data_3V8X # _entry.id 3V8X # _audit_conform.dict_name mmcif_pdbx.dic _audit_conform.dict_version 5.281 _audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic # loop_ _database_2.database_id _database_2.database_code PDB 3V8X RCSB RCSB069743 WWPDB D_1000069743 # loop_ _pdbx_database_related.db_name _pdbx_database_related.db_id _pdbx_database_related.details _pdbx_database_related.content_type PDB 3V89 . unspecified PDB 3V8U . unspecified PDB 3V83 . unspecified # _pdbx_database_status.status_code REL _pdbx_database_status.entry_id 3V8X _pdbx_database_status.recvd_initial_deposition_date 2011-12-23 _pdbx_database_status.deposit_site RCSB _pdbx_database_status.process_site RCSB _pdbx_database_status.status_code_sf REL _pdbx_database_status.status_code_mr ? _pdbx_database_status.SG_entry ? _pdbx_database_status.status_code_cs ? _pdbx_database_status.methods_development_category ? _pdbx_database_status.pdb_format_compatible Y # loop_ _audit_author.name _audit_author.pdbx_ordinal 'Noinaj, N.' 1 'Easley, N.' 2 'Buchanan, S.K.' 3 # _citation.id primary _citation.title 'Structural basis for iron piracy by pathogenic Neisseria.' _citation.journal_abbrev Nature _citation.journal_volume 483 _citation.page_first 53 _citation.page_last 58 _citation.year 2012 _citation.journal_id_ASTM NATUAS _citation.country UK _citation.journal_id_ISSN 0028-0836 _citation.journal_id_CSD 0006 _citation.book_publisher ? _citation.pdbx_database_id_PubMed 22327295 _citation.pdbx_database_id_DOI 10.1038/nature10823 # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Noinaj, N.' 1 primary 'Easley, N.C.' 2 primary 'Oke, M.' 3 primary 'Mizuno, N.' 4 primary 'Gumbart, J.' 5 primary 'Boura, E.' 6 primary 'Steere, A.N.' 7 primary 'Zak, O.' 8 primary 'Aisen, P.' 9 primary 'Tajkhorshid, E.' 10 primary 'Evans, R.W.' 11 primary 'Gorringe, A.R.' 12 primary 'Mason, A.B.' 13 primary 'Steven, A.C.' 14 primary 'Buchanan, S.K.' 15 # _cell.entry_id 3V8X _cell.length_a 91.014 _cell.length_b 129.362 _cell.length_c 198.589 _cell.angle_alpha 90.00 _cell.angle_beta 90.00 _cell.angle_gamma 90.00 _cell.Z_PDB 4 _cell.pdbx_unique_axis ? _cell.length_a_esd ? _cell.length_b_esd ? _cell.length_c_esd ? _cell.angle_alpha_esd ? _cell.angle_beta_esd ? _cell.angle_gamma_esd ? # _symmetry.entry_id 3V8X _symmetry.space_group_name_H-M 'P 21 21 21' _symmetry.pdbx_full_space_group_name_H-M ? _symmetry.cell_setting ? _symmetry.Int_Tables_number 19 _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 'Transferrin-binding protein 1' 101213.328 1 ? M913Y ? ? 2 polymer man Serotransferrin 77153.906 1 ? ? ? ? 3 non-polymer syn '(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE' 306.438 2 ? ? ? ? 4 non-polymer man N-ACETYL-D-GLUCOSAMINE 221.208 8 ? ? ? ? 5 non-polymer man BETA-D-MANNOSE 180.156 2 ? ? ? ? 6 non-polymer man ALPHA-D-MANNOSE 180.156 4 ? ? ? ? 7 non-polymer man BETA-D-GALACTOSE 180.156 3 ? ? ? ? 8 non-polymer man 'O-SIALIC ACID' 309.270 2 ? ? ? ? 9 water nat water 18.015 204 ? ? ? ? # _entity_name_com.entity_id 2 _entity_name_com.name 'Transferrin, Beta-1 metal-binding globulin, Siderophilin' # loop_ _entity_poly.entity_id _entity_poly.type _entity_poly.nstd_linkage _entity_poly.nstd_monomer _entity_poly.pdbx_seq_one_letter_code _entity_poly.pdbx_seq_one_letter_code_can _entity_poly.pdbx_strand_id _entity_poly.pdbx_target_identifier 1 'polypeptide(L)' no no ;MDIHHHHHHHHHHENVQAGQAQEKQLDTIQVKAKKQKTRRDNEVTGLGKLVKSSDTLSKEQVLNIRDLTRYDPGIAVVEQ GRGASSGYSIRGMDKNRVSLTVDGVSQIQSYTAQAALGGTRTAGSSGAINEIEYENVKAVEISKGSNSVEQGSGALAGSV AFQTKTADDVIGEGRQWGIQSKTAYSGKNRGLTQSIALAGRIGGAEALLIHTGRRAGEIRAHEDAGRGVQSFNRLVPVED SSNYAYFIVKEECKNGSYETCKANPKKDVVGKDERQTVSTRDYTGPNRFLADPLSYESRSWLFRPGFRFENKRHYIGGIL EHTQQTFDTRDMTVPAFLTKAVFDANKKQAGSLPGNGKYAGNHKYGGLFTNGENGALVGAEYGTGVFYDETHTKSRYGLE YVYTNADKDTWADYARLSYDRQGVGLDNHFQQTHCSADGSDKYCRPSADKPFSYYKSDRVIYGESHRLLQAAFKKSFDTA KIRHNLSVNLGFDRFGSNLRHQDYYYQHANRAYSSNTPPQNNGKKISPNGSETSPYWVTIGRGNVVTGQICRLGNNTYTD CTPRSINGKSYYAAVRDNVRLGRWADVGAGLRYDYRSTHSDDGSVSTGTHRTLSWNAGIVLKPTDWLDLTYRTSTGFRLP SFAEMYGWRAGVQSKAVKIDPEKSFNKEAGIVFKGDFGNLEASWFNNAYRDLIVRGYEAQIKDGKEEAKGDPAYLNAQSA RITGINILGKIDWNGVWDKLPEGWYSTFAYNRVRVRDIKKRADRTDIQSHLFDAIQPSRYVVGLGYDQPEGKWGVNGMLT YSKAKEITELLGSRALLNGNSRNTKATARRTRPWYIVDVSGYYTVKKHFTLRAGVYNLLNYRYVTWENVRQTAGGAVNQH KNVGVYNRYAAPGRNYTFSLEYKF ; ;MDIHHHHHHHHHHENVQAGQAQEKQLDTIQVKAKKQKTRRDNEVTGLGKLVKSSDTLSKEQVLNIRDLTRYDPGIAVVEQ GRGASSGYSIRGMDKNRVSLTVDGVSQIQSYTAQAALGGTRTAGSSGAINEIEYENVKAVEISKGSNSVEQGSGALAGSV AFQTKTADDVIGEGRQWGIQSKTAYSGKNRGLTQSIALAGRIGGAEALLIHTGRRAGEIRAHEDAGRGVQSFNRLVPVED SSNYAYFIVKEECKNGSYETCKANPKKDVVGKDERQTVSTRDYTGPNRFLADPLSYESRSWLFRPGFRFENKRHYIGGIL EHTQQTFDTRDMTVPAFLTKAVFDANKKQAGSLPGNGKYAGNHKYGGLFTNGENGALVGAEYGTGVFYDETHTKSRYGLE YVYTNADKDTWADYARLSYDRQGVGLDNHFQQTHCSADGSDKYCRPSADKPFSYYKSDRVIYGESHRLLQAAFKKSFDTA KIRHNLSVNLGFDRFGSNLRHQDYYYQHANRAYSSNTPPQNNGKKISPNGSETSPYWVTIGRGNVVTGQICRLGNNTYTD CTPRSINGKSYYAAVRDNVRLGRWADVGAGLRYDYRSTHSDDGSVSTGTHRTLSWNAGIVLKPTDWLDLTYRTSTGFRLP SFAEMYGWRAGVQSKAVKIDPEKSFNKEAGIVFKGDFGNLEASWFNNAYRDLIVRGYEAQIKDGKEEAKGDPAYLNAQSA RITGINILGKIDWNGVWDKLPEGWYSTFAYNRVRVRDIKKRADRTDIQSHLFDAIQPSRYVVGLGYDQPEGKWGVNGMLT YSKAKEITELLGSRALLNGNSRNTKATARRTRPWYIVDVSGYYTVKKHFTLRAGVYNLLNYRYVTWENVRQTAGGAVNQH KNVGVYNRYAAPGRNYTFSLEYKF ; A ? 2 'polypeptide(L)' no no ;MRLAVGALLVCAVLGLCLAVPDKTVRWCAVSEHEATKCQSFRDHMKSVIPSDGPSVACVKKASYLDCIRAIAANEADAVT LDAGLVYDAYLAPNNLKPVVAEFYGSKEDPQTFYYAVAVVKKDSGFQMNQLRGKKSCHTGLGRSAGWNIPIGLLYCDLPE PRKPLEKAVANFFSGSCAPCADGTDFPQLCQLCPGCGCSTLNQYFGYSGAFKCLKDGAGDVAFVKHSTIFENLANKADRD QYELLCLDNTRKPVDEYKDCHLAQVPSHTVVARSMGGKEDLIWELLNQAQEHFGKDKSKEFQLFSSPHGKDLLFKDSAHG FLKVPPRMDAKMYLGYEYVTAIRNLREGTCPEAPTDECKPVKWCALSHHERLKCDEWSVNSVGKIECVSAETTEDCIAKI MNGEADAMSLDGGFVYIAGKCGLVPVLAENYNKSDNCEDTPEAGYFAVAVVKKSASDLTWDNLKGKKSCHTAVGRTAGWN IPMGLLYNKINHCRFDEFFSEGCAPGSKKDSSLCKLCMGSGLNLCEPNNKEGYYGYTGAFRCLVEKGDVAFVKHQTVPQN TGGKNPDPWAKNLNEKDYELLCLDGTRKPVEEYANCHLARAPNHAVVTRKDKEACVHKILRQQQHLFGSNVTDCSGNFCL FRSETKDLLFRDDTVCLAKLHDRNTYEKYLGEEYVKAVGNLRKCSTSSLLEACTFRRP ; ;MRLAVGALLVCAVLGLCLAVPDKTVRWCAVSEHEATKCQSFRDHMKSVIPSDGPSVACVKKASYLDCIRAIAANEADAVT LDAGLVYDAYLAPNNLKPVVAEFYGSKEDPQTFYYAVAVVKKDSGFQMNQLRGKKSCHTGLGRSAGWNIPIGLLYCDLPE PRKPLEKAVANFFSGSCAPCADGTDFPQLCQLCPGCGCSTLNQYFGYSGAFKCLKDGAGDVAFVKHSTIFENLANKADRD QYELLCLDNTRKPVDEYKDCHLAQVPSHTVVARSMGGKEDLIWELLNQAQEHFGKDKSKEFQLFSSPHGKDLLFKDSAHG FLKVPPRMDAKMYLGYEYVTAIRNLREGTCPEAPTDECKPVKWCALSHHERLKCDEWSVNSVGKIECVSAETTEDCIAKI MNGEADAMSLDGGFVYIAGKCGLVPVLAENYNKSDNCEDTPEAGYFAVAVVKKSASDLTWDNLKGKKSCHTAVGRTAGWN IPMGLLYNKINHCRFDEFFSEGCAPGSKKDSSLCKLCMGSGLNLCEPNNKEGYYGYTGAFRCLVEKGDVAFVKHQTVPQN TGGKNPDPWAKNLNEKDYELLCLDGTRKPVEEYANCHLARAPNHAVVTRKDKEACVHKILRQQQHLFGSNVTDCSGNFCL FRSETKDLLFRDDTVCLAKLHDRNTYEKYLGEEYVKAVGNLRKCSTSSLLEACTFRRP ; B ? # loop_ _entity_poly_seq.entity_id _entity_poly_seq.num _entity_poly_seq.mon_id _entity_poly_seq.hetero 1 1 MET n 1 2 ASP n 1 3 ILE n 1 4 HIS n 1 5 HIS n 1 6 HIS n 1 7 HIS n 1 8 HIS n 1 9 HIS n 1 10 HIS n 1 11 HIS n 1 12 HIS n 1 13 HIS n 1 14 GLU n 1 15 ASN n 1 16 VAL n 1 17 GLN n 1 18 ALA n 1 19 GLY n 1 20 GLN n 1 21 ALA n 1 22 GLN n 1 23 GLU n 1 24 LYS n 1 25 GLN n 1 26 LEU n 1 27 ASP n 1 28 THR n 1 29 ILE n 1 30 GLN n 1 31 VAL n 1 32 LYS n 1 33 ALA n 1 34 LYS n 1 35 LYS n 1 36 GLN n 1 37 LYS n 1 38 THR n 1 39 ARG n 1 40 ARG n 1 41 ASP n 1 42 ASN n 1 43 GLU n 1 44 VAL n 1 45 THR n 1 46 GLY n 1 47 LEU n 1 48 GLY n 1 49 LYS n 1 50 LEU n 1 51 VAL n 1 52 LYS n 1 53 SER n 1 54 SER n 1 55 ASP n 1 56 THR n 1 57 LEU n 1 58 SER n 1 59 LYS n 1 60 GLU n 1 61 GLN n 1 62 VAL n 1 63 LEU n 1 64 ASN n 1 65 ILE n 1 66 ARG n 1 67 ASP n 1 68 LEU n 1 69 THR n 1 70 ARG n 1 71 TYR n 1 72 ASP n 1 73 PRO n 1 74 GLY n 1 75 ILE n 1 76 ALA n 1 77 VAL n 1 78 VAL n 1 79 GLU n 1 80 GLN n 1 81 GLY n 1 82 ARG n 1 83 GLY n 1 84 ALA n 1 85 SER n 1 86 SER n 1 87 GLY n 1 88 TYR n 1 89 SER n 1 90 ILE n 1 91 ARG n 1 92 GLY n 1 93 MET n 1 94 ASP n 1 95 LYS n 1 96 ASN n 1 97 ARG n 1 98 VAL n 1 99 SER n 1 100 LEU n 1 101 THR n 1 102 VAL n 1 103 ASP n 1 104 GLY n 1 105 VAL n 1 106 SER n 1 107 GLN n 1 108 ILE n 1 109 GLN n 1 110 SER n 1 111 TYR n 1 112 THR n 1 113 ALA n 1 114 GLN n 1 115 ALA n 1 116 ALA n 1 117 LEU n 1 118 GLY n 1 119 GLY n 1 120 THR n 1 121 ARG n 1 122 THR n 1 123 ALA n 1 124 GLY n 1 125 SER n 1 126 SER n 1 127 GLY n 1 128 ALA n 1 129 ILE n 1 130 ASN n 1 131 GLU n 1 132 ILE n 1 133 GLU n 1 134 TYR n 1 135 GLU n 1 136 ASN n 1 137 VAL n 1 138 LYS n 1 139 ALA n 1 140 VAL n 1 141 GLU n 1 142 ILE n 1 143 SER n 1 144 LYS n 1 145 GLY n 1 146 SER n 1 147 ASN n 1 148 SER n 1 149 VAL n 1 150 GLU n 1 151 GLN n 1 152 GLY n 1 153 SER n 1 154 GLY n 1 155 ALA n 1 156 LEU n 1 157 ALA n 1 158 GLY n 1 159 SER n 1 160 VAL n 1 161 ALA n 1 162 PHE n 1 163 GLN n 1 164 THR n 1 165 LYS n 1 166 THR n 1 167 ALA n 1 168 ASP n 1 169 ASP n 1 170 VAL n 1 171 ILE n 1 172 GLY n 1 173 GLU n 1 174 GLY n 1 175 ARG n 1 176 GLN n 1 177 TRP n 1 178 GLY n 1 179 ILE n 1 180 GLN n 1 181 SER n 1 182 LYS n 1 183 THR n 1 184 ALA n 1 185 TYR n 1 186 SER n 1 187 GLY n 1 188 LYS n 1 189 ASN n 1 190 ARG n 1 191 GLY n 1 192 LEU n 1 193 THR n 1 194 GLN n 1 195 SER n 1 196 ILE n 1 197 ALA n 1 198 LEU n 1 199 ALA n 1 200 GLY n 1 201 ARG n 1 202 ILE n 1 203 GLY n 1 204 GLY n 1 205 ALA n 1 206 GLU n 1 207 ALA n 1 208 LEU n 1 209 LEU n 1 210 ILE n 1 211 HIS n 1 212 THR n 1 213 GLY n 1 214 ARG n 1 215 ARG n 1 216 ALA n 1 217 GLY n 1 218 GLU n 1 219 ILE n 1 220 ARG n 1 221 ALA n 1 222 HIS n 1 223 GLU n 1 224 ASP n 1 225 ALA n 1 226 GLY n 1 227 ARG n 1 228 GLY n 1 229 VAL n 1 230 GLN n 1 231 SER n 1 232 PHE n 1 233 ASN n 1 234 ARG n 1 235 LEU n 1 236 VAL n 1 237 PRO n 1 238 VAL n 1 239 GLU n 1 240 ASP n 1 241 SER n 1 242 SER n 1 243 ASN n 1 244 TYR n 1 245 ALA n 1 246 TYR n 1 247 PHE n 1 248 ILE n 1 249 VAL n 1 250 LYS n 1 251 GLU n 1 252 GLU n 1 253 CYS n 1 254 LYS n 1 255 ASN n 1 256 GLY n 1 257 SER n 1 258 TYR n 1 259 GLU n 1 260 THR n 1 261 CYS n 1 262 LYS n 1 263 ALA n 1 264 ASN n 1 265 PRO n 1 266 LYS n 1 267 LYS n 1 268 ASP n 1 269 VAL n 1 270 VAL n 1 271 GLY n 1 272 LYS n 1 273 ASP n 1 274 GLU n 1 275 ARG n 1 276 GLN n 1 277 THR n 1 278 VAL n 1 279 SER n 1 280 THR n 1 281 ARG n 1 282 ASP n 1 283 TYR n 1 284 THR n 1 285 GLY n 1 286 PRO n 1 287 ASN n 1 288 ARG n 1 289 PHE n 1 290 LEU n 1 291 ALA n 1 292 ASP n 1 293 PRO n 1 294 LEU n 1 295 SER n 1 296 TYR n 1 297 GLU n 1 298 SER n 1 299 ARG n 1 300 SER n 1 301 TRP n 1 302 LEU n 1 303 PHE n 1 304 ARG n 1 305 PRO n 1 306 GLY n 1 307 PHE n 1 308 ARG n 1 309 PHE n 1 310 GLU n 1 311 ASN n 1 312 LYS n 1 313 ARG n 1 314 HIS n 1 315 TYR n 1 316 ILE n 1 317 GLY n 1 318 GLY n 1 319 ILE n 1 320 LEU n 1 321 GLU n 1 322 HIS n 1 323 THR n 1 324 GLN n 1 325 GLN n 1 326 THR n 1 327 PHE n 1 328 ASP n 1 329 THR n 1 330 ARG n 1 331 ASP n 1 332 MET n 1 333 THR n 1 334 VAL n 1 335 PRO n 1 336 ALA n 1 337 PHE n 1 338 LEU n 1 339 THR n 1 340 LYS n 1 341 ALA n 1 342 VAL n 1 343 PHE n 1 344 ASP n 1 345 ALA n 1 346 ASN n 1 347 LYS n 1 348 LYS n 1 349 GLN n 1 350 ALA n 1 351 GLY n 1 352 SER n 1 353 LEU n 1 354 PRO n 1 355 GLY n 1 356 ASN n 1 357 GLY n 1 358 LYS n 1 359 TYR n 1 360 ALA n 1 361 GLY n 1 362 ASN n 1 363 HIS n 1 364 LYS n 1 365 TYR n 1 366 GLY n 1 367 GLY n 1 368 LEU n 1 369 PHE n 1 370 THR n 1 371 ASN n 1 372 GLY n 1 373 GLU n 1 374 ASN n 1 375 GLY n 1 376 ALA n 1 377 LEU n 1 378 VAL n 1 379 GLY n 1 380 ALA n 1 381 GLU n 1 382 TYR n 1 383 GLY n 1 384 THR n 1 385 GLY n 1 386 VAL n 1 387 PHE n 1 388 TYR n 1 389 ASP n 1 390 GLU n 1 391 THR n 1 392 HIS n 1 393 THR n 1 394 LYS n 1 395 SER n 1 396 ARG n 1 397 TYR n 1 398 GLY n 1 399 LEU n 1 400 GLU n 1 401 TYR n 1 402 VAL n 1 403 TYR n 1 404 THR n 1 405 ASN n 1 406 ALA n 1 407 ASP n 1 408 LYS n 1 409 ASP n 1 410 THR n 1 411 TRP n 1 412 ALA n 1 413 ASP n 1 414 TYR n 1 415 ALA n 1 416 ARG n 1 417 LEU n 1 418 SER n 1 419 TYR n 1 420 ASP n 1 421 ARG n 1 422 GLN n 1 423 GLY n 1 424 VAL n 1 425 GLY n 1 426 LEU n 1 427 ASP n 1 428 ASN n 1 429 HIS n 1 430 PHE n 1 431 GLN n 1 432 GLN n 1 433 THR n 1 434 HIS n 1 435 CYS n 1 436 SER n 1 437 ALA n 1 438 ASP n 1 439 GLY n 1 440 SER n 1 441 ASP n 1 442 LYS n 1 443 TYR n 1 444 CYS n 1 445 ARG n 1 446 PRO n 1 447 SER n 1 448 ALA n 1 449 ASP n 1 450 LYS n 1 451 PRO n 1 452 PHE n 1 453 SER n 1 454 TYR n 1 455 TYR n 1 456 LYS n 1 457 SER n 1 458 ASP n 1 459 ARG n 1 460 VAL n 1 461 ILE n 1 462 TYR n 1 463 GLY n 1 464 GLU n 1 465 SER n 1 466 HIS n 1 467 ARG n 1 468 LEU n 1 469 LEU n 1 470 GLN n 1 471 ALA n 1 472 ALA n 1 473 PHE n 1 474 LYS n 1 475 LYS n 1 476 SER n 1 477 PHE n 1 478 ASP n 1 479 THR n 1 480 ALA n 1 481 LYS n 1 482 ILE n 1 483 ARG n 1 484 HIS n 1 485 ASN n 1 486 LEU n 1 487 SER n 1 488 VAL n 1 489 ASN n 1 490 LEU n 1 491 GLY n 1 492 PHE n 1 493 ASP n 1 494 ARG n 1 495 PHE n 1 496 GLY n 1 497 SER n 1 498 ASN n 1 499 LEU n 1 500 ARG n 1 501 HIS n 1 502 GLN n 1 503 ASP n 1 504 TYR n 1 505 TYR n 1 506 TYR n 1 507 GLN n 1 508 HIS n 1 509 ALA n 1 510 ASN n 1 511 ARG n 1 512 ALA n 1 513 TYR n 1 514 SER n 1 515 SER n 1 516 ASN n 1 517 THR n 1 518 PRO n 1 519 PRO n 1 520 GLN n 1 521 ASN n 1 522 ASN n 1 523 GLY n 1 524 LYS n 1 525 LYS n 1 526 ILE n 1 527 SER n 1 528 PRO n 1 529 ASN n 1 530 GLY n 1 531 SER n 1 532 GLU n 1 533 THR n 1 534 SER n 1 535 PRO n 1 536 TYR n 1 537 TRP n 1 538 VAL n 1 539 THR n 1 540 ILE n 1 541 GLY n 1 542 ARG n 1 543 GLY n 1 544 ASN n 1 545 VAL n 1 546 VAL n 1 547 THR n 1 548 GLY n 1 549 GLN n 1 550 ILE n 1 551 CYS n 1 552 ARG n 1 553 LEU n 1 554 GLY n 1 555 ASN n 1 556 ASN n 1 557 THR n 1 558 TYR n 1 559 THR n 1 560 ASP n 1 561 CYS n 1 562 THR n 1 563 PRO n 1 564 ARG n 1 565 SER n 1 566 ILE n 1 567 ASN n 1 568 GLY n 1 569 LYS n 1 570 SER n 1 571 TYR n 1 572 TYR n 1 573 ALA n 1 574 ALA n 1 575 VAL n 1 576 ARG n 1 577 ASP n 1 578 ASN n 1 579 VAL n 1 580 ARG n 1 581 LEU n 1 582 GLY n 1 583 ARG n 1 584 TRP n 1 585 ALA n 1 586 ASP n 1 587 VAL n 1 588 GLY n 1 589 ALA n 1 590 GLY n 1 591 LEU n 1 592 ARG n 1 593 TYR n 1 594 ASP n 1 595 TYR n 1 596 ARG n 1 597 SER n 1 598 THR n 1 599 HIS n 1 600 SER n 1 601 ASP n 1 602 ASP n 1 603 GLY n 1 604 SER n 1 605 VAL n 1 606 SER n 1 607 THR n 1 608 GLY n 1 609 THR n 1 610 HIS n 1 611 ARG n 1 612 THR n 1 613 LEU n 1 614 SER n 1 615 TRP n 1 616 ASN n 1 617 ALA n 1 618 GLY n 1 619 ILE n 1 620 VAL n 1 621 LEU n 1 622 LYS n 1 623 PRO n 1 624 THR n 1 625 ASP n 1 626 TRP n 1 627 LEU n 1 628 ASP n 1 629 LEU n 1 630 THR n 1 631 TYR n 1 632 ARG n 1 633 THR n 1 634 SER n 1 635 THR n 1 636 GLY n 1 637 PHE n 1 638 ARG n 1 639 LEU n 1 640 PRO n 1 641 SER n 1 642 PHE n 1 643 ALA n 1 644 GLU n 1 645 MET n 1 646 TYR n 1 647 GLY n 1 648 TRP n 1 649 ARG n 1 650 ALA n 1 651 GLY n 1 652 VAL n 1 653 GLN n 1 654 SER n 1 655 LYS n 1 656 ALA n 1 657 VAL n 1 658 LYS n 1 659 ILE n 1 660 ASP n 1 661 PRO n 1 662 GLU n 1 663 LYS n 1 664 SER n 1 665 PHE n 1 666 ASN n 1 667 LYS n 1 668 GLU n 1 669 ALA n 1 670 GLY n 1 671 ILE n 1 672 VAL n 1 673 PHE n 1 674 LYS n 1 675 GLY n 1 676 ASP n 1 677 PHE n 1 678 GLY n 1 679 ASN n 1 680 LEU n 1 681 GLU n 1 682 ALA n 1 683 SER n 1 684 TRP n 1 685 PHE n 1 686 ASN n 1 687 ASN n 1 688 ALA n 1 689 TYR n 1 690 ARG n 1 691 ASP n 1 692 LEU n 1 693 ILE n 1 694 VAL n 1 695 ARG n 1 696 GLY n 1 697 TYR n 1 698 GLU n 1 699 ALA n 1 700 GLN n 1 701 ILE n 1 702 LYS n 1 703 ASP n 1 704 GLY n 1 705 LYS n 1 706 GLU n 1 707 GLU n 1 708 ALA n 1 709 LYS n 1 710 GLY n 1 711 ASP n 1 712 PRO n 1 713 ALA n 1 714 TYR n 1 715 LEU n 1 716 ASN n 1 717 ALA n 1 718 GLN n 1 719 SER n 1 720 ALA n 1 721 ARG n 1 722 ILE n 1 723 THR n 1 724 GLY n 1 725 ILE n 1 726 ASN n 1 727 ILE n 1 728 LEU n 1 729 GLY n 1 730 LYS n 1 731 ILE n 1 732 ASP n 1 733 TRP n 1 734 ASN n 1 735 GLY n 1 736 VAL n 1 737 TRP n 1 738 ASP n 1 739 LYS n 1 740 LEU n 1 741 PRO n 1 742 GLU n 1 743 GLY n 1 744 TRP n 1 745 TYR n 1 746 SER n 1 747 THR n 1 748 PHE n 1 749 ALA n 1 750 TYR n 1 751 ASN n 1 752 ARG n 1 753 VAL n 1 754 ARG n 1 755 VAL n 1 756 ARG n 1 757 ASP n 1 758 ILE n 1 759 LYS n 1 760 LYS n 1 761 ARG n 1 762 ALA n 1 763 ASP n 1 764 ARG n 1 765 THR n 1 766 ASP n 1 767 ILE n 1 768 GLN n 1 769 SER n 1 770 HIS n 1 771 LEU n 1 772 PHE n 1 773 ASP n 1 774 ALA n 1 775 ILE n 1 776 GLN n 1 777 PRO n 1 778 SER n 1 779 ARG n 1 780 TYR n 1 781 VAL n 1 782 VAL n 1 783 GLY n 1 784 LEU n 1 785 GLY n 1 786 TYR n 1 787 ASP n 1 788 GLN n 1 789 PRO n 1 790 GLU n 1 791 GLY n 1 792 LYS n 1 793 TRP n 1 794 GLY n 1 795 VAL n 1 796 ASN n 1 797 GLY n 1 798 MET n 1 799 LEU n 1 800 THR n 1 801 TYR n 1 802 SER n 1 803 LYS n 1 804 ALA n 1 805 LYS n 1 806 GLU n 1 807 ILE n 1 808 THR n 1 809 GLU n 1 810 LEU n 1 811 LEU n 1 812 GLY n 1 813 SER n 1 814 ARG n 1 815 ALA n 1 816 LEU n 1 817 LEU n 1 818 ASN n 1 819 GLY n 1 820 ASN n 1 821 SER n 1 822 ARG n 1 823 ASN n 1 824 THR n 1 825 LYS n 1 826 ALA n 1 827 THR n 1 828 ALA n 1 829 ARG n 1 830 ARG n 1 831 THR n 1 832 ARG n 1 833 PRO n 1 834 TRP n 1 835 TYR n 1 836 ILE n 1 837 VAL n 1 838 ASP n 1 839 VAL n 1 840 SER n 1 841 GLY n 1 842 TYR n 1 843 TYR n 1 844 THR n 1 845 VAL n 1 846 LYS n 1 847 LYS n 1 848 HIS n 1 849 PHE n 1 850 THR n 1 851 LEU n 1 852 ARG n 1 853 ALA n 1 854 GLY n 1 855 VAL n 1 856 TYR n 1 857 ASN n 1 858 LEU n 1 859 LEU n 1 860 ASN n 1 861 TYR n 1 862 ARG n 1 863 TYR n 1 864 VAL n 1 865 THR n 1 866 TRP n 1 867 GLU n 1 868 ASN n 1 869 VAL n 1 870 ARG n 1 871 GLN n 1 872 THR n 1 873 ALA n 1 874 GLY n 1 875 GLY n 1 876 ALA n 1 877 VAL n 1 878 ASN n 1 879 GLN n 1 880 HIS n 1 881 LYS n 1 882 ASN n 1 883 VAL n 1 884 GLY n 1 885 VAL n 1 886 TYR n 1 887 ASN n 1 888 ARG n 1 889 TYR n 1 890 ALA n 1 891 ALA n 1 892 PRO n 1 893 GLY n 1 894 ARG n 1 895 ASN n 1 896 TYR n 1 897 THR n 1 898 PHE n 1 899 SER n 1 900 LEU n 1 901 GLU n 1 902 TYR n 1 903 LYS n 1 904 PHE n 2 1 MET n 2 2 ARG n 2 3 LEU n 2 4 ALA n 2 5 VAL n 2 6 GLY n 2 7 ALA n 2 8 LEU n 2 9 LEU n 2 10 VAL n 2 11 CYS n 2 12 ALA n 2 13 VAL n 2 14 LEU n 2 15 GLY n 2 16 LEU n 2 17 CYS n 2 18 LEU n 2 19 ALA n 2 20 VAL n 2 21 PRO n 2 22 ASP n 2 23 LYS n 2 24 THR n 2 25 VAL n 2 26 ARG n 2 27 TRP n 2 28 CYS n 2 29 ALA n 2 30 VAL n 2 31 SER n 2 32 GLU n 2 33 HIS n 2 34 GLU n 2 35 ALA n 2 36 THR n 2 37 LYS n 2 38 CYS n 2 39 GLN n 2 40 SER n 2 41 PHE n 2 42 ARG n 2 43 ASP n 2 44 HIS n 2 45 MET n 2 46 LYS n 2 47 SER n 2 48 VAL n 2 49 ILE n 2 50 PRO n 2 51 SER n 2 52 ASP n 2 53 GLY n 2 54 PRO n 2 55 SER n 2 56 VAL n 2 57 ALA n 2 58 CYS n 2 59 VAL n 2 60 LYS n 2 61 LYS n 2 62 ALA n 2 63 SER n 2 64 TYR n 2 65 LEU n 2 66 ASP n 2 67 CYS n 2 68 ILE n 2 69 ARG n 2 70 ALA n 2 71 ILE n 2 72 ALA n 2 73 ALA n 2 74 ASN n 2 75 GLU n 2 76 ALA n 2 77 ASP n 2 78 ALA n 2 79 VAL n 2 80 THR n 2 81 LEU n 2 82 ASP n 2 83 ALA n 2 84 GLY n 2 85 LEU n 2 86 VAL n 2 87 TYR n 2 88 ASP n 2 89 ALA n 2 90 TYR n 2 91 LEU n 2 92 ALA n 2 93 PRO n 2 94 ASN n 2 95 ASN n 2 96 LEU n 2 97 LYS n 2 98 PRO n 2 99 VAL n 2 100 VAL n 2 101 ALA n 2 102 GLU n 2 103 PHE n 2 104 TYR n 2 105 GLY n 2 106 SER n 2 107 LYS n 2 108 GLU n 2 109 ASP n 2 110 PRO n 2 111 GLN n 2 112 THR n 2 113 PHE n 2 114 TYR n 2 115 TYR n 2 116 ALA n 2 117 VAL n 2 118 ALA n 2 119 VAL n 2 120 VAL n 2 121 LYS n 2 122 LYS n 2 123 ASP n 2 124 SER n 2 125 GLY n 2 126 PHE n 2 127 GLN n 2 128 MET n 2 129 ASN n 2 130 GLN n 2 131 LEU n 2 132 ARG n 2 133 GLY n 2 134 LYS n 2 135 LYS n 2 136 SER n 2 137 CYS n 2 138 HIS n 2 139 THR n 2 140 GLY n 2 141 LEU n 2 142 GLY n 2 143 ARG n 2 144 SER n 2 145 ALA n 2 146 GLY n 2 147 TRP n 2 148 ASN n 2 149 ILE n 2 150 PRO n 2 151 ILE n 2 152 GLY n 2 153 LEU n 2 154 LEU n 2 155 TYR n 2 156 CYS n 2 157 ASP n 2 158 LEU n 2 159 PRO n 2 160 GLU n 2 161 PRO n 2 162 ARG n 2 163 LYS n 2 164 PRO n 2 165 LEU n 2 166 GLU n 2 167 LYS n 2 168 ALA n 2 169 VAL n 2 170 ALA n 2 171 ASN n 2 172 PHE n 2 173 PHE n 2 174 SER n 2 175 GLY n 2 176 SER n 2 177 CYS n 2 178 ALA n 2 179 PRO n 2 180 CYS n 2 181 ALA n 2 182 ASP n 2 183 GLY n 2 184 THR n 2 185 ASP n 2 186 PHE n 2 187 PRO n 2 188 GLN n 2 189 LEU n 2 190 CYS n 2 191 GLN n 2 192 LEU n 2 193 CYS n 2 194 PRO n 2 195 GLY n 2 196 CYS n 2 197 GLY n 2 198 CYS n 2 199 SER n 2 200 THR n 2 201 LEU n 2 202 ASN n 2 203 GLN n 2 204 TYR n 2 205 PHE n 2 206 GLY n 2 207 TYR n 2 208 SER n 2 209 GLY n 2 210 ALA n 2 211 PHE n 2 212 LYS n 2 213 CYS n 2 214 LEU n 2 215 LYS n 2 216 ASP n 2 217 GLY n 2 218 ALA n 2 219 GLY n 2 220 ASP n 2 221 VAL n 2 222 ALA n 2 223 PHE n 2 224 VAL n 2 225 LYS n 2 226 HIS n 2 227 SER n 2 228 THR n 2 229 ILE n 2 230 PHE n 2 231 GLU n 2 232 ASN n 2 233 LEU n 2 234 ALA n 2 235 ASN n 2 236 LYS n 2 237 ALA n 2 238 ASP n 2 239 ARG n 2 240 ASP n 2 241 GLN n 2 242 TYR n 2 243 GLU n 2 244 LEU n 2 245 LEU n 2 246 CYS n 2 247 LEU n 2 248 ASP n 2 249 ASN n 2 250 THR n 2 251 ARG n 2 252 LYS n 2 253 PRO n 2 254 VAL n 2 255 ASP n 2 256 GLU n 2 257 TYR n 2 258 LYS n 2 259 ASP n 2 260 CYS n 2 261 HIS n 2 262 LEU n 2 263 ALA n 2 264 GLN n 2 265 VAL n 2 266 PRO n 2 267 SER n 2 268 HIS n 2 269 THR n 2 270 VAL n 2 271 VAL n 2 272 ALA n 2 273 ARG n 2 274 SER n 2 275 MET n 2 276 GLY n 2 277 GLY n 2 278 LYS n 2 279 GLU n 2 280 ASP n 2 281 LEU n 2 282 ILE n 2 283 TRP n 2 284 GLU n 2 285 LEU n 2 286 LEU n 2 287 ASN n 2 288 GLN n 2 289 ALA n 2 290 GLN n 2 291 GLU n 2 292 HIS n 2 293 PHE n 2 294 GLY n 2 295 LYS n 2 296 ASP n 2 297 LYS n 2 298 SER n 2 299 LYS n 2 300 GLU n 2 301 PHE n 2 302 GLN n 2 303 LEU n 2 304 PHE n 2 305 SER n 2 306 SER n 2 307 PRO n 2 308 HIS n 2 309 GLY n 2 310 LYS n 2 311 ASP n 2 312 LEU n 2 313 LEU n 2 314 PHE n 2 315 LYS n 2 316 ASP n 2 317 SER n 2 318 ALA n 2 319 HIS n 2 320 GLY n 2 321 PHE n 2 322 LEU n 2 323 LYS n 2 324 VAL n 2 325 PRO n 2 326 PRO n 2 327 ARG n 2 328 MET n 2 329 ASP n 2 330 ALA n 2 331 LYS n 2 332 MET n 2 333 TYR n 2 334 LEU n 2 335 GLY n 2 336 TYR n 2 337 GLU n 2 338 TYR n 2 339 VAL n 2 340 THR n 2 341 ALA n 2 342 ILE n 2 343 ARG n 2 344 ASN n 2 345 LEU n 2 346 ARG n 2 347 GLU n 2 348 GLY n 2 349 THR n 2 350 CYS n 2 351 PRO n 2 352 GLU n 2 353 ALA n 2 354 PRO n 2 355 THR n 2 356 ASP n 2 357 GLU n 2 358 CYS n 2 359 LYS n 2 360 PRO n 2 361 VAL n 2 362 LYS n 2 363 TRP n 2 364 CYS n 2 365 ALA n 2 366 LEU n 2 367 SER n 2 368 HIS n 2 369 HIS n 2 370 GLU n 2 371 ARG n 2 372 LEU n 2 373 LYS n 2 374 CYS n 2 375 ASP n 2 376 GLU n 2 377 TRP n 2 378 SER n 2 379 VAL n 2 380 ASN n 2 381 SER n 2 382 VAL n 2 383 GLY n 2 384 LYS n 2 385 ILE n 2 386 GLU n 2 387 CYS n 2 388 VAL n 2 389 SER n 2 390 ALA n 2 391 GLU n 2 392 THR n 2 393 THR n 2 394 GLU n 2 395 ASP n 2 396 CYS n 2 397 ILE n 2 398 ALA n 2 399 LYS n 2 400 ILE n 2 401 MET n 2 402 ASN n 2 403 GLY n 2 404 GLU n 2 405 ALA n 2 406 ASP n 2 407 ALA n 2 408 MET n 2 409 SER n 2 410 LEU n 2 411 ASP n 2 412 GLY n 2 413 GLY n 2 414 PHE n 2 415 VAL n 2 416 TYR n 2 417 ILE n 2 418 ALA n 2 419 GLY n 2 420 LYS n 2 421 CYS n 2 422 GLY n 2 423 LEU n 2 424 VAL n 2 425 PRO n 2 426 VAL n 2 427 LEU n 2 428 ALA n 2 429 GLU n 2 430 ASN n 2 431 TYR n 2 432 ASN n 2 433 LYS n 2 434 SER n 2 435 ASP n 2 436 ASN n 2 437 CYS n 2 438 GLU n 2 439 ASP n 2 440 THR n 2 441 PRO n 2 442 GLU n 2 443 ALA n 2 444 GLY n 2 445 TYR n 2 446 PHE n 2 447 ALA n 2 448 VAL n 2 449 ALA n 2 450 VAL n 2 451 VAL n 2 452 LYS n 2 453 LYS n 2 454 SER n 2 455 ALA n 2 456 SER n 2 457 ASP n 2 458 LEU n 2 459 THR n 2 460 TRP n 2 461 ASP n 2 462 ASN n 2 463 LEU n 2 464 LYS n 2 465 GLY n 2 466 LYS n 2 467 LYS n 2 468 SER n 2 469 CYS n 2 470 HIS n 2 471 THR n 2 472 ALA n 2 473 VAL n 2 474 GLY n 2 475 ARG n 2 476 THR n 2 477 ALA n 2 478 GLY n 2 479 TRP n 2 480 ASN n 2 481 ILE n 2 482 PRO n 2 483 MET n 2 484 GLY n 2 485 LEU n 2 486 LEU n 2 487 TYR n 2 488 ASN n 2 489 LYS n 2 490 ILE n 2 491 ASN n 2 492 HIS n 2 493 CYS n 2 494 ARG n 2 495 PHE n 2 496 ASP n 2 497 GLU n 2 498 PHE n 2 499 PHE n 2 500 SER n 2 501 GLU n 2 502 GLY n 2 503 CYS n 2 504 ALA n 2 505 PRO n 2 506 GLY n 2 507 SER n 2 508 LYS n 2 509 LYS n 2 510 ASP n 2 511 SER n 2 512 SER n 2 513 LEU n 2 514 CYS n 2 515 LYS n 2 516 LEU n 2 517 CYS n 2 518 MET n 2 519 GLY n 2 520 SER n 2 521 GLY n 2 522 LEU n 2 523 ASN n 2 524 LEU n 2 525 CYS n 2 526 GLU n 2 527 PRO n 2 528 ASN n 2 529 ASN n 2 530 LYS n 2 531 GLU n 2 532 GLY n 2 533 TYR n 2 534 TYR n 2 535 GLY n 2 536 TYR n 2 537 THR n 2 538 GLY n 2 539 ALA n 2 540 PHE n 2 541 ARG n 2 542 CYS n 2 543 LEU n 2 544 VAL n 2 545 GLU n 2 546 LYS n 2 547 GLY n 2 548 ASP n 2 549 VAL n 2 550 ALA n 2 551 PHE n 2 552 VAL n 2 553 LYS n 2 554 HIS n 2 555 GLN n 2 556 THR n 2 557 VAL n 2 558 PRO n 2 559 GLN n 2 560 ASN n 2 561 THR n 2 562 GLY n 2 563 GLY n 2 564 LYS n 2 565 ASN n 2 566 PRO n 2 567 ASP n 2 568 PRO n 2 569 TRP n 2 570 ALA n 2 571 LYS n 2 572 ASN n 2 573 LEU n 2 574 ASN n 2 575 GLU n 2 576 LYS n 2 577 ASP n 2 578 TYR n 2 579 GLU n 2 580 LEU n 2 581 LEU n 2 582 CYS n 2 583 LEU n 2 584 ASP n 2 585 GLY n 2 586 THR n 2 587 ARG n 2 588 LYS n 2 589 PRO n 2 590 VAL n 2 591 GLU n 2 592 GLU n 2 593 TYR n 2 594 ALA n 2 595 ASN n 2 596 CYS n 2 597 HIS n 2 598 LEU n 2 599 ALA n 2 600 ARG n 2 601 ALA n 2 602 PRO n 2 603 ASN n 2 604 HIS n 2 605 ALA n 2 606 VAL n 2 607 VAL n 2 608 THR n 2 609 ARG n 2 610 LYS n 2 611 ASP n 2 612 LYS n 2 613 GLU n 2 614 ALA n 2 615 CYS n 2 616 VAL n 2 617 HIS n 2 618 LYS n 2 619 ILE n 2 620 LEU n 2 621 ARG n 2 622 GLN n 2 623 GLN n 2 624 GLN n 2 625 HIS n 2 626 LEU n 2 627 PHE n 2 628 GLY n 2 629 SER n 2 630 ASN n 2 631 VAL n 2 632 THR n 2 633 ASP n 2 634 CYS n 2 635 SER n 2 636 GLY n 2 637 ASN n 2 638 PHE n 2 639 CYS n 2 640 LEU n 2 641 PHE n 2 642 ARG n 2 643 SER n 2 644 GLU n 2 645 THR n 2 646 LYS n 2 647 ASP n 2 648 LEU n 2 649 LEU n 2 650 PHE n 2 651 ARG n 2 652 ASP n 2 653 ASP n 2 654 THR n 2 655 VAL n 2 656 CYS n 2 657 LEU n 2 658 ALA n 2 659 LYS n 2 660 LEU n 2 661 HIS n 2 662 ASP n 2 663 ARG n 2 664 ASN n 2 665 THR n 2 666 TYR n 2 667 GLU n 2 668 LYS n 2 669 TYR n 2 670 LEU n 2 671 GLY n 2 672 GLU n 2 673 GLU n 2 674 TYR n 2 675 VAL n 2 676 LYS n 2 677 ALA n 2 678 VAL n 2 679 GLY n 2 680 ASN n 2 681 LEU n 2 682 ARG n 2 683 LYS n 2 684 CYS n 2 685 SER n 2 686 THR n 2 687 SER n 2 688 SER n 2 689 LEU n 2 690 LEU n 2 691 GLU n 2 692 ALA n 2 693 CYS n 2 694 THR n 2 695 PHE n 2 696 ARG n 2 697 ARG n 2 698 PRO n # loop_ _entity_src_gen.entity_id _entity_src_gen.pdbx_src_id _entity_src_gen.pdbx_alt_source_flag _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 _entity_src_gen.gene_src_genus _entity_src_gen.pdbx_gene_src_gene _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 _entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id _entity_src_gen.pdbx_gene_src_variant _entity_src_gen.pdbx_gene_src_cell_line _entity_src_gen.pdbx_gene_src_atcc _entity_src_gen.pdbx_gene_src_organ _entity_src_gen.pdbx_gene_src_organelle _entity_src_gen.pdbx_gene_src_cell _entity_src_gen.pdbx_gene_src_cellular_location _entity_src_gen.host_org_common_name _entity_src_gen.pdbx_host_org_scientific_name _entity_src_gen.pdbx_host_org_ncbi_taxonomy_id _entity_src_gen.host_org_genus _entity_src_gen.pdbx_host_org_gene _entity_src_gen.pdbx_host_org_organ _entity_src_gen.host_org_species _entity_src_gen.pdbx_host_org_tissue _entity_src_gen.pdbx_host_org_tissue_fraction _entity_src_gen.pdbx_host_org_strain _entity_src_gen.pdbx_host_org_variant _entity_src_gen.pdbx_host_org_cell_line _entity_src_gen.pdbx_host_org_atcc _entity_src_gen.pdbx_host_org_culture_collection _entity_src_gen.pdbx_host_org_cell _entity_src_gen.pdbx_host_org_organelle _entity_src_gen.pdbx_host_org_cellular_location _entity_src_gen.pdbx_host_org_vector_type _entity_src_gen.pdbx_host_org_vector _entity_src_gen.host_org_details _entity_src_gen.expression_system_id _entity_src_gen.plasmid_name _entity_src_gen.plasmid_details _entity_src_gen.pdbx_description 1 1 sample ? ? ? ? ? 'tbp1, NMB0461' ? ? ? ? ? ? 'Neisseria meningitidis serogroup B' 491 ? ? ? ? ? ? ? ? 'Escherichia coli' 562 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 2 1 sample ? ? ? human ? 'TF, PRO1400' ? ? ? ? ? ? 'Homo sapiens' 9606 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? # loop_ _struct_ref.id _struct_ref.db_name _struct_ref.db_code _struct_ref.pdbx_db_accession _struct_ref.entity_id _struct_ref.pdbx_seq_one_letter_code _struct_ref.pdbx_align_begin _struct_ref.pdbx_db_isoform 1 UNP TBP1_NEIMB Q9K0U9 1 ;ENVQAGQAQEKQLDTIQVKAKKQKTRRDNEVTGLGKLVKSSDTLSKEQVLNIRDLTRYDPGIAVVEQGRGASSGYSIRGM DKNRVSLTVDGVSQIQSYTAQAALGGTRTAGSSGAINEIEYENVKAVEISKGSNSVEQGSGALAGSVAFQTKTADDVIGE GRQWGIQSKTAYSGKNRGLTQSIALAGRIGGAEALLIHTGRRAGEIRAHEDAGRGVQSFNRLVPVEDSSNYAYFIVKEEC KNGSYETCKANPKKDVVGKDERQTVSTRDYTGPNRFLADPLSYESRSWLFRPGFRFENKRHYIGGILEHTQQTFDTRDMT VPAFLTKAVFDANKKQAGSLPGNGKYAGNHKYGGLFTNGENGALVGAEYGTGVFYDETHTKSRYGLEYVYTNADKDTWAD YARLSYDRQGIGLDNHFQQTHCSADGSDKYCRPSADKPFSYYKSDRVIYGESHRLLQAAFKKSFDTAKIRHNLSVNLGFD RFGSNLRHQDYYYQHANRAYSSNTPPQNNGKKISPNGSETSPYWVTIGRGNVVTGQICRLGNNTYTDCTPRSINGKSYYA AVRDNVRLGRWADVGAGLRYDYRSTHSDDGSVSTGTHRTLSWNAGIVLKPTDWLDLTYRTSTGFRLPSFAEMYGWRAGVQ SKAVKIDPEKSFNKEAGIVFKGDFGNLEASWFNNAYRDLIVRGYEAQIKDGKEEAKGDPAYLNAQSARITGINILGKIDW NGVWDKLPEGWYSTFAYNRVRVRDIKKRADRTDIQSHLFDAIQPSRYVVGLGYDQPEGKWGVNGMLTYSKAKEITELLGS RALLNGNSRNTKATARRTRPWYIVDVSGYYTVKKHFTLRAGVYNLLNYRYVTWENVRQTAGGAVNQHKNVGVYNRYAAPG RNYTFSLEMKF ; 25 ? 2 UNP TRFE_HUMAN P02787 2 ;MRLAVGALLVCAVLGLCLAVPDKTVRWCAVSEHEATKCQSFRDHMKSVIPSDGPSVACVKKASYLDCIRAIAANEADAVT LDAGLVYDAYLAPNNLKPVVAEFYGSKEDPQTFYYAVAVVKKDSGFQMNQLRGKKSCHTGLGRSAGWNIPIGLLYCDLPE PRKPLEKAVANFFSGSCAPCADGTDFPQLCQLCPGCGCSTLNQYFGYSGAFKCLKDGAGDVAFVKHSTIFENLANKADRD QYELLCLDNTRKPVDEYKDCHLAQVPSHTVVARSMGGKEDLIWELLNQAQEHFGKDKSKEFQLFSSPHGKDLLFKDSAHG FLKVPPRMDAKMYLGYEYVTAIRNLREGTCPEAPTDECKPVKWCALSHHERLKCDEWSVNSVGKIECVSAETTEDCIAKI MNGEADAMSLDGGFVYIAGKCGLVPVLAENYNKSDNCEDTPEAGYFAIAVVKKSASDLTWDNLKGKKSCHTAVGRTAGWN IPMGLLYNKINHCRFDEFFSEGCAPGSKKDSSLCKLCMGSGLNLCEPNNKEGYYGYTGAFRCLVEKGDVAFVKHQTVPQN TGGKNPDPWAKNLNEKDYELLCLDGTRKPVEEYANCHLARAPNHAVVTRKDKEACVHKILRQQQHLFGSNVTDCSGNFCL FRSETKDLLFRDDTVCLAKLHDRNTYEKYLGEEYVKAVGNLRKCSTSSLLEACTFRRP ; 1 ? # loop_ _struct_ref_seq.align_id _struct_ref_seq.ref_id _struct_ref_seq.pdbx_PDB_id_code _struct_ref_seq.pdbx_strand_id _struct_ref_seq.seq_align_beg _struct_ref_seq.pdbx_seq_align_beg_ins_code _struct_ref_seq.seq_align_end _struct_ref_seq.pdbx_seq_align_end_ins_code _struct_ref_seq.pdbx_db_accession _struct_ref_seq.db_align_beg _struct_ref_seq.pdbx_db_align_beg_ins_code _struct_ref_seq.db_align_end _struct_ref_seq.pdbx_db_align_end_ins_code _struct_ref_seq.pdbx_auth_seq_align_beg _struct_ref_seq.pdbx_auth_seq_align_end 1 1 3V8X A 14 ? 904 ? Q9K0U9 25 ? 915 ? 25 915 2 2 3V8X B 1 ? 698 ? P02787 1 ? 698 ? -18 679 # 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 3V8X MET A 1 ? UNP Q9K0U9 ? ? 'EXPRESSION TAG' 12 1 1 3V8X ASP A 2 ? UNP Q9K0U9 ? ? 'EXPRESSION TAG' 13 2 1 3V8X ILE A 3 ? UNP Q9K0U9 ? ? 'EXPRESSION TAG' 14 3 1 3V8X HIS A 4 ? UNP Q9K0U9 ? ? 'EXPRESSION TAG' 15 4 1 3V8X HIS A 5 ? UNP Q9K0U9 ? ? 'EXPRESSION TAG' 16 5 1 3V8X HIS A 6 ? UNP Q9K0U9 ? ? 'EXPRESSION TAG' 17 6 1 3V8X HIS A 7 ? UNP Q9K0U9 ? ? 'EXPRESSION TAG' 18 7 1 3V8X HIS A 8 ? UNP Q9K0U9 ? ? 'EXPRESSION TAG' 19 8 1 3V8X HIS A 9 ? UNP Q9K0U9 ? ? 'EXPRESSION TAG' 20 9 1 3V8X HIS A 10 ? UNP Q9K0U9 ? ? 'EXPRESSION TAG' 21 10 1 3V8X HIS A 11 ? UNP Q9K0U9 ? ? 'EXPRESSION TAG' 22 11 1 3V8X HIS A 12 ? UNP Q9K0U9 ? ? 'EXPRESSION TAG' 23 12 1 3V8X HIS A 13 ? UNP Q9K0U9 ? ? 'EXPRESSION TAG' 24 13 1 3V8X VAL A 424 ? UNP Q9K0U9 ILE 435 VARIANT 435 14 1 3V8X TYR A 902 ? UNP Q9K0U9 MET 913 'ENGINEERED MUTATION' 913 15 2 3V8X VAL B 448 ? UNP P02787 ILE 448 VARIANT 429 16 # 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 C8E non-polymer . '(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE' ? 'C16 H34 O5' 306.438 CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 GAL D-saccharide . BETA-D-GALACTOSE ? 'C6 H12 O6' 180.156 GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162 HOH non-polymer . WATER ? 'H2 O' 18.015 ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173 LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 MAN D-saccharide . ALPHA-D-MANNOSE ? 'C6 H12 O6' 180.156 MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211 NAG D-saccharide . N-ACETYL-D-GLUCOSAMINE ? 'C8 H15 N O6' 221.208 PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189 PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130 SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093 SIA non-polymer . 'O-SIALIC ACID' ? 'C11 H19 N O9' 309.270 THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.119 TRP 'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2' 204.225 TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 # _exptl.entry_id 3V8X _exptl.method 'X-RAY DIFFRACTION' _exptl.crystals_number 1 # _exptl_crystal.id 1 _exptl_crystal.density_meas ? _exptl_crystal.density_Matthews 3.28 _exptl_crystal.density_percent_sol 62.47 _exptl_crystal.description ? _exptl_crystal.F_000 ? _exptl_crystal.preparation ? # _exptl_crystal_grow.crystal_id 1 _exptl_crystal_grow.method 'VAPOR DIFFUSION, HANGING DROP' _exptl_crystal_grow.temp 298 _exptl_crystal_grow.temp_details ? _exptl_crystal_grow.pH 7.5 _exptl_crystal_grow.pdbx_pH_range ? _exptl_crystal_grow.pdbx_details '20% Peg3350 and 200 mM BaBr2, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K' # _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 'MARMOSAIC 300 mm CCD' _diffrn_detector.pdbx_collection_date ? _diffrn_detector.details ? # _diffrn_radiation.diffrn_id 1 _diffrn_radiation.wavelength_id 1 _diffrn_radiation.pdbx_monochromatic_or_laue_m_l M _diffrn_radiation.monochromator 'double crystal' _diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' _diffrn_radiation.pdbx_scattering_type x-ray # _diffrn_radiation_wavelength.id 1 _diffrn_radiation_wavelength.wavelength 1.0 _diffrn_radiation_wavelength.wt 1.0 # _diffrn_source.diffrn_id 1 _diffrn_source.source SYNCHROTRON _diffrn_source.type 'APS BEAMLINE 22-ID' _diffrn_source.pdbx_synchrotron_site APS _diffrn_source.pdbx_synchrotron_beamline 22-ID _diffrn_source.pdbx_wavelength ? _diffrn_source.pdbx_wavelength_list 1.0 # _reflns.pdbx_diffrn_id 1 _reflns.pdbx_ordinal 1 _reflns.entry_id 3V8X _reflns.observed_criterion_sigma_I 1 _reflns.observed_criterion_sigma_F 1 _reflns.d_resolution_low 50 _reflns.d_resolution_high 2.6 _reflns.number_obs 71620 _reflns.number_all 71620 _reflns.percent_possible_obs 98.7 _reflns.pdbx_Rmerge_I_obs ? _reflns.pdbx_Rsym_value 0.12 _reflns.pdbx_netI_over_sigmaI 16.8 _reflns.B_iso_Wilson_estimate ? _reflns.pdbx_redundancy 4.5 _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_shell.pdbx_diffrn_id 1 _reflns_shell.pdbx_ordinal 1 _reflns_shell.d_res_high 2.6 _reflns_shell.d_res_low 2.69 _reflns_shell.percent_possible_all 97.4 _reflns_shell.Rmerge_I_obs ? _reflns_shell.pdbx_Rsym_value 0.84 _reflns_shell.meanI_over_sigI_obs 1.5 _reflns_shell.pdbx_redundancy 3.4 _reflns_shell.percent_possible_obs ? _reflns_shell.number_unique_all ? _reflns_shell.number_measured_all ? _reflns_shell.number_measured_obs ? _reflns_shell.number_unique_obs ? _reflns_shell.pdbx_chi_squared ? # _refine.pdbx_refine_id 'X-RAY DIFFRACTION' _refine.entry_id 3V8X _refine.pdbx_diffrn_id 1 _refine.pdbx_TLS_residual_ADP_flag ? _refine.ls_number_reflns_obs 71619 _refine.ls_number_reflns_all 71620 _refine.pdbx_ls_sigma_I ? _refine.pdbx_ls_sigma_F 0.00 _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.ls_d_res_low 29.924 _refine.ls_d_res_high 2.600 _refine.ls_percent_reflns_obs 98.44 _refine.ls_R_factor_obs 0.2111 _refine.ls_R_factor_all ? _refine.ls_R_factor_R_work 0.2081 _refine.ls_R_factor_R_free 0.2667 _refine.ls_R_factor_R_free_error ? _refine.ls_R_factor_R_free_error_details ? _refine.ls_percent_reflns_R_free 5.03 _refine.ls_number_reflns_R_free 3601 _refine.ls_number_parameters ? _refine.ls_number_restraints ? _refine.occupancy_min ? _refine.occupancy_max ? _refine.correlation_coeff_Fo_to_Fc ? _refine.correlation_coeff_Fo_to_Fc_free ? _refine.B_iso_mean ? _refine.aniso_B[1][1] 6.5828 _refine.aniso_B[2][2] -3.2356 _refine.aniso_B[3][3] -3.3471 _refine.aniso_B[1][2] -0.0000 _refine.aniso_B[1][3] -0.0000 _refine.aniso_B[2][3] -0.0000 _refine.solvent_model_details 'FLAT BULK SOLVENT MODEL' _refine.solvent_model_param_ksol 0.286 _refine.solvent_model_param_bsol 38.919 _refine.pdbx_solvent_vdw_probe_radii 1.00 _refine.pdbx_solvent_ion_probe_radii ? _refine.pdbx_solvent_shrinkage_radii 0.73 _refine.pdbx_ls_cross_valid_method ? _refine.details ? _refine.pdbx_starting_model ? _refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' _refine.pdbx_isotropic_thermal_model ? _refine.pdbx_stereochemistry_target_values ML _refine.pdbx_stereochem_target_val_spec_case ? _refine.pdbx_R_Free_selection_details ? _refine.pdbx_overall_ESU_R ? _refine.pdbx_overall_ESU_R_Free ? _refine.overall_SU_ML 0.45 _refine.pdbx_overall_phase_error 28.18 _refine.overall_SU_B ? _refine.overall_SU_R_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_Blow_DPI ? _refine.pdbx_overall_SU_R_free_Blow_DPI ? _refine.ls_redundancy_reflns_obs ? _refine.B_iso_min ? _refine.B_iso_max ? _refine.overall_SU_R_free ? _refine.ls_wR_factor_R_free ? _refine.ls_wR_factor_R_work ? _refine.overall_FOM_free_R_set ? _refine.overall_FOM_work_R_set ? # _refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_hist.cycle_id LAST _refine_hist.pdbx_number_atoms_protein 11714 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 293 _refine_hist.number_atoms_solvent 204 _refine_hist.number_atoms_total 12211 _refine_hist.d_res_high 2.600 _refine_hist.d_res_low 29.924 # loop_ _refine_ls_restr.type _refine_ls_restr.dev_ideal _refine_ls_restr.dev_ideal_target _refine_ls_restr.weight _refine_ls_restr.number _refine_ls_restr.pdbx_refine_id _refine_ls_restr.pdbx_restraint_function f_bond_d 0.004 ? ? 12341 'X-RAY DIFFRACTION' ? f_angle_d 1.360 ? ? 16717 'X-RAY DIFFRACTION' ? f_dihedral_angle_d 19.541 ? ? 4510 'X-RAY DIFFRACTION' ? f_chiral_restr 0.061 ? ? 1825 'X-RAY DIFFRACTION' ? f_plane_restr 0.003 ? ? 2166 'X-RAY DIFFRACTION' ? # loop_ _refine_ls_shell.pdbx_refine_id _refine_ls_shell.pdbx_total_number_of_bins_used _refine_ls_shell.d_res_high _refine_ls_shell.d_res_low _refine_ls_shell.number_reflns_R_work _refine_ls_shell.R_factor_R_work _refine_ls_shell.percent_reflns_obs _refine_ls_shell.R_factor_R_free _refine_ls_shell.R_factor_R_free_error _refine_ls_shell.percent_reflns_R_free _refine_ls_shell.number_reflns_R_free _refine_ls_shell.number_reflns_all _refine_ls_shell.R_factor_all _refine_ls_shell.redundancy_reflns_obs _refine_ls_shell.number_reflns_obs 'X-RAY DIFFRACTION' . 2.6000 2.6342 2334 0.3643 89.00 0.3929 . . 103 . . . . 'X-RAY DIFFRACTION' . 2.6342 2.6703 2566 0.3555 97.00 0.3871 . . 132 . . . . 'X-RAY DIFFRACTION' . 2.6703 2.7084 2551 0.3455 99.00 0.4167 . . 146 . . . . 'X-RAY DIFFRACTION' . 2.7084 2.7488 2613 0.3589 99.00 0.3922 . . 133 . . . . 'X-RAY DIFFRACTION' . 2.7488 2.7917 2588 0.3172 99.00 0.3697 . . 145 . . . . 'X-RAY DIFFRACTION' . 2.7917 2.8375 2608 0.2989 99.00 0.3777 . . 128 . . . . 'X-RAY DIFFRACTION' . 2.8375 2.8863 2600 0.2745 99.00 0.3157 . . 134 . . . . 'X-RAY DIFFRACTION' . 2.8863 2.9388 2599 0.2819 99.00 0.3680 . . 155 . . . . 'X-RAY DIFFRACTION' . 2.9388 2.9953 2572 0.2738 99.00 0.3444 . . 147 . . . . 'X-RAY DIFFRACTION' . 2.9953 3.0563 2608 0.2564 99.00 0.3249 . . 134 . . . . 'X-RAY DIFFRACTION' . 3.0563 3.1227 2603 0.2424 99.00 0.3091 . . 130 . . . . 'X-RAY DIFFRACTION' . 3.1227 3.1953 2634 0.2179 99.00 0.2801 . . 112 . . . . 'X-RAY DIFFRACTION' . 3.1953 3.2751 2605 0.2177 99.00 0.2555 . . 148 . . . . 'X-RAY DIFFRACTION' . 3.2751 3.3635 2651 0.2121 99.00 0.2845 . . 132 . . . . 'X-RAY DIFFRACTION' . 3.3635 3.4624 2601 0.2038 99.00 0.2729 . . 157 . . . . 'X-RAY DIFFRACTION' . 3.4624 3.5740 2648 0.1989 99.00 0.2543 . . 130 . . . . 'X-RAY DIFFRACTION' . 3.5740 3.7015 2637 0.1881 99.00 0.2467 . . 147 . . . . 'X-RAY DIFFRACTION' . 3.7015 3.8494 2620 0.1823 99.00 0.2295 . . 150 . . . . 'X-RAY DIFFRACTION' . 3.8494 4.0242 2645 0.1793 99.00 0.2429 . . 142 . . . . 'X-RAY DIFFRACTION' . 4.0242 4.2358 2646 0.1607 99.00 0.2406 . . 131 . . . . 'X-RAY DIFFRACTION' . 4.2358 4.5003 2640 0.1538 99.00 0.1861 . . 159 . . . . 'X-RAY DIFFRACTION' . 4.5003 4.8465 2666 0.1440 99.00 0.1855 . . 130 . . . . 'X-RAY DIFFRACTION' . 4.8465 5.3317 2659 0.1681 99.00 0.2332 . . 140 . . . . 'X-RAY DIFFRACTION' . 5.3317 6.0976 2669 0.2024 98.00 0.2527 . . 150 . . . . 'X-RAY DIFFRACTION' . 6.0976 7.6609 2708 0.1893 98.00 0.3053 . . 118 . . . . 'X-RAY DIFFRACTION' . 7.6609 29.9255 2747 0.2241 97.00 0.2754 . . 168 . . . . # _pdbx_refine.pdbx_refine_id 'X-RAY DIFFRACTION' _pdbx_refine.entry_id 3V8X _pdbx_refine.R_factor_all_no_cutoff ? _pdbx_refine.R_factor_obs_no_cutoff ? _pdbx_refine.free_R_factor_no_cutoff ? _pdbx_refine.free_R_error_no_cutoff ? _pdbx_refine.free_R_val_test_set_size_perc_no_cutoff ? _pdbx_refine.free_R_val_test_set_ct_no_cutoff ? _pdbx_refine.R_factor_all_4sig_cutoff ? _pdbx_refine.R_factor_obs_4sig_cutoff ? _pdbx_refine.free_R_factor_4sig_cutoff ? _pdbx_refine.free_R_val_test_set_size_perc_4sig_cutoff ? _pdbx_refine.free_R_val_test_set_ct_4sig_cutoff ? _pdbx_refine.number_reflns_obs_4sig_cutoff ? # _struct.entry_id 3V8X _struct.title ;The crystal structure of transferrin binding protein A (TbpA) from Neisserial meningitidis serogroup B in complex with full length human transferrin ; _struct.pdbx_descriptor 'Transferrin-binding protein 1, Serotransferrin' _struct.pdbx_model_details ? _struct.pdbx_CASP_flag ? _struct.pdbx_model_type_details ? # _struct_keywords.entry_id 3V8X _struct_keywords.pdbx_keywords 'MEMBRANE PROTEIN/METAL TRANSPORT' _struct_keywords.text 'iron binding protein, transferrin binding protein A, iron binding/scavenging, MEMBRANE PROTEIN-METAL TRANSPORT complex' # loop_ _struct_asym.id _struct_asym.pdbx_blank_PDB_chainid_flag _struct_asym.pdbx_modified _struct_asym.entity_id _struct_asym.details A N N 1 ? B N N 2 ? C N N 3 ? D N N 3 ? E N N 4 ? F N N 4 ? G N N 5 ? H N N 6 ? I N N 4 ? J N N 7 ? K N N 8 ? L N N 6 ? M N N 4 ? N N N 7 ? O N N 4 ? P N N 4 ? Q N N 5 ? R N N 6 ? S N N 4 ? T N N 7 ? U N N 8 ? V N N 6 ? W N N 4 ? X N N 9 ? Y N N 9 ? # _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 SER A 54 ? GLN A 61 ? SER A 65 GLN A 72 1 ? 8 HELX_P HELX_P2 2 ASN A 64 ? THR A 69 ? ASN A 75 THR A 80 1 ? 6 HELX_P HELX_P3 3 GLU A 133 ? GLU A 135 ? GLU A 144 GLU A 146 5 ? 3 HELX_P HELX_P4 4 ASN A 147 ? GLY A 152 ? ASN A 158 GLY A 163 1 ? 6 HELX_P HELX_P5 5 THR A 166 ? VAL A 170 ? THR A 177 VAL A 181 5 ? 5 HELX_P HELX_P6 6 LYS A 188 ? ARG A 190 ? LYS A 199 ARG A 201 5 ? 3 HELX_P HELX_P7 7 GLU A 251 ? CYS A 253 ? GLU A 262 CYS A 264 5 ? 3 HELX_P HELX_P8 8 SER A 257 ? LYS A 262 ? SER A 268 LYS A 273 1 ? 6 HELX_P HELX_P9 9 THR A 339 ? GLY A 351 ? THR A 350 GLY A 362 1 ? 13 HELX_P HELX_P10 10 SER A 641 ? GLY A 647 ? SER A 652 GLY A 658 1 ? 7 HELX_P HELX_P11 11 GLU A 806 ? GLU A 809 ? GLU A 817 GLU A 820 5 ? 4 HELX_P HELX_P12 12 THR A 865 ? ARG A 870 ? THR A 876 ARG A 881 1 ? 6 HELX_P HELX_P13 13 GLN A 871 ? ALA A 873 ? GLN A 882 ALA A 884 5 ? 3 HELX_P HELX_P14 14 VAL A 885 ? ALA A 890 ? VAL A 896 ALA A 901 5 ? 6 HELX_P HELX_P15 15 GLU B 32 ? CYS B 38 ? GLU B 13 CYS B 19 1 ? 7 HELX_P HELX_P16 16 SER B 63 ? ALA B 72 ? SER B 44 ALA B 53 1 ? 10 HELX_P HELX_P17 17 ALA B 83 ? LEU B 91 ? ALA B 64 LEU B 72 1 ? 9 HELX_P HELX_P18 18 GLN B 127 ? LEU B 131 ? GLN B 108 LEU B 112 5 ? 5 HELX_P HELX_P19 19 TRP B 147 ? TYR B 155 ? TRP B 128 TYR B 136 1 ? 9 HELX_P HELX_P20 20 PRO B 164 ? ASN B 171 ? PRO B 145 ASN B 152 1 ? 8 HELX_P HELX_P21 21 PHE B 186 ? GLN B 191 ? PHE B 167 GLN B 172 5 ? 6 HELX_P HELX_P22 22 PHE B 205 ? ASP B 216 ? PHE B 186 ASP B 197 1 ? 12 HELX_P HELX_P23 23 SER B 227 ? LEU B 233 ? SER B 208 LEU B 214 1 ? 7 HELX_P HELX_P24 24 ASN B 235 ? ASP B 240 ? ASN B 216 ASP B 221 1 ? 6 HELX_P HELX_P25 25 ASP B 255 ? CYS B 260 ? ASP B 236 CYS B 241 5 ? 6 HELX_P HELX_P26 26 GLU B 279 ? HIS B 292 ? GLU B 260 HIS B 273 1 ? 14 HELX_P HELX_P27 27 ASP B 329 ? GLY B 335 ? ASP B 310 GLY B 316 1 ? 7 HELX_P HELX_P28 28 GLY B 335 ? GLY B 348 ? GLY B 316 GLY B 329 1 ? 14 HELX_P HELX_P29 29 SER B 367 ? SER B 381 ? SER B 348 SER B 362 1 ? 15 HELX_P HELX_P30 30 THR B 392 ? ASN B 402 ? THR B 373 ASN B 383 1 ? 11 HELX_P HELX_P31 31 ASP B 411 ? CYS B 421 ? ASP B 392 CYS B 402 1 ? 11 HELX_P HELX_P32 32 ASN B 436 ? THR B 440 ? ASN B 417 THR B 421 5 ? 5 HELX_P HELX_P33 33 TRP B 479 ? TYR B 487 ? TRP B 460 TYR B 468 1 ? 9 HELX_P HELX_P34 34 ARG B 494 ? PHE B 498 ? ARG B 475 PHE B 479 5 ? 5 HELX_P HELX_P35 35 SER B 511 ? LYS B 515 ? SER B 492 LYS B 496 5 ? 5 HELX_P HELX_P36 36 TYR B 534 ? LYS B 546 ? TYR B 515 LYS B 527 1 ? 13 HELX_P HELX_P37 37 GLN B 555 ? ASN B 560 ? GLN B 536 ASN B 541 1 ? 6 HELX_P HELX_P38 38 ASN B 574 ? LYS B 576 ? ASN B 555 LYS B 557 5 ? 3 HELX_P HELX_P39 39 GLU B 592 ? CYS B 596 ? GLU B 573 CYS B 577 5 ? 5 HELX_P HELX_P40 40 LYS B 612 ? PHE B 627 ? LYS B 593 PHE B 608 1 ? 16 HELX_P HELX_P41 41 THR B 665 ? GLY B 671 ? THR B 646 GLY B 652 1 ? 7 HELX_P HELX_P42 42 GLY B 671 ? VAL B 678 ? GLY B 652 VAL B 659 1 ? 8 HELX_P HELX_P43 43 GLY B 679 ? ARG B 682 ? GLY B 660 ARG B 663 5 ? 4 HELX_P HELX_P44 44 SER B 687 ? ARG B 697 ? SER B 668 ARG B 678 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 253 SG ? ? ? 1_555 A CYS 261 SG ? ? A CYS 264 A CYS 272 1_555 ? ? ? ? ? ? ? 2.038 ? disulf2 disulf ? ? A CYS 435 SG ? ? ? 1_555 A CYS 444 SG ? ? A CYS 446 A CYS 455 1_555 ? ? ? ? ? ? ? 2.052 ? disulf3 disulf ? ? A CYS 551 SG ? ? ? 1_555 A CYS 561 SG ? ? A CYS 562 A CYS 572 1_555 ? ? ? ? ? ? ? 2.036 ? disulf4 disulf ? ? B CYS 28 SG ? ? ? 1_555 B CYS 67 SG ? ? B CYS 9 B CYS 48 1_555 ? ? ? ? ? ? ? 2.046 ? disulf5 disulf ? ? B CYS 38 SG ? ? ? 1_555 B CYS 58 SG ? ? B CYS 19 B CYS 39 1_555 ? ? ? ? ? ? ? 2.031 ? disulf6 disulf ? ? B CYS 137 SG ? ? ? 1_555 B CYS 213 SG ? ? B CYS 118 B CYS 194 1_555 ? ? ? ? ? ? ? 2.040 ? disulf7 disulf ? ? B CYS 156 SG ? ? ? 1_555 B CYS 350 SG ? ? B CYS 137 B CYS 331 1_555 ? ? ? ? ? ? ? 2.034 ? disulf8 disulf ? ? B CYS 177 SG ? ? ? 1_555 B CYS 193 SG ? ? B CYS 158 B CYS 174 1_555 ? ? ? ? ? ? ? 2.033 ? disulf9 disulf ? ? B CYS 180 SG ? ? ? 1_555 B CYS 198 SG ? ? B CYS 161 B CYS 179 1_555 ? ? ? ? ? ? ? 2.033 ? disulf10 disulf ? ? B CYS 190 SG ? ? ? 1_555 B CYS 196 SG ? ? B CYS 171 B CYS 177 1_555 ? ? ? ? ? ? ? 2.029 ? disulf11 disulf ? ? B CYS 246 SG ? ? ? 1_555 B CYS 260 SG ? ? B CYS 227 B CYS 241 1_555 ? ? ? ? ? ? ? 2.036 ? disulf12 disulf ? ? B CYS 358 SG ? ? ? 1_555 B CYS 615 SG ? ? B CYS 339 B CYS 596 1_555 ? ? ? ? ? ? ? 2.038 ? disulf13 disulf ? ? B CYS 364 SG ? ? ? 1_555 B CYS 396 SG ? ? B CYS 345 B CYS 377 1_555 ? ? ? ? ? ? ? 2.030 ? disulf14 disulf ? ? B CYS 374 SG ? ? ? 1_555 B CYS 387 SG ? ? B CYS 355 B CYS 368 1_555 ? ? ? ? ? ? ? 2.037 ? disulf15 disulf ? ? B CYS 421 SG ? ? ? 1_555 B CYS 693 SG ? ? B CYS 402 B CYS 674 1_555 ? ? ? ? ? ? ? 2.031 ? disulf16 disulf ? ? B CYS 437 SG ? ? ? 1_555 B CYS 656 SG ? ? B CYS 418 B CYS 637 1_555 ? ? ? ? ? ? ? 2.033 ? disulf17 disulf ? ? B CYS 469 SG ? ? ? 1_555 B CYS 542 SG ? ? B CYS 450 B CYS 523 1_555 ? ? ? ? ? ? ? 2.034 ? disulf18 disulf ? ? B CYS 493 SG ? ? ? 1_555 B CYS 684 SG ? ? B CYS 474 B CYS 665 1_555 ? ? ? ? ? ? ? 2.031 ? disulf19 disulf ? ? B CYS 503 SG ? ? ? 1_555 B CYS 517 SG ? ? B CYS 484 B CYS 498 1_555 ? ? ? ? ? ? ? 2.033 ? disulf20 disulf ? ? B CYS 514 SG ? ? ? 1_555 B CYS 525 SG ? ? B CYS 495 B CYS 506 1_555 ? ? ? ? ? ? ? 2.035 ? disulf21 disulf ? ? B CYS 582 SG ? ? ? 1_555 B CYS 596 SG ? ? B CYS 563 B CYS 577 1_555 ? ? ? ? ? ? ? 2.033 ? disulf22 disulf ? ? B CYS 634 SG ? ? ? 1_555 B CYS 639 SG ? ? B CYS 615 B CYS 620 1_555 ? ? ? ? ? ? ? 2.031 ? covale1 covale ? ? G BMA . O6 ? ? ? 1_555 L MAN . C1 ? ? B BMA 703 B MAN 708 1_555 ? ? ? ? ? ? ? 1.432 ? covale2 covale ? ? B ASN 432 ND2 ? ? ? 1_555 E NAG . C1 ? ? B ASN 413 B NAG 701 1_555 ? ? ? ? ? ? ? 1.434 ? covale3 covale ? ? E NAG . O4 ? ? ? 1_555 F NAG . C1 ? ? B NAG 701 B NAG 702 1_555 ? ? ? ? ? ? ? 1.436 ? covale4 covale ? ? G BMA . O3 ? ? ? 1_555 H MAN . C1 ? ? B BMA 703 B MAN 704 1_555 ? ? ? ? ? ? ? 1.436 ? covale5 covale ? ? H MAN . O4 ? ? ? 1_555 I NAG . C1 ? ? B MAN 704 B NAG 705 1_555 ? ? ? ? ? ? ? 1.439 ? covale6 covale ? ? F NAG . O4 ? ? ? 1_555 G BMA . C1 ? ? B NAG 702 B BMA 703 1_555 ? ? ? ? ? ? ? 1.442 ? covale7 covale ? ? B ASN 630 ND2 ? ? ? 1_555 O NAG . C1 ? ? B ASN 611 B NAG 711 1_555 ? ? ? ? ? ? ? 1.442 ? covale8 covale ? ? I NAG . O4 ? ? ? 1_555 J GAL . C1 ? ? B NAG 705 B GAL 706 1_555 ? ? ? ? ? ? ? 1.439 ? covale9 covale ? ? V MAN . O4 ? ? ? 1_555 W NAG . C1 ? ? B MAN 718 B NAG 719 1_555 ? ? ? ? ? ? ? 1.443 ? covale10 covale ? ? O NAG . O4 ? ? ? 1_555 P NAG . C1 ? ? B NAG 711 B NAG 712 1_555 ? ? ? ? ? ? ? 1.445 ? covale11 covale ? ? S NAG . O4 ? ? ? 1_555 T GAL . C1 ? ? B NAG 715 B GAL 716 1_555 ? ? ? ? ? ? ? 1.445 ? covale12 covale ? ? M NAG . O4 ? ? ? 1_555 N GAL . C1 ? ? B NAG 709 B GAL 710 1_555 ? ? ? ? ? ? ? 1.446 ? covale13 covale ? ? L MAN . O4 ? ? ? 1_555 M NAG . C1 ? ? B MAN 708 B NAG 709 1_555 ? ? ? ? ? ? ? 1.446 ? covale14 covale ? ? Q BMA . O3 ? ? ? 1_555 V MAN . C1 ? ? B BMA 713 B MAN 718 1_555 ? ? ? ? ? ? ? 1.446 ? covale15 covale ? ? Q BMA . O6 ? ? ? 1_555 R MAN . C1 ? ? B BMA 713 B MAN 714 1_555 ? ? ? ? ? ? ? 1.448 ? covale16 covale ? ? R MAN . O4 ? ? ? 1_555 S NAG . C1 ? ? B MAN 714 B NAG 715 1_555 ? ? ? ? ? ? ? 1.454 ? covale17 covale ? ? P NAG . O4 ? ? ? 1_555 Q BMA . C1 ? ? B NAG 712 B BMA 713 1_555 ? ? ? ? ? ? ? 1.456 ? covale18 covale ? ? J GAL . O6 ? ? ? 1_555 K SIA . C2 ? ? B GAL 706 B SIA 707 1_555 ? ? ? ? ? ? ? 1.480 ? covale19 covale ? ? T GAL . O6 ? ? ? 1_555 U SIA . C2 ? ? B GAL 716 B SIA 717 1_555 ? ? ? ? ? ? ? 1.509 ? # loop_ _struct_conn_type.id _struct_conn_type.criteria _struct_conn_type.reference disulf ? ? covale ? ? # 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 THR 45 A . ? THR 56 A GLY 46 A ? GLY 57 A 1 2.27 2 GLY 203 A . ? GLY 214 A GLY 204 A ? GLY 215 A 1 -1.70 3 GLU 310 A . ? GLU 321 A ASN 311 A ? ASN 322 A 1 7.61 4 TYR 365 A . ? TYR 376 A GLY 366 A ? GLY 377 A 1 -3.87 5 GLY 366 A . ? GLY 377 A GLY 367 A ? GLY 378 A 1 0.30 6 ALA 406 A . ? ALA 417 A ASP 407 A ? ASP 418 A 1 10.76 7 ASP 438 A . ? ASP 449 A GLY 439 A ? GLY 450 A 1 5.77 8 GLY 439 A . ? GLY 450 A SER 440 A ? SER 451 A 1 -9.80 9 ASN 521 A . ? ASN 532 A ASN 522 A ? ASN 533 A 1 -4.68 10 ASN 734 A . ? ASN 745 A GLY 735 A ? GLY 746 A 1 -7.17 11 LEU 817 A . ? LEU 828 A ASN 818 A ? ASN 829 A 1 -3.13 12 LYS 881 A . ? LYS 892 A ASN 882 A ? ASN 893 A 1 -1.98 13 VAL 883 A . ? VAL 894 A GLY 884 A ? GLY 895 A 1 6.22 14 GLN 39 B . ? GLN 20 B SER 40 B ? SER 21 B 1 2.61 15 SER 40 B . ? SER 21 B PHE 41 B ? PHE 22 B 1 2.46 16 ALA 92 B . ? ALA 73 B PRO 93 B ? PRO 74 B 1 -1.23 17 GLU 160 B . ? GLU 141 B PRO 161 B ? PRO 142 B 1 1.56 18 LYS 163 B . ? LYS 144 B PRO 164 B ? PRO 145 B 1 3.48 19 GLU 300 B . ? GLU 281 B PHE 301 B ? PHE 282 B 1 -7.61 20 SER 456 B . ? SER 437 B ASP 457 B ? ASP 438 B 1 1.67 21 ARG 697 B . ? ARG 678 B PRO 698 B ? PRO 679 B 1 -1.10 # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details A ? 5 ? B ? 3 ? C ? 10 ? D ? 13 ? E ? 8 ? F ? 2 ? G ? 2 ? H ? 2 ? I ? 3 ? J ? 2 ? K ? 4 ? L ? 6 ? M ? 5 ? N ? 2 ? O ? 4 ? P ? 6 ? Q ? 5 ? # loop_ _struct_sheet_order.sheet_id _struct_sheet_order.range_id_1 _struct_sheet_order.range_id_2 _struct_sheet_order.offset _struct_sheet_order.sense A 1 2 ? anti-parallel A 2 3 ? anti-parallel A 3 4 ? parallel A 4 5 ? anti-parallel B 1 2 ? anti-parallel B 2 3 ? anti-parallel C 1 2 ? anti-parallel C 2 3 ? parallel C 3 4 ? anti-parallel C 4 5 ? anti-parallel C 5 6 ? anti-parallel C 6 7 ? anti-parallel C 7 8 ? anti-parallel C 8 9 ? anti-parallel C 9 10 ? anti-parallel D 1 2 ? anti-parallel D 2 3 ? anti-parallel D 3 4 ? anti-parallel D 4 5 ? anti-parallel D 5 6 ? anti-parallel D 6 7 ? anti-parallel D 7 8 ? anti-parallel D 8 9 ? anti-parallel D 9 10 ? anti-parallel D 10 11 ? anti-parallel D 11 12 ? anti-parallel D 12 13 ? anti-parallel E 1 2 ? anti-parallel E 2 3 ? anti-parallel E 3 4 ? anti-parallel E 4 5 ? anti-parallel E 5 6 ? anti-parallel E 6 7 ? anti-parallel E 7 8 ? anti-parallel F 1 2 ? anti-parallel G 1 2 ? anti-parallel H 1 2 ? anti-parallel I 1 2 ? anti-parallel I 2 3 ? anti-parallel J 1 2 ? parallel K 1 2 ? anti-parallel K 2 3 ? anti-parallel K 3 4 ? anti-parallel L 1 2 ? parallel L 2 3 ? parallel L 3 4 ? anti-parallel L 4 5 ? anti-parallel L 5 6 ? anti-parallel M 1 2 ? parallel M 2 3 ? parallel M 3 4 ? anti-parallel M 4 5 ? anti-parallel N 1 2 ? parallel O 1 2 ? anti-parallel O 2 3 ? anti-parallel O 3 4 ? anti-parallel P 1 2 ? parallel P 2 3 ? parallel P 3 4 ? anti-parallel P 4 5 ? anti-parallel P 5 6 ? anti-parallel Q 1 2 ? parallel Q 2 3 ? parallel Q 3 4 ? anti-parallel Q 4 5 ? anti-parallel # loop_ _struct_sheet_range.sheet_id _struct_sheet_range.id _struct_sheet_range.beg_label_comp_id _struct_sheet_range.beg_label_asym_id _struct_sheet_range.beg_label_seq_id _struct_sheet_range.pdbx_beg_PDB_ins_code _struct_sheet_range.end_label_comp_id _struct_sheet_range.end_label_asym_id _struct_sheet_range.end_label_seq_id _struct_sheet_range.pdbx_end_PDB_ins_code _struct_sheet_range.beg_auth_comp_id _struct_sheet_range.beg_auth_asym_id _struct_sheet_range.beg_auth_seq_id _struct_sheet_range.end_auth_comp_id _struct_sheet_range.end_auth_asym_id _struct_sheet_range.end_auth_seq_id A 1 LYS A 49 ? SER A 53 ? LYS A 60 SER A 64 A 2 VAL A 137 ? LYS A 144 ? VAL A 148 LYS A 155 A 3 GLY A 158 ? THR A 164 ? GLY A 169 THR A 175 A 4 VAL A 98 ? VAL A 102 ? VAL A 109 VAL A 113 A 5 VAL A 105 ? SER A 106 ? VAL A 116 SER A 117 B 1 ILE A 75 ? GLU A 79 ? ILE A 86 GLU A 90 B 2 SER A 85 ? ILE A 90 ? SER A 96 ILE A 101 B 3 MET A 93 ? ASP A 94 ? MET A 104 ASP A 105 C 1 LYS A 266 ? LYS A 267 ? LYS A 277 LYS A 278 C 2 TYR A 246 ? VAL A 249 ? TYR A 257 VAL A 260 C 3 TYR A 536 ? GLN A 549 ? TYR A 547 GLN A 560 C 4 ARG A 483 ? ASN A 516 ? ARG A 494 ASN A 527 C 5 TYR A 454 ? PHE A 477 ? TYR A 465 PHE A 488 C 6 TYR A 414 ? SER A 436 ? TYR A 425 SER A 447 C 7 GLY A 383 ? THR A 404 ? GLY A 394 THR A 415 C 8 HIS A 314 ? ARG A 330 ? HIS A 325 ARG A 341 C 9 GLY A 306 ? ARG A 308 ? GLY A 317 ARG A 319 C 10 ALA A 205 ? GLY A 217 ? ALA A 216 GLY A 228 D 1 HIS A 314 ? ARG A 330 ? HIS A 325 ARG A 341 D 2 LEU A 294 ? PHE A 303 ? LEU A 305 PHE A 314 D 3 ALA A 205 ? GLY A 217 ? ALA A 216 GLY A 228 D 4 GLY A 191 ? ILE A 202 ? GLY A 202 ILE A 213 D 5 TRP A 177 ? SER A 186 ? TRP A 188 SER A 197 D 6 ASN A 895 ? PHE A 904 ? ASN A 906 PHE A 915 D 7 PHE A 849 ? TYR A 856 ? PHE A 860 TYR A 867 D 8 TRP A 834 ? THR A 844 ? TRP A 845 THR A 855 D 9 TRP A 793 ? SER A 802 ? TRP A 804 SER A 813 D 10 ARG A 779 ? ASP A 787 ? ARG A 790 ASP A 798 D 11 TYR A 745 ? LYS A 760 ? TYR A 756 LYS A 771 D 12 GLU A 706 ? ILE A 731 ? GLU A 717 ILE A 742 D 13 GLY A 678 ? ILE A 701 ? GLY A 689 ILE A 712 E 1 ARG A 483 ? ASN A 516 ? ARG A 494 ASN A 527 E 2 ARG A 564 ? LEU A 581 ? ARG A 575 LEU A 592 E 3 ALA A 585 ? HIS A 599 ? ALA A 596 HIS A 610 E 4 THR A 609 ? LEU A 621 ? THR A 620 LEU A 632 E 5 LEU A 627 ? ARG A 638 ? LEU A 638 ARG A 649 E 6 GLU A 662 ? GLY A 675 ? GLU A 673 GLY A 686 E 7 GLY A 678 ? ILE A 701 ? GLY A 689 ILE A 712 E 8 ARG A 764 ? THR A 765 ? ARG A 775 THR A 776 F 1 VAL A 229 ? PHE A 232 ? VAL A 240 PHE A 243 F 2 GLN A 276 ? SER A 279 ? GLN A 287 SER A 290 G 1 LEU A 235 ? GLU A 239 ? LEU A 246 GLU A 250 G 2 VAL A 269 ? ASP A 273 ? VAL A 280 ASP A 284 H 1 PHE A 369 ? ASN A 371 ? PHE A 380 ASN A 382 H 2 LEU A 377 ? GLY A 379 ? LEU A 388 GLY A 390 I 1 ILE A 767 ? GLN A 768 ? ILE A 778 GLN A 779 I 2 LEU A 811 ? ALA A 815 ? LEU A 822 ALA A 826 I 3 SER A 821 ? LYS A 825 ? SER A 832 LYS A 836 J 1 VAL B 25 ? ARG B 26 ? VAL B 6 ARG B 7 J 2 VAL B 56 ? ALA B 57 ? VAL B 37 ALA B 38 K 1 VAL B 79 ? ASP B 82 ? VAL B 60 ASP B 63 K 2 HIS B 268 ? ALA B 272 ? HIS B 249 ALA B 253 K 3 LYS B 97 ? GLU B 102 ? LYS B 78 GLU B 83 K 4 PHE B 321 ? LYS B 323 ? PHE B 302 LYS B 304 L 1 SER B 176 ? CYS B 177 ? SER B 157 CYS B 158 L 2 SER B 136 ? HIS B 138 ? SER B 117 HIS B 119 L 3 VAL B 221 ? LYS B 225 ? VAL B 202 LYS B 206 L 4 PHE B 113 ? LYS B 121 ? PHE B 94 LYS B 102 L 5 TYR B 242 ? LEU B 245 ? TYR B 223 LEU B 226 L 6 ARG B 251 ? PRO B 253 ? ARG B 232 PRO B 234 M 1 SER B 176 ? CYS B 177 ? SER B 157 CYS B 158 M 2 SER B 136 ? HIS B 138 ? SER B 117 HIS B 119 M 3 VAL B 221 ? LYS B 225 ? VAL B 202 LYS B 206 M 4 PHE B 113 ? LYS B 121 ? PHE B 94 LYS B 102 M 5 ALA B 263 ? PRO B 266 ? ALA B 244 PRO B 247 N 1 VAL B 361 ? ALA B 365 ? VAL B 342 ALA B 346 N 2 ILE B 385 ? SER B 389 ? ILE B 366 SER B 370 O 1 ALA B 407 ? LEU B 410 ? ALA B 388 LEU B 391 O 2 ALA B 605 ? THR B 608 ? ALA B 586 THR B 589 O 3 VAL B 424 ? ASN B 430 ? VAL B 405 ASN B 411 O 4 CYS B 656 ? LYS B 659 ? CYS B 637 LYS B 640 P 1 GLY B 502 ? CYS B 503 ? GLY B 483 CYS B 484 P 2 SER B 468 ? HIS B 470 ? SER B 449 HIS B 451 P 3 VAL B 549 ? LYS B 553 ? VAL B 530 LYS B 534 P 4 TYR B 445 ? LYS B 452 ? TYR B 426 LYS B 433 P 5 TYR B 578 ? LEU B 581 ? TYR B 559 LEU B 562 P 6 ARG B 587 ? PRO B 589 ? ARG B 568 PRO B 570 Q 1 GLY B 502 ? CYS B 503 ? GLY B 483 CYS B 484 Q 2 SER B 468 ? HIS B 470 ? SER B 449 HIS B 451 Q 3 VAL B 549 ? LYS B 553 ? VAL B 530 LYS B 534 Q 4 TYR B 445 ? LYS B 452 ? TYR B 426 LYS B 433 Q 5 ALA B 599 ? ALA B 601 ? ALA B 580 ALA B 582 # 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 N LYS A 52 ? N LYS A 63 O VAL A 140 ? O VAL A 151 A 2 3 N GLU A 141 ? N GLU A 152 O ALA A 161 ? O ALA A 172 A 3 4 O VAL A 160 ? O VAL A 171 N SER A 99 ? N SER A 110 A 4 5 N VAL A 102 ? N VAL A 113 O VAL A 105 ? O VAL A 116 B 1 2 N VAL A 78 ? N VAL A 89 O SER A 86 ? O SER A 97 B 2 3 N ILE A 90 ? N ILE A 101 O MET A 93 ? O MET A 104 C 1 2 O LYS A 266 ? O LYS A 277 N PHE A 247 ? N PHE A 258 C 2 3 N ILE A 248 ? N ILE A 259 O TYR A 536 ? O TYR A 547 C 3 4 O TRP A 537 ? O TRP A 548 N ASN A 516 ? N ASN A 527 C 4 5 O PHE A 492 ? O PHE A 503 N LEU A 469 ? N LEU A 480 C 5 6 O ASP A 458 ? O ASP A 469 N PHE A 430 ? N PHE A 441 C 6 7 O ARG A 421 ? O ARG A 432 N TYR A 397 ? N TYR A 408 C 7 8 O GLU A 400 ? O GLU A 411 N GLY A 317 ? N GLY A 328 C 8 9 O ILE A 316 ? O ILE A 327 N PHE A 307 ? N PHE A 318 C 9 10 O GLY A 306 ? O GLY A 317 N GLU A 206 ? N GLU A 217 D 1 2 O GLN A 324 ? O GLN A 335 N ARG A 299 ? N ARG A 310 D 2 3 O SER A 298 ? O SER A 309 N ARG A 214 ? N ARG A 225 D 3 4 O LEU A 209 ? O LEU A 220 N LEU A 198 ? N LEU A 209 D 4 5 O THR A 193 ? O THR A 204 N ALA A 184 ? N ALA A 195 D 5 6 N THR A 183 ? N THR A 194 O LEU A 900 ? O LEU A 911 D 6 7 O ASN A 895 ? O ASN A 906 N TYR A 856 ? N TYR A 867 D 7 8 O VAL A 855 ? O VAL A 866 N VAL A 839 ? N VAL A 850 D 8 9 O ASP A 838 ? O ASP A 849 N MET A 798 ? N MET A 809 D 9 10 O TYR A 801 ? O TYR A 812 N TYR A 780 ? N TYR A 791 D 10 11 O GLY A 783 ? O GLY A 794 N THR A 747 ? N THR A 758 D 11 12 O ARG A 754 ? O ARG A 765 N THR A 723 ? N THR A 734 D 12 13 O GLN A 718 ? O GLN A 729 N LEU A 692 ? N LEU A 703 E 1 2 N SER A 487 ? N SER A 498 O ARG A 576 ? O ARG A 587 E 2 3 N VAL A 579 ? N VAL A 590 O VAL A 587 ? O VAL A 598 E 3 4 N ARG A 592 ? N ARG A 603 O SER A 614 ? O SER A 625 E 4 5 N ALA A 617 ? N ALA A 628 O THR A 633 ? O THR A 644 E 5 6 N THR A 630 ? N THR A 641 O GLY A 670 ? O GLY A 681 E 6 7 N ALA A 669 ? N ALA A 680 O TRP A 684 ? O TRP A 695 E 7 8 N TYR A 697 ? N TYR A 708 O THR A 765 ? O THR A 776 F 1 2 N GLN A 230 ? N GLN A 241 O VAL A 278 ? O VAL A 289 G 1 2 N VAL A 238 ? N VAL A 249 O VAL A 270 ? O VAL A 281 H 1 2 N THR A 370 ? N THR A 381 O VAL A 378 ? O VAL A 389 I 1 2 N ILE A 767 ? N ILE A 778 O ALA A 815 ? O ALA A 826 I 2 3 N GLY A 812 ? N GLY A 823 O THR A 824 ? O THR A 835 J 1 2 N VAL B 25 ? N VAL B 6 O ALA B 57 ? O ALA B 38 K 1 2 N LEU B 81 ? N LEU B 62 O THR B 269 ? O THR B 250 K 2 3 O VAL B 270 ? O VAL B 251 N VAL B 100 ? N VAL B 81 K 3 4 N ALA B 101 ? N ALA B 82 O LEU B 322 ? O LEU B 303 L 1 2 O CYS B 177 ? O CYS B 158 N HIS B 138 ? N HIS B 119 L 2 3 N CYS B 137 ? N CYS B 118 O PHE B 223 ? O PHE B 204 L 3 4 O ALA B 222 ? O ALA B 203 N VAL B 119 ? N VAL B 100 L 4 5 N VAL B 120 ? N VAL B 101 O GLU B 243 ? O GLU B 224 L 5 6 N LEU B 244 ? N LEU B 225 O LYS B 252 ? O LYS B 233 M 1 2 O CYS B 177 ? O CYS B 158 N HIS B 138 ? N HIS B 119 M 2 3 N CYS B 137 ? N CYS B 118 O PHE B 223 ? O PHE B 204 M 3 4 O ALA B 222 ? O ALA B 203 N VAL B 119 ? N VAL B 100 M 4 5 N ALA B 116 ? N ALA B 97 O ALA B 263 ? O ALA B 244 N 1 2 N ALA B 365 ? N ALA B 346 O VAL B 388 ? O VAL B 369 O 1 2 N LEU B 410 ? N LEU B 391 O ALA B 605 ? O ALA B 586 O 2 3 O VAL B 606 ? O VAL B 587 N LEU B 427 ? N LEU B 408 O 3 4 N ALA B 428 ? N ALA B 409 O ALA B 658 ? O ALA B 639 P 1 2 O CYS B 503 ? O CYS B 484 N HIS B 470 ? N HIS B 451 P 2 3 N CYS B 469 ? N CYS B 450 O PHE B 551 ? O PHE B 532 P 3 4 O ALA B 550 ? O ALA B 531 N VAL B 450 ? N VAL B 431 P 4 5 N ALA B 449 ? N ALA B 430 O LEU B 581 ? O LEU B 562 P 5 6 N LEU B 580 ? N LEU B 561 O LYS B 588 ? O LYS B 569 Q 1 2 O CYS B 503 ? O CYS B 484 N HIS B 470 ? N HIS B 451 Q 2 3 N CYS B 469 ? N CYS B 450 O PHE B 551 ? O PHE B 532 Q 3 4 O ALA B 550 ? O ALA B 531 N VAL B 450 ? N VAL B 431 Q 4 5 N TYR B 445 ? N TYR B 426 O ALA B 601 ? O ALA B 582 # 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 ? ? ? ? 8 'BINDING SITE FOR RESIDUE C8E A 1001' AC2 Software ? ? ? ? 8 'BINDING SITE FOR RESIDUE C8E A 1002' AC3 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE NAG B 701' AC4 Software ? ? ? ? 6 'BINDING SITE FOR RESIDUE NAG B 702' AC5 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE BMA B 703' AC6 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE MAN B 704' AC7 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE NAG B 705' AC8 Software ? ? ? ? 2 'BINDING SITE FOR RESIDUE GAL B 706' AC9 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE SIA B 707' BC1 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE MAN B 708' BC2 Software ? ? ? ? 2 'BINDING SITE FOR RESIDUE NAG B 709' BC3 Software ? ? ? ? 1 'BINDING SITE FOR RESIDUE GAL B 710' BC4 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE NAG B 711' BC5 Software ? ? ? ? 2 'BINDING SITE FOR RESIDUE NAG B 712' BC6 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE BMA B 713' BC7 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE MAN B 714' BC8 Software ? ? ? ? 2 'BINDING SITE FOR RESIDUE NAG B 715' BC9 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE GAL B 716' CC1 Software ? ? ? ? 6 'BINDING SITE FOR RESIDUE SIA B 717' CC2 Software ? ? ? ? 2 'BINDING SITE FOR RESIDUE MAN B 718' CC3 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE NAG B 719' # 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 8 SER A 395 ? SER A 406 . ? 1_555 ? 2 AC1 8 ARG A 421 ? ARG A 432 . ? 1_555 ? 3 AC1 8 GLY A 423 ? GLY A 434 . ? 1_555 ? 4 AC1 8 GLY A 463 ? GLY A 474 . ? 1_555 ? 5 AC1 8 GLU A 464 ? GLU A 475 . ? 1_555 ? 6 AC1 8 SER A 465 ? SER A 476 . ? 1_555 ? 7 AC1 8 ARG A 467 ? ARG A 478 . ? 1_555 ? 8 AC1 8 GLY A 496 ? GLY A 507 . ? 1_555 ? 9 AC2 8 LYS A 825 ? LYS A 836 . ? 1_555 ? 10 AC2 8 ALA A 828 ? ALA A 839 . ? 1_555 ? 11 AC2 8 ARG A 829 ? ARG A 840 . ? 1_555 ? 12 AC2 8 ARG A 830 ? ARG A 841 . ? 1_555 ? 13 AC2 8 ARG A 832 ? ARG A 843 . ? 1_555 ? 14 AC2 8 ARG A 862 ? ARG A 873 . ? 1_555 ? 15 AC2 8 HOH X . ? HOH A 1159 . ? 1_555 ? 16 AC2 8 HOH X . ? HOH A 1186 . ? 1_555 ? 17 AC3 4 ALA A 350 ? ALA A 361 . ? 1_555 ? 18 AC3 4 ASN A 371 ? ASN A 382 . ? 1_555 ? 19 AC3 4 ASN B 432 ? ASN B 413 . ? 1_555 ? 20 AC3 4 NAG F . ? NAG B 702 . ? 1_555 ? 21 AC4 6 GLY B 444 ? GLY B 425 . ? 1_555 ? 22 AC4 6 ALA B 594 ? ALA B 575 . ? 1_555 ? 23 AC4 6 ARG B 600 ? ARG B 581 . ? 1_555 ? 24 AC4 6 NAG E . ? NAG B 701 . ? 1_555 ? 25 AC4 6 BMA G . ? BMA B 703 . ? 1_555 ? 26 AC4 6 MAN L . ? MAN B 708 . ? 1_555 ? 27 AC5 4 ALA B 594 ? ALA B 575 . ? 1_555 ? 28 AC5 4 NAG F . ? NAG B 702 . ? 1_555 ? 29 AC5 4 MAN H . ? MAN B 704 . ? 1_555 ? 30 AC5 4 MAN L . ? MAN B 708 . ? 1_555 ? 31 AC6 5 ARG A 511 ? ARG A 522 . ? 1_555 ? 32 AC6 5 TYR A 513 ? TYR A 524 . ? 1_555 ? 33 AC6 5 BMA G . ? BMA B 703 . ? 1_555 ? 34 AC6 5 NAG I . ? NAG B 705 . ? 1_555 ? 35 AC6 5 HOH Y . ? HOH B 813 . ? 1_555 ? 36 AC7 4 ASN A 544 ? ASN A 555 . ? 1_555 ? 37 AC7 4 MAN H . ? MAN B 704 . ? 1_555 ? 38 AC7 4 GAL J . ? GAL B 706 . ? 1_555 ? 39 AC7 4 SIA K . ? SIA B 707 . ? 1_555 ? 40 AC8 2 NAG I . ? NAG B 705 . ? 1_555 ? 41 AC8 2 SIA K . ? SIA B 707 . ? 1_555 ? 42 AC9 3 ASN A 544 ? ASN A 555 . ? 1_555 ? 43 AC9 3 NAG I . ? NAG B 705 . ? 1_555 ? 44 AC9 3 GAL J . ? GAL B 706 . ? 1_555 ? 45 BC1 5 ALA B 594 ? ALA B 575 . ? 1_555 ? 46 BC1 5 ARG B 600 ? ARG B 581 . ? 1_555 ? 47 BC1 5 NAG F . ? NAG B 702 . ? 1_555 ? 48 BC1 5 BMA G . ? BMA B 703 . ? 1_555 ? 49 BC1 5 NAG M . ? NAG B 709 . ? 1_555 ? 50 BC2 2 MAN L . ? MAN B 708 . ? 1_555 ? 51 BC2 2 GAL N . ? GAL B 710 . ? 1_555 ? 52 BC3 1 NAG M . ? NAG B 709 . ? 1_555 ? 53 BC4 4 GLY A 119 ? GLY A 130 . ? 1_555 ? 54 BC4 4 ASN B 630 ? ASN B 611 . ? 1_555 ? 55 BC4 4 ARG B 642 ? ARG B 623 . ? 1_555 ? 56 BC4 4 NAG P . ? NAG B 712 . ? 1_555 ? 57 BC5 2 NAG O . ? NAG B 711 . ? 1_555 ? 58 BC5 2 BMA Q . ? BMA B 713 . ? 1_555 ? 59 BC6 3 NAG P . ? NAG B 712 . ? 1_555 ? 60 BC6 3 MAN R . ? MAN B 714 . ? 1_555 ? 61 BC6 3 MAN V . ? MAN B 718 . ? 1_555 ? 62 BC7 3 ASN A 287 ? ASN A 298 . ? 1_555 ? 63 BC7 3 BMA Q . ? BMA B 713 . ? 1_555 ? 64 BC7 3 NAG S . ? NAG B 715 . ? 1_555 ? 65 BC8 2 MAN R . ? MAN B 714 . ? 1_555 ? 66 BC8 2 GAL T . ? GAL B 716 . ? 1_555 ? 67 BC9 3 ARG A 275 ? ARG A 286 . ? 1_555 ? 68 BC9 3 NAG S . ? NAG B 715 . ? 1_555 ? 69 BC9 3 SIA U . ? SIA B 717 . ? 1_555 ? 70 CC1 6 VAL A 229 ? VAL A 240 . ? 1_555 ? 71 CC1 6 GLN A 230 ? GLN A 241 . ? 1_555 ? 72 CC1 6 SER A 231 ? SER A 242 . ? 1_555 ? 73 CC1 6 ASN A 287 ? ASN A 298 . ? 1_555 ? 74 CC1 6 PHE A 289 ? PHE A 300 . ? 1_555 ? 75 CC1 6 GAL T . ? GAL B 716 . ? 1_555 ? 76 CC2 2 BMA Q . ? BMA B 713 . ? 1_555 ? 77 CC2 2 NAG W . ? NAG B 719 . ? 1_555 ? 78 CC3 3 LYS B 646 ? LYS B 627 . ? 1_555 ? 79 CC3 3 MAN V . ? MAN B 718 . ? 1_555 ? 80 CC3 3 HOH Y . ? HOH B 839 . ? 1_555 ? # _database_PDB_matrix.entry_id 3V8X _database_PDB_matrix.origx[1][1] 1.000000 _database_PDB_matrix.origx[1][2] 0.000000 _database_PDB_matrix.origx[1][3] 0.000000 _database_PDB_matrix.origx[2][1] 0.000000 _database_PDB_matrix.origx[2][2] 1.000000 _database_PDB_matrix.origx[2][3] 0.000000 _database_PDB_matrix.origx[3][1] 0.000000 _database_PDB_matrix.origx[3][2] 0.000000 _database_PDB_matrix.origx[3][3] 1.000000 _database_PDB_matrix.origx_vector[1] 0.00000 _database_PDB_matrix.origx_vector[2] 0.00000 _database_PDB_matrix.origx_vector[3] 0.00000 # _atom_sites.entry_id 3V8X _atom_sites.fract_transf_matrix[1][1] 0.010987 _atom_sites.fract_transf_matrix[1][2] 0.000000 _atom_sites.fract_transf_matrix[1][3] 0.000000 _atom_sites.fract_transf_matrix[2][1] 0.000000 _atom_sites.fract_transf_matrix[2][2] 0.007730 _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] 0.005036 _atom_sites.fract_transf_vector[1] 0.00000 _atom_sites.fract_transf_vector[2] 0.00000 _atom_sites.fract_transf_vector[3] 0.00000 # loop_ _atom_type.symbol C N O S # loop_ _atom_site.group_PDB _atom_site.id _atom_site.type_symbol _atom_site.label_atom_id _atom_site.label_alt_id _atom_site.label_comp_id _atom_site.label_asym_id _atom_site.label_entity_id _atom_site.label_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.B_iso_or_equiv _atom_site.pdbx_formal_charge _atom_site.auth_seq_id _atom_site.auth_comp_id _atom_site.auth_asym_id _atom_site.auth_atom_id _atom_site.pdbx_PDB_model_num ATOM 1 N N . GLU A 1 43 ? 54.353 -52.727 58.119 1.00 90.07 ? 54 GLU A N 1 ATOM 2 C CA . GLU A 1 43 ? 55.181 -52.860 56.923 1.00 102.31 ? 54 GLU A CA 1 ATOM 3 C C . GLU A 1 43 ? 54.896 -51.769 55.889 1.00 106.64 ? 54 GLU A C 1 ATOM 4 O O . GLU A 1 43 ? 53.741 -51.393 55.666 1.00 94.77 ? 54 GLU A O 1 ATOM 5 C CB . GLU A 1 43 ? 54.999 -54.241 56.296 1.00 101.16 ? 54 GLU A CB 1 ATOM 6 C CG . GLU A 1 43 ? 55.966 -54.536 55.169 1.00 100.39 ? 54 GLU A CG 1 ATOM 7 C CD . GLU A 1 43 ? 55.934 -55.988 54.757 1.00 112.25 ? 54 GLU A CD 1 ATOM 8 O OE1 . GLU A 1 43 ? 55.275 -56.789 55.456 1.00 115.31 ? 54 GLU A OE1 1 ATOM 9 O OE2 . GLU A 1 43 ? 56.567 -56.329 53.736 1.00 116.68 ? 54 GLU A OE2 1 ATOM 10 N N . VAL A 1 44 ? 55.962 -51.277 55.261 1.00 109.72 ? 55 VAL A N 1 ATOM 11 C CA . VAL A 1 44 ? 55.885 -50.162 54.319 1.00 105.60 ? 55 VAL A CA 1 ATOM 12 C C . VAL A 1 44 ? 54.896 -50.382 53.178 1.00 109.14 ? 55 VAL A C 1 ATOM 13 O O . VAL A 1 44 ? 54.104 -49.499 52.862 1.00 114.19 ? 55 VAL A O 1 ATOM 14 C CB . VAL A 1 44 ? 57.271 -49.825 53.730 1.00 103.68 ? 55 VAL A CB 1 ATOM 15 C CG1 . VAL A 1 44 ? 58.028 -48.907 54.663 1.00 101.29 ? 55 VAL A CG1 1 ATOM 16 C CG2 . VAL A 1 44 ? 58.063 -51.097 53.459 1.00 107.98 ? 55 VAL A CG2 1 ATOM 17 N N . THR A 1 45 ? 54.944 -51.555 52.558 1.00 112.90 ? 56 THR A N 1 ATOM 18 C CA . THR A 1 45 ? 54.004 -51.873 51.489 1.00 119.02 ? 56 THR A CA 1 ATOM 19 C C . THR A 1 45 ? 52.893 -52.810 51.977 1.00 126.02 ? 56 THR A C 1 ATOM 20 O O . THR A 1 45 ? 53.116 -54.000 52.208 1.00 134.91 ? 56 THR A O 1 ATOM 21 C CB . THR A 1 45 ? 54.719 -52.436 50.236 1.00 116.97 ? 56 THR A CB 1 ATOM 22 O OG1 . THR A 1 45 ? 53.755 -53.018 49.349 1.00 114.41 ? 56 THR A OG1 1 ATOM 23 C CG2 . THR A 1 45 ? 55.759 -53.481 50.625 1.00 112.59 ? 56 THR A CG2 1 ATOM 24 N N . GLY A 1 46 ? 51.695 -52.258 52.140 1.00 115.71 ? 57 GLY A N 1 ATOM 25 C CA . GLY A 1 46 ? 51.457 -50.864 51.822 1.00 106.75 ? 57 GLY A CA 1 ATOM 26 C C . GLY A 1 46 ? 50.722 -50.083 52.892 1.00 108.10 ? 57 GLY A C 1 ATOM 27 O O . GLY A 1 46 ? 49.643 -50.476 53.336 1.00 102.80 ? 57 GLY A O 1 ATOM 28 N N . LEU A 1 47 ? 51.317 -48.971 53.312 1.00 109.84 ? 58 LEU A N 1 ATOM 29 C CA . LEU A 1 47 ? 50.621 -48.003 54.151 1.00 105.63 ? 58 LEU A CA 1 ATOM 30 C C . LEU A 1 47 ? 49.849 -47.036 53.263 1.00 108.46 ? 58 LEU A C 1 ATOM 31 O O . LEU A 1 47 ? 50.168 -46.879 52.083 1.00 103.27 ? 58 LEU A O 1 ATOM 32 C CB . LEU A 1 47 ? 51.593 -47.247 55.066 1.00 105.91 ? 58 LEU A CB 1 ATOM 33 C CG . LEU A 1 47 ? 53.062 -47.093 54.657 1.00 107.23 ? 58 LEU A CG 1 ATOM 34 C CD1 . LEU A 1 47 ? 53.208 -46.355 53.336 1.00 108.38 ? 58 LEU A CD1 1 ATOM 35 C CD2 . LEU A 1 47 ? 53.853 -46.388 55.748 1.00 73.12 ? 58 LEU A CD2 1 ATOM 36 N N . GLY A 1 48 ? 48.830 -46.398 53.826 1.00 115.92 ? 59 GLY A N 1 ATOM 37 C CA . GLY A 1 48 ? 47.980 -45.507 53.055 1.00 112.99 ? 59 GLY A CA 1 ATOM 38 C C . GLY A 1 48 ? 47.038 -46.278 52.149 1.00 105.99 ? 59 GLY A C 1 ATOM 39 O O . GLY A 1 48 ? 46.397 -45.706 51.268 1.00 100.43 ? 59 GLY A O 1 ATOM 40 N N . LYS A 1 49 ? 46.957 -47.587 52.370 1.00 99.13 ? 60 LYS A N 1 ATOM 41 C CA . LYS A 1 49 ? 46.082 -48.447 51.586 1.00 79.85 ? 60 LYS A CA 1 ATOM 42 C C . LYS A 1 49 ? 44.763 -48.690 52.306 1.00 77.55 ? 60 LYS A C 1 ATOM 43 O O . LYS A 1 49 ? 44.593 -48.335 53.473 1.00 72.70 ? 60 LYS A O 1 ATOM 44 C CB . LYS A 1 49 ? 46.753 -49.794 51.312 1.00 75.82 ? 60 LYS A CB 1 ATOM 45 C CG . LYS A 1 49 ? 48.056 -49.718 50.536 1.00 82.61 ? 60 LYS A CG 1 ATOM 46 C CD . LYS A 1 49 ? 47.817 -49.475 49.059 1.00 79.74 ? 60 LYS A CD 1 ATOM 47 C CE . LYS A 1 49 ? 49.122 -49.535 48.287 1.00 76.66 ? 60 LYS A CE 1 ATOM 48 N NZ . LYS A 1 49 ? 48.964 -49.076 46.881 1.00 84.15 ? 60 LYS A NZ 1 ATOM 49 N N . LEU A 1 50 ? 43.835 -49.311 51.593 1.00 73.71 ? 61 LEU A N 1 ATOM 50 C CA . LEU A 1 50 ? 42.538 -49.656 52.139 1.00 69.80 ? 61 LEU A CA 1 ATOM 51 C C . LEU A 1 50 ? 42.046 -50.870 51.384 1.00 70.90 ? 61 LEU A C 1 ATOM 52 O O . LEU A 1 50 ? 41.524 -50.748 50.281 1.00 87.68 ? 61 LEU A O 1 ATOM 53 C CB . LEU A 1 50 ? 41.556 -48.504 51.952 1.00 72.12 ? 61 LEU A CB 1 ATOM 54 C CG . LEU A 1 50 ? 40.155 -48.748 52.510 1.00 78.59 ? 61 LEU A CG 1 ATOM 55 C CD1 . LEU A 1 50 ? 40.184 -48.798 54.033 1.00 81.64 ? 61 LEU A CD1 1 ATOM 56 C CD2 . LEU A 1 50 ? 39.185 -47.686 52.016 1.00 76.54 ? 61 LEU A CD2 1 ATOM 57 N N . VAL A 1 51 ? 42.224 -52.044 51.976 1.00 79.20 ? 62 VAL A N 1 ATOM 58 C CA . VAL A 1 51 ? 41.906 -53.291 51.296 1.00 77.96 ? 62 VAL A CA 1 ATOM 59 C C . VAL A 1 51 ? 40.549 -53.848 51.718 1.00 72.31 ? 62 VAL A C 1 ATOM 60 O O . VAL A 1 51 ? 40.218 -53.874 52.901 1.00 72.10 ? 62 VAL A O 1 ATOM 61 C CB . VAL A 1 51 ? 43.006 -54.343 51.532 1.00 76.29 ? 62 VAL A CB 1 ATOM 62 C CG1 . VAL A 1 51 ? 42.686 -55.630 50.789 1.00 74.71 ? 62 VAL A CG1 1 ATOM 63 C CG2 . VAL A 1 51 ? 44.351 -53.792 51.093 1.00 67.20 ? 62 VAL A CG2 1 ATOM 64 N N . LYS A 1 52 ? 39.766 -54.272 50.730 1.00 67.48 ? 63 LYS A N 1 ATOM 65 C CA . LYS A 1 52 ? 38.480 -54.910 50.967 1.00 66.55 ? 63 LYS A CA 1 ATOM 66 C C . LYS A 1 52 ? 38.458 -56.241 50.234 1.00 72.27 ? 63 LYS A C 1 ATOM 67 O O . LYS A 1 52 ? 38.890 -56.332 49.088 1.00 75.45 ? 63 LYS A O 1 ATOM 68 C CB . LYS A 1 52 ? 37.335 -54.030 50.461 1.00 61.44 ? 63 LYS A CB 1 ATOM 69 C CG . LYS A 1 52 ? 37.239 -52.664 51.113 1.00 58.59 ? 63 LYS A CG 1 ATOM 70 C CD . LYS A 1 52 ? 36.110 -51.848 50.502 1.00 62.52 ? 63 LYS A CD 1 ATOM 71 C CE . LYS A 1 52 ? 36.005 -50.480 51.153 1.00 70.14 ? 63 LYS A CE 1 ATOM 72 N NZ . LYS A 1 52 ? 35.734 -50.582 52.619 1.00 85.48 ? 63 LYS A NZ 1 ATOM 73 N N . SER A 1 53 ? 37.958 -57.275 50.896 1.00 74.15 ? 64 SER A N 1 ATOM 74 C CA . SER A 1 53 ? 37.911 -58.600 50.298 1.00 73.55 ? 64 SER A CA 1 ATOM 75 C C . SER A 1 53 ? 36.513 -58.910 49.791 1.00 71.00 ? 64 SER A C 1 ATOM 76 O O . SER A 1 53 ? 35.580 -58.141 50.007 1.00 72.61 ? 64 SER A O 1 ATOM 77 C CB . SER A 1 53 ? 38.309 -59.652 51.325 1.00 68.73 ? 64 SER A CB 1 ATOM 78 O OG . SER A 1 53 ? 37.325 -59.733 52.341 1.00 81.99 ? 64 SER A OG 1 ATOM 79 N N . SER A 1 54 ? 36.377 -60.051 49.129 1.00 74.41 ? 65 SER A N 1 ATOM 80 C CA . SER A 1 54 ? 35.085 -60.508 48.643 1.00 73.48 ? 65 SER A CA 1 ATOM 81 C C . SER A 1 54 ? 34.124 -60.728 49.805 1.00 83.40 ? 65 SER A C 1 ATOM 82 O O . SER A 1 54 ? 32.933 -60.433 49.702 1.00 87.50 ? 65 SER A O 1 ATOM 83 C CB . SER A 1 54 ? 35.251 -61.804 47.850 1.00 70.30 ? 65 SER A CB 1 ATOM 84 O OG . SER A 1 54 ? 34.025 -62.201 47.265 1.00 75.65 ? 65 SER A OG 1 ATOM 85 N N . ASP A 1 55 ? 34.650 -61.243 50.912 1.00 86.48 ? 66 ASP A N 1 ATOM 86 C CA . ASP A 1 55 ? 33.834 -61.505 52.091 1.00 91.18 ? 66 ASP A CA 1 ATOM 87 C C . ASP A 1 55 ? 33.366 -60.209 52.741 1.00 81.11 ? 66 ASP A C 1 ATOM 88 O O . ASP A 1 55 ? 32.206 -60.091 53.135 1.00 81.70 ? 66 ASP A O 1 ATOM 89 C CB . ASP A 1 55 ? 34.602 -62.358 53.102 1.00 94.00 ? 66 ASP A CB 1 ATOM 90 C CG . ASP A 1 55 ? 34.944 -63.732 52.563 1.00 99.64 ? 66 ASP A CG 1 ATOM 91 O OD1 . ASP A 1 55 ? 34.052 -64.606 52.557 1.00 88.47 ? 66 ASP A OD1 1 ATOM 92 O OD2 . ASP A 1 55 ? 36.103 -63.939 52.147 1.00 115.59 ? 66 ASP A OD2 1 ATOM 93 N N . THR A 1 56 ? 34.276 -59.246 52.852 1.00 68.86 ? 67 THR A N 1 ATOM 94 C CA . THR A 1 56 ? 33.954 -57.933 53.399 1.00 77.34 ? 67 THR A CA 1 ATOM 95 C C . THR A 1 56 ? 32.796 -57.303 52.630 1.00 77.58 ? 67 THR A C 1 ATOM 96 O O . THR A 1 56 ? 31.925 -56.650 53.210 1.00 74.44 ? 67 THR A O 1 ATOM 97 C CB . THR A 1 56 ? 35.165 -56.985 53.320 1.00 83.54 ? 67 THR A CB 1 ATOM 98 O OG1 . THR A 1 56 ? 36.296 -57.596 53.955 1.00 90.17 ? 67 THR A OG1 1 ATOM 99 C CG2 . THR A 1 56 ? 34.854 -55.648 53.994 1.00 73.85 ? 67 THR A CG2 1 ATOM 100 N N . LEU A 1 57 ? 32.795 -57.515 51.318 1.00 69.61 ? 68 LEU A N 1 ATOM 101 C CA . LEU A 1 57 ? 31.754 -56.976 50.454 1.00 76.51 ? 68 LEU A CA 1 ATOM 102 C C . LEU A 1 57 ? 30.394 -57.618 50.728 1.00 80.86 ? 68 LEU A C 1 ATOM 103 O O . LEU A 1 57 ? 29.394 -56.919 50.887 1.00 88.50 ? 68 LEU A O 1 ATOM 104 C CB . LEU A 1 57 ? 32.137 -57.137 48.978 1.00 72.59 ? 68 LEU A CB 1 ATOM 105 C CG . LEU A 1 57 ? 32.871 -55.982 48.290 1.00 69.42 ? 68 LEU A CG 1 ATOM 106 C CD1 . LEU A 1 57 ? 34.063 -55.504 49.104 1.00 71.55 ? 68 LEU A CD1 1 ATOM 107 C CD2 . LEU A 1 57 ? 33.308 -56.381 46.887 1.00 73.23 ? 68 LEU A CD2 1 ATOM 108 N N . SER A 1 58 ? 30.359 -58.945 50.787 1.00 67.87 ? 69 SER A N 1 ATOM 109 C CA . SER A 1 58 ? 29.110 -59.661 51.024 1.00 65.93 ? 69 SER A CA 1 ATOM 110 C C . SER A 1 58 ? 28.545 -59.382 52.417 1.00 72.81 ? 69 SER A C 1 ATOM 111 O O . SER A 1 58 ? 27.332 -59.400 52.617 1.00 76.89 ? 69 SER A O 1 ATOM 112 C CB . SER A 1 58 ? 29.305 -61.164 50.823 1.00 70.97 ? 69 SER A CB 1 ATOM 113 O OG . SER A 1 58 ? 29.685 -61.454 49.491 1.00 76.55 ? 69 SER A OG 1 ATOM 114 N N . LYS A 1 59 ? 29.431 -59.122 53.373 1.00 77.40 ? 70 LYS A N 1 ATOM 115 C CA . LYS A 1 59 ? 29.020 -58.842 54.744 1.00 81.92 ? 70 LYS A CA 1 ATOM 116 C C . LYS A 1 59 ? 28.355 -57.477 54.845 1.00 80.15 ? 70 LYS A C 1 ATOM 117 O O . LYS A 1 59 ? 27.366 -57.310 55.557 1.00 84.13 ? 70 LYS A O 1 ATOM 118 C CB . LYS A 1 59 ? 30.223 -58.904 55.688 1.00 77.20 ? 70 LYS A CB 1 ATOM 119 C CG . LYS A 1 59 ? 29.898 -58.640 57.153 1.00 86.73 ? 70 LYS A CG 1 ATOM 120 C CD . LYS A 1 59 ? 31.170 -58.625 57.995 1.00 94.89 ? 70 LYS A CD 1 ATOM 121 C CE . LYS A 1 59 ? 30.873 -58.638 59.488 1.00 92.58 ? 70 LYS A CE 1 ATOM 122 N NZ . LYS A 1 59 ? 32.130 -58.683 60.291 1.00 78.72 ? 70 LYS A NZ 1 ATOM 123 N N . GLU A 1 60 ? 28.903 -56.500 54.129 1.00 65.63 ? 71 GLU A N 1 ATOM 124 C CA . GLU A 1 60 ? 28.368 -55.144 54.167 1.00 76.50 ? 71 GLU A CA 1 ATOM 125 C C . GLU A 1 60 ? 27.224 -54.953 53.171 1.00 83.78 ? 71 GLU A C 1 ATOM 126 O O . GLU A 1 60 ? 26.636 -53.872 53.090 1.00 86.34 ? 71 GLU A O 1 ATOM 127 C CB . GLU A 1 60 ? 29.479 -54.114 53.932 1.00 68.74 ? 71 GLU A CB 1 ATOM 128 C CG . GLU A 1 60 ? 30.533 -54.087 55.035 1.00 74.87 ? 71 GLU A CG 1 ATOM 129 C CD . GLU A 1 60 ? 31.585 -53.008 54.832 1.00 91.93 ? 71 GLU A CD 1 ATOM 130 O OE1 . GLU A 1 60 ? 31.491 -52.259 53.835 1.00 94.60 ? 71 GLU A OE1 1 ATOM 131 O OE2 . GLU A 1 60 ? 32.507 -52.908 55.672 1.00 91.77 ? 71 GLU A OE2 1 ATOM 132 N N . GLN A 1 61 ? 26.911 -56.015 52.431 1.00 83.74 ? 72 GLN A N 1 ATOM 133 C CA . GLN A 1 61 ? 25.844 -56.001 51.429 1.00 72.64 ? 72 GLN A CA 1 ATOM 134 C C . GLN A 1 61 ? 25.994 -54.862 50.420 1.00 74.17 ? 72 GLN A C 1 ATOM 135 O O . GLN A 1 61 ? 25.070 -54.069 50.219 1.00 79.39 ? 72 GLN A O 1 ATOM 136 C CB . GLN A 1 61 ? 24.464 -55.948 52.095 1.00 65.01 ? 72 GLN A CB 1 ATOM 137 C CG . GLN A 1 61 ? 23.697 -57.263 52.060 1.00 61.93 ? 72 GLN A CG 1 ATOM 138 C CD . GLN A 1 61 ? 22.369 -57.179 52.798 1.00 80.39 ? 72 GLN A CD 1 ATOM 139 O OE1 . GLN A 1 61 ? 22.253 -56.494 53.815 1.00 78.51 ? 72 GLN A OE1 1 ATOM 140 N NE2 . GLN A 1 61 ? 21.358 -57.872 52.284 1.00 69.27 ? 72 GLN A NE2 1 ATOM 141 N N . VAL A 1 62 ? 27.165 -54.782 49.796 1.00 64.71 ? 73 VAL A N 1 ATOM 142 C CA . VAL A 1 62 ? 27.405 -53.779 48.766 1.00 70.19 ? 73 VAL A CA 1 ATOM 143 C C . VAL A 1 62 ? 27.027 -54.315 47.388 1.00 74.06 ? 73 VAL A C 1 ATOM 144 O O . VAL A 1 62 ? 27.605 -55.286 46.898 1.00 61.70 ? 73 VAL A O 1 ATOM 145 C CB . VAL A 1 62 ? 28.863 -53.257 48.782 1.00 63.20 ? 73 VAL A CB 1 ATOM 146 C CG1 . VAL A 1 62 ? 29.815 -54.355 49.148 1.00 65.23 ? 73 VAL A CG1 1 ATOM 147 C CG2 . VAL A 1 62 ? 29.234 -52.650 47.439 1.00 62.58 ? 73 VAL A CG2 1 ATOM 148 N N . LEU A 1 63 ? 26.035 -53.673 46.781 1.00 72.94 ? 74 LEU A N 1 ATOM 149 C CA . LEU A 1 63 ? 25.520 -54.090 45.489 1.00 65.45 ? 74 LEU A CA 1 ATOM 150 C C . LEU A 1 63 ? 25.746 -52.989 44.467 1.00 74.15 ? 74 LEU A C 1 ATOM 151 O O . LEU A 1 63 ? 25.949 -53.252 43.282 1.00 70.84 ? 74 LEU A O 1 ATOM 152 C CB . LEU A 1 63 ? 24.032 -54.404 45.610 1.00 57.25 ? 74 LEU A CB 1 ATOM 153 C CG . LEU A 1 63 ? 23.730 -55.504 46.628 1.00 67.11 ? 74 LEU A CG 1 ATOM 154 C CD1 . LEU A 1 63 ? 22.244 -55.580 46.936 1.00 73.02 ? 74 LEU A CD1 1 ATOM 155 C CD2 . LEU A 1 63 ? 24.236 -56.829 46.101 1.00 53.50 ? 74 LEU A CD2 1 ATOM 156 N N . ASN A 1 64 ? 25.718 -51.750 44.943 1.00 78.07 ? 75 ASN A N 1 ATOM 157 C CA . ASN A 1 64 ? 25.936 -50.589 44.096 1.00 66.74 ? 75 ASN A CA 1 ATOM 158 C C . ASN A 1 64 ? 27.354 -50.053 44.260 1.00 60.38 ? 75 ASN A C 1 ATOM 159 O O . ASN A 1 64 ? 28.008 -50.316 45.265 1.00 70.52 ? 75 ASN A O 1 ATOM 160 C CB . ASN A 1 64 ? 24.916 -49.501 44.434 1.00 62.59 ? 75 ASN A CB 1 ATOM 161 C CG . ASN A 1 64 ? 24.879 -48.401 43.406 1.00 67.06 ? 75 ASN A CG 1 ATOM 162 O OD1 . ASN A 1 64 ? 25.644 -47.440 43.481 1.00 68.55 ? 75 ASN A OD1 1 ATOM 163 N ND2 . ASN A 1 64 ? 23.988 -48.533 42.433 1.00 84.54 ? 75 ASN A ND2 1 ATOM 164 N N . ILE A 1 65 ? 27.827 -49.303 43.272 1.00 65.85 ? 76 ILE A N 1 ATOM 165 C CA . ILE A 1 65 ? 29.166 -48.729 43.322 1.00 63.16 ? 76 ILE A CA 1 ATOM 166 C C . ILE A 1 65 ? 29.264 -47.716 44.462 1.00 68.64 ? 76 ILE A C 1 ATOM 167 O O . ILE A 1 65 ? 30.348 -47.448 44.988 1.00 67.44 ? 76 ILE A O 1 ATOM 168 C CB . ILE A 1 65 ? 29.541 -48.062 41.978 1.00 60.17 ? 76 ILE A CB 1 ATOM 169 C CG1 . ILE A 1 65 ? 31.004 -47.609 41.988 1.00 68.49 ? 76 ILE A CG1 1 ATOM 170 C CG2 . ILE A 1 65 ? 28.597 -46.908 41.664 1.00 65.40 ? 76 ILE A CG2 1 ATOM 171 C CD1 . ILE A 1 65 ? 31.322 -46.526 40.989 1.00 43.01 ? 76 ILE A CD1 1 ATOM 172 N N . ARG A 1 66 ? 28.113 -47.177 44.851 1.00 75.01 ? 77 ARG A N 1 ATOM 173 C CA . ARG A 1 66 ? 28.038 -46.177 45.908 1.00 73.90 ? 77 ARG A CA 1 ATOM 174 C C . ARG A 1 66 ? 28.108 -46.792 47.305 1.00 63.92 ? 77 ARG A C 1 ATOM 175 O O . ARG A 1 66 ? 28.504 -46.126 48.257 1.00 69.56 ? 77 ARG A O 1 ATOM 176 C CB . ARG A 1 66 ? 26.774 -45.329 45.744 1.00 48.78 ? 77 ARG A CB 1 ATOM 177 C CG . ARG A 1 66 ? 26.820 -44.424 44.518 1.00 47.19 ? 77 ARG A CG 1 ATOM 178 C CD . ARG A 1 66 ? 25.428 -44.134 43.962 1.00 53.34 ? 77 ARG A CD 1 ATOM 179 N NE . ARG A 1 66 ? 25.490 -43.415 42.694 1.00 45.27 ? 77 ARG A NE 1 ATOM 180 C CZ . ARG A 1 66 ? 25.590 -44.005 41.504 1.00 75.01 ? 77 ARG A CZ 1 ATOM 181 N NH1 . ARG A 1 66 ? 25.639 -45.331 41.422 1.00 55.27 ? 77 ARG A NH1 1 ATOM 182 N NH2 . ARG A 1 66 ? 25.641 -43.272 40.394 1.00 42.67 ? 77 ARG A NH2 1 ATOM 183 N N . ASP A 1 67 ? 27.733 -48.063 47.421 1.00 63.51 ? 78 ASP A N 1 ATOM 184 C CA . ASP A 1 67 ? 27.796 -48.769 48.699 1.00 64.87 ? 78 ASP A CA 1 ATOM 185 C C . ASP A 1 67 ? 29.235 -49.062 49.110 1.00 62.00 ? 78 ASP A C 1 ATOM 186 O O . ASP A 1 67 ? 29.540 -49.172 50.292 1.00 69.24 ? 78 ASP A O 1 ATOM 187 C CB . ASP A 1 67 ? 27.033 -50.097 48.627 1.00 70.20 ? 78 ASP A CB 1 ATOM 188 C CG . ASP A 1 67 ? 25.590 -49.929 48.198 1.00 76.33 ? 78 ASP A CG 1 ATOM 189 O OD1 . ASP A 1 67 ? 25.075 -48.793 48.264 1.00 82.25 ? 78 ASP A OD1 1 ATOM 190 O OD2 . ASP A 1 67 ? 24.971 -50.944 47.802 1.00 61.14 ? 78 ASP A OD2 1 ATOM 191 N N . LEU A 1 68 ? 30.112 -49.192 48.122 1.00 59.90 ? 79 LEU A N 1 ATOM 192 C CA . LEU A 1 68 ? 31.470 -49.694 48.331 1.00 59.07 ? 79 LEU A CA 1 ATOM 193 C C . LEU A 1 68 ? 32.343 -48.822 49.238 1.00 66.75 ? 79 LEU A C 1 ATOM 194 O O . LEU A 1 68 ? 33.066 -49.337 50.086 1.00 71.50 ? 79 LEU A O 1 ATOM 195 C CB . LEU A 1 68 ? 32.148 -49.901 46.975 1.00 62.42 ? 79 LEU A CB 1 ATOM 196 C CG . LEU A 1 68 ? 33.403 -50.764 46.868 1.00 52.27 ? 79 LEU A CG 1 ATOM 197 C CD1 . LEU A 1 68 ? 34.644 -49.924 47.080 1.00 53.14 ? 79 LEU A CD1 1 ATOM 198 C CD2 . LEU A 1 68 ? 33.343 -51.927 47.853 1.00 52.51 ? 79 LEU A CD2 1 ATOM 199 N N . THR A 1 69 ? 32.286 -47.509 49.052 1.00 68.70 ? 80 THR A N 1 ATOM 200 C CA . THR A 1 69 ? 33.075 -46.594 49.870 1.00 65.94 ? 80 THR A CA 1 ATOM 201 C C . THR A 1 69 ? 32.166 -45.761 50.769 1.00 66.16 ? 80 THR A C 1 ATOM 202 O O . THR A 1 69 ? 32.535 -44.679 51.223 1.00 67.85 ? 80 THR A O 1 ATOM 203 C CB . THR A 1 69 ? 33.946 -45.678 48.999 1.00 68.35 ? 80 THR A CB 1 ATOM 204 O OG1 . THR A 1 69 ? 33.126 -45.026 48.018 1.00 66.52 ? 80 THR A OG1 1 ATOM 205 C CG2 . THR A 1 69 ? 35.010 -46.500 48.294 1.00 62.71 ? 80 THR A CG2 1 ATOM 206 N N . ARG A 1 70 ? 30.978 -46.299 51.020 1.00 59.40 ? 81 ARG A N 1 ATOM 207 C CA . ARG A 1 70 ? 29.929 -45.650 51.802 1.00 62.36 ? 81 ARG A CA 1 ATOM 208 C C . ARG A 1 70 ? 30.351 -45.312 53.234 1.00 75.60 ? 81 ARG A C 1 ATOM 209 O O . ARG A 1 70 ? 29.889 -44.326 53.814 1.00 66.87 ? 81 ARG A O 1 ATOM 210 C CB . ARG A 1 70 ? 28.698 -46.559 51.800 1.00 60.24 ? 81 ARG A CB 1 ATOM 211 C CG . ARG A 1 70 ? 27.664 -46.307 52.867 1.00 66.03 ? 81 ARG A CG 1 ATOM 212 C CD . ARG A 1 70 ? 26.544 -47.321 52.712 1.00 81.60 ? 81 ARG A CD 1 ATOM 213 N NE . ARG A 1 70 ? 27.074 -48.681 52.644 1.00 96.45 ? 81 ARG A NE 1 ATOM 214 C CZ . ARG A 1 70 ? 26.388 -49.736 52.216 1.00 85.71 ? 81 ARG A CZ 1 ATOM 215 N NH1 . ARG A 1 70 ? 25.133 -49.593 51.806 1.00 73.83 ? 81 ARG A NH1 1 ATOM 216 N NH2 . ARG A 1 70 ? 26.960 -50.934 52.194 1.00 67.25 ? 81 ARG A NH2 1 ATOM 217 N N . TYR A 1 71 ? 31.236 -46.127 53.797 1.00 79.61 ? 82 TYR A N 1 ATOM 218 C CA . TYR A 1 71 ? 31.684 -45.921 55.167 1.00 77.80 ? 82 TYR A CA 1 ATOM 219 C C . TYR A 1 71 ? 33.140 -45.472 55.217 1.00 72.36 ? 82 TYR A C 1 ATOM 220 O O . TYR A 1 71 ? 33.755 -45.445 56.282 1.00 73.76 ? 82 TYR A O 1 ATOM 221 C CB . TYR A 1 71 ? 31.480 -47.195 55.991 1.00 82.08 ? 82 TYR A CB 1 ATOM 222 C CG . TYR A 1 71 ? 30.031 -47.614 56.098 1.00 76.33 ? 82 TYR A CG 1 ATOM 223 C CD1 . TYR A 1 71 ? 29.657 -48.941 55.937 1.00 63.62 ? 82 TYR A CD1 1 ATOM 224 C CD2 . TYR A 1 71 ? 29.038 -46.681 56.360 1.00 82.67 ? 82 TYR A CD2 1 ATOM 225 C CE1 . TYR A 1 71 ? 28.331 -49.325 56.029 1.00 79.02 ? 82 TYR A CE1 1 ATOM 226 C CE2 . TYR A 1 71 ? 27.712 -47.056 56.455 1.00 90.42 ? 82 TYR A CE2 1 ATOM 227 C CZ . TYR A 1 71 ? 27.364 -48.379 56.289 1.00 79.57 ? 82 TYR A CZ 1 ATOM 228 O OH . TYR A 1 71 ? 26.045 -48.751 56.382 1.00 68.55 ? 82 TYR A OH 1 ATOM 229 N N . ASP A 1 72 ? 33.685 -45.116 54.059 1.00 72.81 ? 83 ASP A N 1 ATOM 230 C CA . ASP A 1 72 ? 35.062 -44.642 53.974 1.00 77.27 ? 83 ASP A CA 1 ATOM 231 C C . ASP A 1 72 ? 35.101 -43.163 53.608 1.00 84.04 ? 83 ASP A C 1 ATOM 232 O O . ASP A 1 72 ? 34.990 -42.803 52.436 1.00 80.65 ? 83 ASP A O 1 ATOM 233 C CB . ASP A 1 72 ? 35.846 -45.454 52.942 1.00 79.36 ? 83 ASP A CB 1 ATOM 234 C CG . ASP A 1 72 ? 35.761 -46.944 53.186 1.00 91.99 ? 83 ASP A CG 1 ATOM 235 O OD1 . ASP A 1 72 ? 36.559 -47.457 53.998 1.00 107.46 ? 83 ASP A OD1 1 ATOM 236 O OD2 . ASP A 1 72 ? 34.899 -47.601 52.567 1.00 92.86 ? 83 ASP A OD2 1 ATOM 237 N N . PRO A 1 73 ? 35.261 -42.296 54.616 1.00 83.94 ? 84 PRO A N 1 ATOM 238 C CA . PRO A 1 73 ? 35.292 -40.853 54.360 1.00 78.62 ? 84 PRO A CA 1 ATOM 239 C C . PRO A 1 73 ? 36.554 -40.459 53.604 1.00 75.59 ? 84 PRO A C 1 ATOM 240 O O . PRO A 1 73 ? 37.621 -41.030 53.839 1.00 69.72 ? 84 PRO A O 1 ATOM 241 C CB . PRO A 1 73 ? 35.301 -40.250 55.767 1.00 75.78 ? 84 PRO A CB 1 ATOM 242 C CG . PRO A 1 73 ? 35.921 -41.305 56.621 1.00 82.20 ? 84 PRO A CG 1 ATOM 243 C CD . PRO A 1 73 ? 35.486 -42.618 56.036 1.00 76.70 ? 84 PRO A CD 1 ATOM 244 N N . GLY A 1 74 ? 36.424 -39.496 52.699 1.00 75.08 ? 85 GLY A N 1 ATOM 245 C CA . GLY A 1 74 ? 37.558 -39.016 51.932 1.00 81.14 ? 85 GLY A CA 1 ATOM 246 C C . GLY A 1 74 ? 37.674 -39.689 50.579 1.00 85.87 ? 85 GLY A C 1 ATOM 247 O O . GLY A 1 74 ? 38.534 -39.336 49.773 1.00 87.96 ? 85 GLY A O 1 ATOM 248 N N . ILE A 1 75 ? 36.806 -40.664 50.335 1.00 55.20 ? 86 ILE A N 1 ATOM 249 C CA . ILE A 1 75 ? 36.772 -41.359 49.054 1.00 63.58 ? 86 ILE A CA 1 ATOM 250 C C . ILE A 1 75 ? 35.322 -41.547 48.576 1.00 52.36 ? 86 ILE A C 1 ATOM 251 O O . ILE A 1 75 ? 34.526 -42.231 49.217 1.00 70.23 ? 86 ILE A O 1 ATOM 252 C CB . ILE A 1 75 ? 37.573 -42.689 49.115 1.00 54.78 ? 86 ILE A CB 1 ATOM 253 C CG1 . ILE A 1 75 ? 37.047 -43.704 48.105 1.00 67.79 ? 86 ILE A CG1 1 ATOM 254 C CG2 . ILE A 1 75 ? 37.544 -43.273 50.511 1.00 64.43 ? 86 ILE A CG2 1 ATOM 255 C CD1 . ILE A 1 75 ? 37.428 -43.405 46.675 1.00 96.95 ? 86 ILE A CD1 1 ATOM 256 N N . ALA A 1 76 ? 34.987 -40.915 47.452 1.00 55.32 ? 87 ALA A N 1 ATOM 257 C CA . ALA A 1 76 ? 33.607 -40.870 46.963 1.00 59.90 ? 87 ALA A CA 1 ATOM 258 C C . ALA A 1 76 ? 33.461 -41.174 45.469 1.00 70.11 ? 87 ALA A C 1 ATOM 259 O O . ALA A 1 76 ? 34.423 -41.087 44.701 1.00 66.89 ? 87 ALA A O 1 ATOM 260 C CB . ALA A 1 76 ? 32.981 -39.517 47.277 1.00 50.59 ? 87 ALA A CB 1 ATOM 261 N N . VAL A 1 77 ? 32.238 -41.521 45.072 1.00 47.48 ? 88 VAL A N 1 ATOM 262 C CA . VAL A 1 77 ? 31.920 -41.811 43.680 1.00 50.96 ? 88 VAL A CA 1 ATOM 263 C C . VAL A 1 77 ? 31.329 -40.588 42.996 1.00 53.73 ? 88 VAL A C 1 ATOM 264 O O . VAL A 1 77 ? 30.361 -40.008 43.485 1.00 62.44 ? 88 VAL A O 1 ATOM 265 C CB . VAL A 1 77 ? 30.893 -42.942 43.570 1.00 56.53 ? 88 VAL A CB 1 ATOM 266 C CG1 . VAL A 1 77 ? 30.504 -43.150 42.119 1.00 56.19 ? 88 VAL A CG1 1 ATOM 267 C CG2 . VAL A 1 77 ? 31.436 -44.220 44.177 1.00 47.89 ? 88 VAL A CG2 1 ATOM 268 N N . VAL A 1 78 ? 31.908 -40.203 41.862 1.00 54.98 ? 89 VAL A N 1 ATOM 269 C CA . VAL A 1 78 ? 31.430 -39.036 41.120 1.00 65.30 ? 89 VAL A CA 1 ATOM 270 C C . VAL A 1 78 ? 30.285 -39.369 40.160 1.00 57.61 ? 89 VAL A C 1 ATOM 271 O O . VAL A 1 78 ? 30.438 -40.169 39.237 1.00 60.29 ? 89 VAL A O 1 ATOM 272 C CB . VAL A 1 78 ? 32.585 -38.288 40.391 1.00 68.91 ? 89 VAL A CB 1 ATOM 273 C CG1 . VAL A 1 78 ? 33.708 -39.237 40.038 1.00 73.70 ? 89 VAL A CG1 1 ATOM 274 C CG2 . VAL A 1 78 ? 32.071 -37.541 39.159 1.00 59.30 ? 89 VAL A CG2 1 ATOM 275 N N . GLU A 1 79 ? 29.132 -38.751 40.401 1.00 53.33 ? 90 GLU A N 1 ATOM 276 C CA . GLU A 1 79 ? 27.948 -38.982 39.586 1.00 50.55 ? 90 GLU A CA 1 ATOM 277 C C . GLU A 1 79 ? 28.181 -38.521 38.150 1.00 47.89 ? 90 GLU A C 1 ATOM 278 O O . GLU A 1 79 ? 28.845 -37.513 37.908 1.00 44.46 ? 90 GLU A O 1 ATOM 279 C CB . GLU A 1 79 ? 26.733 -38.279 40.196 1.00 49.28 ? 90 GLU A CB 1 ATOM 280 C CG . GLU A 1 79 ? 26.478 -38.636 41.660 1.00 52.21 ? 90 GLU A CG 1 ATOM 281 C CD . GLU A 1 79 ? 25.997 -40.071 41.848 1.00 77.47 ? 90 GLU A CD 1 ATOM 282 O OE1 . GLU A 1 79 ? 25.421 -40.643 40.896 1.00 72.54 ? 90 GLU A OE1 1 ATOM 283 O OE2 . GLU A 1 79 ? 26.197 -40.629 42.950 1.00 81.47 ? 90 GLU A OE2 1 ATOM 284 N N . GLN A 1 80 ? 27.631 -39.273 37.205 1.00 51.44 ? 91 GLN A N 1 ATOM 285 C CA . GLN A 1 80 ? 27.859 -39.041 35.783 1.00 44.46 ? 91 GLN A CA 1 ATOM 286 C C . GLN A 1 80 ? 26.776 -38.144 35.174 1.00 47.79 ? 91 GLN A C 1 ATOM 287 O O . GLN A 1 80 ? 26.958 -37.566 34.104 1.00 58.51 ? 91 GLN A O 1 ATOM 288 C CB . GLN A 1 80 ? 27.971 -40.391 35.059 1.00 47.73 ? 91 GLN A CB 1 ATOM 289 C CG . GLN A 1 80 ? 27.965 -40.344 33.551 1.00 53.12 ? 91 GLN A CG 1 ATOM 290 C CD . GLN A 1 80 ? 26.573 -40.532 32.981 1.00 58.05 ? 91 GLN A CD 1 ATOM 291 O OE1 . GLN A 1 80 ? 25.587 -40.572 33.722 1.00 49.67 ? 91 GLN A OE1 1 ATOM 292 N NE2 . GLN A 1 80 ? 26.485 -40.657 31.660 1.00 34.67 ? 91 GLN A NE2 1 ATOM 293 N N . GLY A 1 81 ? 25.655 -38.012 35.874 1.00 48.10 ? 92 GLY A N 1 ATOM 294 C CA . GLY A 1 81 ? 24.593 -37.123 35.445 1.00 43.73 ? 92 GLY A CA 1 ATOM 295 C C . GLY A 1 81 ? 23.334 -37.839 34.995 1.00 49.97 ? 92 GLY A C 1 ATOM 296 O O . GLY A 1 81 ? 22.227 -37.355 35.211 1.00 45.93 ? 92 GLY A O 1 ATOM 297 N N . ARG A 1 82 ? 23.494 -38.993 34.363 1.00 60.56 ? 93 ARG A N 1 ATOM 298 C CA . ARG A 1 82 ? 22.338 -39.740 33.885 1.00 57.88 ? 93 ARG A CA 1 ATOM 299 C C . ARG A 1 82 ? 22.253 -41.128 34.508 1.00 59.09 ? 93 ARG A C 1 ATOM 300 O O . ARG A 1 82 ? 21.808 -42.078 33.866 1.00 70.71 ? 93 ARG A O 1 ATOM 301 C CB . ARG A 1 82 ? 22.347 -39.835 32.358 1.00 45.09 ? 93 ARG A CB 1 ATOM 302 C CG . ARG A 1 82 ? 22.157 -38.499 31.656 1.00 46.76 ? 93 ARG A CG 1 ATOM 303 C CD . ARG A 1 82 ? 22.054 -38.658 30.133 1.00 56.46 ? 93 ARG A CD 1 ATOM 304 N NE . ARG A 1 82 ? 23.259 -39.254 29.561 1.00 52.15 ? 93 ARG A NE 1 ATOM 305 C CZ . ARG A 1 82 ? 24.275 -38.560 29.059 1.00 47.89 ? 93 ARG A CZ 1 ATOM 306 N NH1 . ARG A 1 82 ? 24.237 -37.231 29.039 1.00 44.82 ? 93 ARG A NH1 1 ATOM 307 N NH2 . ARG A 1 82 ? 25.330 -39.199 28.574 1.00 42.96 ? 93 ARG A NH2 1 ATOM 308 N N . GLY A 1 83 ? 22.684 -41.243 35.760 1.00 54.12 ? 94 GLY A N 1 ATOM 309 C CA . GLY A 1 83 ? 22.525 -42.485 36.496 1.00 63.53 ? 94 GLY A CA 1 ATOM 310 C C . GLY A 1 83 ? 23.756 -43.371 36.545 1.00 61.81 ? 94 GLY A C 1 ATOM 311 O O . GLY A 1 83 ? 23.872 -44.235 37.414 1.00 61.12 ? 94 GLY A O 1 ATOM 312 N N . ALA A 1 84 ? 24.675 -43.172 35.607 1.00 54.52 ? 95 ALA A N 1 ATOM 313 C CA . ALA A 1 84 ? 25.940 -43.891 35.640 1.00 53.57 ? 95 ALA A CA 1 ATOM 314 C C . ALA A 1 84 ? 26.887 -43.214 36.621 1.00 61.06 ? 95 ALA A C 1 ATOM 315 O O . ALA A 1 84 ? 26.500 -42.295 37.343 1.00 66.94 ? 95 ALA A O 1 ATOM 316 C CB . ALA A 1 84 ? 26.559 -43.940 34.259 1.00 53.23 ? 95 ALA A CB 1 ATOM 317 N N . SER A 1 85 ? 28.132 -43.668 36.641 1.00 52.86 ? 96 SER A N 1 ATOM 318 C CA . SER A 1 85 ? 29.148 -43.041 37.471 1.00 51.04 ? 96 SER A CA 1 ATOM 319 C C . SER A 1 85 ? 30.418 -42.816 36.657 1.00 59.61 ? 96 SER A C 1 ATOM 320 O O . SER A 1 85 ? 30.628 -43.453 35.626 1.00 55.15 ? 96 SER A O 1 ATOM 321 C CB . SER A 1 85 ? 29.437 -43.888 38.712 1.00 43.00 ? 96 SER A CB 1 ATOM 322 O OG . SER A 1 85 ? 29.864 -45.199 38.371 1.00 48.46 ? 96 SER A OG 1 ATOM 323 N N . SER A 1 86 ? 31.262 -41.905 37.120 1.00 62.01 ? 97 SER A N 1 ATOM 324 C CA . SER A 1 86 ? 32.474 -41.572 36.391 1.00 51.59 ? 97 SER A CA 1 ATOM 325 C C . SER A 1 86 ? 33.724 -41.698 37.253 1.00 52.02 ? 97 SER A C 1 ATOM 326 O O . SER A 1 86 ? 34.529 -40.773 37.311 1.00 50.03 ? 97 SER A O 1 ATOM 327 C CB . SER A 1 86 ? 32.381 -40.156 35.825 1.00 43.65 ? 97 SER A CB 1 ATOM 328 O OG . SER A 1 86 ? 31.349 -40.057 34.864 1.00 60.70 ? 97 SER A OG 1 ATOM 329 N N . GLY A 1 87 ? 33.893 -42.840 37.912 1.00 46.09 ? 98 GLY A N 1 ATOM 330 C CA . GLY A 1 87 ? 35.086 -43.071 38.708 1.00 49.04 ? 98 GLY A CA 1 ATOM 331 C C . GLY A 1 87 ? 35.007 -42.520 40.121 1.00 50.87 ? 98 GLY A C 1 ATOM 332 O O . GLY A 1 87 ? 33.918 -42.338 40.670 1.00 44.55 ? 98 GLY A O 1 ATOM 333 N N . TYR A 1 88 ? 36.166 -42.246 40.714 1.00 58.58 ? 99 TYR A N 1 ATOM 334 C CA . TYR A 1 88 ? 36.232 -41.913 42.140 1.00 69.70 ? 99 TYR A CA 1 ATOM 335 C C . TYR A 1 88 ? 36.798 -40.526 42.427 1.00 75.30 ? 99 TYR A C 1 ATOM 336 O O . TYR A 1 88 ? 37.228 -39.819 41.517 1.00 68.34 ? 99 TYR A O 1 ATOM 337 C CB . TYR A 1 88 ? 37.032 -42.973 42.902 1.00 66.06 ? 99 TYR A CB 1 ATOM 338 C CG . TYR A 1 88 ? 36.391 -44.342 42.876 1.00 68.01 ? 99 TYR A CG 1 ATOM 339 C CD1 . TYR A 1 88 ? 35.507 -44.736 43.876 1.00 67.57 ? 99 TYR A CD1 1 ATOM 340 C CD2 . TYR A 1 88 ? 36.661 -45.236 41.848 1.00 57.89 ? 99 TYR A CD2 1 ATOM 341 C CE1 . TYR A 1 88 ? 34.913 -45.987 43.856 1.00 73.06 ? 99 TYR A CE1 1 ATOM 342 C CE2 . TYR A 1 88 ? 36.072 -46.486 41.817 1.00 71.19 ? 99 TYR A CE2 1 ATOM 343 C CZ . TYR A 1 88 ? 35.200 -46.858 42.824 1.00 79.35 ? 99 TYR A CZ 1 ATOM 344 O OH . TYR A 1 88 ? 34.613 -48.106 42.793 1.00 83.15 ? 99 TYR A OH 1 ATOM 345 N N . SER A 1 89 ? 36.788 -40.148 43.703 1.00 70.50 ? 100 SER A N 1 ATOM 346 C CA . SER A 1 89 ? 37.270 -38.838 44.124 1.00 63.74 ? 100 SER A CA 1 ATOM 347 C C . SER A 1 89 ? 38.108 -38.942 45.397 1.00 66.44 ? 100 SER A C 1 ATOM 348 O O . SER A 1 89 ? 37.577 -39.189 46.479 1.00 66.23 ? 100 SER A O 1 ATOM 349 C CB . SER A 1 89 ? 36.094 -37.887 44.344 1.00 57.26 ? 100 SER A CB 1 ATOM 350 O OG . SER A 1 89 ? 36.546 -36.562 44.568 1.00 58.56 ? 100 SER A OG 1 ATOM 351 N N . ILE A 1 90 ? 39.417 -38.750 45.261 1.00 71.14 ? 101 ILE A N 1 ATOM 352 C CA . ILE A 1 90 ? 40.341 -38.886 46.386 1.00 72.51 ? 101 ILE A CA 1 ATOM 353 C C . ILE A 1 90 ? 41.290 -37.692 46.502 1.00 71.76 ? 101 ILE A C 1 ATOM 354 O O . ILE A 1 90 ? 41.793 -37.191 45.493 1.00 58.72 ? 101 ILE A O 1 ATOM 355 C CB . ILE A 1 90 ? 41.187 -40.167 46.251 1.00 65.36 ? 101 ILE A CB 1 ATOM 356 C CG1 . ILE A 1 90 ? 40.294 -41.373 45.965 1.00 69.90 ? 101 ILE A CG1 1 ATOM 357 C CG2 . ILE A 1 90 ? 41.998 -40.405 47.503 1.00 59.46 ? 101 ILE A CG2 1 ATOM 358 C CD1 . ILE A 1 90 ? 41.052 -42.672 45.817 1.00 68.25 ? 101 ILE A CD1 1 ATOM 359 N N . ARG A 1 91 ? 41.524 -37.243 47.736 1.00 75.52 ? 102 ARG A N 1 ATOM 360 C CA . ARG A 1 91 ? 42.472 -36.162 48.026 1.00 75.20 ? 102 ARG A CA 1 ATOM 361 C C . ARG A 1 91 ? 42.221 -34.891 47.209 1.00 70.03 ? 102 ARG A C 1 ATOM 362 O O . ARG A 1 91 ? 43.157 -34.160 46.888 1.00 72.83 ? 102 ARG A O 1 ATOM 363 C CB . ARG A 1 91 ? 43.919 -36.632 47.820 1.00 74.93 ? 102 ARG A CB 1 ATOM 364 C CG . ARG A 1 91 ? 44.355 -37.774 48.731 1.00 69.76 ? 102 ARG A CG 1 ATOM 365 C CD . ARG A 1 91 ? 44.686 -37.287 50.127 1.00 58.64 ? 102 ARG A CD 1 ATOM 366 N NE . ARG A 1 91 ? 44.614 -38.355 51.124 1.00 84.11 ? 102 ARG A NE 1 ATOM 367 C CZ . ARG A 1 91 ? 45.655 -39.064 51.558 1.00 77.21 ? 102 ARG A CZ 1 ATOM 368 N NH1 . ARG A 1 91 ? 45.477 -40.012 52.471 1.00 70.25 ? 102 ARG A NH1 1 ATOM 369 N NH2 . ARG A 1 91 ? 46.873 -38.826 51.089 1.00 71.46 ? 102 ARG A NH2 1 ATOM 370 N N . GLY A 1 92 ? 40.962 -34.639 46.864 1.00 65.84 ? 103 GLY A N 1 ATOM 371 C CA . GLY A 1 92 ? 40.600 -33.426 46.152 1.00 76.66 ? 103 GLY A CA 1 ATOM 372 C C . GLY A 1 92 ? 40.425 -33.575 44.649 1.00 72.25 ? 103 GLY A C 1 ATOM 373 O O . GLY A 1 92 ? 39.778 -32.749 44.008 1.00 68.59 ? 103 GLY A O 1 ATOM 374 N N . MET A 1 93 ? 41.006 -34.621 44.076 1.00 62.96 ? 104 MET A N 1 ATOM 375 C CA . MET A 1 93 ? 40.898 -34.835 42.642 1.00 67.34 ? 104 MET A CA 1 ATOM 376 C C . MET A 1 93 ? 39.954 -35.989 42.335 1.00 67.47 ? 104 MET A C 1 ATOM 377 O O . MET A 1 93 ? 39.650 -36.798 43.211 1.00 67.86 ? 104 MET A O 1 ATOM 378 C CB . MET A 1 93 ? 42.277 -35.078 42.031 1.00 77.18 ? 104 MET A CB 1 ATOM 379 C CG . MET A 1 93 ? 43.267 -33.959 42.310 1.00 78.96 ? 104 MET A CG 1 ATOM 380 S SD . MET A 1 93 ? 42.665 -32.371 41.713 1.00 62.17 ? 104 MET A SD 1 ATOM 381 C CE . MET A 1 93 ? 43.945 -31.269 42.296 1.00 53.74 ? 104 MET A CE 1 ATOM 382 N N . ASP A 1 94 ? 39.480 -36.055 41.093 1.00 63.10 ? 105 ASP A N 1 ATOM 383 C CA . ASP A 1 94 ? 38.543 -37.101 40.698 1.00 54.79 ? 105 ASP A CA 1 ATOM 384 C C . ASP A 1 94 ? 38.669 -37.482 39.231 1.00 50.80 ? 105 ASP A C 1 ATOM 385 O O . ASP A 1 94 ? 39.578 -37.027 38.539 1.00 52.79 ? 105 ASP A O 1 ATOM 386 C CB . ASP A 1 94 ? 37.104 -36.685 41.007 1.00 53.31 ? 105 ASP A CB 1 ATOM 387 C CG . ASP A 1 94 ? 36.661 -35.485 40.205 1.00 68.03 ? 105 ASP A CG 1 ATOM 388 O OD1 . ASP A 1 94 ? 37.529 -34.705 39.757 1.00 71.15 ? 105 ASP A OD1 1 ATOM 389 O OD2 . ASP A 1 94 ? 35.438 -35.319 40.026 1.00 78.73 ? 105 ASP A OD2 1 ATOM 390 N N . LYS A 1 95 ? 37.745 -38.323 38.775 1.00 56.62 ? 106 LYS A N 1 ATOM 391 C CA . LYS A 1 95 ? 37.715 -38.795 37.392 1.00 54.81 ? 106 LYS A CA 1 ATOM 392 C C . LYS A 1 95 ? 39.046 -39.409 36.950 1.00 56.49 ? 106 LYS A C 1 ATOM 393 O O . LYS A 1 95 ? 39.518 -40.387 37.535 1.00 61.93 ? 106 LYS A O 1 ATOM 394 C CB . LYS A 1 95 ? 37.298 -37.667 36.440 1.00 56.90 ? 106 LYS A CB 1 ATOM 395 C CG . LYS A 1 95 ? 35.835 -37.238 36.551 1.00 56.04 ? 106 LYS A CG 1 ATOM 396 C CD . LYS A 1 95 ? 35.557 -35.993 35.708 1.00 59.57 ? 106 LYS A CD 1 ATOM 397 C CE . LYS A 1 95 ? 36.005 -36.190 34.255 1.00 72.53 ? 106 LYS A CE 1 ATOM 398 N NZ . LYS A 1 95 ? 35.952 -34.942 33.424 1.00 57.63 ? 106 LYS A NZ 1 ATOM 399 N N . ASN A 1 96 ? 39.647 -38.816 35.922 1.00 55.74 ? 107 ASN A N 1 ATOM 400 C CA . ASN A 1 96 ? 40.877 -39.329 35.324 1.00 51.99 ? 107 ASN A CA 1 ATOM 401 C C . ASN A 1 96 ? 42.126 -39.039 36.146 1.00 53.90 ? 107 ASN A C 1 ATOM 402 O O . ASN A 1 96 ? 43.241 -39.321 35.708 1.00 58.90 ? 107 ASN A O 1 ATOM 403 C CB . ASN A 1 96 ? 41.051 -38.777 33.903 1.00 44.27 ? 107 ASN A CB 1 ATOM 404 C CG . ASN A 1 96 ? 40.005 -39.309 32.939 1.00 53.19 ? 107 ASN A CG 1 ATOM 405 O OD1 . ASN A 1 96 ? 39.596 -40.465 33.028 1.00 70.16 ? 107 ASN A OD1 1 ATOM 406 N ND2 . ASN A 1 96 ? 39.564 -38.465 32.015 1.00 43.18 ? 107 ASN A ND2 1 ATOM 407 N N . ARG A 1 97 ? 41.936 -38.472 37.334 1.00 49.20 ? 108 ARG A N 1 ATOM 408 C CA . ARG A 1 97 ? 43.052 -38.175 38.226 1.00 51.59 ? 108 ARG A CA 1 ATOM 409 C C . ARG A 1 97 ? 43.228 -39.245 39.306 1.00 58.15 ? 108 ARG A C 1 ATOM 410 O O . ARG A 1 97 ? 44.128 -39.162 40.144 1.00 54.12 ? 108 ARG A O 1 ATOM 411 C CB . ARG A 1 97 ? 42.906 -36.777 38.831 1.00 56.48 ? 108 ARG A CB 1 ATOM 412 C CG . ARG A 1 97 ? 43.463 -35.689 37.933 1.00 62.32 ? 108 ARG A CG 1 ATOM 413 C CD . ARG A 1 97 ? 42.760 -34.360 38.128 1.00 58.36 ? 108 ARG A CD 1 ATOM 414 N NE . ARG A 1 97 ? 43.323 -33.338 37.250 1.00 55.23 ? 108 ARG A NE 1 ATOM 415 C CZ . ARG A 1 97 ? 42.718 -32.196 36.938 1.00 59.51 ? 108 ARG A CZ 1 ATOM 416 N NH1 . ARG A 1 97 ? 41.517 -31.916 37.429 1.00 43.78 ? 108 ARG A NH1 1 ATOM 417 N NH2 . ARG A 1 97 ? 43.312 -31.330 36.128 1.00 57.23 ? 108 ARG A NH2 1 ATOM 418 N N . VAL A 1 98 ? 42.361 -40.249 39.280 1.00 43.89 ? 109 VAL A N 1 ATOM 419 C CA . VAL A 1 98 ? 42.591 -41.464 40.054 1.00 64.10 ? 109 VAL A CA 1 ATOM 420 C C . VAL A 1 98 ? 42.406 -42.671 39.138 1.00 61.02 ? 109 VAL A C 1 ATOM 421 O O . VAL A 1 98 ? 41.389 -42.797 38.452 1.00 64.99 ? 109 VAL A O 1 ATOM 422 C CB . VAL A 1 98 ? 41.726 -41.547 41.356 1.00 51.32 ? 109 VAL A CB 1 ATOM 423 C CG1 . VAL A 1 98 ? 40.533 -40.611 41.293 1.00 59.07 ? 109 VAL A CG1 1 ATOM 424 C CG2 . VAL A 1 98 ? 41.290 -42.977 41.635 1.00 52.96 ? 109 VAL A CG2 1 ATOM 425 N N . SER A 1 99 ? 43.412 -43.539 39.110 1.00 61.80 ? 110 SER A N 1 ATOM 426 C CA . SER A 1 99 ? 43.428 -44.662 38.182 1.00 66.03 ? 110 SER A CA 1 ATOM 427 C C . SER A 1 99 ? 42.540 -45.809 38.647 1.00 61.72 ? 110 SER A C 1 ATOM 428 O O . SER A 1 99 ? 42.432 -46.079 39.838 1.00 62.42 ? 110 SER A O 1 ATOM 429 C CB . SER A 1 99 ? 44.858 -45.152 37.949 1.00 66.47 ? 110 SER A CB 1 ATOM 430 O OG . SER A 1 99 ? 45.430 -45.646 39.142 1.00 70.68 ? 110 SER A OG 1 ATOM 431 N N . LEU A 1 100 ? 41.909 -46.473 37.685 1.00 42.46 ? 111 LEU A N 1 ATOM 432 C CA . LEU A 1 100 ? 40.981 -47.561 37.949 1.00 42.48 ? 111 LEU A CA 1 ATOM 433 C C . LEU A 1 100 ? 41.467 -48.779 37.176 1.00 63.29 ? 111 LEU A C 1 ATOM 434 O O . LEU A 1 100 ? 41.450 -48.784 35.949 1.00 49.78 ? 111 LEU A O 1 ATOM 435 C CB . LEU A 1 100 ? 39.590 -47.178 37.452 1.00 44.36 ? 111 LEU A CB 1 ATOM 436 C CG . LEU A 1 100 ? 38.324 -47.661 38.158 1.00 53.41 ? 111 LEU A CG 1 ATOM 437 C CD1 . LEU A 1 100 ? 37.169 -47.674 37.170 1.00 40.42 ? 111 LEU A CD1 1 ATOM 438 C CD2 . LEU A 1 100 ? 38.501 -49.022 38.815 1.00 58.02 ? 111 LEU A CD2 1 ATOM 439 N N . THR A 1 101 ? 41.899 -49.814 37.882 1.00 63.67 ? 112 THR A N 1 ATOM 440 C CA . THR A 1 101 ? 42.433 -50.988 37.204 1.00 61.49 ? 112 THR A CA 1 ATOM 441 C C . THR A 1 101 ? 41.727 -52.283 37.584 1.00 59.40 ? 112 THR A C 1 ATOM 442 O O . THR A 1 101 ? 41.196 -52.423 38.686 1.00 64.44 ? 112 THR A O 1 ATOM 443 C CB . THR A 1 101 ? 43.947 -51.139 37.449 1.00 62.89 ? 112 THR A CB 1 ATOM 444 O OG1 . THR A 1 101 ? 44.237 -50.872 38.827 1.00 67.08 ? 112 THR A OG1 1 ATOM 445 C CG2 . THR A 1 101 ? 44.725 -50.164 36.580 1.00 49.15 ? 112 THR A CG2 1 ATOM 446 N N . VAL A 1 102 ? 41.722 -53.224 36.648 1.00 60.59 ? 113 VAL A N 1 ATOM 447 C CA . VAL A 1 102 ? 41.219 -54.568 36.890 1.00 62.35 ? 113 VAL A CA 1 ATOM 448 C C . VAL A 1 102 ? 42.252 -55.556 36.373 1.00 58.34 ? 113 VAL A C 1 ATOM 449 O O . VAL A 1 102 ? 42.499 -55.621 35.170 1.00 59.56 ? 113 VAL A O 1 ATOM 450 C CB . VAL A 1 102 ? 39.872 -54.821 36.177 1.00 55.82 ? 113 VAL A CB 1 ATOM 451 C CG1 . VAL A 1 102 ? 39.510 -56.295 36.232 1.00 59.17 ? 113 VAL A CG1 1 ATOM 452 C CG2 . VAL A 1 102 ? 38.766 -53.975 36.797 1.00 48.12 ? 113 VAL A CG2 1 ATOM 453 N N . ASP A 1 103 ? 42.862 -56.307 37.288 1.00 53.79 ? 114 ASP A N 1 ATOM 454 C CA . ASP A 1 103 ? 43.896 -57.285 36.943 1.00 63.44 ? 114 ASP A CA 1 ATOM 455 C C . ASP A 1 103 ? 45.048 -56.678 36.141 1.00 73.03 ? 114 ASP A C 1 ATOM 456 O O . ASP A 1 103 ? 45.584 -57.312 35.226 1.00 70.34 ? 114 ASP A O 1 ATOM 457 C CB . ASP A 1 103 ? 43.299 -58.472 36.185 1.00 66.63 ? 114 ASP A CB 1 ATOM 458 C CG . ASP A 1 103 ? 42.230 -59.193 36.979 1.00 76.83 ? 114 ASP A CG 1 ATOM 459 O OD1 . ASP A 1 103 ? 41.225 -59.617 36.371 1.00 80.07 ? 114 ASP A OD1 1 ATOM 460 O OD2 . ASP A 1 103 ? 42.394 -59.337 38.210 1.00 81.77 ? 114 ASP A OD2 1 ATOM 461 N N . GLY A 1 104 ? 45.416 -55.447 36.487 1.00 66.09 ? 115 GLY A N 1 ATOM 462 C CA . GLY A 1 104 ? 46.553 -54.790 35.873 1.00 57.85 ? 115 GLY A CA 1 ATOM 463 C C . GLY A 1 104 ? 46.195 -54.012 34.625 1.00 62.42 ? 115 GLY A C 1 ATOM 464 O O . GLY A 1 104 ? 47.046 -53.344 34.036 1.00 74.90 ? 115 GLY A O 1 ATOM 465 N N . VAL A 1 105 ? 44.933 -54.094 34.220 1.00 48.93 ? 116 VAL A N 1 ATOM 466 C CA . VAL A 1 105 ? 44.487 -53.422 33.007 1.00 54.41 ? 116 VAL A CA 1 ATOM 467 C C . VAL A 1 105 ? 43.638 -52.208 33.349 1.00 60.28 ? 116 VAL A C 1 ATOM 468 O O . VAL A 1 105 ? 42.619 -52.322 34.024 1.00 70.10 ? 116 VAL A O 1 ATOM 469 C CB . VAL A 1 105 ? 43.669 -54.362 32.099 1.00 55.04 ? 116 VAL A CB 1 ATOM 470 C CG1 . VAL A 1 105 ? 43.477 -53.730 30.726 1.00 45.50 ? 116 VAL A CG1 1 ATOM 471 C CG2 . VAL A 1 105 ? 44.347 -55.731 31.986 1.00 47.42 ? 116 VAL A CG2 1 ATOM 472 N N . SER A 1 106 ? 44.062 -51.042 32.882 1.00 58.93 ? 117 SER A N 1 ATOM 473 C CA . SER A 1 106 ? 43.319 -49.818 33.139 1.00 58.22 ? 117 SER A CA 1 ATOM 474 C C . SER A 1 106 ? 41.976 -49.825 32.416 1.00 55.29 ? 117 SER A C 1 ATOM 475 O O . SER A 1 106 ? 41.835 -50.409 31.344 1.00 60.83 ? 117 SER A O 1 ATOM 476 C CB . SER A 1 106 ? 44.142 -48.601 32.721 1.00 57.39 ? 117 SER A CB 1 ATOM 477 O OG . SER A 1 106 ? 44.727 -48.812 31.450 1.00 66.58 ? 117 SER A OG 1 ATOM 478 N N . GLN A 1 107 ? 40.989 -49.172 33.016 1.00 53.98 ? 118 GLN A N 1 ATOM 479 C CA . GLN A 1 107 ? 39.668 -49.088 32.423 1.00 51.60 ? 118 GLN A CA 1 ATOM 480 C C . GLN A 1 107 ? 39.509 -47.821 31.597 1.00 58.91 ? 118 GLN A C 1 ATOM 481 O O . GLN A 1 107 ? 40.480 -47.112 31.326 1.00 75.20 ? 118 GLN A O 1 ATOM 482 C CB . GLN A 1 107 ? 38.593 -49.153 33.505 1.00 54.46 ? 118 GLN A CB 1 ATOM 483 C CG . GLN A 1 107 ? 38.664 -50.402 34.349 1.00 45.26 ? 118 GLN A CG 1 ATOM 484 C CD . GLN A 1 107 ? 38.651 -51.658 33.508 1.00 53.06 ? 118 GLN A CD 1 ATOM 485 O OE1 . GLN A 1 107 ? 37.591 -52.123 33.083 1.00 54.23 ? 118 GLN A OE1 1 ATOM 486 N NE2 . GLN A 1 107 ? 39.833 -52.216 33.258 1.00 52.36 ? 118 GLN A NE2 1 ATOM 487 N N . ILE A 1 108 ? 38.269 -47.546 31.211 1.00 44.22 ? 119 ILE A N 1 ATOM 488 C CA . ILE A 1 108 ? 37.949 -46.443 30.316 1.00 45.15 ? 119 ILE A CA 1 ATOM 489 C C . ILE A 1 108 ? 38.220 -45.075 30.943 1.00 48.10 ? 119 ILE A C 1 ATOM 490 O O . ILE A 1 108 ? 38.031 -44.876 32.146 1.00 65.08 ? 119 ILE A O 1 ATOM 491 C CB . ILE A 1 108 ? 36.479 -46.546 29.850 1.00 48.43 ? 119 ILE A CB 1 ATOM 492 C CG1 . ILE A 1 108 ? 36.408 -46.672 28.330 1.00 47.16 ? 119 ILE A CG1 1 ATOM 493 C CG2 . ILE A 1 108 ? 35.651 -45.374 30.343 1.00 50.15 ? 119 ILE A CG2 1 ATOM 494 C CD1 . ILE A 1 108 ? 36.775 -45.443 27.619 1.00 41.59 ? 119 ILE A CD1 1 ATOM 495 N N . GLN A 1 109 ? 38.697 -44.144 30.123 1.00 46.36 ? 120 GLN A N 1 ATOM 496 C CA . GLN A 1 109 ? 38.845 -42.757 30.547 1.00 50.55 ? 120 GLN A CA 1 ATOM 497 C C . GLN A 1 109 ? 37.498 -42.062 30.461 1.00 48.03 ? 120 GLN A C 1 ATOM 498 O O . GLN A 1 109 ? 36.662 -42.415 29.631 1.00 47.57 ? 120 GLN A O 1 ATOM 499 C CB . GLN A 1 109 ? 39.833 -42.005 29.655 1.00 38.66 ? 120 GLN A CB 1 ATOM 500 C CG . GLN A 1 109 ? 41.296 -42.334 29.865 1.00 35.89 ? 120 GLN A CG 1 ATOM 501 C CD . GLN A 1 109 ? 42.208 -41.437 29.046 1.00 43.12 ? 120 GLN A CD 1 ATOM 502 O OE1 . GLN A 1 109 ? 41.763 -40.457 28.442 1.00 52.59 ? 120 GLN A OE1 1 ATOM 503 N NE2 . GLN A 1 109 ? 43.489 -41.767 29.019 1.00 39.02 ? 120 GLN A NE2 1 ATOM 504 N N . SER A 1 110 ? 37.285 -41.074 31.320 1.00 48.59 ? 121 SER A N 1 ATOM 505 C CA . SER A 1 110 ? 36.130 -40.208 31.172 1.00 49.11 ? 121 SER A CA 1 ATOM 506 C C . SER A 1 110 ? 36.394 -39.316 29.972 1.00 49.54 ? 121 SER A C 1 ATOM 507 O O . SER A 1 110 ? 37.414 -38.631 29.920 1.00 52.97 ? 121 SER A O 1 ATOM 508 C CB . SER A 1 110 ? 35.927 -39.360 32.422 1.00 51.48 ? 121 SER A CB 1 ATOM 509 O OG . SER A 1 110 ? 34.803 -38.515 32.279 1.00 51.85 ? 121 SER A OG 1 ATOM 510 N N . TYR A 1 111 ? 35.490 -39.350 28.999 1.00 48.75 ? 122 TYR A N 1 ATOM 511 C CA . TYR A 1 111 ? 35.631 -38.550 27.787 1.00 43.09 ? 122 TYR A CA 1 ATOM 512 C C . TYR A 1 111 ? 34.415 -37.651 27.619 1.00 50.34 ? 122 TYR A C 1 ATOM 513 O O . TYR A 1 111 ? 33.306 -38.136 27.402 1.00 52.50 ? 122 TYR A O 1 ATOM 514 C CB . TYR A 1 111 ? 35.766 -39.459 26.563 1.00 42.10 ? 122 TYR A CB 1 ATOM 515 C CG . TYR A 1 111 ? 36.244 -38.769 25.297 1.00 42.58 ? 122 TYR A CG 1 ATOM 516 C CD1 . TYR A 1 111 ? 37.547 -38.930 24.850 1.00 50.21 ? 122 TYR A CD1 1 ATOM 517 C CD2 . TYR A 1 111 ? 35.393 -37.966 24.545 1.00 45.53 ? 122 TYR A CD2 1 ATOM 518 C CE1 . TYR A 1 111 ? 37.993 -38.318 23.695 1.00 49.37 ? 122 TYR A CE1 1 ATOM 519 C CE2 . TYR A 1 111 ? 35.834 -37.339 23.390 1.00 44.13 ? 122 TYR A CE2 1 ATOM 520 C CZ . TYR A 1 111 ? 37.138 -37.520 22.971 1.00 48.45 ? 122 TYR A CZ 1 ATOM 521 O OH . TYR A 1 111 ? 37.592 -36.911 21.820 1.00 45.02 ? 122 TYR A OH 1 ATOM 522 N N . THR A 1 112 ? 34.622 -36.343 27.713 1.00 61.89 ? 123 THR A N 1 ATOM 523 C CA . THR A 1 112 ? 33.543 -35.395 27.455 1.00 60.72 ? 123 THR A CA 1 ATOM 524 C C . THR A 1 112 ? 33.784 -34.577 26.188 1.00 56.86 ? 123 THR A C 1 ATOM 525 O O . THR A 1 112 ? 34.716 -33.775 26.123 1.00 53.43 ? 123 THR A O 1 ATOM 526 C CB . THR A 1 112 ? 33.331 -34.439 28.631 1.00 47.92 ? 123 THR A CB 1 ATOM 527 O OG1 . THR A 1 112 ? 32.987 -35.191 29.802 1.00 50.29 ? 123 THR A OG1 1 ATOM 528 C CG2 . THR A 1 112 ? 32.210 -33.464 28.304 1.00 43.75 ? 123 THR A CG2 1 ATOM 529 N N . ALA A 1 113 ? 32.939 -34.788 25.185 1.00 52.97 ? 124 ALA A N 1 ATOM 530 C CA . ALA A 1 113 ? 33.013 -34.017 23.950 1.00 48.47 ? 124 ALA A CA 1 ATOM 531 C C . ALA A 1 113 ? 32.580 -32.583 24.198 1.00 49.08 ? 124 ALA A C 1 ATOM 532 O O . ALA A 1 113 ? 31.686 -32.330 25.005 1.00 50.68 ? 124 ALA A O 1 ATOM 533 C CB . ALA A 1 113 ? 32.138 -34.644 22.880 1.00 43.29 ? 124 ALA A CB 1 ATOM 534 N N . GLN A 1 114 ? 33.220 -31.648 23.501 1.00 45.62 ? 125 GLN A N 1 ATOM 535 C CA . GLN A 1 114 ? 32.837 -30.243 23.563 1.00 39.40 ? 125 GLN A CA 1 ATOM 536 C C . GLN A 1 114 ? 31.370 -30.091 23.190 1.00 45.98 ? 125 GLN A C 1 ATOM 537 O O . GLN A 1 114 ? 30.864 -30.816 22.332 1.00 54.25 ? 125 GLN A O 1 ATOM 538 C CB . GLN A 1 114 ? 33.718 -29.418 22.632 1.00 34.61 ? 125 GLN A CB 1 ATOM 539 C CG . GLN A 1 114 ? 33.576 -27.921 22.798 1.00 44.41 ? 125 GLN A CG 1 ATOM 540 C CD . GLN A 1 114 ? 34.726 -27.165 22.158 1.00 47.47 ? 125 GLN A CD 1 ATOM 541 O OE1 . GLN A 1 114 ? 35.714 -27.765 21.736 1.00 57.19 ? 125 GLN A OE1 1 ATOM 542 N NE2 . GLN A 1 114 ? 34.603 -25.845 22.085 1.00 49.55 ? 125 GLN A NE2 1 ATOM 543 N N . ALA A 1 115 ? 30.685 -29.161 23.844 1.00 45.65 ? 126 ALA A N 1 ATOM 544 C CA . ALA A 1 115 ? 29.236 -29.039 23.701 1.00 38.03 ? 126 ALA A CA 1 ATOM 545 C C . ALA A 1 115 ? 28.802 -28.368 22.404 1.00 52.41 ? 126 ALA A C 1 ATOM 546 O O . ALA A 1 115 ? 29.558 -27.608 21.791 1.00 49.27 ? 126 ALA A O 1 ATOM 547 C CB . ALA A 1 115 ? 28.650 -28.312 24.886 1.00 45.37 ? 126 ALA A CB 1 ATOM 548 N N . ALA A 1 116 ? 27.564 -28.644 22.008 1.00 57.70 ? 127 ALA A N 1 ATOM 549 C CA . ALA A 1 116 ? 27.022 -28.158 20.746 1.00 61.40 ? 127 ALA A CA 1 ATOM 550 C C . ALA A 1 116 ? 26.345 -26.795 20.865 1.00 64.67 ? 127 ALA A C 1 ATOM 551 O O . ALA A 1 116 ? 25.625 -26.524 21.827 1.00 67.12 ? 127 ALA A O 1 ATOM 552 C CB . ALA A 1 116 ? 26.044 -29.173 20.179 1.00 59.19 ? 127 ALA A CB 1 ATOM 553 N N . LEU A 1 117 ? 26.579 -25.941 19.876 1.00 60.48 ? 128 LEU A N 1 ATOM 554 C CA . LEU A 1 117 ? 25.848 -24.687 19.761 1.00 56.93 ? 128 LEU A CA 1 ATOM 555 C C . LEU A 1 117 ? 24.565 -24.962 19.000 1.00 56.15 ? 128 LEU A C 1 ATOM 556 O O . LEU A 1 117 ? 24.461 -25.971 18.301 1.00 61.13 ? 128 LEU A O 1 ATOM 557 C CB . LEU A 1 117 ? 26.674 -23.642 19.007 1.00 54.65 ? 128 LEU A CB 1 ATOM 558 C CG . LEU A 1 117 ? 27.599 -22.733 19.818 1.00 62.52 ? 128 LEU A CG 1 ATOM 559 C CD1 . LEU A 1 117 ? 28.552 -23.544 20.672 1.00 78.19 ? 128 LEU A CD1 1 ATOM 560 C CD2 . LEU A 1 117 ? 28.373 -21.808 18.904 1.00 45.82 ? 128 LEU A CD2 1 ATOM 561 N N . GLY A 1 118 ? 23.589 -24.069 19.132 1.00 58.81 ? 129 GLY A N 1 ATOM 562 C CA . GLY A 1 118 ? 22.366 -24.171 18.357 1.00 54.23 ? 129 GLY A CA 1 ATOM 563 C C . GLY A 1 118 ? 21.108 -24.112 19.199 1.00 59.72 ? 129 GLY A C 1 ATOM 564 O O . GLY A 1 118 ? 20.005 -23.959 18.673 1.00 61.35 ? 129 GLY A O 1 ATOM 565 N N . GLY A 1 119 ? 21.273 -24.238 20.511 1.00 51.38 ? 130 GLY A N 1 ATOM 566 C CA . GLY A 1 119 ? 20.149 -24.151 21.425 1.00 58.95 ? 130 GLY A CA 1 ATOM 567 C C . GLY A 1 119 ? 19.234 -25.360 21.383 1.00 63.29 ? 130 GLY A C 1 ATOM 568 O O . GLY A 1 119 ? 18.036 -25.251 21.648 1.00 68.18 ? 130 GLY A O 1 ATOM 569 N N . THR A 1 120 ? 19.795 -26.516 21.046 1.00 43.93 ? 131 THR A N 1 ATOM 570 C CA . THR A 1 120 ? 19.021 -27.750 21.023 1.00 38.28 ? 131 THR A CA 1 ATOM 571 C C . THR A 1 120 ? 19.622 -28.785 21.962 1.00 49.01 ? 131 THR A C 1 ATOM 572 O O . THR A 1 120 ? 20.780 -28.684 22.364 1.00 48.77 ? 131 THR A O 1 ATOM 573 C CB . THR A 1 120 ? 18.927 -28.359 19.598 1.00 50.33 ? 131 THR A CB 1 ATOM 574 O OG1 . THR A 1 120 ? 20.197 -28.895 19.211 1.00 47.45 ? 131 THR A OG1 1 ATOM 575 C CG2 . THR A 1 120 ? 18.500 -27.310 18.588 1.00 58.56 ? 131 THR A CG2 1 ATOM 576 N N . ARG A 1 121 ? 18.822 -29.781 22.311 1.00 49.61 ? 132 ARG A N 1 ATOM 577 C CA . ARG A 1 121 ? 19.310 -30.915 23.075 1.00 40.60 ? 132 ARG A CA 1 ATOM 578 C C . ARG A 1 121 ? 20.093 -31.869 22.160 1.00 54.16 ? 132 ARG A C 1 ATOM 579 O O . ARG A 1 121 ? 19.689 -32.130 21.027 1.00 32.34 ? 132 ARG A O 1 ATOM 580 C CB . ARG A 1 121 ? 18.136 -31.640 23.743 1.00 39.84 ? 132 ARG A CB 1 ATOM 581 C CG . ARG A 1 121 ? 17.375 -30.795 24.763 1.00 52.59 ? 132 ARG A CG 1 ATOM 582 C CD . ARG A 1 121 ? 18.304 -30.338 25.885 1.00 75.78 ? 132 ARG A CD 1 ATOM 583 N NE . ARG A 1 121 ? 19.053 -31.456 26.456 1.00 78.07 ? 132 ARG A NE 1 ATOM 584 C CZ . ARG A 1 121 ? 18.658 -32.162 27.511 1.00 77.24 ? 132 ARG A CZ 1 ATOM 585 N NH1 . ARG A 1 121 ? 17.521 -31.865 28.127 1.00 75.22 ? 132 ARG A NH1 1 ATOM 586 N NH2 . ARG A 1 121 ? 19.403 -33.165 27.951 1.00 76.93 ? 132 ARG A NH2 1 ATOM 587 N N . THR A 1 122 ? 21.225 -32.366 22.649 1.00 58.13 ? 133 THR A N 1 ATOM 588 C CA . THR A 1 122 ? 22.030 -33.327 21.903 1.00 45.64 ? 133 THR A CA 1 ATOM 589 C C . THR A 1 122 ? 22.504 -34.466 22.801 1.00 45.98 ? 133 THR A C 1 ATOM 590 O O . THR A 1 122 ? 22.297 -34.443 24.014 1.00 65.95 ? 133 THR A O 1 ATOM 591 C CB . THR A 1 122 ? 23.249 -32.653 21.230 1.00 51.45 ? 133 THR A CB 1 ATOM 592 O OG1 . THR A 1 122 ? 24.134 -32.124 22.225 1.00 48.19 ? 133 THR A OG1 1 ATOM 593 C CG2 . THR A 1 122 ? 22.791 -31.527 20.312 1.00 48.29 ? 133 THR A CG2 1 ATOM 594 N N . ALA A 1 123 ? 23.158 -35.451 22.194 1.00 44.74 ? 134 ALA A N 1 ATOM 595 C CA . ALA A 1 123 ? 23.630 -36.631 22.916 1.00 39.90 ? 134 ALA A CA 1 ATOM 596 C C . ALA A 1 123 ? 24.811 -36.349 23.813 1.00 30.81 ? 134 ALA A C 1 ATOM 597 O O . ALA A 1 123 ? 24.764 -36.610 25.012 1.00 62.66 ? 134 ALA A O 1 ATOM 598 C CB . ALA A 1 123 ? 23.995 -37.738 21.945 1.00 30.04 ? 134 ALA A CB 1 ATOM 599 N N . GLY A 1 124 ? 25.882 -35.846 23.212 1.00 33.17 ? 135 GLY A N 1 ATOM 600 C CA . GLY A 1 124 ? 27.157 -35.729 23.891 1.00 46.21 ? 135 GLY A CA 1 ATOM 601 C C . GLY A 1 124 ? 27.759 -37.103 24.113 1.00 44.40 ? 135 GLY A C 1 ATOM 602 O O . GLY A 1 124 ? 27.101 -38.120 23.895 1.00 49.44 ? 135 GLY A O 1 ATOM 603 N N . SER A 1 125 ? 29.016 -37.149 24.536 1.00 37.36 ? 136 SER A N 1 ATOM 604 C CA . SER A 1 125 ? 29.611 -38.429 24.897 1.00 37.90 ? 136 SER A CA 1 ATOM 605 C C . SER A 1 125 ? 29.041 -38.888 26.238 1.00 42.25 ? 136 SER A C 1 ATOM 606 O O . SER A 1 125 ? 28.446 -38.097 26.962 1.00 40.31 ? 136 SER A O 1 ATOM 607 C CB . SER A 1 125 ? 31.129 -38.319 24.961 1.00 44.36 ? 136 SER A CB 1 ATOM 608 O OG . SER A 1 125 ? 31.515 -37.235 25.784 1.00 54.83 ? 136 SER A OG 1 ATOM 609 N N . SER A 1 126 ? 29.202 -40.167 26.555 1.00 41.14 ? 137 SER A N 1 ATOM 610 C CA . SER A 1 126 ? 28.722 -40.709 27.822 1.00 45.55 ? 137 SER A CA 1 ATOM 611 C C . SER A 1 126 ? 29.348 -40.004 29.028 1.00 45.95 ? 137 SER A C 1 ATOM 612 O O . SER A 1 126 ? 28.648 -39.588 29.952 1.00 45.93 ? 137 SER A O 1 ATOM 613 C CB . SER A 1 126 ? 29.016 -42.207 27.894 1.00 51.93 ? 137 SER A CB 1 ATOM 614 O OG . SER A 1 126 ? 28.828 -42.695 29.209 1.00 58.65 ? 137 SER A OG 1 ATOM 615 N N . GLY A 1 127 ? 30.672 -39.882 29.010 1.00 37.77 ? 138 GLY A N 1 ATOM 616 C CA . GLY A 1 127 ? 31.405 -39.238 30.082 1.00 40.67 ? 138 GLY A CA 1 ATOM 617 C C . GLY A 1 127 ? 31.699 -40.187 31.225 1.00 52.59 ? 138 GLY A C 1 ATOM 618 O O . GLY A 1 127 ? 32.563 -39.931 32.064 1.00 52.96 ? 138 GLY A O 1 ATOM 619 N N . ALA A 1 128 ? 30.978 -41.300 31.248 1.00 43.40 ? 139 ALA A N 1 ATOM 620 C CA . ALA A 1 128 ? 31.082 -42.253 32.335 1.00 45.18 ? 139 ALA A CA 1 ATOM 621 C C . ALA A 1 128 ? 32.394 -43.024 32.319 1.00 41.89 ? 139 ALA A C 1 ATOM 622 O O . ALA A 1 128 ? 33.125 -43.019 31.336 1.00 43.01 ? 139 ALA A O 1 ATOM 623 C CB . ALA A 1 128 ? 29.912 -43.220 32.288 1.00 48.11 ? 139 ALA A CB 1 ATOM 624 N N . ILE A 1 129 ? 32.685 -43.675 33.438 1.00 45.03 ? 140 ILE A N 1 ATOM 625 C CA . ILE A 1 129 ? 33.699 -44.715 33.490 1.00 39.00 ? 140 ILE A CA 1 ATOM 626 C C . ILE A 1 129 ? 32.973 -46.002 33.859 1.00 43.01 ? 140 ILE A C 1 ATOM 627 O O . ILE A 1 129 ? 32.038 -45.981 34.658 1.00 51.78 ? 140 ILE A O 1 ATOM 628 C CB . ILE A 1 129 ? 34.788 -44.402 34.522 1.00 43.92 ? 140 ILE A CB 1 ATOM 629 C CG1 . ILE A 1 129 ? 35.439 -43.048 34.201 1.00 53.91 ? 140 ILE A CG1 1 ATOM 630 C CG2 . ILE A 1 129 ? 35.818 -45.512 34.541 1.00 37.48 ? 140 ILE A CG2 1 ATOM 631 C CD1 . ILE A 1 129 ? 36.478 -42.588 35.202 1.00 37.91 ? 140 ILE A CD1 1 ATOM 632 N N . ASN A 1 130 ? 33.377 -47.112 33.256 1.00 39.86 ? 141 ASN A N 1 ATOM 633 C CA . ASN A 1 130 ? 32.647 -48.366 33.407 1.00 48.73 ? 141 ASN A CA 1 ATOM 634 C C . ASN A 1 130 ? 32.689 -48.966 34.820 1.00 57.77 ? 141 ASN A C 1 ATOM 635 O O . ASN A 1 130 ? 33.751 -49.109 35.426 1.00 59.22 ? 141 ASN A O 1 ATOM 636 C CB . ASN A 1 130 ? 33.109 -49.386 32.366 1.00 36.29 ? 141 ASN A CB 1 ATOM 637 C CG . ASN A 1 130 ? 34.595 -49.655 32.431 1.00 45.02 ? 141 ASN A CG 1 ATOM 638 O OD1 . ASN A 1 130 ? 35.417 -48.738 32.361 1.00 57.73 ? 141 ASN A OD1 1 ATOM 639 N ND2 . ASN A 1 130 ? 34.950 -50.922 32.567 1.00 42.79 ? 141 ASN A ND2 1 ATOM 640 N N . GLU A 1 131 ? 31.513 -49.302 35.334 1.00 47.80 ? 142 GLU A N 1 ATOM 641 C CA . GLU A 1 131 ? 31.378 -49.865 36.666 1.00 44.33 ? 142 GLU A CA 1 ATOM 642 C C . GLU A 1 131 ? 31.736 -51.346 36.663 1.00 57.40 ? 142 GLU A C 1 ATOM 643 O O . GLU A 1 131 ? 31.325 -52.092 35.775 1.00 54.63 ? 142 GLU A O 1 ATOM 644 C CB . GLU A 1 131 ? 29.949 -49.670 37.181 1.00 40.04 ? 142 GLU A CB 1 ATOM 645 C CG . GLU A 1 131 ? 29.538 -48.218 37.311 1.00 62.31 ? 142 GLU A CG 1 ATOM 646 C CD . GLU A 1 131 ? 28.081 -48.055 37.687 1.00 69.64 ? 142 GLU A CD 1 ATOM 647 O OE1 . GLU A 1 131 ? 27.688 -46.923 38.058 1.00 55.84 ? 142 GLU A OE1 1 ATOM 648 O OE2 . GLU A 1 131 ? 27.335 -49.057 37.607 1.00 74.81 ? 142 GLU A OE2 1 ATOM 649 N N . ILE A 1 132 ? 32.502 -51.766 37.665 1.00 54.57 ? 143 ILE A N 1 ATOM 650 C CA . ILE A 1 132 ? 32.945 -53.150 37.762 1.00 52.74 ? 143 ILE A CA 1 ATOM 651 C C . ILE A 1 132 ? 31.853 -54.021 38.377 1.00 55.44 ? 143 ILE A C 1 ATOM 652 O O . ILE A 1 132 ? 31.105 -53.581 39.251 1.00 61.39 ? 143 ILE A O 1 ATOM 653 C CB . ILE A 1 132 ? 34.241 -53.265 38.598 1.00 58.74 ? 143 ILE A CB 1 ATOM 654 C CG1 . ILE A 1 132 ? 35.235 -52.170 38.198 1.00 72.81 ? 143 ILE A CG1 1 ATOM 655 C CG2 . ILE A 1 132 ? 34.869 -54.637 38.448 1.00 53.56 ? 143 ILE A CG2 1 ATOM 656 C CD1 . ILE A 1 132 ? 35.625 -52.185 36.730 1.00 66.71 ? 143 ILE A CD1 1 ATOM 657 N N . GLU A 1 133 ? 31.746 -55.250 37.889 1.00 47.52 ? 144 GLU A N 1 ATOM 658 C CA . GLU A 1 133 ? 30.860 -56.238 38.491 1.00 56.07 ? 144 GLU A CA 1 ATOM 659 C C . GLU A 1 133 ? 31.533 -56.808 39.734 1.00 65.18 ? 144 GLU A C 1 ATOM 660 O O . GLU A 1 133 ? 32.520 -57.539 39.633 1.00 63.74 ? 144 GLU A O 1 ATOM 661 C CB . GLU A 1 133 ? 30.560 -57.359 37.497 1.00 48.58 ? 144 GLU A CB 1 ATOM 662 C CG . GLU A 1 133 ? 29.736 -58.480 38.078 1.00 52.32 ? 144 GLU A CG 1 ATOM 663 C CD . GLU A 1 133 ? 28.460 -57.979 38.708 1.00 72.23 ? 144 GLU A CD 1 ATOM 664 O OE1 . GLU A 1 133 ? 28.396 -57.928 39.957 1.00 69.65 ? 144 GLU A OE1 1 ATOM 665 O OE2 . GLU A 1 133 ? 27.525 -57.633 37.951 1.00 83.34 ? 144 GLU A OE2 1 ATOM 666 N N . TYR A 1 134 ? 31.005 -56.465 40.905 1.00 61.60 ? 145 TYR A N 1 ATOM 667 C CA . TYR A 1 134 ? 31.639 -56.838 42.165 1.00 56.59 ? 145 TYR A CA 1 ATOM 668 C C . TYR A 1 134 ? 31.593 -58.345 42.417 1.00 67.82 ? 145 TYR A C 1 ATOM 669 O O . TYR A 1 134 ? 32.419 -58.889 43.149 1.00 81.22 ? 145 TYR A O 1 ATOM 670 C CB . TYR A 1 134 ? 31.012 -56.068 43.331 1.00 48.83 ? 145 TYR A CB 1 ATOM 671 C CG . TYR A 1 134 ? 31.304 -54.586 43.304 1.00 55.58 ? 145 TYR A CG 1 ATOM 672 C CD1 . TYR A 1 134 ? 32.529 -54.109 42.858 1.00 63.58 ? 145 TYR A CD1 1 ATOM 673 C CD2 . TYR A 1 134 ? 30.353 -53.663 43.713 1.00 56.48 ? 145 TYR A CD2 1 ATOM 674 C CE1 . TYR A 1 134 ? 32.802 -52.754 42.828 1.00 66.35 ? 145 TYR A CE1 1 ATOM 675 C CE2 . TYR A 1 134 ? 30.616 -52.305 43.688 1.00 60.50 ? 145 TYR A CE2 1 ATOM 676 C CZ . TYR A 1 134 ? 31.842 -51.856 43.243 1.00 71.68 ? 145 TYR A CZ 1 ATOM 677 O OH . TYR A 1 134 ? 32.107 -50.505 43.211 1.00 81.95 ? 145 TYR A OH 1 ATOM 678 N N . GLU A 1 135 ? 30.639 -59.024 41.790 1.00 65.92 ? 146 GLU A N 1 ATOM 679 C CA . GLU A 1 135 ? 30.518 -60.469 41.943 1.00 63.94 ? 146 GLU A CA 1 ATOM 680 C C . GLU A 1 135 ? 31.659 -61.240 41.278 1.00 69.27 ? 146 GLU A C 1 ATOM 681 O O . GLU A 1 135 ? 31.709 -62.467 41.354 1.00 72.32 ? 146 GLU A O 1 ATOM 682 C CB . GLU A 1 135 ? 29.161 -60.961 41.432 1.00 55.24 ? 146 GLU A CB 1 ATOM 683 C CG . GLU A 1 135 ? 27.990 -60.527 42.301 1.00 60.34 ? 146 GLU A CG 1 ATOM 684 C CD . GLU A 1 135 ? 28.213 -60.820 43.783 1.00 65.74 ? 146 GLU A CD 1 ATOM 685 O OE1 . GLU A 1 135 ? 28.407 -62.002 44.150 1.00 55.85 ? 146 GLU A OE1 1 ATOM 686 O OE2 . GLU A 1 135 ? 28.198 -59.860 44.583 1.00 65.03 ? 146 GLU A OE2 1 ATOM 687 N N . ASN A 1 136 ? 32.575 -60.522 40.636 1.00 61.76 ? 147 ASN A N 1 ATOM 688 C CA . ASN A 1 136 ? 33.721 -61.157 39.998 1.00 60.06 ? 147 ASN A CA 1 ATOM 689 C C . ASN A 1 136 ? 35.042 -60.827 40.681 1.00 65.92 ? 147 ASN A C 1 ATOM 690 O O . ASN A 1 136 ? 36.090 -61.322 40.270 1.00 64.18 ? 147 ASN A O 1 ATOM 691 C CB . ASN A 1 136 ? 33.816 -60.772 38.519 1.00 52.26 ? 147 ASN A CB 1 ATOM 692 C CG . ASN A 1 136 ? 32.583 -61.158 37.728 1.00 70.73 ? 147 ASN A CG 1 ATOM 693 O OD1 . ASN A 1 136 ? 31.811 -62.025 38.137 1.00 87.31 ? 147 ASN A OD1 1 ATOM 694 N ND2 . ASN A 1 136 ? 32.396 -60.516 36.579 1.00 62.28 ? 147 ASN A ND2 1 ATOM 695 N N . VAL A 1 137 ? 35.005 -59.988 41.713 1.00 60.72 ? 148 VAL A N 1 ATOM 696 C CA . VAL A 1 137 ? 36.247 -59.561 42.356 1.00 55.46 ? 148 VAL A CA 1 ATOM 697 C C . VAL A 1 137 ? 36.546 -60.280 43.670 1.00 58.32 ? 148 VAL A C 1 ATOM 698 O O . VAL A 1 137 ? 35.654 -60.523 44.486 1.00 60.53 ? 148 VAL A O 1 ATOM 699 C CB . VAL A 1 137 ? 36.303 -58.027 42.572 1.00 72.53 ? 148 VAL A CB 1 ATOM 700 C CG1 . VAL A 1 137 ? 36.186 -57.296 41.240 1.00 78.20 ? 148 VAL A CG1 1 ATOM 701 C CG2 . VAL A 1 137 ? 35.223 -57.573 43.534 1.00 73.08 ? 148 VAL A CG2 1 ATOM 702 N N . LYS A 1 138 ? 37.813 -60.627 43.857 1.00 59.19 ? 149 LYS A N 1 ATOM 703 C CA . LYS A 1 138 ? 38.272 -61.208 45.109 1.00 64.13 ? 149 LYS A CA 1 ATOM 704 C C . LYS A 1 138 ? 38.643 -60.093 46.083 1.00 71.85 ? 149 LYS A C 1 ATOM 705 O O . LYS A 1 138 ? 38.196 -60.080 47.229 1.00 68.79 ? 149 LYS A O 1 ATOM 706 C CB . LYS A 1 138 ? 39.471 -62.131 44.865 1.00 67.73 ? 149 LYS A CB 1 ATOM 707 C CG . LYS A 1 138 ? 40.269 -62.471 46.118 1.00 80.50 ? 149 LYS A CG 1 ATOM 708 C CD . LYS A 1 138 ? 39.391 -63.121 47.179 1.00 93.39 ? 149 LYS A CD 1 ATOM 709 C CE . LYS A 1 138 ? 39.985 -62.965 48.569 1.00 95.01 ? 149 LYS A CE 1 ATOM 710 N NZ . LYS A 1 138 ? 38.938 -63.119 49.618 1.00 95.33 ? 149 LYS A NZ 1 ATOM 711 N N . ALA A 1 139 ? 39.457 -59.154 45.618 1.00 76.67 ? 150 ALA A N 1 ATOM 712 C CA . ALA A 1 139 ? 39.920 -58.073 46.471 1.00 70.19 ? 150 ALA A CA 1 ATOM 713 C C . ALA A 1 139 ? 39.819 -56.722 45.773 1.00 58.68 ? 150 ALA A C 1 ATOM 714 O O . ALA A 1 139 ? 39.713 -56.651 44.552 1.00 68.69 ? 150 ALA A O 1 ATOM 715 C CB . ALA A 1 139 ? 41.348 -58.335 46.921 1.00 63.66 ? 150 ALA A CB 1 ATOM 716 N N . VAL A 1 140 ? 39.830 -55.657 46.570 1.00 65.02 ? 151 VAL A N 1 ATOM 717 C CA . VAL A 1 140 ? 39.874 -54.290 46.064 1.00 71.12 ? 151 VAL A CA 1 ATOM 718 C C . VAL A 1 140 ? 40.934 -53.538 46.844 1.00 67.99 ? 151 VAL A C 1 ATOM 719 O O . VAL A 1 140 ? 40.907 -53.525 48.069 1.00 64.19 ? 151 VAL A O 1 ATOM 720 C CB . VAL A 1 140 ? 38.544 -53.539 46.271 1.00 68.61 ? 151 VAL A CB 1 ATOM 721 C CG1 . VAL A 1 140 ? 38.514 -52.287 45.407 1.00 67.49 ? 151 VAL A CG1 1 ATOM 722 C CG2 . VAL A 1 140 ? 37.359 -54.429 45.957 1.00 71.67 ? 151 VAL A CG2 1 ATOM 723 N N . GLU A 1 141 ? 41.865 -52.909 46.139 1.00 79.26 ? 152 GLU A N 1 ATOM 724 C CA . GLU A 1 141 ? 42.929 -52.155 46.792 1.00 85.65 ? 152 GLU A CA 1 ATOM 725 C C . GLU A 1 141 ? 42.832 -50.672 46.459 1.00 84.31 ? 152 GLU A C 1 ATOM 726 O O . GLU A 1 141 ? 43.171 -50.247 45.354 1.00 92.65 ? 152 GLU A O 1 ATOM 727 C CB . GLU A 1 141 ? 44.295 -52.695 46.378 1.00 98.80 ? 152 GLU A CB 1 ATOM 728 C CG . GLU A 1 141 ? 45.468 -51.930 46.957 1.00 109.33 ? 152 GLU A CG 1 ATOM 729 C CD . GLU A 1 141 ? 46.778 -52.285 46.282 1.00 123.30 ? 152 GLU A CD 1 ATOM 730 O OE1 . GLU A 1 141 ? 47.025 -51.781 45.163 1.00 126.18 ? 152 GLU A OE1 1 ATOM 731 O OE2 . GLU A 1 141 ? 47.556 -53.069 46.868 1.00 126.38 ? 152 GLU A OE2 1 ATOM 732 N N . ILE A 1 142 ? 42.363 -49.887 47.420 1.00 66.45 ? 153 ILE A N 1 ATOM 733 C CA . ILE A 1 142 ? 42.248 -48.449 47.237 1.00 59.43 ? 153 ILE A CA 1 ATOM 734 C C . ILE A 1 142 ? 43.446 -47.744 47.862 1.00 59.13 ? 153 ILE A C 1 ATOM 735 O O . ILE A 1 142 ? 43.709 -47.892 49.053 1.00 64.75 ? 153 ILE A O 1 ATOM 736 C CB . ILE A 1 142 ? 40.948 -47.914 47.867 1.00 63.40 ? 153 ILE A CB 1 ATOM 737 C CG1 . ILE A 1 142 ? 39.735 -48.610 47.249 1.00 63.10 ? 153 ILE A CG1 1 ATOM 738 C CG2 . ILE A 1 142 ? 40.849 -46.400 47.705 1.00 52.88 ? 153 ILE A CG2 1 ATOM 739 C CD1 . ILE A 1 142 ? 38.415 -48.130 47.800 1.00 61.91 ? 153 ILE A CD1 1 ATOM 740 N N . SER A 1 143 ? 44.177 -46.987 47.053 1.00 66.65 ? 154 SER A N 1 ATOM 741 C CA . SER A 1 143 ? 45.336 -46.247 47.541 1.00 71.45 ? 154 SER A CA 1 ATOM 742 C C . SER A 1 143 ? 45.046 -44.752 47.540 1.00 71.90 ? 154 SER A C 1 ATOM 743 O O . SER A 1 143 ? 44.619 -44.204 46.525 1.00 79.98 ? 154 SER A O 1 ATOM 744 C CB . SER A 1 143 ? 46.554 -46.522 46.657 1.00 72.82 ? 154 SER A CB 1 ATOM 745 O OG . SER A 1 143 ? 46.700 -47.902 46.388 1.00 80.78 ? 154 SER A OG 1 ATOM 746 N N . LYS A 1 144 ? 45.277 -44.089 48.669 1.00 69.70 ? 155 LYS A N 1 ATOM 747 C CA . LYS A 1 144 ? 45.137 -42.636 48.721 1.00 76.90 ? 155 LYS A CA 1 ATOM 748 C C . LYS A 1 144 ? 46.473 -41.981 48.392 1.00 83.36 ? 155 LYS A C 1 ATOM 749 O O . LYS A 1 144 ? 47.533 -42.554 48.656 1.00 85.97 ? 155 LYS A O 1 ATOM 750 C CB . LYS A 1 144 ? 44.638 -42.172 50.090 1.00 77.65 ? 155 LYS A CB 1 ATOM 751 C CG . LYS A 1 144 ? 43.310 -42.777 50.509 1.00 79.63 ? 155 LYS A CG 1 ATOM 752 C CD . LYS A 1 144 ? 42.925 -42.348 51.918 1.00 87.81 ? 155 LYS A CD 1 ATOM 753 C CE . LYS A 1 144 ? 41.769 -43.182 52.450 1.00 88.31 ? 155 LYS A CE 1 ATOM 754 N NZ . LYS A 1 144 ? 41.209 -42.627 53.710 1.00 86.00 ? 155 LYS A NZ 1 ATOM 755 N N . GLY A 1 145 ? 46.416 -40.786 47.810 1.00 72.99 ? 156 GLY A N 1 ATOM 756 C CA . GLY A 1 145 ? 47.615 -40.064 47.425 1.00 63.97 ? 156 GLY A CA 1 ATOM 757 C C . GLY A 1 145 ? 48.209 -40.585 46.131 1.00 75.13 ? 156 GLY A C 1 ATOM 758 O O . GLY A 1 145 ? 47.683 -41.526 45.536 1.00 67.76 ? 156 GLY A O 1 ATOM 759 N N . SER A 1 146 ? 49.307 -39.969 45.700 1.00 77.16 ? 157 SER A N 1 ATOM 760 C CA . SER A 1 146 ? 50.014 -40.368 44.485 1.00 70.65 ? 157 SER A CA 1 ATOM 761 C C . SER A 1 146 ? 50.387 -41.849 44.520 1.00 72.15 ? 157 SER A C 1 ATOM 762 O O . SER A 1 146 ? 50.598 -42.412 45.595 1.00 71.80 ? 157 SER A O 1 ATOM 763 C CB . SER A 1 146 ? 51.281 -39.530 44.326 1.00 71.18 ? 157 SER A CB 1 ATOM 764 O OG . SER A 1 146 ? 51.043 -38.169 44.633 1.00 71.55 ? 157 SER A OG 1 ATOM 765 N N . ASN A 1 147 ? 50.476 -42.474 43.347 1.00 69.07 ? 158 ASN A N 1 ATOM 766 C CA . ASN A 1 147 ? 50.755 -43.906 43.264 1.00 68.02 ? 158 ASN A CA 1 ATOM 767 C C . ASN A 1 147 ? 51.129 -44.379 41.861 1.00 64.43 ? 158 ASN A C 1 ATOM 768 O O . ASN A 1 147 ? 50.742 -45.471 41.449 1.00 61.97 ? 158 ASN A O 1 ATOM 769 C CB . ASN A 1 147 ? 49.548 -44.706 43.761 1.00 71.44 ? 158 ASN A CB 1 ATOM 770 C CG . ASN A 1 147 ? 49.922 -46.097 44.229 1.00 78.71 ? 158 ASN A CG 1 ATOM 771 O OD1 . ASN A 1 147 ? 51.051 -46.336 44.661 1.00 77.29 ? 158 ASN A OD1 1 ATOM 772 N ND2 . ASN A 1 147 ? 48.977 -47.023 44.144 1.00 77.60 ? 158 ASN A ND2 1 ATOM 773 N N . SER A 1 148 ? 51.885 -43.566 41.132 1.00 71.31 ? 159 SER A N 1 ATOM 774 C CA . SER A 1 148 ? 52.211 -43.873 39.738 1.00 67.55 ? 159 SER A CA 1 ATOM 775 C C . SER A 1 148 ? 53.211 -45.011 39.569 1.00 69.59 ? 159 SER A C 1 ATOM 776 O O . SER A 1 148 ? 53.211 -45.700 38.555 1.00 72.19 ? 159 SER A O 1 ATOM 777 C CB . SER A 1 148 ? 52.715 -42.625 39.012 1.00 64.01 ? 159 SER A CB 1 ATOM 778 O OG . SER A 1 148 ? 51.633 -41.795 38.642 1.00 55.92 ? 159 SER A OG 1 ATOM 779 N N . VAL A 1 149 ? 54.070 -45.206 40.558 1.00 54.01 ? 160 VAL A N 1 ATOM 780 C CA . VAL A 1 149 ? 55.038 -46.291 40.497 1.00 67.34 ? 160 VAL A CA 1 ATOM 781 C C . VAL A 1 149 ? 54.321 -47.652 40.501 1.00 65.21 ? 160 VAL A C 1 ATOM 782 O O . VAL A 1 149 ? 54.800 -48.626 39.916 1.00 66.25 ? 160 VAL A O 1 ATOM 783 C CB . VAL A 1 149 ? 56.087 -46.153 41.626 1.00 72.24 ? 160 VAL A CB 1 ATOM 784 C CG1 . VAL A 1 149 ? 55.534 -45.293 42.756 1.00 81.26 ? 160 VAL A CG1 1 ATOM 785 C CG2 . VAL A 1 149 ? 56.560 -47.514 42.128 1.00 61.11 ? 160 VAL A CG2 1 ATOM 786 N N . GLU A 1 150 ? 53.149 -47.699 41.126 1.00 66.07 ? 161 GLU A N 1 ATOM 787 C CA . GLU A 1 150 ? 52.327 -48.907 41.120 1.00 67.30 ? 161 GLU A CA 1 ATOM 788 C C . GLU A 1 150 ? 51.329 -48.953 39.956 1.00 70.28 ? 161 GLU A C 1 ATOM 789 O O . GLU A 1 150 ? 51.153 -49.997 39.327 1.00 72.86 ? 161 GLU A O 1 ATOM 790 C CB . GLU A 1 150 ? 51.566 -49.054 42.440 1.00 70.82 ? 161 GLU A CB 1 ATOM 791 C CG . GLU A 1 150 ? 52.441 -49.263 43.660 1.00 85.37 ? 161 GLU A CG 1 ATOM 792 C CD . GLU A 1 150 ? 51.634 -49.632 44.891 1.00 92.19 ? 161 GLU A CD 1 ATOM 793 O OE1 . GLU A 1 150 ? 50.408 -49.831 44.759 1.00 91.30 ? 161 GLU A OE1 1 ATOM 794 O OE2 . GLU A 1 150 ? 52.225 -49.723 45.987 1.00 95.44 ? 161 GLU A OE2 1 ATOM 795 N N . GLN A 1 151 ? 50.677 -47.827 39.674 1.00 71.98 ? 162 GLN A N 1 ATOM 796 C CA . GLN A 1 151 ? 49.562 -47.815 38.726 1.00 67.14 ? 162 GLN A CA 1 ATOM 797 C C . GLN A 1 151 ? 49.749 -46.893 37.523 1.00 63.65 ? 162 GLN A C 1 ATOM 798 O O . GLN A 1 151 ? 48.825 -46.720 36.731 1.00 68.84 ? 162 GLN A O 1 ATOM 799 C CB . GLN A 1 151 ? 48.259 -47.464 39.444 1.00 67.65 ? 162 GLN A CB 1 ATOM 800 C CG . GLN A 1 151 ? 47.884 -48.440 40.536 1.00 75.40 ? 162 GLN A CG 1 ATOM 801 C CD . GLN A 1 151 ? 47.622 -49.825 39.997 1.00 75.08 ? 162 GLN A CD 1 ATOM 802 O OE1 . GLN A 1 151 ? 47.097 -49.982 38.898 1.00 70.43 ? 162 GLN A OE1 1 ATOM 803 N NE2 . GLN A 1 151 ? 47.992 -50.842 40.766 1.00 92.42 ? 162 GLN A NE2 1 ATOM 804 N N . GLY A 1 152 ? 50.930 -46.297 37.396 1.00 54.18 ? 163 GLY A N 1 ATOM 805 C CA . GLY A 1 152 ? 51.269 -45.512 36.219 1.00 69.14 ? 163 GLY A CA 1 ATOM 806 C C . GLY A 1 152 ? 50.520 -44.202 36.052 1.00 69.28 ? 163 GLY A C 1 ATOM 807 O O . GLY A 1 152 ? 50.204 -43.517 37.027 1.00 69.22 ? 163 GLY A O 1 ATOM 808 N N . SER A 1 153 ? 50.250 -43.853 34.798 1.00 48.84 ? 164 SER A N 1 ATOM 809 C CA . SER A 1 153 ? 49.511 -42.643 34.468 1.00 58.06 ? 164 SER A CA 1 ATOM 810 C C . SER A 1 153 ? 48.077 -42.717 34.981 1.00 52.76 ? 164 SER A C 1 ATOM 811 O O . SER A 1 153 ? 47.390 -43.722 34.795 1.00 48.88 ? 164 SER A O 1 ATOM 812 C CB . SER A 1 153 ? 49.513 -42.422 32.954 1.00 58.99 ? 164 SER A CB 1 ATOM 813 O OG . SER A 1 153 ? 48.743 -41.288 32.592 1.00 61.66 ? 164 SER A OG 1 ATOM 814 N N . GLY A 1 154 ? 47.631 -41.650 35.632 1.00 50.86 ? 165 GLY A N 1 ATOM 815 C CA . GLY A 1 154 ? 46.283 -41.601 36.160 1.00 56.78 ? 165 GLY A CA 1 ATOM 816 C C . GLY A 1 154 ? 46.239 -41.695 37.671 1.00 59.08 ? 165 GLY A C 1 ATOM 817 O O . GLY A 1 154 ? 45.204 -41.447 38.280 1.00 62.01 ? 165 GLY A O 1 ATOM 818 N N . ALA A 1 155 ? 47.363 -42.051 38.280 1.00 52.86 ? 166 ALA A N 1 ATOM 819 C CA . ALA A 1 155 ? 47.432 -42.166 39.730 1.00 66.68 ? 166 ALA A CA 1 ATOM 820 C C . ALA A 1 155 ? 47.888 -40.858 40.371 1.00 74.26 ? 166 ALA A C 1 ATOM 821 O O . ALA A 1 155 ? 48.773 -40.851 41.227 1.00 78.32 ? 166 ALA A O 1 ATOM 822 C CB . ALA A 1 155 ? 48.350 -43.309 40.127 1.00 68.93 ? 166 ALA A CB 1 ATOM 823 N N . LEU A 1 156 ? 47.275 -39.755 39.951 1.00 68.98 ? 167 LEU A N 1 ATOM 824 C CA . LEU A 1 156 ? 47.608 -38.433 40.467 1.00 48.50 ? 167 LEU A CA 1 ATOM 825 C C . LEU A 1 156 ? 47.264 -38.309 41.941 1.00 49.83 ? 167 LEU A C 1 ATOM 826 O O . LEU A 1 156 ? 48.092 -37.903 42.752 1.00 72.63 ? 167 LEU A O 1 ATOM 827 C CB . LEU A 1 156 ? 46.833 -37.362 39.705 1.00 48.49 ? 167 LEU A CB 1 ATOM 828 C CG . LEU A 1 156 ? 47.593 -36.292 38.926 1.00 63.21 ? 167 LEU A CG 1 ATOM 829 C CD1 . LEU A 1 156 ? 46.982 -34.924 39.198 1.00 67.91 ? 167 LEU A CD1 1 ATOM 830 C CD2 . LEU A 1 156 ? 49.083 -36.308 39.230 1.00 48.82 ? 167 LEU A CD2 1 ATOM 831 N N . ALA A 1 157 ? 46.029 -38.658 42.277 1.00 50.44 ? 168 ALA A N 1 ATOM 832 C CA . ALA A 1 157 ? 45.504 -38.429 43.615 1.00 62.14 ? 168 ALA A CA 1 ATOM 833 C C . ALA A 1 157 ? 45.174 -39.733 44.325 1.00 65.77 ? 168 ALA A C 1 ATOM 834 O O . ALA A 1 157 ? 44.817 -39.735 45.503 1.00 60.18 ? 168 ALA A O 1 ATOM 835 C CB . ALA A 1 157 ? 44.271 -37.561 43.535 1.00 49.86 ? 168 ALA A CB 1 ATOM 836 N N . GLY A 1 158 ? 45.285 -40.840 43.602 1.00 64.91 ? 169 GLY A N 1 ATOM 837 C CA . GLY A 1 158 ? 44.936 -42.132 44.154 1.00 67.49 ? 169 GLY A CA 1 ATOM 838 C C . GLY A 1 158 ? 44.754 -43.188 43.086 1.00 65.38 ? 169 GLY A C 1 ATOM 839 O O . GLY A 1 158 ? 44.942 -42.927 41.899 1.00 69.64 ? 169 GLY A O 1 ATOM 840 N N . SER A 1 159 ? 44.389 -44.388 43.516 1.00 58.47 ? 170 SER A N 1 ATOM 841 C CA . SER A 1 159 ? 44.174 -45.490 42.596 1.00 62.18 ? 170 SER A CA 1 ATOM 842 C C . SER A 1 159 ? 43.243 -46.520 43.209 1.00 52.42 ? 170 SER A C 1 ATOM 843 O O . SER A 1 159 ? 43.242 -46.726 44.418 1.00 63.52 ? 170 SER A O 1 ATOM 844 C CB . SER A 1 159 ? 45.502 -46.147 42.224 1.00 70.57 ? 170 SER A CB 1 ATOM 845 O OG . SER A 1 159 ? 46.103 -46.759 43.348 1.00 80.32 ? 170 SER A OG 1 ATOM 846 N N . VAL A 1 160 ? 42.443 -47.153 42.361 1.00 47.41 ? 171 VAL A N 1 ATOM 847 C CA . VAL A 1 160 ? 41.553 -48.224 42.775 1.00 47.65 ? 171 VAL A CA 1 ATOM 848 C C . VAL A 1 160 ? 41.856 -49.443 41.914 1.00 47.94 ? 171 VAL A C 1 ATOM 849 O O . VAL A 1 160 ? 41.726 -49.398 40.693 1.00 55.97 ? 171 VAL A O 1 ATOM 850 C CB . VAL A 1 160 ? 40.077 -47.829 42.599 1.00 48.00 ? 171 VAL A CB 1 ATOM 851 C CG1 . VAL A 1 160 ? 39.167 -48.931 43.103 1.00 55.83 ? 171 VAL A CG1 1 ATOM 852 C CG2 . VAL A 1 160 ? 39.782 -46.524 43.315 1.00 49.63 ? 171 VAL A CG2 1 ATOM 853 N N . ALA A 1 161 ? 42.284 -50.528 42.550 1.00 60.26 ? 172 ALA A N 1 ATOM 854 C CA . ALA A 1 161 ? 42.660 -51.731 41.819 1.00 56.59 ? 172 ALA A CA 1 ATOM 855 C C . ALA A 1 161 ? 41.825 -52.930 42.250 1.00 61.12 ? 172 ALA A C 1 ATOM 856 O O . ALA A 1 161 ? 41.678 -53.198 43.444 1.00 66.62 ? 172 ALA A O 1 ATOM 857 C CB . ALA A 1 161 ? 44.140 -52.013 41.995 1.00 49.30 ? 172 ALA A CB 1 ATOM 858 N N . PHE A 1 162 ? 41.268 -53.637 41.271 1.00 55.48 ? 173 PHE A N 1 ATOM 859 C CA . PHE A 1 162 ? 40.493 -54.848 41.536 1.00 59.01 ? 173 PHE A CA 1 ATOM 860 C C . PHE A 1 162 ? 41.258 -56.082 41.070 1.00 58.87 ? 173 PHE A C 1 ATOM 861 O O . PHE A 1 162 ? 41.951 -56.043 40.054 1.00 63.43 ? 173 PHE A O 1 ATOM 862 C CB . PHE A 1 162 ? 39.161 -54.818 40.782 1.00 48.92 ? 173 PHE A CB 1 ATOM 863 C CG . PHE A 1 162 ? 38.171 -53.812 41.299 1.00 47.37 ? 173 PHE A CG 1 ATOM 864 C CD1 . PHE A 1 162 ? 37.299 -54.141 42.324 1.00 53.01 ? 173 PHE A CD1 1 ATOM 865 C CD2 . PHE A 1 162 ? 38.085 -52.551 40.734 1.00 48.52 ? 173 PHE A CD2 1 ATOM 866 C CE1 . PHE A 1 162 ? 36.373 -53.223 42.790 1.00 58.46 ? 173 PHE A CE1 1 ATOM 867 C CE2 . PHE A 1 162 ? 37.164 -51.629 41.198 1.00 53.80 ? 173 PHE A CE2 1 ATOM 868 C CZ . PHE A 1 162 ? 36.306 -51.966 42.226 1.00 51.27 ? 173 PHE A CZ 1 ATOM 869 N N . GLN A 1 163 ? 41.123 -57.183 41.800 1.00 50.09 ? 174 GLN A N 1 ATOM 870 C CA . GLN A 1 163 ? 41.601 -58.470 41.296 1.00 75.40 ? 174 GLN A CA 1 ATOM 871 C C . GLN A 1 163 ? 40.436 -59.458 41.178 1.00 65.31 ? 174 GLN A C 1 ATOM 872 O O . GLN A 1 163 ? 39.589 -59.556 42.070 1.00 65.30 ? 174 GLN A O 1 ATOM 873 C CB . GLN A 1 163 ? 42.767 -59.036 42.129 1.00 52.38 ? 174 GLN A CB 1 ATOM 874 C CG . GLN A 1 163 ? 42.424 -59.430 43.559 1.00 124.72 ? 174 GLN A CG 1 ATOM 875 C CD . GLN A 1 163 ? 43.523 -60.255 44.216 1.00 117.43 ? 174 GLN A CD 1 ATOM 876 O OE1 . GLN A 1 163 ? 43.268 -61.035 45.137 1.00 107.06 ? 174 GLN A OE1 1 ATOM 877 N NE2 . GLN A 1 163 ? 44.752 -60.088 43.739 1.00 114.69 ? 174 GLN A NE2 1 ATOM 878 N N . THR A 1 164 ? 40.389 -60.165 40.055 1.00 61.12 ? 175 THR A N 1 ATOM 879 C CA . THR A 1 164 ? 39.274 -61.052 39.747 1.00 65.79 ? 175 THR A CA 1 ATOM 880 C C . THR A 1 164 ? 39.378 -62.350 40.542 1.00 70.42 ? 175 THR A C 1 ATOM 881 O O . THR A 1 164 ? 40.475 -62.781 40.890 1.00 81.24 ? 175 THR A O 1 ATOM 882 C CB . THR A 1 164 ? 39.227 -61.364 38.235 1.00 69.17 ? 175 THR A CB 1 ATOM 883 O OG1 . THR A 1 164 ? 39.369 -60.148 37.494 1.00 69.70 ? 175 THR A OG1 1 ATOM 884 C CG2 . THR A 1 164 ? 37.915 -62.021 37.848 1.00 72.49 ? 175 THR A CG2 1 ATOM 885 N N . LYS A 1 165 ? 38.230 -62.957 40.832 1.00 64.38 ? 176 LYS A N 1 ATOM 886 C CA . LYS A 1 165 ? 38.168 -64.228 41.549 1.00 72.79 ? 176 LYS A CA 1 ATOM 887 C C . LYS A 1 165 ? 38.857 -65.362 40.793 1.00 80.67 ? 176 LYS A C 1 ATOM 888 O O . LYS A 1 165 ? 39.192 -65.227 39.615 1.00 81.11 ? 176 LYS A O 1 ATOM 889 C CB . LYS A 1 165 ? 36.711 -64.618 41.810 1.00 67.69 ? 176 LYS A CB 1 ATOM 890 C CG . LYS A 1 165 ? 36.005 -63.792 42.871 1.00 63.74 ? 176 LYS A CG 1 ATOM 891 C CD . LYS A 1 165 ? 34.554 -64.219 43.002 1.00 54.49 ? 176 LYS A CD 1 ATOM 892 C CE . LYS A 1 165 ? 33.824 -63.409 44.063 1.00 58.12 ? 176 LYS A CE 1 ATOM 893 N NZ . LYS A 1 165 ? 32.366 -63.739 44.108 1.00 57.04 ? 176 LYS A NZ 1 ATOM 894 N N . THR A 1 166 ? 39.066 -66.479 41.485 1.00 76.45 ? 177 THR A N 1 ATOM 895 C CA . THR A 1 166 ? 39.547 -67.707 40.857 1.00 76.72 ? 177 THR A CA 1 ATOM 896 C C . THR A 1 166 ? 38.689 -68.887 41.300 1.00 73.05 ? 177 THR A C 1 ATOM 897 O O . THR A 1 166 ? 37.744 -68.721 42.068 1.00 76.92 ? 177 THR A O 1 ATOM 898 C CB . THR A 1 166 ? 41.018 -67.997 41.201 1.00 80.32 ? 177 THR A CB 1 ATOM 899 O OG1 . THR A 1 166 ? 41.169 -68.094 42.623 1.00 91.29 ? 177 THR A OG1 1 ATOM 900 C CG2 . THR A 1 166 ? 41.921 -66.896 40.667 1.00 67.27 ? 177 THR A CG2 1 ATOM 901 N N . ALA A 1 167 ? 39.021 -70.078 40.814 1.00 73.00 ? 178 ALA A N 1 ATOM 902 C CA . ALA A 1 167 ? 38.268 -71.279 41.160 1.00 80.08 ? 178 ALA A CA 1 ATOM 903 C C . ALA A 1 167 ? 38.353 -71.601 42.651 1.00 84.77 ? 178 ALA A C 1 ATOM 904 O O . ALA A 1 167 ? 37.413 -72.149 43.229 1.00 73.57 ? 178 ALA A O 1 ATOM 905 C CB . ALA A 1 167 ? 38.748 -72.460 40.335 1.00 77.89 ? 178 ALA A CB 1 ATOM 906 N N . ASP A 1 168 ? 39.478 -71.250 43.269 1.00 85.64 ? 179 ASP A N 1 ATOM 907 C CA . ASP A 1 168 ? 39.690 -71.535 44.686 1.00 94.65 ? 179 ASP A CA 1 ATOM 908 C C . ASP A 1 168 ? 38.829 -70.681 45.611 1.00 92.74 ? 179 ASP A C 1 ATOM 909 O O . ASP A 1 168 ? 38.642 -71.018 46.780 1.00 102.67 ? 179 ASP A O 1 ATOM 910 C CB . ASP A 1 168 ? 41.168 -71.389 45.060 1.00 102.96 ? 179 ASP A CB 1 ATOM 911 C CG . ASP A 1 168 ? 41.956 -72.659 44.816 1.00 111.28 ? 179 ASP A CG 1 ATOM 912 O OD1 . ASP A 1 168 ? 41.345 -73.749 44.821 1.00 112.06 ? 179 ASP A OD1 1 ATOM 913 O OD2 . ASP A 1 168 ? 43.187 -72.570 44.622 1.00 113.99 ? 179 ASP A OD2 1 ATOM 914 N N . ASP A 1 169 ? 38.307 -69.577 45.089 1.00 81.12 ? 180 ASP A N 1 ATOM 915 C CA . ASP A 1 169 ? 37.463 -68.698 45.889 1.00 76.41 ? 180 ASP A CA 1 ATOM 916 C C . ASP A 1 169 ? 36.044 -69.245 45.990 1.00 83.81 ? 180 ASP A C 1 ATOM 917 O O . ASP A 1 169 ? 35.226 -68.740 46.758 1.00 87.89 ? 180 ASP A O 1 ATOM 918 C CB . ASP A 1 169 ? 37.454 -67.282 45.311 1.00 84.62 ? 180 ASP A CB 1 ATOM 919 C CG . ASP A 1 169 ? 38.818 -66.627 45.361 1.00 94.87 ? 180 ASP A CG 1 ATOM 920 O OD1 . ASP A 1 169 ? 39.210 -66.164 46.453 1.00 87.68 ? 180 ASP A OD1 1 ATOM 921 O OD2 . ASP A 1 169 ? 39.496 -66.575 44.313 1.00 105.77 ? 180 ASP A OD2 1 ATOM 922 N N . VAL A 1 170 ? 35.762 -70.284 45.211 1.00 93.16 ? 181 VAL A N 1 ATOM 923 C CA . VAL A 1 170 ? 34.445 -70.910 45.200 1.00 94.66 ? 181 VAL A CA 1 ATOM 924 C C . VAL A 1 170 ? 34.546 -72.355 45.692 1.00 105.84 ? 181 VAL A C 1 ATOM 925 O O . VAL A 1 170 ? 33.595 -72.907 46.251 1.00 101.50 ? 181 VAL A O 1 ATOM 926 C CB . VAL A 1 170 ? 33.833 -70.877 43.783 1.00 78.90 ? 181 VAL A CB 1 ATOM 927 C CG1 . VAL A 1 170 ? 32.383 -71.333 43.804 1.00 77.30 ? 181 VAL A CG1 1 ATOM 928 C CG2 . VAL A 1 170 ? 33.940 -69.482 43.196 1.00 69.00 ? 181 VAL A CG2 1 ATOM 929 N N . ILE A 1 171 ? 35.717 -72.953 45.491 1.00 109.07 ? 182 ILE A N 1 ATOM 930 C CA . ILE A 1 171 ? 35.964 -74.343 45.866 1.00 96.81 ? 182 ILE A CA 1 ATOM 931 C C . ILE A 1 171 ? 36.523 -74.464 47.283 1.00 90.71 ? 182 ILE A C 1 ATOM 932 O O . ILE A 1 171 ? 37.607 -73.958 47.582 1.00 82.39 ? 182 ILE A O 1 ATOM 933 C CB . ILE A 1 171 ? 36.920 -75.017 44.867 1.00 92.37 ? 182 ILE A CB 1 ATOM 934 C CG1 . ILE A 1 171 ? 36.236 -75.153 43.502 1.00 84.95 ? 182 ILE A CG1 1 ATOM 935 C CG2 . ILE A 1 171 ? 37.374 -76.366 45.389 1.00 71.10 ? 182 ILE A CG2 1 ATOM 936 C CD1 . ILE A 1 171 ? 37.164 -75.571 42.379 1.00 66.97 ? 182 ILE A CD1 1 ATOM 937 N N . GLY A 1 172 ? 35.772 -75.147 48.144 1.00 98.91 ? 183 GLY A N 1 ATOM 938 C CA . GLY A 1 172 ? 36.097 -75.262 49.556 1.00 101.41 ? 183 GLY A CA 1 ATOM 939 C C . GLY A 1 172 ? 37.381 -76.003 49.884 1.00 98.47 ? 183 GLY A C 1 ATOM 940 O O . GLY A 1 172 ? 38.034 -76.559 48.998 1.00 97.31 ? 183 GLY A O 1 ATOM 941 N N . GLU A 1 173 ? 37.726 -76.012 51.170 1.00 96.37 ? 184 GLU A N 1 ATOM 942 C CA . GLU A 1 173 ? 38.991 -76.570 51.655 1.00 99.84 ? 184 GLU A CA 1 ATOM 943 C C . GLU A 1 173 ? 39.257 -78.014 51.222 1.00 102.76 ? 184 GLU A C 1 ATOM 944 O O . GLU A 1 173 ? 40.281 -78.306 50.601 1.00 108.01 ? 184 GLU A O 1 ATOM 945 C CB . GLU A 1 173 ? 39.066 -76.467 53.181 1.00 90.32 ? 184 GLU A CB 1 ATOM 946 N N . GLY A 1 174 ? 38.336 -78.913 51.548 1.00 93.04 ? 185 GLY A N 1 ATOM 947 C CA . GLY A 1 174 ? 38.526 -80.319 51.246 1.00 117.15 ? 185 GLY A CA 1 ATOM 948 C C . GLY A 1 174 ? 37.575 -80.858 50.197 1.00 126.07 ? 185 GLY A C 1 ATOM 949 O O . GLY A 1 174 ? 37.145 -82.010 50.277 1.00 132.34 ? 185 GLY A O 1 ATOM 950 N N . ARG A 1 175 ? 37.249 -80.028 49.209 1.00 118.93 ? 186 ARG A N 1 ATOM 951 C CA . ARG A 1 175 ? 36.318 -80.424 48.155 1.00 107.00 ? 186 ARG A CA 1 ATOM 952 C C . ARG A 1 175 ? 36.926 -80.240 46.762 1.00 100.82 ? 186 ARG A C 1 ATOM 953 O O . ARG A 1 175 ? 37.897 -79.502 46.589 1.00 88.85 ? 186 ARG A O 1 ATOM 954 C CB . ARG A 1 175 ? 34.998 -79.657 48.292 1.00 95.45 ? 186 ARG A CB 1 ATOM 955 C CG . ARG A 1 175 ? 34.392 -79.750 49.694 1.00 92.07 ? 186 ARG A CG 1 ATOM 956 C CD . ARG A 1 175 ? 33.072 -79.005 49.825 1.00 91.41 ? 186 ARG A CD 1 ATOM 957 N NE . ARG A 1 175 ? 31.999 -79.639 49.064 1.00 99.07 ? 186 ARG A NE 1 ATOM 958 C CZ . ARG A 1 175 ? 31.534 -79.186 47.904 1.00 110.82 ? 186 ARG A CZ 1 ATOM 959 N NH1 . ARG A 1 175 ? 32.044 -78.085 47.362 1.00 122.22 ? 186 ARG A NH1 1 ATOM 960 N NH2 . ARG A 1 175 ? 30.554 -79.831 47.287 1.00 106.81 ? 186 ARG A NH2 1 ATOM 961 N N . GLN A 1 176 ? 36.355 -80.925 45.775 1.00 99.83 ? 187 GLN A N 1 ATOM 962 C CA . GLN A 1 176 ? 36.885 -80.887 44.415 1.00 98.44 ? 187 GLN A CA 1 ATOM 963 C C . GLN A 1 176 ? 36.134 -79.887 43.542 1.00 100.66 ? 187 GLN A C 1 ATOM 964 O O . GLN A 1 176 ? 36.611 -79.495 42.476 1.00 98.64 ? 187 GLN A O 1 ATOM 965 C CB . GLN A 1 176 ? 36.851 -82.282 43.786 1.00 106.96 ? 187 GLN A CB 1 ATOM 966 C CG . GLN A 1 176 ? 38.207 -82.767 43.297 1.00 114.89 ? 187 GLN A CG 1 ATOM 967 C CD . GLN A 1 176 ? 39.307 -82.556 44.325 1.00 120.38 ? 187 GLN A CD 1 ATOM 968 O OE1 . GLN A 1 176 ? 40.016 -81.548 44.293 1.00 120.21 ? 187 GLN A OE1 1 ATOM 969 N NE2 . GLN A 1 176 ? 39.453 -83.507 45.242 1.00 117.54 ? 187 GLN A NE2 1 ATOM 970 N N . TRP A 1 177 ? 34.957 -79.478 44.002 1.00 105.58 ? 188 TRP A N 1 ATOM 971 C CA . TRP A 1 177 ? 34.173 -78.470 43.301 1.00 108.01 ? 188 TRP A CA 1 ATOM 972 C C . TRP A 1 177 ? 33.423 -77.566 44.277 1.00 104.21 ? 188 TRP A C 1 ATOM 973 O O . TRP A 1 177 ? 33.670 -77.592 45.483 1.00 106.81 ? 188 TRP A O 1 ATOM 974 C CB . TRP A 1 177 ? 33.193 -79.120 42.318 1.00 114.56 ? 188 TRP A CB 1 ATOM 975 C CG . TRP A 1 177 ? 32.047 -79.842 42.968 1.00 114.62 ? 188 TRP A CG 1 ATOM 976 C CD1 . TRP A 1 177 ? 32.071 -80.535 44.142 1.00 109.42 ? 188 TRP A CD1 1 ATOM 977 C CD2 . TRP A 1 177 ? 30.703 -79.930 42.478 1.00 115.78 ? 188 TRP A CD2 1 ATOM 978 N NE1 . TRP A 1 177 ? 30.829 -81.054 44.411 1.00 104.87 ? 188 TRP A NE1 1 ATOM 979 C CE2 . TRP A 1 177 ? 29.971 -80.697 43.406 1.00 108.69 ? 188 TRP A CE2 1 ATOM 980 C CE3 . TRP A 1 177 ? 30.049 -79.439 41.344 1.00 121.28 ? 188 TRP A CE3 1 ATOM 981 C CZ2 . TRP A 1 177 ? 28.619 -80.982 43.236 1.00 110.39 ? 188 TRP A CZ2 1 ATOM 982 C CZ3 . TRP A 1 177 ? 28.706 -79.725 41.176 1.00 121.07 ? 188 TRP A CZ3 1 ATOM 983 C CH2 . TRP A 1 177 ? 28.006 -80.489 42.118 1.00 115.57 ? 188 TRP A CH2 1 ATOM 984 N N . GLY A 1 178 ? 32.506 -76.768 43.746 1.00 96.34 ? 189 GLY A N 1 ATOM 985 C CA . GLY A 1 178 ? 31.734 -75.851 44.561 1.00 90.05 ? 189 GLY A CA 1 ATOM 986 C C . GLY A 1 178 ? 30.824 -74.969 43.730 1.00 79.81 ? 189 GLY A C 1 ATOM 987 O O . GLY A 1 178 ? 31.046 -74.771 42.534 1.00 76.62 ? 189 GLY A O 1 ATOM 988 N N . ILE A 1 179 ? 29.783 -74.447 44.366 1.00 68.34 ? 190 ILE A N 1 ATOM 989 C CA . ILE A 1 179 ? 28.867 -73.532 43.705 1.00 73.91 ? 190 ILE A CA 1 ATOM 990 C C . ILE A 1 179 ? 28.260 -72.558 44.709 1.00 78.76 ? 190 ILE A C 1 ATOM 991 O O . ILE A 1 179 ? 27.703 -72.968 45.728 1.00 74.96 ? 190 ILE A O 1 ATOM 992 C CB . ILE A 1 179 ? 27.766 -74.271 42.891 1.00 69.86 ? 190 ILE A CB 1 ATOM 993 C CG1 . ILE A 1 179 ? 26.543 -73.374 42.698 1.00 77.51 ? 190 ILE A CG1 1 ATOM 994 C CG2 . ILE A 1 179 ? 27.352 -75.552 43.566 1.00 67.50 ? 190 ILE A CG2 1 ATOM 995 C CD1 . ILE A 1 179 ? 25.399 -74.062 41.995 1.00 83.65 ? 190 ILE A CD1 1 ATOM 996 N N . GLN A 1 180 ? 28.402 -71.267 44.418 1.00 76.87 ? 191 GLN A N 1 ATOM 997 C CA . GLN A 1 180 ? 27.883 -70.209 45.274 1.00 83.61 ? 191 GLN A CA 1 ATOM 998 C C . GLN A 1 180 ? 26.704 -69.517 44.601 1.00 87.93 ? 191 GLN A C 1 ATOM 999 O O . GLN A 1 180 ? 26.552 -69.581 43.382 1.00 84.42 ? 191 GLN A O 1 ATOM 1000 C CB . GLN A 1 180 ? 28.979 -69.192 45.597 1.00 86.34 ? 191 GLN A CB 1 ATOM 1001 C CG . GLN A 1 180 ? 30.134 -69.760 46.405 1.00 83.21 ? 191 GLN A CG 1 ATOM 1002 C CD . GLN A 1 180 ? 31.241 -68.745 46.644 1.00 87.74 ? 191 GLN A CD 1 ATOM 1003 O OE1 . GLN A 1 180 ? 31.271 -67.679 46.025 1.00 88.96 ? 191 GLN A OE1 1 ATOM 1004 N NE2 . GLN A 1 180 ? 32.158 -69.074 47.548 1.00 76.44 ? 191 GLN A NE2 1 ATOM 1005 N N . SER A 1 181 ? 25.875 -68.850 45.397 1.00 89.19 ? 192 SER A N 1 ATOM 1006 C CA . SER A 1 181 ? 24.645 -68.266 44.881 1.00 83.38 ? 192 SER A CA 1 ATOM 1007 C C . SER A 1 181 ? 24.157 -67.065 45.685 1.00 82.70 ? 192 SER A C 1 ATOM 1008 O O . SER A 1 181 ? 23.449 -67.220 46.676 1.00 89.96 ? 192 SER A O 1 ATOM 1009 C CB . SER A 1 181 ? 23.545 -69.329 44.827 1.00 80.45 ? 192 SER A CB 1 ATOM 1010 O OG . SER A 1 181 ? 22.263 -68.732 44.900 1.00 85.03 ? 192 SER A OG 1 ATOM 1011 N N . LYS A 1 182 ? 24.525 -65.868 45.245 1.00 80.29 ? 193 LYS A N 1 ATOM 1012 C CA . LYS A 1 182 ? 24.025 -64.648 45.864 1.00 70.15 ? 193 LYS A CA 1 ATOM 1013 C C . LYS A 1 182 ? 22.813 -64.109 45.112 1.00 68.01 ? 193 LYS A C 1 ATOM 1014 O O . LYS A 1 182 ? 22.850 -63.939 43.895 1.00 69.57 ? 193 LYS A O 1 ATOM 1015 C CB . LYS A 1 182 ? 25.114 -63.576 45.927 1.00 59.79 ? 193 LYS A CB 1 ATOM 1016 C CG . LYS A 1 182 ? 24.600 -62.228 46.408 1.00 65.67 ? 193 LYS A CG 1 ATOM 1017 C CD . LYS A 1 182 ? 25.681 -61.159 46.385 1.00 71.79 ? 193 LYS A CD 1 ATOM 1018 C CE . LYS A 1 182 ? 26.816 -61.487 47.342 1.00 65.95 ? 193 LYS A CE 1 ATOM 1019 N NZ . LYS A 1 182 ? 27.801 -60.368 47.392 1.00 60.45 ? 193 LYS A NZ 1 ATOM 1020 N N . THR A 1 183 ? 21.738 -63.848 45.844 1.00 65.73 ? 194 THR A N 1 ATOM 1021 C CA . THR A 1 183 ? 20.561 -63.210 45.271 1.00 71.17 ? 194 THR A CA 1 ATOM 1022 C C . THR A 1 183 ? 20.057 -62.128 46.224 1.00 71.37 ? 194 THR A C 1 ATOM 1023 O O . THR A 1 183 ? 19.772 -62.405 47.385 1.00 77.71 ? 194 THR A O 1 ATOM 1024 C CB . THR A 1 183 ? 19.456 -64.238 44.938 1.00 70.02 ? 194 THR A CB 1 ATOM 1025 O OG1 . THR A 1 183 ? 18.166 -63.626 45.065 1.00 59.56 ? 194 THR A OG1 1 ATOM 1026 C CG2 . THR A 1 183 ? 19.545 -65.441 45.865 1.00 61.34 ? 194 THR A CG2 1 ATOM 1027 N N . ALA A 1 184 ? 19.965 -60.894 45.735 1.00 72.43 ? 195 ALA A N 1 ATOM 1028 C CA . ALA A 1 184 ? 19.720 -59.753 46.618 1.00 72.93 ? 195 ALA A CA 1 ATOM 1029 C C . ALA A 1 184 ? 18.679 -58.763 46.110 1.00 71.79 ? 195 ALA A C 1 ATOM 1030 O O . ALA A 1 184 ? 18.603 -58.479 44.915 1.00 77.89 ? 195 ALA A O 1 ATOM 1031 C CB . ALA A 1 184 ? 21.022 -59.028 46.907 1.00 57.00 ? 195 ALA A CB 1 ATOM 1032 N N . TYR A 1 185 ? 17.885 -58.232 47.034 1.00 63.77 ? 196 TYR A N 1 ATOM 1033 C CA . TYR A 1 185 ? 16.941 -57.170 46.706 1.00 71.86 ? 196 TYR A CA 1 ATOM 1034 C C . TYR A 1 185 ? 17.249 -55.889 47.479 1.00 68.62 ? 196 TYR A C 1 ATOM 1035 O O . TYR A 1 185 ? 17.336 -55.897 48.705 1.00 69.91 ? 196 TYR A O 1 ATOM 1036 C CB . TYR A 1 185 ? 15.493 -57.602 46.963 1.00 59.33 ? 196 TYR A CB 1 ATOM 1037 C CG . TYR A 1 185 ? 14.494 -56.500 46.687 1.00 72.65 ? 196 TYR A CG 1 ATOM 1038 C CD1 . TYR A 1 185 ? 13.911 -55.786 47.725 1.00 79.97 ? 196 TYR A CD1 1 ATOM 1039 C CD2 . TYR A 1 185 ? 14.154 -56.156 45.384 1.00 68.13 ? 196 TYR A CD2 1 ATOM 1040 C CE1 . TYR A 1 185 ? 13.007 -54.769 47.473 1.00 86.68 ? 196 TYR A CE1 1 ATOM 1041 C CE2 . TYR A 1 185 ? 13.251 -55.144 45.122 1.00 64.39 ? 196 TYR A CE2 1 ATOM 1042 C CZ . TYR A 1 185 ? 12.681 -54.453 46.169 1.00 80.54 ? 196 TYR A CZ 1 ATOM 1043 O OH . TYR A 1 185 ? 11.781 -53.446 45.914 1.00 83.99 ? 196 TYR A OH 1 ATOM 1044 N N . SER A 1 186 ? 17.411 -54.789 46.751 1.00 71.85 ? 197 SER A N 1 ATOM 1045 C CA . SER A 1 186 ? 17.632 -53.486 47.366 1.00 76.31 ? 197 SER A CA 1 ATOM 1046 C C . SER A 1 186 ? 16.428 -52.578 47.132 1.00 78.23 ? 197 SER A C 1 ATOM 1047 O O . SER A 1 186 ? 16.151 -52.175 46.003 1.00 88.22 ? 197 SER A O 1 ATOM 1048 C CB . SER A 1 186 ? 18.913 -52.843 46.827 1.00 69.93 ? 197 SER A CB 1 ATOM 1049 O OG . SER A 1 186 ? 18.984 -52.941 45.415 1.00 74.03 ? 197 SER A OG 1 ATOM 1050 N N . GLY A 1 187 ? 15.715 -52.263 48.208 1.00 58.70 ? 198 GLY A N 1 ATOM 1051 C CA . GLY A 1 187 ? 14.482 -51.503 48.108 1.00 66.77 ? 198 GLY A CA 1 ATOM 1052 C C . GLY A 1 187 ? 14.615 -50.064 47.633 1.00 80.89 ? 198 GLY A C 1 ATOM 1053 O O . GLY A 1 187 ? 13.653 -49.496 47.108 1.00 67.50 ? 198 GLY A O 1 ATOM 1054 N N . LYS A 1 188 ? 15.794 -49.469 47.811 1.00 56.96 ? 199 LYS A N 1 ATOM 1055 C CA . LYS A 1 188 ? 15.966 -48.045 47.525 1.00 64.21 ? 199 LYS A CA 1 ATOM 1056 C C . LYS A 1 188 ? 15.864 -47.746 46.039 1.00 60.82 ? 199 LYS A C 1 ATOM 1057 O O . LYS A 1 188 ? 15.507 -46.639 45.643 1.00 56.81 ? 199 LYS A O 1 ATOM 1058 C CB . LYS A 1 188 ? 17.291 -47.518 48.080 1.00 62.95 ? 199 LYS A CB 1 ATOM 1059 C CG . LYS A 1 188 ? 18.531 -48.161 47.491 1.00 65.07 ? 199 LYS A CG 1 ATOM 1060 C CD . LYS A 1 188 ? 19.787 -47.485 48.024 1.00 73.01 ? 199 LYS A CD 1 ATOM 1061 C CE . LYS A 1 188 ? 21.042 -48.253 47.652 1.00 69.20 ? 199 LYS A CE 1 ATOM 1062 N NZ . LYS A 1 188 ? 22.272 -47.477 47.966 1.00 68.73 ? 199 LYS A NZ 1 ATOM 1063 N N . ASN A 1 189 ? 16.176 -48.743 45.221 1.00 66.94 ? 200 ASN A N 1 ATOM 1064 C CA . ASN A 1 189 ? 16.092 -48.592 43.780 1.00 60.96 ? 200 ASN A CA 1 ATOM 1065 C C . ASN A 1 189 ? 15.402 -49.785 43.135 1.00 59.11 ? 200 ASN A C 1 ATOM 1066 O O . ASN A 1 189 ? 15.612 -50.058 41.954 1.00 56.05 ? 200 ASN A O 1 ATOM 1067 C CB . ASN A 1 189 ? 17.483 -48.392 43.181 1.00 49.76 ? 200 ASN A CB 1 ATOM 1068 C CG . ASN A 1 189 ? 18.386 -49.590 43.388 1.00 63.49 ? 200 ASN A CG 1 ATOM 1069 O OD1 . ASN A 1 189 ? 18.101 -50.466 44.201 1.00 60.34 ? 200 ASN A OD1 1 ATOM 1070 N ND2 . ASN A 1 189 ? 19.490 -49.627 42.655 1.00 60.09 ? 200 ASN A ND2 1 ATOM 1071 N N . ARG A 1 190 ? 14.585 -50.483 43.925 1.00 57.83 ? 201 ARG A N 1 ATOM 1072 C CA . ARG A 1 190 ? 13.859 -51.669 43.468 1.00 62.14 ? 201 ARG A CA 1 ATOM 1073 C C . ARG A 1 190 ? 14.778 -52.606 42.700 1.00 64.70 ? 201 ARG A C 1 ATOM 1074 O O . ARG A 1 190 ? 14.408 -53.143 41.657 1.00 65.08 ? 201 ARG A O 1 ATOM 1075 C CB . ARG A 1 190 ? 12.656 -51.273 42.606 1.00 69.54 ? 201 ARG A CB 1 ATOM 1076 C CG . ARG A 1 190 ? 11.381 -51.026 43.404 1.00 86.23 ? 201 ARG A CG 1 ATOM 1077 C CD . ARG A 1 190 ? 10.713 -49.711 43.027 1.00 94.20 ? 201 ARG A CD 1 ATOM 1078 N NE . ARG A 1 190 ? 9.465 -49.501 43.759 1.00 113.25 ? 201 ARG A NE 1 ATOM 1079 C CZ . ARG A 1 190 ? 9.384 -48.957 44.971 1.00 124.52 ? 201 ARG A CZ 1 ATOM 1080 N NH1 . ARG A 1 190 ? 8.201 -48.807 45.554 1.00 127.71 ? 201 ARG A NH1 1 ATOM 1081 N NH2 . ARG A 1 190 ? 10.481 -48.560 45.604 1.00 122.48 ? 201 ARG A NH2 1 ATOM 1082 N N . GLY A 1 191 ? 15.984 -52.786 43.226 1.00 67.76 ? 202 GLY A N 1 ATOM 1083 C CA . GLY A 1 191 ? 17.033 -53.477 42.505 1.00 77.79 ? 202 GLY A CA 1 ATOM 1084 C C . GLY A 1 191 ? 17.224 -54.928 42.887 1.00 74.87 ? 202 GLY A C 1 ATOM 1085 O O . GLY A 1 191 ? 17.668 -55.243 43.992 1.00 84.30 ? 202 GLY A O 1 ATOM 1086 N N . LEU A 1 192 ? 16.893 -55.813 41.956 1.00 59.57 ? 203 LEU A N 1 ATOM 1087 C CA . LEU A 1 192 ? 17.135 -57.233 42.130 1.00 61.65 ? 203 LEU A CA 1 ATOM 1088 C C . LEU A 1 192 ? 18.469 -57.612 41.504 1.00 51.11 ? 203 LEU A C 1 ATOM 1089 O O . LEU A 1 192 ? 18.767 -57.227 40.381 1.00 61.33 ? 203 LEU A O 1 ATOM 1090 C CB . LEU A 1 192 ? 16.014 -58.042 41.485 1.00 64.83 ? 203 LEU A CB 1 ATOM 1091 C CG . LEU A 1 192 ? 16.148 -59.557 41.597 1.00 64.34 ? 203 LEU A CG 1 ATOM 1092 C CD1 . LEU A 1 192 ? 16.046 -59.981 43.048 1.00 66.14 ? 203 LEU A CD1 1 ATOM 1093 C CD2 . LEU A 1 192 ? 15.091 -60.249 40.750 1.00 73.92 ? 203 LEU A CD2 1 ATOM 1094 N N . THR A 1 193 ? 19.279 -58.356 42.240 1.00 54.04 ? 204 THR A N 1 ATOM 1095 C CA . THR A 1 193 ? 20.536 -58.851 41.706 1.00 51.76 ? 204 THR A CA 1 ATOM 1096 C C . THR A 1 193 ? 20.672 -60.342 41.984 1.00 64.72 ? 204 THR A C 1 ATOM 1097 O O . THR A 1 193 ? 20.423 -60.807 43.096 1.00 70.46 ? 204 THR A O 1 ATOM 1098 C CB . THR A 1 193 ? 21.740 -58.084 42.271 1.00 59.93 ? 204 THR A CB 1 ATOM 1099 O OG1 . THR A 1 193 ? 22.760 -59.011 42.659 1.00 57.96 ? 204 THR A OG1 1 ATOM 1100 C CG2 . THR A 1 193 ? 21.321 -57.252 43.474 1.00 74.20 ? 204 THR A CG2 1 ATOM 1101 N N . GLN A 1 194 ? 21.051 -61.084 40.951 1.00 65.60 ? 205 GLN A N 1 ATOM 1102 C CA . GLN A 1 194 ? 21.139 -62.533 41.023 1.00 56.63 ? 205 GLN A CA 1 ATOM 1103 C C . GLN A 1 194 ? 22.475 -62.992 40.457 1.00 60.26 ? 205 GLN A C 1 ATOM 1104 O O . GLN A 1 194 ? 22.860 -62.605 39.354 1.00 61.40 ? 205 GLN A O 1 ATOM 1105 C CB . GLN A 1 194 ? 19.984 -63.165 40.246 1.00 53.06 ? 205 GLN A CB 1 ATOM 1106 C CG . GLN A 1 194 ? 20.120 -64.672 40.019 1.00 121.21 ? 205 GLN A CG 1 ATOM 1107 C CD . GLN A 1 194 ? 19.877 -65.497 41.277 1.00 109.17 ? 205 GLN A CD 1 ATOM 1108 O OE1 . GLN A 1 194 ? 20.703 -65.525 42.190 1.00 106.83 ? 205 GLN A OE1 1 ATOM 1109 N NE2 . GLN A 1 194 ? 18.739 -66.179 41.323 1.00 105.84 ? 205 GLN A NE2 1 ATOM 1110 N N . SER A 1 195 ? 23.186 -63.816 41.217 1.00 67.45 ? 206 SER A N 1 ATOM 1111 C CA . SER A 1 195 ? 24.505 -64.276 40.801 1.00 68.55 ? 206 SER A CA 1 ATOM 1112 C C . SER A 1 195 ? 24.728 -65.750 41.127 1.00 70.48 ? 206 SER A C 1 ATOM 1113 O O . SER A 1 195 ? 24.352 -66.226 42.197 1.00 73.74 ? 206 SER A O 1 ATOM 1114 C CB . SER A 1 195 ? 25.593 -63.424 41.456 1.00 61.52 ? 206 SER A CB 1 ATOM 1115 O OG . SER A 1 195 ? 26.881 -63.844 41.048 1.00 77.54 ? 206 SER A OG 1 ATOM 1116 N N . ILE A 1 196 ? 25.337 -66.469 40.190 1.00 63.51 ? 207 ILE A N 1 ATOM 1117 C CA . ILE A 1 196 ? 25.699 -67.863 40.406 1.00 72.61 ? 207 ILE A CA 1 ATOM 1118 C C . ILE A 1 196 ? 27.154 -68.081 39.991 1.00 72.30 ? 207 ILE A C 1 ATOM 1119 O O . ILE A 1 196 ? 27.597 -67.555 38.972 1.00 72.00 ? 207 ILE A O 1 ATOM 1120 C CB . ILE A 1 196 ? 24.764 -68.821 39.634 1.00 79.51 ? 207 ILE A CB 1 ATOM 1121 C CG1 . ILE A 1 196 ? 23.324 -68.662 40.119 1.00 90.97 ? 207 ILE A CG1 1 ATOM 1122 C CG2 . ILE A 1 196 ? 25.196 -70.265 39.812 1.00 77.94 ? 207 ILE A CG2 1 ATOM 1123 C CD1 . ILE A 1 196 ? 22.357 -69.635 39.483 1.00 97.76 ? 207 ILE A CD1 1 ATOM 1124 N N . ALA A 1 197 ? 27.897 -68.839 40.794 1.00 74.99 ? 208 ALA A N 1 ATOM 1125 C CA . ALA A 1 197 ? 29.306 -69.098 40.519 1.00 70.84 ? 208 ALA A CA 1 ATOM 1126 C C . ALA A 1 197 ? 29.627 -70.590 40.575 1.00 71.76 ? 208 ALA A C 1 ATOM 1127 O O . ALA A 1 197 ? 29.497 -71.222 41.620 1.00 72.67 ? 208 ALA A O 1 ATOM 1128 C CB . ALA A 1 197 ? 30.187 -68.328 41.498 1.00 70.80 ? 208 ALA A CB 1 ATOM 1129 N N . LEU A 1 198 ? 30.050 -71.143 39.443 1.00 74.64 ? 209 LEU A N 1 ATOM 1130 C CA . LEU A 1 198 ? 30.433 -72.548 39.366 1.00 78.82 ? 209 LEU A CA 1 ATOM 1131 C C . LEU A 1 198 ? 31.945 -72.685 39.308 1.00 76.88 ? 209 LEU A C 1 ATOM 1132 O O . LEU A 1 198 ? 32.614 -71.957 38.574 1.00 80.23 ? 209 LEU A O 1 ATOM 1133 C CB . LEU A 1 198 ? 29.827 -73.203 38.123 1.00 86.71 ? 209 LEU A CB 1 ATOM 1134 C CG . LEU A 1 198 ? 28.467 -73.895 38.212 1.00 86.35 ? 209 LEU A CG 1 ATOM 1135 C CD1 . LEU A 1 198 ? 27.398 -72.960 38.749 1.00 91.93 ? 209 LEU A CD1 1 ATOM 1136 C CD2 . LEU A 1 198 ? 28.077 -74.419 36.840 1.00 85.01 ? 209 LEU A CD2 1 ATOM 1137 N N . ALA A 1 199 ? 32.483 -73.626 40.076 1.00 69.79 ? 210 ALA A N 1 ATOM 1138 C CA . ALA A 1 199 ? 33.916 -73.896 40.049 1.00 82.94 ? 210 ALA A CA 1 ATOM 1139 C C . ALA A 1 199 ? 34.214 -75.362 40.335 1.00 87.93 ? 210 ALA A C 1 ATOM 1140 O O . ALA A 1 199 ? 33.683 -75.942 41.281 1.00 89.92 ? 210 ALA A O 1 ATOM 1141 C CB . ALA A 1 199 ? 34.646 -73.004 41.034 1.00 93.45 ? 210 ALA A CB 1 ATOM 1142 N N . GLY A 1 200 ? 35.069 -75.954 39.510 1.00 94.96 ? 211 GLY A N 1 ATOM 1143 C CA . GLY A 1 200 ? 35.423 -77.350 39.659 1.00 66.60 ? 211 GLY A CA 1 ATOM 1144 C C . GLY A 1 200 ? 36.856 -77.623 39.257 1.00 86.69 ? 211 GLY A C 1 ATOM 1145 O O . GLY A 1 200 ? 37.437 -76.900 38.447 1.00 89.61 ? 211 GLY A O 1 ATOM 1146 N N . ARG A 1 201 ? 37.425 -78.681 39.825 1.00 86.91 ? 212 ARG A N 1 ATOM 1147 C CA . ARG A 1 201 ? 38.803 -79.057 39.542 1.00 92.62 ? 212 ARG A CA 1 ATOM 1148 C C . ARG A 1 201 ? 38.969 -80.569 39.450 1.00 90.41 ? 212 ARG A C 1 ATOM 1149 O O . ARG A 1 201 ? 38.654 -81.294 40.392 1.00 106.03 ? 212 ARG A O 1 ATOM 1150 C CB . ARG A 1 201 ? 39.733 -78.501 40.621 1.00 99.00 ? 212 ARG A CB 1 ATOM 1151 C CG . ARG A 1 201 ? 41.195 -78.871 40.435 1.00 99.15 ? 212 ARG A CG 1 ATOM 1152 C CD . ARG A 1 201 ? 42.044 -78.238 41.517 1.00 99.78 ? 212 ARG A CD 1 ATOM 1153 N NE . ARG A 1 201 ? 41.837 -76.795 41.577 1.00 98.07 ? 212 ARG A NE 1 ATOM 1154 C CZ . ARG A 1 201 ? 42.318 -76.009 42.534 1.00 94.98 ? 212 ARG A CZ 1 ATOM 1155 N NH1 . ARG A 1 201 ? 43.037 -76.525 43.523 1.00 103.15 ? 212 ARG A NH1 1 ATOM 1156 N NH2 . ARG A 1 201 ? 42.078 -74.706 42.502 1.00 80.20 ? 212 ARG A NH2 1 ATOM 1157 N N . ILE A 1 202 ? 39.454 -81.040 38.307 1.00 78.04 ? 213 ILE A N 1 ATOM 1158 C CA . ILE A 1 202 ? 39.846 -82.437 38.164 1.00 96.95 ? 213 ILE A CA 1 ATOM 1159 C C . ILE A 1 202 ? 41.238 -82.528 37.544 1.00 107.95 ? 213 ILE A C 1 ATOM 1160 O O . ILE A 1 202 ? 41.399 -82.800 36.355 1.00 112.26 ? 213 ILE A O 1 ATOM 1161 C CB . ILE A 1 202 ? 38.807 -83.277 37.378 1.00 97.35 ? 213 ILE A CB 1 ATOM 1162 C CG1 . ILE A 1 202 ? 38.371 -82.568 36.097 1.00 90.57 ? 213 ILE A CG1 1 ATOM 1163 C CG2 . ILE A 1 202 ? 37.585 -83.549 38.242 1.00 104.64 ? 213 ILE A CG2 1 ATOM 1164 C CD1 . ILE A 1 202 ? 37.420 -83.387 35.252 1.00 83.40 ? 213 ILE A CD1 1 ATOM 1165 N N . GLY A 1 203 ? 42.243 -82.284 38.377 1.00 111.84 ? 214 GLY A N 1 ATOM 1166 C CA . GLY A 1 203 ? 43.625 -82.248 37.940 1.00 115.38 ? 214 GLY A CA 1 ATOM 1167 C C . GLY A 1 203 ? 44.467 -81.548 38.987 1.00 121.06 ? 214 GLY A C 1 ATOM 1168 O O . GLY A 1 203 ? 44.344 -81.841 40.177 1.00 122.42 ? 214 GLY A O 1 ATOM 1169 N N . GLY A 1 204 ? 45.319 -80.621 38.557 1.00 123.62 ? 215 GLY A N 1 ATOM 1170 C CA . GLY A 1 204 ? 45.481 -80.302 37.150 1.00 118.59 ? 215 GLY A CA 1 ATOM 1171 C C . GLY A 1 204 ? 44.571 -79.196 36.640 1.00 102.92 ? 215 GLY A C 1 ATOM 1172 O O . GLY A 1 204 ? 44.737 -78.017 36.961 1.00 80.99 ? 215 GLY A O 1 ATOM 1173 N N . ALA A 1 205 ? 43.599 -79.591 35.830 1.00 93.34 ? 216 ALA A N 1 ATOM 1174 C CA . ALA A 1 205 ? 42.696 -78.649 35.197 1.00 85.06 ? 216 ALA A CA 1 ATOM 1175 C C . ALA A 1 205 ? 41.699 -78.052 36.193 1.00 85.26 ? 216 ALA A C 1 ATOM 1176 O O . ALA A 1 205 ? 41.116 -78.770 37.004 1.00 90.85 ? 216 ALA A O 1 ATOM 1177 C CB . ALA A 1 205 ? 41.967 -79.329 34.044 1.00 67.97 ? 216 ALA A CB 1 ATOM 1178 N N . GLU A 1 206 ? 41.516 -76.734 36.127 1.00 78.67 ? 217 GLU A N 1 ATOM 1179 C CA . GLU A 1 206 ? 40.513 -76.046 36.939 1.00 74.21 ? 217 GLU A CA 1 ATOM 1180 C C . GLU A 1 206 ? 39.682 -75.101 36.073 1.00 76.50 ? 217 GLU A C 1 ATOM 1181 O O . GLU A 1 206 ? 40.120 -74.684 35.001 1.00 78.45 ? 217 GLU A O 1 ATOM 1182 C CB . GLU A 1 206 ? 41.175 -75.268 38.083 1.00 78.03 ? 217 GLU A CB 1 ATOM 1183 C CG . GLU A 1 206 ? 41.909 -74.002 37.656 1.00 81.69 ? 217 GLU A CG 1 ATOM 1184 C CD . GLU A 1 206 ? 42.552 -73.266 38.826 1.00 86.23 ? 217 GLU A CD 1 ATOM 1185 O OE1 . GLU A 1 206 ? 43.245 -73.915 39.637 1.00 84.97 ? 217 GLU A OE1 1 ATOM 1186 O OE2 . GLU A 1 206 ? 42.363 -72.036 38.936 1.00 85.47 ? 217 GLU A OE2 1 ATOM 1187 N N . ALA A 1 207 ? 38.482 -74.765 36.536 1.00 77.39 ? 218 ALA A N 1 ATOM 1188 C CA . ALA A 1 207 ? 37.637 -73.820 35.809 1.00 76.25 ? 218 ALA A CA 1 ATOM 1189 C C . ALA A 1 207 ? 36.729 -73.014 36.734 1.00 83.04 ? 218 ALA A C 1 ATOM 1190 O O . ALA A 1 207 ? 36.302 -73.497 37.786 1.00 84.25 ? 218 ALA A O 1 ATOM 1191 C CB . ALA A 1 207 ? 36.814 -74.538 34.745 1.00 72.15 ? 218 ALA A CB 1 ATOM 1192 N N . LEU A 1 208 ? 36.448 -71.778 36.324 1.00 72.34 ? 219 LEU A N 1 ATOM 1193 C CA . LEU A 1 208 ? 35.554 -70.888 37.053 1.00 60.67 ? 219 LEU A CA 1 ATOM 1194 C C . LEU A 1 208 ? 34.567 -70.302 36.054 1.00 63.12 ? 219 LEU A C 1 ATOM 1195 O O . LEU A 1 208 ? 34.957 -69.877 34.969 1.00 65.80 ? 219 LEU A O 1 ATOM 1196 C CB . LEU A 1 208 ? 36.348 -69.761 37.717 1.00 60.69 ? 219 LEU A CB 1 ATOM 1197 C CG . LEU A 1 208 ? 35.824 -69.055 38.977 1.00 67.52 ? 219 LEU A CG 1 ATOM 1198 C CD1 . LEU A 1 208 ? 36.121 -67.564 38.918 1.00 54.14 ? 219 LEU A CD1 1 ATOM 1199 C CD2 . LEU A 1 208 ? 34.343 -69.293 39.241 1.00 61.45 ? 219 LEU A CD2 1 ATOM 1200 N N . LEU A 1 209 ? 33.290 -70.294 36.419 1.00 68.24 ? 220 LEU A N 1 ATOM 1201 C CA . LEU A 1 209 ? 32.248 -69.726 35.575 1.00 58.11 ? 220 LEU A CA 1 ATOM 1202 C C . LEU A 1 209 ? 31.295 -68.935 36.457 1.00 65.20 ? 220 LEU A C 1 ATOM 1203 O O . LEU A 1 209 ? 30.695 -69.488 37.379 1.00 77.52 ? 220 LEU A O 1 ATOM 1204 C CB . LEU A 1 209 ? 31.485 -70.840 34.861 1.00 59.02 ? 220 LEU A CB 1 ATOM 1205 C CG . LEU A 1 209 ? 30.939 -70.592 33.450 1.00 71.75 ? 220 LEU A CG 1 ATOM 1206 C CD1 . LEU A 1 209 ? 29.468 -71.007 33.356 1.00 53.15 ? 220 LEU A CD1 1 ATOM 1207 C CD2 . LEU A 1 209 ? 31.147 -69.151 32.988 1.00 50.78 ? 220 LEU A CD2 1 ATOM 1208 N N . ILE A 1 210 ? 31.168 -67.639 36.194 1.00 63.51 ? 221 ILE A N 1 ATOM 1209 C CA . ILE A 1 210 ? 30.270 -66.799 36.978 1.00 63.94 ? 221 ILE A CA 1 ATOM 1210 C C . ILE A 1 210 ? 29.314 -66.034 36.079 1.00 62.45 ? 221 ILE A C 1 ATOM 1211 O O . ILE A 1 210 ? 29.724 -65.435 35.088 1.00 63.36 ? 221 ILE A O 1 ATOM 1212 C CB . ILE A 1 210 ? 31.033 -65.789 37.866 1.00 62.60 ? 221 ILE A CB 1 ATOM 1213 C CG1 . ILE A 1 210 ? 32.145 -66.484 38.648 1.00 72.43 ? 221 ILE A CG1 1 ATOM 1214 C CG2 . ILE A 1 210 ? 30.078 -65.099 38.828 1.00 50.99 ? 221 ILE A CG2 1 ATOM 1215 C CD1 . ILE A 1 210 ? 32.911 -65.562 39.566 1.00 71.37 ? 221 ILE A CD1 1 ATOM 1216 N N . HIS A 1 211 ? 28.034 -66.062 36.427 1.00 68.78 ? 222 HIS A N 1 ATOM 1217 C CA . HIS A 1 211 ? 27.032 -65.278 35.718 1.00 64.22 ? 222 HIS A CA 1 ATOM 1218 C C . HIS A 1 211 ? 26.297 -64.393 36.710 1.00 58.38 ? 222 HIS A C 1 ATOM 1219 O O . HIS A 1 211 ? 25.859 -64.858 37.759 1.00 63.58 ? 222 HIS A O 1 ATOM 1220 C CB . HIS A 1 211 ? 26.046 -66.189 34.987 1.00 54.19 ? 222 HIS A CB 1 ATOM 1221 C CG . HIS A 1 211 ? 24.965 -65.453 34.263 1.00 59.95 ? 222 HIS A CG 1 ATOM 1222 N ND1 . HIS A 1 211 ? 25.227 -64.537 33.267 1.00 68.60 ? 222 HIS A ND1 1 ATOM 1223 C CD2 . HIS A 1 211 ? 23.618 -65.499 34.386 1.00 72.36 ? 222 HIS A CD2 1 ATOM 1224 C CE1 . HIS A 1 211 ? 24.088 -64.050 32.809 1.00 65.65 ? 222 HIS A CE1 1 ATOM 1225 N NE2 . HIS A 1 211 ? 23.096 -64.617 33.470 1.00 68.50 ? 222 HIS A NE2 1 ATOM 1226 N N . THR A 1 212 ? 26.177 -63.112 36.385 1.00 59.09 ? 223 THR A N 1 ATOM 1227 C CA . THR A 1 212 ? 25.464 -62.182 37.250 1.00 66.47 ? 223 THR A CA 1 ATOM 1228 C C . THR A 1 212 ? 24.443 -61.397 36.442 1.00 60.81 ? 223 THR A C 1 ATOM 1229 O O . THR A 1 212 ? 24.751 -60.889 35.370 1.00 58.98 ? 223 THR A O 1 ATOM 1230 C CB . THR A 1 212 ? 26.420 -61.197 37.958 1.00 65.47 ? 223 THR A CB 1 ATOM 1231 O OG1 . THR A 1 212 ? 27.432 -61.926 38.664 1.00 70.26 ? 223 THR A OG1 1 ATOM 1232 C CG2 . THR A 1 212 ? 25.653 -60.332 38.944 1.00 62.24 ? 223 THR A CG2 1 ATOM 1233 N N . GLY A 1 213 ? 23.225 -61.313 36.961 1.00 55.70 ? 224 GLY A N 1 ATOM 1234 C CA . GLY A 1 213 ? 22.178 -60.538 36.329 1.00 46.54 ? 224 GLY A CA 1 ATOM 1235 C C . GLY A 1 213 ? 21.622 -59.517 37.298 1.00 61.04 ? 224 GLY A C 1 ATOM 1236 O O . GLY A 1 213 ? 21.258 -59.855 38.421 1.00 65.34 ? 224 GLY A O 1 ATOM 1237 N N . ARG A 1 214 ? 21.569 -58.260 36.874 1.00 53.20 ? 225 ARG A N 1 ATOM 1238 C CA . ARG A 1 214 ? 21.054 -57.200 37.729 1.00 51.48 ? 225 ARG A CA 1 ATOM 1239 C C . ARG A 1 214 ? 20.066 -56.319 36.982 1.00 58.14 ? 225 ARG A C 1 ATOM 1240 O O . ARG A 1 214 ? 20.332 -55.883 35.860 1.00 47.55 ? 225 ARG A O 1 ATOM 1241 C CB . ARG A 1 214 ? 22.196 -56.334 38.250 1.00 56.47 ? 225 ARG A CB 1 ATOM 1242 C CG . ARG A 1 214 ? 23.515 -57.065 38.400 1.00 69.28 ? 225 ARG A CG 1 ATOM 1243 C CD . ARG A 1 214 ? 24.608 -56.109 38.801 1.00 70.22 ? 225 ARG A CD 1 ATOM 1244 N NE . ARG A 1 214 ? 24.426 -55.653 40.169 1.00 67.22 ? 225 ARG A NE 1 ATOM 1245 C CZ . ARG A 1 214 ? 25.308 -55.857 41.137 1.00 71.86 ? 225 ARG A CZ 1 ATOM 1246 N NH1 . ARG A 1 214 ? 26.437 -56.499 40.874 1.00 46.91 ? 225 ARG A NH1 1 ATOM 1247 N NH2 . ARG A 1 214 ? 25.065 -55.411 42.362 1.00 77.36 ? 225 ARG A NH2 1 ATOM 1248 N N . ARG A 1 215 ? 18.920 -56.071 37.608 1.00 58.69 ? 226 ARG A N 1 ATOM 1249 C CA . ARG A 1 215 ? 17.980 -55.072 37.117 1.00 60.73 ? 226 ARG A CA 1 ATOM 1250 C C . ARG A 1 215 ? 17.597 -54.140 38.256 1.00 62.23 ? 226 ARG A C 1 ATOM 1251 O O . ARG A 1 215 ? 17.324 -54.580 39.370 1.00 76.22 ? 226 ARG A O 1 ATOM 1252 C CB . ARG A 1 215 ? 16.739 -55.719 36.487 1.00 68.16 ? 226 ARG A CB 1 ATOM 1253 C CG . ARG A 1 215 ? 15.873 -56.533 37.439 1.00 83.41 ? 226 ARG A CG 1 ATOM 1254 C CD . ARG A 1 215 ? 14.681 -57.161 36.720 1.00 101.73 ? 226 ARG A CD 1 ATOM 1255 N NE . ARG A 1 215 ? 15.087 -58.165 35.736 1.00 118.54 ? 226 ARG A NE 1 ATOM 1256 C CZ . ARG A 1 215 ? 15.142 -57.954 34.423 1.00 118.81 ? 226 ARG A CZ 1 ATOM 1257 N NH1 . ARG A 1 215 ? 15.526 -58.929 33.608 1.00 109.06 ? 226 ARG A NH1 1 ATOM 1258 N NH2 . ARG A 1 215 ? 14.811 -56.770 33.922 1.00 122.30 ? 226 ARG A NH2 1 ATOM 1259 N N . ALA A 1 216 ? 17.606 -52.845 37.987 1.00 58.64 ? 227 ALA A N 1 ATOM 1260 C CA . ALA A 1 216 ? 17.240 -51.879 39.009 1.00 65.51 ? 227 ALA A CA 1 ATOM 1261 C C . ALA A 1 216 ? 16.618 -50.646 38.381 1.00 69.13 ? 227 ALA A C 1 ATOM 1262 O O . ALA A 1 216 ? 16.534 -50.531 37.160 1.00 64.21 ? 227 ALA A O 1 ATOM 1263 C CB . ALA A 1 216 ? 18.450 -51.497 39.842 1.00 46.43 ? 227 ALA A CB 1 ATOM 1264 N N . GLY A 1 217 ? 16.176 -49.728 39.229 1.00 66.53 ? 228 GLY A N 1 ATOM 1265 C CA . GLY A 1 217 ? 15.614 -48.480 38.764 1.00 46.11 ? 228 GLY A CA 1 ATOM 1266 C C . GLY A 1 217 ? 16.367 -47.306 39.347 1.00 57.29 ? 228 GLY A C 1 ATOM 1267 O O . GLY A 1 217 ? 17.475 -47.452 39.862 1.00 65.59 ? 228 GLY A O 1 ATOM 1268 N N . GLU A 1 218 ? 15.758 -46.134 39.239 1.00 55.44 ? 229 GLU A N 1 ATOM 1269 C CA . GLU A 1 218 ? 16.244 -44.926 39.883 1.00 58.79 ? 229 GLU A CA 1 ATOM 1270 C C . GLU A 1 218 ? 16.375 -45.137 41.389 1.00 70.66 ? 229 GLU A C 1 ATOM 1271 O O . GLU A 1 218 ? 15.535 -45.794 42.008 1.00 63.78 ? 229 GLU A O 1 ATOM 1272 C CB . GLU A 1 218 ? 15.240 -43.813 39.624 1.00 51.12 ? 229 GLU A CB 1 ATOM 1273 C CG . GLU A 1 218 ? 14.020 -44.315 38.872 1.00 57.24 ? 229 GLU A CG 1 ATOM 1274 C CD . GLU A 1 218 ? 12.773 -43.544 39.201 1.00 77.72 ? 229 GLU A CD 1 ATOM 1275 O OE1 . GLU A 1 218 ? 12.847 -42.640 40.057 1.00 70.34 ? 229 GLU A OE1 1 ATOM 1276 O OE2 . GLU A 1 218 ? 11.716 -43.843 38.605 1.00 94.46 ? 229 GLU A OE2 1 ATOM 1277 N N . ILE A 1 219 ? 17.434 -44.589 41.976 1.00 71.84 ? 230 ILE A N 1 ATOM 1278 C CA . ILE A 1 219 ? 17.549 -44.547 43.426 1.00 62.55 ? 230 ILE A CA 1 ATOM 1279 C C . ILE A 1 219 ? 16.550 -43.523 43.936 1.00 68.80 ? 230 ILE A C 1 ATOM 1280 O O . ILE A 1 219 ? 16.663 -42.335 43.634 1.00 71.35 ? 230 ILE A O 1 ATOM 1281 C CB . ILE A 1 219 ? 18.969 -44.152 43.876 1.00 61.89 ? 230 ILE A CB 1 ATOM 1282 C CG1 . ILE A 1 219 ? 19.980 -45.213 43.431 1.00 59.91 ? 230 ILE A CG1 1 ATOM 1283 C CG2 . ILE A 1 219 ? 19.019 -43.951 45.385 1.00 53.91 ? 230 ILE A CG2 1 ATOM 1284 C CD1 . ILE A 1 219 ? 21.400 -44.951 43.893 1.00 53.16 ? 230 ILE A CD1 1 ATOM 1285 N N . ARG A 1 220 ? 15.559 -43.985 44.691 1.00 70.02 ? 231 ARG A N 1 ATOM 1286 C CA . ARG A 1 220 ? 14.498 -43.104 45.165 1.00 77.93 ? 231 ARG A CA 1 ATOM 1287 C C . ARG A 1 220 ? 14.985 -42.183 46.279 1.00 81.91 ? 231 ARG A C 1 ATOM 1288 O O . ARG A 1 220 ? 16.036 -42.416 46.876 1.00 81.73 ? 231 ARG A O 1 ATOM 1289 C CB . ARG A 1 220 ? 13.274 -43.914 45.609 1.00 89.27 ? 231 ARG A CB 1 ATOM 1290 C CG . ARG A 1 220 ? 12.698 -44.778 44.495 1.00 114.29 ? 231 ARG A CG 1 ATOM 1291 C CD . ARG A 1 220 ? 11.243 -45.157 44.735 1.00 137.49 ? 231 ARG A CD 1 ATOM 1292 N NE . ARG A 1 220 ? 10.637 -45.721 43.529 1.00 150.95 ? 231 ARG A NE 1 ATOM 1293 C CZ . ARG A 1 220 ? 9.357 -46.064 43.418 1.00 153.58 ? 231 ARG A CZ 1 ATOM 1294 N NH1 . ARG A 1 220 ? 8.533 -45.904 44.445 1.00 152.84 ? 231 ARG A NH1 1 ATOM 1295 N NH2 . ARG A 1 220 ? 8.902 -46.569 42.278 1.00 149.71 ? 231 ARG A NH2 1 ATOM 1296 N N . ALA A 1 221 ? 14.225 -41.125 46.540 1.00 78.12 ? 232 ALA A N 1 ATOM 1297 C CA . ALA A 1 221 ? 14.588 -40.166 47.574 1.00 76.58 ? 232 ALA A CA 1 ATOM 1298 C C . ALA A 1 221 ? 13.646 -40.281 48.762 1.00 82.54 ? 232 ALA A C 1 ATOM 1299 O O . ALA A 1 221 ? 12.672 -41.031 48.717 1.00 84.82 ? 232 ALA A O 1 ATOM 1300 C CB . ALA A 1 221 ? 14.571 -38.753 47.019 1.00 60.36 ? 232 ALA A CB 1 ATOM 1301 N N . HIS A 1 222 ? 13.955 -39.546 49.826 1.00 81.03 ? 233 HIS A N 1 ATOM 1302 C CA . HIS A 1 222 ? 13.084 -39.469 50.988 1.00 84.65 ? 233 HIS A CA 1 ATOM 1303 C C . HIS A 1 222 ? 11.671 -39.142 50.524 1.00 87.61 ? 233 HIS A C 1 ATOM 1304 O O . HIS A 1 222 ? 11.474 -38.239 49.714 1.00 94.61 ? 233 HIS A O 1 ATOM 1305 C CB . HIS A 1 222 ? 13.588 -38.393 51.944 1.00 71.51 ? 233 HIS A CB 1 ATOM 1306 C CG . HIS A 1 222 ? 12.901 -38.392 53.272 1.00 78.99 ? 233 HIS A CG 1 ATOM 1307 N ND1 . HIS A 1 222 ? 11.617 -37.922 53.445 1.00 86.31 ? 233 HIS A ND1 1 ATOM 1308 C CD2 . HIS A 1 222 ? 13.325 -38.791 54.495 1.00 86.02 ? 233 HIS A CD2 1 ATOM 1309 C CE1 . HIS A 1 222 ? 11.277 -38.038 54.717 1.00 96.14 ? 233 HIS A CE1 1 ATOM 1310 N NE2 . HIS A 1 222 ? 12.296 -38.561 55.375 1.00 95.74 ? 233 HIS A NE2 1 ATOM 1311 N N . GLU A 1 223 ? 10.700 -39.896 51.025 1.00 91.46 ? 234 GLU A N 1 ATOM 1312 C CA . GLU A 1 223 ? 9.312 -39.786 50.582 1.00 90.70 ? 234 GLU A CA 1 ATOM 1313 C C . GLU A 1 223 ? 8.745 -38.365 50.646 1.00 90.70 ? 234 GLU A C 1 ATOM 1314 O O . GLU A 1 223 ? 7.944 -37.974 49.798 1.00 83.41 ? 234 GLU A O 1 ATOM 1315 C CB . GLU A 1 223 ? 8.433 -40.733 51.399 1.00 104.77 ? 234 GLU A CB 1 ATOM 1316 C CG . GLU A 1 223 ? 8.678 -40.642 52.900 1.00 119.99 ? 234 GLU A CG 1 ATOM 1317 C CD . GLU A 1 223 ? 7.761 -41.540 53.704 1.00 122.59 ? 234 GLU A CD 1 ATOM 1318 O OE1 . GLU A 1 223 ? 7.018 -42.338 53.093 1.00 124.06 ? 234 GLU A OE1 1 ATOM 1319 O OE2 . GLU A 1 223 ? 7.782 -41.442 54.950 1.00 118.62 ? 234 GLU A OE2 1 ATOM 1320 N N . ASP A 1 224 ? 9.159 -37.595 51.647 1.00 94.26 ? 235 ASP A N 1 ATOM 1321 C CA . ASP A 1 224 ? 8.632 -36.246 51.824 1.00 103.28 ? 235 ASP A CA 1 ATOM 1322 C C . ASP A 1 224 ? 9.265 -35.265 50.851 1.00 109.39 ? 235 ASP A C 1 ATOM 1323 O O . ASP A 1 224 ? 8.605 -34.349 50.361 1.00 114.53 ? 235 ASP A O 1 ATOM 1324 C CB . ASP A 1 224 ? 8.824 -35.769 53.264 1.00 108.16 ? 235 ASP A CB 1 ATOM 1325 C CG . ASP A 1 224 ? 7.925 -36.497 54.238 1.00 112.49 ? 235 ASP A CG 1 ATOM 1326 O OD1 . ASP A 1 224 ? 8.278 -36.575 55.433 1.00 118.69 ? 235 ASP A OD1 1 ATOM 1327 O OD2 . ASP A 1 224 ? 6.865 -36.997 53.802 1.00 106.08 ? 235 ASP A OD2 1 ATOM 1328 N N . ALA A 1 225 ? 10.547 -35.457 50.577 1.00 111.48 ? 236 ALA A N 1 ATOM 1329 C CA . ALA A 1 225 ? 11.231 -34.645 49.584 1.00 111.10 ? 236 ALA A CA 1 ATOM 1330 C C . ALA A 1 225 ? 10.714 -34.996 48.196 1.00 110.08 ? 236 ALA A C 1 ATOM 1331 O O . ALA A 1 225 ? 11.090 -36.018 47.623 1.00 114.99 ? 236 ALA A O 1 ATOM 1332 C CB . ALA A 1 225 ? 12.729 -34.862 49.661 1.00 110.26 ? 236 ALA A CB 1 ATOM 1333 N N . GLY A 1 226 ? 9.836 -34.158 47.662 1.00 66.98 ? 237 GLY A N 1 ATOM 1334 C CA . GLY A 1 226 ? 9.340 -34.373 46.317 1.00 113.57 ? 237 GLY A CA 1 ATOM 1335 C C . GLY A 1 226 ? 8.005 -35.087 46.248 1.00 106.18 ? 237 GLY A C 1 ATOM 1336 O O . GLY A 1 226 ? 7.673 -35.705 45.239 1.00 107.76 ? 237 GLY A O 1 ATOM 1337 N N . ARG A 1 227 ? 7.236 -35.011 47.323 1.00 101.15 ? 238 ARG A N 1 ATOM 1338 C CA . ARG A 1 227 ? 5.868 -35.494 47.288 1.00 101.50 ? 238 ARG A CA 1 ATOM 1339 C C . ARG A 1 227 ? 4.966 -34.305 46.990 1.00 99.22 ? 238 ARG A C 1 ATOM 1340 O O . ARG A 1 227 ? 5.359 -33.157 47.192 1.00 99.56 ? 238 ARG A O 1 ATOM 1341 C CB . ARG A 1 227 ? 5.483 -36.135 48.622 1.00 106.71 ? 238 ARG A CB 1 ATOM 1342 N N . GLY A 1 228 ? 3.765 -34.573 46.494 1.00 93.38 ? 239 GLY A N 1 ATOM 1343 C CA . GLY A 1 228 ? 2.807 -33.509 46.275 1.00 89.63 ? 239 GLY A CA 1 ATOM 1344 C C . GLY A 1 228 ? 2.314 -33.354 44.852 1.00 86.51 ? 239 GLY A C 1 ATOM 1345 O O . GLY A 1 228 ? 2.092 -34.333 44.134 1.00 76.14 ? 239 GLY A O 1 ATOM 1346 N N . VAL A 1 229 ? 2.151 -32.104 44.443 1.00 88.01 ? 240 VAL A N 1 ATOM 1347 C CA . VAL A 1 229 ? 1.455 -31.793 43.206 1.00 80.04 ? 240 VAL A CA 1 ATOM 1348 C C . VAL A 1 229 ? 1.988 -30.489 42.613 1.00 72.38 ? 240 VAL A C 1 ATOM 1349 O O . VAL A 1 229 ? 2.410 -29.595 43.349 1.00 77.95 ? 240 VAL A O 1 ATOM 1350 C CB . VAL A 1 229 ? -0.071 -31.697 43.479 1.00 73.99 ? 240 VAL A CB 1 ATOM 1351 C CG1 . VAL A 1 229 ? -0.598 -30.282 43.248 1.00 69.74 ? 240 VAL A CG1 1 ATOM 1352 C CG2 . VAL A 1 229 ? -0.837 -32.728 42.661 1.00 76.61 ? 240 VAL A CG2 1 ATOM 1353 N N . GLN A 1 230 ? 1.997 -30.388 41.286 1.00 67.33 ? 241 GLN A N 1 ATOM 1354 C CA . GLN A 1 230 ? 2.391 -29.138 40.632 1.00 70.89 ? 241 GLN A CA 1 ATOM 1355 C C . GLN A 1 230 ? 1.632 -28.827 39.339 1.00 70.60 ? 241 GLN A C 1 ATOM 1356 O O . GLN A 1 230 ? 1.038 -29.710 38.718 1.00 71.53 ? 241 GLN A O 1 ATOM 1357 C CB . GLN A 1 230 ? 3.908 -29.054 40.421 1.00 63.66 ? 241 GLN A CB 1 ATOM 1358 C CG . GLN A 1 230 ? 4.535 -30.267 39.776 1.00 67.72 ? 241 GLN A CG 1 ATOM 1359 C CD . GLN A 1 230 ? 6.037 -30.316 39.988 1.00 74.76 ? 241 GLN A CD 1 ATOM 1360 O OE1 . GLN A 1 230 ? 6.635 -31.390 40.021 1.00 83.72 ? 241 GLN A OE1 1 ATOM 1361 N NE2 . GLN A 1 230 ? 6.653 -29.150 40.139 1.00 68.37 ? 241 GLN A NE2 1 ATOM 1362 N N . SER A 1 231 ? 1.654 -27.555 38.950 1.00 64.71 ? 242 SER A N 1 ATOM 1363 C CA . SER A 1 231 ? 0.879 -27.095 37.805 1.00 65.40 ? 242 SER A CA 1 ATOM 1364 C C . SER A 1 231 ? 1.735 -26.591 36.655 1.00 73.86 ? 242 SER A C 1 ATOM 1365 O O . SER A 1 231 ? 2.906 -26.251 36.827 1.00 82.66 ? 242 SER A O 1 ATOM 1366 C CB . SER A 1 231 ? -0.116 -26.010 38.219 1.00 68.20 ? 242 SER A CB 1 ATOM 1367 O OG . SER A 1 231 ? -1.176 -26.560 38.982 1.00 89.91 ? 242 SER A OG 1 ATOM 1368 N N . PHE A 1 232 ? 1.125 -26.549 35.477 1.00 70.05 ? 243 PHE A N 1 ATOM 1369 C CA . PHE A 1 232 ? 1.789 -26.088 34.274 1.00 58.43 ? 243 PHE A CA 1 ATOM 1370 C C . PHE A 1 232 ? 0.731 -25.721 33.250 1.00 59.56 ? 243 PHE A C 1 ATOM 1371 O O . PHE A 1 232 ? -0.449 -26.021 33.436 1.00 62.42 ? 243 PHE A O 1 ATOM 1372 C CB . PHE A 1 232 ? 2.696 -27.181 33.720 1.00 57.28 ? 243 PHE A CB 1 ATOM 1373 C CG . PHE A 1 232 ? 1.962 -28.402 33.259 1.00 61.53 ? 243 PHE A CG 1 ATOM 1374 C CD1 . PHE A 1 232 ? 1.633 -29.405 34.149 1.00 64.28 ? 243 PHE A CD1 1 ATOM 1375 C CD2 . PHE A 1 232 ? 1.614 -28.557 31.931 1.00 61.63 ? 243 PHE A CD2 1 ATOM 1376 C CE1 . PHE A 1 232 ? 0.963 -30.534 33.726 1.00 69.70 ? 243 PHE A CE1 1 ATOM 1377 C CE2 . PHE A 1 232 ? 0.943 -29.685 31.504 1.00 72.43 ? 243 PHE A CE2 1 ATOM 1378 C CZ . PHE A 1 232 ? 0.618 -30.674 32.402 1.00 71.63 ? 243 PHE A CZ 1 ATOM 1379 N N . ASN A 1 233 ? 1.151 -25.072 32.170 1.00 63.07 ? 244 ASN A N 1 ATOM 1380 C CA . ASN A 1 233 ? 0.220 -24.669 31.122 1.00 55.60 ? 244 ASN A CA 1 ATOM 1381 C C . ASN A 1 233 ? 0.274 -25.585 29.910 1.00 57.26 ? 244 ASN A C 1 ATOM 1382 O O . ASN A 1 233 ? 1.264 -26.277 29.686 1.00 74.91 ? 244 ASN A O 1 ATOM 1383 C CB . ASN A 1 233 ? 0.477 -23.224 30.703 1.00 57.89 ? 244 ASN A CB 1 ATOM 1384 C CG . ASN A 1 233 ? 0.082 -22.233 31.773 1.00 67.27 ? 244 ASN A CG 1 ATOM 1385 O OD1 . ASN A 1 233 ? 0.932 -21.562 32.354 1.00 86.78 ? 244 ASN A OD1 1 ATOM 1386 N ND2 . ASN A 1 233 ? -1.215 -22.136 32.041 1.00 63.78 ? 244 ASN A ND2 1 ATOM 1387 N N . ARG A 1 234 ? -0.802 -25.582 29.132 1.00 66.45 ? 245 ARG A N 1 ATOM 1388 C CA . ARG A 1 234 ? -0.904 -26.422 27.948 1.00 55.57 ? 245 ARG A CA 1 ATOM 1389 C C . ARG A 1 234 ? -1.825 -25.730 26.965 1.00 57.42 ? 245 ARG A C 1 ATOM 1390 O O . ARG A 1 234 ? -2.950 -25.382 27.311 1.00 60.69 ? 245 ARG A O 1 ATOM 1391 C CB . ARG A 1 234 ? -1.471 -27.794 28.322 1.00 52.69 ? 245 ARG A CB 1 ATOM 1392 C CG . ARG A 1 234 ? -1.127 -28.903 27.349 1.00 59.79 ? 245 ARG A CG 1 ATOM 1393 C CD . ARG A 1 234 ? -2.276 -29.216 26.418 1.00 75.80 ? 245 ARG A CD 1 ATOM 1394 N NE . ARG A 1 234 ? -1.928 -30.244 25.439 1.00 76.85 ? 245 ARG A NE 1 ATOM 1395 C CZ . ARG A 1 234 ? -1.928 -31.548 25.693 1.00 74.26 ? 245 ARG A CZ 1 ATOM 1396 N NH1 . ARG A 1 234 ? -2.243 -31.991 26.902 1.00 82.60 ? 245 ARG A NH1 1 ATOM 1397 N NH2 . ARG A 1 234 ? -1.606 -32.410 24.739 1.00 69.59 ? 245 ARG A NH2 1 ATOM 1398 N N . LEU A 1 235 ? -1.350 -25.529 25.740 1.00 63.34 ? 246 LEU A N 1 ATOM 1399 C CA . LEU A 1 235 ? -2.136 -24.822 24.736 1.00 52.14 ? 246 LEU A CA 1 ATOM 1400 C C . LEU A 1 235 ? -3.306 -25.662 24.238 1.00 58.96 ? 246 LEU A C 1 ATOM 1401 O O . LEU A 1 235 ? -3.137 -26.829 23.896 1.00 62.12 ? 246 LEU A O 1 ATOM 1402 C CB . LEU A 1 235 ? -1.258 -24.400 23.565 1.00 44.26 ? 246 LEU A CB 1 ATOM 1403 C CG . LEU A 1 235 ? -1.854 -23.248 22.759 1.00 52.58 ? 246 LEU A CG 1 ATOM 1404 C CD1 . LEU A 1 235 ? -2.008 -22.032 23.652 1.00 41.98 ? 246 LEU A CD1 1 ATOM 1405 C CD2 . LEU A 1 235 ? -0.985 -22.932 21.556 1.00 38.32 ? 246 LEU A CD2 1 ATOM 1406 N N . VAL A 1 236 ? -4.494 -25.064 24.215 1.00 62.00 ? 247 VAL A N 1 ATOM 1407 C CA . VAL A 1 236 ? -5.695 -25.746 23.742 1.00 60.97 ? 247 VAL A CA 1 ATOM 1408 C C . VAL A 1 236 ? -6.440 -24.882 22.722 1.00 66.90 ? 247 VAL A C 1 ATOM 1409 O O . VAL A 1 236 ? -6.386 -23.652 22.788 1.00 80.02 ? 247 VAL A O 1 ATOM 1410 C CB . VAL A 1 236 ? -6.644 -26.116 24.911 1.00 65.64 ? 247 VAL A CB 1 ATOM 1411 C CG1 . VAL A 1 236 ? -5.908 -26.926 25.966 1.00 57.64 ? 247 VAL A CG1 1 ATOM 1412 C CG2 . VAL A 1 236 ? -7.258 -24.873 25.526 1.00 63.32 ? 247 VAL A CG2 1 ATOM 1413 N N . PRO A 1 237 ? -7.123 -25.524 21.760 1.00 54.91 ? 248 PRO A N 1 ATOM 1414 C CA . PRO A 1 237 ? -7.841 -24.803 20.700 1.00 53.87 ? 248 PRO A CA 1 ATOM 1415 C C . PRO A 1 237 ? -9.074 -24.037 21.172 1.00 55.77 ? 248 PRO A C 1 ATOM 1416 O O . PRO A 1 237 ? -9.865 -24.542 21.969 1.00 62.64 ? 248 PRO A O 1 ATOM 1417 C CB . PRO A 1 237 ? -8.260 -25.920 19.734 1.00 56.24 ? 248 PRO A CB 1 ATOM 1418 C CG . PRO A 1 237 ? -8.221 -27.167 20.544 1.00 61.11 ? 248 PRO A CG 1 ATOM 1419 C CD . PRO A 1 237 ? -7.109 -26.976 21.522 1.00 55.99 ? 248 PRO A CD 1 ATOM 1420 N N . VAL A 1 238 ? -9.230 -22.822 20.657 1.00 51.62 ? 249 VAL A N 1 ATOM 1421 C CA . VAL A 1 238 ? -10.392 -21.991 20.945 1.00 60.15 ? 249 VAL A CA 1 ATOM 1422 C C . VAL A 1 238 ? -10.762 -21.169 19.707 1.00 64.52 ? 249 VAL A C 1 ATOM 1423 O O . VAL A 1 238 ? -9.879 -20.694 18.985 1.00 56.45 ? 249 VAL A O 1 ATOM 1424 C CB . VAL A 1 238 ? -10.129 -21.074 22.160 1.00 48.19 ? 249 VAL A CB 1 ATOM 1425 C CG1 . VAL A 1 238 ? -10.858 -19.748 22.024 1.00 65.07 ? 249 VAL A CG1 1 ATOM 1426 C CG2 . VAL A 1 238 ? -10.521 -21.782 23.447 1.00 55.52 ? 249 VAL A CG2 1 ATOM 1427 N N . GLU A 1 239 ? -12.063 -21.029 19.455 1.00 59.09 ? 250 GLU A N 1 ATOM 1428 C CA . GLU A 1 239 ? -12.557 -20.279 18.305 1.00 55.99 ? 250 GLU A CA 1 ATOM 1429 C C . GLU A 1 239 ? -12.030 -18.849 18.281 1.00 56.35 ? 250 GLU A C 1 ATOM 1430 O O . GLU A 1 239 ? -12.142 -18.123 19.265 1.00 57.39 ? 250 GLU A O 1 ATOM 1431 C CB . GLU A 1 239 ? -14.091 -20.268 18.284 1.00 50.96 ? 250 GLU A CB 1 ATOM 1432 C CG . GLU A 1 239 ? -14.694 -19.643 17.026 1.00 63.91 ? 250 GLU A CG 1 ATOM 1433 C CD . GLU A 1 239 ? -16.212 -19.744 16.980 1.00 77.87 ? 250 GLU A CD 1 ATOM 1434 O OE1 . GLU A 1 239 ? -16.748 -20.256 15.972 1.00 76.94 ? 250 GLU A OE1 1 ATOM 1435 O OE2 . GLU A 1 239 ? -16.872 -19.308 17.947 1.00 82.75 ? 250 GLU A OE2 1 ATOM 1436 N N . ASP A 1 240 ? -11.446 -18.461 17.151 1.00 60.08 ? 251 ASP A N 1 ATOM 1437 C CA . ASP A 1 240 ? -10.985 -17.093 16.947 1.00 57.87 ? 251 ASP A CA 1 ATOM 1438 C C . ASP A 1 240 ? -12.190 -16.160 16.899 1.00 55.94 ? 251 ASP A C 1 ATOM 1439 O O . ASP A 1 240 ? -13.219 -16.491 16.311 1.00 59.64 ? 251 ASP A O 1 ATOM 1440 C CB . ASP A 1 240 ? -10.175 -16.994 15.652 1.00 64.89 ? 251 ASP A CB 1 ATOM 1441 C CG . ASP A 1 240 ? -9.316 -15.744 15.592 1.00 75.33 ? 251 ASP A CG 1 ATOM 1442 O OD1 . ASP A 1 240 ? -9.803 -14.658 15.965 1.00 69.14 ? 251 ASP A OD1 1 ATOM 1443 O OD2 . ASP A 1 240 ? -8.144 -15.853 15.176 1.00 79.91 ? 251 ASP A OD2 1 ATOM 1444 N N . SER A 1 241 ? -12.063 -14.995 17.522 1.00 63.40 ? 252 SER A N 1 ATOM 1445 C CA . SER A 1 241 ? -13.194 -14.084 17.668 1.00 64.55 ? 252 SER A CA 1 ATOM 1446 C C . SER A 1 241 ? -13.299 -13.084 16.520 1.00 58.70 ? 252 SER A C 1 ATOM 1447 O O . SER A 1 241 ? -14.330 -12.433 16.347 1.00 62.29 ? 252 SER A O 1 ATOM 1448 C CB . SER A 1 241 ? -13.103 -13.347 19.005 1.00 73.79 ? 252 SER A CB 1 ATOM 1449 O OG . SER A 1 241 ? -11.836 -12.732 19.153 1.00 79.67 ? 252 SER A OG 1 ATOM 1450 N N . SER A 1 242 ? -12.226 -12.968 15.744 1.00 62.51 ? 253 SER A N 1 ATOM 1451 C CA . SER A 1 242 ? -12.172 -12.052 14.608 1.00 65.03 ? 253 SER A CA 1 ATOM 1452 C C . SER A 1 242 ? -13.244 -12.360 13.569 1.00 65.95 ? 253 SER A C 1 ATOM 1453 O O . SER A 1 242 ? -13.518 -13.524 13.281 1.00 68.73 ? 253 SER A O 1 ATOM 1454 C CB . SER A 1 242 ? -10.788 -12.106 13.954 1.00 64.56 ? 253 SER A CB 1 ATOM 1455 O OG . SER A 1 242 ? -10.801 -11.525 12.662 1.00 62.24 ? 253 SER A OG 1 ATOM 1456 N N . ASN A 1 243 ? -13.841 -11.311 13.006 1.00 68.63 ? 254 ASN A N 1 ATOM 1457 C CA . ASN A 1 243 ? -14.845 -11.467 11.955 1.00 71.38 ? 254 ASN A CA 1 ATOM 1458 C C . ASN A 1 243 ? -14.237 -11.767 10.589 1.00 64.92 ? 254 ASN A C 1 ATOM 1459 O O . ASN A 1 243 ? -14.935 -11.768 9.580 1.00 55.18 ? 254 ASN A O 1 ATOM 1460 C CB . ASN A 1 243 ? -15.730 -10.223 11.856 1.00 73.21 ? 254 ASN A CB 1 ATOM 1461 C CG . ASN A 1 243 ? -16.620 -10.046 13.063 1.00 90.01 ? 254 ASN A CG 1 ATOM 1462 O OD1 . ASN A 1 243 ? -16.963 -11.012 13.745 1.00 98.72 ? 254 ASN A OD1 1 ATOM 1463 N ND2 . ASN A 1 243 ? -17.004 -8.805 13.334 1.00 91.15 ? 254 ASN A ND2 1 ATOM 1464 N N . TYR A 1 244 ? -12.933 -12.019 10.562 1.00 64.37 ? 255 TYR A N 1 ATOM 1465 C CA . TYR A 1 244 ? -12.248 -12.341 9.319 1.00 64.51 ? 255 TYR A CA 1 ATOM 1466 C C . TYR A 1 244 ? -11.541 -13.680 9.437 1.00 61.37 ? 255 TYR A C 1 ATOM 1467 O O . TYR A 1 244 ? -10.549 -13.936 8.753 1.00 53.45 ? 255 TYR A O 1 ATOM 1468 C CB . TYR A 1 244 ? -11.264 -11.232 8.947 1.00 70.36 ? 255 TYR A CB 1 ATOM 1469 C CG . TYR A 1 244 ? -11.947 -9.921 8.641 1.00 67.51 ? 255 TYR A CG 1 ATOM 1470 C CD1 . TYR A 1 244 ? -12.051 -8.928 9.604 1.00 58.48 ? 255 TYR A CD1 1 ATOM 1471 C CD2 . TYR A 1 244 ? -12.511 -9.688 7.394 1.00 64.09 ? 255 TYR A CD2 1 ATOM 1472 C CE1 . TYR A 1 244 ? -12.687 -7.734 9.329 1.00 50.12 ? 255 TYR A CE1 1 ATOM 1473 C CE2 . TYR A 1 244 ? -13.149 -8.499 7.112 1.00 63.84 ? 255 TYR A CE2 1 ATOM 1474 C CZ . TYR A 1 244 ? -13.234 -7.523 8.082 1.00 58.01 ? 255 TYR A CZ 1 ATOM 1475 O OH . TYR A 1 244 ? -13.872 -6.334 7.798 1.00 62.21 ? 255 TYR A OH 1 ATOM 1476 N N . ALA A 1 245 ? -12.075 -14.534 10.304 1.00 68.35 ? 256 ALA A N 1 ATOM 1477 C CA . ALA A 1 245 ? -11.479 -15.834 10.586 1.00 69.91 ? 256 ALA A CA 1 ATOM 1478 C C . ALA A 1 245 ? -12.288 -16.974 9.972 1.00 62.45 ? 256 ALA A C 1 ATOM 1479 O O . ALA A 1 245 ? -12.527 -17.996 10.617 1.00 46.45 ? 256 ALA A O 1 ATOM 1480 C CB . ALA A 1 245 ? -11.338 -16.029 12.092 1.00 60.35 ? 256 ALA A CB 1 ATOM 1481 N N . TYR A 1 246 ? -12.707 -16.795 8.723 1.00 49.68 ? 257 TYR A N 1 ATOM 1482 C CA . TYR A 1 246 ? -13.499 -17.812 8.038 1.00 43.99 ? 257 TYR A CA 1 ATOM 1483 C C . TYR A 1 246 ? -12.760 -18.427 6.854 1.00 50.23 ? 257 TYR A C 1 ATOM 1484 O O . TYR A 1 246 ? -11.971 -17.765 6.184 1.00 51.78 ? 257 TYR A O 1 ATOM 1485 C CB . TYR A 1 246 ? -14.838 -17.237 7.580 1.00 45.82 ? 257 TYR A CB 1 ATOM 1486 C CG . TYR A 1 246 ? -15.746 -16.800 8.709 1.00 58.07 ? 257 TYR A CG 1 ATOM 1487 C CD1 . TYR A 1 246 ? -15.687 -15.509 9.218 1.00 72.79 ? 257 TYR A CD1 1 ATOM 1488 C CD2 . TYR A 1 246 ? -16.669 -17.677 9.259 1.00 52.48 ? 257 TYR A CD2 1 ATOM 1489 C CE1 . TYR A 1 246 ? -16.518 -15.106 10.247 1.00 75.32 ? 257 TYR A CE1 1 ATOM 1490 C CE2 . TYR A 1 246 ? -17.505 -17.285 10.285 1.00 74.35 ? 257 TYR A CE2 1 ATOM 1491 C CZ . TYR A 1 246 ? -17.427 -15.998 10.776 1.00 79.62 ? 257 TYR A CZ 1 ATOM 1492 O OH . TYR A 1 246 ? -18.259 -15.607 11.802 1.00 72.02 ? 257 TYR A OH 1 ATOM 1493 N N . PHE A 1 247 ? -13.028 -19.703 6.600 1.00 54.21 ? 258 PHE A N 1 ATOM 1494 C CA . PHE A 1 247 ? -12.384 -20.423 5.512 1.00 49.97 ? 258 PHE A CA 1 ATOM 1495 C C . PHE A 1 247 ? -13.177 -21.676 5.174 1.00 42.43 ? 258 PHE A C 1 ATOM 1496 O O . PHE A 1 247 ? -13.924 -22.188 6.006 1.00 49.29 ? 258 PHE A O 1 ATOM 1497 C CB . PHE A 1 247 ? -10.959 -20.812 5.909 1.00 46.36 ? 258 PHE A CB 1 ATOM 1498 C CG . PHE A 1 247 ? -10.892 -21.918 6.928 1.00 52.68 ? 258 PHE A CG 1 ATOM 1499 C CD1 . PHE A 1 247 ? -10.582 -23.213 6.548 1.00 54.11 ? 258 PHE A CD1 1 ATOM 1500 C CD2 . PHE A 1 247 ? -11.146 -21.666 8.265 1.00 54.66 ? 258 PHE A CD2 1 ATOM 1501 C CE1 . PHE A 1 247 ? -10.521 -24.239 7.484 1.00 57.28 ? 258 PHE A CE1 1 ATOM 1502 C CE2 . PHE A 1 247 ? -11.086 -22.687 9.204 1.00 54.75 ? 258 PHE A CE2 1 ATOM 1503 C CZ . PHE A 1 247 ? -10.772 -23.975 8.811 1.00 48.92 ? 258 PHE A CZ 1 ATOM 1504 N N . ILE A 1 248 ? -13.026 -22.161 3.947 1.00 43.69 ? 259 ILE A N 1 ATOM 1505 C CA . ILE A 1 248 ? -13.482 -23.506 3.602 1.00 36.03 ? 259 ILE A CA 1 ATOM 1506 C C . ILE A 1 248 ? -12.317 -24.299 3.041 1.00 43.28 ? 259 ILE A C 1 ATOM 1507 O O . ILE A 1 248 ? -11.312 -23.729 2.608 1.00 39.63 ? 259 ILE A O 1 ATOM 1508 C CB . ILE A 1 248 ? -14.646 -23.510 2.598 1.00 36.92 ? 259 ILE A CB 1 ATOM 1509 C CG1 . ILE A 1 248 ? -14.317 -22.649 1.383 1.00 41.32 ? 259 ILE A CG1 1 ATOM 1510 C CG2 . ILE A 1 248 ? -15.912 -23.011 3.253 1.00 38.45 ? 259 ILE A CG2 1 ATOM 1511 C CD1 . ILE A 1 248 ? -15.437 -22.591 0.376 1.00 61.37 ? 259 ILE A CD1 1 ATOM 1512 N N . VAL A 1 249 ? -12.434 -25.618 3.065 1.00 39.65 ? 260 VAL A N 1 ATOM 1513 C CA . VAL A 1 249 ? -11.363 -26.441 2.527 1.00 45.45 ? 260 VAL A CA 1 ATOM 1514 C C . VAL A 1 249 ? -11.830 -27.261 1.326 1.00 45.33 ? 260 VAL A C 1 ATOM 1515 O O . VAL A 1 249 ? -12.903 -27.867 1.346 1.00 52.53 ? 260 VAL A O 1 ATOM 1516 C CB . VAL A 1 249 ? -10.638 -27.283 3.624 1.00 50.73 ? 260 VAL A CB 1 ATOM 1517 C CG1 . VAL A 1 249 ? -11.302 -27.098 4.979 1.00 36.11 ? 260 VAL A CG1 1 ATOM 1518 C CG2 . VAL A 1 249 ? -10.552 -28.749 3.238 1.00 46.46 ? 260 VAL A CG2 1 ATOM 1519 N N . LYS A 1 250 ? -11.013 -27.236 0.276 1.00 52.05 ? 261 LYS A N 1 ATOM 1520 C CA . LYS A 1 250 ? -11.341 -27.816 -1.023 1.00 47.98 ? 261 LYS A CA 1 ATOM 1521 C C . LYS A 1 250 ? -11.852 -29.249 -0.924 1.00 43.39 ? 261 LYS A C 1 ATOM 1522 O O . LYS A 1 250 ? -12.870 -29.596 -1.519 1.00 52.04 ? 261 LYS A O 1 ATOM 1523 C CB . LYS A 1 250 ? -10.116 -27.737 -1.946 1.00 60.56 ? 261 LYS A CB 1 ATOM 1524 C CG . LYS A 1 250 ? -10.256 -28.442 -3.292 1.00 71.87 ? 261 LYS A CG 1 ATOM 1525 C CD . LYS A 1 250 ? -9.047 -28.155 -4.184 1.00 81.65 ? 261 LYS A CD 1 ATOM 1526 C CE . LYS A 1 250 ? -9.098 -28.927 -5.503 1.00 92.88 ? 261 LYS A CE 1 ATOM 1527 N NZ . LYS A 1 250 ? -8.723 -30.364 -5.356 1.00 86.97 ? 261 LYS A NZ 1 ATOM 1528 N N . GLU A 1 251 ? -11.152 -30.072 -0.155 1.00 34.93 ? 262 GLU A N 1 ATOM 1529 C CA . GLU A 1 251 ? -11.515 -31.476 -0.014 1.00 35.95 ? 262 GLU A CA 1 ATOM 1530 C C . GLU A 1 251 ? -12.876 -31.667 0.650 1.00 37.41 ? 262 GLU A C 1 ATOM 1531 O O . GLU A 1 251 ? -13.485 -32.725 0.537 1.00 53.78 ? 262 GLU A O 1 ATOM 1532 C CB . GLU A 1 251 ? -10.435 -32.238 0.756 1.00 52.50 ? 262 GLU A CB 1 ATOM 1533 C CG . GLU A 1 251 ? -9.081 -32.307 0.045 1.00 69.32 ? 262 GLU A CG 1 ATOM 1534 C CD . GLU A 1 251 ? -8.280 -31.010 0.124 1.00 68.33 ? 262 GLU A CD 1 ATOM 1535 O OE1 . GLU A 1 251 ? -8.721 -30.060 0.810 1.00 61.17 ? 262 GLU A OE1 1 ATOM 1536 O OE2 . GLU A 1 251 ? -7.201 -30.945 -0.503 1.00 65.08 ? 262 GLU A OE2 1 ATOM 1537 N N . GLU A 1 252 ? -13.356 -30.640 1.337 1.00 46.31 ? 263 GLU A N 1 ATOM 1538 C CA . GLU A 1 252 ? -14.622 -30.745 2.046 1.00 51.78 ? 263 GLU A CA 1 ATOM 1539 C C . GLU A 1 252 ? -15.753 -30.179 1.200 1.00 50.91 ? 263 GLU A C 1 ATOM 1540 O O . GLU A 1 252 ? -16.909 -30.155 1.615 1.00 47.44 ? 263 GLU A O 1 ATOM 1541 C CB . GLU A 1 252 ? -14.527 -30.068 3.419 1.00 51.05 ? 263 GLU A CB 1 ATOM 1542 C CG . GLU A 1 252 ? -13.478 -30.720 4.320 1.00 59.24 ? 263 GLU A CG 1 ATOM 1543 C CD . GLU A 1 252 ? -13.246 -29.980 5.625 1.00 60.79 ? 263 GLU A CD 1 ATOM 1544 O OE1 . GLU A 1 252 ? -14.166 -29.270 6.086 1.00 59.30 ? 263 GLU A OE1 1 ATOM 1545 O OE2 . GLU A 1 252 ? -12.138 -30.118 6.193 1.00 45.65 ? 263 GLU A OE2 1 ATOM 1546 N N . CYS A 1 253 ? -15.401 -29.732 0.000 1.00 58.68 ? 264 CYS A N 1 ATOM 1547 C CA . CYS A 1 253 ? -16.375 -29.283 -0.984 1.00 60.16 ? 264 CYS A CA 1 ATOM 1548 C C . CYS A 1 253 ? -16.661 -30.451 -1.925 1.00 57.77 ? 264 CYS A C 1 ATOM 1549 O O . CYS A 1 253 ? -15.994 -30.611 -2.946 1.00 64.76 ? 264 CYS A O 1 ATOM 1550 C CB . CYS A 1 253 ? -15.812 -28.087 -1.762 1.00 55.82 ? 264 CYS A CB 1 ATOM 1551 S SG . CYS A 1 253 ? -16.973 -27.285 -2.890 1.00 88.41 ? 264 CYS A SG 1 ATOM 1552 N N . LYS A 1 254 ? -17.639 -31.278 -1.571 1.00 52.52 ? 265 LYS A N 1 ATOM 1553 C CA . LYS A 1 254 ? -17.840 -32.552 -2.264 1.00 54.76 ? 265 LYS A CA 1 ATOM 1554 C C . LYS A 1 254 ? -18.685 -32.408 -3.530 1.00 61.64 ? 265 LYS A C 1 ATOM 1555 O O . LYS A 1 254 ? -18.574 -33.212 -4.459 1.00 50.37 ? 265 LYS A O 1 ATOM 1556 C CB . LYS A 1 254 ? -18.449 -33.594 -1.320 1.00 60.99 ? 265 LYS A CB 1 ATOM 1557 C CG . LYS A 1 254 ? -17.678 -33.796 -0.015 1.00 60.11 ? 265 LYS A CG 1 ATOM 1558 C CD . LYS A 1 254 ? -16.225 -34.180 -0.256 1.00 70.53 ? 265 LYS A CD 1 ATOM 1559 C CE . LYS A 1 254 ? -16.097 -35.575 -0.855 1.00 88.94 ? 265 LYS A CE 1 ATOM 1560 N NZ . LYS A 1 254 ? -14.673 -35.973 -1.073 1.00 82.20 ? 265 LYS A NZ 1 ATOM 1561 N N . ASN A 1 255 ? -19.531 -31.384 -3.549 1.00 65.66 ? 266 ASN A N 1 ATOM 1562 C CA . ASN A 1 255 ? -20.295 -31.008 -4.729 1.00 46.26 ? 266 ASN A CA 1 ATOM 1563 C C . ASN A 1 255 ? -20.077 -29.524 -4.997 1.00 48.37 ? 266 ASN A C 1 ATOM 1564 O O . ASN A 1 255 ? -19.913 -28.746 -4.066 1.00 49.63 ? 266 ASN A O 1 ATOM 1565 C CB . ASN A 1 255 ? -21.788 -31.273 -4.521 1.00 52.01 ? 266 ASN A CB 1 ATOM 1566 C CG . ASN A 1 255 ? -22.146 -32.751 -4.602 1.00 61.53 ? 266 ASN A CG 1 ATOM 1567 O OD1 . ASN A 1 255 ? -21.275 -33.622 -4.562 1.00 54.06 ? 266 ASN A OD1 1 ATOM 1568 N ND2 . ASN A 1 255 ? -23.442 -33.037 -4.715 1.00 54.35 ? 266 ASN A ND2 1 ATOM 1569 N N . GLY A 1 256 ? -20.068 -29.132 -6.265 1.00 49.16 ? 267 GLY A N 1 ATOM 1570 C CA . GLY A 1 256 ? -19.910 -27.735 -6.619 1.00 43.94 ? 267 GLY A CA 1 ATOM 1571 C C . GLY A 1 256 ? -18.492 -27.202 -6.507 1.00 55.70 ? 267 GLY A C 1 ATOM 1572 O O . GLY A 1 256 ? -17.517 -27.914 -6.745 1.00 42.31 ? 267 GLY A O 1 ATOM 1573 N N . SER A 1 257 ? -18.389 -25.932 -6.132 1.00 56.98 ? 268 SER A N 1 ATOM 1574 C CA . SER A 1 257 ? -17.118 -25.222 -6.105 1.00 48.04 ? 268 SER A CA 1 ATOM 1575 C C . SER A 1 257 ? -17.135 -24.171 -5.004 1.00 50.66 ? 268 SER A C 1 ATOM 1576 O O . SER A 1 257 ? -18.084 -24.103 -4.222 1.00 61.63 ? 268 SER A O 1 ATOM 1577 C CB . SER A 1 257 ? -16.898 -24.533 -7.444 1.00 57.86 ? 268 SER A CB 1 ATOM 1578 O OG . SER A 1 257 ? -18.039 -23.759 -7.788 1.00 65.25 ? 268 SER A OG 1 ATOM 1579 N N . TYR A 1 258 ? -16.093 -23.346 -4.958 1.00 49.05 ? 269 TYR A N 1 ATOM 1580 C CA . TYR A 1 258 ? -15.994 -22.267 -3.975 1.00 43.57 ? 269 TYR A CA 1 ATOM 1581 C C . TYR A 1 258 ? -17.254 -21.404 -3.939 1.00 48.72 ? 269 TYR A C 1 ATOM 1582 O O . TYR A 1 258 ? -17.746 -21.055 -2.870 1.00 62.46 ? 269 TYR A O 1 ATOM 1583 C CB . TYR A 1 258 ? -14.767 -21.392 -4.261 1.00 40.99 ? 269 TYR A CB 1 ATOM 1584 C CG . TYR A 1 258 ? -14.599 -20.217 -3.319 1.00 48.21 ? 269 TYR A CG 1 ATOM 1585 C CD1 . TYR A 1 258 ? -15.215 -19.001 -3.579 1.00 43.01 ? 269 TYR A CD1 1 ATOM 1586 C CD2 . TYR A 1 258 ? -13.816 -20.322 -2.177 1.00 52.27 ? 269 TYR A CD2 1 ATOM 1587 C CE1 . TYR A 1 258 ? -15.069 -17.932 -2.730 1.00 42.85 ? 269 TYR A CE1 1 ATOM 1588 C CE2 . TYR A 1 258 ? -13.663 -19.250 -1.319 1.00 56.75 ? 269 TYR A CE2 1 ATOM 1589 C CZ . TYR A 1 258 ? -14.294 -18.056 -1.601 1.00 53.78 ? 269 TYR A CZ 1 ATOM 1590 O OH . TYR A 1 258 ? -14.153 -16.977 -0.756 1.00 61.03 ? 269 TYR A OH 1 ATOM 1591 N N . GLU A 1 259 ? -17.768 -21.069 -5.115 1.00 61.92 ? 270 GLU A N 1 ATOM 1592 C CA . GLU A 1 259 ? -18.941 -20.212 -5.230 1.00 70.25 ? 270 GLU A CA 1 ATOM 1593 C C . GLU A 1 259 ? -20.128 -20.760 -4.446 1.00 60.83 ? 270 GLU A C 1 ATOM 1594 O O . GLU A 1 259 ? -20.873 -20.007 -3.822 1.00 68.61 ? 270 GLU A O 1 ATOM 1595 C CB . GLU A 1 259 ? -19.322 -20.028 -6.702 1.00 75.31 ? 270 GLU A CB 1 ATOM 1596 C CG . GLU A 1 259 ? -20.478 -19.062 -6.940 1.00 82.21 ? 270 GLU A CG 1 ATOM 1597 C CD . GLU A 1 259 ? -20.097 -17.609 -6.706 1.00 93.35 ? 270 GLU A CD 1 ATOM 1598 O OE1 . GLU A 1 259 ? -18.897 -17.322 -6.496 1.00 95.41 ? 270 GLU A OE1 1 ATOM 1599 O OE2 . GLU A 1 259 ? -21.006 -16.751 -6.738 1.00 90.72 ? 270 GLU A OE2 1 ATOM 1600 N N . THR A 1 260 ? -20.292 -22.076 -4.474 1.00 53.19 ? 271 THR A N 1 ATOM 1601 C CA . THR A 1 260 ? -21.408 -22.714 -3.789 1.00 64.74 ? 271 THR A CA 1 ATOM 1602 C C . THR A 1 260 ? -21.051 -23.140 -2.364 1.00 67.06 ? 271 THR A C 1 ATOM 1603 O O . THR A 1 260 ? -21.906 -23.143 -1.477 1.00 65.89 ? 271 THR A O 1 ATOM 1604 C CB . THR A 1 260 ? -21.933 -23.935 -4.582 1.00 68.66 ? 271 THR A CB 1 ATOM 1605 O OG1 . THR A 1 260 ? -20.830 -24.739 -5.016 1.00 67.33 ? 271 THR A OG1 1 ATOM 1606 C CG2 . THR A 1 260 ? -22.714 -23.481 -5.801 1.00 45.35 ? 271 THR A CG2 1 ATOM 1607 N N . CYS A 1 261 ? -19.785 -23.482 -2.147 1.00 51.12 ? 272 CYS A N 1 ATOM 1608 C CA . CYS A 1 261 ? -19.347 -24.051 -0.877 1.00 49.70 ? 272 CYS A CA 1 ATOM 1609 C C . CYS A 1 261 ? -19.028 -23.006 0.185 1.00 62.32 ? 272 CYS A C 1 ATOM 1610 O O . CYS A 1 261 ? -18.938 -23.329 1.370 1.00 61.95 ? 272 CYS A O 1 ATOM 1611 C CB . CYS A 1 261 ? -18.137 -24.965 -1.089 1.00 51.07 ? 272 CYS A CB 1 ATOM 1612 S SG . CYS A 1 261 ? -18.540 -26.586 -1.791 1.00 65.28 ? 272 CYS A SG 1 ATOM 1613 N N . LYS A 1 262 ? -18.861 -21.757 -0.232 1.00 59.53 ? 273 LYS A N 1 ATOM 1614 C CA . LYS A 1 262 ? -18.515 -20.691 0.702 1.00 61.33 ? 273 LYS A CA 1 ATOM 1615 C C . LYS A 1 262 ? -19.695 -20.350 1.613 1.00 64.29 ? 273 LYS A C 1 ATOM 1616 O O . LYS A 1 262 ? -19.559 -19.592 2.573 1.00 66.48 ? 273 LYS A O 1 ATOM 1617 C CB . LYS A 1 262 ? -18.047 -19.451 -0.057 1.00 54.72 ? 273 LYS A CB 1 ATOM 1618 C CG . LYS A 1 262 ? -19.101 -18.857 -0.962 1.00 55.04 ? 273 LYS A CG 1 ATOM 1619 C CD . LYS A 1 262 ? -18.550 -17.672 -1.734 1.00 69.22 ? 273 LYS A CD 1 ATOM 1620 C CE . LYS A 1 262 ? -19.639 -16.980 -2.538 1.00 76.20 ? 273 LYS A CE 1 ATOM 1621 N NZ . LYS A 1 262 ? -19.084 -15.869 -3.357 1.00 78.91 ? 273 LYS A NZ 1 ATOM 1622 N N . ALA A 1 263 ? -20.851 -20.929 1.306 1.00 54.66 ? 274 ALA A N 1 ATOM 1623 C CA . ALA A 1 263 ? -22.057 -20.723 2.091 1.00 48.29 ? 274 ALA A CA 1 ATOM 1624 C C . ALA A 1 263 ? -21.974 -21.424 3.446 1.00 61.83 ? 274 ALA A C 1 ATOM 1625 O O . ALA A 1 263 ? -22.779 -21.167 4.343 1.00 71.12 ? 274 ALA A O 1 ATOM 1626 C CB . ALA A 1 263 ? -23.272 -21.204 1.311 1.00 46.86 ? 274 ALA A CB 1 ATOM 1627 N N . ASN A 1 264 ? -20.999 -22.313 3.593 1.00 57.56 ? 275 ASN A N 1 ATOM 1628 C CA . ASN A 1 264 ? -20.817 -23.022 4.851 1.00 54.95 ? 275 ASN A CA 1 ATOM 1629 C C . ASN A 1 264 ? -19.377 -22.953 5.329 1.00 58.28 ? 275 ASN A C 1 ATOM 1630 O O . ASN A 1 264 ? -18.674 -23.964 5.331 1.00 51.40 ? 275 ASN A O 1 ATOM 1631 C CB . ASN A 1 264 ? -21.249 -24.482 4.707 1.00 59.29 ? 275 ASN A CB 1 ATOM 1632 C CG . ASN A 1 264 ? -22.601 -24.622 4.038 1.00 84.39 ? 275 ASN A CG 1 ATOM 1633 O OD1 . ASN A 1 264 ? -22.689 -24.840 2.829 1.00 92.37 ? 275 ASN A OD1 1 ATOM 1634 N ND2 . ASN A 1 264 ? -23.664 -24.484 4.821 1.00 92.90 ? 275 ASN A ND2 1 ATOM 1635 N N . PRO A 1 265 ? -18.929 -21.758 5.741 1.00 60.10 ? 276 PRO A N 1 ATOM 1636 C CA . PRO A 1 265 ? -17.540 -21.614 6.180 1.00 47.14 ? 276 PRO A CA 1 ATOM 1637 C C . PRO A 1 265 ? -17.301 -22.228 7.550 1.00 46.70 ? 276 PRO A C 1 ATOM 1638 O O . PRO A 1 265 ? -18.222 -22.368 8.354 1.00 53.87 ? 276 PRO A O 1 ATOM 1639 C CB . PRO A 1 265 ? -17.352 -20.099 6.249 1.00 41.57 ? 276 PRO A CB 1 ATOM 1640 C CG . PRO A 1 265 ? -18.711 -19.577 6.536 1.00 43.47 ? 276 PRO A CG 1 ATOM 1641 C CD . PRO A 1 265 ? -19.673 -20.489 5.834 1.00 55.39 ? 276 PRO A CD 1 ATOM 1642 N N . LYS A 1 266 ? -16.056 -22.609 7.795 1.00 51.87 ? 277 LYS A N 1 ATOM 1643 C CA . LYS A 1 266 ? -15.621 -22.994 9.123 1.00 48.29 ? 277 LYS A CA 1 ATOM 1644 C C . LYS A 1 266 ? -14.874 -21.805 9.715 1.00 49.62 ? 277 LYS A C 1 ATOM 1645 O O . LYS A 1 266 ? -14.381 -20.954 8.975 1.00 53.44 ? 277 LYS A O 1 ATOM 1646 C CB . LYS A 1 266 ? -14.731 -24.233 9.044 1.00 42.82 ? 277 LYS A CB 1 ATOM 1647 C CG . LYS A 1 266 ? -15.523 -25.531 8.943 1.00 54.10 ? 277 LYS A CG 1 ATOM 1648 C CD . LYS A 1 266 ? -14.726 -26.662 8.306 1.00 55.34 ? 277 LYS A CD 1 ATOM 1649 C CE . LYS A 1 266 ? -13.329 -26.773 8.877 1.00 55.62 ? 277 LYS A CE 1 ATOM 1650 N NZ . LYS A 1 266 ? -12.615 -27.953 8.316 1.00 51.04 ? 277 LYS A NZ 1 ATOM 1651 N N . LYS A 1 267 ? -14.808 -21.721 11.038 1.00 41.65 ? 278 LYS A N 1 ATOM 1652 C CA . LYS A 1 267 ? -14.113 -20.602 11.670 1.00 52.34 ? 278 LYS A CA 1 ATOM 1653 C C . LYS A 1 267 ? -12.733 -21.009 12.168 1.00 45.72 ? 278 LYS A C 1 ATOM 1654 O O . LYS A 1 267 ? -12.524 -22.152 12.573 1.00 52.55 ? 278 LYS A O 1 ATOM 1655 C CB . LYS A 1 267 ? -14.947 -20.000 12.805 1.00 53.21 ? 278 LYS A CB 1 ATOM 1656 C CG . LYS A 1 267 ? -14.992 -18.475 12.780 1.00 51.56 ? 278 LYS A CG 1 ATOM 1657 C CD . LYS A 1 267 ? -15.988 -17.924 13.785 1.00 72.03 ? 278 LYS A CD 1 ATOM 1658 C CE . LYS A 1 267 ? -15.951 -16.407 13.816 1.00 79.23 ? 278 LYS A CE 1 ATOM 1659 N NZ . LYS A 1 267 ? -14.565 -15.895 13.977 1.00 81.79 ? 278 LYS A NZ 1 ATOM 1660 N N . ASP A 1 268 ? -11.787 -20.076 12.124 1.00 52.85 ? 279 ASP A N 1 ATOM 1661 C CA . ASP A 1 268 ? -10.419 -20.362 12.548 1.00 52.70 ? 279 ASP A CA 1 ATOM 1662 C C . ASP A 1 268 ? -10.357 -20.743 14.021 1.00 58.69 ? 279 ASP A C 1 ATOM 1663 O O . ASP A 1 268 ? -11.331 -20.612 14.760 1.00 68.78 ? 279 ASP A O 1 ATOM 1664 C CB . ASP A 1 268 ? -9.495 -19.164 12.301 1.00 50.43 ? 279 ASP A CB 1 ATOM 1665 C CG . ASP A 1 268 ? -8.943 -19.121 10.886 1.00 63.29 ? 279 ASP A CG 1 ATOM 1666 O OD1 . ASP A 1 268 ? -7.703 -19.065 10.732 1.00 59.16 ? 279 ASP A OD1 1 ATOM 1667 O OD2 . ASP A 1 268 ? -9.746 -19.120 9.930 1.00 72.99 ? 279 ASP A OD2 1 ATOM 1668 N N . VAL A 1 269 ? -9.190 -21.202 14.441 1.00 49.64 ? 280 VAL A N 1 ATOM 1669 C CA . VAL A 1 269 ? -8.980 -21.606 15.816 1.00 39.58 ? 280 VAL A CA 1 ATOM 1670 C C . VAL A 1 269 ? -7.731 -20.893 16.355 1.00 51.75 ? 280 VAL A C 1 ATOM 1671 O O . VAL A 1 269 ? -6.791 -20.626 15.604 1.00 47.69 ? 280 VAL A O 1 ATOM 1672 C CB . VAL A 1 269 ? -8.850 -23.145 15.891 1.00 39.06 ? 280 VAL A CB 1 ATOM 1673 C CG1 . VAL A 1 269 ? -7.403 -23.578 16.099 1.00 41.11 ? 280 VAL A CG1 1 ATOM 1674 C CG2 . VAL A 1 269 ? -9.753 -23.702 16.958 1.00 40.87 ? 280 VAL A CG2 1 ATOM 1675 N N . VAL A 1 270 ? -7.734 -20.528 17.632 1.00 40.63 ? 281 VAL A N 1 ATOM 1676 C CA . VAL A 1 270 ? -6.509 -20.010 18.245 1.00 55.48 ? 281 VAL A CA 1 ATOM 1677 C C . VAL A 1 270 ? -6.208 -20.726 19.547 1.00 57.85 ? 281 VAL A C 1 ATOM 1678 O O . VAL A 1 270 ? -7.069 -21.396 20.119 1.00 62.18 ? 281 VAL A O 1 ATOM 1679 C CB . VAL A 1 270 ? -6.523 -18.480 18.485 1.00 41.57 ? 281 VAL A CB 1 ATOM 1680 C CG1 . VAL A 1 270 ? -6.424 -17.735 17.169 1.00 162.00 ? 281 VAL A CG1 1 ATOM 1681 C CG2 . VAL A 1 270 ? -7.758 -18.061 19.261 1.00 43.77 ? 281 VAL A CG2 1 ATOM 1682 N N . GLY A 1 271 ? -4.972 -20.585 20.003 1.00 47.44 ? 282 GLY A N 1 ATOM 1683 C CA . GLY A 1 271 ? -4.554 -21.218 21.231 1.00 51.30 ? 282 GLY A CA 1 ATOM 1684 C C . GLY A 1 271 ? -4.605 -20.297 22.430 1.00 69.38 ? 282 GLY A C 1 ATOM 1685 O O . GLY A 1 271 ? -4.056 -19.195 22.414 1.00 63.92 ? 282 GLY A O 1 ATOM 1686 N N . LYS A 1 272 ? -5.295 -20.756 23.467 1.00 80.30 ? 283 LYS A N 1 ATOM 1687 C CA . LYS A 1 272 ? -5.155 -20.210 24.807 1.00 76.88 ? 283 LYS A CA 1 ATOM 1688 C C . LYS A 1 272 ? -4.706 -21.382 25.670 1.00 74.74 ? 283 LYS A C 1 ATOM 1689 O O . LYS A 1 272 ? -5.174 -22.503 25.479 1.00 70.40 ? 283 LYS A O 1 ATOM 1690 C CB . LYS A 1 272 ? -6.485 -19.648 25.313 1.00 73.32 ? 283 LYS A CB 1 ATOM 1691 C CG . LYS A 1 272 ? -7.643 -20.637 25.259 1.00 72.24 ? 283 LYS A CG 1 ATOM 1692 C CD . LYS A 1 272 ? -8.518 -20.557 26.504 1.00 78.00 ? 283 LYS A CD 1 ATOM 1693 C CE . LYS A 1 272 ? -9.241 -19.220 26.603 1.00 86.17 ? 283 LYS A CE 1 ATOM 1694 N NZ . LYS A 1 272 ? -10.131 -19.152 27.799 1.00 85.34 ? 283 LYS A NZ 1 ATOM 1695 N N . ASP A 1 273 ? -3.778 -21.163 26.592 1.00 73.66 ? 284 ASP A N 1 ATOM 1696 C CA . ASP A 1 273 ? -3.364 -22.278 27.434 1.00 74.09 ? 284 ASP A CA 1 ATOM 1697 C C . ASP A 1 273 ? -4.294 -22.429 28.628 1.00 67.94 ? 284 ASP A C 1 ATOM 1698 O O . ASP A 1 273 ? -5.024 -21.501 28.969 1.00 52.51 ? 284 ASP A O 1 ATOM 1699 C CB . ASP A 1 273 ? -1.886 -22.198 27.850 1.00 78.88 ? 284 ASP A CB 1 ATOM 1700 C CG . ASP A 1 273 ? -1.458 -20.806 28.245 1.00 79.10 ? 284 ASP A CG 1 ATOM 1701 O OD1 . ASP A 1 273 ? -0.261 -20.486 28.076 1.00 74.15 ? 284 ASP A OD1 1 ATOM 1702 O OD2 . ASP A 1 273 ? -2.312 -20.035 28.726 1.00 91.59 ? 284 ASP A OD2 1 ATOM 1703 N N . GLU A 1 274 ? -4.297 -23.614 29.232 1.00 50.96 ? 285 GLU A N 1 ATOM 1704 C CA . GLU A 1 274 ? -5.125 -23.851 30.404 1.00 87.64 ? 285 GLU A CA 1 ATOM 1705 C C . GLU A 1 274 ? -4.332 -24.513 31.531 1.00 85.87 ? 285 GLU A C 1 ATOM 1706 O O . GLU A 1 274 ? -3.523 -25.410 31.290 1.00 80.92 ? 285 GLU A O 1 ATOM 1707 C CB . GLU A 1 274 ? -6.378 -24.656 30.044 1.00 53.98 ? 285 GLU A CB 1 ATOM 1708 C CG . GLU A 1 274 ? -6.139 -26.116 29.726 1.00 98.06 ? 285 GLU A CG 1 ATOM 1709 C CD . GLU A 1 274 ? -7.437 -26.894 29.567 1.00 99.65 ? 285 GLU A CD 1 ATOM 1710 O OE1 . GLU A 1 274 ? -8.466 -26.279 29.208 1.00 95.18 ? 285 GLU A OE1 1 ATOM 1711 O OE2 . GLU A 1 274 ? -7.431 -28.121 29.807 1.00 97.90 ? 285 GLU A OE2 1 ATOM 1712 N N . ARG A 1 275 ? -4.553 -24.038 32.755 1.00 88.08 ? 286 ARG A N 1 ATOM 1713 C CA . ARG A 1 275 ? -3.887 -24.585 33.931 1.00 87.84 ? 286 ARG A CA 1 ATOM 1714 C C . ARG A 1 275 ? -4.219 -26.055 34.108 1.00 81.72 ? 286 ARG A C 1 ATOM 1715 O O . ARG A 1 275 ? -5.379 -26.456 34.034 1.00 80.94 ? 286 ARG A O 1 ATOM 1716 C CB . ARG A 1 275 ? -4.295 -23.819 35.191 1.00 102.65 ? 286 ARG A CB 1 ATOM 1717 C CG . ARG A 1 275 ? -3.496 -22.551 35.457 1.00 108.17 ? 286 ARG A CG 1 ATOM 1718 C CD . ARG A 1 275 ? -2.312 -22.810 36.380 1.00 93.63 ? 286 ARG A CD 1 ATOM 1719 N NE . ARG A 1 275 ? -1.036 -22.585 35.706 1.00 100.78 ? 286 ARG A NE 1 ATOM 1720 C CZ . ARG A 1 275 ? 0.142 -22.559 36.321 1.00 113.32 ? 286 ARG A CZ 1 ATOM 1721 N NH1 . ARG A 1 275 ? 0.212 -22.739 37.633 1.00 120.15 ? 286 ARG A NH1 1 ATOM 1722 N NH2 . ARG A 1 275 ? 1.252 -22.348 35.625 1.00 109.78 ? 286 ARG A NH2 1 ATOM 1723 N N . GLN A 1 276 ? -3.187 -26.857 34.333 1.00 80.17 ? 287 GLN A N 1 ATOM 1724 C CA . GLN A 1 276 ? -3.368 -28.273 34.607 1.00 82.70 ? 287 GLN A CA 1 ATOM 1725 C C . GLN A 1 276 ? -2.519 -28.671 35.807 1.00 83.68 ? 287 GLN A C 1 ATOM 1726 O O . GLN A 1 276 ? -1.418 -28.160 35.998 1.00 76.88 ? 287 GLN A O 1 ATOM 1727 C CB . GLN A 1 276 ? -3.002 -29.114 33.384 1.00 81.21 ? 287 GLN A CB 1 ATOM 1728 C CG . GLN A 1 276 ? -3.886 -28.858 32.178 1.00 87.73 ? 287 GLN A CG 1 ATOM 1729 C CD . GLN A 1 276 ? -3.733 -29.925 31.119 1.00 103.92 ? 287 GLN A CD 1 ATOM 1730 O OE1 . GLN A 1 276 ? -3.125 -30.969 31.362 1.00 114.06 ? 287 GLN A OE1 1 ATOM 1731 N NE2 . GLN A 1 276 ? -4.284 -29.672 29.935 1.00 102.19 ? 287 GLN A NE2 1 ATOM 1732 N N . THR A 1 277 ? -3.038 -29.579 36.620 1.00 82.55 ? 288 THR A N 1 ATOM 1733 C CA . THR A 1 277 ? -2.322 -30.015 37.804 1.00 78.14 ? 288 THR A CA 1 ATOM 1734 C C . THR A 1 277 ? -2.023 -31.507 37.740 1.00 80.49 ? 288 THR A C 1 ATOM 1735 O O . THR A 1 277 ? -2.917 -32.318 37.510 1.00 89.40 ? 288 THR A O 1 ATOM 1736 C CB . THR A 1 277 ? -3.124 -29.700 39.072 1.00 92.03 ? 288 THR A CB 1 ATOM 1737 O OG1 . THR A 1 277 ? -3.185 -28.280 39.258 1.00 99.96 ? 288 THR A OG1 1 ATOM 1738 C CG2 . THR A 1 277 ? -2.475 -30.335 40.285 1.00 92.29 ? 288 THR A CG2 1 ATOM 1739 N N . VAL A 1 278 ? -0.759 -31.866 37.934 1.00 58.66 ? 289 VAL A N 1 ATOM 1740 C CA . VAL A 1 278 ? -0.367 -33.271 37.946 1.00 77.09 ? 289 VAL A CA 1 ATOM 1741 C C . VAL A 1 278 ? 0.460 -33.611 39.180 1.00 79.84 ? 289 VAL A C 1 ATOM 1742 O O . VAL A 1 278 ? 0.841 -32.729 39.949 1.00 81.48 ? 289 VAL A O 1 ATOM 1743 C CB . VAL A 1 278 ? 0.436 -33.644 36.690 1.00 74.27 ? 289 VAL A CB 1 ATOM 1744 C CG1 . VAL A 1 278 ? -0.396 -33.411 35.442 1.00 53.52 ? 289 VAL A CG1 1 ATOM 1745 C CG2 . VAL A 1 278 ? 1.728 -32.846 36.635 1.00 78.48 ? 289 VAL A CG2 1 ATOM 1746 N N . SER A 1 279 ? 0.730 -34.898 39.370 1.00 79.62 ? 290 SER A N 1 ATOM 1747 C CA . SER A 1 279 ? 1.586 -35.332 40.463 1.00 84.90 ? 290 SER A CA 1 ATOM 1748 C C . SER A 1 279 ? 3.010 -34.911 40.157 1.00 88.19 ? 290 SER A C 1 ATOM 1749 O O . SER A 1 279 ? 3.355 -34.676 38.999 1.00 87.41 ? 290 SER A O 1 ATOM 1750 C CB . SER A 1 279 ? 1.528 -36.849 40.629 1.00 88.99 ? 290 SER A CB 1 ATOM 1751 O OG . SER A 1 279 ? 2.545 -37.481 39.871 1.00 88.16 ? 290 SER A OG 1 ATOM 1752 N N . THR A 1 280 ? 3.837 -34.819 41.192 1.00 83.86 ? 291 THR A N 1 ATOM 1753 C CA . THR A 1 280 ? 5.234 -34.452 41.009 1.00 74.70 ? 291 THR A CA 1 ATOM 1754 C C . THR A 1 280 ? 5.957 -35.468 40.132 1.00 70.96 ? 291 THR A C 1 ATOM 1755 O O . THR A 1 280 ? 6.902 -35.126 39.427 1.00 65.03 ? 291 THR A O 1 ATOM 1756 C CB . THR A 1 280 ? 5.969 -34.321 42.353 1.00 75.11 ? 291 THR A CB 1 ATOM 1757 O OG1 . THR A 1 280 ? 5.496 -35.328 43.254 1.00 84.98 ? 291 THR A OG1 1 ATOM 1758 C CG2 . THR A 1 280 ? 5.725 -32.952 42.959 1.00 78.62 ? 291 THR A CG2 1 ATOM 1759 N N . ARG A 1 281 ? 5.502 -36.716 40.174 1.00 72.65 ? 292 ARG A N 1 ATOM 1760 C CA . ARG A 1 281 ? 6.126 -37.777 39.396 1.00 69.13 ? 292 ARG A CA 1 ATOM 1761 C C . ARG A 1 281 ? 5.855 -37.598 37.909 1.00 64.29 ? 292 ARG A C 1 ATOM 1762 O O . ARG A 1 281 ? 6.700 -37.929 37.077 1.00 66.73 ? 292 ARG A O 1 ATOM 1763 C CB . ARG A 1 281 ? 5.638 -39.154 39.860 1.00 61.27 ? 292 ARG A CB 1 ATOM 1764 N N . ASP A 1 282 ? 4.681 -37.063 37.583 1.00 69.29 ? 293 ASP A N 1 ATOM 1765 C CA . ASP A 1 282 ? 4.250 -36.933 36.190 1.00 77.31 ? 293 ASP A CA 1 ATOM 1766 C C . ASP A 1 282 ? 4.632 -35.605 35.539 1.00 71.29 ? 293 ASP A C 1 ATOM 1767 O O . ASP A 1 282 ? 4.652 -35.501 34.314 1.00 67.59 ? 293 ASP A O 1 ATOM 1768 C CB . ASP A 1 282 ? 2.741 -37.164 36.062 1.00 77.56 ? 293 ASP A CB 1 ATOM 1769 C CG . ASP A 1 282 ? 2.366 -38.631 36.164 1.00 82.95 ? 293 ASP A CG 1 ATOM 1770 O OD1 . ASP A 1 282 ? 1.279 -38.936 36.702 1.00 77.76 ? 293 ASP A OD1 1 ATOM 1771 O OD2 . ASP A 1 282 ? 3.163 -39.480 35.705 1.00 75.03 ? 293 ASP A OD2 1 ATOM 1772 N N . TYR A 1 283 ? 4.934 -34.602 36.357 1.00 62.30 ? 294 TYR A N 1 ATOM 1773 C CA . TYR A 1 283 ? 5.307 -33.277 35.865 1.00 54.38 ? 294 TYR A CA 1 ATOM 1774 C C . TYR A 1 283 ? 6.556 -33.288 34.989 1.00 64.40 ? 294 TYR A C 1 ATOM 1775 O O . TYR A 1 283 ? 7.561 -33.913 35.331 1.00 59.88 ? 294 TYR A O 1 ATOM 1776 C CB . TYR A 1 283 ? 5.518 -32.322 37.042 1.00 66.48 ? 294 TYR A CB 1 ATOM 1777 C CG . TYR A 1 283 ? 6.208 -31.014 36.702 1.00 69.71 ? 294 TYR A CG 1 ATOM 1778 C CD1 . TYR A 1 283 ? 7.592 -30.900 36.754 1.00 73.46 ? 294 TYR A CD1 1 ATOM 1779 C CD2 . TYR A 1 283 ? 5.476 -29.887 36.362 1.00 74.80 ? 294 TYR A CD2 1 ATOM 1780 C CE1 . TYR A 1 283 ? 8.224 -29.711 36.456 1.00 74.12 ? 294 TYR A CE1 1 ATOM 1781 C CE2 . TYR A 1 283 ? 6.104 -28.689 36.063 1.00 79.09 ? 294 TYR A CE2 1 ATOM 1782 C CZ . TYR A 1 283 ? 7.478 -28.610 36.113 1.00 73.79 ? 294 TYR A CZ 1 ATOM 1783 O OH . TYR A 1 283 ? 8.114 -27.425 35.820 1.00 73.19 ? 294 TYR A OH 1 ATOM 1784 N N . THR A 1 284 ? 6.481 -32.583 33.863 1.00 68.63 ? 295 THR A N 1 ATOM 1785 C CA . THR A 1 284 ? 7.649 -32.332 33.029 1.00 55.15 ? 295 THR A CA 1 ATOM 1786 C C . THR A 1 284 ? 7.912 -30.833 32.990 1.00 59.61 ? 295 THR A C 1 ATOM 1787 O O . THR A 1 284 ? 6.984 -30.042 32.821 1.00 59.90 ? 295 THR A O 1 ATOM 1788 C CB . THR A 1 284 ? 7.464 -32.859 31.593 1.00 62.56 ? 295 THR A CB 1 ATOM 1789 O OG1 . THR A 1 284 ? 6.356 -32.197 30.974 1.00 67.97 ? 295 THR A OG1 1 ATOM 1790 C CG2 . THR A 1 284 ? 7.212 -34.356 31.601 1.00 67.18 ? 295 THR A CG2 1 ATOM 1791 N N . GLY A 1 285 ? 9.174 -30.445 33.158 1.00 51.91 ? 296 GLY A N 1 ATOM 1792 C CA . GLY A 1 285 ? 9.544 -29.040 33.171 1.00 45.78 ? 296 GLY A CA 1 ATOM 1793 C C . GLY A 1 285 ? 10.763 -28.748 34.026 1.00 45.88 ? 296 GLY A C 1 ATOM 1794 O O . GLY A 1 285 ? 11.323 -29.658 34.636 1.00 61.11 ? 296 GLY A O 1 ATOM 1795 N N . PRO A 1 286 ? 11.177 -27.472 34.078 1.00 48.15 ? 297 PRO A N 1 ATOM 1796 C CA . PRO A 1 286 ? 12.344 -26.989 34.829 1.00 67.99 ? 297 PRO A CA 1 ATOM 1797 C C . PRO A 1 286 ? 12.253 -27.193 36.343 1.00 72.60 ? 297 PRO A C 1 ATOM 1798 O O . PRO A 1 286 ? 13.241 -27.587 36.962 1.00 75.58 ? 297 PRO A O 1 ATOM 1799 C CB . PRO A 1 286 ? 12.367 -25.487 34.514 1.00 47.25 ? 297 PRO A CB 1 ATOM 1800 C CG . PRO A 1 286 ? 10.974 -25.163 34.115 1.00 52.27 ? 297 PRO A CG 1 ATOM 1801 C CD . PRO A 1 286 ? 10.498 -26.373 33.373 1.00 55.93 ? 297 PRO A CD 1 ATOM 1802 N N . ASN A 1 287 ? 11.093 -26.918 36.930 1.00 78.71 ? 298 ASN A N 1 ATOM 1803 C CA . ASN A 1 287 ? 10.928 -27.022 38.379 1.00 81.93 ? 298 ASN A CA 1 ATOM 1804 C C . ASN A 1 287 ? 10.571 -28.437 38.812 1.00 76.98 ? 298 ASN A C 1 ATOM 1805 O O . ASN A 1 287 ? 9.460 -28.704 39.271 1.00 82.99 ? 298 ASN A O 1 ATOM 1806 C CB . ASN A 1 287 ? 9.873 -26.032 38.864 1.00 87.98 ? 298 ASN A CB 1 ATOM 1807 C CG . ASN A 1 287 ? 10.205 -24.604 38.488 1.00 89.06 ? 298 ASN A CG 1 ATOM 1808 O OD1 . ASN A 1 287 ? 11.324 -24.137 38.705 1.00 89.70 ? 298 ASN A OD1 1 ATOM 1809 N ND2 . ASN A 1 287 ? 9.237 -23.905 37.907 1.00 92.49 ? 298 ASN A ND2 1 ATOM 1810 N N . ARG A 1 288 ? 11.534 -29.338 38.667 1.00 71.59 ? 299 ARG A N 1 ATOM 1811 C CA . ARG A 1 288 ? 11.311 -30.759 38.881 1.00 66.68 ? 299 ARG A CA 1 ATOM 1812 C C . ARG A 1 288 ? 11.684 -31.194 40.305 1.00 69.89 ? 299 ARG A C 1 ATOM 1813 O O . ARG A 1 288 ? 12.699 -30.758 40.855 1.00 74.45 ? 299 ARG A O 1 ATOM 1814 C CB . ARG A 1 288 ? 12.105 -31.547 37.837 1.00 69.97 ? 299 ARG A CB 1 ATOM 1815 C CG . ARG A 1 288 ? 11.972 -33.040 37.952 1.00 75.67 ? 299 ARG A CG 1 ATOM 1816 C CD . ARG A 1 288 ? 11.211 -33.644 36.788 1.00 58.54 ? 299 ARG A CD 1 ATOM 1817 N NE . ARG A 1 288 ? 11.100 -35.088 36.970 1.00 67.31 ? 299 ARG A NE 1 ATOM 1818 C CZ . ARG A 1 288 ? 9.960 -35.726 37.203 1.00 67.57 ? 299 ARG A CZ 1 ATOM 1819 N NH1 . ARG A 1 288 ? 8.825 -35.047 37.256 1.00 72.72 ? 299 ARG A NH1 1 ATOM 1820 N NH2 . ARG A 1 288 ? 9.952 -37.042 37.367 1.00 60.52 ? 299 ARG A NH2 1 ATOM 1821 N N . PHE A 1 289 ? 10.857 -32.054 40.896 1.00 63.39 ? 300 PHE A N 1 ATOM 1822 C CA . PHE A 1 289 ? 11.036 -32.478 42.287 1.00 67.53 ? 300 PHE A CA 1 ATOM 1823 C C . PHE A 1 289 ? 11.650 -33.869 42.449 1.00 62.02 ? 300 PHE A C 1 ATOM 1824 O O . PHE A 1 289 ? 12.088 -34.238 43.537 1.00 69.71 ? 300 PHE A O 1 ATOM 1825 C CB . PHE A 1 289 ? 9.699 -32.426 43.028 1.00 58.53 ? 300 PHE A CB 1 ATOM 1826 C CG . PHE A 1 289 ? 9.294 -31.046 43.435 1.00 69.57 ? 300 PHE A CG 1 ATOM 1827 C CD1 . PHE A 1 289 ? 9.520 -30.598 44.729 1.00 63.12 ? 300 PHE A CD1 1 ATOM 1828 C CD2 . PHE A 1 289 ? 8.705 -30.188 42.524 1.00 59.53 ? 300 PHE A CD2 1 ATOM 1829 C CE1 . PHE A 1 289 ? 9.154 -29.322 45.111 1.00 74.19 ? 300 PHE A CE1 1 ATOM 1830 C CE2 . PHE A 1 289 ? 8.341 -28.911 42.899 1.00 77.23 ? 300 PHE A CE2 1 ATOM 1831 C CZ . PHE A 1 289 ? 8.564 -28.477 44.196 1.00 71.24 ? 300 PHE A CZ 1 ATOM 1832 N N . LEU A 1 290 ? 11.678 -34.631 41.363 1.00 63.35 ? 301 LEU A N 1 ATOM 1833 C CA . LEU A 1 290 ? 12.126 -36.015 41.395 1.00 66.89 ? 301 LEU A CA 1 ATOM 1834 C C . LEU A 1 290 ? 13.213 -36.267 40.354 1.00 70.47 ? 301 LEU A C 1 ATOM 1835 O O . LEU A 1 290 ? 13.256 -35.606 39.317 1.00 82.88 ? 301 LEU A O 1 ATOM 1836 C CB . LEU A 1 290 ? 10.938 -36.939 41.130 1.00 73.20 ? 301 LEU A CB 1 ATOM 1837 C CG . LEU A 1 290 ? 10.293 -37.676 42.306 1.00 78.88 ? 301 LEU A CG 1 ATOM 1838 C CD1 . LEU A 1 290 ? 10.235 -36.809 43.553 1.00 75.76 ? 301 LEU A CD1 1 ATOM 1839 C CD2 . LEU A 1 290 ? 8.899 -38.149 41.915 1.00 82.26 ? 301 LEU A CD2 1 ATOM 1840 N N . ALA A 1 291 ? 14.085 -37.232 40.628 1.00 73.64 ? 302 ALA A N 1 ATOM 1841 C CA . ALA A 1 291 ? 15.133 -37.603 39.683 1.00 63.76 ? 302 ALA A CA 1 ATOM 1842 C C . ALA A 1 291 ? 14.521 -38.168 38.411 1.00 68.61 ? 302 ALA A C 1 ATOM 1843 O O . ALA A 1 291 ? 13.381 -38.638 38.416 1.00 67.70 ? 302 ALA A O 1 ATOM 1844 C CB . ALA A 1 291 ? 16.070 -38.612 40.302 1.00 47.87 ? 302 ALA A CB 1 ATOM 1845 N N . ASP A 1 292 ? 15.274 -38.106 37.319 1.00 66.46 ? 303 ASP A N 1 ATOM 1846 C CA . ASP A 1 292 ? 14.834 -38.718 36.074 1.00 64.32 ? 303 ASP A CA 1 ATOM 1847 C C . ASP A 1 292 ? 14.633 -40.208 36.311 1.00 54.34 ? 303 ASP A C 1 ATOM 1848 O O . ASP A 1 292 ? 15.440 -40.844 36.992 1.00 55.25 ? 303 ASP A O 1 ATOM 1849 C CB . ASP A 1 292 ? 15.861 -38.499 34.951 1.00 63.43 ? 303 ASP A CB 1 ATOM 1850 C CG . ASP A 1 292 ? 15.853 -37.073 34.404 1.00 69.54 ? 303 ASP A CG 1 ATOM 1851 O OD1 . ASP A 1 292 ? 14.793 -36.415 34.452 1.00 73.48 ? 303 ASP A OD1 1 ATOM 1852 O OD2 . ASP A 1 292 ? 16.908 -36.615 33.912 1.00 71.31 ? 303 ASP A OD2 1 ATOM 1853 N N . PRO A 1 293 ? 13.536 -40.763 35.775 1.00 51.92 ? 304 PRO A N 1 ATOM 1854 C CA . PRO A 1 293 ? 13.298 -42.208 35.792 1.00 46.19 ? 304 PRO A CA 1 ATOM 1855 C C . PRO A 1 293 ? 14.421 -42.959 35.096 1.00 51.24 ? 304 PRO A C 1 ATOM 1856 O O . PRO A 1 293 ? 14.738 -42.678 33.942 1.00 47.35 ? 304 PRO A O 1 ATOM 1857 C CB . PRO A 1 293 ? 11.991 -42.364 35.001 1.00 42.23 ? 304 PRO A CB 1 ATOM 1858 C CG . PRO A 1 293 ? 11.813 -41.073 34.269 1.00 45.37 ? 304 PRO A CG 1 ATOM 1859 C CD . PRO A 1 293 ? 12.421 -40.034 35.156 1.00 50.55 ? 304 PRO A CD 1 ATOM 1860 N N . LEU A 1 294 ? 15.015 -43.906 35.809 1.00 61.17 ? 305 LEU A N 1 ATOM 1861 C CA . LEU A 1 294 ? 16.094 -44.717 35.273 1.00 48.76 ? 305 LEU A CA 1 ATOM 1862 C C . LEU A 1 294 ? 15.630 -46.157 35.103 1.00 52.13 ? 305 LEU A C 1 ATOM 1863 O O . LEU A 1 294 ? 14.882 -46.680 35.927 1.00 68.20 ? 305 LEU A O 1 ATOM 1864 C CB . LEU A 1 294 ? 17.304 -44.659 36.209 1.00 44.59 ? 305 LEU A CB 1 ATOM 1865 C CG . LEU A 1 294 ? 18.448 -45.649 35.974 1.00 40.88 ? 305 LEU A CG 1 ATOM 1866 C CD1 . LEU A 1 294 ? 19.078 -45.455 34.604 1.00 41.75 ? 305 LEU A CD1 1 ATOM 1867 C CD2 . LEU A 1 294 ? 19.494 -45.516 37.062 1.00 45.73 ? 305 LEU A CD2 1 ATOM 1868 N N . SER A 1 295 ? 16.067 -46.787 34.021 1.00 48.09 ? 306 SER A N 1 ATOM 1869 C CA . SER A 1 295 ? 15.840 -48.209 33.814 1.00 53.47 ? 306 SER A CA 1 ATOM 1870 C C . SER A 1 295 ? 17.184 -48.904 33.593 1.00 53.88 ? 306 SER A C 1 ATOM 1871 O O . SER A 1 295 ? 17.796 -48.777 32.537 1.00 52.40 ? 306 SER A O 1 ATOM 1872 C CB . SER A 1 295 ? 14.903 -48.441 32.632 1.00 56.89 ? 306 SER A CB 1 ATOM 1873 O OG . SER A 1 295 ? 14.642 -49.821 32.463 1.00 66.16 ? 306 SER A OG 1 ATOM 1874 N N . TYR A 1 296 ? 17.633 -49.643 34.599 1.00 58.62 ? 307 TYR A N 1 ATOM 1875 C CA . TYR A 1 296 ? 18.986 -50.182 34.623 1.00 61.09 ? 307 TYR A CA 1 ATOM 1876 C C . TYR A 1 296 ? 19.016 -51.701 34.515 1.00 62.49 ? 307 TYR A C 1 ATOM 1877 O O . TYR A 1 296 ? 18.204 -52.395 35.127 1.00 63.73 ? 307 TYR A O 1 ATOM 1878 C CB . TYR A 1 296 ? 19.674 -49.739 35.912 1.00 64.43 ? 307 TYR A CB 1 ATOM 1879 C CG . TYR A 1 296 ? 20.968 -50.448 36.238 1.00 61.71 ? 307 TYR A CG 1 ATOM 1880 C CD1 . TYR A 1 296 ? 22.177 -49.980 35.750 1.00 56.92 ? 307 TYR A CD1 1 ATOM 1881 C CD2 . TYR A 1 296 ? 20.985 -51.562 37.070 1.00 66.12 ? 307 TYR A CD2 1 ATOM 1882 C CE1 . TYR A 1 296 ? 23.364 -50.612 36.061 1.00 62.89 ? 307 TYR A CE1 1 ATOM 1883 C CE2 . TYR A 1 296 ? 22.168 -52.202 37.386 1.00 58.70 ? 307 TYR A CE2 1 ATOM 1884 C CZ . TYR A 1 296 ? 23.356 -51.721 36.880 1.00 57.00 ? 307 TYR A CZ 1 ATOM 1885 O OH . TYR A 1 296 ? 24.545 -52.343 37.193 1.00 42.66 ? 307 TYR A OH 1 ATOM 1886 N N . GLU A 1 297 ? 19.962 -52.207 33.732 1.00 56.17 ? 308 GLU A N 1 ATOM 1887 C CA . GLU A 1 297 ? 20.160 -53.642 33.583 1.00 52.37 ? 308 GLU A CA 1 ATOM 1888 C C . GLU A 1 297 ? 21.638 -53.953 33.426 1.00 56.29 ? 308 GLU A C 1 ATOM 1889 O O . GLU A 1 297 ? 22.387 -53.179 32.838 1.00 54.33 ? 308 GLU A O 1 ATOM 1890 C CB . GLU A 1 297 ? 19.385 -54.195 32.384 1.00 54.86 ? 308 GLU A CB 1 ATOM 1891 C CG . GLU A 1 297 ? 17.877 -54.232 32.577 1.00 73.95 ? 308 GLU A CG 1 ATOM 1892 C CD . GLU A 1 297 ? 17.184 -55.198 31.634 1.00 87.02 ? 308 GLU A CD 1 ATOM 1893 O OE1 . GLU A 1 297 ? 17.870 -56.071 31.060 1.00 83.26 ? 308 GLU A OE1 1 ATOM 1894 O OE2 . GLU A 1 297 ? 15.950 -55.083 31.471 1.00 97.49 ? 308 GLU A OE2 1 ATOM 1895 N N . SER A 1 298 ? 22.052 -55.095 33.957 1.00 61.87 ? 309 SER A N 1 ATOM 1896 C CA . SER A 1 298 ? 23.439 -55.518 33.869 1.00 53.81 ? 309 SER A CA 1 ATOM 1897 C C . SER A 1 298 ? 23.489 -57.026 33.696 1.00 49.11 ? 309 SER A C 1 ATOM 1898 O O . SER A 1 298 ? 22.772 -57.752 34.378 1.00 51.86 ? 309 SER A O 1 ATOM 1899 C CB . SER A 1 298 ? 24.199 -55.101 35.132 1.00 58.76 ? 309 SER A CB 1 ATOM 1900 O OG . SER A 1 298 ? 25.535 -55.570 35.121 1.00 61.66 ? 309 SER A OG 1 ATOM 1901 N N . ARG A 1 299 ? 24.315 -57.489 32.763 1.00 46.01 ? 310 ARG A N 1 ATOM 1902 C CA . ARG A 1 299 ? 24.585 -58.915 32.597 1.00 46.27 ? 310 ARG A CA 1 ATOM 1903 C C . ARG A 1 299 ? 26.089 -59.110 32.493 1.00 52.06 ? 310 ARG A C 1 ATOM 1904 O O . ARG A 1 299 ? 26.759 -58.400 31.746 1.00 53.31 ? 310 ARG A O 1 ATOM 1905 C CB . ARG A 1 299 ? 23.918 -59.464 31.338 1.00 48.90 ? 310 ARG A CB 1 ATOM 1906 C CG . ARG A 1 299 ? 22.428 -59.208 31.242 1.00 63.80 ? 310 ARG A CG 1 ATOM 1907 C CD . ARG A 1 299 ? 21.953 -59.335 29.801 1.00 72.47 ? 310 ARG A CD 1 ATOM 1908 N NE . ARG A 1 299 ? 20.794 -58.489 29.538 1.00 91.13 ? 310 ARG A NE 1 ATOM 1909 C CZ . ARG A 1 299 ? 20.871 -57.220 29.147 1.00 102.91 ? 310 ARG A CZ 1 ATOM 1910 N NH1 . ARG A 1 299 ? 22.055 -56.647 28.969 1.00 87.42 ? 310 ARG A NH1 1 ATOM 1911 N NH2 . ARG A 1 299 ? 19.763 -56.523 28.932 1.00 114.40 ? 310 ARG A NH2 1 ATOM 1912 N N . SER A 1 300 ? 26.620 -60.075 33.234 1.00 60.90 ? 311 SER A N 1 ATOM 1913 C CA . SER A 1 300 ? 28.060 -60.287 33.267 1.00 55.86 ? 311 SER A CA 1 ATOM 1914 C C . SER A 1 300 ? 28.438 -61.764 33.210 1.00 64.67 ? 311 SER A C 1 ATOM 1915 O O . SER A 1 300 ? 27.900 -62.585 33.952 1.00 71.80 ? 311 SER A O 1 ATOM 1916 C CB . SER A 1 300 ? 28.657 -59.647 34.518 1.00 57.76 ? 311 SER A CB 1 ATOM 1917 O OG . SER A 1 300 ? 30.057 -59.835 34.559 1.00 66.31 ? 311 SER A OG 1 ATOM 1918 N N . TRP A 1 301 ? 29.370 -62.089 32.320 1.00 57.94 ? 312 TRP A N 1 ATOM 1919 C CA . TRP A 1 301 ? 29.908 -63.439 32.216 1.00 56.10 ? 312 TRP A CA 1 ATOM 1920 C C . TRP A 1 301 ? 31.404 -63.441 32.507 1.00 68.95 ? 312 TRP A C 1 ATOM 1921 O O . TRP A 1 301 ? 32.153 -62.623 31.968 1.00 75.23 ? 312 TRP A O 1 ATOM 1922 C CB . TRP A 1 301 ? 29.659 -64.017 30.824 1.00 59.19 ? 312 TRP A CB 1 ATOM 1923 C CG . TRP A 1 301 ? 28.246 -64.417 30.579 1.00 62.86 ? 312 TRP A CG 1 ATOM 1924 C CD1 . TRP A 1 301 ? 27.269 -63.665 29.997 1.00 66.46 ? 312 TRP A CD1 1 ATOM 1925 C CD2 . TRP A 1 301 ? 27.645 -65.673 30.908 1.00 61.99 ? 312 TRP A CD2 1 ATOM 1926 N NE1 . TRP A 1 301 ? 26.094 -64.374 29.945 1.00 67.51 ? 312 TRP A NE1 1 ATOM 1927 C CE2 . TRP A 1 301 ? 26.300 -65.612 30.496 1.00 64.31 ? 312 TRP A CE2 1 ATOM 1928 C CE3 . TRP A 1 301 ? 28.115 -66.844 31.510 1.00 75.61 ? 312 TRP A CE3 1 ATOM 1929 C CZ2 . TRP A 1 301 ? 25.417 -66.679 30.667 1.00 62.26 ? 312 TRP A CZ2 1 ATOM 1930 C CZ3 . TRP A 1 301 ? 27.237 -67.903 31.679 1.00 81.74 ? 312 TRP A CZ3 1 ATOM 1931 C CH2 . TRP A 1 301 ? 25.904 -67.811 31.260 1.00 79.03 ? 312 TRP A CH2 1 ATOM 1932 N N . LEU A 1 302 ? 31.830 -64.365 33.362 1.00 64.37 ? 313 LEU A N 1 ATOM 1933 C CA . LEU A 1 302 ? 33.243 -64.540 33.676 1.00 61.17 ? 313 LEU A CA 1 ATOM 1934 C C . LEU A 1 302 ? 33.618 -66.012 33.586 1.00 68.37 ? 313 LEU A C 1 ATOM 1935 O O . LEU A 1 302 ? 33.030 -66.851 34.269 1.00 66.57 ? 313 LEU A O 1 ATOM 1936 C CB . LEU A 1 302 ? 33.553 -64.025 35.079 1.00 69.05 ? 313 LEU A CB 1 ATOM 1937 C CG . LEU A 1 302 ? 34.967 -64.318 35.583 1.00 64.39 ? 313 LEU A CG 1 ATOM 1938 C CD1 . LEU A 1 302 ? 35.974 -63.511 34.802 1.00 67.17 ? 313 LEU A CD1 1 ATOM 1939 C CD2 . LEU A 1 302 ? 35.080 -64.016 37.058 1.00 66.60 ? 313 LEU A CD2 1 ATOM 1940 N N . PHE A 1 303 ? 34.591 -66.324 32.738 1.00 62.71 ? 314 PHE A N 1 ATOM 1941 C CA . PHE A 1 303 ? 35.073 -67.691 32.607 1.00 55.51 ? 314 PHE A CA 1 ATOM 1942 C C . PHE A 1 303 ? 36.588 -67.729 32.747 1.00 60.89 ? 314 PHE A C 1 ATOM 1943 O O . PHE A 1 303 ? 37.304 -66.957 32.100 1.00 59.17 ? 314 PHE A O 1 ATOM 1944 C CB . PHE A 1 303 ? 34.643 -68.304 31.272 1.00 57.75 ? 314 PHE A CB 1 ATOM 1945 C CG . PHE A 1 303 ? 35.070 -69.732 31.100 1.00 67.02 ? 314 PHE A CG 1 ATOM 1946 C CD1 . PHE A 1 303 ? 34.402 -70.752 31.755 1.00 70.29 ? 314 PHE A CD1 1 ATOM 1947 C CD2 . PHE A 1 303 ? 36.140 -70.056 30.286 1.00 65.85 ? 314 PHE A CD2 1 ATOM 1948 C CE1 . PHE A 1 303 ? 34.794 -72.068 31.601 1.00 68.42 ? 314 PHE A CE1 1 ATOM 1949 C CE2 . PHE A 1 303 ? 36.536 -71.373 30.128 1.00 74.33 ? 314 PHE A CE2 1 ATOM 1950 C CZ . PHE A 1 303 ? 35.864 -72.377 30.787 1.00 69.06 ? 314 PHE A CZ 1 ATOM 1951 N N . ARG A 1 304 ? 37.075 -68.627 33.597 1.00 60.97 ? 315 ARG A N 1 ATOM 1952 C CA . ARG A 1 304 ? 38.499 -68.688 33.883 1.00 57.80 ? 315 ARG A CA 1 ATOM 1953 C C . ARG A 1 304 ? 39.003 -70.117 34.044 1.00 62.73 ? 315 ARG A C 1 ATOM 1954 O O . ARG A 1 304 ? 39.010 -70.658 35.150 1.00 67.40 ? 315 ARG A O 1 ATOM 1955 C CB . ARG A 1 304 ? 38.822 -67.866 35.129 1.00 54.16 ? 315 ARG A CB 1 ATOM 1956 C CG . ARG A 1 304 ? 40.308 -67.696 35.380 1.00 81.14 ? 315 ARG A CG 1 ATOM 1957 C CD . ARG A 1 304 ? 40.558 -66.703 36.492 1.00 77.93 ? 315 ARG A CD 1 ATOM 1958 N NE . ARG A 1 304 ? 41.918 -66.182 36.452 1.00 80.92 ? 315 ARG A NE 1 ATOM 1959 C CZ . ARG A 1 304 ? 42.324 -65.120 37.135 1.00 78.58 ? 315 ARG A CZ 1 ATOM 1960 N NH1 . ARG A 1 304 ? 41.466 -64.463 37.905 1.00 78.70 ? 315 ARG A NH1 1 ATOM 1961 N NH2 . ARG A 1 304 ? 43.581 -64.713 37.045 1.00 76.66 ? 315 ARG A NH2 1 ATOM 1962 N N . PRO A 1 305 ? 39.430 -70.731 32.929 1.00 79.99 ? 316 PRO A N 1 ATOM 1963 C CA . PRO A 1 305 ? 40.001 -72.080 32.920 1.00 59.10 ? 316 PRO A CA 1 ATOM 1964 C C . PRO A 1 305 ? 41.473 -72.019 33.296 1.00 68.71 ? 316 PRO A C 1 ATOM 1965 O O . PRO A 1 305 ? 42.121 -71.000 33.063 1.00 63.69 ? 316 PRO A O 1 ATOM 1966 C CB . PRO A 1 305 ? 39.856 -72.495 31.460 1.00 59.49 ? 316 PRO A CB 1 ATOM 1967 C CG . PRO A 1 305 ? 40.019 -71.213 30.711 1.00 70.16 ? 316 PRO A CG 1 ATOM 1968 C CD . PRO A 1 305 ? 39.402 -70.138 31.579 1.00 56.24 ? 316 PRO A CD 1 ATOM 1969 N N . GLY A 1 306 ? 41.996 -73.091 33.876 1.00 61.37 ? 317 GLY A N 1 ATOM 1970 C CA . GLY A 1 306 ? 43.384 -73.108 34.289 1.00 62.10 ? 317 GLY A CA 1 ATOM 1971 C C . GLY A 1 306 ? 43.949 -74.507 34.400 1.00 78.81 ? 317 GLY A C 1 ATOM 1972 O O . GLY A 1 306 ? 43.214 -75.487 34.546 1.00 65.28 ? 317 GLY A O 1 ATOM 1973 N N . PHE A 1 307 ? 45.270 -74.603 34.331 1.00 74.66 ? 318 PHE A N 1 ATOM 1974 C CA . PHE A 1 307 ? 45.928 -75.893 34.436 1.00 70.35 ? 318 PHE A CA 1 ATOM 1975 C C . PHE A 1 307 ? 47.192 -75.823 35.286 1.00 79.93 ? 318 PHE A C 1 ATOM 1976 O O . PHE A 1 307 ? 48.087 -75.016 35.033 1.00 85.18 ? 318 PHE A O 1 ATOM 1977 C CB . PHE A 1 307 ? 46.246 -76.451 33.048 1.00 72.78 ? 318 PHE A CB 1 ATOM 1978 C CG . PHE A 1 307 ? 46.873 -77.814 33.078 1.00 91.94 ? 318 PHE A CG 1 ATOM 1979 C CD1 . PHE A 1 307 ? 46.096 -78.944 33.297 1.00 90.81 ? 318 PHE A CD1 1 ATOM 1980 C CD2 . PHE A 1 307 ? 48.240 -77.968 32.898 1.00 93.56 ? 318 PHE A CD2 1 ATOM 1981 C CE1 . PHE A 1 307 ? 46.670 -80.201 33.331 1.00 81.94 ? 318 PHE A CE1 1 ATOM 1982 C CE2 . PHE A 1 307 ? 48.821 -79.222 32.931 1.00 87.88 ? 318 PHE A CE2 1 ATOM 1983 C CZ . PHE A 1 307 ? 48.034 -80.340 33.147 1.00 78.95 ? 318 PHE A CZ 1 ATOM 1984 N N . ARG A 1 308 ? 47.247 -76.675 36.303 1.00 83.83 ? 319 ARG A N 1 ATOM 1985 C CA . ARG A 1 308 ? 48.437 -76.830 37.127 1.00 81.67 ? 319 ARG A CA 1 ATOM 1986 C C . ARG A 1 308 ? 49.271 -77.985 36.565 1.00 85.51 ? 319 ARG A C 1 ATOM 1987 O O . ARG A 1 308 ? 48.758 -79.081 36.335 1.00 77.44 ? 319 ARG A O 1 ATOM 1988 C CB . ARG A 1 308 ? 48.029 -77.102 38.580 1.00 81.25 ? 319 ARG A CB 1 ATOM 1989 C CG . ARG A 1 308 ? 49.178 -77.278 39.563 1.00 82.16 ? 319 ARG A CG 1 ATOM 1990 C CD . ARG A 1 308 ? 49.854 -75.961 39.900 1.00 80.45 ? 319 ARG A CD 1 ATOM 1991 N NE . ARG A 1 308 ? 48.896 -74.929 40.288 1.00 92.06 ? 319 ARG A NE 1 ATOM 1992 C CZ . ARG A 1 308 ? 49.236 -73.717 40.720 1.00 82.99 ? 319 ARG A CZ 1 ATOM 1993 N NH1 . ARG A 1 308 ? 50.514 -73.384 40.832 1.00 69.98 ? 319 ARG A NH1 1 ATOM 1994 N NH2 . ARG A 1 308 ? 48.295 -72.839 41.043 1.00 77.03 ? 319 ARG A NH2 1 ATOM 1995 N N . PHE A 1 309 ? 50.554 -77.731 36.331 1.00 89.78 ? 320 PHE A N 1 ATOM 1996 C CA . PHE A 1 309 ? 51.440 -78.726 35.730 1.00 90.30 ? 320 PHE A CA 1 ATOM 1997 C C . PHE A 1 309 ? 52.112 -79.637 36.748 1.00 104.34 ? 320 PHE A C 1 ATOM 1998 O O . PHE A 1 309 ? 51.674 -79.769 37.891 1.00 107.61 ? 320 PHE A O 1 ATOM 1999 C CB . PHE A 1 309 ? 52.547 -78.031 34.936 1.00 80.12 ? 320 PHE A CB 1 ATOM 2000 C CG . PHE A 1 309 ? 52.138 -77.600 33.564 1.00 80.57 ? 320 PHE A CG 1 ATOM 2001 C CD1 . PHE A 1 309 ? 52.278 -78.459 32.487 1.00 75.89 ? 320 PHE A CD1 1 ATOM 2002 C CD2 . PHE A 1 309 ? 51.635 -76.332 33.346 1.00 72.16 ? 320 PHE A CD2 1 ATOM 2003 C CE1 . PHE A 1 309 ? 51.909 -78.067 31.215 1.00 82.90 ? 320 PHE A CE1 1 ATOM 2004 C CE2 . PHE A 1 309 ? 51.262 -75.933 32.076 1.00 88.86 ? 320 PHE A CE2 1 ATOM 2005 C CZ . PHE A 1 309 ? 51.400 -76.802 31.008 1.00 80.40 ? 320 PHE A CZ 1 ATOM 2006 N N . GLU A 1 310 ? 53.187 -80.271 36.289 1.00 114.55 ? 321 GLU A N 1 ATOM 2007 C CA . GLU A 1 310 ? 54.161 -80.922 37.152 1.00 116.52 ? 321 GLU A CA 1 ATOM 2008 C C . GLU A 1 310 ? 55.545 -80.476 36.676 1.00 107.86 ? 321 GLU A C 1 ATOM 2009 O O . GLU A 1 310 ? 55.924 -80.764 35.539 1.00 112.26 ? 321 GLU A O 1 ATOM 2010 C CB . GLU A 1 310 ? 54.028 -82.440 37.078 1.00 127.26 ? 321 GLU A CB 1 ATOM 2011 C CG . GLU A 1 310 ? 54.002 -83.116 38.434 1.00 135.68 ? 321 GLU A CG 1 ATOM 2012 C CD . GLU A 1 310 ? 52.762 -82.764 39.231 1.00 140.83 ? 321 GLU A CD 1 ATOM 2013 O OE1 . GLU A 1 310 ? 52.725 -81.668 39.831 1.00 138.00 ? 321 GLU A OE1 1 ATOM 2014 O OE2 . GLU A 1 310 ? 51.821 -83.585 39.255 1.00 147.80 ? 321 GLU A OE2 1 ATOM 2015 N N . ASN A 1 311 ? 56.306 -79.777 37.519 1.00 90.33 ? 322 ASN A N 1 ATOM 2016 C CA . ASN A 1 311 ? 55.974 -79.542 38.925 1.00 99.36 ? 322 ASN A CA 1 ATOM 2017 C C . ASN A 1 311 ? 54.821 -78.573 39.190 1.00 106.37 ? 322 ASN A C 1 ATOM 2018 O O . ASN A 1 311 ? 54.420 -77.803 38.317 1.00 105.23 ? 322 ASN A O 1 ATOM 2019 C CB . ASN A 1 311 ? 57.220 -79.067 39.679 1.00 96.93 ? 322 ASN A CB 1 ATOM 2020 N N . LYS A 1 312 ? 54.306 -78.620 40.415 1.00 106.90 ? 323 LYS A N 1 ATOM 2021 C CA . LYS A 1 312 ? 53.161 -77.812 40.826 1.00 101.29 ? 323 LYS A CA 1 ATOM 2022 C C . LYS A 1 312 ? 53.467 -76.308 40.854 1.00 102.44 ? 323 LYS A C 1 ATOM 2023 O O . LYS A 1 312 ? 52.675 -75.509 41.361 1.00 91.72 ? 323 LYS A O 1 ATOM 2024 C CB . LYS A 1 312 ? 52.660 -78.285 42.196 1.00 78.62 ? 323 LYS A CB 1 ATOM 2025 N N . ARG A 1 313 ? 54.614 -75.932 40.298 1.00 101.18 ? 324 ARG A N 1 ATOM 2026 C CA . ARG A 1 313 ? 55.063 -74.548 40.294 1.00 93.48 ? 324 ARG A CA 1 ATOM 2027 C C . ARG A 1 313 ? 54.791 -73.855 38.955 1.00 96.32 ? 324 ARG A C 1 ATOM 2028 O O . ARG A 1 313 ? 55.073 -72.668 38.796 1.00 107.80 ? 324 ARG A O 1 ATOM 2029 C CB . ARG A 1 313 ? 56.551 -74.482 40.657 1.00 91.84 ? 324 ARG A CB 1 ATOM 2030 C CG . ARG A 1 313 ? 57.409 -75.531 39.966 1.00 109.33 ? 324 ARG A CG 1 ATOM 2031 C CD . ARG A 1 313 ? 58.849 -75.532 40.481 1.00 117.52 ? 324 ARG A CD 1 ATOM 2032 N NE . ARG A 1 313 ? 58.932 -75.845 41.906 1.00 123.30 ? 324 ARG A NE 1 ATOM 2033 C CZ . ARG A 1 313 ? 60.070 -76.051 42.565 1.00 128.20 ? 324 ARG A CZ 1 ATOM 2034 N NH1 . ARG A 1 313 ? 61.233 -75.984 41.930 1.00 133.47 ? 324 ARG A NH1 1 ATOM 2035 N NH2 . ARG A 1 313 ? 60.045 -76.328 43.862 1.00 81.46 ? 324 ARG A NH2 1 ATOM 2036 N N . HIS A 1 314 ? 54.237 -74.597 38.001 1.00 91.27 ? 325 HIS A N 1 ATOM 2037 C CA . HIS A 1 314 ? 53.890 -74.038 36.696 1.00 92.09 ? 325 HIS A CA 1 ATOM 2038 C C . HIS A 1 314 ? 52.382 -74.015 36.485 1.00 86.20 ? 325 HIS A C 1 ATOM 2039 O O . HIS A 1 314 ? 51.696 -75.009 36.719 1.00 83.30 ? 325 HIS A O 1 ATOM 2040 C CB . HIS A 1 314 ? 54.551 -74.829 35.567 1.00 103.86 ? 325 HIS A CB 1 ATOM 2041 C CG . HIS A 1 314 ? 56.046 -74.755 35.570 1.00 109.07 ? 325 HIS A CG 1 ATOM 2042 N ND1 . HIS A 1 314 ? 56.811 -75.213 36.621 1.00 99.86 ? 325 HIS A ND1 1 ATOM 2043 C CD2 . HIS A 1 314 ? 56.917 -74.280 34.649 1.00 112.18 ? 325 HIS A CD2 1 ATOM 2044 C CE1 . HIS A 1 314 ? 58.089 -75.021 36.349 1.00 108.37 ? 325 HIS A CE1 1 ATOM 2045 N NE2 . HIS A 1 314 ? 58.181 -74.456 35.158 1.00 117.53 ? 325 HIS A NE2 1 ATOM 2046 N N . TYR A 1 315 ? 51.872 -72.876 36.031 1.00 87.79 ? 326 TYR A N 1 ATOM 2047 C CA . TYR A 1 315 ? 50.439 -72.717 35.818 1.00 78.31 ? 326 TYR A CA 1 ATOM 2048 C C . TYR A 1 315 ? 50.148 -71.866 34.592 1.00 73.16 ? 326 TYR A C 1 ATOM 2049 O O . TYR A 1 315 ? 50.640 -70.747 34.469 1.00 84.28 ? 326 TYR A O 1 ATOM 2050 C CB . TYR A 1 315 ? 49.794 -72.090 37.055 1.00 78.55 ? 326 TYR A CB 1 ATOM 2051 C CG . TYR A 1 315 ? 48.321 -71.772 36.916 1.00 80.50 ? 326 TYR A CG 1 ATOM 2052 C CD1 . TYR A 1 315 ? 47.355 -72.717 37.231 1.00 82.27 ? 326 TYR A CD1 1 ATOM 2053 C CD2 . TYR A 1 315 ? 47.896 -70.516 36.494 1.00 83.33 ? 326 TYR A CD2 1 ATOM 2054 C CE1 . TYR A 1 315 ? 46.005 -72.425 37.116 1.00 82.76 ? 326 TYR A CE1 1 ATOM 2055 C CE2 . TYR A 1 315 ? 46.550 -70.215 36.375 1.00 84.48 ? 326 TYR A CE2 1 ATOM 2056 C CZ . TYR A 1 315 ? 45.609 -71.173 36.688 1.00 83.20 ? 326 TYR A CZ 1 ATOM 2057 O OH . TYR A 1 315 ? 44.269 -70.877 36.572 1.00 83.17 ? 326 TYR A OH 1 ATOM 2058 N N . ILE A 1 316 ? 49.350 -72.406 33.681 1.00 73.15 ? 327 ILE A N 1 ATOM 2059 C CA . ILE A 1 316 ? 48.820 -71.613 32.583 1.00 76.42 ? 327 ILE A CA 1 ATOM 2060 C C . ILE A 1 316 ? 47.331 -71.406 32.825 1.00 75.15 ? 327 ILE A C 1 ATOM 2061 O O . ILE A 1 316 ? 46.649 -72.294 33.338 1.00 75.38 ? 327 ILE A O 1 ATOM 2062 C CB . ILE A 1 316 ? 49.068 -72.273 31.215 1.00 82.66 ? 327 ILE A CB 1 ATOM 2063 C CG1 . ILE A 1 316 ? 48.408 -73.651 31.150 1.00 96.16 ? 327 ILE A CG1 1 ATOM 2064 C CG2 . ILE A 1 316 ? 50.561 -72.398 30.957 1.00 86.86 ? 327 ILE A CG2 1 ATOM 2065 C CD1 . ILE A 1 316 ? 48.468 -74.296 29.777 1.00 102.28 ? 327 ILE A CD1 1 ATOM 2066 N N . GLY A 1 317 ? 46.835 -70.224 32.482 1.00 67.90 ? 328 GLY A N 1 ATOM 2067 C CA . GLY A 1 317 ? 45.448 -69.892 32.740 1.00 61.04 ? 328 GLY A CA 1 ATOM 2068 C C . GLY A 1 317 ? 44.908 -68.835 31.800 1.00 69.30 ? 328 GLY A C 1 ATOM 2069 O O . GLY A 1 317 ? 45.622 -67.914 31.408 1.00 73.84 ? 328 GLY A O 1 ATOM 2070 N N . GLY A 1 318 ? 43.638 -68.977 31.437 1.00 60.52 ? 329 GLY A N 1 ATOM 2071 C CA . GLY A 1 318 ? 42.979 -68.020 30.573 1.00 57.69 ? 329 GLY A CA 1 ATOM 2072 C C . GLY A 1 318 ? 41.918 -67.263 31.338 1.00 67.51 ? 329 GLY A C 1 ATOM 2073 O O . GLY A 1 318 ? 41.511 -67.686 32.418 1.00 72.09 ? 329 GLY A O 1 ATOM 2074 N N . ILE A 1 319 ? 41.475 -66.139 30.785 1.00 65.79 ? 330 ILE A N 1 ATOM 2075 C CA . ILE A 1 319 ? 40.445 -65.333 31.423 1.00 51.42 ? 330 ILE A CA 1 ATOM 2076 C C . ILE A 1 319 ? 39.516 -64.727 30.376 1.00 60.74 ? 330 ILE A C 1 ATOM 2077 O O . ILE A 1 319 ? 39.958 -64.216 29.345 1.00 61.11 ? 330 ILE A O 1 ATOM 2078 C CB . ILE A 1 319 ? 41.055 -64.236 32.334 1.00 65.81 ? 330 ILE A CB 1 ATOM 2079 C CG1 . ILE A 1 319 ? 39.963 -63.494 33.102 1.00 63.73 ? 330 ILE A CG1 1 ATOM 2080 C CG2 . ILE A 1 319 ? 41.894 -63.259 31.542 1.00 67.48 ? 330 ILE A CG2 1 ATOM 2081 C CD1 . ILE A 1 319 ? 39.341 -64.316 34.185 1.00 70.92 ? 330 ILE A CD1 1 ATOM 2082 N N . LEU A 1 320 ? 38.220 -64.802 30.639 1.00 59.73 ? 331 LEU A N 1 ATOM 2083 C CA . LEU A 1 320 ? 37.228 -64.369 29.671 1.00 62.75 ? 331 LEU A CA 1 ATOM 2084 C C . LEU A 1 320 ? 36.105 -63.631 30.384 1.00 73.15 ? 331 LEU A C 1 ATOM 2085 O O . LEU A 1 320 ? 35.255 -64.248 31.025 1.00 86.56 ? 331 LEU A O 1 ATOM 2086 C CB . LEU A 1 320 ? 36.683 -65.587 28.925 1.00 57.40 ? 331 LEU A CB 1 ATOM 2087 C CG . LEU A 1 320 ? 36.038 -65.444 27.548 1.00 70.18 ? 331 LEU A CG 1 ATOM 2088 C CD1 . LEU A 1 320 ? 35.962 -66.818 26.890 1.00 66.32 ? 331 LEU A CD1 1 ATOM 2089 C CD2 . LEU A 1 320 ? 34.649 -64.816 27.634 1.00 68.53 ? 331 LEU A CD2 1 ATOM 2090 N N . GLU A 1 321 ? 36.109 -62.307 30.276 1.00 60.06 ? 332 GLU A N 1 ATOM 2091 C CA . GLU A 1 321 ? 35.081 -61.491 30.906 1.00 57.12 ? 332 GLU A CA 1 ATOM 2092 C C . GLU A 1 321 ? 34.264 -60.737 29.865 1.00 63.78 ? 332 GLU A C 1 ATOM 2093 O O . GLU A 1 321 ? 34.804 -60.196 28.898 1.00 65.56 ? 332 GLU A O 1 ATOM 2094 C CB . GLU A 1 321 ? 35.709 -60.510 31.896 1.00 64.18 ? 332 GLU A CB 1 ATOM 2095 C CG . GLU A 1 321 ? 34.710 -59.640 32.651 1.00 75.19 ? 332 GLU A CG 1 ATOM 2096 C CD . GLU A 1 321 ? 35.390 -58.639 33.577 1.00 92.74 ? 332 GLU A CD 1 ATOM 2097 O OE1 . GLU A 1 321 ? 36.623 -58.744 33.770 1.00 89.07 ? 332 GLU A OE1 1 ATOM 2098 O OE2 . GLU A 1 321 ? 34.693 -57.746 34.108 1.00 93.19 ? 332 GLU A OE2 1 ATOM 2099 N N . HIS A 1 322 ? 32.954 -60.719 30.059 1.00 60.63 ? 333 HIS A N 1 ATOM 2100 C CA . HIS A 1 322 ? 32.083 -59.906 29.231 1.00 57.07 ? 333 HIS A CA 1 ATOM 2101 C C . HIS A 1 322 ? 30.905 -59.415 30.055 1.00 63.89 ? 333 HIS A C 1 ATOM 2102 O O . HIS A 1 322 ? 29.979 -60.174 30.343 1.00 59.88 ? 333 HIS A O 1 ATOM 2103 C CB . HIS A 1 322 ? 31.588 -60.684 28.011 1.00 54.42 ? 333 HIS A CB 1 ATOM 2104 C CG . HIS A 1 322 ? 30.718 -59.876 27.099 1.00 59.65 ? 333 HIS A CG 1 ATOM 2105 N ND1 . HIS A 1 322 ? 29.398 -59.597 27.383 1.00 54.17 ? 333 HIS A ND1 1 ATOM 2106 C CD2 . HIS A 1 322 ? 30.982 -59.275 25.915 1.00 61.11 ? 333 HIS A CD2 1 ATOM 2107 C CE1 . HIS A 1 322 ? 28.886 -58.862 26.413 1.00 59.23 ? 333 HIS A CE1 1 ATOM 2108 N NE2 . HIS A 1 322 ? 29.827 -58.653 25.509 1.00 60.78 ? 333 HIS A NE2 1 ATOM 2109 N N . THR A 1 323 ? 30.947 -58.144 30.440 1.00 53.79 ? 334 THR A N 1 ATOM 2110 C CA . THR A 1 323 ? 29.857 -57.550 31.196 1.00 57.03 ? 334 THR A CA 1 ATOM 2111 C C . THR A 1 323 ? 29.278 -56.355 30.449 1.00 53.12 ? 334 THR A C 1 ATOM 2112 O O . THR A 1 323 ? 30.013 -55.572 29.848 1.00 57.85 ? 334 THR A O 1 ATOM 2113 C CB . THR A 1 323 ? 30.300 -57.115 32.613 1.00 56.95 ? 334 THR A CB 1 ATOM 2114 O OG1 . THR A 1 323 ? 30.320 -55.687 32.693 1.00 62.46 ? 334 THR A OG1 1 ATOM 2115 C CG2 . THR A 1 323 ? 31.675 -57.660 32.943 1.00 42.45 ? 334 THR A CG2 1 ATOM 2116 N N . GLN A 1 324 ? 27.956 -56.223 30.484 1.00 49.16 ? 335 GLN A N 1 ATOM 2117 C CA . GLN A 1 324 ? 27.284 -55.137 29.787 1.00 51.97 ? 335 GLN A CA 1 ATOM 2118 C C . GLN A 1 324 ? 26.186 -54.523 30.639 1.00 56.76 ? 335 GLN A C 1 ATOM 2119 O O . GLN A 1 324 ? 25.341 -55.229 31.187 1.00 67.50 ? 335 GLN A O 1 ATOM 2120 C CB . GLN A 1 324 ? 26.701 -55.621 28.458 1.00 41.95 ? 335 GLN A CB 1 ATOM 2121 C CG . GLN A 1 324 ? 26.105 -54.511 27.615 1.00 37.20 ? 335 GLN A CG 1 ATOM 2122 C CD . GLN A 1 324 ? 25.419 -55.026 26.365 1.00 55.34 ? 335 GLN A CD 1 ATOM 2123 O OE1 . GLN A 1 324 ? 24.378 -55.682 26.436 1.00 55.18 ? 335 GLN A OE1 1 ATOM 2124 N NE2 . GLN A 1 324 ? 26.001 -54.731 25.209 1.00 37.77 ? 335 GLN A NE2 1 ATOM 2125 N N . GLN A 1 325 ? 26.204 -53.199 30.735 1.00 49.75 ? 336 GLN A N 1 ATOM 2126 C CA . GLN A 1 325 ? 25.216 -52.469 31.513 1.00 46.61 ? 336 GLN A CA 1 ATOM 2127 C C . GLN A 1 325 ? 24.448 -51.466 30.650 1.00 52.67 ? 336 GLN A C 1 ATOM 2128 O O . GLN A 1 325 ? 24.993 -50.882 29.709 1.00 57.56 ? 336 GLN A O 1 ATOM 2129 C CB . GLN A 1 325 ? 25.900 -51.743 32.672 1.00 40.71 ? 336 GLN A CB 1 ATOM 2130 C CG . GLN A 1 325 ? 26.723 -52.645 33.558 1.00 48.82 ? 336 GLN A CG 1 ATOM 2131 C CD . GLN A 1 325 ? 28.112 -52.097 33.816 1.00 61.55 ? 336 GLN A CD 1 ATOM 2132 O OE1 . GLN A 1 325 ? 28.672 -51.372 32.991 1.00 57.42 ? 336 GLN A OE1 1 ATOM 2133 N NE2 . GLN A 1 325 ? 28.678 -52.442 34.970 1.00 61.33 ? 336 GLN A NE2 1 ATOM 2134 N N . THR A 1 326 ? 23.178 -51.264 30.973 1.00 41.00 ? 337 THR A N 1 ATOM 2135 C CA . THR A 1 326 ? 22.379 -50.269 30.272 1.00 44.91 ? 337 THR A CA 1 ATOM 2136 C C . THR A 1 326 ? 21.747 -49.276 31.242 1.00 48.11 ? 337 THR A C 1 ATOM 2137 O O . THR A 1 326 ? 21.138 -49.667 32.237 1.00 53.87 ? 337 THR A O 1 ATOM 2138 C CB . THR A 1 326 ? 21.284 -50.925 29.412 1.00 41.16 ? 337 THR A CB 1 ATOM 2139 O OG1 . THR A 1 326 ? 20.529 -51.844 30.212 1.00 44.78 ? 337 THR A OG1 1 ATOM 2140 C CG2 . THR A 1 326 ? 21.906 -51.676 28.250 1.00 37.48 ? 337 THR A CG2 1 ATOM 2141 N N . PHE A 1 327 ? 21.908 -47.992 30.939 1.00 41.88 ? 338 PHE A N 1 ATOM 2142 C CA . PHE A 1 327 ? 21.325 -46.908 31.720 1.00 47.39 ? 338 PHE A CA 1 ATOM 2143 C C . PHE A 1 327 ? 20.372 -46.097 30.851 1.00 52.35 ? 338 PHE A C 1 ATOM 2144 O O . PHE A 1 327 ? 20.791 -45.157 30.176 1.00 49.48 ? 338 PHE A O 1 ATOM 2145 C CB . PHE A 1 327 ? 22.417 -45.968 32.211 1.00 36.38 ? 338 PHE A CB 1 ATOM 2146 C CG . PHE A 1 327 ? 23.408 -46.605 33.127 1.00 50.45 ? 338 PHE A CG 1 ATOM 2147 C CD1 . PHE A 1 327 ? 23.302 -46.445 34.501 1.00 50.67 ? 338 PHE A CD1 1 ATOM 2148 C CD2 . PHE A 1 327 ? 24.465 -47.337 32.621 1.00 50.48 ? 338 PHE A CD2 1 ATOM 2149 C CE1 . PHE A 1 327 ? 24.225 -47.011 35.352 1.00 49.19 ? 338 PHE A CE1 1 ATOM 2150 C CE2 . PHE A 1 327 ? 25.387 -47.913 33.468 1.00 59.79 ? 338 PHE A CE2 1 ATOM 2151 C CZ . PHE A 1 327 ? 25.266 -47.747 34.838 1.00 50.10 ? 338 PHE A CZ 1 ATOM 2152 N N . ASP A 1 328 ? 19.094 -46.446 30.867 1.00 49.72 ? 339 ASP A N 1 ATOM 2153 C CA . ASP A 1 328 ? 18.125 -45.752 30.031 1.00 49.62 ? 339 ASP A CA 1 ATOM 2154 C C . ASP A 1 328 ? 17.282 -44.774 30.833 1.00 53.36 ? 339 ASP A C 1 ATOM 2155 O O . ASP A 1 328 ? 16.572 -45.170 31.754 1.00 58.68 ? 339 ASP A O 1 ATOM 2156 C CB . ASP A 1 328 ? 17.218 -46.756 29.323 1.00 53.80 ? 339 ASP A CB 1 ATOM 2157 C CG . ASP A 1 328 ? 17.977 -47.659 28.376 1.00 59.72 ? 339 ASP A CG 1 ATOM 2158 O OD1 . ASP A 1 328 ? 19.190 -47.434 28.173 1.00 71.15 ? 339 ASP A OD1 1 ATOM 2159 O OD2 . ASP A 1 328 ? 17.354 -48.588 27.824 1.00 61.26 ? 339 ASP A OD2 1 ATOM 2160 N N . THR A 1 329 ? 17.352 -43.494 30.481 1.00 41.56 ? 340 THR A N 1 ATOM 2161 C CA . THR A 1 329 ? 16.547 -42.501 31.179 1.00 45.47 ? 340 THR A CA 1 ATOM 2162 C C . THR A 1 329 ? 15.677 -41.672 30.254 1.00 48.49 ? 340 THR A C 1 ATOM 2163 O O . THR A 1 329 ? 15.828 -41.705 29.034 1.00 50.66 ? 340 THR A O 1 ATOM 2164 C CB . THR A 1 329 ? 17.411 -41.526 31.996 1.00 50.06 ? 340 THR A CB 1 ATOM 2165 O OG1 . THR A 1 329 ? 18.279 -40.797 31.117 1.00 37.88 ? 340 THR A OG1 1 ATOM 2166 C CG2 . THR A 1 329 ? 18.226 -42.280 33.053 1.00 47.61 ? 340 THR A CG2 1 ATOM 2167 N N . ARG A 1 330 ? 14.753 -40.939 30.862 1.00 42.56 ? 341 ARG A N 1 ATOM 2168 C CA . ARG A 1 330 ? 14.006 -39.904 30.173 1.00 49.66 ? 341 ARG A CA 1 ATOM 2169 C C . ARG A 1 330 ? 14.199 -38.596 30.938 1.00 58.42 ? 341 ARG A C 1 ATOM 2170 O O . ARG A 1 330 ? 13.987 -38.539 32.152 1.00 54.57 ? 341 ARG A O 1 ATOM 2171 C CB . ARG A 1 330 ? 12.523 -40.255 30.101 1.00 42.00 ? 341 ARG A CB 1 ATOM 2172 C CG . ARG A 1 330 ? 11.681 -39.144 29.507 1.00 35.84 ? 341 ARG A CG 1 ATOM 2173 C CD . ARG A 1 330 ? 10.198 -39.373 29.715 1.00 36.80 ? 341 ARG A CD 1 ATOM 2174 N NE . ARG A 1 330 ? 9.435 -38.197 29.312 1.00 54.14 ? 341 ARG A NE 1 ATOM 2175 C CZ . ARG A 1 330 ? 8.135 -38.037 29.523 1.00 47.10 ? 341 ARG A CZ 1 ATOM 2176 N NH1 . ARG A 1 330 ? 7.436 -38.985 30.131 1.00 56.47 ? 341 ARG A NH1 1 ATOM 2177 N NH2 . ARG A 1 330 ? 7.532 -36.931 29.110 1.00 44.97 ? 341 ARG A NH2 1 ATOM 2178 N N . ASP A 1 331 ? 14.619 -37.556 30.225 1.00 44.35 ? 342 ASP A N 1 ATOM 2179 C CA . ASP A 1 331 ? 14.877 -36.254 30.828 1.00 44.72 ? 342 ASP A CA 1 ATOM 2180 C C . ASP A 1 331 ? 13.560 -35.531 31.063 1.00 54.08 ? 342 ASP A C 1 ATOM 2181 O O . ASP A 1 331 ? 12.958 -35.001 30.128 1.00 65.94 ? 342 ASP A O 1 ATOM 2182 C CB . ASP A 1 331 ? 15.776 -35.420 29.916 1.00 49.80 ? 342 ASP A CB 1 ATOM 2183 C CG . ASP A 1 331 ? 16.291 -34.163 30.588 1.00 66.02 ? 342 ASP A CG 1 ATOM 2184 O OD1 . ASP A 1 331 ? 17.406 -33.722 30.245 1.00 77.25 ? 342 ASP A OD1 1 ATOM 2185 O OD2 . ASP A 1 331 ? 15.589 -33.615 31.458 1.00 62.39 ? 342 ASP A OD2 1 ATOM 2186 N N . MET A 1 332 ? 13.116 -35.496 32.313 1.00 48.42 ? 343 MET A N 1 ATOM 2187 C CA . MET A 1 332 ? 11.809 -34.927 32.609 1.00 56.94 ? 343 MET A CA 1 ATOM 2188 C C . MET A 1 332 ? 11.868 -33.410 32.777 1.00 63.65 ? 343 MET A C 1 ATOM 2189 O O . MET A 1 332 ? 10.843 -32.763 33.003 1.00 56.79 ? 343 MET A O 1 ATOM 2190 C CB . MET A 1 332 ? 11.196 -35.597 33.836 1.00 46.92 ? 343 MET A CB 1 ATOM 2191 C CG . MET A 1 332 ? 11.030 -37.101 33.701 1.00 44.75 ? 343 MET A CG 1 ATOM 2192 S SD . MET A 1 332 ? 9.503 -37.648 32.904 1.00 60.08 ? 343 MET A SD 1 ATOM 2193 C CE . MET A 1 332 ? 8.299 -37.239 34.164 1.00 43.38 ? 343 MET A CE 1 ATOM 2194 N N . THR A 1 333 ? 13.069 -32.849 32.646 1.00 64.08 ? 344 THR A N 1 ATOM 2195 C CA . THR A 1 333 ? 13.263 -31.400 32.712 1.00 54.13 ? 344 THR A CA 1 ATOM 2196 C C . THR A 1 333 ? 12.676 -30.731 31.473 1.00 50.46 ? 344 THR A C 1 ATOM 2197 O O . THR A 1 333 ? 12.470 -29.519 31.440 1.00 50.62 ? 344 THR A O 1 ATOM 2198 C CB . THR A 1 333 ? 14.757 -31.035 32.803 1.00 55.07 ? 344 THR A CB 1 ATOM 2199 O OG1 . THR A 1 333 ? 15.418 -31.948 33.686 1.00 63.93 ? 344 THR A OG1 1 ATOM 2200 C CG2 . THR A 1 333 ? 14.943 -29.616 33.314 1.00 84.21 ? 344 THR A CG2 1 ATOM 2201 N N . VAL A 1 334 ? 12.413 -31.534 30.452 1.00 40.22 ? 345 VAL A N 1 ATOM 2202 C CA . VAL A 1 334 ? 11.889 -31.024 29.202 1.00 36.93 ? 345 VAL A CA 1 ATOM 2203 C C . VAL A 1 334 ? 10.374 -31.005 29.237 1.00 49.09 ? 345 VAL A C 1 ATOM 2204 O O . VAL A 1 334 ? 9.737 -32.048 29.375 1.00 55.86 ? 345 VAL A O 1 ATOM 2205 C CB . VAL A 1 334 ? 12.366 -31.866 28.004 1.00 38.70 ? 345 VAL A CB 1 ATOM 2206 C CG1 . VAL A 1 334 ? 11.769 -31.340 26.710 1.00 34.18 ? 345 VAL A CG1 1 ATOM 2207 C CG2 . VAL A 1 334 ? 13.893 -31.875 27.931 1.00 34.76 ? 345 VAL A CG2 1 ATOM 2208 N N . PRO A 1 335 ? 9.790 -29.807 29.118 1.00 52.26 ? 346 PRO A N 1 ATOM 2209 C CA . PRO A 1 335 ? 8.338 -29.650 29.031 1.00 55.05 ? 346 PRO A CA 1 ATOM 2210 C C . PRO A 1 335 ? 7.774 -30.499 27.899 1.00 52.44 ? 346 PRO A C 1 ATOM 2211 O O . PRO A 1 335 ? 8.231 -30.398 26.763 1.00 48.32 ? 346 PRO A O 1 ATOM 2212 C CB . PRO A 1 335 ? 8.173 -28.168 28.700 1.00 54.63 ? 346 PRO A CB 1 ATOM 2213 C CG . PRO A 1 335 ? 9.404 -27.523 29.233 1.00 39.48 ? 346 PRO A CG 1 ATOM 2214 C CD . PRO A 1 335 ? 10.494 -28.517 29.024 1.00 42.78 ? 346 PRO A CD 1 ATOM 2215 N N . ALA A 1 336 ? 6.800 -31.341 28.219 1.00 51.10 ? 347 ALA A N 1 ATOM 2216 C CA . ALA A 1 336 ? 6.167 -32.182 27.217 1.00 48.06 ? 347 ALA A CA 1 ATOM 2217 C C . ALA A 1 336 ? 5.271 -31.361 26.309 1.00 49.22 ? 347 ALA A C 1 ATOM 2218 O O . ALA A 1 336 ? 5.264 -31.547 25.097 1.00 54.27 ? 347 ALA A O 1 ATOM 2219 C CB . ALA A 1 336 ? 5.360 -33.272 27.882 1.00 47.62 ? 347 ALA A CB 1 ATOM 2220 N N . PHE A 1 337 ? 4.518 -30.442 26.900 1.00 48.16 ? 348 PHE A N 1 ATOM 2221 C CA . PHE A 1 337 ? 3.482 -29.741 26.159 1.00 58.25 ? 348 PHE A CA 1 ATOM 2222 C C . PHE A 1 337 ? 3.819 -28.292 25.815 1.00 56.87 ? 348 PHE A C 1 ATOM 2223 O O . PHE A 1 337 ? 4.433 -27.573 26.602 1.00 49.65 ? 348 PHE A O 1 ATOM 2224 C CB . PHE A 1 337 ? 2.168 -29.822 26.923 1.00 64.15 ? 348 PHE A CB 1 ATOM 2225 C CG . PHE A 1 337 ? 1.767 -31.223 27.269 1.00 64.10 ? 348 PHE A CG 1 ATOM 2226 C CD1 . PHE A 1 337 ? 1.851 -31.680 28.571 1.00 51.59 ? 348 PHE A CD1 1 ATOM 2227 C CD2 . PHE A 1 337 ? 1.328 -32.093 26.285 1.00 73.31 ? 348 PHE A CD2 1 ATOM 2228 C CE1 . PHE A 1 337 ? 1.483 -32.975 28.891 1.00 51.46 ? 348 PHE A CE1 1 ATOM 2229 C CE2 . PHE A 1 337 ? 0.960 -33.392 26.598 1.00 64.47 ? 348 PHE A CE2 1 ATOM 2230 C CZ . PHE A 1 337 ? 1.038 -33.832 27.902 1.00 60.78 ? 348 PHE A CZ 1 ATOM 2231 N N . LEU A 1 338 ? 3.410 -27.883 24.618 1.00 43.81 ? 349 LEU A N 1 ATOM 2232 C CA . LEU A 1 338 ? 3.636 -26.529 24.139 1.00 43.37 ? 349 LEU A CA 1 ATOM 2233 C C . LEU A 1 338 ? 2.712 -25.550 24.848 1.00 51.99 ? 349 LEU A C 1 ATOM 2234 O O . LEU A 1 338 ? 1.550 -25.862 25.106 1.00 44.68 ? 349 LEU A O 1 ATOM 2235 C CB . LEU A 1 338 ? 3.393 -26.460 22.633 1.00 50.82 ? 349 LEU A CB 1 ATOM 2236 C CG . LEU A 1 338 ? 4.355 -27.218 21.722 1.00 49.12 ? 349 LEU A CG 1 ATOM 2237 C CD1 . LEU A 1 338 ? 3.731 -27.405 20.355 1.00 45.76 ? 349 LEU A CD1 1 ATOM 2238 C CD2 . LEU A 1 338 ? 5.665 -26.465 21.605 1.00 45.10 ? 349 LEU A CD2 1 ATOM 2239 N N . THR A 1 339 ? 3.232 -24.365 25.158 1.00 53.09 ? 350 THR A N 1 ATOM 2240 C CA . THR A 1 339 ? 2.440 -23.320 25.793 1.00 44.59 ? 350 THR A CA 1 ATOM 2241 C C . THR A 1 339 ? 2.402 -22.070 24.925 1.00 61.55 ? 350 THR A C 1 ATOM 2242 O O . THR A 1 339 ? 3.259 -21.878 24.060 1.00 62.42 ? 350 THR A O 1 ATOM 2243 C CB . THR A 1 339 ? 3.004 -22.940 27.168 1.00 48.84 ? 350 THR A CB 1 ATOM 2244 O OG1 . THR A 1 339 ? 4.263 -22.274 27.003 1.00 53.26 ? 350 THR A OG1 1 ATOM 2245 C CG2 . THR A 1 339 ? 3.198 -24.181 28.024 1.00 51.73 ? 350 THR A CG2 1 ATOM 2246 N N . LYS A 1 340 ? 1.410 -21.219 25.172 1.00 67.70 ? 351 LYS A N 1 ATOM 2247 C CA . LYS A 1 340 ? 1.248 -19.979 24.423 1.00 55.85 ? 351 LYS A CA 1 ATOM 2248 C C . LYS A 1 340 ? 2.489 -19.093 24.494 1.00 58.43 ? 351 LYS A C 1 ATOM 2249 O O . LYS A 1 340 ? 2.763 -18.313 23.582 1.00 63.89 ? 351 LYS A O 1 ATOM 2250 C CB . LYS A 1 340 ? 0.022 -19.201 24.913 1.00 44.12 ? 351 LYS A CB 1 ATOM 2251 C CG . LYS A 1 340 ? -0.197 -17.896 24.161 1.00 44.33 ? 351 LYS A CG 1 ATOM 2252 C CD . LYS A 1 340 ? -1.520 -17.237 24.486 1.00 46.15 ? 351 LYS A CD 1 ATOM 2253 C CE . LYS A 1 340 ? -1.686 -15.963 23.667 1.00 71.33 ? 351 LYS A CE 1 ATOM 2254 N NZ . LYS A 1 340 ? -2.849 -15.150 24.118 1.00 86.59 ? 351 LYS A NZ 1 ATOM 2255 N N . ALA A 1 341 ? 3.244 -19.221 25.578 1.00 59.21 ? 352 ALA A N 1 ATOM 2256 C CA . ALA A 1 341 ? 4.440 -18.412 25.758 1.00 60.63 ? 352 ALA A CA 1 ATOM 2257 C C . ALA A 1 341 ? 5.477 -18.700 24.681 1.00 54.12 ? 352 ALA A C 1 ATOM 2258 O O . ALA A 1 341 ? 6.203 -17.800 24.261 1.00 56.56 ? 352 ALA A O 1 ATOM 2259 C CB . ALA A 1 341 ? 5.029 -18.633 27.137 1.00 62.49 ? 352 ALA A CB 1 ATOM 2260 N N . VAL A 1 342 ? 5.535 -19.951 24.229 1.00 44.39 ? 353 VAL A N 1 ATOM 2261 C CA . VAL A 1 342 ? 6.523 -20.351 23.234 1.00 53.49 ? 353 VAL A CA 1 ATOM 2262 C C . VAL A 1 342 ? 5.994 -20.128 21.821 1.00 66.50 ? 353 VAL A C 1 ATOM 2263 O O . VAL A 1 342 ? 6.769 -19.901 20.891 1.00 76.88 ? 353 VAL A O 1 ATOM 2264 C CB . VAL A 1 342 ? 7.000 -21.818 23.433 1.00 54.22 ? 353 VAL A CB 1 ATOM 2265 C CG1 . VAL A 1 342 ? 6.843 -22.228 24.881 1.00 45.31 ? 353 VAL A CG1 1 ATOM 2266 C CG2 . VAL A 1 342 ? 6.246 -22.779 22.526 1.00 57.47 ? 353 VAL A CG2 1 ATOM 2267 N N . PHE A 1 343 ? 4.673 -20.182 21.670 1.00 61.70 ? 354 PHE A N 1 ATOM 2268 C CA . PHE A 1 343 ? 4.037 -19.874 20.397 1.00 57.07 ? 354 PHE A CA 1 ATOM 2269 C C . PHE A 1 343 ? 4.293 -18.412 20.057 1.00 58.03 ? 354 PHE A C 1 ATOM 2270 O O . PHE A 1 343 ? 4.740 -18.090 18.956 1.00 67.19 ? 354 PHE A O 1 ATOM 2271 C CB . PHE A 1 343 ? 2.532 -20.137 20.466 1.00 52.51 ? 354 PHE A CB 1 ATOM 2272 C CG . PHE A 1 343 ? 2.112 -21.478 19.918 1.00 47.10 ? 354 PHE A CG 1 ATOM 2273 C CD1 . PHE A 1 343 ? 1.200 -21.556 18.873 1.00 42.91 ? 354 PHE A CD1 1 ATOM 2274 C CD2 . PHE A 1 343 ? 2.617 -22.656 20.451 1.00 52.01 ? 354 PHE A CD2 1 ATOM 2275 C CE1 . PHE A 1 343 ? 0.799 -22.783 18.365 1.00 38.82 ? 354 PHE A CE1 1 ATOM 2276 C CE2 . PHE A 1 343 ? 2.222 -23.891 19.948 1.00 44.45 ? 354 PHE A CE2 1 ATOM 2277 C CZ . PHE A 1 343 ? 1.313 -23.952 18.903 1.00 47.76 ? 354 PHE A CZ 1 ATOM 2278 N N . ASP A 1 344 ? 4.016 -17.533 21.014 1.00 63.47 ? 355 ASP A N 1 ATOM 2279 C CA . ASP A 1 344 ? 4.225 -16.098 20.829 1.00 63.98 ? 355 ASP A CA 1 ATOM 2280 C C . ASP A 1 344 ? 5.691 -15.788 20.567 1.00 58.63 ? 355 ASP A C 1 ATOM 2281 O O . ASP A 1 344 ? 6.013 -14.940 19.735 1.00 62.82 ? 355 ASP A O 1 ATOM 2282 C CB . ASP A 1 344 ? 3.725 -15.306 22.043 1.00 58.04 ? 355 ASP A CB 1 ATOM 2283 C CG . ASP A 1 344 ? 2.211 -15.376 22.209 1.00 68.27 ? 355 ASP A CG 1 ATOM 2284 O OD1 . ASP A 1 344 ? 1.523 -15.840 21.265 1.00 60.75 ? 355 ASP A OD1 1 ATOM 2285 O OD2 . ASP A 1 344 ? 1.710 -14.958 23.281 1.00 57.75 ? 355 ASP A OD2 1 ATOM 2286 N N . ALA A 1 345 ? 6.571 -16.488 21.276 1.00 53.30 ? 356 ALA A N 1 ATOM 2287 C CA . ALA A 1 345 ? 8.008 -16.317 21.108 1.00 56.49 ? 356 ALA A CA 1 ATOM 2288 C C . ALA A 1 345 ? 8.421 -16.598 19.673 1.00 58.40 ? 356 ALA A C 1 ATOM 2289 O O . ALA A 1 345 ? 9.138 -15.809 19.058 1.00 62.13 ? 356 ALA A O 1 ATOM 2290 C CB . ALA A 1 345 ? 8.769 -17.221 22.062 1.00 39.52 ? 356 ALA A CB 1 ATOM 2291 N N . ASN A 1 346 ? 7.961 -17.726 19.142 1.00 54.69 ? 357 ASN A N 1 ATOM 2292 C CA . ASN A 1 346 ? 8.271 -18.092 17.769 1.00 58.53 ? 357 ASN A CA 1 ATOM 2293 C C . ASN A 1 346 ? 7.738 -17.073 16.769 1.00 62.01 ? 357 ASN A C 1 ATOM 2294 O O . ASN A 1 346 ? 8.405 -16.754 15.785 1.00 66.69 ? 357 ASN A O 1 ATOM 2295 C CB . ASN A 1 346 ? 7.736 -19.485 17.446 1.00 57.01 ? 357 ASN A CB 1 ATOM 2296 C CG . ASN A 1 346 ? 8.450 -20.576 18.215 1.00 59.10 ? 357 ASN A CG 1 ATOM 2297 O OD1 . ASN A 1 346 ? 9.480 -20.336 18.845 1.00 70.71 ? 357 ASN A OD1 1 ATOM 2298 N ND2 . ASN A 1 346 ? 7.912 -21.789 18.157 1.00 50.57 ? 357 ASN A ND2 1 ATOM 2299 N N . LYS A 1 347 ? 6.539 -16.559 17.025 1.00 58.73 ? 358 LYS A N 1 ATOM 2300 C CA . LYS A 1 347 ? 5.946 -15.568 16.135 1.00 56.12 ? 358 LYS A CA 1 ATOM 2301 C C . LYS A 1 347 ? 6.809 -14.323 16.083 1.00 62.42 ? 358 LYS A C 1 ATOM 2302 O O . LYS A 1 347 ? 7.050 -13.786 15.008 1.00 65.98 ? 358 LYS A O 1 ATOM 2303 C CB . LYS A 1 347 ? 4.525 -15.206 16.565 1.00 46.44 ? 358 LYS A CB 1 ATOM 2304 C CG . LYS A 1 347 ? 3.524 -16.333 16.415 1.00 48.49 ? 358 LYS A CG 1 ATOM 2305 C CD . LYS A 1 347 ? 2.111 -15.862 16.713 1.00 63.50 ? 358 LYS A CD 1 ATOM 2306 C CE . LYS A 1 347 ? 1.145 -17.032 16.764 1.00 64.65 ? 358 LYS A CE 1 ATOM 2307 N NZ . LYS A 1 347 ? -0.267 -16.586 16.697 1.00 64.18 ? 358 LYS A NZ 1 ATOM 2308 N N . LYS A 1 348 ? 7.286 -13.877 17.243 1.00 67.60 ? 359 LYS A N 1 ATOM 2309 C CA . LYS A 1 348 ? 8.155 -12.705 17.310 1.00 74.09 ? 359 LYS A CA 1 ATOM 2310 C C . LYS A 1 348 ? 9.357 -12.851 16.383 1.00 71.18 ? 359 LYS A C 1 ATOM 2311 O O . LYS A 1 348 ? 9.763 -11.895 15.725 1.00 82.54 ? 359 LYS A O 1 ATOM 2312 C CB . LYS A 1 348 ? 8.625 -12.450 18.744 1.00 92.56 ? 359 LYS A CB 1 ATOM 2313 C CG . LYS A 1 348 ? 9.627 -11.306 18.866 1.00 107.03 ? 359 LYS A CG 1 ATOM 2314 C CD . LYS A 1 348 ? 9.952 -10.975 20.315 1.00 110.94 ? 359 LYS A CD 1 ATOM 2315 C CE . LYS A 1 348 ? 10.745 -9.678 20.412 1.00 108.90 ? 359 LYS A CE 1 ATOM 2316 N NZ . LYS A 1 348 ? 10.977 -9.259 21.824 1.00 105.37 ? 359 LYS A NZ 1 ATOM 2317 N N . GLN A 1 349 ? 9.910 -14.056 16.315 1.00 67.61 ? 360 GLN A N 1 ATOM 2318 C CA . GLN A 1 349 ? 11.073 -14.300 15.472 1.00 81.80 ? 360 GLN A CA 1 ATOM 2319 C C . GLN A 1 349 ? 10.722 -14.698 14.041 1.00 77.01 ? 360 GLN A C 1 ATOM 2320 O O . GLN A 1 349 ? 11.301 -14.172 13.092 1.00 85.47 ? 360 GLN A O 1 ATOM 2321 C CB . GLN A 1 349 ? 11.999 -15.347 16.102 1.00 90.77 ? 360 GLN A CB 1 ATOM 2322 C CG . GLN A 1 349 ? 13.250 -14.750 16.732 1.00 98.27 ? 360 GLN A CG 1 ATOM 2323 C CD . GLN A 1 349 ? 14.007 -13.849 15.770 1.00 115.22 ? 360 GLN A CD 1 ATOM 2324 O OE1 . GLN A 1 349 ? 14.141 -14.158 14.585 1.00 125.32 ? 360 GLN A OE1 1 ATOM 2325 N NE2 . GLN A 1 349 ? 14.497 -12.721 16.276 1.00 113.95 ? 360 GLN A NE2 1 ATOM 2326 N N . ALA A 1 350 ? 9.776 -15.620 13.888 1.00 64.03 ? 361 ALA A N 1 ATOM 2327 C CA . ALA A 1 350 ? 9.475 -16.194 12.577 1.00 52.25 ? 361 ALA A CA 1 ATOM 2328 C C . ALA A 1 350 ? 8.197 -15.659 11.941 1.00 56.55 ? 361 ALA A C 1 ATOM 2329 O O . ALA A 1 350 ? 7.962 -15.876 10.753 1.00 49.43 ? 361 ALA A O 1 ATOM 2330 C CB . ALA A 1 350 ? 9.410 -17.718 12.669 1.00 31.94 ? 361 ALA A CB 1 ATOM 2331 N N . GLY A 1 351 ? 7.373 -14.973 12.728 1.00 60.39 ? 362 GLY A N 1 ATOM 2332 C CA . GLY A 1 351 ? 6.079 -14.516 12.252 1.00 51.13 ? 362 GLY A CA 1 ATOM 2333 C C . GLY A 1 351 ? 5.049 -15.628 12.312 1.00 38.28 ? 362 GLY A C 1 ATOM 2334 O O . GLY A 1 351 ? 5.355 -16.743 12.721 1.00 57.79 ? 362 GLY A O 1 ATOM 2335 N N . SER A 1 352 ? 3.821 -15.319 11.913 1.00 34.92 ? 363 SER A N 1 ATOM 2336 C CA . SER A 1 352 ? 2.767 -16.319 11.810 1.00 36.29 ? 363 SER A CA 1 ATOM 2337 C C . SER A 1 352 ? 3.090 -17.384 10.755 1.00 45.92 ? 363 SER A C 1 ATOM 2338 O O . SER A 1 352 ? 3.936 -17.182 9.886 1.00 48.76 ? 363 SER A O 1 ATOM 2339 C CB . SER A 1 352 ? 1.441 -15.642 11.471 1.00 45.46 ? 363 SER A CB 1 ATOM 2340 O OG . SER A 1 352 ? 1.137 -14.634 12.416 1.00 63.66 ? 363 SER A OG 1 ATOM 2341 N N . LEU A 1 353 ? 2.407 -18.520 10.837 1.00 49.89 ? 364 LEU A N 1 ATOM 2342 C CA . LEU A 1 353 ? 2.644 -19.624 9.913 1.00 47.71 ? 364 LEU A CA 1 ATOM 2343 C C . LEU A 1 353 ? 1.432 -19.876 9.027 1.00 42.24 ? 364 LEU A C 1 ATOM 2344 O O . LEU A 1 353 ? 0.299 -19.852 9.500 1.00 50.54 ? 364 LEU A O 1 ATOM 2345 C CB . LEU A 1 353 ? 2.987 -20.913 10.673 1.00 48.49 ? 364 LEU A CB 1 ATOM 2346 C CG . LEU A 1 353 ? 4.275 -21.014 11.498 1.00 46.74 ? 364 LEU A CG 1 ATOM 2347 C CD1 . LEU A 1 353 ? 5.358 -20.077 10.970 1.00 41.58 ? 364 LEU A CD1 1 ATOM 2348 C CD2 . LEU A 1 353 ? 4.008 -20.771 12.975 1.00 61.91 ? 364 LEU A CD2 1 ATOM 2349 N N . PRO A 1 354 ? 1.672 -20.121 7.733 1.00 35.09 ? 365 PRO A N 1 ATOM 2350 C CA . PRO A 1 354 ? 0.606 -20.506 6.804 1.00 43.97 ? 365 PRO A CA 1 ATOM 2351 C C . PRO A 1 354 ? -0.182 -21.688 7.350 1.00 47.83 ? 365 PRO A C 1 ATOM 2352 O O . PRO A 1 354 ? 0.415 -22.675 7.779 1.00 52.50 ? 365 PRO A O 1 ATOM 2353 C CB . PRO A 1 354 ? 1.375 -20.934 5.555 1.00 27.92 ? 365 PRO A CB 1 ATOM 2354 C CG . PRO A 1 354 ? 2.631 -20.157 5.614 1.00 28.46 ? 365 PRO A CG 1 ATOM 2355 C CD . PRO A 1 354 ? 2.980 -20.020 7.065 1.00 31.65 ? 365 PRO A CD 1 ATOM 2356 N N . GLY A 1 355 ? -1.504 -21.577 7.360 1.00 44.17 ? 366 GLY A N 1 ATOM 2357 C CA . GLY A 1 355 ? -2.340 -22.671 7.808 1.00 51.14 ? 366 GLY A CA 1 ATOM 2358 C C . GLY A 1 355 ? -2.752 -22.612 9.263 1.00 53.84 ? 366 GLY A C 1 ATOM 2359 O O . GLY A 1 355 ? -3.622 -23.375 9.683 1.00 66.54 ? 366 GLY A O 1 ATOM 2360 N N . ASN A 1 356 ? -2.144 -21.716 10.035 1.00 36.60 ? 367 ASN A N 1 ATOM 2361 C CA . ASN A 1 356 ? -2.453 -21.646 11.462 1.00 49.73 ? 367 ASN A CA 1 ATOM 2362 C C . ASN A 1 356 ? -3.907 -21.263 11.705 1.00 42.65 ? 367 ASN A C 1 ATOM 2363 O O . ASN A 1 356 ? -4.440 -20.356 11.070 1.00 51.42 ? 367 ASN A O 1 ATOM 2364 C CB . ASN A 1 356 ? -1.482 -20.729 12.226 1.00 31.70 ? 367 ASN A CB 1 ATOM 2365 C CG . ASN A 1 356 ? -1.780 -19.259 12.033 1.00 50.85 ? 367 ASN A CG 1 ATOM 2366 O OD1 . ASN A 1 356 ? -2.686 -18.713 12.657 1.00 61.97 ? 367 ASN A OD1 1 ATOM 2367 N ND2 . ASN A 1 356 ? -1.002 -18.603 11.181 1.00 65.08 ? 367 ASN A ND2 1 ATOM 2368 N N . GLY A 1 357 ? -4.552 -21.990 12.607 1.00 46.67 ? 368 GLY A N 1 ATOM 2369 C CA . GLY A 1 357 ? -5.953 -21.765 12.894 1.00 51.76 ? 368 GLY A CA 1 ATOM 2370 C C . GLY A 1 357 ? -6.865 -22.583 12.007 1.00 51.11 ? 368 GLY A C 1 ATOM 2371 O O . GLY A 1 357 ? -8.045 -22.755 12.306 1.00 66.80 ? 368 GLY A O 1 ATOM 2372 N N . LYS A 1 358 ? -6.317 -23.096 10.913 1.00 40.59 ? 369 LYS A N 1 ATOM 2373 C CA . LYS A 1 358 ? -7.111 -23.860 9.961 1.00 51.29 ? 369 LYS A CA 1 ATOM 2374 C C . LYS A 1 358 ? -6.855 -25.357 10.096 1.00 48.32 ? 369 LYS A C 1 ATOM 2375 O O . LYS A 1 358 ? -5.755 -25.773 10.452 1.00 46.89 ? 369 LYS A O 1 ATOM 2376 C CB . LYS A 1 358 ? -6.861 -23.358 8.539 1.00 43.44 ? 369 LYS A CB 1 ATOM 2377 C CG . LYS A 1 358 ? -7.385 -21.945 8.327 1.00 41.84 ? 369 LYS A CG 1 ATOM 2378 C CD . LYS A 1 358 ? -7.000 -21.390 6.975 1.00 46.38 ? 369 LYS A CD 1 ATOM 2379 C CE . LYS A 1 358 ? -7.352 -19.915 6.872 1.00 46.66 ? 369 LYS A CE 1 ATOM 2380 N NZ . LYS A 1 358 ? -6.487 -19.083 7.750 1.00 47.21 ? 369 LYS A NZ 1 ATOM 2381 N N . TYR A 1 359 ? -7.879 -26.156 9.811 1.00 38.30 ? 370 TYR A N 1 ATOM 2382 C CA . TYR A 1 359 ? -7.882 -27.572 10.174 1.00 47.69 ? 370 TYR A CA 1 ATOM 2383 C C . TYR A 1 359 ? -8.817 -28.397 9.288 1.00 46.62 ? 370 TYR A C 1 ATOM 2384 O O . TYR A 1 359 ? -9.859 -27.920 8.843 1.00 40.12 ? 370 TYR A O 1 ATOM 2385 C CB . TYR A 1 359 ? -8.308 -27.721 11.639 1.00 34.88 ? 370 TYR A CB 1 ATOM 2386 C CG . TYR A 1 359 ? -9.617 -27.021 11.942 1.00 36.32 ? 370 TYR A CG 1 ATOM 2387 C CD1 . TYR A 1 359 ? -10.825 -27.693 11.832 1.00 45.24 ? 370 TYR A CD1 1 ATOM 2388 C CD2 . TYR A 1 359 ? -9.647 -25.677 12.311 1.00 41.15 ? 370 TYR A CD2 1 ATOM 2389 C CE1 . TYR A 1 359 ? -12.027 -27.058 12.087 1.00 43.16 ? 370 TYR A CE1 1 ATOM 2390 C CE2 . TYR A 1 359 ? -10.849 -25.031 12.565 1.00 43.14 ? 370 TYR A CE2 1 ATOM 2391 C CZ . TYR A 1 359 ? -12.035 -25.732 12.451 1.00 47.25 ? 370 TYR A CZ 1 ATOM 2392 O OH . TYR A 1 359 ? -13.238 -25.115 12.704 1.00 58.36 ? 370 TYR A OH 1 ATOM 2393 N N . ALA A 1 360 ? -8.442 -29.646 9.046 1.00 53.73 ? 371 ALA A N 1 ATOM 2394 C CA . ALA A 1 360 ? -9.285 -30.560 8.294 1.00 44.85 ? 371 ALA A CA 1 ATOM 2395 C C . ALA A 1 360 ? -10.407 -31.075 9.186 1.00 51.99 ? 371 ALA A C 1 ATOM 2396 O O . ALA A 1 360 ? -10.189 -31.330 10.369 1.00 57.85 ? 371 ALA A O 1 ATOM 2397 C CB . ALA A 1 360 ? -8.460 -31.711 7.774 1.00 37.94 ? 371 ALA A CB 1 ATOM 2398 N N . GLY A 1 361 ? -11.604 -31.214 8.621 1.00 51.80 ? 372 GLY A N 1 ATOM 2399 C CA . GLY A 1 361 ? -12.758 -31.710 9.358 1.00 43.63 ? 372 GLY A CA 1 ATOM 2400 C C . GLY A 1 361 ? -13.059 -30.930 10.625 1.00 53.12 ? 372 GLY A C 1 ATOM 2401 O O . GLY A 1 361 ? -13.052 -29.701 10.621 1.00 57.13 ? 372 GLY A O 1 ATOM 2402 N N . ASN A 1 362 ? -13.326 -31.648 11.713 1.00 56.05 ? 373 ASN A N 1 ATOM 2403 C CA . ASN A 1 362 ? -13.540 -31.023 13.013 1.00 57.91 ? 373 ASN A CA 1 ATOM 2404 C C . ASN A 1 362 ? -12.328 -31.194 13.925 1.00 59.17 ? 373 ASN A C 1 ATOM 2405 O O . ASN A 1 362 ? -12.407 -30.954 15.128 1.00 57.22 ? 373 ASN A O 1 ATOM 2406 C CB . ASN A 1 362 ? -14.793 -31.583 13.689 1.00 68.20 ? 373 ASN A CB 1 ATOM 2407 C CG . ASN A 1 362 ? -14.787 -33.100 13.765 1.00 95.53 ? 373 ASN A CG 1 ATOM 2408 O OD1 . ASN A 1 362 ? -13.770 -33.745 13.499 1.00 100.79 ? 373 ASN A OD1 1 ATOM 2409 N ND2 . ASN A 1 362 ? -15.928 -33.679 14.128 1.00 103.84 ? 373 ASN A ND2 1 ATOM 2410 N N . HIS A 1 363 ? -11.207 -31.609 13.345 1.00 51.21 ? 374 HIS A N 1 ATOM 2411 C CA . HIS A 1 363 ? -9.981 -31.826 14.109 1.00 57.58 ? 374 HIS A CA 1 ATOM 2412 C C . HIS A 1 363 ? -9.341 -30.499 14.530 1.00 60.24 ? 374 HIS A C 1 ATOM 2413 O O . HIS A 1 363 ? -8.300 -30.105 14.012 1.00 36.65 ? 374 HIS A O 1 ATOM 2414 C CB . HIS A 1 363 ? -8.996 -32.671 13.298 1.00 41.02 ? 374 HIS A CB 1 ATOM 2415 C CG . HIS A 1 363 ? -7.725 -32.984 14.021 1.00 62.50 ? 374 HIS A CG 1 ATOM 2416 N ND1 . HIS A 1 363 ? -7.704 -33.561 15.273 1.00 71.94 ? 374 HIS A ND1 1 ATOM 2417 C CD2 . HIS A 1 363 ? -6.430 -32.802 13.668 1.00 71.35 ? 374 HIS A CD2 1 ATOM 2418 C CE1 . HIS A 1 363 ? -6.451 -33.721 15.659 1.00 77.77 ? 374 HIS A CE1 1 ATOM 2419 N NE2 . HIS A 1 363 ? -5.658 -33.268 14.704 1.00 72.76 ? 374 HIS A NE2 1 ATOM 2420 N N . LYS A 1 364 ? -9.969 -29.830 15.491 1.00 55.39 ? 375 LYS A N 1 ATOM 2421 C CA . LYS A 1 364 ? -9.574 -28.491 15.922 1.00 45.38 ? 375 LYS A CA 1 ATOM 2422 C C . LYS A 1 364 ? -8.112 -28.310 16.336 1.00 44.26 ? 375 LYS A C 1 ATOM 2423 O O . LYS A 1 364 ? -7.614 -27.186 16.350 1.00 54.69 ? 375 LYS A O 1 ATOM 2424 C CB . LYS A 1 364 ? -10.472 -28.038 17.081 1.00 44.37 ? 375 LYS A CB 1 ATOM 2425 C CG . LYS A 1 364 ? -11.492 -26.966 16.714 1.00 45.65 ? 375 LYS A CG 1 ATOM 2426 C CD . LYS A 1 364 ? -12.460 -27.451 15.647 1.00 50.52 ? 375 LYS A CD 1 ATOM 2427 C CE . LYS A 1 364 ? -13.654 -26.524 15.550 1.00 50.51 ? 375 LYS A CE 1 ATOM 2428 N NZ . LYS A 1 364 ? -14.262 -26.314 16.893 1.00 48.53 ? 375 LYS A NZ 1 ATOM 2429 N N . TYR A 1 365 ? -7.420 -29.406 16.631 1.00 49.38 ? 376 TYR A N 1 ATOM 2430 C CA . TYR A 1 365 ? -6.217 -29.354 17.466 1.00 54.37 ? 376 TYR A CA 1 ATOM 2431 C C . TYR A 1 365 ? -4.865 -29.734 16.831 1.00 71.27 ? 376 TYR A C 1 ATOM 2432 O O . TYR A 1 365 ? -4.150 -30.541 17.419 1.00 107.16 ? 376 TYR A O 1 ATOM 2433 C CB . TYR A 1 365 ? -6.455 -30.305 18.648 1.00 62.23 ? 376 TYR A CB 1 ATOM 2434 C CG . TYR A 1 365 ? -5.807 -29.956 19.974 1.00 65.23 ? 376 TYR A CG 1 ATOM 2435 C CD1 . TYR A 1 365 ? -4.677 -29.151 20.049 1.00 69.33 ? 376 TYR A CD1 1 ATOM 2436 C CD2 . TYR A 1 365 ? -6.334 -30.454 21.161 1.00 59.29 ? 376 TYR A CD2 1 ATOM 2437 C CE1 . TYR A 1 365 ? -4.098 -28.850 21.270 1.00 68.38 ? 376 TYR A CE1 1 ATOM 2438 C CE2 . TYR A 1 365 ? -5.768 -30.156 22.379 1.00 60.17 ? 376 TYR A CE2 1 ATOM 2439 C CZ . TYR A 1 365 ? -4.653 -29.357 22.431 1.00 69.17 ? 376 TYR A CZ 1 ATOM 2440 O OH . TYR A 1 365 ? -4.096 -29.069 23.654 1.00 73.55 ? 376 TYR A OH 1 ATOM 2441 N N . GLY A 1 366 ? -4.471 -29.194 15.678 1.00 56.02 ? 377 GLY A N 1 ATOM 2442 C CA . GLY A 1 366 ? -5.235 -28.287 14.850 1.00 66.92 ? 377 GLY A CA 1 ATOM 2443 C C . GLY A 1 366 ? -4.540 -28.092 13.516 1.00 64.02 ? 377 GLY A C 1 ATOM 2444 O O . GLY A 1 366 ? -4.123 -29.056 12.881 1.00 66.16 ? 377 GLY A O 1 ATOM 2445 N N . GLY A 1 367 ? -4.404 -26.840 13.096 1.00 54.09 ? 378 GLY A N 1 ATOM 2446 C CA . GLY A 1 367 ? -4.887 -25.716 13.872 1.00 46.08 ? 378 GLY A CA 1 ATOM 2447 C C . GLY A 1 367 ? -3.785 -25.096 14.705 1.00 55.43 ? 378 GLY A C 1 ATOM 2448 O O . GLY A 1 367 ? -3.374 -23.962 14.454 1.00 57.21 ? 378 GLY A O 1 ATOM 2449 N N . LEU A 1 368 ? -3.301 -25.846 15.693 1.00 43.84 ? 379 LEU A N 1 ATOM 2450 C CA . LEU A 1 368 ? -2.287 -25.341 16.611 1.00 39.34 ? 379 LEU A CA 1 ATOM 2451 C C . LEU A 1 368 ? -0.937 -25.988 16.368 1.00 43.84 ? 379 LEU A C 1 ATOM 2452 O O . LEU A 1 368 ? -0.711 -27.142 16.725 1.00 53.09 ? 379 LEU A O 1 ATOM 2453 C CB . LEU A 1 368 ? -2.711 -25.558 18.062 1.00 46.34 ? 379 LEU A CB 1 ATOM 2454 C CG . LEU A 1 368 ? -4.058 -24.965 18.476 1.00 48.65 ? 379 LEU A CG 1 ATOM 2455 C CD1 . LEU A 1 368 ? -4.272 -25.167 19.962 1.00 39.97 ? 379 LEU A CD1 1 ATOM 2456 C CD2 . LEU A 1 368 ? -4.145 -23.491 18.104 1.00 47.61 ? 379 LEU A CD2 1 ATOM 2457 N N . PHE A 1 369 ? -0.037 -25.234 15.756 1.00 46.95 ? 380 PHE A N 1 ATOM 2458 C CA . PHE A 1 369 ? 1.304 -25.720 15.484 1.00 47.82 ? 380 PHE A CA 1 ATOM 2459 C C . PHE A 1 369 ? 2.245 -24.521 15.446 1.00 41.42 ? 380 PHE A C 1 ATOM 2460 O O . PHE A 1 369 ? 1.827 -23.403 15.156 1.00 45.07 ? 380 PHE A O 1 ATOM 2461 C CB . PHE A 1 369 ? 1.347 -26.528 14.167 1.00 40.55 ? 380 PHE A CB 1 ATOM 2462 C CG . PHE A 1 369 ? 0.864 -25.762 12.968 1.00 38.37 ? 380 PHE A CG 1 ATOM 2463 C CD1 . PHE A 1 369 ? 1.754 -25.049 12.179 1.00 47.57 ? 380 PHE A CD1 1 ATOM 2464 C CD2 . PHE A 1 369 ? -0.481 -25.735 12.639 1.00 47.62 ? 380 PHE A CD2 1 ATOM 2465 C CE1 . PHE A 1 369 ? 1.311 -24.326 11.084 1.00 44.90 ? 380 PHE A CE1 1 ATOM 2466 C CE2 . PHE A 1 369 ? -0.928 -25.013 11.542 1.00 52.89 ? 380 PHE A CE2 1 ATOM 2467 C CZ . PHE A 1 369 ? -0.032 -24.312 10.763 1.00 42.36 ? 380 PHE A CZ 1 ATOM 2468 N N . THR A 1 370 ? 3.511 -24.755 15.756 1.00 39.91 ? 381 THR A N 1 ATOM 2469 C CA . THR A 1 370 ? 4.491 -23.684 15.801 1.00 42.59 ? 381 THR A CA 1 ATOM 2470 C C . THR A 1 370 ? 5.861 -24.209 15.398 1.00 44.90 ? 381 THR A C 1 ATOM 2471 O O . THR A 1 370 ? 6.016 -25.383 15.064 1.00 47.29 ? 381 THR A O 1 ATOM 2472 C CB . THR A 1 370 ? 4.585 -23.072 17.207 1.00 38.44 ? 381 THR A CB 1 ATOM 2473 O OG1 . THR A 1 370 ? 5.423 -21.911 17.172 1.00 47.06 ? 381 THR A OG1 1 ATOM 2474 C CG2 . THR A 1 370 ? 5.164 -24.078 18.176 1.00 31.58 ? 381 THR A CG2 1 ATOM 2475 N N . ASN A 1 371 ? 6.855 -23.332 15.433 1.00 42.27 ? 382 ASN A N 1 ATOM 2476 C CA . ASN A 1 371 ? 8.197 -23.697 15.014 1.00 46.48 ? 382 ASN A CA 1 ATOM 2477 C C . ASN A 1 371 ? 8.880 -24.620 16.005 1.00 46.03 ? 382 ASN A C 1 ATOM 2478 O O . ASN A 1 371 ? 8.872 -24.375 17.213 1.00 64.18 ? 382 ASN A O 1 ATOM 2479 C CB . ASN A 1 371 ? 9.051 -22.448 14.808 1.00 55.48 ? 382 ASN A CB 1 ATOM 2480 C CG . ASN A 1 371 ? 8.427 -21.470 13.833 1.00 57.31 ? 382 ASN A CG 1 ATOM 2481 O OD1 . ASN A 1 371 ? 7.692 -20.560 14.229 1.00 56.99 ? 382 ASN A OD1 1 ATOM 2482 N ND2 . ASN A 1 371 ? 8.718 -21.651 12.550 1.00 52.65 ? 382 ASN A ND2 1 ATOM 2483 N N . GLY A 1 372 ? 9.463 -25.692 15.488 1.00 37.58 ? 383 GLY A N 1 ATOM 2484 C CA . GLY A 1 372 ? 10.337 -26.524 16.289 1.00 35.75 ? 383 GLY A CA 1 ATOM 2485 C C . GLY A 1 372 ? 11.778 -26.137 16.019 1.00 43.55 ? 383 GLY A C 1 ATOM 2486 O O . GLY A 1 372 ? 12.109 -24.957 15.889 1.00 60.04 ? 383 GLY A O 1 ATOM 2487 N N . GLU A 1 373 ? 12.635 -27.142 15.933 1.00 44.55 ? 384 GLU A N 1 ATOM 2488 C CA . GLU A 1 373 ? 14.019 -26.947 15.538 1.00 51.67 ? 384 GLU A CA 1 ATOM 2489 C C . GLU A 1 373 ? 14.230 -27.613 14.182 1.00 50.33 ? 384 GLU A C 1 ATOM 2490 O O . GLU A 1 373 ? 13.398 -28.401 13.742 1.00 52.66 ? 384 GLU A O 1 ATOM 2491 C CB . GLU A 1 373 ? 14.945 -27.568 16.579 1.00 44.98 ? 384 GLU A CB 1 ATOM 2492 C CG . GLU A 1 373 ? 14.703 -29.049 16.775 1.00 55.36 ? 384 GLU A CG 1 ATOM 2493 C CD . GLU A 1 373 ? 15.214 -29.558 18.104 1.00 57.22 ? 384 GLU A CD 1 ATOM 2494 O OE1 . GLU A 1 373 ? 14.953 -28.905 19.139 1.00 53.88 ? 384 GLU A OE1 1 ATOM 2495 O OE2 . GLU A 1 373 ? 15.873 -30.616 18.108 1.00 50.44 ? 384 GLU A OE2 1 ATOM 2496 N N . ASN A 1 374 ? 15.334 -27.283 13.519 1.00 41.54 ? 385 ASN A N 1 ATOM 2497 C CA . ASN A 1 374 ? 15.682 -27.893 12.239 1.00 43.82 ? 385 ASN A CA 1 ATOM 2498 C C . ASN A 1 374 ? 14.584 -27.784 11.181 1.00 44.80 ? 385 ASN A C 1 ATOM 2499 O O . ASN A 1 374 ? 14.440 -28.661 10.332 1.00 56.66 ? 385 ASN A O 1 ATOM 2500 C CB . ASN A 1 374 ? 16.091 -29.354 12.441 1.00 53.43 ? 385 ASN A CB 1 ATOM 2501 C CG . ASN A 1 374 ? 17.191 -29.510 13.475 1.00 57.64 ? 385 ASN A CG 1 ATOM 2502 O OD1 . ASN A 1 374 ? 18.159 -28.751 13.489 1.00 48.54 ? 385 ASN A OD1 1 ATOM 2503 N ND2 . ASN A 1 374 ? 17.038 -30.490 14.356 1.00 64.16 ? 385 ASN A ND2 1 ATOM 2504 N N . GLY A 1 375 ? 13.806 -26.709 11.248 1.00 42.21 ? 386 GLY A N 1 ATOM 2505 C CA . GLY A 1 375 ? 12.836 -26.402 10.213 1.00 34.09 ? 386 GLY A CA 1 ATOM 2506 C C . GLY A 1 375 ? 11.539 -27.175 10.304 1.00 48.85 ? 386 GLY A C 1 ATOM 2507 O O . GLY A 1 375 ? 10.726 -27.155 9.377 1.00 57.71 ? 386 GLY A O 1 ATOM 2508 N N . ALA A 1 376 ? 11.344 -27.859 11.423 1.00 51.43 ? 387 ALA A N 1 ATOM 2509 C CA . ALA A 1 376 ? 10.137 -28.639 11.639 1.00 44.67 ? 387 ALA A CA 1 ATOM 2510 C C . ALA A 1 376 ? 9.010 -27.753 12.135 1.00 48.22 ? 387 ALA A C 1 ATOM 2511 O O . ALA A 1 376 ? 9.250 -26.739 12.787 1.00 54.78 ? 387 ALA A O 1 ATOM 2512 C CB . ALA A 1 376 ? 10.404 -29.736 12.647 1.00 46.09 ? 387 ALA A CB 1 ATOM 2513 N N . LEU A 1 377 ? 7.778 -28.144 11.831 1.00 46.88 ? 388 LEU A N 1 ATOM 2514 C CA . LEU A 1 377 ? 6.616 -27.539 12.467 1.00 43.34 ? 388 LEU A CA 1 ATOM 2515 C C . LEU A 1 377 ? 6.021 -28.548 13.444 1.00 47.54 ? 388 LEU A C 1 ATOM 2516 O O . LEU A 1 377 ? 5.733 -29.677 13.062 1.00 57.16 ? 388 LEU A O 1 ATOM 2517 C CB . LEU A 1 377 ? 5.584 -27.125 11.420 1.00 37.68 ? 388 LEU A CB 1 ATOM 2518 C CG . LEU A 1 377 ? 6.084 -26.080 10.426 1.00 39.08 ? 388 LEU A CG 1 ATOM 2519 C CD1 . LEU A 1 377 ? 4.988 -25.712 9.442 1.00 38.52 ? 388 LEU A CD1 1 ATOM 2520 C CD2 . LEU A 1 377 ? 6.597 -24.849 11.164 1.00 43.00 ? 388 LEU A CD2 1 ATOM 2521 N N . VAL A 1 378 ? 5.848 -28.144 14.701 1.00 48.04 ? 389 VAL A N 1 ATOM 2522 C CA . VAL A 1 378 ? 5.414 -29.061 15.761 1.00 39.91 ? 389 VAL A CA 1 ATOM 2523 C C . VAL A 1 378 ? 4.022 -28.740 16.291 1.00 39.90 ? 389 VAL A C 1 ATOM 2524 O O . VAL A 1 378 ? 3.692 -27.584 16.539 1.00 40.14 ? 389 VAL A O 1 ATOM 2525 C CB . VAL A 1 378 ? 6.404 -29.066 16.928 1.00 38.23 ? 389 VAL A CB 1 ATOM 2526 C CG1 . VAL A 1 378 ? 7.673 -29.752 16.517 1.00 35.16 ? 389 VAL A CG1 1 ATOM 2527 C CG2 . VAL A 1 378 ? 6.703 -27.640 17.373 1.00 48.22 ? 389 VAL A CG2 1 ATOM 2528 N N . GLY A 1 379 ? 3.205 -29.772 16.464 1.00 36.31 ? 390 GLY A N 1 ATOM 2529 C CA . GLY A 1 379 ? 1.815 -29.577 16.831 1.00 37.51 ? 390 GLY A CA 1 ATOM 2530 C C . GLY A 1 379 ? 1.554 -29.680 18.318 1.00 40.67 ? 390 GLY A C 1 ATOM 2531 O O . GLY A 1 379 ? 2.255 -30.390 19.035 1.00 47.51 ? 390 GLY A O 1 ATOM 2532 N N . ALA A 1 380 ? 0.527 -28.977 18.778 1.00 43.47 ? 391 ALA A N 1 ATOM 2533 C CA . ALA A 1 380 ? 0.196 -28.927 20.196 1.00 48.65 ? 391 ALA A CA 1 ATOM 2534 C C . ALA A 1 380 ? -0.460 -30.209 20.719 1.00 59.17 ? 391 ALA A C 1 ATOM 2535 O O . ALA A 1 380 ? -0.536 -30.417 21.929 1.00 67.91 ? 391 ALA A O 1 ATOM 2536 C CB . ALA A 1 380 ? -0.692 -27.729 20.480 1.00 48.62 ? 391 ALA A CB 1 ATOM 2537 N N . GLU A 1 381 ? -0.934 -31.063 19.813 1.00 56.52 ? 392 GLU A N 1 ATOM 2538 C CA . GLU A 1 381 ? -1.641 -32.278 20.216 1.00 60.98 ? 392 GLU A CA 1 ATOM 2539 C C . GLU A 1 381 ? -0.689 -33.409 20.601 1.00 57.72 ? 392 GLU A C 1 ATOM 2540 O O . GLU A 1 381 ? -1.108 -34.422 21.158 1.00 50.91 ? 392 GLU A O 1 ATOM 2541 C CB . GLU A 1 381 ? -2.588 -32.746 19.115 1.00 64.26 ? 392 GLU A CB 1 ATOM 2542 C CG . GLU A 1 381 ? -1.887 -33.124 17.826 1.00 77.36 ? 392 GLU A CG 1 ATOM 2543 C CD . GLU A 1 381 ? -2.861 -33.404 16.703 1.00 82.10 ? 392 GLU A CD 1 ATOM 2544 O OE1 . GLU A 1 381 ? -3.750 -34.265 16.893 1.00 86.44 ? 392 GLU A OE1 1 ATOM 2545 O OE2 . GLU A 1 381 ? -2.743 -32.753 15.639 1.00 59.33 ? 392 GLU A OE2 1 ATOM 2546 N N . TYR A 1 382 ? 0.591 -33.242 20.299 1.00 43.93 ? 393 TYR A N 1 ATOM 2547 C CA . TYR A 1 382 ? 1.582 -34.197 20.766 1.00 49.26 ? 393 TYR A CA 1 ATOM 2548 C C . TYR A 1 382 ? 2.401 -33.554 21.866 1.00 39.43 ? 393 TYR A C 1 ATOM 2549 O O . TYR A 1 382 ? 2.553 -32.341 21.899 1.00 42.41 ? 393 TYR A O 1 ATOM 2550 C CB . TYR A 1 382 ? 2.502 -34.662 19.630 1.00 46.81 ? 393 TYR A CB 1 ATOM 2551 C CG . TYR A 1 382 ? 1.761 -35.152 18.410 1.00 53.56 ? 393 TYR A CG 1 ATOM 2552 C CD1 . TYR A 1 382 ? 0.970 -36.288 18.468 1.00 53.49 ? 393 TYR A CD1 1 ATOM 2553 C CD2 . TYR A 1 382 ? 1.851 -34.475 17.199 1.00 58.30 ? 393 TYR A CD2 1 ATOM 2554 C CE1 . TYR A 1 382 ? 0.286 -36.734 17.360 1.00 61.20 ? 393 TYR A CE1 1 ATOM 2555 C CE2 . TYR A 1 382 ? 1.170 -34.915 16.084 1.00 44.12 ? 393 TYR A CE2 1 ATOM 2556 C CZ . TYR A 1 382 ? 0.388 -36.047 16.171 1.00 54.66 ? 393 TYR A CZ 1 ATOM 2557 O OH . TYR A 1 382 ? -0.296 -36.499 15.068 1.00 59.62 ? 393 TYR A OH 1 ATOM 2558 N N . GLY A 1 383 ? 2.911 -34.374 22.774 1.00 46.07 ? 394 GLY A N 1 ATOM 2559 C CA . GLY A 1 383 ? 3.890 -33.918 23.739 1.00 42.56 ? 394 GLY A CA 1 ATOM 2560 C C . GLY A 1 383 ? 5.265 -34.363 23.282 1.00 49.46 ? 394 GLY A C 1 ATOM 2561 O O . GLY A 1 383 ? 5.393 -35.371 22.588 1.00 52.52 ? 394 GLY A O 1 ATOM 2562 N N . THR A 1 384 ? 6.300 -33.616 23.647 1.00 46.25 ? 395 THR A N 1 ATOM 2563 C CA . THR A 1 384 ? 7.649 -34.046 23.307 1.00 41.55 ? 395 THR A CA 1 ATOM 2564 C C . THR A 1 384 ? 8.291 -34.827 24.450 1.00 47.53 ? 395 THR A C 1 ATOM 2565 O O . THR A 1 384 ? 7.978 -34.600 25.615 1.00 53.99 ? 395 THR A O 1 ATOM 2566 C CB . THR A 1 384 ? 8.571 -32.880 22.877 1.00 33.57 ? 395 THR A CB 1 ATOM 2567 O OG1 . THR A 1 384 ? 9.768 -32.916 23.661 1.00 44.33 ? 395 THR A OG1 1 ATOM 2568 C CG2 . THR A 1 384 ? 7.895 -31.540 23.049 1.00 37.79 ? 395 THR A CG2 1 ATOM 2569 N N . GLY A 1 385 ? 9.180 -35.754 24.103 1.00 47.10 ? 396 GLY A N 1 ATOM 2570 C CA . GLY A 1 385 ? 9.911 -36.538 25.083 1.00 31.50 ? 396 GLY A CA 1 ATOM 2571 C C . GLY A 1 385 ? 11.373 -36.715 24.704 1.00 44.43 ? 396 GLY A C 1 ATOM 2572 O O . GLY A 1 385 ? 11.699 -36.937 23.539 1.00 52.89 ? 396 GLY A O 1 ATOM 2573 N N . VAL A 1 386 ? 12.259 -36.616 25.692 1.00 45.13 ? 397 VAL A N 1 ATOM 2574 C CA . VAL A 1 386 ? 13.692 -36.757 25.456 1.00 40.79 ? 397 VAL A CA 1 ATOM 2575 C C . VAL A 1 386 ? 14.271 -37.940 26.229 1.00 38.82 ? 397 VAL A C 1 ATOM 2576 O O . VAL A 1 386 ? 14.040 -38.088 27.425 1.00 48.02 ? 397 VAL A O 1 ATOM 2577 C CB . VAL A 1 386 ? 14.458 -35.467 25.802 1.00 41.59 ? 397 VAL A CB 1 ATOM 2578 C CG1 . VAL A 1 386 ? 15.958 -35.734 25.873 1.00 35.10 ? 397 VAL A CG1 1 ATOM 2579 C CG2 . VAL A 1 386 ? 14.149 -34.378 24.778 1.00 35.20 ? 397 VAL A CG2 1 ATOM 2580 N N . PHE A 1 387 ? 15.022 -38.780 25.529 1.00 35.30 ? 398 PHE A N 1 ATOM 2581 C CA . PHE A 1 387 ? 15.517 -40.023 26.097 1.00 43.60 ? 398 PHE A CA 1 ATOM 2582 C C . PHE A 1 387 ? 17.010 -40.198 25.876 1.00 45.91 ? 398 PHE A C 1 ATOM 2583 O O . PHE A 1 387 ? 17.553 -39.780 24.858 1.00 52.62 ? 398 PHE A O 1 ATOM 2584 C CB . PHE A 1 387 ? 14.792 -41.214 25.470 1.00 37.61 ? 398 PHE A CB 1 ATOM 2585 C CG . PHE A 1 387 ? 13.298 -41.132 25.556 1.00 37.83 ? 398 PHE A CG 1 ATOM 2586 C CD1 . PHE A 1 387 ? 12.619 -41.713 26.611 1.00 36.72 ? 398 PHE A CD1 1 ATOM 2587 C CD2 . PHE A 1 387 ? 12.571 -40.488 24.571 1.00 32.09 ? 398 PHE A CD2 1 ATOM 2588 C CE1 . PHE A 1 387 ? 11.248 -41.648 26.687 1.00 37.40 ? 398 PHE A CE1 1 ATOM 2589 C CE2 . PHE A 1 387 ? 11.196 -40.422 24.640 1.00 43.57 ? 398 PHE A CE2 1 ATOM 2590 C CZ . PHE A 1 387 ? 10.532 -40.999 25.698 1.00 44.81 ? 398 PHE A CZ 1 ATOM 2591 N N . TYR A 1 388 ? 17.669 -40.828 26.838 1.00 50.88 ? 399 TYR A N 1 ATOM 2592 C CA . TYR A 1 388 ? 19.052 -41.237 26.670 1.00 33.30 ? 399 TYR A CA 1 ATOM 2593 C C . TYR A 1 388 ? 19.152 -42.720 26.960 1.00 37.20 ? 399 TYR A C 1 ATOM 2594 O O . TYR A 1 388 ? 18.775 -43.180 28.037 1.00 49.89 ? 399 TYR A O 1 ATOM 2595 C CB . TYR A 1 388 ? 19.972 -40.466 27.607 1.00 36.69 ? 399 TYR A CB 1 ATOM 2596 C CG . TYR A 1 388 ? 20.159 -39.017 27.246 1.00 36.33 ? 399 TYR A CG 1 ATOM 2597 C CD1 . TYR A 1 388 ? 21.328 -38.579 26.644 1.00 37.47 ? 399 TYR A CD1 1 ATOM 2598 C CD2 . TYR A 1 388 ? 19.172 -38.084 27.517 1.00 29.82 ? 399 TYR A CD2 1 ATOM 2599 C CE1 . TYR A 1 388 ? 21.509 -37.254 26.320 1.00 29.53 ? 399 TYR A CE1 1 ATOM 2600 C CE2 . TYR A 1 388 ? 19.343 -36.763 27.200 1.00 36.86 ? 399 TYR A CE2 1 ATOM 2601 C CZ . TYR A 1 388 ? 20.511 -36.352 26.599 1.00 34.82 ? 399 TYR A CZ 1 ATOM 2602 O OH . TYR A 1 388 ? 20.674 -35.027 26.281 1.00 37.87 ? 399 TYR A OH 1 ATOM 2603 N N . ASP A 1 389 ? 19.638 -43.468 25.982 1.00 47.47 ? 400 ASP A N 1 ATOM 2604 C CA . ASP A 1 389 ? 19.868 -44.889 26.150 1.00 48.59 ? 400 ASP A CA 1 ATOM 2605 C C . ASP A 1 389 ? 21.363 -45.162 26.095 1.00 53.01 ? 400 ASP A C 1 ATOM 2606 O O . ASP A 1 389 ? 21.970 -45.172 25.025 1.00 44.37 ? 400 ASP A O 1 ATOM 2607 C CB . ASP A 1 389 ? 19.123 -45.683 25.082 1.00 45.39 ? 400 ASP A CB 1 ATOM 2608 C CG . ASP A 1 389 ? 17.631 -45.699 25.316 1.00 51.40 ? 400 ASP A CG 1 ATOM 2609 O OD1 . ASP A 1 389 ? 17.144 -44.815 26.044 1.00 56.89 ? 400 ASP A OD1 1 ATOM 2610 O OD2 . ASP A 1 389 ? 16.944 -46.594 24.785 1.00 58.24 ? 400 ASP A OD2 1 ATOM 2611 N N . GLU A 1 390 ? 21.951 -45.367 27.267 1.00 56.33 ? 401 GLU A N 1 ATOM 2612 C CA . GLU A 1 390 ? 23.383 -45.570 27.377 1.00 45.60 ? 401 GLU A CA 1 ATOM 2613 C C . GLU A 1 390 ? 23.666 -47.063 27.486 1.00 41.31 ? 401 GLU A C 1 ATOM 2614 O O . GLU A 1 390 ? 22.945 -47.783 28.167 1.00 56.49 ? 401 GLU A O 1 ATOM 2615 C CB . GLU A 1 390 ? 23.922 -44.807 28.588 1.00 40.53 ? 401 GLU A CB 1 ATOM 2616 C CG . GLU A 1 390 ? 25.248 -44.104 28.354 1.00 40.42 ? 401 GLU A CG 1 ATOM 2617 C CD . GLU A 1 390 ? 25.418 -42.867 29.217 1.00 51.06 ? 401 GLU A CD 1 ATOM 2618 O OE1 . GLU A 1 390 ? 24.451 -42.093 29.354 1.00 55.43 ? 401 GLU A OE1 1 ATOM 2619 O OE2 . GLU A 1 390 ? 26.521 -42.666 29.761 1.00 62.55 ? 401 GLU A OE2 1 ATOM 2620 N N . THR A 1 391 ? 24.699 -47.526 26.787 1.00 55.44 ? 402 THR A N 1 ATOM 2621 C CA . THR A 1 391 ? 25.070 -48.940 26.795 1.00 53.57 ? 402 THR A CA 1 ATOM 2622 C C . THR A 1 391 ? 26.569 -49.104 27.030 1.00 55.87 ? 402 THR A C 1 ATOM 2623 O O . THR A 1 391 ? 27.388 -48.741 26.183 1.00 52.72 ? 402 THR A O 1 ATOM 2624 C CB . THR A 1 391 ? 24.658 -49.649 25.488 1.00 37.57 ? 402 THR A CB 1 ATOM 2625 O OG1 . THR A 1 391 ? 23.232 -49.629 25.366 1.00 45.30 ? 402 THR A OG1 1 ATOM 2626 C CG2 . THR A 1 391 ? 25.124 -51.102 25.483 1.00 36.34 ? 402 THR A CG2 1 ATOM 2627 N N . HIS A 1 392 ? 26.919 -49.651 28.190 1.00 42.99 ? 403 HIS A N 1 ATOM 2628 C CA . HIS A 1 392 ? 28.314 -49.775 28.591 1.00 39.03 ? 403 HIS A CA 1 ATOM 2629 C C . HIS A 1 392 ? 28.749 -51.224 28.482 1.00 41.61 ? 403 HIS A C 1 ATOM 2630 O O . HIS A 1 392 ? 28.226 -52.086 29.179 1.00 50.42 ? 403 HIS A O 1 ATOM 2631 C CB . HIS A 1 392 ? 28.514 -49.281 30.027 1.00 34.34 ? 403 HIS A CB 1 ATOM 2632 C CG . HIS A 1 392 ? 28.133 -47.848 30.240 1.00 50.89 ? 403 HIS A CG 1 ATOM 2633 N ND1 . HIS A 1 392 ? 28.344 -47.194 31.434 1.00 43.32 ? 403 HIS A ND1 1 ATOM 2634 C CD2 . HIS A 1 392 ? 27.554 -46.943 29.413 1.00 57.30 ? 403 HIS A CD2 1 ATOM 2635 C CE1 . HIS A 1 392 ? 27.912 -45.949 31.335 1.00 44.42 ? 403 HIS A CE1 1 ATOM 2636 N NE2 . HIS A 1 392 ? 27.426 -45.772 30.119 1.00 45.17 ? 403 HIS A NE2 1 ATOM 2637 N N . THR A 1 393 ? 29.712 -51.490 27.609 1.00 39.80 ? 404 THR A N 1 ATOM 2638 C CA . THR A 1 393 ? 30.137 -52.858 27.360 1.00 36.63 ? 404 THR A CA 1 ATOM 2639 C C . THR A 1 393 ? 31.628 -53.033 27.571 1.00 44.30 ? 404 THR A C 1 ATOM 2640 O O . THR A 1 393 ? 32.434 -52.316 26.984 1.00 50.72 ? 404 THR A O 1 ATOM 2641 C CB . THR A 1 393 ? 29.775 -53.302 25.931 1.00 48.78 ? 404 THR A CB 1 ATOM 2642 O OG1 . THR A 1 393 ? 28.360 -53.179 25.738 1.00 38.35 ? 404 THR A OG1 1 ATOM 2643 C CG2 . THR A 1 393 ? 30.195 -54.747 25.697 1.00 54.48 ? 404 THR A CG2 1 ATOM 2644 N N . LYS A 1 394 ? 31.987 -53.982 28.429 1.00 44.81 ? 405 LYS A N 1 ATOM 2645 C CA . LYS A 1 394 ? 33.382 -54.350 28.615 1.00 32.92 ? 405 LYS A CA 1 ATOM 2646 C C . LYS A 1 394 ? 33.625 -55.772 28.132 1.00 46.67 ? 405 LYS A C 1 ATOM 2647 O O . LYS A 1 394 ? 32.866 -56.689 28.450 1.00 54.60 ? 405 LYS A O 1 ATOM 2648 C CB . LYS A 1 394 ? 33.806 -54.217 30.082 1.00 49.92 ? 405 LYS A CB 1 ATOM 2649 C CG . LYS A 1 394 ? 35.191 -54.792 30.351 1.00 41.92 ? 405 LYS A CG 1 ATOM 2650 C CD . LYS A 1 394 ? 35.608 -54.682 31.803 1.00 49.78 ? 405 LYS A CD 1 ATOM 2651 C CE . LYS A 1 394 ? 36.953 -55.357 32.009 1.00 44.75 ? 405 LYS A CE 1 ATOM 2652 N NZ . LYS A 1 394 ? 37.413 -55.283 33.419 1.00 59.91 ? 405 LYS A NZ 1 ATOM 2653 N N . SER A 1 395 ? 34.684 -55.943 27.351 1.00 41.15 ? 406 SER A N 1 ATOM 2654 C CA . SER A 1 395 ? 35.076 -57.253 26.865 1.00 48.57 ? 406 SER A CA 1 ATOM 2655 C C . SER A 1 395 ? 36.548 -57.495 27.173 1.00 58.92 ? 406 SER A C 1 ATOM 2656 O O . SER A 1 395 ? 37.406 -56.671 26.856 1.00 69.41 ? 406 SER A O 1 ATOM 2657 C CB . SER A 1 395 ? 34.816 -57.361 25.365 1.00 53.40 ? 406 SER A CB 1 ATOM 2658 O OG . SER A 1 395 ? 35.687 -58.301 24.765 1.00 73.51 ? 406 SER A OG 1 ATOM 2659 N N . ARG A 1 396 ? 36.837 -58.630 27.798 1.00 48.77 ? 407 ARG A N 1 ATOM 2660 C CA . ARG A 1 396 ? 38.202 -58.948 28.190 1.00 53.80 ? 407 ARG A CA 1 ATOM 2661 C C . ARG A 1 396 ? 38.578 -60.350 27.757 1.00 56.16 ? 407 ARG A C 1 ATOM 2662 O O . ARG A 1 396 ? 37.820 -61.296 27.948 1.00 69.63 ? 407 ARG A O 1 ATOM 2663 C CB . ARG A 1 396 ? 38.367 -58.813 29.705 1.00 60.35 ? 407 ARG A CB 1 ATOM 2664 C CG . ARG A 1 396 ? 39.538 -59.584 30.286 1.00 67.30 ? 407 ARG A CG 1 ATOM 2665 C CD . ARG A 1 396 ? 40.717 -58.681 30.592 1.00 79.49 ? 407 ARG A CD 1 ATOM 2666 N NE . ARG A 1 396 ? 41.767 -59.382 31.331 1.00 83.58 ? 407 ARG A NE 1 ATOM 2667 C CZ . ARG A 1 396 ? 41.792 -59.514 32.655 1.00 72.40 ? 407 ARG A CZ 1 ATOM 2668 N NH1 . ARG A 1 396 ? 40.819 -58.998 33.395 1.00 70.72 ? 407 ARG A NH1 1 ATOM 2669 N NH2 . ARG A 1 396 ? 42.789 -60.164 33.241 1.00 66.08 ? 407 ARG A NH2 1 ATOM 2670 N N . TYR A 1 397 ? 39.754 -60.478 27.162 1.00 55.63 ? 408 TYR A N 1 ATOM 2671 C CA . TYR A 1 397 ? 40.298 -61.784 26.842 1.00 50.25 ? 408 TYR A CA 1 ATOM 2672 C C . TYR A 1 397 ? 41.771 -61.797 27.211 1.00 60.17 ? 408 TYR A C 1 ATOM 2673 O O . TYR A 1 397 ? 42.533 -60.937 26.773 1.00 69.63 ? 408 TYR A O 1 ATOM 2674 C CB . TYR A 1 397 ? 40.111 -62.104 25.364 1.00 53.32 ? 408 TYR A CB 1 ATOM 2675 C CG . TYR A 1 397 ? 40.793 -63.383 24.948 1.00 92.15 ? 408 TYR A CG 1 ATOM 2676 C CD1 . TYR A 1 397 ? 40.360 -64.611 25.433 1.00 100.95 ? 408 TYR A CD1 1 ATOM 2677 C CD2 . TYR A 1 397 ? 41.875 -63.366 24.076 1.00 103.20 ? 408 TYR A CD2 1 ATOM 2678 C CE1 . TYR A 1 397 ? 40.982 -65.786 25.061 1.00 97.90 ? 408 TYR A CE1 1 ATOM 2679 C CE2 . TYR A 1 397 ? 42.503 -64.537 23.696 1.00 103.83 ? 408 TYR A CE2 1 ATOM 2680 C CZ . TYR A 1 397 ? 42.050 -65.744 24.191 1.00 91.46 ? 408 TYR A CZ 1 ATOM 2681 O OH . TYR A 1 397 ? 42.668 -66.912 23.818 1.00 70.81 ? 408 TYR A OH 1 ATOM 2682 N N . GLY A 1 398 ? 42.171 -62.765 28.027 1.00 63.11 ? 409 GLY A N 1 ATOM 2683 C CA . GLY A 1 398 ? 43.539 -62.803 28.504 1.00 55.02 ? 409 GLY A CA 1 ATOM 2684 C C . GLY A 1 398 ? 44.110 -64.182 28.756 1.00 61.42 ? 409 GLY A C 1 ATOM 2685 O O . GLY A 1 398 ? 43.384 -65.136 29.034 1.00 65.15 ? 409 GLY A O 1 ATOM 2686 N N . LEU A 1 399 ? 45.431 -64.277 28.653 1.00 69.27 ? 410 LEU A N 1 ATOM 2687 C CA . LEU A 1 399 ? 46.157 -65.502 28.957 1.00 65.11 ? 410 LEU A CA 1 ATOM 2688 C C . LEU A 1 399 ? 47.256 -65.182 29.962 1.00 63.69 ? 410 LEU A C 1 ATOM 2689 O O . LEU A 1 399 ? 47.868 -64.117 29.893 1.00 79.85 ? 410 LEU A O 1 ATOM 2690 C CB . LEU A 1 399 ? 46.771 -66.087 27.684 1.00 63.66 ? 410 LEU A CB 1 ATOM 2691 C CG . LEU A 1 399 ? 45.958 -67.098 26.871 1.00 72.77 ? 410 LEU A CG 1 ATOM 2692 C CD1 . LEU A 1 399 ? 44.639 -66.523 26.411 1.00 71.02 ? 410 LEU A CD1 1 ATOM 2693 C CD2 . LEU A 1 399 ? 46.765 -67.572 25.675 1.00 79.54 ? 410 LEU A CD2 1 ATOM 2694 N N . GLU A 1 400 ? 47.504 -66.094 30.899 1.00 65.66 ? 411 GLU A N 1 ATOM 2695 C CA . GLU A 1 400 ? 48.562 -65.895 31.887 1.00 56.30 ? 411 GLU A CA 1 ATOM 2696 C C . GLU A 1 400 ? 49.361 -67.163 32.170 1.00 66.06 ? 411 GLU A C 1 ATOM 2697 O O . GLU A 1 400 ? 48.818 -68.269 32.182 1.00 69.34 ? 411 GLU A O 1 ATOM 2698 C CB . GLU A 1 400 ? 47.992 -65.353 33.198 1.00 58.68 ? 411 GLU A CB 1 ATOM 2699 C CG . GLU A 1 400 ? 47.122 -66.343 33.955 1.00 68.89 ? 411 GLU A CG 1 ATOM 2700 C CD . GLU A 1 400 ? 46.707 -65.834 35.322 1.00 78.41 ? 411 GLU A CD 1 ATOM 2701 O OE1 . GLU A 1 400 ? 47.454 -65.024 35.913 1.00 67.45 ? 411 GLU A OE1 1 ATOM 2702 O OE2 . GLU A 1 400 ? 45.629 -66.242 35.805 1.00 89.83 ? 411 GLU A OE2 1 ATOM 2703 N N . TYR A 1 401 ? 50.661 -66.988 32.379 1.00 67.23 ? 412 TYR A N 1 ATOM 2704 C CA . TYR A 1 401 ? 51.517 -68.041 32.911 1.00 65.89 ? 412 TYR A CA 1 ATOM 2705 C C . TYR A 1 401 ? 52.051 -67.583 34.262 1.00 76.21 ? 412 TYR A C 1 ATOM 2706 O O . TYR A 1 401 ? 52.559 -66.465 34.392 1.00 72.26 ? 412 TYR A O 1 ATOM 2707 C CB . TYR A 1 401 ? 52.684 -68.339 31.972 1.00 63.96 ? 412 TYR A CB 1 ATOM 2708 C CG . TYR A 1 401 ? 53.828 -69.053 32.659 1.00 66.43 ? 412 TYR A CG 1 ATOM 2709 C CD1 . TYR A 1 401 ? 53.799 -70.427 32.849 1.00 68.84 ? 412 TYR A CD1 1 ATOM 2710 C CD2 . TYR A 1 401 ? 54.935 -68.350 33.125 1.00 66.55 ? 412 TYR A CD2 1 ATOM 2711 C CE1 . TYR A 1 401 ? 54.839 -71.083 33.480 1.00 71.22 ? 412 TYR A CE1 1 ATOM 2712 C CE2 . TYR A 1 401 ? 55.976 -68.996 33.759 1.00 71.05 ? 412 TYR A CE2 1 ATOM 2713 C CZ . TYR A 1 401 ? 55.924 -70.364 33.934 1.00 76.67 ? 412 TYR A CZ 1 ATOM 2714 O OH . TYR A 1 401 ? 56.960 -71.015 34.564 1.00 73.71 ? 412 TYR A OH 1 ATOM 2715 N N . VAL A 1 402 ? 51.937 -68.443 35.267 1.00 64.42 ? 413 VAL A N 1 ATOM 2716 C CA . VAL A 1 402 ? 52.359 -68.081 36.614 1.00 69.45 ? 413 VAL A CA 1 ATOM 2717 C C . VAL A 1 402 ? 53.342 -69.090 37.181 1.00 67.75 ? 413 VAL A C 1 ATOM 2718 O O . VAL A 1 402 ? 53.048 -70.281 37.254 1.00 69.57 ? 413 VAL A O 1 ATOM 2719 C CB . VAL A 1 402 ? 51.156 -67.953 37.566 1.00 72.68 ? 413 VAL A CB 1 ATOM 2720 C CG1 . VAL A 1 402 ? 51.634 -67.737 38.996 1.00 65.93 ? 413 VAL A CG1 1 ATOM 2721 C CG2 . VAL A 1 402 ? 50.239 -66.814 37.116 1.00 61.32 ? 413 VAL A CG2 1 ATOM 2722 N N . TYR A 1 403 ? 54.513 -68.604 37.577 1.00 79.46 ? 414 TYR A N 1 ATOM 2723 C CA . TYR A 1 403 ? 55.531 -69.456 38.179 1.00 90.46 ? 414 TYR A CA 1 ATOM 2724 C C . TYR A 1 403 ? 55.677 -69.150 39.661 1.00 90.87 ? 414 TYR A C 1 ATOM 2725 O O . TYR A 1 403 ? 56.159 -68.084 40.036 1.00 93.72 ? 414 TYR A O 1 ATOM 2726 C CB . TYR A 1 403 ? 56.875 -69.272 37.469 1.00 71.90 ? 414 TYR A CB 1 ATOM 2727 C CG . TYR A 1 403 ? 58.022 -70.056 38.077 1.00 78.26 ? 414 TYR A CG 1 ATOM 2728 C CD1 . TYR A 1 403 ? 58.141 -71.426 37.873 1.00 83.79 ? 414 TYR A CD1 1 ATOM 2729 C CD2 . TYR A 1 403 ? 58.995 -69.422 38.839 1.00 75.48 ? 414 TYR A CD2 1 ATOM 2730 C CE1 . TYR A 1 403 ? 59.192 -72.144 38.419 1.00 79.99 ? 414 TYR A CE1 1 ATOM 2731 C CE2 . TYR A 1 403 ? 60.048 -70.129 39.387 1.00 78.28 ? 414 TYR A CE2 1 ATOM 2732 C CZ . TYR A 1 403 ? 60.142 -71.491 39.175 1.00 86.14 ? 414 TYR A CZ 1 ATOM 2733 O OH . TYR A 1 403 ? 61.190 -72.200 39.722 1.00 86.95 ? 414 TYR A OH 1 ATOM 2734 N N . THR A 1 404 ? 55.243 -70.081 40.503 1.00 96.59 ? 415 THR A N 1 ATOM 2735 C CA . THR A 1 404 ? 55.438 -69.950 41.942 1.00 109.72 ? 415 THR A CA 1 ATOM 2736 C C . THR A 1 404 ? 56.649 -70.775 42.354 1.00 112.83 ? 415 THR A C 1 ATOM 2737 O O . THR A 1 404 ? 57.082 -71.650 41.611 1.00 118.20 ? 415 THR A O 1 ATOM 2738 C CB . THR A 1 404 ? 54.198 -70.413 42.735 1.00 110.42 ? 415 THR A CB 1 ATOM 2739 O OG1 . THR A 1 404 ? 53.852 -71.750 42.351 1.00 121.63 ? 415 THR A OG1 1 ATOM 2740 C CG2 . THR A 1 404 ? 53.018 -69.493 42.465 1.00 95.41 ? 415 THR A CG2 1 ATOM 2741 N N . ASN A 1 405 ? 57.204 -70.489 43.527 1.00 111.13 ? 416 ASN A N 1 ATOM 2742 C CA . ASN A 1 405 ? 58.351 -71.247 44.020 1.00 112.57 ? 416 ASN A CA 1 ATOM 2743 C C . ASN A 1 405 ? 58.592 -71.089 45.515 1.00 110.64 ? 416 ASN A C 1 ATOM 2744 O O . ASN A 1 405 ? 59.325 -70.202 45.949 1.00 111.33 ? 416 ASN A O 1 ATOM 2745 C CB . ASN A 1 405 ? 59.625 -70.883 43.251 1.00 114.49 ? 416 ASN A CB 1 ATOM 2746 C CG . ASN A 1 405 ? 60.758 -71.860 43.510 1.00 106.14 ? 416 ASN A CG 1 ATOM 2747 O OD1 . ASN A 1 405 ? 60.526 -73.044 43.755 1.00 87.30 ? 416 ASN A OD1 1 ATOM 2748 N ND2 . ASN A 1 405 ? 61.991 -71.366 43.465 1.00 101.28 ? 416 ASN A ND2 1 ATOM 2749 N N . ALA A 1 406 ? 57.958 -71.955 46.295 1.00 118.68 ? 417 ALA A N 1 ATOM 2750 C CA . ALA A 1 406 ? 58.236 -72.082 47.719 1.00 127.29 ? 417 ALA A CA 1 ATOM 2751 C C . ALA A 1 406 ? 58.223 -73.574 47.981 1.00 130.72 ? 417 ALA A C 1 ATOM 2752 O O . ALA A 1 406 ? 57.151 -74.176 47.933 1.00 131.22 ? 417 ALA A O 1 ATOM 2753 C CB . ALA A 1 406 ? 57.168 -71.384 48.539 1.00 126.87 ? 417 ALA A CB 1 ATOM 2754 N N . ASP A 1 407 ? 59.369 -74.205 48.251 1.00 140.40 ? 418 ASP A N 1 ATOM 2755 C CA . ASP A 1 407 ? 60.681 -73.603 48.549 1.00 143.70 ? 418 ASP A CA 1 ATOM 2756 C C . ASP A 1 407 ? 61.322 -72.669 47.515 1.00 137.38 ? 418 ASP A C 1 ATOM 2757 O O . ASP A 1 407 ? 61.007 -72.723 46.333 1.00 143.27 ? 418 ASP A O 1 ATOM 2758 C CB . ASP A 1 407 ? 61.662 -74.735 48.844 1.00 151.32 ? 418 ASP A CB 1 ATOM 2759 C CG . ASP A 1 407 ? 61.537 -75.876 47.851 1.00 149.30 ? 418 ASP A CG 1 ATOM 2760 O OD1 . ASP A 1 407 ? 60.737 -76.802 48.108 1.00 141.44 ? 418 ASP A OD1 1 ATOM 2761 O OD2 . ASP A 1 407 ? 62.223 -75.839 46.807 1.00 152.07 ? 418 ASP A OD2 1 ATOM 2762 N N . LYS A 1 408 ? 62.250 -71.839 47.984 1.00 125.91 ? 419 LYS A N 1 ATOM 2763 C CA . LYS A 1 408 ? 62.796 -70.737 47.197 1.00 112.83 ? 419 LYS A CA 1 ATOM 2764 C C . LYS A 1 408 ? 64.239 -70.968 46.745 1.00 115.44 ? 419 LYS A C 1 ATOM 2765 O O . LYS A 1 408 ? 65.159 -70.330 47.258 1.00 102.58 ? 419 LYS A O 1 ATOM 2766 C CB . LYS A 1 408 ? 62.741 -69.455 48.029 1.00 106.52 ? 419 LYS A CB 1 ATOM 2767 C CG . LYS A 1 408 ? 61.375 -69.154 48.629 1.00 106.09 ? 419 LYS A CG 1 ATOM 2768 C CD . LYS A 1 408 ? 61.452 -68.015 49.638 1.00 110.27 ? 419 LYS A CD 1 ATOM 2769 C CE . LYS A 1 408 ? 60.106 -67.320 49.798 1.00 112.86 ? 419 LYS A CE 1 ATOM 2770 N NZ . LYS A 1 408 ? 58.998 -68.282 50.044 1.00 118.52 ? 419 LYS A NZ 1 ATOM 2771 N N . ASP A 1 409 ? 64.437 -71.852 45.770 1.00 132.11 ? 420 ASP A N 1 ATOM 2772 C CA . ASP A 1 409 ? 65.790 -72.232 45.358 1.00 138.22 ? 420 ASP A CA 1 ATOM 2773 C C . ASP A 1 409 ? 66.232 -71.669 44.000 1.00 126.54 ? 420 ASP A C 1 ATOM 2774 O O . ASP A 1 409 ? 67.407 -71.768 43.641 1.00 128.20 ? 420 ASP A O 1 ATOM 2775 C CB . ASP A 1 409 ? 65.943 -73.757 45.366 1.00 149.18 ? 420 ASP A CB 1 ATOM 2776 C CG . ASP A 1 409 ? 65.305 -74.412 44.159 1.00 165.70 ? 420 ASP A CG 1 ATOM 2777 O OD1 . ASP A 1 409 ? 64.061 -74.533 44.132 1.00 172.25 ? 420 ASP A OD1 1 ATOM 2778 O OD2 . ASP A 1 409 ? 66.048 -74.808 43.236 1.00 171.02 ? 420 ASP A OD2 1 ATOM 2779 N N . THR A 1 410 ? 65.301 -71.085 43.250 1.00 111.41 ? 421 THR A N 1 ATOM 2780 C CA . THR A 1 410 ? 65.622 -70.520 41.938 1.00 104.43 ? 421 THR A CA 1 ATOM 2781 C C . THR A 1 410 ? 65.714 -68.995 42.000 1.00 103.26 ? 421 THR A C 1 ATOM 2782 O O . THR A 1 410 ? 65.403 -68.392 43.028 1.00 106.95 ? 421 THR A O 1 ATOM 2783 C CB . THR A 1 410 ? 64.592 -70.936 40.878 1.00 105.21 ? 421 THR A CB 1 ATOM 2784 O OG1 . THR A 1 410 ? 63.983 -72.173 41.265 1.00 113.19 ? 421 THR A OG1 1 ATOM 2785 C CG2 . THR A 1 410 ? 65.262 -71.111 39.521 1.00 105.21 ? 421 THR A CG2 1 ATOM 2786 N N . TRP A 1 411 ? 66.136 -68.376 40.898 1.00 94.01 ? 422 TRP A N 1 ATOM 2787 C CA . TRP A 1 411 ? 66.399 -66.937 40.879 1.00 92.29 ? 422 TRP A CA 1 ATOM 2788 C C . TRP A 1 411 ? 65.154 -66.072 41.087 1.00 91.60 ? 422 TRP A C 1 ATOM 2789 O O . TRP A 1 411 ? 65.260 -64.893 41.424 1.00 88.42 ? 422 TRP A O 1 ATOM 2790 C CB . TRP A 1 411 ? 67.142 -66.526 39.602 1.00 98.87 ? 422 TRP A CB 1 ATOM 2791 C CG . TRP A 1 411 ? 66.427 -66.847 38.323 1.00 110.71 ? 422 TRP A CG 1 ATOM 2792 C CD1 . TRP A 1 411 ? 66.425 -68.042 37.663 1.00 115.62 ? 422 TRP A CD1 1 ATOM 2793 C CD2 . TRP A 1 411 ? 65.627 -65.953 37.535 1.00 110.02 ? 422 TRP A CD2 1 ATOM 2794 N NE1 . TRP A 1 411 ? 65.667 -67.951 36.520 1.00 114.26 ? 422 TRP A NE1 1 ATOM 2795 C CE2 . TRP A 1 411 ? 65.166 -66.679 36.417 1.00 109.88 ? 422 TRP A CE2 1 ATOM 2796 C CE3 . TRP A 1 411 ? 65.252 -64.611 37.668 1.00 102.47 ? 422 TRP A CE3 1 ATOM 2797 C CZ2 . TRP A 1 411 ? 64.351 -66.108 35.439 1.00 97.23 ? 422 TRP A CZ2 1 ATOM 2798 C CZ3 . TRP A 1 411 ? 64.441 -64.046 36.694 1.00 94.49 ? 422 TRP A CZ3 1 ATOM 2799 C CH2 . TRP A 1 411 ? 64.000 -64.795 35.596 1.00 90.84 ? 422 TRP A CH2 1 ATOM 2800 N N . ALA A 1 412 ? 63.979 -66.662 40.891 1.00 89.14 ? 423 ALA A N 1 ATOM 2801 C CA . ALA A 1 412 ? 62.726 -65.965 41.153 1.00 81.24 ? 423 ALA A CA 1 ATOM 2802 C C . ALA A 1 412 ? 61.804 -66.820 42.015 1.00 91.60 ? 423 ALA A C 1 ATOM 2803 O O . ALA A 1 412 ? 61.595 -68.002 41.734 1.00 102.48 ? 423 ALA A O 1 ATOM 2804 C CB . ALA A 1 412 ? 62.042 -65.593 39.850 1.00 75.06 ? 423 ALA A CB 1 ATOM 2805 N N . ASP A 1 413 ? 61.261 -66.225 43.072 1.00 79.68 ? 424 ASP A N 1 ATOM 2806 C CA . ASP A 1 413 ? 60.331 -66.937 43.940 1.00 77.89 ? 424 ASP A CA 1 ATOM 2807 C C . ASP A 1 413 ? 58.935 -66.877 43.345 1.00 82.55 ? 424 ASP A C 1 ATOM 2808 O O . ASP A 1 413 ? 58.071 -67.688 43.675 1.00 82.58 ? 424 ASP A O 1 ATOM 2809 C CB . ASP A 1 413 ? 60.329 -66.335 45.345 1.00 80.84 ? 424 ASP A CB 1 ATOM 2810 C CG . ASP A 1 413 ? 61.689 -66.407 46.011 1.00 93.39 ? 424 ASP A CG 1 ATOM 2811 O OD1 . ASP A 1 413 ? 62.488 -67.297 45.644 1.00 85.56 ? 424 ASP A OD1 1 ATOM 2812 O OD2 . ASP A 1 413 ? 61.960 -65.573 46.900 1.00 103.54 ? 424 ASP A OD2 1 ATOM 2813 N N . TYR A 1 414 ? 58.731 -65.904 42.461 1.00 78.90 ? 425 TYR A N 1 ATOM 2814 C CA . TYR A 1 414 ? 57.449 -65.706 41.795 1.00 79.15 ? 425 TYR A CA 1 ATOM 2815 C C . TYR A 1 414 ? 57.645 -64.980 40.472 1.00 82.51 ? 425 TYR A C 1 ATOM 2816 O O . TYR A 1 414 ? 58.424 -64.033 40.378 1.00 92.00 ? 425 TYR A O 1 ATOM 2817 C CB . TYR A 1 414 ? 56.494 -64.917 42.693 1.00 69.32 ? 425 TYR A CB 1 ATOM 2818 C CG . TYR A 1 414 ? 55.219 -64.468 42.015 1.00 66.66 ? 425 TYR A CG 1 ATOM 2819 C CD1 . TYR A 1 414 ? 54.119 -65.312 41.927 1.00 69.70 ? 425 TYR A CD1 1 ATOM 2820 C CD2 . TYR A 1 414 ? 55.107 -63.190 41.478 1.00 64.50 ? 425 TYR A CD2 1 ATOM 2821 C CE1 . TYR A 1 414 ? 52.941 -64.899 41.312 1.00 66.17 ? 425 TYR A CE1 1 ATOM 2822 C CE2 . TYR A 1 414 ? 53.936 -62.767 40.864 1.00 63.89 ? 425 TYR A CE2 1 ATOM 2823 C CZ . TYR A 1 414 ? 52.857 -63.624 40.783 1.00 68.03 ? 425 TYR A CZ 1 ATOM 2824 O OH . TYR A 1 414 ? 51.696 -63.201 40.170 1.00 69.62 ? 425 TYR A OH 1 ATOM 2825 N N . ALA A 1 415 ? 56.932 -65.431 39.450 1.00 78.07 ? 426 ALA A N 1 ATOM 2826 C CA . ALA A 1 415 ? 57.012 -64.817 38.135 1.00 70.85 ? 426 ALA A CA 1 ATOM 2827 C C . ALA A 1 415 ? 55.665 -64.932 37.449 1.00 76.72 ? 426 ALA A C 1 ATOM 2828 O O . ALA A 1 415 ? 54.886 -65.841 37.741 1.00 85.59 ? 426 ALA A O 1 ATOM 2829 C CB . ALA A 1 415 ? 58.094 -65.477 37.300 1.00 75.78 ? 426 ALA A CB 1 ATOM 2830 N N . ARG A 1 416 ? 55.389 -64.006 36.539 1.00 73.08 ? 427 ARG A N 1 ATOM 2831 C CA . ARG A 1 416 ? 54.113 -63.999 35.845 1.00 62.59 ? 427 ARG A CA 1 ATOM 2832 C C . ARG A 1 416 ? 54.194 -63.294 34.501 1.00 70.33 ? 427 ARG A C 1 ATOM 2833 O O . ARG A 1 416 ? 54.499 -62.107 34.430 1.00 74.20 ? 427 ARG A O 1 ATOM 2834 C CB . ARG A 1 416 ? 53.034 -63.344 36.710 1.00 61.29 ? 427 ARG A CB 1 ATOM 2835 C CG . ARG A 1 416 ? 51.665 -63.358 36.063 1.00 61.93 ? 427 ARG A CG 1 ATOM 2836 C CD . ARG A 1 416 ? 50.580 -62.886 37.009 1.00 65.02 ? 427 ARG A CD 1 ATOM 2837 N NE . ARG A 1 416 ? 49.279 -62.873 36.346 1.00 77.77 ? 427 ARG A NE 1 ATOM 2838 C CZ . ARG A 1 416 ? 48.819 -61.853 35.629 1.00 70.85 ? 427 ARG A CZ 1 ATOM 2839 N NH1 . ARG A 1 416 ? 49.556 -60.760 35.486 1.00 78.87 ? 427 ARG A NH1 1 ATOM 2840 N NH2 . ARG A 1 416 ? 47.626 -61.925 35.054 1.00 55.85 ? 427 ARG A NH2 1 ATOM 2841 N N . LEU A 1 417 ? 53.922 -64.039 33.436 1.00 75.88 ? 428 LEU A N 1 ATOM 2842 C CA . LEU A 1 417 ? 53.770 -63.453 32.114 1.00 72.52 ? 428 LEU A CA 1 ATOM 2843 C C . LEU A 1 417 ? 52.286 -63.434 31.780 1.00 73.12 ? 428 LEU A C 1 ATOM 2844 O O . LEU A 1 417 ? 51.576 -64.409 32.024 1.00 75.92 ? 428 LEU A O 1 ATOM 2845 C CB . LEU A 1 417 ? 54.535 -64.265 31.071 1.00 81.11 ? 428 LEU A CB 1 ATOM 2846 C CG . LEU A 1 417 ? 55.982 -64.627 31.414 1.00 93.87 ? 428 LEU A CG 1 ATOM 2847 C CD1 . LEU A 1 417 ? 56.631 -65.375 30.259 1.00 92.55 ? 428 LEU A CD1 1 ATOM 2848 C CD2 . LEU A 1 417 ? 56.791 -63.388 31.779 1.00 99.67 ? 428 LEU A CD2 1 ATOM 2849 N N . SER A 1 418 ? 51.809 -62.324 31.235 1.00 70.03 ? 429 SER A N 1 ATOM 2850 C CA . SER A 1 418 ? 50.394 -62.212 30.916 1.00 70.88 ? 429 SER A CA 1 ATOM 2851 C C . SER A 1 418 ? 50.127 -61.378 29.670 1.00 77.81 ? 429 SER A C 1 ATOM 2852 O O . SER A 1 418 ? 50.805 -60.382 29.409 1.00 78.98 ? 429 SER A O 1 ATOM 2853 C CB . SER A 1 418 ? 49.616 -61.643 32.107 1.00 71.72 ? 429 SER A CB 1 ATOM 2854 O OG . SER A 1 418 ? 50.056 -60.337 32.435 1.00 68.90 ? 429 SER A OG 1 ATOM 2855 N N . TYR A 1 419 ? 49.135 -61.804 28.900 1.00 50.60 ? 430 TYR A N 1 ATOM 2856 C CA . TYR A 1 419 ? 48.652 -61.025 27.773 1.00 50.88 ? 430 TYR A CA 1 ATOM 2857 C C . TYR A 1 419 ? 47.155 -60.803 27.945 1.00 55.20 ? 430 TYR A C 1 ATOM 2858 O O . TYR A 1 419 ? 46.418 -61.737 28.257 1.00 54.61 ? 430 TYR A O 1 ATOM 2859 C CB . TYR A 1 419 ? 48.955 -61.729 26.449 1.00 50.52 ? 430 TYR A CB 1 ATOM 2860 C CG . TYR A 1 419 ? 48.434 -60.993 25.239 1.00 65.92 ? 430 TYR A CG 1 ATOM 2861 C CD1 . TYR A 1 419 ? 48.934 -59.743 24.895 1.00 68.37 ? 430 TYR A CD1 1 ATOM 2862 C CD2 . TYR A 1 419 ? 47.442 -61.545 24.439 1.00 68.23 ? 430 TYR A CD2 1 ATOM 2863 C CE1 . TYR A 1 419 ? 48.458 -59.059 23.789 1.00 74.95 ? 430 TYR A CE1 1 ATOM 2864 C CE2 . TYR A 1 419 ? 46.960 -60.870 23.329 1.00 76.81 ? 430 TYR A CE2 1 ATOM 2865 C CZ . TYR A 1 419 ? 47.473 -59.628 23.009 1.00 79.05 ? 430 TYR A CZ 1 ATOM 2866 O OH . TYR A 1 419 ? 46.999 -58.954 21.907 1.00 86.96 ? 430 TYR A OH 1 ATOM 2867 N N . ASP A 1 420 ? 46.720 -59.559 27.761 1.00 50.27 ? 431 ASP A N 1 ATOM 2868 C CA . ASP A 1 420 ? 45.321 -59.185 27.942 1.00 53.91 ? 431 ASP A CA 1 ATOM 2869 C C . ASP A 1 420 ? 44.831 -58.242 26.851 1.00 54.01 ? 431 ASP A C 1 ATOM 2870 O O . ASP A 1 420 ? 45.388 -57.157 26.664 1.00 47.36 ? 431 ASP A O 1 ATOM 2871 C CB . ASP A 1 420 ? 45.118 -58.511 29.302 1.00 58.46 ? 431 ASP A CB 1 ATOM 2872 C CG . ASP A 1 420 ? 45.302 -59.466 30.461 1.00 71.85 ? 431 ASP A CG 1 ATOM 2873 O OD1 . ASP A 1 420 ? 44.370 -60.254 30.728 1.00 65.80 ? 431 ASP A OD1 1 ATOM 2874 O OD2 . ASP A 1 420 ? 46.372 -59.423 31.108 1.00 79.63 ? 431 ASP A OD2 1 ATOM 2875 N N . ARG A 1 421 ? 43.787 -58.660 26.140 1.00 50.02 ? 432 ARG A N 1 ATOM 2876 C CA . ARG A 1 421 ? 43.084 -57.783 25.206 1.00 53.34 ? 432 ARG A CA 1 ATOM 2877 C C . ARG A 1 421 ? 41.782 -57.306 25.838 1.00 52.31 ? 432 ARG A C 1 ATOM 2878 O O . ARG A 1 421 ? 40.886 -58.103 26.105 1.00 70.30 ? 432 ARG A O 1 ATOM 2879 C CB . ARG A 1 421 ? 42.784 -58.503 23.888 1.00 73.53 ? 432 ARG A CB 1 ATOM 2880 C CG . ARG A 1 421 ? 44.016 -58.959 23.118 1.00 99.56 ? 432 ARG A CG 1 ATOM 2881 C CD . ARG A 1 421 ? 43.655 -59.795 21.887 1.00 109.21 ? 432 ARG A CD 1 ATOM 2882 N NE . ARG A 1 421 ? 43.105 -58.988 20.800 1.00 114.34 ? 432 ARG A NE 1 ATOM 2883 C CZ . ARG A 1 421 ? 41.806 -58.841 20.554 1.00 101.40 ? 432 ARG A CZ 1 ATOM 2884 N NH1 . ARG A 1 421 ? 41.400 -58.085 19.540 1.00 68.15 ? 432 ARG A NH1 1 ATOM 2885 N NH2 . ARG A 1 421 ? 40.911 -59.450 21.320 1.00 108.14 ? 432 ARG A NH2 1 ATOM 2886 N N . GLN A 1 422 ? 41.681 -56.005 26.082 1.00 54.40 ? 433 GLN A N 1 ATOM 2887 C CA . GLN A 1 422 ? 40.474 -55.434 26.673 1.00 49.09 ? 433 GLN A CA 1 ATOM 2888 C C . GLN A 1 422 ? 39.847 -54.383 25.758 1.00 49.62 ? 433 GLN A C 1 ATOM 2889 O O . GLN A 1 422 ? 40.547 -53.650 25.054 1.00 48.98 ? 433 GLN A O 1 ATOM 2890 C CB . GLN A 1 422 ? 40.790 -54.824 28.042 1.00 55.63 ? 433 GLN A CB 1 ATOM 2891 C CG . GLN A 1 422 ? 39.616 -54.135 28.723 1.00 50.26 ? 433 GLN A CG 1 ATOM 2892 C CD . GLN A 1 422 ? 39.977 -53.584 30.090 1.00 56.55 ? 433 GLN A CD 1 ATOM 2893 O OE1 . GLN A 1 422 ? 40.375 -54.326 30.989 1.00 75.04 ? 433 GLN A OE1 1 ATOM 2894 N NE2 . GLN A 1 422 ? 39.847 -52.275 30.252 1.00 58.60 ? 433 GLN A NE2 1 ATOM 2895 N N . GLY A 1 423 ? 38.522 -54.328 25.761 1.00 46.00 ? 434 GLY A N 1 ATOM 2896 C CA . GLY A 1 423 ? 37.800 -53.292 25.052 1.00 35.46 ? 434 GLY A CA 1 ATOM 2897 C C . GLY A 1 423 ? 36.666 -52.780 25.918 1.00 48.00 ? 434 GLY A C 1 ATOM 2898 O O . GLY A 1 423 ? 35.951 -53.562 26.542 1.00 49.96 ? 434 GLY A O 1 ATOM 2899 N N . VAL A 1 424 ? 36.506 -51.465 25.982 1.00 35.28 ? 435 VAL A N 1 ATOM 2900 C CA . VAL A 1 424 ? 35.367 -50.894 26.687 1.00 39.71 ? 435 VAL A CA 1 ATOM 2901 C C . VAL A 1 424 ? 34.657 -49.907 25.772 1.00 49.27 ? 435 VAL A C 1 ATOM 2902 O O . VAL A 1 424 ? 35.292 -49.047 25.166 1.00 44.47 ? 435 VAL A O 1 ATOM 2903 C CB . VAL A 1 424 ? 35.774 -50.185 27.998 1.00 40.73 ? 435 VAL A CB 1 ATOM 2904 C CG1 . VAL A 1 424 ? 34.542 -49.701 28.736 1.00 40.28 ? 435 VAL A CG1 1 ATOM 2905 C CG2 . VAL A 1 424 ? 36.585 -51.116 28.895 1.00 43.30 ? 435 VAL A CG2 1 ATOM 2906 N N . GLY A 1 425 ? 33.340 -50.040 25.671 1.00 47.84 ? 436 GLY A N 1 ATOM 2907 C CA . GLY A 1 425 ? 32.559 -49.176 24.809 1.00 39.73 ? 436 GLY A CA 1 ATOM 2908 C C . GLY A 1 425 ? 31.409 -48.494 25.518 1.00 43.78 ? 436 GLY A C 1 ATOM 2909 O O . GLY A 1 425 ? 30.614 -49.132 26.204 1.00 49.94 ? 436 GLY A O 1 ATOM 2910 N N . LEU A 1 426 ? 31.324 -47.182 25.345 1.00 36.89 ? 437 LEU A N 1 ATOM 2911 C CA . LEU A 1 426 ? 30.232 -46.400 25.904 1.00 41.68 ? 437 LEU A CA 1 ATOM 2912 C C . LEU A 1 426 ? 29.372 -45.827 24.778 1.00 47.26 ? 437 LEU A C 1 ATOM 2913 O O . LEU A 1 426 ? 29.783 -44.907 24.068 1.00 42.35 ? 437 LEU A O 1 ATOM 2914 C CB . LEU A 1 426 ? 30.783 -45.286 26.794 1.00 39.82 ? 437 LEU A CB 1 ATOM 2915 C CG . LEU A 1 426 ? 31.736 -45.757 27.894 1.00 37.95 ? 437 LEU A CG 1 ATOM 2916 C CD1 . LEU A 1 426 ? 32.260 -44.575 28.691 1.00 36.04 ? 437 LEU A CD1 1 ATOM 2917 C CD2 . LEU A 1 426 ? 31.049 -46.764 28.798 1.00 29.98 ? 437 LEU A CD2 1 ATOM 2918 N N . ASP A 1 427 ? 28.182 -46.398 24.622 1.00 44.85 ? 438 ASP A N 1 ATOM 2919 C CA . ASP A 1 427 ? 27.277 -46.072 23.528 1.00 38.60 ? 438 ASP A CA 1 ATOM 2920 C C . ASP A 1 427 ? 26.145 -45.203 24.050 1.00 45.86 ? 438 ASP A C 1 ATOM 2921 O O . ASP A 1 427 ? 25.272 -45.682 24.772 1.00 51.69 ? 438 ASP A O 1 ATOM 2922 C CB . ASP A 1 427 ? 26.696 -47.363 22.945 1.00 53.50 ? 438 ASP A CB 1 ATOM 2923 C CG . ASP A 1 427 ? 25.948 -47.142 21.640 1.00 53.10 ? 438 ASP A CG 1 ATOM 2924 O OD1 . ASP A 1 427 ? 24.815 -46.620 21.674 1.00 49.21 ? 438 ASP A OD1 1 ATOM 2925 O OD2 . ASP A 1 427 ? 26.484 -47.519 20.578 1.00 64.02 ? 438 ASP A OD2 1 ATOM 2926 N N . ASN A 1 428 ? 26.152 -43.929 23.678 1.00 41.70 ? 439 ASN A N 1 ATOM 2927 C CA . ASN A 1 428 ? 25.159 -42.994 24.187 1.00 39.42 ? 439 ASN A CA 1 ATOM 2928 C C . ASN A 1 428 ? 24.178 -42.546 23.110 1.00 48.79 ? 439 ASN A C 1 ATOM 2929 O O . ASN A 1 428 ? 24.519 -41.747 22.239 1.00 52.46 ? 439 ASN A O 1 ATOM 2930 C CB . ASN A 1 428 ? 25.853 -41.786 24.806 1.00 49.16 ? 439 ASN A CB 1 ATOM 2931 C CG . ASN A 1 428 ? 24.889 -40.859 25.501 1.00 49.62 ? 439 ASN A CG 1 ATOM 2932 O OD1 . ASN A 1 428 ? 23.852 -41.293 26.005 1.00 50.94 ? 439 ASN A OD1 1 ATOM 2933 N ND2 . ASN A 1 428 ? 25.218 -39.571 25.524 1.00 35.19 ? 439 ASN A ND2 1 ATOM 2934 N N . HIS A 1 429 ? 22.956 -43.061 23.175 1.00 48.24 ? 440 HIS A N 1 ATOM 2935 C CA . HIS A 1 429 ? 21.972 -42.795 22.134 1.00 46.96 ? 440 HIS A CA 1 ATOM 2936 C C . HIS A 1 429 ? 20.885 -41.837 22.604 1.00 44.05 ? 440 HIS A C 1 ATOM 2937 O O . HIS A 1 429 ? 20.035 -42.198 23.412 1.00 45.92 ? 440 HIS A O 1 ATOM 2938 C CB . HIS A 1 429 ? 21.347 -44.102 21.650 1.00 42.88 ? 440 HIS A CB 1 ATOM 2939 C CG . HIS A 1 429 ? 20.430 -43.940 20.478 1.00 48.41 ? 440 HIS A CG 1 ATOM 2940 N ND1 . HIS A 1 429 ? 19.375 -44.794 20.235 1.00 54.34 ? 440 HIS A ND1 1 ATOM 2941 C CD2 . HIS A 1 429 ? 20.416 -43.031 19.476 1.00 53.62 ? 440 HIS A CD2 1 ATOM 2942 C CE1 . HIS A 1 429 ? 18.746 -44.415 19.137 1.00 33.23 ? 440 HIS A CE1 1 ATOM 2943 N NE2 . HIS A 1 429 ? 19.358 -43.348 18.657 1.00 51.32 ? 440 HIS A NE2 1 ATOM 2944 N N . PHE A 1 430 ? 20.932 -40.614 22.086 1.00 43.95 ? 441 PHE A N 1 ATOM 2945 C CA . PHE A 1 430 ? 19.907 -39.606 22.324 1.00 38.91 ? 441 PHE A CA 1 ATOM 2946 C C . PHE A 1 430 ? 18.722 -39.838 21.395 1.00 42.02 ? 441 PHE A C 1 ATOM 2947 O O . PHE A 1 430 ? 18.897 -40.209 20.235 1.00 44.82 ? 441 PHE A O 1 ATOM 2948 C CB . PHE A 1 430 ? 20.493 -38.215 22.069 1.00 35.17 ? 441 PHE A CB 1 ATOM 2949 C CG . PHE A 1 430 ? 19.489 -37.095 22.141 1.00 43.19 ? 441 PHE A CG 1 ATOM 2950 C CD1 . PHE A 1 430 ? 19.314 -36.382 23.312 1.00 38.50 ? 441 PHE A CD1 1 ATOM 2951 C CD2 . PHE A 1 430 ? 18.746 -36.731 21.025 1.00 43.71 ? 441 PHE A CD2 1 ATOM 2952 C CE1 . PHE A 1 430 ? 18.406 -35.340 23.377 1.00 49.00 ? 441 PHE A CE1 1 ATOM 2953 C CE2 . PHE A 1 430 ? 17.831 -35.694 21.090 1.00 43.60 ? 441 PHE A CE2 1 ATOM 2954 C CZ . PHE A 1 430 ? 17.663 -34.997 22.266 1.00 37.49 ? 441 PHE A CZ 1 ATOM 2955 N N . GLN A 1 431 ? 17.520 -39.607 21.906 1.00 30.56 ? 442 GLN A N 1 ATOM 2956 C CA . GLN A 1 431 ? 16.317 -39.669 21.088 1.00 39.48 ? 442 GLN A CA 1 ATOM 2957 C C . GLN A 1 431 ? 15.291 -38.649 21.561 1.00 49.61 ? 442 GLN A C 1 ATOM 2958 O O . GLN A 1 431 ? 14.931 -38.625 22.735 1.00 50.90 ? 442 GLN A O 1 ATOM 2959 C CB . GLN A 1 431 ? 15.708 -41.070 21.121 1.00 39.39 ? 442 GLN A CB 1 ATOM 2960 C CG . GLN A 1 431 ? 16.333 -42.061 20.154 1.00 36.53 ? 442 GLN A CG 1 ATOM 2961 C CD . GLN A 1 431 ? 15.722 -43.441 20.285 1.00 46.84 ? 442 GLN A CD 1 ATOM 2962 O OE1 . GLN A 1 431 ? 16.015 -44.168 21.230 1.00 56.77 ? 442 GLN A OE1 1 ATOM 2963 N NE2 . GLN A 1 431 ? 14.857 -43.802 19.346 1.00 38.16 ? 442 GLN A NE2 1 ATOM 2964 N N . GLN A 1 432 ? 14.831 -37.803 20.642 1.00 53.31 ? 443 GLN A N 1 ATOM 2965 C CA . GLN A 1 432 ? 13.781 -36.836 20.940 1.00 40.82 ? 443 GLN A CA 1 ATOM 2966 C C . GLN A 1 432 ? 12.577 -37.098 20.053 1.00 38.90 ? 443 GLN A C 1 ATOM 2967 O O . GLN A 1 432 ? 12.704 -37.140 18.837 1.00 52.45 ? 443 GLN A O 1 ATOM 2968 C CB . GLN A 1 432 ? 14.281 -35.408 20.730 1.00 33.04 ? 443 GLN A CB 1 ATOM 2969 C CG . GLN A 1 432 ? 13.245 -34.335 21.050 1.00 41.79 ? 443 GLN A CG 1 ATOM 2970 C CD . GLN A 1 432 ? 13.781 -32.919 20.898 1.00 39.31 ? 443 GLN A CD 1 ATOM 2971 O OE1 . GLN A 1 432 ? 14.922 -32.629 21.254 1.00 43.36 ? 443 GLN A OE1 1 ATOM 2972 N NE2 . GLN A 1 432 ? 12.955 -32.030 20.366 1.00 51.06 ? 443 GLN A NE2 1 ATOM 2973 N N . THR A 1 433 ? 11.412 -37.287 20.661 1.00 36.54 ? 444 THR A N 1 ATOM 2974 C CA . THR A 1 433 ? 10.194 -37.528 19.891 1.00 40.47 ? 444 THR A CA 1 ATOM 2975 C C . THR A 1 433 ? 9.133 -36.482 20.196 1.00 44.91 ? 444 THR A C 1 ATOM 2976 O O . THR A 1 433 ? 9.063 -35.959 21.305 1.00 39.36 ? 444 THR A O 1 ATOM 2977 C CB . THR A 1 433 ? 9.587 -38.934 20.150 1.00 28.02 ? 444 THR A CB 1 ATOM 2978 O OG1 . THR A 1 433 ? 8.931 -38.952 21.424 1.00 42.49 ? 444 THR A OG1 1 ATOM 2979 C CG2 . THR A 1 433 ? 10.661 -40.005 20.120 1.00 28.30 ? 444 THR A CG2 1 ATOM 2980 N N . HIS A 1 434 ? 8.320 -36.180 19.191 1.00 45.98 ? 445 HIS A N 1 ATOM 2981 C CA . HIS A 1 434 ? 7.156 -35.324 19.349 1.00 43.25 ? 445 HIS A CA 1 ATOM 2982 C C . HIS A 1 434 ? 6.070 -35.882 18.444 1.00 50.81 ? 445 HIS A C 1 ATOM 2983 O O . HIS A 1 434 ? 5.788 -35.332 17.384 1.00 58.61 ? 445 HIS A O 1 ATOM 2984 C CB . HIS A 1 434 ? 7.472 -33.877 18.964 1.00 44.23 ? 445 HIS A CB 1 ATOM 2985 C CG . HIS A 1 434 ? 6.344 -32.923 19.223 1.00 51.00 ? 445 HIS A CG 1 ATOM 2986 N ND1 . HIS A 1 434 ? 6.204 -32.242 20.413 1.00 53.89 ? 445 HIS A ND1 1 ATOM 2987 C CD2 . HIS A 1 434 ? 5.294 -32.551 18.453 1.00 38.20 ? 445 HIS A CD2 1 ATOM 2988 C CE1 . HIS A 1 434 ? 5.121 -31.487 20.362 1.00 50.96 ? 445 HIS A CE1 1 ATOM 2989 N NE2 . HIS A 1 434 ? 4.552 -31.655 19.183 1.00 49.25 ? 445 HIS A NE2 1 ATOM 2990 N N . CYS A 1 435 ? 5.465 -36.985 18.866 1.00 40.90 ? 446 CYS A N 1 ATOM 2991 C CA . CYS A 1 435 ? 4.523 -37.696 18.017 1.00 40.51 ? 446 CYS A CA 1 ATOM 2992 C C . CYS A 1 435 ? 3.635 -38.608 18.856 1.00 42.34 ? 446 CYS A C 1 ATOM 2993 O O . CYS A 1 435 ? 3.123 -39.622 18.376 1.00 47.13 ? 446 CYS A O 1 ATOM 2994 C CB . CYS A 1 435 ? 5.289 -38.500 16.960 1.00 37.01 ? 446 CYS A CB 1 ATOM 2995 S SG . CYS A 1 435 ? 6.608 -39.509 17.653 1.00 81.90 ? 446 CYS A SG 1 ATOM 2996 N N . SER A 1 436 ? 3.435 -38.219 20.098 1.00 42.78 ? 447 SER A N 1 ATOM 2997 C CA . SER A 1 436 ? 2.561 -38.920 21.005 1.00 48.11 ? 447 SER A CA 1 ATOM 2998 C C . SER A 1 436 ? 1.918 -37.986 21.964 1.00 47.64 ? 447 SER A C 1 ATOM 2999 O O . SER A 1 436 ? 2.366 -36.899 22.141 1.00 52.45 ? 447 SER A O 1 ATOM 3000 C CB . SER A 1 436 ? 3.327 -39.955 21.788 1.00 49.01 ? 447 SER A CB 1 ATOM 3001 O OG . SER A 1 436 ? 4.259 -39.371 22.634 1.00 44.93 ? 447 SER A OG 1 ATOM 3002 N N . ALA A 1 437 ? 0.847 -38.425 22.585 1.00 46.64 ? 448 ALA A N 1 ATOM 3003 C CA . ALA A 1 437 ? 0.248 -37.686 23.657 1.00 43.60 ? 448 ALA A CA 1 ATOM 3004 C C . ALA A 1 437 ? 1.019 -38.275 24.741 1.00 71.28 ? 448 ALA A C 1 ATOM 3005 O O . ALA A 1 437 ? 1.225 -39.450 24.702 1.00 98.30 ? 448 ALA A O 1 ATOM 3006 C CB . ALA A 1 437 ? -1.115 -38.084 23.793 1.00 40.01 ? 448 ALA A CB 1 ATOM 3007 N N . ASP A 1 438 ? 1.497 -37.522 25.704 1.00 63.93 ? 449 ASP A N 1 ATOM 3008 C CA . ASP A 1 438 ? 2.452 -38.131 26.604 1.00 71.43 ? 449 ASP A CA 1 ATOM 3009 C C . ASP A 1 438 ? 1.948 -38.973 27.766 1.00 80.58 ? 449 ASP A C 1 ATOM 3010 O O . ASP A 1 438 ? 1.110 -38.559 28.512 1.00 99.15 ? 449 ASP A O 1 ATOM 3011 C CB . ASP A 1 438 ? 3.435 -37.102 27.065 1.00 60.92 ? 449 ASP A CB 1 ATOM 3012 C CG . ASP A 1 438 ? 4.597 -37.059 26.191 1.00 77.23 ? 449 ASP A CG 1 ATOM 3013 O OD1 . ASP A 1 438 ? 4.541 -37.689 25.151 1.00 66.36 ? 449 ASP A OD1 1 ATOM 3014 O OD2 . ASP A 1 438 ? 5.572 -36.424 26.529 1.00 100.70 ? 449 ASP A OD2 1 ATOM 3015 N N . GLY A 1 439 ? 2.486 -40.166 27.922 1.00 68.17 ? 450 GLY A N 1 ATOM 3016 C CA . GLY A 1 439 ? 3.595 -40.637 27.123 1.00 83.62 ? 450 GLY A CA 1 ATOM 3017 C C . GLY A 1 439 ? 4.650 -41.207 28.037 1.00 111.68 ? 450 GLY A C 1 ATOM 3018 O O . GLY A 1 439 ? 4.338 -41.784 29.038 1.00 128.72 ? 450 GLY A O 1 ATOM 3019 N N . SER A 1 440 ? 5.896 -41.000 27.706 1.00 35.39 ? 451 SER A N 1 ATOM 3020 C CA . SER A 1 440 ? 6.180 -40.457 26.440 1.00 59.97 ? 451 SER A CA 1 ATOM 3021 C C . SER A 1 440 ? 6.728 -41.627 25.731 1.00 56.07 ? 451 SER A C 1 ATOM 3022 O O . SER A 1 440 ? 7.415 -42.444 26.288 1.00 43.57 ? 451 SER A O 1 ATOM 3023 C CB . SER A 1 440 ? 7.161 -39.313 26.499 1.00 50.67 ? 451 SER A CB 1 ATOM 3024 O OG . SER A 1 440 ? 6.687 -38.265 25.722 1.00 41.54 ? 451 SER A OG 1 ATOM 3025 N N . ASP A 1 441 ? 6.335 -41.704 24.492 1.00 44.26 ? 452 ASP A N 1 ATOM 3026 C CA . ASP A 1 441 ? 6.780 -42.728 23.564 1.00 42.04 ? 452 ASP A CA 1 ATOM 3027 C C . ASP A 1 441 ? 8.175 -42.428 23.024 1.00 49.71 ? 452 ASP A C 1 ATOM 3028 O O . ASP A 1 441 ? 8.461 -41.310 22.603 1.00 57.99 ? 452 ASP A O 1 ATOM 3029 C CB . ASP A 1 441 ? 5.786 -42.829 22.411 1.00 56.49 ? 452 ASP A CB 1 ATOM 3030 C CG . ASP A 1 441 ? 5.722 -44.212 21.817 1.00 61.37 ? 452 ASP A CG 1 ATOM 3031 O OD1 . ASP A 1 441 ? 6.740 -44.935 21.877 1.00 55.26 ? 452 ASP A OD1 1 ATOM 3032 O OD2 . ASP A 1 441 ? 4.648 -44.573 21.289 1.00 63.10 ? 452 ASP A OD2 1 ATOM 3033 N N . LYS A 1 442 ? 9.036 -43.438 23.038 1.00 43.40 ? 453 LYS A N 1 ATOM 3034 C CA . LYS A 1 442 ? 10.386 -43.307 22.513 1.00 45.02 ? 453 LYS A CA 1 ATOM 3035 C C . LYS A 1 442 ? 10.459 -43.904 21.113 1.00 45.72 ? 453 LYS A C 1 ATOM 3036 O O . LYS A 1 442 ? 11.450 -43.738 20.413 1.00 52.16 ? 453 LYS A O 1 ATOM 3037 C CB . LYS A 1 442 ? 11.361 -44.048 23.421 1.00 48.55 ? 453 LYS A CB 1 ATOM 3038 C CG . LYS A 1 442 ? 12.807 -43.655 23.253 1.00 49.84 ? 453 LYS A CG 1 ATOM 3039 C CD . LYS A 1 442 ? 13.736 -44.842 23.491 1.00 69.19 ? 453 LYS A CD 1 ATOM 3040 C CE . LYS A 1 442 ? 13.445 -45.551 24.800 1.00 66.82 ? 453 LYS A CE 1 ATOM 3041 N NZ . LYS A 1 442 ? 14.307 -46.751 24.956 1.00 58.30 ? 453 LYS A NZ 1 ATOM 3042 N N . TYR A 1 443 ? 9.403 -44.600 20.707 1.00 40.65 ? 454 TYR A N 1 ATOM 3043 C CA . TYR A 1 443 ? 9.439 -45.384 19.477 1.00 49.77 ? 454 TYR A CA 1 ATOM 3044 C C . TYR A 1 443 ? 8.613 -44.796 18.350 1.00 53.78 ? 454 TYR A C 1 ATOM 3045 O O . TYR A 1 443 ? 8.788 -45.174 17.191 1.00 59.95 ? 454 TYR A O 1 ATOM 3046 C CB . TYR A 1 443 ? 8.989 -46.819 19.745 1.00 56.98 ? 454 TYR A CB 1 ATOM 3047 C CG . TYR A 1 443 ? 9.845 -47.516 20.765 1.00 58.14 ? 454 TYR A CG 1 ATOM 3048 C CD1 . TYR A 1 443 ? 11.095 -48.016 20.424 1.00 56.01 ? 454 TYR A CD1 1 ATOM 3049 C CD2 . TYR A 1 443 ? 9.410 -47.666 22.072 1.00 58.35 ? 454 TYR A CD2 1 ATOM 3050 C CE1 . TYR A 1 443 ? 11.887 -48.650 21.359 1.00 61.03 ? 454 TYR A CE1 1 ATOM 3051 C CE2 . TYR A 1 443 ? 10.193 -48.298 23.014 1.00 62.64 ? 454 TYR A CE2 1 ATOM 3052 C CZ . TYR A 1 443 ? 11.430 -48.789 22.654 1.00 61.85 ? 454 TYR A CZ 1 ATOM 3053 O OH . TYR A 1 443 ? 12.210 -49.421 23.595 1.00 75.42 ? 454 TYR A OH 1 ATOM 3054 N N . CYS A 1 444 ? 7.711 -43.882 18.689 1.00 41.25 ? 455 CYS A N 1 ATOM 3055 C CA . CYS A 1 444 ? 6.870 -43.252 17.683 1.00 36.29 ? 455 CYS A CA 1 ATOM 3056 C C . CYS A 1 444 ? 7.744 -42.456 16.716 1.00 41.76 ? 455 CYS A C 1 ATOM 3057 O O . CYS A 1 444 ? 8.809 -41.959 17.097 1.00 37.21 ? 455 CYS A O 1 ATOM 3058 C CB . CYS A 1 444 ? 5.808 -42.361 18.339 1.00 44.66 ? 455 CYS A CB 1 ATOM 3059 S SG . CYS A 1 444 ? 6.427 -40.874 19.174 1.00 70.63 ? 455 CYS A SG 1 ATOM 3060 N N . ARG A 1 445 ? 7.305 -42.356 15.464 1.00 41.66 ? 456 ARG A N 1 ATOM 3061 C CA . ARG A 1 445 ? 8.031 -41.591 14.450 1.00 43.76 ? 456 ARG A CA 1 ATOM 3062 C C . ARG A 1 445 ? 7.066 -40.720 13.653 1.00 44.53 ? 456 ARG A C 1 ATOM 3063 O O . ARG A 1 445 ? 5.871 -41.010 13.595 1.00 39.80 ? 456 ARG A O 1 ATOM 3064 C CB . ARG A 1 445 ? 8.776 -42.525 13.493 1.00 43.44 ? 456 ARG A CB 1 ATOM 3065 C CG . ARG A 1 445 ? 9.866 -43.374 14.122 1.00 33.18 ? 456 ARG A CG 1 ATOM 3066 C CD . ARG A 1 445 ? 10.991 -42.529 14.665 1.00 34.97 ? 456 ARG A CD 1 ATOM 3067 N NE . ARG A 1 445 ? 11.070 -42.674 16.112 1.00 58.24 ? 456 ARG A NE 1 ATOM 3068 C CZ . ARG A 1 445 ? 11.902 -43.497 16.736 1.00 53.44 ? 456 ARG A CZ 1 ATOM 3069 N NH1 . ARG A 1 445 ? 12.756 -44.239 16.046 1.00 58.38 ? 456 ARG A NH1 1 ATOM 3070 N NH2 . ARG A 1 445 ? 11.895 -43.559 18.055 1.00 51.73 ? 456 ARG A NH2 1 ATOM 3071 N N . PRO A 1 446 ? 7.578 -39.637 13.048 1.00 46.41 ? 457 PRO A N 1 ATOM 3072 C CA . PRO A 1 446 ? 6.772 -38.802 12.151 1.00 33.72 ? 457 PRO A CA 1 ATOM 3073 C C . PRO A 1 446 ? 6.279 -39.584 10.946 1.00 38.85 ? 457 PRO A C 1 ATOM 3074 O O . PRO A 1 446 ? 6.995 -40.438 10.423 1.00 46.82 ? 457 PRO A O 1 ATOM 3075 C CB . PRO A 1 446 ? 7.757 -37.718 11.704 1.00 35.71 ? 457 PRO A CB 1 ATOM 3076 C CG . PRO A 1 446 ? 8.730 -37.622 12.814 1.00 47.09 ? 457 PRO A CG 1 ATOM 3077 C CD . PRO A 1 446 ? 8.886 -39.026 13.335 1.00 59.42 ? 457 PRO A CD 1 ATOM 3078 N N . SER A 1 447 ? 5.061 -39.289 10.513 1.00 43.49 ? 458 SER A N 1 ATOM 3079 C CA . SER A 1 447 ? 4.446 -40.012 9.411 1.00 46.84 ? 458 SER A CA 1 ATOM 3080 C C . SER A 1 447 ? 3.356 -39.162 8.779 1.00 46.05 ? 458 SER A C 1 ATOM 3081 O O . SER A 1 447 ? 2.863 -38.223 9.393 1.00 51.05 ? 458 SER A O 1 ATOM 3082 C CB . SER A 1 447 ? 3.860 -41.331 9.908 1.00 52.24 ? 458 SER A CB 1 ATOM 3083 O OG . SER A 1 447 ? 2.874 -41.101 10.899 1.00 60.77 ? 458 SER A OG 1 ATOM 3084 N N . ALA A 1 448 ? 2.978 -39.499 7.554 1.00 44.68 ? 459 ALA A N 1 ATOM 3085 C CA . ALA A 1 448 ? 2.022 -38.689 6.810 1.00 41.53 ? 459 ALA A CA 1 ATOM 3086 C C . ALA A 1 448 ? 0.700 -38.543 7.547 1.00 43.27 ? 459 ALA A C 1 ATOM 3087 O O . ALA A 1 448 ? 0.032 -37.518 7.435 1.00 54.56 ? 459 ALA A O 1 ATOM 3088 C CB . ALA A 1 448 ? 1.798 -39.267 5.428 1.00 42.64 ? 459 ALA A CB 1 ATOM 3089 N N . ASP A 1 449 ? 0.330 -39.568 8.306 1.00 56.52 ? 460 ASP A N 1 ATOM 3090 C CA . ASP A 1 449 ? -0.929 -39.549 9.039 1.00 56.81 ? 460 ASP A CA 1 ATOM 3091 C C . ASP A 1 449 ? -0.766 -38.769 10.337 1.00 55.70 ? 460 ASP A C 1 ATOM 3092 O O . ASP A 1 449 ? -1.723 -38.562 11.076 1.00 58.88 ? 460 ASP A O 1 ATOM 3093 C CB . ASP A 1 449 ? -1.419 -40.974 9.318 1.00 69.29 ? 460 ASP A CB 1 ATOM 3094 C CG . ASP A 1 449 ? -0.545 -41.710 10.317 1.00 92.66 ? 460 ASP A CG 1 ATOM 3095 O OD1 . ASP A 1 449 ? 0.659 -41.388 10.412 1.00 95.01 ? 460 ASP A OD1 1 ATOM 3096 O OD2 . ASP A 1 449 ? -1.066 -42.612 11.009 1.00 103.21 ? 460 ASP A OD2 1 ATOM 3097 N N . LYS A 1 450 ? 0.461 -38.345 10.611 1.00 39.05 ? 461 LYS A N 1 ATOM 3098 C CA . LYS A 1 450 ? 0.733 -37.540 11.791 1.00 43.98 ? 461 LYS A CA 1 ATOM 3099 C C . LYS A 1 450 ? 1.440 -36.235 11.428 1.00 52.41 ? 461 LYS A C 1 ATOM 3100 O O . LYS A 1 450 ? 2.647 -36.098 11.630 1.00 42.99 ? 461 LYS A O 1 ATOM 3101 C CB . LYS A 1 450 ? 1.551 -38.333 12.809 1.00 38.99 ? 461 LYS A CB 1 ATOM 3102 C CG . LYS A 1 450 ? 0.762 -39.441 13.499 1.00 50.42 ? 461 LYS A CG 1 ATOM 3103 C CD . LYS A 1 450 ? 1.465 -39.933 14.759 1.00 48.39 ? 461 LYS A CD 1 ATOM 3104 C CE . LYS A 1 450 ? 2.857 -40.483 14.465 1.00 51.81 ? 461 LYS A CE 1 ATOM 3105 N NZ . LYS A 1 450 ? 2.820 -41.728 13.640 1.00 57.79 ? 461 LYS A NZ 1 ATOM 3106 N N . PRO A 1 451 ? 0.680 -35.269 10.889 1.00 46.81 ? 462 PRO A N 1 ATOM 3107 C CA . PRO A 1 451 ? 1.207 -33.944 10.558 1.00 37.66 ? 462 PRO A CA 1 ATOM 3108 C C . PRO A 1 451 ? 1.734 -33.267 11.815 1.00 55.80 ? 462 PRO A C 1 ATOM 3109 O O . PRO A 1 451 ? 1.179 -33.479 12.895 1.00 60.73 ? 462 PRO A O 1 ATOM 3110 C CB . PRO A 1 451 ? -0.029 -33.185 10.064 1.00 37.33 ? 462 PRO A CB 1 ATOM 3111 C CG . PRO A 1 451 ? -1.036 -34.228 9.744 1.00 39.09 ? 462 PRO A CG 1 ATOM 3112 C CD . PRO A 1 451 ? -0.773 -35.350 10.680 1.00 49.08 ? 462 PRO A CD 1 ATOM 3113 N N . PHE A 1 452 ? 2.787 -32.469 11.664 1.00 56.77 ? 463 PHE A N 1 ATOM 3114 C CA . PHE A 1 452 ? 3.373 -31.713 12.765 1.00 51.33 ? 463 PHE A CA 1 ATOM 3115 C C . PHE A 1 452 ? 3.931 -32.606 13.863 1.00 55.28 ? 463 PHE A C 1 ATOM 3116 O O . PHE A 1 452 ? 3.738 -32.349 15.057 1.00 46.50 ? 463 PHE A O 1 ATOM 3117 C CB . PHE A 1 452 ? 2.377 -30.706 13.341 1.00 50.37 ? 463 PHE A CB 1 ATOM 3118 C CG . PHE A 1 452 ? 1.741 -29.831 12.305 1.00 52.59 ? 463 PHE A CG 1 ATOM 3119 C CD1 . PHE A 1 452 ? 2.522 -29.043 11.474 1.00 47.29 ? 463 PHE A CD1 1 ATOM 3120 C CD2 . PHE A 1 452 ? 0.363 -29.791 12.162 1.00 41.97 ? 463 PHE A CD2 1 ATOM 3121 C CE1 . PHE A 1 452 ? 1.938 -28.230 10.520 1.00 60.37 ? 463 PHE A CE1 1 ATOM 3122 C CE2 . PHE A 1 452 ? -0.226 -28.980 11.208 1.00 51.72 ? 463 PHE A CE2 1 ATOM 3123 C CZ . PHE A 1 452 ? 0.562 -28.199 10.387 1.00 54.94 ? 463 PHE A CZ 1 ATOM 3124 N N . SER A 1 453 ? 4.624 -33.656 13.441 1.00 61.10 ? 464 SER A N 1 ATOM 3125 C CA . SER A 1 453 ? 5.382 -34.501 14.351 1.00 54.68 ? 464 SER A CA 1 ATOM 3126 C C . SER A 1 453 ? 6.867 -34.253 14.131 1.00 56.05 ? 464 SER A C 1 ATOM 3127 O O . SER A 1 453 ? 7.247 -33.552 13.192 1.00 68.60 ? 464 SER A O 1 ATOM 3128 C CB . SER A 1 453 ? 5.041 -35.974 14.128 1.00 52.93 ? 464 SER A CB 1 ATOM 3129 O OG . SER A 1 453 ? 4.932 -36.265 12.747 1.00 61.67 ? 464 SER A OG 1 ATOM 3130 N N . TYR A 1 454 ? 7.704 -34.827 14.988 1.00 38.18 ? 465 TYR A N 1 ATOM 3131 C CA . TYR A 1 454 ? 9.143 -34.594 14.912 1.00 42.16 ? 465 TYR A CA 1 ATOM 3132 C C . TYR A 1 454 ? 9.924 -35.684 15.639 1.00 40.72 ? 465 TYR A C 1 ATOM 3133 O O . TYR A 1 454 ? 9.431 -36.295 16.582 1.00 40.66 ? 465 TYR A O 1 ATOM 3134 C CB . TYR A 1 454 ? 9.489 -33.207 15.476 1.00 40.15 ? 465 TYR A CB 1 ATOM 3135 C CG . TYR A 1 454 ? 10.970 -32.898 15.575 1.00 33.31 ? 465 TYR A CG 1 ATOM 3136 C CD1 . TYR A 1 454 ? 11.688 -32.472 14.467 1.00 45.56 ? 465 TYR A CD1 1 ATOM 3137 C CD2 . TYR A 1 454 ? 11.644 -33.013 16.783 1.00 39.44 ? 465 TYR A CD2 1 ATOM 3138 C CE1 . TYR A 1 454 ? 13.048 -32.176 14.558 1.00 25.16 ? 465 TYR A CE1 1 ATOM 3139 C CE2 . TYR A 1 454 ? 12.998 -32.720 16.885 1.00 39.90 ? 465 TYR A CE2 1 ATOM 3140 C CZ . TYR A 1 454 ? 13.694 -32.300 15.767 1.00 44.08 ? 465 TYR A CZ 1 ATOM 3141 O OH . TYR A 1 454 ? 15.039 -32.010 15.862 1.00 44.65 ? 465 TYR A OH 1 ATOM 3142 N N . TYR A 1 455 ? 11.142 -35.929 15.175 1.00 42.82 ? 466 TYR A N 1 ATOM 3143 C CA . TYR A 1 455 ? 12.014 -36.908 15.792 1.00 47.64 ? 466 TYR A CA 1 ATOM 3144 C C . TYR A 1 455 ? 13.448 -36.511 15.541 1.00 57.83 ? 466 TYR A C 1 ATOM 3145 O O . TYR A 1 455 ? 13.779 -36.018 14.465 1.00 53.69 ? 466 TYR A O 1 ATOM 3146 C CB . TYR A 1 455 ? 11.767 -38.298 15.218 1.00 44.84 ? 466 TYR A CB 1 ATOM 3147 C CG . TYR A 1 455 ? 12.770 -39.333 15.675 1.00 55.83 ? 466 TYR A CG 1 ATOM 3148 C CD1 . TYR A 1 455 ? 12.695 -39.890 16.946 1.00 50.53 ? 466 TYR A CD1 1 ATOM 3149 C CD2 . TYR A 1 455 ? 13.788 -39.762 14.831 1.00 56.78 ? 466 TYR A CD2 1 ATOM 3150 C CE1 . TYR A 1 455 ? 13.616 -40.841 17.369 1.00 32.10 ? 466 TYR A CE1 1 ATOM 3151 C CE2 . TYR A 1 455 ? 14.708 -40.710 15.242 1.00 43.00 ? 466 TYR A CE2 1 ATOM 3152 C CZ . TYR A 1 455 ? 14.617 -41.246 16.511 1.00 40.94 ? 466 TYR A CZ 1 ATOM 3153 O OH . TYR A 1 455 ? 15.533 -42.185 16.923 1.00 50.07 ? 466 TYR A OH 1 ATOM 3154 N N . LYS A 1 456 ? 14.297 -36.710 16.541 1.00 51.12 ? 467 LYS A N 1 ATOM 3155 C CA . LYS A 1 456 ? 15.723 -36.527 16.350 1.00 46.59 ? 467 LYS A CA 1 ATOM 3156 C C . LYS A 1 456 ? 16.491 -37.673 16.980 1.00 49.12 ? 467 LYS A C 1 ATOM 3157 O O . LYS A 1 456 ? 16.149 -38.153 18.060 1.00 40.49 ? 467 LYS A O 1 ATOM 3158 C CB . LYS A 1 456 ? 16.211 -35.195 16.920 1.00 30.27 ? 467 LYS A CB 1 ATOM 3159 C CG . LYS A 1 456 ? 17.588 -34.810 16.394 1.00 25.90 ? 467 LYS A CG 1 ATOM 3160 C CD . LYS A 1 456 ? 18.435 -34.114 17.442 1.00 43.10 ? 467 LYS A CD 1 ATOM 3161 C CE . LYS A 1 456 ? 18.144 -32.632 17.511 1.00 51.11 ? 467 LYS A CE 1 ATOM 3162 N NZ . LYS A 1 456 ? 18.839 -31.990 18.663 1.00 46.47 ? 467 LYS A NZ 1 ATOM 3163 N N . SER A 1 457 ? 17.532 -38.111 16.289 1.00 40.47 ? 468 SER A N 1 ATOM 3164 C CA . SER A 1 457 ? 18.388 -39.162 16.795 1.00 28.59 ? 468 SER A CA 1 ATOM 3165 C C . SER A 1 457 ? 19.812 -38.639 16.843 1.00 40.54 ? 468 SER A C 1 ATOM 3166 O O . SER A 1 457 ? 20.205 -37.816 16.023 1.00 49.88 ? 468 SER A O 1 ATOM 3167 C CB . SER A 1 457 ? 18.287 -40.409 15.913 1.00 30.99 ? 468 SER A CB 1 ATOM 3168 O OG . SER A 1 457 ? 19.235 -41.391 16.290 1.00 40.39 ? 468 SER A OG 1 ATOM 3169 N N . ASP A 1 458 ? 20.574 -39.107 17.822 1.00 44.72 ? 469 ASP A N 1 ATOM 3170 C CA . ASP A 1 458 ? 21.969 -38.725 17.961 1.00 41.07 ? 469 ASP A CA 1 ATOM 3171 C C . ASP A 1 458 ? 22.664 -39.762 18.822 1.00 36.08 ? 469 ASP A C 1 ATOM 3172 O O . ASP A 1 458 ? 22.293 -39.966 19.976 1.00 37.61 ? 469 ASP A O 1 ATOM 3173 C CB . ASP A 1 458 ? 22.094 -37.335 18.600 1.00 32.85 ? 469 ASP A CB 1 ATOM 3174 C CG . ASP A 1 458 ? 23.516 -36.801 18.568 1.00 47.85 ? 469 ASP A CG 1 ATOM 3175 O OD1 . ASP A 1 458 ? 24.328 -37.315 17.771 1.00 57.08 ? 469 ASP A OD1 1 ATOM 3176 O OD2 . ASP A 1 458 ? 23.823 -35.861 19.333 1.00 58.09 ? 469 ASP A OD2 1 ATOM 3177 N N . ARG A 1 459 ? 23.665 -40.423 18.254 1.00 37.83 ? 470 ARG A N 1 ATOM 3178 C CA . ARG A 1 459 ? 24.422 -41.432 18.983 1.00 36.93 ? 470 ARG A CA 1 ATOM 3179 C C . ARG A 1 459 ? 25.910 -41.117 18.982 1.00 40.95 ? 470 ARG A C 1 ATOM 3180 O O . ARG A 1 459 ? 26.522 -40.928 17.932 1.00 33.32 ? 470 ARG A O 1 ATOM 3181 C CB . ARG A 1 459 ? 24.185 -42.821 18.393 1.00 32.43 ? 470 ARG A CB 1 ATOM 3182 C CG . ARG A 1 459 ? 24.862 -43.940 19.169 1.00 37.07 ? 470 ARG A CG 1 ATOM 3183 C CD . ARG A 1 459 ? 24.656 -45.285 18.498 1.00 34.87 ? 470 ARG A CD 1 ATOM 3184 N NE . ARG A 1 459 ? 23.272 -45.474 18.078 1.00 35.03 ? 470 ARG A NE 1 ATOM 3185 C CZ . ARG A 1 459 ? 22.381 -46.209 18.730 1.00 38.17 ? 470 ARG A CZ 1 ATOM 3186 N NH1 . ARG A 1 459 ? 22.725 -46.841 19.842 1.00 53.48 ? 470 ARG A NH1 1 ATOM 3187 N NH2 . ARG A 1 459 ? 21.147 -46.320 18.262 1.00 32.33 ? 470 ARG A NH2 1 ATOM 3188 N N . VAL A 1 460 ? 26.485 -41.055 20.175 1.00 45.16 ? 471 VAL A N 1 ATOM 3189 C CA . VAL A 1 460 ? 27.914 -40.838 20.318 1.00 33.17 ? 471 VAL A CA 1 ATOM 3190 C C . VAL A 1 460 ? 28.516 -42.059 20.990 1.00 44.40 ? 471 VAL A C 1 ATOM 3191 O O . VAL A 1 460 ? 28.067 -42.463 22.059 1.00 56.79 ? 471 VAL A O 1 ATOM 3192 C CB . VAL A 1 460 ? 28.211 -39.586 21.158 1.00 35.29 ? 471 VAL A CB 1 ATOM 3193 C CG1 . VAL A 1 460 ? 29.709 -39.409 21.323 1.00 28.50 ? 471 VAL A CG1 1 ATOM 3194 C CG2 . VAL A 1 460 ? 27.578 -38.352 20.517 1.00 40.11 ? 471 VAL A CG2 1 ATOM 3195 N N . ILE A 1 461 ? 29.521 -42.656 20.360 1.00 39.61 ? 472 ILE A N 1 ATOM 3196 C CA . ILE A 1 461 ? 30.117 -43.875 20.886 1.00 46.73 ? 472 ILE A CA 1 ATOM 3197 C C . ILE A 1 461 ? 31.589 -43.692 21.237 1.00 53.28 ? 472 ILE A C 1 ATOM 3198 O O . ILE A 1 461 ? 32.414 -43.434 20.362 1.00 55.86 ? 472 ILE A O 1 ATOM 3199 C CB . ILE A 1 461 ? 29.998 -45.022 19.873 1.00 44.29 ? 472 ILE A CB 1 ATOM 3200 C CG1 . ILE A 1 461 ? 28.554 -45.158 19.387 1.00 42.22 ? 472 ILE A CG1 1 ATOM 3201 C CG2 . ILE A 1 461 ? 30.500 -46.316 20.480 1.00 32.39 ? 472 ILE A CG2 1 ATOM 3202 C CD1 . ILE A 1 461 ? 28.376 -46.207 18.309 1.00 45.31 ? 472 ILE A CD1 1 ATOM 3203 N N . TYR A 1 462 ? 31.927 -43.828 22.515 1.00 56.89 ? 473 TYR A N 1 ATOM 3204 C CA . TYR A 1 462 ? 33.331 -43.756 22.901 1.00 53.28 ? 473 TYR A CA 1 ATOM 3205 C C . TYR A 1 462 ? 33.888 -45.115 23.317 1.00 43.47 ? 473 TYR A C 1 ATOM 3206 O O . TYR A 1 462 ? 33.214 -45.890 23.995 1.00 41.55 ? 473 TYR A O 1 ATOM 3207 C CB . TYR A 1 462 ? 33.582 -42.714 23.997 1.00 48.67 ? 473 TYR A CB 1 ATOM 3208 C CG . TYR A 1 462 ? 35.062 -42.536 24.239 1.00 39.02 ? 473 TYR A CG 1 ATOM 3209 C CD1 . TYR A 1 462 ? 35.884 -42.062 23.231 1.00 32.14 ? 473 TYR A CD1 1 ATOM 3210 C CD2 . TYR A 1 462 ? 35.642 -42.879 25.451 1.00 32.34 ? 473 TYR A CD2 1 ATOM 3211 C CE1 . TYR A 1 462 ? 37.240 -41.924 23.420 1.00 44.46 ? 473 TYR A CE1 1 ATOM 3212 C CE2 . TYR A 1 462 ? 37.001 -42.731 25.654 1.00 37.41 ? 473 TYR A CE2 1 ATOM 3213 C CZ . TYR A 1 462 ? 37.793 -42.256 24.633 1.00 50.46 ? 473 TYR A CZ 1 ATOM 3214 O OH . TYR A 1 462 ? 39.145 -42.108 24.822 1.00 58.09 ? 473 TYR A OH 1 ATOM 3215 N N . GLY A 1 463 ? 35.123 -45.395 22.904 1.00 36.44 ? 474 GLY A N 1 ATOM 3216 C CA . GLY A 1 463 ? 35.740 -46.679 23.176 1.00 36.38 ? 474 GLY A CA 1 ATOM 3217 C C . GLY A 1 463 ? 37.254 -46.680 23.285 1.00 50.00 ? 474 GLY A C 1 ATOM 3218 O O . GLY A 1 463 ? 37.949 -45.954 22.570 1.00 52.18 ? 474 GLY A O 1 ATOM 3219 N N . GLU A 1 464 ? 37.767 -47.513 24.185 1.00 51.84 ? 475 GLU A N 1 ATOM 3220 C CA . GLU A 1 464 ? 39.208 -47.703 24.322 1.00 46.33 ? 475 GLU A CA 1 ATOM 3221 C C . GLU A 1 464 ? 39.583 -49.174 24.254 1.00 42.68 ? 475 GLU A C 1 ATOM 3222 O O . GLU A 1 464 ? 38.796 -50.047 24.620 1.00 56.32 ? 475 GLU A O 1 ATOM 3223 C CB . GLU A 1 464 ? 39.723 -47.092 25.625 1.00 45.46 ? 475 GLU A CB 1 ATOM 3224 C CG . GLU A 1 464 ? 39.783 -45.576 25.606 1.00 47.63 ? 475 GLU A CG 1 ATOM 3225 C CD . GLU A 1 464 ? 40.005 -44.984 26.979 1.00 53.09 ? 475 GLU A CD 1 ATOM 3226 O OE1 . GLU A 1 464 ? 40.291 -45.749 27.924 1.00 72.54 ? 475 GLU A OE1 1 ATOM 3227 O OE2 . GLU A 1 464 ? 39.878 -43.751 27.115 1.00 50.94 ? 475 GLU A OE2 1 ATOM 3228 N N . SER A 1 465 ? 40.792 -49.441 23.776 1.00 42.32 ? 476 SER A N 1 ATOM 3229 C CA . SER A 1 465 ? 41.288 -50.806 23.681 1.00 46.61 ? 476 SER A CA 1 ATOM 3230 C C . SER A 1 465 ? 42.721 -50.891 24.178 1.00 57.45 ? 476 SER A C 1 ATOM 3231 O O . SER A 1 465 ? 43.525 -49.989 23.944 1.00 68.56 ? 476 SER A O 1 ATOM 3232 C CB . SER A 1 465 ? 41.227 -51.298 22.237 1.00 46.86 ? 476 SER A CB 1 ATOM 3233 O OG . SER A 1 465 ? 42.083 -50.525 21.415 1.00 58.36 ? 476 SER A OG 1 ATOM 3234 N N . HIS A 1 466 ? 43.031 -51.980 24.870 1.00 48.53 ? 477 HIS A N 1 ATOM 3235 C CA . HIS A 1 466 ? 44.401 -52.270 25.254 1.00 47.11 ? 477 HIS A CA 1 ATOM 3236 C C . HIS A 1 466 ? 44.784 -53.662 24.776 1.00 48.60 ? 477 HIS A C 1 ATOM 3237 O O . HIS A 1 466 ? 43.970 -54.585 24.794 1.00 51.09 ? 477 HIS A O 1 ATOM 3238 C CB . HIS A 1 466 ? 44.575 -52.189 26.771 1.00 43.27 ? 477 HIS A CB 1 ATOM 3239 C CG . HIS A 1 466 ? 44.163 -50.880 27.361 1.00 46.03 ? 477 HIS A CG 1 ATOM 3240 N ND1 . HIS A 1 466 ? 45.043 -49.833 27.540 1.00 47.70 ? 477 HIS A ND1 1 ATOM 3241 C CD2 . HIS A 1 466 ? 42.965 -50.450 27.822 1.00 54.06 ? 477 HIS A CD2 1 ATOM 3242 C CE1 . HIS A 1 466 ? 44.402 -48.812 28.081 1.00 59.94 ? 477 HIS A CE1 1 ATOM 3243 N NE2 . HIS A 1 466 ? 43.140 -49.161 28.264 1.00 57.43 ? 477 HIS A NE2 1 ATOM 3244 N N . ARG A 1 467 ? 46.024 -53.800 24.330 1.00 44.96 ? 478 ARG A N 1 ATOM 3245 C CA . ARG A 1 467 ? 46.597 -55.108 24.063 1.00 47.17 ? 478 ARG A CA 1 ATOM 3246 C C . ARG A 1 467 ? 47.871 -55.167 24.883 1.00 56.55 ? 478 ARG A C 1 ATOM 3247 O O . ARG A 1 467 ? 48.964 -54.906 24.387 1.00 67.58 ? 478 ARG A O 1 ATOM 3248 C CB . ARG A 1 467 ? 46.862 -55.306 22.573 1.00 49.73 ? 478 ARG A CB 1 ATOM 3249 C CG . ARG A 1 467 ? 45.599 -55.231 21.727 1.00 62.11 ? 478 ARG A CG 1 ATOM 3250 C CD . ARG A 1 467 ? 45.801 -55.813 20.332 1.00 76.42 ? 478 ARG A CD 1 ATOM 3251 N NE . ARG A 1 467 ? 46.780 -55.067 19.546 1.00 83.18 ? 478 ARG A NE 1 ATOM 3252 C CZ . ARG A 1 467 ? 46.496 -53.981 18.832 1.00 88.57 ? 478 ARG A CZ 1 ATOM 3253 N NH1 . ARG A 1 467 ? 45.257 -53.507 18.807 1.00 102.41 ? 478 ARG A NH1 1 ATOM 3254 N NH2 . ARG A 1 467 ? 47.449 -53.364 18.145 1.00 75.69 ? 478 ARG A NH2 1 ATOM 3255 N N . LEU A 1 468 ? 47.702 -55.498 26.158 1.00 58.85 ? 479 LEU A N 1 ATOM 3256 C CA . LEU A 1 468 ? 48.741 -55.297 27.160 1.00 60.20 ? 479 LEU A CA 1 ATOM 3257 C C . LEU A 1 468 ? 49.529 -56.566 27.489 1.00 72.07 ? 479 LEU A C 1 ATOM 3258 O O . LEU A 1 468 ? 48.958 -57.628 27.744 1.00 75.71 ? 479 LEU A O 1 ATOM 3259 C CB . LEU A 1 468 ? 48.118 -54.702 28.426 1.00 46.91 ? 479 LEU A CB 1 ATOM 3260 C CG . LEU A 1 468 ? 49.000 -54.502 29.654 1.00 58.38 ? 479 LEU A CG 1 ATOM 3261 C CD1 . LEU A 1 468 ? 50.138 -53.538 29.364 1.00 53.27 ? 479 LEU A CD1 1 ATOM 3262 C CD2 . LEU A 1 468 ? 48.149 -54.008 30.810 1.00 69.83 ? 479 LEU A CD2 1 ATOM 3263 N N . LEU A 1 469 ? 50.850 -56.434 27.488 1.00 60.17 ? 480 LEU A N 1 ATOM 3264 C CA . LEU A 1 469 ? 51.748 -57.548 27.736 1.00 57.91 ? 480 LEU A CA 1 ATOM 3265 C C . LEU A 1 469 ? 52.558 -57.235 28.988 1.00 73.61 ? 480 LEU A C 1 ATOM 3266 O O . LEU A 1 469 ? 53.338 -56.285 29.001 1.00 82.40 ? 480 LEU A O 1 ATOM 3267 C CB . LEU A 1 469 ? 52.673 -57.719 26.533 1.00 50.28 ? 480 LEU A CB 1 ATOM 3268 C CG . LEU A 1 469 ? 53.316 -59.077 26.271 1.00 69.05 ? 480 LEU A CG 1 ATOM 3269 C CD1 . LEU A 1 469 ? 52.265 -60.170 26.242 1.00 76.08 ? 480 LEU A CD1 1 ATOM 3270 C CD2 . LEU A 1 469 ? 54.067 -59.029 24.954 1.00 66.13 ? 480 LEU A CD2 1 ATOM 3271 N N . GLN A 1 470 ? 52.370 -58.022 30.045 1.00 68.70 ? 481 GLN A N 1 ATOM 3272 C CA . GLN A 1 470 ? 53.002 -57.712 31.329 1.00 63.45 ? 481 GLN A CA 1 ATOM 3273 C C . GLN A 1 470 ? 53.879 -58.829 31.902 1.00 75.39 ? 481 GLN A C 1 ATOM 3274 O O . GLN A 1 470 ? 53.453 -59.977 32.024 1.00 76.11 ? 481 GLN A O 1 ATOM 3275 C CB . GLN A 1 470 ? 51.948 -57.302 32.363 1.00 63.89 ? 481 GLN A CB 1 ATOM 3276 C CG . GLN A 1 470 ? 51.213 -56.019 32.032 1.00 72.83 ? 481 GLN A CG 1 ATOM 3277 C CD . GLN A 1 470 ? 50.349 -55.525 33.179 1.00 75.12 ? 481 GLN A CD 1 ATOM 3278 O OE1 . GLN A 1 470 ? 50.459 -54.373 33.596 1.00 80.40 ? 481 GLN A OE1 1 ATOM 3279 N NE2 . GLN A 1 470 ? 49.481 -56.393 33.690 1.00 63.52 ? 481 GLN A NE2 1 ATOM 3280 N N . ALA A 1 471 ? 55.106 -58.472 32.265 1.00 77.52 ? 482 ALA A N 1 ATOM 3281 C CA . ALA A 1 471 ? 56.006 -59.395 32.945 1.00 83.59 ? 482 ALA A CA 1 ATOM 3282 C C . ALA A 1 471 ? 56.251 -58.935 34.381 1.00 79.33 ? 482 ALA A C 1 ATOM 3283 O O . ALA A 1 471 ? 56.612 -57.783 34.617 1.00 82.00 ? 482 ALA A O 1 ATOM 3284 C CB . ALA A 1 471 ? 57.318 -59.506 32.192 1.00 88.90 ? 482 ALA A CB 1 ATOM 3285 N N . ALA A 1 472 ? 56.046 -59.836 35.337 1.00 76.99 ? 483 ALA A N 1 ATOM 3286 C CA . ALA A 1 472 ? 56.263 -59.524 36.748 1.00 80.98 ? 483 ALA A CA 1 ATOM 3287 C C . ALA A 1 472 ? 57.135 -60.577 37.432 1.00 77.37 ? 483 ALA A C 1 ATOM 3288 O O . ALA A 1 472 ? 56.743 -61.734 37.553 1.00 76.27 ? 483 ALA A O 1 ATOM 3289 C CB . ALA A 1 472 ? 54.933 -59.385 37.472 1.00 57.21 ? 483 ALA A CB 1 ATOM 3290 N N . PHE A 1 473 ? 58.320 -60.172 37.874 1.00 66.57 ? 484 PHE A N 1 ATOM 3291 C CA . PHE A 1 473 ? 59.213 -61.077 38.584 1.00 68.22 ? 484 PHE A CA 1 ATOM 3292 C C . PHE A 1 473 ? 59.380 -60.633 40.038 1.00 77.88 ? 484 PHE A C 1 ATOM 3293 O O . PHE A 1 473 ? 59.230 -59.453 40.357 1.00 74.70 ? 484 PHE A O 1 ATOM 3294 C CB . PHE A 1 473 ? 60.574 -61.146 37.895 1.00 70.92 ? 484 PHE A CB 1 ATOM 3295 C CG . PHE A 1 473 ? 60.500 -61.454 36.425 1.00 86.59 ? 484 PHE A CG 1 ATOM 3296 C CD1 . PHE A 1 473 ? 60.476 -62.766 35.978 1.00 89.02 ? 484 PHE A CD1 1 ATOM 3297 C CD2 . PHE A 1 473 ? 60.472 -60.431 35.489 1.00 91.55 ? 484 PHE A CD2 1 ATOM 3298 C CE1 . PHE A 1 473 ? 60.417 -63.053 34.623 1.00 79.57 ? 484 PHE A CE1 1 ATOM 3299 C CE2 . PHE A 1 473 ? 60.412 -60.710 34.133 1.00 88.66 ? 484 PHE A CE2 1 ATOM 3300 C CZ . PHE A 1 473 ? 60.385 -62.024 33.700 1.00 81.18 ? 484 PHE A CZ 1 ATOM 3301 N N . LYS A 1 474 ? 59.699 -61.582 40.914 1.00 84.15 ? 485 LYS A N 1 ATOM 3302 C CA . LYS A 1 474 ? 59.778 -61.304 42.343 1.00 79.40 ? 485 LYS A CA 1 ATOM 3303 C C . LYS A 1 474 ? 60.690 -62.308 43.055 1.00 85.91 ? 485 LYS A C 1 ATOM 3304 O O . LYS A 1 474 ? 60.583 -63.515 42.843 1.00 88.63 ? 485 LYS A O 1 ATOM 3305 C CB . LYS A 1 474 ? 58.371 -61.326 42.943 1.00 72.87 ? 485 LYS A CB 1 ATOM 3306 C CG . LYS A 1 474 ? 58.253 -60.701 44.317 1.00 84.53 ? 485 LYS A CG 1 ATOM 3307 C CD . LYS A 1 474 ? 56.792 -60.563 44.719 1.00 87.19 ? 485 LYS A CD 1 ATOM 3308 C CE . LYS A 1 474 ? 56.028 -59.707 43.716 1.00 91.12 ? 485 LYS A CE 1 ATOM 3309 N NZ . LYS A 1 474 ? 54.595 -59.530 44.087 1.00 90.56 ? 485 LYS A NZ 1 ATOM 3310 N N . LYS A 1 475 ? 61.590 -61.800 43.893 1.00 95.47 ? 486 LYS A N 1 ATOM 3311 C CA . LYS A 1 475 ? 62.563 -62.642 44.595 1.00 99.99 ? 486 LYS A CA 1 ATOM 3312 C C . LYS A 1 475 ? 62.995 -62.004 45.915 1.00 97.90 ? 486 LYS A C 1 ATOM 3313 O O . LYS A 1 475 ? 63.165 -60.788 46.001 1.00 97.36 ? 486 LYS A O 1 ATOM 3314 C CB . LYS A 1 475 ? 63.789 -62.892 43.708 1.00 99.10 ? 486 LYS A CB 1 ATOM 3315 C CG . LYS A 1 475 ? 64.930 -63.640 44.385 1.00 86.96 ? 486 LYS A CG 1 ATOM 3316 C CD . LYS A 1 475 ? 64.582 -65.103 44.606 1.00 89.71 ? 486 LYS A CD 1 ATOM 3317 C CE . LYS A 1 475 ? 65.686 -65.837 45.358 1.00 98.80 ? 486 LYS A CE 1 ATOM 3318 N NZ . LYS A 1 475 ? 65.361 -67.274 45.573 1.00 87.37 ? 486 LYS A NZ 1 ATOM 3319 N N . SER A 1 476 ? 63.168 -62.828 46.943 1.00 99.85 ? 487 SER A N 1 ATOM 3320 C CA . SER A 1 476 ? 63.607 -62.336 48.245 1.00 103.27 ? 487 SER A CA 1 ATOM 3321 C C . SER A 1 476 ? 65.056 -62.722 48.537 1.00 101.00 ? 487 SER A C 1 ATOM 3322 O O . SER A 1 476 ? 65.429 -63.892 48.433 1.00 92.39 ? 487 SER A O 1 ATOM 3323 C CB . SER A 1 476 ? 62.686 -62.846 49.355 1.00 104.65 ? 487 SER A CB 1 ATOM 3324 O OG . SER A 1 476 ? 62.691 -64.260 49.412 1.00 116.86 ? 487 SER A OG 1 ATOM 3325 N N . PHE A 1 477 ? 65.864 -61.728 48.901 1.00 106.90 ? 488 PHE A N 1 ATOM 3326 C CA . PHE A 1 477 ? 67.272 -61.939 49.229 1.00 116.24 ? 488 PHE A CA 1 ATOM 3327 C C . PHE A 1 477 ? 67.536 -61.786 50.725 1.00 121.46 ? 488 PHE A C 1 ATOM 3328 O O . PHE A 1 477 ? 66.706 -61.253 51.460 1.00 111.19 ? 488 PHE A O 1 ATOM 3329 C CB . PHE A 1 477 ? 68.152 -60.951 48.461 1.00 124.74 ? 488 PHE A CB 1 ATOM 3330 C CG . PHE A 1 477 ? 68.291 -61.264 47.001 1.00 136.95 ? 488 PHE A CG 1 ATOM 3331 C CD1 . PHE A 1 477 ? 68.585 -60.262 46.092 1.00 142.12 ? 488 PHE A CD1 1 ATOM 3332 C CD2 . PHE A 1 477 ? 68.138 -62.561 46.539 1.00 144.23 ? 488 PHE A CD2 1 ATOM 3333 C CE1 . PHE A 1 477 ? 68.718 -60.545 44.745 1.00 146.85 ? 488 PHE A CE1 1 ATOM 3334 C CE2 . PHE A 1 477 ? 68.270 -62.851 45.194 1.00 149.06 ? 488 PHE A CE2 1 ATOM 3335 C CZ . PHE A 1 477 ? 68.560 -61.841 44.295 1.00 150.86 ? 488 PHE A CZ 1 ATOM 3336 N N . ASP A 1 478 ? 68.700 -62.255 51.168 1.00 138.72 ? 489 ASP A N 1 ATOM 3337 C CA . ASP A 1 478 ? 69.130 -62.083 52.555 1.00 141.77 ? 489 ASP A CA 1 ATOM 3338 C C . ASP A 1 478 ? 70.481 -61.378 52.634 1.00 147.52 ? 489 ASP A C 1 ATOM 3339 O O . ASP A 1 478 ? 71.260 -61.398 51.681 1.00 148.17 ? 489 ASP A O 1 ATOM 3340 C CB . ASP A 1 478 ? 69.201 -63.430 53.278 1.00 131.56 ? 489 ASP A CB 1 ATOM 3341 C CG . ASP A 1 478 ? 67.869 -63.843 53.873 1.00 121.68 ? 489 ASP A CG 1 ATOM 3342 O OD1 . ASP A 1 478 ? 66.817 -63.524 53.276 1.00 108.25 ? 489 ASP A OD1 1 ATOM 3343 O OD2 . ASP A 1 478 ? 67.879 -64.485 54.943 1.00 120.92 ? 489 ASP A OD2 1 ATOM 3344 N N . LYS A 1 481 ? 71.025 -61.568 57.124 1.00 121.17 ? 492 LYS A N 1 ATOM 3345 C CA . LYS A 1 481 ? 69.861 -61.639 58.000 1.00 124.62 ? 492 LYS A CA 1 ATOM 3346 C C . LYS A 1 481 ? 68.795 -60.627 57.582 1.00 138.57 ? 492 LYS A C 1 ATOM 3347 O O . LYS A 1 481 ? 67.598 -60.916 57.630 1.00 137.11 ? 492 LYS A O 1 ATOM 3348 C CB . LYS A 1 481 ? 70.269 -61.415 59.459 1.00 114.97 ? 492 LYS A CB 1 ATOM 3349 N N . ILE A 1 482 ? 69.237 -59.442 57.173 1.00 143.23 ? 493 ILE A N 1 ATOM 3350 C CA . ILE A 1 482 ? 68.328 -58.402 56.702 1.00 135.88 ? 493 ILE A CA 1 ATOM 3351 C C . ILE A 1 482 ? 67.743 -58.782 55.342 1.00 135.39 ? 493 ILE A C 1 ATOM 3352 O O . ILE A 1 482 ? 68.424 -58.702 54.318 1.00 137.86 ? 493 ILE A O 1 ATOM 3353 C CB . ILE A 1 482 ? 69.037 -57.038 56.595 1.00 129.26 ? 493 ILE A CB 1 ATOM 3354 N N . ARG A 1 483 ? 66.478 -59.192 55.343 1.00 129.13 ? 494 ARG A N 1 ATOM 3355 C CA . ARG A 1 483 ? 65.834 -59.718 54.141 1.00 121.00 ? 494 ARG A CA 1 ATOM 3356 C C . ARG A 1 483 ? 65.367 -58.634 53.173 1.00 119.57 ? 494 ARG A C 1 ATOM 3357 O O . ARG A 1 483 ? 64.574 -57.765 53.531 1.00 117.39 ? 494 ARG A O 1 ATOM 3358 C CB . ARG A 1 483 ? 64.653 -60.619 54.518 1.00 115.99 ? 494 ARG A CB 1 ATOM 3359 N N . HIS A 1 484 ? 65.865 -58.699 51.941 1.00 118.36 ? 495 HIS A N 1 ATOM 3360 C CA . HIS A 1 484 ? 65.425 -57.800 50.881 1.00 108.61 ? 495 HIS A CA 1 ATOM 3361 C C . HIS A 1 484 ? 64.334 -58.463 50.053 1.00 93.57 ? 495 HIS A C 1 ATOM 3362 O O . HIS A 1 484 ? 64.484 -59.605 49.627 1.00 89.86 ? 495 HIS A O 1 ATOM 3363 C CB . HIS A 1 484 ? 66.593 -57.440 49.962 1.00 114.78 ? 495 HIS A CB 1 ATOM 3364 C CG . HIS A 1 484 ? 67.654 -56.616 50.620 1.00 128.39 ? 495 HIS A CG 1 ATOM 3365 N ND1 . HIS A 1 484 ? 67.784 -55.261 50.406 1.00 127.67 ? 495 HIS A ND1 1 ATOM 3366 C CD2 . HIS A 1 484 ? 68.639 -56.956 51.486 1.00 139.18 ? 495 HIS A CD2 1 ATOM 3367 C CE1 . HIS A 1 484 ? 68.801 -54.801 51.112 1.00 135.68 ? 495 HIS A CE1 1 ATOM 3368 N NE2 . HIS A 1 484 ? 69.337 -55.809 51.776 1.00 143.64 ? 495 HIS A NE2 1 ATOM 3369 N N . ASN A 1 485 ? 63.237 -57.750 49.824 1.00 81.56 ? 496 ASN A N 1 ATOM 3370 C CA . ASN A 1 485 ? 62.197 -58.238 48.925 1.00 96.63 ? 496 ASN A CA 1 ATOM 3371 C C . ASN A 1 485 ? 62.175 -57.449 47.620 1.00 91.44 ? 496 ASN A C 1 ATOM 3372 O O . ASN A 1 485 ? 61.532 -56.405 47.525 1.00 90.30 ? 496 ASN A O 1 ATOM 3373 C CB . ASN A 1 485 ? 60.820 -58.205 49.594 1.00 94.61 ? 496 ASN A CB 1 ATOM 3374 C CG . ASN A 1 485 ? 60.703 -59.190 50.741 1.00 104.36 ? 496 ASN A CG 1 ATOM 3375 O OD1 . ASN A 1 485 ? 61.510 -60.113 50.868 1.00 108.94 ? 496 ASN A OD1 1 ATOM 3376 N ND2 . ASN A 1 485 ? 59.690 -59.004 51.579 1.00 105.02 ? 496 ASN A ND2 1 ATOM 3377 N N . LEU A 1 486 ? 62.882 -57.959 46.617 1.00 85.43 ? 497 LEU A N 1 ATOM 3378 C CA . LEU A 1 486 ? 62.998 -57.285 45.330 1.00 77.31 ? 497 LEU A CA 1 ATOM 3379 C C . LEU A 1 486 ? 61.797 -57.571 44.426 1.00 71.88 ? 497 LEU A C 1 ATOM 3380 O O . LEU A 1 486 ? 61.219 -58.657 44.473 1.00 80.00 ? 497 LEU A O 1 ATOM 3381 C CB . LEU A 1 486 ? 64.296 -57.707 44.640 1.00 78.07 ? 497 LEU A CB 1 ATOM 3382 C CG . LEU A 1 486 ? 64.691 -56.961 43.367 1.00 87.30 ? 497 LEU A CG 1 ATOM 3383 C CD1 . LEU A 1 486 ? 64.892 -55.485 43.659 1.00 79.61 ? 497 LEU A CD1 1 ATOM 3384 C CD2 . LEU A 1 486 ? 65.949 -57.571 42.765 1.00 97.95 ? 497 LEU A CD2 1 ATOM 3385 N N . SER A 1 487 ? 61.426 -56.590 43.608 1.00 69.86 ? 498 SER A N 1 ATOM 3386 C CA . SER A 1 487 ? 60.303 -56.736 42.683 1.00 78.10 ? 498 SER A CA 1 ATOM 3387 C C . SER A 1 487 ? 60.541 -55.964 41.391 1.00 89.43 ? 498 SER A C 1 ATOM 3388 O O . SER A 1 487 ? 60.763 -54.752 41.416 1.00 95.44 ? 498 SER A O 1 ATOM 3389 C CB . SER A 1 487 ? 58.999 -56.248 43.323 1.00 65.63 ? 498 SER A CB 1 ATOM 3390 O OG . SER A 1 487 ? 58.570 -57.099 44.371 1.00 73.20 ? 498 SER A OG 1 ATOM 3391 N N . VAL A 1 488 ? 60.490 -56.663 40.261 1.00 85.75 ? 499 VAL A N 1 ATOM 3392 C CA . VAL A 1 488 ? 60.566 -55.997 38.966 1.00 83.79 ? 499 VAL A CA 1 ATOM 3393 C C . VAL A 1 488 ? 59.277 -56.196 38.160 1.00 81.19 ? 499 VAL A C 1 ATOM 3394 O O . VAL A 1 488 ? 58.609 -57.227 38.267 1.00 83.43 ? 499 VAL A O 1 ATOM 3395 C CB . VAL A 1 488 ? 61.803 -56.437 38.142 1.00 90.68 ? 499 VAL A CB 1 ATOM 3396 C CG1 . VAL A 1 488 ? 63.065 -56.369 38.990 1.00 81.72 ? 499 VAL A CG1 1 ATOM 3397 C CG2 . VAL A 1 488 ? 61.615 -57.830 37.591 1.00 95.17 ? 499 VAL A CG2 1 ATOM 3398 N N . ASN A 1 489 ? 58.921 -55.191 37.371 1.00 72.13 ? 500 ASN A N 1 ATOM 3399 C CA . ASN A 1 489 ? 57.716 -55.252 36.558 1.00 69.72 ? 500 ASN A CA 1 ATOM 3400 C C . ASN A 1 489 ? 57.918 -54.618 35.191 1.00 79.17 ? 500 ASN A C 1 ATOM 3401 O O . ASN A 1 489 ? 58.365 -53.478 35.078 1.00 87.02 ? 500 ASN A O 1 ATOM 3402 C CB . ASN A 1 489 ? 56.547 -54.584 37.274 1.00 75.69 ? 500 ASN A CB 1 ATOM 3403 C CG . ASN A 1 489 ? 56.077 -55.373 38.468 1.00 75.93 ? 500 ASN A CG 1 ATOM 3404 O OD1 . ASN A 1 489 ? 56.662 -55.292 39.548 1.00 85.63 ? 500 ASN A OD1 1 ATOM 3405 N ND2 . ASN A 1 489 ? 55.015 -56.146 38.284 1.00 71.04 ? 500 ASN A ND2 1 ATOM 3406 N N . LEU A 1 490 ? 57.588 -55.375 34.154 1.00 75.46 ? 501 LEU A N 1 ATOM 3407 C CA . LEU A 1 490 ? 57.755 -54.920 32.785 1.00 66.29 ? 501 LEU A CA 1 ATOM 3408 C C . LEU A 1 490 ? 56.379 -54.724 32.157 1.00 64.49 ? 501 LEU A C 1 ATOM 3409 O O . LEU A 1 490 ? 55.405 -55.347 32.577 1.00 70.77 ? 501 LEU A O 1 ATOM 3410 C CB . LEU A 1 490 ? 58.572 -55.939 31.989 1.00 57.48 ? 501 LEU A CB 1 ATOM 3411 C CG . LEU A 1 490 ? 60.105 -55.855 32.015 1.00 103.26 ? 501 LEU A CG 1 ATOM 3412 C CD1 . LEU A 1 490 ? 60.647 -55.445 33.373 1.00 60.98 ? 501 LEU A CD1 1 ATOM 3413 C CD2 . LEU A 1 490 ? 60.720 -57.186 31.586 1.00 61.75 ? 501 LEU A CD2 1 ATOM 3414 N N . GLY A 1 491 ? 56.296 -53.854 31.157 1.00 59.01 ? 502 GLY A N 1 ATOM 3415 C CA . GLY A 1 491 ? 55.026 -53.586 30.515 1.00 62.35 ? 502 GLY A CA 1 ATOM 3416 C C . GLY A 1 491 ? 55.121 -53.126 29.077 1.00 65.60 ? 502 GLY A C 1 ATOM 3417 O O . GLY A 1 491 ? 55.977 -52.319 28.717 1.00 65.86 ? 502 GLY A O 1 ATOM 3418 N N . PHE A 1 492 ? 54.225 -53.651 28.250 1.00 63.33 ? 503 PHE A N 1 ATOM 3419 C CA . PHE A 1 492 ? 54.123 -53.240 26.860 1.00 61.59 ? 503 PHE A CA 1 ATOM 3420 C C . PHE A 1 492 ? 52.659 -53.237 26.453 1.00 61.83 ? 503 PHE A C 1 ATOM 3421 O O . PHE A 1 492 ? 51.959 -54.238 26.610 1.00 70.33 ? 503 PHE A O 1 ATOM 3422 C CB . PHE A 1 492 ? 54.931 -54.169 25.957 1.00 60.87 ? 503 PHE A CB 1 ATOM 3423 C CG . PHE A 1 492 ? 54.797 -53.858 24.496 1.00 72.17 ? 503 PHE A CG 1 ATOM 3424 C CD1 . PHE A 1 492 ? 54.911 -52.558 24.040 1.00 74.43 ? 503 PHE A CD1 1 ATOM 3425 C CD2 . PHE A 1 492 ? 54.565 -54.866 23.577 1.00 86.22 ? 503 PHE A CD2 1 ATOM 3426 C CE1 . PHE A 1 492 ? 54.789 -52.269 22.694 1.00 81.02 ? 503 PHE A CE1 1 ATOM 3427 C CE2 . PHE A 1 492 ? 54.444 -54.581 22.230 1.00 91.97 ? 503 PHE A CE2 1 ATOM 3428 C CZ . PHE A 1 492 ? 54.556 -53.281 21.789 1.00 86.65 ? 503 PHE A CZ 1 ATOM 3429 N N . ASP A 1 493 ? 52.198 -52.102 25.938 1.00 54.23 ? 504 ASP A N 1 ATOM 3430 C CA . ASP A 1 493 ? 50.792 -51.951 25.588 1.00 58.67 ? 504 ASP A CA 1 ATOM 3431 C C . ASP A 1 493 ? 50.623 -51.252 24.251 1.00 65.08 ? 504 ASP A C 1 ATOM 3432 O O . ASP A 1 493 ? 51.142 -50.156 24.042 1.00 70.71 ? 504 ASP A O 1 ATOM 3433 C CB . ASP A 1 493 ? 50.049 -51.175 26.682 1.00 63.61 ? 504 ASP A CB 1 ATOM 3434 C CG . ASP A 1 493 ? 48.544 -51.162 26.477 1.00 65.09 ? 504 ASP A CG 1 ATOM 3435 O OD1 . ASP A 1 493 ? 48.022 -52.055 25.775 1.00 73.58 ? 504 ASP A OD1 1 ATOM 3436 O OD2 . ASP A 1 493 ? 47.879 -50.259 27.029 1.00 63.27 ? 504 ASP A OD2 1 ATOM 3437 N N . ARG A 1 494 ? 49.904 -51.905 23.346 1.00 69.40 ? 505 ARG A N 1 ATOM 3438 C CA . ARG A 1 494 ? 49.452 -51.271 22.117 1.00 57.71 ? 505 ARG A CA 1 ATOM 3439 C C . ARG A 1 494 ? 48.001 -50.869 22.352 1.00 54.85 ? 505 ARG A C 1 ATOM 3440 O O . ARG A 1 494 ? 47.146 -51.725 22.585 1.00 50.65 ? 505 ARG A O 1 ATOM 3441 C CB . ARG A 1 494 ? 49.574 -52.237 20.937 1.00 67.62 ? 505 ARG A CB 1 ATOM 3442 C CG . ARG A 1 494 ? 50.987 -52.778 20.725 1.00 78.84 ? 505 ARG A CG 1 ATOM 3443 C CD . ARG A 1 494 ? 51.029 -53.883 19.677 1.00 89.73 ? 505 ARG A CD 1 ATOM 3444 N NE . ARG A 1 494 ? 50.192 -55.024 20.042 1.00 109.21 ? 505 ARG A NE 1 ATOM 3445 C CZ . ARG A 1 494 ? 50.596 -56.044 20.796 1.00 116.90 ? 505 ARG A CZ 1 ATOM 3446 N NH1 . ARG A 1 494 ? 51.833 -56.075 21.277 1.00 107.79 ? 505 ARG A NH1 1 ATOM 3447 N NH2 . ARG A 1 494 ? 49.760 -57.036 21.073 1.00 117.79 ? 505 ARG A NH2 1 ATOM 3448 N N . PHE A 1 495 ? 47.730 -49.567 22.317 1.00 48.53 ? 506 PHE A N 1 ATOM 3449 C CA . PHE A 1 495 ? 46.419 -49.059 22.708 1.00 42.05 ? 506 PHE A CA 1 ATOM 3450 C C . PHE A 1 495 ? 45.768 -48.173 21.648 1.00 51.21 ? 506 PHE A C 1 ATOM 3451 O O . PHE A 1 495 ? 46.422 -47.719 20.710 1.00 56.00 ? 506 PHE A O 1 ATOM 3452 C CB . PHE A 1 495 ? 46.520 -48.285 24.027 1.00 54.05 ? 506 PHE A CB 1 ATOM 3453 C CG . PHE A 1 495 ? 47.426 -47.086 23.959 1.00 54.53 ? 506 PHE A CG 1 ATOM 3454 C CD1 . PHE A 1 495 ? 46.948 -45.861 23.516 1.00 46.77 ? 506 PHE A CD1 1 ATOM 3455 C CD2 . PHE A 1 495 ? 48.757 -47.185 24.340 1.00 57.22 ? 506 PHE A CD2 1 ATOM 3456 C CE1 . PHE A 1 495 ? 47.780 -44.767 23.443 1.00 52.35 ? 506 PHE A CE1 1 ATOM 3457 C CE2 . PHE A 1 495 ? 49.596 -46.091 24.274 1.00 60.02 ? 506 PHE A CE2 1 ATOM 3458 C CZ . PHE A 1 495 ? 49.107 -44.880 23.825 1.00 57.11 ? 506 PHE A CZ 1 ATOM 3459 N N . GLY A 1 496 ? 44.476 -47.913 21.826 1.00 41.92 ? 507 GLY A N 1 ATOM 3460 C CA . GLY A 1 496 ? 43.727 -47.102 20.892 1.00 39.59 ? 507 GLY A CA 1 ATOM 3461 C C . GLY A 1 496 ? 42.486 -46.488 21.505 1.00 52.25 ? 507 GLY A C 1 ATOM 3462 O O . GLY A 1 496 ? 41.818 -47.107 22.337 1.00 53.39 ? 507 GLY A O 1 ATOM 3463 N N . SER A 1 497 ? 42.184 -45.260 21.084 1.00 52.10 ? 508 SER A N 1 ATOM 3464 C CA . SER A 1 497 ? 41.021 -44.522 21.562 1.00 51.56 ? 508 SER A CA 1 ATOM 3465 C C . SER A 1 497 ? 40.189 -44.064 20.378 1.00 45.45 ? 508 SER A C 1 ATOM 3466 O O . SER A 1 497 ? 40.720 -43.474 19.438 1.00 48.56 ? 508 SER A O 1 ATOM 3467 C CB . SER A 1 497 ? 41.462 -43.305 22.375 1.00 49.91 ? 508 SER A CB 1 ATOM 3468 O OG . SER A 1 497 ? 40.344 -42.595 22.876 1.00 51.81 ? 508 SER A OG 1 ATOM 3469 N N . ASN A 1 498 ? 38.884 -44.321 20.424 1.00 45.57 ? 509 ASN A N 1 ATOM 3470 C CA . ASN A 1 498 ? 38.027 -44.024 19.276 1.00 61.95 ? 509 ASN A CA 1 ATOM 3471 C C . ASN A 1 498 ? 36.637 -43.482 19.628 1.00 49.33 ? 509 ASN A C 1 ATOM 3472 O O . ASN A 1 498 ? 35.871 -44.114 20.351 1.00 59.73 ? 509 ASN A O 1 ATOM 3473 C CB . ASN A 1 498 ? 37.905 -45.259 18.374 1.00 68.59 ? 509 ASN A CB 1 ATOM 3474 C CG . ASN A 1 498 ? 37.665 -44.899 16.920 1.00 89.65 ? 509 ASN A CG 1 ATOM 3475 O OD1 . ASN A 1 498 ? 38.143 -43.873 16.433 1.00 106.33 ? 509 ASN A OD1 1 ATOM 3476 N ND2 . ASN A 1 498 ? 36.920 -45.743 16.219 1.00 91.19 ? 509 ASN A ND2 1 ATOM 3477 N N . LEU A 1 499 ? 36.322 -42.301 19.109 1.00 46.47 ? 510 LEU A N 1 ATOM 3478 C CA . LEU A 1 499 ? 34.997 -41.717 19.280 1.00 39.00 ? 510 LEU A CA 1 ATOM 3479 C C . LEU A 1 499 ? 34.285 -41.692 17.941 1.00 47.50 ? 510 LEU A C 1 ATOM 3480 O O . LEU A 1 499 ? 34.807 -41.163 16.959 1.00 55.15 ? 510 LEU A O 1 ATOM 3481 C CB . LEU A 1 499 ? 35.088 -40.297 19.837 1.00 39.36 ? 510 LEU A CB 1 ATOM 3482 C CG . LEU A 1 499 ? 33.758 -39.606 20.153 1.00 53.67 ? 510 LEU A CG 1 ATOM 3483 C CD1 . LEU A 1 499 ? 33.235 -40.072 21.494 1.00 62.25 ? 510 LEU A CD1 1 ATOM 3484 C CD2 . LEU A 1 499 ? 33.905 -38.101 20.142 1.00 53.15 ? 510 LEU A CD2 1 ATOM 3485 N N . ARG A 1 500 ? 33.096 -42.279 17.904 1.00 47.64 ? 511 ARG A N 1 ATOM 3486 C CA . ARG A 1 500 ? 32.285 -42.304 16.695 1.00 36.39 ? 511 ARG A CA 1 ATOM 3487 C C . ARG A 1 500 ? 31.013 -41.477 16.879 1.00 46.39 ? 511 ARG A C 1 ATOM 3488 O O . ARG A 1 500 ? 30.458 -41.403 17.977 1.00 47.50 ? 511 ARG A O 1 ATOM 3489 C CB . ARG A 1 500 ? 31.936 -43.743 16.305 1.00 34.69 ? 511 ARG A CB 1 ATOM 3490 C CG . ARG A 1 500 ? 32.992 -44.438 15.454 1.00 50.10 ? 511 ARG A CG 1 ATOM 3491 C CD . ARG A 1 500 ? 33.586 -45.669 16.134 1.00 67.36 ? 511 ARG A CD 1 ATOM 3492 N NE . ARG A 1 500 ? 32.581 -46.544 16.737 1.00 76.23 ? 511 ARG A NE 1 ATOM 3493 C CZ . ARG A 1 500 ? 31.732 -47.300 16.049 1.00 78.21 ? 511 ARG A CZ 1 ATOM 3494 N NH1 . ARG A 1 500 ? 31.747 -47.281 14.724 1.00 98.71 ? 511 ARG A NH1 1 ATOM 3495 N NH2 . ARG A 1 500 ? 30.859 -48.069 16.681 1.00 55.82 ? 511 ARG A NH2 1 ATOM 3496 N N . HIS A 1 501 ? 30.558 -40.851 15.800 1.00 50.37 ? 512 HIS A N 1 ATOM 3497 C CA . HIS A 1 501 ? 29.368 -40.012 15.853 1.00 42.90 ? 512 HIS A CA 1 ATOM 3498 C C . HIS A 1 501 ? 28.470 -40.359 14.673 1.00 43.39 ? 512 HIS A C 1 ATOM 3499 O O . HIS A 1 501 ? 28.836 -40.140 13.517 1.00 45.94 ? 512 HIS A O 1 ATOM 3500 C CB . HIS A 1 501 ? 29.765 -38.536 15.831 1.00 38.72 ? 512 HIS A CB 1 ATOM 3501 C CG . HIS A 1 501 ? 28.738 -37.622 16.418 1.00 43.95 ? 512 HIS A CG 1 ATOM 3502 N ND1 . HIS A 1 501 ? 29.041 -36.355 16.866 1.00 56.41 ? 512 HIS A ND1 1 ATOM 3503 C CD2 . HIS A 1 501 ? 27.409 -37.784 16.619 1.00 42.76 ? 512 HIS A CD2 1 ATOM 3504 C CE1 . HIS A 1 501 ? 27.944 -35.778 17.323 1.00 56.84 ? 512 HIS A CE1 1 ATOM 3505 N NE2 . HIS A 1 501 ? 26.939 -36.623 17.183 1.00 49.62 ? 512 HIS A NE2 1 ATOM 3506 N N . GLN A 1 502 ? 27.300 -40.915 14.968 1.00 31.75 ? 513 GLN A N 1 ATOM 3507 C CA . GLN A 1 502 ? 26.452 -41.499 13.934 1.00 38.79 ? 513 GLN A CA 1 ATOM 3508 C C . GLN A 1 502 ? 24.998 -41.512 14.354 1.00 32.34 ? 513 GLN A C 1 ATOM 3509 O O . GLN A 1 502 ? 24.673 -41.110 15.464 1.00 36.37 ? 513 GLN A O 1 ATOM 3510 C CB . GLN A 1 502 ? 26.886 -42.932 13.657 1.00 26.78 ? 513 GLN A CB 1 ATOM 3511 C CG . GLN A 1 502 ? 26.750 -43.843 14.867 1.00 43.63 ? 513 GLN A CG 1 ATOM 3512 C CD . GLN A 1 502 ? 27.213 -45.256 14.578 1.00 56.79 ? 513 GLN A CD 1 ATOM 3513 O OE1 . GLN A 1 502 ? 28.399 -45.499 14.340 1.00 55.34 ? 513 GLN A OE1 1 ATOM 3514 N NE2 . GLN A 1 502 ? 26.274 -46.198 14.584 1.00 43.49 ? 513 GLN A NE2 1 ATOM 3515 N N . ASP A 1 503 ? 24.136 -41.999 13.462 1.00 33.46 ? 514 ASP A N 1 ATOM 3516 C CA . ASP A 1 503 ? 22.694 -42.038 13.691 1.00 35.20 ? 514 ASP A CA 1 ATOM 3517 C C . ASP A 1 503 ? 22.189 -40.672 14.144 1.00 41.87 ? 514 ASP A C 1 ATOM 3518 O O . ASP A 1 503 ? 21.354 -40.564 15.043 1.00 41.18 ? 514 ASP A O 1 ATOM 3519 C CB . ASP A 1 503 ? 22.345 -43.122 14.708 1.00 40.46 ? 514 ASP A CB 1 ATOM 3520 C CG . ASP A 1 503 ? 22.845 -44.486 14.289 1.00 55.60 ? 514 ASP A CG 1 ATOM 3521 O OD1 . ASP A 1 503 ? 23.609 -45.117 15.056 1.00 47.31 ? 514 ASP A OD1 1 ATOM 3522 O OD2 . ASP A 1 503 ? 22.472 -44.924 13.182 1.00 61.87 ? 514 ASP A OD2 1 ATOM 3523 N N . TYR A 1 504 ? 22.716 -39.633 13.505 1.00 41.89 ? 515 TYR A N 1 ATOM 3524 C CA . TYR A 1 504 ? 22.467 -38.250 13.892 1.00 56.20 ? 515 TYR A CA 1 ATOM 3525 C C . TYR A 1 504 ? 21.602 -37.570 12.832 1.00 55.75 ? 515 TYR A C 1 ATOM 3526 O O . TYR A 1 504 ? 22.116 -36.997 11.872 1.00 56.54 ? 515 TYR A O 1 ATOM 3527 C CB . TYR A 1 504 ? 23.806 -37.514 14.043 1.00 42.04 ? 515 TYR A CB 1 ATOM 3528 C CG . TYR A 1 504 ? 23.753 -36.195 14.791 1.00 40.84 ? 515 TYR A CG 1 ATOM 3529 C CD1 . TYR A 1 504 ? 22.584 -35.751 15.388 1.00 41.30 ? 515 TYR A CD1 1 ATOM 3530 C CD2 . TYR A 1 504 ? 24.882 -35.395 14.895 1.00 44.52 ? 515 TYR A CD2 1 ATOM 3531 C CE1 . TYR A 1 504 ? 22.543 -34.548 16.067 1.00 44.40 ? 515 TYR A CE1 1 ATOM 3532 C CE2 . TYR A 1 504 ? 24.849 -34.195 15.573 1.00 40.03 ? 515 TYR A CE2 1 ATOM 3533 C CZ . TYR A 1 504 ? 23.679 -33.776 16.155 1.00 40.49 ? 515 TYR A CZ 1 ATOM 3534 O OH . TYR A 1 504 ? 23.647 -32.578 16.828 1.00 42.73 ? 515 TYR A OH 1 ATOM 3535 N N . TYR A 1 505 ? 20.288 -37.634 13.004 1.00 44.59 ? 516 TYR A N 1 ATOM 3536 C CA . TYR A 1 505 ? 19.382 -37.087 12.003 1.00 39.88 ? 516 TYR A CA 1 ATOM 3537 C C . TYR A 1 505 ? 18.053 -36.660 12.604 1.00 40.85 ? 516 TYR A C 1 ATOM 3538 O O . TYR A 1 505 ? 17.686 -37.093 13.694 1.00 47.35 ? 516 TYR A O 1 ATOM 3539 C CB . TYR A 1 505 ? 19.126 -38.123 10.909 1.00 43.19 ? 516 TYR A CB 1 ATOM 3540 C CG . TYR A 1 505 ? 18.386 -39.349 11.396 1.00 42.35 ? 516 TYR A CG 1 ATOM 3541 C CD1 . TYR A 1 505 ? 17.002 -39.441 11.284 1.00 37.57 ? 516 TYR A CD1 1 ATOM 3542 C CD2 . TYR A 1 505 ? 19.070 -40.414 11.969 1.00 38.71 ? 516 TYR A CD2 1 ATOM 3543 C CE1 . TYR A 1 505 ? 16.323 -40.557 11.726 1.00 38.83 ? 516 TYR A CE1 1 ATOM 3544 C CE2 . TYR A 1 505 ? 18.397 -41.538 12.411 1.00 36.22 ? 516 TYR A CE2 1 ATOM 3545 C CZ . TYR A 1 505 ? 17.026 -41.601 12.288 1.00 42.37 ? 516 TYR A CZ 1 ATOM 3546 O OH . TYR A 1 505 ? 16.354 -42.711 12.726 1.00 46.21 ? 516 TYR A OH 1 ATOM 3547 N N . TYR A 1 506 ? 17.330 -35.813 11.882 1.00 35.84 ? 517 TYR A N 1 ATOM 3548 C CA . TYR A 1 506 ? 15.991 -35.423 12.295 1.00 46.93 ? 517 TYR A CA 1 ATOM 3549 C C . TYR A 1 506 ? 14.977 -35.862 11.245 1.00 45.74 ? 517 TYR A C 1 ATOM 3550 O O . TYR A 1 506 ? 15.342 -36.191 10.116 1.00 50.33 ? 517 TYR A O 1 ATOM 3551 C CB . TYR A 1 506 ? 15.901 -33.910 12.547 1.00 24.99 ? 517 TYR A CB 1 ATOM 3552 C CG . TYR A 1 506 ? 16.153 -33.056 11.328 1.00 38.15 ? 517 TYR A CG 1 ATOM 3553 C CD1 . TYR A 1 506 ? 15.142 -32.807 10.409 1.00 41.09 ? 517 TYR A CD1 1 ATOM 3554 C CD2 . TYR A 1 506 ? 17.399 -32.486 11.097 1.00 43.22 ? 517 TYR A CD2 1 ATOM 3555 C CE1 . TYR A 1 506 ? 15.363 -32.032 9.285 1.00 43.49 ? 517 TYR A CE1 1 ATOM 3556 C CE2 . TYR A 1 506 ? 17.629 -31.704 9.974 1.00 52.97 ? 517 TYR A CE2 1 ATOM 3557 C CZ . TYR A 1 506 ? 16.603 -31.482 9.071 1.00 50.91 ? 517 TYR A CZ 1 ATOM 3558 O OH . TYR A 1 506 ? 16.808 -30.711 7.948 1.00 45.09 ? 517 TYR A OH 1 ATOM 3559 N N . GLN A 1 507 ? 13.707 -35.880 11.634 1.00 43.53 ? 518 GLN A N 1 ATOM 3560 C CA . GLN A 1 507 ? 12.606 -36.139 10.714 1.00 38.70 ? 518 GLN A CA 1 ATOM 3561 C C . GLN A 1 507 ? 11.397 -35.335 11.159 1.00 40.32 ? 518 GLN A C 1 ATOM 3562 O O . GLN A 1 507 ? 11.093 -35.264 12.348 1.00 42.36 ? 518 GLN A O 1 ATOM 3563 C CB . GLN A 1 507 ? 12.228 -37.625 10.678 1.00 32.32 ? 518 GLN A CB 1 ATOM 3564 C CG . GLN A 1 507 ? 13.243 -38.537 10.014 1.00 47.67 ? 518 GLN A CG 1 ATOM 3565 C CD . GLN A 1 507 ? 12.745 -39.971 9.885 1.00 59.06 ? 518 GLN A CD 1 ATOM 3566 O OE1 . GLN A 1 507 ? 12.033 -40.480 10.752 1.00 50.64 ? 518 GLN A OE1 1 ATOM 3567 N NE2 . GLN A 1 507 ? 13.115 -40.626 8.790 1.00 61.71 ? 518 GLN A NE2 1 ATOM 3568 N N . HIS A 1 508 ? 10.707 -34.720 10.208 1.00 38.00 ? 519 HIS A N 1 ATOM 3569 C CA . HIS A 1 508 ? 9.434 -34.094 10.519 1.00 31.45 ? 519 HIS A CA 1 ATOM 3570 C C . HIS A 1 508 ? 8.392 -34.414 9.467 1.00 38.77 ? 519 HIS A C 1 ATOM 3571 O O . HIS A 1 508 ? 8.698 -34.974 8.422 1.00 53.80 ? 519 HIS A O 1 ATOM 3572 C CB . HIS A 1 508 ? 9.573 -32.582 10.726 1.00 29.12 ? 519 HIS A CB 1 ATOM 3573 C CG . HIS A 1 508 ? 10.289 -31.870 9.623 1.00 34.48 ? 519 HIS A CG 1 ATOM 3574 N ND1 . HIS A 1 508 ? 11.595 -31.446 9.738 1.00 41.18 ? 519 HIS A ND1 1 ATOM 3575 C CD2 . HIS A 1 508 ? 9.877 -31.486 8.393 1.00 51.80 ? 519 HIS A CD2 1 ATOM 3576 C CE1 . HIS A 1 508 ? 11.962 -30.843 8.621 1.00 37.78 ? 519 HIS A CE1 1 ATOM 3577 N NE2 . HIS A 1 508 ? 10.937 -30.854 7.789 1.00 47.00 ? 519 HIS A NE2 1 ATOM 3578 N N . ALA A 1 509 ? 7.150 -34.074 9.765 1.00 48.52 ? 520 ALA A N 1 ATOM 3579 C CA . ALA A 1 509 ? 6.060 -34.319 8.846 1.00 46.17 ? 520 ALA A CA 1 ATOM 3580 C C . ALA A 1 509 ? 5.196 -33.077 8.811 1.00 47.75 ? 520 ALA A C 1 ATOM 3581 O O . ALA A 1 509 ? 4.206 -32.975 9.534 1.00 53.87 ? 520 ALA A O 1 ATOM 3582 C CB . ALA A 1 509 ? 5.249 -35.533 9.287 1.00 33.43 ? 520 ALA A CB 1 ATOM 3583 N N . ASN A 1 510 ? 5.589 -32.118 7.982 1.00 64.34 ? 521 ASN A N 1 ATOM 3584 C CA . ASN A 1 510 ? 4.818 -30.894 7.842 1.00 61.71 ? 521 ASN A CA 1 ATOM 3585 C C . ASN A 1 510 ? 3.654 -31.102 6.886 1.00 60.31 ? 521 ASN A C 1 ATOM 3586 O O . ASN A 1 510 ? 3.789 -31.769 5.862 1.00 67.53 ? 521 ASN A O 1 ATOM 3587 C CB . ASN A 1 510 ? 5.708 -29.724 7.409 1.00 62.25 ? 521 ASN A CB 1 ATOM 3588 C CG . ASN A 1 510 ? 6.681 -29.285 8.508 1.00 67.39 ? 521 ASN A CG 1 ATOM 3589 O OD1 . ASN A 1 510 ? 6.719 -29.865 9.598 1.00 66.04 ? 521 ASN A OD1 1 ATOM 3590 N ND2 . ASN A 1 510 ? 7.475 -28.262 8.216 1.00 49.94 ? 521 ASN A ND2 1 ATOM 3591 N N . ARG A 1 511 ? 2.511 -30.535 7.250 1.00 61.67 ? 522 ARG A N 1 ATOM 3592 C CA . ARG A 1 511 ? 1.250 -30.714 6.537 1.00 63.50 ? 522 ARG A CA 1 ATOM 3593 C C . ARG A 1 511 ? 1.262 -30.110 5.129 1.00 58.96 ? 522 ARG A C 1 ATOM 3594 O O . ARG A 1 511 ? 1.884 -29.075 4.899 1.00 61.78 ? 522 ARG A O 1 ATOM 3595 C CB . ARG A 1 511 ? 0.134 -30.075 7.370 1.00 56.01 ? 522 ARG A CB 1 ATOM 3596 C CG . ARG A 1 511 ? -1.276 -30.370 6.917 1.00 48.72 ? 522 ARG A CG 1 ATOM 3597 C CD . ARG A 1 511 ? -2.277 -29.874 7.949 1.00 51.58 ? 522 ARG A CD 1 ATOM 3598 N NE . ARG A 1 511 ? -2.262 -28.422 8.067 1.00 48.57 ? 522 ARG A NE 1 ATOM 3599 C CZ . ARG A 1 511 ? -3.148 -27.719 8.764 1.00 47.20 ? 522 ARG A CZ 1 ATOM 3600 N NH1 . ARG A 1 511 ? -3.058 -26.402 8.803 1.00 45.15 ? 522 ARG A NH1 1 ATOM 3601 N NH2 . ARG A 1 511 ? -4.125 -28.331 9.416 1.00 46.58 ? 522 ARG A NH2 1 ATOM 3602 N N . ALA A 1 512 ? 0.573 -30.762 4.193 1.00 49.48 ? 523 ALA A N 1 ATOM 3603 C CA . ALA A 1 512 ? 0.385 -30.217 2.847 1.00 47.41 ? 523 ALA A CA 1 ATOM 3604 C C . ALA A 1 512 ? -0.719 -29.180 2.862 1.00 60.46 ? 523 ALA A C 1 ATOM 3605 O O . ALA A 1 512 ? -1.875 -29.503 3.130 1.00 80.66 ? 523 ALA A O 1 ATOM 3606 C CB . ALA A 1 512 ? 0.038 -31.315 1.862 1.00 44.51 ? 523 ALA A CB 1 ATOM 3607 N N . TYR A 1 513 ? -0.366 -27.937 2.555 1.00 51.56 ? 524 TYR A N 1 ATOM 3608 C CA . TYR A 1 513 ? -1.295 -26.825 2.691 1.00 44.26 ? 524 TYR A CA 1 ATOM 3609 C C . TYR A 1 513 ? -1.041 -25.712 1.687 1.00 48.93 ? 524 TYR A C 1 ATOM 3610 O O . TYR A 1 513 ? 0.096 -25.377 1.379 1.00 52.15 ? 524 TYR A O 1 ATOM 3611 C CB . TYR A 1 513 ? -1.210 -26.250 4.106 1.00 47.03 ? 524 TYR A CB 1 ATOM 3612 C CG . TYR A 1 513 ? -2.038 -25.000 4.332 1.00 55.73 ? 524 TYR A CG 1 ATOM 3613 C CD1 . TYR A 1 513 ? -3.342 -25.085 4.793 1.00 58.31 ? 524 TYR A CD1 1 ATOM 3614 C CD2 . TYR A 1 513 ? -1.509 -23.734 4.101 1.00 42.34 ? 524 TYR A CD2 1 ATOM 3615 C CE1 . TYR A 1 513 ? -4.096 -23.952 5.011 1.00 52.08 ? 524 TYR A CE1 1 ATOM 3616 C CE2 . TYR A 1 513 ? -2.258 -22.597 4.309 1.00 46.85 ? 524 TYR A CE2 1 ATOM 3617 C CZ . TYR A 1 513 ? -3.552 -22.713 4.765 1.00 48.06 ? 524 TYR A CZ 1 ATOM 3618 O OH . TYR A 1 513 ? -4.305 -21.588 4.990 1.00 41.33 ? 524 TYR A OH 1 ATOM 3619 N N . SER A 1 514 ? -2.118 -25.127 1.187 1.00 37.32 ? 525 SER A N 1 ATOM 3620 C CA . SER A 1 514 ? -2.006 -23.870 0.475 1.00 41.67 ? 525 SER A CA 1 ATOM 3621 C C . SER A 1 514 ? -3.314 -23.108 0.572 1.00 44.11 ? 525 SER A C 1 ATOM 3622 O O . SER A 1 514 ? -4.387 -23.701 0.698 1.00 40.41 ? 525 SER A O 1 ATOM 3623 C CB . SER A 1 514 ? -1.560 -24.066 -0.981 1.00 47.12 ? 525 SER A CB 1 ATOM 3624 O OG . SER A 1 514 ? -2.458 -24.879 -1.711 1.00 63.46 ? 525 SER A OG 1 ATOM 3625 N N . SER A 1 515 ? -3.196 -21.785 0.559 1.00 51.00 ? 526 SER A N 1 ATOM 3626 C CA . SER A 1 515 ? -4.336 -20.887 0.560 1.00 42.05 ? 526 SER A CA 1 ATOM 3627 C C . SER A 1 515 ? -4.365 -20.256 -0.821 1.00 47.78 ? 526 SER A C 1 ATOM 3628 O O . SER A 1 515 ? -3.383 -19.651 -1.251 1.00 54.60 ? 526 SER A O 1 ATOM 3629 C CB . SER A 1 515 ? -4.155 -19.821 1.638 1.00 42.23 ? 526 SER A CB 1 ATOM 3630 O OG . SER A 1 515 ? -5.282 -18.973 1.722 1.00 48.53 ? 526 SER A OG 1 ATOM 3631 N N . ASN A 1 516 ? -5.478 -20.410 -1.528 1.00 45.91 ? 527 ASN A N 1 ATOM 3632 C CA . ASN A 1 516 ? -5.502 -20.075 -2.949 1.00 47.70 ? 527 ASN A CA 1 ATOM 3633 C C . ASN A 1 516 ? -6.571 -19.073 -3.326 1.00 53.70 ? 527 ASN A C 1 ATOM 3634 O O . ASN A 1 516 ? -7.591 -18.957 -2.657 1.00 50.26 ? 527 ASN A O 1 ATOM 3635 C CB . ASN A 1 516 ? -5.678 -21.342 -3.791 1.00 52.26 ? 527 ASN A CB 1 ATOM 3636 C CG . ASN A 1 516 ? -4.652 -22.403 -3.462 1.00 66.22 ? 527 ASN A CG 1 ATOM 3637 O OD1 . ASN A 1 516 ? -3.480 -22.102 -3.242 1.00 65.42 ? 527 ASN A OD1 1 ATOM 3638 N ND2 . ASN A 1 516 ? -5.090 -23.653 -3.415 1.00 80.77 ? 527 ASN A ND2 1 ATOM 3639 N N . THR A 1 517 ? -6.326 -18.349 -4.408 1.00 56.72 ? 528 THR A N 1 ATOM 3640 C CA . THR A 1 517 ? -7.334 -17.472 -4.968 1.00 58.01 ? 528 THR A CA 1 ATOM 3641 C C . THR A 1 517 ? -8.371 -18.336 -5.671 1.00 57.03 ? 528 THR A C 1 ATOM 3642 O O . THR A 1 517 ? -8.034 -19.100 -6.574 1.00 52.93 ? 528 THR A O 1 ATOM 3643 C CB . THR A 1 517 ? -6.712 -16.486 -5.967 1.00 80.09 ? 528 THR A CB 1 ATOM 3644 O OG1 . THR A 1 517 ? -5.708 -15.711 -5.302 1.00 93.84 ? 528 THR A OG1 1 ATOM 3645 C CG2 . THR A 1 517 ? -7.773 -15.558 -6.539 1.00 77.24 ? 528 THR A CG2 1 ATOM 3646 N N . PRO A 1 518 ? -9.637 -18.233 -5.243 1.00 58.64 ? 529 PRO A N 1 ATOM 3647 C CA . PRO A 1 518 ? -10.720 -19.021 -5.835 1.00 54.90 ? 529 PRO A CA 1 ATOM 3648 C C . PRO A 1 518 ? -10.905 -18.667 -7.307 1.00 75.14 ? 529 PRO A C 1 ATOM 3649 O O . PRO A 1 518 ? -10.494 -17.584 -7.725 1.00 69.31 ? 529 PRO A O 1 ATOM 3650 C CB . PRO A 1 518 ? -11.946 -18.593 -5.018 1.00 56.75 ? 529 PRO A CB 1 ATOM 3651 C CG . PRO A 1 518 ? -11.604 -17.252 -4.495 1.00 62.72 ? 529 PRO A CG 1 ATOM 3652 C CD . PRO A 1 518 ? -10.133 -17.314 -4.207 1.00 64.94 ? 529 PRO A CD 1 ATOM 3653 N N . PRO A 1 519 ? -11.503 -19.578 -8.092 1.00 82.77 ? 530 PRO A N 1 ATOM 3654 C CA . PRO A 1 519 ? -11.722 -19.326 -9.519 1.00 66.19 ? 530 PRO A CA 1 ATOM 3655 C C . PRO A 1 519 ? -12.592 -18.102 -9.756 1.00 70.52 ? 530 PRO A C 1 ATOM 3656 O O . PRO A 1 519 ? -13.429 -17.754 -8.919 1.00 71.86 ? 530 PRO A O 1 ATOM 3657 C CB . PRO A 1 519 ? -12.446 -20.590 -9.994 1.00 74.75 ? 530 PRO A CB 1 ATOM 3658 C CG . PRO A 1 519 ? -12.986 -21.225 -8.751 1.00 84.03 ? 530 PRO A CG 1 ATOM 3659 C CD . PRO A 1 519 ? -11.993 -20.906 -7.688 1.00 87.82 ? 530 PRO A CD 1 ATOM 3660 N N . GLN A 1 520 ? -12.377 -17.456 -10.896 1.00 63.14 ? 531 GLN A N 1 ATOM 3661 C CA . GLN A 1 520 ? -13.131 -16.270 -11.278 1.00 70.01 ? 531 GLN A CA 1 ATOM 3662 C C . GLN A 1 520 ? -14.564 -16.627 -11.677 1.00 78.64 ? 531 GLN A C 1 ATOM 3663 O O . GLN A 1 520 ? -14.780 -17.468 -12.549 1.00 91.12 ? 531 GLN A O 1 ATOM 3664 C CB . GLN A 1 520 ? -12.408 -15.565 -12.424 1.00 66.32 ? 531 GLN A CB 1 ATOM 3665 C CG . GLN A 1 520 ? -13.190 -14.461 -13.089 1.00 80.95 ? 531 GLN A CG 1 ATOM 3666 C CD . GLN A 1 520 ? -12.528 -13.996 -14.368 1.00 83.92 ? 531 GLN A CD 1 ATOM 3667 O OE1 . GLN A 1 520 ? -13.200 -13.580 -15.312 1.00 77.01 ? 531 GLN A OE1 1 ATOM 3668 N NE2 . GLN A 1 520 ? -11.201 -14.073 -14.410 1.00 85.82 ? 531 GLN A NE2 1 ATOM 3669 N N . ASN A 1 521 ? -15.537 -15.984 -11.037 1.00 77.55 ? 532 ASN A N 1 ATOM 3670 C CA . ASN A 1 521 ? -16.945 -16.317 -11.231 1.00 85.83 ? 532 ASN A CA 1 ATOM 3671 C C . ASN A 1 521 ? -17.873 -15.223 -10.705 1.00 111.18 ? 532 ASN A C 1 ATOM 3672 O O . ASN A 1 521 ? -18.331 -15.297 -9.564 1.00 123.49 ? 532 ASN A O 1 ATOM 3673 C CB . ASN A 1 521 ? -17.264 -17.637 -10.516 1.00 85.66 ? 532 ASN A CB 1 ATOM 3674 C CG . ASN A 1 521 ? -18.671 -18.152 -10.806 1.00 98.84 ? 532 ASN A CG 1 ATOM 3675 O OD1 . ASN A 1 521 ? -19.554 -17.410 -11.241 1.00 106.71 ? 532 ASN A OD1 1 ATOM 3676 N ND2 . ASN A 1 521 ? -18.882 -19.440 -10.555 1.00 97.37 ? 532 ASN A ND2 1 ATOM 3677 N N . ASN A 1 522 ? -18.158 -14.212 -11.521 1.00 122.13 ? 533 ASN A N 1 ATOM 3678 C CA . ASN A 1 522 ? -17.561 -14.043 -12.839 1.00 125.48 ? 533 ASN A CA 1 ATOM 3679 C C . ASN A 1 522 ? -17.234 -12.572 -13.069 1.00 120.39 ? 533 ASN A C 1 ATOM 3680 O O . ASN A 1 522 ? -17.854 -11.692 -12.473 1.00 107.91 ? 533 ASN A O 1 ATOM 3681 C CB . ASN A 1 522 ? -18.494 -14.562 -13.938 1.00 127.87 ? 533 ASN A CB 1 ATOM 3682 C CG . ASN A 1 522 ? -19.962 -14.404 -13.582 1.00 125.29 ? 533 ASN A CG 1 ATOM 3683 O OD1 . ASN A 1 522 ? -20.410 -14.860 -12.531 1.00 117.47 ? 533 ASN A OD1 1 ATOM 3684 N ND2 . ASN A 1 522 ? -20.719 -13.755 -14.460 1.00 127.67 ? 533 ASN A ND2 1 ATOM 3685 N N . GLY A 1 523 ? -16.259 -12.306 -13.928 1.00 127.03 ? 534 GLY A N 1 ATOM 3686 C CA . GLY A 1 523 ? -15.822 -10.945 -14.177 1.00 132.87 ? 534 GLY A CA 1 ATOM 3687 C C . GLY A 1 523 ? -14.325 -10.803 -13.993 1.00 130.42 ? 534 GLY A C 1 ATOM 3688 O O . GLY A 1 523 ? -13.567 -10.886 -14.957 1.00 133.91 ? 534 GLY A O 1 ATOM 3689 N N . LYS A 1 524 ? -13.898 -10.580 -12.752 1.00 118.66 ? 535 LYS A N 1 ATOM 3690 C CA . LYS A 1 524 ? -12.476 -10.511 -12.426 1.00 114.74 ? 535 LYS A CA 1 ATOM 3691 C C . LYS A 1 524 ? -12.190 -11.274 -11.137 1.00 98.58 ? 535 LYS A C 1 ATOM 3692 O O . LYS A 1 524 ? -13.109 -11.595 -10.385 1.00 94.38 ? 535 LYS A O 1 ATOM 3693 C CB . LYS A 1 524 ? -12.014 -9.058 -12.302 1.00 127.25 ? 535 LYS A CB 1 ATOM 3694 C CG . LYS A 1 524 ? -12.133 -8.251 -13.592 1.00 141.99 ? 535 LYS A CG 1 ATOM 3695 C CD . LYS A 1 524 ? -11.248 -8.818 -14.695 1.00 142.09 ? 535 LYS A CD 1 ATOM 3696 C CE . LYS A 1 524 ? -11.538 -8.159 -16.038 1.00 144.81 ? 535 LYS A CE 1 ATOM 3697 N NZ . LYS A 1 524 ? -12.927 -8.423 -16.514 1.00 142.61 ? 535 LYS A NZ 1 ATOM 3698 N N . LYS A 1 525 ? -10.916 -11.564 -10.886 1.00 84.76 ? 536 LYS A N 1 ATOM 3699 C CA . LYS A 1 525 ? -10.525 -12.344 -9.712 1.00 91.55 ? 536 LYS A CA 1 ATOM 3700 C C . LYS A 1 525 ? -10.574 -11.547 -8.409 1.00 91.84 ? 536 LYS A C 1 ATOM 3701 O O . LYS A 1 525 ? -10.015 -10.457 -8.317 1.00 92.02 ? 536 LYS A O 1 ATOM 3702 C CB . LYS A 1 525 ? -9.126 -12.939 -9.896 1.00 91.25 ? 536 LYS A CB 1 ATOM 3703 C CG . LYS A 1 525 ? -9.086 -14.217 -10.716 1.00 88.48 ? 536 LYS A CG 1 ATOM 3704 C CD . LYS A 1 525 ? -7.742 -14.909 -10.560 1.00 88.02 ? 536 LYS A CD 1 ATOM 3705 C CE . LYS A 1 525 ? -7.793 -16.349 -11.041 1.00 89.90 ? 536 LYS A CE 1 ATOM 3706 N NZ . LYS A 1 525 ? -6.629 -17.134 -10.537 1.00 89.04 ? 536 LYS A NZ 1 ATOM 3707 N N . ILE A 1 526 ? -11.234 -12.106 -7.399 1.00 86.83 ? 537 ILE A N 1 ATOM 3708 C CA . ILE A 1 526 ? -11.305 -11.471 -6.088 1.00 85.51 ? 537 ILE A CA 1 ATOM 3709 C C . ILE A 1 526 ? -10.567 -12.290 -5.032 1.00 78.79 ? 537 ILE A C 1 ATOM 3710 O O . ILE A 1 526 ? -10.947 -13.423 -4.731 1.00 76.43 ? 537 ILE A O 1 ATOM 3711 C CB . ILE A 1 526 ? -12.766 -11.244 -5.635 1.00 85.75 ? 537 ILE A CB 1 ATOM 3712 C CG1 . ILE A 1 526 ? -13.511 -10.371 -6.648 1.00 79.15 ? 537 ILE A CG1 1 ATOM 3713 C CG2 . ILE A 1 526 ? -12.810 -10.600 -4.255 1.00 75.01 ? 537 ILE A CG2 1 ATOM 3714 C CD1 . ILE A 1 526 ? -14.934 -10.053 -6.246 1.00 78.73 ? 537 ILE A CD1 1 ATOM 3715 N N . SER A 1 527 ? -9.509 -11.706 -4.477 1.00 80.17 ? 538 SER A N 1 ATOM 3716 C CA . SER A 1 527 ? -8.745 -12.342 -3.409 1.00 79.51 ? 538 SER A CA 1 ATOM 3717 C C . SER A 1 527 ? -9.437 -12.142 -2.062 1.00 68.27 ? 538 SER A C 1 ATOM 3718 O O . SER A 1 527 ? -9.483 -11.029 -1.546 1.00 67.17 ? 538 SER A O 1 ATOM 3719 C CB . SER A 1 527 ? -7.317 -11.787 -3.366 1.00 77.93 ? 538 SER A CB 1 ATOM 3720 O OG . SER A 1 527 ? -7.310 -10.403 -3.064 1.00 59.31 ? 538 SER A OG 1 ATOM 3721 N N . PRO A 1 528 ? -9.960 -13.233 -1.482 1.00 68.86 ? 539 PRO A N 1 ATOM 3722 C CA . PRO A 1 528 ? -10.814 -13.208 -0.288 1.00 71.43 ? 539 PRO A CA 1 ATOM 3723 C C . PRO A 1 528 ? -10.094 -12.692 0.959 1.00 70.13 ? 539 PRO A C 1 ATOM 3724 O O . PRO A 1 528 ? -8.867 -12.741 1.032 1.00 66.99 ? 539 PRO A O 1 ATOM 3725 C CB . PRO A 1 528 ? -11.189 -14.678 -0.106 1.00 66.87 ? 539 PRO A CB 1 ATOM 3726 C CG . PRO A 1 528 ? -10.039 -15.419 -0.684 1.00 52.89 ? 539 PRO A CG 1 ATOM 3727 C CD . PRO A 1 528 ? -9.615 -14.610 -1.876 1.00 47.20 ? 539 PRO A CD 1 ATOM 3728 N N . ASN A 1 529 ? -10.865 -12.214 1.933 1.00 65.57 ? 540 ASN A N 1 ATOM 3729 C CA . ASN A 1 529 ? -10.302 -11.605 3.133 1.00 67.20 ? 540 ASN A CA 1 ATOM 3730 C C . ASN A 1 529 ? -10.605 -12.360 4.429 1.00 69.00 ? 540 ASN A C 1 ATOM 3731 O O . ASN A 1 529 ? -10.197 -11.939 5.509 1.00 73.32 ? 540 ASN A O 1 ATOM 3732 C CB . ASN A 1 529 ? -10.777 -10.156 3.258 1.00 67.42 ? 540 ASN A CB 1 ATOM 3733 C CG . ASN A 1 529 ? -12.286 -10.042 3.334 1.00 62.08 ? 540 ASN A CG 1 ATOM 3734 O OD1 . ASN A 1 529 ? -13.001 -11.046 3.347 1.00 56.59 ? 540 ASN A OD1 1 ATOM 3735 N ND2 . ASN A 1 529 ? -12.780 -8.813 3.392 1.00 53.27 ? 540 ASN A ND2 1 ATOM 3736 N N . GLY A 1 530 ? -11.331 -13.466 4.324 1.00 66.56 ? 541 GLY A N 1 ATOM 3737 C CA . GLY A 1 530 ? -11.647 -14.264 5.492 1.00 60.77 ? 541 GLY A CA 1 ATOM 3738 C C . GLY A 1 530 ? -12.970 -13.908 6.144 1.00 56.29 ? 541 GLY A C 1 ATOM 3739 O O . GLY A 1 530 ? -13.322 -14.458 7.184 1.00 57.73 ? 541 GLY A O 1 ATOM 3740 N N . SER A 1 531 ? -13.709 -12.987 5.539 1.00 58.01 ? 542 SER A N 1 ATOM 3741 C CA . SER A 1 531 ? -15.031 -12.643 6.046 1.00 58.83 ? 542 SER A CA 1 ATOM 3742 C C . SER A 1 531 ? -15.985 -13.812 5.821 1.00 63.04 ? 542 SER A C 1 ATOM 3743 O O . SER A 1 531 ? -15.729 -14.674 4.979 1.00 58.59 ? 542 SER A O 1 ATOM 3744 C CB . SER A 1 531 ? -15.566 -11.388 5.358 1.00 54.72 ? 542 SER A CB 1 ATOM 3745 O OG . SER A 1 531 ? -15.938 -11.659 4.019 1.00 61.14 ? 542 SER A OG 1 ATOM 3746 N N . GLU A 1 532 ? -17.079 -13.837 6.577 1.00 55.55 ? 543 GLU A N 1 ATOM 3747 C CA . GLU A 1 532 ? -18.057 -14.915 6.490 1.00 59.56 ? 543 GLU A CA 1 ATOM 3748 C C . GLU A 1 532 ? -18.602 -15.065 5.067 1.00 66.31 ? 543 GLU A C 1 ATOM 3749 O O . GLU A 1 532 ? -18.853 -16.177 4.599 1.00 70.38 ? 543 GLU A O 1 ATOM 3750 C CB . GLU A 1 532 ? -19.199 -14.670 7.478 1.00 63.94 ? 543 GLU A CB 1 ATOM 3751 C CG . GLU A 1 532 ? -20.072 -15.885 7.744 1.00 78.66 ? 543 GLU A CG 1 ATOM 3752 C CD . GLU A 1 532 ? -21.151 -15.613 8.777 1.00 92.42 ? 543 GLU A CD 1 ATOM 3753 O OE1 . GLU A 1 532 ? -21.312 -14.438 9.176 1.00 91.39 ? 543 GLU A OE1 1 ATOM 3754 O OE2 . GLU A 1 532 ? -21.836 -16.573 9.191 1.00 92.79 ? 543 GLU A OE2 1 ATOM 3755 N N . THR A 1 533 ? -18.764 -13.942 4.378 1.00 54.94 ? 544 THR A N 1 ATOM 3756 C CA . THR A 1 533 ? -19.266 -13.953 3.009 1.00 57.99 ? 544 THR A CA 1 ATOM 3757 C C . THR A 1 533 ? -18.148 -14.142 1.983 1.00 65.50 ? 544 THR A C 1 ATOM 3758 O O . THR A 1 533 ? -18.414 -14.369 0.800 1.00 70.91 ? 544 THR A O 1 ATOM 3759 C CB . THR A 1 533 ? -20.003 -12.653 2.678 1.00 56.92 ? 544 THR A CB 1 ATOM 3760 O OG1 . THR A 1 533 ? -19.075 -11.561 2.721 1.00 61.86 ? 544 THR A OG1 1 ATOM 3761 C CG2 . THR A 1 533 ? -21.130 -12.409 3.670 1.00 63.45 ? 544 THR A CG2 1 ATOM 3762 N N . SER A 1 534 ? -16.900 -14.045 2.432 1.00 55.03 ? 545 SER A N 1 ATOM 3763 C CA . SER A 1 534 ? -15.758 -14.194 1.534 1.00 58.79 ? 545 SER A CA 1 ATOM 3764 C C . SER A 1 534 ? -14.626 -15.022 2.169 1.00 47.24 ? 545 SER A C 1 ATOM 3765 O O . SER A 1 534 ? -13.501 -14.548 2.299 1.00 46.57 ? 545 SER A O 1 ATOM 3766 C CB . SER A 1 534 ? -15.260 -12.809 1.098 1.00 53.46 ? 545 SER A CB 1 ATOM 3767 O OG . SER A 1 534 ? -14.201 -12.888 0.160 1.00 62.12 ? 545 SER A OG 1 ATOM 3768 N N . PRO A 1 535 ? -14.920 -16.276 2.547 1.00 46.84 ? 546 PRO A N 1 ATOM 3769 C CA . PRO A 1 535 ? -13.941 -17.064 3.301 1.00 45.51 ? 546 PRO A CA 1 ATOM 3770 C C . PRO A 1 535 ? -12.764 -17.490 2.439 1.00 56.38 ? 546 PRO A C 1 ATOM 3771 O O . PRO A 1 535 ? -12.891 -17.557 1.220 1.00 60.56 ? 546 PRO A O 1 ATOM 3772 C CB . PRO A 1 535 ? -14.746 -18.291 3.716 1.00 59.29 ? 546 PRO A CB 1 ATOM 3773 C CG . PRO A 1 535 ? -15.729 -18.462 2.613 1.00 52.41 ? 546 PRO A CG 1 ATOM 3774 C CD . PRO A 1 535 ? -16.105 -17.077 2.185 1.00 47.84 ? 546 PRO A CD 1 ATOM 3775 N N . TYR A 1 536 ? -11.632 -17.777 3.071 1.00 43.37 ? 547 TYR A N 1 ATOM 3776 C CA . TYR A 1 536 ? -10.452 -18.248 2.357 1.00 56.79 ? 547 TYR A CA 1 ATOM 3777 C C . TYR A 1 536 ? -10.687 -19.587 1.666 1.00 55.53 ? 547 TYR A C 1 ATOM 3778 O O . TYR A 1 536 ? -11.527 -20.381 2.091 1.00 44.51 ? 547 TYR A O 1 ATOM 3779 C CB . TYR A 1 536 ? -9.249 -18.347 3.298 1.00 52.11 ? 547 TYR A CB 1 ATOM 3780 C CG . TYR A 1 536 ? -8.684 -17.006 3.710 1.00 46.97 ? 547 TYR A CG 1 ATOM 3781 C CD1 . TYR A 1 536 ? -8.009 -16.207 2.798 1.00 45.44 ? 547 TYR A CD1 1 ATOM 3782 C CD2 . TYR A 1 536 ? -8.820 -16.541 5.011 1.00 55.41 ? 547 TYR A CD2 1 ATOM 3783 C CE1 . TYR A 1 536 ? -7.490 -14.985 3.168 1.00 51.31 ? 547 TYR A CE1 1 ATOM 3784 C CE2 . TYR A 1 536 ? -8.305 -15.317 5.389 1.00 57.33 ? 547 TYR A CE2 1 ATOM 3785 C CZ . TYR A 1 536 ? -7.642 -14.544 4.465 1.00 57.08 ? 547 TYR A CZ 1 ATOM 3786 O OH . TYR A 1 536 ? -7.126 -13.326 4.839 1.00 59.09 ? 547 TYR A OH 1 ATOM 3787 N N . TRP A 1 537 ? -9.933 -19.819 0.595 1.00 55.81 ? 548 TRP A N 1 ATOM 3788 C CA . TRP A 1 537 ? -10.034 -21.039 -0.198 1.00 46.07 ? 548 TRP A CA 1 ATOM 3789 C C . TRP A 1 537 ? -8.765 -21.839 0.041 1.00 56.45 ? 548 TRP A C 1 ATOM 3790 O O . TRP A 1 537 ? -7.708 -21.548 -0.515 1.00 61.81 ? 548 TRP A O 1 ATOM 3791 C CB . TRP A 1 537 ? -10.209 -20.682 -1.673 1.00 45.14 ? 548 TRP A CB 1 ATOM 3792 C CG . TRP A 1 537 ? -10.515 -21.805 -2.627 1.00 57.25 ? 548 TRP A CG 1 ATOM 3793 C CD1 . TRP A 1 537 ? -9.972 -21.980 -3.864 1.00 57.71 ? 548 TRP A CD1 1 ATOM 3794 C CD2 . TRP A 1 537 ? -11.454 -22.878 -2.450 1.00 66.30 ? 548 TRP A CD2 1 ATOM 3795 N NE1 . TRP A 1 537 ? -10.499 -23.094 -4.465 1.00 57.63 ? 548 TRP A NE1 1 ATOM 3796 C CE2 . TRP A 1 537 ? -11.406 -23.665 -3.619 1.00 64.43 ? 548 TRP A CE2 1 ATOM 3797 C CE3 . TRP A 1 537 ? -12.316 -23.254 -1.419 1.00 68.42 ? 548 TRP A CE3 1 ATOM 3798 C CZ2 . TRP A 1 537 ? -12.190 -24.804 -3.781 1.00 61.41 ? 548 TRP A CZ2 1 ATOM 3799 C CZ3 . TRP A 1 537 ? -13.091 -24.384 -1.583 1.00 69.39 ? 548 TRP A CZ3 1 ATOM 3800 C CH2 . TRP A 1 537 ? -13.024 -25.145 -2.756 1.00 75.02 ? 548 TRP A CH2 1 ATOM 3801 N N . VAL A 1 538 ? -8.890 -22.846 0.893 1.00 55.48 ? 549 VAL A N 1 ATOM 3802 C CA . VAL A 1 538 ? -7.746 -23.543 1.457 1.00 43.91 ? 549 VAL A CA 1 ATOM 3803 C C . VAL A 1 538 ? -7.765 -25.027 1.088 1.00 48.37 ? 549 VAL A C 1 ATOM 3804 O O . VAL A 1 538 ? -8.824 -25.643 1.025 1.00 57.56 ? 549 VAL A O 1 ATOM 3805 C CB . VAL A 1 538 ? -7.747 -23.353 2.999 1.00 43.33 ? 549 VAL A CB 1 ATOM 3806 C CG1 . VAL A 1 538 ? -7.256 -24.588 3.730 1.00 39.27 ? 549 VAL A CG1 1 ATOM 3807 C CG2 . VAL A 1 538 ? -6.942 -22.133 3.375 1.00 41.52 ? 549 VAL A CG2 1 ATOM 3808 N N . THR A 1 539 ? -6.599 -25.597 0.811 1.00 40.94 ? 550 THR A N 1 ATOM 3809 C CA . THR A 1 539 ? -6.504 -27.044 0.651 1.00 53.40 ? 550 THR A CA 1 ATOM 3810 C C . THR A 1 539 ? -5.590 -27.633 1.722 1.00 50.28 ? 550 THR A C 1 ATOM 3811 O O . THR A 1 539 ? -4.509 -27.108 1.992 1.00 47.86 ? 550 THR A O 1 ATOM 3812 C CB . THR A 1 539 ? -6.038 -27.455 -0.770 1.00 53.67 ? 550 THR A CB 1 ATOM 3813 O OG1 . THR A 1 539 ? -5.466 -28.770 -0.733 1.00 66.10 ? 550 THR A OG1 1 ATOM 3814 C CG2 . THR A 1 539 ? -5.005 -26.495 -1.283 1.00 49.02 ? 550 THR A CG2 1 ATOM 3815 N N . ILE A 1 540 ? -6.043 -28.711 2.350 1.00 54.57 ? 551 ILE A N 1 ATOM 3816 C CA . ILE A 1 540 ? -5.263 -29.362 3.393 1.00 47.64 ? 551 ILE A CA 1 ATOM 3817 C C . ILE A 1 540 ? -5.105 -30.840 3.100 1.00 47.74 ? 551 ILE A C 1 ATOM 3818 O O . ILE A 1 540 ? -6.091 -31.567 2.985 1.00 53.65 ? 551 ILE A O 1 ATOM 3819 C CB . ILE A 1 540 ? -5.915 -29.212 4.774 1.00 42.37 ? 551 ILE A CB 1 ATOM 3820 C CG1 . ILE A 1 540 ? -5.985 -27.745 5.176 1.00 38.91 ? 551 ILE A CG1 1 ATOM 3821 C CG2 . ILE A 1 540 ? -5.126 -29.971 5.807 1.00 50.65 ? 551 ILE A CG2 1 ATOM 3822 C CD1 . ILE A 1 540 ? -6.829 -27.507 6.407 1.00 52.85 ? 551 ILE A CD1 1 ATOM 3823 N N . GLY A 1 541 ? -3.856 -31.276 2.977 1.00 48.18 ? 552 GLY A N 1 ATOM 3824 C CA . GLY A 1 541 ? -3.546 -32.673 2.745 1.00 52.59 ? 552 GLY A CA 1 ATOM 3825 C C . GLY A 1 541 ? -2.703 -33.228 3.874 1.00 67.25 ? 552 GLY A C 1 ATOM 3826 O O . GLY A 1 541 ? -2.350 -32.510 4.810 1.00 55.48 ? 552 GLY A O 1 ATOM 3827 N N . ARG A 1 542 ? -2.381 -34.513 3.790 1.00 84.64 ? 553 ARG A N 1 ATOM 3828 C CA . ARG A 1 542 ? -1.607 -35.173 4.831 1.00 93.66 ? 553 ARG A CA 1 ATOM 3829 C C . ARG A 1 542 ? -0.161 -34.685 4.788 1.00 91.36 ? 553 ARG A C 1 ATOM 3830 O O . ARG A 1 542 ? 0.290 -34.149 3.773 1.00 93.42 ? 553 ARG A O 1 ATOM 3831 C CB . ARG A 1 542 ? -1.694 -36.691 4.654 1.00 105.48 ? 553 ARG A CB 1 ATOM 3832 C CG . ARG A 1 542 ? -3.130 -37.204 4.701 1.00 113.53 ? 553 ARG A CG 1 ATOM 3833 C CD . ARG A 1 542 ? -3.300 -38.551 4.016 1.00 118.08 ? 553 ARG A CD 1 ATOM 3834 N NE . ARG A 1 542 ? -3.029 -39.675 4.908 1.00 118.71 ? 553 ARG A NE 1 ATOM 3835 C CZ . ARG A 1 542 ? -2.017 -40.523 4.754 1.00 114.41 ? 553 ARG A CZ 1 ATOM 3836 N NH1 . ARG A 1 542 ? -1.176 -40.378 3.738 1.00 105.76 ? 553 ARG A NH1 1 ATOM 3837 N NH2 . ARG A 1 542 ? -1.851 -41.520 5.613 1.00 115.40 ? 553 ARG A NH2 1 ATOM 3838 N N . GLY A 1 543 ? 0.559 -34.863 5.892 1.00 80.09 ? 554 GLY A N 1 ATOM 3839 C CA . GLY A 1 543 ? 1.928 -34.389 5.997 1.00 81.70 ? 554 GLY A CA 1 ATOM 3840 C C . GLY A 1 543 ? 2.919 -35.083 5.075 1.00 94.96 ? 554 GLY A C 1 ATOM 3841 O O . GLY A 1 543 ? 2.781 -36.268 4.767 1.00 105.84 ? 554 GLY A O 1 ATOM 3842 N N . ASN A 1 544 ? 3.922 -34.333 4.626 1.00 81.89 ? 555 ASN A N 1 ATOM 3843 C CA . ASN A 1 544 ? 5.017 -34.890 3.842 1.00 66.81 ? 555 ASN A CA 1 ATOM 3844 C C . ASN A 1 544 ? 6.225 -35.085 4.758 1.00 56.26 ? 555 ASN A C 1 ATOM 3845 O O . ASN A 1 544 ? 6.736 -34.127 5.338 1.00 65.52 ? 555 ASN A O 1 ATOM 3846 C CB . ASN A 1 544 ? 5.356 -33.957 2.673 1.00 77.16 ? 555 ASN A CB 1 ATOM 3847 C CG . ASN A 1 544 ? 6.220 -34.627 1.605 1.00 80.36 ? 555 ASN A CG 1 ATOM 3848 O OD1 . ASN A 1 544 ? 7.449 -34.563 1.658 1.00 78.92 ? 555 ASN A OD1 1 ATOM 3849 N ND2 . ASN A 1 544 ? 5.576 -35.251 0.619 1.00 65.00 ? 555 ASN A ND2 1 ATOM 3850 N N . VAL A 1 545 ? 6.670 -36.325 4.912 1.00 45.34 ? 556 VAL A N 1 ATOM 3851 C CA . VAL A 1 545 ? 7.747 -36.607 5.855 1.00 51.96 ? 556 VAL A CA 1 ATOM 3852 C C . VAL A 1 545 ? 9.133 -36.357 5.260 1.00 53.30 ? 556 VAL A C 1 ATOM 3853 O O . VAL A 1 545 ? 9.447 -36.814 4.166 1.00 45.10 ? 556 VAL A O 1 ATOM 3854 C CB . VAL A 1 545 ? 7.620 -38.019 6.488 1.00 46.18 ? 556 VAL A CB 1 ATOM 3855 C CG1 . VAL A 1 545 ? 6.770 -38.919 5.616 1.00 50.62 ? 556 VAL A CG1 1 ATOM 3856 C CG2 . VAL A 1 545 ? 8.993 -38.624 6.772 1.00 34.61 ? 556 VAL A CG2 1 ATOM 3857 N N . VAL A 1 546 ? 9.946 -35.612 6.000 1.00 59.44 ? 557 VAL A N 1 ATOM 3858 C CA . VAL A 1 546 ? 11.235 -35.132 5.527 1.00 57.99 ? 557 VAL A CA 1 ATOM 3859 C C . VAL A 1 546 ? 12.345 -35.563 6.478 1.00 58.83 ? 557 VAL A C 1 ATOM 3860 O O . VAL A 1 546 ? 12.193 -35.464 7.693 1.00 59.45 ? 557 VAL A O 1 ATOM 3861 C CB . VAL A 1 546 ? 11.229 -33.584 5.434 1.00 41.21 ? 557 VAL A CB 1 ATOM 3862 C CG1 . VAL A 1 546 ? 12.643 -33.032 5.327 1.00 33.20 ? 557 VAL A CG1 1 ATOM 3863 C CG2 . VAL A 1 546 ? 10.373 -33.117 4.267 1.00 47.08 ? 557 VAL A CG2 1 ATOM 3864 N N . THR A 1 547 ? 13.458 -36.041 5.927 1.00 44.69 ? 558 THR A N 1 ATOM 3865 C CA . THR A 1 547 ? 14.618 -36.403 6.736 1.00 40.22 ? 558 THR A CA 1 ATOM 3866 C C . THR A 1 547 ? 15.820 -35.498 6.470 1.00 33.39 ? 558 THR A C 1 ATOM 3867 O O . THR A 1 547 ? 16.117 -35.158 5.327 1.00 56.02 ? 558 THR A O 1 ATOM 3868 C CB . THR A 1 547 ? 15.043 -37.870 6.509 1.00 30.33 ? 558 THR A CB 1 ATOM 3869 O OG1 . THR A 1 547 ? 13.945 -38.741 6.794 1.00 36.48 ? 558 THR A OG1 1 ATOM 3870 C CG2 . THR A 1 547 ? 16.199 -38.235 7.417 1.00 29.67 ? 558 THR A CG2 1 ATOM 3871 N N . GLY A 1 548 ? 16.512 -35.114 7.535 1.00 40.91 ? 559 GLY A N 1 ATOM 3872 C CA . GLY A 1 548 ? 17.731 -34.345 7.407 1.00 45.12 ? 559 GLY A CA 1 ATOM 3873 C C . GLY A 1 548 ? 18.884 -34.956 8.177 1.00 41.63 ? 559 GLY A C 1 ATOM 3874 O O . GLY A 1 548 ? 18.792 -35.179 9.384 1.00 40.82 ? 559 GLY A O 1 ATOM 3875 N N . GLN A 1 549 ? 19.974 -35.233 7.472 1.00 33.98 ? 560 GLN A N 1 ATOM 3876 C CA . GLN A 1 549 ? 21.199 -35.705 8.104 1.00 34.06 ? 560 GLN A CA 1 ATOM 3877 C C . GLN A 1 549 ? 21.982 -34.540 8.723 1.00 41.64 ? 560 GLN A C 1 ATOM 3878 O O . GLN A 1 549 ? 22.338 -33.578 8.045 1.00 55.64 ? 560 GLN A O 1 ATOM 3879 C CB . GLN A 1 549 ? 22.061 -36.450 7.085 1.00 32.12 ? 560 GLN A CB 1 ATOM 3880 C CG . GLN A 1 549 ? 21.342 -37.582 6.386 1.00 37.21 ? 560 GLN A CG 1 ATOM 3881 C CD . GLN A 1 549 ? 21.061 -38.753 7.303 1.00 47.72 ? 560 GLN A CD 1 ATOM 3882 O OE1 . GLN A 1 549 ? 21.766 -38.966 8.291 1.00 44.73 ? 560 GLN A OE1 1 ATOM 3883 N NE2 . GLN A 1 549 ? 20.030 -39.526 6.977 1.00 45.84 ? 560 GLN A NE2 1 ATOM 3884 N N . ILE A 1 550 ? 22.256 -34.642 10.016 1.00 46.48 ? 561 ILE A N 1 ATOM 3885 C CA . ILE A 1 550 ? 22.853 -33.548 10.769 1.00 42.73 ? 561 ILE A CA 1 ATOM 3886 C C . ILE A 1 550 ? 24.383 -33.575 10.719 1.00 47.24 ? 561 ILE A C 1 ATOM 3887 O O . ILE A 1 550 ? 25.036 -32.532 10.776 1.00 52.87 ? 561 ILE A O 1 ATOM 3888 C CB . ILE A 1 550 ? 22.343 -33.568 12.221 1.00 47.31 ? 561 ILE A CB 1 ATOM 3889 C CG1 . ILE A 1 550 ? 20.812 -33.486 12.227 1.00 40.46 ? 561 ILE A CG1 1 ATOM 3890 C CG2 . ILE A 1 550 ? 22.941 -32.434 13.021 1.00 54.59 ? 561 ILE A CG2 1 ATOM 3891 C CD1 . ILE A 1 550 ? 20.192 -33.587 13.599 1.00 49.29 ? 561 ILE A CD1 1 ATOM 3892 N N . CYS A 1 551 ? 24.940 -34.775 10.590 1.00 46.86 ? 562 CYS A N 1 ATOM 3893 C CA . CYS A 1 551 ? 26.386 -34.971 10.493 1.00 39.38 ? 562 CYS A CA 1 ATOM 3894 C C . CYS A 1 551 ? 27.048 -34.087 9.443 1.00 44.66 ? 562 CYS A C 1 ATOM 3895 O O . CYS A 1 551 ? 26.518 -33.907 8.350 1.00 49.79 ? 562 CYS A O 1 ATOM 3896 C CB . CYS A 1 551 ? 26.698 -36.437 10.164 1.00 37.73 ? 562 CYS A CB 1 ATOM 3897 S SG . CYS A 1 551 ? 27.089 -37.482 11.578 1.00 62.91 ? 562 CYS A SG 1 ATOM 3898 N N . ARG A 1 552 ? 28.203 -33.530 9.790 1.00 53.76 ? 563 ARG A N 1 ATOM 3899 C CA . ARG A 1 552 ? 29.073 -32.882 8.814 1.00 48.34 ? 563 ARG A CA 1 ATOM 3900 C C . ARG A 1 552 ? 30.447 -33.545 8.884 1.00 52.16 ? 563 ARG A C 1 ATOM 3901 O O . ARG A 1 552 ? 30.734 -34.306 9.811 1.00 64.03 ? 563 ARG A O 1 ATOM 3902 C CB . ARG A 1 552 ? 29.204 -31.382 9.086 1.00 41.95 ? 563 ARG A CB 1 ATOM 3903 C CG . ARG A 1 552 ? 27.900 -30.599 9.057 1.00 50.60 ? 563 ARG A CG 1 ATOM 3904 C CD . ARG A 1 552 ? 27.236 -30.621 7.686 1.00 41.20 ? 563 ARG A CD 1 ATOM 3905 N NE . ARG A 1 552 ? 25.875 -31.140 7.777 1.00 47.14 ? 563 ARG A NE 1 ATOM 3906 C CZ . ARG A 1 552 ? 24.785 -30.387 7.723 1.00 46.59 ? 563 ARG A CZ 1 ATOM 3907 N NH1 . ARG A 1 552 ? 24.893 -29.077 7.562 1.00 50.03 ? 563 ARG A NH1 1 ATOM 3908 N NH2 . ARG A 1 552 ? 23.588 -30.945 7.828 1.00 40.92 ? 563 ARG A NH2 1 ATOM 3909 N N . LEU A 1 553 ? 31.297 -33.257 7.908 1.00 35.27 ? 564 LEU A N 1 ATOM 3910 C CA . LEU A 1 553 ? 32.632 -33.829 7.888 1.00 41.08 ? 564 LEU A CA 1 ATOM 3911 C C . LEU A 1 553 ? 33.698 -32.742 7.852 1.00 45.52 ? 564 LEU A C 1 ATOM 3912 O O . LEU A 1 553 ? 33.705 -31.900 6.957 1.00 45.47 ? 564 LEU A O 1 ATOM 3913 C CB . LEU A 1 553 ? 32.792 -34.756 6.686 1.00 42.29 ? 564 LEU A CB 1 ATOM 3914 C CG . LEU A 1 553 ? 31.750 -35.864 6.551 1.00 43.14 ? 564 LEU A CG 1 ATOM 3915 C CD1 . LEU A 1 553 ? 31.989 -36.641 5.271 1.00 45.71 ? 564 LEU A CD1 1 ATOM 3916 C CD2 . LEU A 1 553 ? 31.788 -36.785 7.754 1.00 43.76 ? 564 LEU A CD2 1 ATOM 3917 N N . GLY A 1 554 ? 34.591 -32.768 8.836 1.00 44.78 ? 565 GLY A N 1 ATOM 3918 C CA . GLY A 1 554 ? 35.727 -31.862 8.883 1.00 48.25 ? 565 GLY A CA 1 ATOM 3919 C C . GLY A 1 554 ? 35.425 -30.398 9.161 1.00 56.22 ? 565 GLY A C 1 ATOM 3920 O O . GLY A 1 554 ? 36.166 -29.520 8.717 1.00 63.46 ? 565 GLY A O 1 ATOM 3921 N N . ASN A 1 555 ? 34.355 -30.126 9.903 1.00 47.93 ? 566 ASN A N 1 ATOM 3922 C CA . ASN A 1 555 ? 33.962 -28.748 10.179 1.00 40.96 ? 566 ASN A CA 1 ATOM 3923 C C . ASN A 1 555 ? 34.313 -28.299 11.592 1.00 49.17 ? 566 ASN A C 1 ATOM 3924 O O . ASN A 1 555 ? 34.012 -27.169 11.986 1.00 50.18 ? 566 ASN A O 1 ATOM 3925 C CB . ASN A 1 555 ? 32.470 -28.547 9.924 1.00 37.13 ? 566 ASN A CB 1 ATOM 3926 C CG . ASN A 1 555 ? 31.605 -29.396 10.835 1.00 55.83 ? 566 ASN A CG 1 ATOM 3927 O OD1 . ASN A 1 555 ? 31.903 -30.563 11.074 1.00 59.09 ? 566 ASN A OD1 1 ATOM 3928 N ND2 . ASN A 1 555 ? 30.528 -28.810 11.351 1.00 55.70 ? 566 ASN A ND2 1 ATOM 3929 N N . ASN A 1 556 ? 34.947 -29.198 12.340 1.00 47.94 ? 567 ASN A N 1 ATOM 3930 C CA . ASN A 1 556 ? 35.425 -28.936 13.701 1.00 41.75 ? 567 ASN A CA 1 ATOM 3931 C C . ASN A 1 556 ? 34.410 -28.357 14.683 1.00 42.17 ? 567 ASN A C 1 ATOM 3932 O O . ASN A 1 556 ? 34.729 -27.450 15.447 1.00 51.65 ? 567 ASN A O 1 ATOM 3933 C CB . ASN A 1 556 ? 36.691 -28.072 13.694 1.00 44.45 ? 567 ASN A CB 1 ATOM 3934 C CG . ASN A 1 556 ? 37.836 -28.732 12.967 1.00 51.68 ? 567 ASN A CG 1 ATOM 3935 O OD1 . ASN A 1 556 ? 38.356 -29.759 13.402 1.00 47.05 ? 567 ASN A OD1 1 ATOM 3936 N ND2 . ASN A 1 556 ? 38.238 -28.144 11.848 1.00 66.10 ? 567 ASN A ND2 1 ATOM 3937 N N . THR A 1 557 ? 33.192 -28.879 14.661 1.00 37.02 ? 568 THR A N 1 ATOM 3938 C CA . THR A 1 557 ? 32.246 -28.597 15.731 1.00 46.52 ? 568 THR A CA 1 ATOM 3939 C C . THR A 1 557 ? 31.677 -29.913 16.226 1.00 49.39 ? 568 THR A C 1 ATOM 3940 O O . THR A 1 557 ? 32.139 -30.980 15.825 1.00 34.07 ? 568 THR A O 1 ATOM 3941 C CB . THR A 1 557 ? 31.093 -27.672 15.287 1.00 47.99 ? 568 THR A CB 1 ATOM 3942 O OG1 . THR A 1 557 ? 30.376 -28.273 14.203 1.00 42.41 ? 568 THR A OG1 1 ATOM 3943 C CG2 . THR A 1 557 ? 31.625 -26.311 14.861 1.00 33.58 ? 568 THR A CG2 1 ATOM 3944 N N . TYR A 1 558 ? 30.674 -29.838 17.094 1.00 44.78 ? 569 TYR A N 1 ATOM 3945 C CA . TYR A 1 558 ? 30.037 -31.039 17.613 1.00 47.63 ? 569 TYR A CA 1 ATOM 3946 C C . TYR A 1 558 ? 29.480 -31.907 16.490 1.00 46.83 ? 569 TYR A C 1 ATOM 3947 O O . TYR A 1 558 ? 29.453 -33.128 16.603 1.00 54.41 ? 569 TYR A O 1 ATOM 3948 C CB . TYR A 1 558 ? 28.928 -30.684 18.603 1.00 46.18 ? 569 TYR A CB 1 ATOM 3949 C CG . TYR A 1 558 ? 28.140 -31.889 19.079 1.00 51.78 ? 569 TYR A CG 1 ATOM 3950 C CD1 . TYR A 1 558 ? 28.645 -32.731 20.060 1.00 52.08 ? 569 TYR A CD1 1 ATOM 3951 C CD2 . TYR A 1 558 ? 26.893 -32.184 18.544 1.00 45.77 ? 569 TYR A CD2 1 ATOM 3952 C CE1 . TYR A 1 558 ? 27.930 -33.832 20.491 1.00 52.65 ? 569 TYR A CE1 1 ATOM 3953 C CE2 . TYR A 1 558 ? 26.171 -33.281 18.971 1.00 51.22 ? 569 TYR A CE2 1 ATOM 3954 C CZ . TYR A 1 558 ? 26.695 -34.102 19.941 1.00 48.92 ? 569 TYR A CZ 1 ATOM 3955 O OH . TYR A 1 558 ? 25.975 -35.192 20.367 1.00 49.91 ? 569 TYR A OH 1 ATOM 3956 N N . THR A 1 559 ? 29.048 -31.270 15.406 1.00 42.09 ? 570 THR A N 1 ATOM 3957 C CA . THR A 1 559 ? 28.466 -31.989 14.279 1.00 41.36 ? 570 THR A CA 1 ATOM 3958 C C . THR A 1 559 ? 29.509 -32.641 13.376 1.00 50.64 ? 570 THR A C 1 ATOM 3959 O O . THR A 1 559 ? 29.159 -33.216 12.341 1.00 44.66 ? 570 THR A O 1 ATOM 3960 C CB . THR A 1 559 ? 27.578 -31.080 13.407 1.00 47.13 ? 570 THR A CB 1 ATOM 3961 O OG1 . THR A 1 559 ? 28.312 -29.911 13.029 1.00 75.89 ? 570 THR A OG1 1 ATOM 3962 C CG2 . THR A 1 559 ? 26.315 -30.677 14.155 1.00 31.93 ? 570 THR A CG2 1 ATOM 3963 N N . ASP A 1 560 ? 30.783 -32.551 13.751 1.00 45.67 ? 571 ASP A N 1 ATOM 3964 C CA . ASP A 1 560 ? 31.825 -33.213 12.973 1.00 32.35 ? 571 ASP A CA 1 ATOM 3965 C C . ASP A 1 560 ? 31.832 -34.680 13.316 1.00 43.34 ? 571 ASP A C 1 ATOM 3966 O O . ASP A 1 560 ? 32.234 -35.066 14.412 1.00 71.33 ? 571 ASP A O 1 ATOM 3967 C CB . ASP A 1 560 ? 33.205 -32.616 13.236 1.00 42.44 ? 571 ASP A CB 1 ATOM 3968 C CG . ASP A 1 560 ? 34.206 -32.970 12.146 1.00 54.32 ? 571 ASP A CG 1 ATOM 3969 O OD1 . ASP A 1 560 ? 33.977 -33.968 11.429 1.00 54.14 ? 571 ASP A OD1 1 ATOM 3970 O OD2 . ASP A 1 560 ? 35.215 -32.251 11.999 1.00 57.55 ? 571 ASP A OD2 1 ATOM 3971 N N . CYS A 1 561 ? 31.376 -35.497 12.377 1.00 41.34 ? 572 CYS A N 1 ATOM 3972 C CA . CYS A 1 561 ? 31.220 -36.916 12.638 1.00 38.22 ? 572 CYS A CA 1 ATOM 3973 C C . CYS A 1 561 ? 32.370 -37.688 12.028 1.00 40.27 ? 572 CYS A C 1 ATOM 3974 O O . CYS A 1 561 ? 32.277 -38.898 11.825 1.00 50.07 ? 572 CYS A O 1 ATOM 3975 C CB . CYS A 1 561 ? 29.882 -37.424 12.103 1.00 35.67 ? 572 CYS A CB 1 ATOM 3976 S SG . CYS A 1 561 ? 28.442 -36.625 12.835 1.00 51.11 ? 572 CYS A SG 1 ATOM 3977 N N . THR A 1 562 ? 33.448 -36.972 11.722 1.00 36.11 ? 573 THR A N 1 ATOM 3978 C CA . THR A 1 562 ? 34.692 -37.614 11.339 1.00 35.20 ? 573 THR A CA 1 ATOM 3979 C C . THR A 1 562 ? 35.216 -38.285 12.593 1.00 47.44 ? 573 THR A C 1 ATOM 3980 O O . THR A 1 562 ? 35.528 -37.607 13.573 1.00 49.96 ? 573 THR A O 1 ATOM 3981 C CB . THR A 1 562 ? 35.749 -36.608 10.860 1.00 32.86 ? 573 THR A CB 1 ATOM 3982 O OG1 . THR A 1 562 ? 35.184 -35.736 9.874 1.00 75.31 ? 573 THR A OG1 1 ATOM 3983 C CG2 . THR A 1 562 ? 36.938 -37.339 10.256 1.00 35.08 ? 573 THR A CG2 1 ATOM 3984 N N . PRO A 1 563 ? 35.306 -39.620 12.571 1.00 33.32 ? 574 PRO A N 1 ATOM 3985 C CA . PRO A 1 563 ? 35.724 -40.370 13.755 1.00 34.96 ? 574 PRO A CA 1 ATOM 3986 C C . PRO A 1 563 ? 37.047 -39.854 14.321 1.00 46.25 ? 574 PRO A C 1 ATOM 3987 O O . PRO A 1 563 ? 37.994 -39.612 13.569 1.00 54.43 ? 574 PRO A O 1 ATOM 3988 C CB . PRO A 1 563 ? 35.856 -41.814 13.240 1.00 25.51 ? 574 PRO A CB 1 ATOM 3989 C CG . PRO A 1 563 ? 35.831 -41.718 11.741 1.00 36.55 ? 574 PRO A CG 1 ATOM 3990 C CD . PRO A 1 563 ? 35.060 -40.492 11.410 1.00 32.42 ? 574 PRO A CD 1 ATOM 3991 N N . ARG A 1 564 ? 37.082 -39.651 15.636 1.00 34.01 ? 575 ARG A N 1 ATOM 3992 C CA . ARG A 1 564 ? 38.292 -39.202 16.315 1.00 33.90 ? 575 ARG A CA 1 ATOM 3993 C C . ARG A 1 564 ? 39.086 -40.413 16.807 1.00 43.51 ? 575 ARG A C 1 ATOM 3994 O O . ARG A 1 564 ? 38.727 -41.066 17.790 1.00 40.37 ? 575 ARG A O 1 ATOM 3995 C CB . ARG A 1 564 ? 37.953 -38.244 17.465 1.00 42.74 ? 575 ARG A CB 1 ATOM 3996 C CG . ARG A 1 564 ? 36.464 -37.989 17.618 1.00 58.33 ? 575 ARG A CG 1 ATOM 3997 C CD . ARG A 1 564 ? 36.117 -36.511 17.584 1.00 60.34 ? 575 ARG A CD 1 ATOM 3998 N NE . ARG A 1 564 ? 36.282 -35.871 18.885 1.00 74.83 ? 575 ARG A NE 1 ATOM 3999 C CZ . ARG A 1 564 ? 35.401 -35.035 19.426 1.00 68.11 ? 575 ARG A CZ 1 ATOM 4000 N NH1 . ARG A 1 564 ? 35.640 -34.500 20.616 1.00 69.50 ? 575 ARG A NH1 1 ATOM 4001 N NH2 . ARG A 1 564 ? 34.282 -34.733 18.781 1.00 43.59 ? 575 ARG A NH2 1 ATOM 4002 N N . SER A 1 565 ? 40.168 -40.706 16.098 1.00 34.66 ? 576 SER A N 1 ATOM 4003 C CA . SER A 1 565 ? 40.925 -41.917 16.330 1.00 46.94 ? 576 SER A CA 1 ATOM 4004 C C . SER A 1 565 ? 42.350 -41.588 16.770 1.00 51.03 ? 576 SER A C 1 ATOM 4005 O O . SER A 1 565 ? 43.099 -40.928 16.050 1.00 51.65 ? 576 SER A O 1 ATOM 4006 C CB . SER A 1 565 ? 40.921 -42.779 15.064 1.00 42.34 ? 576 SER A CB 1 ATOM 4007 O OG . SER A 1 565 ? 41.435 -44.071 15.326 1.00 72.07 ? 576 SER A OG 1 ATOM 4008 N N . ILE A 1 566 ? 42.707 -42.045 17.966 1.00 47.05 ? 577 ILE A N 1 ATOM 4009 C CA . ILE A 1 566 ? 44.045 -41.851 18.506 1.00 53.87 ? 577 ILE A CA 1 ATOM 4010 C C . ILE A 1 566 ? 44.631 -43.201 18.899 1.00 56.95 ? 577 ILE A C 1 ATOM 4011 O O . ILE A 1 566 ? 44.016 -43.945 19.658 1.00 55.40 ? 577 ILE A O 1 ATOM 4012 C CB . ILE A 1 566 ? 44.019 -40.958 19.756 1.00 39.03 ? 577 ILE A CB 1 ATOM 4013 C CG1 . ILE A 1 566 ? 43.370 -39.612 19.448 1.00 40.49 ? 577 ILE A CG1 1 ATOM 4014 C CG2 . ILE A 1 566 ? 45.420 -40.752 20.297 1.00 37.87 ? 577 ILE A CG2 1 ATOM 4015 C CD1 . ILE A 1 566 ? 43.342 -38.674 20.643 1.00 40.20 ? 577 ILE A CD1 1 ATOM 4016 N N . ASN A 1 567 ? 45.819 -43.514 18.388 1.00 55.31 ? 578 ASN A N 1 ATOM 4017 C CA . ASN A 1 567 ? 46.446 -44.806 18.653 1.00 61.14 ? 578 ASN A CA 1 ATOM 4018 C C . ASN A 1 567 ? 47.843 -44.667 19.242 1.00 66.29 ? 578 ASN A C 1 ATOM 4019 O O . ASN A 1 567 ? 48.454 -43.603 19.149 1.00 79.15 ? 578 ASN A O 1 ATOM 4020 C CB . ASN A 1 567 ? 46.478 -45.655 17.381 1.00 43.28 ? 578 ASN A CB 1 ATOM 4021 C CG . ASN A 1 567 ? 45.092 -46.082 16.936 1.00 68.59 ? 578 ASN A CG 1 ATOM 4022 O OD1 . ASN A 1 567 ? 44.657 -47.204 17.205 1.00 75.75 ? 578 ASN A OD1 1 ATOM 4023 N ND2 . ASN A 1 567 ? 44.384 -45.183 16.263 1.00 63.30 ? 578 ASN A ND2 1 ATOM 4024 N N . GLY A 1 568 ? 48.345 -45.735 19.858 1.00 54.76 ? 579 GLY A N 1 ATOM 4025 C CA . GLY A 1 568 ? 49.667 -45.683 20.454 1.00 54.83 ? 579 GLY A CA 1 ATOM 4026 C C . GLY A 1 568 ? 50.248 -46.945 21.073 1.00 63.11 ? 579 GLY A C 1 ATOM 4027 O O . GLY A 1 568 ? 49.582 -47.975 21.204 1.00 59.60 ? 579 GLY A O 1 ATOM 4028 N N . LYS A 1 569 ? 51.520 -46.839 21.450 1.00 65.46 ? 580 LYS A N 1 ATOM 4029 C CA . LYS A 1 569 ? 52.253 -47.887 22.144 1.00 56.25 ? 580 LYS A CA 1 ATOM 4030 C C . LYS A 1 569 ? 52.768 -47.302 23.448 1.00 59.21 ? 580 LYS A C 1 ATOM 4031 O O . LYS A 1 569 ? 52.939 -46.087 23.550 1.00 49.44 ? 580 LYS A O 1 ATOM 4032 C CB . LYS A 1 569 ? 53.439 -48.354 21.299 1.00 63.06 ? 580 LYS A CB 1 ATOM 4033 C CG . LYS A 1 569 ? 53.053 -49.123 20.044 1.00 75.90 ? 580 LYS A CG 1 ATOM 4034 C CD . LYS A 1 569 ? 54.267 -49.430 19.177 1.00 84.85 ? 580 LYS A CD 1 ATOM 4035 C CE . LYS A 1 569 ? 53.971 -50.569 18.214 1.00 98.46 ? 580 LYS A CE 1 ATOM 4036 N NZ . LYS A 1 569 ? 52.643 -50.404 17.559 1.00 104.30 ? 580 LYS A NZ 1 ATOM 4037 N N . SER A 1 570 ? 53.013 -48.152 24.443 1.00 51.09 ? 581 SER A N 1 ATOM 4038 C CA . SER A 1 570 ? 53.569 -47.681 25.712 1.00 53.24 ? 581 SER A CA 1 ATOM 4039 C C . SER A 1 570 ? 54.409 -48.734 26.437 1.00 60.45 ? 581 SER A C 1 ATOM 4040 O O . SER A 1 570 ? 54.188 -49.940 26.296 1.00 57.88 ? 581 SER A O 1 ATOM 4041 C CB . SER A 1 570 ? 52.468 -47.146 26.635 1.00 56.85 ? 581 SER A CB 1 ATOM 4042 O OG . SER A 1 570 ? 51.702 -48.197 27.190 1.00 61.07 ? 581 SER A OG 1 ATOM 4043 N N . TYR A 1 571 ? 55.375 -48.258 27.214 1.00 60.34 ? 582 TYR A N 1 ATOM 4044 C CA . TYR A 1 571 ? 56.292 -49.127 27.938 1.00 70.83 ? 582 TYR A CA 1 ATOM 4045 C C . TYR A 1 571 ? 56.453 -48.662 29.378 1.00 72.46 ? 582 TYR A C 1 ATOM 4046 O O . TYR A 1 571 ? 56.485 -47.458 29.643 1.00 68.96 ? 582 TYR A O 1 ATOM 4047 C CB . TYR A 1 571 ? 57.667 -49.121 27.265 1.00 84.09 ? 582 TYR A CB 1 ATOM 4048 C CG . TYR A 1 571 ? 57.705 -49.776 25.905 1.00 97.21 ? 582 TYR A CG 1 ATOM 4049 C CD1 . TYR A 1 571 ? 58.145 -51.086 25.757 1.00 117.72 ? 582 TYR A CD1 1 ATOM 4050 C CD2 . TYR A 1 571 ? 57.309 -49.086 24.768 1.00 93.44 ? 582 TYR A CD2 1 ATOM 4051 C CE1 . TYR A 1 571 ? 58.185 -51.693 24.516 1.00 123.65 ? 582 TYR A CE1 1 ATOM 4052 C CE2 . TYR A 1 571 ? 57.343 -49.685 23.520 1.00 109.37 ? 582 TYR A CE2 1 ATOM 4053 C CZ . TYR A 1 571 ? 57.784 -50.989 23.400 1.00 122.53 ? 582 TYR A CZ 1 ATOM 4054 O OH . TYR A 1 571 ? 57.820 -51.591 22.162 1.00 125.78 ? 582 TYR A OH 1 ATOM 4055 N N . TYR A 1 572 ? 56.551 -49.614 30.305 1.00 67.88 ? 583 TYR A N 1 ATOM 4056 C CA . TYR A 1 572 ? 56.936 -49.296 31.678 1.00 52.56 ? 583 TYR A CA 1 ATOM 4057 C C . TYR A 1 572 ? 57.859 -50.352 32.279 1.00 66.95 ? 583 TYR A C 1 ATOM 4058 O O . TYR A 1 572 ? 57.692 -51.546 32.041 1.00 61.24 ? 583 TYR A O 1 ATOM 4059 C CB . TYR A 1 572 ? 55.715 -49.046 32.579 1.00 55.73 ? 583 TYR A CB 1 ATOM 4060 C CG . TYR A 1 572 ? 54.958 -50.283 33.010 1.00 58.31 ? 583 TYR A CG 1 ATOM 4061 C CD1 . TYR A 1 572 ? 55.358 -51.021 34.121 1.00 56.26 ? 583 TYR A CD1 1 ATOM 4062 C CD2 . TYR A 1 572 ? 53.825 -50.695 32.326 1.00 61.86 ? 583 TYR A CD2 1 ATOM 4063 C CE1 . TYR A 1 572 ? 54.665 -52.149 34.519 1.00 51.48 ? 583 TYR A CE1 1 ATOM 4064 C CE2 . TYR A 1 572 ? 53.121 -51.819 32.721 1.00 65.82 ? 583 TYR A CE2 1 ATOM 4065 C CZ . TYR A 1 572 ? 53.547 -52.542 33.814 1.00 68.75 ? 583 TYR A CZ 1 ATOM 4066 O OH . TYR A 1 572 ? 52.845 -53.661 34.202 1.00 80.39 ? 583 TYR A OH 1 ATOM 4067 N N . ALA A 1 573 ? 58.840 -49.890 33.048 1.00 55.43 ? 584 ALA A N 1 ATOM 4068 C CA . ALA A 1 573 ? 59.735 -50.765 33.796 1.00 67.70 ? 584 ALA A CA 1 ATOM 4069 C C . ALA A 1 573 ? 59.773 -50.294 35.247 1.00 63.97 ? 584 ALA A C 1 ATOM 4070 O O . ALA A 1 573 ? 60.006 -49.116 35.520 1.00 58.02 ? 584 ALA A O 1 ATOM 4071 C CB . ALA A 1 573 ? 61.129 -50.751 33.190 1.00 59.70 ? 584 ALA A CB 1 ATOM 4072 N N . ALA A 1 574 ? 59.531 -51.205 36.182 1.00 70.66 ? 585 ALA A N 1 ATOM 4073 C CA . ALA A 1 574 ? 59.439 -50.807 37.580 1.00 71.73 ? 585 ALA A CA 1 ATOM 4074 C C . ALA A 1 574 ? 60.209 -51.728 38.516 1.00 78.24 ? 585 ALA A C 1 ATOM 4075 O O . ALA A 1 574 ? 59.909 -52.916 38.624 1.00 88.09 ? 585 ALA A O 1 ATOM 4076 C CB . ALA A 1 574 ? 57.981 -50.700 38.011 1.00 63.71 ? 585 ALA A CB 1 ATOM 4077 N N . VAL A 1 575 ? 61.201 -51.159 39.194 1.00 73.34 ? 586 VAL A N 1 ATOM 4078 C CA . VAL A 1 575 ? 61.971 -51.881 40.194 1.00 74.28 ? 586 VAL A CA 1 ATOM 4079 C C . VAL A 1 575 ? 61.593 -51.391 41.580 1.00 71.93 ? 586 VAL A C 1 ATOM 4080 O O . VAL A 1 575 ? 61.690 -50.199 41.869 1.00 71.98 ? 586 VAL A O 1 ATOM 4081 C CB . VAL A 1 575 ? 63.478 -51.668 40.001 1.00 82.48 ? 586 VAL A CB 1 ATOM 4082 C CG1 . VAL A 1 575 ? 64.255 -52.343 41.122 1.00 64.53 ? 586 VAL A CG1 1 ATOM 4083 C CG2 . VAL A 1 575 ? 63.916 -52.193 38.642 1.00 92.94 ? 586 VAL A CG2 1 ATOM 4084 N N . ARG A 1 576 ? 61.154 -52.313 42.429 1.00 75.09 ? 587 ARG A N 1 ATOM 4085 C CA . ARG A 1 576 ? 60.806 -51.988 43.808 1.00 89.80 ? 587 ARG A CA 1 ATOM 4086 C C . ARG A 1 576 ? 61.556 -52.890 44.784 1.00 97.06 ? 587 ARG A C 1 ATOM 4087 O O . ARG A 1 576 ? 62.043 -53.958 44.407 1.00 99.89 ? 587 ARG A O 1 ATOM 4088 C CB . ARG A 1 576 ? 59.300 -52.134 44.032 1.00 89.18 ? 587 ARG A CB 1 ATOM 4089 C CG . ARG A 1 576 ? 58.450 -51.196 43.197 1.00 97.77 ? 587 ARG A CG 1 ATOM 4090 C CD . ARG A 1 576 ? 56.973 -51.421 43.466 1.00 96.81 ? 587 ARG A CD 1 ATOM 4091 N NE . ARG A 1 576 ? 56.555 -52.769 43.096 1.00 96.79 ? 587 ARG A NE 1 ATOM 4092 C CZ . ARG A 1 576 ? 55.358 -53.277 43.363 1.00 86.93 ? 587 ARG A CZ 1 ATOM 4093 N NH1 . ARG A 1 576 ? 54.458 -52.546 44.008 1.00 83.60 ? 587 ARG A NH1 1 ATOM 4094 N NH2 . ARG A 1 576 ? 55.063 -54.515 42.989 1.00 76.99 ? 587 ARG A NH2 1 ATOM 4095 N N . ASP A 1 577 ? 61.644 -52.459 46.038 1.00 85.93 ? 588 ASP A N 1 ATOM 4096 C CA . ASP A 1 577 ? 62.291 -53.257 47.071 1.00 86.89 ? 588 ASP A CA 1 ATOM 4097 C C . ASP A 1 577 ? 61.880 -52.821 48.473 1.00 80.22 ? 588 ASP A C 1 ATOM 4098 O O . ASP A 1 577 ? 61.947 -51.643 48.810 1.00 78.77 ? 588 ASP A O 1 ATOM 4099 C CB . ASP A 1 577 ? 63.814 -53.198 46.928 1.00 96.21 ? 588 ASP A CB 1 ATOM 4100 C CG . ASP A 1 577 ? 64.529 -54.040 47.967 1.00 114.02 ? 588 ASP A CG 1 ATOM 4101 O OD1 . ASP A 1 577 ? 64.563 -55.278 47.810 1.00 117.02 ? 588 ASP A OD1 1 ATOM 4102 O OD2 . ASP A 1 577 ? 65.060 -53.463 48.940 1.00 124.41 ? 588 ASP A OD2 1 ATOM 4103 N N . ASN A 1 578 ? 61.449 -53.783 49.282 1.00 84.55 ? 589 ASN A N 1 ATOM 4104 C CA . ASN A 1 578 ? 61.148 -53.530 50.684 1.00 94.63 ? 589 ASN A CA 1 ATOM 4105 C C . ASN A 1 578 ? 61.934 -54.469 51.594 1.00 91.24 ? 589 ASN A C 1 ATOM 4106 O O . ASN A 1 578 ? 61.894 -55.686 51.428 1.00 100.26 ? 589 ASN A O 1 ATOM 4107 C CB . ASN A 1 578 ? 59.643 -53.633 50.954 1.00 109.37 ? 589 ASN A CB 1 ATOM 4108 C CG . ASN A 1 578 ? 59.005 -54.836 50.284 1.00 122.27 ? 589 ASN A CG 1 ATOM 4109 O OD1 . ASN A 1 578 ? 58.920 -55.917 50.868 1.00 125.34 ? 589 ASN A OD1 1 ATOM 4110 N ND2 . ASN A 1 578 ? 58.540 -54.649 49.053 1.00 124.89 ? 589 ASN A ND2 1 ATOM 4111 N N . VAL A 1 579 ? 62.656 -53.894 52.549 1.00 81.88 ? 590 VAL A N 1 ATOM 4112 C CA . VAL A 1 579 ? 63.529 -54.674 53.419 1.00 84.88 ? 590 VAL A CA 1 ATOM 4113 C C . VAL A 1 579 ? 63.069 -54.616 54.873 1.00 83.79 ? 590 VAL A C 1 ATOM 4114 O O . VAL A 1 579 ? 62.633 -53.572 55.353 1.00 91.07 ? 590 VAL A O 1 ATOM 4115 C CB . VAL A 1 579 ? 65.000 -54.194 53.307 1.00 90.07 ? 590 VAL A CB 1 ATOM 4116 C CG1 . VAL A 1 579 ? 65.094 -52.691 53.522 1.00 78.65 ? 590 VAL A CG1 1 ATOM 4117 C CG2 . VAL A 1 579 ? 65.901 -54.937 54.286 1.00 99.68 ? 590 VAL A CG2 1 ATOM 4118 N N . ARG A 1 580 ? 63.150 -55.749 55.563 1.00 88.46 ? 591 ARG A N 1 ATOM 4119 C CA . ARG A 1 580 ? 62.895 -55.786 56.997 1.00 89.35 ? 591 ARG A CA 1 ATOM 4120 C C . ARG A 1 580 ? 64.194 -55.527 57.750 1.00 87.77 ? 591 ARG A C 1 ATOM 4121 O O . ARG A 1 580 ? 65.041 -56.413 57.862 1.00 81.10 ? 591 ARG A O 1 ATOM 4122 C CB . ARG A 1 580 ? 62.307 -57.137 57.410 1.00 93.67 ? 591 ARG A CB 1 ATOM 4123 C CG . ARG A 1 580 ? 61.836 -57.186 58.857 1.00 103.10 ? 591 ARG A CG 1 ATOM 4124 C CD . ARG A 1 580 ? 61.354 -58.575 59.250 1.00 105.17 ? 591 ARG A CD 1 ATOM 4125 N NE . ARG A 1 580 ? 60.819 -58.609 60.610 1.00 115.89 ? 591 ARG A NE 1 ATOM 4126 C CZ . ARG A 1 580 ? 61.549 -58.835 61.700 1.00 132.67 ? 591 ARG A CZ 1 ATOM 4127 N NH1 . ARG A 1 580 ? 60.975 -58.847 62.895 1.00 132.86 ? 591 ARG A NH1 1 ATOM 4128 N NH2 . ARG A 1 580 ? 62.856 -59.046 61.597 1.00 139.41 ? 591 ARG A NH2 1 ATOM 4129 N N . LEU A 1 581 ? 64.353 -54.305 58.248 1.00 85.28 ? 592 LEU A N 1 ATOM 4130 C CA . LEU A 1 581 ? 65.548 -53.921 58.996 1.00 81.20 ? 592 LEU A CA 1 ATOM 4131 C C . LEU A 1 581 ? 65.459 -54.399 60.445 1.00 82.76 ? 592 LEU A C 1 ATOM 4132 O O . LEU A 1 581 ? 65.185 -53.613 61.350 1.00 88.05 ? 592 LEU A O 1 ATOM 4133 C CB . LEU A 1 581 ? 65.725 -52.401 58.964 1.00 75.89 ? 592 LEU A CB 1 ATOM 4134 C CG . LEU A 1 581 ? 67.003 -51.864 58.321 1.00 77.30 ? 592 LEU A CG 1 ATOM 4135 C CD1 . LEU A 1 581 ? 68.214 -52.638 58.822 1.00 81.95 ? 592 LEU A CD1 1 ATOM 4136 C CD2 . LEU A 1 581 ? 66.917 -51.915 56.808 1.00 74.78 ? 592 LEU A CD2 1 ATOM 4137 N N . GLY A 1 582 ? 65.691 -55.688 60.664 1.00 84.58 ? 593 GLY A N 1 ATOM 4138 C CA . GLY A 1 582 ? 65.503 -56.264 61.982 1.00 96.39 ? 593 GLY A CA 1 ATOM 4139 C C . GLY A 1 582 ? 64.050 -56.159 62.400 1.00 99.88 ? 593 GLY A C 1 ATOM 4140 O O . GLY A 1 582 ? 63.159 -56.246 61.560 1.00 103.65 ? 593 GLY A O 1 ATOM 4141 N N . ARG A 1 583 ? 63.804 -55.959 63.690 1.00 99.48 ? 594 ARG A N 1 ATOM 4142 C CA . ARG A 1 583 ? 62.439 -55.816 64.182 1.00 96.18 ? 594 ARG A CA 1 ATOM 4143 C C . ARG A 1 583 ? 62.107 -54.359 64.476 1.00 99.56 ? 594 ARG A C 1 ATOM 4144 O O . ARG A 1 583 ? 60.982 -54.036 64.860 1.00 106.71 ? 594 ARG A O 1 ATOM 4145 C CB . ARG A 1 583 ? 62.228 -56.649 65.444 1.00 92.77 ? 594 ARG A CB 1 ATOM 4146 C CG . ARG A 1 583 ? 62.772 -56.011 66.714 1.00 104.31 ? 594 ARG A CG 1 ATOM 4147 C CD . ARG A 1 583 ? 62.324 -56.796 67.938 1.00 111.54 ? 594 ARG A CD 1 ATOM 4148 N NE . ARG A 1 583 ? 62.769 -56.202 69.196 1.00 112.05 ? 594 ARG A NE 1 ATOM 4149 C CZ . ARG A 1 583 ? 63.945 -56.451 69.762 1.00 116.35 ? 594 ARG A CZ 1 ATOM 4150 N NH1 . ARG A 1 583 ? 64.801 -57.276 69.175 1.00 124.52 ? 594 ARG A NH1 1 ATOM 4151 N NH2 . ARG A 1 583 ? 64.269 -55.876 70.913 1.00 108.40 ? 594 ARG A NH2 1 ATOM 4152 N N . TRP A 1 584 ? 63.087 -53.482 64.286 1.00 90.31 ? 595 TRP A N 1 ATOM 4153 C CA . TRP A 1 584 ? 62.945 -52.082 64.674 1.00 94.19 ? 595 TRP A CA 1 ATOM 4154 C C . TRP A 1 584 ? 62.358 -51.177 63.585 1.00 102.45 ? 595 TRP A C 1 ATOM 4155 O O . TRP A 1 584 ? 61.764 -50.142 63.888 1.00 102.47 ? 595 TRP A O 1 ATOM 4156 C CB . TRP A 1 584 ? 64.284 -51.529 65.166 1.00 90.73 ? 595 TRP A CB 1 ATOM 4157 C CG . TRP A 1 584 ? 64.771 -52.190 66.423 1.00 96.42 ? 595 TRP A CG 1 ATOM 4158 C CD1 . TRP A 1 584 ? 65.823 -53.054 66.544 1.00 102.11 ? 595 TRP A CD1 1 ATOM 4159 C CD2 . TRP A 1 584 ? 64.216 -52.050 67.737 1.00 103.31 ? 595 TRP A CD2 1 ATOM 4160 N NE1 . TRP A 1 584 ? 65.961 -53.453 67.852 1.00 105.44 ? 595 TRP A NE1 1 ATOM 4161 C CE2 . TRP A 1 584 ? 64.986 -52.851 68.604 1.00 109.91 ? 595 TRP A CE2 1 ATOM 4162 C CE3 . TRP A 1 584 ? 63.145 -51.321 68.265 1.00 101.63 ? 595 TRP A CE3 1 ATOM 4163 C CZ2 . TRP A 1 584 ? 64.721 -52.942 69.968 1.00 110.19 ? 595 TRP A CZ2 1 ATOM 4164 C CZ3 . TRP A 1 584 ? 62.882 -51.415 69.619 1.00 108.48 ? 595 TRP A CZ3 1 ATOM 4165 C CH2 . TRP A 1 584 ? 63.666 -52.219 70.454 1.00 110.87 ? 595 TRP A CH2 1 ATOM 4166 N N . ALA A 1 585 ? 62.520 -51.566 62.324 1.00 101.22 ? 596 ALA A N 1 ATOM 4167 C CA . ALA A 1 585 ? 61.987 -50.774 61.221 1.00 96.03 ? 596 ALA A CA 1 ATOM 4168 C C . ALA A 1 585 ? 61.901 -51.571 59.927 1.00 86.71 ? 596 ALA A C 1 ATOM 4169 O O . ALA A 1 585 ? 62.621 -52.551 59.745 1.00 81.80 ? 596 ALA A O 1 ATOM 4170 C CB . ALA A 1 585 ? 62.832 -49.521 61.011 1.00 101.47 ? 596 ALA A CB 1 ATOM 4171 N N . ASP A 1 586 ? 61.005 -51.146 59.039 1.00 83.92 ? 597 ASP A N 1 ATOM 4172 C CA . ASP A 1 586 ? 60.960 -51.658 57.672 1.00 89.79 ? 597 ASP A CA 1 ATOM 4173 C C . ASP A 1 586 ? 61.069 -50.491 56.695 1.00 89.26 ? 597 ASP A C 1 ATOM 4174 O O . ASP A 1 586 ? 60.440 -49.448 56.885 1.00 85.68 ? 597 ASP A O 1 ATOM 4175 C CB . ASP A 1 586 ? 59.674 -52.445 57.407 1.00 86.64 ? 597 ASP A CB 1 ATOM 4176 C CG . ASP A 1 586 ? 59.421 -53.525 58.440 1.00 100.81 ? 597 ASP A CG 1 ATOM 4177 O OD1 . ASP A 1 586 ? 60.401 -54.106 58.954 1.00 112.48 ? 597 ASP A OD1 1 ATOM 4178 O OD2 . ASP A 1 586 ? 58.237 -53.796 58.737 1.00 99.64 ? 597 ASP A OD2 1 ATOM 4179 N N . VAL A 1 587 ? 61.877 -50.661 55.655 1.00 85.52 ? 598 VAL A N 1 ATOM 4180 C CA . VAL A 1 587 ? 62.071 -49.606 54.670 1.00 86.24 ? 598 VAL A CA 1 ATOM 4181 C C . VAL A 1 587 ? 61.799 -50.105 53.256 1.00 99.05 ? 598 VAL A C 1 ATOM 4182 O O . VAL A 1 587 ? 62.330 -51.132 52.834 1.00 98.45 ? 598 VAL A O 1 ATOM 4183 C CB . VAL A 1 587 ? 63.489 -49.012 54.749 1.00 80.90 ? 598 VAL A CB 1 ATOM 4184 C CG1 . VAL A 1 587 ? 63.766 -48.119 53.548 1.00 75.21 ? 598 VAL A CG1 1 ATOM 4185 C CG2 . VAL A 1 587 ? 63.659 -48.237 56.043 1.00 70.67 ? 598 VAL A CG2 1 ATOM 4186 N N . GLY A 1 588 ? 60.959 -49.371 52.533 1.00 101.56 ? 599 GLY A N 1 ATOM 4187 C CA . GLY A 1 588 ? 60.649 -49.700 51.157 1.00 97.38 ? 599 GLY A CA 1 ATOM 4188 C C . GLY A 1 588 ? 60.948 -48.549 50.216 1.00 95.21 ? 599 GLY A C 1 ATOM 4189 O O . GLY A 1 588 ? 60.912 -47.383 50.610 1.00 93.19 ? 599 GLY A O 1 ATOM 4190 N N . ALA A 1 589 ? 61.253 -48.885 48.968 1.00 95.16 ? 600 ALA A N 1 ATOM 4191 C CA . ALA A 1 589 ? 61.496 -47.891 47.933 1.00 91.65 ? 600 ALA A CA 1 ATOM 4192 C C . ALA A 1 589 ? 61.106 -48.462 46.577 1.00 86.99 ? 600 ALA A C 1 ATOM 4193 O O . ALA A 1 589 ? 61.124 -49.677 46.377 1.00 81.94 ? 600 ALA A O 1 ATOM 4194 C CB . ALA A 1 589 ? 62.954 -47.463 47.933 1.00 61.58 ? 600 ALA A CB 1 ATOM 4195 N N . GLY A 1 590 ? 60.751 -47.583 45.649 1.00 83.85 ? 601 GLY A N 1 ATOM 4196 C CA . GLY A 1 590 ? 60.343 -48.010 44.325 1.00 76.86 ? 601 GLY A CA 1 ATOM 4197 C C . GLY A 1 590 ? 60.732 -47.009 43.259 1.00 74.21 ? 601 GLY A C 1 ATOM 4198 O O . GLY A 1 590 ? 60.772 -45.802 43.509 1.00 62.67 ? 601 GLY A O 1 ATOM 4199 N N . LEU A 1 591 ? 61.019 -47.518 42.065 1.00 79.62 ? 602 LEU A N 1 ATOM 4200 C CA . LEU A 1 591 ? 61.379 -46.675 40.931 1.00 75.13 ? 602 LEU A CA 1 ATOM 4201 C C . LEU A 1 591 ? 60.677 -47.170 39.664 1.00 77.58 ? 602 LEU A C 1 ATOM 4202 O O . LEU A 1 591 ? 60.533 -48.375 39.458 1.00 76.76 ? 602 LEU A O 1 ATOM 4203 C CB . LEU A 1 591 ? 62.896 -46.668 40.748 1.00 60.07 ? 602 LEU A CB 1 ATOM 4204 C CG . LEU A 1 591 ? 63.488 -45.695 39.733 1.00 77.67 ? 602 LEU A CG 1 ATOM 4205 C CD1 . LEU A 1 591 ? 62.889 -44.314 39.916 1.00 86.50 ? 602 LEU A CD1 1 ATOM 4206 C CD2 . LEU A 1 591 ? 64.999 -45.644 39.883 1.00 73.48 ? 602 LEU A CD2 1 ATOM 4207 N N . ARG A 1 592 ? 60.229 -46.242 38.823 1.00 71.07 ? 603 ARG A N 1 ATOM 4208 C CA . ARG A 1 592 ? 59.512 -46.617 37.606 1.00 64.70 ? 603 ARG A CA 1 ATOM 4209 C C . ARG A 1 592 ? 59.705 -45.631 36.451 1.00 75.38 ? 603 ARG A C 1 ATOM 4210 O O . ARG A 1 592 ? 59.723 -44.415 36.649 1.00 87.04 ? 603 ARG A O 1 ATOM 4211 C CB . ARG A 1 592 ? 58.020 -46.799 37.897 1.00 56.84 ? 603 ARG A CB 1 ATOM 4212 C CG . ARG A 1 592 ? 57.211 -47.204 36.681 1.00 52.25 ? 603 ARG A CG 1 ATOM 4213 C CD . ARG A 1 592 ? 55.769 -47.513 37.025 1.00 57.81 ? 603 ARG A CD 1 ATOM 4214 N NE . ARG A 1 592 ? 54.985 -47.753 35.819 1.00 64.75 ? 603 ARG A NE 1 ATOM 4215 C CZ . ARG A 1 592 ? 53.717 -48.145 35.816 1.00 74.54 ? 603 ARG A CZ 1 ATOM 4216 N NH1 . ARG A 1 592 ? 53.085 -48.353 36.962 1.00 79.86 ? 603 ARG A NH1 1 ATOM 4217 N NH2 . ARG A 1 592 ? 53.083 -48.333 34.667 1.00 80.77 ? 603 ARG A NH2 1 ATOM 4218 N N . TYR A 1 593 ? 59.846 -46.175 35.245 1.00 73.41 ? 604 TYR A N 1 ATOM 4219 C CA . TYR A 1 593 ? 59.983 -45.378 34.034 1.00 74.23 ? 604 TYR A CA 1 ATOM 4220 C C . TYR A 1 593 ? 58.799 -45.657 33.121 1.00 74.66 ? 604 TYR A C 1 ATOM 4221 O O . TYR A 1 593 ? 58.440 -46.812 32.906 1.00 77.52 ? 604 TYR A O 1 ATOM 4222 C CB . TYR A 1 593 ? 61.279 -45.749 33.316 1.00 77.38 ? 604 TYR A CB 1 ATOM 4223 C CG . TYR A 1 593 ? 61.662 -44.826 32.179 1.00 80.93 ? 604 TYR A CG 1 ATOM 4224 C CD1 . TYR A 1 593 ? 62.408 -43.680 32.416 1.00 90.87 ? 604 TYR A CD1 1 ATOM 4225 C CD2 . TYR A 1 593 ? 61.299 -45.113 30.867 1.00 73.17 ? 604 TYR A CD2 1 ATOM 4226 C CE1 . TYR A 1 593 ? 62.773 -42.836 31.382 1.00 94.26 ? 604 TYR A CE1 1 ATOM 4227 C CE2 . TYR A 1 593 ? 61.659 -44.274 29.824 1.00 68.74 ? 604 TYR A CE2 1 ATOM 4228 C CZ . TYR A 1 593 ? 62.397 -43.136 30.090 1.00 80.47 ? 604 TYR A CZ 1 ATOM 4229 O OH . TYR A 1 593 ? 62.769 -42.288 29.071 1.00 78.54 ? 604 TYR A OH 1 ATOM 4230 N N . ASP A 1 594 ? 58.188 -44.604 32.588 1.00 69.04 ? 605 ASP A N 1 ATOM 4231 C CA . ASP A 1 594 ? 57.061 -44.769 31.674 1.00 61.13 ? 605 ASP A CA 1 ATOM 4232 C C . ASP A 1 594 ? 57.283 -44.048 30.354 1.00 63.61 ? 605 ASP A C 1 ATOM 4233 O O . ASP A 1 594 ? 57.646 -42.875 30.339 1.00 61.69 ? 605 ASP A O 1 ATOM 4234 C CB . ASP A 1 594 ? 55.762 -44.272 32.312 1.00 65.36 ? 605 ASP A CB 1 ATOM 4235 C CG . ASP A 1 594 ? 55.134 -45.299 33.226 1.00 78.60 ? 605 ASP A CG 1 ATOM 4236 O OD1 . ASP A 1 594 ? 54.260 -46.063 32.756 1.00 46.81 ? 605 ASP A OD1 1 ATOM 4237 O OD2 . ASP A 1 594 ? 55.518 -45.341 34.415 1.00 85.33 ? 605 ASP A OD2 1 ATOM 4238 N N . TYR A 1 595 ? 57.057 -44.761 29.252 1.00 65.64 ? 606 TYR A N 1 ATOM 4239 C CA . TYR A 1 595 ? 57.114 -44.190 27.908 1.00 62.18 ? 606 TYR A CA 1 ATOM 4240 C C . TYR A 1 595 ? 55.740 -44.311 27.256 1.00 60.50 ? 606 TYR A C 1 ATOM 4241 O O . TYR A 1 595 ? 55.039 -45.302 27.457 1.00 73.50 ? 606 TYR A O 1 ATOM 4242 C CB . TYR A 1 595 ? 58.158 -44.935 27.070 1.00 65.40 ? 606 TYR A CB 1 ATOM 4243 C CG . TYR A 1 595 ? 58.262 -44.497 25.622 1.00 64.54 ? 606 TYR A CG 1 ATOM 4244 C CD1 . TYR A 1 595 ? 59.197 -43.550 25.229 1.00 69.33 ? 606 TYR A CD1 1 ATOM 4245 C CD2 . TYR A 1 595 ? 57.441 -45.047 24.643 1.00 68.50 ? 606 TYR A CD2 1 ATOM 4246 C CE1 . TYR A 1 595 ? 59.303 -43.151 23.905 1.00 64.57 ? 606 TYR A CE1 1 ATOM 4247 C CE2 . TYR A 1 595 ? 57.538 -44.652 23.318 1.00 73.00 ? 606 TYR A CE2 1 ATOM 4248 C CZ . TYR A 1 595 ? 58.472 -43.705 22.954 1.00 70.44 ? 606 TYR A CZ 1 ATOM 4249 O OH . TYR A 1 595 ? 58.575 -43.309 21.637 1.00 66.27 ? 606 TYR A OH 1 ATOM 4250 N N A ARG A 1 596 ? 55.364 -43.302 26.481 0.68 61.70 ? 607 ARG A N 1 ATOM 4251 N N B ARG A 1 596 ? 55.353 -43.309 26.471 0.32 61.75 ? 607 ARG A N 1 ATOM 4252 C CA A ARG A 1 596 ? 54.104 -43.337 25.757 0.68 57.79 ? 607 ARG A CA 1 ATOM 4253 C CA B ARG A 1 596 ? 54.068 -43.345 25.768 0.32 57.20 ? 607 ARG A CA 1 ATOM 4254 C C A ARG A 1 596 ? 54.215 -42.540 24.468 0.68 64.97 ? 607 ARG A C 1 ATOM 4255 C C B ARG A 1 596 ? 54.082 -42.513 24.490 0.32 64.72 ? 607 ARG A C 1 ATOM 4256 O O A ARG A 1 596 ? 54.629 -41.379 24.477 0.68 72.90 ? 607 ARG A O 1 ATOM 4257 O O B ARG A 1 596 ? 54.287 -41.298 24.530 0.32 72.83 ? 607 ARG A O 1 ATOM 4258 C CB A ARG A 1 596 ? 52.972 -42.779 26.616 0.68 52.14 ? 607 ARG A CB 1 ATOM 4259 C CB B ARG A 1 596 ? 52.940 -42.865 26.681 0.32 51.77 ? 607 ARG A CB 1 ATOM 4260 C CG A ARG A 1 596 ? 51.584 -43.042 26.052 0.68 43.69 ? 607 ARG A CG 1 ATOM 4261 C CG B ARG A 1 596 ? 51.606 -42.627 25.974 0.32 52.90 ? 607 ARG A CG 1 ATOM 4262 C CD A ARG A 1 596 ? 50.714 -41.805 26.152 0.68 52.34 ? 607 ARG A CD 1 ATOM 4263 C CD B ARG A 1 596 ? 50.835 -41.519 26.693 0.32 54.11 ? 607 ARG A CD 1 ATOM 4264 N NE A ARG A 1 596 ? 49.347 -42.113 26.552 0.68 40.45 ? 607 ARG A NE 1 ATOM 4265 N NE B ARG A 1 596 ? 50.281 -40.483 25.812 0.32 54.90 ? 607 ARG A NE 1 ATOM 4266 C CZ A ARG A 1 596 ? 48.387 -41.204 26.670 0.68 39.11 ? 607 ARG A CZ 1 ATOM 4267 C CZ B ARG A 1 596 ? 50.990 -39.692 25.001 0.32 63.95 ? 607 ARG A CZ 1 ATOM 4268 N NH1 A ARG A 1 596 ? 48.637 -39.930 26.411 0.68 39.21 ? 607 ARG A NH1 1 ATOM 4269 N NH1 B ARG A 1 596 ? 52.309 -39.811 24.912 0.32 44.47 ? 607 ARG A NH1 1 ATOM 4270 N NH2 A ARG A 1 596 ? 47.173 -41.571 27.042 0.68 60.98 ? 607 ARG A NH2 1 ATOM 4271 N NH2 B ARG A 1 596 ? 50.373 -38.780 24.256 0.32 59.74 ? 607 ARG A NH2 1 ATOM 4272 N N . SER A 1 597 ? 53.847 -43.173 23.361 1.00 64.52 ? 608 SER A N 1 ATOM 4273 C CA . SER A 1 597 ? 53.841 -42.509 22.062 1.00 59.57 ? 608 SER A CA 1 ATOM 4274 C C . SER A 1 597 ? 52.450 -42.573 21.441 1.00 58.09 ? 608 SER A C 1 ATOM 4275 O O . SER A 1 597 ? 51.834 -43.632 21.428 1.00 62.51 ? 608 SER A O 1 ATOM 4276 C CB . SER A 1 597 ? 54.859 -43.170 21.133 1.00 64.19 ? 608 SER A CB 1 ATOM 4277 O OG . SER A 1 597 ? 54.657 -42.788 19.784 1.00 85.67 ? 608 SER A OG 1 ATOM 4278 N N . THR A 1 598 ? 51.961 -41.444 20.927 1.00 52.70 ? 609 THR A N 1 ATOM 4279 C CA . THR A 1 598 ? 50.626 -41.387 20.327 1.00 54.12 ? 609 THR A CA 1 ATOM 4280 C C . THR A 1 598 ? 50.627 -40.814 18.914 1.00 62.69 ? 609 THR A C 1 ATOM 4281 O O . THR A 1 598 ? 51.440 -39.951 18.588 1.00 70.00 ? 609 THR A O 1 ATOM 4282 C CB . THR A 1 598 ? 49.658 -40.550 21.177 1.00 54.21 ? 609 THR A CB 1 ATOM 4283 O OG1 . THR A 1 598 ? 50.280 -39.306 21.527 1.00 67.57 ? 609 THR A OG1 1 ATOM 4284 C CG2 . THR A 1 598 ? 49.282 -41.299 22.439 1.00 51.15 ? 609 THR A CG2 1 ATOM 4285 N N . HIS A 1 599 ? 49.705 -41.297 18.085 1.00 45.15 ? 610 HIS A N 1 ATOM 4286 C CA . HIS A 1 599 ? 49.532 -40.784 16.728 1.00 52.35 ? 610 HIS A CA 1 ATOM 4287 C C . HIS A 1 599 ? 48.061 -40.610 16.358 1.00 43.88 ? 610 HIS A C 1 ATOM 4288 O O . HIS A 1 599 ? 47.204 -41.377 16.796 1.00 68.60 ? 610 HIS A O 1 ATOM 4289 C CB . HIS A 1 599 ? 50.204 -41.695 15.700 1.00 48.19 ? 610 HIS A CB 1 ATOM 4290 C CG . HIS A 1 599 ? 49.955 -41.279 14.282 1.00 150.94 ? 610 HIS A CG 1 ATOM 4291 N ND1 . HIS A 1 599 ? 50.565 -40.182 13.710 1.00 149.19 ? 610 HIS A ND1 1 ATOM 4292 C CD2 . HIS A 1 599 ? 49.143 -41.796 13.329 1.00 145.64 ? 610 HIS A CD2 1 ATOM 4293 C CE1 . HIS A 1 599 ? 50.150 -40.050 12.462 1.00 143.75 ? 610 HIS A CE1 1 ATOM 4294 N NE2 . HIS A 1 599 ? 49.286 -41.016 12.206 1.00 142.38 ? 610 HIS A NE2 1 ATOM 4295 N N . SER A 1 600 ? 47.776 -39.593 15.551 1.00 58.87 ? 611 SER A N 1 ATOM 4296 C CA . SER A 1 600 ? 46.448 -39.420 14.963 1.00 42.42 ? 611 SER A CA 1 ATOM 4297 C C . SER A 1 600 ? 46.568 -38.930 13.531 1.00 56.36 ? 611 SER A C 1 ATOM 4298 O O . SER A 1 600 ? 47.480 -38.171 13.200 1.00 52.91 ? 611 SER A O 1 ATOM 4299 C CB . SER A 1 600 ? 45.611 -38.430 15.767 1.00 50.16 ? 611 SER A CB 1 ATOM 4300 O OG . SER A 1 600 ? 44.349 -38.230 15.158 1.00 51.75 ? 611 SER A OG 1 ATOM 4301 N N . ASP A 1 601 ? 45.647 -39.371 12.683 1.00 47.38 ? 612 ASP A N 1 ATOM 4302 C CA . ASP A 1 601 ? 45.588 -38.888 11.315 1.00 58.96 ? 612 ASP A CA 1 ATOM 4303 C C . ASP A 1 601 ? 45.302 -37.393 11.333 1.00 55.05 ? 612 ASP A C 1 ATOM 4304 O O . ASP A 1 601 ? 45.823 -36.641 10.510 1.00 74.40 ? 612 ASP A O 1 ATOM 4305 C CB . ASP A 1 601 ? 44.510 -39.639 10.535 1.00 70.30 ? 612 ASP A CB 1 ATOM 4306 C CG . ASP A 1 601 ? 44.990 -40.989 10.032 1.00 78.36 ? 612 ASP A CG 1 ATOM 4307 O OD1 . ASP A 1 601 ? 44.202 -41.683 9.352 1.00 77.31 ? 612 ASP A OD1 1 ATOM 4308 O OD2 . ASP A 1 601 ? 46.157 -41.349 10.305 1.00 71.92 ? 612 ASP A OD2 1 ATOM 4309 N N . ASP A 1 602 ? 44.481 -36.979 12.295 1.00 46.76 ? 613 ASP A N 1 ATOM 4310 C CA . ASP A 1 602 ? 44.127 -35.578 12.504 1.00 47.76 ? 613 ASP A CA 1 ATOM 4311 C C . ASP A 1 602 ? 45.318 -34.793 13.049 1.00 45.57 ? 613 ASP A C 1 ATOM 4312 O O . ASP A 1 602 ? 45.773 -35.031 14.168 1.00 45.45 ? 613 ASP A O 1 ATOM 4313 C CB . ASP A 1 602 ? 42.955 -35.488 13.483 1.00 49.70 ? 613 ASP A CB 1 ATOM 4314 C CG . ASP A 1 602 ? 42.343 -34.101 13.549 1.00 64.62 ? 613 ASP A CG 1 ATOM 4315 O OD1 . ASP A 1 602 ? 41.139 -34.014 13.884 1.00 63.90 ? 613 ASP A OD1 1 ATOM 4316 O OD2 . ASP A 1 602 ? 43.053 -33.106 13.269 1.00 60.58 ? 613 ASP A OD2 1 ATOM 4317 N N . GLY A 1 603 ? 45.804 -33.843 12.257 1.00 49.81 ? 614 GLY A N 1 ATOM 4318 C CA . GLY A 1 603 ? 46.973 -33.065 12.618 1.00 50.61 ? 614 GLY A CA 1 ATOM 4319 C C . GLY A 1 603 ? 46.719 -32.079 13.741 1.00 58.45 ? 614 GLY A C 1 ATOM 4320 O O . GLY A 1 603 ? 47.656 -31.523 14.313 1.00 65.43 ? 614 GLY A O 1 ATOM 4321 N N . SER A 1 604 ? 45.449 -31.868 14.069 1.00 56.59 ? 615 SER A N 1 ATOM 4322 C CA . SER A 1 604 ? 45.090 -30.907 15.102 1.00 64.19 ? 615 SER A CA 1 ATOM 4323 C C . SER A 1 604 ? 45.039 -31.516 16.502 1.00 62.14 ? 615 SER A C 1 ATOM 4324 O O . SER A 1 604 ? 44.916 -30.796 17.492 1.00 69.08 ? 615 SER A O 1 ATOM 4325 C CB . SER A 1 604 ? 43.763 -30.236 14.759 1.00 59.30 ? 615 SER A CB 1 ATOM 4326 O OG . SER A 1 604 ? 43.884 -29.505 13.553 1.00 57.44 ? 615 SER A OG 1 ATOM 4327 N N . VAL A 1 605 ? 45.136 -32.840 16.578 1.00 46.94 ? 616 VAL A N 1 ATOM 4328 C CA . VAL A 1 605 ? 45.170 -33.537 17.863 1.00 50.78 ? 616 VAL A CA 1 ATOM 4329 C C . VAL A 1 605 ? 46.537 -33.416 18.545 1.00 54.03 ? 616 VAL A C 1 ATOM 4330 O O . VAL A 1 605 ? 47.573 -33.641 17.920 1.00 46.49 ? 616 VAL A O 1 ATOM 4331 C CB . VAL A 1 605 ? 44.825 -35.024 17.690 1.00 41.44 ? 616 VAL A CB 1 ATOM 4332 C CG1 . VAL A 1 605 ? 44.972 -35.755 19.006 1.00 40.47 ? 616 VAL A CG1 1 ATOM 4333 C CG2 . VAL A 1 605 ? 43.416 -35.177 17.136 1.00 45.94 ? 616 VAL A CG2 1 ATOM 4334 N N . SER A 1 606 ? 46.538 -33.054 19.826 1.00 57.85 ? 617 SER A N 1 ATOM 4335 C CA . SER A 1 606 ? 47.783 -32.896 20.576 1.00 60.47 ? 617 SER A CA 1 ATOM 4336 C C . SER A 1 606 ? 48.471 -34.237 20.793 1.00 62.23 ? 617 SER A C 1 ATOM 4337 O O . SER A 1 606 ? 48.209 -34.939 21.767 1.00 57.55 ? 617 SER A O 1 ATOM 4338 C CB . SER A 1 606 ? 47.527 -32.202 21.911 1.00 76.09 ? 617 SER A CB 1 ATOM 4339 O OG . SER A 1 606 ? 47.144 -30.853 21.705 1.00 97.56 ? 617 SER A OG 1 ATOM 4340 N N . THR A 1 607 ? 49.369 -34.567 19.875 1.00 70.95 ? 618 THR A N 1 ATOM 4341 C CA . THR A 1 607 ? 49.956 -35.894 19.786 1.00 63.47 ? 618 THR A CA 1 ATOM 4342 C C . THR A 1 607 ? 51.466 -35.827 20.012 1.00 74.63 ? 618 THR A C 1 ATOM 4343 O O . THR A 1 607 ? 52.111 -34.854 19.618 1.00 90.15 ? 618 THR A O 1 ATOM 4344 C CB . THR A 1 607 ? 49.634 -36.505 18.398 1.00 60.60 ? 618 THR A CB 1 ATOM 4345 O OG1 . THR A 1 607 ? 48.718 -37.594 18.550 1.00 57.34 ? 618 THR A OG1 1 ATOM 4346 C CG2 . THR A 1 607 ? 50.894 -36.973 17.668 1.00 64.18 ? 618 THR A CG2 1 ATOM 4347 N N . GLY A 1 608 ? 52.030 -36.845 20.660 1.00 62.23 ? 619 GLY A N 1 ATOM 4348 C CA . GLY A 1 608 ? 53.466 -36.870 20.876 1.00 54.45 ? 619 GLY A CA 1 ATOM 4349 C C . GLY A 1 608 ? 54.007 -37.960 21.781 1.00 58.30 ? 619 GLY A C 1 ATOM 4350 O O . GLY A 1 608 ? 53.349 -38.970 22.034 1.00 70.32 ? 619 GLY A O 1 ATOM 4351 N N . THR A 1 609 ? 55.224 -37.739 22.268 1.00 59.32 ? 620 THR A N 1 ATOM 4352 C CA . THR A 1 609 ? 55.928 -38.699 23.110 1.00 69.87 ? 620 THR A CA 1 ATOM 4353 C C . THR A 1 609 ? 56.054 -38.182 24.542 1.00 68.62 ? 620 THR A C 1 ATOM 4354 O O . THR A 1 609 ? 56.362 -37.010 24.760 1.00 74.55 ? 620 THR A O 1 ATOM 4355 C CB . THR A 1 609 ? 57.349 -38.970 22.554 1.00 72.66 ? 620 THR A CB 1 ATOM 4356 O OG1 . THR A 1 609 ? 57.258 -39.614 21.277 1.00 70.02 ? 620 THR A OG1 1 ATOM 4357 C CG2 . THR A 1 609 ? 58.146 -39.849 23.498 1.00 74.23 ? 620 THR A CG2 1 ATOM 4358 N N . HIS A 1 610 ? 55.804 -39.054 25.514 1.00 71.29 ? 621 HIS A N 1 ATOM 4359 C CA . HIS A 1 610 ? 56.058 -38.729 26.918 1.00 72.15 ? 621 HIS A CA 1 ATOM 4360 C C . HIS A 1 610 ? 56.989 -39.748 27.569 1.00 76.36 ? 621 HIS A C 1 ATOM 4361 O O . HIS A 1 610 ? 56.846 -40.956 27.366 1.00 73.56 ? 621 HIS A O 1 ATOM 4362 C CB . HIS A 1 610 ? 54.755 -38.673 27.720 1.00 59.92 ? 621 HIS A CB 1 ATOM 4363 C CG . HIS A 1 610 ? 53.877 -37.512 27.380 1.00 62.24 ? 621 HIS A CG 1 ATOM 4364 N ND1 . HIS A 1 610 ? 52.720 -37.646 26.644 1.00 57.37 ? 621 HIS A ND1 1 ATOM 4365 C CD2 . HIS A 1 610 ? 53.978 -36.198 27.686 1.00 58.15 ? 621 HIS A CD2 1 ATOM 4366 C CE1 . HIS A 1 610 ? 52.149 -36.464 26.505 1.00 51.39 ? 621 HIS A CE1 1 ATOM 4367 N NE2 . HIS A 1 610 ? 52.892 -35.568 27.128 1.00 62.23 ? 621 HIS A NE2 1 ATOM 4368 N N . ARG A 1 611 ? 57.942 -39.260 28.354 1.00 76.79 ? 622 ARG A N 1 ATOM 4369 C CA . ARG A 1 611 ? 58.731 -40.136 29.214 1.00 81.59 ? 622 ARG A CA 1 ATOM 4370 C C . ARG A 1 611 ? 58.850 -39.551 30.619 1.00 78.48 ? 622 ARG A C 1 ATOM 4371 O O . ARG A 1 611 ? 59.541 -38.558 30.835 1.00 84.96 ? 622 ARG A O 1 ATOM 4372 C CB . ARG A 1 611 ? 60.105 -40.451 28.608 1.00 80.49 ? 622 ARG A CB 1 ATOM 4373 C CG . ARG A 1 611 ? 60.820 -39.268 27.990 1.00 94.92 ? 622 ARG A CG 1 ATOM 4374 C CD . ARG A 1 611 ? 61.028 -39.480 26.502 1.00 99.53 ? 622 ARG A CD 1 ATOM 4375 N NE . ARG A 1 611 ? 61.748 -40.717 26.214 1.00 96.88 ? 622 ARG A NE 1 ATOM 4376 C CZ . ARG A 1 611 ? 62.102 -41.104 24.992 1.00 99.50 ? 622 ARG A CZ 1 ATOM 4377 N NH1 . ARG A 1 611 ? 61.802 -40.347 23.942 1.00 100.99 ? 622 ARG A NH1 1 ATOM 4378 N NH2 . ARG A 1 611 ? 62.754 -42.246 24.818 1.00 88.70 ? 622 ARG A NH2 1 ATOM 4379 N N . THR A 1 612 ? 58.153 -40.169 31.567 1.00 74.71 ? 623 THR A N 1 ATOM 4380 C CA . THR A 1 612 ? 58.118 -39.677 32.939 1.00 71.74 ? 623 THR A CA 1 ATOM 4381 C C . THR A 1 612 ? 58.854 -40.620 33.889 1.00 80.76 ? 623 THR A C 1 ATOM 4382 O O . THR A 1 612 ? 59.053 -41.796 33.585 1.00 86.72 ? 623 THR A O 1 ATOM 4383 C CB . THR A 1 612 ? 56.669 -39.489 33.433 1.00 70.53 ? 623 THR A CB 1 ATOM 4384 O OG1 . THR A 1 612 ? 56.081 -40.766 33.705 1.00 84.84 ? 623 THR A OG1 1 ATOM 4385 C CG2 . THR A 1 612 ? 55.837 -38.776 32.388 1.00 76.51 ? 623 THR A CG2 1 ATOM 4386 N N . LEU A 1 613 ? 59.256 -40.092 35.039 1.00 81.06 ? 624 LEU A N 1 ATOM 4387 C CA . LEU A 1 613 ? 59.950 -40.876 36.051 1.00 70.71 ? 624 LEU A CA 1 ATOM 4388 C C . LEU A 1 613 ? 59.158 -40.853 37.353 1.00 69.38 ? 624 LEU A C 1 ATOM 4389 O O . LEU A 1 613 ? 58.848 -39.785 37.878 1.00 75.26 ? 624 LEU A O 1 ATOM 4390 C CB . LEU A 1 613 ? 61.350 -40.309 36.278 1.00 72.24 ? 624 LEU A CB 1 ATOM 4391 C CG . LEU A 1 613 ? 62.295 -41.073 37.202 1.00 78.75 ? 624 LEU A CG 1 ATOM 4392 C CD1 . LEU A 1 613 ? 62.533 -42.479 36.676 1.00 88.83 ? 624 LEU A CD1 1 ATOM 4393 C CD2 . LEU A 1 613 ? 63.610 -40.321 37.343 1.00 65.94 ? 624 LEU A CD2 1 ATOM 4394 N N . SER A 1 614 ? 58.818 -42.030 37.865 1.00 66.32 ? 625 SER A N 1 ATOM 4395 C CA . SER A 1 614 ? 58.066 -42.126 39.114 1.00 68.15 ? 625 SER A CA 1 ATOM 4396 C C . SER A 1 614 ? 58.889 -42.830 40.191 1.00 73.34 ? 625 SER A C 1 ATOM 4397 O O . SER A 1 614 ? 59.635 -43.767 39.901 1.00 76.44 ? 625 SER A O 1 ATOM 4398 C CB . SER A 1 614 ? 56.742 -42.868 38.899 1.00 61.11 ? 625 SER A CB 1 ATOM 4399 O OG . SER A 1 614 ? 55.887 -42.173 38.010 1.00 58.58 ? 625 SER A OG 1 ATOM 4400 N N . TRP A 1 615 ? 58.753 -42.380 41.433 1.00 67.38 ? 626 TRP A N 1 ATOM 4401 C CA . TRP A 1 615 ? 59.490 -42.992 42.532 1.00 73.67 ? 626 TRP A CA 1 ATOM 4402 C C . TRP A 1 615 ? 58.766 -42.855 43.866 1.00 79.35 ? 626 TRP A C 1 ATOM 4403 O O . TRP A 1 615 ? 58.076 -41.865 44.107 1.00 84.19 ? 626 TRP A O 1 ATOM 4404 C CB . TRP A 1 615 ? 60.896 -42.397 42.631 1.00 65.61 ? 626 TRP A CB 1 ATOM 4405 C CG . TRP A 1 615 ? 60.931 -40.973 43.099 1.00 79.40 ? 626 TRP A CG 1 ATOM 4406 C CD1 . TRP A 1 615 ? 60.887 -39.854 42.322 1.00 88.95 ? 626 TRP A CD1 1 ATOM 4407 C CD2 . TRP A 1 615 ? 61.036 -40.516 44.454 1.00 91.52 ? 626 TRP A CD2 1 ATOM 4408 N NE1 . TRP A 1 615 ? 60.952 -38.729 43.107 1.00 88.48 ? 626 TRP A NE1 1 ATOM 4409 C CE2 . TRP A 1 615 ? 61.042 -39.108 44.420 1.00 92.32 ? 626 TRP A CE2 1 ATOM 4410 C CE3 . TRP A 1 615 ? 61.121 -41.161 45.693 1.00 102.84 ? 626 TRP A CE3 1 ATOM 4411 C CZ2 . TRP A 1 615 ? 61.131 -38.335 45.575 1.00 102.09 ? 626 TRP A CZ2 1 ATOM 4412 C CZ3 . TRP A 1 615 ? 61.209 -40.391 46.838 1.00 102.34 ? 626 TRP A CZ3 1 ATOM 4413 C CH2 . TRP A 1 615 ? 61.218 -38.994 46.770 1.00 102.51 ? 626 TRP A CH2 1 ATOM 4414 N N . ASN A 1 616 ? 58.917 -43.859 44.728 1.00 72.99 ? 627 ASN A N 1 ATOM 4415 C CA . ASN A 1 616 ? 58.357 -43.783 46.076 1.00 81.67 ? 627 ASN A CA 1 ATOM 4416 C C . ASN A 1 616 ? 59.274 -44.338 47.166 1.00 85.13 ? 627 ASN A C 1 ATOM 4417 O O . ASN A 1 616 ? 60.180 -45.128 46.895 1.00 75.52 ? 627 ASN A O 1 ATOM 4418 C CB . ASN A 1 616 ? 56.946 -44.400 46.156 1.00 73.78 ? 627 ASN A CB 1 ATOM 4419 C CG . ASN A 1 616 ? 56.933 -45.909 45.945 1.00 70.70 ? 627 ASN A CG 1 ATOM 4420 O OD1 . ASN A 1 616 ? 57.972 -46.565 45.926 1.00 81.13 ? 627 ASN A OD1 1 ATOM 4421 N ND2 . ASN A 1 616 ? 55.735 -46.467 45.798 1.00 65.79 ? 627 ASN A ND2 1 ATOM 4422 N N . ALA A 1 617 ? 59.032 -43.907 48.398 1.00 89.97 ? 628 ALA A N 1 ATOM 4423 C CA . ALA A 1 617 ? 59.837 -44.344 49.531 1.00 89.87 ? 628 ALA A CA 1 ATOM 4424 C C . ALA A 1 617 ? 59.057 -44.206 50.827 1.00 84.52 ? 628 ALA A C 1 ATOM 4425 O O . ALA A 1 617 ? 58.317 -43.243 51.028 1.00 73.58 ? 628 ALA A O 1 ATOM 4426 C CB . ALA A 1 617 ? 61.137 -43.555 49.605 1.00 59.61 ? 628 ALA A CB 1 ATOM 4427 N N . GLY A 1 618 ? 59.225 -45.179 51.709 1.00 91.18 ? 629 GLY A N 1 ATOM 4428 C CA . GLY A 1 618 ? 58.502 -45.176 52.960 1.00 95.40 ? 629 GLY A CA 1 ATOM 4429 C C . GLY A 1 618 ? 59.309 -45.815 54.062 1.00 90.43 ? 629 GLY A C 1 ATOM 4430 O O . GLY A 1 618 ? 60.204 -46.621 53.810 1.00 95.48 ? 629 GLY A O 1 ATOM 4431 N N . ILE A 1 619 ? 58.986 -45.448 55.294 1.00 84.89 ? 630 ILE A N 1 ATOM 4432 C CA . ILE A 1 619 ? 59.642 -46.021 56.453 1.00 80.73 ? 630 ILE A CA 1 ATOM 4433 C C . ILE A 1 619 ? 58.611 -46.295 57.538 1.00 73.32 ? 630 ILE A C 1 ATOM 4434 O O . ILE A 1 619 ? 57.658 -45.534 57.725 1.00 65.61 ? 630 ILE A O 1 ATOM 4435 C CB . ILE A 1 619 ? 60.755 -45.091 56.987 1.00 81.00 ? 630 ILE A CB 1 ATOM 4436 C CG1 . ILE A 1 619 ? 61.547 -45.780 58.101 1.00 77.66 ? 630 ILE A CG1 1 ATOM 4437 C CG2 . ILE A 1 619 ? 60.175 -43.764 57.460 1.00 66.61 ? 630 ILE A CG2 1 ATOM 4438 C CD1 . ILE A 1 619 ? 62.618 -44.909 58.715 1.00 72.07 ? 630 ILE A CD1 1 ATOM 4439 N N . VAL A 1 620 ? 58.781 -47.408 58.234 1.00 76.01 ? 631 VAL A N 1 ATOM 4440 C CA . VAL A 1 620 ? 57.956 -47.678 59.396 1.00 88.61 ? 631 VAL A CA 1 ATOM 4441 C C . VAL A 1 620 ? 58.819 -47.975 60.617 1.00 88.45 ? 631 VAL A C 1 ATOM 4442 O O . VAL A 1 620 ? 59.256 -49.106 60.827 1.00 90.02 ? 631 VAL A O 1 ATOM 4443 C CB . VAL A 1 620 ? 56.943 -48.807 59.138 1.00 94.24 ? 631 VAL A CB 1 ATOM 4444 C CG1 . VAL A 1 620 ? 55.690 -48.246 58.510 1.00 92.94 ? 631 VAL A CG1 1 ATOM 4445 C CG2 . VAL A 1 620 ? 57.542 -49.857 58.239 1.00 99.53 ? 631 VAL A CG2 1 ATOM 4446 N N . LEU A 1 621 ? 59.066 -46.938 61.414 1.00 82.60 ? 632 LEU A N 1 ATOM 4447 C CA . LEU A 1 621 ? 59.810 -47.085 62.658 1.00 86.21 ? 632 LEU A CA 1 ATOM 4448 C C . LEU A 1 621 ? 58.973 -47.804 63.704 1.00 91.57 ? 632 LEU A C 1 ATOM 4449 O O . LEU A 1 621 ? 57.833 -47.426 63.973 1.00 90.97 ? 632 LEU A O 1 ATOM 4450 C CB . LEU A 1 621 ? 60.247 -45.723 63.200 1.00 75.09 ? 632 LEU A CB 1 ATOM 4451 C CG . LEU A 1 621 ? 61.386 -45.023 62.459 1.00 95.46 ? 632 LEU A CG 1 ATOM 4452 C CD1 . LEU A 1 621 ? 61.821 -43.766 63.205 1.00 87.68 ? 632 LEU A CD1 1 ATOM 4453 C CD2 . LEU A 1 621 ? 62.558 -45.975 62.260 1.00 99.78 ? 632 LEU A CD2 1 ATOM 4454 N N . LYS A 1 622 ? 59.548 -48.847 64.289 1.00 97.63 ? 633 LYS A N 1 ATOM 4455 C CA . LYS A 1 622 ? 58.876 -49.594 65.340 1.00 95.38 ? 633 LYS A CA 1 ATOM 4456 C C . LYS A 1 622 ? 59.733 -49.665 66.600 1.00 94.36 ? 633 LYS A C 1 ATOM 4457 O O . LYS A 1 622 ? 60.424 -50.659 66.826 1.00 102.07 ? 633 LYS A O 1 ATOM 4458 C CB . LYS A 1 622 ? 58.520 -51.001 64.849 1.00 87.01 ? 633 LYS A CB 1 ATOM 4459 C CG . LYS A 1 622 ? 57.538 -51.001 63.687 1.00 94.05 ? 633 LYS A CG 1 ATOM 4460 C CD . LYS A 1 622 ? 57.265 -52.400 63.150 1.00 100.55 ? 633 LYS A CD 1 ATOM 4461 C CE . LYS A 1 622 ? 58.445 -52.935 62.355 1.00 102.62 ? 633 LYS A CE 1 ATOM 4462 N NZ . LYS A 1 622 ? 58.097 -54.189 61.631 1.00 99.98 ? 633 LYS A NZ 1 ATOM 4463 N N . PRO A 1 623 ? 59.685 -48.605 67.430 1.00 86.29 ? 634 PRO A N 1 ATOM 4464 C CA . PRO A 1 623 ? 60.322 -48.601 68.753 1.00 89.84 ? 634 PRO A CA 1 ATOM 4465 C C . PRO A 1 623 ? 59.512 -49.481 69.698 1.00 98.97 ? 634 PRO A C 1 ATOM 4466 O O . PRO A 1 623 ? 59.847 -49.660 70.869 1.00 90.11 ? 634 PRO A O 1 ATOM 4467 C CB . PRO A 1 623 ? 60.232 -47.134 69.176 1.00 86.05 ? 634 PRO A CB 1 ATOM 4468 C CG . PRO A 1 623 ? 59.023 -46.626 68.484 1.00 84.35 ? 634 PRO A CG 1 ATOM 4469 C CD . PRO A 1 623 ? 58.982 -47.338 67.157 1.00 95.27 ? 634 PRO A CD 1 ATOM 4470 N N . THR A 1 624 ? 58.434 -50.020 69.140 1.00 106.60 ? 635 THR A N 1 ATOM 4471 C CA . THR A 1 624 ? 57.545 -50.991 69.769 1.00 111.56 ? 635 THR A CA 1 ATOM 4472 C C . THR A 1 624 ? 57.159 -50.758 71.231 1.00 123.68 ? 635 THR A C 1 ATOM 4473 O O . THR A 1 624 ? 57.540 -51.503 72.131 1.00 148.75 ? 635 THR A O 1 ATOM 4474 C CB . THR A 1 624 ? 57.962 -52.470 69.483 1.00 134.85 ? 635 THR A CB 1 ATOM 4475 O OG1 . THR A 1 624 ? 56.979 -53.360 70.027 1.00 131.22 ? 635 THR A OG1 1 ATOM 4476 C CG2 . THR A 1 624 ? 59.347 -52.799 70.047 1.00 145.02 ? 635 THR A CG2 1 ATOM 4477 N N . ASP A 1 625 ? 56.380 -49.703 71.438 1.00 117.56 ? 636 ASP A N 1 ATOM 4478 C CA . ASP A 1 625 ? 55.446 -49.643 72.551 1.00 125.58 ? 636 ASP A CA 1 ATOM 4479 C C . ASP A 1 625 ? 54.163 -50.161 71.909 1.00 130.71 ? 636 ASP A C 1 ATOM 4480 O O . ASP A 1 625 ? 53.046 -49.783 72.272 1.00 131.56 ? 636 ASP A O 1 ATOM 4481 C CB . ASP A 1 625 ? 55.287 -48.204 73.040 1.00 123.71 ? 636 ASP A CB 1 ATOM 4482 C CG . ASP A 1 625 ? 54.254 -48.066 74.143 1.00 123.34 ? 636 ASP A CG 1 ATOM 4483 O OD1 . ASP A 1 625 ? 54.081 -49.026 74.922 1.00 114.55 ? 636 ASP A OD1 1 ATOM 4484 O OD2 . ASP A 1 625 ? 53.603 -47.002 74.219 1.00 131.35 ? 636 ASP A OD2 1 ATOM 4485 N N . TRP A 1 626 ? 54.360 -51.055 70.944 1.00 128.07 ? 637 TRP A N 1 ATOM 4486 C CA . TRP A 1 626 ? 53.356 -51.393 69.953 1.00 132.60 ? 637 TRP A CA 1 ATOM 4487 C C . TRP A 1 626 ? 52.761 -50.123 69.361 1.00 142.55 ? 637 TRP A C 1 ATOM 4488 O O . TRP A 1 626 ? 51.544 -49.951 69.292 1.00 154.26 ? 637 TRP A O 1 ATOM 4489 C CB . TRP A 1 626 ? 52.309 -52.349 70.515 1.00 136.03 ? 637 TRP A CB 1 ATOM 4490 C CG . TRP A 1 626 ? 52.781 -53.766 70.455 1.00 152.20 ? 637 TRP A CG 1 ATOM 4491 C CD1 . TRP A 1 626 ? 52.408 -54.716 69.550 1.00 152.40 ? 637 TRP A CD1 1 ATOM 4492 C CD2 . TRP A 1 626 ? 53.745 -54.387 71.316 1.00 167.77 ? 637 TRP A CD2 1 ATOM 4493 N NE1 . TRP A 1 626 ? 53.066 -55.896 69.805 1.00 161.97 ? 637 TRP A NE1 1 ATOM 4494 C CE2 . TRP A 1 626 ? 53.893 -55.720 70.883 1.00 170.96 ? 637 TRP A CE2 1 ATOM 4495 C CE3 . TRP A 1 626 ? 54.490 -53.949 72.416 1.00 167.89 ? 637 TRP A CE3 1 ATOM 4496 C CZ2 . TRP A 1 626 ? 54.756 -56.618 71.513 1.00 169.92 ? 637 TRP A CZ2 1 ATOM 4497 C CZ3 . TRP A 1 626 ? 55.346 -54.842 73.039 1.00 166.64 ? 637 TRP A CZ3 1 ATOM 4498 C CH2 . TRP A 1 626 ? 55.471 -56.161 72.585 1.00 166.05 ? 637 TRP A CH2 1 ATOM 4499 N N . LEU A 1 627 ? 53.659 -49.228 68.958 1.00 132.60 ? 638 LEU A N 1 ATOM 4500 C CA . LEU A 1 627 ? 53.301 -48.052 68.180 1.00 123.70 ? 638 LEU A CA 1 ATOM 4501 C C . LEU A 1 627 ? 54.271 -47.883 67.013 1.00 116.96 ? 638 LEU A C 1 ATOM 4502 O O . LEU A 1 627 ? 55.473 -48.123 67.155 1.00 111.94 ? 638 LEU A O 1 ATOM 4503 C CB . LEU A 1 627 ? 53.252 -46.793 69.052 1.00 110.61 ? 638 LEU A CB 1 ATOM 4504 C CG . LEU A 1 627 ? 54.481 -46.326 69.830 1.00 110.49 ? 638 LEU A CG 1 ATOM 4505 C CD1 . LEU A 1 627 ? 55.422 -45.505 68.966 1.00 92.34 ? 638 LEU A CD1 1 ATOM 4506 C CD2 . LEU A 1 627 ? 54.038 -45.523 71.041 1.00 129.04 ? 638 LEU A CD2 1 ATOM 4507 N N . ASP A 1 628 ? 53.743 -47.473 65.864 1.00 97.28 ? 639 ASP A N 1 ATOM 4508 C CA . ASP A 1 628 ? 54.557 -47.322 64.666 1.00 82.54 ? 639 ASP A CA 1 ATOM 4509 C C . ASP A 1 628 ? 54.598 -45.877 64.182 1.00 87.29 ? 639 ASP A C 1 ATOM 4510 O O . ASP A 1 628 ? 53.560 -45.245 64.000 1.00 79.11 ? 639 ASP A O 1 ATOM 4511 C CB . ASP A 1 628 ? 54.035 -48.227 63.550 1.00 87.16 ? 639 ASP A CB 1 ATOM 4512 C CG . ASP A 1 628 ? 54.006 -49.683 63.946 1.00 98.11 ? 639 ASP A CG 1 ATOM 4513 O OD1 . ASP A 1 628 ? 54.768 -50.067 64.856 1.00 104.44 ? 639 ASP A OD1 1 ATOM 4514 O OD2 . ASP A 1 628 ? 53.220 -50.446 63.346 1.00 94.72 ? 639 ASP A OD2 1 ATOM 4515 N N . LEU A 1 629 ? 55.809 -45.366 63.976 1.00 93.06 ? 640 LEU A N 1 ATOM 4516 C CA . LEU A 1 629 ? 56.016 -44.045 63.392 1.00 85.49 ? 640 LEU A CA 1 ATOM 4517 C C . LEU A 1 629 ? 56.242 -44.196 61.890 1.00 78.10 ? 640 LEU A C 1 ATOM 4518 O O . LEU A 1 629 ? 57.275 -44.718 61.467 1.00 78.02 ? 640 LEU A O 1 ATOM 4519 C CB . LEU A 1 629 ? 57.224 -43.355 64.034 1.00 81.67 ? 640 LEU A CB 1 ATOM 4520 C CG . LEU A 1 629 ? 57.008 -42.490 65.283 1.00 83.61 ? 640 LEU A CG 1 ATOM 4521 C CD1 . LEU A 1 629 ? 56.263 -43.249 66.356 1.00 88.36 ? 640 LEU A CD1 1 ATOM 4522 C CD2 . LEU A 1 629 ? 58.338 -41.971 65.830 1.00 80.42 ? 640 LEU A CD2 1 ATOM 4523 N N . THR A 1 630 ? 55.277 -43.748 61.089 1.00 71.12 ? 641 THR A N 1 ATOM 4524 C CA . THR A 1 630 ? 55.309 -43.994 59.646 1.00 67.36 ? 641 THR A CA 1 ATOM 4525 C C . THR A 1 630 ? 55.489 -42.717 58.836 1.00 79.70 ? 641 THR A C 1 ATOM 4526 O O . THR A 1 630 ? 54.933 -41.675 59.177 1.00 83.11 ? 641 THR A O 1 ATOM 4527 C CB . THR A 1 630 ? 54.018 -44.692 59.160 1.00 67.73 ? 641 THR A CB 1 ATOM 4528 O OG1 . THR A 1 630 ? 52.941 -43.749 59.130 1.00 74.20 ? 641 THR A OG1 1 ATOM 4529 C CG2 . THR A 1 630 ? 53.646 -45.849 60.076 1.00 71.17 ? 641 THR A CG2 1 ATOM 4530 N N . TYR A 1 631 ? 56.259 -42.806 57.757 1.00 80.20 ? 642 TYR A N 1 ATOM 4531 C CA . TYR A 1 631 ? 56.451 -41.671 56.862 1.00 85.02 ? 642 TYR A CA 1 ATOM 4532 C C . TYR A 1 631 ? 56.705 -42.120 55.430 1.00 80.87 ? 642 TYR A C 1 ATOM 4533 O O . TYR A 1 631 ? 57.653 -42.857 55.163 1.00 87.73 ? 642 TYR A O 1 ATOM 4534 C CB . TYR A 1 631 ? 57.607 -40.802 57.338 1.00 84.33 ? 642 TYR A CB 1 ATOM 4535 C CG . TYR A 1 631 ? 57.838 -39.588 56.474 1.00 88.64 ? 642 TYR A CG 1 ATOM 4536 C CD1 . TYR A 1 631 ? 57.066 -38.448 56.633 1.00 91.36 ? 642 TYR A CD1 1 ATOM 4537 C CD2 . TYR A 1 631 ? 58.828 -39.582 55.498 1.00 87.54 ? 642 TYR A CD2 1 ATOM 4538 C CE1 . TYR A 1 631 ? 57.272 -37.333 55.849 1.00 90.02 ? 642 TYR A CE1 1 ATOM 4539 C CE2 . TYR A 1 631 ? 59.041 -38.470 54.707 1.00 89.53 ? 642 TYR A CE2 1 ATOM 4540 C CZ . TYR A 1 631 ? 58.260 -37.348 54.887 1.00 86.76 ? 642 TYR A CZ 1 ATOM 4541 O OH . TYR A 1 631 ? 58.468 -36.235 54.106 1.00 80.46 ? 642 TYR A OH 1 ATOM 4542 N N . ARG A 1 632 ? 55.867 -41.655 54.509 1.00 69.79 ? 643 ARG A N 1 ATOM 4543 C CA . ARG A 1 632 ? 55.929 -42.119 53.128 1.00 76.73 ? 643 ARG A CA 1 ATOM 4544 C C . ARG A 1 632 ? 55.957 -40.978 52.130 1.00 81.24 ? 643 ARG A C 1 ATOM 4545 O O . ARG A 1 632 ? 55.396 -39.909 52.370 1.00 78.52 ? 643 ARG A O 1 ATOM 4546 C CB . ARG A 1 632 ? 54.736 -43.012 52.809 1.00 79.42 ? 643 ARG A CB 1 ATOM 4547 C CG . ARG A 1 632 ? 53.429 -42.320 53.020 1.00 77.32 ? 643 ARG A CG 1 ATOM 4548 C CD . ARG A 1 632 ? 52.301 -43.084 52.409 1.00 77.13 ? 643 ARG A CD 1 ATOM 4549 N NE . ARG A 1 632 ? 52.517 -43.362 50.994 1.00 85.31 ? 643 ARG A NE 1 ATOM 4550 C CZ . ARG A 1 632 ? 51.547 -43.586 50.116 1.00 85.90 ? 643 ARG A CZ 1 ATOM 4551 N NH1 . ARG A 1 632 ? 50.262 -43.536 50.480 1.00 86.32 ? 643 ARG A NH1 1 ATOM 4552 N NH2 . ARG A 1 632 ? 51.879 -43.850 48.864 1.00 79.08 ? 643 ARG A NH2 1 ATOM 4553 N N . THR A 1 633 ? 56.606 -41.234 51.000 1.00 88.89 ? 644 THR A N 1 ATOM 4554 C CA . THR A 1 633 ? 56.727 -40.273 49.916 1.00 80.05 ? 644 THR A CA 1 ATOM 4555 C C . THR A 1 633 ? 56.454 -40.989 48.602 1.00 81.18 ? 644 THR A C 1 ATOM 4556 O O . THR A 1 633 ? 56.959 -42.088 48.382 1.00 91.86 ? 644 THR A O 1 ATOM 4557 C CB . THR A 1 633 ? 58.146 -39.684 49.872 1.00 74.43 ? 644 THR A CB 1 ATOM 4558 O OG1 . THR A 1 633 ? 58.323 -38.774 50.964 1.00 69.28 ? 644 THR A OG1 1 ATOM 4559 C CG2 . THR A 1 633 ? 58.371 -38.945 48.582 1.00 84.43 ? 644 THR A CG2 1 ATOM 4560 N N . SER A 1 634 ? 55.651 -40.380 47.735 1.00 74.39 ? 645 SER A N 1 ATOM 4561 C CA . SER A 1 634 ? 55.352 -40.974 46.436 1.00 74.01 ? 645 SER A CA 1 ATOM 4562 C C . SER A 1 634 ? 55.032 -39.908 45.393 1.00 69.68 ? 645 SER A C 1 ATOM 4563 O O . SER A 1 634 ? 54.437 -38.879 45.709 1.00 65.17 ? 645 SER A O 1 ATOM 4564 C CB . SER A 1 634 ? 54.182 -41.954 46.552 1.00 74.03 ? 645 SER A CB 1 ATOM 4565 O OG . SER A 1 634 ? 52.980 -41.283 46.892 1.00 72.82 ? 645 SER A OG 1 ATOM 4566 N N . THR A 1 635 ? 55.431 -40.159 44.150 1.00 66.91 ? 646 THR A N 1 ATOM 4567 C CA . THR A 1 635 ? 55.104 -39.259 43.050 1.00 67.73 ? 646 THR A CA 1 ATOM 4568 C C . THR A 1 635 ? 53.885 -39.767 42.289 1.00 71.52 ? 646 THR A C 1 ATOM 4569 O O . THR A 1 635 ? 53.472 -40.920 42.444 1.00 74.51 ? 646 THR A O 1 ATOM 4570 C CB . THR A 1 635 ? 56.280 -39.097 42.066 1.00 66.83 ? 646 THR A CB 1 ATOM 4571 O OG1 . THR A 1 635 ? 56.496 -40.326 41.360 1.00 68.08 ? 646 THR A OG1 1 ATOM 4572 C CG2 . THR A 1 635 ? 57.552 -38.705 42.810 1.00 61.89 ? 646 THR A CG2 1 ATOM 4573 N N . GLY A 1 636 ? 53.307 -38.892 41.475 1.00 55.89 ? 647 GLY A N 1 ATOM 4574 C CA . GLY A 1 636 ? 52.143 -39.233 40.678 1.00 53.63 ? 647 GLY A CA 1 ATOM 4575 C C . GLY A 1 636 ? 52.053 -38.386 39.420 1.00 63.62 ? 647 GLY A C 1 ATOM 4576 O O . GLY A 1 636 ? 52.360 -37.192 39.435 1.00 63.91 ? 647 GLY A O 1 ATOM 4577 N N . PHE A 1 637 ? 51.639 -38.999 38.319 1.00 57.18 ? 648 PHE A N 1 ATOM 4578 C CA . PHE A 1 637 ? 51.532 -38.264 37.071 1.00 49.30 ? 648 PHE A CA 1 ATOM 4579 C C . PHE A 1 637 ? 50.341 -38.699 36.232 1.00 57.11 ? 648 PHE A C 1 ATOM 4580 O O . PHE A 1 637 ? 49.873 -39.835 36.317 1.00 61.79 ? 648 PHE A O 1 ATOM 4581 C CB . PHE A 1 637 ? 52.827 -38.361 36.260 1.00 54.70 ? 648 PHE A CB 1 ATOM 4582 C CG . PHE A 1 637 ? 52.952 -39.622 35.464 1.00 54.20 ? 648 PHE A CG 1 ATOM 4583 C CD1 . PHE A 1 637 ? 52.678 -39.631 34.109 1.00 58.62 ? 648 PHE A CD1 1 ATOM 4584 C CD2 . PHE A 1 637 ? 53.346 -40.802 36.070 1.00 60.54 ? 648 PHE A CD2 1 ATOM 4585 C CE1 . PHE A 1 637 ? 52.792 -40.794 33.375 1.00 69.50 ? 648 PHE A CE1 1 ATOM 4586 C CE2 . PHE A 1 637 ? 53.462 -41.969 35.341 1.00 54.82 ? 648 PHE A CE2 1 ATOM 4587 C CZ . PHE A 1 637 ? 53.185 -41.966 33.993 1.00 57.38 ? 648 PHE A CZ 1 ATOM 4588 N N . ARG A 1 638 ? 49.853 -37.769 35.425 1.00 56.78 ? 649 ARG A N 1 ATOM 4589 C CA . ARG A 1 638 ? 48.738 -38.038 34.541 1.00 62.39 ? 649 ARG A CA 1 ATOM 4590 C C . ARG A 1 638 ? 49.011 -37.466 33.158 1.00 62.64 ? 649 ARG A C 1 ATOM 4591 O O . ARG A 1 638 ? 49.197 -36.262 33.003 1.00 61.95 ? 649 ARG A O 1 ATOM 4592 C CB . ARG A 1 638 ? 47.460 -37.429 35.104 1.00 53.17 ? 649 ARG A CB 1 ATOM 4593 C CG . ARG A 1 638 ? 46.275 -37.606 34.197 1.00 37.75 ? 649 ARG A CG 1 ATOM 4594 C CD . ARG A 1 638 ? 45.108 -36.757 34.635 1.00 46.33 ? 649 ARG A CD 1 ATOM 4595 N NE . ARG A 1 638 ? 44.122 -36.649 33.569 1.00 61.01 ? 649 ARG A NE 1 ATOM 4596 C CZ . ARG A 1 638 ? 43.838 -35.522 32.929 1.00 61.46 ? 649 ARG A CZ 1 ATOM 4597 N NH1 . ARG A 1 638 ? 44.453 -34.397 33.264 1.00 52.30 ? 649 ARG A NH1 1 ATOM 4598 N NH2 . ARG A 1 638 ? 42.926 -35.517 31.966 1.00 69.03 ? 649 ARG A NH2 1 ATOM 4599 N N . LEU A 1 639 ? 49.044 -38.339 32.159 1.00 52.93 ? 650 LEU A N 1 ATOM 4600 C CA . LEU A 1 639 ? 49.203 -37.914 30.777 1.00 46.76 ? 650 LEU A CA 1 ATOM 4601 C C . LEU A 1 639 ? 47.921 -37.223 30.298 1.00 55.29 ? 650 LEU A C 1 ATOM 4602 O O . LEU A 1 639 ? 46.844 -37.468 30.847 1.00 58.71 ? 650 LEU A O 1 ATOM 4603 C CB . LEU A 1 639 ? 49.529 -39.126 29.900 1.00 39.72 ? 650 LEU A CB 1 ATOM 4604 C CG . LEU A 1 639 ? 50.992 -39.553 29.750 1.00 45.58 ? 650 LEU A CG 1 ATOM 4605 C CD1 . LEU A 1 639 ? 51.932 -38.572 30.429 1.00 42.46 ? 650 LEU A CD1 1 ATOM 4606 C CD2 . LEU A 1 639 ? 51.212 -40.963 30.261 1.00 41.74 ? 650 LEU A CD2 1 ATOM 4607 N N . PRO A 1 640 ? 48.034 -36.345 29.286 1.00 47.11 ? 651 PRO A N 1 ATOM 4608 C CA . PRO A 1 640 ? 46.864 -35.664 28.710 1.00 42.83 ? 651 PRO A CA 1 ATOM 4609 C C . PRO A 1 640 ? 45.832 -36.671 28.228 1.00 53.03 ? 651 PRO A C 1 ATOM 4610 O O . PRO A 1 640 ? 46.191 -37.609 27.518 1.00 68.07 ? 651 PRO A O 1 ATOM 4611 C CB . PRO A 1 640 ? 47.445 -34.930 27.497 1.00 39.04 ? 651 PRO A CB 1 ATOM 4612 C CG . PRO A 1 640 ? 48.880 -34.775 27.789 1.00 45.70 ? 651 PRO A CG 1 ATOM 4613 C CD . PRO A 1 640 ? 49.287 -35.951 28.620 1.00 45.36 ? 651 PRO A CD 1 ATOM 4614 N N . SER A 1 641 ? 44.570 -36.487 28.598 1.00 50.50 ? 652 SER A N 1 ATOM 4615 C CA . SER A 1 641 ? 43.537 -37.445 28.215 1.00 58.27 ? 652 SER A CA 1 ATOM 4616 C C . SER A 1 641 ? 43.259 -37.375 26.719 1.00 56.45 ? 652 SER A C 1 ATOM 4617 O O . SER A 1 641 ? 43.684 -36.441 26.049 1.00 44.27 ? 652 SER A O 1 ATOM 4618 C CB . SER A 1 641 ? 42.248 -37.194 28.997 1.00 52.93 ? 652 SER A CB 1 ATOM 4619 O OG . SER A 1 641 ? 41.650 -35.978 28.597 1.00 39.15 ? 652 SER A OG 1 ATOM 4620 N N . PHE A 1 642 ? 42.536 -38.360 26.198 1.00 54.84 ? 653 PHE A N 1 ATOM 4621 C CA . PHE A 1 642 ? 42.219 -38.385 24.776 1.00 50.98 ? 653 PHE A CA 1 ATOM 4622 C C . PHE A 1 642 ? 41.306 -37.223 24.374 1.00 55.41 ? 653 PHE A C 1 ATOM 4623 O O . PHE A 1 642 ? 41.372 -36.736 23.247 1.00 59.02 ? 653 PHE A O 1 ATOM 4624 C CB . PHE A 1 642 ? 41.617 -39.736 24.375 1.00 44.73 ? 653 PHE A CB 1 ATOM 4625 C CG . PHE A 1 642 ? 42.549 -40.901 24.589 1.00 46.02 ? 653 PHE A CG 1 ATOM 4626 C CD1 . PHE A 1 642 ? 43.748 -40.985 23.890 1.00 51.26 ? 653 PHE A CD1 1 ATOM 4627 C CD2 . PHE A 1 642 ? 42.229 -41.913 25.485 1.00 43.74 ? 653 PHE A CD2 1 ATOM 4628 C CE1 . PHE A 1 642 ? 44.615 -42.052 24.086 1.00 49.80 ? 653 PHE A CE1 1 ATOM 4629 C CE2 . PHE A 1 642 ? 43.087 -42.985 25.684 1.00 35.02 ? 653 PHE A CE2 1 ATOM 4630 C CZ . PHE A 1 642 ? 44.285 -43.052 24.984 1.00 36.06 ? 653 PHE A CZ 1 ATOM 4631 N N . ALA A 1 643 ? 40.470 -36.768 25.301 1.00 46.77 ? 654 ALA A N 1 ATOM 4632 C CA . ALA A 1 643 ? 39.595 -35.627 25.035 1.00 44.36 ? 654 ALA A CA 1 ATOM 4633 C C . ALA A 1 643 ? 40.368 -34.310 25.064 1.00 45.98 ? 654 ALA A C 1 ATOM 4634 O O . ALA A 1 643 ? 40.081 -33.388 24.295 1.00 38.30 ? 654 ALA A O 1 ATOM 4635 C CB . ALA A 1 643 ? 38.433 -35.594 26.019 1.00 38.46 ? 654 ALA A CB 1 ATOM 4636 N N . GLU A 1 644 ? 41.350 -34.228 25.954 1.00 32.95 ? 655 GLU A N 1 ATOM 4637 C CA . GLU A 1 644 ? 42.219 -33.062 26.011 1.00 44.65 ? 655 GLU A CA 1 ATOM 4638 C C . GLU A 1 644 ? 43.115 -32.980 24.781 1.00 54.39 ? 655 GLU A C 1 ATOM 4639 O O . GLU A 1 644 ? 43.417 -31.891 24.290 1.00 58.71 ? 655 GLU A O 1 ATOM 4640 C CB . GLU A 1 644 ? 43.053 -33.088 27.286 1.00 48.13 ? 655 GLU A CB 1 ATOM 4641 C CG . GLU A 1 644 ? 42.235 -32.830 28.542 1.00 62.45 ? 655 GLU A CG 1 ATOM 4642 C CD . GLU A 1 644 ? 42.883 -33.381 29.799 1.00 62.49 ? 655 GLU A CD 1 ATOM 4643 O OE1 . GLU A 1 644 ? 43.809 -34.215 29.698 1.00 66.25 ? 655 GLU A OE1 1 ATOM 4644 O OE2 . GLU A 1 644 ? 42.455 -32.980 30.896 1.00 56.17 ? 655 GLU A OE2 1 ATOM 4645 N N . MET A 1 645 ? 43.529 -34.139 24.280 1.00 58.92 ? 656 MET A N 1 ATOM 4646 C CA . MET A 1 645 ? 44.401 -34.195 23.114 1.00 53.09 ? 656 MET A CA 1 ATOM 4647 C C . MET A 1 645 ? 43.675 -33.722 21.866 1.00 55.38 ? 656 MET A C 1 ATOM 4648 O O . MET A 1 645 ? 44.271 -33.079 21.001 1.00 59.56 ? 656 MET A O 1 ATOM 4649 C CB . MET A 1 645 ? 44.938 -35.612 22.906 1.00 48.19 ? 656 MET A CB 1 ATOM 4650 C CG . MET A 1 645 ? 45.890 -36.083 23.992 1.00 43.94 ? 656 MET A CG 1 ATOM 4651 S SD . MET A 1 645 ? 46.197 -37.857 23.947 1.00 57.79 ? 656 MET A SD 1 ATOM 4652 C CE . MET A 1 645 ? 47.442 -37.962 22.669 1.00 38.78 ? 656 MET A CE 1 ATOM 4653 N N . TYR A 1 646 ? 42.386 -34.039 21.778 1.00 47.53 ? 657 TYR A N 1 ATOM 4654 C CA . TYR A 1 646 ? 41.588 -33.646 20.622 1.00 41.54 ? 657 TYR A CA 1 ATOM 4655 C C . TYR A 1 646 ? 41.401 -32.144 20.621 1.00 39.92 ? 657 TYR A C 1 ATOM 4656 O O . TYR A 1 646 ? 41.218 -31.529 19.574 1.00 53.74 ? 657 TYR A O 1 ATOM 4657 C CB . TYR A 1 646 ? 40.231 -34.339 20.632 1.00 42.53 ? 657 TYR A CB 1 ATOM 4658 C CG . TYR A 1 646 ? 39.345 -33.966 19.468 1.00 42.35 ? 657 TYR A CG 1 ATOM 4659 C CD1 . TYR A 1 646 ? 38.343 -33.015 19.610 1.00 48.53 ? 657 TYR A CD1 1 ATOM 4660 C CD2 . TYR A 1 646 ? 39.506 -34.570 18.225 1.00 46.39 ? 657 TYR A CD2 1 ATOM 4661 C CE1 . TYR A 1 646 ? 37.525 -32.677 18.549 1.00 46.92 ? 657 TYR A CE1 1 ATOM 4662 C CE2 . TYR A 1 646 ? 38.694 -34.240 17.159 1.00 43.82 ? 657 TYR A CE2 1 ATOM 4663 C CZ . TYR A 1 646 ? 37.704 -33.295 17.328 1.00 43.63 ? 657 TYR A CZ 1 ATOM 4664 O OH . TYR A 1 646 ? 36.898 -32.961 16.266 1.00 48.69 ? 657 TYR A OH 1 ATOM 4665 N N . GLY A 1 647 ? 41.436 -31.565 21.814 1.00 49.03 ? 658 GLY A N 1 ATOM 4666 C CA . GLY A 1 647 ? 41.488 -30.127 21.970 1.00 41.59 ? 658 GLY A CA 1 ATOM 4667 C C . GLY A 1 647 ? 40.147 -29.436 21.924 1.00 47.07 ? 658 GLY A C 1 ATOM 4668 O O . GLY A 1 647 ? 39.115 -30.052 21.666 1.00 50.40 ? 658 GLY A O 1 ATOM 4669 N N . TRP A 1 648 ? 40.185 -28.135 22.178 1.00 50.34 ? 659 TRP A N 1 ATOM 4670 C CA . TRP A 1 648 ? 39.010 -27.281 22.161 1.00 46.34 ? 659 TRP A CA 1 ATOM 4671 C C . TRP A 1 648 ? 38.867 -26.748 20.741 1.00 52.49 ? 659 TRP A C 1 ATOM 4672 O O . TRP A 1 648 ? 39.851 -26.312 20.141 1.00 51.51 ? 659 TRP A O 1 ATOM 4673 C CB . TRP A 1 648 ? 39.227 -26.138 23.157 1.00 46.25 ? 659 TRP A CB 1 ATOM 4674 C CG . TRP A 1 648 ? 38.080 -25.208 23.342 1.00 51.22 ? 659 TRP A CG 1 ATOM 4675 C CD1 . TRP A 1 648 ? 37.104 -25.285 24.292 1.00 50.51 ? 659 TRP A CD1 1 ATOM 4676 C CD2 . TRP A 1 648 ? 37.804 -24.032 22.578 1.00 57.71 ? 659 TRP A CD2 1 ATOM 4677 N NE1 . TRP A 1 648 ? 36.228 -24.236 24.157 1.00 52.56 ? 659 TRP A NE1 1 ATOM 4678 C CE2 . TRP A 1 648 ? 36.637 -23.451 23.111 1.00 57.75 ? 659 TRP A CE2 1 ATOM 4679 C CE3 . TRP A 1 648 ? 38.427 -23.416 21.488 1.00 60.75 ? 659 TRP A CE3 1 ATOM 4680 C CZ2 . TRP A 1 648 ? 36.080 -22.286 22.592 1.00 58.99 ? 659 TRP A CZ2 1 ATOM 4681 C CZ3 . TRP A 1 648 ? 37.873 -22.259 20.975 1.00 59.43 ? 659 TRP A CZ3 1 ATOM 4682 C CH2 . TRP A 1 648 ? 36.710 -21.707 21.525 1.00 59.63 ? 659 TRP A CH2 1 ATOM 4683 N N . ARG A 1 649 ? 37.656 -26.806 20.190 1.00 51.35 ? 660 ARG A N 1 ATOM 4684 C CA . ARG A 1 649 ? 37.442 -26.388 18.804 1.00 37.77 ? 660 ARG A CA 1 ATOM 4685 C C . ARG A 1 649 ? 36.226 -25.490 18.619 1.00 44.03 ? 660 ARG A C 1 ATOM 4686 O O . ARG A 1 649 ? 35.208 -25.664 19.284 1.00 61.07 ? 660 ARG A O 1 ATOM 4687 C CB . ARG A 1 649 ? 37.359 -27.604 17.884 1.00 43.53 ? 660 ARG A CB 1 ATOM 4688 C CG . ARG A 1 649 ? 38.602 -28.472 17.952 1.00 50.88 ? 660 ARG A CG 1 ATOM 4689 C CD . ARG A 1 649 ? 38.644 -29.524 16.874 1.00 49.72 ? 660 ARG A CD 1 ATOM 4690 N NE . ARG A 1 649 ? 39.849 -30.332 17.010 1.00 43.35 ? 660 ARG A NE 1 ATOM 4691 C CZ . ARG A 1 649 ? 40.187 -31.312 16.184 1.00 40.74 ? 660 ARG A CZ 1 ATOM 4692 N NH1 . ARG A 1 649 ? 41.302 -31.995 16.389 1.00 54.20 ? 660 ARG A NH1 1 ATOM 4693 N NH2 . ARG A 1 649 ? 39.409 -31.609 15.154 1.00 42.66 ? 660 ARG A NH2 1 ATOM 4694 N N . ALA A 1 650 ? 36.345 -24.528 17.707 1.00 44.72 ? 661 ALA A N 1 ATOM 4695 C CA . ALA A 1 650 ? 35.285 -23.551 17.478 1.00 52.40 ? 661 ALA A CA 1 ATOM 4696 C C . ALA A 1 650 ? 34.922 -23.400 16.002 1.00 63.29 ? 661 ALA A C 1 ATOM 4697 O O . ALA A 1 650 ? 34.594 -22.304 15.543 1.00 82.55 ? 661 ALA A O 1 ATOM 4698 C CB . ALA A 1 650 ? 35.672 -22.202 18.068 1.00 63.31 ? 661 ALA A CB 1 ATOM 4699 N N . GLY A 1 651 ? 34.982 -24.502 15.262 1.00 60.56 ? 662 GLY A N 1 ATOM 4700 C CA . GLY A 1 651 ? 34.564 -24.501 13.872 1.00 64.11 ? 662 GLY A CA 1 ATOM 4701 C C . GLY A 1 651 ? 35.574 -23.884 12.927 1.00 58.96 ? 662 GLY A C 1 ATOM 4702 O O . GLY A 1 651 ? 35.247 -23.528 11.798 1.00 65.92 ? 662 GLY A O 1 ATOM 4703 N N . VAL A 1 652 ? 36.805 -23.749 13.396 1.00 57.16 ? 663 VAL A N 1 ATOM 4704 C CA . VAL A 1 652 ? 37.877 -23.237 12.564 1.00 55.52 ? 663 VAL A CA 1 ATOM 4705 C C . VAL A 1 652 ? 39.102 -24.126 12.701 1.00 66.76 ? 663 VAL A C 1 ATOM 4706 O O . VAL A 1 652 ? 39.186 -24.942 13.619 1.00 70.48 ? 663 VAL A O 1 ATOM 4707 C CB . VAL A 1 652 ? 38.244 -21.786 12.939 1.00 59.95 ? 663 VAL A CB 1 ATOM 4708 C CG1 . VAL A 1 652 ? 37.070 -20.854 12.673 1.00 73.05 ? 663 VAL A CG1 1 ATOM 4709 C CG2 . VAL A 1 652 ? 38.667 -21.701 14.389 1.00 55.28 ? 663 VAL A CG2 1 ATOM 4710 N N . GLN A 1 653 ? 40.042 -23.971 11.774 1.00 75.18 ? 664 GLN A N 1 ATOM 4711 C CA . GLN A 1 653 ? 41.303 -24.701 11.810 1.00 78.92 ? 664 GLN A CA 1 ATOM 4712 C C . GLN A 1 653 ? 42.041 -24.482 13.130 1.00 78.71 ? 664 GLN A C 1 ATOM 4713 O O . GLN A 1 653 ? 42.143 -23.356 13.621 1.00 73.42 ? 664 GLN A O 1 ATOM 4714 C CB . GLN A 1 653 ? 42.192 -24.275 10.639 1.00 88.89 ? 664 GLN A CB 1 ATOM 4715 C CG . GLN A 1 653 ? 43.586 -24.886 10.637 1.00 100.22 ? 664 GLN A CG 1 ATOM 4716 C CD . GLN A 1 653 ? 43.600 -26.330 10.169 1.00 105.38 ? 664 GLN A CD 1 ATOM 4717 O OE1 . GLN A 1 653 ? 42.554 -26.969 10.041 1.00 103.97 ? 664 GLN A OE1 1 ATOM 4718 N NE2 . GLN A 1 653 ? 44.794 -26.849 9.904 1.00 104.18 ? 664 GLN A NE2 1 ATOM 4719 N N . SER A 1 654 ? 42.543 -25.569 13.705 1.00 75.47 ? 665 SER A N 1 ATOM 4720 C CA . SER A 1 654 ? 43.285 -25.500 14.955 1.00 71.92 ? 665 SER A CA 1 ATOM 4721 C C . SER A 1 654 ? 44.662 -26.114 14.772 1.00 63.14 ? 665 SER A C 1 ATOM 4722 O O . SER A 1 654 ? 44.811 -27.125 14.093 1.00 68.54 ? 665 SER A O 1 ATOM 4723 C CB . SER A 1 654 ? 42.542 -26.251 16.066 1.00 79.78 ? 665 SER A CB 1 ATOM 4724 O OG . SER A 1 654 ? 41.243 -25.727 16.275 1.00 89.62 ? 665 SER A OG 1 ATOM 4725 N N . LYS A 1 655 ? 45.673 -25.499 15.369 1.00 73.42 ? 666 LYS A N 1 ATOM 4726 C CA . LYS A 1 655 ? 46.977 -26.135 15.448 1.00 81.03 ? 666 LYS A CA 1 ATOM 4727 C C . LYS A 1 655 ? 46.973 -27.059 16.658 1.00 82.75 ? 666 LYS A C 1 ATOM 4728 O O . LYS A 1 655 ? 46.095 -26.969 17.518 1.00 83.12 ? 666 LYS A O 1 ATOM 4729 C CB . LYS A 1 655 ? 48.091 -25.093 15.576 1.00 85.73 ? 666 LYS A CB 1 ATOM 4730 C CG . LYS A 1 655 ? 48.308 -24.243 14.334 1.00 96.63 ? 666 LYS A CG 1 ATOM 4731 C CD . LYS A 1 655 ? 48.766 -25.089 13.157 1.00 108.36 ? 666 LYS A CD 1 ATOM 4732 C CE . LYS A 1 655 ? 49.037 -24.235 11.926 1.00 116.71 ? 666 LYS A CE 1 ATOM 4733 N NZ . LYS A 1 655 ? 50.187 -23.308 12.126 1.00 117.95 ? 666 LYS A NZ 1 ATOM 4734 N N . ALA A 1 656 ? 47.944 -27.960 16.720 1.00 74.54 ? 667 ALA A N 1 ATOM 4735 C CA . ALA A 1 656 ? 48.101 -28.800 17.894 1.00 61.14 ? 667 ALA A CA 1 ATOM 4736 C C . ALA A 1 656 ? 49.103 -28.149 18.839 1.00 70.81 ? 667 ALA A C 1 ATOM 4737 O O . ALA A 1 656 ? 50.081 -27.548 18.396 1.00 74.07 ? 667 ALA A O 1 ATOM 4738 C CB . ALA A 1 656 ? 48.562 -30.186 17.493 1.00 49.12 ? 667 ALA A CB 1 ATOM 4739 N N . VAL A 1 657 ? 48.853 -28.254 20.140 1.00 69.17 ? 668 VAL A N 1 ATOM 4740 C CA . VAL A 1 657 ? 49.787 -27.730 21.131 1.00 65.72 ? 668 VAL A CA 1 ATOM 4741 C C . VAL A 1 657 ? 50.375 -28.854 21.970 1.00 71.53 ? 668 VAL A C 1 ATOM 4742 O O . VAL A 1 657 ? 49.748 -29.894 22.154 1.00 84.70 ? 668 VAL A O 1 ATOM 4743 C CB . VAL A 1 657 ? 49.114 -26.714 22.073 1.00 73.32 ? 668 VAL A CB 1 ATOM 4744 C CG1 . VAL A 1 657 ? 48.747 -25.444 21.319 1.00 61.86 ? 668 VAL A CG1 1 ATOM 4745 C CG2 . VAL A 1 657 ? 47.889 -27.334 22.739 1.00 84.74 ? 668 VAL A CG2 1 ATOM 4746 N N . LYS A 1 658 ? 51.583 -28.643 22.476 1.00 71.99 ? 669 LYS A N 1 ATOM 4747 C CA . LYS A 1 658 ? 52.216 -29.614 23.356 1.00 69.65 ? 669 LYS A CA 1 ATOM 4748 C C . LYS A 1 658 ? 51.539 -29.586 24.720 1.00 62.76 ? 669 LYS A C 1 ATOM 4749 O O . LYS A 1 658 ? 51.181 -28.521 25.222 1.00 64.81 ? 669 LYS A O 1 ATOM 4750 C CB . LYS A 1 658 ? 53.709 -29.308 23.502 1.00 80.69 ? 669 LYS A CB 1 ATOM 4751 C CG . LYS A 1 658 ? 54.471 -30.292 24.376 1.00 106.12 ? 669 LYS A CG 1 ATOM 4752 C CD . LYS A 1 658 ? 54.311 -31.720 23.867 1.00 132.07 ? 669 LYS A CD 1 ATOM 4753 C CE . LYS A 1 658 ? 55.213 -32.694 24.620 1.00 147.06 ? 669 LYS A CE 1 ATOM 4754 N NZ . LYS A 1 658 ? 54.886 -32.784 26.072 1.00 152.35 ? 669 LYS A NZ 1 ATOM 4755 N N . ILE A 1 659 ? 51.345 -30.758 25.312 1.00 55.01 ? 670 ILE A N 1 ATOM 4756 C CA . ILE A 1 659 ? 50.851 -30.822 26.681 1.00 55.54 ? 670 ILE A CA 1 ATOM 4757 C C . ILE A 1 659 ? 51.745 -31.695 27.550 1.00 52.86 ? 670 ILE A C 1 ATOM 4758 O O . ILE A 1 659 ? 51.913 -32.885 27.289 1.00 59.22 ? 670 ILE A O 1 ATOM 4759 C CB . ILE A 1 659 ? 49.420 -31.366 26.766 1.00 51.69 ? 670 ILE A CB 1 ATOM 4760 C CG1 . ILE A 1 659 ? 48.497 -30.645 25.789 1.00 46.23 ? 670 ILE A CG1 1 ATOM 4761 C CG2 . ILE A 1 659 ? 48.901 -31.219 28.181 1.00 47.34 ? 670 ILE A CG2 1 ATOM 4762 C CD1 . ILE A 1 659 ? 47.061 -31.092 25.892 1.00 44.30 ? 670 ILE A CD1 1 ATOM 4763 N N . ASP A 1 660 ? 52.323 -31.095 28.581 1.00 53.36 ? 671 ASP A N 1 ATOM 4764 C CA . ASP A 1 660 ? 53.117 -31.844 29.539 1.00 60.10 ? 671 ASP A CA 1 ATOM 4765 C C . ASP A 1 660 ? 52.159 -32.567 30.480 1.00 64.16 ? 671 ASP A C 1 ATOM 4766 O O . ASP A 1 660 ? 50.980 -32.223 30.547 1.00 57.91 ? 671 ASP A O 1 ATOM 4767 C CB . ASP A 1 660 ? 54.053 -30.903 30.302 1.00 65.93 ? 671 ASP A CB 1 ATOM 4768 C CG . ASP A 1 660 ? 55.062 -30.219 29.390 1.00 84.68 ? 671 ASP A CG 1 ATOM 4769 O OD1 . ASP A 1 660 ? 55.531 -30.865 28.429 1.00 89.22 ? 671 ASP A OD1 1 ATOM 4770 O OD2 . ASP A 1 660 ? 55.386 -29.036 29.630 1.00 89.96 ? 671 ASP A OD2 1 ATOM 4771 N N . PRO A 1 661 ? 52.647 -33.590 31.196 1.00 67.57 ? 672 PRO A N 1 ATOM 4772 C CA . PRO A 1 661 ? 51.724 -34.297 32.085 1.00 52.92 ? 672 PRO A CA 1 ATOM 4773 C C . PRO A 1 661 ? 51.482 -33.553 33.390 1.00 61.50 ? 672 PRO A C 1 ATOM 4774 O O . PRO A 1 661 ? 52.323 -32.765 33.830 1.00 70.65 ? 672 PRO A O 1 ATOM 4775 C CB . PRO A 1 661 ? 52.460 -35.605 32.373 1.00 54.77 ? 672 PRO A CB 1 ATOM 4776 C CG . PRO A 1 661 ? 53.900 -35.251 32.251 1.00 53.49 ? 672 PRO A CG 1 ATOM 4777 C CD . PRO A 1 661 ? 53.977 -34.226 31.157 1.00 65.67 ? 672 PRO A CD 1 ATOM 4778 N N . GLU A 1 662 ? 50.325 -33.802 33.994 1.00 57.95 ? 673 GLU A N 1 ATOM 4779 C CA . GLU A 1 662 ? 50.066 -33.366 35.355 1.00 56.86 ? 673 GLU A CA 1 ATOM 4780 C C . GLU A 1 662 ? 50.961 -34.174 36.291 1.00 60.64 ? 673 GLU A C 1 ATOM 4781 O O . GLU A 1 662 ? 51.186 -35.363 36.075 1.00 57.27 ? 673 GLU A O 1 ATOM 4782 C CB . GLU A 1 662 ? 48.596 -33.585 35.715 1.00 56.92 ? 673 GLU A CB 1 ATOM 4783 C CG . GLU A 1 662 ? 47.626 -32.729 34.922 1.00 59.87 ? 673 GLU A CG 1 ATOM 4784 C CD . GLU A 1 662 ? 46.186 -32.893 35.375 1.00 62.62 ? 673 GLU A CD 1 ATOM 4785 O OE1 . GLU A 1 662 ? 45.828 -33.981 35.869 1.00 58.89 ? 673 GLU A OE1 1 ATOM 4786 O OE2 . GLU A 1 662 ? 45.409 -31.927 35.235 1.00 69.41 ? 673 GLU A OE2 1 ATOM 4787 N N . LYS A 1 663 ? 51.485 -33.529 37.322 1.00 59.29 ? 674 LYS A N 1 ATOM 4788 C CA . LYS A 1 663 ? 52.325 -34.227 38.282 1.00 65.75 ? 674 LYS A CA 1 ATOM 4789 C C . LYS A 1 663 ? 51.868 -33.945 39.706 1.00 65.24 ? 674 LYS A C 1 ATOM 4790 O O . LYS A 1 663 ? 51.304 -32.888 39.985 1.00 58.67 ? 674 LYS A O 1 ATOM 4791 C CB . LYS A 1 663 ? 53.791 -33.835 38.101 1.00 57.21 ? 674 LYS A CB 1 ATOM 4792 C CG . LYS A 1 663 ? 54.411 -34.303 36.791 1.00 81.89 ? 674 LYS A CG 1 ATOM 4793 C CD . LYS A 1 663 ? 55.880 -33.898 36.719 1.00 95.80 ? 674 LYS A CD 1 ATOM 4794 C CE . LYS A 1 663 ? 56.554 -34.409 35.455 1.00 92.17 ? 674 LYS A CE 1 ATOM 4795 N NZ . LYS A 1 663 ? 56.709 -35.888 35.464 1.00 87.12 ? 674 LYS A NZ 1 ATOM 4796 N N . SER A 1 664 ? 52.103 -34.900 40.601 1.00 67.55 ? 675 SER A N 1 ATOM 4797 C CA . SER A 1 664 ? 51.776 -34.720 42.011 1.00 67.80 ? 675 SER A CA 1 ATOM 4798 C C . SER A 1 664 ? 52.844 -35.311 42.922 1.00 65.19 ? 675 SER A C 1 ATOM 4799 O O . SER A 1 664 ? 53.648 -36.146 42.500 1.00 75.13 ? 675 SER A O 1 ATOM 4800 C CB . SER A 1 664 ? 50.410 -35.323 42.339 1.00 77.56 ? 675 SER A CB 1 ATOM 4801 O OG . SER A 1 664 ? 50.383 -36.717 42.087 1.00 67.79 ? 675 SER A OG 1 ATOM 4802 N N . PHE A 1 665 ? 52.843 -34.869 44.176 1.00 69.98 ? 676 PHE A N 1 ATOM 4803 C CA . PHE A 1 665 ? 53.832 -35.307 45.158 1.00 76.81 ? 676 PHE A CA 1 ATOM 4804 C C . PHE A 1 665 ? 53.168 -35.434 46.524 1.00 76.63 ? 676 PHE A C 1 ATOM 4805 O O . PHE A 1 665 ? 52.546 -34.492 47.009 1.00 81.56 ? 676 PHE A O 1 ATOM 4806 C CB . PHE A 1 665 ? 54.994 -34.314 45.219 1.00 78.64 ? 676 PHE A CB 1 ATOM 4807 C CG . PHE A 1 665 ? 56.192 -34.822 45.969 1.00 90.87 ? 676 PHE A CG 1 ATOM 4808 C CD1 . PHE A 1 665 ? 57.182 -35.536 45.314 1.00 98.10 ? 676 PHE A CD1 1 ATOM 4809 C CD2 . PHE A 1 665 ? 56.336 -34.575 47.324 1.00 94.09 ? 676 PHE A CD2 1 ATOM 4810 C CE1 . PHE A 1 665 ? 58.291 -36.001 46.000 1.00 98.42 ? 676 PHE A CE1 1 ATOM 4811 C CE2 . PHE A 1 665 ? 57.442 -35.038 48.014 1.00 96.08 ? 676 PHE A CE2 1 ATOM 4812 C CZ . PHE A 1 665 ? 58.420 -35.749 47.350 1.00 94.61 ? 676 PHE A CZ 1 ATOM 4813 N N . ASN A 1 666 ? 53.309 -36.600 47.143 1.00 78.40 ? 677 ASN A N 1 ATOM 4814 C CA . ASN A 1 666 ? 52.561 -36.916 48.355 1.00 76.39 ? 677 ASN A CA 1 ATOM 4815 C C . ASN A 1 666 ? 53.443 -37.281 49.548 1.00 87.90 ? 677 ASN A C 1 ATOM 4816 O O . ASN A 1 666 ? 54.023 -38.368 49.593 1.00 92.29 ? 677 ASN A O 1 ATOM 4817 C CB . ASN A 1 666 ? 51.575 -38.049 48.059 1.00 81.06 ? 677 ASN A CB 1 ATOM 4818 C CG . ASN A 1 666 ? 50.819 -38.505 49.286 1.00 88.06 ? 677 ASN A CG 1 ATOM 4819 O OD1 . ASN A 1 666 ? 49.796 -37.926 49.647 1.00 85.78 ? 677 ASN A OD1 1 ATOM 4820 N ND2 . ASN A 1 666 ? 51.310 -39.563 49.927 1.00 94.20 ? 677 ASN A ND2 1 ATOM 4821 N N . LYS A 1 667 ? 53.548 -36.366 50.509 1.00 87.00 ? 678 LYS A N 1 ATOM 4822 C CA . LYS A 1 667 ? 54.236 -36.652 51.765 1.00 79.57 ? 678 LYS A CA 1 ATOM 4823 C C . LYS A 1 667 ? 53.190 -37.026 52.812 1.00 78.31 ? 678 LYS A C 1 ATOM 4824 O O . LYS A 1 667 ? 52.147 -36.380 52.919 1.00 81.52 ? 678 LYS A O 1 ATOM 4825 C CB . LYS A 1 667 ? 55.110 -35.463 52.211 1.00 75.98 ? 678 LYS A CB 1 ATOM 4826 C CG . LYS A 1 667 ? 54.524 -34.539 53.300 1.00 101.10 ? 678 LYS A CG 1 ATOM 4827 C CD . LYS A 1 667 ? 54.952 -34.952 54.726 1.00 114.29 ? 678 LYS A CD 1 ATOM 4828 C CE . LYS A 1 667 ? 54.649 -33.876 55.786 1.00 96.19 ? 678 LYS A CE 1 ATOM 4829 N NZ . LYS A 1 667 ? 53.190 -33.668 56.059 1.00 76.29 ? 678 LYS A NZ 1 ATOM 4830 N N . GLU A 1 668 ? 53.449 -38.089 53.563 1.00 70.01 ? 679 GLU A N 1 ATOM 4831 C CA . GLU A 1 668 ? 52.489 -38.534 54.568 1.00 106.06 ? 679 GLU A CA 1 ATOM 4832 C C . GLU A 1 668 ? 53.162 -39.157 55.797 1.00 105.99 ? 679 GLU A C 1 ATOM 4833 O O . GLU A 1 668 ? 53.862 -40.166 55.699 1.00 99.08 ? 679 GLU A O 1 ATOM 4834 C CB . GLU A 1 668 ? 51.473 -39.498 53.945 1.00 67.84 ? 679 GLU A CB 1 ATOM 4835 C CG . GLU A 1 668 ? 50.217 -39.718 54.777 1.00 97.33 ? 679 GLU A CG 1 ATOM 4836 C CD . GLU A 1 668 ? 49.123 -40.445 54.007 1.00 96.89 ? 679 GLU A CD 1 ATOM 4837 O OE1 . GLU A 1 668 ? 47.992 -40.549 54.530 1.00 90.20 ? 679 GLU A OE1 1 ATOM 4838 O OE2 . GLU A 1 668 ? 49.394 -40.911 52.879 1.00 101.23 ? 679 GLU A OE2 1 ATOM 4839 N N . ALA A 1 669 ? 52.951 -38.534 56.952 1.00 73.51 ? 680 ALA A N 1 ATOM 4840 C CA . ALA A 1 669 ? 53.464 -39.053 58.212 1.00 103.14 ? 680 ALA A CA 1 ATOM 4841 C C . ALA A 1 669 ? 52.318 -39.609 59.048 1.00 93.68 ? 680 ALA A C 1 ATOM 4842 O O . ALA A 1 669 ? 51.215 -39.056 59.042 1.00 74.10 ? 680 ALA A O 1 ATOM 4843 C CB . ALA A 1 669 ? 54.199 -37.968 58.976 1.00 77.86 ? 680 ALA A CB 1 ATOM 4844 N N . GLY A 1 670 ? 52.580 -40.699 59.765 1.00 95.86 ? 681 GLY A N 1 ATOM 4845 C CA . GLY A 1 670 ? 51.545 -41.344 60.551 1.00 76.67 ? 681 GLY A CA 1 ATOM 4846 C C . GLY A 1 670 ? 52.007 -42.072 61.801 1.00 89.93 ? 681 GLY A C 1 ATOM 4847 O O . GLY A 1 670 ? 53.165 -42.482 61.920 1.00 83.01 ? 681 GLY A O 1 ATOM 4848 N N . ILE A 1 671 ? 51.079 -42.233 62.738 1.00 79.40 ? 682 ILE A N 1 ATOM 4849 C CA . ILE A 1 671 ? 51.336 -42.947 63.979 1.00 81.72 ? 682 ILE A CA 1 ATOM 4850 C C . ILE A 1 671 ? 50.181 -43.904 64.256 1.00 87.22 ? 682 ILE A C 1 ATOM 4851 O O . ILE A 1 671 ? 49.014 -43.540 64.099 1.00 81.59 ? 682 ILE A O 1 ATOM 4852 C CB . ILE A 1 671 ? 51.515 -41.967 65.160 1.00 105.26 ? 682 ILE A CB 1 ATOM 4853 C CG1 . ILE A 1 671 ? 51.562 -42.717 66.492 1.00 116.78 ? 682 ILE A CG1 1 ATOM 4854 C CG2 . ILE A 1 671 ? 50.394 -40.940 65.181 1.00 107.87 ? 682 ILE A CG2 1 ATOM 4855 C CD1 . ILE A 1 671 ? 52.719 -43.676 66.619 1.00 126.15 ? 682 ILE A CD1 1 ATOM 4856 N N . VAL A 1 672 ? 50.506 -45.134 64.645 1.00 88.05 ? 683 VAL A N 1 ATOM 4857 C CA . VAL A 1 672 ? 49.485 -46.132 64.955 1.00 95.49 ? 683 VAL A CA 1 ATOM 4858 C C . VAL A 1 672 ? 49.758 -46.872 66.264 1.00 92.59 ? 683 VAL A C 1 ATOM 4859 O O . VAL A 1 672 ? 50.811 -47.482 66.435 1.00 87.20 ? 683 VAL A O 1 ATOM 4860 C CB . VAL A 1 672 ? 49.304 -47.157 63.803 1.00 97.30 ? 683 VAL A CB 1 ATOM 4861 C CG1 . VAL A 1 672 ? 50.638 -47.489 63.160 1.00 94.69 ? 683 VAL A CG1 1 ATOM 4862 C CG2 . VAL A 1 672 ? 48.604 -48.424 64.302 1.00 81.61 ? 683 VAL A CG2 1 ATOM 4863 N N . PHE A 1 673 ? 48.799 -46.808 67.181 1.00 96.14 ? 684 PHE A N 1 ATOM 4864 C CA . PHE A 1 673 ? 48.874 -47.544 68.436 1.00 102.75 ? 684 PHE A CA 1 ATOM 4865 C C . PHE A 1 673 ? 48.152 -48.873 68.282 1.00 106.64 ? 684 PHE A C 1 ATOM 4866 O O . PHE A 1 673 ? 46.948 -48.899 68.041 1.00 102.41 ? 684 PHE A O 1 ATOM 4867 C CB . PHE A 1 673 ? 48.213 -46.746 69.558 1.00 106.35 ? 684 PHE A CB 1 ATOM 4868 C CG . PHE A 1 673 ? 48.857 -45.417 69.819 1.00 112.44 ? 684 PHE A CG 1 ATOM 4869 C CD1 . PHE A 1 673 ? 50.234 -45.282 69.787 1.00 116.60 ? 684 PHE A CD1 1 ATOM 4870 C CD2 . PHE A 1 673 ? 48.083 -44.302 70.095 1.00 111.11 ? 684 PHE A CD2 1 ATOM 4871 C CE1 . PHE A 1 673 ? 50.830 -44.061 70.029 1.00 119.17 ? 684 PHE A CE1 1 ATOM 4872 C CE2 . PHE A 1 673 ? 48.672 -43.077 70.336 1.00 115.53 ? 684 PHE A CE2 1 ATOM 4873 C CZ . PHE A 1 673 ? 50.048 -42.956 70.304 1.00 120.78 ? 684 PHE A CZ 1 ATOM 4874 N N . LYS A 1 674 ? 48.884 -49.974 68.424 1.00 107.81 ? 685 LYS A N 1 ATOM 4875 C CA . LYS A 1 674 ? 48.289 -51.301 68.312 1.00 104.12 ? 685 LYS A CA 1 ATOM 4876 C C . LYS A 1 674 ? 48.430 -52.084 69.614 1.00 114.33 ? 685 LYS A C 1 ATOM 4877 O O . LYS A 1 674 ? 49.207 -51.706 70.489 1.00 128.40 ? 685 LYS A O 1 ATOM 4878 C CB . LYS A 1 674 ? 48.916 -52.067 67.149 1.00 98.15 ? 685 LYS A CB 1 ATOM 4879 C CG . LYS A 1 674 ? 50.430 -51.990 67.102 1.00 106.47 ? 685 LYS A CG 1 ATOM 4880 C CD . LYS A 1 674 ? 50.970 -52.596 65.817 1.00 120.12 ? 685 LYS A CD 1 ATOM 4881 C CE . LYS A 1 674 ? 52.491 -52.596 65.795 1.00 128.48 ? 685 LYS A CE 1 ATOM 4882 N NZ . LYS A 1 674 ? 53.026 -53.160 64.525 1.00 126.00 ? 685 LYS A NZ 1 ATOM 4883 N N . GLY A 1 675 ? 47.669 -53.167 69.747 1.00 112.50 ? 686 GLY A N 1 ATOM 4884 C CA . GLY A 1 675 ? 47.713 -53.975 70.954 1.00 115.58 ? 686 GLY A CA 1 ATOM 4885 C C . GLY A 1 675 ? 46.519 -54.896 71.132 1.00 112.50 ? 686 GLY A C 1 ATOM 4886 O O . GLY A 1 675 ? 45.896 -55.314 70.157 1.00 104.40 ? 686 GLY A O 1 ATOM 4887 N N . ASP A 1 676 ? 46.205 -55.213 72.385 1.00 114.47 ? 687 ASP A N 1 ATOM 4888 C CA . ASP A 1 676 ? 45.092 -56.104 72.704 1.00 114.13 ? 687 ASP A CA 1 ATOM 4889 C C . ASP A 1 676 ? 43.754 -55.446 72.383 1.00 110.14 ? 687 ASP A C 1 ATOM 4890 O O . ASP A 1 676 ? 42.785 -56.119 72.031 1.00 99.78 ? 687 ASP A O 1 ATOM 4891 C CB . ASP A 1 676 ? 45.126 -56.505 74.183 1.00 117.52 ? 687 ASP A CB 1 ATOM 4892 C CG . ASP A 1 676 ? 46.436 -57.159 74.586 1.00 115.58 ? 687 ASP A CG 1 ATOM 4893 O OD1 . ASP A 1 676 ? 47.496 -56.758 74.057 1.00 113.94 ? 687 ASP A OD1 1 ATOM 4894 O OD2 . ASP A 1 676 ? 46.405 -58.073 75.438 1.00 108.98 ? 687 ASP A OD2 1 ATOM 4895 N N . PHE A 1 677 ? 43.713 -54.124 72.513 1.00 112.94 ? 688 PHE A N 1 ATOM 4896 C CA . PHE A 1 677 ? 42.513 -53.342 72.236 1.00 111.57 ? 688 PHE A CA 1 ATOM 4897 C C . PHE A 1 677 ? 42.203 -53.303 70.741 1.00 106.28 ? 688 PHE A C 1 ATOM 4898 O O . PHE A 1 677 ? 41.110 -52.912 70.332 1.00 97.77 ? 688 PHE A O 1 ATOM 4899 C CB . PHE A 1 677 ? 42.698 -51.915 72.751 1.00 113.58 ? 688 PHE A CB 1 ATOM 4900 C CG . PHE A 1 677 ? 43.858 -51.196 72.123 1.00 118.54 ? 688 PHE A CG 1 ATOM 4901 C CD1 . PHE A 1 677 ? 43.666 -50.364 71.032 1.00 107.68 ? 688 PHE A CD1 1 ATOM 4902 C CD2 . PHE A 1 677 ? 45.144 -51.362 72.618 1.00 126.68 ? 688 PHE A CD2 1 ATOM 4903 C CE1 . PHE A 1 677 ? 44.732 -49.708 70.448 1.00 110.39 ? 688 PHE A CE1 1 ATOM 4904 C CE2 . PHE A 1 677 ? 46.214 -50.708 72.039 1.00 128.33 ? 688 PHE A CE2 1 ATOM 4905 C CZ . PHE A 1 677 ? 46.008 -49.879 70.953 1.00 121.52 ? 688 PHE A CZ 1 ATOM 4906 N N . GLY A 1 678 ? 43.179 -53.703 69.932 1.00 111.18 ? 689 GLY A N 1 ATOM 4907 C CA . GLY A 1 678 ? 43.053 -53.658 68.488 1.00 112.75 ? 689 GLY A CA 1 ATOM 4908 C C . GLY A 1 678 ? 44.129 -52.765 67.906 1.00 114.53 ? 689 GLY A C 1 ATOM 4909 O O . GLY A 1 678 ? 45.318 -53.073 68.005 1.00 116.69 ? 689 GLY A O 1 ATOM 4910 N N . ASN A 1 679 ? 43.706 -51.659 67.302 1.00 112.81 ? 690 ASN A N 1 ATOM 4911 C CA . ASN A 1 679 ? 44.633 -50.631 66.838 1.00 106.91 ? 690 ASN A CA 1 ATOM 4912 C C . ASN A 1 679 ? 43.944 -49.298 66.563 1.00 99.17 ? 690 ASN A C 1 ATOM 4913 O O . ASN A 1 679 ? 42.741 -49.250 66.315 1.00 97.24 ? 690 ASN A O 1 ATOM 4914 C CB . ASN A 1 679 ? 45.410 -51.097 65.604 1.00 99.83 ? 690 ASN A CB 1 ATOM 4915 C CG . ASN A 1 679 ? 44.507 -51.549 64.488 1.00 100.54 ? 690 ASN A CG 1 ATOM 4916 O OD1 . ASN A 1 679 ? 44.159 -52.726 64.393 1.00 108.66 ? 690 ASN A OD1 1 ATOM 4917 N ND2 . ASN A 1 679 ? 44.118 -50.615 63.631 1.00 103.19 ? 690 ASN A ND2 1 ATOM 4918 N N . LEU A 1 680 ? 44.720 -48.220 66.626 1.00 100.62 ? 691 LEU A N 1 ATOM 4919 C CA . LEU A 1 680 ? 44.232 -46.883 66.310 1.00 96.70 ? 691 LEU A CA 1 ATOM 4920 C C . LEU A 1 680 ? 45.274 -46.188 65.448 1.00 96.88 ? 691 LEU A C 1 ATOM 4921 O O . LEU A 1 680 ? 46.417 -46.022 65.866 1.00 103.33 ? 691 LEU A O 1 ATOM 4922 C CB . LEU A 1 680 ? 44.002 -46.079 67.588 1.00 96.60 ? 691 LEU A CB 1 ATOM 4923 C CG . LEU A 1 680 ? 42.747 -45.205 67.653 1.00 92.11 ? 691 LEU A CG 1 ATOM 4924 C CD1 . LEU A 1 680 ? 42.807 -44.282 68.858 1.00 90.77 ? 691 LEU A CD1 1 ATOM 4925 C CD2 . LEU A 1 680 ? 42.551 -44.410 66.375 1.00 87.53 ? 691 LEU A CD2 1 ATOM 4926 N N . GLU A 1 681 ? 44.878 -45.778 64.249 1.00 100.24 ? 692 GLU A N 1 ATOM 4927 C CA . GLU A 1 681 ? 45.826 -45.239 63.281 1.00 104.64 ? 692 GLU A CA 1 ATOM 4928 C C . GLU A 1 681 ? 45.504 -43.794 62.894 1.00 102.47 ? 692 GLU A C 1 ATOM 4929 O O . GLU A 1 681 ? 44.344 -43.443 62.670 1.00 99.15 ? 692 GLU A O 1 ATOM 4930 C CB . GLU A 1 681 ? 45.853 -46.131 62.038 1.00 116.06 ? 692 GLU A CB 1 ATOM 4931 C CG . GLU A 1 681 ? 47.006 -45.870 61.085 1.00 131.96 ? 692 GLU A CG 1 ATOM 4932 C CD . GLU A 1 681 ? 47.122 -46.941 60.014 1.00 139.72 ? 692 GLU A CD 1 ATOM 4933 O OE1 . GLU A 1 681 ? 46.325 -47.903 60.047 1.00 142.82 ? 692 GLU A OE1 1 ATOM 4934 O OE2 . GLU A 1 681 ? 48.009 -46.826 59.142 1.00 138.40 ? 692 GLU A OE2 1 ATOM 4935 N N . ALA A 1 682 ? 46.539 -42.961 62.826 1.00 98.66 ? 693 ALA A N 1 ATOM 4936 C CA . ALA A 1 682 ? 46.391 -41.570 62.407 1.00 86.27 ? 693 ALA A CA 1 ATOM 4937 C C . ALA A 1 682 ? 47.509 -41.176 61.453 1.00 90.40 ? 693 ALA A C 1 ATOM 4938 O O . ALA A 1 682 ? 48.636 -41.647 61.581 1.00 94.70 ? 693 ALA A O 1 ATOM 4939 C CB . ALA A 1 682 ? 46.380 -40.647 63.606 1.00 78.78 ? 693 ALA A CB 1 ATOM 4940 N N . SER A 1 683 ? 47.190 -40.306 60.501 1.00 90.57 ? 694 SER A N 1 ATOM 4941 C CA . SER A 1 683 ? 48.161 -39.870 59.505 1.00 83.97 ? 694 SER A CA 1 ATOM 4942 C C . SER A 1 683 ? 47.857 -38.464 58.987 1.00 85.84 ? 694 SER A C 1 ATOM 4943 O O . SER A 1 683 ? 46.697 -38.062 58.879 1.00 68.71 ? 694 SER A O 1 ATOM 4944 C CB . SER A 1 683 ? 48.208 -40.862 58.340 1.00 83.61 ? 694 SER A CB 1 ATOM 4945 O OG . SER A 1 683 ? 46.928 -41.009 57.748 1.00 79.46 ? 694 SER A OG 1 ATOM 4946 N N . TRP A 1 684 ? 48.914 -37.721 58.676 1.00 70.92 ? 695 TRP A N 1 ATOM 4947 C CA . TRP A 1 684 ? 48.783 -36.391 58.093 1.00 86.98 ? 695 TRP A CA 1 ATOM 4948 C C . TRP A 1 684 ? 49.430 -36.387 56.712 1.00 92.07 ? 695 TRP A C 1 ATOM 4949 O O . TRP A 1 684 ? 50.577 -36.805 56.558 1.00 96.20 ? 695 TRP A O 1 ATOM 4950 C CB . TRP A 1 684 ? 49.446 -35.343 58.991 1.00 92.75 ? 695 TRP A CB 1 ATOM 4951 C CG . TRP A 1 684 ? 48.796 -35.200 60.336 1.00 106.33 ? 695 TRP A CG 1 ATOM 4952 C CD1 . TRP A 1 684 ? 47.927 -34.223 60.727 1.00 110.18 ? 695 TRP A CD1 1 ATOM 4953 C CD2 . TRP A 1 684 ? 48.961 -36.065 61.469 1.00 112.60 ? 695 TRP A CD2 1 ATOM 4954 N NE1 . TRP A 1 684 ? 47.542 -34.424 62.032 1.00 107.86 ? 695 TRP A NE1 1 ATOM 4955 C CE2 . TRP A 1 684 ? 48.163 -35.548 62.509 1.00 110.99 ? 695 TRP A CE2 1 ATOM 4956 C CE3 . TRP A 1 684 ? 49.707 -37.225 61.704 1.00 113.93 ? 695 TRP A CE3 1 ATOM 4957 C CZ2 . TRP A 1 684 ? 48.088 -36.151 63.761 1.00 116.43 ? 695 TRP A CZ2 1 ATOM 4958 C CZ3 . TRP A 1 684 ? 49.630 -37.822 62.947 1.00 113.08 ? 695 TRP A CZ3 1 ATOM 4959 C CH2 . TRP A 1 684 ? 48.828 -37.285 63.959 1.00 118.61 ? 695 TRP A CH2 1 ATOM 4960 N N . PHE A 1 685 ? 48.698 -35.921 55.707 1.00 67.04 ? 696 PHE A N 1 ATOM 4961 C CA . PHE A 1 685 ? 49.209 -35.950 54.338 1.00 90.06 ? 696 PHE A CA 1 ATOM 4962 C C . PHE A 1 685 ? 49.330 -34.570 53.697 1.00 76.43 ? 696 PHE A C 1 ATOM 4963 O O . PHE A 1 685 ? 48.642 -33.625 54.082 1.00 74.31 ? 696 PHE A O 1 ATOM 4964 C CB . PHE A 1 685 ? 48.354 -36.866 53.456 1.00 63.76 ? 696 PHE A CB 1 ATOM 4965 C CG . PHE A 1 685 ? 46.881 -36.594 53.546 1.00 90.59 ? 696 PHE A CG 1 ATOM 4966 C CD1 . PHE A 1 685 ? 46.068 -37.372 54.356 1.00 102.34 ? 696 PHE A CD1 1 ATOM 4967 C CD2 . PHE A 1 685 ? 46.308 -35.560 52.825 1.00 79.96 ? 696 PHE A CD2 1 ATOM 4968 C CE1 . PHE A 1 685 ? 44.708 -37.128 54.439 1.00 103.18 ? 696 PHE A CE1 1 ATOM 4969 C CE2 . PHE A 1 685 ? 44.953 -35.310 52.906 1.00 84.13 ? 696 PHE A CE2 1 ATOM 4970 C CZ . PHE A 1 685 ? 44.150 -36.097 53.711 1.00 91.87 ? 696 PHE A CZ 1 ATOM 4971 N N . ASN A 1 686 ? 50.209 -34.474 52.708 1.00 73.55 ? 697 ASN A N 1 ATOM 4972 C CA . ASN A 1 686 ? 50.436 -33.233 51.991 1.00 73.57 ? 697 ASN A CA 1 ATOM 4973 C C . ASN A 1 686 ? 50.659 -33.514 50.511 1.00 78.91 ? 697 ASN A C 1 ATOM 4974 O O . ASN A 1 686 ? 51.791 -33.745 50.081 1.00 74.72 ? 697 ASN A O 1 ATOM 4975 C CB . ASN A 1 686 ? 51.646 -32.509 52.579 1.00 83.17 ? 697 ASN A CB 1 ATOM 4976 C CG . ASN A 1 686 ? 51.746 -31.067 52.124 1.00 106.46 ? 697 ASN A CG 1 ATOM 4977 O OD1 . ASN A 1 686 ? 51.368 -30.726 51.001 1.00 111.09 ? 697 ASN A OD1 1 ATOM 4978 N ND2 . ASN A 1 686 ? 52.263 -30.208 52.998 1.00 113.79 ? 697 ASN A ND2 1 ATOM 4979 N N . ASN A 1 687 ? 49.575 -33.493 49.737 1.00 79.88 ? 698 ASN A N 1 ATOM 4980 C CA . ASN A 1 687 ? 49.646 -33.747 48.299 1.00 70.06 ? 698 ASN A CA 1 ATOM 4981 C C . ASN A 1 687 ? 49.708 -32.458 47.486 1.00 77.48 ? 698 ASN A C 1 ATOM 4982 O O . ASN A 1 687 ? 48.825 -31.607 47.593 1.00 75.31 ? 698 ASN A O 1 ATOM 4983 C CB . ASN A 1 687 ? 48.455 -34.584 47.840 1.00 58.27 ? 698 ASN A CB 1 ATOM 4984 C CG . ASN A 1 687 ? 48.750 -35.383 46.581 1.00 101.43 ? 698 ASN A CG 1 ATOM 4985 O OD1 . ASN A 1 687 ? 47.899 -36.127 46.089 1.00 98.85 ? 698 ASN A OD1 1 ATOM 4986 N ND2 . ASN A 1 687 ? 49.965 -35.241 46.060 1.00 99.42 ? 698 ASN A ND2 1 ATOM 4987 N N . ALA A 1 688 ? 50.750 -32.329 46.670 1.00 81.02 ? 699 ALA A N 1 ATOM 4988 C CA . ALA A 1 688 ? 50.952 -31.136 45.854 1.00 71.39 ? 699 ALA A CA 1 ATOM 4989 C C . ALA A 1 688 ? 50.823 -31.426 44.362 1.00 69.82 ? 699 ALA A C 1 ATOM 4990 O O . ALA A 1 688 ? 51.713 -32.022 43.752 1.00 62.36 ? 699 ALA A O 1 ATOM 4991 C CB . ALA A 1 688 ? 52.300 -30.531 46.146 1.00 62.83 ? 699 ALA A CB 1 ATOM 4992 N N . TYR A 1 689 ? 49.714 -30.988 43.778 1.00 66.39 ? 700 TYR A N 1 ATOM 4993 C CA . TYR A 1 689 ? 49.485 -31.155 42.351 1.00 64.55 ? 700 TYR A CA 1 ATOM 4994 C C . TYR A 1 689 ? 50.138 -30.011 41.580 1.00 73.76 ? 700 TYR A C 1 ATOM 4995 O O . TYR A 1 689 ? 50.253 -28.894 42.084 1.00 81.25 ? 700 TYR A O 1 ATOM 4996 C CB . TYR A 1 689 ? 47.984 -31.246 42.066 1.00 58.45 ? 700 TYR A CB 1 ATOM 4997 C CG . TYR A 1 689 ? 47.303 -32.299 42.912 1.00 69.52 ? 700 TYR A CG 1 ATOM 4998 C CD1 . TYR A 1 689 ? 47.243 -33.620 42.492 1.00 69.90 ? 700 TYR A CD1 1 ATOM 4999 C CD2 . TYR A 1 689 ? 46.752 -31.978 44.146 1.00 66.14 ? 700 TYR A CD2 1 ATOM 5000 C CE1 . TYR A 1 689 ? 46.640 -34.589 43.267 1.00 71.00 ? 700 TYR A CE1 1 ATOM 5001 C CE2 . TYR A 1 689 ? 46.143 -32.942 44.929 1.00 76.88 ? 700 TYR A CE2 1 ATOM 5002 C CZ . TYR A 1 689 ? 46.092 -34.247 44.485 1.00 75.45 ? 700 TYR A CZ 1 ATOM 5003 O OH . TYR A 1 689 ? 45.493 -35.215 45.263 1.00 74.91 ? 700 TYR A OH 1 ATOM 5004 N N . ARG A 1 690 ? 50.578 -30.299 40.361 1.00 75.38 ? 701 ARG A N 1 ATOM 5005 C CA . ARG A 1 690 ? 51.305 -29.325 39.558 1.00 71.72 ? 701 ARG A CA 1 ATOM 5006 C C . ARG A 1 690 ? 51.045 -29.576 38.070 1.00 70.45 ? 701 ARG A C 1 ATOM 5007 O O . ARG A 1 690 ? 50.771 -30.710 37.663 1.00 61.78 ? 701 ARG A O 1 ATOM 5008 C CB . ARG A 1 690 ? 52.799 -29.402 39.890 1.00 79.23 ? 701 ARG A CB 1 ATOM 5009 C CG . ARG A 1 690 ? 53.710 -28.521 39.050 1.00 97.72 ? 701 ARG A CG 1 ATOM 5010 C CD . ARG A 1 690 ? 55.153 -28.632 39.519 1.00 108.47 ? 701 ARG A CD 1 ATOM 5011 N NE . ARG A 1 690 ? 55.436 -29.935 40.124 1.00 119.94 ? 701 ARG A NE 1 ATOM 5012 C CZ . ARG A 1 690 ? 55.885 -30.997 39.460 1.00 113.03 ? 701 ARG A CZ 1 ATOM 5013 N NH1 . ARG A 1 690 ? 56.108 -30.924 38.154 1.00 116.13 ? 701 ARG A NH1 1 ATOM 5014 N NH2 . ARG A 1 690 ? 56.112 -32.135 40.104 1.00 96.03 ? 701 ARG A NH2 1 ATOM 5015 N N . ASP A 1 691 ? 51.115 -28.510 37.275 1.00 67.54 ? 702 ASP A N 1 ATOM 5016 C CA . ASP A 1 691 ? 50.860 -28.568 35.835 1.00 71.62 ? 702 ASP A CA 1 ATOM 5017 C C . ASP A 1 691 ? 49.453 -29.062 35.526 1.00 70.23 ? 702 ASP A C 1 ATOM 5018 O O . ASP A 1 691 ? 49.249 -29.840 34.592 1.00 73.44 ? 702 ASP A O 1 ATOM 5019 C CB . ASP A 1 691 ? 51.895 -29.437 35.110 1.00 54.93 ? 702 ASP A CB 1 ATOM 5020 C CG . ASP A 1 691 ? 53.204 -28.721 34.891 1.00 81.32 ? 702 ASP A CG 1 ATOM 5021 O OD1 . ASP A 1 691 ? 53.205 -27.472 34.858 1.00 82.00 ? 702 ASP A OD1 1 ATOM 5022 O OD2 . ASP A 1 691 ? 54.234 -29.411 34.744 1.00 88.18 ? 702 ASP A OD2 1 ATOM 5023 N N . LEU A 1 692 ? 48.487 -28.610 36.318 1.00 60.73 ? 703 LEU A N 1 ATOM 5024 C CA . LEU A 1 692 ? 47.098 -28.977 36.090 1.00 62.73 ? 703 LEU A CA 1 ATOM 5025 C C . LEU A 1 692 ? 46.616 -28.471 34.732 1.00 63.61 ? 703 LEU A C 1 ATOM 5026 O O . LEU A 1 692 ? 46.882 -27.333 34.340 1.00 69.49 ? 703 LEU A O 1 ATOM 5027 C CB . LEU A 1 692 ? 46.208 -28.469 37.227 1.00 66.67 ? 703 LEU A CB 1 ATOM 5028 C CG . LEU A 1 692 ? 46.409 -29.206 38.555 1.00 67.02 ? 703 LEU A CG 1 ATOM 5029 C CD1 . LEU A 1 692 ? 45.583 -28.577 39.665 1.00 56.18 ? 703 LEU A CD1 1 ATOM 5030 C CD2 . LEU A 1 692 ? 46.076 -30.688 38.400 1.00 49.29 ? 703 LEU A CD2 1 ATOM 5031 N N . ILE A 1 693 ? 45.915 -29.337 34.013 1.00 59.91 ? 704 ILE A N 1 ATOM 5032 C CA . ILE A 1 693 ? 45.498 -29.050 32.651 1.00 57.18 ? 704 ILE A CA 1 ATOM 5033 C C . ILE A 1 693 ? 44.116 -28.399 32.615 1.00 59.46 ? 704 ILE A C 1 ATOM 5034 O O . ILE A 1 693 ? 43.144 -28.941 33.147 1.00 56.34 ? 704 ILE A O 1 ATOM 5035 C CB . ILE A 1 693 ? 45.505 -30.341 31.809 1.00 60.61 ? 704 ILE A CB 1 ATOM 5036 C CG1 . ILE A 1 693 ? 46.936 -30.872 31.683 1.00 56.41 ? 704 ILE A CG1 1 ATOM 5037 C CG2 . ILE A 1 693 ? 44.873 -30.105 30.436 1.00 55.79 ? 704 ILE A CG2 1 ATOM 5038 C CD1 . ILE A 1 693 ? 47.020 -32.308 31.202 1.00 56.37 ? 704 ILE A CD1 1 ATOM 5039 N N . VAL A 1 694 ? 44.037 -27.227 31.995 1.00 45.58 ? 705 VAL A N 1 ATOM 5040 C CA . VAL A 1 694 ? 42.767 -26.524 31.869 1.00 66.62 ? 705 VAL A CA 1 ATOM 5041 C C . VAL A 1 694 ? 42.712 -25.753 30.553 1.00 62.70 ? 705 VAL A C 1 ATOM 5042 O O . VAL A 1 694 ? 43.747 -25.445 29.960 1.00 63.01 ? 705 VAL A O 1 ATOM 5043 C CB . VAL A 1 694 ? 42.526 -25.565 33.060 1.00 63.01 ? 705 VAL A CB 1 ATOM 5044 C CG1 . VAL A 1 694 ? 43.301 -24.269 32.872 1.00 62.24 ? 705 VAL A CG1 1 ATOM 5045 C CG2 . VAL A 1 694 ? 41.034 -25.280 33.236 1.00 68.57 ? 705 VAL A CG2 1 ATOM 5046 N N . ARG A 1 695 ? 41.500 -25.455 30.096 1.00 52.03 ? 706 ARG A N 1 ATOM 5047 C CA . ARG A 1 695 ? 41.304 -24.695 28.871 1.00 49.36 ? 706 ARG A CA 1 ATOM 5048 C C . ARG A 1 695 ? 41.616 -23.221 29.116 1.00 57.01 ? 706 ARG A C 1 ATOM 5049 O O . ARG A 1 695 ? 40.947 -22.559 29.906 1.00 58.16 ? 706 ARG A O 1 ATOM 5050 C CB . ARG A 1 695 ? 39.866 -24.865 28.372 1.00 45.37 ? 706 ARG A CB 1 ATOM 5051 C CG . ARG A 1 695 ? 39.667 -24.618 26.885 1.00 52.17 ? 706 ARG A CG 1 ATOM 5052 C CD . ARG A 1 695 ? 39.525 -23.141 26.576 1.00 42.51 ? 706 ARG A CD 1 ATOM 5053 N NE . ARG A 1 695 ? 38.416 -22.544 27.311 1.00 64.90 ? 706 ARG A NE 1 ATOM 5054 C CZ . ARG A 1 695 ? 38.397 -21.284 27.738 1.00 76.19 ? 706 ARG A CZ 1 ATOM 5055 N NH1 . ARG A 1 695 ? 39.431 -20.481 27.503 1.00 57.81 ? 706 ARG A NH1 1 ATOM 5056 N NH2 . ARG A 1 695 ? 37.342 -20.827 28.399 1.00 82.24 ? 706 ARG A NH2 1 ATOM 5057 N N . GLY A 1 696 ? 42.635 -22.714 28.430 1.00 58.37 ? 707 GLY A N 1 ATOM 5058 C CA . GLY A 1 696 ? 43.036 -21.328 28.570 1.00 59.80 ? 707 GLY A CA 1 ATOM 5059 C C . GLY A 1 696 ? 43.880 -20.866 27.402 1.00 58.09 ? 707 GLY A C 1 ATOM 5060 O O . GLY A 1 696 ? 43.801 -21.427 26.315 1.00 67.05 ? 707 GLY A O 1 ATOM 5061 N N . TYR A 1 697 ? 44.691 -19.840 27.629 1.00 50.93 ? 708 TYR A N 1 ATOM 5062 C CA . TYR A 1 697 ? 45.553 -19.289 26.592 1.00 55.25 ? 708 TYR A CA 1 ATOM 5063 C C . TYR A 1 697 ? 47.004 -19.282 27.045 1.00 64.69 ? 708 TYR A C 1 ATOM 5064 O O . TYR A 1 697 ? 47.299 -19.122 28.233 1.00 54.69 ? 708 TYR A O 1 ATOM 5065 C CB . TYR A 1 697 ? 45.175 -17.842 26.292 1.00 59.88 ? 708 TYR A CB 1 ATOM 5066 C CG . TYR A 1 697 ? 43.985 -17.619 25.388 1.00 58.22 ? 708 TYR A CG 1 ATOM 5067 C CD1 . TYR A 1 697 ? 44.146 -17.492 24.011 1.00 65.72 ? 708 TYR A CD1 1 ATOM 5068 C CD2 . TYR A 1 697 ? 42.709 -17.480 25.912 1.00 52.35 ? 708 TYR A CD2 1 ATOM 5069 C CE1 . TYR A 1 697 ? 43.062 -17.261 23.181 1.00 51.19 ? 708 TYR A CE1 1 ATOM 5070 C CE2 . TYR A 1 697 ? 41.620 -17.246 25.091 1.00 64.44 ? 708 TYR A CE2 1 ATOM 5071 C CZ . TYR A 1 697 ? 41.803 -17.139 23.728 1.00 64.23 ? 708 TYR A CZ 1 ATOM 5072 O OH . TYR A 1 697 ? 40.719 -16.905 22.919 1.00 61.86 ? 708 TYR A OH 1 ATOM 5073 N N . GLU A 1 698 ? 47.910 -19.430 26.088 1.00 61.13 ? 709 GLU A N 1 ATOM 5074 C CA . GLU A 1 698 ? 49.322 -19.186 26.337 1.00 60.39 ? 709 GLU A CA 1 ATOM 5075 C C . GLU A 1 698 ? 49.510 -17.680 26.525 1.00 59.30 ? 709 GLU A C 1 ATOM 5076 O O . GLU A 1 698 ? 48.822 -16.883 25.891 1.00 58.37 ? 709 GLU A O 1 ATOM 5077 C CB . GLU A 1 698 ? 50.154 -19.699 25.162 1.00 63.49 ? 709 GLU A CB 1 ATOM 5078 C CG . GLU A 1 698 ? 51.652 -19.588 25.350 1.00 90.34 ? 709 GLU A CG 1 ATOM 5079 C CD . GLU A 1 698 ? 52.417 -20.512 24.423 1.00 102.64 ? 709 GLU A CD 1 ATOM 5080 O OE1 . GLU A 1 698 ? 51.804 -21.466 23.894 1.00 90.57 ? 709 GLU A OE1 1 ATOM 5081 O OE2 . GLU A 1 698 ? 53.630 -20.283 24.226 1.00 111.74 ? 709 GLU A OE2 1 ATOM 5082 N N . ALA A 1 699 ? 50.420 -17.284 27.408 1.00 65.55 ? 710 ALA A N 1 ATOM 5083 C CA . ALA A 1 699 ? 50.622 -15.863 27.685 1.00 63.59 ? 710 ALA A CA 1 ATOM 5084 C C . ALA A 1 699 ? 52.083 -15.448 27.563 1.00 71.69 ? 710 ALA A C 1 ATOM 5085 O O . ALA A 1 699 ? 52.988 -16.232 27.848 1.00 75.89 ? 710 ALA A O 1 ATOM 5086 C CB . ALA A 1 699 ? 50.080 -15.502 29.060 1.00 63.68 ? 710 ALA A CB 1 ATOM 5087 N N . GLN A 1 700 ? 52.299 -14.209 27.133 1.00 66.09 ? 711 GLN A N 1 ATOM 5088 C CA . GLN A 1 700 ? 53.642 -13.656 27.010 1.00 75.37 ? 711 GLN A CA 1 ATOM 5089 C C . GLN A 1 700 ? 53.605 -12.152 27.231 1.00 78.93 ? 711 GLN A C 1 ATOM 5090 O O . GLN A 1 700 ? 52.584 -11.508 26.993 1.00 82.87 ? 711 GLN A O 1 ATOM 5091 C CB . GLN A 1 700 ? 54.238 -13.969 25.636 1.00 82.07 ? 711 GLN A CB 1 ATOM 5092 C CG . GLN A 1 700 ? 53.516 -13.303 24.474 1.00 90.11 ? 711 GLN A CG 1 ATOM 5093 C CD . GLN A 1 700 ? 54.189 -13.563 23.138 1.00 98.19 ? 711 GLN A CD 1 ATOM 5094 O OE1 . GLN A 1 700 ? 55.270 -14.152 23.076 1.00 97.82 ? 711 GLN A OE1 1 ATOM 5095 N NE2 . GLN A 1 700 ? 53.549 -13.125 22.059 1.00 100.39 ? 711 GLN A NE2 1 ATOM 5096 N N . ILE A 1 701 ? 54.723 -11.596 27.688 1.00 90.00 ? 712 ILE A N 1 ATOM 5097 C CA . ILE A 1 701 ? 54.819 -10.165 27.957 1.00 92.68 ? 712 ILE A CA 1 ATOM 5098 C C . ILE A 1 701 ? 55.805 -9.510 26.998 1.00 87.71 ? 712 ILE A C 1 ATOM 5099 O O . ILE A 1 701 ? 57.017 -9.699 27.116 1.00 88.75 ? 712 ILE A O 1 ATOM 5100 C CB . ILE A 1 701 ? 55.263 -9.900 29.409 1.00 100.59 ? 712 ILE A CB 1 ATOM 5101 C CG1 . ILE A 1 701 ? 54.409 -10.718 30.382 1.00 108.46 ? 712 ILE A CG1 1 ATOM 5102 C CG2 . ILE A 1 701 ? 55.196 -8.412 29.729 1.00 95.88 ? 712 ILE A CG2 1 ATOM 5103 C CD1 . ILE A 1 701 ? 54.813 -10.573 31.835 1.00 118.47 ? 712 ILE A CD1 1 ATOM 5104 N N . LYS A 1 702 ? 55.279 -8.735 26.053 1.00 93.29 ? 713 LYS A N 1 ATOM 5105 C CA . LYS A 1 702 ? 56.097 -8.141 24.995 1.00 110.78 ? 713 LYS A CA 1 ATOM 5106 C C . LYS A 1 702 ? 56.708 -6.786 25.367 1.00 124.86 ? 713 LYS A C 1 ATOM 5107 O O . LYS A 1 702 ? 57.931 -6.646 25.430 1.00 133.34 ? 713 LYS A O 1 ATOM 5108 C CB . LYS A 1 702 ? 55.297 -8.031 23.693 1.00 110.05 ? 713 LYS A CB 1 ATOM 5109 C CG . LYS A 1 702 ? 55.781 -8.971 22.595 1.00 108.74 ? 713 LYS A CG 1 ATOM 5110 C CD . LYS A 1 702 ? 54.727 -9.165 21.519 1.00 100.72 ? 713 LYS A CD 1 ATOM 5111 C CE . LYS A 1 702 ? 54.224 -7.836 20.981 1.00 101.41 ? 713 LYS A CE 1 ATOM 5112 N NZ . LYS A 1 702 ? 53.082 -8.021 20.042 1.00 103.11 ? 713 LYS A NZ 1 ATOM 5113 N N . ASP A 1 703 ? 55.863 -5.788 25.607 1.00 122.11 ? 714 ASP A N 1 ATOM 5114 C CA . ASP A 1 703 ? 56.355 -4.455 25.945 1.00 119.17 ? 714 ASP A CA 1 ATOM 5115 C C . ASP A 1 703 ? 55.794 -3.969 27.278 1.00 109.66 ? 714 ASP A C 1 ATOM 5116 O O . ASP A 1 703 ? 55.176 -2.910 27.352 1.00 107.00 ? 714 ASP A O 1 ATOM 5117 C CB . ASP A 1 703 ? 56.024 -3.458 24.830 1.00 112.86 ? 714 ASP A CB 1 ATOM 5118 N N . GLY A 1 704 ? 56.016 -4.748 28.331 1.00 106.69 ? 715 GLY A N 1 ATOM 5119 C CA . GLY A 1 704 ? 55.506 -4.410 29.646 1.00 102.79 ? 715 GLY A CA 1 ATOM 5120 C C . GLY A 1 704 ? 54.165 -5.056 29.929 1.00 104.65 ? 715 GLY A C 1 ATOM 5121 O O . GLY A 1 704 ? 53.948 -5.614 31.005 1.00 103.25 ? 715 GLY A O 1 ATOM 5122 N N . LYS A 1 705 ? 53.264 -4.982 28.955 1.00 101.83 ? 716 LYS A N 1 ATOM 5123 C CA . LYS A 1 705 ? 51.934 -5.564 29.093 1.00 94.19 ? 716 LYS A CA 1 ATOM 5124 C C . LYS A 1 705 ? 51.918 -7.023 28.641 1.00 93.10 ? 716 LYS A C 1 ATOM 5125 O O . LYS A 1 705 ? 52.502 -7.374 27.615 1.00 92.61 ? 716 LYS A O 1 ATOM 5126 C CB . LYS A 1 705 ? 50.910 -4.755 28.292 1.00 86.95 ? 716 LYS A CB 1 ATOM 5127 N N . GLU A 1 706 ? 51.255 -7.872 29.414 1.00 73.57 ? 717 GLU A N 1 ATOM 5128 C CA . GLU A 1 706 ? 51.105 -9.262 29.022 1.00 95.39 ? 717 GLU A CA 1 ATOM 5129 C C . GLU A 1 706 ? 49.968 -9.373 28.016 1.00 91.14 ? 717 GLU A C 1 ATOM 5130 O O . GLU A 1 706 ? 49.137 -8.469 27.906 1.00 80.29 ? 717 GLU A O 1 ATOM 5131 C CB . GLU A 1 706 ? 50.852 -10.162 30.237 1.00 98.65 ? 717 GLU A CB 1 ATOM 5132 C CG . GLU A 1 706 ? 49.453 -10.082 30.816 1.00 106.13 ? 717 GLU A CG 1 ATOM 5133 C CD . GLU A 1 706 ? 49.200 -11.151 31.865 1.00 119.18 ? 717 GLU A CD 1 ATOM 5134 O OE1 . GLU A 1 706 ? 50.049 -12.058 32.014 1.00 114.58 ? 717 GLU A OE1 1 ATOM 5135 O OE2 . GLU A 1 706 ? 48.151 -11.083 32.540 1.00 128.73 ? 717 GLU A OE2 1 ATOM 5136 N N . GLU A 1 707 ? 49.945 -10.475 27.274 1.00 88.88 ? 718 GLU A N 1 ATOM 5137 C CA . GLU A 1 707 ? 48.920 -10.694 26.262 1.00 80.05 ? 718 GLU A CA 1 ATOM 5138 C C . GLU A 1 707 ? 48.738 -12.176 25.977 1.00 73.96 ? 718 GLU A C 1 ATOM 5139 O O . GLU A 1 707 ? 49.618 -12.988 26.259 1.00 76.74 ? 718 GLU A O 1 ATOM 5140 C CB . GLU A 1 707 ? 49.269 -9.950 24.971 1.00 87.83 ? 718 GLU A CB 1 ATOM 5141 C CG . GLU A 1 707 ? 50.581 -10.380 24.329 1.00 93.54 ? 718 GLU A CG 1 ATOM 5142 C CD . GLU A 1 707 ? 50.901 -9.598 23.064 1.00 97.95 ? 718 GLU A CD 1 ATOM 5143 O OE1 . GLU A 1 707 ? 50.256 -8.555 22.824 1.00 101.07 ? 718 GLU A OE1 1 ATOM 5144 O OE2 . GLU A 1 707 ? 51.796 -10.027 22.308 1.00 93.57 ? 718 GLU A OE2 1 ATOM 5145 N N . ALA A 1 708 ? 47.584 -12.523 25.421 1.00 67.75 ? 719 ALA A N 1 ATOM 5146 C CA . ALA A 1 708 ? 47.320 -13.893 25.010 1.00 68.23 ? 719 ALA A CA 1 ATOM 5147 C C . ALA A 1 708 ? 47.899 -14.152 23.631 1.00 60.22 ? 719 ALA A C 1 ATOM 5148 O O . ALA A 1 708 ? 47.772 -13.328 22.732 1.00 119.99 ? 719 ALA A O 1 ATOM 5149 C CB . ALA A 1 708 ? 45.829 -14.167 25.005 1.00 57.98 ? 719 ALA A CB 1 ATOM 5150 N N . LYS A 1 709 ? 48.544 -15.300 23.469 1.00 59.96 ? 720 LYS A N 1 ATOM 5151 C CA . LYS A 1 709 ? 48.977 -15.739 22.153 1.00 81.74 ? 720 LYS A CA 1 ATOM 5152 C C . LYS A 1 709 ? 48.378 -17.106 21.854 1.00 79.66 ? 720 LYS A C 1 ATOM 5153 O O . LYS A 1 709 ? 48.105 -17.886 22.768 1.00 80.10 ? 720 LYS A O 1 ATOM 5154 C CB . LYS A 1 709 ? 50.504 -15.783 22.058 1.00 86.28 ? 720 LYS A CB 1 ATOM 5155 C CG . LYS A 1 709 ? 51.170 -16.741 23.026 1.00 87.67 ? 720 LYS A CG 1 ATOM 5156 C CD . LYS A 1 709 ? 52.616 -16.997 22.631 1.00 95.56 ? 720 LYS A CD 1 ATOM 5157 C CE . LYS A 1 709 ? 52.706 -17.576 21.226 1.00 97.36 ? 720 LYS A CE 1 ATOM 5158 N NZ . LYS A 1 709 ? 54.114 -17.872 20.834 1.00 101.92 ? 720 LYS A NZ 1 ATOM 5159 N N . GLY A 1 710 ? 48.158 -17.384 20.573 1.00 84.24 ? 721 GLY A N 1 ATOM 5160 C CA . GLY A 1 710 ? 47.628 -18.669 20.157 1.00 54.49 ? 721 GLY A CA 1 ATOM 5161 C C . GLY A 1 710 ? 46.122 -18.775 20.295 1.00 57.21 ? 721 GLY A C 1 ATOM 5162 O O . GLY A 1 710 ? 45.431 -17.772 20.455 1.00 57.38 ? 721 GLY A O 1 ATOM 5163 N N . ASP A 1 711 ? 45.619 -20.004 20.237 1.00 56.53 ? 722 ASP A N 1 ATOM 5164 C CA . ASP A 1 711 ? 44.186 -20.265 20.289 1.00 52.89 ? 722 ASP A CA 1 ATOM 5165 C C . ASP A 1 711 ? 43.770 -20.665 21.698 1.00 58.40 ? 722 ASP A C 1 ATOM 5166 O O . ASP A 1 711 ? 44.617 -20.977 22.527 1.00 57.19 ? 722 ASP A O 1 ATOM 5167 C CB . ASP A 1 711 ? 43.826 -21.393 19.317 1.00 62.74 ? 722 ASP A CB 1 ATOM 5168 C CG . ASP A 1 711 ? 44.243 -21.095 17.892 1.00 69.06 ? 722 ASP A CG 1 ATOM 5169 O OD1 . ASP A 1 711 ? 44.118 -19.931 17.466 1.00 59.84 ? 722 ASP A OD1 1 ATOM 5170 O OD2 . ASP A 1 711 ? 44.697 -22.029 17.198 1.00 87.79 ? 722 ASP A OD2 1 ATOM 5171 N N . PRO A 1 712 ? 42.459 -20.638 21.980 1.00 65.67 ? 723 PRO A N 1 ATOM 5172 C CA . PRO A 1 712 ? 41.996 -21.265 23.216 1.00 45.92 ? 723 PRO A CA 1 ATOM 5173 C C . PRO A 1 712 ? 42.348 -22.748 23.181 1.00 47.01 ? 723 PRO A C 1 ATOM 5174 O O . PRO A 1 712 ? 41.912 -23.462 22.279 1.00 49.85 ? 723 PRO A O 1 ATOM 5175 C CB . PRO A 1 712 ? 40.478 -21.085 23.149 1.00 47.76 ? 723 PRO A CB 1 ATOM 5176 C CG . PRO A 1 712 ? 40.269 -19.925 22.276 1.00 53.69 ? 723 PRO A CG 1 ATOM 5177 C CD . PRO A 1 712 ? 41.370 -19.947 21.269 1.00 61.09 ? 723 PRO A CD 1 ATOM 5178 N N . ALA A 1 713 ? 43.137 -23.204 24.143 1.00 49.70 ? 724 ALA A N 1 ATOM 5179 C CA . ALA A 1 713 ? 43.612 -24.581 24.125 1.00 60.27 ? 724 ALA A CA 1 ATOM 5180 C C . ALA A 1 713 ? 43.695 -25.175 25.520 1.00 58.25 ? 724 ALA A C 1 ATOM 5181 O O . ALA A 1 713 ? 43.625 -24.460 26.516 1.00 65.91 ? 724 ALA A O 1 ATOM 5182 C CB . ALA A 1 713 ? 44.969 -24.660 23.438 1.00 58.97 ? 724 ALA A CB 1 ATOM 5183 N N . TYR A 1 714 ? 43.843 -26.492 25.585 1.00 56.26 ? 725 TYR A N 1 ATOM 5184 C CA . TYR A 1 714 ? 44.095 -27.156 26.854 1.00 55.37 ? 725 TYR A CA 1 ATOM 5185 C C . TYR A 1 714 ? 45.590 -27.143 27.149 1.00 48.08 ? 725 TYR A C 1 ATOM 5186 O O . TYR A 1 714 ? 46.381 -27.741 26.423 1.00 64.06 ? 725 TYR A O 1 ATOM 5187 C CB . TYR A 1 714 ? 43.539 -28.580 26.836 1.00 42.25 ? 725 TYR A CB 1 ATOM 5188 C CG . TYR A 1 714 ? 42.029 -28.615 26.872 1.00 55.41 ? 725 TYR A CG 1 ATOM 5189 C CD1 . TYR A 1 714 ? 41.294 -28.961 25.750 1.00 52.49 ? 725 TYR A CD1 1 ATOM 5190 C CD2 . TYR A 1 714 ? 41.339 -28.278 28.025 1.00 59.79 ? 725 TYR A CD2 1 ATOM 5191 C CE1 . TYR A 1 714 ? 39.912 -28.983 25.781 1.00 51.95 ? 725 TYR A CE1 1 ATOM 5192 C CE2 . TYR A 1 714 ? 39.960 -28.298 28.063 1.00 52.07 ? 725 TYR A CE2 1 ATOM 5193 C CZ . TYR A 1 714 ? 39.252 -28.648 26.941 1.00 53.31 ? 725 TYR A CZ 1 ATOM 5194 O OH . TYR A 1 714 ? 37.878 -28.666 26.982 1.00 59.47 ? 725 TYR A OH 1 ATOM 5195 N N . LEU A 1 715 ? 45.973 -26.437 28.207 1.00 57.03 ? 726 LEU A N 1 ATOM 5196 C CA . LEU A 1 715 ? 47.383 -26.268 28.547 1.00 64.95 ? 726 LEU A CA 1 ATOM 5197 C C . LEU A 1 715 ? 47.644 -26.553 30.016 1.00 57.86 ? 726 LEU A C 1 ATOM 5198 O O . LEU A 1 715 ? 46.730 -26.503 30.840 1.00 53.57 ? 726 LEU A O 1 ATOM 5199 C CB . LEU A 1 715 ? 47.838 -24.844 28.230 1.00 50.14 ? 726 LEU A CB 1 ATOM 5200 C CG . LEU A 1 715 ? 47.558 -24.352 26.814 1.00 63.13 ? 726 LEU A CG 1 ATOM 5201 C CD1 . LEU A 1 715 ? 47.900 -22.877 26.674 1.00 54.53 ? 726 LEU A CD1 1 ATOM 5202 C CD2 . LEU A 1 715 ? 48.339 -25.193 25.818 1.00 58.16 ? 726 LEU A CD2 1 ATOM 5203 N N . ASN A 1 716 ? 48.897 -26.859 30.335 1.00 53.06 ? 727 ASN A N 1 ATOM 5204 C CA . ASN A 1 716 ? 49.328 -26.951 31.721 1.00 61.46 ? 727 ASN A CA 1 ATOM 5205 C C . ASN A 1 716 ? 49.348 -25.550 32.307 1.00 66.68 ? 727 ASN A C 1 ATOM 5206 O O . ASN A 1 716 ? 50.132 -24.701 31.884 1.00 70.27 ? 727 ASN A O 1 ATOM 5207 C CB . ASN A 1 716 ? 50.714 -27.577 31.806 1.00 52.96 ? 727 ASN A CB 1 ATOM 5208 C CG . ASN A 1 716 ? 50.780 -28.922 31.127 1.00 68.84 ? 727 ASN A CG 1 ATOM 5209 O OD1 . ASN A 1 716 ? 51.410 -29.069 30.083 1.00 52.21 ? 727 ASN A OD1 1 ATOM 5210 N ND2 . ASN A 1 716 ? 50.125 -29.917 31.714 1.00 69.98 ? 727 ASN A ND2 1 ATOM 5211 N N . ALA A 1 717 ? 48.478 -25.299 33.274 1.00 59.51 ? 728 ALA A N 1 ATOM 5212 C CA . ALA A 1 717 ? 48.272 -23.934 33.722 1.00 62.49 ? 728 ALA A CA 1 ATOM 5213 C C . ALA A 1 717 ? 48.491 -23.735 35.217 1.00 62.68 ? 728 ALA A C 1 ATOM 5214 O O . ALA A 1 717 ? 48.945 -22.673 35.646 1.00 71.29 ? 728 ALA A O 1 ATOM 5215 C CB . ALA A 1 717 ? 46.881 -23.462 33.317 1.00 52.06 ? 728 ALA A CB 1 ATOM 5216 N N . GLN A 1 718 ? 48.189 -24.756 36.010 1.00 63.64 ? 729 GLN A N 1 ATOM 5217 C CA . GLN A 1 718 ? 48.042 -24.549 37.448 1.00 64.36 ? 729 GLN A CA 1 ATOM 5218 C C . GLN A 1 718 ? 48.717 -25.555 38.371 1.00 63.80 ? 729 GLN A C 1 ATOM 5219 O O . GLN A 1 718 ? 48.975 -26.701 37.996 1.00 67.15 ? 729 GLN A O 1 ATOM 5220 C CB . GLN A 1 718 ? 46.563 -24.508 37.791 1.00 62.59 ? 729 GLN A CB 1 ATOM 5221 C CG . GLN A 1 718 ? 46.165 -23.299 38.562 1.00 62.08 ? 729 GLN A CG 1 ATOM 5222 C CD . GLN A 1 718 ? 44.683 -23.245 38.769 1.00 75.11 ? 729 GLN A CD 1 ATOM 5223 O OE1 . GLN A 1 718 ? 44.202 -22.595 39.691 1.00 94.65 ? 729 GLN A OE1 1 ATOM 5224 N NE2 . GLN A 1 718 ? 43.939 -23.931 37.910 1.00 55.20 ? 729 GLN A NE2 1 ATOM 5225 N N . SER A 1 719 ? 48.975 -25.104 39.595 1.00 65.91 ? 730 SER A N 1 ATOM 5226 C CA . SER A 1 719 ? 49.462 -25.965 40.665 1.00 60.58 ? 730 SER A CA 1 ATOM 5227 C C . SER A 1 719 ? 48.595 -25.773 41.904 1.00 58.68 ? 730 SER A C 1 ATOM 5228 O O . SER A 1 719 ? 48.028 -24.700 42.111 1.00 59.26 ? 730 SER A O 1 ATOM 5229 C CB . SER A 1 719 ? 50.916 -25.640 40.995 1.00 69.77 ? 730 SER A CB 1 ATOM 5230 O OG . SER A 1 719 ? 51.019 -24.386 41.648 1.00 82.81 ? 730 SER A OG 1 ATOM 5231 N N . ALA A 1 720 ? 48.487 -26.815 42.723 1.00 82.67 ? 731 ALA A N 1 ATOM 5232 C CA . ALA A 1 720 ? 47.711 -26.740 43.959 1.00 79.27 ? 731 ALA A CA 1 ATOM 5233 C C . ALA A 1 720 ? 48.147 -27.809 44.949 1.00 80.10 ? 731 ALA A C 1 ATOM 5234 O O . ALA A 1 720 ? 48.546 -28.906 44.558 1.00 80.80 ? 731 ALA A O 1 ATOM 5235 C CB . ALA A 1 720 ? 46.220 -26.859 43.672 1.00 58.64 ? 731 ALA A CB 1 ATOM 5236 N N . ARG A 1 721 ? 48.070 -27.482 46.235 1.00 90.86 ? 732 ARG A N 1 ATOM 5237 C CA . ARG A 1 721 ? 48.435 -28.429 47.282 1.00 90.11 ? 732 ARG A CA 1 ATOM 5238 C C . ARG A 1 721 ? 47.299 -28.619 48.283 1.00 80.48 ? 732 ARG A C 1 ATOM 5239 O O . ARG A 1 721 ? 46.532 -27.692 48.556 1.00 65.47 ? 732 ARG A O 1 ATOM 5240 C CB . ARG A 1 721 ? 49.720 -27.991 47.992 1.00 95.71 ? 732 ARG A CB 1 ATOM 5241 C CG . ARG A 1 721 ? 49.631 -26.642 48.687 1.00 111.79 ? 732 ARG A CG 1 ATOM 5242 C CD . ARG A 1 721 ? 50.988 -26.191 49.219 1.00 118.24 ? 732 ARG A CD 1 ATOM 5243 N NE . ARG A 1 721 ? 51.662 -27.239 49.981 1.00 120.62 ? 732 ARG A NE 1 ATOM 5244 C CZ . ARG A 1 721 ? 52.741 -27.892 49.558 1.00 118.03 ? 732 ARG A CZ 1 ATOM 5245 N NH1 . ARG A 1 721 ? 53.289 -28.831 50.316 1.00 120.10 ? 732 ARG A NH1 1 ATOM 5246 N NH2 . ARG A 1 721 ? 53.275 -27.601 48.380 1.00 107.02 ? 732 ARG A NH2 1 ATOM 5247 N N . ILE A 1 722 ? 47.183 -29.834 48.810 1.00 78.16 ? 733 ILE A N 1 ATOM 5248 C CA . ILE A 1 722 ? 46.150 -30.142 49.790 1.00 72.41 ? 733 ILE A CA 1 ATOM 5249 C C . ILE A 1 722 ? 46.730 -30.892 50.984 1.00 76.68 ? 733 ILE A C 1 ATOM 5250 O O . ILE A 1 722 ? 47.570 -31.779 50.831 1.00 75.70 ? 733 ILE A O 1 ATOM 5251 C CB . ILE A 1 722 ? 44.981 -30.945 49.165 1.00 78.83 ? 733 ILE A CB 1 ATOM 5252 C CG1 . ILE A 1 722 ? 45.496 -32.195 48.452 1.00 93.97 ? 733 ILE A CG1 1 ATOM 5253 C CG2 . ILE A 1 722 ? 44.186 -30.082 48.194 1.00 71.00 ? 733 ILE A CG2 1 ATOM 5254 C CD1 . ILE A 1 722 ? 45.334 -33.465 49.259 1.00 112.44 ? 733 ILE A CD1 1 ATOM 5255 N N . THR A 1 723 ? 46.288 -30.515 52.178 1.00 88.03 ? 734 THR A N 1 ATOM 5256 C CA . THR A 1 723 ? 46.701 -31.197 53.396 1.00 85.02 ? 734 THR A CA 1 ATOM 5257 C C . THR A 1 723 ? 45.478 -31.790 54.066 1.00 84.75 ? 734 THR A C 1 ATOM 5258 O O . THR A 1 723 ? 44.354 -31.358 53.802 1.00 65.47 ? 734 THR A O 1 ATOM 5259 C CB . THR A 1 723 ? 47.380 -30.240 54.383 1.00 83.48 ? 734 THR A CB 1 ATOM 5260 O OG1 . THR A 1 723 ? 46.435 -29.256 54.819 1.00 85.29 ? 734 THR A OG1 1 ATOM 5261 C CG2 . THR A 1 723 ? 48.566 -29.553 53.729 1.00 86.45 ? 734 THR A CG2 1 ATOM 5262 N N . GLY A 1 724 ? 45.691 -32.777 54.931 1.00 66.48 ? 735 GLY A N 1 ATOM 5263 C CA . GLY A 1 724 ? 44.588 -33.368 55.663 1.00 72.51 ? 735 GLY A CA 1 ATOM 5264 C C . GLY A 1 724 ? 44.948 -34.381 56.733 1.00 75.03 ? 735 GLY A C 1 ATOM 5265 O O . GLY A 1 724 ? 46.123 -34.636 57.011 1.00 68.16 ? 735 GLY A O 1 ATOM 5266 N N . ILE A 1 725 ? 43.910 -34.967 57.323 1.00 73.38 ? 736 ILE A N 1 ATOM 5267 C CA . ILE A 1 725 ? 44.053 -35.879 58.448 1.00 74.81 ? 736 ILE A CA 1 ATOM 5268 C C . ILE A 1 725 ? 43.126 -37.089 58.300 1.00 70.45 ? 736 ILE A C 1 ATOM 5269 O O . ILE A 1 725 ? 41.980 -36.956 57.866 1.00 66.55 ? 736 ILE A O 1 ATOM 5270 C CB . ILE A 1 725 ? 43.754 -35.147 59.783 1.00 76.85 ? 736 ILE A CB 1 ATOM 5271 C CG1 . ILE A 1 725 ? 43.730 -36.122 60.959 1.00 87.47 ? 736 ILE A CG1 1 ATOM 5272 C CG2 . ILE A 1 725 ? 42.431 -34.405 59.707 1.00 75.14 ? 736 ILE A CG2 1 ATOM 5273 C CD1 . ILE A 1 725 ? 45.075 -36.704 61.292 1.00 106.00 ? 736 ILE A CD1 1 ATOM 5274 N N . ASN A 1 726 ? 43.634 -38.269 58.645 1.00 69.76 ? 737 ASN A N 1 ATOM 5275 C CA . ASN A 1 726 ? 42.823 -39.481 58.671 1.00 74.00 ? 737 ASN A CA 1 ATOM 5276 C C . ASN A 1 726 ? 42.961 -40.242 59.988 1.00 83.20 ? 737 ASN A C 1 ATOM 5277 O O . ASN A 1 726 ? 44.071 -40.497 60.456 1.00 71.68 ? 737 ASN A O 1 ATOM 5278 C CB . ASN A 1 726 ? 43.180 -40.403 57.501 1.00 80.40 ? 737 ASN A CB 1 ATOM 5279 C CG . ASN A 1 726 ? 42.573 -39.945 56.190 1.00 99.21 ? 737 ASN A CG 1 ATOM 5280 O OD1 . ASN A 1 726 ? 41.443 -39.458 56.155 1.00 105.89 ? 737 ASN A OD1 1 ATOM 5281 N ND2 . ASN A 1 726 ? 43.322 -40.100 55.102 1.00 102.63 ? 737 ASN A ND2 1 ATOM 5282 N N . ILE A 1 727 ? 41.828 -40.598 60.584 1.00 89.35 ? 738 ILE A N 1 ATOM 5283 C CA . ILE A 1 727 ? 41.824 -41.460 61.758 1.00 83.37 ? 738 ILE A CA 1 ATOM 5284 C C . ILE A 1 727 ? 41.080 -42.750 61.433 1.00 83.74 ? 738 ILE A C 1 ATOM 5285 O O . ILE A 1 727 ? 39.965 -42.715 60.907 1.00 81.75 ? 738 ILE A O 1 ATOM 5286 C CB . ILE A 1 727 ? 41.139 -40.792 62.967 1.00 77.78 ? 738 ILE A CB 1 ATOM 5287 C CG1 . ILE A 1 727 ? 41.652 -39.366 63.175 1.00 73.66 ? 738 ILE A CG1 1 ATOM 5288 C CG2 . ILE A 1 727 ? 41.352 -41.626 64.217 1.00 77.19 ? 738 ILE A CG2 1 ATOM 5289 C CD1 . ILE A 1 727 ? 43.106 -39.292 63.540 1.00 74.55 ? 738 ILE A CD1 1 ATOM 5290 N N . LEU A 1 728 ? 41.699 -43.886 61.742 1.00 79.50 ? 739 LEU A N 1 ATOM 5291 C CA . LEU A 1 728 ? 41.076 -45.184 61.510 1.00 84.37 ? 739 LEU A CA 1 ATOM 5292 C C . LEU A 1 728 ? 41.460 -46.180 62.591 1.00 88.81 ? 739 LEU A C 1 ATOM 5293 O O . LEU A 1 728 ? 42.642 -46.386 62.862 1.00 96.75 ? 739 LEU A O 1 ATOM 5294 C CB . LEU A 1 728 ? 41.469 -45.739 60.140 1.00 89.51 ? 739 LEU A CB 1 ATOM 5295 C CG . LEU A 1 728 ? 41.030 -47.179 59.851 1.00 94.92 ? 739 LEU A CG 1 ATOM 5296 C CD1 . LEU A 1 728 ? 39.514 -47.319 59.925 1.00 90.46 ? 739 LEU A CD1 1 ATOM 5297 C CD2 . LEU A 1 728 ? 41.551 -47.646 58.497 1.00 90.94 ? 739 LEU A CD2 1 ATOM 5298 N N . GLY A 1 729 ? 40.458 -46.804 63.200 1.00 91.33 ? 740 GLY A N 1 ATOM 5299 C CA . GLY A 1 729 ? 40.711 -47.790 64.231 1.00 98.31 ? 740 GLY A CA 1 ATOM 5300 C C . GLY A 1 729 ? 39.580 -48.775 64.449 1.00 101.47 ? 740 GLY A C 1 ATOM 5301 O O . GLY A 1 729 ? 38.447 -48.554 64.017 1.00 100.02 ? 740 GLY A O 1 ATOM 5302 N N . LYS A 1 730 ? 39.904 -49.873 65.124 1.00 103.11 ? 741 LYS A N 1 ATOM 5303 C CA . LYS A 1 730 ? 38.914 -50.868 65.517 1.00 100.55 ? 741 LYS A CA 1 ATOM 5304 C C . LYS A 1 730 ? 39.177 -51.340 66.943 1.00 92.72 ? 741 LYS A C 1 ATOM 5305 O O . LYS A 1 730 ? 40.278 -51.781 67.268 1.00 98.36 ? 741 LYS A O 1 ATOM 5306 C CB . LYS A 1 730 ? 38.908 -52.049 64.541 1.00 103.04 ? 741 LYS A CB 1 ATOM 5307 C CG . LYS A 1 730 ? 40.291 -52.514 64.110 1.00 106.81 ? 741 LYS A CG 1 ATOM 5308 C CD . LYS A 1 730 ? 40.203 -53.509 62.960 1.00 107.21 ? 741 LYS A CD 1 ATOM 5309 C CE . LYS A 1 730 ? 41.584 -53.864 62.423 1.00 100.52 ? 741 LYS A CE 1 ATOM 5310 N NZ . LYS A 1 730 ? 41.515 -54.829 61.289 1.00 89.18 ? 741 LYS A NZ 1 ATOM 5311 N N . ILE A 1 731 ? 38.160 -51.228 67.792 1.00 77.57 ? 742 ILE A N 1 ATOM 5312 C CA . ILE A 1 731 ? 38.267 -51.634 69.186 1.00 82.63 ? 742 ILE A CA 1 ATOM 5313 C C . ILE A 1 731 ? 37.844 -53.095 69.376 1.00 90.28 ? 742 ILE A C 1 ATOM 5314 O O . ILE A 1 731 ? 36.953 -53.587 68.684 1.00 96.32 ? 742 ILE A O 1 ATOM 5315 C CB . ILE A 1 731 ? 37.412 -50.725 70.092 1.00 77.24 ? 742 ILE A CB 1 ATOM 5316 N N . ASP A 1 732 ? 38.491 -53.782 70.314 1.00 102.20 ? 743 ASP A N 1 ATOM 5317 C CA . ASP A 1 732 ? 38.176 -55.179 70.611 1.00 114.79 ? 743 ASP A CA 1 ATOM 5318 C C . ASP A 1 732 ? 37.162 -55.249 71.749 1.00 112.17 ? 743 ASP A C 1 ATOM 5319 O O . ASP A 1 732 ? 36.566 -56.293 72.008 1.00 111.12 ? 743 ASP A O 1 ATOM 5320 C CB . ASP A 1 732 ? 39.451 -55.937 70.999 1.00 121.46 ? 743 ASP A CB 1 ATOM 5321 C CG . ASP A 1 732 ? 39.366 -57.432 70.712 1.00 123.76 ? 743 ASP A CG 1 ATOM 5322 O OD1 . ASP A 1 732 ? 40.374 -58.003 70.243 1.00 123.37 ? 743 ASP A OD1 1 ATOM 5323 O OD2 . ASP A 1 732 ? 38.305 -58.041 70.956 1.00 125.11 ? 743 ASP A OD2 1 ATOM 5324 N N . TRP A 1 733 ? 36.973 -54.118 72.422 1.00 109.09 ? 744 TRP A N 1 ATOM 5325 C CA . TRP A 1 733 ? 36.114 -54.030 73.603 1.00 112.13 ? 744 TRP A CA 1 ATOM 5326 C C . TRP A 1 733 ? 36.484 -55.015 74.710 1.00 116.40 ? 744 TRP A C 1 ATOM 5327 O O . TRP A 1 733 ? 35.647 -55.383 75.536 1.00 110.58 ? 744 TRP A O 1 ATOM 5328 C CB . TRP A 1 733 ? 34.628 -54.146 73.241 1.00 99.00 ? 744 TRP A CB 1 ATOM 5329 C CG . TRP A 1 733 ? 34.066 -52.912 72.605 1.00 103.46 ? 744 TRP A CG 1 ATOM 5330 C CD1 . TRP A 1 733 ? 33.306 -52.854 71.477 1.00 108.18 ? 744 TRP A CD1 1 ATOM 5331 C CD2 . TRP A 1 733 ? 34.227 -51.555 73.051 1.00 101.84 ? 744 TRP A CD2 1 ATOM 5332 N NE1 . TRP A 1 733 ? 32.975 -51.551 71.196 1.00 108.39 ? 744 TRP A NE1 1 ATOM 5333 C CE2 . TRP A 1 733 ? 33.531 -50.735 72.145 1.00 105.51 ? 744 TRP A CE2 1 ATOM 5334 C CE3 . TRP A 1 733 ? 34.889 -50.957 74.130 1.00 93.43 ? 744 TRP A CE3 1 ATOM 5335 C CZ2 . TRP A 1 733 ? 33.476 -49.349 72.282 1.00 103.47 ? 744 TRP A CZ2 1 ATOM 5336 C CZ3 . TRP A 1 733 ? 34.836 -49.584 74.263 1.00 95.29 ? 744 TRP A CZ3 1 ATOM 5337 C CH2 . TRP A 1 733 ? 34.133 -48.794 73.345 1.00 102.25 ? 744 TRP A CH2 1 ATOM 5338 N N . ASN A 1 734 ? 37.743 -55.436 74.720 1.00 119.11 ? 745 ASN A N 1 ATOM 5339 C CA . ASN A 1 734 ? 38.252 -56.256 75.805 1.00 123.51 ? 745 ASN A CA 1 ATOM 5340 C C . ASN A 1 734 ? 39.277 -55.495 76.639 1.00 122.96 ? 745 ASN A C 1 ATOM 5341 O O . ASN A 1 734 ? 40.415 -55.293 76.206 1.00 111.63 ? 745 ASN A O 1 ATOM 5342 C CB . ASN A 1 734 ? 38.825 -57.581 75.286 1.00 121.67 ? 745 ASN A CB 1 ATOM 5343 C CG . ASN A 1 734 ? 37.749 -58.636 75.069 1.00 119.08 ? 745 ASN A CG 1 ATOM 5344 O OD1 . ASN A 1 734 ? 36.729 -58.373 74.433 1.00 108.78 ? 745 ASN A OD1 1 ATOM 5345 N ND2 . ASN A 1 734 ? 37.964 -59.831 75.620 1.00 86.28 ? 745 ASN A ND2 1 ATOM 5346 N N . GLY A 1 735 ? 38.850 -55.031 77.814 1.00 120.19 ? 746 GLY A N 1 ATOM 5347 C CA . GLY A 1 735 ? 37.451 -55.101 78.213 1.00 113.38 ? 746 GLY A CA 1 ATOM 5348 C C . GLY A 1 735 ? 37.066 -56.193 79.197 1.00 115.48 ? 746 GLY A C 1 ATOM 5349 O O . GLY A 1 735 ? 36.721 -55.902 80.342 1.00 115.89 ? 746 GLY A O 1 ATOM 5350 N N . VAL A 1 736 ? 37.116 -57.444 78.738 1.00 122.87 ? 747 VAL A N 1 ATOM 5351 C CA . VAL A 1 736 ? 36.726 -58.628 79.519 1.00 134.63 ? 747 VAL A CA 1 ATOM 5352 C C . VAL A 1 736 ? 35.363 -58.504 80.206 1.00 138.97 ? 747 VAL A C 1 ATOM 5353 O O . VAL A 1 736 ? 34.620 -59.484 80.320 1.00 91.01 ? 747 VAL A O 1 ATOM 5354 C CB . VAL A 1 736 ? 37.811 -59.058 80.555 1.00 111.44 ? 747 VAL A CB 1 ATOM 5355 C CG1 . VAL A 1 736 ? 39.204 -58.658 80.084 1.00 112.94 ? 747 VAL A CG1 1 ATOM 5356 C CG2 . VAL A 1 736 ? 37.516 -58.482 81.935 1.00 113.16 ? 747 VAL A CG2 1 ATOM 5357 N N . TRP A 1 744 ? 32.462 -58.441 71.270 1.00 103.08 ? 755 TRP A N 1 ATOM 5358 C CA . TRP A 1 744 ? 32.058 -57.634 70.124 1.00 101.05 ? 755 TRP A CA 1 ATOM 5359 C C . TRP A 1 744 ? 33.017 -56.478 69.838 1.00 101.62 ? 755 TRP A C 1 ATOM 5360 O O . TRP A 1 744 ? 33.980 -56.266 70.573 1.00 104.14 ? 755 TRP A O 1 ATOM 5361 C CB . TRP A 1 744 ? 30.619 -57.133 70.279 1.00 117.07 ? 755 TRP A CB 1 ATOM 5362 C CG . TRP A 1 744 ? 30.252 -56.637 71.643 1.00 120.10 ? 755 TRP A CG 1 ATOM 5363 C CD1 . TRP A 1 744 ? 31.083 -56.072 72.565 1.00 122.66 ? 755 TRP A CD1 1 ATOM 5364 C CD2 . TRP A 1 744 ? 28.949 -56.661 72.239 1.00 127.19 ? 755 TRP A CD2 1 ATOM 5365 N NE1 . TRP A 1 744 ? 30.378 -55.742 73.698 1.00 128.87 ? 755 TRP A NE1 1 ATOM 5366 C CE2 . TRP A 1 744 ? 29.065 -56.094 73.523 1.00 135.94 ? 755 TRP A CE2 1 ATOM 5367 C CE3 . TRP A 1 744 ? 27.695 -57.105 71.810 1.00 130.20 ? 755 TRP A CE3 1 ATOM 5368 C CZ2 . TRP A 1 744 ? 27.977 -55.962 74.384 1.00 144.64 ? 755 TRP A CZ2 1 ATOM 5369 C CZ3 . TRP A 1 744 ? 26.616 -56.975 72.663 1.00 141.84 ? 755 TRP A CZ3 1 ATOM 5370 C CH2 . TRP A 1 744 ? 26.763 -56.408 73.936 1.00 149.11 ? 755 TRP A CH2 1 ATOM 5371 N N . TYR A 1 745 ? 32.743 -55.733 68.769 1.00 103.62 ? 756 TYR A N 1 ATOM 5372 C CA . TYR A 1 745 ? 33.707 -54.775 68.228 1.00 98.87 ? 756 TYR A CA 1 ATOM 5373 C C . TYR A 1 745 ? 33.151 -53.375 67.992 1.00 100.31 ? 756 TYR A C 1 ATOM 5374 O O . TYR A 1 745 ? 31.985 -53.087 68.271 1.00 101.31 ? 756 TYR A O 1 ATOM 5375 C CB . TYR A 1 745 ? 34.290 -55.302 66.911 1.00 87.63 ? 756 TYR A CB 1 ATOM 5376 C CG . TYR A 1 745 ? 33.254 -55.497 65.823 1.00 93.54 ? 756 TYR A CG 1 ATOM 5377 C CD1 . TYR A 1 745 ? 33.065 -54.540 64.831 1.00 87.56 ? 756 TYR A CD1 1 ATOM 5378 C CD2 . TYR A 1 745 ? 32.460 -56.638 65.791 1.00 102.19 ? 756 TYR A CD2 1 ATOM 5379 C CE1 . TYR A 1 745 ? 32.115 -54.716 63.835 1.00 81.98 ? 756 TYR A CE1 1 ATOM 5380 C CE2 . TYR A 1 745 ? 31.508 -56.821 64.803 1.00 103.82 ? 756 TYR A CE2 1 ATOM 5381 C CZ . TYR A 1 745 ? 31.340 -55.859 63.828 1.00 93.72 ? 756 TYR A CZ 1 ATOM 5382 O OH . TYR A 1 745 ? 30.391 -56.051 62.850 1.00 88.33 ? 756 TYR A OH 1 ATOM 5383 N N . SER A 1 746 ? 34.013 -52.517 67.457 1.00 94.60 ? 757 SER A N 1 ATOM 5384 C CA . SER A 1 746 ? 33.661 -51.143 67.136 1.00 89.43 ? 757 SER A CA 1 ATOM 5385 C C . SER A 1 746 ? 34.614 -50.631 66.061 1.00 93.87 ? 757 SER A C 1 ATOM 5386 O O . SER A 1 746 ? 35.770 -51.050 66.003 1.00 103.83 ? 757 SER A O 1 ATOM 5387 C CB . SER A 1 746 ? 33.770 -50.265 68.382 1.00 85.99 ? 757 SER A CB 1 ATOM 5388 O OG . SER A 1 746 ? 32.695 -49.346 68.470 1.00 74.77 ? 757 SER A OG 1 ATOM 5389 N N . THR A 1 747 ? 34.131 -49.735 65.205 1.00 77.70 ? 758 THR A N 1 ATOM 5390 C CA . THR A 1 747 ? 34.981 -49.130 64.183 1.00 81.59 ? 758 THR A CA 1 ATOM 5391 C C . THR A 1 747 ? 34.889 -47.609 64.215 1.00 88.43 ? 758 THR A C 1 ATOM 5392 O O . THR A 1 747 ? 33.855 -47.046 64.572 1.00 98.16 ? 758 THR A O 1 ATOM 5393 C CB . THR A 1 747 ? 34.652 -49.645 62.758 1.00 79.51 ? 758 THR A CB 1 ATOM 5394 O OG1 . THR A 1 747 ? 33.245 -49.529 62.505 1.00 74.84 ? 758 THR A OG1 1 ATOM 5395 C CG2 . THR A 1 747 ? 35.072 -51.096 62.599 1.00 69.27 ? 758 THR A CG2 1 ATOM 5396 N N . PHE A 1 748 ? 35.978 -46.945 63.849 1.00 79.31 ? 759 PHE A N 1 ATOM 5397 C CA . PHE A 1 748 ? 35.992 -45.492 63.803 1.00 87.92 ? 759 PHE A CA 1 ATOM 5398 C C . PHE A 1 748 ? 36.734 -45.006 62.566 1.00 97.74 ? 759 PHE A C 1 ATOM 5399 O O . PHE A 1 748 ? 37.732 -45.603 62.158 1.00 101.91 ? 759 PHE A O 1 ATOM 5400 C CB . PHE A 1 748 ? 36.630 -44.912 65.068 1.00 93.59 ? 759 PHE A CB 1 ATOM 5401 C CG . PHE A 1 748 ? 36.647 -43.409 65.102 1.00 99.92 ? 759 PHE A CG 1 ATOM 5402 C CD1 . PHE A 1 748 ? 35.522 -42.700 65.485 1.00 105.36 ? 759 PHE A CD1 1 ATOM 5403 C CD2 . PHE A 1 748 ? 37.786 -42.704 64.745 1.00 99.66 ? 759 PHE A CD2 1 ATOM 5404 C CE1 . PHE A 1 748 ? 35.528 -41.316 65.514 1.00 105.67 ? 759 PHE A CE1 1 ATOM 5405 C CE2 . PHE A 1 748 ? 37.799 -41.318 64.769 1.00 102.91 ? 759 PHE A CE2 1 ATOM 5406 C CZ . PHE A 1 748 ? 36.669 -40.625 65.156 1.00 103.18 ? 759 PHE A CZ 1 ATOM 5407 N N . ALA A 1 749 ? 36.243 -43.920 61.973 1.00 96.20 ? 760 ALA A N 1 ATOM 5408 C CA . ALA A 1 749 ? 36.866 -43.347 60.785 1.00 81.28 ? 760 ALA A CA 1 ATOM 5409 C C . ALA A 1 749 ? 36.548 -41.862 60.635 1.00 81.51 ? 760 ALA A C 1 ATOM 5410 O O . ALA A 1 749 ? 35.416 -41.429 60.857 1.00 83.05 ? 760 ALA A O 1 ATOM 5411 C CB . ALA A 1 749 ? 36.446 -44.113 59.545 1.00 70.52 ? 760 ALA A CB 1 ATOM 5412 N N . TYR A 1 750 ? 37.557 -41.090 60.246 1.00 76.98 ? 761 TYR A N 1 ATOM 5413 C CA . TYR A 1 750 ? 37.422 -39.644 60.126 1.00 68.88 ? 761 TYR A CA 1 ATOM 5414 C C . TYR A 1 750 ? 38.330 -39.105 59.029 1.00 83.71 ? 761 TYR A C 1 ATOM 5415 O O . TYR A 1 750 ? 39.469 -39.551 58.884 1.00 95.18 ? 761 TYR A O 1 ATOM 5416 C CB . TYR A 1 750 ? 37.768 -38.978 61.460 1.00 71.66 ? 761 TYR A CB 1 ATOM 5417 C CG . TYR A 1 750 ? 37.889 -37.472 61.396 1.00 84.65 ? 761 TYR A CG 1 ATOM 5418 C CD1 . TYR A 1 750 ? 36.760 -36.665 61.432 1.00 94.60 ? 761 TYR A CD1 1 ATOM 5419 C CD2 . TYR A 1 750 ? 39.132 -36.857 61.308 1.00 85.69 ? 761 TYR A CD2 1 ATOM 5420 C CE1 . TYR A 1 750 ? 36.863 -35.287 61.376 1.00 94.52 ? 761 TYR A CE1 1 ATOM 5421 C CE2 . TYR A 1 750 ? 39.244 -35.478 61.250 1.00 90.11 ? 761 TYR A CE2 1 ATOM 5422 C CZ . TYR A 1 750 ? 38.105 -34.699 61.285 1.00 93.72 ? 761 TYR A CZ 1 ATOM 5423 O OH . TYR A 1 750 ? 38.206 -33.328 61.229 1.00 95.29 ? 761 TYR A OH 1 ATOM 5424 N N . ASN A 1 751 ? 37.825 -38.144 58.259 1.00 77.01 ? 762 ASN A N 1 ATOM 5425 C CA . ASN A 1 751 ? 38.630 -37.483 57.235 1.00 69.24 ? 762 ASN A CA 1 ATOM 5426 C C . ASN A 1 751 ? 38.346 -35.986 57.135 1.00 76.50 ? 762 ASN A C 1 ATOM 5427 O O . ASN A 1 751 ? 37.200 -35.548 57.226 1.00 84.60 ? 762 ASN A O 1 ATOM 5428 C CB . ASN A 1 751 ? 38.431 -38.147 55.872 1.00 72.87 ? 762 ASN A CB 1 ATOM 5429 C CG . ASN A 1 751 ? 39.222 -37.464 54.768 1.00 76.39 ? 762 ASN A CG 1 ATOM 5430 O OD1 . ASN A 1 751 ? 38.723 -36.559 54.101 1.00 76.35 ? 762 ASN A OD1 1 ATOM 5431 N ND2 . ASN A 1 751 ? 40.463 -37.896 54.574 1.00 84.48 ? 762 ASN A ND2 1 ATOM 5432 N N . ARG A 1 752 ? 39.402 -35.205 56.942 1.00 75.17 ? 763 ARG A N 1 ATOM 5433 C CA . ARG A 1 752 ? 39.274 -33.761 56.828 1.00 84.67 ? 763 ARG A CA 1 ATOM 5434 C C . ARG A 1 752 ? 40.321 -33.230 55.857 1.00 84.96 ? 763 ARG A C 1 ATOM 5435 O O . ARG A 1 752 ? 41.512 -33.232 56.157 1.00 90.20 ? 763 ARG A O 1 ATOM 5436 C CB . ARG A 1 752 ? 39.437 -33.110 58.202 1.00 99.35 ? 763 ARG A CB 1 ATOM 5437 C CG . ARG A 1 752 ? 39.350 -31.591 58.216 1.00 111.14 ? 763 ARG A CG 1 ATOM 5438 C CD . ARG A 1 752 ? 37.975 -31.107 57.793 1.00 120.40 ? 763 ARG A CD 1 ATOM 5439 N NE . ARG A 1 752 ? 37.668 -29.781 58.325 1.00 131.27 ? 763 ARG A NE 1 ATOM 5440 C CZ . ARG A 1 752 ? 36.958 -29.564 59.429 1.00 138.88 ? 763 ARG A CZ 1 ATOM 5441 N NH1 . ARG A 1 752 ? 36.472 -30.587 60.122 1.00 143.04 ? 763 ARG A NH1 1 ATOM 5442 N NH2 . ARG A 1 752 ? 36.730 -28.324 59.839 1.00 137.83 ? 763 ARG A NH2 1 ATOM 5443 N N . VAL A 1 753 ? 39.874 -32.790 54.687 1.00 83.90 ? 764 VAL A N 1 ATOM 5444 C CA . VAL A 1 753 ? 40.781 -32.258 53.679 1.00 84.53 ? 764 VAL A CA 1 ATOM 5445 C C . VAL A 1 753 ? 40.719 -30.735 53.675 1.00 85.06 ? 764 VAL A C 1 ATOM 5446 O O . VAL A 1 753 ? 39.652 -30.150 53.858 1.00 81.72 ? 764 VAL A O 1 ATOM 5447 C CB . VAL A 1 753 ? 40.438 -32.793 52.273 1.00 76.04 ? 764 VAL A CB 1 ATOM 5448 C CG1 . VAL A 1 753 ? 41.463 -32.326 51.255 1.00 76.25 ? 764 VAL A CG1 1 ATOM 5449 C CG2 . VAL A 1 753 ? 40.369 -34.310 52.287 1.00 75.43 ? 764 VAL A CG2 1 ATOM 5450 N N . ARG A 1 754 ? 41.871 -30.099 53.486 1.00 83.36 ? 765 ARG A N 1 ATOM 5451 C CA . ARG A 1 754 ? 41.932 -28.648 53.363 1.00 91.23 ? 765 ARG A CA 1 ATOM 5452 C C . ARG A 1 754 ? 42.751 -28.227 52.150 1.00 96.17 ? 765 ARG A C 1 ATOM 5453 O O . ARG A 1 754 ? 43.767 -28.844 51.828 1.00 92.82 ? 765 ARG A O 1 ATOM 5454 C CB . ARG A 1 754 ? 42.504 -28.013 54.632 1.00 96.51 ? 765 ARG A CB 1 ATOM 5455 C CG . ARG A 1 754 ? 41.495 -27.872 55.758 1.00 98.65 ? 765 ARG A CG 1 ATOM 5456 C CD . ARG A 1 754 ? 42.090 -27.159 56.963 1.00 106.34 ? 765 ARG A CD 1 ATOM 5457 N NE . ARG A 1 754 ? 41.095 -26.974 58.015 1.00 123.92 ? 765 ARG A NE 1 ATOM 5458 C CZ . ARG A 1 754 ? 40.816 -27.879 58.949 1.00 141.94 ? 765 ARG A CZ 1 ATOM 5459 N NH1 . ARG A 1 754 ? 41.461 -29.039 58.968 1.00 143.39 ? 765 ARG A NH1 1 ATOM 5460 N NH2 . ARG A 1 754 ? 39.892 -27.624 59.865 1.00 148.39 ? 765 ARG A NH2 1 ATOM 5461 N N . VAL A 1 755 ? 42.297 -27.173 51.480 1.00 65.12 ? 766 VAL A N 1 ATOM 5462 C CA . VAL A 1 755 ? 43.011 -26.620 50.338 1.00 76.48 ? 766 VAL A CA 1 ATOM 5463 C C . VAL A 1 755 ? 43.934 -25.486 50.779 1.00 86.54 ? 766 VAL A C 1 ATOM 5464 O O . VAL A 1 755 ? 43.535 -24.614 51.551 1.00 71.34 ? 766 VAL A O 1 ATOM 5465 C CB . VAL A 1 755 ? 42.035 -26.080 49.283 1.00 69.83 ? 766 VAL A CB 1 ATOM 5466 C CG1 . VAL A 1 755 ? 42.794 -25.571 48.071 1.00 76.20 ? 766 VAL A CG1 1 ATOM 5467 C CG2 . VAL A 1 755 ? 41.045 -27.151 48.882 1.00 63.34 ? 766 VAL A CG2 1 ATOM 5468 N N . ARG A 1 756 ? 45.165 -25.498 50.278 1.00 99.77 ? 767 ARG A N 1 ATOM 5469 C CA . ARG A 1 756 ? 46.145 -24.477 50.630 1.00 100.41 ? 767 ARG A CA 1 ATOM 5470 C C . ARG A 1 756 ? 46.479 -23.581 49.436 1.00 109.15 ? 767 ARG A C 1 ATOM 5471 O O . ARG A 1 756 ? 45.607 -22.891 48.910 1.00 118.32 ? 767 ARG A O 1 ATOM 5472 C CB . ARG A 1 756 ? 47.410 -25.133 51.185 1.00 94.43 ? 767 ARG A CB 1 ATOM 5473 C CG . ARG A 1 756 ? 47.152 -26.046 52.376 1.00 101.15 ? 767 ARG A CG 1 ATOM 5474 C CD . ARG A 1 756 ? 46.845 -25.246 53.634 1.00 113.26 ? 767 ARG A CD 1 ATOM 5475 N NE . ARG A 1 756 ? 46.284 -26.073 54.700 1.00 115.74 ? 767 ARG A NE 1 ATOM 5476 C CZ . ARG A 1 756 ? 46.215 -25.699 55.974 1.00 114.02 ? 767 ARG A CZ 1 ATOM 5477 N NH1 . ARG A 1 756 ? 46.685 -24.515 56.342 1.00 115.55 ? 767 ARG A NH1 1 ATOM 5478 N NH2 . ARG A 1 756 ? 45.685 -26.508 56.883 1.00 108.52 ? 767 ARG A NH2 1 ATOM 5479 N N . ASP A 1 757 ? 47.738 -23.600 49.009 1.00 110.23 ? 768 ASP A N 1 ATOM 5480 C CA . ASP A 1 757 ? 48.200 -22.728 47.929 1.00 116.50 ? 768 ASP A CA 1 ATOM 5481 C C . ASP A 1 757 ? 47.649 -23.117 46.558 1.00 113.89 ? 768 ASP A C 1 ATOM 5482 O O . ASP A 1 757 ? 47.628 -24.294 46.198 1.00 118.20 ? 768 ASP A O 1 ATOM 5483 C CB . ASP A 1 757 ? 49.730 -22.706 47.874 1.00 130.40 ? 768 ASP A CB 1 ATOM 5484 C CG . ASP A 1 757 ? 50.350 -22.005 49.067 1.00 148.59 ? 768 ASP A CG 1 ATOM 5485 O OD1 . ASP A 1 757 ? 49.772 -21.002 49.536 1.00 156.49 ? 768 ASP A OD1 1 ATOM 5486 O OD2 . ASP A 1 757 ? 51.417 -22.458 49.534 1.00 151.60 ? 768 ASP A OD2 1 ATOM 5487 N N . ILE A 1 758 ? 47.205 -22.117 45.801 1.00 99.92 ? 769 ILE A N 1 ATOM 5488 C CA . ILE A 1 758 ? 46.802 -22.305 44.411 1.00 79.09 ? 769 ILE A CA 1 ATOM 5489 C C . ILE A 1 758 ? 47.510 -21.283 43.521 1.00 78.79 ? 769 ILE A C 1 ATOM 5490 O O . ILE A 1 758 ? 47.064 -20.143 43.399 1.00 78.83 ? 769 ILE A O 1 ATOM 5491 C CB . ILE A 1 758 ? 45.280 -22.134 44.217 1.00 82.85 ? 769 ILE A CB 1 ATOM 5492 C CG1 . ILE A 1 758 ? 44.494 -23.040 45.163 1.00 84.96 ? 769 ILE A CG1 1 ATOM 5493 C CG2 . ILE A 1 758 ? 44.889 -22.429 42.782 1.00 60.46 ? 769 ILE A CG2 1 ATOM 5494 C CD1 . ILE A 1 758 ? 42.995 -22.980 44.938 1.00 61.69 ? 769 ILE A CD1 1 ATOM 5495 N N . LYS A 1 759 ? 48.614 -21.689 42.902 1.00 82.31 ? 770 LYS A N 1 ATOM 5496 C CA . LYS A 1 759 ? 49.367 -20.787 42.035 1.00 85.18 ? 770 LYS A CA 1 ATOM 5497 C C . LYS A 1 759 ? 49.188 -21.099 40.545 1.00 87.38 ? 770 LYS A C 1 ATOM 5498 O O . LYS A 1 759 ? 49.293 -22.250 40.116 1.00 82.94 ? 770 LYS A O 1 ATOM 5499 C CB . LYS A 1 759 ? 50.852 -20.789 42.409 1.00 86.38 ? 770 LYS A CB 1 ATOM 5500 C CG . LYS A 1 759 ? 51.147 -20.143 43.752 1.00 105.99 ? 770 LYS A CG 1 ATOM 5501 C CD . LYS A 1 759 ? 52.640 -20.119 44.046 1.00 121.98 ? 770 LYS A CD 1 ATOM 5502 C CE . LYS A 1 759 ? 52.937 -19.399 45.357 1.00 132.46 ? 770 LYS A CE 1 ATOM 5503 N NZ . LYS A 1 759 ? 52.299 -20.061 46.530 1.00 131.49 ? 770 LYS A NZ 1 ATOM 5504 N N . LYS A 1 760 ? 48.914 -20.059 39.766 1.00 82.78 ? 771 LYS A N 1 ATOM 5505 C CA . LYS A 1 760 ? 48.766 -20.183 38.322 1.00 73.71 ? 771 LYS A CA 1 ATOM 5506 C C . LYS A 1 760 ? 50.070 -19.800 37.626 1.00 70.69 ? 771 LYS A C 1 ATOM 5507 O O . LYS A 1 760 ? 50.779 -18.903 38.079 1.00 79.14 ? 771 LYS A O 1 ATOM 5508 C CB . LYS A 1 760 ? 47.616 -19.299 37.840 1.00 68.58 ? 771 LYS A CB 1 ATOM 5509 C CG . LYS A 1 760 ? 47.904 -18.519 36.575 1.00 64.92 ? 771 LYS A CG 1 ATOM 5510 C CD . LYS A 1 760 ? 46.814 -17.508 36.296 1.00 60.84 ? 771 LYS A CD 1 ATOM 5511 C CE . LYS A 1 760 ? 47.234 -16.558 35.192 1.00 64.81 ? 771 LYS A CE 1 ATOM 5512 N NZ . LYS A 1 760 ? 48.530 -15.884 35.496 1.00 75.27 ? 771 LYS A NZ 1 ATOM 5513 N N . ARG A 1 761 ? 50.394 -20.494 36.539 1.00 62.84 ? 772 ARG A N 1 ATOM 5514 C CA . ARG A 1 761 ? 51.613 -20.210 35.786 1.00 73.78 ? 772 ARG A CA 1 ATOM 5515 C C . ARG A 1 761 ? 51.588 -18.822 35.145 1.00 83.60 ? 772 ARG A C 1 ATOM 5516 O O . ARG A 1 761 ? 50.558 -18.380 34.632 1.00 89.76 ? 772 ARG A O 1 ATOM 5517 C CB . ARG A 1 761 ? 51.844 -21.281 34.721 1.00 64.55 ? 772 ARG A CB 1 ATOM 5518 C CG . ARG A 1 761 ? 52.234 -22.628 35.289 1.00 57.18 ? 772 ARG A CG 1 ATOM 5519 C CD . ARG A 1 761 ? 52.229 -23.710 34.223 1.00 64.10 ? 772 ARG A CD 1 ATOM 5520 N NE . ARG A 1 761 ? 52.957 -23.327 33.017 1.00 71.54 ? 772 ARG A NE 1 ATOM 5521 C CZ . ARG A 1 761 ? 53.533 -24.197 32.191 1.00 78.76 ? 772 ARG A CZ 1 ATOM 5522 N NH1 . ARG A 1 761 ? 53.478 -25.497 32.458 1.00 80.15 ? 772 ARG A NH1 1 ATOM 5523 N NH2 . ARG A 1 761 ? 54.171 -23.770 31.107 1.00 73.12 ? 772 ARG A NH2 1 ATOM 5524 N N . ALA A 1 762 ? 52.729 -18.140 35.177 1.00 77.19 ? 773 ALA A N 1 ATOM 5525 C CA . ALA A 1 762 ? 52.825 -16.780 34.655 1.00 82.06 ? 773 ALA A CA 1 ATOM 5526 C C . ALA A 1 762 ? 52.768 -16.725 33.124 1.00 81.05 ? 773 ALA A C 1 ATOM 5527 O O . ALA A 1 762 ? 52.573 -15.658 32.540 1.00 82.24 ? 773 ALA A O 1 ATOM 5528 C CB . ALA A 1 762 ? 54.086 -16.106 35.168 1.00 62.95 ? 773 ALA A CB 1 ATOM 5529 N N . ASP A 1 763 ? 52.935 -17.874 32.479 1.00 77.24 ? 774 ASP A N 1 ATOM 5530 C CA . ASP A 1 763 ? 52.881 -17.940 31.022 1.00 75.31 ? 774 ASP A CA 1 ATOM 5531 C C . ASP A 1 763 ? 51.534 -18.457 30.516 1.00 73.23 ? 774 ASP A C 1 ATOM 5532 O O . ASP A 1 763 ? 51.451 -19.032 29.432 1.00 86.13 ? 774 ASP A O 1 ATOM 5533 C CB . ASP A 1 763 ? 54.038 -18.789 30.471 1.00 79.36 ? 774 ASP A CB 1 ATOM 5534 C CG . ASP A 1 763 ? 54.034 -20.217 31.004 1.00 87.06 ? 774 ASP A CG 1 ATOM 5535 O OD1 . ASP A 1 763 ? 54.768 -21.058 30.442 1.00 88.61 ? 774 ASP A OD1 1 ATOM 5536 O OD2 . ASP A 1 763 ? 53.303 -20.503 31.977 1.00 86.49 ? 774 ASP A OD2 1 ATOM 5537 N N . ARG A 1 764 ? 50.481 -18.250 31.304 1.00 62.72 ? 775 ARG A N 1 ATOM 5538 C CA . ARG A 1 764 ? 49.140 -18.700 30.935 1.00 71.77 ? 775 ARG A CA 1 ATOM 5539 C C . ARG A 1 764 ? 48.101 -17.652 31.330 1.00 66.12 ? 775 ARG A C 1 ATOM 5540 O O . ARG A 1 764 ? 48.329 -16.884 32.256 1.00 63.99 ? 775 ARG A O 1 ATOM 5541 C CB . ARG A 1 764 ? 48.816 -20.034 31.618 1.00 77.67 ? 775 ARG A CB 1 ATOM 5542 C CG . ARG A 1 764 ? 49.741 -21.195 31.245 1.00 80.83 ? 775 ARG A CG 1 ATOM 5543 C CD . ARG A 1 764 ? 49.442 -21.741 29.854 1.00 71.14 ? 775 ARG A CD 1 ATOM 5544 N NE . ARG A 1 764 ? 50.619 -21.747 28.985 1.00 82.26 ? 775 ARG A NE 1 ATOM 5545 C CZ . ARG A 1 764 ? 51.443 -22.781 28.834 1.00 74.86 ? 775 ARG A CZ 1 ATOM 5546 N NH1 . ARG A 1 764 ? 51.231 -23.906 29.501 1.00 71.51 ? 775 ARG A NH1 1 ATOM 5547 N NH2 . ARG A 1 764 ? 52.483 -22.687 28.015 1.00 69.70 ? 775 ARG A NH2 1 ATOM 5548 N N . THR A 1 765 ? 46.971 -17.617 30.625 1.00 55.27 ? 776 THR A N 1 ATOM 5549 C CA . THR A 1 765 ? 45.851 -16.744 30.998 1.00 67.63 ? 776 THR A CA 1 ATOM 5550 C C . THR A 1 765 ? 44.484 -17.329 30.649 1.00 70.02 ? 776 THR A C 1 ATOM 5551 O O . THR A 1 765 ? 44.386 -18.429 30.102 1.00 61.13 ? 776 THR A O 1 ATOM 5552 C CB . THR A 1 765 ? 45.947 -15.334 30.369 1.00 65.44 ? 776 THR A CB 1 ATOM 5553 O OG1 . THR A 1 765 ? 46.600 -15.410 29.095 1.00 59.97 ? 776 THR A OG1 1 ATOM 5554 C CG2 . THR A 1 765 ? 46.711 -14.390 31.281 1.00 72.20 ? 776 THR A CG2 1 ATOM 5555 N N . ASP A 1 766 ? 43.438 -16.565 30.962 1.00 77.85 ? 777 ASP A N 1 ATOM 5556 C CA . ASP A 1 766 ? 42.050 -17.015 30.858 1.00 55.25 ? 777 ASP A CA 1 ATOM 5557 C C . ASP A 1 766 ? 41.853 -18.266 31.704 1.00 66.31 ? 777 ASP A C 1 ATOM 5558 O O . ASP A 1 766 ? 41.022 -19.122 31.401 1.00 63.79 ? 777 ASP A O 1 ATOM 5559 C CB . ASP A 1 766 ? 41.645 -17.259 29.404 1.00 58.15 ? 777 ASP A CB 1 ATOM 5560 C CG . ASP A 1 766 ? 40.140 -17.310 29.217 1.00 71.19 ? 777 ASP A CG 1 ATOM 5561 O OD1 . ASP A 1 766 ? 39.409 -16.873 30.133 1.00 74.28 ? 777 ASP A OD1 1 ATOM 5562 O OD2 . ASP A 1 766 ? 39.690 -17.782 28.152 1.00 69.77 ? 777 ASP A OD2 1 ATOM 5563 N N . ILE A 1 767 ? 42.627 -18.346 32.782 1.00 57.41 ? 778 ILE A N 1 ATOM 5564 C CA . ILE A 1 767 ? 42.663 -19.523 33.634 1.00 59.44 ? 778 ILE A CA 1 ATOM 5565 C C . ILE A 1 767 ? 41.721 -19.405 34.823 1.00 62.64 ? 778 ILE A C 1 ATOM 5566 O O . ILE A 1 767 ? 42.004 -18.681 35.777 1.00 72.22 ? 778 ILE A O 1 ATOM 5567 C CB . ILE A 1 767 ? 44.091 -19.781 34.156 1.00 65.08 ? 778 ILE A CB 1 ATOM 5568 C CG1 . ILE A 1 767 ? 45.059 -19.952 32.983 1.00 66.58 ? 778 ILE A CG1 1 ATOM 5569 C CG2 . ILE A 1 767 ? 44.124 -20.995 35.083 1.00 55.15 ? 778 ILE A CG2 1 ATOM 5570 C CD1 . ILE A 1 767 ? 44.618 -20.991 31.984 1.00 63.26 ? 778 ILE A CD1 1 ATOM 5571 N N . GLN A 1 768 ? 40.593 -20.104 34.744 1.00 55.31 ? 779 GLN A N 1 ATOM 5572 C CA . GLN A 1 768 ? 39.729 -20.300 35.896 1.00 71.36 ? 779 GLN A CA 1 ATOM 5573 C C . GLN A 1 768 ? 40.616 -20.974 36.919 1.00 72.89 ? 779 GLN A C 1 ATOM 5574 O O . GLN A 1 768 ? 41.314 -21.925 36.578 1.00 70.00 ? 779 GLN A O 1 ATOM 5575 C CB . GLN A 1 768 ? 38.569 -21.228 35.536 1.00 73.66 ? 779 GLN A CB 1 ATOM 5576 C CG . GLN A 1 768 ? 37.245 -20.869 36.183 1.00 80.47 ? 779 GLN A CG 1 ATOM 5577 C CD . GLN A 1 768 ? 37.328 -20.822 37.690 1.00 95.25 ? 779 GLN A CD 1 ATOM 5578 O OE1 . GLN A 1 768 ? 38.012 -21.634 38.313 1.00 104.59 ? 779 GLN A OE1 1 ATOM 5579 N NE2 . GLN A 1 768 ? 36.637 -19.860 38.287 1.00 94.76 ? 779 GLN A NE2 1 ATOM 5580 N N . SER A 1 769 ? 40.618 -20.471 38.152 1.00 78.94 ? 780 SER A N 1 ATOM 5581 C CA . SER A 1 769 ? 41.513 -20.995 39.181 1.00 81.26 ? 780 SER A CA 1 ATOM 5582 C C . SER A 1 769 ? 41.296 -22.494 39.414 1.00 89.60 ? 780 SER A C 1 ATOM 5583 O O . SER A 1 769 ? 41.764 -23.320 38.632 1.00 107.37 ? 780 SER A O 1 ATOM 5584 C CB . SER A 1 769 ? 41.410 -20.190 40.486 1.00 69.00 ? 780 SER A CB 1 ATOM 5585 O OG . SER A 1 769 ? 40.073 -20.081 40.939 1.00 78.66 ? 780 SER A OG 1 ATOM 5586 N N . HIS A 1 770 ? 40.600 -22.855 40.480 1.00 82.59 ? 781 HIS A N 1 ATOM 5587 C CA . HIS A 1 770 ? 40.286 -24.262 40.694 1.00 89.72 ? 781 HIS A CA 1 ATOM 5588 C C . HIS A 1 770 ? 39.178 -24.417 41.714 1.00 100.45 ? 781 HIS A C 1 ATOM 5589 O O . HIS A 1 770 ? 39.365 -24.149 42.902 1.00 108.22 ? 781 HIS A O 1 ATOM 5590 C CB . HIS A 1 770 ? 41.523 -25.060 41.122 1.00 82.27 ? 781 HIS A CB 1 ATOM 5591 C CG . HIS A 1 770 ? 41.484 -26.501 40.707 1.00 88.34 ? 781 HIS A CG 1 ATOM 5592 N ND1 . HIS A 1 770 ? 41.264 -27.529 41.599 1.00 83.14 ? 781 HIS A ND1 1 ATOM 5593 C CD2 . HIS A 1 770 ? 41.631 -27.083 39.492 1.00 80.25 ? 781 HIS A CD2 1 ATOM 5594 C CE1 . HIS A 1 770 ? 41.283 -28.681 40.953 1.00 71.87 ? 781 HIS A CE1 1 ATOM 5595 N NE2 . HIS A 1 770 ? 41.504 -28.439 39.674 1.00 62.49 ? 781 HIS A NE2 1 ATOM 5596 N N . LEU A 1 771 ? 38.014 -24.836 41.241 1.00 92.75 ? 782 LEU A N 1 ATOM 5597 C CA . LEU A 1 771 ? 36.913 -25.112 42.139 1.00 95.97 ? 782 LEU A CA 1 ATOM 5598 C C . LEU A 1 771 ? 37.072 -26.536 42.655 1.00 96.62 ? 782 LEU A C 1 ATOM 5599 O O . LEU A 1 771 ? 37.073 -27.492 41.880 1.00 105.21 ? 782 LEU A O 1 ATOM 5600 C CB . LEU A 1 771 ? 35.567 -24.929 41.433 1.00 92.77 ? 782 LEU A CB 1 ATOM 5601 C CG . LEU A 1 771 ? 35.227 -23.559 40.827 1.00 71.68 ? 782 LEU A CG 1 ATOM 5602 C CD1 . LEU A 1 771 ? 35.877 -22.409 41.594 1.00 59.11 ? 782 LEU A CD1 1 ATOM 5603 C CD2 . LEU A 1 771 ? 35.595 -23.511 39.361 1.00 56.59 ? 782 LEU A CD2 1 ATOM 5604 N N . PHE A 1 772 ? 37.232 -26.669 43.966 1.00 87.51 ? 783 PHE A N 1 ATOM 5605 C CA . PHE A 1 772 ? 37.384 -27.978 44.582 1.00 84.30 ? 783 PHE A CA 1 ATOM 5606 C C . PHE A 1 772 ? 36.033 -28.561 44.983 1.00 86.47 ? 783 PHE A C 1 ATOM 5607 O O . PHE A 1 772 ? 35.824 -28.942 46.135 1.00 91.12 ? 783 PHE A O 1 ATOM 5608 C CB . PHE A 1 772 ? 38.314 -27.895 45.793 1.00 78.53 ? 783 PHE A CB 1 ATOM 5609 C CG . PHE A 1 772 ? 39.772 -27.891 45.435 1.00 78.88 ? 783 PHE A CG 1 ATOM 5610 C CD1 . PHE A 1 772 ? 40.438 -29.080 45.183 1.00 71.55 ? 783 PHE A CD1 1 ATOM 5611 C CD2 . PHE A 1 772 ? 40.479 -26.703 45.354 1.00 81.36 ? 783 PHE A CD2 1 ATOM 5612 C CE1 . PHE A 1 772 ? 41.781 -29.083 44.853 1.00 74.08 ? 783 PHE A CE1 1 ATOM 5613 C CE2 . PHE A 1 772 ? 41.824 -26.701 45.024 1.00 76.13 ? 783 PHE A CE2 1 ATOM 5614 C CZ . PHE A 1 772 ? 42.476 -27.890 44.775 1.00 74.88 ? 783 PHE A CZ 1 ATOM 5615 N N . ASP A 1 773 ? 35.118 -28.630 44.021 1.00 81.96 ? 784 ASP A N 1 ATOM 5616 C CA . ASP A 1 773 ? 33.810 -29.221 44.257 1.00 78.78 ? 784 ASP A CA 1 ATOM 5617 C C . ASP A 1 773 ? 33.927 -30.732 44.428 1.00 78.17 ? 784 ASP A C 1 ATOM 5618 O O . ASP A 1 773 ? 33.012 -31.383 44.937 1.00 78.60 ? 784 ASP A O 1 ATOM 5619 C CB . ASP A 1 773 ? 32.837 -28.870 43.122 1.00 79.08 ? 784 ASP A CB 1 ATOM 5620 C CG . ASP A 1 773 ? 33.404 -29.166 41.739 1.00 70.98 ? 784 ASP A CG 1 ATOM 5621 O OD1 . ASP A 1 773 ? 33.170 -30.279 41.222 1.00 67.42 ? 784 ASP A OD1 1 ATOM 5622 O OD2 . ASP A 1 773 ? 34.072 -28.282 41.161 1.00 61.53 ? 784 ASP A OD2 1 ATOM 5623 N N . ALA A 1 774 ? 35.063 -31.285 44.014 1.00 73.36 ? 785 ALA A N 1 ATOM 5624 C CA . ALA A 1 774 ? 35.288 -32.724 44.112 1.00 81.61 ? 785 ALA A CA 1 ATOM 5625 C C . ALA A 1 774 ? 35.430 -33.203 45.558 1.00 70.80 ? 785 ALA A C 1 ATOM 5626 O O . ALA A 1 774 ? 35.024 -34.319 45.886 1.00 71.40 ? 785 ALA A O 1 ATOM 5627 C CB . ALA A 1 774 ? 36.507 -33.142 43.281 1.00 54.55 ? 785 ALA A CB 1 ATOM 5628 N N . ILE A 1 775 ? 36.001 -32.356 46.411 1.00 63.31 ? 786 ILE A N 1 ATOM 5629 C CA . ILE A 1 775 ? 36.283 -32.727 47.797 1.00 64.50 ? 786 ILE A CA 1 ATOM 5630 C C . ILE A 1 775 ? 35.037 -33.164 48.557 1.00 68.65 ? 786 ILE A C 1 ATOM 5631 O O . ILE A 1 775 ? 34.105 -32.382 48.737 1.00 60.80 ? 786 ILE A O 1 ATOM 5632 C CB . ILE A 1 775 ? 36.940 -31.572 48.582 1.00 70.41 ? 786 ILE A CB 1 ATOM 5633 C CG1 . ILE A 1 775 ? 38.250 -31.140 47.922 1.00 68.71 ? 786 ILE A CG1 1 ATOM 5634 C CG2 . ILE A 1 775 ? 37.188 -31.990 50.022 1.00 64.46 ? 786 ILE A CG2 1 ATOM 5635 C CD1 . ILE A 1 775 ? 39.089 -30.228 48.790 1.00 59.89 ? 786 ILE A CD1 1 ATOM 5636 N N . GLN A 1 776 ? 35.025 -34.418 48.998 1.00 75.59 ? 787 GLN A N 1 ATOM 5637 C CA . GLN A 1 776 ? 33.941 -34.913 49.833 1.00 76.05 ? 787 GLN A CA 1 ATOM 5638 C C . GLN A 1 776 ? 34.031 -34.206 51.179 1.00 77.60 ? 787 GLN A C 1 ATOM 5639 O O . GLN A 1 776 ? 35.114 -34.116 51.756 1.00 86.10 ? 787 GLN A O 1 ATOM 5640 C CB . GLN A 1 776 ? 34.050 -36.429 50.012 1.00 92.78 ? 787 GLN A CB 1 ATOM 5641 C CG . GLN A 1 776 ? 32.842 -37.067 50.687 1.00 111.18 ? 787 GLN A CG 1 ATOM 5642 C CD . GLN A 1 776 ? 32.999 -38.562 50.898 1.00 120.69 ? 787 GLN A CD 1 ATOM 5643 O OE1 . GLN A 1 776 ? 33.999 -39.025 51.450 1.00 123.30 ? 787 GLN A OE1 1 ATOM 5644 N NE2 . GLN A 1 776 ? 32.005 -39.327 50.459 1.00 121.58 ? 787 GLN A NE2 1 ATOM 5645 N N . PRO A 1 777 ? 32.896 -33.683 51.672 1.00 81.44 ? 788 PRO A N 1 ATOM 5646 C CA . PRO A 1 777 ? 32.857 -32.938 52.935 1.00 72.74 ? 788 PRO A CA 1 ATOM 5647 C C . PRO A 1 777 ? 33.368 -33.777 54.094 1.00 73.47 ? 788 PRO A C 1 ATOM 5648 O O . PRO A 1 777 ? 33.233 -34.999 54.058 1.00 85.09 ? 788 PRO A O 1 ATOM 5649 C CB . PRO A 1 777 ? 31.365 -32.654 53.126 1.00 84.24 ? 788 PRO A CB 1 ATOM 5650 C CG . PRO A 1 777 ? 30.790 -32.701 51.756 1.00 80.01 ? 788 PRO A CG 1 ATOM 5651 C CD . PRO A 1 777 ? 31.567 -33.762 51.040 1.00 85.17 ? 788 PRO A CD 1 ATOM 5652 N N . SER A 1 778 ? 33.950 -33.128 55.098 1.00 82.82 ? 789 SER A N 1 ATOM 5653 C CA . SER A 1 778 ? 34.473 -33.824 56.270 1.00 75.57 ? 789 SER A CA 1 ATOM 5654 C C . SER A 1 778 ? 33.415 -34.730 56.879 1.00 82.37 ? 789 SER A C 1 ATOM 5655 O O . SER A 1 778 ? 32.278 -34.314 57.098 1.00 90.54 ? 789 SER A O 1 ATOM 5656 C CB . SER A 1 778 ? 34.962 -32.825 57.315 1.00 73.49 ? 789 SER A CB 1 ATOM 5657 O OG . SER A 1 778 ? 35.750 -33.473 58.298 1.00 88.28 ? 789 SER A OG 1 ATOM 5658 N N . ARG A 1 779 ? 33.799 -35.972 57.145 1.00 85.02 ? 790 ARG A N 1 ATOM 5659 C CA . ARG A 1 779 ? 32.859 -36.982 57.604 1.00 80.38 ? 790 ARG A CA 1 ATOM 5660 C C . ARG A 1 779 ? 33.409 -37.776 58.791 1.00 84.46 ? 790 ARG A C 1 ATOM 5661 O O . ARG A 1 779 ? 34.610 -38.053 58.865 1.00 66.28 ? 790 ARG A O 1 ATOM 5662 C CB . ARG A 1 779 ? 32.523 -37.921 56.440 1.00 71.42 ? 790 ARG A CB 1 ATOM 5663 C CG . ARG A 1 779 ? 31.606 -39.076 56.783 1.00 68.29 ? 790 ARG A CG 1 ATOM 5664 C CD . ARG A 1 779 ? 31.387 -39.952 55.564 1.00 96.42 ? 790 ARG A CD 1 ATOM 5665 N NE . ARG A 1 779 ? 30.687 -39.242 54.495 1.00 118.51 ? 790 ARG A NE 1 ATOM 5666 C CZ . ARG A 1 779 ? 30.382 -39.777 53.317 1.00 132.19 ? 790 ARG A CZ 1 ATOM 5667 N NH1 . ARG A 1 779 ? 30.719 -41.032 53.049 1.00 134.04 ? 790 ARG A NH1 1 ATOM 5668 N NH2 . ARG A 1 779 ? 29.740 -39.058 52.405 1.00 137.20 ? 790 ARG A NH2 1 ATOM 5669 N N . TYR A 1 780 ? 32.522 -38.110 59.727 1.00 90.73 ? 791 TYR A N 1 ATOM 5670 C CA . TYR A 1 780 ? 32.816 -39.070 60.788 1.00 91.73 ? 791 TYR A CA 1 ATOM 5671 C C . TYR A 1 780 ? 31.984 -40.313 60.512 1.00 82.10 ? 791 TYR A C 1 ATOM 5672 O O . TYR A 1 780 ? 30.818 -40.208 60.130 1.00 79.67 ? 791 TYR A O 1 ATOM 5673 C CB . TYR A 1 780 ? 32.405 -38.534 62.168 1.00 96.65 ? 791 TYR A CB 1 ATOM 5674 C CG . TYR A 1 780 ? 33.079 -37.259 62.627 1.00 104.88 ? 791 TYR A CG 1 ATOM 5675 C CD1 . TYR A 1 780 ? 32.710 -36.026 62.102 1.00 108.97 ? 791 TYR A CD1 1 ATOM 5676 C CD2 . TYR A 1 780 ? 34.053 -37.282 63.619 1.00 109.65 ? 791 TYR A CD2 1 ATOM 5677 C CE1 . TYR A 1 780 ? 33.311 -34.855 62.527 1.00 108.04 ? 791 TYR A CE1 1 ATOM 5678 C CE2 . TYR A 1 780 ? 34.660 -36.113 64.053 1.00 114.28 ? 791 TYR A CE2 1 ATOM 5679 C CZ . TYR A 1 780 ? 34.283 -34.903 63.501 1.00 109.53 ? 791 TYR A CZ 1 ATOM 5680 O OH . TYR A 1 780 ? 34.876 -33.733 63.919 1.00 102.37 ? 791 TYR A OH 1 ATOM 5681 N N . VAL A 1 781 ? 32.564 -41.490 60.714 1.00 80.05 ? 792 VAL A N 1 ATOM 5682 C CA . VAL A 1 781 ? 31.773 -42.716 60.662 1.00 81.58 ? 792 VAL A CA 1 ATOM 5683 C C . VAL A 1 781 ? 32.220 -43.736 61.712 1.00 84.75 ? 792 VAL A C 1 ATOM 5684 O O . VAL A 1 781 ? 33.283 -44.348 61.606 1.00 91.43 ? 792 VAL A O 1 ATOM 5685 C CB . VAL A 1 781 ? 31.724 -43.331 59.244 1.00 80.30 ? 792 VAL A CB 1 ATOM 5686 C CG1 . VAL A 1 781 ? 33.097 -43.326 58.611 1.00 83.35 ? 792 VAL A CG1 1 ATOM 5687 C CG2 . VAL A 1 781 ? 31.140 -44.735 59.286 1.00 83.61 ? 792 VAL A CG2 1 ATOM 5688 N N . VAL A 1 782 ? 31.393 -43.890 62.740 1.00 88.16 ? 793 VAL A N 1 ATOM 5689 C CA . VAL A 1 782 ? 31.674 -44.809 63.832 1.00 92.91 ? 793 VAL A CA 1 ATOM 5690 C C . VAL A 1 782 ? 30.814 -46.058 63.699 1.00 91.22 ? 793 VAL A C 1 ATOM 5691 O O . VAL A 1 782 ? 29.756 -46.033 63.068 1.00 95.63 ? 793 VAL A O 1 ATOM 5692 C CB . VAL A 1 782 ? 31.411 -44.154 65.202 1.00 102.33 ? 793 VAL A CB 1 ATOM 5693 C CG1 . VAL A 1 782 ? 32.089 -42.798 65.275 1.00 97.05 ? 793 VAL A CG1 1 ATOM 5694 C CG2 . VAL A 1 782 ? 29.918 -44.007 65.449 1.00 108.01 ? 793 VAL A CG2 1 ATOM 5695 N N . GLY A 1 783 ? 31.268 -47.153 64.293 1.00 90.12 ? 794 GLY A N 1 ATOM 5696 C CA . GLY A 1 783 ? 30.558 -48.411 64.175 1.00 95.11 ? 794 GLY A CA 1 ATOM 5697 C C . GLY A 1 783 ? 30.478 -49.201 65.465 1.00 90.50 ? 794 GLY A C 1 ATOM 5698 O O . GLY A 1 783 ? 31.387 -49.163 66.293 1.00 80.60 ? 794 GLY A O 1 ATOM 5699 N N . LEU A 1 784 ? 29.375 -49.919 65.631 1.00 89.69 ? 795 LEU A N 1 ATOM 5700 C CA . LEU A 1 784 ? 29.197 -50.811 66.763 1.00 87.48 ? 795 LEU A CA 1 ATOM 5701 C C . LEU A 1 784 ? 28.470 -52.066 66.301 1.00 92.39 ? 795 LEU A C 1 ATOM 5702 O O . LEU A 1 784 ? 27.376 -51.986 65.740 1.00 96.02 ? 795 LEU A O 1 ATOM 5703 C CB . LEU A 1 784 ? 28.407 -50.117 67.869 1.00 86.33 ? 795 LEU A CB 1 ATOM 5704 C CG . LEU A 1 784 ? 28.072 -50.964 69.095 1.00 90.04 ? 795 LEU A CG 1 ATOM 5705 C CD1 . LEU A 1 784 ? 29.340 -51.505 69.742 1.00 80.05 ? 795 LEU A CD1 1 ATOM 5706 C CD2 . LEU A 1 784 ? 27.255 -50.151 70.087 1.00 91.83 ? 795 LEU A CD2 1 ATOM 5707 N N . GLY A 1 785 ? 29.082 -53.224 66.527 1.00 90.19 ? 796 GLY A N 1 ATOM 5708 C CA . GLY A 1 785 ? 28.499 -54.480 66.095 1.00 86.93 ? 796 GLY A CA 1 ATOM 5709 C C . GLY A 1 785 ? 29.000 -55.687 66.863 1.00 92.64 ? 796 GLY A C 1 ATOM 5710 O O . GLY A 1 785 ? 30.057 -55.641 67.493 1.00 91.98 ? 796 GLY A O 1 ATOM 5711 N N . TYR A 1 786 ? 28.236 -56.774 66.805 1.00 89.40 ? 797 TYR A N 1 ATOM 5712 C CA . TYR A 1 786 ? 28.593 -58.009 67.494 1.00 84.32 ? 797 TYR A CA 1 ATOM 5713 C C . TYR A 1 786 ? 28.659 -59.189 66.536 1.00 82.15 ? 797 TYR A C 1 ATOM 5714 O O . TYR A 1 786 ? 27.681 -59.502 65.859 1.00 89.33 ? 797 TYR A O 1 ATOM 5715 C CB . TYR A 1 786 ? 27.586 -58.316 68.614 1.00 81.97 ? 797 TYR A CB 1 ATOM 5716 C CG . TYR A 1 786 ? 27.744 -59.693 69.234 1.00 88.44 ? 797 TYR A CG 1 ATOM 5717 C CD1 . TYR A 1 786 ? 26.957 -60.762 68.819 1.00 84.39 ? 797 TYR A CD1 1 ATOM 5718 C CD2 . TYR A 1 786 ? 28.685 -59.924 70.229 1.00 102.39 ? 797 TYR A CD2 1 ATOM 5719 C CE1 . TYR A 1 786 ? 27.103 -62.019 69.379 1.00 92.82 ? 797 TYR A CE1 1 ATOM 5720 C CE2 . TYR A 1 786 ? 28.837 -61.176 70.797 1.00 106.80 ? 797 TYR A CE2 1 ATOM 5721 C CZ . TYR A 1 786 ? 28.045 -62.221 70.370 1.00 99.33 ? 797 TYR A CZ 1 ATOM 5722 O OH . TYR A 1 786 ? 28.201 -63.467 70.936 1.00 87.28 ? 797 TYR A OH 1 ATOM 5723 N N . ASP A 1 787 ? 29.809 -59.848 66.485 1.00 77.82 ? 798 ASP A N 1 ATOM 5724 C CA . ASP A 1 787 ? 29.920 -61.100 65.750 1.00 90.99 ? 798 ASP A CA 1 ATOM 5725 C C . ASP A 1 787 ? 30.000 -62.264 66.726 1.00 95.76 ? 798 ASP A C 1 ATOM 5726 O O . ASP A 1 787 ? 30.815 -62.252 67.650 1.00 99.00 ? 798 ASP A O 1 ATOM 5727 C CB . ASP A 1 787 ? 31.147 -61.097 64.836 1.00 101.16 ? 798 ASP A CB 1 ATOM 5728 C CG . ASP A 1 787 ? 31.025 -60.101 63.698 1.00 111.53 ? 798 ASP A CG 1 ATOM 5729 O OD1 . ASP A 1 787 ? 29.884 -59.793 63.292 1.00 117.24 ? 798 ASP A OD1 1 ATOM 5730 O OD2 . ASP A 1 787 ? 32.072 -59.629 63.208 1.00 115.11 ? 798 ASP A OD2 1 ATOM 5731 N N . GLN A 1 788 ? 29.144 -63.261 66.532 1.00 101.87 ? 799 GLN A N 1 ATOM 5732 C CA . GLN A 1 788 ? 29.203 -64.467 67.344 1.00 103.42 ? 799 GLN A CA 1 ATOM 5733 C C . GLN A 1 788 ? 30.460 -65.245 66.982 1.00 106.06 ? 799 GLN A C 1 ATOM 5734 O O . GLN A 1 788 ? 30.697 -65.525 65.807 1.00 109.55 ? 799 GLN A O 1 ATOM 5735 C CB . GLN A 1 788 ? 27.970 -65.342 67.121 1.00 99.03 ? 799 GLN A CB 1 ATOM 5736 C CG . GLN A 1 788 ? 27.869 -66.502 68.099 1.00 103.06 ? 799 GLN A CG 1 ATOM 5737 C CD . GLN A 1 788 ? 26.868 -67.552 67.667 1.00 103.67 ? 799 GLN A CD 1 ATOM 5738 O OE1 . GLN A 1 788 ? 26.581 -67.699 66.480 1.00 107.02 ? 799 GLN A OE1 1 ATOM 5739 N NE2 . GLN A 1 788 ? 26.332 -68.293 68.632 1.00 99.48 ? 799 GLN A NE2 1 ATOM 5740 N N . PRO A 1 789 ? 31.271 -65.596 67.992 1.00 108.48 ? 800 PRO A N 1 ATOM 5741 C CA . PRO A 1 789 ? 32.524 -66.326 67.768 1.00 107.70 ? 800 PRO A CA 1 ATOM 5742 C C . PRO A 1 789 ? 32.299 -67.626 67.000 1.00 108.34 ? 800 PRO A C 1 ATOM 5743 O O . PRO A 1 789 ? 33.173 -68.052 66.244 1.00 97.13 ? 800 PRO A O 1 ATOM 5744 C CB . PRO A 1 789 ? 33.021 -66.617 69.190 1.00 102.46 ? 800 PRO A CB 1 ATOM 5745 C CG . PRO A 1 789 ? 31.818 -66.456 70.069 1.00 102.46 ? 800 PRO A CG 1 ATOM 5746 C CD . PRO A 1 789 ? 31.016 -65.375 69.426 1.00 107.47 ? 800 PRO A CD 1 ATOM 5747 N N . GLU A 1 790 ? 31.129 -68.232 67.186 1.00 115.09 ? 801 GLU A N 1 ATOM 5748 C CA . GLU A 1 790 ? 30.771 -69.461 66.486 1.00 119.96 ? 801 GLU A CA 1 ATOM 5749 C C . GLU A 1 790 ? 30.693 -69.221 64.979 1.00 118.36 ? 801 GLU A C 1 ATOM 5750 O O . GLU A 1 790 ? 30.980 -70.114 64.180 1.00 109.60 ? 801 GLU A O 1 ATOM 5751 C CB . GLU A 1 790 ? 29.433 -69.995 67.003 1.00 125.36 ? 801 GLU A CB 1 ATOM 5752 C CG . GLU A 1 790 ? 29.242 -69.859 68.513 1.00 127.36 ? 801 GLU A CG 1 ATOM 5753 C CD . GLU A 1 790 ? 30.209 -70.705 69.318 1.00 129.68 ? 801 GLU A CD 1 ATOM 5754 O OE1 . GLU A 1 790 ? 30.643 -70.245 70.396 1.00 131.05 ? 801 GLU A OE1 1 ATOM 5755 O OE2 . GLU A 1 790 ? 30.527 -71.831 68.881 1.00 132.19 ? 801 GLU A OE2 1 ATOM 5756 N N . GLY A 1 791 ? 30.306 -68.007 64.600 1.00 120.87 ? 802 GLY A N 1 ATOM 5757 C CA . GLY A 1 791 ? 30.207 -67.634 63.201 1.00 112.69 ? 802 GLY A CA 1 ATOM 5758 C C . GLY A 1 791 ? 28.880 -68.020 62.578 1.00 103.71 ? 802 GLY A C 1 ATOM 5759 O O . GLY A 1 791 ? 28.811 -68.347 61.394 1.00 95.52 ? 802 GLY A O 1 ATOM 5760 N N . LYS A 1 792 ? 27.818 -67.979 63.375 1.00 103.22 ? 803 LYS A N 1 ATOM 5761 C CA . LYS A 1 792 ? 26.495 -68.354 62.894 1.00 105.92 ? 803 LYS A CA 1 ATOM 5762 C C . LYS A 1 792 ? 25.626 -67.128 62.632 1.00 106.49 ? 803 LYS A C 1 ATOM 5763 O O . LYS A 1 792 ? 24.849 -67.107 61.678 1.00 105.57 ? 803 LYS A O 1 ATOM 5764 C CB . LYS A 1 792 ? 25.803 -69.295 63.884 1.00 106.00 ? 803 LYS A CB 1 ATOM 5765 N N . TRP A 1 793 ? 25.761 -66.112 63.481 1.00 99.57 ? 804 TRP A N 1 ATOM 5766 C CA . TRP A 1 793 ? 24.991 -64.881 63.321 1.00 101.46 ? 804 TRP A CA 1 ATOM 5767 C C . TRP A 1 793 ? 25.768 -63.648 63.782 1.00 103.58 ? 804 TRP A C 1 ATOM 5768 O O . TRP A 1 793 ? 26.800 -63.764 64.438 1.00 100.59 ? 804 TRP A O 1 ATOM 5769 C CB . TRP A 1 793 ? 23.655 -64.978 64.062 1.00 97.52 ? 804 TRP A CB 1 ATOM 5770 C CG . TRP A 1 793 ? 23.780 -64.925 65.552 1.00 100.97 ? 804 TRP A CG 1 ATOM 5771 C CD1 . TRP A 1 793 ? 24.037 -65.968 66.390 1.00 99.34 ? 804 TRP A CD1 1 ATOM 5772 C CD2 . TRP A 1 793 ? 23.643 -63.765 66.384 1.00 97.57 ? 804 TRP A CD2 1 ATOM 5773 N NE1 . TRP A 1 793 ? 24.075 -65.530 67.691 1.00 93.37 ? 804 TRP A NE1 1 ATOM 5774 C CE2 . TRP A 1 793 ? 23.836 -64.182 67.714 1.00 90.48 ? 804 TRP A CE2 1 ATOM 5775 C CE3 . TRP A 1 793 ? 23.380 -62.415 66.132 1.00 94.10 ? 804 TRP A CE3 1 ATOM 5776 C CZ2 . TRP A 1 793 ? 23.771 -63.298 68.790 1.00 87.01 ? 804 TRP A CZ2 1 ATOM 5777 C CZ3 . TRP A 1 793 ? 23.317 -61.539 67.202 1.00 91.15 ? 804 TRP A CZ3 1 ATOM 5778 C CH2 . TRP A 1 793 ? 23.511 -61.985 68.513 1.00 93.05 ? 804 TRP A CH2 1 ATOM 5779 N N . GLY A 1 794 ? 25.266 -62.469 63.428 1.00 109.68 ? 805 GLY A N 1 ATOM 5780 C CA . GLY A 1 794 ? 25.916 -61.223 63.793 1.00 105.52 ? 805 GLY A CA 1 ATOM 5781 C C . GLY A 1 794 ? 25.047 -59.994 63.592 1.00 99.65 ? 805 GLY A C 1 ATOM 5782 O O . GLY A 1 794 ? 24.067 -60.026 62.850 1.00 93.92 ? 805 GLY A O 1 ATOM 5783 N N . VAL A 1 795 ? 25.422 -58.908 64.263 1.00 94.71 ? 806 VAL A N 1 ATOM 5784 C CA . VAL A 1 795 ? 24.682 -57.652 64.233 1.00 83.74 ? 806 VAL A CA 1 ATOM 5785 C C . VAL A 1 795 ? 25.675 -56.513 64.049 1.00 84.35 ? 806 VAL A C 1 ATOM 5786 O O . VAL A 1 795 ? 26.799 -56.587 64.545 1.00 86.42 ? 806 VAL A O 1 ATOM 5787 C CB . VAL A 1 795 ? 23.889 -57.450 65.548 1.00 91.14 ? 806 VAL A CB 1 ATOM 5788 C CG1 . VAL A 1 795 ? 23.411 -56.008 65.706 1.00 90.07 ? 806 VAL A CG1 1 ATOM 5789 C CG2 . VAL A 1 795 ? 22.716 -58.418 65.616 1.00 93.07 ? 806 VAL A CG2 1 ATOM 5790 N N . ASN A 1 796 ? 25.276 -55.474 63.319 1.00 82.45 ? 807 ASN A N 1 ATOM 5791 C CA . ASN A 1 796 ? 26.132 -54.312 63.120 1.00 71.92 ? 807 ASN A CA 1 ATOM 5792 C C . ASN A 1 796 ? 25.353 -53.000 63.068 1.00 87.82 ? 807 ASN A C 1 ATOM 5793 O O . ASN A 1 796 ? 24.295 -52.917 62.445 1.00 82.99 ? 807 ASN A O 1 ATOM 5794 C CB . ASN A 1 796 ? 26.975 -54.481 61.853 1.00 74.78 ? 807 ASN A CB 1 ATOM 5795 C CG . ASN A 1 796 ? 28.059 -53.423 61.726 1.00 85.01 ? 807 ASN A CG 1 ATOM 5796 O OD1 . ASN A 1 796 ? 27.864 -52.385 61.090 1.00 85.41 ? 807 ASN A OD1 1 ATOM 5797 N ND2 . ASN A 1 796 ? 29.211 -53.683 62.337 1.00 89.41 ? 807 ASN A ND2 1 ATOM 5798 N N . GLY A 1 797 ? 25.883 -51.976 63.730 1.00 91.36 ? 808 GLY A N 1 ATOM 5799 C CA . GLY A 1 797 ? 25.290 -50.651 63.687 1.00 89.67 ? 808 GLY A CA 1 ATOM 5800 C C . GLY A 1 797 ? 26.286 -49.608 63.216 1.00 80.45 ? 808 GLY A C 1 ATOM 5801 O O . GLY A 1 797 ? 27.406 -49.532 63.722 1.00 87.38 ? 808 GLY A O 1 ATOM 5802 N N . MET A 1 798 ? 25.879 -48.799 62.245 1.00 76.49 ? 809 MET A N 1 ATOM 5803 C CA . MET A 1 798 ? 26.765 -47.795 61.667 1.00 90.18 ? 809 MET A CA 1 ATOM 5804 C C . MET A 1 798 ? 26.188 -46.392 61.782 1.00 86.63 ? 809 MET A C 1 ATOM 5805 O O . MET A 1 798 ? 25.065 -46.142 61.351 1.00 81.34 ? 809 MET A O 1 ATOM 5806 C CB . MET A 1 798 ? 27.034 -48.113 60.194 1.00 102.77 ? 809 MET A CB 1 ATOM 5807 C CG . MET A 1 798 ? 27.952 -49.299 59.964 1.00 112.66 ? 809 MET A CG 1 ATOM 5808 S SD . MET A 1 798 ? 29.652 -48.953 60.448 1.00 98.75 ? 809 MET A SD 1 ATOM 5809 C CE . MET A 1 798 ? 30.455 -50.470 59.934 1.00 176.21 ? 809 MET A CE 1 ATOM 5810 N N . LEU A 1 799 ? 26.963 -45.479 62.359 1.00 85.33 ? 810 LEU A N 1 ATOM 5811 C CA . LEU A 1 799 ? 26.576 -44.072 62.419 1.00 81.15 ? 810 LEU A CA 1 ATOM 5812 C C . LEU A 1 799 ? 27.500 -43.217 61.556 1.00 89.12 ? 810 LEU A C 1 ATOM 5813 O O . LEU A 1 799 ? 28.716 -43.220 61.743 1.00 93.26 ? 810 LEU A O 1 ATOM 5814 C CB . LEU A 1 799 ? 26.593 -43.566 63.861 1.00 75.84 ? 810 LEU A CB 1 ATOM 5815 C CG . LEU A 1 799 ? 26.515 -42.048 64.048 1.00 77.17 ? 810 LEU A CG 1 ATOM 5816 C CD1 . LEU A 1 799 ? 25.216 -41.485 63.481 1.00 72.29 ? 810 LEU A CD1 1 ATOM 5817 C CD2 . LEU A 1 799 ? 26.674 -41.677 65.515 1.00 73.95 ? 810 LEU A CD2 1 ATOM 5818 N N . THR A 1 800 ? 26.918 -42.488 60.609 1.00 79.43 ? 811 THR A N 1 ATOM 5819 C CA . THR A 1 800 ? 27.698 -41.626 59.732 1.00 69.19 ? 811 THR A CA 1 ATOM 5820 C C . THR A 1 800 ? 27.280 -40.177 59.904 1.00 78.13 ? 811 THR A C 1 ATOM 5821 O O . THR A 1 800 ? 26.096 -39.868 59.882 1.00 87.67 ? 811 THR A O 1 ATOM 5822 C CB . THR A 1 800 ? 27.524 -42.015 58.255 1.00 75.78 ? 811 THR A CB 1 ATOM 5823 O OG1 . THR A 1 800 ? 27.749 -43.421 58.098 1.00 73.38 ? 811 THR A OG1 1 ATOM 5824 C CG2 . THR A 1 800 ? 28.504 -41.240 57.384 1.00 65.04 ? 811 THR A CG2 1 ATOM 5825 N N . TYR A 1 801 ? 28.256 -39.293 60.074 1.00 83.67 ? 812 TYR A N 1 ATOM 5826 C CA . TYR A 1 801 ? 27.985 -37.869 60.227 1.00 82.55 ? 812 TYR A CA 1 ATOM 5827 C C . TYR A 1 801 ? 28.897 -37.050 59.319 1.00 89.83 ? 812 TYR A C 1 ATOM 5828 O O . TYR A 1 801 ? 30.122 -37.085 59.456 1.00 92.21 ? 812 TYR A O 1 ATOM 5829 C CB . TYR A 1 801 ? 28.173 -37.453 61.687 1.00 72.30 ? 812 TYR A CB 1 ATOM 5830 C CG . TYR A 1 801 ? 28.123 -35.960 61.944 1.00 97.39 ? 812 TYR A CG 1 ATOM 5831 C CD1 . TYR A 1 801 ? 26.913 -35.310 62.144 1.00 114.02 ? 812 TYR A CD1 1 ATOM 5832 C CD2 . TYR A 1 801 ? 29.290 -35.205 62.012 1.00 105.96 ? 812 TYR A CD2 1 ATOM 5833 C CE1 . TYR A 1 801 ? 26.865 -33.947 62.391 1.00 122.15 ? 812 TYR A CE1 1 ATOM 5834 C CE2 . TYR A 1 801 ? 29.251 -33.843 62.256 1.00 113.73 ? 812 TYR A CE2 1 ATOM 5835 C CZ . TYR A 1 801 ? 28.037 -33.220 62.445 1.00 122.44 ? 812 TYR A CZ 1 ATOM 5836 O OH . TYR A 1 801 ? 27.994 -31.865 62.690 1.00 127.48 ? 812 TYR A OH 1 ATOM 5837 N N . SER A 1 802 ? 28.303 -36.314 58.386 1.00 78.47 ? 813 SER A N 1 ATOM 5838 C CA . SER A 1 802 ? 29.095 -35.471 57.505 1.00 76.67 ? 813 SER A CA 1 ATOM 5839 C C . SER A 1 802 ? 28.862 -34.001 57.805 1.00 77.81 ? 813 SER A C 1 ATOM 5840 O O . SER A 1 802 ? 27.742 -33.586 58.107 1.00 83.72 ? 813 SER A O 1 ATOM 5841 C CB . SER A 1 802 ? 28.789 -35.763 56.033 1.00 91.94 ? 813 SER A CB 1 ATOM 5842 O OG . SER A 1 802 ? 27.635 -35.066 55.602 1.00 89.91 ? 813 SER A OG 1 ATOM 5843 N N . LYS A 1 803 ? 29.935 -33.221 57.722 1.00 89.41 ? 814 LYS A N 1 ATOM 5844 C CA . LYS A 1 803 ? 29.861 -31.776 57.872 1.00 92.67 ? 814 LYS A CA 1 ATOM 5845 C C . LYS A 1 803 ? 29.178 -31.164 56.658 1.00 96.02 ? 814 LYS A C 1 ATOM 5846 O O . LYS A 1 803 ? 28.756 -31.873 55.744 1.00 98.73 ? 814 LYS A O 1 ATOM 5847 C CB . LYS A 1 803 ? 31.266 -31.186 58.014 1.00 92.35 ? 814 LYS A CB 1 ATOM 5848 C CG . LYS A 1 803 ? 31.614 -30.691 59.405 1.00 97.91 ? 814 LYS A CG 1 ATOM 5849 C CD . LYS A 1 803 ? 31.758 -31.835 60.390 1.00 105.75 ? 814 LYS A CD 1 ATOM 5850 C CE . LYS A 1 803 ? 32.222 -31.326 61.749 1.00 122.15 ? 814 LYS A CE 1 ATOM 5851 N NZ . LYS A 1 803 ? 33.507 -30.575 61.650 1.00 124.16 ? 814 LYS A NZ 1 ATOM 5852 N N . ALA A 1 804 ? 29.080 -29.839 56.649 1.00 106.04 ? 815 ALA A N 1 ATOM 5853 C CA . ALA A 1 804 ? 28.539 -29.118 55.505 1.00 104.25 ? 815 ALA A CA 1 ATOM 5854 C C . ALA A 1 804 ? 29.623 -28.942 54.445 1.00 98.63 ? 815 ALA A C 1 ATOM 5855 O O . ALA A 1 804 ? 30.811 -29.082 54.736 1.00 108.19 ? 815 ALA A O 1 ATOM 5856 C CB . ALA A 1 804 ? 27.998 -27.763 55.943 1.00 76.04 ? 815 ALA A CB 1 ATOM 5857 N N . LYS A 1 805 ? 29.209 -28.644 53.218 1.00 77.99 ? 816 LYS A N 1 ATOM 5858 C CA . LYS A 1 805 ? 30.149 -28.338 52.147 1.00 78.45 ? 816 LYS A CA 1 ATOM 5859 C C . LYS A 1 805 ? 30.748 -26.943 52.343 1.00 82.95 ? 816 LYS A C 1 ATOM 5860 O O . LYS A 1 805 ? 30.020 -25.949 52.405 1.00 84.88 ? 816 LYS A O 1 ATOM 5861 C CB . LYS A 1 805 ? 29.448 -28.426 50.789 1.00 75.95 ? 816 LYS A CB 1 ATOM 5862 C CG . LYS A 1 805 ? 30.357 -28.192 49.598 1.00 67.79 ? 816 LYS A CG 1 ATOM 5863 C CD . LYS A 1 805 ? 31.418 -29.271 49.500 1.00 57.95 ? 816 LYS A CD 1 ATOM 5864 C CE . LYS A 1 805 ? 32.474 -28.898 48.477 1.00 70.82 ? 816 LYS A CE 1 ATOM 5865 N NZ . LYS A 1 805 ? 33.548 -29.922 48.386 1.00 74.73 ? 816 LYS A NZ 1 ATOM 5866 N N . GLU A 1 806 ? 32.072 -26.873 52.447 1.00 79.36 ? 817 GLU A N 1 ATOM 5867 C CA . GLU A 1 806 ? 32.761 -25.599 52.645 1.00 78.39 ? 817 GLU A CA 1 ATOM 5868 C C . GLU A 1 806 ? 32.623 -24.691 51.426 1.00 78.32 ? 817 GLU A C 1 ATOM 5869 O O . GLU A 1 806 ? 32.958 -25.080 50.309 1.00 82.38 ? 817 GLU A O 1 ATOM 5870 C CB . GLU A 1 806 ? 34.240 -25.832 52.960 1.00 78.40 ? 817 GLU A CB 1 ATOM 5871 C CG . GLU A 1 806 ? 34.495 -26.496 54.302 1.00 92.31 ? 817 GLU A CG 1 ATOM 5872 C CD . GLU A 1 806 ? 34.318 -25.544 55.470 1.00 106.54 ? 817 GLU A CD 1 ATOM 5873 O OE1 . GLU A 1 806 ? 34.425 -24.318 55.259 1.00 117.53 ? 817 GLU A OE1 1 ATOM 5874 O OE2 . GLU A 1 806 ? 34.073 -26.021 56.599 1.00 103.89 ? 817 GLU A OE2 1 ATOM 5875 N N . ILE A 1 807 ? 32.135 -23.476 51.649 1.00 89.83 ? 818 ILE A N 1 ATOM 5876 C CA . ILE A 1 807 ? 31.879 -22.534 50.563 1.00 83.55 ? 818 ILE A CA 1 ATOM 5877 C C . ILE A 1 807 ? 33.171 -22.062 49.890 1.00 94.60 ? 818 ILE A C 1 ATOM 5878 O O . ILE A 1 807 ? 33.157 -21.644 48.730 1.00 95.99 ? 818 ILE A O 1 ATOM 5879 C CB . ILE A 1 807 ? 31.054 -21.323 51.058 1.00 82.18 ? 818 ILE A CB 1 ATOM 5880 C CG1 . ILE A 1 807 ? 30.543 -20.488 49.879 1.00 84.95 ? 818 ILE A CG1 1 ATOM 5881 C CG2 . ILE A 1 807 ? 31.870 -20.479 52.031 1.00 79.16 ? 818 ILE A CG2 1 ATOM 5882 C CD1 . ILE A 1 807 ? 29.589 -19.376 50.275 1.00 90.31 ? 818 ILE A CD1 1 ATOM 5883 N N . THR A 1 808 ? 34.289 -22.144 50.609 1.00 93.87 ? 819 THR A N 1 ATOM 5884 C CA . THR A 1 808 ? 35.583 -21.762 50.047 1.00 92.60 ? 819 THR A CA 1 ATOM 5885 C C . THR A 1 808 ? 36.060 -22.753 48.994 1.00 100.01 ? 819 THR A C 1 ATOM 5886 O O . THR A 1 808 ? 36.849 -22.406 48.115 1.00 104.42 ? 819 THR A O 1 ATOM 5887 C CB . THR A 1 808 ? 36.673 -21.659 51.125 1.00 90.44 ? 819 THR A CB 1 ATOM 5888 O OG1 . THR A 1 808 ? 36.633 -22.823 51.961 1.00 83.57 ? 819 THR A OG1 1 ATOM 5889 C CG2 . THR A 1 808 ? 36.473 -20.411 51.964 1.00 81.85 ? 819 THR A CG2 1 ATOM 5890 N N . GLU A 1 809 ? 35.580 -23.989 49.092 1.00 98.26 ? 820 GLU A N 1 ATOM 5891 C CA . GLU A 1 809 ? 36.000 -25.047 48.180 1.00 91.22 ? 820 GLU A CA 1 ATOM 5892 C C . GLU A 1 809 ? 35.302 -24.962 46.823 1.00 93.29 ? 820 GLU A C 1 ATOM 5893 O O . GLU A 1 809 ? 35.716 -25.614 45.866 1.00 89.79 ? 820 GLU A O 1 ATOM 5894 C CB . GLU A 1 809 ? 35.788 -26.425 48.820 1.00 89.51 ? 820 GLU A CB 1 ATOM 5895 C CG . GLU A 1 809 ? 36.659 -26.663 50.052 1.00 111.88 ? 820 GLU A CG 1 ATOM 5896 C CD . GLU A 1 809 ? 36.394 -27.998 50.727 1.00 108.65 ? 820 GLU A CD 1 ATOM 5897 O OE1 . GLU A 1 809 ? 35.722 -28.854 50.115 1.00 106.40 ? 820 GLU A OE1 1 ATOM 5898 O OE2 . GLU A 1 809 ? 36.857 -28.185 51.875 1.00 99.39 ? 820 GLU A OE2 1 ATOM 5899 N N . LEU A 1 810 ? 34.250 -24.153 46.734 1.00 92.69 ? 821 LEU A N 1 ATOM 5900 C CA . LEU A 1 810 ? 33.539 -23.997 45.468 1.00 83.10 ? 821 LEU A CA 1 ATOM 5901 C C . LEU A 1 810 ? 33.486 -22.547 44.983 1.00 77.19 ? 821 LEU A C 1 ATOM 5902 O O . LEU A 1 810 ? 32.693 -22.203 44.108 1.00 77.94 ? 821 LEU A O 1 ATOM 5903 C CB . LEU A 1 810 ? 32.139 -24.617 45.544 1.00 79.70 ? 821 LEU A CB 1 ATOM 5904 C CG . LEU A 1 810 ? 31.217 -24.209 46.690 1.00 84.62 ? 821 LEU A CG 1 ATOM 5905 C CD1 . LEU A 1 810 ? 30.334 -23.035 46.288 1.00 93.91 ? 821 LEU A CD1 1 ATOM 5906 C CD2 . LEU A 1 810 ? 30.378 -25.393 47.139 1.00 78.13 ? 821 LEU A CD2 1 ATOM 5907 N N . LEU A 1 811 ? 34.344 -21.706 45.554 1.00 82.82 ? 822 LEU A N 1 ATOM 5908 C CA . LEU A 1 811 ? 34.497 -20.328 45.098 1.00 77.76 ? 822 LEU A CA 1 ATOM 5909 C C . LEU A 1 811 ? 35.835 -20.148 44.392 1.00 82.43 ? 822 LEU A C 1 ATOM 5910 O O . LEU A 1 811 ? 36.756 -20.940 44.583 1.00 89.73 ? 822 LEU A O 1 ATOM 5911 C CB . LEU A 1 811 ? 34.385 -19.353 46.271 1.00 73.98 ? 822 LEU A CB 1 ATOM 5912 C CG . LEU A 1 811 ? 33.058 -18.608 46.445 1.00 68.55 ? 822 LEU A CG 1 ATOM 5913 C CD1 . LEU A 1 811 ? 31.892 -19.401 45.871 1.00 65.29 ? 822 LEU A CD1 1 ATOM 5914 C CD2 . LEU A 1 811 ? 32.822 -18.311 47.917 1.00 72.74 ? 822 LEU A CD2 1 ATOM 5915 N N . GLY A 1 812 ? 35.937 -19.109 43.571 1.00 84.98 ? 823 GLY A N 1 ATOM 5916 C CA . GLY A 1 812 ? 37.161 -18.840 42.841 1.00 78.95 ? 823 GLY A CA 1 ATOM 5917 C C . GLY A 1 812 ? 37.015 -17.696 41.856 1.00 76.44 ? 823 GLY A C 1 ATOM 5918 O O . GLY A 1 812 ? 35.969 -17.050 41.780 1.00 67.25 ? 823 GLY A O 1 ATOM 5919 N N . SER A 1 813 ? 38.074 -17.442 41.097 1.00 76.87 ? 824 SER A N 1 ATOM 5920 C CA . SER A 1 813 ? 38.048 -16.389 40.095 1.00 79.56 ? 824 SER A CA 1 ATOM 5921 C C . SER A 1 813 ? 38.748 -16.848 38.827 1.00 85.15 ? 824 SER A C 1 ATOM 5922 O O . SER A 1 813 ? 39.521 -17.805 38.844 1.00 87.47 ? 824 SER A O 1 ATOM 5923 C CB . SER A 1 813 ? 38.743 -15.135 40.618 1.00 85.36 ? 824 SER A CB 1 ATOM 5924 O OG . SER A 1 813 ? 40.151 -15.293 40.579 1.00 84.55 ? 824 SER A OG 1 ATOM 5925 N N A ARG A 1 814 ? 38.476 -16.157 37.726 0.57 84.03 ? 825 ARG A N 1 ATOM 5926 N N B ARG A 1 814 ? 38.477 -16.160 37.725 0.43 83.83 ? 825 ARG A N 1 ATOM 5927 C CA A ARG A 1 814 ? 39.136 -16.453 36.463 0.57 79.34 ? 825 ARG A CA 1 ATOM 5928 C CA B ARG A 1 814 ? 39.141 -16.462 36.466 0.43 79.36 ? 825 ARG A CA 1 ATOM 5929 C C A ARG A 1 814 ? 40.177 -15.387 36.154 0.57 76.16 ? 825 ARG A C 1 ATOM 5930 C C B ARG A 1 814 ? 40.176 -15.391 36.151 0.43 75.97 ? 825 ARG A C 1 ATOM 5931 O O A ARG A 1 814 ? 39.847 -14.211 35.998 0.57 76.74 ? 825 ARG A O 1 ATOM 5932 O O B ARG A 1 814 ? 39.840 -14.218 35.987 0.43 76.73 ? 825 ARG A O 1 ATOM 5933 C CB A ARG A 1 814 ? 38.117 -16.541 35.327 0.57 79.84 ? 825 ARG A CB 1 ATOM 5934 C CB B ARG A 1 814 ? 38.127 -16.567 35.329 0.43 79.89 ? 825 ARG A CB 1 ATOM 5935 C CG A ARG A 1 814 ? 38.689 -17.130 34.054 0.57 81.45 ? 825 ARG A CG 1 ATOM 5936 C CG B ARG A 1 814 ? 38.709 -17.131 34.048 0.43 81.64 ? 825 ARG A CG 1 ATOM 5937 C CD A ARG A 1 814 ? 37.622 -17.327 32.995 0.57 84.77 ? 825 ARG A CD 1 ATOM 5938 C CD B ARG A 1 814 ? 37.678 -17.180 32.936 0.43 84.57 ? 825 ARG A CD 1 ATOM 5939 N NE A ARG A 1 814 ? 38.011 -18.370 32.053 0.57 81.18 ? 825 ARG A NE 1 ATOM 5940 N NE B ARG A 1 814 ? 36.508 -17.981 33.284 0.43 88.16 ? 825 ARG A NE 1 ATOM 5941 C CZ A ARG A 1 814 ? 37.591 -19.628 32.123 0.57 74.12 ? 825 ARG A CZ 1 ATOM 5942 C CZ B ARG A 1 814 ? 35.328 -17.474 33.629 0.43 92.98 ? 825 ARG A CZ 1 ATOM 5943 N NH1 A ARG A 1 814 ? 38.003 -20.517 31.231 0.57 77.72 ? 825 ARG A NH1 1 ATOM 5944 N NH1 B ARG A 1 814 ? 34.321 -18.283 33.927 0.43 93.04 ? 825 ARG A NH1 1 ATOM 5945 N NH2 A ARG A 1 814 ? 36.754 -19.997 33.081 0.57 71.48 ? 825 ARG A NH2 1 ATOM 5946 N NH2 B ARG A 1 814 ? 35.155 -16.159 33.675 0.43 88.44 ? 825 ARG A NH2 1 ATOM 5947 N N . ALA A 1 815 ? 41.437 -15.802 36.072 1.00 61.95 ? 826 ALA A N 1 ATOM 5948 C CA . ALA A 1 815 ? 42.528 -14.874 35.816 1.00 65.03 ? 826 ALA A CA 1 ATOM 5949 C C . ALA A 1 815 ? 42.497 -14.335 34.393 1.00 76.22 ? 826 ALA A C 1 ATOM 5950 O O . ALA A 1 815 ? 42.325 -15.083 33.430 1.00 78.86 ? 826 ALA A O 1 ATOM 5951 C CB . ALA A 1 815 ? 43.859 -15.532 36.098 1.00 68.25 ? 826 ALA A CB 1 ATOM 5952 N N . LEU A 1 816 ? 42.662 -13.025 34.272 1.00 67.08 ? 827 LEU A N 1 ATOM 5953 C CA . LEU A 1 816 ? 42.729 -12.375 32.975 1.00 65.46 ? 827 LEU A CA 1 ATOM 5954 C C . LEU A 1 816 ? 44.005 -11.546 32.928 1.00 78.98 ? 827 LEU A C 1 ATOM 5955 O O . LEU A 1 816 ? 44.935 -11.793 33.696 1.00 97.19 ? 827 LEU A O 1 ATOM 5956 C CB . LEU A 1 816 ? 41.489 -11.505 32.759 1.00 61.11 ? 827 LEU A CB 1 ATOM 5957 C CG . LEU A 1 816 ? 40.167 -12.234 33.048 1.00 73.73 ? 827 LEU A CG 1 ATOM 5958 C CD1 . LEU A 1 816 ? 38.991 -11.275 33.111 1.00 75.81 ? 827 LEU A CD1 1 ATOM 5959 C CD2 . LEU A 1 816 ? 39.896 -13.341 32.029 1.00 55.12 ? 827 LEU A CD2 1 ATOM 5960 N N . LEU A 1 817 ? 44.060 -10.574 32.026 1.00 79.72 ? 828 LEU A N 1 ATOM 5961 C CA . LEU A 1 817 ? 45.183 -9.642 31.987 1.00 90.94 ? 828 LEU A CA 1 ATOM 5962 C C . LEU A 1 817 ? 44.706 -8.237 32.353 1.00 105.12 ? 828 LEU A C 1 ATOM 5963 O O . LEU A 1 817 ? 43.583 -7.860 32.022 1.00 125.15 ? 828 LEU A O 1 ATOM 5964 C CB . LEU A 1 817 ? 45.852 -9.659 30.605 1.00 98.34 ? 828 LEU A CB 1 ATOM 5965 C CG . LEU A 1 817 ? 45.007 -9.931 29.351 1.00 103.05 ? 828 LEU A CG 1 ATOM 5966 C CD1 . LEU A 1 817 ? 44.032 -8.801 29.027 1.00 105.49 ? 828 LEU A CD1 1 ATOM 5967 C CD2 . LEU A 1 817 ? 45.903 -10.212 28.154 1.00 97.05 ? 828 LEU A CD2 1 ATOM 5968 N N . ASN A 1 818 ? 45.534 -7.462 33.052 1.00 106.69 ? 829 ASN A N 1 ATOM 5969 C CA . ASN A 1 818 ? 46.833 -7.899 33.540 1.00 101.47 ? 829 ASN A CA 1 ATOM 5970 C C . ASN A 1 818 ? 46.707 -8.276 35.007 1.00 111.03 ? 829 ASN A C 1 ATOM 5971 O O . ASN A 1 818 ? 47.267 -9.276 35.464 1.00 109.09 ? 829 ASN A O 1 ATOM 5972 C CB . ASN A 1 818 ? 47.860 -6.779 33.368 1.00 88.81 ? 829 ASN A CB 1 ATOM 5973 C CG . ASN A 1 818 ? 48.203 -6.519 31.909 1.00 94.81 ? 829 ASN A CG 1 ATOM 5974 O OD1 . ASN A 1 818 ? 49.276 -6.895 31.438 1.00 107.49 ? 829 ASN A OD1 1 ATOM 5975 N ND2 . ASN A 1 818 ? 47.290 -5.876 31.186 1.00 86.11 ? 829 ASN A ND2 1 ATOM 5976 N N . GLY A 1 819 ? 45.961 -7.458 35.740 1.00 107.87 ? 830 GLY A N 1 ATOM 5977 C CA . GLY A 1 819 ? 45.586 -7.777 37.102 1.00 109.59 ? 830 GLY A CA 1 ATOM 5978 C C . GLY A 1 819 ? 44.089 -8.008 37.172 1.00 112.58 ? 830 GLY A C 1 ATOM 5979 O O . GLY A 1 819 ? 43.524 -8.160 38.257 1.00 81.06 ? 830 GLY A O 1 ATOM 5980 N N . ASN A 1 820 ? 43.451 -8.032 36.002 1.00 100.43 ? 831 ASN A N 1 ATOM 5981 C CA . ASN A 1 820 ? 42.011 -8.230 35.905 1.00 73.90 ? 831 ASN A CA 1 ATOM 5982 C C . ASN A 1 820 ? 41.593 -9.656 36.230 1.00 77.75 ? 831 ASN A C 1 ATOM 5983 O O . ASN A 1 820 ? 42.374 -10.593 36.076 1.00 73.93 ? 831 ASN A O 1 ATOM 5984 C CB . ASN A 1 820 ? 41.507 -7.868 34.507 1.00 104.04 ? 831 ASN A CB 1 ATOM 5985 C CG . ASN A 1 820 ? 41.398 -6.371 34.289 1.00 106.49 ? 831 ASN A CG 1 ATOM 5986 O OD1 . ASN A 1 820 ? 40.406 -5.744 34.669 1.00 105.28 ? 831 ASN A OD1 1 ATOM 5987 N ND2 . ASN A 1 820 ? 42.413 -5.792 33.660 1.00 110.17 ? 831 ASN A ND2 1 ATOM 5988 N N . SER A 1 821 ? 40.350 -9.807 36.676 1.00 83.90 ? 832 SER A N 1 ATOM 5989 C CA . SER A 1 821 ? 39.783 -11.118 36.964 1.00 82.20 ? 832 SER A CA 1 ATOM 5990 C C . SER A 1 821 ? 38.264 -11.039 37.079 1.00 77.75 ? 832 SER A C 1 ATOM 5991 O O . SER A 1 821 ? 37.681 -9.953 37.058 1.00 72.13 ? 832 SER A O 1 ATOM 5992 C CB . SER A 1 821 ? 40.365 -11.687 38.258 1.00 81.97 ? 832 SER A CB 1 ATOM 5993 O OG . SER A 1 821 ? 39.912 -10.949 39.378 1.00 82.66 ? 832 SER A OG 1 ATOM 5994 N N . ARG A 1 822 ? 37.628 -12.199 37.193 1.00 69.05 ? 833 ARG A N 1 ATOM 5995 C CA . ARG A 1 822 ? 36.191 -12.270 37.410 1.00 72.42 ? 833 ARG A CA 1 ATOM 5996 C C . ARG A 1 822 ? 35.887 -13.389 38.402 1.00 78.17 ? 833 ARG A C 1 ATOM 5997 O O . ARG A 1 822 ? 36.288 -14.534 38.201 1.00 86.60 ? 833 ARG A O 1 ATOM 5998 C CB . ARG A 1 822 ? 35.458 -12.515 36.088 1.00 70.06 ? 833 ARG A CB 1 ATOM 5999 C CG . ARG A 1 822 ? 35.531 -11.362 35.094 1.00 73.05 ? 833 ARG A CG 1 ATOM 6000 C CD . ARG A 1 822 ? 34.756 -10.160 35.599 1.00 82.76 ? 833 ARG A CD 1 ATOM 6001 N NE . ARG A 1 822 ? 35.604 -8.981 35.752 1.00 84.39 ? 833 ARG A NE 1 ATOM 6002 C CZ . ARG A 1 822 ? 35.618 -7.958 34.904 1.00 85.39 ? 833 ARG A CZ 1 ATOM 6003 N NH1 . ARG A 1 822 ? 34.826 -7.967 33.843 1.00 83.23 ? 833 ARG A NH1 1 ATOM 6004 N NH2 . ARG A 1 822 ? 36.420 -6.924 35.117 1.00 84.48 ? 833 ARG A NH2 1 ATOM 6005 N N . ASN A 1 823 ? 35.186 -13.055 39.478 1.00 74.39 ? 834 ASN A N 1 ATOM 6006 C CA . ASN A 1 823 ? 34.846 -14.047 40.488 1.00 79.56 ? 834 ASN A CA 1 ATOM 6007 C C . ASN A 1 823 ? 33.787 -15.007 39.980 1.00 72.49 ? 834 ASN A C 1 ATOM 6008 O O . ASN A 1 823 ? 32.804 -14.592 39.368 1.00 73.72 ? 834 ASN A O 1 ATOM 6009 C CB . ASN A 1 823 ? 34.361 -13.372 41.770 1.00 88.75 ? 834 ASN A CB 1 ATOM 6010 C CG . ASN A 1 823 ? 35.409 -12.477 42.389 1.00 87.57 ? 834 ASN A CG 1 ATOM 6011 O OD1 . ASN A 1 823 ? 36.588 -12.546 42.039 1.00 72.50 ? 834 ASN A OD1 1 ATOM 6012 N ND2 . ASN A 1 823 ? 34.986 -11.634 43.323 1.00 86.86 ? 834 ASN A ND2 1 ATOM 6013 N N . THR A 1 824 ? 33.991 -16.295 40.232 1.00 72.67 ? 835 THR A N 1 ATOM 6014 C CA . THR A 1 824 ? 33.055 -17.317 39.782 1.00 66.07 ? 835 THR A CA 1 ATOM 6015 C C . THR A 1 824 ? 32.798 -18.373 40.854 1.00 68.45 ? 835 THR A C 1 ATOM 6016 O O . THR A 1 824 ? 33.641 -18.621 41.717 1.00 65.95 ? 835 THR A O 1 ATOM 6017 C CB . THR A 1 824 ? 33.563 -18.012 38.512 1.00 69.36 ? 835 THR A CB 1 ATOM 6018 O OG1 . THR A 1 824 ? 34.893 -18.491 38.732 1.00 65.22 ? 835 THR A OG1 1 ATOM 6019 C CG2 . THR A 1 824 ? 33.572 -17.041 37.339 1.00 74.78 ? 835 THR A CG2 1 ATOM 6020 N N . LYS A 1 825 ? 31.624 -18.993 40.790 1.00 78.27 ? 836 LYS A N 1 ATOM 6021 C CA . LYS A 1 825 ? 31.258 -20.052 41.724 1.00 77.65 ? 836 LYS A CA 1 ATOM 6022 C C . LYS A 1 825 ? 31.066 -21.370 40.980 1.00 80.19 ? 836 LYS A C 1 ATOM 6023 O O . LYS A 1 825 ? 30.781 -21.377 39.782 1.00 87.69 ? 836 LYS A O 1 ATOM 6024 C CB . LYS A 1 825 ? 29.983 -19.678 42.481 1.00 57.20 ? 836 LYS A CB 1 ATOM 6025 C CG . LYS A 1 825 ? 28.769 -19.423 41.593 1.00 56.00 ? 836 LYS A CG 1 ATOM 6026 C CD . LYS A 1 825 ? 27.537 -19.108 42.430 1.00 65.26 ? 836 LYS A CD 1 ATOM 6027 C CE . LYS A 1 825 ? 26.253 -19.189 41.616 1.00 74.45 ? 836 LYS A CE 1 ATOM 6028 N NZ . LYS A 1 825 ? 26.137 -18.090 40.622 1.00 91.56 ? 836 LYS A NZ 1 ATOM 6029 N N . ALA A 1 826 ? 31.225 -22.484 41.686 1.00 74.78 ? 837 ALA A N 1 ATOM 6030 C CA . ALA A 1 826 ? 31.088 -23.798 41.066 1.00 66.69 ? 837 ALA A CA 1 ATOM 6031 C C . ALA A 1 826 ? 29.635 -24.253 41.032 1.00 72.54 ? 837 ALA A C 1 ATOM 6032 O O . ALA A 1 826 ? 29.154 -24.741 40.012 1.00 85.38 ? 837 ALA A O 1 ATOM 6033 C CB . ALA A 1 826 ? 31.943 -24.819 41.787 1.00 59.49 ? 837 ALA A CB 1 ATOM 6034 N N . THR A 1 827 ? 28.945 -24.104 42.156 1.00 68.42 ? 838 THR A N 1 ATOM 6035 C CA . THR A 1 827 ? 27.529 -24.440 42.235 1.00 68.44 ? 838 THR A CA 1 ATOM 6036 C C . THR A 1 827 ? 26.745 -23.237 42.728 1.00 75.70 ? 838 THR A C 1 ATOM 6037 O O . THR A 1 827 ? 27.323 -22.269 43.221 1.00 62.50 ? 838 THR A O 1 ATOM 6038 C CB . THR A 1 827 ? 27.265 -25.611 43.199 1.00 59.02 ? 838 THR A CB 1 ATOM 6039 O OG1 . THR A 1 827 ? 27.923 -25.361 44.444 1.00 61.30 ? 838 THR A OG1 1 ATOM 6040 C CG2 . THR A 1 827 ? 27.785 -26.903 42.630 1.00 57.90 ? 838 THR A CG2 1 ATOM 6041 N N . ALA A 1 828 ? 25.426 -23.303 42.595 1.00 81.83 ? 839 ALA A N 1 ATOM 6042 C CA . ALA A 1 828 ? 24.562 -22.242 43.088 1.00 77.55 ? 839 ALA A CA 1 ATOM 6043 C C . ALA A 1 828 ? 24.186 -22.499 44.541 1.00 79.58 ? 839 ALA A C 1 ATOM 6044 O O . ALA A 1 828 ? 23.705 -21.605 45.231 1.00 87.94 ? 839 ALA A O 1 ATOM 6045 C CB . ALA A 1 828 ? 23.313 -22.127 42.226 1.00 69.69 ? 839 ALA A CB 1 ATOM 6046 N N . ARG A 1 829 ? 24.409 -23.729 44.997 1.00 76.03 ? 840 ARG A N 1 ATOM 6047 C CA . ARG A 1 829 ? 24.020 -24.140 46.341 1.00 70.35 ? 840 ARG A CA 1 ATOM 6048 C C . ARG A 1 829 ? 25.080 -25.037 46.973 1.00 70.60 ? 840 ARG A C 1 ATOM 6049 O O . ARG A 1 829 ? 25.870 -25.670 46.273 1.00 70.04 ? 840 ARG A O 1 ATOM 6050 C CB . ARG A 1 829 ? 22.683 -24.890 46.303 1.00 68.74 ? 840 ARG A CB 1 ATOM 6051 C CG . ARG A 1 829 ? 21.565 -24.170 45.554 1.00 66.85 ? 840 ARG A CG 1 ATOM 6052 C CD . ARG A 1 829 ? 21.101 -22.923 46.284 1.00 83.36 ? 840 ARG A CD 1 ATOM 6053 N NE . ARG A 1 829 ? 20.251 -23.242 47.425 1.00 109.78 ? 840 ARG A NE 1 ATOM 6054 C CZ . ARG A 1 829 ? 18.926 -23.306 47.366 1.00 130.92 ? 840 ARG A CZ 1 ATOM 6055 N NH1 . ARG A 1 829 ? 18.301 -23.069 46.219 1.00 131.90 ? 840 ARG A NH1 1 ATOM 6056 N NH2 . ARG A 1 829 ? 18.224 -23.605 48.451 1.00 140.68 ? 840 ARG A NH2 1 ATOM 6057 N N . ARG A 1 830 ? 25.087 -25.085 48.301 1.00 82.89 ? 841 ARG A N 1 ATOM 6058 C CA . ARG A 1 830 ? 25.965 -25.980 49.048 1.00 74.99 ? 841 ARG A CA 1 ATOM 6059 C C . ARG A 1 830 ? 25.124 -26.798 50.020 1.00 83.93 ? 841 ARG A C 1 ATOM 6060 O O . ARG A 1 830 ? 23.999 -26.420 50.332 1.00 94.25 ? 841 ARG A O 1 ATOM 6061 C CB . ARG A 1 830 ? 27.038 -25.185 49.796 1.00 78.82 ? 841 ARG A CB 1 ATOM 6062 C CG . ARG A 1 830 ? 26.496 -23.988 50.565 1.00 91.56 ? 841 ARG A CG 1 ATOM 6063 C CD . ARG A 1 830 ? 27.613 -23.087 51.073 1.00 91.84 ? 841 ARG A CD 1 ATOM 6064 N NE . ARG A 1 830 ? 28.304 -23.661 52.221 1.00 98.24 ? 841 ARG A NE 1 ATOM 6065 C CZ . ARG A 1 830 ? 27.925 -23.478 53.482 1.00 118.33 ? 841 ARG A CZ 1 ATOM 6066 N NH1 . ARG A 1 830 ? 26.860 -22.736 53.755 1.00 117.90 ? 841 ARG A NH1 1 ATOM 6067 N NH2 . ARG A 1 830 ? 28.610 -24.035 54.471 1.00 130.53 ? 841 ARG A NH2 1 ATOM 6068 N N . THR A 1 831 ? 25.664 -27.912 50.500 1.00 83.98 ? 842 THR A N 1 ATOM 6069 C CA . THR A 1 831 ? 24.872 -28.849 51.295 1.00 77.52 ? 842 THR A CA 1 ATOM 6070 C C . THR A 1 831 ? 24.999 -28.626 52.798 1.00 74.17 ? 842 THR A C 1 ATOM 6071 O O . THR A 1 831 ? 25.979 -28.051 53.268 1.00 81.76 ? 842 THR A O 1 ATOM 6072 C CB . THR A 1 831 ? 25.239 -30.307 50.969 1.00 81.60 ? 842 THR A CB 1 ATOM 6073 O OG1 . THR A 1 831 ? 24.332 -31.188 51.641 1.00 108.04 ? 842 THR A OG1 1 ATOM 6074 C CG2 . THR A 1 831 ? 26.654 -30.610 51.420 1.00 83.74 ? 842 THR A CG2 1 ATOM 6075 N N . ARG A 1 832 ? 24.000 -29.093 53.544 1.00 80.25 ? 843 ARG A N 1 ATOM 6076 C CA . ARG A 1 832 ? 23.981 -28.978 55.004 1.00 93.32 ? 843 ARG A CA 1 ATOM 6077 C C . ARG A 1 832 ? 24.542 -30.235 55.674 1.00 92.93 ? 843 ARG A C 1 ATOM 6078 O O . ARG A 1 832 ? 24.685 -31.273 55.024 1.00 92.36 ? 843 ARG A O 1 ATOM 6079 C CB . ARG A 1 832 ? 22.552 -28.717 55.494 1.00 74.98 ? 843 ARG A CB 1 ATOM 6080 C CG . ARG A 1 832 ? 22.032 -27.342 55.156 1.00 85.06 ? 843 ARG A CG 1 ATOM 6081 C CD . ARG A 1 832 ? 20.596 -27.156 55.617 1.00 79.54 ? 843 ARG A CD 1 ATOM 6082 N NE . ARG A 1 832 ? 20.071 -25.863 55.185 1.00 81.23 ? 843 ARG A NE 1 ATOM 6083 C CZ . ARG A 1 832 ? 20.179 -24.739 55.886 1.00 98.47 ? 843 ARG A CZ 1 ATOM 6084 N NH1 . ARG A 1 832 ? 20.785 -24.747 57.066 1.00 95.33 ? 843 ARG A NH1 1 ATOM 6085 N NH2 . ARG A 1 832 ? 19.676 -23.609 55.409 1.00 91.33 ? 843 ARG A NH2 1 ATOM 6086 N N . PRO A 1 833 ? 24.877 -30.143 56.976 1.00 95.86 ? 844 PRO A N 1 ATOM 6087 C CA . PRO A 1 833 ? 25.312 -31.337 57.711 1.00 91.87 ? 844 PRO A CA 1 ATOM 6088 C C . PRO A 1 833 ? 24.191 -32.359 57.847 1.00 87.47 ? 844 PRO A C 1 ATOM 6089 O O . PRO A 1 833 ? 23.014 -31.996 57.812 1.00 83.58 ? 844 PRO A O 1 ATOM 6090 C CB . PRO A 1 833 ? 25.669 -30.784 59.096 1.00 83.00 ? 844 PRO A CB 1 ATOM 6091 C CG . PRO A 1 833 ? 25.969 -29.351 58.872 1.00 82.19 ? 844 PRO A CG 1 ATOM 6092 C CD . PRO A 1 833 ? 25.040 -28.918 57.780 1.00 79.91 ? 844 PRO A CD 1 ATOM 6093 N N . TRP A 1 834 ? 24.558 -33.626 58.004 1.00 84.83 ? 845 TRP A N 1 ATOM 6094 C CA . TRP A 1 834 ? 23.575 -34.680 58.217 1.00 83.59 ? 845 TRP A CA 1 ATOM 6095 C C . TRP A 1 834 ? 24.190 -35.899 58.893 1.00 85.42 ? 845 TRP A C 1 ATOM 6096 O O . TRP A 1 834 ? 25.400 -36.122 58.819 1.00 89.71 ? 845 TRP A O 1 ATOM 6097 C CB . TRP A 1 834 ? 22.910 -35.087 56.897 1.00 69.26 ? 845 TRP A CB 1 ATOM 6098 C CG . TRP A 1 834 ? 23.883 -35.391 55.794 1.00 70.44 ? 845 TRP A CG 1 ATOM 6099 C CD1 . TRP A 1 834 ? 24.319 -34.531 54.831 1.00 64.12 ? 845 TRP A CD1 1 ATOM 6100 C CD2 . TRP A 1 834 ? 24.537 -36.640 55.541 1.00 67.92 ? 845 TRP A CD2 1 ATOM 6101 N NE1 . TRP A 1 834 ? 25.203 -35.164 53.995 1.00 74.84 ? 845 TRP A NE1 1 ATOM 6102 C CE2 . TRP A 1 834 ? 25.352 -36.462 54.408 1.00 71.88 ? 845 TRP A CE2 1 ATOM 6103 C CE3 . TRP A 1 834 ? 24.509 -37.893 56.159 1.00 73.07 ? 845 TRP A CE3 1 ATOM 6104 C CZ2 . TRP A 1 834 ? 26.136 -37.485 53.883 1.00 73.08 ? 845 TRP A CZ2 1 ATOM 6105 C CZ3 . TRP A 1 834 ? 25.288 -38.907 55.637 1.00 66.46 ? 845 TRP A CZ3 1 ATOM 6106 C CH2 . TRP A 1 834 ? 26.090 -38.697 54.512 1.00 72.67 ? 845 TRP A CH2 1 ATOM 6107 N N . TYR A 1 835 ? 23.343 -36.679 59.557 1.00 86.39 ? 846 TYR A N 1 ATOM 6108 C CA . TYR A 1 835 ? 23.771 -37.922 60.182 1.00 86.25 ? 846 TYR A CA 1 ATOM 6109 C C . TYR A 1 835 ? 22.741 -39.018 59.931 1.00 80.55 ? 846 TYR A C 1 ATOM 6110 O O . TYR A 1 835 ? 21.538 -38.769 59.981 1.00 76.58 ? 846 TYR A O 1 ATOM 6111 C CB . TYR A 1 835 ? 24.001 -37.735 61.689 1.00 81.47 ? 846 TYR A CB 1 ATOM 6112 C CG . TYR A 1 835 ? 22.734 -37.505 62.487 1.00 91.71 ? 846 TYR A CG 1 ATOM 6113 C CD1 . TYR A 1 835 ? 22.074 -38.565 63.103 1.00 82.68 ? 846 TYR A CD1 1 ATOM 6114 C CD2 . TYR A 1 835 ? 22.197 -36.231 62.623 1.00 92.52 ? 846 TYR A CD2 1 ATOM 6115 C CE1 . TYR A 1 835 ? 20.914 -38.360 63.829 1.00 108.44 ? 846 TYR A CE1 1 ATOM 6116 C CE2 . TYR A 1 835 ? 21.038 -36.016 63.350 1.00 100.70 ? 846 TYR A CE2 1 ATOM 6117 C CZ . TYR A 1 835 ? 20.401 -37.084 63.950 1.00 106.03 ? 846 TYR A CZ 1 ATOM 6118 O OH . TYR A 1 835 ? 19.248 -36.875 64.673 1.00 104.65 ? 846 TYR A OH 1 ATOM 6119 N N . ILE A 1 836 ? 23.213 -40.227 59.648 1.00 73.63 ? 847 ILE A N 1 ATOM 6120 C CA . ILE A 1 836 ? 22.315 -41.361 59.465 1.00 74.46 ? 847 ILE A CA 1 ATOM 6121 C C . ILE A 1 836 ? 22.808 -42.583 60.221 1.00 86.93 ? 847 ILE A C 1 ATOM 6122 O O . ILE A 1 836 ? 24.000 -42.712 60.503 1.00 100.26 ? 847 ILE A O 1 ATOM 6123 C CB . ILE A 1 836 ? 22.155 -41.745 57.979 1.00 65.68 ? 847 ILE A CB 1 ATOM 6124 C CG1 . ILE A 1 836 ? 23.486 -42.232 57.398 1.00 73.41 ? 847 ILE A CG1 1 ATOM 6125 C CG2 . ILE A 1 836 ? 21.608 -40.580 57.176 1.00 82.51 ? 847 ILE A CG2 1 ATOM 6126 C CD1 . ILE A 1 836 ? 23.376 -42.764 55.971 1.00 59.85 ? 847 ILE A CD1 1 ATOM 6127 N N . VAL A 1 837 ? 21.884 -43.477 60.553 1.00 78.31 ? 848 VAL A N 1 ATOM 6128 C CA . VAL A 1 837 ? 22.258 -44.746 61.159 1.00 71.28 ? 848 VAL A CA 1 ATOM 6129 C C . VAL A 1 837 ? 21.795 -45.931 60.316 1.00 85.77 ? 848 VAL A C 1 ATOM 6130 O O . VAL A 1 837 ? 20.654 -45.983 59.853 1.00 68.22 ? 848 VAL A O 1 ATOM 6131 C CB . VAL A 1 837 ? 21.754 -44.890 62.629 1.00 82.19 ? 848 VAL A CB 1 ATOM 6132 C CG1 . VAL A 1 837 ? 22.533 -43.969 63.557 1.00 78.16 ? 848 VAL A CG1 1 ATOM 6133 C CG2 . VAL A 1 837 ? 20.257 -44.627 62.732 1.00 77.18 ? 848 VAL A CG2 1 ATOM 6134 N N . ASP A 1 838 ? 22.704 -46.876 60.110 1.00 77.37 ? 849 ASP A N 1 ATOM 6135 C CA . ASP A 1 838 ? 22.377 -48.114 59.424 1.00 75.90 ? 849 ASP A CA 1 ATOM 6136 C C . ASP A 1 838 ? 22.496 -49.276 60.400 1.00 72.33 ? 849 ASP A C 1 ATOM 6137 O O . ASP A 1 838 ? 23.406 -49.313 61.228 1.00 83.39 ? 849 ASP A O 1 ATOM 6138 C CB . ASP A 1 838 ? 23.322 -48.340 58.246 1.00 75.42 ? 849 ASP A CB 1 ATOM 6139 C CG . ASP A 1 838 ? 23.322 -47.187 57.273 1.00 72.24 ? 849 ASP A CG 1 ATOM 6140 O OD1 . ASP A 1 838 ? 22.271 -46.529 57.141 1.00 79.68 ? 849 ASP A OD1 1 ATOM 6141 O OD2 . ASP A 1 838 ? 24.372 -46.945 56.638 1.00 70.01 ? 849 ASP A OD2 1 ATOM 6142 N N . VAL A 1 839 ? 21.570 -50.221 60.304 1.00 68.64 ? 850 VAL A N 1 ATOM 6143 C CA . VAL A 1 839 ? 21.609 -51.410 61.139 1.00 78.08 ? 850 VAL A CA 1 ATOM 6144 C C . VAL A 1 839 ? 21.480 -52.654 60.275 1.00 86.14 ? 850 VAL A C 1 ATOM 6145 O O . VAL A 1 839 ? 20.504 -52.812 59.543 1.00 92.46 ? 850 VAL A O 1 ATOM 6146 C CB . VAL A 1 839 ? 20.487 -51.403 62.189 1.00 74.34 ? 850 VAL A CB 1 ATOM 6147 C CG1 . VAL A 1 839 ? 20.556 -52.659 63.034 1.00 76.62 ? 850 VAL A CG1 1 ATOM 6148 C CG2 . VAL A 1 839 ? 20.591 -50.171 63.067 1.00 74.12 ? 850 VAL A CG2 1 ATOM 6149 N N . SER A 1 840 ? 22.471 -53.534 60.358 1.00 79.07 ? 851 SER A N 1 ATOM 6150 C CA . SER A 1 840 ? 22.461 -54.760 59.574 1.00 77.52 ? 851 SER A CA 1 ATOM 6151 C C . SER A 1 840 ? 22.679 -55.988 60.451 1.00 76.89 ? 851 SER A C 1 ATOM 6152 O O . SER A 1 840 ? 23.223 -55.891 61.549 1.00 69.08 ? 851 SER A O 1 ATOM 6153 C CB . SER A 1 840 ? 23.523 -54.701 58.473 1.00 81.13 ? 851 SER A CB 1 ATOM 6154 O OG . SER A 1 840 ? 24.794 -54.353 58.999 1.00 73.80 ? 851 SER A OG 1 ATOM 6155 N N . GLY A 1 841 ? 22.248 -57.143 59.953 1.00 81.83 ? 852 GLY A N 1 ATOM 6156 C CA . GLY A 1 841 ? 22.418 -58.397 60.662 1.00 80.87 ? 852 GLY A CA 1 ATOM 6157 C C . GLY A 1 841 ? 22.422 -59.592 59.726 1.00 80.79 ? 852 GLY A C 1 ATOM 6158 O O . GLY A 1 841 ? 21.935 -59.516 58.599 1.00 73.38 ? 852 GLY A O 1 ATOM 6159 N N . TYR A 1 842 ? 22.973 -60.706 60.191 1.00 80.46 ? 853 TYR A N 1 ATOM 6160 C CA . TYR A 1 842 ? 23.010 -61.909 59.375 1.00 75.09 ? 853 TYR A CA 1 ATOM 6161 C C . TYR A 1 842 ? 22.803 -63.179 60.197 1.00 83.40 ? 853 TYR A C 1 ATOM 6162 O O . TYR A 1 842 ? 22.749 -63.141 61.427 1.00 77.31 ? 853 TYR A O 1 ATOM 6163 C CB . TYR A 1 842 ? 24.321 -61.989 58.598 1.00 69.88 ? 853 TYR A CB 1 ATOM 6164 C CG . TYR A 1 842 ? 25.548 -62.000 59.476 1.00 82.24 ? 853 TYR A CG 1 ATOM 6165 C CD1 . TYR A 1 842 ? 26.102 -63.197 59.913 1.00 81.16 ? 853 TYR A CD1 1 ATOM 6166 C CD2 . TYR A 1 842 ? 26.158 -60.815 59.865 1.00 93.04 ? 853 TYR A CD2 1 ATOM 6167 C CE1 . TYR A 1 842 ? 27.224 -63.212 60.715 1.00 91.77 ? 853 TYR A CE1 1 ATOM 6168 C CE2 . TYR A 1 842 ? 27.282 -60.820 60.664 1.00 102.73 ? 853 TYR A CE2 1 ATOM 6169 C CZ . TYR A 1 842 ? 27.810 -62.022 61.088 1.00 98.76 ? 853 TYR A CZ 1 ATOM 6170 O OH . TYR A 1 842 ? 28.927 -62.033 61.890 1.00 97.06 ? 853 TYR A OH 1 ATOM 6171 N N . TYR A 1 843 ? 22.689 -64.301 59.496 1.00 83.93 ? 854 TYR A N 1 ATOM 6172 C CA . TYR A 1 843 ? 22.461 -65.593 60.120 1.00 83.28 ? 854 TYR A CA 1 ATOM 6173 C C . TYR A 1 843 ? 22.764 -66.681 59.101 1.00 91.37 ? 854 TYR A C 1 ATOM 6174 O O . TYR A 1 843 ? 22.259 -66.644 57.982 1.00 86.47 ? 854 TYR A O 1 ATOM 6175 C CB . TYR A 1 843 ? 21.009 -65.708 60.587 1.00 73.57 ? 854 TYR A CB 1 ATOM 6176 C CG . TYR A 1 843 ? 20.714 -66.953 61.397 1.00 115.44 ? 854 TYR A CG 1 ATOM 6177 C CD1 . TYR A 1 843 ? 20.799 -66.939 62.783 1.00 113.61 ? 854 TYR A CD1 1 ATOM 6178 C CD2 . TYR A 1 843 ? 20.343 -68.141 60.776 1.00 108.64 ? 854 TYR A CD2 1 ATOM 6179 C CE1 . TYR A 1 843 ? 20.528 -68.071 63.529 1.00 114.01 ? 854 TYR A CE1 1 ATOM 6180 C CE2 . TYR A 1 843 ? 20.071 -69.279 61.515 1.00 112.65 ? 854 TYR A CE2 1 ATOM 6181 C CZ . TYR A 1 843 ? 20.165 -69.237 62.891 1.00 116.96 ? 854 TYR A CZ 1 ATOM 6182 O OH . TYR A 1 843 ? 19.895 -70.364 63.632 1.00 123.94 ? 854 TYR A OH 1 ATOM 6183 N N . THR A 1 844 ? 23.595 -67.644 59.484 1.00 100.80 ? 855 THR A N 1 ATOM 6184 C CA . THR A 1 844 ? 23.924 -68.752 58.594 1.00 104.80 ? 855 THR A CA 1 ATOM 6185 C C . THR A 1 844 ? 23.453 -70.072 59.192 1.00 115.60 ? 855 THR A C 1 ATOM 6186 O O . THR A 1 844 ? 23.283 -70.185 60.407 1.00 116.92 ? 855 THR A O 1 ATOM 6187 C CB . THR A 1 844 ? 25.437 -68.842 58.323 1.00 105.15 ? 855 THR A CB 1 ATOM 6188 O OG1 . THR A 1 844 ? 26.035 -69.763 59.243 1.00 119.17 ? 855 THR A OG1 1 ATOM 6189 C CG2 . THR A 1 844 ? 26.096 -67.476 58.468 1.00 71.96 ? 855 THR A CG2 1 ATOM 6190 N N . VAL A 1 845 ? 23.241 -71.066 58.333 1.00 121.63 ? 856 VAL A N 1 ATOM 6191 C CA . VAL A 1 845 ? 22.842 -72.398 58.779 1.00 122.58 ? 856 VAL A CA 1 ATOM 6192 C C . VAL A 1 845 ? 23.942 -73.410 58.455 1.00 131.34 ? 856 VAL A C 1 ATOM 6193 O O . VAL A 1 845 ? 23.708 -74.404 57.764 1.00 129.32 ? 856 VAL A O 1 ATOM 6194 C CB . VAL A 1 845 ? 21.508 -72.844 58.138 1.00 116.71 ? 856 VAL A CB 1 ATOM 6195 C CG1 . VAL A 1 845 ? 20.874 -73.972 58.948 1.00 120.94 ? 856 VAL A CG1 1 ATOM 6196 C CG2 . VAL A 1 845 ? 20.549 -71.668 58.035 1.00 107.26 ? 856 VAL A CG2 1 ATOM 6197 N N . LYS A 1 846 ? 25.144 -73.131 58.956 1.00 141.39 ? 857 LYS A N 1 ATOM 6198 C CA . LYS A 1 846 ? 26.309 -74.002 58.788 1.00 145.35 ? 857 LYS A CA 1 ATOM 6199 C C . LYS A 1 846 ? 26.690 -74.232 57.326 1.00 141.98 ? 857 LYS A C 1 ATOM 6200 O O . LYS A 1 846 ? 26.205 -75.167 56.688 1.00 146.43 ? 857 LYS A O 1 ATOM 6201 C CB . LYS A 1 846 ? 26.102 -75.341 59.507 1.00 148.24 ? 857 LYS A CB 1 ATOM 6202 N N . LYS A 1 847 ? 27.551 -73.360 56.807 1.00 132.28 ? 858 LYS A N 1 ATOM 6203 C CA . LYS A 1 847 ? 28.127 -73.495 55.464 1.00 133.04 ? 858 LYS A CA 1 ATOM 6204 C C . LYS A 1 847 ? 27.137 -73.381 54.296 1.00 133.63 ? 858 LYS A C 1 ATOM 6205 O O . LYS A 1 847 ? 27.532 -73.014 53.193 1.00 148.68 ? 858 LYS A O 1 ATOM 6206 C CB . LYS A 1 847 ? 28.965 -74.780 55.348 1.00 138.88 ? 858 LYS A CB 1 ATOM 6207 C CG . LYS A 1 847 ? 28.388 -75.849 54.419 1.00 138.89 ? 858 LYS A CG 1 ATOM 6208 C CD . LYS A 1 847 ? 29.072 -75.854 53.054 1.00 129.01 ? 858 LYS A CD 1 ATOM 6209 C CE . LYS A 1 847 ? 30.526 -76.292 53.156 1.00 127.84 ? 858 LYS A CE 1 ATOM 6210 N NZ . LYS A 1 847 ? 30.669 -77.700 53.633 1.00 125.40 ? 858 LYS A NZ 1 ATOM 6211 N N . HIS A 1 848 ? 25.864 -73.686 54.526 1.00 121.59 ? 859 HIS A N 1 ATOM 6212 C CA . HIS A 1 848 ? 24.880 -73.663 53.446 1.00 115.73 ? 859 HIS A CA 1 ATOM 6213 C C . HIS A 1 848 ? 24.203 -72.302 53.301 1.00 103.50 ? 859 HIS A C 1 ATOM 6214 O O . HIS A 1 848 ? 24.782 -71.353 52.773 1.00 95.53 ? 859 HIS A O 1 ATOM 6215 C CB . HIS A 1 848 ? 23.821 -74.747 53.658 1.00 127.16 ? 859 HIS A CB 1 ATOM 6216 C CG . HIS A 1 848 ? 24.388 -76.126 53.798 1.00 140.03 ? 859 HIS A CG 1 ATOM 6217 N ND1 . HIS A 1 848 ? 24.975 -76.575 54.962 1.00 142.00 ? 859 HIS A ND1 1 ATOM 6218 C CD2 . HIS A 1 848 ? 24.457 -77.154 52.920 1.00 146.07 ? 859 HIS A CD2 1 ATOM 6219 C CE1 . HIS A 1 848 ? 25.381 -77.821 54.795 1.00 145.05 ? 859 HIS A CE1 1 ATOM 6220 N NE2 . HIS A 1 848 ? 25.079 -78.196 53.566 1.00 150.05 ? 859 HIS A NE2 1 ATOM 6221 N N . PHE A 1 849 ? 22.966 -72.223 53.772 1.00 107.55 ? 860 PHE A N 1 ATOM 6222 C CA . PHE A 1 849 ? 22.189 -70.995 53.709 1.00 98.19 ? 860 PHE A CA 1 ATOM 6223 C C . PHE A 1 849 ? 22.781 -69.939 54.630 1.00 91.62 ? 860 PHE A C 1 ATOM 6224 O O . PHE A 1 849 ? 23.282 -70.253 55.707 1.00 114.60 ? 860 PHE A O 1 ATOM 6225 C CB . PHE A 1 849 ? 20.738 -71.270 54.113 1.00 109.55 ? 860 PHE A CB 1 ATOM 6226 C CG . PHE A 1 849 ? 20.095 -72.393 53.346 1.00 120.55 ? 860 PHE A CG 1 ATOM 6227 C CD1 . PHE A 1 849 ? 20.257 -73.710 53.748 1.00 114.52 ? 860 PHE A CD1 1 ATOM 6228 C CD2 . PHE A 1 849 ? 19.324 -72.131 52.225 1.00 121.85 ? 860 PHE A CD2 1 ATOM 6229 C CE1 . PHE A 1 849 ? 19.671 -74.740 53.042 1.00 114.12 ? 860 PHE A CE1 1 ATOM 6230 C CE2 . PHE A 1 849 ? 18.733 -73.160 51.517 1.00 116.34 ? 860 PHE A CE2 1 ATOM 6231 C CZ . PHE A 1 849 ? 18.907 -74.465 51.926 1.00 112.20 ? 860 PHE A CZ 1 ATOM 6232 N N . THR A 1 850 ? 22.730 -68.686 54.196 1.00 80.11 ? 861 THR A N 1 ATOM 6233 C CA . THR A 1 850 ? 23.078 -67.561 55.056 1.00 84.07 ? 861 THR A CA 1 ATOM 6234 C C . THR A 1 850 ? 22.302 -66.305 54.650 1.00 83.65 ? 861 THR A C 1 ATOM 6235 O O . THR A 1 850 ? 22.453 -65.798 53.540 1.00 76.71 ? 861 THR A O 1 ATOM 6236 C CB . THR A 1 850 ? 24.604 -67.301 55.103 1.00 86.33 ? 861 THR A CB 1 ATOM 6237 O OG1 . THR A 1 850 ? 24.850 -65.918 55.386 1.00 86.56 ? 861 THR A OG1 1 ATOM 6238 C CG2 . THR A 1 850 ? 25.261 -67.677 53.788 1.00 93.44 ? 861 THR A CG2 1 ATOM 6239 N N . LEU A 1 851 ? 21.460 -65.824 55.561 1.00 90.16 ? 862 LEU A N 1 ATOM 6240 C CA . LEU A 1 851 ? 20.539 -64.726 55.281 1.00 86.95 ? 862 LEU A CA 1 ATOM 6241 C C . LEU A 1 851 ? 21.097 -63.388 55.737 1.00 93.57 ? 862 LEU A C 1 ATOM 6242 O O . LEU A 1 851 ? 21.780 -63.310 56.756 1.00 96.76 ? 862 LEU A O 1 ATOM 6243 C CB . LEU A 1 851 ? 19.197 -64.977 55.972 1.00 85.77 ? 862 LEU A CB 1 ATOM 6244 C CG . LEU A 1 851 ? 17.986 -65.243 55.075 1.00 88.70 ? 862 LEU A CG 1 ATOM 6245 C CD1 . LEU A 1 851 ? 16.850 -65.866 55.880 1.00 79.28 ? 862 LEU A CD1 1 ATOM 6246 C CD2 . LEU A 1 851 ? 17.524 -63.958 54.387 1.00 65.98 ? 862 LEU A CD2 1 ATOM 6247 N N . ARG A 1 852 ? 20.801 -62.335 54.980 1.00 96.91 ? 863 ARG A N 1 ATOM 6248 C CA . ARG A 1 852 ? 21.245 -60.991 55.337 1.00 92.80 ? 863 ARG A CA 1 ATOM 6249 C C . ARG A 1 852 ? 20.121 -59.969 55.241 1.00 79.66 ? 863 ARG A C 1 ATOM 6250 O O . ARG A 1 852 ? 19.220 -60.093 54.413 1.00 85.98 ? 863 ARG A O 1 ATOM 6251 C CB . ARG A 1 852 ? 22.430 -60.556 54.473 1.00 59.86 ? 863 ARG A CB 1 ATOM 6252 C CG . ARG A 1 852 ? 23.639 -61.470 54.581 1.00 62.01 ? 863 ARG A CG 1 ATOM 6253 C CD . ARG A 1 852 ? 24.857 -60.862 53.916 1.00 63.61 ? 863 ARG A CD 1 ATOM 6254 N NE . ARG A 1 852 ? 25.974 -61.801 53.885 1.00 81.55 ? 863 ARG A NE 1 ATOM 6255 C CZ . ARG A 1 852 ? 26.799 -62.014 54.905 1.00 96.87 ? 863 ARG A CZ 1 ATOM 6256 N NH1 . ARG A 1 852 ? 26.634 -61.354 56.045 1.00 101.46 ? 863 ARG A NH1 1 ATOM 6257 N NH2 . ARG A 1 852 ? 27.788 -62.888 54.787 1.00 99.05 ? 863 ARG A NH2 1 ATOM 6258 N N . ALA A 1 853 ? 20.185 -58.959 56.099 1.00 67.40 ? 864 ALA A N 1 ATOM 6259 C CA . ALA A 1 853 ? 19.178 -57.911 56.133 1.00 72.82 ? 864 ALA A CA 1 ATOM 6260 C C . ALA A 1 853 ? 19.768 -56.629 56.708 1.00 79.66 ? 864 ALA A C 1 ATOM 6261 O O . ALA A 1 853 ? 20.428 -56.646 57.746 1.00 81.91 ? 864 ALA A O 1 ATOM 6262 C CB . ALA A 1 853 ? 17.968 -58.354 56.947 1.00 64.45 ? 864 ALA A CB 1 ATOM 6263 N N . GLY A 1 854 ? 19.531 -55.519 56.022 1.00 83.13 ? 865 GLY A N 1 ATOM 6264 C CA . GLY A 1 854 ? 20.008 -54.232 56.482 1.00 77.01 ? 865 GLY A CA 1 ATOM 6265 C C . GLY A 1 854 ? 18.950 -53.161 56.327 1.00 75.63 ? 865 GLY A C 1 ATOM 6266 O O . GLY A 1 854 ? 18.322 -53.045 55.273 1.00 73.00 ? 865 GLY A O 1 ATOM 6267 N N . VAL A 1 855 ? 18.740 -52.390 57.389 1.00 71.43 ? 866 VAL A N 1 ATOM 6268 C CA . VAL A 1 855 ? 17.879 -51.218 57.327 1.00 65.89 ? 866 VAL A CA 1 ATOM 6269 C C . VAL A 1 855 ? 18.764 -49.984 57.301 1.00 73.63 ? 866 VAL A C 1 ATOM 6270 O O . VAL A 1 855 ? 19.491 -49.712 58.254 1.00 80.06 ? 866 VAL A O 1 ATOM 6271 C CB . VAL A 1 855 ? 16.941 -51.123 58.533 1.00 72.10 ? 866 VAL A CB 1 ATOM 6272 C CG1 . VAL A 1 855 ? 15.875 -50.069 58.275 1.00 67.64 ? 866 VAL A CG1 1 ATOM 6273 C CG2 . VAL A 1 855 ? 16.308 -52.472 58.821 1.00 77.84 ? 866 VAL A CG2 1 ATOM 6274 N N . TYR A 1 856 ? 18.706 -49.243 56.203 1.00 81.81 ? 867 TYR A N 1 ATOM 6275 C CA . TYR A 1 856 ? 19.590 -48.102 56.016 1.00 81.23 ? 867 TYR A CA 1 ATOM 6276 C C . TYR A 1 856 ? 18.842 -46.787 56.207 1.00 76.08 ? 867 TYR A C 1 ATOM 6277 O O . TYR A 1 856 ? 17.704 -46.637 55.752 1.00 70.57 ? 867 TYR A O 1 ATOM 6278 C CB . TYR A 1 856 ? 20.267 -48.179 54.649 1.00 73.03 ? 867 TYR A CB 1 ATOM 6279 C CG . TYR A 1 856 ? 21.099 -49.434 54.469 1.00 80.68 ? 867 TYR A CG 1 ATOM 6280 C CD1 . TYR A 1 856 ? 22.465 -49.427 54.725 1.00 86.14 ? 867 TYR A CD1 1 ATOM 6281 C CD2 . TYR A 1 856 ? 20.516 -50.628 54.055 1.00 72.52 ? 867 TYR A CD2 1 ATOM 6282 C CE1 . TYR A 1 856 ? 23.229 -50.568 54.565 1.00 77.55 ? 867 TYR A CE1 1 ATOM 6283 C CE2 . TYR A 1 856 ? 21.273 -51.775 53.895 1.00 72.84 ? 867 TYR A CE2 1 ATOM 6284 C CZ . TYR A 1 856 ? 22.629 -51.739 54.150 1.00 78.73 ? 867 TYR A CZ 1 ATOM 6285 O OH . TYR A 1 856 ? 23.390 -52.876 53.991 1.00 84.91 ? 867 TYR A OH 1 ATOM 6286 N N . ASN A 1 857 ? 19.495 -45.850 56.891 1.00 80.09 ? 868 ASN A N 1 ATOM 6287 C CA . ASN A 1 857 ? 18.861 -44.619 57.354 1.00 81.72 ? 868 ASN A CA 1 ATOM 6288 C C . ASN A 1 857 ? 17.640 -44.938 58.219 1.00 76.16 ? 868 ASN A C 1 ATOM 6289 O O . ASN A 1 857 ? 16.515 -44.571 57.882 1.00 75.79 ? 868 ASN A O 1 ATOM 6290 C CB . ASN A 1 857 ? 18.508 -43.708 56.171 1.00 72.00 ? 868 ASN A CB 1 ATOM 6291 C CG . ASN A 1 857 ? 17.959 -42.363 56.605 1.00 92.63 ? 868 ASN A CG 1 ATOM 6292 O OD1 . ASN A 1 857 ? 16.963 -41.883 56.065 1.00 84.67 ? 868 ASN A OD1 1 ATOM 6293 N ND2 . ASN A 1 857 ? 18.601 -41.752 57.591 1.00 98.68 ? 868 ASN A ND2 1 ATOM 6294 N N . LEU A 1 858 ? 17.882 -45.640 59.328 1.00 92.26 ? 869 LEU A N 1 ATOM 6295 C CA . LEU A 1 858 ? 16.823 -46.107 60.228 1.00 88.77 ? 869 LEU A CA 1 ATOM 6296 C C . LEU A 1 858 ? 15.935 -44.950 60.657 1.00 87.29 ? 869 LEU A C 1 ATOM 6297 O O . LEU A 1 858 ? 14.716 -45.000 60.498 1.00 83.77 ? 869 LEU A O 1 ATOM 6298 C CB . LEU A 1 858 ? 17.423 -46.793 61.459 1.00 83.12 ? 869 LEU A CB 1 ATOM 6299 C CG . LEU A 1 858 ? 16.608 -47.870 62.190 1.00 104.33 ? 869 LEU A CG 1 ATOM 6300 C CD1 . LEU A 1 858 ? 17.425 -48.454 63.332 1.00 87.45 ? 869 LEU A CD1 1 ATOM 6301 C CD2 . LEU A 1 858 ? 15.264 -47.367 62.715 1.00 86.46 ? 869 LEU A CD2 1 ATOM 6302 N N . LEU A 1 859 ? 16.553 -43.919 61.222 1.00 96.89 ? 870 LEU A N 1 ATOM 6303 C CA . LEU A 1 859 ? 15.866 -42.659 61.431 1.00 108.59 ? 870 LEU A CA 1 ATOM 6304 C C . LEU A 1 859 ? 15.656 -42.050 60.054 1.00 118.03 ? 870 LEU A C 1 ATOM 6305 O O . LEU A 1 859 ? 16.620 -41.754 59.348 1.00 127.69 ? 870 LEU A O 1 ATOM 6306 C CB . LEU A 1 859 ? 16.699 -41.721 62.303 1.00 111.93 ? 870 LEU A CB 1 ATOM 6307 C CG . LEU A 1 859 ? 16.597 -41.860 63.826 1.00 119.74 ? 870 LEU A CG 1 ATOM 6308 C CD1 . LEU A 1 859 ? 17.099 -43.213 64.319 1.00 90.55 ? 870 LEU A CD1 1 ATOM 6309 C CD2 . LEU A 1 859 ? 17.350 -40.724 64.504 1.00 120.65 ? 870 LEU A CD2 1 ATOM 6310 N N . ASN A 1 860 ? 14.397 -41.878 59.666 1.00 105.32 ? 871 ASN A N 1 ATOM 6311 C CA . ASN A 1 860 ? 14.059 -41.391 58.333 1.00 89.94 ? 871 ASN A CA 1 ATOM 6312 C C . ASN A 1 860 ? 14.570 -39.975 58.080 1.00 86.57 ? 871 ASN A C 1 ATOM 6313 O O . ASN A 1 860 ? 13.779 -39.061 57.840 1.00 84.91 ? 871 ASN A O 1 ATOM 6314 C CB . ASN A 1 860 ? 12.542 -41.421 58.149 1.00 89.76 ? 871 ASN A CB 1 ATOM 6315 C CG . ASN A 1 860 ? 12.130 -41.824 56.754 1.00 83.89 ? 871 ASN A CG 1 ATOM 6316 O OD1 . ASN A 1 860 ? 12.952 -41.881 55.842 1.00 90.60 ? 871 ASN A OD1 1 ATOM 6317 N ND2 . ASN A 1 860 ? 10.844 -42.105 56.578 1.00 79.28 ? 871 ASN A ND2 1 ATOM 6318 N N . TYR A 1 861 ? 15.887 -39.790 58.131 1.00 78.17 ? 872 TYR A N 1 ATOM 6319 C CA . TYR A 1 861 ? 16.462 -38.453 58.023 1.00 81.23 ? 872 TYR A CA 1 ATOM 6320 C C . TYR A 1 861 ? 16.411 -37.930 56.594 1.00 84.12 ? 872 TYR A C 1 ATOM 6321 O O . TYR A 1 861 ? 16.958 -38.543 55.678 1.00 83.71 ? 872 TYR A O 1 ATOM 6322 C CB . TYR A 1 861 ? 17.902 -38.428 58.536 1.00 80.78 ? 872 TYR A CB 1 ATOM 6323 C CG . TYR A 1 861 ? 18.411 -37.031 58.831 1.00 96.98 ? 872 TYR A CG 1 ATOM 6324 C CD1 . TYR A 1 861 ? 18.226 -36.454 60.082 1.00 106.31 ? 872 TYR A CD1 1 ATOM 6325 C CD2 . TYR A 1 861 ? 19.074 -36.290 57.862 1.00 96.48 ? 872 TYR A CD2 1 ATOM 6326 C CE1 . TYR A 1 861 ? 18.686 -35.177 60.360 1.00 103.20 ? 872 TYR A CE1 1 ATOM 6327 C CE2 . TYR A 1 861 ? 19.539 -35.012 58.132 1.00 98.35 ? 872 TYR A CE2 1 ATOM 6328 C CZ . TYR A 1 861 ? 19.341 -34.462 59.383 1.00 99.73 ? 872 TYR A CZ 1 ATOM 6329 O OH . TYR A 1 861 ? 19.796 -33.193 59.661 1.00 93.49 ? 872 TYR A OH 1 ATOM 6330 N N . ARG A 1 862 ? 15.747 -36.793 56.413 1.00 83.41 ? 873 ARG A N 1 ATOM 6331 C CA . ARG A 1 862 ? 15.666 -36.155 55.109 1.00 82.41 ? 873 ARG A CA 1 ATOM 6332 C C . ARG A 1 862 ? 16.851 -35.219 54.908 1.00 83.70 ? 873 ARG A C 1 ATOM 6333 O O . ARG A 1 862 ? 16.992 -34.220 55.613 1.00 76.15 ? 873 ARG A O 1 ATOM 6334 C CB . ARG A 1 862 ? 14.354 -35.383 54.964 1.00 75.08 ? 873 ARG A CB 1 ATOM 6335 C CG . ARG A 1 862 ? 14.201 -34.670 53.628 1.00 78.55 ? 873 ARG A CG 1 ATOM 6336 C CD . ARG A 1 862 ? 14.098 -33.169 53.813 1.00 88.24 ? 873 ARG A CD 1 ATOM 6337 N NE . ARG A 1 862 ? 12.859 -32.643 53.249 1.00 97.49 ? 873 ARG A NE 1 ATOM 6338 C CZ . ARG A 1 862 ? 12.740 -32.162 52.015 1.00 95.20 ? 873 ARG A CZ 1 ATOM 6339 N NH1 . ARG A 1 862 ? 13.792 -32.131 51.204 1.00 93.56 ? 873 ARG A NH1 1 ATOM 6340 N NH2 . ARG A 1 862 ? 11.569 -31.708 51.591 1.00 90.74 ? 873 ARG A NH2 1 ATOM 6341 N N . TYR A 1 863 ? 17.705 -35.550 53.947 1.00 71.82 ? 874 TYR A N 1 ATOM 6342 C CA . TYR A 1 863 ? 18.884 -34.739 53.678 1.00 76.22 ? 874 TYR A CA 1 ATOM 6343 C C . TYR A 1 863 ? 19.273 -34.786 52.210 1.00 72.68 ? 874 TYR A C 1 ATOM 6344 O O . TYR A 1 863 ? 18.792 -35.630 51.457 1.00 72.92 ? 874 TYR A O 1 ATOM 6345 C CB . TYR A 1 863 ? 20.059 -35.185 54.554 1.00 78.29 ? 874 TYR A CB 1 ATOM 6346 C CG . TYR A 1 863 ? 20.567 -36.585 54.279 1.00 81.61 ? 874 TYR A CG 1 ATOM 6347 C CD1 . TYR A 1 863 ? 21.810 -36.791 53.698 1.00 83.30 ? 874 TYR A CD1 1 ATOM 6348 C CD2 . TYR A 1 863 ? 19.810 -37.699 54.610 1.00 87.73 ? 874 TYR A CD2 1 ATOM 6349 C CE1 . TYR A 1 863 ? 22.286 -38.069 53.455 1.00 86.80 ? 874 TYR A CE1 1 ATOM 6350 C CE2 . TYR A 1 863 ? 20.274 -38.980 54.365 1.00 89.97 ? 874 TYR A CE2 1 ATOM 6351 C CZ . TYR A 1 863 ? 21.514 -39.160 53.790 1.00 82.85 ? 874 TYR A CZ 1 ATOM 6352 O OH . TYR A 1 863 ? 21.976 -40.434 53.548 1.00 72.62 ? 874 TYR A OH 1 ATOM 6353 N N . VAL A 1 864 ? 20.142 -33.867 51.808 1.00 75.00 ? 875 VAL A N 1 ATOM 6354 C CA . VAL A 1 864 ? 20.645 -33.840 50.443 1.00 66.10 ? 875 VAL A CA 1 ATOM 6355 C C . VAL A 1 864 ? 22.158 -34.003 50.450 1.00 84.56 ? 875 VAL A C 1 ATOM 6356 O O . VAL A 1 864 ? 22.869 -33.211 51.064 1.00 83.63 ? 875 VAL A O 1 ATOM 6357 C CB . VAL A 1 864 ? 20.279 -32.523 49.740 1.00 66.06 ? 875 VAL A CB 1 ATOM 6358 C CG1 . VAL A 1 864 ? 21.071 -32.371 48.464 1.00 63.93 ? 875 VAL A CG1 1 ATOM 6359 C CG2 . VAL A 1 864 ? 18.778 -32.457 49.467 1.00 66.42 ? 875 VAL A CG2 1 ATOM 6360 N N . THR A 1 865 ? 22.645 -35.040 49.777 1.00 85.57 ? 876 THR A N 1 ATOM 6361 C CA . THR A 1 865 ? 24.079 -35.306 49.728 1.00 88.03 ? 876 THR A CA 1 ATOM 6362 C C . THR A 1 865 ? 24.783 -34.333 48.792 1.00 77.91 ? 876 THR A C 1 ATOM 6363 O O . THR A 1 865 ? 24.197 -33.874 47.821 1.00 78.67 ? 876 THR A O 1 ATOM 6364 C CB . THR A 1 865 ? 24.373 -36.748 49.276 1.00 86.36 ? 876 THR A CB 1 ATOM 6365 O OG1 . THR A 1 865 ? 23.478 -37.110 48.216 1.00 82.56 ? 876 THR A OG1 1 ATOM 6366 C CG2 . THR A 1 865 ? 24.185 -37.711 50.431 1.00 92.48 ? 876 THR A CG2 1 ATOM 6367 N N . TRP A 1 866 ? 26.041 -34.023 49.091 1.00 73.56 ? 877 TRP A N 1 ATOM 6368 C CA . TRP A 1 866 ? 26.822 -33.119 48.253 1.00 70.58 ? 877 TRP A CA 1 ATOM 6369 C C . TRP A 1 866 ? 27.169 -33.747 46.908 1.00 74.41 ? 877 TRP A C 1 ATOM 6370 O O . TRP A 1 866 ? 27.135 -33.075 45.874 1.00 59.00 ? 877 TRP A O 1 ATOM 6371 C CB . TRP A 1 866 ? 28.107 -32.684 48.958 1.00 78.31 ? 877 TRP A CB 1 ATOM 6372 C CG . TRP A 1 866 ? 29.054 -31.967 48.042 1.00 83.74 ? 877 TRP A CG 1 ATOM 6373 C CD1 . TRP A 1 866 ? 30.285 -32.393 47.635 1.00 83.19 ? 877 TRP A CD1 1 ATOM 6374 C CD2 . TRP A 1 866 ? 28.830 -30.710 47.393 1.00 82.16 ? 877 TRP A CD2 1 ATOM 6375 N NE1 . TRP A 1 866 ? 30.849 -31.473 46.784 1.00 72.34 ? 877 TRP A NE1 1 ATOM 6376 C CE2 . TRP A 1 866 ? 29.974 -30.431 46.617 1.00 78.80 ? 877 TRP A CE2 1 ATOM 6377 C CE3 . TRP A 1 866 ? 27.776 -29.791 47.395 1.00 77.45 ? 877 TRP A CE3 1 ATOM 6378 C CZ2 . TRP A 1 866 ? 30.094 -29.270 45.854 1.00 75.94 ? 877 TRP A CZ2 1 ATOM 6379 C CZ3 . TRP A 1 866 ? 27.897 -28.641 46.638 1.00 79.07 ? 877 TRP A CZ3 1 ATOM 6380 C CH2 . TRP A 1 866 ? 29.047 -28.391 45.877 1.00 77.70 ? 877 TRP A CH2 1 ATOM 6381 N N . GLU A 1 867 ? 27.507 -35.035 46.939 1.00 73.32 ? 878 GLU A N 1 ATOM 6382 C CA . GLU A 1 867 ? 27.847 -35.793 45.739 1.00 65.18 ? 878 GLU A CA 1 ATOM 6383 C C . GLU A 1 867 ? 26.731 -35.706 44.708 1.00 72.20 ? 878 GLU A C 1 ATOM 6384 O O . GLU A 1 867 ? 26.973 -35.791 43.504 1.00 76.34 ? 878 GLU A O 1 ATOM 6385 C CB . GLU A 1 867 ? 28.131 -37.258 46.085 1.00 80.13 ? 878 GLU A CB 1 ATOM 6386 C CG . GLU A 1 867 ? 29.531 -37.523 46.637 1.00 100.80 ? 878 GLU A CG 1 ATOM 6387 C CD . GLU A 1 867 ? 29.792 -36.843 47.973 1.00 111.59 ? 878 GLU A CD 1 ATOM 6388 O OE1 . GLU A 1 867 ? 28.865 -36.783 48.810 1.00 113.57 ? 878 GLU A OE1 1 ATOM 6389 O OE2 . GLU A 1 867 ? 30.927 -36.366 48.184 1.00 111.70 ? 878 GLU A OE2 1 ATOM 6390 N N . ASN A 1 868 ? 25.507 -35.533 45.191 1.00 68.05 ? 879 ASN A N 1 ATOM 6391 C CA . ASN A 1 868 ? 24.366 -35.320 44.316 1.00 75.29 ? 879 ASN A CA 1 ATOM 6392 C C . ASN A 1 868 ? 24.329 -33.901 43.759 1.00 76.60 ? 879 ASN A C 1 ATOM 6393 O O . ASN A 1 868 ? 24.209 -33.712 42.549 1.00 71.94 ? 879 ASN A O 1 ATOM 6394 C CB . ASN A 1 868 ? 23.065 -35.644 45.049 1.00 76.59 ? 879 ASN A CB 1 ATOM 6395 C CG . ASN A 1 868 ? 22.565 -37.040 44.752 1.00 77.38 ? 879 ASN A CG 1 ATOM 6396 O OD1 . ASN A 1 868 ? 21.456 -37.218 44.253 1.00 91.72 ? 879 ASN A OD1 1 ATOM 6397 N ND2 . ASN A 1 868 ? 23.391 -38.040 45.035 1.00 77.97 ? 879 ASN A ND2 1 ATOM 6398 N N . VAL A 1 869 ? 24.442 -32.911 44.642 1.00 73.36 ? 880 VAL A N 1 ATOM 6399 C CA . VAL A 1 869 ? 24.407 -31.506 44.238 1.00 65.97 ? 880 VAL A CA 1 ATOM 6400 C C . VAL A 1 869 ? 25.535 -31.179 43.267 1.00 63.24 ? 880 VAL A C 1 ATOM 6401 O O . VAL A 1 869 ? 25.430 -30.244 42.471 1.00 68.24 ? 880 VAL A O 1 ATOM 6402 C CB . VAL A 1 869 ? 24.523 -30.554 45.447 1.00 70.38 ? 880 VAL A CB 1 ATOM 6403 C CG1 . VAL A 1 869 ? 24.031 -29.161 45.075 1.00 73.88 ? 880 VAL A CG1 1 ATOM 6404 C CG2 . VAL A 1 869 ? 23.728 -31.076 46.605 1.00 72.02 ? 880 VAL A CG2 1 ATOM 6405 N N . ARG A 1 870 ? 26.612 -31.956 43.342 1.00 58.84 ? 881 ARG A N 1 ATOM 6406 C CA . ARG A 1 870 ? 27.774 -31.762 42.485 1.00 65.35 ? 881 ARG A CA 1 ATOM 6407 C C . ARG A 1 870 ? 27.383 -31.768 41.005 1.00 71.94 ? 881 ARG A C 1 ATOM 6408 O O . ARG A 1 870 ? 27.963 -31.042 40.197 1.00 52.68 ? 881 ARG A O 1 ATOM 6409 C CB . ARG A 1 870 ? 28.831 -32.832 42.780 1.00 75.22 ? 881 ARG A CB 1 ATOM 6410 C CG . ARG A 1 870 ? 30.079 -32.714 41.930 1.00 74.54 ? 881 ARG A CG 1 ATOM 6411 C CD . ARG A 1 870 ? 31.333 -33.076 42.704 1.00 63.25 ? 881 ARG A CD 1 ATOM 6412 N NE . ARG A 1 870 ? 32.519 -32.674 41.955 1.00 66.94 ? 881 ARG A NE 1 ATOM 6413 C CZ . ARG A 1 870 ? 33.373 -33.517 41.386 1.00 70.54 ? 881 ARG A CZ 1 ATOM 6414 N NH1 . ARG A 1 870 ? 33.196 -34.825 41.501 1.00 70.33 ? 881 ARG A NH1 1 ATOM 6415 N NH2 . ARG A 1 870 ? 34.417 -33.048 40.716 1.00 75.45 ? 881 ARG A NH2 1 ATOM 6416 N N . GLN A 1 871 ? 26.372 -32.568 40.671 1.00 51.78 ? 882 GLN A N 1 ATOM 6417 C CA . GLN A 1 871 ? 25.867 -32.677 39.305 1.00 63.97 ? 882 GLN A CA 1 ATOM 6418 C C . GLN A 1 871 ? 25.455 -31.334 38.690 1.00 67.47 ? 882 GLN A C 1 ATOM 6419 O O . GLN A 1 871 ? 25.399 -31.200 37.465 1.00 71.13 ? 882 GLN A O 1 ATOM 6420 C CB . GLN A 1 871 ? 24.685 -33.651 39.246 1.00 49.03 ? 882 GLN A CB 1 ATOM 6421 C CG . GLN A 1 871 ? 25.023 -35.093 39.581 1.00 54.45 ? 882 GLN A CG 1 ATOM 6422 C CD . GLN A 1 871 ? 23.794 -35.982 39.577 1.00 62.39 ? 882 GLN A CD 1 ATOM 6423 O OE1 . GLN A 1 871 ? 23.551 -36.722 38.624 1.00 66.91 ? 882 GLN A OE1 1 ATOM 6424 N NE2 . GLN A 1 871 ? 23.006 -35.908 40.645 1.00 58.73 ? 882 GLN A NE2 1 ATOM 6425 N N . THR A 1 872 ? 25.162 -30.347 39.533 1.00 57.12 ? 883 THR A N 1 ATOM 6426 C CA . THR A 1 872 ? 24.757 -29.030 39.045 1.00 59.99 ? 883 THR A CA 1 ATOM 6427 C C . THR A 1 872 ? 25.948 -28.118 38.762 1.00 53.91 ? 883 THR A C 1 ATOM 6428 O O . THR A 1 872 ? 25.792 -27.061 38.154 1.00 64.83 ? 883 THR A O 1 ATOM 6429 C CB . THR A 1 872 ? 23.817 -28.304 40.036 1.00 65.46 ? 883 THR A CB 1 ATOM 6430 O OG1 . THR A 1 872 ? 24.478 -28.131 41.295 1.00 69.90 ? 883 THR A OG1 1 ATOM 6431 C CG2 . THR A 1 872 ? 22.533 -29.087 40.242 1.00 55.07 ? 883 THR A CG2 1 ATOM 6432 N N . ALA A 1 873 ? 27.132 -28.527 39.203 1.00 62.71 ? 884 ALA A N 1 ATOM 6433 C CA . ALA A 1 873 ? 28.316 -27.676 39.113 1.00 68.07 ? 884 ALA A CA 1 ATOM 6434 C C . ALA A 1 873 ? 28.744 -27.415 37.680 1.00 76.62 ? 884 ALA A C 1 ATOM 6435 O O . ALA A 1 873 ? 28.537 -28.243 36.797 1.00 77.76 ? 884 ALA A O 1 ATOM 6436 C CB . ALA A 1 873 ? 29.471 -28.284 39.897 1.00 71.52 ? 884 ALA A CB 1 ATOM 6437 N N . GLY A 1 874 ? 29.344 -26.254 37.454 1.00 85.56 ? 885 GLY A N 1 ATOM 6438 C CA . GLY A 1 874 ? 29.969 -25.979 36.178 1.00 96.25 ? 885 GLY A CA 1 ATOM 6439 C C . GLY A 1 874 ? 31.248 -26.788 36.086 1.00 97.09 ? 885 GLY A C 1 ATOM 6440 O O . GLY A 1 874 ? 32.186 -26.568 36.854 1.00 101.82 ? 885 GLY A O 1 ATOM 6441 N N . GLY A 1 875 ? 31.282 -27.739 35.159 1.00 85.50 ? 886 GLY A N 1 ATOM 6442 C CA . GLY A 1 875 ? 32.444 -28.594 35.003 1.00 86.46 ? 886 GLY A CA 1 ATOM 6443 C C . GLY A 1 875 ? 32.118 -30.059 35.211 1.00 81.39 ? 886 GLY A C 1 ATOM 6444 O O . GLY A 1 875 ? 32.881 -30.937 34.814 1.00 86.14 ? 886 GLY A O 1 ATOM 6445 N N . ALA A 1 876 ? 30.979 -30.321 35.843 1.00 76.79 ? 887 ALA A N 1 ATOM 6446 C CA . ALA A 1 876 ? 30.498 -31.683 36.031 1.00 63.85 ? 887 ALA A CA 1 ATOM 6447 C C . ALA A 1 876 ? 30.267 -32.359 34.691 1.00 62.69 ? 887 ALA A C 1 ATOM 6448 O O . ALA A 1 876 ? 29.775 -31.736 33.749 1.00 74.67 ? 887 ALA A O 1 ATOM 6449 C CB . ALA A 1 876 ? 29.210 -31.681 36.838 1.00 58.04 ? 887 ALA A CB 1 ATOM 6450 N N . VAL A 1 877 ? 30.629 -33.633 34.606 1.00 51.73 ? 888 VAL A N 1 ATOM 6451 C CA . VAL A 1 877 ? 30.283 -34.432 33.439 1.00 56.71 ? 888 VAL A CA 1 ATOM 6452 C C . VAL A 1 877 ? 28.763 -34.489 33.307 1.00 54.33 ? 888 VAL A C 1 ATOM 6453 O O . VAL A 1 877 ? 28.065 -34.886 34.240 1.00 74.19 ? 888 VAL A O 1 ATOM 6454 C CB . VAL A 1 877 ? 30.881 -35.858 33.526 1.00 57.84 ? 888 VAL A CB 1 ATOM 6455 C CG1 . VAL A 1 877 ? 30.808 -36.382 34.943 1.00 57.03 ? 888 VAL A CG1 1 ATOM 6456 C CG2 . VAL A 1 877 ? 30.178 -36.799 32.561 1.00 65.12 ? 888 VAL A CG2 1 ATOM 6457 N N . ASN A 1 878 ? 28.261 -34.067 32.151 1.00 46.96 ? 889 ASN A N 1 ATOM 6458 C CA . ASN A 1 878 ? 26.817 -33.985 31.890 1.00 52.95 ? 889 ASN A CA 1 ATOM 6459 C C . ASN A 1 878 ? 26.061 -33.155 32.924 1.00 48.49 ? 889 ASN A C 1 ATOM 6460 O O . ASN A 1 878 ? 25.006 -33.566 33.414 1.00 52.68 ? 889 ASN A O 1 ATOM 6461 C CB . ASN A 1 878 ? 26.183 -35.374 31.756 1.00 42.64 ? 889 ASN A CB 1 ATOM 6462 C CG . ASN A 1 878 ? 26.990 -36.294 30.877 1.00 56.45 ? 889 ASN A CG 1 ATOM 6463 O OD1 . ASN A 1 878 ? 27.745 -35.841 30.019 1.00 55.51 ? 889 ASN A OD1 1 ATOM 6464 N ND2 . ASN A 1 878 ? 26.850 -37.597 31.094 1.00 65.55 ? 889 ASN A ND2 1 ATOM 6465 N N . GLN A 1 879 ? 26.616 -31.987 33.233 1.00 49.72 ? 890 GLN A N 1 ATOM 6466 C CA . GLN A 1 879 ? 26.039 -31.043 34.185 1.00 62.31 ? 890 GLN A CA 1 ATOM 6467 C C . GLN A 1 879 ? 24.540 -30.826 34.013 1.00 60.98 ? 890 GLN A C 1 ATOM 6468 O O . GLN A 1 879 ? 24.054 -30.625 32.899 1.00 59.68 ? 890 GLN A O 1 ATOM 6469 C CB . GLN A 1 879 ? 26.749 -29.694 34.072 1.00 62.98 ? 890 GLN A CB 1 ATOM 6470 C CG . GLN A 1 879 ? 26.067 -28.571 34.834 1.00 60.01 ? 890 GLN A CG 1 ATOM 6471 C CD . GLN A 1 879 ? 26.578 -27.204 34.438 1.00 66.09 ? 890 GLN A CD 1 ATOM 6472 O OE1 . GLN A 1 879 ? 27.186 -27.037 33.381 1.00 77.26 ? 890 GLN A OE1 1 ATOM 6473 N NE2 . GLN A 1 879 ? 26.334 -26.215 35.286 1.00 67.04 ? 890 GLN A NE2 1 ATOM 6474 N N . HIS A 1 880 ? 23.814 -30.864 35.127 1.00 64.92 ? 891 HIS A N 1 ATOM 6475 C CA . HIS A 1 880 ? 22.394 -30.535 35.126 1.00 68.75 ? 891 HIS A CA 1 ATOM 6476 C C . HIS A 1 880 ? 22.177 -29.027 35.081 1.00 69.94 ? 891 HIS A C 1 ATOM 6477 O O . HIS A 1 880 ? 22.801 -28.273 35.830 1.00 74.36 ? 891 HIS A O 1 ATOM 6478 C CB . HIS A 1 880 ? 21.698 -31.107 36.361 1.00 64.75 ? 891 HIS A CB 1 ATOM 6479 C CG . HIS A 1 880 ? 21.748 -32.597 36.449 1.00 60.64 ? 891 HIS A CG 1 ATOM 6480 N ND1 . HIS A 1 880 ? 21.063 -33.306 37.410 1.00 71.64 ? 891 HIS A ND1 1 ATOM 6481 C CD2 . HIS A 1 880 ? 22.404 -33.514 35.700 1.00 66.64 ? 891 HIS A CD2 1 ATOM 6482 C CE1 . HIS A 1 880 ? 21.294 -34.597 37.251 1.00 70.56 ? 891 HIS A CE1 1 ATOM 6483 N NE2 . HIS A 1 880 ? 22.105 -34.749 36.220 1.00 74.08 ? 891 HIS A NE2 1 ATOM 6484 N N . LYS A 1 881 ? 21.289 -28.598 34.190 1.00 77.05 ? 892 LYS A N 1 ATOM 6485 C CA . LYS A 1 881 ? 20.847 -27.211 34.129 1.00 74.09 ? 892 LYS A CA 1 ATOM 6486 C C . LYS A 1 881 ? 19.469 -27.164 33.476 1.00 101.09 ? 892 LYS A C 1 ATOM 6487 O O . LYS A 1 881 ? 19.164 -27.988 32.613 1.00 118.13 ? 892 LYS A O 1 ATOM 6488 C CB . LYS A 1 881 ? 21.857 -26.342 33.368 1.00 69.97 ? 892 LYS A CB 1 ATOM 6489 C CG . LYS A 1 881 ? 22.162 -26.769 31.942 1.00 73.94 ? 892 LYS A CG 1 ATOM 6490 C CD . LYS A 1 881 ? 23.439 -27.592 31.883 1.00 90.51 ? 892 LYS A CD 1 ATOM 6491 C CE . LYS A 1 881 ? 24.066 -27.571 30.492 1.00 87.59 ? 892 LYS A CE 1 ATOM 6492 N NZ . LYS A 1 881 ? 24.837 -26.321 30.233 1.00 72.42 ? 892 LYS A NZ 1 ATOM 6493 N N . ASN A 1 882 ? 18.623 -26.227 33.896 1.00 109.63 ? 893 ASN A N 1 ATOM 6494 C CA . ASN A 1 882 ? 18.941 -25.289 34.965 1.00 110.33 ? 893 ASN A CA 1 ATOM 6495 C C . ASN A 1 882 ? 18.037 -25.470 36.176 1.00 106.12 ? 893 ASN A C 1 ATOM 6496 O O . ASN A 1 882 ? 16.830 -25.230 36.114 1.00 103.73 ? 893 ASN A O 1 ATOM 6497 C CB . ASN A 1 882 ? 18.864 -23.846 34.460 1.00 113.94 ? 893 ASN A CB 1 ATOM 6498 C CG . ASN A 1 882 ? 20.199 -23.332 33.961 1.00 109.99 ? 893 ASN A CG 1 ATOM 6499 O OD1 . ASN A 1 882 ? 21.244 -23.595 34.563 1.00 106.93 ? 893 ASN A OD1 1 ATOM 6500 N ND2 . ASN A 1 882 ? 20.174 -22.592 32.857 1.00 101.10 ? 893 ASN A ND2 1 ATOM 6501 N N . VAL A 1 883 ? 18.640 -25.900 37.277 1.00 96.48 ? 894 VAL A N 1 ATOM 6502 C CA . VAL A 1 883 ? 17.925 -26.110 38.525 1.00 92.74 ? 894 VAL A CA 1 ATOM 6503 C C . VAL A 1 883 ? 17.918 -24.802 39.307 1.00 94.25 ? 894 VAL A C 1 ATOM 6504 O O . VAL A 1 883 ? 18.974 -24.221 39.556 1.00 107.28 ? 894 VAL A O 1 ATOM 6505 C CB . VAL A 1 883 ? 18.619 -27.196 39.355 1.00 103.21 ? 894 VAL A CB 1 ATOM 6506 C CG1 . VAL A 1 883 ? 17.595 -28.114 39.994 1.00 109.43 ? 894 VAL A CG1 1 ATOM 6507 C CG2 . VAL A 1 883 ? 19.571 -27.994 38.473 1.00 55.14 ? 894 VAL A CG2 1 ATOM 6508 N N . GLY A 1 884 ? 16.738 -24.339 39.705 1.00 82.73 ? 895 GLY A N 1 ATOM 6509 C CA . GLY A 1 884 ? 15.503 -25.079 39.544 1.00 72.69 ? 895 GLY A CA 1 ATOM 6510 C C . GLY A 1 884 ? 14.930 -25.363 40.920 1.00 90.19 ? 895 GLY A C 1 ATOM 6511 O O . GLY A 1 884 ? 14.523 -24.452 41.641 1.00 96.43 ? 895 GLY A O 1 ATOM 6512 N N . VAL A 1 885 ? 14.910 -26.638 41.286 1.00 83.58 ? 896 VAL A N 1 ATOM 6513 C CA . VAL A 1 885 ? 14.501 -27.064 42.615 1.00 71.47 ? 896 VAL A CA 1 ATOM 6514 C C . VAL A 1 885 ? 15.421 -28.203 43.044 1.00 72.72 ? 896 VAL A C 1 ATOM 6515 O O . VAL A 1 885 ? 15.580 -29.180 42.313 1.00 79.49 ? 896 VAL A O 1 ATOM 6516 C CB . VAL A 1 885 ? 13.037 -27.544 42.629 1.00 75.33 ? 896 VAL A CB 1 ATOM 6517 C CG1 . VAL A 1 885 ? 12.759 -28.368 43.870 1.00 81.37 ? 896 VAL A CG1 1 ATOM 6518 C CG2 . VAL A 1 885 ? 12.082 -26.362 42.545 1.00 66.16 ? 896 VAL A CG2 1 ATOM 6519 N N . TYR A 1 886 ? 16.032 -28.077 44.219 1.00 67.99 ? 897 TYR A N 1 ATOM 6520 C CA . TYR A 1 886 ? 17.050 -29.038 44.642 1.00 67.53 ? 897 TYR A CA 1 ATOM 6521 C C . TYR A 1 886 ? 16.485 -30.234 45.403 1.00 64.67 ? 897 TYR A C 1 ATOM 6522 O O . TYR A 1 886 ? 17.236 -31.067 45.904 1.00 64.63 ? 897 TYR A O 1 ATOM 6523 C CB . TYR A 1 886 ? 18.159 -28.341 45.437 1.00 64.11 ? 897 TYR A CB 1 ATOM 6524 C CG . TYR A 1 886 ? 19.095 -27.551 44.554 1.00 73.55 ? 897 TYR A CG 1 ATOM 6525 C CD1 . TYR A 1 886 ? 20.364 -28.026 44.255 1.00 66.16 ? 897 TYR A CD1 1 ATOM 6526 C CD2 . TYR A 1 886 ? 18.698 -26.342 43.993 1.00 68.22 ? 897 TYR A CD2 1 ATOM 6527 C CE1 . TYR A 1 886 ? 21.220 -27.314 43.436 1.00 66.33 ? 897 TYR A CE1 1 ATOM 6528 C CE2 . TYR A 1 886 ? 19.544 -25.624 43.167 1.00 72.44 ? 897 TYR A CE2 1 ATOM 6529 C CZ . TYR A 1 886 ? 20.804 -26.115 42.891 1.00 78.79 ? 897 TYR A CZ 1 ATOM 6530 O OH . TYR A 1 886 ? 21.655 -25.402 42.072 1.00 79.29 ? 897 TYR A OH 1 ATOM 6531 N N . ASN A 1 887 ? 15.159 -30.318 45.469 1.00 72.79 ? 898 ASN A N 1 ATOM 6532 C CA . ASN A 1 887 ? 14.481 -31.447 46.098 1.00 69.05 ? 898 ASN A CA 1 ATOM 6533 C C . ASN A 1 887 ? 14.909 -32.777 45.497 1.00 67.27 ? 898 ASN A C 1 ATOM 6534 O O . ASN A 1 887 ? 15.071 -33.769 46.207 1.00 66.99 ? 898 ASN A O 1 ATOM 6535 C CB . ASN A 1 887 ? 12.962 -31.309 45.962 1.00 75.67 ? 898 ASN A CB 1 ATOM 6536 C CG . ASN A 1 887 ? 12.361 -30.374 46.995 1.00 80.44 ? 898 ASN A CG 1 ATOM 6537 O OD1 . ASN A 1 887 ? 12.399 -29.153 46.842 1.00 77.17 ? 898 ASN A OD1 1 ATOM 6538 N ND2 . ASN A 1 887 ? 11.786 -30.948 48.049 1.00 84.30 ? 898 ASN A ND2 1 ATOM 6539 N N . ARG A 1 888 ? 15.101 -32.787 44.183 1.00 65.85 ? 899 ARG A N 1 ATOM 6540 C CA . ARG A 1 888 ? 15.359 -34.025 43.461 1.00 64.87 ? 899 ARG A CA 1 ATOM 6541 C C . ARG A 1 888 ? 16.682 -34.681 43.846 1.00 67.22 ? 899 ARG A C 1 ATOM 6542 O O . ARG A 1 888 ? 16.874 -35.872 43.617 1.00 81.72 ? 899 ARG A O 1 ATOM 6543 C CB . ARG A 1 888 ? 15.286 -33.795 41.948 1.00 63.28 ? 899 ARG A CB 1 ATOM 6544 C CG . ARG A 1 888 ? 16.341 -32.854 41.401 1.00 65.06 ? 899 ARG A CG 1 ATOM 6545 C CD . ARG A 1 888 ? 17.106 -33.514 40.268 1.00 72.11 ? 899 ARG A CD 1 ATOM 6546 N NE . ARG A 1 888 ? 16.934 -32.804 39.007 1.00 75.97 ? 899 ARG A NE 1 ATOM 6547 C CZ . ARG A 1 888 ? 17.322 -33.275 37.827 1.00 80.80 ? 899 ARG A CZ 1 ATOM 6548 N NH1 . ARG A 1 888 ? 17.125 -32.556 36.731 1.00 83.08 ? 899 ARG A NH1 1 ATOM 6549 N NH2 . ARG A 1 888 ? 17.900 -34.468 37.742 1.00 68.39 ? 899 ARG A NH2 1 ATOM 6550 N N . TYR A 1 889 ? 17.582 -33.910 44.448 1.00 66.05 ? 900 TYR A N 1 ATOM 6551 C CA . TYR A 1 889 ? 18.881 -34.439 44.855 1.00 71.69 ? 900 TYR A CA 1 ATOM 6552 C C . TYR A 1 889 ? 18.862 -35.010 46.274 1.00 70.31 ? 900 TYR A C 1 ATOM 6553 O O . TYR A 1 889 ? 19.912 -35.314 46.843 1.00 67.46 ? 900 TYR A O 1 ATOM 6554 C CB . TYR A 1 889 ? 19.967 -33.368 44.719 1.00 72.93 ? 900 TYR A CB 1 ATOM 6555 C CG . TYR A 1 889 ? 20.110 -32.833 43.311 1.00 75.81 ? 900 TYR A CG 1 ATOM 6556 C CD1 . TYR A 1 889 ? 20.832 -33.529 42.354 1.00 73.49 ? 900 TYR A CD1 1 ATOM 6557 C CD2 . TYR A 1 889 ? 19.517 -31.634 42.939 1.00 77.31 ? 900 TYR A CD2 1 ATOM 6558 C CE1 . TYR A 1 889 ? 20.962 -33.047 41.065 1.00 66.16 ? 900 TYR A CE1 1 ATOM 6559 C CE2 . TYR A 1 889 ? 19.642 -31.145 41.652 1.00 71.50 ? 900 TYR A CE2 1 ATOM 6560 C CZ . TYR A 1 889 ? 20.366 -31.857 40.720 1.00 63.57 ? 900 TYR A CZ 1 ATOM 6561 O OH . TYR A 1 889 ? 20.493 -31.377 39.438 1.00 61.77 ? 900 TYR A OH 1 ATOM 6562 N N . ALA A 1 890 ? 17.668 -35.158 46.838 1.00 60.53 ? 901 ALA A N 1 ATOM 6563 C CA . ALA A 1 890 ? 17.526 -35.705 48.182 1.00 66.63 ? 901 ALA A CA 1 ATOM 6564 C C . ALA A 1 890 ? 17.967 -37.160 48.234 1.00 69.17 ? 901 ALA A C 1 ATOM 6565 O O . ALA A 1 890 ? 17.681 -37.937 47.326 1.00 73.37 ? 901 ALA A O 1 ATOM 6566 C CB . ALA A 1 890 ? 16.097 -35.574 48.660 1.00 67.29 ? 901 ALA A CB 1 ATOM 6567 N N . ALA A 1 891 ? 18.669 -37.518 49.304 1.00 61.99 ? 902 ALA A N 1 ATOM 6568 C CA . ALA A 1 891 ? 19.123 -38.888 49.518 1.00 80.13 ? 902 ALA A CA 1 ATOM 6569 C C . ALA A 1 891 ? 17.940 -39.785 49.888 1.00 76.69 ? 902 ALA A C 1 ATOM 6570 O O . ALA A 1 891 ? 16.870 -39.286 50.237 1.00 84.00 ? 902 ALA A O 1 ATOM 6571 C CB . ALA A 1 891 ? 20.193 -38.917 50.608 1.00 63.07 ? 902 ALA A CB 1 ATOM 6572 N N . PRO A 1 892 ? 18.116 -41.114 49.804 1.00 72.28 ? 903 PRO A N 1 ATOM 6573 C CA . PRO A 1 892 ? 16.977 -41.959 50.176 1.00 72.83 ? 903 PRO A CA 1 ATOM 6574 C C . PRO A 1 892 ? 16.754 -42.009 51.686 1.00 64.40 ? 903 PRO A C 1 ATOM 6575 O O . PRO A 1 892 ? 17.712 -42.014 52.461 1.00 100.97 ? 903 PRO A O 1 ATOM 6576 C CB . PRO A 1 892 ? 17.383 -43.341 49.656 1.00 73.79 ? 903 PRO A CB 1 ATOM 6577 C CG . PRO A 1 892 ? 18.871 -43.318 49.628 1.00 59.63 ? 903 PRO A CG 1 ATOM 6578 C CD . PRO A 1 892 ? 19.266 -41.905 49.324 1.00 59.56 ? 903 PRO A CD 1 ATOM 6579 N N . GLY A 1 893 ? 15.490 -42.041 52.094 1.00 65.59 ? 904 GLY A N 1 ATOM 6580 C CA . GLY A 1 893 ? 15.144 -42.254 53.487 1.00 68.21 ? 904 GLY A CA 1 ATOM 6581 C C . GLY A 1 893 ? 15.358 -43.699 53.909 1.00 72.54 ? 904 GLY A C 1 ATOM 6582 O O . GLY A 1 893 ? 16.241 -44.382 53.388 1.00 69.43 ? 904 GLY A O 1 ATOM 6583 N N . ARG A 1 894 ? 14.552 -44.174 54.852 1.00 72.98 ? 905 ARG A N 1 ATOM 6584 C CA . ARG A 1 894 ? 14.682 -45.549 55.327 1.00 70.94 ? 905 ARG A CA 1 ATOM 6585 C C . ARG A 1 894 ? 14.471 -46.543 54.187 1.00 77.43 ? 905 ARG A C 1 ATOM 6586 O O . ARG A 1 894 ? 13.471 -46.480 53.471 1.00 75.22 ? 905 ARG A O 1 ATOM 6587 C CB . ARG A 1 894 ? 13.714 -45.832 56.484 1.00 73.59 ? 905 ARG A CB 1 ATOM 6588 C CG . ARG A 1 894 ? 13.648 -47.303 56.886 1.00 74.20 ? 905 ARG A CG 1 ATOM 6589 C CD . ARG A 1 894 ? 12.996 -47.509 58.250 1.00 80.25 ? 905 ARG A CD 1 ATOM 6590 N NE . ARG A 1 894 ? 11.700 -46.845 58.361 1.00 93.61 ? 905 ARG A NE 1 ATOM 6591 C CZ . ARG A 1 894 ? 11.439 -45.852 59.205 1.00 97.84 ? 905 ARG A CZ 1 ATOM 6592 N NH1 . ARG A 1 894 ? 12.384 -45.410 60.023 1.00 93.26 ? 905 ARG A NH1 1 ATOM 6593 N NH2 . ARG A 1 894 ? 10.232 -45.304 59.235 1.00 97.01 ? 905 ARG A NH2 1 ATOM 6594 N N . ASN A 1 895 ? 15.430 -47.447 54.017 1.00 74.94 ? 906 ASN A N 1 ATOM 6595 C CA . ASN A 1 895 ? 15.365 -48.446 52.956 1.00 80.48 ? 906 ASN A CA 1 ATOM 6596 C C . ASN A 1 895 ? 15.931 -49.797 53.401 1.00 81.30 ? 906 ASN A C 1 ATOM 6597 O O . ASN A 1 895 ? 16.789 -49.859 54.280 1.00 81.41 ? 906 ASN A O 1 ATOM 6598 C CB . ASN A 1 895 ? 16.070 -47.934 51.691 1.00 68.53 ? 906 ASN A CB 1 ATOM 6599 C CG . ASN A 1 895 ? 17.507 -47.491 51.951 1.00 69.25 ? 906 ASN A CG 1 ATOM 6600 O OD1 . ASN A 1 895 ? 18.452 -48.243 51.718 1.00 62.37 ? 906 ASN A OD1 1 ATOM 6601 N ND2 . ASN A 1 895 ? 17.673 -46.263 52.429 1.00 64.20 ? 906 ASN A ND2 1 ATOM 6602 N N . TYR A 1 896 ? 15.449 -50.877 52.793 1.00 78.16 ? 907 TYR A N 1 ATOM 6603 C CA . TYR A 1 896 ? 15.846 -52.221 53.199 1.00 79.75 ? 907 TYR A CA 1 ATOM 6604 C C . TYR A 1 896 ? 16.536 -52.981 52.072 1.00 73.60 ? 907 TYR A C 1 ATOM 6605 O O . TYR A 1 896 ? 16.171 -52.843 50.906 1.00 79.13 ? 907 TYR A O 1 ATOM 6606 C CB . TYR A 1 896 ? 14.621 -53.018 53.657 1.00 91.78 ? 907 TYR A CB 1 ATOM 6607 C CG . TYR A 1 896 ? 13.809 -52.357 54.749 1.00 69.72 ? 907 TYR A CG 1 ATOM 6608 C CD1 . TYR A 1 896 ? 14.000 -52.694 56.083 1.00 72.38 ? 907 TYR A CD1 1 ATOM 6609 C CD2 . TYR A 1 896 ? 12.845 -51.409 54.445 1.00 69.49 ? 907 TYR A CD2 1 ATOM 6610 C CE1 . TYR A 1 896 ? 13.255 -52.099 57.085 1.00 84.32 ? 907 TYR A CE1 1 ATOM 6611 C CE2 . TYR A 1 896 ? 12.099 -50.805 55.436 1.00 73.92 ? 907 TYR A CE2 1 ATOM 6612 C CZ . TYR A 1 896 ? 12.307 -51.154 56.758 1.00 83.82 ? 907 TYR A CZ 1 ATOM 6613 O OH . TYR A 1 896 ? 11.566 -50.556 57.756 1.00 76.81 ? 907 TYR A OH 1 ATOM 6614 N N . THR A 1 897 ? 17.536 -53.785 52.424 1.00 71.32 ? 908 THR A N 1 ATOM 6615 C CA . THR A 1 897 ? 18.140 -54.720 51.473 1.00 68.06 ? 908 THR A CA 1 ATOM 6616 C C . THR A 1 897 ? 18.235 -56.131 52.070 1.00 77.15 ? 908 THR A C 1 ATOM 6617 O O . THR A 1 897 ? 18.472 -56.295 53.268 1.00 68.53 ? 908 THR A O 1 ATOM 6618 C CB . THR A 1 897 ? 19.539 -54.265 51.000 1.00 73.75 ? 908 THR A CB 1 ATOM 6619 O OG1 . THR A 1 897 ? 20.446 -54.259 52.110 1.00 90.73 ? 908 THR A OG1 1 ATOM 6620 C CG2 . THR A 1 897 ? 19.484 -52.871 50.378 1.00 59.66 ? 908 THR A CG2 1 ATOM 6621 N N . PHE A 1 898 ? 18.048 -57.144 51.229 1.00 71.99 ? 909 PHE A N 1 ATOM 6622 C CA . PHE A 1 898 ? 18.057 -58.531 51.680 1.00 75.84 ? 909 PHE A CA 1 ATOM 6623 C C . PHE A 1 898 ? 18.892 -59.397 50.745 1.00 80.94 ? 909 PHE A C 1 ATOM 6624 O O . PHE A 1 898 ? 18.706 -59.359 49.534 1.00 89.66 ? 909 PHE A O 1 ATOM 6625 C CB . PHE A 1 898 ? 16.629 -59.080 51.736 1.00 82.98 ? 909 PHE A CB 1 ATOM 6626 C CG . PHE A 1 898 ? 15.696 -58.271 52.595 1.00 87.86 ? 909 PHE A CG 1 ATOM 6627 C CD1 . PHE A 1 898 ? 15.651 -58.465 53.968 1.00 92.89 ? 909 PHE A CD1 1 ATOM 6628 C CD2 . PHE A 1 898 ? 14.854 -57.326 52.028 1.00 76.45 ? 909 PHE A CD2 1 ATOM 6629 C CE1 . PHE A 1 898 ? 14.791 -57.726 54.761 1.00 89.66 ? 909 PHE A CE1 1 ATOM 6630 C CE2 . PHE A 1 898 ? 13.993 -56.583 52.814 1.00 76.44 ? 909 PHE A CE2 1 ATOM 6631 C CZ . PHE A 1 898 ? 13.961 -56.783 54.184 1.00 81.04 ? 909 PHE A CZ 1 ATOM 6632 N N . SER A 1 899 ? 19.804 -60.184 51.307 1.00 79.01 ? 910 SER A N 1 ATOM 6633 C CA . SER A 1 899 ? 20.667 -61.042 50.501 1.00 72.97 ? 910 SER A CA 1 ATOM 6634 C C . SER A 1 899 ? 20.601 -62.499 50.946 1.00 82.79 ? 910 SER A C 1 ATOM 6635 O O . SER A 1 899 ? 20.666 -62.797 52.140 1.00 83.24 ? 910 SER A O 1 ATOM 6636 C CB . SER A 1 899 ? 22.117 -60.558 50.567 1.00 72.36 ? 910 SER A CB 1 ATOM 6637 O OG . SER A 1 899 ? 22.256 -59.268 50.003 1.00 78.12 ? 910 SER A OG 1 ATOM 6638 N N . LEU A 1 900 ? 20.482 -63.400 49.976 1.00 77.50 ? 911 LEU A N 1 ATOM 6639 C CA . LEU A 1 900 ? 20.488 -64.833 50.247 1.00 72.34 ? 911 LEU A CA 1 ATOM 6640 C C . LEU A 1 900 ? 21.668 -65.527 49.575 1.00 72.62 ? 911 LEU A C 1 ATOM 6641 O O . LEU A 1 900 ? 21.699 -65.662 48.352 1.00 76.13 ? 911 LEU A O 1 ATOM 6642 C CB . LEU A 1 900 ? 19.181 -65.475 49.781 1.00 76.57 ? 911 LEU A CB 1 ATOM 6643 C CG . LEU A 1 900 ? 18.313 -66.072 50.891 1.00 92.38 ? 911 LEU A CG 1 ATOM 6644 C CD1 . LEU A 1 900 ? 17.130 -66.832 50.308 1.00 94.93 ? 911 LEU A CD1 1 ATOM 6645 C CD2 . LEU A 1 900 ? 19.142 -66.965 51.805 1.00 91.37 ? 911 LEU A CD2 1 ATOM 6646 N N . GLU A 1 901 ? 22.632 -65.972 50.378 1.00 75.25 ? 912 GLU A N 1 ATOM 6647 C CA . GLU A 1 901 ? 23.812 -66.660 49.860 1.00 71.67 ? 912 GLU A CA 1 ATOM 6648 C C . GLU A 1 901 ? 23.738 -68.169 50.109 1.00 74.11 ? 912 GLU A C 1 ATOM 6649 O O . GLU A 1 901 ? 23.501 -68.604 51.230 1.00 80.22 ? 912 GLU A O 1 ATOM 6650 C CB . GLU A 1 901 ? 25.084 -66.085 50.490 1.00 77.93 ? 912 GLU A CB 1 ATOM 6651 C CG . GLU A 1 901 ? 25.288 -64.593 50.244 1.00 79.07 ? 912 GLU A CG 1 ATOM 6652 C CD . GLU A 1 901 ? 26.433 -64.004 51.061 1.00 88.29 ? 912 GLU A CD 1 ATOM 6653 O OE1 . GLU A 1 901 ? 27.338 -64.762 51.474 1.00 86.09 ? 912 GLU A OE1 1 ATOM 6654 O OE2 . GLU A 1 901 ? 26.423 -62.777 51.295 1.00 92.72 ? 912 GLU A OE2 1 ATOM 6655 N N . TYR A 1 902 ? 23.927 -68.961 49.056 1.00 78.86 ? 913 TYR A N 1 ATOM 6656 C CA . TYR A 1 902 ? 23.958 -70.418 49.180 1.00 79.09 ? 913 TYR A CA 1 ATOM 6657 C C . TYR A 1 902 ? 25.330 -70.942 48.778 1.00 77.54 ? 913 TYR A C 1 ATOM 6658 O O . TYR A 1 902 ? 25.867 -70.542 47.746 1.00 76.93 ? 913 TYR A O 1 ATOM 6659 C CB . TYR A 1 902 ? 22.944 -71.089 48.245 1.00 83.91 ? 913 TYR A CB 1 ATOM 6660 C CG . TYR A 1 902 ? 21.475 -70.826 48.496 1.00 91.72 ? 913 TYR A CG 1 ATOM 6661 C CD1 . TYR A 1 902 ? 20.510 -71.534 47.794 1.00 96.45 ? 913 TYR A CD1 1 ATOM 6662 C CD2 . TYR A 1 902 ? 21.050 -69.872 49.409 1.00 109.09 ? 913 TYR A CD2 1 ATOM 6663 C CE1 . TYR A 1 902 ? 19.166 -71.312 47.998 1.00 112.28 ? 913 TYR A CE1 1 ATOM 6664 C CE2 . TYR A 1 902 ? 19.704 -69.638 49.618 1.00 129.51 ? 913 TYR A CE2 1 ATOM 6665 C CZ . TYR A 1 902 ? 18.766 -70.363 48.910 1.00 133.88 ? 913 TYR A CZ 1 ATOM 6666 O OH . TYR A 1 902 ? 17.422 -70.140 49.114 1.00 146.89 ? 913 TYR A OH 1 ATOM 6667 N N . LYS A 1 903 ? 25.892 -71.843 49.578 1.00 75.13 ? 914 LYS A N 1 ATOM 6668 C CA . LYS A 1 903 ? 27.026 -72.640 49.123 1.00 78.12 ? 914 LYS A CA 1 ATOM 6669 C C . LYS A 1 903 ? 26.557 -74.069 48.894 1.00 97.19 ? 914 LYS A C 1 ATOM 6670 O O . LYS A 1 903 ? 25.651 -74.546 49.575 1.00 108.55 ? 914 LYS A O 1 ATOM 6671 C CB . LYS A 1 903 ? 28.171 -72.637 50.136 1.00 85.60 ? 914 LYS A CB 1 ATOM 6672 C CG . LYS A 1 903 ? 28.940 -71.333 50.245 1.00 93.80 ? 914 LYS A CG 1 ATOM 6673 C CD . LYS A 1 903 ? 30.378 -71.590 50.691 1.00 98.78 ? 914 LYS A CD 1 ATOM 6674 C CE . LYS A 1 903 ? 30.440 -72.548 51.878 1.00 100.43 ? 914 LYS A CE 1 ATOM 6675 N NZ . LYS A 1 903 ? 31.840 -72.909 52.247 1.00 96.73 ? 914 LYS A NZ 1 ATOM 6676 N N . PHE A 1 904 ? 27.174 -74.749 47.936 1.00 103.00 ? 915 PHE A N 1 ATOM 6677 C CA . PHE A 1 904 ? 26.836 -76.138 47.645 1.00 106.38 ? 915 PHE A CA 1 ATOM 6678 C C . PHE A 1 904 ? 28.061 -76.899 47.151 1.00 101.68 ? 915 PHE A C 1 ATOM 6679 O O . PHE A 1 904 ? 29.196 -76.468 47.359 1.00 98.97 ? 915 PHE A O 1 ATOM 6680 C CB . PHE A 1 904 ? 25.706 -76.219 46.612 1.00 104.26 ? 915 PHE A CB 1 ATOM 6681 C CG . PHE A 1 904 ? 24.327 -76.245 47.212 1.00 110.83 ? 915 PHE A CG 1 ATOM 6682 C CD1 . PHE A 1 904 ? 24.089 -76.893 48.415 1.00 118.80 ? 915 PHE A CD1 1 ATOM 6683 C CD2 . PHE A 1 904 ? 23.266 -75.626 46.568 1.00 110.68 ? 915 PHE A CD2 1 ATOM 6684 C CE1 . PHE A 1 904 ? 22.819 -76.920 48.969 1.00 115.94 ? 915 PHE A CE1 1 ATOM 6685 C CE2 . PHE A 1 904 ? 21.994 -75.650 47.115 1.00 113.42 ? 915 PHE A CE2 1 ATOM 6686 C CZ . PHE A 1 904 ? 21.771 -76.298 48.318 1.00 112.34 ? 915 PHE A CZ 1 ATOM 6687 N N . LYS B 2 23 ? 35.623 38.084 0.569 1.00 161.08 ? 4 LYS B N 1 ATOM 6688 C CA . LYS B 2 23 ? 35.864 36.666 0.322 1.00 156.29 ? 4 LYS B CA 1 ATOM 6689 C C . LYS B 2 23 ? 36.738 36.469 -0.913 1.00 165.36 ? 4 LYS B C 1 ATOM 6690 O O . LYS B 2 23 ? 36.233 36.247 -2.014 1.00 168.36 ? 4 LYS B O 1 ATOM 6691 C CB . LYS B 2 23 ? 34.539 35.919 0.153 1.00 143.37 ? 4 LYS B CB 1 ATOM 6692 N N . THR B 2 24 ? 38.051 36.552 -0.723 1.00 164.72 ? 5 THR B N 1 ATOM 6693 C CA . THR B 2 24 ? 38.992 36.421 -1.831 1.00 150.71 ? 5 THR B CA 1 ATOM 6694 C C . THR B 2 24 ? 39.667 35.051 -1.844 1.00 142.21 ? 5 THR B C 1 ATOM 6695 O O . THR B 2 24 ? 40.056 34.528 -0.798 1.00 135.00 ? 5 THR B O 1 ATOM 6696 C CB . THR B 2 24 ? 40.057 37.543 -1.812 1.00 138.20 ? 5 THR B CB 1 ATOM 6697 O OG1 . THR B 2 24 ? 40.720 37.560 -0.542 1.00 130.64 ? 5 THR B OG1 1 ATOM 6698 C CG2 . THR B 2 24 ? 39.406 38.898 -2.048 1.00 135.61 ? 5 THR B CG2 1 ATOM 6699 N N . VAL B 2 25 ? 39.798 34.468 -3.031 1.00 143.73 ? 6 VAL B N 1 ATOM 6700 C CA . VAL B 2 25 ? 40.387 33.136 -3.152 1.00 140.42 ? 6 VAL B CA 1 ATOM 6701 C C . VAL B 2 25 ? 41.785 33.169 -3.774 1.00 139.19 ? 6 VAL B C 1 ATOM 6702 O O . VAL B 2 25 ? 41.939 33.322 -4.986 1.00 133.05 ? 6 VAL B O 1 ATOM 6703 C CB . VAL B 2 25 ? 39.466 32.169 -3.928 1.00 127.28 ? 6 VAL B CB 1 ATOM 6704 C CG1 . VAL B 2 25 ? 40.174 30.844 -4.174 1.00 115.76 ? 6 VAL B CG1 1 ATOM 6705 C CG2 . VAL B 2 25 ? 38.171 31.956 -3.156 1.00 124.00 ? 6 VAL B CG2 1 ATOM 6706 N N . ARG B 2 26 ? 42.803 33.037 -2.930 1.00 137.51 ? 7 ARG B N 1 ATOM 6707 C CA . ARG B 2 26 ? 44.187 33.086 -3.392 1.00 128.87 ? 7 ARG B CA 1 ATOM 6708 C C . ARG B 2 26 ? 44.693 31.703 -3.808 1.00 123.01 ? 7 ARG B C 1 ATOM 6709 O O . ARG B 2 26 ? 44.577 30.747 -3.051 1.00 107.14 ? 7 ARG B O 1 ATOM 6710 C CB . ARG B 2 26 ? 45.093 33.666 -2.297 1.00 120.96 ? 7 ARG B CB 1 ATOM 6711 N N . TRP B 2 27 ? 45.262 31.583 -5.003 1.00 128.77 ? 8 TRP B N 1 ATOM 6712 C CA . TRP B 2 27 ? 45.883 30.314 -5.378 1.00 127.42 ? 8 TRP B CA 1 ATOM 6713 C C . TRP B 2 27 ? 47.339 30.238 -4.858 1.00 135.96 ? 8 TRP B C 1 ATOM 6714 O O . TRP B 2 27 ? 47.628 30.711 -3.759 1.00 140.56 ? 8 TRP B O 1 ATOM 6715 C CB . TRP B 2 27 ? 45.768 30.039 -6.895 1.00 130.98 ? 8 TRP B CB 1 ATOM 6716 C CG . TRP B 2 27 ? 45.818 28.530 -7.224 1.00 134.22 ? 8 TRP B CG 1 ATOM 6717 C CD1 . TRP B 2 27 ? 46.942 27.721 -7.249 1.00 143.66 ? 8 TRP B CD1 1 ATOM 6718 C CD2 . TRP B 2 27 ? 44.695 27.659 -7.520 1.00 129.16 ? 8 TRP B CD2 1 ATOM 6719 N NE1 . TRP B 2 27 ? 46.581 26.394 -7.544 1.00 146.80 ? 8 TRP B NE1 1 ATOM 6720 C CE2 . TRP B 2 27 ? 45.215 26.341 -7.722 1.00 136.22 ? 8 TRP B CE2 1 ATOM 6721 C CE3 . TRP B 2 27 ? 43.310 27.865 -7.638 1.00 116.23 ? 8 TRP B CE3 1 ATOM 6722 C CZ2 . TRP B 2 27 ? 44.394 25.246 -8.042 1.00 126.94 ? 8 TRP B CZ2 1 ATOM 6723 C CZ3 . TRP B 2 27 ? 42.486 26.771 -7.957 1.00 107.21 ? 8 TRP B CZ3 1 ATOM 6724 C CH2 . TRP B 2 27 ? 43.036 25.478 -8.157 1.00 115.11 ? 8 TRP B CH2 1 ATOM 6725 N N . CYS B 2 28 ? 48.242 29.670 -5.655 1.00 140.14 ? 9 CYS B N 1 ATOM 6726 C CA . CYS B 2 28 ? 49.625 29.369 -5.265 1.00 137.00 ? 9 CYS B CA 1 ATOM 6727 C C . CYS B 2 28 ? 50.242 28.577 -6.392 1.00 122.21 ? 9 CYS B C 1 ATOM 6728 O O . CYS B 2 28 ? 49.664 27.602 -6.852 1.00 102.01 ? 9 CYS B O 1 ATOM 6729 C CB . CYS B 2 28 ? 49.691 28.509 -4.001 1.00 135.13 ? 9 CYS B CB 1 ATOM 6730 S SG . CYS B 2 28 ? 51.167 27.473 -3.869 1.00 161.72 ? 9 CYS B SG 1 ATOM 6731 N N . ALA B 2 29 ? 51.429 28.972 -6.824 1.00 124.54 ? 10 ALA B N 1 ATOM 6732 C CA . ALA B 2 29 ? 52.071 28.280 -7.929 1.00 120.71 ? 10 ALA B CA 1 ATOM 6733 C C . ALA B 2 29 ? 53.541 27.999 -7.635 1.00 118.96 ? 10 ALA B C 1 ATOM 6734 O O . ALA B 2 29 ? 54.230 28.815 -7.026 1.00 109.83 ? 10 ALA B O 1 ATOM 6735 C CB . ALA B 2 29 ? 51.921 29.090 -9.197 1.00 122.53 ? 10 ALA B CB 1 ATOM 6736 N N . VAL B 2 30 ? 54.025 26.843 -8.073 1.00 125.66 ? 11 VAL B N 1 ATOM 6737 C CA . VAL B 2 30 ? 55.394 26.458 -7.755 1.00 134.06 ? 11 VAL B CA 1 ATOM 6738 C C . VAL B 2 30 ? 56.408 27.131 -8.678 1.00 141.32 ? 11 VAL B C 1 ATOM 6739 O O . VAL B 2 30 ? 57.226 27.932 -8.228 1.00 142.70 ? 11 VAL B O 1 ATOM 6740 C CB . VAL B 2 30 ? 55.574 24.924 -7.730 1.00 127.65 ? 11 VAL B CB 1 ATOM 6741 C CG1 . VAL B 2 30 ? 55.239 24.384 -6.349 1.00 122.23 ? 11 VAL B CG1 1 ATOM 6742 C CG2 . VAL B 2 30 ? 54.707 24.263 -8.791 1.00 126.57 ? 11 VAL B CG2 1 ATOM 6743 N N . SER B 2 31 ? 56.340 26.822 -9.967 1.00 146.08 ? 12 SER B N 1 ATOM 6744 C CA . SER B 2 31 ? 57.287 27.383 -10.922 1.00 152.12 ? 12 SER B CA 1 ATOM 6745 C C . SER B 2 31 ? 56.921 28.815 -11.302 1.00 158.30 ? 12 SER B C 1 ATOM 6746 O O . SER B 2 31 ? 55.761 29.220 -11.208 1.00 157.26 ? 12 SER B O 1 ATOM 6747 C CB . SER B 2 31 ? 57.387 26.503 -12.173 1.00 149.79 ? 12 SER B CB 1 ATOM 6748 O OG . SER B 2 31 ? 56.181 26.513 -12.916 1.00 146.41 ? 12 SER B OG 1 ATOM 6749 N N . GLU B 2 32 ? 57.922 29.577 -11.731 1.00 160.93 ? 13 GLU B N 1 ATOM 6750 C CA . GLU B 2 32 ? 57.712 30.960 -12.137 1.00 161.67 ? 13 GLU B CA 1 ATOM 6751 C C . GLU B 2 32 ? 56.954 31.029 -13.459 1.00 164.02 ? 13 GLU B C 1 ATOM 6752 O O . GLU B 2 32 ? 56.443 32.082 -13.840 1.00 166.40 ? 13 GLU B O 1 ATOM 6753 C CB . GLU B 2 32 ? 59.050 31.694 -12.252 1.00 161.75 ? 13 GLU B CB 1 ATOM 6754 N N . HIS B 2 33 ? 56.884 29.898 -14.153 1.00 164.79 ? 14 HIS B N 1 ATOM 6755 C CA . HIS B 2 33 ? 56.183 29.820 -15.429 1.00 171.21 ? 14 HIS B CA 1 ATOM 6756 C C . HIS B 2 33 ? 54.670 29.835 -15.242 1.00 171.72 ? 14 HIS B C 1 ATOM 6757 O O . HIS B 2 33 ? 53.952 30.495 -15.993 1.00 178.89 ? 14 HIS B O 1 ATOM 6758 C CB . HIS B 2 33 ? 56.607 28.569 -16.199 1.00 172.56 ? 14 HIS B CB 1 ATOM 6759 C CG . HIS B 2 33 ? 58.054 28.557 -16.580 1.00 181.10 ? 14 HIS B CG 1 ATOM 6760 N ND1 . HIS B 2 33 ? 58.486 28.775 -17.871 1.00 187.32 ? 14 HIS B ND1 1 ATOM 6761 C CD2 . HIS B 2 33 ? 59.170 28.361 -15.838 1.00 184.00 ? 14 HIS B CD2 1 ATOM 6762 C CE1 . HIS B 2 33 ? 59.805 28.710 -17.908 1.00 190.25 ? 14 HIS B CE1 1 ATOM 6763 N NE2 . HIS B 2 33 ? 60.244 28.460 -16.688 1.00 188.63 ? 14 HIS B NE2 1 ATOM 6764 N N . GLU B 2 34 ? 54.186 29.108 -14.239 1.00 163.54 ? 15 GLU B N 1 ATOM 6765 C CA . GLU B 2 34 ? 52.749 29.048 -13.985 1.00 156.36 ? 15 GLU B CA 1 ATOM 6766 C C . GLU B 2 34 ? 52.249 30.260 -13.200 1.00 138.60 ? 15 GLU B C 1 ATOM 6767 O O . GLU B 2 34 ? 51.046 30.427 -12.999 1.00 124.52 ? 15 GLU B O 1 ATOM 6768 C CB . GLU B 2 34 ? 52.351 27.732 -13.299 1.00 160.35 ? 15 GLU B CB 1 ATOM 6769 C CG . GLU B 2 34 ? 53.086 27.423 -12.007 1.00 159.90 ? 15 GLU B CG 1 ATOM 6770 C CD . GLU B 2 34 ? 52.578 26.154 -11.336 1.00 153.51 ? 15 GLU B CD 1 ATOM 6771 O OE1 . GLU B 2 34 ? 51.581 26.226 -10.585 1.00 151.03 ? 15 GLU B OE1 1 ATOM 6772 O OE2 . GLU B 2 34 ? 53.176 25.082 -11.566 1.00 146.76 ? 15 GLU B OE2 1 ATOM 6773 N N . ALA B 2 35 ? 53.178 31.105 -12.764 1.00 138.60 ? 16 ALA B N 1 ATOM 6774 C CA . ALA B 2 35 ? 52.818 32.373 -12.141 1.00 141.63 ? 16 ALA B CA 1 ATOM 6775 C C . ALA B 2 35 ? 52.183 33.284 -13.187 1.00 142.44 ? 16 ALA B C 1 ATOM 6776 O O . ALA B 2 35 ? 51.223 34.003 -12.905 1.00 137.75 ? 16 ALA B O 1 ATOM 6777 C CB . ALA B 2 35 ? 54.042 33.033 -11.530 1.00 143.63 ? 16 ALA B CB 1 ATOM 6778 N N . THR B 2 36 ? 52.726 33.241 -14.399 1.00 143.82 ? 17 THR B N 1 ATOM 6779 C CA . THR B 2 36 ? 52.164 33.982 -15.519 1.00 141.39 ? 17 THR B CA 1 ATOM 6780 C C . THR B 2 36 ? 50.916 33.274 -16.040 1.00 142.69 ? 17 THR B C 1 ATOM 6781 O O . THR B 2 36 ? 50.011 33.910 -16.581 1.00 148.48 ? 17 THR B O 1 ATOM 6782 C CB . THR B 2 36 ? 53.183 34.138 -16.665 1.00 131.91 ? 17 THR B CB 1 ATOM 6783 N N . LYS B 2 37 ? 50.875 31.955 -15.872 1.00 133.38 ? 18 LYS B N 1 ATOM 6784 C CA . LYS B 2 37 ? 49.717 31.164 -16.277 1.00 134.06 ? 18 LYS B CA 1 ATOM 6785 C C . LYS B 2 37 ? 48.543 31.435 -15.344 1.00 132.23 ? 18 LYS B C 1 ATOM 6786 O O . LYS B 2 37 ? 47.382 31.286 -15.725 1.00 128.53 ? 18 LYS B O 1 ATOM 6787 C CB . LYS B 2 37 ? 50.057 29.672 -16.282 1.00 104.38 ? 18 LYS B CB 1 ATOM 6788 N N . CYS B 2 38 ? 48.859 31.847 -14.121 1.00 136.26 ? 19 CYS B N 1 ATOM 6789 C CA . CYS B 2 38 ? 47.847 32.155 -13.118 1.00 138.66 ? 19 CYS B CA 1 ATOM 6790 C C . CYS B 2 38 ? 47.160 33.491 -13.409 1.00 149.93 ? 19 CYS B C 1 ATOM 6791 O O . CYS B 2 38 ? 46.190 33.851 -12.746 1.00 148.35 ? 19 CYS B O 1 ATOM 6792 C CB . CYS B 2 38 ? 48.477 32.169 -11.721 1.00 140.81 ? 19 CYS B CB 1 ATOM 6793 S SG . CYS B 2 38 ? 47.308 32.268 -10.339 1.00 173.93 ? 19 CYS B SG 1 ATOM 6794 N N . GLN B 2 39 ? 47.677 34.225 -14.392 1.00 160.69 ? 20 GLN B N 1 ATOM 6795 C CA . GLN B 2 39 ? 47.066 35.478 -14.834 1.00 157.57 ? 20 GLN B CA 1 ATOM 6796 C C . GLN B 2 39 ? 46.530 35.326 -16.263 1.00 156.13 ? 20 GLN B C 1 ATOM 6797 O O . GLN B 2 39 ? 47.304 35.039 -17.180 1.00 121.59 ? 20 GLN B O 1 ATOM 6798 C CB . GLN B 2 39 ? 48.067 36.633 -14.747 1.00 123.52 ? 20 GLN B CB 1 ATOM 6799 N N . SER B 2 40 ? 45.223 35.501 -16.475 1.00 151.23 ? 21 SER B N 1 ATOM 6800 C CA . SER B 2 40 ? 44.233 35.885 -15.461 1.00 153.99 ? 21 SER B CA 1 ATOM 6801 C C . SER B 2 40 ? 44.022 34.840 -14.361 1.00 152.26 ? 21 SER B C 1 ATOM 6802 O O . SER B 2 40 ? 44.062 33.645 -14.658 1.00 111.50 ? 21 SER B O 1 ATOM 6803 C CB . SER B 2 40 ? 42.892 36.131 -16.143 1.00 149.40 ? 21 SER B CB 1 ATOM 6804 N N . PHE B 2 41 ? 43.805 35.243 -13.100 1.00 154.00 ? 22 PHE B N 1 ATOM 6805 C CA . PHE B 2 41 ? 43.686 36.632 -12.594 1.00 154.40 ? 22 PHE B CA 1 ATOM 6806 C C . PHE B 2 41 ? 42.515 37.468 -13.129 1.00 153.76 ? 22 PHE B C 1 ATOM 6807 O O . PHE B 2 41 ? 41.378 36.997 -13.179 1.00 145.45 ? 22 PHE B O 1 ATOM 6808 C CB . PHE B 2 41 ? 45.015 37.414 -12.643 1.00 153.34 ? 22 PHE B CB 1 ATOM 6809 N N . ARG B 2 42 ? 42.799 38.707 -13.517 1.00 166.44 ? 23 ARG B N 1 ATOM 6810 C CA . ARG B 2 42 ? 41.748 39.636 -13.923 1.00 183.61 ? 23 ARG B CA 1 ATOM 6811 C C . ARG B 2 42 ? 41.755 39.926 -15.421 1.00 203.99 ? 23 ARG B C 1 ATOM 6812 O O . ARG B 2 42 ? 40.982 40.753 -15.903 1.00 211.55 ? 23 ARG B O 1 ATOM 6813 C CB . ARG B 2 42 ? 41.857 40.946 -13.138 1.00 180.57 ? 23 ARG B CB 1 ATOM 6814 N N . ASP B 2 43 ? 42.633 39.248 -16.153 1.00 209.45 ? 24 ASP B N 1 ATOM 6815 C CA . ASP B 2 43 ? 42.698 39.397 -17.603 1.00 214.11 ? 24 ASP B CA 1 ATOM 6816 C C . ASP B 2 43 ? 41.545 38.658 -18.281 1.00 207.15 ? 24 ASP B C 1 ATOM 6817 O O . ASP B 2 43 ? 40.426 39.168 -18.353 1.00 213.83 ? 24 ASP B O 1 ATOM 6818 C CB . ASP B 2 43 ? 44.040 38.889 -18.137 1.00 213.69 ? 24 ASP B CB 1 ATOM 6819 N N . HIS B 2 44 ? 41.821 37.453 -18.771 1.00 185.53 ? 25 HIS B N 1 ATOM 6820 C CA . HIS B 2 44 ? 40.809 36.644 -19.441 1.00 163.86 ? 25 HIS B CA 1 ATOM 6821 C C . HIS B 2 44 ? 39.928 35.878 -18.453 1.00 150.32 ? 25 HIS B C 1 ATOM 6822 O O . HIS B 2 44 ? 39.491 34.763 -18.738 1.00 146.21 ? 25 HIS B O 1 ATOM 6823 C CB . HIS B 2 44 ? 41.467 35.677 -20.428 1.00 129.09 ? 25 HIS B CB 1 ATOM 6824 N N . MET B 2 45 ? 39.667 36.479 -17.294 1.00 144.16 ? 26 MET B N 1 ATOM 6825 C CA . MET B 2 45 ? 38.790 35.870 -16.296 1.00 141.04 ? 26 MET B CA 1 ATOM 6826 C C . MET B 2 45 ? 37.828 36.887 -15.686 1.00 137.49 ? 26 MET B C 1 ATOM 6827 O O . MET B 2 45 ? 36.900 36.520 -14.963 1.00 130.48 ? 26 MET B O 1 ATOM 6828 C CB . MET B 2 45 ? 39.603 35.189 -15.192 1.00 135.44 ? 26 MET B CB 1 ATOM 6829 N N . LYS B 2 46 ? 38.050 38.164 -15.980 1.00 143.42 ? 27 LYS B N 1 ATOM 6830 C CA . LYS B 2 46 ? 37.162 39.218 -15.501 1.00 149.16 ? 27 LYS B CA 1 ATOM 6831 C C . LYS B 2 46 ? 35.819 39.174 -16.226 1.00 158.78 ? 27 LYS B C 1 ATOM 6832 O O . LYS B 2 46 ? 35.479 40.088 -16.980 1.00 147.79 ? 27 LYS B O 1 ATOM 6833 C CB . LYS B 2 46 ? 37.809 40.594 -15.675 1.00 137.64 ? 27 LYS B CB 1 ATOM 6834 N N . SER B 2 47 ? 35.060 38.106 -15.994 1.00 167.33 ? 28 SER B N 1 ATOM 6835 C CA . SER B 2 47 ? 33.752 37.938 -16.617 1.00 172.00 ? 28 SER B CA 1 ATOM 6836 C C . SER B 2 47 ? 32.653 37.765 -15.573 1.00 178.49 ? 28 SER B C 1 ATOM 6837 O O . SER B 2 47 ? 32.654 36.796 -14.811 1.00 169.92 ? 28 SER B O 1 ATOM 6838 C CB . SER B 2 47 ? 33.760 36.748 -17.580 1.00 161.07 ? 28 SER B CB 1 ATOM 6839 O OG . SER B 2 47 ? 34.648 36.974 -18.660 1.00 157.45 ? 28 SER B OG 1 ATOM 6840 N N . VAL B 2 48 ? 31.720 38.715 -15.556 1.00 190.31 ? 29 VAL B N 1 ATOM 6841 C CA . VAL B 2 48 ? 30.594 38.722 -14.621 1.00 193.14 ? 29 VAL B CA 1 ATOM 6842 C C . VAL B 2 48 ? 31.048 38.619 -13.161 1.00 190.85 ? 29 VAL B C 1 ATOM 6843 O O . VAL B 2 48 ? 30.808 37.614 -12.491 1.00 189.98 ? 29 VAL B O 1 ATOM 6844 C CB . VAL B 2 48 ? 29.560 37.615 -14.949 1.00 159.00 ? 29 VAL B CB 1 ATOM 6845 C CG1 . VAL B 2 48 ? 28.229 37.910 -14.270 1.00 152.63 ? 29 VAL B CG1 1 ATOM 6846 C CG2 . VAL B 2 48 ? 29.363 37.499 -16.454 1.00 163.93 ? 29 VAL B CG2 1 ATOM 6847 N N . ILE B 2 49 ? 31.714 39.665 -12.681 1.00 189.06 ? 30 ILE B N 1 ATOM 6848 C CA . ILE B 2 49 ? 32.151 39.729 -11.290 1.00 181.72 ? 30 ILE B CA 1 ATOM 6849 C C . ILE B 2 49 ? 31.185 40.580 -10.472 1.00 179.46 ? 30 ILE B C 1 ATOM 6850 O O . ILE B 2 49 ? 31.034 41.772 -10.733 1.00 180.59 ? 30 ILE B O 1 ATOM 6851 C CB . ILE B 2 49 ? 33.570 40.323 -11.161 1.00 177.60 ? 30 ILE B CB 1 ATOM 6852 C CG1 . ILE B 2 49 ? 34.589 39.460 -11.906 1.00 169.15 ? 30 ILE B CG1 1 ATOM 6853 C CG2 . ILE B 2 49 ? 33.962 40.461 -9.697 1.00 176.22 ? 30 ILE B CG2 1 ATOM 6854 C CD1 . ILE B 2 49 ? 35.998 40.014 -11.865 1.00 165.87 ? 30 ILE B CD1 1 ATOM 6855 N N . PRO B 2 50 ? 30.516 39.962 -9.486 1.00 176.65 ? 31 PRO B N 1 ATOM 6856 C CA . PRO B 2 50 ? 29.582 40.663 -8.599 1.00 180.54 ? 31 PRO B CA 1 ATOM 6857 C C . PRO B 2 50 ? 30.295 41.665 -7.694 1.00 190.05 ? 31 PRO B C 1 ATOM 6858 O O . PRO B 2 50 ? 30.764 42.702 -8.164 1.00 195.61 ? 31 PRO B O 1 ATOM 6859 C CB . PRO B 2 50 ? 28.983 39.530 -7.755 1.00 172.06 ? 31 PRO B CB 1 ATOM 6860 C CG . PRO B 2 50 ? 29.221 38.287 -8.547 1.00 167.33 ? 31 PRO B CG 1 ATOM 6861 C CD . PRO B 2 50 ? 30.524 38.511 -9.239 1.00 167.99 ? 31 PRO B CD 1 ATOM 6862 N N . SER B 2 51 ? 30.370 41.355 -6.404 1.00 191.87 ? 32 SER B N 1 ATOM 6863 C CA . SER B 2 51 ? 31.047 42.222 -5.448 1.00 195.03 ? 32 SER B CA 1 ATOM 6864 C C . SER B 2 51 ? 32.229 41.499 -4.812 1.00 188.25 ? 32 SER B C 1 ATOM 6865 O O . SER B 2 51 ? 33.365 41.627 -5.268 1.00 185.29 ? 32 SER B O 1 ATOM 6866 C CB . SER B 2 51 ? 30.073 42.698 -4.369 1.00 198.62 ? 32 SER B CB 1 ATOM 6867 N N . ASP B 2 52 ? 31.951 40.737 -3.758 1.00 184.44 ? 33 ASP B N 1 ATOM 6868 C CA . ASP B 2 52 ? 32.983 39.965 -3.074 1.00 180.11 ? 33 ASP B CA 1 ATOM 6869 C C . ASP B 2 52 ? 32.725 38.466 -3.208 1.00 177.44 ? 33 ASP B C 1 ATOM 6870 O O . ASP B 2 52 ? 32.118 37.851 -2.330 1.00 176.49 ? 33 ASP B O 1 ATOM 6871 C CB . ASP B 2 52 ? 33.054 40.357 -1.596 1.00 177.13 ? 33 ASP B CB 1 ATOM 6872 N N . GLY B 2 53 ? 33.190 37.883 -4.308 1.00 172.54 ? 34 GLY B N 1 ATOM 6873 C CA . GLY B 2 53 ? 32.978 36.471 -4.564 1.00 162.76 ? 34 GLY B CA 1 ATOM 6874 C C . GLY B 2 53 ? 34.071 35.819 -5.391 1.00 169.79 ? 34 GLY B C 1 ATOM 6875 O O . GLY B 2 53 ? 35.146 35.515 -4.874 1.00 167.93 ? 34 GLY B O 1 ATOM 6876 N N . PRO B 2 54 ? 33.800 35.607 -6.690 1.00 180.15 ? 35 PRO B N 1 ATOM 6877 C CA . PRO B 2 54 ? 34.663 34.845 -7.602 1.00 176.19 ? 35 PRO B CA 1 ATOM 6878 C C . PRO B 2 54 ? 35.961 35.565 -7.958 1.00 171.97 ? 35 PRO B C 1 ATOM 6879 O O . PRO B 2 54 ? 36.112 36.047 -9.082 1.00 171.79 ? 35 PRO B O 1 ATOM 6880 C CB . PRO B 2 54 ? 33.792 34.691 -8.850 1.00 180.22 ? 35 PRO B CB 1 ATOM 6881 C CG . PRO B 2 54 ? 32.916 35.891 -8.833 1.00 187.94 ? 35 PRO B CG 1 ATOM 6882 C CD . PRO B 2 54 ? 32.622 36.160 -7.382 1.00 186.61 ? 35 PRO B CD 1 ATOM 6883 N N . SER B 2 55 ? 36.889 35.623 -7.009 1.00 166.84 ? 36 SER B N 1 ATOM 6884 C CA . SER B 2 55 ? 38.178 36.263 -7.235 1.00 162.80 ? 36 SER B CA 1 ATOM 6885 C C . SER B 2 55 ? 39.298 35.231 -7.204 1.00 158.51 ? 36 SER B C 1 ATOM 6886 O O . SER B 2 55 ? 39.246 34.274 -6.434 1.00 157.96 ? 36 SER B O 1 ATOM 6887 C CB . SER B 2 55 ? 38.434 37.324 -6.169 1.00 157.19 ? 36 SER B CB 1 ATOM 6888 O OG . SER B 2 55 ? 38.515 36.726 -4.889 1.00 150.18 ? 36 SER B OG 1 ATOM 6889 N N . VAL B 2 56 ? 40.311 35.432 -8.040 1.00 155.66 ? 37 VAL B N 1 ATOM 6890 C CA . VAL B 2 56 ? 41.451 34.523 -8.082 1.00 149.48 ? 37 VAL B CA 1 ATOM 6891 C C . VAL B 2 56 ? 42.786 35.272 -8.120 1.00 142.99 ? 37 VAL B C 1 ATOM 6892 O O . VAL B 2 56 ? 43.082 35.996 -9.069 1.00 134.55 ? 37 VAL B O 1 ATOM 6893 C CB . VAL B 2 56 ? 41.348 33.531 -9.267 1.00 152.45 ? 37 VAL B CB 1 ATOM 6894 C CG1 . VAL B 2 56 ? 40.978 34.257 -10.556 1.00 158.21 ? 37 VAL B CG1 1 ATOM 6895 C CG2 . VAL B 2 56 ? 42.642 32.743 -9.425 1.00 150.85 ? 37 VAL B CG2 1 ATOM 6896 N N . ALA B 2 57 ? 43.583 35.093 -7.071 1.00 144.28 ? 38 ALA B N 1 ATOM 6897 C CA . ALA B 2 57 ? 44.883 35.747 -6.973 1.00 139.04 ? 38 ALA B CA 1 ATOM 6898 C C . ALA B 2 57 ? 46.019 34.743 -7.132 1.00 140.65 ? 38 ALA B C 1 ATOM 6899 O O . ALA B 2 57 ? 45.798 33.530 -7.110 1.00 138.81 ? 38 ALA B O 1 ATOM 6900 C CB . ALA B 2 57 ? 45.009 36.482 -5.647 1.00 130.82 ? 38 ALA B CB 1 ATOM 6901 N N . CYS B 2 58 ? 47.235 35.256 -7.290 1.00 140.70 ? 39 CYS B N 1 ATOM 6902 C CA . CYS B 2 58 ? 48.406 34.403 -7.452 1.00 140.55 ? 39 CYS B CA 1 ATOM 6903 C C . CYS B 2 58 ? 49.409 34.590 -6.321 1.00 144.34 ? 39 CYS B C 1 ATOM 6904 O O . CYS B 2 58 ? 49.705 35.715 -5.915 1.00 147.35 ? 39 CYS B O 1 ATOM 6905 C CB . CYS B 2 58 ? 49.079 34.658 -8.801 1.00 136.23 ? 39 CYS B CB 1 ATOM 6906 S SG . CYS B 2 58 ? 48.095 34.137 -10.220 1.00 233.46 ? 39 CYS B SG 1 ATOM 6907 N N . VAL B 2 59 ? 49.923 33.475 -5.814 1.00 137.58 ? 40 VAL B N 1 ATOM 6908 C CA . VAL B 2 59 ? 50.929 33.495 -4.762 1.00 128.95 ? 40 VAL B CA 1 ATOM 6909 C C . VAL B 2 59 ? 52.107 32.623 -5.180 1.00 125.20 ? 40 VAL B C 1 ATOM 6910 O O . VAL B 2 59 ? 51.921 31.511 -5.669 1.00 115.30 ? 40 VAL B O 1 ATOM 6911 C CB . VAL B 2 59 ? 50.352 32.992 -3.426 1.00 122.68 ? 40 VAL B CB 1 ATOM 6912 C CG1 . VAL B 2 59 ? 51.408 33.047 -2.328 1.00 122.91 ? 40 VAL B CG1 1 ATOM 6913 C CG2 . VAL B 2 59 ? 49.127 33.811 -3.040 1.00 104.74 ? 40 VAL B CG2 1 ATOM 6914 N N . LYS B 2 60 ? 53.320 33.135 -4.995 1.00 136.40 ? 41 LYS B N 1 ATOM 6915 C CA . LYS B 2 60 ? 54.518 32.427 -5.432 1.00 144.70 ? 41 LYS B CA 1 ATOM 6916 C C . LYS B 2 60 ? 55.256 31.748 -4.280 1.00 153.00 ? 41 LYS B C 1 ATOM 6917 O O . LYS B 2 60 ? 55.566 32.378 -3.268 1.00 163.01 ? 41 LYS B O 1 ATOM 6918 C CB . LYS B 2 60 ? 55.462 33.380 -6.169 1.00 148.61 ? 41 LYS B CB 1 ATOM 6919 N N . LYS B 2 61 ? 55.527 30.457 -4.448 1.00 144.70 ? 42 LYS B N 1 ATOM 6920 C CA . LYS B 2 61 ? 56.330 29.697 -3.497 1.00 133.71 ? 42 LYS B CA 1 ATOM 6921 C C . LYS B 2 61 ? 57.309 28.803 -4.254 1.00 130.21 ? 42 LYS B C 1 ATOM 6922 O O . LYS B 2 61 ? 57.132 28.554 -5.446 1.00 129.05 ? 42 LYS B O 1 ATOM 6923 C CB . LYS B 2 61 ? 55.438 28.862 -2.580 1.00 124.84 ? 42 LYS B CB 1 ATOM 6924 C CG . LYS B 2 61 ? 54.633 29.679 -1.584 1.00 130.98 ? 42 LYS B CG 1 ATOM 6925 C CD . LYS B 2 61 ? 55.543 30.435 -0.627 1.00 140.97 ? 42 LYS B CD 1 ATOM 6926 C CE . LYS B 2 61 ? 54.740 31.255 0.373 1.00 141.54 ? 42 LYS B CE 1 ATOM 6927 N NZ . LYS B 2 61 ? 55.616 31.964 1.346 1.00 142.31 ? 42 LYS B NZ 1 ATOM 6928 N N . ALA B 2 62 ? 58.340 28.326 -3.562 1.00 127.18 ? 43 ALA B N 1 ATOM 6929 C CA . ALA B 2 62 ? 59.383 27.518 -4.194 1.00 119.61 ? 43 ALA B CA 1 ATOM 6930 C C . ALA B 2 62 ? 58.921 26.093 -4.495 1.00 134.25 ? 43 ALA B C 1 ATOM 6931 O O . ALA B 2 62 ? 58.641 25.751 -5.646 1.00 134.46 ? 43 ALA B O 1 ATOM 6932 C CB . ALA B 2 62 ? 60.637 27.497 -3.329 1.00 103.60 ? 43 ALA B CB 1 ATOM 6933 N N . SER B 2 63 ? 58.847 25.266 -3.456 1.00 139.61 ? 44 SER B N 1 ATOM 6934 C CA . SER B 2 63 ? 58.476 23.864 -3.617 1.00 133.00 ? 44 SER B CA 1 ATOM 6935 C C . SER B 2 63 ? 56.993 23.634 -3.346 1.00 128.52 ? 44 SER B C 1 ATOM 6936 O O . SER B 2 63 ? 56.285 24.537 -2.895 1.00 119.10 ? 44 SER B O 1 ATOM 6937 C CB . SER B 2 63 ? 59.319 22.977 -2.696 1.00 136.87 ? 44 SER B CB 1 ATOM 6938 O OG . SER B 2 63 ? 58.938 21.616 -2.804 1.00 140.21 ? 44 SER B OG 1 ATOM 6939 N N . TYR B 2 64 ? 56.534 22.418 -3.627 1.00 126.55 ? 45 TYR B N 1 ATOM 6940 C CA . TYR B 2 64 ? 55.143 22.042 -3.396 1.00 111.68 ? 45 TYR B CA 1 ATOM 6941 C C . TYR B 2 64 ? 54.786 22.097 -1.917 1.00 109.21 ? 45 TYR B C 1 ATOM 6942 O O . TYR B 2 64 ? 53.650 22.401 -1.561 1.00 95.12 ? 45 TYR B O 1 ATOM 6943 C CB . TYR B 2 64 ? 54.865 20.649 -3.959 1.00 103.28 ? 45 TYR B CB 1 ATOM 6944 C CG . TYR B 2 64 ? 54.279 20.667 -5.352 1.00 107.25 ? 45 TYR B CG 1 ATOM 6945 C CD1 . TYR B 2 64 ? 53.220 21.508 -5.668 1.00 105.15 ? 45 TYR B CD1 1 ATOM 6946 C CD2 . TYR B 2 64 ? 54.789 19.849 -6.353 1.00 105.01 ? 45 TYR B CD2 1 ATOM 6947 C CE1 . TYR B 2 64 ? 52.678 21.529 -6.941 1.00 106.96 ? 45 TYR B CE1 1 ATOM 6948 C CE2 . TYR B 2 64 ? 54.256 19.865 -7.631 1.00 101.35 ? 45 TYR B CE2 1 ATOM 6949 C CZ . TYR B 2 64 ? 53.201 20.707 -7.919 1.00 107.30 ? 45 TYR B CZ 1 ATOM 6950 O OH . TYR B 2 64 ? 52.665 20.727 -9.188 1.00 109.09 ? 45 TYR B OH 1 ATOM 6951 N N . LEU B 2 65 ? 55.767 21.805 -1.067 1.00 121.25 ? 46 LEU B N 1 ATOM 6952 C CA . LEU B 2 65 ? 55.595 21.876 0.381 1.00 122.95 ? 46 LEU B CA 1 ATOM 6953 C C . LEU B 2 65 ? 55.254 23.294 0.818 1.00 127.85 ? 46 LEU B C 1 ATOM 6954 O O . LEU B 2 65 ? 54.358 23.503 1.636 1.00 122.29 ? 46 LEU B O 1 ATOM 6955 C CB . LEU B 2 65 ? 56.867 21.421 1.105 1.00 120.85 ? 46 LEU B CB 1 ATOM 6956 C CG . LEU B 2 65 ? 57.302 19.957 1.016 1.00 117.58 ? 46 LEU B CG 1 ATOM 6957 C CD1 . LEU B 2 65 ? 56.111 19.031 1.210 1.00 115.38 ? 46 LEU B CD1 1 ATOM 6958 C CD2 . LEU B 2 65 ? 58.026 19.660 -0.293 1.00 120.89 ? 46 LEU B CD2 1 ATOM 6959 N N . ASP B 2 66 ? 55.976 24.263 0.263 1.00 135.65 ? 47 ASP B N 1 ATOM 6960 C CA . ASP B 2 66 ? 55.798 25.667 0.614 1.00 145.89 ? 47 ASP B CA 1 ATOM 6961 C C . ASP B 2 66 ? 54.372 26.143 0.354 1.00 146.01 ? 47 ASP B C 1 ATOM 6962 O O . ASP B 2 66 ? 53.880 27.048 1.025 1.00 150.93 ? 47 ASP B O 1 ATOM 6963 C CB . ASP B 2 66 ? 56.794 26.541 -0.153 1.00 154.19 ? 47 ASP B CB 1 ATOM 6964 C CG . ASP B 2 66 ? 58.238 26.223 0.192 1.00 156.73 ? 47 ASP B CG 1 ATOM 6965 O OD1 . ASP B 2 66 ? 58.809 26.912 1.064 1.00 160.62 ? 47 ASP B OD1 1 ATOM 6966 O OD2 . ASP B 2 66 ? 58.802 25.284 -0.409 1.00 150.64 ? 47 ASP B OD2 1 ATOM 6967 N N . CYS B 2 67 ? 53.713 25.523 -0.620 1.00 141.04 ? 48 CYS B N 1 ATOM 6968 C CA . CYS B 2 67 ? 52.333 25.863 -0.946 1.00 138.33 ? 48 CYS B CA 1 ATOM 6969 C C . CYS B 2 67 ? 51.367 25.414 0.149 1.00 126.84 ? 48 CYS B C 1 ATOM 6970 O O . CYS B 2 67 ? 50.551 26.201 0.627 1.00 126.29 ? 48 CYS B O 1 ATOM 6971 C CB . CYS B 2 67 ? 51.937 25.256 -2.292 1.00 138.55 ? 48 CYS B CB 1 ATOM 6972 S SG . CYS B 2 67 ? 52.664 26.087 -3.719 1.00 201.11 ? 48 CYS B SG 1 ATOM 6973 N N . ILE B 2 68 ? 51.466 24.149 0.543 1.00 115.76 ? 49 ILE B N 1 ATOM 6974 C CA . ILE B 2 68 ? 50.634 23.621 1.618 1.00 117.21 ? 49 ILE B CA 1 ATOM 6975 C C . ILE B 2 68 ? 50.975 24.310 2.942 1.00 126.79 ? 49 ILE B C 1 ATOM 6976 O O . ILE B 2 68 ? 50.086 24.607 3.742 1.00 127.74 ? 49 ILE B O 1 ATOM 6977 C CB . ILE B 2 68 ? 50.739 22.070 1.722 1.00 120.45 ? 49 ILE B CB 1 ATOM 6978 C CG1 . ILE B 2 68 ? 50.874 21.610 3.175 1.00 122.35 ? 49 ILE B CG1 1 ATOM 6979 C CG2 . ILE B 2 68 ? 51.900 21.547 0.899 1.00 115.47 ? 49 ILE B CG2 1 ATOM 6980 C CD1 . ILE B 2 68 ? 49.557 21.355 3.854 1.00 121.13 ? 49 ILE B CD1 1 ATOM 6981 N N . ARG B 2 69 ? 52.260 24.588 3.153 1.00 132.11 ? 50 ARG B N 1 ATOM 6982 C CA . ARG B 2 69 ? 52.701 25.321 4.338 1.00 138.50 ? 50 ARG B CA 1 ATOM 6983 C C . ARG B 2 69 ? 52.135 26.738 4.337 1.00 145.63 ? 50 ARG B C 1 ATOM 6984 O O . ARG B 2 69 ? 51.938 27.339 5.394 1.00 149.90 ? 50 ARG B O 1 ATOM 6985 C CB . ARG B 2 69 ? 54.230 25.369 4.409 1.00 140.69 ? 50 ARG B CB 1 ATOM 6986 C CG . ARG B 2 69 ? 54.890 24.020 4.648 1.00 144.83 ? 50 ARG B CG 1 ATOM 6987 C CD . ARG B 2 69 ? 54.761 23.572 6.094 1.00 149.99 ? 50 ARG B CD 1 ATOM 6988 N NE . ARG B 2 69 ? 55.169 22.180 6.273 1.00 147.23 ? 50 ARG B NE 1 ATOM 6989 C CZ . ARG B 2 69 ? 56.428 21.776 6.423 1.00 138.81 ? 50 ARG B CZ 1 ATOM 6990 N NH1 . ARG B 2 69 ? 57.420 22.657 6.411 1.00 129.44 ? 50 ARG B NH1 1 ATOM 6991 N NH2 . ARG B 2 69 ? 56.696 20.486 6.581 1.00 133.20 ? 50 ARG B NH2 1 ATOM 6992 N N . ALA B 2 70 ? 51.878 27.266 3.144 1.00 145.84 ? 51 ALA B N 1 ATOM 6993 C CA . ALA B 2 70 ? 51.301 28.598 3.003 1.00 146.46 ? 51 ALA B CA 1 ATOM 6994 C C . ALA B 2 70 ? 49.803 28.569 3.277 1.00 138.53 ? 51 ALA B C 1 ATOM 6995 O O . ALA B 2 70 ? 49.274 29.438 3.970 1.00 140.08 ? 51 ALA B O 1 ATOM 6996 C CB . ALA B 2 70 ? 51.578 29.156 1.617 1.00 149.25 ? 51 ALA B CB 1 ATOM 6997 N N . ILE B 2 71 ? 49.123 27.564 2.733 1.00 125.53 ? 52 ILE B N 1 ATOM 6998 C CA . ILE B 2 71 ? 47.696 27.395 2.980 1.00 120.61 ? 52 ILE B CA 1 ATOM 6999 C C . ILE B 2 71 ? 47.471 27.099 4.461 1.00 129.25 ? 52 ILE B C 1 ATOM 7000 O O . ILE B 2 71 ? 46.396 27.358 5.005 1.00 136.28 ? 52 ILE B O 1 ATOM 7001 C CB . ILE B 2 71 ? 47.091 26.281 2.097 1.00 106.09 ? 52 ILE B CB 1 ATOM 7002 C CG1 . ILE B 2 71 ? 47.401 26.546 0.626 1.00 97.32 ? 52 ILE B CG1 1 ATOM 7003 C CG2 . ILE B 2 71 ? 45.583 26.188 2.285 1.00 101.30 ? 52 ILE B CG2 1 ATOM 7004 C CD1 . ILE B 2 71 ? 46.571 25.721 -0.315 1.00 90.92 ? 52 ILE B CD1 1 ATOM 7005 N N . ALA B 2 72 ? 48.506 26.571 5.111 1.00 129.14 ? 53 ALA B N 1 ATOM 7006 C CA . ALA B 2 72 ? 48.486 26.365 6.554 1.00 140.03 ? 53 ALA B CA 1 ATOM 7007 C C . ALA B 2 72 ? 48.300 27.692 7.284 1.00 139.64 ? 53 ALA B C 1 ATOM 7008 O O . ALA B 2 72 ? 47.657 27.749 8.332 1.00 134.38 ? 53 ALA B O 1 ATOM 7009 C CB . ALA B 2 72 ? 49.765 25.694 7.008 1.00 147.11 ? 53 ALA B CB 1 ATOM 7010 N N . ALA B 2 73 ? 48.875 28.753 6.725 1.00 135.67 ? 54 ALA B N 1 ATOM 7011 C CA . ALA B 2 73 ? 48.694 30.097 7.263 1.00 132.96 ? 54 ALA B CA 1 ATOM 7012 C C . ALA B 2 73 ? 47.407 30.703 6.715 1.00 129.75 ? 54 ALA B C 1 ATOM 7013 O O . ALA B 2 73 ? 46.314 30.326 7.136 1.00 129.16 ? 54 ALA B O 1 ATOM 7014 C CB . ALA B 2 73 ? 49.886 30.972 6.922 1.00 131.59 ? 54 ALA B CB 1 ATOM 7015 N N . ASN B 2 74 ? 47.542 31.636 5.775 1.00 125.24 ? 55 ASN B N 1 ATOM 7016 C CA . ASN B 2 74 ? 46.387 32.224 5.098 1.00 124.81 ? 55 ASN B CA 1 ATOM 7017 C C . ASN B 2 74 ? 46.751 32.956 3.807 1.00 128.85 ? 55 ASN B C 1 ATOM 7018 O O . ASN B 2 74 ? 45.875 33.477 3.112 1.00 122.34 ? 55 ASN B O 1 ATOM 7019 C CB . ASN B 2 74 ? 45.613 33.159 6.036 1.00 125.11 ? 55 ASN B CB 1 ATOM 7020 C CG . ASN B 2 74 ? 44.268 32.586 6.455 1.00 115.77 ? 55 ASN B CG 1 ATOM 7021 O OD1 . ASN B 2 74 ? 44.149 31.948 7.503 1.00 109.66 ? 55 ASN B OD1 1 ATOM 7022 N ND2 . ASN B 2 74 ? 43.246 32.815 5.636 1.00 106.44 ? 55 ASN B ND2 1 ATOM 7023 N N . GLU B 2 75 ? 48.041 32.987 3.480 1.00 137.27 ? 56 GLU B N 1 ATOM 7024 C CA . GLU B 2 75 ? 48.499 33.676 2.276 1.00 151.11 ? 56 GLU B CA 1 ATOM 7025 C C . GLU B 2 75 ? 48.356 32.793 1.044 1.00 152.49 ? 56 GLU B C 1 ATOM 7026 O O . GLU B 2 75 ? 48.927 33.081 -0.004 1.00 154.08 ? 56 GLU B O 1 ATOM 7027 C CB . GLU B 2 75 ? 49.955 34.132 2.414 1.00 160.88 ? 56 GLU B CB 1 ATOM 7028 C CG . GLU B 2 75 ? 50.459 34.247 3.841 1.00 160.05 ? 56 GLU B CG 1 ATOM 7029 C CD . GLU B 2 75 ? 51.068 32.955 4.338 1.00 145.03 ? 56 GLU B CD 1 ATOM 7030 O OE1 . GLU B 2 75 ? 50.656 31.882 3.853 1.00 139.18 ? 56 GLU B OE1 1 ATOM 7031 O OE2 . GLU B 2 75 ? 51.965 33.011 5.205 1.00 142.70 ? 56 GLU B OE2 1 ATOM 7032 N N . ALA B 2 76 ? 47.598 31.711 1.187 1.00 152.82 ? 57 ALA B N 1 ATOM 7033 C CA . ALA B 2 76 ? 47.310 30.800 0.088 1.00 145.40 ? 57 ALA B CA 1 ATOM 7034 C C . ALA B 2 76 ? 46.068 29.995 0.443 1.00 136.38 ? 57 ALA B C 1 ATOM 7035 O O . ALA B 2 76 ? 45.813 29.734 1.619 1.00 136.78 ? 57 ALA B O 1 ATOM 7036 C CB . ALA B 2 76 ? 48.490 29.881 -0.168 1.00 144.16 ? 57 ALA B CB 1 ATOM 7037 N N . ASP B 2 77 ? 45.293 29.604 -0.563 1.00 131.10 ? 58 ASP B N 1 ATOM 7038 C CA . ASP B 2 77 ? 44.023 28.928 -0.310 1.00 121.41 ? 58 ASP B CA 1 ATOM 7039 C C . ASP B 2 77 ? 43.845 27.624 -1.089 1.00 107.83 ? 58 ASP B C 1 ATOM 7040 O O . ASP B 2 77 ? 43.334 26.642 -0.552 1.00 91.74 ? 58 ASP B O 1 ATOM 7041 C CB . ASP B 2 77 ? 42.855 29.875 -0.595 1.00 123.57 ? 58 ASP B CB 1 ATOM 7042 C CG . ASP B 2 77 ? 42.932 31.151 0.217 1.00 136.06 ? 58 ASP B CG 1 ATOM 7043 O OD1 . ASP B 2 77 ? 43.341 31.078 1.395 1.00 134.21 ? 58 ASP B OD1 1 ATOM 7044 O OD2 . ASP B 2 77 ? 42.593 32.227 -0.320 1.00 145.59 ? 58 ASP B OD2 1 ATOM 7045 N N . ALA B 2 78 ? 44.269 27.616 -2.349 1.00 116.83 ? 59 ALA B N 1 ATOM 7046 C CA . ALA B 2 78 ? 44.041 26.470 -3.226 1.00 119.15 ? 59 ALA B CA 1 ATOM 7047 C C . ALA B 2 78 ? 45.293 26.054 -3.990 1.00 126.86 ? 59 ALA B C 1 ATOM 7048 O O . ALA B 2 78 ? 45.899 26.864 -4.685 1.00 140.24 ? 59 ALA B O 1 ATOM 7049 C CB . ALA B 2 78 ? 42.906 26.770 -4.206 1.00 114.01 ? 59 ALA B CB 1 ATOM 7050 N N . VAL B 2 79 ? 45.682 24.790 -3.843 1.00 113.01 ? 60 VAL B N 1 ATOM 7051 C CA . VAL B 2 79 ? 46.727 24.200 -4.671 1.00 105.16 ? 60 VAL B CA 1 ATOM 7052 C C . VAL B 2 79 ? 46.269 22.825 -5.124 1.00 103.13 ? 60 VAL B C 1 ATOM 7053 O O . VAL B 2 79 ? 45.693 22.069 -4.344 1.00 105.08 ? 60 VAL B O 1 ATOM 7054 C CB . VAL B 2 79 ? 48.057 24.018 -3.914 1.00 105.22 ? 60 VAL B CB 1 ATOM 7055 C CG1 . VAL B 2 79 ? 49.161 23.623 -4.882 1.00 98.78 ? 60 VAL B CG1 1 ATOM 7056 C CG2 . VAL B 2 79 ? 48.444 25.279 -3.186 1.00 121.40 ? 60 VAL B CG2 1 ATOM 7057 N N . THR B 2 80 ? 46.523 22.505 -6.386 1.00 105.88 ? 61 THR B N 1 ATOM 7058 C CA . THR B 2 80 ? 46.232 21.175 -6.901 1.00 108.99 ? 61 THR B CA 1 ATOM 7059 C C . THR B 2 80 ? 47.447 20.260 -6.737 1.00 104.32 ? 61 THR B C 1 ATOM 7060 O O . THR B 2 80 ? 48.570 20.629 -7.086 1.00 107.45 ? 61 THR B O 1 ATOM 7061 C CB . THR B 2 80 ? 45.800 21.233 -8.371 1.00 117.28 ? 61 THR B CB 1 ATOM 7062 O OG1 . THR B 2 80 ? 45.850 19.919 -8.939 1.00 115.48 ? 61 THR B OG1 1 ATOM 7063 C CG2 . THR B 2 80 ? 46.718 22.158 -9.151 1.00 126.03 ? 61 THR B CG2 1 ATOM 7064 N N . LEU B 2 81 ? 47.220 19.067 -6.196 1.00 89.64 ? 62 LEU B N 1 ATOM 7065 C CA . LEU B 2 81 ? 48.318 18.168 -5.861 1.00 85.72 ? 62 LEU B CA 1 ATOM 7066 C C . LEU B 2 81 ? 48.113 16.751 -6.382 1.00 84.70 ? 62 LEU B C 1 ATOM 7067 O O . LEU B 2 81 ? 46.983 16.309 -6.575 1.00 72.36 ? 62 LEU B O 1 ATOM 7068 C CB . LEU B 2 81 ? 48.505 18.117 -4.345 1.00 88.66 ? 62 LEU B CB 1 ATOM 7069 C CG . LEU B 2 81 ? 48.929 19.415 -3.663 1.00 87.92 ? 62 LEU B CG 1 ATOM 7070 C CD1 . LEU B 2 81 ? 48.979 19.229 -2.157 1.00 89.75 ? 62 LEU B CD1 1 ATOM 7071 C CD2 . LEU B 2 81 ? 50.276 19.866 -4.195 1.00 74.73 ? 62 LEU B CD2 1 ATOM 7072 N N . ASP B 2 82 ? 49.219 16.046 -6.607 1.00 99.45 ? 63 ASP B N 1 ATOM 7073 C CA . ASP B 2 82 ? 49.166 14.617 -6.889 1.00 95.75 ? 63 ASP B CA 1 ATOM 7074 C C . ASP B 2 82 ? 48.892 13.891 -5.582 1.00 86.28 ? 63 ASP B C 1 ATOM 7075 O O . ASP B 2 82 ? 49.059 14.468 -4.509 1.00 83.46 ? 63 ASP B O 1 ATOM 7076 C CB . ASP B 2 82 ? 50.479 14.124 -7.503 1.00 93.58 ? 63 ASP B CB 1 ATOM 7077 C CG . ASP B 2 82 ? 50.660 14.581 -8.938 1.00 102.64 ? 63 ASP B CG 1 ATOM 7078 O OD1 . ASP B 2 82 ? 50.267 15.723 -9.257 1.00 120.77 ? 63 ASP B OD1 1 ATOM 7079 O OD2 . ASP B 2 82 ? 51.192 13.796 -9.749 1.00 87.38 ? 63 ASP B OD2 1 ATOM 7080 N N . ALA B 2 83 ? 48.477 12.631 -5.678 1.00 79.05 ? 64 ALA B N 1 ATOM 7081 C CA . ALA B 2 83 ? 48.081 11.848 -4.507 1.00 76.10 ? 64 ALA B CA 1 ATOM 7082 C C . ALA B 2 83 ? 49.129 11.829 -3.394 1.00 71.08 ? 64 ALA B C 1 ATOM 7083 O O . ALA B 2 83 ? 48.787 11.911 -2.213 1.00 71.65 ? 64 ALA B O 1 ATOM 7084 C CB . ALA B 2 83 ? 47.719 10.427 -4.918 1.00 67.87 ? 64 ALA B CB 1 ATOM 7085 N N . GLY B 2 84 ? 50.397 11.721 -3.777 1.00 67.59 ? 65 GLY B N 1 ATOM 7086 C CA . GLY B 2 84 ? 51.483 11.674 -2.816 1.00 71.26 ? 65 GLY B CA 1 ATOM 7087 C C . GLY B 2 84 ? 51.505 12.894 -1.920 1.00 84.77 ? 65 GLY B C 1 ATOM 7088 O O . GLY B 2 84 ? 51.767 12.793 -0.722 1.00 89.59 ? 65 GLY B O 1 ATOM 7089 N N . LEU B 2 85 ? 51.214 14.049 -2.508 1.00 97.93 ? 66 LEU B N 1 ATOM 7090 C CA . LEU B 2 85 ? 51.207 15.311 -1.778 1.00 100.02 ? 66 LEU B CA 1 ATOM 7091 C C . LEU B 2 85 ? 49.868 15.559 -1.090 1.00 96.13 ? 66 LEU B C 1 ATOM 7092 O O . LEU B 2 85 ? 49.795 16.316 -0.125 1.00 99.03 ? 66 LEU B O 1 ATOM 7093 C CB . LEU B 2 85 ? 51.547 16.468 -2.718 1.00 100.70 ? 66 LEU B CB 1 ATOM 7094 C CG . LEU B 2 85 ? 52.977 16.454 -3.259 1.00 96.87 ? 66 LEU B CG 1 ATOM 7095 C CD1 . LEU B 2 85 ? 53.068 17.238 -4.559 1.00 107.15 ? 66 LEU B CD1 1 ATOM 7096 C CD2 . LEU B 2 85 ? 53.933 17.018 -2.219 1.00 83.51 ? 66 LEU B CD2 1 ATOM 7097 N N . VAL B 2 86 ? 48.811 14.923 -1.591 1.00 85.93 ? 67 VAL B N 1 ATOM 7098 C CA . VAL B 2 86 ? 47.510 14.988 -0.938 1.00 69.39 ? 67 VAL B CA 1 ATOM 7099 C C . VAL B 2 86 ? 47.633 14.326 0.425 1.00 79.18 ? 67 VAL B C 1 ATOM 7100 O O . VAL B 2 86 ? 47.028 14.768 1.402 1.00 84.04 ? 67 VAL B O 1 ATOM 7101 C CB . VAL B 2 86 ? 46.415 14.291 -1.768 1.00 61.23 ? 67 VAL B CB 1 ATOM 7102 C CG1 . VAL B 2 86 ? 45.102 14.266 -1.011 1.00 54.74 ? 67 VAL B CG1 1 ATOM 7103 C CG2 . VAL B 2 86 ? 46.231 14.998 -3.100 1.00 68.83 ? 67 VAL B CG2 1 ATOM 7104 N N . TYR B 2 87 ? 48.444 13.274 0.483 1.00 77.25 ? 68 TYR B N 1 ATOM 7105 C CA . TYR B 2 87 ? 48.743 12.600 1.740 1.00 75.19 ? 68 TYR B CA 1 ATOM 7106 C C . TYR B 2 87 ? 49.622 13.481 2.625 1.00 84.53 ? 68 TYR B C 1 ATOM 7107 O O . TYR B 2 87 ? 49.424 13.552 3.838 1.00 87.85 ? 68 TYR B O 1 ATOM 7108 C CB . TYR B 2 87 ? 49.418 11.249 1.481 1.00 67.78 ? 68 TYR B CB 1 ATOM 7109 C CG . TYR B 2 87 ? 49.805 10.505 2.739 1.00 85.77 ? 68 TYR B CG 1 ATOM 7110 C CD1 . TYR B 2 87 ? 48.857 9.808 3.480 1.00 95.79 ? 68 TYR B CD1 1 ATOM 7111 C CD2 . TYR B 2 87 ? 51.119 10.496 3.185 1.00 89.43 ? 68 TYR B CD2 1 ATOM 7112 C CE1 . TYR B 2 87 ? 49.208 9.129 4.631 1.00 96.45 ? 68 TYR B CE1 1 ATOM 7113 C CE2 . TYR B 2 87 ? 51.479 9.819 4.334 1.00 93.81 ? 68 TYR B CE2 1 ATOM 7114 C CZ . TYR B 2 87 ? 50.521 9.137 5.053 1.00 98.31 ? 68 TYR B CZ 1 ATOM 7115 O OH . TYR B 2 87 ? 50.883 8.462 6.198 1.00 104.42 ? 68 TYR B OH 1 ATOM 7116 N N . ASP B 2 88 ? 50.592 14.152 2.010 1.00 84.27 ? 69 ASP B N 1 ATOM 7117 C CA . ASP B 2 88 ? 51.474 15.063 2.734 1.00 84.03 ? 69 ASP B CA 1 ATOM 7118 C C . ASP B 2 88 ? 50.686 16.241 3.290 1.00 80.11 ? 69 ASP B C 1 ATOM 7119 O O . ASP B 2 88 ? 50.905 16.668 4.422 1.00 85.31 ? 69 ASP B O 1 ATOM 7120 C CB . ASP B 2 88 ? 52.595 15.576 1.823 1.00 95.83 ? 69 ASP B CB 1 ATOM 7121 C CG . ASP B 2 88 ? 53.580 14.487 1.431 1.00 104.60 ? 69 ASP B CG 1 ATOM 7122 O OD1 . ASP B 2 88 ? 53.816 13.574 2.249 1.00 101.71 ? 69 ASP B OD1 1 ATOM 7123 O OD2 . ASP B 2 88 ? 54.121 14.546 0.306 1.00 104.90 ? 69 ASP B OD2 1 ATOM 7124 N N . ALA B 2 89 ? 49.766 16.760 2.484 1.00 83.00 ? 70 ALA B N 1 ATOM 7125 C CA . ALA B 2 89 ? 48.967 17.914 2.874 1.00 94.55 ? 70 ALA B CA 1 ATOM 7126 C C . ALA B 2 89 ? 47.978 17.582 3.985 1.00 93.30 ? 70 ALA B C 1 ATOM 7127 O O . ALA B 2 89 ? 47.571 18.461 4.738 1.00 101.66 ? 70 ALA B O 1 ATOM 7128 C CB . ALA B 2 89 ? 48.239 18.495 1.669 1.00 101.90 ? 70 ALA B CB 1 ATOM 7129 N N . TYR B 2 90 ? 47.589 16.317 4.082 1.00 86.27 ? 71 TYR B N 1 ATOM 7130 C CA . TYR B 2 90 ? 46.670 15.894 5.131 1.00 92.88 ? 71 TYR B CA 1 ATOM 7131 C C . TYR B 2 90 ? 47.369 15.825 6.483 1.00 89.50 ? 71 TYR B C 1 ATOM 7132 O O . TYR B 2 90 ? 46.753 16.042 7.526 1.00 88.36 ? 71 TYR B O 1 ATOM 7133 C CB . TYR B 2 90 ? 46.057 14.532 4.805 1.00 92.73 ? 71 TYR B CB 1 ATOM 7134 C CG . TYR B 2 90 ? 45.472 13.844 6.017 1.00 94.96 ? 71 TYR B CG 1 ATOM 7135 C CD1 . TYR B 2 90 ? 44.288 14.293 6.589 1.00 105.58 ? 71 TYR B CD1 1 ATOM 7136 C CD2 . TYR B 2 90 ? 46.113 12.756 6.602 1.00 97.76 ? 71 TYR B CD2 1 ATOM 7137 C CE1 . TYR B 2 90 ? 43.754 13.675 7.704 1.00 114.49 ? 71 TYR B CE1 1 ATOM 7138 C CE2 . TYR B 2 90 ? 45.585 12.132 7.717 1.00 102.37 ? 71 TYR B CE2 1 ATOM 7139 C CZ . TYR B 2 90 ? 44.405 12.596 8.264 1.00 111.56 ? 71 TYR B CZ 1 ATOM 7140 O OH . TYR B 2 90 ? 43.871 11.982 9.375 1.00 114.03 ? 71 TYR B OH 1 ATOM 7141 N N . LEU B 2 91 ? 48.660 15.520 6.451 1.00 89.17 ? 72 LEU B N 1 ATOM 7142 C CA . LEU B 2 91 ? 49.435 15.313 7.667 1.00 99.46 ? 72 LEU B CA 1 ATOM 7143 C C . LEU B 2 91 ? 49.534 16.572 8.533 1.00 110.87 ? 72 LEU B C 1 ATOM 7144 O O . LEU B 2 91 ? 49.464 17.697 8.034 1.00 102.28 ? 72 LEU B O 1 ATOM 7145 C CB . LEU B 2 91 ? 50.831 14.803 7.314 1.00 101.07 ? 72 LEU B CB 1 ATOM 7146 C CG . LEU B 2 91 ? 51.340 13.630 8.148 1.00 104.45 ? 72 LEU B CG 1 ATOM 7147 C CD1 . LEU B 2 91 ? 50.344 12.480 8.110 1.00 83.03 ? 72 LEU B CD1 1 ATOM 7148 C CD2 . LEU B 2 91 ? 52.707 13.181 7.650 1.00 112.98 ? 72 LEU B CD2 1 ATOM 7149 N N . ALA B 2 92 ? 49.689 16.364 9.837 1.00 113.71 ? 73 ALA B N 1 ATOM 7150 C CA . ALA B 2 92 ? 49.840 17.454 10.794 1.00 108.19 ? 73 ALA B CA 1 ATOM 7151 C C . ALA B 2 92 ? 51.133 18.223 10.520 1.00 104.42 ? 73 ALA B C 1 ATOM 7152 O O . ALA B 2 92 ? 52.055 17.684 9.911 1.00 97.87 ? 73 ALA B O 1 ATOM 7153 C CB . ALA B 2 92 ? 49.835 16.894 12.213 1.00 111.80 ? 73 ALA B CB 1 ATOM 7154 N N . PRO B 2 93 ? 51.210 19.490 10.961 1.00 119.19 ? 74 PRO B N 1 ATOM 7155 C CA . PRO B 2 93 ? 50.184 20.266 11.669 1.00 133.37 ? 74 PRO B CA 1 ATOM 7156 C C . PRO B 2 93 ? 49.188 20.899 10.707 1.00 143.15 ? 74 PRO B C 1 ATOM 7157 O O . PRO B 2 93 ? 48.116 21.340 11.120 1.00 146.26 ? 74 PRO B O 1 ATOM 7158 C CB . PRO B 2 93 ? 51.004 21.360 12.351 1.00 131.40 ? 74 PRO B CB 1 ATOM 7159 C CG . PRO B 2 93 ? 52.132 21.597 11.407 1.00 123.20 ? 74 PRO B CG 1 ATOM 7160 C CD . PRO B 2 93 ? 52.468 20.248 10.823 1.00 118.82 ? 74 PRO B CD 1 ATOM 7161 N N . ASN B 2 94 ? 49.551 20.930 9.431 1.00 141.16 ? 75 ASN B N 1 ATOM 7162 C CA . ASN B 2 94 ? 48.776 21.627 8.416 1.00 126.04 ? 75 ASN B CA 1 ATOM 7163 C C . ASN B 2 94 ? 47.724 20.751 7.747 1.00 113.18 ? 75 ASN B C 1 ATOM 7164 O O . ASN B 2 94 ? 47.796 20.503 6.547 1.00 110.91 ? 75 ASN B O 1 ATOM 7165 C CB . ASN B 2 94 ? 49.725 22.193 7.361 1.00 118.40 ? 75 ASN B CB 1 ATOM 7166 C CG . ASN B 2 94 ? 50.848 21.231 7.014 1.00 108.71 ? 75 ASN B CG 1 ATOM 7167 O OD1 . ASN B 2 94 ? 50.742 20.029 7.243 1.00 102.88 ? 75 ASN B OD1 1 ATOM 7168 N ND2 . ASN B 2 94 ? 51.932 21.760 6.459 1.00 110.33 ? 75 ASN B ND2 1 ATOM 7169 N N . ASN B 2 95 ? 46.746 20.296 8.525 1.00 116.15 ? 76 ASN B N 1 ATOM 7170 C CA . ASN B 2 95 ? 45.703 19.403 8.022 1.00 115.58 ? 76 ASN B CA 1 ATOM 7171 C C . ASN B 2 95 ? 44.884 19.994 6.878 1.00 107.68 ? 76 ASN B C 1 ATOM 7172 O O . ASN B 2 95 ? 44.079 20.900 7.080 1.00 105.66 ? 76 ASN B O 1 ATOM 7173 C CB . ASN B 2 95 ? 44.776 18.969 9.158 1.00 125.96 ? 76 ASN B CB 1 ATOM 7174 C CG . ASN B 2 95 ? 45.479 18.104 10.183 1.00 138.25 ? 76 ASN B CG 1 ATOM 7175 O OD1 . ASN B 2 95 ? 46.131 18.611 11.097 1.00 144.17 ? 76 ASN B OD1 1 ATOM 7176 N ND2 . ASN B 2 95 ? 45.352 16.788 10.036 1.00 135.42 ? 76 ASN B ND2 1 ATOM 7177 N N . LEU B 2 96 ? 45.095 19.465 5.678 1.00 99.83 ? 77 LEU B N 1 ATOM 7178 C CA . LEU B 2 96 ? 44.395 19.939 4.491 1.00 87.83 ? 77 LEU B CA 1 ATOM 7179 C C . LEU B 2 96 ? 43.439 18.882 3.934 1.00 84.67 ? 77 LEU B C 1 ATOM 7180 O O . LEU B 2 96 ? 43.772 17.697 3.872 1.00 81.99 ? 77 LEU B O 1 ATOM 7181 C CB . LEU B 2 96 ? 45.400 20.370 3.422 1.00 80.22 ? 77 LEU B CB 1 ATOM 7182 C CG . LEU B 2 96 ? 45.644 21.873 3.265 1.00 96.15 ? 77 LEU B CG 1 ATOM 7183 C CD1 . LEU B 2 96 ? 46.207 22.485 4.538 1.00 98.54 ? 77 LEU B CD1 1 ATOM 7184 C CD2 . LEU B 2 96 ? 46.546 22.158 2.070 1.00 103.85 ? 77 LEU B CD2 1 ATOM 7185 N N . LYS B 2 97 ? 42.253 19.325 3.525 1.00 83.16 ? 78 LYS B N 1 ATOM 7186 C CA . LYS B 2 97 ? 41.208 18.433 3.029 1.00 80.42 ? 78 LYS B CA 1 ATOM 7187 C C . LYS B 2 97 ? 40.947 18.626 1.537 1.00 88.68 ? 78 LYS B C 1 ATOM 7188 O O . LYS B 2 97 ? 40.894 19.756 1.056 1.00 106.08 ? 78 LYS B O 1 ATOM 7189 C CB . LYS B 2 97 ? 39.908 18.657 3.809 1.00 79.22 ? 78 LYS B CB 1 ATOM 7190 N N . PRO B 2 98 ? 40.779 17.519 0.797 1.00 90.43 ? 79 PRO B N 1 ATOM 7191 C CA . PRO B 2 98 ? 40.456 17.593 -0.633 1.00 93.35 ? 79 PRO B CA 1 ATOM 7192 C C . PRO B 2 98 ? 39.038 18.116 -0.862 1.00 100.16 ? 79 PRO B C 1 ATOM 7193 O O . PRO B 2 98 ? 38.124 17.760 -0.115 1.00 93.26 ? 79 PRO B O 1 ATOM 7194 C CB . PRO B 2 98 ? 40.569 16.136 -1.092 1.00 81.70 ? 79 PRO B CB 1 ATOM 7195 C CG . PRO B 2 98 ? 40.317 15.335 0.139 1.00 83.92 ? 79 PRO B CG 1 ATOM 7196 C CD . PRO B 2 98 ? 40.908 16.128 1.265 1.00 87.98 ? 79 PRO B CD 1 ATOM 7197 N N . VAL B 2 99 ? 38.863 18.964 -1.875 1.00 104.09 ? 80 VAL B N 1 ATOM 7198 C CA . VAL B 2 99 ? 37.558 19.560 -2.152 1.00 98.40 ? 80 VAL B CA 1 ATOM 7199 C C . VAL B 2 99 ? 37.152 19.444 -3.624 1.00 100.25 ? 80 VAL B C 1 ATOM 7200 O O . VAL B 2 99 ? 35.969 19.303 -3.937 1.00 106.10 ? 80 VAL B O 1 ATOM 7201 C CB . VAL B 2 99 ? 37.506 21.050 -1.743 1.00 93.97 ? 80 VAL B CB 1 ATOM 7202 C CG1 . VAL B 2 99 ? 36.062 21.533 -1.684 1.00 99.17 ? 80 VAL B CG1 1 ATOM 7203 C CG2 . VAL B 2 99 ? 38.192 21.273 -0.401 1.00 85.51 ? 80 VAL B CG2 1 ATOM 7204 N N . VAL B 2 100 ? 38.128 19.505 -4.526 1.00 94.74 ? 81 VAL B N 1 ATOM 7205 C CA . VAL B 2 100 ? 37.842 19.483 -5.963 1.00 93.97 ? 81 VAL B CA 1 ATOM 7206 C C . VAL B 2 100 ? 38.783 18.543 -6.722 1.00 79.07 ? 81 VAL B C 1 ATOM 7207 O O . VAL B 2 100 ? 39.982 18.496 -6.448 1.00 75.30 ? 81 VAL B O 1 ATOM 7208 C CB . VAL B 2 100 ? 37.904 20.915 -6.574 1.00 90.42 ? 81 VAL B CB 1 ATOM 7209 C CG1 . VAL B 2 100 ? 37.848 20.873 -8.099 1.00 80.20 ? 81 VAL B CG1 1 ATOM 7210 C CG2 . VAL B 2 100 ? 36.782 21.783 -6.023 1.00 89.45 ? 81 VAL B CG2 1 ATOM 7211 N N . ALA B 2 101 ? 38.237 17.795 -7.676 1.00 78.56 ? 82 ALA B N 1 ATOM 7212 C CA . ALA B 2 101 ? 39.036 16.844 -8.441 1.00 89.97 ? 82 ALA B CA 1 ATOM 7213 C C . ALA B 2 101 ? 38.949 17.079 -9.946 1.00 88.13 ? 82 ALA B C 1 ATOM 7214 O O . ALA B 2 101 ? 37.928 17.541 -10.449 1.00 92.03 ? 82 ALA B O 1 ATOM 7215 C CB . ALA B 2 101 ? 38.615 15.423 -8.111 1.00 90.66 ? 82 ALA B CB 1 ATOM 7216 N N . GLU B 2 102 ? 40.026 16.750 -10.654 1.00 82.22 ? 83 GLU B N 1 ATOM 7217 C CA . GLU B 2 102 ? 40.048 16.822 -12.111 1.00 79.24 ? 83 GLU B CA 1 ATOM 7218 C C . GLU B 2 102 ? 39.548 15.518 -12.718 1.00 87.30 ? 83 GLU B C 1 ATOM 7219 O O . GLU B 2 102 ? 40.260 14.513 -12.713 1.00 81.29 ? 83 GLU B O 1 ATOM 7220 C CB . GLU B 2 102 ? 41.465 17.079 -12.622 1.00 72.89 ? 83 GLU B CB 1 ATOM 7221 C CG . GLU B 2 102 ? 42.121 18.343 -12.116 1.00 82.36 ? 83 GLU B CG 1 ATOM 7222 C CD . GLU B 2 102 ? 43.497 18.555 -12.723 1.00 86.03 ? 83 GLU B CD 1 ATOM 7223 O OE1 . GLU B 2 102 ? 43.726 18.081 -13.857 1.00 79.80 ? 83 GLU B OE1 1 ATOM 7224 O OE2 . GLU B 2 102 ? 44.352 19.185 -12.064 1.00 92.20 ? 83 GLU B OE2 1 ATOM 7225 N N . PHE B 2 103 ? 38.329 15.530 -13.245 1.00 92.47 ? 84 PHE B N 1 ATOM 7226 C CA . PHE B 2 103 ? 37.812 14.356 -13.933 1.00 93.72 ? 84 PHE B CA 1 ATOM 7227 C C . PHE B 2 103 ? 38.341 14.322 -15.363 1.00 92.99 ? 84 PHE B C 1 ATOM 7228 O O . PHE B 2 103 ? 38.509 15.362 -15.997 1.00 85.84 ? 84 PHE B O 1 ATOM 7229 C CB . PHE B 2 103 ? 36.278 14.325 -13.909 1.00 95.46 ? 84 PHE B CB 1 ATOM 7230 C CG . PHE B 2 103 ? 35.625 15.150 -14.986 1.00 86.28 ? 84 PHE B CG 1 ATOM 7231 C CD1 . PHE B 2 103 ? 35.264 14.573 -16.197 1.00 83.94 ? 84 PHE B CD1 1 ATOM 7232 C CD2 . PHE B 2 103 ? 35.355 16.492 -14.784 1.00 90.07 ? 84 PHE B CD2 1 ATOM 7233 C CE1 . PHE B 2 103 ? 34.664 15.323 -17.186 1.00 87.60 ? 84 PHE B CE1 1 ATOM 7234 C CE2 . PHE B 2 103 ? 34.748 17.246 -15.768 1.00 93.56 ? 84 PHE B CE2 1 ATOM 7235 C CZ . PHE B 2 103 ? 34.405 16.662 -16.971 1.00 96.29 ? 84 PHE B CZ 1 ATOM 7236 N N . TYR B 2 104 ? 38.618 13.124 -15.862 1.00 100.06 ? 85 TYR B N 1 ATOM 7237 C CA . TYR B 2 104 ? 39.090 12.964 -17.231 1.00 101.90 ? 85 TYR B CA 1 ATOM 7238 C C . TYR B 2 104 ? 38.082 12.121 -18.006 1.00 111.35 ? 85 TYR B C 1 ATOM 7239 O O . TYR B 2 104 ? 37.246 11.443 -17.408 1.00 118.14 ? 85 TYR B O 1 ATOM 7240 C CB . TYR B 2 104 ? 40.472 12.308 -17.244 1.00 102.36 ? 85 TYR B CB 1 ATOM 7241 C CG . TYR B 2 104 ? 41.480 12.993 -16.346 1.00 108.81 ? 85 TYR B CG 1 ATOM 7242 C CD1 . TYR B 2 104 ? 42.445 12.264 -15.664 1.00 106.44 ? 85 TYR B CD1 1 ATOM 7243 C CD2 . TYR B 2 104 ? 41.470 14.371 -16.183 1.00 122.14 ? 85 TYR B CD2 1 ATOM 7244 C CE1 . TYR B 2 104 ? 43.368 12.891 -14.840 1.00 108.48 ? 85 TYR B CE1 1 ATOM 7245 C CE2 . TYR B 2 104 ? 42.384 15.005 -15.363 1.00 123.70 ? 85 TYR B CE2 1 ATOM 7246 C CZ . TYR B 2 104 ? 43.331 14.264 -14.694 1.00 113.42 ? 85 TYR B CZ 1 ATOM 7247 O OH . TYR B 2 104 ? 44.239 14.906 -13.879 1.00 102.03 ? 85 TYR B OH 1 ATOM 7248 N N . GLY B 2 105 ? 38.151 12.169 -19.332 1.00 113.67 ? 86 GLY B N 1 ATOM 7249 C CA . GLY B 2 105 ? 37.220 11.423 -20.161 1.00 116.74 ? 86 GLY B CA 1 ATOM 7250 C C . GLY B 2 105 ? 35.797 11.941 -20.058 1.00 122.27 ? 86 GLY B C 1 ATOM 7251 O O . GLY B 2 105 ? 35.575 13.128 -19.815 1.00 118.23 ? 86 GLY B O 1 ATOM 7252 N N . SER B 2 106 ? 34.831 11.044 -20.232 1.00 127.05 ? 87 SER B N 1 ATOM 7253 C CA . SER B 2 106 ? 33.417 11.417 -20.236 1.00 128.94 ? 87 SER B CA 1 ATOM 7254 C C . SER B 2 106 ? 32.892 11.766 -18.847 1.00 125.14 ? 87 SER B C 1 ATOM 7255 O O . SER B 2 106 ? 33.596 11.624 -17.848 1.00 118.24 ? 87 SER B O 1 ATOM 7256 C CB . SER B 2 106 ? 32.569 10.290 -20.829 1.00 126.20 ? 87 SER B CB 1 ATOM 7257 O OG . SER B 2 106 ? 32.982 9.978 -22.147 1.00 127.58 ? 87 SER B OG 1 ATOM 7258 N N . LYS B 2 107 ? 31.647 12.226 -18.796 1.00 126.64 ? 88 LYS B N 1 ATOM 7259 C CA . LYS B 2 107 ? 30.984 12.492 -17.527 1.00 128.08 ? 88 LYS B CA 1 ATOM 7260 C C . LYS B 2 107 ? 30.399 11.194 -16.980 1.00 126.42 ? 88 LYS B C 1 ATOM 7261 O O . LYS B 2 107 ? 30.354 10.980 -15.767 1.00 116.20 ? 88 LYS B O 1 ATOM 7262 C CB . LYS B 2 107 ? 29.887 13.546 -17.697 1.00 76.73 ? 88 LYS B CB 1 ATOM 7263 N N . GLU B 2 108 ? 29.954 10.330 -17.889 1.00 137.10 ? 89 GLU B N 1 ATOM 7264 C CA . GLU B 2 108 ? 29.442 9.014 -17.524 1.00 139.22 ? 89 GLU B CA 1 ATOM 7265 C C . GLU B 2 108 ? 30.598 8.090 -17.155 1.00 134.24 ? 89 GLU B C 1 ATOM 7266 O O . GLU B 2 108 ? 30.428 7.125 -16.406 1.00 127.57 ? 89 GLU B O 1 ATOM 7267 C CB . GLU B 2 108 ? 28.635 8.413 -18.677 1.00 140.47 ? 89 GLU B CB 1 ATOM 7268 N N . ASP B 2 109 ? 31.773 8.395 -17.695 1.00 129.36 ? 90 ASP B N 1 ATOM 7269 C CA . ASP B 2 109 ? 32.988 7.667 -17.361 1.00 112.52 ? 90 ASP B CA 1 ATOM 7270 C C . ASP B 2 109 ? 34.112 8.649 -17.039 1.00 113.55 ? 90 ASP B C 1 ATOM 7271 O O . ASP B 2 109 ? 34.991 8.883 -17.869 1.00 109.62 ? 90 ASP B O 1 ATOM 7272 C CB . ASP B 2 109 ? 33.399 6.752 -18.517 1.00 107.17 ? 90 ASP B CB 1 ATOM 7273 C CG . ASP B 2 109 ? 34.567 5.851 -18.162 1.00 116.06 ? 90 ASP B CG 1 ATOM 7274 O OD1 . ASP B 2 109 ? 34.650 5.411 -16.995 1.00 114.05 ? 90 ASP B OD1 1 ATOM 7275 O OD2 . ASP B 2 109 ? 35.403 5.584 -19.051 1.00 119.35 ? 90 ASP B OD2 1 ATOM 7276 N N . PRO B 2 110 ? 34.081 9.236 -15.830 1.00 113.15 ? 91 PRO B N 1 ATOM 7277 C CA . PRO B 2 110 ? 35.110 10.188 -15.403 1.00 104.32 ? 91 PRO B CA 1 ATOM 7278 C C . PRO B 2 110 ? 36.327 9.484 -14.808 1.00 116.55 ? 91 PRO B C 1 ATOM 7279 O O . PRO B 2 110 ? 36.208 8.763 -13.816 1.00 129.54 ? 91 PRO B O 1 ATOM 7280 C CB . PRO B 2 110 ? 34.393 11.004 -14.330 1.00 95.23 ? 91 PRO B CB 1 ATOM 7281 C CG . PRO B 2 110 ? 33.428 10.040 -13.721 1.00 97.53 ? 91 PRO B CG 1 ATOM 7282 C CD . PRO B 2 110 ? 33.027 9.071 -14.810 1.00 106.89 ? 91 PRO B CD 1 ATOM 7283 N N . GLN B 2 111 ? 37.492 9.687 -15.411 1.00 116.19 ? 92 GLN B N 1 ATOM 7284 C CA . GLN B 2 111 ? 38.710 9.062 -14.909 1.00 113.95 ? 92 GLN B CA 1 ATOM 7285 C C . GLN B 2 111 ? 39.298 9.903 -13.784 1.00 104.27 ? 92 GLN B C 1 ATOM 7286 O O . GLN B 2 111 ? 40.438 10.364 -13.865 1.00 105.44 ? 92 GLN B O 1 ATOM 7287 C CB . GLN B 2 111 ? 39.741 8.880 -16.028 1.00 122.02 ? 92 GLN B CB 1 ATOM 7288 C CG . GLN B 2 111 ? 39.167 8.842 -17.443 1.00 122.10 ? 92 GLN B CG 1 ATOM 7289 C CD . GLN B 2 111 ? 38.472 7.535 -17.789 1.00 108.65 ? 92 GLN B CD 1 ATOM 7290 O OE1 . GLN B 2 111 ? 37.769 6.945 -16.967 1.00 103.35 ? 92 GLN B OE1 1 ATOM 7291 N NE2 . GLN B 2 111 ? 38.665 7.080 -19.020 1.00 102.12 ? 92 GLN B NE2 1 ATOM 7292 N N . THR B 2 112 ? 38.506 10.105 -12.738 1.00 88.08 ? 93 THR B N 1 ATOM 7293 C CA . THR B 2 112 ? 38.943 10.872 -11.585 1.00 78.50 ? 93 THR B CA 1 ATOM 7294 C C . THR B 2 112 ? 40.051 10.112 -10.868 1.00 73.73 ? 93 THR B C 1 ATOM 7295 O O . THR B 2 112 ? 41.006 10.704 -10.361 1.00 71.13 ? 93 THR B O 1 ATOM 7296 C CB . THR B 2 112 ? 37.780 11.111 -10.612 1.00 81.27 ? 93 THR B CB 1 ATOM 7297 O OG1 . THR B 2 112 ? 36.633 11.569 -11.337 1.00 86.68 ? 93 THR B OG1 1 ATOM 7298 C CG2 . THR B 2 112 ? 38.160 12.145 -9.572 1.00 82.09 ? 93 THR B CG2 1 ATOM 7299 N N . PHE B 2 113 ? 39.916 8.792 -10.833 1.00 70.38 ? 94 PHE B N 1 ATOM 7300 C CA . PHE B 2 113 ? 40.919 7.944 -10.213 1.00 64.94 ? 94 PHE B CA 1 ATOM 7301 C C . PHE B 2 113 ? 41.483 6.978 -11.241 1.00 70.96 ? 94 PHE B C 1 ATOM 7302 O O . PHE B 2 113 ? 40.796 6.607 -12.195 1.00 76.17 ? 94 PHE B O 1 ATOM 7303 C CB . PHE B 2 113 ? 40.306 7.157 -9.056 1.00 51.82 ? 94 PHE B CB 1 ATOM 7304 C CG . PHE B 2 113 ? 39.625 8.015 -8.032 1.00 65.95 ? 94 PHE B CG 1 ATOM 7305 C CD1 . PHE B 2 113 ? 40.317 8.469 -6.922 1.00 76.11 ? 94 PHE B CD1 1 ATOM 7306 C CD2 . PHE B 2 113 ? 38.290 8.361 -8.174 1.00 72.28 ? 94 PHE B CD2 1 ATOM 7307 C CE1 . PHE B 2 113 ? 39.696 9.262 -5.972 1.00 77.32 ? 94 PHE B CE1 1 ATOM 7308 C CE2 . PHE B 2 113 ? 37.660 9.153 -7.229 1.00 79.28 ? 94 PHE B CE2 1 ATOM 7309 C CZ . PHE B 2 113 ? 38.366 9.604 -6.126 1.00 82.41 ? 94 PHE B CZ 1 ATOM 7310 N N . TYR B 2 114 ? 42.740 6.584 -11.062 1.00 60.48 ? 95 TYR B N 1 ATOM 7311 C CA . TYR B 2 114 ? 43.263 5.445 -11.799 1.00 63.14 ? 95 TYR B CA 1 ATOM 7312 C C . TYR B 2 114 ? 43.487 4.271 -10.852 1.00 65.16 ? 95 TYR B C 1 ATOM 7313 O O . TYR B 2 114 ? 43.300 4.398 -9.642 1.00 65.54 ? 95 TYR B O 1 ATOM 7314 C CB . TYR B 2 114 ? 44.534 5.794 -12.571 1.00 76.21 ? 95 TYR B CB 1 ATOM 7315 C CG . TYR B 2 114 ? 45.736 6.121 -11.722 1.00 85.53 ? 95 TYR B CG 1 ATOM 7316 C CD1 . TYR B 2 114 ? 46.625 5.128 -11.332 1.00 91.06 ? 95 TYR B CD1 1 ATOM 7317 C CD2 . TYR B 2 114 ? 45.998 7.426 -11.334 1.00 94.54 ? 95 TYR B CD2 1 ATOM 7318 C CE1 . TYR B 2 114 ? 47.733 5.424 -10.563 1.00 98.06 ? 95 TYR B CE1 1 ATOM 7319 C CE2 . TYR B 2 114 ? 47.104 7.732 -10.568 1.00 105.69 ? 95 TYR B CE2 1 ATOM 7320 C CZ . TYR B 2 114 ? 47.968 6.728 -10.185 1.00 106.95 ? 95 TYR B CZ 1 ATOM 7321 O OH . TYR B 2 114 ? 49.069 7.034 -9.419 1.00 110.37 ? 95 TYR B OH 1 ATOM 7322 N N . TYR B 2 115 ? 43.871 3.129 -11.411 1.00 68.49 ? 96 TYR B N 1 ATOM 7323 C CA . TYR B 2 115 ? 44.056 1.915 -10.627 1.00 57.51 ? 96 TYR B CA 1 ATOM 7324 C C . TYR B 2 115 ? 45.462 1.354 -10.774 1.00 59.66 ? 96 TYR B C 1 ATOM 7325 O O . TYR B 2 115 ? 45.932 1.115 -11.887 1.00 59.32 ? 96 TYR B O 1 ATOM 7326 C CB . TYR B 2 115 ? 43.034 0.852 -11.032 1.00 61.22 ? 96 TYR B CB 1 ATOM 7327 C CG . TYR B 2 115 ? 41.607 1.181 -10.652 1.00 66.76 ? 96 TYR B CG 1 ATOM 7328 C CD1 . TYR B 2 115 ? 40.763 1.843 -11.538 1.00 83.57 ? 96 TYR B CD1 1 ATOM 7329 C CD2 . TYR B 2 115 ? 41.102 0.825 -9.408 1.00 63.24 ? 96 TYR B CD2 1 ATOM 7330 C CE1 . TYR B 2 115 ? 39.453 2.142 -11.192 1.00 86.45 ? 96 TYR B CE1 1 ATOM 7331 C CE2 . TYR B 2 115 ? 39.797 1.117 -9.055 1.00 72.81 ? 96 TYR B CE2 1 ATOM 7332 C CZ . TYR B 2 115 ? 38.977 1.774 -9.949 1.00 82.73 ? 96 TYR B CZ 1 ATOM 7333 O OH . TYR B 2 115 ? 37.680 2.066 -9.595 1.00 81.22 ? 96 TYR B OH 1 ATOM 7334 N N . ALA B 2 116 ? 46.134 1.161 -9.644 1.00 58.99 ? 97 ALA B N 1 ATOM 7335 C CA . ALA B 2 116 ? 47.428 0.498 -9.633 1.00 46.56 ? 97 ALA B CA 1 ATOM 7336 C C . ALA B 2 116 ? 47.152 -0.986 -9.738 1.00 55.71 ? 97 ALA B C 1 ATOM 7337 O O . ALA B 2 116 ? 46.260 -1.507 -9.076 1.00 54.41 ? 97 ALA B O 1 ATOM 7338 C CB . ALA B 2 116 ? 48.181 0.810 -8.364 1.00 44.90 ? 97 ALA B CB 1 ATOM 7339 N N . VAL B 2 117 ? 47.932 -1.664 -10.565 1.00 54.73 ? 98 VAL B N 1 ATOM 7340 C CA . VAL B 2 117 ? 47.580 -2.997 -11.011 1.00 43.18 ? 98 VAL B CA 1 ATOM 7341 C C . VAL B 2 117 ? 48.835 -3.866 -11.165 1.00 52.38 ? 98 VAL B C 1 ATOM 7342 O O . VAL B 2 117 ? 49.921 -3.358 -11.453 1.00 54.79 ? 98 VAL B O 1 ATOM 7343 C CB . VAL B 2 117 ? 46.781 -2.888 -12.342 1.00 46.09 ? 98 VAL B CB 1 ATOM 7344 C CG1 . VAL B 2 117 ? 47.369 -3.761 -13.417 1.00 56.38 ? 98 VAL B CG1 1 ATOM 7345 C CG2 . VAL B 2 117 ? 45.304 -3.184 -12.126 1.00 35.51 ? 98 VAL B CG2 1 ATOM 7346 N N . ALA B 2 118 ? 48.691 -5.170 -10.945 1.00 56.77 ? 99 ALA B N 1 ATOM 7347 C CA . ALA B 2 118 ? 49.798 -6.104 -11.144 1.00 44.02 ? 99 ALA B CA 1 ATOM 7348 C C . ALA B 2 118 ? 49.495 -7.054 -12.300 1.00 51.39 ? 99 ALA B C 1 ATOM 7349 O O . ALA B 2 118 ? 48.655 -7.945 -12.172 1.00 66.92 ? 99 ALA B O 1 ATOM 7350 C CB . ALA B 2 118 ? 50.062 -6.883 -9.875 1.00 38.94 ? 99 ALA B CB 1 ATOM 7351 N N . VAL B 2 119 ? 50.176 -6.868 -13.427 1.00 50.52 ? 100 VAL B N 1 ATOM 7352 C CA . VAL B 2 119 ? 49.892 -7.666 -14.615 1.00 52.55 ? 100 VAL B CA 1 ATOM 7353 C C . VAL B 2 119 ? 50.826 -8.858 -14.733 1.00 50.11 ? 100 VAL B C 1 ATOM 7354 O O . VAL B 2 119 ? 52.038 -8.727 -14.574 1.00 55.38 ? 100 VAL B O 1 ATOM 7355 C CB . VAL B 2 119 ? 49.978 -6.835 -15.905 1.00 52.16 ? 100 VAL B CB 1 ATOM 7356 C CG1 . VAL B 2 119 ? 49.496 -7.652 -17.092 1.00 64.32 ? 100 VAL B CG1 1 ATOM 7357 C CG2 . VAL B 2 119 ? 49.149 -5.595 -15.774 1.00 42.84 ? 100 VAL B CG2 1 ATOM 7358 N N . VAL B 2 120 ? 50.244 -10.020 -15.011 1.00 44.71 ? 101 VAL B N 1 ATOM 7359 C CA . VAL B 2 120 ? 50.994 -11.260 -15.123 1.00 56.66 ? 101 VAL B CA 1 ATOM 7360 C C . VAL B 2 120 ? 50.530 -12.047 -16.342 1.00 57.90 ? 101 VAL B C 1 ATOM 7361 O O . VAL B 2 120 ? 49.441 -11.812 -16.867 1.00 50.33 ? 101 VAL B O 1 ATOM 7362 C CB . VAL B 2 120 ? 50.792 -12.144 -13.877 1.00 55.49 ? 101 VAL B CB 1 ATOM 7363 C CG1 . VAL B 2 120 ? 51.560 -11.590 -12.692 1.00 45.05 ? 101 VAL B CG1 1 ATOM 7364 C CG2 . VAL B 2 120 ? 49.315 -12.255 -13.552 1.00 60.01 ? 101 VAL B CG2 1 ATOM 7365 N N . LYS B 2 121 ? 51.359 -12.986 -16.787 1.00 48.28 ? 102 LYS B N 1 ATOM 7366 C CA . LYS B 2 121 ? 50.965 -13.885 -17.861 1.00 46.58 ? 102 LYS B CA 1 ATOM 7367 C C . LYS B 2 121 ? 49.997 -14.940 -17.333 1.00 48.63 ? 102 LYS B C 1 ATOM 7368 O O . LYS B 2 121 ? 50.109 -15.371 -16.185 1.00 39.41 ? 102 LYS B O 1 ATOM 7369 C CB . LYS B 2 121 ? 52.195 -14.524 -18.509 1.00 43.45 ? 102 LYS B CB 1 ATOM 7370 C CG . LYS B 2 121 ? 52.994 -13.537 -19.337 1.00 60.18 ? 102 LYS B CG 1 ATOM 7371 C CD . LYS B 2 121 ? 54.025 -14.222 -20.199 1.00 63.77 ? 102 LYS B CD 1 ATOM 7372 C CE . LYS B 2 121 ? 54.678 -13.247 -21.168 1.00 69.48 ? 102 LYS B CE 1 ATOM 7373 N NZ . LYS B 2 121 ? 53.699 -12.668 -22.131 1.00 73.63 ? 102 LYS B NZ 1 ATOM 7374 N N . LYS B 2 122 ? 49.037 -15.331 -18.165 1.00 51.29 ? 103 LYS B N 1 ATOM 7375 C CA . LYS B 2 122 ? 48.006 -16.280 -17.756 1.00 49.82 ? 103 LYS B CA 1 ATOM 7376 C C . LYS B 2 122 ? 48.597 -17.618 -17.308 1.00 60.86 ? 103 LYS B C 1 ATOM 7377 O O . LYS B 2 122 ? 49.512 -18.144 -17.942 1.00 59.36 ? 103 LYS B O 1 ATOM 7378 C CB . LYS B 2 122 ? 46.981 -16.482 -18.875 1.00 42.29 ? 103 LYS B CB 1 ATOM 7379 C CG . LYS B 2 122 ? 46.046 -17.665 -18.660 1.00 60.77 ? 103 LYS B CG 1 ATOM 7380 C CD . LYS B 2 122 ? 44.741 -17.519 -19.440 1.00 75.44 ? 103 LYS B CD 1 ATOM 7381 C CE . LYS B 2 122 ? 43.856 -16.434 -18.834 1.00 82.36 ? 103 LYS B CE 1 ATOM 7382 N NZ . LYS B 2 122 ? 42.581 -16.237 -19.582 1.00 82.35 ? 103 LYS B NZ 1 ATOM 7383 N N . ASP B 2 123 ? 48.079 -18.131 -16.192 1.00 68.27 ? 104 ASP B N 1 ATOM 7384 C CA . ASP B 2 123 ? 48.473 -19.423 -15.627 1.00 61.45 ? 104 ASP B CA 1 ATOM 7385 C C . ASP B 2 123 ? 49.949 -19.513 -15.239 1.00 51.70 ? 104 ASP B C 1 ATOM 7386 O O . ASP B 2 123 ? 50.516 -20.602 -15.218 1.00 45.87 ? 104 ASP B O 1 ATOM 7387 C CB . ASP B 2 123 ? 48.110 -20.574 -16.576 1.00 49.76 ? 104 ASP B CB 1 ATOM 7388 C CG . ASP B 2 123 ? 46.609 -20.730 -16.769 1.00 64.64 ? 104 ASP B CG 1 ATOM 7389 O OD1 . ASP B 2 123 ? 45.842 -20.338 -15.862 1.00 76.06 ? 104 ASP B OD1 1 ATOM 7390 O OD2 . ASP B 2 123 ? 46.197 -21.256 -17.828 1.00 65.49 ? 104 ASP B OD2 1 ATOM 7391 N N . SER B 2 124 ? 50.564 -18.377 -14.921 1.00 45.21 ? 105 SER B N 1 ATOM 7392 C CA . SER B 2 124 ? 51.985 -18.356 -14.555 1.00 49.94 ? 105 SER B CA 1 ATOM 7393 C C . SER B 2 124 ? 52.287 -18.996 -13.191 1.00 54.90 ? 105 SER B C 1 ATOM 7394 O O . SER B 2 124 ? 53.448 -19.107 -12.790 1.00 50.23 ? 105 SER B O 1 ATOM 7395 C CB . SER B 2 124 ? 52.548 -16.934 -14.625 1.00 46.30 ? 105 SER B CB 1 ATOM 7396 O OG . SER B 2 124 ? 51.706 -16.016 -13.955 1.00 66.99 ? 105 SER B OG 1 ATOM 7397 N N . GLY B 2 125 ? 51.240 -19.392 -12.475 1.00 53.53 ? 106 GLY B N 1 ATOM 7398 C CA . GLY B 2 125 ? 51.387 -20.266 -11.324 1.00 60.54 ? 106 GLY B CA 1 ATOM 7399 C C . GLY B 2 125 ? 51.693 -19.657 -9.969 1.00 62.75 ? 106 GLY B C 1 ATOM 7400 O O . GLY B 2 125 ? 52.054 -20.379 -9.040 1.00 67.93 ? 106 GLY B O 1 ATOM 7401 N N . PHE B 2 126 ? 51.551 -18.344 -9.832 1.00 53.21 ? 107 PHE B N 1 ATOM 7402 C CA . PHE B 2 126 ? 51.843 -17.715 -8.549 1.00 36.78 ? 107 PHE B CA 1 ATOM 7403 C C . PHE B 2 126 ? 50.830 -16.642 -8.180 1.00 52.06 ? 107 PHE B C 1 ATOM 7404 O O . PHE B 2 126 ? 50.209 -16.032 -9.050 1.00 55.45 ? 107 PHE B O 1 ATOM 7405 C CB . PHE B 2 126 ? 53.267 -17.147 -8.523 1.00 44.81 ? 107 PHE B CB 1 ATOM 7406 C CG . PHE B 2 126 ? 53.474 -15.955 -9.424 1.00 52.05 ? 107 PHE B CG 1 ATOM 7407 C CD1 . PHE B 2 126 ? 53.318 -14.667 -8.939 1.00 60.85 ? 107 PHE B CD1 1 ATOM 7408 C CD2 . PHE B 2 126 ? 53.839 -16.125 -10.748 1.00 42.29 ? 107 PHE B CD2 1 ATOM 7409 C CE1 . PHE B 2 126 ? 53.511 -13.575 -9.761 1.00 70.42 ? 107 PHE B CE1 1 ATOM 7410 C CE2 . PHE B 2 126 ? 54.037 -15.038 -11.573 1.00 48.82 ? 107 PHE B CE2 1 ATOM 7411 C CZ . PHE B 2 126 ? 53.873 -13.763 -11.081 1.00 67.39 ? 107 PHE B CZ 1 ATOM 7412 N N . GLN B 2 127 ? 50.675 -16.414 -6.881 1.00 58.27 ? 108 GLN B N 1 ATOM 7413 C CA . GLN B 2 127 ? 49.769 -15.386 -6.394 1.00 53.48 ? 108 GLN B CA 1 ATOM 7414 C C . GLN B 2 127 ? 50.527 -14.239 -5.742 1.00 55.47 ? 108 GLN B C 1 ATOM 7415 O O . GLN B 2 127 ? 51.751 -14.281 -5.624 1.00 53.61 ? 108 GLN B O 1 ATOM 7416 C CB . GLN B 2 127 ? 48.767 -15.983 -5.412 1.00 43.15 ? 108 GLN B CB 1 ATOM 7417 C CG . GLN B 2 127 ? 47.920 -17.076 -6.011 1.00 42.03 ? 108 GLN B CG 1 ATOM 7418 C CD . GLN B 2 127 ? 46.951 -16.551 -7.046 1.00 61.48 ? 108 GLN B CD 1 ATOM 7419 O OE1 . GLN B 2 127 ? 46.637 -15.362 -7.068 1.00 73.44 ? 108 GLN B OE1 1 ATOM 7420 N NE2 . GLN B 2 127 ? 46.473 -17.434 -7.914 1.00 58.80 ? 108 GLN B NE2 1 ATOM 7421 N N . MET B 2 128 ? 49.780 -13.225 -5.317 1.00 52.91 ? 109 MET B N 1 ATOM 7422 C CA . MET B 2 128 ? 50.342 -12.008 -4.741 1.00 53.06 ? 109 MET B CA 1 ATOM 7423 C C . MET B 2 128 ? 51.283 -12.274 -3.570 1.00 57.35 ? 109 MET B C 1 ATOM 7424 O O . MET B 2 128 ? 52.269 -11.561 -3.384 1.00 60.02 ? 109 MET B O 1 ATOM 7425 C CB . MET B 2 128 ? 49.220 -11.078 -4.284 1.00 53.77 ? 109 MET B CB 1 ATOM 7426 C CG . MET B 2 128 ? 49.667 -9.658 -4.027 1.00 45.79 ? 109 MET B CG 1 ATOM 7427 S SD . MET B 2 128 ? 49.678 -8.657 -5.522 1.00 71.04 ? 109 MET B SD 1 ATOM 7428 C CE . MET B 2 128 ? 50.918 -7.445 -5.067 1.00 107.27 ? 109 MET B CE 1 ATOM 7429 N N . ASN B 2 129 ? 50.977 -13.296 -2.778 1.00 38.91 ? 110 ASN B N 1 ATOM 7430 C CA . ASN B 2 129 ? 51.822 -13.626 -1.638 1.00 52.25 ? 110 ASN B CA 1 ATOM 7431 C C . ASN B 2 129 ? 52.975 -14.559 -2.004 1.00 56.73 ? 110 ASN B C 1 ATOM 7432 O O . ASN B 2 129 ? 53.669 -15.079 -1.130 1.00 60.37 ? 110 ASN B O 1 ATOM 7433 C CB . ASN B 2 129 ? 50.990 -14.212 -0.496 1.00 53.44 ? 110 ASN B CB 1 ATOM 7434 C CG . ASN B 2 129 ? 50.294 -15.497 -0.882 1.00 60.09 ? 110 ASN B CG 1 ATOM 7435 O OD1 . ASN B 2 129 ? 50.213 -15.847 -2.059 1.00 66.14 ? 110 ASN B OD1 1 ATOM 7436 N ND2 . ASN B 2 129 ? 49.772 -16.202 0.110 1.00 64.09 ? 110 ASN B ND2 1 ATOM 7437 N N . GLN B 2 130 ? 53.178 -14.763 -3.301 1.00 58.87 ? 111 GLN B N 1 ATOM 7438 C CA . GLN B 2 130 ? 54.267 -15.608 -3.773 1.00 61.23 ? 111 GLN B CA 1 ATOM 7439 C C . GLN B 2 130 ? 55.182 -14.823 -4.692 1.00 58.63 ? 111 GLN B C 1 ATOM 7440 O O . GLN B 2 130 ? 55.810 -15.388 -5.584 1.00 59.46 ? 111 GLN B O 1 ATOM 7441 C CB . GLN B 2 130 ? 53.728 -16.830 -4.516 1.00 46.22 ? 111 GLN B CB 1 ATOM 7442 C CG . GLN B 2 130 ? 52.868 -17.754 -3.679 1.00 40.20 ? 111 GLN B CG 1 ATOM 7443 C CD . GLN B 2 130 ? 52.220 -18.838 -4.517 1.00 52.40 ? 111 GLN B CD 1 ATOM 7444 O OE1 . GLN B 2 130 ? 51.311 -18.568 -5.302 1.00 52.29 ? 111 GLN B OE1 1 ATOM 7445 N NE2 . GLN B 2 130 ? 52.695 -20.072 -4.366 1.00 45.63 ? 111 GLN B NE2 1 ATOM 7446 N N . LEU B 2 131 ? 55.252 -13.516 -4.477 1.00 51.21 ? 112 LEU B N 1 ATOM 7447 C CA . LEU B 2 131 ? 56.076 -12.666 -5.321 1.00 49.17 ? 112 LEU B CA 1 ATOM 7448 C C . LEU B 2 131 ? 57.559 -12.830 -5.029 1.00 47.73 ? 112 LEU B C 1 ATOM 7449 O O . LEU B 2 131 ? 58.395 -12.518 -5.874 1.00 62.43 ? 112 LEU B O 1 ATOM 7450 C CB . LEU B 2 131 ? 55.675 -11.198 -5.175 1.00 49.37 ? 112 LEU B CB 1 ATOM 7451 C CG . LEU B 2 131 ? 54.376 -10.785 -5.866 1.00 51.31 ? 112 LEU B CG 1 ATOM 7452 C CD1 . LEU B 2 131 ? 54.118 -9.308 -5.644 1.00 48.94 ? 112 LEU B CD1 1 ATOM 7453 C CD2 . LEU B 2 131 ? 54.420 -11.111 -7.352 1.00 48.67 ? 112 LEU B CD2 1 ATOM 7454 N N . ARG B 2 132 ? 57.888 -13.314 -3.837 1.00 51.62 ? 113 ARG B N 1 ATOM 7455 C CA . ARG B 2 132 ? 59.290 -13.453 -3.458 1.00 65.77 ? 113 ARG B CA 1 ATOM 7456 C C . ARG B 2 132 ? 60.017 -14.405 -4.401 1.00 64.95 ? 113 ARG B C 1 ATOM 7457 O O . ARG B 2 132 ? 59.534 -15.500 -4.686 1.00 64.12 ? 113 ARG B O 1 ATOM 7458 C CB . ARG B 2 132 ? 59.435 -13.923 -2.010 1.00 56.90 ? 113 ARG B CB 1 ATOM 7459 C CG . ARG B 2 132 ? 60.885 -14.036 -1.558 1.00 62.98 ? 113 ARG B CG 1 ATOM 7460 C CD . ARG B 2 132 ? 61.010 -14.482 -0.107 1.00 74.97 ? 113 ARG B CD 1 ATOM 7461 N NE . ARG B 2 132 ? 60.701 -13.410 0.838 1.00 86.59 ? 113 ARG B NE 1 ATOM 7462 C CZ . ARG B 2 132 ? 59.614 -13.374 1.605 1.00 89.28 ? 113 ARG B CZ 1 ATOM 7463 N NH1 . ARG B 2 132 ? 58.722 -14.357 1.549 1.00 78.85 ? 113 ARG B NH1 1 ATOM 7464 N NH2 . ARG B 2 132 ? 59.420 -12.357 2.434 1.00 90.15 ? 113 ARG B NH2 1 ATOM 7465 N N . GLY B 2 133 ? 61.168 -13.967 -4.901 1.00 56.48 ? 114 GLY B N 1 ATOM 7466 C CA . GLY B 2 133 ? 61.970 -14.780 -5.792 1.00 65.37 ? 114 GLY B CA 1 ATOM 7467 C C . GLY B 2 133 ? 61.553 -14.688 -7.247 1.00 68.11 ? 114 GLY B C 1 ATOM 7468 O O . GLY B 2 133 ? 62.158 -15.319 -8.111 1.00 74.22 ? 114 GLY B O 1 ATOM 7469 N N . LYS B 2 134 ? 60.515 -13.910 -7.525 1.00 60.56 ? 115 LYS B N 1 ATOM 7470 C CA . LYS B 2 134 ? 60.070 -13.712 -8.898 1.00 49.74 ? 115 LYS B CA 1 ATOM 7471 C C . LYS B 2 134 ? 60.757 -12.481 -9.476 1.00 55.85 ? 115 LYS B C 1 ATOM 7472 O O . LYS B 2 134 ? 61.455 -11.768 -8.758 1.00 64.98 ? 115 LYS B O 1 ATOM 7473 C CB . LYS B 2 134 ? 58.553 -13.561 -8.948 1.00 46.05 ? 115 LYS B CB 1 ATOM 7474 C CG . LYS B 2 134 ? 57.804 -14.723 -8.314 1.00 55.57 ? 115 LYS B CG 1 ATOM 7475 C CD . LYS B 2 134 ? 57.667 -15.896 -9.274 1.00 60.26 ? 115 LYS B CD 1 ATOM 7476 C CE . LYS B 2 134 ? 57.524 -17.210 -8.530 1.00 66.63 ? 115 LYS B CE 1 ATOM 7477 N NZ . LYS B 2 134 ? 56.534 -17.125 -7.421 1.00 67.89 ? 115 LYS B NZ 1 ATOM 7478 N N . LYS B 2 135 ? 60.570 -12.237 -10.770 1.00 65.37 ? 116 LYS B N 1 ATOM 7479 C CA . LYS B 2 135 ? 61.213 -11.106 -11.437 1.00 71.04 ? 116 LYS B CA 1 ATOM 7480 C C . LYS B 2 135 ? 60.194 -10.014 -11.760 1.00 67.13 ? 116 LYS B C 1 ATOM 7481 O O . LYS B 2 135 ? 59.116 -10.302 -12.278 1.00 76.38 ? 116 LYS B O 1 ATOM 7482 C CB . LYS B 2 135 ? 61.928 -11.571 -12.706 1.00 76.58 ? 116 LYS B CB 1 ATOM 7483 C CG . LYS B 2 135 ? 62.973 -12.654 -12.471 1.00 74.34 ? 116 LYS B CG 1 ATOM 7484 C CD . LYS B 2 135 ? 63.582 -13.134 -13.781 1.00 81.46 ? 116 LYS B CD 1 ATOM 7485 C CE . LYS B 2 135 ? 64.374 -14.425 -13.599 1.00 88.21 ? 116 LYS B CE 1 ATOM 7486 N NZ . LYS B 2 135 ? 65.545 -14.264 -12.691 1.00 94.81 ? 116 LYS B NZ 1 ATOM 7487 N N . SER B 2 136 ? 60.540 -8.764 -11.459 1.00 60.99 ? 117 SER B N 1 ATOM 7488 C CA . SER B 2 136 ? 59.573 -7.665 -11.519 1.00 69.90 ? 117 SER B CA 1 ATOM 7489 C C . SER B 2 136 ? 59.892 -6.596 -12.561 1.00 69.42 ? 117 SER B C 1 ATOM 7490 O O . SER B 2 136 ? 61.051 -6.353 -12.886 1.00 78.53 ? 117 SER B O 1 ATOM 7491 C CB . SER B 2 136 ? 59.453 -6.996 -10.150 1.00 71.57 ? 117 SER B CB 1 ATOM 7492 O OG . SER B 2 136 ? 60.645 -6.302 -9.828 1.00 77.03 ? 117 SER B OG 1 ATOM 7493 N N . CYS B 2 137 ? 58.845 -5.946 -13.060 1.00 57.92 ? 118 CYS B N 1 ATOM 7494 C CA . CYS B 2 137 ? 58.981 -4.865 -14.027 1.00 57.98 ? 118 CYS B CA 1 ATOM 7495 C C . CYS B 2 137 ? 58.267 -3.613 -13.517 1.00 55.94 ? 118 CYS B C 1 ATOM 7496 O O . CYS B 2 137 ? 57.052 -3.620 -13.338 1.00 57.42 ? 118 CYS B O 1 ATOM 7497 C CB . CYS B 2 137 ? 58.383 -5.284 -15.375 1.00 72.17 ? 118 CYS B CB 1 ATOM 7498 S SG . CYS B 2 137 ? 59.106 -6.773 -16.126 1.00 70.80 ? 118 CYS B SG 1 ATOM 7499 N N . HIS B 2 138 ? 59.018 -2.538 -13.293 1.00 64.65 ? 119 HIS B N 1 ATOM 7500 C CA . HIS B 2 138 ? 58.451 -1.296 -12.766 1.00 63.05 ? 119 HIS B CA 1 ATOM 7501 C C . HIS B 2 138 ? 58.498 -0.159 -13.790 1.00 71.04 ? 119 HIS B C 1 ATOM 7502 O O . HIS B 2 138 ? 59.328 -0.170 -14.698 1.00 72.99 ? 119 HIS B O 1 ATOM 7503 C CB . HIS B 2 138 ? 59.193 -0.873 -11.496 1.00 66.65 ? 119 HIS B CB 1 ATOM 7504 C CG . HIS B 2 138 ? 59.336 -1.966 -10.483 1.00 69.10 ? 119 HIS B CG 1 ATOM 7505 N ND1 . HIS B 2 138 ? 58.482 -2.104 -9.410 1.00 68.03 ? 119 HIS B ND1 1 ATOM 7506 C CD2 . HIS B 2 138 ? 60.237 -2.972 -10.379 1.00 63.26 ? 119 HIS B CD2 1 ATOM 7507 C CE1 . HIS B 2 138 ? 58.849 -3.149 -8.689 1.00 63.03 ? 119 HIS B CE1 1 ATOM 7508 N NE2 . HIS B 2 138 ? 59.912 -3.692 -9.255 1.00 64.10 ? 119 HIS B NE2 1 ATOM 7509 N N . THR B 2 139 ? 57.612 0.824 -13.634 1.00 68.21 ? 120 THR B N 1 ATOM 7510 C CA . THR B 2 139 ? 57.574 1.964 -14.549 1.00 65.01 ? 120 THR B CA 1 ATOM 7511 C C . THR B 2 139 ? 58.746 2.903 -14.304 1.00 73.89 ? 120 THR B C 1 ATOM 7512 O O . THR B 2 139 ? 59.216 3.579 -15.218 1.00 72.33 ? 120 THR B O 1 ATOM 7513 C CB . THR B 2 139 ? 56.258 2.766 -14.438 1.00 63.25 ? 120 THR B CB 1 ATOM 7514 O OG1 . THR B 2 139 ? 56.042 3.169 -13.080 1.00 73.89 ? 120 THR B OG1 1 ATOM 7515 C CG2 . THR B 2 139 ? 55.083 1.935 -14.909 1.00 55.69 ? 120 THR B CG2 1 ATOM 7516 N N . GLY B 2 140 ? 59.214 2.937 -13.062 1.00 70.26 ? 121 GLY B N 1 ATOM 7517 C CA . GLY B 2 140 ? 60.344 3.767 -12.697 1.00 66.81 ? 121 GLY B CA 1 ATOM 7518 C C . GLY B 2 140 ? 60.404 3.936 -11.198 1.00 72.12 ? 121 GLY B C 1 ATOM 7519 O O . GLY B 2 140 ? 59.372 3.925 -10.525 1.00 70.10 ? 121 GLY B O 1 ATOM 7520 N N . LEU B 2 141 ? 61.614 4.086 -10.674 1.00 80.33 ? 122 LEU B N 1 ATOM 7521 C CA . LEU B 2 141 ? 61.815 4.297 -9.247 1.00 81.22 ? 122 LEU B CA 1 ATOM 7522 C C . LEU B 2 141 ? 61.082 5.545 -8.770 1.00 81.33 ? 122 LEU B C 1 ATOM 7523 O O . LEU B 2 141 ? 61.170 6.602 -9.394 1.00 72.97 ? 122 LEU B O 1 ATOM 7524 C CB . LEU B 2 141 ? 63.308 4.416 -8.941 1.00 83.91 ? 122 LEU B CB 1 ATOM 7525 C CG . LEU B 2 141 ? 63.715 4.874 -7.541 1.00 87.55 ? 122 LEU B CG 1 ATOM 7526 C CD1 . LEU B 2 141 ? 63.184 3.927 -6.482 1.00 90.76 ? 122 LEU B CD1 1 ATOM 7527 C CD2 . LEU B 2 141 ? 65.227 4.986 -7.448 1.00 95.16 ? 122 LEU B CD2 1 ATOM 7528 N N . GLY B 2 142 ? 60.345 5.409 -7.672 1.00 88.31 ? 123 GLY B N 1 ATOM 7529 C CA . GLY B 2 142 ? 59.659 6.536 -7.065 1.00 89.14 ? 123 GLY B CA 1 ATOM 7530 C C . GLY B 2 142 ? 58.302 6.861 -7.665 1.00 80.47 ? 123 GLY B C 1 ATOM 7531 O O . GLY B 2 142 ? 57.565 7.690 -7.128 1.00 75.77 ? 123 GLY B O 1 ATOM 7532 N N . ARG B 2 143 ? 57.969 6.222 -8.782 1.00 68.79 ? 124 ARG B N 1 ATOM 7533 C CA . ARG B 2 143 ? 56.668 6.443 -9.403 1.00 69.68 ? 124 ARG B CA 1 ATOM 7534 C C . ARG B 2 143 ? 55.551 5.763 -8.607 1.00 71.27 ? 124 ARG B C 1 ATOM 7535 O O . ARG B 2 143 ? 55.800 4.848 -7.824 1.00 60.30 ? 124 ARG B O 1 ATOM 7536 C CB . ARG B 2 143 ? 56.681 6.016 -10.873 1.00 78.27 ? 124 ARG B CB 1 ATOM 7537 C CG . ARG B 2 143 ? 57.449 6.992 -11.755 1.00 90.05 ? 124 ARG B CG 1 ATOM 7538 C CD . ARG B 2 143 ? 57.627 6.499 -13.182 1.00 106.74 ? 124 ARG B CD 1 ATOM 7539 N NE . ARG B 2 143 ? 56.375 6.475 -13.931 1.00 115.80 ? 124 ARG B NE 1 ATOM 7540 C CZ . ARG B 2 143 ? 56.302 6.562 -15.256 1.00 119.25 ? 124 ARG B CZ 1 ATOM 7541 N NH1 . ARG B 2 143 ? 57.409 6.692 -15.974 1.00 124.17 ? 124 ARG B NH1 1 ATOM 7542 N NH2 . ARG B 2 143 ? 55.123 6.527 -15.863 1.00 116.85 ? 124 ARG B NH2 1 ATOM 7543 N N . SER B 2 144 ? 54.325 6.234 -8.798 1.00 77.55 ? 125 SER B N 1 ATOM 7544 C CA . SER B 2 144 ? 53.204 5.834 -7.953 1.00 78.36 ? 125 SER B CA 1 ATOM 7545 C C . SER B 2 144 ? 52.770 4.384 -8.165 1.00 76.26 ? 125 SER B C 1 ATOM 7546 O O . SER B 2 144 ? 52.938 3.539 -7.280 1.00 72.60 ? 125 SER B O 1 ATOM 7547 C CB . SER B 2 144 ? 52.022 6.782 -8.173 1.00 86.56 ? 125 SER B CB 1 ATOM 7548 O OG . SER B 2 144 ? 50.900 6.402 -7.398 1.00 100.09 ? 125 SER B OG 1 ATOM 7549 N N . ALA B 2 145 ? 52.210 4.102 -9.337 1.00 67.57 ? 126 ALA B N 1 ATOM 7550 C CA . ALA B 2 145 ? 51.685 2.776 -9.637 1.00 51.49 ? 126 ALA B CA 1 ATOM 7551 C C . ALA B 2 145 ? 52.789 1.742 -9.867 1.00 54.13 ? 126 ALA B C 1 ATOM 7552 O O . ALA B 2 145 ? 52.621 0.561 -9.556 1.00 58.19 ? 126 ALA B O 1 ATOM 7553 C CB . ALA B 2 145 ? 50.757 2.842 -10.832 1.00 51.48 ? 126 ALA B CB 1 ATOM 7554 N N . GLY B 2 146 ? 53.921 2.190 -10.398 1.00 53.99 ? 127 GLY B N 1 ATOM 7555 C CA . GLY B 2 146 ? 55.020 1.296 -10.711 1.00 52.91 ? 127 GLY B CA 1 ATOM 7556 C C . GLY B 2 146 ? 56.007 1.040 -9.585 1.00 55.12 ? 127 GLY B C 1 ATOM 7557 O O . GLY B 2 146 ? 56.782 0.087 -9.649 1.00 60.16 ? 127 GLY B O 1 ATOM 7558 N N . TRP B 2 147 ? 55.994 1.882 -8.556 1.00 60.62 ? 128 TRP B N 1 ATOM 7559 C CA . TRP B 2 147 ? 56.956 1.731 -7.464 1.00 64.83 ? 128 TRP B CA 1 ATOM 7560 C C . TRP B 2 147 ? 56.377 1.880 -6.057 1.00 60.84 ? 128 TRP B C 1 ATOM 7561 O O . TRP B 2 147 ? 56.320 0.910 -5.306 1.00 62.62 ? 128 TRP B O 1 ATOM 7562 C CB . TRP B 2 147 ? 58.146 2.679 -7.634 1.00 62.50 ? 128 TRP B CB 1 ATOM 7563 C CG . TRP B 2 147 ? 59.191 2.455 -6.595 1.00 67.78 ? 128 TRP B CG 1 ATOM 7564 C CD1 . TRP B 2 147 ? 59.341 3.134 -5.423 1.00 84.99 ? 128 TRP B CD1 1 ATOM 7565 C CD2 . TRP B 2 147 ? 60.223 1.460 -6.617 1.00 72.43 ? 128 TRP B CD2 1 ATOM 7566 N NE1 . TRP B 2 147 ? 60.409 2.633 -4.719 1.00 94.22 ? 128 TRP B NE1 1 ATOM 7567 C CE2 . TRP B 2 147 ? 60.965 1.602 -5.430 1.00 84.44 ? 128 TRP B CE2 1 ATOM 7568 C CE3 . TRP B 2 147 ? 60.593 0.467 -7.528 1.00 67.47 ? 128 TRP B CE3 1 ATOM 7569 C CZ2 . TRP B 2 147 ? 62.055 0.790 -5.130 1.00 77.73 ? 128 TRP B CZ2 1 ATOM 7570 C CZ3 . TRP B 2 147 ? 61.675 -0.338 -7.229 1.00 63.52 ? 128 TRP B CZ3 1 ATOM 7571 C CH2 . TRP B 2 147 ? 62.392 -0.172 -6.040 1.00 68.87 ? 128 TRP B CH2 1 ATOM 7572 N N . ASN B 2 148 ? 55.971 3.096 -5.703 1.00 63.04 ? 129 ASN B N 1 ATOM 7573 C CA . ASN B 2 148 ? 55.520 3.397 -4.343 1.00 58.62 ? 129 ASN B CA 1 ATOM 7574 C C . ASN B 2 148 ? 54.432 2.469 -3.810 1.00 64.66 ? 129 ASN B C 1 ATOM 7575 O O . ASN B 2 148 ? 54.565 1.911 -2.722 1.00 75.98 ? 129 ASN B O 1 ATOM 7576 C CB . ASN B 2 148 ? 55.046 4.846 -4.239 1.00 61.84 ? 129 ASN B CB 1 ATOM 7577 C CG . ASN B 2 148 ? 56.152 5.843 -4.512 1.00 62.79 ? 129 ASN B CG 1 ATOM 7578 O OD1 . ASN B 2 148 ? 57.332 5.498 -4.484 1.00 53.97 ? 129 ASN B OD1 1 ATOM 7579 N ND2 . ASN B 2 148 ? 55.774 7.092 -4.766 1.00 66.53 ? 129 ASN B ND2 1 ATOM 7580 N N . ILE B 2 149 ? 53.359 2.308 -4.577 1.00 50.57 ? 130 ILE B N 1 ATOM 7581 C CA . ILE B 2 149 ? 52.237 1.474 -4.151 1.00 46.73 ? 130 ILE B CA 1 ATOM 7582 C C . ILE B 2 149 ? 52.596 -0.006 -3.947 1.00 59.71 ? 130 ILE B C 1 ATOM 7583 O O . ILE B 2 149 ? 52.354 -0.544 -2.864 1.00 66.55 ? 130 ILE B O 1 ATOM 7584 C CB . ILE B 2 149 ? 51.017 1.617 -5.090 1.00 50.70 ? 130 ILE B CB 1 ATOM 7585 C CG1 . ILE B 2 149 ? 50.500 3.055 -5.078 1.00 53.73 ? 130 ILE B CG1 1 ATOM 7586 C CG2 . ILE B 2 149 ? 49.918 0.660 -4.680 1.00 55.61 ? 130 ILE B CG2 1 ATOM 7587 C CD1 . ILE B 2 149 ? 49.595 3.381 -6.237 1.00 42.67 ? 130 ILE B CD1 1 ATOM 7588 N N . PRO B 2 150 ? 53.178 -0.671 -4.971 1.00 55.74 ? 131 PRO B N 1 ATOM 7589 C CA . PRO B 2 150 ? 53.490 -2.089 -4.747 1.00 57.33 ? 131 PRO B CA 1 ATOM 7590 C C . PRO B 2 150 ? 54.589 -2.320 -3.707 1.00 59.04 ? 131 PRO B C 1 ATOM 7591 O O . PRO B 2 150 ? 54.467 -3.249 -2.907 1.00 61.50 ? 131 PRO B O 1 ATOM 7592 C CB . PRO B 2 150 ? 53.945 -2.575 -6.129 1.00 49.71 ? 131 PRO B CB 1 ATOM 7593 C CG . PRO B 2 150 ? 54.424 -1.359 -6.815 1.00 45.73 ? 131 PRO B CG 1 ATOM 7594 C CD . PRO B 2 150 ? 53.528 -0.254 -6.342 1.00 53.12 ? 131 PRO B CD 1 ATOM 7595 N N . ILE B 2 151 ? 55.637 -1.502 -3.716 1.00 47.00 ? 132 ILE B N 1 ATOM 7596 C CA . ILE B 2 151 ? 56.707 -1.653 -2.733 1.00 52.04 ? 132 ILE B CA 1 ATOM 7597 C C . ILE B 2 151 ? 56.211 -1.297 -1.339 1.00 58.49 ? 132 ILE B C 1 ATOM 7598 O O . ILE B 2 151 ? 56.596 -1.926 -0.353 1.00 60.70 ? 132 ILE B O 1 ATOM 7599 C CB . ILE B 2 151 ? 57.939 -0.798 -3.073 1.00 54.29 ? 132 ILE B CB 1 ATOM 7600 C CG1 . ILE B 2 151 ? 58.509 -1.216 -4.428 1.00 54.36 ? 132 ILE B CG1 1 ATOM 7601 C CG2 . ILE B 2 151 ? 58.997 -0.940 -1.994 1.00 55.54 ? 132 ILE B CG2 1 ATOM 7602 C CD1 . ILE B 2 151 ? 58.752 -2.700 -4.546 1.00 55.17 ? 132 ILE B CD1 1 ATOM 7603 N N . GLY B 2 152 ? 55.345 -0.292 -1.263 1.00 64.38 ? 133 GLY B N 1 ATOM 7604 C CA . GLY B 2 152 ? 54.756 0.099 0.002 1.00 61.77 ? 133 GLY B CA 1 ATOM 7605 C C . GLY B 2 152 ? 53.903 -1.018 0.568 1.00 59.04 ? 133 GLY B C 1 ATOM 7606 O O . GLY B 2 152 ? 53.948 -1.310 1.762 1.00 63.61 ? 133 GLY B O 1 ATOM 7607 N N . LEU B 2 153 ? 53.127 -1.653 -0.300 1.00 54.01 ? 134 LEU B N 1 ATOM 7608 C CA . LEU B 2 153 ? 52.266 -2.748 0.120 1.00 53.23 ? 134 LEU B CA 1 ATOM 7609 C C . LEU B 2 153 ? 53.078 -3.984 0.506 1.00 59.45 ? 134 LEU B C 1 ATOM 7610 O O . LEU B 2 153 ? 52.623 -4.813 1.292 1.00 56.03 ? 134 LEU B O 1 ATOM 7611 C CB . LEU B 2 153 ? 51.254 -3.078 -0.978 1.00 52.82 ? 134 LEU B CB 1 ATOM 7612 C CG . LEU B 2 153 ? 49.801 -2.656 -0.732 1.00 56.98 ? 134 LEU B CG 1 ATOM 7613 C CD1 . LEU B 2 153 ? 49.666 -1.819 0.532 1.00 45.45 ? 134 LEU B CD1 1 ATOM 7614 C CD2 . LEU B 2 153 ? 49.239 -1.909 -1.931 1.00 61.41 ? 134 LEU B CD2 1 ATOM 7615 N N . LEU B 2 154 ? 54.287 -4.091 -0.038 1.00 65.75 ? 135 LEU B N 1 ATOM 7616 C CA . LEU B 2 154 ? 55.157 -5.237 0.213 1.00 68.24 ? 135 LEU B CA 1 ATOM 7617 C C . LEU B 2 154 ? 56.158 -4.973 1.330 1.00 76.28 ? 135 LEU B C 1 ATOM 7618 O O . LEU B 2 154 ? 56.903 -5.871 1.714 1.00 82.82 ? 135 LEU B O 1 ATOM 7619 C CB . LEU B 2 154 ? 55.932 -5.604 -1.057 1.00 58.38 ? 135 LEU B CB 1 ATOM 7620 C CG . LEU B 2 154 ? 55.244 -6.454 -2.123 1.00 70.26 ? 135 LEU B CG 1 ATOM 7621 C CD1 . LEU B 2 154 ? 56.104 -6.538 -3.377 1.00 63.93 ? 135 LEU B CD1 1 ATOM 7622 C CD2 . LEU B 2 154 ? 54.956 -7.841 -1.576 1.00 76.70 ? 135 LEU B CD2 1 ATOM 7623 N N . TYR B 2 155 ? 56.168 -3.745 1.843 1.00 72.68 ? 136 TYR B N 1 ATOM 7624 C CA . TYR B 2 155 ? 57.250 -3.267 2.711 1.00 73.48 ? 136 TYR B CA 1 ATOM 7625 C C . TYR B 2 155 ? 57.647 -4.203 3.853 1.00 81.72 ? 136 TYR B C 1 ATOM 7626 O O . TYR B 2 155 ? 58.833 -4.397 4.110 1.00 84.76 ? 136 TYR B O 1 ATOM 7627 C CB . TYR B 2 155 ? 56.937 -1.874 3.266 1.00 62.88 ? 136 TYR B CB 1 ATOM 7628 C CG . TYR B 2 155 ? 58.123 -1.230 3.946 1.00 71.83 ? 136 TYR B CG 1 ATOM 7629 C CD1 . TYR B 2 155 ? 59.106 -0.584 3.204 1.00 65.71 ? 136 TYR B CD1 1 ATOM 7630 C CD2 . TYR B 2 155 ? 58.267 -1.275 5.327 1.00 81.30 ? 136 TYR B CD2 1 ATOM 7631 C CE1 . TYR B 2 155 ? 60.197 0.000 3.819 1.00 65.62 ? 136 TYR B CE1 1 ATOM 7632 C CE2 . TYR B 2 155 ? 59.355 -0.691 5.951 1.00 79.27 ? 136 TYR B CE2 1 ATOM 7633 C CZ . TYR B 2 155 ? 60.316 -0.057 5.192 1.00 70.53 ? 136 TYR B CZ 1 ATOM 7634 O OH . TYR B 2 155 ? 61.399 0.524 5.808 1.00 72.30 ? 136 TYR B OH 1 ATOM 7635 N N . CYS B 2 156 ? 56.662 -4.784 4.529 1.00 82.47 ? 137 CYS B N 1 ATOM 7636 C CA . CYS B 2 156 ? 56.938 -5.646 5.675 1.00 81.85 ? 137 CYS B CA 1 ATOM 7637 C C . CYS B 2 156 ? 57.526 -6.997 5.271 1.00 86.94 ? 137 CYS B C 1 ATOM 7638 O O . CYS B 2 156 ? 58.372 -7.545 5.979 1.00 91.17 ? 137 CYS B O 1 ATOM 7639 C CB . CYS B 2 156 ? 55.680 -5.838 6.528 1.00 82.47 ? 137 CYS B CB 1 ATOM 7640 S SG . CYS B 2 156 ? 55.134 -4.346 7.403 1.00 155.67 ? 137 CYS B SG 1 ATOM 7641 N N . ASP B 2 157 ? 57.078 -7.528 4.136 1.00 82.73 ? 138 ASP B N 1 ATOM 7642 C CA . ASP B 2 157 ? 57.560 -8.819 3.647 1.00 79.54 ? 138 ASP B CA 1 ATOM 7643 C C . ASP B 2 157 ? 59.002 -8.734 3.147 1.00 72.36 ? 138 ASP B C 1 ATOM 7644 O O . ASP B 2 157 ? 59.659 -9.752 2.942 1.00 75.39 ? 138 ASP B O 1 ATOM 7645 C CB . ASP B 2 157 ? 56.657 -9.358 2.530 1.00 80.46 ? 138 ASP B CB 1 ATOM 7646 C CG . ASP B 2 157 ? 55.198 -9.466 2.949 1.00 85.45 ? 138 ASP B CG 1 ATOM 7647 O OD1 . ASP B 2 157 ? 54.913 -9.347 4.159 1.00 85.08 ? 138 ASP B OD1 1 ATOM 7648 O OD2 . ASP B 2 157 ? 54.338 -9.678 2.063 1.00 83.23 ? 138 ASP B OD2 1 ATOM 7649 N N . LEU B 2 158 ? 59.488 -7.516 2.945 1.00 63.72 ? 139 LEU B N 1 ATOM 7650 C CA . LEU B 2 158 ? 60.848 -7.302 2.465 1.00 72.40 ? 139 LEU B CA 1 ATOM 7651 C C . LEU B 2 158 ? 61.873 -7.797 3.485 1.00 86.54 ? 139 LEU B C 1 ATOM 7652 O O . LEU B 2 158 ? 61.584 -7.856 4.680 1.00 96.90 ? 139 LEU B O 1 ATOM 7653 C CB . LEU B 2 158 ? 61.064 -5.819 2.158 1.00 72.53 ? 139 LEU B CB 1 ATOM 7654 C CG . LEU B 2 158 ? 60.853 -5.351 0.716 1.00 63.21 ? 139 LEU B CG 1 ATOM 7655 C CD1 . LEU B 2 158 ? 59.749 -6.127 0.033 1.00 70.59 ? 139 LEU B CD1 1 ATOM 7656 C CD2 . LEU B 2 158 ? 60.541 -3.865 0.697 1.00 61.89 ? 139 LEU B CD2 1 ATOM 7657 N N . PRO B 2 159 ? 63.075 -8.168 3.015 1.00 92.43 ? 140 PRO B N 1 ATOM 7658 C CA . PRO B 2 159 ? 64.113 -8.655 3.931 1.00 100.69 ? 140 PRO B CA 1 ATOM 7659 C C . PRO B 2 159 ? 64.855 -7.524 4.649 1.00 111.97 ? 140 PRO B C 1 ATOM 7660 O O . PRO B 2 159 ? 65.363 -6.607 4.001 1.00 111.18 ? 140 PRO B O 1 ATOM 7661 C CB . PRO B 2 159 ? 65.068 -9.403 2.998 1.00 87.08 ? 140 PRO B CB 1 ATOM 7662 C CG . PRO B 2 159 ? 64.936 -8.696 1.693 1.00 81.24 ? 140 PRO B CG 1 ATOM 7663 C CD . PRO B 2 159 ? 63.498 -8.251 1.605 1.00 84.92 ? 140 PRO B CD 1 ATOM 7664 N N . GLU B 2 160 ? 64.911 -7.597 5.977 1.00 116.68 ? 141 GLU B N 1 ATOM 7665 C CA . GLU B 2 160 ? 65.641 -6.618 6.779 1.00 115.57 ? 141 GLU B CA 1 ATOM 7666 C C . GLU B 2 160 ? 67.132 -6.692 6.463 1.00 111.17 ? 141 GLU B C 1 ATOM 7667 O O . GLU B 2 160 ? 67.662 -7.779 6.231 1.00 108.96 ? 141 GLU B O 1 ATOM 7668 C CB . GLU B 2 160 ? 65.404 -6.863 8.271 1.00 126.32 ? 141 GLU B CB 1 ATOM 7669 C CG . GLU B 2 160 ? 63.935 -6.889 8.671 1.00 134.55 ? 141 GLU B CG 1 ATOM 7670 C CD . GLU B 2 160 ? 63.731 -7.137 10.155 1.00 137.30 ? 141 GLU B CD 1 ATOM 7671 O OE1 . GLU B 2 160 ? 64.736 -7.325 10.872 1.00 141.26 ? 141 GLU B OE1 1 ATOM 7672 O OE2 . GLU B 2 160 ? 62.563 -7.143 10.603 1.00 130.12 ? 141 GLU B OE2 1 ATOM 7673 N N . PRO B 2 161 ? 67.819 -5.537 6.451 1.00 116.36 ? 142 PRO B N 1 ATOM 7674 C CA . PRO B 2 161 ? 67.293 -4.197 6.743 1.00 112.88 ? 142 PRO B CA 1 ATOM 7675 C C . PRO B 2 161 ? 66.508 -3.596 5.578 1.00 105.56 ? 142 PRO B C 1 ATOM 7676 O O . PRO B 2 161 ? 66.925 -3.692 4.422 1.00 100.09 ? 142 PRO B O 1 ATOM 7677 C CB . PRO B 2 161 ? 68.560 -3.380 6.995 1.00 111.65 ? 142 PRO B CB 1 ATOM 7678 C CG . PRO B 2 161 ? 69.588 -4.034 6.142 1.00 114.39 ? 142 PRO B CG 1 ATOM 7679 C CD . PRO B 2 161 ? 69.263 -5.505 6.154 1.00 116.35 ? 142 PRO B CD 1 ATOM 7680 N N . ARG B 2 162 ? 65.378 -2.973 5.894 1.00 101.49 ? 143 ARG B N 1 ATOM 7681 C CA . ARG B 2 162 ? 64.504 -2.399 4.879 1.00 95.89 ? 143 ARG B CA 1 ATOM 7682 C C . ARG B 2 162 ? 64.944 -0.989 4.489 1.00 106.21 ? 143 ARG B C 1 ATOM 7683 O O . ARG B 2 162 ? 64.208 -0.253 3.827 1.00 104.55 ? 143 ARG B O 1 ATOM 7684 C CB . ARG B 2 162 ? 63.057 -2.398 5.372 1.00 81.53 ? 143 ARG B CB 1 ATOM 7685 C CG . ARG B 2 162 ? 62.574 -3.767 5.832 1.00 71.69 ? 143 ARG B CG 1 ATOM 7686 C CD . ARG B 2 162 ? 61.131 -3.713 6.282 1.00 66.50 ? 143 ARG B CD 1 ATOM 7687 N NE . ARG B 2 162 ? 60.662 -4.996 6.787 1.00 70.84 ? 143 ARG B NE 1 ATOM 7688 C CZ . ARG B 2 162 ? 60.675 -5.339 8.069 1.00 107.03 ? 143 ARG B CZ 1 ATOM 7689 N NH1 . ARG B 2 162 ? 61.141 -4.494 8.982 1.00 107.52 ? 143 ARG B NH1 1 ATOM 7690 N NH2 . ARG B 2 162 ? 60.224 -6.530 8.441 1.00 125.54 ? 143 ARG B NH2 1 ATOM 7691 N N . LYS B 2 163 ? 66.150 -0.625 4.914 1.00 111.38 ? 144 LYS B N 1 ATOM 7692 C CA . LYS B 2 163 ? 66.766 0.643 4.545 1.00 104.27 ? 144 LYS B CA 1 ATOM 7693 C C . LYS B 2 163 ? 68.240 0.393 4.235 1.00 110.47 ? 144 LYS B C 1 ATOM 7694 O O . LYS B 2 163 ? 68.971 -0.113 5.086 1.00 118.12 ? 144 LYS B O 1 ATOM 7695 C CB . LYS B 2 163 ? 66.624 1.660 5.678 1.00 97.70 ? 144 LYS B CB 1 ATOM 7696 N N . PRO B 2 164 ? 68.687 0.745 3.016 1.00 106.98 ? 145 PRO B N 1 ATOM 7697 C CA . PRO B 2 164 ? 67.935 1.417 1.947 1.00 104.95 ? 145 PRO B CA 1 ATOM 7698 C C . PRO B 2 164 ? 66.913 0.514 1.256 1.00 105.06 ? 145 PRO B C 1 ATOM 7699 O O . PRO B 2 164 ? 67.070 -0.709 1.228 1.00 101.53 ? 145 PRO B O 1 ATOM 7700 C CB . PRO B 2 164 ? 69.031 1.824 0.960 1.00 100.15 ? 145 PRO B CB 1 ATOM 7701 C CG . PRO B 2 164 ? 70.094 0.809 1.155 1.00 96.25 ? 145 PRO B CG 1 ATOM 7702 C CD . PRO B 2 164 ? 70.080 0.475 2.617 1.00 101.88 ? 145 PRO B CD 1 ATOM 7703 N N . LEU B 2 165 ? 65.875 1.133 0.703 1.00 104.11 ? 146 LEU B N 1 ATOM 7704 C CA . LEU B 2 165 ? 64.742 0.408 0.142 1.00 93.81 ? 146 LEU B CA 1 ATOM 7705 C C . LEU B 2 165 ? 65.096 -0.338 -1.141 1.00 85.17 ? 146 LEU B C 1 ATOM 7706 O O . LEU B 2 165 ? 64.631 -1.454 -1.359 1.00 78.30 ? 146 LEU B O 1 ATOM 7707 C CB . LEU B 2 165 ? 63.570 1.366 -0.095 1.00 83.08 ? 146 LEU B CB 1 ATOM 7708 C CG . LEU B 2 165 ? 62.231 0.788 -0.558 1.00 80.28 ? 146 LEU B CG 1 ATOM 7709 C CD1 . LEU B 2 165 ? 61.828 -0.419 0.278 1.00 74.67 ? 146 LEU B CD1 1 ATOM 7710 C CD2 . LEU B 2 165 ? 61.159 1.866 -0.495 1.00 68.08 ? 146 LEU B CD2 1 ATOM 7711 N N . GLU B 2 166 ? 65.922 0.279 -1.980 1.00 85.98 ? 147 GLU B N 1 ATOM 7712 C CA . GLU B 2 166 ? 66.311 -0.317 -3.255 1.00 84.28 ? 147 GLU B CA 1 ATOM 7713 C C . GLU B 2 166 ? 67.002 -1.669 -3.095 1.00 90.13 ? 147 GLU B C 1 ATOM 7714 O O . GLU B 2 166 ? 66.686 -2.621 -3.809 1.00 93.79 ? 147 GLU B O 1 ATOM 7715 C CB . GLU B 2 166 ? 67.209 0.636 -4.046 1.00 87.46 ? 147 GLU B CB 1 ATOM 7716 C CG . GLU B 2 166 ? 66.484 1.816 -4.657 1.00 87.55 ? 147 GLU B CG 1 ATOM 7717 C CD . GLU B 2 166 ? 67.040 3.139 -4.184 1.00 101.65 ? 147 GLU B CD 1 ATOM 7718 O OE1 . GLU B 2 166 ? 67.250 4.034 -5.029 1.00 106.07 ? 147 GLU B OE1 1 ATOM 7719 O OE2 . GLU B 2 166 ? 67.264 3.285 -2.963 1.00 111.63 ? 147 GLU B OE2 1 ATOM 7720 N N . LYS B 2 167 ? 67.947 -1.748 -2.163 1.00 89.19 ? 148 LYS B N 1 ATOM 7721 C CA . LYS B 2 167 ? 68.663 -2.995 -1.918 1.00 84.15 ? 148 LYS B CA 1 ATOM 7722 C C . LYS B 2 167 ? 67.722 -4.069 -1.375 1.00 87.30 ? 148 LYS B C 1 ATOM 7723 O O . LYS B 2 167 ? 67.912 -5.258 -1.626 1.00 97.14 ? 148 LYS B O 1 ATOM 7724 C CB . LYS B 2 167 ? 69.835 -2.772 -0.957 1.00 71.90 ? 148 LYS B CB 1 ATOM 7725 N N . ALA B 2 168 ? 66.702 -3.643 -0.636 1.00 73.25 ? 149 ALA B N 1 ATOM 7726 C CA . ALA B 2 168 ? 65.728 -4.566 -0.067 1.00 68.38 ? 149 ALA B CA 1 ATOM 7727 C C . ALA B 2 168 ? 64.856 -5.188 -1.156 1.00 76.61 ? 149 ALA B C 1 ATOM 7728 O O . ALA B 2 168 ? 64.658 -6.403 -1.191 1.00 80.97 ? 149 ALA B O 1 ATOM 7729 C CB . ALA B 2 168 ? 64.865 -3.852 0.961 1.00 66.69 ? 149 ALA B CB 1 ATOM 7730 N N . VAL B 2 169 ? 64.331 -4.341 -2.036 1.00 76.21 ? 150 VAL B N 1 ATOM 7731 C CA . VAL B 2 169 ? 63.518 -4.798 -3.155 1.00 74.88 ? 150 VAL B CA 1 ATOM 7732 C C . VAL B 2 169 ? 64.346 -5.705 -4.056 1.00 72.36 ? 150 VAL B C 1 ATOM 7733 O O . VAL B 2 169 ? 63.869 -6.743 -4.512 1.00 65.10 ? 150 VAL B O 1 ATOM 7734 C CB . VAL B 2 169 ? 62.971 -3.610 -3.978 1.00 72.33 ? 150 VAL B CB 1 ATOM 7735 C CG1 . VAL B 2 169 ? 62.199 -4.106 -5.186 1.00 52.18 ? 150 VAL B CG1 1 ATOM 7736 C CG2 . VAL B 2 169 ? 62.091 -2.724 -3.112 1.00 79.06 ? 150 VAL B CG2 1 ATOM 7737 N N . ALA B 2 170 ? 65.595 -5.312 -4.292 1.00 71.15 ? 151 ALA B N 1 ATOM 7738 C CA . ALA B 2 170 ? 66.505 -6.087 -5.128 1.00 75.12 ? 151 ALA B CA 1 ATOM 7739 C C . ALA B 2 170 ? 66.710 -7.513 -4.613 1.00 79.85 ? 151 ALA B C 1 ATOM 7740 O O . ALA B 2 170 ? 66.820 -8.454 -5.401 1.00 78.71 ? 151 ALA B O 1 ATOM 7741 C CB . ALA B 2 170 ? 67.836 -5.373 -5.258 1.00 76.60 ? 151 ALA B CB 1 ATOM 7742 N N . ASN B 2 171 ? 66.751 -7.669 -3.293 1.00 76.15 ? 152 ASN B N 1 ATOM 7743 C CA . ASN B 2 171 ? 66.949 -8.983 -2.685 1.00 79.89 ? 152 ASN B CA 1 ATOM 7744 C C . ASN B 2 171 ? 65.642 -9.702 -2.359 1.00 84.20 ? 152 ASN B C 1 ATOM 7745 O O . ASN B 2 171 ? 65.649 -10.785 -1.771 1.00 80.94 ? 152 ASN B O 1 ATOM 7746 C CB . ASN B 2 171 ? 67.829 -8.874 -1.438 1.00 76.82 ? 152 ASN B CB 1 ATOM 7747 C CG . ASN B 2 171 ? 69.236 -8.410 -1.760 1.00 76.64 ? 152 ASN B CG 1 ATOM 7748 O OD1 . ASN B 2 171 ? 69.766 -8.697 -2.833 1.00 78.08 ? 152 ASN B OD1 1 ATOM 7749 N ND2 . ASN B 2 171 ? 69.847 -7.683 -0.833 1.00 68.01 ? 152 ASN B ND2 1 ATOM 7750 N N . PHE B 2 172 ? 64.524 -9.095 -2.745 1.00 80.69 ? 153 PHE B N 1 ATOM 7751 C CA . PHE B 2 172 ? 63.218 -9.728 -2.606 1.00 65.79 ? 153 PHE B CA 1 ATOM 7752 C C . PHE B 2 172 ? 62.800 -10.349 -3.932 1.00 66.94 ? 153 PHE B C 1 ATOM 7753 O O . PHE B 2 172 ? 62.183 -11.416 -3.969 1.00 72.45 ? 153 PHE B O 1 ATOM 7754 C CB . PHE B 2 172 ? 62.169 -8.717 -2.153 1.00 56.21 ? 153 PHE B CB 1 ATOM 7755 C CG . PHE B 2 172 ? 60.782 -9.283 -2.070 1.00 54.53 ? 153 PHE B CG 1 ATOM 7756 C CD1 . PHE B 2 172 ? 60.359 -9.940 -0.930 1.00 51.25 ? 153 PHE B CD1 1 ATOM 7757 C CD2 . PHE B 2 172 ? 59.900 -9.158 -3.132 1.00 55.99 ? 153 PHE B CD2 1 ATOM 7758 C CE1 . PHE B 2 172 ? 59.081 -10.466 -0.849 1.00 54.01 ? 153 PHE B CE1 1 ATOM 7759 C CE2 . PHE B 2 172 ? 58.622 -9.682 -3.057 1.00 55.64 ? 153 PHE B CE2 1 ATOM 7760 C CZ . PHE B 2 172 ? 58.212 -10.337 -1.914 1.00 50.54 ? 153 PHE B CZ 1 ATOM 7761 N N . PHE B 2 173 ? 63.124 -9.663 -5.021 1.00 63.57 ? 154 PHE B N 1 ATOM 7762 C CA . PHE B 2 173 ? 62.890 -10.196 -6.352 1.00 69.48 ? 154 PHE B CA 1 ATOM 7763 C C . PHE B 2 173 ? 64.183 -10.816 -6.856 1.00 76.06 ? 154 PHE B C 1 ATOM 7764 O O . PHE B 2 173 ? 65.252 -10.567 -6.301 1.00 93.17 ? 154 PHE B O 1 ATOM 7765 C CB . PHE B 2 173 ? 62.417 -9.099 -7.307 1.00 66.48 ? 154 PHE B CB 1 ATOM 7766 C CG . PHE B 2 173 ? 61.088 -8.496 -6.937 1.00 63.03 ? 154 PHE B CG 1 ATOM 7767 C CD1 . PHE B 2 173 ? 59.920 -9.225 -7.064 1.00 67.62 ? 154 PHE B CD1 1 ATOM 7768 C CD2 . PHE B 2 173 ? 61.006 -7.189 -6.483 1.00 66.51 ? 154 PHE B CD2 1 ATOM 7769 C CE1 . PHE B 2 173 ? 58.694 -8.665 -6.731 1.00 67.21 ? 154 PHE B CE1 1 ATOM 7770 C CE2 . PHE B 2 173 ? 59.784 -6.625 -6.150 1.00 60.48 ? 154 PHE B CE2 1 ATOM 7771 C CZ . PHE B 2 173 ? 58.628 -7.364 -6.275 1.00 52.73 ? 154 PHE B CZ 1 ATOM 7772 N N . SER B 2 174 ? 64.088 -11.626 -7.904 1.00 69.91 ? 155 SER B N 1 ATOM 7773 C CA . SER B 2 174 ? 65.260 -12.312 -8.435 1.00 77.23 ? 155 SER B CA 1 ATOM 7774 C C . SER B 2 174 ? 65.792 -11.640 -9.699 1.00 78.13 ? 155 SER B C 1 ATOM 7775 O O . SER B 2 174 ? 66.317 -12.304 -10.595 1.00 82.67 ? 155 SER B O 1 ATOM 7776 C CB . SER B 2 174 ? 64.935 -13.778 -8.716 1.00 69.68 ? 155 SER B CB 1 ATOM 7777 O OG . SER B 2 174 ? 63.885 -13.889 -9.661 1.00 77.23 ? 155 SER B OG 1 ATOM 7778 N N . GLY B 2 175 ? 65.662 -10.320 -9.762 1.00 65.73 ? 156 GLY B N 1 ATOM 7779 C CA . GLY B 2 175 ? 66.064 -9.574 -10.938 1.00 61.78 ? 156 GLY B CA 1 ATOM 7780 C C . GLY B 2 175 ? 64.936 -8.677 -11.400 1.00 62.52 ? 156 GLY B C 1 ATOM 7781 O O . GLY B 2 175 ? 63.820 -9.140 -11.630 1.00 68.95 ? 156 GLY B O 1 ATOM 7782 N N . SER B 2 176 ? 65.223 -7.390 -11.537 1.00 57.80 ? 157 SER B N 1 ATOM 7783 C CA . SER B 2 176 ? 64.181 -6.421 -11.843 1.00 72.45 ? 157 SER B CA 1 ATOM 7784 C C . SER B 2 176 ? 64.632 -5.358 -12.833 1.00 83.83 ? 157 SER B C 1 ATOM 7785 O O . SER B 2 176 ? 65.824 -5.104 -12.992 1.00 99.92 ? 157 SER B O 1 ATOM 7786 C CB . SER B 2 176 ? 63.708 -5.742 -10.558 1.00 80.33 ? 157 SER B CB 1 ATOM 7787 O OG . SER B 2 176 ? 63.246 -6.693 -9.617 1.00 85.35 ? 157 SER B OG 1 ATOM 7788 N N . CYS B 2 177 ? 63.660 -4.743 -13.498 1.00 83.84 ? 158 CYS B N 1 ATOM 7789 C CA . CYS B 2 177 ? 63.907 -3.556 -14.302 1.00 81.27 ? 158 CYS B CA 1 ATOM 7790 C C . CYS B 2 177 ? 63.260 -2.359 -13.627 1.00 80.39 ? 158 CYS B C 1 ATOM 7791 O O . CYS B 2 177 ? 62.066 -2.111 -13.792 1.00 81.31 ? 158 CYS B O 1 ATOM 7792 C CB . CYS B 2 177 ? 63.345 -3.708 -15.714 1.00 73.74 ? 158 CYS B CB 1 ATOM 7793 S SG . CYS B 2 177 ? 63.410 -2.172 -16.672 1.00 88.39 ? 158 CYS B SG 1 ATOM 7794 N N . ALA B 2 178 ? 64.052 -1.626 -12.856 1.00 72.90 ? 159 ALA B N 1 ATOM 7795 C CA . ALA B 2 178 ? 63.565 -0.433 -12.189 1.00 69.77 ? 159 ALA B CA 1 ATOM 7796 C C . ALA B 2 178 ? 64.245 0.804 -12.770 1.00 73.62 ? 159 ALA B C 1 ATOM 7797 O O . ALA B 2 178 ? 65.252 1.271 -12.240 1.00 76.82 ? 159 ALA B O 1 ATOM 7798 C CB . ALA B 2 178 ? 63.811 -0.533 -10.698 1.00 68.42 ? 159 ALA B CB 1 ATOM 7799 N N . PRO B 2 179 ? 63.693 1.337 -13.870 1.00 77.48 ? 160 PRO B N 1 ATOM 7800 C CA . PRO B 2 179 ? 64.306 2.487 -14.542 1.00 87.77 ? 160 PRO B CA 1 ATOM 7801 C C . PRO B 2 179 ? 64.422 3.705 -13.631 1.00 83.70 ? 160 PRO B C 1 ATOM 7802 O O . PRO B 2 179 ? 63.740 3.774 -12.604 1.00 78.95 ? 160 PRO B O 1 ATOM 7803 C CB . PRO B 2 179 ? 63.357 2.766 -15.715 1.00 95.64 ? 160 PRO B CB 1 ATOM 7804 C CG . PRO B 2 179 ? 62.079 2.086 -15.362 1.00 89.24 ? 160 PRO B CG 1 ATOM 7805 C CD . PRO B 2 179 ? 62.452 0.902 -14.534 1.00 79.40 ? 160 PRO B CD 1 ATOM 7806 N N . CYS B 2 180 ? 65.300 4.631 -14.012 1.00 87.53 ? 161 CYS B N 1 ATOM 7807 C CA . CYS B 2 180 ? 65.599 5.842 -13.244 1.00 82.25 ? 161 CYS B CA 1 ATOM 7808 C C . CYS B 2 180 ? 66.309 5.562 -11.917 1.00 90.25 ? 161 CYS B C 1 ATOM 7809 O O . CYS B 2 180 ? 66.545 6.481 -11.131 1.00 90.04 ? 161 CYS B O 1 ATOM 7810 C CB . CYS B 2 180 ? 64.345 6.702 -13.034 1.00 66.68 ? 161 CYS B CB 1 ATOM 7811 S SG . CYS B 2 180 ? 63.620 7.351 -14.566 1.00 149.17 ? 161 CYS B SG 1 ATOM 7812 N N . ALA B 2 181 ? 66.660 4.299 -11.679 1.00 92.91 ? 162 ALA B N 1 ATOM 7813 C CA . ALA B 2 181 ? 67.408 3.919 -10.481 1.00 87.17 ? 162 ALA B CA 1 ATOM 7814 C C . ALA B 2 181 ? 68.903 3.814 -10.771 1.00 92.73 ? 162 ALA B C 1 ATOM 7815 O O . ALA B 2 181 ? 69.324 3.808 -11.929 1.00 93.29 ? 162 ALA B O 1 ATOM 7816 C CB . ALA B 2 181 ? 66.883 2.612 -9.909 1.00 71.92 ? 162 ALA B CB 1 ATOM 7817 N N . ASP B 2 182 ? 69.701 3.725 -9.712 1.00 99.59 ? 163 ASP B N 1 ATOM 7818 C CA . ASP B 2 182 ? 71.154 3.710 -9.847 1.00 106.03 ? 163 ASP B CA 1 ATOM 7819 C C . ASP B 2 182 ? 71.670 2.309 -10.161 1.00 95.84 ? 163 ASP B C 1 ATOM 7820 O O . ASP B 2 182 ? 71.639 1.422 -9.309 1.00 89.71 ? 163 ASP B O 1 ATOM 7821 C CB . ASP B 2 182 ? 71.809 4.237 -8.568 1.00 112.58 ? 163 ASP B CB 1 ATOM 7822 C CG . ASP B 2 182 ? 73.232 4.715 -8.793 1.00 121.56 ? 163 ASP B CG 1 ATOM 7823 O OD1 . ASP B 2 182 ? 73.892 4.218 -9.731 1.00 122.92 ? 163 ASP B OD1 1 ATOM 7824 O OD2 . ASP B 2 182 ? 73.690 5.591 -8.029 1.00 124.59 ? 163 ASP B OD2 1 ATOM 7825 N N . GLY B 2 183 ? 72.161 2.126 -11.382 1.00 100.85 ? 164 GLY B N 1 ATOM 7826 C CA . GLY B 2 183 ? 72.606 0.822 -11.843 1.00 110.06 ? 164 GLY B CA 1 ATOM 7827 C C . GLY B 2 183 ? 73.839 0.275 -11.148 1.00 116.00 ? 164 GLY B C 1 ATOM 7828 O O . GLY B 2 183 ? 74.060 -0.936 -11.127 1.00 115.29 ? 164 GLY B O 1 ATOM 7829 N N . THR B 2 184 ? 74.641 1.165 -10.576 1.00 118.63 ? 165 THR B N 1 ATOM 7830 C CA . THR B 2 184 ? 75.898 0.769 -9.952 1.00 123.19 ? 165 THR B CA 1 ATOM 7831 C C . THR B 2 184 ? 75.704 0.322 -8.508 1.00 129.34 ? 165 THR B C 1 ATOM 7832 O O . THR B 2 184 ? 76.190 -0.736 -8.108 1.00 136.75 ? 165 THR B O 1 ATOM 7833 C CB . THR B 2 184 ? 76.927 1.912 -9.993 1.00 124.33 ? 165 THR B CB 1 ATOM 7834 O OG1 . THR B 2 184 ? 76.476 2.994 -9.168 1.00 127.86 ? 165 THR B OG1 1 ATOM 7835 C CG2 . THR B 2 184 ? 77.114 2.408 -11.420 1.00 119.16 ? 165 THR B CG2 1 ATOM 7836 N N . ASP B 2 185 ? 74.998 1.131 -7.727 1.00 130.90 ? 166 ASP B N 1 ATOM 7837 C CA . ASP B 2 185 ? 74.753 0.806 -6.326 1.00 136.11 ? 166 ASP B CA 1 ATOM 7838 C C . ASP B 2 185 ? 73.787 -0.365 -6.185 1.00 126.06 ? 166 ASP B C 1 ATOM 7839 O O . ASP B 2 185 ? 73.958 -1.218 -5.314 1.00 121.04 ? 166 ASP B O 1 ATOM 7840 C CB . ASP B 2 185 ? 74.223 2.025 -5.569 1.00 144.54 ? 166 ASP B CB 1 ATOM 7841 C CG . ASP B 2 185 ? 75.298 3.063 -5.312 1.00 153.34 ? 166 ASP B CG 1 ATOM 7842 O OD1 . ASP B 2 185 ? 76.158 3.264 -6.196 1.00 156.73 ? 166 ASP B OD1 1 ATOM 7843 O OD2 . ASP B 2 185 ? 75.287 3.673 -4.223 1.00 154.46 ? 166 ASP B OD2 1 ATOM 7844 N N . PHE B 2 186 ? 72.777 -0.400 -7.048 1.00 122.34 ? 167 PHE B N 1 ATOM 7845 C CA . PHE B 2 186 ? 71.770 -1.454 -7.010 1.00 113.27 ? 167 PHE B CA 1 ATOM 7846 C C . PHE B 2 186 ? 71.676 -2.150 -8.359 1.00 109.40 ? 167 PHE B C 1 ATOM 7847 O O . PHE B 2 186 ? 70.779 -1.859 -9.147 1.00 100.37 ? 167 PHE B O 1 ATOM 7848 C CB . PHE B 2 186 ? 70.412 -0.871 -6.625 1.00 104.99 ? 167 PHE B CB 1 ATOM 7849 C CG . PHE B 2 186 ? 70.478 0.106 -5.489 1.00 110.60 ? 167 PHE B CG 1 ATOM 7850 C CD1 . PHE B 2 186 ? 70.393 1.468 -5.726 1.00 113.62 ? 167 PHE B CD1 1 ATOM 7851 C CD2 . PHE B 2 186 ? 70.644 -0.336 -4.187 1.00 110.50 ? 167 PHE B CD2 1 ATOM 7852 C CE1 . PHE B 2 186 ? 70.459 2.370 -4.685 1.00 117.79 ? 167 PHE B CE1 1 ATOM 7853 C CE2 . PHE B 2 186 ? 70.711 0.561 -3.140 1.00 113.49 ? 167 PHE B CE2 1 ATOM 7854 C CZ . PHE B 2 186 ? 70.618 1.917 -3.390 1.00 118.45 ? 167 PHE B CZ 1 ATOM 7855 N N . PRO B 2 187 ? 72.603 -3.082 -8.623 1.00 113.67 ? 168 PRO B N 1 ATOM 7856 C CA . PRO B 2 187 ? 72.707 -3.757 -9.921 1.00 107.60 ? 168 PRO B CA 1 ATOM 7857 C C . PRO B 2 187 ? 71.481 -4.603 -10.258 1.00 92.72 ? 168 PRO B C 1 ATOM 7858 O O . PRO B 2 187 ? 71.000 -4.554 -11.392 1.00 76.86 ? 168 PRO B O 1 ATOM 7859 C CB . PRO B 2 187 ? 73.938 -4.654 -9.748 1.00 111.52 ? 168 PRO B CB 1 ATOM 7860 C CG . PRO B 2 187 ? 74.048 -4.869 -8.278 1.00 113.65 ? 168 PRO B CG 1 ATOM 7861 C CD . PRO B 2 187 ? 73.593 -3.588 -7.656 1.00 113.74 ? 168 PRO B CD 1 ATOM 7862 N N . GLN B 2 188 ? 70.985 -5.359 -9.282 1.00 88.62 ? 169 GLN B N 1 ATOM 7863 C CA . GLN B 2 188 ? 69.864 -6.265 -9.504 1.00 88.37 ? 169 GLN B CA 1 ATOM 7864 C C . GLN B 2 188 ? 68.614 -5.539 -9.988 1.00 81.32 ? 169 GLN B C 1 ATOM 7865 O O . GLN B 2 188 ? 67.799 -6.106 -10.712 1.00 86.08 ? 169 GLN B O 1 ATOM 7866 C CB . GLN B 2 188 ? 69.545 -7.042 -8.229 1.00 95.84 ? 169 GLN B CB 1 ATOM 7867 C CG . GLN B 2 188 ? 70.703 -7.855 -7.694 1.00 97.44 ? 169 GLN B CG 1 ATOM 7868 C CD . GLN B 2 188 ? 70.270 -8.829 -6.618 1.00 87.22 ? 169 GLN B CD 1 ATOM 7869 O OE1 . GLN B 2 188 ? 69.505 -9.759 -6.879 1.00 84.58 ? 169 GLN B OE1 1 ATOM 7870 N NE2 . GLN B 2 188 ? 70.754 -8.618 -5.397 1.00 79.24 ? 169 GLN B NE2 1 ATOM 7871 N N . LEU B 2 189 ? 68.473 -4.279 -9.594 1.00 85.93 ? 170 LEU B N 1 ATOM 7872 C CA . LEU B 2 189 ? 67.320 -3.476 -9.983 1.00 84.67 ? 170 LEU B CA 1 ATOM 7873 C C . LEU B 2 189 ? 67.400 -3.045 -11.442 1.00 90.69 ? 170 LEU B C 1 ATOM 7874 O O . LEU B 2 189 ? 66.516 -2.347 -11.937 1.00 93.59 ? 170 LEU B O 1 ATOM 7875 C CB . LEU B 2 189 ? 67.202 -2.249 -9.083 1.00 83.52 ? 170 LEU B CB 1 ATOM 7876 C CG . LEU B 2 189 ? 65.924 -2.137 -8.253 1.00 81.51 ? 170 LEU B CG 1 ATOM 7877 C CD1 . LEU B 2 189 ? 65.624 -3.442 -7.521 1.00 53.02 ? 170 LEU B CD1 1 ATOM 7878 C CD2 . LEU B 2 189 ? 66.048 -0.977 -7.273 1.00 80.65 ? 170 LEU B CD2 1 ATOM 7879 N N . CYS B 2 190 ? 68.463 -3.464 -12.123 1.00 95.93 ? 171 CYS B N 1 ATOM 7880 C CA . CYS B 2 190 ? 68.647 -3.162 -13.539 1.00 100.95 ? 171 CYS B CA 1 ATOM 7881 C C . CYS B 2 190 ? 68.964 -4.429 -14.323 1.00 89.73 ? 171 CYS B C 1 ATOM 7882 O O . CYS B 2 190 ? 69.364 -4.364 -15.485 1.00 86.11 ? 171 CYS B O 1 ATOM 7883 C CB . CYS B 2 190 ? 69.777 -2.148 -13.729 1.00 107.13 ? 171 CYS B CB 1 ATOM 7884 S SG . CYS B 2 190 ? 69.546 -0.600 -12.838 1.00 140.66 ? 171 CYS B SG 1 ATOM 7885 N N . GLN B 2 191 ? 68.786 -5.579 -13.679 1.00 83.80 ? 172 GLN B N 1 ATOM 7886 C CA . GLN B 2 191 ? 69.118 -6.869 -14.279 1.00 84.78 ? 172 GLN B CA 1 ATOM 7887 C C . GLN B 2 191 ? 68.329 -7.152 -15.560 1.00 82.54 ? 172 GLN B C 1 ATOM 7888 O O . GLN B 2 191 ? 68.839 -7.781 -16.486 1.00 83.81 ? 172 GLN B O 1 ATOM 7889 C CB . GLN B 2 191 ? 68.906 -7.991 -13.261 1.00 82.37 ? 172 GLN B CB 1 ATOM 7890 C CG . GLN B 2 191 ? 69.260 -9.379 -13.760 1.00 84.29 ? 172 GLN B CG 1 ATOM 7891 C CD . GLN B 2 191 ? 69.260 -10.404 -12.645 1.00 97.39 ? 172 GLN B CD 1 ATOM 7892 O OE1 . GLN B 2 191 ? 69.732 -10.135 -11.538 1.00 96.70 ? 172 GLN B OE1 1 ATOM 7893 N NE2 . GLN B 2 191 ? 68.721 -11.587 -12.928 1.00 104.32 ? 172 GLN B NE2 1 ATOM 7894 N N . LEU B 2 192 ? 67.090 -6.674 -15.608 1.00 80.82 ? 173 LEU B N 1 ATOM 7895 C CA . LEU B 2 192 ? 66.225 -6.882 -16.763 1.00 73.59 ? 173 LEU B CA 1 ATOM 7896 C C . LEU B 2 192 ? 66.340 -5.745 -17.773 1.00 75.97 ? 173 LEU B C 1 ATOM 7897 O O . LEU B 2 192 ? 65.909 -5.878 -18.916 1.00 83.13 ? 173 LEU B O 1 ATOM 7898 C CB . LEU B 2 192 ? 64.772 -7.042 -16.317 1.00 76.19 ? 173 LEU B CB 1 ATOM 7899 C CG . LEU B 2 192 ? 64.521 -8.117 -15.259 1.00 80.50 ? 173 LEU B CG 1 ATOM 7900 C CD1 . LEU B 2 192 ? 63.043 -8.206 -14.927 1.00 73.66 ? 173 LEU B CD1 1 ATOM 7901 C CD2 . LEU B 2 192 ? 65.048 -9.460 -15.730 1.00 81.06 ? 173 LEU B CD2 1 ATOM 7902 N N . CYS B 2 193 ? 66.910 -4.624 -17.340 1.00 83.15 ? 174 CYS B N 1 ATOM 7903 C CA . CYS B 2 193 ? 67.192 -3.504 -18.234 1.00 90.67 ? 174 CYS B CA 1 ATOM 7904 C C . CYS B 2 193 ? 68.467 -2.790 -17.796 1.00 103.49 ? 174 CYS B C 1 ATOM 7905 O O . CYS B 2 193 ? 68.426 -1.874 -16.974 1.00 102.58 ? 174 CYS B O 1 ATOM 7906 C CB . CYS B 2 193 ? 66.005 -2.530 -18.318 1.00 90.79 ? 174 CYS B CB 1 ATOM 7907 S SG . CYS B 2 193 ? 65.413 -1.829 -16.744 1.00 88.99 ? 174 CYS B SG 1 ATOM 7908 N N . PRO B 2 194 ? 69.613 -3.231 -18.336 1.00 111.66 ? 175 PRO B N 1 ATOM 7909 C CA . PRO B 2 194 ? 70.938 -2.713 -17.976 1.00 112.53 ? 175 PRO B CA 1 ATOM 7910 C C . PRO B 2 194 ? 71.048 -1.198 -18.131 1.00 110.00 ? 175 PRO B C 1 ATOM 7911 O O . PRO B 2 194 ? 70.853 -0.670 -19.227 1.00 105.95 ? 175 PRO B O 1 ATOM 7912 C CB . PRO B 2 194 ? 71.864 -3.411 -18.974 1.00 114.72 ? 175 PRO B CB 1 ATOM 7913 C CG . PRO B 2 194 ? 71.153 -4.673 -19.316 1.00 116.59 ? 175 PRO B CG 1 ATOM 7914 C CD . PRO B 2 194 ? 69.698 -4.315 -19.330 1.00 111.09 ? 175 PRO B CD 1 ATOM 7915 N N . GLY B 2 195 ? 71.351 -0.513 -17.032 1.00 105.37 ? 176 GLY B N 1 ATOM 7916 C CA . GLY B 2 195 ? 71.555 0.923 -17.059 1.00 97.59 ? 176 GLY B CA 1 ATOM 7917 C C . GLY B 2 195 ? 70.444 1.714 -16.400 1.00 91.90 ? 176 GLY B C 1 ATOM 7918 O O . GLY B 2 195 ? 70.689 2.779 -15.832 1.00 88.29 ? 176 GLY B O 1 ATOM 7919 N N . CYS B 2 196 ? 69.226 1.184 -16.473 1.00 93.22 ? 177 CYS B N 1 ATOM 7920 C CA . CYS B 2 196 ? 68.035 1.869 -15.975 1.00 91.56 ? 177 CYS B CA 1 ATOM 7921 C C . CYS B 2 196 ? 67.824 3.204 -16.681 1.00 96.80 ? 177 CYS B C 1 ATOM 7922 O O . CYS B 2 196 ? 67.901 4.265 -16.060 1.00 101.12 ? 177 CYS B O 1 ATOM 7923 C CB . CYS B 2 196 ? 68.095 2.067 -14.456 1.00 90.09 ? 177 CYS B CB 1 ATOM 7924 S SG . CYS B 2 196 ? 68.004 0.540 -13.500 1.00 133.82 ? 177 CYS B SG 1 ATOM 7925 N N . GLY B 2 197 ? 67.562 3.140 -17.983 1.00 100.24 ? 178 GLY B N 1 ATOM 7926 C CA . GLY B 2 197 ? 67.327 4.335 -18.770 1.00 111.71 ? 178 GLY B CA 1 ATOM 7927 C C . GLY B 2 197 ? 66.120 5.107 -18.275 1.00 118.61 ? 178 GLY B C 1 ATOM 7928 O O . GLY B 2 197 ? 65.053 4.534 -18.055 1.00 120.43 ? 178 GLY B O 1 ATOM 7929 N N . CYS B 2 198 ? 66.290 6.411 -18.090 1.00 117.26 ? 179 CYS B N 1 ATOM 7930 C CA . CYS B 2 198 ? 65.205 7.254 -17.613 1.00 113.59 ? 179 CYS B CA 1 ATOM 7931 C C . CYS B 2 198 ? 64.540 7.980 -18.779 1.00 115.75 ? 179 CYS B C 1 ATOM 7932 O O . CYS B 2 198 ? 64.015 9.082 -18.624 1.00 118.25 ? 179 CYS B O 1 ATOM 7933 C CB . CYS B 2 198 ? 65.722 8.255 -16.578 1.00 117.62 ? 179 CYS B CB 1 ATOM 7934 S SG . CYS B 2 198 ? 64.441 8.955 -15.507 1.00 124.84 ? 179 CYS B SG 1 ATOM 7935 N N . SER B 2 199 ? 64.564 7.351 -19.949 1.00 113.95 ? 180 SER B N 1 ATOM 7936 C CA . SER B 2 199 ? 63.960 7.937 -21.138 1.00 112.43 ? 180 SER B CA 1 ATOM 7937 C C . SER B 2 199 ? 63.384 6.864 -22.051 1.00 107.22 ? 180 SER B C 1 ATOM 7938 O O . SER B 2 199 ? 63.438 5.675 -21.742 1.00 86.46 ? 180 SER B O 1 ATOM 7939 C CB . SER B 2 199 ? 64.987 8.771 -21.906 1.00 115.28 ? 180 SER B CB 1 ATOM 7940 O OG . SER B 2 199 ? 66.028 7.956 -22.416 1.00 118.62 ? 180 SER B OG 1 ATOM 7941 N N . THR B 2 200 ? 62.842 7.296 -23.185 1.00 119.02 ? 181 THR B N 1 ATOM 7942 C CA . THR B 2 200 ? 62.271 6.383 -24.166 1.00 118.33 ? 181 THR B CA 1 ATOM 7943 C C . THR B 2 200 ? 63.366 5.537 -24.818 1.00 101.76 ? 181 THR B C 1 ATOM 7944 O O . THR B 2 200 ? 63.081 4.531 -25.464 1.00 89.03 ? 181 THR B O 1 ATOM 7945 C CB . THR B 2 200 ? 61.491 7.152 -25.256 1.00 134.27 ? 181 THR B CB 1 ATOM 7946 O OG1 . THR B 2 200 ? 60.807 8.263 -24.663 1.00 139.58 ? 181 THR B OG1 1 ATOM 7947 C CG2 . THR B 2 200 ? 60.477 6.246 -25.943 1.00 133.86 ? 181 THR B CG2 1 ATOM 7948 N N . LEU B 2 201 ? 64.618 5.952 -24.647 1.00 104.97 ? 182 LEU B N 1 ATOM 7949 C CA . LEU B 2 201 ? 65.755 5.194 -25.162 1.00 104.26 ? 182 LEU B CA 1 ATOM 7950 C C . LEU B 2 201 ? 65.779 3.794 -24.553 1.00 104.86 ? 182 LEU B C 1 ATOM 7951 O O . LEU B 2 201 ? 66.133 2.819 -25.219 1.00 95.88 ? 182 LEU B O 1 ATOM 7952 C CB . LEU B 2 201 ? 67.069 5.927 -24.876 1.00 96.56 ? 182 LEU B CB 1 ATOM 7953 N N . ASN B 2 202 ? 65.396 3.704 -23.282 1.00 107.80 ? 183 ASN B N 1 ATOM 7954 C CA . ASN B 2 202 ? 65.223 2.417 -22.620 1.00 99.80 ? 183 ASN B CA 1 ATOM 7955 C C . ASN B 2 202 ? 63.932 1.748 -23.081 1.00 100.76 ? 183 ASN B C 1 ATOM 7956 O O . ASN B 2 202 ? 62.844 2.301 -22.917 1.00 93.43 ? 183 ASN B O 1 ATOM 7957 C CB . ASN B 2 202 ? 65.212 2.594 -21.100 1.00 96.47 ? 183 ASN B CB 1 ATOM 7958 C CG . ASN B 2 202 ? 64.861 1.311 -20.361 1.00 100.28 ? 183 ASN B CG 1 ATOM 7959 O OD1 . ASN B 2 202 ? 65.105 0.205 -20.849 1.00 96.72 ? 183 ASN B OD1 1 ATOM 7960 N ND2 . ASN B 2 202 ? 64.282 1.458 -19.174 1.00 95.14 ? 183 ASN B ND2 1 ATOM 7961 N N . GLN B 2 203 ? 64.063 0.555 -23.651 1.00 107.16 ? 184 GLN B N 1 ATOM 7962 C CA . GLN B 2 203 ? 62.923 -0.174 -24.199 1.00 111.01 ? 184 GLN B CA 1 ATOM 7963 C C . GLN B 2 203 ? 61.859 -0.478 -23.144 1.00 102.72 ? 184 GLN B C 1 ATOM 7964 O O . GLN B 2 203 ? 60.680 -0.628 -23.468 1.00 95.64 ? 184 GLN B O 1 ATOM 7965 C CB . GLN B 2 203 ? 63.396 -1.477 -24.848 1.00 119.25 ? 184 GLN B CB 1 ATOM 7966 C CG . GLN B 2 203 ? 64.242 -2.345 -23.926 1.00 122.77 ? 184 GLN B CG 1 ATOM 7967 C CD . GLN B 2 203 ? 64.419 -3.760 -24.445 1.00 115.15 ? 184 GLN B CD 1 ATOM 7968 O OE1 . GLN B 2 203 ? 63.965 -4.095 -25.542 1.00 118.67 ? 184 GLN B OE1 1 ATOM 7969 N NE2 . GLN B 2 203 ? 65.080 -4.602 -23.654 1.00 96.93 ? 184 GLN B NE2 1 ATOM 7970 N N . TYR B 2 204 ? 62.284 -0.558 -21.886 1.00 97.13 ? 185 TYR B N 1 ATOM 7971 C CA . TYR B 2 204 ? 61.397 -0.935 -20.791 1.00 90.83 ? 185 TYR B CA 1 ATOM 7972 C C . TYR B 2 204 ? 61.065 0.236 -19.861 1.00 95.38 ? 185 TYR B C 1 ATOM 7973 O O . TYR B 2 204 ? 61.043 0.074 -18.640 1.00 92.88 ? 185 TYR B O 1 ATOM 7974 C CB . TYR B 2 204 ? 62.030 -2.062 -19.969 1.00 82.37 ? 185 TYR B CB 1 ATOM 7975 C CG . TYR B 2 204 ? 62.161 -3.395 -20.684 1.00 84.22 ? 185 TYR B CG 1 ATOM 7976 C CD1 . TYR B 2 204 ? 61.356 -3.713 -21.771 1.00 85.28 ? 185 TYR B CD1 1 ATOM 7977 C CD2 . TYR B 2 204 ? 63.086 -4.343 -20.254 1.00 81.09 ? 185 TYR B CD2 1 ATOM 7978 C CE1 . TYR B 2 204 ? 61.474 -4.937 -22.416 1.00 82.83 ? 185 TYR B CE1 1 ATOM 7979 C CE2 . TYR B 2 204 ? 63.211 -5.567 -20.891 1.00 80.06 ? 185 TYR B CE2 1 ATOM 7980 C CZ . TYR B 2 204 ? 62.404 -5.859 -21.970 1.00 82.88 ? 185 TYR B CZ 1 ATOM 7981 O OH . TYR B 2 204 ? 62.530 -7.077 -22.604 1.00 79.93 ? 185 TYR B OH 1 ATOM 7982 N N . PHE B 2 205 ? 60.804 1.409 -20.433 1.00 93.19 ? 186 PHE B N 1 ATOM 7983 C CA . PHE B 2 205 ? 60.512 2.597 -19.632 1.00 92.73 ? 186 PHE B CA 1 ATOM 7984 C C . PHE B 2 205 ? 59.031 2.962 -19.638 1.00 88.99 ? 186 PHE B C 1 ATOM 7985 O O . PHE B 2 205 ? 58.372 2.900 -20.673 1.00 96.17 ? 186 PHE B O 1 ATOM 7986 C CB . PHE B 2 205 ? 61.336 3.795 -20.122 1.00 104.63 ? 186 PHE B CB 1 ATOM 7987 C CG . PHE B 2 205 ? 60.976 5.099 -19.450 1.00 98.99 ? 186 PHE B CG 1 ATOM 7988 C CD1 . PHE B 2 205 ? 61.578 5.466 -18.256 1.00 97.21 ? 186 PHE B CD1 1 ATOM 7989 C CD2 . PHE B 2 205 ? 60.040 5.956 -20.014 1.00 87.52 ? 186 PHE B CD2 1 ATOM 7990 C CE1 . PHE B 2 205 ? 61.249 6.656 -17.636 1.00 98.70 ? 186 PHE B CE1 1 ATOM 7991 C CE2 . PHE B 2 205 ? 59.705 7.142 -19.399 1.00 91.65 ? 186 PHE B CE2 1 ATOM 7992 C CZ . PHE B 2 205 ? 60.311 7.496 -18.209 1.00 99.47 ? 186 PHE B CZ 1 ATOM 7993 N N . GLY B 2 206 ? 58.520 3.366 -18.479 1.00 77.04 ? 187 GLY B N 1 ATOM 7994 C CA . GLY B 2 206 ? 57.163 3.872 -18.387 1.00 83.97 ? 187 GLY B CA 1 ATOM 7995 C C . GLY B 2 206 ? 56.118 2.778 -18.313 1.00 86.55 ? 187 GLY B C 1 ATOM 7996 O O . GLY B 2 206 ? 56.441 1.623 -18.048 1.00 91.35 ? 187 GLY B O 1 ATOM 7997 N N . TYR B 2 207 ? 54.860 3.145 -18.542 1.00 82.97 ? 188 TYR B N 1 ATOM 7998 C CA . TYR B 2 207 ? 53.765 2.187 -18.470 1.00 74.90 ? 188 TYR B CA 1 ATOM 7999 C C . TYR B 2 207 ? 53.939 1.124 -19.539 1.00 75.61 ? 188 TYR B C 1 ATOM 8000 O O . TYR B 2 207 ? 53.966 -0.071 -19.249 1.00 87.50 ? 188 TYR B O 1 ATOM 8001 C CB . TYR B 2 207 ? 52.415 2.880 -18.660 1.00 76.48 ? 188 TYR B CB 1 ATOM 8002 C CG . TYR B 2 207 ? 52.189 4.079 -17.769 1.00 96.03 ? 188 TYR B CG 1 ATOM 8003 C CD1 . TYR B 2 207 ? 51.830 3.923 -16.435 1.00 98.50 ? 188 TYR B CD1 1 ATOM 8004 C CD2 . TYR B 2 207 ? 52.321 5.368 -18.267 1.00 109.65 ? 188 TYR B CD2 1 ATOM 8005 C CE1 . TYR B 2 207 ? 51.619 5.022 -15.619 1.00 104.80 ? 188 TYR B CE1 1 ATOM 8006 C CE2 . TYR B 2 207 ? 52.110 6.471 -17.463 1.00 118.05 ? 188 TYR B CE2 1 ATOM 8007 C CZ . TYR B 2 207 ? 51.758 6.294 -16.140 1.00 114.43 ? 188 TYR B CZ 1 ATOM 8008 O OH . TYR B 2 207 ? 51.549 7.396 -15.342 1.00 115.56 ? 188 TYR B OH 1 ATOM 8009 N N . SER B 2 208 ? 54.058 1.573 -20.781 1.00 70.26 ? 189 SER B N 1 ATOM 8010 C CA . SER B 2 208 ? 54.193 0.667 -21.908 1.00 75.45 ? 189 SER B CA 1 ATOM 8011 C C . SER B 2 208 ? 55.506 -0.107 -21.839 1.00 81.59 ? 189 SER B C 1 ATOM 8012 O O . SER B 2 208 ? 55.573 -1.266 -22.252 1.00 90.75 ? 189 SER B O 1 ATOM 8013 C CB . SER B 2 208 ? 54.081 1.436 -23.229 1.00 73.03 ? 189 SER B CB 1 ATOM 8014 O OG . SER B 2 208 ? 54.941 2.561 -23.255 1.00 77.54 ? 189 SER B OG 1 ATOM 8015 N N . GLY B 2 209 ? 56.543 0.534 -21.308 1.00 67.30 ? 190 GLY B N 1 ATOM 8016 C CA . GLY B 2 209 ? 57.847 -0.095 -21.202 1.00 73.97 ? 190 GLY B CA 1 ATOM 8017 C C . GLY B 2 209 ? 57.871 -1.237 -20.203 1.00 76.64 ? 190 GLY B C 1 ATOM 8018 O O . GLY B 2 209 ? 58.417 -2.309 -20.479 1.00 69.04 ? 190 GLY B O 1 ATOM 8019 N N . ALA B 2 210 ? 57.280 -1.004 -19.035 1.00 72.98 ? 191 ALA B N 1 ATOM 8020 C CA . ALA B 2 210 ? 57.198 -2.027 -18.001 1.00 72.83 ? 191 ALA B CA 1 ATOM 8021 C C . ALA B 2 210 ? 56.389 -3.217 -18.498 1.00 76.16 ? 191 ALA B C 1 ATOM 8022 O O . ALA B 2 210 ? 56.735 -4.365 -18.221 1.00 65.70 ? 191 ALA B O 1 ATOM 8023 C CB . ALA B 2 210 ? 56.585 -1.458 -16.731 1.00 56.27 ? 191 ALA B CB 1 ATOM 8024 N N . PHE B 2 211 ? 55.321 -2.941 -19.243 1.00 74.24 ? 192 PHE B N 1 ATOM 8025 C CA . PHE B 2 211 ? 54.482 -4.008 -19.772 1.00 72.02 ? 192 PHE B CA 1 ATOM 8026 C C . PHE B 2 211 ? 55.230 -4.860 -20.792 1.00 72.40 ? 192 PHE B C 1 ATOM 8027 O O . PHE B 2 211 ? 55.046 -6.075 -20.849 1.00 74.81 ? 192 PHE B O 1 ATOM 8028 C CB . PHE B 2 211 ? 53.195 -3.457 -20.389 1.00 65.47 ? 192 PHE B CB 1 ATOM 8029 C CG . PHE B 2 211 ? 52.287 -4.525 -20.922 1.00 62.12 ? 192 PHE B CG 1 ATOM 8030 C CD1 . PHE B 2 211 ? 51.578 -5.345 -20.054 1.00 65.97 ? 192 PHE B CD1 1 ATOM 8031 C CD2 . PHE B 2 211 ? 52.155 -4.729 -22.284 1.00 65.06 ? 192 PHE B CD2 1 ATOM 8032 C CE1 . PHE B 2 211 ? 50.747 -6.346 -20.535 1.00 58.19 ? 192 PHE B CE1 1 ATOM 8033 C CE2 . PHE B 2 211 ? 51.323 -5.726 -22.773 1.00 76.85 ? 192 PHE B CE2 1 ATOM 8034 C CZ . PHE B 2 211 ? 50.618 -6.535 -21.895 1.00 65.69 ? 192 PHE B CZ 1 ATOM 8035 N N . LYS B 2 212 ? 56.072 -4.218 -21.594 1.00 69.17 ? 193 LYS B N 1 ATOM 8036 C CA . LYS B 2 212 ? 56.884 -4.933 -22.571 1.00 61.76 ? 193 LYS B CA 1 ATOM 8037 C C . LYS B 2 212 ? 57.834 -5.900 -21.868 1.00 72.59 ? 193 LYS B C 1 ATOM 8038 O O . LYS B 2 212 ? 58.064 -7.013 -22.343 1.00 73.67 ? 193 LYS B O 1 ATOM 8039 C CB . LYS B 2 212 ? 57.670 -3.952 -23.444 1.00 56.83 ? 193 LYS B CB 1 ATOM 8040 N N . CYS B 2 213 ? 58.367 -5.468 -20.727 1.00 68.20 ? 194 CYS B N 1 ATOM 8041 C CA . CYS B 2 213 ? 59.261 -6.292 -19.912 1.00 68.84 ? 194 CYS B CA 1 ATOM 8042 C C . CYS B 2 213 ? 58.578 -7.590 -19.483 1.00 74.35 ? 194 CYS B C 1 ATOM 8043 O O . CYS B 2 213 ? 59.225 -8.621 -19.284 1.00 70.92 ? 194 CYS B O 1 ATOM 8044 C CB . CYS B 2 213 ? 59.736 -5.501 -18.690 1.00 62.66 ? 194 CYS B CB 1 ATOM 8045 S SG . CYS B 2 213 ? 60.626 -6.453 -17.448 1.00 77.57 ? 194 CYS B SG 1 ATOM 8046 N N . LEU B 2 214 ? 57.259 -7.532 -19.355 1.00 76.44 ? 195 LEU B N 1 ATOM 8047 C CA . LEU B 2 214 ? 56.469 -8.713 -19.058 1.00 63.54 ? 195 LEU B CA 1 ATOM 8048 C C . LEU B 2 214 ? 56.169 -9.500 -20.336 1.00 63.35 ? 195 LEU B C 1 ATOM 8049 O O . LEU B 2 214 ? 56.394 -10.707 -20.397 1.00 62.97 ? 195 LEU B O 1 ATOM 8050 C CB . LEU B 2 214 ? 55.168 -8.313 -18.364 1.00 50.60 ? 195 LEU B CB 1 ATOM 8051 C CG . LEU B 2 214 ? 54.207 -9.470 -18.102 1.00 50.68 ? 195 LEU B CG 1 ATOM 8052 C CD1 . LEU B 2 214 ? 54.808 -10.438 -17.091 1.00 37.74 ? 195 LEU B CD1 1 ATOM 8053 C CD2 . LEU B 2 214 ? 52.850 -8.954 -17.655 1.00 37.95 ? 195 LEU B CD2 1 ATOM 8054 N N . LYS B 2 215 ? 55.663 -8.802 -21.350 1.00 66.55 ? 196 LYS B N 1 ATOM 8055 C CA . LYS B 2 215 ? 55.291 -9.414 -22.625 1.00 68.52 ? 196 LYS B CA 1 ATOM 8056 C C . LYS B 2 215 ? 56.435 -10.204 -23.266 1.00 73.87 ? 196 LYS B C 1 ATOM 8057 O O . LYS B 2 215 ? 56.210 -11.254 -23.872 1.00 75.26 ? 196 LYS B O 1 ATOM 8058 C CB . LYS B 2 215 ? 54.766 -8.340 -23.585 1.00 75.64 ? 196 LYS B CB 1 ATOM 8059 C CG . LYS B 2 215 ? 54.735 -8.733 -25.059 1.00 88.14 ? 196 LYS B CG 1 ATOM 8060 C CD . LYS B 2 215 ? 54.290 -7.551 -25.921 1.00 97.44 ? 196 LYS B CD 1 ATOM 8061 C CE . LYS B 2 215 ? 54.660 -7.729 -27.390 1.00 101.64 ? 196 LYS B CE 1 ATOM 8062 N NZ . LYS B 2 215 ? 53.863 -8.788 -28.066 1.00 107.90 ? 196 LYS B NZ 1 ATOM 8063 N N . ASP B 2 216 ? 57.660 -9.708 -23.116 1.00 66.85 ? 197 ASP B N 1 ATOM 8064 C CA . ASP B 2 216 ? 58.829 -10.389 -23.667 1.00 66.08 ? 197 ASP B CA 1 ATOM 8065 C C . ASP B 2 216 ? 59.259 -11.586 -22.822 1.00 70.90 ? 197 ASP B C 1 ATOM 8066 O O . ASP B 2 216 ? 59.915 -12.503 -23.318 1.00 79.28 ? 197 ASP B O 1 ATOM 8067 C CB . ASP B 2 216 ? 59.999 -9.415 -23.822 1.00 72.39 ? 197 ASP B CB 1 ATOM 8068 C CG . ASP B 2 216 ? 59.752 -8.373 -24.893 1.00 77.77 ? 197 ASP B CG 1 ATOM 8069 O OD1 . ASP B 2 216 ? 58.810 -8.560 -25.697 1.00 72.61 ? 197 ASP B OD1 1 ATOM 8070 O OD2 . ASP B 2 216 ? 60.504 -7.373 -24.934 1.00 77.50 ? 197 ASP B OD2 1 ATOM 8071 N N . GLY B 2 217 ? 58.895 -11.568 -21.545 1.00 60.03 ? 198 GLY B N 1 ATOM 8072 C CA . GLY B 2 217 ? 59.251 -12.644 -20.642 1.00 63.98 ? 198 GLY B CA 1 ATOM 8073 C C . GLY B 2 217 ? 60.451 -12.316 -19.773 1.00 69.51 ? 198 GLY B C 1 ATOM 8074 O O . GLY B 2 217 ? 61.002 -13.197 -19.105 1.00 56.14 ? 198 GLY B O 1 ATOM 8075 N N . ALA B 2 218 ? 60.864 -11.052 -19.782 1.00 66.88 ? 199 ALA B N 1 ATOM 8076 C CA . ALA B 2 218 ? 61.994 -10.622 -18.968 1.00 63.97 ? 199 ALA B CA 1 ATOM 8077 C C . ALA B 2 218 ? 61.641 -10.716 -17.487 1.00 69.16 ? 199 ALA B C 1 ATOM 8078 O O . ALA B 2 218 ? 62.470 -11.102 -16.662 1.00 67.20 ? 199 ALA B O 1 ATOM 8079 C CB . ALA B 2 218 ? 62.407 -9.207 -19.330 1.00 64.89 ? 199 ALA B CB 1 ATOM 8080 N N . GLY B 2 219 ? 60.399 -10.368 -17.163 1.00 60.89 ? 200 GLY B N 1 ATOM 8081 C CA . GLY B 2 219 ? 59.908 -10.462 -15.801 1.00 65.74 ? 200 GLY B CA 1 ATOM 8082 C C . GLY B 2 219 ? 58.632 -11.277 -15.718 1.00 64.81 ? 200 GLY B C 1 ATOM 8083 O O . GLY B 2 219 ? 58.059 -11.649 -16.746 1.00 64.77 ? 200 GLY B O 1 ATOM 8084 N N . ASP B 2 220 ? 58.183 -11.547 -14.493 1.00 48.28 ? 201 ASP B N 1 ATOM 8085 C CA . ASP B 2 220 ? 56.984 -12.346 -14.273 1.00 42.80 ? 201 ASP B CA 1 ATOM 8086 C C . ASP B 2 220 ? 55.792 -11.488 -13.857 1.00 50.00 ? 201 ASP B C 1 ATOM 8087 O O . ASP B 2 220 ? 54.644 -11.931 -13.918 1.00 53.68 ? 201 ASP B O 1 ATOM 8088 C CB . ASP B 2 220 ? 57.251 -13.422 -13.218 1.00 48.96 ? 201 ASP B CB 1 ATOM 8089 C CG . ASP B 2 220 ? 58.545 -14.166 -13.464 1.00 57.43 ? 201 ASP B CG 1 ATOM 8090 O OD1 . ASP B 2 220 ? 58.615 -14.933 -14.449 1.00 59.80 ? 201 ASP B OD1 1 ATOM 8091 O OD2 . ASP B 2 220 ? 59.493 -13.986 -12.672 1.00 71.08 ? 201 ASP B OD2 1 ATOM 8092 N N . VAL B 2 221 ? 56.069 -10.261 -13.432 1.00 45.46 ? 202 VAL B N 1 ATOM 8093 C CA . VAL B 2 221 ? 55.013 -9.348 -13.012 1.00 47.82 ? 202 VAL B CA 1 ATOM 8094 C C . VAL B 2 221 ? 55.358 -7.889 -13.324 1.00 58.69 ? 202 VAL B C 1 ATOM 8095 O O . VAL B 2 221 ? 56.484 -7.440 -13.102 1.00 53.55 ? 202 VAL B O 1 ATOM 8096 C CB . VAL B 2 221 ? 54.679 -9.514 -11.510 1.00 46.01 ? 202 VAL B CB 1 ATOM 8097 C CG1 . VAL B 2 221 ? 55.930 -9.332 -10.648 1.00 34.98 ? 202 VAL B CG1 1 ATOM 8098 C CG2 . VAL B 2 221 ? 53.572 -8.550 -11.099 1.00 45.73 ? 202 VAL B CG2 1 ATOM 8099 N N . ALA B 2 222 ? 54.383 -7.160 -13.858 1.00 66.67 ? 203 ALA B N 1 ATOM 8100 C CA . ALA B 2 222 ? 54.573 -5.755 -14.195 1.00 59.17 ? 203 ALA B CA 1 ATOM 8101 C C . ALA B 2 222 ? 53.624 -4.874 -13.398 1.00 57.56 ? 203 ALA B C 1 ATOM 8102 O O . ALA B 2 222 ? 52.413 -5.099 -13.387 1.00 63.11 ? 203 ALA B O 1 ATOM 8103 C CB . ALA B 2 222 ? 54.370 -5.538 -15.675 1.00 61.61 ? 203 ALA B CB 1 ATOM 8104 N N . PHE B 2 223 ? 54.181 -3.870 -12.731 1.00 47.79 ? 204 PHE B N 1 ATOM 8105 C CA . PHE B 2 223 ? 53.381 -2.938 -11.942 1.00 53.71 ? 204 PHE B CA 1 ATOM 8106 C C . PHE B 2 223 ? 53.067 -1.664 -12.732 1.00 63.95 ? 204 PHE B C 1 ATOM 8107 O O . PHE B 2 223 ? 53.924 -0.794 -12.906 1.00 55.03 ? 204 PHE B O 1 ATOM 8108 C CB . PHE B 2 223 ? 54.091 -2.613 -10.627 1.00 47.15 ? 204 PHE B CB 1 ATOM 8109 C CG . PHE B 2 223 ? 54.369 -3.823 -9.781 1.00 52.06 ? 204 PHE B CG 1 ATOM 8110 C CD1 . PHE B 2 223 ? 53.334 -4.494 -9.149 1.00 49.83 ? 204 PHE B CD1 1 ATOM 8111 C CD2 . PHE B 2 223 ? 55.661 -4.295 -9.622 1.00 55.02 ? 204 PHE B CD2 1 ATOM 8112 C CE1 . PHE B 2 223 ? 53.582 -5.611 -8.375 1.00 44.39 ? 204 PHE B CE1 1 ATOM 8113 C CE2 . PHE B 2 223 ? 55.912 -5.413 -8.849 1.00 46.49 ? 204 PHE B CE2 1 ATOM 8114 C CZ . PHE B 2 223 ? 54.871 -6.069 -8.225 1.00 41.53 ? 204 PHE B CZ 1 ATOM 8115 N N . VAL B 2 224 ? 51.834 -1.571 -13.224 1.00 55.53 ? 205 VAL B N 1 ATOM 8116 C CA . VAL B 2 224 ? 51.431 -0.468 -14.088 1.00 54.39 ? 205 VAL B CA 1 ATOM 8117 C C . VAL B 2 224 ? 50.010 -0.009 -13.778 1.00 59.73 ? 205 VAL B C 1 ATOM 8118 O O . VAL B 2 224 ? 49.386 -0.484 -12.825 1.00 49.11 ? 205 VAL B O 1 ATOM 8119 C CB . VAL B 2 224 ? 51.489 -0.871 -15.579 1.00 56.67 ? 205 VAL B CB 1 ATOM 8120 C CG1 . VAL B 2 224 ? 52.896 -1.286 -15.979 1.00 61.25 ? 205 VAL B CG1 1 ATOM 8121 C CG2 . VAL B 2 224 ? 50.509 -1.995 -15.862 1.00 48.27 ? 205 VAL B CG2 1 ATOM 8122 N N . LYS B 2 225 ? 49.507 0.915 -14.593 1.00 61.42 ? 206 LYS B N 1 ATOM 8123 C CA . LYS B 2 225 ? 48.127 1.377 -14.481 1.00 64.21 ? 206 LYS B CA 1 ATOM 8124 C C . LYS B 2 225 ? 47.176 0.429 -15.208 1.00 66.83 ? 206 LYS B C 1 ATOM 8125 O O . LYS B 2 225 ? 47.562 -0.220 -16.178 1.00 69.14 ? 206 LYS B O 1 ATOM 8126 C CB . LYS B 2 225 ? 47.977 2.797 -15.037 1.00 84.61 ? 206 LYS B CB 1 ATOM 8127 C CG . LYS B 2 225 ? 48.565 3.888 -14.154 1.00 97.79 ? 206 LYS B CG 1 ATOM 8128 C CD . LYS B 2 225 ? 48.263 5.272 -14.714 1.00 111.29 ? 206 LYS B CD 1 ATOM 8129 C CE . LYS B 2 225 ? 48.857 6.369 -13.840 1.00 116.69 ? 206 LYS B CE 1 ATOM 8130 N NZ . LYS B 2 225 ? 48.705 7.719 -14.454 1.00 116.64 ? 206 LYS B NZ 1 ATOM 8131 N N . HIS B 2 226 ? 45.935 0.367 -14.731 1.00 68.70 ? 207 HIS B N 1 ATOM 8132 C CA . HIS B 2 226 ? 44.901 -0.508 -15.287 1.00 72.99 ? 207 HIS B CA 1 ATOM 8133 C C . HIS B 2 226 ? 44.757 -0.368 -16.799 1.00 80.04 ? 207 HIS B C 1 ATOM 8134 O O . HIS B 2 226 ? 44.503 -1.345 -17.501 1.00 87.58 ? 207 HIS B O 1 ATOM 8135 C CB . HIS B 2 226 ? 43.557 -0.182 -14.640 1.00 77.20 ? 207 HIS B CB 1 ATOM 8136 C CG . HIS B 2 226 ? 43.053 1.188 -14.971 1.00 88.31 ? 207 HIS B CG 1 ATOM 8137 N ND1 . HIS B 2 226 ? 43.639 2.334 -14.477 1.00 83.73 ? 207 HIS B ND1 1 ATOM 8138 C CD2 . HIS B 2 226 ? 42.039 1.598 -15.768 1.00 84.12 ? 207 HIS B CD2 1 ATOM 8139 C CE1 . HIS B 2 226 ? 42.999 3.390 -14.946 1.00 80.39 ? 207 HIS B CE1 1 ATOM 8140 N NE2 . HIS B 2 226 ? 42.024 2.971 -15.733 1.00 78.45 ? 207 HIS B NE2 1 ATOM 8141 N N . SER B 2 227 ? 44.924 0.856 -17.285 1.00 80.95 ? 208 SER B N 1 ATOM 8142 C CA . SER B 2 227 ? 44.701 1.188 -18.685 1.00 80.99 ? 208 SER B CA 1 ATOM 8143 C C . SER B 2 227 ? 45.824 0.700 -19.588 1.00 93.70 ? 208 SER B C 1 ATOM 8144 O O . SER B 2 227 ? 45.629 0.535 -20.791 1.00 104.44 ? 208 SER B O 1 ATOM 8145 C CB . SER B 2 227 ? 44.570 2.702 -18.834 1.00 74.65 ? 208 SER B CB 1 ATOM 8146 O OG . SER B 2 227 ? 45.771 3.348 -18.440 1.00 68.33 ? 208 SER B OG 1 ATOM 8147 N N . THR B 2 228 ? 46.994 0.473 -19.000 1.00 89.22 ? 209 THR B N 1 ATOM 8148 C CA . THR B 2 228 ? 48.209 0.177 -19.757 1.00 86.78 ? 209 THR B CA 1 ATOM 8149 C C . THR B 2 228 ? 48.078 -0.970 -20.765 1.00 87.69 ? 209 THR B C 1 ATOM 8150 O O . THR B 2 228 ? 48.414 -0.807 -21.941 1.00 84.16 ? 209 THR B O 1 ATOM 8151 C CB . THR B 2 228 ? 49.396 -0.093 -18.819 1.00 76.67 ? 209 THR B CB 1 ATOM 8152 O OG1 . THR B 2 228 ? 49.680 1.089 -18.064 1.00 68.04 ? 209 THR B OG1 1 ATOM 8153 C CG2 . THR B 2 228 ? 50.628 -0.484 -19.614 1.00 88.29 ? 209 THR B CG2 1 ATOM 8154 N N . ILE B 2 229 ? 47.588 -2.120 -20.312 1.00 76.45 ? 210 ILE B N 1 ATOM 8155 C CA . ILE B 2 229 ? 47.453 -3.278 -21.192 1.00 73.54 ? 210 ILE B CA 1 ATOM 8156 C C . ILE B 2 229 ? 46.451 -3.042 -22.331 1.00 74.79 ? 210 ILE B C 1 ATOM 8157 O O . ILE B 2 229 ? 46.607 -3.577 -23.425 1.00 82.21 ? 210 ILE B O 1 ATOM 8158 C CB . ILE B 2 229 ? 47.089 -4.562 -20.410 1.00 86.10 ? 210 ILE B CB 1 ATOM 8159 C CG1 . ILE B 2 229 ? 47.181 -5.788 -21.324 1.00 91.42 ? 210 ILE B CG1 1 ATOM 8160 C CG2 . ILE B 2 229 ? 45.706 -4.443 -19.775 1.00 89.22 ? 210 ILE B CG2 1 ATOM 8161 C CD1 . ILE B 2 229 ? 46.931 -7.096 -20.624 1.00 90.89 ? 210 ILE B CD1 1 ATOM 8162 N N . PHE B 2 230 ? 45.431 -2.229 -22.082 1.00 69.72 ? 211 PHE B N 1 ATOM 8163 C CA . PHE B 2 230 ? 44.453 -1.931 -23.120 1.00 69.35 ? 211 PHE B CA 1 ATOM 8164 C C . PHE B 2 230 ? 45.018 -0.928 -24.121 1.00 79.00 ? 211 PHE B C 1 ATOM 8165 O O . PHE B 2 230 ? 44.452 -0.720 -25.193 1.00 79.04 ? 211 PHE B O 1 ATOM 8166 C CB . PHE B 2 230 ? 43.161 -1.386 -22.512 1.00 67.19 ? 211 PHE B CB 1 ATOM 8167 C CG . PHE B 2 230 ? 42.442 -2.366 -21.635 1.00 70.72 ? 211 PHE B CG 1 ATOM 8168 C CD1 . PHE B 2 230 ? 41.570 -3.293 -22.179 1.00 69.06 ? 211 PHE B CD1 1 ATOM 8169 C CD2 . PHE B 2 230 ? 42.632 -2.358 -20.262 1.00 72.33 ? 211 PHE B CD2 1 ATOM 8170 C CE1 . PHE B 2 230 ? 40.902 -4.197 -21.368 1.00 74.06 ? 211 PHE B CE1 1 ATOM 8171 C CE2 . PHE B 2 230 ? 41.966 -3.259 -19.446 1.00 57.01 ? 211 PHE B CE2 1 ATOM 8172 C CZ . PHE B 2 230 ? 41.103 -4.179 -20.000 1.00 60.68 ? 211 PHE B CZ 1 ATOM 8173 N N . GLU B 2 231 ? 46.138 -0.310 -23.763 1.00 77.47 ? 212 GLU B N 1 ATOM 8174 C CA . GLU B 2 231 ? 46.757 0.699 -24.609 1.00 79.83 ? 212 GLU B CA 1 ATOM 8175 C C . GLU B 2 231 ? 47.965 0.152 -25.364 1.00 76.47 ? 212 GLU B C 1 ATOM 8176 O O . GLU B 2 231 ? 48.562 0.853 -26.182 1.00 75.84 ? 212 GLU B O 1 ATOM 8177 C CB . GLU B 2 231 ? 47.163 1.915 -23.774 1.00 85.35 ? 212 GLU B CB 1 ATOM 8178 C CG . GLU B 2 231 ? 45.991 2.662 -23.164 1.00 99.39 ? 212 GLU B CG 1 ATOM 8179 C CD . GLU B 2 231 ? 46.431 3.742 -22.192 1.00 114.30 ? 212 GLU B CD 1 ATOM 8180 O OE1 . GLU B 2 231 ? 47.646 3.831 -21.910 1.00 111.08 ? 212 GLU B OE1 1 ATOM 8181 O OE2 . GLU B 2 231 ? 45.562 4.501 -21.710 1.00 120.59 ? 212 GLU B OE2 1 ATOM 8182 N N . ASN B 2 232 ? 48.322 -1.098 -25.088 1.00 72.85 ? 213 ASN B N 1 ATOM 8183 C CA . ASN B 2 232 ? 49.452 -1.736 -25.757 1.00 76.66 ? 213 ASN B CA 1 ATOM 8184 C C . ASN B 2 232 ? 49.049 -3.025 -26.448 1.00 83.18 ? 213 ASN B C 1 ATOM 8185 O O . ASN B 2 232 ? 49.814 -3.592 -27.228 1.00 79.34 ? 213 ASN B O 1 ATOM 8186 C CB . ASN B 2 232 ? 50.580 -2.006 -24.769 1.00 72.06 ? 213 ASN B CB 1 ATOM 8187 C CG . ASN B 2 232 ? 51.159 -0.738 -24.203 1.00 93.02 ? 213 ASN B CG 1 ATOM 8188 O OD1 . ASN B 2 232 ? 51.949 -0.064 -24.860 1.00 115.56 ? 213 ASN B OD1 1 ATOM 8189 N ND2 . ASN B 2 232 ? 50.762 -0.393 -22.984 1.00 85.93 ? 213 ASN B ND2 1 ATOM 8190 N N . LEU B 2 233 ? 47.837 -3.474 -26.150 1.00 86.10 ? 214 LEU B N 1 ATOM 8191 C CA . LEU B 2 233 ? 47.284 -4.684 -26.732 1.00 84.93 ? 214 LEU B CA 1 ATOM 8192 C C . LEU B 2 233 ? 45.850 -4.403 -27.158 1.00 84.90 ? 214 LEU B C 1 ATOM 8193 O O . LEU B 2 233 ? 44.930 -4.449 -26.339 1.00 87.91 ? 214 LEU B O 1 ATOM 8194 C CB . LEU B 2 233 ? 47.322 -5.823 -25.710 1.00 74.77 ? 214 LEU B CB 1 ATOM 8195 C CG . LEU B 2 233 ? 48.256 -6.992 -26.022 1.00 73.77 ? 214 LEU B CG 1 ATOM 8196 C CD1 . LEU B 2 233 ? 49.676 -6.506 -26.312 1.00 52.77 ? 214 LEU B CD1 1 ATOM 8197 C CD2 . LEU B 2 233 ? 48.239 -8.017 -24.888 1.00 48.79 ? 214 LEU B CD2 1 ATOM 8198 N N . ALA B 2 234 ? 45.663 -4.106 -28.440 1.00 90.95 ? 215 ALA B N 1 ATOM 8199 C CA . ALA B 2 234 ? 44.351 -3.717 -28.948 1.00 95.95 ? 215 ALA B CA 1 ATOM 8200 C C . ALA B 2 234 ? 43.382 -4.895 -29.035 1.00 104.67 ? 215 ALA B C 1 ATOM 8201 O O . ALA B 2 234 ? 42.163 -4.708 -29.013 1.00 101.46 ? 215 ALA B O 1 ATOM 8202 C CB . ALA B 2 234 ? 44.491 -3.041 -30.298 1.00 86.11 ? 215 ALA B CB 1 ATOM 8203 N N . ASN B 2 235 ? 43.928 -6.105 -29.123 1.00 108.05 ? 216 ASN B N 1 ATOM 8204 C CA . ASN B 2 235 ? 43.114 -7.307 -29.286 1.00 115.99 ? 216 ASN B CA 1 ATOM 8205 C C . ASN B 2 235 ? 42.620 -7.902 -27.971 1.00 107.43 ? 216 ASN B C 1 ATOM 8206 O O . ASN B 2 235 ? 43.315 -7.858 -26.958 1.00 114.55 ? 216 ASN B O 1 ATOM 8207 C CB . ASN B 2 235 ? 43.885 -8.371 -30.071 1.00 128.60 ? 216 ASN B CB 1 ATOM 8208 C CG . ASN B 2 235 ? 44.306 -7.892 -31.445 1.00 136.12 ? 216 ASN B CG 1 ATOM 8209 O OD1 . ASN B 2 235 ? 44.378 -6.689 -31.701 1.00 142.63 ? 216 ASN B OD1 1 ATOM 8210 N ND2 . ASN B 2 235 ? 44.588 -8.834 -32.340 1.00 130.51 ? 216 ASN B ND2 1 ATOM 8211 N N . LYS B 2 236 ? 41.416 -8.464 -27.999 1.00 103.21 ? 217 LYS B N 1 ATOM 8212 C CA . LYS B 2 236 ? 40.853 -9.152 -26.842 1.00 97.70 ? 217 LYS B CA 1 ATOM 8213 C C . LYS B 2 236 ? 41.608 -10.451 -26.575 1.00 88.91 ? 217 LYS B C 1 ATOM 8214 O O . LYS B 2 236 ? 41.941 -10.764 -25.432 1.00 76.84 ? 217 LYS B O 1 ATOM 8215 C CB . LYS B 2 236 ? 39.367 -9.442 -27.073 1.00 95.76 ? 217 LYS B CB 1 ATOM 8216 C CG . LYS B 2 236 ? 38.689 -10.274 -25.990 1.00 90.02 ? 217 LYS B CG 1 ATOM 8217 C CD . LYS B 2 236 ? 38.596 -9.521 -24.672 1.00 88.10 ? 217 LYS B CD 1 ATOM 8218 C CE . LYS B 2 236 ? 37.518 -10.109 -23.764 1.00 83.71 ? 217 LYS B CE 1 ATOM 8219 N NZ . LYS B 2 236 ? 37.728 -11.557 -23.477 1.00 84.36 ? 217 LYS B NZ 1 ATOM 8220 N N . ALA B 2 237 ? 41.881 -11.198 -27.640 1.00 88.03 ? 218 ALA B N 1 ATOM 8221 C CA . ALA B 2 237 ? 42.564 -12.483 -27.532 1.00 79.21 ? 218 ALA B CA 1 ATOM 8222 C C . ALA B 2 237 ? 44.007 -12.312 -27.075 1.00 82.98 ? 218 ALA B C 1 ATOM 8223 O O . ALA B 2 237 ? 44.563 -13.184 -26.403 1.00 83.68 ? 218 ALA B O 1 ATOM 8224 C CB . ALA B 2 237 ? 42.514 -13.225 -28.859 1.00 64.88 ? 218 ALA B CB 1 ATOM 8225 N N . ASP B 2 238 ? 44.614 -11.190 -27.446 1.00 83.04 ? 219 ASP B N 1 ATOM 8226 C CA . ASP B 2 238 ? 45.968 -10.893 -27.003 1.00 89.72 ? 219 ASP B CA 1 ATOM 8227 C C . ASP B 2 238 ? 46.004 -10.650 -25.496 1.00 83.25 ? 219 ASP B C 1 ATOM 8228 O O . ASP B 2 238 ? 46.861 -11.188 -24.797 1.00 78.60 ? 219 ASP B O 1 ATOM 8229 C CB . ASP B 2 238 ? 46.535 -9.687 -27.754 1.00 97.84 ? 219 ASP B CB 1 ATOM 8230 C CG . ASP B 2 238 ? 47.164 -10.068 -29.079 1.00 100.12 ? 219 ASP B CG 1 ATOM 8231 O OD1 . ASP B 2 238 ? 47.646 -11.214 -29.201 1.00 97.44 ? 219 ASP B OD1 1 ATOM 8232 O OD2 . ASP B 2 238 ? 47.182 -9.218 -29.995 1.00 103.84 ? 219 ASP B OD2 1 ATOM 8233 N N . ARG B 2 239 ? 45.065 -9.849 -25.001 1.00 77.52 ? 220 ARG B N 1 ATOM 8234 C CA . ARG B 2 239 ? 45.013 -9.531 -23.579 1.00 80.04 ? 220 ARG B CA 1 ATOM 8235 C C . ARG B 2 239 ? 44.426 -10.683 -22.765 1.00 71.68 ? 220 ARG B C 1 ATOM 8236 O O . ARG B 2 239 ? 44.559 -10.722 -21.544 1.00 75.49 ? 220 ARG B O 1 ATOM 8237 C CB . ARG B 2 239 ? 44.228 -8.238 -23.330 1.00 87.72 ? 220 ARG B CB 1 ATOM 8238 C CG . ARG B 2 239 ? 42.718 -8.410 -23.286 1.00 92.70 ? 220 ARG B CG 1 ATOM 8239 C CD . ARG B 2 239 ? 42.029 -7.089 -22.982 1.00 87.36 ? 220 ARG B CD 1 ATOM 8240 N NE . ARG B 2 239 ? 42.341 -6.077 -23.988 1.00 93.75 ? 220 ARG B NE 1 ATOM 8241 C CZ . ARG B 2 239 ? 41.515 -5.709 -24.963 1.00 93.15 ? 220 ARG B CZ 1 ATOM 8242 N NH1 . ARG B 2 239 ? 40.313 -6.260 -25.061 1.00 83.22 ? 220 ARG B NH1 1 ATOM 8243 N NH2 . ARG B 2 239 ? 41.887 -4.783 -25.836 1.00 97.88 ? 220 ARG B NH2 1 ATOM 8244 N N . ASP B 2 240 ? 43.785 -11.627 -23.446 1.00 68.96 ? 221 ASP B N 1 ATOM 8245 C CA . ASP B 2 240 ? 43.283 -12.827 -22.785 1.00 71.40 ? 221 ASP B CA 1 ATOM 8246 C C . ASP B 2 240 ? 44.432 -13.710 -22.303 1.00 62.82 ? 221 ASP B C 1 ATOM 8247 O O . ASP B 2 240 ? 44.229 -14.623 -21.503 1.00 50.37 ? 221 ASP B O 1 ATOM 8248 C CB . ASP B 2 240 ? 42.359 -13.617 -23.717 1.00 86.20 ? 221 ASP B CB 1 ATOM 8249 C CG . ASP B 2 240 ? 40.929 -13.113 -23.685 1.00 99.68 ? 221 ASP B CG 1 ATOM 8250 O OD1 . ASP B 2 240 ? 40.040 -13.799 -24.234 1.00 99.83 ? 221 ASP B OD1 1 ATOM 8251 O OD2 . ASP B 2 240 ? 40.692 -12.034 -23.101 1.00 101.12 ? 221 ASP B OD2 1 ATOM 8252 N N . GLN B 2 241 ? 45.637 -13.429 -22.793 1.00 63.76 ? 222 GLN B N 1 ATOM 8253 C CA . GLN B 2 241 ? 46.829 -14.166 -22.387 1.00 70.11 ? 222 GLN B CA 1 ATOM 8254 C C . GLN B 2 241 ? 47.449 -13.574 -21.123 1.00 63.13 ? 222 GLN B C 1 ATOM 8255 O O . GLN B 2 241 ? 48.548 -13.953 -20.724 1.00 70.91 ? 222 GLN B O 1 ATOM 8256 C CB . GLN B 2 241 ? 47.867 -14.173 -23.511 1.00 83.62 ? 222 GLN B CB 1 ATOM 8257 C CG . GLN B 2 241 ? 47.503 -15.027 -24.720 1.00 88.55 ? 222 GLN B CG 1 ATOM 8258 C CD . GLN B 2 241 ? 48.564 -14.965 -25.809 1.00 101.54 ? 222 GLN B CD 1 ATOM 8259 O OE1 . GLN B 2 241 ? 48.931 -13.884 -26.274 1.00 103.94 ? 222 GLN B OE1 1 ATOM 8260 N NE2 . GLN B 2 241 ? 49.070 -16.125 -26.212 1.00 106.37 ? 222 GLN B NE2 1 ATOM 8261 N N . TYR B 2 242 ? 46.738 -12.639 -20.501 1.00 54.82 ? 223 TYR B N 1 ATOM 8262 C CA . TYR B 2 242 ? 47.232 -11.973 -19.304 1.00 42.66 ? 223 TYR B CA 1 ATOM 8263 C C . TYR B 2 242 ? 46.182 -11.952 -18.201 1.00 45.99 ? 223 TYR B C 1 ATOM 8264 O O . TYR B 2 242 ? 44.985 -12.082 -18.460 1.00 49.34 ? 223 TYR B O 1 ATOM 8265 C CB . TYR B 2 242 ? 47.703 -10.550 -19.633 1.00 38.77 ? 223 TYR B CB 1 ATOM 8266 C CG . TYR B 2 242 ? 48.864 -10.532 -20.599 1.00 57.77 ? 223 TYR B CG 1 ATOM 8267 C CD1 . TYR B 2 242 ? 50.175 -10.572 -20.144 1.00 57.67 ? 223 TYR B CD1 1 ATOM 8268 C CD2 . TYR B 2 242 ? 48.649 -10.507 -21.968 1.00 54.88 ? 223 TYR B CD2 1 ATOM 8269 C CE1 . TYR B 2 242 ? 51.237 -10.577 -21.031 1.00 53.60 ? 223 TYR B CE1 1 ATOM 8270 C CE2 . TYR B 2 242 ? 49.702 -10.512 -22.856 1.00 58.24 ? 223 TYR B CE2 1 ATOM 8271 C CZ . TYR B 2 242 ? 50.992 -10.547 -22.386 1.00 55.51 ? 223 TYR B CZ 1 ATOM 8272 O OH . TYR B 2 242 ? 52.038 -10.547 -23.281 1.00 77.90 ? 223 TYR B OH 1 ATOM 8273 N N . GLU B 2 243 ? 46.649 -11.797 -16.966 1.00 45.42 ? 224 GLU B N 1 ATOM 8274 C CA . GLU B 2 243 ? 45.777 -11.763 -15.800 1.00 54.37 ? 224 GLU B CA 1 ATOM 8275 C C . GLU B 2 243 ? 46.224 -10.693 -14.816 1.00 56.37 ? 224 GLU B C 1 ATOM 8276 O O . GLU B 2 243 ? 47.236 -10.023 -15.020 1.00 52.50 ? 224 GLU B O 1 ATOM 8277 C CB . GLU B 2 243 ? 45.774 -13.119 -15.096 1.00 56.69 ? 224 GLU B CB 1 ATOM 8278 C CG . GLU B 2 243 ? 44.927 -14.176 -15.771 1.00 60.08 ? 224 GLU B CG 1 ATOM 8279 C CD . GLU B 2 243 ? 45.089 -15.537 -15.129 1.00 64.97 ? 224 GLU B CD 1 ATOM 8280 O OE1 . GLU B 2 243 ? 46.176 -15.809 -14.579 1.00 57.78 ? 224 GLU B OE1 1 ATOM 8281 O OE2 . GLU B 2 243 ? 44.131 -16.337 -15.170 1.00 74.36 ? 224 GLU B OE2 1 ATOM 8282 N N . LEU B 2 244 ? 45.465 -10.549 -13.738 1.00 63.15 ? 225 LEU B N 1 ATOM 8283 C CA . LEU B 2 244 ? 45.813 -9.613 -12.682 1.00 62.16 ? 225 LEU B CA 1 ATOM 8284 C C . LEU B 2 244 ? 45.944 -10.338 -11.350 1.00 55.13 ? 225 LEU B C 1 ATOM 8285 O O . LEU B 2 244 ? 45.214 -11.286 -11.078 1.00 61.39 ? 225 LEU B O 1 ATOM 8286 C CB . LEU B 2 244 ? 44.750 -8.521 -12.570 1.00 53.65 ? 225 LEU B CB 1 ATOM 8287 C CG . LEU B 2 244 ? 44.544 -7.636 -13.798 1.00 47.64 ? 225 LEU B CG 1 ATOM 8288 C CD1 . LEU B 2 244 ? 43.358 -6.707 -13.579 1.00 35.07 ? 225 LEU B CD1 1 ATOM 8289 C CD2 . LEU B 2 244 ? 45.812 -6.853 -14.109 1.00 34.64 ? 225 LEU B CD2 1 ATOM 8290 N N . LEU B 2 245 ? 46.883 -9.895 -10.525 1.00 46.93 ? 226 LEU B N 1 ATOM 8291 C CA . LEU B 2 245 ? 46.984 -10.400 -9.162 1.00 51.14 ? 226 LEU B CA 1 ATOM 8292 C C . LEU B 2 245 ? 46.094 -9.564 -8.252 1.00 54.49 ? 226 LEU B C 1 ATOM 8293 O O . LEU B 2 245 ? 46.187 -8.335 -8.248 1.00 67.97 ? 226 LEU B O 1 ATOM 8294 C CB . LEU B 2 245 ? 48.428 -10.331 -8.665 1.00 44.93 ? 226 LEU B CB 1 ATOM 8295 C CG . LEU B 2 245 ? 49.496 -11.027 -9.508 1.00 48.02 ? 226 LEU B CG 1 ATOM 8296 C CD1 . LEU B 2 245 ? 50.837 -11.007 -8.779 1.00 38.69 ? 226 LEU B CD1 1 ATOM 8297 C CD2 . LEU B 2 245 ? 49.073 -12.456 -9.865 1.00 43.33 ? 226 LEU B CD2 1 ATOM 8298 N N . CYS B 2 246 ? 45.227 -10.225 -7.490 1.00 44.70 ? 227 CYS B N 1 ATOM 8299 C CA . CYS B 2 246 ? 44.419 -9.532 -6.488 1.00 48.92 ? 227 CYS B CA 1 ATOM 8300 C C . CYS B 2 246 ? 45.031 -9.721 -5.099 1.00 55.96 ? 227 CYS B C 1 ATOM 8301 O O . CYS B 2 246 ? 45.752 -10.691 -4.861 1.00 51.78 ? 227 CYS B O 1 ATOM 8302 C CB . CYS B 2 246 ? 42.971 -10.024 -6.517 1.00 40.90 ? 227 CYS B CB 1 ATOM 8303 S SG . CYS B 2 246 ? 42.314 -10.264 -8.192 1.00 62.62 ? 227 CYS B SG 1 ATOM 8304 N N . LEU B 2 247 ? 44.746 -8.790 -4.192 1.00 56.72 ? 228 LEU B N 1 ATOM 8305 C CA . LEU B 2 247 ? 45.315 -8.818 -2.847 1.00 50.37 ? 228 LEU B CA 1 ATOM 8306 C C . LEU B 2 247 ? 44.882 -10.033 -2.024 1.00 51.89 ? 228 LEU B C 1 ATOM 8307 O O . LEU B 2 247 ? 45.558 -10.415 -1.066 1.00 48.79 ? 228 LEU B O 1 ATOM 8308 C CB . LEU B 2 247 ? 44.962 -7.540 -2.084 1.00 54.89 ? 228 LEU B CB 1 ATOM 8309 C CG . LEU B 2 247 ? 45.906 -6.338 -2.169 1.00 46.00 ? 228 LEU B CG 1 ATOM 8310 C CD1 . LEU B 2 247 ? 47.336 -6.766 -2.480 1.00 38.96 ? 228 LEU B CD1 1 ATOM 8311 C CD2 . LEU B 2 247 ? 45.402 -5.335 -3.172 1.00 34.91 ? 228 LEU B CD2 1 ATOM 8312 N N . ASP B 2 248 ? 43.756 -10.635 -2.398 1.00 45.90 ? 229 ASP B N 1 ATOM 8313 C CA . ASP B 2 248 ? 43.227 -11.784 -1.672 1.00 57.89 ? 229 ASP B CA 1 ATOM 8314 C C . ASP B 2 248 ? 43.844 -13.095 -2.151 1.00 68.48 ? 229 ASP B C 1 ATOM 8315 O O . ASP B 2 248 ? 43.311 -14.173 -1.881 1.00 67.56 ? 229 ASP B O 1 ATOM 8316 C CB . ASP B 2 248 ? 41.709 -11.852 -1.818 1.00 56.66 ? 229 ASP B CB 1 ATOM 8317 C CG . ASP B 2 248 ? 41.278 -12.282 -3.198 1.00 69.16 ? 229 ASP B CG 1 ATOM 8318 O OD1 . ASP B 2 248 ? 42.034 -12.039 -4.163 1.00 74.21 ? 229 ASP B OD1 1 ATOM 8319 O OD2 . ASP B 2 248 ? 40.181 -12.864 -3.318 1.00 80.60 ? 229 ASP B OD2 1 ATOM 8320 N N . ASN B 2 249 ? 44.954 -12.987 -2.875 1.00 63.08 ? 230 ASN B N 1 ATOM 8321 C CA . ASN B 2 249 ? 45.660 -14.141 -3.425 1.00 57.29 ? 230 ASN B CA 1 ATOM 8322 C C . ASN B 2 249 ? 44.856 -14.968 -4.440 1.00 55.68 ? 230 ASN B C 1 ATOM 8323 O O . ASN B 2 249 ? 44.848 -16.196 -4.397 1.00 57.09 ? 230 ASN B O 1 ATOM 8324 C CB . ASN B 2 249 ? 46.218 -15.019 -2.303 1.00 43.12 ? 230 ASN B CB 1 ATOM 8325 C CG . ASN B 2 249 ? 47.262 -14.302 -1.477 1.00 64.68 ? 230 ASN B CG 1 ATOM 8326 O OD1 . ASN B 2 249 ? 48.063 -13.530 -2.005 1.00 70.33 ? 230 ASN B OD1 1 ATOM 8327 N ND2 . ASN B 2 249 ? 47.258 -14.548 -0.172 1.00 70.99 ? 230 ASN B ND2 1 ATOM 8328 N N . THR B 2 250 ? 44.178 -14.276 -5.350 1.00 47.58 ? 231 THR B N 1 ATOM 8329 C CA . THR B 2 250 ? 43.565 -14.910 -6.510 1.00 48.59 ? 231 THR B CA 1 ATOM 8330 C C . THR B 2 250 ? 43.924 -14.104 -7.751 1.00 49.90 ? 231 THR B C 1 ATOM 8331 O O . THR B 2 250 ? 44.504 -13.021 -7.651 1.00 54.95 ? 231 THR B O 1 ATOM 8332 C CB . THR B 2 250 ? 42.026 -14.984 -6.404 1.00 50.61 ? 231 THR B CB 1 ATOM 8333 O OG1 . THR B 2 250 ? 41.473 -13.661 -6.421 1.00 61.62 ? 231 THR B OG1 1 ATOM 8334 C CG2 . THR B 2 250 ? 41.603 -15.696 -5.132 1.00 41.86 ? 231 THR B CG2 1 ATOM 8335 N N . ARG B 2 251 ? 43.577 -14.630 -8.919 1.00 50.95 ? 232 ARG B N 1 ATOM 8336 C CA . ARG B 2 251 ? 43.763 -13.898 -10.165 1.00 44.75 ? 232 ARG B CA 1 ATOM 8337 C C . ARG B 2 251 ? 42.423 -13.559 -10.798 1.00 48.87 ? 232 ARG B C 1 ATOM 8338 O O . ARG B 2 251 ? 41.425 -14.241 -10.566 1.00 59.67 ? 232 ARG B O 1 ATOM 8339 C CB . ARG B 2 251 ? 44.619 -14.699 -11.152 1.00 38.92 ? 232 ARG B CB 1 ATOM 8340 C CG . ARG B 2 251 ? 46.101 -14.701 -10.831 1.00 36.92 ? 232 ARG B CG 1 ATOM 8341 C CD . ARG B 2 251 ? 46.783 -15.920 -11.419 1.00 40.48 ? 232 ARG B CD 1 ATOM 8342 N NE . ARG B 2 251 ? 48.209 -15.937 -11.117 1.00 42.30 ? 232 ARG B NE 1 ATOM 8343 C CZ . ARG B 2 251 ? 49.165 -15.738 -12.016 1.00 43.67 ? 232 ARG B CZ 1 ATOM 8344 N NH1 . ARG B 2 251 ? 48.845 -15.520 -13.280 1.00 38.46 ? 232 ARG B NH1 1 ATOM 8345 N NH2 . ARG B 2 251 ? 50.440 -15.764 -11.652 1.00 49.21 ? 232 ARG B NH2 1 ATOM 8346 N N . LYS B 2 252 ? 42.409 -12.493 -11.589 1.00 50.22 ? 233 LYS B N 1 ATOM 8347 C CA . LYS B 2 252 ? 41.240 -12.115 -12.374 1.00 57.81 ? 233 LYS B CA 1 ATOM 8348 C C . LYS B 2 252 ? 41.689 -11.560 -13.725 1.00 61.68 ? 233 LYS B C 1 ATOM 8349 O O . LYS B 2 252 ? 42.783 -11.006 -13.838 1.00 64.68 ? 233 LYS B O 1 ATOM 8350 C CB . LYS B 2 252 ? 40.393 -11.078 -11.627 1.00 56.48 ? 233 LYS B CB 1 ATOM 8351 C CG . LYS B 2 252 ? 39.480 -11.661 -10.563 1.00 60.11 ? 233 LYS B CG 1 ATOM 8352 C CD . LYS B 2 252 ? 38.725 -10.568 -9.819 1.00 76.85 ? 233 LYS B CD 1 ATOM 8353 C CE . LYS B 2 252 ? 37.880 -11.143 -8.688 1.00 82.86 ? 233 LYS B CE 1 ATOM 8354 N NZ . LYS B 2 252 ? 38.706 -11.797 -7.629 1.00 87.04 ? 233 LYS B NZ 1 ATOM 8355 N N . PRO B 2 253 ? 40.847 -11.717 -14.756 1.00 56.86 ? 234 PRO B N 1 ATOM 8356 C CA . PRO B 2 253 ? 41.137 -11.184 -16.093 1.00 66.46 ? 234 PRO B CA 1 ATOM 8357 C C . PRO B 2 253 ? 41.393 -9.674 -16.064 1.00 65.25 ? 234 PRO B C 1 ATOM 8358 O O . PRO B 2 253 ? 40.885 -8.990 -15.178 1.00 61.82 ? 234 PRO B O 1 ATOM 8359 C CB . PRO B 2 253 ? 39.858 -11.493 -16.875 1.00 56.51 ? 234 PRO B CB 1 ATOM 8360 C CG . PRO B 2 253 ? 39.255 -12.648 -16.175 1.00 52.48 ? 234 PRO B CG 1 ATOM 8361 C CD . PRO B 2 253 ? 39.582 -12.471 -14.724 1.00 52.26 ? 234 PRO B CD 1 ATOM 8362 N N . VAL B 2 254 ? 42.157 -9.168 -17.030 1.00 64.74 ? 235 VAL B N 1 ATOM 8363 C CA . VAL B 2 254 ? 42.624 -7.783 -17.004 1.00 64.41 ? 235 VAL B CA 1 ATOM 8364 C C . VAL B 2 254 ? 41.514 -6.747 -17.137 1.00 65.40 ? 235 VAL B C 1 ATOM 8365 O O . VAL B 2 254 ? 41.740 -5.561 -16.896 1.00 73.82 ? 235 VAL B O 1 ATOM 8366 C CB . VAL B 2 254 ? 43.692 -7.504 -18.094 1.00 50.89 ? 235 VAL B CB 1 ATOM 8367 C CG1 . VAL B 2 254 ? 44.886 -8.428 -17.926 1.00 45.14 ? 235 VAL B CG1 1 ATOM 8368 C CG2 . VAL B 2 254 ? 43.095 -7.649 -19.477 1.00 45.11 ? 235 VAL B CG2 1 ATOM 8369 N N . ASP B 2 255 ? 40.319 -7.187 -17.521 1.00 61.79 ? 236 ASP B N 1 ATOM 8370 C CA . ASP B 2 255 ? 39.200 -6.261 -17.684 1.00 69.44 ? 236 ASP B CA 1 ATOM 8371 C C . ASP B 2 255 ? 38.401 -6.119 -16.395 1.00 62.55 ? 236 ASP B C 1 ATOM 8372 O O . ASP B 2 255 ? 37.390 -5.423 -16.355 1.00 69.79 ? 236 ASP B O 1 ATOM 8373 C CB . ASP B 2 255 ? 38.287 -6.675 -18.849 1.00 82.75 ? 236 ASP B CB 1 ATOM 8374 C CG . ASP B 2 255 ? 37.713 -8.073 -18.684 1.00 99.01 ? 236 ASP B CG 1 ATOM 8375 O OD1 . ASP B 2 255 ? 38.436 -8.963 -18.188 1.00 101.70 ? 236 ASP B OD1 1 ATOM 8376 O OD2 . ASP B 2 255 ? 36.538 -8.284 -19.057 1.00 100.65 ? 236 ASP B OD2 1 ATOM 8377 N N . GLU B 2 256 ? 38.868 -6.780 -15.343 1.00 57.07 ? 237 GLU B N 1 ATOM 8378 C CA . GLU B 2 256 ? 38.214 -6.714 -14.043 1.00 55.20 ? 237 GLU B CA 1 ATOM 8379 C C . GLU B 2 256 ? 39.109 -6.028 -13.017 1.00 60.97 ? 237 GLU B C 1 ATOM 8380 O O . GLU B 2 256 ? 39.161 -6.428 -11.855 1.00 63.74 ? 237 GLU B O 1 ATOM 8381 C CB . GLU B 2 256 ? 37.834 -8.115 -13.562 1.00 62.04 ? 237 GLU B CB 1 ATOM 8382 C CG . GLU B 2 256 ? 36.914 -8.865 -14.510 1.00 78.46 ? 237 GLU B CG 1 ATOM 8383 C CD . GLU B 2 256 ? 36.428 -10.178 -13.934 1.00 96.09 ? 237 GLU B CD 1 ATOM 8384 O OE1 . GLU B 2 256 ? 36.757 -10.470 -12.767 1.00 98.96 ? 237 GLU B OE1 1 ATOM 8385 O OE2 . GLU B 2 256 ? 35.715 -10.918 -14.645 1.00 108.31 ? 237 GLU B OE2 1 ATOM 8386 N N . TYR B 2 257 ? 39.806 -4.986 -13.455 1.00 71.49 ? 238 TYR B N 1 ATOM 8387 C CA . TYR B 2 257 ? 40.721 -4.258 -12.587 1.00 76.26 ? 238 TYR B CA 1 ATOM 8388 C C . TYR B 2 257 ? 40.013 -3.580 -11.415 1.00 75.19 ? 238 TYR B C 1 ATOM 8389 O O . TYR B 2 257 ? 40.611 -3.369 -10.359 1.00 71.68 ? 238 TYR B O 1 ATOM 8390 C CB . TYR B 2 257 ? 41.522 -3.231 -13.392 1.00 83.07 ? 238 TYR B CB 1 ATOM 8391 C CG . TYR B 2 257 ? 40.678 -2.301 -14.233 1.00 83.91 ? 238 TYR B CG 1 ATOM 8392 C CD1 . TYR B 2 257 ? 40.194 -1.109 -13.713 1.00 94.82 ? 238 TYR B CD1 1 ATOM 8393 C CD2 . TYR B 2 257 ? 40.377 -2.609 -15.550 1.00 78.41 ? 238 TYR B CD2 1 ATOM 8394 C CE1 . TYR B 2 257 ? 39.427 -0.255 -14.478 1.00 96.78 ? 238 TYR B CE1 1 ATOM 8395 C CE2 . TYR B 2 257 ? 39.612 -1.762 -16.322 1.00 86.10 ? 238 TYR B CE2 1 ATOM 8396 C CZ . TYR B 2 257 ? 39.138 -0.587 -15.782 1.00 93.27 ? 238 TYR B CZ 1 ATOM 8397 O OH . TYR B 2 257 ? 38.374 0.261 -16.550 1.00 100.05 ? 238 TYR B OH 1 ATOM 8398 N N . LYS B 2 258 ? 38.740 -3.246 -11.601 1.00 73.50 ? 239 LYS B N 1 ATOM 8399 C CA . LYS B 2 258 ? 37.978 -2.570 -10.557 1.00 72.85 ? 239 LYS B CA 1 ATOM 8400 C C . LYS B 2 258 ? 37.781 -3.467 -9.345 1.00 71.88 ? 239 LYS B C 1 ATOM 8401 O O . LYS B 2 258 ? 37.585 -2.980 -8.233 1.00 85.47 ? 239 LYS B O 1 ATOM 8402 C CB . LYS B 2 258 ? 36.626 -2.088 -11.087 1.00 80.33 ? 239 LYS B CB 1 ATOM 8403 C CG . LYS B 2 258 ? 36.713 -0.877 -12.005 1.00 83.52 ? 239 LYS B CG 1 ATOM 8404 C CD . LYS B 2 258 ? 35.366 -0.574 -12.647 1.00 86.19 ? 239 LYS B CD 1 ATOM 8405 C CE . LYS B 2 258 ? 35.469 0.581 -13.635 1.00 79.84 ? 239 LYS B CE 1 ATOM 8406 N NZ . LYS B 2 258 ? 34.195 0.794 -14.376 1.00 72.83 ? 239 LYS B NZ 1 ATOM 8407 N N . ASP B 2 259 ? 37.840 -4.776 -9.565 1.00 66.43 ? 240 ASP B N 1 ATOM 8408 C CA . ASP B 2 259 ? 37.701 -5.740 -8.478 1.00 71.30 ? 240 ASP B CA 1 ATOM 8409 C C . ASP B 2 259 ? 39.021 -6.447 -8.198 1.00 72.02 ? 240 ASP B C 1 ATOM 8410 O O . ASP B 2 259 ? 39.061 -7.404 -7.427 1.00 70.31 ? 240 ASP B O 1 ATOM 8411 C CB . ASP B 2 259 ? 36.634 -6.788 -8.809 1.00 80.71 ? 240 ASP B CB 1 ATOM 8412 C CG . ASP B 2 259 ? 35.276 -6.174 -9.094 1.00 100.23 ? 240 ASP B CG 1 ATOM 8413 O OD1 . ASP B 2 259 ? 34.568 -5.819 -8.126 1.00 105.95 ? 240 ASP B OD1 1 ATOM 8414 O OD2 . ASP B 2 259 ? 34.911 -6.060 -10.286 1.00 98.75 ? 240 ASP B OD2 1 ATOM 8415 N N . CYS B 2 260 ? 40.098 -5.979 -8.823 1.00 59.92 ? 241 CYS B N 1 ATOM 8416 C CA . CYS B 2 260 ? 41.384 -6.654 -8.704 1.00 53.97 ? 241 CYS B CA 1 ATOM 8417 C C . CYS B 2 260 ? 42.558 -5.709 -8.932 1.00 55.28 ? 241 CYS B C 1 ATOM 8418 O O . CYS B 2 260 ? 43.236 -5.784 -9.955 1.00 62.17 ? 241 CYS B O 1 ATOM 8419 C CB . CYS B 2 260 ? 41.452 -7.826 -9.688 1.00 51.67 ? 241 CYS B CB 1 ATOM 8420 S SG . CYS B 2 260 ? 42.924 -8.856 -9.530 1.00 61.07 ? 241 CYS B SG 1 ATOM 8421 N N . HIS B 2 261 ? 42.802 -4.826 -7.969 1.00 58.11 ? 242 HIS B N 1 ATOM 8422 C CA . HIS B 2 261 ? 43.876 -3.842 -8.091 1.00 54.74 ? 242 HIS B CA 1 ATOM 8423 C C . HIS B 2 261 ? 44.651 -3.705 -6.785 1.00 53.95 ? 242 HIS B C 1 ATOM 8424 O O . HIS B 2 261 ? 44.133 -4.022 -5.721 1.00 51.95 ? 242 HIS B O 1 ATOM 8425 C CB . HIS B 2 261 ? 43.305 -2.482 -8.504 1.00 56.14 ? 242 HIS B CB 1 ATOM 8426 C CG . HIS B 2 261 ? 42.198 -1.998 -7.618 1.00 62.39 ? 242 HIS B CG 1 ATOM 8427 N ND1 . HIS B 2 261 ? 40.870 -2.068 -7.981 1.00 66.10 ? 242 HIS B ND1 1 ATOM 8428 C CD2 . HIS B 2 261 ? 42.221 -1.445 -6.382 1.00 58.75 ? 242 HIS B CD2 1 ATOM 8429 C CE1 . HIS B 2 261 ? 40.123 -1.577 -7.008 1.00 64.76 ? 242 HIS B CE1 1 ATOM 8430 N NE2 . HIS B 2 261 ? 40.918 -1.192 -6.026 1.00 58.97 ? 242 HIS B NE2 1 ATOM 8431 N N . LEU B 2 262 ? 45.890 -3.228 -6.868 1.00 56.06 ? 243 LEU B N 1 ATOM 8432 C CA . LEU B 2 262 ? 46.688 -2.986 -5.672 1.00 47.08 ? 243 LEU B CA 1 ATOM 8433 C C . LEU B 2 262 ? 46.136 -1.807 -4.889 1.00 54.72 ? 243 LEU B C 1 ATOM 8434 O O . LEU B 2 262 ? 46.068 -1.846 -3.662 1.00 52.86 ? 243 LEU B O 1 ATOM 8435 C CB . LEU B 2 262 ? 48.150 -2.721 -6.026 1.00 39.55 ? 243 LEU B CB 1 ATOM 8436 C CG . LEU B 2 262 ? 48.908 -3.841 -6.743 1.00 42.43 ? 243 LEU B CG 1 ATOM 8437 C CD1 . LEU B 2 262 ? 50.411 -3.681 -6.540 1.00 40.85 ? 243 LEU B CD1 1 ATOM 8438 C CD2 . LEU B 2 262 ? 48.444 -5.211 -6.292 1.00 37.38 ? 243 LEU B CD2 1 ATOM 8439 N N . ALA B 2 263 ? 45.739 -0.760 -5.608 1.00 47.17 ? 244 ALA B N 1 ATOM 8440 C CA . ALA B 2 263 ? 45.224 0.449 -4.977 1.00 52.78 ? 244 ALA B CA 1 ATOM 8441 C C . ALA B 2 263 ? 44.502 1.342 -5.973 1.00 68.25 ? 244 ALA B C 1 ATOM 8442 O O . ALA B 2 263 ? 44.815 1.350 -7.165 1.00 71.13 ? 244 ALA B O 1 ATOM 8443 C CB . ALA B 2 263 ? 46.357 1.223 -4.315 1.00 60.57 ? 244 ALA B CB 1 ATOM 8444 N N . GLN B 2 264 ? 43.530 2.094 -5.474 1.00 65.42 ? 245 GLN B N 1 ATOM 8445 C CA . GLN B 2 264 ? 42.884 3.120 -6.274 1.00 57.24 ? 245 GLN B CA 1 ATOM 8446 C C . GLN B 2 264 ? 43.503 4.454 -5.900 1.00 56.75 ? 245 GLN B C 1 ATOM 8447 O O . GLN B 2 264 ? 43.732 4.727 -4.724 1.00 72.28 ? 245 GLN B O 1 ATOM 8448 C CB . GLN B 2 264 ? 41.383 3.130 -6.013 1.00 58.67 ? 245 GLN B CB 1 ATOM 8449 C CG . GLN B 2 264 ? 40.613 4.117 -6.853 1.00 46.62 ? 245 GLN B CG 1 ATOM 8450 C CD . GLN B 2 264 ? 39.120 3.909 -6.735 1.00 64.96 ? 245 GLN B CD 1 ATOM 8451 O OE1 . GLN B 2 264 ? 38.659 3.077 -5.948 1.00 64.79 ? 245 GLN B OE1 1 ATOM 8452 N NE2 . GLN B 2 264 ? 38.350 4.657 -7.522 1.00 68.46 ? 245 GLN B NE2 1 ATOM 8453 N N . VAL B 2 265 ? 43.794 5.276 -6.901 1.00 58.00 ? 246 VAL B N 1 ATOM 8454 C CA . VAL B 2 265 ? 44.526 6.520 -6.671 1.00 63.70 ? 246 VAL B CA 1 ATOM 8455 C C . VAL B 2 265 ? 43.919 7.709 -7.416 1.00 62.28 ? 246 VAL B C 1 ATOM 8456 O O . VAL B 2 265 ? 43.617 7.614 -8.604 1.00 60.14 ? 246 VAL B O 1 ATOM 8457 C CB . VAL B 2 265 ? 46.000 6.370 -7.095 1.00 56.89 ? 246 VAL B CB 1 ATOM 8458 C CG1 . VAL B 2 265 ? 46.729 7.693 -6.980 1.00 56.96 ? 246 VAL B CG1 1 ATOM 8459 C CG2 . VAL B 2 265 ? 46.681 5.317 -6.258 1.00 55.03 ? 246 VAL B CG2 1 ATOM 8460 N N . PRO B 2 266 ? 43.733 8.836 -6.711 1.00 65.60 ? 247 PRO B N 1 ATOM 8461 C CA . PRO B 2 266 ? 43.272 10.081 -7.335 1.00 54.82 ? 247 PRO B CA 1 ATOM 8462 C C . PRO B 2 266 ? 44.378 10.745 -8.148 1.00 59.62 ? 247 PRO B C 1 ATOM 8463 O O . PRO B 2 266 ? 45.475 10.952 -7.634 1.00 68.77 ? 247 PRO B O 1 ATOM 8464 C CB . PRO B 2 266 ? 42.891 10.950 -6.135 1.00 53.60 ? 247 PRO B CB 1 ATOM 8465 C CG . PRO B 2 266 ? 43.728 10.437 -5.021 1.00 66.02 ? 247 PRO B CG 1 ATOM 8466 C CD . PRO B 2 266 ? 43.847 8.958 -5.248 1.00 76.28 ? 247 PRO B CD 1 ATOM 8467 N N . SER B 2 267 ? 44.089 11.065 -9.405 1.00 66.29 ? 248 SER B N 1 ATOM 8468 C CA . SER B 2 267 ? 45.089 11.644 -10.292 1.00 76.67 ? 248 SER B CA 1 ATOM 8469 C C . SER B 2 267 ? 45.526 13.017 -9.804 1.00 87.89 ? 248 SER B C 1 ATOM 8470 O O . SER B 2 267 ? 46.572 13.152 -9.173 1.00 100.70 ? 248 SER B O 1 ATOM 8471 C CB . SER B 2 267 ? 44.543 11.745 -11.714 1.00 71.40 ? 248 SER B CB 1 ATOM 8472 O OG . SER B 2 267 ? 44.048 10.494 -12.160 1.00 72.30 ? 248 SER B OG 1 ATOM 8473 N N . HIS B 2 268 ? 44.718 14.032 -10.095 1.00 85.66 ? 249 HIS B N 1 ATOM 8474 C CA . HIS B 2 268 ? 45.020 15.400 -9.683 1.00 87.21 ? 249 HIS B CA 1 ATOM 8475 C C . HIS B 2 268 ? 43.907 15.992 -8.824 1.00 82.16 ? 249 HIS B C 1 ATOM 8476 O O . HIS B 2 268 ? 42.766 16.128 -9.267 1.00 87.10 ? 249 HIS B O 1 ATOM 8477 C CB . HIS B 2 268 ? 45.276 16.286 -10.900 1.00 93.97 ? 249 HIS B CB 1 ATOM 8478 C CG . HIS B 2 268 ? 46.614 16.953 -10.886 1.00 106.50 ? 249 HIS B CG 1 ATOM 8479 N ND1 . HIS B 2 268 ? 46.871 18.090 -10.151 1.00 112.24 ? 249 HIS B ND1 1 ATOM 8480 C CD2 . HIS B 2 268 ? 47.773 16.639 -11.511 1.00 114.26 ? 249 HIS B CD2 1 ATOM 8481 C CE1 . HIS B 2 268 ? 48.130 18.449 -10.324 1.00 113.38 ? 249 HIS B CE1 1 ATOM 8482 N NE2 . HIS B 2 268 ? 48.700 17.586 -11.146 1.00 115.47 ? 249 HIS B NE2 1 ATOM 8483 N N . THR B 2 269 ? 44.259 16.353 -7.595 1.00 66.57 ? 250 THR B N 1 ATOM 8484 C CA . THR B 2 269 ? 43.288 16.801 -6.608 1.00 66.06 ? 250 THR B CA 1 ATOM 8485 C C . THR B 2 269 ? 43.662 18.172 -6.042 1.00 78.97 ? 250 THR B C 1 ATOM 8486 O O . THR B 2 269 ? 44.777 18.368 -5.549 1.00 77.34 ? 250 THR B O 1 ATOM 8487 C CB . THR B 2 269 ? 43.175 15.777 -5.449 1.00 78.75 ? 250 THR B CB 1 ATOM 8488 O OG1 . THR B 2 269 ? 42.734 14.510 -5.962 1.00 71.82 ? 250 THR B OG1 1 ATOM 8489 C CG2 . THR B 2 269 ? 42.195 16.260 -4.392 1.00 71.90 ? 250 THR B CG2 1 ATOM 8490 N N . VAL B 2 270 ? 42.735 19.125 -6.125 1.00 79.20 ? 251 VAL B N 1 ATOM 8491 C CA . VAL B 2 270 ? 42.929 20.418 -5.473 1.00 83.11 ? 251 VAL B CA 1 ATOM 8492 C C . VAL B 2 270 ? 42.458 20.325 -4.022 1.00 82.74 ? 251 VAL B C 1 ATOM 8493 O O . VAL B 2 270 ? 41.437 19.698 -3.727 1.00 77.23 ? 251 VAL B O 1 ATOM 8494 C CB . VAL B 2 270 ? 42.254 21.595 -6.247 1.00 86.32 ? 251 VAL B CB 1 ATOM 8495 C CG1 . VAL B 2 270 ? 41.427 21.082 -7.417 1.00 76.96 ? 251 VAL B CG1 1 ATOM 8496 C CG2 . VAL B 2 270 ? 41.414 22.469 -5.321 1.00 79.63 ? 251 VAL B CG2 1 ATOM 8497 N N . VAL B 2 271 ? 43.216 20.938 -3.119 1.00 85.72 ? 252 VAL B N 1 ATOM 8498 C CA . VAL B 2 271 ? 43.017 20.726 -1.692 1.00 93.63 ? 252 VAL B CA 1 ATOM 8499 C C . VAL B 2 271 ? 43.067 22.021 -0.871 1.00 100.49 ? 252 VAL B C 1 ATOM 8500 O O . VAL B 2 271 ? 43.999 22.816 -0.995 1.00 100.37 ? 252 VAL B O 1 ATOM 8501 C CB . VAL B 2 271 ? 44.051 19.708 -1.158 1.00 98.28 ? 252 VAL B CB 1 ATOM 8502 C CG1 . VAL B 2 271 ? 45.455 20.067 -1.632 1.00 93.26 ? 252 VAL B CG1 1 ATOM 8503 C CG2 . VAL B 2 271 ? 43.993 19.621 0.346 1.00 107.17 ? 252 VAL B CG2 1 ATOM 8504 N N . ALA B 2 272 ? 42.051 22.223 -0.034 1.00 112.33 ? 253 ALA B N 1 ATOM 8505 C CA . ALA B 2 272 ? 41.960 23.409 0.817 1.00 116.79 ? 253 ALA B CA 1 ATOM 8506 C C . ALA B 2 272 ? 42.354 23.106 2.263 1.00 117.86 ? 253 ALA B C 1 ATOM 8507 O O . ALA B 2 272 ? 42.630 21.961 2.609 1.00 117.40 ? 253 ALA B O 1 ATOM 8508 C CB . ALA B 2 272 ? 40.559 23.990 0.764 1.00 119.82 ? 253 ALA B CB 1 ATOM 8509 N N . ARG B 2 273 ? 42.353 24.137 3.105 1.00 123.92 ? 254 ARG B N 1 ATOM 8510 C CA . ARG B 2 273 ? 42.850 24.027 4.478 1.00 127.89 ? 254 ARG B CA 1 ATOM 8511 C C . ARG B 2 273 ? 41.851 23.443 5.481 1.00 124.13 ? 254 ARG B C 1 ATOM 8512 O O . ARG B 2 273 ? 41.811 23.870 6.635 1.00 124.18 ? 254 ARG B O 1 ATOM 8513 C CB . ARG B 2 273 ? 43.338 25.391 4.978 1.00 132.10 ? 254 ARG B CB 1 ATOM 8514 N N . SER B 2 274 ? 41.058 22.470 5.039 1.00 120.36 ? 255 SER B N 1 ATOM 8515 C CA . SER B 2 274 ? 40.135 21.742 5.914 1.00 116.77 ? 255 SER B CA 1 ATOM 8516 C C . SER B 2 274 ? 39.112 22.644 6.606 1.00 117.00 ? 255 SER B C 1 ATOM 8517 O O . SER B 2 274 ? 38.395 23.401 5.948 1.00 113.09 ? 255 SER B O 1 ATOM 8518 C CB . SER B 2 274 ? 40.907 20.917 6.951 1.00 111.16 ? 255 SER B CB 1 ATOM 8519 O OG . SER B 2 274 ? 40.027 20.240 7.831 1.00 109.10 ? 255 SER B OG 1 ATOM 8520 N N . MET B 2 275 ? 39.048 22.545 7.933 1.00 124.58 ? 256 MET B N 1 ATOM 8521 C CA . MET B 2 275 ? 38.127 23.352 8.733 1.00 129.75 ? 256 MET B CA 1 ATOM 8522 C C . MET B 2 275 ? 38.737 24.711 9.073 1.00 127.68 ? 256 MET B C 1 ATOM 8523 O O . MET B 2 275 ? 39.415 24.862 10.089 1.00 122.12 ? 256 MET B O 1 ATOM 8524 C CB . MET B 2 275 ? 37.741 22.615 10.019 1.00 121.82 ? 256 MET B CB 1 ATOM 8525 N N . GLY B 2 276 ? 38.483 25.696 8.218 1.00 129.42 ? 257 GLY B N 1 ATOM 8526 C CA . GLY B 2 276 ? 39.080 27.009 8.362 1.00 135.39 ? 257 GLY B CA 1 ATOM 8527 C C . GLY B 2 276 ? 39.699 27.452 7.052 1.00 141.40 ? 257 GLY B C 1 ATOM 8528 O O . GLY B 2 276 ? 40.918 27.584 6.936 1.00 144.28 ? 257 GLY B O 1 ATOM 8529 N N . GLY B 2 277 ? 38.847 27.673 6.058 1.00 141.87 ? 258 GLY B N 1 ATOM 8530 C CA . GLY B 2 277 ? 39.297 28.055 4.734 1.00 143.33 ? 258 GLY B CA 1 ATOM 8531 C C . GLY B 2 277 ? 38.204 27.828 3.711 1.00 140.99 ? 258 GLY B C 1 ATOM 8532 O O . GLY B 2 277 ? 37.475 26.839 3.786 1.00 134.64 ? 258 GLY B O 1 ATOM 8533 N N . LYS B 2 278 ? 38.089 28.750 2.760 1.00 145.11 ? 259 LYS B N 1 ATOM 8534 C CA . LYS B 2 278 ? 37.048 28.684 1.741 1.00 138.36 ? 259 LYS B CA 1 ATOM 8535 C C . LYS B 2 278 ? 37.134 27.392 0.941 1.00 129.21 ? 259 LYS B C 1 ATOM 8536 O O . LYS B 2 278 ? 38.186 27.055 0.400 1.00 117.88 ? 259 LYS B O 1 ATOM 8537 C CB . LYS B 2 278 ? 37.137 29.890 0.802 1.00 138.15 ? 259 LYS B CB 1 ATOM 8538 N N . GLU B 2 279 ? 36.022 26.667 0.887 1.00 134.27 ? 260 GLU B N 1 ATOM 8539 C CA . GLU B 2 279 ? 35.943 25.433 0.118 1.00 125.24 ? 260 GLU B CA 1 ATOM 8540 C C . GLU B 2 279 ? 34.814 25.507 -0.905 1.00 129.27 ? 260 GLU B C 1 ATOM 8541 O O . GLU B 2 279 ? 35.001 25.174 -2.074 1.00 132.22 ? 260 GLU B O 1 ATOM 8542 C CB . GLU B 2 279 ? 35.759 24.222 1.041 1.00 112.55 ? 260 GLU B CB 1 ATOM 8543 C CG . GLU B 2 279 ? 34.665 24.378 2.089 1.00 115.54 ? 260 GLU B CG 1 ATOM 8544 C CD . GLU B 2 279 ? 34.247 23.052 2.701 1.00 125.57 ? 260 GLU B CD 1 ATOM 8545 O OE1 . GLU B 2 279 ? 34.698 21.997 2.205 1.00 123.61 ? 260 GLU B OE1 1 ATOM 8546 O OE2 . GLU B 2 279 ? 33.466 23.064 3.676 1.00 131.92 ? 260 GLU B OE2 1 ATOM 8547 N N . ASP B 2 280 ? 33.645 25.956 -0.458 1.00 131.70 ? 261 ASP B N 1 ATOM 8548 C CA . ASP B 2 280 ? 32.489 26.098 -1.332 1.00 137.27 ? 261 ASP B CA 1 ATOM 8549 C C . ASP B 2 280 ? 32.706 27.239 -2.320 1.00 135.54 ? 261 ASP B C 1 ATOM 8550 O O . ASP B 2 280 ? 32.114 27.263 -3.400 1.00 127.75 ? 261 ASP B O 1 ATOM 8551 C CB . ASP B 2 280 ? 31.221 26.339 -0.509 1.00 149.59 ? 261 ASP B CB 1 ATOM 8552 C CG . ASP B 2 280 ? 31.352 27.524 0.433 1.00 166.13 ? 261 ASP B CG 1 ATOM 8553 O OD1 . ASP B 2 280 ? 32.482 27.795 0.896 1.00 171.24 ? 261 ASP B OD1 1 ATOM 8554 O OD2 . ASP B 2 280 ? 30.327 28.184 0.712 1.00 169.16 ? 261 ASP B OD2 1 ATOM 8555 N N . LEU B 2 281 ? 33.562 28.184 -1.941 1.00 139.62 ? 262 LEU B N 1 ATOM 8556 C CA . LEU B 2 281 ? 33.901 29.303 -2.809 1.00 143.69 ? 262 LEU B CA 1 ATOM 8557 C C . LEU B 2 281 ? 34.884 28.860 -3.884 1.00 134.44 ? 262 LEU B C 1 ATOM 8558 O O . LEU B 2 281 ? 34.865 29.368 -5.007 1.00 134.91 ? 262 LEU B O 1 ATOM 8559 C CB . LEU B 2 281 ? 34.487 30.459 -1.994 1.00 149.54 ? 262 LEU B CB 1 ATOM 8560 C CG . LEU B 2 281 ? 33.524 31.150 -1.026 1.00 151.72 ? 262 LEU B CG 1 ATOM 8561 C CD1 . LEU B 2 281 ? 34.242 32.229 -0.228 1.00 152.21 ? 262 LEU B CD1 1 ATOM 8562 C CD2 . LEU B 2 281 ? 32.336 31.735 -1.778 1.00 151.99 ? 262 LEU B CD2 1 ATOM 8563 N N . ILE B 2 282 ? 35.744 27.908 -3.534 1.00 120.75 ? 263 ILE B N 1 ATOM 8564 C CA . ILE B 2 282 ? 36.694 27.357 -4.490 1.00 115.82 ? 263 ILE B CA 1 ATOM 8565 C C . ILE B 2 282 ? 35.961 26.598 -5.593 1.00 116.76 ? 263 ILE B C 1 ATOM 8566 O O . ILE B 2 282 ? 36.304 26.714 -6.769 1.00 113.41 ? 263 ILE B O 1 ATOM 8567 C CB . ILE B 2 282 ? 37.728 26.440 -3.808 1.00 107.49 ? 263 ILE B CB 1 ATOM 8568 C CG1 . ILE B 2 282 ? 38.605 27.253 -2.852 1.00 103.35 ? 263 ILE B CG1 1 ATOM 8569 C CG2 . ILE B 2 282 ? 38.588 25.738 -4.850 1.00 97.54 ? 263 ILE B CG2 1 ATOM 8570 C CD1 . ILE B 2 282 ? 39.786 26.489 -2.294 1.00 92.84 ? 263 ILE B CD1 1 ATOM 8571 N N . TRP B 2 283 ? 34.942 25.833 -5.216 1.00 119.94 ? 264 TRP B N 1 ATOM 8572 C CA . TRP B 2 283 ? 34.141 25.124 -6.207 1.00 122.05 ? 264 TRP B CA 1 ATOM 8573 C C . TRP B 2 283 ? 33.320 26.085 -7.057 1.00 135.44 ? 264 TRP B C 1 ATOM 8574 O O . TRP B 2 283 ? 33.225 25.916 -8.273 1.00 140.03 ? 264 TRP B O 1 ATOM 8575 C CB . TRP B 2 283 ? 33.213 24.102 -5.556 1.00 114.52 ? 264 TRP B CB 1 ATOM 8576 C CG . TRP B 2 283 ? 32.158 23.623 -6.505 1.00 113.06 ? 264 TRP B CG 1 ATOM 8577 C CD1 . TRP B 2 283 ? 30.819 23.870 -6.434 1.00 118.58 ? 264 TRP B CD1 1 ATOM 8578 C CD2 . TRP B 2 283 ? 32.361 22.842 -7.690 1.00 103.79 ? 264 TRP B CD2 1 ATOM 8579 N NE1 . TRP B 2 283 ? 30.171 23.277 -7.492 1.00 118.15 ? 264 TRP B NE1 1 ATOM 8580 C CE2 . TRP B 2 283 ? 31.095 22.640 -8.277 1.00 108.51 ? 264 TRP B CE2 1 ATOM 8581 C CE3 . TRP B 2 283 ? 33.487 22.287 -8.306 1.00 94.26 ? 264 TRP B CE3 1 ATOM 8582 C CZ2 . TRP B 2 283 ? 30.925 21.905 -9.452 1.00 98.15 ? 264 TRP B CZ2 1 ATOM 8583 C CZ3 . TRP B 2 283 ? 33.315 21.558 -9.473 1.00 93.63 ? 264 TRP B CZ3 1 ATOM 8584 C CH2 . TRP B 2 283 ? 32.044 21.375 -10.033 1.00 93.02 ? 264 TRP B CH2 1 ATOM 8585 N N . GLU B 2 284 ? 32.724 27.084 -6.408 1.00 139.84 ? 265 GLU B N 1 ATOM 8586 C CA . GLU B 2 284 ? 31.943 28.104 -7.103 1.00 139.48 ? 265 GLU B CA 1 ATOM 8587 C C . GLU B 2 284 ? 32.801 28.781 -8.165 1.00 131.95 ? 265 GLU B C 1 ATOM 8588 O O . GLU B 2 284 ? 32.316 29.145 -9.237 1.00 130.89 ? 265 GLU B O 1 ATOM 8589 C CB . GLU B 2 284 ? 31.407 29.141 -6.113 1.00 140.92 ? 265 GLU B CB 1 ATOM 8590 N N . LEU B 2 285 ? 34.084 28.932 -7.857 1.00 120.83 ? 266 LEU B N 1 ATOM 8591 C CA . LEU B 2 285 ? 35.049 29.450 -8.811 1.00 117.26 ? 266 LEU B CA 1 ATOM 8592 C C . LEU B 2 285 ? 35.274 28.463 -9.951 1.00 109.75 ? 266 LEU B C 1 ATOM 8593 O O . LEU B 2 285 ? 34.910 28.733 -11.097 1.00 103.01 ? 266 LEU B O 1 ATOM 8594 C CB . LEU B 2 285 ? 36.377 29.741 -8.113 1.00 93.30 ? 266 LEU B CB 1 ATOM 8595 C CG . LEU B 2 285 ? 37.556 30.055 -9.039 1.00 109.00 ? 266 LEU B CG 1 ATOM 8596 C CD1 . LEU B 2 285 ? 37.252 31.267 -9.912 1.00 98.91 ? 266 LEU B CD1 1 ATOM 8597 C CD2 . LEU B 2 285 ? 38.838 30.263 -8.238 1.00 93.78 ? 266 LEU B CD2 1 ATOM 8598 N N . LEU B 2 286 ? 35.870 27.318 -9.619 1.00 109.60 ? 267 LEU B N 1 ATOM 8599 C CA . LEU B 2 286 ? 36.299 26.334 -10.612 1.00 105.95 ? 267 LEU B CA 1 ATOM 8600 C C . LEU B 2 286 ? 35.165 25.845 -11.508 1.00 103.89 ? 267 LEU B C 1 ATOM 8601 O O . LEU B 2 286 ? 35.390 25.516 -12.672 1.00 105.53 ? 267 LEU B O 1 ATOM 8602 C CB . LEU B 2 286 ? 36.998 25.146 -9.940 1.00 109.00 ? 267 LEU B CB 1 ATOM 8603 C CG . LEU B 2 286 ? 38.505 25.231 -9.658 1.00 110.53 ? 267 LEU B CG 1 ATOM 8604 C CD1 . LEU B 2 286 ? 39.289 25.471 -10.937 1.00 110.83 ? 267 LEU B CD1 1 ATOM 8605 C CD2 . LEU B 2 286 ? 38.839 26.297 -8.625 1.00 112.47 ? 267 LEU B CD2 1 ATOM 8606 N N . ASN B 2 287 ? 33.950 25.796 -10.970 1.00 104.92 ? 268 ASN B N 1 ATOM 8607 C CA . ASN B 2 287 ? 32.793 25.419 -11.775 1.00 111.43 ? 268 ASN B CA 1 ATOM 8608 C C . ASN B 2 287 ? 32.422 26.528 -12.748 1.00 112.00 ? 268 ASN B C 1 ATOM 8609 O O . ASN B 2 287 ? 32.146 26.269 -13.918 1.00 110.65 ? 268 ASN B O 1 ATOM 8610 C CB . ASN B 2 287 ? 31.588 25.071 -10.901 1.00 115.57 ? 268 ASN B CB 1 ATOM 8611 C CG . ASN B 2 287 ? 30.412 24.551 -11.712 1.00 106.30 ? 268 ASN B CG 1 ATOM 8612 O OD1 . ASN B 2 287 ? 30.587 23.767 -12.647 1.00 92.62 ? 268 ASN B OD1 1 ATOM 8613 N ND2 . ASN B 2 287 ? 29.209 24.995 -11.362 1.00 97.90 ? 268 ASN B ND2 1 ATOM 8614 N N . GLN B 2 288 ? 32.414 27.764 -12.255 1.00 113.67 ? 269 GLN B N 1 ATOM 8615 C CA . GLN B 2 288 ? 32.159 28.917 -13.106 1.00 116.92 ? 269 GLN B CA 1 ATOM 8616 C C . GLN B 2 288 ? 33.293 29.055 -14.112 1.00 119.21 ? 269 GLN B C 1 ATOM 8617 O O . GLN B 2 288 ? 33.073 29.440 -15.261 1.00 126.95 ? 269 GLN B O 1 ATOM 8618 C CB . GLN B 2 288 ? 32.019 30.194 -12.274 1.00 110.97 ? 269 GLN B CB 1 ATOM 8619 N N . ALA B 2 289 ? 34.477 28.655 -13.685 1.00 110.45 ? 270 ALA B N 1 ATOM 8620 C CA . ALA B 2 289 ? 35.646 28.686 -14.532 1.00 115.08 ? 270 ALA B CA 1 ATOM 8621 C C . ALA B 2 289 ? 35.558 27.666 -15.631 1.00 123.38 ? 270 ALA B C 1 ATOM 8622 O O . ALA B 2 289 ? 36.245 27.756 -16.624 1.00 133.92 ? 270 ALA B O 1 ATOM 8623 C CB . ALA B 2 289 ? 36.865 28.449 -13.725 1.00 107.01 ? 270 ALA B CB 1 ATOM 8624 N N . GLN B 2 290 ? 34.725 26.669 -15.450 1.00 121.27 ? 271 GLN B N 1 ATOM 8625 C CA . GLN B 2 290 ? 34.527 25.732 -16.515 1.00 128.40 ? 271 GLN B CA 1 ATOM 8626 C C . GLN B 2 290 ? 33.658 26.505 -17.442 1.00 145.27 ? 271 GLN B C 1 ATOM 8627 O O . GLN B 2 290 ? 34.119 27.088 -18.398 1.00 145.45 ? 271 GLN B O 1 ATOM 8628 C CB . GLN B 2 290 ? 33.770 24.517 -16.009 1.00 116.94 ? 271 GLN B CB 1 ATOM 8629 C CG . GLN B 2 290 ? 34.615 23.272 -15.818 1.00 111.85 ? 271 GLN B CG 1 ATOM 8630 C CD . GLN B 2 290 ? 33.822 22.127 -15.249 1.00 110.92 ? 271 GLN B CD 1 ATOM 8631 O OE1 . GLN B 2 290 ? 33.320 22.202 -14.143 1.00 101.67 ? 271 GLN B OE1 1 ATOM 8632 N NE2 . GLN B 2 290 ? 33.699 21.063 -16.011 1.00 109.90 ? 271 GLN B NE2 1 ATOM 8633 N N . GLU B 2 291 ? 32.381 26.534 -17.115 1.00 159.23 ? 272 GLU B N 1 ATOM 8634 C CA . GLU B 2 291 ? 31.419 27.311 -17.855 1.00 168.83 ? 272 GLU B CA 1 ATOM 8635 C C . GLU B 2 291 ? 32.106 28.038 -18.975 1.00 171.75 ? 272 GLU B C 1 ATOM 8636 O O . GLU B 2 291 ? 32.488 27.449 -19.974 1.00 172.36 ? 272 GLU B O 1 ATOM 8637 C CB . GLU B 2 291 ? 30.765 28.334 -16.937 1.00 175.08 ? 272 GLU B CB 1 ATOM 8638 C CG . GLU B 2 291 ? 30.636 27.890 -15.496 1.00 170.42 ? 272 GLU B CG 1 ATOM 8639 C CD . GLU B 2 291 ? 29.201 27.734 -15.067 1.00 166.14 ? 272 GLU B CD 1 ATOM 8640 O OE1 . GLU B 2 291 ? 28.468 28.736 -15.075 1.00 157.88 ? 272 GLU B OE1 1 ATOM 8641 O OE2 . GLU B 2 291 ? 28.796 26.610 -14.728 1.00 164.92 ? 272 GLU B OE2 1 ATOM 8642 N N . HIS B 2 292 ? 32.244 29.341 -18.802 1.00 175.55 ? 273 HIS B N 1 ATOM 8643 C CA . HIS B 2 292 ? 32.904 30.148 -19.794 1.00 176.43 ? 273 HIS B CA 1 ATOM 8644 C C . HIS B 2 292 ? 34.110 29.347 -20.167 1.00 183.84 ? 273 HIS B C 1 ATOM 8645 O O . HIS B 2 292 ? 35.097 29.372 -19.471 1.00 180.43 ? 273 HIS B O 1 ATOM 8646 C CB . HIS B 2 292 ? 33.315 31.492 -19.209 1.00 158.20 ? 273 HIS B CB 1 ATOM 8647 C CG . HIS B 2 292 ? 32.298 32.077 -18.284 1.00 145.77 ? 273 HIS B CG 1 ATOM 8648 N ND1 . HIS B 2 292 ? 32.639 32.803 -17.168 1.00 146.92 ? 273 HIS B ND1 1 ATOM 8649 C CD2 . HIS B 2 292 ? 30.948 32.026 -18.303 1.00 144.89 ? 273 HIS B CD2 1 ATOM 8650 C CE1 . HIS B 2 292 ? 31.541 33.174 -16.538 1.00 156.04 ? 273 HIS B CE1 1 ATOM 8651 N NE2 . HIS B 2 292 ? 30.502 32.713 -17.206 1.00 154.77 ? 273 HIS B NE2 1 ATOM 8652 N N . PHE B 2 293 ? 33.998 28.611 -21.257 1.00 191.34 ? 274 PHE B N 1 ATOM 8653 C CA . PHE B 2 293 ? 35.073 27.780 -21.712 1.00 187.96 ? 274 PHE B CA 1 ATOM 8654 C C . PHE B 2 293 ? 36.295 28.636 -21.821 1.00 187.14 ? 274 PHE B C 1 ATOM 8655 O O . PHE B 2 293 ? 37.353 28.174 -22.213 1.00 191.98 ? 274 PHE B O 1 ATOM 8656 C CB . PHE B 2 293 ? 34.726 27.148 -23.046 1.00 188.25 ? 274 PHE B CB 1 ATOM 8657 C CG . PHE B 2 293 ? 33.727 26.048 -22.940 1.00 179.89 ? 274 PHE B CG 1 ATOM 8658 C CD1 . PHE B 2 293 ? 33.932 24.848 -23.581 1.00 173.43 ? 274 PHE B CD1 1 ATOM 8659 C CD2 . PHE B 2 293 ? 32.579 26.212 -22.191 1.00 175.25 ? 274 PHE B CD2 1 ATOM 8660 C CE1 . PHE B 2 293 ? 33.006 23.840 -23.485 1.00 164.47 ? 274 PHE B CE1 1 ATOM 8661 C CE2 . PHE B 2 293 ? 31.652 25.209 -22.097 1.00 165.04 ? 274 PHE B CE2 1 ATOM 8662 C CZ . PHE B 2 293 ? 31.865 24.024 -22.744 1.00 160.40 ? 274 PHE B CZ 1 ATOM 8663 N N . GLY B 2 294 ? 36.158 29.892 -21.436 1.00 177.45 ? 275 GLY B N 1 ATOM 8664 C CA . GLY B 2 294 ? 37.322 30.693 -21.176 1.00 168.14 ? 275 GLY B CA 1 ATOM 8665 C C . GLY B 2 294 ? 38.059 29.756 -20.267 1.00 158.14 ? 275 GLY B C 1 ATOM 8666 O O . GLY B 2 294 ? 39.246 29.888 -20.028 1.00 153.83 ? 275 GLY B O 1 ATOM 8667 N N . LYS B 2 295 ? 37.294 28.796 -19.764 1.00 156.48 ? 276 LYS B N 1 ATOM 8668 C CA . LYS B 2 295 ? 37.771 27.636 -19.040 1.00 155.75 ? 276 LYS B CA 1 ATOM 8669 C C . LYS B 2 295 ? 38.701 26.890 -19.958 1.00 162.63 ? 276 LYS B C 1 ATOM 8670 O O . LYS B 2 295 ? 39.891 27.116 -19.933 1.00 176.08 ? 276 LYS B O 1 ATOM 8671 C CB . LYS B 2 295 ? 36.600 26.729 -18.650 1.00 144.68 ? 276 LYS B CB 1 ATOM 8672 N N . ASP B 2 296 ? 38.168 26.011 -20.791 1.00 152.77 ? 277 ASP B N 1 ATOM 8673 C CA . ASP B 2 296 ? 39.054 25.327 -21.706 1.00 153.64 ? 277 ASP B CA 1 ATOM 8674 C C . ASP B 2 296 ? 38.418 24.300 -22.616 1.00 159.35 ? 277 ASP B C 1 ATOM 8675 O O . ASP B 2 296 ? 38.780 23.142 -22.591 1.00 162.49 ? 277 ASP B O 1 ATOM 8676 C CB . ASP B 2 296 ? 40.210 24.701 -20.939 1.00 144.86 ? 277 ASP B CB 1 ATOM 8677 N N . LYS B 2 297 ? 37.511 24.756 -23.463 1.00 158.55 ? 278 LYS B N 1 ATOM 8678 C CA . LYS B 2 297 ? 36.990 23.958 -24.554 1.00 154.08 ? 278 LYS B CA 1 ATOM 8679 C C . LYS B 2 297 ? 36.249 24.900 -25.458 1.00 151.86 ? 278 LYS B C 1 ATOM 8680 O O . LYS B 2 297 ? 35.343 24.525 -26.181 1.00 153.05 ? 278 LYS B O 1 ATOM 8681 C CB . LYS B 2 297 ? 36.105 22.873 -24.009 1.00 99.36 ? 278 LYS B CB 1 ATOM 8682 N N . SER B 2 298 ? 36.672 26.150 -25.368 1.00 146.75 ? 279 SER B N 1 ATOM 8683 C CA . SER B 2 298 ? 36.296 27.226 -26.253 1.00 155.00 ? 279 SER B CA 1 ATOM 8684 C C . SER B 2 298 ? 37.615 27.932 -26.422 1.00 166.97 ? 279 SER B C 1 ATOM 8685 O O . SER B 2 298 ? 38.664 27.316 -26.294 1.00 168.77 ? 279 SER B O 1 ATOM 8686 C CB . SER B 2 298 ? 35.331 28.168 -25.569 1.00 156.22 ? 279 SER B CB 1 ATOM 8687 O OG . SER B 2 298 ? 36.062 29.112 -24.815 1.00 123.28 ? 279 SER B OG 1 ATOM 8688 N N . LYS B 2 299 ? 37.576 29.228 -26.668 1.00 177.10 ? 280 LYS B N 1 ATOM 8689 C CA . LYS B 2 299 ? 38.801 29.983 -26.805 1.00 181.14 ? 280 LYS B CA 1 ATOM 8690 C C . LYS B 2 299 ? 39.136 30.604 -25.478 1.00 189.18 ? 280 LYS B C 1 ATOM 8691 O O . LYS B 2 299 ? 38.292 30.681 -24.604 1.00 193.53 ? 280 LYS B O 1 ATOM 8692 C CB . LYS B 2 299 ? 38.635 31.073 -27.849 1.00 174.49 ? 280 LYS B CB 1 ATOM 8693 N N . GLU B 2 300 ? 40.371 31.050 -25.330 1.00 190.25 ? 281 GLU B N 1 ATOM 8694 C CA . GLU B 2 300 ? 40.820 31.636 -24.080 1.00 187.98 ? 281 GLU B CA 1 ATOM 8695 C C . GLU B 2 300 ? 40.372 30.835 -22.857 1.00 192.82 ? 281 GLU B C 1 ATOM 8696 O O . GLU B 2 300 ? 39.199 30.810 -22.498 1.00 196.40 ? 281 GLU B O 1 ATOM 8697 C CB . GLU B 2 300 ? 40.360 33.089 -23.971 1.00 179.63 ? 281 GLU B CB 1 ATOM 8698 N N . PHE B 2 301 ? 41.326 30.197 -22.200 1.00 188.33 ? 282 PHE B N 1 ATOM 8699 C CA . PHE B 2 301 ? 42.678 30.119 -22.699 1.00 183.88 ? 282 PHE B CA 1 ATOM 8700 C C . PHE B 2 301 ? 42.901 28.642 -22.769 1.00 166.00 ? 282 PHE B C 1 ATOM 8701 O O . PHE B 2 301 ? 44.015 28.160 -22.918 1.00 159.62 ? 282 PHE B O 1 ATOM 8702 C CB . PHE B 2 301 ? 43.643 30.741 -21.695 1.00 189.78 ? 282 PHE B CB 1 ATOM 8703 N N . GLN B 2 302 ? 41.800 27.923 -22.640 1.00 162.31 ? 283 GLN B N 1 ATOM 8704 C CA . GLN B 2 302 ? 41.846 26.542 -22.259 1.00 160.80 ? 283 GLN B CA 1 ATOM 8705 C C . GLN B 2 302 ? 42.671 26.564 -20.992 1.00 156.30 ? 283 GLN B C 1 ATOM 8706 O O . GLN B 2 302 ? 43.863 26.856 -21.031 1.00 157.20 ? 283 GLN B O 1 ATOM 8707 C CB . GLN B 2 302 ? 42.521 25.720 -23.336 1.00 161.49 ? 283 GLN B CB 1 ATOM 8708 C CG . GLN B 2 302 ? 44.009 25.911 -23.393 1.00 166.98 ? 283 GLN B CG 1 ATOM 8709 C CD . GLN B 2 302 ? 44.506 25.988 -24.800 1.00 164.25 ? 283 GLN B CD 1 ATOM 8710 O OE1 . GLN B 2 302 ? 44.034 26.803 -25.582 1.00 153.46 ? 283 GLN B OE1 1 ATOM 8711 N NE2 . GLN B 2 302 ? 45.459 25.137 -25.142 1.00 168.87 ? 283 GLN B NE2 1 ATOM 8712 N N . LEU B 2 303 ? 42.027 26.289 -19.865 1.00 147.54 ? 284 LEU B N 1 ATOM 8713 C CA . LEU B 2 303 ? 42.663 26.403 -18.564 1.00 136.49 ? 284 LEU B CA 1 ATOM 8714 C C . LEU B 2 303 ? 43.757 25.394 -18.455 1.00 121.30 ? 284 LEU B C 1 ATOM 8715 O O . LEU B 2 303 ? 44.771 25.635 -17.844 1.00 115.76 ? 284 LEU B O 1 ATOM 8716 C CB . LEU B 2 303 ? 41.652 26.183 -17.439 1.00 129.21 ? 284 LEU B CB 1 ATOM 8717 N N . PHE B 2 304 ? 43.538 24.257 -19.081 1.00 112.80 ? 285 PHE B N 1 ATOM 8718 C CA . PHE B 2 304 ? 44.354 23.088 -18.860 1.00 119.63 ? 285 PHE B CA 1 ATOM 8719 C C . PHE B 2 304 ? 45.726 23.089 -19.521 1.00 123.70 ? 285 PHE B C 1 ATOM 8720 O O . PHE B 2 304 ? 46.700 22.665 -18.927 1.00 115.33 ? 285 PHE B O 1 ATOM 8721 C CB . PHE B 2 304 ? 43.533 21.861 -19.224 1.00 129.62 ? 285 PHE B CB 1 ATOM 8722 C CG . PHE B 2 304 ? 42.248 21.770 -18.460 1.00 134.81 ? 285 PHE B CG 1 ATOM 8723 C CD1 . PHE B 2 304 ? 42.105 22.421 -17.271 1.00 134.80 ? 285 PHE B CD1 1 ATOM 8724 C CD2 . PHE B 2 304 ? 41.193 21.049 -18.932 1.00 134.98 ? 285 PHE B CD2 1 ATOM 8725 C CE1 . PHE B 2 304 ? 40.946 22.356 -16.569 1.00 127.09 ? 285 PHE B CE1 1 ATOM 8726 C CE2 . PHE B 2 304 ? 40.035 20.985 -18.229 1.00 129.50 ? 285 PHE B CE2 1 ATOM 8727 C CZ . PHE B 2 304 ? 39.915 21.644 -17.046 1.00 124.41 ? 285 PHE B CZ 1 ATOM 8728 N N . SER B 2 305 ? 45.797 23.590 -20.741 1.00 139.61 ? 286 SER B N 1 ATOM 8729 C CA . SER B 2 305 ? 47.042 23.693 -21.499 1.00 150.01 ? 286 SER B CA 1 ATOM 8730 C C . SER B 2 305 ? 47.739 25.034 -21.274 1.00 157.33 ? 286 SER B C 1 ATOM 8731 O O . SER B 2 305 ? 47.090 26.055 -21.044 1.00 153.46 ? 286 SER B O 1 ATOM 8732 C CB . SER B 2 305 ? 46.790 23.475 -22.992 1.00 152.97 ? 286 SER B CB 1 ATOM 8733 O OG . SER B 2 305 ? 48.005 23.509 -23.722 1.00 152.36 ? 286 SER B OG 1 ATOM 8734 N N . SER B 2 306 ? 49.066 25.024 -21.344 1.00 164.11 ? 287 SER B N 1 ATOM 8735 C CA . SER B 2 306 ? 49.855 26.232 -21.129 1.00 171.15 ? 287 SER B CA 1 ATOM 8736 C C . SER B 2 306 ? 50.709 26.568 -22.351 1.00 168.61 ? 287 SER B C 1 ATOM 8737 O O . SER B 2 306 ? 51.223 25.671 -23.019 1.00 169.67 ? 287 SER B O 1 ATOM 8738 C CB . SER B 2 306 ? 50.737 26.078 -19.886 1.00 174.46 ? 287 SER B CB 1 ATOM 8739 O OG . SER B 2 306 ? 51.523 24.901 -19.956 1.00 173.86 ? 287 SER B OG 1 ATOM 8740 N N . PRO B 2 307 ? 50.859 27.868 -22.647 1.00 162.90 ? 288 PRO B N 1 ATOM 8741 C CA . PRO B 2 307 ? 51.654 28.312 -23.798 1.00 171.07 ? 288 PRO B CA 1 ATOM 8742 C C . PRO B 2 307 ? 53.150 28.071 -23.600 1.00 176.41 ? 288 PRO B C 1 ATOM 8743 O O . PRO B 2 307 ? 53.879 27.908 -24.578 1.00 173.26 ? 288 PRO B O 1 ATOM 8744 C CB . PRO B 2 307 ? 51.366 29.814 -23.859 1.00 173.03 ? 288 PRO B CB 1 ATOM 8745 C CG . PRO B 2 307 ? 51.013 30.185 -22.461 1.00 169.35 ? 288 PRO B CG 1 ATOM 8746 C CD . PRO B 2 307 ? 50.274 29.001 -21.909 1.00 159.05 ? 288 PRO B CD 1 ATOM 8747 N N . HIS B 2 308 ? 53.596 28.049 -22.347 1.00 181.04 ? 289 HIS B N 1 ATOM 8748 C CA . HIS B 2 308 ? 55.007 27.838 -22.040 1.00 179.43 ? 289 HIS B CA 1 ATOM 8749 C C . HIS B 2 308 ? 55.218 26.725 -21.015 1.00 166.07 ? 289 HIS B C 1 ATOM 8750 O O . HIS B 2 308 ? 55.630 26.982 -19.883 1.00 158.27 ? 289 HIS B O 1 ATOM 8751 C CB . HIS B 2 308 ? 55.652 29.139 -21.552 1.00 186.27 ? 289 HIS B CB 1 ATOM 8752 C CG . HIS B 2 308 ? 54.800 29.918 -20.598 1.00 187.51 ? 289 HIS B CG 1 ATOM 8753 N ND1 . HIS B 2 308 ? 54.241 31.135 -20.924 1.00 190.62 ? 289 HIS B ND1 1 ATOM 8754 C CD2 . HIS B 2 308 ? 54.410 29.654 -19.329 1.00 182.59 ? 289 HIS B CD2 1 ATOM 8755 C CE1 . HIS B 2 308 ? 53.544 31.587 -19.896 1.00 189.17 ? 289 HIS B CE1 1 ATOM 8756 N NE2 . HIS B 2 308 ? 53.630 30.707 -18.916 1.00 187.23 ? 289 HIS B NE2 1 ATOM 8757 N N . GLY B 2 309 ? 54.937 25.489 -21.420 1.00 162.90 ? 290 GLY B N 1 ATOM 8758 C CA . GLY B 2 309 ? 55.128 24.337 -20.558 1.00 163.18 ? 290 GLY B CA 1 ATOM 8759 C C . GLY B 2 309 ? 54.072 23.264 -20.751 1.00 165.11 ? 290 GLY B C 1 ATOM 8760 O O . GLY B 2 309 ? 53.148 23.423 -21.550 1.00 168.45 ? 290 GLY B O 1 ATOM 8761 N N . LYS B 2 310 ? 54.219 22.165 -20.016 1.00 161.32 ? 291 LYS B N 1 ATOM 8762 C CA . LYS B 2 310 ? 53.264 21.062 -20.059 1.00 156.63 ? 291 LYS B CA 1 ATOM 8763 C C . LYS B 2 310 ? 52.784 20.735 -18.650 1.00 152.51 ? 291 LYS B C 1 ATOM 8764 O O . LYS B 2 310 ? 53.592 20.598 -17.729 1.00 154.42 ? 291 LYS B O 1 ATOM 8765 C CB . LYS B 2 310 ? 53.892 19.822 -20.700 1.00 152.06 ? 291 LYS B CB 1 ATOM 8766 N N . ASP B 2 311 ? 51.468 20.613 -18.492 1.00 143.59 ? 292 ASP B N 1 ATOM 8767 C CA . ASP B 2 311 ? 50.850 20.370 -17.186 1.00 120.99 ? 292 ASP B CA 1 ATOM 8768 C C . ASP B 2 311 ? 51.302 21.418 -16.154 1.00 121.87 ? 292 ASP B C 1 ATOM 8769 O O . ASP B 2 311 ? 51.711 21.082 -15.042 1.00 114.75 ? 292 ASP B O 1 ATOM 8770 C CB . ASP B 2 311 ? 51.120 18.929 -16.694 1.00 86.18 ? 292 ASP B CB 1 ATOM 8771 C CG . ASP B 2 311 ? 50.630 17.855 -17.694 1.00 93.66 ? 292 ASP B CG 1 ATOM 8772 O OD1 . ASP B 2 311 ? 49.640 18.153 -18.448 1.00 95.78 ? 292 ASP B OD1 1 ATOM 8773 O OD2 . ASP B 2 311 ? 51.217 16.710 -17.727 1.00 99.81 ? 292 ASP B OD2 1 ATOM 8774 N N . LEU B 2 312 ? 51.217 22.689 -16.540 1.00 124.72 ? 293 LEU B N 1 ATOM 8775 C CA . LEU B 2 312 ? 51.692 23.791 -15.706 1.00 127.45 ? 293 LEU B CA 1 ATOM 8776 C C . LEU B 2 312 ? 50.888 23.951 -14.421 1.00 125.41 ? 293 LEU B C 1 ATOM 8777 O O . LEU B 2 312 ? 51.359 23.598 -13.340 1.00 120.83 ? 293 LEU B O 1 ATOM 8778 C CB . LEU B 2 312 ? 51.677 25.102 -16.494 1.00 128.34 ? 293 LEU B CB 1 ATOM 8779 N N . LEU B 2 313 ? 49.680 24.493 -14.544 1.00 123.16 ? 294 LEU B N 1 ATOM 8780 C CA . LEU B 2 313 ? 48.824 24.735 -13.389 1.00 120.30 ? 294 LEU B CA 1 ATOM 8781 C C . LEU B 2 313 ? 47.918 23.537 -13.116 1.00 126.75 ? 294 LEU B C 1 ATOM 8782 O O . LEU B 2 313 ? 47.767 23.115 -11.972 1.00 122.91 ? 294 LEU B O 1 ATOM 8783 C CB . LEU B 2 313 ? 47.990 25.996 -13.604 1.00 120.12 ? 294 LEU B CB 1 ATOM 8784 C CG . LEU B 2 313 ? 47.364 26.611 -12.355 1.00 126.49 ? 294 LEU B CG 1 ATOM 8785 C CD1 . LEU B 2 313 ? 48.434 26.923 -11.315 1.00 128.10 ? 294 LEU B CD1 1 ATOM 8786 C CD2 . LEU B 2 313 ? 46.592 27.866 -12.726 1.00 130.00 ? 294 LEU B CD2 1 ATOM 8787 N N . PHE B 2 314 ? 47.315 23.002 -14.175 1.00 131.15 ? 295 PHE B N 1 ATOM 8788 C CA . PHE B 2 314 ? 46.538 21.767 -14.097 1.00 109.37 ? 295 PHE B CA 1 ATOM 8789 C C . PHE B 2 314 ? 47.052 20.799 -15.155 1.00 113.55 ? 295 PHE B C 1 ATOM 8790 O O . PHE B 2 314 ? 47.741 21.205 -16.091 1.00 113.67 ? 295 PHE B O 1 ATOM 8791 C CB . PHE B 2 314 ? 45.052 22.041 -14.339 1.00 100.19 ? 295 PHE B CB 1 ATOM 8792 C CG . PHE B 2 314 ? 44.431 22.963 -13.331 1.00 112.12 ? 295 PHE B CG 1 ATOM 8793 C CD1 . PHE B 2 314 ? 44.689 22.813 -11.981 1.00 117.42 ? 295 PHE B CD1 1 ATOM 8794 C CD2 . PHE B 2 314 ? 43.589 23.986 -13.736 1.00 121.56 ? 295 PHE B CD2 1 ATOM 8795 C CE1 . PHE B 2 314 ? 44.118 23.663 -11.051 1.00 127.42 ? 295 PHE B CE1 1 ATOM 8796 C CE2 . PHE B 2 314 ? 43.015 24.840 -12.811 1.00 129.50 ? 295 PHE B CE2 1 ATOM 8797 C CZ . PHE B 2 314 ? 43.280 24.678 -11.467 1.00 130.99 ? 295 PHE B CZ 1 ATOM 8798 N N . LYS B 2 315 ? 46.722 19.521 -15.009 1.00 121.21 ? 296 LYS B N 1 ATOM 8799 C CA . LYS B 2 315 ? 47.105 18.528 -16.006 1.00 116.84 ? 296 LYS B CA 1 ATOM 8800 C C . LYS B 2 315 ? 46.415 18.835 -17.336 1.00 117.69 ? 296 LYS B C 1 ATOM 8801 O O . LYS B 2 315 ? 45.224 19.146 -17.366 1.00 114.09 ? 296 LYS B O 1 ATOM 8802 C CB . LYS B 2 315 ? 46.749 17.119 -15.525 1.00 107.47 ? 296 LYS B CB 1 ATOM 8803 N N . ASP B 2 316 ? 47.170 18.758 -18.429 1.00 123.82 ? 297 ASP B N 1 ATOM 8804 C CA . ASP B 2 316 ? 46.644 19.064 -19.761 1.00 127.03 ? 297 ASP B CA 1 ATOM 8805 C C . ASP B 2 316 ? 45.569 18.079 -20.209 1.00 114.92 ? 297 ASP B C 1 ATOM 8806 O O . ASP B 2 316 ? 44.784 18.375 -21.112 1.00 108.25 ? 297 ASP B O 1 ATOM 8807 C CB . ASP B 2 316 ? 47.768 19.091 -20.802 1.00 129.44 ? 297 ASP B CB 1 ATOM 8808 C CG . ASP B 2 316 ? 48.547 20.392 -20.794 1.00 135.28 ? 297 ASP B CG 1 ATOM 8809 O OD1 . ASP B 2 316 ? 48.805 20.935 -19.699 1.00 137.31 ? 297 ASP B OD1 1 ATOM 8810 O OD2 . ASP B 2 316 ? 48.902 20.872 -21.891 1.00 142.63 ? 297 ASP B OD2 1 ATOM 8811 N N . SER B 2 317 ? 45.541 16.908 -19.580 1.00 95.98 ? 298 SER B N 1 ATOM 8812 C CA . SER B 2 317 ? 44.598 15.863 -19.957 1.00 98.74 ? 298 SER B CA 1 ATOM 8813 C C . SER B 2 317 ? 43.198 16.142 -19.421 1.00 92.79 ? 298 SER B C 1 ATOM 8814 O O . SER B 2 317 ? 42.236 15.471 -19.799 1.00 84.58 ? 298 SER B O 1 ATOM 8815 C CB . SER B 2 317 ? 45.087 14.501 -19.455 1.00 109.41 ? 298 SER B CB 1 ATOM 8816 O OG . SER B 2 317 ? 44.149 13.479 -19.748 1.00 112.43 ? 298 SER B OG 1 ATOM 8817 N N . ALA B 2 318 ? 43.091 17.140 -18.547 1.00 89.84 ? 299 ALA B N 1 ATOM 8818 C CA . ALA B 2 318 ? 41.840 17.428 -17.848 1.00 97.20 ? 299 ALA B CA 1 ATOM 8819 C C . ALA B 2 318 ? 40.665 17.736 -18.779 1.00 98.72 ? 299 ALA B C 1 ATOM 8820 O O . ALA B 2 318 ? 40.849 18.215 -19.897 1.00 98.81 ? 299 ALA B O 1 ATOM 8821 C CB . ALA B 2 318 ? 42.040 18.558 -16.839 1.00 100.82 ? 299 ALA B CB 1 ATOM 8822 N N . HIS B 2 319 ? 39.459 17.434 -18.308 1.00 95.04 ? 300 HIS B N 1 ATOM 8823 C CA . HIS B 2 319 ? 38.233 17.707 -19.049 1.00 99.15 ? 300 HIS B CA 1 ATOM 8824 C C . HIS B 2 319 ? 37.289 18.560 -18.211 1.00 105.72 ? 300 HIS B C 1 ATOM 8825 O O . HIS B 2 319 ? 36.165 18.850 -18.625 1.00 105.65 ? 300 HIS B O 1 ATOM 8826 C CB . HIS B 2 319 ? 37.530 16.405 -19.439 1.00 100.00 ? 300 HIS B CB 1 ATOM 8827 C CG . HIS B 2 319 ? 38.209 15.654 -20.542 1.00 108.51 ? 300 HIS B CG 1 ATOM 8828 N ND1 . HIS B 2 319 ? 39.512 15.896 -20.916 1.00 114.55 ? 300 HIS B ND1 1 ATOM 8829 C CD2 . HIS B 2 319 ? 37.761 14.669 -21.354 1.00 114.01 ? 300 HIS B CD2 1 ATOM 8830 C CE1 . HIS B 2 319 ? 39.840 15.090 -21.910 1.00 120.43 ? 300 HIS B CE1 1 ATOM 8831 N NE2 . HIS B 2 319 ? 38.794 14.335 -22.195 1.00 120.29 ? 300 HIS B NE2 1 ATOM 8832 N N . GLY B 2 320 ? 37.752 18.953 -17.028 1.00 107.86 ? 301 GLY B N 1 ATOM 8833 C CA . GLY B 2 320 ? 36.959 19.764 -16.124 1.00 110.59 ? 301 GLY B CA 1 ATOM 8834 C C . GLY B 2 320 ? 37.119 19.333 -14.678 1.00 101.36 ? 301 GLY B C 1 ATOM 8835 O O . GLY B 2 320 ? 37.987 18.524 -14.358 1.00 91.94 ? 301 GLY B O 1 ATOM 8836 N N . PHE B 2 321 ? 36.270 19.863 -13.805 1.00 103.33 ? 302 PHE B N 1 ATOM 8837 C CA . PHE B 2 321 ? 36.393 19.602 -12.377 1.00 102.04 ? 302 PHE B CA 1 ATOM 8838 C C . PHE B 2 321 ? 35.114 19.064 -11.745 1.00 104.47 ? 302 PHE B C 1 ATOM 8839 O O . PHE B 2 321 ? 34.009 19.355 -12.202 1.00 102.20 ? 302 PHE B O 1 ATOM 8840 C CB . PHE B 2 321 ? 36.832 20.868 -11.647 1.00 113.64 ? 302 PHE B CB 1 ATOM 8841 C CG . PHE B 2 321 ? 38.100 21.460 -12.179 1.00 124.98 ? 302 PHE B CG 1 ATOM 8842 C CD1 . PHE B 2 321 ? 39.329 20.952 -11.797 1.00 127.89 ? 302 PHE B CD1 1 ATOM 8843 C CD2 . PHE B 2 321 ? 38.064 22.524 -13.061 1.00 128.82 ? 302 PHE B CD2 1 ATOM 8844 C CE1 . PHE B 2 321 ? 40.500 21.496 -12.285 1.00 128.79 ? 302 PHE B CE1 1 ATOM 8845 C CE2 . PHE B 2 321 ? 39.231 23.070 -13.553 1.00 134.06 ? 302 PHE B CE2 1 ATOM 8846 C CZ . PHE B 2 321 ? 40.451 22.556 -13.163 1.00 132.92 ? 302 PHE B CZ 1 ATOM 8847 N N . LEU B 2 322 ? 35.284 18.274 -10.689 1.00 102.79 ? 303 LEU B N 1 ATOM 8848 C CA . LEU B 2 322 ? 34.167 17.771 -9.901 1.00 88.82 ? 303 LEU B CA 1 ATOM 8849 C C . LEU B 2 322 ? 34.394 18.099 -8.433 1.00 94.68 ? 303 LEU B C 1 ATOM 8850 O O . LEU B 2 322 ? 35.535 18.153 -7.972 1.00 104.52 ? 303 LEU B O 1 ATOM 8851 C CB . LEU B 2 322 ? 34.019 16.261 -10.081 1.00 74.16 ? 303 LEU B CB 1 ATOM 8852 C CG . LEU B 2 322 ? 33.511 15.770 -11.437 1.00 82.88 ? 303 LEU B CG 1 ATOM 8853 C CD1 . LEU B 2 322 ? 33.530 14.250 -11.493 1.00 81.40 ? 303 LEU B CD1 1 ATOM 8854 C CD2 . LEU B 2 322 ? 32.110 16.300 -11.711 1.00 81.45 ? 303 LEU B CD2 1 ATOM 8855 N N . LYS B 2 323 ? 33.308 18.325 -7.702 1.00 89.89 ? 304 LYS B N 1 ATOM 8856 C CA . LYS B 2 323 ? 33.398 18.629 -6.278 1.00 83.22 ? 304 LYS B CA 1 ATOM 8857 C C . LYS B 2 323 ? 33.527 17.354 -5.452 1.00 83.84 ? 304 LYS B C 1 ATOM 8858 O O . LYS B 2 323 ? 32.740 16.420 -5.613 1.00 83.72 ? 304 LYS B O 1 ATOM 8859 C CB . LYS B 2 323 ? 32.174 19.425 -5.815 1.00 74.26 ? 304 LYS B CB 1 ATOM 8860 N N . VAL B 2 324 ? 34.525 17.316 -4.576 1.00 84.02 ? 305 VAL B N 1 ATOM 8861 C CA . VAL B 2 324 ? 34.671 16.206 -3.645 1.00 83.13 ? 305 VAL B CA 1 ATOM 8862 C C . VAL B 2 324 ? 33.581 16.300 -2.586 1.00 92.46 ? 305 VAL B C 1 ATOM 8863 O O . VAL B 2 324 ? 33.433 17.340 -1.943 1.00 105.11 ? 305 VAL B O 1 ATOM 8864 C CB . VAL B 2 324 ? 36.048 16.215 -2.952 1.00 71.52 ? 305 VAL B CB 1 ATOM 8865 C CG1 . VAL B 2 324 ? 36.113 15.136 -1.881 1.00 81.58 ? 305 VAL B CG1 1 ATOM 8866 C CG2 . VAL B 2 324 ? 37.157 16.025 -3.966 1.00 62.06 ? 305 VAL B CG2 1 ATOM 8867 N N . PRO B 2 325 ? 32.810 15.214 -2.409 1.00 80.29 ? 306 PRO B N 1 ATOM 8868 C CA . PRO B 2 325 ? 31.709 15.143 -1.441 1.00 82.60 ? 306 PRO B CA 1 ATOM 8869 C C . PRO B 2 325 ? 32.139 15.582 -0.043 1.00 98.77 ? 306 PRO B C 1 ATOM 8870 O O . PRO B 2 325 ? 33.307 15.418 0.311 1.00 99.65 ? 306 PRO B O 1 ATOM 8871 C CB . PRO B 2 325 ? 31.342 13.659 -1.447 1.00 85.75 ? 306 PRO B CB 1 ATOM 8872 C CG . PRO B 2 325 ? 31.701 13.204 -2.815 1.00 86.69 ? 306 PRO B CG 1 ATOM 8873 C CD . PRO B 2 325 ? 32.941 13.966 -3.182 1.00 76.08 ? 306 PRO B CD 1 ATOM 8874 N N . PRO B 2 326 ? 31.201 16.144 0.736 1.00 110.28 ? 307 PRO B N 1 ATOM 8875 C CA . PRO B 2 326 ? 31.452 16.720 2.063 1.00 113.04 ? 307 PRO B CA 1 ATOM 8876 C C . PRO B 2 326 ? 32.120 15.756 3.043 1.00 110.30 ? 307 PRO B C 1 ATOM 8877 O O . PRO B 2 326 ? 33.168 16.083 3.605 1.00 101.91 ? 307 PRO B O 1 ATOM 8878 C CB . PRO B 2 326 ? 30.045 17.063 2.560 1.00 114.11 ? 307 PRO B CB 1 ATOM 8879 C CG . PRO B 2 326 ? 29.252 17.272 1.324 1.00 110.49 ? 307 PRO B CG 1 ATOM 8880 C CD . PRO B 2 326 ? 29.791 16.290 0.334 1.00 107.11 ? 307 PRO B CD 1 ATOM 8881 N N . ARG B 2 327 ? 31.520 14.583 3.233 1.00 108.29 ? 308 ARG B N 1 ATOM 8882 C CA . ARG B 2 327 ? 31.961 13.631 4.253 1.00 104.33 ? 308 ARG B CA 1 ATOM 8883 C C . ARG B 2 327 ? 33.260 12.918 3.884 1.00 90.70 ? 308 ARG B C 1 ATOM 8884 O O . ARG B 2 327 ? 33.646 11.946 4.529 1.00 90.18 ? 308 ARG B O 1 ATOM 8885 C CB . ARG B 2 327 ? 30.861 12.598 4.522 1.00 111.77 ? 308 ARG B CB 1 ATOM 8886 C CG . ARG B 2 327 ? 30.721 12.175 5.983 1.00 116.07 ? 308 ARG B CG 1 ATOM 8887 C CD . ARG B 2 327 ? 31.174 10.738 6.207 1.00 108.69 ? 308 ARG B CD 1 ATOM 8888 N NE . ARG B 2 327 ? 32.568 10.653 6.639 1.00 107.27 ? 308 ARG B NE 1 ATOM 8889 C CZ . ARG B 2 327 ? 32.951 10.306 7.864 1.00 98.65 ? 308 ARG B CZ 1 ATOM 8890 N NH1 . ARG B 2 327 ? 32.042 10.006 8.781 1.00 91.35 ? 308 ARG B NH1 1 ATOM 8891 N NH2 . ARG B 2 327 ? 34.240 10.253 8.173 1.00 95.25 ? 308 ARG B NH2 1 ATOM 8892 N N . MET B 2 328 ? 33.934 13.405 2.849 1.00 83.72 ? 309 MET B N 1 ATOM 8893 C CA . MET B 2 328 ? 35.170 12.791 2.386 1.00 79.28 ? 309 MET B CA 1 ATOM 8894 C C . MET B 2 328 ? 36.395 13.483 2.980 1.00 82.41 ? 309 MET B C 1 ATOM 8895 O O . MET B 2 328 ? 36.684 14.636 2.663 1.00 94.37 ? 309 MET B O 1 ATOM 8896 C CB . MET B 2 328 ? 35.240 12.831 0.856 1.00 73.90 ? 309 MET B CB 1 ATOM 8897 C CG . MET B 2 328 ? 36.428 12.089 0.261 1.00 65.69 ? 309 MET B CG 1 ATOM 8898 S SD . MET B 2 328 ? 36.030 10.405 -0.249 1.00 98.77 ? 309 MET B SD 1 ATOM 8899 C CE . MET B 2 328 ? 34.942 10.729 -1.630 1.00 52.81 ? 309 MET B CE 1 ATOM 8900 N N . ASP B 2 329 ? 37.105 12.777 3.851 1.00 77.16 ? 310 ASP B N 1 ATOM 8901 C CA . ASP B 2 329 ? 38.396 13.248 4.336 1.00 75.97 ? 310 ASP B CA 1 ATOM 8902 C C . ASP B 2 329 ? 39.485 12.685 3.434 1.00 76.26 ? 310 ASP B C 1 ATOM 8903 O O . ASP B 2 329 ? 39.195 11.923 2.512 1.00 78.30 ? 310 ASP B O 1 ATOM 8904 C CB . ASP B 2 329 ? 38.628 12.826 5.791 1.00 81.48 ? 310 ASP B CB 1 ATOM 8905 C CG . ASP B 2 329 ? 38.396 11.341 6.016 1.00 90.15 ? 310 ASP B CG 1 ATOM 8906 O OD1 . ASP B 2 329 ? 39.159 10.529 5.454 1.00 82.76 ? 310 ASP B OD1 1 ATOM 8907 O OD2 . ASP B 2 329 ? 37.457 10.987 6.763 1.00 94.19 ? 310 ASP B OD2 1 ATOM 8908 N N . ALA B 2 330 ? 40.733 13.049 3.704 1.00 69.98 ? 311 ALA B N 1 ATOM 8909 C CA . ALA B 2 330 ? 41.847 12.615 2.865 1.00 66.26 ? 311 ALA B CA 1 ATOM 8910 C C . ALA B 2 330 ? 42.010 11.095 2.786 1.00 66.34 ? 311 ALA B C 1 ATOM 8911 O O . ALA B 2 330 ? 42.048 10.531 1.692 1.00 63.64 ? 311 ALA B O 1 ATOM 8912 C CB . ALA B 2 330 ? 43.137 13.257 3.325 1.00 55.03 ? 311 ALA B CB 1 ATOM 8913 N N . LYS B 2 331 ? 42.112 10.438 3.938 1.00 62.67 ? 312 LYS B N 1 ATOM 8914 C CA . LYS B 2 331 ? 42.365 9.000 3.961 1.00 65.95 ? 312 LYS B CA 1 ATOM 8915 C C . LYS B 2 331 ? 41.253 8.202 3.274 1.00 59.03 ? 312 LYS B C 1 ATOM 8916 O O . LYS B 2 331 ? 41.518 7.205 2.601 1.00 54.23 ? 312 LYS B O 1 ATOM 8917 C CB . LYS B 2 331 ? 42.622 8.501 5.388 1.00 72.64 ? 312 LYS B CB 1 ATOM 8918 C CG . LYS B 2 331 ? 41.528 8.828 6.382 1.00 82.42 ? 312 LYS B CG 1 ATOM 8919 C CD . LYS B 2 331 ? 41.911 8.413 7.792 1.00 86.11 ? 312 LYS B CD 1 ATOM 8920 C CE . LYS B 2 331 ? 43.214 9.060 8.218 1.00 85.52 ? 312 LYS B CE 1 ATOM 8921 N NZ . LYS B 2 331 ? 43.536 8.778 9.642 1.00 87.66 ? 312 LYS B NZ 1 ATOM 8922 N N . MET B 2 332 ? 40.014 8.656 3.420 1.00 57.20 ? 313 MET B N 1 ATOM 8923 C CA . MET B 2 332 ? 38.901 8.029 2.721 1.00 59.42 ? 313 MET B CA 1 ATOM 8924 C C . MET B 2 332 ? 38.975 8.323 1.225 1.00 64.39 ? 313 MET B C 1 ATOM 8925 O O . MET B 2 332 ? 38.437 7.576 0.412 1.00 67.09 ? 313 MET B O 1 ATOM 8926 C CB . MET B 2 332 ? 37.562 8.513 3.277 1.00 64.95 ? 313 MET B CB 1 ATOM 8927 C CG . MET B 2 332 ? 36.380 7.696 2.790 1.00 63.82 ? 313 MET B CG 1 ATOM 8928 S SD . MET B 2 332 ? 34.792 8.501 3.018 1.00 64.36 ? 313 MET B SD 1 ATOM 8929 C CE . MET B 2 332 ? 34.685 8.570 4.803 1.00 65.84 ? 313 MET B CE 1 ATOM 8930 N N . TYR B 2 333 ? 39.647 9.411 0.866 1.00 63.51 ? 314 TYR B N 1 ATOM 8931 C CA . TYR B 2 333 ? 39.735 9.820 -0.530 1.00 63.47 ? 314 TYR B CA 1 ATOM 8932 C C . TYR B 2 333 ? 40.861 9.082 -1.241 1.00 62.85 ? 314 TYR B C 1 ATOM 8933 O O . TYR B 2 333 ? 40.700 8.618 -2.371 1.00 64.03 ? 314 TYR B O 1 ATOM 8934 C CB . TYR B 2 333 ? 39.928 11.334 -0.632 1.00 66.13 ? 314 TYR B CB 1 ATOM 8935 C CG . TYR B 2 333 ? 39.764 11.878 -2.030 1.00 69.62 ? 314 TYR B CG 1 ATOM 8936 C CD1 . TYR B 2 333 ? 38.509 11.960 -2.621 1.00 73.10 ? 314 TYR B CD1 1 ATOM 8937 C CD2 . TYR B 2 333 ? 40.863 12.315 -2.759 1.00 71.60 ? 314 TYR B CD2 1 ATOM 8938 C CE1 . TYR B 2 333 ? 38.355 12.458 -3.904 1.00 79.11 ? 314 TYR B CE1 1 ATOM 8939 C CE2 . TYR B 2 333 ? 40.718 12.816 -4.041 1.00 72.09 ? 314 TYR B CE2 1 ATOM 8940 C CZ . TYR B 2 333 ? 39.464 12.885 -4.607 1.00 74.79 ? 314 TYR B CZ 1 ATOM 8941 O OH . TYR B 2 333 ? 39.323 13.379 -5.879 1.00 71.27 ? 314 TYR B OH 1 ATOM 8942 N N . LEU B 2 334 ? 42.001 8.973 -0.569 1.00 65.54 ? 315 LEU B N 1 ATOM 8943 C CA . LEU B 2 334 ? 43.138 8.226 -1.095 1.00 67.42 ? 315 LEU B CA 1 ATOM 8944 C C . LEU B 2 334 ? 42.893 6.717 -1.050 1.00 69.15 ? 315 LEU B C 1 ATOM 8945 O O . LEU B 2 334 ? 43.339 5.980 -1.931 1.00 69.79 ? 315 LEU B O 1 ATOM 8946 C CB . LEU B 2 334 ? 44.399 8.576 -0.308 1.00 64.01 ? 315 LEU B CB 1 ATOM 8947 C CG . LEU B 2 334 ? 44.817 10.038 -0.418 1.00 57.19 ? 315 LEU B CG 1 ATOM 8948 C CD1 . LEU B 2 334 ? 45.794 10.410 0.687 1.00 56.02 ? 315 LEU B CD1 1 ATOM 8949 C CD2 . LEU B 2 334 ? 45.429 10.281 -1.781 1.00 64.87 ? 315 LEU B CD2 1 ATOM 8950 N N . GLY B 2 335 ? 42.190 6.259 -0.018 1.00 65.73 ? 316 GLY B N 1 ATOM 8951 C CA . GLY B 2 335 ? 41.861 4.850 0.112 1.00 60.29 ? 316 GLY B CA 1 ATOM 8952 C C . GLY B 2 335 ? 42.714 4.101 1.121 1.00 61.94 ? 316 GLY B C 1 ATOM 8953 O O . GLY B 2 335 ? 43.858 4.475 1.387 1.00 61.29 ? 316 GLY B O 1 ATOM 8954 N N . TYR B 2 336 ? 42.151 3.035 1.683 1.00 50.49 ? 317 TYR B N 1 ATOM 8955 C CA . TYR B 2 336 ? 42.853 2.216 2.665 1.00 53.77 ? 317 TYR B CA 1 ATOM 8956 C C . TYR B 2 336 ? 44.158 1.644 2.113 1.00 57.43 ? 317 TYR B C 1 ATOM 8957 O O . TYR B 2 336 ? 45.193 1.707 2.773 1.00 52.61 ? 317 TYR B O 1 ATOM 8958 C CB . TYR B 2 336 ? 41.951 1.085 3.169 1.00 50.81 ? 317 TYR B CB 1 ATOM 8959 C CG . TYR B 2 336 ? 42.608 0.189 4.199 1.00 56.54 ? 317 TYR B CG 1 ATOM 8960 C CD1 . TYR B 2 336 ? 42.864 0.650 5.487 1.00 68.95 ? 317 TYR B CD1 1 ATOM 8961 C CD2 . TYR B 2 336 ? 42.967 -1.118 3.888 1.00 45.19 ? 317 TYR B CD2 1 ATOM 8962 C CE1 . TYR B 2 336 ? 43.465 -0.163 6.436 1.00 59.65 ? 317 TYR B CE1 1 ATOM 8963 C CE2 . TYR B 2 336 ? 43.568 -1.938 4.830 1.00 50.90 ? 317 TYR B CE2 1 ATOM 8964 C CZ . TYR B 2 336 ? 43.814 -1.453 6.102 1.00 55.32 ? 317 TYR B CZ 1 ATOM 8965 O OH . TYR B 2 336 ? 44.409 -2.257 7.044 1.00 58.01 ? 317 TYR B OH 1 ATOM 8966 N N . GLU B 2 337 ? 44.102 1.095 0.902 1.00 51.89 ? 318 GLU B N 1 ATOM 8967 C CA . GLU B 2 337 ? 45.277 0.500 0.269 1.00 52.52 ? 318 GLU B CA 1 ATOM 8968 C C . GLU B 2 337 ? 46.404 1.505 0.059 1.00 66.60 ? 318 GLU B C 1 ATOM 8969 O O . GLU B 2 337 ? 47.551 1.241 0.422 1.00 67.22 ? 318 GLU B O 1 ATOM 8970 C CB . GLU B 2 337 ? 44.910 -0.146 -1.070 1.00 49.97 ? 318 GLU B CB 1 ATOM 8971 C CG . GLU B 2 337 ? 44.171 -1.466 -0.946 1.00 54.87 ? 318 GLU B CG 1 ATOM 8972 C CD . GLU B 2 337 ? 42.715 -1.292 -0.560 1.00 68.64 ? 318 GLU B CD 1 ATOM 8973 O OE1 . GLU B 2 337 ? 42.189 -0.169 -0.725 1.00 79.02 ? 318 GLU B OE1 1 ATOM 8974 O OE2 . GLU B 2 337 ? 42.100 -2.278 -0.094 1.00 66.40 ? 318 GLU B OE2 1 ATOM 8975 N N . TYR B 2 338 ? 46.077 2.651 -0.532 1.00 67.66 ? 319 TYR B N 1 ATOM 8976 C CA . TYR B 2 338 ? 47.087 3.658 -0.829 1.00 57.96 ? 319 TYR B CA 1 ATOM 8977 C C . TYR B 2 338 ? 47.702 4.220 0.447 1.00 69.84 ? 319 TYR B C 1 ATOM 8978 O O . TYR B 2 338 ? 48.926 4.263 0.586 1.00 76.42 ? 319 TYR B O 1 ATOM 8979 C CB . TYR B 2 338 ? 46.517 4.793 -1.689 1.00 57.33 ? 319 TYR B CB 1 ATOM 8980 C CG . TYR B 2 338 ? 47.574 5.798 -2.109 1.00 55.67 ? 319 TYR B CG 1 ATOM 8981 C CD1 . TYR B 2 338 ? 48.458 5.506 -3.136 1.00 60.12 ? 319 TYR B CD1 1 ATOM 8982 C CD2 . TYR B 2 338 ? 47.700 7.023 -1.467 1.00 47.01 ? 319 TYR B CD2 1 ATOM 8983 C CE1 . TYR B 2 338 ? 49.430 6.402 -3.522 1.00 60.93 ? 319 TYR B CE1 1 ATOM 8984 C CE2 . TYR B 2 338 ? 48.676 7.931 -1.849 1.00 54.18 ? 319 TYR B CE2 1 ATOM 8985 C CZ . TYR B 2 338 ? 49.538 7.612 -2.879 1.00 60.55 ? 319 TYR B CZ 1 ATOM 8986 O OH . TYR B 2 338 ? 50.514 8.495 -3.276 1.00 57.64 ? 319 TYR B OH 1 ATOM 8987 N N . VAL B 2 339 ? 46.847 4.645 1.373 1.00 65.33 ? 320 VAL B N 1 ATOM 8988 C CA . VAL B 2 339 ? 47.300 5.185 2.650 1.00 60.65 ? 320 VAL B CA 1 ATOM 8989 C C . VAL B 2 339 ? 48.215 4.197 3.367 1.00 64.87 ? 320 VAL B C 1 ATOM 8990 O O . VAL B 2 339 ? 49.262 4.579 3.886 1.00 74.64 ? 320 VAL B O 1 ATOM 8991 C CB . VAL B 2 339 ? 46.110 5.577 3.560 1.00 68.27 ? 320 VAL B CB 1 ATOM 8992 C CG1 . VAL B 2 339 ? 46.580 5.842 4.981 1.00 47.27 ? 320 VAL B CG1 1 ATOM 8993 C CG2 . VAL B 2 339 ? 45.394 6.801 2.999 1.00 70.11 ? 320 VAL B CG2 1 ATOM 8994 N N . THR B 2 340 ? 47.825 2.926 3.371 1.00 58.71 ? 321 THR B N 1 ATOM 8995 C CA . THR B 2 340 ? 48.628 1.873 3.981 1.00 60.08 ? 321 THR B CA 1 ATOM 8996 C C . THR B 2 340 ? 50.011 1.790 3.349 1.00 67.55 ? 321 THR B C 1 ATOM 8997 O O . THR B 2 340 ? 51.020 1.693 4.047 1.00 66.32 ? 321 THR B O 1 ATOM 8998 C CB . THR B 2 340 ? 47.951 0.501 3.844 1.00 56.69 ? 321 THR B CB 1 ATOM 8999 O OG1 . THR B 2 340 ? 46.720 0.501 4.576 1.00 68.50 ? 321 THR B OG1 1 ATOM 9000 C CG2 . THR B 2 340 ? 48.851 -0.593 4.384 1.00 53.47 ? 321 THR B CG2 1 ATOM 9001 N N . ALA B 2 341 ? 50.047 1.839 2.022 1.00 65.81 ? 322 ALA B N 1 ATOM 9002 C CA . ALA B 2 341 ? 51.290 1.668 1.284 1.00 57.04 ? 322 ALA B CA 1 ATOM 9003 C C . ALA B 2 341 ? 52.258 2.812 1.542 1.00 60.38 ? 322 ALA B C 1 ATOM 9004 O O . ALA B 2 341 ? 53.435 2.592 1.822 1.00 74.68 ? 322 ALA B O 1 ATOM 9005 C CB . ALA B 2 341 ? 51.004 1.538 -0.203 1.00 55.72 ? 322 ALA B CB 1 ATOM 9006 N N . ILE B 2 342 ? 51.754 4.035 1.446 1.00 61.00 ? 323 ILE B N 1 ATOM 9007 C CA . ILE B 2 342 ? 52.583 5.223 1.613 1.00 70.77 ? 323 ILE B CA 1 ATOM 9008 C C . ILE B 2 342 ? 53.074 5.360 3.053 1.00 79.43 ? 323 ILE B C 1 ATOM 9009 O O . ILE B 2 342 ? 54.229 5.708 3.295 1.00 81.79 ? 323 ILE B O 1 ATOM 9010 C CB . ILE B 2 342 ? 51.817 6.495 1.191 1.00 66.20 ? 323 ILE B CB 1 ATOM 9011 C CG1 . ILE B 2 342 ? 51.343 6.373 -0.258 1.00 75.36 ? 323 ILE B CG1 1 ATOM 9012 C CG2 . ILE B 2 342 ? 52.681 7.721 1.358 1.00 60.36 ? 323 ILE B CG2 1 ATOM 9013 C CD1 . ILE B 2 342 ? 52.460 6.171 -1.260 1.00 76.21 ? 323 ILE B CD1 1 ATOM 9014 N N . ARG B 2 343 ? 52.188 5.074 4.003 1.00 86.26 ? 324 ARG B N 1 ATOM 9015 C CA . ARG B 2 343 ? 52.518 5.135 5.423 1.00 83.03 ? 324 ARG B CA 1 ATOM 9016 C C . ARG B 2 343 ? 53.661 4.178 5.748 1.00 72.66 ? 324 ARG B C 1 ATOM 9017 O O . ARG B 2 343 ? 54.576 4.522 6.497 1.00 71.80 ? 324 ARG B O 1 ATOM 9018 C CB . ARG B 2 343 ? 51.283 4.800 6.263 1.00 85.56 ? 324 ARG B CB 1 ATOM 9019 C CG . ARG B 2 343 ? 51.446 5.012 7.755 1.00 89.51 ? 324 ARG B CG 1 ATOM 9020 C CD . ARG B 2 343 ? 50.221 4.516 8.508 1.00 94.59 ? 324 ARG B CD 1 ATOM 9021 N NE . ARG B 2 343 ? 49.847 3.167 8.089 1.00 109.58 ? 324 ARG B NE 1 ATOM 9022 C CZ . ARG B 2 343 ? 50.409 2.052 8.550 1.00 109.50 ? 324 ARG B CZ 1 ATOM 9023 N NH1 . ARG B 2 343 ? 51.381 2.118 9.452 1.00 111.92 ? 324 ARG B NH1 1 ATOM 9024 N NH2 . ARG B 2 343 ? 50.001 0.869 8.106 1.00 95.00 ? 324 ARG B NH2 1 ATOM 9025 N N . ASN B 2 344 ? 53.600 2.979 5.176 1.00 57.90 ? 325 ASN B N 1 ATOM 9026 C CA . ASN B 2 344 ? 54.685 2.011 5.287 1.00 65.06 ? 325 ASN B CA 1 ATOM 9027 C C . ASN B 2 344 ? 55.969 2.590 4.725 1.00 65.27 ? 325 ASN B C 1 ATOM 9028 O O . ASN B 2 344 ? 57.042 2.424 5.293 1.00 77.12 ? 325 ASN B O 1 ATOM 9029 C CB . ASN B 2 344 ? 54.346 0.723 4.526 1.00 47.10 ? 325 ASN B CB 1 ATOM 9030 C CG . ASN B 2 344 ? 53.473 -0.227 5.328 1.00 76.47 ? 325 ASN B CG 1 ATOM 9031 O OD1 . ASN B 2 344 ? 53.036 0.089 6.434 1.00 76.41 ? 325 ASN B OD1 1 ATOM 9032 N ND2 . ASN B 2 344 ? 53.214 -1.402 4.766 1.00 65.83 ? 325 ASN B ND2 1 ATOM 9033 N N . LEU B 2 345 ? 55.839 3.281 3.600 1.00 75.31 ? 326 LEU B N 1 ATOM 9034 C CA . LEU B 2 345 ? 56.985 3.803 2.873 1.00 78.28 ? 326 LEU B CA 1 ATOM 9035 C C . LEU B 2 345 ? 57.689 4.920 3.636 1.00 83.38 ? 326 LEU B C 1 ATOM 9036 O O . LEU B 2 345 ? 58.889 5.139 3.465 1.00 91.90 ? 326 LEU B O 1 ATOM 9037 C CB . LEU B 2 345 ? 56.537 4.304 1.501 1.00 70.01 ? 326 LEU B CB 1 ATOM 9038 C CG . LEU B 2 345 ? 57.399 3.872 0.320 1.00 66.14 ? 326 LEU B CG 1 ATOM 9039 C CD1 . LEU B 2 345 ? 57.637 2.370 0.365 1.00 71.10 ? 326 LEU B CD1 1 ATOM 9040 C CD2 . LEU B 2 345 ? 56.727 4.278 -0.979 1.00 57.51 ? 326 LEU B CD2 1 ATOM 9041 N N . ARG B 2 346 ? 56.941 5.623 4.480 1.00 80.87 ? 327 ARG B N 1 ATOM 9042 C CA . ARG B 2 346 ? 57.492 6.749 5.225 1.00 91.14 ? 327 ARG B CA 1 ATOM 9043 C C . ARG B 2 346 ? 57.891 6.362 6.645 1.00 87.58 ? 327 ARG B C 1 ATOM 9044 O O . ARG B 2 346 ? 59.059 6.452 7.020 1.00 91.20 ? 327 ARG B O 1 ATOM 9045 C CB . ARG B 2 346 ? 56.494 7.909 5.257 1.00 98.44 ? 327 ARG B CB 1 ATOM 9046 C CG . ARG B 2 346 ? 56.116 8.434 3.884 1.00 97.21 ? 327 ARG B CG 1 ATOM 9047 C CD . ARG B 2 346 ? 55.139 9.589 3.986 1.00 108.10 ? 327 ARG B CD 1 ATOM 9048 N NE . ARG B 2 346 ? 54.589 9.946 2.682 1.00 121.47 ? 327 ARG B NE 1 ATOM 9049 C CZ . ARG B 2 346 ? 55.042 10.934 1.918 1.00 123.83 ? 327 ARG B CZ 1 ATOM 9050 N NH1 . ARG B 2 346 ? 56.055 11.686 2.329 1.00 128.08 ? 327 ARG B NH1 1 ATOM 9051 N NH2 . ARG B 2 346 ? 54.471 11.179 0.745 1.00 117.21 ? 327 ARG B NH2 1 ATOM 9052 N N . GLU B 2 347 ? 56.911 5.930 7.429 1.00 84.39 ? 328 GLU B N 1 ATOM 9053 C CA . GLU B 2 347 ? 57.147 5.576 8.823 1.00 89.84 ? 328 GLU B CA 1 ATOM 9054 C C . GLU B 2 347 ? 58.040 4.347 8.958 1.00 92.35 ? 328 GLU B C 1 ATOM 9055 O O . GLU B 2 347 ? 58.831 4.247 9.896 1.00 84.49 ? 328 GLU B O 1 ATOM 9056 C CB . GLU B 2 347 ? 55.815 5.369 9.546 1.00 89.08 ? 328 GLU B CB 1 ATOM 9057 C CG . GLU B 2 347 ? 54.966 6.630 9.591 1.00 94.21 ? 328 GLU B CG 1 ATOM 9058 C CD . GLU B 2 347 ? 53.583 6.398 10.159 1.00 93.48 ? 328 GLU B CD 1 ATOM 9059 O OE1 . GLU B 2 347 ? 52.790 7.365 10.195 1.00 89.01 ? 328 GLU B OE1 1 ATOM 9060 O OE2 . GLU B 2 347 ? 53.289 5.252 10.565 1.00 91.12 ? 328 GLU B OE2 1 ATOM 9061 N N . GLY B 2 348 ? 57.910 3.417 8.017 1.00 89.99 ? 329 GLY B N 1 ATOM 9062 C CA . GLY B 2 348 ? 58.753 2.234 7.984 1.00 88.77 ? 329 GLY B CA 1 ATOM 9063 C C . GLY B 2 348 ? 58.574 1.314 9.177 1.00 95.54 ? 329 GLY B C 1 ATOM 9064 O O . GLY B 2 348 ? 59.407 0.443 9.429 1.00 98.16 ? 329 GLY B O 1 ATOM 9065 N N . THR B 2 349 ? 57.482 1.503 9.909 1.00 97.36 ? 330 THR B N 1 ATOM 9066 C CA . THR B 2 349 ? 57.215 0.703 11.098 1.00 103.45 ? 330 THR B CA 1 ATOM 9067 C C . THR B 2 349 ? 56.606 -0.659 10.762 1.00 95.77 ? 330 THR B C 1 ATOM 9068 O O . THR B 2 349 ? 55.452 -0.753 10.340 1.00 85.90 ? 330 THR B O 1 ATOM 9069 C CB . THR B 2 349 ? 56.308 1.456 12.094 1.00 110.85 ? 330 THR B CB 1 ATOM 9070 O OG1 . THR B 2 349 ? 55.678 0.518 12.975 1.00 101.04 ? 330 THR B OG1 1 ATOM 9071 C CG2 . THR B 2 349 ? 55.235 2.247 11.354 1.00 117.57 ? 330 THR B CG2 1 ATOM 9072 N N . CYS B 2 350 ? 57.400 -1.709 10.948 1.00 93.96 ? 331 CYS B N 1 ATOM 9073 C CA . CYS B 2 350 ? 56.938 -3.082 10.764 1.00 95.78 ? 331 CYS B CA 1 ATOM 9074 C C . CYS B 2 350 ? 57.323 -3.929 11.970 1.00 109.95 ? 331 CYS B C 1 ATOM 9075 O O . CYS B 2 350 ? 58.367 -3.699 12.582 1.00 117.00 ? 331 CYS B O 1 ATOM 9076 C CB . CYS B 2 350 ? 57.536 -3.690 9.492 1.00 87.79 ? 331 CYS B CB 1 ATOM 9077 S SG . CYS B 2 350 ? 56.716 -3.196 7.963 1.00 135.34 ? 331 CYS B SG 1 ATOM 9078 N N . PRO B 2 351 ? 56.477 -4.912 12.320 1.00 108.85 ? 332 PRO B N 1 ATOM 9079 C CA . PRO B 2 351 ? 56.777 -5.832 13.425 1.00 115.29 ? 332 PRO B CA 1 ATOM 9080 C C . PRO B 2 351 ? 58.063 -6.627 13.193 1.00 131.32 ? 332 PRO B C 1 ATOM 9081 O O . PRO B 2 351 ? 58.186 -7.312 12.177 1.00 132.10 ? 332 PRO B O 1 ATOM 9082 C CB . PRO B 2 351 ? 55.564 -6.775 13.439 1.00 103.58 ? 332 PRO B CB 1 ATOM 9083 C CG . PRO B 2 351 ? 54.915 -6.610 12.099 1.00 92.92 ? 332 PRO B CG 1 ATOM 9084 C CD . PRO B 2 351 ? 55.163 -5.188 11.715 1.00 91.98 ? 332 PRO B CD 1 ATOM 9085 N N . GLU B 2 352 ? 59.006 -6.532 14.128 1.00 142.37 ? 333 GLU B N 1 ATOM 9086 C CA . GLU B 2 352 ? 60.255 -7.286 14.037 1.00 143.40 ? 333 GLU B CA 1 ATOM 9087 C C . GLU B 2 352 ? 60.025 -8.763 14.341 1.00 143.09 ? 333 GLU B C 1 ATOM 9088 O O . GLU B 2 352 ? 60.905 -9.597 14.129 1.00 132.27 ? 333 GLU B O 1 ATOM 9089 C CB . GLU B 2 352 ? 61.322 -6.708 14.971 1.00 145.65 ? 333 GLU B CB 1 ATOM 9090 C CG . GLU B 2 352 ? 61.822 -5.328 14.566 1.00 143.42 ? 333 GLU B CG 1 ATOM 9091 C CD . GLU B 2 352 ? 63.177 -4.993 15.169 1.00 138.44 ? 333 GLU B CD 1 ATOM 9092 O OE1 . GLU B 2 352 ? 63.711 -5.820 15.939 1.00 129.95 ? 333 GLU B OE1 1 ATOM 9093 O OE2 . GLU B 2 352 ? 63.710 -3.903 14.866 1.00 135.92 ? 333 GLU B OE2 1 ATOM 9094 N N . ALA B 2 353 ? 58.834 -9.075 14.844 1.00 152.60 ? 334 ALA B N 1 ATOM 9095 C CA . ALA B 2 353 ? 58.419 -10.455 15.062 1.00 154.55 ? 334 ALA B CA 1 ATOM 9096 C C . ALA B 2 353 ? 57.118 -10.737 14.308 1.00 155.01 ? 334 ALA B C 1 ATOM 9097 O O . ALA B 2 353 ? 56.036 -10.701 14.896 1.00 156.46 ? 334 ALA B O 1 ATOM 9098 C CB . ALA B 2 353 ? 58.248 -10.731 16.548 1.00 150.28 ? 334 ALA B CB 1 ATOM 9099 N N . PRO B 2 354 ? 57.223 -11.010 12.997 1.00 147.00 ? 335 PRO B N 1 ATOM 9100 C CA . PRO B 2 354 ? 56.056 -11.281 12.151 1.00 143.24 ? 335 PRO B CA 1 ATOM 9101 C C . PRO B 2 354 ? 55.515 -12.694 12.358 1.00 141.13 ? 335 PRO B C 1 ATOM 9102 O O . PRO B 2 354 ? 55.716 -13.561 11.507 1.00 142.75 ? 335 PRO B O 1 ATOM 9103 C CB . PRO B 2 354 ? 56.619 -11.136 10.736 1.00 140.21 ? 335 PRO B CB 1 ATOM 9104 C CG . PRO B 2 354 ? 58.052 -11.522 10.871 1.00 139.41 ? 335 PRO B CG 1 ATOM 9105 C CD . PRO B 2 354 ? 58.483 -11.049 12.231 1.00 140.74 ? 335 PRO B CD 1 ATOM 9106 N N . THR B 2 355 ? 54.825 -12.912 13.473 1.00 135.19 ? 336 THR B N 1 ATOM 9107 C CA . THR B 2 355 ? 54.330 -14.240 13.830 1.00 129.08 ? 336 THR B CA 1 ATOM 9108 C C . THR B 2 355 ? 53.302 -14.782 12.841 1.00 128.30 ? 336 THR B C 1 ATOM 9109 O O . THR B 2 355 ? 53.019 -15.981 12.831 1.00 131.05 ? 336 THR B O 1 ATOM 9110 C CB . THR B 2 355 ? 53.716 -14.256 15.246 1.00 127.40 ? 336 THR B CB 1 ATOM 9111 O OG1 . THR B 2 355 ? 52.830 -13.140 15.396 1.00 133.53 ? 336 THR B OG1 1 ATOM 9112 C CG2 . THR B 2 355 ? 54.807 -14.180 16.307 1.00 119.46 ? 336 THR B CG2 1 ATOM 9113 N N . ASP B 2 356 ? 52.750 -13.896 12.016 1.00 128.12 ? 337 ASP B N 1 ATOM 9114 C CA . ASP B 2 356 ? 51.743 -14.266 11.023 1.00 133.30 ? 337 ASP B CA 1 ATOM 9115 C C . ASP B 2 356 ? 50.529 -14.935 11.671 1.00 131.35 ? 337 ASP B C 1 ATOM 9116 O O . ASP B 2 356 ? 49.943 -15.865 11.117 1.00 125.01 ? 337 ASP B O 1 ATOM 9117 C CB . ASP B 2 356 ? 52.347 -15.159 9.931 1.00 143.67 ? 337 ASP B CB 1 ATOM 9118 C CG . ASP B 2 356 ? 51.491 -15.210 8.676 1.00 150.05 ? 337 ASP B CG 1 ATOM 9119 O OD1 . ASP B 2 356 ? 50.679 -14.282 8.469 1.00 151.08 ? 337 ASP B OD1 1 ATOM 9120 O OD2 . ASP B 2 356 ? 51.634 -16.176 7.896 1.00 150.10 ? 337 ASP B OD2 1 ATOM 9121 N N . GLU B 2 357 ? 50.174 -14.460 12.861 1.00 126.40 ? 338 GLU B N 1 ATOM 9122 C CA . GLU B 2 357 ? 48.941 -14.868 13.522 1.00 103.44 ? 338 GLU B CA 1 ATOM 9123 C C . GLU B 2 357 ? 48.025 -13.652 13.630 1.00 92.95 ? 338 GLU B C 1 ATOM 9124 O O . GLU B 2 357 ? 48.357 -12.579 13.128 1.00 97.57 ? 338 GLU B O 1 ATOM 9125 C CB . GLU B 2 357 ? 49.227 -15.478 14.896 1.00 109.83 ? 338 GLU B CB 1 ATOM 9126 C CG . GLU B 2 357 ? 49.999 -14.575 15.848 1.00 125.01 ? 338 GLU B CG 1 ATOM 9127 C CD . GLU B 2 357 ? 50.314 -15.252 17.174 1.00 131.65 ? 338 GLU B CD 1 ATOM 9128 O OE1 . GLU B 2 357 ? 49.977 -16.445 17.333 1.00 126.08 ? 338 GLU B OE1 1 ATOM 9129 O OE2 . GLU B 2 357 ? 50.900 -14.589 18.058 1.00 134.78 ? 338 GLU B OE2 1 ATOM 9130 N N . CYS B 2 358 ? 46.879 -13.812 14.281 1.00 75.68 ? 339 CYS B N 1 ATOM 9131 C CA . CYS B 2 358 ? 45.853 -12.772 14.257 1.00 68.05 ? 339 CYS B CA 1 ATOM 9132 C C . CYS B 2 358 ? 46.004 -11.715 15.341 1.00 77.67 ? 339 CYS B C 1 ATOM 9133 O O . CYS B 2 358 ? 46.064 -12.033 16.527 1.00 99.67 ? 339 CYS B O 1 ATOM 9134 C CB . CYS B 2 358 ? 44.456 -13.398 14.326 1.00 62.63 ? 339 CYS B CB 1 ATOM 9135 S SG . CYS B 2 358 ? 43.919 -14.171 12.773 1.00 77.83 ? 339 CYS B SG 1 ATOM 9136 N N . LYS B 2 359 ? 46.056 -10.453 14.927 1.00 72.90 ? 340 LYS B N 1 ATOM 9137 C CA . LYS B 2 359 ? 46.049 -9.340 15.873 1.00 79.87 ? 340 LYS B CA 1 ATOM 9138 C C . LYS B 2 359 ? 44.617 -9.098 16.344 1.00 76.38 ? 340 LYS B C 1 ATOM 9139 O O . LYS B 2 359 ? 43.673 -9.417 15.625 1.00 91.21 ? 340 LYS B O 1 ATOM 9140 C CB . LYS B 2 359 ? 46.636 -8.074 15.236 1.00 75.81 ? 340 LYS B CB 1 ATOM 9141 C CG . LYS B 2 359 ? 48.104 -8.195 14.852 1.00 95.77 ? 340 LYS B CG 1 ATOM 9142 C CD . LYS B 2 359 ? 48.936 -8.719 16.015 1.00 121.83 ? 340 LYS B CD 1 ATOM 9143 C CE . LYS B 2 359 ? 50.360 -9.043 15.585 1.00 131.03 ? 340 LYS B CE 1 ATOM 9144 N NZ . LYS B 2 359 ? 51.145 -9.673 16.686 1.00 135.84 ? 340 LYS B NZ 1 ATOM 9145 N N . PRO B 2 360 ? 44.453 -8.553 17.562 1.00 71.40 ? 341 PRO B N 1 ATOM 9146 C CA . PRO B 2 360 ? 43.138 -8.271 18.148 1.00 76.23 ? 341 PRO B CA 1 ATOM 9147 C C . PRO B 2 360 ? 42.161 -7.576 17.197 1.00 76.43 ? 341 PRO B C 1 ATOM 9148 O O . PRO B 2 360 ? 42.549 -6.692 16.431 1.00 68.53 ? 341 PRO B O 1 ATOM 9149 C CB . PRO B 2 360 ? 43.481 -7.342 19.312 1.00 74.97 ? 341 PRO B CB 1 ATOM 9150 C CG . PRO B 2 360 ? 44.816 -7.801 19.749 1.00 75.31 ? 341 PRO B CG 1 ATOM 9151 C CD . PRO B 2 360 ? 45.543 -8.232 18.503 1.00 74.97 ? 341 PRO B CD 1 ATOM 9152 N N . VAL B 2 361 ? 40.899 -7.990 17.255 1.00 54.64 ? 342 VAL B N 1 ATOM 9153 C CA . VAL B 2 361 ? 39.851 -7.400 16.436 1.00 59.32 ? 342 VAL B CA 1 ATOM 9154 C C . VAL B 2 361 ? 39.244 -6.206 17.154 1.00 64.49 ? 342 VAL B C 1 ATOM 9155 O O . VAL B 2 361 ? 38.726 -6.331 18.264 1.00 65.36 ? 342 VAL B O 1 ATOM 9156 C CB . VAL B 2 361 ? 38.734 -8.410 16.138 1.00 51.41 ? 342 VAL B CB 1 ATOM 9157 C CG1 . VAL B 2 361 ? 37.603 -7.741 15.375 1.00 47.97 ? 342 VAL B CG1 1 ATOM 9158 C CG2 . VAL B 2 361 ? 39.286 -9.591 15.364 1.00 52.52 ? 342 VAL B CG2 1 ATOM 9159 N N . LYS B 2 362 ? 39.311 -5.047 16.513 1.00 60.14 ? 343 LYS B N 1 ATOM 9160 C CA . LYS B 2 362 ? 38.803 -3.824 17.107 1.00 54.41 ? 343 LYS B CA 1 ATOM 9161 C C . LYS B 2 362 ? 37.341 -3.613 16.724 1.00 57.19 ? 343 LYS B C 1 ATOM 9162 O O . LYS B 2 362 ? 37.026 -3.297 15.576 1.00 60.95 ? 343 LYS B O 1 ATOM 9163 C CB . LYS B 2 362 ? 39.666 -2.633 16.681 1.00 52.70 ? 343 LYS B CB 1 ATOM 9164 C CG . LYS B 2 362 ? 41.161 -2.868 16.866 1.00 46.81 ? 343 LYS B CG 1 ATOM 9165 C CD . LYS B 2 362 ? 41.974 -1.589 16.670 1.00 61.41 ? 343 LYS B CD 1 ATOM 9166 C CE . LYS B 2 362 ? 42.035 -1.168 15.207 1.00 78.58 ? 343 LYS B CE 1 ATOM 9167 N NZ . LYS B 2 362 ? 42.807 -2.114 14.345 1.00 77.87 ? 343 LYS B NZ 1 ATOM 9168 N N . TRP B 2 363 ? 36.449 -3.801 17.690 1.00 49.13 ? 344 TRP B N 1 ATOM 9169 C CA . TRP B 2 363 ? 35.022 -3.654 17.446 1.00 56.49 ? 344 TRP B CA 1 ATOM 9170 C C . TRP B 2 363 ? 34.596 -2.193 17.589 1.00 66.24 ? 344 TRP B C 1 ATOM 9171 O O . TRP B 2 363 ? 35.202 -1.435 18.349 1.00 81.50 ? 344 TRP B O 1 ATOM 9172 C CB . TRP B 2 363 ? 34.228 -4.539 18.407 1.00 41.95 ? 344 TRP B CB 1 ATOM 9173 C CG . TRP B 2 363 ? 32.866 -4.876 17.902 1.00 66.85 ? 344 TRP B CG 1 ATOM 9174 C CD1 . TRP B 2 363 ? 31.720 -4.159 18.088 1.00 67.49 ? 344 TRP B CD1 1 ATOM 9175 C CD2 . TRP B 2 363 ? 32.505 -6.014 17.115 1.00 58.04 ? 344 TRP B CD2 1 ATOM 9176 N NE1 . TRP B 2 363 ? 30.665 -4.785 17.467 1.00 64.45 ? 344 TRP B NE1 1 ATOM 9177 C CE2 . TRP B 2 363 ? 31.123 -5.925 16.861 1.00 55.87 ? 344 TRP B CE2 1 ATOM 9178 C CE3 . TRP B 2 363 ? 33.216 -7.102 16.600 1.00 55.40 ? 344 TRP B CE3 1 ATOM 9179 C CZ2 . TRP B 2 363 ? 30.440 -6.882 16.119 1.00 58.41 ? 344 TRP B CZ2 1 ATOM 9180 C CZ3 . TRP B 2 363 ? 32.535 -8.050 15.867 1.00 38.63 ? 344 TRP B CZ3 1 ATOM 9181 C CH2 . TRP B 2 363 ? 31.163 -7.936 15.633 1.00 55.79 ? 344 TRP B CH2 1 ATOM 9182 N N . CYS B 2 364 ? 33.556 -1.795 16.862 1.00 57.00 ? 345 CYS B N 1 ATOM 9183 C CA . CYS B 2 364 ? 33.092 -0.411 16.910 1.00 59.52 ? 345 CYS B CA 1 ATOM 9184 C C . CYS B 2 364 ? 31.741 -0.266 17.618 1.00 69.96 ? 345 CYS B C 1 ATOM 9185 O O . CYS B 2 364 ? 30.740 -0.854 17.198 1.00 69.63 ? 345 CYS B O 1 ATOM 9186 C CB . CYS B 2 364 ? 33.026 0.184 15.502 1.00 50.40 ? 345 CYS B CB 1 ATOM 9187 S SG . CYS B 2 364 ? 33.001 1.999 15.456 1.00 79.60 ? 345 CYS B SG 1 ATOM 9188 N N . ALA B 2 365 ? 31.721 0.529 18.688 1.00 59.24 ? 346 ALA B N 1 ATOM 9189 C CA . ALA B 2 365 ? 30.512 0.720 19.486 1.00 53.42 ? 346 ALA B CA 1 ATOM 9190 C C . ALA B 2 365 ? 29.788 2.031 19.163 1.00 64.51 ? 346 ALA B C 1 ATOM 9191 O O . ALA B 2 365 ? 30.421 3.075 18.993 1.00 50.83 ? 346 ALA B O 1 ATOM 9192 C CB . ALA B 2 365 ? 30.848 0.652 20.956 1.00 55.89 ? 346 ALA B CB 1 ATOM 9193 N N . LEU B 2 366 ? 28.459 1.964 19.107 1.00 64.89 ? 347 LEU B N 1 ATOM 9194 C CA . LEU B 2 366 ? 27.627 3.090 18.678 1.00 59.03 ? 347 LEU B CA 1 ATOM 9195 C C . LEU B 2 366 ? 27.061 3.938 19.810 1.00 68.49 ? 347 LEU B C 1 ATOM 9196 O O . LEU B 2 366 ? 26.411 4.954 19.557 1.00 68.90 ? 347 LEU B O 1 ATOM 9197 C CB . LEU B 2 366 ? 26.464 2.586 17.826 1.00 55.67 ? 347 LEU B CB 1 ATOM 9198 C CG . LEU B 2 366 ? 26.863 2.105 16.440 1.00 74.16 ? 347 LEU B CG 1 ATOM 9199 C CD1 . LEU B 2 366 ? 25.630 1.778 15.616 1.00 90.57 ? 347 LEU B CD1 1 ATOM 9200 C CD2 . LEU B 2 366 ? 27.706 3.165 15.765 1.00 75.10 ? 347 LEU B CD2 1 ATOM 9201 N N . SER B 2 367 ? 27.290 3.514 21.049 1.00 73.43 ? 348 SER B N 1 ATOM 9202 C CA . SER B 2 367 ? 26.756 4.217 22.212 1.00 73.11 ? 348 SER B CA 1 ATOM 9203 C C . SER B 2 367 ? 27.539 3.866 23.466 1.00 81.77 ? 348 SER B C 1 ATOM 9204 O O . SER B 2 367 ? 28.442 3.031 23.432 1.00 89.25 ? 348 SER B O 1 ATOM 9205 C CB . SER B 2 367 ? 25.277 3.878 22.418 1.00 72.27 ? 348 SER B CB 1 ATOM 9206 O OG . SER B 2 367 ? 25.094 2.500 22.706 1.00 67.60 ? 348 SER B OG 1 ATOM 9207 N N . HIS B 2 368 ? 27.186 4.503 24.576 1.00 89.65 ? 349 HIS B N 1 ATOM 9208 C CA . HIS B 2 368 ? 27.860 4.243 25.841 1.00 91.35 ? 349 HIS B CA 1 ATOM 9209 C C . HIS B 2 368 ? 27.574 2.831 26.350 1.00 90.54 ? 349 HIS B C 1 ATOM 9210 O O . HIS B 2 368 ? 28.459 2.160 26.886 1.00 83.01 ? 349 HIS B O 1 ATOM 9211 C CB . HIS B 2 368 ? 27.446 5.270 26.894 1.00 80.08 ? 349 HIS B CB 1 ATOM 9212 C CG . HIS B 2 368 ? 28.120 5.077 28.216 1.00 73.37 ? 349 HIS B CG 1 ATOM 9213 N ND1 . HIS B 2 368 ? 29.468 5.299 28.401 1.00 81.84 ? 349 HIS B ND1 1 ATOM 9214 C CD2 . HIS B 2 368 ? 27.637 4.671 29.414 1.00 62.60 ? 349 HIS B CD2 1 ATOM 9215 C CE1 . HIS B 2 368 ? 29.785 5.043 29.658 1.00 88.51 ? 349 HIS B CE1 1 ATOM 9216 N NE2 . HIS B 2 368 ? 28.691 4.662 30.294 1.00 79.84 ? 349 HIS B NE2 1 ATOM 9217 N N . HIS B 2 369 ? 26.334 2.385 26.181 1.00 85.01 ? 350 HIS B N 1 ATOM 9218 C CA . HIS B 2 369 ? 25.950 1.051 26.613 1.00 85.05 ? 350 HIS B CA 1 ATOM 9219 C C . HIS B 2 369 ? 26.645 -0.026 25.780 1.00 92.80 ? 350 HIS B C 1 ATOM 9220 O O . HIS B 2 369 ? 27.068 -1.050 26.314 1.00 91.84 ? 350 HIS B O 1 ATOM 9221 C CB . HIS B 2 369 ? 24.429 0.884 26.578 1.00 91.90 ? 350 HIS B CB 1 ATOM 9222 C CG . HIS B 2 369 ? 23.723 1.552 27.718 1.00 101.95 ? 350 HIS B CG 1 ATOM 9223 N ND1 . HIS B 2 369 ? 23.622 0.981 28.968 1.00 100.90 ? 350 HIS B ND1 1 ATOM 9224 C CD2 . HIS B 2 369 ? 23.084 2.743 27.797 1.00 111.42 ? 350 HIS B CD2 1 ATOM 9225 C CE1 . HIS B 2 369 ? 22.953 1.791 29.769 1.00 103.56 ? 350 HIS B CE1 1 ATOM 9226 N NE2 . HIS B 2 369 ? 22.615 2.868 29.083 1.00 114.29 ? 350 HIS B NE2 1 ATOM 9227 N N . GLU B 2 370 ? 26.767 0.212 24.475 1.00 94.26 ? 351 GLU B N 1 ATOM 9228 C CA . GLU B 2 370 ? 27.500 -0.698 23.598 1.00 76.68 ? 351 GLU B CA 1 ATOM 9229 C C . GLU B 2 370 ? 28.984 -0.707 23.941 1.00 72.04 ? 351 GLU B C 1 ATOM 9230 O O . GLU B 2 370 ? 29.640 -1.748 23.881 1.00 68.40 ? 351 GLU B O 1 ATOM 9231 C CB . GLU B 2 370 ? 27.332 -0.303 22.131 1.00 73.41 ? 351 GLU B CB 1 ATOM 9232 C CG . GLU B 2 370 ? 26.091 -0.854 21.466 1.00 81.48 ? 351 GLU B CG 1 ATOM 9233 C CD . GLU B 2 370 ? 26.208 -0.855 19.956 1.00 77.21 ? 351 GLU B CD 1 ATOM 9234 O OE1 . GLU B 2 370 ? 25.244 -1.272 19.282 1.00 69.53 ? 351 GLU B OE1 1 ATOM 9235 O OE2 . GLU B 2 370 ? 27.272 -0.443 19.446 1.00 78.76 ? 351 GLU B OE2 1 ATOM 9236 N N . ARG B 2 371 ? 29.510 0.462 24.292 1.00 59.39 ? 352 ARG B N 1 ATOM 9237 C CA . ARG B 2 371 ? 30.924 0.583 24.614 1.00 59.96 ? 352 ARG B CA 1 ATOM 9238 C C . ARG B 2 371 ? 31.231 -0.077 25.953 1.00 74.45 ? 352 ARG B C 1 ATOM 9239 O O . ARG B 2 371 ? 32.300 -0.661 26.136 1.00 77.52 ? 352 ARG B O 1 ATOM 9240 C CB . ARG B 2 371 ? 31.350 2.051 24.614 1.00 60.58 ? 352 ARG B CB 1 ATOM 9241 C CG . ARG B 2 371 ? 32.786 2.283 25.040 1.00 62.89 ? 352 ARG B CG 1 ATOM 9242 C CD . ARG B 2 371 ? 33.766 1.458 24.226 1.00 64.80 ? 352 ARG B CD 1 ATOM 9243 N NE . ARG B 2 371 ? 35.138 1.682 24.670 1.00 75.15 ? 352 ARG B NE 1 ATOM 9244 C CZ . ARG B 2 371 ? 35.981 2.532 24.094 1.00 87.15 ? 352 ARG B CZ 1 ATOM 9245 N NH1 . ARG B 2 371 ? 35.598 3.238 23.037 1.00 81.83 ? 352 ARG B NH1 1 ATOM 9246 N NH2 . ARG B 2 371 ? 37.211 2.671 24.572 1.00 94.90 ? 352 ARG B NH2 1 ATOM 9247 N N . LEU B 2 372 ? 30.286 0.013 26.884 1.00 82.12 ? 353 LEU B N 1 ATOM 9248 C CA . LEU B 2 372 ? 30.432 -0.644 28.177 1.00 74.32 ? 353 LEU B CA 1 ATOM 9249 C C . LEU B 2 372 ? 30.492 -2.158 28.007 1.00 67.25 ? 353 LEU B C 1 ATOM 9250 O O . LEU B 2 372 ? 31.407 -2.809 28.508 1.00 70.97 ? 353 LEU B O 1 ATOM 9251 C CB . LEU B 2 372 ? 29.294 -0.250 29.121 1.00 65.17 ? 353 LEU B CB 1 ATOM 9252 C CG . LEU B 2 372 ? 29.453 1.105 29.815 1.00 67.57 ? 353 LEU B CG 1 ATOM 9253 C CD1 . LEU B 2 372 ? 28.256 1.416 30.710 1.00 59.25 ? 353 LEU B CD1 1 ATOM 9254 C CD2 . LEU B 2 372 ? 30.754 1.153 30.613 1.00 68.42 ? 353 LEU B CD2 1 ATOM 9255 N N . LYS B 2 373 ? 29.520 -2.708 27.287 1.00 57.38 ? 354 LYS B N 1 ATOM 9256 C CA . LYS B 2 373 ? 29.487 -4.139 27.002 1.00 67.04 ? 354 LYS B CA 1 ATOM 9257 C C . LYS B 2 373 ? 30.734 -4.592 26.251 1.00 67.07 ? 354 LYS B C 1 ATOM 9258 O O . LYS B 2 373 ? 31.311 -5.637 26.558 1.00 65.92 ? 354 LYS B O 1 ATOM 9259 C CB . LYS B 2 373 ? 28.236 -4.501 26.199 1.00 47.62 ? 354 LYS B CB 1 ATOM 9260 C CG . LYS B 2 373 ? 28.237 -5.927 25.665 1.00 45.96 ? 354 LYS B CG 1 ATOM 9261 C CD . LYS B 2 373 ? 26.886 -6.289 25.065 1.00 62.71 ? 354 LYS B CD 1 ATOM 9262 C CE . LYS B 2 373 ? 26.850 -7.733 24.602 1.00 55.06 ? 354 LYS B CE 1 ATOM 9263 N NZ . LYS B 2 373 ? 25.489 -8.137 24.149 1.00 63.37 ? 354 LYS B NZ 1 ATOM 9264 N N . CYS B 2 374 ? 31.144 -3.801 25.266 1.00 61.11 ? 355 CYS B N 1 ATOM 9265 C CA . CYS B 2 374 ? 32.338 -4.107 24.493 1.00 64.97 ? 355 CYS B CA 1 ATOM 9266 C C . CYS B 2 374 ? 33.570 -4.137 25.402 1.00 69.60 ? 355 CYS B C 1 ATOM 9267 O O . CYS B 2 374 ? 34.436 -4.997 25.256 1.00 74.96 ? 355 CYS B O 1 ATOM 9268 C CB . CYS B 2 374 ? 32.514 -3.097 23.352 1.00 69.92 ? 355 CYS B CB 1 ATOM 9269 S SG . CYS B 2 374 ? 33.789 -3.527 22.128 1.00 77.81 ? 355 CYS B SG 1 ATOM 9270 N N . ASP B 2 375 ? 33.643 -3.197 26.338 1.00 67.35 ? 356 ASP B N 1 ATOM 9271 C CA . ASP B 2 375 ? 34.758 -3.149 27.278 1.00 79.74 ? 356 ASP B CA 1 ATOM 9272 C C . ASP B 2 375 ? 34.816 -4.408 28.136 1.00 74.73 ? 356 ASP B C 1 ATOM 9273 O O . ASP B 2 375 ? 35.891 -4.963 28.364 1.00 61.03 ? 356 ASP B O 1 ATOM 9274 C CB . ASP B 2 375 ? 34.667 -1.908 28.169 1.00 91.04 ? 356 ASP B CB 1 ATOM 9275 C CG . ASP B 2 375 ? 35.224 -0.665 27.499 1.00 94.06 ? 356 ASP B CG 1 ATOM 9276 O OD1 . ASP B 2 375 ? 36.105 -0.805 26.623 1.00 88.02 ? 356 ASP B OD1 1 ATOM 9277 O OD2 . ASP B 2 375 ? 34.788 0.451 27.858 1.00 97.82 ? 356 ASP B OD2 1 ATOM 9278 N N . GLU B 2 376 ? 33.653 -4.850 28.606 1.00 75.48 ? 357 GLU B N 1 ATOM 9279 C CA . GLU B 2 376 ? 33.546 -6.082 29.381 1.00 74.31 ? 357 GLU B CA 1 ATOM 9280 C C . GLU B 2 376 ? 33.975 -7.275 28.538 1.00 72.96 ? 357 GLU B C 1 ATOM 9281 O O . GLU B 2 376 ? 34.699 -8.152 29.008 1.00 72.40 ? 357 GLU B O 1 ATOM 9282 C CB . GLU B 2 376 ? 32.111 -6.278 29.883 1.00 77.40 ? 357 GLU B CB 1 ATOM 9283 C CG . GLU B 2 376 ? 31.833 -7.631 30.543 1.00 89.16 ? 357 GLU B CG 1 ATOM 9284 C CD . GLU B 2 376 ? 32.403 -7.750 31.954 1.00 86.22 ? 357 GLU B CD 1 ATOM 9285 O OE1 . GLU B 2 376 ? 33.066 -6.797 32.424 1.00 72.93 ? 357 GLU B OE1 1 ATOM 9286 O OE2 . GLU B 2 376 ? 32.184 -8.804 32.596 1.00 75.85 ? 357 GLU B OE2 1 ATOM 9287 N N . TRP B 2 377 ? 33.525 -7.292 27.288 1.00 70.92 ? 358 TRP B N 1 ATOM 9288 C CA . TRP B 2 377 ? 33.884 -8.349 26.352 1.00 59.02 ? 358 TRP B CA 1 ATOM 9289 C C . TRP B 2 377 ? 35.389 -8.388 26.160 1.00 55.27 ? 358 TRP B C 1 ATOM 9290 O O . TRP B 2 377 ? 36.004 -9.447 26.231 1.00 67.46 ? 358 TRP B O 1 ATOM 9291 C CB . TRP B 2 377 ? 33.202 -8.125 25.002 1.00 45.56 ? 358 TRP B CB 1 ATOM 9292 C CG . TRP B 2 377 ? 33.410 -9.250 24.035 1.00 54.55 ? 358 TRP B CG 1 ATOM 9293 C CD1 . TRP B 2 377 ? 33.895 -10.494 24.316 1.00 62.53 ? 358 TRP B CD1 1 ATOM 9294 C CD2 . TRP B 2 377 ? 33.141 -9.235 22.628 1.00 57.02 ? 358 TRP B CD2 1 ATOM 9295 N NE1 . TRP B 2 377 ? 33.943 -11.254 23.173 1.00 65.04 ? 358 TRP B NE1 1 ATOM 9296 C CE2 . TRP B 2 377 ? 33.484 -10.504 22.124 1.00 59.35 ? 358 TRP B CE2 1 ATOM 9297 C CE3 . TRP B 2 377 ? 32.638 -8.275 21.748 1.00 56.93 ? 358 TRP B CE3 1 ATOM 9298 C CZ2 . TRP B 2 377 ? 33.345 -10.834 20.782 1.00 53.46 ? 358 TRP B CZ2 1 ATOM 9299 C CZ3 . TRP B 2 377 ? 32.502 -8.605 20.414 1.00 47.05 ? 358 TRP B CZ3 1 ATOM 9300 C CH2 . TRP B 2 377 ? 32.855 -9.871 19.944 1.00 51.98 ? 358 TRP B CH2 1 ATOM 9301 N N . SER B 2 378 ? 35.969 -7.222 25.910 1.00 55.24 ? 359 SER B N 1 ATOM 9302 C CA . SER B 2 378 ? 37.403 -7.094 25.703 1.00 63.65 ? 359 SER B CA 1 ATOM 9303 C C . SER B 2 378 ? 38.178 -7.675 26.883 1.00 72.78 ? 359 SER B C 1 ATOM 9304 O O . SER B 2 378 ? 39.201 -8.340 26.706 1.00 73.07 ? 359 SER B O 1 ATOM 9305 C CB . SER B 2 378 ? 37.765 -5.620 25.506 1.00 58.57 ? 359 SER B CB 1 ATOM 9306 O OG . SER B 2 378 ? 39.159 -5.451 25.337 1.00 53.80 ? 359 SER B OG 1 ATOM 9307 N N . VAL B 2 379 ? 37.673 -7.427 28.086 1.00 67.04 ? 360 VAL B N 1 ATOM 9308 C CA . VAL B 2 379 ? 38.304 -7.926 29.299 1.00 79.84 ? 360 VAL B CA 1 ATOM 9309 C C . VAL B 2 379 ? 38.222 -9.447 29.384 1.00 76.44 ? 360 VAL B C 1 ATOM 9310 O O . VAL B 2 379 ? 39.232 -10.115 29.600 1.00 76.35 ? 360 VAL B O 1 ATOM 9311 C CB . VAL B 2 379 ? 37.677 -7.293 30.560 1.00 72.94 ? 360 VAL B CB 1 ATOM 9312 C CG1 . VAL B 2 379 ? 38.162 -7.998 31.808 1.00 68.86 ? 360 VAL B CG1 1 ATOM 9313 C CG2 . VAL B 2 379 ? 38.008 -5.814 30.626 1.00 71.35 ? 360 VAL B CG2 1 ATOM 9314 N N . ASN B 2 380 ? 37.017 -9.983 29.206 1.00 66.21 ? 361 ASN B N 1 ATOM 9315 C CA . ASN B 2 380 ? 36.795 -11.427 29.235 1.00 63.14 ? 361 ASN B CA 1 ATOM 9316 C C . ASN B 2 380 ? 37.435 -12.183 28.073 1.00 56.23 ? 361 ASN B C 1 ATOM 9317 O O . ASN B 2 380 ? 37.643 -13.394 28.156 1.00 68.38 ? 361 ASN B O 1 ATOM 9318 C CB . ASN B 2 380 ? 35.300 -11.745 29.281 1.00 65.14 ? 361 ASN B CB 1 ATOM 9319 C CG . ASN B 2 380 ? 34.717 -11.607 30.674 1.00 69.55 ? 361 ASN B CG 1 ATOM 9320 O OD1 . ASN B 2 380 ? 34.820 -12.518 31.501 1.00 63.69 ? 361 ASN B OD1 1 ATOM 9321 N ND2 . ASN B 2 380 ? 34.088 -10.468 30.937 1.00 65.21 ? 361 ASN B ND2 1 ATOM 9322 N N . SER B 2 381 ? 37.748 -11.469 26.996 1.00 50.37 ? 362 SER B N 1 ATOM 9323 C CA . SER B 2 381 ? 38.301 -12.096 25.799 1.00 58.30 ? 362 SER B CA 1 ATOM 9324 C C . SER B 2 381 ? 39.817 -12.118 25.843 1.00 54.69 ? 362 SER B C 1 ATOM 9325 O O . SER B 2 381 ? 40.465 -12.447 24.847 1.00 53.81 ? 362 SER B O 1 ATOM 9326 C CB . SER B 2 381 ? 37.848 -11.361 24.540 1.00 59.64 ? 362 SER B CB 1 ATOM 9327 O OG . SER B 2 381 ? 38.587 -10.167 24.364 1.00 70.53 ? 362 SER B OG 1 ATOM 9328 N N . VAL B 2 382 ? 40.364 -11.746 26.999 1.00 47.55 ? 363 VAL B N 1 ATOM 9329 C CA . VAL B 2 382 ? 41.806 -11.743 27.254 1.00 54.29 ? 363 VAL B CA 1 ATOM 9330 C C . VAL B 2 382 ? 42.620 -11.051 26.137 1.00 59.04 ? 363 VAL B C 1 ATOM 9331 O O . VAL B 2 382 ? 43.752 -11.429 25.825 1.00 60.56 ? 363 VAL B O 1 ATOM 9332 C CB . VAL B 2 382 ? 42.326 -13.170 27.654 1.00 68.49 ? 363 VAL B CB 1 ATOM 9333 C CG1 . VAL B 2 382 ? 42.481 -14.090 26.445 1.00 64.14 ? 363 VAL B CG1 1 ATOM 9334 C CG2 . VAL B 2 382 ? 43.619 -13.084 28.439 1.00 73.77 ? 363 VAL B CG2 1 ATOM 9335 N N . GLY B 2 383 ? 42.024 -10.017 25.548 1.00 52.91 ? 364 GLY B N 1 ATOM 9336 C CA . GLY B 2 383 ? 42.719 -9.175 24.590 1.00 46.05 ? 364 GLY B CA 1 ATOM 9337 C C . GLY B 2 383 ? 42.347 -9.379 23.132 1.00 53.10 ? 364 GLY B C 1 ATOM 9338 O O . GLY B 2 383 ? 42.682 -8.557 22.276 1.00 60.38 ? 364 GLY B O 1 ATOM 9339 N N . LYS B 2 384 ? 41.655 -10.473 22.841 1.00 48.82 ? 365 LYS B N 1 ATOM 9340 C CA . LYS B 2 384 ? 41.350 -10.822 21.463 1.00 51.54 ? 365 LYS B CA 1 ATOM 9341 C C . LYS B 2 384 ? 40.356 -9.848 20.834 1.00 53.91 ? 365 LYS B C 1 ATOM 9342 O O . LYS B 2 384 ? 40.279 -9.724 19.615 1.00 56.81 ? 365 LYS B O 1 ATOM 9343 C CB . LYS B 2 384 ? 40.854 -12.265 21.375 1.00 57.11 ? 365 LYS B CB 1 ATOM 9344 C CG . LYS B 2 384 ? 41.937 -13.307 21.652 1.00 53.09 ? 365 LYS B CG 1 ATOM 9345 C CD . LYS B 2 384 ? 42.921 -13.399 20.492 1.00 57.97 ? 365 LYS B CD 1 ATOM 9346 C CE . LYS B 2 384 ? 43.967 -14.477 20.734 1.00 59.96 ? 365 LYS B CE 1 ATOM 9347 N NZ . LYS B 2 384 ? 44.772 -14.779 19.514 1.00 54.46 ? 365 LYS B NZ 1 ATOM 9348 N N . ILE B 2 385 ? 39.604 -9.154 21.678 1.00 53.11 ? 366 ILE B N 1 ATOM 9349 C CA . ILE B 2 385 ? 38.744 -8.067 21.228 1.00 47.73 ? 366 ILE B CA 1 ATOM 9350 C C . ILE B 2 385 ? 39.177 -6.764 21.902 1.00 60.87 ? 366 ILE B C 1 ATOM 9351 O O . ILE B 2 385 ? 39.497 -6.746 23.091 1.00 60.13 ? 366 ILE B O 1 ATOM 9352 C CB . ILE B 2 385 ? 37.265 -8.343 21.561 1.00 58.98 ? 366 ILE B CB 1 ATOM 9353 C CG1 . ILE B 2 385 ? 36.803 -9.656 20.925 1.00 52.05 ? 366 ILE B CG1 1 ATOM 9354 C CG2 . ILE B 2 385 ? 36.385 -7.197 21.094 1.00 63.92 ? 366 ILE B CG2 1 ATOM 9355 C CD1 . ILE B 2 385 ? 36.695 -9.597 19.423 1.00 43.06 ? 366 ILE B CD1 1 ATOM 9356 N N . GLU B 2 386 ? 39.217 -5.683 21.132 1.00 57.95 ? 367 GLU B N 1 ATOM 9357 C CA . GLU B 2 386 ? 39.462 -4.357 21.683 1.00 57.87 ? 367 GLU B CA 1 ATOM 9358 C C . GLU B 2 386 ? 38.292 -3.463 21.295 1.00 61.69 ? 367 GLU B C 1 ATOM 9359 O O . GLU B 2 386 ? 37.370 -3.908 20.616 1.00 68.82 ? 367 GLU B O 1 ATOM 9360 C CB . GLU B 2 386 ? 40.788 -3.789 21.178 1.00 43.74 ? 367 GLU B CB 1 ATOM 9361 C CG . GLU B 2 386 ? 42.000 -4.590 21.625 1.00 71.80 ? 367 GLU B CG 1 ATOM 9362 C CD . GLU B 2 386 ? 43.287 -4.129 20.967 1.00 77.39 ? 367 GLU B CD 1 ATOM 9363 O OE1 . GLU B 2 386 ? 43.248 -3.135 20.211 1.00 73.12 ? 367 GLU B OE1 1 ATOM 9364 O OE2 . GLU B 2 386 ? 44.339 -4.762 21.203 1.00 80.49 ? 367 GLU B OE2 1 ATOM 9365 N N . CYS B 2 387 ? 38.312 -2.209 21.723 1.00 64.57 ? 368 CYS B N 1 ATOM 9366 C CA . CYS B 2 387 ? 37.145 -1.359 21.512 1.00 61.44 ? 368 CYS B CA 1 ATOM 9367 C C . CYS B 2 387 ? 37.437 0.043 20.996 1.00 63.30 ? 368 CYS B C 1 ATOM 9368 O O . CYS B 2 387 ? 38.393 0.692 21.420 1.00 68.29 ? 368 CYS B O 1 ATOM 9369 C CB . CYS B 2 387 ? 36.307 -1.290 22.789 1.00 59.26 ? 368 CYS B CB 1 ATOM 9370 S SG . CYS B 2 387 ? 35.423 -2.821 23.119 1.00 122.17 ? 368 CYS B SG 1 ATOM 9371 N N . VAL B 2 388 ? 36.602 0.489 20.060 1.00 47.42 ? 369 VAL B N 1 ATOM 9372 C CA . VAL B 2 388 ? 36.583 1.883 19.629 1.00 50.42 ? 369 VAL B CA 1 ATOM 9373 C C . VAL B 2 388 ? 35.142 2.376 19.536 1.00 60.97 ? 369 VAL B C 1 ATOM 9374 O O . VAL B 2 388 ? 34.231 1.614 19.204 1.00 60.51 ? 369 VAL B O 1 ATOM 9375 C CB . VAL B 2 388 ? 37.294 2.098 18.279 1.00 49.97 ? 369 VAL B CB 1 ATOM 9376 C CG1 . VAL B 2 388 ? 38.765 1.753 18.393 1.00 48.18 ? 369 VAL B CG1 1 ATOM 9377 C CG2 . VAL B 2 388 ? 36.640 1.275 17.200 1.00 63.75 ? 369 VAL B CG2 1 ATOM 9378 N N . SER B 2 389 ? 34.938 3.650 19.853 1.00 77.85 ? 370 SER B N 1 ATOM 9379 C CA . SER B 2 389 ? 33.603 4.233 19.835 1.00 71.34 ? 370 SER B CA 1 ATOM 9380 C C . SER B 2 389 ? 33.468 5.217 18.693 1.00 64.26 ? 370 SER B C 1 ATOM 9381 O O . SER B 2 389 ? 34.459 5.683 18.135 1.00 65.41 ? 370 SER B O 1 ATOM 9382 C CB . SER B 2 389 ? 33.304 4.950 21.154 1.00 78.84 ? 370 SER B CB 1 ATOM 9383 O OG . SER B 2 389 ? 33.226 4.043 22.238 1.00 87.07 ? 370 SER B OG 1 ATOM 9384 N N . ALA B 2 390 ? 32.226 5.528 18.352 1.00 69.60 ? 371 ALA B N 1 ATOM 9385 C CA . ALA B 2 390 ? 31.933 6.560 17.376 1.00 75.77 ? 371 ALA B CA 1 ATOM 9386 C C . ALA B 2 390 ? 30.511 7.034 17.604 1.00 86.45 ? 371 ALA B C 1 ATOM 9387 O O . ALA B 2 390 ? 29.709 6.331 18.219 1.00 91.09 ? 371 ALA B O 1 ATOM 9388 C CB . ALA B 2 390 ? 32.105 6.031 15.971 1.00 69.26 ? 371 ALA B CB 1 ATOM 9389 N N . GLU B 2 391 ? 30.203 8.229 17.112 1.00 85.63 ? 372 GLU B N 1 ATOM 9390 C CA . GLU B 2 391 ? 28.901 8.838 17.338 1.00 80.36 ? 372 GLU B CA 1 ATOM 9391 C C . GLU B 2 391 ? 27.788 8.123 16.577 1.00 75.12 ? 372 GLU B C 1 ATOM 9392 O O . GLU B 2 391 ? 26.734 7.831 17.137 1.00 75.45 ? 372 GLU B O 1 ATOM 9393 C CB . GLU B 2 391 ? 28.933 10.314 16.940 1.00 90.29 ? 372 GLU B CB 1 ATOM 9394 C CG . GLU B 2 391 ? 30.035 11.121 17.607 1.00 105.17 ? 372 GLU B CG 1 ATOM 9395 C CD . GLU B 2 391 ? 30.095 12.557 17.102 1.00 123.59 ? 372 GLU B CD 1 ATOM 9396 O OE1 . GLU B 2 391 ? 29.186 12.965 16.344 1.00 124.07 ? 372 GLU B OE1 1 ATOM 9397 O OE2 . GLU B 2 391 ? 31.053 13.277 17.460 1.00 126.58 ? 372 GLU B OE2 1 ATOM 9398 N N . THR B 2 392 ? 28.023 7.845 15.298 1.00 77.19 ? 373 THR B N 1 ATOM 9399 C CA . THR B 2 392 ? 26.986 7.280 14.438 1.00 74.27 ? 373 THR B CA 1 ATOM 9400 C C . THR B 2 392 ? 27.416 5.976 13.780 1.00 72.64 ? 373 THR B C 1 ATOM 9401 O O . THR B 2 392 ? 28.584 5.591 13.840 1.00 75.26 ? 373 THR B O 1 ATOM 9402 C CB . THR B 2 392 ? 26.580 8.264 13.322 1.00 79.32 ? 373 THR B CB 1 ATOM 9403 O OG1 . THR B 2 392 ? 27.676 8.443 12.416 1.00 85.27 ? 373 THR B OG1 1 ATOM 9404 C CG2 . THR B 2 392 ? 26.188 9.609 13.908 1.00 67.36 ? 373 THR B CG2 1 ATOM 9405 N N . THR B 2 393 ? 26.459 5.303 13.150 1.00 72.95 ? 374 THR B N 1 ATOM 9406 C CA . THR B 2 393 ? 26.737 4.082 12.405 1.00 64.56 ? 374 THR B CA 1 ATOM 9407 C C . THR B 2 393 ? 27.744 4.360 11.296 1.00 66.30 ? 374 THR B C 1 ATOM 9408 O O . THR B 2 393 ? 28.733 3.648 11.152 1.00 70.63 ? 374 THR B O 1 ATOM 9409 C CB . THR B 2 393 ? 25.453 3.492 11.793 1.00 70.73 ? 374 THR B CB 1 ATOM 9410 O OG1 . THR B 2 393 ? 24.586 3.040 12.839 1.00 74.23 ? 374 THR B OG1 1 ATOM 9411 C CG2 . THR B 2 393 ? 25.780 2.323 10.882 1.00 76.09 ? 374 THR B CG2 1 ATOM 9412 N N . GLU B 2 394 ? 27.500 5.421 10.534 1.00 75.23 ? 375 GLU B N 1 ATOM 9413 C CA . GLU B 2 394 ? 28.360 5.772 9.408 1.00 68.03 ? 375 GLU B CA 1 ATOM 9414 C C . GLU B 2 394 ? 29.780 6.165 9.816 1.00 69.41 ? 375 GLU B C 1 ATOM 9415 O O . GLU B 2 394 ? 30.729 5.922 9.073 1.00 86.71 ? 375 GLU B O 1 ATOM 9416 C CB . GLU B 2 394 ? 27.715 6.869 8.568 1.00 67.94 ? 375 GLU B CB 1 ATOM 9417 C CG . GLU B 2 394 ? 26.389 6.454 7.965 1.00 77.57 ? 375 GLU B CG 1 ATOM 9418 C CD . GLU B 2 394 ? 25.849 7.470 6.983 1.00 88.28 ? 375 GLU B CD 1 ATOM 9419 O OE1 . GLU B 2 394 ? 26.465 8.548 6.831 1.00 96.15 ? 375 GLU B OE1 1 ATOM 9420 O OE2 . GLU B 2 394 ? 24.805 7.183 6.361 1.00 88.52 ? 375 GLU B OE2 1 ATOM 9421 N N . ASP B 2 395 ? 29.928 6.764 10.993 1.00 64.74 ? 376 ASP B N 1 ATOM 9422 C CA . ASP B 2 395 ? 31.255 7.098 11.506 1.00 70.95 ? 376 ASP B CA 1 ATOM 9423 C C . ASP B 2 395 ? 32.063 5.836 11.798 1.00 68.78 ? 376 ASP B C 1 ATOM 9424 O O . ASP B 2 395 ? 33.279 5.806 11.610 1.00 72.92 ? 376 ASP B O 1 ATOM 9425 C CB . ASP B 2 395 ? 31.159 7.961 12.764 1.00 67.51 ? 376 ASP B CB 1 ATOM 9426 C CG . ASP B 2 395 ? 30.709 9.377 12.466 1.00 92.37 ? 376 ASP B CG 1 ATOM 9427 O OD1 . ASP B 2 395 ? 30.228 10.058 13.397 1.00 108.39 ? 376 ASP B OD1 1 ATOM 9428 O OD2 . ASP B 2 395 ? 30.836 9.810 11.302 1.00 92.96 ? 376 ASP B OD2 1 ATOM 9429 N N . CYS B 2 396 ? 31.376 4.796 12.257 1.00 54.17 ? 377 CYS B N 1 ATOM 9430 C CA . CYS B 2 396 ? 32.022 3.523 12.546 1.00 57.26 ? 377 CYS B CA 1 ATOM 9431 C C . CYS B 2 396 ? 32.487 2.846 11.266 1.00 59.66 ? 377 CYS B C 1 ATOM 9432 O O . CYS B 2 396 ? 33.620 2.373 11.185 1.00 68.45 ? 377 CYS B O 1 ATOM 9433 C CB . CYS B 2 396 ? 31.072 2.601 13.311 1.00 55.01 ? 377 CYS B CB 1 ATOM 9434 S SG . CYS B 2 396 ? 31.146 2.745 15.105 1.00 76.70 ? 377 CYS B SG 1 ATOM 9435 N N . ILE B 2 397 ? 31.601 2.800 10.274 1.00 62.53 ? 378 ILE B N 1 ATOM 9436 C CA . ILE B 2 397 ? 31.910 2.206 8.977 1.00 59.00 ? 378 ILE B CA 1 ATOM 9437 C C . ILE B 2 397 ? 33.140 2.865 8.375 1.00 64.13 ? 378 ILE B C 1 ATOM 9438 O O . ILE B 2 397 ? 34.039 2.184 7.884 1.00 72.20 ? 378 ILE B O 1 ATOM 9439 C CB . ILE B 2 397 ? 30.731 2.338 8.001 1.00 55.40 ? 378 ILE B CB 1 ATOM 9440 C CG1 . ILE B 2 397 ? 29.515 1.582 8.535 1.00 48.89 ? 378 ILE B CG1 1 ATOM 9441 C CG2 . ILE B 2 397 ? 31.108 1.809 6.637 1.00 53.57 ? 378 ILE B CG2 1 ATOM 9442 C CD1 . ILE B 2 397 ? 28.331 1.607 7.598 1.00 54.97 ? 378 ILE B CD1 1 ATOM 9443 N N . ALA B 2 398 ? 33.179 4.192 8.440 1.00 57.46 ? 379 ALA B N 1 ATOM 9444 C CA . ALA B 2 398 ? 34.330 4.955 7.973 1.00 57.63 ? 379 ALA B CA 1 ATOM 9445 C C . ALA B 2 398 ? 35.591 4.606 8.759 1.00 63.42 ? 379 ALA B C 1 ATOM 9446 O O . ALA B 2 398 ? 36.695 4.627 8.214 1.00 62.84 ? 379 ALA B O 1 ATOM 9447 C CB . ALA B 2 398 ? 34.047 6.444 8.055 1.00 54.75 ? 379 ALA B CB 1 ATOM 9448 N N . LYS B 2 399 ? 35.420 4.287 10.040 1.00 65.06 ? 380 LYS B N 1 ATOM 9449 C CA . LYS B 2 399 ? 36.541 3.888 10.887 1.00 53.92 ? 380 LYS B CA 1 ATOM 9450 C C . LYS B 2 399 ? 37.042 2.487 10.538 1.00 58.81 ? 380 LYS B C 1 ATOM 9451 O O . LYS B 2 399 ? 38.232 2.195 10.668 1.00 57.72 ? 380 LYS B O 1 ATOM 9452 C CB . LYS B 2 399 ? 36.162 3.973 12.366 1.00 54.42 ? 380 LYS B CB 1 ATOM 9453 C CG . LYS B 2 399 ? 36.588 5.268 13.048 1.00 52.04 ? 380 LYS B CG 1 ATOM 9454 C CD . LYS B 2 399 ? 35.849 5.451 14.368 1.00 83.95 ? 380 LYS B CD 1 ATOM 9455 C CE . LYS B 2 399 ? 36.350 6.663 15.147 1.00 84.61 ? 380 LYS B CE 1 ATOM 9456 N NZ . LYS B 2 399 ? 37.740 6.472 15.663 1.00 84.87 ? 380 LYS B NZ 1 ATOM 9457 N N . ILE B 2 400 ? 36.134 1.624 10.095 1.00 65.08 ? 381 ILE B N 1 ATOM 9458 C CA . ILE B 2 400 ? 36.517 0.310 9.592 1.00 53.54 ? 381 ILE B CA 1 ATOM 9459 C C . ILE B 2 400 ? 37.224 0.442 8.243 1.00 59.36 ? 381 ILE B C 1 ATOM 9460 O O . ILE B 2 400 ? 38.214 -0.238 7.977 1.00 58.16 ? 381 ILE B O 1 ATOM 9461 C CB . ILE B 2 400 ? 35.301 -0.609 9.448 1.00 52.65 ? 381 ILE B CB 1 ATOM 9462 C CG1 . ILE B 2 400 ? 34.654 -0.828 10.813 1.00 56.16 ? 381 ILE B CG1 1 ATOM 9463 C CG2 . ILE B 2 400 ? 35.702 -1.940 8.826 1.00 54.02 ? 381 ILE B CG2 1 ATOM 9464 C CD1 . ILE B 2 400 ? 33.684 -1.978 10.842 1.00 62.26 ? 381 ILE B CD1 1 ATOM 9465 N N . MET B 2 401 ? 36.717 1.336 7.403 1.00 49.58 ? 382 MET B N 1 ATOM 9466 C CA . MET B 2 401 ? 37.338 1.615 6.117 1.00 51.10 ? 382 MET B CA 1 ATOM 9467 C C . MET B 2 401 ? 38.784 2.092 6.259 1.00 55.31 ? 382 MET B C 1 ATOM 9468 O O . MET B 2 401 ? 39.683 1.559 5.613 1.00 61.52 ? 382 MET B O 1 ATOM 9469 C CB . MET B 2 401 ? 36.527 2.658 5.352 1.00 55.07 ? 382 MET B CB 1 ATOM 9470 C CG . MET B 2 401 ? 35.152 2.194 4.930 1.00 50.14 ? 382 MET B CG 1 ATOM 9471 S SD . MET B 2 401 ? 34.171 3.565 4.299 1.00 69.48 ? 382 MET B SD 1 ATOM 9472 C CE . MET B 2 401 ? 35.216 4.136 2.962 1.00 69.60 ? 382 MET B CE 1 ATOM 9473 N N . ASN B 2 402 ? 39.008 3.096 7.100 1.00 50.45 ? 383 ASN B N 1 ATOM 9474 C CA . ASN B 2 402 ? 40.351 3.653 7.240 1.00 57.04 ? 383 ASN B CA 1 ATOM 9475 C C . ASN B 2 402 ? 41.244 2.868 8.193 1.00 56.94 ? 383 ASN B C 1 ATOM 9476 O O . ASN B 2 402 ? 42.445 3.117 8.271 1.00 62.67 ? 383 ASN B O 1 ATOM 9477 C CB . ASN B 2 402 ? 40.325 5.151 7.589 1.00 58.61 ? 383 ASN B CB 1 ATOM 9478 C CG . ASN B 2 402 ? 39.683 5.447 8.940 1.00 66.60 ? 383 ASN B CG 1 ATOM 9479 O OD1 . ASN B 2 402 ? 39.733 4.641 9.869 1.00 70.37 ? 383 ASN B OD1 1 ATOM 9480 N ND2 . ASN B 2 402 ? 39.084 6.627 9.052 1.00 67.10 ? 383 ASN B ND2 1 ATOM 9481 N N . GLY B 2 403 ? 40.646 1.930 8.920 1.00 50.88 ? 384 GLY B N 1 ATOM 9482 C CA . GLY B 2 403 ? 41.409 1.008 9.740 1.00 52.86 ? 384 GLY B CA 1 ATOM 9483 C C . GLY B 2 403 ? 41.455 1.297 11.229 1.00 62.02 ? 384 GLY B C 1 ATOM 9484 O O . GLY B 2 403 ? 42.130 0.589 11.974 1.00 62.38 ? 384 GLY B O 1 ATOM 9485 N N . GLU B 2 404 ? 40.747 2.334 11.668 1.00 71.59 ? 385 GLU B N 1 ATOM 9486 C CA . GLU B 2 404 ? 40.686 2.668 13.090 1.00 52.15 ? 385 GLU B CA 1 ATOM 9487 C C . GLU B 2 404 ? 39.831 1.654 13.844 1.00 64.24 ? 385 GLU B C 1 ATOM 9488 O O . GLU B 2 404 ? 39.953 1.502 15.059 1.00 68.93 ? 385 GLU B O 1 ATOM 9489 C CB . GLU B 2 404 ? 40.131 4.078 13.288 1.00 53.75 ? 385 GLU B CB 1 ATOM 9490 C CG . GLU B 2 404 ? 41.018 5.172 12.724 1.00 82.20 ? 385 GLU B CG 1 ATOM 9491 C CD . GLU B 2 404 ? 40.456 6.560 12.967 1.00 94.51 ? 385 GLU B CD 1 ATOM 9492 O OE1 . GLU B 2 404 ? 40.932 7.518 12.321 1.00 91.57 ? 385 GLU B OE1 1 ATOM 9493 O OE2 . GLU B 2 404 ? 39.538 6.692 13.803 1.00 102.06 ? 385 GLU B OE2 1 ATOM 9494 N N . ALA B 2 405 ? 38.962 0.967 13.107 1.00 62.25 ? 386 ALA B N 1 ATOM 9495 C CA . ALA B 2 405 ? 38.148 -0.111 13.655 1.00 61.06 ? 386 ALA B CA 1 ATOM 9496 C C . ALA B 2 405 ? 38.277 -1.326 12.744 1.00 51.42 ? 386 ALA B C 1 ATOM 9497 O O . ALA B 2 405 ? 38.775 -1.210 11.630 1.00 48.53 ? 386 ALA B O 1 ATOM 9498 C CB . ALA B 2 405 ? 36.690 0.326 13.772 1.00 45.78 ? 386 ALA B CB 1 ATOM 9499 N N . ASP B 2 406 ? 37.831 -2.487 13.211 1.00 56.90 ? 387 ASP B N 1 ATOM 9500 C CA . ASP B 2 406 ? 37.947 -3.710 12.420 1.00 52.46 ? 387 ASP B CA 1 ATOM 9501 C C . ASP B 2 406 ? 36.601 -4.303 12.021 1.00 56.93 ? 387 ASP B C 1 ATOM 9502 O O . ASP B 2 406 ? 36.437 -4.766 10.895 1.00 64.35 ? 387 ASP B O 1 ATOM 9503 C CB . ASP B 2 406 ? 38.788 -4.762 13.150 1.00 57.66 ? 387 ASP B CB 1 ATOM 9504 C CG . ASP B 2 406 ? 40.275 -4.437 13.143 1.00 70.93 ? 387 ASP B CG 1 ATOM 9505 O OD1 . ASP B 2 406 ? 40.739 -3.747 12.211 1.00 62.83 ? 387 ASP B OD1 1 ATOM 9506 O OD2 . ASP B 2 406 ? 40.984 -4.878 14.070 1.00 82.71 ? 387 ASP B OD2 1 ATOM 9507 N N . ALA B 2 407 ? 35.636 -4.294 12.933 1.00 49.18 ? 388 ALA B N 1 ATOM 9508 C CA . ALA B 2 407 ? 34.360 -4.947 12.656 1.00 48.48 ? 388 ALA B CA 1 ATOM 9509 C C . ALA B 2 407 ? 33.193 -4.379 13.449 1.00 53.46 ? 388 ALA B C 1 ATOM 9510 O O . ALA B 2 407 ? 33.382 -3.737 14.482 1.00 63.07 ? 388 ALA B O 1 ATOM 9511 C CB . ALA B 2 407 ? 34.473 -6.453 12.893 1.00 44.31 ? 388 ALA B CB 1 ATOM 9512 N N . MET B 2 408 ? 31.986 -4.641 12.958 1.00 47.12 ? 389 MET B N 1 ATOM 9513 C CA . MET B 2 408 ? 30.763 -4.275 13.656 1.00 43.02 ? 389 MET B CA 1 ATOM 9514 C C . MET B 2 408 ? 29.593 -5.006 13.017 1.00 47.07 ? 389 MET B C 1 ATOM 9515 O O . MET B 2 408 ? 29.709 -5.498 11.898 1.00 59.92 ? 389 MET B O 1 ATOM 9516 C CB . MET B 2 408 ? 30.540 -2.768 13.594 1.00 54.19 ? 389 MET B CB 1 ATOM 9517 C CG . MET B 2 408 ? 29.543 -2.323 12.544 1.00 59.94 ? 389 MET B CG 1 ATOM 9518 S SD . MET B 2 408 ? 29.439 -0.534 12.442 1.00 69.01 ? 389 MET B SD 1 ATOM 9519 C CE . MET B 2 408 ? 30.778 -0.233 11.315 1.00 107.16 ? 389 MET B CE 1 ATOM 9520 N N . SER B 2 409 ? 28.470 -5.089 13.725 1.00 55.19 ? 390 SER B N 1 ATOM 9521 C CA . SER B 2 409 ? 27.288 -5.751 13.181 1.00 61.23 ? 390 SER B CA 1 ATOM 9522 C C . SER B 2 409 ? 26.335 -4.735 12.555 1.00 57.73 ? 390 SER B C 1 ATOM 9523 O O . SER B 2 409 ? 26.069 -3.681 13.131 1.00 53.31 ? 390 SER B O 1 ATOM 9524 C CB . SER B 2 409 ? 26.575 -6.568 14.259 1.00 77.12 ? 390 SER B CB 1 ATOM 9525 O OG . SER B 2 409 ? 25.690 -7.510 13.675 1.00 79.99 ? 390 SER B OG 1 ATOM 9526 N N . LEU B 2 410 ? 25.825 -5.061 11.372 1.00 55.63 ? 391 LEU B N 1 ATOM 9527 C CA . LEU B 2 410 ? 25.020 -4.123 10.599 1.00 48.00 ? 391 LEU B CA 1 ATOM 9528 C C . LEU B 2 410 ? 23.755 -4.761 10.042 1.00 59.26 ? 391 LEU B C 1 ATOM 9529 O O . LEU B 2 410 ? 23.752 -5.938 9.692 1.00 66.73 ? 391 LEU B O 1 ATOM 9530 C CB . LEU B 2 410 ? 25.847 -3.555 9.445 1.00 49.61 ? 391 LEU B CB 1 ATOM 9531 C CG . LEU B 2 410 ? 27.030 -2.673 9.838 1.00 58.07 ? 391 LEU B CG 1 ATOM 9532 C CD1 . LEU B 2 410 ? 27.791 -2.215 8.603 1.00 57.38 ? 391 LEU B CD1 1 ATOM 9533 C CD2 . LEU B 2 410 ? 26.542 -1.483 10.653 1.00 58.64 ? 391 LEU B CD2 1 ATOM 9534 N N . ASP B 2 411 ? 22.683 -3.977 9.956 1.00 57.25 ? 392 ASP B N 1 ATOM 9535 C CA . ASP B 2 411 ? 21.452 -4.435 9.325 1.00 56.10 ? 392 ASP B CA 1 ATOM 9536 C C . ASP B 2 411 ? 21.634 -4.359 7.822 1.00 58.39 ? 392 ASP B C 1 ATOM 9537 O O . ASP B 2 411 ? 22.552 -3.695 7.347 1.00 68.34 ? 392 ASP B O 1 ATOM 9538 C CB . ASP B 2 411 ? 20.257 -3.587 9.765 1.00 75.06 ? 392 ASP B CB 1 ATOM 9539 C CG . ASP B 2 411 ? 20.356 -2.147 9.300 1.00 85.09 ? 392 ASP B CG 1 ATOM 9540 O OD1 . ASP B 2 411 ? 19.535 -1.734 8.451 1.00 70.60 ? 392 ASP B OD1 1 ATOM 9541 O OD2 . ASP B 2 411 ? 21.256 -1.429 9.783 1.00 100.56 ? 392 ASP B OD2 1 ATOM 9542 N N . GLY B 2 412 ? 20.762 -5.040 7.084 1.00 66.91 ? 393 GLY B N 1 ATOM 9543 C CA . GLY B 2 412 ? 20.874 -5.140 5.638 1.00 65.87 ? 393 GLY B CA 1 ATOM 9544 C C . GLY B 2 412 ? 21.106 -3.814 4.941 1.00 64.96 ? 393 GLY B C 1 ATOM 9545 O O . GLY B 2 412 ? 21.964 -3.702 4.063 1.00 69.80 ? 393 GLY B O 1 ATOM 9546 N N . GLY B 2 413 ? 20.341 -2.805 5.343 1.00 47.16 ? 394 GLY B N 1 ATOM 9547 C CA . GLY B 2 413 ? 20.500 -1.470 4.804 1.00 57.56 ? 394 GLY B CA 1 ATOM 9548 C C . GLY B 2 413 ? 21.931 -0.980 4.900 1.00 64.33 ? 394 GLY B C 1 ATOM 9549 O O . GLY B 2 413 ? 22.519 -0.563 3.906 1.00 64.10 ? 394 GLY B O 1 ATOM 9550 N N . PHE B 2 414 ? 22.503 -1.048 6.096 1.00 66.73 ? 395 PHE B N 1 ATOM 9551 C CA . PHE B 2 414 ? 23.873 -0.592 6.293 1.00 61.02 ? 395 PHE B CA 1 ATOM 9552 C C . PHE B 2 414 ? 24.931 -1.574 5.787 1.00 75.41 ? 395 PHE B C 1 ATOM 9553 O O . PHE B 2 414 ? 26.123 -1.280 5.827 1.00 86.17 ? 395 PHE B O 1 ATOM 9554 C CB . PHE B 2 414 ? 24.119 -0.206 7.751 1.00 55.21 ? 395 PHE B CB 1 ATOM 9555 C CG . PHE B 2 414 ? 23.687 1.191 8.078 1.00 60.42 ? 395 PHE B CG 1 ATOM 9556 C CD1 . PHE B 2 414 ? 22.538 1.424 8.809 1.00 63.94 ? 395 PHE B CD1 1 ATOM 9557 C CD2 . PHE B 2 414 ? 24.418 2.274 7.629 1.00 65.23 ? 395 PHE B CD2 1 ATOM 9558 C CE1 . PHE B 2 414 ? 22.135 2.709 9.099 1.00 60.98 ? 395 PHE B CE1 1 ATOM 9559 C CE2 . PHE B 2 414 ? 24.017 3.561 7.915 1.00 63.31 ? 395 PHE B CE2 1 ATOM 9560 C CZ . PHE B 2 414 ? 22.875 3.777 8.651 1.00 61.88 ? 395 PHE B CZ 1 ATOM 9561 N N . VAL B 2 415 ? 24.497 -2.734 5.306 1.00 68.72 ? 396 VAL B N 1 ATOM 9562 C CA . VAL B 2 415 ? 25.414 -3.658 4.653 1.00 65.39 ? 396 VAL B CA 1 ATOM 9563 C C . VAL B 2 415 ? 25.592 -3.220 3.198 1.00 70.54 ? 396 VAL B C 1 ATOM 9564 O O . VAL B 2 415 ? 26.678 -3.338 2.627 1.00 78.52 ? 396 VAL B O 1 ATOM 9565 C CB . VAL B 2 415 ? 24.933 -5.136 4.744 1.00 56.77 ? 396 VAL B CB 1 ATOM 9566 C CG1 . VAL B 2 415 ? 25.849 -6.053 3.946 1.00 47.97 ? 396 VAL B CG1 1 ATOM 9567 C CG2 . VAL B 2 415 ? 24.876 -5.597 6.198 1.00 41.63 ? 396 VAL B CG2 1 ATOM 9568 N N . TYR B 2 416 ? 24.522 -2.688 2.613 1.00 61.80 ? 397 TYR B N 1 ATOM 9569 C CA . TYR B 2 416 ? 24.562 -2.172 1.246 1.00 54.75 ? 397 TYR B CA 1 ATOM 9570 C C . TYR B 2 416 ? 25.525 -0.996 1.106 1.00 60.58 ? 397 TYR B C 1 ATOM 9571 O O . TYR B 2 416 ? 26.348 -0.961 0.194 1.00 68.57 ? 397 TYR B O 1 ATOM 9572 C CB . TYR B 2 416 ? 23.164 -1.749 0.786 1.00 55.74 ? 397 TYR B CB 1 ATOM 9573 C CG . TYR B 2 416 ? 23.118 -1.241 -0.640 1.00 61.29 ? 397 TYR B CG 1 ATOM 9574 C CD1 . TYR B 2 416 ? 23.032 -2.124 -1.709 1.00 60.88 ? 397 TYR B CD1 1 ATOM 9575 C CD2 . TYR B 2 416 ? 23.165 0.121 -0.917 1.00 61.42 ? 397 TYR B CD2 1 ATOM 9576 C CE1 . TYR B 2 416 ? 22.992 -1.663 -3.016 1.00 80.09 ? 397 TYR B CE1 1 ATOM 9577 C CE2 . TYR B 2 416 ? 23.128 0.589 -2.221 1.00 64.95 ? 397 TYR B CE2 1 ATOM 9578 C CZ . TYR B 2 416 ? 23.038 -0.307 -3.265 1.00 76.38 ? 397 TYR B CZ 1 ATOM 9579 O OH . TYR B 2 416 ? 22.998 0.152 -4.563 1.00 81.33 ? 397 TYR B OH 1 ATOM 9580 N N . ILE B 2 417 ? 25.412 -0.029 2.009 1.00 64.14 ? 398 ILE B N 1 ATOM 9581 C CA . ILE B 2 417 ? 26.293 1.131 1.979 1.00 71.52 ? 398 ILE B CA 1 ATOM 9582 C C . ILE B 2 417 ? 27.739 0.749 2.332 1.00 71.48 ? 398 ILE B C 1 ATOM 9583 O O . ILE B 2 417 ? 28.678 1.203 1.674 1.00 69.29 ? 398 ILE B O 1 ATOM 9584 C CB . ILE B 2 417 ? 25.742 2.316 2.842 1.00 57.97 ? 398 ILE B CB 1 ATOM 9585 C CG1 . ILE B 2 417 ? 26.862 3.022 3.598 1.00 53.72 ? 398 ILE B CG1 1 ATOM 9586 C CG2 . ILE B 2 417 ? 24.673 1.851 3.802 1.00 66.73 ? 398 ILE B CG2 1 ATOM 9587 C CD1 . ILE B 2 417 ? 27.570 4.050 2.773 1.00 75.59 ? 398 ILE B CD1 1 ATOM 9588 N N . ALA B 2 418 ? 27.915 -0.103 3.339 1.00 62.85 ? 399 ALA B N 1 ATOM 9589 C CA . ALA B 2 418 ? 29.251 -0.583 3.702 1.00 58.09 ? 399 ALA B CA 1 ATOM 9590 C C . ALA B 2 418 ? 29.916 -1.337 2.549 1.00 59.89 ? 399 ALA B C 1 ATOM 9591 O O . ALA B 2 418 ? 31.138 -1.291 2.383 1.00 50.90 ? 399 ALA B O 1 ATOM 9592 C CB . ALA B 2 418 ? 29.189 -1.462 4.941 1.00 49.26 ? 399 ALA B CB 1 ATOM 9593 N N . GLY B 2 419 ? 29.102 -2.027 1.755 1.00 60.27 ? 400 GLY B N 1 ATOM 9594 C CA . GLY B 2 419 ? 29.590 -2.758 0.600 1.00 58.64 ? 400 GLY B CA 1 ATOM 9595 C C . GLY B 2 419 ? 29.988 -1.837 -0.536 1.00 70.73 ? 400 GLY B C 1 ATOM 9596 O O . GLY B 2 419 ? 30.979 -2.076 -1.223 1.00 83.18 ? 400 GLY B O 1 ATOM 9597 N N . LYS B 2 420 ? 29.210 -0.778 -0.733 1.00 70.46 ? 401 LYS B N 1 ATOM 9598 C CA . LYS B 2 420 ? 29.556 0.255 -1.703 1.00 64.68 ? 401 LYS B CA 1 ATOM 9599 C C . LYS B 2 420 ? 30.826 0.981 -1.266 1.00 66.49 ? 401 LYS B C 1 ATOM 9600 O O . LYS B 2 420 ? 31.439 1.705 -2.051 1.00 75.41 ? 401 LYS B O 1 ATOM 9601 C CB . LYS B 2 420 ? 28.407 1.256 -1.865 1.00 58.82 ? 401 LYS B CB 1 ATOM 9602 C CG . LYS B 2 420 ? 27.265 0.787 -2.760 1.00 57.21 ? 401 LYS B CG 1 ATOM 9603 C CD . LYS B 2 420 ? 27.670 0.814 -4.225 1.00 66.71 ? 401 LYS B CD 1 ATOM 9604 C CE . LYS B 2 420 ? 26.474 0.619 -5.147 1.00 69.31 ? 401 LYS B CE 1 ATOM 9605 N NZ . LYS B 2 420 ? 26.844 0.825 -6.581 1.00 72.63 ? 401 LYS B NZ 1 ATOM 9606 N N . CYS B 2 421 ? 31.210 0.786 -0.008 1.00 60.80 ? 402 CYS B N 1 ATOM 9607 C CA . CYS B 2 421 ? 32.417 1.398 0.532 1.00 62.42 ? 402 CYS B CA 1 ATOM 9608 C C . CYS B 2 421 ? 33.588 0.411 0.606 1.00 68.55 ? 402 CYS B C 1 ATOM 9609 O O . CYS B 2 421 ? 34.660 0.737 1.128 1.00 61.85 ? 402 CYS B O 1 ATOM 9610 C CB . CYS B 2 421 ? 32.141 2.004 1.907 1.00 51.69 ? 402 CYS B CB 1 ATOM 9611 S SG . CYS B 2 421 ? 31.134 3.492 1.874 1.00 68.22 ? 402 CYS B SG 1 ATOM 9612 N N . GLY B 2 422 ? 33.376 -0.796 0.085 1.00 70.11 ? 403 GLY B N 1 ATOM 9613 C CA . GLY B 2 422 ? 34.453 -1.763 -0.058 1.00 48.84 ? 403 GLY B CA 1 ATOM 9614 C C . GLY B 2 422 ? 34.586 -2.755 1.078 1.00 58.88 ? 403 GLY B C 1 ATOM 9615 O O . GLY B 2 422 ? 35.563 -3.502 1.140 1.00 52.36 ? 403 GLY B O 1 ATOM 9616 N N . LEU B 2 423 ? 33.610 -2.762 1.981 1.00 58.45 ? 404 LEU B N 1 ATOM 9617 C CA . LEU B 2 423 ? 33.609 -3.713 3.083 1.00 52.17 ? 404 LEU B CA 1 ATOM 9618 C C . LEU B 2 423 ? 32.863 -4.987 2.711 1.00 55.77 ? 404 LEU B C 1 ATOM 9619 O O . LEU B 2 423 ? 32.024 -4.991 1.811 1.00 56.67 ? 404 LEU B O 1 ATOM 9620 C CB . LEU B 2 423 ? 32.989 -3.097 4.331 1.00 44.46 ? 404 LEU B CB 1 ATOM 9621 C CG . LEU B 2 423 ? 33.682 -1.829 4.817 1.00 57.58 ? 404 LEU B CG 1 ATOM 9622 C CD1 . LEU B 2 423 ? 33.164 -1.422 6.195 1.00 45.30 ? 404 LEU B CD1 1 ATOM 9623 C CD2 . LEU B 2 423 ? 35.181 -2.030 4.826 1.00 50.43 ? 404 LEU B CD2 1 ATOM 9624 N N . VAL B 2 424 ? 33.179 -6.069 3.411 1.00 52.40 ? 405 VAL B N 1 ATOM 9625 C CA . VAL B 2 424 ? 32.529 -7.347 3.165 1.00 56.23 ? 405 VAL B CA 1 ATOM 9626 C C . VAL B 2 424 ? 31.913 -7.913 4.436 1.00 52.97 ? 405 VAL B C 1 ATOM 9627 O O . VAL B 2 424 ? 32.409 -7.673 5.534 1.00 57.33 ? 405 VAL B O 1 ATOM 9628 C CB . VAL B 2 424 ? 33.516 -8.370 2.580 1.00 51.18 ? 405 VAL B CB 1 ATOM 9629 C CG1 . VAL B 2 424 ? 33.821 -8.028 1.140 1.00 42.38 ? 405 VAL B CG1 1 ATOM 9630 C CG2 . VAL B 2 424 ? 34.795 -8.412 3.408 1.00 42.28 ? 405 VAL B CG2 1 ATOM 9631 N N . PRO B 2 425 ? 30.809 -8.653 4.290 1.00 45.68 ? 406 PRO B N 1 ATOM 9632 C CA . PRO B 2 425 ? 30.240 -9.379 5.427 1.00 49.85 ? 406 PRO B CA 1 ATOM 9633 C C . PRO B 2 425 ? 30.995 -10.685 5.702 1.00 51.13 ? 406 PRO B C 1 ATOM 9634 O O . PRO B 2 425 ? 31.285 -11.430 4.769 1.00 56.77 ? 406 PRO B O 1 ATOM 9635 C CB . PRO B 2 425 ? 28.810 -9.667 4.969 1.00 44.96 ? 406 PRO B CB 1 ATOM 9636 C CG . PRO B 2 425 ? 28.886 -9.696 3.486 1.00 46.09 ? 406 PRO B CG 1 ATOM 9637 C CD . PRO B 2 425 ? 29.931 -8.687 3.108 1.00 40.40 ? 406 PRO B CD 1 ATOM 9638 N N . VAL B 2 426 ? 31.314 -10.941 6.968 1.00 51.85 ? 407 VAL B N 1 ATOM 9639 C CA . VAL B 2 426 ? 32.017 -12.161 7.367 1.00 51.66 ? 407 VAL B CA 1 ATOM 9640 C C . VAL B 2 426 ? 31.058 -13.197 7.933 1.00 60.98 ? 407 VAL B C 1 ATOM 9641 O O . VAL B 2 426 ? 31.125 -14.378 7.591 1.00 72.83 ? 407 VAL B O 1 ATOM 9642 C CB . VAL B 2 426 ? 33.066 -11.889 8.472 1.00 43.96 ? 407 VAL B CB 1 ATOM 9643 C CG1 . VAL B 2 426 ? 34.443 -12.316 8.025 1.00 40.21 ? 407 VAL B CG1 1 ATOM 9644 C CG2 . VAL B 2 426 ? 33.055 -10.431 8.883 1.00 44.90 ? 407 VAL B CG2 1 ATOM 9645 N N . LEU B 2 427 ? 30.179 -12.743 8.822 1.00 52.40 ? 408 LEU B N 1 ATOM 9646 C CA . LEU B 2 427 ? 29.288 -13.630 9.559 1.00 47.18 ? 408 LEU B CA 1 ATOM 9647 C C . LEU B 2 427 ? 27.873 -13.066 9.653 1.00 44.37 ? 408 LEU B C 1 ATOM 9648 O O . LEU B 2 427 ? 27.674 -11.861 9.771 1.00 44.58 ? 408 LEU B O 1 ATOM 9649 C CB . LEU B 2 427 ? 29.841 -13.879 10.964 1.00 44.91 ? 408 LEU B CB 1 ATOM 9650 C CG . LEU B 2 427 ? 31.207 -14.560 11.026 1.00 42.02 ? 408 LEU B CG 1 ATOM 9651 C CD1 . LEU B 2 427 ? 31.929 -14.204 12.304 1.00 38.42 ? 408 LEU B CD1 1 ATOM 9652 C CD2 . LEU B 2 427 ? 31.044 -16.060 10.909 1.00 45.17 ? 408 LEU B CD2 1 ATOM 9653 N N . ALA B 2 428 ? 26.890 -13.953 9.602 1.00 41.09 ? 409 ALA B N 1 ATOM 9654 C CA . ALA B 2 428 ? 25.499 -13.556 9.705 1.00 39.05 ? 409 ALA B CA 1 ATOM 9655 C C . ALA B 2 428 ? 24.950 -13.946 11.066 1.00 42.31 ? 409 ALA B C 1 ATOM 9656 O O . ALA B 2 428 ? 25.283 -15.004 11.593 1.00 46.86 ? 409 ALA B O 1 ATOM 9657 C CB . ALA B 2 428 ? 24.690 -14.213 8.605 1.00 46.76 ? 409 ALA B CB 1 ATOM 9658 N N . GLU B 2 429 ? 24.119 -13.085 11.642 1.00 43.19 ? 410 GLU B N 1 ATOM 9659 C CA . GLU B 2 429 ? 23.431 -13.427 12.878 1.00 44.64 ? 410 GLU B CA 1 ATOM 9660 C C . GLU B 2 429 ? 22.297 -14.399 12.572 1.00 59.24 ? 410 GLU B C 1 ATOM 9661 O O . GLU B 2 429 ? 21.503 -14.177 11.658 1.00 73.56 ? 410 GLU B O 1 ATOM 9662 C CB . GLU B 2 429 ? 22.891 -12.178 13.572 1.00 36.61 ? 410 GLU B CB 1 ATOM 9663 C CG . GLU B 2 429 ? 23.962 -11.259 14.150 1.00 50.34 ? 410 GLU B CG 1 ATOM 9664 C CD . GLU B 2 429 ? 23.365 -10.044 14.840 1.00 67.20 ? 410 GLU B CD 1 ATOM 9665 O OE1 . GLU B 2 429 ? 22.138 -9.858 14.734 1.00 63.45 ? 410 GLU B OE1 1 ATOM 9666 O OE2 . GLU B 2 429 ? 24.112 -9.278 15.488 1.00 81.44 ? 410 GLU B OE2 1 ATOM 9667 N N . ASN B 2 430 ? 22.240 -15.489 13.327 1.00 55.34 ? 411 ASN B N 1 ATOM 9668 C CA . ASN B 2 430 ? 21.216 -16.502 13.124 1.00 51.17 ? 411 ASN B CA 1 ATOM 9669 C C . ASN B 2 430 ? 20.314 -16.628 14.334 1.00 53.11 ? 411 ASN B C 1 ATOM 9670 O O . ASN B 2 430 ? 20.785 -16.584 15.466 1.00 54.47 ? 411 ASN B O 1 ATOM 9671 C CB . ASN B 2 430 ? 21.851 -17.853 12.798 1.00 48.87 ? 411 ASN B CB 1 ATOM 9672 C CG . ASN B 2 430 ? 22.029 -18.070 11.307 1.00 52.01 ? 411 ASN B CG 1 ATOM 9673 O OD1 . ASN B 2 430 ? 21.815 -17.164 10.500 1.00 60.89 ? 411 ASN B OD1 1 ATOM 9674 N ND2 . ASN B 2 430 ? 22.426 -19.276 10.935 1.00 52.32 ? 411 ASN B ND2 1 ATOM 9675 N N . TYR B 2 431 ? 19.019 -16.795 14.086 1.00 55.02 ? 412 TYR B N 1 ATOM 9676 C CA . TYR B 2 431 ? 18.032 -16.811 15.158 1.00 51.33 ? 412 TYR B CA 1 ATOM 9677 C C . TYR B 2 431 ? 17.296 -18.145 15.272 1.00 63.80 ? 412 TYR B C 1 ATOM 9678 O O . TYR B 2 431 ? 16.570 -18.384 16.239 1.00 67.11 ? 412 TYR B O 1 ATOM 9679 C CB . TYR B 2 431 ? 17.051 -15.654 14.975 1.00 50.21 ? 412 TYR B CB 1 ATOM 9680 C CG . TYR B 2 431 ? 17.754 -14.337 14.726 1.00 51.44 ? 412 TYR B CG 1 ATOM 9681 C CD1 . TYR B 2 431 ? 18.562 -13.765 15.700 1.00 49.89 ? 412 TYR B CD1 1 ATOM 9682 C CD2 . TYR B 2 431 ? 17.624 -13.674 13.510 1.00 63.83 ? 412 TYR B CD2 1 ATOM 9683 C CE1 . TYR B 2 431 ? 19.217 -12.567 15.474 1.00 55.16 ? 412 TYR B CE1 1 ATOM 9684 C CE2 . TYR B 2 431 ? 18.275 -12.477 13.274 1.00 58.14 ? 412 TYR B CE2 1 ATOM 9685 C CZ . TYR B 2 431 ? 19.070 -11.930 14.260 1.00 56.93 ? 412 TYR B CZ 1 ATOM 9686 O OH . TYR B 2 431 ? 19.720 -10.741 14.034 1.00 54.33 ? 412 TYR B OH 1 ATOM 9687 N N . ASN B 2 432 ? 17.497 -19.015 14.289 1.00 64.77 ? 413 ASN B N 1 ATOM 9688 C CA . ASN B 2 432 ? 16.871 -20.332 14.291 1.00 56.46 ? 413 ASN B CA 1 ATOM 9689 C C . ASN B 2 432 ? 17.588 -21.321 15.199 1.00 66.06 ? 413 ASN B C 1 ATOM 9690 O O . ASN B 2 432 ? 18.814 -21.440 15.163 1.00 70.23 ? 413 ASN B O 1 ATOM 9691 C CB . ASN B 2 432 ? 16.816 -20.905 12.877 1.00 63.82 ? 413 ASN B CB 1 ATOM 9692 C CG . ASN B 2 432 ? 15.707 -20.305 12.045 1.00 65.97 ? 413 ASN B CG 1 ATOM 9693 O OD1 . ASN B 2 432 ? 15.104 -19.302 12.420 1.00 68.67 ? 413 ASN B OD1 1 ATOM 9694 N ND2 . ASN B 2 432 ? 15.426 -20.929 10.907 1.00 71.51 ? 413 ASN B ND2 1 ATOM 9695 N N . LYS B 2 433 ? 16.814 -22.032 16.008 1.00 64.98 ? 414 LYS B N 1 ATOM 9696 C CA . LYS B 2 433 ? 17.347 -23.122 16.807 1.00 55.82 ? 414 LYS B CA 1 ATOM 9697 C C . LYS B 2 433 ? 17.535 -24.345 15.922 1.00 56.98 ? 414 LYS B C 1 ATOM 9698 O O . LYS B 2 433 ? 16.561 -24.930 15.449 1.00 60.31 ? 414 LYS B O 1 ATOM 9699 C CB . LYS B 2 433 ? 16.403 -23.444 17.966 1.00 52.14 ? 414 LYS B CB 1 ATOM 9700 C CG . LYS B 2 433 ? 16.545 -22.505 19.155 1.00 66.15 ? 414 LYS B CG 1 ATOM 9701 C CD . LYS B 2 433 ? 15.288 -22.485 20.015 1.00 84.04 ? 414 LYS B CD 1 ATOM 9702 C CE . LYS B 2 433 ? 14.150 -21.752 19.312 1.00 101.59 ? 414 LYS B CE 1 ATOM 9703 N NZ . LYS B 2 433 ? 12.938 -21.618 20.173 1.00 104.41 ? 414 LYS B NZ 1 ATOM 9704 N N . SER B 2 434 ? 18.789 -24.715 15.684 1.00 52.68 ? 415 SER B N 1 ATOM 9705 C CA . SER B 2 434 ? 19.101 -25.900 14.889 1.00 51.47 ? 415 SER B CA 1 ATOM 9706 C C . SER B 2 434 ? 20.506 -26.399 15.201 1.00 45.01 ? 415 SER B C 1 ATOM 9707 O O . SER B 2 434 ? 21.379 -25.614 15.566 1.00 38.49 ? 415 SER B O 1 ATOM 9708 C CB . SER B 2 434 ? 18.976 -25.597 13.396 1.00 53.72 ? 415 SER B CB 1 ATOM 9709 O OG . SER B 2 434 ? 19.997 -24.714 12.972 1.00 63.01 ? 415 SER B OG 1 ATOM 9710 N N . ASP B 2 435 ? 20.719 -27.703 15.049 1.00 36.24 ? 416 ASP B N 1 ATOM 9711 C CA . ASP B 2 435 ? 22.015 -28.310 15.341 1.00 52.33 ? 416 ASP B CA 1 ATOM 9712 C C . ASP B 2 435 ? 23.139 -27.753 14.473 1.00 53.50 ? 416 ASP B C 1 ATOM 9713 O O . ASP B 2 435 ? 24.283 -27.678 14.910 1.00 54.47 ? 416 ASP B O 1 ATOM 9714 C CB . ASP B 2 435 ? 21.959 -29.827 15.169 1.00 37.15 ? 416 ASP B CB 1 ATOM 9715 C CG . ASP B 2 435 ? 20.950 -30.487 16.083 1.00 50.14 ? 416 ASP B CG 1 ATOM 9716 O OD1 . ASP B 2 435 ? 21.309 -31.504 16.710 1.00 46.95 ? 416 ASP B OD1 1 ATOM 9717 O OD2 . ASP B 2 435 ? 19.797 -30.008 16.164 1.00 51.05 ? 416 ASP B OD2 1 ATOM 9718 N N . ASN B 2 436 ? 22.820 -27.369 13.242 1.00 61.28 ? 417 ASN B N 1 ATOM 9719 C CA . ASN B 2 436 ? 23.844 -26.859 12.334 1.00 61.07 ? 417 ASN B CA 1 ATOM 9720 C C . ASN B 2 436 ? 23.764 -25.359 12.093 1.00 56.34 ? 417 ASN B C 1 ATOM 9721 O O . ASN B 2 436 ? 23.981 -24.887 10.978 1.00 70.96 ? 417 ASN B O 1 ATOM 9722 C CB . ASN B 2 436 ? 23.807 -27.613 11.008 1.00 55.16 ? 417 ASN B CB 1 ATOM 9723 C CG . ASN B 2 436 ? 24.611 -28.886 11.053 1.00 53.91 ? 417 ASN B CG 1 ATOM 9724 O OD1 . ASN B 2 436 ? 25.787 -28.878 11.424 1.00 57.54 ? 417 ASN B OD1 1 ATOM 9725 N ND2 . ASN B 2 436 ? 23.979 -29.995 10.696 1.00 47.33 ? 417 ASN B ND2 1 ATOM 9726 N N . CYS B 2 437 ? 23.471 -24.616 13.151 1.00 50.97 ? 418 CYS B N 1 ATOM 9727 C CA . CYS B 2 437 ? 23.253 -23.182 13.038 1.00 54.60 ? 418 CYS B CA 1 ATOM 9728 C C . CYS B 2 437 ? 24.451 -22.442 12.471 1.00 55.26 ? 418 CYS B C 1 ATOM 9729 O O . CYS B 2 437 ? 24.293 -21.571 11.624 1.00 62.14 ? 418 CYS B O 1 ATOM 9730 C CB . CYS B 2 437 ? 22.884 -22.588 14.396 1.00 40.22 ? 418 CYS B CB 1 ATOM 9731 S SG . CYS B 2 437 ? 22.933 -20.795 14.432 1.00 84.15 ? 418 CYS B SG 1 ATOM 9732 N N . GLU B 2 438 ? 25.645 -22.790 12.937 1.00 56.45 ? 419 GLU B N 1 ATOM 9733 C CA . GLU B 2 438 ? 26.843 -22.030 12.590 1.00 60.11 ? 419 GLU B CA 1 ATOM 9734 C C . GLU B 2 438 ? 27.386 -22.356 11.202 1.00 58.20 ? 419 GLU B C 1 ATOM 9735 O O . GLU B 2 438 ? 28.378 -21.774 10.766 1.00 55.20 ? 419 GLU B O 1 ATOM 9736 C CB . GLU B 2 438 ? 27.927 -22.220 13.651 1.00 55.79 ? 419 GLU B CB 1 ATOM 9737 C CG . GLU B 2 438 ? 28.046 -23.648 14.137 1.00 74.09 ? 419 GLU B CG 1 ATOM 9738 C CD . GLU B 2 438 ? 28.980 -23.789 15.319 1.00 73.79 ? 419 GLU B CD 1 ATOM 9739 O OE1 . GLU B 2 438 ? 29.931 -22.990 15.431 1.00 69.44 ? 419 GLU B OE1 1 ATOM 9740 O OE2 . GLU B 2 438 ? 28.758 -24.702 16.141 1.00 75.32 ? 419 GLU B OE2 1 ATOM 9741 N N . ASP B 2 439 ? 26.725 -23.273 10.505 1.00 57.89 ? 420 ASP B N 1 ATOM 9742 C CA . ASP B 2 439 ? 27.137 -23.645 9.157 1.00 62.11 ? 420 ASP B CA 1 ATOM 9743 C C . ASP B 2 439 ? 26.132 -23.174 8.113 1.00 64.72 ? 420 ASP B C 1 ATOM 9744 O O . ASP B 2 439 ? 26.425 -23.174 6.918 1.00 70.12 ? 420 ASP B O 1 ATOM 9745 C CB . ASP B 2 439 ? 27.320 -25.164 9.044 1.00 71.26 ? 420 ASP B CB 1 ATOM 9746 C CG . ASP B 2 439 ? 28.739 -25.616 9.365 1.00 87.75 ? 420 ASP B CG 1 ATOM 9747 O OD1 . ASP B 2 439 ? 29.320 -25.137 10.366 1.00 78.12 ? 420 ASP B OD1 1 ATOM 9748 O OD2 . ASP B 2 439 ? 29.273 -26.456 8.606 1.00 96.18 ? 420 ASP B OD2 1 ATOM 9749 N N . THR B 2 440 ? 24.947 -22.775 8.567 1.00 66.36 ? 421 THR B N 1 ATOM 9750 C CA . THR B 2 440 ? 23.852 -22.445 7.656 1.00 72.33 ? 421 THR B CA 1 ATOM 9751 C C . THR B 2 440 ? 23.270 -21.044 7.892 1.00 65.67 ? 421 THR B C 1 ATOM 9752 O O . THR B 2 440 ? 22.446 -20.854 8.787 1.00 58.74 ? 421 THR B O 1 ATOM 9753 C CB . THR B 2 440 ? 22.713 -23.503 7.735 1.00 83.80 ? 421 THR B CB 1 ATOM 9754 O OG1 . THR B 2 440 ? 22.107 -23.474 9.032 1.00 83.18 ? 421 THR B OG1 1 ATOM 9755 C CG2 . THR B 2 440 ? 23.250 -24.907 7.470 1.00 78.02 ? 421 THR B CG2 1 ATOM 9756 N N . PRO B 2 441 ? 23.691 -20.063 7.075 1.00 64.80 ? 422 PRO B N 1 ATOM 9757 C CA . PRO B 2 441 ? 23.204 -18.676 7.142 1.00 62.21 ? 422 PRO B CA 1 ATOM 9758 C C . PRO B 2 441 ? 21.728 -18.577 6.789 1.00 56.26 ? 422 PRO B C 1 ATOM 9759 O O . PRO B 2 441 ? 21.308 -19.115 5.766 1.00 62.60 ? 422 PRO B O 1 ATOM 9760 C CB . PRO B 2 441 ? 24.018 -17.956 6.060 1.00 55.15 ? 422 PRO B CB 1 ATOM 9761 C CG . PRO B 2 441 ? 25.140 -18.860 5.734 1.00 61.90 ? 422 PRO B CG 1 ATOM 9762 C CD . PRO B 2 441 ? 24.666 -20.248 5.991 1.00 61.84 ? 422 PRO B CD 1 ATOM 9763 N N . GLU B 2 442 ? 20.954 -17.888 7.617 1.00 55.61 ? 423 GLU B N 1 ATOM 9764 C CA . GLU B 2 442 ? 19.525 -17.746 7.374 1.00 58.33 ? 423 GLU B CA 1 ATOM 9765 C C . GLU B 2 442 ? 19.249 -16.720 6.280 1.00 63.99 ? 423 GLU B C 1 ATOM 9766 O O . GLU B 2 442 ? 20.024 -15.783 6.088 1.00 71.61 ? 423 GLU B O 1 ATOM 9767 C CB . GLU B 2 442 ? 18.807 -17.362 8.665 1.00 60.47 ? 423 GLU B CB 1 ATOM 9768 C CG . GLU B 2 442 ? 18.897 -18.422 9.748 1.00 57.49 ? 423 GLU B CG 1 ATOM 9769 C CD . GLU B 2 442 ? 18.614 -17.871 11.133 1.00 71.23 ? 423 GLU B CD 1 ATOM 9770 O OE1 . GLU B 2 442 ? 18.177 -16.704 11.244 1.00 82.42 ? 423 GLU B OE1 1 ATOM 9771 O OE2 . GLU B 2 442 ? 18.836 -18.607 12.115 1.00 67.80 ? 423 GLU B OE2 1 ATOM 9772 N N . ALA B 2 443 ? 18.145 -16.905 5.563 1.00 59.74 ? 424 ALA B N 1 ATOM 9773 C CA . ALA B 2 443 ? 17.786 -16.009 4.467 1.00 62.22 ? 424 ALA B CA 1 ATOM 9774 C C . ALA B 2 443 ? 17.434 -14.602 4.955 1.00 69.27 ? 424 ALA B C 1 ATOM 9775 O O . ALA B 2 443 ? 17.768 -13.613 4.301 1.00 81.89 ? 424 ALA B O 1 ATOM 9776 C CB . ALA B 2 443 ? 16.643 -16.600 3.642 1.00 36.93 ? 424 ALA B CB 1 ATOM 9777 N N . GLY B 2 444 ? 16.765 -14.519 6.103 1.00 63.89 ? 425 GLY B N 1 ATOM 9778 C CA . GLY B 2 444 ? 16.389 -13.240 6.681 1.00 59.86 ? 425 GLY B CA 1 ATOM 9779 C C . GLY B 2 444 ? 14.891 -13.093 6.877 1.00 59.39 ? 425 GLY B C 1 ATOM 9780 O O . GLY B 2 444 ? 14.205 -14.055 7.222 1.00 71.88 ? 425 GLY B O 1 ATOM 9781 N N . TYR B 2 445 ? 14.381 -11.886 6.659 1.00 51.03 ? 426 TYR B N 1 ATOM 9782 C CA . TYR B 2 445 ? 12.945 -11.638 6.778 1.00 56.71 ? 426 TYR B CA 1 ATOM 9783 C C . TYR B 2 445 ? 12.303 -11.108 5.493 1.00 68.36 ? 426 TYR B C 1 ATOM 9784 O O . TYR B 2 445 ? 12.911 -11.121 4.420 1.00 73.28 ? 426 TYR B O 1 ATOM 9785 C CB . TYR B 2 445 ? 12.645 -10.699 7.950 1.00 52.05 ? 426 TYR B CB 1 ATOM 9786 C CG . TYR B 2 445 ? 13.309 -9.338 7.881 1.00 66.33 ? 426 TYR B CG 1 ATOM 9787 C CD1 . TYR B 2 445 ? 12.667 -8.256 7.293 1.00 73.15 ? 426 TYR B CD1 1 ATOM 9788 C CD2 . TYR B 2 445 ? 14.566 -9.131 8.431 1.00 71.67 ? 426 TYR B CD2 1 ATOM 9789 C CE1 . TYR B 2 445 ? 13.267 -7.006 7.244 1.00 74.40 ? 426 TYR B CE1 1 ATOM 9790 C CE2 . TYR B 2 445 ? 15.174 -7.890 8.387 1.00 64.37 ? 426 TYR B CE2 1 ATOM 9791 C CZ . TYR B 2 445 ? 14.522 -6.829 7.793 1.00 71.74 ? 426 TYR B CZ 1 ATOM 9792 O OH . TYR B 2 445 ? 15.131 -5.591 7.751 1.00 53.34 ? 426 TYR B OH 1 ATOM 9793 N N . PHE B 2 446 ? 11.059 -10.657 5.612 1.00 59.53 ? 427 PHE B N 1 ATOM 9794 C CA . PHE B 2 446 ? 10.343 -10.062 4.491 1.00 52.44 ? 427 PHE B CA 1 ATOM 9795 C C . PHE B 2 446 ? 9.813 -8.683 4.863 1.00 53.20 ? 427 PHE B C 1 ATOM 9796 O O . PHE B 2 446 ? 9.229 -8.501 5.930 1.00 56.45 ? 427 PHE B O 1 ATOM 9797 C CB . PHE B 2 446 ? 9.163 -10.938 4.065 1.00 43.90 ? 427 PHE B CB 1 ATOM 9798 C CG . PHE B 2 446 ? 9.549 -12.156 3.284 1.00 49.47 ? 427 PHE B CG 1 ATOM 9799 C CD1 . PHE B 2 446 ? 9.480 -13.418 3.859 1.00 57.72 ? 427 PHE B CD1 1 ATOM 9800 C CD2 . PHE B 2 446 ? 9.963 -12.048 1.969 1.00 51.09 ? 427 PHE B CD2 1 ATOM 9801 C CE1 . PHE B 2 446 ? 9.823 -14.550 3.132 1.00 46.32 ? 427 PHE B CE1 1 ATOM 9802 C CE2 . PHE B 2 446 ? 10.308 -13.172 1.241 1.00 53.20 ? 427 PHE B CE2 1 ATOM 9803 C CZ . PHE B 2 446 ? 10.234 -14.425 1.823 1.00 51.05 ? 427 PHE B CZ 1 ATOM 9804 N N . ALA B 2 447 ? 10.015 -7.719 3.973 1.00 53.20 ? 428 ALA B N 1 ATOM 9805 C CA . ALA B 2 447 ? 9.421 -6.399 4.121 1.00 50.98 ? 428 ALA B CA 1 ATOM 9806 C C . ALA B 2 447 ? 8.051 -6.419 3.458 1.00 61.50 ? 428 ALA B C 1 ATOM 9807 O O . ALA B 2 447 ? 7.922 -6.807 2.297 1.00 57.82 ? 428 ALA B O 1 ATOM 9808 C CB . ALA B 2 447 ? 10.303 -5.355 3.481 1.00 49.31 ? 428 ALA B CB 1 ATOM 9809 N N . VAL B 2 448 ? 7.027 -6.017 4.200 1.00 57.36 ? 429 VAL B N 1 ATOM 9810 C CA . VAL B 2 448 ? 5.661 -6.117 3.707 1.00 58.34 ? 429 VAL B CA 1 ATOM 9811 C C . VAL B 2 448 ? 4.889 -4.814 3.868 1.00 62.48 ? 429 VAL B C 1 ATOM 9812 O O . VAL B 2 448 ? 5.316 -3.903 4.580 1.00 70.11 ? 429 VAL B O 1 ATOM 9813 C CB . VAL B 2 448 ? 4.876 -7.229 4.441 1.00 61.43 ? 429 VAL B CB 1 ATOM 9814 C CG1 . VAL B 2 448 ? 5.550 -8.588 4.261 1.00 44.55 ? 429 VAL B CG1 1 ATOM 9815 C CG2 . VAL B 2 448 ? 4.728 -6.884 5.914 1.00 53.05 ? 429 VAL B CG2 1 ATOM 9816 N N . ALA B 2 449 ? 3.742 -4.740 3.202 1.00 52.80 ? 430 ALA B N 1 ATOM 9817 C CA . ALA B 2 449 ? 2.845 -3.601 3.331 1.00 53.80 ? 430 ALA B CA 1 ATOM 9818 C C . ALA B 2 449 ? 1.544 -4.051 3.977 1.00 52.05 ? 430 ALA B C 1 ATOM 9819 O O . ALA B 2 449 ? 0.802 -4.847 3.408 1.00 54.33 ? 430 ALA B O 1 ATOM 9820 C CB . ALA B 2 449 ? 2.581 -2.975 1.972 1.00 52.70 ? 430 ALA B CB 1 ATOM 9821 N N . VAL B 2 450 ? 1.271 -3.537 5.169 1.00 60.13 ? 431 VAL B N 1 ATOM 9822 C CA . VAL B 2 450 ? 0.113 -3.981 5.932 1.00 61.08 ? 431 VAL B CA 1 ATOM 9823 C C . VAL B 2 450 ? -1.040 -2.986 5.864 1.00 70.59 ? 431 VAL B C 1 ATOM 9824 O O . VAL B 2 450 ? -0.850 -1.783 6.029 1.00 82.45 ? 431 VAL B O 1 ATOM 9825 C CB . VAL B 2 450 ? 0.478 -4.222 7.406 1.00 50.78 ? 431 VAL B CB 1 ATOM 9826 C CG1 . VAL B 2 450 ? -0.692 -4.853 8.144 1.00 50.68 ? 431 VAL B CG1 1 ATOM 9827 C CG2 . VAL B 2 450 ? 1.712 -5.099 7.504 1.00 49.12 ? 431 VAL B CG2 1 ATOM 9828 N N . VAL B 2 451 ? -2.238 -3.504 5.618 1.00 65.62 ? 432 VAL B N 1 ATOM 9829 C CA . VAL B 2 451 ? -3.448 -2.696 5.625 1.00 63.54 ? 432 VAL B CA 1 ATOM 9830 C C . VAL B 2 451 ? -4.515 -3.395 6.460 1.00 66.40 ? 432 VAL B C 1 ATOM 9831 O O . VAL B 2 451 ? -4.378 -4.575 6.788 1.00 69.34 ? 432 VAL B O 1 ATOM 9832 C CB . VAL B 2 451 ? -3.986 -2.472 4.192 1.00 75.59 ? 432 VAL B CB 1 ATOM 9833 C CG1 . VAL B 2 451 ? -3.016 -1.624 3.384 1.00 76.83 ? 432 VAL B CG1 1 ATOM 9834 C CG2 . VAL B 2 451 ? -4.242 -3.804 3.493 1.00 54.74 ? 432 VAL B CG2 1 ATOM 9835 N N . LYS B 2 452 ? -5.569 -2.668 6.813 1.00 56.40 ? 433 LYS B N 1 ATOM 9836 C CA . LYS B 2 452 ? -6.719 -3.287 7.461 1.00 80.60 ? 433 LYS B CA 1 ATOM 9837 C C . LYS B 2 452 ? -7.594 -3.976 6.419 1.00 77.35 ? 433 LYS B C 1 ATOM 9838 O O . LYS B 2 452 ? -7.704 -3.511 5.282 1.00 74.36 ? 433 LYS B O 1 ATOM 9839 C CB . LYS B 2 452 ? -7.556 -2.248 8.199 1.00 76.30 ? 433 LYS B CB 1 ATOM 9840 C CG . LYS B 2 452 ? -6.782 -1.379 9.157 1.00 79.23 ? 433 LYS B CG 1 ATOM 9841 C CD . LYS B 2 452 ? -7.733 -0.505 9.953 1.00 79.05 ? 433 LYS B CD 1 ATOM 9842 C CE . LYS B 2 452 ? -6.986 0.585 10.675 1.00 78.39 ? 433 LYS B CE 1 ATOM 9843 N NZ . LYS B 2 452 ? -6.155 1.362 9.715 1.00 88.86 ? 433 LYS B NZ 1 ATOM 9844 N N . LYS B 2 453 ? -8.222 -5.079 6.811 1.00 66.07 ? 434 LYS B N 1 ATOM 9845 C CA . LYS B 2 453 ? -9.140 -5.781 5.920 1.00 74.62 ? 434 LYS B CA 1 ATOM 9846 C C . LYS B 2 453 ? -10.406 -4.959 5.687 1.00 68.33 ? 434 LYS B C 1 ATOM 9847 O O . LYS B 2 453 ? -11.046 -5.063 4.640 1.00 76.45 ? 434 LYS B O 1 ATOM 9848 C CB . LYS B 2 453 ? -9.497 -7.159 6.484 1.00 71.12 ? 434 LYS B CB 1 ATOM 9849 C CG . LYS B 2 453 ? -8.361 -8.161 6.437 1.00 65.31 ? 434 LYS B CG 1 ATOM 9850 C CD . LYS B 2 453 ? -8.799 -9.513 6.962 1.00 68.20 ? 434 LYS B CD 1 ATOM 9851 C CE . LYS B 2 453 ? -7.671 -10.529 6.879 1.00 65.84 ? 434 LYS B CE 1 ATOM 9852 N NZ . LYS B 2 453 ? -8.077 -11.865 7.407 1.00 53.08 ? 434 LYS B NZ 1 ATOM 9853 N N . SER B 2 454 ? -10.752 -4.138 6.672 1.00 61.68 ? 435 SER B N 1 ATOM 9854 C CA . SER B 2 454 ? -11.939 -3.298 6.594 1.00 76.05 ? 435 SER B CA 1 ATOM 9855 C C . SER B 2 454 ? -11.767 -2.139 5.611 1.00 88.59 ? 435 SER B C 1 ATOM 9856 O O . SER B 2 454 ? -12.745 -1.616 5.080 1.00 91.90 ? 435 SER B O 1 ATOM 9857 C CB . SER B 2 454 ? -12.305 -2.763 7.983 1.00 77.98 ? 435 SER B CB 1 ATOM 9858 O OG . SER B 2 454 ? -11.237 -2.028 8.558 1.00 73.96 ? 435 SER B OG 1 ATOM 9859 N N . ALA B 2 455 ? -10.522 -1.752 5.360 1.00 99.24 ? 436 ALA B N 1 ATOM 9860 C CA . ALA B 2 455 ? -10.244 -0.540 4.594 1.00 110.81 ? 436 ALA B CA 1 ATOM 9861 C C . ALA B 2 455 ? -10.292 -0.727 3.079 1.00 108.79 ? 436 ALA B C 1 ATOM 9862 O O . ALA B 2 455 ? -9.382 -0.299 2.369 1.00 114.44 ? 436 ALA B O 1 ATOM 9863 C CB . ALA B 2 455 ? -8.904 0.056 5.015 1.00 121.39 ? 436 ALA B CB 1 ATOM 9864 N N . SER B 2 456 ? -11.356 -1.357 2.590 1.00 103.68 ? 437 SER B N 1 ATOM 9865 C CA . SER B 2 456 ? -11.582 -1.480 1.152 1.00 108.59 ? 437 SER B CA 1 ATOM 9866 C C . SER B 2 456 ? -11.798 -0.091 0.552 1.00 100.30 ? 437 SER B C 1 ATOM 9867 O O . SER B 2 456 ? -12.459 0.745 1.168 1.00 100.30 ? 437 SER B O 1 ATOM 9868 C CB . SER B 2 456 ? -12.799 -2.372 0.888 1.00 115.25 ? 437 SER B CB 1 ATOM 9869 O OG . SER B 2 456 ? -13.139 -2.396 -0.488 1.00 117.23 ? 437 SER B OG 1 ATOM 9870 N N . ASP B 2 457 ? -11.252 0.168 -0.636 1.00 100.42 ? 438 ASP B N 1 ATOM 9871 C CA . ASP B 2 457 ? -10.489 -0.806 -1.416 1.00 102.99 ? 438 ASP B CA 1 ATOM 9872 C C . ASP B 2 457 ? -9.033 -0.375 -1.563 1.00 94.74 ? 438 ASP B C 1 ATOM 9873 O O . ASP B 2 457 ? -8.739 0.672 -2.138 1.00 92.87 ? 438 ASP B O 1 ATOM 9874 C CB . ASP B 2 457 ? -11.117 -0.981 -2.802 1.00 116.81 ? 438 ASP B CB 1 ATOM 9875 C CG . ASP B 2 457 ? -10.203 -1.711 -3.774 1.00 121.66 ? 438 ASP B CG 1 ATOM 9876 O OD1 . ASP B 2 457 ? -9.581 -2.718 -3.373 1.00 119.95 ? 438 ASP B OD1 1 ATOM 9877 O OD2 . ASP B 2 457 ? -10.108 -1.274 -4.941 1.00 121.57 ? 438 ASP B OD2 1 ATOM 9878 N N . LEU B 2 458 ? -8.124 -1.196 -1.050 1.00 86.32 ? 439 LEU B N 1 ATOM 9879 C CA . LEU B 2 458 ? -6.706 -0.869 -1.072 1.00 78.05 ? 439 LEU B CA 1 ATOM 9880 C C . LEU B 2 458 ? -5.908 -1.895 -1.855 1.00 77.74 ? 439 LEU B C 1 ATOM 9881 O O . LEU B 2 458 ? -6.015 -3.095 -1.605 1.00 87.21 ? 439 LEU B O 1 ATOM 9882 C CB . LEU B 2 458 ? -6.161 -0.790 0.353 1.00 77.20 ? 439 LEU B CB 1 ATOM 9883 C CG . LEU B 2 458 ? -6.266 0.547 1.083 1.00 71.22 ? 439 LEU B CG 1 ATOM 9884 C CD1 . LEU B 2 458 ? -6.138 0.331 2.578 1.00 69.24 ? 439 LEU B CD1 1 ATOM 9885 C CD2 . LEU B 2 458 ? -5.180 1.483 0.585 1.00 67.51 ? 439 LEU B CD2 1 ATOM 9886 N N . THR B 2 459 ? -5.121 -1.421 -2.816 1.00 72.77 ? 440 THR B N 1 ATOM 9887 C CA . THR B 2 459 ? -4.152 -2.270 -3.501 1.00 77.36 ? 440 THR B CA 1 ATOM 9888 C C . THR B 2 459 ? -2.847 -1.512 -3.686 1.00 77.21 ? 440 THR B C 1 ATOM 9889 O O . THR B 2 459 ? -2.752 -0.329 -3.370 1.00 73.36 ? 440 THR B O 1 ATOM 9890 C CB . THR B 2 459 ? -4.631 -2.728 -4.891 1.00 61.02 ? 440 THR B CB 1 ATOM 9891 O OG1 . THR B 2 459 ? -4.512 -1.642 -5.818 1.00 68.29 ? 440 THR B OG1 1 ATOM 9892 C CG2 . THR B 2 459 ? -6.070 -3.220 -4.848 1.00 63.72 ? 440 THR B CG2 1 ATOM 9893 N N . TRP B 2 460 ? -1.845 -2.202 -4.214 1.00 78.88 ? 441 TRP B N 1 ATOM 9894 C CA . TRP B 2 460 ? -0.541 -1.606 -4.451 1.00 77.51 ? 441 TRP B CA 1 ATOM 9895 C C . TRP B 2 460 ? -0.591 -0.610 -5.609 1.00 85.83 ? 441 TRP B C 1 ATOM 9896 O O . TRP B 2 460 ? 0.295 0.235 -5.752 1.00 95.51 ? 441 TRP B O 1 ATOM 9897 C CB . TRP B 2 460 ? 0.477 -2.710 -4.736 1.00 73.47 ? 441 TRP B CB 1 ATOM 9898 C CG . TRP B 2 460 ? 1.855 -2.228 -5.050 1.00 78.50 ? 441 TRP B CG 1 ATOM 9899 C CD1 . TRP B 2 460 ? 2.440 -2.173 -6.279 1.00 78.37 ? 441 TRP B CD1 1 ATOM 9900 C CD2 . TRP B 2 460 ? 2.830 -1.742 -4.119 1.00 87.22 ? 441 TRP B CD2 1 ATOM 9901 N NE1 . TRP B 2 460 ? 3.717 -1.679 -6.175 1.00 86.40 ? 441 TRP B NE1 1 ATOM 9902 C CE2 . TRP B 2 460 ? 3.981 -1.406 -4.859 1.00 90.32 ? 441 TRP B CE2 1 ATOM 9903 C CE3 . TRP B 2 460 ? 2.840 -1.554 -2.734 1.00 78.80 ? 441 TRP B CE3 1 ATOM 9904 C CZ2 . TRP B 2 460 ? 5.131 -0.896 -4.260 1.00 78.17 ? 441 TRP B CZ2 1 ATOM 9905 C CZ3 . TRP B 2 460 ? 3.983 -1.047 -2.143 1.00 74.03 ? 441 TRP B CZ3 1 ATOM 9906 C CH2 . TRP B 2 460 ? 5.112 -0.724 -2.905 1.00 72.17 ? 441 TRP B CH2 1 ATOM 9907 N N . ASP B 2 461 ? -1.635 -0.705 -6.426 1.00 84.42 ? 442 ASP B N 1 ATOM 9908 C CA . ASP B 2 461 ? -1.756 0.133 -7.618 1.00 94.21 ? 442 ASP B CA 1 ATOM 9909 C C . ASP B 2 461 ? -2.296 1.528 -7.306 1.00 101.13 ? 442 ASP B C 1 ATOM 9910 O O . ASP B 2 461 ? -1.648 2.532 -7.597 1.00 106.60 ? 442 ASP B O 1 ATOM 9911 C CB . ASP B 2 461 ? -2.631 -0.556 -8.667 1.00 97.69 ? 442 ASP B CB 1 ATOM 9912 C CG . ASP B 2 461 ? -2.118 -1.936 -9.035 1.00 99.56 ? 442 ASP B CG 1 ATOM 9913 O OD1 . ASP B 2 461 ? -0.884 -2.118 -9.092 1.00 93.28 ? 442 ASP B OD1 1 ATOM 9914 O OD2 . ASP B 2 461 ? -2.949 -2.841 -9.261 1.00 104.65 ? 442 ASP B OD2 1 ATOM 9915 N N . ASN B 2 462 ? -3.483 1.587 -6.712 1.00 105.00 ? 443 ASN B N 1 ATOM 9916 C CA . ASN B 2 462 ? -4.084 2.865 -6.354 1.00 112.36 ? 443 ASN B CA 1 ATOM 9917 C C . ASN B 2 462 ? -3.682 3.317 -4.951 1.00 109.91 ? 443 ASN B C 1 ATOM 9918 O O . ASN B 2 462 ? -4.516 3.763 -4.163 1.00 122.26 ? 443 ASN B O 1 ATOM 9919 C CB . ASN B 2 462 ? -5.607 2.799 -6.487 1.00 115.13 ? 443 ASN B CB 1 ATOM 9920 C CG . ASN B 2 462 ? -6.228 1.780 -5.558 1.00 109.83 ? 443 ASN B CG 1 ATOM 9921 O OD1 . ASN B 2 462 ? -5.549 0.882 -5.063 1.00 101.67 ? 443 ASN B OD1 1 ATOM 9922 N ND2 . ASN B 2 462 ? -7.526 1.916 -5.314 1.00 117.17 ? 443 ASN B ND2 1 ATOM 9923 N N . LEU B 2 463 ? -2.392 3.204 -4.651 1.00 92.91 ? 444 LEU B N 1 ATOM 9924 C CA . LEU B 2 463 ? -1.867 3.591 -3.347 1.00 88.48 ? 444 LEU B CA 1 ATOM 9925 C C . LEU B 2 463 ? -1.702 5.109 -3.270 1.00 95.22 ? 444 LEU B C 1 ATOM 9926 O O . LEU B 2 463 ? -1.663 5.690 -2.186 1.00 104.72 ? 444 LEU B O 1 ATOM 9927 C CB . LEU B 2 463 ? -0.531 2.887 -3.093 1.00 78.95 ? 444 LEU B CB 1 ATOM 9928 C CG . LEU B 2 463 ? -0.156 2.518 -1.654 1.00 86.56 ? 444 LEU B CG 1 ATOM 9929 C CD1 . LEU B 2 463 ? -1.308 1.811 -0.947 1.00 76.52 ? 444 LEU B CD1 1 ATOM 9930 C CD2 . LEU B 2 463 ? 1.101 1.647 -1.632 1.00 61.70 ? 444 LEU B CD2 1 ATOM 9931 N N . LYS B 2 464 ? -1.616 5.742 -4.436 1.00 85.56 ? 445 LYS B N 1 ATOM 9932 C CA . LYS B 2 464 ? -1.448 7.188 -4.537 1.00 93.04 ? 445 LYS B CA 1 ATOM 9933 C C . LYS B 2 464 ? -2.644 7.960 -3.982 1.00 97.64 ? 445 LYS B C 1 ATOM 9934 O O . LYS B 2 464 ? -3.776 7.788 -4.437 1.00 77.13 ? 445 LYS B O 1 ATOM 9935 C CB . LYS B 2 464 ? -1.219 7.578 -5.999 1.00 104.09 ? 445 LYS B CB 1 ATOM 9936 C CG . LYS B 2 464 ? -1.065 9.068 -6.242 1.00 105.44 ? 445 LYS B CG 1 ATOM 9937 C CD . LYS B 2 464 ? -0.843 9.353 -7.717 1.00 98.48 ? 445 LYS B CD 1 ATOM 9938 C CE . LYS B 2 464 ? -0.603 10.830 -7.962 1.00 100.18 ? 445 LYS B CE 1 ATOM 9939 N NZ . LYS B 2 464 ? -0.306 11.104 -9.394 1.00 109.50 ? 445 LYS B NZ 1 ATOM 9940 N N . GLY B 2 465 ? -2.384 8.820 -3.003 1.00 97.46 ? 446 GLY B N 1 ATOM 9941 C CA . GLY B 2 465 ? -3.430 9.628 -2.406 1.00 93.03 ? 446 GLY B CA 1 ATOM 9942 C C . GLY B 2 465 ? -3.930 9.064 -1.090 1.00 90.05 ? 446 GLY B C 1 ATOM 9943 O O . GLY B 2 465 ? -4.877 9.587 -0.498 1.00 80.99 ? 446 GLY B O 1 ATOM 9944 N N . LYS B 2 466 ? -3.292 7.990 -0.633 1.00 80.86 ? 447 LYS B N 1 ATOM 9945 C CA . LYS B 2 466 ? -3.627 7.382 0.650 1.00 81.05 ? 447 LYS B CA 1 ATOM 9946 C C . LYS B 2 466 ? -2.619 7.829 1.707 1.00 83.93 ? 447 LYS B C 1 ATOM 9947 O O . LYS B 2 466 ? -1.555 8.340 1.367 1.00 89.53 ? 447 LYS B O 1 ATOM 9948 C CB . LYS B 2 466 ? -3.637 5.859 0.526 1.00 82.92 ? 447 LYS B CB 1 ATOM 9949 C CG . LYS B 2 466 ? -4.466 5.331 -0.643 1.00 77.56 ? 447 LYS B CG 1 ATOM 9950 C CD . LYS B 2 466 ? -5.917 5.786 -0.550 1.00 81.56 ? 447 LYS B CD 1 ATOM 9951 C CE . LYS B 2 466 ? -6.797 5.104 -1.593 1.00 80.58 ? 447 LYS B CE 1 ATOM 9952 N NZ . LYS B 2 466 ? -6.350 5.363 -2.993 1.00 82.70 ? 447 LYS B NZ 1 ATOM 9953 N N . LYS B 2 467 ? -2.952 7.646 2.983 1.00 85.83 ? 448 LYS B N 1 ATOM 9954 C CA . LYS B 2 467 ? -2.070 8.080 4.073 1.00 89.49 ? 448 LYS B CA 1 ATOM 9955 C C . LYS B 2 467 ? -1.175 6.944 4.594 1.00 88.49 ? 448 LYS B C 1 ATOM 9956 O O . LYS B 2 467 ? -1.666 5.919 5.075 1.00 84.81 ? 448 LYS B O 1 ATOM 9957 C CB . LYS B 2 467 ? -2.880 8.709 5.215 1.00 81.44 ? 448 LYS B CB 1 ATOM 9958 N N . SER B 2 468 ? 0.138 7.145 4.510 1.00 79.24 ? 449 SER B N 1 ATOM 9959 C CA . SER B 2 468 ? 1.100 6.067 4.746 1.00 79.91 ? 449 SER B CA 1 ATOM 9960 C C . SER B 2 468 ? 1.736 6.068 6.134 1.00 77.11 ? 449 SER B C 1 ATOM 9961 O O . SER B 2 468 ? 1.855 7.105 6.776 1.00 78.80 ? 449 SER B O 1 ATOM 9962 C CB . SER B 2 468 ? 2.199 6.102 3.682 1.00 82.45 ? 449 SER B CB 1 ATOM 9963 O OG . SER B 2 468 ? 2.941 7.309 3.746 1.00 78.96 ? 449 SER B OG 1 ATOM 9964 N N . CYS B 2 469 ? 2.155 4.890 6.582 1.00 82.83 ? 450 CYS B N 1 ATOM 9965 C CA . CYS B 2 469 ? 2.827 4.744 7.868 1.00 76.51 ? 450 CYS B CA 1 ATOM 9966 C C . CYS B 2 469 ? 4.187 4.077 7.702 1.00 79.88 ? 450 CYS B C 1 ATOM 9967 O O . CYS B 2 469 ? 4.272 2.900 7.350 1.00 80.24 ? 450 CYS B O 1 ATOM 9968 C CB . CYS B 2 469 ? 1.965 3.936 8.837 1.00 63.53 ? 450 CYS B CB 1 ATOM 9969 S SG . CYS B 2 469 ? 0.529 4.828 9.455 1.00 92.19 ? 450 CYS B SG 1 ATOM 9970 N N . HIS B 2 470 ? 5.249 4.834 7.956 1.00 83.96 ? 451 HIS B N 1 ATOM 9971 C CA . HIS B 2 470 ? 6.602 4.308 7.840 1.00 77.45 ? 451 HIS B CA 1 ATOM 9972 C C . HIS B 2 470 ? 7.271 4.297 9.206 1.00 71.26 ? 451 HIS B C 1 ATOM 9973 O O . HIS B 2 470 ? 6.943 5.113 10.069 1.00 60.25 ? 451 HIS B O 1 ATOM 9974 C CB . HIS B 2 470 ? 7.429 5.157 6.875 1.00 76.09 ? 451 HIS B CB 1 ATOM 9975 C CG . HIS B 2 470 ? 6.691 5.565 5.639 1.00 72.35 ? 451 HIS B CG 1 ATOM 9976 N ND1 . HIS B 2 470 ? 6.924 4.990 4.409 1.00 75.09 ? 451 HIS B ND1 1 ATOM 9977 C CD2 . HIS B 2 470 ? 5.731 6.499 5.441 1.00 69.90 ? 451 HIS B CD2 1 ATOM 9978 C CE1 . HIS B 2 470 ? 6.138 5.550 3.508 1.00 77.98 ? 451 HIS B CE1 1 ATOM 9979 N NE2 . HIS B 2 470 ? 5.404 6.469 4.108 1.00 72.27 ? 451 HIS B NE2 1 ATOM 9980 N N . THR B 2 471 ? 8.201 3.364 9.396 1.00 74.41 ? 452 THR B N 1 ATOM 9981 C CA . THR B 2 471 ? 8.976 3.284 10.629 1.00 75.54 ? 452 THR B CA 1 ATOM 9982 C C . THR B 2 471 ? 9.787 4.560 10.807 1.00 90.10 ? 452 THR B C 1 ATOM 9983 O O . THR B 2 471 ? 9.573 5.317 11.751 1.00 102.55 ? 452 THR B O 1 ATOM 9984 C CB . THR B 2 471 ? 9.935 2.082 10.614 1.00 75.61 ? 452 THR B CB 1 ATOM 9985 O OG1 . THR B 2 471 ? 10.775 2.152 9.456 1.00 67.76 ? 452 THR B OG1 1 ATOM 9986 C CG2 . THR B 2 471 ? 9.155 0.781 10.582 1.00 86.20 ? 452 THR B CG2 1 ATOM 9987 N N . ALA B 2 472 ? 10.715 4.787 9.883 1.00 94.55 ? 453 ALA B N 1 ATOM 9988 C CA . ALA B 2 472 ? 11.502 6.013 9.845 1.00 107.55 ? 453 ALA B CA 1 ATOM 9989 C C . ALA B 2 472 ? 12.149 6.145 8.472 1.00 104.63 ? 453 ALA B C 1 ATOM 9990 O O . ALA B 2 472 ? 12.445 5.141 7.822 1.00 104.52 ? 453 ALA B O 1 ATOM 9991 C CB . ALA B 2 472 ? 12.561 6.005 10.933 1.00 118.98 ? 453 ALA B CB 1 ATOM 9992 N N . VAL B 2 473 ? 12.364 7.378 8.028 1.00 95.98 ? 454 VAL B N 1 ATOM 9993 C CA . VAL B 2 473 ? 12.939 7.603 6.708 1.00 92.65 ? 454 VAL B CA 1 ATOM 9994 C C . VAL B 2 473 ? 14.410 7.205 6.677 1.00 95.73 ? 454 VAL B C 1 ATOM 9995 O O . VAL B 2 473 ? 15.197 7.633 7.518 1.00 110.88 ? 454 VAL B O 1 ATOM 9996 C CB . VAL B 2 473 ? 12.768 9.065 6.251 1.00 95.43 ? 454 VAL B CB 1 ATOM 9997 C CG1 . VAL B 2 473 ? 13.074 10.017 7.386 1.00 100.98 ? 454 VAL B CG1 1 ATOM 9998 C CG2 . VAL B 2 473 ? 13.643 9.354 5.040 1.00 97.09 ? 454 VAL B CG2 1 ATOM 9999 N N . GLY B 2 474 ? 14.769 6.370 5.708 1.00 83.93 ? 455 GLY B N 1 ATOM 10000 C CA . GLY B 2 474 ? 16.132 5.886 5.586 1.00 84.36 ? 455 GLY B CA 1 ATOM 10001 C C . GLY B 2 474 ? 16.276 4.439 6.020 1.00 94.97 ? 455 GLY B C 1 ATOM 10002 O O . GLY B 2 474 ? 17.248 3.770 5.666 1.00 97.00 ? 455 GLY B O 1 ATOM 10003 N N . ARG B 2 475 ? 15.306 3.953 6.788 1.00 95.46 ? 456 ARG B N 1 ATOM 10004 C CA . ARG B 2 475 ? 15.333 2.576 7.270 1.00 91.41 ? 456 ARG B CA 1 ATOM 10005 C C . ARG B 2 475 ? 14.954 1.579 6.175 1.00 89.27 ? 456 ARG B C 1 ATOM 10006 O O . ARG B 2 475 ? 14.219 1.915 5.246 1.00 80.86 ? 456 ARG B O 1 ATOM 10007 C CB . ARG B 2 475 ? 14.435 2.413 8.502 1.00 94.96 ? 456 ARG B CB 1 ATOM 10008 C CG . ARG B 2 475 ? 15.039 2.988 9.779 1.00 100.99 ? 456 ARG B CG 1 ATOM 10009 C CD . ARG B 2 475 ? 14.136 2.795 10.991 1.00 103.82 ? 456 ARG B CD 1 ATOM 10010 N NE . ARG B 2 475 ? 13.913 1.389 11.316 1.00 106.14 ? 456 ARG B NE 1 ATOM 10011 C CZ . ARG B 2 475 ? 13.362 0.965 12.449 1.00 107.93 ? 456 ARG B CZ 1 ATOM 10012 N NH1 . ARG B 2 475 ? 12.982 1.837 13.373 1.00 103.32 ? 456 ARG B NH1 1 ATOM 10013 N NH2 . ARG B 2 475 ? 13.195 -0.332 12.664 1.00 111.57 ? 456 ARG B NH2 1 ATOM 10014 N N . THR B 2 476 ? 15.465 0.355 6.306 1.00 85.22 ? 457 THR B N 1 ATOM 10015 C CA . THR B 2 476 ? 15.323 -0.691 5.292 1.00 85.17 ? 457 THR B CA 1 ATOM 10016 C C . THR B 2 476 ? 13.886 -0.956 4.848 1.00 85.98 ? 457 THR B C 1 ATOM 10017 O O . THR B 2 476 ? 13.477 -0.547 3.763 1.00 87.12 ? 457 THR B O 1 ATOM 10018 C CB . THR B 2 476 ? 15.914 -2.028 5.785 1.00 88.20 ? 457 THR B CB 1 ATOM 10019 O OG1 . THR B 2 476 ? 17.220 -1.811 6.335 1.00 101.52 ? 457 THR B OG1 1 ATOM 10020 C CG2 . THR B 2 476 ? 15.998 -3.031 4.642 1.00 71.38 ? 457 THR B CG2 1 ATOM 10021 N N . ALA B 2 477 ? 13.128 -1.655 5.687 1.00 84.62 ? 458 ALA B N 1 ATOM 10022 C CA . ALA B 2 477 ? 11.785 -2.094 5.320 1.00 75.10 ? 458 ALA B CA 1 ATOM 10023 C C . ALA B 2 477 ? 10.776 -0.952 5.306 1.00 75.40 ? 458 ALA B C 1 ATOM 10024 O O . ALA B 2 477 ? 9.827 -0.963 4.523 1.00 75.65 ? 458 ALA B O 1 ATOM 10025 C CB . ALA B 2 477 ? 11.315 -3.205 6.255 1.00 59.45 ? 458 ALA B CB 1 ATOM 10026 N N . GLY B 2 478 ? 10.984 0.033 6.172 1.00 67.84 ? 459 GLY B N 1 ATOM 10027 C CA . GLY B 2 478 ? 10.025 1.109 6.334 1.00 71.21 ? 459 GLY B CA 1 ATOM 10028 C C . GLY B 2 478 ? 10.094 2.201 5.282 1.00 80.17 ? 459 GLY B C 1 ATOM 10029 O O . GLY B 2 478 ? 9.159 2.990 5.146 1.00 83.61 ? 459 GLY B O 1 ATOM 10030 N N . TRP B 2 479 ? 11.192 2.256 4.536 1.00 75.54 ? 460 TRP B N 1 ATOM 10031 C CA . TRP B 2 479 ? 11.379 3.341 3.579 1.00 70.22 ? 460 TRP B CA 1 ATOM 10032 C C . TRP B 2 479 ? 12.076 2.919 2.286 1.00 76.16 ? 460 TRP B C 1 ATOM 10033 O O . TRP B 2 479 ? 11.500 3.037 1.204 1.00 76.00 ? 460 TRP B O 1 ATOM 10034 C CB . TRP B 2 479 ? 12.138 4.500 4.230 1.00 68.42 ? 460 TRP B CB 1 ATOM 10035 C CG . TRP B 2 479 ? 12.212 5.731 3.373 1.00 82.13 ? 460 TRP B CG 1 ATOM 10036 C CD1 . TRP B 2 479 ? 13.207 6.065 2.498 1.00 78.40 ? 460 TRP B CD1 1 ATOM 10037 C CD2 . TRP B 2 479 ? 11.248 6.791 3.308 1.00 82.31 ? 460 TRP B CD2 1 ATOM 10038 N NE1 . TRP B 2 479 ? 12.921 7.268 1.894 1.00 72.16 ? 460 TRP B NE1 1 ATOM 10039 C CE2 . TRP B 2 479 ? 11.725 7.734 2.374 1.00 78.30 ? 460 TRP B CE2 1 ATOM 10040 C CE3 . TRP B 2 479 ? 10.027 7.034 3.948 1.00 75.53 ? 460 TRP B CE3 1 ATOM 10041 C CZ2 . TRP B 2 479 ? 11.026 8.899 2.066 1.00 84.78 ? 460 TRP B CZ2 1 ATOM 10042 C CZ3 . TRP B 2 479 ? 9.335 8.191 3.642 1.00 80.39 ? 460 TRP B CZ3 1 ATOM 10043 C CH2 . TRP B 2 479 ? 9.837 9.109 2.710 1.00 85.46 ? 460 TRP B CH2 1 ATOM 10044 N N . ASN B 2 480 ? 13.310 2.433 2.400 1.00 74.97 ? 461 ASN B N 1 ATOM 10045 C CA . ASN B 2 480 ? 14.131 2.141 1.223 1.00 73.63 ? 461 ASN B CA 1 ATOM 10046 C C . ASN B 2 480 ? 13.469 1.202 0.225 1.00 73.81 ? 461 ASN B C 1 ATOM 10047 O O . ASN B 2 480 ? 13.374 1.517 -0.958 1.00 88.52 ? 461 ASN B O 1 ATOM 10048 C CB . ASN B 2 480 ? 15.505 1.596 1.624 1.00 80.23 ? 461 ASN B CB 1 ATOM 10049 C CG . ASN B 2 480 ? 16.348 2.620 2.362 1.00 96.31 ? 461 ASN B CG 1 ATOM 10050 O OD1 . ASN B 2 480 ? 16.214 3.827 2.150 1.00 90.46 ? 461 ASN B OD1 1 ATOM 10051 N ND2 . ASN B 2 480 ? 17.227 2.140 3.236 1.00 110.27 ? 461 ASN B ND2 1 ATOM 10052 N N . ILE B 2 481 ? 13.005 0.056 0.706 1.00 65.37 ? 462 ILE B N 1 ATOM 10053 C CA . ILE B 2 481 ? 12.348 -0.917 -0.160 1.00 54.51 ? 462 ILE B CA 1 ATOM 10054 C C . ILE B 2 481 ? 11.014 -0.431 -0.756 1.00 69.31 ? 462 ILE B C 1 ATOM 10055 O O . ILE B 2 481 ? 10.832 -0.500 -1.973 1.00 86.26 ? 462 ILE B O 1 ATOM 10056 C CB . ILE B 2 481 ? 12.170 -2.288 0.532 1.00 58.16 ? 462 ILE B CB 1 ATOM 10057 C CG1 . ILE B 2 481 ? 13.520 -2.840 0.989 1.00 56.73 ? 462 ILE B CG1 1 ATOM 10058 C CG2 . ILE B 2 481 ? 11.497 -3.264 -0.407 1.00 72.49 ? 462 ILE B CG2 1 ATOM 10059 C CD1 . ILE B 2 481 ? 13.428 -4.217 1.595 1.00 56.59 ? 462 ILE B CD1 1 ATOM 10060 N N . PRO B 2 482 ? 10.080 0.069 0.082 1.00 67.26 ? 463 PRO B N 1 ATOM 10061 C CA . PRO B 2 482 ? 8.800 0.480 -0.514 1.00 72.22 ? 463 PRO B CA 1 ATOM 10062 C C . PRO B 2 482 ? 8.924 1.674 -1.460 1.00 70.96 ? 463 PRO B C 1 ATOM 10063 O O . PRO B 2 482 ? 8.390 1.626 -2.574 1.00 74.32 ? 463 PRO B O 1 ATOM 10064 C CB . PRO B 2 482 ? 7.943 0.846 0.705 1.00 70.45 ? 463 PRO B CB 1 ATOM 10065 C CG . PRO B 2 482 ? 8.910 1.152 1.775 1.00 72.10 ? 463 PRO B CG 1 ATOM 10066 C CD . PRO B 2 482 ? 10.062 0.223 1.547 1.00 68.25 ? 463 PRO B CD 1 ATOM 10067 N N . MET B 2 483 ? 9.617 2.726 -1.034 1.00 78.41 ? 464 MET B N 1 ATOM 10068 C CA . MET B 2 483 ? 9.871 3.860 -1.917 1.00 80.32 ? 464 MET B CA 1 ATOM 10069 C C . MET B 2 483 ? 10.755 3.466 -3.084 1.00 82.26 ? 464 MET B C 1 ATOM 10070 O O . MET B 2 483 ? 10.737 4.150 -4.114 1.00 91.90 ? 464 MET B O 1 ATOM 10071 C CB . MET B 2 483 ? 10.504 5.036 -1.153 1.00 77.32 ? 464 MET B CB 1 ATOM 10072 C CG . MET B 2 483 ? 9.645 5.599 -0.063 1.00 75.70 ? 464 MET B CG 1 ATOM 10073 S SD . MET B 2 483 ? 7.926 5.747 -0.575 1.00 90.60 ? 464 MET B SD 1 ATOM 10074 C CE . MET B 2 483 ? 7.165 4.452 0.394 1.00 81.59 ? 464 MET B CE 1 ATOM 10075 N N . GLY B 2 484 ? 11.521 2.379 -2.929 1.00 82.82 ? 465 GLY B N 1 ATOM 10076 C CA . GLY B 2 484 ? 12.324 1.846 -4.028 1.00 88.37 ? 465 GLY B CA 1 ATOM 10077 C C . GLY B 2 484 ? 11.508 1.245 -5.158 1.00 91.31 ? 465 GLY B C 1 ATOM 10078 O O . GLY B 2 484 ? 11.798 1.464 -6.344 1.00 78.06 ? 465 GLY B O 1 ATOM 10079 N N . LEU B 2 485 ? 10.446 0.539 -4.781 1.00 92.32 ? 466 LEU B N 1 ATOM 10080 C CA . LEU B 2 485 ? 9.511 -0.021 -5.750 1.00 91.10 ? 466 LEU B CA 1 ATOM 10081 C C . LEU B 2 485 ? 8.639 1.074 -6.355 1.00 99.99 ? 466 LEU B C 1 ATOM 10082 O O . LEU B 2 485 ? 8.144 0.937 -7.475 1.00 104.61 ? 466 LEU B O 1 ATOM 10083 C CB . LEU B 2 485 ? 8.642 -1.120 -5.115 1.00 78.06 ? 466 LEU B CB 1 ATOM 10084 C CG . LEU B 2 485 ? 9.271 -2.499 -4.882 1.00 75.11 ? 466 LEU B CG 1 ATOM 10085 C CD1 . LEU B 2 485 ? 10.644 -2.573 -5.528 1.00 72.78 ? 466 LEU B CD1 1 ATOM 10086 C CD2 . LEU B 2 485 ? 9.345 -2.891 -3.403 1.00 69.66 ? 466 LEU B CD2 1 ATOM 10087 N N . LEU B 2 486 ? 8.482 2.171 -5.623 1.00 99.05 ? 467 LEU B N 1 ATOM 10088 C CA . LEU B 2 486 ? 7.658 3.291 -6.069 1.00 106.06 ? 467 LEU B CA 1 ATOM 10089 C C . LEU B 2 486 ? 8.448 4.324 -6.869 1.00 111.03 ? 467 LEU B C 1 ATOM 10090 O O . LEU B 2 486 ? 7.860 5.203 -7.490 1.00 116.90 ? 467 LEU B O 1 ATOM 10091 C CB . LEU B 2 486 ? 6.984 3.968 -4.869 1.00 111.83 ? 467 LEU B CB 1 ATOM 10092 C CG . LEU B 2 486 ? 5.910 3.143 -4.155 1.00 117.51 ? 467 LEU B CG 1 ATOM 10093 C CD1 . LEU B 2 486 ? 5.181 4.013 -3.145 1.00 121.39 ? 467 LEU B CD1 1 ATOM 10094 C CD2 . LEU B 2 486 ? 4.935 2.532 -5.153 1.00 119.10 ? 467 LEU B CD2 1 ATOM 10095 N N . TYR B 2 487 ? 9.774 4.224 -6.865 1.00 112.27 ? 468 TYR B N 1 ATOM 10096 C CA . TYR B 2 487 ? 10.587 5.137 -7.668 1.00 115.80 ? 468 TYR B CA 1 ATOM 10097 C C . TYR B 2 487 ? 10.468 4.777 -9.146 1.00 125.42 ? 468 TYR B C 1 ATOM 10098 O O . TYR B 2 487 ? 10.681 5.615 -10.024 1.00 135.47 ? 468 TYR B O 1 ATOM 10099 C CB . TYR B 2 487 ? 12.051 5.114 -7.226 1.00 119.46 ? 468 TYR B CB 1 ATOM 10100 C CG . TYR B 2 487 ? 12.873 6.255 -7.783 1.00 127.80 ? 468 TYR B CG 1 ATOM 10101 C CD1 . TYR B 2 487 ? 12.937 7.476 -7.124 1.00 132.18 ? 468 TYR B CD1 1 ATOM 10102 C CD2 . TYR B 2 487 ? 13.586 6.111 -8.966 1.00 134.84 ? 468 TYR B CD2 1 ATOM 10103 C CE1 . TYR B 2 487 ? 13.686 8.522 -7.630 1.00 138.79 ? 468 TYR B CE1 1 ATOM 10104 C CE2 . TYR B 2 487 ? 14.337 7.151 -9.479 1.00 141.57 ? 468 TYR B CE2 1 ATOM 10105 C CZ . TYR B 2 487 ? 14.384 8.354 -8.807 1.00 140.19 ? 468 TYR B CZ 1 ATOM 10106 O OH . TYR B 2 487 ? 15.133 9.392 -9.314 1.00 135.62 ? 468 TYR B OH 1 ATOM 10107 N N . ASN B 2 488 ? 10.116 3.522 -9.413 1.00 128.25 ? 469 ASN B N 1 ATOM 10108 C CA . ASN B 2 488 ? 9.878 3.065 -10.778 1.00 130.73 ? 469 ASN B CA 1 ATOM 10109 C C . ASN B 2 488 ? 8.463 3.366 -11.256 1.00 137.06 ? 469 ASN B C 1 ATOM 10110 O O . ASN B 2 488 ? 7.982 2.769 -12.218 1.00 136.25 ? 469 ASN B O 1 ATOM 10111 C CB . ASN B 2 488 ? 10.163 1.571 -10.909 1.00 121.42 ? 469 ASN B CB 1 ATOM 10112 C CG . ASN B 2 488 ? 11.627 1.245 -10.739 1.00 127.89 ? 469 ASN B CG 1 ATOM 10113 O OD1 . ASN B 2 488 ? 12.424 1.409 -11.663 1.00 129.86 ? 469 ASN B OD1 1 ATOM 10114 N ND2 . ASN B 2 488 ? 11.991 0.776 -9.552 1.00 132.58 ? 469 ASN B ND2 1 ATOM 10115 N N . LYS B 2 489 ? 7.801 4.289 -10.568 1.00 140.50 ? 470 LYS B N 1 ATOM 10116 C CA . LYS B 2 489 ? 6.475 4.742 -10.958 1.00 140.65 ? 470 LYS B CA 1 ATOM 10117 C C . LYS B 2 489 ? 6.541 6.230 -11.246 1.00 134.33 ? 470 LYS B C 1 ATOM 10118 O O . LYS B 2 489 ? 6.115 6.689 -12.303 1.00 147.28 ? 470 LYS B O 1 ATOM 10119 C CB . LYS B 2 489 ? 5.467 4.490 -9.837 1.00 146.99 ? 470 LYS B CB 1 ATOM 10120 C CG . LYS B 2 489 ? 5.308 3.033 -9.432 1.00 142.60 ? 470 LYS B CG 1 ATOM 10121 C CD . LYS B 2 489 ? 4.531 2.242 -10.467 1.00 132.15 ? 470 LYS B CD 1 ATOM 10122 C CE . LYS B 2 489 ? 3.976 0.966 -9.861 1.00 122.94 ? 470 LYS B CE 1 ATOM 10123 N NZ . LYS B 2 489 ? 3.060 1.261 -8.721 1.00 116.02 ? 470 LYS B NZ 1 ATOM 10124 N N . ILE B 2 490 ? 7.083 6.978 -10.293 1.00 124.57 ? 471 ILE B N 1 ATOM 10125 C CA . ILE B 2 490 ? 7.203 8.424 -10.428 1.00 135.38 ? 471 ILE B CA 1 ATOM 10126 C C . ILE B 2 490 ? 8.622 8.906 -10.107 1.00 146.46 ? 471 ILE B C 1 ATOM 10127 O O . ILE B 2 490 ? 9.012 9.008 -8.943 1.00 148.36 ? 471 ILE B O 1 ATOM 10128 C CB . ILE B 2 490 ? 6.154 9.156 -9.567 1.00 128.48 ? 471 ILE B CB 1 ATOM 10129 C CG1 . ILE B 2 490 ? 5.664 8.257 -8.429 1.00 115.37 ? 471 ILE B CG1 1 ATOM 10130 C CG2 . ILE B 2 490 ? 4.970 9.585 -10.421 1.00 129.74 ? 471 ILE B CG2 1 ATOM 10131 C CD1 . ILE B 2 490 ? 6.499 8.337 -7.169 1.00 106.73 ? 471 ILE B CD1 1 ATOM 10132 N N . ASN B 2 491 ? 9.382 9.205 -11.157 1.00 148.91 ? 472 ASN B N 1 ATOM 10133 C CA . ASN B 2 491 ? 10.811 9.498 -11.044 1.00 147.42 ? 472 ASN B CA 1 ATOM 10134 C C . ASN B 2 491 ? 11.149 10.795 -10.313 1.00 146.73 ? 472 ASN B C 1 ATOM 10135 O O . ASN B 2 491 ? 11.654 11.740 -10.920 1.00 140.57 ? 472 ASN B O 1 ATOM 10136 C CB . ASN B 2 491 ? 11.453 9.526 -12.435 1.00 146.91 ? 472 ASN B CB 1 ATOM 10137 C CG . ASN B 2 491 ? 11.075 8.325 -13.278 1.00 141.93 ? 472 ASN B CG 1 ATOM 10138 O OD1 . ASN B 2 491 ? 10.241 7.511 -12.881 1.00 142.94 ? 472 ASN B OD1 1 ATOM 10139 N ND2 . ASN B 2 491 ? 11.680 8.214 -14.457 1.00 138.23 ? 472 ASN B ND2 1 ATOM 10140 N N . HIS B 2 492 ? 10.883 10.832 -9.011 1.00 149.04 ? 473 HIS B N 1 ATOM 10141 C CA . HIS B 2 492 ? 11.241 11.986 -8.193 1.00 149.13 ? 473 HIS B CA 1 ATOM 10142 C C . HIS B 2 492 ? 11.203 11.665 -6.702 1.00 140.10 ? 473 HIS B C 1 ATOM 10143 O O . HIS B 2 492 ? 10.383 10.868 -6.245 1.00 131.89 ? 473 HIS B O 1 ATOM 10144 C CB . HIS B 2 492 ? 10.340 13.184 -8.509 1.00 154.53 ? 473 HIS B CB 1 ATOM 10145 C CG . HIS B 2 492 ? 8.878 12.864 -8.500 1.00 157.05 ? 473 HIS B CG 1 ATOM 10146 N ND1 . HIS B 2 492 ? 8.045 13.214 -7.458 1.00 157.26 ? 473 HIS B ND1 1 ATOM 10147 C CD2 . HIS B 2 492 ? 8.098 12.230 -9.406 1.00 156.78 ? 473 HIS B CD2 1 ATOM 10148 C CE1 . HIS B 2 492 ? 6.817 12.810 -7.723 1.00 155.82 ? 473 HIS B CE1 1 ATOM 10149 N NE2 . HIS B 2 492 ? 6.821 12.211 -8.901 1.00 156.57 ? 473 HIS B NE2 1 ATOM 10150 N N . CYS B 2 493 ? 12.099 12.298 -5.952 1.00 136.52 ? 474 CYS B N 1 ATOM 10151 C CA . CYS B 2 493 ? 12.188 12.094 -4.513 1.00 131.06 ? 474 CYS B CA 1 ATOM 10152 C C . CYS B 2 493 ? 11.189 12.978 -3.776 1.00 134.09 ? 474 CYS B C 1 ATOM 10153 O O . CYS B 2 493 ? 11.515 13.586 -2.755 1.00 136.46 ? 474 CYS B O 1 ATOM 10154 C CB . CYS B 2 493 ? 13.604 12.402 -4.029 1.00 131.19 ? 474 CYS B CB 1 ATOM 10155 S SG . CYS B 2 493 ? 14.907 11.701 -5.064 1.00 170.18 ? 474 CYS B SG 1 ATOM 10156 N N . ARG B 2 494 ? 9.972 13.053 -4.303 1.00 134.76 ? 475 ARG B N 1 ATOM 10157 C CA . ARG B 2 494 ? 8.924 13.863 -3.699 1.00 126.49 ? 475 ARG B CA 1 ATOM 10158 C C . ARG B 2 494 ? 7.794 12.971 -3.211 1.00 115.62 ? 475 ARG B C 1 ATOM 10159 O O . ARG B 2 494 ? 6.624 13.208 -3.513 1.00 110.78 ? 475 ARG B O 1 ATOM 10160 C CB . ARG B 2 494 ? 8.396 14.897 -4.694 1.00 119.71 ? 475 ARG B CB 1 ATOM 10161 N N . PHE B 2 495 ? 8.157 11.946 -2.445 1.00 103.93 ? 476 PHE B N 1 ATOM 10162 C CA . PHE B 2 495 ? 7.190 11.011 -1.883 1.00 103.10 ? 476 PHE B CA 1 ATOM 10163 C C . PHE B 2 495 ? 6.166 11.741 -1.021 1.00 119.84 ? 476 PHE B C 1 ATOM 10164 O O . PHE B 2 495 ? 5.080 11.226 -0.753 1.00 123.98 ? 476 PHE B O 1 ATOM 10165 C CB . PHE B 2 495 ? 7.912 9.938 -1.070 1.00 102.12 ? 476 PHE B CB 1 ATOM 10166 C CG . PHE B 2 495 ? 9.075 9.321 -1.791 1.00 108.90 ? 476 PHE B CG 1 ATOM 10167 C CD1 . PHE B 2 495 ? 8.871 8.362 -2.771 1.00 105.24 ? 476 PHE B CD1 1 ATOM 10168 C CD2 . PHE B 2 495 ? 10.374 9.707 -1.497 1.00 112.55 ? 476 PHE B CD2 1 ATOM 10169 C CE1 . PHE B 2 495 ? 9.940 7.794 -3.442 1.00 103.42 ? 476 PHE B CE1 1 ATOM 10170 C CE2 . PHE B 2 495 ? 11.448 9.143 -2.164 1.00 108.95 ? 476 PHE B CE2 1 ATOM 10171 C CZ . PHE B 2 495 ? 11.230 8.185 -3.138 1.00 105.88 ? 476 PHE B CZ 1 ATOM 10172 N N . ASP B 2 496 ? 6.526 12.948 -0.594 1.00 127.60 ? 477 ASP B N 1 ATOM 10173 C CA . ASP B 2 496 ? 5.609 13.837 0.098 1.00 128.21 ? 477 ASP B CA 1 ATOM 10174 C C . ASP B 2 496 ? 4.364 14.098 -0.744 1.00 125.10 ? 477 ASP B C 1 ATOM 10175 O O . ASP B 2 496 ? 3.258 14.188 -0.212 1.00 128.29 ? 477 ASP B O 1 ATOM 10176 C CB . ASP B 2 496 ? 6.314 15.155 0.438 1.00 140.04 ? 477 ASP B CB 1 ATOM 10177 C CG . ASP B 2 496 ? 5.471 16.376 0.109 1.00 152.06 ? 477 ASP B CG 1 ATOM 10178 O OD1 . ASP B 2 496 ? 4.702 16.828 0.985 1.00 149.47 ? 477 ASP B OD1 1 ATOM 10179 O OD2 . ASP B 2 496 ? 5.583 16.889 -1.025 1.00 158.66 ? 477 ASP B OD2 1 ATOM 10180 N N . GLU B 2 497 ? 4.542 14.204 -2.059 1.00 126.39 ? 478 GLU B N 1 ATOM 10181 C CA . GLU B 2 497 ? 3.430 14.535 -2.950 1.00 126.63 ? 478 GLU B CA 1 ATOM 10182 C C . GLU B 2 497 ? 2.845 13.319 -3.674 1.00 108.69 ? 478 GLU B C 1 ATOM 10183 O O . GLU B 2 497 ? 2.027 13.462 -4.587 1.00 94.25 ? 478 GLU B O 1 ATOM 10184 C CB . GLU B 2 497 ? 3.828 15.631 -3.950 1.00 135.06 ? 478 GLU B CB 1 ATOM 10185 C CG . GLU B 2 497 ? 4.740 15.175 -5.080 1.00 135.69 ? 478 GLU B CG 1 ATOM 10186 C CD . GLU B 2 497 ? 5.301 16.337 -5.883 1.00 131.19 ? 478 GLU B CD 1 ATOM 10187 O OE1 . GLU B 2 497 ? 5.431 17.441 -5.313 1.00 125.43 ? 478 GLU B OE1 1 ATOM 10188 O OE2 . GLU B 2 497 ? 5.608 16.147 -7.081 1.00 124.55 ? 478 GLU B OE2 1 ATOM 10189 N N . PHE B 2 498 ? 3.257 12.124 -3.263 1.00 105.22 ? 479 PHE B N 1 ATOM 10190 C CA . PHE B 2 498 ? 2.652 10.904 -3.789 1.00 106.60 ? 479 PHE B CA 1 ATOM 10191 C C . PHE B 2 498 ? 1.508 10.439 -2.895 1.00 101.71 ? 479 PHE B C 1 ATOM 10192 O O . PHE B 2 498 ? 0.386 10.226 -3.357 1.00 94.96 ? 479 PHE B O 1 ATOM 10193 C CB . PHE B 2 498 ? 3.682 9.785 -3.940 1.00 97.93 ? 479 PHE B CB 1 ATOM 10194 C CG . PHE B 2 498 ? 3.101 8.511 -4.480 1.00 93.71 ? 479 PHE B CG 1 ATOM 10195 C CD1 . PHE B 2 498 ? 2.837 7.442 -3.640 1.00 85.40 ? 479 PHE B CD1 1 ATOM 10196 C CD2 . PHE B 2 498 ? 2.792 8.393 -5.826 1.00 93.51 ? 479 PHE B CD2 1 ATOM 10197 C CE1 . PHE B 2 498 ? 2.291 6.269 -4.135 1.00 74.51 ? 479 PHE B CE1 1 ATOM 10198 C CE2 . PHE B 2 498 ? 2.246 7.224 -6.327 1.00 86.74 ? 479 PHE B CE2 1 ATOM 10199 C CZ . PHE B 2 498 ? 1.995 6.160 -5.479 1.00 72.83 ? 479 PHE B CZ 1 ATOM 10200 N N . PHE B 2 499 ? 1.803 10.275 -1.612 1.00 97.65 ? 480 PHE B N 1 ATOM 10201 C CA . PHE B 2 499 ? 0.776 9.939 -0.642 1.00 96.47 ? 480 PHE B CA 1 ATOM 10202 C C . PHE B 2 499 ? 0.009 11.194 -0.250 1.00 100.59 ? 480 PHE B C 1 ATOM 10203 O O . PHE B 2 499 ? 0.471 12.311 -0.477 1.00 106.71 ? 480 PHE B O 1 ATOM 10204 C CB . PHE B 2 499 ? 1.397 9.285 0.596 1.00 98.37 ? 480 PHE B CB 1 ATOM 10205 C CG . PHE B 2 499 ? 2.031 7.950 0.322 1.00 90.99 ? 480 PHE B CG 1 ATOM 10206 C CD1 . PHE B 2 499 ? 1.248 6.822 0.132 1.00 80.13 ? 480 PHE B CD1 1 ATOM 10207 C CD2 . PHE B 2 499 ? 3.409 7.822 0.258 1.00 90.84 ? 480 PHE B CD2 1 ATOM 10208 C CE1 . PHE B 2 499 ? 1.829 5.595 -0.122 1.00 77.77 ? 480 PHE B CE1 1 ATOM 10209 C CE2 . PHE B 2 499 ? 3.996 6.594 0.005 1.00 77.81 ? 480 PHE B CE2 1 ATOM 10210 C CZ . PHE B 2 499 ? 3.206 5.481 -0.184 1.00 73.83 ? 480 PHE B CZ 1 ATOM 10211 N N . SER B 2 500 ? -1.172 11.006 0.324 1.00 100.75 ? 481 SER B N 1 ATOM 10212 C CA . SER B 2 500 ? -1.949 12.118 0.847 1.00 100.82 ? 481 SER B CA 1 ATOM 10213 C C . SER B 2 500 ? -1.185 12.779 1.985 1.00 106.73 ? 481 SER B C 1 ATOM 10214 O O . SER B 2 500 ? -0.848 13.960 1.929 1.00 108.21 ? 481 SER B O 1 ATOM 10215 C CB . SER B 2 500 ? -3.297 11.617 1.360 1.00 98.33 ? 481 SER B CB 1 ATOM 10216 O OG . SER B 2 500 ? -3.840 12.508 2.316 1.00 106.69 ? 481 SER B OG 1 ATOM 10217 N N . GLU B 2 501 ? -0.918 11.989 3.017 1.00 109.01 ? 482 GLU B N 1 ATOM 10218 C CA . GLU B 2 501 ? -0.162 12.429 4.178 1.00 106.83 ? 482 GLU B CA 1 ATOM 10219 C C . GLU B 2 501 ? 0.404 11.190 4.869 1.00 108.84 ? 482 GLU B C 1 ATOM 10220 O O . GLU B 2 501 ? 0.604 10.158 4.227 1.00 111.25 ? 482 GLU B O 1 ATOM 10221 C CB . GLU B 2 501 ? -1.051 13.245 5.123 1.00 103.24 ? 482 GLU B CB 1 ATOM 10222 C CG . GLU B 2 501 ? -2.488 12.749 5.213 1.00 102.80 ? 482 GLU B CG 1 ATOM 10223 C CD . GLU B 2 501 ? -3.416 13.747 5.883 1.00 108.38 ? 482 GLU B CD 1 ATOM 10224 O OE1 . GLU B 2 501 ? -3.286 13.950 7.109 1.00 108.69 ? 482 GLU B OE1 1 ATOM 10225 O OE2 . GLU B 2 501 ? -4.275 14.329 5.183 1.00 108.44 ? 482 GLU B OE2 1 ATOM 10226 N N . GLY B 2 502 ? 0.666 11.281 6.168 1.00 107.18 ? 483 GLY B N 1 ATOM 10227 C CA . GLY B 2 502 ? 1.153 10.128 6.902 1.00 94.92 ? 483 GLY B CA 1 ATOM 10228 C C . GLY B 2 502 ? 2.194 10.432 7.961 1.00 93.92 ? 483 GLY B C 1 ATOM 10229 O O . GLY B 2 502 ? 2.257 11.544 8.484 1.00 97.71 ? 483 GLY B O 1 ATOM 10230 N N . CYS B 2 503 ? 3.008 9.432 8.284 1.00 84.89 ? 484 CYS B N 1 ATOM 10231 C CA . CYS B 2 503 ? 4.048 9.585 9.294 1.00 73.87 ? 484 CYS B CA 1 ATOM 10232 C C . CYS B 2 503 ? 5.320 8.836 8.917 1.00 86.04 ? 484 CYS B C 1 ATOM 10233 O O . CYS B 2 503 ? 5.340 7.604 8.866 1.00 91.20 ? 484 CYS B O 1 ATOM 10234 C CB . CYS B 2 503 ? 3.551 9.114 10.664 1.00 71.81 ? 484 CYS B CB 1 ATOM 10235 S SG . CYS B 2 503 ? 4.697 9.455 12.021 1.00 138.17 ? 484 CYS B SG 1 ATOM 10236 N N . ALA B 2 504 ? 6.381 9.590 8.650 1.00 93.27 ? 485 ALA B N 1 ATOM 10237 C CA . ALA B 2 504 ? 7.686 9.011 8.360 1.00 93.61 ? 485 ALA B CA 1 ATOM 10238 C C . ALA B 2 504 ? 8.764 9.735 9.161 1.00 100.53 ? 485 ALA B C 1 ATOM 10239 O O . ALA B 2 504 ? 9.457 10.597 8.623 1.00 99.44 ? 485 ALA B O 1 ATOM 10240 C CB . ALA B 2 504 ? 7.985 9.090 6.869 1.00 82.77 ? 485 ALA B CB 1 ATOM 10241 N N . PRO B 2 505 ? 8.901 9.380 10.452 1.00 105.38 ? 486 PRO B N 1 ATOM 10242 C CA . PRO B 2 505 ? 9.811 9.999 11.424 1.00 109.57 ? 486 PRO B CA 1 ATOM 10243 C C . PRO B 2 505 ? 11.201 10.299 10.869 1.00 116.11 ? 486 PRO B C 1 ATOM 10244 O O . PRO B 2 505 ? 11.905 9.388 10.433 1.00 117.16 ? 486 PRO B O 1 ATOM 10245 C CB . PRO B 2 505 ? 9.897 8.943 12.524 1.00 97.87 ? 486 PRO B CB 1 ATOM 10246 C CG . PRO B 2 505 ? 8.551 8.315 12.509 1.00 91.16 ? 486 PRO B CG 1 ATOM 10247 C CD . PRO B 2 505 ? 8.138 8.272 11.058 1.00 95.77 ? 486 PRO B CD 1 ATOM 10248 N N . GLY B 2 506 ? 11.579 11.574 10.892 1.00 120.55 ? 487 GLY B N 1 ATOM 10249 C CA . GLY B 2 506 ? 12.850 12.017 10.348 1.00 122.04 ? 487 GLY B CA 1 ATOM 10250 C C . GLY B 2 506 ? 12.671 12.966 9.177 1.00 124.42 ? 487 GLY B C 1 ATOM 10251 O O . GLY B 2 506 ? 13.611 13.643 8.761 1.00 120.06 ? 487 GLY B O 1 ATOM 10252 N N . SER B 2 507 ? 11.454 13.010 8.644 1.00 128.76 ? 488 SER B N 1 ATOM 10253 C CA . SER B 2 507 ? 11.133 13.882 7.521 1.00 123.04 ? 488 SER B CA 1 ATOM 10254 C C . SER B 2 507 ? 11.071 15.333 7.973 1.00 117.16 ? 488 SER B C 1 ATOM 10255 O O . SER B 2 507 ? 11.084 15.615 9.172 1.00 120.87 ? 488 SER B O 1 ATOM 10256 C CB . SER B 2 507 ? 9.797 13.476 6.896 1.00 121.46 ? 488 SER B CB 1 ATOM 10257 O OG . SER B 2 507 ? 9.832 12.135 6.438 1.00 117.57 ? 488 SER B OG 1 ATOM 10258 N N . LYS B 2 508 ? 11.003 16.248 7.010 1.00 113.88 ? 489 LYS B N 1 ATOM 10259 C CA . LYS B 2 508 ? 10.913 17.675 7.308 1.00 114.83 ? 489 LYS B CA 1 ATOM 10260 C C . LYS B 2 508 ? 9.639 17.989 8.086 1.00 124.32 ? 489 LYS B C 1 ATOM 10261 O O . LYS B 2 508 ? 8.603 17.356 7.881 1.00 129.08 ? 489 LYS B O 1 ATOM 10262 C CB . LYS B 2 508 ? 10.968 18.503 6.023 1.00 102.32 ? 489 LYS B CB 1 ATOM 10263 N N . LYS B 2 509 ? 9.724 18.965 8.983 1.00 123.26 ? 490 LYS B N 1 ATOM 10264 C CA . LYS B 2 509 ? 8.595 19.317 9.836 1.00 129.03 ? 490 LYS B CA 1 ATOM 10265 C C . LYS B 2 509 ? 7.444 19.910 9.029 1.00 146.71 ? 490 LYS B C 1 ATOM 10266 O O . LYS B 2 509 ? 6.279 19.787 9.410 1.00 150.25 ? 490 LYS B O 1 ATOM 10267 C CB . LYS B 2 509 ? 9.037 20.288 10.932 1.00 125.79 ? 490 LYS B CB 1 ATOM 10268 C CG . LYS B 2 509 ? 10.118 19.736 11.849 1.00 118.24 ? 490 LYS B CG 1 ATOM 10269 C CD . LYS B 2 509 ? 9.637 18.494 12.581 1.00 118.13 ? 490 LYS B CD 1 ATOM 10270 C CE . LYS B 2 509 ? 10.717 17.925 13.489 1.00 116.11 ? 490 LYS B CE 1 ATOM 10271 N NZ . LYS B 2 509 ? 11.906 17.454 12.726 1.00 115.17 ? 490 LYS B NZ 1 ATOM 10272 N N . ASP B 2 510 ? 7.776 20.549 7.911 1.00 155.38 ? 491 ASP B N 1 ATOM 10273 C CA . ASP B 2 510 ? 6.768 21.142 7.037 1.00 158.11 ? 491 ASP B CA 1 ATOM 10274 C C . ASP B 2 510 ? 6.365 20.197 5.906 1.00 152.84 ? 491 ASP B C 1 ATOM 10275 O O . ASP B 2 510 ? 5.747 20.616 4.926 1.00 150.33 ? 491 ASP B O 1 ATOM 10276 C CB . ASP B 2 510 ? 7.257 22.479 6.471 1.00 160.30 ? 491 ASP B CB 1 ATOM 10277 C CG . ASP B 2 510 ? 8.684 22.412 5.959 1.00 158.04 ? 491 ASP B CG 1 ATOM 10278 O OD1 . ASP B 2 510 ? 9.195 21.292 5.746 1.00 149.17 ? 491 ASP B OD1 1 ATOM 10279 O OD2 . ASP B 2 510 ? 9.294 23.485 5.766 1.00 163.28 ? 491 ASP B OD2 1 ATOM 10280 N N . SER B 2 511 ? 6.719 18.923 6.048 1.00 142.23 ? 492 SER B N 1 ATOM 10281 C CA . SER B 2 511 ? 6.343 17.910 5.068 1.00 132.56 ? 492 SER B CA 1 ATOM 10282 C C . SER B 2 511 ? 4.998 17.290 5.427 1.00 128.35 ? 492 SER B C 1 ATOM 10283 O O . SER B 2 511 ? 4.516 17.439 6.550 1.00 120.79 ? 492 SER B O 1 ATOM 10284 C CB . SER B 2 511 ? 7.417 16.824 4.971 1.00 121.26 ? 492 SER B CB 1 ATOM 10285 O OG . SER B 2 511 ? 7.061 15.836 4.019 1.00 108.42 ? 492 SER B OG 1 ATOM 10286 N N . SER B 2 512 ? 4.395 16.595 4.470 1.00 130.80 ? 493 SER B N 1 ATOM 10287 C CA . SER B 2 512 ? 3.090 15.985 4.684 1.00 133.93 ? 493 SER B CA 1 ATOM 10288 C C . SER B 2 512 ? 3.214 14.647 5.406 1.00 132.34 ? 493 SER B C 1 ATOM 10289 O O . SER B 2 512 ? 2.215 14.062 5.819 1.00 140.60 ? 493 SER B O 1 ATOM 10290 C CB . SER B 2 512 ? 2.355 15.804 3.354 1.00 138.35 ? 493 SER B CB 1 ATOM 10291 O OG . SER B 2 512 ? 3.051 14.915 2.500 1.00 141.18 ? 493 SER B OG 1 ATOM 10292 N N . LEU B 2 513 ? 4.444 14.169 5.560 1.00 123.16 ? 494 LEU B N 1 ATOM 10293 C CA . LEU B 2 513 ? 4.689 12.898 6.235 1.00 113.55 ? 494 LEU B CA 1 ATOM 10294 C C . LEU B 2 513 ? 4.920 13.085 7.730 1.00 117.46 ? 494 LEU B C 1 ATOM 10295 O O . LEU B 2 513 ? 5.601 12.283 8.365 1.00 122.72 ? 494 LEU B O 1 ATOM 10296 C CB . LEU B 2 513 ? 5.875 12.174 5.601 1.00 103.05 ? 494 LEU B CB 1 ATOM 10297 C CG . LEU B 2 513 ? 5.663 11.816 4.132 1.00 97.94 ? 494 LEU B CG 1 ATOM 10298 C CD1 . LEU B 2 513 ? 6.887 11.121 3.568 1.00 95.60 ? 494 LEU B CD1 1 ATOM 10299 C CD2 . LEU B 2 513 ? 4.424 10.948 3.981 1.00 97.15 ? 494 LEU B CD2 1 ATOM 10300 N N . CYS B 2 514 ? 4.353 14.154 8.279 1.00 121.27 ? 495 CYS B N 1 ATOM 10301 C CA . CYS B 2 514 ? 4.392 14.410 9.714 1.00 115.40 ? 495 CYS B CA 1 ATOM 10302 C C . CYS B 2 514 ? 3.016 14.879 10.172 1.00 111.23 ? 495 CYS B C 1 ATOM 10303 O O . CYS B 2 514 ? 2.808 15.173 11.348 1.00 116.94 ? 495 CYS B O 1 ATOM 10304 C CB . CYS B 2 514 ? 5.442 15.475 10.053 1.00 114.58 ? 495 CYS B CB 1 ATOM 10305 S SG . CYS B 2 514 ? 7.169 15.000 9.765 1.00 114.88 ? 495 CYS B SG 1 ATOM 10306 N N . LYS B 2 515 ? 2.076 14.931 9.232 1.00 104.83 ? 496 LYS B N 1 ATOM 10307 C CA . LYS B 2 515 ? 0.761 15.521 9.473 1.00 109.60 ? 496 LYS B CA 1 ATOM 10308 C C . LYS B 2 515 ? -0.162 14.668 10.343 1.00 115.13 ? 496 LYS B C 1 ATOM 10309 O O . LYS B 2 515 ? -1.297 15.056 10.614 1.00 122.83 ? 496 LYS B O 1 ATOM 10310 C CB . LYS B 2 515 ? 0.072 15.849 8.143 1.00 103.28 ? 496 LYS B CB 1 ATOM 10311 N N . LEU B 2 516 ? 0.320 13.508 10.776 1.00 118.06 ? 497 LEU B N 1 ATOM 10312 C CA . LEU B 2 516 ? -0.466 12.656 11.663 1.00 119.43 ? 497 LEU B CA 1 ATOM 10313 C C . LEU B 2 516 ? 0.400 11.770 12.552 1.00 116.64 ? 497 LEU B C 1 ATOM 10314 O O . LEU B 2 516 ? 0.017 10.655 12.897 1.00 116.81 ? 497 LEU B O 1 ATOM 10315 C CB . LEU B 2 516 ? -1.483 11.822 10.875 1.00 111.87 ? 497 LEU B CB 1 ATOM 10316 C CG . LEU B 2 516 ? -1.019 11.053 9.637 1.00 95.57 ? 497 LEU B CG 1 ATOM 10317 C CD1 . LEU B 2 516 ? -0.549 9.650 9.992 1.00 97.28 ? 497 LEU B CD1 1 ATOM 10318 C CD2 . LEU B 2 516 ? -2.137 11.003 8.613 1.00 81.67 ? 497 LEU B CD2 1 ATOM 10319 N N . CYS B 2 517 ? 1.571 12.276 12.922 1.00 110.94 ? 498 CYS B N 1 ATOM 10320 C CA . CYS B 2 517 ? 2.396 11.612 13.919 1.00 105.92 ? 498 CYS B CA 1 ATOM 10321 C C . CYS B 2 517 ? 1.884 11.971 15.311 1.00 116.30 ? 498 CYS B C 1 ATOM 10322 O O . CYS B 2 517 ? 0.842 12.613 15.452 1.00 123.80 ? 498 CYS B O 1 ATOM 10323 C CB . CYS B 2 517 ? 3.860 12.026 13.769 1.00 103.22 ? 498 CYS B CB 1 ATOM 10324 S SG . CYS B 2 517 ? 4.645 11.476 12.236 1.00 122.47 ? 498 CYS B SG 1 ATOM 10325 N N . MET B 2 518 ? 2.610 11.544 16.337 1.00 122.43 ? 499 MET B N 1 ATOM 10326 C CA . MET B 2 518 ? 2.310 11.949 17.705 1.00 128.70 ? 499 MET B CA 1 ATOM 10327 C C . MET B 2 518 ? 3.591 12.379 18.405 1.00 130.71 ? 499 MET B C 1 ATOM 10328 O O . MET B 2 518 ? 4.504 12.899 17.766 1.00 136.88 ? 499 MET B O 1 ATOM 10329 C CB . MET B 2 518 ? 1.622 10.822 18.478 1.00 133.83 ? 499 MET B CB 1 ATOM 10330 C CG . MET B 2 518 ? 2.268 9.457 18.311 1.00 138.12 ? 499 MET B CG 1 ATOM 10331 S SD . MET B 2 518 ? 1.565 8.240 19.438 1.00 106.99 ? 499 MET B SD 1 ATOM 10332 C CE . MET B 2 518 ? -0.175 8.675 19.353 1.00 74.11 ? 499 MET B CE 1 ATOM 10333 N N . GLY B 2 519 ? 3.661 12.157 19.713 1.00 130.63 ? 500 GLY B N 1 ATOM 10334 C CA . GLY B 2 519 ? 4.828 12.549 20.481 1.00 135.21 ? 500 GLY B CA 1 ATOM 10335 C C . GLY B 2 519 ? 4.972 14.057 20.532 1.00 137.18 ? 500 GLY B C 1 ATOM 10336 O O . GLY B 2 519 ? 5.533 14.673 19.624 1.00 138.38 ? 500 GLY B O 1 ATOM 10337 N N . SER B 2 520 ? 4.462 14.650 21.605 1.00 135.40 ? 501 SER B N 1 ATOM 10338 C CA . SER B 2 520 ? 4.423 16.101 21.746 1.00 139.51 ? 501 SER B CA 1 ATOM 10339 C C . SER B 2 520 ? 5.807 16.753 21.768 1.00 130.91 ? 501 SER B C 1 ATOM 10340 O O . SER B 2 520 ? 6.828 16.072 21.882 1.00 112.66 ? 501 SER B O 1 ATOM 10341 C CB . SER B 2 520 ? 3.641 16.479 23.006 1.00 149.83 ? 501 SER B CB 1 ATOM 10342 O OG . SER B 2 520 ? 4.069 15.706 24.115 1.00 149.89 ? 501 SER B OG 1 ATOM 10343 N N . GLY B 2 521 ? 5.824 18.078 21.651 1.00 135.60 ? 502 GLY B N 1 ATOM 10344 C CA . GLY B 2 521 ? 7.057 18.843 21.700 1.00 134.03 ? 502 GLY B CA 1 ATOM 10345 C C . GLY B 2 521 ? 7.754 18.938 20.357 1.00 128.96 ? 502 GLY B C 1 ATOM 10346 O O . GLY B 2 521 ? 7.113 19.120 19.322 1.00 116.12 ? 502 GLY B O 1 ATOM 10347 N N . LEU B 2 522 ? 9.077 18.826 20.379 1.00 136.56 ? 503 LEU B N 1 ATOM 10348 C CA . LEU B 2 522 ? 9.869 18.817 19.157 1.00 138.99 ? 503 LEU B CA 1 ATOM 10349 C C . LEU B 2 522 ? 10.240 17.383 18.814 1.00 139.09 ? 503 LEU B C 1 ATOM 10350 O O . LEU B 2 522 ? 11.039 17.131 17.910 1.00 138.04 ? 503 LEU B O 1 ATOM 10351 C CB . LEU B 2 522 ? 11.130 19.668 19.322 1.00 141.63 ? 503 LEU B CB 1 ATOM 10352 N N . ASN B 2 523 ? 9.656 16.446 19.556 1.00 142.79 ? 504 ASN B N 1 ATOM 10353 C CA . ASN B 2 523 ? 9.843 15.022 19.304 1.00 140.52 ? 504 ASN B CA 1 ATOM 10354 C C . ASN B 2 523 ? 8.938 14.550 18.172 1.00 137.57 ? 504 ASN B C 1 ATOM 10355 O O . ASN B 2 523 ? 9.100 13.447 17.647 1.00 136.53 ? 504 ASN B O 1 ATOM 10356 C CB . ASN B 2 523 ? 9.561 14.210 20.570 1.00 135.82 ? 504 ASN B CB 1 ATOM 10357 C CG . ASN B 2 523 ? 10.616 14.408 21.641 1.00 125.56 ? 504 ASN B CG 1 ATOM 10358 O OD1 . ASN B 2 523 ? 11.810 14.493 21.349 1.00 119.28 ? 504 ASN B OD1 1 ATOM 10359 N ND2 . ASN B 2 523 ? 10.178 14.477 22.894 1.00 117.62 ? 504 ASN B ND2 1 ATOM 10360 N N . LEU B 2 524 ? 7.977 15.397 17.814 1.00 128.69 ? 505 LEU B N 1 ATOM 10361 C CA . LEU B 2 524 ? 7.071 15.125 16.708 1.00 116.48 ? 505 LEU B CA 1 ATOM 10362 C C . LEU B 2 524 ? 7.882 14.884 15.440 1.00 117.93 ? 505 LEU B C 1 ATOM 10363 O O . LEU B 2 524 ? 8.718 15.707 15.068 1.00 119.97 ? 505 LEU B O 1 ATOM 10364 C CB . LEU B 2 524 ? 6.111 16.303 16.522 1.00 110.99 ? 505 LEU B CB 1 ATOM 10365 C CG . LEU B 2 524 ? 4.820 16.116 15.721 1.00 109.59 ? 505 LEU B CG 1 ATOM 10366 C CD1 . LEU B 2 524 ? 3.775 17.127 16.173 1.00 99.74 ? 505 LEU B CD1 1 ATOM 10367 C CD2 . LEU B 2 524 ? 5.070 16.252 14.227 1.00 114.95 ? 505 LEU B CD2 1 ATOM 10368 N N . CYS B 2 525 ? 7.639 13.741 14.802 1.00 120.04 ? 506 CYS B N 1 ATOM 10369 C CA . CYS B 2 525 ? 8.337 13.345 13.579 1.00 120.84 ? 506 CYS B CA 1 ATOM 10370 C C . CYS B 2 525 ? 9.848 13.226 13.796 1.00 111.83 ? 506 CYS B C 1 ATOM 10371 O O . CYS B 2 525 ? 10.641 13.613 12.940 1.00 110.64 ? 506 CYS B O 1 ATOM 10372 C CB . CYS B 2 525 ? 8.017 14.312 12.432 1.00 128.97 ? 506 CYS B CB 1 ATOM 10373 S SG . CYS B 2 525 ? 8.364 13.692 10.766 1.00 122.83 ? 506 CYS B SG 1 ATOM 10374 N N . GLU B 2 526 ? 10.237 12.686 14.948 1.00 103.55 ? 507 GLU B N 1 ATOM 10375 C CA . GLU B 2 526 ? 11.648 12.475 15.253 1.00 104.61 ? 507 GLU B CA 1 ATOM 10376 C C . GLU B 2 526 ? 11.949 10.983 15.388 1.00 94.26 ? 507 GLU B C 1 ATOM 10377 O O . GLU B 2 526 ? 11.219 10.261 16.064 1.00 91.81 ? 507 GLU B O 1 ATOM 10378 C CB . GLU B 2 526 ? 12.038 13.214 16.537 1.00 117.07 ? 507 GLU B CB 1 ATOM 10379 C CG . GLU B 2 526 ? 13.360 13.968 16.455 1.00 128.40 ? 507 GLU B CG 1 ATOM 10380 C CD . GLU B 2 526 ? 13.255 15.243 15.639 1.00 138.39 ? 507 GLU B CD 1 ATOM 10381 O OE1 . GLU B 2 526 ? 12.131 15.770 15.504 1.00 142.80 ? 507 GLU B OE1 1 ATOM 10382 O OE2 . GLU B 2 526 ? 14.294 15.717 15.132 1.00 138.37 ? 507 GLU B OE2 1 ATOM 10383 N N . PRO B 2 527 ? 13.034 10.517 14.746 1.00 92.13 ? 508 PRO B N 1 ATOM 10384 C CA . PRO B 2 527 ? 13.416 9.097 14.707 1.00 93.14 ? 508 PRO B CA 1 ATOM 10385 C C . PRO B 2 527 ? 13.820 8.502 16.062 1.00 92.40 ? 508 PRO B C 1 ATOM 10386 O O . PRO B 2 527 ? 14.894 7.907 16.166 1.00 77.54 ? 508 PRO B O 1 ATOM 10387 C CB . PRO B 2 527 ? 14.626 9.085 13.761 1.00 88.22 ? 508 PRO B CB 1 ATOM 10388 C CG . PRO B 2 527 ? 14.533 10.348 12.988 1.00 85.35 ? 508 PRO B CG 1 ATOM 10389 C CD . PRO B 2 527 ? 13.928 11.345 13.922 1.00 91.95 ? 508 PRO B CD 1 ATOM 10390 N N . ASN B 2 528 ? 12.972 8.648 17.075 1.00 103.48 ? 509 ASN B N 1 ATOM 10391 C CA . ASN B 2 528 ? 13.246 8.068 18.387 1.00 105.83 ? 509 ASN B CA 1 ATOM 10392 C C . ASN B 2 528 ? 11.958 7.748 19.143 1.00 103.98 ? 509 ASN B C 1 ATOM 10393 O O . ASN B 2 528 ? 10.897 8.295 18.832 1.00 100.23 ? 509 ASN B O 1 ATOM 10394 C CB . ASN B 2 528 ? 14.141 8.994 19.213 1.00 107.84 ? 509 ASN B CB 1 ATOM 10395 C CG . ASN B 2 528 ? 13.383 10.166 19.798 1.00 109.99 ? 509 ASN B CG 1 ATOM 10396 O OD1 . ASN B 2 528 ? 12.951 11.065 19.077 1.00 104.75 ? 509 ASN B OD1 1 ATOM 10397 N ND2 . ASN B 2 528 ? 13.225 10.166 21.116 1.00 116.46 ? 509 ASN B ND2 1 ATOM 10398 N N . ASN B 2 529 ? 12.060 6.874 20.142 1.00 99.96 ? 510 ASN B N 1 ATOM 10399 C CA . ASN B 2 529 ? 10.885 6.336 20.834 1.00 99.92 ? 510 ASN B CA 1 ATOM 10400 C C . ASN B 2 529 ? 9.935 7.371 21.452 1.00 93.15 ? 510 ASN B C 1 ATOM 10401 O O . ASN B 2 529 ? 8.791 7.050 21.776 1.00 86.94 ? 510 ASN B O 1 ATOM 10402 C CB . ASN B 2 529 ? 11.291 5.284 21.876 1.00 99.44 ? 510 ASN B CB 1 ATOM 10403 C CG . ASN B 2 529 ? 12.189 5.848 22.960 1.00 106.60 ? 510 ASN B CG 1 ATOM 10404 O OD1 . ASN B 2 529 ? 11.736 6.579 23.842 1.00 110.96 ? 510 ASN B OD1 1 ATOM 10405 N ND2 . ASN B 2 529 ? 13.469 5.498 22.909 1.00 101.70 ? 510 ASN B ND2 1 ATOM 10406 N N . LYS B 2 530 ? 10.402 8.606 21.610 1.00 97.52 ? 511 LYS B N 1 ATOM 10407 C CA . LYS B 2 530 ? 9.535 9.677 22.090 1.00 107.81 ? 511 LYS B CA 1 ATOM 10408 C C . LYS B 2 530 ? 8.410 9.896 21.086 1.00 113.15 ? 511 LYS B C 1 ATOM 10409 O O . LYS B 2 530 ? 7.300 10.291 21.448 1.00 110.54 ? 511 LYS B O 1 ATOM 10410 C CB . LYS B 2 530 ? 10.326 10.969 22.303 1.00 100.91 ? 511 LYS B CB 1 ATOM 10411 N N . GLU B 2 531 ? 8.712 9.630 19.819 1.00 112.93 ? 512 GLU B N 1 ATOM 10412 C CA . GLU B 2 531 ? 7.706 9.637 18.767 1.00 114.08 ? 512 GLU B CA 1 ATOM 10413 C C . GLU B 2 531 ? 6.966 8.307 18.781 1.00 117.99 ? 512 GLU B C 1 ATOM 10414 O O . GLU B 2 531 ? 7.532 7.269 18.437 1.00 110.50 ? 512 GLU B O 1 ATOM 10415 C CB . GLU B 2 531 ? 8.361 9.866 17.406 1.00 110.91 ? 512 GLU B CB 1 ATOM 10416 C CG . GLU B 2 531 ? 7.427 9.677 16.224 1.00 113.36 ? 512 GLU B CG 1 ATOM 10417 C CD . GLU B 2 531 ? 6.249 10.628 16.251 1.00 114.74 ? 512 GLU B CD 1 ATOM 10418 O OE1 . GLU B 2 531 ? 6.403 11.776 15.785 1.00 129.71 ? 512 GLU B OE1 1 ATOM 10419 O OE2 . GLU B 2 531 ? 5.170 10.228 16.736 1.00 109.18 ? 512 GLU B OE2 1 ATOM 10420 N N . GLY B 2 532 ? 5.699 8.346 19.179 1.00 125.42 ? 513 GLY B N 1 ATOM 10421 C CA . GLY B 2 532 ? 4.907 7.141 19.353 1.00 120.92 ? 513 GLY B CA 1 ATOM 10422 C C . GLY B 2 532 ? 4.721 6.301 18.104 1.00 111.03 ? 513 GLY B C 1 ATOM 10423 O O . GLY B 2 532 ? 4.349 5.131 18.190 1.00 103.92 ? 513 GLY B O 1 ATOM 10424 N N . TYR B 2 533 ? 4.976 6.890 16.940 1.00 100.87 ? 514 TYR B N 1 ATOM 10425 C CA . TYR B 2 533 ? 4.833 6.166 15.684 1.00 84.31 ? 514 TYR B CA 1 ATOM 10426 C C . TYR B 2 533 ? 6.181 5.820 15.058 1.00 90.67 ? 514 TYR B C 1 ATOM 10427 O O . TYR B 2 533 ? 6.247 5.371 13.915 1.00 89.92 ? 514 TYR B O 1 ATOM 10428 C CB . TYR B 2 533 ? 3.961 6.943 14.696 1.00 81.29 ? 514 TYR B CB 1 ATOM 10429 C CG . TYR B 2 533 ? 2.514 7.052 15.117 1.00 78.41 ? 514 TYR B CG 1 ATOM 10430 C CD1 . TYR B 2 533 ? 2.007 6.270 16.145 1.00 84.13 ? 514 TYR B CD1 1 ATOM 10431 C CD2 . TYR B 2 533 ? 1.652 7.931 14.480 1.00 77.08 ? 514 TYR B CD2 1 ATOM 10432 C CE1 . TYR B 2 533 ? 0.685 6.366 16.533 1.00 88.34 ? 514 TYR B CE1 1 ATOM 10433 C CE2 . TYR B 2 533 ? 0.328 8.034 14.859 1.00 84.90 ? 514 TYR B CE2 1 ATOM 10434 C CZ . TYR B 2 533 ? -0.151 7.249 15.885 1.00 89.41 ? 514 TYR B CZ 1 ATOM 10435 O OH . TYR B 2 533 ? -1.470 7.350 16.264 1.00 95.54 ? 514 TYR B OH 1 ATOM 10436 N N . TYR B 2 534 ? 7.256 6.027 15.810 1.00 89.98 ? 515 TYR B N 1 ATOM 10437 C CA . TYR B 2 534 ? 8.573 5.603 15.357 1.00 83.71 ? 515 TYR B CA 1 ATOM 10438 C C . TYR B 2 534 ? 8.726 4.093 15.517 1.00 85.67 ? 515 TYR B C 1 ATOM 10439 O O . TYR B 2 534 ? 8.174 3.503 16.443 1.00 86.24 ? 515 TYR B O 1 ATOM 10440 C CB . TYR B 2 534 ? 9.677 6.326 16.130 1.00 77.33 ? 515 TYR B CB 1 ATOM 10441 C CG . TYR B 2 534 ? 11.045 5.719 15.916 1.00 79.80 ? 515 TYR B CG 1 ATOM 10442 C CD1 . TYR B 2 534 ? 11.665 5.781 14.673 1.00 75.86 ? 515 TYR B CD1 1 ATOM 10443 C CD2 . TYR B 2 534 ? 11.712 5.073 16.950 1.00 80.08 ? 515 TYR B CD2 1 ATOM 10444 C CE1 . TYR B 2 534 ? 12.912 5.221 14.464 1.00 69.44 ? 515 TYR B CE1 1 ATOM 10445 C CE2 . TYR B 2 534 ? 12.963 4.511 16.752 1.00 72.42 ? 515 TYR B CE2 1 ATOM 10446 C CZ . TYR B 2 534 ? 13.558 4.588 15.507 1.00 75.83 ? 515 TYR B CZ 1 ATOM 10447 O OH . TYR B 2 534 ? 14.801 4.030 15.300 1.00 76.13 ? 515 TYR B OH 1 ATOM 10448 N N . GLY B 2 535 ? 9.470 3.470 14.607 1.00 86.93 ? 516 GLY B N 1 ATOM 10449 C CA . GLY B 2 535 ? 9.751 2.048 14.692 1.00 77.82 ? 516 GLY B CA 1 ATOM 10450 C C . GLY B 2 535 ? 8.654 1.188 14.098 1.00 77.52 ? 516 GLY B C 1 ATOM 10451 O O . GLY B 2 535 ? 7.595 1.695 13.722 1.00 77.67 ? 516 GLY B O 1 ATOM 10452 N N . TYR B 2 536 ? 8.916 -0.115 14.009 1.00 70.88 ? 517 TYR B N 1 ATOM 10453 C CA . TYR B 2 536 ? 7.942 -1.069 13.489 1.00 61.05 ? 517 TYR B CA 1 ATOM 10454 C C . TYR B 2 536 ? 6.628 -0.959 14.250 1.00 66.28 ? 517 TYR B C 1 ATOM 10455 O O . TYR B 2 536 ? 5.561 -0.794 13.655 1.00 70.40 ? 517 TYR B O 1 ATOM 10456 C CB . TYR B 2 536 ? 8.459 -2.503 13.617 1.00 57.05 ? 517 TYR B CB 1 ATOM 10457 C CG . TYR B 2 536 ? 9.700 -2.828 12.816 1.00 63.82 ? 517 TYR B CG 1 ATOM 10458 C CD1 . TYR B 2 536 ? 10.905 -3.110 13.448 1.00 61.59 ? 517 TYR B CD1 1 ATOM 10459 C CD2 . TYR B 2 536 ? 9.662 -2.876 11.431 1.00 70.05 ? 517 TYR B CD2 1 ATOM 10460 C CE1 . TYR B 2 536 ? 12.041 -3.420 12.720 1.00 60.58 ? 517 TYR B CE1 1 ATOM 10461 C CE2 . TYR B 2 536 ? 10.791 -3.184 10.694 1.00 72.99 ? 517 TYR B CE2 1 ATOM 10462 C CZ . TYR B 2 536 ? 11.976 -3.452 11.343 1.00 70.28 ? 517 TYR B CZ 1 ATOM 10463 O OH . TYR B 2 536 ? 13.095 -3.760 10.605 1.00 75.19 ? 517 TYR B OH 1 ATOM 10464 N N . THR B 2 537 ? 6.725 -1.049 15.572 1.00 66.22 ? 518 THR B N 1 ATOM 10465 C CA . THR B 2 537 ? 5.561 -1.023 16.445 1.00 61.42 ? 518 THR B CA 1 ATOM 10466 C C . THR B 2 537 ? 4.759 0.243 16.242 1.00 69.31 ? 518 THR B C 1 ATOM 10467 O O . THR B 2 537 ? 3.545 0.197 16.055 1.00 77.38 ? 518 THR B O 1 ATOM 10468 C CB . THR B 2 537 ? 5.967 -1.091 17.921 1.00 60.93 ? 518 THR B CB 1 ATOM 10469 O OG1 . THR B 2 537 ? 6.764 -2.259 18.151 1.00 75.87 ? 518 THR B OG1 1 ATOM 10470 C CG2 . THR B 2 537 ? 4.730 -1.137 18.799 1.00 61.09 ? 518 THR B CG2 1 ATOM 10471 N N . GLY B 2 538 ? 5.453 1.374 16.279 1.00 77.88 ? 519 GLY B N 1 ATOM 10472 C CA . GLY B 2 538 ? 4.811 2.665 16.138 1.00 75.73 ? 519 GLY B CA 1 ATOM 10473 C C . GLY B 2 538 ? 4.167 2.838 14.780 1.00 75.94 ? 519 GLY B C 1 ATOM 10474 O O . GLY B 2 538 ? 3.092 3.436 14.661 1.00 64.99 ? 519 GLY B O 1 ATOM 10475 N N . ALA B 2 539 ? 4.826 2.309 13.753 1.00 57.55 ? 520 ALA B N 1 ATOM 10476 C CA . ALA B 2 539 ? 4.297 2.383 12.401 1.00 71.98 ? 520 ALA B CA 1 ATOM 10477 C C . ALA B 2 539 ? 3.000 1.584 12.286 1.00 74.68 ? 520 ALA B C 1 ATOM 10478 O O . ALA B 2 539 ? 2.058 2.013 11.618 1.00 74.13 ? 520 ALA B O 1 ATOM 10479 C CB . ALA B 2 539 ? 5.326 1.897 11.398 1.00 56.21 ? 520 ALA B CB 1 ATOM 10480 N N . PHE B 2 540 ? 2.948 0.430 12.947 1.00 59.35 ? 521 PHE B N 1 ATOM 10481 C CA . PHE B 2 540 ? 1.724 -0.360 12.958 1.00 63.29 ? 521 PHE B CA 1 ATOM 10482 C C . PHE B 2 540 ? 0.639 0.317 13.796 1.00 75.04 ? 521 PHE B C 1 ATOM 10483 O O . PHE B 2 540 ? -0.545 0.259 13.462 1.00 73.57 ? 521 PHE B O 1 ATOM 10484 C CB . PHE B 2 540 ? 1.982 -1.785 13.449 1.00 72.38 ? 521 PHE B CB 1 ATOM 10485 C CG . PHE B 2 540 ? 0.729 -2.596 13.636 1.00 78.84 ? 521 PHE B CG 1 ATOM 10486 C CD1 . PHE B 2 540 ? -0.131 -2.823 12.574 1.00 70.25 ? 521 PHE B CD1 1 ATOM 10487 C CD2 . PHE B 2 540 ? 0.411 -3.131 14.874 1.00 80.14 ? 521 PHE B CD2 1 ATOM 10488 C CE1 . PHE B 2 540 ? -1.285 -3.562 12.746 1.00 69.09 ? 521 PHE B CE1 1 ATOM 10489 C CE2 . PHE B 2 540 ? -0.739 -3.875 15.049 1.00 72.33 ? 521 PHE B CE2 1 ATOM 10490 C CZ . PHE B 2 540 ? -1.588 -4.088 13.986 1.00 69.61 ? 521 PHE B CZ 1 ATOM 10491 N N . ARG B 2 541 ? 1.041 0.964 14.884 1.00 76.86 ? 522 ARG B N 1 ATOM 10492 C CA . ARG B 2 541 ? 0.091 1.724 15.681 1.00 83.19 ? 522 ARG B CA 1 ATOM 10493 C C . ARG B 2 541 ? -0.489 2.863 14.850 1.00 85.60 ? 522 ARG B C 1 ATOM 10494 O O . ARG B 2 541 ? -1.677 3.174 14.942 1.00 87.41 ? 522 ARG B O 1 ATOM 10495 C CB . ARG B 2 541 ? 0.744 2.280 16.945 1.00 89.10 ? 522 ARG B CB 1 ATOM 10496 C CG . ARG B 2 541 ? -0.227 3.076 17.803 1.00 97.64 ? 522 ARG B CG 1 ATOM 10497 C CD . ARG B 2 541 ? 0.425 3.655 19.038 1.00 95.64 ? 522 ARG B CD 1 ATOM 10498 N NE . ARG B 2 541 ? -0.544 4.390 19.841 1.00 96.80 ? 522 ARG B NE 1 ATOM 10499 C CZ . ARG B 2 541 ? -0.294 4.875 21.051 1.00 98.28 ? 522 ARG B CZ 1 ATOM 10500 N NH1 . ARG B 2 541 ? 0.900 4.700 21.600 1.00 95.72 ? 522 ARG B NH1 1 ATOM 10501 N NH2 . ARG B 2 541 ? -1.240 5.530 21.711 1.00 90.37 ? 522 ARG B NH2 1 ATOM 10502 N N . CYS B 2 542 ? 0.362 3.480 14.038 1.00 83.58 ? 523 CYS B N 1 ATOM 10503 C CA . CYS B 2 542 ? -0.076 4.521 13.123 1.00 87.96 ? 523 CYS B CA 1 ATOM 10504 C C . CYS B 2 542 ? -1.173 3.985 12.210 1.00 89.74 ? 523 CYS B C 1 ATOM 10505 O O . CYS B 2 542 ? -2.158 4.671 11.934 1.00 92.85 ? 523 CYS B O 1 ATOM 10506 C CB . CYS B 2 542 ? 1.105 5.019 12.291 1.00 84.27 ? 523 CYS B CB 1 ATOM 10507 S SG . CYS B 2 542 ? 0.664 6.167 10.980 1.00 107.15 ? 523 CYS B SG 1 ATOM 10508 N N . LEU B 2 543 ? -0.994 2.748 11.757 1.00 76.75 ? 524 LEU B N 1 ATOM 10509 C CA . LEU B 2 543 ? -1.953 2.095 10.876 1.00 71.69 ? 524 LEU B CA 1 ATOM 10510 C C . LEU B 2 543 ? -3.321 1.906 11.527 1.00 73.79 ? 524 LEU B C 1 ATOM 10511 O O . LEU B 2 543 ? -4.341 2.213 10.917 1.00 78.45 ? 524 LEU B O 1 ATOM 10512 C CB . LEU B 2 543 ? -1.407 0.746 10.404 1.00 74.59 ? 524 LEU B CB 1 ATOM 10513 C CG . LEU B 2 543 ? -2.369 -0.165 9.641 1.00 70.22 ? 524 LEU B CG 1 ATOM 10514 C CD1 . LEU B 2 543 ? -2.909 0.543 8.422 1.00 69.31 ? 524 LEU B CD1 1 ATOM 10515 C CD2 . LEU B 2 543 ? -1.681 -1.461 9.241 1.00 68.30 ? 524 LEU B CD2 1 ATOM 10516 N N . VAL B 2 544 ? -3.344 1.409 12.760 1.00 72.77 ? 525 VAL B N 1 ATOM 10517 C CA . VAL B 2 544 ? -4.609 1.101 13.426 1.00 77.01 ? 525 VAL B CA 1 ATOM 10518 C C . VAL B 2 544 ? -5.357 2.334 13.943 1.00 86.08 ? 525 VAL B C 1 ATOM 10519 O O . VAL B 2 544 ? -6.560 2.269 14.200 1.00 84.80 ? 525 VAL B O 1 ATOM 10520 C CB . VAL B 2 544 ? -4.422 0.103 14.589 1.00 74.05 ? 525 VAL B CB 1 ATOM 10521 C CG1 . VAL B 2 544 ? -3.388 -0.946 14.221 1.00 72.89 ? 525 VAL B CG1 1 ATOM 10522 C CG2 . VAL B 2 544 ? -4.020 0.828 15.862 1.00 64.76 ? 525 VAL B CG2 1 ATOM 10523 N N . GLU B 2 545 ? -4.650 3.452 14.087 1.00 89.17 ? 526 GLU B N 1 ATOM 10524 C CA . GLU B 2 545 ? -5.239 4.649 14.685 1.00 93.91 ? 526 GLU B CA 1 ATOM 10525 C C . GLU B 2 545 ? -5.537 5.754 13.677 1.00 95.61 ? 526 GLU B C 1 ATOM 10526 O O . GLU B 2 545 ? -6.600 6.379 13.731 1.00 83.27 ? 526 GLU B O 1 ATOM 10527 C CB . GLU B 2 545 ? -4.340 5.196 15.799 1.00 99.72 ? 526 GLU B CB 1 ATOM 10528 C CG . GLU B 2 545 ? -4.309 4.341 17.057 1.00 101.37 ? 526 GLU B CG 1 ATOM 10529 C CD . GLU B 2 545 ? -3.320 4.852 18.089 1.00 103.86 ? 526 GLU B CD 1 ATOM 10530 O OE1 . GLU B 2 545 ? -2.611 5.839 17.802 1.00 111.21 ? 526 GLU B OE1 1 ATOM 10531 O OE2 . GLU B 2 545 ? -3.250 4.263 19.189 1.00 95.59 ? 526 GLU B OE2 1 ATOM 10532 N N . LYS B 2 546 ? -4.601 5.995 12.763 1.00 98.81 ? 527 LYS B N 1 ATOM 10533 C CA . LYS B 2 546 ? -4.710 7.129 11.849 1.00 96.71 ? 527 LYS B CA 1 ATOM 10534 C C . LYS B 2 546 ? -4.554 6.747 10.375 1.00 97.92 ? 527 LYS B C 1 ATOM 10535 O O . LYS B 2 546 ? -5.429 7.037 9.559 1.00 108.30 ? 527 LYS B O 1 ATOM 10536 C CB . LYS B 2 546 ? -3.698 8.215 12.230 1.00 96.73 ? 527 LYS B CB 1 ATOM 10537 C CG . LYS B 2 546 ? -3.875 8.746 13.648 1.00 99.91 ? 527 LYS B CG 1 ATOM 10538 C CD . LYS B 2 546 ? -2.801 9.754 14.018 1.00 103.03 ? 527 LYS B CD 1 ATOM 10539 C CE . LYS B 2 546 ? -2.978 10.250 15.447 1.00 110.93 ? 527 LYS B CE 1 ATOM 10540 N NZ . LYS B 2 546 ? -2.018 11.338 15.796 1.00 114.49 ? 527 LYS B NZ 1 ATOM 10541 N N . GLY B 2 547 ? -3.444 6.100 10.039 1.00 90.70 ? 528 GLY B N 1 ATOM 10542 C CA . GLY B 2 547 ? -3.146 5.771 8.654 1.00 90.16 ? 528 GLY B CA 1 ATOM 10543 C C . GLY B 2 547 ? -3.973 4.630 8.091 1.00 95.79 ? 528 GLY B C 1 ATOM 10544 O O . GLY B 2 547 ? -4.874 4.116 8.755 1.00 99.52 ? 528 GLY B O 1 ATOM 10545 N N . ASP B 2 548 ? -3.668 4.233 6.857 1.00 88.51 ? 529 ASP B N 1 ATOM 10546 C CA . ASP B 2 548 ? -4.376 3.124 6.222 1.00 91.43 ? 529 ASP B CA 1 ATOM 10547 C C . ASP B 2 548 ? -3.441 2.114 5.541 1.00 89.56 ? 529 ASP B C 1 ATOM 10548 O O . ASP B 2 548 ? -3.892 1.107 4.997 1.00 82.37 ? 529 ASP B O 1 ATOM 10549 C CB . ASP B 2 548 ? -5.463 3.631 5.260 1.00 92.76 ? 529 ASP B CB 1 ATOM 10550 C CG . ASP B 2 548 ? -4.936 4.629 4.243 1.00 99.22 ? 529 ASP B CG 1 ATOM 10551 O OD1 . ASP B 2 548 ? -5.705 5.528 3.837 1.00 84.68 ? 529 ASP B OD1 1 ATOM 10552 O OD2 . ASP B 2 548 ? -3.761 4.511 3.841 1.00 111.17 ? 529 ASP B OD2 1 ATOM 10553 N N . VAL B 2 549 ? -2.139 2.377 5.597 1.00 88.11 ? 530 VAL B N 1 ATOM 10554 C CA . VAL B 2 549 ? -1.148 1.443 5.070 1.00 74.66 ? 530 VAL B CA 1 ATOM 10555 C C . VAL B 2 549 ? 0.212 1.625 5.748 1.00 72.53 ? 530 VAL B C 1 ATOM 10556 O O . VAL B 2 549 ? 0.769 2.720 5.756 1.00 90.84 ? 530 VAL B O 1 ATOM 10557 C CB . VAL B 2 549 ? -0.996 1.574 3.539 1.00 60.15 ? 530 VAL B CB 1 ATOM 10558 C CG1 . VAL B 2 549 ? -0.977 3.032 3.126 1.00 84.50 ? 530 VAL B CG1 1 ATOM 10559 C CG2 . VAL B 2 549 ? 0.260 0.867 3.062 1.00 63.09 ? 530 VAL B CG2 1 ATOM 10560 N N . ALA B 2 550 ? 0.733 0.545 6.322 1.00 59.72 ? 531 ALA B N 1 ATOM 10561 C CA . ALA B 2 550 ? 2.022 0.574 7.007 1.00 60.24 ? 531 ALA B CA 1 ATOM 10562 C C . ALA B 2 550 ? 3.064 -0.268 6.273 1.00 61.11 ? 531 ALA B C 1 ATOM 10563 O O . ALA B 2 550 ? 2.795 -1.411 5.887 1.00 54.13 ? 531 ALA B O 1 ATOM 10564 C CB . ALA B 2 550 ? 1.864 0.087 8.442 1.00 55.43 ? 531 ALA B CB 1 ATOM 10565 N N . PHE B 2 551 ? 4.251 0.299 6.077 1.00 61.12 ? 532 PHE B N 1 ATOM 10566 C CA . PHE B 2 551 ? 5.348 -0.432 5.443 1.00 67.25 ? 532 PHE B CA 1 ATOM 10567 C C . PHE B 2 551 ? 6.302 -0.939 6.509 1.00 68.18 ? 532 PHE B C 1 ATOM 10568 O O . PHE B 2 551 ? 7.130 -0.193 7.031 1.00 66.16 ? 532 PHE B O 1 ATOM 10569 C CB . PHE B 2 551 ? 6.073 0.442 4.421 1.00 64.95 ? 532 PHE B CB 1 ATOM 10570 C CG . PHE B 2 551 ? 5.173 0.976 3.351 1.00 67.68 ? 532 PHE B CG 1 ATOM 10571 C CD1 . PHE B 2 551 ? 4.833 0.194 2.263 1.00 58.61 ? 532 PHE B CD1 1 ATOM 10572 C CD2 . PHE B 2 551 ? 4.645 2.253 3.446 1.00 68.27 ? 532 PHE B CD2 1 ATOM 10573 C CE1 . PHE B 2 551 ? 3.994 0.679 1.284 1.00 62.49 ? 532 PHE B CE1 1 ATOM 10574 C CE2 . PHE B 2 551 ? 3.804 2.745 2.468 1.00 76.82 ? 532 PHE B CE2 1 ATOM 10575 C CZ . PHE B 2 551 ? 3.478 1.957 1.386 1.00 74.88 ? 532 PHE B CZ 1 ATOM 10576 N N . VAL B 2 552 ? 6.185 -2.222 6.823 1.00 80.04 ? 533 VAL B N 1 ATOM 10577 C CA . VAL B 2 552 ? 6.746 -2.742 8.059 1.00 73.88 ? 533 VAL B CA 1 ATOM 10578 C C . VAL B 2 552 ? 7.288 -4.175 7.880 1.00 59.90 ? 533 VAL B C 1 ATOM 10579 O O . VAL B 2 552 ? 7.372 -4.674 6.757 1.00 61.19 ? 533 VAL B O 1 ATOM 10580 C CB . VAL B 2 552 ? 5.684 -2.601 9.198 1.00 52.68 ? 533 VAL B CB 1 ATOM 10581 C CG1 . VAL B 2 552 ? 4.736 -3.794 9.243 1.00 48.98 ? 533 VAL B CG1 1 ATOM 10582 C CG2 . VAL B 2 552 ? 6.336 -2.340 10.535 1.00 58.98 ? 533 VAL B CG2 1 ATOM 10583 N N . LYS B 2 553 ? 7.686 -4.816 8.976 1.00 56.36 ? 534 LYS B N 1 ATOM 10584 C CA . LYS B 2 553 ? 8.252 -6.163 8.935 1.00 64.15 ? 534 LYS B CA 1 ATOM 10585 C C . LYS B 2 553 ? 7.156 -7.227 8.969 1.00 69.44 ? 534 LYS B C 1 ATOM 10586 O O . LYS B 2 553 ? 6.058 -6.978 9.464 1.00 82.97 ? 534 LYS B O 1 ATOM 10587 C CB . LYS B 2 553 ? 9.203 -6.356 10.117 1.00 73.70 ? 534 LYS B CB 1 ATOM 10588 C CG . LYS B 2 553 ? 10.611 -6.776 9.740 1.00 72.34 ? 534 LYS B CG 1 ATOM 10589 C CD . LYS B 2 553 ? 11.540 -6.754 10.953 1.00 72.06 ? 534 LYS B CD 1 ATOM 10590 C CE . LYS B 2 553 ? 10.945 -7.498 12.143 1.00 69.66 ? 534 LYS B CE 1 ATOM 10591 N NZ . LYS B 2 553 ? 11.930 -7.682 13.246 1.00 61.94 ? 534 LYS B NZ 1 ATOM 10592 N N . HIS B 2 554 ? 7.456 -8.417 8.455 1.00 59.57 ? 535 HIS B N 1 ATOM 10593 C CA . HIS B 2 554 ? 6.465 -9.497 8.396 1.00 65.11 ? 535 HIS B CA 1 ATOM 10594 C C . HIS B 2 554 ? 6.187 -10.162 9.752 1.00 66.42 ? 535 HIS B C 1 ATOM 10595 O O . HIS B 2 554 ? 5.294 -10.997 9.861 1.00 65.95 ? 535 HIS B O 1 ATOM 10596 C CB . HIS B 2 554 ? 6.861 -10.557 7.358 1.00 60.83 ? 535 HIS B CB 1 ATOM 10597 C CG . HIS B 2 554 ? 7.769 -11.621 7.892 1.00 57.80 ? 535 HIS B CG 1 ATOM 10598 N ND1 . HIS B 2 554 ? 9.142 -11.494 7.902 1.00 56.83 ? 535 HIS B ND1 1 ATOM 10599 C CD2 . HIS B 2 554 ? 7.499 -12.832 8.434 1.00 58.67 ? 535 HIS B CD2 1 ATOM 10600 C CE1 . HIS B 2 554 ? 9.678 -12.579 8.431 1.00 55.52 ? 535 HIS B CE1 1 ATOM 10601 N NE2 . HIS B 2 554 ? 8.703 -13.406 8.763 1.00 53.71 ? 535 HIS B NE2 1 ATOM 10602 N N . GLN B 2 555 ? 6.954 -9.800 10.776 1.00 58.49 ? 536 GLN B N 1 ATOM 10603 C CA . GLN B 2 555 ? 6.687 -10.281 12.128 1.00 48.37 ? 536 GLN B CA 1 ATOM 10604 C C . GLN B 2 555 ? 5.919 -9.236 12.919 1.00 53.92 ? 536 GLN B C 1 ATOM 10605 O O . GLN B 2 555 ? 5.337 -9.539 13.960 1.00 49.71 ? 536 GLN B O 1 ATOM 10606 C CB . GLN B 2 555 ? 7.988 -10.588 12.874 1.00 52.91 ? 536 GLN B CB 1 ATOM 10607 C CG . GLN B 2 555 ? 8.904 -11.586 12.189 1.00 67.77 ? 536 GLN B CG 1 ATOM 10608 C CD . GLN B 2 555 ? 9.947 -10.911 11.328 1.00 68.24 ? 536 GLN B CD 1 ATOM 10609 O OE1 . GLN B 2 555 ? 9.647 -9.968 10.596 1.00 71.69 ? 536 GLN B OE1 1 ATOM 10610 N NE2 . GLN B 2 555 ? 11.185 -11.382 11.419 1.00 57.19 ? 536 GLN B NE2 1 ATOM 10611 N N . THR B 2 556 ? 5.940 -8.002 12.422 1.00 57.84 ? 537 THR B N 1 ATOM 10612 C CA . THR B 2 556 ? 5.403 -6.856 13.147 1.00 53.98 ? 537 THR B CA 1 ATOM 10613 C C . THR B 2 556 ? 3.969 -7.042 13.623 1.00 59.41 ? 537 THR B C 1 ATOM 10614 O O . THR B 2 556 ? 3.676 -6.840 14.800 1.00 65.82 ? 537 THR B O 1 ATOM 10615 C CB . THR B 2 556 ? 5.478 -5.584 12.298 1.00 61.17 ? 537 THR B CB 1 ATOM 10616 O OG1 . THR B 2 556 ? 6.850 -5.284 12.016 1.00 50.03 ? 537 THR B OG1 1 ATOM 10617 C CG2 . THR B 2 556 ? 4.820 -4.408 13.026 1.00 48.70 ? 537 THR B CG2 1 ATOM 10618 N N . VAL B 2 557 ? 3.078 -7.429 12.714 1.00 52.26 ? 538 VAL B N 1 ATOM 10619 C CA . VAL B 2 557 ? 1.669 -7.583 13.073 1.00 53.32 ? 538 VAL B CA 1 ATOM 10620 C C . VAL B 2 557 ? 1.404 -8.692 14.109 1.00 65.01 ? 538 VAL B C 1 ATOM 10621 O O . VAL B 2 557 ? 0.683 -8.464 15.080 1.00 79.08 ? 538 VAL B O 1 ATOM 10622 C CB . VAL B 2 557 ? 0.756 -7.722 11.835 1.00 49.63 ? 538 VAL B CB 1 ATOM 10623 C CG1 . VAL B 2 557 ? -0.677 -7.963 12.258 1.00 47.91 ? 538 VAL B CG1 1 ATOM 10624 C CG2 . VAL B 2 557 ? 0.851 -6.478 10.976 1.00 52.60 ? 538 VAL B CG2 1 ATOM 10625 N N . PRO B 2 558 ? 1.986 -9.890 13.921 1.00 63.15 ? 539 PRO B N 1 ATOM 10626 C CA . PRO B 2 558 ? 1.826 -10.846 15.025 1.00 71.02 ? 539 PRO B CA 1 ATOM 10627 C C . PRO B 2 558 ? 2.537 -10.412 16.312 1.00 67.54 ? 539 PRO B C 1 ATOM 10628 O O . PRO B 2 558 ? 2.086 -10.782 17.394 1.00 64.32 ? 539 PRO B O 1 ATOM 10629 C CB . PRO B 2 558 ? 2.437 -12.145 14.476 1.00 69.63 ? 539 PRO B CB 1 ATOM 10630 C CG . PRO B 2 558 ? 3.236 -11.744 13.290 1.00 74.66 ? 539 PRO B CG 1 ATOM 10631 C CD . PRO B 2 558 ? 2.581 -10.520 12.729 1.00 66.93 ? 539 PRO B CD 1 ATOM 10632 N N . GLN B 2 559 ? 3.613 -9.636 16.198 1.00 55.53 ? 540 GLN B N 1 ATOM 10633 C CA . GLN B 2 559 ? 4.337 -9.152 17.375 1.00 58.58 ? 540 GLN B CA 1 ATOM 10634 C C . GLN B 2 559 ? 3.476 -8.277 18.278 1.00 62.39 ? 540 GLN B C 1 ATOM 10635 O O . GLN B 2 559 ? 3.711 -8.204 19.483 1.00 69.91 ? 540 GLN B O 1 ATOM 10636 C CB . GLN B 2 559 ? 5.579 -8.361 16.965 1.00 57.48 ? 540 GLN B CB 1 ATOM 10637 C CG . GLN B 2 559 ? 6.883 -9.126 17.055 1.00 61.18 ? 540 GLN B CG 1 ATOM 10638 C CD . GLN B 2 559 ? 8.049 -8.317 16.529 1.00 72.52 ? 540 GLN B CD 1 ATOM 10639 O OE1 . GLN B 2 559 ? 7.901 -7.142 16.195 1.00 83.61 ? 540 GLN B OE1 1 ATOM 10640 N NE2 . GLN B 2 559 ? 9.216 -8.943 16.446 1.00 77.61 ? 540 GLN B NE2 1 ATOM 10641 N N . ASN B 2 560 ? 2.486 -7.612 17.695 1.00 51.89 ? 541 ASN B N 1 ATOM 10642 C CA . ASN B 2 560 ? 1.702 -6.631 18.435 1.00 58.52 ? 541 ASN B CA 1 ATOM 10643 C C . ASN B 2 560 ? 0.223 -6.973 18.510 1.00 67.42 ? 541 ASN B C 1 ATOM 10644 O O . ASN B 2 560 ? -0.609 -6.099 18.758 1.00 65.99 ? 541 ASN B O 1 ATOM 10645 C CB . ASN B 2 560 ? 1.886 -5.237 17.828 1.00 65.33 ? 541 ASN B CB 1 ATOM 10646 C CG . ASN B 2 560 ? 3.335 -4.792 17.823 1.00 65.40 ? 541 ASN B CG 1 ATOM 10647 O OD1 . ASN B 2 560 ? 3.844 -4.291 18.823 1.00 63.91 ? 541 ASN B OD1 1 ATOM 10648 N ND2 . ASN B 2 560 ? 4.009 -4.976 16.695 1.00 67.35 ? 541 ASN B ND2 1 ATOM 10649 N N . THR B 2 561 ? -0.105 -8.242 18.288 1.00 63.48 ? 542 THR B N 1 ATOM 10650 C CA . THR B 2 561 ? -1.481 -8.710 18.437 1.00 67.86 ? 542 THR B CA 1 ATOM 10651 C C . THR B 2 561 ? -1.559 -9.898 19.397 1.00 63.00 ? 542 THR B C 1 ATOM 10652 O O . THR B 2 561 ? -0.538 -10.476 19.769 1.00 65.60 ? 542 THR B O 1 ATOM 10653 C CB . THR B 2 561 ? -2.121 -9.085 17.077 1.00 69.62 ? 542 THR B CB 1 ATOM 10654 O OG1 . THR B 2 561 ? -1.297 -10.041 16.400 1.00 68.68 ? 542 THR B OG1 1 ATOM 10655 C CG2 . THR B 2 561 ? -2.290 -7.849 16.198 1.00 56.04 ? 542 THR B CG2 1 ATOM 10656 N N . GLY B 2 562 ? -2.774 -10.241 19.813 1.00 66.30 ? 543 GLY B N 1 ATOM 10657 C CA . GLY B 2 562 ? -2.995 -11.390 20.675 1.00 76.34 ? 543 GLY B CA 1 ATOM 10658 C C . GLY B 2 562 ? -2.696 -11.148 22.143 1.00 86.21 ? 543 GLY B C 1 ATOM 10659 O O . GLY B 2 562 ? -3.079 -11.944 23.002 1.00 74.24 ? 543 GLY B O 1 ATOM 10660 N N . GLY B 2 563 ? -2.006 -10.049 22.433 1.00 91.68 ? 544 GLY B N 1 ATOM 10661 C CA . GLY B 2 563 ? -1.668 -9.703 23.799 1.00 84.01 ? 544 GLY B CA 1 ATOM 10662 C C . GLY B 2 563 ? -0.174 -9.609 24.037 1.00 87.94 ? 544 GLY B C 1 ATOM 10663 O O . GLY B 2 563 ? 0.259 -9.232 25.125 1.00 97.67 ? 544 GLY B O 1 ATOM 10664 N N . LYS B 2 564 ? 0.616 -9.951 23.022 1.00 80.64 ? 545 LYS B N 1 ATOM 10665 C CA . LYS B 2 564 ? 2.071 -9.875 23.126 1.00 83.14 ? 545 LYS B CA 1 ATOM 10666 C C . LYS B 2 564 ? 2.509 -8.447 23.429 1.00 80.48 ? 545 LYS B C 1 ATOM 10667 O O . LYS B 2 564 ? 3.521 -8.221 24.091 1.00 73.44 ? 545 LYS B O 1 ATOM 10668 C CB . LYS B 2 564 ? 2.728 -10.367 21.837 1.00 86.95 ? 545 LYS B CB 1 ATOM 10669 C CG . LYS B 2 564 ? 2.236 -11.726 21.385 1.00 92.02 ? 545 LYS B CG 1 ATOM 10670 C CD . LYS B 2 564 ? 2.878 -12.140 20.075 1.00 88.07 ? 545 LYS B CD 1 ATOM 10671 C CE . LYS B 2 564 ? 2.129 -13.302 19.449 1.00 79.39 ? 545 LYS B CE 1 ATOM 10672 N NZ . LYS B 2 564 ? 0.657 -13.064 19.442 1.00 77.36 ? 545 LYS B NZ 1 ATOM 10673 N N . ASN B 2 565 ? 1.735 -7.489 22.931 1.00 80.50 ? 546 ASN B N 1 ATOM 10674 C CA . ASN B 2 565 ? 1.920 -6.087 23.268 1.00 82.80 ? 546 ASN B CA 1 ATOM 10675 C C . ASN B 2 565 ? 0.872 -5.684 24.304 1.00 88.24 ? 546 ASN B C 1 ATOM 10676 O O . ASN B 2 565 ? -0.260 -5.358 23.952 1.00 101.72 ? 546 ASN B O 1 ATOM 10677 C CB . ASN B 2 565 ? 1.795 -5.228 22.010 1.00 84.86 ? 546 ASN B CB 1 ATOM 10678 C CG . ASN B 2 565 ? 2.260 -3.804 22.225 1.00 87.64 ? 546 ASN B CG 1 ATOM 10679 O OD1 . ASN B 2 565 ? 1.500 -2.953 22.679 1.00 99.94 ? 546 ASN B OD1 1 ATOM 10680 N ND2 . ASN B 2 565 ? 3.515 -3.536 21.890 1.00 80.49 ? 546 ASN B ND2 1 ATOM 10681 N N . PRO B 2 566 ? 1.249 -5.710 25.592 1.00 88.04 ? 547 PRO B N 1 ATOM 10682 C CA . PRO B 2 566 ? 0.303 -5.569 26.707 1.00 86.65 ? 547 PRO B CA 1 ATOM 10683 C C . PRO B 2 566 ? -0.268 -4.164 26.848 1.00 93.24 ? 547 PRO B C 1 ATOM 10684 O O . PRO B 2 566 ? -1.208 -3.969 27.618 1.00 97.09 ? 547 PRO B O 1 ATOM 10685 C CB . PRO B 2 566 ? 1.159 -5.909 27.926 1.00 80.12 ? 547 PRO B CB 1 ATOM 10686 C CG . PRO B 2 566 ? 2.530 -5.501 27.532 1.00 86.42 ? 547 PRO B CG 1 ATOM 10687 C CD . PRO B 2 566 ? 2.642 -5.808 26.062 1.00 89.09 ? 547 PRO B CD 1 ATOM 10688 N N . ASP B 2 567 ? 0.296 -3.207 26.118 1.00 98.29 ? 548 ASP B N 1 ATOM 10689 C CA . ASP B 2 567 ? -0.181 -1.827 26.141 1.00 92.84 ? 548 ASP B CA 1 ATOM 10690 C C . ASP B 2 567 ? -1.652 -1.764 25.722 1.00 92.68 ? 548 ASP B C 1 ATOM 10691 O O . ASP B 2 567 ? -2.135 -2.662 25.033 1.00 85.48 ? 548 ASP B O 1 ATOM 10692 C CB . ASP B 2 567 ? 0.697 -0.957 25.236 1.00 83.92 ? 548 ASP B CB 1 ATOM 10693 C CG . ASP B 2 567 ? 2.133 -0.884 25.719 1.00 84.43 ? 548 ASP B CG 1 ATOM 10694 O OD1 . ASP B 2 567 ? 3.053 -1.018 24.886 1.00 88.15 ? 548 ASP B OD1 1 ATOM 10695 O OD2 . ASP B 2 567 ? 2.344 -0.696 26.935 1.00 84.44 ? 548 ASP B OD2 1 ATOM 10696 N N . PRO B 2 568 ? -2.373 -0.713 26.153 1.00 95.51 ? 549 PRO B N 1 ATOM 10697 C CA . PRO B 2 568 ? -3.820 -0.641 25.910 1.00 93.77 ? 549 PRO B CA 1 ATOM 10698 C C . PRO B 2 568 ? -4.217 -0.555 24.434 1.00 98.64 ? 549 PRO B C 1 ATOM 10699 O O . PRO B 2 568 ? -5.227 -1.144 24.048 1.00 91.96 ? 549 PRO B O 1 ATOM 10700 C CB . PRO B 2 568 ? -4.236 0.639 26.649 1.00 88.36 ? 549 PRO B CB 1 ATOM 10701 C CG . PRO B 2 568 ? -2.982 1.446 26.747 1.00 92.43 ? 549 PRO B CG 1 ATOM 10702 C CD . PRO B 2 568 ? -1.894 0.440 26.936 1.00 98.01 ? 549 PRO B CD 1 ATOM 10703 N N . TRP B 2 569 ? -3.437 0.155 23.624 1.00 104.46 ? 550 TRP B N 1 ATOM 10704 C CA . TRP B 2 569 ? -3.796 0.367 22.222 1.00 104.51 ? 550 TRP B CA 1 ATOM 10705 C C . TRP B 2 569 ? -3.742 -0.917 21.396 1.00 99.64 ? 550 TRP B C 1 ATOM 10706 O O . TRP B 2 569 ? -4.301 -0.977 20.302 1.00 96.34 ? 550 TRP B O 1 ATOM 10707 C CB . TRP B 2 569 ? -2.906 1.441 21.580 1.00 97.80 ? 550 TRP B CB 1 ATOM 10708 C CG . TRP B 2 569 ? -1.484 1.007 21.340 1.00 85.38 ? 550 TRP B CG 1 ATOM 10709 C CD1 . TRP B 2 569 ? -0.415 1.210 22.164 1.00 82.08 ? 550 TRP B CD1 1 ATOM 10710 C CD2 . TRP B 2 569 ? -0.978 0.304 20.196 1.00 76.56 ? 550 TRP B CD2 1 ATOM 10711 N NE1 . TRP B 2 569 ? 0.721 0.676 21.607 1.00 82.53 ? 550 TRP B NE1 1 ATOM 10712 C CE2 . TRP B 2 569 ? 0.402 0.112 20.400 1.00 79.40 ? 550 TRP B CE2 1 ATOM 10713 C CE3 . TRP B 2 569 ? -1.559 -0.183 19.021 1.00 72.11 ? 550 TRP B CE3 1 ATOM 10714 C CZ2 . TRP B 2 569 ? 1.209 -0.548 19.475 1.00 75.45 ? 550 TRP B CZ2 1 ATOM 10715 C CZ3 . TRP B 2 569 ? -0.757 -0.838 18.106 1.00 75.25 ? 550 TRP B CZ3 1 ATOM 10716 C CH2 . TRP B 2 569 ? 0.612 -1.013 18.337 1.00 73.32 ? 550 TRP B CH2 1 ATOM 10717 N N . ALA B 2 570 ? -3.075 -1.940 21.922 1.00 91.31 ? 551 ALA B N 1 ATOM 10718 C CA . ALA B 2 570 ? -2.814 -3.151 21.154 1.00 87.73 ? 551 ALA B CA 1 ATOM 10719 C C . ALA B 2 570 ? -3.262 -4.431 21.854 1.00 102.62 ? 551 ALA B C 1 ATOM 10720 O O . ALA B 2 570 ? -3.106 -5.524 21.310 1.00 105.75 ? 551 ALA B O 1 ATOM 10721 C CB . ALA B 2 570 ? -1.332 -3.236 20.802 1.00 77.19 ? 551 ALA B CB 1 ATOM 10722 N N . LYS B 2 571 ? -3.820 -4.294 23.053 1.00 114.63 ? 552 LYS B N 1 ATOM 10723 C CA . LYS B 2 571 ? -4.174 -5.452 23.873 1.00 115.93 ? 552 LYS B CA 1 ATOM 10724 C C . LYS B 2 571 ? -5.201 -6.377 23.216 1.00 112.00 ? 552 LYS B C 1 ATOM 10725 O O . LYS B 2 571 ? -5.050 -7.599 23.247 1.00 112.44 ? 552 LYS B O 1 ATOM 10726 C CB . LYS B 2 571 ? -4.672 -5.006 25.252 1.00 115.54 ? 552 LYS B CB 1 ATOM 10727 N N . ASN B 2 572 ? -6.236 -5.793 22.618 1.00 99.68 ? 553 ASN B N 1 ATOM 10728 C CA . ASN B 2 572 ? -7.335 -6.576 22.056 1.00 90.38 ? 553 ASN B CA 1 ATOM 10729 C C . ASN B 2 572 ? -7.242 -6.791 20.544 1.00 85.81 ? 553 ASN B C 1 ATOM 10730 O O . ASN B 2 572 ? -8.140 -7.375 19.932 1.00 75.76 ? 553 ASN B O 1 ATOM 10731 C CB . ASN B 2 572 ? -8.677 -5.932 22.408 1.00 93.45 ? 553 ASN B CB 1 ATOM 10732 C CG . ASN B 2 572 ? -8.857 -5.741 23.897 1.00 97.06 ? 553 ASN B CG 1 ATOM 10733 O OD1 . ASN B 2 572 ? -8.230 -6.429 24.703 1.00 89.68 ? 553 ASN B OD1 1 ATOM 10734 N ND2 . ASN B 2 572 ? -9.718 -4.803 24.273 1.00 104.38 ? 553 ASN B ND2 1 ATOM 10735 N N . LEU B 2 573 ? -6.155 -6.320 19.947 1.00 79.93 ? 554 LEU B N 1 ATOM 10736 C CA . LEU B 2 573 ? -5.962 -6.457 18.511 1.00 66.15 ? 554 LEU B CA 1 ATOM 10737 C C . LEU B 2 573 ? -5.778 -7.921 18.098 1.00 67.99 ? 554 LEU B C 1 ATOM 10738 O O . LEU B 2 573 ? -5.232 -8.729 18.850 1.00 61.73 ? 554 LEU B O 1 ATOM 10739 C CB . LEU B 2 573 ? -4.773 -5.612 18.045 1.00 61.87 ? 554 LEU B CB 1 ATOM 10740 C CG . LEU B 2 573 ? -4.864 -4.100 18.270 1.00 65.94 ? 554 LEU B CG 1 ATOM 10741 C CD1 . LEU B 2 573 ? -3.705 -3.388 17.586 1.00 65.16 ? 554 LEU B CD1 1 ATOM 10742 C CD2 . LEU B 2 573 ? -6.204 -3.534 17.797 1.00 58.75 ? 554 LEU B CD2 1 ATOM 10743 N N . ASN B 2 574 ? -6.243 -8.244 16.895 1.00 68.81 ? 555 ASN B N 1 ATOM 10744 C CA . ASN B 2 574 ? -6.147 -9.588 16.344 1.00 66.00 ? 555 ASN B CA 1 ATOM 10745 C C . ASN B 2 574 ? -5.413 -9.535 15.008 1.00 61.86 ? 555 ASN B C 1 ATOM 10746 O O . ASN B 2 574 ? -5.727 -8.705 14.158 1.00 63.82 ? 555 ASN B O 1 ATOM 10747 C CB . ASN B 2 574 ? -7.551 -10.171 16.158 1.00 70.75 ? 555 ASN B CB 1 ATOM 10748 C CG . ASN B 2 574 ? -7.548 -11.676 15.973 1.00 75.41 ? 555 ASN B CG 1 ATOM 10749 O OD1 . ASN B 2 574 ? -6.641 -12.243 15.365 1.00 87.75 ? 555 ASN B OD1 1 ATOM 10750 N ND2 . ASN B 2 574 ? -8.574 -12.331 16.498 1.00 71.34 ? 555 ASN B ND2 1 ATOM 10751 N N . GLU B 2 575 ? -4.432 -10.414 14.828 1.00 66.31 ? 556 GLU B N 1 ATOM 10752 C CA . GLU B 2 575 ? -3.634 -10.423 13.601 1.00 64.11 ? 556 GLU B CA 1 ATOM 10753 C C . GLU B 2 575 ? -4.470 -10.683 12.344 1.00 66.07 ? 556 GLU B C 1 ATOM 10754 O O . GLU B 2 575 ? -4.156 -10.176 11.267 1.00 62.46 ? 556 GLU B O 1 ATOM 10755 C CB . GLU B 2 575 ? -2.497 -11.445 13.697 1.00 54.05 ? 556 GLU B CB 1 ATOM 10756 C CG . GLU B 2 575 ? -2.951 -12.880 13.907 1.00 71.36 ? 556 GLU B CG 1 ATOM 10757 C CD . GLU B 2 575 ? -1.801 -13.869 13.870 1.00 94.06 ? 556 GLU B CD 1 ATOM 10758 O OE1 . GLU B 2 575 ? -0.693 -13.476 13.449 1.00 102.92 ? 556 GLU B OE1 1 ATOM 10759 O OE2 . GLU B 2 575 ? -2.003 -15.039 14.262 1.00 101.11 ? 556 GLU B OE2 1 ATOM 10760 N N . LYS B 2 576 ? -5.539 -11.461 12.489 1.00 68.87 ? 557 LYS B N 1 ATOM 10761 C CA . LYS B 2 576 ? -6.362 -11.857 11.349 1.00 61.95 ? 557 LYS B CA 1 ATOM 10762 C C . LYS B 2 576 ? -7.292 -10.741 10.883 1.00 53.68 ? 557 LYS B C 1 ATOM 10763 O O . LYS B 2 576 ? -8.126 -10.940 10.003 1.00 49.47 ? 557 LYS B O 1 ATOM 10764 C CB . LYS B 2 576 ? -7.162 -13.123 11.671 1.00 60.40 ? 557 LYS B CB 1 ATOM 10765 C CG . LYS B 2 576 ? -6.295 -14.348 11.932 1.00 67.77 ? 557 LYS B CG 1 ATOM 10766 C CD . LYS B 2 576 ? -7.137 -15.578 12.232 1.00 71.55 ? 557 LYS B CD 1 ATOM 10767 C CE . LYS B 2 576 ? -6.267 -16.773 12.599 1.00 73.67 ? 557 LYS B CE 1 ATOM 10768 N NZ . LYS B 2 576 ? -5.380 -17.186 11.477 1.00 68.98 ? 557 LYS B NZ 1 ATOM 10769 N N . ASP B 2 577 ? -7.147 -9.566 11.478 1.00 52.63 ? 558 ASP B N 1 ATOM 10770 C CA . ASP B 2 577 ? -7.903 -8.404 11.042 1.00 54.50 ? 558 ASP B CA 1 ATOM 10771 C C . ASP B 2 577 ? -7.150 -7.676 9.938 1.00 54.12 ? 558 ASP B C 1 ATOM 10772 O O . ASP B 2 577 ? -7.623 -6.675 9.406 1.00 66.43 ? 558 ASP B O 1 ATOM 10773 C CB . ASP B 2 577 ? -8.153 -7.457 12.218 1.00 56.18 ? 558 ASP B CB 1 ATOM 10774 C CG . ASP B 2 577 ? -9.255 -7.945 13.137 1.00 66.89 ? 558 ASP B CG 1 ATOM 10775 O OD1 . ASP B 2 577 ? -10.222 -8.552 12.628 1.00 53.76 ? 558 ASP B OD1 1 ATOM 10776 O OD2 . ASP B 2 577 ? -9.156 -7.718 14.364 1.00 71.03 ? 558 ASP B OD2 1 ATOM 10777 N N . TYR B 2 578 ? -5.978 -8.190 9.587 1.00 50.47 ? 559 TYR B N 1 ATOM 10778 C CA . TYR B 2 578 ? -5.084 -7.474 8.690 1.00 54.09 ? 559 TYR B CA 1 ATOM 10779 C C . TYR B 2 578 ? -4.621 -8.336 7.519 1.00 54.18 ? 559 TYR B C 1 ATOM 10780 O O . TYR B 2 578 ? -4.418 -9.538 7.664 1.00 67.15 ? 559 TYR B O 1 ATOM 10781 C CB . TYR B 2 578 ? -3.885 -6.929 9.477 1.00 53.32 ? 559 TYR B CB 1 ATOM 10782 C CG . TYR B 2 578 ? -4.299 -6.087 10.661 1.00 65.31 ? 559 TYR B CG 1 ATOM 10783 C CD1 . TYR B 2 578 ? -4.527 -6.662 11.903 1.00 63.35 ? 559 TYR B CD1 1 ATOM 10784 C CD2 . TYR B 2 578 ? -4.485 -4.719 10.530 1.00 80.94 ? 559 TYR B CD2 1 ATOM 10785 C CE1 . TYR B 2 578 ? -4.921 -5.896 12.982 1.00 60.21 ? 559 TYR B CE1 1 ATOM 10786 C CE2 . TYR B 2 578 ? -4.877 -3.945 11.606 1.00 77.62 ? 559 TYR B CE2 1 ATOM 10787 C CZ . TYR B 2 578 ? -5.093 -4.539 12.827 1.00 62.79 ? 559 TYR B CZ 1 ATOM 10788 O OH . TYR B 2 578 ? -5.485 -3.769 13.894 1.00 63.04 ? 559 TYR B OH 1 ATOM 10789 N N . GLU B 2 579 ? -4.478 -7.714 6.354 1.00 54.82 ? 560 GLU B N 1 ATOM 10790 C CA . GLU B 2 579 ? -3.939 -8.402 5.190 1.00 62.39 ? 560 GLU B CA 1 ATOM 10791 C C . GLU B 2 579 ? -2.738 -7.657 4.617 1.00 61.59 ? 560 GLU B C 1 ATOM 10792 O O . GLU B 2 579 ? -2.303 -6.642 5.162 1.00 55.19 ? 560 GLU B O 1 ATOM 10793 C CB . GLU B 2 579 ? -5.018 -8.649 4.124 1.00 62.38 ? 560 GLU B CB 1 ATOM 10794 C CG . GLU B 2 579 ? -5.919 -7.461 3.826 1.00 65.55 ? 560 GLU B CG 1 ATOM 10795 C CD . GLU B 2 579 ? -7.063 -7.811 2.881 1.00 67.64 ? 560 GLU B CD 1 ATOM 10796 O OE1 . GLU B 2 579 ? -7.111 -8.959 2.392 1.00 65.78 ? 560 GLU B OE1 1 ATOM 10797 O OE2 . GLU B 2 579 ? -7.918 -6.937 2.629 1.00 71.76 ? 560 GLU B OE2 1 ATOM 10798 N N . LEU B 2 580 ? -2.198 -8.180 3.521 1.00 66.86 ? 561 LEU B N 1 ATOM 10799 C CA . LEU B 2 580 ? -0.980 -7.640 2.934 1.00 48.86 ? 561 LEU B CA 1 ATOM 10800 C C . LEU B 2 580 ? -1.199 -7.238 1.486 1.00 59.55 ? 561 LEU B C 1 ATOM 10801 O O . LEU B 2 580 ? -1.977 -7.865 0.765 1.00 52.68 ? 561 LEU B O 1 ATOM 10802 C CB . LEU B 2 580 ? 0.148 -8.669 3.013 1.00 47.29 ? 561 LEU B CB 1 ATOM 10803 C CG . LEU B 2 580 ? 0.629 -9.078 4.407 1.00 64.98 ? 561 LEU B CG 1 ATOM 10804 C CD1 . LEU B 2 580 ? 1.663 -10.197 4.305 1.00 44.86 ? 561 LEU B CD1 1 ATOM 10805 C CD2 . LEU B 2 580 ? 1.191 -7.875 5.162 1.00 46.91 ? 561 LEU B CD2 1 ATOM 10806 N N . LEU B 2 581 ? -0.509 -6.184 1.067 1.00 63.47 ? 562 LEU B N 1 ATOM 10807 C CA . LEU B 2 581 ? -0.570 -5.728 -0.312 1.00 58.68 ? 562 LEU B CA 1 ATOM 10808 C C . LEU B 2 581 ? 0.485 -6.448 -1.128 1.00 56.48 ? 562 LEU B C 1 ATOM 10809 O O . LEU B 2 581 ? 1.656 -6.464 -0.758 1.00 67.79 ? 562 LEU B O 1 ATOM 10810 C CB . LEU B 2 581 ? -0.347 -4.221 -0.388 1.00 53.75 ? 562 LEU B CB 1 ATOM 10811 C CG . LEU B 2 581 ? -1.423 -3.381 0.293 1.00 61.75 ? 562 LEU B CG 1 ATOM 10812 C CD1 . LEU B 2 581 ? -1.121 -1.898 0.154 1.00 67.86 ? 562 LEU B CD1 1 ATOM 10813 C CD2 . LEU B 2 581 ? -2.780 -3.716 -0.292 1.00 60.83 ? 562 LEU B CD2 1 ATOM 10814 N N . CYS B 2 582 ? 0.066 -7.054 -2.232 1.00 51.58 ? 563 CYS B N 1 ATOM 10815 C CA . CYS B 2 582 ? 0.993 -7.777 -3.099 1.00 61.15 ? 563 CYS B CA 1 ATOM 10816 C C . CYS B 2 582 ? 1.352 -6.936 -4.319 1.00 61.31 ? 563 CYS B C 1 ATOM 10817 O O . CYS B 2 582 ? 0.596 -6.050 -4.723 1.00 61.55 ? 563 CYS B O 1 ATOM 10818 C CB . CYS B 2 582 ? 0.405 -9.123 -3.541 1.00 53.63 ? 563 CYS B CB 1 ATOM 10819 S SG . CYS B 2 582 ? -0.213 -10.165 -2.196 1.00 75.79 ? 563 CYS B SG 1 ATOM 10820 N N . LEU B 2 583 ? 2.507 -7.227 -4.905 1.00 56.99 ? 564 LEU B N 1 ATOM 10821 C CA . LEU B 2 583 ? 3.001 -6.467 -6.045 1.00 57.64 ? 564 LEU B CA 1 ATOM 10822 C C . LEU B 2 583 ? 2.166 -6.674 -7.307 1.00 60.15 ? 564 LEU B C 1 ATOM 10823 O O . LEU B 2 583 ? 2.294 -5.918 -8.269 1.00 72.90 ? 564 LEU B O 1 ATOM 10824 C CB . LEU B 2 583 ? 4.468 -6.805 -6.309 1.00 53.40 ? 564 LEU B CB 1 ATOM 10825 C CG . LEU B 2 583 ? 5.443 -6.316 -5.238 1.00 56.22 ? 564 LEU B CG 1 ATOM 10826 C CD1 . LEU B 2 583 ? 6.856 -6.766 -5.559 1.00 55.73 ? 564 LEU B CD1 1 ATOM 10827 C CD2 . LEU B 2 583 ? 5.375 -4.795 -5.102 1.00 54.16 ? 564 LEU B CD2 1 ATOM 10828 N N . ASP B 2 584 ? 1.309 -7.691 -7.298 1.00 56.41 ? 565 ASP B N 1 ATOM 10829 C CA . ASP B 2 584 ? 0.443 -7.967 -8.440 1.00 63.92 ? 565 ASP B CA 1 ATOM 10830 C C . ASP B 2 584 ? -0.952 -7.369 -8.251 1.00 61.52 ? 565 ASP B C 1 ATOM 10831 O O . ASP B 2 584 ? -1.888 -7.700 -8.982 1.00 65.02 ? 565 ASP B O 1 ATOM 10832 C CB . ASP B 2 584 ? 0.353 -9.473 -8.709 1.00 78.49 ? 565 ASP B CB 1 ATOM 10833 C CG . ASP B 2 584 ? -0.498 -10.205 -7.686 1.00 87.15 ? 565 ASP B CG 1 ATOM 10834 O OD1 . ASP B 2 584 ? -0.541 -9.773 -6.515 1.00 97.13 ? 565 ASP B OD1 1 ATOM 10835 O OD2 . ASP B 2 584 ? -1.125 -11.220 -8.055 1.00 78.47 ? 565 ASP B OD2 1 ATOM 10836 N N . GLY B 2 585 ? -1.084 -6.493 -7.260 1.00 56.89 ? 566 GLY B N 1 ATOM 10837 C CA . GLY B 2 585 ? -2.334 -5.793 -7.020 1.00 66.91 ? 566 GLY B CA 1 ATOM 10838 C C . GLY B 2 585 ? -3.344 -6.532 -6.162 1.00 63.50 ? 566 GLY B C 1 ATOM 10839 O O . GLY B 2 585 ? -4.465 -6.060 -5.981 1.00 61.77 ? 566 GLY B O 1 ATOM 10840 N N . THR B 2 586 ? -2.957 -7.684 -5.624 1.00 59.94 ? 567 THR B N 1 ATOM 10841 C CA . THR B 2 586 ? -3.885 -8.496 -4.843 1.00 53.99 ? 567 THR B CA 1 ATOM 10842 C C . THR B 2 586 ? -3.588 -8.407 -3.352 1.00 62.32 ? 567 THR B C 1 ATOM 10843 O O . THR B 2 586 ? -2.645 -7.734 -2.941 1.00 55.64 ? 567 THR B O 1 ATOM 10844 C CB . THR B 2 586 ? -3.838 -9.967 -5.275 1.00 52.95 ? 567 THR B CB 1 ATOM 10845 O OG1 . THR B 2 586 ? -2.636 -10.573 -4.792 1.00 65.00 ? 567 THR B OG1 1 ATOM 10846 C CG2 . THR B 2 586 ? -3.872 -10.072 -6.784 1.00 54.20 ? 567 THR B CG2 1 ATOM 10847 N N . ARG B 2 587 ? -4.398 -9.088 -2.546 1.00 66.84 ? 568 ARG B N 1 ATOM 10848 C CA . ARG B 2 587 ? -4.200 -9.094 -1.097 1.00 52.06 ? 568 ARG B CA 1 ATOM 10849 C C . ARG B 2 587 ? -4.194 -10.496 -0.486 1.00 51.78 ? 568 ARG B C 1 ATOM 10850 O O . ARG B 2 587 ? -4.962 -11.373 -0.884 1.00 55.01 ? 568 ARG B O 1 ATOM 10851 C CB . ARG B 2 587 ? -5.245 -8.218 -0.403 1.00 52.02 ? 568 ARG B CB 1 ATOM 10852 C CG . ARG B 2 587 ? -5.082 -6.725 -0.668 1.00 56.68 ? 568 ARG B CG 1 ATOM 10853 C CD . ARG B 2 587 ? -6.109 -5.917 0.106 1.00 56.23 ? 568 ARG B CD 1 ATOM 10854 N NE . ARG B 2 587 ? -7.449 -6.469 -0.062 1.00 54.98 ? 568 ARG B NE 1 ATOM 10855 C CZ . ARG B 2 587 ? -8.257 -6.168 -1.070 1.00 58.63 ? 568 ARG B CZ 1 ATOM 10856 N NH1 . ARG B 2 587 ? -7.864 -5.309 -1.999 1.00 59.66 ? 568 ARG B NH1 1 ATOM 10857 N NH2 . ARG B 2 587 ? -9.459 -6.722 -1.149 1.00 69.06 ? 568 ARG B NH2 1 ATOM 10858 N N . LYS B 2 588 ? -3.315 -10.692 0.491 1.00 64.61 ? 569 LYS B N 1 ATOM 10859 C CA . LYS B 2 588 ? -3.195 -11.965 1.196 1.00 54.71 ? 569 LYS B CA 1 ATOM 10860 C C . LYS B 2 588 ? -3.021 -11.710 2.694 1.00 59.24 ? 569 LYS B C 1 ATOM 10861 O O . LYS B 2 588 ? -2.591 -10.628 3.091 1.00 67.64 ? 569 LYS B O 1 ATOM 10862 C CB . LYS B 2 588 ? -2.021 -12.761 0.625 1.00 47.32 ? 569 LYS B CB 1 ATOM 10863 C CG . LYS B 2 588 ? -2.265 -13.246 -0.793 1.00 48.52 ? 569 LYS B CG 1 ATOM 10864 C CD . LYS B 2 588 ? -1.070 -13.970 -1.368 1.00 54.34 ? 569 LYS B CD 1 ATOM 10865 C CE . LYS B 2 588 ? -1.482 -14.774 -2.587 1.00 63.28 ? 569 LYS B CE 1 ATOM 10866 N NZ . LYS B 2 588 ? -2.231 -13.922 -3.554 1.00 76.74 ? 569 LYS B NZ 1 ATOM 10867 N N . PRO B 2 589 ? -3.378 -12.694 3.538 1.00 58.38 ? 570 PRO B N 1 ATOM 10868 C CA . PRO B 2 589 ? -3.275 -12.491 4.991 1.00 56.59 ? 570 PRO B CA 1 ATOM 10869 C C . PRO B 2 589 ? -1.829 -12.407 5.476 1.00 53.07 ? 570 PRO B C 1 ATOM 10870 O O . PRO B 2 589 ? -0.913 -12.772 4.740 1.00 48.09 ? 570 PRO B O 1 ATOM 10871 C CB . PRO B 2 589 ? -3.970 -13.728 5.570 1.00 51.31 ? 570 PRO B CB 1 ATOM 10872 C CG . PRO B 2 589 ? -3.867 -14.753 4.504 1.00 50.15 ? 570 PRO B CG 1 ATOM 10873 C CD . PRO B 2 589 ? -3.982 -13.995 3.209 1.00 55.36 ? 570 PRO B CD 1 ATOM 10874 N N . VAL B 2 590 ? -1.642 -11.947 6.710 1.00 49.82 ? 571 VAL B N 1 ATOM 10875 C CA . VAL B 2 590 ? -0.312 -11.642 7.239 1.00 53.00 ? 571 VAL B CA 1 ATOM 10876 C C . VAL B 2 590 ? 0.638 -12.836 7.338 1.00 53.84 ? 571 VAL B C 1 ATOM 10877 O O . VAL B 2 590 ? 1.852 -12.653 7.408 1.00 56.24 ? 571 VAL B O 1 ATOM 10878 C CB . VAL B 2 590 ? -0.391 -10.955 8.618 1.00 53.62 ? 571 VAL B CB 1 ATOM 10879 C CG1 . VAL B 2 590 ? -1.240 -9.704 8.530 1.00 64.19 ? 571 VAL B CG1 1 ATOM 10880 C CG2 . VAL B 2 590 ? -0.951 -11.908 9.661 1.00 59.92 ? 571 VAL B CG2 1 ATOM 10881 N N . GLU B 2 591 ? 0.093 -14.049 7.347 1.00 49.90 ? 572 GLU B N 1 ATOM 10882 C CA . GLU B 2 591 ? 0.930 -15.243 7.436 1.00 49.63 ? 572 GLU B CA 1 ATOM 10883 C C . GLU B 2 591 ? 1.354 -15.732 6.057 1.00 49.95 ? 572 GLU B C 1 ATOM 10884 O O . GLU B 2 591 ? 2.158 -16.657 5.938 1.00 57.54 ? 572 GLU B O 1 ATOM 10885 C CB . GLU B 2 591 ? 0.220 -16.367 8.196 1.00 55.47 ? 572 GLU B CB 1 ATOM 10886 C CG . GLU B 2 591 ? -0.859 -17.097 7.402 1.00 57.94 ? 572 GLU B CG 1 ATOM 10887 C CD . GLU B 2 591 ? -2.218 -16.423 7.482 1.00 60.99 ? 572 GLU B CD 1 ATOM 10888 O OE1 . GLU B 2 591 ? -2.291 -15.262 7.943 1.00 57.19 ? 572 GLU B OE1 1 ATOM 10889 O OE2 . GLU B 2 591 ? -3.215 -17.065 7.088 1.00 60.37 ? 572 GLU B OE2 1 ATOM 10890 N N . GLU B 2 592 ? 0.808 -15.108 5.019 1.00 49.12 ? 573 GLU B N 1 ATOM 10891 C CA . GLU B 2 592 ? 1.141 -15.475 3.647 1.00 54.34 ? 573 GLU B CA 1 ATOM 10892 C C . GLU B 2 592 ? 2.156 -14.502 3.039 1.00 58.36 ? 573 GLU B C 1 ATOM 10893 O O . GLU B 2 592 ? 2.106 -14.189 1.851 1.00 51.80 ? 573 GLU B O 1 ATOM 10894 C CB . GLU B 2 592 ? -0.126 -15.552 2.794 1.00 44.65 ? 573 GLU B CB 1 ATOM 10895 C CG . GLU B 2 592 ? -1.073 -16.667 3.203 1.00 46.36 ? 573 GLU B CG 1 ATOM 10896 C CD . GLU B 2 592 ? -0.552 -18.042 2.826 1.00 68.26 ? 573 GLU B CD 1 ATOM 10897 O OE1 . GLU B 2 592 ? 0.254 -18.136 1.878 1.00 84.36 ? 573 GLU B OE1 1 ATOM 10898 O OE2 . GLU B 2 592 ? -0.950 -19.033 3.476 1.00 70.26 ? 573 GLU B OE2 1 ATOM 10899 N N . TYR B 2 593 ? 3.083 -14.041 3.872 1.00 58.79 ? 574 TYR B N 1 ATOM 10900 C CA . TYR B 2 593 ? 4.106 -13.079 3.474 1.00 50.58 ? 574 TYR B CA 1 ATOM 10901 C C . TYR B 2 593 ? 5.029 -13.618 2.383 1.00 52.09 ? 574 TYR B C 1 ATOM 10902 O O . TYR B 2 593 ? 5.598 -12.862 1.603 1.00 63.55 ? 574 TYR B O 1 ATOM 10903 C CB . TYR B 2 593 ? 4.932 -12.671 4.698 1.00 45.07 ? 574 TYR B CB 1 ATOM 10904 C CG . TYR B 2 593 ? 5.350 -13.851 5.541 1.00 45.99 ? 574 TYR B CG 1 ATOM 10905 C CD1 . TYR B 2 593 ? 6.473 -14.598 5.216 1.00 55.52 ? 574 TYR B CD1 1 ATOM 10906 C CD2 . TYR B 2 593 ? 4.611 -14.231 6.648 1.00 43.23 ? 574 TYR B CD2 1 ATOM 10907 C CE1 . TYR B 2 593 ? 6.851 -15.686 5.972 1.00 63.08 ? 574 TYR B CE1 1 ATOM 10908 C CE2 . TYR B 2 593 ? 4.981 -15.320 7.410 1.00 60.96 ? 574 TYR B CE2 1 ATOM 10909 C CZ . TYR B 2 593 ? 6.102 -16.044 7.068 1.00 66.65 ? 574 TYR B CZ 1 ATOM 10910 O OH . TYR B 2 593 ? 6.479 -17.127 7.828 1.00 79.41 ? 574 TYR B OH 1 ATOM 10911 N N . ALA B 2 594 ? 5.177 -14.933 2.334 1.00 61.53 ? 575 ALA B N 1 ATOM 10912 C CA . ALA B 2 594 ? 6.105 -15.546 1.399 1.00 59.42 ? 575 ALA B CA 1 ATOM 10913 C C . ALA B 2 594 ? 5.640 -15.388 -0.052 1.00 62.56 ? 575 ALA B C 1 ATOM 10914 O O . ALA B 2 594 ? 6.449 -15.407 -0.979 1.00 65.58 ? 575 ALA B O 1 ATOM 10915 C CB . ALA B 2 594 ? 6.307 -17.005 1.754 1.00 49.56 ? 575 ALA B CB 1 ATOM 10916 N N . ASN B 2 595 ? 4.336 -15.227 -0.242 1.00 57.87 ? 576 ASN B N 1 ATOM 10917 C CA . ASN B 2 595 ? 3.791 -14.938 -1.563 1.00 52.65 ? 576 ASN B CA 1 ATOM 10918 C C . ASN B 2 595 ? 3.157 -13.556 -1.642 1.00 53.29 ? 576 ASN B C 1 ATOM 10919 O O . ASN B 2 595 ? 2.314 -13.307 -2.503 1.00 59.35 ? 576 ASN B O 1 ATOM 10920 C CB . ASN B 2 595 ? 2.766 -15.995 -1.972 1.00 60.87 ? 576 ASN B CB 1 ATOM 10921 C CG . ASN B 2 595 ? 3.385 -17.361 -2.153 1.00 83.77 ? 576 ASN B CG 1 ATOM 10922 O OD1 . ASN B 2 595 ? 3.918 -17.680 -3.217 1.00 84.44 ? 576 ASN B OD1 1 ATOM 10923 N ND2 . ASN B 2 595 ? 3.322 -18.180 -1.109 1.00 88.77 ? 576 ASN B ND2 1 ATOM 10924 N N . CYS B 2 596 ? 3.559 -12.659 -0.745 1.00 57.05 ? 577 CYS B N 1 ATOM 10925 C CA . CYS B 2 596 ? 2.977 -11.321 -0.704 1.00 57.12 ? 577 CYS B CA 1 ATOM 10926 C C . CYS B 2 596 ? 3.854 -10.310 0.039 1.00 54.83 ? 577 CYS B C 1 ATOM 10927 O O . CYS B 2 596 ? 3.439 -9.735 1.046 1.00 56.38 ? 577 CYS B O 1 ATOM 10928 C CB . CYS B 2 596 ? 1.583 -11.367 -0.075 1.00 45.77 ? 577 CYS B CB 1 ATOM 10929 S SG . CYS B 2 596 ? 0.610 -9.878 -0.359 1.00 69.65 ? 577 CYS B SG 1 ATOM 10930 N N . HIS B 2 597 ? 5.061 -10.088 -0.472 1.00 45.62 ? 578 HIS B N 1 ATOM 10931 C CA . HIS B 2 597 ? 5.995 -9.153 0.146 1.00 49.64 ? 578 HIS B CA 1 ATOM 10932 C C . HIS B 2 597 ? 6.526 -8.138 -0.856 1.00 52.01 ? 578 HIS B C 1 ATOM 10933 O O . HIS B 2 597 ? 6.324 -8.274 -2.060 1.00 66.45 ? 578 HIS B O 1 ATOM 10934 C CB . HIS B 2 597 ? 7.167 -9.913 0.767 1.00 53.94 ? 578 HIS B CB 1 ATOM 10935 C CG . HIS B 2 597 ? 7.893 -10.802 -0.197 1.00 61.86 ? 578 HIS B CG 1 ATOM 10936 N ND1 . HIS B 2 597 ? 7.506 -12.100 -0.450 1.00 59.24 ? 578 HIS B ND1 1 ATOM 10937 C CD2 . HIS B 2 597 ? 8.994 -10.585 -0.955 1.00 62.78 ? 578 HIS B CD2 1 ATOM 10938 C CE1 . HIS B 2 597 ? 8.330 -12.640 -1.330 1.00 60.24 ? 578 HIS B CE1 1 ATOM 10939 N NE2 . HIS B 2 597 ? 9.244 -11.743 -1.650 1.00 46.21 ? 578 HIS B NE2 1 ATOM 10940 N N . LEU B 2 598 ? 7.216 -7.123 -0.353 1.00 60.32 ? 579 LEU B N 1 ATOM 10941 C CA . LEU B 2 598 ? 7.866 -6.156 -1.224 1.00 61.77 ? 579 LEU B CA 1 ATOM 10942 C C . LEU B 2 598 ? 9.231 -6.689 -1.646 1.00 58.82 ? 579 LEU B C 1 ATOM 10943 O O . LEU B 2 598 ? 9.559 -6.704 -2.833 1.00 63.10 ? 579 LEU B O 1 ATOM 10944 C CB . LEU B 2 598 ? 7.996 -4.795 -0.532 1.00 53.48 ? 579 LEU B CB 1 ATOM 10945 C CG . LEU B 2 598 ? 6.693 -4.163 -0.029 1.00 58.42 ? 579 LEU B CG 1 ATOM 10946 C CD1 . LEU B 2 598 ? 6.899 -2.692 0.295 1.00 60.64 ? 579 LEU B CD1 1 ATOM 10947 C CD2 . LEU B 2 598 ? 5.561 -4.335 -1.032 1.00 55.94 ? 579 LEU B CD2 1 ATOM 10948 N N . ALA B 2 599 ? 10.013 -7.137 -0.667 1.00 56.73 ? 580 ALA B N 1 ATOM 10949 C CA . ALA B 2 599 ? 11.314 -7.754 -0.921 1.00 60.77 ? 580 ALA B CA 1 ATOM 10950 C C . ALA B 2 599 ? 11.848 -8.447 0.327 1.00 64.10 ? 580 ALA B C 1 ATOM 10951 O O . ALA B 2 599 ? 11.488 -8.088 1.449 1.00 59.17 ? 580 ALA B O 1 ATOM 10952 C CB . ALA B 2 599 ? 12.316 -6.719 -1.407 1.00 53.05 ? 580 ALA B CB 1 ATOM 10953 N N . ARG B 2 600 ? 12.716 -9.434 0.122 1.00 59.31 ? 581 ARG B N 1 ATOM 10954 C CA . ARG B 2 600 ? 13.394 -10.098 1.230 1.00 67.11 ? 581 ARG B CA 1 ATOM 10955 C C . ARG B 2 600 ? 14.595 -9.290 1.717 1.00 66.36 ? 581 ARG B C 1 ATOM 10956 O O . ARG B 2 600 ? 15.395 -8.805 0.917 1.00 65.04 ? 581 ARG B O 1 ATOM 10957 C CB . ARG B 2 600 ? 13.851 -11.503 0.833 1.00 57.42 ? 581 ARG B CB 1 ATOM 10958 C CG . ARG B 2 600 ? 14.746 -12.155 1.877 1.00 68.85 ? 581 ARG B CG 1 ATOM 10959 C CD . ARG B 2 600 ? 15.235 -13.531 1.458 1.00 83.76 ? 581 ARG B CD 1 ATOM 10960 N NE . ARG B 2 600 ? 14.200 -14.564 1.521 1.00 86.43 ? 581 ARG B NE 1 ATOM 10961 C CZ . ARG B 2 600 ? 13.682 -15.046 2.649 1.00 81.38 ? 581 ARG B CZ 1 ATOM 10962 N NH1 . ARG B 2 600 ? 14.078 -14.576 3.825 1.00 76.52 ? 581 ARG B NH1 1 ATOM 10963 N NH2 . ARG B 2 600 ? 12.759 -15.995 2.601 1.00 75.65 ? 581 ARG B NH2 1 ATOM 10964 N N . ALA B 2 601 ? 14.713 -9.152 3.034 1.00 62.50 ? 582 ALA B N 1 ATOM 10965 C CA . ALA B 2 601 ? 15.864 -8.492 3.643 1.00 67.13 ? 582 ALA B CA 1 ATOM 10966 C C . ALA B 2 601 ? 16.648 -9.466 4.519 1.00 63.86 ? 582 ALA B C 1 ATOM 10967 O O . ALA B 2 601 ? 16.069 -10.334 5.173 1.00 59.79 ? 582 ALA B O 1 ATOM 10968 C CB . ALA B 2 601 ? 15.421 -7.286 4.455 1.00 67.04 ? 582 ALA B CB 1 ATOM 10969 N N . PRO B 2 602 ? 17.977 -9.323 4.535 1.00 55.82 ? 583 PRO B N 1 ATOM 10970 C CA . PRO B 2 602 ? 18.826 -10.227 5.314 1.00 65.84 ? 583 PRO B CA 1 ATOM 10971 C C . PRO B 2 602 ? 18.874 -9.876 6.799 1.00 67.87 ? 583 PRO B C 1 ATOM 10972 O O . PRO B 2 602 ? 18.615 -8.733 7.180 1.00 61.36 ? 583 PRO B O 1 ATOM 10973 C CB . PRO B 2 602 ? 20.205 -10.009 4.691 1.00 66.07 ? 583 PRO B CB 1 ATOM 10974 C CG . PRO B 2 602 ? 20.169 -8.602 4.232 1.00 63.34 ? 583 PRO B CG 1 ATOM 10975 C CD . PRO B 2 602 ? 18.770 -8.375 3.735 1.00 50.46 ? 583 PRO B CD 1 ATOM 10976 N N . ASN B 2 603 ? 19.207 -10.864 7.626 1.00 57.22 ? 584 ASN B N 1 ATOM 10977 C CA . ASN B 2 603 ? 19.478 -10.625 9.035 1.00 51.88 ? 584 ASN B CA 1 ATOM 10978 C C . ASN B 2 603 ? 20.731 -9.770 9.171 1.00 53.85 ? 584 ASN B C 1 ATOM 10979 O O . ASN B 2 603 ? 21.433 -9.536 8.190 1.00 42.54 ? 584 ASN B O 1 ATOM 10980 C CB . ASN B 2 603 ? 19.683 -11.945 9.777 1.00 47.57 ? 584 ASN B CB 1 ATOM 10981 C CG . ASN B 2 603 ? 18.429 -12.787 9.831 1.00 55.28 ? 584 ASN B CG 1 ATOM 10982 O OD1 . ASN B 2 603 ? 17.328 -12.268 10.010 1.00 59.11 ? 584 ASN B OD1 1 ATOM 10983 N ND2 . ASN B 2 603 ? 18.589 -14.099 9.680 1.00 56.49 ? 584 ASN B ND2 1 ATOM 10984 N N . HIS B 2 604 ? 21.016 -9.309 10.384 1.00 53.72 ? 585 HIS B N 1 ATOM 10985 C CA . HIS B 2 604 ? 22.225 -8.532 10.613 1.00 46.50 ? 585 HIS B CA 1 ATOM 10986 C C . HIS B 2 604 ? 23.471 -9.342 10.283 1.00 49.80 ? 585 HIS B C 1 ATOM 10987 O O . HIS B 2 604 ? 23.483 -10.568 10.396 1.00 46.28 ? 585 HIS B O 1 ATOM 10988 C CB . HIS B 2 604 ? 22.292 -8.027 12.052 1.00 54.16 ? 585 HIS B CB 1 ATOM 10989 C CG . HIS B 2 604 ? 21.409 -6.851 12.320 1.00 61.66 ? 585 HIS B CG 1 ATOM 10990 N ND1 . HIS B 2 604 ? 20.036 -6.915 12.223 1.00 66.92 ? 585 HIS B ND1 1 ATOM 10991 C CD2 . HIS B 2 604 ? 21.703 -5.578 12.677 1.00 66.17 ? 585 HIS B CD2 1 ATOM 10992 C CE1 . HIS B 2 604 ? 19.522 -5.732 12.512 1.00 76.54 ? 585 HIS B CE1 1 ATOM 10993 N NE2 . HIS B 2 604 ? 20.512 -4.904 12.793 1.00 75.87 ? 585 HIS B NE2 1 ATOM 10994 N N . ALA B 2 605 ? 24.518 -8.645 9.866 1.00 51.20 ? 586 ALA B N 1 ATOM 10995 C CA . ALA B 2 605 ? 25.761 -9.299 9.502 1.00 41.06 ? 586 ALA B CA 1 ATOM 10996 C C . ALA B 2 605 ? 26.933 -8.536 10.076 1.00 45.17 ? 586 ALA B C 1 ATOM 10997 O O . ALA B 2 605 ? 26.880 -7.317 10.218 1.00 49.50 ? 586 ALA B O 1 ATOM 10998 C CB . ALA B 2 605 ? 25.884 -9.394 7.994 1.00 51.41 ? 586 ALA B CB 1 ATOM 10999 N N . VAL B 2 606 ? 27.985 -9.261 10.429 1.00 47.06 ? 587 VAL B N 1 ATOM 11000 C CA . VAL B 2 606 ? 29.225 -8.627 10.827 1.00 49.42 ? 587 VAL B CA 1 ATOM 11001 C C . VAL B 2 606 ? 29.967 -8.285 9.547 1.00 54.82 ? 587 VAL B C 1 ATOM 11002 O O . VAL B 2 606 ? 30.122 -9.137 8.672 1.00 52.45 ? 587 VAL B O 1 ATOM 11003 C CB . VAL B 2 606 ? 30.087 -9.563 11.699 1.00 52.14 ? 587 VAL B CB 1 ATOM 11004 C CG1 . VAL B 2 606 ? 31.437 -8.923 12.006 1.00 58.41 ? 587 VAL B CG1 1 ATOM 11005 C CG2 . VAL B 2 606 ? 29.364 -9.902 12.982 1.00 37.17 ? 587 VAL B CG2 1 ATOM 11006 N N . VAL B 2 607 ? 30.399 -7.035 9.416 1.00 42.03 ? 588 VAL B N 1 ATOM 11007 C CA . VAL B 2 607 ? 31.173 -6.645 8.246 1.00 56.57 ? 588 VAL B CA 1 ATOM 11008 C C . VAL B 2 607 ? 32.572 -6.210 8.660 1.00 56.64 ? 588 VAL B C 1 ATOM 11009 O O . VAL B 2 607 ? 32.789 -5.781 9.788 1.00 54.61 ? 588 VAL B O 1 ATOM 11010 C CB . VAL B 2 607 ? 30.488 -5.522 7.410 1.00 57.29 ? 588 VAL B CB 1 ATOM 11011 C CG1 . VAL B 2 607 ? 28.995 -5.779 7.274 1.00 48.20 ? 588 VAL B CG1 1 ATOM 11012 C CG2 . VAL B 2 607 ? 30.741 -4.157 8.018 1.00 41.98 ? 588 VAL B CG2 1 ATOM 11013 N N . THR B 2 608 ? 33.522 -6.331 7.741 1.00 54.07 ? 589 THR B N 1 ATOM 11014 C CA . THR B 2 608 ? 34.889 -5.921 8.011 1.00 48.86 ? 589 THR B CA 1 ATOM 11015 C C . THR B 2 608 ? 35.616 -5.587 6.712 1.00 55.62 ? 589 THR B C 1 ATOM 11016 O O . THR B 2 608 ? 35.030 -5.634 5.631 1.00 41.66 ? 589 THR B O 1 ATOM 11017 C CB . THR B 2 608 ? 35.657 -7.024 8.753 1.00 55.17 ? 589 THR B CB 1 ATOM 11018 O OG1 . THR B 2 608 ? 36.951 -6.541 9.129 1.00 57.40 ? 589 THR B OG1 1 ATOM 11019 C CG2 . THR B 2 608 ? 35.813 -8.249 7.872 1.00 38.96 ? 589 THR B CG2 1 ATOM 11020 N N . ARG B 2 609 ? 36.893 -5.239 6.830 1.00 57.39 ? 590 ARG B N 1 ATOM 11021 C CA . ARG B 2 609 ? 37.751 -5.055 5.669 1.00 50.00 ? 590 ARG B CA 1 ATOM 11022 C C . ARG B 2 609 ? 38.135 -6.405 5.073 1.00 53.80 ? 590 ARG B C 1 ATOM 11023 O O . ARG B 2 609 ? 38.079 -7.435 5.747 1.00 54.48 ? 590 ARG B O 1 ATOM 11024 C CB . ARG B 2 609 ? 39.018 -4.299 6.051 1.00 53.55 ? 590 ARG B CB 1 ATOM 11025 C CG . ARG B 2 609 ? 38.868 -2.802 6.127 1.00 58.79 ? 590 ARG B CG 1 ATOM 11026 C CD . ARG B 2 609 ? 40.222 -2.179 6.405 1.00 63.23 ? 590 ARG B CD 1 ATOM 11027 N NE . ARG B 2 609 ? 40.925 -2.920 7.449 1.00 62.56 ? 590 ARG B NE 1 ATOM 11028 C CZ . ARG B 2 609 ? 40.726 -2.744 8.750 1.00 57.86 ? 590 ARG B CZ 1 ATOM 11029 N NH1 . ARG B 2 609 ? 39.848 -1.848 9.174 1.00 70.36 ? 590 ARG B NH1 1 ATOM 11030 N NH2 . ARG B 2 609 ? 41.405 -3.461 9.630 1.00 59.70 ? 590 ARG B NH2 1 ATOM 11031 N N . LYS B 2 610 ? 38.540 -6.389 3.810 1.00 55.34 ? 591 LYS B N 1 ATOM 11032 C CA . LYS B 2 610 ? 38.850 -7.619 3.094 1.00 59.65 ? 591 LYS B CA 1 ATOM 11033 C C . LYS B 2 610 ? 40.134 -8.263 3.628 1.00 54.78 ? 591 LYS B C 1 ATOM 11034 O O . LYS B 2 610 ? 40.294 -9.481 3.589 1.00 50.57 ? 591 LYS B O 1 ATOM 11035 C CB . LYS B 2 610 ? 38.951 -7.336 1.590 1.00 60.22 ? 591 LYS B CB 1 ATOM 11036 C CG . LYS B 2 610 ? 39.117 -8.566 0.713 1.00 81.77 ? 591 LYS B CG 1 ATOM 11037 C CD . LYS B 2 610 ? 37.897 -9.467 0.755 1.00 94.48 ? 591 LYS B CD 1 ATOM 11038 C CE . LYS B 2 610 ? 38.085 -10.683 -0.143 1.00 96.16 ? 591 LYS B CE 1 ATOM 11039 N NZ . LYS B 2 610 ? 36.941 -11.634 -0.049 1.00 94.51 ? 591 LYS B NZ 1 ATOM 11040 N N . ASP B 2 611 ? 41.038 -7.439 4.145 1.00 56.18 ? 592 ASP B N 1 ATOM 11041 C CA . ASP B 2 611 ? 42.313 -7.934 4.648 1.00 48.36 ? 592 ASP B CA 1 ATOM 11042 C C . ASP B 2 611 ? 42.173 -8.491 6.056 1.00 48.79 ? 592 ASP B C 1 ATOM 11043 O O . ASP B 2 611 ? 43.135 -8.995 6.631 1.00 59.76 ? 592 ASP B O 1 ATOM 11044 C CB . ASP B 2 611 ? 43.368 -6.822 4.628 1.00 47.19 ? 592 ASP B CB 1 ATOM 11045 C CG . ASP B 2 611 ? 43.085 -5.724 5.640 1.00 67.13 ? 592 ASP B CG 1 ATOM 11046 O OD1 . ASP B 2 611 ? 42.199 -4.886 5.377 1.00 86.51 ? 592 ASP B OD1 1 ATOM 11047 O OD2 . ASP B 2 611 ? 43.757 -5.691 6.692 1.00 75.36 ? 592 ASP B OD2 1 ATOM 11048 N N . LYS B 2 612 ? 40.970 -8.388 6.606 1.00 58.00 ? 593 LYS B N 1 ATOM 11049 C CA . LYS B 2 612 ? 40.699 -8.827 7.969 1.00 64.24 ? 593 LYS B CA 1 ATOM 11050 C C . LYS B 2 612 ? 39.700 -9.971 7.984 1.00 68.72 ? 593 LYS B C 1 ATOM 11051 O O . LYS B 2 612 ? 39.471 -10.580 9.029 1.00 83.97 ? 593 LYS B O 1 ATOM 11052 C CB . LYS B 2 612 ? 40.148 -7.668 8.803 1.00 61.69 ? 593 LYS B CB 1 ATOM 11053 C CG . LYS B 2 612 ? 41.201 -6.786 9.444 1.00 54.78 ? 593 LYS B CG 1 ATOM 11054 C CD . LYS B 2 612 ? 41.739 -7.416 10.709 1.00 45.27 ? 593 LYS B CD 1 ATOM 11055 C CE . LYS B 2 612 ? 42.742 -6.506 11.396 1.00 65.14 ? 593 LYS B CE 1 ATOM 11056 N NZ . LYS B 2 612 ? 43.139 -7.031 12.734 1.00 74.60 ? 593 LYS B NZ 1 ATOM 11057 N N . GLU B 2 613 ? 39.110 -10.248 6.822 1.00 53.59 ? 594 GLU B N 1 ATOM 11058 C CA . GLU B 2 613 ? 38.046 -11.241 6.694 1.00 52.95 ? 594 GLU B CA 1 ATOM 11059 C C . GLU B 2 613 ? 38.370 -12.550 7.414 1.00 56.85 ? 594 GLU B C 1 ATOM 11060 O O . GLU B 2 613 ? 37.604 -12.999 8.262 1.00 70.48 ? 594 GLU B O 1 ATOM 11061 C CB . GLU B 2 613 ? 37.729 -11.504 5.221 1.00 48.68 ? 594 GLU B CB 1 ATOM 11062 C CG . GLU B 2 613 ? 36.446 -12.289 4.982 1.00 61.39 ? 594 GLU B CG 1 ATOM 11063 C CD . GLU B 2 613 ? 36.003 -12.265 3.523 1.00 85.58 ? 594 GLU B CD 1 ATOM 11064 O OE1 . GLU B 2 613 ? 36.817 -11.868 2.660 1.00 87.05 ? 594 GLU B OE1 1 ATOM 11065 O OE2 . GLU B 2 613 ? 34.840 -12.637 3.242 1.00 83.28 ? 594 GLU B OE2 1 ATOM 11066 N N . ALA B 2 614 ? 39.520 -13.134 7.098 1.00 49.45 ? 595 ALA B N 1 ATOM 11067 C CA . ALA B 2 614 ? 39.935 -14.405 7.686 1.00 50.42 ? 595 ALA B CA 1 ATOM 11068 C C . ALA B 2 614 ? 40.068 -14.356 9.210 1.00 61.09 ? 595 ALA B C 1 ATOM 11069 O O . ALA B 2 614 ? 39.571 -15.241 9.909 1.00 58.43 ? 595 ALA B O 1 ATOM 11070 C CB . ALA B 2 614 ? 41.236 -14.878 7.056 1.00 44.91 ? 595 ALA B CB 1 ATOM 11071 N N . CYS B 2 615 ? 40.738 -13.326 9.721 1.00 50.39 ? 596 CYS B N 1 ATOM 11072 C CA . CYS B 2 615 ? 40.947 -13.201 11.162 1.00 48.72 ? 596 CYS B CA 1 ATOM 11073 C C . CYS B 2 615 ? 39.649 -12.944 11.918 1.00 58.68 ? 596 CYS B C 1 ATOM 11074 O O . CYS B 2 615 ? 39.391 -13.568 12.949 1.00 66.12 ? 596 CYS B O 1 ATOM 11075 C CB . CYS B 2 615 ? 41.977 -12.115 11.484 1.00 37.13 ? 596 CYS B CB 1 ATOM 11076 S SG . CYS B 2 615 ? 43.691 -12.682 11.400 1.00 86.98 ? 596 CYS B SG 1 ATOM 11077 N N . VAL B 2 616 ? 38.836 -12.026 11.409 1.00 54.63 ? 597 VAL B N 1 ATOM 11078 C CA . VAL B 2 616 ? 37.548 -11.755 12.025 1.00 50.77 ? 597 VAL B CA 1 ATOM 11079 C C . VAL B 2 616 ? 36.698 -13.020 12.035 1.00 56.35 ? 597 VAL B C 1 ATOM 11080 O O . VAL B 2 616 ? 36.058 -13.335 13.037 1.00 64.62 ? 597 VAL B O 1 ATOM 11081 C CB . VAL B 2 616 ? 36.799 -10.632 11.308 1.00 42.00 ? 597 VAL B CB 1 ATOM 11082 C CG1 . VAL B 2 616 ? 35.436 -10.434 11.939 1.00 41.76 ? 597 VAL B CG1 1 ATOM 11083 C CG2 . VAL B 2 616 ? 37.604 -9.346 11.375 1.00 45.51 ? 597 VAL B CG2 1 ATOM 11084 N N . HIS B 2 617 ? 36.714 -13.740 10.916 1.00 54.51 ? 598 HIS B N 1 ATOM 11085 C CA . HIS B 2 617 ? 36.041 -15.027 10.795 1.00 38.28 ? 598 HIS B CA 1 ATOM 11086 C C . HIS B 2 617 ? 36.523 -15.964 11.899 1.00 51.96 ? 598 HIS B C 1 ATOM 11087 O O . HIS B 2 617 ? 35.724 -16.522 12.636 1.00 47.47 ? 598 HIS B O 1 ATOM 11088 C CB . HIS B 2 617 ? 36.328 -15.634 9.420 1.00 45.19 ? 598 HIS B CB 1 ATOM 11089 C CG . HIS B 2 617 ? 35.577 -16.900 9.135 1.00 55.50 ? 598 HIS B CG 1 ATOM 11090 N ND1 . HIS B 2 617 ? 36.077 -18.149 9.438 1.00 42.69 ? 598 HIS B ND1 1 ATOM 11091 C CD2 . HIS B 2 617 ? 34.374 -17.111 8.549 1.00 60.89 ? 598 HIS B CD2 1 ATOM 11092 C CE1 . HIS B 2 617 ? 35.207 -19.072 9.069 1.00 56.30 ? 598 HIS B CE1 1 ATOM 11093 N NE2 . HIS B 2 617 ? 34.166 -18.470 8.524 1.00 62.64 ? 598 HIS B NE2 1 ATOM 11094 N N . LYS B 2 618 ? 37.836 -16.109 12.032 1.00 59.36 ? 599 LYS B N 1 ATOM 11095 C CA . LYS B 2 618 ? 38.405 -17.017 13.024 1.00 53.32 ? 599 LYS B CA 1 ATOM 11096 C C . LYS B 2 618 ? 38.029 -16.660 14.460 1.00 61.33 ? 599 LYS B C 1 ATOM 11097 O O . LYS B 2 618 ? 37.544 -17.504 15.207 1.00 72.72 ? 599 LYS B O 1 ATOM 11098 C CB . LYS B 2 618 ? 39.929 -17.065 12.893 1.00 56.90 ? 599 LYS B CB 1 ATOM 11099 C CG . LYS B 2 618 ? 40.605 -18.042 13.833 1.00 53.04 ? 599 LYS B CG 1 ATOM 11100 C CD . LYS B 2 618 ? 42.109 -18.082 13.598 1.00 70.33 ? 599 LYS B CD 1 ATOM 11101 C CE . LYS B 2 618 ? 42.756 -19.239 14.351 1.00 81.18 ? 599 LYS B CE 1 ATOM 11102 N NZ . LYS B 2 618 ? 44.217 -19.355 14.088 1.00 80.82 ? 599 LYS B NZ 1 ATOM 11103 N N . ILE B 2 619 ? 38.246 -15.408 14.844 1.00 66.44 ? 600 ILE B N 1 ATOM 11104 C CA . ILE B 2 619 ? 38.119 -15.027 16.248 1.00 65.16 ? 600 ILE B CA 1 ATOM 11105 C C . ILE B 2 619 ? 36.674 -14.946 16.745 1.00 64.06 ? 600 ILE B C 1 ATOM 11106 O O . ILE B 2 619 ? 36.360 -15.415 17.842 1.00 62.11 ? 600 ILE B O 1 ATOM 11107 C CB . ILE B 2 619 ? 38.868 -13.718 16.546 1.00 59.11 ? 600 ILE B CB 1 ATOM 11108 C CG1 . ILE B 2 619 ? 40.374 -13.924 16.366 1.00 50.15 ? 600 ILE B CG1 1 ATOM 11109 C CG2 . ILE B 2 619 ? 38.573 -13.243 17.955 1.00 60.39 ? 600 ILE B CG2 1 ATOM 11110 C CD1 . ILE B 2 619 ? 41.188 -12.658 16.562 1.00 57.85 ? 600 ILE B CD1 1 ATOM 11111 N N . LEU B 2 620 ? 35.794 -14.363 15.942 1.00 56.59 ? 601 LEU B N 1 ATOM 11112 C CA . LEU B 2 620 ? 34.397 -14.249 16.340 1.00 51.97 ? 601 LEU B CA 1 ATOM 11113 C C . LEU B 2 620 ? 33.744 -15.624 16.514 1.00 50.63 ? 601 LEU B C 1 ATOM 11114 O O . LEU B 2 620 ? 32.874 -15.796 17.361 1.00 44.81 ? 601 LEU B O 1 ATOM 11115 C CB . LEU B 2 620 ? 33.611 -13.376 15.356 1.00 51.78 ? 601 LEU B CB 1 ATOM 11116 C CG . LEU B 2 620 ? 33.381 -11.914 15.754 1.00 57.11 ? 601 LEU B CG 1 ATOM 11117 C CD1 . LEU B 2 620 ? 32.449 -11.821 16.945 1.00 60.17 ? 601 LEU B CD1 1 ATOM 11118 C CD2 . LEU B 2 620 ? 34.689 -11.220 16.068 1.00 61.96 ? 601 LEU B CD2 1 ATOM 11119 N N . ARG B 2 621 ? 34.169 -16.606 15.724 1.00 46.59 ? 602 ARG B N 1 ATOM 11120 C CA . ARG B 2 621 ? 33.654 -17.961 15.891 1.00 50.52 ? 602 ARG B CA 1 ATOM 11121 C C . ARG B 2 621 ? 34.212 -18.562 17.178 1.00 56.30 ? 602 ARG B C 1 ATOM 11122 O O . ARG B 2 621 ? 33.544 -19.350 17.844 1.00 57.77 ? 602 ARG B O 1 ATOM 11123 C CB . ARG B 2 621 ? 33.990 -18.848 14.685 1.00 44.00 ? 602 ARG B CB 1 ATOM 11124 C CG . ARG B 2 621 ? 33.467 -18.317 13.362 1.00 45.80 ? 602 ARG B CG 1 ATOM 11125 C CD . ARG B 2 621 ? 32.491 -19.259 12.705 1.00 52.28 ? 602 ARG B CD 1 ATOM 11126 N NE . ARG B 2 621 ? 33.130 -20.484 12.253 1.00 59.25 ? 602 ARG B NE 1 ATOM 11127 C CZ . ARG B 2 621 ? 32.461 -21.560 11.864 1.00 60.55 ? 602 ARG B CZ 1 ATOM 11128 N NH1 . ARG B 2 621 ? 31.137 -21.551 11.879 1.00 70.24 ? 602 ARG B NH1 1 ATOM 11129 N NH2 . ARG B 2 621 ? 33.111 -22.641 11.464 1.00 60.93 ? 602 ARG B NH2 1 ATOM 11130 N N . GLN B 2 622 ? 35.438 -18.183 17.527 1.00 51.49 ? 603 GLN B N 1 ATOM 11131 C CA . GLN B 2 622 ? 36.033 -18.621 18.783 1.00 53.80 ? 603 GLN B CA 1 ATOM 11132 C C . GLN B 2 622 ? 35.315 -17.980 19.966 1.00 58.62 ? 603 GLN B C 1 ATOM 11133 O O . GLN B 2 622 ? 35.143 -18.604 21.011 1.00 64.93 ? 603 GLN B O 1 ATOM 11134 C CB . GLN B 2 622 ? 37.520 -18.274 18.834 1.00 42.76 ? 603 GLN B CB 1 ATOM 11135 C CG . GLN B 2 622 ? 38.408 -19.127 17.953 1.00 36.03 ? 603 GLN B CG 1 ATOM 11136 C CD . GLN B 2 622 ? 39.849 -18.652 17.972 1.00 49.10 ? 603 GLN B CD 1 ATOM 11137 O OE1 . GLN B 2 622 ? 40.139 -17.535 18.407 1.00 43.52 ? 603 GLN B OE1 1 ATOM 11138 N NE2 . GLN B 2 622 ? 40.762 -19.502 17.513 1.00 51.69 ? 603 GLN B NE2 1 ATOM 11139 N N . GLN B 2 623 ? 34.890 -16.733 19.792 1.00 54.60 ? 604 GLN B N 1 ATOM 11140 C CA . GLN B 2 623 ? 34.265 -15.988 20.879 1.00 52.99 ? 604 GLN B CA 1 ATOM 11141 C C . GLN B 2 623 ? 32.890 -16.536 21.247 1.00 54.67 ? 604 GLN B C 1 ATOM 11142 O O . GLN B 2 623 ? 32.493 -16.498 22.411 1.00 51.83 ? 604 GLN B O 1 ATOM 11143 C CB . GLN B 2 623 ? 34.173 -14.501 20.533 1.00 47.20 ? 604 GLN B CB 1 ATOM 11144 C CG . GLN B 2 623 ? 35.514 -13.793 20.501 1.00 48.55 ? 604 GLN B CG 1 ATOM 11145 C CD . GLN B 2 623 ? 36.187 -13.769 21.857 1.00 49.53 ? 604 GLN B CD 1 ATOM 11146 O OE1 . GLN B 2 623 ? 35.595 -13.347 22.847 1.00 63.14 ? 604 GLN B OE1 1 ATOM 11147 N NE2 . GLN B 2 623 ? 37.429 -14.230 21.910 1.00 49.25 ? 604 GLN B NE2 1 ATOM 11148 N N . GLN B 2 624 ? 32.168 -17.050 20.258 1.00 46.18 ? 605 GLN B N 1 ATOM 11149 C CA . GLN B 2 624 ? 30.821 -17.549 20.507 1.00 56.71 ? 605 GLN B CA 1 ATOM 11150 C C . GLN B 2 624 ? 30.826 -18.948 21.114 1.00 51.66 ? 605 GLN B C 1 ATOM 11151 O O . GLN B 2 624 ? 29.796 -19.441 21.551 1.00 62.51 ? 605 GLN B O 1 ATOM 11152 C CB . GLN B 2 624 ? 29.970 -17.515 19.233 1.00 51.60 ? 605 GLN B CB 1 ATOM 11153 C CG . GLN B 2 624 ? 30.476 -18.397 18.110 1.00 56.38 ? 605 GLN B CG 1 ATOM 11154 C CD . GLN B 2 624 ? 29.480 -18.507 16.967 1.00 58.09 ? 605 GLN B CD 1 ATOM 11155 O OE1 . GLN B 2 624 ? 28.329 -18.088 17.090 1.00 52.87 ? 605 GLN B OE1 1 ATOM 11156 N NE2 . GLN B 2 624 ? 29.919 -19.076 15.851 1.00 58.55 ? 605 GLN B NE2 1 ATOM 11157 N N . HIS B 2 625 ? 31.986 -19.592 21.131 1.00 51.10 ? 606 HIS B N 1 ATOM 11158 C CA . HIS B 2 625 ? 32.109 -20.899 21.765 1.00 47.69 ? 606 HIS B CA 1 ATOM 11159 C C . HIS B 2 625 ? 32.629 -20.722 23.189 1.00 54.45 ? 606 HIS B C 1 ATOM 11160 O O . HIS B 2 625 ? 32.621 -21.656 23.992 1.00 64.45 ? 606 HIS B O 1 ATOM 11161 C CB . HIS B 2 625 ? 33.034 -21.815 20.958 1.00 53.95 ? 606 HIS B CB 1 ATOM 11162 C CG . HIS B 2 625 ? 32.372 -22.472 19.785 1.00 60.25 ? 606 HIS B CG 1 ATOM 11163 N ND1 . HIS B 2 625 ? 31.857 -23.750 19.842 1.00 65.46 ? 606 HIS B ND1 1 ATOM 11164 C CD2 . HIS B 2 625 ? 32.158 -22.038 18.520 1.00 58.12 ? 606 HIS B CD2 1 ATOM 11165 C CE1 . HIS B 2 625 ? 31.346 -24.070 18.667 1.00 54.96 ? 606 HIS B CE1 1 ATOM 11166 N NE2 . HIS B 2 625 ? 31.516 -23.048 17.847 1.00 58.44 ? 606 HIS B NE2 1 ATOM 11167 N N . LEU B 2 626 ? 33.084 -19.509 23.486 1.00 55.42 ? 607 LEU B N 1 ATOM 11168 C CA . LEU B 2 626 ? 33.545 -19.150 24.817 1.00 54.98 ? 607 LEU B CA 1 ATOM 11169 C C . LEU B 2 626 ? 32.421 -18.497 25.609 1.00 60.19 ? 607 LEU B C 1 ATOM 11170 O O . LEU B 2 626 ? 32.235 -18.788 26.790 1.00 64.02 ? 607 LEU B O 1 ATOM 11171 C CB . LEU B 2 626 ? 34.740 -18.198 24.732 1.00 42.78 ? 607 LEU B CB 1 ATOM 11172 C CG . LEU B 2 626 ? 36.053 -18.794 24.220 1.00 42.66 ? 607 LEU B CG 1 ATOM 11173 C CD1 . LEU B 2 626 ? 37.072 -17.707 23.886 1.00 49.56 ? 607 LEU B CD1 1 ATOM 11174 C CD2 . LEU B 2 626 ? 36.625 -19.751 25.241 1.00 41.64 ? 607 LEU B CD2 1 ATOM 11175 N N . PHE B 2 627 ? 31.670 -17.616 24.954 1.00 66.22 ? 608 PHE B N 1 ATOM 11176 C CA . PHE B 2 627 ? 30.633 -16.845 25.633 1.00 65.30 ? 608 PHE B CA 1 ATOM 11177 C C . PHE B 2 627 ? 29.301 -16.878 24.892 1.00 63.93 ? 608 PHE B C 1 ATOM 11178 O O . PHE B 2 627 ? 28.494 -15.957 25.020 1.00 61.73 ? 608 PHE B O 1 ATOM 11179 C CB . PHE B 2 627 ? 31.076 -15.392 25.804 1.00 56.17 ? 608 PHE B CB 1 ATOM 11180 C CG . PHE B 2 627 ? 32.511 -15.238 26.209 1.00 52.12 ? 608 PHE B CG 1 ATOM 11181 C CD1 . PHE B 2 627 ? 32.908 -15.486 27.509 1.00 42.33 ? 608 PHE B CD1 1 ATOM 11182 C CD2 . PHE B 2 627 ? 33.463 -14.836 25.290 1.00 52.27 ? 608 PHE B CD2 1 ATOM 11183 C CE1 . PHE B 2 627 ? 34.231 -15.340 27.886 1.00 47.33 ? 608 PHE B CE1 1 ATOM 11184 C CE2 . PHE B 2 627 ? 34.785 -14.691 25.659 1.00 51.10 ? 608 PHE B CE2 1 ATOM 11185 C CZ . PHE B 2 627 ? 35.169 -14.943 26.959 1.00 47.61 ? 608 PHE B CZ 1 ATOM 11186 N N . GLY B 2 628 ? 29.072 -17.938 24.126 1.00 51.54 ? 609 GLY B N 1 ATOM 11187 C CA . GLY B 2 628 ? 27.857 -18.063 23.344 1.00 54.61 ? 609 GLY B CA 1 ATOM 11188 C C . GLY B 2 628 ? 26.583 -18.209 24.150 1.00 64.86 ? 609 GLY B C 1 ATOM 11189 O O . GLY B 2 628 ? 26.620 -18.255 25.377 1.00 66.16 ? 609 GLY B O 1 ATOM 11190 N N . SER B 2 629 ? 25.460 -18.282 23.437 1.00 87.76 ? 610 SER B N 1 ATOM 11191 C CA . SER B 2 629 ? 24.120 -18.311 24.025 1.00 106.70 ? 610 SER B CA 1 ATOM 11192 C C . SER B 2 629 ? 24.027 -19.255 25.216 1.00 115.06 ? 610 SER B C 1 ATOM 11193 O O . SER B 2 629 ? 23.852 -18.818 26.353 1.00 117.74 ? 610 SER B O 1 ATOM 11194 C CB . SER B 2 629 ? 23.089 -18.708 22.966 1.00 109.08 ? 610 SER B CB 1 ATOM 11195 O OG . SER B 2 629 ? 23.117 -17.822 21.861 1.00 103.67 ? 610 SER B OG 1 ATOM 11196 N N . ASN B 2 630 ? 24.144 -20.551 24.949 1.00 114.44 ? 611 ASN B N 1 ATOM 11197 C CA . ASN B 2 630 ? 24.267 -21.527 26.019 1.00 105.88 ? 611 ASN B CA 1 ATOM 11198 C C . ASN B 2 630 ? 25.747 -21.771 26.296 1.00 100.15 ? 611 ASN B C 1 ATOM 11199 O O . ASN B 2 630 ? 26.532 -20.826 26.288 1.00 107.80 ? 611 ASN B O 1 ATOM 11200 C CB . ASN B 2 630 ? 23.533 -22.820 25.667 1.00 97.49 ? 611 ASN B CB 1 ATOM 11201 C CG . ASN B 2 630 ? 22.070 -22.582 25.334 1.00 92.93 ? 611 ASN B CG 1 ATOM 11202 O OD1 . ASN B 2 630 ? 21.742 -22.123 24.242 1.00 71.87 ? 611 ASN B OD1 1 ATOM 11203 N ND2 . ASN B 2 630 ? 21.185 -22.891 26.277 1.00 116.51 ? 611 ASN B ND2 1 ATOM 11204 N N . VAL B 2 631 ? 26.121 -23.024 26.539 1.00 82.54 ? 612 VAL B N 1 ATOM 11205 C CA . VAL B 2 631 ? 27.502 -23.405 26.886 1.00 87.94 ? 612 VAL B CA 1 ATOM 11206 C C . VAL B 2 631 ? 28.191 -22.550 27.969 1.00 85.18 ? 612 VAL B C 1 ATOM 11207 O O . VAL B 2 631 ? 29.408 -22.625 28.143 1.00 81.72 ? 612 VAL B O 1 ATOM 11208 C CB . VAL B 2 631 ? 28.425 -23.568 25.630 1.00 95.65 ? 612 VAL B CB 1 ATOM 11209 C CG1 . VAL B 2 631 ? 27.711 -24.356 24.544 1.00 103.01 ? 612 VAL B CG1 1 ATOM 11210 C CG2 . VAL B 2 631 ? 28.908 -22.224 25.093 1.00 82.31 ? 612 VAL B CG2 1 ATOM 11211 N N . THR B 2 632 ? 27.405 -21.758 28.698 1.00 88.14 ? 613 THR B N 1 ATOM 11212 C CA . THR B 2 632 ? 27.897 -20.965 29.825 1.00 101.09 ? 613 THR B CA 1 ATOM 11213 C C . THR B 2 632 ? 26.739 -20.488 30.690 1.00 99.82 ? 613 THR B C 1 ATOM 11214 O O . THR B 2 632 ? 25.614 -20.337 30.209 1.00 90.11 ? 613 THR B O 1 ATOM 11215 C CB . THR B 2 632 ? 28.706 -19.722 29.378 1.00 115.20 ? 613 THR B CB 1 ATOM 11216 O OG1 . THR B 2 632 ? 28.571 -19.528 27.964 1.00 121.17 ? 613 THR B OG1 1 ATOM 11217 C CG2 . THR B 2 632 ? 30.180 -19.879 29.737 1.00 114.73 ? 613 THR B CG2 1 ATOM 11218 N N . ASP B 2 633 ? 27.021 -20.250 31.967 1.00 106.87 ? 614 ASP B N 1 ATOM 11219 C CA . ASP B 2 633 ? 26.021 -19.721 32.886 1.00 117.79 ? 614 ASP B CA 1 ATOM 11220 C C . ASP B 2 633 ? 26.002 -18.205 32.789 1.00 117.79 ? 614 ASP B C 1 ATOM 11221 O O . ASP B 2 633 ? 26.902 -17.536 33.297 1.00 122.55 ? 614 ASP B O 1 ATOM 11222 C CB . ASP B 2 633 ? 26.330 -20.146 34.320 1.00 133.26 ? 614 ASP B CB 1 ATOM 11223 C CG . ASP B 2 633 ? 26.410 -21.650 34.476 1.00 149.38 ? 614 ASP B CG 1 ATOM 11224 O OD1 . ASP B 2 633 ? 25.398 -22.263 34.878 1.00 154.44 ? 614 ASP B OD1 1 ATOM 11225 O OD2 . ASP B 2 633 ? 27.484 -22.222 34.192 1.00 154.74 ? 614 ASP B OD2 1 ATOM 11226 N N . CYS B 2 634 ? 24.975 -17.667 32.140 1.00 118.23 ? 615 CYS B N 1 ATOM 11227 C CA . CYS B 2 634 ? 24.900 -16.231 31.877 1.00 118.91 ? 615 CYS B CA 1 ATOM 11228 C C . CYS B 2 634 ? 24.729 -15.400 33.145 1.00 105.91 ? 615 CYS B C 1 ATOM 11229 O O . CYS B 2 634 ? 24.907 -14.182 33.129 1.00 98.29 ? 615 CYS B O 1 ATOM 11230 C CB . CYS B 2 634 ? 23.785 -15.923 30.876 1.00 119.42 ? 615 CYS B CB 1 ATOM 11231 S SG . CYS B 2 634 ? 24.172 -16.429 29.185 1.00 117.01 ? 615 CYS B SG 1 ATOM 11232 N N . SER B 2 635 ? 24.389 -16.067 34.240 1.00 101.82 ? 616 SER B N 1 ATOM 11233 C CA . SER B 2 635 ? 24.264 -15.408 35.531 1.00 105.39 ? 616 SER B CA 1 ATOM 11234 C C . SER B 2 635 ? 25.632 -15.192 36.178 1.00 108.76 ? 616 SER B C 1 ATOM 11235 O O . SER B 2 635 ? 25.869 -14.174 36.832 1.00 98.02 ? 616 SER B O 1 ATOM 11236 C CB . SER B 2 635 ? 23.371 -16.236 36.454 1.00 101.26 ? 616 SER B CB 1 ATOM 11237 O OG . SER B 2 635 ? 23.758 -17.599 36.431 1.00 95.66 ? 616 SER B OG 1 ATOM 11238 N N . GLY B 2 636 ? 26.534 -16.149 35.982 1.00 112.36 ? 617 GLY B N 1 ATOM 11239 C CA . GLY B 2 636 ? 27.834 -16.109 36.626 1.00 112.97 ? 617 GLY B CA 1 ATOM 11240 C C . GLY B 2 636 ? 28.939 -15.489 35.794 1.00 103.43 ? 617 GLY B C 1 ATOM 11241 O O . GLY B 2 636 ? 29.881 -14.913 36.336 1.00 110.12 ? 617 GLY B O 1 ATOM 11242 N N . ASN B 2 637 ? 28.829 -15.603 34.476 1.00 91.86 ? 618 ASN B N 1 ATOM 11243 C CA . ASN B 2 637 ? 29.890 -15.135 33.593 1.00 92.60 ? 618 ASN B CA 1 ATOM 11244 C C . ASN B 2 637 ? 29.417 -14.140 32.540 1.00 78.78 ? 618 ASN B C 1 ATOM 11245 O O . ASN B 2 637 ? 28.286 -13.654 32.585 1.00 77.74 ? 618 ASN B O 1 ATOM 11246 C CB . ASN B 2 637 ? 30.572 -16.323 32.913 1.00 105.24 ? 618 ASN B CB 1 ATOM 11247 C CG . ASN B 2 637 ? 31.058 -17.359 33.907 1.00 112.65 ? 618 ASN B CG 1 ATOM 11248 O OD1 . ASN B 2 637 ? 32.222 -17.352 34.309 1.00 118.66 ? 618 ASN B OD1 1 ATOM 11249 N ND2 . ASN B 2 637 ? 30.164 -18.254 34.313 1.00 105.87 ? 618 ASN B ND2 1 ATOM 11250 N N . PHE B 2 638 ? 30.300 -13.842 31.594 1.00 68.49 ? 619 PHE B N 1 ATOM 11251 C CA . PHE B 2 638 ? 29.972 -12.959 30.483 1.00 72.39 ? 619 PHE B CA 1 ATOM 11252 C C . PHE B 2 638 ? 29.285 -13.722 29.350 1.00 74.80 ? 619 PHE B C 1 ATOM 11253 O O . PHE B 2 638 ? 29.690 -14.831 28.997 1.00 81.31 ? 619 PHE B O 1 ATOM 11254 C CB . PHE B 2 638 ? 31.236 -12.267 29.963 1.00 71.88 ? 619 PHE B CB 1 ATOM 11255 C CG . PHE B 2 638 ? 31.055 -11.591 28.634 1.00 69.48 ? 619 PHE B CG 1 ATOM 11256 C CD1 . PHE B 2 638 ? 30.462 -10.344 28.551 1.00 73.42 ? 619 PHE B CD1 1 ATOM 11257 C CD2 . PHE B 2 638 ? 31.479 -12.202 27.468 1.00 66.54 ? 619 PHE B CD2 1 ATOM 11258 C CE1 . PHE B 2 638 ? 30.290 -9.722 27.327 1.00 65.42 ? 619 PHE B CE1 1 ATOM 11259 C CE2 . PHE B 2 638 ? 31.311 -11.584 26.241 1.00 75.66 ? 619 PHE B CE2 1 ATOM 11260 C CZ . PHE B 2 638 ? 30.717 -10.343 26.172 1.00 66.53 ? 619 PHE B CZ 1 ATOM 11261 N N . CYS B 2 639 ? 28.243 -13.120 28.787 1.00 66.22 ? 620 CYS B N 1 ATOM 11262 C CA . CYS B 2 639 ? 27.554 -13.691 27.634 1.00 64.44 ? 620 CYS B CA 1 ATOM 11263 C C . CYS B 2 639 ? 27.522 -12.702 26.471 1.00 64.40 ? 620 CYS B C 1 ATOM 11264 O O . CYS B 2 639 ? 27.019 -11.586 26.609 1.00 75.22 ? 620 CYS B O 1 ATOM 11265 C CB . CYS B 2 639 ? 26.133 -14.121 28.006 1.00 56.10 ? 620 CYS B CB 1 ATOM 11266 S SG . CYS B 2 639 ? 26.034 -15.645 28.975 1.00 92.06 ? 620 CYS B SG 1 ATOM 11267 N N . LEU B 2 640 ? 28.060 -13.122 25.329 1.00 61.63 ? 621 LEU B N 1 ATOM 11268 C CA . LEU B 2 640 ? 28.157 -12.259 24.155 1.00 68.14 ? 621 LEU B CA 1 ATOM 11269 C C . LEU B 2 640 ? 26.797 -11.760 23.683 1.00 61.07 ? 621 LEU B C 1 ATOM 11270 O O . LEU B 2 640 ? 26.675 -10.634 23.205 1.00 52.82 ? 621 LEU B O 1 ATOM 11271 C CB . LEU B 2 640 ? 28.846 -12.994 23.002 1.00 67.75 ? 621 LEU B CB 1 ATOM 11272 C CG . LEU B 2 640 ? 30.027 -12.296 22.318 1.00 61.61 ? 621 LEU B CG 1 ATOM 11273 C CD1 . LEU B 2 640 ? 30.121 -12.715 20.866 1.00 48.66 ? 621 LEU B CD1 1 ATOM 11274 C CD2 . LEU B 2 640 ? 29.942 -10.788 22.432 1.00 55.83 ? 621 LEU B CD2 1 ATOM 11275 N N . PHE B 2 641 ? 25.780 -12.604 23.822 1.00 56.42 ? 622 PHE B N 1 ATOM 11276 C CA . PHE B 2 641 ? 24.465 -12.319 23.256 1.00 40.72 ? 622 PHE B CA 1 ATOM 11277 C C . PHE B 2 641 ? 23.442 -11.907 24.308 1.00 53.54 ? 622 PHE B C 1 ATOM 11278 O O . PHE B 2 641 ? 22.244 -12.160 24.163 1.00 57.83 ? 622 PHE B O 1 ATOM 11279 C CB . PHE B 2 641 ? 23.974 -13.519 22.445 1.00 43.90 ? 622 PHE B CB 1 ATOM 11280 C CG . PHE B 2 641 ? 24.947 -13.968 21.393 1.00 52.71 ? 622 PHE B CG 1 ATOM 11281 C CD1 . PHE B 2 641 ? 25.591 -13.042 20.588 1.00 61.71 ? 622 PHE B CD1 1 ATOM 11282 C CD2 . PHE B 2 641 ? 25.238 -15.309 21.223 1.00 62.99 ? 622 PHE B CD2 1 ATOM 11283 C CE1 . PHE B 2 641 ? 26.493 -13.447 19.622 1.00 62.44 ? 622 PHE B CE1 1 ATOM 11284 C CE2 . PHE B 2 641 ? 26.142 -15.721 20.262 1.00 65.96 ? 622 PHE B CE2 1 ATOM 11285 C CZ . PHE B 2 641 ? 26.770 -14.788 19.458 1.00 58.17 ? 622 PHE B CZ 1 ATOM 11286 N N . ARG B 2 642 ? 23.931 -11.266 25.365 1.00 50.51 ? 623 ARG B N 1 ATOM 11287 C CA . ARG B 2 642 ? 23.078 -10.692 26.398 1.00 71.52 ? 623 ARG B CA 1 ATOM 11288 C C . ARG B 2 642 ? 23.528 -9.262 26.673 1.00 71.83 ? 623 ARG B C 1 ATOM 11289 O O . ARG B 2 642 ? 24.726 -8.972 26.686 1.00 59.00 ? 623 ARG B O 1 ATOM 11290 C CB . ARG B 2 642 ? 23.155 -11.518 27.684 1.00 78.82 ? 623 ARG B CB 1 ATOM 11291 C CG . ARG B 2 642 ? 22.680 -12.957 27.541 1.00 91.96 ? 623 ARG B CG 1 ATOM 11292 C CD . ARG B 2 642 ? 21.169 -13.046 27.402 1.00 101.98 ? 623 ARG B CD 1 ATOM 11293 N NE . ARG B 2 642 ? 20.703 -14.430 27.393 1.00 105.96 ? 623 ARG B NE 1 ATOM 11294 C CZ . ARG B 2 642 ? 20.501 -15.157 28.487 1.00 115.09 ? 623 ARG B CZ 1 ATOM 11295 N NH1 . ARG B 2 642 ? 20.728 -14.633 29.686 1.00 114.56 ? 623 ARG B NH1 1 ATOM 11296 N NH2 . ARG B 2 642 ? 20.074 -16.409 28.385 1.00 121.62 ? 623 ARG B NH2 1 ATOM 11297 N N . SER B 2 643 ? 22.572 -8.367 26.895 1.00 76.35 ? 624 SER B N 1 ATOM 11298 C CA . SER B 2 643 ? 22.907 -6.961 27.102 1.00 87.07 ? 624 SER B CA 1 ATOM 11299 C C . SER B 2 643 ? 22.148 -6.316 28.263 1.00 78.90 ? 624 SER B C 1 ATOM 11300 O O . SER B 2 643 ? 21.005 -6.675 28.545 1.00 84.38 ? 624 SER B O 1 ATOM 11301 C CB . SER B 2 643 ? 22.709 -6.169 25.807 1.00 91.30 ? 624 SER B CB 1 ATOM 11302 O OG . SER B 2 643 ? 21.484 -6.496 25.177 1.00 83.40 ? 624 SER B OG 1 ATOM 11303 N N . GLU B 2 644 ? 22.800 -5.364 28.931 1.00 70.60 ? 625 GLU B N 1 ATOM 11304 C CA . GLU B 2 644 ? 22.241 -4.719 30.118 1.00 66.90 ? 625 GLU B CA 1 ATOM 11305 C C . GLU B 2 644 ? 20.921 -4.012 29.819 1.00 77.76 ? 625 GLU B C 1 ATOM 11306 O O . GLU B 2 644 ? 20.032 -3.958 30.667 1.00 84.71 ? 625 GLU B O 1 ATOM 11307 C CB . GLU B 2 644 ? 23.248 -3.733 30.721 1.00 72.82 ? 625 GLU B CB 1 ATOM 11308 C CG . GLU B 2 644 ? 22.848 -3.173 32.089 1.00 102.59 ? 625 GLU B CG 1 ATOM 11309 C CD . GLU B 2 644 ? 22.945 -4.200 33.212 1.00 116.73 ? 625 GLU B CD 1 ATOM 11310 O OE1 . GLU B 2 644 ? 23.942 -4.955 33.251 1.00 120.18 ? 625 GLU B OE1 1 ATOM 11311 O OE2 . GLU B 2 644 ? 22.025 -4.252 34.057 1.00 112.33 ? 625 GLU B OE2 1 ATOM 11312 N N . THR B 2 645 ? 20.798 -3.470 28.612 1.00 78.78 ? 626 THR B N 1 ATOM 11313 C CA . THR B 2 645 ? 19.547 -2.862 28.175 1.00 74.69 ? 626 THR B CA 1 ATOM 11314 C C . THR B 2 645 ? 18.887 -3.746 27.126 1.00 75.93 ? 626 THR B C 1 ATOM 11315 O O . THR B 2 645 ? 18.205 -4.715 27.463 1.00 84.00 ? 626 THR B O 1 ATOM 11316 C CB . THR B 2 645 ? 19.756 -1.444 27.603 1.00 78.35 ? 626 THR B CB 1 ATOM 11317 O OG1 . THR B 2 645 ? 20.654 -1.498 26.488 1.00 84.86 ? 626 THR B OG1 1 ATOM 11318 C CG2 . THR B 2 645 ? 20.333 -0.522 28.661 1.00 56.51 ? 626 THR B CG2 1 ATOM 11319 N N . LYS B 2 646 ? 19.098 -3.416 25.856 1.00 72.52 ? 627 LYS B N 1 ATOM 11320 C CA . LYS B 2 646 ? 18.590 -4.239 24.764 1.00 68.42 ? 627 LYS B CA 1 ATOM 11321 C C . LYS B 2 646 ? 19.522 -4.234 23.555 1.00 73.97 ? 627 LYS B C 1 ATOM 11322 O O . LYS B 2 646 ? 20.035 -3.186 23.167 1.00 82.58 ? 627 LYS B O 1 ATOM 11323 C CB . LYS B 2 646 ? 17.188 -3.786 24.347 1.00 74.29 ? 627 LYS B CB 1 ATOM 11324 C CG . LYS B 2 646 ? 16.596 -4.597 23.197 1.00 88.10 ? 627 LYS B CG 1 ATOM 11325 C CD . LYS B 2 646 ? 15.228 -4.076 22.773 1.00 105.23 ? 627 LYS B CD 1 ATOM 11326 C CE . LYS B 2 646 ? 14.193 -4.242 23.878 1.00 116.39 ? 627 LYS B CE 1 ATOM 11327 N NZ . LYS B 2 646 ? 12.829 -3.822 23.438 1.00 117.45 ? 627 LYS B NZ 1 ATOM 11328 N N . ASP B 2 647 ? 19.746 -5.421 22.992 1.00 70.86 ? 628 ASP B N 1 ATOM 11329 C CA . ASP B 2 647 ? 20.397 -5.601 21.690 1.00 65.28 ? 628 ASP B CA 1 ATOM 11330 C C . ASP B 2 647 ? 21.685 -4.810 21.465 1.00 62.32 ? 628 ASP B C 1 ATOM 11331 O O . ASP B 2 647 ? 21.815 -4.108 20.464 1.00 69.35 ? 628 ASP B O 1 ATOM 11332 C CB . ASP B 2 647 ? 19.407 -5.291 20.563 1.00 72.40 ? 628 ASP B CB 1 ATOM 11333 C CG . ASP B 2 647 ? 18.282 -6.306 20.477 1.00 85.27 ? 628 ASP B CG 1 ATOM 11334 O OD1 . ASP B 2 647 ? 18.537 -7.503 20.730 1.00 81.28 ? 628 ASP B OD1 1 ATOM 11335 O OD2 . ASP B 2 647 ? 17.143 -5.908 20.154 1.00 93.18 ? 628 ASP B OD2 1 ATOM 11336 N N . LEU B 2 648 ? 22.637 -4.927 22.384 1.00 61.94 ? 629 LEU B N 1 ATOM 11337 C CA . LEU B 2 648 ? 23.909 -4.233 22.231 1.00 63.18 ? 629 LEU B CA 1 ATOM 11338 C C . LEU B 2 648 ? 24.896 -5.104 21.464 1.00 68.97 ? 629 LEU B C 1 ATOM 11339 O O . LEU B 2 648 ? 24.965 -6.310 21.690 1.00 70.89 ? 629 LEU B O 1 ATOM 11340 C CB . LEU B 2 648 ? 24.479 -3.843 23.595 1.00 57.40 ? 629 LEU B CB 1 ATOM 11341 C CG . LEU B 2 648 ? 23.546 -3.005 24.476 1.00 57.55 ? 629 LEU B CG 1 ATOM 11342 C CD1 . LEU B 2 648 ? 24.227 -2.625 25.782 1.00 57.16 ? 629 LEU B CD1 1 ATOM 11343 C CD2 . LEU B 2 648 ? 23.050 -1.772 23.745 1.00 66.72 ? 629 LEU B CD2 1 ATOM 11344 N N . LEU B 2 649 ? 25.643 -4.487 20.551 1.00 77.11 ? 630 LEU B N 1 ATOM 11345 C CA . LEU B 2 649 ? 26.590 -5.193 19.678 1.00 66.17 ? 630 LEU B CA 1 ATOM 11346 C C . LEU B 2 649 ? 25.912 -6.185 18.733 1.00 55.40 ? 630 LEU B C 1 ATOM 11347 O O . LEU B 2 649 ? 26.030 -6.063 17.512 1.00 64.33 ? 630 LEU B O 1 ATOM 11348 C CB . LEU B 2 649 ? 27.690 -5.883 20.490 1.00 54.73 ? 630 LEU B CB 1 ATOM 11349 C CG . LEU B 2 649 ? 28.444 -4.953 21.439 1.00 49.66 ? 630 LEU B CG 1 ATOM 11350 C CD1 . LEU B 2 649 ? 29.554 -5.702 22.163 1.00 45.64 ? 630 LEU B CD1 1 ATOM 11351 C CD2 . LEU B 2 649 ? 28.996 -3.765 20.670 1.00 44.18 ? 630 LEU B CD2 1 ATOM 11352 N N . PHE B 2 650 ? 25.211 -7.162 19.304 1.00 46.32 ? 631 PHE B N 1 ATOM 11353 C CA . PHE B 2 650 ? 24.451 -8.144 18.532 1.00 53.56 ? 631 PHE B CA 1 ATOM 11354 C C . PHE B 2 650 ? 23.009 -8.176 19.032 1.00 52.93 ? 631 PHE B C 1 ATOM 11355 O O . PHE B 2 650 ? 22.721 -7.668 20.114 1.00 54.22 ? 631 PHE B O 1 ATOM 11356 C CB . PHE B 2 650 ? 25.063 -9.534 18.694 1.00 46.81 ? 631 PHE B CB 1 ATOM 11357 C CG . PHE B 2 650 ? 26.525 -9.604 18.362 1.00 46.53 ? 631 PHE B CG 1 ATOM 11358 C CD1 . PHE B 2 650 ? 26.944 -9.982 17.097 1.00 52.10 ? 631 PHE B CD1 1 ATOM 11359 C CD2 . PHE B 2 650 ? 27.478 -9.309 19.318 1.00 50.44 ? 631 PHE B CD2 1 ATOM 11360 C CE1 . PHE B 2 650 ? 28.288 -10.057 16.791 1.00 64.10 ? 631 PHE B CE1 1 ATOM 11361 C CE2 . PHE B 2 650 ? 28.823 -9.377 19.020 1.00 63.44 ? 631 PHE B CE2 1 ATOM 11362 C CZ . PHE B 2 650 ? 29.231 -9.752 17.755 1.00 66.84 ? 631 PHE B CZ 1 ATOM 11363 N N . ARG B 2 651 ? 22.099 -8.774 18.267 1.00 48.45 ? 632 ARG B N 1 ATOM 11364 C CA . ARG B 2 651 ? 20.738 -8.937 18.775 1.00 65.26 ? 632 ARG B CA 1 ATOM 11365 C C . ARG B 2 651 ? 20.756 -9.917 19.949 1.00 70.35 ? 632 ARG B C 1 ATOM 11366 O O . ARG B 2 651 ? 21.568 -10.840 19.987 1.00 78.06 ? 632 ARG B O 1 ATOM 11367 C CB . ARG B 2 651 ? 19.764 -9.415 17.693 1.00 76.40 ? 632 ARG B CB 1 ATOM 11368 C CG . ARG B 2 651 ? 19.877 -8.722 16.342 1.00 84.16 ? 632 ARG B CG 1 ATOM 11369 C CD . ARG B 2 651 ? 19.435 -7.261 16.319 1.00 88.21 ? 632 ARG B CD 1 ATOM 11370 N NE . ARG B 2 651 ? 20.413 -6.335 16.889 1.00 97.24 ? 632 ARG B NE 1 ATOM 11371 C CZ . ARG B 2 651 ? 21.647 -6.144 16.427 1.00 97.62 ? 632 ARG B CZ 1 ATOM 11372 N NH1 . ARG B 2 651 ? 22.098 -6.826 15.384 1.00 88.03 ? 632 ARG B NH1 1 ATOM 11373 N NH2 . ARG B 2 651 ? 22.444 -5.271 17.027 1.00 105.78 ? 632 ARG B NH2 1 ATOM 11374 N N . ASP B 2 652 ? 19.862 -9.711 20.908 1.00 70.78 ? 633 ASP B N 1 ATOM 11375 C CA . ASP B 2 652 ? 19.852 -10.518 22.122 1.00 64.70 ? 633 ASP B CA 1 ATOM 11376 C C . ASP B 2 652 ? 19.312 -11.930 21.912 1.00 63.39 ? 633 ASP B C 1 ATOM 11377 O O . ASP B 2 652 ? 19.512 -12.804 22.756 1.00 69.82 ? 633 ASP B O 1 ATOM 11378 C CB . ASP B 2 652 ? 19.069 -9.811 23.228 1.00 73.80 ? 633 ASP B CB 1 ATOM 11379 C CG . ASP B 2 652 ? 19.833 -8.653 23.828 1.00 81.83 ? 633 ASP B CG 1 ATOM 11380 O OD1 . ASP B 2 652 ? 21.082 -8.697 23.818 1.00 85.64 ? 633 ASP B OD1 1 ATOM 11381 O OD2 . ASP B 2 652 ? 19.188 -7.702 24.314 1.00 92.95 ? 633 ASP B OD2 1 ATOM 11382 N N . ASP B 2 653 ? 18.626 -12.153 20.796 1.00 63.76 ? 634 ASP B N 1 ATOM 11383 C CA . ASP B 2 653 ? 18.122 -13.487 20.483 1.00 68.05 ? 634 ASP B CA 1 ATOM 11384 C C . ASP B 2 653 ? 18.961 -14.162 19.401 1.00 68.09 ? 634 ASP B C 1 ATOM 11385 O O . ASP B 2 653 ? 18.503 -15.075 18.707 1.00 67.02 ? 634 ASP B O 1 ATOM 11386 C CB . ASP B 2 653 ? 16.634 -13.458 20.116 1.00 73.16 ? 634 ASP B CB 1 ATOM 11387 C CG . ASP B 2 653 ? 16.291 -12.358 19.140 1.00 91.66 ? 634 ASP B CG 1 ATOM 11388 O OD1 . ASP B 2 653 ? 17.107 -12.078 18.239 1.00 106.05 ? 634 ASP B OD1 1 ATOM 11389 O OD2 . ASP B 2 653 ? 15.198 -11.770 19.276 1.00 101.80 ? 634 ASP B OD2 1 ATOM 11390 N N . THR B 2 654 ? 20.197 -13.697 19.266 1.00 60.44 ? 635 THR B N 1 ATOM 11391 C CA . THR B 2 654 ? 21.171 -14.346 18.405 1.00 59.00 ? 635 THR B CA 1 ATOM 11392 C C . THR B 2 654 ? 21.490 -15.723 18.959 1.00 61.28 ? 635 THR B C 1 ATOM 11393 O O . THR B 2 654 ? 21.917 -15.853 20.107 1.00 67.48 ? 635 THR B O 1 ATOM 11394 C CB . THR B 2 654 ? 22.488 -13.556 18.355 1.00 67.96 ? 635 THR B CB 1 ATOM 11395 O OG1 . THR B 2 654 ? 22.228 -12.203 17.960 1.00 63.20 ? 635 THR B OG1 1 ATOM 11396 C CG2 . THR B 2 654 ? 23.460 -14.200 17.377 1.00 36.70 ? 635 THR B CG2 1 ATOM 11397 N N . VAL B 2 655 ? 21.275 -16.748 18.144 1.00 61.21 ? 636 VAL B N 1 ATOM 11398 C CA . VAL B 2 655 ? 21.629 -18.114 18.512 1.00 50.73 ? 636 VAL B CA 1 ATOM 11399 C C . VAL B 2 655 ? 23.125 -18.334 18.306 1.00 45.88 ? 636 VAL B C 1 ATOM 11400 O O . VAL B 2 655 ? 23.812 -18.857 19.181 1.00 59.37 ? 636 VAL B O 1 ATOM 11401 C CB . VAL B 2 655 ? 20.831 -19.142 17.681 1.00 50.48 ? 636 VAL B CB 1 ATOM 11402 C CG1 . VAL B 2 655 ? 21.385 -20.547 17.872 1.00 48.39 ? 636 VAL B CG1 1 ATOM 11403 C CG2 . VAL B 2 655 ? 19.356 -19.091 18.042 1.00 42.15 ? 636 VAL B CG2 1 ATOM 11404 N N . CYS B 2 656 ? 23.621 -17.922 17.145 1.00 52.65 ? 637 CYS B N 1 ATOM 11405 C CA . CYS B 2 656 ? 25.038 -18.043 16.822 1.00 63.90 ? 637 CYS B CA 1 ATOM 11406 C C . CYS B 2 656 ? 25.400 -17.196 15.598 1.00 60.93 ? 637 CYS B C 1 ATOM 11407 O O . CYS B 2 656 ? 24.524 -16.689 14.896 1.00 46.17 ? 637 CYS B O 1 ATOM 11408 C CB . CYS B 2 656 ? 25.405 -19.508 16.557 1.00 46.14 ? 637 CYS B CB 1 ATOM 11409 S SG . CYS B 2 656 ? 24.779 -20.149 14.986 1.00 75.30 ? 637 CYS B SG 1 ATOM 11410 N N . LEU B 2 657 ? 26.700 -17.055 15.355 1.00 45.50 ? 638 LEU B N 1 ATOM 11411 C CA . LEU B 2 657 ? 27.206 -16.405 14.158 1.00 43.49 ? 638 LEU B CA 1 ATOM 11412 C C . LEU B 2 657 ? 27.504 -17.458 13.096 1.00 52.09 ? 638 LEU B C 1 ATOM 11413 O O . LEU B 2 657 ? 28.278 -18.383 13.330 1.00 54.29 ? 638 LEU B O 1 ATOM 11414 C CB . LEU B 2 657 ? 28.475 -15.631 14.489 1.00 42.09 ? 638 LEU B CB 1 ATOM 11415 C CG . LEU B 2 657 ? 28.289 -14.617 15.615 1.00 43.61 ? 638 LEU B CG 1 ATOM 11416 C CD1 . LEU B 2 657 ? 29.596 -13.909 15.961 1.00 47.58 ? 638 LEU B CD1 1 ATOM 11417 C CD2 . LEU B 2 657 ? 27.216 -13.621 15.216 1.00 35.82 ? 638 LEU B CD2 1 ATOM 11418 N N . ALA B 2 658 ? 26.886 -17.319 11.929 1.00 60.27 ? 639 ALA B N 1 ATOM 11419 C CA . ALA B 2 658 ? 27.044 -18.306 10.867 1.00 55.66 ? 639 ALA B CA 1 ATOM 11420 C C . ALA B 2 658 ? 27.991 -17.814 9.778 1.00 55.11 ? 639 ALA B C 1 ATOM 11421 O O . ALA B 2 658 ? 27.994 -16.633 9.433 1.00 48.97 ? 639 ALA B O 1 ATOM 11422 C CB . ALA B 2 658 ? 25.693 -18.670 10.277 1.00 45.39 ? 639 ALA B CB 1 ATOM 11423 N N . LYS B 2 659 ? 28.792 -18.731 9.243 1.00 55.36 ? 640 LYS B N 1 ATOM 11424 C CA . LYS B 2 659 ? 29.754 -18.400 8.194 1.00 64.06 ? 640 LYS B CA 1 ATOM 11425 C C . LYS B 2 659 ? 29.079 -18.241 6.833 1.00 65.29 ? 640 LYS B C 1 ATOM 11426 O O . LYS B 2 659 ? 28.033 -18.832 6.579 1.00 53.73 ? 640 LYS B O 1 ATOM 11427 C CB . LYS B 2 659 ? 30.862 -19.456 8.126 1.00 58.14 ? 640 LYS B CB 1 ATOM 11428 C CG . LYS B 2 659 ? 30.365 -20.886 7.945 1.00 49.22 ? 640 LYS B CG 1 ATOM 11429 C CD . LYS B 2 659 ? 31.510 -21.876 8.093 1.00 58.27 ? 640 LYS B CD 1 ATOM 11430 C CE . LYS B 2 659 ? 31.064 -23.303 7.841 1.00 70.02 ? 640 LYS B CE 1 ATOM 11431 N NZ . LYS B 2 659 ? 32.212 -24.249 7.873 1.00 72.47 ? 640 LYS B NZ 1 ATOM 11432 N N . LEU B 2 660 ? 29.691 -17.439 5.967 1.00 68.27 ? 641 LEU B N 1 ATOM 11433 C CA . LEU B 2 660 ? 29.123 -17.114 4.663 1.00 66.50 ? 641 LEU B CA 1 ATOM 11434 C C . LEU B 2 660 ? 29.972 -17.672 3.525 1.00 85.56 ? 641 LEU B C 1 ATOM 11435 O O . LEU B 2 660 ? 31.144 -17.316 3.383 1.00 85.10 ? 641 LEU B O 1 ATOM 11436 C CB . LEU B 2 660 ? 29.012 -15.597 4.504 1.00 59.13 ? 641 LEU B CB 1 ATOM 11437 C CG . LEU B 2 660 ? 28.101 -14.855 5.477 1.00 49.29 ? 641 LEU B CG 1 ATOM 11438 C CD1 . LEU B 2 660 ? 28.337 -13.371 5.369 1.00 42.98 ? 641 LEU B CD1 1 ATOM 11439 C CD2 . LEU B 2 660 ? 26.655 -15.186 5.183 1.00 61.82 ? 641 LEU B CD2 1 ATOM 11440 N N . HIS B 2 661 ? 29.379 -18.541 2.712 1.00 88.58 ? 642 HIS B N 1 ATOM 11441 C CA . HIS B 2 661 ? 30.079 -19.092 1.558 1.00 96.85 ? 642 HIS B CA 1 ATOM 11442 C C . HIS B 2 661 ? 29.714 -18.313 0.303 1.00 98.74 ? 642 HIS B C 1 ATOM 11443 O O . HIS B 2 661 ? 30.438 -17.408 -0.111 1.00 93.44 ? 642 HIS B O 1 ATOM 11444 C CB . HIS B 2 661 ? 29.744 -20.573 1.366 1.00 118.31 ? 642 HIS B CB 1 ATOM 11445 C CG . HIS B 2 661 ? 28.976 -21.174 2.502 1.00 140.30 ? 642 HIS B CG 1 ATOM 11446 N ND1 . HIS B 2 661 ? 27.610 -21.042 2.628 1.00 147.40 ? 642 HIS B ND1 1 ATOM 11447 C CD2 . HIS B 2 661 ? 29.381 -21.913 3.562 1.00 144.70 ? 642 HIS B CD2 1 ATOM 11448 C CE1 . HIS B 2 661 ? 27.207 -21.673 3.716 1.00 148.06 ? 642 HIS B CE1 1 ATOM 11449 N NE2 . HIS B 2 661 ? 28.262 -22.210 4.302 1.00 145.33 ? 642 HIS B NE2 1 ATOM 11450 N N . ASP B 2 662 ? 28.581 -18.671 -0.292 1.00 104.02 ? 643 ASP B N 1 ATOM 11451 C CA . ASP B 2 662 ? 28.112 -18.022 -1.509 1.00 101.20 ? 643 ASP B CA 1 ATOM 11452 C C . ASP B 2 662 ? 27.863 -16.540 -1.264 1.00 80.97 ? 643 ASP B C 1 ATOM 11453 O O . ASP B 2 662 ? 28.255 -15.696 -2.064 1.00 82.01 ? 643 ASP B O 1 ATOM 11454 C CB . ASP B 2 662 ? 26.819 -18.676 -2.008 1.00 122.73 ? 643 ASP B CB 1 ATOM 11455 C CG . ASP B 2 662 ? 26.885 -20.194 -2.002 1.00 134.12 ? 643 ASP B CG 1 ATOM 11456 O OD1 . ASP B 2 662 ? 27.491 -20.763 -1.067 1.00 141.03 ? 643 ASP B OD1 1 ATOM 11457 O OD2 . ASP B 2 662 ? 26.324 -20.819 -2.929 1.00 128.27 ? 643 ASP B OD2 1 ATOM 11458 N N . ARG B 2 663 ? 27.217 -16.233 -0.144 1.00 64.71 ? 644 ARG B N 1 ATOM 11459 C CA . ARG B 2 663 ? 26.792 -14.869 0.145 1.00 65.80 ? 644 ARG B CA 1 ATOM 11460 C C . ARG B 2 663 ? 27.858 -14.055 0.876 1.00 66.43 ? 644 ARG B C 1 ATOM 11461 O O . ARG B 2 663 ? 27.552 -13.337 1.827 1.00 73.27 ? 644 ARG B O 1 ATOM 11462 C CB . ARG B 2 663 ? 25.498 -14.887 0.960 1.00 64.65 ? 644 ARG B CB 1 ATOM 11463 C CG . ARG B 2 663 ? 24.343 -15.598 0.278 1.00 60.99 ? 644 ARG B CG 1 ATOM 11464 C CD . ARG B 2 663 ? 23.195 -15.840 1.248 1.00 62.14 ? 644 ARG B CD 1 ATOM 11465 N NE . ARG B 2 663 ? 22.794 -14.624 1.950 1.00 76.68 ? 644 ARG B NE 1 ATOM 11466 C CZ . ARG B 2 663 ? 21.903 -14.590 2.936 1.00 73.93 ? 644 ARG B CZ 1 ATOM 11467 N NH1 . ARG B 2 663 ? 21.317 -15.706 3.342 1.00 82.41 ? 644 ARG B NH1 1 ATOM 11468 N NH2 . ARG B 2 663 ? 21.600 -13.441 3.520 1.00 74.25 ? 644 ARG B NH2 1 ATOM 11469 N N . ASN B 2 664 ? 29.103 -14.158 0.423 1.00 71.72 ? 645 ASN B N 1 ATOM 11470 C CA . ASN B 2 664 ? 30.210 -13.450 1.062 1.00 73.50 ? 645 ASN B CA 1 ATOM 11471 C C . ASN B 2 664 ? 30.458 -12.049 0.495 1.00 67.38 ? 645 ASN B C 1 ATOM 11472 O O . ASN B 2 664 ? 31.431 -11.386 0.856 1.00 66.29 ? 645 ASN B O 1 ATOM 11473 C CB . ASN B 2 664 ? 31.490 -14.290 1.014 1.00 74.14 ? 645 ASN B CB 1 ATOM 11474 C CG . ASN B 2 664 ? 31.946 -14.589 -0.403 1.00 87.44 ? 645 ASN B CG 1 ATOM 11475 O OD1 . ASN B 2 664 ? 31.162 -14.530 -1.352 1.00 92.62 ? 645 ASN B OD1 1 ATOM 11476 N ND2 . ASN B 2 664 ? 33.224 -14.921 -0.551 1.00 88.75 ? 645 ASN B ND2 1 ATOM 11477 N N . THR B 2 665 ? 29.575 -11.604 -0.392 1.00 60.39 ? 646 THR B N 1 ATOM 11478 C CA . THR B 2 665 ? 29.649 -10.248 -0.928 1.00 67.74 ? 646 THR B CA 1 ATOM 11479 C C . THR B 2 665 ? 28.336 -9.535 -0.649 1.00 73.52 ? 646 THR B C 1 ATOM 11480 O O . THR B 2 665 ? 27.301 -10.181 -0.488 1.00 77.91 ? 646 THR B O 1 ATOM 11481 C CB . THR B 2 665 ? 29.875 -10.248 -2.440 1.00 64.02 ? 646 THR B CB 1 ATOM 11482 O OG1 . THR B 2 665 ? 28.653 -10.600 -3.097 1.00 62.61 ? 646 THR B OG1 1 ATOM 11483 C CG2 . THR B 2 665 ? 30.968 -11.236 -2.821 1.00 62.90 ? 646 THR B CG2 1 ATOM 11484 N N . TYR B 2 666 ? 28.371 -8.207 -0.603 1.00 64.94 ? 647 TYR B N 1 ATOM 11485 C CA . TYR B 2 666 ? 27.191 -7.446 -0.216 1.00 54.60 ? 647 TYR B CA 1 ATOM 11486 C C . TYR B 2 666 ? 26.029 -7.641 -1.184 1.00 55.66 ? 647 TYR B C 1 ATOM 11487 O O . TYR B 2 666 ? 24.872 -7.677 -0.766 1.00 56.21 ? 647 TYR B O 1 ATOM 11488 C CB . TYR B 2 666 ? 27.521 -5.958 -0.012 1.00 47.95 ? 647 TYR B CB 1 ATOM 11489 C CG . TYR B 2 666 ? 27.572 -5.113 -1.265 1.00 51.52 ? 647 TYR B CG 1 ATOM 11490 C CD1 . TYR B 2 666 ? 26.445 -4.431 -1.712 1.00 57.04 ? 647 TYR B CD1 1 ATOM 11491 C CD2 . TYR B 2 666 ? 28.751 -4.968 -1.983 1.00 60.32 ? 647 TYR B CD2 1 ATOM 11492 C CE1 . TYR B 2 666 ? 26.485 -3.643 -2.850 1.00 54.58 ? 647 TYR B CE1 1 ATOM 11493 C CE2 . TYR B 2 666 ? 28.801 -4.178 -3.123 1.00 62.79 ? 647 TYR B CE2 1 ATOM 11494 C CZ . TYR B 2 666 ? 27.665 -3.520 -3.552 1.00 63.96 ? 647 TYR B CZ 1 ATOM 11495 O OH . TYR B 2 666 ? 27.705 -2.737 -4.684 1.00 58.46 ? 647 TYR B OH 1 ATOM 11496 N N . GLU B 2 667 ? 26.335 -7.788 -2.470 1.00 50.43 ? 648 GLU B N 1 ATOM 11497 C CA . GLU B 2 667 ? 25.289 -7.982 -3.468 1.00 62.09 ? 648 GLU B CA 1 ATOM 11498 C C . GLU B 2 667 ? 24.639 -9.351 -3.300 1.00 73.54 ? 648 GLU B C 1 ATOM 11499 O O . GLU B 2 667 ? 23.430 -9.501 -3.488 1.00 82.42 ? 648 GLU B O 1 ATOM 11500 C CB . GLU B 2 667 ? 25.836 -7.843 -4.891 1.00 67.96 ? 648 GLU B CB 1 ATOM 11501 C CG . GLU B 2 667 ? 26.638 -6.581 -5.155 1.00 86.22 ? 648 GLU B CG 1 ATOM 11502 C CD . GLU B 2 667 ? 28.139 -6.820 -5.104 1.00 99.20 ? 648 GLU B CD 1 ATOM 11503 O OE1 . GLU B 2 667 ? 28.891 -5.989 -5.657 1.00 109.07 ? 648 GLU B OE1 1 ATOM 11504 O OE2 . GLU B 2 667 ? 28.567 -7.836 -4.513 1.00 90.90 ? 648 GLU B OE2 1 ATOM 11505 N N . LYS B 2 668 ? 25.446 -10.348 -2.948 1.00 63.13 ? 649 LYS B N 1 ATOM 11506 C CA . LYS B 2 668 ? 24.945 -11.711 -2.801 1.00 63.20 ? 649 LYS B CA 1 ATOM 11507 C C . LYS B 2 668 ? 24.315 -11.924 -1.431 1.00 64.92 ? 649 LYS B C 1 ATOM 11508 O O . LYS B 2 668 ? 23.439 -12.769 -1.270 1.00 65.93 ? 649 LYS B O 1 ATOM 11509 C CB . LYS B 2 668 ? 26.061 -12.730 -3.042 1.00 64.32 ? 649 LYS B CB 1 ATOM 11510 C CG . LYS B 2 668 ? 26.691 -12.639 -4.425 1.00 77.64 ? 649 LYS B CG 1 ATOM 11511 C CD . LYS B 2 668 ? 27.938 -13.508 -4.534 1.00 83.46 ? 649 LYS B CD 1 ATOM 11512 C CE . LYS B 2 668 ? 27.602 -14.917 -5.002 1.00 91.59 ? 649 LYS B CE 1 ATOM 11513 N NZ . LYS B 2 668 ? 27.087 -14.941 -6.400 1.00 93.51 ? 649 LYS B NZ 1 ATOM 11514 N N . TYR B 2 669 ? 24.758 -11.151 -0.446 1.00 70.36 ? 650 TYR B N 1 ATOM 11515 C CA . TYR B 2 669 ? 24.221 -11.278 0.902 1.00 64.02 ? 650 TYR B CA 1 ATOM 11516 C C . TYR B 2 669 ? 22.849 -10.622 1.024 1.00 66.39 ? 650 TYR B C 1 ATOM 11517 O O . TYR B 2 669 ? 21.978 -11.118 1.739 1.00 74.74 ? 650 TYR B O 1 ATOM 11518 C CB . TYR B 2 669 ? 25.181 -10.697 1.943 1.00 55.29 ? 650 TYR B CB 1 ATOM 11519 C CG . TYR B 2 669 ? 24.688 -10.899 3.354 1.00 52.72 ? 650 TYR B CG 1 ATOM 11520 C CD1 . TYR B 2 669 ? 24.805 -12.135 3.977 1.00 54.33 ? 650 TYR B CD1 1 ATOM 11521 C CD2 . TYR B 2 669 ? 24.082 -9.864 4.056 1.00 46.84 ? 650 TYR B CD2 1 ATOM 11522 C CE1 . TYR B 2 669 ? 24.346 -12.334 5.261 1.00 46.87 ? 650 TYR B CE1 1 ATOM 11523 C CE2 . TYR B 2 669 ? 23.617 -10.054 5.345 1.00 48.30 ? 650 TYR B CE2 1 ATOM 11524 C CZ . TYR B 2 669 ? 23.753 -11.292 5.940 1.00 46.96 ? 650 TYR B CZ 1 ATOM 11525 O OH . TYR B 2 669 ? 23.292 -11.490 7.217 1.00 53.79 ? 650 TYR B OH 1 ATOM 11526 N N . LEU B 2 670 ? 22.664 -9.507 0.322 1.00 59.07 ? 651 LEU B N 1 ATOM 11527 C CA . LEU B 2 670 ? 21.401 -8.769 0.350 1.00 57.99 ? 651 LEU B CA 1 ATOM 11528 C C . LEU B 2 670 ? 20.295 -9.403 -0.496 1.00 62.69 ? 651 LEU B C 1 ATOM 11529 O O . LEU B 2 670 ? 19.119 -9.342 -0.137 1.00 76.36 ? 651 LEU B O 1 ATOM 11530 C CB . LEU B 2 670 ? 21.627 -7.334 -0.111 1.00 63.87 ? 651 LEU B CB 1 ATOM 11531 C CG . LEU B 2 670 ? 22.388 -6.442 0.861 1.00 60.00 ? 651 LEU B CG 1 ATOM 11532 C CD1 . LEU B 2 670 ? 22.903 -5.240 0.119 1.00 70.00 ? 651 LEU B CD1 1 ATOM 11533 C CD2 . LEU B 2 670 ? 21.473 -6.022 1.986 1.00 60.98 ? 651 LEU B CD2 1 ATOM 11534 N N . GLY B 2 671 ? 20.672 -9.998 -1.622 1.00 53.76 ? 652 GLY B N 1 ATOM 11535 C CA . GLY B 2 671 ? 19.708 -10.616 -2.513 1.00 54.93 ? 652 GLY B CA 1 ATOM 11536 C C . GLY B 2 671 ? 19.336 -9.724 -3.682 1.00 67.78 ? 652 GLY B C 1 ATOM 11537 O O . GLY B 2 671 ? 19.362 -8.499 -3.572 1.00 75.11 ? 652 GLY B O 1 ATOM 11538 N N . GLU B 2 672 ? 18.984 -10.337 -4.807 1.00 70.07 ? 653 GLU B N 1 ATOM 11539 C CA . GLU B 2 672 ? 18.618 -9.572 -5.994 1.00 80.47 ? 653 GLU B CA 1 ATOM 11540 C C . GLU B 2 672 ? 17.370 -8.712 -5.774 1.00 76.23 ? 653 GLU B C 1 ATOM 11541 O O . GLU B 2 672 ? 17.271 -7.608 -6.310 1.00 82.77 ? 653 GLU B O 1 ATOM 11542 C CB . GLU B 2 672 ? 18.450 -10.489 -7.211 1.00 100.51 ? 653 GLU B CB 1 ATOM 11543 C CG . GLU B 2 672 ? 17.531 -11.679 -6.986 1.00 125.27 ? 653 GLU B CG 1 ATOM 11544 C CD . GLU B 2 672 ? 17.430 -12.577 -8.206 1.00 136.92 ? 653 GLU B CD 1 ATOM 11545 O OE1 . GLU B 2 672 ? 18.100 -12.282 -9.220 1.00 134.92 ? 653 GLU B OE1 1 ATOM 11546 O OE2 . GLU B 2 672 ? 16.680 -13.576 -8.150 1.00 141.79 ? 653 GLU B OE2 1 ATOM 11547 N N . GLU B 2 673 ? 16.431 -9.210 -4.975 1.00 72.01 ? 654 GLU B N 1 ATOM 11548 C CA . GLU B 2 673 ? 15.216 -8.455 -4.678 1.00 76.94 ? 654 GLU B CA 1 ATOM 11549 C C . GLU B 2 673 ? 15.524 -7.134 -3.981 1.00 84.24 ? 654 GLU B C 1 ATOM 11550 O O . GLU B 2 673 ? 15.028 -6.086 -4.393 1.00 86.90 ? 654 GLU B O 1 ATOM 11551 C CB . GLU B 2 673 ? 14.226 -9.284 -3.850 1.00 77.01 ? 654 GLU B CB 1 ATOM 11552 C CG . GLU B 2 673 ? 13.577 -10.427 -4.622 1.00 84.13 ? 654 GLU B CG 1 ATOM 11553 C CD . GLU B 2 673 ? 12.369 -11.013 -3.909 1.00 89.58 ? 654 GLU B CD 1 ATOM 11554 O OE1 . GLU B 2 673 ? 12.207 -10.754 -2.698 1.00 86.64 ? 654 GLU B OE1 1 ATOM 11555 O OE2 . GLU B 2 673 ? 11.579 -11.729 -4.563 1.00 87.41 ? 654 GLU B OE2 1 ATOM 11556 N N . TYR B 2 674 ? 16.343 -7.182 -2.934 1.00 88.78 ? 655 TYR B N 1 ATOM 11557 C CA . TYR B 2 674 ? 16.726 -5.962 -2.230 1.00 84.98 ? 655 TYR B CA 1 ATOM 11558 C C . TYR B 2 674 ? 17.474 -5.009 -3.156 1.00 88.29 ? 655 TYR B C 1 ATOM 11559 O O . TYR B 2 674 ? 17.192 -3.817 -3.175 1.00 90.48 ? 655 TYR B O 1 ATOM 11560 C CB . TYR B 2 674 ? 17.576 -6.260 -0.988 1.00 77.44 ? 655 TYR B CB 1 ATOM 11561 C CG . TYR B 2 674 ? 17.987 -5.005 -0.244 1.00 76.46 ? 655 TYR B CG 1 ATOM 11562 C CD1 . TYR B 2 674 ? 17.228 -4.523 0.813 1.00 76.26 ? 655 TYR B CD1 1 ATOM 11563 C CD2 . TYR B 2 674 ? 19.123 -4.292 -0.611 1.00 78.87 ? 655 TYR B CD2 1 ATOM 11564 C CE1 . TYR B 2 674 ? 17.592 -3.370 1.484 1.00 82.21 ? 655 TYR B CE1 1 ATOM 11565 C CE2 . TYR B 2 674 ? 19.491 -3.136 0.051 1.00 83.83 ? 655 TYR B CE2 1 ATOM 11566 C CZ . TYR B 2 674 ? 18.725 -2.680 1.098 1.00 82.48 ? 655 TYR B CZ 1 ATOM 11567 O OH . TYR B 2 674 ? 19.096 -1.530 1.760 1.00 75.96 ? 655 TYR B OH 1 ATOM 11568 N N . VAL B 2 675 ? 18.431 -5.538 -3.913 1.00 89.71 ? 656 VAL B N 1 ATOM 11569 C CA . VAL B 2 675 ? 19.260 -4.717 -4.791 1.00 85.82 ? 656 VAL B CA 1 ATOM 11570 C C . VAL B 2 675 ? 18.436 -4.006 -5.866 1.00 88.46 ? 656 VAL B C 1 ATOM 11571 O O . VAL B 2 675 ? 18.600 -2.806 -6.091 1.00 89.03 ? 656 VAL B O 1 ATOM 11572 C CB . VAL B 2 675 ? 20.383 -5.548 -5.449 1.00 75.12 ? 656 VAL B CB 1 ATOM 11573 C CG1 . VAL B 2 675 ? 21.126 -4.725 -6.496 1.00 66.71 ? 656 VAL B CG1 1 ATOM 11574 C CG2 . VAL B 2 675 ? 21.343 -6.056 -4.393 1.00 62.16 ? 656 VAL B CG2 1 ATOM 11575 N N . LYS B 2 676 ? 17.545 -4.746 -6.518 1.00 91.91 ? 657 LYS B N 1 ATOM 11576 C CA . LYS B 2 676 ? 16.684 -4.164 -7.544 1.00 99.70 ? 657 LYS B CA 1 ATOM 11577 C C . LYS B 2 676 ? 15.744 -3.118 -6.952 1.00 93.92 ? 657 LYS B C 1 ATOM 11578 O O . LYS B 2 676 ? 15.422 -2.122 -7.602 1.00 109.30 ? 657 LYS B O 1 ATOM 11579 C CB . LYS B 2 676 ? 15.887 -5.253 -8.272 1.00 113.36 ? 657 LYS B CB 1 ATOM 11580 C CG . LYS B 2 676 ? 16.731 -6.126 -9.197 1.00 123.33 ? 657 LYS B CG 1 ATOM 11581 C CD . LYS B 2 676 ? 15.898 -7.199 -9.894 1.00 124.03 ? 657 LYS B CD 1 ATOM 11582 C CE . LYS B 2 676 ? 16.768 -8.083 -10.787 1.00 117.33 ? 657 LYS B CE 1 ATOM 11583 N NZ . LYS B 2 676 ? 15.989 -9.139 -11.498 1.00 106.85 ? 657 LYS B NZ 1 ATOM 11584 N N . ALA B 2 677 ? 15.318 -3.346 -5.714 1.00 83.11 ? 658 ALA B N 1 ATOM 11585 C CA . ALA B 2 677 ? 14.414 -2.430 -5.026 1.00 78.59 ? 658 ALA B CA 1 ATOM 11586 C C . ALA B 2 677 ? 15.060 -1.071 -4.772 1.00 81.71 ? 658 ALA B C 1 ATOM 11587 O O . ALA B 2 677 ? 14.508 -0.042 -5.154 1.00 96.93 ? 658 ALA B O 1 ATOM 11588 C CB . ALA B 2 677 ? 13.924 -3.039 -3.725 1.00 74.96 ? 658 ALA B CB 1 ATOM 11589 N N . VAL B 2 678 ? 16.225 -1.041 -4.174 1.00 73.97 ? 659 VAL B N 1 ATOM 11590 C CA . VAL B 2 678 ? 16.816 0.241 -3.931 1.00 93.96 ? 659 VAL B CA 1 ATOM 11591 C C . VAL B 2 678 ? 17.438 0.736 -5.186 1.00 104.29 ? 659 VAL B C 1 ATOM 11592 O O . VAL B 2 678 ? 16.771 0.929 -6.170 1.00 117.53 ? 659 VAL B O 1 ATOM 11593 C CB . VAL B 2 678 ? 17.896 0.183 -2.905 1.00 100.54 ? 659 VAL B CB 1 ATOM 11594 C CG1 . VAL B 2 678 ? 17.388 -0.432 -1.664 1.00 96.74 ? 659 VAL B CG1 1 ATOM 11595 C CG2 . VAL B 2 678 ? 19.052 -0.557 -3.438 1.00 107.69 ? 659 VAL B CG2 1 ATOM 11596 N N . GLY B 2 679 ? 18.736 0.943 -5.152 1.00 110.21 ? 660 GLY B N 1 ATOM 11597 C CA . GLY B 2 679 ? 19.410 1.516 -6.289 1.00 125.31 ? 660 GLY B CA 1 ATOM 11598 C C . GLY B 2 679 ? 18.698 2.794 -6.662 1.00 133.17 ? 660 GLY B C 1 ATOM 11599 O O . GLY B 2 679 ? 19.038 3.890 -6.224 1.00 135.81 ? 660 GLY B O 1 ATOM 11600 N N . ASN B 2 680 ? 17.674 2.664 -7.471 1.00 131.19 ? 661 ASN B N 1 ATOM 11601 C CA . ASN B 2 680 ? 16.883 3.824 -7.743 1.00 132.02 ? 661 ASN B CA 1 ATOM 11602 C C . ASN B 2 680 ? 16.892 4.748 -6.531 1.00 127.50 ? 661 ASN B C 1 ATOM 11603 O O . ASN B 2 680 ? 17.648 5.701 -6.503 1.00 136.85 ? 661 ASN B O 1 ATOM 11604 C CB . ASN B 2 680 ? 15.487 3.387 -8.110 1.00 133.54 ? 661 ASN B CB 1 ATOM 11605 C CG . ASN B 2 680 ? 15.491 2.097 -8.864 1.00 163.60 ? 661 ASN B CG 1 ATOM 11606 O OD1 . ASN B 2 680 ? 14.465 1.450 -9.048 1.00 159.98 ? 661 ASN B OD1 1 ATOM 11607 N ND2 . ASN B 2 680 ? 16.662 1.701 -9.297 1.00 167.26 ? 661 ASN B ND2 1 ATOM 11608 N N . LEU B 2 681 ? 16.064 4.461 -5.532 1.00 107.76 ? 662 LEU B N 1 ATOM 11609 C CA . LEU B 2 681 ? 15.914 5.361 -4.415 1.00 86.33 ? 662 LEU B CA 1 ATOM 11610 C C . LEU B 2 681 ? 17.277 5.840 -4.038 1.00 99.74 ? 662 LEU B C 1 ATOM 11611 O O . LEU B 2 681 ? 17.422 6.873 -3.418 1.00 103.01 ? 662 LEU B O 1 ATOM 11612 C CB . LEU B 2 681 ? 15.208 4.708 -3.240 1.00 78.36 ? 662 LEU B CB 1 ATOM 11613 N N . ARG B 2 682 ? 18.290 5.079 -4.396 1.00 119.49 ? 663 ARG B N 1 ATOM 11614 C CA . ARG B 2 682 ? 19.641 5.532 -4.186 1.00 126.71 ? 663 ARG B CA 1 ATOM 11615 C C . ARG B 2 682 ? 19.699 6.785 -4.991 1.00 121.50 ? 663 ARG B C 1 ATOM 11616 O O . ARG B 2 682 ? 18.675 7.351 -5.275 1.00 117.78 ? 663 ARG B O 1 ATOM 11617 C CB . ARG B 2 682 ? 20.644 4.511 -4.702 1.00 126.23 ? 663 ARG B CB 1 ATOM 11618 N N . LYS B 2 683 ? 20.882 7.228 -5.370 1.00 118.77 ? 664 LYS B N 1 ATOM 11619 C CA . LYS B 2 683 ? 20.971 8.402 -6.200 1.00 126.10 ? 664 LYS B CA 1 ATOM 11620 C C . LYS B 2 683 ? 19.717 9.244 -6.044 1.00 130.35 ? 664 LYS B C 1 ATOM 11621 O O . LYS B 2 683 ? 18.908 9.345 -6.944 1.00 124.62 ? 664 LYS B O 1 ATOM 11622 C CB . LYS B 2 683 ? 21.101 7.975 -7.647 1.00 127.75 ? 664 LYS B CB 1 ATOM 11623 N N . CYS B 2 684 ? 19.542 9.836 -4.884 1.00 132.65 ? 665 CYS B N 1 ATOM 11624 C CA . CYS B 2 684 ? 18.289 10.518 -4.589 1.00 130.37 ? 665 CYS B CA 1 ATOM 11625 C C . CYS B 2 684 ? 18.266 10.436 -3.068 1.00 127.66 ? 665 CYS B C 1 ATOM 11626 O O . CYS B 2 684 ? 17.419 11.019 -2.391 1.00 126.69 ? 665 CYS B O 1 ATOM 11627 C CB . CYS B 2 684 ? 17.092 9.796 -5.218 1.00 127.68 ? 665 CYS B CB 1 ATOM 11628 S SG . CYS B 2 684 ? 15.514 9.908 -4.329 1.00 125.14 ? 665 CYS B SG 1 ATOM 11629 N N . SER B 2 685 ? 19.262 9.719 -2.551 1.00 122.19 ? 666 SER B N 1 ATOM 11630 C CA . SER B 2 685 ? 19.432 9.469 -1.126 1.00 110.35 ? 666 SER B CA 1 ATOM 11631 C C . SER B 2 685 ? 20.010 10.662 -0.373 1.00 111.94 ? 666 SER B C 1 ATOM 11632 O O . SER B 2 685 ? 20.336 11.695 -0.964 1.00 110.96 ? 666 SER B O 1 ATOM 11633 C CB . SER B 2 685 ? 20.342 8.258 -0.925 1.00 107.80 ? 666 SER B CB 1 ATOM 11634 O OG . SER B 2 685 ? 20.859 8.230 0.391 1.00 109.51 ? 666 SER B OG 1 ATOM 11635 N N . THR B 2 686 ? 20.145 10.496 0.940 1.00 112.88 ? 667 THR B N 1 ATOM 11636 C CA . THR B 2 686 ? 20.601 11.569 1.817 1.00 116.71 ? 667 THR B CA 1 ATOM 11637 C C . THR B 2 686 ? 21.920 11.224 2.515 1.00 110.64 ? 667 THR B C 1 ATOM 11638 O O . THR B 2 686 ? 22.666 12.119 2.920 1.00 99.77 ? 667 THR B O 1 ATOM 11639 C CB . THR B 2 686 ? 19.511 11.935 2.862 1.00 102.96 ? 667 THR B CB 1 ATOM 11640 O OG1 . THR B 2 686 ? 19.272 13.347 2.836 1.00 101.61 ? 667 THR B OG1 1 ATOM 11641 C CG2 . THR B 2 686 ? 19.914 11.510 4.274 1.00 101.16 ? 667 THR B CG2 1 ATOM 11642 N N . SER B 2 687 ? 22.197 9.925 2.636 1.00 107.19 ? 668 SER B N 1 ATOM 11643 C CA . SER B 2 687 ? 23.405 9.423 3.294 1.00 91.49 ? 668 SER B CA 1 ATOM 11644 C C . SER B 2 687 ? 24.668 9.989 2.664 1.00 80.66 ? 668 SER B C 1 ATOM 11645 O O . SER B 2 687 ? 24.943 9.748 1.491 1.00 68.04 ? 668 SER B O 1 ATOM 11646 C CB . SER B 2 687 ? 23.446 7.894 3.227 1.00 84.57 ? 668 SER B CB 1 ATOM 11647 O OG . SER B 2 687 ? 24.700 7.391 3.662 1.00 68.66 ? 668 SER B OG 1 ATOM 11648 N N . SER B 2 688 ? 25.439 10.734 3.448 1.00 81.19 ? 669 SER B N 1 ATOM 11649 C CA . SER B 2 688 ? 26.625 11.395 2.917 1.00 81.91 ? 669 SER B CA 1 ATOM 11650 C C . SER B 2 688 ? 27.788 10.425 2.744 1.00 78.73 ? 669 SER B C 1 ATOM 11651 O O . SER B 2 688 ? 28.727 10.702 1.999 1.00 81.41 ? 669 SER B O 1 ATOM 11652 C CB . SER B 2 688 ? 27.034 12.581 3.795 1.00 73.22 ? 669 SER B CB 1 ATOM 11653 O OG . SER B 2 688 ? 27.450 12.152 5.077 1.00 81.85 ? 669 SER B OG 1 ATOM 11654 N N . LEU B 2 689 ? 27.726 9.290 3.435 1.00 67.98 ? 670 LEU B N 1 ATOM 11655 C CA . LEU B 2 689 ? 28.745 8.260 3.280 1.00 68.38 ? 670 LEU B CA 1 ATOM 11656 C C . LEU B 2 689 ? 28.568 7.564 1.937 1.00 67.83 ? 670 LEU B C 1 ATOM 11657 O O . LEU B 2 689 ? 29.538 7.349 1.209 1.00 70.36 ? 670 LEU B O 1 ATOM 11658 C CB . LEU B 2 689 ? 28.683 7.241 4.420 1.00 58.00 ? 670 LEU B CB 1 ATOM 11659 C CG . LEU B 2 689 ? 29.816 6.209 4.437 1.00 56.24 ? 670 LEU B CG 1 ATOM 11660 C CD1 . LEU B 2 689 ? 31.171 6.888 4.529 1.00 71.12 ? 670 LEU B CD1 1 ATOM 11661 C CD2 . LEU B 2 689 ? 29.631 5.223 5.580 1.00 54.21 ? 670 LEU B CD2 1 ATOM 11662 N N . LEU B 2 690 ? 27.322 7.225 1.614 1.00 68.08 ? 671 LEU B N 1 ATOM 11663 C CA . LEU B 2 690 ? 27.000 6.612 0.329 1.00 62.38 ? 671 LEU B CA 1 ATOM 11664 C C . LEU B 2 690 ? 27.437 7.518 -0.812 1.00 71.88 ? 671 LEU B C 1 ATOM 11665 O O . LEU B 2 690 ? 28.006 7.056 -1.798 1.00 78.90 ? 671 LEU B O 1 ATOM 11666 C CB . LEU B 2 690 ? 25.503 6.314 0.224 1.00 61.45 ? 671 LEU B CB 1 ATOM 11667 C CG . LEU B 2 690 ? 25.066 5.609 -1.066 1.00 73.96 ? 671 LEU B CG 1 ATOM 11668 C CD1 . LEU B 2 690 ? 25.893 4.356 -1.290 1.00 79.68 ? 671 LEU B CD1 1 ATOM 11669 C CD2 . LEU B 2 690 ? 23.579 5.268 -1.052 1.00 59.25 ? 671 LEU B CD2 1 ATOM 11670 N N . GLU B 2 691 ? 27.182 8.813 -0.659 1.00 72.78 ? 672 GLU B N 1 ATOM 11671 C CA . GLU B 2 691 ? 27.569 9.795 -1.662 1.00 79.88 ? 672 GLU B CA 1 ATOM 11672 C C . GLU B 2 691 ? 29.076 9.765 -1.887 1.00 85.91 ? 672 GLU B C 1 ATOM 11673 O O . GLU B 2 691 ? 29.541 9.779 -3.027 1.00 95.62 ? 672 GLU B O 1 ATOM 11674 C CB . GLU B 2 691 ? 27.129 11.198 -1.236 1.00 82.59 ? 672 GLU B CB 1 ATOM 11675 C CG . GLU B 2 691 ? 27.353 12.271 -2.294 1.00 86.98 ? 672 GLU B CG 1 ATOM 11676 C CD . GLU B 2 691 ? 27.459 13.664 -1.704 1.00 94.64 ? 672 GLU B CD 1 ATOM 11677 O OE1 . GLU B 2 691 ? 28.015 13.798 -0.592 1.00 102.38 ? 672 GLU B OE1 1 ATOM 11678 O OE2 . GLU B 2 691 ? 26.987 14.624 -2.350 1.00 88.73 ? 672 GLU B OE2 1 ATOM 11679 N N . ALA B 2 692 ? 29.832 9.709 -0.795 1.00 85.67 ? 673 ALA B N 1 ATOM 11680 C CA . ALA B 2 692 ? 31.290 9.737 -0.858 1.00 88.63 ? 673 ALA B CA 1 ATOM 11681 C C . ALA B 2 692 ? 31.870 8.498 -1.531 1.00 81.96 ? 673 ALA B C 1 ATOM 11682 O O . ALA B 2 692 ? 32.774 8.594 -2.359 1.00 92.38 ? 673 ALA B O 1 ATOM 11683 C CB . ALA B 2 692 ? 31.874 9.903 0.533 1.00 91.08 ? 673 ALA B CB 1 ATOM 11684 N N . CYS B 2 693 ? 31.347 7.333 -1.177 1.00 67.83 ? 674 CYS B N 1 ATOM 11685 C CA . CYS B 2 693 ? 31.857 6.085 -1.734 1.00 76.30 ? 674 CYS B CA 1 ATOM 11686 C C . CYS B 2 693 ? 31.404 5.880 -3.180 1.00 77.22 ? 674 CYS B C 1 ATOM 11687 O O . CYS B 2 693 ? 32.032 5.147 -3.941 1.00 81.03 ? 674 CYS B O 1 ATOM 11688 C CB . CYS B 2 693 ? 31.440 4.902 -0.860 1.00 57.83 ? 674 CYS B CB 1 ATOM 11689 S SG . CYS B 2 693 ? 31.931 5.071 0.875 1.00 70.06 ? 674 CYS B SG 1 ATOM 11690 N N . THR B 2 694 ? 30.311 6.536 -3.552 1.00 71.33 ? 675 THR B N 1 ATOM 11691 C CA . THR B 2 694 ? 29.810 6.479 -4.920 1.00 64.29 ? 675 THR B CA 1 ATOM 11692 C C . THR B 2 694 ? 30.683 7.339 -5.834 1.00 71.17 ? 675 THR B C 1 ATOM 11693 O O . THR B 2 694 ? 30.751 7.120 -7.041 1.00 73.02 ? 675 THR B O 1 ATOM 11694 C CB . THR B 2 694 ? 28.324 6.906 -4.982 1.00 72.99 ? 675 THR B CB 1 ATOM 11695 O OG1 . THR B 2 694 ? 27.530 5.937 -4.284 1.00 69.56 ? 675 THR B OG1 1 ATOM 11696 C CG2 . THR B 2 694 ? 27.824 7.004 -6.416 1.00 66.94 ? 675 THR B CG2 1 ATOM 11697 N N . PHE B 2 695 ? 31.384 8.300 -5.248 1.00 77.24 ? 676 PHE B N 1 ATOM 11698 C CA . PHE B 2 695 ? 32.290 9.139 -6.019 1.00 80.43 ? 676 PHE B CA 1 ATOM 11699 C C . PHE B 2 695 ? 33.539 8.362 -6.444 1.00 84.99 ? 676 PHE B C 1 ATOM 11700 O O . PHE B 2 695 ? 34.174 8.691 -7.449 1.00 91.95 ? 676 PHE B O 1 ATOM 11701 C CB . PHE B 2 695 ? 32.672 10.388 -5.223 1.00 74.50 ? 676 PHE B CB 1 ATOM 11702 C CG . PHE B 2 695 ? 33.609 11.309 -5.950 1.00 73.70 ? 676 PHE B CG 1 ATOM 11703 C CD1 . PHE B 2 695 ? 33.140 12.164 -6.928 1.00 76.51 ? 676 PHE B CD1 1 ATOM 11704 C CD2 . PHE B 2 695 ? 34.960 11.326 -5.646 1.00 73.38 ? 676 PHE B CD2 1 ATOM 11705 C CE1 . PHE B 2 695 ? 34.002 13.011 -7.593 1.00 79.00 ? 676 PHE B CE1 1 ATOM 11706 C CE2 . PHE B 2 695 ? 35.825 12.175 -6.307 1.00 75.80 ? 676 PHE B CE2 1 ATOM 11707 C CZ . PHE B 2 695 ? 35.345 13.015 -7.280 1.00 78.63 ? 676 PHE B CZ 1 ATOM 11708 N N . ARG B 2 696 ? 33.883 7.331 -5.677 1.00 77.00 ? 677 ARG B N 1 ATOM 11709 C CA . ARG B 2 696 ? 35.053 6.509 -5.981 1.00 81.70 ? 677 ARG B CA 1 ATOM 11710 C C . ARG B 2 696 ? 34.689 5.234 -6.742 1.00 83.16 ? 677 ARG B C 1 ATOM 11711 O O . ARG B 2 696 ? 35.506 4.689 -7.486 1.00 75.32 ? 677 ARG B O 1 ATOM 11712 C CB . ARG B 2 696 ? 35.818 6.162 -4.703 1.00 69.41 ? 677 ARG B CB 1 ATOM 11713 C CG . ARG B 2 696 ? 36.531 7.342 -4.083 1.00 70.02 ? 677 ARG B CG 1 ATOM 11714 C CD . ARG B 2 696 ? 37.194 6.957 -2.775 1.00 73.19 ? 677 ARG B CD 1 ATOM 11715 N NE . ARG B 2 696 ? 38.239 5.956 -2.959 1.00 68.97 ? 677 ARG B NE 1 ATOM 11716 C CZ . ARG B 2 696 ? 38.337 4.837 -2.249 1.00 74.85 ? 677 ARG B CZ 1 ATOM 11717 N NH1 . ARG B 2 696 ? 37.449 4.568 -1.296 1.00 71.70 ? 677 ARG B NH1 1 ATOM 11718 N NH2 . ARG B 2 696 ? 39.328 3.989 -2.491 1.00 77.76 ? 677 ARG B NH2 1 ATOM 11719 N N . ARG B 2 697 ? 33.461 4.763 -6.553 1.00 78.90 ? 678 ARG B N 1 ATOM 11720 C CA . ARG B 2 697 ? 32.991 3.583 -7.265 1.00 81.59 ? 678 ARG B CA 1 ATOM 11721 C C . ARG B 2 697 ? 31.495 3.664 -7.546 1.00 74.87 ? 678 ARG B C 1 ATOM 11722 O O . ARG B 2 697 ? 30.680 3.227 -6.731 1.00 75.86 ? 678 ARG B O 1 ATOM 11723 C CB . ARG B 2 697 ? 33.317 2.311 -6.482 1.00 87.39 ? 678 ARG B CB 1 ATOM 11724 C CG . ARG B 2 697 ? 33.018 1.029 -7.240 1.00 97.32 ? 678 ARG B CG 1 ATOM 11725 C CD . ARG B 2 697 ? 33.187 -0.194 -6.353 1.00 104.95 ? 678 ARG B CD 1 ATOM 11726 N NE . ARG B 2 697 ? 32.871 -1.424 -7.070 1.00 106.41 ? 678 ARG B NE 1 ATOM 11727 C CZ . ARG B 2 697 ? 33.746 -2.103 -7.801 1.00 107.15 ? 678 ARG B CZ 1 ATOM 11728 N NH1 . ARG B 2 697 ? 34.995 -1.671 -7.909 1.00 112.44 ? 678 ARG B NH1 1 ATOM 11729 N NH2 . ARG B 2 697 ? 33.374 -3.212 -8.423 1.00 105.89 ? 678 ARG B NH2 1 ATOM 11730 N N . PRO B 2 698 ? 31.128 4.226 -8.710 1.00 75.21 ? 679 PRO B N 1 ATOM 11731 C CA . PRO B 2 698 ? 32.058 4.779 -9.702 1.00 78.88 ? 679 PRO B CA 1 ATOM 11732 C C . PRO B 2 698 ? 32.432 6.229 -9.403 1.00 93.88 ? 679 PRO B C 1 ATOM 11733 O O . PRO B 2 698 ? 32.691 6.999 -10.331 1.00 94.19 ? 679 PRO B O 1 ATOM 11734 C CB . PRO B 2 698 ? 31.250 4.709 -10.995 1.00 80.65 ? 679 PRO B CB 1 ATOM 11735 C CG . PRO B 2 698 ? 29.845 4.899 -10.544 1.00 77.78 ? 679 PRO B CG 1 ATOM 11736 C CD . PRO B 2 698 ? 29.739 4.221 -9.205 1.00 73.81 ? 679 PRO B CD 1 HETATM 11737 C C1 . C8E C 3 . ? 42.644 -53.653 16.710 1.00 111.72 ? 1001 C8E A C1 1 HETATM 11738 C C2 . C8E C 3 . ? 41.837 -53.507 17.996 1.00 113.94 ? 1001 C8E A C2 1 HETATM 11739 C C3 . C8E C 3 . ? 41.845 -54.800 18.805 1.00 107.60 ? 1001 C8E A C3 1 HETATM 11740 C C4 . C8E C 3 . ? 41.593 -54.529 20.284 1.00 99.99 ? 1001 C8E A C4 1 HETATM 11741 C C5 . C8E C 3 . ? 40.277 -55.154 20.731 1.00 95.41 ? 1001 C8E A C5 1 HETATM 11742 C C6 . C8E C 3 . ? 40.460 -55.974 22.004 1.00 97.17 ? 1001 C8E A C6 1 HETATM 11743 C C7 . C8E C 3 . ? 39.114 -56.367 22.606 1.00 101.61 ? 1001 C8E A C7 1 HETATM 11744 C C8 . C8E C 3 . ? 38.232 -57.063 21.575 1.00 108.62 ? 1001 C8E A C8 1 HETATM 11745 O O9 . C8E C 3 . ? 36.878 -56.727 21.789 1.00 117.33 ? 1001 C8E A O9 1 HETATM 11746 C C10 . C8E C 3 . ? 36.537 -55.457 21.272 1.00 118.44 ? 1001 C8E A C10 1 HETATM 11747 C C11 . C8E C 3 . ? 35.016 -55.324 21.207 1.00 118.44 ? 1001 C8E A C11 1 HETATM 11748 O O12 . C8E C 3 . ? 34.484 -55.149 22.504 1.00 113.64 ? 1001 C8E A O12 1 HETATM 11749 C C13 . C8E C 3 . ? 33.755 -53.948 22.635 1.00 104.97 ? 1001 C8E A C13 1 HETATM 11750 C C14 . C8E C 3 . ? 34.693 -52.816 23.045 1.00 104.25 ? 1001 C8E A C14 1 HETATM 11751 O O15 . C8E C 3 . ? 34.608 -51.774 22.099 1.00 101.85 ? 1001 C8E A O15 1 HETATM 11752 C C16 . C8E C 3 . ? 35.737 -51.705 21.256 1.00 100.45 ? 1001 C8E A C16 1 HETATM 11753 C C17 . C8E C 3 . ? 36.908 -51.080 22.002 1.00 100.61 ? 1001 C8E A C17 1 HETATM 11754 O O18 . C8E C 3 . ? 37.979 -50.866 21.106 1.00 106.01 ? 1001 C8E A O18 1 HETATM 11755 C C19 . C8E C 3 . ? 37.757 -49.777 20.235 1.00 96.71 ? 1001 C8E A C19 1 HETATM 11756 C C20 . C8E C 3 . ? 38.649 -48.604 20.636 1.00 81.04 ? 1001 C8E A C20 1 HETATM 11757 O O21 . C8E C 3 . ? 39.695 -48.451 19.701 1.00 70.68 ? 1001 C8E A O21 1 HETATM 11758 C C1 . C8E D 3 . ? 29.315 -15.988 44.997 1.00 48.41 ? 1002 C8E A C1 1 HETATM 11759 C C2 . C8E D 3 . ? 28.126 -16.149 45.940 1.00 60.07 ? 1002 C8E A C2 1 HETATM 11760 C C3 . C8E D 3 . ? 27.069 -17.087 45.363 1.00 66.94 ? 1002 C8E A C3 1 HETATM 11761 C C4 . C8E D 3 . ? 26.384 -17.933 46.437 1.00 67.98 ? 1002 C8E A C4 1 HETATM 11762 C C5 . C8E D 3 . ? 26.422 -19.430 46.116 1.00 61.79 ? 1002 C8E A C5 1 HETATM 11763 C C6 . C8E D 3 . ? 25.858 -20.260 47.269 1.00 66.72 ? 1002 C8E A C6 1 HETATM 11764 C C7 . C8E D 3 . ? 24.459 -19.782 47.663 1.00 76.55 ? 1002 C8E A C7 1 HETATM 11765 C C8 . C8E D 3 . ? 24.009 -20.243 49.053 1.00 87.21 ? 1002 C8E A C8 1 HETATM 11766 O O9 . C8E D 3 . ? 23.512 -21.570 49.045 1.00 95.22 ? 1002 C8E A O9 1 HETATM 11767 C C10 . C8E D 3 . ? 22.453 -21.749 49.963 1.00 82.41 ? 1002 C8E A C10 1 HETATM 11768 C C11 . C8E D 3 . ? 22.789 -22.890 50.913 1.00 80.84 ? 1002 C8E A C11 1 HETATM 11769 O O12 . C8E D 3 . ? 21.620 -23.435 51.481 1.00 77.69 ? 1002 C8E A O12 1 HETATM 11770 C C13 . C8E D 3 . ? 21.525 -24.787 51.104 1.00 65.53 ? 1002 C8E A C13 1 HETATM 11771 C C14 . C8E D 3 . ? 20.102 -25.319 50.995 1.00 70.11 ? 1002 C8E A C14 1 HETATM 11772 O O15 . C8E D 3 . ? 20.246 -26.701 50.762 1.00 85.77 ? 1002 C8E A O15 1 HETATM 11773 C C16 . C8E D 3 . ? 19.715 -27.624 51.702 1.00 88.61 ? 1002 C8E A C16 1 HETATM 11774 C C17 . C8E D 3 . ? 18.666 -27.020 52.632 1.00 92.84 ? 1002 C8E A C17 1 HETATM 11775 O O18 . C8E D 3 . ? 17.438 -27.622 52.336 1.00 98.17 ? 1002 C8E A O18 1 HETATM 11776 C C19 . C8E D 3 . ? 17.531 -29.035 52.227 1.00 105.85 ? 1002 C8E A C19 1 HETATM 11777 C C20 . C8E D 3 . ? 16.155 -29.707 52.201 1.00 106.07 ? 1002 C8E A C20 1 HETATM 11778 O O21 . C8E D 3 . ? 16.199 -30.868 52.997 1.00 96.40 ? 1002 C8E A O21 1 HETATM 11779 C C1 . NAG E 4 . ? 14.813 -20.025 9.978 1.00 54.10 ? 701 NAG B C1 1 HETATM 11780 C C2 . NAG E 4 . ? 14.955 -21.115 8.917 1.00 62.30 ? 701 NAG B C2 1 HETATM 11781 C C3 . NAG E 4 . ? 13.993 -20.949 7.742 1.00 67.22 ? 701 NAG B C3 1 HETATM 11782 C C4 . NAG E 4 . ? 12.660 -20.289 8.094 1.00 67.24 ? 701 NAG B C4 1 HETATM 11783 C C5 . NAG E 4 . ? 12.756 -19.267 9.219 1.00 77.29 ? 701 NAG B C5 1 HETATM 11784 C C6 . NAG E 4 . ? 11.382 -18.821 9.712 1.00 82.04 ? 701 NAG B C6 1 HETATM 11785 C C7 . NAG E 4 . ? 17.171 -22.109 8.712 1.00 64.98 ? 701 NAG B C7 1 HETATM 11786 C C8 . NAG E 4 . ? 18.387 -22.221 7.839 1.00 69.07 ? 701 NAG B C8 1 HETATM 11787 N N2 . NAG E 4 . ? 16.314 -21.138 8.402 1.00 59.33 ? 701 NAG B N2 1 HETATM 11788 O O3 . NAG E 4 . ? 13.741 -22.222 7.181 1.00 76.38 ? 701 NAG B O3 1 HETATM 11789 O O4 . NAG E 4 . ? 12.223 -19.621 6.940 1.00 62.99 ? 701 NAG B O4 1 HETATM 11790 O O5 . NAG E 4 . ? 13.456 -19.835 10.294 1.00 73.97 ? 701 NAG B O5 1 HETATM 11791 O O6 . NAG E 4 . ? 10.618 -19.949 10.082 1.00 86.50 ? 701 NAG B O6 1 HETATM 11792 O O7 . NAG E 4 . ? 17.004 -22.882 9.660 1.00 57.23 ? 701 NAG B O7 1 HETATM 11793 C C1 . NAG F 4 . ? 10.999 -20.194 6.455 1.00 66.40 ? 702 NAG B C1 1 HETATM 11794 C C2 . NAG F 4 . ? 10.381 -19.153 5.534 1.00 70.13 ? 702 NAG B C2 1 HETATM 11795 C C3 . NAG F 4 . ? 9.058 -19.654 4.991 1.00 66.44 ? 702 NAG B C3 1 HETATM 11796 C C4 . NAG F 4 . ? 9.268 -21.005 4.321 1.00 64.05 ? 702 NAG B C4 1 HETATM 11797 C C5 . NAG F 4 . ? 9.993 -21.991 5.248 1.00 57.54 ? 702 NAG B C5 1 HETATM 11798 C C6 . NAG F 4 . ? 10.384 -23.282 4.530 1.00 68.74 ? 702 NAG B C6 1 HETATM 11799 C C7 . NAG F 4 . ? 11.079 -16.900 5.997 1.00 67.31 ? 702 NAG B C7 1 HETATM 11800 C C8 . NAG F 4 . ? 10.978 -15.702 6.899 1.00 55.43 ? 702 NAG B C8 1 HETATM 11801 N N2 . NAG F 4 . ? 10.224 -17.893 6.232 1.00 67.28 ? 702 NAG B N2 1 HETATM 11802 O O3 . NAG F 4 . ? 8.536 -18.722 4.072 1.00 71.65 ? 702 NAG B O3 1 HETATM 11803 O O4 . NAG F 4 . ? 7.985 -21.468 3.971 1.00 69.95 ? 702 NAG B O4 1 HETATM 11804 O O5 . NAG F 4 . ? 11.175 -21.427 5.785 1.00 60.38 ? 702 NAG B O5 1 HETATM 11805 O O6 . NAG F 4 . ? 10.875 -24.230 5.451 1.00 80.90 ? 702 NAG B O6 1 HETATM 11806 O O7 . NAG F 4 . ? 11.922 -16.945 5.094 1.00 58.94 ? 702 NAG B O7 1 HETATM 11807 C C1 . BMA G 5 . ? 7.895 -21.893 2.596 1.00 63.79 ? 703 BMA B C1 1 HETATM 11808 C C2 . BMA G 5 . ? 6.778 -22.917 2.630 1.00 54.41 ? 703 BMA B C2 1 HETATM 11809 C C3 . BMA G 5 . ? 6.726 -23.546 1.212 1.00 62.81 ? 703 BMA B C3 1 HETATM 11810 C C4 . BMA G 5 . ? 6.338 -22.419 0.256 1.00 64.36 ? 703 BMA B C4 1 HETATM 11811 C C5 . BMA G 5 . ? 7.499 -21.401 0.304 1.00 73.05 ? 703 BMA B C5 1 HETATM 11812 C C6 . BMA G 5 . ? 7.185 -20.286 -0.705 1.00 85.63 ? 703 BMA B C6 1 HETATM 11813 O O2 . BMA G 5 . ? 5.539 -22.324 2.843 1.00 65.32 ? 703 BMA B O2 1 HETATM 11814 O O3 . BMA G 5 . ? 5.763 -24.555 1.076 1.00 62.04 ? 703 BMA B O3 1 HETATM 11815 O O4 . BMA G 5 . ? 6.310 -22.896 -1.053 1.00 71.96 ? 703 BMA B O4 1 HETATM 11816 O O5 . BMA G 5 . ? 7.597 -20.872 1.628 1.00 72.50 ? 703 BMA B O5 1 HETATM 11817 O O6 . BMA G 5 . ? 7.556 -19.085 -0.132 1.00 108.13 ? 703 BMA B O6 1 HETATM 11818 C C1 . MAN H 6 . ? 5.788 -25.336 2.281 1.00 91.61 ? 704 MAN B C1 1 HETATM 11819 C C2 . MAN H 6 . ? 6.712 -26.530 2.126 1.00 114.43 ? 704 MAN B C2 1 HETATM 11820 C C3 . MAN H 6 . ? 5.935 -27.800 2.442 1.00 116.07 ? 704 MAN B C3 1 HETATM 11821 C C4 . MAN H 6 . ? 4.550 -27.897 1.778 1.00 107.73 ? 704 MAN B C4 1 HETATM 11822 C C5 . MAN H 6 . ? 3.849 -26.558 1.791 1.00 83.33 ? 704 MAN B C5 1 HETATM 11823 C C6 . MAN H 6 . ? 2.506 -26.824 2.411 1.00 79.28 ? 704 MAN B C6 1 HETATM 11824 O O2 . MAN H 6 . ? 7.804 -26.404 3.011 1.00 128.24 ? 704 MAN B O2 1 HETATM 11825 O O3 . MAN H 6 . ? 5.751 -27.812 3.844 1.00 98.70 ? 704 MAN B O3 1 HETATM 11826 O O4 . MAN H 6 . ? 4.408 -28.483 0.484 1.00 105.80 ? 704 MAN B O4 1 HETATM 11827 O O5 . MAN H 6 . ? 4.506 -25.727 2.704 1.00 95.02 ? 704 MAN B O5 1 HETATM 11828 O O6 . MAN H 6 . ? 2.737 -27.208 3.748 1.00 81.81 ? 704 MAN B O6 1 HETATM 11829 C C1 . NAG I 4 . ? 5.370 -28.123 -0.524 1.00 100.19 ? 705 NAG B C1 1 HETATM 11830 C C2 . NAG I 4 . ? 6.242 -29.358 -0.779 1.00 88.14 ? 705 NAG B C2 1 HETATM 11831 C C3 . NAG I 4 . ? 6.639 -29.635 -2.223 1.00 87.75 ? 705 NAG B C3 1 HETATM 11832 C C4 . NAG I 4 . ? 5.666 -29.075 -3.248 1.00 107.57 ? 705 NAG B C4 1 HETATM 11833 C C5 . NAG I 4 . ? 5.313 -27.640 -2.894 1.00 113.01 ? 705 NAG B C5 1 HETATM 11834 C C6 . NAG I 4 . ? 4.362 -27.045 -3.925 1.00 111.81 ? 705 NAG B C6 1 HETATM 11835 C C7 . NAG I 4 . ? 7.721 -30.209 0.947 1.00 103.59 ? 705 NAG B C7 1 HETATM 11836 C C8 . NAG I 4 . ? 9.076 -30.141 1.589 1.00 108.73 ? 705 NAG B C8 1 HETATM 11837 N N2 . NAG I 4 . ? 7.451 -29.289 0.021 1.00 91.50 ? 705 NAG B N2 1 HETATM 11838 O O3 . NAG I 4 . ? 6.716 -31.033 -2.361 1.00 81.47 ? 705 NAG B O3 1 HETATM 11839 O O4 . NAG I 4 . ? 6.253 -29.143 -4.534 1.00 123.11 ? 705 NAG B O4 1 HETATM 11840 O O5 . NAG I 4 . ? 4.669 -27.614 -1.642 1.00 110.84 ? 705 NAG B O5 1 HETATM 11841 O O6 . NAG I 4 . ? 3.139 -27.749 -3.890 1.00 98.89 ? 705 NAG B O6 1 HETATM 11842 O O7 . NAG I 4 . ? 6.917 -31.078 1.286 1.00 106.27 ? 705 NAG B O7 1 HETATM 11843 C C1 . GAL J 7 . ? 5.743 -30.304 -5.215 1.00 132.95 ? 706 GAL B C1 1 HETATM 11844 C C2 . GAL J 7 . ? 5.116 -29.880 -6.538 1.00 134.01 ? 706 GAL B C2 1 HETATM 11845 C C3 . GAL J 7 . ? 5.834 -30.521 -7.720 1.00 141.11 ? 706 GAL B C3 1 HETATM 11846 C C4 . GAL J 7 . ? 5.909 -32.033 -7.556 1.00 144.14 ? 706 GAL B C4 1 HETATM 11847 C C5 . GAL J 7 . ? 6.238 -32.403 -6.115 1.00 146.98 ? 706 GAL B C5 1 HETATM 11848 C C6 . GAL J 7 . ? 7.265 -33.527 -6.059 1.00 156.63 ? 706 GAL B C6 1 HETATM 11849 O O2 . GAL J 7 . ? 3.757 -30.256 -6.555 1.00 30.00 ? 706 GAL B O2 1 HETATM 11850 O O3 . GAL J 7 . ? 7.137 -29.993 -7.821 1.00 144.61 ? 706 GAL B O3 1 HETATM 11851 O O4 . GAL J 7 . ? 6.901 -32.551 -8.413 1.00 145.30 ? 706 GAL B O4 1 HETATM 11852 O O5 . GAL J 7 . ? 6.745 -31.268 -5.449 1.00 142.60 ? 706 GAL B O5 1 HETATM 11853 O O6 . GAL J 7 . ? 7.049 -34.304 -4.903 1.00 165.30 ? 706 GAL B O6 1 HETATM 11854 C C1 . SIA K 8 . ? 8.183 -35.527 -4.122 1.00 162.79 ? 707 SIA B C1 1 HETATM 11855 C C2 . SIA K 8 . ? 7.850 -34.117 -3.673 1.00 168.82 ? 707 SIA B C2 1 HETATM 11856 C C3 . SIA K 8 . ? 7.653 -34.110 -2.155 1.00 167.37 ? 707 SIA B C3 1 HETATM 11857 C C4 . SIA K 8 . ? 8.899 -33.722 -1.383 1.00 161.30 ? 707 SIA B C4 1 HETATM 11858 C C5 . SIA K 8 . ? 9.484 -32.458 -1.987 1.00 168.61 ? 707 SIA B C5 1 HETATM 11859 C C6 . SIA K 8 . ? 9.937 -32.764 -3.425 1.00 168.84 ? 707 SIA B C6 1 HETATM 11860 C C7 . SIA K 8 . ? 10.643 -31.635 -4.196 1.00 168.01 ? 707 SIA B C7 1 HETATM 11861 C C8 . SIA K 8 . ? 11.948 -31.093 -3.606 1.00 162.36 ? 707 SIA B C8 1 HETATM 11862 C C9 . SIA K 8 . ? 13.048 -32.147 -3.526 1.00 157.00 ? 707 SIA B C9 1 HETATM 11863 C C10 . SIA K 8 . ? 11.505 -32.471 -0.479 1.00 173.28 ? 707 SIA B C10 1 HETATM 11864 C C11 . SIA K 8 . ? 12.306 -31.576 0.422 1.00 166.87 ? 707 SIA B C11 1 HETATM 11865 N N5 . SIA K 8 . ? 10.460 -31.873 -1.065 1.00 174.34 ? 707 SIA B N5 1 HETATM 11866 O O1A . SIA K 8 . ? 7.255 -36.279 -4.498 1.00 160.20 ? 707 SIA B O1A 1 HETATM 11867 O O1B . SIA K 8 . ? 9.374 -35.906 -4.072 1.00 156.52 ? 707 SIA B O1B 1 HETATM 11868 O O4 . SIA K 8 . ? 8.579 -33.496 -0.006 1.00 150.60 ? 707 SIA B O4 1 HETATM 11869 O O6 . SIA K 8 . ? 8.801 -33.169 -4.229 1.00 171.62 ? 707 SIA B O6 1 HETATM 11870 O O7 . SIA K 8 . ? 10.938 -32.124 -5.511 1.00 171.35 ? 707 SIA B O7 1 HETATM 11871 O O8 . SIA K 8 . ? 12.409 -29.995 -4.403 1.00 159.62 ? 707 SIA B O8 1 HETATM 11872 O O9 . SIA K 8 . ? 14.208 -31.568 -2.913 1.00 149.14 ? 707 SIA B O9 1 HETATM 11873 O O10 . SIA K 8 . ? 11.819 -33.640 -0.645 1.00 174.49 ? 707 SIA B O10 1 HETATM 11874 C C1 . MAN L 6 . ? 8.800 -18.697 -0.726 1.00 118.79 ? 708 MAN B C1 1 HETATM 11875 C C2 . MAN L 6 . ? 9.847 -18.255 0.291 1.00 134.05 ? 708 MAN B C2 1 HETATM 11876 C C3 . MAN L 6 . ? 11.088 -17.822 -0.488 1.00 141.57 ? 708 MAN B C3 1 HETATM 11877 C C4 . MAN L 6 . ? 10.976 -18.391 -1.912 1.00 130.92 ? 708 MAN B C4 1 HETATM 11878 C C5 . MAN L 6 . ? 9.784 -17.699 -2.588 1.00 118.67 ? 708 MAN B C5 1 HETATM 11879 C C6 . MAN L 6 . ? 9.249 -18.432 -3.804 1.00 110.92 ? 708 MAN B C6 1 HETATM 11880 O O2 . MAN L 6 . ? 10.153 -19.301 1.186 1.00 131.72 ? 708 MAN B O2 1 HETATM 11881 O O3 . MAN L 6 . ? 12.248 -18.226 0.207 1.00 153.60 ? 708 MAN B O3 1 HETATM 11882 O O4 . MAN L 6 . ? 12.183 -18.352 -2.649 1.00 133.12 ? 708 MAN B O4 1 HETATM 11883 O O5 . MAN L 6 . ? 8.699 -17.664 -1.687 1.00 118.20 ? 708 MAN B O5 1 HETATM 11884 O O6 . MAN L 6 . ? 7.860 -18.179 -3.850 1.00 85.07 ? 708 MAN B O6 1 HETATM 11885 C C1 . NAG M 4 . ? 12.872 -19.594 -2.378 1.00 124.56 ? 709 NAG B C1 1 HETATM 11886 C C2 . NAG M 4 . ? 13.173 -20.402 -3.642 1.00 124.24 ? 709 NAG B C2 1 HETATM 11887 C C3 . NAG M 4 . ? 13.921 -21.698 -3.304 1.00 125.20 ? 709 NAG B C3 1 HETATM 11888 C C4 . NAG M 4 . ? 15.003 -21.490 -2.240 1.00 137.43 ? 709 NAG B C4 1 HETATM 11889 C C5 . NAG M 4 . ? 14.469 -20.645 -1.089 1.00 128.40 ? 709 NAG B C5 1 HETATM 11890 C C6 . NAG M 4 . ? 15.506 -20.442 0.012 1.00 120.70 ? 709 NAG B C6 1 HETATM 11891 C C7 . NAG M 4 . ? 11.563 -21.796 -4.921 1.00 136.92 ? 709 NAG B C7 1 HETATM 11892 C C8 . NAG M 4 . ? 10.254 -22.366 -4.459 1.00 133.83 ? 709 NAG B C8 1 HETATM 11893 N N2 . NAG M 4 . ? 11.932 -20.638 -4.368 1.00 128.96 ? 709 NAG B N2 1 HETATM 11894 O O3 . NAG M 4 . ? 14.511 -22.209 -4.479 1.00 118.13 ? 709 NAG B O3 1 HETATM 11895 O O4 . NAG M 4 . ? 15.456 -22.720 -1.711 1.00 150.74 ? 709 NAG B O4 1 HETATM 11896 O O5 . NAG M 4 . ? 14.038 -19.410 -1.606 1.00 124.24 ? 709 NAG B O5 1 HETATM 11897 O O6 . NAG M 4 . ? 16.764 -20.153 -0.555 1.00 118.68 ? 709 NAG B O6 1 HETATM 11898 O O7 . NAG M 4 . ? 12.219 -22.384 -5.781 1.00 145.42 ? 709 NAG B O7 1 HETATM 11899 C C1 . GAL N 7 . ? 16.767 -23.080 -2.203 1.00 157.65 ? 710 GAL B C1 1 HETATM 11900 C C2 . GAL N 7 . ? 16.874 -24.607 -2.156 1.00 155.47 ? 710 GAL B C2 1 HETATM 11901 C C3 . GAL N 7 . ? 17.947 -25.230 -3.052 1.00 151.30 ? 710 GAL B C3 1 HETATM 11902 C C4 . GAL N 7 . ? 18.301 -24.393 -4.276 1.00 154.85 ? 710 GAL B C4 1 HETATM 11903 C C5 . GAL N 7 . ? 18.337 -22.918 -3.912 1.00 154.34 ? 710 GAL B C5 1 HETATM 11904 C C6 . GAL N 7 . ? 18.794 -22.052 -5.082 1.00 145.14 ? 710 GAL B C6 1 HETATM 11905 O O2 . GAL N 7 . ? 17.159 -24.978 -0.824 1.00 157.03 ? 710 GAL B O2 1 HETATM 11906 O O3 . GAL N 7 . ? 17.474 -26.485 -3.488 1.00 146.29 ? 710 GAL B O3 1 HETATM 11907 O O4 . GAL N 7 . ? 17.342 -24.608 -5.287 1.00 156.14 ? 710 GAL B O4 1 HETATM 11908 O O5 . GAL N 7 . ? 17.040 -22.565 -3.491 1.00 160.98 ? 710 GAL B O5 1 HETATM 11909 O O6 . GAL N 7 . ? 18.267 -22.557 -6.289 1.00 139.07 ? 710 GAL B O6 1 HETATM 11910 C C1 . NAG O 4 . ? 19.928 -22.250 25.979 1.00 96.86 ? 711 NAG B C1 1 HETATM 11911 C C2 . NAG O 4 . ? 18.807 -22.927 26.778 1.00 105.24 ? 711 NAG B C2 1 HETATM 11912 C C3 . NAG O 4 . ? 17.711 -22.025 27.374 1.00 118.50 ? 711 NAG B C3 1 HETATM 11913 C C4 . NAG O 4 . ? 17.855 -20.520 27.142 1.00 122.36 ? 711 NAG B C4 1 HETATM 11914 C C5 . NAG O 4 . ? 18.762 -20.217 25.960 1.00 118.19 ? 711 NAG B C5 1 HETATM 11915 C C6 . NAG O 4 . ? 19.012 -18.722 25.806 1.00 115.57 ? 711 NAG B C6 1 HETATM 11916 C C7 . NAG O 4 . ? 18.339 -25.225 26.106 1.00 77.58 ? 711 NAG B C7 1 HETATM 11917 C C8 . NAG O 4 . ? 17.627 -26.125 25.138 1.00 75.43 ? 711 NAG B C8 1 HETATM 11918 N N2 . NAG O 4 . ? 18.176 -23.915 25.921 1.00 87.67 ? 711 NAG B N2 1 HETATM 11919 O O3 . NAG O 4 . ? 17.621 -22.259 28.765 1.00 119.35 ? 711 NAG B O3 1 HETATM 11920 O O4 . NAG O 4 . ? 16.563 -20.005 26.892 1.00 131.25 ? 711 NAG B O4 1 HETATM 11921 O O5 . NAG O 4 . ? 19.993 -20.858 26.179 1.00 113.86 ? 711 NAG B O5 1 HETATM 11922 O O6 . NAG O 4 . ? 19.723 -18.491 24.612 1.00 119.25 ? 711 NAG B O6 1 HETATM 11923 O O7 . NAG O 4 . ? 19.028 -25.704 27.007 1.00 67.59 ? 711 NAG B O7 1 HETATM 11924 C C1 . NAG P 4 . ? 16.148 -19.027 27.871 1.00 141.28 ? 712 NAG B C1 1 HETATM 11925 C C2 . NAG P 4 . ? 15.138 -18.120 27.147 1.00 144.31 ? 712 NAG B C2 1 HETATM 11926 C C3 . NAG P 4 . ? 14.072 -17.491 28.035 1.00 153.98 ? 712 NAG B C3 1 HETATM 11927 C C4 . NAG P 4 . ? 13.581 -18.491 29.075 1.00 156.30 ? 712 NAG B C4 1 HETATM 11928 C C5 . NAG P 4 . ? 14.793 -18.919 29.900 1.00 150.15 ? 712 NAG B C5 1 HETATM 11929 C C6 . NAG P 4 . ? 14.412 -19.810 31.078 1.00 151.45 ? 712 NAG B C6 1 HETATM 11930 C C7 . NAG P 4 . ? 15.557 -16.865 25.099 1.00 121.16 ? 712 NAG B C7 1 HETATM 11931 C C8 . NAG P 4 . ? 16.119 -15.610 24.496 1.00 111.99 ? 712 NAG B C8 1 HETATM 11932 N N2 . NAG P 4 . ? 15.818 -17.078 26.391 1.00 134.01 ? 712 NAG B N2 1 HETATM 11933 O O3 . NAG P 4 . ? 12.995 -17.084 27.219 1.00 158.17 ? 712 NAG B O3 1 HETATM 11934 O O4 . NAG P 4 . ? 12.441 -18.104 29.859 1.00 162.25 ? 712 NAG B O4 1 HETATM 11935 O O5 . NAG P 4 . ? 15.685 -19.641 29.069 1.00 142.56 ? 712 NAG B O5 1 HETATM 11936 O O6 . NAG P 4 . ? 13.987 -21.065 30.598 1.00 151.15 ? 712 NAG B O6 1 HETATM 11937 O O7 . NAG P 4 . ? 14.892 -17.638 24.409 1.00 113.20 ? 712 NAG B O7 1 HETATM 11938 C C1 . BMA Q 5 . ? 12.442 -16.895 30.670 1.00 166.45 ? 713 BMA B C1 1 HETATM 11939 C C2 . BMA Q 5 . ? 12.018 -15.568 29.817 1.00 202.52 ? 713 BMA B C2 1 HETATM 11940 C C3 . BMA Q 5 . ? 11.131 -14.578 30.624 1.00 184.03 ? 713 BMA B C3 1 HETATM 11941 C C4 . BMA Q 5 . ? 10.174 -15.373 31.494 1.00 173.52 ? 713 BMA B C4 1 HETATM 11942 C C5 . BMA Q 5 . ? 11.067 -16.064 32.508 1.00 170.84 ? 713 BMA B C5 1 HETATM 11943 C C6 . BMA Q 5 . ? 10.183 -16.537 33.693 1.00 150.68 ? 713 BMA B C6 1 HETATM 11944 O O2 . BMA Q 5 . ? 11.285 -15.861 28.670 1.00 201.70 ? 713 BMA B O2 1 HETATM 11945 O O3 . BMA Q 5 . ? 10.316 -13.797 29.796 1.00 189.71 ? 713 BMA B O3 1 HETATM 11946 O O4 . BMA Q 5 . ? 9.359 -14.506 32.227 1.00 166.43 ? 713 BMA B O4 1 HETATM 11947 O O5 . BMA Q 5 . ? 11.630 -17.177 31.859 1.00 169.30 ? 713 BMA B O5 1 HETATM 11948 O O6 . BMA Q 5 . ? 11.022 -16.775 34.801 1.00 151.30 ? 713 BMA B O6 1 HETATM 11949 C C1 . MAN R 6 . ? 11.185 -18.186 35.080 1.00 153.38 ? 714 MAN B C1 1 HETATM 11950 C C2 . MAN R 6 . ? 10.110 -19.048 34.417 1.00 155.33 ? 714 MAN B C2 1 HETATM 11951 C C3 . MAN R 6 . ? 9.233 -19.745 35.455 1.00 155.02 ? 714 MAN B C3 1 HETATM 11952 C C4 . MAN R 6 . ? 8.775 -18.790 36.558 1.00 154.26 ? 714 MAN B C4 1 HETATM 11953 C C5 . MAN R 6 . ? 9.975 -18.018 37.104 1.00 153.83 ? 714 MAN B C5 1 HETATM 11954 C C6 . MAN R 6 . ? 10.096 -18.194 38.617 1.00 145.28 ? 714 MAN B C6 1 HETATM 11955 O O2 . MAN R 6 . ? 10.723 -20.002 33.579 1.00 157.57 ? 714 MAN B O2 1 HETATM 11956 O O3 . MAN R 6 . ? 9.953 -20.811 36.033 1.00 152.24 ? 714 MAN B O3 1 HETATM 11957 O O4 . MAN R 6 . ? 7.790 -17.886 36.087 1.00 147.35 ? 714 MAN B O4 1 HETATM 11958 O O5 . MAN R 6 . ? 11.169 -18.446 36.471 1.00 154.69 ? 714 MAN B O5 1 HETATM 11959 O O6 . MAN R 6 . ? 10.344 -19.548 38.936 1.00 137.21 ? 714 MAN B O6 1 HETATM 11960 C C1 . NAG S 4 . ? 6.501 -18.024 36.745 1.00 143.16 ? 715 NAG B C1 1 HETATM 11961 C C2 . NAG S 4 . ? 5.951 -19.459 36.745 1.00 137.03 ? 715 NAG B C2 1 HETATM 11962 C C3 . NAG S 4 . ? 4.631 -19.545 37.506 1.00 127.46 ? 715 NAG B C3 1 HETATM 11963 C C4 . NAG S 4 . ? 4.816 -18.952 38.897 1.00 137.70 ? 715 NAG B C4 1 HETATM 11964 C C5 . NAG S 4 . ? 5.289 -17.510 38.755 1.00 138.46 ? 715 NAG B C5 1 HETATM 11965 C C6 . NAG S 4 . ? 5.445 -16.851 40.120 1.00 135.24 ? 715 NAG B C6 1 HETATM 11966 C C7 . NAG S 4 . ? 6.184 -21.156 35.017 1.00 129.52 ? 715 NAG B C7 1 HETATM 11967 C C8 . NAG S 4 . ? 6.275 -21.413 33.541 1.00 115.15 ? 715 NAG B C8 1 HETATM 11968 N N2 . NAG S 4 . ? 5.758 -19.951 35.392 1.00 136.97 ? 715 NAG B N2 1 HETATM 11969 O O3 . NAG S 4 . ? 4.192 -20.882 37.570 1.00 113.25 ? 715 NAG B O3 1 HETATM 11970 O O4 . NAG S 4 . ? 3.636 -19.047 39.673 1.00 144.65 ? 715 NAG B O4 1 HETATM 11971 O O5 . NAG S 4 . ? 6.522 -17.475 38.056 1.00 142.02 ? 715 NAG B O5 1 HETATM 11972 O O6 . NAG S 4 . ? 6.181 -17.699 40.974 1.00 131.54 ? 715 NAG B O6 1 HETATM 11973 O O7 . NAG S 4 . ? 6.500 -22.033 35.820 1.00 130.92 ? 715 NAG B O7 1 HETATM 11974 C C1 . GAL T 7 . ? 3.823 -20.093 40.652 1.00 149.92 ? 716 GAL B C1 1 HETATM 11975 C C2 . GAL T 7 . ? 3.167 -19.717 41.983 1.00 144.19 ? 716 GAL B C2 1 HETATM 11976 C C3 . GAL T 7 . ? 1.651 -19.792 41.822 1.00 133.34 ? 716 GAL B C3 1 HETATM 11977 C C4 . GAL T 7 . ? 1.285 -21.228 41.483 1.00 131.01 ? 716 GAL B C4 1 HETATM 11978 C C5 . GAL T 7 . ? 2.580 -21.993 41.218 1.00 145.43 ? 716 GAL B C5 1 HETATM 11979 C C6 . GAL T 7 . ? 2.340 -23.450 40.889 1.00 150.40 ? 716 GAL B C6 1 HETATM 11980 O O2 . GAL T 7 . ? 3.778 -20.115 43.195 1.00 30.00 ? 716 GAL B O2 1 HETATM 11981 O O3 . GAL T 7 . ? 1.220 -18.943 40.782 1.00 121.84 ? 716 GAL B O3 1 HETATM 11982 O O4 . GAL T 7 . ? 0.454 -21.251 40.345 1.00 120.97 ? 716 GAL B O4 1 HETATM 11983 O O5 . GAL T 7 . ? 3.309 -21.333 40.203 1.00 153.63 ? 716 GAL B O5 1 HETATM 11984 O O6 . GAL T 7 . ? 1.385 -23.812 41.872 1.00 147.88 ? 716 GAL B O6 1 HETATM 11985 C C1 . SIA U 8 . ? 1.044 -25.477 42.160 1.00 143.78 ? 717 SIA B C1 1 HETATM 11986 C C2 . SIA U 8 . ? 1.863 -24.586 43.076 1.00 133.07 ? 717 SIA B C2 1 HETATM 11987 C C3 . SIA U 8 . ? 1.590 -25.047 44.499 1.00 118.25 ? 717 SIA B C3 1 HETATM 11988 C C4 . SIA U 8 . ? 2.133 -26.451 44.636 1.00 100.29 ? 717 SIA B C4 1 HETATM 11989 C C5 . SIA U 8 . ? 3.641 -26.395 44.477 1.00 91.04 ? 717 SIA B C5 1 HETATM 11990 C C6 . SIA U 8 . ? 4.092 -25.692 43.191 1.00 92.78 ? 717 SIA B C6 1 HETATM 11991 C C7 . SIA U 8 . ? 5.564 -25.310 43.368 1.00 82.13 ? 717 SIA B C7 1 HETATM 11992 C C8 . SIA U 8 . ? 6.198 -24.741 42.106 1.00 86.22 ? 717 SIA B C8 1 HETATM 11993 C C9 . SIA U 8 . ? 7.639 -24.342 42.399 1.00 86.42 ? 717 SIA B C9 1 HETATM 11994 C C10 . SIA U 8 . ? 5.035 -28.180 45.435 1.00 89.11 ? 717 SIA B C10 1 HETATM 11995 C C11 . SIA U 8 . ? 5.502 -27.179 46.452 1.00 103.62 ? 717 SIA B C11 1 HETATM 11996 N N5 . SIA U 8 . ? 4.159 -27.753 44.523 1.00 86.82 ? 717 SIA B N5 1 HETATM 11997 O O1A . SIA U 8 . ? 1.612 -26.271 41.379 1.00 146.41 ? 717 SIA B O1A 1 HETATM 11998 O O1B . SIA U 8 . ? -0.204 -25.408 42.233 1.00 144.58 ? 717 SIA B O1B 1 HETATM 11999 O O4 . SIA U 8 . ? 1.788 -26.989 45.917 1.00 99.75 ? 717 SIA B O4 1 HETATM 12000 O O6 . SIA U 8 . ? 3.272 -24.581 42.730 1.00 113.89 ? 717 SIA B O6 1 HETATM 12001 O O7 . SIA U 8 . ? 5.706 -24.373 44.441 1.00 91.14 ? 717 SIA B O7 1 HETATM 12002 O O8 . SIA U 8 . ? 6.172 -25.719 41.061 1.00 73.17 ? 717 SIA B O8 1 HETATM 12003 O O9 . SIA U 8 . ? 8.360 -24.198 41.172 1.00 84.67 ? 717 SIA B O9 1 HETATM 12004 O O10 . SIA U 8 . ? 5.442 -29.330 45.448 1.00 74.84 ? 717 SIA B O10 1 HETATM 12005 C C1 . MAN V 6 . ? 10.552 -12.386 30.007 1.00 187.40 ? 718 MAN B C1 1 HETATM 12006 C C2 . MAN V 6 . ? 10.163 -11.584 28.778 1.00 180.65 ? 718 MAN B C2 1 HETATM 12007 C C3 . MAN V 6 . ? 9.984 -10.139 29.214 1.00 175.69 ? 718 MAN B C3 1 HETATM 12008 C C4 . MAN V 6 . ? 11.192 -9.628 30.014 1.00 179.30 ? 718 MAN B C4 1 HETATM 12009 C C5 . MAN V 6 . ? 11.987 -10.688 30.805 1.00 179.68 ? 718 MAN B C5 1 HETATM 12010 C C6 . MAN V 6 . ? 11.600 -10.659 32.283 1.00 173.04 ? 718 MAN B C6 1 HETATM 12011 O O2 . MAN V 6 . ? 8.962 -12.077 28.229 1.00 175.67 ? 718 MAN B O2 1 HETATM 12012 O O3 . MAN V 6 . ? 8.808 -10.029 29.985 1.00 167.01 ? 718 MAN B O3 1 HETATM 12013 O O4 . MAN V 6 . ? 12.032 -8.863 29.168 1.00 179.20 ? 718 MAN B O4 1 HETATM 12014 O O5 . MAN V 6 . ? 11.878 -12.017 30.312 1.00 185.17 ? 718 MAN B O5 1 HETATM 12015 O O6 . MAN V 6 . ? 11.908 -9.394 32.826 1.00 167.31 ? 718 MAN B O6 1 HETATM 12016 C C1 . NAG W 4 . ? 11.407 -7.574 28.992 1.00 182.41 ? 719 NAG B C1 1 HETATM 12017 C C2 . NAG W 4 . ? 12.368 -6.451 29.392 1.00 184.32 ? 719 NAG B C2 1 HETATM 12018 C C3 . NAG W 4 . ? 12.435 -5.381 28.304 1.00 187.29 ? 719 NAG B C3 1 HETATM 12019 C C4 . NAG W 4 . ? 11.038 -4.964 27.846 1.00 185.57 ? 719 NAG B C4 1 HETATM 12020 C C5 . NAG W 4 . ? 10.165 -6.186 27.567 1.00 184.05 ? 719 NAG B C5 1 HETATM 12021 C C6 . NAG W 4 . ? 9.513 -6.110 26.188 1.00 177.46 ? 719 NAG B C6 1 HETATM 12022 C C7 . NAG W 4 . ? 12.873 -5.751 31.673 1.00 165.97 ? 719 NAG B C7 1 HETATM 12023 C C8 . NAG W 4 . ? 12.310 -5.799 33.064 1.00 157.02 ? 719 NAG B C8 1 HETATM 12024 N N2 . NAG W 4 . ? 12.001 -5.862 30.670 1.00 178.54 ? 719 NAG B N2 1 HETATM 12025 O O3 . NAG W 4 . ? 13.168 -5.865 27.200 1.00 187.33 ? 719 NAG B O3 1 HETATM 12026 O O4 . NAG W 4 . ? 10.431 -4.152 28.830 1.00 178.50 ? 719 NAG B O4 1 HETATM 12027 O O5 . NAG W 4 . ? 10.934 -7.367 27.676 1.00 183.29 ? 719 NAG B O5 1 HETATM 12028 O O6 . NAG W 4 . ? 10.499 -5.957 25.191 1.00 171.07 ? 719 NAG B O6 1 HETATM 12029 O O7 . NAG W 4 . ? 14.083 -5.613 31.499 1.00 162.79 ? 719 NAG B O7 1 HETATM 12030 O O . HOH X 9 . ? -17.087 -30.076 -5.609 1.00 42.92 ? 1101 HOH A O 1 HETATM 12031 O O . HOH X 9 . ? -1.362 -29.922 16.771 1.00 38.70 ? 1102 HOH A O 1 HETATM 12032 O O . HOH X 9 . ? 13.234 -50.042 50.994 1.00 44.81 ? 1103 HOH A O 1 HETATM 12033 O O . HOH X 9 . ? -5.915 -30.759 10.338 1.00 36.30 ? 1104 HOH A O 1 HETATM 12034 O O . HOH X 9 . ? 38.557 -24.292 16.211 1.00 42.41 ? 1105 HOH A O 1 HETATM 12035 O O . HOH X 9 . ? -9.536 -17.649 7.867 1.00 51.72 ? 1106 HOH A O 1 HETATM 12036 O O . HOH X 9 . ? 32.255 -41.563 13.725 1.00 40.90 ? 1107 HOH A O 1 HETATM 12037 O O . HOH X 9 . ? 30.243 -36.193 28.871 1.00 33.71 ? 1108 HOH A O 1 HETATM 12038 O O . HOH X 9 . ? 40.161 -37.816 20.901 1.00 30.28 ? 1109 HOH A O 1 HETATM 12039 O O . HOH X 9 . ? 51.095 -26.597 28.366 1.00 49.73 ? 1110 HOH A O 1 HETATM 12040 O O . HOH X 9 . ? 54.887 -39.607 39.004 1.00 60.79 ? 1111 HOH A O 1 HETATM 12041 O O . HOH X 9 . ? 36.520 -30.002 20.684 1.00 40.98 ? 1112 HOH A O 1 HETATM 12042 O O . HOH X 9 . ? 42.386 -39.115 52.490 1.00 50.39 ? 1113 HOH A O 1 HETATM 12043 O O . HOH X 9 . ? 20.485 -42.277 30.838 1.00 39.55 ? 1114 HOH A O 1 HETATM 12044 O O . HOH X 9 . ? 44.861 -51.765 21.506 1.00 52.73 ? 1115 HOH A O 1 HETATM 12045 O O . HOH X 9 . ? 10.796 -47.122 16.617 1.00 44.15 ? 1116 HOH A O 1 HETATM 12046 O O . HOH X 9 . ? 2.148 -29.687 23.056 1.00 42.64 ? 1117 HOH A O 1 HETATM 12047 O O . HOH X 9 . ? 45.259 -40.281 27.072 1.00 75.53 ? 1118 HOH A O 1 HETATM 12048 O O . HOH X 9 . ? -8.496 -32.889 3.930 1.00 42.74 ? 1119 HOH A O 1 HETATM 12049 O O . HOH X 9 . ? 45.663 -62.354 31.572 1.00 61.72 ? 1120 HOH A O 1 HETATM 12050 O O . HOH X 9 . ? 22.861 -47.247 23.741 1.00 35.85 ? 1121 HOH A O 1 HETATM 12051 O O . HOH X 9 . ? 40.189 -40.570 20.769 1.00 40.03 ? 1122 HOH A O 1 HETATM 12052 O O . HOH X 9 . ? 15.205 -44.550 27.696 1.00 44.92 ? 1123 HOH A O 1 HETATM 12053 O O . HOH X 9 . ? 32.074 -40.790 27.023 1.00 45.23 ? 1124 HOH A O 1 HETATM 12054 O O . HOH X 9 . ? -8.168 -15.680 8.733 1.00 45.22 ? 1125 HOH A O 1 HETATM 12055 O O . HOH X 9 . ? 20.395 -44.690 11.479 1.00 53.86 ? 1126 HOH A O 1 HETATM 12056 O O . HOH X 9 . ? 8.505 -32.877 39.698 1.00 56.83 ? 1127 HOH A O 1 HETATM 12057 O O . HOH X 9 . ? 29.548 -41.787 24.629 1.00 43.17 ? 1128 HOH A O 1 HETATM 12058 O O . HOH X 9 . ? 48.839 -36.520 11.656 1.00 46.83 ? 1129 HOH A O 1 HETATM 12059 O O . HOH X 9 . ? 61.736 -74.310 39.056 1.00 58.42 ? 1130 HOH A O 1 HETATM 12060 O O . HOH X 9 . ? -20.212 -17.856 12.809 1.00 56.61 ? 1131 HOH A O 1 HETATM 12061 O O . HOH X 9 . ? 41.419 -38.759 14.814 1.00 48.86 ? 1132 HOH A O 1 HETATM 12062 O O . HOH X 9 . ? 2.024 -19.031 28.441 1.00 57.26 ? 1133 HOH A O 1 HETATM 12063 O O . HOH X 9 . ? -25.619 -30.775 -4.840 1.00 57.19 ? 1134 HOH A O 1 HETATM 12064 O O . HOH X 9 . ? 47.533 -21.919 19.998 1.00 56.25 ? 1135 HOH A O 1 HETATM 12065 O O . HOH X 9 . ? 18.472 -50.344 30.987 1.00 50.45 ? 1136 HOH A O 1 HETATM 12066 O O . HOH X 9 . ? 2.786 -36.835 2.483 1.00 68.89 ? 1137 HOH A O 1 HETATM 12067 O O . HOH X 9 . ? 36.601 -29.568 25.125 1.00 50.98 ? 1138 HOH A O 1 HETATM 12068 O O . HOH X 9 . ? -9.340 -14.290 19.608 1.00 55.43 ? 1139 HOH A O 1 HETATM 12069 O O . HOH X 9 . ? 13.671 -43.269 12.839 1.00 50.25 ? 1140 HOH A O 1 HETATM 12070 O O . HOH X 9 . ? 6.312 -37.904 21.654 1.00 45.29 ? 1141 HOH A O 1 HETATM 12071 O O . HOH X 9 . ? 34.379 -30.032 19.034 1.00 45.72 ? 1142 HOH A O 1 HETATM 12072 O O . HOH X 9 . ? 48.506 -21.980 22.544 1.00 58.10 ? 1143 HOH A O 1 HETATM 12073 O O . HOH X 9 . ? 22.776 -51.685 50.728 1.00 58.63 ? 1144 HOH A O 1 HETATM 12074 O O . HOH X 9 . ? 18.010 -34.219 33.943 1.00 59.05 ? 1145 HOH A O 1 HETATM 12075 O O . HOH X 9 . ? 30.537 -27.632 19.276 1.00 52.97 ? 1146 HOH A O 1 HETATM 12076 O O . HOH X 9 . ? 33.106 -27.714 19.221 1.00 44.81 ? 1147 HOH A O 1 HETATM 12077 O O . HOH X 9 . ? 38.335 -25.276 38.006 1.00 45.19 ? 1148 HOH A O 1 HETATM 12078 O O . HOH X 9 . ? 28.590 -50.664 24.361 1.00 40.49 ? 1149 HOH A O 1 HETATM 12079 O O . HOH X 9 . ? -7.027 -17.418 -0.155 1.00 57.92 ? 1150 HOH A O 1 HETATM 12080 O O . HOH X 9 . ? 44.534 -76.481 39.337 1.00 74.54 ? 1151 HOH A O 1 HETATM 12081 O O . HOH X 9 . ? 32.391 -32.031 20.144 1.00 67.13 ? 1152 HOH A O 1 HETATM 12082 O O . HOH X 9 . ? 39.999 -21.520 32.563 1.00 56.16 ? 1153 HOH A O 1 HETATM 12083 O O . HOH X 9 . ? -14.499 -26.602 4.834 1.00 38.94 ? 1154 HOH A O 1 HETATM 12084 O O . HOH X 9 . ? 31.615 -34.529 17.462 1.00 43.66 ? 1155 HOH A O 1 HETATM 12085 O O . HOH X 9 . ? 45.657 -11.398 36.663 1.00 62.40 ? 1156 HOH A O 1 HETATM 12086 O O . HOH X 9 . ? 29.273 -62.335 36.688 1.00 54.66 ? 1157 HOH A O 1 HETATM 12087 O O . HOH X 9 . ? 47.674 -37.203 49.294 1.00 62.20 ? 1158 HOH A O 1 HETATM 12088 O O . HOH X 9 . ? 18.187 -26.936 48.978 1.00 53.79 ? 1159 HOH A O 1 HETATM 12089 O O . HOH X 9 . ? -17.473 -11.988 8.885 1.00 41.13 ? 1160 HOH A O 1 HETATM 12090 O O . HOH X 9 . ? 41.602 -24.118 19.259 1.00 56.03 ? 1161 HOH A O 1 HETATM 12091 O O . HOH X 9 . ? 17.988 -49.982 50.124 1.00 48.15 ? 1162 HOH A O 1 HETATM 12092 O O . HOH X 9 . ? 44.316 -48.137 39.703 1.00 69.06 ? 1163 HOH A O 1 HETATM 12093 O O . HOH X 9 . ? 19.676 -47.846 40.387 1.00 57.61 ? 1164 HOH A O 1 HETATM 12094 O O . HOH X 9 . ? 3.772 -27.290 29.536 1.00 44.15 ? 1165 HOH A O 1 HETATM 12095 O O . HOH X 9 . ? 12.894 -46.944 41.459 1.00 53.57 ? 1166 HOH A O 1 HETATM 12096 O O . HOH X 9 . ? 26.605 -15.900 42.097 1.00 58.94 ? 1167 HOH A O 1 HETATM 12097 O O . HOH X 9 . ? -5.809 -16.830 23.016 1.00 50.34 ? 1168 HOH A O 1 HETATM 12098 O O . HOH X 9 . ? 44.841 -20.138 39.460 1.00 55.74 ? 1169 HOH A O 1 HETATM 12099 O O . HOH X 9 . ? 12.022 -39.084 4.842 1.00 44.23 ? 1170 HOH A O 1 HETATM 12100 O O . HOH X 9 . ? -10.845 -16.525 20.927 1.00 58.07 ? 1171 HOH A O 1 HETATM 12101 O O . HOH X 9 . ? 44.333 -54.214 38.977 1.00 58.26 ? 1172 HOH A O 1 HETATM 12102 O O . HOH X 9 . ? 55.999 -27.636 32.236 1.00 72.42 ? 1173 HOH A O 1 HETATM 12103 O O . HOH X 9 . ? -5.285 -16.169 25.727 1.00 52.63 ? 1174 HOH A O 1 HETATM 12104 O O . HOH X 9 . ? -16.435 -23.354 12.651 1.00 62.44 ? 1175 HOH A O 1 HETATM 12105 O O . HOH X 9 . ? 2.819 -23.453 7.698 1.00 50.24 ? 1176 HOH A O 1 HETATM 12106 O O . HOH X 9 . ? 27.017 -59.612 28.870 1.00 53.75 ? 1177 HOH A O 1 HETATM 12107 O O . HOH X 9 . ? -0.608 -35.281 1.866 1.00 52.55 ? 1178 HOH A O 1 HETATM 12108 O O . HOH X 9 . ? -0.563 -25.697 7.330 1.00 53.74 ? 1179 HOH A O 1 HETATM 12109 O O . HOH X 9 . ? 19.627 -54.105 28.699 1.00 67.53 ? 1180 HOH A O 1 HETATM 12110 O O . HOH X 9 . ? 58.129 -35.983 28.720 1.00 48.56 ? 1181 HOH A O 1 HETATM 12111 O O . HOH X 9 . ? -1.939 -18.728 20.684 1.00 65.97 ? 1182 HOH A O 1 HETATM 12112 O O . HOH X 9 . ? 20.952 -30.037 31.286 1.00 53.90 ? 1183 HOH A O 1 HETATM 12113 O O . HOH X 9 . ? -9.934 -28.943 27.936 1.00 59.05 ? 1184 HOH A O 1 HETATM 12114 O O . HOH X 9 . ? 19.331 -31.830 32.097 1.00 61.31 ? 1185 HOH A O 1 HETATM 12115 O O . HOH X 9 . ? 15.184 -26.112 52.840 1.00 75.46 ? 1186 HOH A O 1 HETATM 12116 O O . HOH X 9 . ? -3.493 -17.612 27.063 1.00 54.65 ? 1187 HOH A O 1 HETATM 12117 O O . HOH X 9 . ? 59.439 -36.704 26.190 1.00 70.87 ? 1188 HOH A O 1 HETATM 12118 O O . HOH X 9 . ? 43.502 -79.361 45.015 1.00 60.92 ? 1189 HOH A O 1 HETATM 12119 O O . HOH X 9 . ? 35.917 -45.854 13.004 1.00 51.27 ? 1190 HOH A O 1 HETATM 12120 O O . HOH X 9 . ? 11.401 -46.832 36.925 1.00 62.85 ? 1191 HOH A O 1 HETATM 12121 O O . HOH X 9 . ? 12.974 -51.755 39.100 1.00 63.03 ? 1192 HOH A O 1 HETATM 12122 O O . HOH X 9 . ? 66.086 -77.019 42.457 1.00 63.94 ? 1193 HOH A O 1 HETATM 12123 O O . HOH X 9 . ? 16.743 -32.245 3.804 1.00 56.90 ? 1194 HOH A O 1 HETATM 12124 O O . HOH X 9 . ? -2.492 -16.063 17.119 1.00 54.00 ? 1195 HOH A O 1 HETATM 12125 O O . HOH X 9 . ? 41.151 -27.715 13.064 1.00 55.38 ? 1196 HOH A O 1 HETATM 12126 O O . HOH X 9 . ? 34.066 -10.010 39.387 1.00 49.28 ? 1197 HOH A O 1 HETATM 12127 O O . HOH X 9 . ? 32.975 -23.365 58.046 1.00 55.73 ? 1198 HOH A O 1 HETATM 12128 O O . HOH X 9 . ? -4.093 -19.737 8.451 1.00 45.69 ? 1199 HOH A O 1 HETATM 12129 O O . HOH X 9 . ? 19.469 -40.216 61.184 1.00 67.13 ? 1200 HOH A O 1 HETATM 12130 O O . HOH X 9 . ? 27.430 -33.732 27.794 1.00 56.54 ? 1201 HOH A O 1 HETATM 12131 O O . HOH X 9 . ? -13.443 -10.271 -0.240 1.00 56.22 ? 1202 HOH A O 1 HETATM 12132 O O . HOH X 9 . ? 29.063 -50.431 17.404 1.00 51.39 ? 1203 HOH A O 1 HETATM 12133 O O . HOH X 9 . ? 10.532 -24.058 11.398 1.00 44.86 ? 1204 HOH A O 1 HETATM 12134 O O . HOH X 9 . ? 9.092 -34.470 28.272 1.00 50.23 ? 1205 HOH A O 1 HETATM 12135 O O . HOH X 9 . ? -6.805 -22.352 33.079 1.00 57.80 ? 1206 HOH A O 1 HETATM 12136 O O . HOH X 9 . ? -3.254 -33.385 7.348 1.00 53.76 ? 1207 HOH A O 1 HETATM 12137 O O . HOH X 9 . ? 23.672 -29.263 23.005 1.00 46.06 ? 1208 HOH A O 1 HETATM 12138 O O . HOH X 9 . ? -5.387 -34.244 38.354 1.00 75.21 ? 1209 HOH A O 1 HETATM 12139 O O . HOH X 9 . ? 22.729 -25.475 22.979 1.00 48.35 ? 1210 HOH A O 1 HETATM 12140 O O . HOH X 9 . ? 55.696 -31.895 33.531 1.00 74.45 ? 1211 HOH A O 1 HETATM 12141 O O . HOH X 9 . ? -6.152 -30.427 -3.962 1.00 66.17 ? 1212 HOH A O 1 HETATM 12142 O O . HOH X 9 . ? 22.167 -27.267 20.048 1.00 46.74 ? 1213 HOH A O 1 HETATM 12143 O O . HOH X 9 . ? 3.755 -21.035 30.459 1.00 36.27 ? 1214 HOH A O 1 HETATM 12144 O O . HOH X 9 . ? -20.057 -20.044 15.615 1.00 68.53 ? 1215 HOH A O 1 HETATM 12145 O O . HOH X 9 . ? -9.234 -31.764 18.173 1.00 38.45 ? 1216 HOH A O 1 HETATM 12146 O O . HOH X 9 . ? 26.968 -27.324 6.703 1.00 60.73 ? 1217 HOH A O 1 HETATM 12147 O O . HOH X 9 . ? 36.773 -26.103 9.847 1.00 55.08 ? 1218 HOH A O 1 HETATM 12148 O O . HOH X 9 . ? 35.015 -31.220 16.282 1.00 51.62 ? 1219 HOH A O 1 HETATM 12149 O O . HOH X 9 . ? 33.738 -36.653 15.454 1.00 85.02 ? 1220 HOH A O 1 HETATM 12150 O O . HOH X 9 . ? 56.490 -47.126 62.121 1.00 111.38 ? 1221 HOH A O 1 HETATM 12151 O O . HOH X 9 . ? 36.484 -15.494 30.670 1.00 66.03 ? 1222 HOH A O 1 HETATM 12152 O O . HOH X 9 . ? 47.401 -13.329 34.228 1.00 98.93 ? 1223 HOH A O 1 HETATM 12153 O O . HOH X 9 . ? 1.142 -18.832 13.431 1.00 58.10 ? 1224 HOH A O 1 HETATM 12154 O O . HOH X 9 . ? 20.846 -31.256 8.000 1.00 65.45 ? 1225 HOH A O 1 HETATM 12155 O O . HOH X 9 . ? 35.773 -32.174 22.289 1.00 49.86 ? 1226 HOH A O 1 HETATM 12156 O O . HOH X 9 . ? 16.658 -30.271 21.000 1.00 52.88 ? 1227 HOH A O 1 HETATM 12157 O O . HOH X 9 . ? 32.522 -42.188 51.031 1.00 57.79 ? 1228 HOH A O 1 HETATM 12158 O O . HOH X 9 . ? -6.717 -13.379 -0.308 1.00 70.28 ? 1229 HOH A O 1 HETATM 12159 O O . HOH X 9 . ? 17.655 -42.745 23.590 1.00 62.21 ? 1230 HOH A O 1 HETATM 12160 O O . HOH X 9 . ? 26.480 -31.261 22.846 1.00 52.63 ? 1231 HOH A O 1 HETATM 12161 O O . HOH X 9 . ? 29.968 -34.484 25.539 1.00 61.93 ? 1232 HOH A O 1 HETATM 12162 O O . HOH X 9 . ? 40.985 -44.845 33.655 1.00 72.63 ? 1233 HOH A O 1 HETATM 12163 O O . HOH X 9 . ? 40.855 -48.547 28.552 1.00 68.45 ? 1234 HOH A O 1 HETATM 12164 O O . HOH X 9 . ? 33.912 -41.713 29.194 1.00 60.19 ? 1235 HOH A O 1 HETATM 12165 O O . HOH X 9 . ? 35.360 -36.310 31.113 1.00 53.96 ? 1236 HOH A O 1 HETATM 12166 O O . HOH X 9 . ? 38.163 -32.706 12.063 1.00 50.78 ? 1237 HOH A O 1 HETATM 12167 O O . HOH X 9 . ? 39.206 -36.533 14.536 1.00 67.25 ? 1238 HOH A O 1 HETATM 12168 O O . HOH X 9 . ? 50.271 -43.689 55.003 1.00 69.89 ? 1239 HOH A O 1 HETATM 12169 O O . HOH X 9 . ? 43.970 -41.124 13.503 1.00 71.04 ? 1240 HOH A O 1 HETATM 12170 O O . HOH X 9 . ? 39.230 -14.984 24.018 1.00 52.92 ? 1241 HOH A O 1 HETATM 12171 O O . HOH X 9 . ? -5.861 -16.586 6.964 1.00 67.30 ? 1242 HOH A O 1 HETATM 12172 O O . HOH Y 9 . ? 31.395 -25.319 22.178 1.00 51.13 ? 801 HOH B O 1 HETATM 12173 O O . HOH Y 9 . ? 34.408 -19.578 29.092 1.00 72.38 ? 802 HOH B O 1 HETATM 12174 O O . HOH Y 9 . ? 44.042 -20.227 -14.450 1.00 41.96 ? 803 HOH B O 1 HETATM 12175 O O . HOH Y 9 . ? 26.811 -17.941 2.523 1.00 38.63 ? 804 HOH B O 1 HETATM 12176 O O . HOH Y 9 . ? 52.596 7.866 -4.740 1.00 37.67 ? 805 HOH B O 1 HETATM 12177 O O . HOH Y 9 . ? 43.011 -6.917 -4.882 1.00 48.36 ? 806 HOH B O 1 HETATM 12178 O O . HOH Y 9 . ? -2.711 -19.281 5.300 1.00 45.93 ? 807 HOH B O 1 HETATM 12179 O O . HOH Y 9 . ? 41.317 -11.712 5.650 1.00 43.42 ? 808 HOH B O 1 HETATM 12180 O O . HOH Y 9 . ? 41.902 4.781 4.497 1.00 42.65 ? 809 HOH B O 1 HETATM 12181 O O . HOH Y 9 . ? -6.435 -11.498 2.647 1.00 48.94 ? 810 HOH B O 1 HETATM 12182 O O . HOH Y 9 . ? -7.108 -5.826 15.379 1.00 51.19 ? 811 HOH B O 1 HETATM 12183 O O . HOH Y 9 . ? 47.398 -12.725 -6.399 1.00 66.26 ? 812 HOH B O 1 HETATM 12184 O O . HOH Y 9 . ? 3.375 -30.877 1.371 1.00 49.04 ? 813 HOH B O 1 HETATM 12185 O O . HOH Y 9 . ? 42.990 9.053 -14.695 1.00 58.51 ? 814 HOH B O 1 HETATM 12186 O O . HOH Y 9 . ? -10.277 -6.925 2.464 1.00 55.01 ? 815 HOH B O 1 HETATM 12187 O O . HOH Y 9 . ? 2.731 -18.153 1.590 1.00 56.68 ? 816 HOH B O 1 HETATM 12188 O O . HOH Y 9 . ? 48.088 3.354 -27.375 1.00 61.94 ? 817 HOH B O 1 HETATM 12189 O O . HOH Y 9 . ? -1.489 -7.328 21.544 1.00 69.81 ? 818 HOH B O 1 HETATM 12190 O O . HOH Y 9 . ? 11.938 -0.463 15.503 1.00 61.90 ? 819 HOH B O 1 HETATM 12191 O O . HOH Y 9 . ? 21.599 -29.905 10.267 1.00 35.27 ? 820 HOH B O 1 HETATM 12192 O O . HOH Y 9 . ? 54.495 -11.744 -1.806 1.00 53.73 ? 821 HOH B O 1 HETATM 12193 O O . HOH Y 9 . ? -1.213 -12.916 17.145 1.00 53.62 ? 822 HOH B O 1 HETATM 12194 O O . HOH Y 9 . ? 39.244 4.960 4.395 1.00 40.11 ? 823 HOH B O 1 HETATM 12195 O O . HOH Y 9 . ? 42.225 -5.705 0.667 1.00 68.34 ? 824 HOH B O 1 HETATM 12196 O O . HOH Y 9 . ? 28.525 -26.625 17.709 1.00 53.44 ? 825 HOH B O 1 HETATM 12197 O O . HOH Y 9 . ? 29.217 -9.672 32.524 1.00 56.09 ? 826 HOH B O 1 HETATM 12198 O O . HOH Y 9 . ? 41.260 -10.319 -20.859 1.00 77.29 ? 827 HOH B O 1 HETATM 12199 O O . HOH Y 9 . ? 12.084 -0.635 8.967 1.00 41.59 ? 828 HOH B O 1 HETATM 12200 O O . HOH Y 9 . ? 41.476 -4.588 2.926 1.00 54.93 ? 829 HOH B O 1 HETATM 12201 O O . HOH Y 9 . ? 65.042 -9.941 7.424 1.00 65.14 ? 830 HOH B O 1 HETATM 12202 O O . HOH Y 9 . ? 39.488 1.230 -0.342 1.00 71.80 ? 831 HOH B O 1 HETATM 12203 O O . HOH Y 9 . ? 48.782 3.520 -18.967 1.00 51.82 ? 832 HOH B O 1 HETATM 12204 O O . HOH Y 9 . ? 43.051 -11.598 7.988 1.00 51.46 ? 833 HOH B O 1 HETATM 12205 O O . HOH Y 9 . ? 18.303 -7.838 27.596 1.00 56.10 ? 834 HOH B O 1 HETATM 12206 O O . HOH Y 9 . ? 16.506 -9.260 20.182 1.00 64.55 ? 835 HOH B O 1 HETATM 12207 O O . HOH Y 9 . ? 32.202 26.222 3.172 1.00 63.21 ? 836 HOH B O 1 HETATM 12208 O O . HOH Y 9 . ? 20.805 -20.684 22.097 1.00 56.90 ? 837 HOH B O 1 HETATM 12209 O O . HOH Y 9 . ? 10.157 -20.770 30.363 1.00 57.80 ? 838 HOH B O 1 HETATM 12210 O O . HOH Y 9 . ? 16.498 -4.142 30.983 1.00 64.23 ? 839 HOH B O 1 HETATM 12211 O O . HOH Y 9 . ? 29.154 27.269 -9.735 1.00 56.05 ? 840 HOH B O 1 HETATM 12212 O O . HOH Y 9 . ? 61.364 25.594 1.368 1.00 83.59 ? 841 HOH B O 1 HETATM 12213 O O . HOH Y 9 . ? 48.436 -19.431 -11.900 1.00 32.56 ? 842 HOH B O 1 HETATM 12214 O O . HOH Y 9 . ? 25.608 -15.406 24.998 1.00 51.40 ? 843 HOH B O 1 HETATM 12215 O O . HOH Y 9 . ? 53.071 -22.453 -7.104 1.00 42.93 ? 844 HOH B O 1 HETATM 12216 O O . HOH Y 9 . ? 50.474 -4.438 2.980 1.00 54.89 ? 845 HOH B O 1 HETATM 12217 O O . HOH Y 9 . ? 33.592 41.312 -18.505 1.00 68.23 ? 846 HOH B O 1 HETATM 12218 O O . HOH Y 9 . ? 18.952 1.188 7.467 1.00 70.44 ? 847 HOH B O 1 HETATM 12219 O O . HOH Y 9 . ? 45.285 9.400 11.745 1.00 69.41 ? 848 HOH B O 1 HETATM 12220 O O . HOH Y 9 . ? 65.433 -8.660 13.517 1.00 75.12 ? 849 HOH B O 1 HETATM 12221 O O . HOH Y 9 . ? 55.942 -19.332 -4.321 1.00 60.24 ? 850 HOH B O 1 HETATM 12222 O O . HOH Y 9 . ? 13.109 -17.108 13.133 1.00 78.96 ? 851 HOH B O 1 HETATM 12223 O O . HOH Y 9 . ? -1.901 -4.813 -3.945 1.00 70.96 ? 852 HOH B O 1 HETATM 12224 O O . HOH Y 9 . ? -6.358 -13.906 7.818 1.00 58.26 ? 853 HOH B O 1 HETATM 12225 O O . HOH Y 9 . ? 15.479 -16.310 8.662 1.00 56.57 ? 854 HOH B O 1 HETATM 12226 O O . HOH Y 9 . ? 31.448 -21.112 15.051 1.00 75.37 ? 855 HOH B O 1 HETATM 12227 O O . HOH Y 9 . ? 32.846 -25.010 10.446 1.00 59.02 ? 856 HOH B O 1 HETATM 12228 O O . HOH Y 9 . ? 40.715 6.276 -3.953 1.00 72.37 ? 857 HOH B O 1 HETATM 12229 O O . HOH Y 9 . ? 43.627 2.558 -2.592 1.00 73.76 ? 858 HOH B O 1 HETATM 12230 O O . HOH Y 9 . ? 34.685 10.580 -9.641 1.00 61.64 ? 859 HOH B O 1 HETATM 12231 O O . HOH Y 9 . ? 42.131 13.407 -9.990 1.00 55.06 ? 860 HOH B O 1 HETATM 12232 O O . HOH Y 9 . ? -4.199 -11.857 8.359 1.00 67.62 ? 861 HOH B O 1 HETATM 12233 O O . HOH Y 9 . ? 11.225 -23.333 18.706 1.00 70.51 ? 862 HOH B O 1 # loop_ _atom_site_anisotrop.id _atom_site_anisotrop.type_symbol _atom_site_anisotrop.pdbx_label_atom_id _atom_site_anisotrop.pdbx_label_alt_id _atom_site_anisotrop.pdbx_label_comp_id _atom_site_anisotrop.pdbx_label_asym_id _atom_site_anisotrop.pdbx_label_seq_id _atom_site_anisotrop.pdbx_PDB_ins_code _atom_site_anisotrop.U[1][1] _atom_site_anisotrop.U[2][2] _atom_site_anisotrop.U[3][3] _atom_site_anisotrop.U[1][2] _atom_site_anisotrop.U[1][3] _atom_site_anisotrop.U[2][3] _atom_site_anisotrop.pdbx_auth_seq_id _atom_site_anisotrop.pdbx_auth_comp_id _atom_site_anisotrop.pdbx_auth_asym_id _atom_site_anisotrop.pdbx_auth_atom_id 1 N N . GLU A 43 ? 1.2219 1.2856 0.9148 0.0409 -0.4617 0.2590 54 GLU A N 2 C CA . GLU A 43 ? 1.3532 1.4349 1.0994 0.0435 -0.4637 0.2562 54 GLU A CA 3 C C . GLU A 43 ? 1.4026 1.4871 1.1622 0.0354 -0.4560 0.2410 54 GLU A C 4 O O . GLU A 43 ? 1.2647 1.3338 1.0024 0.0318 -0.4425 0.2369 54 GLU A O 5 C CB . GLU A 43 ? 1.3306 1.4097 1.1034 0.0543 -0.4552 0.2693 54 GLU A CB 6 C CG . GLU A 43 ? 1.2962 1.3948 1.1235 0.0592 -0.4578 0.2676 54 GLU A CG 7 C CD . GLU A 43 ? 1.4402 1.5347 1.2902 0.0712 -0.4521 0.2809 54 GLU A CD 8 O OE1 . GLU A 43 ? 1.4935 1.5706 1.3171 0.0752 -0.4485 0.2926 54 GLU A OE1 9 O OE2 . GLU A 43 ? 1.4771 1.5851 1.3709 0.0767 -0.4509 0.2796 54 GLU A OE2 10 N N . VAL A 44 ? 1.4227 1.5275 1.2187 0.0327 -0.4646 0.2334 55 VAL A N 11 C CA . VAL A 44 ? 1.3640 1.4737 1.1746 0.0242 -0.4597 0.2188 55 VAL A CA 12 C C . VAL A 44 ? 1.4076 1.5088 1.2305 0.0262 -0.4416 0.2185 55 VAL A C 13 O O . VAL A 44 ? 1.4804 1.5714 1.2867 0.0191 -0.4333 0.2087 55 VAL A O 14 C CB . VAL A 44 ? 1.3162 1.4520 1.1712 0.0222 -0.4706 0.2136 55 VAL A CB 15 C CG1 . VAL A 44 ? 1.2896 1.4315 1.1273 0.0136 -0.4870 0.2064 55 VAL A CG1 16 C CG2 . VAL A 44 ? 1.3536 1.5039 1.2451 0.0342 -0.4738 0.2259 55 VAL A CG2 17 N N . THR A 45 ? 1.4444 1.5490 1.2961 0.0361 -0.4356 0.2287 56 THR A N 18 C CA . THR A 45 ? 1.5209 1.6170 1.3845 0.0384 -0.4188 0.2293 56 THR A CA 19 C C . THR A 45 ? 1.6258 1.7008 1.4616 0.0436 -0.4090 0.2413 56 THR A C 20 O O . THR A 45 ? 1.7361 1.8095 1.5806 0.0525 -0.4104 0.2537 56 THR A O 21 C CB . THR A 45 ? 1.4714 1.5845 1.3883 0.0450 -0.4163 0.2302 56 THR A CB 22 O OG1 . THR A 45 ? 1.4400 1.5419 1.3650 0.0490 -0.4004 0.2335 56 THR A OG1 23 C CG2 . THR A 45 ? 1.4055 1.5297 1.3426 0.0549 -0.4265 0.2406 56 THR A CG2 24 N N . GLY A 46 ? 1.5119 1.5705 1.3140 0.0378 -0.3987 0.2375 57 GLY A N 25 C CA . GLY A 46 ? 1.4014 1.4605 1.1942 0.0281 -0.3972 0.2225 57 GLY A CA 26 C C . GLY A 46 ? 1.4412 1.4846 1.1817 0.0218 -0.3965 0.2178 57 GLY A C 27 O O . GLY A 46 ? 1.3893 1.4166 1.1000 0.0235 -0.3860 0.2246 57 GLY A O 28 N N . LEU A 47 ? 1.4653 1.5134 1.1948 0.0145 -0.4074 0.2060 58 LEU A N 29 C CA . LEU A 47 ? 1.4332 1.4657 1.1144 0.0080 -0.4057 0.1973 58 LEU A CA 30 C C . LEU A 47 ? 1.4720 1.4971 1.1519 0.0022 -0.3947 0.1853 58 LEU A C 31 O O . LEU A 47 ? 1.3892 1.4257 1.1089 0.0015 -0.3905 0.1801 58 LEU A O 32 C CB . LEU A 47 ? 1.4396 1.4778 1.1069 0.0025 -0.4228 0.1896 58 LEU A CB 33 C CG . LEU A 47 ? 1.4348 1.4956 1.1439 0.0005 -0.4376 0.1865 58 LEU A CG 34 C CD1 . LEU A 47 ? 1.4355 1.5047 1.1779 -0.0048 -0.4333 0.1759 58 LEU A CD1 35 C CD2 . LEU A 47 ? 1.0090 1.0725 0.6967 -0.0055 -0.4542 0.1800 58 LEU A CD2 36 N N . GLY A 48 ? 1.5866 1.5939 1.2238 -0.0005 -0.3849 0.1787 59 GLY A N 37 C CA . GLY A 48 ? 1.5514 1.5517 1.1901 -0.0034 -0.3655 0.1643 59 GLY A CA 38 C C . GLY A 48 ? 1.4558 1.4555 1.1157 0.0025 -0.3433 0.1699 59 GLY A C 39 O O . GLY A 48 ? 1.3823 1.3798 1.0538 0.0011 -0.3272 0.1598 59 GLY A O 40 N N . LYS A 49 ? 1.3670 1.3679 1.0317 0.0089 -0.3434 0.1865 60 LYS A N 41 C CA . LYS A 49 ? 1.1172 1.1160 0.8008 0.0140 -0.3243 0.1933 60 LYS A CA 42 C C . LYS A 49 ? 1.1057 1.0895 0.7514 0.0155 -0.3095 0.1989 60 LYS A C 43 O O . LYS A 49 ? 1.0611 1.0362 0.6650 0.0139 -0.3146 0.1993 60 LYS A O 44 C CB . LYS A 49 ? 1.0530 1.0605 0.7673 0.0202 -0.3322 0.2083 60 LYS A CB 45 C CG . LYS A 49 ? 1.1190 1.1443 0.8755 0.0203 -0.3451 0.2046 60 LYS A CG 46 C CD . LYS A 49 ? 1.0687 1.1002 0.8609 0.0199 -0.3299 0.1950 60 LYS A CD 47 C CE . LYS A 49 ? 1.0089 1.0597 0.8442 0.0210 -0.3413 0.1932 60 LYS A CE 48 N NZ . LYS A 49 ? 1.0913 1.1486 0.9573 0.0192 -0.3274 0.1820 60 LYS A NZ 49 N N . LEU A 50 ? 1.0529 1.0342 0.7136 0.0183 -0.2910 0.2033 61 LEU A N 50 C CA . LEU A 50 ? 1.0168 0.9868 0.6485 0.0196 -0.2751 0.2103 61 LEU A CA 51 C C . LEU A 50 ? 1.0213 0.9919 0.6808 0.0231 -0.2642 0.2218 61 LEU A C 52 O O . LEU A 50 ? 1.2246 1.1979 0.9090 0.0227 -0.2504 0.2152 61 LEU A O 53 C CB . LEU A 50 ? 1.0534 1.0181 0.6688 0.0167 -0.2587 0.1956 61 LEU A CB 54 C CG . LEU A 50 ? 1.1481 1.1038 0.7343 0.0181 -0.2405 0.2019 61 LEU A CG 55 C CD1 . LEU A 50 ? 1.2049 1.1526 0.7444 0.0184 -0.2484 0.2089 61 LEU A CD1 56 C CD2 . LEU A 50 ? 1.1243 1.0776 0.7063 0.0168 -0.2227 0.1874 61 LEU A CD2 57 N N . VAL A 51 ? 1.1291 1.0963 0.7839 0.0264 -0.2711 0.2391 62 VAL A N 58 C CA . VAL A 51 ? 1.1049 1.0704 0.7868 0.0298 -0.2638 0.2507 62 VAL A CA 59 C C . VAL A 51 ? 1.0441 0.9994 0.7041 0.0289 -0.2471 0.2612 62 VAL A C 60 O O . VAL A 51 ? 1.0563 1.0050 0.6783 0.0281 -0.2483 0.2690 62 VAL A O 61 C CB . VAL A 51 ? 1.0780 1.0455 0.7751 0.0347 -0.2820 0.2641 62 VAL A CB 62 C CG1 . VAL A 51 ? 1.0503 1.0132 0.7753 0.0385 -0.2746 0.2750 62 VAL A CG1 63 C CG2 . VAL A 51 ? 0.9502 0.9311 0.6721 0.0355 -0.2979 0.2543 62 VAL A CG2 64 N N . LYS A 52 ? 0.9752 0.9297 0.6591 0.0285 -0.2316 0.2612 63 LYS A N 65 C CA . LYS A 52 ? 0.9703 0.9171 0.6412 0.0268 -0.2156 0.2722 63 LYS A CA 66 C C . LYS A 52 ? 1.0339 0.9765 0.7357 0.0287 -0.2144 0.2835 63 LYS A C 67 O O . LYS A 52 ? 1.0609 1.0080 0.7979 0.0303 -0.2153 0.2760 63 LYS A O 68 C CB . LYS A 52 ? 0.9054 0.8551 0.5739 0.0235 -0.1962 0.2602 63 LYS A CB 69 C CG . LYS A 52 ? 0.8790 0.8303 0.5167 0.0223 -0.1952 0.2474 63 LYS A CG 70 C CD . LYS A 52 ? 0.9270 0.8812 0.5671 0.0204 -0.1758 0.2360 63 LYS A CD 71 C CE . LYS A 52 ? 1.0344 0.9876 0.6431 0.0201 -0.1746 0.2226 63 LYS A CE 72 N NZ . LYS A 52 ? 1.2456 1.1924 0.8099 0.0207 -0.1754 0.2314 63 LYS A NZ 73 N N . SER A 53 ? 1.0656 0.9985 0.7533 0.0283 -0.2122 0.3015 64 SER A N 74 C CA . SER A 53 ? 1.0517 0.9770 0.7657 0.0298 -0.2118 0.3132 64 SER A CA 75 C C . SER A 53 ? 1.0189 0.9407 0.7381 0.0247 -0.1920 0.3158 64 SER A C 76 O O . SER A 53 ? 1.0437 0.9701 0.7451 0.0208 -0.1785 0.3103 64 SER A O 77 C CB . SER A 53 ? 0.9997 0.9146 0.6972 0.0323 -0.2238 0.3333 64 SER A CB 78 O OG . SER A 53 ? 1.1813 1.0907 0.8431 0.0280 -0.2144 0.3444 64 SER A OG 79 N N . SER A 54 ? 1.0567 0.9701 0.8005 0.0249 -0.1906 0.3243 65 SER A N 80 C CA . SER A 54 ? 1.0438 0.9531 0.7949 0.0190 -0.1738 0.3287 65 SER A CA 81 C C . SER A 54 ? 1.1820 1.0873 0.8996 0.0144 -0.1653 0.3436 65 SER A C 82 O O . SER A 54 ? 1.2341 1.1440 0.9467 0.0089 -0.1487 0.3425 65 SER A O 83 C CB . SER A 54 ? 0.9977 0.8951 0.7782 0.0202 -0.1769 0.3363 65 SER A CB 84 O OG . SER A 54 ? 1.0633 0.9574 0.8537 0.0134 -0.1618 0.3390 65 SER A OG 85 N N . ASP A 55 ? 1.2311 1.1289 0.9260 0.0166 -0.1767 0.3578 66 ASP A N 86 C CA . ASP A 55 ? 1.3034 1.1972 0.9638 0.0124 -0.1694 0.3736 66 ASP A CA 87 C C . ASP A 55 ? 1.1822 1.0873 0.8121 0.0113 -0.1607 0.3635 66 ASP A C 88 O O . ASP A 55 ? 1.1944 1.1024 0.8073 0.0066 -0.1445 0.3685 66 ASP A O 89 C CB . ASP A 55 ? 1.3488 1.2312 0.9914 0.0156 -0.1853 0.3915 66 ASP A CB 90 C CG . ASP A 55 ? 1.4154 1.2838 1.0867 0.0178 -0.1910 0.4005 66 ASP A CG 91 O OD1 . ASP A 55 ? 1.2762 1.1352 0.9502 0.0126 -0.1802 0.4116 66 ASP A OD1 92 O OD2 . ASP A 55 ? 1.6110 1.4779 1.3028 0.0248 -0.2058 0.3955 66 ASP A OD2 93 N N . THR A 56 ? 1.0272 0.9385 0.6507 0.0157 -0.1714 0.3492 67 THR A N 94 C CA . THR A 56 ? 1.1412 1.0609 0.7365 0.0155 -0.1648 0.3368 67 THR A CA 95 C C . THR A 56 ? 1.1375 1.0654 0.7448 0.0122 -0.1446 0.3260 67 THR A C 96 O O . THR A 56 ? 1.1048 1.0373 0.6865 0.0108 -0.1313 0.3238 67 THR A O 97 C CB . THR A 56 ? 1.2178 1.1423 0.8141 0.0196 -0.1803 0.3207 67 THR A CB 98 O OG1 . THR A 56 ? 1.3057 1.2247 0.8955 0.0229 -0.2005 0.3309 67 THR A OG1 99 C CG2 . THR A 56 ? 1.1046 1.0339 0.6674 0.0193 -0.1747 0.3081 67 THR A CG2 100 N N . LEU A 57 ? 1.0230 0.9528 0.6693 0.0116 -0.1424 0.3192 68 LEU A N 101 C CA . LEU A 57 ? 1.1023 1.0403 0.7644 0.0086 -0.1252 0.3093 68 LEU A CA 102 C C . LEU A 57 ? 1.1594 1.0975 0.8155 0.0032 -0.1086 0.3235 68 LEU A C 103 O O . LEU A 57 ? 1.2572 1.2039 0.9016 0.0017 -0.0931 0.3191 68 LEU A O 104 C CB . LEU A 57 ? 1.0382 0.9776 0.7422 0.0090 -0.1282 0.2997 68 LEU A CB 105 C CG . LEU A 57 ? 0.9917 0.9385 0.7076 0.0122 -0.1337 0.2793 68 LEU A CG 106 C CD1 . LEU A 57 ? 1.0254 0.9712 0.7218 0.0161 -0.1501 0.2760 68 LEU A CD1 107 C CD2 . LEU A 57 ? 1.0264 0.9735 0.7824 0.0127 -0.1371 0.2731 68 LEU A CD2 108 N N . SER A 58 ? 0.9952 0.9236 0.6598 0.0004 -0.1120 0.3409 69 SER A N 109 C CA . SER A 58 ? 0.9718 0.8998 0.6333 -0.0063 -0.0973 0.3563 69 SER A CA 110 C C . SER A 58 ? 1.0718 1.0030 0.6919 -0.0070 -0.0892 0.3657 69 SER A C 111 O O . SER A 58 ? 1.1229 1.0614 0.7372 -0.0117 -0.0720 0.3722 69 SER A O 112 C CB . SER A 58 ? 1.0349 0.9485 0.7131 -0.0093 -0.1046 0.3731 69 SER A CB 113 O OG . SER A 58 ? 1.0940 1.0046 0.8098 -0.0086 -0.1096 0.3639 69 SER A OG 114 N N . LYS A 59 ? 1.1410 1.0675 0.7324 -0.0024 -0.1016 0.3665 70 LYS A N 115 C CA . LYS A 59 ? 1.2123 1.1404 0.7600 -0.0024 -0.0955 0.3747 70 LYS A CA 116 C C . LYS A 59 ? 1.1907 1.1314 0.7232 -0.0003 -0.0813 0.3584 70 LYS A C 117 O O . LYS A 59 ? 1.2469 1.1937 0.7559 -0.0020 -0.0655 0.3648 70 LYS A O 118 C CB . LYS A 59 ? 1.1643 1.0835 0.6854 0.0021 -0.1149 0.3786 70 LYS A CB 119 C CG . LYS A 59 ? 1.3016 1.2207 0.7732 0.0023 -0.1103 0.3871 70 LYS A CG 120 C CD . LYS A 59 ? 1.4158 1.3265 0.8631 0.0068 -0.1318 0.3886 70 LYS A CD 121 C CE . LYS A 59 ? 1.4034 1.3092 0.8049 0.0081 -0.1265 0.3951 70 LYS A CE 122 N NZ . LYS A 59 ? 1.2372 1.1344 0.6195 0.0135 -0.1472 0.3939 70 LYS A NZ 123 N N . GLU A 60 ? 1.0009 0.9453 0.5473 0.0037 -0.0866 0.3377 71 GLU A N 124 C CA . GLU A 60 ? 1.1399 1.0936 0.6730 0.0066 -0.0748 0.3208 71 GLU A CA 125 C C . GLU A 60 ? 1.2190 1.1836 0.7806 0.0040 -0.0570 0.3160 71 GLU A C 126 O O . GLU A 60 ? 1.2507 1.2238 0.8059 0.0068 -0.0454 0.3028 71 GLU A O 127 C CB . GLU A 60 ? 1.0426 0.9943 0.5749 0.0113 -0.0892 0.3013 71 GLU A CB 128 C CG . GLU A 60 ? 1.1339 1.0771 0.6336 0.0138 -0.1065 0.3044 71 GLU A CG 129 C CD . GLU A 60 ? 1.3506 1.2928 0.8495 0.0172 -0.1205 0.2850 71 GLU A CD 130 O OE1 . GLU A 60 ? 1.3747 1.3222 0.8975 0.0178 -0.1160 0.2694 71 GLU A OE1 131 O OE2 . GLU A 60 ? 1.3588 1.2951 0.8330 0.0188 -0.1364 0.2859 71 GLU A OE2 132 N N . GLN A 61 ? 1.2084 1.1722 0.8010 -0.0012 -0.0556 0.3268 72 GLN A N 133 C CA . GLN A 61 ? 1.0545 1.0285 0.6769 -0.0050 -0.0408 0.3241 72 GLN A CA 134 C C . GLN A 61 ? 1.0656 1.0459 0.7068 -0.0012 -0.0404 0.3022 72 GLN A C 135 O O . GLN A 61 ? 1.1276 1.1192 0.7697 -0.0002 -0.0256 0.2945 72 GLN A O 136 C CB . GLN A 61 ? 0.9598 0.9447 0.5656 -0.0075 -0.0203 0.3336 72 GLN A CB 137 C CG . GLN A 61 ? 0.9161 0.9011 0.5358 -0.0161 -0.0136 0.3546 72 GLN A CG 138 C CD . GLN A 61 ? 1.1510 1.1495 0.7538 -0.0187 0.0073 0.3649 72 GLN A CD 139 O OE1 . GLN A 61 ? 1.1378 1.1400 0.7053 -0.0138 0.0136 0.3628 72 GLN A OE1 140 N NE2 . GLN A 61 ? 0.9992 1.0055 0.6271 -0.0266 0.0182 0.3757 72 GLN A NE2 141 N N . VAL A 62 ? 0.9428 0.9163 0.5994 0.0010 -0.0565 0.2928 73 VAL A N 142 C CA . VAL A 62 ? 1.0042 0.9826 0.6803 0.0037 -0.0574 0.2733 73 VAL A CA 143 C C . VAL A 62 ? 1.0387 1.0202 0.7550 -0.0004 -0.0542 0.2728 73 VAL A C 144 O O . VAL A 62 ? 0.8784 0.8522 0.6139 -0.0025 -0.0641 0.2789 73 VAL A O 145 C CB . VAL A 62 ? 0.9191 0.8910 0.5912 0.0079 -0.0755 0.2620 73 VAL A CB 146 C CG1 . VAL A 62 ? 0.9480 0.9102 0.6201 0.0075 -0.0910 0.2744 73 VAL A CG1 147 C CG2 . VAL A 62 ? 0.8998 0.8753 0.6026 0.0086 -0.0784 0.2461 73 VAL A CG2 148 N N . LEU A 63 ? 1.0171 1.0094 0.7449 -0.0011 -0.0403 0.2656 74 LEU A N 149 C CA . LEU A 63 ? 0.9090 0.9056 0.6723 -0.0055 -0.0362 0.2647 74 LEU A CA 150 C C . LEU A 63 ? 1.0122 1.0137 0.7913 -0.0023 -0.0369 0.2458 74 LEU A C 151 O O . LEU A 63 ? 0.9610 0.9620 0.7685 -0.0044 -0.0408 0.2411 74 LEU A O 152 C CB . LEU A 63 ? 0.8007 0.8077 0.5669 -0.0102 -0.0191 0.2751 74 LEU A CB 153 C CG . LEU A 63 ? 0.9323 0.9347 0.6827 -0.0146 -0.0172 0.2954 74 LEU A CG 154 C CD1 . LEU A 63 ? 1.0031 1.0193 0.7521 -0.0188 0.0015 0.3052 74 LEU A CD1 155 C CD2 . LEU A 63 ? 0.7572 0.7473 0.5281 -0.0196 -0.0282 0.3049 74 LEU A CD2 156 N N . ASN A 64 ? 1.0674 1.0725 0.8263 0.0028 -0.0331 0.2351 75 ASN A N 157 C CA . ASN A 64 ? 0.9192 0.9275 0.6892 0.0060 -0.0337 0.2176 75 ASN A CA 158 C C . ASN A 64 ? 0.8445 0.8444 0.6053 0.0093 -0.0492 0.2076 75 ASN A C 159 O O . ASN A 64 ? 0.9825 0.9757 0.7210 0.0105 -0.0575 0.2129 75 ASN A O 160 C CB . ASN A 64 ? 0.8684 0.8853 0.6243 0.0098 -0.0189 0.2113 75 ASN A CB 161 C CG . ASN A 64 ? 0.9185 0.9391 0.6904 0.0123 -0.0174 0.1955 75 ASN A CG 162 O OD1 . ASN A 64 ? 0.9430 0.9576 0.7042 0.0160 -0.0245 0.1830 75 ASN A OD1 163 N ND2 . ASN A 64 ? 1.1281 1.1581 0.9259 0.0097 -0.0089 0.1965 75 ASN A ND2 164 N N . ILE A 65 ? 0.9076 0.9085 0.6858 0.0103 -0.0534 0.1939 76 ILE A N 165 C CA . ILE A 65 ? 0.8772 0.8721 0.6505 0.0123 -0.0679 0.1841 76 ILE A CA 166 C C . ILE A 65 ? 0.9594 0.9505 0.6979 0.0160 -0.0681 0.1778 76 ILE A C 167 O O . ILE A 65 ? 0.9507 0.9358 0.6759 0.0170 -0.0814 0.1739 76 ILE A O 168 C CB . ILE A 65 ? 0.8297 0.8275 0.6290 0.0119 -0.0703 0.1710 76 ILE A CB 169 C CG1 . ILE A 65 ? 0.9368 0.9303 0.7353 0.0128 -0.0860 0.1627 76 ILE A CG1 170 C CG2 . ILE A 65 ? 0.8951 0.8977 0.6920 0.0138 -0.0580 0.1615 76 ILE A CG2 171 C CD1 . ILE A 65 ? 0.6083 0.6040 0.4216 0.0127 -0.0869 0.1483 76 ILE A CD1 172 N N . ARG A 66 ? 1.0436 1.0386 0.7677 0.0183 -0.0533 0.1769 77 ARG A N 173 C CA . ARG A 66 ? 1.0428 1.0332 0.7320 0.0226 -0.0509 0.1698 77 ARG A CA 174 C C . ARG A 66 ? 0.9282 0.9144 0.5859 0.0230 -0.0528 0.1812 77 ARG A C 175 O O . ARG A 66 ? 1.0126 0.9916 0.6387 0.0259 -0.0574 0.1754 77 ARG A O 176 C CB . ARG A 66 ? 0.7234 0.7199 0.4102 0.0263 -0.0334 0.1638 77 ARG A CB 177 C CG . ARG A 66 ? 0.6949 0.6929 0.4052 0.0270 -0.0333 0.1505 77 ARG A CG 178 C CD . ARG A 66 ? 0.7647 0.7733 0.4885 0.0291 -0.0161 0.1505 77 ARG A CD 179 N NE . ARG A 66 ? 0.6539 0.6639 0.4023 0.0291 -0.0172 0.1399 77 ARG A NE 180 C CZ . ARG A 66 ? 1.0182 1.0334 0.7987 0.0244 -0.0203 0.1427 77 ARG A CZ 181 N NH1 . ARG A 66 ? 0.7631 0.7814 0.5555 0.0196 -0.0228 0.1551 77 ARG A NH1 182 N NH2 . ARG A 66 ? 0.6019 0.6181 0.4014 0.0246 -0.0209 0.1330 77 ARG A NH2 183 N N . ASP A 67 ? 0.9195 0.9088 0.5848 0.0198 -0.0498 0.1976 78 ASP A N 184 C CA . ASP A 67 ? 0.9476 0.9327 0.5844 0.0195 -0.0519 0.2109 78 ASP A CA 185 C C . ASP A 67 ? 0.9170 0.8930 0.5457 0.0191 -0.0724 0.2117 78 ASP A C 186 O O . ASP A 67 ? 1.0213 0.9916 0.6179 0.0202 -0.0776 0.2172 78 ASP A O 187 C CB . ASP A 67 ? 1.0091 0.9989 0.6593 0.0151 -0.0440 0.2292 78 ASP A CB 188 C CG . ASP A 67 ? 1.0788 1.0804 0.7410 0.0145 -0.0244 0.2304 78 ASP A CG 189 O OD1 . ASP A 67 ? 1.1557 1.1616 0.8078 0.0191 -0.0150 0.2188 78 ASP A OD1 190 O OD2 . ASP A 67 ? 0.8780 0.8845 0.5604 0.0094 -0.0189 0.2431 78 ASP A OD2 191 N N . LEU A 68 ? 0.8808 0.8563 0.5389 0.0176 -0.0839 0.2065 79 LEU A N 192 C CA . LEU A 68 ? 0.8716 0.8415 0.5314 0.0172 -0.1032 0.2097 79 LEU A CA 193 C C . LEU A 68 ? 0.9805 0.9449 0.6108 0.0192 -0.1154 0.2012 79 LEU A C 194 O O . LEU A 68 ? 1.0478 1.0075 0.6614 0.0194 -0.1279 0.2094 79 LEU A O 195 C CB . LEU A 68 ? 0.8998 0.8727 0.5993 0.0159 -0.1104 0.2043 79 LEU A CB 196 C CG . LEU A 68 ? 0.7672 0.7373 0.4814 0.0160 -0.1277 0.2105 79 LEU A CG 197 C CD1 . LEU A 68 ? 0.7804 0.7501 0.4884 0.0172 -0.1430 0.1995 79 LEU A CD1 198 C CD2 . LEU A 68 ? 0.7777 0.7421 0.4754 0.0159 -0.1309 0.2287 79 LEU A CD2 199 N N . THR A 69 ? 1.0075 0.9715 0.6312 0.0206 -0.1126 0.1849 80 THR A N 200 C CA . THR A 69 ? 0.9844 0.9416 0.5796 0.0216 -0.1243 0.1750 80 THR A CA 201 C C . THR A 69 ? 1.0011 0.9538 0.5588 0.0247 -0.1119 0.1696 80 THR A C 202 O O . THR A 69 ? 1.0325 0.9780 0.5675 0.0259 -0.1172 0.1565 80 THR A O 203 C CB . THR A 69 ? 1.0079 0.9655 0.6235 0.0201 -0.1340 0.1596 80 THR A CB 204 O OG1 . THR A 69 ? 0.9776 0.9387 0.6111 0.0207 -0.1198 0.1506 80 THR A OG1 205 C CG2 . THR A 69 ? 0.9239 0.8865 0.5722 0.0179 -0.1477 0.1650 80 THR A CG2 206 N N . ARG A 70 ? 0.9161 0.8730 0.4679 0.0260 -0.0951 0.1799 81 ARG A N 207 C CA . ARG A 70 ? 0.9646 0.9203 0.4845 0.0300 -0.0793 0.1766 81 ARG A CA 208 C C . ARG A 70 ? 1.1512 1.0971 0.6239 0.0319 -0.0867 0.1753 81 ARG A C 209 O O . ARG A 70 ? 1.0523 0.9930 0.4956 0.0360 -0.0787 0.1645 81 ARG A O 210 C CB . ARG A 70 ? 0.9322 0.8971 0.4595 0.0296 -0.0617 0.1918 81 ARG A CB 211 C CG . ARG A 70 ? 1.0170 0.9832 0.5088 0.0335 -0.0455 0.1950 81 ARG A CG 212 C CD . ARG A 70 ? 1.2052 1.1828 0.7123 0.0312 -0.0298 0.2119 81 ARG A CD 213 N NE . ARG A 70 ? 1.3889 1.3652 0.9105 0.0256 -0.0405 0.2283 81 ARG A NE 214 C CZ . ARG A 70 ? 1.2428 1.2263 0.7877 0.0213 -0.0323 0.2430 81 ARG A CZ 215 N NH1 . ARG A 70 ? 1.0840 1.0791 0.6420 0.0214 -0.0136 0.2439 81 ARG A NH1 216 N NH2 . ARG A 70 ? 1.0068 0.9857 0.5626 0.0169 -0.0435 0.2570 81 ARG A NH2 217 N N . TYR A 71 ? 1.2057 1.1484 0.6705 0.0292 -0.1024 0.1860 82 TYR A N 218 C CA . TYR A 71 ? 1.2010 1.1347 0.6203 0.0303 -0.1114 0.1864 82 TYR A CA 219 C C . TYR A 71 ? 1.1347 1.0619 0.5529 0.0280 -0.1353 0.1773 82 TYR A C 220 O O . TYR A 71 ? 1.1660 1.0860 0.5506 0.0276 -0.1480 0.1789 82 TYR A O 221 C CB . TYR A 71 ? 1.2599 1.1947 0.6640 0.0291 -0.1108 0.2079 82 TYR A CB 222 C CG . TYR A 71 ? 1.1856 1.1277 0.5871 0.0304 -0.0871 0.2180 82 TYR A CG 223 C CD1 . TYR A 71 ? 1.0167 0.9643 0.4364 0.0272 -0.0828 0.2377 82 TYR A CD1 224 C CD2 . TYR A 71 ? 1.2719 1.2154 0.6538 0.0349 -0.0691 0.2079 82 TYR A CD2 225 C CE1 . TYR A 71 ? 1.2092 1.1649 0.6285 0.0271 -0.0615 0.2476 82 TYR A CE1 226 C CE2 . TYR A 71 ? 1.3668 1.3198 0.7488 0.0361 -0.0471 0.2177 82 TYR A CE2 227 C CZ . TYR A 71 ? 1.2207 1.1805 0.6219 0.0315 -0.0436 0.2377 82 TYR A CZ 228 O OH . TYR A 71 ? 1.0770 1.0476 0.4801 0.0315 -0.0220 0.2481 82 TYR A OH 229 N N . ASP A 72 ? 1.1270 1.0575 0.5820 0.0260 -0.1415 0.1679 83 ASP A N 230 C CA . ASP A 72 ? 1.1829 1.1101 0.6428 0.0230 -0.1633 0.1590 83 ASP A CA 231 C C . ASP A 72 ? 1.2717 1.1929 0.7285 0.0229 -0.1621 0.1382 83 ASP A C 232 O O . ASP A 72 ? 1.2161 1.1420 0.7063 0.0222 -0.1569 0.1311 83 ASP A O 233 C CB . ASP A 72 ? 1.1910 1.1273 0.6970 0.0203 -0.1732 0.1657 83 ASP A CB 234 C CG . ASP A 72 ? 1.3476 1.2876 0.8601 0.0208 -0.1738 0.1862 83 ASP A CG 235 O OD1 . ASP A 72 ? 1.5495 1.4869 1.0465 0.0203 -0.1895 0.1948 83 ASP A OD1 236 O OD2 . ASP A 72 ? 1.3502 1.2949 0.8832 0.0213 -0.1591 0.1939 83 ASP A OD2 237 N N . PRO A 73 ? 1.2882 1.1977 0.7035 0.0236 -0.1674 0.1283 84 PRO A N 238 C CA . PRO A 73 ? 1.2261 1.1264 0.6346 0.0236 -0.1669 0.1082 84 PRO A CA 239 C C . PRO A 73 ? 1.1776 1.0796 0.6150 0.0176 -0.1855 0.1005 84 PRO A C 240 O O . PRO A 73 ? 1.0997 1.0061 0.5432 0.0138 -0.2040 0.1076 84 PRO A O 241 C CB . PRO A 73 ? 1.2131 1.0991 0.5669 0.0253 -0.1711 0.1016 84 PRO A CB 242 C CG . PRO A 73 ? 1.2982 1.1873 0.6377 0.0233 -0.1846 0.1171 84 PRO A CG 243 C CD . PRO A 73 ? 1.2132 1.1161 0.5850 0.0242 -0.1755 0.1353 84 PRO A CD 244 N N . GLY A 74 ? 1.1657 1.0654 0.6216 0.0168 -0.1805 0.0871 85 GLY A N 245 C CA . GLY A 74 ? 1.2326 1.1344 0.7161 0.0106 -0.1962 0.0794 85 GLY A CA 246 C C . GLY A 74 ? 1.2706 1.1876 0.8046 0.0094 -0.1926 0.0865 85 GLY A C 247 O O . GLY A 74 ? 1.2863 1.2077 0.8481 0.0045 -0.2026 0.0810 85 GLY A O 248 N N . ILE A 75 ? 0.8759 0.8007 0.4209 0.0134 -0.1782 0.0987 86 ILE A N 249 C CA . ILE A 75 ? 0.9628 0.9002 0.5527 0.0127 -0.1731 0.1051 86 ILE A CA 250 C C . ILE A 75 ? 0.8177 0.7578 0.4140 0.0170 -0.1506 0.1082 86 ILE A C 251 O O . ILE A 75 ? 1.0492 0.9900 0.6291 0.0202 -0.1410 0.1184 86 ILE A O 252 C CB . ILE A 75 ? 0.8426 0.7892 0.4495 0.0115 -0.1851 0.1200 86 ILE A CB 253 C CG1 . ILE A 75 ? 0.9927 0.9490 0.6340 0.0130 -0.1739 0.1299 86 ILE A CG1 254 C CG2 . ILE A 75 ? 0.9784 0.9201 0.5496 0.0133 -0.1900 0.1299 86 ILE A CG2 255 C CD1 . ILE A 75 ? 1.3464 1.3099 1.0271 0.0107 -0.1738 0.1228 86 ILE A CD1 256 N N . ALA A 76 ? 0.8465 0.7887 0.4667 0.0167 -0.1425 0.0997 87 ALA A N 257 C CA . ALA A 76 ? 0.9015 0.8466 0.5280 0.0207 -0.1221 0.1005 87 ALA A CA 258 C C . ALA A 76 ? 1.0133 0.9684 0.6823 0.0189 -0.1169 0.1019 87 ALA A C 259 O O . ALA A 76 ? 0.9634 0.9217 0.6563 0.0150 -0.1276 0.0984 87 ALA A O 260 C CB . ALA A 76 ? 0.7952 0.7295 0.3974 0.0242 -0.1138 0.0867 87 ALA A CB 261 N N . VAL A 77 ? 0.7219 0.6826 0.3997 0.0217 -0.1002 0.1071 88 VAL A N 262 C CA . VAL A 77 ? 0.7507 0.7203 0.4654 0.0202 -0.0941 0.1085 88 VAL A CA 263 C C . VAL A 77 ? 0.7850 0.7522 0.5043 0.0221 -0.0853 0.0964 88 VAL A C 264 O O . VAL A 77 ? 0.9029 0.8667 0.6029 0.0269 -0.0736 0.0933 88 VAL A O 265 C CB . VAL A 77 ? 0.8153 0.7932 0.5395 0.0212 -0.0819 0.1218 88 VAL A CB 266 C CG1 . VAL A 77 ? 0.7965 0.7824 0.5562 0.0194 -0.0758 0.1217 88 VAL A CG1 267 C CG2 . VAL A 77 ? 0.7066 0.6852 0.4279 0.0194 -0.0904 0.1350 88 VAL A CG2 268 N N . VAL A 78 ? 0.7917 0.7608 0.5367 0.0188 -0.0905 0.0903 89 VAL A N 269 C CA . VAL A 78 ? 0.9213 0.8872 0.6725 0.0202 -0.0836 0.0796 89 VAL A CA 270 C C . VAL A 78 ? 0.8134 0.7889 0.5868 0.0219 -0.0695 0.0842 89 VAL A C 271 O O . VAL A 78 ? 0.8353 0.8195 0.6358 0.0187 -0.0706 0.0900 89 VAL A O 272 C CB . VAL A 78 ? 0.9635 0.9259 0.7288 0.0152 -0.0958 0.0704 89 VAL A CB 273 C CG1 . VAL A 78 ? 1.0146 0.9851 0.8004 0.0105 -0.1077 0.0767 89 VAL A CG1 274 C CG2 . VAL A 78 ? 0.8349 0.7984 0.6199 0.0154 -0.0880 0.0644 89 VAL A CG2 275 N N . GLU A 79 ? 0.7636 0.7376 0.5249 0.0274 -0.0564 0.0815 90 GLU A N 276 C CA . GLU A 79 ? 0.7184 0.7027 0.4995 0.0293 -0.0431 0.0860 90 GLU A CA 277 C C . GLU A 79 ? 0.6749 0.6612 0.4833 0.0264 -0.0454 0.0806 90 GLU A C 278 O O . GLU A 79 ? 0.6355 0.6128 0.4411 0.0255 -0.0521 0.0705 90 GLU A O 279 C CB . GLU A 79 ? 0.7090 0.6920 0.4714 0.0369 -0.0290 0.0832 90 GLU A CB 280 C CG . GLU A 79 ? 0.7571 0.7379 0.4887 0.0401 -0.0253 0.0880 90 GLU A CG 281 C CD . GLU A 79 ? 1.0702 1.0632 0.8102 0.0376 -0.0204 0.1036 90 GLU A CD 282 O OE1 . GLU A 79 ? 0.9948 0.9989 0.7627 0.0352 -0.0151 0.1098 90 GLU A OE1 283 O OE2 . GLU A 79 ? 1.1290 1.1196 0.8469 0.0375 -0.0224 0.1098 90 GLU A OE2 284 N N . GLN A 80 ? 0.7077 0.7053 0.5414 0.0245 -0.0401 0.0876 91 GLN A N 285 C CA . GLN A 80 ? 0.6096 0.6105 0.4694 0.0212 -0.0425 0.0841 91 GLN A CA 286 C C . GLN A 80 ? 0.6493 0.6520 0.5146 0.0253 -0.0320 0.0801 91 GLN A C 287 O O . GLN A 80 ? 0.7802 0.7823 0.6607 0.0235 -0.0340 0.0751 91 GLN A O 288 C CB . GLN A 80 ? 0.6401 0.6504 0.5230 0.0165 -0.0442 0.0931 91 GLN A CB 289 C CG . GLN A 80 ? 0.6979 0.7134 0.6070 0.0133 -0.0442 0.0911 91 GLN A CG 290 C CD . GLN A 80 ? 0.7535 0.7780 0.6743 0.0147 -0.0329 0.0957 91 GLN A CD 291 O OE1 . GLN A 80 ? 0.6497 0.6774 0.5599 0.0184 -0.0240 0.0999 91 GLN A OE1 292 N NE2 . GLN A 80 ? 0.4483 0.4779 0.3911 0.0115 -0.0331 0.0951 91 GLN A NE2 293 N N . GLY A 81 ? 0.6565 0.6618 0.5092 0.0312 -0.0208 0.0826 92 GLY A N 294 C CA . GLY A 81 ? 0.5991 0.6067 0.4559 0.0368 -0.0106 0.0790 92 GLY A CA 295 C C . GLY A 81 ? 0.6666 0.6905 0.5414 0.0375 0.0001 0.0885 92 GLY A C 296 O O . GLY A 81 ? 0.6147 0.6438 0.4866 0.0440 0.0113 0.0888 92 GLY A O 297 N N . ARG A 82 ? 0.7916 0.8237 0.6857 0.0307 -0.0035 0.0963 93 ARG A N 298 C CA . ARG A 82 ? 0.7466 0.7937 0.6590 0.0294 0.0050 0.1056 93 ARG A CA 299 C C . ARG A 82 ? 0.7604 0.8128 0.6718 0.0252 0.0056 0.1168 93 ARG A C 300 O O . ARG A 82 ? 0.8982 0.9596 0.8291 0.0200 0.0066 0.1246 93 ARG A O 301 C CB . ARG A 82 ? 0.5742 0.6260 0.5128 0.0248 0.0013 0.1048 93 ARG A CB 302 C CG . ARG A 82 ? 0.5954 0.6440 0.5374 0.0290 0.0025 0.0963 93 ARG A CG 303 C CD . ARG A 82 ? 0.7080 0.7626 0.6747 0.0243 -0.0005 0.0969 93 ARG A CD 304 N NE . ARG A 82 ? 0.6530 0.7025 0.6262 0.0173 -0.0109 0.0956 93 ARG A NE 305 C CZ . ARG A 82 ? 0.6022 0.6428 0.5747 0.0159 -0.0183 0.0879 93 ARG A CZ 306 N NH1 . ARG A 82 ? 0.5683 0.6017 0.5330 0.0202 -0.0172 0.0808 93 ARG A NH1 307 N NH2 . ARG A 82 ? 0.5378 0.5766 0.5179 0.0102 -0.0264 0.0875 93 ARG A NH2 308 N N . GLY A 83 ? 0.7077 0.7533 0.5953 0.0271 0.0043 0.1178 94 GLY A N 309 C CA . GLY A 83 ? 0.8271 0.8766 0.7102 0.0238 0.0058 0.1296 94 GLY A CA 310 C C . GLY A 83 ? 0.8077 0.8494 0.6912 0.0185 -0.0070 0.1321 94 GLY A C 311 O O . GLY A 83 ? 0.8031 0.8435 0.6756 0.0169 -0.0079 0.1408 94 GLY A O 312 N N . ALA A 84 ? 0.7127 0.7495 0.6093 0.0159 -0.0166 0.1252 95 ALA A N 313 C CA . ALA A 84 ? 0.7023 0.7325 0.6005 0.0123 -0.0289 0.1264 95 ALA A CA 314 C C . ALA A 84 ? 0.8085 0.8290 0.6827 0.0151 -0.0362 0.1203 95 ALA A C 315 O O . ALA A 84 ? 0.8905 0.9080 0.7448 0.0197 -0.0311 0.1156 95 ALA A O 316 C CB . ALA A 84 ? 0.6900 0.7207 0.6117 0.0088 -0.0353 0.1214 95 ALA A CB 317 N N . SER A 85 ? 0.7054 0.7212 0.5820 0.0126 -0.0484 0.1202 96 SER A N 318 C CA . SER A 85 ? 0.6916 0.6991 0.5483 0.0139 -0.0578 0.1142 96 SER A CA 319 C C . SER A 85 ? 0.7954 0.8015 0.6680 0.0110 -0.0693 0.1076 96 SER A C 320 O O . SER A 85 ? 0.7293 0.7403 0.6259 0.0083 -0.0707 0.1096 96 SER A O 321 C CB . SER A 85 ? 0.5970 0.6014 0.4352 0.0143 -0.0621 0.1233 96 SER A CB 322 O OG . SER A 85 ? 0.6597 0.6665 0.5149 0.0113 -0.0675 0.1322 96 SER A OG 323 N N . SER A 86 ? 0.8325 0.8321 0.6915 0.0112 -0.0774 0.0995 97 SER A N 324 C CA . SER A 86 ? 0.6952 0.6952 0.5697 0.0078 -0.0879 0.0932 97 SER A CA 325 C C . SER A 86 ? 0.7052 0.7021 0.5690 0.0066 -0.1017 0.0934 97 SER A C 326 O O . SER A 86 ? 0.6826 0.6758 0.5423 0.0045 -0.1097 0.0851 97 SER A O 327 C CB . SER A 86 ? 0.5959 0.5920 0.4705 0.0074 -0.0856 0.0822 97 SER A CB 328 O OG . SER A 86 ? 0.8057 0.8062 0.6942 0.0083 -0.0746 0.0825 97 SER A OG 329 N N . GLY A 87 ? 0.6310 0.6293 0.4909 0.0075 -0.1053 0.1032 98 GLY A N 330 C CA . GLY A 87 ? 0.6717 0.6684 0.5233 0.0067 -0.1195 0.1048 98 GLY A CA 331 C C . GLY A 87 ? 0.7091 0.6975 0.5261 0.0082 -0.1225 0.1033 98 GLY A C 332 O O . GLY A 87 ? 0.6368 0.6211 0.4346 0.0110 -0.1119 0.1044 98 GLY A O 333 N N . TYR A 88 ? 0.8102 0.7965 0.6190 0.0063 -0.1371 0.1005 99 TYR A N 334 C CA . TYR A 88 ? 0.9656 0.9434 0.7394 0.0074 -0.1425 0.1000 99 TYR A CA 335 C C . TYR A 88 ? 1.0441 1.0140 0.8031 0.0047 -0.1503 0.0870 99 TYR A C 336 O O . TYR A 88 ? 0.9491 0.9208 0.7267 0.0014 -0.1524 0.0791 99 TYR A O 337 C CB . TYR A 88 ? 0.9199 0.9003 0.6899 0.0076 -0.1547 0.1105 99 TYR A CB 338 C CG . TYR A 88 ? 0.9409 0.9248 0.7183 0.0102 -0.1473 0.1241 99 TYR A CG 339 C CD1 . TYR A 88 ? 0.9459 0.9248 0.6968 0.0128 -0.1401 0.1319 99 TYR A CD1 340 C CD2 . TYR A 88 ? 0.7993 0.7906 0.6095 0.0100 -0.1473 0.1293 99 TYR A CD2 341 C CE1 . TYR A 88 ? 1.0121 0.9935 0.7704 0.0139 -0.1336 0.1451 99 TYR A CE1 342 C CE2 . TYR A 88 ? 0.9654 0.9574 0.7820 0.0117 -0.1412 0.1414 99 TYR A CE2 343 C CZ . TYR A 88 ? 1.0789 1.0659 0.8701 0.0132 -0.1347 0.1497 99 TYR A CZ 344 O OH . TYR A 88 ? 1.1248 1.1117 0.9230 0.0137 -0.1290 0.1626 99 TYR A OH 345 N N . SER A 89 ? 0.9980 0.9584 0.7222 0.0058 -0.1548 0.0849 100 SER A N 346 C CA . SER A 89 ? 0.9224 0.8721 0.6275 0.0030 -0.1629 0.0720 100 SER A CA 347 C C . SER A 89 ? 0.9667 0.9118 0.6459 0.0012 -0.1787 0.0734 100 SER A C 348 O O . SER A 89 ? 0.9766 0.9154 0.6245 0.0049 -0.1756 0.0772 100 SER A O 349 C CB . SER A 89 ? 0.8517 0.7898 0.5342 0.0071 -0.1488 0.0637 100 SER A CB 350 O OG . SER A 89 ? 0.8775 0.8028 0.5446 0.0042 -0.1562 0.0500 100 SER A OG 351 N N . ILE A 90 ? 1.0205 0.9697 0.7127 -0.0045 -0.1957 0.0708 101 ILE A N 352 C CA . ILE A 90 ? 1.0455 0.9926 0.7172 -0.0069 -0.2135 0.0728 101 ILE A CA 353 C C . ILE A 90 ? 1.0397 0.9806 0.7062 -0.0141 -0.2283 0.0603 101 ILE A C 354 O O . ILE A 90 ? 0.8633 0.8096 0.5581 -0.0188 -0.2303 0.0551 101 ILE A O 355 C CB . ILE A 90 ? 0.9417 0.9039 0.6379 -0.0069 -0.2235 0.0859 101 ILE A CB 356 C CG1 . ILE A 90 ? 0.9941 0.9614 0.7002 -0.0010 -0.2094 0.0982 101 ILE A CG1 357 C CG2 . ILE A 90 ? 0.8753 0.8358 0.5480 -0.0083 -0.2414 0.0900 101 ILE A CG2 358 C CD1 . ILE A 90 ? 0.9615 0.9407 0.6910 0.0002 -0.2183 0.1110 101 ILE A CD1 359 N N . ARG A 91 ? 1.1035 1.0327 0.7330 -0.0155 -0.2386 0.0559 102 ARG A N 360 C CA . ARG A 91 ? 1.1051 1.0267 0.7256 -0.0234 -0.2553 0.0444 102 ARG A CA 361 C C . ARG A 91 ? 1.0402 0.9521 0.6685 -0.0268 -0.2487 0.0310 102 ARG A C 362 O O . ARG A 91 ? 1.0715 0.9835 0.7123 -0.0351 -0.2615 0.0241 102 ARG A O 363 C CB . ARG A 91 ? 1.0866 1.0250 0.7355 -0.0296 -0.2746 0.0504 102 ARG A CB 364 C CG . ARG A 91 ? 1.0216 0.9678 0.6610 -0.0268 -0.2854 0.0633 102 ARG A CG 365 C CD . ARG A 91 ? 0.8995 0.8328 0.4959 -0.0297 -0.3003 0.0585 102 ARG A CD 366 N NE . ARG A 91 ? 1.2282 1.1637 0.8039 -0.0247 -0.3044 0.0713 102 ARG A NE 367 C CZ . ARG A 91 ? 1.1341 1.0815 0.7180 -0.0264 -0.3230 0.0809 102 ARG A CZ 368 N NH1 . ARG A 91 ? 1.0532 1.0003 0.6156 -0.0214 -0.3255 0.0931 102 ARG A NH1 369 N NH2 . ARG A 91 ? 1.0471 1.0071 0.6609 -0.0332 -0.3391 0.0790 102 ARG A NH2 370 N N . GLY A 92 ? 0.9917 0.8960 0.6138 -0.0204 -0.2290 0.0281 103 GLY A N 371 C CA . GLY A 92 ? 1.1313 1.0241 0.7575 -0.0221 -0.2219 0.0160 103 GLY A CA 372 C C . GLY A 92 ? 1.0573 0.9626 0.7252 -0.0225 -0.2118 0.0192 103 GLY A C 373 O O . GLY A 92 ? 1.0130 0.9095 0.6837 -0.0212 -0.2012 0.0119 103 GLY A O 374 N N . MET A 93 ? 0.9225 0.8476 0.6219 -0.0237 -0.2153 0.0301 104 MET A N 375 C CA . MET A 93 ? 0.9612 0.8985 0.6988 -0.0241 -0.2062 0.0331 104 MET A CA 376 C C . MET A 93 ? 0.9568 0.9030 0.7037 -0.0164 -0.1915 0.0437 104 MET A C 377 O O . MET A 93 ? 0.9675 0.9141 0.6969 -0.0120 -0.1909 0.0510 104 MET A O 378 C CB . MET A 93 ? 1.0698 1.0229 0.8399 -0.0313 -0.2199 0.0362 104 MET A CB 379 C CG . MET A 93 ? 1.0967 1.0427 0.8608 -0.0407 -0.2357 0.0267 104 MET A CG 380 S SD . MET A 93 ? 0.8930 0.8196 0.6497 -0.0437 -0.2274 0.0131 104 MET A SD 381 C CE . MET A 93 ? 0.7926 0.7101 0.5392 -0.0560 -0.2493 0.0036 104 MET A CE 382 N N . ASP A 94 ? 0.8905 0.8432 0.6638 -0.0154 -0.1799 0.0447 105 ASP A N 383 C CA . ASP A 94 ? 0.7791 0.7397 0.5628 -0.0093 -0.1661 0.0540 105 ASP A CA 384 C C . ASP A 94 ? 0.7119 0.6851 0.5332 -0.0108 -0.1610 0.0569 105 ASP A C 385 O O . ASP A 94 ? 0.7289 0.7071 0.5697 -0.0164 -0.1683 0.0529 105 ASP A O 386 C CB . ASP A 94 ? 0.7713 0.7214 0.5329 -0.0033 -0.1507 0.0511 105 ASP A CB 387 C CG . ASP A 94 ? 0.9586 0.9011 0.7252 -0.0039 -0.1436 0.0413 105 ASP A CG 388 O OD1 . ASP A 94 ? 0.9956 0.9356 0.7720 -0.0102 -0.1528 0.0345 105 ASP A OD1 389 O OD2 . ASP A 94 ? 1.0967 1.0362 0.8584 0.0017 -0.1290 0.0409 105 ASP A OD2 390 N N . LYS A 95 ? 0.7806 0.7592 0.6115 -0.0061 -0.1485 0.0640 106 LYS A N 391 C CA . LYS A 95 ? 0.7432 0.7326 0.6066 -0.0069 -0.1426 0.0668 106 LYS A CA 392 C C . LYS A 95 ? 0.7522 0.7537 0.6403 -0.0102 -0.1538 0.0702 106 LYS A C 393 O O . LYS A 95 ? 0.8196 0.8258 0.7078 -0.0084 -0.1606 0.0777 106 LYS A O 394 C CB . LYS A 95 ? 0.7687 0.7540 0.6392 -0.0088 -0.1355 0.0584 106 LYS A CB 395 C CG . LYS A 95 ? 0.7657 0.7428 0.6207 -0.0038 -0.1216 0.0566 106 LYS A CG 396 C CD . LYS A 95 ? 0.8107 0.7817 0.6709 -0.0054 -0.1170 0.0480 106 LYS A CD 397 C CE . LYS A 95 ? 0.9607 0.9424 0.8527 -0.0094 -0.1167 0.0494 106 LYS A CE 398 N NZ . LYS A 95 ? 0.7723 0.7478 0.6696 -0.0123 -0.1146 0.0419 106 LYS A NZ 399 N N . ASN A 96 ? 0.7340 0.7408 0.6431 -0.0147 -0.1554 0.0650 107 ASN A N 400 C CA . ASN A 96 ? 0.6728 0.6935 0.6090 -0.0173 -0.1637 0.0676 107 ASN A CA 401 C C . ASN A 96 ? 0.6975 0.7209 0.6294 -0.0213 -0.1803 0.0664 107 ASN A C 402 O O . ASN A 96 ? 0.7485 0.7853 0.7040 -0.0238 -0.1881 0.0681 107 ASN A O 403 C CB . ASN A 96 ? 0.5653 0.5919 0.5250 -0.0211 -0.1584 0.0630 107 ASN A CB 404 C CG . ASN A 96 ? 0.6746 0.7023 0.6441 -0.0174 -0.1442 0.0656 107 ASN A CG 405 O OD1 . ASN A 96 ? 0.8878 0.9180 0.8599 -0.0128 -0.1405 0.0725 107 ASN A OD1 406 N ND2 . ASN A 96 ? 0.5469 0.5721 0.5216 -0.0198 -0.1369 0.0604 107 ASN A ND2 407 N N . ARG A 97 ? 0.6521 0.6634 0.5539 -0.0219 -0.1856 0.0632 108 ARG A N 408 C CA . ARG A 97 ? 0.6848 0.6971 0.5785 -0.0262 -0.2026 0.0618 108 ARG A CA 409 C C . ARG A 97 ? 0.7712 0.7855 0.6527 -0.0217 -0.2099 0.0708 108 ARG A C 410 O O . ARG A 97 ? 0.7223 0.7384 0.5958 -0.0245 -0.2252 0.0712 108 ARG A O 411 C CB . ARG A 97 ? 0.7608 0.7570 0.6281 -0.0308 -0.2064 0.0514 108 ARG A CB 412 C CG . ARG A 97 ? 0.8288 0.8261 0.7131 -0.0386 -0.2085 0.0438 108 ARG A CG 413 C CD . ARG A 97 ? 0.7935 0.7704 0.6537 -0.0405 -0.2042 0.0335 108 ARG A CD 414 N NE . ARG A 97 ? 0.7482 0.7251 0.6252 -0.0486 -0.2067 0.0274 108 ARG A NE 415 C CZ . ARG A 97 ? 0.8112 0.7721 0.6777 -0.0502 -0.2005 0.0194 108 ARG A CZ 416 N NH1 . ARG A 97 ? 0.6261 0.5710 0.4662 -0.0434 -0.1909 0.0158 108 ARG A NH1 417 N NH2 . ARG A 97 ? 0.7767 0.7380 0.6597 -0.0585 -0.2037 0.0154 108 ARG A NH2 418 N N . VAL A 98 ? 0.5913 0.6050 0.4713 -0.0151 -0.1994 0.0784 109 VAL A N 419 C CA . VAL A 98 ? 0.8475 0.8648 0.7232 -0.0107 -0.2056 0.0892 109 VAL A CA 420 C C . VAL A 98 ? 0.7966 0.8227 0.6993 -0.0062 -0.1976 0.0970 109 VAL A C 421 O O . VAL A 98 ? 0.8466 0.8696 0.7532 -0.0044 -0.1832 0.0967 109 VAL A O 422 C CB . VAL A 98 ? 0.7030 0.7069 0.5402 -0.0075 -0.2031 0.0920 109 VAL A CB 423 C CG1 . VAL A 98 ? 0.8114 0.8033 0.6297 -0.0072 -0.1896 0.0840 109 VAL A CG1 424 C CG2 . VAL A 98 ? 0.7228 0.7286 0.5606 -0.0017 -0.1990 0.1050 109 VAL A CG2 425 N N . SER A 99 ? 0.7964 0.8335 0.7184 -0.0044 -0.2075 0.1037 110 SER A N 426 C CA . SER A 99 ? 0.8382 0.8829 0.7876 0.0001 -0.2015 0.1098 110 SER A CA 427 C C . SER A 99 ? 0.7902 0.8268 0.7280 0.0054 -0.1952 0.1198 110 SER A C 428 O O . SER A 99 ? 0.8090 0.8393 0.7232 0.0068 -0.2010 0.1258 110 SER A O 429 C CB . SER A 99 ? 0.8299 0.8896 0.8060 0.0012 -0.2139 0.1129 110 SER A CB 430 O OG . SER A 99 ? 0.8874 0.9471 0.8512 0.0034 -0.2276 0.1204 110 SER A OG 431 N N . LEU A 100 ? 0.5409 0.5776 0.4949 0.0078 -0.1835 0.1218 111 LEU A N 432 C CA . LEU A 100 ? 0.5463 0.5751 0.4927 0.0115 -0.1763 0.1312 111 LEU A CA 433 C C . LEU A 100 ? 0.7991 0.8326 0.7732 0.0157 -0.1771 0.1367 111 LEU A C 434 O O . LEU A 100 ? 0.6191 0.6573 0.6149 0.0154 -0.1703 0.1316 111 LEU A O 435 C CB . LEU A 100 ? 0.5745 0.5973 0.5139 0.0097 -0.1605 0.1276 111 LEU A CB 436 C CG . LEU A 100 ? 0.6992 0.7128 0.6173 0.0108 -0.1518 0.1352 111 LEU A CG 437 C CD1 . LEU A 100 ? 0.5317 0.5446 0.4595 0.0096 -0.1370 0.1330 111 LEU A CD1 438 C CD2 . LEU A 100 ? 0.7594 0.7695 0.6755 0.0141 -0.1572 0.1482 111 LEU A CD2 439 N N . THR A 101 ? 0.8050 0.8365 0.7777 0.0200 -0.1854 0.1471 112 THR A N 440 C CA . THR A 101 ? 0.7679 0.8021 0.7665 0.0253 -0.1870 0.1520 112 THR A CA 441 C C . THR A 101 ? 0.7477 0.7697 0.7394 0.0286 -0.1838 0.1638 112 THR A C 442 O O . THR A 101 ? 0.8226 0.8367 0.7893 0.0278 -0.1851 0.1713 112 THR A O 443 C CB . THR A 101 ? 0.7768 0.8223 0.7905 0.0288 -0.2022 0.1536 112 THR A CB 444 O OG1 . THR A 101 ? 0.8383 0.8820 0.8286 0.0278 -0.2137 0.1585 112 THR A OG1 445 C CG2 . THR A 101 ? 0.5915 0.6513 0.6249 0.0257 -0.2030 0.1425 112 THR A CG2 446 N N . VAL A 102 ? 0.7561 0.7761 0.7697 0.0320 -0.1794 0.1652 113 VAL A N 447 C CA . VAL A 102 ? 0.7834 0.7906 0.7950 0.0352 -0.1779 0.1765 113 VAL A CA 448 C C . VAL A 102 ? 0.7235 0.7325 0.7608 0.0427 -0.1847 0.1790 113 VAL A C 449 O O . VAL A 102 ? 0.7299 0.7435 0.7894 0.0443 -0.1797 0.1713 113 VAL A O 450 C CB . VAL A 102 ? 0.7037 0.7025 0.7148 0.0312 -0.1634 0.1754 113 VAL A CB 451 C CG1 . VAL A 102 ? 0.7495 0.7346 0.7642 0.0340 -0.1629 0.1865 113 VAL A CG1 452 C CG2 . VAL A 102 ? 0.6151 0.6123 0.6010 0.0253 -0.1560 0.1748 113 VAL A CG2 453 N N . ASP A 103 ? 0.6684 0.6737 0.7018 0.0478 -0.1961 0.1899 114 ASP A N 454 C CA . ASP A 103 ? 0.7821 0.7887 0.8395 0.0567 -0.2038 0.1935 114 ASP A CA 455 C C . ASP A 103 ? 0.8889 0.9142 0.9715 0.0594 -0.2070 0.1830 114 ASP A C 456 O O . ASP A 103 ? 0.8458 0.8734 0.9533 0.0658 -0.2054 0.1803 114 ASP A O 457 C CB . ASP A 103 ? 0.8240 0.8156 0.8921 0.0595 -0.1958 0.1964 114 ASP A CB 458 C CG . ASP A 103 ? 0.9664 0.9400 1.0126 0.0564 -0.1933 0.2086 114 ASP A CG 459 O OD1 . ASP A 103 ? 1.0110 0.9737 1.0576 0.0527 -0.1827 0.2080 114 ASP A OD1 460 O OD2 . ASP A 103 ? 1.0359 1.0066 1.0644 0.0571 -0.2021 0.2192 114 ASP A OD2 461 N N . GLY A 104 ? 0.7991 0.8374 0.8747 0.0544 -0.2112 0.1771 115 GLY A N 462 C CA . GLY A 104 ? 0.6807 0.7383 0.7792 0.0554 -0.2154 0.1687 115 GLY A CA 463 C C . GLY A 104 ? 0.7334 0.7965 0.8418 0.0505 -0.2028 0.1562 115 GLY A C 464 O O . GLY A 104 ? 0.8799 0.9595 1.0064 0.0497 -0.2044 0.1488 115 GLY A O 465 N N . VAL A 105 ? 0.5706 0.6209 0.6676 0.0467 -0.1905 0.1544 116 VAL A N 466 C CA . VAL A 105 ? 0.6361 0.6901 0.7410 0.0422 -0.1786 0.1434 116 VAL A CA 467 C C . VAL A 105 ? 0.7185 0.7706 0.8012 0.0336 -0.1740 0.1390 116 VAL A C 468 O O . VAL A 105 ? 0.8541 0.8944 0.9149 0.0312 -0.1707 0.1439 116 VAL A O 469 C CB . VAL A 105 ? 0.6462 0.6880 0.7573 0.0442 -0.1679 0.1434 116 VAL A CB 470 C CG1 . VAL A 105 ? 0.5191 0.5675 0.6422 0.0408 -0.1575 0.1320 116 VAL A CG1 471 C CG2 . VAL A 105 ? 0.5455 0.5830 0.6733 0.0537 -0.1728 0.1493 116 VAL A CG2 472 N N . SER A 106 ? 0.6956 0.7593 0.7842 0.0292 -0.1735 0.1299 117 SER A N 473 C CA . SER A 106 ? 0.6941 0.7550 0.7628 0.0219 -0.1693 0.1246 117 SER A CA 474 C C . SER A 106 ? 0.6619 0.7137 0.7252 0.0194 -0.1553 0.1220 117 SER A C 475 O O . SER A 106 ? 0.7267 0.7785 0.8063 0.0213 -0.1485 0.1201 117 SER A O 476 C CB . SER A 106 ? 0.6761 0.7501 0.7545 0.0174 -0.1725 0.1159 117 SER A CB 477 O OG . SER A 106 ? 0.7799 0.8643 0.8853 0.0193 -0.1682 0.1116 117 SER A OG 478 N N . GLN A 107 ? 0.6555 0.7000 0.6957 0.0154 -0.1511 0.1217 118 GLN A N 479 C CA . GLN A 107 ? 0.6291 0.6671 0.6643 0.0128 -0.1384 0.1199 118 GLN A CA 480 C C . GLN A 107 ? 0.7189 0.7620 0.7574 0.0083 -0.1328 0.1098 118 GLN A C 481 O O . GLN A 107 ? 0.9192 0.9710 0.9669 0.0068 -0.1380 0.1042 118 GLN A O 482 C CB . GLN A 107 ? 0.6770 0.7053 0.6869 0.0119 -0.1354 0.1261 118 GLN A CB 483 C CG . GLN A 107 ? 0.5644 0.5862 0.5689 0.0155 -0.1405 0.1376 118 GLN A CG 484 C CD . GLN A 107 ? 0.6578 0.6764 0.6820 0.0184 -0.1380 0.1412 118 GLN A CD 485 O OE1 . GLN A 107 ? 0.6747 0.6869 0.6988 0.0165 -0.1290 0.1433 118 GLN A OE1 486 N NE2 . GLN A 107 ? 0.6416 0.6645 0.6832 0.0230 -0.1460 0.1417 118 GLN A NE2 487 N N . ILE A 108 ? 0.5368 0.5749 0.5683 0.0060 -0.1224 0.1082 119 ILE A N 488 C CA . ILE A 108 ? 0.5464 0.5877 0.5813 0.0022 -0.1161 0.0998 119 ILE A CA 489 C C . ILE A 108 ? 0.5884 0.6298 0.6093 -0.0006 -0.1201 0.0945 119 ILE A C 490 O O . ILE A 108 ? 0.8120 0.8479 0.8128 0.0000 -0.1236 0.0971 119 ILE A O 491 C CB . ILE A 108 ? 0.5911 0.6273 0.6216 0.0010 -0.1049 0.1007 119 ILE A CB 492 C CG1 . ILE A 108 ? 0.5675 0.6077 0.6167 -0.0003 -0.0993 0.0962 119 ILE A CG1 493 C CG2 . ILE A 108 ? 0.6201 0.6530 0.6324 -0.0008 -0.1004 0.0977 119 ILE A CG2 494 C CD1 . ILE A 108 ? 0.4936 0.5392 0.5473 -0.0033 -0.0984 0.0882 119 ILE A CD1 495 N N . GLN A 109 ? 0.5613 0.6080 0.5921 -0.0038 -0.1198 0.0871 120 GLN A N 496 C CA . GLN A 109 ? 0.6195 0.6637 0.6376 -0.0074 -0.1228 0.0812 120 GLN A CA 497 C C . GLN A 109 ? 0.5949 0.6311 0.5991 -0.0079 -0.1130 0.0788 120 GLN A C 498 O O . GLN A 109 ? 0.5864 0.6231 0.5981 -0.0072 -0.1042 0.0799 120 GLN A O 499 C CB . GLN A 109 ? 0.4605 0.5130 0.4955 -0.0116 -0.1258 0.0752 120 GLN A CB 500 C CG . GLN A 109 ? 0.4173 0.4801 0.4661 -0.0118 -0.1367 0.0765 120 GLN A CG 501 C CD . GLN A 109 ? 0.5006 0.5726 0.5651 -0.0172 -0.1388 0.0709 120 GLN A CD 502 O OE1 . GLN A 109 ? 0.6229 0.6910 0.6844 -0.0213 -0.1332 0.0660 120 GLN A OE1 503 N NE2 . GLN A 109 ? 0.4386 0.5234 0.5206 -0.0174 -0.1468 0.0723 120 GLN A NE2 504 N N . SER A 110 ? 0.6112 0.6399 0.5951 -0.0087 -0.1149 0.0753 121 SER A N 505 C CA . SER A 110 ? 0.6238 0.6456 0.5964 -0.0084 -0.1059 0.0717 121 SER A CA 506 C C . SER A 110 ? 0.6240 0.6481 0.6103 -0.0122 -0.1042 0.0656 121 SER A C 507 O O . SER A 110 ? 0.6659 0.6910 0.6557 -0.0162 -0.1117 0.0612 121 SER A O 508 C CB . SER A 110 ? 0.6661 0.6777 0.6121 -0.0074 -0.1085 0.0684 121 SER A CB 509 O OG . SER A 110 ? 0.6764 0.6813 0.6124 -0.0057 -0.0992 0.0647 121 SER A OG 510 N N . TYR A 111 ? 0.6108 0.6363 0.6051 -0.0115 -0.0948 0.0659 122 TYR A N 511 C CA . TYR A 111 ? 0.5345 0.5619 0.5407 -0.0150 -0.0924 0.0614 122 TYR A CA 512 C C . TYR A 111 ? 0.6322 0.6522 0.6284 -0.0134 -0.0846 0.0590 122 TYR A C 513 O O . TYR A 111 ? 0.6589 0.6803 0.6556 -0.0104 -0.0769 0.0626 122 TYR A O 514 C CB . TYR A 111 ? 0.5119 0.5487 0.5391 -0.0157 -0.0891 0.0639 122 TYR A CB 515 C CG . TYR A 111 ? 0.5121 0.5532 0.5526 -0.0200 -0.0880 0.0600 122 TYR A CG 516 C CD1 . TYR A 111 ? 0.6009 0.6507 0.6562 -0.0229 -0.0932 0.0590 122 TYR A CD1 517 C CD2 . TYR A 111 ? 0.5513 0.5886 0.5900 -0.0208 -0.0816 0.0580 122 TYR A CD2 518 C CE1 . TYR A 111 ? 0.5848 0.6394 0.6517 -0.0272 -0.0913 0.0562 122 TYR A CE1 519 C CE2 . TYR A 111 ? 0.5289 0.5696 0.5782 -0.0251 -0.0807 0.0554 122 TYR A CE2 520 C CZ . TYR A 111 ? 0.5763 0.6256 0.6392 -0.0285 -0.0852 0.0546 122 TYR A CZ 521 O OH . TYR A 111 ? 0.5279 0.5816 0.6010 -0.0332 -0.0834 0.0528 122 TYR A OH 522 N N . THR A 112 ? 0.7838 0.7958 0.7718 -0.0154 -0.0868 0.0532 123 THR A N 523 C CA . THR A 112 ? 0.7742 0.7785 0.7544 -0.0131 -0.0798 0.0507 123 THR A CA 524 C C . THR A 112 ? 0.7212 0.7256 0.7134 -0.0173 -0.0791 0.0480 123 THR A C 525 O O . THR A 112 ? 0.6791 0.6794 0.6717 -0.0222 -0.0853 0.0440 123 THR A O 526 C CB . THR A 112 ? 0.6242 0.6150 0.5813 -0.0105 -0.0815 0.0459 123 THR A CB 527 O OG1 . THR A 112 ? 0.6587 0.6497 0.6024 -0.0063 -0.0808 0.0491 123 THR A OG1 528 C CG2 . THR A 112 ? 0.5762 0.5590 0.5272 -0.0066 -0.0737 0.0433 123 THR A CG2 529 N N . ALA A 113 ? 0.6673 0.6764 0.6690 -0.0160 -0.0719 0.0508 124 ALA A N 530 C CA . ALA A 113 ? 0.6072 0.6160 0.6183 -0.0195 -0.0704 0.0493 124 ALA A CA 531 C C . ALA A 113 ? 0.6240 0.6188 0.6222 -0.0181 -0.0698 0.0451 124 ALA A C 532 O O . ALA A 113 ? 0.6510 0.6390 0.6358 -0.0121 -0.0663 0.0443 124 ALA A O 533 C CB . ALA A 113 ? 0.5352 0.5522 0.5575 -0.0182 -0.0637 0.0534 124 ALA A CB 534 N N . GLN A 114 ? 0.5802 0.5704 0.5827 -0.0235 -0.0729 0.0427 125 GLN A N 535 C CA . GLN A 114 ? 0.5102 0.4848 0.5019 -0.0225 -0.0727 0.0390 125 GLN A CA 536 C C . GLN A 114 ? 0.5944 0.5679 0.5847 -0.0154 -0.0644 0.0414 125 GLN A C 537 O O . GLN A 114 ? 0.6912 0.6765 0.6935 -0.0150 -0.0600 0.0462 125 GLN A O 538 C CB . GLN A 114 ? 0.4477 0.4196 0.4478 -0.0306 -0.0766 0.0382 125 GLN A CB 539 C CG . GLN A 114 ? 0.5822 0.5346 0.5704 -0.0310 -0.0786 0.0340 125 GLN A CG 540 C CD . GLN A 114 ? 0.6195 0.5689 0.6151 -0.0412 -0.0845 0.0334 125 GLN A CD 541 O OE1 . GLN A 114 ? 0.7335 0.6969 0.7427 -0.0476 -0.0873 0.0355 125 GLN A OE1 542 N NE2 . GLN A 114 ? 0.6548 0.5858 0.6419 -0.0427 -0.0863 0.0307 125 GLN A NE2 543 N N . ALA A 115 ? 0.5997 0.5592 0.5754 -0.0097 -0.0624 0.0380 126 ALA A N 544 C CA . ALA A 115 ? 0.5034 0.4635 0.4779 -0.0014 -0.0542 0.0404 126 ALA A CA 545 C C . ALA A 115 ? 0.6828 0.6418 0.6669 -0.0020 -0.0522 0.0431 126 ALA A C 546 O O . ALA A 115 ? 0.6448 0.5962 0.6309 -0.0081 -0.0568 0.0417 126 ALA A O 547 C CB . ALA A 115 ? 0.6074 0.5536 0.5628 0.0065 -0.0519 0.0355 126 ALA A CB 548 N N . ALA A 116 ? 0.7452 0.7122 0.7351 0.0041 -0.0456 0.0475 127 ALA A N 549 C CA . ALA A 116 ? 0.7884 0.7568 0.7878 0.0041 -0.0440 0.0513 127 ALA A CA 550 C C . ALA A 116 ? 0.8378 0.7905 0.8288 0.0111 -0.0422 0.0493 127 ALA A C 551 O O . ALA A 116 ? 0.8739 0.8212 0.8551 0.0198 -0.0381 0.0467 127 ALA A O 552 C CB . ALA A 116 ? 0.7503 0.7365 0.7620 0.0063 -0.0392 0.0576 127 ALA A CB 553 N N . LEU A 117 ? 0.7862 0.7311 0.7807 0.0076 -0.0450 0.0507 128 LEU A N 554 C CA . LEU A 117 ? 0.7480 0.6779 0.7371 0.0147 -0.0435 0.0502 128 LEU A CA 555 C C . LEU A 117 ? 0.7298 0.6732 0.7304 0.0209 -0.0386 0.0571 128 LEU A C 556 O O . LEU A 117 ? 0.7830 0.7443 0.7954 0.0166 -0.0381 0.0620 128 LEU A O 557 C CB . LEU A 117 ? 0.7245 0.6394 0.7124 0.0075 -0.0493 0.0500 128 LEU A CB 558 C CG . LEU A 117 ? 0.8360 0.7293 0.8100 0.0042 -0.0546 0.0426 128 LEU A CG 559 C CD1 . LEU A 117 ? 1.0335 0.9333 1.0042 -0.0015 -0.0577 0.0385 128 LEU A CD1 560 C CD2 . LEU A 117 ? 0.6280 0.5091 0.6040 -0.0046 -0.0600 0.0445 128 LEU A CD2 561 N N . GLY A 118 ? 0.7675 0.7021 0.7649 0.0310 -0.0353 0.0573 129 GLY A N 562 C CA . GLY A 118 ? 0.7012 0.6484 0.7109 0.0370 -0.0318 0.0645 129 GLY A CA 563 C C . GLY A 118 ? 0.7695 0.7212 0.7785 0.0502 -0.0244 0.0643 129 GLY A C 564 O O . GLY A 118 ? 0.7836 0.7443 0.8030 0.0571 -0.0215 0.0700 129 GLY A O 565 N N . GLY A 119 ? 0.6697 0.6161 0.6665 0.0538 -0.0212 0.0580 130 GLY A N 566 C CA . GLY A 119 ? 0.7652 0.7156 0.7592 0.0667 -0.0129 0.0571 130 GLY A CA 567 C C . GLY A 119 ? 0.8062 0.7838 0.8147 0.0678 -0.0074 0.0641 130 GLY A C 568 O O . GLY A 119 ? 0.8631 0.8502 0.8775 0.0784 -0.0003 0.0670 130 GLY A O 569 N N . THR A 120 ? 0.5547 0.5447 0.5697 0.0570 -0.0108 0.0668 131 THR A N 570 C CA . THR A 120 ? 0.4708 0.4845 0.4990 0.0562 -0.0067 0.0733 131 THR A CA 571 C C . THR A 120 ? 0.6080 0.6253 0.6289 0.0512 -0.0060 0.0712 131 THR A C 572 O O . THR A 120 ? 0.6134 0.6176 0.6222 0.0462 -0.0106 0.0655 131 THR A O 573 C CB . THR A 120 ? 0.6135 0.6405 0.6584 0.0480 -0.0115 0.0799 131 THR A CB 574 O OG1 . THR A 120 ? 0.5793 0.6022 0.6213 0.0367 -0.0177 0.0776 131 THR A OG1 575 C CG2 . THR A 120 ? 0.7176 0.7395 0.7679 0.0517 -0.0139 0.0826 131 THR A CG2 576 N N . ARG A 121 ? 0.6068 0.6422 0.6359 0.0523 -0.0006 0.0765 132 ARG A N 577 C CA . ARG A 121 ? 0.4927 0.5330 0.5171 0.0469 -0.0004 0.0767 132 ARG A CA 578 C C . ARG A 121 ? 0.6596 0.7048 0.6933 0.0352 -0.0076 0.0789 132 ARG A C 579 O O . ARG A 121 ? 0.3754 0.4300 0.4234 0.0317 -0.0096 0.0833 132 ARG A O 580 C CB . ARG A 121 ? 0.4751 0.5329 0.5057 0.0516 0.0082 0.0828 132 ARG A CB 581 C CG . ARG A 121 ? 0.6411 0.6956 0.6613 0.0643 0.0170 0.0803 132 ARG A CG 582 C CD . ARG A 121 ? 0.9494 0.9846 0.9452 0.0661 0.0161 0.0717 132 ARG A CD 583 N NE . ARG A 121 ? 0.9796 1.0170 0.9696 0.0581 0.0132 0.0727 132 ARG A NE 584 C CZ . ARG A 121 ? 0.9686 1.0141 0.9520 0.0603 0.0196 0.0758 132 ARG A CZ 585 N NH1 . ARG A 121 ? 0.9408 0.9943 0.9228 0.0702 0.0302 0.0778 132 ARG A NH1 586 N NH2 . ARG A 121 ? 0.9663 1.0122 0.9447 0.0529 0.0157 0.0774 132 ARG A NH2 587 N N . THR A 122 ? 0.7151 0.7536 0.7399 0.0295 -0.0117 0.0754 133 THR A N 588 C CA . THR A 122 ? 0.5528 0.5955 0.5857 0.0198 -0.0175 0.0768 133 THR A CA 589 C C . THR A 122 ? 0.5577 0.6032 0.5862 0.0168 -0.0179 0.0776 133 THR A C 590 O O . THR A 122 ? 0.8152 0.8584 0.8324 0.0215 -0.0140 0.0771 133 THR A O 591 C CB . THR A 122 ? 0.6314 0.6622 0.6612 0.0148 -0.0244 0.0717 133 THR A CB 592 O OG1 . THR A 122 ? 0.5996 0.6172 0.6143 0.0157 -0.0266 0.0657 133 THR A OG1 593 C CG2 . THR A 122 ? 0.5915 0.6183 0.6249 0.0174 -0.0245 0.0720 133 THR A CG2 594 N N . ALA A 123 ? 0.5380 0.5874 0.5744 0.0093 -0.0225 0.0790 134 ALA A N 595 C CA . ALA A 123 ? 0.4767 0.5283 0.5109 0.0063 -0.0237 0.0808 134 ALA A CA 596 C C . ALA A 123 ? 0.3698 0.4105 0.3903 0.0064 -0.0278 0.0757 134 ALA A C 597 O O . ALA A 123 ? 0.7774 0.8163 0.7869 0.0092 -0.0261 0.0766 134 ALA A O 598 C CB . ALA A 123 ? 0.3457 0.4030 0.3926 -0.0007 -0.0275 0.0830 134 ALA A CB 599 N N . GLY A 124 ? 0.4016 0.4359 0.4228 0.0026 -0.0336 0.0710 135 GLY A N 600 C CA . GLY A 124 ? 0.5724 0.5989 0.5847 0.0006 -0.0395 0.0667 135 GLY A CA 601 C C . GLY A 124 ? 0.5460 0.5779 0.5631 -0.0027 -0.0425 0.0698 135 GLY A C 602 O O . GLY A 124 ? 0.6046 0.6443 0.6296 -0.0032 -0.0395 0.0750 135 GLY A O 603 N N . SER A 125 ? 0.4595 0.4873 0.4728 -0.0051 -0.0490 0.0668 136 SER A N 604 C CA . SER A 125 ? 0.4636 0.4956 0.4807 -0.0067 -0.0523 0.0700 136 SER A CA 605 C C . SER A 125 ? 0.5235 0.5541 0.5279 -0.0029 -0.0500 0.0739 136 SER A C 606 O O . SER A 125 ? 0.5048 0.5307 0.4959 0.0011 -0.0465 0.0724 136 SER A O 607 C CB . SER A 125 ? 0.5456 0.5757 0.5642 -0.0099 -0.0603 0.0663 136 SER A CB 608 O OG . SER A 125 ? 0.6856 0.7073 0.6902 -0.0092 -0.0636 0.0618 136 SER A OG 609 N N . SER A 126 ? 0.5070 0.5411 0.5149 -0.0038 -0.0514 0.0790 137 SER A N 610 C CA . SER A 126 ? 0.5674 0.6004 0.5629 -0.0009 -0.0493 0.0842 137 SER A CA 611 C C . SER A 126 ? 0.5814 0.6067 0.5578 0.0014 -0.0535 0.0805 137 SER A C 612 O O . SER A 126 ? 0.5875 0.6097 0.5480 0.0053 -0.0488 0.0810 137 SER A O 613 C CB . SER A 126 ? 0.6447 0.6805 0.6478 -0.0029 -0.0520 0.0905 137 SER A CB 614 O OG . SER A 126 ? 0.7353 0.7687 0.7244 -0.0008 -0.0517 0.0959 137 SER A OG 615 N N . GLY A 127 ? 0.4780 0.5009 0.4560 -0.0012 -0.0623 0.0768 138 GLY A N 616 C CA . GLY A 127 ? 0.5230 0.5385 0.4839 -0.0004 -0.0686 0.0729 138 GLY A CA 617 C C . GLY A 127 ? 0.6774 0.6926 0.6282 0.0009 -0.0725 0.0786 138 GLY A C 618 O O . GLY A 127 ? 0.6875 0.6982 0.6265 0.0005 -0.0805 0.0764 138 GLY A O 619 N N . ALA A 128 ? 0.5579 0.5776 0.5134 0.0018 -0.0674 0.0865 139 ALA A N 620 C CA . ALA A 128 ? 0.5843 0.6030 0.5294 0.0031 -0.0700 0.0938 139 ALA A CA 621 C C . ALA A 128 ? 0.5392 0.5590 0.4934 0.0013 -0.0806 0.0956 139 ALA A C 622 O O . ALA A 128 ? 0.5463 0.5697 0.5181 -0.0009 -0.0842 0.0920 139 ALA A O 623 C CB . ALA A 128 ? 0.6185 0.6414 0.5681 0.0035 -0.0615 0.1024 139 ALA A CB 624 N N . ILE A 129 ? 0.5841 0.6012 0.5256 0.0028 -0.0852 0.1015 140 ILE A N 625 C CA . ILE A 129 ? 0.5039 0.5226 0.4554 0.0025 -0.0941 0.1063 140 ILE A CA 626 C C . ILE A 129 ? 0.5554 0.5728 0.5058 0.0035 -0.0900 0.1171 140 ILE A C 627 O O . ILE A 129 ? 0.6729 0.6880 0.6066 0.0044 -0.0838 0.1216 140 ILE A O 628 C CB . ILE A 129 ? 0.5715 0.5877 0.5094 0.0030 -0.1056 0.1051 140 ILE A CB 629 C CG1 . ILE A 129 ? 0.6980 0.7143 0.6362 0.0007 -0.1097 0.0944 140 ILE A CG1 630 C CG2 . ILE A 129 ? 0.4847 0.5038 0.4354 0.0039 -0.1149 0.1108 140 ILE A CG2 631 C CD1 . ILE A 129 ? 0.5008 0.5145 0.4251 -0.0001 -0.1219 0.0921 140 ILE A CD1 632 N N . ASN A 130 ? 0.5093 0.5277 0.4775 0.0031 -0.0929 0.1213 141 ASN A N 633 C CA . ASN A 130 ? 0.6220 0.6375 0.5921 0.0029 -0.0890 0.1315 141 ASN A CA 634 C C . ASN A 130 ? 0.7444 0.7548 0.6958 0.0045 -0.0927 0.1412 141 ASN A C 635 O O . ASN A 130 ? 0.7649 0.7737 0.7116 0.0066 -0.1030 0.1424 141 ASN A O 636 C CB . ASN A 130 ? 0.4569 0.4722 0.4499 0.0025 -0.0915 0.1324 141 ASN A CB 637 C CG . ASN A 130 ? 0.5647 0.5806 0.5653 0.0054 -0.1026 0.1310 141 ASN A CG 638 O OD1 . ASN A 130 ? 0.7238 0.7446 0.7251 0.0056 -0.1073 0.1237 141 ASN A OD1 639 N ND2 . ASN A 130 ? 0.5358 0.5469 0.5431 0.0075 -0.1070 0.1384 141 ASN A ND2 640 N N . GLU A 131 ? 0.6221 0.6311 0.5630 0.0035 -0.0843 0.1487 142 GLU A N 641 C CA . GLU A 131 ? 0.5863 0.5907 0.5074 0.0045 -0.0859 0.1591 142 GLU A CA 642 C C . GLU A 131 ? 0.7504 0.7490 0.6815 0.0042 -0.0914 0.1694 142 GLU A C 643 O O . GLU A 131 ? 0.7096 0.7071 0.6588 0.0018 -0.0879 0.1715 142 GLU A O 644 C CB . GLU A 131 ? 0.5357 0.5424 0.4432 0.0033 -0.0734 0.1639 142 GLU A CB 645 C CG . GLU A 131 ? 0.8205 0.8311 0.7158 0.0051 -0.0675 0.1541 142 GLU A CG 646 C CD . GLU A 131 ? 0.9149 0.9302 0.8011 0.0050 -0.0538 0.1587 142 GLU A CD 647 O OE1 . GLU A 131 ? 0.7443 0.7613 0.6160 0.0081 -0.0483 0.1520 142 GLU A OE1 648 O OE2 . GLU A 131 ? 0.9769 0.9942 0.8713 0.0019 -0.0486 0.1691 142 GLU A OE2 649 N N . ILE A 132 ? 0.7203 0.7143 0.6389 0.0066 -0.1006 0.1758 143 ILE A N 650 C CA . ILE A 132 ? 0.6967 0.6835 0.6235 0.0074 -0.1072 0.1861 143 ILE A CA 651 C C . ILE A 132 ? 0.7361 0.7174 0.6530 0.0044 -0.1001 0.1997 143 ILE A C 652 O O . ILE A 132 ? 0.8178 0.8013 0.7135 0.0033 -0.0936 0.2033 143 ILE A O 653 C CB . ILE A 132 ? 0.7763 0.7609 0.6946 0.0116 -0.1211 0.1886 143 ILE A CB 654 C CG1 . ILE A 132 ? 0.9499 0.9421 0.8744 0.0132 -0.1274 0.1755 143 ILE A CG1 655 C CG2 . ILE A 132 ? 0.7084 0.6856 0.6410 0.0141 -0.1288 0.1974 143 ILE A CG2 656 C CD1 . ILE A 132 ? 0.8617 0.8583 0.8148 0.0133 -0.1264 0.1669 143 ILE A CD1 657 N N . GLU A 133 ? 0.6331 0.6071 0.5653 0.0029 -0.1010 0.2069 144 GLU A N 658 C CA . GLU A 133 ? 0.7462 0.7134 0.6709 -0.0009 -0.0963 0.2217 144 GLU A CA 659 C C . GLU A 133 ? 0.8700 0.8296 0.7770 0.0022 -0.1055 0.2330 144 GLU A C 660 O O . GLU A 133 ? 0.8510 0.8033 0.7674 0.0059 -0.1163 0.2356 144 GLU A O 661 C CB . GLU A 133 ? 0.6465 0.6058 0.5937 -0.0041 -0.0953 0.2248 144 GLU A CB 662 C CG . GLU A 133 ? 0.6986 0.6490 0.6402 -0.0091 -0.0919 0.2410 144 GLU A CG 663 C CD . GLU A 133 ? 0.9528 0.9121 0.8794 -0.0139 -0.0797 0.2461 144 GLU A CD 664 O OE1 . GLU A 133 ? 0.9279 0.8871 0.8314 -0.0129 -0.0793 0.2551 144 GLU A OE1 665 O OE2 . GLU A 133 ? 1.0872 1.0545 1.0250 -0.0181 -0.0705 0.2413 144 GLU A OE2 666 N N . TYR A 134 ? 0.8326 0.7944 0.7135 0.0012 -0.1012 0.2396 145 TYR A N 667 C CA . TYR A 134 ? 0.7784 0.7340 0.6379 0.0041 -0.1104 0.2499 145 TYR A CA 668 C C . TYR A 134 ? 0.9235 0.8662 0.7870 0.0025 -0.1141 0.2663 145 TYR A C 669 O O . TYR A 134 ? 1.0988 1.0342 0.9532 0.0062 -0.1254 0.2747 145 TYR A O 670 C CB . TYR A 134 ? 0.6888 0.6496 0.5170 0.0034 -0.1035 0.2523 145 TYR A CB 671 C CG . TYR A 134 ? 0.7743 0.7437 0.5939 0.0061 -0.1033 0.2364 145 TYR A CG 672 C CD1 . TYR A 134 ? 0.8716 0.8424 0.7018 0.0096 -0.1149 0.2256 145 TYR A CD1 673 C CD2 . TYR A 134 ? 0.7893 0.7653 0.5912 0.0053 -0.0911 0.2325 145 TYR A CD2 674 C CE1 . TYR A 134 ? 0.9071 0.8841 0.7298 0.0110 -0.1153 0.2115 145 TYR A CE1 675 C CE2 . TYR A 134 ? 0.8415 0.8224 0.6350 0.0079 -0.0913 0.2177 145 TYR A CE2 676 C CZ . TYR A 134 ? 0.9797 0.9604 0.7834 0.0102 -0.1037 0.2075 145 TYR A CZ 677 O OH . TYR A 134 ? 1.1113 1.0954 0.9069 0.0118 -0.1044 0.1932 145 TYR A OH 678 N N . GLU A 135 ? 0.8959 0.8353 0.7735 -0.0030 -0.1054 0.2711 146 GLU A N 679 C CA . GLU A 135 ? 0.8741 0.7988 0.7567 -0.0056 -0.1086 0.2865 146 GLU A CA 680 C C . GLU A 135 ? 0.9384 0.8522 0.8413 -0.0003 -0.1211 0.2843 146 GLU A C 681 O O . GLU A 135 ? 0.9802 0.8790 0.8885 -0.0011 -0.1255 0.2961 146 GLU A O 682 C CB . GLU A 135 ? 0.7606 0.6847 0.6536 -0.0143 -0.0965 0.2919 146 GLU A CB 683 C CG . GLU A 135 ? 0.8286 0.7625 0.7013 -0.0192 -0.0839 0.2995 146 GLU A CG 684 C CD . GLU A 135 ? 0.9083 0.8372 0.7522 -0.0178 -0.0874 0.3139 146 GLU A CD 685 O OE1 . GLU A 135 ? 0.7881 0.7026 0.6313 -0.0194 -0.0935 0.3286 146 GLU A OE1 686 O OE2 . GLU A 135 ? 0.9040 0.8424 0.7247 -0.0149 -0.0843 0.3105 146 GLU A OE2 687 N N . ASN A 136 ? 0.8369 0.7582 0.7514 0.0052 -0.1266 0.2694 147 ASN A N 688 C CA . ASN A 136 ? 0.8111 0.7251 0.7457 0.0115 -0.1375 0.2662 147 ASN A CA 689 C C . ASN A 136 ? 0.8865 0.8045 0.8139 0.0192 -0.1506 0.2654 147 ASN A C 690 O O . ASN A 136 ? 0.8600 0.7743 0.8043 0.0257 -0.1603 0.2635 147 ASN A O 691 C CB . ASN A 136 ? 0.7023 0.6221 0.6614 0.0118 -0.1337 0.2501 147 ASN A CB 692 C CG . ASN A 136 ? 0.9344 0.8500 0.9030 0.0042 -0.1228 0.2503 147 ASN A CG 693 O OD1 . ASN A 136 ? 1.1496 1.0549 1.1128 -0.0010 -0.1198 0.2633 147 ASN A OD1 694 N ND2 . ASN A 136 ? 0.8197 0.7438 0.8029 0.0029 -0.1172 0.2362 147 ASN A ND2 695 N N . VAL A 137 ? 0.8262 0.7521 0.7289 0.0186 -0.1511 0.2665 148 VAL A N 696 C CA . VAL A 137 ? 0.7603 0.6914 0.6555 0.0246 -0.1645 0.2647 148 VAL A CA 697 C C . VAL A 137 ? 0.8064 0.7286 0.6808 0.0267 -0.1739 0.2815 148 VAL A C 698 O O . VAL A 137 ? 0.8436 0.7605 0.6959 0.0222 -0.1677 0.2928 148 VAL A O 699 C CB . VAL A 137 ? 0.9762 0.9214 0.8581 0.0234 -0.1624 0.2519 148 VAL A CB 700 C CG1 . VAL A 137 ? 1.0380 0.9918 0.9415 0.0221 -0.1551 0.2357 148 VAL A CG1 701 C CG2 . VAL A 137 ? 0.9933 0.9388 0.8449 0.0187 -0.1531 0.2571 148 VAL A CG2 702 N N . LYS A 138 ? 0.8151 0.7365 0.6972 0.0338 -0.1889 0.2837 149 LYS A N 703 C CA . LYS A 138 ? 0.8867 0.8009 0.7490 0.0368 -0.2005 0.2992 149 LYS A CA 704 C C . LYS A 138 ? 0.9895 0.9145 0.8258 0.0364 -0.2063 0.2952 149 LYS A C 705 O O . LYS A 138 ? 0.9625 0.8836 0.7677 0.0339 -0.2060 0.3052 149 LYS A O 706 C CB . LYS A 138 ? 0.9268 0.8356 0.8110 0.0454 -0.2148 0.3041 149 LYS A CB 707 C CG . LYS A 138 ? 1.0955 1.0016 0.9617 0.0501 -0.2306 0.3174 149 LYS A CG 708 C CD . LYS A 138 ? 1.2728 1.1653 1.1102 0.0456 -0.2273 0.3356 149 LYS A CD 709 C CE . LYS A 138 ? 1.3024 1.1965 1.1111 0.0479 -0.2407 0.3456 149 LYS A CE 710 N NZ . LYS A 138 ? 1.3208 1.2070 1.0943 0.0413 -0.2330 0.3590 149 LYS A NZ 711 N N . ALA A 139 ? 1.0423 0.9804 0.8904 0.0386 -0.2117 0.2803 150 ALA A N 712 C CA . ALA A 139 ? 0.9649 0.9120 0.7901 0.0379 -0.2191 0.2749 150 ALA A CA 713 C C . ALA A 139 ? 0.8132 0.7719 0.6445 0.0347 -0.2122 0.2559 150 ALA A C 714 O O . ALA A 139 ? 0.9299 0.8922 0.7879 0.0345 -0.2049 0.2468 150 ALA A O 715 C CB . ALA A 139 ? 0.8790 0.8299 0.7100 0.0442 -0.2391 0.2791 150 ALA A CB 716 N N . VAL A 140 ? 0.9009 0.8640 0.7055 0.0322 -0.2145 0.2502 151 VAL A N 717 C CA . VAL A 140 ? 0.9742 0.9466 0.7814 0.0294 -0.2106 0.2326 151 VAL A CA 718 C C . VAL A 140 ? 0.9374 0.9155 0.7303 0.0298 -0.2267 0.2283 151 VAL A C 719 O O . VAL A 140 ? 0.9015 0.8746 0.6628 0.0295 -0.2328 0.2354 151 VAL A O 720 C CB . VAL A 140 ? 0.9509 0.9207 0.7352 0.0249 -0.1943 0.2278 151 VAL A CB 721 C CG1 . VAL A 140 ? 0.9303 0.9078 0.7260 0.0226 -0.1886 0.2099 151 VAL A CG1 722 C CG2 . VAL A 140 ? 0.9903 0.9537 0.7793 0.0234 -0.1799 0.2371 151 VAL A CG2 723 N N . GLU A 141 ? 1.0690 1.0576 0.8848 0.0299 -0.2338 0.2168 152 GLU A N 724 C CA . GLU A 141 ? 1.1511 1.1464 0.9570 0.0290 -0.2502 0.2120 152 GLU A CA 725 C C . GLU A 141 ? 1.1341 1.1337 0.9355 0.0238 -0.2460 0.1949 152 GLU A C 726 O O . GLU A 141 ? 1.2276 1.2355 1.0572 0.0228 -0.2433 0.1851 152 GLU A O 727 C CB . GLU A 141 ? 1.3034 1.3092 1.1413 0.0334 -0.2651 0.2147 152 GLU A CB 728 C CG . GLU A 141 ? 1.4351 1.4507 1.2683 0.0316 -0.2834 0.2099 152 GLU A CG 729 C CD . GLU A 141 ? 1.5939 1.6245 1.4662 0.0357 -0.2951 0.2101 152 GLU A CD 730 O OE1 . GLU A 141 ? 1.6183 1.6584 1.5178 0.0341 -0.2894 0.1991 152 GLU A OE1 731 O OE2 . GLU A 141 ? 1.6309 1.6642 1.5068 0.0407 -0.3097 0.2215 152 GLU A OE2 732 N N . ILE A 142 ? 0.9224 0.9153 0.6870 0.0208 -0.2452 0.1914 153 ILE A N 733 C CA . ILE A 142 ? 0.8363 0.8298 0.5922 0.0162 -0.2420 0.1753 153 ILE A CA 734 C C . ILE A 142 ? 0.8337 0.8316 0.5812 0.0134 -0.2615 0.1700 153 ILE A C 735 O O . ILE A 142 ? 0.9158 0.9093 0.6352 0.0137 -0.2727 0.1762 153 ILE A O 736 C CB . ILE A 142 ? 0.9021 0.8846 0.6223 0.0151 -0.2279 0.1727 153 ILE A CB 737 C CG1 . ILE A 142 ? 0.8955 0.8757 0.6261 0.0169 -0.2090 0.1787 153 ILE A CG1 738 C CG2 . ILE A 142 ? 0.7727 0.7533 0.4830 0.0112 -0.2252 0.1556 153 ILE A CG2 739 C CD1 . ILE A 142 ? 0.8932 0.8658 0.5932 0.0165 -0.1936 0.1769 153 ILE A CD1 740 N N . SER A 143 ? 0.9179 0.9249 0.6897 0.0101 -0.2661 0.1589 154 SER A N 741 C CA . SER A 143 ? 0.9780 0.9907 0.7459 0.0058 -0.2850 0.1531 154 SER A CA 742 C C . SER A 143 ? 0.9918 0.9977 0.7423 -0.0003 -0.2816 0.1372 154 SER A C 743 O O . SER A 143 ? 1.0884 1.0949 0.8555 -0.0020 -0.2692 0.1286 154 SER A O 744 C CB . SER A 143 ? 0.9751 1.0052 0.7866 0.0061 -0.2948 0.1535 154 SER A CB 745 O OG . SER A 143 ? 1.0673 1.1021 0.8999 0.0131 -0.2944 0.1666 154 SER A OG 746 N N . LYS A 144 ? 0.9780 0.9761 0.6940 -0.0037 -0.2929 0.1332 155 LYS A N 747 C CA . LYS A 144 ? 1.0779 1.0674 0.7766 -0.0096 -0.2921 0.1173 155 LYS A CA 748 C C . LYS A 144 ? 1.1488 1.1490 0.8696 -0.0165 -0.3094 0.1105 155 LYS A C 749 O O . LYS A 144 ? 1.1729 1.1855 0.9079 -0.0166 -0.3261 0.1183 155 LYS A O 750 C CB . LYS A 144 ? 1.1099 1.0832 0.7572 -0.0099 -0.2944 0.1146 155 LYS A CB 751 C CG . LYS A 144 ? 1.1458 1.1101 0.7696 -0.0037 -0.2768 0.1220 155 LYS A CG 752 C CD . LYS A 144 ? 1.2718 1.2214 0.8433 -0.0035 -0.2796 0.1196 155 LYS A CD 753 C CE . LYS A 144 ? 1.2869 1.2313 0.8369 0.0026 -0.2642 0.1310 155 LYS A CE 754 N NZ . LYS A 144 ? 1.2801 1.2099 0.7777 0.0034 -0.2621 0.1267 155 LYS A NZ 755 N N . GLY A 145 ? 1.0174 1.0135 0.7423 -0.0222 -0.3055 0.0968 156 GLY A N 756 C CA . GLY A 145 ? 0.8925 0.8987 0.6395 -0.0302 -0.3203 0.0900 156 GLY A CA 757 C C . GLY A 145 ? 1.0105 1.0366 0.8077 -0.0294 -0.3176 0.0944 156 GLY A C 758 O O . GLY A 145 ? 0.9103 0.9406 0.7238 -0.0224 -0.3047 0.1020 156 GLY A O 759 N N . SER A 146 ? 1.0241 1.0623 0.8453 -0.0369 -0.3296 0.0894 157 SER A N 760 C CA . SER A 146 ? 0.9187 0.9778 0.7878 -0.0366 -0.3278 0.0927 157 SER A CA 761 C C . SER A 146 ? 0.9268 0.9995 0.8151 -0.0278 -0.3308 0.1070 157 SER A C 762 O O . SER A 146 ? 0.9293 1.0001 0.7987 -0.0249 -0.3425 0.1147 157 SER A O 763 C CB . SER A 146 ? 0.9147 0.9867 0.8031 -0.0468 -0.3440 0.0872 157 SER A CB 764 O OG . SER A 146 ? 0.9332 0.9888 0.7964 -0.0556 -0.3462 0.0746 157 SER A OG 765 N N . ASN A 147 ? 0.8714 0.9567 0.7962 -0.0234 -0.3205 0.1104 158 ASN A N 766 C CA . ASN A 147 ? 0.8483 0.9438 0.7924 -0.0139 -0.3215 0.1231 158 ASN A CA 767 C C . ASN A 147 ? 0.7829 0.8944 0.7708 -0.0104 -0.3124 0.1240 158 ASN A C 768 O O . ASN A 147 ? 0.7483 0.8592 0.7471 -0.0019 -0.3032 0.1311 158 ASN A O 769 C CB . ASN A 147 ? 0.9062 0.9846 0.8237 -0.0069 -0.3105 0.1298 158 ASN A CB 770 C CG . ASN A 147 ? 0.9943 1.0777 0.9186 0.0016 -0.3180 0.1443 158 ASN A CG 771 O OD1 . ASN A 147 ? 0.9680 1.0644 0.9041 0.0020 -0.3356 0.1495 158 ASN A OD1 772 N ND2 . ASN A 147 ? 0.9859 1.0589 0.9036 0.0082 -0.3052 0.1513 158 ASN A ND2 773 N N . SER A 148 ? 0.8574 0.9826 0.8695 -0.0173 -0.3151 0.1169 159 SER A N 774 C CA . SER A 148 ? 0.7916 0.9320 0.8428 -0.0146 -0.3048 0.1163 159 SER A CA 775 C C . SER A 148 ? 0.8002 0.9604 0.8836 -0.0064 -0.3122 0.1260 159 SER A C 776 O O . SER A 148 ? 0.8220 0.9895 0.9313 0.0001 -0.3011 0.1277 159 SER A O 777 C CB . SER A 148 ? 0.7386 0.8880 0.8053 -0.0250 -0.3047 0.1066 159 SER A CB 778 O OG . SER A 148 ? 0.6488 0.7804 0.6957 -0.0293 -0.2911 0.0979 159 SER A OG 779 N N . VAL A 149 ? 0.6006 0.7692 0.6822 -0.0063 -0.3313 0.1321 160 VAL A N 780 C CA . VAL A 149 ? 0.7530 0.9404 0.8650 0.0027 -0.3397 0.1421 160 VAL A CA 781 C C . VAL A 149 ? 0.7319 0.9069 0.8388 0.0149 -0.3306 0.1508 160 VAL A C 782 O O . VAL A 149 ? 0.7316 0.9178 0.8680 0.0243 -0.3284 0.1565 160 VAL A O 783 C CB . VAL A 149 ? 0.8120 1.0111 0.9215 -0.0002 -0.3639 0.1474 160 VAL A CB 784 C CG1 . VAL A 149 ? 0.9479 1.1276 1.0122 -0.0089 -0.3713 0.1429 160 VAL A CG1 785 C CG2 . VAL A 149 ? 0.6656 0.8710 0.7853 0.0119 -0.3731 0.1610 160 VAL A CG2 786 N N . GLU A 150 ? 0.7632 0.9146 0.8328 0.0145 -0.3245 0.1514 161 GLU A N 787 C CA . GLU A 150 ? 0.7858 0.9231 0.8482 0.0238 -0.3147 0.1594 161 GLU A CA 788 C C . GLU A 150 ? 0.8246 0.9531 0.8925 0.0245 -0.2931 0.1533 161 GLU A C 789 O O . GLU A 150 ? 0.8522 0.9793 0.9368 0.0326 -0.2850 0.1579 161 GLU A O 790 C CB . GLU A 150 ? 0.8509 0.9689 0.8708 0.0233 -0.3190 0.1653 161 GLU A CB 791 C CG . GLU A 150 ? 1.0364 1.1603 1.0469 0.0243 -0.3407 0.1738 161 GLU A CG 792 C CD . GLU A 150 ? 1.1434 1.2475 1.1119 0.0254 -0.3429 0.1815 161 GLU A CD 793 O OE1 . GLU A 150 ? 1.1437 1.2311 1.0943 0.0262 -0.3267 0.1812 161 GLU A OE1 794 O OE2 . GLU A 150 ? 1.1889 1.2951 1.1425 0.0254 -0.3607 0.1882 161 GLU A OE2 795 N N . GLN A 151 ? 0.8532 0.9749 0.9067 0.0160 -0.2844 0.1429 162 GLN A N 796 C CA . GLN A 151 ? 0.7958 0.9070 0.8484 0.0161 -0.2648 0.1378 162 GLN A CA 797 C C . GLN A 151 ? 0.7417 0.8625 0.8143 0.0104 -0.2567 0.1271 162 GLN A C 798 O O . GLN A 151 ? 0.8110 0.9235 0.8812 0.0094 -0.2414 0.1221 162 GLN A O 799 C CB . GLN A 151 ? 0.8221 0.9127 0.8358 0.0131 -0.2580 0.1368 162 GLN A CB 800 C CG . GLN A 151 ? 0.9311 1.0107 0.9233 0.0185 -0.2626 0.1484 162 GLN A CG 801 C CD . GLN A 151 ? 0.9223 0.9992 0.9313 0.0267 -0.2554 0.1567 162 GLN A CD 802 O OE1 . GLN A 151 ? 0.8589 0.9345 0.8827 0.0275 -0.2416 0.1525 162 GLN A OE1 803 N NE2 . GLN A 151 ? 1.1434 1.2184 1.1497 0.0329 -0.2654 0.1686 162 GLN A NE2 804 N N . GLY A 152 ? 0.6093 0.7480 0.7014 0.0062 -0.2672 0.1241 163 GLY A N 805 C CA . GLY A 152 ? 0.7874 0.9376 0.9020 0.0007 -0.2601 0.1158 163 GLY A CA 806 C C . GLY A 152 ? 0.7997 0.9381 0.8945 -0.0086 -0.2531 0.1061 163 GLY A C 807 O O . GLY A 152 ? 0.8126 0.9390 0.8785 -0.0136 -0.2597 0.1038 163 GLY A O 808 N N . SER A 153 ? 0.5349 0.6760 0.6447 -0.0106 -0.2398 0.1004 164 SER A N 809 C CA . SER A 153 ? 0.6607 0.7904 0.7549 -0.0184 -0.2320 0.0917 164 SER A CA 810 C C . SER A 153 ? 0.6118 0.7193 0.6736 -0.0160 -0.2237 0.0915 164 SER A C 811 O O . SER A 153 ? 0.5646 0.6669 0.6258 -0.0089 -0.2152 0.0964 164 SER A O 812 C CB . SER A 153 ? 0.6618 0.7999 0.7798 -0.0199 -0.2192 0.0874 164 SER A CB 813 O OG . SER A 153 ? 0.7045 0.8305 0.8077 -0.0267 -0.2114 0.0799 164 SER A OG 814 N N . GLY A 154 ? 0.6008 0.6954 0.6362 -0.0220 -0.2260 0.0858 165 GLY A N 815 C CA . GLY A 154 ? 0.6925 0.7678 0.6972 -0.0196 -0.2175 0.0852 165 GLY A CA 816 C C . GLY A 154 ? 0.7344 0.8006 0.7098 -0.0187 -0.2280 0.0884 165 GLY A C 817 O O . GLY A 154 ? 0.7863 0.8369 0.7327 -0.0176 -0.2221 0.0870 165 GLY A O 818 N N . ALA A 155 ? 0.6496 0.7264 0.6324 -0.0188 -0.2436 0.0931 166 ALA A N 819 C CA . ALA A 155 ? 0.8368 0.9058 0.7911 -0.0182 -0.2555 0.0967 166 ALA A CA 820 C C . ALA A 155 ? 0.9402 1.0043 0.8769 -0.0270 -0.2670 0.0882 166 ALA A C 821 O O . ALA A 155 ? 0.9916 1.0609 0.9233 -0.0294 -0.2840 0.0905 166 ALA A O 822 C CB . ALA A 155 ? 0.8560 0.9378 0.8254 -0.0130 -0.2674 0.1073 166 ALA A CB 823 N N . LEU A 156 ? 0.8801 0.9334 0.8074 -0.0318 -0.2583 0.0783 167 LEU A N 824 C CA . LEU A 156 ? 0.6296 0.6742 0.5391 -0.0405 -0.2680 0.0688 167 LEU A CA 825 C C . LEU A 156 ? 0.6652 0.6943 0.5337 -0.0395 -0.2756 0.0683 167 LEU A C 826 O O . LEU A 156 ? 0.9574 0.9869 0.8153 -0.0450 -0.2927 0.0663 167 LEU A O 827 C CB . LEU A 156 ? 0.6346 0.6674 0.5403 -0.0439 -0.2550 0.0592 167 LEU A CB 828 C CG . LEU A 156 ? 0.8128 0.8508 0.7382 -0.0536 -0.2594 0.0521 167 LEU A CG 829 C CD1 . LEU A 156 ? 0.8887 0.9046 0.7868 -0.0586 -0.2572 0.0410 167 LEU A CD1 830 C CD2 . LEU A 156 ? 0.6190 0.6737 0.5621 -0.0601 -0.2783 0.0545 167 LEU A CD2 831 N N . ALA A 157 ? 0.6851 0.7013 0.5302 -0.0328 -0.2626 0.0701 168 ALA A N 832 C CA . ALA A 157 ? 0.8529 0.8527 0.6552 -0.0313 -0.2659 0.0684 168 ALA A CA 833 C C . ALA A 157 ? 0.9019 0.9035 0.6934 -0.0237 -0.2650 0.0809 168 ALA A C 834 O O . ALA A 157 ? 0.8469 0.8371 0.6027 -0.0220 -0.2683 0.0819 168 ALA A O 835 C CB . ALA A 157 ? 0.7109 0.6928 0.4906 -0.0301 -0.2508 0.0594 168 ALA A CB 836 N N . GLY A 158 ? 0.8767 0.8914 0.6981 -0.0191 -0.2603 0.0903 169 GLY A N 837 C CA . GLY A 158 ? 0.9116 0.9267 0.7259 -0.0121 -0.2586 0.1030 169 GLY A CA 838 C C . GLY A 158 ? 0.8707 0.8954 0.7179 -0.0071 -0.2484 0.1104 169 GLY A C 839 O O . GLY A 158 ? 0.9126 0.9452 0.7882 -0.0089 -0.2428 0.1056 169 GLY A O 840 N N . SER A 159 ? 0.7854 0.8086 0.6275 -0.0011 -0.2462 0.1223 170 SER A N 841 C CA . SER A 159 ? 0.8211 0.8503 0.6912 0.0038 -0.2373 0.1295 170 SER A CA 842 C C . SER A 159 ? 0.7065 0.7264 0.5588 0.0088 -0.2301 0.1408 170 SER A C 843 O O . SER A 159 ? 0.8582 0.8720 0.6832 0.0097 -0.2375 0.1469 170 SER A O 844 C CB . SER A 159 ? 0.9117 0.9561 0.8136 0.0057 -0.2499 0.1345 170 SER A CB 845 O OG . SER A 159 ? 1.0392 1.0841 0.9286 0.0083 -0.2647 0.1440 170 SER A OG 846 N N . VAL A 160 ? 0.6385 0.6572 0.5058 0.0113 -0.2159 0.1436 171 VAL A N 847 C CA . VAL A 160 ? 0.6479 0.6587 0.5040 0.0150 -0.2083 0.1552 171 VAL A CA 848 C C . VAL A 160 ? 0.6394 0.6548 0.5273 0.0190 -0.2074 0.1623 171 VAL A C 849 O O . VAL A 160 ? 0.7314 0.7513 0.6437 0.0187 -0.1992 0.1566 171 VAL A O 850 C CB . VAL A 160 ? 0.6595 0.6627 0.5014 0.0137 -0.1904 0.1519 171 VAL A CB 851 C CG1 . VAL A 160 ? 0.7650 0.7612 0.5952 0.0162 -0.1830 0.1650 171 VAL A CG1 852 C CG2 . VAL A 160 ? 0.6919 0.6896 0.5041 0.0108 -0.1899 0.1426 171 VAL A CG2 853 N N . ALA A 161 ? 0.7965 0.8099 0.6832 0.0232 -0.2164 0.1747 172 ALA A N 854 C CA . ALA A 161 ? 0.7397 0.7553 0.6553 0.0281 -0.2169 0.1814 172 ALA A CA 855 C C . ALA A 161 ? 0.8047 0.8080 0.7098 0.0306 -0.2115 0.1949 172 ALA A C 856 O O . ALA A 161 ? 0.8851 0.8818 0.7642 0.0310 -0.2168 0.2043 172 ALA A O 857 C CB . ALA A 161 ? 0.6384 0.6642 0.5707 0.0319 -0.2341 0.1842 172 ALA A CB 858 N N . PHE A 162 ? 0.7279 0.7276 0.6523 0.0317 -0.2009 0.1959 173 PHE A N 859 C CA . PHE A 162 ? 0.7787 0.7660 0.6974 0.0331 -0.1958 0.2089 173 PHE A CA 860 C C . PHE A 162 ? 0.7692 0.7541 0.7133 0.0394 -0.2028 0.2156 173 PHE A C 861 O O . PHE A 162 ? 0.8152 0.8080 0.7866 0.0422 -0.2038 0.2076 173 PHE A O 862 C CB . PHE A 162 ? 0.6516 0.6346 0.5726 0.0288 -0.1786 0.2056 173 PHE A CB 863 C CG . PHE A 162 ? 0.6404 0.6237 0.5358 0.0239 -0.1694 0.2015 173 PHE A CG 864 C CD1 . PHE A 162 ? 0.7232 0.6988 0.5923 0.0223 -0.1648 0.2121 173 PHE A CD1 865 C CD2 . PHE A 162 ? 0.6516 0.6424 0.5495 0.0212 -0.1645 0.1874 173 PHE A CD2 866 C CE1 . PHE A 162 ? 0.7995 0.7762 0.6456 0.0190 -0.1551 0.2079 173 PHE A CE1 867 C CE2 . PHE A 162 ? 0.7263 0.7164 0.6013 0.0181 -0.1557 0.1833 173 PHE A CE2 868 C CZ . PHE A 162 ? 0.7052 0.6886 0.5544 0.0174 -0.1507 0.1932 173 PHE A CZ 869 N N . GLN A 163 ? 0.6650 0.6385 0.5998 0.0421 -0.2070 0.2304 174 GLN A N 870 C CA . GLN A 163 ? 0.9801 0.9468 0.9381 0.0485 -0.2110 0.2373 174 GLN A CA 871 C C . GLN A 163 ? 0.8592 0.8093 0.8128 0.0459 -0.2008 0.2464 174 GLN A C 872 O O . GLN A 163 ? 0.8699 0.8128 0.7983 0.0415 -0.1971 0.2557 174 GLN A O 873 C CB . GLN A 163 ? 0.6881 0.6555 0.6464 0.0555 -0.2284 0.2474 174 GLN A CB 874 C CG . GLN A 163 ? 1.6182 1.5755 1.5452 0.0544 -0.2341 0.2626 174 GLN A CG 875 C CD . GLN A 163 ? 1.5250 1.4805 1.4565 0.0624 -0.2513 0.2746 174 GLN A CD 876 O OE1 . GLN A 163 ? 1.4039 1.3469 1.3170 0.0633 -0.2558 0.2902 174 GLN A OE1 877 N NE2 . GLN A 163 ? 1.4773 1.4462 1.4343 0.0684 -0.2611 0.2682 174 GLN A NE2 878 N N . THR A 164 ? 0.7997 0.7444 0.7781 0.0481 -0.1960 0.2433 175 THR A N 879 C CA . THR A 164 ? 0.8642 0.7934 0.8421 0.0442 -0.1863 0.2499 175 THR A CA 880 C C . THR A 164 ? 0.9306 0.8433 0.9019 0.0476 -0.1940 0.2675 175 THR A C 881 O O . THR A 164 ? 1.0655 0.9778 1.0434 0.0556 -0.2068 0.2724 175 THR A O 882 C CB . THR A 164 ? 0.8986 0.8259 0.9037 0.0453 -0.1796 0.2395 175 THR A CB 883 O OG1 . THR A 164 ? 0.8973 0.8409 0.9100 0.0433 -0.1747 0.2238 175 THR A OG1 884 C CG2 . THR A 164 ? 0.9458 0.8594 0.9490 0.0386 -0.1687 0.2438 175 THR A CG2 885 N N . LYS A 165 ? 0.8625 0.7620 0.8214 0.0414 -0.1863 0.2777 176 LYS A N 886 C CA . LYS A 165 ? 0.9776 0.8587 0.9292 0.0430 -0.1921 0.2957 176 LYS A CA 887 C C . LYS A 165 ? 1.0733 0.9412 1.0505 0.0507 -0.1983 0.2967 176 LYS A C 888 O O . LYS A 165 ? 1.0697 0.9420 1.0699 0.0538 -0.1954 0.2830 176 LYS A O 889 C CB . LYS A 165 ? 0.9212 0.7922 0.8585 0.0330 -0.1806 0.3053 176 LYS A CB 890 C CG . LYS A 165 ? 0.8781 0.7583 0.7855 0.0269 -0.1750 0.3096 176 LYS A CG 891 C CD . LYS A 165 ? 0.7664 0.6392 0.6646 0.0172 -0.1623 0.3190 176 LYS A CD 892 C CE . LYS A 165 ? 0.8191 0.7020 0.6873 0.0121 -0.1551 0.3232 176 LYS A CE 893 N NZ . LYS A 165 ? 0.8081 0.6881 0.6709 0.0024 -0.1410 0.3316 176 LYS A NZ 894 N N . THR A 166 ? 1.0273 0.8782 0.9994 0.0543 -0.2066 0.3130 177 THR A N 895 C CA . THR A 166 ? 1.0295 0.8625 1.0231 0.0617 -0.2116 0.3159 177 THR A CA 896 C C . THR A 166 ? 0.9947 0.8029 0.9779 0.0564 -0.2099 0.3331 177 THR A C 897 O O . THR A 166 ? 1.0514 0.8591 1.0120 0.0470 -0.2042 0.3426 177 THR A O 898 C CB . THR A 166 ? 1.0706 0.9066 1.0745 0.0749 -0.2272 0.3191 177 THR A CB 899 O OG1 . THR A 166 ? 1.2181 1.0525 1.1981 0.0750 -0.2366 0.3354 177 THR A OG1 900 C CG2 . THR A 166 ? 0.8923 0.7532 0.9105 0.0795 -0.2290 0.3024 177 THR A CG2 901 N N . ALA A 167 ? 0.9955 0.7829 0.9954 0.0625 -0.2146 0.3370 178 ALA A N 902 C CA . ALA A 167 ? 1.0965 0.8573 1.0888 0.0572 -0.2140 0.3535 178 ALA A CA 903 C C . ALA A 167 ? 1.1657 0.9216 1.1336 0.0572 -0.2215 0.3730 178 ALA A C 904 O O . ALA A 167 ? 1.0333 0.7771 0.9850 0.0480 -0.2154 0.3846 178 ALA A O 905 C CB . ALA A 167 ? 1.0689 0.8067 1.0839 0.0655 -0.2188 0.3522 178 ALA A CB 906 N N . ASP A 168 ? 1.1734 0.9422 1.1384 0.0669 -0.2319 0.3722 179 ASP A N 907 C CA . ASP A 168 ? 1.2961 1.0633 1.2368 0.0679 -0.2374 0.3852 179 ASP A CA 908 C C . ASP A 168 ? 1.2781 1.0573 1.1884 0.0571 -0.2308 0.3908 179 ASP A C 909 O O . ASP A 168 ? 1.4136 1.1877 1.2997 0.0551 -0.2318 0.4032 179 ASP A O 910 C CB . ASP A 168 ? 1.3954 1.1741 1.3426 0.0812 -0.2511 0.3822 179 ASP A CB 911 C CG . ASP A 168 ? 1.5004 1.2615 1.4660 0.0927 -0.2580 0.3852 179 ASP A CG 912 O OD1 . ASP A 168 ? 1.5192 1.2561 1.4823 0.0896 -0.2539 0.3939 179 ASP A OD1 913 O OD2 . ASP A 168 ? 1.5255 1.2973 1.5084 0.1048 -0.2675 0.3789 179 ASP A OD2 914 N N . ASP A 169 ? 1.1256 0.9203 1.0365 0.0509 -0.2238 0.3816 180 ASP A N 915 C CA . ASP A 169 ? 1.0714 0.8781 0.9539 0.0415 -0.2163 0.3854 180 ASP A CA 916 C C . ASP A 169 ? 1.1721 0.9671 1.0451 0.0298 -0.2029 0.3952 180 ASP A C 917 O O . ASP A 169 ? 1.2294 1.0321 1.0777 0.0221 -0.1947 0.4009 180 ASP A O 918 C CB . ASP A 169 ? 1.1660 0.9961 1.0530 0.0400 -0.2096 0.3651 180 ASP A CB 919 C CG . ASP A 169 ? 1.2887 1.1333 1.1826 0.0497 -0.2222 0.3556 180 ASP A CG 920 O OD1 . ASP A 169 ? 1.2028 1.0547 1.0738 0.0509 -0.2301 0.3613 180 ASP A OD1 921 O OD2 . ASP A 169 ? 1.4160 1.2651 1.3378 0.0557 -0.2243 0.3426 180 ASP A OD2 922 N N . VAL A 170 ? 1.2902 1.0666 1.1829 0.0285 -0.2006 0.3968 181 VAL A N 923 C CA . VAL A 170 ? 1.3146 1.0792 1.2027 0.0165 -0.1888 0.4057 181 VAL A CA 924 C C . VAL A 170 ? 1.4650 1.2055 1.3510 0.0179 -0.1927 0.4182 181 VAL A C 925 O O . VAL A 170 ? 1.4174 1.1493 1.2900 0.0084 -0.1849 0.4301 181 VAL A O 926 C CB . VAL A 170 ? 1.1076 0.8701 1.0201 0.0111 -0.1813 0.3951 181 VAL A CB 927 C CG1 . VAL A 170 ? 1.0914 0.8465 0.9992 -0.0032 -0.1692 0.4050 181 VAL A CG1 928 C CG2 . VAL A 170 ? 0.9718 0.7601 0.8896 0.0126 -0.1752 0.3741 181 VAL A CG2 929 N N . ILE A 171 ? 1.5047 1.2351 1.4044 0.0301 -0.2046 0.4156 182 ILE A N 930 C CA . ILE A 171 ? 1.3574 1.0636 1.2574 0.0336 -0.2097 0.4264 182 ILE A CA 931 C C . ILE A 171 ? 1.2875 0.9956 1.1636 0.0387 -0.2169 0.4379 182 ILE A C 932 O O . ILE A 171 ? 1.1781 0.8987 1.0535 0.0490 -0.2270 0.4333 182 ILE A O 933 C CB . ILE A 171 ? 1.2962 0.9890 1.2245 0.0452 -0.2180 0.4176 182 ILE A CB 934 C CG1 . ILE A 171 ? 1.1980 0.8826 1.1472 0.0388 -0.2105 0.4080 182 ILE A CG1 935 C CG2 . ILE A 171 ? 1.0353 0.7044 0.9620 0.0514 -0.2250 0.4288 182 ILE A CG2 936 C CD1 . ILE A 171 ? 0.9643 0.6393 0.9411 0.0508 -0.2170 0.3957 182 ILE A CD1 937 N N . GLY A 172 ? 1.4019 1.0978 1.2586 0.0311 -0.2119 0.4530 183 GLY A N 938 C CA . GLY A 172 ? 1.4422 1.1391 1.2718 0.0340 -0.2170 0.4654 183 GLY A CA 939 C C . GLY A 172 ? 1.4068 1.0930 1.2418 0.0480 -0.2316 0.4690 183 GLY A C 940 O O . GLY A 172 ? 1.3868 1.0627 1.2478 0.0562 -0.2374 0.4623 183 GLY A O 941 N N . GLU A 173 ? 1.3876 1.0766 1.1974 0.0509 -0.2371 0.4797 184 GLU A N 942 C CA . GLU A 173 ? 1.4327 1.1161 1.2446 0.0646 -0.2519 0.4841 184 GLU A CA 943 C C . GLU A 173 ? 1.4727 1.1288 1.3030 0.0702 -0.2558 0.4900 184 GLU A C 944 O O . GLU A 173 ? 1.5322 1.1859 1.3859 0.0825 -0.2649 0.4826 184 GLU A O 945 C CB . GLU A 173 ? 1.3223 1.0097 1.0999 0.0643 -0.2556 0.4971 184 GLU A CB 946 N N . GLY A 174 ? 1.3599 0.9956 1.1797 0.0612 -0.2487 0.5030 185 GLY A N 947 C CA . GLY A 174 ? 1.6702 1.2772 1.5037 0.0656 -0.2525 0.5097 185 GLY A CA 948 C C . GLY A 174 ? 1.7832 1.3736 1.6334 0.0559 -0.2426 0.5059 185 GLY A C 949 O O . GLY A 174 ? 1.8713 1.4361 1.7210 0.0520 -0.2410 0.5163 185 GLY A O 950 N N . ARG A 175 ? 1.6831 1.2876 1.5480 0.0517 -0.2364 0.4909 186 ARG A N 951 C CA . ARG A 175 ? 1.5312 1.1223 1.4120 0.0416 -0.2273 0.4858 186 ARG A CA 952 C C . ARG A 175 ? 1.4428 1.0347 1.3533 0.0499 -0.2303 0.4676 186 ARG A C 953 O O . ARG A 175 ? 1.2826 0.8923 1.2009 0.0608 -0.2369 0.4578 186 ARG A O 954 C CB . ARG A 175 ? 1.3843 0.9905 1.2521 0.0252 -0.2138 0.4870 186 ARG A CB 955 C CG . ARG A 175 ? 1.3510 0.9591 1.1881 0.0176 -0.2094 0.5043 186 ARG A CG 956 C CD . ARG A 175 ? 1.3411 0.9655 1.1666 0.0022 -0.1947 0.5054 186 ARG A CD 957 N NE . ARG A 175 ? 1.4378 1.0488 1.2775 -0.0104 -0.1858 0.5061 186 ARG A NE 958 C CZ . ARG A 175 ? 1.5778 1.1957 1.4372 -0.0157 -0.1803 0.4931 186 ARG A CZ 959 N NH1 . ARG A 175 ? 1.7130 1.3507 1.5802 -0.0092 -0.1822 0.4787 186 ARG A NH1 960 N NH2 . ARG A 175 ? 1.5274 1.1323 1.3984 -0.0278 -0.1732 0.4947 186 ARG A NH2 961 N N . GLN A 176 ? 1.4314 1.0036 1.3580 0.0443 -0.2256 0.4631 187 GLN A N 962 C CA . GLN A 176 ? 1.4059 0.9749 1.3595 0.0522 -0.2278 0.4460 187 GLN A CA 963 C C . GLN A 176 ? 1.4259 1.0118 1.3871 0.0424 -0.2188 0.4338 187 GLN A C 964 O O . GLN A 176 ? 1.3918 0.9830 1.3728 0.0490 -0.2201 0.4184 187 GLN A O 965 C CB . GLN A 176 ? 1.5210 1.0555 1.4877 0.0541 -0.2294 0.4465 187 GLN A CB 966 C CG . GLN A 176 ? 1.6184 1.1437 1.6032 0.0736 -0.2393 0.4385 187 GLN A CG 967 C CD . GLN A 176 ? 1.6861 1.2253 1.6625 0.0866 -0.2488 0.4456 187 GLN A CD 968 O OE1 . GLN A 176 ? 1.6735 1.2392 1.6546 0.0938 -0.2522 0.4373 187 GLN A OE1 969 N NE2 . GLN A 176 ? 1.6602 1.1815 1.6241 0.0892 -0.2537 0.4611 187 GLN A NE2 970 N N . TRP A 177 ? 1.4903 1.0853 1.4359 0.0269 -0.2093 0.4410 188 TRP A N 971 C CA . TRP A 177 ? 1.5132 1.1266 1.4640 0.0172 -0.2002 0.4313 188 TRP A CA 972 C C . TRP A 177 ? 1.4652 1.1014 1.3930 0.0075 -0.1925 0.4395 188 TRP A C 973 O O . TRP A 177 ? 1.5037 1.1436 1.4109 0.0099 -0.1953 0.4508 188 TRP A O 974 C CB . TRP A 177 ? 1.5977 1.1930 1.5619 0.0057 -0.1936 0.4279 188 TRP A CB 975 C CG . TRP A 177 ? 1.6068 1.1905 1.5578 -0.0090 -0.1868 0.4430 188 TRP A CG 976 C CD1 . TRP A 177 ? 1.5502 1.1238 1.4836 -0.0092 -0.1889 0.4592 188 TRP A CD1 977 C CD2 . TRP A 177 ? 1.6205 1.2029 1.5758 -0.0260 -0.1767 0.4434 188 TRP A CD2 978 N NE1 . TRP A 177 ? 1.4973 1.0634 1.4240 -0.0253 -0.1803 0.4699 188 TRP A NE1 979 C CE2 . TRP A 177 ? 1.5390 1.1110 1.4796 -0.0359 -0.1728 0.4603 188 TRP A CE2 980 C CE3 . TRP A 177 ? 1.6826 1.2722 1.6531 -0.0340 -0.1709 0.4314 188 TRP A CE3 981 C CZ2 . TRP A 177 ? 1.5606 1.1310 1.5029 -0.0535 -0.1632 0.4653 188 TRP A CZ2 982 C CZ3 . TRP A 177 ? 1.6803 1.2679 1.6520 -0.0514 -0.1619 0.4363 188 TRP A CZ3 983 C CH2 . TRP A 177 ? 1.6179 1.1968 1.5764 -0.0610 -0.1581 0.4530 188 TRP A CH2 984 N N . GLY A 178 ? 1.3594 1.0108 1.2902 -0.0031 -0.1827 0.4334 189 GLY A N 985 C CA . GLY A 178 ? 1.2790 0.9530 1.1893 -0.0117 -0.1737 0.4394 189 GLY A CA 986 C C . GLY A 178 ? 1.1408 0.8313 1.0602 -0.0214 -0.1635 0.4304 189 GLY A C 987 O O . GLY A 178 ? 1.0938 0.7832 1.0342 -0.0188 -0.1653 0.4172 189 GLY A O 988 N N . ILE A 179 ? 0.9956 0.7018 0.8991 -0.0321 -0.1524 0.4376 190 ILE A N 989 C CA . ILE A 179 ? 1.0575 0.7826 0.9681 -0.0409 -0.1418 0.4304 190 ILE A CA 990 C C . ILE A 179 ? 1.1186 0.8680 1.0057 -0.0451 -0.1321 0.4362 190 ILE A C 991 O O . ILE A 179 ? 1.0770 0.8249 0.9461 -0.0507 -0.1267 0.4496 190 ILE A O 992 C CB . ILE A 179 ? 1.0044 0.7180 0.9318 -0.0542 -0.1349 0.4314 190 ILE A CB 993 C CG1 . ILE A 179 ? 1.0932 0.8308 1.0210 -0.0656 -0.1212 0.4301 190 ILE A CG1 994 C CG2 . ILE A 179 ? 0.9837 0.6772 0.9040 -0.0605 -0.1344 0.4460 190 ILE A CG2 995 C CD1 . ILE A 179 ? 1.1683 0.8979 1.1121 -0.0799 -0.1147 0.4318 190 ILE A CD1 996 N N . GLN A 180 ? 1.0878 0.8587 0.9743 -0.0418 -0.1301 0.4259 191 GLN A N 997 C CA . GLN A 180 ? 1.1729 0.9672 1.0368 -0.0442 -0.1208 0.4286 191 GLN A CA 998 C C . GLN A 180 ? 1.2180 1.0306 1.0922 -0.0532 -0.1061 0.4202 191 GLN A C 999 O O . GLN A 180 ? 1.1661 0.9769 1.0647 -0.0551 -0.1053 0.4077 191 GLN A O 1000 C CB . GLN A 180 ? 1.2069 1.0138 1.0596 -0.0320 -0.1282 0.4176 191 GLN A CB 1001 C CG . GLN A 180 ? 1.1758 0.9692 1.0165 -0.0226 -0.1424 0.4254 191 GLN A CG 1002 C CD . GLN A 180 ? 1.2314 1.0382 1.0639 -0.0118 -0.1517 0.4152 191 GLN A CD 1003 O OE1 . GLN A 180 ? 1.2385 1.0627 1.0788 -0.0099 -0.1468 0.3965 191 GLN A OE1 1004 N NE2 . GLN A 180 ? 1.0954 0.8957 0.9134 -0.0040 -0.1627 0.4212 191 GLN A NE2 1005 N N . SER A 181 ? 1.2341 1.0652 1.0895 -0.0580 -0.0941 0.4260 192 SER A N 1006 C CA . SER A 181 ? 1.1509 1.0008 1.0163 -0.0665 -0.0791 0.4200 192 SER A CA 1007 C C . SER A 181 ? 1.1415 1.0160 0.9849 -0.0649 -0.0675 0.4178 192 SER A C 1008 O O . SER A 181 ? 1.2379 1.1174 1.0626 -0.0706 -0.0589 0.4338 192 SER A O 1009 C CB . SER A 181 ? 1.1137 0.9546 0.9886 -0.0806 -0.0730 0.4369 192 SER A CB 1010 O OG . SER A 181 ? 1.1640 1.0278 1.0391 -0.0890 -0.0568 0.4382 192 SER A OG 1011 N N . LYS A 182 ? 1.1054 0.9946 0.9508 -0.0573 -0.0667 0.3980 193 LYS A N 1012 C CA . LYS A 182 ? 0.9760 0.8872 0.8023 -0.0552 -0.0552 0.3930 193 LYS A CA 1013 C C . LYS A 182 ? 0.9370 0.8663 0.7808 -0.0615 -0.0409 0.3859 193 LYS A C 1014 O O . LYS A 182 ? 0.9482 0.8785 0.8166 -0.0616 -0.0429 0.3723 193 LYS A O 1015 C CB . LYS A 182 ? 0.8465 0.7628 0.6625 -0.0435 -0.0628 0.3761 193 LYS A CB 1016 C CG . LYS A 182 ? 0.9200 0.8569 0.7181 -0.0407 -0.0511 0.3676 193 LYS A CG 1017 C CD . LYS A 182 ? 0.9993 0.9393 0.7890 -0.0305 -0.0597 0.3502 193 LYS A CD 1018 C CE . LYS A 182 ? 0.9365 0.8646 0.7045 -0.0249 -0.0737 0.3572 193 LYS A CE 1019 N NZ . LYS A 182 ? 0.8681 0.8014 0.6272 -0.0163 -0.0817 0.3405 193 LYS A NZ 1020 N N . THR A 183 ? 0.9074 0.8517 0.7383 -0.0665 -0.0264 0.3955 194 THR A N 1021 C CA . THR A 183 ? 0.9644 0.9296 0.8103 -0.0711 -0.0121 0.3894 194 THR A CA 1022 C C . THR A 183 ? 0.9685 0.9534 0.7897 -0.0664 0.0010 0.3883 194 THR A C 1023 O O . THR A 183 ? 1.0564 1.0423 0.8539 -0.0682 0.0067 0.4034 194 THR A O 1024 C CB . THR A 183 ? 0.9433 0.9082 0.8091 -0.0849 -0.0058 0.4043 194 THR A CB 1025 O OG1 . THR A 183 ? 0.8014 0.7915 0.6701 -0.0892 0.0114 0.4062 194 THR A OG1 1026 C CG2 . THR A 183 ? 0.8435 0.7918 0.6953 -0.0907 -0.0094 0.4266 194 THR A CG2 1027 N N . ALA A 184 ? 0.9758 0.9751 0.8010 -0.0600 0.0058 0.3702 195 ALA A N 1028 C CA . ALA A 184 ? 0.9860 0.9999 0.7850 -0.0529 0.0160 0.3654 195 ALA A CA 1029 C C . ALA A 184 ? 0.9599 0.9962 0.7716 -0.0519 0.0305 0.3555 195 ALA A C 1030 O O . ALA A 184 ? 1.0273 1.0669 0.8652 -0.0524 0.0282 0.3437 195 ALA A O 1031 C CB . ALA A 184 ? 0.7938 0.7985 0.5734 -0.0422 0.0042 0.3520 195 ALA A CB 1032 N N . TYR A 185 ? 0.8597 0.9114 0.6518 -0.0500 0.0456 0.3606 196 TYR A N 1033 C CA . TYR A 185 ? 0.9521 1.0255 0.7526 -0.0464 0.0600 0.3509 196 TYR A CA 1034 C C . TYR A 185 ? 0.9201 0.9972 0.6900 -0.0344 0.0644 0.3387 196 TYR A C 1035 O O . TYR A 185 ? 0.9478 1.0230 0.6856 -0.0318 0.0684 0.3463 196 TYR A O 1036 C CB . TYR A 185 ? 0.7836 0.8764 0.5943 -0.0546 0.0770 0.3668 196 TYR A CB 1037 C CG . TYR A 185 ? 0.9411 1.0582 0.7612 -0.0496 0.0923 0.3576 196 TYR A CG 1038 C CD1 . TYR A 185 ? 1.0371 1.1688 0.8327 -0.0428 0.1081 0.3593 196 TYR A CD1 1039 C CD2 . TYR A 185 ? 0.8704 0.9953 0.7229 -0.0507 0.0907 0.3469 196 TYR A CD2 1040 C CE1 . TYR A 185 ? 1.1116 1.2651 0.9166 -0.0367 0.1223 0.3506 196 TYR A CE1 1041 C CE2 . TYR A 185 ? 0.8125 0.9593 0.6745 -0.0452 0.1039 0.3390 196 TYR A CE2 1042 C CZ . TYR A 185 ? 1.0200 1.1810 0.8590 -0.0379 0.1197 0.3409 196 TYR A CZ 1043 O OH . TYR A 185 ? 1.0531 1.2357 0.9025 -0.0311 0.1331 0.3331 196 TYR A OH 1044 N N . SER A 186 ? 0.9566 1.0378 0.7354 -0.0274 0.0634 0.3197 197 SER A N 1045 C CA . SER A 186 ? 1.0214 1.1048 0.7733 -0.0161 0.0677 0.3062 197 SER A CA 1046 C C . SER A 186 ? 1.0354 1.1403 0.7969 -0.0120 0.0851 0.3005 197 SER A C 1047 O O . SER A 186 ? 1.1504 1.2618 0.9398 -0.0120 0.0847 0.2912 197 SER A O 1048 C CB . SER A 186 ? 0.9458 1.0144 0.6967 -0.0104 0.0515 0.2885 197 SER A CB 1049 O OG . SER A 186 ? 0.9860 1.0548 0.7719 -0.0138 0.0453 0.2815 197 SER A OG 1050 N N . GLY A 187 ? 0.7922 0.9082 0.5301 -0.0081 0.1006 0.3064 198 GLY A N 1051 C CA . GLY A 187 ? 0.8838 1.0223 0.6309 -0.0035 0.1190 0.3035 198 GLY A CA 1052 C C . GLY A 187 ? 1.0625 1.2014 0.8094 0.0077 0.1195 0.2822 198 GLY A C 1053 O O . GLY A 187 ? 0.8804 1.0372 0.6472 0.0108 0.1311 0.2785 198 GLY A O 1054 N N . LYS A 188 ? 0.7730 0.8927 0.4984 0.0135 0.1067 0.2687 199 LYS A N 1055 C CA . LYS A 188 ? 0.8676 0.9848 0.5873 0.0241 0.1072 0.2488 199 LYS A CA 1056 C C . LYS A 188 ? 0.8108 0.9320 0.5679 0.0226 0.1023 0.2402 199 LYS A C 1057 O O . LYS A 188 ? 0.7568 0.8831 0.5185 0.0305 0.1079 0.2276 199 LYS A O 1058 C CB . LYS A 188 ? 0.8694 0.9647 0.5577 0.0289 0.0933 0.2372 199 LYS A CB 1059 C CG . LYS A 188 ? 0.8977 0.9772 0.5974 0.0223 0.0726 0.2367 199 LYS A CG 1060 C CD . LYS A 188 ? 1.0140 1.0751 0.6848 0.0274 0.0592 0.2242 199 LYS A CD 1061 C CE . LYS A 188 ? 0.9674 1.0148 0.6471 0.0214 0.0393 0.2265 199 LYS A CE 1062 N NZ . LYS A 188 ? 0.9735 1.0057 0.6320 0.0258 0.0253 0.2128 199 LYS A NZ 1063 N N . ASN A 189 ? 0.8811 0.9989 0.6636 0.0126 0.0916 0.2470 200 ASN A N 1064 C CA . ASN A 189 ? 0.7927 0.9138 0.6096 0.0100 0.0862 0.2400 200 ASN A CA 1065 C C . ASN A 189 ? 0.7558 0.8870 0.6031 -0.0013 0.0875 0.2544 200 ASN A C 1066 O O . ASN A 189 ? 0.7093 0.8378 0.5828 -0.0063 0.0784 0.2509 200 ASN A O 1067 C CB . ASN A 189 ? 0.6573 0.7590 0.4743 0.0103 0.0679 0.2280 200 ASN A CB 1068 C CG . ASN A 189 ? 0.8369 0.9248 0.6507 0.0030 0.0550 0.2371 200 ASN A CG 1069 O OD1 . ASN A 189 ? 0.8001 0.8892 0.6035 -0.0012 0.0589 0.2519 200 ASN A OD1 1070 N ND2 . ASN A 189 ? 0.7951 0.8700 0.6180 0.0019 0.0396 0.2288 200 ASN A ND2 1071 N N . ARG A 190 ? 0.7374 0.8799 0.5800 -0.0056 0.0988 0.2705 201 ARG A N 1072 C CA . ARG A 190 ? 0.7799 0.9317 0.6493 -0.0178 0.1006 0.2860 201 ARG A CA 1073 C C . ARG A 190 ? 0.8140 0.9474 0.6969 -0.0259 0.0829 0.2867 201 ARG A C 1074 O O . ARG A 190 ? 0.8076 0.9448 0.7203 -0.0337 0.0794 0.2889 201 ARG A O 1075 C CB . ARG A 190 ? 0.8559 1.0304 0.7559 -0.0185 0.1104 0.2848 201 ARG A CB 1076 C CG . ARG A 190 ? 1.0604 1.2591 0.9570 -0.0157 0.1307 0.2942 201 ARG A CG 1077 C CD . ARG A 190 ? 1.1532 1.3678 1.0583 -0.0047 0.1405 0.2821 201 ARG A CD 1078 N NE . ARG A 190 ? 1.3862 1.6262 1.2906 -0.0012 0.1609 0.2913 201 ARG A NE 1079 C CZ . ARG A 190 ? 1.5390 1.7807 1.4116 0.0084 0.1729 0.2905 201 ARG A CZ 1080 N NH1 . ARG A 190 ? 1.5700 1.8371 1.4452 0.0117 0.1925 0.2993 201 ARG A NH1 1081 N NH2 . ARG A 190 ? 1.5322 1.7510 1.3703 0.0147 0.1652 0.2809 201 ARG A NH2 1082 N N . GLY A 191 ? 0.8669 0.9804 0.7273 -0.0235 0.0715 0.2843 202 GLY A N 1083 C CA . GLY A 191 ? 0.9964 1.0916 0.8678 -0.0279 0.0544 0.2817 202 GLY A CA 1084 C C . GLY A 191 ? 0.9631 1.0475 0.8340 -0.0369 0.0488 0.2984 202 GLY A C 1085 O O . GLY A 191 ? 1.0940 1.1701 0.9389 -0.0355 0.0474 0.3062 202 GLY A O 1086 N N . LEU A 192 ? 0.7604 0.8438 0.6593 -0.0463 0.0451 0.3037 203 LEU A N 1087 C CA . LEU A 192 ? 0.7903 0.8597 0.6922 -0.0551 0.0379 0.3184 203 LEU A CA 1088 C C . LEU A 192 ? 0.6626 0.7104 0.5688 -0.0533 0.0204 0.3101 203 LEU A C 1089 O O . LEU A 192 ? 0.7866 0.8335 0.7103 -0.0517 0.0148 0.2966 203 LEU A O 1090 C CB . LEU A 192 ? 0.8184 0.8968 0.7480 -0.0671 0.0431 0.3289 203 LEU A CB 1091 C CG . LEU A 192 ? 0.8160 0.8780 0.7506 -0.0776 0.0359 0.3446 203 LEU A CG 1092 C CD1 . LEU A 192 ? 0.8479 0.9087 0.7566 -0.0785 0.0418 0.3612 203 LEU A CD1 1093 C CD2 . LEU A 192 ? 0.9246 0.9945 0.8896 -0.0901 0.0389 0.3517 203 LEU A CD2 1094 N N . THR A 193 ? 0.7107 0.7420 0.6005 -0.0532 0.0120 0.3186 204 THR A N 1095 C CA . THR A 193 ? 0.6864 0.6981 0.5820 -0.0511 -0.0043 0.3128 204 THR A CA 1096 C C . THR A 193 ? 0.8555 0.8506 0.7532 -0.0584 -0.0106 0.3294 204 THR A C 1097 O O . THR A 193 ? 0.9348 0.9283 0.8140 -0.0608 -0.0068 0.3447 204 THR A O 1098 C CB . THR A 193 ? 0.7993 0.8051 0.6726 -0.0406 -0.0121 0.3030 204 THR A CB 1099 O OG1 . THR A 193 ? 0.7828 0.7701 0.6492 -0.0400 -0.0251 0.3103 204 THR A OG1 1100 C CG2 . THR A 193 ? 0.9858 1.0027 0.8308 -0.0362 -0.0018 0.3051 204 THR A CG2 1101 N N . GLN A 194 ? 0.8637 0.8457 0.7833 -0.0618 -0.0201 0.3262 205 GLN A N 1102 C CA . GLN A 194 ? 0.7543 0.7178 0.6795 -0.0689 -0.0267 0.3406 205 GLN A CA 1103 C C . GLN A 194 ? 0.8048 0.7483 0.7365 -0.0631 -0.0422 0.3328 205 GLN A C 1104 O O . GLN A 194 ? 0.8137 0.7577 0.7615 -0.0600 -0.0462 0.3172 205 GLN A O 1105 C CB . GLN A 194 ? 0.6999 0.6670 0.6491 -0.0810 -0.0211 0.3462 205 GLN A CB 1106 C CG . GLN A 194 ? 1.5674 1.5112 1.5267 -0.0889 -0.0297 0.3577 205 GLN A CG 1107 C CD . GLN A 194 ? 1.4231 1.3595 1.3653 -0.0940 -0.0275 0.3795 205 GLN A CD 1108 O OE1 . GLN A 194 ? 1.4036 1.3315 1.3241 -0.0869 -0.0327 0.3841 205 GLN A OE1 1109 N NE2 . GLN A 194 ? 1.3764 1.3162 1.3286 -0.1070 -0.0203 0.3937 205 GLN A NE2 1110 N N . SER A 195 ? 0.9057 0.8322 0.8248 -0.0613 -0.0507 0.3441 206 SER A N 1111 C CA . SER A 195 ? 0.9237 0.8323 0.8487 -0.0543 -0.0653 0.3379 206 SER A CA 1112 C C . SER A 195 ? 0.9556 0.8409 0.8812 -0.0581 -0.0731 0.3541 206 SER A C 1113 O O . SER A 195 ? 1.0035 0.8856 0.9125 -0.0622 -0.0703 0.3716 206 SER A O 1114 C CB . SER A 195 ? 0.8394 0.7523 0.7458 -0.0431 -0.0712 0.3307 206 SER A CB 1115 O OG . SER A 195 ? 1.0442 0.9430 0.9589 -0.0359 -0.0851 0.3251 206 SER A OG 1116 N N . ILE A 196 ? 0.8669 0.7352 0.8110 -0.0565 -0.0825 0.3483 207 ILE A N 1117 C CA . ILE A 196 ? 0.9902 0.8328 0.9361 -0.0581 -0.0915 0.3618 207 ILE A CA 1118 C C . ILE A 196 ? 0.9884 0.8178 0.9409 -0.0462 -0.1050 0.3523 207 ILE A C 1119 O O . ILE A 196 ? 0.9780 0.8128 0.9449 -0.0413 -0.1064 0.3346 207 ILE A O 1120 C CB . ILE A 196 ? 1.0752 0.9059 1.0397 -0.0702 -0.0888 0.3668 207 ILE A CB 1121 C CG1 . ILE A 196 ? 1.2169 1.0630 1.1767 -0.0825 -0.0755 0.3784 207 ILE A CG1 1122 C CG2 . ILE A 196 ? 1.0648 0.8654 1.0312 -0.0713 -0.0989 0.3798 207 ILE A CG2 1123 C CD1 . ILE A 196 ? 1.3005 1.1359 1.2782 -0.0963 -0.0735 0.3857 207 ILE A CD1 1124 N N . ALA A 197 ? 1.0314 0.8444 0.9734 -0.0413 -0.1146 0.3647 208 ALA A N 1125 C CA . ALA A 197 ? 0.9802 0.7821 0.9293 -0.0290 -0.1276 0.3578 208 ALA A CA 1126 C C . ALA A 197 ? 0.9999 0.7722 0.9546 -0.0286 -0.1368 0.3706 208 ALA A C 1127 O O . ALA A 197 ? 1.0200 0.7819 0.9592 -0.0311 -0.1394 0.3896 208 ALA A O 1128 C CB . ALA A 197 ? 0.9821 0.7959 0.9123 -0.0197 -0.1329 0.3579 208 ALA A CB 1129 N N . LEU A 198 ? 1.0340 0.7921 1.0099 -0.0251 -0.1416 0.3602 209 LEU A N 1130 C CA . LEU A 198 ? 1.0948 0.8222 1.0778 -0.0230 -0.1509 0.3698 209 LEU A CA 1131 C C . LEU A 198 ? 1.0702 0.7916 1.0591 -0.0067 -0.1630 0.3640 209 LEU A C 1132 O O . LEU A 198 ? 1.1044 0.8396 1.1044 0.0011 -0.1634 0.3461 209 LEU A O 1133 C CB . LEU A 198 ? 1.1933 0.9055 1.1956 -0.0302 -0.1481 0.3623 209 LEU A CB 1134 C CG . LEU A 198 ? 1.1927 0.8941 1.1940 -0.0468 -0.1419 0.3755 209 LEU A CG 1135 C CD1 . LEU A 198 ? 1.2580 0.9868 1.2483 -0.0568 -0.1296 0.3796 209 LEU A CD1 1136 C CD2 . LEU A 198 ? 1.1739 0.8611 1.1951 -0.0523 -0.1414 0.3637 209 LEU A CD2 1137 N N . ALA A 199 ? 0.9893 0.6908 0.9717 -0.0017 -0.1728 0.3797 210 ALA A N 1138 C CA . ALA A 199 ? 1.1553 0.8502 1.1457 0.0143 -0.1852 0.3762 210 ALA A CA 1139 C C . ALA A 199 ? 1.2279 0.8936 1.2195 0.0181 -0.1917 0.3860 210 ALA A C 1140 O O . ALA A 199 ? 1.2612 0.9189 1.2364 0.0115 -0.1895 0.4001 210 ALA A O 1141 C CB . ALA A 199 ? 1.2863 1.0027 1.2615 0.0215 -0.1899 0.3784 210 ALA A CB 1142 N N . GLY A 200 ? 1.3155 0.9664 1.3263 0.0293 -0.1984 0.3768 211 GLY A N 1143 C CA . GLY A 200 ? 0.9649 0.5875 0.9782 0.0346 -0.2038 0.3828 211 GLY A CA 1144 C C . GLY A 200 ? 1.2154 0.8339 1.2447 0.0533 -0.2134 0.3741 211 GLY A C 1145 O O . GLY A 200 ? 1.2426 0.8751 1.2871 0.0606 -0.2145 0.3603 211 GLY A O 1146 N N . ARG A 201 ? 1.2252 0.8251 1.2518 0.0613 -0.2200 0.3826 212 ARG A N 1147 C CA . ARG A 201 ? 1.2937 0.8898 1.3358 0.0800 -0.2288 0.3759 212 ARG A CA 1148 C C . ARG A 201 ? 1.2757 0.8376 1.3220 0.0853 -0.2321 0.3806 212 ARG A C 1149 O O . ARG A 201 ? 1.4832 1.0314 1.5140 0.0810 -0.2336 0.3958 212 ARG A O 1150 C CB . ARG A 201 ? 1.3701 0.9881 1.4032 0.0891 -0.2364 0.3822 212 ARG A CB 1151 C CG . ARG A 201 ? 1.3662 0.9844 1.4164 0.1087 -0.2458 0.3768 212 ARG A CG 1152 C CD . ARG A 201 ? 1.3694 1.0116 1.4101 0.1154 -0.2538 0.3828 212 ARG A CD 1153 N NE . ARG A 201 ? 1.3398 1.0116 1.3748 0.1087 -0.2509 0.3771 212 ARG A NE 1154 C CZ . ARG A 201 ? 1.2974 0.9919 1.3195 0.1102 -0.2565 0.3813 212 ARG A CZ 1155 N NH1 . ARG A 201 ? 1.4045 1.0966 1.4183 0.1181 -0.2655 0.3917 212 ARG A NH1 1156 N NH2 . ARG A 201 ? 1.1039 0.8227 1.1207 0.1037 -0.2534 0.3749 212 ARG A NH2 1157 N N . ILE A 202 ? 1.1170 0.6648 1.1835 0.0948 -0.2330 0.3673 213 ILE A N 1158 C CA . ILE A 202 ? 1.3653 0.8810 1.4374 0.1036 -0.2370 0.3695 213 ILE A CA 1159 C C . ILE A 202 ? 1.4965 1.0158 1.5894 0.1248 -0.2424 0.3574 213 ILE A C 1160 O O . ILE A 202 ? 1.5497 1.0570 1.6586 0.1304 -0.2399 0.3428 213 ILE A O 1161 C CB . ILE A 202 ? 1.3802 0.8653 1.4533 0.0918 -0.2313 0.3664 213 ILE A CB 1162 C CG1 . ILE A 202 ? 1.2877 0.7806 1.3729 0.0863 -0.2251 0.3492 213 ILE A CG1 1163 C CG2 . ILE A 202 ? 1.4816 0.9597 1.5346 0.0732 -0.2274 0.3827 213 ILE A CG2 1164 C CD1 . ILE A 202 ? 1.2064 0.6693 1.2932 0.0751 -0.2206 0.3443 213 ILE A CD1 1165 N N . GLY A 203 ? 1.5400 1.0771 1.6321 0.1364 -0.2498 0.3636 214 GLY A N 1166 C CA . GLY A 203 ? 1.5745 1.1223 1.6873 0.1566 -0.2549 0.3537 214 GLY A CA 1167 C C . GLY A 203 ? 1.6380 1.2155 1.7463 0.1630 -0.2625 0.3612 214 GLY A C 1168 O O . GLY A 203 ? 1.6625 1.2367 1.7524 0.1596 -0.2670 0.3772 214 GLY A O 1169 N N . GLY A 204 ? 1.6553 1.2619 1.7799 0.1719 -0.2640 0.3498 215 GLY A N 1170 C CA . GLY A 204 ? 1.5831 1.1936 1.7292 0.1765 -0.2582 0.3312 215 GLY A CA 1171 C C . GLY A 204 ? 1.3812 1.0060 1.5233 0.1615 -0.2508 0.3238 215 GLY A C 1172 O O . GLY A 204 ? 1.0941 0.7493 1.2340 0.1583 -0.2518 0.3228 215 GLY A O 1173 N N . ALA A 205 ? 1.2678 0.8698 1.4088 0.1522 -0.2435 0.3185 216 ALA A N 1174 C CA . ALA A 205 ? 1.1600 0.7727 1.2992 0.1387 -0.2361 0.3108 216 ALA A CA 1175 C C . ALA A 205 ? 1.1672 0.7896 1.2828 0.1214 -0.2343 0.3239 216 ALA A C 1176 O O . ALA A 205 ? 1.2493 0.8544 1.3482 0.1141 -0.2349 0.3378 216 ALA A O 1177 C CB . ALA A 205 ? 0.9513 0.5354 1.0959 0.1337 -0.2298 0.3013 216 ALA A CB 1178 N N . GLU A 206 ? 1.0748 0.7251 1.1891 0.1155 -0.2316 0.3194 217 GLU A N 1179 C CA . GLU A 206 ? 1.0221 0.6834 1.1144 0.0995 -0.2280 0.3294 217 GLU A CA 1180 C C . GLU A 206 ? 1.0455 0.7228 1.1382 0.0878 -0.2155 0.3143 217 GLU A C 1181 O O . GLU A 206 ? 1.0612 0.7496 1.1699 0.0933 -0.2111 0.2960 217 GLU A O 1182 C CB . GLU A 206 ? 1.0654 0.7527 1.1467 0.1032 -0.2343 0.3363 217 GLU A CB 1183 C CG . GLU A 206 ? 1.0971 0.8168 1.1900 0.1085 -0.2342 0.3222 217 GLU A CG 1184 C CD . GLU A 206 ? 1.1510 0.8931 1.2324 0.1113 -0.2431 0.3306 217 GLU A CD 1185 O OE1 . GLU A 206 ? 1.1380 0.8752 1.2153 0.1193 -0.2509 0.3392 217 GLU A OE1 1186 O OE2 . GLU A 206 ? 1.1356 0.9031 1.2088 0.1044 -0.2382 0.3229 217 GLU A OE2 1187 N N . ALA A 207 ? 1.0619 0.7418 1.1367 0.0719 -0.2089 0.3216 218 ALA A N 1188 C CA . ALA A 207 ? 1.0419 0.7395 1.1159 0.0606 -0.1967 0.3078 218 ALA A CA 1189 C C . ALA A 207 ? 1.1293 0.8436 1.1822 0.0479 -0.1913 0.3168 218 ALA A C 1190 O O . ALA A 207 ? 1.1534 0.8571 1.1905 0.0429 -0.1942 0.3353 218 ALA A O 1191 C CB . ALA A 207 ? 0.9946 0.6702 1.0766 0.0532 -0.1906 0.3012 218 ALA A CB 1192 N N . LEU A 208 ? 0.9853 0.7254 1.0378 0.0434 -0.1831 0.3036 219 LEU A N 1193 C CA . LEU A 208 ? 0.8380 0.5955 0.8717 0.0323 -0.1761 0.3088 219 LEU A CA 1194 C C . LEU A 208 ? 0.8642 0.6308 0.9035 0.0223 -0.1642 0.2959 219 LEU A C 1195 O O . LEU A 208 ? 0.8905 0.6651 0.9446 0.0264 -0.1619 0.2789 219 LEU A O 1196 C CB . LEU A 208 ? 0.8325 0.6151 0.8582 0.0386 -0.1798 0.3056 219 LEU A CB 1197 C CG . LEU A 208 ? 0.9231 0.7188 0.9234 0.0320 -0.1776 0.3160 219 LEU A CG 1198 C CD1 . LEU A 208 ? 0.7455 0.5688 0.7427 0.0331 -0.1745 0.3024 219 LEU A CD1 1199 C CD2 . LEU A 208 ? 0.8525 0.6419 0.8406 0.0181 -0.1675 0.3257 219 LEU A CD2 1200 N N . LEU A 209 ? 0.9328 0.6992 0.9607 0.0092 -0.1566 0.3046 220 LEU A N 1201 C CA . LEU A 209 ? 0.7995 0.5761 0.8322 -0.0010 -0.1457 0.2945 220 LEU A CA 1202 C C . LEU A 209 ? 0.8892 0.6836 0.9044 -0.0100 -0.1377 0.3024 220 LEU A C 1203 O O . LEU A 209 ? 1.0523 0.8384 1.0547 -0.0164 -0.1370 0.3196 220 LEU A O 1204 C CB . LEU A 209 ? 0.8157 0.5690 0.8580 -0.0091 -0.1443 0.2970 220 LEU A CB 1205 C CG . LEU A 209 ? 0.9712 0.7277 1.0275 -0.0145 -0.1380 0.2807 220 LEU A CG 1206 C CD1 . LEU A 209 ? 0.7379 0.4883 0.7932 -0.0305 -0.1317 0.2886 220 LEU A CD1 1207 C CD2 . LEU A 209 ? 0.6955 0.4804 0.7536 -0.0114 -0.1325 0.2653 220 LEU A CD2 1208 N N . ILE A 210 ? 0.8604 0.6786 0.8742 -0.0102 -0.1313 0.2903 221 ILE A N 1209 C CA . ILE A 210 ? 0.8655 0.7012 0.8629 -0.0172 -0.1227 0.2957 221 ILE A CA 1210 C C . ILE A 210 ? 0.8389 0.6893 0.8446 -0.0245 -0.1122 0.2844 221 ILE A C 1211 O O . ILE A 210 ? 0.8440 0.7020 0.8615 -0.0205 -0.1120 0.2683 221 ILE A O 1212 C CB . ILE A 210 ? 0.8483 0.7000 0.8302 -0.0096 -0.1258 0.2939 221 ILE A CB 1213 C CG1 . ILE A 210 ? 0.9789 0.8181 0.9550 -0.0010 -0.1383 0.3036 221 ILE A CG1 1214 C CG2 . ILE A 210 ? 0.7036 0.5690 0.6649 -0.0162 -0.1168 0.3015 221 ILE A CG2 1215 C CD1 . ILE A 210 ? 0.9660 0.8198 0.9260 0.0055 -0.1431 0.3025 221 ILE A CD1 1216 N N . HIS A 211 ? 0.9196 0.7746 0.9193 -0.0351 -0.1034 0.2936 222 HIS A N 1217 C CA . HIS A 211 ? 0.8540 0.7256 0.8607 -0.0419 -0.0933 0.2849 222 HIS A CA 1218 C C . HIS A 211 ? 0.7793 0.6699 0.7690 -0.0446 -0.0841 0.2911 222 HIS A C 1219 O O . HIS A 211 ? 0.8507 0.7380 0.8269 -0.0486 -0.0820 0.3072 222 HIS A O 1220 C CB . HIS A 211 ? 0.7259 0.5866 0.7466 -0.0529 -0.0906 0.2890 222 HIS A CB 1221 C CG . HIS A 211 ? 0.7900 0.6685 0.8194 -0.0603 -0.0812 0.2815 222 HIS A CG 1222 N ND1 . HIS A 211 ? 0.8928 0.7828 0.9308 -0.0560 -0.0801 0.2640 222 HIS A ND1 1223 C CD2 . HIS A 211 ? 0.9435 0.8310 0.9750 -0.0715 -0.0727 0.2900 222 HIS A CD2 1224 C CE1 . HIS A 211 ? 0.8484 0.7529 0.8930 -0.0639 -0.0719 0.2620 222 HIS A CE1 1225 N NE2 . HIS A 211 ? 0.8856 0.7898 0.9274 -0.0732 -0.0673 0.2774 222 HIS A NE2 1226 N N . THR A 212 ? 0.7820 0.6918 0.7714 -0.0420 -0.0785 0.2785 223 THR A N 1227 C CA . THR A 212 ? 0.8749 0.8025 0.8481 -0.0433 -0.0690 0.2821 223 THR A CA 1228 C C . THR A 212 ? 0.7940 0.7382 0.7784 -0.0481 -0.0591 0.2735 223 THR A C 1229 O O . THR A 212 ? 0.7653 0.7129 0.7627 -0.0455 -0.0608 0.2590 223 THR A O 1230 C CB . THR A 212 ? 0.8656 0.8003 0.8216 -0.0336 -0.0726 0.2757 223 THR A CB 1231 O OG1 . THR A 212 ? 0.9340 0.8544 0.8812 -0.0287 -0.0834 0.2837 223 THR A OG1 1232 C CG2 . THR A 212 ? 0.8263 0.7762 0.7624 -0.0345 -0.0625 0.2799 223 THR A CG2 1233 N N . GLY A 213 ? 0.7271 0.6824 0.7070 -0.0549 -0.0486 0.2832 224 GLY A N 1234 C CA . GLY A 213 ? 0.6015 0.5749 0.5918 -0.0587 -0.0388 0.2769 224 GLY A CA 1235 C C . GLY A 213 ? 0.7850 0.7762 0.7580 -0.0557 -0.0283 0.2791 224 GLY A C 1236 O O . GLY A 213 ? 0.8444 0.8363 0.8021 -0.0578 -0.0238 0.2929 224 GLY A O 1237 N N . ARG A 214 ? 0.6809 0.6856 0.6550 -0.0505 -0.0243 0.2656 225 ARG A N 1238 C CA . ARG A 214 ? 0.6595 0.6797 0.6167 -0.0463 -0.0141 0.2654 225 ARG A CA 1239 C C . ARG A 214 ? 0.7333 0.7714 0.7043 -0.0471 -0.0049 0.2579 225 ARG A C 1240 O O . ARG A 214 ? 0.5942 0.6327 0.5796 -0.0457 -0.0090 0.2454 225 ARG A O 1241 C CB . ARG A 214 ? 0.7304 0.7468 0.6684 -0.0363 -0.0198 0.2557 225 ARG A CB 1242 C CG . ARG A 214 ? 0.8999 0.8984 0.8340 -0.0337 -0.0335 0.2568 225 ARG A CG 1243 C CD . ARG A 214 ? 0.9173 0.9150 0.8358 -0.0249 -0.0397 0.2463 225 ARG A CD 1244 N NE . ARG A 214 ? 0.8872 0.8889 0.7780 -0.0220 -0.0348 0.2520 225 ARG A NE 1245 C CZ . ARG A 214 ? 0.9556 0.9485 0.8264 -0.0183 -0.0430 0.2565 225 ARG A CZ 1246 N NH1 . ARG A 214 ? 0.6410 0.6219 0.5193 -0.0165 -0.0563 0.2561 225 ARG A NH1 1247 N NH2 . ARG A 214 ? 1.0331 1.0297 0.8765 -0.0159 -0.0379 0.2611 225 ARG A NH2 1248 N N . ARG A 215 ? 0.7365 0.7901 0.7032 -0.0492 0.0077 0.2661 226 ARG A N 1249 C CA . ARG A 215 ? 0.7526 0.8253 0.7295 -0.0476 0.0174 0.2595 226 ARG A CA 1250 C C . ARG A 215 ? 0.7751 0.8594 0.7301 -0.0404 0.0286 0.2603 226 ARG A C 1251 O O . ARG A 215 ? 0.9572 1.0425 0.8964 -0.0417 0.0342 0.2726 226 ARG A O 1252 C CB . ARG A 215 ? 0.8348 0.9188 0.8359 -0.0580 0.0228 0.2682 226 ARG A CB 1253 C CG . ARG A 215 ? 1.0272 1.1175 1.0245 -0.0652 0.0313 0.2868 226 ARG A CG 1254 C CD . ARG A 215 ? 1.2462 1.3483 1.2706 -0.0768 0.0351 0.2948 226 ARG A CD 1255 N NE . ARG A 215 ? 1.4596 1.5444 1.5000 -0.0847 0.0226 0.2937 226 ARG A NE 1256 C CZ . ARG A 215 ? 1.4573 1.5415 1.5156 -0.0858 0.0164 0.2821 226 ARG A CZ 1257 N NH1 . ARG A 215 ? 1.3357 1.4026 1.4055 -0.0927 0.0057 0.2811 226 ARG A NH1 1258 N NH2 . ARG A 215 ? 1.4944 1.5944 1.5580 -0.0797 0.0211 0.2714 226 ARG A NH2 1259 N N . ALA A 216 ? 0.7280 0.8196 0.6804 -0.0323 0.0318 0.2470 227 ALA A N 1260 C CA . ALA A 216 ? 0.8192 0.9200 0.7499 -0.0243 0.0425 0.2456 227 ALA A CA 1261 C C . ALA A 216 ? 0.8572 0.9715 0.7977 -0.0185 0.0495 0.2345 227 ALA A C 1262 O O . ALA A 216 ? 0.7867 0.9031 0.7498 -0.0209 0.0451 0.2283 227 ALA A O 1263 C CB . ALA A 216 ? 0.5920 0.6779 0.4943 -0.0175 0.0353 0.2397 227 ALA A CB 1264 N N . GLY A 217 ? 0.8275 0.9503 0.7500 -0.0103 0.0605 0.2323 228 GLY A N 1265 C CA . GLY A 217 ? 0.5630 0.6968 0.4920 -0.0029 0.0675 0.2217 228 GLY A CA 1266 C C . GLY A 217 ? 0.7171 0.8402 0.6195 0.0077 0.0660 0.2086 228 GLY A C 1267 O O . GLY A 217 ? 0.8340 0.9409 0.7171 0.0082 0.0566 0.2060 228 GLY A O 1268 N N . GLU A 218 ? 0.7452 0.8514 0.5100 0.0593 -0.0273 0.1743 229 GLU A N 1269 C CA . GLU A 218 ? 0.8014 0.8996 0.5327 0.0756 -0.0357 0.1552 229 GLU A CA 1270 C C . GLU A 218 ? 0.9589 1.0683 0.6575 0.0917 -0.0342 0.1645 229 GLU A C 1271 O O . GLU A 218 ? 0.8641 0.9981 0.5609 0.0961 -0.0202 0.1858 229 GLU A O 1272 C CB . GLU A 218 ? 0.7037 0.8108 0.4276 0.0848 -0.0291 0.1445 229 GLU A CB 1273 C CG . GLU A 218 ? 0.7655 0.8907 0.5188 0.0747 -0.0147 0.1588 229 GLU A CG 1274 C CD . GLU A 218 ? 1.0219 1.1694 0.7618 0.0896 -0.0024 0.1592 229 GLU A CD 1275 O OE1 . GLU A 218 ? 0.9401 1.0879 0.6444 0.1097 -0.0049 0.1477 229 GLU A OE1 1276 O OE2 . GLU A 218 ? 1.2201 1.3844 0.9846 0.0820 0.0088 0.1710 229 GLU A OE2 1277 N N . ILE A 219 ? 0.9879 1.0801 0.6614 0.1006 -0.0494 0.1499 230 ILE A N 1278 C CA . ILE A 219 ? 0.8803 0.9807 0.5154 0.1199 -0.0502 0.1541 230 ILE A CA 1279 C C . ILE A 219 ? 0.9647 1.0787 0.5707 0.1410 -0.0426 0.1465 230 ILE A C 1280 O O . ILE A 219 ? 1.0059 1.1042 0.6007 0.1472 -0.0525 0.1237 230 ILE A O 1281 C CB . ILE A 219 ? 0.8865 0.9621 0.5028 0.1237 -0.0717 0.1385 230 ILE A CB 1282 C CG1 . ILE A 219 ? 0.8558 0.9206 0.5001 0.1053 -0.0783 0.1475 230 ILE A CG1 1283 C CG2 . ILE A 219 ? 0.7985 0.8806 0.3692 0.1469 -0.0743 0.1395 230 ILE A CG2 1284 C CD1 . ILE A 219 ? 0.7817 0.8259 0.4122 0.1078 -0.0992 0.1360 230 ILE A CD1 1285 N N . ARG A 220 ? 0.9737 1.1179 0.5687 0.1524 -0.0249 0.1667 231 ARG A N 1286 C CA . ARG A 220 ? 1.0767 1.2391 0.6451 0.1746 -0.0145 0.1625 231 ARG A CA 1287 C C . ARG A 220 ? 1.1486 1.2992 0.6646 0.2011 -0.0269 0.1443 231 ARG A C 1288 O O . ARG A 220 ? 1.1568 1.2916 0.6568 0.2026 -0.0409 0.1409 231 ARG A O 1289 C CB . ARG A 220 ? 1.2042 1.4071 0.7804 0.1789 0.0093 0.1932 231 ARG A CB 1290 C CG . ARG A 220 ? 1.5005 1.7130 1.1289 0.1530 0.0188 0.2106 231 ARG A CG 1291 C CD . ARG A 220 ? 1.7768 2.0306 1.4166 0.1583 0.0413 0.2371 231 ARG A CD 1292 N NE . ARG A 220 ? 1.9296 2.1874 1.6185 0.1340 0.0462 0.2478 231 ARG A NE 1293 C CZ . ARG A 220 ? 1.9443 2.2354 1.6557 0.1321 0.0631 0.2707 231 ARG A CZ 1294 N NH1 . ARG A 220 ? 1.9301 2.2571 1.6199 0.1539 0.0791 0.2871 231 ARG A NH1 1295 N NH2 . ARG A 220 ? 1.8811 2.1705 1.6366 0.1091 0.0635 0.2780 231 ARG A NH2 1296 N N . ALA A 221 ? 1.1075 1.2643 0.5965 0.2227 -0.0232 0.1317 232 ALA A N 1297 C CA . ALA A 221 ? 1.1106 1.2531 0.5462 0.2508 -0.0368 0.1118 232 ALA A CA 1298 C C . ALA A 221 ? 1.1837 1.3575 0.5948 0.2752 -0.0180 0.1245 232 ALA A C 1299 O O . ALA A 221 ? 1.1934 1.4026 0.6266 0.2715 0.0051 0.1505 232 ALA A O 1300 C CB . ALA A 221 ? 0.9165 1.0339 0.3430 0.2570 -0.0507 0.0822 232 ALA A CB 1301 N N . HIS A 222 ? 1.1816 1.3406 0.5565 0.2974 -0.0286 0.1055 233 HIS A N 1302 C CA . HIS A 222 ? 1.2254 1.4106 0.5805 0.3226 -0.0121 0.1123 233 HIS A CA 1303 C C . HIS A 222 ? 1.2484 1.4624 0.6179 0.3295 0.0086 0.1196 233 HIS A C 1304 O O . HIS A 222 ? 1.3415 1.5405 0.7126 0.3291 0.0019 0.1017 233 HIS A O 1305 C CB . HIS A 222 ? 1.0821 1.2397 0.3954 0.3471 -0.0306 0.0838 233 HIS A CB 1306 C CG . HIS A 222 ? 1.1767 1.3590 0.4655 0.3756 -0.0162 0.0905 233 HIS A CG 1307 N ND1 . HIS A 222 ? 1.2615 1.4706 0.5474 0.3959 0.0022 0.0937 233 HIS A ND1 1308 C CD2 . HIS A 222 ? 1.2725 1.4574 0.5385 0.3884 -0.0179 0.0951 233 HIS A CD2 1309 C CE1 . HIS A 222 ? 1.3872 1.6156 0.6501 0.4208 0.0116 0.1004 233 HIS A CE1 1310 N NE2 . HIS A 222 ? 1.3915 1.6052 0.6410 0.4168 -0.0003 0.1011 233 HIS A NE2 1311 N N . GLU A 223 ? 1.2786 1.5347 0.6616 0.3348 0.0332 0.1472 234 GLU A N 1312 C CA . GLU A 223 ? 1.2504 1.5404 0.6552 0.3385 0.0545 0.1604 234 GLU A CA 1313 C C . GLU A 223 ? 1.2611 1.5431 0.6420 0.3636 0.0515 0.1351 234 GLU A C 1314 O O . GLU A 223 ? 1.1591 1.4517 0.5583 0.3603 0.0596 0.1353 234 GLU A O 1315 C CB . GLU A 223 ? 1.4081 1.7447 0.8280 0.3449 0.0784 0.1932 234 GLU A CB 1316 C CG . GLU A 223 ? 1.6120 1.9514 0.9957 0.3714 0.0773 0.1897 234 GLU A CG 1317 C CD . GLU A 223 ? 1.6231 2.0115 1.0233 0.3792 0.1011 0.2233 234 GLU A CD 1318 O OE1 . GLU A 223 ? 1.6174 2.0355 1.0610 0.3603 0.1166 0.2508 234 GLU A OE1 1319 O OE2 . GLU A 223 ? 1.5796 1.9766 0.9507 0.4042 0.1034 0.2226 234 GLU A OE2 1320 N N . ASP A 224 ? 1.3264 1.5884 0.6668 0.3889 0.0390 0.1135 235 ASP A N 1321 C CA . ASP A 224 ? 1.4522 1.7040 0.7681 0.4155 0.0345 0.0895 235 ASP A CA 1322 C C . ASP A 224 ? 1.5453 1.7531 0.8579 0.4054 0.0112 0.0602 235 ASP A C 1323 O O . ASP A 224 ? 1.6114 1.8163 0.9237 0.4148 0.0118 0.0473 235 ASP A O 1324 C CB . ASP A 224 ? 1.5302 1.7750 0.8044 0.4478 0.0282 0.0771 235 ASP A CB 1325 C CG . ASP A 224 ? 1.5680 1.8617 0.8444 0.4649 0.0535 0.1052 235 ASP A CG 1326 O OD1 . ASP A 224 ? 1.6566 1.9491 0.9040 0.4844 0.0502 0.1034 235 ASP A OD1 1327 O OD2 . ASP A 224 ? 1.4626 1.7965 0.7714 0.4585 0.0761 0.1299 235 ASP A OD2 1328 N N . ALA A 225 ? 1.5832 1.7576 0.8951 0.3862 -0.0098 0.0506 236 ALA A N 1329 C CA . ALA A 225 ? 1.5904 1.7250 0.9060 0.3726 -0.0329 0.0265 236 ALA A CA 1330 C C . ALA A 225 ? 1.5602 1.7100 0.9124 0.3499 -0.0214 0.0392 236 ALA A C 1331 O O . ALA A 225 ? 1.6113 1.7690 0.9888 0.3254 -0.0178 0.0575 236 ALA A O 1332 C CB . ALA A 225 ? 1.5928 1.6931 0.9035 0.3574 -0.0576 0.0171 236 ALA A CB 1333 N N . GLY A 226 ? 1.0120 1.1658 0.3671 0.3588 -0.0161 0.0302 237 GLY A N 1334 C CA . GLY A 226 ? 1.5871 1.7530 0.9750 0.3385 -0.0069 0.0398 237 GLY A CA 1335 C C . GLY A 226 ? 1.4686 1.6850 0.8807 0.3392 0.0237 0.0691 237 GLY A C 1336 O O . GLY A 226 ? 1.4722 1.7048 0.9175 0.3175 0.0338 0.0861 237 GLY A O 1337 N N . ARG A 227 ? 1.4012 1.6433 0.7989 0.3643 0.0379 0.0763 238 ARG A N 1338 C CA . ARG A 227 ? 1.3806 1.6720 0.8038 0.3677 0.0654 0.1031 238 ARG A CA 1339 C C . ARG A 227 ? 1.3535 1.6464 0.7699 0.3868 0.0678 0.0874 238 ARG A C 1340 O O . ARG A 227 ? 1.3795 1.6378 0.7655 0.4035 0.0495 0.0574 238 ARG A O 1341 C CB . ARG A 227 ? 1.4385 1.7620 0.8538 0.3850 0.0803 0.1233 238 ARG A CB 1342 N N . GLY A 228 ? 1.2564 1.5881 0.7035 0.3836 0.0888 0.1081 239 GLY A N 1343 C CA . GLY A 228 ? 1.2082 1.5466 0.6508 0.4033 0.0930 0.0965 239 GLY A CA 1344 C C . GLY A 228 ? 1.1573 1.4991 0.6306 0.3841 0.0967 0.0980 239 GLY A C 1345 O O . GLY A 228 ? 1.0063 1.3698 0.5170 0.3581 0.1078 0.1221 239 GLY A O 1346 N N . VAL A 229 ? 1.1892 1.5076 0.6470 0.3970 0.0860 0.0718 240 VAL A N 1347 C CA . VAL A 229 ? 1.0768 1.4033 0.5610 0.3855 0.0918 0.0726 240 VAL A CA 1348 C C . VAL A 229 ? 1.0029 1.2815 0.4656 0.3900 0.0686 0.0368 240 VAL A C 1349 O O . VAL A 229 ? 1.0950 1.3438 0.5230 0.4117 0.0523 0.0132 240 VAL A O 1350 C CB . VAL A 229 ? 0.9790 1.3530 0.4794 0.4038 0.1142 0.0912 240 VAL A CB 1351 C CG1 . VAL A 229 ? 0.9360 1.2947 0.4193 0.4260 0.1072 0.0667 240 VAL A CG1 1352 C CG2 . VAL A 229 ? 0.9817 1.3962 0.5328 0.3783 0.1335 0.1237 240 VAL A CG2 1353 N N . GLN A 230 ? 0.9338 1.2026 0.4219 0.3676 0.0651 0.0331 241 GLN A N 1354 C CA . GLN A 230 ? 0.9966 1.2212 0.4758 0.3685 0.0430 0.0016 241 GLN A CA 1355 C C . GLN A 230 ? 0.9771 1.2083 0.4970 0.3529 0.0483 0.0030 241 GLN A C 1356 O O . GLN A 230 ? 0.9640 1.2263 0.5274 0.3319 0.0646 0.0272 241 GLN A O 1357 C CB . GLN A 230 ? 0.9222 1.0977 0.3991 0.3490 0.0159 -0.0163 241 GLN A CB 1358 C CG . GLN A 230 ? 0.9582 1.1362 0.4788 0.3114 0.0177 0.0014 241 GLN A CG 1359 C CD . GLN A 230 ? 1.0642 1.2031 0.5734 0.3002 -0.0056 -0.0119 241 GLN A CD 1360 O OE1 . GLN A 230 ? 1.1699 1.3138 0.6972 0.2808 -0.0034 0.0031 241 GLN A OE1 1361 N NE2 . GLN A 230 ? 1.0060 1.1054 0.4864 0.3125 -0.0293 -0.0396 241 GLN A NE2 1362 N N . SER A 231 ? 0.9177 1.1182 0.4227 0.3636 0.0328 -0.0230 242 SER A N 1363 C CA . SER A 231 ? 0.9141 1.1199 0.4510 0.3541 0.0370 -0.0238 242 SER A CA 1364 C C . SER A 231 ? 1.0286 1.1905 0.5874 0.3281 0.0147 -0.0415 242 SER A C 1365 O O . SER A 231 ? 1.1587 1.2812 0.7008 0.3238 -0.0075 -0.0585 242 SER A O 1366 C CB . SER A 231 ? 0.9566 1.1723 0.4625 0.3913 0.0422 -0.0351 242 SER A CB 1367 O OG . SER A 231 ? 1.2157 1.4845 0.7160 0.4118 0.0689 -0.0116 242 SER A OG 1368 N N . PHE A 232 ? 0.9643 1.1355 0.5617 0.3110 0.0207 -0.0358 243 PHE A N 1369 C CA . PHE A 232 ? 0.8207 0.9569 0.4423 0.2869 0.0029 -0.0489 243 PHE A CA 1370 C C . PHE A 232 ? 0.8205 0.9723 0.4701 0.2830 0.0119 -0.0454 243 PHE A C 1371 O O . PHE A 232 ? 0.8410 1.0330 0.4977 0.2941 0.0325 -0.0296 243 PHE A O 1372 C CB . PHE A 232 ? 0.7975 0.9281 0.4507 0.2532 0.0002 -0.0371 243 PHE A CB 1373 C CG . PHE A 232 ? 0.8260 0.9950 0.5169 0.2357 0.0210 -0.0103 243 PHE A CG 1374 C CD1 . PHE A 232 ? 0.8513 1.0527 0.5384 0.2411 0.0369 0.0104 243 PHE A CD1 1375 C CD2 . PHE A 232 ? 0.8131 0.9848 0.5436 0.2137 0.0229 -0.0051 243 PHE A CD2 1376 C CE1 . PHE A 232 ? 0.8963 1.1309 0.6209 0.2236 0.0532 0.0362 243 PHE A CE1 1377 C CE2 . PHE A 232 ? 0.9277 1.1312 0.6930 0.1974 0.0385 0.0188 243 PHE A CE2 1378 C CZ . PHE A 232 ? 0.9079 1.1422 0.6716 0.2016 0.0530 0.0397 243 PHE A CZ 1379 N N . ASN A 233 ? 0.8693 0.9910 0.5361 0.2673 -0.0034 -0.0584 244 ASN A N 1380 C CA . ASN A 233 ? 0.7622 0.8950 0.4553 0.2626 0.0028 -0.0564 244 ASN A CA 1381 C C . ASN A 233 ? 0.7645 0.9067 0.5046 0.2290 0.0080 -0.0410 244 ASN A C 1382 O O . ASN A 233 ? 0.9887 1.1172 0.7403 0.2079 0.0013 -0.0375 244 ASN A O 1383 C CB . ASN A 233 ? 0.8085 0.9033 0.4878 0.2713 -0.0173 -0.0808 244 ASN A CB 1384 C CG . ASN A 233 ? 0.9449 1.0328 0.5782 0.3089 -0.0215 -0.0967 244 ASN A CG 1385 O OD1 . ASN A 233 ? 1.2145 1.2661 0.8167 0.3195 -0.0420 -0.1155 244 ASN A OD1 1386 N ND2 . ASN A 233 ? 0.8906 1.0134 0.5194 0.3303 -0.0029 -0.0891 244 ASN A ND2 1387 N N . ARG A 234 ? 0.8645 1.0296 0.6305 0.2255 0.0191 -0.0320 245 ARG A N 1388 C CA . ARG A 234 ? 0.7095 0.8837 0.5181 0.1963 0.0231 -0.0182 245 ARG A CA 1389 C C . ARG A 234 ? 0.7250 0.9048 0.5517 0.1971 0.0247 -0.0210 245 ARG A C 1390 O O . ARG A 234 ? 0.7593 0.9653 0.5815 0.2163 0.0363 -0.0167 245 ARG A O 1391 C CB . ARG A 234 ? 0.6541 0.8666 0.4812 0.1890 0.0409 0.0075 245 ARG A CB 1392 C CG . ARG A 234 ? 0.7323 0.9436 0.5957 0.1577 0.0396 0.0197 245 ARG A CG 1393 C CD . ARG A 234 ? 0.9152 1.1512 0.8138 0.1477 0.0483 0.0331 245 ARG A CD 1394 N NE . ARG A 234 ? 0.9201 1.1499 0.8499 0.1196 0.0442 0.0421 245 ARG A NE 1395 C CZ . ARG A 234 ? 0.8768 1.1221 0.8226 0.1069 0.0500 0.0610 245 ARG A CZ 1396 N NH1 . ARG A 234 ? 0.9776 1.2481 0.9128 0.1186 0.0613 0.0747 245 ARG A NH1 1397 N NH2 . ARG A 234 ? 0.8126 1.0475 0.7839 0.0835 0.0438 0.0663 245 ARG A NH2 1398 N N . LEU A 235 ? 0.8010 0.9579 0.6479 0.1773 0.0135 -0.0273 246 LEU A N 1399 C CA . LEU A 235 ? 0.6530 0.8118 0.5164 0.1772 0.0130 -0.0308 246 LEU A CA 1400 C C . LEU A 235 ? 0.7160 0.9127 0.6116 0.1685 0.0285 -0.0105 246 LEU A C 1401 O O . LEU A 235 ? 0.7455 0.9512 0.6637 0.1481 0.0320 0.0036 246 LEU A O 1402 C CB . LEU A 235 ? 0.5603 0.6855 0.4358 0.1590 -0.0030 -0.0413 246 LEU A CB 1403 C CG . LEU A 235 ? 0.6669 0.7838 0.5470 0.1656 -0.0084 -0.0511 246 LEU A CG 1404 C CD1 . LEU A 235 ? 0.5481 0.6522 0.3946 0.1934 -0.0146 -0.0670 246 LEU A CD1 1405 C CD2 . LEU A 235 ? 0.4909 0.5792 0.3858 0.1464 -0.0226 -0.0573 246 LEU A CD2 1406 N N . VAL A 236 ? 0.7466 0.9647 0.6446 0.1845 0.0366 -0.0089 247 VAL A N 1407 C CA . VAL A 236 ? 0.7099 0.9657 0.6410 0.1771 0.0498 0.0111 247 VAL A CA 1408 C C . VAL A 236 ? 0.7808 1.0354 0.7258 0.1791 0.0465 0.0048 247 VAL A C 1409 O O . VAL A 236 ? 0.9605 1.1961 0.8838 0.1963 0.0394 -0.0127 247 VAL A O 1410 C CB . VAL A 236 ? 0.7565 1.0553 0.6824 0.1963 0.0681 0.0279 247 VAL A CB 1411 C CG1 . VAL A 236 ? 0.6602 0.9602 0.5699 0.1960 0.0712 0.0345 247 VAL A CG1 1412 C CG2 . VAL A 236 ? 0.7345 1.0387 0.6326 0.2291 0.0715 0.0162 247 VAL A CG2 1413 N N . PRO A 237 ? 0.6108 0.8836 0.5920 0.1614 0.0498 0.0188 248 PRO A N 1414 C CA . PRO A 237 ? 0.5925 0.8650 0.5894 0.1613 0.0462 0.0143 248 PRO A CA 1415 C C . PRO A 237 ? 0.6084 0.9095 0.6010 0.1868 0.0567 0.0166 248 PRO A C 1416 O O . PRO A 237 ? 0.6807 1.0204 0.6790 0.1969 0.0717 0.0337 248 PRO A O 1417 C CB . PRO A 237 ? 0.6046 0.8921 0.6403 0.1361 0.0469 0.0311 248 PRO A CB 1418 C CG . PRO A 237 ? 0.6567 0.9655 0.6995 0.1294 0.0557 0.0491 248 PRO A CG 1419 C CD . PRO A 237 ? 0.6105 0.8979 0.6189 0.1386 0.0535 0.0378 248 PRO A CD 1420 N N . VAL A 238 ? 0.5648 0.8479 0.5485 0.1977 0.0489 0.0008 249 VAL A N 1421 C CA . VAL A 238 ? 0.6664 0.9730 0.6460 0.2230 0.0572 0.0009 249 VAL A CA 1422 C C . VAL A 238 ? 0.7217 1.0145 0.7153 0.2190 0.0478 -0.0077 249 VAL A C 1423 O O . VAL A 238 ? 0.6345 0.8884 0.6221 0.2080 0.0326 -0.0223 249 VAL A O 1424 C CB . VAL A 238 ? 0.5334 0.8283 0.4694 0.2541 0.0571 -0.0146 249 VAL A CB 1425 C CG1 . VAL A 238 ? 0.7521 1.0440 0.6762 0.2787 0.0547 -0.0271 249 VAL A CG1 1426 C CG2 . VAL A 238 ? 0.6169 0.9487 0.5439 0.2686 0.0742 0.0009 249 VAL A CG2 1427 N N . GLU A 239 ? 0.6348 0.9616 0.6487 0.2276 0.0571 0.0033 250 GLU A N 1428 C CA . GLU A 239 ? 0.5935 0.9119 0.6221 0.2252 0.0493 -0.0028 250 GLU A CA 1429 C C . GLU A 239 ? 0.6214 0.9002 0.6193 0.2417 0.0364 -0.0271 250 GLU A C 1430 O O . GLU A 239 ? 0.6449 0.9223 0.6134 0.2692 0.0390 -0.0366 250 GLU A O 1431 C CB . GLU A 239 ? 0.5063 0.8714 0.5585 0.2372 0.0625 0.0133 250 GLU A CB 1432 C CG . GLU A 239 ? 0.6651 1.0257 0.7373 0.2324 0.0546 0.0099 250 GLU A CG 1433 C CD . GLU A 239 ? 0.8161 1.2261 0.9166 0.2420 0.0672 0.0284 250 GLU A CD 1434 O OE1 . GLU A 239 ? 0.7883 1.2113 0.9239 0.2223 0.0639 0.0402 250 GLU A OE1 1435 O OE2 . GLU A 239 ? 0.8733 1.3100 0.9610 0.2701 0.0797 0.0314 250 GLU A OE2 1436 N N . ASP A 240 ? 0.6773 0.9236 0.6818 0.2253 0.0216 -0.0365 251 ASP A N 1437 C CA . ASP A 240 ? 0.6695 0.8775 0.6519 0.2372 0.0070 -0.0568 251 ASP A CA 1438 C C . ASP A 240 ? 0.6395 0.8636 0.6223 0.2608 0.0109 -0.0591 251 ASP A C 1439 O O . ASP A 240 ? 0.6664 0.9222 0.6774 0.2566 0.0191 -0.0455 251 ASP A O 1440 C CB . ASP A 240 ? 0.7644 0.9414 0.7597 0.2128 -0.0075 -0.0611 251 ASP A CB 1441 C CG . ASP A 240 ? 0.9190 1.0515 0.8916 0.2200 -0.0249 -0.0798 251 ASP A CG 1442 O OD1 . ASP A 240 ? 0.8485 0.9738 0.8045 0.2437 -0.0285 -0.0905 251 ASP A OD1 1443 O OD2 . ASP A 240 ? 0.9865 1.0913 0.9585 0.2023 -0.0358 -0.0832 251 ASP A OD2 1444 N N . SER A 241 ? 0.7521 0.9533 0.7036 0.2861 0.0035 -0.0764 252 SER A N 1445 C CA . SER A 241 ? 0.7634 0.9796 0.7097 0.3140 0.0077 -0.0800 252 SER A CA 1446 C C . SER A 241 ? 0.6947 0.8857 0.6499 0.3106 -0.0065 -0.0889 252 SER A C 1447 O O . SER A 241 ? 0.7336 0.9399 0.6931 0.3288 -0.0030 -0.0890 252 SER A O 1448 C CB . SER A 241 ? 0.8981 1.1031 0.8024 0.3478 0.0068 -0.0949 252 SER A CB 1449 O OG . SER A 241 ? 0.9986 1.1512 0.8772 0.3449 -0.0134 -0.1137 252 SER A OG 1450 N N . SER A 242 ? 0.7543 0.9082 0.7127 0.2880 -0.0221 -0.0950 253 SER A N 1451 C CA . SER A 242 ? 0.7918 0.9198 0.7591 0.2822 -0.0365 -0.1015 253 SER A CA 1452 C C . SER A 242 ? 0.7820 0.9413 0.7824 0.2736 -0.0285 -0.0876 253 SER A C 1453 O O . SER A 242 ? 0.7996 0.9883 0.8234 0.2563 -0.0179 -0.0720 253 SER A O 1454 C CB . SER A 242 ? 0.7976 0.8887 0.7668 0.2569 -0.0515 -0.1050 253 SER A CB 1455 O OG . SER A 242 ? 0.7677 0.8438 0.7535 0.2459 -0.0617 -0.1046 253 SER A OG 1456 N N . ASN A 243 ? 0.8181 0.9692 0.8204 0.2858 -0.0354 -0.0935 254 ASN A N 1457 C CA . ASN A 243 ? 0.8339 1.0113 0.8669 0.2785 -0.0308 -0.0817 254 ASN A CA 1458 C C . ASN A 243 ? 0.7513 0.9119 0.8034 0.2492 -0.0404 -0.0771 254 ASN A C 1459 O O . ASN A 243 ? 0.6160 0.7901 0.6904 0.2426 -0.0407 -0.0696 254 ASN A O 1460 C CB . ASN A 243 ? 0.8596 1.0350 0.8871 0.3039 -0.0346 -0.0893 254 ASN A CB 1461 C CG . ASN A 243 ? 1.0677 1.2713 1.0807 0.3356 -0.0214 -0.0901 254 ASN A CG 1462 O OD1 . ASN A 243 ? 1.1640 1.4038 1.1832 0.3360 -0.0053 -0.0780 254 ASN A OD1 1463 N ND2 . ASN A 243 ? 1.0941 1.2818 1.0875 0.3636 -0.0281 -0.1037 254 ASN A ND2 1464 N N . TYR A 244 ? 0.7570 0.8891 0.7995 0.2331 -0.0484 -0.0812 255 TYR A N 1465 C CA . TYR A 244 ? 0.7587 0.8761 0.8162 0.2076 -0.0564 -0.0764 255 TYR A CA 1466 C C . TYR A 244 ? 0.7147 0.8396 0.7775 0.1874 -0.0506 -0.0685 255 TYR A C 1467 O O . TYR A 244 ? 0.6202 0.7254 0.6852 0.1692 -0.0579 -0.0677 255 TYR A O 1468 C CB . TYR A 244 ? 0.8517 0.9255 0.8961 0.2067 -0.0738 -0.0870 255 TYR A CB 1469 C CG . TYR A 244 ? 0.8201 0.8831 0.8619 0.2243 -0.0818 -0.0939 255 TYR A CG 1470 C CD1 . TYR A 244 ? 0.7191 0.7650 0.7378 0.2488 -0.0876 -0.1073 255 TYR A CD1 1471 C CD2 . TYR A 244 ? 0.7682 0.8375 0.8294 0.2178 -0.0845 -0.0873 255 TYR A CD2 1472 C CE1 . TYR A 244 ? 0.6182 0.6523 0.6338 0.2662 -0.0960 -0.1140 255 TYR A CE1 1473 C CE2 . TYR A 244 ? 0.7690 0.8285 0.8284 0.2341 -0.0920 -0.0930 255 TYR A CE2 1474 C CZ . TYR A 244 ? 0.7085 0.7501 0.7456 0.2583 -0.0978 -0.1063 255 TYR A CZ 1475 O OH . TYR A 244 ? 0.7664 0.7960 0.8011 0.2757 -0.1065 -0.1125 255 TYR A OH 1476 N N . ALA A 245 ? 0.7922 0.9473 0.8576 0.1918 -0.0371 -0.0616 256 ALA A N 1477 C CA . ALA A 245 ? 0.8079 0.9709 0.8773 0.1749 -0.0314 -0.0538 256 ALA A CA 1478 C C . ALA A 245 ? 0.6931 0.8883 0.7913 0.1608 -0.0240 -0.0382 256 ALA A C 1479 O O . ALA A 245 ? 0.4801 0.6992 0.5857 0.1569 -0.0141 -0.0282 256 ALA A O 1480 C CB . ALA A 245 ? 0.6908 0.8613 0.7410 0.1889 -0.0232 -0.0563 256 ALA A CB 1481 N N . TYR A 246 ? 0.5261 0.7208 0.6409 0.1529 -0.0301 -0.0355 257 TYR A N 1482 C CA . TYR A 246 ? 0.4359 0.6572 0.5783 0.1394 -0.0271 -0.0218 257 TYR A CA 1483 C C . TYR A 246 ? 0.5193 0.7219 0.6673 0.1180 -0.0365 -0.0209 257 TYR A C 1484 O O . TYR A 246 ? 0.5520 0.7265 0.6887 0.1157 -0.0454 -0.0290 257 TYR A O 1485 C CB . TYR A 246 ? 0.4463 0.6894 0.6055 0.1499 -0.0262 -0.0176 257 TYR A CB 1486 C CG . TYR A 246 ? 0.5932 0.8632 0.7502 0.1728 -0.0148 -0.0153 257 TYR A CG 1487 C CD1 . TYR A 246 ? 0.7922 1.0467 0.9267 0.1952 -0.0162 -0.0283 257 TYR A CD1 1488 C CD2 . TYR A 246 ? 0.5016 0.8128 0.6794 0.1730 -0.0032 0.0007 257 TYR A CD2 1489 C CE1 . TYR A 246 ? 0.8179 1.0971 0.9468 0.2196 -0.0055 -0.0271 257 TYR A CE1 1490 C CE2 . TYR A 246 ? 0.7698 1.1098 0.9452 0.1961 0.0090 0.0047 257 TYR A CE2 1491 C CZ . TYR A 246 ? 0.8507 1.1746 0.9999 0.2206 0.0083 -0.0100 257 TYR A CZ 1492 O OH . TYR A 246 ? 0.7468 1.0995 0.8901 0.2471 0.0208 -0.0068 257 TYR A OH 1493 N N . PHE A 247 ? 0.5584 0.7773 0.7241 0.1033 -0.0350 -0.0102 258 PHE A N 1494 C CA . PHE A 247 ? 0.5091 0.7114 0.6779 0.0855 -0.0440 -0.0097 258 PHE A CA 1495 C C . PHE A 247 ? 0.3981 0.6226 0.5915 0.0730 -0.0449 0.0028 258 PHE A C 1496 O O . PHE A 247 ? 0.4710 0.7230 0.6786 0.0748 -0.0370 0.0129 258 PHE A O 1497 C CB . PHE A 247 ? 0.4772 0.6568 0.6275 0.0787 -0.0443 -0.0147 258 PHE A CB 1498 C CG . PHE A 247 ? 0.5513 0.7453 0.7049 0.0737 -0.0366 -0.0075 258 PHE A CG 1499 C CD1 . PHE A 247 ? 0.5671 0.7598 0.7291 0.0577 -0.0400 -0.0015 258 PHE A CD1 1500 C CD2 . PHE A 247 ? 0.5738 0.7821 0.7209 0.0864 -0.0267 -0.0066 258 PHE A CD2 1501 C CE1 . PHE A 247 ? 0.6016 0.8068 0.7680 0.0525 -0.0338 0.0065 258 PHE A CE1 1502 C CE2 . PHE A 247 ? 0.5689 0.7921 0.7192 0.0821 -0.0192 0.0019 258 PHE A CE2 1503 C CZ . PHE A 247 ? 0.4920 0.7135 0.6531 0.0642 -0.0229 0.0090 258 PHE A CZ 1504 N N . ILE A 248 ? 0.4163 0.6289 0.6148 0.0610 -0.0556 0.0027 259 ILE A N 1505 C CA . ILE A 248 ? 0.3090 0.5328 0.5271 0.0467 -0.0608 0.0125 259 ILE A CA 1506 C C . ILE A 248 ? 0.4143 0.6116 0.6186 0.0353 -0.0680 0.0076 259 ILE A C 1507 O O . ILE A 248 ? 0.3827 0.5564 0.5665 0.0381 -0.0698 -0.0018 259 ILE A O 1508 C CB . ILE A 248 ? 0.3087 0.5457 0.5484 0.0443 -0.0698 0.0178 259 ILE A CB 1509 C CG1 . ILE A 248 ? 0.3764 0.5914 0.6023 0.0481 -0.0782 0.0078 259 ILE A CG1 1510 C CG2 . ILE A 248 ? 0.3104 0.5808 0.5696 0.0545 -0.0617 0.0266 259 ILE A CG2 1511 C CD1 . ILE A 248 ? 0.6201 0.8467 0.8649 0.0468 -0.0880 0.0122 259 ILE A CD1 1512 N N . VAL A 249 ? 0.3628 0.5644 0.5793 0.0230 -0.0723 0.0149 260 VAL A N 1513 C CA . VAL A 249 ? 0.4493 0.6258 0.6519 0.0142 -0.0796 0.0099 260 VAL A CA 1514 C C . VAL A 249 ? 0.4465 0.6168 0.6593 0.0053 -0.0952 0.0114 260 VAL A C 1515 O O . VAL A 249 ? 0.5233 0.7114 0.7611 -0.0013 -0.1008 0.0211 260 VAL A O 1516 C CB . VAL A 249 ? 0.5181 0.6933 0.7160 0.0091 -0.0730 0.0131 260 VAL A CB 1517 C CG1 . VAL A 249 ? 0.3200 0.5225 0.5294 0.0143 -0.0606 0.0220 260 VAL A CG1 1518 C CG2 . VAL A 249 ? 0.4641 0.6314 0.6699 -0.0042 -0.0836 0.0175 260 VAL A CG2 1519 N N . LYS A 250 ? 0.5464 0.6919 0.7396 0.0060 -0.1028 0.0022 261 LYS A N 1520 C CA . LYS A 250 ? 0.4980 0.6324 0.6925 0.0019 -0.1190 0.0000 261 LYS A CA 1521 C C . LYS A 250 ? 0.4333 0.5699 0.6455 -0.0103 -0.1300 0.0069 261 LYS A C 1522 O O . LYS A 250 ? 0.5346 0.6777 0.7650 -0.0151 -0.1429 0.0111 261 LYS A O 1523 C CB . LYS A 250 ? 0.6757 0.7836 0.8417 0.0066 -0.1224 -0.0098 261 LYS A CB 1524 C CG . LYS A 250 ? 0.8264 0.9186 0.9856 0.0053 -0.1397 -0.0142 261 LYS A CG 1525 C CD . LYS A 250 ? 0.9671 1.0387 1.0966 0.0140 -0.1394 -0.0221 261 LYS A CD 1526 C CE . LYS A 250 ? 1.1194 1.1735 1.2360 0.0162 -0.1566 -0.0278 261 LYS A CE 1527 N NZ . LYS A 250 ? 1.0507 1.0903 1.1633 0.0103 -0.1653 -0.0299 261 LYS A NZ 1528 N N . GLU A 251 ? 0.3293 0.4601 0.5376 -0.0158 -0.1262 0.0088 262 GLU A N 1529 C CA . GLU A 251 ? 0.3372 0.4665 0.5620 -0.0281 -0.1378 0.0160 262 GLU A CA 1530 C C . GLU A 251 ? 0.3335 0.4937 0.5943 -0.0353 -0.1375 0.0317 262 GLU A C 1531 O O . GLU A 251 ? 0.5332 0.6948 0.8153 -0.0469 -0.1514 0.0402 262 GLU A O 1532 C CB . GLU A 251 ? 0.5548 0.6723 0.7675 -0.0315 -0.1323 0.0156 262 GLU A CB 1533 C CG . GLU A 251 ? 0.7884 0.8766 0.9688 -0.0253 -0.1345 0.0025 262 GLU A CG 1534 C CD . GLU A 251 ? 0.7824 0.8704 0.9433 -0.0142 -0.1202 -0.0039 262 GLU A CD 1535 O OE1 . GLU A 251 ? 0.6827 0.7895 0.8521 -0.0105 -0.1090 -0.0003 262 GLU A OE1 1536 O OE2 . GLU A 251 ? 0.7554 0.8243 0.8929 -0.0084 -0.1209 -0.0120 262 GLU A OE2 1537 N N . GLU A 252 ? 0.4353 0.6206 0.7037 -0.0277 -0.1223 0.0363 263 GLU A N 1538 C CA . GLU A 252 ? 0.4815 0.7018 0.7841 -0.0316 -0.1187 0.0532 263 GLU A CA 1539 C C . GLU A 252 ? 0.4606 0.6936 0.7803 -0.0294 -0.1271 0.0552 263 GLU A C 1540 O O . GLU A 252 ? 0.3957 0.6606 0.7464 -0.0314 -0.1250 0.0700 263 GLU A O 1541 C CB . GLU A 252 ? 0.4657 0.7082 0.7658 -0.0222 -0.0969 0.0580 263 GLU A CB 1542 C CG . GLU A 252 ? 0.5778 0.8097 0.8634 -0.0253 -0.0897 0.0578 263 GLU A CG 1543 C CD . GLU A 252 ? 0.5951 0.8436 0.8709 -0.0136 -0.0699 0.0593 263 GLU A CD 1544 O OE1 . GLU A 252 ? 0.5626 0.8393 0.8513 -0.0047 -0.0608 0.0663 263 GLU A OE1 1545 O OE2 . GLU A 252 ? 0.4158 0.6487 0.6701 -0.0123 -0.0640 0.0532 263 GLU A OE2 1546 N N . CYS A 253 ? 0.5736 0.7829 0.8732 -0.0247 -0.1365 0.0414 264 CYS A N 1547 C CA . CYS A 253 ? 0.5859 0.8017 0.8982 -0.0229 -0.1478 0.0416 264 CYS A CA 1548 C C . CYS A 253 ? 0.5582 0.7572 0.8794 -0.0349 -0.1722 0.0419 264 CYS A C 1549 O O . CYS A 253 ? 0.6654 0.8341 0.9611 -0.0324 -0.1835 0.0286 264 CYS A O 1550 C CB . CYS A 253 ? 0.5459 0.7453 0.8297 -0.0098 -0.1444 0.0272 264 CYS A CB 1551 S SG . CYS A 253 ? 0.9512 1.1603 1.2476 -0.0045 -0.1553 0.0273 264 CYS A SG 1552 N N . LYS A 254 ? 0.4732 0.6917 0.8305 -0.0473 -0.1810 0.0577 265 LYS A N 1553 C CA . LYS A 254 ? 0.5048 0.7038 0.8721 -0.0605 -0.2066 0.0589 265 LYS A CA 1554 C C . LYS A 254 ? 0.5908 0.7848 0.9664 -0.0609 -0.2276 0.0557 265 LYS A C 1555 O O . LYS A 254 ? 0.4604 0.6257 0.8278 -0.0660 -0.2512 0.0481 265 LYS A O 1556 C CB . LYS A 254 ? 0.5642 0.7841 0.9691 -0.0758 -0.2095 0.0794 265 LYS A CB 1557 C CG . LYS A 254 ? 0.5532 0.7799 0.9507 -0.0753 -0.1893 0.0841 265 LYS A CG 1558 C CD . LYS A 254 ? 0.7114 0.8991 1.0695 -0.0722 -0.1904 0.0669 265 LYS A CD 1559 C CE . LYS A 254 ? 0.9532 1.1118 1.3142 -0.0844 -0.2162 0.0653 265 LYS A CE 1560 N NZ . LYS A 254 ? 0.8928 1.0155 1.2149 -0.0791 -0.2163 0.0491 265 LYS A NZ 1561 N N . ASN A 255 ? 0.6276 0.8489 1.0184 -0.0543 -0.2197 0.0612 266 ASN A N 1562 C CA . ASN A 255 ? 0.3810 0.5997 0.7768 -0.0519 -0.2367 0.0574 266 ASN A CA 1563 C C . ASN A 255 ? 0.4139 0.6365 0.7876 -0.0349 -0.2209 0.0480 266 ASN A C 1564 O O . ASN A 255 ? 0.4240 0.6654 0.7965 -0.0272 -0.1981 0.0512 266 ASN A O 1565 C CB . ASN A 255 ? 0.4256 0.6788 0.8718 -0.0624 -0.2462 0.0777 266 ASN A CB 1566 C CG . ASN A 255 ? 0.5407 0.7849 1.0123 -0.0811 -0.2707 0.0873 266 ASN A CG 1567 O OD1 . ASN A 255 ? 0.4620 0.6771 0.9148 -0.0860 -0.2771 0.0801 266 ASN A OD1 1568 N ND2 . ASN A 255 ? 0.4272 0.6957 0.9422 -0.0916 -0.2849 0.1044 266 ASN A ND2 1569 N N . GLY A 256 ? 0.4365 0.6398 0.7915 -0.0284 -0.2339 0.0364 267 GLY A N 1570 C CA . GLY A 256 ? 0.3759 0.5815 0.7121 -0.0132 -0.2216 0.0290 267 GLY A CA 1571 C C . GLY A 256 ? 0.5449 0.7295 0.8421 -0.0033 -0.2061 0.0168 267 GLY A C 1572 O O . GLY A 256 ? 0.3916 0.5503 0.6658 -0.0053 -0.2106 0.0088 267 GLY A O 1573 N N . SER A 257 ? 0.5592 0.7553 0.8505 0.0079 -0.1886 0.0160 268 SER A N 1574 C CA . SER A 257 ? 0.4633 0.6408 0.7214 0.0173 -0.1756 0.0061 268 SER A CA 1575 C C . SER A 257 ? 0.4888 0.6845 0.7516 0.0251 -0.1555 0.0094 268 SER A C 1576 O O . SER A 257 ? 0.6095 0.8330 0.8991 0.0243 -0.1500 0.0192 268 SER A O 1577 C CB . SER A 257 ? 0.6005 0.7611 0.8367 0.0264 -0.1836 -0.0022 268 SER A CB 1578 O OG . SER A 257 ? 0.6820 0.8606 0.9365 0.0309 -0.1872 0.0024 268 SER A OG 1579 N N . TYR A 258 ? 0.4821 0.6624 0.7192 0.0336 -0.1454 0.0017 269 TYR A N 1580 C CA . TYR A 258 ? 0.4095 0.6000 0.6459 0.0428 -0.1293 0.0022 269 TYR A CA 1581 C C . TYR A 258 ? 0.4604 0.6740 0.7168 0.0506 -0.1282 0.0073 269 TYR A C 1582 O O . TYR A 258 ? 0.6232 0.8577 0.8923 0.0559 -0.1170 0.0122 269 TYR A O 1583 C CB . TYR A 258 ? 0.3940 0.5613 0.6021 0.0501 -0.1243 -0.0061 269 TYR A CB 1584 C CG . TYR A 258 ? 0.4852 0.6564 0.6900 0.0601 -0.1118 -0.0076 269 TYR A CG 1585 C CD1 . TYR A 258 ? 0.4165 0.5928 0.6249 0.0707 -0.1119 -0.0080 269 TYR A CD1 1586 C CD2 . TYR A 258 ? 0.5407 0.7083 0.7372 0.0598 -0.1015 -0.0092 269 TYR A CD2 1587 C CE1 . TYR A 258 ? 0.4163 0.5923 0.6197 0.0813 -0.1030 -0.0108 269 TYR A CE1 1588 C CE2 . TYR A 258 ? 0.5992 0.7670 0.7900 0.0703 -0.0928 -0.0121 269 TYR A CE2 1589 C CZ . TYR A 258 ? 0.5595 0.7304 0.7534 0.0813 -0.0941 -0.0133 269 TYR A CZ 1590 O OH . TYR A 258 ? 0.6551 0.8224 0.8414 0.0933 -0.0879 -0.0176 269 TYR A OH 1591 N N . GLU A 259 ? 0.6281 0.8385 0.8861 0.0528 -0.1399 0.0062 270 GLU A N 1592 C CA . GLU A 259 ? 0.7206 0.9517 0.9970 0.0611 -0.1403 0.0108 270 GLU A CA 1593 C C . GLU A 259 ? 0.5788 0.8436 0.8890 0.0572 -0.1380 0.0228 270 GLU A C 1594 O O . GLU A 259 ? 0.6651 0.9529 0.9891 0.0674 -0.1289 0.0277 270 GLU A O 1595 C CB . GLU A 259 ? 0.7885 1.0106 1.0622 0.0618 -0.1560 0.0087 270 GLU A CB 1596 C CG . GLU A 259 ? 0.8636 1.1050 1.1548 0.0712 -0.1574 0.0130 270 GLU A CG 1597 C CD . GLU A 259 ? 1.0123 1.2462 1.2885 0.0855 -0.1471 0.0082 270 GLU A CD 1598 O OE1 . GLU A 259 ? 1.0535 1.2657 1.3060 0.0869 -0.1407 0.0018 270 GLU A OE1 1599 O OE2 . GLU A 259 ? 0.9694 1.2187 1.2589 0.0954 -0.1466 0.0112 270 GLU A OE2 1600 N N . THR A 260 ? 0.4763 0.7445 0.8002 0.0431 -0.1467 0.0285 271 THR A N 1601 C CA . THR A 260 ? 0.5991 0.9012 0.9596 0.0369 -0.1461 0.0436 271 THR A CA 1602 C C . THR A 260 ? 0.6234 0.9379 0.9868 0.0355 -0.1303 0.0494 271 THR A C 1603 O O . THR A 260 ? 0.5885 0.9373 0.9776 0.0383 -0.1210 0.0625 271 THR A O 1604 C CB . THR A 260 ? 0.6430 0.9432 1.0227 0.0211 -0.1675 0.0494 271 THR A CB 1605 O OG1 . THR A 260 ? 0.6457 0.9122 1.0001 0.0135 -0.1756 0.0395 271 THR A OG1 1606 C CG2 . THR A 260 ? 0.3454 0.6456 0.7319 0.0240 -0.1829 0.0481 271 THR A CG2 1607 N N . CYS A 261 ? 0.4391 0.7273 0.7759 0.0323 -0.1269 0.0404 272 CYS A N 1608 C CA . CYS A 261 ? 0.4183 0.7145 0.7557 0.0292 -0.1144 0.0454 272 CYS A CA 1609 C C . CYS A 261 ? 0.5807 0.8837 0.9037 0.0449 -0.0955 0.0417 272 CYS A C 1610 O O . CYS A 261 ? 0.5699 0.8876 0.8963 0.0460 -0.0835 0.0480 272 CYS A O 1611 C CB . CYS A 261 ? 0.4528 0.7183 0.7693 0.0189 -0.1202 0.0380 272 CYS A CB 1612 S SG . CYS A 261 ? 0.6279 0.8881 0.9645 -0.0001 -0.1418 0.0450 272 CYS A SG 1613 N N . LYS A 262 ? 0.5549 0.8460 0.8611 0.0576 -0.0941 0.0318 273 LYS A N 1614 C CA . LYS A 262 ? 0.5833 0.8743 0.8728 0.0735 -0.0800 0.0259 273 LYS A CA 1615 C C . LYS A 262 ? 0.6009 0.9301 0.9117 0.0853 -0.0691 0.0365 273 LYS A C 1616 O O . LYS A 262 ? 0.6317 0.9649 0.9295 0.1008 -0.0571 0.0327 273 LYS A O 1617 C CB . LYS A 262 ? 0.5148 0.7810 0.7833 0.0829 -0.0841 0.0138 273 LYS A CB 1618 C CG . LYS A 262 ? 0.5102 0.7874 0.7938 0.0880 -0.0918 0.0165 273 LYS A CG 1619 C CD . LYS A 262 ? 0.7055 0.9565 0.9681 0.0962 -0.0964 0.0061 273 LYS A CD 1620 C CE . LYS A 262 ? 0.7851 1.0481 1.0621 0.1034 -0.1033 0.0090 273 LYS A CE 1621 N NZ . LYS A 262 ? 0.8346 1.0714 1.0921 0.1102 -0.1088 0.0007 273 LYS A NZ 1622 N N . ALA A 263 ? 0.4587 0.8161 0.8021 0.0788 -0.0742 0.0503 274 ALA A N 1623 C CA . ALA A 263 ? 0.3552 0.7553 0.7242 0.0895 -0.0638 0.0643 274 ALA A CA 1624 C C . ALA A 263 ? 0.5178 0.9393 0.8922 0.0892 -0.0500 0.0748 274 ALA A C 1625 O O . ALA A 263 ? 0.6188 1.0763 1.0073 0.1025 -0.0368 0.0860 274 ALA A O 1626 C CB . ALA A 263 ? 0.3165 0.7412 0.7227 0.0801 -0.0753 0.0782 274 ALA A CB 1627 N N . ASN A 264 ? 0.4747 0.8751 0.8372 0.0754 -0.0526 0.0719 275 ASN A N 1628 C CA . ASN A 264 ? 0.4349 0.8526 0.8004 0.0742 -0.0403 0.0818 275 ASN A CA 1629 C C . ASN A 264 ? 0.5004 0.8846 0.8294 0.0754 -0.0362 0.0671 275 ASN A C 1630 O O . ASN A 264 ? 0.4190 0.7886 0.7453 0.0602 -0.0408 0.0680 275 ASN A O 1631 C CB . ASN A 264 ? 0.4740 0.9072 0.8718 0.0530 -0.0487 0.0994 275 ASN A CB 1632 C CG . ASN A 264 ? 0.7694 1.2311 1.2060 0.0480 -0.0579 0.1140 275 ASN A CG 1633 O OD1 . ASN A 264 ? 0.8748 1.3180 1.3168 0.0368 -0.0759 0.1092 275 ASN A OD1 1634 N ND2 . ASN A 264 ? 0.8528 1.3608 1.3162 0.0574 -0.0456 0.1323 275 ASN A ND2 1635 N N . PRO A 265 ? 0.5371 0.9081 0.8385 0.0938 -0.0289 0.0535 276 PRO A N 1636 C CA . PRO A 265 ? 0.3947 0.7333 0.6630 0.0947 -0.0269 0.0397 276 PRO A CA 1637 C C . PRO A 265 ? 0.3854 0.7392 0.6500 0.0971 -0.0145 0.0471 276 PRO A C 1638 O O . PRO A 265 ? 0.4582 0.8493 0.7394 0.1057 -0.0035 0.0609 276 PRO A O 1639 C CB . PRO A 265 ? 0.3371 0.6601 0.5822 0.1144 -0.0251 0.0253 276 PRO A CB 1640 C CG . PRO A 265 ? 0.3433 0.7017 0.6067 0.1299 -0.0181 0.0340 276 PRO A CG 1641 C CD . PRO A 265 ? 0.4735 0.8575 0.7734 0.1148 -0.0237 0.0502 276 PRO A CD 1642 N N . LYS A 266 ? 0.4669 0.7935 0.7102 0.0898 -0.0160 0.0390 277 LYS A N 1643 C CA . LYS A 266 ? 0.4228 0.7572 0.6547 0.0946 -0.0048 0.0424 277 LYS A CA 1644 C C . LYS A 266 ? 0.4584 0.7706 0.6562 0.1126 -0.0016 0.0255 277 LYS A C 1645 O O . LYS A 266 ? 0.5209 0.8048 0.7050 0.1144 -0.0104 0.0119 277 LYS A O 1646 C CB . LYS A 266 ? 0.3590 0.6775 0.5905 0.0749 -0.0099 0.0449 277 LYS A CB 1647 C CG . LYS A 266 ? 0.4819 0.8264 0.7472 0.0594 -0.0118 0.0646 277 LYS A CG 1648 C CD . LYS A 266 ? 0.5057 0.8252 0.7718 0.0388 -0.0238 0.0635 277 LYS A CD 1649 C CE . LYS A 266 ? 0.5276 0.8211 0.7645 0.0389 -0.0209 0.0531 277 LYS A CE 1650 N NZ . LYS A 266 ? 0.4761 0.7485 0.7148 0.0208 -0.0316 0.0534 277 LYS A NZ 1651 N N . LYS A 267 ? 0.3580 0.6825 0.5421 0.1266 0.0099 0.0269 278 LYS A N 1652 C CA . LYS A 267 ? 0.5125 0.8133 0.6629 0.1447 0.0102 0.0100 278 LYS A CA 1653 C C . LYS A 267 ? 0.4447 0.7188 0.5735 0.1370 0.0076 0.0028 278 LYS A C 1654 O O . LYS A 267 ? 0.5251 0.8101 0.6616 0.1254 0.0120 0.0133 278 LYS A O 1655 C CB . LYS A 267 ? 0.5169 0.8453 0.6596 0.1711 0.0229 0.0126 278 LYS A CB 1656 C CG . LYS A 267 ? 0.5097 0.8186 0.6306 0.1928 0.0182 -0.0043 278 LYS A CG 1657 C CD . LYS A 267 ? 0.7608 1.1007 0.8753 0.2216 0.0310 -0.0010 278 LYS A CD 1658 C CE . LYS A 267 ? 0.8688 1.1835 0.9581 0.2446 0.0239 -0.0199 278 LYS A CE 1659 N NZ . LYS A 267 ? 0.9275 1.1938 0.9864 0.2426 0.0114 -0.0385 278 LYS A NZ 1660 N N . ASP A 268 ? 0.5551 0.7940 0.6588 0.1428 -0.0006 -0.0140 279 ASP A N 1661 C CA . ASP A 268 ? 0.5685 0.7810 0.6529 0.1355 -0.0047 -0.0209 279 ASP A CA 1662 C C . ASP A 268 ? 0.6442 0.8713 0.7145 0.1466 0.0056 -0.0176 279 ASP A C 1663 O O . ASP A 268 ? 0.7619 1.0181 0.8334 0.1632 0.0164 -0.0113 279 ASP A O 1664 C CB . ASP A 268 ? 0.5595 0.7339 0.6226 0.1410 -0.0167 -0.0377 279 ASP A CB 1665 C CG . ASP A 268 ? 0.7260 0.8796 0.7990 0.1240 -0.0275 -0.0392 279 ASP A CG 1666 O OD1 . ASP A 268 ? 0.6862 0.8131 0.7486 0.1156 -0.0352 -0.0448 279 ASP A OD1 1667 O OD2 . ASP A 268 ? 0.8389 1.0041 0.9303 0.1201 -0.0284 -0.0341 279 ASP A OD2 1668 N N . VAL A 269 ? 0.5407 0.7485 0.5970 0.1384 0.0025 -0.0212 280 VAL A N 1669 C CA . VAL A 269 ? 0.4150 0.6332 0.4554 0.1479 0.0110 -0.0185 280 VAL A CA 1670 C C . VAL A 269 ? 0.5914 0.7736 0.6010 0.1545 0.0014 -0.0351 280 VAL A C 1671 O O . VAL A 269 ? 0.5504 0.7028 0.5588 0.1423 -0.0107 -0.0428 280 VAL A O 1672 C CB . VAL A 269 ? 0.3973 0.6317 0.4553 0.1290 0.0166 -0.0027 280 VAL A CB 1673 C CG1 . VAL A 269 ? 0.4375 0.6440 0.4806 0.1179 0.0098 -0.0088 280 VAL A CG1 1674 C CG2 . VAL A 269 ? 0.4053 0.6788 0.4687 0.1396 0.0316 0.0126 280 VAL A CG2 1675 N N . VAL A 270 ? 0.4580 0.6432 0.4427 0.1749 0.0057 -0.0402 281 VAL A N 1676 C CA . VAL A 270 ? 0.6669 0.8178 0.6232 0.1796 -0.0054 -0.0548 281 VAL A CA 1677 C C . VAL A 270 ? 0.6986 0.8609 0.6384 0.1861 0.0025 -0.0504 281 VAL A C 1678 O O . VAL A 270 ? 0.7393 0.9375 0.6859 0.1925 0.0177 -0.0366 281 VAL A O 1679 C CB . VAL A 270 ? 0.5069 0.6333 0.4394 0.2013 -0.0162 -0.0728 281 VAL A CB 1680 C CG1 . VAL A 270 ? 2.0343 2.1399 1.9812 0.1913 -0.0280 -0.0780 281 VAL A CG1 1681 C CG2 . VAL A 270 ? 0.5294 0.6827 0.4511 0.2291 -0.0048 -0.0722 281 VAL A CG2 1682 N N . GLY A 271 ? 0.5834 0.7160 0.5031 0.1839 -0.0082 -0.0605 282 GLY A N 1683 C CA . GLY A 271 ? 0.6361 0.7754 0.5375 0.1899 -0.0028 -0.0575 282 GLY A CA 1684 C C . GLY A 271 ? 0.8806 1.0107 0.7449 0.2194 -0.0059 -0.0712 282 GLY A C 1685 O O . GLY A 271 ? 0.8291 0.9245 0.6751 0.2275 -0.0223 -0.0887 282 GLY A O 1686 N N . LYS A 272 ? 1.0119 1.1736 0.8654 0.2362 0.0095 -0.0622 283 LYS A N 1687 C CA . LYS A 272 ? 0.9845 1.1391 0.7974 0.2645 0.0078 -0.0735 283 LYS A CA 1688 C C . LYS A 272 ? 0.9537 1.1242 0.7618 0.2588 0.0167 -0.0612 283 LYS A C 1689 O O . LYS A 272 ? 0.8789 1.0822 0.7139 0.2446 0.0312 -0.0404 283 LYS A O 1690 C CB . LYS A 272 ? 0.9337 1.1170 0.7352 0.2950 0.0204 -0.0724 283 LYS A CB 1691 C CG . LYS A 272 ? 0.8923 1.1296 0.7230 0.2913 0.0434 -0.0467 283 LYS A CG 1692 C CD . LYS A 272 ? 0.9612 1.2336 0.7687 0.3247 0.0600 -0.0404 283 LYS A CD 1693 C CE . LYS A 272 ? 1.0734 1.3411 0.8597 0.3560 0.0574 -0.0556 283 LYS A CE 1694 N NZ . LYS A 272 ? 1.0581 1.3639 0.8206 0.3919 0.0752 -0.0484 283 LYS A NZ 1695 N N . ASP A 273 ? 0.9592 1.1050 0.7346 0.2686 0.0064 -0.0733 284 ASP A N 1696 C CA . ASP A 273 ? 0.9611 1.1227 0.7312 0.2642 0.0150 -0.0609 284 ASP A CA 1697 C C . ASP A 273 ? 0.8781 1.0764 0.6270 0.2930 0.0328 -0.0521 284 ASP A C 1698 O O . ASP A 273 ? 0.6880 0.8907 0.4163 0.3209 0.0347 -0.0613 284 ASP A O 1699 C CB . ASP A 273 ? 1.0417 1.1644 0.7910 0.2578 -0.0033 -0.0740 284 ASP A CB 1700 C CG . ASP A 273 ? 1.0690 1.1530 0.7837 0.2785 -0.0232 -0.0990 284 ASP A CG 1701 O OD1 . ASP A 273 ? 1.0202 1.0664 0.7307 0.2665 -0.0434 -0.1105 284 ASP A OD1 1702 O OD2 . ASP A 273 ? 1.2320 1.3233 0.9245 0.3072 -0.0197 -0.1067 284 ASP A OD2 1703 N N . GLU A 274 ? 0.6516 0.8779 0.4066 0.2870 0.0464 -0.0328 285 GLU A N 1704 C CA . GLU A 274 ? 1.1095 1.3749 0.8455 0.3141 0.0649 -0.0205 285 GLU A CA 1705 C C . GLU A 274 ? 1.0960 1.3596 0.8072 0.3181 0.0653 -0.0171 285 GLU A C 1706 O O . GLU A 274 ? 1.0307 1.2849 0.7590 0.2917 0.0612 -0.0097 285 GLU A O 1707 C CB . GLU A 274 ? 0.6527 0.9703 0.4280 0.3065 0.0865 0.0077 285 GLU A CB 1708 C CG . GLU A 274 ? 1.1938 1.5272 1.0048 0.2749 0.0922 0.0305 285 GLU A CG 1709 C CD . GLU A 274 ? 1.1837 1.5705 1.0321 0.2704 0.1121 0.0603 285 GLU A CD 1710 O OE1 . GLU A 274 ? 1.1173 1.5236 0.9756 0.2824 0.1185 0.0617 285 GLU A OE1 1711 O OE2 . GLU A 274 ? 1.1472 1.5563 1.0163 0.2546 0.1203 0.0832 285 GLU A OE2 1712 N N . ARG A 275 ? 1.1358 1.4068 0.8042 0.3530 0.0696 -0.0234 286 ARG A N 1713 C CA . ARG A 275 ? 1.1423 1.4135 0.7815 0.3619 0.0705 -0.0205 286 ARG A CA 1714 C C . ARG A 275 ? 1.0404 1.3549 0.7098 0.3451 0.0902 0.0120 286 ARG A C 1715 O O . ARG A 275 ? 1.0071 1.3677 0.7004 0.3484 0.1102 0.0344 286 ARG A O 1716 C CB . ARG A 275 ? 1.3450 1.6232 0.9318 0.4069 0.0743 -0.0310 286 ARG A CB 1717 C CG . ARG A 275 ? 1.4477 1.6710 0.9912 0.4246 0.0479 -0.0657 286 ARG A CG 1718 C CD . ARG A 275 ? 1.2833 1.4803 0.7940 0.4270 0.0344 -0.0745 286 ARG A CD 1719 N NE . ARG A 275 ? 1.3870 1.5338 0.9084 0.3994 0.0084 -0.0904 286 ARG A NE 1720 C CZ . ARG A 275 ? 1.5657 1.6790 1.0612 0.3989 -0.0104 -0.1031 286 ARG A CZ 1721 N NH1 . ARG A 275 ? 1.6630 1.7849 1.1174 0.4250 -0.0068 -0.1033 286 ARG A NH1 1722 N NH2 . ARG A 275 ? 1.5290 1.6015 1.0404 0.3727 -0.0328 -0.1144 286 ARG A NH2 1723 N N . GLN A 276 ? 1.0256 1.3247 0.6957 0.3265 0.0834 0.0154 287 GLN A N 1724 C CA . GLN A 276 ? 1.0375 1.3721 0.7327 0.3110 0.0992 0.0455 287 GLN A CA 1725 C C . GLN A 276 ? 1.0640 1.3910 0.7245 0.3213 0.0965 0.0449 287 GLN A C 1726 O O . GLN A 276 ? 1.0014 1.2853 0.6343 0.3229 0.0767 0.0217 287 GLN A O 1727 C CB . GLN A 276 ? 1.0060 1.3307 0.7491 0.2702 0.0936 0.0544 287 GLN A CB 1728 C CG . GLN A 276 ? 1.0730 1.4080 0.8524 0.2587 0.0966 0.0577 287 GLN A CG 1729 C CD . GLN A 276 ? 1.2627 1.5974 1.0885 0.2219 0.0946 0.0721 287 GLN A CD 1730 O OE1 . GLN A 276 ? 1.3887 1.7227 1.2225 0.2062 0.0942 0.0838 287 GLN A OE1 1731 N NE2 . GLN A 276 ? 1.2311 1.5653 1.0864 0.2092 0.0923 0.0709 287 GLN A NE2 1732 N N . THR A 277 ? 1.0346 1.4044 0.6976 0.3282 0.1158 0.0718 288 THR A N 1733 C CA . THR A 277 ? 0.9906 1.3580 0.6204 0.3395 0.1151 0.0741 288 THR A CA 1734 C C . THR A 277 ? 1.0037 1.3872 0.6675 0.3105 0.1215 0.1009 288 THR A C 1735 O O . THR A 277 ? 1.0905 1.5148 0.7917 0.2995 0.1383 0.1298 288 THR A O 1736 C CB . THR A 277 ? 1.1670 1.5709 0.7587 0.3809 0.1322 0.0819 288 THR A CB 1737 O OG1 . THR A 277 ? 1.2880 1.6633 0.8466 0.4074 0.1190 0.0520 288 THR A OG1 1738 C CG2 . THR A 277 ? 1.1775 1.5809 0.7482 0.3870 0.1310 0.0891 288 THR A CG2 1739 N N . VAL A 278 ? 0.7421 1.0925 0.3944 0.2978 0.1065 0.0917 289 VAL A N 1740 C CA . VAL A 278 ? 0.9627 1.3235 0.6427 0.2724 0.1105 0.1151 289 VAL A CA 1741 C C . VAL A 278 ? 1.0119 1.3666 0.6549 0.2853 0.1075 0.1154 289 VAL A C 1742 O O . VAL A 278 ? 1.0547 1.3913 0.6500 0.3121 0.0993 0.0945 289 VAL A O 1743 C CB . VAL A 278 ? 0.9271 1.2537 0.6413 0.2364 0.0947 0.1073 289 VAL A CB 1744 C CG1 . VAL A 278 ? 0.6495 0.9832 0.4009 0.2228 0.0974 0.1088 289 VAL A CG1 1745 C CG2 . VAL A 278 ? 1.0065 1.2827 0.6926 0.2376 0.0717 0.0762 289 VAL A CG2 1746 N N . SER A 279 ? 0.9975 1.3657 0.6619 0.2666 0.1129 0.1391 290 SER A N 1747 C CA . SER A 279 ? 1.0771 1.4384 0.7103 0.2752 0.1091 0.1409 290 SER A CA 1748 C C . SER A 279 ? 1.1417 1.4490 0.7602 0.2647 0.0837 0.1121 290 SER A C 1749 O O . SER A 279 ? 1.1320 1.4131 0.7760 0.2432 0.0719 0.0992 290 SER A O 1750 C CB . SER A 279 ? 1.1097 1.4968 0.7747 0.2548 0.1197 0.1745 290 SER A CB 1751 O OG . SER A 279 ? 1.1021 1.4559 0.7915 0.2237 0.1042 0.1693 290 SER A OG 1752 N N . THR A 280 ? 1.1053 1.3975 0.6833 0.2803 0.0750 0.1032 291 THR A N 1753 C CA . THR A 280 ? 1.0098 1.2534 0.5751 0.2707 0.0499 0.0785 291 THR A CA 1754 C C . THR A 280 ? 0.9523 1.1835 0.5603 0.2341 0.0443 0.0881 291 THR A C 1755 O O . THR A 280 ? 0.8865 1.0816 0.5026 0.2188 0.0258 0.0699 291 THR A O 1756 C CB . THR A 280 ? 1.0351 1.2678 0.5508 0.2934 0.0413 0.0706 291 THR A CB 1757 O OG1 . THR A 280 ? 1.1483 1.4205 0.6602 0.3014 0.0608 0.0995 291 THR A OG1 1758 C CG2 . THR A 280 ? 1.1000 1.3200 0.5672 0.3282 0.0337 0.0461 291 THR A CG2 1759 N N . ARG A 281 ? 0.9542 1.2159 0.5901 0.2211 0.0598 0.1176 292 ARG A N 1760 C CA . ARG A 281 ? 0.9007 1.1509 0.5750 0.1890 0.0545 0.1276 292 ARG A CA 1761 C C . ARG A 281 ? 0.8303 1.0699 0.5424 0.1680 0.0511 0.1213 292 ARG A C 1762 O O . ARG A 281 ? 0.8631 1.0767 0.5957 0.1461 0.0390 0.1148 292 ARG A O 1763 C CB . ARG A 281 ? 0.7831 1.0674 0.4773 0.1813 0.0703 0.1617 292 ARG A CB 1764 N N . ASP A 282 ? 0.8840 1.1446 0.6039 0.1762 0.0621 0.1236 293 ASP A N 1765 C CA . ASP A 282 ? 0.9754 1.2307 0.7315 0.1576 0.0605 0.1203 293 ASP A CA 1766 C C . ASP A 282 ? 0.9137 1.1376 0.6576 0.1621 0.0463 0.0906 293 ASP A C 1767 O O . ASP A 282 ? 0.8621 1.0726 0.6335 0.1444 0.0407 0.0846 293 ASP A O 1768 C CB . ASP A 282 ? 0.9572 1.2537 0.7362 0.1605 0.0791 0.1417 293 ASP A CB 1769 C CG . ASP A 282 ? 1.0061 1.3286 0.8170 0.1437 0.0891 0.1737 293 ASP A CG 1770 O OD1 . ASP A 282 ? 0.9240 1.2879 0.7428 0.1530 0.1061 0.1975 293 ASP A OD1 1771 O OD2 . ASP A 282 ? 0.9066 1.2085 0.7355 0.1217 0.0794 0.1760 293 ASP A OD2 1772 N N . TYR A 283 ? 0.8178 1.0292 0.5202 0.1862 0.0395 0.0726 294 TYR A N 1773 C CA . TYR A 283 ? 0.7325 0.9123 0.4215 0.1921 0.0238 0.0450 294 TYR A CA 1774 C C . TYR A 283 ? 0.8659 1.0098 0.5714 0.1691 0.0054 0.0330 294 TYR A C 1775 O O . TYR A 283 ? 0.8135 0.9456 0.5162 0.1606 -0.0020 0.0355 294 TYR A O 1776 C CB . TYR A 283 ? 0.9062 1.0752 0.5447 0.2227 0.0164 0.0282 294 TYR A CB 1777 C CG . TYR A 283 ? 0.9662 1.0943 0.5882 0.2272 -0.0061 -0.0008 294 TYR A CG 1778 C CD1 . TYR A 283 ? 1.0275 1.1211 0.6425 0.2177 -0.0270 -0.0133 294 TYR A CD1 1779 C CD2 . TYR A 283 ? 1.0344 1.1589 0.6489 0.2414 -0.0072 -0.0144 294 TYR A CD2 1780 C CE1 . TYR A 283 ? 1.0518 1.1088 0.6556 0.2204 -0.0491 -0.0371 294 TYR A CE1 1781 C CE2 . TYR A 283 ? 1.1062 1.1918 0.7073 0.2448 -0.0294 -0.0395 294 TYR A CE2 1782 C CZ . TYR A 283 ? 1.0515 1.1037 0.6484 0.2336 -0.0507 -0.0500 294 TYR A CZ 1783 O OH . TYR A 283 ? 1.0598 1.0739 0.6473 0.2354 -0.0744 -0.0724 294 TYR A OH 1784 N N . THR A 284 ? 0.9187 1.0474 0.6416 0.1602 -0.0014 0.0210 295 THR A N 1785 C CA . THR A 284 ? 0.7547 0.8505 0.4903 0.1427 -0.0191 0.0085 295 THR A CA 1786 C C . THR A 284 ? 0.8268 0.8961 0.5419 0.1554 -0.0351 -0.0150 295 THR A C 1787 O O . THR A 284 ? 0.8302 0.9058 0.5400 0.1680 -0.0308 -0.0211 295 THR A O 1788 C CB . THR A 284 ? 0.8338 0.9324 0.6109 0.1188 -0.0152 0.0163 295 THR A CB 1789 O OG1 . THR A 284 ? 0.8958 1.0050 0.6817 0.1238 -0.0085 0.0136 295 THR A OG1 1790 C CG2 . THR A 284 ? 0.8779 0.9982 0.6763 0.1057 -0.0028 0.0389 295 THR A CG2 1791 N N . GLY A 285 ? 0.7428 0.7822 0.4475 0.1522 -0.0547 -0.0273 296 GLY A N 1792 C CA . GLY A 285 ? 0.6809 0.6909 0.3675 0.1625 -0.0741 -0.0487 296 GLY A CA 1793 C C . GLY A 285 ? 0.6990 0.6828 0.3613 0.1677 -0.0947 -0.0594 296 GLY A C 1794 O O . GLY A 285 ? 0.8911 0.8812 0.5495 0.1640 -0.0926 -0.0500 296 GLY A O 1795 N N . PRO A 286 ? 0.7431 0.6963 0.3900 0.1761 -0.1164 -0.0788 297 PRO A N 1796 C CA . PRO A 286 ? 1.0118 0.9348 0.6369 0.1808 -0.1415 -0.0912 297 PRO A CA 1797 C C . PRO A 286 ? 1.0834 1.0103 0.6649 0.2048 -0.1414 -0.0942 297 PRO A C 1798 O O . PRO A 286 ? 1.1274 1.0440 0.7002 0.2016 -0.1528 -0.0934 297 PRO A O 1799 C CB . PRO A 286 ? 0.7617 0.6543 0.3794 0.1882 -0.1624 -0.1107 297 PRO A CB 1800 C CG . PRO A 286 ? 0.8192 0.7299 0.4368 0.1991 -0.1451 -0.1109 297 PRO A CG 1801 C CD . PRO A 286 ? 0.8431 0.7876 0.4942 0.1812 -0.1196 -0.0897 297 PRO A CD 1802 N N . ASN A 287 ? 1.1647 1.1074 0.7187 0.2297 -0.1286 -0.0971 298 ASN A N 1803 C CA . ASN A 287 ? 1.2189 1.1671 0.7270 0.2570 -0.1275 -0.1001 298 ASN A CA 1804 C C . ASN A 287 ? 1.1415 1.1280 0.6555 0.2539 -0.1025 -0.0762 298 ASN A C 1805 O O . ASN A 287 ? 1.2116 1.2293 0.7126 0.2713 -0.0813 -0.0665 298 ASN A O 1806 C CB . ASN A 287 ? 1.3072 1.2558 0.7798 0.2890 -0.1255 -0.1139 298 ASN A CB 1807 C CG . ASN A 287 ? 1.3371 1.2444 0.8022 0.2932 -0.1527 -0.1379 298 ASN A CG 1808 O OD1 . ASN A 287 ? 1.3598 1.2314 0.8169 0.2886 -0.1805 -0.1507 298 ASN A OD1 1809 N ND2 . ASN A 287 ? 1.3776 1.2893 0.8475 0.3012 -0.1458 -0.1431 298 ASN A ND2 1810 N N . ARG A 288 ? 1.0667 1.0512 0.6020 0.2319 -0.1056 -0.0655 299 ARG A N 1811 C CA . ARG A 288 ? 0.9891 1.0060 0.5385 0.2232 -0.0843 -0.0413 299 ARG A CA 1812 C C . ARG A 288 ? 1.0410 1.0616 0.5530 0.2408 -0.0863 -0.0383 299 ARG A C 1813 O O . ARG A 288 ? 1.1157 1.1074 0.6056 0.2456 -0.1091 -0.0525 299 ARG A O 1814 C CB . ARG A 288 ? 1.0172 1.0300 0.6115 0.1904 -0.0859 -0.0310 299 ARG A CB 1815 C CG . ARG A 288 ? 1.0742 1.1144 0.6863 0.1788 -0.0676 -0.0068 299 ARG A CG 1816 C CD . ARG A 288 ? 0.8371 0.8972 0.4901 0.1605 -0.0507 0.0074 299 ARG A CD 1817 N NE . ARG A 288 ? 0.9351 1.0181 0.6044 0.1498 -0.0363 0.0306 299 ARG A NE 1818 C CZ . ARG A 288 ? 0.9255 1.0412 0.6007 0.1542 -0.0160 0.0491 299 ARG A CZ 1819 N NH1 . ARG A 288 ? 0.9884 1.1201 0.6547 0.1697 -0.0062 0.0469 299 ARG A NH1 1820 N NH2 . ARG A 288 ? 0.8249 0.9577 0.5169 0.1428 -0.0062 0.0708 299 ARG A NH2 1821 N N . PHE A 289 ? 0.9484 1.0054 0.4546 0.2500 -0.0629 -0.0186 300 PHE A N 1822 C CA . PHE A 289 ? 1.0105 1.0768 0.4786 0.2700 -0.0611 -0.0131 300 PHE A CA 1823 C C . PHE A 289 ? 0.9301 1.0085 0.4180 0.2512 -0.0550 0.0082 300 PHE A C 1824 O O . PHE A 289 ? 1.0367 1.1165 0.4954 0.2637 -0.0582 0.0117 300 PHE A O 1825 C CB . PHE A 289 ? 0.8933 0.9947 0.3357 0.2983 -0.0392 -0.0037 300 PHE A CB 1826 C CG . PHE A 289 ? 1.0521 1.1376 0.4537 0.3288 -0.0492 -0.0277 300 PHE A CG 1827 C CD1 . PHE A 289 ? 0.9864 1.0605 0.3513 0.3539 -0.0576 -0.0392 300 PHE A CD1 1828 C CD2 . PHE A 289 ? 0.9221 1.0006 0.3391 0.3269 -0.0501 -0.0390 300 PHE A CD2 1829 C CE1 . PHE A 289 ? 1.1402 1.1954 0.4833 0.3778 -0.0672 -0.0611 300 PHE A CE1 1830 C CE2 . PHE A 289 ? 1.1632 1.2240 0.5473 0.3541 -0.0604 -0.0614 300 PHE A CE2 1831 C CZ . PHE A 289 ? 1.1018 1.1500 0.4551 0.3778 -0.0687 -0.0720 300 PHE A CZ 1832 N N . LEU A 290 ? 0.9285 1.0142 0.4642 0.2223 -0.0473 0.0216 301 LEU A N 1833 C CA . LEU A 290 ? 0.9620 1.0596 0.5201 0.2041 -0.0403 0.0430 301 LEU A CA 1834 C C . LEU A 290 ? 1.0039 1.0772 0.5965 0.1762 -0.0541 0.0386 301 LEU A C 1835 O O . LEU A 290 ? 1.1594 1.2181 0.7716 0.1659 -0.0608 0.0268 301 LEU A O 1836 C CB . LEU A 290 ? 1.0203 1.1563 0.6045 0.1978 -0.0145 0.0689 301 LEU A CB 1837 C CG . LEU A 290 ? 1.0873 1.2574 0.6523 0.2142 0.0030 0.0911 301 LEU A CG 1838 C CD1 . LEU A 290 ? 1.0667 1.2352 0.5765 0.2484 -0.0014 0.0779 301 LEU A CD1 1839 C CD2 . LEU A 290 ? 1.1084 1.3163 0.7006 0.2108 0.0264 0.1132 301 LEU A CD2 1840 N N . ALA A 291 ? 1.0425 1.1132 0.6423 0.1651 -0.0578 0.0492 302 ALA A N 1841 C CA . ALA A 291 ? 0.9127 0.9646 0.5452 0.1406 -0.0688 0.0478 302 ALA A CA 1842 C C . ALA A 291 ? 0.9565 1.0201 0.6304 0.1213 -0.0556 0.0587 302 ALA A C 1843 O O . ALA A 291 ? 0.9340 1.0231 0.6152 0.1233 -0.0375 0.0732 302 ALA A O 1844 C CB . ALA A 291 ? 0.7125 0.7628 0.3434 0.1351 -0.0732 0.0590 302 ALA A CB 1845 N N . ASP A 292 ? 0.9261 0.9719 0.6272 0.1034 -0.0653 0.0522 303 ASP A N 1846 C CA . ASP A 292 ? 0.8841 0.9374 0.6224 0.0855 -0.0554 0.0614 303 ASP A CA 1847 C C . ASP A 292 ? 0.7478 0.8177 0.4992 0.0775 -0.0438 0.0837 303 ASP A C 1848 O O . ASP A 292 ? 0.7633 0.8292 0.5066 0.0774 -0.0490 0.0897 303 ASP A O 1849 C CB . ASP A 292 ? 0.8721 0.9041 0.6338 0.0700 -0.0681 0.0522 303 ASP A CB 1850 C CG . ASP A 292 ? 0.9551 0.9729 0.7142 0.0736 -0.0779 0.0338 303 ASP A CG 1851 O OD1 . ASP A 292 ? 1.0056 1.0315 0.7547 0.0838 -0.0709 0.0292 303 ASP A OD1 1852 O OD2 . ASP A 292 ? 0.9805 0.9798 0.7492 0.0661 -0.0926 0.0253 303 ASP A OD2 1853 N N . PRO A 293 ? 0.7041 0.7922 0.4766 0.0709 -0.0294 0.0967 304 PRO A N 1854 C CA . PRO A 293 ? 0.6207 0.7216 0.4128 0.0598 -0.0208 0.1189 304 PRO A CA 1855 C C . PRO A 293 ? 0.6846 0.7659 0.4964 0.0441 -0.0308 0.1187 304 PRO A C 1856 O O . PRO A 293 ? 0.6341 0.7015 0.4635 0.0347 -0.0364 0.1084 304 PRO A O 1857 C CB . PRO A 293 ? 0.5570 0.6744 0.3732 0.0532 -0.0090 0.1275 304 PRO A CB 1858 C CG . PRO A 293 ? 0.6007 0.7086 0.4146 0.0569 -0.0130 0.1076 304 PRO A CG 1859 C CD . PRO A 293 ? 0.6813 0.7789 0.4607 0.0737 -0.0218 0.0919 304 PRO A CD 1860 N N . LEU A 294 ? 0.8118 0.8931 0.6195 0.0427 -0.0324 0.1306 305 LEU A N 1861 C CA . LEU A 294 ? 0.6547 0.7190 0.4791 0.0304 -0.0413 0.1320 305 LEU A CA 1862 C C . LEU A 294 ? 0.6876 0.7593 0.5337 0.0195 -0.0346 0.1528 305 LEU A C 1863 O O . LEU A 294 ? 0.8863 0.9769 0.7280 0.0230 -0.0255 0.1701 305 LEU A O 1864 C CB . LEU A 294 ? 0.6121 0.6667 0.4154 0.0374 -0.0519 0.1281 305 LEU A CB 1865 C CG . LEU A 294 ? 0.5649 0.6064 0.3820 0.0278 -0.0599 0.1335 305 LEU A CG 1866 C CD1 . LEU A 294 ? 0.5736 0.5998 0.4130 0.0180 -0.0666 0.1225 305 LEU A CD1 1867 C CD2 . LEU A 294 ? 0.6359 0.6715 0.4302 0.0364 -0.0700 0.1310 305 LEU A CD2 1868 N N . SER A 295 ? 0.6336 0.6904 0.5031 0.0070 -0.0400 0.1517 306 SER A N 1869 C CA . SER A 295 ? 0.6953 0.7515 0.5850 -0.0036 -0.0386 0.1693 306 SER A CA 1870 C C . SER A 295 ? 0.7058 0.7421 0.5994 -0.0075 -0.0493 0.1670 306 SER A C 1871 O O . SER A 295 ? 0.6886 0.7096 0.5928 -0.0115 -0.0556 0.1552 306 SER A O 1872 C CB . SER A 295 ? 0.7304 0.7862 0.6449 -0.0137 -0.0358 0.1707 306 SER A CB 1873 O OG . SER A 295 ? 0.8425 0.8947 0.7767 -0.0240 -0.0374 0.1878 306 SER A OG 1874 N N . TYR A 296 ? 0.7680 0.8063 0.6529 -0.0052 -0.0507 0.1795 307 TYR A N 1875 C CA . TYR A 296 ? 0.8049 0.8269 0.6893 -0.0058 -0.0609 0.1774 307 TYR A CA 1876 C C . TYR A 296 ? 0.8197 0.8340 0.7206 -0.0140 -0.0631 0.1939 307 TYR A C 1877 O O . TYR A 296 ? 0.8305 0.8562 0.7349 -0.0168 -0.0575 0.2126 307 TYR A O 1878 C CB . TYR A 296 ? 0.8543 0.8813 0.7126 0.0049 -0.0639 0.1764 307 TYR A CB 1879 C CG . TYR A 296 ? 0.8240 0.8392 0.6813 0.0049 -0.0736 0.1795 307 TYR A CG 1880 C CD1 . TYR A 296 ? 0.7669 0.7694 0.6263 0.0058 -0.0836 0.1655 307 TYR A CD1 1881 C CD2 . TYR A 296 ? 0.8796 0.8980 0.7348 0.0044 -0.0727 0.1981 307 TYR A CD2 1882 C CE1 . TYR A 296 ? 0.8452 0.8393 0.7050 0.0066 -0.0922 0.1693 307 TYR A CE1 1883 C CE2 . TYR A 296 ? 0.7896 0.7972 0.6436 0.0052 -0.0818 0.2011 307 TYR A CE2 1884 C CZ . TYR A 296 ? 0.7712 0.7671 0.6274 0.0066 -0.0914 0.1862 307 TYR A CZ 1885 O OH . TYR A 296 ? 0.5923 0.5796 0.4488 0.0082 -0.1004 0.1899 307 TYR A OH 1886 N N . GLU A 297 ? 0.7424 0.7378 0.6540 -0.0171 -0.0718 0.1878 308 GLU A N 1887 C CA . GLU A 297 ? 0.6940 0.6766 0.6193 -0.0230 -0.0770 0.2006 308 GLU A CA 1888 C C . GLU A 297 ? 0.7493 0.7169 0.6726 -0.0188 -0.0863 0.1941 308 GLU A C 1889 O O . GLU A 297 ? 0.7262 0.6903 0.6479 -0.0148 -0.0892 0.1786 308 GLU A O 1890 C CB . GLU A 297 ? 0.7218 0.6939 0.6685 -0.0316 -0.0783 0.2010 308 GLU A CB 1891 C CG . GLU A 297 ? 0.9556 0.9431 0.9110 -0.0380 -0.0705 0.2136 308 GLU A CG 1892 C CD . GLU A 297 ? 1.1180 1.0914 1.0970 -0.0484 -0.0763 0.2200 308 GLU A CD 1893 O OE1 . GLU A 297 ? 1.0759 1.0260 1.0615 -0.0496 -0.0868 0.2177 308 GLU A OE1 1894 O OE2 . GLU A 297 ? 1.2427 1.2281 1.2335 -0.0546 -0.0714 0.2274 308 GLU A OE2 1895 N N . SER A 298 ? 0.8218 0.7821 0.7470 -0.0197 -0.0911 0.2075 309 SER A N 1896 C CA . SER A 298 ? 0.7241 0.6715 0.6487 -0.0149 -0.0998 0.2037 309 SER A CA 1897 C C . SER A 298 ? 0.6662 0.5966 0.6031 -0.0187 -0.1062 0.2162 309 SER A C 1898 O O . SER A 298 ? 0.6991 0.6326 0.6385 -0.0239 -0.1048 0.2337 309 SER A O 1899 C CB . SER A 298 ? 0.7896 0.7474 0.6956 -0.0081 -0.1013 0.2061 309 SER A CB 1900 O OG . SER A 298 ? 0.8293 0.7768 0.7369 -0.0037 -0.1101 0.2049 309 SER A OG 1901 N N . ARG A 299 ? 0.6303 0.5430 0.5751 -0.0153 -0.1134 0.2079 310 ARG A N 1902 C CA . ARG A 299 ? 0.6375 0.5296 0.5910 -0.0159 -0.1223 0.2172 310 ARG A CA 1903 C C . ARG A 299 ? 0.7143 0.5992 0.6645 -0.0058 -0.1285 0.2111 310 ARG A C 1904 O O . ARG A 299 ? 0.7292 0.6167 0.6796 0.0005 -0.1277 0.1968 310 ARG A O 1905 C CB . ARG A 299 ? 0.6724 0.5458 0.6396 -0.0197 -0.1266 0.2124 310 ARG A CB 1906 C CG . ARG A 299 ? 0.8560 0.7375 0.8307 -0.0301 -0.1213 0.2175 310 ARG A CG 1907 C CD . ARG A 299 ? 0.9679 0.8326 0.9530 -0.0315 -0.1260 0.2058 310 ARG A CD 1908 N NE . ARG A 299 ? 1.1980 1.0774 1.1872 -0.0381 -0.1181 0.2032 310 ARG A NE 1909 C CZ . ARG A 299 ? 1.3450 1.2379 1.3272 -0.0340 -0.1104 0.1887 310 ARG A CZ 1910 N NH1 . ARG A 299 ? 1.1513 1.0458 1.1243 -0.0245 -0.1098 0.1768 310 ARG A NH1 1911 N NH2 . ARG A 299 ? 1.4850 1.3904 1.4714 -0.0396 -0.1038 0.1873 310 ARG A NH2 1912 N N . SER A 300 ? 0.8293 0.7067 0.7780 -0.0040 -0.1346 0.2236 311 SER A N 1913 C CA . SER A 300 ? 0.7676 0.6410 0.7139 0.0062 -0.1405 0.2202 311 SER A CA 1914 C C . SER A 300 ? 0.8848 0.7354 0.8369 0.0092 -0.1504 0.2292 311 SER A C 1915 O O . SER A 300 ? 0.9767 0.8215 0.9299 0.0028 -0.1533 0.2454 311 SER A O 1916 C CB . SER A 300 ? 0.7895 0.6817 0.7233 0.0083 -0.1389 0.2245 311 SER A CB 1917 O OG . SER A 300 ? 0.8983 0.7887 0.8327 0.0174 -0.1453 0.2225 311 SER A OG 1918 N N . TRP A 301 ? 0.8024 0.6407 0.7584 0.0199 -0.1556 0.2197 312 TRP A N 1919 C CA . TRP A 301 ? 0.7858 0.6008 0.7451 0.0264 -0.1662 0.2257 312 TRP A CA 1920 C C . TRP A 301 ? 0.9471 0.7691 0.9037 0.0386 -0.1687 0.2249 312 TRP A C 1921 O O . TRP A 301 ? 1.0216 0.8574 0.9793 0.0462 -0.1647 0.2140 312 TRP A O 1922 C CB . TRP A 301 ? 0.8312 0.6217 0.7960 0.0319 -0.1720 0.2150 312 TRP A CB 1923 C CG . TRP A 301 ? 0.8804 0.6569 0.8513 0.0197 -0.1749 0.2192 312 TRP A CG 1924 C CD1 . TRP A 301 ? 0.9226 0.7063 0.8962 0.0124 -0.1687 0.2118 312 TRP A CD1 1925 C CD2 . TRP A 301 ? 0.8748 0.6280 0.8524 0.0126 -0.1860 0.2334 312 TRP A CD2 1926 N NE1 . TRP A 301 ? 0.9382 0.7060 0.9207 0.0010 -0.1752 0.2208 312 TRP A NE1 1927 C CE2 . TRP A 301 ? 0.9030 0.6516 0.8890 0.0004 -0.1863 0.2346 312 TRP A CE2 1928 C CE3 . TRP A 301 ? 1.0527 0.7885 1.0317 0.0150 -0.1966 0.2463 312 TRP A CE3 1929 C CZ2 . TRP A 301 ? 0.8800 0.6079 0.8779 -0.0104 -0.1976 0.2494 312 TRP A CZ2 1930 C CZ3 . TRP A 301 ? 1.1343 0.8479 1.1237 0.0045 -0.2077 0.2605 312 TRP A CZ3 1931 C CH2 . TRP A 301 ? 1.0976 0.8078 1.0974 -0.0085 -0.2085 0.2625 312 TRP A CH2 1932 N N . LEU A 302 ? 0.8923 0.7062 0.8474 0.0401 -0.1758 0.2382 313 LEU A N 1933 C CA . LEU A 302 ? 0.8504 0.6693 0.8046 0.0519 -0.1798 0.2395 313 LEU A CA 1934 C C . LEU A 302 ? 0.9497 0.7416 0.9064 0.0596 -0.1910 0.2465 313 LEU A C 1935 O O . LEU A 302 ? 0.9315 0.7099 0.8879 0.0519 -0.1965 0.2604 313 LEU A O 1936 C CB . LEU A 302 ? 0.9458 0.7855 0.8922 0.0473 -0.1781 0.2495 313 LEU A CB 1937 C CG . LEU A 302 ? 0.8850 0.7297 0.8317 0.0579 -0.1845 0.2540 313 LEU A CG 1938 C CD1 . LEU A 302 ? 0.9128 0.7724 0.8669 0.0674 -0.1823 0.2418 313 LEU A CD1 1939 C CD2 . LEU A 302 ? 0.9116 0.7713 0.8477 0.0528 -0.1854 0.2653 313 LEU A CD2 1940 N N . PHE A 303 ? 0.8795 0.6641 0.8392 0.0757 -0.1945 0.2377 314 PHE A N 1941 C CA . PHE A 303 ? 0.7970 0.5546 0.7573 0.0865 -0.2061 0.2422 314 PHE A CA 1942 C C . PHE A 303 ? 0.8606 0.6306 0.8224 0.1024 -0.2073 0.2426 314 PHE A C 1943 O O . PHE A 303 ? 0.8312 0.6204 0.7965 0.1118 -0.2009 0.2331 314 PHE A O 1944 C CB . PHE A 303 ? 0.8349 0.5639 0.7953 0.0945 -0.2117 0.2303 314 PHE A CB 1945 C CG . PHE A 303 ? 0.9637 0.6598 0.9228 0.1070 -0.2261 0.2332 314 PHE A CG 1946 C CD1 . PHE A 303 ? 1.0127 0.6841 0.9739 0.0965 -0.2373 0.2470 314 PHE A CD1 1947 C CD2 . PHE A 303 ? 0.9518 0.6422 0.9080 0.1300 -0.2286 0.2233 314 PHE A CD2 1948 C CE1 . PHE A 303 ? 1.0006 0.6384 0.9607 0.1081 -0.2526 0.2495 314 PHE A CE1 1949 C CE2 . PHE A 303 ? 1.0712 0.7290 1.0240 0.1437 -0.2428 0.2248 314 PHE A CE2 1950 C CZ . PHE A 303 ? 1.0131 0.6432 0.9678 0.1323 -0.2554 0.2371 314 PHE A CZ 1951 N N . ARG A 304 ? 0.8651 0.6255 0.8259 0.1051 -0.2159 0.2554 315 ARG A N 1952 C CA . ARG A 304 ? 0.8194 0.5935 0.7831 0.1191 -0.2178 0.2584 315 ARG A CA 1953 C C . ARG A 304 ? 0.8911 0.6384 0.8540 0.1307 -0.2302 0.2660 315 ARG A C 1954 O O . ARG A 304 ? 0.9524 0.6951 0.9133 0.1242 -0.2362 0.2808 315 ARG A O 1955 C CB . ARG A 304 ? 0.7642 0.5668 0.7268 0.1093 -0.2144 0.2675 315 ARG A CB 1956 C CG . ARG A 304 ? 1.0973 0.9195 1.0663 0.1220 -0.2166 0.2702 315 ARG A CG 1957 C CD . ARG A 304 ? 1.0484 0.8975 1.0151 0.1119 -0.2151 0.2760 315 ARG A CD 1958 N NE . ARG A 304 ? 1.0746 0.9476 1.0525 0.1219 -0.2165 0.2757 315 ARG A NE 1959 C CZ . ARG A 304 ? 1.0361 0.9339 1.0156 0.1153 -0.2171 0.2771 315 ARG A CZ 1960 N NH1 . ARG A 304 ? 1.0408 0.9418 1.0077 0.1009 -0.2154 0.2772 315 ARG A NH1 1961 N NH2 . ARG A 304 ? 0.9997 0.9192 0.9937 0.1238 -0.2201 0.2789 315 ARG A NH2 1962 N N . PRO A 305 ? 1.1157 0.8448 1.0788 0.1494 -0.2343 0.2558 316 PRO A N 1963 C CA . PRO A 305 ? 0.8607 0.5629 0.8219 0.1643 -0.2460 0.2593 316 PRO A CA 1964 C C . PRO A 305 ? 0.9729 0.6986 0.9390 0.1791 -0.2443 0.2639 316 PRO A C 1965 O O . PRO A 305 ? 0.8966 0.6540 0.8693 0.1834 -0.2362 0.2610 316 PRO A O 1966 C CB . PRO A 305 ? 0.8750 0.5539 0.8314 0.1805 -0.2484 0.2425 316 PRO A CB 1967 C CG . PRO A 305 ? 0.9993 0.7081 0.9585 0.1836 -0.2354 0.2323 316 PRO A CG 1968 C CD . PRO A 305 ? 0.8130 0.5475 0.7763 0.1590 -0.2269 0.2390 316 PRO A CD 1969 N N . GLY A 306 ? 0.8844 0.5980 0.8493 0.1852 -0.2501 0.2704 317 GLY A N 1970 C CA . GLY A 306 ? 0.8844 0.6201 0.8550 0.1989 -0.2491 0.2760 317 GLY A CA 1971 C C . GLY A 306 ? 1.1041 0.8179 1.0723 0.2131 -0.2560 0.2779 317 GLY A C 1972 O O . GLY A 306 ? 0.9452 0.6272 0.9078 0.2066 -0.2630 0.2789 317 GLY A O 1973 N N . PHE A 307 ? 1.0434 0.7756 1.0176 0.2322 -0.2544 0.2795 318 PHE A N 1974 C CA . PHE A 307 ? 0.9951 0.7097 0.9680 0.2476 -0.2604 0.2818 318 PHE A CA 1975 C C . PHE A 307 ? 1.1048 0.8469 1.0852 0.2548 -0.2597 0.2932 318 PHE A C 1976 O O . PHE A 307 ? 1.1569 0.9324 1.1472 0.2645 -0.2536 0.2936 318 PHE A O 1977 C CB . PHE A 307 ? 1.0313 0.7316 1.0025 0.2716 -0.2599 0.2679 318 PHE A CB 1978 C CG . PHE A 307 ? 1.2814 0.9610 1.2510 0.2879 -0.2669 0.2687 318 PHE A CG 1979 C CD1 . PHE A 307 ? 1.2836 0.9221 1.2447 0.2802 -0.2778 0.2677 318 PHE A CD1 1980 C CD2 . PHE A 307 ? 1.2912 0.9936 1.2701 0.3101 -0.2632 0.2716 318 PHE A CD2 1981 C CE1 . PHE A 307 ? 1.1788 0.7964 1.1383 0.2949 -0.2856 0.2681 318 PHE A CE1 1982 C CE2 . PHE A 307 ? 1.2261 0.9093 1.2038 0.3253 -0.2700 0.2722 318 PHE A CE2 1983 C CZ . PHE A 307 ? 1.1313 0.7706 1.0979 0.3181 -0.2815 0.2697 318 PHE A CZ 1984 N N . ARG A 308 ? 1.1601 0.8886 1.1366 0.2494 -0.2665 0.3030 319 ARG A N 1985 C CA . ARG A 308 ? 1.1243 0.8730 1.1059 0.2576 -0.2678 0.3131 319 ARG A CA 1986 C C . ARG A 308 ? 1.1763 0.9120 1.1607 0.2826 -0.2707 0.3112 319 ARG A C 1987 O O . ARG A 308 ? 1.0882 0.7880 1.0660 0.2845 -0.2772 0.3079 319 ARG A O 1988 C CB . ARG A 308 ? 1.1233 0.8658 1.0982 0.2385 -0.2732 0.3255 319 ARG A CB 1989 C CG . ARG A 308 ? 1.1277 0.8886 1.1054 0.2449 -0.2763 0.3358 319 ARG A CG 1990 C CD . ARG A 308 ? 1.0905 0.8908 1.0755 0.2412 -0.2725 0.3367 319 ARG A CD 1991 N NE . ARG A 308 ? 1.2361 1.0448 1.2169 0.2187 -0.2695 0.3364 319 ARG A NE 1992 C CZ . ARG A 308 ? 1.1093 0.9488 1.0951 0.2103 -0.2677 0.3370 319 ARG A CZ 1993 N NH1 . ARG A 308 ? 0.9321 0.7973 0.9294 0.2205 -0.2693 0.3385 319 ARG A NH1 1994 N NH2 . ARG A 308 ? 1.0342 0.8787 1.0140 0.1916 -0.2648 0.3362 319 ARG A NH2 1995 N N . PHE A 309 ? 1.2166 0.9823 1.2122 0.3015 -0.2661 0.3137 320 PHE A N 1996 C CA . PHE A 309 ? 1.2224 0.9833 1.2254 0.3264 -0.2671 0.3132 320 PHE A CA 1997 C C . PHE A 309 ? 1.4023 1.1578 1.4045 0.3307 -0.2739 0.3246 320 PHE A C 1998 O O . PHE A 309 ? 1.4504 1.1952 1.4430 0.3133 -0.2797 0.3317 320 PHE A O 1999 C CB . PHE A 309 ? 1.0725 0.8749 1.0970 0.3436 -0.2584 0.3143 320 PHE A CB 2000 C CG . PHE A 309 ? 1.0777 0.8785 1.1052 0.3485 -0.2536 0.3003 320 PHE A CG 2001 C CD1 . PHE A 309 ? 1.0271 0.8061 1.0502 0.3682 -0.2551 0.2870 320 PHE A CD1 2002 C CD2 . PHE A 309 ? 0.9644 0.7840 0.9932 0.3361 -0.2472 0.2978 320 PHE A CD2 2003 C CE1 . PHE A 309 ? 1.1187 0.8953 1.1358 0.3762 -0.2491 0.2711 320 PHE A CE1 2004 C CE2 . PHE A 309 ? 1.1770 0.9944 1.2047 0.3421 -0.2422 0.2836 320 PHE A CE2 2005 C CZ . PHE A 309 ? 1.0796 0.8760 1.0994 0.3631 -0.2423 0.2699 320 PHE A CZ 2006 N N . GLU A 310 ? 1.5243 1.2887 1.5395 0.3535 -0.2735 0.3269 321 GLU A N 2007 C CA . GLU A 310 ? 1.5451 1.3173 1.5649 0.3622 -0.2776 0.3392 321 GLU A CA 2008 C C . GLU A 310 ? 1.4105 1.2280 1.4599 0.3785 -0.2719 0.3463 321 GLU A C 2009 O O . GLU A 310 ? 1.4618 1.2768 1.5267 0.3914 -0.2741 0.3375 321 GLU A O 2010 C CB . GLU A 310 ? 1.6971 1.4280 1.7101 0.3707 -0.2871 0.3369 321 GLU A CB 2011 C CG . GLU A 310 ? 1.8122 1.5281 1.8151 0.3614 -0.2953 0.3484 321 GLU A CG 2012 C CD . GLU A 310 ? 1.8876 1.5873 1.8761 0.3333 -0.2986 0.3497 321 GLU A CD 2013 O OE1 . GLU A 310 ? 1.8433 1.5693 1.8308 0.3198 -0.2946 0.3532 321 GLU A OE1 2014 O OE2 . GLU A 310 ? 1.9914 1.6528 1.9714 0.3239 -0.3061 0.3476 321 GLU A OE2 2015 N N . ASN A 311 ? 1.1794 1.0285 1.2242 0.3765 -0.2677 0.3502 322 ASN A N 2016 C CA . ASN A 311 ? 1.3083 1.1418 1.3250 0.3634 -0.2787 0.3513 322 ASN A CA 2017 C C . ASN A 311 ? 1.4009 1.2301 1.4108 0.3358 -0.2789 0.3467 322 ASN A C 2018 O O . ASN A 311 ? 1.3826 1.2201 1.3957 0.3344 -0.2723 0.3384 322 ASN A O 2019 C CB . ASN A 311 ? 1.2696 1.1251 1.2881 0.3663 -0.2887 0.3512 322 ASN A CB 2020 N N . LYS A 312 ? 1.4134 1.2328 1.4154 0.3142 -0.2853 0.3535 323 LYS A N 2021 C CA . LYS A 312 ? 1.3451 1.1622 1.3412 0.2876 -0.2842 0.3524 323 LYS A CA 2022 C C . LYS A 312 ? 1.3446 1.1972 1.3506 0.2779 -0.2811 0.3493 323 LYS A C 2023 O O . LYS A 312 ? 1.2087 1.0658 1.2105 0.2565 -0.2802 0.3498 323 LYS A O 2024 C CB . LYS A 312 ? 1.0666 0.8691 1.0516 0.2706 -0.2908 0.3628 323 LYS A CB 2025 N N . ARG A 313 ? 1.3154 1.1933 1.3356 0.2937 -0.2800 0.3465 324 ARG A N 2026 C CA . ARG A 313 ? 1.2005 1.1145 1.2368 0.2839 -0.2782 0.3452 324 ARG A CA 2027 C C . ARG A 313 ? 1.2307 1.1538 1.2755 0.2882 -0.2697 0.3356 324 ARG A C 2028 O O . ARG A 313 ? 1.3604 1.3141 1.4214 0.2792 -0.2664 0.3350 324 ARG A O 2029 C CB . ARG A 313 ? 1.1651 1.1062 1.2182 0.2935 -0.2836 0.3506 324 ARG A CB 2030 C CG . ARG A 313 ? 1.3885 1.3213 1.4443 0.3209 -0.2856 0.3486 324 ARG A CG 2031 C CD . ARG A 313 ? 1.4772 1.4366 1.5512 0.3278 -0.2920 0.3559 324 ARG A CD 2032 N NE . ARG A 313 ? 1.5554 1.5097 1.6200 0.3179 -0.2998 0.3652 324 ARG A NE 2033 C CZ . ARG A 313 ? 1.6083 1.5789 1.6837 0.3236 -0.3072 0.3725 324 ARG A CZ 2034 N NH1 . ARG A 313 ? 1.6593 1.6541 1.7577 0.3383 -0.3072 0.3726 324 ARG A NH1 2035 N NH2 . ARG A 313 ? 1.0222 0.9861 1.0867 0.3142 -0.3146 0.3805 324 ARG A NH2 2036 N N . HIS A 314 ? 1.1791 1.0756 1.2131 0.3021 -0.2662 0.3286 325 HIS A N 2037 C CA . HIS A 314 ? 1.1866 1.0873 1.2252 0.3077 -0.2590 0.3186 325 HIS A CA 2038 C C . HIS A 314 ? 1.1248 1.0009 1.1495 0.2943 -0.2546 0.3149 325 HIS A C 2039 O O . HIS A 314 ? 1.1026 0.9473 1.1153 0.2926 -0.2571 0.3166 325 HIS A O 2040 C CB . HIS A 314 ? 1.3386 1.2277 1.3799 0.3349 -0.2627 0.3105 325 HIS A CB 2041 C CG . HIS A 314 ? 1.3848 1.3066 1.4528 0.3439 -0.2649 0.3160 325 HIS A CG 2042 N ND1 . HIS A 314 ? 1.2672 1.1925 1.3345 0.3457 -0.2721 0.3244 325 HIS A ND1 2043 C CD2 . HIS A 314 ? 1.4038 1.3611 1.4976 0.3540 -0.2559 0.3159 325 HIS A CD2 2044 C CE1 . HIS A 314 ? 1.3550 1.3142 1.4484 0.3554 -0.2703 0.3287 325 HIS A CE1 2045 N NE2 . HIS A 314 ? 1.4587 1.4392 1.5676 0.3613 -0.2590 0.3242 325 HIS A NE2 2046 N N . TYR A 315 ? 1.1378 1.0290 1.1688 0.2821 -0.2490 0.3102 326 TYR A N 2047 C CA . TYR A 315 ? 1.0286 0.8981 1.0489 0.2669 -0.2466 0.3055 326 TYR A CA 2048 C C . TYR A 315 ? 0.9571 0.8386 0.9840 0.2705 -0.2386 0.2967 326 TYR A C 2049 O O . TYR A 315 ? 1.0814 0.9970 1.1239 0.2656 -0.2342 0.2977 326 TYR A O 2050 C CB . TYR A 315 ? 1.0318 0.9049 1.0478 0.2394 -0.2498 0.3113 326 TYR A CB 2051 C CG . TYR A 315 ? 1.0661 0.9208 1.0718 0.2217 -0.2477 0.3067 326 TYR A CG 2052 C CD1 . TYR A 315 ? 1.1046 0.9248 1.0963 0.2146 -0.2518 0.3077 326 TYR A CD1 2053 C CD2 . TYR A 315 ? 1.0937 0.9669 1.1055 0.2112 -0.2421 0.3020 326 TYR A CD2 2054 C CE1 . TYR A 315 ? 1.1185 0.9236 1.1024 0.1979 -0.2501 0.3043 326 TYR A CE1 2055 C CE2 . TYR A 315 ? 1.1170 0.9740 1.1191 0.1957 -0.2404 0.2979 326 TYR A CE2 2056 C CZ . TYR A 315 ? 1.1165 0.9400 1.1048 0.1892 -0.2443 0.2991 326 TYR A CZ 2057 O OH . TYR A 315 ? 1.1233 0.9330 1.1039 0.1734 -0.2425 0.2961 326 TYR A OH 2058 N N . ILE A 316 ? 0.9693 0.8238 0.9865 0.2778 -0.2365 0.2886 327 ILE A N 2059 C CA . ILE A 316 ? 1.0078 0.8685 1.0275 0.2784 -0.2297 0.2799 327 ILE A CA 2060 C C . ILE A 316 ? 1.0040 0.8397 1.0118 0.2546 -0.2324 0.2753 327 ILE A C 2061 O O . ILE A 316 ? 1.0215 0.8256 1.0171 0.2465 -0.2388 0.2757 327 ILE A O 2062 C CB . ILE A 316 ? 1.0888 0.9409 1.1108 0.3022 -0.2256 0.2712 327 ILE A CB 2063 C CG1 . ILE A 316 ? 1.2816 1.0869 1.2853 0.3053 -0.2325 0.2633 327 ILE A CG1 2064 C CG2 . ILE A 316 ? 1.1265 1.0060 1.1677 0.3193 -0.2252 0.2744 327 ILE A CG2 2065 C CD1 . ILE A 316 ? 1.3668 1.1557 1.3638 0.3271 -0.2299 0.2480 327 ILE A CD1 2066 N N . GLY A 317 ? 0.9047 0.7574 0.9178 0.2425 -0.2265 0.2718 328 GLY A N 2067 C CA . GLY A 317 ? 0.8270 0.6630 0.8291 0.2194 -0.2258 0.2669 328 GLY A CA 2068 C C . GLY A 317 ? 0.9264 0.7764 0.9305 0.2144 -0.2144 0.2553 328 GLY A C 2069 O O . GLY A 317 ? 0.9678 0.8519 0.9857 0.2190 -0.2066 0.2557 328 GLY A O 2070 N N . GLY A 318 ? 0.8279 0.6519 0.8198 0.2045 -0.2143 0.2465 329 GLY A N 2071 C CA . GLY A 318 ? 0.7888 0.6225 0.7808 0.1986 -0.2043 0.2354 329 GLY A CA 2072 C C . GLY A 318 ? 0.9133 0.7498 0.9021 0.1719 -0.2024 0.2369 329 GLY A C 2073 O O . GLY A 318 ? 0.9770 0.8016 0.9603 0.1597 -0.2089 0.2457 329 GLY A O 2074 N N . ILE A 319 ? 0.8848 0.7382 0.8767 0.1643 -0.1931 0.2290 330 ILE A N 2075 C CA . ILE A 319 ? 0.7028 0.5602 0.6907 0.1415 -0.1903 0.2289 330 ILE A CA 2076 C C . ILE A 319 ? 0.8226 0.6772 0.8080 0.1375 -0.1826 0.2163 330 ILE A C 2077 O O . ILE A 319 ? 0.8204 0.6893 0.8121 0.1484 -0.1760 0.2093 330 ILE A O 2078 C CB . ILE A 319 ? 0.8718 0.7610 0.8676 0.1322 -0.1891 0.2356 330 ILE A CB 2079 C CG1 . ILE A 319 ? 0.8479 0.7384 0.8350 0.1116 -0.1872 0.2351 330 ILE A CG1 2080 C CG2 . ILE A 319 ? 0.8780 0.7966 0.8892 0.1399 -0.1827 0.2321 330 ILE A CG2 2081 C CD1 . ILE A 319 ? 0.9492 0.8210 0.9243 0.1033 -0.1933 0.2444 330 ILE A CD1 2082 N N . LEU A 320 ? 0.8183 0.6560 0.7953 0.1222 -0.1833 0.2148 331 LEU A N 2083 C CA . LEU A 320 ? 0.8596 0.6908 0.8338 0.1180 -0.1777 0.2032 331 LEU A CA 2084 C C . LEU A 320 ? 0.9904 0.8275 0.9613 0.0968 -0.1741 0.2052 331 LEU A C 2085 O O . LEU A 320 ? 1.1677 0.9880 1.1333 0.0864 -0.1785 0.2119 331 LEU A O 2086 C CB . LEU A 320 ? 0.8062 0.6014 0.7732 0.1261 -0.1852 0.1980 331 LEU A CB 2087 C CG . LEU A 320 ? 0.9732 0.7569 0.9363 0.1317 -0.1824 0.1836 331 LEU A CG 2088 C CD1 . LEU A 320 ? 0.9397 0.6856 0.8945 0.1461 -0.1943 0.1787 331 LEU A CD1 2089 C CD2 . LEU A 320 ? 0.9528 0.7358 0.9151 0.1114 -0.1788 0.1813 331 LEU A CD2 2090 N N . GLU A 321 ? 0.8151 0.6768 0.7899 0.0910 -0.1662 0.2004 332 GLU A N 2091 C CA . GLU A 321 ? 0.7771 0.6462 0.7472 0.0738 -0.1622 0.2006 332 GLU A CA 2092 C C . GLU A 321 ? 0.8603 0.7313 0.8316 0.0704 -0.1549 0.1888 332 GLU A C 2093 O O . GLU A 321 ? 0.8772 0.7589 0.8549 0.0792 -0.1507 0.1814 332 GLU A O 2094 C CB . GLU A 321 ? 0.8579 0.7518 0.8290 0.0689 -0.1620 0.2051 332 GLU A CB 2095 C CG . GLU A 321 ? 0.9977 0.8991 0.9600 0.0544 -0.1584 0.2047 332 GLU A CG 2096 C CD . GLU A 321 ? 1.2137 1.1357 1.1744 0.0518 -0.1612 0.2066 332 GLU A CD 2097 O OE1 . GLU A 321 ? 1.1620 1.0923 1.1302 0.0592 -0.1670 0.2110 332 GLU A OE1 2098 O OE2 . GLU A 321 ? 1.2198 1.1492 1.1717 0.0431 -0.1588 0.2037 332 GLU A OE2 2099 N N . HIS A 322 ? 0.8253 0.6873 0.7912 0.0580 -0.1533 0.1887 333 HIS A N 2100 C CA . HIS A 322 ? 0.7787 0.6443 0.7454 0.0529 -0.1466 0.1785 333 HIS A CA 2101 C C . HIS A 322 ? 0.8651 0.7359 0.8267 0.0375 -0.1431 0.1824 333 HIS A C 2102 O O . HIS A 322 ? 0.8196 0.6761 0.7795 0.0305 -0.1455 0.1891 333 HIS A O 2103 C CB . HIS A 322 ? 0.7528 0.5952 0.7198 0.0591 -0.1493 0.1711 333 HIS A CB 2104 C CG . HIS A 322 ? 0.8177 0.6635 0.7854 0.0548 -0.1431 0.1605 333 HIS A CG 2105 N ND1 . HIS A 322 ? 0.7491 0.5935 0.7158 0.0404 -0.1408 0.1617 333 HIS A ND1 2106 C CD2 . HIS A 322 ? 0.8332 0.6857 0.8029 0.0636 -0.1383 0.1498 333 HIS A CD2 2107 C CE1 . HIS A 322 ? 0.8114 0.6598 0.7793 0.0401 -0.1357 0.1511 333 HIS A CE1 2108 N NE2 . HIS A 322 ? 0.8291 0.6820 0.7982 0.0539 -0.1341 0.1437 333 HIS A NE2 2109 N N . THR A 323 ? 0.7307 0.6225 0.6905 0.0330 -0.1380 0.1792 334 THR A N 2110 C CA . THR A 323 ? 0.7717 0.6710 0.7242 0.0218 -0.1336 0.1816 334 THR A CA 2111 C C . THR A 323 ? 0.7183 0.6273 0.6728 0.0185 -0.1269 0.1700 334 THR A C 2112 O O . THR A 323 ? 0.7732 0.6918 0.7331 0.0234 -0.1260 0.1623 334 THR A O 2113 C CB . THR A 323 ? 0.7693 0.6823 0.7122 0.0202 -0.1355 0.1886 334 THR A CB 2114 O OG1 . THR A 323 ? 0.8348 0.7638 0.7746 0.0184 -0.1327 0.1800 334 THR A OG1 2115 C CG2 . THR A 323 ? 0.5850 0.4973 0.5307 0.0284 -0.1429 0.1938 334 THR A CG2 2116 N N . GLN A 324 ? 0.6696 0.5771 0.6213 0.0102 -0.1224 0.1703 335 GLN A N 2117 C CA . GLN A 324 ? 0.7019 0.6174 0.6552 0.0070 -0.1162 0.1597 335 GLN A CA 2118 C C . GLN A 324 ? 0.7619 0.6880 0.7068 -0.0006 -0.1109 0.1629 335 GLN A C 2119 O O . GLN A 324 ? 0.8994 0.8223 0.8428 -0.0059 -0.1098 0.1734 335 GLN A O 2120 C CB . GLN A 324 ? 0.5772 0.4785 0.5383 0.0076 -0.1159 0.1538 335 GLN A CB 2121 C CG . GLN A 324 ? 0.5136 0.4229 0.4770 0.0055 -0.1099 0.1427 335 GLN A CG 2122 C CD . GLN A 324 ? 0.7467 0.6407 0.7154 0.0062 -0.1109 0.1369 335 GLN A CD 2123 O OE1 . GLN A 324 ? 0.7474 0.6311 0.7181 -0.0008 -0.1128 0.1419 335 GLN A OE1 2124 N NE2 . GLN A 324 ? 0.5234 0.4166 0.4949 0.0149 -0.1103 0.1273 335 GLN A NE2 2125 N N . GLN A 325 ? 0.6702 0.6096 0.6104 -0.0005 -0.1080 0.1546 336 GLN A N 2126 C CA . GLN A 325 ? 0.6304 0.5809 0.5599 -0.0044 -0.1028 0.1554 336 GLN A CA 2127 C C . GLN A 325 ? 0.7043 0.6592 0.6375 -0.0067 -0.0974 0.1443 336 GLN A C 2128 O O . GLN A 325 ? 0.7640 0.7181 0.7048 -0.0045 -0.0987 0.1346 336 GLN A O 2129 C CB . GLN A 325 ? 0.5572 0.5171 0.4724 -0.0003 -0.1067 0.1551 336 GLN A CB 2130 C CG . GLN A 325 ? 0.6625 0.6192 0.5732 0.0026 -0.1127 0.1658 336 GLN A CG 2131 C CD . GLN A 325 ? 0.8230 0.7826 0.7329 0.0076 -0.1215 0.1612 336 GLN A CD 2132 O OE1 . GLN A 325 ? 0.7666 0.7281 0.6869 0.0084 -0.1236 0.1521 336 GLN A OE1 2133 N NE2 . GLN A 325 ? 0.8235 0.7845 0.7224 0.0108 -0.1273 0.1690 336 GLN A NE2 2134 N N . THR A 326 ? 0.5558 0.5173 0.4845 -0.0107 -0.0910 0.1472 337 THR A N 2135 C CA . THR A 326 ? 0.6029 0.5696 0.5340 -0.0124 -0.0859 0.1373 337 THR A CA 2136 C C . THR A 326 ? 0.6439 0.6244 0.5596 -0.0101 -0.0817 0.1360 337 THR A C 2137 O O . THR A 326 ? 0.7173 0.7055 0.6240 -0.0098 -0.0778 0.1469 337 THR A O 2138 C CB . THR A 326 ? 0.5530 0.5141 0.4967 -0.0184 -0.0824 0.1403 337 THR A CB 2139 O OG1 . THR A 326 ? 0.5980 0.5616 0.5418 -0.0227 -0.0803 0.1558 337 THR A OG1 2140 C CG2 . THR A 326 ? 0.5080 0.4530 0.4631 -0.0174 -0.0878 0.1366 337 THR A CG2 2141 N N . PHE A 327 ? 0.5652 0.5487 0.4774 -0.0075 -0.0828 0.1232 338 PHE A N 2142 C CA . PHE A 327 ? 0.6373 0.6305 0.5328 -0.0029 -0.0805 0.1184 338 PHE A CA 2143 C C . PHE A 327 ? 0.6970 0.6934 0.5986 -0.0048 -0.0750 0.1100 338 PHE A C 2144 O O . PHE A 327 ? 0.6605 0.6533 0.5662 -0.0043 -0.0790 0.0986 338 PHE A O 2145 C CB . PHE A 327 ? 0.5022 0.4927 0.3874 0.0023 -0.0906 0.1096 338 PHE A CB 2146 C CG . PHE A 327 ? 0.6837 0.6718 0.5616 0.0050 -0.0975 0.1168 338 PHE A CG 2147 C CD1 . PHE A 327 ? 0.6926 0.6855 0.5473 0.0119 -0.0993 0.1198 338 PHE A CD1 2148 C CD2 . PHE A 327 ? 0.6813 0.6627 0.5739 0.0024 -0.1025 0.1204 338 PHE A CD2 2149 C CE1 . PHE A 327 ? 0.6771 0.6676 0.5243 0.0147 -0.1066 0.1264 338 PHE A CE1 2150 C CE2 . PHE A 327 ? 0.8019 0.7814 0.6885 0.0051 -0.1093 0.1274 338 PHE A CE2 2151 C CZ . PHE A 327 ? 0.6852 0.6690 0.5494 0.0106 -0.1117 0.1304 338 PHE A CZ 2152 N N . ASP A 328 ? 0.6602 0.6647 0.5642 -0.0071 -0.0662 0.1169 339 ASP A N 2153 C CA . ASP A 328 ? 0.6552 0.6636 0.5664 -0.0089 -0.0610 0.1100 339 ASP A CA 2154 C C . ASP A 328 ? 0.7038 0.7252 0.5983 -0.0015 -0.0558 0.1071 339 ASP A C 2155 O O . ASP A 328 ? 0.7697 0.8039 0.6559 0.0016 -0.0492 0.1184 339 ASP A O 2156 C CB . ASP A 328 ? 0.7024 0.7107 0.6312 -0.0169 -0.0564 0.1191 339 ASP A CB 2157 C CG . ASP A 328 ? 0.7780 0.7704 0.7206 -0.0215 -0.0626 0.1189 339 ASP A CG 2158 O OD1 . ASP A 328 ? 0.9260 0.9108 0.8665 -0.0182 -0.0685 0.1121 339 ASP A OD1 2159 O OD2 . ASP A 328 ? 0.7948 0.7821 0.7506 -0.0275 -0.0624 0.1258 339 ASP A OD2 2160 N N . THR A 329 ? 0.5568 0.5757 0.4464 0.0023 -0.0588 0.0929 340 THR A N 2161 C CA . THR A 329 ? 0.6091 0.6379 0.4808 0.0118 -0.0549 0.0880 340 THR A CA 2162 C C . THR A 329 ? 0.6436 0.6749 0.5238 0.0109 -0.0510 0.0797 340 THR A C 2163 O O . THR A 329 ? 0.6675 0.6914 0.5659 0.0032 -0.0527 0.0759 340 THR A O 2164 C CB . THR A 329 ? 0.6770 0.6981 0.5271 0.0211 -0.0655 0.0771 340 THR A CB 2165 O OG1 . THR A 329 ? 0.5237 0.5313 0.3844 0.0168 -0.0755 0.0657 340 THR A OG1 2166 C CG2 . THR A 329 ? 0.6503 0.6701 0.4887 0.0237 -0.0699 0.0852 340 THR A CG2 2167 N N . ARG A 330 ? 0.5697 0.6123 0.4351 0.0205 -0.0454 0.0774 341 ARG A N 2168 C CA . ARG A 330 ? 0.6581 0.7022 0.5266 0.0228 -0.0434 0.0674 341 ARG A CA 2169 C C . ARG A 330 ? 0.7792 0.8181 0.6222 0.0364 -0.0502 0.0539 341 ARG A C 2170 O O . ARG A 330 ? 0.7357 0.7822 0.5555 0.0484 -0.0481 0.0563 341 ARG A O 2171 C CB . ARG A 330 ? 0.5517 0.6155 0.4284 0.0228 -0.0302 0.0778 341 ARG A CB 2172 C CG . ARG A 330 ? 0.4722 0.5394 0.3501 0.0272 -0.0277 0.0677 341 ARG A CG 2173 C CD . ARG A 330 ? 0.4747 0.5659 0.3578 0.0304 -0.0144 0.0793 341 ARG A CD 2174 N NE . ARG A 330 ? 0.6940 0.7888 0.5742 0.0378 -0.0124 0.0686 341 ARG A NE 2175 C CZ . ARG A 330 ? 0.5968 0.7140 0.4788 0.0445 -0.0013 0.0758 341 ARG A CZ 2176 N NH1 . ARG A 330 ? 0.7058 0.8455 0.5944 0.0438 0.0091 0.0955 341 ARG A NH1 2177 N NH2 . ARG A 330 ? 0.5706 0.6887 0.4496 0.0519 -0.0007 0.0648 341 ARG A NH2 2178 N N . ASP A 331 ? 0.6044 0.6294 0.4511 0.0353 -0.0593 0.0402 342 ASP A N 2179 C CA . ASP A 331 ? 0.6200 0.6343 0.4447 0.0471 -0.0700 0.0260 342 ASP A CA 2180 C C . ASP A 331 ? 0.7393 0.7643 0.5511 0.0594 -0.0620 0.0216 342 ASP A C 2181 O O . ASP A 331 ? 0.8848 0.9105 0.7099 0.0563 -0.0592 0.0172 342 ASP A O 2182 C CB . ASP A 331 ? 0.6858 0.6823 0.5239 0.0399 -0.0834 0.0158 342 ASP A CB 2183 C CG . ASP A 331 ? 0.9035 0.8836 0.7213 0.0498 -0.0998 0.0020 342 ASP A CG 2184 O OD1 . ASP A 331 ? 1.0473 1.0129 0.8751 0.0432 -0.1142 -0.0020 342 ASP A OD1 2185 O OD2 . ASP A 331 ? 0.8656 0.8473 0.6576 0.0649 -0.0990 -0.0044 342 ASP A OD2 2186 N N . MET A 332 ? 0.6735 0.7079 0.4586 0.0747 -0.0581 0.0231 343 MET A N 2187 C CA . MET A 332 ? 0.7806 0.8301 0.5529 0.0890 -0.0479 0.0215 343 MET A CA 2188 C C . MET A 332 ? 0.8785 0.9104 0.6296 0.1027 -0.0605 0.0016 343 MET A C 2189 O O . MET A 332 ? 0.7928 0.8343 0.5306 0.1174 -0.0540 -0.0028 343 MET A O 2190 C CB . MET A 332 ? 0.6524 0.7244 0.4058 0.1015 -0.0357 0.0345 343 MET A CB 2191 C CG . MET A 332 ? 0.6118 0.7006 0.3879 0.0876 -0.0243 0.0561 343 MET A CG 2192 S SD . MET A 332 ? 0.7872 0.9028 0.5930 0.0797 -0.0067 0.0718 343 MET A SD 2193 C CE . MET A 332 ? 0.5748 0.7199 0.3537 0.1045 0.0074 0.0787 343 MET A CE 2194 N N . THR A 333 ? 0.8928 0.8992 0.6427 0.0980 -0.0794 -0.0097 344 THR A N 2195 C CA . THR A 333 ? 0.7795 0.7638 0.5135 0.1081 -0.0959 -0.0284 344 THR A CA 2196 C C . THR A 333 ? 0.7264 0.7093 0.4817 0.1017 -0.0936 -0.0327 344 THR A C 2197 O O . THR A 333 ? 0.7371 0.7054 0.4808 0.1114 -0.1038 -0.0468 344 THR A O 2198 C CB . THR A 333 ? 0.7997 0.7582 0.5344 0.1011 -0.1184 -0.0358 344 THR A CB 2199 O OG1 . THR A 333 ? 0.9141 0.8764 0.6387 0.1013 -0.1189 -0.0279 344 THR A OG1 2200 C CG2 . THR A 333 ? 1.1854 1.1190 0.8952 0.1156 -0.1388 -0.0548 344 THR A CG2 2201 N N . VAL A 334 ? 0.5820 0.5787 0.3675 0.0858 -0.0813 -0.0208 345 VAL A N 2202 C CA . VAL A 334 ? 0.5333 0.5298 0.3401 0.0786 -0.0787 -0.0234 345 VAL A CA 2203 C C . VAL A 334 ? 0.6813 0.6990 0.4847 0.0884 -0.0628 -0.0201 345 VAL A C 2204 O O . VAL A 334 ? 0.7571 0.7972 0.5681 0.0857 -0.0477 -0.0059 345 VAL A O 2205 C CB . VAL A 334 ? 0.5440 0.5432 0.3833 0.0583 -0.0750 -0.0135 345 VAL A CB 2206 C CG1 . VAL A 334 ? 0.4801 0.4799 0.3388 0.0525 -0.0722 -0.0160 345 VAL A CG1 2207 C CG2 . VAL A 334 ? 0.4977 0.4798 0.3431 0.0496 -0.0898 -0.0148 345 VAL A CG2 2208 N N . PRO A 335 ? 0.7270 0.7381 0.5206 0.0998 -0.0669 -0.0322 346 PRO A N 2209 C CA . PRO A 335 ? 0.7553 0.7875 0.5486 0.1097 -0.0523 -0.0293 346 PRO A CA 2210 C C . PRO A 335 ? 0.7054 0.7547 0.5322 0.0928 -0.0399 -0.0159 346 PRO A C 2211 O O . PRO A 335 ? 0.6502 0.6878 0.4980 0.0784 -0.0458 -0.0179 346 PRO A O 2212 C CB . PRO A 335 ? 0.7591 0.7726 0.5438 0.1192 -0.0640 -0.0461 346 PRO A CB 2213 C CG . PRO A 335 ? 0.5827 0.5668 0.3503 0.1219 -0.0851 -0.0584 346 PRO A CG 2214 C CD . PRO A 335 ? 0.6194 0.6019 0.4041 0.1035 -0.0871 -0.0485 346 PRO A CD 2215 N N . ALA A 336 ? 0.6776 0.7545 0.5094 0.0949 -0.0237 -0.0016 347 ALA A N 2216 C CA . ALA A 336 ? 0.6236 0.7156 0.4867 0.0794 -0.0142 0.0113 347 ALA A CA 2217 C C . ALA A 336 ? 0.6336 0.7288 0.5078 0.0813 -0.0125 0.0056 347 ALA A C 2218 O O . ALA A 336 ? 0.6912 0.7819 0.5888 0.0670 -0.0142 0.0068 347 ALA A O 2219 C CB . ALA A 336 ? 0.6067 0.7278 0.4746 0.0806 0.0005 0.0303 347 ALA A CB 2220 N N . PHE A 337 ? 0.6239 0.7264 0.4796 0.1005 -0.0095 -0.0010 348 PHE A N 2221 C CA . PHE A 337 ? 0.7455 0.8559 0.6118 0.1043 -0.0056 -0.0040 348 PHE A CA 2222 C C . PHE A 337 ? 0.7407 0.8255 0.5948 0.1121 -0.0192 -0.0233 348 PHE A C 2223 O O . PHE A 337 ? 0.6640 0.7306 0.4917 0.1246 -0.0297 -0.0356 348 PHE A O 2224 C CB . PHE A 337 ? 0.8115 0.9544 0.6716 0.1206 0.0098 0.0059 348 PHE A CB 2225 C CG . PHE A 337 ? 0.7965 0.9666 0.6725 0.1121 0.0225 0.0281 348 PHE A CG 2226 C CD1 . PHE A 337 ? 0.6401 0.8237 0.4964 0.1235 0.0291 0.0363 348 PHE A CD1 2227 C CD2 . PHE A 337 ? 0.8983 1.0787 0.8085 0.0927 0.0262 0.0410 348 PHE A CD2 2228 C CE1 . PHE A 337 ? 0.6244 0.8330 0.4977 0.1146 0.0400 0.0589 348 PHE A CE1 2229 C CE2 . PHE A 337 ? 0.7733 0.9759 0.7004 0.0836 0.0352 0.0623 348 PHE A CE2 2230 C CZ . PHE A 337 ? 0.7273 0.9447 0.6372 0.0940 0.0424 0.0721 348 PHE A CZ 2231 N N . LEU A 338 ? 0.5695 0.6518 0.4434 0.1044 -0.0205 -0.0255 349 LEU A N 2232 C CA . LEU A 338 ? 0.5737 0.6327 0.4413 0.1098 -0.0333 -0.0412 349 LEU A CA 2233 C C . LEU A 338 ? 0.6884 0.7531 0.5339 0.1341 -0.0311 -0.0497 349 LEU A C 2234 O O . LEU A 338 ? 0.5853 0.6789 0.4335 0.1429 -0.0161 -0.0407 349 LEU A O 2235 C CB . LEU A 338 ? 0.6592 0.7172 0.5546 0.0951 -0.0338 -0.0389 349 LEU A CB 2236 C CG . LEU A 338 ? 0.6341 0.6828 0.5493 0.0740 -0.0379 -0.0332 349 LEU A CG 2237 C CD1 . LEU A 338 ? 0.5808 0.6372 0.5206 0.0635 -0.0339 -0.0282 349 LEU A CD1 2238 C CD2 . LEU A 338 ? 0.5949 0.6152 0.5037 0.0710 -0.0542 -0.0429 349 LEU A CD2 2239 N N . THR A 339 ? 0.7186 0.7556 0.5429 0.1455 -0.0468 -0.0665 350 THR A N 2240 C CA . THR A 339 ? 0.6194 0.6558 0.4190 0.1713 -0.0477 -0.0778 350 THR A CA 2241 C C . THR A 339 ? 0.8402 0.8534 0.6450 0.1718 -0.0611 -0.0901 350 THR A C 2242 O O . THR A 339 ? 0.8524 0.8452 0.6742 0.1539 -0.0730 -0.0916 350 THR A O 2243 C CB . THR A 339 ? 0.6912 0.7115 0.4529 0.1903 -0.0575 -0.0891 350 THR A CB 2244 O OG1 . THR A 339 ? 0.7613 0.7433 0.5190 0.1824 -0.0807 -0.1013 350 THR A OG1 2245 C CG2 . THR A 339 ? 0.7228 0.7637 0.4790 0.1885 -0.0459 -0.0760 350 THR A CG2 2246 N N . LYS A 340 ? 0.9214 0.9391 0.7118 0.1934 -0.0588 -0.0979 351 LYS A N 2247 C CA . LYS A 340 ? 0.7775 0.7734 0.5713 0.1967 -0.0715 -0.1095 351 LYS A CA 2248 C C . LYS A 340 ? 0.8282 0.7810 0.6108 0.1938 -0.0972 -0.1237 351 LYS A C 2249 O O . LYS A 340 ? 0.8994 0.8318 0.6965 0.1849 -0.1100 -0.1280 351 LYS A O 2250 C CB . LYS A 340 ? 0.6321 0.6385 0.4060 0.2252 -0.0657 -0.1170 351 LYS A CB 2251 C CG . LYS A 340 ? 0.6417 0.6243 0.4184 0.2299 -0.0796 -0.1292 351 LYS A CG 2252 C CD . LYS A 340 ? 0.6647 0.6625 0.4264 0.2575 -0.0712 -0.1345 351 LYS A CD 2253 C CE . LYS A 340 ? 0.9906 0.9623 0.7572 0.2605 -0.0863 -0.1460 351 LYS A CE 2254 N NZ . LYS A 340 ? 1.1883 1.1679 0.9340 0.2919 -0.0821 -0.1549 351 LYS A NZ 2255 N N . ALA A 341 ? 0.8505 0.7903 0.6087 0.2009 -0.1057 -0.1295 352 ALA A N 2256 C CA . ALA A 341 ? 0.8855 0.7845 0.6339 0.1981 -0.1325 -0.1419 352 ALA A CA 2257 C C . ALA A 341 ? 0.7944 0.6848 0.5769 0.1683 -0.1394 -0.1324 352 ALA A C 2258 O O . ALA A 341 ? 0.8330 0.6937 0.6222 0.1616 -0.1604 -0.1387 352 ALA A O 2259 C CB . ALA A 341 ? 0.9229 0.8125 0.6391 0.2110 -0.1397 -0.1487 352 ALA A CB 2260 N N . VAL A 342 ? 0.6552 0.5720 0.4594 0.1512 -0.1222 -0.1164 353 VAL A N 2261 C CA . VAL A 342 ? 0.7620 0.6743 0.5959 0.1257 -0.1263 -0.1065 353 VAL A CA 2262 C C . VAL A 342 ? 0.9152 0.8353 0.7760 0.1153 -0.1205 -0.1005 353 VAL A C 2263 O O . VAL A 342 ? 1.0434 0.9523 0.9253 0.0994 -0.1292 -0.0960 353 VAL A O 2264 C CB . VAL A 342 ? 0.7621 0.6939 0.6042 0.1132 -0.1138 -0.0935 353 VAL A CB 2265 C CG1 . VAL A 342 ? 0.6570 0.5951 0.4696 0.1293 -0.1097 -0.0968 353 VAL A CG1 2266 C CG2 . VAL A 342 ? 0.7859 0.7463 0.6513 0.1025 -0.0937 -0.0800 353 VAL A CG2 2267 N N . PHE A 343 ? 0.8479 0.7886 0.7079 0.1252 -0.1058 -0.0996 354 PHE A N 2268 C CA . PHE A 343 ? 0.7796 0.7270 0.6617 0.1184 -0.1014 -0.0956 354 PHE A CA 2269 C C . PHE A 343 ? 0.8023 0.7202 0.6822 0.1229 -0.1209 -0.1062 354 PHE A C 2270 O O . PHE A 343 ? 0.9139 0.8236 0.8154 0.1087 -0.1273 -0.1012 354 PHE A O 2271 C CB . PHE A 343 ? 0.7129 0.6885 0.5937 0.1303 -0.0838 -0.0927 354 PHE A CB 2272 C CG . PHE A 343 ? 0.6276 0.6324 0.5296 0.1165 -0.0663 -0.0774 354 PHE A CG 2273 C CD1 . PHE A 343 ? 0.5625 0.5830 0.4849 0.1115 -0.0583 -0.0713 354 PHE A CD1 2274 C CD2 . PHE A 343 ? 0.6865 0.7014 0.5882 0.1088 -0.0598 -0.0692 354 PHE A CD2 2275 C CE1 . PHE A 343 ? 0.4964 0.5404 0.4382 0.0989 -0.0456 -0.0580 354 PHE A CE1 2276 C CE2 . PHE A 343 ? 0.5764 0.6145 0.4978 0.0962 -0.0465 -0.0554 354 PHE A CE2 2277 C CZ . PHE A 343 ? 0.6071 0.6589 0.5485 0.0912 -0.0402 -0.0501 354 PHE A CZ 2278 N N . ASP A 344 ? 0.8857 0.7873 0.7385 0.1437 -0.1309 -0.1203 355 ASP A N 2279 C CA . ASP A 344 ? 0.9047 0.7737 0.7527 0.1501 -0.1526 -0.1319 355 ASP A CA 2280 C C . ASP A 344 ? 0.8415 0.6843 0.7020 0.1331 -0.1729 -0.1297 355 ASP A C 2281 O O . ASP A 344 ? 0.8949 0.7201 0.7720 0.1248 -0.1864 -0.1285 355 ASP A O 2282 C CB . ASP A 344 ? 0.8467 0.7003 0.6582 0.1784 -0.1614 -0.1492 355 ASP A CB 2283 C CG . ASP A 344 ? 0.9705 0.8511 0.7722 0.1978 -0.1422 -0.1503 355 ASP A CG 2284 O OD1 . ASP A 344 ? 0.8585 0.7650 0.6847 0.1878 -0.1261 -0.1387 355 ASP A OD1 2285 O OD2 . ASP A 344 ? 0.8495 0.7260 0.6188 0.2240 -0.1439 -0.1625 355 ASP A OD2 2286 N N . ALA A 345 ? 0.7763 0.6185 0.6304 0.1276 -0.1748 -0.1274 356 ALA A N 2287 C CA . ALA A 345 ? 0.8188 0.6407 0.6870 0.1111 -0.1931 -0.1229 356 ALA A CA 2288 C C . ALA A 345 ? 0.8269 0.6608 0.7312 0.0892 -0.1872 -0.1068 356 ALA A C 2289 O O . ALA A 345 ? 0.8744 0.6901 0.7962 0.0791 -0.2038 -0.1030 356 ALA A O 2290 C CB . ALA A 345 ? 0.6062 0.4323 0.4631 0.1091 -0.1920 -0.1212 356 ALA A CB 2291 N N . ASN A 346 ? 0.7663 0.6306 0.6812 0.0826 -0.1642 -0.0966 357 ASN A N 2292 C CA . ASN A 346 ? 0.8008 0.6779 0.7452 0.0651 -0.1571 -0.0823 357 ASN A CA 2293 C C . ASN A 346 ? 0.8432 0.7135 0.7996 0.0656 -0.1619 -0.0824 357 ASN A C 2294 O O . ASN A 346 ? 0.8962 0.7628 0.8750 0.0527 -0.1680 -0.0724 357 ASN A O 2295 C CB . ASN A 346 ? 0.7696 0.6770 0.7194 0.0606 -0.1339 -0.0739 357 ASN A CB 2296 C CG . ASN A 346 ? 0.7959 0.7101 0.7396 0.0564 -0.1296 -0.0700 357 ASN A CG 2297 O OD1 . ASN A 346 ? 0.9500 0.8479 0.8889 0.0545 -0.1435 -0.0720 357 ASN A OD1 2298 N ND2 . ASN A 346 ? 0.6796 0.6170 0.6249 0.0543 -0.1116 -0.0639 357 ASN A ND2 2299 N N . LYS A 347 ? 0.8065 0.6768 0.7484 0.0813 -0.1588 -0.0926 358 LYS A N 2300 C CA . LYS A 347 ? 0.7724 0.6357 0.7241 0.0835 -0.1636 -0.0936 358 LYS A CA 2301 C C . LYS A 347 ? 0.8613 0.6921 0.8182 0.0804 -0.1891 -0.0959 358 LYS A C 2302 O O . LYS A 347 ? 0.9004 0.7275 0.8790 0.0704 -0.1945 -0.0870 358 LYS A O 2303 C CB . LYS A 347 ? 0.6540 0.5229 0.5876 0.1036 -0.1567 -0.1047 358 LYS A CB 2304 C CG . LYS A 347 ? 0.6677 0.5711 0.6035 0.1048 -0.1325 -0.0989 358 LYS A CG 2305 C CD . LYS A 347 ? 0.8592 0.7714 0.7823 0.1244 -0.1259 -0.1070 358 LYS A CD 2306 C CE . LYS A 347 ? 0.8604 0.8085 0.7873 0.1254 -0.1033 -0.0994 358 LYS A CE 2307 N NZ . LYS A 347 ? 0.8506 0.8131 0.7748 0.1412 -0.0955 -0.1026 358 LYS A NZ 2308 N N . LYS A 348 ? 0.9412 0.7485 0.8788 0.0890 -0.2059 -0.1071 359 LYS A N 2309 C CA . LYS A 348 ? 1.0329 0.8058 0.9762 0.0853 -0.2342 -0.1095 359 LYS A CA 2310 C C . LYS A 348 ? 0.9838 0.7604 0.9604 0.0621 -0.2389 -0.0904 359 LYS A C 2311 O O . LYS A 348 ? 1.1267 0.8870 1.1223 0.0544 -0.2551 -0.0840 359 LYS A O 2312 C CB . LYS A 348 ? 1.2841 1.0321 1.2006 0.0966 -0.2520 -0.1237 359 LYS A CB 2313 C CG . LYS A 348 ? 1.4773 1.1872 1.4021 0.0907 -0.2852 -0.1254 359 LYS A CG 2314 C CD . LYS A 348 ? 1.5469 1.2283 1.4402 0.1054 -0.3055 -0.1429 359 LYS A CD 2315 C CE . LYS A 348 ? 1.5329 1.1710 1.4336 0.1015 -0.3427 -0.1467 359 LYS A CE 2316 N NZ . LYS A 348 ? 1.5109 1.1161 1.3765 0.1188 -0.3660 -0.1668 359 LYS A NZ 2317 N N . GLN A 349 ? 0.9284 0.7279 0.9126 0.0516 -0.2242 -0.0802 360 GLN A N 2318 C CA . GLN A 349 ? 1.0954 0.9030 1.1097 0.0322 -0.2261 -0.0611 360 GLN A CA 2319 C C . GLN A 349 ? 1.0197 0.8525 1.0540 0.0244 -0.2078 -0.0475 360 GLN A C 2320 O O . GLN A 349 ? 1.1188 0.9509 1.1777 0.0138 -0.2145 -0.0335 360 GLN A O 2321 C CB . GLN A 349 ? 1.2062 1.0235 1.2192 0.0257 -0.2222 -0.0566 360 GLN A CB 2322 C CG . GLN A 349 ? 1.3069 1.1005 1.3266 0.0191 -0.2480 -0.0548 360 GLN A CG 2323 C CD . GLN A 349 ? 1.5132 1.2990 1.5657 0.0052 -0.2632 -0.0390 360 GLN A CD 2324 O OE1 . GLN A 349 ? 1.6261 1.4343 1.7013 -0.0042 -0.2497 -0.0226 360 GLN A OE1 2325 N NE2 . GLN A 349 ? 1.5070 1.2608 1.5619 0.0047 -0.2924 -0.0433 360 GLN A NE2 2326 N N . ALA A 350 ? 0.8513 0.7064 0.8754 0.0301 -0.1858 -0.0506 361 ALA A N 2327 C CA . ALA A 350 ? 0.6889 0.5676 0.7286 0.0235 -0.1689 -0.0389 361 ALA A CA 2328 C C . ALA A 350 ? 0.7433 0.6245 0.7809 0.0315 -0.1638 -0.0437 361 ALA A C 2329 O O . ALA A 350 ? 0.6437 0.5399 0.6946 0.0265 -0.1541 -0.0342 361 ALA A O 2330 C CB . ALA A 350 ? 0.4257 0.3275 0.4603 0.0214 -0.1498 -0.0363 361 ALA A CB 2331 N N . GLY A 351 ? 0.8025 0.6697 0.8221 0.0453 -0.1702 -0.0585 362 GLY A N 2332 C CA . GLY A 351 ? 0.6849 0.5565 0.7013 0.0549 -0.1644 -0.0639 362 GLY A CA 2333 C C . GLY A 351 ? 0.5160 0.4141 0.5244 0.0599 -0.1431 -0.0659 362 GLY A C 2334 O O . GLY A 351 ? 0.7598 0.6709 0.7649 0.0558 -0.1334 -0.0632 362 GLY A O 2335 N N . SER A 352 ? 0.4711 0.3772 0.4783 0.0687 -0.1368 -0.0697 363 SER A N 2336 C CA . SER A 352 ? 0.4801 0.4130 0.4858 0.0717 -0.1182 -0.0688 363 SER A CA 2337 C C . SER A 352 ? 0.5910 0.5412 0.6125 0.0573 -0.1079 -0.0563 363 SER A C 2338 O O . SER A 352 ? 0.6246 0.5693 0.6589 0.0474 -0.1132 -0.0478 363 SER A O 2339 C CB . SER A 352 ? 0.5949 0.5325 0.5998 0.0833 -0.1159 -0.0737 363 SER A CB 2340 O OG . SER A 352 ? 0.8370 0.7570 0.8247 0.0994 -0.1260 -0.0864 363 SER A OG 2341 N N . LEU A 353 ? 0.6344 0.6059 0.6552 0.0570 -0.0937 -0.0545 364 LEU A N 2342 C CA . LEU A 353 ? 0.5985 0.5837 0.6306 0.0456 -0.0855 -0.0449 364 LEU A CA 2343 C C . LEU A 353 ? 0.5213 0.5222 0.5614 0.0469 -0.0782 -0.0429 364 LEU A C 2344 O O . LEU A 353 ? 0.6239 0.6353 0.6609 0.0552 -0.0732 -0.0470 364 LEU A O 2345 C CB . LEU A 353 ? 0.6071 0.6013 0.6340 0.0416 -0.0780 -0.0430 364 LEU A CB 2346 C CG . LEU A 353 ? 0.5912 0.5733 0.6114 0.0383 -0.0840 -0.0431 364 LEU A CG 2347 C CD1 . LEU A 353 ? 0.5289 0.4943 0.5567 0.0334 -0.0964 -0.0398 364 LEU A CD1 2348 C CD2 . LEU A 353 ? 0.7905 0.7684 0.7936 0.0489 -0.0856 -0.0519 364 LEU A CD2 2349 N N . PRO A 354 ? 0.4264 0.4300 0.4767 0.0395 -0.0778 -0.0358 365 PRO A N 2350 C CA . PRO A 354 ? 0.5320 0.5493 0.5895 0.0396 -0.0726 -0.0337 365 PRO A CA 2351 C C . PRO A 354 ? 0.5753 0.6090 0.6330 0.0390 -0.0641 -0.0337 365 PRO A C 2352 O O . PRO A 354 ? 0.6349 0.6700 0.6900 0.0334 -0.0610 -0.0313 365 PRO A O 2353 C CB . PRO A 354 ? 0.3272 0.3435 0.3900 0.0321 -0.0734 -0.0261 365 PRO A CB 2354 C CG . PRO A 354 ? 0.3387 0.3411 0.4017 0.0300 -0.0803 -0.0229 365 PRO A CG 2355 C CD . PRO A 354 ? 0.3842 0.3789 0.4394 0.0320 -0.0827 -0.0287 365 PRO A CD 2356 N N . GLY A 355 ? 0.5229 0.5696 0.5855 0.0445 -0.0608 -0.0350 366 GLY A N 2357 C CA . GLY A 355 ? 0.6034 0.6685 0.6712 0.0428 -0.0534 -0.0316 366 GLY A CA 2358 C C . GLY A 355 ? 0.6369 0.7110 0.6980 0.0511 -0.0478 -0.0336 366 GLY A C 2359 O O . GLY A 355 ? 0.7886 0.8824 0.8570 0.0510 -0.0409 -0.0284 366 GLY A O 2360 N N . ASN A 356 ? 0.4277 0.4879 0.4751 0.0587 -0.0515 -0.0404 367 ASN A N 2361 C CA . ASN A 356 ? 0.5955 0.6627 0.6313 0.0695 -0.0466 -0.0435 367 ASN A CA 2362 C C . ASN A 356 ? 0.4980 0.5849 0.5377 0.0818 -0.0405 -0.0432 367 ASN A C 2363 O O . ASN A 356 ? 0.6088 0.6927 0.6524 0.0875 -0.0444 -0.0467 367 ASN A O 2364 C CB . ASN A 356 ? 0.3806 0.4250 0.3987 0.0764 -0.0550 -0.0524 367 ASN A CB 2365 C CG . ASN A 356 ? 0.6294 0.6600 0.6426 0.0875 -0.0634 -0.0606 367 ASN A CG 2366 O OD1 . ASN A 356 ? 0.7704 0.8082 0.7759 0.1029 -0.0607 -0.0656 367 ASN A OD1 2367 N ND2 . ASN A 356 ? 0.8145 0.8258 0.8325 0.0808 -0.0738 -0.0611 367 ASN A ND2 2368 N N . GLY A 357 ? 0.5412 0.6504 0.5817 0.0860 -0.0305 -0.0374 368 GLY A N 2369 C CA . GLY A 357 ? 0.5950 0.7293 0.6422 0.0980 -0.0226 -0.0338 368 GLY A CA 2370 C C . GLY A 357 ? 0.5712 0.7268 0.6441 0.0871 -0.0192 -0.0224 368 GLY A C 2371 O O . GLY A 357 ? 0.7567 0.9401 0.8415 0.0935 -0.0113 -0.0144 368 GLY A O 2372 N N . LYS A 358 ? 0.4392 0.5821 0.5208 0.0714 -0.0259 -0.0211 369 LYS A N 2373 C CA . LYS A 358 ? 0.5626 0.7197 0.6664 0.0610 -0.0266 -0.0123 369 LYS A CA 2374 C C . LYS A 358 ? 0.5203 0.6830 0.6327 0.0472 -0.0253 -0.0031 369 LYS A C 2375 O O . LYS A 358 ? 0.5110 0.6590 0.6116 0.0425 -0.0262 -0.0055 369 LYS A O 2376 C CB . LYS A 358 ? 0.4682 0.6080 0.5742 0.0562 -0.0361 -0.0174 369 LYS A CB 2377 C CG . LYS A 358 ? 0.4499 0.5874 0.5526 0.0692 -0.0381 -0.0238 369 LYS A CG 2378 C CD . LYS A 358 ? 0.5132 0.6327 0.6163 0.0648 -0.0473 -0.0276 369 LYS A CD 2379 C CE . LYS A 358 ? 0.5206 0.6334 0.6188 0.0778 -0.0507 -0.0342 369 LYS A CE 2380 N NZ . LYS A 358 ? 0.5401 0.6339 0.6199 0.0858 -0.0531 -0.0424 369 LYS A NZ 2381 N N . TYR A 359 ? 0.3791 0.5627 0.5135 0.0406 -0.0243 0.0080 370 TYR A N 2382 C CA . TYR A 359 ? 0.4911 0.6839 0.6370 0.0289 -0.0231 0.0192 370 TYR A CA 2383 C C . TYR A 359 ? 0.4651 0.6692 0.6370 0.0175 -0.0298 0.0288 370 TYR A C 2384 O O . TYR A 359 ? 0.3731 0.5922 0.5592 0.0212 -0.0306 0.0317 370 TYR A O 2385 C CB . TYR A 359 ? 0.3207 0.5378 0.4667 0.0370 -0.0110 0.0281 370 TYR A CB 2386 C CG . TYR A 359 ? 0.3259 0.5714 0.4828 0.0498 -0.0037 0.0336 370 TYR A CG 2387 C CD1 . TYR A 359 ? 0.4191 0.6943 0.6055 0.0440 -0.0017 0.0501 370 TYR A CD1 2388 C CD2 . TYR A 359 ? 0.3942 0.6365 0.5330 0.0679 -0.0001 0.0228 370 TYR A CD2 2389 C CE1 . TYR A 359 ? 0.3789 0.6836 0.5773 0.0566 0.0057 0.0568 370 TYR A CE1 2390 C CE2 . TYR A 359 ? 0.4076 0.6762 0.5552 0.0819 0.0068 0.0275 370 TYR A CE2 2391 C CZ . TYR A 359 ? 0.4386 0.7401 0.6164 0.0764 0.0107 0.0450 370 TYR A CZ 2392 O OH . TYR A 359 ? 0.5657 0.8972 0.7546 0.0911 0.0184 0.0515 370 TYR A OH 2393 N N . ALA A 360 ? 0.5558 0.7515 0.7341 0.0040 -0.0361 0.0338 371 ALA A N 2394 C CA . ALA A 360 ? 0.4328 0.6356 0.6357 -0.0078 -0.0458 0.0431 371 ALA A CA 2395 C C . ALA A 360 ? 0.5032 0.7403 0.7318 -0.0100 -0.0392 0.0616 371 ALA A C 2396 O O . ALA A 360 ? 0.5747 0.8236 0.7996 -0.0071 -0.0290 0.0686 371 ALA A O 2397 C CB . ALA A 360 ? 0.3547 0.5335 0.5533 -0.0197 -0.0564 0.0410 371 ALA A CB 2398 N N . GLY A 361 ? 0.4861 0.7409 0.7413 -0.0145 -0.0450 0.0709 372 GLY A N 2399 C CA . GLY A 361 ? 0.3600 0.6520 0.6456 -0.0175 -0.0394 0.0922 372 GLY A CA 2400 C C . GLY A 361 ? 0.4730 0.7930 0.7524 -0.0009 -0.0204 0.0973 372 GLY A C 2401 O O . GLY A 361 ? 0.5299 0.8485 0.7924 0.0144 -0.0144 0.0857 372 GLY A O 2402 N N . ASN A 362 ? 0.4976 0.8423 0.7897 -0.0029 -0.0116 0.1151 373 ASN A N 2403 C CA . ASN A 362 ? 0.5156 0.8871 0.7974 0.0151 0.0070 0.1204 373 ASN A CA 2404 C C . ASN A 362 ? 0.5473 0.9014 0.7996 0.0190 0.0130 0.1133 373 ASN A C 2405 O O . ASN A 362 ? 0.5190 0.8939 0.7612 0.0327 0.0272 0.1194 373 ASN A O 2406 C CB . ASN A 362 ? 0.6184 1.0376 0.9353 0.0139 0.0156 0.1484 373 ASN A CB 2407 C CG . ASN A 362 ? 0.9552 1.3770 1.2975 -0.0074 0.0076 0.1669 373 ASN A CG 2408 O OD1 . ASN A 362 ? 1.0376 1.4255 1.3663 -0.0184 -0.0021 0.1575 373 ASN A OD1 2409 N ND2 . ASN A 362 ? 1.0339 1.4967 1.4148 -0.0129 0.0112 0.1943 373 ASN A ND2 2410 N N . HIS A 363 ? 0.4637 0.7805 0.7016 0.0081 0.0019 0.1005 374 HIS A N 2411 C CA . HIS A 363 ? 0.5593 0.8576 0.7710 0.0100 0.0054 0.0937 374 HIS A CA 2412 C C . HIS A 363 ? 0.6084 0.8938 0.7868 0.0285 0.0116 0.0756 374 HIS A C 2413 O O . HIS A 363 ? 0.3270 0.5802 0.4855 0.0275 0.0043 0.0588 374 HIS A O 2414 C CB . HIS A 363 ? 0.3622 0.6263 0.5702 -0.0059 -0.0085 0.0863 374 HIS A CB 2415 C CG . HIS A 363 ? 0.6482 0.8940 0.8326 -0.0052 -0.0060 0.0807 374 HIS A CG 2416 N ND1 . HIS A 363 ? 0.7617 1.0251 0.9465 -0.0037 0.0033 0.0939 374 HIS A ND1 2417 C CD2 . HIS A 363 ? 0.7788 0.9923 0.9399 -0.0056 -0.0116 0.0647 374 HIS A CD2 2418 C CE1 . HIS A 363 ? 0.8508 1.0916 1.0125 -0.0034 0.0025 0.0850 374 HIS A CE1 2419 N NE2 . HIS A 363 ? 0.8017 1.0128 0.9499 -0.0047 -0.0065 0.0676 374 HIS A NE2 2420 N N . LYS A 364 ? 0.5401 0.8515 0.7131 0.0461 0.0243 0.0800 375 LYS A N 2421 C CA . LYS A 364 ? 0.4272 0.7271 0.5698 0.0660 0.0281 0.0629 375 LYS A CA 2422 C C . LYS A 364 ? 0.4340 0.7016 0.5459 0.0675 0.0242 0.0481 375 LYS A C 2423 O O . LYS A 364 ? 0.5803 0.8281 0.6694 0.0792 0.0211 0.0315 375 LYS A O 2424 C CB . LYS A 364 ? 0.4038 0.7390 0.5430 0.0868 0.0431 0.0721 375 LYS A CB 2425 C CG . LYS A 364 ? 0.4133 0.7633 0.5580 0.1013 0.0457 0.0689 375 LYS A CG 2426 C CD . LYS A 364 ? 0.4570 0.8232 0.6391 0.0865 0.0408 0.0813 375 LYS A CD 2427 C CE . LYS A 364 ? 0.4453 0.8373 0.6366 0.1031 0.0468 0.0837 375 LYS A CE 2428 N NZ . LYS A 364 ? 0.4106 0.8383 0.5951 0.1249 0.0639 0.0946 375 LYS A NZ 2429 N N . TYR A 365 ? 0.5006 0.7619 0.6137 0.0550 0.0229 0.0546 376 TYR A N 2430 C CA . TYR A 365 ? 0.5793 0.8216 0.6649 0.0596 0.0229 0.0461 376 TYR A CA 2431 C C . TYR A 365 ? 0.8073 1.0152 0.8855 0.0459 0.0117 0.0364 376 TYR A C 2432 O O . TYR A 365 ? 1.2652 1.4684 1.3378 0.0403 0.0122 0.0408 376 TYR A O 2433 C CB . TYR A 365 ? 0.6693 0.9366 0.7586 0.0604 0.0332 0.0635 376 TYR A CB 2434 C CG . TYR A 365 ? 0.7183 0.9830 0.7769 0.0760 0.0390 0.0582 376 TYR A CG 2435 C CD1 . TYR A 365 ? 0.7904 1.0227 0.8212 0.0820 0.0310 0.0384 376 TYR A CD1 2436 C CD2 . TYR A 365 ? 0.6329 0.9286 0.6912 0.0848 0.0517 0.0745 376 TYR A CD2 2437 C CE1 . TYR A 365 ? 0.7893 1.0175 0.7915 0.0965 0.0338 0.0330 376 TYR A CE1 2438 C CE2 . TYR A 365 ? 0.6551 0.9483 0.6827 0.1007 0.0564 0.0693 376 TYR A CE2 2439 C CZ . TYR A 365 ? 0.7904 1.0485 0.7893 0.1065 0.0466 0.0476 376 TYR A CZ 2440 O OH . TYR A 365 ? 0.8578 1.1116 0.8252 0.1226 0.0488 0.0418 376 TYR A OH 2441 N N . GLY A 366 ? 0.6217 0.8074 0.6995 0.0413 0.0022 0.0248 377 GLY A N 2442 C CA . GLY A 366 ? 0.7564 0.9447 0.8414 0.0463 -0.0001 0.0197 377 GLY A CA 2443 C C . GLY A 366 ? 0.7282 0.8904 0.8137 0.0369 -0.0112 0.0103 377 GLY A C 2444 O O . GLY A 366 ? 0.7556 0.9089 0.8493 0.0235 -0.0165 0.0137 377 GLY A O 2445 N N . GLY A 367 ? 0.6100 0.7595 0.6858 0.0453 -0.0152 -0.0011 378 GLY A N 2446 C CA . GLY A 367 ? 0.5102 0.6667 0.5739 0.0629 -0.0107 -0.0065 378 GLY A CA 2447 C C . GLY A 367 ? 0.6438 0.7799 0.6824 0.0709 -0.0138 -0.0170 378 GLY A C 2448 O O . GLY A 367 ? 0.6765 0.7931 0.7040 0.0773 -0.0213 -0.0282 378 GLY A O 2449 N N . LEU A 368 ? 0.4985 0.6382 0.5289 0.0699 -0.0096 -0.0126 379 LEU A N 2450 C CA . LEU A 368 ? 0.4558 0.5773 0.4618 0.0778 -0.0135 -0.0219 379 LEU A CA 2451 C C . LEU A 368 ? 0.5195 0.6219 0.5244 0.0637 -0.0200 -0.0221 379 LEU A C 2452 O O . LEU A 368 ? 0.6327 0.7428 0.6418 0.0558 -0.0157 -0.0134 379 LEU A O 2453 C CB . LEU A 368 ? 0.5426 0.6828 0.5352 0.0915 -0.0039 -0.0176 379 LEU A CB 2454 C CG . LEU A 368 ? 0.5640 0.7285 0.5560 0.1092 0.0048 -0.0156 379 LEU A CG 2455 C CD1 . LEU A 368 ? 0.4543 0.6362 0.4282 0.1251 0.0144 -0.0114 379 LEU A CD1 2456 C CD2 . LEU A 368 ? 0.5605 0.7069 0.5415 0.1215 -0.0035 -0.0306 379 LEU A CD2 2457 N N . PHE A 369 ? 0.5685 0.6467 0.5689 0.0610 -0.0304 -0.0309 380 PHE A N 2458 C CA . PHE A 369 ? 0.5850 0.6466 0.5852 0.0494 -0.0365 -0.0305 380 PHE A CA 2459 C C . PHE A 369 ? 0.5154 0.5531 0.5054 0.0530 -0.0482 -0.0402 380 PHE A C 2460 O O . PHE A 369 ? 0.5642 0.5956 0.5526 0.0605 -0.0529 -0.0465 380 PHE A O 2461 C CB . PHE A 369 ? 0.4864 0.5497 0.5047 0.0356 -0.0365 -0.0240 380 PHE A CB 2462 C CG . PHE A 369 ? 0.4568 0.5172 0.4840 0.0358 -0.0401 -0.0268 380 PHE A CG 2463 C CD1 . PHE A 369 ? 0.5793 0.6221 0.6062 0.0330 -0.0484 -0.0306 380 PHE A CD1 2464 C CD2 . PHE A 369 ? 0.5649 0.6420 0.6024 0.0388 -0.0355 -0.0241 380 PHE A CD2 2465 C CE1 . PHE A 369 ? 0.5435 0.5843 0.5780 0.0337 -0.0516 -0.0320 380 PHE A CE1 2466 C CE2 . PHE A 369 ? 0.6301 0.7043 0.6751 0.0395 -0.0394 -0.0267 380 PHE A CE2 2467 C CZ . PHE A 369 ? 0.5038 0.5594 0.5464 0.0372 -0.0473 -0.0308 380 PHE A CZ 2468 N N . THR A 370 ? 0.5025 0.5269 0.4872 0.0474 -0.0540 -0.0403 381 THR A N 2469 C CA . THR A 370 ? 0.5460 0.5478 0.5243 0.0489 -0.0672 -0.0471 381 THR A CA 2470 C C . THR A 370 ? 0.5755 0.5690 0.5615 0.0365 -0.0718 -0.0415 381 THR A C 2471 O O . THR A 370 ? 0.6000 0.6034 0.5934 0.0284 -0.0647 -0.0340 381 THR A O 2472 C CB . THR A 370 ? 0.5038 0.4965 0.4603 0.0621 -0.0727 -0.0560 381 THR A CB 2473 O OG1 . THR A 370 ? 0.6225 0.5904 0.5753 0.0632 -0.0891 -0.0629 381 THR A OG1 2474 C CG2 . THR A 370 ? 0.4183 0.4155 0.3660 0.0601 -0.0691 -0.0523 381 THR A CG2 2475 N N . ASN A 371 ? 0.5486 0.5238 0.5335 0.0354 -0.0846 -0.0443 382 ASN A N 2476 C CA . ASN A 371 ? 0.6004 0.5704 0.5953 0.0245 -0.0892 -0.0371 382 ASN A CA 2477 C C . ASN A 371 ? 0.5969 0.5684 0.5835 0.0228 -0.0877 -0.0353 382 ASN A C 2478 O O . ASN A 371 ? 0.8342 0.7995 0.8047 0.0305 -0.0920 -0.0418 382 ASN A O 2479 C CB . ASN A 371 ? 0.7186 0.6703 0.7190 0.0229 -0.1049 -0.0380 382 ASN A CB 2480 C CG . ASN A 371 ? 0.7400 0.6888 0.7489 0.0245 -0.1075 -0.0388 382 ASN A CG 2481 O OD1 . ASN A 371 ? 0.7419 0.6820 0.7416 0.0341 -0.1127 -0.0478 382 ASN A OD1 2482 N ND2 . ASN A 371 ? 0.6730 0.6290 0.6983 0.0168 -0.1040 -0.0292 382 ASN A ND2 2483 N N . GLY A 372 ? 0.4876 0.5256 0.4145 0.0813 0.0013 0.0548 383 GLY A N 2484 C CA . GLY A 372 ? 0.4666 0.4988 0.3928 0.0697 0.0038 0.0508 383 GLY A CA 2485 C C . GLY A 372 ? 0.5734 0.5857 0.4955 0.0663 0.0056 0.0565 383 GLY A C 2486 O O . GLY A 372 ? 0.7867 0.7842 0.7104 0.0715 0.0058 0.0621 383 GLY A O 2487 N N . GLU A 373 ? 0.5872 0.5992 0.5065 0.0574 0.0066 0.0560 384 GLU A N 2488 C CA . GLU A 373 ? 0.6822 0.6812 0.6000 0.0541 0.0091 0.0630 384 GLU A CA 2489 C C . GLU A 373 ? 0.6646 0.6735 0.5742 0.0566 0.0093 0.0676 384 GLU A C 2490 O O . GLU A 373 ? 0.6907 0.7137 0.5965 0.0584 0.0055 0.0620 384 GLU A O 2491 C CB . GLU A 373 ? 0.5990 0.5908 0.5193 0.0442 0.0100 0.0581 384 GLU A CB 2492 C CG . GLU A 373 ? 0.7273 0.7310 0.6453 0.0382 0.0090 0.0517 384 GLU A CG 2493 C CD . GLU A 373 ? 0.7518 0.7504 0.6721 0.0306 0.0094 0.0467 384 GLU A CD 2494 O OE1 . GLU A 373 ? 0.7105 0.7047 0.6321 0.0324 0.0093 0.0433 384 GLU A OE1 2495 O OE2 . GLU A 373 ? 0.6659 0.6651 0.5855 0.0243 0.0093 0.0458 384 GLU A OE2 2496 N N . ASN A 374 ? 0.5559 0.5585 0.4639 0.0574 0.0134 0.0776 385 ASN A N 2497 C CA . ASN A 374 ? 0.5849 0.5981 0.4818 0.0625 0.0149 0.0820 385 ASN A CA 2498 C C . ASN A 374 ? 0.5965 0.6226 0.4832 0.0738 0.0110 0.0827 385 ASN A C 2499 O O . ASN A 374 ? 0.7466 0.7844 0.6217 0.0785 0.0078 0.0781 385 ASN A O 2500 C CB . ASN A 374 ? 0.7064 0.7240 0.5998 0.0563 0.0132 0.0721 385 ASN A CB 2501 C CG . ASN A 374 ? 0.7603 0.7668 0.6630 0.0462 0.0162 0.0718 385 ASN A CG 2502 O OD1 . ASN A 374 ? 0.6453 0.6441 0.5547 0.0450 0.0209 0.0817 385 ASN A OD1 2503 N ND2 . ASN A 374 ? 0.8422 0.8485 0.7473 0.0387 0.0129 0.0615 385 ASN A ND2 2504 N N . GLY A 375 ? 0.5630 0.5866 0.4542 0.0793 0.0098 0.0871 386 GLY A N 2505 C CA . GLY A 375 ? 0.4590 0.4947 0.3415 0.0915 0.0059 0.0903 386 GLY A CA 2506 C C . GLY A 375 ? 0.6408 0.6913 0.5239 0.0920 -0.0027 0.0767 386 GLY A C 2507 O O . GLY A 375 ? 0.7511 0.8147 0.6268 0.1020 -0.0085 0.0768 386 GLY A O 2508 N N . ALA A 376 ? 0.6702 0.7201 0.5637 0.0814 -0.0040 0.0663 387 ALA A N 2509 C CA . ALA A 376 ? 0.5771 0.6423 0.4777 0.0793 -0.0114 0.0557 387 ALA A CA 2510 C C . ALA A 376 ? 0.6168 0.6878 0.5276 0.0845 -0.0120 0.0566 387 ALA A C 2511 O O . ALA A 376 ? 0.7030 0.7615 0.6168 0.0862 -0.0067 0.0611 387 ALA A O 2512 C CB . ALA A 376 ? 0.5929 0.6564 0.5018 0.0662 -0.0111 0.0478 387 ALA A CB 2513 N N . LEU A 377 ? 0.5911 0.6813 0.5087 0.0875 -0.0195 0.0515 388 LEU A N 2514 C CA . LEU A 377 ? 0.5383 0.6392 0.4694 0.0918 -0.0196 0.0509 388 LEU A CA 2515 C C . LEU A 377 ? 0.5814 0.6958 0.5291 0.0811 -0.0203 0.0440 388 LEU A C 2516 O O . LEU A 377 ? 0.6976 0.8229 0.6513 0.0746 -0.0275 0.0389 388 LEU A O 2517 C CB . LEU A 377 ? 0.4614 0.5780 0.3923 0.1041 -0.0274 0.0528 388 LEU A CB 2518 C CG . LEU A 377 ? 0.4883 0.5935 0.4031 0.1162 -0.0261 0.0632 388 LEU A CG 2519 C CD1 . LEU A 377 ? 0.4757 0.5985 0.3895 0.1297 -0.0348 0.0652 388 LEU A CD1 2520 C CD2 . LEU A 377 ? 0.5442 0.6289 0.4606 0.1185 -0.0175 0.0704 388 LEU A CD2 2521 N N . VAL A 378 ? 0.5856 0.6990 0.5408 0.0799 -0.0131 0.0442 389 VAL A N 2522 C CA . VAL A 378 ? 0.4733 0.6000 0.4432 0.0701 -0.0107 0.0413 389 VAL A CA 2523 C C . VAL A 378 ? 0.4593 0.6103 0.4462 0.0762 -0.0092 0.0422 389 VAL A C 2524 O O . VAL A 378 ? 0.4639 0.6134 0.4478 0.0884 -0.0056 0.0433 389 VAL A O 2525 C CB . VAL A 378 ? 0.4597 0.5700 0.4228 0.0643 -0.0025 0.0411 389 VAL A CB 2526 C CG1 . VAL A 378 ? 0.4299 0.5232 0.3827 0.0558 -0.0041 0.0404 389 VAL A CG1 2527 C CG2 . VAL A 378 ? 0.5943 0.6894 0.5483 0.0748 0.0022 0.0418 389 VAL A CG2 2528 N N . GLY A 379 ? 0.3995 0.5733 0.4067 0.0681 -0.0123 0.0422 390 GLY A N 2529 C CA . GLY A 379 ? 0.3979 0.6010 0.4263 0.0735 -0.0112 0.0449 390 GLY A CA 2530 C C . GLY A 379 ? 0.4312 0.6462 0.4681 0.0720 0.0006 0.0486 390 GLY A C 2531 O O . GLY A 379 ? 0.5218 0.7282 0.5553 0.0618 0.0052 0.0497 390 GLY A O 2532 N N . ALA A 380 ? 0.4558 0.6925 0.5032 0.0838 0.0058 0.0509 391 ALA A N 2533 C CA . ALA A 380 ? 0.5148 0.7668 0.5669 0.0873 0.0185 0.0546 391 ALA A CA 2534 C C . ALA A 380 ? 0.6290 0.9103 0.7089 0.0741 0.0214 0.0634 391 ALA A C 2535 O O . ALA A 380 ? 0.7351 1.0285 0.8167 0.0746 0.0331 0.0691 391 ALA A O 2536 C CB . ALA A 380 ? 0.5089 0.7756 0.5626 0.1070 0.0233 0.0536 391 ALA A CB 2537 N N . GLU A 381 ? 0.5844 0.8768 0.6864 0.0629 0.0102 0.0651 392 GLU A N 2538 C CA . GLU A 381 ? 0.6204 0.9404 0.7561 0.0487 0.0107 0.0748 392 GLU A CA 2539 C C . GLU A 381 ? 0.5865 0.8880 0.7185 0.0324 0.0108 0.0772 392 GLU A C 2540 O O . GLU A 381 ? 0.4853 0.8053 0.6438 0.0201 0.0134 0.0878 392 GLU A O 2541 C CB . GLU A 381 ? 0.6458 0.9850 0.8108 0.0431 -0.0044 0.0741 392 GLU A CB 2542 C CG . GLU A 381 ? 0.8253 1.1373 0.9768 0.0373 -0.0209 0.0633 392 GLU A CG 2543 C CD . GLU A 381 ? 0.8709 1.2020 1.0467 0.0361 -0.0380 0.0597 392 GLU A CD 2544 O OE1 . GLU A 381 ? 0.9039 1.2618 1.1188 0.0246 -0.0426 0.0661 392 GLU A OE1 2545 O OE2 . GLU A 381 ? 0.5924 0.9126 0.7495 0.0467 -0.0472 0.0514 392 GLU A OE2 2546 N N . TYR A 382 ? 0.4338 0.6997 0.5355 0.0322 0.0080 0.0687 393 TYR A N 2547 C CA . TYR A 382 ? 0.5096 0.7571 0.6049 0.0195 0.0093 0.0706 393 TYR A CA 2548 C C . TYR A 382 ? 0.3984 0.6325 0.4671 0.0274 0.0218 0.0707 393 TYR A C 2549 O O . TYR A 382 ? 0.4453 0.6712 0.4947 0.0416 0.0250 0.0647 393 TYR A O 2550 C CB . TYR A 382 ? 0.4921 0.7115 0.5752 0.0131 -0.0037 0.0610 393 TYR A CB 2551 C CG . TYR A 382 ? 0.5677 0.7970 0.6704 0.0090 -0.0193 0.0565 393 TYR A CG 2552 C CD1 . TYR A 382 ? 0.5489 0.7968 0.6868 -0.0043 -0.0260 0.0619 393 TYR A CD1 2553 C CD2 . TYR A 382 ? 0.6360 0.8562 0.7229 0.0188 -0.0281 0.0473 393 TYR A CD2 2554 C CE1 . TYR A 382 ? 0.6372 0.8936 0.7944 -0.0077 -0.0432 0.0556 393 TYR A CE1 2555 C CE2 . TYR A 382 ? 0.4481 0.6783 0.5500 0.0172 -0.0440 0.0417 393 TYR A CE2 2556 C CZ . TYR A 382 ? 0.5640 0.8118 0.7011 0.0038 -0.0525 0.0444 393 TYR A CZ 2557 O OH . TYR A 382 ? 0.6183 0.8754 0.7718 0.0022 -0.0712 0.0367 393 TYR A OH 2558 N N . GLY A 383 ? 0.4835 0.7148 0.5523 0.0186 0.0276 0.0775 394 GLY A N 2559 C CA . GLY A 383 ? 0.4538 0.6683 0.4951 0.0248 0.0359 0.0755 394 GLY A CA 2560 C C . GLY A 383 ? 0.5572 0.7390 0.5830 0.0165 0.0286 0.0693 394 GLY A C 2561 O O . GLY A 383 ? 0.5933 0.7699 0.6321 0.0044 0.0201 0.0698 394 GLY A O 2562 N N . THR A 384 ? 0.5326 0.6926 0.5322 0.0235 0.0309 0.0627 395 THR A N 2563 C CA . THR A 384 ? 0.4863 0.6190 0.4735 0.0161 0.0254 0.0584 395 THR A CA 2564 C C . THR A 384 ? 0.5643 0.6942 0.5473 0.0102 0.0303 0.0644 395 THR A C 2565 O O . THR A 384 ? 0.6432 0.7864 0.6215 0.0165 0.0390 0.0692 395 THR A O 2566 C CB . THR A 384 ? 0.4001 0.5091 0.3664 0.0243 0.0229 0.0493 395 THR A CB 2567 O OG1 . THR A 384 ? 0.5469 0.6389 0.4984 0.0228 0.0247 0.0477 395 THR A OG1 2568 C CG2 . THR A 384 ? 0.4530 0.5684 0.4144 0.0386 0.0262 0.0459 395 THR A CG2 2569 N N . GLY A 385 ? 0.5642 0.6777 0.5476 0.0000 0.0247 0.0643 396 GLY A N 2570 C CA . GLY A 385 ? 0.3700 0.4780 0.3490 -0.0054 0.0278 0.0703 396 GLY A CA 2571 C C . GLY A 385 ? 0.5470 0.6284 0.5128 -0.0085 0.0220 0.0638 396 GLY A C 2572 O O . GLY A 385 ? 0.6568 0.7272 0.6255 -0.0117 0.0148 0.0582 396 GLY A O 2573 N N . VAL A 386 ? 0.5635 0.6367 0.5146 -0.0061 0.0250 0.0644 397 VAL A N 2574 C CA . VAL A 386 ? 0.5191 0.5704 0.4604 -0.0085 0.0200 0.0593 397 VAL A CA 2575 C C . VAL A 386 ? 0.4946 0.5428 0.4376 -0.0151 0.0201 0.0670 397 VAL A C 2576 O O . VAL A 386 ? 0.6091 0.6678 0.5477 -0.0128 0.0256 0.0744 397 VAL A O 2577 C CB . VAL A 386 ? 0.5387 0.5789 0.4626 0.0002 0.0199 0.0515 397 VAL A CB 2578 C CG1 . VAL A 386 ? 0.4645 0.4871 0.3821 -0.0031 0.0156 0.0492 397 VAL A CG1 2579 C CG2 . VAL A 386 ? 0.4588 0.4956 0.3830 0.0055 0.0181 0.0452 397 VAL A CG2 2580 N N . PHE A 387 ? 0.4529 0.4872 0.4012 -0.0217 0.0140 0.0655 398 PHE A N 2581 C CA . PHE A 387 ? 0.5579 0.5874 0.5114 -0.0281 0.0127 0.0732 398 PHE A CA 2582 C C . PHE A 387 ? 0.5961 0.6071 0.5410 -0.0277 0.0079 0.0677 398 PHE A C 2583 O O . PHE A 387 ? 0.6849 0.6871 0.6272 -0.0256 0.0046 0.0592 398 PHE A O 2584 C CB . PHE A 387 ? 0.4740 0.5055 0.4494 -0.0372 0.0082 0.0777 398 PHE A CB 2585 C CG . PHE A 387 ? 0.4648 0.5171 0.4555 -0.0392 0.0118 0.0841 398 PHE A CG 2586 C CD1 . PHE A 387 ? 0.4417 0.5097 0.4438 -0.0431 0.0180 0.0995 398 PHE A CD1 2587 C CD2 . PHE A 387 ? 0.3886 0.4471 0.3834 -0.0366 0.0092 0.0763 398 PHE A CD2 2588 C CE1 . PHE A 387 ? 0.4367 0.5277 0.4567 -0.0449 0.0222 0.1072 398 PHE A CE1 2589 C CE2 . PHE A 387 ? 0.5212 0.6013 0.5329 -0.0381 0.0119 0.0824 398 PHE A CE2 2590 C CZ . PHE A 387 ? 0.5266 0.6238 0.5523 -0.0425 0.0187 0.0979 398 PHE A CZ 2591 N N . TYR A 388 ? 0.6614 0.6688 0.6029 -0.0289 0.0082 0.0742 399 TYR A N 2592 C CA . TYR A 388 ? 0.4450 0.4372 0.3830 -0.0291 0.0032 0.0709 399 TYR A CA 2593 C C . TYR A 388 ? 0.4925 0.4795 0.4414 -0.0351 0.0004 0.0799 399 TYR A C 2594 O O . TYR A 388 ? 0.6504 0.6449 0.6002 -0.0366 0.0039 0.0918 399 TYR A O 2595 C CB . TYR A 388 ? 0.4935 0.4843 0.4163 -0.0232 0.0036 0.0689 399 TYR A CB 2596 C CG . TYR A 388 ? 0.4918 0.4815 0.4072 -0.0179 0.0036 0.0593 399 TYR A CG 2597 C CD1 . TYR A 388 ? 0.5093 0.4890 0.4253 -0.0170 -0.0002 0.0532 399 TYR A CD1 2598 C CD2 . TYR A 388 ? 0.4078 0.4071 0.3181 -0.0134 0.0075 0.0575 399 TYR A CD2 2599 C CE1 . TYR A 388 ? 0.4103 0.3878 0.3237 -0.0134 -0.0006 0.0469 399 TYR A CE1 2600 C CE2 . TYR A 388 ? 0.4999 0.4951 0.4054 -0.0085 0.0063 0.0492 399 TYR A CE2 2601 C CZ . TYR A 388 ? 0.4772 0.4606 0.3851 -0.0092 0.0020 0.0445 399 TYR A CZ 2602 O OH . TYR A 388 ? 0.5179 0.4962 0.4249 -0.0054 0.0005 0.0387 399 TYR A OH 2603 N N . ASP A 389 ? 0.6240 0.5983 0.5812 -0.0373 -0.0058 0.0747 400 ASP A N 2604 C CA . ASP A 389 ? 0.6377 0.6018 0.6066 -0.0421 -0.0106 0.0813 400 ASP A CA 2605 C C . ASP A 389 ? 0.7000 0.6516 0.6624 -0.0376 -0.0143 0.0771 400 ASP A C 2606 O O . ASP A 389 ? 0.5931 0.5372 0.5554 -0.0340 -0.0178 0.0667 400 ASP A O 2607 C CB . ASP A 389 ? 0.5934 0.5517 0.5793 -0.0472 -0.0172 0.0770 400 ASP A CB 2608 C CG . ASP A 389 ? 0.6602 0.6327 0.6600 -0.0537 -0.0147 0.0850 400 ASP A CG 2609 O OD1 . ASP A 389 ? 0.7269 0.7156 0.7189 -0.0515 -0.0062 0.0904 400 ASP A OD1 2610 O OD2 . ASP A 389 ? 0.7415 0.7097 0.7615 -0.0605 -0.0218 0.0854 400 ASP A OD2 2611 N N . GLU A 390 ? 0.7438 0.6959 0.7006 -0.0364 -0.0131 0.0858 401 GLU A N 2612 C CA . GLU A 390 ? 0.6123 0.5557 0.5645 -0.0316 -0.0169 0.0831 401 GLU A CA 2613 C C . GLU A 390 ? 0.5585 0.4889 0.5223 -0.0338 -0.0223 0.0899 401 GLU A C 2614 O O . GLU A 390 ? 0.7480 0.6788 0.7194 -0.0390 -0.0217 0.1027 401 GLU A O 2615 C CB . GLU A 390 ? 0.5501 0.5018 0.4881 -0.0275 -0.0148 0.0866 401 GLU A CB 2616 C CG . GLU A 390 ? 0.5508 0.5006 0.4843 -0.0224 -0.0177 0.0778 401 GLU A CG 2617 C CD . GLU A 390 ? 0.6869 0.6453 0.6077 -0.0189 -0.0172 0.0753 401 GLU A CD 2618 O OE1 . GLU A 390 ? 0.7420 0.7075 0.6566 -0.0188 -0.0130 0.0737 401 GLU A OE1 2619 O OE2 . GLU A 390 ? 0.8337 0.7916 0.7515 -0.0154 -0.0222 0.0738 401 GLU A OE2 2620 N N . THR A 391 ? 0.7402 0.6595 0.7069 -0.0292 -0.0274 0.0823 402 THR A N 2621 C CA . THR A 391 ? 0.7179 0.6214 0.6960 -0.0292 -0.0341 0.0864 402 THR A CA 2622 C C . THR A 391 ? 0.7496 0.6496 0.7238 -0.0214 -0.0368 0.0850 402 THR A C 2623 O O . THR A 391 ? 0.7100 0.6109 0.6822 -0.0149 -0.0369 0.0740 402 THR A O 2624 C CB . THR A 391 ? 0.5157 0.4066 0.5051 -0.0296 -0.0403 0.0757 402 THR A CB 2625 O OG1 . THR A 391 ? 0.6095 0.5045 0.6073 -0.0380 -0.0399 0.0785 402 THR A OG1 2626 C CG2 . THR A 391 ? 0.5026 0.3735 0.5045 -0.0280 -0.0492 0.0778 402 THR A CG2 2627 N N . HIS A 392 ? 0.5872 0.4853 0.5610 -0.0213 -0.0384 0.0978 403 HIS A N 2628 C CA . HIS A 392 ? 0.5382 0.4356 0.5090 -0.0137 -0.0418 0.0981 403 HIS A CA 2629 C C . HIS A 392 ? 0.5729 0.4522 0.5559 -0.0107 -0.0489 0.1019 403 HIS A C 2630 O O . HIS A 392 ? 0.6851 0.5562 0.6742 -0.0150 -0.0509 0.1156 403 HIS A O 2631 C CB . HIS A 392 ? 0.4790 0.3881 0.4375 -0.0129 -0.0404 0.1085 403 HIS A CB 2632 C CG . HIS A 392 ? 0.6876 0.6120 0.6338 -0.0141 -0.0353 0.1032 403 HIS A CG 2633 N ND1 . HIS A 392 ? 0.5929 0.5282 0.5249 -0.0110 -0.0356 0.1074 403 HIS A ND1 2634 C CD2 . HIS A 392 ? 0.7675 0.6967 0.7129 -0.0167 -0.0310 0.0934 403 HIS A CD2 2635 C CE1 . HIS A 392 ? 0.6064 0.5509 0.5305 -0.0118 -0.0321 0.0994 403 HIS A CE1 2636 N NE2 . HIS A 392 ? 0.6142 0.5553 0.5469 -0.0156 -0.0288 0.0920 403 HIS A NE2 2637 N N . THR A 393 ? 0.5503 0.4240 0.5379 -0.0025 -0.0522 0.0907 404 THR A N 2638 C CA . THR A 393 ? 0.5128 0.3669 0.5119 0.0027 -0.0600 0.0910 404 THR A CA 2639 C C . THR A 393 ? 0.6088 0.4658 0.6086 0.0136 -0.0627 0.0903 404 THR A C 2640 O O . THR A 393 ? 0.6867 0.5565 0.6840 0.0199 -0.0595 0.0807 404 THR A O 2641 C CB . THR A 393 ? 0.6687 0.5105 0.6742 0.0055 -0.0634 0.0755 404 THR A CB 2642 O OG1 . THR A 393 ? 0.5362 0.3764 0.5444 -0.0051 -0.0626 0.0763 404 THR A OG1 2643 C CG2 . THR A 393 ? 0.7446 0.5628 0.7625 0.0123 -0.0735 0.0737 404 THR A CG2 2644 N N . LYS A 394 ? 0.6171 0.4634 0.6221 0.0158 -0.0685 0.1024 405 LYS A N 2645 C CA . LYS A 394 ? 0.4649 0.3123 0.4735 0.0274 -0.0728 0.1023 405 LYS A CA 2646 C C . LYS A 394 ? 0.6429 0.4659 0.6644 0.0349 -0.0809 0.0998 405 LYS A C 2647 O O . LYS A 394 ? 0.7473 0.5507 0.7765 0.0292 -0.0858 0.1090 405 LYS A O 2648 C CB . LYS A 394 ? 0.6793 0.5360 0.6815 0.0271 -0.0746 0.1178 405 LYS A CB 2649 C CG . LYS A 394 ? 0.5758 0.4322 0.5848 0.0393 -0.0812 0.1197 405 LYS A CG 2650 C CD . LYS A 394 ? 0.6748 0.5410 0.6756 0.0405 -0.0848 0.1345 405 LYS A CD 2651 C CE . LYS A 394 ? 0.6083 0.4735 0.6184 0.0533 -0.0926 0.1365 405 LYS A CE 2652 N NZ . LYS A 394 ? 0.8000 0.6755 0.8008 0.0563 -0.0981 0.1504 405 LYS A NZ 2653 N N . SER A 395 ? 0.5709 0.3956 0.5968 0.0481 -0.0824 0.0878 406 SER A N 2654 C CA . SER A 395 ? 0.6690 0.4707 0.7059 0.0592 -0.0909 0.0825 406 SER A CA 2655 C C . SER A 395 ? 0.7957 0.6057 0.8374 0.0732 -0.0933 0.0844 406 SER A C 2656 O O . SER A 395 ? 0.9211 0.7552 0.9610 0.0793 -0.0875 0.0785 406 SER A O 2657 C CB . SER A 395 ? 0.7326 0.5274 0.7690 0.0657 -0.0909 0.0620 406 SER A CB 2658 O OG . SER A 395 ? 0.9891 0.7713 1.0325 0.0832 -0.0973 0.0519 406 SER A OG 2659 N N . ARG A 396 ? 0.6706 0.4613 0.7210 0.0782 -0.1021 0.0942 407 ARG A N 2660 C CA . ARG A 396 ? 0.7298 0.5281 0.7863 0.0922 -0.1058 0.0977 407 ARG A CA 2661 C C . ARG A 396 ? 0.7649 0.5356 0.8335 0.1062 -0.1154 0.0926 407 ARG A C 2662 O O . ARG A 396 ? 0.9433 0.6844 1.0181 0.1014 -0.1230 0.0985 407 ARG A O 2663 C CB . ARG A 396 ? 0.8113 0.6177 0.8639 0.0866 -0.1081 0.1183 407 ARG A CB 2664 C CG . ARG A 396 ? 0.8972 0.7013 0.9587 0.1006 -0.1162 0.1261 407 ARG A CG 2665 C CD . ARG A 396 ? 1.0406 0.8775 1.1020 0.1065 -0.1143 0.1247 407 ARG A CD 2666 N NE . ARG A 396 ? 1.0896 0.9268 1.1592 0.1191 -0.1232 0.1346 407 ARG A NE 2667 C CZ . ARG A 396 ? 0.9498 0.7883 1.0127 0.1167 -0.1290 0.1525 407 ARG A CZ 2668 N NH1 . ARG A 396 ? 0.9332 0.7735 0.9804 0.1029 -0.1259 0.1623 407 ARG A NH1 2669 N NH2 . ARG A 396 ? 0.8668 0.7062 0.9376 0.1299 -0.1379 0.1609 407 ARG A NH2 2670 N N . TYR A 397 ? 0.7530 0.5338 0.8269 0.1241 -0.1153 0.0819 408 TYR A N 2671 C CA . TYR A 397 ? 0.6892 0.4456 0.7743 0.1413 -0.1250 0.0764 408 TYR A CA 2672 C C . TYR A 397 ? 0.8055 0.5825 0.8982 0.1568 -0.1253 0.0804 408 TYR A C 2673 O O . TYR A 397 ? 0.9145 0.7238 1.0072 0.1626 -0.1168 0.0738 408 TYR A O 2674 C CB . TYR A 397 ? 0.7325 0.4775 0.8161 0.1526 -0.1253 0.0526 408 TYR A CB 2675 C CG . TYR A 397 ? 1.2287 0.9500 1.3226 0.1743 -0.1356 0.0429 408 TYR A CG 2676 C CD1 . TYR A 397 ? 1.3498 1.0315 1.4546 0.1728 -0.1496 0.0500 408 TYR A CD1 2677 C CD2 . TYR A 397 ? 1.3627 1.1016 1.4567 0.1971 -0.1313 0.0278 408 TYR A CD2 2678 C CE1 . TYR A 397 ? 1.3161 0.9728 1.4310 0.1937 -0.1605 0.0402 408 TYR A CE1 2679 C CE2 . TYR A 397 ? 1.3750 1.0924 1.4775 0.2196 -0.1409 0.0174 408 TYR A CE2 2680 C CZ . TYR A 397 ? 1.2293 0.9038 1.3419 0.2179 -0.1563 0.0227 408 TYR A CZ 2681 O OH . TYR A 397 ? 0.9731 0.6228 1.0947 0.2412 -0.1674 0.0114 408 TYR A OH 2682 N N . GLY A 398 ? 0.8456 0.6051 0.9472 0.1632 -0.1354 0.0930 409 GLY A N 2683 C CA . GLY A 398 ? 0.7333 0.5133 0.8437 0.1775 -0.1374 0.0987 409 GLY A CA 2684 C C . GLY A 398 ? 0.8190 0.5729 0.9419 0.1943 -0.1494 0.1030 409 GLY A C 2685 O O . GLY A 398 ? 0.8776 0.5946 1.0031 0.1903 -0.1581 0.1099 409 GLY A O 2686 N N . LEU A 399 ? 0.9083 0.6822 1.0416 0.2134 -0.1500 0.0997 410 LEU A N 2687 C CA . LEU A 399 ? 0.8579 0.6118 1.0042 0.2322 -0.1615 0.1044 410 LEU A CA 2688 C C . LEU A 399 ? 0.8276 0.6115 0.9809 0.2373 -0.1639 0.1195 410 LEU A C 2689 O O . LEU A 399 ? 1.0183 0.8424 1.1733 0.2355 -0.1561 0.1168 410 LEU A O 2690 C CB . LEU A 399 ? 0.8387 0.5875 0.9926 0.2565 -0.1612 0.0820 410 LEU A CB 2691 C CG . LEU A 399 ? 0.9698 0.6731 1.1222 0.2616 -0.1688 0.0669 410 LEU A CG 2692 C CD1 . LEU A 399 ? 0.9545 0.6505 1.0936 0.2408 -0.1636 0.0604 410 LEU A CD1 2693 C CD2 . LEU A 399 ? 1.0533 0.7589 1.2100 0.2905 -0.1682 0.0434 410 LEU A CD2 2694 N N . GLU A 400 ? 0.8571 0.6217 1.0161 0.2435 -0.1756 0.1360 411 GLU A N 2695 C CA . GLU A 400 ? 0.7273 0.5191 0.8927 0.2505 -0.1806 0.1501 411 GLU A CA 2696 C C . GLU A 400 ? 0.8524 0.6252 1.0324 0.2727 -0.1928 0.1567 411 GLU A C 2697 O O . GLU A 400 ? 0.9074 0.6412 1.0859 0.2730 -0.1966 0.1597 411 GLU A O 2698 C CB . GLU A 400 ? 0.7604 0.5584 0.9108 0.2316 -0.1826 0.1707 411 GLU A CB 2699 C CG . GLU A 400 ? 0.9048 0.6634 1.0492 0.2259 -0.1902 0.1900 411 GLU A CG 2700 C CD . GLU A 400 ? 1.0270 0.7978 1.1545 0.2122 -0.1913 0.2121 411 GLU A CD 2701 O OE1 . GLU A 400 ? 0.8777 0.6838 1.0012 0.2141 -0.1927 0.2140 411 GLU A OE1 2702 O OE2 . GLU A 400 ? 1.1828 0.9291 1.3014 0.2001 -0.1911 0.2274 411 GLU A OE2 2703 N N . TYR A 401 ? 0.8521 0.6572 1.0453 0.2881 -0.1951 0.1576 412 TYR A N 2704 C CA . TYR A 401 ? 0.8342 0.6332 1.0360 0.3048 -0.2019 0.1662 412 TYR A CA 2705 C C . TYR A 401 ? 0.9570 0.7828 1.1557 0.3007 -0.2084 0.1856 412 TYR A C 2706 O O . TYR A 401 ? 0.8920 0.7566 1.0969 0.2978 -0.2089 0.1841 412 TYR A O 2707 C CB . TYR A 401 ? 0.7972 0.6145 1.0183 0.3293 -0.1986 0.1497 412 TYR A CB 2708 C CG . TYR A 401 ? 0.8211 0.6493 1.0538 0.3457 -0.2044 0.1604 412 TYR A CG 2709 C CD1 . TYR A 401 ? 0.8638 0.6562 1.0956 0.3547 -0.2086 0.1651 412 TYR A CD1 2710 C CD2 . TYR A 401 ? 0.8025 0.6772 1.0490 0.3517 -0.2066 0.1659 412 TYR A CD2 2711 C CE1 . TYR A 401 ? 0.8873 0.6894 1.1295 0.3706 -0.2140 0.1756 412 TYR A CE1 2712 C CE2 . TYR A 401 ? 0.8520 0.7381 1.1095 0.3670 -0.2126 0.1757 412 TYR A CE2 2713 C CZ . TYR A 401 ? 0.9364 0.7859 1.1907 0.3771 -0.2159 0.1809 412 TYR A CZ 2714 O OH . TYR A 401 ? 0.8915 0.7522 1.1569 0.3933 -0.2219 0.1914 412 TYR A OH 2715 N N . VAL A 402 ? 0.8175 0.6234 1.0068 0.3009 -0.2139 0.2033 413 VAL A N 2716 C CA . VAL A 402 ? 0.8765 0.7056 1.0568 0.2986 -0.2208 0.2212 413 VAL A CA 2717 C C . VAL A 402 ? 0.8530 0.6811 1.0401 0.3177 -0.2274 0.2303 413 VAL A C 2718 O O . VAL A 402 ? 0.8887 0.6813 1.0733 0.3227 -0.2279 0.2369 413 VAL A O 2719 C CB . VAL A 402 ? 0.9317 0.7436 1.0863 0.2791 -0.2204 0.2385 413 VAL A CB 2720 C CG1 . VAL A 402 ? 0.8435 0.6774 0.9841 0.2813 -0.2282 0.2558 413 VAL A CG1 2721 C CG2 . VAL A 402 ? 0.7878 0.6064 0.9355 0.2602 -0.2143 0.2308 413 VAL A CG2 2722 N N . TYR A 403 ? 0.9845 0.8524 1.1823 0.3280 -0.2331 0.2308 414 TYR A N 2723 C CA . TYR A 403 ? 1.1198 0.9927 1.3247 0.3470 -0.2401 0.2402 414 TYR A CA 2724 C C . TYR A 403 ? 1.1258 1.0149 1.3120 0.3436 -0.2496 0.2579 414 TYR A C 2725 O O . TYR A 403 ? 1.1484 1.0758 1.3368 0.3396 -0.2547 0.2551 414 TYR A O 2726 C CB . TYR A 403 ? 0.8629 0.7714 1.0975 0.3646 -0.2396 0.2271 414 TYR A CB 2727 C CG . TYR A 403 ? 0.9361 0.8562 1.1815 0.3848 -0.2470 0.2367 414 TYR A CG 2728 C CD1 . TYR A 403 ? 1.0155 0.9032 1.2650 0.3998 -0.2462 0.2400 414 TYR A CD1 2729 C CD2 . TYR A 403 ? 0.8838 0.8472 1.1367 0.3890 -0.2558 0.2418 414 TYR A CD2 2730 C CE1 . TYR A 403 ? 0.9602 0.8587 1.2205 0.4191 -0.2528 0.2496 414 TYR A CE1 2731 C CE2 . TYR A 403 ? 0.9116 0.8874 1.1751 0.4079 -0.2629 0.2509 414 TYR A CE2 2732 C CZ . TYR A 403 ? 1.0208 0.9643 1.2879 0.4233 -0.2608 0.2556 414 TYR A CZ 2733 O OH . TYR A 403 ? 1.0230 0.9789 1.3018 0.4427 -0.2678 0.2657 414 TYR A OH 2734 N N . THR A 404 ? 1.2142 1.0740 1.3818 0.3454 -0.2523 0.2755 415 THR A N 2735 C CA . THR A 404 ? 1.3830 1.2567 1.5291 0.3471 -0.2616 0.2924 415 THR A CA 2736 C C . THR A 404 ? 1.4159 1.2982 1.5729 0.3702 -0.2698 0.2987 415 THR A C 2737 O O . THR A 404 ? 1.4821 1.3496 1.6595 0.3833 -0.2667 0.2938 415 THR A O 2738 C CB . THR A 404 ? 1.4132 1.2528 1.5293 0.3355 -0.2591 0.3106 415 THR A CB 2739 O OG1 . THR A 404 ? 1.5672 1.3644 1.6898 0.3405 -0.2550 0.3163 415 THR A OG1 2740 C CG2 . THR A 404 ? 1.2278 1.0653 1.3322 0.3127 -0.2510 0.3061 415 THR A CG2 2741 N N . ASN A 405 ? 1.3908 1.2977 1.5340 0.3764 -0.2808 0.3086 416 ASN A N 2742 C CA . ASN A 405 ? 1.4025 1.3198 1.5546 0.3990 -0.2897 0.3161 416 ASN A CA 2743 C C . ASN A 405 ? 1.3826 1.3141 1.5069 0.4045 -0.3029 0.3297 416 ASN A C 2744 O O . ASN A 405 ? 1.3757 1.3496 1.5049 0.4043 -0.3113 0.3233 416 ASN A O 2745 C CB . ASN A 405 ? 1.4012 1.3578 1.5910 0.4099 -0.2906 0.3014 416 ASN A CB 2746 C CG . ASN A 405 ? 1.2882 1.2514 1.4934 0.4341 -0.2965 0.3092 416 ASN A CG 2747 O OD1 . ASN A 405 ? 1.0650 0.9917 1.2602 0.4439 -0.2962 0.3213 416 ASN A OD1 2748 N ND2 . ASN A 405 ? 1.2022 1.2119 1.4341 0.4416 -0.3019 0.3023 416 ASN A ND2 2749 N N . ALA A 406 ? 1.5060 1.4009 1.6024 0.4066 -0.3051 0.3470 417 ALA A N 2750 C CA . ALA A 406 ? 1.6227 1.5223 1.6914 0.4131 -0.3194 0.3589 417 ALA A CA 2751 C C . ALA A 406 ? 1.6808 1.5409 1.7449 0.4268 -0.3206 0.3759 417 ALA A C 2752 O O . ALA A 406 ? 1.7047 1.5245 1.7564 0.4184 -0.3130 0.3881 417 ALA A O 2753 C CB . ALA A 406 ? 1.6317 1.5243 1.6644 0.3956 -0.3219 0.3647 417 ALA A CB 2754 N N . ASP A 407 ? 1.7959 1.6668 1.8720 0.4471 -0.3293 0.3780 418 ASP A N 2755 C CA . ASP A 407 ? 1.8165 1.7367 1.9066 0.4577 -0.3398 0.3677 418 ASP A CA 2756 C C . ASP A 407 ? 1.7087 1.6739 1.8371 0.4535 -0.3319 0.3502 418 ASP A C 2757 O O . ASP A 407 ? 1.7798 1.7340 1.9298 0.4483 -0.3195 0.3423 418 ASP A O 2758 C CB . ASP A 407 ? 1.9113 1.8269 2.0113 0.4813 -0.3469 0.3767 418 ASP A CB 2759 C CG . ASP A 407 ? 1.8889 1.7718 2.0118 0.4897 -0.3341 0.3810 418 ASP A CG 2760 O OD1 . ASP A 407 ? 1.8116 1.6463 1.9160 0.4894 -0.3330 0.3956 418 ASP A OD1 2761 O OD2 . ASP A 407 ? 1.9043 1.8083 2.0654 0.4957 -0.3263 0.3699 418 ASP A OD2 2762 N N . LYS A 408 ? 1.5433 1.5586 1.6822 0.4556 -0.3408 0.3448 419 LYS A N 2763 C CA . LYS A 408 ? 1.3503 1.4108 1.5257 0.4460 -0.3372 0.3305 419 LYS A CA 2764 C C . LYS A 408 ? 1.3563 1.4526 1.5774 0.4600 -0.3396 0.3282 419 LYS A C 2765 O O . LYS A 408 ? 1.1716 1.3145 1.4117 0.4594 -0.3500 0.3289 419 LYS A O 2766 C CB . LYS A 408 ? 1.2624 1.3591 1.4256 0.4322 -0.3455 0.3285 419 LYS A CB 2767 C CG . LYS A 408 ? 1.2843 1.3482 1.3984 0.4201 -0.3452 0.3295 419 LYS A CG 2768 C CD . LYS A 408 ? 1.3258 1.4336 1.4305 0.4095 -0.3522 0.3329 419 LYS A CD 2769 C CE . LYS A 408 ? 1.3833 1.4598 1.4450 0.3947 -0.3522 0.3217 419 LYS A CE 2770 N NZ . LYS A 408 ? 1.4904 1.4934 1.5192 0.3891 -0.3597 0.3286 419 LYS A NZ 2771 N N . ASP A 409 ? 1.5673 1.6431 1.8094 0.4712 -0.3305 0.3257 420 ASP A N 2772 C CA . ASP A 409 ? 1.6208 1.7264 1.9046 0.4871 -0.3321 0.3246 420 ASP A CA 2773 C C . ASP A 409 ? 1.4528 1.5810 1.7741 0.4845 -0.3231 0.3062 420 ASP A C 2774 O O . ASP A 409 ? 1.4505 1.6113 1.8090 0.4958 -0.3242 0.3038 420 ASP A O 2775 C CB . ASP A 409 ? 1.7710 1.8425 2.0548 0.5066 -0.3296 0.3371 420 ASP A CB 2776 C CG . ASP A 409 ? 1.9918 2.0224 2.2817 0.5084 -0.3158 0.3294 420 ASP A CG 2777 O OD1 . ASP A 409 ? 2.0983 2.0879 2.3587 0.4978 -0.3110 0.3305 420 ASP A OD1 2778 O OD2 . ASP A 409 ? 2.0440 2.0842 2.3700 0.5201 -0.3102 0.3225 420 ASP A OD2 2779 N N . THR A 410 ? 1.2696 1.3819 1.5817 0.4701 -0.3137 0.2942 421 THR A N 2780 C CA . THR A 410 ? 1.1636 1.2968 1.5073 0.4680 -0.3035 0.2769 421 THR A CA 2781 C C . THR A 410 ? 1.1344 1.3063 1.4828 0.4516 -0.3082 0.2655 421 THR A C 2782 O O . THR A 410 ? 1.1864 1.3645 1.5127 0.4406 -0.3193 0.2703 421 THR A O 2783 C CB . THR A 410 ? 1.1903 1.2809 1.5263 0.4647 -0.2890 0.2699 421 THR A CB 2784 O OG1 . THR A 410 ? 1.3151 1.3570 1.6288 0.4721 -0.2891 0.2827 421 THR A OG1 2785 C CG2 . THR A 410 ? 1.1726 1.2780 1.5468 0.4753 -0.2773 0.2576 421 THR A CG2 2786 N N . TRP A 411 ? 0.9986 1.1967 1.3765 0.4503 -0.2995 0.2505 422 TRP A N 2787 C CA . TRP A 411 ? 0.9594 1.1976 1.3495 0.4364 -0.3048 0.2387 422 TRP A CA 2788 C C . TRP A 411 ? 0.9659 1.1861 1.3286 0.4146 -0.3056 0.2358 422 TRP A C 2789 O O . TRP A 411 ? 0.9144 1.1627 1.2826 0.3999 -0.3138 0.2297 422 TRP A O 2790 C CB . TRP A 411 ? 1.0196 1.2899 1.4471 0.4417 -0.2939 0.2235 422 TRP A CB 2791 C CG . TRP A 411 ? 1.1787 1.4222 1.6053 0.4424 -0.2746 0.2168 422 TRP A CG 2792 C CD1 . TRP A 411 ? 1.2463 1.4646 1.6819 0.4561 -0.2626 0.2224 422 TRP A CD1 2793 C CD2 . TRP A 411 ? 1.1724 1.4124 1.5956 0.4271 -0.2660 0.2047 422 TRP A CD2 2794 N NE1 . TRP A 411 ? 1.2353 1.4342 1.6718 0.4506 -0.2478 0.2130 422 TRP A NE1 2795 C CE2 . TRP A 411 ? 1.1789 1.3923 1.6039 0.4343 -0.2481 0.2026 422 TRP A CE2 2796 C CE3 . TRP A 411 ? 1.0705 1.3281 1.4948 0.4065 -0.2711 0.1984 422 TRP A CE3 2797 C CZ2 . TRP A 411 ? 1.0229 1.2271 1.4442 0.4240 -0.2358 0.1917 422 TRP A CZ2 2798 C CZ3 . TRP A 411 ? 0.9731 1.2206 1.3966 0.3940 -0.2579 0.1894 422 TRP A CZ3 2799 C CH2 . TRP A 411 ? 0.9371 1.1587 1.3559 0.4055 -0.2416 0.1846 422 TRP A CH2 2800 N N . ALA A 412 ? 0.9598 1.1323 1.2947 0.4107 -0.2970 0.2401 423 ALA A N 2801 C CA . ALA A 412 ? 0.8766 1.0278 1.1825 0.3888 -0.2964 0.2388 423 ALA A CA 2802 C C . ALA A 412 ? 1.0351 1.1431 1.3020 0.3891 -0.2984 0.2542 423 ALA A C 2803 O O . ALA A 412 ? 1.1855 1.2603 1.4479 0.4005 -0.2920 0.2605 423 ALA A O 2804 C CB . ALA A 412 ? 0.8000 0.9387 1.1134 0.3791 -0.2813 0.2261 423 ALA A CB 2805 N N . ASP A 413 ? 0.8931 1.0023 1.1322 0.3770 -0.3069 0.2605 424 ASP A N 2806 C CA . ASP A 413 ? 0.8959 0.9679 1.0957 0.3770 -0.3074 0.2764 424 ASP A CA 2807 C C . ASP A 413 ? 0.9730 1.0079 1.1556 0.3609 -0.2950 0.2739 424 ASP A C 2808 O O . ASP A 413 ? 0.9947 0.9908 1.1522 0.3605 -0.2909 0.2860 424 ASP A O 2809 C CB . ASP A 413 ? 0.9350 1.0270 1.1097 0.3732 -0.3205 0.2844 424 ASP A CB 2810 C CG . ASP A 413 ? 1.0752 1.2047 1.2685 0.3859 -0.3334 0.2876 424 ASP A CG 2811 O OD1 . ASP A 413 ? 0.9689 1.0980 1.1840 0.4021 -0.3321 0.2900 424 ASP A OD1 2812 O OD2 . ASP A 413 ? 1.1950 1.3557 1.3833 0.3791 -0.3450 0.2884 424 ASP A OD2 2813 N N . TYR A 414 ? 0.9172 0.9654 1.1153 0.3472 -0.2890 0.2587 425 TYR A N 2814 C CA . TYR A 414 ? 0.9342 0.9530 1.1200 0.3312 -0.2773 0.2548 425 TYR A CA 2815 C C . TYR A 414 ? 0.9616 0.9970 1.1764 0.3256 -0.2693 0.2368 425 TYR A C 2816 O O . TYR A 414 ? 1.0614 1.1365 1.2976 0.3235 -0.2743 0.2280 425 TYR A O 2817 C CB . TYR A 414 ? 0.8212 0.8382 0.9745 0.3146 -0.2803 0.2608 425 TYR A CB 2818 C CG . TYR A 414 ? 0.7979 0.7933 0.9417 0.2962 -0.2687 0.2560 425 TYR A CG 2819 C CD1 . TYR A 414 ? 0.8564 0.8098 0.9821 0.2919 -0.2595 0.2657 425 TYR A CD1 2820 C CD2 . TYR A 414 ? 0.7596 0.7770 0.9142 0.2825 -0.2674 0.2423 425 TYR A CD2 2821 C CE1 . TYR A 414 ? 0.8201 0.7557 0.9385 0.2748 -0.2492 0.2616 425 TYR A CE1 2822 C CE2 . TYR A 414 ? 0.7612 0.7597 0.9066 0.2665 -0.2570 0.2385 425 TYR A CE2 2823 C CZ . TYR A 414 ? 0.8330 0.7915 0.9601 0.2629 -0.2479 0.2480 425 TYR A CZ 2824 O OH . TYR A 414 ? 0.8613 0.8031 0.9809 0.2470 -0.2380 0.2441 425 TYR A OH 2825 N N . ALA A 415 ? 0.9149 0.9203 1.1312 0.3235 -0.2571 0.2314 426 ALA A N 2826 C CA . ALA A 415 ? 0.8111 0.8298 1.0509 0.3205 -0.2477 0.2149 426 ALA A CA 2827 C C . ALA A 415 ? 0.9031 0.8845 1.1273 0.3086 -0.2374 0.2112 426 ALA A C 2828 O O . ALA A 415 ? 1.0351 0.9776 1.2394 0.3076 -0.2359 0.2202 426 ALA A O 2829 C CB . ALA A 415 ? 0.8598 0.8908 1.1288 0.3418 -0.2436 0.2074 426 ALA A CB 2830 N N . ARG A 416 ? 0.8491 0.8434 1.0843 0.2992 -0.2301 0.1987 427 ARG A N 2831 C CA . ARG A 416 ? 0.7326 0.6961 0.9495 0.2857 -0.2175 0.1918 427 ARG A CA 2832 C C . ARG A 416 ? 0.8201 0.8023 1.0498 0.2823 -0.2022 0.1727 427 ARG A C 2833 O O . ARG A 416 ? 0.8548 0.8718 1.0925 0.2716 -0.1984 0.1677 427 ARG A O 2834 C CB . ARG A 416 ? 0.7285 0.6839 0.9163 0.2638 -0.2180 0.2004 427 ARG A CB 2835 C CG . ARG A 416 ? 0.7525 0.6774 0.9231 0.2492 -0.2057 0.1948 427 ARG A CG 2836 C CD . ARG A 416 ? 0.8040 0.7202 0.9463 0.2309 -0.2061 0.2062 427 ARG A CD 2837 N NE . ARG A 416 ? 0.9782 0.8686 1.1081 0.2167 -0.1944 0.2008 427 ARG A NE 2838 C CZ . ARG A 416 ? 0.8874 0.7903 1.0143 0.2033 -0.1834 0.1863 427 ARG A CZ 2839 N NH1 . ARG A 416 ? 0.9735 0.9129 1.1103 0.2013 -0.1823 0.1769 427 ARG A NH1 2840 N NH2 . ARG A 416 ? 0.7089 0.5879 0.8251 0.1917 -0.1743 0.1821 427 ARG A NH2 2841 N N . LEU A 417 ? 0.8978 0.8559 1.1294 0.2923 -0.1942 0.1624 428 LEU A N 2842 C CA . LEU A 417 ? 0.8495 0.8201 1.0857 0.2897 -0.1785 0.1450 428 LEU A CA 2843 C C . LEU A 417 ? 0.8772 0.8129 1.0880 0.2730 -0.1720 0.1405 428 LEU A C 2844 O O . LEU A 417 ? 0.9303 0.8249 1.1294 0.2740 -0.1779 0.1456 428 LEU A O 2845 C CB . LEU A 417 ? 0.9520 0.9238 1.2062 0.3159 -0.1743 0.1336 428 LEU A CB 2846 C CG . LEU A 417 ? 1.0949 1.0952 1.3764 0.3373 -0.1822 0.1394 428 LEU A CG 2847 C CD1 . LEU A 417 ? 1.0726 1.0749 1.3691 0.3648 -0.1754 0.1259 428 LEU A CD1 2848 C CD2 . LEU A 417 ? 1.1444 1.1974 1.4452 0.3280 -0.1815 0.1442 428 LEU A CD2 2849 N N . SER A 418 ? 0.8347 0.7869 1.0394 0.2573 -0.1605 0.1323 429 SER A N 2850 C CA . SER A 418 ? 0.8625 0.7859 1.0448 0.2410 -0.1546 0.1279 429 SER A CA 2851 C C . SER A 418 ? 0.9452 0.8844 1.1268 0.2360 -0.1396 0.1125 429 SER A C 2852 O O . SER A 418 ? 0.9428 0.9207 1.1375 0.2341 -0.1329 0.1104 429 SER A O 2853 C CB . SER A 418 ? 0.8805 0.7997 1.0448 0.2201 -0.1593 0.1414 429 SER A CB 2854 O OG . SER A 418 ? 0.8307 0.7876 0.9996 0.2101 -0.1575 0.1415 429 SER A OG 2855 N N . TYR A 419 ? 0.6152 0.5243 0.7830 0.2341 -0.1352 0.1026 430 TYR A N 2856 C CA . TYR A 419 ? 0.6174 0.5372 0.7787 0.2281 -0.1218 0.0892 430 TYR A CA 2857 C C . TYR A 419 ? 0.6879 0.5813 0.8280 0.2071 -0.1213 0.0901 430 TYR A C 2858 O O . TYR A 419 ? 0.6952 0.5517 0.8279 0.2053 -0.1292 0.0933 430 TYR A O 2859 C CB . TYR A 419 ? 0.6138 0.5274 0.7785 0.2504 -0.1167 0.0723 430 TYR A CB 2860 C CG . TYR A 419 ? 0.8085 0.7330 0.9632 0.2468 -0.1031 0.0590 430 TYR A CG 2861 C CD1 . TYR A 419 ? 0.8225 0.7896 0.9855 0.2417 -0.0908 0.0610 430 TYR A CD1 2862 C CD2 . TYR A 419 ? 0.8540 0.7460 0.9923 0.2487 -0.1037 0.0450 430 TYR A CD2 2863 C CE1 . TYR A 419 ? 0.9056 0.8833 1.0587 0.2393 -0.0779 0.0513 430 TYR A CE1 2864 C CE2 . TYR A 419 ? 0.9628 0.8660 1.0897 0.2469 -0.0920 0.0330 430 TYR A CE2 2865 C CZ . TYR A 419 ? 0.9747 0.9210 1.1080 0.2427 -0.0784 0.0371 430 TYR A CZ 2866 O OH . TYR A 419 ? 1.0749 1.0327 1.1963 0.2419 -0.0665 0.0276 430 TYR A OH 2867 N N . ASP A 420 ? 0.6211 0.5344 0.7545 0.1912 -0.1122 0.0886 431 ASP A N 2868 C CA . ASP A 420 ? 0.6796 0.5743 0.7944 0.1712 -0.1106 0.0898 431 ASP A CA 2869 C C . ASP A 420 ? 0.6786 0.5866 0.7869 0.1649 -0.0981 0.0780 431 ASP A C 2870 O O . ASP A 420 ? 0.5810 0.5218 0.6966 0.1619 -0.0906 0.0783 431 ASP A O 2871 C CB . ASP A 420 ? 0.7363 0.6399 0.8449 0.1553 -0.1151 0.1048 431 ASP A CB 2872 C CG . ASP A 420 ? 0.9115 0.7980 1.0203 0.1598 -0.1273 0.1193 431 ASP A CG 2873 O OD1 . ASP A 420 ? 0.8485 0.7032 0.9484 0.1551 -0.1311 0.1252 431 ASP A OD1 2874 O OD2 . ASP A 420 ? 1.0001 0.9060 1.1195 0.1679 -0.1336 0.1260 431 ASP A OD2 2875 N N . ARG A 421 ? 0.6407 0.5229 0.7370 0.1627 -0.0969 0.0685 432 ARG A N 2876 C CA . ARG A 421 ? 0.6832 0.5743 0.7693 0.1549 -0.0865 0.0589 432 ARG A CA 2877 C C . ARG A 421 ? 0.6787 0.5571 0.7518 0.1329 -0.0874 0.0656 432 ARG A C 2878 O O . ARG A 421 ? 0.9183 0.7666 0.9862 0.1277 -0.0943 0.0675 432 ARG A O 2879 C CB . ARG A 421 ? 0.9464 0.8206 1.0268 0.1692 -0.0854 0.0413 432 ARG A CB 2880 C CG . ARG A 421 ? 1.2678 1.1569 1.3581 0.1946 -0.0824 0.0327 432 ARG A CG 2881 C CD . ARG A 421 ? 1.4003 1.2682 1.4809 0.2115 -0.0842 0.0127 432 ARG A CD 2882 N NE . ARG A 421 ? 1.4654 1.3470 1.5320 0.2098 -0.0736 0.0026 432 ARG A NE 2883 C CZ . ARG A 421 ? 1.3126 1.1747 1.3655 0.1960 -0.0761 -0.0029 432 ARG A CZ 2884 N NH1 . ARG A 421 ? 0.8907 0.7681 0.9307 0.1968 -0.0665 -0.0115 432 ARG A NH1 2885 N NH2 . ARG A 421 ? 1.4088 1.2379 1.4622 0.1819 -0.0881 0.0017 432 ARG A NH2 2886 N N . GLN A 422 ? 0.6984 0.6001 0.7684 0.1203 -0.0807 0.0697 433 GLN A N 2887 C CA . GLN A 422 ? 0.6381 0.5320 0.6952 0.1015 -0.0804 0.0753 433 GLN A CA 2888 C C . GLN A 422 ? 0.6435 0.5488 0.6931 0.0943 -0.0703 0.0668 433 GLN A C 2889 O O . GLN A 422 ? 0.6253 0.5544 0.6813 0.0997 -0.0626 0.0624 433 GLN A O 2890 C CB . GLN A 422 ? 0.7165 0.6239 0.7733 0.0931 -0.0843 0.0884 433 GLN A CB 2891 C CG . GLN A 422 ? 0.6547 0.5586 0.6965 0.0763 -0.0829 0.0939 433 GLN A CG 2892 C CD . GLN A 422 ? 0.7311 0.6482 0.7692 0.0717 -0.0885 0.1044 433 GLN A CD 2893 O OE1 . GLN A 422 ? 0.9671 0.8782 1.0058 0.0770 -0.0966 0.1144 433 GLN A OE1 2894 N NE2 . GLN A 422 ? 0.7528 0.6871 0.7865 0.0630 -0.0852 0.1018 433 GLN A NE2 2895 N N . GLY A 423 ? 0.6068 0.4963 0.6447 0.0826 -0.0701 0.0661 434 GLY A N 2896 C CA . GLY A 423 ? 0.4729 0.3721 0.5026 0.0748 -0.0617 0.0599 434 GLY A CA 2897 C C . GLY A 423 ? 0.6365 0.5306 0.6566 0.0581 -0.0622 0.0677 434 GLY A C 2898 O O . GLY A 423 ? 0.6685 0.5434 0.6864 0.0531 -0.0679 0.0741 434 GLY A O 2899 N N . VAL A 424 ? 0.4709 0.3828 0.4868 0.0501 -0.0562 0.0682 435 VAL A N 2900 C CA . VAL A 424 ? 0.5315 0.4405 0.5366 0.0367 -0.0554 0.0734 435 VAL A CA 2901 C C . VAL A 424 ? 0.6521 0.5684 0.6516 0.0319 -0.0477 0.0658 435 VAL A C 2902 O O . VAL A 424 ? 0.5843 0.5172 0.5881 0.0348 -0.0424 0.0621 435 VAL A O 2903 C CB . VAL A 424 ? 0.5413 0.4626 0.5438 0.0321 -0.0584 0.0820 435 VAL A CB 2904 C CG1 . VAL A 424 ? 0.5410 0.4595 0.5299 0.0215 -0.0570 0.0868 435 VAL A CG1 2905 C CG2 . VAL A 424 ? 0.5737 0.4905 0.5810 0.0388 -0.0667 0.0903 435 VAL A CG2 2906 N N . GLY A 425 ? 0.6402 0.5453 0.6323 0.0245 -0.0471 0.0651 436 GLY A N 2907 C CA . GLY A 425 ? 0.5375 0.4485 0.5237 0.0206 -0.0409 0.0583 436 GLY A CA 2908 C C . GLY A 425 ? 0.5909 0.5034 0.5692 0.0092 -0.0391 0.0634 436 GLY A C 2909 O O . GLY A 425 ? 0.6727 0.5752 0.6497 0.0037 -0.0421 0.0701 436 GLY A O 2910 N N . LEU A 426 ? 0.5005 0.4263 0.4747 0.0063 -0.0338 0.0612 437 LEU A N 2911 C CA . LEU A 426 ? 0.5630 0.4918 0.5289 -0.0020 -0.0314 0.0639 437 LEU A CA 2912 C C . LEU A 426 ? 0.6339 0.5648 0.5969 -0.0034 -0.0265 0.0570 437 LEU A C 2913 O O . LEU A 426 ? 0.5684 0.5087 0.5321 -0.0008 -0.0222 0.0532 437 LEU A O 2914 C CB . LEU A 426 ? 0.5366 0.4766 0.4997 -0.0036 -0.0319 0.0663 437 LEU A CB 2915 C CG . LEU A 426 ? 0.5122 0.4527 0.4771 -0.0007 -0.0384 0.0722 437 LEU A CG 2916 C CD1 . LEU A 426 ? 0.4852 0.4362 0.4478 -0.0017 -0.0416 0.0713 437 LEU A CD1 2917 C CD2 . LEU A 426 ? 0.4164 0.3479 0.3748 -0.0024 -0.0409 0.0811 437 LEU A CD2 2918 N N . ASP A 427 ? 0.6064 0.5294 0.5682 -0.0075 -0.0275 0.0568 438 ASP A N 2919 C CA . ASP A 427 ? 0.5276 0.4517 0.4871 -0.0080 -0.0252 0.0497 438 ASP A CA 2920 C C . ASP A 427 ? 0.6188 0.5500 0.5735 -0.0150 -0.0218 0.0533 438 ASP A C 2921 O O . ASP A 427 ? 0.6927 0.6216 0.6496 -0.0208 -0.0230 0.0597 438 ASP A O 2922 C CB . ASP A 427 ? 0.7190 0.6294 0.6845 -0.0076 -0.0315 0.0454 438 ASP A CB 2923 C CG . ASP A 427 ? 0.7145 0.6261 0.6768 -0.0050 -0.0318 0.0351 438 ASP A CG 2924 O OD1 . ASP A 427 ? 0.6638 0.5807 0.6254 -0.0113 -0.0303 0.0364 438 ASP A OD1 2925 O OD2 . ASP A 427 ? 0.8546 0.7632 0.8146 0.0047 -0.0338 0.0255 438 ASP A OD2 2926 N N . ASN A 428 ? 0.5647 0.5054 0.5144 -0.0138 -0.0170 0.0504 439 ASN A N 2927 C CA . ASN A 428 ? 0.5353 0.4827 0.4799 -0.0181 -0.0139 0.0525 439 ASN A CA 2928 C C . ASN A 428 ? 0.6531 0.6040 0.5965 -0.0178 -0.0117 0.0474 439 ASN A C 2929 O O . ASN A 428 ? 0.6991 0.6539 0.6402 -0.0135 -0.0089 0.0437 439 ASN A O 2930 C CB . ASN A 428 ? 0.6580 0.6112 0.5988 -0.0170 -0.0124 0.0532 439 ASN A CB 2931 C CG . ASN A 428 ? 0.6644 0.6229 0.5980 -0.0190 -0.0102 0.0540 439 ASN A CG 2932 O OD1 . ASN A 428 ? 0.6812 0.6418 0.6125 -0.0216 -0.0091 0.0578 439 ASN A OD1 2933 N ND2 . ASN A 428 ? 0.4813 0.4424 0.4132 -0.0174 -0.0097 0.0508 439 ASN A ND2 2934 N N . HIS A 429 ? 0.6452 0.5958 0.5919 -0.0222 -0.0132 0.0487 440 HIS A N 2935 C CA . HIS A 429 ? 0.6275 0.5820 0.5748 -0.0215 -0.0135 0.0432 440 HIS A CA 2936 C C . HIS A 429 ? 0.5878 0.5528 0.5330 -0.0240 -0.0093 0.0463 440 HIS A C 2937 O O . HIS A 429 ? 0.6083 0.5777 0.5589 -0.0291 -0.0088 0.0525 440 HIS A O 2938 C CB . HIS A 429 ? 0.5750 0.5221 0.5321 -0.0243 -0.0207 0.0403 440 HIS A CB 2939 C CG . HIS A 429 ? 0.6436 0.5944 0.6012 -0.0223 -0.0240 0.0324 440 HIS A CG 2940 N ND1 . HIS A 429 ? 0.7153 0.6637 0.6858 -0.0276 -0.0317 0.0305 440 HIS A ND1 2941 C CD2 . HIS A 429 ? 0.7107 0.6681 0.6587 -0.0154 -0.0216 0.0267 440 HIS A CD2 2942 C CE1 . HIS A 429 ? 0.4473 0.4009 0.4145 -0.0234 -0.0348 0.0220 440 HIS A CE1 2943 N NE2 . HIS A 429 ? 0.6795 0.6388 0.6316 -0.0154 -0.0282 0.0202 440 HIS A NE2 2944 N N . PHE A 430 ? 0.5872 0.5570 0.5258 -0.0196 -0.0058 0.0432 441 PHE A N 2945 C CA . PHE A 430 ? 0.5212 0.4999 0.4575 -0.0194 -0.0024 0.0442 441 PHE A CA 2946 C C . PHE A 430 ? 0.5570 0.5413 0.4984 -0.0196 -0.0049 0.0411 441 PHE A C 2947 O O . PHE A 430 ? 0.5937 0.5747 0.5347 -0.0165 -0.0087 0.0355 441 PHE A O 2948 C CB . PHE A 430 ? 0.4759 0.4543 0.4059 -0.0144 0.0006 0.0425 441 PHE A CB 2949 C CG . PHE A 430 ? 0.5761 0.5612 0.5036 -0.0119 0.0032 0.0421 441 PHE A CG 2950 C CD1 . PHE A 430 ? 0.5177 0.5043 0.4410 -0.0109 0.0048 0.0429 441 PHE A CD1 2951 C CD2 . PHE A 430 ? 0.5811 0.5708 0.5089 -0.0086 0.0033 0.0401 441 PHE A CD2 2952 C CE1 . PHE A 430 ? 0.6497 0.6416 0.5704 -0.0065 0.0069 0.0414 441 PHE A CE1 2953 C CE2 . PHE A 430 ? 0.5782 0.5739 0.5046 -0.0051 0.0053 0.0400 441 PHE A CE2 2954 C CZ . PHE A 430 ? 0.5015 0.4978 0.4250 -0.0039 0.0074 0.0405 441 PHE A CZ 2955 N N . GLN A 431 ? 0.4068 0.4013 0.3529 -0.0220 -0.0031 0.0445 442 GLN A N 2956 C CA . GLN A 431 ? 0.5144 0.5174 0.4681 -0.0221 -0.0063 0.0418 442 GLN A CA 2957 C C . GLN A 431 ? 0.6382 0.6548 0.5920 -0.0197 -0.0012 0.0448 442 GLN A C 2958 O O . GLN A 431 ? 0.6515 0.6753 0.6073 -0.0215 0.0035 0.0512 442 GLN A O 2959 C CB . GLN A 431 ? 0.5078 0.5108 0.4779 -0.0299 -0.0125 0.0437 442 GLN A CB 2960 C CG . GLN A 431 ? 0.4757 0.4653 0.4469 -0.0293 -0.0212 0.0358 442 GLN A CG 2961 C CD . GLN A 431 ? 0.6008 0.5867 0.5920 -0.0380 -0.0295 0.0375 442 GLN A CD 2962 O OE1 . GLN A 431 ? 0.7259 0.7066 0.7244 -0.0439 -0.0283 0.0459 442 GLN A OE1 2963 N NE2 . GLN A 431 ? 0.4867 0.4751 0.4881 -0.0389 -0.0389 0.0303 442 GLN A NE2 2964 N N . GLN A 432 ? 0.6848 0.7056 0.6353 -0.0139 -0.0018 0.0406 443 GLN A N 2965 C CA . GLN A 432 ? 0.5218 0.5555 0.4736 -0.0098 0.0020 0.0424 443 GLN A CA 2966 C C . GLN A 432 ? 0.4896 0.5355 0.4530 -0.0100 -0.0033 0.0405 443 GLN A C 2967 O O . GLN A 432 ? 0.6636 0.7056 0.6234 -0.0067 -0.0090 0.0349 443 GLN A O 2968 C CB . GLN A 432 ? 0.4295 0.4569 0.3689 -0.0015 0.0051 0.0402 443 GLN A CB 2969 C CG . GLN A 432 ? 0.5367 0.5747 0.4765 0.0051 0.0085 0.0407 443 GLN A CG 2970 C CD . GLN A 432 ? 0.5121 0.5394 0.4422 0.0127 0.0099 0.0388 443 GLN A CD 2971 O OE1 . GLN A 432 ? 0.5697 0.5837 0.4941 0.0119 0.0102 0.0383 443 GLN A OE1 2972 N NE2 . GLN A 432 ? 0.6587 0.6917 0.5896 0.0201 0.0099 0.0384 443 GLN A NE2 2973 N N . THR A 433 ? 0.4493 0.5119 0.4271 -0.0130 -0.0015 0.0456 444 THR A N 2974 C CA . THR A 433 ? 0.4890 0.5661 0.4826 -0.0140 -0.0079 0.0442 444 THR A CA 2975 C C . THR A 433 ? 0.5380 0.6334 0.5350 -0.0070 -0.0025 0.0472 444 THR A C 2976 O O . THR A 433 ? 0.4672 0.5683 0.4601 -0.0038 0.0066 0.0521 444 THR A O 2977 C CB . THR A 433 ? 0.3208 0.4050 0.3388 -0.0258 -0.0133 0.0489 444 THR A CB 2978 O OG1 . THR A 433 ? 0.4945 0.5956 0.5243 -0.0288 -0.0042 0.0606 444 THR A OG1 2979 C CG2 . THR A 433 ? 0.3319 0.3963 0.3472 -0.0318 -0.0179 0.0468 444 THR A CG2 2980 N N . HIS A 434 ? 0.5463 0.6511 0.5494 -0.0028 -0.0087 0.0433 445 HIS A N 2981 C CA . HIS A 434 ? 0.5025 0.6275 0.5134 0.0042 -0.0053 0.0461 445 HIS A CA 2982 C C . HIS A 434 ? 0.5858 0.7269 0.6177 0.0011 -0.0161 0.0441 445 HIS A C 2983 O O . HIS A 434 ? 0.6861 0.8283 0.7123 0.0089 -0.0226 0.0386 445 HIS A O 2984 C CB . HIS A 434 ? 0.5243 0.6406 0.5156 0.0172 -0.0024 0.0425 445 HIS A CB 2985 C CG . HIS A 434 ? 0.6018 0.7364 0.5995 0.0268 0.0015 0.0447 445 HIS A CG 2986 N ND1 . HIS A 434 ? 0.6383 0.7775 0.6319 0.0330 0.0113 0.0473 445 HIS A ND1 2987 C CD2 . HIS A 434 ? 0.4310 0.5815 0.4388 0.0328 -0.0036 0.0439 445 HIS A CD2 2988 C CE1 . HIS A 434 ? 0.5927 0.7496 0.5938 0.0429 0.0128 0.0481 445 HIS A CE1 2989 N NE2 . HIS A 434 ? 0.5654 0.7297 0.5762 0.0425 0.0039 0.0467 445 HIS A NE2 2990 N N . CYS A 435 ? 0.4477 0.6012 0.5052 -0.0104 -0.0189 0.0495 446 CYS A N 2991 C CA . CYS A 435 ? 0.4303 0.5965 0.5125 -0.0160 -0.0326 0.0464 446 CYS A CA 2992 C C . CYS A 435 ? 0.4347 0.6215 0.5524 -0.0285 -0.0313 0.0581 446 CYS A C 2993 O O . CYS A 435 ? 0.4852 0.6761 0.6293 -0.0390 -0.0445 0.0567 446 CYS A O 2994 C CB . CYS A 435 ? 0.3962 0.5406 0.4696 -0.0190 -0.0463 0.0350 446 CYS A CB 2995 S SG . CYS A 435 ? 0.9752 1.0952 1.0414 -0.0282 -0.0429 0.0369 446 CYS A SG 2996 N N . SER A 436 ? 0.4355 0.6355 0.5543 -0.0269 -0.0157 0.0699 447 SER A N 2997 C CA . SER A 436 ? 0.4837 0.7084 0.6360 -0.0370 -0.0106 0.0854 447 SER A CA 2998 C C . SER A 436 ? 0.4691 0.7204 0.6206 -0.0263 0.0056 0.0950 447 SER A C 2999 O O . SER A 436 ? 0.5427 0.7859 0.6643 -0.0124 0.0130 0.0890 447 SER A O 3000 C CB . SER A 436 ? 0.4998 0.7096 0.6527 -0.0478 -0.0072 0.0934 447 SER A CB 3001 O OG . SER A 436 ? 0.4621 0.6617 0.5835 -0.0391 0.0061 0.0949 447 SER A OG 3002 N N . ALA A 437 ? 0.4340 0.7177 0.6203 -0.0323 0.0105 0.1100 448 ALA A N 3003 C CA . ALA A 437 ? 0.3865 0.6982 0.5719 -0.0216 0.0286 0.1216 448 ALA A CA 3004 C C . ALA A 437 ? 0.7452 1.0470 0.9162 -0.0248 0.0394 0.1311 448 ALA A C 3005 O O . ALA A 437 ? 1.0824 1.3795 1.2731 -0.0403 0.0355 0.1406 448 ALA A O 3006 C CB . ALA A 437 ? 0.3120 0.6649 0.5432 -0.0277 0.0306 0.1368 448 ALA A CB 3007 N N . ASP A 438 ? 0.6652 0.9618 0.8020 -0.0100 0.0512 0.1281 449 ASP A N 3008 C CA . ASP A 438 ? 0.7700 1.0550 0.8890 -0.0117 0.0591 0.1351 449 ASP A CA 3009 C C . ASP A 438 ? 0.8679 1.1861 1.0077 -0.0146 0.0733 0.1587 449 ASP A C 3010 O O . ASP A 438 ? 1.0919 1.4419 1.2336 -0.0019 0.0863 0.1661 449 ASP A O 3011 C CB . ASP A 438 ? 0.6583 0.9227 0.7337 0.0041 0.0633 0.1220 449 ASP A CB 3012 C CG . ASP A 438 ? 0.8847 1.1094 0.9405 -0.0011 0.0516 0.1080 449 ASP A CG 3013 O OD1 . ASP A 438 ? 0.7455 0.9594 0.8164 -0.0119 0.0395 0.1037 449 ASP A OD1 3014 O OD2 . ASP A 438 ? 1.1980 1.4038 1.2243 0.0061 0.0539 0.1013 449 ASP A OD2 3015 N N . GLY A 439 ? 0.7079 1.0189 0.8634 -0.0302 0.0710 0.1713 450 GLY A N 3016 C CA . GLY A 439 ? 0.9179 1.1906 1.0685 -0.0421 0.0557 0.1605 450 GLY A CA 3017 C C . GLY A 439 ? 1.2825 1.5399 1.4210 -0.0469 0.0598 0.1702 450 GLY A C 3018 O O . GLY A 439 ? 1.4863 1.7660 1.6386 -0.0494 0.0713 0.1921 450 GLY A O 3019 N N . SER A 440 ? 0.3366 0.5581 0.4501 -0.0473 0.0509 0.1558 451 SER A N 3020 C CA . SER A 440 ? 0.6604 0.8589 0.7592 -0.0440 0.0390 0.1334 451 SER A CA 3021 C C . SER A 440 ? 0.6178 0.7881 0.7245 -0.0563 0.0244 0.1270 451 SER A C 3022 O O . SER A 440 ? 0.4660 0.6210 0.5683 -0.0615 0.0243 0.1327 451 SER A O 3023 C CB . SER A 440 ? 0.5611 0.7447 0.6194 -0.0291 0.0433 0.1206 451 SER A CB 3024 O OG . SER A 440 ? 0.4539 0.6230 0.5015 -0.0241 0.0349 0.1033 451 SER A OG 3025 N N . ASP A 441 ? 0.4670 0.6309 0.5838 -0.0590 0.0115 0.1143 452 ASP A N 3026 C CA . ASP A 441 ? 0.4429 0.5838 0.5705 -0.0690 -0.0042 0.1063 452 ASP A CA 3027 C C . ASP A 441 ? 0.5609 0.6721 0.6556 -0.0621 -0.0083 0.0908 452 ASP A C 3028 O O . ASP A 441 ? 0.6745 0.7830 0.7458 -0.0510 -0.0061 0.0804 452 ASP A O 3029 C CB . ASP A 441 ? 0.6150 0.7650 0.7664 -0.0726 -0.0173 0.0985 452 ASP A CB 3030 C CG . ASP A 441 ? 0.6720 0.8084 0.8512 -0.0863 -0.0339 0.0965 452 ASP A CG 3031 O OD1 . ASP A 441 ? 0.6064 0.7172 0.7762 -0.0894 -0.0378 0.0939 452 ASP A OD1 3032 O OD2 . ASP A 441 ? 0.6784 0.8292 0.8900 -0.0936 -0.0442 0.0969 452 ASP A OD2 3033 N N . LYS A 442 ? 0.4880 0.5777 0.5832 -0.0685 -0.0143 0.0905 453 LYS A N 3034 C CA . LYS A 442 ? 0.5259 0.5902 0.5944 -0.0623 -0.0181 0.0774 453 LYS A CA 3035 C C . LYS A 442 ? 0.5376 0.5874 0.6122 -0.0637 -0.0341 0.0627 453 LYS A C 3036 O O . LYS A 442 ? 0.6319 0.6648 0.6852 -0.0565 -0.0375 0.0507 453 LYS A O 3037 C CB . LYS A 442 ? 0.5769 0.6274 0.6406 -0.0658 -0.0148 0.0856 453 LYS A CB 3038 C CG . LYS A 442 ? 0.6090 0.6403 0.6444 -0.0577 -0.0140 0.0759 453 LYS A CG 3039 C CD . LYS A 442 ? 0.8594 0.8712 0.8981 -0.0625 -0.0192 0.0784 453 LYS A CD 3040 C CE . LYS A 442 ? 0.8225 0.8415 0.8750 -0.0698 -0.0134 0.0976 453 LYS A CE 3041 N NZ . LYS A 442 ? 0.7197 0.7178 0.7777 -0.0740 -0.0199 0.1005 453 LYS A NZ 3042 N N . TYR A 443 ? 0.4608 0.5186 0.5651 -0.0722 -0.0443 0.0636 454 TYR A N 3043 C CA . TYR A 443 ? 0.5790 0.6211 0.6908 -0.0737 -0.0627 0.0483 454 TYR A CA 3044 C C . TYR A 443 ? 0.6256 0.6795 0.7381 -0.0679 -0.0714 0.0364 454 TYR A C 3045 O O . TYR A 443 ? 0.7097 0.7511 0.8171 -0.0636 -0.0862 0.0200 454 TYR A O 3046 C CB . TYR A 443 ? 0.6603 0.6961 0.8085 -0.0884 -0.0736 0.0552 454 TYR A CB 3047 C CG . TYR A 443 ? 0.6800 0.7018 0.8274 -0.0931 -0.0669 0.0673 454 TYR A CG 3048 C CD1 . TYR A 443 ? 0.6680 0.6630 0.7972 -0.0879 -0.0723 0.0568 454 TYR A CD1 3049 C CD2 . TYR A 443 ? 0.6719 0.7094 0.8358 -0.1010 -0.0548 0.0901 454 TYR A CD2 3050 C CE1 . TYR A 443 ? 0.7359 0.7185 0.8646 -0.0913 -0.0670 0.0682 454 TYR A CE1 3051 C CE2 . TYR A 443 ? 0.7311 0.7566 0.8923 -0.1040 -0.0490 0.1024 454 TYR A CE2 3052 C CZ . TYR A 443 ? 0.7362 0.7336 0.8804 -0.0995 -0.0558 0.0911 454 TYR A CZ 3053 O OH . TYR A 443 ? 0.9125 0.8985 1.0546 -0.1016 -0.0509 0.1037 454 TYR A OH 3054 N N . CYS A 444 ? 0.4570 0.5357 0.5747 -0.0662 -0.0626 0.0443 455 CYS A N 3055 C CA . CYS A 444 ? 0.3892 0.4815 0.5082 -0.0598 -0.0705 0.0349 455 CYS A CA 3056 C C . CYS A 444 ? 0.4751 0.5547 0.5567 -0.0448 -0.0707 0.0212 455 CYS A C 3057 O O . CYS A 444 ? 0.4295 0.4980 0.4864 -0.0392 -0.0593 0.0232 455 CYS A O 3058 C CB . CYS A 444 ? 0.4815 0.6034 0.6122 -0.0587 -0.0591 0.0471 455 CYS A CB 3059 S SG . CYS A 444 ? 0.8207 0.9453 0.9176 -0.0460 -0.0378 0.0529 455 CYS A SG 3060 N N . ARG A 445 ? 0.4739 0.5561 0.5527 -0.0382 -0.0841 0.0083 456 ARG A N 3061 C CA . ARG A 445 ? 0.5148 0.5889 0.5591 -0.0227 -0.0838 -0.0020 456 ARG A CA 3062 C C . ARG A 445 ? 0.5189 0.6115 0.5616 -0.0139 -0.0884 -0.0053 456 ARG A C 3063 O O . ARG A 445 ? 0.4443 0.5534 0.5144 -0.0199 -0.0979 -0.0052 456 ARG A O 3064 C CB . ARG A 445 ? 0.5211 0.5754 0.5541 -0.0186 -0.0974 -0.0173 456 ARG A CB 3065 C CG . ARG A 445 ? 0.3984 0.4324 0.4298 -0.0243 -0.0938 -0.0155 456 ARG A CG 3066 C CD . ARG A 445 ? 0.4307 0.4599 0.4380 -0.0186 -0.0757 -0.0074 456 ARG A CD 3067 N NE . ARG A 445 ? 0.7207 0.7506 0.7415 -0.0296 -0.0651 0.0068 456 ARG A NE 3068 C CZ . ARG A 445 ? 0.6642 0.6790 0.6872 -0.0350 -0.0637 0.0097 456 ARG A CZ 3069 N NH1 . ARG A 445 ? 0.7358 0.7330 0.7493 -0.0303 -0.0718 -0.0013 456 ARG A NH1 3070 N NH2 . ARG A 445 ? 0.6382 0.6565 0.6710 -0.0432 -0.0539 0.0237 456 ARG A NH2 3071 N N . PRO A 446 ? 0.5531 0.6441 0.5663 0.0003 -0.0818 -0.0067 457 PRO A N 3072 C CA . PRO A 446 ? 0.3890 0.4954 0.3967 0.0112 -0.0871 -0.0097 457 PRO A CA 3073 C C . PRO A 446 ? 0.4524 0.5605 0.4634 0.0147 -0.1085 -0.0250 457 PRO A C 3074 O O . PRO A 446 ? 0.5620 0.6541 0.5626 0.0163 -0.1170 -0.0359 457 PRO A O 3075 C CB . PRO A 446 ? 0.4283 0.5260 0.4024 0.0248 -0.0760 -0.0070 457 PRO A CB 3076 C CG . PRO A 446 ? 0.5777 0.6629 0.5485 0.0184 -0.0613 0.0014 457 PRO A CG 3077 C CD . PRO A 446 ? 0.7310 0.8079 0.7187 0.0057 -0.0674 -0.0020 457 PRO A CD 3078 N N . SER A 447 ? 0.4996 0.6276 0.5251 0.0171 -0.1182 -0.0268 458 SER A N 3079 C CA . SER A 447 ? 0.5386 0.6706 0.5705 0.0203 -0.1418 -0.0427 458 SER A CA 3080 C C . SER A 447 ? 0.5200 0.6752 0.5546 0.0298 -0.1481 -0.0425 458 SER A C 3081 O O . SER A 447 ? 0.5760 0.7456 0.6182 0.0300 -0.1353 -0.0293 458 SER A O 3082 C CB . SER A 447 ? 0.5938 0.7252 0.6657 0.0022 -0.1551 -0.0461 458 SER A CB 3083 O OG . SER A 447 ? 0.6835 0.8358 0.7899 -0.0095 -0.1479 -0.0313 458 SER A OG 3084 N N . ALA A 448 ? 0.5038 0.6626 0.5312 0.0393 -0.1690 -0.0580 459 ALA A N 3085 C CA . ALA A 448 ? 0.4574 0.6380 0.4827 0.0513 -0.1769 -0.0586 459 ALA A CA 3086 C C . ALA A 448 ? 0.4568 0.6620 0.5252 0.0398 -0.1779 -0.0495 459 ALA A C 3087 O O . ALA A 448 ? 0.5937 0.8175 0.6618 0.0487 -0.1735 -0.0420 459 ALA A O 3088 C CB . ALA A 448 ? 0.4757 0.6566 0.4880 0.0628 -0.2025 -0.0790 459 ALA A CB 3089 N N . ASP A 449 ? 0.6116 0.8176 0.7183 0.0206 -0.1830 -0.0488 460 ASP A N 3090 C CA . ASP A 449 ? 0.5910 0.8243 0.7434 0.0088 -0.1830 -0.0380 460 ASP A CA 3091 C C . ASP A 449 ? 0.5747 0.8133 0.7282 0.0058 -0.1554 -0.0183 460 ASP A C 3092 O O . ASP A 449 ? 0.5957 0.8595 0.7819 -0.0005 -0.1494 -0.0065 460 ASP A O 3093 C CB . ASP A 449 ? 0.7340 0.9676 0.9310 -0.0110 -0.1998 -0.0423 460 ASP A CB 3094 C CG . ASP A 449 ? 1.0359 1.2482 1.2367 -0.0246 -0.1872 -0.0348 460 ASP A CG 3095 O OD1 . ASP A 449 ? 1.0858 1.2764 1.2478 -0.0169 -0.1732 -0.0347 460 ASP A OD1 3096 O OD2 . ASP A 449 ? 1.1529 1.3713 1.3974 -0.0431 -0.1916 -0.0276 460 ASP A OD2 3097 N N . LYS A 450 ? 0.3831 0.5993 0.5013 0.0114 -0.1390 -0.0153 461 LYS A N 3098 C CA . LYS A 450 ? 0.4466 0.6643 0.5602 0.0110 -0.1150 0.0001 461 LYS A CA 3099 C C . LYS A 450 ? 0.5701 0.7771 0.6440 0.0280 -0.1035 0.0017 461 LYS A C 3100 O O . LYS A 450 ? 0.4668 0.6514 0.5153 0.0295 -0.0932 0.0028 461 LYS A O 3101 C CB . LYS A 450 ? 0.3875 0.5884 0.5053 -0.0025 -0.1053 0.0054 461 LYS A CB 3102 C CG . LYS A 450 ? 0.5128 0.7274 0.6758 -0.0206 -0.1111 0.0114 461 LYS A CG 3103 C CD . LYS A 450 ? 0.4899 0.6931 0.6556 -0.0313 -0.0962 0.0226 461 LYS A CD 3104 C CE . LYS A 450 ? 0.5534 0.7233 0.6917 -0.0311 -0.0984 0.0135 461 LYS A CE 3105 N NZ . LYS A 450 ? 0.6285 0.7865 0.7808 -0.0380 -0.1207 0.0002 461 LYS A NZ 3106 N N . PRO A 451 ? 0.4945 0.7180 0.5660 0.0408 -0.1059 0.0031 462 PRO A N 3107 C CA . PRO A 451 ? 0.3924 0.6068 0.4318 0.0568 -0.0955 0.0076 462 PRO A CA 3108 C C . PRO A 451 ? 0.6266 0.8320 0.6616 0.0548 -0.0749 0.0181 462 PRO A C 3109 O O . PRO A 451 ? 0.6767 0.8952 0.7357 0.0464 -0.0682 0.0238 462 PRO A O 3110 C CB . PRO A 451 ? 0.3763 0.6154 0.4268 0.0679 -0.1023 0.0093 462 PRO A CB 3111 C CG . PRO A 451 ? 0.3811 0.6403 0.4637 0.0590 -0.1210 0.0017 462 PRO A CG 3112 C CD . PRO A 451 ? 0.5025 0.7559 0.6064 0.0400 -0.1179 0.0027 462 PRO A CD 3113 N N . PHE A 452 ? 0.6556 0.8402 0.6612 0.0629 -0.0656 0.0209 463 PHE A N 3114 C CA . PHE A 452 ? 0.5927 0.7658 0.5918 0.0628 -0.0490 0.0285 463 PHE A CA 3115 C C . PHE A 452 ? 0.6425 0.8081 0.6497 0.0483 -0.0426 0.0290 463 PHE A C 3116 O O . PHE A 452 ? 0.5267 0.6972 0.5427 0.0457 -0.0322 0.0344 463 PHE A O 3117 C CB . PHE A 452 ? 0.5711 0.7606 0.5822 0.0709 -0.0430 0.0341 463 PHE A CB 3118 C CG . PHE A 452 ? 0.5983 0.7962 0.6037 0.0858 -0.0499 0.0349 463 PHE A CG 3119 C CD1 . PHE A 452 ? 0.5459 0.7255 0.5253 0.0962 -0.0491 0.0374 463 PHE A CD1 3120 C CD2 . PHE A 452 ? 0.4469 0.6729 0.4750 0.0898 -0.0569 0.0348 463 PHE A CD2 3121 C CE1 . PHE A 452 ? 0.7110 0.8984 0.6843 0.1110 -0.0552 0.0403 463 PHE A CE1 3122 C CE2 . PHE A 452 ? 0.5695 0.8037 0.5919 0.1048 -0.0641 0.0359 463 PHE A CE2 3123 C CZ . PHE A 452 ? 0.6266 0.8407 0.6202 0.1157 -0.0632 0.0389 463 PHE A CZ 3124 N N . SER A 453 ? 0.7217 0.8756 0.7243 0.0408 -0.0492 0.0233 464 SER A N 3125 C CA . SER A 453 ? 0.6432 0.7854 0.6492 0.0285 -0.0438 0.0243 464 SER A CA 3126 C C . SER A 453 ? 0.6775 0.7953 0.6570 0.0317 -0.0383 0.0236 464 SER A C 3127 O O . SER A 453 ? 0.8445 0.9565 0.8055 0.0424 -0.0392 0.0230 464 SER A O 3128 C CB . SER A 453 ? 0.6131 0.7594 0.6388 0.0169 -0.0564 0.0187 464 SER A CB 3129 O OG . SER A 453 ? 0.7265 0.8719 0.7447 0.0230 -0.0713 0.0084 464 SER A OG 3130 N N . TYR A 454 ? 0.4552 0.5609 0.4344 0.0228 -0.0325 0.0252 465 TYR A N 3131 C CA . TYR A 454 ? 0.5192 0.6045 0.4779 0.0249 -0.0267 0.0256 465 TYR A CA 3132 C C . TYR A 454 ? 0.5033 0.5780 0.4660 0.0141 -0.0255 0.0249 465 TYR A C 3133 O O . TYR A 454 ? 0.4947 0.5762 0.4740 0.0052 -0.0244 0.0280 465 TYR A O 3134 C CB . TYR A 454 ? 0.4989 0.5784 0.4483 0.0312 -0.0161 0.0319 465 TYR A CB 3135 C CG . TYR A 454 ? 0.4235 0.4837 0.3584 0.0314 -0.0102 0.0341 465 TYR A CG 3136 C CD1 . TYR A 454 ? 0.5856 0.6388 0.5067 0.0387 -0.0104 0.0357 465 TYR A CD1 3137 C CD2 . TYR A 454 ? 0.5035 0.5551 0.4398 0.0248 -0.0043 0.0358 465 TYR A CD2 3138 C CE1 . TYR A 454 ? 0.3347 0.3736 0.2476 0.0381 -0.0045 0.0398 465 TYR A CE1 3139 C CE2 . TYR A 454 ? 0.5178 0.5537 0.4447 0.0244 -0.0004 0.0378 465 TYR A CE2 3140 C CZ . TYR A 454 ? 0.5757 0.6059 0.4931 0.0304 -0.0002 0.0402 465 TYR A CZ 3141 O OH . TYR A 454 ? 0.5885 0.6063 0.5016 0.0292 0.0041 0.0441 465 TYR A OH 3142 N N . TYR A 455 ? 0.5398 0.5994 0.4878 0.0158 -0.0252 0.0224 466 TYR A N 3143 C CA . TYR A 455 ? 0.6040 0.6521 0.5541 0.0076 -0.0243 0.0218 466 TYR A CA 3144 C C . TYR A 455 ? 0.7432 0.7779 0.6763 0.0125 -0.0185 0.0231 466 TYR A C 3145 O O . TYR A 455 ? 0.6952 0.7295 0.6153 0.0218 -0.0188 0.0221 466 TYR A O 3146 C CB . TYR A 455 ? 0.5660 0.6127 0.5251 0.0032 -0.0365 0.0137 466 TYR A CB 3147 C CG . TYR A 455 ? 0.7099 0.7418 0.6697 -0.0030 -0.0367 0.0127 466 TYR A CG 3148 C CD1 . TYR A 455 ? 0.6382 0.6691 0.6124 -0.0137 -0.0333 0.0196 466 TYR A CD1 3149 C CD2 . TYR A 455 ? 0.7305 0.7510 0.6759 0.0034 -0.0399 0.0056 466 TYR A CD2 3150 C CE1 . TYR A 455 ? 0.4092 0.4261 0.3842 -0.0185 -0.0341 0.0196 466 TYR A CE1 3151 C CE2 . TYR A 455 ? 0.5599 0.5672 0.5069 -0.0008 -0.0405 0.0044 466 TYR A CE2 3152 C CZ . TYR A 455 ? 0.5297 0.5342 0.4918 -0.0121 -0.0382 0.0114 466 TYR A CZ 3153 O OH . TYR A 455 ? 0.6493 0.6402 0.6131 -0.0154 -0.0393 0.0112 466 TYR A OH 3154 N N . LYS A 456 ? 0.6609 0.6865 0.5948 0.0066 -0.0131 0.0266 467 LYS A N 3155 C CA . LYS A 456 ? 0.6108 0.6255 0.5340 0.0096 -0.0087 0.0280 467 LYS A CA 3156 C C . LYS A 456 ? 0.6442 0.6503 0.5717 0.0028 -0.0101 0.0267 467 LYS A C 3157 O O . LYS A 456 ? 0.5316 0.5381 0.4686 -0.0049 -0.0101 0.0291 467 LYS A O 3158 C CB . LYS A 456 ? 0.4064 0.4176 0.3263 0.0115 -0.0010 0.0346 467 LYS A CB 3159 C CG . LYS A 456 ? 0.3557 0.3598 0.2688 0.0153 0.0031 0.0382 467 LYS A CG 3160 C CD . LYS A 456 ? 0.5749 0.5709 0.4918 0.0114 0.0073 0.0427 467 LYS A CD 3161 C CE . LYS A 456 ? 0.6767 0.6708 0.5943 0.0152 0.0098 0.0469 467 LYS A CE 3162 N NZ . LYS A 456 ? 0.6196 0.6041 0.5418 0.0114 0.0105 0.0477 467 LYS A NZ 3163 N N . SER A 457 ? 0.5393 0.5391 0.4595 0.0072 -0.0107 0.0240 468 SER A N 3164 C CA . SER A 457 ? 0.3907 0.3813 0.3144 0.0029 -0.0122 0.0227 468 SER A CA 3165 C C . SER A 457 ? 0.5451 0.5321 0.4631 0.0064 -0.0053 0.0273 468 SER A C 3166 O O . SER A 457 ? 0.6644 0.6556 0.5753 0.0137 -0.0009 0.0300 468 SER A O 3167 C CB . SER A 457 ? 0.4225 0.4091 0.3460 0.0059 -0.0216 0.0130 468 SER A CB 3168 O OG . SER A 457 ? 0.5441 0.5202 0.4703 0.0041 -0.0231 0.0116 468 SER A OG 3169 N N . ASP A 458 ? 0.5985 0.5790 0.5217 0.0010 -0.0045 0.0297 469 ASP A N 3170 C CA . ASP A 458 ? 0.5532 0.5316 0.4758 0.0031 0.0004 0.0341 469 ASP A CA 3171 C C . ASP A 458 ? 0.4906 0.4618 0.4185 -0.0012 -0.0024 0.0339 469 ASP A C 3172 O O . ASP A 458 ? 0.5094 0.4781 0.4414 -0.0080 -0.0039 0.0363 469 ASP A O 3173 C CB . ASP A 458 ? 0.4479 0.4277 0.3725 0.0009 0.0049 0.0402 469 ASP A CB 3174 C CG . ASP A 458 ? 0.6365 0.6158 0.5656 0.0023 0.0087 0.0456 469 ASP A CG 3175 O OD1 . ASP A 458 ? 0.7525 0.7349 0.6812 0.0075 0.0106 0.0460 469 ASP A OD1 3176 O OD2 . ASP A 458 ? 0.7653 0.7420 0.6997 -0.0012 0.0092 0.0490 469 ASP A OD2 3177 N N . ARG A 459 ? 0.5136 0.4829 0.4409 0.0043 -0.0026 0.0317 470 ARG A N 3178 C CA . ARG A 459 ? 0.5027 0.4647 0.4356 0.0020 -0.0057 0.0319 470 ARG A CA 3179 C C . ARG A 459 ? 0.5514 0.5172 0.4875 0.0060 -0.0013 0.0361 470 ARG A C 3180 O O . ARG A 459 ? 0.4533 0.4260 0.3869 0.0145 0.0029 0.0359 470 ARG A O 3181 C CB . ARG A 459 ? 0.4484 0.4026 0.3811 0.0054 -0.0128 0.0238 470 ARG A CB 3182 C CG . ARG A 459 ? 0.5083 0.4524 0.4480 0.0033 -0.0170 0.0248 470 ARG A CG 3183 C CD . ARG A 459 ? 0.4836 0.4164 0.4249 0.0078 -0.0257 0.0153 470 ARG A CD 3184 N NE . ARG A 459 ? 0.4857 0.4167 0.4286 0.0040 -0.0319 0.0101 470 ARG A NE 3185 C CZ . ARG A 459 ? 0.5240 0.4472 0.4792 -0.0059 -0.0384 0.0125 470 ARG A CZ 3186 N NH1 . ARG A 459 ? 0.7174 0.6332 0.6815 -0.0120 -0.0391 0.0208 470 ARG A NH1 3187 N NH2 . ARG A 459 ? 0.4479 0.3725 0.4082 -0.0094 -0.0445 0.0079 470 ARG A NH2 3188 N N . VAL A 460 ? 0.6034 0.5668 0.5458 0.0005 -0.0024 0.0407 471 VAL A N 3189 C CA . VAL A 460 ? 0.4473 0.4154 0.3975 0.0029 -0.0003 0.0449 471 VAL A CA 3190 C C . VAL A 460 ? 0.5906 0.5521 0.5445 0.0032 -0.0053 0.0442 471 VAL A C 3191 O O . VAL A 460 ? 0.7500 0.7047 0.7030 -0.0026 -0.0098 0.0456 471 VAL A O 3192 C CB . VAL A 460 ? 0.4712 0.4422 0.4273 -0.0029 0.0002 0.0499 471 VAL A CB 3193 C CG1 . VAL A 460 ? 0.3788 0.3559 0.3482 -0.0017 0.0004 0.0545 471 VAL A CG1 3194 C CG2 . VAL A 460 ? 0.5317 0.5065 0.4856 -0.0028 0.0045 0.0514 471 VAL A CG2 3195 N N . ILE A 461 ? 0.5275 0.4921 0.4855 0.0113 -0.0042 0.0431 472 ILE A N 3196 C CA . ILE A 461 ? 0.6188 0.5758 0.5809 0.0135 -0.0095 0.0422 472 ILE A CA 3197 C C . ILE A 461 ? 0.6947 0.6611 0.6686 0.0165 -0.0083 0.0474 472 ILE A C 3198 O O . ILE A 461 ? 0.7214 0.7000 0.7009 0.0241 -0.0025 0.0486 472 ILE A O 3199 C CB . ILE A 461 ? 0.5917 0.5419 0.5493 0.0230 -0.0117 0.0337 472 ILE A CB 3200 C CG1 . ILE A 461 ? 0.5707 0.5136 0.5200 0.0201 -0.0147 0.0275 472 ILE A CG1 3201 C CG2 . ILE A 461 ? 0.4430 0.3814 0.4062 0.0251 -0.0187 0.0330 472 ILE A CG2 3202 C CD1 . ILE A 461 ? 0.6141 0.5491 0.5583 0.0303 -0.0198 0.0160 472 ILE A CD1 3203 N N . TYR A 462 ? 0.7400 0.7030 0.7184 0.0112 -0.0138 0.0515 473 TYR A N 3204 C CA . TYR A 462 ? 0.6867 0.6590 0.6785 0.0140 -0.0151 0.0558 473 TYR A CA 3205 C C . TYR A 462 ? 0.5641 0.5291 0.5585 0.0196 -0.0208 0.0556 473 TYR A C 3206 O O . TYR A 462 ? 0.5468 0.4979 0.5339 0.0166 -0.0261 0.0558 473 TYR A O 3207 C CB . TYR A 462 ? 0.6252 0.6019 0.6222 0.0059 -0.0192 0.0598 473 TYR A CB 3208 C CG . TYR A 462 ? 0.4925 0.4817 0.5082 0.0083 -0.0217 0.0639 473 TYR A CG 3209 C CD1 . TYR A 462 ? 0.3951 0.3998 0.4263 0.0123 -0.0146 0.0674 473 TYR A CD1 3210 C CD2 . TYR A 462 ? 0.4073 0.3952 0.4263 0.0073 -0.0309 0.0656 473 TYR A CD2 3211 C CE1 . TYR A 462 ? 0.5389 0.5583 0.5920 0.0141 -0.0165 0.0727 473 TYR A CE1 3212 C CE2 . TYR A 462 ? 0.4604 0.4616 0.4994 0.0095 -0.0346 0.0692 473 TYR A CE2 3213 C CZ . TYR A 462 ? 0.6139 0.6313 0.6719 0.0123 -0.0273 0.0728 473 TYR A CZ 3214 O OH . TYR A 462 ? 0.6969 0.7307 0.7796 0.0139 -0.0307 0.0778 473 TYR A OH 3215 N N . GLY A 463 ? 0.4676 0.4430 0.4740 0.0283 -0.0192 0.0567 474 GLY A N 3216 C CA . GLY A 463 ? 0.4679 0.4364 0.4780 0.0361 -0.0245 0.0561 474 GLY A CA 3217 C C . GLY A 463 ? 0.6290 0.6139 0.6570 0.0430 -0.0245 0.0604 474 GLY A C 3218 O O . GLY A 463 ? 0.6462 0.6504 0.6858 0.0463 -0.0172 0.0629 474 GLY A O 3219 N N . GLU A 464 ? 0.6530 0.6316 0.6850 0.0455 -0.0327 0.0631 475 GLU A N 3220 C CA . GLU A 464 ? 0.5718 0.5662 0.6225 0.0536 -0.0343 0.0670 475 GLU A CA 3221 C C . GLU A 464 ? 0.5293 0.5122 0.5800 0.0662 -0.0385 0.0644 475 GLU A C 3222 O O . GLU A 464 ? 0.7137 0.6737 0.7525 0.0648 -0.0441 0.0627 475 GLU A O 3223 C CB . GLU A 464 ? 0.5555 0.5572 0.6147 0.0455 -0.0428 0.0732 475 GLU A CB 3224 C CG . GLU A 464 ? 0.5752 0.5913 0.6432 0.0358 -0.0403 0.0750 475 GLU A CG 3225 C CD . GLU A 464 ? 0.6432 0.6605 0.7136 0.0278 -0.0520 0.0771 475 GLU A CD 3226 O OE1 . GLU A 464 ? 0.8926 0.9045 0.9591 0.0313 -0.0610 0.0790 475 GLU A OE1 3227 O OE2 . GLU A 464 ? 0.6125 0.6354 0.6877 0.0191 -0.0529 0.0765 475 GLU A OE2 3228 N N . SER A 465 ? 0.5140 0.5135 0.5805 0.0787 -0.0357 0.0650 476 SER A N 3229 C CA . SER A 465 ? 0.5710 0.5604 0.6395 0.0933 -0.0401 0.0618 476 SER A CA 3230 C C . SER A 465 ? 0.6944 0.7037 0.7847 0.1006 -0.0433 0.0685 476 SER A C 3231 O O . SER A 465 ? 0.8199 0.8571 0.9280 0.0998 -0.0377 0.0733 476 SER A O 3232 C CB . SER A 465 ? 0.5764 0.5654 0.6389 0.1083 -0.0324 0.0516 476 SER A CB 3233 O OG . SER A 465 ? 0.7074 0.7277 0.7824 0.1152 -0.0210 0.0543 476 SER A OG 3234 N N . HIS A 466 ? 0.5857 0.5811 0.6771 0.1074 -0.0530 0.0700 477 HIS A N 3235 C CA . HIS A 466 ? 0.5546 0.5682 0.6670 0.1176 -0.0570 0.0753 477 HIS A CA 3236 C C . HIS A 466 ? 0.5776 0.5785 0.6906 0.1371 -0.0589 0.0697 477 HIS A C 3237 O O . HIS A 466 ? 0.6245 0.5943 0.7224 0.1386 -0.0641 0.0649 477 HIS A O 3238 C CB . HIS A 466 ? 0.5063 0.5172 0.6207 0.1088 -0.0696 0.0841 477 HIS A CB 3239 C CG . HIS A 466 ? 0.5394 0.5588 0.6507 0.0915 -0.0707 0.0871 477 HIS A CG 3240 N ND1 . HIS A 466 ? 0.5443 0.5913 0.6768 0.0870 -0.0717 0.0906 477 HIS A ND1 3241 C CD2 . HIS A 466 ? 0.6531 0.6566 0.7442 0.0783 -0.0717 0.0866 477 HIS A CD2 3242 C CE1 . HIS A 466 ? 0.7029 0.7478 0.8269 0.0723 -0.0744 0.0906 477 HIS A CE1 3243 N NE2 . HIS A 466 ? 0.6882 0.7079 0.7858 0.0677 -0.0736 0.0882 477 HIS A NE2 3244 N N . ARG A 467 ? 0.5167 0.5422 0.6493 0.1525 -0.0549 0.0703 478 ARG A N 3245 C CA . ARG A 467 ? 0.5466 0.5625 0.6829 0.1735 -0.0586 0.0653 478 ARG A CA 3246 C C . ARG A 467 ? 0.6502 0.6878 0.8106 0.1788 -0.0650 0.0752 478 ARG A C 3247 O O . ARG A 467 ? 0.7717 0.8422 0.9538 0.1901 -0.0580 0.0773 478 ARG A O 3248 C CB . ARG A 467 ? 0.5757 0.6032 0.7106 0.1922 -0.0465 0.0546 478 ARG A CB 3249 C CG . ARG A 467 ? 0.7475 0.7547 0.8579 0.1880 -0.0420 0.0436 478 ARG A CG 3250 C CD . ARG A 467 ? 0.9303 0.9405 1.0328 0.2121 -0.0345 0.0294 478 ARG A CD 3251 N NE . ARG A 467 ? 0.9966 1.0508 1.1130 0.2230 -0.0190 0.0342 478 ARG A NE 3252 C CZ . ARG A 467 ? 1.0592 1.1344 1.1715 0.2164 -0.0062 0.0373 478 ARG A CZ 3253 N NH1 . ARG A 467 ? 1.2473 1.3030 1.3409 0.1997 -0.0078 0.0343 478 ARG A NH1 3254 N NH2 . ARG A 467 ? 0.8768 0.9936 1.0055 0.2268 0.0087 0.0451 478 ARG A NH2 3255 N N . LEU A 468 ? 0.6861 0.7069 0.8428 0.1708 -0.0783 0.0825 479 LEU A N 3256 C CA . LEU A 468 ? 0.6896 0.7315 0.8661 0.1710 -0.0873 0.0926 479 LEU A CA 3257 C C . LEU A 468 ? 0.8393 0.8740 1.0251 0.1901 -0.0961 0.0948 479 LEU A C 3258 O O . LEU A 468 ? 0.9018 0.9020 1.0727 0.1947 -0.1028 0.0938 479 LEU A O 3259 C CB . LEU A 468 ? 0.5283 0.5614 0.6927 0.1516 -0.0968 0.0998 479 LEU A CB 3260 C CG . LEU A 468 ? 0.6634 0.7134 0.8415 0.1507 -0.1102 0.1090 479 LEU A CG 3261 C CD1 . LEU A 468 ? 0.5745 0.6655 0.7841 0.1504 -0.1076 0.1102 479 LEU A CD1 3262 C CD2 . LEU A 468 ? 0.8199 0.8564 0.9768 0.1345 -0.1186 0.1134 479 LEU A CD2 3263 N N . LEU A 469 ? 0.6683 0.7363 0.8816 0.2010 -0.0964 0.0988 480 LEU A N 3264 C CA . LEU A 469 ? 0.6358 0.7029 0.8619 0.2215 -0.1042 0.1010 480 LEU A CA 3265 C C . LEU A 469 ? 0.8223 0.9092 1.0653 0.2171 -0.1176 0.1127 480 LEU A C 3266 O O . LEU A 469 ? 0.9130 1.0374 1.1804 0.2122 -0.1160 0.1162 480 LEU A O 3267 C CB . LEU A 469 ? 0.5234 0.6179 0.7694 0.2424 -0.0920 0.0950 480 LEU A CB 3268 C CG . LEU A 469 ? 0.7623 0.8470 1.0143 0.2697 -0.0957 0.0906 480 LEU A CG 3269 C CD1 . LEU A 469 ? 0.8780 0.9102 1.1025 0.2727 -0.1022 0.0827 480 LEU A CD1 3270 C CD2 . LEU A 469 ? 0.7099 0.8261 0.9768 0.2900 -0.0799 0.0835 480 LEU A CD2 3271 N N . GLN A 470 ? 0.7723 0.8345 1.0035 0.2188 -0.1317 0.1192 481 GLN A N 3272 C CA . GLN A 470 ? 0.6972 0.7758 0.9378 0.2146 -0.1465 0.1297 481 GLN A CA 3273 C C . GLN A 470 ? 0.8453 0.9219 1.0973 0.2343 -0.1586 0.1367 481 GLN A C 3274 O O . GLN A 470 ? 0.8708 0.9130 1.1081 0.2436 -0.1623 0.1386 481 GLN A O 3275 C CB . GLN A 470 ? 0.7190 0.7771 0.9315 0.1959 -0.1538 0.1346 481 GLN A CB 3276 C CG . GLN A 470 ? 0.8327 0.8976 1.0370 0.1761 -0.1450 0.1287 481 GLN A CG 3277 C CD . GLN A 470 ? 0.8745 0.9262 1.0533 0.1607 -0.1534 0.1334 481 GLN A CD 3278 O OE1 . GLN A 470 ? 0.9338 1.0046 1.1163 0.1489 -0.1574 0.1317 481 GLN A OE1 3279 N NE2 . GLN A 470 ? 0.7468 0.7661 0.9007 0.1614 -0.1560 0.1395 481 GLN A NE2 3280 N N . ALA A 471 ? 0.8502 0.9640 1.1310 0.2402 -0.1659 0.1411 482 ALA A N 3281 C CA . ALA A 471 ? 0.9219 1.0387 1.2153 0.2584 -0.1795 0.1490 482 ALA A CA 3282 C C . ALA A 471 ? 0.8652 0.9929 1.1560 0.2498 -0.1978 0.1584 482 ALA A C 3283 O O . ALA A 471 ? 0.8841 1.0420 1.1894 0.2373 -0.2013 0.1568 482 ALA A O 3284 C CB . ALA A 471 ? 0.9641 1.1180 1.2955 0.2767 -0.1743 0.1466 482 ALA A CB 3285 N N . ALA A 472 ? 0.8503 0.9527 1.1224 0.2570 -0.2102 0.1681 483 ALA A N 3286 C CA . ALA A 472 ? 0.9005 1.0122 1.1643 0.2529 -0.2287 0.1774 483 ALA A CA 3287 C C . ALA A 472 ? 0.8512 0.9639 1.1245 0.2741 -0.2434 0.1884 483 ALA A C 3288 O O . ALA A 472 ? 0.8536 0.9325 1.1118 0.2847 -0.2438 0.1960 483 ALA A O 3289 C CB . ALA A 472 ? 0.6231 0.7045 0.8461 0.2382 -0.2294 0.1821 483 ALA A CB 3290 N N . PHE A 473 ? 0.6924 0.8436 0.9933 0.2801 -0.2563 0.1896 484 PHE A N 3291 C CA . PHE A 473 ? 0.7109 0.8668 1.0144 0.2982 -0.2668 0.1970 484 PHE A CA 3292 C C . PHE A 473 ? 0.8352 1.0031 1.1209 0.2928 -0.2844 0.2026 484 PHE A C 3293 O O . PHE A 473 ? 0.7890 0.9745 1.0748 0.2771 -0.2909 0.1970 484 PHE A O 3294 C CB . PHE A 473 ? 0.7186 0.9114 1.0645 0.3123 -0.2639 0.1914 484 PHE A CB 3295 C CG . PHE A 473 ? 0.9127 1.1013 1.2761 0.3202 -0.2457 0.1841 484 PHE A CG 3296 C CD1 . PHE A 473 ? 0.9554 1.1160 1.3112 0.3395 -0.2393 0.1844 484 PHE A CD1 3297 C CD2 . PHE A 473 ? 0.9593 1.1728 1.3463 0.3094 -0.2346 0.1770 484 PHE A CD2 3298 C CE1 . PHE A 473 ? 0.8327 0.9896 1.2012 0.3495 -0.2235 0.1750 484 PHE A CE1 3299 C CE2 . PHE A 473 ? 0.9205 1.1321 1.3160 0.3179 -0.2149 0.1688 484 PHE A CE2 3300 C CZ . PHE A 473 ? 0.8373 1.0213 1.2257 0.3398 -0.2114 0.1676 484 PHE A CZ 3301 N N . LYS A 474 ? 0.9231 1.0814 1.1930 0.3069 -0.2922 0.2131 485 LYS A N 3302 C CA . LYS A 474 ? 0.8676 1.0350 1.1143 0.3052 -0.3080 0.2197 485 LYS A CA 3303 C C . LYS A 474 ? 0.9474 1.1213 1.1955 0.3255 -0.3165 0.2303 485 LYS A C 3304 O O . LYS A 474 ? 0.9928 1.1399 1.2349 0.3387 -0.3096 0.2387 485 LYS A O 3305 C CB . LYS A 474 ? 0.8110 0.9448 1.0129 0.2950 -0.3054 0.2276 485 LYS A CB 3306 C CG . LYS A 474 ? 0.9634 1.1107 1.1378 0.2907 -0.3196 0.2312 485 LYS A CG 3307 C CD . LYS A 474 ? 1.0206 1.1389 1.1533 0.2798 -0.3133 0.2375 485 LYS A CD 3308 C CE . LYS A 474 ? 1.0702 1.1813 1.2106 0.2620 -0.3036 0.2256 485 LYS A CE 3309 N NZ . LYS A 474 ? 1.0847 1.1703 1.1860 0.2511 -0.2969 0.2318 485 LYS A NZ 3310 N N . LYS A 475 ? 1.0535 1.2629 1.3109 0.3277 -0.3321 0.2296 486 LYS A N 3311 C CA . LYS A 475 ? 1.1047 1.3272 1.3674 0.3468 -0.3415 0.2401 486 LYS A CA 3312 C C . LYS A 475 ? 1.0717 1.3230 1.3252 0.3438 -0.3604 0.2431 486 LYS A C 3313 O O . LYS A 475 ? 1.0528 1.3288 1.3175 0.3297 -0.3687 0.2305 486 LYS A O 3314 C CB . LYS A 475 ? 1.0695 1.3180 1.3779 0.3590 -0.3385 0.2334 486 LYS A CB 3315 C CG . LYS A 475 ? 0.9051 1.1740 1.2251 0.3786 -0.3491 0.2434 486 LYS A CG 3316 C CD . LYS A 475 ? 0.9602 1.1910 1.2575 0.3942 -0.3432 0.2587 486 LYS A CD 3317 C CE . LYS A 475 ? 1.0654 1.3147 1.3737 0.4111 -0.3535 0.2698 486 LYS A CE 3318 N NZ . LYS A 475 ? 0.9405 1.1504 1.2289 0.4251 -0.3477 0.2850 486 LYS A NZ 3319 N N . SER A 476 ? 1.1039 1.3515 1.3384 0.3567 -0.3676 0.2604 487 SER A N 3320 C CA . SER A 476 ? 1.1409 1.4156 1.3675 0.3541 -0.3869 0.2655 487 SER A CA 3321 C C . SER A 476 ? 1.0908 1.3976 1.3492 0.3679 -0.3988 0.2690 487 SER A C 3322 O O . SER A 476 ? 0.9839 1.2787 1.2478 0.3835 -0.3933 0.2804 487 SER A O 3323 C CB . SER A 476 ? 1.1819 1.4300 1.3642 0.3518 -0.3877 0.2840 487 SER A CB 3324 O OG . SER A 476 ? 1.3466 1.5700 1.5237 0.3658 -0.3793 0.3015 487 SER A OG 3325 N N . PHE A 477 ? 1.1453 1.4914 1.4250 0.3617 -0.4155 0.2580 488 PHE A N 3326 C CA . PHE A 477 ? 1.2405 1.6229 1.5530 0.3735 -0.4292 0.2605 488 PHE A CA 3327 C C . PHE A 477 ? 1.3083 1.7042 1.6025 0.3730 -0.4518 0.2693 488 PHE A C 3328 O O . PHE A 477 ? 1.1945 1.5770 1.4532 0.3616 -0.4581 0.2682 488 PHE A O 3329 C CB . PHE A 477 ? 1.3209 1.7398 1.6789 0.3661 -0.4320 0.2403 488 PHE A CB 3330 C CG . PHE A 477 ? 1.4676 1.8822 1.8537 0.3711 -0.4125 0.2340 488 PHE A CG 3331 C CD1 . PHE A 477 ? 1.5142 1.9504 1.9354 0.3580 -0.4085 0.2171 488 PHE A CD1 3332 C CD2 . PHE A 477 ? 1.5708 1.9595 1.9498 0.3886 -0.3985 0.2453 488 PHE A CD2 3333 C CE1 . PHE A 477 ? 1.5660 2.0004 2.0132 0.3628 -0.3901 0.2123 488 PHE A CE1 3334 C CE2 . PHE A 477 ? 1.6255 2.0096 2.0285 0.3943 -0.3815 0.2377 488 PHE A CE2 3335 C CZ . PHE A 477 ? 1.6290 2.0374 2.0655 0.3818 -0.3770 0.2215 488 PHE A CZ 3336 N N . ASP A 478 ? 1.5104 1.9322 1.8280 0.3860 -0.4644 0.2768 489 ASP A N 3337 C CA . ASP A 478 ? 1.5478 1.9861 1.8527 0.3868 -0.4892 0.2830 489 ASP A CA 3338 C C . ASP A 478 ? 1.5910 2.0773 1.9369 0.3872 -0.5063 0.2694 489 ASP A C 3339 O O . ASP A 478 ? 1.5777 2.0861 1.9662 0.3921 -0.4984 0.2629 489 ASP A O 3340 C CB . ASP A 478 ? 1.4307 1.8481 1.7199 0.4008 -0.4920 0.3074 489 ASP A CB 3341 C CG . ASP A 478 ? 1.3369 1.7098 1.5767 0.3949 -0.4873 0.3205 489 ASP A CG 3342 O OD1 . ASP A 478 ? 1.1801 1.5301 1.4029 0.3842 -0.4710 0.3143 489 ASP A OD1 3343 O OD2 . ASP A 478 ? 1.3386 1.6991 1.5567 0.4011 -0.5009 0.3370 489 ASP A OD2 3344 N N . LYS A 481 ? 1.2820 1.7792 1.5427 0.3999 -0.5798 0.2919 492 LYS A N 3345 C CA . LYS A 481 ? 1.3568 1.8198 1.5583 0.3970 -0.5811 0.2985 492 LYS A CA 3346 C C . LYS A 481 ? 1.5455 1.9936 1.7258 0.3800 -0.5695 0.2804 492 LYS A C 3347 O O . LYS A 481 ? 1.5514 1.9643 1.6939 0.3765 -0.5560 0.2890 492 LYS A O 3348 C CB . LYS A 481 ? 1.2392 1.7158 1.4133 0.4037 -0.6087 0.2972 492 LYS A CB 3349 N N . ILE A 482 ? 1.5871 2.0613 1.7939 0.3690 -0.5756 0.2556 493 ILE A N 3350 C CA . ILE A 482 ? 1.5027 1.9640 1.6960 0.3523 -0.5661 0.2367 493 ILE A CA 3351 C C . ILE A 482 ? 1.4975 1.9399 1.7068 0.3481 -0.5380 0.2417 493 ILE A C 3352 O O . ILE A 482 ? 1.5071 1.9679 1.7630 0.3473 -0.5306 0.2355 493 ILE A O 3353 C CB . ILE A 482 ? 1.3985 1.8903 1.6225 0.3403 -0.5822 0.2090 493 ILE A CB 3354 N N . ARG A 483 ? 1.4435 1.8492 1.6135 0.3461 -0.5225 0.2524 494 ARG A N 3355 C CA . ARG A 483 ? 1.3451 1.7278 1.5246 0.3441 -0.4964 0.2592 494 ARG A CA 3356 C C . ARG A 483 ? 1.3233 1.7057 1.5142 0.3284 -0.4859 0.2374 494 ARG A C 3357 O O . ARG A 483 ? 1.3087 1.6813 1.4703 0.3169 -0.4887 0.2256 494 ARG A O 3358 C CB . ARG A 483 ? 1.3095 1.6514 1.4461 0.3466 -0.4851 0.2803 494 ARG A CB 3359 N N . HIS A 484 ? 1.2904 1.6829 1.5238 0.3287 -0.4738 0.2319 495 HIS A N 3360 C CA . HIS A 484 ? 1.1632 1.5519 1.4115 0.3138 -0.4623 0.2140 495 HIS A CA 3361 C C . HIS A 484 ? 0.9907 1.3431 1.2214 0.3145 -0.4379 0.2228 495 HIS A C 3362 O O . HIS A 484 ? 0.9449 1.2863 1.1829 0.3280 -0.4265 0.2368 495 HIS A O 3363 C CB . HIS A 484 ? 1.2111 1.6320 1.5179 0.3126 -0.4628 0.2027 495 HIS A CB 3364 C CG . HIS A 484 ? 1.3631 1.8206 1.6946 0.3081 -0.4866 0.1912 495 HIS A CG 3365 N ND1 . HIS A 484 ? 1.3421 1.8138 1.6951 0.2897 -0.4949 0.1708 495 HIS A ND1 3366 C CD2 . HIS A 484 ? 1.4888 1.9705 1.8289 0.3192 -0.5047 0.1974 495 HIS A CD2 3367 C CE1 . HIS A 484 ? 1.4264 1.9285 1.8002 0.2894 -0.5173 0.1639 495 HIS A CE1 3368 N NE2 . HIS A 484 ? 1.5274 2.0372 1.8931 0.3075 -0.5239 0.1795 495 HIS A NE2 3369 N N . ASN A 485 ? 0.8528 1.1855 1.0607 0.3003 -0.4306 0.2137 496 ASN A N 3370 C CA . ASN A 485 ? 1.0591 1.3583 1.2543 0.2987 -0.4082 0.2191 496 ASN A CA 3371 C C . ASN A 485 ? 0.9813 1.2842 1.2088 0.2860 -0.3987 0.2020 496 ASN A C 3372 O O . ASN A 485 ? 0.9713 1.2700 1.1898 0.2702 -0.3993 0.1894 496 ASN A O 3373 C CB . ASN A 485 ? 1.0602 1.3310 1.2037 0.2929 -0.4039 0.2266 496 ASN A CB 3374 C CG . ASN A 485 ? 1.1965 1.4577 1.3109 0.3040 -0.4092 0.2494 496 ASN A CG 3375 O OD1 . ASN A 485 ? 1.2464 1.5146 1.3782 0.3174 -0.4124 0.2623 496 ASN A OD1 3376 N ND2 . ASN A 485 ? 1.2252 1.4690 1.2960 0.2980 -0.4106 0.2552 496 ASN A ND2 3377 N N . LEU A 486 ? 0.8898 1.2008 1.1553 0.2932 -0.3896 0.2025 497 LEU A N 3378 C CA . LEU A 486 ? 0.7718 1.0912 1.0744 0.2817 -0.3794 0.1898 497 LEU A CA 3379 C C . LEU A 486 ? 0.7208 1.0040 1.0064 0.2767 -0.3595 0.1919 497 LEU A C 3380 O O . LEU A 486 ? 0.8423 1.0955 1.1020 0.2872 -0.3506 0.2040 497 LEU A O 3381 C CB . LEU A 486 ? 0.7559 1.1036 1.1069 0.2929 -0.3770 0.1902 497 LEU A CB 3382 C CG . LEU A 486 ? 0.8502 1.2187 1.2479 0.2821 -0.3668 0.1798 497 LEU A CG 3383 C CD1 . LEU A 486 ? 0.7393 1.1312 1.1544 0.2619 -0.3797 0.1672 497 LEU A CD1 3384 C CD2 . LEU A 486 ? 0.9616 1.3583 1.4016 0.2976 -0.3624 0.1826 497 LEU A CD2 3385 N N . SER A 487 ? 0.6887 0.9748 0.9910 0.2599 -0.3528 0.1807 498 SER A N 3386 C CA . SER A 487 ? 0.8074 1.0628 1.0975 0.2534 -0.3345 0.1818 498 SER A CA 3387 C C . SER A 487 ? 0.9307 1.2042 1.2631 0.2422 -0.3237 0.1729 498 SER A C 3388 O O . SER A 487 ? 0.9933 1.2884 1.3446 0.2272 -0.3308 0.1633 498 SER A O 3389 C CB . SER A 487 ? 0.6730 0.9031 0.9176 0.2420 -0.3366 0.1811 498 SER A CB 3390 O OG . SER A 487 ? 0.7894 0.9997 0.9922 0.2529 -0.3403 0.1938 498 SER A OG 3391 N N . VAL A 488 ? 0.8821 1.1467 1.2292 0.2498 -0.3059 0.1765 499 VAL A N 3392 C CA . VAL A 488 ? 0.8400 1.1211 1.2224 0.2408 -0.2913 0.1709 499 VAL A CA 3393 C C . VAL A 488 ? 0.8286 1.0738 1.1824 0.2342 -0.2702 0.1692 499 VAL A C 3394 O O . VAL A 488 ? 0.8788 1.0894 1.2018 0.2431 -0.2654 0.1748 499 VAL A O 3395 C CB . VAL A 488 ? 0.9025 1.2142 1.3287 0.2549 -0.2827 0.1718 499 VAL A CB 3396 C CG1 . VAL A 488 ? 0.7716 1.1153 1.2179 0.2609 -0.3001 0.1716 499 VAL A CG1 3397 C CG2 . VAL A 488 ? 0.9721 1.2582 1.3856 0.2748 -0.2704 0.1767 499 VAL A CG2 3398 N N . ASN A 489 ? 0.7083 0.9610 1.0714 0.2175 -0.2571 0.1611 500 ASN A N 3399 C CA . ASN A 489 ? 0.6972 0.9191 1.0328 0.2097 -0.2363 0.1571 500 ASN A CA 3400 C C . ASN A 489 ? 0.8006 1.0427 1.1650 0.2038 -0.2173 0.1517 500 ASN A C 3401 O O . ASN A 489 ? 0.8810 1.1519 1.2733 0.1911 -0.2198 0.1491 500 ASN A O 3402 C CB . ASN A 489 ? 0.7935 0.9922 1.0903 0.1928 -0.2405 0.1537 500 ASN A CB 3403 C CG . ASN A 489 ? 0.8171 0.9908 1.0770 0.2004 -0.2529 0.1618 500 ASN A CG 3404 O OD1 . ASN A 489 ? 0.9352 1.1228 1.1955 0.2054 -0.2732 0.1652 500 ASN A OD1 3405 N ND2 . ASN A 489 ? 0.7777 0.9153 1.0062 0.2015 -0.2413 0.1660 500 ASN A ND2 3406 N N . LEU A 490 ? 0.7610 0.9875 1.1186 0.2138 -0.1990 0.1504 501 LEU A N 3407 C CA . LEU A 490 ? 0.6311 0.8768 1.0108 0.2126 -0.1789 0.1464 501 LEU A CA 3408 C C . LEU A 490 ? 0.6305 0.8442 0.9757 0.2014 -0.1641 0.1398 501 LEU A C 3409 O O . LEU A 490 ? 0.7350 0.9105 1.0436 0.2007 -0.1666 0.1390 501 LEU A O 3410 C CB . LEU A 490 ? 0.5086 0.7667 0.9086 0.2373 -0.1700 0.1479 501 LEU A CB 3411 C CG . LEU A 490 ? 1.0557 1.3621 1.5055 0.2487 -0.1757 0.1542 501 LEU A CG 3412 C CD1 . LEU A 490 ? 0.5114 0.8320 0.9736 0.2411 -0.2006 0.1591 501 LEU A CD1 3413 C CD2 . LEU A 490 ? 0.5278 0.8337 0.9848 0.2775 -0.1716 0.1552 501 LEU A CD2 3414 N N . GLY A 491 ? 0.5508 0.7816 0.9096 0.1927 -0.1487 0.1367 502 GLY A N 3415 C CA . GLY A 491 ? 0.6121 0.8163 0.9406 0.1824 -0.1352 0.1303 502 GLY A CA 3416 C C . GLY A 491 ? 0.6418 0.8655 0.9853 0.1841 -0.1143 0.1281 502 GLY A C 3417 O O . GLY A 491 ? 0.6199 0.8824 1.0001 0.1809 -0.1101 0.1334 502 GLY A O 3418 N N . PHE A 492 ? 0.6311 0.8285 0.9467 0.1894 -0.1017 0.1212 503 PHE A N 3419 C CA . PHE A 492 ? 0.6025 0.8146 0.9229 0.1923 -0.0815 0.1183 503 PHE A CA 3420 C C . PHE A 492 ? 0.6306 0.8064 0.9122 0.1838 -0.0750 0.1098 503 PHE A C 3421 O O . PHE A 492 ? 0.7592 0.8993 1.0139 0.1899 -0.0794 0.1039 503 PHE A O 3422 C CB . PHE A 492 ? 0.5838 0.8116 0.9173 0.2191 -0.0716 0.1166 503 PHE A CB 3423 C CG . PHE A 492 ? 0.7222 0.9653 1.0546 0.2264 -0.0502 0.1133 503 PHE A CG 3424 C CD1 . PHE A 492 ? 0.7347 1.0074 1.0857 0.2124 -0.0396 0.1209 503 PHE A CD1 3425 C CD2 . PHE A 492 ? 0.9119 1.1396 1.2245 0.2485 -0.0415 0.1027 503 PHE A CD2 3426 C CE1 . PHE A 492 ? 0.8139 1.1026 1.1619 0.2206 -0.0191 0.1202 503 PHE A CE1 3427 C CE2 . PHE A 492 ? 0.9811 1.2246 1.2886 0.2578 -0.0223 0.0991 503 PHE A CE2 3428 C CZ . PHE A 492 ? 0.8976 1.1729 1.2220 0.2441 -0.0102 0.1090 503 PHE A CZ 3429 N N . ASP A 493 ? 0.5312 0.7164 0.8127 0.1691 -0.0654 0.1103 504 ASP A N 3430 C CA . ASP A 493 ? 0.6092 0.7636 0.8565 0.1595 -0.0601 0.1029 504 ASP A CA 3431 C C . ASP A 493 ? 0.6837 0.8554 0.9335 0.1600 -0.0416 0.1021 504 ASP A C 3432 O O . ASP A 493 ? 0.7364 0.9386 1.0116 0.1513 -0.0359 0.1104 504 ASP A O 3433 C CB . ASP A 493 ? 0.6809 0.8200 0.9159 0.1373 -0.0715 0.1045 504 ASP A CB 3434 C CG . ASP A 493 ? 0.7223 0.8286 0.9223 0.1282 -0.0676 0.0976 504 ASP A CG 3435 O OD1 . ASP A 493 ? 0.8421 0.9288 1.0246 0.1390 -0.0618 0.0909 504 ASP A OD1 3436 O OD2 . ASP A 493 ? 0.7044 0.8044 0.8953 0.1109 -0.0714 0.0983 504 ASP A OD2 3437 N N . ARG A 494 ? 0.7535 0.9056 0.9777 0.1708 -0.0332 0.0924 505 ARG A N 3438 C CA . ARG A 494 ? 0.6049 0.7667 0.8210 0.1712 -0.0169 0.0903 505 ARG A CA 3439 C C . ARG A 494 ? 0.5888 0.7190 0.7762 0.1532 -0.0205 0.0850 505 ARG A C 3440 O O . ARG A 494 ? 0.5554 0.6511 0.7180 0.1545 -0.0278 0.0762 505 ARG A O 3441 C CB . ARG A 494 ? 0.7346 0.8961 0.9387 0.1969 -0.0070 0.0807 505 ARG A CB 3442 C CG . ARG A 494 ? 0.8575 1.0498 1.0884 0.2184 -0.0032 0.0850 505 ARG A CG 3443 C CD . ARG A 494 ? 1.0034 1.1888 1.2171 0.2469 0.0036 0.0716 505 ARG A CD 3444 N NE . ARG A 494 ? 1.2753 1.4119 1.4622 0.2499 -0.0106 0.0576 505 ARG A NE 3445 C CZ . ARG A 494 ? 1.3766 1.4961 1.5691 0.2583 -0.0238 0.0560 505 ARG A CZ 3446 N NH1 . ARG A 494 ? 1.2416 1.3898 1.4641 0.2655 -0.0253 0.0660 505 ARG A NH1 3447 N NH2 . ARG A 494 ? 1.4102 1.4843 1.5808 0.2593 -0.0361 0.0454 505 ARG A NH2 3448 N N . PHE A 495 ? 0.5026 0.6450 0.6963 0.1364 -0.0160 0.0913 506 PHE A N 3449 C CA . PHE A 495 ? 0.4372 0.5532 0.6074 0.1188 -0.0204 0.0874 506 PHE A CA 3450 C C . PHE A 495 ? 0.5540 0.6762 0.7156 0.1144 -0.0070 0.0874 506 PHE A C 3451 O O . PHE A 495 ? 0.5997 0.7510 0.7772 0.1221 0.0061 0.0937 506 PHE A O 3452 C CB . PHE A 495 ? 0.5854 0.7018 0.7667 0.1008 -0.0330 0.0934 506 PHE A CB 3453 C CG . PHE A 495 ? 0.5692 0.7186 0.7843 0.0932 -0.0301 0.1034 506 PHE A CG 3454 C CD1 . PHE A 495 ? 0.4683 0.6231 0.6857 0.0805 -0.0231 0.1067 506 PHE A CD1 3455 C CD2 . PHE A 495 ? 0.5837 0.7590 0.8314 0.0984 -0.0352 0.1105 506 PHE A CD2 3456 C CE1 . PHE A 495 ? 0.5176 0.7009 0.7706 0.0723 -0.0214 0.1175 506 PHE A CE1 3457 C CE2 . PHE A 495 ? 0.5965 0.8029 0.8812 0.0898 -0.0338 0.1208 506 PHE A CE2 3458 C CZ . PHE A 495 ? 0.5575 0.7669 0.8456 0.0762 -0.0270 0.1247 506 PHE A CZ 3459 N N . GLY A 496 ? 0.4528 0.5496 0.5901 0.1025 -0.0100 0.0818 507 GLY A N 3460 C CA . GLY A 496 ? 0.4262 0.5256 0.5526 0.0983 0.0009 0.0814 507 GLY A CA 3461 C C . GLY A 496 ? 0.5996 0.6766 0.7089 0.0806 -0.0053 0.0788 507 GLY A C 3462 O O . GLY A 496 ? 0.6274 0.6797 0.7215 0.0760 -0.0156 0.0735 507 GLY A O 3463 N N . SER A 497 ? 0.5931 0.6802 0.7063 0.0714 0.0016 0.0839 508 SER A N 3464 C CA . SER A 497 ? 0.5970 0.6663 0.6955 0.0562 -0.0027 0.0815 508 SER A CA 3465 C C . SER A 497 ? 0.5246 0.5938 0.6084 0.0582 0.0083 0.0800 508 SER A C 3466 O O . SER A 497 ? 0.5526 0.6441 0.6484 0.0633 0.0197 0.0877 508 SER A O 3467 C CB . SER A 497 ? 0.5659 0.6450 0.6856 0.0421 -0.0085 0.0890 508 SER A CB 3468 O OG . SER A 497 ? 0.6009 0.6625 0.7050 0.0298 -0.0130 0.0853 508 SER A OG 3469 N N . ASN A 498 ? 0.5420 0.5883 0.6010 0.0545 0.0050 0.0715 509 ASN A N 3470 C CA . ASN A 498 ? 0.7553 0.8007 0.7981 0.0582 0.0134 0.0683 509 ASN A CA 3471 C C . ASN A 498 ? 0.6065 0.6343 0.6336 0.0459 0.0094 0.0647 509 ASN A C 3472 O O . ASN A 498 ? 0.7486 0.7567 0.7641 0.0412 0.0010 0.0584 509 ASN A O 3473 C CB . ASN A 498 ? 0.8464 0.8862 0.8737 0.0751 0.0153 0.0581 509 ASN A CB 3474 C CG . ASN A 498 ? 1.1125 1.1652 1.1286 0.0860 0.0267 0.0574 509 ASN A CG 3475 O OD1 . ASN A 498 ? 1.3125 1.3874 1.3402 0.0855 0.0370 0.0691 509 ASN A OD1 3476 N ND2 . ASN A 498 ? 1.1439 1.1827 1.1381 0.0962 0.0240 0.0441 509 ASN A ND2 3477 N N . LEU A 499 ? 0.5670 0.6033 0.5956 0.0413 0.0161 0.0701 510 LEU A N 3478 C CA . LEU A 499 ? 0.4816 0.5042 0.4959 0.0322 0.0137 0.0668 510 LEU A CA 3479 C C . LEU A 499 ? 0.5938 0.6188 0.5923 0.0407 0.0212 0.0636 510 LEU A C 3480 O O . LEU A 499 ? 0.6830 0.7260 0.6865 0.0480 0.0312 0.0709 510 LEU A O 3481 C CB . LEU A 499 ? 0.4803 0.5070 0.5082 0.0203 0.0129 0.0744 510 LEU A CB 3482 C CG . LEU A 499 ? 0.6706 0.6837 0.6850 0.0120 0.0100 0.0708 510 LEU A CG 3483 C CD1 . LEU A 499 ? 0.7871 0.7850 0.7932 0.0056 -0.0002 0.0646 510 LEU A CD1 3484 C CD2 . LEU A 499 ? 0.6574 0.6762 0.6859 0.0048 0.0119 0.0786 510 LEU A CD2 3485 N N . ARG A 500 ? 0.6072 0.6157 0.5874 0.0401 0.0159 0.0537 511 ARG A N 3486 C CA . ARG A 500 ? 0.4699 0.4792 0.4334 0.0482 0.0196 0.0483 511 ARG A CA 3487 C C . ARG A 500 ? 0.6014 0.6034 0.5578 0.0383 0.0178 0.0483 511 ARG A C 3488 O O . ARG A 500 ? 0.6186 0.6093 0.5769 0.0270 0.0115 0.0475 511 ARG A O 3489 C CB . ARG A 500 ? 0.4568 0.4537 0.4078 0.0576 0.0131 0.0348 511 ARG A CB 3490 C CG . ARG A 500 ? 0.6485 0.6563 0.5987 0.0753 0.0177 0.0319 511 ARG A CG 3491 C CD . ARG A 500 ? 0.8687 0.8649 0.8258 0.0780 0.0100 0.0267 511 ARG A CD 3492 N NE . ARG A 500 ? 0.9911 0.9621 0.9431 0.0705 -0.0024 0.0180 511 ARG A NE 3493 C CZ . ARG A 500 ? 1.0249 0.9825 0.9643 0.0764 -0.0092 0.0049 511 ARG A CZ 3494 N NH1 . ARG A 500 ? 1.2861 1.2528 1.2118 0.0918 -0.0054 -0.0029 511 ARG A NH1 3495 N NH2 . ARG A 500 ? 0.7478 0.6838 0.6892 0.0673 -0.0204 0.0002 511 ARG A NH2 3496 N N . HIS A 501 ? 0.6521 0.6624 0.5993 0.0441 0.0238 0.0498 512 HIS A N 3497 C CA . HIS A 501 ? 0.5612 0.5665 0.5023 0.0368 0.0226 0.0502 512 HIS A CA 3498 C C . HIS A 501 ? 0.5733 0.5793 0.4960 0.0468 0.0219 0.0422 512 HIS A C 3499 O O . HIS A 501 ? 0.6037 0.6232 0.5188 0.0592 0.0291 0.0451 512 HIS A O 3500 C CB . HIS A 501 ? 0.5011 0.5164 0.4538 0.0324 0.0297 0.0636 512 HIS A CB 3501 C CG . HIS A 501 ? 0.5705 0.5769 0.5224 0.0226 0.0262 0.0639 512 HIS A CG 3502 N ND1 . HIS A 501 ? 0.7234 0.7307 0.6892 0.0154 0.0277 0.0730 512 HIS A ND1 3503 C CD2 . HIS A 501 ? 0.5624 0.5595 0.5029 0.0197 0.0208 0.0561 512 HIS A CD2 3504 C CE1 . HIS A 501 ? 0.7339 0.7319 0.6940 0.0101 0.0237 0.0696 512 HIS A CE1 3505 N NE2 . HIS A 501 ? 0.6488 0.6424 0.5941 0.0125 0.0203 0.0603 512 HIS A NE2 3506 N N . GLN A 502 ? 0.4323 0.4254 0.3486 0.0419 0.0129 0.0325 513 GLN A N 3507 C CA . GLN A 502 ? 0.5271 0.5186 0.4283 0.0510 0.0078 0.0214 513 GLN A CA 3508 C C . GLN A 502 ? 0.4483 0.4308 0.3496 0.0413 -0.0003 0.0165 513 GLN A C 3509 O O . GLN A 502 ? 0.4976 0.4758 0.4084 0.0290 -0.0005 0.0221 513 GLN A O 3510 C CB . GLN A 502 ? 0.3786 0.3625 0.2763 0.0597 0.0013 0.0097 513 GLN A CB 3511 C CG . GLN A 502 ? 0.5936 0.5607 0.5033 0.0484 -0.0072 0.0070 513 GLN A CG 3512 C CD . GLN A 502 ? 0.7644 0.7208 0.6727 0.0577 -0.0147 -0.0043 513 GLN A CD 3513 O OE1 . GLN A 502 ? 0.7438 0.7064 0.6523 0.0679 -0.0097 -0.0033 513 GLN A OE1 3514 N NE2 . GLN A 502 ? 0.6008 0.5413 0.5101 0.0545 -0.0272 -0.0149 513 GLN A NE2 3515 N N . ASP A 503 ? 0.4078 0.4171 0.4465 0.0037 -0.0661 -0.0436 514 ASP A N 3516 C CA . ASP A 503 ? 0.4224 0.4343 0.4810 0.0034 -0.0635 -0.0266 514 ASP A CA 3517 C C . ASP A 503 ? 0.5232 0.5320 0.5355 0.0053 -0.0438 -0.0105 514 ASP A C 3518 O O . ASP A 503 ? 0.5135 0.5217 0.5295 0.0052 -0.0351 0.0130 514 ASP A O 3519 C CB . ASP A 503 ? 0.4743 0.4818 0.5811 -0.0019 -0.0693 -0.0042 514 ASP A CB 3520 C CG . ASP A 503 ? 0.6472 0.6552 0.8102 -0.0038 -0.0930 -0.0211 514 ASP A CG 3521 O OD1 . ASP A 503 ? 0.5398 0.5398 0.7181 -0.0082 -0.0969 -0.0119 514 ASP A OD1 3522 O OD2 . ASP A 503 ? 0.7133 0.7309 0.9065 0.0009 -0.1097 -0.0458 514 ASP A OD2 3523 N N . TYR A 504 ? 0.5361 0.5464 0.5092 0.0083 -0.0376 -0.0223 515 TYR A N 3524 C CA . TYR A 504 ? 0.7322 0.7370 0.6661 0.0105 -0.0230 -0.0112 515 TYR A CA 3525 C C . TYR A 504 ? 0.7251 0.7414 0.6518 0.0143 -0.0210 -0.0159 515 TYR A C 3526 O O . TYR A 504 ? 0.7376 0.7627 0.6479 0.0168 -0.0207 -0.0262 515 TYR A O 3527 C CB . TYR A 504 ? 0.5651 0.5615 0.4705 0.0101 -0.0195 -0.0165 515 TYR A CB 3528 C CG . TYR A 504 ? 0.5636 0.5492 0.4390 0.0133 -0.0101 -0.0068 515 TYR A CG 3529 C CD1 . TYR A 504 ? 0.5714 0.5573 0.4404 0.0179 -0.0035 0.0053 515 TYR A CD1 3530 C CD2 . TYR A 504 ? 0.6185 0.5952 0.4779 0.0132 -0.0099 -0.0114 515 TYR A CD2 3531 C CE1 . TYR A 504 ? 0.6215 0.5994 0.4661 0.0243 0.0014 0.0085 515 TYR A CE1 3532 C CE2 . TYR A 504 ? 0.5713 0.5371 0.4125 0.0181 -0.0068 -0.0071 515 TYR A CE2 3533 C CZ . TYR A 504 ? 0.5798 0.5463 0.4123 0.0246 -0.0020 0.0007 515 TYR A CZ 3534 O OH . TYR A 504 ? 0.6164 0.5737 0.4334 0.0327 -0.0024 -0.0004 515 TYR A OH 3535 N N . TYR A 505 ? 0.5779 0.5972 0.5190 0.0155 -0.0191 -0.0057 516 TYR A N 3536 C CA . TYR A 505 ? 0.5157 0.5459 0.4537 0.0196 -0.0194 -0.0106 516 TYR A CA 3537 C C . TYR A 505 ? 0.5273 0.5563 0.4686 0.0209 -0.0113 0.0063 516 TYR A C 3538 O O . TYR A 505 ? 0.6057 0.6320 0.5613 0.0197 -0.0068 0.0226 516 TYR A O 3539 C CB . TYR A 505 ? 0.5416 0.5865 0.5130 0.0227 -0.0359 -0.0294 516 TYR A CB 3540 C CG . TYR A 505 ? 0.5141 0.5572 0.5379 0.0195 -0.0461 -0.0238 516 TYR A CG 3541 C CD1 . TYR A 505 ? 0.4427 0.4909 0.4938 0.0208 -0.0485 -0.0164 516 TYR A CD1 3542 C CD2 . TYR A 505 ? 0.4603 0.4975 0.5130 0.0149 -0.0542 -0.0232 516 TYR A CD2 3543 C CE1 . TYR A 505 ? 0.4387 0.4874 0.5494 0.0172 -0.0583 -0.0063 516 TYR A CE1 3544 C CE2 . TYR A 505 ? 0.4091 0.4463 0.5208 0.0112 -0.0647 -0.0125 516 TYR A CE2 3545 C CZ . TYR A 505 ? 0.4745 0.5180 0.6173 0.0121 -0.0665 -0.0029 516 TYR A CZ 3546 O OH . TYR A 505 ? 0.4992 0.5448 0.7117 0.0077 -0.0774 0.0125 516 TYR A OH 3547 N N . TYR A 506 ? 0.4659 0.5007 0.3949 0.0247 -0.0089 0.0043 517 TYR A N 3548 C CA . TYR A 506 ? 0.6036 0.6401 0.5393 0.0270 -0.0023 0.0177 517 TYR A CA 3549 C C . TYR A 506 ? 0.5751 0.6236 0.5392 0.0292 -0.0127 0.0094 517 TYR A C 3550 O O . TYR A 506 ? 0.6290 0.6866 0.5966 0.0321 -0.0244 -0.0091 517 TYR A O 3551 C CB . TYR A 506 ? 0.3397 0.3700 0.2398 0.0308 0.0079 0.0229 517 TYR A CB 3552 C CG . TYR A 506 ? 0.5106 0.5450 0.3939 0.0322 0.0050 0.0144 517 TYR A CG 3553 C CD1 . TYR A 506 ? 0.5421 0.5872 0.4321 0.0358 0.0017 0.0124 517 TYR A CD1 3554 C CD2 . TYR A 506 ? 0.5826 0.6132 0.4465 0.0309 0.0056 0.0114 517 TYR A CD2 3555 C CE1 . TYR A 506 ? 0.5744 0.6291 0.4488 0.0390 -0.0001 0.0095 517 TYR A CE1 3556 C CE2 . TYR A 506 ? 0.7060 0.7471 0.5596 0.0330 0.0048 0.0112 517 TYR A CE2 3557 C CZ . TYR A 506 ? 0.6743 0.7289 0.5313 0.0376 0.0024 0.0112 517 TYR A CZ 3558 O OH . TYR A 506 ? 0.5988 0.6694 0.4450 0.0416 0.0024 0.0155 517 TYR A OH 3559 N N . GLN A 507 ? 0.5388 0.5907 0.5245 0.0300 -0.0091 0.0223 518 GLN A N 3560 C CA . GLN A 507 ? 0.4646 0.5264 0.4794 0.0331 -0.0198 0.0148 518 GLN A CA 3561 C C . GLN A 507 ? 0.4854 0.5489 0.4976 0.0355 -0.0085 0.0306 518 GLN A C 3562 O O . GLN A 507 ? 0.5104 0.5742 0.5250 0.0351 0.0043 0.0504 518 GLN A O 3563 C CB . GLN A 507 ? 0.3615 0.4282 0.4385 0.0305 -0.0352 0.0126 518 GLN A CB 3564 C CG . GLN A 507 ? 0.5510 0.6192 0.6410 0.0313 -0.0526 -0.0105 518 GLN A CG 3565 C CD . GLN A 507 ? 0.6692 0.7412 0.8335 0.0301 -0.0740 -0.0161 518 GLN A CD 3566 O OE1 . GLN A 507 ? 0.5480 0.6189 0.7572 0.0241 -0.0707 0.0087 518 GLN A OE1 3567 N NE2 . GLN A 507 ? 0.6943 0.7742 0.8763 0.0377 -0.0972 -0.0482 518 GLN A NE2 3568 N N . HIS A 508 ? 0.4563 0.5249 0.4626 0.0401 -0.0132 0.0218 519 HIS A N 3569 C CA . HIS A 508 ? 0.3701 0.4416 0.3831 0.0428 -0.0055 0.0343 519 HIS A CA 3570 C C . HIS A 508 ? 0.4490 0.5296 0.4944 0.0462 -0.0201 0.0238 519 HIS A C 3571 O O . HIS A 508 ? 0.6344 0.7206 0.6892 0.0494 -0.0370 0.0036 519 HIS A O 3572 C CB . HIS A 508 ? 0.3581 0.4231 0.3254 0.0463 0.0060 0.0378 519 HIS A CB 3573 C CG . HIS A 508 ? 0.4362 0.5000 0.3740 0.0479 0.0001 0.0255 519 HIS A CG 3574 N ND1 . HIS A 508 ? 0.5329 0.5895 0.4423 0.0458 0.0034 0.0241 519 HIS A ND1 3575 C CD2 . HIS A 508 ? 0.6536 0.7265 0.5879 0.0525 -0.0083 0.0176 519 HIS A CD2 3576 C CE1 . HIS A 508 ? 0.4929 0.5566 0.3859 0.0485 -0.0011 0.0194 519 HIS A CE1 3577 N NE2 . HIS A 508 ? 0.6021 0.6769 0.5067 0.0534 -0.0080 0.0155 519 HIS A NE2 3578 N N . ALA A 509 ? 0.5650 0.6498 0.6287 0.0480 -0.0146 0.0358 520 ALA A N 3579 C CA . ALA A 509 ? 0.5212 0.6137 0.6193 0.0519 -0.0294 0.0262 520 ALA A CA 3580 C C . ALA A 509 ? 0.5481 0.6411 0.6249 0.0562 -0.0203 0.0328 520 ALA A C 3581 O O . ALA A 509 ? 0.6161 0.7140 0.7166 0.0563 -0.0109 0.0491 520 ALA A O 3582 C CB . ALA A 509 ? 0.3339 0.4329 0.5034 0.0482 -0.0362 0.0369 520 ALA A CB 3583 N N . ASN A 510 ? 0.7729 0.8638 0.8077 0.0605 -0.0226 0.0223 521 ASN A N 3584 C CA . ASN A 510 ? 0.7454 0.8355 0.7636 0.0646 -0.0173 0.0276 521 ASN A CA 3585 C C . ASN A 510 ? 0.7147 0.8141 0.7626 0.0701 -0.0323 0.0185 521 ASN A C 3586 O O . ASN A 510 ? 0.7999 0.9077 0.8584 0.0748 -0.0501 0.0009 521 ASN A O 3587 C CB . ASN A 510 ? 0.7700 0.8549 0.7405 0.0662 -0.0141 0.0267 521 ASN A CB 3588 C CG . ASN A 510 ? 0.8469 0.9200 0.7936 0.0622 -0.0008 0.0351 521 ASN A CG 3589 O OD1 . ASN A 510 ? 0.8266 0.8979 0.7847 0.0599 0.0072 0.0414 521 ASN A OD1 3590 N ND2 . ASN A 510 ? 0.6376 0.7049 0.5550 0.0626 0.0004 0.0366 521 ASN A ND2 3591 N N . ARG A 511 ? 0.7270 0.8269 0.7891 0.0716 -0.0262 0.0284 522 ARG A N 3592 C CA . ARG A 511 ? 0.7358 0.8435 0.8335 0.0765 -0.0397 0.0219 522 ARG A CA 3593 C C . ARG A 511 ? 0.6853 0.7982 0.7569 0.0851 -0.0543 0.0070 522 ARG A C 3594 O O . ARG A 511 ? 0.7367 0.8466 0.7642 0.0863 -0.0478 0.0115 522 ARG A O 3595 C CB . ARG A 511 ? 0.6354 0.7442 0.7484 0.0769 -0.0262 0.0382 522 ARG A CB 3596 C CG . ARG A 511 ? 0.5240 0.6410 0.6861 0.0802 -0.0375 0.0360 522 ARG A CG 3597 C CD . ARG A 511 ? 0.5520 0.6755 0.7322 0.0811 -0.0201 0.0551 522 ARG A CD 3598 N NE . ARG A 511 ? 0.5309 0.6482 0.6662 0.0859 -0.0115 0.0553 522 ARG A NE 3599 C CZ . ARG A 511 ? 0.5088 0.6330 0.6516 0.0910 0.0003 0.0650 522 ARG A CZ 3600 N NH1 . ARG A 511 ? 0.4971 0.6136 0.6046 0.0961 0.0032 0.0613 522 ARG A NH1 3601 N NH2 . ARG A 511 ? 0.4792 0.6205 0.6701 0.0919 0.0083 0.0793 522 ARG A NH2 3602 N N . ALA A 512 ? 0.5514 0.6744 0.6542 0.0924 -0.0753 -0.0096 523 ALA A N 3603 C CA . ALA A 512 ? 0.5289 0.6640 0.6084 0.1048 -0.0901 -0.0227 523 ALA A CA 3604 C C . ALA A 512 ? 0.6948 0.8264 0.7761 0.1061 -0.0860 -0.0121 523 ALA A C 3605 O O . ALA A 512 ? 0.9358 1.0663 1.0626 0.1055 -0.0904 -0.0119 523 ALA A O 3606 C CB . ALA A 512 ? 0.4761 0.6257 0.5892 0.1164 -0.1180 -0.0498 523 ALA A CB 3607 N N . TYR A 513 ? 0.5967 0.7277 0.6349 0.1081 -0.0787 -0.0019 524 TYR A N 3608 C CA . TYR A 513 ? 0.5056 0.6307 0.5455 0.1086 -0.0742 0.0093 524 TYR A CA 3609 C C . TYR A 513 ? 0.5738 0.7070 0.5783 0.1159 -0.0790 0.0157 524 TYR A C 3610 O O . TYR A 513 ? 0.6239 0.7622 0.5952 0.1160 -0.0747 0.0229 524 TYR A O 3611 C CB . TYR A 513 ? 0.5463 0.6558 0.5850 0.0994 -0.0534 0.0247 524 TYR A CB 3612 C CG . TYR A 513 ? 0.6581 0.7616 0.6977 0.1017 -0.0495 0.0335 524 TYR A CG 3613 C CD1 . TYR A 513 ? 0.6780 0.7833 0.7540 0.1032 -0.0481 0.0340 524 TYR A CD1 3614 C CD2 . TYR A 513 ? 0.5002 0.5974 0.5111 0.1024 -0.0481 0.0425 524 TYR A CD2 3615 C CE1 . TYR A 513 ? 0.5998 0.7009 0.6781 0.1068 -0.0455 0.0393 524 TYR A CE1 3616 C CE2 . TYR A 513 ? 0.5570 0.6476 0.5755 0.1052 -0.0479 0.0484 524 TYR A CE2 3617 C CZ . TYR A 513 ? 0.5614 0.6539 0.6109 0.1080 -0.0466 0.0448 524 TYR A CZ 3618 O OH . TYR A 513 ? 0.4748 0.5621 0.5333 0.1122 -0.0472 0.0479 524 TYR A OH 3619 N N . SER A 514 ? 0.4219 0.5582 0.4377 0.1222 -0.0877 0.0164 525 SER A N 3620 C CA . SER A 514 ? 0.4839 0.6256 0.4738 0.1272 -0.0896 0.0308 525 SER A CA 3621 C C . SER A 514 ? 0.5098 0.6437 0.5226 0.1286 -0.0933 0.0346 525 SER A C 3622 O O . SER A 514 ? 0.4518 0.5853 0.4982 0.1306 -0.1000 0.0223 525 SER A O 3623 C CB . SER A 514 ? 0.5521 0.7229 0.5155 0.1417 -0.1034 0.0265 525 SER A CB 3624 O OG . SER A 514 ? 0.7479 0.9329 0.7306 0.1542 -0.1233 0.0039 525 SER A OG 3625 N N . SER A 515 ? 0.6030 0.7305 0.6043 0.1273 -0.0895 0.0525 526 SER A N 3626 C CA . SER A 515 ? 0.4852 0.6058 0.5068 0.1298 -0.0947 0.0570 526 SER A CA 3627 C C . SER A 515 ? 0.5571 0.6960 0.5622 0.1400 -0.1084 0.0684 526 SER A C 3628 O O . SER A 515 ? 0.6485 0.7954 0.6307 0.1400 -0.1056 0.0875 526 SER A O 3629 C CB . SER A 515 ? 0.4923 0.5925 0.5199 0.1225 -0.0836 0.0675 526 SER A CB 3630 O OG . SER A 515 ? 0.5663 0.6601 0.6174 0.1260 -0.0893 0.0686 526 SER A OG 3631 N N . ASN A 516 ? 0.5256 0.6744 0.5445 0.1498 -0.1232 0.0588 527 ASN A N 3632 C CA . ASN A 516 ? 0.5464 0.7215 0.5446 0.1643 -0.1378 0.0670 527 ASN A CA 3633 C C . ASN A 516 ? 0.6176 0.7901 0.6327 0.1690 -0.1481 0.0767 527 ASN A C 3634 O O . ASN A 516 ? 0.5694 0.7231 0.6170 0.1643 -0.1484 0.0672 527 ASN A O 3635 C CB . ASN A 516 ? 0.5981 0.7972 0.5903 0.1789 -0.1532 0.0416 527 ASN A CB 3636 C CG . ASN A 516 ? 0.7777 0.9799 0.7584 0.1754 -0.1461 0.0295 527 ASN A CG 3637 O OD1 . ASN A 516 ? 0.7754 0.9784 0.7317 0.1690 -0.1322 0.0458 527 ASN A OD1 3638 N ND2 . ASN A 516 ? 0.9535 1.1569 0.9585 0.1793 -0.1572 0.0012 527 ASN A ND2 3639 N N . THR A 517 ? 0.6552 0.8503 0.6495 0.1793 -0.1559 0.0981 528 THR A N 3640 C CA . THR A 517 ? 0.6659 0.8633 0.6749 0.1863 -0.1690 0.1083 528 THR A CA 3641 C C . THR A 517 ? 0.6465 0.8591 0.6613 0.2017 -0.1877 0.0807 528 THR A C 3642 O O . THR A 517 ? 0.5932 0.8362 0.5818 0.2176 -0.1975 0.0694 528 THR A O 3643 C CB . THR A 517 ? 0.9441 1.1674 0.9315 0.1942 -0.1717 0.1454 528 THR A CB 3644 O OG1 . THR A 517 ? 1.1215 1.3292 1.1149 0.1792 -0.1573 0.1707 528 THR A OG1 3645 C CG2 . THR A 517 ? 0.9012 1.1266 0.9071 0.2014 -0.1866 0.1584 528 THR A CG2 3646 N N . PRO A 518 ? 0.6608 0.8540 0.7133 0.1987 -0.1942 0.0675 529 PRO A N 3647 C CA . PRO A 518 ? 0.6038 0.8076 0.6744 0.2123 -0.2147 0.0403 529 PRO A CA 3648 C C . PRO A 518 ? 0.8578 1.0949 0.9022 0.2344 -0.2347 0.0471 529 PRO A C 3649 O O . PRO A 518 ? 0.7874 1.0343 0.8117 0.2358 -0.2310 0.0795 529 PRO A O 3650 C CB . PRO A 518 ? 0.6203 0.7977 0.7381 0.2028 -0.2134 0.0361 529 PRO A CB 3651 C CG . PRO A 518 ? 0.7022 0.8637 0.8170 0.1923 -0.2005 0.0634 529 PRO A CG 3652 C CD . PRO A 518 ? 0.7402 0.9034 0.8237 0.1848 -0.1847 0.0765 529 PRO A CD 3653 N N . PRO A 519 ? 0.9466 1.2036 0.9946 0.2533 -0.2574 0.0176 530 PRO A N 3654 C CA . PRO A 519 ? 0.7336 1.0289 0.7525 0.2800 -0.2789 0.0198 530 PRO A CA 3655 C C . PRO A 519 ? 0.7861 1.0747 0.8187 0.2801 -0.2847 0.0422 530 PRO A C 3656 O O . PRO A 519 ? 0.8000 1.0546 0.8758 0.2643 -0.2808 0.0397 530 PRO A O 3657 C CB . PRO A 519 ? 0.8336 1.1338 0.8727 0.2915 -0.2995 -0.0250 530 PRO A CB 3658 C CG . PRO A 519 ? 0.9429 1.2104 1.0394 0.2760 -0.2982 -0.0431 530 PRO A CG 3659 C CD . PRO A 519 ? 1.0016 1.2488 1.0862 0.2525 -0.2665 -0.0193 530 PRO A CD 3660 N N . GLN A 520 ? 0.6946 1.0114 0.6929 0.2908 -0.2869 0.0650 531 GLN A N 3661 C CA . GLN A 520 ? 0.7783 1.0928 0.7892 0.2916 -0.2942 0.0900 531 GLN A CA 3662 C C . GLN A 520 ? 0.8800 1.1893 0.9186 0.3008 -0.3160 0.0593 531 GLN A C 3663 O O . GLN A 520 ? 1.0368 1.3658 1.0595 0.3149 -0.3273 0.0319 531 GLN A O 3664 C CB . GLN A 520 ? 0.7347 1.0812 0.7041 0.2975 -0.2873 0.1254 531 GLN A CB 3665 C CG . GLN A 520 ? 0.9153 1.2651 0.8954 0.3011 -0.2983 0.1503 531 GLN A CG 3666 C CD . GLN A 520 ? 0.9543 1.3410 0.8931 0.3108 -0.2923 0.1795 531 GLN A CD 3667 O OE1 . GLN A 520 ? 0.8633 1.2662 0.7967 0.3227 -0.3049 0.1862 531 GLN A OE1 3668 N NE2 . GLN A 520 ? 0.9826 1.3850 0.8933 0.3069 -0.2718 0.1971 531 GLN A NE2 3669 N N . ASN A 521 ? 0.8606 1.1428 0.9433 0.2934 -0.3219 0.0621 532 ASN A N 3670 C CA . ASN A 521 ? 0.9566 1.2287 1.0757 0.2980 -0.3399 0.0333 532 ASN A CA 3671 C C . ASN A 521 ? 1.2724 1.5194 1.4327 0.2897 -0.3429 0.0479 532 ASN A C 3672 O O . ASN A 521 ? 1.4233 1.6407 1.6279 0.2772 -0.3377 0.0363 532 ASN A O 3673 C CB . ASN A 521 ? 0.9486 1.2040 1.1021 0.2929 -0.3418 -0.0063 532 ASN A CB 3674 C CG . ASN A 521 ? 1.1045 1.3512 1.2996 0.2969 -0.3598 -0.0369 532 ASN A CG 3675 O OD1 . ASN A 521 ? 1.2012 1.4463 1.4070 0.3007 -0.3694 -0.0298 532 ASN A OD1 3676 N ND2 . ASN A 521 ? 1.0789 1.3186 1.3021 0.2952 -0.3647 -0.0700 532 ASN A ND2 3677 N N . ASN A 522 ? 1.4104 1.6702 1.5599 0.2960 -0.3502 0.0740 533 ASN A N 3678 C CA . ASN A 522 ? 1.4567 1.7548 1.5563 0.3090 -0.3527 0.0945 533 ASN A CA 3679 C C . ASN A 522 ? 1.3915 1.6934 1.4893 0.3041 -0.3492 0.1454 533 ASN A C 3680 O O . ASN A 522 ? 1.2281 1.5055 1.3666 0.2962 -0.3524 0.1570 533 ASN A O 3681 C CB . ASN A 522 ? 1.4830 1.7991 1.5765 0.3257 -0.3721 0.0683 533 ASN A CB 3682 C CG . ASN A 522 ? 1.4415 1.7318 1.5870 0.3226 -0.3852 0.0490 533 ASN A CG 3683 O OD1 . ASN A 522 ? 1.3385 1.5991 1.5256 0.3111 -0.3819 0.0262 533 ASN A OD1 3684 N ND2 . ASN A 522 ? 1.4678 1.7702 1.6128 0.3322 -0.3991 0.0595 533 ASN A ND2 3685 N N . GLY A 523 ? 1.4808 1.8103 1.5356 0.3084 -0.3424 0.1740 534 GLY A N 3686 C CA . GLY A 523 ? 1.5548 1.8819 1.6119 0.3016 -0.3388 0.2225 534 GLY A CA 3687 C C . GLY A 523 ? 1.5305 1.8635 1.5614 0.2928 -0.3157 0.2476 534 GLY A C 3688 O O . GLY A 523 ? 1.5773 1.9439 1.5666 0.3009 -0.3066 0.2632 534 GLY A O 3689 N N . LYS A 524 ? 1.3821 1.6861 1.4403 0.2770 -0.3044 0.2517 535 LYS A N 3690 C CA . LYS A 524 ? 1.3371 1.6440 1.3785 0.2656 -0.2815 0.2728 535 LYS A CA 3691 C C . LYS A 524 ? 1.1347 1.4220 1.1887 0.2569 -0.2727 0.2484 535 LYS A C 3692 O O . LYS A 524 ? 1.0779 1.3462 1.1620 0.2580 -0.2817 0.2214 535 LYS A O 3693 C CB . LYS A 524 ? 1.4911 1.7832 1.5605 0.2516 -0.2735 0.3163 535 LYS A CB 3694 C CG . LYS A 524 ? 1.6733 1.9903 1.7314 0.2602 -0.2779 0.3477 535 LYS A CG 3695 C CD . LYS A 524 ? 1.6762 2.0411 1.6814 0.2717 -0.2653 0.3580 535 LYS A CD 3696 C CE . LYS A 524 ? 1.7042 2.1020 1.6959 0.2851 -0.2704 0.3859 535 LYS A CE 3697 N NZ . LYS A 524 ? 1.6778 2.0744 1.6664 0.3007 -0.2960 0.3590 535 LYS A NZ 3698 N N . LYS A 525 ? 0.9649 1.2585 0.9972 0.2491 -0.2538 0.2579 536 LYS A N 3699 C CA . LYS A 525 ? 1.0539 1.3323 1.0925 0.2422 -0.2443 0.2362 536 LYS A CA 3700 C C . LYS A 525 ? 1.0579 1.2881 1.1435 0.2187 -0.2362 0.2391 536 LYS A C 3701 O O . LYS A 525 ? 1.0548 1.2795 1.1619 0.2101 -0.2337 0.2760 536 LYS A O 3702 C CB . LYS A 525 ? 1.0567 1.3539 1.0563 0.2396 -0.2265 0.2411 536 LYS A CB 3703 C CG . LYS A 525 ? 1.0255 1.3530 0.9832 0.2563 -0.2301 0.2094 536 LYS A CG 3704 C CD . LYS A 525 ? 1.0251 1.3650 0.9541 0.2524 -0.2122 0.2075 536 LYS A CD 3705 C CE . LYS A 525 ? 1.0513 1.4121 0.9524 0.2680 -0.2187 0.1647 536 LYS A CE 3706 N NZ . LYS A 525 ? 1.0453 1.4084 0.9296 0.2625 -0.2038 0.1555 536 LYS A NZ 3707 N N . ILE A 526 ? 0.9986 1.1969 1.1037 0.2100 -0.2330 0.1999 537 ILE A N 3708 C CA . ILE A 526 ? 0.9822 1.1407 1.1262 0.1927 -0.2251 0.1947 537 ILE A CA 3709 C C . ILE A 526 ? 0.9055 1.0497 1.0386 0.1818 -0.2062 0.1738 537 ILE A C 3710 O O . ILE A 526 ? 0.8782 1.0223 1.0035 0.1834 -0.2021 0.1431 537 ILE A O 3711 C CB . ILE A 526 ? 0.9796 1.1170 1.1614 0.1933 -0.2350 0.1712 537 ILE A CB 3712 C CG1 . ILE A 526 ? 0.8874 1.0366 1.0832 0.2037 -0.2552 0.1924 537 ILE A CG1 3713 C CG2 . ILE A 526 ? 0.8427 0.9465 1.0609 0.1807 -0.2270 0.1621 537 ILE A CG2 3714 C CD1 . ILE A 526 ? 0.8752 1.0045 1.1117 0.2046 -0.2660 0.1709 537 ILE A CD1 3715 N N . SER A 527 ? 0.9252 1.0578 1.0632 0.1711 -0.1966 0.1920 538 SER A N 3716 C CA . SER A 527 ? 0.9247 1.0428 1.0536 0.1612 -0.1796 0.1746 538 SER A CA 3717 C C . SER A 527 ? 0.7815 0.8701 0.9424 0.1556 -0.1757 0.1490 538 SER A C 3718 O O . SER A 527 ? 0.7630 0.8332 0.9559 0.1524 -0.1814 0.1559 538 SER A O 3719 C CB . SER A 527 ? 0.9058 1.0249 1.0304 0.1537 -0.1728 0.2032 538 SER A CB 3720 O OG . SER A 527 ? 0.6619 0.7623 0.8294 0.1486 -0.1821 0.2227 538 SER A OG 3721 N N . PRO A 528 ? 0.7909 0.8786 0.9468 0.1561 -0.1669 0.1201 539 PRO A N 3722 C CA . PRO A 528 ? 0.8191 0.8912 1.0036 0.1552 -0.1611 0.0973 539 PRO A CA 3723 C C . PRO A 528 ? 0.8061 0.8613 0.9974 0.1501 -0.1510 0.0935 539 PRO A C 3724 O O . PRO A 528 ? 0.7734 0.8269 0.9452 0.1444 -0.1451 0.1038 539 PRO A O 3725 C CB . PRO A 528 ? 0.7605 0.8433 0.9369 0.1559 -0.1520 0.0774 539 PRO A CB 3726 C CG . PRO A 528 ? 0.5917 0.6863 0.7317 0.1537 -0.1484 0.0845 539 PRO A CG 3727 C CD . PRO A 528 ? 0.5208 0.6261 0.6465 0.1581 -0.1610 0.1095 539 PRO A CD 3728 N N . ASN A 529 ? 0.7420 0.7879 0.9615 0.1545 -0.1501 0.0769 540 ASN A N 3729 C CA . ASN A 529 ? 0.7639 0.7968 0.9925 0.1555 -0.1455 0.0674 540 ASN A CA 3730 C C . ASN A 529 ? 0.7855 0.8262 1.0100 0.1604 -0.1269 0.0447 540 ASN A C 3731 O O . ASN A 529 ? 0.8408 0.8766 1.0685 0.1658 -0.1230 0.0324 540 ASN A O 3732 C CB . ASN A 529 ? 0.7580 0.7775 1.0263 0.1616 -0.1638 0.0664 540 ASN A CB 3733 C CG . ASN A 529 ? 0.6800 0.7054 0.9734 0.1704 -0.1678 0.0521 540 ASN A CG 3734 O OD1 . ASN A 529 ? 0.6083 0.6483 0.8936 0.1716 -0.1563 0.0440 540 ASN A OD1 3735 N ND2 . ASN A 529 ? 0.5595 0.5739 0.8905 0.1767 -0.1857 0.0492 540 ASN A ND2 3736 N N . GLY A 530 ? 0.7504 0.8064 0.9721 0.1603 -0.1170 0.0402 541 GLY A N 3737 C CA . GLY A 530 ? 0.6718 0.7418 0.8953 0.1647 -0.0975 0.0274 541 GLY A CA 3738 C C . GLY A 530 ? 0.6003 0.6821 0.8563 0.1767 -0.0951 0.0150 541 GLY A C 3739 O O . GLY A 530 ? 0.6104 0.7114 0.8717 0.1836 -0.0772 0.0082 541 GLY A O 3740 N N . SER A 531 ? 0.6170 0.6909 0.8963 0.1804 -0.1125 0.0143 542 SER A N 3741 C CA . SER A 531 ? 0.6117 0.6985 0.9249 0.1924 -0.1115 0.0021 542 SER A CA 3742 C C . SER A 531 ? 0.6532 0.7587 0.9832 0.1901 -0.1019 0.0059 542 SER A C 3743 O O . SER A 531 ? 0.6011 0.7042 0.9208 0.1800 -0.1049 0.0151 542 SER A O 3744 C CB . SER A 531 ? 0.5566 0.6283 0.8943 0.1959 -0.1353 0.0015 542 SER A CB 3745 O OG . SER A 531 ? 0.6385 0.7062 0.9783 0.1881 -0.1477 0.0150 542 SER A OG 3746 N N . GLU A 532 ? 0.5411 0.6678 0.9017 0.2011 -0.0918 -0.0019 543 GLU A N 3747 C CA . GLU A 532 ? 0.5748 0.7219 0.9661 0.1993 -0.0827 0.0041 543 GLU A CA 3748 C C . GLU A 532 ? 0.6596 0.7936 1.0663 0.1921 -0.1044 0.0074 543 GLU A C 3749 O O . GLU A 532 ? 0.7040 0.8447 1.1255 0.1858 -0.1049 0.0123 543 GLU A O 3750 C CB . GLU A 532 ? 0.6090 0.7848 1.0356 0.2147 -0.0693 -0.0021 543 GLU A CB 3751 C CG . GLU A 532 ? 0.7727 0.9776 1.2386 0.2133 -0.0531 0.0103 543 GLU A CG 3752 C CD . GLU A 532 ? 0.9232 1.1650 1.4233 0.2309 -0.0361 0.0085 543 GLU A CD 3753 O OE1 . GLU A 532 ? 0.9123 1.1547 1.4054 0.2455 -0.0410 -0.0081 543 GLU A OE1 3754 O OE2 . GLU A 532 ? 0.9047 1.1777 1.4433 0.2313 -0.0186 0.0244 543 GLU A OE2 3755 N N . THR A 533 ? 0.5216 0.6384 0.9277 0.1947 -0.1248 0.0041 544 THR A N 3756 C CA . THR A 533 ? 0.5599 0.6679 0.9755 0.1917 -0.1471 0.0075 544 THR A CA 3757 C C . THR A 533 ? 0.6727 0.7685 1.0476 0.1839 -0.1581 0.0173 544 THR A C 3758 O O . THR A 533 ? 0.7416 0.8372 1.1155 0.1843 -0.1759 0.0199 544 THR A O 3759 C CB . THR A 533 ? 0.5424 0.6411 0.9792 0.1990 -0.1649 0.0037 544 THR A CB 3760 O OG1 . THR A 533 ? 0.6180 0.6994 1.0329 0.1986 -0.1721 0.0079 544 THR A OG1 3761 C CG2 . THR A 533 ? 0.6062 0.7215 1.0833 0.2097 -0.1544 -0.0080 544 THR A CG2 3762 N N . SER A 534 ? 0.5534 0.6428 0.8949 0.1793 -0.1481 0.0223 545 SER A N 3763 C CA . SER A 534 ? 0.6157 0.6987 0.9191 0.1730 -0.1555 0.0340 545 SER A CA 3764 C C . SER A 534 ? 0.4780 0.5632 0.7537 0.1664 -0.1376 0.0347 545 SER A C 3765 O O . SER A 534 ? 0.4812 0.5572 0.7310 0.1627 -0.1353 0.0423 545 SER A O 3766 C CB . SER A 534 ? 0.5556 0.6244 0.8513 0.1736 -0.1692 0.0467 545 SER A CB 3767 O OG . SER A 534 ? 0.6762 0.7459 0.9384 0.1693 -0.1750 0.0638 545 SER A OG 3768 N N . PRO A 535 ? 0.4649 0.5627 0.7522 0.1646 -0.1264 0.0284 546 PRO A N 3769 C CA . PRO A 535 ? 0.4537 0.5546 0.7207 0.1588 -0.1086 0.0297 546 PRO A CA 3770 C C . PRO A 535 ? 0.6051 0.7020 0.8352 0.1532 -0.1151 0.0352 546 PRO A C 3771 O O . PRO A 535 ? 0.6590 0.7589 0.8831 0.1559 -0.1323 0.0362 546 PRO A O 3772 C CB . PRO A 535 ? 0.6109 0.7283 0.9137 0.1584 -0.0997 0.0261 546 PRO A CB 3773 C CG . PRO A 535 ? 0.5142 0.6336 0.8437 0.1617 -0.1203 0.0211 546 PRO A CG 3774 C CD . PRO A 535 ? 0.4611 0.5706 0.7860 0.1673 -0.1326 0.0218 546 PRO A CD 3775 N N . TYR A 536 ? 0.4495 0.5436 0.6545 0.1478 -0.1016 0.0381 547 TYR A N 3776 C CA . TYR A 536 ? 0.6309 0.7248 0.8019 0.1432 -0.1051 0.0430 547 TYR A CA 3777 C C . TYR A 536 ? 0.6081 0.7145 0.7874 0.1440 -0.1127 0.0345 547 TYR A C 3778 O O . TYR A 536 ? 0.4543 0.5671 0.6697 0.1440 -0.1097 0.0273 547 TYR A O 3779 C CB . TYR A 536 ? 0.5812 0.6693 0.7294 0.1374 -0.0890 0.0459 547 TYR A CB 3780 C CG . TYR A 536 ? 0.5238 0.5982 0.6626 0.1379 -0.0892 0.0521 547 TYR A CG 3781 C CD1 . TYR A 536 ? 0.5112 0.5800 0.6355 0.1363 -0.1011 0.0660 547 TYR A CD1 3782 C CD2 . TYR A 536 ? 0.6286 0.6992 0.7776 0.1420 -0.0790 0.0444 547 TYR A CD2 3783 C CE1 . TYR A 536 ? 0.5884 0.6432 0.7180 0.1360 -0.1049 0.0729 547 TYR A CE1 3784 C CE2 . TYR A 536 ? 0.6576 0.7145 0.8062 0.1447 -0.0847 0.0448 547 TYR A CE2 3785 C CZ . TYR A 536 ? 0.6595 0.7061 0.8031 0.1403 -0.0987 0.0594 547 TYR A CZ 3786 O OH . TYR A 536 ? 0.6857 0.7172 0.8423 0.1421 -0.1078 0.0612 547 TYR A OH 3787 N N . TRP A 537 ? 0.6192 0.7320 0.7693 0.1463 -0.1236 0.0357 548 TRP A N 3788 C CA . TRP A 537 ? 0.4894 0.6160 0.6452 0.1514 -0.1367 0.0218 548 TRP A CA 3789 C C . TRP A 537 ? 0.6280 0.7568 0.7600 0.1462 -0.1278 0.0205 548 TRP A C 3790 O O . TRP A 537 ? 0.7071 0.8413 0.8000 0.1479 -0.1282 0.0279 548 TRP A O 3791 C CB . TRP A 537 ? 0.4788 0.6194 0.6167 0.1642 -0.1582 0.0208 548 TRP A CB 3792 C CG . TRP A 537 ? 0.6234 0.7817 0.7703 0.1762 -0.1792 -0.0007 548 TRP A CG 3793 C CD1 . TRP A 537 ? 0.6331 0.8141 0.7455 0.1908 -0.1946 -0.0059 548 TRP A CD1 3794 C CD2 . TRP A 537 ? 0.7207 0.8791 0.9192 0.1775 -0.1897 -0.0207 548 TRP A CD2 3795 N NE1 . TRP A 537 ? 0.6198 0.8136 0.7562 0.2030 -0.2167 -0.0336 548 TRP A NE1 3796 C CE2 . TRP A 537 ? 0.6921 0.8698 0.8861 0.1936 -0.2151 -0.0424 548 TRP A CE2 3797 C CE3 . TRP A 537 ? 0.7333 0.8812 0.9852 0.1682 -0.1806 -0.0209 548 TRP A CE3 3798 C CZ2 . TRP A 537 ? 0.6347 0.8160 0.8826 0.1992 -0.2352 -0.0670 548 TRP A CZ2 3799 C CZ3 . TRP A 537 ? 0.7255 0.8790 1.0322 0.1718 -0.1970 -0.0386 548 TRP A CZ3 3800 C CH2 . TRP A 537 ? 0.7919 0.9591 1.0996 0.1865 -0.2259 -0.0628 548 TRP A CH2 3801 N N . VAL A 538 ? 0.6070 0.7338 0.7671 0.1401 -0.1191 0.0140 549 VAL A N 3802 C CA . VAL A 538 ? 0.4664 0.5915 0.6103 0.1329 -0.1071 0.0152 549 VAL A CA 3803 C C . VAL A 538 ? 0.5109 0.6456 0.6813 0.1351 -0.1199 -0.0011 549 VAL A C 3804 O O . VAL A 538 ? 0.6096 0.7481 0.8294 0.1375 -0.1307 -0.0097 549 VAL A O 3805 C CB . VAL A 538 ? 0.4586 0.5748 0.6132 0.1246 -0.0839 0.0259 549 VAL A CB 3806 C CG1 . VAL A 538 ? 0.4012 0.5205 0.5704 0.1182 -0.0745 0.0255 549 VAL A CG1 3807 C CG2 . VAL A 538 ? 0.4517 0.5571 0.5689 0.1227 -0.0740 0.0362 549 VAL A CG2 3808 N N . THR A 539 ? 0.4243 0.5633 0.5678 0.1350 -0.1211 -0.0064 550 THR A N 3809 C CA . THR A 539 ? 0.5693 0.7152 0.7445 0.1365 -0.1338 -0.0235 550 THR A CA 3810 C C . THR A 539 ? 0.5325 0.6710 0.7068 0.1246 -0.1157 -0.0148 550 THR A C 3811 O O . THR A 539 ? 0.5185 0.6523 0.6475 0.1204 -0.1016 -0.0053 550 THR A O 3812 C CB . THR A 539 ? 0.5742 0.7385 0.7265 0.1524 -0.1579 -0.0452 550 THR A CB 3813 O OG1 . THR A 539 ? 0.7233 0.8918 0.8964 0.1527 -0.1670 -0.0618 550 THR A OG1 3814 C CG2 . THR A 539 ? 0.5343 0.7063 0.6219 0.1562 -0.1494 -0.0331 550 THR A CG2 3815 N N . ILE A 540 ? 0.5685 0.7067 0.7983 0.1192 -0.1167 -0.0156 551 ILE A N 3816 C CA . ILE A 540 ? 0.4805 0.6145 0.7154 0.1087 -0.1005 -0.0046 551 ILE A CA 3817 C C . ILE A 540 ? 0.4645 0.6035 0.7460 0.1093 -0.1196 -0.0198 551 ILE A C 3818 O O . ILE A 540 ? 0.5157 0.6589 0.8639 0.1107 -0.1350 -0.0249 551 ILE A O 3819 C CB . ILE A 540 ? 0.4042 0.5378 0.6679 0.1010 -0.0776 0.0192 551 ILE A CB 3820 C CG1 . ILE A 540 ? 0.3766 0.5051 0.5967 0.1027 -0.0611 0.0294 551 ILE A CG1 3821 C CG2 . ILE A 540 ? 0.5069 0.6409 0.7768 0.0927 -0.0626 0.0321 551 ILE A CG2 3822 C CD1 . ILE A 540 ? 0.5414 0.6777 0.7889 0.1017 -0.0412 0.0479 551 ILE A CD1 3823 N N . GLY A 541 ? 0.4800 0.6185 0.7322 0.1085 -0.1205 -0.0275 552 GLY A N 3824 C CA . GLY A 541 ? 0.5199 0.6622 0.8163 0.1098 -0.1401 -0.0443 552 GLY A CA 3825 C C . GLY A 541 ? 0.7062 0.8420 1.0071 0.0971 -0.1221 -0.0270 552 GLY A C 3826 O O . GLY A 541 ? 0.5709 0.7010 0.8361 0.0894 -0.0950 -0.0045 552 GLY A O 3827 N N . ARG A 542 ? 0.9101 1.0477 1.2581 0.0964 -0.1396 -0.0392 553 ARG A N 3828 C CA . ARG A 542 ? 1.0219 1.1545 1.3823 0.0848 -0.1255 -0.0218 553 ARG A CA 3829 C C . ARG A 542 ? 1.0199 1.1485 1.3029 0.0848 -0.1134 -0.0262 553 ARG A C 3830 O O . ARG A 542 ? 1.0606 1.1944 1.2946 0.0951 -0.1218 -0.0456 553 ARG A O 3831 C CB . ARG A 542 ? 1.1436 1.2783 1.5860 0.0846 -0.1526 -0.0348 553 ARG A CB 3832 C CG . ARG A 542 ? 1.2139 1.3529 1.7469 0.0837 -0.1668 -0.0277 553 ARG A CG 3833 C CD . ARG A 542 ? 1.2429 1.3834 1.8601 0.0898 -0.2074 -0.0555 553 ARG A CD 3834 N NE . ARG A 542 ? 1.2280 1.3665 1.9160 0.0773 -0.2073 -0.0339 553 ARG A NE 3835 C CZ . ARG A 542 ? 1.1759 1.3068 1.8645 0.0767 -0.2205 -0.0516 553 ARG A CZ 3836 N NH1 . ARG A 542 ? 1.0839 1.2179 1.7165 0.0917 -0.2374 -0.0921 553 ARG A NH1 3837 N NH2 . ARG A 542 ? 1.1739 1.2952 1.9155 0.0618 -0.2153 -0.0270 553 ARG A NH2 3838 N N . GLY A 543 ? 0.8820 1.0046 1.1563 0.0744 -0.0935 -0.0058 554 GLY A N 3839 C CA . GLY A 543 ? 0.9262 1.0436 1.1345 0.0731 -0.0812 -0.0074 554 GLY A CA 3840 C C . GLY A 543 ? 1.0955 1.2178 1.2949 0.0796 -0.1011 -0.0349 554 GLY A C 3841 O O . GLY A 543 ? 1.2136 1.3396 1.4683 0.0822 -0.1237 -0.0509 554 GLY A O 3842 N N . ASN A 544 ? 0.9509 1.0754 1.0852 0.0836 -0.0940 -0.0405 555 ASN A N 3843 C CA . ASN A 544 ? 0.7622 0.8972 0.8792 0.0915 -0.1077 -0.0637 555 ASN A CA 3844 C C . ASN A 544 ? 0.6380 0.7623 0.7374 0.0807 -0.0920 -0.0517 555 ASN A C 3845 O O . ASN A 544 ? 0.7724 0.8882 0.8287 0.0744 -0.0705 -0.0332 555 ASN A O 3846 C CB . ASN A 544 ? 0.9061 1.0584 0.9671 0.1049 -0.1092 -0.0730 555 ASN A CB 3847 C CG . ASN A 544 ? 0.9429 1.1188 0.9915 0.1206 -0.1277 -0.1018 555 ASN A CG 3848 O OD1 . ASN A 544 ? 0.9341 1.1144 0.9499 0.1193 -0.1182 -0.0996 555 ASN A OD1 3849 N ND2 . ASN A 544 ? 0.7333 0.9274 0.8091 0.1380 -0.1555 -0.1309 555 ASN A ND2 3850 N N . VAL A 545 ? 0.4870 0.6108 0.6248 0.0791 -0.1051 -0.0631 556 VAL A N 3851 C CA . VAL A 545 ? 0.5780 0.6910 0.7051 0.0686 -0.0917 -0.0507 556 VAL A CA 3852 C C . VAL A 545 ? 0.6092 0.7302 0.6856 0.0742 -0.0905 -0.0645 556 VAL A C 3853 O O . VAL A 545 ? 0.4993 0.6387 0.5756 0.0876 -0.1094 -0.0918 556 VAL A O 3854 C CB . VAL A 545 ? 0.4832 0.5909 0.6806 0.0619 -0.1038 -0.0487 556 VAL A CB 3855 C CG1 . VAL A 545 ? 0.5153 0.6322 0.7760 0.0711 -0.1351 -0.0731 556 VAL A CG1 3856 C CG2 . VAL A 545 ? 0.3411 0.4450 0.5288 0.0584 -0.1043 -0.0545 556 VAL A CG2 3857 N N . VAL A 546 ? 0.7042 0.8145 0.7399 0.0659 -0.0688 -0.0457 557 VAL A N 3858 C CA . VAL A 546 ? 0.6987 0.8168 0.6877 0.0694 -0.0633 -0.0508 557 VAL A CA 3859 C C . VAL A 546 ? 0.7144 0.8192 0.7016 0.0597 -0.0553 -0.0443 557 VAL A C 3860 O O . VAL A 546 ? 0.7258 0.8135 0.7194 0.0499 -0.0429 -0.0251 557 VAL A O 3861 C CB . VAL A 546 ? 0.5012 0.6182 0.4463 0.0690 -0.0470 -0.0331 557 VAL A CB 3862 C CG1 . VAL A 546 ? 0.4107 0.5314 0.3192 0.0680 -0.0373 -0.0279 557 VAL A CG1 3863 C CG2 . VAL A 546 ? 0.5712 0.7068 0.5107 0.0811 -0.0560 -0.0401 557 VAL A CG2 3864 N N . THR A 547 ? 0.5348 0.6511 0.5122 0.0646 -0.0624 -0.0606 558 THR A N 3865 C CA . THR A 547 ? 0.4835 0.5878 0.4568 0.0562 -0.0559 -0.0560 558 THR A CA 3866 C C . THR A 547 ? 0.4102 0.5205 0.3379 0.0570 -0.0437 -0.0508 558 THR A C 3867 O O . THR A 547 ? 0.6954 0.8305 0.6026 0.0681 -0.0465 -0.0594 558 THR A O 3868 C CB . THR A 547 ? 0.3432 0.4537 0.3553 0.0595 -0.0758 -0.0786 558 THR A CB 3869 O OG1 . THR A 547 ? 0.4043 0.5087 0.4730 0.0573 -0.0893 -0.0795 558 THR A OG1 3870 C CG2 . THR A 547 ? 0.3405 0.4370 0.3499 0.0500 -0.0690 -0.0716 558 THR A CG2 3871 N N . GLY A 548 ? 0.5163 0.6069 0.4312 0.0468 -0.0307 -0.0354 559 GLY A N 3872 C CA . GLY A 548 ? 0.5788 0.6722 0.4635 0.0459 -0.0214 -0.0294 559 GLY A CA 3873 C C . GLY A 548 ? 0.5371 0.6186 0.4260 0.0395 -0.0208 -0.0318 559 GLY A C 3874 O O . GLY A 548 ? 0.5310 0.5915 0.4286 0.0322 -0.0173 -0.0233 559 GLY A O 3875 N N . GLN A 549 ? 0.4367 0.5356 0.3186 0.0441 -0.0240 -0.0428 560 GLN A N 3876 C CA . GLN A 549 ? 0.4402 0.5291 0.3247 0.0384 -0.0234 -0.0454 560 GLN A CA 3877 C C . GLN A 549 ? 0.5478 0.6224 0.4119 0.0318 -0.0106 -0.0274 560 GLN A C 3878 O O . GLN A 549 ? 0.7251 0.8136 0.5752 0.0346 -0.0042 -0.0179 560 GLN A O 3879 C CB . GLN A 549 ? 0.4050 0.5222 0.2930 0.0480 -0.0324 -0.0660 560 GLN A CB 3880 C CG . GLN A 549 ? 0.4554 0.5887 0.3696 0.0584 -0.0510 -0.0906 560 GLN A CG 3881 C CD . GLN A 549 ? 0.5828 0.6931 0.5371 0.0504 -0.0627 -0.0962 560 GLN A CD 3882 O OE1 . GLN A 549 ? 0.5504 0.6408 0.5082 0.0403 -0.0582 -0.0873 560 GLN A OE1 3883 N NE2 . GLN A 549 ? 0.5458 0.6603 0.5355 0.0555 -0.0792 -0.1094 560 GLN A NE2 3884 N N . ILE A 550 ? 0.6167 0.6656 0.4836 0.0244 -0.0087 -0.0220 561 ILE A N 3885 C CA . ILE A 550 ? 0.5796 0.6112 0.4329 0.0206 -0.0016 -0.0098 561 ILE A CA 3886 C C . ILE A 550 ? 0.6362 0.6692 0.4896 0.0181 -0.0019 -0.0126 561 ILE A C 3887 O O . ILE A 550 ? 0.7100 0.7384 0.5602 0.0164 0.0018 -0.0028 561 ILE A O 3888 C CB . ILE A 550 ? 0.6454 0.6546 0.4977 0.0191 -0.0002 -0.0044 561 ILE A CB 3889 C CG1 . ILE A 550 ? 0.5564 0.5688 0.4121 0.0221 0.0020 0.0010 561 ILE A CG1 3890 C CG2 . ILE A 550 ? 0.7471 0.7395 0.5875 0.0195 0.0020 0.0011 561 ILE A CG2 3891 C CD1 . ILE A 550 ? 0.6720 0.6736 0.5272 0.0242 0.0058 0.0094 561 ILE A CD1 3892 N N . CYS A 551 ? 0.6255 0.6654 0.4895 0.0181 -0.0081 -0.0260 562 CYS A N 3893 C CA . CYS A 551 ? 0.5283 0.5726 0.3953 0.0166 -0.0090 -0.0309 562 CYS A CA 3894 C C . CYS A 551 ? 0.5885 0.6576 0.4507 0.0200 -0.0020 -0.0220 562 CYS A C 3895 O O . CYS A 551 ? 0.6462 0.7426 0.5029 0.0274 0.0005 -0.0203 562 CYS A O 3896 C CB . CYS A 551 ? 0.4981 0.5543 0.3812 0.0193 -0.0191 -0.0503 562 CYS A CB 3897 S SG . CYS A 551 ? 0.8210 0.8492 0.7200 0.0122 -0.0271 -0.0539 562 CYS A SG 3898 N N . ARG A 552 ? 0.7044 0.7662 0.5718 0.0155 0.0007 -0.0141 563 ARG A N 3899 C CA . ARG A 552 ? 0.6241 0.7153 0.4973 0.0183 0.0081 -0.0011 563 ARG A CA 3900 C C . ARG A 552 ? 0.6666 0.7645 0.5506 0.0173 0.0062 -0.0101 563 ARG A C 3901 O O . ARG A 552 ? 0.8243 0.8971 0.7113 0.0129 -0.0017 -0.0243 563 ARG A O 3902 C CB . ARG A 552 ? 0.5439 0.6221 0.4278 0.0131 0.0120 0.0221 563 ARG A CB 3903 C CG . ARG A 552 ? 0.6585 0.7288 0.5352 0.0142 0.0129 0.0312 563 ARG A CG 3904 C CD . ARG A 552 ? 0.5299 0.6390 0.3966 0.0229 0.0190 0.0377 563 ARG A CD 3905 N NE . ARG A 552 ? 0.6124 0.7139 0.4649 0.0261 0.0147 0.0242 563 ARG A NE 3906 C CZ . ARG A 552 ? 0.6086 0.7039 0.4576 0.0268 0.0156 0.0336 563 ARG A CZ 3907 N NH1 . ARG A 552 ? 0.6486 0.7436 0.5087 0.0246 0.0191 0.0561 563 ARG A NH1 3908 N NH2 . ARG A 552 ? 0.5414 0.6311 0.3825 0.0296 0.0116 0.0215 563 ARG A NH2 3909 N N . LEU A 553 ? 0.4380 0.5728 0.3292 0.0225 0.0141 0.0005 564 LEU A N 3910 C CA . LEU A 553 ? 0.5035 0.6499 0.4073 0.0228 0.0135 -0.0071 564 LEU A CA 3911 C C . LEU A 553 ? 0.5497 0.7025 0.4772 0.0176 0.0213 0.0192 564 LEU A C 3912 O O . LEU A 553 ? 0.5358 0.7216 0.4703 0.0218 0.0321 0.0447 564 LEU A O 3913 C CB . LEU A 553 ? 0.5049 0.7008 0.4010 0.0382 0.0147 -0.0227 564 LEU A CB 3914 C CG . LEU A 553 ? 0.5200 0.7141 0.4052 0.0454 0.0027 -0.0506 564 LEU A CG 3915 C CD1 . LEU A 553 ? 0.5358 0.7845 0.4164 0.0655 0.0004 -0.0701 564 LEU A CD1 3916 C CD2 . LEU A 553 ? 0.5385 0.6895 0.4346 0.0355 -0.0104 -0.0684 564 LEU A CD2 3917 N N . GLY A 554 ? 0.5449 0.6670 0.4894 0.0089 0.0146 0.0146 565 GLY A N 3918 C CA . GLY A 554 ? 0.5766 0.7018 0.5549 0.0034 0.0179 0.0365 565 GLY A CA 3919 C C . GLY A 554 ? 0.6763 0.7829 0.6768 -0.0028 0.0168 0.0611 565 GLY A C 3920 O O . GLY A 554 ? 0.7494 0.8748 0.7868 -0.0053 0.0222 0.0890 565 GLY A O 3921 N N . ASN A 555 ? 0.5885 0.6602 0.5726 -0.0044 0.0087 0.0521 566 ASN A N 3922 C CA . ASN A 555 ? 0.4986 0.5520 0.5056 -0.0079 0.0041 0.0701 566 ASN A CA 3923 C C . ASN A 555 ? 0.6127 0.6189 0.6365 -0.0114 -0.0136 0.0565 566 ASN A C 3924 O O . ASN A 555 ? 0.6244 0.6107 0.6715 -0.0120 -0.0230 0.0640 566 ASN A O 3925 C CB . ASN A 555 ? 0.4589 0.5125 0.4395 -0.0039 0.0068 0.0705 566 ASN A CB 3926 C CG . ASN A 555 ? 0.7166 0.7427 0.6621 -0.0016 0.0002 0.0425 566 ASN A CG 3927 O OD1 . ASN A 555 ? 0.7630 0.7887 0.6935 -0.0009 -0.0009 0.0245 566 ASN A OD1 3928 N ND2 . ASN A 555 ? 0.7246 0.7300 0.6616 0.0000 -0.0044 0.0409 566 ASN A ND2 3929 N N . ASN A 556 ? 0.6060 0.5965 0.6190 -0.0116 -0.0199 0.0348 567 ASN A N 3930 C CA . ASN A 556 ? 0.5371 0.4883 0.5612 -0.0110 -0.0379 0.0183 567 ASN A CA 3931 C C . ASN A 556 ? 0.5572 0.4793 0.5658 -0.0043 -0.0493 0.0063 567 ASN A C 3932 O O . ASN A 556 ? 0.6765 0.5746 0.7115 -0.0009 -0.0661 0.0005 567 ASN A O 3933 C CB . ASN A 556 ? 0.5536 0.5016 0.6338 -0.0157 -0.0462 0.0312 567 ASN A CB 3934 C CG . ASN A 556 ? 0.6304 0.6076 0.7257 -0.0200 -0.0358 0.0399 567 ASN A CG 3935 O OD1 . ASN A 556 ? 0.5796 0.5506 0.6576 -0.0194 -0.0384 0.0204 567 ASN A OD1 3936 N ND2 . ASN A 556 ? 0.7897 0.8025 0.9194 -0.0232 -0.0237 0.0711 567 ASN A ND2 3937 N N . THR A 557 ? 0.5034 0.4300 0.4731 -0.0006 -0.0416 0.0012 568 THR A N 3938 C CA . THR A 557 ? 0.6383 0.5428 0.5865 0.0085 -0.0503 -0.0125 568 THR A CA 3939 C C . THR A 557 ? 0.6870 0.5933 0.5962 0.0118 -0.0448 -0.0237 568 THR A C 3940 O O . THR A 557 ? 0.4903 0.4085 0.3955 0.0065 -0.0389 -0.0246 568 THR A O 3941 C CB . THR A 557 ? 0.6549 0.5638 0.6047 0.0107 -0.0472 -0.0019 568 THR A CB 3942 O OG1 . THR A 557 ? 0.5816 0.5166 0.5134 0.0067 -0.0308 0.0094 568 THR A OG1 3943 C CG2 . THR A 557 ? 0.4567 0.3630 0.4561 0.0073 -0.0554 0.0133 568 THR A CG2 3944 N N . TYR A 558 ? 0.6395 0.5368 0.5250 0.0214 -0.0474 -0.0310 569 TYR A N 3945 C CA . TYR A 558 ? 0.6834 0.5857 0.5406 0.0246 -0.0416 -0.0344 569 TYR A CA 3946 C C . TYR A 558 ? 0.6670 0.5898 0.5226 0.0162 -0.0291 -0.0258 569 TYR A C 3947 O O . TYR A 558 ? 0.7628 0.6910 0.6134 0.0142 -0.0272 -0.0280 569 TYR A O 3948 C CB . TYR A 558 ? 0.6736 0.5722 0.5087 0.0382 -0.0431 -0.0380 569 TYR A CB 3949 C CG . TYR A 558 ? 0.7476 0.6575 0.5621 0.0410 -0.0347 -0.0326 569 TYR A CG 3950 C CD1 . TYR A 558 ? 0.7554 0.6633 0.5602 0.0460 -0.0387 -0.0352 569 TYR A CD1 3951 C CD2 . TYR A 558 ? 0.6680 0.5918 0.4790 0.0385 -0.0238 -0.0223 569 TYR A CD2 3952 C CE1 . TYR A 558 ? 0.7610 0.6820 0.5575 0.0478 -0.0312 -0.0236 569 TYR A CE1 3953 C CE2 . TYR A 558 ? 0.7353 0.6704 0.5404 0.0401 -0.0175 -0.0133 569 TYR A CE2 3954 C CZ . TYR A 558 ? 0.7080 0.6424 0.5081 0.0442 -0.0208 -0.0120 569 TYR A CZ 3955 O OH . TYR A 558 ? 0.7148 0.6631 0.5186 0.0451 -0.0147 0.0033 569 TYR A OH 3956 N N . THR A 559 ? 0.6000 0.5354 0.4637 0.0129 -0.0230 -0.0166 570 THR A N 3957 C CA . THR A 559 ? 0.5840 0.5422 0.4453 0.0093 -0.0142 -0.0124 570 THR A CA 3958 C C . THR A 559 ? 0.6915 0.6678 0.5648 0.0048 -0.0125 -0.0146 570 THR A C 3959 O O . THR A 559 ? 0.6081 0.6084 0.4805 0.0057 -0.0081 -0.0157 570 THR A O 3960 C CB . THR A 559 ? 0.6527 0.6228 0.5150 0.0103 -0.0086 -0.0013 570 THR A CB 3961 O OG1 . THR A 559 ? 1.0103 0.9806 0.8924 0.0082 -0.0101 0.0094 570 THR A OG1 3962 C CG2 . THR A 559 ? 0.4684 0.4269 0.3179 0.0162 -0.0090 -0.0015 570 THR A CG2 3963 N N . ASP A 560 ? 0.6273 0.5949 0.5130 0.0023 -0.0174 -0.0174 571 ASP A N 3964 C CA . ASP A 560 ? 0.4478 0.4355 0.3456 -0.0003 -0.0155 -0.0206 571 ASP A CA 3965 C C . ASP A 560 ? 0.5893 0.5750 0.4823 -0.0001 -0.0205 -0.0358 571 ASP A C 3966 O O . ASP A 560 ? 0.9513 0.9153 0.8437 -0.0010 -0.0278 -0.0417 571 ASP A O 3967 C CB . ASP A 560 ? 0.5709 0.5510 0.4907 -0.0036 -0.0194 -0.0169 571 ASP A CB 3968 C CG . ASP A 560 ? 0.7053 0.7177 0.6408 -0.0044 -0.0129 -0.0134 571 ASP A CG 3969 O OD1 . ASP A 560 ? 0.6984 0.7347 0.6239 -0.0004 -0.0096 -0.0229 571 ASP A OD1 3970 O OD2 . ASP A 560 ? 0.7360 0.7528 0.6977 -0.0073 -0.0123 -0.0016 571 ASP A OD2 3971 N N . CYS A 561 ? 0.5560 0.5657 0.4491 0.0027 -0.0186 -0.0423 572 CYS A N 3972 C CA . CYS A 561 ? 0.5149 0.5223 0.4150 0.0030 -0.0270 -0.0564 572 CYS A CA 3973 C C . CYS A 561 ? 0.5298 0.5555 0.4448 0.0046 -0.0313 -0.0704 572 CYS A C 3974 O O . CYS A 561 ? 0.6468 0.6797 0.5758 0.0071 -0.0406 -0.0860 572 CYS A O 3975 C CB . CYS A 561 ? 0.4785 0.4978 0.3790 0.0068 -0.0281 -0.0597 572 CYS A CB 3976 S SG . CYS A 561 ? 0.6849 0.6867 0.5706 0.0062 -0.0224 -0.0437 572 CYS A SG 3977 N N . THR A 562 ? 0.4730 0.5079 0.3911 0.0040 -0.0256 -0.0645 573 THR A N 3978 C CA . THR A 562 ? 0.4509 0.5024 0.3841 0.0058 -0.0287 -0.0762 573 THR A CA 3979 C C . THR A 562 ? 0.6140 0.6329 0.5554 -0.0003 -0.0398 -0.0837 573 THR A C 3980 O O . THR A 562 ? 0.6560 0.6483 0.5939 -0.0049 -0.0407 -0.0746 573 THR A O 3981 C CB . THR A 562 ? 0.4126 0.4816 0.3544 0.0054 -0.0189 -0.0616 573 THR A CB 3982 O OG1 . THR A 562 ? 0.9434 1.0403 0.8778 0.0103 -0.0073 -0.0452 573 THR A OG1 3983 C CG2 . THR A 562 ? 0.4261 0.5236 0.3833 0.0104 -0.0197 -0.0740 573 THR A CG2 3984 N N . PRO A 563 ? 0.4295 0.4517 0.3848 0.0015 -0.0506 -0.1011 574 PRO A N 3985 C CA . PRO A 563 ? 0.4563 0.4501 0.4221 -0.0037 -0.0619 -0.1047 574 PRO A CA 3986 C C . PRO A 563 ? 0.6027 0.5836 0.5710 -0.0072 -0.0621 -0.1022 574 PRO A C 3987 O O . PRO A 563 ? 0.6960 0.6979 0.6743 -0.0056 -0.0579 -0.1061 574 PRO A O 3988 C CB . PRO A 563 ? 0.3229 0.3315 0.3149 0.0000 -0.0748 -0.1256 574 PRO A CB 3989 C CG . PRO A 563 ? 0.4495 0.4987 0.4404 0.0103 -0.0700 -0.1378 574 PRO A CG 3990 C CD . PRO A 563 ? 0.4037 0.4587 0.3697 0.0107 -0.0553 -0.1196 574 PRO A CD 3991 N N . ARG A 564 ? 0.4373 0.3433 0.5117 -0.0048 -0.0838 0.0121 575 ARG A N 3992 C CA . ARG A 564 ? 0.4170 0.3632 0.5077 -0.0107 -0.0771 0.0242 575 ARG A CA 3993 C C . ARG A 564 ? 0.5349 0.4930 0.6254 0.0041 -0.0739 0.0288 575 ARG A C 3994 O O . ARG A 564 ? 0.4964 0.4460 0.5916 0.0007 -0.0793 0.0261 575 ARG A O 3995 C CB . ARG A 564 ? 0.5199 0.4748 0.6292 -0.0330 -0.0826 0.0231 575 ARG A CB 3996 C CG . ARG A 564 ? 0.7276 0.6535 0.8352 -0.0418 -0.0912 0.0094 575 ARG A CG 3997 C CD . ARG A 564 ? 0.7505 0.6770 0.8653 -0.0573 -0.0976 0.0059 575 ARG A CD 3998 N NE . ARG A 564 ? 0.9227 0.8677 1.0529 -0.0701 -0.1018 0.0061 575 ARG A NE 3999 C CZ . ARG A 564 ? 0.8383 0.7756 0.9739 -0.0804 -0.1111 -0.0051 575 ARG A CZ 4000 N NH1 . ARG A 564 ? 0.8470 0.8010 0.9927 -0.0886 -0.1157 -0.0056 575 ARG A NH1 4001 N NH2 . ARG A 564 ? 0.5379 0.4506 0.6677 -0.0807 -0.1168 -0.0167 575 ARG A NH2 4002 N N . SER A 565 ? 0.4175 0.3972 0.5022 0.0212 -0.0656 0.0362 576 SER A N 4003 C CA . SER A 565 ? 0.5715 0.5594 0.6525 0.0410 -0.0643 0.0381 576 SER A CA 4004 C C . SER A 565 ? 0.6006 0.6377 0.7008 0.0404 -0.0557 0.0522 576 SER A C 4005 O O . SER A 565 ? 0.5968 0.6648 0.7009 0.0423 -0.0465 0.0618 576 SER A O 4006 C CB . SER A 565 ? 0.5284 0.4975 0.5828 0.0691 -0.0640 0.0315 576 SER A CB 4007 O OG . SER A 565 ? 0.9084 0.8740 0.9559 0.0903 -0.0683 0.0293 576 SER A OG 4008 N N . ILE A 566 ? 0.5432 0.5884 0.6562 0.0364 -0.0597 0.0548 577 ILE A N 4009 C CA . ILE A 566 ? 0.6081 0.6976 0.7412 0.0360 -0.0543 0.0678 577 ILE A CA 4010 C C . ILE A 566 ? 0.6484 0.7380 0.7776 0.0568 -0.0575 0.0662 577 ILE A C 4011 O O . ILE A 566 ? 0.6406 0.7007 0.7638 0.0545 -0.0678 0.0597 577 ILE A O 4012 C CB . ILE A 566 ? 0.4099 0.5093 0.5637 0.0093 -0.0595 0.0730 577 ILE A CB 4013 C CG1 . ILE A 566 ? 0.4296 0.5228 0.5861 -0.0105 -0.0611 0.0724 577 ILE A CG1 4014 C CG2 . ILE A 566 ? 0.3732 0.5165 0.5492 0.0082 -0.0564 0.0874 577 ILE A CG2 4015 C CD1 . ILE A 566 ? 0.4179 0.5181 0.5913 -0.0335 -0.0692 0.0751 577 ILE A CD1 4016 N N . ASN A 567 ? 0.6146 0.7394 0.7476 0.0772 -0.0495 0.0727 578 ASN A N 4017 C CA . ASN A 567 ? 0.6900 0.8149 0.8180 0.1013 -0.0543 0.0695 578 ASN A CA 4018 C C . ASN A 567 ? 0.7298 0.9052 0.8837 0.1028 -0.0494 0.0825 578 ASN A C 4019 O O . ASN A 567 ? 0.8724 1.0880 1.0468 0.0892 -0.0403 0.0957 578 ASN A O 4020 C CB . ASN A 567 ? 0.4764 0.5898 0.5784 0.1348 -0.0527 0.0599 578 ASN A CB 4021 C CG . ASN A 567 ? 0.8250 0.8801 0.9008 0.1356 -0.0634 0.0462 578 ASN A CG 4022 O OD1 . ASN A 567 ? 0.9334 0.9500 0.9946 0.1465 -0.0784 0.0373 578 ASN A OD1 4023 N ND2 . ASN A 567 ? 0.7623 0.8096 0.8332 0.1226 -0.0579 0.0454 578 ASN A ND2 4024 N N . GLY A 568 ? 0.5849 0.7570 0.7387 0.1182 -0.0577 0.0797 579 GLY A N 4025 C CA . GLY A 568 ? 0.5617 0.7803 0.7412 0.1209 -0.0550 0.0912 579 GLY A CA 4026 C C . GLY A 568 ? 0.6694 0.8815 0.8469 0.1413 -0.0664 0.0867 579 GLY A C 4027 O O . GLY A 568 ? 0.6482 0.8133 0.8031 0.1514 -0.0800 0.0750 579 GLY A O 4028 N N . LYS A 569 ? 0.6747 0.9349 0.8777 0.1463 -0.0628 0.0974 580 LYS A N 4029 C CA . LYS A 569 ? 0.5564 0.8175 0.7633 0.1638 -0.0745 0.0951 580 LYS A CA 4030 C C . LYS A 569 ? 0.5785 0.8584 0.8127 0.1379 -0.0791 0.1079 580 LYS A C 4031 O O . LYS A 569 ? 0.4386 0.7467 0.6931 0.1148 -0.0708 0.1200 580 LYS A O 4032 C CB . LYS A 569 ? 0.6247 0.9330 0.8383 0.1998 -0.0660 0.0952 580 LYS A CB 4033 C CG . LYS A 569 ? 0.8049 1.0926 0.9864 0.2332 -0.0647 0.0797 580 LYS A CG 4034 C CD . LYS A 569 ? 0.8966 1.2420 1.0852 0.2704 -0.0530 0.0802 580 LYS A CD 4035 C CE . LYS A 569 ? 1.0923 1.4056 1.2432 0.3118 -0.0604 0.0597 580 LYS A CE 4036 N NZ . LYS A 569 ? 1.1935 1.4552 1.3144 0.3026 -0.0620 0.0512 580 LYS A NZ 4037 N N . SER A 570 ? 0.4822 0.7436 0.7155 0.1416 -0.0946 0.1055 581 SER A N 4038 C CA . SER A 570 ? 0.4963 0.7737 0.7528 0.1199 -0.1009 0.1169 581 SER A CA 4039 C C . SER A 570 ? 0.5859 0.8637 0.8471 0.1369 -0.1154 0.1160 581 SER A C 4040 O O . SER A 570 ? 0.5716 0.8165 0.8110 0.1586 -0.1269 0.1047 581 SER A O 4041 C CB . SER A 570 ? 0.5579 0.7976 0.8044 0.0874 -0.1074 0.1167 581 SER A CB 4042 O OG . SER A 570 ? 0.6362 0.8263 0.8580 0.0892 -0.1217 0.1080 581 SER A OG 4043 N N . TYR A 571 ? 0.5633 0.8762 0.8531 0.1267 -0.1175 0.1282 582 TYR A N 4044 C CA . TYR A 571 ? 0.6913 1.0098 0.9902 0.1415 -0.1318 0.1288 582 TYR A CA 4045 C C . TYR A 571 ? 0.7100 1.0224 1.0208 0.1136 -0.1433 0.1383 582 TYR A C 4046 O O . TYR A 571 ? 0.6535 0.9857 0.9809 0.0891 -0.1373 0.1485 582 TYR A O 4047 C CB . TYR A 571 ? 0.8279 1.2109 1.1562 0.1664 -0.1224 0.1349 582 TYR A CB 4048 C CG . TYR A 571 ? 0.9956 1.3886 1.3094 0.2023 -0.1130 0.1236 582 TYR A CG 4049 C CD1 . TYR A 571 ? 1.2625 1.6455 1.5647 0.2384 -0.1252 0.1111 582 TYR A CD1 4050 C CD2 . TYR A 571 ? 0.9434 1.3540 1.2529 0.2017 -0.0941 0.1248 582 TYR A CD2 4051 C CE1 . TYR A 571 ? 1.3409 1.7312 1.6261 0.2750 -0.1186 0.0985 582 TYR A CE1 4052 C CE2 . TYR A 571 ? 1.1481 1.5672 1.4404 0.2365 -0.0859 0.1137 582 TYR A CE2 4053 C CZ . TYR A 571 ? 1.3223 1.7314 1.6019 0.2741 -0.0982 0.0999 582 TYR A CZ 4054 O OH . TYR A 571 ? 1.3682 1.7839 1.6270 0.3123 -0.0920 0.0867 582 TYR A OH 4055 N N . TYR A 572 ? 0.6657 0.9479 0.9655 0.1178 -0.1620 0.1350 583 TYR A N 4056 C CA . TYR A 572 ? 0.4684 0.7493 0.7792 0.0969 -0.1744 0.1441 583 TYR A CA 4057 C C . TYR A 572 ? 0.6494 0.9290 0.9655 0.1154 -0.1923 0.1436 583 TYR A C 4058 O O . TYR A 572 ? 0.5933 0.8440 0.8894 0.1370 -0.2027 0.1336 583 TYR A O 4059 C CB . TYR A 572 ? 0.5325 0.7674 0.8176 0.0687 -0.1804 0.1427 583 TYR A CB 4060 C CG . TYR A 572 ? 0.5934 0.7759 0.8463 0.0727 -0.1951 0.1355 583 TYR A CG 4061 C CD1 . TYR A 572 ? 0.5756 0.7392 0.8228 0.0715 -0.2149 0.1389 583 TYR A CD1 4062 C CD2 . TYR A 572 ? 0.6572 0.8077 0.8855 0.0755 -0.1915 0.1270 583 TYR A CD2 4063 C CE1 . TYR A 572 ? 0.5409 0.6562 0.7589 0.0722 -0.2308 0.1354 583 TYR A CE1 4064 C CE2 . TYR A 572 ? 0.7323 0.8350 0.9333 0.0761 -0.2078 0.1235 583 TYR A CE2 4065 C CZ . TYR A 572 ? 0.7769 0.8625 0.9729 0.0738 -0.2275 0.1285 583 TYR A CZ 4066 O OH . TYR A 572 ? 0.9494 0.9869 1.1183 0.0717 -0.2460 0.1280 583 TYR A OH 4067 N N . ALA A 573 ? 0.4845 0.7935 0.8278 0.1070 -0.1985 0.1545 584 ALA A N 4068 C CA . ALA A 573 ? 0.6383 0.9452 0.9887 0.1205 -0.2179 0.1552 584 ALA A CA 4069 C C . ALA A 573 ? 0.5966 0.8870 0.9471 0.0924 -0.2317 0.1641 584 ALA A C 4070 O O . ALA A 573 ? 0.5062 0.8218 0.8764 0.0722 -0.2263 0.1740 584 ALA A O 4071 C CB . ALA A 573 ? 0.5034 0.8726 0.8924 0.1446 -0.2125 0.1599 584 ALA A CB 4072 N N . ALA A 574 ? 0.7042 0.9502 1.0304 0.0909 -0.2515 0.1611 585 ALA A N 4073 C CA . ALA A 574 ? 0.7270 0.9532 1.0454 0.0649 -0.2645 0.1686 585 ALA A CA 4074 C C . ALA A 574 ? 0.8150 1.0255 1.1324 0.0732 -0.2889 0.1707 585 ALA A C 4075 O O . ALA A 574 ? 0.9602 1.1334 1.2535 0.0845 -0.3026 0.1648 585 ALA A O 4076 C CB . ALA A 574 ? 0.6524 0.8349 0.9335 0.0429 -0.2622 0.1657 585 ALA A CB 4077 N N . VAL A 575 ? 0.7352 0.9722 1.0791 0.0665 -0.2969 0.1799 586 VAL A N 4078 C CA . VAL A 575 ? 0.7518 0.9742 1.0963 0.0714 -0.3217 0.1829 586 VAL A CA 4079 C C . VAL A 575 ? 0.7388 0.9318 1.0624 0.0427 -0.3334 0.1895 586 VAL A C 4080 O O . VAL A 575 ? 0.7287 0.9409 1.0654 0.0250 -0.3280 0.1956 586 VAL A O 4081 C CB . VAL A 575 ? 0.8219 1.0978 1.2139 0.0870 -0.3252 0.1890 586 VAL A CB 4082 C CG1 . VAL A 575 ? 0.6005 0.8584 0.9930 0.0902 -0.3530 0.1921 586 VAL A CG1 4083 C CG2 . VAL A 575 ? 0.9362 1.2476 1.3475 0.1197 -0.3129 0.1818 586 VAL A CG2 4084 N N . ARG A 576 ? 0.8061 0.9517 1.0952 0.0385 -0.3509 0.1886 587 ARG A N 4085 C CA . ARG A 576 ? 1.0102 1.1277 1.2740 0.0139 -0.3630 0.1949 587 ARG A CA 4086 C C . ARG A 576 ? 1.1119 1.2066 1.3694 0.0190 -0.3912 0.1991 587 ARG A C 4087 O O . ARG A 576 ? 1.1478 1.2365 1.4111 0.0408 -0.4026 0.1953 587 ARG A O 4088 C CB . ARG A 576 ? 1.0287 1.1100 1.2498 -0.0028 -0.3556 0.1929 587 ARG A CB 4089 C CG . ARG A 576 ? 1.1308 1.2295 1.3546 -0.0100 -0.3299 0.1881 587 ARG A CG 4090 C CD . ARG A 576 ? 1.1427 1.2087 1.3269 -0.0255 -0.3239 0.1868 587 ARG A CD 4091 N NE . ARG A 576 ? 1.1580 1.1947 1.3250 -0.0155 -0.3316 0.1854 587 ARG A NE 4092 C CZ . ARG A 576 ? 1.0543 1.0602 1.1886 -0.0286 -0.3319 0.1879 587 ARG A CZ 4093 N NH1 . ARG A 576 ? 1.0188 1.0239 1.1337 -0.0503 -0.3221 0.1906 587 ARG A NH1 4094 N NH2 . ARG A 576 ? 0.9425 0.9191 1.0636 -0.0196 -0.3436 0.1879 587 ARG A NH2 4095 N N . ASP A 577 ? 0.9805 1.0605 1.2238 0.0004 -0.4040 0.2059 588 ASP A N 4096 C CA . ASP A 577 ? 1.0049 1.0588 1.2376 0.0021 -0.4323 0.2108 588 ASP A CA 4097 C C . ASP A 577 ? 0.9407 0.9677 1.1395 -0.0222 -0.4426 0.2174 588 ASP A C 4098 O O . ASP A 577 ? 0.9146 0.9582 1.1203 -0.0342 -0.4369 0.2188 588 ASP A O 4099 C CB . ASP A 577 ? 1.0969 1.1845 1.3742 0.0194 -0.4414 0.2113 588 ASP A CB 4100 C CG . ASP A 577 ? 1.3372 1.3948 1.6003 0.0219 -0.4633 0.2112 588 ASP A CG 4101 O OD1 . ASP A 577 ? 1.3875 1.4208 1.6378 0.0365 -0.4736 0.2062 588 ASP A OD1 4102 O OD2 . ASP A 577 ? 1.4692 1.5249 1.7327 0.0094 -0.4715 0.2154 588 ASP A OD2 4103 N N . ASN A 578 ? 1.0225 1.0071 1.1828 -0.0290 -0.4590 0.2217 589 ASN A N 4104 C CA . ASN A 578 ? 1.1711 1.1300 1.2945 -0.0495 -0.4681 0.2275 589 ASN A CA 4105 C C . ASN A 578 ? 1.1420 1.0714 1.2534 -0.0465 -0.4890 0.2291 589 ASN A C 4106 O O . ASN A 578 ? 1.2677 1.1727 1.3690 -0.0387 -0.4982 0.2287 589 ASN A O 4107 C CB . ASN A 578 ? 1.3794 1.3174 1.4588 -0.0673 -0.4582 0.2314 589 ASN A CB 4108 C CG . ASN A 578 ? 1.5534 1.4707 1.6217 -0.0620 -0.4580 0.2321 589 ASN A CG 4109 O OD1 . ASN A 578 ? 1.6123 1.4948 1.6551 -0.0659 -0.4759 0.2387 589 ASN A OD1 4110 N ND2 . ASN A 578 ? 1.5743 1.5104 1.6604 -0.0537 -0.4367 0.2242 589 ASN A ND2 4111 N N . VAL A 579 ? 1.0231 0.9524 1.1355 -0.0525 -0.4981 0.2304 590 VAL A N 4112 C CA . VAL A 579 ? 1.0720 0.9758 1.1773 -0.0492 -0.5188 0.2314 590 VAL A CA 4113 C C . VAL A 579 ? 1.0853 0.9558 1.1427 -0.0694 -0.5285 0.2381 590 VAL A C 4114 O O . VAL A 579 ? 1.1799 1.0577 1.2225 -0.0815 -0.5217 0.2391 590 VAL A O 4115 C CB . VAL A 579 ? 1.1127 1.0451 1.2642 -0.0361 -0.5242 0.2275 590 VAL A CB 4116 C CG1 . VAL A 579 ? 0.9562 0.9122 1.1199 -0.0465 -0.5162 0.2283 590 VAL A CG1 4117 C CG2 . VAL A 579 ? 1.2463 1.1512 1.3898 -0.0337 -0.5468 0.2283 590 VAL A CG2 4118 N N . ARG A 580 ? 1.1652 0.9992 1.1967 -0.0722 -0.5448 0.2421 591 ARG A N 4119 C CA . ARG A 580 ? 1.2012 1.0052 1.1884 -0.0897 -0.5555 0.2492 591 ARG A CA 4120 C C . ARG A 580 ? 1.1775 0.9775 1.1797 -0.0845 -0.5719 0.2463 591 ARG A C 4121 O O . ARG A 580 ? 1.0944 0.8788 1.1083 -0.0751 -0.5881 0.2448 591 ARG A O 4122 C CB . ARG A 580 ? 1.2806 1.0464 1.2320 -0.0986 -0.5656 0.2571 591 ARG A CB 4123 C CG . ARG A 580 ? 1.4255 1.1652 1.3268 -0.1189 -0.5729 0.2671 591 ARG A CG 4124 C CD . ARG A 580 ? 1.4740 1.1771 1.3448 -0.1297 -0.5846 0.2771 591 ARG A CD 4125 N NE . ARG A 580 ? 1.6324 1.3168 1.4542 -0.1502 -0.5888 0.2887 591 ARG A NE 4126 C CZ . ARG A 580 ? 1.8578 1.5187 1.6644 -0.1531 -0.6071 0.2907 591 ARG A CZ 4127 N NH1 . ARG A 580 ? 1.8803 1.5278 1.6399 -0.1710 -0.6087 0.3017 591 ARG A NH1 4128 N NH2 . ARG A 580 ? 1.9352 1.5883 1.7735 -0.1375 -0.6233 0.2817 591 ARG A NH2 4129 N N . LEU A 581 ? 1.1416 0.9547 1.1438 -0.0901 -0.5690 0.2446 592 LEU A N 4130 C CA . LEU A 581 ? 1.0869 0.8953 1.1030 -0.0870 -0.5850 0.2424 592 LEU A CA 4131 C C . LEU A 581 ? 1.1365 0.9037 1.1043 -0.0988 -0.6016 0.2479 592 LEU A C 4132 O O . LEU A 581 ? 1.2160 0.9753 1.1542 -0.1084 -0.6028 0.2484 592 LEU A O 4133 C CB . LEU A 581 ? 1.0056 0.8392 1.0388 -0.0889 -0.5775 0.2382 592 LEU A CB 4134 C CG . LEU A 581 ? 0.9931 0.8583 1.0857 -0.0769 -0.5795 0.2347 592 LEU A CG 4135 C CD1 . LEU A 581 ? 1.0520 0.9026 1.1592 -0.0692 -0.6001 0.2354 592 LEU A CD1 4136 C CD2 . LEU A 581 ? 0.9349 0.8384 1.0679 -0.0656 -0.5619 0.2326 592 LEU A CD2 4137 N N . GLY A 582 ? 1.1716 0.9120 1.1302 -0.0974 -0.6153 0.2514 593 GLY A N 4138 C CA . GLY A 582 ? 1.3503 1.0512 1.2610 -0.1106 -0.6303 0.2586 593 GLY A CA 4139 C C . GLY A 582 ? 1.4130 1.1084 1.2737 -0.1275 -0.6170 0.2667 593 GLY A C 4140 O O . GLY A 582 ? 1.4549 1.1659 1.3174 -0.1291 -0.6006 0.2683 593 GLY A O 4141 N N . ARG A 583 ? 1.4294 1.1051 1.2452 -0.1394 -0.6237 0.2719 594 ARG A N 4142 C CA . ARG A 583 ? 1.4035 1.0808 1.1699 -0.1546 -0.6099 0.2802 594 ARG A CA 4143 C C . ARG A 583 ? 1.4436 1.1422 1.1972 -0.1534 -0.5985 0.2731 594 ARG A C 4144 O O . ARG A 583 ? 1.5446 1.2520 1.2580 -0.1625 -0.5850 0.2773 594 ARG A O 4145 C CB . ARG A 583 ? 1.3874 1.0318 1.1056 -0.1686 -0.6230 0.2920 594 ARG A CB 4146 C CG . ARG A 583 ? 1.5468 1.1774 1.2390 -0.1687 -0.6353 0.2892 594 ARG A CG 4147 C CD . ARG A 583 ? 1.6653 1.2690 1.3038 -0.1842 -0.6439 0.3029 594 ARG A CD 4148 N NE . ARG A 583 ? 1.6868 1.2761 1.2945 -0.1833 -0.6555 0.3001 594 ARG A NE 4149 C CZ . ARG A 583 ? 1.7473 1.3085 1.3649 -0.1787 -0.6791 0.2969 594 ARG A CZ 4150 N NH1 . ARG A 583 ? 1.8419 1.3895 1.5000 -0.1736 -0.6927 0.2954 594 ARG A NH1 4151 N NH2 . ARG A 583 ? 1.6617 1.2087 1.2482 -0.1778 -0.6895 0.2942 594 ARG A NH2 4152 N N . TRP A 584 ? 1.3116 1.0196 1.1002 -0.1417 -0.6047 0.2622 595 TRP A N 4153 C CA . TRP A 584 ? 1.3606 1.0808 1.1375 -0.1395 -0.6001 0.2536 595 TRP A CA 4154 C C . TRP A 584 ? 1.4459 1.2003 1.2464 -0.1355 -0.5804 0.2467 595 TRP A C 4155 O O . TRP A 584 ? 1.4507 1.2146 1.2280 -0.1359 -0.5729 0.2403 595 TRP A O 4156 C CB . TRP A 584 ? 1.3130 1.0216 1.1126 -0.1319 -0.6195 0.2467 595 TRP A CB 4157 C CG . TRP A 584 ? 1.4076 1.0804 1.1755 -0.1363 -0.6397 0.2520 595 TRP A CG 4158 C CD1 . TRP A 584 ? 1.4785 1.1320 1.2691 -0.1337 -0.6579 0.2548 595 TRP A CD1 4159 C CD2 . TRP A 584 ? 1.5219 1.1750 1.2284 -0.1432 -0.6438 0.2546 595 TRP A CD2 4160 N NE1 . TRP A 584 ? 1.5462 1.1662 1.2940 -0.1401 -0.6740 0.2595 595 TRP A NE1 4161 C CE2 . TRP A 584 ? 1.6202 1.2404 1.3155 -0.1459 -0.6652 0.2599 595 TRP A CE2 4162 C CE3 . TRP A 584 ? 1.5133 1.1757 1.1723 -0.1457 -0.6314 0.2524 595 TRP A CE3 4163 C CZ2 . TRP A 584 ? 1.6508 1.2469 1.2892 -0.1522 -0.6739 0.2642 595 TRP A CZ2 4164 C CZ3 . TRP A 584 ? 1.6259 1.2677 1.2279 -0.1499 -0.6392 0.2560 595 TRP A CZ3 4165 C CH2 . TRP A 584 ? 1.6706 1.2794 1.2626 -0.1537 -0.6600 0.2625 595 TRP A CH2 4166 N N . ALA A 585 ? 1.4096 1.1818 1.2546 -0.1304 -0.5726 0.2470 596 ALA A N 4167 C CA . ALA A 585 ? 1.3249 1.1292 1.1945 -0.1271 -0.5541 0.2413 596 ALA A CA 4168 C C . ALA A 585 ? 1.1905 1.0092 1.0948 -0.1225 -0.5448 0.2443 596 ALA A C 4169 O O . ALA A 585 ? 1.1255 0.9332 1.0493 -0.1169 -0.5552 0.2473 596 ALA A O 4170 C CB . ALA A 585 ? 1.3770 1.1962 1.2823 -0.1197 -0.5581 0.2316 596 ALA A CB 4171 N N . ASP A 586 ? 1.1453 0.9877 1.0556 -0.1235 -0.5260 0.2422 597 ASP A N 4172 C CA . ASP A 586 ? 1.2013 1.0612 1.1489 -0.1161 -0.5161 0.2425 597 ASP A CA 4173 C C . ASP A 586 ? 1.1704 1.0645 1.1566 -0.1098 -0.5035 0.2344 597 ASP A C 4174 O O . ASP A 586 ? 1.1274 1.0304 1.0975 -0.1155 -0.4958 0.2298 597 ASP A O 4175 C CB . ASP A 586 ? 1.1734 1.0269 1.0918 -0.1249 -0.5052 0.2500 597 ASP A CB 4176 C CG . ASP A 586 ? 1.3778 1.1984 1.2543 -0.1355 -0.5166 0.2605 597 ASP A CG 4177 O OD1 . ASP A 586 ? 1.5305 1.3304 1.4127 -0.1313 -0.5344 0.2612 597 ASP A OD1 4178 O OD2 . ASP A 586 ? 1.3766 1.1937 1.2154 -0.1489 -0.5075 0.2688 597 ASP A OD2 4179 N N . VAL A 587 ? 1.0995 1.0139 1.1361 -0.0974 -0.5018 0.2324 598 VAL A N 4180 C CA . VAL A 587 ? 1.0833 1.0329 1.1604 -0.0926 -0.4895 0.2271 598 VAL A CA 4181 C C . VAL A 587 ? 1.2287 1.2004 1.3342 -0.0832 -0.4754 0.2270 598 VAL A C 4182 O O . VAL A 587 ? 1.2163 1.1859 1.3385 -0.0715 -0.4802 0.2283 598 VAL A O 4183 C CB . VAL A 587 ? 0.9976 0.9611 1.1149 -0.0864 -0.4993 0.2255 598 VAL A CB 4184 C CG1 . VAL A 587 ? 0.8964 0.9002 1.0611 -0.0818 -0.4852 0.2233 598 VAL A CG1 4185 C CG2 . VAL A 587 ? 0.8845 0.8264 0.9741 -0.0953 -0.5124 0.2236 598 VAL A CG2 4186 N N . GLY A 588 ? 1.2530 1.2440 1.3619 -0.0870 -0.4591 0.2241 599 GLY A N 4187 C CA . GLY A 588 ? 1.1849 1.1964 1.3188 -0.0777 -0.4405 0.2213 599 GLY A CA 4188 C C . GLY A 588 ? 1.1315 1.1802 1.3057 -0.0747 -0.4265 0.2171 599 GLY A C 4189 O O . GLY A 588 ? 1.1049 1.1585 1.2773 -0.0839 -0.4284 0.2154 599 GLY A O 4190 N N . ALA A 589 ? 1.1109 1.1848 1.3198 -0.0611 -0.4142 0.2158 600 ALA A N 4191 C CA . ALA A 589 ? 1.0409 1.1532 1.2882 -0.0587 -0.3989 0.2142 600 ALA A CA 4192 C C . ALA A 589 ? 0.9728 1.1001 1.2323 -0.0456 -0.3780 0.2095 600 ALA A C 4193 O O . ALA A 589 ? 0.9157 1.0296 1.1680 -0.0331 -0.3815 0.2084 600 ALA A O 4194 C CB . ALA A 589 ? 0.6352 0.7766 0.9279 -0.0536 -0.4124 0.2213 600 ALA A CB 4195 N N . GLY A 590 ? 0.9194 1.0714 1.1953 -0.0479 -0.3586 0.2066 601 GLY A N 4196 C CA . GLY A 590 ? 0.8231 0.9890 1.1082 -0.0353 -0.3384 0.2016 601 GLY A CA 4197 C C . GLY A 590 ? 0.7624 0.9713 1.0859 -0.0336 -0.3239 0.2037 601 GLY A C 4198 O O . GLY A 590 ? 0.6105 0.8286 0.9422 -0.0483 -0.3258 0.2069 601 GLY A O 4199 N N . LEU A 591 ? 0.8153 1.0495 1.1604 -0.0152 -0.3112 0.2022 602 LEU A N 4200 C CA . LEU A 591 ? 0.7317 1.0108 1.1122 -0.0127 -0.2954 0.2062 602 LEU A CA 4201 C C . LEU A 591 ? 0.7646 1.0463 1.1367 0.0014 -0.2745 0.1977 602 LEU A C 4202 O O . LEU A 591 ? 0.7651 1.0292 1.1222 0.0187 -0.2761 0.1910 602 LEU A O 4203 C CB . LEU A 591 ? 0.5099 0.8351 0.9376 -0.0014 -0.3032 0.2170 602 LEU A CB 4204 C CG . LEU A 591 ? 0.7000 1.0805 1.1705 -0.0028 -0.2900 0.2273 602 LEU A CG 4205 C CD1 . LEU A 591 ? 0.8168 1.1885 1.2813 -0.0287 -0.2893 0.2305 602 LEU A CD1 4206 C CD2 . LEU A 591 ? 0.6172 1.0416 1.1330 0.0036 -0.3010 0.2401 602 LEU A CD2 4207 N N . ARG A 592 ? 0.6736 0.9733 1.0535 -0.0059 -0.2576 0.1978 603 ARG A N 4208 C CA . ARG A 592 ? 0.5962 0.8960 0.9660 0.0066 -0.2384 0.1895 603 ARG A CA 4209 C C . ARG A 592 ? 0.7085 1.0501 1.1054 0.0052 -0.2214 0.1950 603 ARG A C 4210 O O . ARG A 592 ? 0.8488 1.2009 1.2576 -0.0148 -0.2230 0.2022 603 ARG A O 4211 C CB . ARG A 592 ? 0.5269 0.7790 0.8538 -0.0042 -0.2351 0.1793 603 ARG A CB 4212 C CG . ARG A 592 ? 0.4747 0.7210 0.7895 0.0075 -0.2184 0.1706 603 ARG A CG 4213 C CD . ARG A 592 ? 0.5730 0.7745 0.8490 -0.0033 -0.2174 0.1625 603 ARG A CD 4214 N NE . ARG A 592 ? 0.6658 0.8617 0.9328 0.0061 -0.2027 0.1547 603 ARG A NE 4215 C CZ . ARG A 592 ? 0.8110 0.9723 1.0489 0.0000 -0.2005 0.1482 603 ARG A CZ 4216 N NH1 . ARG A 592 ? 0.8953 1.0288 1.1101 -0.0157 -0.2100 0.1495 603 ARG A NH1 4217 N NH2 . ARG A 592 ? 0.8936 1.0497 1.1254 0.0094 -0.1890 0.1413 603 ARG A NH2 4218 N N . TYR A 593 ? 0.6737 1.0374 1.0781 0.0270 -0.2071 0.1918 604 TYR A N 4219 C CA . TYR A 593 ? 0.6634 1.0678 1.0893 0.0277 -0.1892 0.1976 604 TYR A CA 4220 C C . TYR A 593 ? 0.6871 1.0663 1.0834 0.0344 -0.1743 0.1849 604 TYR A C 4221 O O . TYR A 593 ? 0.7391 1.0933 1.1132 0.0535 -0.1749 0.1736 604 TYR A O 4222 C CB . TYR A 593 ? 0.6721 1.1338 1.1340 0.0509 -0.1837 0.2057 604 TYR A CB 4223 C CG . TYR A 593 ? 0.6896 1.2052 1.1801 0.0485 -0.1664 0.2179 604 TYR A CG 4224 C CD1 . TYR A 593 ? 0.7910 1.3441 1.3176 0.0273 -0.1715 0.2373 604 TYR A CD1 4225 C CD2 . TYR A 593 ? 0.5903 1.1188 1.0709 0.0670 -0.1470 0.2114 604 TYR A CD2 4226 C CE1 . TYR A 593 ? 0.8080 1.4119 1.3615 0.0222 -0.1573 0.2520 604 TYR A CE1 4227 C CE2 . TYR A 593 ? 0.5090 1.0888 1.0139 0.0640 -0.1310 0.2246 604 TYR A CE2 4228 C CZ . TYR A 593 ? 0.6323 1.2507 1.1743 0.0404 -0.1360 0.2459 604 TYR A CZ 4229 O OH . TYR A 593 ? 0.5821 1.2528 1.1492 0.0341 -0.1218 0.2626 604 TYR A OH 4230 N N . ASP A 594 ? 0.6150 0.9976 1.0106 0.0185 -0.1638 0.1868 605 ASP A N 4231 C CA . ASP A 594 ? 0.5311 0.8908 0.9008 0.0237 -0.1502 0.1753 605 ASP A CA 4232 C C . ASP A 594 ? 0.5433 0.9428 0.9308 0.0267 -0.1334 0.1821 605 ASP A C 4233 O O . ASP A 594 ? 0.5027 0.9283 0.9129 0.0080 -0.1335 0.1949 605 ASP A O 4234 C CB . ASP A 594 ? 0.6090 0.9236 0.9509 0.0015 -0.1542 0.1677 605 ASP A CB 4235 C CG . ASP A 594 ? 0.8011 1.0715 1.1137 0.0032 -0.1649 0.1587 605 ASP A CG 4236 O OD1 . ASP A 594 ? 0.4159 0.6584 0.7044 0.0124 -0.1605 0.1487 605 ASP A OD1 4237 O OD2 . ASP A 594 ? 0.8886 1.1517 1.2019 -0.0054 -0.1792 0.1628 605 ASP A OD2 4238 N N . TYR A 595 ? 0.5723 0.9740 0.9476 0.0502 -0.1210 0.1738 606 TYR A N 4239 C CA . TYR A 595 ? 0.5145 0.9496 0.8986 0.0552 -0.1035 0.1787 606 TYR A CA 4240 C C . TYR A 595 ? 0.5191 0.9112 0.8686 0.0559 -0.0966 0.1643 606 TYR A C 4241 O O . TYR A 595 ? 0.7072 1.0564 1.0291 0.0667 -0.1024 0.1502 606 TYR A O 4242 C CB . TYR A 595 ? 0.5345 1.0167 0.9339 0.0875 -0.0942 0.1812 606 TYR A CB 4243 C CG . TYR A 595 ? 0.5089 1.0301 0.9134 0.0972 -0.0744 0.1865 606 TYR A CG 4244 C CD1 . TYR A 595 ? 0.5363 1.1207 0.9774 0.0873 -0.0661 0.2080 606 TYR A CD1 4245 C CD2 . TYR A 595 ? 0.5784 1.0736 0.9507 0.1160 -0.0654 0.1714 606 TYR A CD2 4246 C CE1 . TYR A 595 ? 0.4621 1.0851 0.9063 0.0950 -0.0475 0.2152 606 TYR A CE1 4247 C CE2 . TYR A 595 ? 0.6234 1.1536 0.9967 0.1258 -0.0475 0.1763 606 TYR A CE2 4248 C CZ . TYR A 595 ? 0.5573 1.1529 0.9660 0.1151 -0.0376 0.1986 606 TYR A CZ 4249 O OH . TYR A 595 ? 0.4921 1.1253 0.9004 0.1236 -0.0193 0.2058 606 TYR A OH 4250 N N A ARG A 596 ? 0.5298 0.9329 0.8818 0.0433 -0.0864 0.1691 607 ARG A N 4251 N N B ARG A 596 ? 0.5306 0.9333 0.8823 0.0434 -0.0863 0.1689 607 ARG A N 4252 C CA A ARG A 596 ? 0.5024 0.8685 0.8247 0.0442 -0.0799 0.1562 607 ARG A CA 4253 C CA B ARG A 596 ? 0.4958 0.8603 0.8173 0.0440 -0.0801 0.1558 607 ARG A CA 4254 C C A ARG A 596 ? 0.5802 0.9781 0.9101 0.0440 -0.0652 0.1642 607 ARG A C 4255 C C B ARG A 596 ? 0.5796 0.9723 0.9071 0.0425 -0.0657 0.1630 607 ARG A C 4256 O O A ARG A 596 ? 0.6634 1.0899 1.0163 0.0232 -0.0651 0.1795 607 ARG A O 4257 O O B ARG A 596 ? 0.6693 1.0823 1.0157 0.0194 -0.0664 0.1762 607 ARG A O 4258 C CB A ARG A 596 ? 0.4508 0.7723 0.7579 0.0184 -0.0894 0.1496 607 ARG A CB 4259 C CB B ARG A 596 ? 0.4475 0.7662 0.7531 0.0191 -0.0902 0.1487 607 ARG A CB 4260 C CG A ARG A 596 ? 0.3683 0.6471 0.6448 0.0206 -0.0856 0.1348 607 ARG A CG 4261 C CG B ARG A 596 ? 0.4813 0.7664 0.7624 0.0148 -0.0844 0.1375 607 ARG A CG 4262 C CD A ARG A 596 ? 0.4838 0.7475 0.7574 -0.0047 -0.0868 0.1338 607 ARG A CD 4263 C CD B ARG A 596 ? 0.5038 0.7689 0.7831 -0.0134 -0.0917 0.1364 607 ARG A CD 4264 N NE A ARG A 596 ? 0.3572 0.5745 0.6053 -0.0106 -0.0912 0.1198 607 ARG A NE 4265 N NE B ARG A 596 ? 0.5142 0.7794 0.7923 -0.0239 -0.0858 0.1367 607 ARG A NE 4266 C CZ A ARG A 596 ? 0.3485 0.5476 0.5898 -0.0285 -0.0930 0.1145 607 ARG A CZ 4267 C CZ B ARG A 596 ? 0.6106 0.9118 0.9075 -0.0272 -0.0799 0.1500 607 ARG A CZ 4268 N NH1 A ARG A 596 ? 0.3390 0.5561 0.5948 -0.0424 -0.0933 0.1215 607 ARG A NH1 4269 N NH1 B ARG A 596 ? 0.3406 0.6871 0.6621 -0.0199 -0.0771 0.1648 607 ARG A NH1 4270 N NH2 A ARG A 596 ? 0.6440 0.8078 0.8649 -0.0323 -0.0959 0.1029 607 ARG A NH2 4271 N NH2 B ARG A 596 ? 0.5613 0.8553 0.8533 -0.0383 -0.0774 0.1497 607 ARG A NH2 4272 N N . SER A 597 ? 0.5837 0.9747 0.8928 0.0670 -0.0549 0.1544 608 SER A N 4273 C CA . SER A 597 ? 0.5123 0.9294 0.8217 0.0687 -0.0404 0.1609 608 SER A CA 4274 C C . SER A 597 ? 0.5216 0.8882 0.7975 0.0686 -0.0391 0.1453 608 SER A C 4275 O O . SER A 597 ? 0.5989 0.9265 0.8497 0.0859 -0.0436 0.1291 608 SER A O 4276 C CB . SER A 597 ? 0.5521 1.0186 0.8681 0.1012 -0.0275 0.1649 608 SER A CB 4277 O OG . SER A 597 ? 0.8224 1.3054 1.1273 0.1085 -0.0128 0.1672 608 SER A OG 4278 N N . THR A 598 ? 0.4534 0.8195 0.7296 0.0486 -0.0353 0.1510 609 THR A N 4279 C CA . THR A 598 ? 0.4965 0.8160 0.7437 0.0467 -0.0351 0.1368 609 THR A CA 4280 C C . THR A 598 ? 0.6004 0.9400 0.8415 0.0508 -0.0225 0.1429 609 THR A C 4281 O O . THR A 598 ? 0.6700 1.0563 0.9334 0.0402 -0.0165 0.1620 609 THR A O 4282 C CB . THR A 598 ? 0.5099 0.7937 0.7562 0.0169 -0.0467 0.1327 609 THR A CB 4283 O OG1 . THR A 598 ? 0.6603 0.9742 0.9329 -0.0067 -0.0505 0.1494 609 THR A OG1 4284 C CG2 . THR A 598 ? 0.4833 0.7365 0.7236 0.0157 -0.0579 0.1229 609 THR A CG2 4285 N N . HIS A 599 ? 0.4004 0.7040 0.6110 0.0652 -0.0201 0.1279 610 HIS A N 4286 C CA . HIS A 599 ? 0.4925 0.8061 0.6905 0.0692 -0.0095 0.1315 610 HIS A CA 4287 C C . HIS A 599 ? 0.4130 0.6693 0.5850 0.0616 -0.0158 0.1163 610 HIS A C 4288 O O . HIS A 599 ? 0.7466 0.9570 0.9027 0.0668 -0.0250 0.1000 610 HIS A O 4289 C CB . HIS A 599 ? 0.4351 0.7763 0.6194 0.1063 0.0030 0.1296 610 HIS A CB 4290 C CG . HIS A 599 ? 1.7407 2.0887 1.9055 0.1134 0.0139 0.1318 610 HIS A CG 4291 N ND1 . HIS A 599 ? 1.6968 2.0934 1.8783 0.0980 0.0240 0.1537 610 HIS A ND1 4292 C CD2 . HIS A 599 ? 1.6981 2.0086 1.8271 0.1330 0.0143 0.1159 610 HIS A CD2 4293 C CE1 . HIS A 599 ? 1.6389 2.0290 1.7941 0.1082 0.0318 0.1512 610 HIS A CE1 4294 N NE2 . HIS A 599 ? 1.6500 1.9871 1.7727 0.1303 0.0260 0.1275 610 HIS A NE2 4295 N N . SER A 600 ? 0.6025 0.8627 0.7715 0.0480 -0.0122 0.1233 611 SER A N 4296 C CA . SER A 600 ? 0.4192 0.6294 0.5630 0.0443 -0.0172 0.1093 611 SER A CA 4297 C C . SER A 600 ? 0.5949 0.8215 0.7248 0.0503 -0.0071 0.1168 611 SER A C 4298 O O . SER A 600 ? 0.5293 0.8046 0.6763 0.0413 0.0007 0.1373 611 SER A O 4299 C CB . SER A 600 ? 0.5230 0.7059 0.6769 0.0129 -0.0301 0.1068 611 SER A CB 4300 O OG . SER A 600 ? 0.5651 0.7037 0.6975 0.0101 -0.0351 0.0936 611 SER A OG 4301 N N . ASP A 601 ? 0.5051 0.6911 0.6039 0.0647 -0.0083 0.1016 612 ASP A N 4302 C CA . ASP A 601 ? 0.6557 0.8489 0.7357 0.0697 -0.0005 0.1069 612 ASP A CA 4303 C C . ASP A 601 ? 0.6013 0.7950 0.6952 0.0350 -0.0066 0.1191 612 ASP A C 4304 O O . ASP A 601 ? 0.8353 1.0616 0.9302 0.0283 0.0007 0.1365 612 ASP A O 4305 C CB . ASP A 601 ? 0.8295 0.9687 0.8728 0.0898 -0.0055 0.0860 612 ASP A CB 4306 C CG . ASP A 601 ? 0.9371 1.0814 0.9590 0.1298 0.0003 0.0769 612 ASP A CG 4307 O OD1 . ASP A 601 ? 0.9495 1.0485 0.9395 0.1492 -0.0063 0.0600 612 ASP A OD1 4308 O OD2 . ASP A 601 ? 0.8344 1.0270 0.8710 0.1427 0.0096 0.0861 612 ASP A OD2 4309 N N . ASP A 602 ? 0.5045 0.6632 0.6088 0.0135 -0.0211 0.1101 613 ASP A N 4310 C CA . ASP A 602 ? 0.5154 0.6667 0.6328 -0.0181 -0.0324 0.1175 613 ASP A CA 4311 C C . ASP A 602 ? 0.4604 0.6616 0.6094 -0.0366 -0.0324 0.1410 613 ASP A C 4312 O O . ASP A 602 ? 0.4480 0.6621 0.6169 -0.0398 -0.0354 0.1420 613 ASP A O 4313 C CB . ASP A 602 ? 0.5548 0.6595 0.6739 -0.0302 -0.0474 0.0989 613 ASP A CB 4314 C CG . ASP A 602 ? 0.7481 0.8341 0.8732 -0.0569 -0.0621 0.0999 613 ASP A CG 4315 O OD1 . ASP A 602 ? 0.7551 0.7996 0.8732 -0.0614 -0.0727 0.0817 613 ASP A OD1 4316 O OD2 . ASP A 602 ? 0.6837 0.7968 0.8212 -0.0731 -0.0646 0.1191 613 ASP A OD2 4317 N N . GLY A 603 ? 0.5037 0.7317 0.6571 -0.0502 -0.0309 0.1612 614 GLY A N 4318 C CA . GLY A 603 ? 0.4867 0.7648 0.6716 -0.0696 -0.0325 0.1877 614 GLY A CA 4319 C C . GLY A 603 ? 0.5860 0.8437 0.7912 -0.0984 -0.0548 0.1880 614 GLY A C 4320 O O . GLY A 603 ? 0.6534 0.9456 0.8869 -0.1148 -0.0609 0.2076 614 GLY A O 4321 N N . SER A 604 ? 0.5857 0.7879 0.7765 -0.1033 -0.0680 0.1658 615 SER A N 4322 C CA . SER A 604 ? 0.6850 0.8643 0.8897 -0.1264 -0.0905 0.1619 615 SER A CA 4323 C C . SER A 604 ? 0.6581 0.8309 0.8720 -0.1208 -0.0931 0.1485 615 SER A C 4324 O O . SER A 604 ? 0.7463 0.9067 0.9718 -0.1368 -0.1110 0.1457 615 SER A O 4325 C CB . SER A 604 ? 0.6462 0.7743 0.8325 -0.1345 -0.1047 0.1452 615 SER A CB 4326 O OG . SER A 604 ? 0.6234 0.7565 0.8024 -0.1444 -0.1065 0.1605 615 SER A OG 4327 N N . VAL A 605 ? 0.4658 0.6454 0.6722 -0.0974 -0.0771 0.1403 616 VAL A N 4328 C CA . VAL A 605 ? 0.5134 0.6893 0.7268 -0.0917 -0.0787 0.1305 616 VAL A CA 4329 C C . VAL A 605 ? 0.5309 0.7506 0.7715 -0.0981 -0.0797 0.1498 616 VAL A C 4330 O O . VAL A 605 ? 0.4177 0.6801 0.6687 -0.0912 -0.0678 0.1675 616 VAL A O 4331 C CB . VAL A 605 ? 0.4048 0.5691 0.6005 -0.0655 -0.0654 0.1165 616 VAL A CB 4332 C CG1 . VAL A 605 ? 0.3903 0.5538 0.5935 -0.0616 -0.0680 0.1104 616 VAL A CG1 4333 C CG2 . VAL A 605 ? 0.4852 0.6037 0.6566 -0.0608 -0.0675 0.0975 616 VAL A CG2 4334 N N . SER A 606 ? 0.5783 0.7893 0.8305 -0.1102 -0.0940 0.1463 617 SER A N 4335 C CA . SER A 606 ? 0.5906 0.8379 0.8691 -0.1177 -0.0988 0.1638 617 SER A CA 4336 C C . SER A 606 ? 0.6036 0.8754 0.8854 -0.0960 -0.0837 0.1645 617 SER A C 4337 O O . SER A 606 ? 0.5517 0.8067 0.8282 -0.0890 -0.0860 0.1519 617 SER A O 4338 C CB . SER A 606 ? 0.7937 1.0192 1.0781 -0.1335 -0.1201 0.1568 617 SER A CB 4339 O OG . SER A 606 ? 1.0714 1.2788 1.3566 -0.1534 -0.1384 0.1590 617 SER A OG 4340 N N . THR A 607 ? 0.6973 1.0109 0.9875 -0.0851 -0.0692 0.1800 618 THR A N 4341 C CA . THR A 607 ? 0.5958 0.9313 0.8845 -0.0585 -0.0544 0.1780 618 THR A CA 4342 C C . THR A 607 ? 0.7069 1.1007 1.0280 -0.0598 -0.0520 0.2009 618 THR A C 4343 O O . THR A 607 ? 0.8853 1.3129 1.2272 -0.0772 -0.0545 0.2228 618 THR A O 4344 C CB . THR A 607 ? 0.5673 0.9024 0.8329 -0.0365 -0.0382 0.1723 618 THR A CB 4345 O OG1 . THR A 607 ? 0.5490 0.8411 0.7887 -0.0181 -0.0373 0.1491 618 THR A OG1 4346 C CG2 . THR A 607 ? 0.5889 0.9831 0.8667 -0.0178 -0.0222 0.1885 618 THR A CG2 4347 N N . GLY A 608 ? 0.5439 0.9497 0.8710 -0.0429 -0.0491 0.1971 619 GLY A N 4348 C CA . GLY A 608 ? 0.4153 0.8786 0.7751 -0.0415 -0.0467 0.2177 619 GLY A CA 4349 C C . GLY A 608 ? 0.4606 0.9284 0.8262 -0.0243 -0.0483 0.2111 619 GLY A C 4350 O O . GLY A 608 ? 0.6335 1.0640 0.9744 -0.0072 -0.0478 0.1908 619 GLY A O 4351 N N . THR A 609 ? 0.4470 0.9606 0.8465 -0.0304 -0.0524 0.2299 620 THR A N 4352 C CA . THR A 609 ? 0.5734 1.0980 0.9833 -0.0148 -0.0555 0.2268 620 THR A CA 4353 C C . THR A 609 ? 0.5591 1.0653 0.9827 -0.0377 -0.0764 0.2298 620 THR A C 4354 O O . THR A 609 ? 0.6230 1.1421 1.0676 -0.0635 -0.0876 0.2459 620 THR A O 4355 C CB . THR A 609 ? 0.5739 1.1723 1.0147 0.0009 -0.0436 0.2459 620 THR A CB 4356 O OG1 . THR A 609 ? 0.5408 1.1561 0.9636 0.0289 -0.0240 0.2398 620 THR A OG1 4357 C CG2 . THR A 609 ? 0.5849 1.1951 1.0404 0.0151 -0.0504 0.2436 620 THR A CG2 4358 N N . HIS A 610 ? 0.6083 1.0823 1.0180 -0.0284 -0.0837 0.2146 621 HIS A N 4359 C CA . HIS A 610 ? 0.6203 1.0805 1.0406 -0.0453 -0.1031 0.2171 621 HIS A CA 4360 C C . HIS A 610 ? 0.6632 1.1421 1.0962 -0.0283 -0.1060 0.2185 621 HIS A C 4361 O O . HIS A 610 ? 0.6367 1.1054 1.0527 -0.0034 -0.0987 0.2060 621 HIS A O 4362 C CB . HIS A 610 ? 0.4964 0.8953 0.8848 -0.0549 -0.1127 0.1978 621 HIS A CB 4363 C CG . HIS A 610 ? 0.5361 0.9136 0.9151 -0.0742 -0.1162 0.1955 621 HIS A CG 4364 N ND1 . HIS A 610 ? 0.4928 0.8416 0.8453 -0.0689 -0.1065 0.1812 621 HIS A ND1 4365 C CD2 . HIS A 610 ? 0.4798 0.8576 0.8720 -0.0982 -0.1312 0.2050 621 HIS A CD2 4366 C CE1 . HIS A 610 ? 0.4227 0.7567 0.7730 -0.0881 -0.1143 0.1814 621 HIS A CE1 4367 N NE2 . HIS A 610 ? 0.5472 0.8969 0.9203 -0.1058 -0.1301 0.1955 621 HIS A NE2 4368 N N . ARG A 611 ? 0.6506 1.1537 1.1133 -0.0416 -0.1197 0.2338 622 ARG A N 4369 C CA . ARG A 611 ? 0.7053 1.2165 1.1783 -0.0291 -0.1276 0.2336 622 ARG A CA 4370 C C . ARG A 611 ? 0.6719 1.1603 1.1498 -0.0509 -0.1507 0.2367 622 ARG A C 4371 O O . ARG A 611 ? 0.7359 1.2493 1.2429 -0.0700 -0.1622 0.2544 622 ARG A O 4372 C CB . ARG A 611 ? 0.6563 1.2356 1.1662 -0.0130 -0.1189 0.2502 622 ARG A CB 4373 C CG . ARG A 611 ? 0.8092 1.4416 1.3556 -0.0314 -0.1166 0.2757 622 ARG A CG 4374 C CD . ARG A 611 ? 0.8508 1.5292 1.4016 -0.0129 -0.0925 0.2813 622 ARG A CD 4375 N NE . ARG A 611 ? 0.8042 1.5160 1.3608 0.0222 -0.0817 0.2762 622 ARG A NE 4376 C CZ . ARG A 611 ? 0.8208 1.5793 1.3806 0.0465 -0.0609 0.2790 622 ARG A CZ 4377 N NH1 . ARG A 611 ? 0.8341 1.6115 1.3918 0.0371 -0.0476 0.2888 622 ARG A NH1 4378 N NH2 . ARG A 611 ? 0.6738 1.4594 1.2371 0.0814 -0.0544 0.2714 622 ARG A NH2 4379 N N . THR A 612 ? 0.6503 1.0904 1.0980 -0.0484 -0.1587 0.2201 623 THR A N 4380 C CA . THR A 612 ? 0.6232 1.0363 1.0664 -0.0662 -0.1800 0.2196 623 THR A CA 4381 C C . THR A 612 ? 0.7360 1.1489 1.1834 -0.0555 -0.1906 0.2199 623 THR A C 4382 O O . THR A 612 ? 0.8110 1.2297 1.2544 -0.0333 -0.1822 0.2147 623 THR A O 4383 C CB . THR A 612 ? 0.6394 0.9983 1.0423 -0.0749 -0.1824 0.2016 623 THR A CB 4384 O OG1 . THR A 612 ? 0.8391 1.1705 1.2141 -0.0594 -0.1769 0.1878 623 THR A OG1 4385 C CG2 . THR A 612 ? 0.7189 1.0740 1.1143 -0.0808 -0.1710 0.1980 623 THR A CG2 4386 N N . LEU A 613 ? 0.7409 1.1442 1.1948 -0.0706 -0.2114 0.2254 624 LEU A N 4387 C CA . LEU A 613 ? 0.6103 1.0094 1.0670 -0.0632 -0.2249 0.2263 624 LEU A CA 4388 C C . LEU A 613 ? 0.6230 0.9702 1.0429 -0.0734 -0.2392 0.2144 624 LEU A C 4389 O O . LEU A 613 ? 0.7048 1.0361 1.1186 -0.0912 -0.2513 0.2143 624 LEU A O 4390 C CB . LEU A 613 ? 0.6015 1.0414 1.1019 -0.0706 -0.2383 0.2460 624 LEU A CB 4391 C CG . LEU A 613 ? 0.6810 1.1219 1.1894 -0.0615 -0.2515 0.2481 624 LEU A CG 4392 C CD1 . LEU A 613 ? 0.8015 1.2602 1.3134 -0.0336 -0.2407 0.2435 624 LEU A CD1 4393 C CD2 . LEU A 613 ? 0.5011 0.9668 1.0376 -0.0707 -0.2562 0.2619 624 LEU A CD2 4394 N N . SER A 614 ? 0.6016 0.9227 0.9957 -0.0615 -0.2390 0.2045 625 SER A N 4395 C CA . SER A 614 ? 0.6516 0.9288 1.0090 -0.0703 -0.2506 0.1952 625 SER A CA 4396 C C . SER A 614 ? 0.7191 0.9899 1.0776 -0.0662 -0.2684 0.1997 625 SER A C 4397 O O . SER A 614 ? 0.7474 1.0350 1.1221 -0.0503 -0.2676 0.2036 625 SER A O 4398 C CB . SER A 614 ? 0.5849 0.8315 0.9054 -0.0650 -0.2370 0.1815 625 SER A CB 4399 O OG . SER A 614 ? 0.5539 0.8014 0.8704 -0.0698 -0.2228 0.1759 625 SER A OG 4400 N N . TRP A 615 ? 0.6582 0.9039 0.9978 -0.0788 -0.2857 0.1983 626 TRP A N 4401 C CA . TRP A 615 ? 0.7424 0.9775 1.0791 -0.0764 -0.3047 0.2026 626 TRP A CA 4402 C C . TRP A 615 ? 0.8418 1.0371 1.1359 -0.0868 -0.3168 0.1953 626 TRP A C 4403 O O . TRP A 615 ? 0.9124 1.0962 1.1903 -0.0976 -0.3176 0.1892 626 TRP A O 4404 C CB . TRP A 615 ? 0.6154 0.8821 0.9954 -0.0795 -0.3204 0.2168 626 TRP A CB 4405 C CG . TRP A 615 ? 0.7923 1.0515 1.1729 -0.0970 -0.3326 0.2186 626 TRP A CG 4406 C CD1 . TRP A 615 ? 0.9035 1.1769 1.2992 -0.1056 -0.3239 0.2209 626 TRP A CD1 4407 C CD2 . TRP A 615 ? 0.9652 1.1911 1.3211 -0.1057 -0.3520 0.2148 626 TRP A CD2 4408 N NE1 . TRP A 615 ? 0.9106 1.1587 1.2926 -0.1185 -0.3384 0.2184 626 TRP A NE1 4409 C CE2 . TRP A 615 ? 0.9768 1.1966 1.3345 -0.1178 -0.3553 0.2140 626 TRP A CE2 4410 C CE3 . TRP A 615 ? 1.1263 1.3249 1.4562 -0.1038 -0.3677 0.2121 626 TRP A CE3 4411 C CZ2 . TRP A 615 ? 1.1189 1.3062 1.4540 -0.1255 -0.3744 0.2091 626 TRP A CZ2 4412 C CZ3 . TRP A 615 ? 1.1373 1.3066 1.4444 -0.1125 -0.3848 0.2078 626 TRP A CZ3 4413 C CH2 . TRP A 615 ? 1.1402 1.3042 1.4504 -0.1221 -0.3883 0.2057 626 TRP A CH2 4414 N N . ASN A 616 ? 0.7746 0.9496 1.0491 -0.0823 -0.3270 0.1958 627 ASN A N 4415 C CA . ASN A 616 ? 0.9094 1.0511 1.1425 -0.0915 -0.3393 0.1914 627 ASN A CA 4416 C C . ASN A 616 ? 0.9582 1.0878 1.1884 -0.0901 -0.3624 0.1983 627 ASN A C 4417 O O . ASN A 616 ? 0.8240 0.9661 1.0793 -0.0797 -0.3674 0.2050 627 ASN A O 4418 C CB . ASN A 616 ? 0.8307 0.9499 1.0228 -0.0928 -0.3244 0.1831 627 ASN A CB 4419 C CG . ASN A 616 ? 0.7969 0.9065 0.9830 -0.0834 -0.3216 0.1863 627 ASN A CG 4420 O OD1 . ASN A 616 ? 0.9200 1.0358 1.1268 -0.0740 -0.3327 0.1927 627 ASN A OD1 4421 N ND2 . ASN A 616 ? 0.7493 0.8431 0.9072 -0.0857 -0.3089 0.1820 627 ASN A ND2 4422 N N . ALA A 617 ? 1.0382 1.1436 1.2366 -0.0989 -0.3772 0.1958 628 ALA A N 4423 C CA . ALA A 617 ? 1.0451 1.1342 1.2352 -0.0989 -0.4012 0.2019 628 ALA A CA 4424 C C . ALA A 617 ? 1.0058 1.0632 1.1423 -0.1066 -0.4091 0.1964 628 ALA A C 4425 O O . ALA A 617 ? 0.8755 0.9285 0.9919 -0.1119 -0.4052 0.1877 628 ALA A O 4426 C CB . ALA A 617 ? 0.6444 0.7485 0.8719 -0.0997 -0.4157 0.2075 628 ALA A CB 4427 N N . GLY A 618 ? 1.1054 1.1416 1.2175 -0.1060 -0.4210 0.2013 629 GLY A N 4428 C CA . GLY A 618 ? 1.1854 1.1953 1.2439 -0.1127 -0.4273 0.1983 629 GLY A CA 4429 C C . GLY A 618 ? 1.1344 1.1228 1.1788 -0.1128 -0.4526 0.2064 629 GLY A C 4430 O O . GLY A 618 ? 1.1890 1.1788 1.2600 -0.1066 -0.4585 0.2127 629 GLY A O 4431 N N . ILE A 619 ? 1.0861 1.0532 1.0862 -0.1176 -0.4623 0.2030 630 ILE A N 4432 C CA . ILE A 619 ? 1.0489 0.9905 1.0280 -0.1177 -0.4791 0.2073 630 ILE A CA 4433 C C . ILE A 619 ? 0.9824 0.9054 0.8983 -0.1243 -0.4793 0.2081 630 ILE A C 4434 O O . ILE A 619 ? 0.8923 0.8210 0.7796 -0.1264 -0.4717 0.2007 630 ILE A O 4435 C CB . ILE A 619 ? 1.0489 0.9837 1.0451 -0.1148 -0.4946 0.2024 630 ILE A CB 4436 C CG1 . ILE A 619 ? 1.0209 0.9292 1.0007 -0.1144 -0.5129 0.2073 630 ILE A CG1 4437 C CG2 . ILE A 619 ? 0.8771 0.8070 0.8470 -0.1160 -0.4957 0.1906 630 ILE A CG2 4438 C CD1 . ILE A 619 ? 0.9488 0.8469 0.9425 -0.1126 -0.5300 0.2034 630 ILE A CD1 4439 N N . VAL A 620 ? 1.0305 0.9333 0.9243 -0.1274 -0.4874 0.2175 631 VAL A N 4440 C CA . VAL A 620 ? 1.2155 1.1026 1.0488 -0.1346 -0.4882 0.2209 631 VAL A CA 4441 C C . VAL A 620 ? 1.2289 1.0884 1.0435 -0.1339 -0.5077 0.2234 631 VAL A C 4442 O O . VAL A 620 ? 1.2538 1.0971 1.0695 -0.1365 -0.5157 0.2332 631 VAL A O 4443 C CB . VAL A 620 ? 1.2930 1.1819 1.1056 -0.1438 -0.4761 0.2332 631 VAL A CB 4444 C CG1 . VAL A 620 ? 1.2703 1.1839 1.0771 -0.1458 -0.4498 0.2263 631 VAL A CG1 4445 C CG2 . VAL A 620 ? 1.3479 1.2332 1.2005 -0.1407 -0.4787 0.2400 631 VAL A CG2 4446 N N . LEU A 621 ? 1.1631 1.0152 0.9602 -0.1297 -0.5168 0.2133 632 LEU A N 4447 C CA . LEU A 621 ? 1.2256 1.0502 0.9997 -0.1286 -0.5359 0.2143 632 LEU A CA 4448 C C . LEU A 621 ? 1.3179 1.1303 1.0309 -0.1359 -0.5336 0.2226 632 LEU A C 4449 O O . LEU A 621 ? 1.3193 1.1446 0.9926 -0.1376 -0.5206 0.2199 632 LEU A O 4450 C CB . LEU A 621 ? 1.0883 0.9061 0.8587 -0.1210 -0.5472 0.2004 632 LEU A CB 4451 C CG . LEU A 621 ? 1.3239 1.1483 1.1550 -0.1164 -0.5550 0.1959 632 LEU A CG 4452 C CD1 . LEU A 621 ? 1.2341 1.0428 1.0548 -0.1108 -0.5703 0.1841 632 LEU A CD1 4453 C CD2 . LEU A 621 ? 1.3677 1.1863 1.2371 -0.1170 -0.5650 0.2060 632 LEU A CD2 4454 N N . LYS A 622 ? 1.4045 1.1943 1.1106 -0.1404 -0.5459 0.2330 633 LYS A N 4455 C CA . LYS A 622 ? 1.3988 1.1761 1.0490 -0.1493 -0.5452 0.2437 633 LYS A CA 4456 C C . LYS A 622 ? 1.4033 1.1508 1.0311 -0.1472 -0.5665 0.2434 633 LYS A C 4457 O O . LYS A 622 ? 1.5051 1.2310 1.1422 -0.1515 -0.5796 0.2524 633 LYS A O 4458 C CB . LYS A 622 ? 1.2914 1.0665 0.9483 -0.1604 -0.5394 0.2596 633 LYS A CB 4459 C CG . LYS A 622 ? 1.3662 1.1687 1.0387 -0.1637 -0.5182 0.2612 633 LYS A CG 4460 C CD . LYS A 622 ? 1.4476 1.2428 1.1303 -0.1734 -0.5159 0.2759 633 LYS A CD 4461 C CE . LYS A 622 ? 1.4602 1.2433 1.1956 -0.1644 -0.5289 0.2729 633 LYS A CE 4462 N NZ . LYS A 622 ? 1.4251 1.2012 1.1724 -0.1699 -0.5267 0.2831 633 LYS A NZ 4463 N N . PRO A 623 ? 1.3125 1.0569 0.9093 -0.1393 -0.5715 0.2319 634 PRO A N 4464 C CA . PRO A 623 ? 1.3776 1.0933 0.9427 -0.1366 -0.5909 0.2311 634 PRO A CA 4465 C C . PRO A 623 ? 1.5139 1.2254 1.0210 -0.1464 -0.5853 0.2448 634 PRO A C 4466 O O . PRO A 623 ? 1.4209 1.1102 0.8925 -0.1461 -0.5990 0.2472 634 PRO A O 4467 C CB . PRO A 623 ? 1.3347 1.0532 0.8817 -0.1236 -0.5940 0.2131 634 PRO A CB 4468 C CG . PRO A 623 ? 1.3049 1.0559 0.8442 -0.1223 -0.5713 0.2080 634 PRO A CG 4469 C CD . PRO A 623 ? 1.4217 1.1881 1.0100 -0.1310 -0.5599 0.2175 634 PRO A CD 4470 N N . THR A 624 ? 1.6052 1.3399 1.1053 -0.1559 -0.5647 0.2549 635 THR A N 4471 C CA . THR A 624 ? 1.6816 1.4200 1.1372 -0.1697 -0.5552 0.2728 635 THR A CA 4472 C C . THR A 624 ? 1.8576 1.5938 1.2478 -0.1674 -0.5567 0.2739 635 THR A C 4473 O O . THR A 624 ? 2.1906 1.9034 1.5576 -0.1741 -0.5696 0.2847 635 THR A O 4474 C CB . THR A 624 ? 1.9757 1.6932 1.4547 -0.1835 -0.5640 0.2897 635 THR A CB 4475 O OG1 . THR A 624 ? 1.9411 1.6650 1.3797 -0.1997 -0.5537 0.3087 635 THR A OG1 4476 C CG2 . THR A 624 ? 2.1124 1.7927 1.6050 -0.1798 -0.5911 0.2877 635 THR A CG2 4477 N N . ASP A 625 ? 1.7817 1.5435 1.1415 -0.1564 -0.5435 0.2617 636 ASP A N 4478 C CA . ASP A 625 ? 1.8995 1.6792 1.1929 -0.1554 -0.5322 0.2665 636 ASP A CA 4479 C C . ASP A 625 ? 1.9528 1.7692 1.2446 -0.1691 -0.5050 0.2807 636 ASP A C 4480 O O . ASP A 625 ? 1.9654 1.8169 1.2166 -0.1658 -0.4849 0.2805 636 ASP A O 4481 C CB . ASP A 625 ? 1.8824 1.6719 1.1461 -0.1328 -0.5330 0.2429 636 ASP A CB 4482 C CG . ASP A 625 ? 1.8924 1.7085 1.0854 -0.1270 -0.5185 0.2454 636 ASP A CG 4483 O OD1 . ASP A 625 ? 1.7920 1.6060 0.9545 -0.1392 -0.5170 0.2652 636 ASP A OD1 4484 O OD2 . ASP A 625 ? 1.9937 1.8347 1.1623 -0.1095 -0.5086 0.2274 636 ASP A OD2 4485 N N . TRP A 626 ? 1.9066 1.7149 1.2446 -0.1836 -0.5053 0.2927 637 TRP A N 4486 C CA . TRP A 626 ? 1.9480 1.7858 1.3043 -0.1949 -0.4832 0.3019 637 TRP A CA 4487 C C . TRP A 626 ? 2.0628 1.9310 1.4224 -0.1809 -0.4682 0.2828 637 TRP A C 4488 O O . TRP A 626 ? 2.2059 2.1118 1.5433 -0.1841 -0.4449 0.2863 637 TRP A O 4489 C CB . TRP A 626 ? 1.9966 1.8539 1.3180 -0.2136 -0.4677 0.3260 637 TRP A CB 4490 C CG . TRP A 626 ? 2.2049 2.0319 1.5460 -0.2318 -0.4818 0.3455 637 TRP A CG 4491 C CD1 . TRP A 626 ? 2.1965 2.0241 1.5701 -0.2479 -0.4770 0.3598 637 TRP A CD1 4492 C CD2 . TRP A 626 ? 2.4186 2.2069 1.7490 -0.2344 -0.5059 0.3510 637 TRP A CD2 4493 N NE1 . TRP A 626 ? 2.3270 2.1179 1.7092 -0.2597 -0.4974 0.3728 637 TRP A NE1 4494 C CE2 . TRP A 626 ? 2.4573 2.2244 1.8139 -0.2522 -0.5149 0.3680 637 TRP A CE2 4495 C CE3 . TRP A 626 ? 2.4369 2.2048 1.7374 -0.2230 -0.5221 0.3424 637 TRP A CE3 4496 C CZ2 . TRP A 626 ? 2.4585 2.1855 1.8123 -0.2590 -0.5392 0.3762 637 TRP A CZ2 4497 C CZ3 . TRP A 626 ? 2.4347 2.1638 1.7333 -0.2307 -0.5451 0.3519 637 TRP A CZ3 4498 C CH2 . TRP A 626 ? 2.4249 2.1344 1.7500 -0.2487 -0.5534 0.3685 637 TRP A CH2 4499 N N . LEU A 627 ? 1.9323 1.7841 1.3218 -0.1657 -0.4828 0.2627 638 LEU A N 4500 C CA . LEU A 627 ? 1.8072 1.6798 1.2132 -0.1535 -0.4739 0.2436 638 LEU A CA 4501 C C . LEU A 627 ? 1.7050 1.5619 1.1769 -0.1510 -0.4852 0.2364 638 LEU A C 4502 O O . LEU A 627 ? 1.6430 1.4708 1.1395 -0.1492 -0.5053 0.2363 638 LEU A O 4503 C CB . LEU A 627 ? 1.6540 1.5286 1.0202 -0.1333 -0.4795 0.2224 638 LEU A CB 4504 C CG . LEU A 627 ? 1.6651 1.5036 1.0295 -0.1212 -0.5064 0.2110 638 LEU A CG 4505 C CD1 . LEU A 627 ? 1.4214 1.2448 0.8422 -0.1130 -0.5204 0.1955 638 LEU A CD1 4506 C CD2 . LEU A 627 ? 1.9186 1.7636 1.2208 -0.1042 -0.5073 0.1975 638 LEU A CD2 4507 N N . ASP A 628 ? 1.4385 1.3180 0.9396 -0.1507 -0.4714 0.2308 639 ASP A N 4508 C CA . ASP A 628 ? 1.2331 1.1057 0.7974 -0.1482 -0.4782 0.2255 639 ASP A CA 4509 C C . ASP A 628 ? 1.2843 1.1667 0.8658 -0.1346 -0.4788 0.2040 639 ASP A C 4510 O O . ASP A 628 ? 1.1795 1.0857 0.7408 -0.1315 -0.4641 0.1957 639 ASP A O 4511 C CB . ASP A 628 ? 1.2773 1.1639 0.8704 -0.1604 -0.4638 0.2392 639 ASP A CB 4512 C CG . ASP A 628 ? 1.4250 1.2972 1.0056 -0.1744 -0.4659 0.2603 639 ASP A CG 4513 O OD1 . ASP A 628 ? 1.5184 1.3650 1.0849 -0.1741 -0.4826 0.2638 639 ASP A OD1 4514 O OD2 . ASP A 628 ? 1.3761 1.2608 0.9619 -0.1861 -0.4523 0.2732 639 ASP A OD2 4515 N N . LEU A 629 ? 1.3503 1.2149 0.9708 -0.1271 -0.4962 0.1954 640 LEU A N 4516 C CA . LEU A 629 ? 1.2433 1.1139 0.8913 -0.1167 -0.4991 0.1775 640 LEU A CA 4517 C C . LEU A 629 ? 1.1243 1.0102 0.8331 -0.1212 -0.4908 0.1813 640 LEU A C 4518 O O . LEU A 629 ? 1.1117 0.9898 0.8629 -0.1233 -0.4989 0.1890 640 LEU A O 4519 C CB . LEU A 629 ? 1.2001 1.0448 0.8583 -0.1080 -0.5223 0.1685 640 LEU A CB 4520 C CG . LEU A 629 ? 1.2466 1.0777 0.8525 -0.0960 -0.5325 0.1540 640 LEU A CG 4521 C CD1 . LEU A 629 ? 1.3273 1.1595 0.8706 -0.0983 -0.5261 0.1621 640 LEU A CD1 4522 C CD2 . LEU A 629 ? 1.2100 1.0117 0.8340 -0.0905 -0.5573 0.1488 640 LEU A CD2 4523 N N . THR A 630 ? 1.0269 0.9364 0.7390 -0.1215 -0.4745 0.1756 641 THR A N 4524 C CA . THR A 630 ? 0.9553 0.8823 0.7217 -0.1248 -0.4589 0.1786 641 THR A CA 4525 C C . THR A 630 ? 1.0968 1.0335 0.8979 -0.1183 -0.4594 0.1643 641 THR A C 4526 O O . THR A 630 ? 1.1481 1.0856 0.9242 -0.1115 -0.4600 0.1492 641 THR A O 4527 C CB . THR A 630 ? 0.9567 0.9042 0.7125 -0.1311 -0.4278 0.1830 641 THR A CB 4528 O OG1 . THR A 630 ? 1.0394 1.0049 0.7750 -0.1256 -0.4112 0.1677 641 THR A OG1 4529 C CG2 . THR A 630 ? 1.0169 0.9561 0.7310 -0.1403 -0.4281 0.1988 641 THR A CG2 4530 N N . TYR A 631 ? 1.0816 1.0265 0.9392 -0.1197 -0.4599 0.1693 642 TYR A N 4531 C CA . TYR A 631 ? 1.1262 1.0830 1.0210 -0.1167 -0.4597 0.1600 642 TYR A CA 4532 C C . TYR A 631 ? 1.0487 1.0270 0.9969 -0.1189 -0.4432 0.1671 642 TYR A C 4533 O O . TYR A 631 ? 1.1249 1.1046 1.1037 -0.1194 -0.4508 0.1788 642 TYR A O 4534 C CB . TYR A 631 ? 1.1175 1.0578 1.0288 -0.1124 -0.4796 0.1551 642 TYR A CB 4535 C CG . TYR A 631 ? 1.1565 1.1063 1.1051 -0.1113 -0.4787 0.1474 642 TYR A CG 4536 C CD1 . TYR A 631 ? 1.2009 1.1454 1.1251 -0.1063 -0.4796 0.1311 642 TYR A CD1 4537 C CD2 . TYR A 631 ? 1.1182 1.0829 1.1251 -0.1146 -0.4769 0.1568 642 TYR A CD2 4538 C CE1 . TYR A 631 ? 1.1716 1.1205 1.1283 -0.1065 -0.4801 0.1251 642 TYR A CE1 4539 C CE2 . TYR A 631 ? 1.1296 1.1033 1.1687 -0.1160 -0.4755 0.1529 642 TYR A CE2 4540 C CZ . TYR A 631 ? 1.1065 1.0696 1.1202 -0.1128 -0.4778 0.1374 642 TYR A CZ 4541 O OH . TYR A 631 ? 1.0153 0.9827 1.0591 -0.1153 -0.4779 0.1345 642 TYR A OH 4542 N N . ARG A 632 ? 0.8993 0.8946 0.8576 -0.1184 -0.4217 0.1589 643 ARG A N 4543 C CA . ARG A 632 ? 0.9663 0.9818 0.9674 -0.1189 -0.4032 0.1643 643 ARG A CA 4544 C C . ARG A 632 ? 1.0073 1.0381 1.0413 -0.1184 -0.3991 0.1575 643 ARG A C 4545 O O . ARG A 632 ? 0.9807 1.0064 0.9963 -0.1177 -0.4025 0.1452 643 ARG A O 4546 C CB . ARG A 632 ? 1.0053 1.0260 0.9861 -0.1206 -0.3775 0.1646 643 ARG A CB 4547 C CG . ARG A 632 ? 0.9883 1.0131 0.9364 -0.1206 -0.3638 0.1517 643 ARG A CG 4548 C CD . ARG A 632 ? 0.9843 1.0201 0.9262 -0.1237 -0.3379 0.1535 643 ARG A CD 4549 N NE . ARG A 632 ? 1.0699 1.1168 1.0547 -0.1223 -0.3264 0.1562 643 ARG A NE 4550 C CZ . ARG A 632 ? 1.0725 1.1299 1.0616 -0.1232 -0.3048 0.1533 643 ARG A CZ 4551 N NH1 . ARG A 632 ? 1.0869 1.1487 1.0443 -0.1265 -0.2914 0.1482 643 ARG A NH1 4552 N NH2 . ARG A 632 ? 0.9712 1.0366 0.9969 -0.1200 -0.2970 0.1557 643 ARG A NH2 4553 N N . THR A 633 ? 1.0821 1.1319 1.1634 -0.1179 -0.3926 0.1656 644 THR A N 4554 C CA . THR A 633 ? 0.9522 1.0202 1.0691 -0.1193 -0.3878 0.1634 644 THR A CA 4555 C C . THR A 633 ? 0.9516 1.0400 1.0929 -0.1161 -0.3624 0.1669 644 THR A C 4556 O O . THR A 633 ? 1.0806 1.1744 1.2353 -0.1115 -0.3593 0.1755 644 THR A O 4557 C CB . THR A 633 ? 0.8654 0.9407 1.0218 -0.1215 -0.4084 0.1728 644 THR A CB 4558 O OG1 . THR A 633 ? 0.8172 0.8666 0.9487 -0.1225 -0.4259 0.1647 644 THR A OG1 4559 C CG2 . THR A 633 ? 0.9708 1.0695 1.1677 -0.1238 -0.3971 0.1751 644 THR A CG2 4560 N N . SER A 634 ? 0.8614 0.9586 1.0066 -0.1172 -0.3463 0.1591 645 SER A N 4561 C CA . SER A 634 ? 0.8439 0.9584 1.0098 -0.1132 -0.3233 0.1611 645 SER A CA 4562 C C . SER A 634 ? 0.7780 0.9060 0.9636 -0.1160 -0.3148 0.1564 645 SER A C 4563 O O . SER A 634 ? 0.7300 0.8476 0.8985 -0.1203 -0.3206 0.1464 645 SER A O 4564 C CB . SER A 634 ? 0.8591 0.9618 0.9918 -0.1114 -0.3063 0.1563 645 SER A CB 4565 O OG . SER A 634 ? 0.8567 0.9515 0.9587 -0.1150 -0.2998 0.1441 645 SER A OG 4566 N N . THR A 635 ? 0.7239 0.8747 0.9437 -0.1124 -0.3024 0.1632 646 THR A N 4567 C CA . THR A 635 ? 0.7239 0.8880 0.9615 -0.1156 -0.2928 0.1606 646 THR A CA 4568 C C . THR A 635 ? 0.7787 0.9388 0.9998 -0.1111 -0.2689 0.1515 646 THR A C 4569 O O . THR A 635 ? 0.8253 0.9767 1.0292 -0.1054 -0.2599 0.1505 646 THR A O 4570 C CB . THR A 635 ? 0.6856 0.8825 0.9711 -0.1149 -0.2929 0.1751 646 THR A CB 4571 O OG1 . THR A 635 ? 0.6931 0.9046 0.9892 -0.1024 -0.2767 0.1791 646 THR A OG1 4572 C CG2 . THR A 635 ? 0.6134 0.8174 0.9206 -0.1200 -0.3178 0.1869 646 THR A CG2 4573 N N . GLY A 636 ? 0.5776 0.7418 0.8042 -0.1147 -0.2614 0.1458 647 GLY A N 4574 C CA . GLY A 636 ? 0.5546 0.7148 0.7684 -0.1112 -0.2406 0.1370 647 GLY A CA 4575 C C . GLY A 636 ? 0.6695 0.8428 0.9049 -0.1137 -0.2336 0.1370 647 GLY A C 4576 O O . GLY A 636 ? 0.6687 0.8442 0.9153 -0.1218 -0.2470 0.1382 647 GLY A O 4577 N N . PHE A 637 ? 0.5844 0.7640 0.8242 -0.1069 -0.2148 0.1363 648 PHE A N 4578 C CA . PHE A 637 ? 0.4746 0.6664 0.7321 -0.1090 -0.2071 0.1370 648 PHE A CA 4579 C C . PHE A 637 ? 0.5821 0.7635 0.8242 -0.1036 -0.1887 0.1270 648 PHE A C 4580 O O . PHE A 637 ? 0.6498 0.8213 0.8767 -0.0962 -0.1801 0.1240 648 PHE A O 4581 C CB . PHE A 637 ? 0.5204 0.7441 0.8139 -0.1055 -0.2055 0.1531 648 PHE A CB 4582 C CG . PHE A 637 ? 0.5095 0.7436 0.8064 -0.0898 -0.1891 0.1549 648 PHE A CG 4583 C CD1 . PHE A 637 ? 0.5596 0.8046 0.8631 -0.0836 -0.1735 0.1545 648 PHE A CD1 4584 C CD2 . PHE A 637 ? 0.5930 0.8229 0.8841 -0.0800 -0.1916 0.1565 648 PHE A CD2 4585 C CE1 . PHE A 637 ? 0.6955 0.9467 0.9984 -0.0661 -0.1610 0.1541 648 PHE A CE1 4586 C CE2 . PHE A 637 ? 0.5187 0.7534 0.8107 -0.0632 -0.1807 0.1564 648 PHE A CE2 4587 C CZ . PHE A 637 ? 0.5459 0.7911 0.8432 -0.0553 -0.1655 0.1545 648 PHE A CZ 4588 N N . ARG A 638 ? 0.5765 0.7581 0.8230 -0.1085 -0.1856 0.1227 649 ARG A N 4589 C CA . ARG A 638 ? 0.6549 0.8263 0.8893 -0.1042 -0.1702 0.1133 649 ARG A CA 4590 C C . ARG A 638 ? 0.6467 0.8327 0.9006 -0.1045 -0.1639 0.1188 649 ARG A C 4591 O O . ARG A 638 ? 0.6333 0.8229 0.8977 -0.1149 -0.1739 0.1213 649 ARG A O 4592 C CB . ARG A 638 ? 0.5528 0.7038 0.7635 -0.1097 -0.1731 0.0979 649 ARG A CB 4593 C CG . ARG A 638 ? 0.3640 0.5050 0.5652 -0.1066 -0.1592 0.0884 649 ARG A CG 4594 C CD . ARG A 638 ? 0.4830 0.6105 0.6669 -0.1113 -0.1634 0.0730 649 ARG A CD 4595 N NE . ARG A 638 ? 0.6721 0.7920 0.8539 -0.1096 -0.1530 0.0650 649 ARG A NE 4596 C CZ . ARG A 638 ? 0.6777 0.7930 0.8646 -0.1137 -0.1583 0.0590 649 ARG A CZ 4597 N NH1 . ARG A 638 ? 0.5588 0.6752 0.7532 -0.1203 -0.1753 0.0605 649 ARG A NH1 4598 N NH2 . ARG A 638 ? 0.7774 0.8840 0.9614 -0.1115 -0.1492 0.0517 649 ARG A NH2 4599 N N . LEU A 639 ? 0.5203 0.7135 0.7774 -0.0930 -0.1491 0.1213 650 LEU A N 4600 C CA . LEU A 639 ? 0.4328 0.6405 0.7032 -0.0912 -0.1404 0.1262 650 LEU A CA 4601 C C . LEU A 639 ? 0.5534 0.7389 0.8086 -0.0973 -0.1382 0.1135 650 LEU A C 4602 O O . LEU A 639 ? 0.6114 0.7736 0.8458 -0.0975 -0.1380 0.1004 650 LEU A O 4603 C CB . LEU A 639 ? 0.3397 0.5580 0.6116 -0.0729 -0.1263 0.1292 650 LEU A CB 4604 C CG . LEU A 639 ? 0.3941 0.6478 0.6900 -0.0635 -0.1255 0.1438 650 LEU A CG 4605 C CD1 . LEU A 639 ? 0.3398 0.6144 0.6591 -0.0784 -0.1393 0.1566 650 LEU A CD1 4606 C CD2 . LEU A 639 ? 0.3511 0.5969 0.6380 -0.0482 -0.1257 0.1409 650 LEU A CD2 4607 N N . PRO A 640 ? 0.4430 0.6376 0.7093 -0.1027 -0.1373 0.1185 651 PRO A N 4608 C CA . PRO A 640 ? 0.4004 0.5733 0.6537 -0.1076 -0.1367 0.1066 651 PRO A CA 4609 C C . PRO A 640 ? 0.5421 0.6965 0.7762 -0.0957 -0.1230 0.0949 651 PRO A C 4610 O O . PRO A 640 ? 0.7294 0.8923 0.9647 -0.0828 -0.1118 0.0997 651 PRO A O 4611 C CB . PRO A 640 ? 0.3406 0.5322 0.6105 -0.1125 -0.1351 0.1194 651 PRO A CB 4612 C CG . PRO A 640 ? 0.4058 0.6298 0.7008 -0.1168 -0.1411 0.1384 651 PRO A CG 4613 C CD . PRO A 640 ? 0.4006 0.6293 0.6936 -0.1052 -0.1373 0.1374 651 PRO A CD 4614 N N . SER A 641 ? 0.5236 0.6541 0.7409 -0.0989 -0.1251 0.0799 652 SER A N 4615 C CA . SER A 641 ? 0.6332 0.7459 0.8348 -0.0902 -0.1148 0.0706 652 SER A CA 4616 C C . SER A 641 ? 0.6121 0.7196 0.8131 -0.0848 -0.1069 0.0698 652 SER A C 4617 O O . SER A 641 ? 0.4515 0.5683 0.6622 -0.0903 -0.1094 0.0754 652 SER A O 4618 C CB . SER A 641 ? 0.5761 0.6718 0.7634 -0.0958 -0.1187 0.0563 652 SER A CB 4619 O OG . SER A 641 ? 0.4041 0.4918 0.5914 -0.1023 -0.1246 0.0475 652 SER A OG 4620 N N . PHE A 642 ? 0.6014 0.6924 0.7898 -0.0749 -0.0994 0.0639 653 PHE A N 4621 C CA . PHE A 642 ? 0.5572 0.6392 0.7407 -0.0676 -0.0928 0.0618 653 PHE A CA 4622 C C . PHE A 642 ? 0.6186 0.6870 0.7996 -0.0779 -0.0974 0.0528 653 PHE A C 4623 O O . PHE A 642 ? 0.6646 0.7320 0.8457 -0.0770 -0.0952 0.0549 653 PHE A O 4624 C CB . PHE A 642 ? 0.4896 0.5513 0.6588 -0.0542 -0.0883 0.0568 653 PHE A CB 4625 C CG . PHE A 642 ? 0.5026 0.5735 0.6723 -0.0409 -0.0867 0.0645 653 PHE A CG 4626 C CD1 . PHE A 642 ? 0.5585 0.6528 0.7362 -0.0290 -0.0813 0.0735 653 PHE A CD1 4627 C CD2 . PHE A 642 ? 0.4805 0.5385 0.6430 -0.0400 -0.0915 0.0635 653 PHE A CD2 4628 C CE1 . PHE A 642 ? 0.5366 0.6404 0.7153 -0.0139 -0.0812 0.0786 653 PHE A CE1 4629 C CE2 . PHE A 642 ? 0.3686 0.4312 0.5307 -0.0271 -0.0934 0.0697 653 PHE A CE2 4630 C CZ . PHE A 642 ? 0.3715 0.4566 0.5419 -0.0127 -0.0886 0.0760 653 PHE A CZ 4631 N N . ALA A 643 ? 0.5133 0.5725 0.6912 -0.0868 -0.1044 0.0427 654 ALA A N 4632 C CA . ALA A 643 ? 0.4879 0.5339 0.6637 -0.0946 -0.1116 0.0318 654 ALA A CA 4633 C C . ALA A 643 ? 0.5014 0.5576 0.6880 -0.1049 -0.1228 0.0378 654 ALA A C 4634 O O . ALA A 643 ? 0.4075 0.4537 0.5942 -0.1102 -0.1291 0.0352 654 ALA A O 4635 C CB . ALA A 643 ? 0.4183 0.4560 0.5871 -0.0975 -0.1151 0.0179 654 ALA A CB 4636 N N . GLU A 644 ? 0.3275 0.4015 0.5231 -0.1085 -0.1277 0.0469 655 GLU A N 4637 C CA . GLU A 644 ? 0.4679 0.5521 0.6764 -0.1197 -0.1414 0.0563 655 GLU A CA 4638 C C . GLU A 644 ? 0.5821 0.6828 0.8019 -0.1206 -0.1354 0.0735 655 GLU A C 4639 O O . GLU A 644 ? 0.6336 0.7359 0.8613 -0.1320 -0.1464 0.0809 655 GLU A O 4640 C CB . GLU A 644 ? 0.5049 0.6033 0.7206 -0.1229 -0.1492 0.0624 655 GLU A CB 4641 C CG . GLU A 644 ? 0.6951 0.7800 0.8976 -0.1233 -0.1584 0.0460 655 GLU A CG 4642 C CD . GLU A 644 ? 0.6916 0.7884 0.8942 -0.1217 -0.1602 0.0508 655 GLU A CD 4643 O OE1 . GLU A 644 ? 0.7307 0.8436 0.9427 -0.1183 -0.1522 0.0647 655 GLU A OE1 4644 O OE2 . GLU A 644 ? 0.6176 0.7076 0.8092 -0.1225 -0.1703 0.0398 655 GLU A OE2 4645 N N . MET A 645 ? 0.6352 0.7488 0.8545 -0.1078 -0.1192 0.0800 656 MET A N 4646 C CA . MET A 645 ? 0.5510 0.6873 0.7789 -0.1043 -0.1104 0.0958 656 MET A CA 4647 C C . MET A 645 ? 0.5891 0.7087 0.8062 -0.1052 -0.1084 0.0916 656 MET A C 4648 O O . MET A 645 ? 0.6341 0.7701 0.8588 -0.1115 -0.1086 0.1058 656 MET A O 4649 C CB . MET A 645 ? 0.4846 0.6358 0.7105 -0.0854 -0.0952 0.0997 656 MET A CB 4650 C CG . MET A 645 ? 0.4195 0.5914 0.6585 -0.0840 -0.0976 0.1074 656 MET A CG 4651 S SD . MET A 645 ? 0.5964 0.7721 0.8273 -0.0599 -0.0854 0.1054 656 MET A SD 4652 C CE . MET A 645 ? 0.3376 0.5546 0.5812 -0.0472 -0.0732 0.1218 656 MET A CE 4653 N N . TYR A 646 ? 0.5059 0.5943 0.7058 -0.0998 -0.1073 0.0734 657 TYR A N 4654 C CA . TYR A 646 ? 0.4409 0.5085 0.6289 -0.0998 -0.1070 0.0673 657 TYR A CA 4655 C C . TYR A 646 ? 0.4216 0.4803 0.6149 -0.1175 -0.1243 0.0676 657 TYR A C 4656 O O . TYR A 646 ? 0.6009 0.6513 0.7896 -0.1222 -0.1271 0.0708 657 TYR A O 4657 C CB . TYR A 646 ? 0.4689 0.5062 0.6410 -0.0911 -0.1042 0.0484 657 TYR A CB 4658 C CG . TYR A 646 ? 0.4789 0.4914 0.6386 -0.0904 -0.1057 0.0407 657 TYR A CG 4659 C CD1 . TYR A 646 ? 0.5651 0.5557 0.7231 -0.1002 -0.1187 0.0278 657 TYR A CD1 4660 C CD2 . TYR A 646 ? 0.5346 0.5450 0.6828 -0.0781 -0.0954 0.0452 657 TYR A CD2 4661 C CE1 . TYR A 646 ? 0.5566 0.5227 0.7036 -0.0996 -0.1217 0.0205 657 TYR A CE1 4662 C CE2 . TYR A 646 ? 0.5150 0.5002 0.6498 -0.0772 -0.0980 0.0382 657 TYR A CE2 4663 C CZ . TYR A 646 ? 0.5199 0.4826 0.6552 -0.0890 -0.1114 0.0263 657 TYR A CZ 4664 O OH . TYR A 646 ? 0.5972 0.5332 0.7195 -0.0882 -0.1156 0.0191 657 TYR A OH 4665 N N . GLY A 647 ? 0.6087 0.5934 0.6609 0.0185 -0.0798 -0.0434 658 GLY A N 4666 C CA . GLY A 647 ? 0.5331 0.4878 0.5595 0.0045 -0.0952 -0.0417 658 GLY A CA 4667 C C . GLY A 647 ? 0.6275 0.5427 0.6184 0.0122 -0.0962 -0.0517 658 GLY A C 4668 O O . GLY A 647 ? 0.6720 0.5846 0.6584 0.0283 -0.0838 -0.0605 658 GLY A O 4669 N N . TRP A 648 ? 0.6872 0.5719 0.6535 0.0004 -0.1115 -0.0506 659 TRP A N 4670 C CA . TRP A 648 ? 0.6617 0.5062 0.5931 0.0062 -0.1156 -0.0598 659 TRP A CA 4671 C C . TRP A 648 ? 0.7408 0.5834 0.6702 0.0010 -0.1089 -0.0565 659 TRP A C 4672 O O . TRP A 648 ? 0.7202 0.5753 0.6617 -0.0158 -0.1115 -0.0456 659 TRP A O 4673 C CB . TRP A 648 ? 0.6793 0.4916 0.5864 -0.0046 -0.1364 -0.0599 659 TRP A CB 4674 C CG . TRP A 648 ? 0.7689 0.5378 0.6394 0.0017 -0.1434 -0.0702 659 TRP A CG 4675 C CD1 . TRP A 648 ? 0.7742 0.5215 0.6234 0.0155 -0.1462 -0.0824 659 TRP A CD1 4676 C CD2 . TRP A 648 ? 0.8671 0.6082 0.7176 -0.0057 -0.1488 -0.0693 659 TRP A CD2 4677 N NE1 . TRP A 648 ? 0.8231 0.5323 0.6417 0.0182 -0.1531 -0.0901 659 TRP A NE1 4678 C CE2 . TRP A 648 ? 0.8909 0.5943 0.7092 0.0056 -0.1553 -0.0819 659 TRP A CE2 4679 C CE3 . TRP A 648 ? 0.9025 0.6469 0.7587 -0.0207 -0.1487 -0.0588 659 TRP A CE3 4680 C CZ2 . TRP A 648 ? 0.9269 0.5950 0.7193 0.0035 -0.1624 -0.0845 659 TRP A CZ2 4681 C CZ3 . TRP A 648 ? 0.9070 0.6151 0.7359 -0.0237 -0.1556 -0.0603 659 TRP A CZ3 4682 C CH2 . TRP A 648 ? 0.9328 0.6027 0.7303 -0.0112 -0.1627 -0.0731 659 TRP A CH2 4683 N N . ARG A 649 ? 0.7360 0.5647 0.6504 0.0152 -0.1000 -0.0657 660 ARG A N 4684 C CA . ARG A 649 ? 0.5653 0.3932 0.4767 0.0123 -0.0928 -0.0629 660 ARG A CA 4685 C C . ARG A 649 ? 0.6695 0.4572 0.5463 0.0202 -0.0979 -0.0718 660 ARG A C 4686 O O . ARG A 649 ? 0.8961 0.6669 0.7575 0.0354 -0.0982 -0.0841 660 ARG A O 4687 C CB . ARG A 649 ? 0.6169 0.4821 0.5549 0.0219 -0.0725 -0.0637 660 ARG A CB 4688 C CG . ARG A 649 ? 0.6843 0.5905 0.6584 0.0145 -0.0674 -0.0549 660 ARG A CG 4689 C CD . ARG A 649 ? 0.6486 0.5912 0.6492 0.0214 -0.0479 -0.0549 660 ARG A CD 4690 N NE . ARG A 649 ? 0.5436 0.5246 0.5791 0.0153 -0.0442 -0.0472 660 ARG A NE 4691 C CZ . ARG A 649 ? 0.4884 0.5065 0.5530 0.0193 -0.0283 -0.0461 660 ARG A CZ 4692 N NH1 . ARG A 649 ? 0.6371 0.6889 0.7332 0.0143 -0.0266 -0.0396 660 ARG A NH1 4693 N NH2 . ARG A 649 ? 0.5122 0.5343 0.5746 0.0287 -0.0146 -0.0521 660 ARG A NH2 4694 N N . ALA A 650 ? 0.6874 0.4601 0.5518 0.0099 -0.1018 -0.0654 661 ALA A N 4695 C CA . ALA A 650 ? 0.8093 0.5415 0.6402 0.0164 -0.1087 -0.0725 661 ALA A CA 4696 C C . ALA A 650 ? 0.9471 0.6827 0.7751 0.0182 -0.0992 -0.0697 661 ALA A C 4697 O O . ALA A 650 ? 1.2100 0.9137 1.0129 0.0143 -0.1079 -0.0678 661 ALA A O 4698 C CB . ALA A 650 ? 0.9674 0.6627 0.7753 0.0018 -0.1290 -0.0682 661 ALA A CB 4699 N N . GLY A 651 ? 0.8914 0.6650 0.7445 0.0244 -0.0815 -0.0695 662 GLY A N 4700 C CA . GLY A 651 ? 0.9347 0.7153 0.7857 0.0282 -0.0711 -0.0684 662 GLY A CA 4701 C C . GLY A 651 ? 0.8659 0.6534 0.7208 0.0079 -0.0723 -0.0527 662 GLY A C 4702 O O . GLY A 651 ? 0.9591 0.7422 0.8034 0.0080 -0.0678 -0.0499 662 GLY A O 4703 N N . VAL A 652 ? 0.8345 0.6332 0.7041 -0.0098 -0.0784 -0.0424 663 VAL A N 4704 C CA . VAL A 652 ? 0.8074 0.6175 0.6845 -0.0311 -0.0785 -0.0272 663 VAL A CA 4705 C C . VAL A 652 ? 0.9218 0.7778 0.8369 -0.0405 -0.0709 -0.0207 663 VAL A C 4706 O O . VAL A 652 ? 0.9585 0.8295 0.8900 -0.0323 -0.0699 -0.0265 663 VAL A O 4707 C CB . VAL A 652 ? 0.8853 0.6553 0.7374 -0.0484 -0.0977 -0.0196 663 VAL A CB 4708 C CG1 . VAL A 652 ? 1.0790 0.8031 0.8935 -0.0390 -0.1055 -0.0253 663 VAL A CG1 4709 C CG2 . VAL A 652 ? 0.8279 0.5896 0.6828 -0.0524 -0.1106 -0.0222 663 VAL A CG2 4710 N N . GLN A 653 ? 1.0164 0.8949 0.9454 -0.0573 -0.0656 -0.0085 664 GLN A N 4711 C CA . GLN A 653 ? 1.0363 0.9598 1.0024 -0.0680 -0.0590 -0.0017 664 GLN A CA 4712 C C . GLN A 653 ? 1.0333 0.9519 1.0056 -0.0773 -0.0737 0.0004 664 GLN A C 4713 O O . GLN A 653 ? 0.9854 0.8692 0.9352 -0.0891 -0.0898 0.0040 664 GLN A O 4714 C CB . GLN A 653 ? 1.1538 1.0958 1.1279 -0.0879 -0.0535 0.0115 664 GLN A CB 4715 C CG . GLN A 653 ? 1.2686 1.2579 1.2815 -0.1012 -0.0478 0.0190 664 GLN A CG 4716 C CD . GLN A 653 ? 1.3081 1.3431 1.3527 -0.0868 -0.0289 0.0131 664 GLN A CD 4717 O OE1 . GLN A 653 ? 1.2935 1.3246 1.3325 -0.0661 -0.0207 0.0024 664 GLN A OE1 4718 N NE2 . GLN A 653 ? 1.2669 1.3459 1.3458 -0.0979 -0.0218 0.0195 664 GLN A NE2 4719 N N . SER A 654 ? 0.9708 0.9234 0.9733 -0.0715 -0.0684 -0.0020 665 SER A N 4720 C CA . SER A 654 ? 0.9227 0.8761 0.9338 -0.0790 -0.0817 -0.0002 665 SER A CA 4721 C C . SER A 654 ? 0.7823 0.7840 0.8327 -0.0909 -0.0762 0.0082 665 SER A C 4722 O O . SER A 654 ? 0.8298 0.8684 0.9058 -0.0833 -0.0600 0.0072 665 SER A O 4723 C CB . SER A 654 ? 1.0257 0.9716 1.0340 -0.0587 -0.0831 -0.0117 665 SER A CB 4724 O OG . SER A 654 ? 1.1757 1.0798 1.1496 -0.0467 -0.0877 -0.0209 665 SER A OG 4725 N N . LYS A 655 ? 0.9107 0.9128 0.9664 -0.1096 -0.0897 0.0156 666 LYS A N 4726 C CA . LYS A 655 ? 0.9785 1.0273 1.0731 -0.1189 -0.0868 0.0218 666 LYS A CA 4727 C C . LYS A 655 ? 0.9924 1.0515 1.1004 -0.1042 -0.0905 0.0153 666 LYS A C 4728 O O . LYS A 655 ? 1.0157 1.0425 1.0999 -0.0920 -0.0981 0.0076 666 LYS A O 4729 C CB . LYS A 655 ? 1.0379 1.0853 1.1342 -0.1460 -0.0999 0.0321 666 LYS A CB 4730 C CG . LYS A 655 ? 1.1805 1.2234 1.2677 -0.1637 -0.0951 0.0409 666 LYS A CG 4731 C CD . LYS A 655 ? 1.3029 1.3937 1.4204 -0.1631 -0.0751 0.0441 666 LYS A CD 4732 C CE . LYS A 655 ? 1.4131 1.5008 1.5205 -0.1822 -0.0702 0.0538 666 LYS A CE 4733 N NZ . LYS A 655 ? 1.4265 1.5159 1.5389 -0.2103 -0.0818 0.0643 666 LYS A NZ 4734 N N . ALA A 656 ? 0.8608 0.9650 1.0065 -0.1049 -0.0852 0.0184 667 ALA A N 4735 C CA . ALA A 656 ? 0.6830 0.7979 0.8422 -0.0929 -0.0904 0.0144 667 ALA A CA 4736 C C . ALA A 656 ? 0.8045 0.9189 0.9672 -0.1100 -0.1093 0.0201 667 ALA A C 4737 O O . ALA A 656 ? 0.8363 0.9667 1.0115 -0.1308 -0.1126 0.0283 667 ALA A O 4738 C CB . ALA A 656 ? 0.5019 0.6644 0.7000 -0.0820 -0.0752 0.0138 667 ALA A CB 4739 N N . VAL A 657 ? 0.7935 0.8899 0.9447 -0.1018 -0.1217 0.0156 668 VAL A N 4740 C CA . VAL A 657 ? 0.7481 0.8457 0.9031 -0.1163 -0.1403 0.0198 668 VAL A CA 4741 C C . VAL A 657 ? 0.8020 0.9313 0.9845 -0.1058 -0.1420 0.0195 668 VAL A C 4742 O O . VAL A 657 ? 0.9662 1.0997 1.1522 -0.0849 -0.1327 0.0142 668 VAL A O 4743 C CB . VAL A 657 ? 0.8747 0.9216 0.9895 -0.1186 -0.1572 0.0152 668 VAL A CB 4744 C CG1 . VAL A 657 ? 0.7492 0.7635 0.8378 -0.1323 -0.1593 0.0171 668 VAL A CG1 4745 C CG2 . VAL A 657 ? 1.0334 1.0578 1.1284 -0.0947 -0.1542 0.0052 668 VAL A CG2 4746 N N . LYS A 658 ? 0.7939 0.9454 0.9960 -0.1203 -0.1543 0.0253 669 LYS A N 4747 C CA . LYS A 658 ? 0.7463 0.9266 0.9734 -0.1110 -0.1591 0.0258 669 LYS A CA 4748 C C . LYS A 658 ? 0.6798 0.8265 0.8784 -0.1000 -0.1721 0.0202 669 LYS A C 4749 O O . LYS A 658 ? 0.7287 0.8381 0.8957 -0.1090 -0.1851 0.0179 669 LYS A O 4750 C CB . LYS A 658 ? 0.8653 1.0796 1.1211 -0.1307 -0.1698 0.0331 669 LYS A CB 4751 C CG . LYS A 658 ? 1.1671 1.4142 1.4510 -0.1213 -0.1760 0.0343 669 LYS A CG 4752 C CD . LYS A 658 ? 1.4772 1.7537 1.7871 -0.1006 -0.1579 0.0328 669 LYS A CD 4753 C CE . LYS A 658 ? 1.6444 1.9569 1.9862 -0.0922 -0.1642 0.0352 669 LYS A CE 4754 N NZ . LYS A 658 ? 1.7270 2.0146 2.0470 -0.0830 -0.1799 0.0331 669 LYS A NZ 4755 N N . ILE A 659 ? 0.5742 0.7329 0.7828 -0.0806 -0.1683 0.0177 670 ILE A N 4756 C CA . ILE A 659 ? 0.5979 0.7303 0.7822 -0.0710 -0.1808 0.0134 670 ILE A CA 4757 C C . ILE A 659 ? 0.5451 0.7083 0.7549 -0.0653 -0.1886 0.0174 670 ILE A C 4758 O O . ILE A 659 ? 0.6073 0.7992 0.8436 -0.0516 -0.1771 0.0188 670 ILE A O 4759 C CB . ILE A 659 ? 0.5662 0.6713 0.7266 -0.0502 -0.1695 0.0054 670 ILE A CB 4760 C CG1 . ILE A 659 ? 0.5131 0.5918 0.6517 -0.0528 -0.1602 0.0011 670 ILE A CG1 4761 C CG2 . ILE A 659 ? 0.5309 0.6059 0.6617 -0.0435 -0.1833 0.0008 670 ILE A CG2 4762 C CD1 . ILE A 659 ? 0.5055 0.5576 0.6202 -0.0333 -0.1500 -0.0080 670 ILE A CD1 4763 N N . ASP A 660 ? 0.5563 0.7132 0.7578 -0.0757 -0.2088 0.0190 671 ASP A N 4764 C CA . ASP A 660 ? 0.6268 0.8091 0.8477 -0.0697 -0.2191 0.0226 671 ASP A CA 4765 C C . ASP A 660 ? 0.6938 0.8526 0.8914 -0.0489 -0.2185 0.0181 671 ASP A C 4766 O O . ASP A 660 ? 0.6384 0.7595 0.8024 -0.0433 -0.2143 0.0114 671 ASP A O 4767 C CB . ASP A 660 ? 0.7008 0.8846 0.9197 -0.0889 -0.2414 0.0252 671 ASP A CB 4768 C CG . ASP A 660 ? 0.9214 1.1309 1.1653 -0.1111 -0.2417 0.0301 671 ASP A CG 4769 O OD1 . ASP A 660 ? 0.9557 1.2012 1.2332 -0.1093 -0.2275 0.0337 671 ASP A OD1 4770 O OD2 . ASP A 660 ? 0.9982 1.1918 1.2280 -0.1308 -0.2557 0.0301 671 ASP A OD2 4771 N N . PRO A 661 ? 0.7236 0.9047 0.9389 -0.0371 -0.2223 0.0217 672 PRO A N 4772 C CA . PRO A 661 ? 0.5537 0.7116 0.7455 -0.0181 -0.2208 0.0182 672 PRO A CA 4773 C C . PRO A 661 ? 0.6846 0.8114 0.8407 -0.0226 -0.2399 0.0152 672 PRO A C 4774 O O . PRO A 661 ? 0.7982 0.9306 0.9558 -0.0384 -0.2574 0.0174 672 PRO A O 4775 C CB . PRO A 661 ? 0.5544 0.7477 0.7788 -0.0052 -0.2197 0.0245 672 PRO A CB 4776 C CG . PRO A 661 ? 0.5158 0.7450 0.7715 -0.0206 -0.2315 0.0304 672 PRO A CG 4777 C CD . PRO A 661 ? 0.6698 0.8980 0.9275 -0.0387 -0.2262 0.0288 672 PRO A CD 4778 N N . GLU A 662 ? 0.6609 0.7558 0.7850 -0.0092 -0.2362 0.0094 673 GLU A N 4779 C CA . GLU A 662 ? 0.6670 0.7356 0.7579 -0.0096 -0.2529 0.0063 673 GLU A CA 4780 C C . GLU A 662 ? 0.7010 0.7947 0.8084 -0.0038 -0.2644 0.0137 673 GLU A C 4781 O O . GLU A 662 ? 0.6419 0.7596 0.7745 0.0093 -0.2547 0.0189 673 GLU A O 4782 C CB . GLU A 662 ? 0.6913 0.7243 0.7472 0.0047 -0.2434 -0.0017 673 GLU A CB 4783 C CG . GLU A 662 ? 0.7447 0.7497 0.7802 0.0004 -0.2343 -0.0101 673 GLU A CG 4784 C CD . GLU A 662 ? 0.8024 0.7736 0.8032 0.0142 -0.2265 -0.0192 673 GLU A CD 4785 O OE1 . GLU A 662 ? 0.7540 0.7290 0.7548 0.0294 -0.2194 -0.0181 673 GLU A OE1 4786 O OE2 . GLU A 662 ? 0.9076 0.8483 0.8813 0.0097 -0.2273 -0.0276 673 GLU A OE2 4787 N N . LYS A 663 ? 0.6905 0.7786 0.7839 -0.0132 -0.2857 0.0140 674 LYS A N 4788 C CA . LYS A 663 ? 0.7606 0.8711 0.8665 -0.0076 -0.2988 0.0210 674 LYS A CA 4789 C C . LYS A 663 ? 0.7771 0.8586 0.8431 -0.0049 -0.3136 0.0173 674 LYS A C 4790 O O . LYS A 663 ? 0.7150 0.7652 0.7491 -0.0139 -0.3198 0.0094 674 LYS A O 4791 C CB . LYS A 663 ? 0.6295 0.7757 0.7685 -0.0233 -0.3124 0.0266 674 LYS A CB 4792 C CG . LYS A 663 ? 0.9153 1.0980 1.0983 -0.0247 -0.2982 0.0311 674 LYS A CG 4793 C CD . LYS A 663 ? 1.0684 1.2881 1.2837 -0.0409 -0.3125 0.0361 674 LYS A CD 4794 C CE . LYS A 663 ? 0.9940 1.2538 1.2545 -0.0419 -0.2982 0.0403 674 LYS A CE 4795 N NZ . LYS A 663 ? 0.9135 1.1977 1.1989 -0.0208 -0.2895 0.0451 674 LYS A NZ 4796 N N . SER A 664 ? 0.8027 0.8941 0.8698 0.0080 -0.3191 0.0230 675 SER A N 4797 C CA . SER A 664 ? 0.8259 0.8940 0.8560 0.0109 -0.3338 0.0207 675 SER A CA 4798 C C . SER A 664 ? 0.7794 0.8738 0.8238 0.0143 -0.3509 0.0296 675 SER A C 4799 O O . SER A 664 ? 0.8812 1.0100 0.9635 0.0200 -0.3479 0.0378 675 SER A O 4800 C CB . SER A 664 ? 0.9698 1.0079 0.9693 0.0271 -0.3196 0.0166 675 SER A CB 4801 O OG . SER A 664 ? 0.8333 0.8883 0.8540 0.0437 -0.3059 0.0239 675 SER A OG 4802 N N . PHE A 665 ? 0.8558 0.9339 0.8691 0.0114 -0.3691 0.0274 676 PHE A N 4803 C CA . PHE A 665 ? 0.9320 1.0326 0.9537 0.0140 -0.3882 0.0352 676 PHE A CA 4804 C C . PHE A 665 ? 0.9539 1.0265 0.9312 0.0222 -0.3967 0.0333 676 PHE A C 4805 O O . PHE A 665 ? 1.0383 1.0808 0.9796 0.0144 -0.4024 0.0238 676 PHE A O 4806 C CB . PHE A 665 ? 0.9432 1.0640 0.9809 -0.0058 -0.4083 0.0343 676 PHE A CB 4807 C CG . PHE A 665 ? 1.0805 1.2341 1.1382 -0.0034 -0.4271 0.0428 676 PHE A CG 4808 C CD1 . PHE A 665 ? 1.1420 1.3377 1.2476 -0.0001 -0.4245 0.0510 676 PHE A CD1 4809 C CD2 . PHE A 665 ? 1.1342 1.2777 1.1631 -0.0041 -0.4477 0.0420 676 PHE A CD2 4810 C CE1 . PHE A 665 ? 1.1290 1.3563 1.2544 0.0031 -0.4426 0.0584 676 PHE A CE1 4811 C CE2 . PHE A 665 ? 1.1430 1.3175 1.1902 -0.0013 -0.4660 0.0499 676 PHE A CE2 4812 C CZ . PHE A 665 ? 1.0941 1.3106 1.1900 0.0026 -0.4637 0.0581 676 PHE A CZ 4813 N N . ASN A 666 ? 0.9723 1.0545 0.9518 0.0381 -0.3975 0.0425 677 ASN A N 4814 C CA . ASN A 666 ? 0.9701 1.0254 0.9071 0.0480 -0.4012 0.0421 677 ASN A CA 4815 C C . ASN A 666 ? 1.1118 1.1827 1.0453 0.0515 -0.4235 0.0504 677 ASN A C 4816 O O . ASN A 666 ? 1.1517 1.2456 1.1092 0.0637 -0.4238 0.0617 677 ASN A O 4817 C CB . ASN A 666 ? 1.0351 1.0773 0.9674 0.0657 -0.3781 0.0451 677 ASN A CB 4818 C CG . ASN A 666 ? 1.1464 1.1630 1.0364 0.0761 -0.3801 0.0462 677 ASN A CG 4819 O OD1 . ASN A 666 ? 1.1407 1.1258 0.9929 0.0736 -0.3759 0.0363 677 ASN A OD1 4820 N ND2 . ASN A 666 ? 1.2178 1.2475 1.1137 0.0884 -0.3861 0.0583 677 ASN A ND2 4821 N N . LYS A 667 ? 1.1146 1.1728 1.0182 0.0410 -0.4428 0.0445 678 LYS A N 4822 C CA . LYS A 667 ? 1.0209 1.0894 0.9130 0.0446 -0.4647 0.0512 678 LYS A CA 4823 C C . LYS A 667 ? 1.0320 1.0678 0.8755 0.0555 -0.4617 0.0503 678 LYS A C 4824 O O . LYS A 667 ? 1.0946 1.0985 0.9044 0.0514 -0.4540 0.0392 678 LYS A O 4825 C CB . LYS A 667 ? 0.9723 1.0510 0.8637 0.0260 -0.4892 0.0452 678 LYS A CB 4826 C CG . LYS A 667 ? 1.3181 1.3647 1.1587 0.0186 -0.5017 0.0346 678 LYS A CG 4827 C CD . LYS A 667 ? 1.4909 1.5424 1.3092 0.0253 -0.5222 0.0408 678 LYS A CD 4828 C CE . LYS A 667 ? 1.2827 1.3117 1.0602 0.0144 -0.5288 0.0285 678 LYS A CE 4829 N NZ . LYS A 667 ? 1.0593 1.0470 0.7924 0.0186 -0.5158 0.0193 678 LYS A NZ 4830 N N . GLU A 668 ? 0.9255 0.9692 0.7653 0.0696 -0.4669 0.0621 679 GLU A N 4831 C CA . GLU A 668 ? 1.4074 1.4215 1.2010 0.0798 -0.4632 0.0629 679 GLU A CA 4832 C C . GLU A 668 ? 1.4071 1.4316 1.1883 0.0879 -0.4831 0.0744 679 GLU A C 4833 O O . GLU A 668 ? 1.3026 1.3502 1.1119 0.0991 -0.4851 0.0876 679 GLU A O 4834 C CB . GLU A 668 ? 0.9278 0.9271 0.7225 0.0933 -0.4356 0.0658 679 GLU A CB 4835 C CG . GLU A 668 ? 1.3297 1.2937 1.0746 0.1001 -0.4266 0.0625 679 GLU A CG 4836 C CD . GLU A 668 ? 1.3284 1.2771 1.0759 0.1098 -0.3978 0.0616 679 GLU A CD 4837 O OE1 . GLU A 668 ? 1.2660 1.1862 0.9751 0.1138 -0.3873 0.0568 679 GLU A OE1 4838 O OE2 . GLU A 668 ? 1.3641 1.3301 1.1520 0.1132 -0.3857 0.0652 679 GLU A OE2 4839 N N . ALA A 669 ? 1.0157 1.0231 0.7545 0.0824 -0.4982 0.0688 680 ALA A N 4840 C CA . ALA A 669 ? 1.3937 1.4088 1.1162 0.0888 -0.5111 0.0782 680 ALA A CA 4841 C C . ALA A 669 ? 1.3003 1.2835 0.9756 0.0990 -0.5006 0.0800 680 ALA A C 4842 O O . ALA A 669 ? 1.0722 1.0264 0.7167 0.0948 -0.4900 0.0681 680 ALA A O 4843 C CB . ALA A 669 ? 1.0719 1.0985 0.7878 0.0735 -0.5278 0.0702 680 ALA A CB 4844 N N . GLY A 670 ? 1.3279 1.3167 0.9977 0.1121 -0.5030 0.0947 681 GLY A N 4845 C CA . GLY A 670 ? 1.1089 1.0688 0.7354 0.1216 -0.4923 0.0985 681 GLY A CA 4846 C C . GLY A 670 ? 1.2804 1.2467 0.8900 0.1292 -0.5016 0.1117 681 GLY A C 4847 O O . GLY A 670 ? 1.1736 1.1687 0.8117 0.1331 -0.5144 0.1222 681 GLY A O 4848 N N . ILE A 671 ? 1.1715 1.1112 0.7342 0.1315 -0.4945 0.1109 682 ILE A N 4849 C CA . ILE A 671 ? 1.2080 1.1490 0.7479 0.1387 -0.5014 0.1238 682 ILE A CA 4850 C C . ILE A 671 ? 1.2985 1.2095 0.8058 0.1496 -0.4838 0.1309 682 ILE A C 4851 O O . ILE A 671 ? 1.2446 1.1298 0.7258 0.1461 -0.4692 0.1196 682 ILE A O 4852 C CB . ILE A 671 ? 1.5155 1.4580 1.0259 0.1268 -0.5141 0.1144 682 ILE A CB 4853 C CG1 . ILE A 671 ? 1.6728 1.6121 1.1521 0.1343 -0.5189 0.1271 682 ILE A CG1 4854 C CG2 . ILE A 671 ? 1.5674 1.4840 1.0471 0.1160 -0.5037 0.0952 682 ILE A CG2 4855 C CD1 . ILE A 671 ? 1.7734 1.7387 1.2809 0.1452 -0.5309 0.1457 682 ILE A CD1 4856 N N . VAL A 672 ? 1.3072 1.2216 0.8168 0.1628 -0.4845 0.1496 683 VAL A N 4857 C CA . VAL A 672 ? 1.4211 1.3070 0.9001 0.1729 -0.4679 0.1584 683 VAL A CA 4858 C C . VAL A 672 ? 1.3932 1.2782 0.8465 0.1788 -0.4753 0.1737 683 VAL A C 4859 O O . VAL A 672 ? 1.3098 1.2163 0.7872 0.1862 -0.4877 0.1876 683 VAL A O 4860 C CB . VAL A 672 ? 1.4353 1.3173 0.9445 0.1858 -0.4540 0.1673 683 VAL A CB 4861 C CG1 . VAL A 672 ? 1.3732 1.2888 0.9359 0.1913 -0.4662 0.1760 683 VAL A CG1 4862 C CG2 . VAL A 672 ? 1.2534 1.1112 0.7361 0.1978 -0.4407 0.1820 683 VAL A CG2 4863 N N . PHE A 673 ? 1.4625 1.3231 0.8671 0.1755 -0.4673 0.1706 684 PHE A N 4864 C CA . PHE A 673 ? 1.5580 1.4134 0.9325 0.1807 -0.4717 0.1853 684 PHE A CA 4865 C C . PHE A 673 ? 1.6186 1.4505 0.9828 0.1929 -0.4541 0.1998 684 PHE A C 4866 O O . PHE A 673 ? 1.5814 1.3875 0.9224 0.1915 -0.4351 0.1927 684 PHE A O 4867 C CB . PHE A 673 ? 1.6236 1.4667 0.9504 0.1697 -0.4718 0.1738 684 PHE A CB 4868 C CG . PHE A 673 ? 1.6920 1.5552 1.0250 0.1571 -0.4883 0.1588 684 PHE A CG 4869 C CD1 . PHE A 673 ? 1.7231 1.6176 1.0897 0.1575 -0.5082 0.1641 684 PHE A CD1 4870 C CD2 . PHE A 673 ? 1.6880 1.5390 0.9945 0.1450 -0.4833 0.1390 684 PHE A CD2 4871 C CE1 . PHE A 673 ? 1.7478 1.6602 1.1199 0.1453 -0.5229 0.1502 684 PHE A CE1 4872 C CE2 . PHE A 673 ? 1.7364 1.6041 1.0490 0.1333 -0.4978 0.1251 684 PHE A CE2 4873 C CZ . PHE A 673 ? 1.7821 1.6800 1.1271 0.1330 -0.5177 0.1308 684 PHE A CZ 4874 N N . LYS A 674 ? 1.6246 1.4653 1.0063 0.2049 -0.4600 0.2198 685 LYS A N 4875 C CA . LYS A 674 ? 1.5883 1.4059 0.9620 0.2166 -0.4439 0.2351 685 LYS A CA 4876 C C . LYS A 674 ? 1.7301 1.5409 1.0731 0.2211 -0.4495 0.2526 685 LYS A C 4877 O O . LYS A 674 ? 1.9041 1.7335 1.2408 0.2178 -0.4681 0.2548 685 LYS A O 4878 C CB . LYS A 674 ? 1.4913 1.3213 0.9168 0.2285 -0.4420 0.2439 685 LYS A CB 4879 C CG . LYS A 674 ? 1.5708 1.4378 1.0367 0.2317 -0.4637 0.2497 685 LYS A CG 4880 C CD . LYS A 674 ? 1.7210 1.6023 1.2409 0.2422 -0.4598 0.2542 685 LYS A CD 4881 C CE . LYS A 674 ? 1.8003 1.7203 1.3611 0.2460 -0.4804 0.2602 685 LYS A CE 4882 N NZ . LYS A 674 ? 1.7451 1.6818 1.3605 0.2559 -0.4756 0.2632 685 LYS A NZ 4883 N N . GLY A 675 ? 1.7224 1.5062 1.0456 0.2284 -0.4332 0.2650 686 GLY A N 4884 C CA . GLY A 675 ? 1.7751 1.5491 1.0672 0.2323 -0.4368 0.2827 686 GLY A CA 4885 C C . GLY A 675 ? 1.7590 1.4971 1.0185 0.2351 -0.4144 0.2909 686 GLY A C 4886 O O . GLY A 675 ? 1.6569 1.3797 0.9301 0.2393 -0.3965 0.2887 686 GLY A O 4887 N N . ASP A 676 ? 1.8025 1.5280 1.0188 0.2325 -0.4150 0.3003 687 ASP A N 4888 C CA . ASP A 676 ? 1.8209 1.5129 1.0027 0.2335 -0.3940 0.3092 687 ASP A CA 4889 C C . ASP A 676 ? 1.7849 1.4585 0.9417 0.2236 -0.3735 0.2896 687 ASP A C 4890 O O . ASP A 676 ? 1.6661 1.3139 0.8110 0.2255 -0.3515 0.2922 687 ASP A O 4891 C CB . ASP A 676 ? 1.8796 1.5654 1.0201 0.2317 -0.4009 0.3234 687 ASP A CB 4892 C CG . ASP A 676 ? 1.8416 1.5458 1.0040 0.2421 -0.4217 0.3431 687 ASP A CG 4893 O OD1 . ASP A 676 ? 1.7978 1.5302 1.0012 0.2459 -0.4379 0.3396 687 ASP A OD1 4894 O OD2 . ASP A 676 ? 1.7705 1.4613 0.9089 0.2462 -0.4217 0.3621 687 ASP A OD2 4895 N N . PHE A 677 ? 1.8180 1.5054 0.9677 0.2131 -0.3808 0.2696 688 PHE A N 4896 C CA . PHE A 677 ? 1.8125 1.4862 0.9404 0.2035 -0.3636 0.2485 688 PHE A CA 4897 C C . PHE A 677 ? 1.7356 1.4056 0.8970 0.2076 -0.3509 0.2392 688 PHE A C 4898 O O . PHE A 677 ? 1.6377 1.2929 0.7840 0.2025 -0.3327 0.2241 688 PHE A O 4899 C CB . PHE A 677 ? 1.8357 1.5271 0.9528 0.1918 -0.3770 0.2295 688 PHE A CB 4900 C CG . PHE A 677 ? 1.8746 1.5944 1.0349 0.1923 -0.3967 0.2234 688 PHE A CG 4901 C CD1 . PHE A 677 ? 1.7275 1.4519 0.9120 0.1885 -0.3924 0.2051 688 PHE A CD1 4902 C CD2 . PHE A 677 ? 1.9645 1.7071 1.1416 0.1963 -0.4190 0.2361 688 PHE A CD2 4903 C CE1 . PHE A 677 ? 1.7398 1.4904 0.9641 0.1876 -0.4098 0.1999 688 PHE A CE1 4904 C CE2 . PHE A 677 ? 1.9627 1.7330 1.1803 0.1958 -0.4361 0.2301 688 PHE A CE2 4905 C CZ . PHE A 677 ? 1.8673 1.6414 1.1085 0.1909 -0.4313 0.2121 688 PHE A CZ 4906 N N . GLY A 678 ? 1.7771 1.4624 0.9848 0.2171 -0.3605 0.2480 689 GLY A N 4907 C CA . GLY A 678 ? 1.7844 1.4709 1.0287 0.2218 -0.3508 0.2400 689 GLY A CA 4908 C C . GLY A 678 ? 1.7832 1.5008 1.0678 0.2200 -0.3702 0.2310 689 GLY A C 4909 O O . GLY A 678 ? 1.7940 1.5329 1.1067 0.2256 -0.3876 0.2428 689 GLY A O 4910 N N . ASN A 679 ? 1.7594 1.4799 1.0469 0.2117 -0.3668 0.2099 690 ASN A N 4911 C CA . ASN A 679 ? 1.6644 1.4130 0.9848 0.2065 -0.3847 0.1991 690 ASN A CA 4912 C C . ASN A 679 ? 1.5717 1.3170 0.8793 0.1943 -0.3803 0.1749 690 ASN A C 4913 O O . ASN A 679 ? 1.5622 1.2855 0.8471 0.1927 -0.3608 0.1654 690 ASN A O 4914 C CB . ASN A 679 ? 1.5511 1.3162 0.9260 0.2162 -0.3871 0.2053 690 ASN A CB 4915 C CG . ASN A 679 ? 1.5603 1.3103 0.9496 0.2205 -0.3617 0.2006 690 ASN A CG 4916 O OD1 . ASN A 679 ? 1.6674 1.4030 1.0580 0.2295 -0.3469 0.2134 690 ASN A OD1 4917 N ND2 . ASN A 679 ? 1.5853 1.3424 0.9929 0.2114 -0.3522 0.1807 690 ASN A ND2 4918 N N . LEU A 680 ? 1.5777 1.3452 0.9002 0.1855 -0.3983 0.1647 691 LEU A N 4919 C CA . LEU A 680 ? 1.5303 1.2968 0.8471 0.1736 -0.3965 0.1416 691 LEU A CA 4920 C C . LEU A 680 ? 1.5087 1.3012 0.8710 0.1702 -0.4113 0.1362 691 LEU A C 4921 O O . LEU A 680 ? 1.5771 1.3929 0.9560 0.1683 -0.4306 0.1422 691 LEU A O 4922 C CB . LEU A 680 ? 1.5427 1.3069 0.8209 0.1627 -0.4031 0.1323 691 LEU A CB 4923 C CG . LEU A 680 ? 1.5019 1.2477 0.7502 0.1538 -0.3885 0.1110 691 LEU A CG 4924 C CD1 . LEU A 680 ? 1.4925 1.2431 0.7132 0.1429 -0.3990 0.1010 691 LEU A CD1 4925 C CD2 . LEU A 680 ? 1.4344 1.1818 0.7095 0.1503 -0.3839 0.0949 691 LEU A CD2 4926 N N . GLU A 681 ? 1.5456 1.3351 0.9280 0.1691 -0.4020 0.1246 692 GLU A N 4927 C CA . GLU A 681 ? 1.5778 1.3916 1.0064 0.1662 -0.4137 0.1209 692 GLU A CA 4928 C C . GLU A 681 ? 1.5514 1.3640 0.9782 0.1525 -0.4146 0.0989 692 GLU A C 4929 O O . GLU A 681 ? 1.5218 1.3150 0.9303 0.1490 -0.3961 0.0855 692 GLU A O 4930 C CB . GLU A 681 ? 1.7045 1.5262 1.1791 0.1747 -0.3955 0.1278 692 GLU A CB 4931 C CG . GLU A 681 ? 1.8777 1.7301 1.4062 0.1732 -0.4060 0.1284 692 GLU A CG 4932 C CD . GLU A 681 ? 1.9585 1.8198 1.5304 0.1837 -0.3893 0.1375 692 GLU A CD 4933 O OE1 . GLU A 681 ? 2.0081 1.8506 1.5677 0.1921 -0.3705 0.1439 692 GLU A OE1 4934 O OE2 . GLU A 681 ? 1.9176 1.8051 1.5359 0.1833 -0.3948 0.1380 692 GLU A OE2 4935 N N . ALA A 682 ? 1.4871 1.3230 0.9384 0.1433 -0.4324 0.0945 693 ALA A N 4936 C CA . ALA A 682 ? 1.3292 1.1648 0.7837 0.1297 -0.4348 0.0749 693 ALA A CA 4937 C C . ALA A 682 ? 1.3564 1.2188 0.8595 0.1252 -0.4470 0.0754 693 ALA A C 4938 O O . ALA A 682 ? 1.3940 1.2810 0.9230 0.1286 -0.4601 0.0882 693 ALA A O 4939 C CB . ALA A 682 ? 1.2454 1.0784 0.6692 0.1185 -0.4439 0.0650 693 ALA A CB 4940 N N . SER A 683 ? 1.3554 1.2141 0.8719 0.1172 -0.4414 0.0611 694 SER A N 4941 C CA . SER A 683 ? 1.2472 1.1315 0.8118 0.1106 -0.4485 0.0604 694 SER A CA 4942 C C . SER A 683 ? 1.2740 1.1500 0.8375 0.0961 -0.4486 0.0416 694 SER A C 4943 O O . SER A 683 ? 1.0733 0.9246 0.6125 0.0946 -0.4334 0.0292 694 SER A O 4944 C CB . SER A 683 ? 1.2243 1.1209 0.8316 0.1201 -0.4295 0.0696 694 SER A CB 4945 O OG . SER A 683 ? 1.1819 1.0568 0.7802 0.1229 -0.4032 0.0617 694 SER A OG 4946 N N . TRP A 684 ? 1.0691 0.9661 0.6593 0.0854 -0.4659 0.0395 695 TRP A N 4947 C CA . TRP A 684 ? 1.2731 1.1638 0.8680 0.0706 -0.4665 0.0234 695 TRP A CA 4948 C C . TRP A 684 ? 1.3127 1.2261 0.9595 0.0670 -0.4613 0.0265 695 TRP A C 4949 O O . TRP A 684 ? 1.3439 1.2870 1.0241 0.0678 -0.4723 0.0375 695 TRP A O 4950 C CB . TRP A 684 ? 1.3468 1.2445 0.9327 0.0566 -0.4821 0.0162 695 TRP A CB 4951 C CG . TRP A 684 ? 1.5402 1.4192 1.0808 0.0576 -0.4806 0.0110 695 TRP A CG 4952 C CD1 . TRP A 684 ? 1.6070 1.4621 1.1174 0.0504 -0.4744 -0.0055 695 TRP A CD1 4953 C CD2 . TRP A 684 ? 1.6243 1.5082 1.1458 0.0666 -0.4850 0.0224 695 TRP A CD2 4954 N NE1 . TRP A 684 ? 1.5923 1.4388 1.0669 0.0539 -0.4744 -0.0055 695 TRP A NE1 4955 C CE2 . TRP A 684 ? 1.6248 1.4881 1.1042 0.0634 -0.4811 0.0118 695 TRP A CE2 4956 C CE3 . TRP A 684 ? 1.6294 1.5333 1.1660 0.0773 -0.4916 0.0408 695 TRP A CE3 4957 C CZ2 . TRP A 684 ? 1.7037 1.5658 1.1545 0.0696 -0.4837 0.0193 695 TRP A CZ2 4958 C CZ3 . TRP A 684 ? 1.6293 1.5303 1.1368 0.0839 -0.4944 0.0486 695 TRP A CZ3 4959 C CH2 . TRP A 684 ? 1.7206 1.6010 1.1850 0.0796 -0.4906 0.0380 695 TRP A CH2 4960 N N . PHE A 685 ? 0.9974 0.8980 0.6517 0.0632 -0.4437 0.0165 696 PHE A N 4961 C CA . PHE A 685 ? 1.2662 1.1875 0.9683 0.0599 -0.4352 0.0193 696 PHE A CA 4962 C C . PHE A 685 ? 1.0927 1.0096 0.8019 0.0431 -0.4401 0.0067 696 PHE A C 4963 O O . PHE A 685 ? 1.0858 0.9762 0.7616 0.0363 -0.4428 -0.0067 696 PHE A O 4964 C CB . PHE A 685 ? 0.9309 0.8464 0.6454 0.0720 -0.4076 0.0222 696 PHE A CB 4965 C CG . PHE A 685 ? 1.2940 1.1758 0.9724 0.0746 -0.3914 0.0101 696 PHE A CG 4966 C CD1 . PHE A 685 ? 1.4588 1.3239 1.1057 0.0861 -0.3831 0.0127 696 PHE A CD1 4967 C CD2 . PHE A 685 ? 1.1652 1.0321 0.8410 0.0656 -0.3847 -0.0039 696 PHE A CD2 4968 C CE1 . PHE A 685 ? 1.4895 1.3262 1.1047 0.0883 -0.3678 0.0007 696 PHE A CE1 4969 C CE2 . PHE A 685 ? 1.2382 1.0759 0.8823 0.0690 -0.3703 -0.0159 696 PHE A CE2 4970 C CZ . PHE A 685 ? 1.3508 1.1745 0.9654 0.0803 -0.3616 -0.0140 696 PHE A CZ 4971 N N . ASN A 686 ? 1.0329 0.9757 0.7858 0.0365 -0.4409 0.0111 697 ASN A N 4972 C CA . ASN A 686 ? 1.0302 0.9709 0.7941 0.0197 -0.4450 0.0014 697 ASN A CA 4973 C C . ASN A 686 ? 1.0773 1.0363 0.8845 0.0192 -0.4287 0.0056 697 ASN A C 4974 O O . ASN A 686 ? 1.0005 0.9925 0.8462 0.0152 -0.4354 0.0140 697 ASN A O 4975 C CB . ASN A 686 ? 1.1439 1.1019 0.9142 0.0056 -0.4719 0.0016 697 ASN A CB 4976 C CG . ASN A 686 ? 1.4429 1.3897 1.2125 -0.0135 -0.4787 -0.0102 697 ASN A CG 4977 O OD1 . ASN A 686 ? 1.4990 1.4393 1.2827 -0.0175 -0.4639 -0.0140 697 ASN A OD1 4978 N ND2 . ASN A 686 ? 1.5423 1.4862 1.2950 -0.0254 -0.5005 -0.0161 697 ASN A ND2 4979 N N . ASN A 687 ? 1.0985 1.0374 0.8993 0.0235 -0.4075 -0.0007 698 ASN A N 4980 C CA . ASN A 687 ? 0.9568 0.9105 0.7948 0.0236 -0.3904 0.0021 698 ASN A CA 4981 C C . ASN A 687 ? 1.0515 0.9974 0.8949 0.0068 -0.3921 -0.0067 698 ASN A C 4982 O O . ASN A 687 ? 1.0449 0.9591 0.8573 0.0028 -0.3904 -0.0185 698 ASN A O 4983 C CB . ASN A 687 ? 0.8147 0.7537 0.6457 0.0388 -0.3654 0.0011 698 ASN A CB 4984 C CG . ASN A 687 ? 1.3387 1.3025 1.2128 0.0443 -0.3488 0.0086 698 ASN A CG 4985 O OD1 . ASN A 687 ? 1.3084 1.2646 1.1830 0.0561 -0.3284 0.0082 698 ASN A OD1 4986 N ND2 . ASN A 687 ? 1.2906 1.2853 1.2015 0.0355 -0.3575 0.0147 698 ASN A ND2 4987 N N . ALA A 688 ? 1.0734 1.0485 0.9564 -0.0028 -0.3951 -0.0010 699 ALA A N 4988 C CA . ALA A 688 ? 0.9504 0.9206 0.8415 -0.0203 -0.3973 -0.0072 699 ALA A CA 4989 C C . ALA A 688 ? 0.9164 0.8985 0.8382 -0.0190 -0.3767 -0.0045 699 ALA A C 4990 O O . ALA A 688 ? 0.7969 0.8141 0.7584 -0.0191 -0.3739 0.0046 699 ALA A O 4991 C CB . ALA A 688 ? 0.8282 0.8216 0.7375 -0.0366 -0.4192 -0.0042 699 ALA A CB 4992 N N . TYR A 689 ? 0.8886 0.8422 0.7918 -0.0176 -0.3627 -0.0131 700 TYR A N 4993 C CA . TYR A 689 ? 0.8546 0.8160 0.7821 -0.0169 -0.3434 -0.0118 700 TYR A CA 4994 C C . TYR A 689 ? 0.9651 0.9305 0.9068 -0.0372 -0.3502 -0.0131 700 TYR A C 4995 O O . TYR A 689 ? 1.0732 1.0196 0.9941 -0.0505 -0.3659 -0.0192 700 TYR A O 4996 C CB . TYR A 689 ? 0.7964 0.7267 0.6978 -0.0053 -0.3255 -0.0204 700 TYR A CB 4997 C CG . TYR A 689 ? 0.9446 0.8683 0.8285 0.0126 -0.3192 -0.0197 700 TYR A CG 4998 C CD1 . TYR A 689 ? 0.9354 0.8785 0.8421 0.0268 -0.3034 -0.0122 700 TYR A CD1 4999 C CD2 . TYR A 689 ? 0.9235 0.8216 0.7678 0.0149 -0.3293 -0.0263 700 TYR A CD2 5000 C CE1 . TYR A 689 ? 0.9573 0.8928 0.8476 0.0421 -0.2976 -0.0106 700 TYR A CE1 5001 C CE2 . TYR A 689 ? 1.0673 0.9594 0.8944 0.0302 -0.3231 -0.0249 700 TYR A CE2 5002 C CZ . TYR A 689 ? 1.0354 0.9457 0.8856 0.0435 -0.3073 -0.0166 700 TYR A CZ 5003 O OH . TYR A 689 ? 1.0370 0.9397 0.8695 0.0577 -0.3009 -0.0143 700 TYR A OH 5004 N N . ARG A 690 ? 0.9656 0.9558 0.9426 -0.0399 -0.3381 -0.0073 701 ARG A N 5005 C CA . ARG A 690 ? 0.9106 0.9094 0.9051 -0.0600 -0.3431 -0.0065 701 ARG A CA 5006 C C . ARG A 690 ? 0.8839 0.8923 0.9005 -0.0583 -0.3219 -0.0043 701 ARG A C 5007 O O . ARG A 690 ? 0.7637 0.7875 0.7963 -0.0427 -0.3059 -0.0008 701 ARG A O 5008 C CB . ARG A 690 ? 0.9832 1.0194 1.0079 -0.0707 -0.3590 0.0014 701 ARG A CB 5009 C CG . ARG A 690 ? 1.2040 1.2562 1.2526 -0.0927 -0.3635 0.0037 701 ARG A CG 5010 C CD . ARG A 690 ? 1.3177 1.4082 1.3953 -0.1025 -0.3803 0.0101 701 ARG A CD 5011 N NE . ARG A 690 ? 1.4499 1.5654 1.5419 -0.0845 -0.3804 0.0161 701 ARG A NE 5012 C CZ . ARG A 690 ? 1.3382 1.4893 1.4673 -0.0748 -0.3681 0.0236 701 ARG A CZ 5013 N NH1 . ARG A 690 ? 1.3629 1.5309 1.5188 -0.0817 -0.3540 0.0256 701 ARG A NH1 5014 N NH2 . ARG A 690 ? 1.1137 1.2827 1.2524 -0.0581 -0.3701 0.0289 701 ARG A NH2 5015 N N . ASP A 691 ? 0.8508 0.8487 0.8667 -0.0744 -0.3221 -0.0066 702 ASP A N 5016 C CA . ASP A 691 ? 0.8949 0.8990 0.9275 -0.0751 -0.3033 -0.0050 702 ASP A CA 5017 C C . ASP A 691 ? 0.8915 0.8724 0.9045 -0.0568 -0.2854 -0.0110 702 ASP A C 5018 O O . ASP A 691 ? 0.9196 0.9176 0.9532 -0.0478 -0.2671 -0.0083 702 ASP A O 5019 C CB . ASP A 691 ? 0.6515 0.7044 0.7313 -0.0753 -0.2955 0.0047 702 ASP A CB 5020 C CG . ASP A 691 ? 0.9700 1.0467 1.0732 -0.0975 -0.3082 0.0098 702 ASP A CG 5021 O OD1 . ASP A 691 ? 0.9926 1.0456 1.0775 -0.1146 -0.3178 0.0064 702 ASP A OD1 5022 O OD2 . ASP A 691 ? 1.0303 1.1494 1.1706 -0.0979 -0.3084 0.0170 702 ASP A OD2 5023 N N . LEU A 692 ? 0.7968 0.7400 0.7706 -0.0516 -0.2906 -0.0200 703 LEU A N 5024 C CA . LEU A 692 ? 0.8368 0.7567 0.7900 -0.0352 -0.2746 -0.0273 703 LEU A CA 5025 C C . LEU A 692 ? 0.8502 0.7609 0.8059 -0.0392 -0.2616 -0.0295 703 LEU A C 5026 O O . LEU A 692 ? 0.9309 0.8286 0.8807 -0.0552 -0.2696 -0.0302 703 LEU A O 5027 C CB . LEU A 692 ? 0.9135 0.7958 0.8239 -0.0304 -0.2840 -0.0376 703 LEU A CB 5028 C CG . LEU A 692 ? 0.9178 0.8074 0.8213 -0.0217 -0.2925 -0.0358 703 LEU A CG 5029 C CD1 . LEU A 692 ? 0.8072 0.6602 0.6673 -0.0192 -0.3025 -0.0467 703 LEU A CD1 5030 C CD2 . LEU A 692 ? 0.6816 0.5901 0.6010 -0.0033 -0.2753 -0.0314 703 LEU A CD2 5031 N N . ILE A 693 ? 0.7982 0.7157 0.7626 -0.0246 -0.2416 -0.0304 704 ILE A N 5032 C CA . ILE A 693 ? 0.7625 0.6771 0.7329 -0.0265 -0.2277 -0.0315 704 ILE A CA 5033 C C . ILE A 693 ? 0.8173 0.6908 0.7512 -0.0200 -0.2242 -0.0430 704 ILE A C 5034 O O . ILE A 693 ? 0.7880 0.6482 0.7046 -0.0044 -0.2177 -0.0501 704 ILE A O 5035 C CB . ILE A 693 ? 0.7852 0.7312 0.7864 -0.0144 -0.2078 -0.0271 704 ILE A CB 5036 C CG1 . ILE A 693 ? 0.7049 0.6933 0.7451 -0.0216 -0.2113 -0.0161 704 ILE A CG1 5037 C CG2 . ILE A 693 ? 0.7255 0.6662 0.7282 -0.0137 -0.1923 -0.0299 704 ILE A CG2 5038 C CD1 . ILE A 693 ? 0.6840 0.7037 0.7542 -0.0071 -0.1945 -0.0124 704 ILE A CD1 5039 N N . VAL A 694 ? 0.6520 0.5054 0.5745 -0.0323 -0.2287 -0.0449 705 VAL A N 5040 C CA . VAL A 694 ? 0.9425 0.7570 0.8317 -0.0262 -0.2264 -0.0559 705 VAL A CA 5041 C C . VAL A 694 ? 0.8946 0.7014 0.7862 -0.0355 -0.2215 -0.0540 705 VAL A C 5042 O O . VAL A 694 ? 0.8855 0.7106 0.7980 -0.0512 -0.2247 -0.0446 705 VAL A O 5043 C CB . VAL A 694 ? 0.9194 0.6999 0.7747 -0.0308 -0.2451 -0.0638 705 VAL A CB 5044 C CG1 . VAL A 694 ? 0.9149 0.6830 0.7670 -0.0522 -0.2608 -0.0604 705 VAL A CG1 5045 C CG2 . VAL A 694 ? 1.0125 0.7581 0.8347 -0.0169 -0.2402 -0.0774 705 VAL A CG2 5046 N N . ARG A 695 ? 0.7754 0.5560 0.6454 -0.0256 -0.2135 -0.0628 706 ARG A N 5047 C CA . ARG A 695 ? 0.7465 0.5153 0.6137 -0.0324 -0.2093 -0.0615 706 ARG A CA 5048 C C . ARG A 695 ? 0.8609 0.5983 0.7068 -0.0494 -0.2279 -0.0618 706 ARG A C 5049 O O . ARG A 695 ? 0.8970 0.6004 0.7125 -0.0458 -0.2382 -0.0717 706 ARG A O 5050 C CB . ARG A 695 ? 0.7076 0.4584 0.5578 -0.0149 -0.1960 -0.0717 706 ARG A CB 5051 C CG . ARG A 695 ? 0.7908 0.5437 0.6477 -0.0171 -0.1851 -0.0685 706 ARG A CG 5052 C CD . ARG A 695 ? 0.6889 0.4052 0.5210 -0.0286 -0.1973 -0.0695 706 ARG A CD 5053 N NE . ARG A 695 ? 0.9971 0.6743 0.7945 -0.0183 -0.2048 -0.0830 706 ARG A NE 5054 C CZ . ARG A 695 ? 1.1605 0.8017 0.9326 -0.0277 -0.2217 -0.0863 706 ARG A CZ 5055 N NH1 . ARG A 695 ? 0.9270 0.5655 0.7041 -0.0487 -0.2328 -0.0765 706 ARG A NH1 5056 N NH2 . ARG A 695 ? 1.2582 0.8664 1.0002 -0.0163 -0.2272 -0.1000 706 ARG A NH2 5057 N N . GLY A 696 ? 0.8687 0.6180 0.7311 -0.0683 -0.2318 -0.0513 707 GLY A N 5058 C CA . GLY A 696 ? 0.9021 0.6228 0.7472 -0.0868 -0.2489 -0.0502 707 GLY A CA 5059 C C . GLY A 696 ? 0.8702 0.6037 0.7332 -0.1053 -0.2464 -0.0385 707 GLY A C 5060 O O . GLY A 696 ? 0.9709 0.7257 0.8511 -0.1010 -0.2303 -0.0337 707 GLY A O 5061 N N . TYR A 697 ? 0.7851 0.5061 0.6438 -0.1265 -0.2623 -0.0341 708 TYR A N 5062 C CA . TYR A 697 ? 0.8313 0.5627 0.7052 -0.1472 -0.2612 -0.0225 708 TYR A CA 5063 C C . TYR A 697 ? 0.9326 0.6934 0.8319 -0.1665 -0.2713 -0.0145 708 TYR A C 5064 O O . TYR A 697 ? 0.8100 0.5650 0.7029 -0.1691 -0.2862 -0.0188 708 TYR A O 5065 C CB . TYR A 697 ? 0.9163 0.5996 0.7592 -0.1584 -0.2716 -0.0241 708 TYR A CB 5066 C CG . TYR A 697 ? 0.9109 0.5681 0.7332 -0.1454 -0.2613 -0.0280 708 TYR A CG 5067 C CD1 . TYR A 697 ? 0.9999 0.6657 0.8313 -0.1528 -0.2502 -0.0185 708 TYR A CD1 5068 C CD2 . TYR A 697 ? 0.8575 0.4812 0.6504 -0.1264 -0.2634 -0.0413 708 TYR A CD2 5069 C CE1 . TYR A 697 ? 0.8306 0.4723 0.6421 -0.1408 -0.2420 -0.0220 708 TYR A CE1 5070 C CE2 . TYR A 697 ? 1.0244 0.6250 0.7990 -0.1142 -0.2551 -0.0455 708 TYR A CE2 5071 C CZ . TYR A 697 ? 1.0157 0.6252 0.7995 -0.1212 -0.2449 -0.0357 708 TYR A CZ 5072 O OH . TYR A 697 ? 0.9996 0.5864 0.7645 -0.1086 -0.2376 -0.0398 708 TYR A OH 5073 N N . GLU A 698 ? 0.8673 0.6604 0.7950 -0.1804 -0.2635 -0.0032 709 GLU A N 5074 C CA . GLU A 698 ? 0.8415 0.6604 0.7928 -0.2027 -0.2736 0.0047 709 GLU A CA 5075 C C . GLU A 698 ? 0.8493 0.6278 0.7761 -0.2237 -0.2908 0.0047 709 GLU A C 5076 O O . GLU A 698 ? 0.8580 0.5998 0.7600 -0.2253 -0.2895 0.0040 709 GLU A O 5077 C CB . GLU A 698 ? 0.8539 0.7173 0.8410 -0.2118 -0.2590 0.0158 709 GLU A CB 5078 C CG . GLU A 698 ? 1.1723 1.0705 1.1895 -0.2339 -0.2673 0.0237 709 GLU A CG 5079 C CD . GLU A 698 ? 1.2964 1.2489 1.3545 -0.2354 -0.2509 0.0319 709 GLU A CD 5080 O OE1 . GLU A 698 ? 1.1366 1.1031 1.2017 -0.2157 -0.2341 0.0302 709 GLU A OE1 5081 O OE2 . GLU A 698 ? 1.3934 1.3753 1.4770 -0.2564 -0.2547 0.0394 709 GLU A OE2 5082 N N . ALA A 699 ? 0.9245 0.7085 0.8577 -0.2392 -0.3075 0.0052 710 ALA A N 5083 C CA . ALA A 699 ? 0.9205 0.6651 0.8306 -0.2597 -0.3249 0.0041 710 ALA A CA 5084 C C . ALA A 699 ? 1.0055 0.7766 0.9416 -0.2882 -0.3327 0.0135 710 ALA A C 5085 O O . ALA A 699 ? 1.0320 0.8502 1.0011 -0.2903 -0.3318 0.0171 710 ALA A O 5086 C CB . ALA A 699 ? 0.9422 0.6535 0.8237 -0.2513 -0.3414 -0.0084 710 ALA A CB 5087 N N . GLN A 700 ? 0.9497 0.6902 0.8711 -0.3100 -0.3403 0.0173 711 GLN A N 5088 C CA . GLN A 700 ? 1.0533 0.8140 0.9963 -0.3400 -0.3484 0.0256 711 GLN A CA 5089 C C . GLN A 700 ? 1.1259 0.8343 1.0389 -0.3598 -0.3652 0.0236 711 GLN A C 5090 O O . GLN A 700 ? 1.2036 0.8629 1.0823 -0.3523 -0.3658 0.0196 711 GLN A O 5091 C CB . GLN A 700 ? 1.1169 0.9135 1.0880 -0.3508 -0.3310 0.0384 711 GLN A CB 5092 C CG . GLN A 700 ? 1.2385 0.9996 1.1859 -0.3532 -0.3217 0.0431 711 GLN A CG 5093 C CD . GLN A 700 ? 1.3195 1.1175 1.2938 -0.3664 -0.3050 0.0560 711 GLN A CD 5094 O OE1 . GLN A 700 ? 1.2848 1.1350 1.2970 -0.3761 -0.3010 0.0611 711 GLN A OE1 5095 N NE2 . GLN A 700 ? 1.3626 1.1345 1.3173 -0.3664 -0.2952 0.0610 711 GLN A NE2 5096 N N . ILE A 701 ? 1.2580 0.9771 1.1844 -0.3848 -0.3793 0.0260 712 ILE A N 5097 C CA . ILE A 701 ? 1.3166 0.9877 1.2171 -0.4062 -0.3965 0.0239 712 ILE A CA 5098 C C . ILE A 701 ? 1.2445 0.9263 1.1616 -0.4376 -0.3938 0.0370 712 ILE A C 5099 O O . ILE A 701 ? 1.2321 0.9577 1.1822 -0.4547 -0.3957 0.0419 712 ILE A O 5100 C CB . ILE A 701 ? 1.4181 1.0880 1.3158 -0.4082 -0.4146 0.0145 712 ILE A CB 5101 C CG1 . ILE A 701 ? 1.5230 1.1897 1.4082 -0.3804 -0.4183 0.0025 712 ILE A CG1 5102 C CG2 . ILE A 701 ? 1.3842 1.0061 1.2527 -0.4170 -0.4229 0.0113 712 ILE A CG2 5103 C CD1 . ILE A 701 ? 1.6492 1.3204 1.5317 -0.3772 -0.4320 -0.0063 712 ILE A CD1 5104 N N . LYS A 702 ? 1.3359 0.9788 1.2299 -0.4436 -0.3883 0.0425 713 LYS A N 5105 C CA . LYS A 702 ? 1.5499 1.2026 1.4566 -0.4697 -0.3808 0.0563 713 LYS A CA 5106 C C . LYS A 702 ? 1.7411 1.3677 1.6353 -0.4879 -0.3906 0.0570 713 LYS A C 5107 O O . LYS A 702 ? 1.8281 1.4890 1.7494 -0.5084 -0.3917 0.0619 713 LYS A O 5108 C CB . LYS A 702 ? 1.5544 1.1835 1.4437 -0.4655 -0.3670 0.0640 713 LYS A CB 5109 C CG . LYS A 702 ? 1.5078 1.1931 1.4309 -0.4656 -0.3452 0.0748 713 LYS A CG 5110 C CD . LYS A 702 ? 1.4186 1.0857 1.3227 -0.4478 -0.3290 0.0784 713 LYS A CD 5111 C CE . LYS A 702 ? 1.4610 1.0655 1.3268 -0.4603 -0.3354 0.0830 713 LYS A CE 5112 N NZ . LYS A 702 ? 1.4965 1.0803 1.3408 -0.4397 -0.3218 0.0847 713 LYS A NZ 5113 N N . ASP A 703 ? 1.7392 1.3067 1.5938 -0.4798 -0.3975 0.0515 714 ASP A N 5114 C CA . ASP A 703 ? 1.7161 1.2548 1.5570 -0.4962 -0.4071 0.0517 714 ASP A CA 5115 C C . ASP A 703 ? 1.6153 1.1203 1.4311 -0.4803 -0.4213 0.0368 714 ASP A C 5116 O O . ASP A 703 ? 1.6093 1.0634 1.3928 -0.4766 -0.4265 0.0337 714 ASP A O 5117 C CB . ASP A 703 ? 1.6576 1.1557 1.4748 -0.5062 -0.4016 0.0616 714 ASP A CB 5118 N N . GLY A 704 ? 1.5625 1.0975 1.3938 -0.4705 -0.4272 0.0278 715 GLY A N 5119 C CA . GLY A 704 ? 1.5290 1.0381 1.3383 -0.4546 -0.4394 0.0134 715 GLY A CA 5120 C C . GLY A 704 ? 1.5651 1.0570 1.3539 -0.4240 -0.4364 0.0042 715 GLY A C 5121 O O . GLY A 704 ? 1.5439 1.0466 1.3323 -0.4084 -0.4419 -0.0062 715 GLY A O 5122 N N . LYS A 705 ? 1.5440 1.0096 1.3153 -0.4153 -0.4272 0.0082 716 LYS A N 5123 C CA . LYS A 705 ? 1.4595 0.9082 1.2112 -0.3860 -0.4227 -0.0006 716 LYS A CA 5124 C C . LYS A 705 ? 1.4234 0.9141 1.1996 -0.3789 -0.4128 0.0024 716 LYS A C 5125 O O . LYS A 705 ? 1.4010 0.9179 1.1997 -0.3944 -0.4045 0.0143 716 LYS A O 5126 C CB . LYS A 705 ? 1.3946 0.7942 1.1148 -0.3778 -0.4183 0.0009 716 LYS A CB 5127 N N . GLU A 706 ? 1.1749 0.6732 0.9473 -0.3556 -0.4131 -0.0083 717 GLU A N 5128 C CA . GLU A 706 ? 1.4324 0.9667 1.2254 -0.3461 -0.4041 -0.0067 717 GLU A CA 5129 C C . GLU A 706 ? 1.3924 0.9028 1.1677 -0.3308 -0.3913 -0.0060 717 GLU A C 5130 O O . GLU A 706 ? 1.2815 0.7443 1.0249 -0.3236 -0.3934 -0.0101 717 GLU A O 5131 C CB . GLU A 706 ? 1.4666 1.0194 1.2621 -0.3266 -0.4085 -0.0178 717 GLU A CB 5132 C CG . GLU A 706 ? 1.5848 1.1012 1.3464 -0.2985 -0.4071 -0.0310 717 GLU A CG 5133 C CD . GLU A 706 ? 1.7409 1.2803 1.5069 -0.2796 -0.4085 -0.0400 717 GLU A CD 5134 O OE1 . GLU A 706 ? 1.6565 1.2431 1.4537 -0.2842 -0.4073 -0.0345 717 GLU A OE1 5135 O OE2 . GLU A 706 ? 1.8788 1.3935 1.6190 -0.2574 -0.4072 -0.0513 717 GLU A OE2 5136 N N . GLU A 707 ? 1.3418 0.8941 1.1412 -0.3191 -0.3720 0.0007 718 GLU A N 5137 C CA . GLU A 707 ? 1.2385 0.7777 1.0255 -0.3020 -0.3563 0.0021 718 GLU A CA 5138 C C . GLU A 707 ? 1.1367 0.7241 0.9492 -0.2816 -0.3375 0.0031 718 GLU A C 5139 O O . GLU A 707 ? 1.1453 0.7805 0.9901 -0.2854 -0.3346 0.0069 718 GLU A O 5140 C CB . GLU A 707 ? 1.3410 0.8688 1.1272 -0.3222 -0.3512 0.0153 718 GLU A CB 5141 C CG . GLU A 707 ? 1.3829 0.9631 1.2081 -0.3427 -0.3426 0.0291 718 GLU A CG 5142 C CD . GLU A 707 ? 1.4445 1.0114 1.2657 -0.3638 -0.3373 0.0424 718 GLU A CD 5143 O OE1 . GLU A 707 ? 1.5136 1.0259 1.3007 -0.3665 -0.3446 0.0416 718 GLU A OE1 5144 O OE2 . GLU A 707 ? 1.3641 0.9751 1.2160 -0.3776 -0.3259 0.0537 718 GLU A OE2 5145 N N . ALA A 708 ? 1.0672 0.6416 0.8653 -0.2597 -0.3252 -0.0007 719 ALA A N 5146 C CA . ALA A 708 ? 1.0519 0.6682 0.8725 -0.2404 -0.3061 0.0001 719 ALA A CA 5147 C C . ALA A 708 ? 0.9322 0.5793 0.7764 -0.2514 -0.2908 0.0137 719 ALA A C 5148 O O . ALA A 708 ? 1.7026 1.3244 1.5320 -0.2623 -0.2898 0.0200 719 ALA A O 5149 C CB . ALA A 708 ? 0.9386 0.5297 0.7347 -0.2128 -0.2992 -0.0109 719 ALA A CB 5150 N N . LYS A 709 ? 0.8989 0.6003 0.7791 -0.2485 -0.2790 0.0182 720 LYS A N 5151 C CA . LYS A 709 ? 1.1555 0.8909 1.0594 -0.2546 -0.2617 0.0292 720 LYS A CA 5152 C C . LYS A 709 ? 1.1139 0.8799 1.0329 -0.2291 -0.2436 0.0252 720 LYS A C 5153 O O . LYS A 709 ? 1.1142 0.8909 1.0381 -0.2123 -0.2447 0.0170 720 LYS A O 5154 C CB . LYS A 709 ? 1.1878 0.9645 1.1259 -0.2790 -0.2635 0.0393 720 LYS A CB 5155 C CG . LYS A 709 ? 1.1821 0.9999 1.1490 -0.2733 -0.2665 0.0360 720 LYS A CG 5156 C CD . LYS A 709 ? 1.2520 1.1203 1.2586 -0.2939 -0.2631 0.0463 720 LYS A CD 5157 C CE . LYS A 709 ? 1.2576 1.1576 1.2841 -0.2927 -0.2416 0.0541 720 LYS A CE 5158 N NZ . LYS A 709 ? 1.2842 1.2370 1.3513 -0.3119 -0.2373 0.0630 720 LYS A NZ 5159 N N . GLY A 710 ? 1.1655 0.9445 1.0908 -0.2265 -0.2270 0.0308 721 GLY A N 5160 C CA . GLY A 710 ? 0.7733 0.5825 0.7145 -0.2039 -0.2088 0.0272 721 GLY A CA 5161 C C . GLY A 710 ? 0.8286 0.6043 0.7409 -0.1793 -0.2060 0.0158 721 GLY A C 5162 O O . GLY A 710 ? 0.8579 0.5857 0.7364 -0.1796 -0.2165 0.0117 721 GLY A O 5163 N N . ASP A 711 ? 0.8066 0.6081 0.7332 -0.1579 -0.1919 0.0102 722 ASP A N 5164 C CA . ASP A 711 ? 0.7763 0.5533 0.6800 -0.1338 -0.1866 -0.0011 722 ASP A CA 5165 C C . ASP A 711 ? 0.8513 0.6197 0.7478 -0.1198 -0.1947 -0.0118 722 ASP A C 5166 O O . ASP A 711 ? 0.8235 0.6123 0.7373 -0.1263 -0.2017 -0.0097 722 ASP A O 5167 C CB . ASP A 711 ? 0.8835 0.6936 0.8067 -0.1191 -0.1650 -0.0014 722 ASP A CB 5168 C CG . ASP A 711 ? 0.9568 0.7796 0.8877 -0.1321 -0.1555 0.0091 722 ASP A CG 5169 O OD1 . ASP A 711 ? 0.8593 0.6485 0.7659 -0.1441 -0.1632 0.0133 722 ASP A OD1 5170 O OD2 . ASP A 711 ? 1.1697 1.0358 1.1302 -0.1304 -0.1402 0.0130 722 ASP A OD2 5171 N N . PRO A 712 ? 0.9621 0.7006 0.8326 -0.1007 -0.1939 -0.0235 723 PRO A N 5172 C CA . PRO A 712 ? 0.7136 0.4510 0.5800 -0.0852 -0.1971 -0.0337 723 PRO A CA 5173 C C . PRO A 712 ? 0.7004 0.4852 0.6005 -0.0754 -0.1827 -0.0317 723 PRO A C 5174 O O . PRO A 712 ? 0.7267 0.5292 0.6380 -0.0646 -0.1658 -0.0322 723 PRO A O 5175 C CB . PRO A 712 ? 0.7578 0.4620 0.5949 -0.0659 -0.1937 -0.0460 723 PRO A CB 5176 C CG . PRO A 712 ? 0.8496 0.5235 0.6669 -0.0754 -0.1981 -0.0426 723 PRO A CG 5177 C CD . PRO A 712 ? 0.9256 0.6282 0.7674 -0.0934 -0.1921 -0.0280 723 PRO A CD 5178 N N . ALA A 713 ? 0.7225 0.5273 0.6385 -0.0790 -0.1896 -0.0297 724 ALA A N 5179 C CA . ALA A 713 ? 0.8303 0.6799 0.7799 -0.0709 -0.1775 -0.0265 724 ALA A CA 5180 C C . ALA A 713 ? 0.8030 0.6569 0.7532 -0.0627 -0.1851 -0.0308 724 ALA A C 5181 O O . ALA A 713 ? 0.9165 0.7434 0.8443 -0.0671 -0.2012 -0.0348 724 ALA A O 5182 C CB . ALA A 713 ? 0.7906 0.6771 0.7728 -0.0886 -0.1753 -0.0141 724 ALA A CB 5183 N N . TYR A 714 ? 0.7583 0.6456 0.7336 -0.0507 -0.1737 -0.0298 725 TYR A N 5184 C CA . TYR A 714 ? 0.7427 0.6389 0.7222 -0.0439 -0.1806 -0.0312 725 TYR A CA 5185 C C . TYR A 714 ? 0.6320 0.5573 0.6376 -0.0599 -0.1909 -0.0212 725 TYR A C 5186 O O . TYR A 714 ? 0.8109 0.7736 0.8496 -0.0635 -0.1820 -0.0138 725 TYR A O 5187 C CB . TYR A 714 ? 0.5656 0.4811 0.5586 -0.0233 -0.1641 -0.0346 725 TYR A CB 5188 C CG . TYR A 714 ? 0.7514 0.6374 0.7167 -0.0071 -0.1565 -0.0463 725 TYR A CG 5189 C CD1 . TYR A 714 ? 0.7120 0.6016 0.6810 0.0020 -0.1394 -0.0497 725 TYR A CD1 5190 C CD2 . TYR A 714 ? 0.8269 0.6827 0.7622 -0.0011 -0.1665 -0.0546 725 TYR A CD2 5191 C CE1 . TYR A 714 ? 0.7214 0.5860 0.6665 0.0167 -0.1327 -0.0611 725 TYR A CE1 5192 C CE2 . TYR A 714 ? 0.7454 0.5764 0.6566 0.0135 -0.1592 -0.0661 725 TYR A CE2 5193 C CZ . TYR A 714 ? 0.7576 0.5934 0.6744 0.0223 -0.1425 -0.0694 725 TYR A CZ 5194 O OH . TYR A 714 ? 0.8508 0.6639 0.7449 0.0369 -0.1357 -0.0816 725 TYR A OH 5195 N N . LEU A 715 ? 0.7558 0.6647 0.7465 -0.0694 -0.2100 -0.0219 726 LEU A N 5196 C CA . LEU A 715 ? 0.8402 0.7744 0.8533 -0.0863 -0.2223 -0.0134 726 LEU A CA 5197 C C . LEU A 715 ? 0.7523 0.6864 0.7597 -0.0821 -0.2365 -0.0155 726 LEU A C 5198 O O . LEU A 715 ? 0.7173 0.6225 0.6955 -0.0709 -0.2402 -0.0239 726 LEU A O 5199 C CB . LEU A 715 ? 0.6626 0.5776 0.6647 -0.1090 -0.2344 -0.0107 726 LEU A CB 5200 C CG . LEU A 715 ? 0.8296 0.7381 0.8308 -0.1153 -0.2228 -0.0079 726 LEU A CG 5201 C CD1 . LEU A 715 ? 0.7357 0.6167 0.7196 -0.1374 -0.2366 -0.0055 726 LEU A CD1 5202 C CD2 . LEU A 715 ? 0.7375 0.6936 0.7786 -0.1173 -0.2081 0.0005 726 LEU A CD2 5203 N N . ASN A 716 ? 0.6710 0.6388 0.7063 -0.0911 -0.2443 -0.0080 727 ASN A N 5204 C CA . ASN A 716 ? 0.7791 0.7476 0.8088 -0.0909 -0.2610 -0.0088 727 ASN A CA 5205 C C . ASN A 716 ? 0.8661 0.8003 0.8670 -0.1067 -0.2798 -0.0131 727 ASN A C 5206 O O . ASN A 716 ? 0.9074 0.8455 0.9171 -0.1271 -0.2873 -0.0087 727 ASN A O 5207 C CB . ASN A 716 ? 0.6425 0.6579 0.7117 -0.0972 -0.2651 0.0004 727 ASN A CB 5208 C CG . ASN A 716 ? 0.8218 0.8718 0.9221 -0.0824 -0.2466 0.0045 727 ASN A CG 5209 O OD1 . ASN A 716 ? 0.5916 0.6706 0.7214 -0.0897 -0.2373 0.0101 727 ASN A OD1 5210 N ND2 . ASN A 716 ? 0.8394 0.8863 0.9331 -0.0620 -0.2407 0.0015 727 ASN A ND2 5211 N N . ALA A 717 ? 0.7982 0.6985 0.7646 -0.0978 -0.2871 -0.0221 728 ALA A N 5212 C CA . ALA A 717 ? 0.8592 0.7209 0.7944 -0.1104 -0.3029 -0.0285 728 ALA A CA 5213 C C . ALA A 717 ? 0.8706 0.7225 0.7884 -0.1114 -0.3219 -0.0331 728 ALA A C 5214 O O . ALA A 717 ? 0.9891 0.8246 0.8949 -0.1281 -0.3391 -0.0352 728 ALA A O 5215 C CB . ALA A 717 ? 0.7508 0.5726 0.6548 -0.1009 -0.2945 -0.0376 728 ALA A CB 5216 N N . GLN A 718 ? 0.9490 0.7923 0.6767 -0.1159 -0.3082 0.0476 729 GLN A N 5217 C CA . GLN A 718 ? 0.9830 0.7890 0.6733 -0.1076 -0.3158 0.0410 729 GLN A CA 5218 C C . GLN A 718 ? 0.9825 0.7813 0.6601 -0.1043 -0.3199 0.0409 729 GLN A C 5219 O O . GLN A 718 ? 1.0129 0.8325 0.7059 -0.1044 -0.3098 0.0447 729 GLN A O 5220 C CB . GLN A 718 ? 0.9730 0.7657 0.6396 -0.0973 -0.2992 0.0353 729 GLN A CB 5221 C CG . GLN A 718 ? 0.9876 0.7450 0.6263 -0.0914 -0.3071 0.0300 729 GLN A CG 5222 C CD . GLN A 718 ? 1.1613 0.9113 0.7811 -0.0797 -0.2882 0.0277 729 GLN A CD 5223 O OE1 . GLN A 718 ? 1.4308 1.1473 1.0182 -0.0699 -0.2896 0.0221 729 GLN A OE1 5224 N NE2 . GLN A 718 ? 0.8924 0.6738 0.5310 -0.0810 -0.2702 0.0327 729 GLN A NE2 5225 N N . SER A 719 ? 1.0297 0.7973 0.6774 -0.1012 -0.3342 0.0368 730 SER A N 5226 C CA . SER A 719 ? 0.9709 0.7295 0.6014 -0.0970 -0.3383 0.0372 730 SER A CA 5227 C C . SER A 719 ? 0.9724 0.6974 0.5599 -0.0866 -0.3359 0.0278 730 SER A C 5228 O O . SER A 719 ? 0.9941 0.6955 0.5621 -0.0844 -0.3388 0.0215 730 SER A O 5229 C CB . SER A 719 ? 1.0850 0.8437 0.7223 -0.1065 -0.3622 0.0444 730 SER A CB 5230 O OG . SER A 719 ? 1.2690 0.9965 0.8811 -0.1107 -0.3803 0.0392 730 SER A OG 5231 N N . ALA A 720 ? 1.2820 1.0046 0.8545 -0.0792 -0.3295 0.0277 731 ALA A N 5232 C CA . ALA A 720 ? 1.2624 0.9560 0.7936 -0.0685 -0.3269 0.0200 731 ALA A CA 5233 C C . ALA A 720 ? 1.2766 0.9705 0.7963 -0.0644 -0.3286 0.0232 731 ALA A C 5234 O O . ALA A 720 ? 1.2693 0.9875 0.8133 -0.0654 -0.3212 0.0308 731 ALA A O 5235 C CB . ALA A 720 ? 1.0031 0.6976 0.5273 -0.0585 -0.3049 0.0163 731 ALA A CB 5236 N N . ARG A 721 ? 1.4347 1.1010 0.9165 -0.0597 -0.3377 0.0178 732 ARG A N 5237 C CA . ARG A 721 ? 1.4294 1.0964 0.8981 -0.0557 -0.3400 0.0218 732 ARG A CA 5238 C C . ARG A 721 ? 1.3262 0.9737 0.7579 -0.0418 -0.3289 0.0148 732 ARG A C 5239 O O . ARG A 721 ? 1.1535 0.7760 0.5579 -0.0363 -0.3274 0.0057 732 ARG A O 5240 C CB . ARG A 721 ? 1.5061 1.1649 0.9657 -0.0662 -0.3655 0.0256 732 ARG A CB 5241 C CG . ARG A 721 ? 1.7351 1.3564 1.1560 -0.0696 -0.3810 0.0149 732 ARG A CG 5242 C CD . ARG A 721 ? 1.8203 1.4368 1.2355 -0.0848 -0.4084 0.0204 732 ARG A CD 5243 N NE . ARG A 721 ? 1.8439 1.4780 1.2612 -0.0849 -0.4127 0.0312 732 ARG A NE 5244 C CZ . ARG A 721 ? 1.7880 1.4549 1.2418 -0.0921 -0.4184 0.0471 732 ARG A CZ 5245 N NH1 . ARG A 721 ? 1.8087 1.4909 1.2636 -0.0905 -0.4209 0.0582 732 ARG A NH1 5246 N NH2 . ARG A 721 ? 1.6303 1.3159 1.1202 -0.0999 -0.4210 0.0533 732 ARG A NH2 5247 N N . ILE A 722 ? 1.2929 0.9523 0.7245 -0.0352 -0.3200 0.0202 733 ILE A N 5248 C CA . ILE A 722 ? 1.2355 0.8813 0.6346 -0.0218 -0.3094 0.0161 733 ILE A CA 5249 C C . ILE A 722 ? 1.2942 0.9405 0.6790 -0.0197 -0.3173 0.0215 733 ILE A C 5250 O O . ILE A 722 ? 1.2658 0.9337 0.6767 -0.0244 -0.3192 0.0319 733 ILE A O 5251 C CB . ILE A 722 ? 1.3067 0.9690 0.7194 -0.0139 -0.2850 0.0184 733 ILE A CB 5252 C CG1 . ILE A 722 ? 1.4768 1.1671 0.9264 -0.0192 -0.2774 0.0278 733 ILE A CG1 5253 C CG2 . ILE A 722 ? 1.2059 0.8667 0.6250 -0.0143 -0.2767 0.0139 733 ILE A CG2 5254 C CD1 . ILE A 722 ? 1.7107 1.4072 1.1544 -0.0117 -0.2692 0.0341 733 ILE A CD1 5255 N N . THR A 723 ? 1.4596 1.0825 0.8026 -0.0121 -0.3211 0.0151 734 THR A N 5256 C CA . THR A 723 ? 1.4267 1.0512 0.7526 -0.0096 -0.3278 0.0205 734 THR A CA 5257 C C . THR A 723 ? 1.4312 1.0533 0.7358 0.0063 -0.3105 0.0194 734 THR A C 5258 O O . THR A 723 ? 1.1943 0.8062 0.4871 0.0151 -0.2974 0.0129 734 THR A O 5259 C CB . THR A 723 ? 1.4277 1.0268 0.7175 -0.0166 -0.3506 0.0145 734 THR A CB 5260 O OG1 . THR A 723 ? 1.4755 1.0411 0.7240 -0.0082 -0.3471 0.0005 734 THR A OG1 5261 C CG2 . THR A 723 ? 1.4579 1.0593 0.7676 -0.0338 -0.3695 0.0168 734 THR A CG2 5262 N N . GLY A 724 ? 1.1970 0.8308 0.4983 0.0103 -0.3103 0.0278 735 GLY A N 5263 C CA . GLY A 724 ? 1.2801 0.9138 0.5612 0.0251 -0.2955 0.0287 735 GLY A CA 5264 C C . GLY A 724 ? 1.3094 0.9559 0.5856 0.0285 -0.2982 0.0390 735 GLY A C 5265 O O . GLY A 724 ? 1.2153 0.8716 0.5027 0.0194 -0.3124 0.0466 735 GLY A O 5266 N N . ILE A 725 ? 1.2924 0.9418 0.5538 0.0419 -0.2839 0.0414 736 ILE A N 5267 C CA . ILE A 725 ? 1.3095 0.9706 0.5622 0.0475 -0.2850 0.0513 736 ILE A CA 5268 C C . ILE A 725 ? 1.2425 0.9221 0.5123 0.0570 -0.2642 0.0609 736 ILE A C 5269 O O . ILE A 725 ? 1.1954 0.8719 0.4611 0.0640 -0.2496 0.0572 736 ILE A O 5270 C CB . ILE A 725 ? 1.3598 0.9995 0.5606 0.0546 -0.2936 0.0435 736 ILE A CB 5271 C CG1 . ILE A 725 ? 1.4923 1.1476 0.6837 0.0617 -0.2927 0.0548 736 ILE A CG1 5272 C CG2 . ILE A 725 ? 1.3537 0.9738 0.5274 0.0670 -0.2806 0.0328 736 ILE A CG2 5273 C CD1 . ILE A 725 ? 1.7143 1.3878 0.9253 0.0507 -0.3072 0.0670 736 ILE A CD1 5274 N N . ASN A 726 ? 1.2204 0.9198 0.5105 0.0566 -0.2629 0.0746 737 ASN A N 5275 C CA . ASN A 726 ? 1.2645 0.9792 0.5679 0.0646 -0.2449 0.0848 737 ASN A CA 5276 C C . ASN A 726 ? 1.3811 1.1070 0.6732 0.0717 -0.2477 0.0963 737 ASN A C 5277 O O . ASN A 726 ? 1.2297 0.9640 0.5298 0.0665 -0.2598 0.1041 737 ASN A O 5278 C CB . ASN A 726 ? 1.3265 1.0545 0.6739 0.0572 -0.2346 0.0918 737 ASN A CB 5279 C CG . ASN A 726 ? 1.5629 1.2854 0.9212 0.0524 -0.2252 0.0827 737 ASN A CG 5280 O OD1 . ASN A 726 ? 1.6560 1.3721 0.9954 0.0582 -0.2178 0.0770 737 ASN A OD1 5281 N ND2 . ASN A 726 ? 1.5944 1.3215 0.9837 0.0421 -0.2249 0.0829 737 ASN A ND2 5282 N N . ILE A 727 ? 1.4640 1.1926 0.7383 0.0836 -0.2365 0.0993 738 ILE A N 5283 C CA . ILE A 727 ? 1.3856 1.1288 0.6533 0.0911 -0.2364 0.1124 738 ILE A CA 5284 C C . ILE A 727 ? 1.3769 1.1356 0.6694 0.0953 -0.2178 0.1247 738 ILE A C 5285 O O . ILE A 727 ? 1.3532 1.1095 0.6434 0.0988 -0.2048 0.1218 738 ILE A O 5286 C CB . ILE A 727 ? 1.3335 1.0677 0.5540 0.1025 -0.2402 0.1071 738 ILE A CB 5287 C CG1 . ILE A 727 ? 1.3000 1.0100 0.4888 0.0977 -0.2566 0.0912 738 ILE A CG1 5288 C CG2 . ILE A 727 ? 1.3221 1.0742 0.5367 0.1082 -0.2434 0.1212 738 ILE A CG2 5289 C CD1 . ILE A 727 ? 1.3083 1.0220 0.5023 0.0854 -0.2762 0.0944 738 ILE A CD1 5290 N N . LEU A 728 ? 1.3099 1.0846 0.6263 0.0943 -0.2166 0.1398 739 LEU A N 5291 C CA . LEU A 728 ? 1.3603 1.1464 0.6991 0.0971 -0.1996 0.1523 739 LEU A CA 5292 C C . LEU A 728 ? 1.4086 1.2121 0.7538 0.1028 -0.2009 0.1699 739 LEU A C 5293 O O . LEU A 728 ? 1.5021 1.3128 0.8613 0.0991 -0.2101 0.1772 739 LEU A O 5294 C CB . LEU A 728 ? 1.4142 1.1974 0.7895 0.0868 -0.1904 0.1522 739 LEU A CB 5295 C CG . LEU A 728 ? 1.4725 1.2625 0.8716 0.0869 -0.1733 0.1650 739 LEU A CG 5296 C CD1 . LEU A 728 ? 1.4206 1.2123 0.8040 0.0915 -0.1624 0.1658 739 LEU A CD1 5297 C CD2 . LEU A 728 ? 1.4142 1.1966 0.8445 0.0764 -0.1645 0.1627 739 LEU A CD2 5298 N N . GLY A 729 ? 1.4401 1.2530 0.7769 0.1118 -0.1914 0.1789 740 GLY A N 5299 C CA . GLY A 729 ? 1.5199 1.3513 0.8641 0.1178 -0.1913 0.1973 740 GLY A CA 5300 C C . GLY A 729 ? 1.5552 1.3965 0.9039 0.1244 -0.1764 0.2095 740 GLY A C 5301 O O . GLY A 729 ? 1.5421 1.3783 0.8801 0.1259 -0.1676 0.2040 740 GLY A O 5302 N N . LYS A 730 ? 1.5647 1.4222 0.9307 0.1280 -0.1738 0.2282 741 LYS A N 5303 C CA . LYS A 730 ? 1.5269 1.3963 0.8974 0.1342 -0.1617 0.2429 741 LYS A CA 5304 C C . LYS A 730 ? 1.4219 1.3138 0.7874 0.1435 -0.1678 0.2599 741 LYS A C 5305 O O . LYS A 730 ? 1.4840 1.3848 0.8684 0.1419 -0.1731 0.2701 741 LYS A O 5306 C CB . LYS A 730 ? 1.5489 1.4113 0.9549 0.1263 -0.1466 0.2504 741 LYS A CB 5307 C CG . LYS A 730 ? 1.5881 1.4459 1.0243 0.1207 -0.1473 0.2543 741 LYS A CG 5308 C CD . LYS A 730 ? 1.5889 1.4313 1.0532 0.1125 -0.1305 0.2565 741 LYS A CD 5309 C CE . LYS A 730 ? 1.4968 1.3326 0.9897 0.1089 -0.1292 0.2594 741 LYS A CE 5310 N NZ . LYS A 730 ? 1.3522 1.1681 0.8683 0.1014 -0.1113 0.2597 741 LYS A NZ 5311 N N . ILE A 731 ? 1.2344 1.1381 0.5747 0.1536 -0.1667 0.2643 742 ILE A N 5312 C CA . ILE A 731 ? 1.2933 1.2209 0.6253 0.1631 -0.1722 0.2805 742 ILE A CA 5313 C C . ILE A 731 ? 1.3756 1.3189 0.7359 0.1656 -0.1597 0.3032 742 ILE A C 5314 O O . ILE A 731 ? 1.4509 1.3876 0.8212 0.1629 -0.1470 0.3050 742 ILE A O 5315 C CB . ILE A 731 ? 1.2384 1.1710 0.5254 0.1744 -0.1771 0.2740 742 ILE A CB 5316 N N . ASP A 732 ? 1.5152 1.4798 0.8883 0.1697 -0.1639 0.3216 743 ASP A N 5317 C CA . ASP A 732 ? 1.6603 1.6402 1.0609 0.1728 -0.1528 0.3451 743 ASP A CA 5318 C C . ASP A 732 ? 1.6268 1.6303 1.0047 0.1846 -0.1532 0.3564 743 ASP A C 5319 O O . ASP A 732 ? 1.6033 1.6202 0.9985 0.1877 -0.1437 0.3755 743 ASP A O 5320 C CB . ASP A 732 ? 1.7303 1.7232 1.1614 0.1719 -0.1556 0.3623 743 ASP A CB 5321 C CG . ASP A 732 ? 1.7464 1.7398 1.2161 0.1711 -0.1399 0.3823 743 ASP A CG 5322 O OD1 . ASP A 732 ? 1.7336 1.7198 1.2342 0.1671 -0.1355 0.3889 743 ASP A OD1 5323 O OD2 . ASP A 732 ? 1.7616 1.7617 1.2304 0.1747 -0.1316 0.3924 743 ASP A OD2 5324 N N . TRP A 733 ? 1.5999 1.6072 0.9379 0.1912 -0.1638 0.3447 744 TRP A N 5325 C CA . TRP A 733 ? 1.6367 1.6623 0.9615 0.1965 -0.1634 0.3462 744 TRP A CA 5326 C C . TRP A 733 ? 1.6745 1.7280 1.0203 0.1990 -0.1647 0.3677 744 TRP A C 5327 O O . TRP A 733 ? 1.5946 1.6647 0.9422 0.2030 -0.1599 0.3742 744 TRP A O 5328 C CB . TRP A 733 ? 1.4713 1.4945 0.7959 0.1976 -0.1503 0.3444 744 TRP A CB 5329 C CG . TRP A 733 ? 1.5431 1.5460 0.8418 0.1967 -0.1496 0.3218 744 TRP A CG 5330 C CD1 . TRP A 733 ? 1.6062 1.5959 0.9081 0.1932 -0.1402 0.3175 744 TRP A CD1 5331 C CD2 . TRP A 733 ? 1.5366 1.5301 0.8028 0.1986 -0.1581 0.3013 744 TRP A CD2 5332 N NE1 . TRP A 733 ? 1.6223 1.5970 0.8990 0.1940 -0.1417 0.2966 744 TRP A NE1 5333 C CE2 . TRP A 733 ? 1.5933 1.5683 0.8474 0.1977 -0.1521 0.2860 744 TRP A CE2 5334 C CE3 . TRP A 733 ? 1.4354 1.4337 0.6807 0.2000 -0.1699 0.2952 744 TRP A CE3 5335 C CZ2 . TRP A 733 ? 1.5826 1.5425 0.8062 0.1999 -0.1563 0.2650 744 TRP A CZ2 5336 C CZ3 . TRP A 733 ? 1.4759 1.4573 0.6876 0.2006 -0.1747 0.2734 744 TRP A CZ3 5337 C CH2 . TRP A 733 ? 1.5739 1.5355 0.7758 0.2015 -0.1674 0.2586 744 TRP A CH2 5338 N N . ASN A 734 ? 1.7004 1.7607 1.0644 0.1969 -0.1709 0.3796 745 ASN A N 5339 C CA . ASN A 734 ? 1.7399 1.8283 1.1246 0.1987 -0.1735 0.3998 745 ASN A CA 5340 C C . ASN A 734 ? 1.7359 1.8336 1.1023 0.1954 -0.1905 0.3940 745 ASN A C 5341 O O . ASN A 734 ? 1.5913 1.6856 0.9643 0.1905 -0.1984 0.3957 745 ASN A O 5342 C CB . ASN A 734 ? 1.7001 1.7943 1.1286 0.1987 -0.1642 0.4249 745 ASN A CB 5343 C CG . ASN A 734 ? 1.6605 1.7553 1.1089 0.2009 -0.1485 0.4376 745 ASN A CG 5344 O OD1 . ASN A 734 ? 1.5398 1.6186 0.9746 0.1998 -0.1421 0.4264 745 ASN A OD1 5345 N ND2 . ASN A 734 ? 1.2277 1.3417 0.7089 0.2032 -0.1426 0.4617 745 ASN A ND2 5346 N N . GLY A 735 ? 1.7054 1.8141 1.0471 0.1971 -0.1960 0.3873 746 GLY A N 5347 C CA . GLY A 735 ? 1.6215 1.7327 0.9538 0.2032 -0.1861 0.3837 746 GLY A CA 5348 C C . GLY A 735 ? 1.6305 1.7711 0.9860 0.2083 -0.1800 0.4044 746 GLY A C 5349 O O . GLY A 735 ? 1.6372 1.7919 0.9741 0.2114 -0.1836 0.4019 746 GLY A O 5350 N N . VAL A 736 ? 1.7081 1.8567 1.1037 0.2090 -0.1701 0.4250 747 VAL A N 5351 C CA . VAL A 736 ? 1.8386 2.0142 1.2627 0.2134 -0.1625 0.4468 747 VAL A CA 5352 C C . VAL A 736 ? 1.8956 2.0800 1.3047 0.2187 -0.1571 0.4420 747 VAL A C 5353 O O . VAL A 736 ? 1.2758 1.4730 0.7092 0.2212 -0.1469 0.4571 747 VAL A O 5354 C CB . VAL A 736 ? 1.5302 1.7340 0.9700 0.2132 -0.1705 0.4629 747 VAL A CB 5355 C CG1 . VAL A 736 ? 1.5512 1.7474 0.9927 0.2071 -0.1804 0.4616 747 VAL A CG1 5356 C CG2 . VAL A 736 ? 1.5554 1.7770 0.9671 0.2157 -0.1784 0.4560 747 VAL A CG2 5357 N N . TRP A 744 ? 1.4908 1.5190 0.9066 0.1823 -0.1069 0.4079 755 TRP A N 5358 C CA . TRP A 744 ? 1.4777 1.4852 0.8764 0.1764 -0.1047 0.3908 755 TRP A CA 5359 C C . TRP A 744 ? 1.4954 1.4862 0.8797 0.1764 -0.1140 0.3670 755 TRP A C 5360 O O . TRP A 744 ? 1.5257 1.5236 0.9074 0.1823 -0.1233 0.3669 755 TRP A O 5361 C CB . TRP A 744 ? 1.6815 1.6985 1.0682 0.1754 -0.1014 0.3840 755 TRP A CB 5362 C CG . TRP A 744 ? 1.7164 1.7541 1.0928 0.1851 -0.1062 0.3800 755 TRP A CG 5363 C CD1 . TRP A 744 ? 1.7512 1.7942 1.1150 0.1930 -0.1160 0.3728 755 TRP A CD1 5364 C CD2 . TRP A 744 ? 1.8001 1.8559 1.1767 0.1873 -0.1010 0.3839 755 TRP A CD2 5365 N NE1 . TRP A 744 ? 1.8271 1.8884 1.1810 0.2002 -0.1163 0.3715 755 TRP A NE1 5366 C CE2 . TRP A 744 ? 1.9109 1.9808 1.2735 0.1981 -0.1068 0.3785 755 TRP A CE2 5367 C CE3 . TRP A 744 ? 1.8328 1.8946 1.2195 0.1807 -0.0922 0.3923 755 TRP A CE3 5368 C CZ2 . TRP A 744 ? 2.0158 2.1052 1.3749 0.2046 -0.1025 0.3813 755 TRP A CZ2 5369 C CZ3 . TRP A 744 ? 1.9735 2.0566 1.3591 0.1868 -0.0890 0.3956 755 TRP A CZ3 5370 C CH2 . TRP A 744 ? 2.0656 2.1621 1.4377 0.1997 -0.0934 0.3902 755 TRP A CH2 5371 N N . TYR A 745 ? 1.5306 1.5008 0.9058 0.1686 -0.1119 0.3482 756 TYR A N 5372 C CA . TYR A 745 ? 1.4793 1.4293 0.8481 0.1646 -0.1195 0.3259 756 TYR A CA 5373 C C . TYR A 745 ? 1.5107 1.4539 0.8469 0.1685 -0.1232 0.3078 756 TYR A C 5374 O O . TYR A 745 ? 1.5257 1.4809 0.8427 0.1762 -0.1190 0.3127 756 TYR A O 5375 C CB . TYR A 745 ? 1.3354 1.2610 0.7332 0.1487 -0.1127 0.3191 756 TYR A CB 5376 C CG . TYR A 745 ? 1.4128 1.3277 0.8136 0.1374 -0.1020 0.3163 756 TYR A CG 5377 C CD1 . TYR A 745 ? 1.3457 1.2456 0.7355 0.1304 -0.1023 0.2971 756 TYR A CD1 5378 C CD2 . TYR A 745 ? 1.5156 1.4368 0.9302 0.1322 -0.0921 0.3341 756 TYR A CD2 5379 C CE1 . TYR A 745 ? 1.2761 1.1700 0.6687 0.1184 -0.0931 0.2963 756 TYR A CE1 5380 C CE2 . TYR A 745 ? 1.5387 1.4517 0.9544 0.1190 -0.0836 0.3328 756 TYR A CE2 5381 C CZ . TYR A 745 ? 1.4185 1.3191 0.8232 0.1120 -0.0841 0.3142 756 TYR A CZ 5382 O OH . TYR A 745 ? 1.3514 1.2475 0.7574 0.0974 -0.0762 0.3148 756 TYR A OH 5383 N N . SER A 746 ? 1.4462 1.3703 0.7780 0.1636 -0.1304 0.2883 757 SER A N 5384 C CA . SER A 746 ? 1.3941 1.3065 0.6973 0.1663 -0.1339 0.2697 757 SER A CA 5385 C C . SER A 746 ? 1.4543 1.3433 0.7692 0.1540 -0.1382 0.2516 757 SER A C 5386 O O . SER A 746 ? 1.5750 1.4601 0.9102 0.1483 -0.1430 0.2525 757 SER A O 5387 C CB . SER A 746 ? 1.3603 1.2796 0.6273 0.1808 -0.1442 0.2658 757 SER A CB 5388 O OG . SER A 746 ? 1.2239 1.1438 0.4732 0.1850 -0.1388 0.2559 757 SER A OG 5389 N N . THR A 747 ? 1.2574 1.1333 0.5614 0.1504 -0.1359 0.2371 758 THR A N 5390 C CA . THR A 747 ? 1.3103 1.1659 0.6238 0.1393 -0.1405 0.2199 758 THR A CA 5391 C C . THR A 747 ? 1.4113 1.2551 0.6936 0.1447 -0.1480 0.2026 758 THR A C 5392 O O . THR A 747 ? 1.5415 1.3895 0.7984 0.1551 -0.1439 0.2029 758 THR A O 5393 C CB . THR A 747 ? 1.2783 1.1255 0.6171 0.1247 -0.1292 0.2184 758 THR A CB 5394 O OG1 . THR A 747 ? 1.2201 1.0753 0.5482 0.1261 -0.1200 0.2229 758 THR A OG1 5395 C CG2 . THR A 747 ? 1.1378 0.9866 0.5075 0.1175 -0.1224 0.2315 758 THR A CG2 5396 N N . PHE A 748 ? 1.3002 1.1288 0.5844 0.1380 -0.1584 0.1888 759 PHE A N 5397 C CA . PHE A 748 ? 1.4241 1.2367 0.6798 0.1410 -0.1660 0.1715 759 PHE A CA 5398 C C . PHE A 748 ? 1.5476 1.3446 0.8216 0.1274 -0.1696 0.1582 759 PHE A C 5399 O O . PHE A 748 ? 1.5912 1.3884 0.8926 0.1178 -0.1726 0.1606 759 PHE A O 5400 C CB . PHE A 748 ? 1.5065 1.3168 0.7327 0.1488 -0.1802 0.1680 759 PHE A CB 5401 C CG . PHE A 748 ? 1.6053 1.3937 0.7974 0.1517 -0.1880 0.1495 759 PHE A CG 5402 C CD1 . PHE A 748 ? 1.6870 1.4702 0.8458 0.1654 -0.1811 0.1460 759 PHE A CD1 5403 C CD2 . PHE A 748 ? 1.6071 1.3793 0.8004 0.1410 -0.2017 0.1368 759 PHE A CD2 5404 C CE1 . PHE A 748 ? 1.7075 1.4683 0.8392 0.1677 -0.1854 0.1283 759 PHE A CE1 5405 C CE2 . PHE A 748 ? 1.6669 1.4155 0.8280 0.1427 -0.2090 0.1198 759 PHE A CE2 5406 C CZ . PHE A 748 ? 1.6846 1.4245 0.8114 0.1570 -0.2009 0.1151 759 PHE A CZ 5407 N N . ALA A 749 ? 1.5371 1.3215 0.7964 0.1276 -0.1684 0.1455 760 ALA A N 5408 C CA . ALA A 749 ? 1.3473 1.1184 0.6225 0.1152 -0.1720 0.1330 760 ALA A CA 5409 C C . ALA A 749 ? 1.3648 1.1191 0.6130 0.1193 -0.1760 0.1184 760 ALA A C 5410 O O . ALA A 749 ? 1.3912 1.1463 0.6182 0.1300 -0.1676 0.1195 760 ALA A O 5411 C CB . ALA A 749 ? 1.1986 0.9760 0.5049 0.1044 -0.1589 0.1376 760 ALA A CB 5412 N N . TYR A 750 ? 1.3118 1.0512 0.5617 0.1111 -0.1882 0.1062 761 TYR A N 5413 C CA . TYR A 750 ? 1.2246 0.9437 0.4488 0.1139 -0.1935 0.0917 761 TYR A CA 5414 C C . TYR A 750 ? 1.4084 1.1182 0.6538 0.0994 -0.2014 0.0820 761 TYR A C 5415 O O . TYR A 750 ? 1.5454 1.2591 0.8119 0.0896 -0.2104 0.0840 761 TYR A O 5416 C CB . TYR A 750 ? 1.2777 0.9829 0.4620 0.1224 -0.2059 0.0859 761 TYR A CB 5417 C CG . TYR A 750 ? 1.4612 1.1383 0.6167 0.1232 -0.2139 0.0693 761 TYR A CG 5418 C CD1 . TYR A 750 ? 1.6000 1.2652 0.7291 0.1362 -0.2032 0.0646 761 TYR A CD1 5419 C CD2 . TYR A 750 ? 1.4795 1.1420 0.6343 0.1110 -0.2317 0.0598 761 TYR A CD2 5420 C CE1 . TYR A 750 ? 1.6179 1.2535 0.7199 0.1377 -0.2090 0.0495 761 TYR A CE1 5421 C CE2 . TYR A 750 ? 1.5543 1.1879 0.6817 0.1104 -0.2394 0.0446 761 TYR A CE2 5422 C CZ . TYR A 750 ? 1.6140 1.2324 0.7146 0.1242 -0.2275 0.0388 761 TYR A CZ 5423 O OH . TYR A 750 ? 1.6541 1.2400 0.7266 0.1245 -0.2337 0.0239 761 TYR A OH 5424 N N . ASN A 751 ? 1.3287 1.0279 0.5696 0.0989 -0.1976 0.0732 762 ASN A N 5425 C CA . ASN A 751 ? 1.2273 0.9177 0.4860 0.0860 -0.2057 0.0639 762 ASN A CA 5426 C C . ASN A 751 ? 1.3351 1.0030 0.5684 0.0899 -0.2094 0.0514 762 ASN A C 5427 O O . ASN A 751 ? 1.4449 1.1096 0.6599 0.1015 -0.1979 0.0517 762 ASN A O 5428 C CB . ASN A 751 ? 1.2551 0.9615 0.5521 0.0754 -0.1943 0.0687 762 ASN A CB 5429 C CG . ASN A 751 ? 1.2952 0.9957 0.6118 0.0627 -0.2018 0.0602 762 ASN A CG 5430 O OD1 . ASN A 751 ? 1.2975 0.9922 0.6114 0.0621 -0.1987 0.0541 762 ASN A OD1 5431 N ND2 . ASN A 751 ? 1.3892 1.0932 0.7272 0.0532 -0.2110 0.0615 762 ASN A ND2 5432 N N . ARG A 752 ? 1.3236 0.9763 0.5564 0.0805 -0.2251 0.0419 763 ARG A N 5433 C CA . ARG A 752 ? 1.4603 1.0873 0.6695 0.0826 -0.2300 0.0296 763 ARG A CA 5434 C C . ARG A 752 ? 1.4572 1.0805 0.6907 0.0664 -0.2423 0.0239 763 ARG A C 5435 O O . ARG A 752 ? 1.5237 1.1438 0.7596 0.0568 -0.2590 0.0228 763 ARG A O 5436 C CB . ARG A 752 ? 1.6705 1.2722 0.8323 0.0908 -0.2405 0.0219 763 ARG A CB 5437 C CG . ARG A 752 ? 1.8416 1.4089 0.9724 0.0933 -0.2457 0.0078 763 ARG A CG 5438 C CD . ARG A 752 ? 1.9622 1.5264 1.0861 0.1075 -0.2260 0.0085 763 ARG A CD 5439 N NE . ARG A 752 ? 2.1273 1.6533 1.2069 0.1177 -0.2269 -0.0038 763 ARG A NE 5440 C CZ . ARG A 752 ? 2.2434 1.7533 1.2799 0.1355 -0.2196 -0.0058 763 ARG A CZ 5441 N NH1 . ARG A 752 ? 2.2895 1.8216 1.3236 0.1445 -0.2119 0.0048 763 ARG A NH1 5442 N NH2 . ARG A 752 ? 2.2572 1.7275 1.2521 0.1446 -0.2193 -0.0182 763 ARG A NH2 5443 N N . VAL A 753 ? 1.4360 1.0630 0.6888 0.0631 -0.2340 0.0224 764 VAL A N 5444 C CA . VAL A 753 ? 1.4359 1.0622 0.7137 0.0484 -0.2443 0.0181 764 VAL A CA 5445 C C . VAL A 753 ? 1.4604 1.0577 0.7140 0.0499 -0.2513 0.0069 764 VAL A C 5446 O O . VAL A 753 ? 1.4296 1.0147 0.6607 0.0627 -0.2399 0.0044 764 VAL A O 5447 C CB . VAL A 753 ? 1.3066 0.9580 0.6246 0.0411 -0.2313 0.0242 764 VAL A CB 5448 C CG1 . VAL A 753 ? 1.2993 0.9532 0.6446 0.0263 -0.2422 0.0211 764 VAL A CG1 5449 C CG2 . VAL A 753 ? 1.2848 0.9589 0.6222 0.0402 -0.2220 0.0345 764 VAL A CG2 5450 N N . ARG A 754 ? 1.4410 1.0272 0.6991 0.0372 -0.2698 0.0014 765 ARG A N 5451 C CA . ARG A 754 ? 1.5571 1.1137 0.7956 0.0358 -0.2778 -0.0092 765 ARG A CA 5452 C C . ARG A 754 ? 1.6047 1.1704 0.8787 0.0199 -0.2869 -0.0087 765 ARG A C 5453 O O . ARG A 754 ? 1.5467 1.1318 0.8484 0.0079 -0.2965 -0.0028 765 ARG A O 5454 C CB . ARG A 754 ? 1.6498 1.1735 0.8438 0.0356 -0.2948 -0.0182 765 ARG A CB 5455 C CG . ARG A 754 ? 1.6989 1.2021 0.8472 0.0541 -0.2843 -0.0226 765 ARG A CG 5456 C CD . ARG A 754 ? 1.8244 1.2914 0.9245 0.0517 -0.3017 -0.0335 765 ARG A CD 5457 N NE . ARG A 754 ? 2.0697 1.5153 1.1233 0.0710 -0.2900 -0.0385 765 ARG A NE 5458 C CZ . ARG A 754 ? 2.2978 1.7571 1.3382 0.0797 -0.2854 -0.0328 765 ARG A CZ 5459 N NH1 . ARG A 754 ? 2.2950 1.7875 1.3655 0.0710 -0.2912 -0.0217 765 ARG A NH1 5460 N NH2 . ARG A 754 ? 2.4003 1.8401 1.3976 0.0982 -0.2740 -0.0371 765 ARG A NH2 5461 N N . VAL A 755 ? 1.2159 0.7688 0.4897 0.0209 -0.2831 -0.0135 766 VAL A N 5462 C CA . VAL A 755 ? 1.3465 0.9071 0.6522 0.0065 -0.2921 -0.0130 766 VAL A CA 5463 C C . VAL A 755 ? 1.4922 1.0203 0.7755 -0.0026 -0.3143 -0.0215 766 VAL A C 5464 O O . VAL A 755 ? 1.3259 0.8172 0.5674 0.0051 -0.3158 -0.0310 766 VAL A O 5465 C CB . VAL A 755 ? 1.2544 0.8225 0.5765 0.0109 -0.2761 -0.0113 766 VAL A CB 5466 C CG1 . VAL A 755 ? 1.3190 0.8994 0.6767 -0.0044 -0.2853 -0.0095 766 VAL A CG1 5467 C CG2 . VAL A 755 ? 1.1559 0.7549 0.4958 0.0177 -0.2549 -0.0023 766 VAL A CG2 5468 N N . ARG A 756 ? 1.6466 1.1876 0.9565 -0.0193 -0.3312 -0.0176 767 ARG A N 5469 C CA . ARG A 756 ? 1.6696 1.1836 0.9617 -0.0320 -0.3549 -0.0233 767 ARG A CA 5470 C C . ARG A 756 ? 1.7702 1.2869 1.0902 -0.0425 -0.3605 -0.0224 767 ARG A C 5471 O O . ARG A 756 ? 1.8900 1.3965 1.2090 -0.0351 -0.3482 -0.0261 767 ARG A O 5472 C CB . ARG A 756 ? 1.5876 1.1151 0.8851 -0.0440 -0.3734 -0.0164 767 ARG A CB 5473 C CG . ARG A 756 ? 1.6808 1.2089 0.9534 -0.0344 -0.3688 -0.0154 767 ARG A CG 5474 C CD . ARG A 756 ? 1.8682 1.3528 1.0824 -0.0296 -0.3758 -0.0279 767 ARG A CD 5475 N NE . ARG A 756 ? 1.9073 1.3936 1.0968 -0.0165 -0.3664 -0.0273 767 ARG A NE 5476 C CZ . ARG A 756 ? 1.9126 1.3683 1.0514 -0.0134 -0.3739 -0.0358 767 ARG A CZ 5477 N NH1 . ARG A 756 ? 1.9555 1.3736 1.0615 -0.0235 -0.3908 -0.0465 767 ARG A NH1 5478 N NH2 . ARG A 756 ? 1.8468 1.3092 0.9672 -0.0009 -0.3644 -0.0335 767 ARG A NH2 5479 N N . ASP A 757 ? 1.7696 1.3027 1.1161 -0.0593 -0.3787 -0.0155 768 ASP A N 5480 C CA . ASP A 757 ? 1.8386 1.3759 1.2122 -0.0710 -0.3872 -0.0132 768 ASP A CA 5481 C C . ASP A 757 ? 1.7793 1.3517 1.1965 -0.0676 -0.3685 -0.0066 768 ASP A C 5482 O O . ASP A 757 ? 1.8145 1.4197 1.2568 -0.0653 -0.3575 0.0007 768 ASP A O 5483 C CB . ASP A 757 ? 2.0045 1.5544 1.3957 -0.0899 -0.4120 -0.0048 768 ASP A CB 5484 C CG . ASP A 757 ? 2.2618 1.7746 1.6095 -0.0990 -0.4347 -0.0111 768 ASP A CG 5485 O OD1 . ASP A 757 ? 2.3892 1.8588 1.6978 -0.0953 -0.4353 -0.0240 768 ASP A OD1 5486 O OD2 . ASP A 757 ? 2.2940 1.8205 1.6455 -0.1102 -0.4516 -0.0024 768 ASP A OD2 5487 N N . ILE A 758 ? 1.6025 1.1667 1.0272 -0.0680 -0.3650 -0.0090 769 ILE A N 5488 C CA . ILE A 758 ? 1.3130 0.9120 0.7801 -0.0687 -0.3507 -0.0018 769 ILE A CA 5489 C C . ILE A 758 ? 1.3001 0.9020 0.7915 -0.0822 -0.3650 0.0017 769 ILE A C 5490 O O . ILE A 758 ? 1.3127 0.8901 0.7925 -0.0803 -0.3651 -0.0028 769 ILE A O 5491 C CB . ILE A 758 ? 1.3650 0.9602 0.8228 -0.0536 -0.3272 -0.0042 769 ILE A CB 5492 C CG1 . ILE A 758 ? 1.4022 0.9928 0.8332 -0.0395 -0.3135 -0.0068 769 ILE A CG1 5493 C CG2 . ILE A 758 ? 1.0535 0.6891 0.5548 -0.0570 -0.3133 0.0045 769 ILE A CG2 5494 C CD1 . ILE A 758 ? 1.1081 0.7021 0.5336 -0.0251 -0.2898 -0.0054 769 ILE A CD1 5495 N N . LYS A 759 ? 1.3233 0.9550 0.8490 -0.0950 -0.3762 0.0108 770 LYS A N 5496 C CA . LYS A 759 ? 1.3481 0.9878 0.9004 -0.1087 -0.3908 0.0165 770 LYS A CA 5497 C C . LYS A 759 ? 1.3460 1.0290 0.9451 -0.1110 -0.3777 0.0252 770 LYS A C 5498 O O . LYS A 759 ? 1.2717 0.9869 0.8926 -0.1100 -0.3672 0.0305 770 LYS A O 5499 C CB . LYS A 759 ? 1.3612 1.0032 0.9177 -0.1232 -0.4163 0.0229 770 LYS A CB 5500 C CG . LYS A 759 ? 1.6403 1.2370 1.1497 -0.1266 -0.4343 0.0146 770 LYS A CG 5501 C CD . LYS A 759 ? 1.8377 1.4424 1.3544 -0.1439 -0.4610 0.0242 770 LYS A CD 5502 C CE . LYS A 759 ? 2.0027 1.5608 1.4693 -0.1509 -0.4806 0.0155 770 LYS A CE 5503 N NZ . LYS A 759 ? 2.0097 1.5490 1.4372 -0.1379 -0.4705 0.0064 770 LYS A NZ 5504 N N . LYS A 760 ? 1.2833 0.9656 0.8963 -0.1145 -0.3780 0.0265 771 LYS A N 5505 C CA . LYS A 760 ? 1.1401 0.8639 0.7967 -0.1187 -0.3676 0.0352 771 LYS A CA 5506 C C . LYS A 760 ? 1.0842 0.8285 0.7732 -0.1340 -0.3870 0.0450 771 LYS A C 5507 O O . LYS A 760 ? 1.2030 0.9231 0.8809 -0.1422 -0.4082 0.0449 771 LYS A O 5508 C CB . LYS A 760 ? 1.0777 0.7944 0.7337 -0.1124 -0.3546 0.0338 771 LYS A CB 5509 C CG . LYS A 760 ? 1.0103 0.7517 0.7047 -0.1226 -0.3591 0.0430 771 LYS A CG 5510 C CD . LYS A 760 ? 0.9644 0.6927 0.6545 -0.1154 -0.3478 0.0429 771 LYS A CD 5511 C CE . LYS A 760 ? 0.9963 0.7436 0.7224 -0.1264 -0.3563 0.0526 771 LYS A CE 5512 N NZ . LYS A 760 ? 1.1355 0.8636 0.8607 -0.1388 -0.3836 0.0531 771 LYS A NZ 5513 N N . ARG A 761 ? 0.9572 0.7457 0.6848 -0.1384 -0.3797 0.0539 772 ARG A N 5514 C CA . ARG A 761 ? 1.0756 0.8901 0.8376 -0.1515 -0.3958 0.0655 772 ARG A CA 5515 C C . ARG A 761 ? 1.1963 1.0076 0.9726 -0.1590 -0.4054 0.0692 772 ARG A C 5516 O O . ARG A 761 ? 1.2729 1.0852 1.0524 -0.1542 -0.3912 0.0669 772 ARG A O 5517 C CB . ARG A 761 ? 0.9316 0.7924 0.7287 -0.1523 -0.3820 0.0732 772 ARG A CB 5518 C CG . ARG A 761 ? 0.8395 0.7046 0.6286 -0.1469 -0.3763 0.0731 772 ARG A CG 5519 C CD . ARG A 761 ? 0.9052 0.8082 0.7223 -0.1460 -0.3576 0.0777 772 ARG A CD 5520 N NE . ARG A 761 ? 0.9752 0.9123 0.8308 -0.1553 -0.3632 0.0887 772 ARG A NE 5521 C CZ . ARG A 761 ? 1.0471 1.0168 0.9286 -0.1562 -0.3541 0.0960 772 ARG A CZ 5522 N NH1 . ARG A 761 ? 1.0676 1.0374 0.9404 -0.1487 -0.3391 0.0931 772 ARG A NH1 5523 N NH2 . ARG A 761 ? 0.9538 0.9551 0.8694 -0.1640 -0.3594 0.1065 772 ARG A NH2 5524 N N . ALA A 762 ? 1.1125 0.9215 0.8987 -0.1714 -0.4295 0.0768 773 ALA A N 5525 C CA . ALA A 762 ? 1.1723 0.9745 0.9713 -0.1800 -0.4415 0.0811 773 ALA A CA 5526 C C . ALA A 762 ? 1.1276 0.9778 0.9739 -0.1839 -0.4325 0.0922 773 ALA A C 5527 O O . ALA A 762 ? 1.1381 0.9879 0.9989 -0.1886 -0.4365 0.0964 773 ALA A O 5528 C CB . ALA A 762 ? 0.9368 0.7230 0.7320 -0.1937 -0.4697 0.0871 773 ALA A CB 5529 N N . ASP A 763 ? 1.0583 0.9488 0.9275 -0.1819 -0.4196 0.0969 774 ASP A N 5530 C CA . ASP A 763 ? 1.0043 0.9419 0.9152 -0.1859 -0.4097 0.1065 774 ASP A CA 5531 C C . ASP A 763 ? 0.9744 0.9243 0.8837 -0.1776 -0.3825 0.1003 774 ASP A C 5532 O O . ASP A 763 ? 1.1151 1.1057 1.0516 -0.1801 -0.3695 0.1056 774 ASP A O 5533 C CB . ASP A 763 ? 1.0333 1.0089 0.9731 -0.1895 -0.4100 0.1169 774 ASP A CB 5534 C CG . ASP A 763 ? 1.1366 1.1117 1.0596 -0.1819 -0.4002 0.1117 774 ASP A CG 5535 O OD1 . ASP A 763 ? 1.1380 1.1450 1.0836 -0.1826 -0.3959 0.1198 774 ASP A OD1 5536 O OD2 . ASP A 763 ? 1.1520 1.0943 1.0398 -0.1737 -0.3934 0.0997 774 ASP A OD2 5537 N N . ARG A 764 ? 0.8639 0.7793 0.7400 -0.1682 -0.3739 0.0899 775 ARG A N 5538 C CA . ARG A 764 ? 0.9760 0.9026 0.8483 -0.1607 -0.3491 0.0861 775 ARG A CA 5539 C C . ARG A 764 ? 0.9208 0.8176 0.7737 -0.1535 -0.3449 0.0829 775 ARG A C 5540 O O . ARG A 764 ? 0.9161 0.7710 0.7441 -0.1511 -0.3584 0.0778 775 ARG A O 5541 C CB . ARG A 764 ? 1.0615 0.9804 0.9093 -0.1526 -0.3363 0.0777 775 ARG A CB 5542 C CG . ARG A 764 ? 1.0869 1.0325 0.9517 -0.1569 -0.3357 0.0809 775 ARG A CG 5543 C CD . ARG A 764 ? 0.9396 0.9295 0.8338 -0.1624 -0.3193 0.0861 775 ARG A CD 5544 N NE . ARG A 764 ? 1.0589 1.0800 0.9867 -0.1712 -0.3285 0.0960 775 ARG A NE 5545 C CZ . ARG A 764 ? 0.9577 0.9933 0.8935 -0.1712 -0.3259 0.0981 775 ARG A CZ 5546 N NH1 . ARG A 764 ? 0.9279 0.9482 0.8409 -0.1637 -0.3149 0.0906 775 ARG A NH1 5547 N NH2 . ARG A 764 ? 0.8718 0.9376 0.8390 -0.1777 -0.3336 0.1090 775 ARG A NH2 5548 N N . THR A 765 ? 0.7726 0.6910 0.6362 -0.1504 -0.3257 0.0867 776 THR A N 5549 C CA . THR A 765 ? 0.9436 0.8368 0.7891 -0.1403 -0.3168 0.0859 776 THR A CA 5550 C C . THR A 765 ? 0.9668 0.8823 0.8112 -0.1337 -0.2917 0.0885 776 THR A C 5551 O O . THR A 765 ? 0.8396 0.7879 0.6952 -0.1388 -0.2816 0.0894 776 THR A O 5552 C CB . THR A 765 ? 0.9079 0.8025 0.7762 -0.1450 -0.3250 0.0952 776 THR A CB 5553 O OG1 . THR A 765 ? 0.8078 0.7509 0.7199 -0.1586 -0.3297 0.1060 776 THR A OG1 5554 C CG2 . THR A 765 ? 1.0173 0.8623 0.8636 -0.1456 -0.3465 0.0894 776 THR A CG2 5555 N N . ASP A 766 ? 1.0770 0.9737 0.9072 -0.1228 -0.2816 0.0907 777 ASP A N 5556 C CA . ASP A 766 ? 0.7875 0.7006 0.6112 -0.1148 -0.2584 0.0952 777 ASP A CA 5557 C C . ASP A 766 ? 0.9413 0.8426 0.7357 -0.1092 -0.2521 0.0852 777 ASP A C 5558 O O . ASP A 766 ? 0.9002 0.8276 0.6958 -0.1093 -0.2355 0.0889 777 ASP A O 5559 C CB . ASP A 766 ? 0.7918 0.7632 0.6545 -0.1263 -0.2473 0.1084 777 ASP A CB 5560 C CG . ASP A 766 ? 0.9518 0.9415 0.8118 -0.1192 -0.2252 0.1183 777 ASP A CG 5561 O OD1 . ASP A 766 ? 1.0111 0.9676 0.8435 -0.1032 -0.2183 0.1172 777 ASP A OD1 5562 O OD2 . ASP A 766 ? 0.9093 0.9475 0.7941 -0.1301 -0.2146 0.1282 777 ASP A OD2 5563 N N . ILE A 767 ? 0.8505 0.7125 0.6182 -0.1053 -0.2661 0.0736 778 ILE A N 5564 C CA . ILE A 767 ? 0.8887 0.7389 0.6309 -0.1007 -0.2633 0.0647 778 ILE A CA 5565 C C . ILE A 767 ? 0.9545 0.7690 0.6566 -0.0836 -0.2541 0.0595 778 ILE A C 5566 O O . ILE A 767 ? 1.0994 0.8704 0.7741 -0.0763 -0.2644 0.0520 778 ILE A O 5567 C CB . ILE A 767 ? 0.9675 0.8006 0.7047 -0.1068 -0.2839 0.0573 778 ILE A CB 5568 C CG1 . ILE A 767 ? 0.9606 0.8313 0.7379 -0.1219 -0.2919 0.0640 778 ILE A CG1 5569 C CG2 . ILE A 767 ? 0.8541 0.6754 0.5658 -0.1011 -0.2804 0.0496 778 ILE A CG2 5570 C CD1 . ILE A 767 ? 0.8970 0.8109 0.6956 -0.1278 -0.2750 0.0687 778 ILE A CD1 5571 N N . GLN A 768 ? 0.8568 0.6902 0.5546 -0.0781 -0.2345 0.0640 779 GLN A N 5572 C CA . GLN A 768 ? 1.0818 0.8877 0.7420 -0.0616 -0.2244 0.0602 779 GLN A CA 5573 C C . GLN A 768 ? 1.1179 0.8972 0.7544 -0.0610 -0.2373 0.0478 779 GLN A C 5574 O O . GLN A 768 ? 1.0696 0.8689 0.7212 -0.0716 -0.2417 0.0465 779 GLN A O 5575 C CB . GLN A 768 ? 1.0982 0.9375 0.7630 -0.0606 -0.2039 0.0689 779 GLN A CB 5576 C CG . GLN A 768 ? 1.1966 1.0235 0.8375 -0.0428 -0.1878 0.0749 779 GLN A CG 5577 C CD . GLN A 768 ? 1.4140 1.1931 1.0119 -0.0272 -0.1922 0.0634 779 GLN A CD 5578 O OE1 . GLN A 768 ? 1.5408 1.3080 1.1252 -0.0300 -0.2012 0.0536 779 GLN A OE1 5579 N NE2 . GLN A 768 ? 1.4246 1.1758 0.9999 -0.0102 -0.1849 0.0653 779 GLN A NE2 5580 N N . SER A 769 ? 1.2218 0.9564 0.8211 -0.0489 -0.2429 0.0395 780 SER A N 5581 C CA . SER A 769 ? 1.2674 0.9768 0.8432 -0.0494 -0.2571 0.0290 780 SER A CA 5582 C C . SER A 769 ? 1.3673 1.0961 0.9410 -0.0487 -0.2478 0.0293 780 SER A C 5583 O O . SER A 769 ? 1.5727 1.3328 1.1740 -0.0603 -0.2476 0.0328 780 SER A O 5584 C CB . SER A 769 ? 1.1444 0.8017 0.6757 -0.0367 -0.2630 0.0197 780 SER A CB 5585 O OG . SER A 769 ? 1.2773 0.9254 0.7861 -0.0193 -0.2436 0.0219 780 SER A OG 5586 N N . HIS A 770 ? 1.2960 1.0054 0.8365 -0.0350 -0.2397 0.0260 781 HIS A N 5587 C CA . HIS A 770 ? 1.3807 1.1083 0.9198 -0.0343 -0.2298 0.0277 781 HIS A CA 5588 C C . HIS A 770 ? 1.5334 1.2446 1.0386 -0.0172 -0.2170 0.0278 781 HIS A C 5589 O O . HIS A 770 ? 1.6547 1.3314 1.1260 -0.0074 -0.2241 0.0200 781 HIS A O 5590 C CB . HIS A 770 ? 1.2876 1.0112 0.8272 -0.0414 -0.2439 0.0224 781 HIS A CB 5591 C CG . HIS A 770 ? 1.3493 1.1014 0.9056 -0.0471 -0.2340 0.0264 781 HIS A CG 5592 N ND1 . HIS A 770 ? 1.2920 1.0380 0.8291 -0.0402 -0.2288 0.0252 781 HIS A ND1 5593 C CD2 . HIS A 770 ? 1.2251 1.0100 0.8139 -0.0593 -0.2278 0.0314 781 HIS A CD2 5594 C CE1 . HIS A 770 ? 1.1342 0.9053 0.6911 -0.0480 -0.2197 0.0292 781 HIS A CE1 5595 N NE2 . HIS A 770 ? 0.9978 0.7918 0.5846 -0.0597 -0.2187 0.0323 781 HIS A NE2 5596 N N . LEU A 771 ? 1.4243 1.1618 0.9380 -0.0143 -0.1983 0.0376 782 LEU A N 5597 C CA . LEU A 771 ? 1.4773 1.2065 0.9625 0.0018 -0.1849 0.0410 782 LEU A CA 5598 C C . LEU A 771 ? 1.4850 1.2216 0.9644 -0.0005 -0.1840 0.0396 782 LEU A C 5599 O O . LEU A 771 ? 1.5761 1.3422 1.0793 -0.0127 -0.1788 0.0444 782 LEU A O 5600 C CB . LEU A 771 ? 1.4233 1.1807 0.9210 0.0053 -0.1656 0.0555 782 LEU A CB 5601 C CG . LEU A 771 ? 1.1533 0.9091 0.6611 0.0090 -0.1624 0.0611 782 LEU A CG 5602 C CD1 . LEU A 771 ? 1.0183 0.7265 0.5012 0.0182 -0.1750 0.0492 782 LEU A CD1 5603 C CD2 . LEU A 771 ? 0.9368 0.7272 0.4862 -0.0100 -0.1650 0.0665 782 LEU A CD2 5604 N N . PHE A 772 ? 1.3901 1.0983 0.8367 0.0110 -0.1890 0.0329 783 PHE A N 5605 C CA . PHE A 772 ? 1.3499 1.0632 0.7899 0.0107 -0.1883 0.0327 783 PHE A CA 5606 C C . PHE A 772 ? 1.3779 1.1033 0.8045 0.0216 -0.1704 0.0422 783 PHE A C 5607 O O . PHE A 772 ? 1.4507 1.1614 0.8500 0.0333 -0.1696 0.0409 783 PHE A O 5608 C CB . PHE A 772 ? 1.2962 0.9779 0.7098 0.0155 -0.2041 0.0226 783 PHE A CB 5609 C CG . PHE A 772 ? 1.2948 0.9753 0.7271 0.0012 -0.2219 0.0173 783 PHE A CG 5610 C CD1 . PHE A 772 ? 1.1890 0.8882 0.6416 -0.0081 -0.2236 0.0199 783 PHE A CD1 5611 C CD2 . PHE A 772 ? 1.3339 0.9941 0.7634 -0.0026 -0.2366 0.0111 783 PHE A CD2 5612 C CE1 . PHE A 772 ? 1.2142 0.9152 0.6853 -0.0196 -0.2387 0.0178 783 PHE A CE1 5613 C CE2 . PHE A 772 ? 1.2605 0.9234 0.7087 -0.0161 -0.2536 0.0090 783 PHE A CE2 5614 C CZ . PHE A 772 ? 1.2302 0.9150 0.6998 -0.0239 -0.2543 0.0131 783 PHE A CZ 5615 N N . ASP A 773 ? 1.3043 1.0591 0.7508 0.0169 -0.1567 0.0534 784 ASP A N 5616 C CA . ASP A 773 ? 1.2607 1.0336 0.6990 0.0243 -0.1400 0.0659 784 ASP A CA 5617 C C . ASP A 773 ? 1.2475 1.0328 0.6897 0.0162 -0.1384 0.0675 784 ASP A C 5618 O O . ASP A 773 ? 1.2539 1.0486 0.6841 0.0229 -0.1278 0.0767 784 ASP A O 5619 C CB . ASP A 773 ? 1.2465 1.0513 0.7067 0.0185 -0.1270 0.0798 784 ASP A CB 5620 C CG . ASP A 773 ? 1.1243 0.9533 0.6195 -0.0041 -0.1306 0.0791 784 ASP A CG 5621 O OD1 . ASP A 773 ? 1.0671 0.9196 0.5749 -0.0175 -0.1246 0.0841 784 ASP A OD1 5622 O OD2 . ASP A 773 ? 1.0018 0.8254 0.5107 -0.0087 -0.1390 0.0737 784 ASP A OD2 5623 N N . ALA A 774 ? 1.1811 0.9659 0.6403 0.0025 -0.1484 0.0595 785 ALA A N 5624 C CA . ALA A 774 ? 1.2812 1.0740 0.7456 -0.0052 -0.1461 0.0606 785 ALA A CA 5625 C C . ALA A 774 ? 1.1596 0.9328 0.5977 0.0083 -0.1498 0.0584 785 ALA A C 5626 O O . ALA A 774 ? 1.1654 0.9469 0.6006 0.0079 -0.1425 0.0644 785 ALA A O 5627 C CB . ALA A 774 ? 0.9289 0.7253 0.4185 -0.0209 -0.1540 0.0538 785 ALA A CB 5628 N N . ILE A 775 ? 1.0802 0.8271 0.4983 0.0191 -0.1614 0.0501 786 ILE A N 5629 C CA . ILE A 775 ? 1.1101 0.8384 0.5022 0.0305 -0.1672 0.0472 786 ILE A CA 5630 C C . ILE A 775 ? 1.1675 0.9018 0.5392 0.0437 -0.1541 0.0567 786 ILE A C 5631 O O . ILE A 775 ? 1.0739 0.8061 0.4301 0.0555 -0.1462 0.0607 786 ILE A O 5632 C CB . ILE A 775 ? 1.2034 0.9007 0.5712 0.0389 -0.1815 0.0367 786 ILE A CB 5633 C CG1 . ILE A 775 ? 1.1767 0.8692 0.5647 0.0252 -0.1967 0.0292 786 ILE A CG1 5634 C CG2 . ILE A 775 ? 1.1429 0.8240 0.4821 0.0492 -0.1874 0.0344 786 ILE A CG2 5635 C CD1 . ILE A 775 ? 1.0836 0.7450 0.4469 0.0291 -0.2141 0.0194 786 ILE A CD1 5636 N N . GLN A 776 ? 1.2522 0.9949 0.6250 0.0424 -0.1511 0.0617 787 GLN A N 5637 C CA . GLN A 776 ? 1.2621 1.0115 0.6158 0.0548 -0.1404 0.0719 787 GLN A CA 5638 C C . GLN A 776 ? 1.3020 1.0266 0.6200 0.0731 -0.1468 0.0662 787 GLN A C 5639 O O . GLN A 776 ? 1.4184 1.1246 0.7283 0.0724 -0.1609 0.0567 787 GLN A O 5640 C CB . GLN A 776 ? 1.4667 1.2279 0.8308 0.0480 -0.1373 0.0782 787 GLN A CB 5641 C CG . GLN A 776 ? 1.6999 1.4743 1.0501 0.0576 -0.1255 0.0919 787 GLN A CG 5642 C CD . GLN A 776 ? 1.8142 1.5968 1.1745 0.0505 -0.1230 0.0982 787 GLN A CD 5643 O OE1 . GLN A 776 ? 1.8512 1.6220 1.2117 0.0509 -0.1318 0.0929 787 GLN A OE1 5644 N NE2 . GLN A 776 ? 1.8158 1.6190 1.1846 0.0434 -0.1109 0.1109 787 GLN A NE2 5645 N N . PRO A 777 ? 1.3581 1.0825 0.6538 0.0893 -0.1362 0.0728 788 PRO A N 5646 C CA . PRO A 777 ? 1.2698 0.9676 0.5262 0.1081 -0.1397 0.0667 788 PRO A CA 5647 C C . PRO A 777 ? 1.2859 0.9783 0.5272 0.1117 -0.1472 0.0655 788 PRO A C 5648 O O . PRO A 777 ? 1.4205 1.1340 0.6785 0.1058 -0.1431 0.0749 788 PRO A O 5649 C CB . PRO A 777 ? 1.4163 1.1257 0.6587 0.1245 -0.1218 0.0800 788 PRO A CB 5650 C CG . PRO A 777 ? 1.3428 1.0794 0.6177 0.1124 -0.1125 0.0899 788 PRO A CG 5651 C CD . PRO A 777 ? 1.3934 1.1438 0.6990 0.0905 -0.1195 0.0879 788 PRO A CD 5652 N N . SER A 778 ? 1.4243 1.0883 0.6339 0.1203 -0.1581 0.0545 789 SER A N 5653 C CA . SER A 778 ? 1.3394 0.9994 0.5326 0.1237 -0.1663 0.0539 789 SER A CA 5654 C C . SER A 778 ? 1.4205 1.1015 0.6077 0.1352 -0.1527 0.0687 789 SER A C 5655 O O . SER A 778 ? 1.5291 1.2124 0.6987 0.1503 -0.1395 0.0752 789 SER A O 5656 C CB . SER A 778 ? 1.3385 0.9640 0.4898 0.1326 -0.1776 0.0407 789 SER A CB 5657 O OG . SER A 778 ? 1.5297 1.1540 0.6707 0.1304 -0.1895 0.0398 789 SER A OG 5658 N N . ARG A 779 ? 1.4435 1.1405 0.6464 0.1285 -0.1555 0.0756 790 ARG A N 5659 C CA . ARG A 779 ? 1.3769 1.0968 0.5805 0.1360 -0.1435 0.0915 790 ARG A CA 5660 C C . ARG A 779 ? 1.4320 1.1526 0.6246 0.1398 -0.1513 0.0942 790 ARG A C 5661 O O . ARG A 779 ? 1.2004 0.9147 0.4033 0.1296 -0.1643 0.0882 790 ARG A O 5662 C CB . ARG A 779 ? 1.2423 0.9869 0.4843 0.1209 -0.1349 0.1017 790 ARG A CB 5663 C CG . ARG A 779 ? 1.1931 0.9617 0.4400 0.1240 -0.1238 0.1193 790 ARG A CG 5664 C CD . ARG A 779 ? 1.5317 1.3187 0.8133 0.1053 -0.1168 0.1267 790 ARG A CD 5665 N NE . ARG A 779 ? 1.8061 1.6008 1.0959 0.1003 -0.1091 0.1279 790 ARG A NE 5666 C CZ . ARG A 779 ? 1.9653 1.7760 1.2811 0.0827 -0.1027 0.1335 790 ARG A CZ 5667 N NH1 . ARG A 779 ? 1.9809 1.7970 1.3153 0.0689 -0.1023 0.1368 790 ARG A NH1 5668 N NH2 . ARG A 779 ? 2.0233 1.8439 1.3457 0.0787 -0.0963 0.1360 790 ARG A NH2 5669 N N . TYR A 780 ? 1.5148 1.2455 0.6872 0.1551 -0.1429 0.1049 791 TYR A N 5670 C CA . TYR A 780 ? 1.5259 1.2660 0.6934 0.1587 -0.1472 0.1125 791 TYR A CA 5671 C C . TYR A 780 ? 1.3862 1.1551 0.5779 0.1560 -0.1347 0.1311 791 TYR A C 5672 O O . TYR A 780 ? 1.3511 1.1329 0.5432 0.1609 -0.1217 0.1404 791 TYR A O 5673 C CB . TYR A 780 ? 1.6035 1.3365 0.7324 0.1773 -0.1462 0.1110 791 TYR A CB 5674 C CG . TYR A 780 ? 1.7282 1.4297 0.8270 0.1802 -0.1571 0.0920 791 TYR A CG 5675 C CD1 . TYR A 780 ? 1.7920 1.4726 0.8759 0.1851 -0.1529 0.0821 791 TYR A CD1 5676 C CD2 . TYR A 780 ? 1.7967 1.4891 0.8806 0.1776 -0.1713 0.0853 791 TYR A CD2 5677 C CE1 . TYR A 780 ? 1.8016 1.4487 0.8548 0.1868 -0.1628 0.0645 791 TYR A CE1 5678 C CE2 . TYR A 780 ? 1.8753 1.5374 0.9296 0.1775 -0.1819 0.0680 791 TYR A CE2 5679 C CZ . TYR A 780 ? 1.8287 1.4661 0.8669 0.1820 -0.1776 0.0570 791 TYR A CZ 5680 O OH . TYR A 780 ? 1.7602 1.3629 0.7665 0.1810 -0.1881 0.0395 791 TYR A OH 5681 N N . VAL A 781 ? 1.3502 1.1295 0.5620 0.1479 -0.1384 0.1381 792 VAL A N 5682 C CA . VAL A 781 ? 1.3555 1.1588 0.5853 0.1458 -0.1275 0.1564 792 VAL A CA 5683 C C . VAL A 781 ? 1.3923 1.2044 0.6234 0.1493 -0.1319 0.1659 792 VAL A C 5684 O O . VAL A 781 ? 1.4714 1.2799 0.7224 0.1393 -0.1390 0.1640 792 VAL A O 5685 C CB . VAL A 781 ? 1.3256 1.1350 0.5905 0.1265 -0.1212 0.1585 792 VAL A CB 5686 C CG1 . VAL A 781 ? 1.3628 1.1570 0.6469 0.1130 -0.1310 0.1456 792 VAL A CG1 5687 C CG2 . VAL A 781 ? 1.3553 1.1840 0.6374 0.1212 -0.1125 0.1764 792 VAL A CG2 5688 N N . VAL A 782 ? 1.4380 1.2633 0.6482 0.1647 -0.1270 0.1775 793 VAL A N 5689 C CA . VAL A 782 ? 1.4941 1.3318 0.7042 0.1698 -0.1304 0.1888 793 VAL A CA 5690 C C . VAL A 782 ? 1.4576 1.3188 0.6893 0.1664 -0.1192 0.2093 793 VAL A C 5691 O O . VAL A 782 ? 1.5069 1.3790 0.7476 0.1628 -0.1083 0.2153 793 VAL A O 5692 C CB . VAL A 782 ? 1.6179 1.4613 0.8088 0.1824 -0.1310 0.1845 793 VAL A CB 5693 C CG1 . VAL A 782 ? 1.5684 1.3852 0.7340 0.1847 -0.1406 0.1636 793 VAL A CG1 5694 C CG2 . VAL A 782 ? 1.6826 1.5453 0.8760 0.1903 -0.1158 0.1932 793 VAL A CG2 5695 N N . GLY A 783 ? 1.4361 1.3069 0.6812 0.1649 -0.1218 0.2204 794 GLY A N 5696 C CA . GLY A 783 ? 1.4860 1.3753 0.7522 0.1596 -0.1122 0.2400 794 GLY A CA 5697 C C . GLY A 783 ? 1.4210 1.3296 0.6882 0.1684 -0.1130 0.2553 794 GLY A C 5698 O O . GLY A 783 ? 1.2988 1.2050 0.5588 0.1741 -0.1225 0.2523 794 GLY A O 5699 N N . LEU A 784 ? 1.3988 1.3286 0.6806 0.1661 -0.1033 0.2712 795 LEU A N 5700 C CA . LEU A 784 ? 1.3609 1.3105 0.6524 0.1706 -0.1029 0.2865 795 LEU A CA 5701 C C . LEU A 784 ? 1.4120 1.3730 0.7255 0.1605 -0.0942 0.3061 795 LEU A C 5702 O O . LEU A 784 ? 1.4537 1.4221 0.7724 0.1537 -0.0865 0.3097 795 LEU A O 5703 C CB . LEU A 784 ? 1.3451 1.3096 0.6255 0.1815 -0.1008 0.2837 795 LEU A CB 5704 C CG . LEU A 784 ? 1.3816 1.3683 0.6711 0.1868 -0.0998 0.2990 795 LEU A CG 5705 C CD1 . LEU A 784 ? 1.2553 1.2403 0.5458 0.1889 -0.1097 0.3020 795 LEU A CD1 5706 C CD2 . LEU A 784 ? 1.4056 1.4036 0.6799 0.1990 -0.0961 0.2947 795 LEU A CD2 5707 N N . GLY A 785 ? 1.3793 1.3414 0.7060 0.1588 -0.0954 0.3198 796 GLY A N 5708 C CA . GLY A 785 ? 1.3295 1.2980 0.6756 0.1479 -0.0872 0.3391 796 GLY A CA 5709 C C . GLY A 785 ? 1.3938 1.3702 0.7560 0.1507 -0.0879 0.3567 796 GLY A C 5710 O O . GLY A 785 ? 1.3861 1.3601 0.7486 0.1585 -0.0949 0.3533 796 GLY A O 5711 N N . TYR A 786 ? 1.3439 1.3298 0.7232 0.1418 -0.0807 0.3750 797 TYR A N 5712 C CA . TYR A 786 ? 1.2707 1.2642 0.6689 0.1434 -0.0797 0.3942 797 TYR A CA 5713 C C . TYR A 786 ? 1.2418 1.2146 0.6650 0.1235 -0.0712 0.4002 797 TYR A C 5714 O O . TYR A 786 ? 1.3326 1.3051 0.7566 0.1099 -0.0653 0.4064 797 TYR A O 5715 C CB . TYR A 786 ? 1.2297 1.2495 0.6354 0.1477 -0.0791 0.4033 797 TYR A CB 5716 C CG . TYR A 786 ? 1.3010 1.3300 0.7292 0.1470 -0.0767 0.4252 797 TYR A CG 5717 C CD1 . TYR A 786 ? 1.2445 1.2738 0.6881 0.1337 -0.0693 0.4421 797 TYR A CD1 5718 C CD2 . TYR A 786 ? 1.4727 1.5102 0.9074 0.1584 -0.0819 0.4298 797 TYR A CD2 5719 C CE1 . TYR A 786 ? 1.3421 1.3776 0.8072 0.1329 -0.0667 0.4626 797 TYR A CE1 5720 C CE2 . TYR A 786 ? 1.5175 1.5645 0.9757 0.1583 -0.0790 0.4509 797 TYR A CE2 5721 C CZ . TYR A 786 ? 1.4186 1.4634 0.8921 0.1461 -0.0710 0.4671 797 TYR A CZ 5722 O OH . TYR A 786 ? 1.2555 1.3077 0.7531 0.1459 -0.0677 0.4885 797 TYR A OH 5723 N N . ASP A 787 ? 1.1861 1.1407 0.6301 0.1206 -0.0703 0.3979 798 ASP A N 5724 C CA . ASP A 787 ? 1.3527 1.2838 0.8205 0.1036 -0.0604 0.4040 798 ASP A CA 5725 C C . ASP A 787 ? 1.4030 1.3471 0.8885 0.1099 -0.0581 0.4287 798 ASP A C 5726 O O . ASP A 787 ? 1.4378 1.3946 0.9292 0.1245 -0.0631 0.4338 798 ASP A O 5727 C CB . ASP A 787 ? 1.4886 1.3860 0.9691 0.0959 -0.0575 0.3850 798 ASP A CB 5728 C CG . ASP A 787 ? 1.6295 1.5120 1.0963 0.0862 -0.0584 0.3620 798 ASP A CG 5729 O OD1 . ASP A 787 ? 1.7036 1.5943 1.1569 0.0784 -0.0572 0.3629 798 ASP A OD1 5730 O OD2 . ASP A 787 ? 1.6791 1.5443 1.1501 0.0862 -0.0603 0.3449 798 ASP A OD2 5731 N N . GLN A 788 ? 1.4780 1.4205 0.9722 0.0977 -0.0510 0.4451 799 GLN A N 5732 C CA . GLN A 788 ? 1.4880 1.4392 1.0023 0.1015 -0.0476 0.4696 799 GLN A CA 5733 C C . GLN A 788 ? 1.5241 1.4431 1.0624 0.0981 -0.0402 0.4657 799 GLN A C 5734 O O . GLN A 788 ? 1.5792 1.4614 1.1219 0.0821 -0.0321 0.4519 799 GLN A O 5735 C CB . GLN A 788 ? 1.4307 1.3843 0.9478 0.0863 -0.0422 0.4879 799 GLN A CB 5736 C CG . GLN A 788 ? 1.4702 1.4389 1.0065 0.0917 -0.0400 0.5163 799 GLN A CG 5737 C CD . GLN A 788 ? 1.4791 1.4382 1.0218 0.0715 -0.0336 0.5328 799 GLN A CD 5738 O OE1 . GLN A 788 ? 1.5334 1.4618 1.0712 0.0499 -0.0284 0.5209 799 GLN A OE1 5739 N NE2 . GLN A 788 ? 1.4135 1.3993 0.9669 0.0769 -0.0347 0.5606 799 GLN A NE2 5740 N N . PRO A 789 ? 1.5445 1.4787 1.0983 0.1135 -0.0423 0.4788 800 PRO A N 5741 C CA . PRO A 789 ? 1.5347 1.4435 1.1140 0.1140 -0.0343 0.4794 800 PRO A CA 5742 C C . PRO A 789 ? 1.5495 1.4220 1.1449 0.0975 -0.0196 0.4861 800 PRO A C 5743 O O . PRO A 789 ? 1.4151 1.2518 1.0238 0.0925 -0.0095 0.4771 800 PRO A O 5744 C CB . PRO A 789 ? 1.4524 1.3955 1.0453 0.1325 -0.0395 0.5014 800 PRO A CB 5745 C CG . PRO A 789 ? 1.4451 1.4252 1.0228 0.1379 -0.0466 0.5163 800 PRO A CG 5746 C CD . PRO A 789 ? 1.5188 1.4971 1.0673 0.1316 -0.0514 0.4965 800 PRO A CD 5747 N N . GLU A 790 ? 1.6332 1.5140 1.2257 0.0889 -0.0181 0.5021 801 GLU A N 5748 C CA . GLU A 790 ? 1.7036 1.5480 1.3064 0.0702 -0.0053 0.5090 801 GLU A CA 5749 C C . GLU A 790 ? 1.7013 1.5051 1.2905 0.0498 0.0007 0.4836 801 GLU A C 5750 O O . GLU A 790 ? 1.6025 1.3622 1.1996 0.0361 0.0137 0.4799 801 GLU A O 5751 C CB . GLU A 790 ? 1.7655 1.6328 1.3649 0.0633 -0.0081 0.5318 801 GLU A CB 5752 C CG . GLU A 790 ? 1.7719 1.6911 1.3763 0.0842 -0.0175 0.5546 801 GLU A CG 5753 C CD . GLU A 790 ? 1.7910 1.7123 1.4238 0.0978 -0.0126 0.5722 801 GLU A CD 5754 O OE1 . GLU A 790 ? 1.7949 1.7539 1.4305 0.1177 -0.0210 0.5804 801 GLU A OE1 5755 O OE2 . GLU A 790 ? 1.8287 1.7138 1.4803 0.0883 0.0000 0.5786 801 GLU A OE2 5756 N N . GLY A 791 ? 1.7357 1.5538 1.3031 0.0482 -0.0082 0.4665 802 GLY A N 5757 C CA . GLY A 791 ? 1.6470 1.4338 1.2009 0.0295 -0.0041 0.4429 802 GLY A CA 5758 C C . GLY A 791 ? 1.5397 1.3203 1.0805 0.0055 -0.0024 0.4479 802 GLY A C 5759 O O . GLY A 791 ? 1.4505 1.1937 0.9851 -0.0160 0.0055 0.4346 802 GLY A O 5760 N N . LYS A 792 ? 1.5226 1.3414 1.0581 0.0086 -0.0098 0.4681 803 LYS A N 5761 C CA . LYS A 792 ? 1.5597 1.3804 1.0843 -0.0144 -0.0097 0.4782 803 LYS A CA 5762 C C . LYS A 792 ? 1.5635 1.4152 1.0675 -0.0157 -0.0184 0.4721 803 LYS A C 5763 O O . LYS A 792 ? 1.5587 1.4016 1.0508 -0.0390 -0.0172 0.4684 803 LYS A O 5764 C CB . LYS A 792 ? 1.5499 1.3924 1.0852 -0.0126 -0.0108 0.5097 803 LYS A CB 5765 N N . TRP A 793 ? 1.4658 1.3529 0.9645 0.0090 -0.0265 0.4717 804 TRP A N 5766 C CA . TRP A 793 ? 1.4868 1.4024 0.9658 0.0121 -0.0331 0.4665 804 TRP A CA 5767 C C . TRP A 793 ? 1.5123 1.4397 0.9835 0.0362 -0.0392 0.4500 804 TRP A C 5768 O O . TRP A 793 ? 1.4726 1.3957 0.9538 0.0516 -0.0404 0.4475 804 TRP A O 5769 C CB . TRP A 793 ? 1.4246 1.3827 0.8980 0.0148 -0.0371 0.4943 804 TRP A CB 5770 C CG . TRP A 793 ? 1.4560 1.4434 0.9369 0.0412 -0.0416 0.5029 804 TRP A CG 5771 C CD1 . TRP A 793 ? 1.4285 1.4186 0.9274 0.0464 -0.0402 0.5202 804 TRP A CD1 5772 C CD2 . TRP A 793 ? 1.4067 1.4206 0.8799 0.0637 -0.0476 0.4883 804 TRP A CD2 5773 N NE1 . TRP A 793 ? 1.3415 1.3616 0.8445 0.0698 -0.0457 0.5171 804 TRP A NE1 5774 C CE2 . TRP A 793 ? 1.3063 1.3393 0.7924 0.0800 -0.0502 0.4973 804 TRP A CE2 5775 C CE3 . TRP A 793 ? 1.3658 1.3870 0.8225 0.0704 -0.0506 0.4688 804 TRP A CE3 5776 C CZ2 . TRP A 793 ? 1.2558 1.3136 0.7366 0.1007 -0.0557 0.4869 804 TRP A CZ2 5777 C CZ3 . TRP A 793 ? 1.3229 1.3656 0.7746 0.0918 -0.0554 0.4590 804 TRP A CZ3 5778 C CH2 . TRP A 793 ? 1.3376 1.3978 0.8002 0.1059 -0.0580 0.4677 804 TRP A CH2 5779 N N . GLY A 794 ? 1.5906 1.5329 1.0438 0.0385 -0.0431 0.4399 805 GLY A N 5780 C CA . GLY A 794 ? 1.5392 1.4891 0.9810 0.0589 -0.0492 0.4232 805 GLY A CA 5781 C C . GLY A 794 ? 1.4645 1.4364 0.8852 0.0636 -0.0522 0.4194 805 GLY A C 5782 O O . GLY A 794 ? 1.3913 1.3690 0.8083 0.0472 -0.0490 0.4256 805 GLY A O 5783 N N . VAL A 795 ? 1.4028 1.3864 0.8092 0.0855 -0.0580 0.4097 806 VAL A N 5784 C CA . VAL A 795 ? 1.2639 1.2589 0.6587 0.0910 -0.0597 0.3948 806 VAL A CA 5785 C C . VAL A 795 ? 1.2815 1.2634 0.6602 0.1024 -0.0646 0.3752 806 VAL A C 5786 O O . VAL A 795 ? 1.3108 1.2834 0.6895 0.1126 -0.0692 0.3708 806 VAL A O 5787 C CB . VAL A 795 ? 1.3482 1.3684 0.7463 0.1051 -0.0612 0.3977 806 VAL A CB 5788 C CG1 . VAL A 795 ? 1.3365 1.3643 0.7214 0.1157 -0.0621 0.3819 806 VAL A CG1 5789 C CG2 . VAL A 795 ? 1.3626 1.3978 0.7760 0.0936 -0.0564 0.4156 806 VAL A CG2 5790 N N . ASN A 796 ? 1.2615 1.2414 0.6300 0.0993 -0.0639 0.3619 807 ASN A N 5791 C CA . ASN A 796 ? 1.1380 1.1042 0.4905 0.1096 -0.0689 0.3422 807 ASN A CA 5792 C C . ASN A 796 ? 1.3395 1.3141 0.6833 0.1143 -0.0683 0.3300 807 ASN A C 5793 O O . ASN A 796 ? 1.2731 1.2573 0.6228 0.1033 -0.0625 0.3347 807 ASN A O 5794 C CB . ASN A 796 ? 1.1793 1.1158 0.5464 0.0906 -0.0680 0.3251 807 ASN A CB 5795 C CG . ASN A 796 ? 1.3172 1.2359 0.6771 0.0982 -0.0750 0.3015 807 ASN A CG 5796 O OD1 . ASN A 796 ? 1.3266 1.2422 0.6765 0.0973 -0.0754 0.2893 807 ASN A OD1 5797 N ND2 . ASN A 796 ? 1.3741 1.2829 0.7403 0.1051 -0.0806 0.2967 807 ASN A ND2 5798 N N . GLY A 797 ? 1.3903 1.3606 0.7203 0.1302 -0.0738 0.3152 808 GLY A N 5799 C CA . GLY A 797 ? 1.3710 1.3449 0.6912 0.1367 -0.0719 0.3036 808 GLY A CA 5800 C C . GLY A 797 ? 1.2670 1.2187 0.5710 0.1414 -0.0777 0.2837 808 GLY A C 5801 O O . GLY A 797 ? 1.3626 1.3007 0.6567 0.1491 -0.0860 0.2753 808 GLY A O 5802 N N . MET A 798 ? 1.2188 1.1669 0.5207 0.1360 -0.0740 0.2766 809 MET A N 5803 C CA . MET A 798 ? 1.4047 1.3298 0.6920 0.1389 -0.0796 0.2576 809 MET A CA 5804 C C . MET A 798 ? 1.3625 1.2894 0.6397 0.1487 -0.0762 0.2479 809 MET A C 5805 O O . MET A 798 ? 1.2870 1.2300 0.5734 0.1448 -0.0673 0.2558 809 MET A O 5806 C CB . MET A 798 ? 1.5649 1.4783 0.8616 0.1209 -0.0782 0.2554 809 MET A CB 5807 C CG . MET A 798 ? 1.6865 1.5875 1.0066 0.1061 -0.0809 0.2533 809 MET A CG 5808 S SD . MET A 798 ? 1.5185 1.3959 0.8375 0.1125 -0.0931 0.2342 809 MET A SD 5809 C CE . MET A 798 ? 2.4926 2.3591 1.8436 0.0947 -0.0906 0.2376 809 MET A CE 5810 N N . LEU A 799 ? 1.3584 1.2676 0.6160 0.1611 -0.0832 0.2317 810 LEU A N 5811 C CA . LEU A 799 ? 1.3126 1.2154 0.5554 0.1719 -0.0797 0.2208 810 LEU A CA 5812 C C . LEU A 799 ? 1.4264 1.3018 0.6580 0.1685 -0.0871 0.2029 810 LEU A C 5813 O O . LEU A 799 ? 1.4891 1.3439 0.7103 0.1679 -0.0993 0.1914 810 LEU A O 5814 C CB . LEU A 799 ? 1.2527 1.1533 0.4757 0.1894 -0.0809 0.2157 810 LEU A CB 5815 C CG . LEU A 799 ? 1.2839 1.1662 0.4820 0.2032 -0.0788 0.2007 810 LEU A CG 5816 C CD1 . LEU A 799 ? 1.2147 1.1109 0.4211 0.2068 -0.0645 0.2091 810 LEU A CD1 5817 C CD2 . LEU A 799 ? 1.2534 1.1297 0.4268 0.2189 -0.0810 0.1947 810 LEU A CD2 5818 N N . THR A 800 ? 1.3022 1.1786 0.5373 0.1655 -0.0805 0.2018 811 THR A N 5819 C CA . THR A 800 ? 1.1839 1.0351 0.4098 0.1618 -0.0872 0.1856 811 THR A CA 5820 C C . THR A 800 ? 1.3061 1.1475 0.5150 0.1756 -0.0825 0.1770 811 THR A C 5821 O O . THR A 800 ? 1.4185 1.2789 0.6337 0.1816 -0.0696 0.1879 811 THR A O 5822 C CB . THR A 800 ? 1.2594 1.1167 0.5031 0.1443 -0.0841 0.1914 811 THR A CB 5823 O OG1 . THR A 800 ? 1.2184 1.0851 0.4847 0.1291 -0.0848 0.1992 811 THR A OG1 5824 C CG2 . THR A 800 ? 1.1280 0.9632 0.3802 0.1339 -0.0920 0.1712 811 THR A CG2 5825 N N . TYR A 801 ? 1.3940 1.2044 0.5808 0.1803 -0.0931 0.1581 812 TYR A N 5826 C CA . TYR A 801 ? 1.3932 1.1855 0.5579 0.1940 -0.0893 0.1481 812 TYR A CA 5827 C C . TYR A 801 ? 1.4975 1.2612 0.6545 0.1863 -0.0998 0.1322 812 TYR A C 5828 O O . TYR A 801 ? 1.5369 1.2798 0.6868 0.1791 -0.1155 0.1191 812 TYR A O 5829 C CB . TYR A 801 ? 1.2777 1.0555 0.4137 0.2097 -0.0919 0.1399 812 TYR A CB 5830 C CG . TYR A 801 ? 1.6165 1.3638 0.7201 0.2242 -0.0898 0.1259 812 TYR A CG 5831 C CD1 . TYR A 801 ? 1.8275 1.5813 0.9233 0.2413 -0.0727 0.1337 812 TYR A CD1 5832 C CD2 . TYR A 801 ? 1.7452 1.4558 0.8251 0.2208 -0.1051 0.1057 812 TYR A CD2 5833 C CE1 . TYR A 801 ? 1.9529 1.6735 1.0146 0.2568 -0.0693 0.1211 812 TYR A CE1 5834 C CE2 . TYR A 801 ? 1.8658 1.5431 0.9121 0.2334 -0.1035 0.0923 812 TYR A CE2 5835 C CZ . TYR A 801 ? 1.9788 1.6592 1.0142 0.2525 -0.0848 0.0998 812 TYR A CZ 5836 O OH . TYR A 801 ? 2.0680 1.7100 1.0657 0.2669 -0.0816 0.0867 812 TYR A OH 5837 N N . SER A 802 ? 1.3515 1.1168 0.5133 0.1867 -0.0915 0.1346 813 SER A N 5838 C CA . SER A 802 ? 1.3343 1.0777 0.5012 0.1766 -0.1000 0.1191 813 SER A CA 5839 C C . SER A 802 ? 1.3684 1.0846 0.5034 0.1939 -0.0966 0.1101 813 SER A C 5840 O O . SER A 802 ? 1.4450 1.1690 0.5669 0.2115 -0.0813 0.1210 813 SER A O 5841 C CB . SER A 802 ? 1.5070 1.2735 0.7126 0.1585 -0.0944 0.1268 813 SER A CB 5842 O OG . SER A 802 ? 1.4780 1.2569 0.6815 0.1681 -0.0799 0.1383 813 SER A OG 5843 N N . LYS A 803 ? 1.5817 1.2260 0.5894 0.0059 -0.1733 0.0051 814 LYS A N 5844 C CA . LYS A 803 ? 1.6661 1.2414 0.6136 0.0046 -0.1687 -0.0196 814 LYS A CA 5845 C C . LYS A 803 ? 1.6868 1.2778 0.6839 0.0310 -0.1402 -0.0306 814 LYS A C 5846 O O . LYS A 803 ? 1.6667 1.3287 0.7558 0.0477 -0.1232 -0.0190 814 LYS A O 5847 C CB . LYS A 803 ? 1.6680 1.2248 0.6159 -0.0314 -0.2180 -0.0166 814 LYS A CB 5848 C CG . LYS A 803 ? 1.7862 1.2803 0.6535 -0.0536 -0.2301 -0.0249 814 LYS A CG 5849 C CD . LYS A 803 ? 1.8787 1.3984 0.7408 -0.0626 -0.2371 -0.0071 814 LYS A CD 5850 C CE . LYS A 803 ? 2.1348 1.5907 0.9158 -0.0878 -0.2548 -0.0137 814 LYS A CE 5851 N NZ . LYS A 803 ? 2.1640 1.6011 0.9524 -0.1210 -0.3002 -0.0100 814 LYS A NZ 5852 N N . ALA A 804 ? 1.8535 1.3794 0.7959 0.0332 -0.1345 -0.0521 815 ALA A N 5853 C CA . ALA A 804 ? 1.8077 1.3487 0.8047 0.0558 -0.1101 -0.0611 815 ALA A CA 5854 C C . ALA A 804 ? 1.6987 1.2770 0.7717 0.0371 -0.1471 -0.0524 815 ALA A C 5855 O O . ALA A 804 ? 1.8231 1.3979 0.8897 0.0057 -0.1916 -0.0426 815 ALA A O 5856 C CB . ALA A 804 ? 1.5107 0.9620 0.4166 0.0677 -0.0861 -0.0864 815 ALA A CB 5857 N N . LYS A 805 ? 1.4002 1.0161 0.5469 0.0562 -0.1286 -0.0534 816 LYS A N 5858 C CA . LYS A 805 ? 1.3735 1.0189 0.5882 0.0420 -0.1574 -0.0465 816 LYS A CA 5859 C C . LYS A 805 ? 1.4755 1.0471 0.6292 0.0252 -0.1780 -0.0625 816 LYS A C 5860 O O . LYS A 805 ? 1.5337 1.0519 0.6395 0.0423 -0.1512 -0.0818 816 LYS A O 5861 C CB . LYS A 805 ? 1.2933 0.9961 0.5964 0.0671 -0.1301 -0.0430 816 LYS A CB 5862 C CG . LYS A 805 ? 1.1542 0.8911 0.5303 0.0554 -0.1547 -0.0346 816 LYS A CG 5863 C CD . LYS A 805 ? 0.9966 0.7825 0.4228 0.0349 -0.1856 -0.0124 816 LYS A CD 5864 C CE . LYS A 805 ? 1.1317 0.9404 0.6188 0.0213 -0.2111 -0.0029 816 LYS A CE 5865 N NZ . LYS A 805 ? 1.1482 1.0039 0.6874 0.0042 -0.2378 0.0221 816 LYS A NZ 5866 N N . GLU A 806 ? 1.4301 0.9983 0.5867 -0.0085 -0.2254 -0.0524 817 GLU A N 5867 C CA . GLU A 806 ? 1.4601 0.9585 0.5597 -0.0314 -0.2520 -0.0647 817 GLU A CA 5868 C C . GLU A 806 ? 1.4404 0.9448 0.5905 -0.0180 -0.2399 -0.0718 817 GLU A C 5869 O O . GLU A 806 ? 1.4361 1.0101 0.6838 -0.0145 -0.2445 -0.0562 817 GLU A O 5870 C CB . GLU A 806 ? 1.4545 0.9623 0.5621 -0.0726 -0.3085 -0.0451 817 GLU A CB 5871 C CG . GLU A 806 ? 1.6553 1.1464 0.7058 -0.0912 -0.3244 -0.0378 817 GLU A CG 5872 C CD . GLU A 806 ? 1.9005 1.3000 0.8474 -0.1026 -0.3190 -0.0590 817 GLU A CD 5873 O OE1 . GLU A 806 ? 2.0699 1.4125 0.9831 -0.1087 -0.3218 -0.0747 817 GLU A OE1 5874 O OE2 . GLU A 806 ? 1.8889 1.2710 0.7874 -0.1054 -0.3114 -0.0591 817 GLU A OE2 5875 N N . ILE A 807 ? 1.6356 1.0626 0.7150 -0.0101 -0.2230 -0.0948 818 ILE A N 5876 C CA . ILE A 807 ? 1.5435 0.9687 0.6625 0.0054 -0.2076 -0.1021 818 ILE A CA 5877 C C . ILE A 807 ? 1.6649 1.1015 0.8281 -0.0244 -0.2509 -0.0913 818 ILE A C 5878 O O . ILE A 807 ? 1.6503 1.1171 0.8797 -0.0136 -0.2434 -0.0881 818 ILE A O 5879 C CB . ILE A 807 ? 1.5886 0.9192 0.6145 0.0224 -0.1767 -0.1284 818 ILE A CB 5880 C CG1 . ILE A 807 ? 1.6031 0.9434 0.6813 0.0469 -0.1518 -0.1326 818 ILE A CG1 5881 C CG2 . ILE A 807 ? 1.6184 0.8515 0.5378 -0.0127 -0.2106 -0.1419 818 ILE A CG2 5882 C CD1 . ILE A 807 ? 1.7260 0.9805 0.7250 0.0719 -0.1124 -0.1549 818 ILE A CD1 5883 N N . THR A 808 ? 1.6740 1.0897 0.8030 -0.0627 -0.2967 -0.0828 819 THR A N 5884 C CA . THR A 808 ? 1.6365 1.0692 0.8127 -0.0938 -0.3403 -0.0668 819 THR A CA 5885 C C . THR A 808 ? 1.6541 1.1917 0.9541 -0.0883 -0.3449 -0.0393 819 THR A C 5886 O O . THR A 808 ? 1.6796 1.2454 1.0426 -0.0998 -0.3638 -0.0258 819 THR A O 5887 C CB . THR A 808 ? 1.6447 1.0342 0.7572 -0.1392 -0.3918 -0.0591 819 THR A CB 5888 O OG1 . THR A 808 ? 1.5504 0.9695 0.6553 -0.1410 -0.3932 -0.0477 819 THR A OG1 5889 C CG2 . THR A 808 ? 1.6090 0.8895 0.6113 -0.1508 -0.3891 -0.0844 819 THR A CG2 5890 N N . GLU A 809 ? 1.6037 1.1947 0.9350 -0.0707 -0.3259 -0.0306 820 GLU A N 5891 C CA . GLU A 809 ? 1.4490 1.1305 0.8866 -0.0648 -0.3269 -0.0054 820 GLU A CA 5892 C C . GLU A 809 ? 1.4398 1.1604 0.9444 -0.0348 -0.2924 -0.0092 820 GLU A C 5893 O O . GLU A 809 ? 1.3459 1.1309 0.9349 -0.0309 -0.2926 0.0095 820 GLU A O 5894 C CB . GLU A 809 ? 1.4139 1.1317 0.8552 -0.0599 -0.3214 0.0061 820 GLU A CB 5895 C CG . GLU A 809 ? 1.7225 1.4158 1.1126 -0.0927 -0.3615 0.0177 820 GLU A CG 5896 C CD . GLU A 809 ? 1.6711 1.3965 1.0607 -0.0866 -0.3543 0.0292 820 GLU A CD 5897 O OE1 . GLU A 809 ? 1.6075 1.3836 1.0516 -0.0600 -0.3223 0.0325 820 GLU A OE1 5898 O OE2 . GLU A 809 ? 1.5824 1.2799 0.9141 -0.1102 -0.3820 0.0358 820 GLU A OE2 5899 N N . LEU A 810 ? 1.4590 1.1386 0.9242 -0.0137 -0.2622 -0.0318 821 LEU A N 5900 C CA . LEU A 810 ? 1.3058 1.0207 0.8309 0.0130 -0.2319 -0.0336 821 LEU A CA 5901 C C . LEU A 810 ? 1.2523 0.9204 0.7601 0.0148 -0.2296 -0.0468 821 LEU A C 5902 O O . LEU A 810 ? 1.2467 0.9291 0.7855 0.0390 -0.2015 -0.0514 821 LEU A O 5903 C CB . LEU A 810 ? 1.2574 0.9913 0.7797 0.0436 -0.1910 -0.0403 821 LEU A CB 5904 C CG . LEU A 810 ? 1.3699 1.0421 0.8031 0.0553 -0.1694 -0.0593 821 LEU A CG 5905 C CD1 . LEU A 810 ? 1.5064 1.1407 0.9211 0.0783 -0.1402 -0.0747 821 LEU A CD1 5906 C CD2 . LEU A 810 ? 1.2746 0.9823 0.7117 0.0710 -0.1460 -0.0541 821 LEU A CD2 5907 N N . LEU A 811 ? 1.3591 0.9705 0.8171 -0.0128 -0.2611 -0.0511 822 LEU A N 5908 C CA . LEU A 811 ? 1.3163 0.8796 0.7587 -0.0166 -0.2647 -0.0612 822 LEU A CA 5909 C C . LEU A 811 ? 1.3453 0.9387 0.8479 -0.0434 -0.3011 -0.0412 822 LEU A C 5910 O O . LEU A 811 ? 1.4134 1.0469 0.9488 -0.0639 -0.3288 -0.0208 822 LEU A O 5911 C CB . LEU A 811 ? 1.3400 0.8015 0.6692 -0.0288 -0.2707 -0.0832 822 LEU A CB 5912 C CG . LEU A 811 ? 1.3087 0.7141 0.5818 0.0037 -0.2263 -0.1066 822 LEU A CG 5913 C CD1 . LEU A 811 ? 1.2264 0.6976 0.5567 0.0417 -0.1846 -0.1016 822 LEU A CD1 5914 C CD2 . LEU A 811 ? 1.4312 0.7478 0.5849 -0.0043 -0.2251 -0.1257 822 LEU A CD2 5915 N N . GLY A 812 ? 1.3776 0.9534 0.8980 -0.0418 -0.2996 -0.0445 823 GLY A N 5916 C CA . GLY A 812 ? 1.2721 0.8758 0.8519 -0.0655 -0.3305 -0.0241 823 GLY A CA 5917 C C . GLY A 812 ? 1.2405 0.8249 0.8390 -0.0570 -0.3199 -0.0295 823 GLY A C 5918 O O . GLY A 812 ? 1.1491 0.6943 0.7117 -0.0328 -0.2896 -0.0492 823 GLY A O 5919 N N . SER A 813 ? 1.2164 0.8300 0.8742 -0.0759 -0.3439 -0.0094 824 SER A N 5920 C CA . SER A 813 ? 1.2469 0.8471 0.9290 -0.0700 -0.3362 -0.0108 824 SER A CA 5921 C C . SER A 813 ? 1.2584 0.9365 1.0406 -0.0695 -0.3388 0.0159 824 SER A C 5922 O O . SER A 813 ? 1.2547 0.9860 1.0827 -0.0809 -0.3541 0.0374 824 SER A O 5923 C CB . SER A 813 ? 1.3642 0.8881 0.9910 -0.1018 -0.3677 -0.0166 824 SER A CB 5924 O OG . SER A 813 ? 1.3293 0.8837 0.9993 -0.1371 -0.4091 0.0102 824 SER A OG 5925 N N A ARG A 814 ? 1.2322 0.9143 1.0463 -0.0551 -0.3220 0.0157 825 ARG A N 5926 N N B ARG A 814 ? 1.2295 0.9119 1.0438 -0.0551 -0.3220 0.0157 825 ARG A N 5927 C CA A ARG A 814 ? 1.1224 0.8688 1.0233 -0.0543 -0.3217 0.0401 825 ARG A CA 5928 C CA B ARG A 814 ? 1.1225 0.8692 1.0236 -0.0544 -0.3218 0.0402 825 ARG A CA 5929 C C A ARG A 814 ? 1.0848 0.8086 1.0004 -0.0809 -0.3493 0.0527 825 ARG A C 5930 C C B ARG A 814 ? 1.0821 0.8062 0.9980 -0.0808 -0.3492 0.0528 825 ARG A C 5931 O O A ARG A 814 ? 1.1205 0.7912 1.0040 -0.0798 -0.3458 0.0395 825 ARG A O 5932 O O B ARG A 814 ? 1.1200 0.7913 1.0040 -0.0794 -0.3455 0.0395 825 ARG A O 5933 C CB A ARG A 814 ? 1.1089 0.8839 1.0407 -0.0207 -0.2840 0.0352 825 ARG A CB 5934 C CB B ARG A 814 ? 1.1089 0.8850 1.0414 -0.0208 -0.2841 0.0355 825 ARG A CB 5935 C CG A ARG A 814 ? 1.0800 0.9221 1.0926 -0.0168 -0.2782 0.0590 825 ARG A CG 5936 C CG B ARG A 814 ? 1.0820 0.9245 1.0953 -0.0172 -0.2785 0.0594 825 ARG A CG 5937 C CD A ARG A 814 ? 1.1062 0.9745 1.1400 0.0130 -0.2440 0.0541 825 ARG A CD 5938 C CD B ARG A 814 ? 1.1045 0.9695 1.1391 0.0119 -0.2452 0.0546 825 ARG A CD 5939 N NE A ARG A 814 ? 1.0200 0.9506 1.1139 0.0183 -0.2344 0.0732 825 ARG A NE 5940 N NE B ARG A 814 ? 1.1540 1.0297 1.1660 0.0329 -0.2226 0.0412 825 ARG A NE 5941 C CZ A ARG A 814 ? 0.9169 0.8815 1.0179 0.0295 -0.2203 0.0734 825 ARG A CZ 5942 C CZ B ARG A 814 ? 1.2405 1.0826 1.2097 0.0503 -0.2050 0.0225 825 ARG A CZ 5943 N NH1 A ARG A 814 ? 0.9311 0.9419 1.0802 0.0338 -0.2101 0.0903 825 ARG A NH1 5944 N NH1 B ARG A 814 ? 1.2395 1.0992 1.1965 0.0680 -0.1850 0.0151 825 ARG A NH1 5945 N NH2 A ARG A 814 ? 0.9035 0.8519 0.9606 0.0367 -0.2146 0.0570 825 ARG A NH2 5946 N NH2 B ARG A 814 ? 1.2100 1.0002 1.1500 0.0508 -0.2059 0.0131 825 ARG A NH2 5947 N N . ALA A 815 ? 0.8742 0.6388 0.8410 -0.1046 -0.3759 0.0807 826 ALA A N 5948 C CA . ALA A 815 ? 0.9102 0.6614 0.8994 -0.1337 -0.4055 0.0985 826 ALA A CA 5949 C C . ALA A 815 ? 1.0270 0.7999 1.0690 -0.1189 -0.3858 0.1069 826 ALA A C 5950 O O . ALA A 815 ? 1.0227 0.8537 1.1200 -0.0961 -0.3602 0.1173 826 ALA A O 5951 C CB . ALA A 815 ? 0.9185 0.7169 0.9579 -0.1609 -0.4372 0.1319 826 ALA A CB 5952 N N . LEU A 816 ? 0.9362 0.6570 0.9555 -0.1331 -0.3981 0.1021 827 LEU A N 5953 C CA . LEU A 816 ? 0.8951 0.6308 0.9612 -0.1232 -0.3837 0.1122 827 LEU A CA 5954 C C . LEU A 816 ? 1.0622 0.7860 1.1526 -0.1601 -0.4195 0.1353 827 LEU A C 5955 O O . LEU A 816 ? 1.2898 1.0193 1.3837 -0.1909 -0.4537 0.1513 827 LEU A O 5956 C CB . LEU A 816 ? 0.8745 0.5563 0.8910 -0.0993 -0.3578 0.0842 827 LEU A CB 5957 C CG . LEU A 816 ? 1.0435 0.7299 1.0281 -0.0668 -0.3264 0.0621 827 LEU A CG 5958 C CD1 . LEU A 816 ? 1.1086 0.7336 1.0383 -0.0458 -0.3041 0.0371 827 LEU A CD1 5959 C CD2 . LEU A 816 ? 0.7606 0.5253 0.8084 -0.0428 -0.3008 0.0749 827 LEU A CD2 5960 N N . LEU A 817 ? 1.0699 0.7796 1.1796 -0.1584 -0.4133 0.1398 828 LEU A N 5961 C CA . LEU A 817 ? 1.2124 0.9027 1.3402 -0.1950 -0.4473 0.1607 828 LEU A CA 5962 C C . LEU A 817 ? 1.4486 1.0436 1.5019 -0.2041 -0.4542 0.1358 828 LEU A C 5963 O O . LEU A 817 ? 1.7231 1.2877 1.7443 -0.1736 -0.4226 0.1122 828 LEU A O 5964 C CB . LEU A 817 ? 1.2550 1.0084 1.4730 -0.1895 -0.4362 0.1927 828 LEU A CB 5965 C CG . LEU A 817 ? 1.2943 1.0809 1.5402 -0.1488 -0.3916 0.1874 828 LEU A CG 5966 C CD1 . LEU A 817 ? 1.3607 1.0869 1.5603 -0.1339 -0.3756 0.1632 828 LEU A CD1 5967 C CD2 . LEU A 817 ? 1.1669 1.0204 1.5001 -0.1479 -0.3834 0.2236 828 LEU A CD2 5968 N N . ASN A 818 ? 1.4951 1.0400 1.5188 -0.2463 -0.4952 0.1420 829 ASN A N 5969 C CA . ASN A 818 ? 1.4041 0.9860 1.4655 -0.2850 -0.5365 0.1731 829 ASN A CA 5970 C C . ASN A 818 ? 1.5642 1.1044 1.5500 -0.3027 -0.5593 0.1557 829 ASN A C 5971 O O . ASN A 818 ? 1.5118 1.1048 1.5282 -0.3131 -0.5754 0.1747 829 ASN A O 5972 C CB . ASN A 818 ? 1.2473 0.8017 1.3253 -0.3259 -0.5723 0.1953 829 ASN A CB 5973 C CG . ASN A 818 ? 1.2767 0.8845 1.4412 -0.3122 -0.5527 0.2208 829 ASN A CG 5974 O OD1 . ASN A 818 ? 1.3857 1.0636 1.6348 -0.3269 -0.5659 0.2609 829 ASN A OD1 5975 N ND2 . ASN A 818 ? 1.1840 0.7597 1.3282 -0.2829 -0.5196 0.1998 829 ASN A ND2 5976 N N . GLY A 819 ? 1.5909 1.0326 1.4751 -0.3049 -0.5587 0.1203 830 GLY A N 5977 C CA . GLY A 819 ? 1.6592 1.0494 1.4554 -0.3140 -0.5704 0.0970 830 GLY A CA 5978 C C . GLY A 819 ? 1.7218 1.0872 1.4684 -0.2668 -0.5221 0.0615 830 GLY A C 5979 O O . GLY A 819 ? 1.3686 0.6800 1.0313 -0.2659 -0.5209 0.0366 830 GLY A O 5980 N N . ASN A 820 ? 1.5369 0.9430 1.3361 -0.2283 -0.4826 0.0615 831 ASN A N 5981 C CA . ASN A 820 ? 1.2154 0.6095 0.9829 -0.1827 -0.4363 0.0343 831 ASN A CA 5982 C C . ASN A 820 ? 1.2389 0.6931 1.0220 -0.1629 -0.4212 0.0335 831 ASN A C 5983 O O . ASN A 820 ? 1.1459 0.6722 0.9910 -0.1738 -0.4361 0.0584 831 ASN A O 5984 C CB . ASN A 820 ? 1.5678 0.9938 1.3917 -0.1516 -0.4036 0.0396 831 ASN A CB 5985 C CG . ASN A 820 ? 1.6376 0.9847 1.4238 -0.1577 -0.4042 0.0299 831 ASN A CG 5986 O OD1 . ASN A 820 ? 1.6686 0.9452 1.3863 -0.1377 -0.3814 0.0033 831 ASN A OD1 5987 N ND2 . ASN A 820 ? 1.6649 1.0233 1.4979 -0.1838 -0.4281 0.0534 831 ASN A ND2 5988 N N . SER A 821 ? 1.3454 0.7688 1.0735 -0.1328 -0.3897 0.0066 832 SER A N 5989 C CA . SER A 821 ? 1.3029 0.7785 1.0418 -0.1113 -0.3711 0.0040 832 SER A CA 5990 C C . SER A 821 ? 1.2704 0.7178 0.9658 -0.0716 -0.3283 -0.0215 832 SER A C 5991 O O . SER A 821 ? 1.2361 0.6177 0.8870 -0.0608 -0.3133 -0.0375 832 SER A O 5992 C CB . SER A 821 ? 1.3196 0.7800 1.0149 -0.1399 -0.4023 0.0043 832 SER A CB 5993 O OG . SER A 821 ? 1.3971 0.7585 0.9853 -0.1479 -0.4054 -0.0231 832 SER A OG 5994 N N . ARG A 822 ? 1.1380 0.6363 0.8494 -0.0498 -0.3079 -0.0225 833 ARG A N 5995 C CA . ARG A 822 ? 1.1984 0.6792 0.8742 -0.0137 -0.2686 -0.0420 833 ARG A CA 5996 C C . ARG A 822 ? 1.2757 0.7715 0.9228 -0.0112 -0.2660 -0.0480 833 ARG A C 5997 O O . ARG A 822 ? 1.3420 0.9074 1.0409 -0.0154 -0.2737 -0.0321 833 ARG A O 5998 C CB . ARG A 822 ? 1.1245 0.6679 0.8696 0.0179 -0.2380 -0.0325 833 ARG A CB 5999 C CG . ARG A 822 ? 1.1606 0.6861 0.9290 0.0214 -0.2342 -0.0275 833 ARG A CG 6000 C CD . ARG A 822 ? 1.3363 0.7741 1.0343 0.0350 -0.2168 -0.0481 833 ARG A CD 6001 N NE . ARG A 822 ? 1.3904 0.7601 1.0560 0.0076 -0.2421 -0.0506 833 ARG A NE 6002 C CZ . ARG A 822 ? 1.4030 0.7532 1.0880 0.0121 -0.2370 -0.0455 833 ARG A CZ 6003 N NH1 . ARG A 822 ? 1.3435 0.7389 1.0799 0.0433 -0.2082 -0.0370 833 ARG A NH1 6004 N NH2 . ARG A 822 ? 1.4244 0.7090 1.0763 -0.0163 -0.2623 -0.0475 833 ARG A NH2 6005 N N . ASN A 823 ? 1.2791 0.7060 0.8414 -0.0037 -0.2533 -0.0702 834 ASN A N 6006 C CA . ASN A 823 ? 1.3538 0.7881 0.8812 -0.0010 -0.2492 -0.0763 834 ASN A CA 6007 C C . ASN A 823 ? 1.2253 0.7281 0.8009 0.0338 -0.2137 -0.0719 834 ASN A C 6008 O O . ASN A 823 ? 1.2355 0.7405 0.8252 0.0634 -0.1817 -0.0757 834 ASN A O 6009 C CB . ASN A 823 ? 1.5405 0.8750 0.9564 -0.0013 -0.2416 -0.1015 834 ASN A CB 6010 C CG . ASN A 823 ? 1.5715 0.8293 0.9264 -0.0416 -0.2809 -0.1068 834 ASN A CG 6011 O OD1 . ASN A 823 ? 1.3551 0.6443 0.7551 -0.0730 -0.3189 -0.0883 834 ASN A OD1 6012 N ND2 . ASN A 823 ? 1.6320 0.7862 0.8820 -0.0417 -0.2716 -0.1309 834 ASN A ND2 6013 N N . THR A 824 ? 1.2003 0.7587 0.8021 0.0289 -0.2208 -0.0619 835 THR A N 6014 C CA . THR A 824 ? 1.0804 0.7035 0.7265 0.0564 -0.1915 -0.0564 835 THR A CA 6015 C C . THR A 824 ? 1.1188 0.7496 0.7323 0.0559 -0.1895 -0.0596 835 THR A C 6016 O O . THR A 824 ? 1.1046 0.7158 0.6855 0.0299 -0.2181 -0.0585 835 THR A O 6017 C CB . THR A 824 ? 1.0652 0.7679 0.8021 0.0544 -0.1976 -0.0349 835 THR A CB 6018 O OG1 . THR A 824 ? 1.0006 0.7213 0.7563 0.0249 -0.2318 -0.0210 835 THR A OG1 6019 C CG2 . THR A 824 ? 1.1225 0.8243 0.8944 0.0609 -0.1922 -0.0308 835 THR A CG2 6020 N N . LYS A 825 ? 1.2295 0.8906 0.8537 0.0836 -0.1569 -0.0611 836 LYS A N 6021 C CA . LYS A 825 ? 1.2257 0.8996 0.8249 0.0860 -0.1506 -0.0623 836 LYS A CA 6022 C C . LYS A 825 ? 1.2056 0.9635 0.8777 0.0934 -0.1435 -0.0456 836 LYS A C 6023 O O . LYS A 825 ? 1.2676 1.0665 0.9976 0.1048 -0.1326 -0.0371 836 LYS A O 6024 C CB . LYS A 825 ? 1.0013 0.6313 0.5409 0.1116 -0.1160 -0.0777 836 LYS A CB 6025 C CG . LYS A 825 ? 0.9626 0.6214 0.5436 0.1443 -0.0800 -0.0739 836 LYS A CG 6026 C CD . LYS A 825 ? 1.1116 0.7301 0.6378 0.1714 -0.0430 -0.0846 836 LYS A CD 6027 C CE . LYS A 825 ? 1.1932 0.8611 0.7744 0.2033 -0.0083 -0.0729 836 LYS A CE 6028 N NZ . LYS A 825 ? 1.4036 1.0621 1.0130 0.2137 -0.0026 -0.0704 836 LYS A NZ 6029 N N . ALA A 826 ? 1.1325 0.9114 0.7973 0.0858 -0.1501 -0.0408 837 ALA A N 6030 C CA . ALA A 826 ? 0.9863 0.8356 0.7119 0.0907 -0.1437 -0.0257 837 ALA A CA 6031 C C . ALA A 826 ? 1.0522 0.9232 0.7809 0.1164 -0.1093 -0.0279 837 ALA A C 6032 O O . ALA A 826 ? 1.1805 1.1004 0.9632 0.1264 -0.0967 -0.0182 837 ALA A O 6033 C CB . ALA A 826 ? 0.8912 0.7553 0.6138 0.0713 -0.1660 -0.0162 837 ALA A CB 6034 N N . THR A 827 ? 1.0324 0.8660 0.7013 0.1257 -0.0945 -0.0389 838 THR A N 6035 C CA . THR A 827 ? 1.0253 0.8783 0.6970 0.1509 -0.0600 -0.0381 838 THR A CA 6036 C C . THR A 827 ? 1.1533 0.9496 0.7734 0.1704 -0.0362 -0.0513 838 THR A C 6037 O O . THR A 827 ? 1.0249 0.7576 0.5922 0.1614 -0.0478 -0.0644 838 THR A O 6038 C CB . THR A 827 ? 0.9081 0.7752 0.5590 0.1491 -0.0555 -0.0348 838 THR A CB 6039 O OG1 . THR A 827 ? 0.9791 0.7906 0.5594 0.1343 -0.0718 -0.0452 838 THR A OG1 6040 C CG2 . THR A 827 ? 0.8559 0.7815 0.5624 0.1361 -0.0703 -0.0197 838 THR A CG2 6041 N N . ALA A 828 ? 1.2187 1.0364 0.8539 0.1967 -0.0023 -0.0462 839 ALA A N 6042 C CA . ALA A 828 ? 1.1967 0.9630 0.7868 0.2212 0.0282 -0.0552 839 ALA A CA 6043 C C . ALA A 828 ? 1.2602 0.9854 0.7782 0.2270 0.0444 -0.0640 839 ALA A C 6044 O O . ALA A 828 ? 1.4076 1.0693 0.8646 0.2440 0.0685 -0.0755 839 ALA A O 6045 C CB . ALA A 828 ? 1.0624 0.8754 0.7100 0.2482 0.0580 -0.0402 839 ALA A CB 6046 N N . ARG A 829 ? 1.2027 0.9610 0.7251 0.2136 0.0329 -0.0580 840 ARG A N 6047 C CA . ARG A 829 ? 1.1623 0.8902 0.6207 0.2184 0.0484 -0.0632 840 ARG A CA 6048 C C . ARG A 829 ? 1.1719 0.9013 0.6091 0.1886 0.0142 -0.0636 840 ARG A C 6049 O O . ARG A 829 ? 1.1315 0.9067 0.6232 0.1698 -0.0139 -0.0541 840 ARG A O 6050 C CB . ARG A 829 ? 1.1110 0.8930 0.6078 0.2423 0.0830 -0.0473 840 ARG A CB 6051 C CG . ARG A 829 ? 1.0674 0.8674 0.6050 0.2719 0.1156 -0.0383 840 ARG A CG 6052 C CD . ARG A 829 ? 1.3258 1.0476 0.7936 0.2950 0.1461 -0.0516 840 ARG A CD 6053 N NE . ARG A 829 ? 1.6824 1.3855 1.1033 0.3139 0.1807 -0.0501 840 ARG A NE 6054 C CZ . ARG A 829 ? 1.9274 1.6649 1.3822 0.3449 0.2219 -0.0323 840 ARG A CZ 6055 N NH1 . ARG A 829 ? 1.8947 1.6871 1.4298 0.3587 0.2305 -0.0144 840 ARG A NH1 6056 N NH2 . ARG A 829 ? 2.0724 1.7907 1.4820 0.3617 0.2544 -0.0300 840 ARG A NH2 6057 N N . ARG A 830 ? 1.3718 1.0493 0.7283 0.1854 0.0183 -0.0731 841 ARG A N 6058 C CA . ARG A 830 ? 1.2792 0.9585 0.6114 0.1590 -0.0119 -0.0702 841 ARG A CA 6059 C C . ARG A 830 ? 1.4014 1.0857 0.7016 0.1715 0.0140 -0.0659 841 ARG A C 6060 O O . ARG A 830 ? 1.5464 1.2123 0.8223 0.1988 0.0541 -0.0690 841 ARG A O 6061 C CB . ARG A 830 ? 1.3795 0.9822 0.6332 0.1338 -0.0426 -0.0850 841 ARG A CB 6062 C CG . ARG A 830 ? 1.6024 1.1143 0.7622 0.1478 -0.0176 -0.1053 841 ARG A CG 6063 C CD . ARG A 830 ? 1.6566 1.0900 0.7430 0.1180 -0.0532 -0.1199 841 ARG A CD 6064 N NE . ARG A 830 ? 1.7677 1.1744 0.7907 0.0907 -0.0811 -0.1198 841 ARG A NE 6065 C CZ . ARG A 830 ? 2.0812 1.4158 0.9991 0.0929 -0.0658 -0.1330 841 ARG A CZ 6066 N NH1 . ARG A 830 ? 2.1108 1.3919 0.9771 0.1239 -0.0191 -0.1473 841 ARG A NH1 6067 N NH2 . ARG A 830 ? 2.2606 1.5752 1.1238 0.0650 -0.0958 -0.1302 841 ARG A NH2 6068 N N . THR A 831 ? 1.3929 1.1028 0.6953 0.1529 -0.0072 -0.0564 842 THR A N 6069 C CA . THR A 831 ? 1.3112 1.0377 0.5966 0.1636 0.0162 -0.0484 842 THR A CA 6070 C C . THR A 831 ? 1.3294 0.9826 0.5061 0.1573 0.0174 -0.0601 842 THR A C 6071 O O . THR A 831 ? 1.4634 1.0610 0.5821 0.1344 -0.0132 -0.0711 842 THR A O 6072 C CB . THR A 831 ? 1.3179 1.1147 0.6678 0.1498 -0.0022 -0.0293 842 THR A CB 6073 O OG1 . THR A 831 ? 1.6495 1.4658 0.9898 0.1620 0.0240 -0.0201 842 THR A OG1 6074 C CG2 . THR A 831 ? 1.3575 1.1390 0.6854 0.1186 -0.0463 -0.0275 842 THR A CG2 6075 N N . ARG A 832 ? 1.4160 1.0688 0.5642 0.1760 0.0521 -0.0560 843 ARG A N 6076 C CA . ARG A 832 ? 1.6413 1.2238 0.6805 0.1726 0.0593 -0.0659 843 ARG A CA 6077 C C . ARG A 832 ? 1.6296 1.2381 0.6634 0.1504 0.0340 -0.0528 843 ARG A C 6078 O O . ARG A 832 ? 1.5692 1.2529 0.6874 0.1449 0.0219 -0.0350 843 ARG A O 6079 C CB . ARG A 832 ? 1.4263 0.9894 0.4332 0.2086 0.1169 -0.0671 843 ARG A CB 6080 C CG . ARG A 832 ? 1.5770 1.0919 0.5628 0.2321 0.1453 -0.0811 843 ARG A CG 6081 C CD . ARG A 832 ? 1.5175 1.0215 0.4832 0.2711 0.2061 -0.0763 843 ARG A CD 6082 N NE . ARG A 832 ? 1.5503 1.0184 0.5175 0.2947 0.2337 -0.0847 843 ARG A NE 6083 C CZ . ARG A 832 ? 1.8235 1.2019 0.7162 0.2937 0.2411 -0.1026 843 ARG A CZ 6084 N NH1 . ARG A 832 ? 1.8319 1.1486 0.6416 0.2690 0.2222 -0.1145 843 ARG A NH1 6085 N NH2 . ARG A 832 ? 1.7391 1.0897 0.6413 0.3167 0.2669 -0.1068 843 ARG A NH2 6086 N N . PRO A 833 ? 1.7233 1.2653 0.6538 0.1370 0.0256 -0.0610 844 PRO A N 6087 C CA . PRO A 833 ? 1.6684 1.2332 0.5890 0.1182 0.0047 -0.0461 844 PRO A CA 6088 C C . PRO A 833 ? 1.5831 1.2001 0.5401 0.1409 0.0427 -0.0304 844 PRO A C 6089 O O . PRO A 833 ? 1.5361 1.1490 0.4906 0.1711 0.0891 -0.0333 844 PRO A O 6090 C CB . PRO A 833 ? 1.6148 1.1014 0.4374 0.0997 -0.0042 -0.0591 844 PRO A CB 6091 C CG . PRO A 833 ? 1.6379 1.0613 0.4235 0.0963 -0.0096 -0.0798 844 PRO A CG 6092 C CD . PRO A 833 ? 1.5871 1.0321 0.4171 0.1315 0.0278 -0.0832 844 PRO A CD 6093 N N . TRP A 834 ? 1.5213 1.1876 0.5142 0.1264 0.0234 -0.0115 845 TRP A N 6094 C CA . TRP A 834 ? 1.4798 1.1931 0.5033 0.1429 0.0550 0.0052 845 TRP A CA 6095 C C . TRP A 834 ? 1.4985 1.2313 0.5157 0.1217 0.0293 0.0220 845 TRP A C 6096 O O . TRP A 834 ? 1.5484 1.2848 0.5755 0.0956 -0.0151 0.0267 845 TRP A O 6097 C CB . TRP A 834 ? 1.2350 1.0254 0.3712 0.1583 0.0714 0.0168 845 TRP A CB 6098 C CG . TRP A 834 ? 1.2099 1.0432 0.4232 0.1399 0.0336 0.0222 845 TRP A CG 6099 C CD1 . TRP A 834 ? 1.1201 0.9510 0.3651 0.1381 0.0202 0.0121 845 TRP A CD1 6100 C CD2 . TRP A 834 ? 1.1438 1.0261 0.4109 0.1225 0.0080 0.0402 845 TRP A CD2 6101 N NE1 . TRP A 834 ? 1.2180 1.0936 0.5320 0.1211 -0.0110 0.0228 845 TRP A NE1 6102 C CE2 . TRP A 834 ? 1.1654 1.0717 0.4941 0.1122 -0.0180 0.0400 845 TRP A CE2 6103 C CE3 . TRP A 834 ? 1.2007 1.1064 0.4691 0.1158 0.0065 0.0575 845 TRP A CE3 6104 C CZ2 . TRP A 834 ? 1.1458 1.0959 0.5350 0.0973 -0.0425 0.0563 845 TRP A CZ2 6105 C CZ3 . TRP A 834 ? 1.0822 1.0310 0.4119 0.1004 -0.0195 0.0734 845 TRP A CZ3 6106 C CH2 . TRP A 834 ? 1.1344 1.1038 0.5230 0.0922 -0.0424 0.0727 845 TRP A CH2 6107 N N . TYR A 835 ? 1.5106 1.2575 0.5142 0.1337 0.0583 0.0338 846 TYR A N 6108 C CA . TYR A 835 ? 1.4999 1.2709 0.5063 0.1163 0.0392 0.0526 846 TYR A CA 6109 C C . TYR A 835 ? 1.3867 1.2194 0.4545 0.1327 0.0705 0.0721 846 TYR A C 6110 O O . TYR A 835 ? 1.3342 1.1710 0.4045 0.1562 0.1134 0.0712 846 TYR A O 6111 C CB . TYR A 835 ? 1.4844 1.2018 0.4093 0.1004 0.0338 0.0459 846 TYR A CB 6112 C CG . TYR A 835 ? 1.6338 1.3288 0.5219 0.1215 0.0825 0.0406 846 TYR A CG 6113 C CD1 . TYR A 835 ? 1.5064 1.2311 0.4040 0.1261 0.1029 0.0581 846 TYR A CD1 6114 C CD2 . TYR A 835 ? 1.6752 1.3183 0.5219 0.1375 0.1089 0.0198 846 TYR A CD2 6115 C CE1 . TYR A 835 ? 1.8478 1.5546 0.7177 0.1458 0.1477 0.0558 846 TYR A CE1 6116 C CE2 . TYR A 835 ? 1.7949 1.4178 0.6134 0.1592 0.1552 0.0178 846 TYR A CE2 6117 C CZ . TYR A 835 ? 1.8469 1.5033 0.6784 0.1632 0.1742 0.0362 846 TYR A CZ 6118 O OH . TYR A 835 ? 1.8433 1.4817 0.6512 0.1851 0.2202 0.0365 846 TYR A OH 6119 N N . ILE A 836 ? 1.2627 1.1451 0.3897 0.1184 0.0488 0.0913 847 ILE A N 6120 C CA . ILE A 836 ? 1.2364 1.1734 0.4194 0.1279 0.0736 0.1110 847 ILE A CA 6121 C C . ILE A 836 ? 1.3949 1.3417 0.5665 0.1118 0.0561 0.1302 847 ILE A C 6122 O O . ILE A 836 ? 1.5752 1.5061 0.7281 0.0915 0.0178 0.1326 847 ILE A O 6123 C CB . ILE A 836 ? 1.0698 1.0670 0.3586 0.1297 0.0717 0.1172 847 ILE A CB 6124 C CG1 . ILE A 836 ? 1.1490 1.1616 0.4788 0.1084 0.0294 0.1222 847 ILE A CG1 6125 C CG2 . ILE A 836 ? 1.2781 1.2717 0.5850 0.1460 0.0891 0.1018 847 ILE A CG2 6126 C CD1 . ILE A 836 ? 0.9284 0.9931 0.3526 0.1086 0.0286 0.1289 847 ILE A CD1 6127 N N . VAL A 837 ? 1.2715 1.2464 0.4574 0.1206 0.0838 0.1468 848 VAL A N 6128 C CA . VAL A 837 ? 1.1773 1.1673 0.3638 0.1066 0.0699 0.1679 848 VAL A CA 6129 C C . VAL A 837 ? 1.3100 1.3614 0.5874 0.1068 0.0780 0.1867 848 VAL A C 6130 O O . VAL A 837 ? 1.0653 1.1459 0.3807 0.1207 0.1093 0.1901 848 VAL A O 6131 C CB . VAL A 837 ? 1.3480 1.3050 0.4698 0.1039 0.0876 0.1691 848 VAL A CB 6132 C CG1 . VAL A 837 ? 1.3455 1.2413 0.3828 0.0905 0.0664 0.1521 848 VAL A CG1 6133 C CG2 . VAL A 837 ? 1.2788 1.2443 0.4094 0.1257 0.1360 0.1670 848 VAL A CG2 6134 N N . ASP A 838 ? 1.1862 1.2552 0.4983 0.0904 0.0491 0.2004 849 ASP A N 6135 C CA . ASP A 838 ? 1.1278 1.2426 0.5133 0.0874 0.0550 0.2185 849 ASP A CA 6136 C C . ASP A 838 ? 1.0896 1.2050 0.4535 0.0792 0.0526 0.2408 849 ASP A C 6137 O O . ASP A 838 ? 1.2539 1.3432 0.5714 0.0691 0.0288 0.2452 849 ASP A O 6138 C CB . ASP A 838 ? 1.0949 1.2270 0.5437 0.0779 0.0286 0.2177 849 ASP A CB 6139 C CG . ASP A 838 ? 1.0485 1.1788 0.5174 0.0844 0.0277 0.1968 849 ASP A CG 6140 O OD1 . ASP A 838 ? 1.1435 1.2766 0.6072 0.0980 0.0542 0.1875 849 ASP A OD1 6141 O OD2 . ASP A 838 ? 1.0132 1.1408 0.5059 0.0768 0.0018 0.1920 849 ASP A OD2 6142 N N . VAL A 839 ? 1.0215 1.1670 0.4196 0.0819 0.0758 0.2568 850 VAL A N 6143 C CA . VAL A 839 ? 1.1436 1.2879 0.5353 0.0723 0.0744 0.2760 850 VAL A CA 6144 C C . VAL A 839 ? 1.2100 1.3902 0.6727 0.0657 0.0752 0.2938 850 VAL A C 6145 O O . VAL A 839 ? 1.2669 1.4748 0.7715 0.0695 0.0958 0.2958 850 VAL A O 6146 C CB . VAL A 839 ? 1.1126 1.2458 0.4662 0.0788 0.1050 0.2773 850 VAL A CB 6147 C CG1 . VAL A 839 ? 1.1440 1.2758 0.4915 0.0683 0.1025 0.2977 850 VAL A CG1 6148 C CG2 . VAL A 839 ? 1.1513 1.2388 0.4260 0.0841 0.1073 0.2582 850 VAL A CG2 6149 N N . SER A 840 ? 1.1173 1.2940 0.5929 0.0548 0.0522 0.3078 851 SER A N 6150 C CA . SER A 840 ? 1.0707 1.2694 0.6054 0.0480 0.0533 0.3243 851 SER A CA 6151 C C . SER A 840 ? 1.0677 1.2578 0.5959 0.0401 0.0501 0.3446 851 SER A C 6152 O O . SER A 840 ? 0.9913 1.1592 0.4741 0.0379 0.0375 0.3474 851 SER A O 6153 C CB . SER A 840 ? 1.1023 1.3009 0.6795 0.0447 0.0313 0.3184 851 SER A CB 6154 O OG . SER A 840 ? 1.0236 1.2046 0.5757 0.0422 0.0038 0.3204 851 SER A OG 6155 N N . GLY A 841 ? 1.1111 1.3157 0.6824 0.0343 0.0606 0.3591 852 GLY A N 6156 C CA . GLY A 841 ? 1.1017 1.2980 0.6730 0.0273 0.0594 0.3795 852 GLY A CA 6157 C C . GLY A 841 ? 1.0812 1.2838 0.7047 0.0198 0.0629 0.3930 852 GLY A C 6158 O O . GLY A 841 ? 0.9723 1.1874 0.6282 0.0177 0.0713 0.3870 852 GLY A O 6159 N N . TYR A 842 ? 1.0796 1.2693 0.7081 0.0151 0.0565 0.4117 853 TYR A N 6160 C CA . TYR A 842 ? 0.9995 1.1841 0.6696 0.0082 0.0619 0.4247 853 TYR A CA 6161 C C . TYR A 842 ? 1.1095 1.2836 0.7757 0.0021 0.0682 0.4448 853 TYR A C 6162 O O . TYR A 842 ? 1.0445 1.2166 0.6762 0.0037 0.0665 0.4500 853 TYR A O 6163 C CB . TYR A 842 ? 0.9288 1.1017 0.6247 0.0122 0.0459 0.4276 853 TYR A CB 6164 C CG . TYR A 842 ? 1.0926 1.2567 0.7755 0.0170 0.0249 0.4383 853 TYR A CG 6165 C CD1 . TYR A 842 ? 1.0792 1.2298 0.7745 0.0158 0.0226 0.4602 853 TYR A CD1 6166 C CD2 . TYR A 842 ? 1.2362 1.4043 0.8948 0.0212 0.0063 0.4273 853 TYR A CD2 6167 C CE1 . TYR A 842 ? 1.2172 1.3640 0.9057 0.0190 0.0016 0.4725 853 TYR A CE1 6168 C CE2 . TYR A 842 ? 1.3647 1.5256 1.0130 0.0216 -0.0165 0.4386 853 TYR A CE2 6169 C CZ . TYR A 842 ? 1.3113 1.4642 0.9768 0.0206 -0.0190 0.4620 853 TYR A CZ 6170 O OH . TYR A 842 ? 1.2929 1.4425 0.9525 0.0201 -0.0429 0.4754 853 TYR A OH 6171 N N . TYR A 843 ? 1.1096 1.2723 0.8071 -0.0056 0.0760 0.4555 854 TYR A N 6172 C CA . TYR A 843 ? 1.1056 1.2551 0.8034 -0.0124 0.0831 0.4747 854 TYR A CA 6173 C C . TYR A 843 ? 1.2059 1.3299 0.9359 -0.0187 0.0876 0.4832 854 TYR A C 6174 O O . TYR A 843 ? 1.1388 1.2603 0.8863 -0.0266 0.0951 0.4741 854 TYR A O 6175 C CB . TYR A 843 ? 0.9806 1.1460 0.6688 -0.0206 0.1007 0.4752 854 TYR A CB 6176 C CG . TYR A 843 ? 1.5163 1.6699 1.1999 -0.0278 0.1078 0.4953 854 TYR A CG 6177 C CD1 . TYR A 843 ? 1.5041 1.6588 1.1536 -0.0228 0.1059 0.5035 854 TYR A CD1 6178 C CD2 . TYR A 843 ? 1.4272 1.5643 1.1361 -0.0408 0.1162 0.5057 854 TYR A CD2 6179 C CE1 . TYR A 843 ? 1.5141 1.6585 1.1593 -0.0291 0.1126 0.5226 854 TYR A CE1 6180 C CE2 . TYR A 843 ? 1.4837 1.6084 1.1880 -0.0476 0.1227 0.5242 854 TYR A CE2 6181 C CZ . TYR A 843 ? 1.5461 1.6770 1.2208 -0.0410 0.1211 0.5331 854 TYR A CZ 6182 O OH . TYR A 843 ? 1.6401 1.7591 1.3101 -0.0475 0.1277 0.5523 854 TYR A OH 6183 N N . THR A 844 ? 1.3309 1.4327 1.0662 -0.0155 0.0835 0.5007 855 THR A N 6184 C CA . THR A 844 ? 1.3850 1.4522 1.1446 -0.0193 0.0914 0.5090 855 THR A CA 6185 C C . THR A 844 ? 1.5296 1.5780 1.2848 -0.0286 0.1014 0.5264 855 THR A C 6186 O O . THR A 844 ? 1.5477 1.6098 1.2848 -0.0275 0.0985 0.5363 855 THR A O 6187 C CB . THR A 844 ? 1.3886 1.4398 1.1668 -0.0042 0.0816 0.5163 855 THR A CB 6188 O OG1 . THR A 844 ? 1.5697 1.6097 1.3485 0.0005 0.0784 0.5378 855 THR A OG1 6189 C CG2 . THR A 844 ? 0.9603 1.0391 0.7348 0.0063 0.0639 0.5059 855 THR A CG2 6190 N N . VAL A 845 ? 1.6137 1.6264 1.3812 -0.0388 0.1133 0.5297 856 VAL A N 6191 C CA . VAL A 845 ? 1.6357 1.6230 1.3990 -0.0490 0.1229 0.5461 856 VAL A CA 6192 C C . VAL A 845 ? 1.7576 1.6997 1.5330 -0.0400 0.1263 0.5585 856 VAL A C 6193 O O . VAL A 845 ? 1.7469 1.6441 1.5226 -0.0509 0.1388 0.5607 856 VAL A O 6194 C CB . VAL A 845 ? 1.5651 1.5420 1.3272 -0.0729 0.1346 0.5411 856 VAL A CB 6195 C CG1 . VAL A 845 ? 1.6251 1.5908 1.3792 -0.0846 0.1421 0.5585 856 VAL A CG1 6196 C CG2 . VAL A 845 ? 1.4304 1.4529 1.1921 -0.0784 0.1325 0.5262 856 VAL A CG2 6197 N N . LYS A 846 ? 1.8783 1.8310 1.6630 -0.0205 0.1150 0.5667 857 LYS A N 6198 C CA . LYS A 846 ? 1.9332 1.8523 1.7370 -0.0069 0.1183 0.5814 857 LYS A CA 6199 C C . LYS A 846 ? 1.9001 1.7772 1.7172 -0.0042 0.1311 0.5711 857 LYS A C 6200 O O . LYS A 846 ? 1.9751 1.8054 1.7831 -0.0164 0.1467 0.5697 857 LYS A O 6201 C CB . LYS A 846 ? 1.9802 1.8749 1.7774 -0.0123 0.1261 0.6012 857 LYS A CB 6202 N N . LYS A 847 ? 1.7667 1.6577 1.6016 0.0107 0.1243 0.5635 858 LYS A N 6203 C CA . LYS A 847 ? 1.7850 1.6365 1.6334 0.0184 0.1376 0.5544 858 LYS A CA 6204 C C . LYS A 847 ? 1.8083 1.6322 1.6369 -0.0006 0.1488 0.5337 858 LYS A C 6205 O O . LYS A 847 ? 2.0038 1.8074 1.8380 0.0051 0.1555 0.5208 858 LYS A O 6206 C CB . LYS A 847 ? 1.8698 1.6748 1.7323 0.0308 0.1522 0.5703 858 LYS A CB 6207 C CG . LYS A 847 ? 1.9000 1.6364 1.7410 0.0170 0.1742 0.5628 858 LYS A CG 6208 C CD . LYS A 847 ? 1.7872 1.4799 1.6348 0.0284 0.1902 0.5498 858 LYS A CD 6209 C CE . LYS A 847 ? 1.7629 1.4491 1.6453 0.0580 0.1977 0.5659 858 LYS A CE 6210 N NZ . LYS A 847 ? 1.7449 1.3942 1.6253 0.0605 0.2096 0.5839 858 LYS A NZ 6211 N N . HIS A 848 ? 1.6630 1.4873 1.4697 -0.0239 0.1504 0.5314 859 HIS A N 6212 C CA . HIS A 848 ? 1.6028 1.4023 1.3922 -0.0466 0.1581 0.5152 859 HIS A CA 6213 C C . HIS A 848 ? 1.4298 1.2824 1.2204 -0.0530 0.1466 0.5005 859 HIS A C 6214 O O . HIS A 848 ? 1.3205 1.1878 1.1215 -0.0402 0.1420 0.4899 859 HIS A O 6215 C CB . HIS A 848 ? 1.7631 1.5354 1.5330 -0.0719 0.1650 0.5223 859 HIS A CB 6216 C CG . HIS A 848 ? 1.9464 1.6627 1.7113 -0.0675 0.1767 0.5363 859 HIS A CG 6217 N ND1 . HIS A 848 ? 1.9623 1.6944 1.7388 -0.0517 0.1735 0.5556 859 HIS A ND1 6218 C CD2 . HIS A 848 ? 2.0533 1.6961 1.8007 -0.0772 0.1913 0.5337 859 HIS A CD2 6219 C CE1 . HIS A 848 ? 2.0217 1.6964 1.7930 -0.0502 0.1864 0.5653 859 HIS A CE1 6220 N NE2 . HIS A 848 ? 2.1104 1.7284 1.8624 -0.0652 0.1977 0.5514 859 HIS A NE2 6221 N N . PHE A 849 ? 1.4743 1.3559 1.2562 -0.0721 0.1431 0.5004 860 PHE A N 6222 C CA . PHE A 849 ? 1.3374 1.2713 1.1219 -0.0780 0.1344 0.4874 860 PHE A CA 6223 C C . PHE A 849 ? 1.2365 1.2184 1.0261 -0.0560 0.1226 0.4868 860 PHE A C 6224 O O . PHE A 849 ? 1.5263 1.5145 1.3135 -0.0450 0.1188 0.5001 860 PHE A O 6225 C CB . PHE A 849 ? 1.4758 1.4310 1.2556 -0.1009 0.1359 0.4909 860 PHE A CB 6226 C CG . PHE A 849 ? 1.6343 1.5406 1.4054 -0.1277 0.1438 0.4938 860 PHE A CG 6227 C CD1 . PHE A 849 ? 1.5758 1.4386 1.3368 -0.1321 0.1519 0.5085 860 PHE A CD1 6228 C CD2 . PHE A 849 ? 1.6527 1.5540 1.4231 -0.1505 0.1413 0.4822 860 PHE A CD2 6229 C CE1 . PHE A 849 ? 1.5931 1.4033 1.3395 -0.1588 0.1586 0.5102 860 PHE A CE1 6230 C CE2 . PHE A 849 ? 1.6044 1.4553 1.3606 -0.1793 0.1453 0.4843 860 PHE A CE2 6231 C CZ . PHE A 849 ? 1.5727 1.3755 1.3151 -0.1834 0.1547 0.4978 860 PHE A CZ 6232 N N . THR A 850 ? 1.0794 1.0917 0.8726 -0.0515 0.1157 0.4714 861 THR A N 6233 C CA . THR A 850 ? 1.1166 1.1716 0.9059 -0.0356 0.1036 0.4675 861 THR A CA 6234 C C . THR A 850 ? 1.0998 1.1906 0.8879 -0.0393 0.1009 0.4492 861 THR A C 6235 O O . THR A 850 ? 1.0110 1.0934 0.8103 -0.0397 0.0984 0.4290 861 THR A O 6236 C CB . THR A 850 ? 1.1449 1.1917 0.9437 -0.0150 0.0938 0.4715 861 THR A CB 6237 O OG1 . THR A 850 ? 1.1378 1.2203 0.9310 -0.0054 0.0802 0.4601 861 THR A OG1 6238 C CG2 . THR A 850 ? 1.2427 1.2498 1.0579 -0.0121 0.1018 0.4680 861 THR A CG2 6239 N N . LEU A 851 ? 1.1748 1.2998 0.9510 -0.0403 0.1018 0.4483 862 LEU A N 6240 C CA . LEU A 851 ? 1.1222 1.2820 0.8996 -0.0427 0.1037 0.4338 862 LEU A CA 6241 C C . LEU A 851 ? 1.2041 1.3845 0.9665 -0.0245 0.0943 0.4215 862 LEU A C 6242 O O . LEU A 851 ? 1.2518 1.4298 0.9950 -0.0140 0.0868 0.4269 862 LEU A O 6243 C CB . LEU A 851 ? 1.1002 1.2827 0.8759 -0.0527 0.1147 0.4406 862 LEU A CB 6244 C CG . LEU A 851 ? 1.1268 1.3187 0.9248 -0.0739 0.1214 0.4407 862 LEU A CG 6245 C CD1 . LEU A 851 ? 1.0007 1.2090 0.8024 -0.0841 0.1319 0.4551 862 LEU A CD1 6246 C CD2 . LEU A 851 ? 0.8249 1.0481 0.6339 -0.0707 0.1201 0.4255 862 LEU A CD2 6247 N N . ARG A 852 ? 1.2383 1.4335 1.0102 -0.0224 0.0921 0.3996 863 ARG A N 6248 C CA . ARG A 852 ? 1.1869 1.3962 0.9427 -0.0068 0.0835 0.3842 863 ARG A CA 6249 C C . ARG A 852 ? 1.0109 1.2499 0.7660 -0.0052 0.0929 0.3720 863 ARG A C 6250 O O . ARG A 852 ? 1.0789 1.3295 0.8586 -0.0164 0.1003 0.3702 863 ARG A O 6251 C CB . ARG A 852 ? 0.7709 0.9629 0.5408 0.0000 0.0691 0.3696 863 ARG A CB 6252 C CG . ARG A 852 ? 0.8047 0.9703 0.5810 0.0030 0.0619 0.3850 863 ARG A CG 6253 C CD . ARG A 852 ? 0.8231 0.9793 0.6145 0.0131 0.0487 0.3742 863 ARG A CD 6254 N NE . ARG A 852 ? 1.0529 1.1858 0.8598 0.0179 0.0460 0.3929 863 ARG A NE 6255 C CZ . ARG A 852 ? 1.2484 1.3842 1.0478 0.0246 0.0348 0.4131 863 ARG A CZ 6256 N NH1 . ARG A 852 ? 1.3105 1.4660 1.0787 0.0253 0.0244 0.4145 863 ARG A NH1 6257 N NH2 . ARG A 852 ? 1.2753 1.3920 1.0963 0.0308 0.0347 0.4334 863 ARG A NH2 6258 N N . ALA A 853 ? 0.8624 1.1112 0.5873 0.0083 0.0926 0.3654 864 ALA A N 6259 C CA . ALA A 853 ? 0.9243 1.1976 0.6450 0.0150 0.1056 0.3554 864 ALA A CA 6260 C C . ALA A 853 ? 1.0260 1.2910 0.7097 0.0306 0.0986 0.3390 864 ALA A C 6261 O O . ALA A 853 ? 1.0728 1.3218 0.7175 0.0349 0.0911 0.3443 864 ALA A O 6262 C CB . ALA A 853 ? 0.8138 1.1050 0.5302 0.0123 0.1261 0.3711 864 ALA A CB 6263 N N . GLY A 854 ? 1.0638 1.3372 0.7576 0.0374 0.0995 0.3200 865 GLY A N 6264 C CA . GLY A 854 ? 1.0030 1.2635 0.6596 0.0507 0.0936 0.3027 865 GLY A CA 6265 C C . GLY A 854 ? 0.9800 1.2572 0.6363 0.0619 0.1131 0.2926 865 GLY A C 6266 O O . GLY A 854 ? 0.9249 1.2238 0.6248 0.0588 0.1183 0.2900 865 GLY A O 6267 N N . VAL A 855 ? 0.9482 1.2130 0.5530 0.0749 0.1248 0.2884 866 VAL A N 6268 C CA . VAL A 855 ? 0.8776 1.1504 0.4756 0.0905 0.1457 0.2780 866 VAL A CA 6269 C C . VAL A 855 ? 0.9976 1.2387 0.5612 0.0980 0.1302 0.2537 866 VAL A C 6270 O O . VAL A 855 ? 1.1097 1.3173 0.6150 0.0988 0.1199 0.2485 866 VAL A O 6271 C CB . VAL A 855 ? 0.9691 1.2383 0.5321 0.1012 0.1740 0.2857 866 VAL A CB 6272 C CG1 . VAL A 855 ? 0.9035 1.1872 0.4792 0.1185 0.2003 0.2796 866 VAL A CG1 6273 C CG2 . VAL A 855 ? 1.0253 1.3151 0.6173 0.0895 0.1822 0.3082 866 VAL A CG2 6274 N N . TYR A 856 ? 1.0864 1.3372 0.6849 0.1012 0.1266 0.2400 867 TYR A N 6275 C CA . TYR A 856 ? 1.0968 1.3188 0.6708 0.1056 0.1095 0.2177 867 TYR A CA 6276 C C . TYR A 856 ? 1.0434 1.2558 0.5914 0.1247 0.1324 0.2054 867 TYR A C 6277 O O . TYR A 856 ? 0.9517 1.1945 0.5354 0.1338 0.1562 0.2124 867 TYR A O 6278 C CB . TYR A 856 ? 0.9719 1.2044 0.5986 0.0960 0.0876 0.2109 867 TYR A CB 6279 C CG . TYR A 856 ? 1.0612 1.2949 0.7094 0.0806 0.0685 0.2230 867 TYR A CG 6280 C CD1 . TYR A 856 ? 1.1438 1.3544 0.7745 0.0751 0.0427 0.2204 867 TYR A CD1 6281 C CD2 . TYR A 856 ? 0.9374 1.1941 0.6238 0.0714 0.0768 0.2395 867 TYR A CD2 6282 C CE1 . TYR A 856 ? 1.0269 1.2388 0.6810 0.0646 0.0289 0.2347 867 TYR A CE1 6283 C CE2 . TYR A 856 ? 0.9381 1.1888 0.6405 0.0595 0.0630 0.2507 867 TYR A CE2 6284 C CZ . TYR A 856 ? 1.0249 1.2539 0.7127 0.0581 0.0408 0.2487 867 TYR A CZ 6285 O OH . TYR A 856 ? 1.0984 1.3218 0.8061 0.0497 0.0304 0.2629 867 TYR A OH 6286 N N . ASN A 857 ? 1.3446 1.1450 0.5533 0.2274 -0.1372 0.2071 868 ASN A N 6287 C CA . ASN A 857 ? 1.3834 1.1667 0.5549 0.2413 -0.1228 0.1983 868 ASN A CA 6288 C C . ASN A 857 ? 1.3283 1.1052 0.4601 0.2472 -0.0894 0.2071 868 ASN A C 6289 O O . ASN A 857 ? 1.3119 1.1163 0.4513 0.2519 -0.0568 0.2104 868 ASN A O 6290 C CB . ASN A 857 ? 1.2354 1.0553 0.4451 0.2438 -0.1106 0.1947 868 ASN A CB 6291 C CG . ASN A 857 ? 1.5165 1.3146 0.6885 0.2600 -0.0982 0.1850 868 ASN A CG 6292 O OD1 . ASN A 857 ? 1.4005 1.2295 0.5870 0.2660 -0.0688 0.1888 868 ASN A OD1 6293 N ND2 . ASN A 857 ? 1.6265 1.3720 0.7508 0.2673 -0.1203 0.1721 868 ASN A ND2 6294 N N . LEU A 858 ? 1.5572 1.2990 0.6494 0.2467 -0.0983 0.2104 869 LEU A N 6295 C CA . LEU A 858 ? 1.5290 1.2612 0.5827 0.2502 -0.0692 0.2188 869 LEU A CA 6296 C C . LEU A 858 ? 1.5241 1.2466 0.5460 0.2645 -0.0475 0.2110 869 LEU A C 6297 O O . LEU A 858 ? 1.4679 1.2176 0.4972 0.2660 -0.0123 0.2170 869 LEU A O 6298 C CB . LEU A 858 ? 1.4875 1.1746 0.4962 0.2503 -0.0885 0.2209 869 LEU A CB 6299 C CG . LEU A 858 ? 1.7665 1.4483 0.7491 0.2470 -0.0639 0.2347 869 LEU A CG 6300 C CD1 . LEU A 858 ? 1.5822 1.2181 0.5226 0.2484 -0.0894 0.2360 869 LEU A CD1 6301 C CD2 . LEU A 858 ? 1.5501 1.2324 0.5027 0.2552 -0.0280 0.2341 869 LEU A CD2 6302 N N . LEU A 859 ? 1.6702 1.3536 0.6576 0.2748 -0.0687 0.1968 870 LEU A N 6303 C CA . LEU A 859 ? 1.8299 1.5036 0.7925 0.2895 -0.0513 0.1878 870 LEU A CA 6304 C C . LEU A 859 ? 1.9176 1.6342 0.9329 0.2895 -0.0426 0.1867 870 LEU A C 6305 O O . LEU A 859 ? 2.0297 1.7496 1.0725 0.2850 -0.0684 0.1803 870 LEU A O 6306 C CB . LEU A 859 ? 1.9065 1.5261 0.8203 0.2991 -0.0782 0.1718 870 LEU A CB 6307 C CG . LEU A 859 ? 2.0428 1.6156 0.8909 0.3054 -0.0789 0.1701 870 LEU A CG 6308 C CD1 . LEU A 859 ? 1.6769 1.2426 0.5211 0.2946 -0.0933 0.1801 870 LEU A CD1 6309 C CD2 . LEU A 859 ? 2.0850 1.6095 0.8896 0.3151 -0.1030 0.1520 870 LEU A CD2 6310 N N . ASN A 860 ? 1.7396 1.4908 0.7713 0.2943 -0.0066 0.1926 871 ASN A N 6311 C CA . ASN A 860 ? 1.5111 1.3099 0.5962 0.2945 0.0054 0.1939 871 ASN A CA 6312 C C . ASN A 860 ? 1.4789 1.2563 0.5541 0.3066 -0.0092 0.1805 871 ASN A C 6313 O O . ASN A 860 ? 1.4542 1.2424 0.5297 0.3198 0.0125 0.1784 871 ASN A O 6314 C CB . ASN A 860 ? 1.4908 1.3282 0.5916 0.2992 0.0468 0.2013 871 ASN A CB 6315 C CG . ASN A 860 ? 1.3712 1.2744 0.5419 0.2890 0.0611 0.2096 871 ASN A CG 6316 O OD1 . ASN A 860 ? 1.4386 1.3586 0.6451 0.2808 0.0418 0.2095 871 ASN A OD1 6317 N ND2 . ASN A 860 ? 1.2925 1.2348 0.4851 0.2889 0.0948 0.2160 871 ASN A ND2 6318 N N . TYR A 861 ? 1.3851 1.1321 0.4529 0.3022 -0.0460 0.1711 872 TYR A N 6319 C CA . TYR A 861 ? 1.4390 1.1568 0.4904 0.3124 -0.0621 0.1562 872 TYR A CA 6320 C C . TYR A 861 ? 1.4446 1.2033 0.5485 0.3118 -0.0570 0.1576 872 TYR A C 6321 O O . TYR A 861 ? 1.4123 1.2030 0.5655 0.2977 -0.0699 0.1622 872 TYR A O 6322 C CB . TYR A 861 ? 1.4549 1.1289 0.4855 0.3061 -0.1043 0.1435 872 TYR A CB 6323 C CG . TYR A 861 ? 1.6867 1.3165 0.6815 0.3174 -0.1191 0.1254 872 TYR A CG 6324 C CD1 . TYR A 861 ? 1.8427 1.4237 0.7729 0.3295 -0.1165 0.1167 872 TYR A CD1 6325 C CD2 . TYR A 861 ? 1.6690 1.3040 0.6929 0.3155 -0.1352 0.1167 872 TYR A CD2 6326 C CE1 . TYR A 861 ? 1.8295 1.3675 0.7241 0.3393 -0.1292 0.0993 872 TYR A CE1 6327 C CE2 . TYR A 861 ? 1.7192 1.3101 0.7074 0.3250 -0.1481 0.0994 872 TYR A CE2 6328 C CZ . TYR A 861 ? 1.7747 1.3169 0.6978 0.3370 -0.1448 0.0906 872 TYR A CZ 6329 O OH . TYR A 861 ? 1.7237 1.2198 0.6087 0.3459 -0.1568 0.0725 872 TYR A OH 6330 N N . ARG A 862 ? 1.4398 1.1968 0.5327 0.3278 -0.0377 0.1539 873 ARG A N 6331 C CA . ARG A 862 ? 1.4007 1.1926 0.5378 0.3298 -0.0319 0.1554 873 ARG A CA 6332 C C . ARG A 862 ? 1.4341 1.1873 0.5588 0.3310 -0.0634 0.1401 873 ARG A C 6333 O O . ARG A 862 ? 1.3720 1.0753 0.4461 0.3442 -0.0678 0.1277 873 ARG A O 6334 C CB . ARG A 862 ? 1.3025 1.1129 0.4371 0.3478 0.0047 0.1598 873 ARG A CB 6335 C CG . ARG A 862 ? 1.3196 1.1664 0.4984 0.3519 0.0124 0.1628 873 ARG A CG 6336 C CD . ARG A 862 ? 1.4683 1.2756 0.6089 0.3731 0.0170 0.1530 873 ARG A CD 6337 N NE . ARG A 862 ? 1.5649 1.4108 0.7285 0.3880 0.0511 0.1618 873 ARG A NE 6338 C CZ . ARG A 862 ? 1.5094 1.3917 0.7162 0.3902 0.0571 0.1672 873 ARG A CZ 6339 N NH1 . ARG A 862 ? 1.4769 1.3617 0.7163 0.3748 0.0320 0.1626 873 ARG A NH1 6340 N NH2 . ARG A 862 ? 1.4343 1.3518 0.6616 0.4049 0.0873 0.1752 873 ARG A NH2 6341 N N . TYR A 863 ? 1.2586 1.0355 0.4345 0.3149 -0.0847 0.1392 874 TYR A N 6342 C CA . TYR A 863 ? 1.3203 1.0679 0.5078 0.3072 -0.1141 0.1207 874 TYR A CA 6343 C C . TYR A 863 ? 1.2321 1.0273 0.5021 0.2892 -0.1175 0.1209 874 TYR A C 6344 O O . TYR A 863 ? 1.2005 1.0506 0.5195 0.2797 -0.1027 0.1347 874 TYR A O 6345 C CB . TYR A 863 ? 1.3701 1.0754 0.5291 0.2985 -0.1512 0.1096 874 TYR A CB 6346 C CG . TYR A 863 ? 1.3874 1.1236 0.5897 0.2795 -0.1659 0.1175 874 TYR A CG 6347 C CD1 . TYR A 863 ? 1.3901 1.1325 0.6424 0.2599 -0.1968 0.1068 874 TYR A CD1 6348 C CD2 . TYR A 863 ? 1.4607 1.2184 0.6540 0.2810 -0.1479 0.1351 874 TYR A CD2 6349 C CE1 . TYR A 863 ? 1.4122 1.1811 0.7047 0.2436 -0.2096 0.1137 874 TYR A CE1 6350 C CE2 . TYR A 863 ? 1.4681 1.2506 0.6998 0.2640 -0.1601 0.1423 874 TYR A CE2 6351 C CZ . TYR A 863 ? 1.3597 1.1474 0.6410 0.2459 -0.1912 0.1317 874 TYR A CZ 6352 O OH . TYR A 863 ? 1.2092 1.0204 0.5295 0.2301 -0.2024 0.1388 874 TYR A OH 6353 N N . VAL A 864 ? 1.2644 1.0373 0.5481 0.2837 -0.1361 0.1048 875 VAL A N 6354 C CA . VAL A 864 ? 1.1141 0.9254 0.4722 0.2652 -0.1415 0.1028 875 VAL A CA 6355 C C . VAL A 864 ? 1.3483 1.1380 0.7268 0.2458 -0.1800 0.0860 875 VAL A C 6356 O O . VAL A 864 ? 1.3656 1.1043 0.7077 0.2492 -0.1997 0.0688 875 VAL A O 6357 C CB . VAL A 864 ? 1.1119 0.9212 0.4768 0.2750 -0.1253 0.0995 875 VAL A CB 6358 C CG1 . VAL A 864 ? 1.0541 0.8883 0.4864 0.2542 -0.1371 0.0932 875 VAL A CG1 6359 C CG2 . VAL A 864 ? 1.1051 0.9507 0.4677 0.2925 -0.0871 0.1177 875 VAL A CG2 6360 N N . THR A 865 ? 1.3282 1.1573 0.7656 0.2252 -0.1902 0.0901 876 THR A N 6361 C CA . THR A 865 ? 1.3549 1.1703 0.8196 0.2063 -0.2262 0.0747 876 THR A CA 6362 C C . THR A 865 ? 1.2145 1.0281 0.7178 0.1952 -0.2342 0.0599 876 THR A C 6363 O O . THR A 865 ? 1.2048 1.0470 0.7371 0.1956 -0.2116 0.0665 876 THR A O 6364 C CB . THR A 865 ? 1.3017 1.1598 0.8197 0.1881 -0.2327 0.0838 876 THR A CB 6365 O OG1 . THR A 865 ? 1.2195 1.1342 0.7831 0.1834 -0.2033 0.0992 876 THR A OG1 6366 C CG2 . THR A 865 ? 1.3996 1.2411 0.8733 0.1959 -0.2380 0.0925 876 THR A CG2 6367 N N . TRP A 866 ? 1.1708 0.9507 0.6736 0.1852 -0.2664 0.0399 877 TRP A N 6368 C CA . TRP A 866 ? 1.1230 0.8972 0.6618 0.1722 -0.2752 0.0238 877 TRP A CA 6369 C C . TRP A 866 ? 1.1264 0.9537 0.7472 0.1496 -0.2737 0.0276 877 TRP A C 6370 O O . TRP A 866 ? 0.9153 0.7571 0.5692 0.1429 -0.2616 0.0256 877 TRP A O 6371 C CB . TRP A 866 ? 1.2431 0.9701 0.7623 0.1656 -0.3108 -0.0003 877 TRP A CB 6372 C CG . TRP A 866 ? 1.2964 1.0226 0.8627 0.1471 -0.3217 -0.0178 877 TRP A CG 6373 C CD1 . TRP A 866 ? 1.2679 1.0060 0.8869 0.1243 -0.3484 -0.0314 877 TRP A CD1 6374 C CD2 . TRP A 866 ? 1.2810 0.9938 0.8469 0.1496 -0.3045 -0.0232 877 TRP A CD2 6375 N NE1 . TRP A 866 ? 1.1217 0.8544 0.7724 0.1113 -0.3484 -0.0458 877 TRP A NE1 6376 C CE2 . TRP A 866 ? 1.2202 0.9360 0.8380 0.1265 -0.3217 -0.0405 877 TRP A CE2 6377 C CE3 . TRP A 866 ? 1.2393 0.9371 0.7663 0.1698 -0.2758 -0.0149 877 TRP A CE3 6378 C CZ2 . TRP A 866 ? 1.1851 0.8866 0.8137 0.1222 -0.3105 -0.0493 877 TRP A CZ2 6379 C CZ3 . TRP A 866 ? 1.2606 0.9444 0.7991 0.1670 -0.2657 -0.0230 877 TRP A CZ3 6380 C CH2 . TRP A 866 ? 1.2266 0.9113 0.8143 0.1430 -0.2827 -0.0397 877 TRP A CH2 6381 N N . GLU A 867 ? 1.0936 0.9475 0.7448 0.1380 -0.2856 0.0331 878 GLU A N 6382 C CA . GLU A 867 ? 0.9479 0.8525 0.6761 0.1156 -0.2842 0.0367 878 GLU A CA 6383 C C . GLU A 867 ? 1.0139 0.9625 0.7670 0.1174 -0.2493 0.0532 878 GLU A C 6384 O O . GLU A 867 ? 1.0347 1.0187 0.8471 0.0997 -0.2442 0.0526 878 GLU A O 6385 C CB . GLU A 867 ? 1.1247 1.0484 0.8713 0.1078 -0.2968 0.0436 878 GLU A CB 6386 C CG . GLU A 867 ? 1.3929 1.2903 1.1466 0.0980 -0.3357 0.0260 878 GLU A CG 6387 C CD . GLU A 867 ? 1.5730 1.4123 1.2547 0.1145 -0.3545 0.0150 878 GLU A CD 6388 O OE1 . GLU A 867 ? 1.6246 1.4454 1.2453 0.1346 -0.3402 0.0263 878 GLU A OE1 6389 O OE2 . GLU A 867 ? 1.5815 1.3945 1.2680 0.1066 -0.3832 -0.0059 878 GLU A OE2 6390 N N . ASN A 868 ? 0.9771 0.9240 0.6843 0.1388 -0.2255 0.0675 879 ASN A N 6391 C CA . ASN A 868 ? 1.0497 1.0368 0.7740 0.1443 -0.1927 0.0829 879 ASN A CA 6392 C C . ASN A 868 ? 1.0740 1.0434 0.7932 0.1503 -0.1848 0.0759 879 ASN A C 6393 O O . ASN A 868 ? 0.9882 0.9921 0.7533 0.1402 -0.1729 0.0797 879 ASN A O 6394 C CB . ASN A 868 ? 1.0792 1.0726 0.7583 0.1654 -0.1694 0.1000 879 ASN A CB 6395 C CG . ASN A 868 ? 1.0610 1.1054 0.7739 0.1554 -0.1576 0.1153 879 ASN A CG 6396 O OD1 . ASN A 868 ? 1.2249 1.3107 0.9493 0.1606 -0.1295 0.1303 879 ASN A OD1 6397 N ND2 . ASN A 868 ? 1.0633 1.1056 0.7937 0.1409 -0.1790 0.1112 879 ASN A ND2 6398 N N . VAL A 869 ? 1.0704 0.9845 0.7323 0.1665 -0.1911 0.0656 880 VAL A N 6399 C CA . VAL A 869 ? 0.9896 0.8779 0.6391 0.1742 -0.1829 0.0584 880 VAL A CA 6400 C C . VAL A 869 ? 0.9374 0.8272 0.6382 0.1504 -0.1983 0.0438 880 VAL A C 6401 O O . VAL A 869 ? 0.9981 0.8852 0.7095 0.1510 -0.1863 0.0427 880 VAL A O 6402 C CB . VAL A 869 ? 1.0913 0.9135 0.6695 0.1925 -0.1905 0.0460 880 VAL A CB 6403 C CG1 . VAL A 869 ? 1.1498 0.9497 0.7075 0.2074 -0.1711 0.0452 880 VAL A CG1 6404 C CG2 . VAL A 869 ? 1.1321 0.9461 0.6583 0.2112 -0.1830 0.0562 880 VAL A CG2 6405 N N . ARG A 870 ? 0.8700 0.7636 0.6020 0.1300 -0.2245 0.0329 881 ARG A N 6406 C CA . ARG A 870 ? 0.9342 0.8307 0.7180 0.1053 -0.2406 0.0173 881 ARG A CA 6407 C C . ARG A 870 ? 0.9840 0.9282 0.8211 0.0942 -0.2195 0.0280 881 ARG A C 6408 O O . ARG A 870 ? 0.7342 0.6707 0.5967 0.0818 -0.2209 0.0177 881 ARG A O 6409 C CB . ARG A 870 ? 1.0463 0.9507 0.8612 0.0869 -0.2693 0.0076 881 ARG A CB 6410 C CG . ARG A 870 ? 1.0166 0.9265 0.8891 0.0604 -0.2863 -0.0100 881 ARG A CG 6411 C CD . ARG A 870 ? 0.8810 0.7663 0.7560 0.0504 -0.3219 -0.0291 881 ARG A CD 6412 N NE . ARG A 870 ? 0.9122 0.7953 0.8359 0.0269 -0.3365 -0.0492 881 ARG A NE 6413 C CZ . ARG A 870 ? 0.9267 0.8406 0.9131 0.0044 -0.3506 -0.0556 881 ARG A CZ 6414 N NH1 . ARG A 870 ? 0.9060 0.8530 0.9130 0.0028 -0.3529 -0.0434 881 ARG A NH1 6415 N NH2 . ARG A 870 ? 0.9762 0.8861 1.0044 -0.0166 -0.3616 -0.0750 881 ARG A NH2 6416 N N . GLN A 871 ? 0.7081 0.7003 0.5591 0.0988 -0.1992 0.0485 882 GLN A N 6417 C CA . GLN A 871 ? 0.8297 0.8726 0.7281 0.0894 -0.1785 0.0605 882 GLN A CA 6418 C C . GLN A 871 ? 0.8837 0.9118 0.7681 0.1002 -0.1616 0.0623 882 GLN A C 6419 O O . GLN A 871 ? 0.9060 0.9654 0.8312 0.0883 -0.1506 0.0669 882 GLN A O 6420 C CB . GLN A 871 ? 0.6219 0.7151 0.5260 0.0967 -0.1577 0.0820 882 GLN A CB 6421 C CG . GLN A 871 ? 0.6751 0.7909 0.6029 0.0830 -0.1697 0.0832 882 GLN A CG 6422 C CD . GLN A 871 ? 0.7602 0.9217 0.6887 0.0904 -0.1466 0.1036 882 GLN A CD 6423 O OE1 . GLN A 871 ? 0.7835 0.9974 0.7615 0.0746 -0.1355 0.1117 882 GLN A OE1 6424 N NE2 . GLN A 871 ? 0.7390 0.8807 0.6118 0.1137 -0.1382 0.1113 882 GLN A NE2 6425 N N . THR A 872 ? 0.7886 0.7677 0.6140 0.1228 -0.1590 0.0588 883 THR A N 6426 C CA . THR A 872 ? 0.8381 0.7964 0.6449 0.1359 -0.1424 0.0608 883 THR A CA 6427 C C . THR A 872 ? 0.7735 0.6881 0.5867 0.1214 -0.1578 0.0398 883 THR A C 6428 O O . THR A 872 ? 0.9197 0.8170 0.7264 0.1269 -0.1449 0.0404 883 THR A O 6429 C CB . THR A 872 ? 0.9412 0.8652 0.6807 0.1685 -0.1285 0.0669 883 THR A CB 6430 O OG1 . THR A 872 ? 1.0297 0.9000 0.7259 0.1719 -0.1490 0.0502 883 THR A OG1 6431 C CG2 . THR A 872 ? 0.7968 0.7656 0.5302 0.1838 -0.1088 0.0881 883 THR A CG2 6432 N N . ALA A 873 ? 0.8866 0.7833 0.7127 0.1030 -0.1852 0.0212 884 ALA A N 6433 C CA . ALA A 873 ? 0.9683 0.8207 0.7976 0.0886 -0.2017 -0.0019 884 ALA A CA 6434 C C . ALA A 873 ? 1.0519 0.9257 0.9339 0.0675 -0.1949 -0.0035 884 ALA A C 6435 O O . ALA A 873 ? 1.0323 0.9601 0.9620 0.0549 -0.1876 0.0079 884 ALA A O 6436 C CB . ALA A 873 ? 1.0147 0.8512 0.8514 0.0736 -0.2338 -0.0211 884 ALA A CB 6437 N N . GLY A 874 ? 1.1833 1.0129 1.0548 0.0629 -0.1963 -0.0183 885 GLY A N 6438 C CA . GLY A 874 ? 1.2987 1.1402 1.2181 0.0394 -0.1929 -0.0238 885 GLY A CA 6439 C C . GLY A 874 ? 1.2879 1.1436 1.2574 0.0097 -0.2182 -0.0420 885 GLY A C 6440 O O . GLY A 874 ? 1.3642 1.1824 1.3221 0.0030 -0.2408 -0.0636 885 GLY A O 6441 N N . GLY A 875 ? 1.1041 1.0148 1.1297 -0.0081 -0.2147 -0.0338 886 GLY A N 6442 C CA . GLY A 875 ? 1.0925 1.0217 1.1709 -0.0356 -0.2367 -0.0497 886 GLY A CA 6443 C C . GLY A 875 ? 1.0043 0.9817 1.1064 -0.0366 -0.2411 -0.0378 886 GLY A C 6444 O O . GLY A 875 ? 1.0374 1.0432 1.1925 -0.0593 -0.2533 -0.0455 886 GLY A O 6445 N N . ALA A 876 ? 0.9565 0.9418 1.0193 -0.0119 -0.2300 -0.0194 887 ALA A N 6446 C CA . ALA A 876 ? 0.7719 0.8019 0.8521 -0.0113 -0.2293 -0.0056 887 ALA A CA 6447 C C . ALA A 876 ? 0.7188 0.8066 0.8565 -0.0296 -0.2139 0.0051 887 ALA A C 6448 O O . ALA A 876 ? 0.8648 0.9644 1.0079 -0.0294 -0.1941 0.0134 887 ALA A O 6449 C CB . ALA A 876 ? 0.7172 0.7449 0.7431 0.0185 -0.2149 0.0126 887 ALA A CB 6450 N N . VAL A 877 ? 0.5545 0.6772 0.7340 -0.0453 -0.2230 0.0048 888 VAL A N 6451 C CA . VAL A 877 ? 0.5812 0.7617 0.8118 -0.0618 -0.2070 0.0160 888 VAL A CA 6452 C C . VAL A 877 ? 0.5496 0.7596 0.7552 -0.0423 -0.1809 0.0401 888 VAL A C 6453 O O . VAL A 877 ? 0.8133 1.0216 0.9841 -0.0235 -0.1789 0.0501 888 VAL A O 6454 C CB . VAL A 877 ? 0.5710 0.7802 0.8464 -0.0796 -0.2206 0.0117 888 VAL A CB 6455 C CG1 . VAL A 877 ? 0.5806 0.7679 0.8184 -0.0627 -0.2358 0.0131 888 VAL A CG1 6456 C CG2 . VAL A 877 ? 0.6298 0.8997 0.9445 -0.0909 -0.2000 0.0273 888 VAL A CG2 6457 N N . ASN A 878 ? 0.4417 0.6783 0.6644 -0.0468 -0.1609 0.0492 889 ASN A N 6458 C CA . ASN A 878 ? 0.5137 0.7819 0.7164 -0.0282 -0.1358 0.0716 889 ASN A CA 6459 C C . ASN A 878 ? 0.4916 0.7223 0.6285 0.0047 -0.1310 0.0781 889 ASN A C 6460 O O . ASN A 878 ? 0.5455 0.7965 0.6597 0.0224 -0.1187 0.0932 889 ASN A O 6461 C CB . ASN A 878 ? 0.3553 0.6798 0.5852 -0.0347 -0.1268 0.0843 889 ASN A CB 6462 C CG . ASN A 878 ? 0.4979 0.8555 0.7914 -0.0671 -0.1325 0.0760 889 ASN A CG 6463 O OD1 . ASN A 878 ? 0.4781 0.8309 0.8002 -0.0851 -0.1357 0.0654 889 ASN A OD1 6464 N ND2 . ASN A 878 ? 0.5952 0.9845 0.9107 -0.0752 -0.1329 0.0803 889 ASN A ND2 6465 N N . GLN A 879 ? 0.5353 0.7110 0.6428 0.0114 -0.1394 0.0657 890 GLN A N 6466 C CA . GLN A 879 ? 0.7306 0.8624 0.7746 0.0413 -0.1351 0.0686 890 GLN A CA 6467 C C . GLN A 879 ? 0.7120 0.8717 0.7332 0.0655 -0.1088 0.0912 890 GLN A C 6468 O O . GLN A 879 ? 0.6764 0.8702 0.7210 0.0625 -0.0925 0.1023 890 GLN A O 6469 C CB . GLN A 879 ? 0.7635 0.8406 0.7890 0.0411 -0.1407 0.0539 890 GLN A CB 6470 C CG . GLN A 879 ? 0.7621 0.7943 0.7236 0.0721 -0.1312 0.0579 890 GLN A CG 6471 C CD . GLN A 879 ? 0.8598 0.8444 0.8071 0.0715 -0.1296 0.0472 890 GLN A CD 6472 O OE1 . GLN A 879 ? 0.9853 0.9789 0.9711 0.0502 -0.1295 0.0420 890 GLN A OE1 6473 N NE2 . GLN A 879 ? 0.9083 0.8400 0.7990 0.0945 -0.1272 0.0435 890 GLN A NE2 6474 N N . HIS A 880 ? 0.7820 0.9276 0.7572 0.0897 -0.1049 0.0977 891 HIS A N 6475 C CA . HIS A 880 ? 0.8323 0.9987 0.7811 0.1160 -0.0801 0.1173 891 HIS A CA 6476 C C . HIS A 880 ? 0.8745 0.9973 0.7855 0.1364 -0.0712 0.1169 891 HIS A C 6477 O O . HIS A 880 ? 0.9627 1.0248 0.8380 0.1422 -0.0831 0.1022 891 HIS A O 6478 C CB . HIS A 880 ? 0.7945 0.9592 0.7064 0.1343 -0.0773 0.1236 891 HIS A CB 6479 C CG . HIS A 880 ? 0.7179 0.9243 0.6618 0.1175 -0.0823 0.1267 891 HIS A CG 6480 N ND1 . HIS A 880 ? 0.8636 1.0774 0.7810 0.1302 -0.0769 0.1347 891 HIS A ND1 6481 C CD2 . HIS A 880 ? 0.7641 1.0046 0.7635 0.0888 -0.0909 0.1228 891 HIS A CD2 6482 C CE1 . HIS A 880 ? 0.8257 1.0751 0.7802 0.1103 -0.0820 0.1361 891 HIS A CE1 6483 N NE2 . HIS A 880 ? 0.8476 1.1142 0.8528 0.0853 -0.0906 0.1287 891 HIS A NE2 6484 N N . LYS A 881 ? 0.9514 1.1055 0.8705 0.1471 -0.0502 0.1331 892 LYS A N 6485 C CA . LYS A 881 ? 0.9385 1.0562 0.8202 0.1713 -0.0374 0.1373 892 LYS A CA 6486 C C . LYS A 881 ? 1.2611 1.4309 1.1488 0.1901 -0.0128 0.1606 892 LYS A C 6487 O O . LYS A 881 ? 1.4414 1.6736 1.3734 0.1755 -0.0076 0.1704 892 LYS A O 6488 C CB . LYS A 881 ? 0.8942 0.9762 0.7880 0.1556 -0.0450 0.1250 892 LYS A CB 6489 C CG . LYS A 881 ? 0.9101 1.0386 0.8606 0.1296 -0.0434 0.1290 892 LYS A CG 6490 C CD . LYS A 881 ? 1.1066 1.2364 1.0960 0.0957 -0.0652 0.1108 892 LYS A CD 6491 C CE . LYS A 881 ? 1.0470 1.1974 1.0836 0.0688 -0.0648 0.1081 892 LYS A CE 6492 N NZ . LYS A 881 ? 0.8794 0.9719 0.9002 0.0657 -0.0678 0.0957 892 LYS A NZ 6493 N N . ASN A 882 ? 1.3917 1.5380 1.2359 0.2224 0.0024 0.1691 893 ASN A N 6494 C CA . ASN A 882 ? 1.4434 1.5156 1.2331 0.2394 -0.0025 0.1568 893 ASN A CA 6495 C C . ASN A 882 ? 1.4052 1.4734 1.1536 0.2652 0.0067 0.1623 893 ASN A C 6496 O O . ASN A 882 ? 1.3700 1.4643 1.1069 0.2905 0.0278 0.1789 893 ASN A O 6497 C CB . ASN A 882 ? 1.5095 1.5422 1.2775 0.2554 0.0082 0.1590 893 ASN A CB 6498 C CG . ASN A 882 ? 1.4692 1.4600 1.2500 0.2309 -0.0070 0.1417 893 ASN A CG 6499 O OD1 . ASN A 882 ? 1.4414 1.4007 1.2209 0.2124 -0.0272 0.1219 893 ASN A OD1 6500 N ND2 . ASN A 882 ? 1.3524 1.3432 1.1456 0.2307 0.0028 0.1489 893 ASN A ND2 6501 N N . VAL A 883 ? 1.3011 1.3370 1.0276 0.2586 -0.0095 0.1479 894 VAL A N 6502 C CA . VAL A 883 ? 1.2720 1.2969 0.9548 0.2802 -0.0027 0.1508 894 VAL A CA 6503 C C . VAL A 883 ? 1.3345 1.2884 0.9581 0.3039 0.0013 0.1422 894 VAL A C 6504 O O . VAL A 883 ? 1.5230 1.4216 1.1315 0.2937 -0.0154 0.1239 894 VAL A O 6505 C CB . VAL A 883 ? 1.4058 1.4262 1.0893 0.2617 -0.0231 0.1397 894 VAL A CB 6506 C CG1 . VAL A 883 ? 1.4757 1.5332 1.1488 0.2734 -0.0102 0.1527 894 VAL A CG1 6507 C CG2 . VAL A 883 ? 0.7673 0.8182 0.5095 0.2274 -0.0400 0.1340 894 VAL A CG2 6508 N N . GLY A 884 ? 1.1990 1.1544 0.7899 0.3353 0.0238 0.1544 895 GLY A N 6509 C CA . GLY A 884 ? 1.0441 1.0656 0.6522 0.3467 0.0428 0.1739 895 GLY A CA 6510 C C . GLY A 884 ? 1.2870 1.2913 0.8484 0.3643 0.0492 0.1729 895 GLY A C 6511 O O . GLY A 884 ? 1.3975 1.3571 0.9093 0.3900 0.0601 0.1705 895 GLY A O 6512 N N . VAL A 885 ? 1.1872 1.2252 0.7633 0.3498 0.0433 0.1747 896 VAL A N 6513 C CA . VAL A 885 ? 1.0546 1.0747 0.5863 0.3617 0.0470 0.1730 896 VAL A CA 6514 C C . VAL A 885 ? 1.0673 1.0858 0.6100 0.3347 0.0232 0.1636 896 VAL A C 6515 O O . VAL A 885 ? 1.1189 1.1886 0.7128 0.3129 0.0185 0.1692 896 VAL A O 6516 C CB . VAL A 885 ? 1.0826 1.1598 0.6198 0.3794 0.0746 0.1917 896 VAL A CB 6517 C CG1 . VAL A 885 ? 1.1731 1.2424 0.6762 0.3818 0.0762 0.1905 896 VAL A CG1 6518 C CG2 . VAL A 885 ? 0.9772 1.0458 0.4909 0.4124 0.0981 0.1997 896 VAL A CG2 6519 N N . TYR A 886 ? 1.0431 1.0027 0.5376 0.3363 0.0081 0.1493 897 TYR A N 6520 C CA . TYR A 886 ? 1.0375 0.9882 0.5402 0.3121 -0.0184 0.1391 897 TYR A CA 6521 C C . TYR A 886 ? 0.9972 0.9721 0.4879 0.3128 -0.0125 0.1480 897 TYR A C 6522 O O . TYR A 886 ? 1.0005 0.9645 0.4906 0.2964 -0.0332 0.1412 897 TYR A O 6523 C CB . TYR A 886 ? 1.0324 0.9095 0.4941 0.3097 -0.0423 0.1177 897 TYR A CB 6524 C CG . TYR A 886 ? 1.1483 1.0079 0.6385 0.2959 -0.0553 0.1062 897 TYR A CG 6525 C CD1 . TYR A 886 ? 1.0440 0.9013 0.5687 0.2678 -0.0829 0.0933 897 TYR A CD1 6526 C CD2 . TYR A 886 ? 1.0874 0.9334 0.5714 0.3112 -0.0390 0.1085 897 TYR A CD2 6527 C CE1 . TYR A 886 ? 1.0422 0.8842 0.5939 0.2538 -0.0931 0.0821 897 TYR A CE1 6528 C CE2 . TYR A 886 ? 1.1386 0.9666 0.6471 0.2977 -0.0490 0.0985 897 TYR A CE2 6529 C CZ . TYR A 886 ? 1.2082 1.0347 0.7507 0.2682 -0.0756 0.0848 897 TYR A CZ 6530 O OH . TYR A 886 ? 1.2124 1.0207 0.7796 0.2534 -0.0842 0.0739 897 TYR A OH 6531 N N . ASN A 887 ? 1.0918 1.0999 0.5740 0.3317 0.0162 0.1633 898 ASN A N 6532 C CA . ASN A 887 ? 1.0382 1.0740 0.5115 0.3322 0.0271 0.1732 898 ASN A CA 6533 C C . ASN A 887 ? 0.9820 1.0643 0.5097 0.3039 0.0163 0.1773 898 ASN A C 6534 O O . ASN A 887 ? 0.9838 1.0624 0.4989 0.2955 0.0095 0.1777 898 ASN A O 6535 C CB . ASN A 887 ? 1.1088 1.1862 0.5802 0.3542 0.0617 0.1892 898 ASN A CB 6536 C CG . ASN A 887 ? 1.2069 1.2370 0.6125 0.3841 0.0762 0.1864 898 ASN A CG 6537 O OD1 . ASN A 887 ? 1.1814 1.1800 0.5705 0.3993 0.0788 0.1813 898 ASN A OD1 6538 N ND2 . ASN A 887 ? 1.2709 1.2945 0.6376 0.3924 0.0873 0.1899 898 ASN A ND2 6539 N N . ARG A 888 ? 0.9305 1.0545 0.5172 0.2892 0.0154 0.1802 899 ARG A N 6540 C CA . ARG A 888 ? 0.8820 1.0575 0.5254 0.2626 0.0102 0.1850 899 ARG A CA 6541 C C . ARG A 888 ? 0.9204 1.0654 0.5681 0.2411 -0.0203 0.1724 899 ARG A C 6542 O O . ARG A 888 ? 1.0818 1.2594 0.7637 0.2217 -0.0244 0.1761 899 ARG A O 6543 C CB . ARG A 888 ? 0.8260 1.0502 0.5284 0.2519 0.0161 0.1900 899 ARG A CB 6544 C CG . ARG A 888 ? 0.8569 1.0461 0.5690 0.2446 -0.0028 0.1771 899 ARG A CG 6545 C CD . ARG A 888 ? 0.9128 1.1382 0.6891 0.2140 -0.0151 0.1745 899 ARG A CD 6546 N NE . ARG A 888 ? 0.9420 1.1936 0.7510 0.2128 -0.0064 0.1789 899 ARG A NE 6547 C CZ . ARG A 888 ? 0.9702 1.2634 0.8365 0.1886 -0.0100 0.1797 899 ARG A CZ 6548 N NH1 . ARG A 888 ? 0.9850 1.2979 0.8739 0.1896 -0.0015 0.1844 899 ARG A NH1 6549 N NH2 . ARG A 888 ? 0.7950 1.1089 0.6947 0.1637 -0.0215 0.1759 899 ARG A NH2 6550 N N . TYR A 889 ? 0.9379 1.0208 0.5510 0.2449 -0.0414 0.1570 900 TYR A N 6551 C CA . TYR A 889 ? 1.0182 1.0711 0.6346 0.2264 -0.0726 0.1437 900 TYR A CA 6552 C C . TYR A 889 ? 1.0301 1.0486 0.5927 0.2348 -0.0795 0.1431 900 TYR A C 6553 O O . TYR A 889 ? 1.0088 0.9933 0.5610 0.2249 -0.1072 0.1315 900 TYR A O 6554 C CB . TYR A 889 ? 1.0508 1.0574 0.6628 0.2225 -0.0942 0.1255 900 TYR A CB 6555 C CG . TYR A 889 ? 1.0604 1.0960 0.7240 0.2120 -0.0890 0.1256 900 TYR A CG 6556 C CD1 . TYR A 889 ? 0.9987 1.0687 0.7247 0.1849 -0.1005 0.1231 900 TYR A CD1 6557 C CD2 . TYR A 889 ? 1.0872 1.1142 0.7359 0.2297 -0.0717 0.1285 900 TYR A CD2 6558 C CE1 . TYR A 889 ? 0.8828 0.9780 0.6530 0.1746 -0.0950 0.1234 900 TYR A CE1 6559 C CE2 . TYR A 889 ? 0.9911 1.0423 0.6834 0.2206 -0.0669 0.1299 900 TYR A CE2 6560 C CZ . TYR A 889 ? 0.8593 0.9446 0.6114 0.1925 -0.0785 0.1272 900 TYR A CZ 6561 O OH . TYR A 889 ? 0.8155 0.9236 0.6081 0.1827 -0.0731 0.1286 900 TYR A OH 6562 N N . ALA A 890 ? 0.9143 0.9427 0.4430 0.2530 -0.0543 0.1556 901 ALA A N 6563 C CA . ALA A 890 ? 1.0207 1.0169 0.4941 0.2618 -0.0569 0.1569 901 ALA A CA 6564 C C . ALA A 890 ? 1.0370 1.0539 0.5371 0.2417 -0.0686 0.1613 901 ALA A C 6565 O O . ALA A 890 ? 1.0534 1.1258 0.6086 0.2270 -0.0577 0.1706 901 ALA A O 6566 C CB . ALA A 890 ? 1.0371 1.0451 0.4746 0.2841 -0.0237 0.1696 901 ALA A CB 6567 N N . ALA A 891 ? 0.9749 0.9458 0.4345 0.2415 -0.0909 0.1544 902 ALA A N 6568 C CA . ALA A 891 ? 1.1957 1.1768 0.6719 0.2257 -0.1034 0.1589 902 ALA A CA 6569 C C . ALA A 891 ? 1.1485 1.1562 0.6091 0.2315 -0.0744 0.1765 902 ALA A C 6570 O O . ALA A 891 ? 1.2526 1.2607 0.6782 0.2501 -0.0487 0.1828 902 ALA A O 6571 C CB . ALA A 891 ? 1.0141 0.9359 0.4463 0.2268 -0.1367 0.1468 902 ALA A CB 6572 N N . PRO A 892 ? 1.0762 1.1064 0.5638 0.2154 -0.0770 0.1841 903 PRO A N 6573 C CA . PRO A 892 ? 1.0808 1.1343 0.5519 0.2197 -0.0476 0.2001 903 PRO A CA 6574 C C . PRO A 892 ? 1.0191 1.0190 0.4087 0.2370 -0.0478 0.2021 903 PRO A C 6575 O O . PRO A 892 ? 1.5101 1.4603 0.8660 0.2380 -0.0772 0.1936 903 PRO A O 6576 C CB . PRO A 892 ? 1.0651 1.1508 0.5878 0.1962 -0.0527 0.2059 903 PRO A CB 6577 C CG . PRO A 892 ? 0.8905 0.9463 0.4288 0.1855 -0.0916 0.1926 903 PRO A CG 6578 C CD . PRO A 892 ? 0.8960 0.9343 0.4325 0.1929 -0.1031 0.1789 903 PRO A CD 6579 N N . GLY A 893 ? 1.0389 1.0503 0.4030 0.2481 -0.0149 0.2110 904 GLY A N 6580 C CA . GLY A 893 ? 1.1063 1.0734 0.4120 0.2556 -0.0095 0.2097 904 GLY A CA 6581 C C . GLY A 893 ? 1.1623 1.1270 0.4670 0.2420 -0.0135 0.2184 904 GLY A C 6582 O O . GLY A 893 ? 1.1093 1.0843 0.4444 0.2295 -0.0344 0.2212 904 GLY A O 6583 N N . ARG A 894 ? 1.1840 1.1345 0.4544 0.2447 0.0068 0.2230 905 ARG A N 6584 C CA . ARG A 894 ? 1.1628 1.1061 0.4263 0.2328 0.0058 0.2322 905 ARG A CA 6585 C C . ARG A 894 ? 1.2047 1.2064 0.5309 0.2159 0.0192 0.2430 905 ARG A C 6586 O O . ARG A 894 ? 1.1476 1.1993 0.5112 0.2128 0.0483 0.2460 905 ARG A O 6587 C CB . ARG A 894 ? 1.2189 1.1405 0.4368 0.2382 0.0294 0.2351 905 ARG A CB 6588 C CG . ARG A 894 ? 1.2290 1.1479 0.4424 0.2252 0.0352 0.2464 905 ARG A CG 6589 C CD . ARG A 894 ? 1.3369 1.2191 0.4933 0.2312 0.0494 0.2475 905 ARG A CD 6590 N NE . ARG A 894 ? 1.5009 1.4016 0.6543 0.2398 0.0814 0.2444 905 ARG A NE 6591 C CZ . ARG A 894 ? 1.5806 1.4481 0.6887 0.2558 0.0829 0.2361 905 ARG A CZ 6592 N NH1 . ARG A 894 ? 1.5558 1.3704 0.6173 0.2637 0.0545 0.2291 905 ARG A NH1 6593 N NH2 . ARG A 894 ? 1.5622 1.4502 0.6735 0.2638 0.1127 0.2341 905 ARG A NH2 6594 N N . ASN A 895 ? 1.1702 1.1667 0.5104 0.2048 -0.0030 0.2480 906 ASN A N 6595 C CA . ASN A 895 ? 1.2022 1.2530 0.6026 0.1872 0.0080 0.2584 906 ASN A CA 6596 C C . ASN A 895 ? 1.2227 1.2527 0.6136 0.1777 -0.0028 0.2680 906 ASN A C 6597 O O . ASN A 895 ? 1.2561 1.2318 0.6052 0.1844 -0.0314 0.2648 906 ASN A O 6598 C CB . ASN A 895 ? 1.0180 1.1032 0.4826 0.1778 -0.0091 0.2503 906 ASN A CB 6599 C CG . ASN A 895 ? 1.0444 1.0849 0.5018 0.1791 -0.0524 0.2371 906 ASN A CG 6600 O OD1 . ASN A 895 ? 0.9473 0.9854 0.4372 0.1647 -0.0743 0.2352 906 ASN A OD1 6601 N ND2 . ASN A 895 ? 1.0058 1.0116 0.4220 0.1961 -0.0643 0.2271 906 ASN A ND2 6602 N N . TYR A 896 ? 1.1548 1.2279 0.5869 0.1612 0.0202 0.2786 907 TYR A N 6603 C CA . TYR A 896 ? 1.1833 1.2366 0.6101 0.1508 0.0156 0.2877 907 TYR A CA 6604 C C . TYR A 896 ? 1.0664 1.1564 0.5735 0.1271 0.0059 0.2852 907 TYR A C 6605 O O . TYR A 896 ? 1.0970 1.2442 0.6656 0.1141 0.0207 0.2820 907 TYR A O 6606 C CB . TYR A 896 ? 1.3395 1.3994 0.7485 0.1456 0.0538 0.2961 907 TYR A CB 6607 C CG . TYR A 896 ? 1.0902 1.1159 0.4428 0.1594 0.0661 0.2893 907 TYR A CG 6608 C CD1 . TYR A 896 ? 1.1649 1.1313 0.4540 0.1664 0.0570 0.2917 907 TYR A CD1 6609 C CD2 . TYR A 896 ? 1.0730 1.1282 0.4390 0.1650 0.0869 0.2811 907 TYR A CD2 6610 C CE1 . TYR A 896 ? 1.3408 1.2809 0.5820 0.1774 0.0692 0.2861 907 TYR A CE1 6611 C CE2 . TYR A 896 ? 1.1544 1.1814 0.4728 0.1776 0.0987 0.2757 907 TYR A CE2 6612 C CZ . TYR A 896 ? 1.3194 1.2897 0.5756 0.1831 0.0904 0.2782 907 TYR A CZ 6613 O OH . TYR A 896 ? 1.2544 1.1994 0.4648 0.1948 0.1031 0.2731 907 TYR A OH 6614 N N . THR A 897 ? 1.0492 1.1059 0.5547 0.1221 -0.0192 0.2867 908 THR A N 6615 C CA . THR A 897 ? 0.9737 1.0610 0.5512 0.0993 -0.0245 0.2860 908 THR A CA 6616 C C . THR A 897 ? 1.1037 1.1649 0.6626 0.0938 -0.0195 0.2992 908 THR A C 6617 O O . THR A 897 ? 1.0355 1.0404 0.5278 0.1090 -0.0324 0.3054 908 THR A O 6618 C CB . THR A 897 ? 1.0353 1.1150 0.6519 0.0957 -0.0651 0.2715 908 THR A CB 6619 O OG1 . THR A 897 ? 1.2884 1.3060 0.8531 0.1102 -0.0987 0.2704 908 THR A OG1 6620 C CG2 . THR A 897 ? 0.8435 0.9454 0.4781 0.1002 -0.0693 0.2586 908 THR A CG2 6621 N N . PHE A 898 ? 1.0061 1.1070 0.6224 0.0720 -0.0005 0.3035 909 PHE A N 6622 C CA . PHE A 898 ? 1.0662 1.1452 0.6701 0.0648 0.0092 0.3165 909 PHE A CA 6623 C C . PHE A 898 ? 1.0989 1.2000 0.7764 0.0437 -0.0012 0.3129 909 PHE A C 6624 O O . PHE A 898 ? 1.1682 1.3256 0.9129 0.0255 0.0116 0.3059 909 PHE A O 6625 C CB . PHE A 898 ? 1.1530 1.2572 0.7427 0.0581 0.0564 0.3279 909 PHE A CB 6626 C CG . PHE A 898 ? 1.2429 1.3306 0.7646 0.0778 0.0720 0.3313 909 PHE A CG 6627 C CD1 . PHE A 898 ? 1.3546 1.3806 0.7944 0.0948 0.0688 0.3409 909 PHE A CD1 6628 C CD2 . PHE A 898 ? 1.0774 1.2110 0.6164 0.0797 0.0907 0.3251 909 PHE A CD2 6629 C CE1 . PHE A 898 ? 1.3377 1.3458 0.7231 0.1090 0.0828 0.3373 909 PHE A CE1 6630 C CE2 . PHE A 898 ? 1.1012 1.2167 0.5865 0.0963 0.1044 0.3224 909 PHE A CE2 6631 C CZ . PHE A 898 ? 1.2047 1.2566 0.6178 0.1085 0.1000 0.3255 909 PHE A CZ 6632 N N . SER A 899 ? 1.0936 1.1507 0.7580 0.0464 -0.0240 0.3178 910 SER A N 6633 C CA . SER A 899 ? 0.9890 1.0619 0.7216 0.0282 -0.0349 0.3143 910 SER A CA 6634 C C . SER A 899 ? 1.1267 1.1735 0.8456 0.0224 -0.0209 0.3294 910 SER A C 6635 O O . SER A 899 ? 1.1735 1.1650 0.8243 0.0391 -0.0287 0.3407 910 SER A O 6636 C CB . SER A 899 ? 0.9848 1.0329 0.7316 0.0364 -0.0828 0.3025 910 SER A CB 6637 O OG . SER A 899 ? 1.0420 1.1158 0.8105 0.0381 -0.0944 0.2874 910 SER A OG 6638 N N . LEU A 900 ? 1.0256 1.1109 0.8082 -0.0016 0.0000 0.3293 911 LEU A N 6639 C CA . LEU A 900 ? 0.9690 1.0312 0.7483 -0.0099 0.0146 0.3424 911 LEU A CA 6640 C C . LEU A 900 ? 0.9500 1.0152 0.7941 -0.0220 -0.0066 0.3364 911 LEU A C 6641 O O . LEU A 900 ? 0.9530 1.0696 0.8701 -0.0440 0.0044 0.3264 911 LEU A O 6642 C CB . LEU A 900 ? 1.0048 1.1064 0.7979 -0.0293 0.0647 0.3488 911 LEU A CB 6643 C CG . LEU A 900 ? 1.2426 1.3051 0.9621 -0.0209 0.0907 0.3662 911 LEU A CG 6644 C CD1 . LEU A 900 ? 1.2520 1.3577 0.9972 -0.0445 0.1402 0.3703 911 LEU A CD1 6645 C CD2 . LEU A 900 ? 1.2648 1.2601 0.9465 -0.0099 0.0707 0.3783 911 LEU A CD2 6646 N N . GLU A 901 ? 1.0107 1.0211 0.8273 -0.0073 -0.0367 0.3425 912 GLU A N 6647 C CA . GLU A 901 ? 0.9465 0.9548 0.8217 -0.0155 -0.0587 0.3373 912 GLU A CA 6648 C C . GLU A 901 ? 0.9876 0.9694 0.8590 -0.0224 -0.0396 0.3527 912 GLU A C 6649 O O . GLU A 901 ? 1.1052 1.0357 0.9071 -0.0069 -0.0373 0.3688 912 GLU A O 6650 C CB . GLU A 901 ? 1.0445 1.0144 0.9021 0.0060 -0.1100 0.3315 912 GLU A CB 6651 C CG . GLU A 901 ? 1.0500 1.0413 0.9130 0.0121 -0.1308 0.3149 912 GLU A CG 6652 C CD . GLU A 901 ? 1.1912 1.1396 1.0238 0.0343 -0.1800 0.3095 912 GLU A CD 6653 O OE1 . GLU A 901 ? 1.1737 1.0891 1.0082 0.0413 -0.2037 0.3145 912 GLU A OE1 6654 O OE2 . GLU A 901 ? 1.2562 1.2040 1.0627 0.0451 -0.1950 0.3001 912 GLU A OE2 6655 N N . TYR A 902 ? 1.0122 1.0273 0.9567 -0.0460 -0.0245 0.3476 913 TYR A N 6656 C CA . TYR A 902 ? 1.0219 1.0118 0.9712 -0.0542 -0.0064 0.3604 913 TYR A CA 6657 C C . TYR A 902 ? 0.9866 0.9675 0.9922 -0.0556 -0.0360 0.3540 913 TYR A C 6658 O O . TYR A 902 ? 0.9414 0.9651 1.0164 -0.0688 -0.0465 0.3367 913 TYR A O 6659 C CB . TYR A 902 ? 1.0534 1.0906 1.0440 -0.0840 0.0426 0.3597 913 TYR A CB 6660 C CG . TYR A 902 ? 1.1611 1.2155 1.1082 -0.0877 0.0800 0.3661 913 TYR A CG 6661 C CD1 . TYR A 902 ? 1.1979 1.2913 1.1756 -0.1142 0.1252 0.3666 913 TYR A CD1 6662 C CD2 . TYR A 902 ? 1.4109 1.4449 1.2892 -0.0657 0.0711 0.3703 913 TYR A CD2 6663 C CE1 . TYR A 902 ? 1.4031 1.5168 1.3462 -0.1182 0.1599 0.3714 913 TYR A CE1 6664 C CE2 . TYR A 902 ? 1.6754 1.7275 1.5179 -0.0689 0.1066 0.3754 913 TYR A CE2 6665 C CZ . TYR A 902 ? 1.7058 1.7990 1.5821 -0.0950 0.1507 0.3759 913 TYR A CZ 6666 O OH . TYR A 902 ? 1.8741 1.9888 1.7182 -0.0984 0.1861 0.3802 913 TYR A OH 6667 N N . LYS A 903 ? 0.9844 0.9095 0.9606 -0.0418 -0.0486 0.3681 914 LYS A N 6668 C CA . LYS A 903 ? 1.0047 0.9233 1.0402 -0.0463 -0.0663 0.3643 914 LYS A CA 6669 C C . LYS A 903 ? 1.2448 1.1544 1.2936 -0.0632 -0.0278 0.3760 914 LYS A C 6670 O O . LYS A 903 ? 1.4175 1.2995 1.4073 -0.0608 -0.0002 0.3924 914 LYS A O 6671 C CB . LYS A 903 ? 1.1295 0.9925 1.1303 -0.0169 -0.1135 0.3707 914 LYS A CB 6672 C CG . LYS A 903 ? 1.2295 1.1016 1.2328 -0.0026 -0.1570 0.3555 914 LYS A CG 6673 C CD . LYS A 903 ? 1.3001 1.1380 1.3150 0.0163 -0.2036 0.3549 914 LYS A CD 6674 C CE . LYS A 903 ? 1.3650 1.1367 1.3142 0.0369 -0.2082 0.3786 914 LYS A CE 6675 N NZ . LYS A 903 ? 1.3222 1.0641 1.2889 0.0554 -0.2528 0.3788 914 LYS A NZ 6676 N N . PHE A 904 ? 1.2852 1.2170 1.4113 -0.0809 -0.0246 0.3670 915 PHE A N 6677 C CA . PHE A 904 ? 1.3248 1.2470 1.4700 -0.0984 0.0115 0.3762 915 PHE A CA 6678 C C . PHE A 904 ? 1.2464 1.1606 1.4563 -0.1009 -0.0067 0.3707 915 PHE A C 6679 O O . PHE A 904 ? 1.2117 1.1136 1.4350 -0.0828 -0.0505 0.3647 915 PHE A O 6680 C CB . PHE A 904 ? 1.2663 1.2472 1.4478 -0.1312 0.0585 0.3676 915 PHE A CB 6681 C CG . PHE A 904 ? 1.3738 1.3475 1.4897 -0.1326 0.0934 0.3806 915 PHE A CG 6682 C CD1 . PHE A 904 ? 1.5207 1.4304 1.5628 -0.1155 0.0991 0.4021 915 PHE A CD1 6683 C CD2 . PHE A 904 ? 1.3485 1.3799 1.4769 -0.1509 0.1210 0.3712 915 PHE A CD2 6684 C CE1 . PHE A 904 ? 1.5066 1.4097 1.4891 -0.1177 0.1331 0.4131 915 PHE A CE1 6685 C CE2 . PHE A 904 ? 1.4034 1.4311 1.4751 -0.1522 0.1539 0.3821 915 PHE A CE2 6686 C CZ . PHE A 904 ? 1.4353 1.3987 1.4343 -0.1362 0.1607 0.4026 915 PHE A CZ 6687 N N . LYS B 23 ? 2.4844 1.1209 2.5150 0.0548 0.2074 0.0057 4 LYS B N 6688 C CA . LYS B 23 ? 2.4073 1.0952 2.4357 0.0492 0.1935 0.0111 4 LYS B CA 6689 C C . LYS B 23 ? 2.5243 1.2156 2.5431 0.0378 0.1862 0.0374 4 LYS B C 6690 O O . LYS B 23 ? 2.5612 1.2572 2.5785 0.0593 0.1768 0.0653 4 LYS B O 6691 C CB . LYS B 23 ? 2.2293 0.9469 2.2711 0.0815 0.1850 0.0196 4 LYS B CB 6692 N N . THR B 24 ? 2.5192 1.2080 2.5316 0.0045 0.1903 0.0273 5 THR B N 6693 C CA . THR B 24 ? 2.3436 1.0345 2.3483 -0.0096 0.1881 0.0500 5 THR B CA 6694 C C . THR B 24 ? 2.2196 0.9612 2.2224 -0.0263 0.1766 0.0471 5 THR B C 6695 O O . THR B 24 ? 2.1197 0.8839 2.1259 -0.0434 0.1741 0.0201 5 THR B O 6696 C CB . THR B 24 ? 2.1983 0.8499 2.2028 -0.0354 0.2028 0.0442 5 THR B CB 6697 O OG1 . THR B 24 ? 2.0982 0.7560 2.1094 -0.0611 0.2051 0.0086 5 THR B OG1 6698 C CG2 . THR B 24 ? 2.1836 0.7812 2.1877 -0.0170 0.2147 0.0536 5 THR B CG2 6699 N N . VAL B 25 ? 2.2360 0.9940 2.2312 -0.0201 0.1691 0.0750 6 VAL B N 6700 C CA . VAL B 25 ? 2.1787 0.9844 2.1723 -0.0336 0.1584 0.0747 6 VAL B CA 6701 C C . VAL B 25 ? 2.1641 0.9704 2.1541 -0.0616 0.1639 0.0826 6 VAL B C 6702 O O . VAL B 25 ? 2.0938 0.8887 2.0727 -0.0553 0.1666 0.1107 6 VAL B O 6703 C CB . VAL B 25 ? 2.0044 0.8380 1.9937 -0.0058 0.1439 0.0964 6 VAL B CB 6704 C CG1 . VAL B 25 ? 1.8445 0.7233 1.8307 -0.0210 0.1345 0.0984 6 VAL B CG1 6705 C CG2 . VAL B 25 ? 1.9559 0.7987 1.9567 0.0181 0.1396 0.0833 6 VAL B CG2 6706 N N . ARG B 26 ? 2.1352 0.9547 2.1350 -0.0919 0.1657 0.0567 7 ARG B N 6707 C CA . ARG B 26 ? 2.0227 0.8464 2.0274 -0.1207 0.1719 0.0594 7 ARG B CA 6708 C C . ARG B 26 ? 1.9326 0.8052 1.9360 -0.1283 0.1610 0.0662 7 ARG B C 6709 O O . ARG B 26 ? 1.7190 0.6260 1.7256 -0.1302 0.1487 0.0491 7 ARG B O 6710 C CB . ARG B 26 ? 1.9202 0.7351 1.9407 -0.1498 0.1766 0.0262 7 ARG B CB 6711 N N . TRP B 27 ? 2.0072 0.8813 2.0042 -0.1322 0.1667 0.0911 8 TRP B N 6712 C CA . TRP B 27 ? 1.9748 0.8942 1.9722 -0.1424 0.1583 0.0956 8 TRP B CA 6713 C C . TRP B 27 ? 2.0694 1.0074 2.0890 -0.1789 0.1617 0.0732 8 TRP B C 6714 O O . TRP B 27 ? 2.1251 1.0563 2.1591 -0.1936 0.1606 0.0446 8 TRP B O 6715 C CB . TRP B 27 ? 2.0274 0.9447 2.0044 -0.1274 0.1614 0.1318 8 TRP B CB 6716 C CG . TRP B 27 ? 2.0542 1.0195 2.0261 -0.1246 0.1477 0.1379 8 TRP B CG 6717 C CD1 . TRP B 27 ? 2.1584 1.1590 2.1411 -0.1489 0.1475 0.1308 8 TRP B CD1 6718 C CD2 . TRP B 27 ? 1.9885 0.9720 1.9468 -0.0962 0.1320 0.1502 8 TRP B CD2 6719 N NE1 . TRP B 27 ? 2.1889 1.2264 2.1624 -0.1373 0.1335 0.1387 8 TRP B NE1 6720 C CE2 . TRP B 27 ? 2.0633 1.0906 2.0219 -0.1055 0.1239 0.1506 8 TRP B CE2 6721 C CE3 . TRP B 27 ? 1.8329 0.8012 1.7823 -0.0637 0.1236 0.1601 8 TRP B CE3 6722 C CZ2 . TRP B 27 ? 1.9404 0.9939 1.8889 -0.0839 0.1086 0.1607 8 TRP B CZ2 6723 C CZ3 . TRP B 27 ? 1.7110 0.7084 1.6541 -0.0419 0.1071 0.1694 8 TRP B CZ3 6724 C CH2 . TRP B 27 ? 1.7977 0.8363 1.7394 -0.0525 0.1000 0.1697 8 TRP B CH2 6725 N N . CYS B 28 ? 2.1137 1.0745 2.1364 -0.1924 0.1654 0.0854 9 CYS B N 6726 C CA . CYS B 28 ? 2.0558 1.0448 2.1046 -0.2251 0.1657 0.0652 9 CYS B CA 6727 C C . CYS B 28 ? 1.8611 0.8756 1.9065 -0.2290 0.1705 0.0869 9 CYS B C 6728 O O . CYS B 28 ? 1.6043 0.6400 1.6317 -0.2114 0.1609 0.1020 9 CYS B O 6729 C CB . CYS B 28 ? 2.0166 1.0418 2.0761 -0.2331 0.1456 0.0347 9 CYS B CB 6730 S SG . CYS B 28 ? 2.3266 1.4054 2.4124 -0.2627 0.1372 0.0194 9 CYS B SG 6731 N N . ALA B 29 ? 1.8849 0.8983 1.9489 -0.2523 0.1861 0.0871 10 ALA B N 6732 C CA . ALA B 29 ? 1.8303 0.8654 1.8906 -0.2564 0.1947 0.1074 10 ALA B CA 6733 C C . ALA B 29 ? 1.7837 0.8531 1.8831 -0.2890 0.1980 0.0870 10 ALA B C 6734 O O . ALA B 29 ? 1.6621 0.7211 1.7899 -0.3099 0.2037 0.0660 10 ALA B O 6735 C CB . ALA B 29 ? 1.8756 0.8682 1.9118 -0.2447 0.2172 0.1389 10 ALA B CB 6736 N N . VAL B 30 ? 1.8536 0.9645 1.9565 -0.2929 0.1938 0.0924 11 VAL B N 6737 C CA . VAL B 30 ? 1.9329 1.0832 2.0775 -0.3218 0.1938 0.0715 11 VAL B CA 6738 C C . VAL B 30 ? 2.0241 1.1604 2.1853 -0.3377 0.2231 0.0829 11 VAL B C 6739 O O . VAL B 30 ? 2.0320 1.1619 2.2281 -0.3600 0.2313 0.0638 11 VAL B O 6740 C CB . VAL B 30 ? 1.8331 1.0366 1.9806 -0.3208 0.1773 0.0689 11 VAL B CB 6741 C CG1 . VAL B 30 ? 1.7541 0.9810 1.9090 -0.3213 0.1491 0.0403 11 VAL B CG1 6742 C CG2 . VAL B 30 ? 1.8353 1.0332 1.9407 -0.2946 0.1799 0.1012 11 VAL B CG2 6743 N N . SER B 31 ? 2.0954 1.2249 2.2302 -0.3258 0.2395 0.1135 12 SER B N 6744 C CA . SER B 31 ? 2.1732 1.2877 2.3188 -0.3392 0.2710 0.1262 12 SER B CA 6745 C C . SER B 31 ? 2.2782 1.3307 2.4059 -0.3332 0.2920 0.1401 12 SER B C 6746 O O . SER B 31 ? 2.2869 1.3067 2.3814 -0.3108 0.2833 0.1502 12 SER B O 6747 C CB . SER B 31 ? 2.1483 1.2761 2.2669 -0.3280 0.2821 0.1529 12 SER B CB 6748 O OG . SER B 31 ? 2.1356 1.2304 2.1970 -0.2969 0.2801 0.1819 12 SER B OG 6749 N N . GLU B 32 ? 2.3085 1.3453 2.4607 -0.3529 0.3205 0.1402 13 GLU B N 6750 C CA . GLU B 32 ? 2.3431 1.3190 2.4808 -0.3496 0.3445 0.1534 13 GLU B CA 6751 C C . GLU B 32 ? 2.4057 1.3435 2.4830 -0.3212 0.3585 0.1931 13 GLU B C 6752 O O . GLU B 32 ? 2.4625 1.3458 2.5141 -0.3094 0.3728 0.2092 13 GLU B O 6753 C CB . GLU B 32 ? 2.3302 1.3014 2.5140 -0.3797 0.3734 0.1418 13 GLU B CB 6754 N N . HIS B 33 ? 2.4140 1.3800 2.4674 -0.3096 0.3532 0.2083 14 HIS B N 6755 C CA . HIS B 33 ? 2.5263 1.4606 2.5183 -0.2812 0.3621 0.2445 14 HIS B CA 6756 C C . HIS B 33 ? 2.5520 1.4675 2.5052 -0.2497 0.3360 0.2548 14 HIS B C 6757 O O . HIS B 33 ? 2.6730 1.5411 2.5829 -0.2268 0.3437 0.2800 14 HIS B O 6758 C CB . HIS B 33 ? 2.5352 1.5070 2.5141 -0.2790 0.3636 0.2548 14 HIS B CB 6759 C CG . HIS B 33 ? 2.6265 1.6140 2.6406 -0.3059 0.3932 0.2485 14 HIS B CG 6760 N ND1 . HIS B 33 ? 2.7248 1.6840 2.7086 -0.3018 0.4261 0.2731 14 HIS B ND1 6761 C CD2 . HIS B 33 ? 2.6280 1.6569 2.7062 -0.3364 0.3949 0.2195 14 HIS B CD2 6762 C CE1 . HIS B 33 ? 2.7383 1.7212 2.7691 -0.3291 0.4491 0.2595 14 HIS B CE1 6763 N NE2 . HIS B 33 ? 2.6831 1.7101 2.7738 -0.3503 0.4294 0.2268 14 HIS B NE2 6764 N N . GLU B 34 ? 2.4304 1.3829 2.4003 -0.2478 0.3055 0.2350 15 GLU B N 6765 C CA . GLU B 34 ? 2.3534 1.2935 2.2942 -0.2184 0.2811 0.2418 15 GLU B CA 6766 C C . GLU B 34 ? 2.1372 1.0399 2.0892 -0.2174 0.2806 0.2306 15 GLU B C 6767 O O . GLU B 34 ? 1.9714 0.8572 1.9028 -0.1922 0.2642 0.2362 15 GLU B O 6768 C CB . GLU B 34 ? 2.3837 1.3752 2.3335 -0.2140 0.2515 0.2272 15 GLU B CB 6769 C CG . GLU B 34 ? 2.3483 1.3784 2.3487 -0.2419 0.2420 0.1915 15 GLU B CG 6770 C CD . GLU B 34 ? 2.2518 1.3261 2.2548 -0.2346 0.2138 0.1791 15 GLU B CD 6771 O OE1 . GLU B 34 ? 2.2243 1.2921 2.2219 -0.2200 0.1963 0.1707 15 GLU B OE1 6772 O OE2 . GLU B 34 ? 2.1501 1.2649 2.1610 -0.2430 0.2109 0.1777 15 GLU B OE2 6773 N N . ALA B 35 ? 2.1295 1.0199 2.1166 -0.2444 0.2989 0.2139 16 ALA B N 6774 C CA . ALA B 35 ? 2.1790 1.0275 2.1750 -0.2450 0.3034 0.2044 16 ALA B CA 6775 C C . ALA B 35 ? 2.2228 1.0128 2.1765 -0.2215 0.3201 0.2367 16 ALA B C 6776 O O . ALA B 35 ? 2.1791 0.9352 2.1196 -0.2030 0.3134 0.2396 16 ALA B O 6777 C CB . ALA B 35 ? 2.1879 1.0375 2.2319 -0.2803 0.3196 0.1791 16 ALA B CB 6778 N N . THR B 36 ? 2.2518 1.0297 2.1832 -0.2213 0.3423 0.2606 17 THR B N 6779 C CA . THR B 36 ? 2.2555 0.9782 2.1385 -0.1968 0.3574 0.2939 17 THR B CA 6780 C C . THR B 36 ? 2.2853 1.0135 2.1229 -0.1598 0.3316 0.3144 17 THR B C 6781 O O . THR B 36 ? 2.3849 1.0705 2.1861 -0.1322 0.3298 0.3360 17 THR B O 6782 C CB . THR B 36 ? 2.1456 0.8516 2.0148 -0.2081 0.3917 0.3124 17 THR B CB 6783 N N . LYS B 37 ? 2.1481 0.9296 1.9903 -0.1591 0.3107 0.3070 18 LYS B N 6784 C CA . LYS B 37 ? 2.1643 0.9584 1.9709 -0.1260 0.2837 0.3223 18 LYS B CA 6785 C C . LYS B 37 ? 2.1387 0.9289 1.9564 -0.1091 0.2597 0.3104 18 LYS B C 6786 O O . LYS B 37 ? 2.1041 0.8861 1.8934 -0.0765 0.2406 0.3258 18 LYS B O 6787 C CB . LYS B 37 ? 1.7671 0.6191 1.5798 -0.1324 0.2700 0.3153 18 LYS B CB 6788 N N . CYS B 38 ? 2.1736 0.9698 2.0336 -0.1309 0.2609 0.2816 19 CYS B N 6789 C CA . CYS B 38 ? 2.2013 0.9927 2.0745 -0.1179 0.2425 0.2663 19 CYS B CA 6790 C C . CYS B 38 ? 2.3697 1.1017 2.2253 -0.0991 0.2515 0.2809 19 CYS B C 6791 O O . CYS B 38 ? 2.3511 1.0724 2.2132 -0.0828 0.2380 0.2724 19 CYS B O 6792 C CB . CYS B 38 ? 2.2055 1.0204 2.1244 -0.1476 0.2412 0.2293 19 CYS B CB 6793 S SG . CYS B 38 ? 2.6187 1.4371 2.5527 -0.1338 0.2188 0.2051 19 CYS B SG 6794 N N . GLN B 39 ? 2.5264 1.2189 2.3601 -0.1010 0.2760 0.3026 20 GLN B N 6795 C CA . GLN B 39 ? 2.5145 1.1466 2.3258 -0.0813 0.2861 0.3209 20 GLN B CA 6796 C C . GLN B 39 ? 2.5209 1.1325 2.2789 -0.0504 0.2834 0.3575 20 GLN B C 6797 O O . GLN B 39 ? 2.0909 0.7022 1.8268 -0.0583 0.2998 0.3728 20 GLN B O 6798 C CB . GLN B 39 ? 2.0906 0.6841 1.9186 -0.1082 0.3191 0.3155 20 GLN B CB 6799 N N . SER B 40 ? 2.4711 1.0666 2.2083 -0.0145 0.2623 0.3708 21 SER B N 6800 C CA . SER B 40 ? 2.4985 1.0913 2.2611 -0.0018 0.2451 0.3540 21 SER B CA 6801 C C . SER B 40 ? 2.4460 1.0963 2.2427 -0.0101 0.2237 0.3256 21 SER B C 6802 O O . SER B 40 ? 1.9179 0.6109 1.7076 -0.0078 0.2096 0.3282 21 SER B O 6803 C CB . SER B 40 ? 2.4583 1.0275 2.1909 0.0416 0.2254 0.3776 21 SER B CB 6804 N N . PHE B 41 ? 2.4565 1.1076 2.2874 -0.0194 0.2217 0.2983 22 PHE B N 6805 C CA . PHE B 41 ? 2.4739 1.0762 2.3164 -0.0220 0.2367 0.2909 22 PHE B CA 6806 C C . PHE B 41 ? 2.4879 1.0454 2.3086 0.0149 0.2308 0.3125 22 PHE B C 6807 O O . PHE B 41 ? 2.3785 0.9525 2.1955 0.0448 0.2062 0.3173 22 PHE B O 6808 C CB . PHE B 41 ? 2.4664 1.0423 2.3176 -0.0554 0.2677 0.2866 22 PHE B CB 6809 N N . ARG B 42 ? 2.6711 1.1725 2.4803 0.0128 0.2534 0.3246 23 ARG B N 6810 C CA . ARG B 42 ? 2.9103 1.3642 2.7019 0.0463 0.2493 0.3432 23 ARG B CA 6811 C C . ARG B 42 ? 3.1959 1.6144 2.9404 0.0656 0.2561 0.3815 23 ARG B C 6812 O O . ARG B 42 ? 3.3130 1.6870 3.0381 0.0939 0.2538 0.4006 23 ARG B O 6813 C CB . ARG B 42 ? 2.8797 1.2888 2.6922 0.0347 0.2686 0.3276 23 ARG B CB 6814 N N . ASP B 43 ? 3.2654 1.7025 2.9901 0.0510 0.2649 0.3924 24 ASP B N 6815 C CA . ASP B 43 ? 3.3521 1.7579 3.0252 0.0689 0.2724 0.4280 24 ASP B CA 6816 C C . ASP B 43 ? 3.2658 1.6923 2.9126 0.1085 0.2378 0.4458 24 ASP B C 6817 O O . ASP B 43 ? 3.3591 1.7635 3.0018 0.1406 0.2206 0.4546 24 ASP B O 6818 C CB . ASP B 43 ? 3.3458 1.7660 3.0076 0.0398 0.2953 0.4315 24 ASP B CB 6819 N N . HIS B 44 ? 2.9823 1.4526 2.6145 0.1065 0.2269 0.4496 25 HIS B N 6820 C CA . HIS B 44 ? 2.7071 1.2026 2.3161 0.1419 0.1931 0.4642 25 HIS B CA 6821 C C . HIS B 44 ? 2.5042 1.0509 2.1565 0.1502 0.1627 0.4405 25 HIS B C 6822 O O . HIS B 44 ? 2.4388 1.0296 2.0869 0.1640 0.1378 0.4417 25 HIS B O 6823 C CB . HIS B 44 ? 2.2715 0.7900 1.8432 0.1372 0.1952 0.4781 25 HIS B CB 6824 N N . MET B 45 ? 2.4151 0.9545 2.1079 0.1421 0.1663 0.4182 26 MET B N 6825 C CA . MET B 45 ? 2.3481 0.9294 2.0812 0.1511 0.1420 0.3947 26 MET B CA 6826 C C . MET B 45 ? 2.3063 0.8562 2.0615 0.1703 0.1378 0.3879 26 MET B C 6827 O O . MET B 45 ? 2.1977 0.7754 1.9844 0.1849 0.1178 0.3711 26 MET B O 6828 C CB . MET B 45 ? 2.2529 0.8745 2.0188 0.1143 0.1508 0.3640 26 MET B CB 6829 N N . LYS B 46 ? 2.4064 0.8973 2.1457 0.1706 0.1583 0.4005 27 LYS B N 6830 C CA . LYS B 46 ? 2.4853 0.9401 2.2421 0.1905 0.1562 0.3964 27 LYS B CA 6831 C C . LYS B 46 ? 2.6105 1.0641 2.3584 0.2372 0.1255 0.4162 27 LYS B C 6832 O O . LYS B 46 ? 2.4958 0.9006 2.2187 0.2595 0.1274 0.4400 27 LYS B O 6833 C CB . LYS B 46 ? 2.3663 0.7558 2.1075 0.1779 0.1878 0.4058 27 LYS B CB 6834 N N . SER B 47 ? 2.6930 1.2011 2.4638 0.2521 0.0968 0.4059 28 SER B N 6835 C CA . SER B 47 ? 2.7477 1.2660 2.5216 0.2960 0.0637 0.4205 28 SER B CA 6836 C C . SER B 47 ? 2.8028 1.3493 2.6297 0.3113 0.0461 0.3948 28 SER B C 6837 O O . SER B 47 ? 2.6691 1.2645 2.5227 0.2981 0.0406 0.3715 28 SER B O 6838 C CB . SER B 47 ? 2.6031 1.1630 2.3539 0.3056 0.0428 0.4356 28 SER B CB 6839 O OG . SER B 47 ? 2.5860 1.1147 2.2816 0.2975 0.0591 0.4613 28 SER B OG 6840 N N . VAL B 48 ? 2.9589 1.4725 2.7996 0.3399 0.0387 0.3994 29 VAL B N 6841 C CA . VAL B 48 ? 2.9716 1.5046 2.8622 0.3586 0.0243 0.3756 29 VAL B CA 6842 C C . VAL B 48 ? 2.9307 1.4757 2.8450 0.3265 0.0466 0.3405 29 VAL B C 6843 O O . VAL B 48 ? 2.8945 1.4897 2.8341 0.3212 0.0379 0.3190 29 VAL B O 6844 C CB . VAL B 48 ? 2.5106 1.1018 2.4291 0.3874 -0.0129 0.3751 29 VAL B CB 6845 C CG1 . VAL B 48 ? 2.4108 1.0094 2.3791 0.4166 -0.0289 0.3568 29 VAL B CG1 6846 C CG2 . VAL B 48 ? 2.5835 1.1726 2.4723 0.4125 -0.0335 0.4102 29 VAL B CG2 6847 N N . ILE B 49 ? 2.9267 1.4251 2.8319 0.3052 0.0761 0.3348 30 ILE B N 6848 C CA . ILE B 49 ? 2.8241 1.3295 2.7509 0.2754 0.0979 0.3014 30 ILE B CA 6849 C C . ILE B 49 ? 2.7936 1.2761 2.7489 0.2948 0.1006 0.2847 30 ILE B C 6850 O O . ILE B 49 ? 2.8284 1.2576 2.7755 0.3062 0.1095 0.2963 30 ILE B O 6851 C CB . ILE B 49 ? 2.7898 1.2628 2.6952 0.2360 0.1293 0.3004 30 ILE B CB 6852 C CG1 . ILE B 49 ? 2.6834 1.1809 2.5628 0.2150 0.1299 0.3142 30 ILE B CG1 6853 C CG2 . ILE B 49 ? 2.7620 1.2418 2.6919 0.2074 0.1482 0.2644 30 ILE B CG2 6854 C CD1 . ILE B 49 ? 2.6567 1.1257 2.5201 0.1770 0.1604 0.3133 30 ILE B CD1 6855 N N . PRO B 50 ? 2.7340 1.2560 2.7219 0.2993 0.0946 0.2577 31 PRO B N 6856 C CA . PRO B 50 ? 2.7788 1.2852 2.7955 0.3169 0.1003 0.2380 31 PRO B CA 6857 C C . PRO B 50 ? 2.9137 1.3797 2.9274 0.2888 0.1322 0.2206 31 PRO B C 6858 O O . PRO B 50 ? 3.0080 1.4220 3.0022 0.2846 0.1445 0.2359 31 PRO B O 6859 C CB . PRO B 50 ? 2.6419 1.2072 2.6882 0.3194 0.0925 0.2128 31 PRO B CB 6860 C CG . PRO B 50 ? 2.5710 1.1799 2.6067 0.3184 0.0716 0.2268 31 PRO B CG 6861 C CD . PRO B 50 ? 2.5999 1.1845 2.5986 0.2914 0.0821 0.2459 31 PRO B CD 6862 N N . SER B 51 ? 2.9227 1.4120 2.9553 0.2701 0.1454 0.1883 32 SER B N 6863 C CA . SER B 51 ? 2.9741 1.4302 3.0058 0.2426 0.1728 0.1672 32 SER B CA 6864 C C . SER B 51 ? 2.8809 1.3662 2.9057 0.2009 0.1826 0.1488 32 SER B C 6865 O O . SER B 51 ? 2.8544 1.3264 2.8594 0.1753 0.1900 0.1586 32 SER B O 6866 C CB . SER B 51 ? 3.0128 1.4625 3.0715 0.2586 0.1813 0.1423 32 SER B CB 6867 N N . ASP B 52 ? 2.8135 1.3389 2.8557 0.1949 0.1831 0.1219 33 ASP B N 6868 C CA . ASP B 52 ? 2.7500 1.3063 2.7869 0.1584 0.1889 0.1025 33 ASP B CA 6869 C C . ASP B 52 ? 2.6944 1.3104 2.7369 0.1632 0.1717 0.1040 33 ASP B C 6870 O O . ASP B 52 ? 2.6663 1.3135 2.7258 0.1684 0.1720 0.0835 33 ASP B O 6871 C CB . ASP B 52 ? 2.7119 1.2600 2.7583 0.1426 0.2062 0.0669 33 ASP B CB 6872 N N . GLY B 53 ? 2.6326 1.2631 2.6599 0.1612 0.1586 0.1284 34 GLY B N 6873 C CA . GLY B 53 ? 2.4894 1.1738 2.5208 0.1663 0.1415 0.1321 34 GLY B CA 6874 C C . GLY B 53 ? 2.5806 1.2802 2.5903 0.1456 0.1357 0.1487 34 GLY B C 6875 O O . GLY B 53 ? 2.5551 1.2660 2.5594 0.1123 0.1451 0.1345 34 GLY B O 6876 N N . PRO B 54 ? 2.7158 1.4160 2.7132 0.1661 0.1195 0.1784 35 PRO B N 6877 C CA . PRO B 54 ? 2.6662 1.3858 2.6423 0.1523 0.1125 0.1967 35 PRO B CA 6878 C C . PRO B 54 ? 2.6310 1.3170 2.5859 0.1240 0.1309 0.2050 35 PRO B C 6879 O O . PRO B 54 ? 2.6454 1.3033 2.5784 0.1334 0.1306 0.2324 35 PRO B O 6880 C CB . PRO B 54 ? 2.7198 1.4397 2.6880 0.1887 0.0900 0.2252 35 PRO B CB 6881 C CG . PRO B 54 ? 2.8288 1.5069 2.8054 0.2144 0.0914 0.2287 35 PRO B CG 6882 C CD . PRO B 54 ? 2.8029 1.4825 2.8051 0.2060 0.1060 0.1962 35 PRO B CD 6883 N N . SER B 55 ? 2.5626 1.2521 2.5244 0.0901 0.1466 0.1809 36 SER B N 6884 C CA . SER B 55 ? 2.5242 1.1871 2.4742 0.0604 0.1648 0.1839 36 SER B CA 6885 C C . SER B 55 ? 2.4572 1.1600 2.4054 0.0307 0.1643 0.1775 36 SER B C 6886 O O . SER B 55 ? 2.4324 1.1764 2.3930 0.0237 0.1558 0.1578 36 SER B O 6887 C CB . SER B 55 ? 2.4596 1.0901 2.4230 0.0441 0.1824 0.1590 36 SER B CB 6888 O OG . SER B 55 ? 2.3546 1.0172 2.3344 0.0291 0.1805 0.1267 36 SER B OG 6889 N N . VAL B 56 ? 2.4305 1.1203 2.3636 0.0139 0.1748 0.1939 37 VAL B N 6890 C CA . VAL B 56 ? 2.3398 1.0661 2.2738 -0.0146 0.1760 0.1884 37 VAL B CA 6891 C C . VAL B 56 ? 2.2643 0.9671 2.2017 -0.0471 0.1978 0.1839 37 VAL B C 6892 O O . VAL B 56 ? 2.1748 0.8418 2.0958 -0.0450 0.2115 0.2067 37 VAL B O 6893 C CB . VAL B 56 ? 2.3757 1.1278 2.2890 -0.0004 0.1635 0.2150 37 VAL B CB 6894 C CG1 . VAL B 56 ? 2.4714 1.1829 2.3571 0.0230 0.1666 0.2484 37 VAL B CG1 6895 C CG2 . VAL B 56 ? 2.3448 1.1282 2.2586 -0.0308 0.1690 0.2114 37 VAL B CG2 6896 N N . ALA B 57 ? 2.2666 0.9894 2.2259 -0.0767 0.2009 0.1537 38 ALA B N 6897 C CA . ALA B 57 ? 2.2015 0.9083 2.1730 -0.1096 0.2193 0.1439 38 ALA B CA 6898 C C . ALA B 57 ? 2.2045 0.9553 2.1844 -0.1350 0.2173 0.1394 38 ALA B C 6899 O O . ALA B 57 ? 2.1679 0.9617 2.1447 -0.1289 0.2011 0.1394 38 ALA B O 6900 C CB . ALA B 57 ? 2.0955 0.7869 2.0881 -0.1248 0.2232 0.1104 38 ALA B CB 6901 N N . CYS B 58 ? 2.2041 0.9442 2.1976 -0.1633 0.2347 0.1350 39 CYS B N 6902 C CA . CYS B 58 ? 2.1838 0.9650 2.1912 -0.1887 0.2350 0.1295 39 CYS B CA 6903 C C . CYS B 58 ? 2.2154 1.0110 2.2578 -0.2219 0.2350 0.0931 39 CYS B C 6904 O O . CYS B 58 ? 2.2606 1.0214 2.3165 -0.2341 0.2475 0.0804 39 CYS B O 6905 C CB . CYS B 58 ? 2.1391 0.9030 2.1341 -0.1931 0.2558 0.1578 39 CYS B CB 6906 S SG . CYS B 58 ? 3.3880 2.1455 3.3370 -0.1556 0.2503 0.1996 39 CYS B SG 6907 N N . VAL B 59 ? 2.1081 0.9547 2.1645 -0.2356 0.2196 0.0759 40 VAL B N 6908 C CA . VAL B 59 ? 1.9814 0.8482 2.0701 -0.2660 0.2142 0.0406 40 VAL B CA 6909 C C . VAL B 59 ? 1.9129 0.8236 2.0207 -0.2874 0.2140 0.0404 40 VAL B C 6910 O O . VAL B 59 ? 1.7809 0.7241 1.8759 -0.2771 0.2054 0.0547 40 VAL B O 6911 C CB . VAL B 59 ? 1.8958 0.7820 1.9835 -0.2607 0.1915 0.0124 40 VAL B CB 6912 C CG1 . VAL B 59 ? 1.8830 0.7874 1.9996 -0.2909 0.1824 -0.0253 40 VAL B CG1 6913 C CG2 . VAL B 59 ? 1.6883 0.5329 1.7585 -0.2374 0.1936 0.0129 40 VAL B CG2 6914 N N . LYS B 60 ? 2.0433 0.9553 2.1841 -0.3168 0.2240 0.0237 41 LYS B N 6915 C CA . LYS B 60 ? 2.1265 1.0794 2.2921 -0.3379 0.2271 0.0229 41 LYS B CA 6916 C C . LYS B 60 ? 2.2061 1.2055 2.4018 -0.3585 0.2037 -0.0135 41 LYS B C 6917 O O . LYS B 60 ? 2.3296 1.3197 2.5443 -0.3731 0.1964 -0.0433 41 LYS B O 6918 C CB . LYS B 60 ? 2.1774 1.1049 2.3642 -0.3566 0.2565 0.0311 41 LYS B CB 6919 N N . LYS B 61 ? 2.0841 1.1320 2.2817 -0.3585 0.1911 -0.0110 42 LYS B N 6920 C CA . LYS B 61 ? 1.9197 1.0155 2.1453 -0.3771 0.1682 -0.0427 42 LYS B CA 6921 C C . LYS B 61 ? 1.8530 0.9935 2.1010 -0.3890 0.1728 -0.0338 42 LYS B C 6922 O O . LYS B 61 ? 1.8456 0.9811 2.0768 -0.3780 0.1902 -0.0024 42 LYS B O 6923 C CB . LYS B 61 ? 1.8103 0.9221 2.0111 -0.3604 0.1417 -0.0549 42 LYS B CB 6924 C CG . LYS B 61 ? 1.9060 0.9802 2.0905 -0.3519 0.1353 -0.0723 42 LYS B CG 6925 C CD . LYS B 61 ? 2.0242 1.0939 2.2380 -0.3771 0.1286 -0.1075 42 LYS B CD 6926 C CE . LYS B 61 ? 2.0514 1.0809 2.2456 -0.3680 0.1233 -0.1259 42 LYS B CE 6927 N NZ . LYS B 61 ? 2.0546 1.0786 2.2738 -0.3923 0.1138 -0.1624 42 LYS B NZ 6928 N N . ALA B 62 ? 1.7880 0.9715 2.0726 -0.4102 0.1565 -0.0621 43 ALA B N 6929 C CA . ALA B 62 ? 1.6670 0.8965 1.9812 -0.4230 0.1611 -0.0577 43 ALA B CA 6930 C C . ALA B 62 ? 1.8487 1.1125 2.1398 -0.4063 0.1484 -0.0436 43 ALA B C 6931 O O . ALA B 62 ? 1.8595 1.1185 2.1307 -0.3941 0.1655 -0.0127 43 ALA B O 6932 C CB . ALA B 62 ? 1.4350 0.7016 1.7997 -0.4494 0.1455 -0.0939 43 ALA B CB 6933 N N . SER B 63 ? 1.9056 1.2019 2.1971 -0.4055 0.1183 -0.0669 44 SER B N 6934 C CA . SER B 63 ? 1.8160 1.1473 2.0901 -0.3918 0.1049 -0.0575 44 SER B CA 6935 C C . SER B 63 ? 1.7833 1.0897 2.0103 -0.3659 0.0967 -0.0475 44 SER B C 6936 O O . SER B 63 ? 1.6833 0.9489 1.8931 -0.3586 0.0987 -0.0515 44 SER B O 6937 C CB . SER B 63 ? 1.8378 1.2224 2.1402 -0.4050 0.0773 -0.0877 44 SER B CB 6938 O OG . SER B 63 ? 1.8750 1.2916 2.1607 -0.3916 0.0646 -0.0795 44 SER B OG 6939 N N . TYR B 64 ? 1.7557 1.0877 1.9649 -0.3519 0.0885 -0.0352 45 TYR B N 6940 C CA . TYR B 64 ? 1.5862 0.9012 1.7558 -0.3269 0.0811 -0.0262 45 TYR B CA 6941 C C . TYR B 64 ? 1.5585 0.8698 1.7212 -0.3264 0.0601 -0.0570 45 TYR B C 6942 O O . TYR B 64 ? 1.3997 0.6803 1.5342 -0.3083 0.0604 -0.0543 45 TYR B O 6943 C CB . TYR B 64 ? 1.4732 0.8205 1.6304 -0.3152 0.0762 -0.0100 45 TYR B CB 6944 C CG . TYR B 64 ? 1.5382 0.8657 1.6710 -0.2982 0.0953 0.0271 45 TYR B CG 6945 C CD1 . TYR B 64 ? 1.5363 0.8180 1.6410 -0.2790 0.1046 0.0441 45 TYR B CD1 6946 C CD2 . TYR B 64 ? 1.4999 0.8540 1.6361 -0.2998 0.1028 0.0444 45 TYR B CD2 6947 C CE1 . TYR B 64 ? 1.5742 0.8372 1.6525 -0.2610 0.1180 0.0772 45 TYR B CE1 6948 C CE2 . TYR B 64 ? 1.4704 0.8035 1.5769 -0.2826 0.1183 0.0774 45 TYR B CE2 6949 C CZ . TYR B 64 ? 1.5709 0.8586 1.6475 -0.2628 0.1243 0.0937 45 TYR B CZ 6950 O OH . TYR B 64 ? 1.6116 0.8783 1.6552 -0.2434 0.1357 0.1257 45 TYR B OH 6951 N N . LEU B 65 ? 1.6924 1.0350 1.8797 -0.3449 0.0418 -0.0865 46 LEU B N 6952 C CA . LEU B 65 ? 1.7191 1.0571 1.8954 -0.3457 0.0200 -0.1189 46 LEU B CA 6953 C C . LEU B 65 ? 1.7996 1.0888 1.9693 -0.3465 0.0285 -0.1279 46 LEU B C 6954 O O . LEU B 65 ? 1.7472 1.0107 1.8886 -0.3332 0.0229 -0.1387 46 LEU B O 6955 C CB . LEU B 65 ? 1.6688 1.0493 1.8735 -0.3657 -0.0031 -0.1486 46 LEU B CB 6956 C CG . LEU B 65 ? 1.6069 1.0407 1.8200 -0.3650 -0.0185 -0.1488 46 LEU B CG 6957 C CD1 . LEU B 65 ? 1.5932 1.0234 1.7673 -0.3427 -0.0233 -0.1400 46 LEU B CD1 6958 C CD2 . LEU B 65 ? 1.6294 1.0897 1.8740 -0.3729 -0.0013 -0.1257 46 LEU B CD2 6959 N N . ASP B 66 ? 1.8938 1.1699 2.0904 -0.3620 0.0441 -0.1236 47 ASP B N 6960 C CA . ASP B 66 ? 2.0392 1.2690 2.2350 -0.3657 0.0537 -0.1326 47 ASP B CA 6961 C C . ASP B 66 ? 2.0668 1.2530 2.2280 -0.3405 0.0678 -0.1121 47 ASP B C 6962 O O . ASP B 66 ? 2.1452 1.2945 2.2949 -0.3365 0.0692 -0.1251 47 ASP B O 6963 C CB . ASP B 66 ? 2.1345 1.3577 2.3661 -0.3858 0.0733 -0.1260 47 ASP B CB 6964 C CG . ASP B 66 ? 2.1381 1.4050 2.4118 -0.4112 0.0596 -0.1501 47 ASP B CG 6965 O OD1 . ASP B 66 ? 2.1840 1.4440 2.4749 -0.4269 0.0488 -0.1797 47 ASP B OD1 6966 O OD2 . ASP B 66 ? 2.0416 1.3502 2.3319 -0.4146 0.0590 -0.1400 47 ASP B OD2 6967 N N . CYS B 67 ? 2.0075 1.1989 2.1526 -0.3228 0.0774 -0.0808 48 CYS B N 6968 C CA . CYS B 67 ? 1.9949 1.1512 2.1097 -0.2961 0.0881 -0.0598 48 CYS B CA 6969 C C . CYS B 67 ? 1.8580 1.0127 1.9487 -0.2801 0.0739 -0.0764 48 CYS B C 6970 O O . CYS B 67 ? 1.8678 0.9866 1.9440 -0.2679 0.0790 -0.0815 48 CYS B O 6971 C CB . CYS B 67 ? 1.9987 1.1638 2.1019 -0.2810 0.0986 -0.0234 48 CYS B CB 6972 S SG . CYS B 67 ? 2.7932 1.9391 2.9088 -0.2906 0.1240 0.0030 48 CYS B SG 6973 N N . ILE B 68 ? 1.7066 0.8992 1.7926 -0.2798 0.0579 -0.0850 49 ILE B N 6974 C CA . ILE B 68 ? 1.7338 0.9256 1.7941 -0.2658 0.0466 -0.1020 49 ILE B CA 6975 C C . ILE B 68 ? 1.8616 1.0360 1.9197 -0.2769 0.0364 -0.1381 49 ILE B C 6976 O O . ILE B 68 ? 1.8903 1.0389 1.9243 -0.2626 0.0379 -0.1495 49 ILE B O 6977 C CB . ILE B 68 ? 1.7629 0.9976 1.8159 -0.2642 0.0326 -0.1029 49 ILE B CB 6978 C CG1 . ILE B 68 ? 1.7902 1.0330 1.8257 -0.2681 0.0137 -0.1374 49 ILE B CG1 6979 C CG2 . ILE B 68 ? 1.6783 0.9495 1.7594 -0.2818 0.0299 -0.0940 49 ILE B CG2 6980 C CD1 . ILE B 68 ? 1.7942 1.0163 1.7918 -0.2452 0.0176 -0.1396 49 ILE B CD1 6981 N N . ARG B 69 ? 1.9160 1.1043 1.9995 -0.3018 0.0265 -0.1565 50 ARG B N 6982 C CA . ARG B 69 ? 2.0030 1.1739 2.0855 -0.3138 0.0142 -0.1917 50 ARG B CA 6983 C C . ARG B 69 ? 2.1114 1.2314 2.1905 -0.3086 0.0320 -0.1893 50 ARG B C 6984 O O . ARG B 69 ? 2.1792 1.2732 2.2433 -0.3080 0.0259 -0.2155 50 ARG B O 6985 C CB . ARG B 69 ? 2.0101 1.2088 2.1265 -0.3417 0.0001 -0.2092 50 ARG B CB 6986 C CG . ARG B 69 ? 2.0442 1.2944 2.1644 -0.3473 -0.0225 -0.2187 50 ARG B CG 6987 C CD . ARG B 69 ? 2.1198 1.3713 2.2078 -0.3421 -0.0484 -0.2518 50 ARG B CD 6988 N NE . ARG B 69 ? 2.0709 1.3686 2.1546 -0.3416 -0.0687 -0.2566 50 ARG B NE 6989 C CZ . ARG B 69 ? 1.9431 1.2807 2.0505 -0.3596 -0.0890 -0.2716 50 ARG B CZ 6990 N NH1 . ARG B 69 ? 1.8132 1.1514 1.9534 -0.3807 -0.0904 -0.2840 50 ARG B NH1 6991 N NH2 . ARG B 69 ? 1.8604 1.2397 1.9610 -0.3559 -0.1065 -0.2745 50 ARG B NH2 6992 N N . ALA B 70 ? 2.1156 1.2198 2.2057 -0.3038 0.0537 -0.1581 51 ALA B N 6993 C CA . ALA B 70 ? 2.1410 1.1961 2.2277 -0.2967 0.0718 -0.1518 51 ALA B CA 6994 C C . ALA B 70 ? 2.0580 1.0910 2.1144 -0.2674 0.0780 -0.1440 51 ALA B C 6995 O O . ALA B 70 ? 2.0931 1.0906 2.1387 -0.2609 0.0829 -0.1584 51 ALA B O 6996 C CB . ALA B 70 ? 2.1740 1.2183 2.2786 -0.3003 0.0923 -0.1208 51 ALA B CB 6997 N N . ILE B 71 ? 1.8899 0.9450 1.9347 -0.2497 0.0784 -0.1220 52 ILE B N 6998 C CA . ILE B 71 ? 1.8401 0.8813 1.8611 -0.2215 0.0838 -0.1148 52 ILE B CA 6999 C C . ILE B 71 ? 1.9566 0.9973 1.9571 -0.2201 0.0732 -0.1481 52 ILE B C 7000 O O . ILE B 71 ? 2.0591 1.0775 2.0413 -0.2006 0.0811 -0.1522 52 ILE B O 7001 C CB . ILE B 71 ? 1.6489 0.7177 1.6643 -0.2044 0.0839 -0.0863 52 ILE B CB 7002 C CG1 . ILE B 71 ? 1.5337 0.6014 1.5624 -0.2057 0.0933 -0.0545 52 ILE B CG1 7003 C CG2 . ILE B 71 ? 1.5985 0.6539 1.5966 -0.1747 0.0903 -0.0784 52 ILE B CG2 7004 C CD1 . ILE B 71 ? 1.4507 0.5340 1.4697 -0.1834 0.0941 -0.0251 52 ILE B CD1 7005 N N . ALA B 72 ? 1.9465 1.0114 1.9490 -0.2400 0.0554 -0.1723 53 ALA B N 7006 C CA . ALA B 72 ? 2.0942 1.1550 2.0712 -0.2404 0.0428 -0.2070 53 ALA B CA 7007 C C . ALA B 72 ? 2.1059 1.1227 2.0772 -0.2411 0.0490 -0.2274 53 ALA B C 7008 O O . ALA B 72 ? 2.0552 1.0538 1.9970 -0.2292 0.0496 -0.2472 53 ALA B O 7009 C CB . ALA B 72 ? 2.1705 1.2649 2.1541 -0.2621 0.0187 -0.2291 53 ALA B CB 7010 N N . ALA B 73 ? 2.0528 1.0513 2.0508 -0.2551 0.0554 -0.2224 54 ALA B N 7011 C CA . ALA B 73 ? 2.0343 0.9877 2.0301 -0.2562 0.0636 -0.2386 54 ALA B CA 7012 C C . ALA B 73 ? 2.0053 0.9284 1.9962 -0.2317 0.0868 -0.2137 54 ALA B C 7013 O O . ALA B 73 ? 2.0065 0.9262 1.9749 -0.2093 0.0923 -0.2127 54 ALA B O 7014 C CB . ALA B 73 ? 2.0092 0.9545 2.0360 -0.2826 0.0618 -0.2447 54 ALA B CB 7015 N N . ASN B 74 ? 1.9484 0.8498 1.9603 -0.2355 0.1007 -0.1937 55 ASN B N 7016 C CA . ASN B 74 ? 1.9531 0.8270 1.9622 -0.2113 0.1198 -0.1673 55 ASN B CA 7017 C C . ASN B 74 ? 2.0027 0.8611 2.0321 -0.2168 0.1327 -0.1394 55 ASN B C 7018 O O . ASN B 74 ? 1.9291 0.7636 1.9558 -0.1963 0.1464 -0.1152 55 ASN B O 7019 C CB . ASN B 74 ? 1.9752 0.8081 1.9702 -0.1995 0.1285 -0.1869 55 ASN B CB 7020 C CG . ASN B 74 ? 1.8623 0.6998 1.8368 -0.1710 0.1332 -0.1840 55 ASN B CG 7021 O OD1 . ASN B 74 ? 1.7877 0.6372 1.7415 -0.1696 0.1255 -0.2073 55 ASN B OD1 7022 N ND2 . ASN B 74 ? 1.7456 0.5731 1.7255 -0.1474 0.1459 -0.1556 55 ASN B ND2 7023 N N . GLU B 75 ? 2.0981 0.9700 2.1475 -0.2435 0.1285 -0.1428 56 GLU B N 7024 C CA . GLU B 75 ? 2.2731 1.1288 2.3397 -0.2508 0.1440 -0.1174 56 GLU B CA 7025 C C . GLU B 75 ? 2.2820 1.1654 2.3465 -0.2403 0.1459 -0.0828 56 GLU B C 7026 O O . GLU B 75 ? 2.2999 1.1789 2.3755 -0.2486 0.1573 -0.0616 56 GLU B O 7027 C CB . GLU B 75 ? 2.3871 1.2454 2.4802 -0.2844 0.1423 -0.1359 56 GLU B CB 7028 C CG . GLU B 75 ? 2.3757 1.2355 2.4701 -0.3005 0.1252 -0.1789 56 GLU B CG 7029 C CD . GLU B 75 ? 2.1685 1.0790 2.2629 -0.3102 0.1016 -0.1948 56 GLU B CD 7030 O OE1 . GLU B 75 ? 2.0877 1.0283 2.1723 -0.2966 0.0987 -0.1750 56 GLU B OE1 7031 O OE2 . GLU B 75 ? 2.1329 1.0526 2.2367 -0.3309 0.0849 -0.2273 56 GLU B OE2 7032 N N . ALA B 76 ? 2.2823 1.1931 2.3312 -0.2221 0.1357 -0.0779 57 ALA B N 7033 C CA . ALA B 76 ? 2.1815 1.1181 2.2250 -0.2090 0.1352 -0.0468 57 ALA B CA 7034 C C . ALA B 76 ? 2.0685 1.0188 2.0944 -0.1827 0.1278 -0.0445 57 ALA B C 7035 O O . ALA B 76 ? 2.0742 1.0296 2.0930 -0.1822 0.1204 -0.0705 57 ALA B O 7036 C CB . ALA B 76 ? 2.1472 1.1259 2.2043 -0.2312 0.1263 -0.0491 57 ALA B CB 7037 N N . ASP B 77 ? 2.0026 0.9579 2.0208 -0.1603 0.1299 -0.0141 58 ASP B N 7038 C CA . ASP B 77 ? 1.8796 0.8466 1.8870 -0.1336 0.1246 -0.0106 58 ASP B CA 7039 C C . ASP B 77 ? 1.6962 0.7012 1.6998 -0.1243 0.1155 0.0097 58 ASP B C 7040 O O . ASP B 77 ? 1.4851 0.5161 1.4846 -0.1159 0.1077 0.0014 58 ASP B O 7041 C CB . ASP B 77 ? 1.9203 0.8505 1.9242 -0.1072 0.1339 0.0025 58 ASP B CB 7042 C CG . ASP B 77 ? 2.0909 0.9814 2.0976 -0.1145 0.1438 -0.0183 58 ASP B CG 7043 O OD1 . ASP B 77 ? 2.0662 0.9612 2.0722 -0.1298 0.1404 -0.0490 58 ASP B OD1 7044 O OD2 . ASP B 77 ? 2.2236 1.0768 2.2312 -0.1044 0.1543 -0.0043 58 ASP B OD2 7045 N N . ALA B 78 ? 1.8098 0.8161 1.8130 -0.1258 0.1180 0.0358 59 ALA B N 7046 C CA . ALA B 78 ? 1.8310 0.8685 1.8278 -0.1144 0.1098 0.0573 59 ALA B CA 7047 C C . ALA B 78 ? 1.9213 0.9779 1.9209 -0.1359 0.1110 0.0670 59 ALA B C 7048 O O . ALA B 78 ? 2.0980 1.1321 2.0984 -0.1448 0.1223 0.0789 59 ALA B O 7049 C CB . ALA B 78 ? 1.7755 0.7943 1.7622 -0.0829 0.1102 0.0852 59 ALA B CB 7050 N N . VAL B 79 ? 1.7316 0.8290 1.7334 -0.1441 0.1009 0.0615 60 VAL B N 7051 C CA . VAL B 79 ? 1.6231 0.7442 1.6282 -0.1600 0.1019 0.0731 60 VAL B CA 7052 C C . VAL B 79 ? 1.5898 0.7440 1.5849 -0.1461 0.0912 0.0858 60 VAL B C 7053 O O . VAL B 79 ? 1.6085 0.7810 1.6033 -0.1390 0.0814 0.0725 60 VAL B O 7054 C CB . VAL B 79 ? 1.6097 0.7528 1.6354 -0.1922 0.0994 0.0470 60 VAL B CB 7055 C CG1 . VAL B 79 ? 1.5184 0.6821 1.5527 -0.2082 0.1050 0.0605 60 VAL B CG1 7056 C CG2 . VAL B 79 ? 1.8208 0.9338 1.8582 -0.2062 0.1060 0.0271 60 VAL B CG2 7057 N N . THR B 80 ? 1.6261 0.7859 1.6109 -0.1420 0.0943 0.1113 61 THR B N 7058 C CA . THR B 80 ? 1.6584 0.8496 1.6330 -0.1310 0.0842 0.1231 61 THR B CA 7059 C C . THR B 80 ? 1.5828 0.8110 1.5699 -0.1567 0.0825 0.1118 61 THR B C 7060 O O . THR B 80 ? 1.6186 0.8475 1.6166 -0.1773 0.0926 0.1120 61 THR B O 7061 C CB . THR B 80 ? 1.7760 0.9534 1.7267 -0.1098 0.0860 0.1561 61 THR B CB 7062 O OG1 . THR B 80 ? 1.7460 0.9555 1.6863 -0.1051 0.0773 0.1658 61 THR B OG1 7063 C CG2 . THR B 80 ? 1.8962 1.0498 1.8427 -0.1232 0.1030 0.1683 61 THR B CG2 7064 N N . LEU B 81 ? 1.3844 0.6491 1.3726 -0.1543 0.0684 0.1009 62 LEU B N 7065 C CA . LEU B 81 ? 1.3140 0.6257 1.3172 -0.1753 0.0603 0.0860 62 LEU B CA 7066 C C . LEU B 81 ? 1.2869 0.6492 1.2822 -0.1625 0.0454 0.0959 62 LEU B C 7067 O O . LEU B 81 ? 1.1322 0.5022 1.1150 -0.1381 0.0359 0.1050 62 LEU B O 7068 C CB . LEU B 81 ? 1.3434 0.6668 1.3586 -0.1871 0.0506 0.0538 62 LEU B CB 7069 C CG . LEU B 81 ? 1.3449 0.6240 1.3716 -0.2051 0.0625 0.0359 62 LEU B CG 7070 C CD1 . LEU B 81 ? 1.3635 0.6551 1.3916 -0.2117 0.0489 0.0035 62 LEU B CD1 7071 C CD2 . LEU B 81 ? 1.1683 0.4538 1.2175 -0.2284 0.0707 0.0368 62 LEU B CD2 7072 N N . ASP B 82 ? 1.4583 0.8553 1.4651 -0.1793 0.0436 0.0926 63 ASP B N 7073 C CA . ASP B 82 ? 1.3960 0.8435 1.3987 -0.1704 0.0287 0.0961 63 ASP B CA 7074 C C . ASP B 82 ? 1.2643 0.7415 1.2727 -0.1689 0.0118 0.0734 63 ASP B C 7075 O O . ASP B 82 ? 1.2312 0.6936 1.2465 -0.1791 0.0116 0.0534 63 ASP B O 7076 C CB . ASP B 82 ? 1.3556 0.8289 1.3711 -0.1885 0.0343 0.0986 63 ASP B CB 7077 C CG . ASP B 82 ? 1.4846 0.9304 1.4848 -0.1859 0.0529 0.1250 63 ASP B CG 7078 O OD1 . ASP B 82 ? 1.7351 1.1303 1.7233 -0.1817 0.0668 0.1365 63 ASP B OD1 7079 O OD2 . ASP B 82 ? 1.2839 0.7554 1.2806 -0.1870 0.0548 0.1346 63 ASP B OD2 7080 N N . ALA B 83 ? 1.1616 0.6775 1.1643 -0.1559 -0.0014 0.0764 64 ALA B N 7081 C CA . ALA B 83 ? 1.1165 0.6563 1.1185 -0.1509 -0.0145 0.0588 64 ALA B CA 7082 C C . ALA B 83 ? 1.0462 0.5967 1.0578 -0.1706 -0.0205 0.0349 64 ALA B C 7083 O O . ALA B 83 ? 1.0586 0.6013 1.0622 -0.1688 -0.0255 0.0177 64 ALA B O 7084 C CB . ALA B 83 ? 1.0001 0.5803 0.9984 -0.1379 -0.0253 0.0664 64 ALA B CB 7085 N N . GLY B 84 ? 0.9905 0.5585 1.0192 -0.1886 -0.0200 0.0332 65 GLY B N 7086 C CA . GLY B 84 ? 1.0268 0.6102 1.0706 -0.2069 -0.0297 0.0094 65 GLY B CA 7087 C C . GLY B 84 ? 1.2102 0.7559 1.2549 -0.2171 -0.0264 -0.0088 65 GLY B C 7088 O O . GLY B 84 ? 1.2710 0.8216 1.3113 -0.2217 -0.0397 -0.0320 65 GLY B O 7089 N N . LEU B 85 ? 1.3898 0.8946 1.4366 -0.2193 -0.0088 0.0016 66 LEU B N 7090 C CA . LEU B 85 ? 1.4295 0.8922 1.4786 -0.2293 -0.0024 -0.0149 66 LEU B CA 7091 C C . LEU B 85 ? 1.3978 0.8340 1.4208 -0.2097 -0.0020 -0.0175 66 LEU B C 7092 O O . LEU B 85 ? 1.4457 0.8533 1.4636 -0.2151 -0.0015 -0.0378 66 LEU B O 7093 C CB . LEU B 85 ? 1.4455 0.8712 1.5094 -0.2410 0.0194 -0.0018 66 LEU B CB 7094 C CG . LEU B 85 ? 1.3795 0.8246 1.4763 -0.2652 0.0250 -0.0039 66 LEU B CG 7095 C CD1 . LEU B 85 ? 1.5202 0.9309 1.6200 -0.2687 0.0513 0.0213 66 LEU B CD1 7096 C CD2 . LEU B 85 ? 1.2019 0.6456 1.3257 -0.2895 0.0177 -0.0365 66 LEU B CD2 7097 N N . VAL B 86 ? 1.2699 0.7159 1.2790 -0.1869 -0.0017 0.0014 67 VAL B N 7098 C CA . VAL B 86 ? 1.0720 0.5009 1.0637 -0.1673 -0.0003 -0.0017 67 VAL B CA 7099 C C . VAL B 86 ? 1.1950 0.6407 1.1727 -0.1688 -0.0126 -0.0251 67 VAL B C 7100 O O . VAL B 86 ? 1.2705 0.6899 1.2326 -0.1630 -0.0088 -0.0396 67 VAL B O 7101 C CB . VAL B 86 ? 0.9646 0.4092 0.9525 -0.1437 -0.0003 0.0208 67 VAL B CB 7102 C CG1 . VAL B 86 ? 0.8894 0.3223 0.8682 -0.1247 0.0025 0.0149 67 VAL B CG1 7103 C CG2 . VAL B 86 ? 1.0671 0.4888 1.0593 -0.1384 0.0097 0.0445 67 VAL B CG2 7104 N N . TYR B 87 ? 1.1559 0.6428 1.1364 -0.1756 -0.0265 -0.0284 68 TYR B N 7105 C CA . TYR B 87 ? 1.1308 0.6326 1.0934 -0.1767 -0.0405 -0.0494 68 TYR B CA 7106 C C . TYR B 87 ? 1.2560 0.7370 1.2188 -0.1952 -0.0466 -0.0757 68 TYR B C 7107 O O . TYR B 87 ? 1.3122 0.7773 1.2486 -0.1920 -0.0522 -0.0957 68 TYR B O 7108 C CB . TYR B 87 ? 1.0191 0.5694 0.9870 -0.1775 -0.0546 -0.0445 68 TYR B CB 7109 C CG . TYR B 87 ? 1.2497 0.8137 1.1953 -0.1765 -0.0710 -0.0639 68 TYR B CG 7110 C CD1 . TYR B 87 ? 1.3880 0.9481 1.3033 -0.1588 -0.0691 -0.0642 68 TYR B CD1 7111 C CD2 . TYR B 87 ? 1.2877 0.8676 1.2427 -0.1924 -0.0880 -0.0818 68 TYR B CD2 7112 C CE1 . TYR B 87 ? 1.4041 0.9703 1.2905 -0.1558 -0.0828 -0.0798 68 TYR B CE1 7113 C CE2 . TYR B 87 ? 1.3485 0.9384 1.2777 -0.1885 -0.1062 -0.0990 68 TYR B CE2 7114 C CZ . TYR B 87 ? 1.4215 1.0019 1.3120 -0.1695 -0.1030 -0.0968 68 TYR B CZ 7115 O OH . TYR B 87 ? 1.5088 1.0931 1.3655 -0.1637 -0.1199 -0.1119 68 TYR B OH 7116 N N . ASP B 88 ? 1.2434 0.7228 1.2356 -0.2147 -0.0446 -0.0765 69 ASP B N 7117 C CA . ASP B 88 ? 1.2432 0.7038 1.2455 -0.2351 -0.0503 -0.1032 69 ASP B CA 7118 C C . ASP B 88 ? 1.2170 0.6239 1.2029 -0.2318 -0.0373 -0.1129 69 ASP B C 7119 O O . ASP B 88 ? 1.2943 0.6823 1.2649 -0.2380 -0.0460 -0.1404 69 ASP B O 7120 C CB . ASP B 88 ? 1.3760 0.8440 1.4209 -0.2576 -0.0446 -0.0997 69 ASP B CB 7121 C CG . ASP B 88 ? 1.4621 0.9838 1.5285 -0.2637 -0.0580 -0.0967 69 ASP B CG 7122 O OD1 . ASP B 88 ? 1.4207 0.9708 1.4731 -0.2580 -0.0792 -0.1099 69 ASP B OD1 7123 O OD2 . ASP B 88 ? 1.4525 0.9855 1.5478 -0.2733 -0.0461 -0.0809 69 ASP B OD2 7124 N N . ALA B 89 ? 1.2615 0.6429 1.2492 -0.2206 -0.0175 -0.0908 70 ALA B N 7125 C CA . ALA B 89 ? 1.4290 0.7579 1.4057 -0.2152 -0.0025 -0.0971 70 ALA B CA 7126 C C . ALA B 89 ? 1.4280 0.7470 1.3699 -0.1969 -0.0039 -0.1087 70 ALA B C 7127 O O . ALA B 89 ? 1.5526 0.8300 1.4802 -0.1958 0.0043 -0.1253 70 ALA B O 7128 C CB . ALA B 89 ? 1.5261 0.8318 1.5138 -0.2046 0.0168 -0.0684 70 ALA B CB 7129 N N . TYR B 90 ? 1.3318 0.6863 1.2597 -0.1826 -0.0117 -0.1002 71 TYR B N 7130 C CA . TYR B 90 ? 1.4297 0.7751 1.3242 -0.1655 -0.0091 -0.1098 71 TYR B CA 7131 C C . TYR B 90 ? 1.3992 0.7381 1.2635 -0.1745 -0.0238 -0.1402 71 TYR B C 7132 O O . TYR B 90 ? 1.4057 0.7151 1.2363 -0.1652 -0.0173 -0.1557 71 TYR B O 7133 C CB . TYR B 90 ? 1.4163 0.7997 1.3075 -0.1488 -0.0109 -0.0913 71 TYR B CB 7134 C CG . TYR B 90 ? 1.4580 0.8379 1.3123 -0.1359 -0.0097 -0.1036 71 TYR B CG 7135 C CD1 . TYR B 90 ? 1.6083 0.9549 1.4483 -0.1212 0.0096 -0.1078 71 TYR B CD1 7136 C CD2 . TYR B 90 ? 1.4914 0.8987 1.3242 -0.1376 -0.0260 -0.1106 71 TYR B CD2 7137 C CE1 . TYR B 90 ? 1.7359 1.0749 1.5391 -0.1096 0.0156 -0.1183 71 TYR B CE1 7138 C CE2 . TYR B 90 ? 1.5667 0.9642 1.3588 -0.1249 -0.0222 -0.1199 71 TYR B CE2 7139 C CZ . TYR B 90 ? 1.6999 1.0625 1.4764 -0.1115 0.0001 -0.1236 71 TYR B CZ 7140 O OH . TYR B 90 ? 1.7501 1.0990 1.4836 -0.0990 0.0087 -0.1321 71 TYR B OH 7141 N N . LEU B 91 ? 1.3818 0.7483 1.2580 -0.1916 -0.0440 -0.1493 72 LEU B N 7142 C CA . LEU B 91 ? 1.5210 0.8887 1.3695 -0.1985 -0.0650 -0.1781 72 LEU B CA 7143 C C . LEU B 91 ? 1.6863 1.0062 1.5200 -0.2079 -0.0633 -0.2068 72 LEU B C 7144 O O . LEU B 91 ? 1.5782 0.8700 1.4379 -0.2176 -0.0490 -0.2060 72 LEU B O 7145 C CB . LEU B 91 ? 1.5173 0.9284 1.3944 -0.2149 -0.0878 -0.1818 72 LEU B CB 7146 C CG . LEU B 91 ? 1.5603 1.0005 1.4080 -0.2081 -0.1124 -0.1924 72 LEU B CG 7147 C CD1 . LEU B 91 ? 1.2939 0.7458 1.1149 -0.1850 -0.1027 -0.1707 72 LEU B CD1 7148 C CD2 . LEU B 91 ? 1.6397 1.1258 1.5273 -0.2236 -0.1332 -0.1947 72 LEU B CD2 7149 N N . ALA B 92 ? 1.7415 1.0492 1.5297 -0.2039 -0.0776 -0.2322 73 ALA B N 7150 C CA . ALA B 92 ? 1.6940 0.9563 1.4603 -0.2122 -0.0798 -0.2643 73 ALA B CA 7151 C C . ALA B 92 ? 1.6297 0.8984 1.4396 -0.2400 -0.0958 -0.2828 73 ALA B C 7152 O O . ALA B 92 ? 1.5199 0.8331 1.3659 -0.2510 -0.1110 -0.2760 73 ALA B O 7153 C CB . ALA B 92 ? 1.7652 1.0164 1.4662 -0.2003 -0.0954 -0.2866 73 ALA B CB 7154 N N . PRO B 93 ? 1.8309 1.0557 1.6419 -0.2516 -0.0905 -0.3070 74 PRO B N 7155 C CA . PRO B 93 ? 2.0373 1.2148 1.8155 -0.2371 -0.0706 -0.3158 74 PRO B CA 7156 C C . PRO B 93 ? 2.1590 1.3156 1.9646 -0.2292 -0.0380 -0.2879 74 PRO B C 7157 O O . PRO B 93 ? 2.2175 1.3401 1.9994 -0.2124 -0.0180 -0.2874 74 PRO B O 7158 C CB . PRO B 93 ? 2.0098 1.1776 1.8053 -0.2514 -0.0839 -0.3499 74 PRO B CB 7159 C CG . PRO B 93 ? 1.8721 1.0730 1.7359 -0.2741 -0.0937 -0.3454 74 PRO B CG 7160 C CD . PRO B 93 ? 1.8019 1.0456 1.6672 -0.2748 -0.1046 -0.3263 74 PRO B CD 7161 N N . ASN B 94 ? 2.1098 1.2886 1.9651 -0.2395 -0.0333 -0.2643 75 ASN B N 7162 C CA . ASN B 94 ? 1.9143 1.0762 1.7983 -0.2314 -0.0074 -0.2367 75 ASN B CA 7163 C C . ASN B 94 ? 1.7525 0.9220 1.6257 -0.2121 0.0065 -0.2063 75 ASN B C 7164 O O . ASN B 94 ? 1.7066 0.8976 1.6099 -0.2130 0.0109 -0.1793 75 ASN B O 7165 C CB . ASN B 94 ? 1.7945 0.9719 1.7321 -0.2505 -0.0085 -0.2254 75 ASN B CB 7166 C CG . ASN B 94 ? 1.6503 0.8740 1.6063 -0.2667 -0.0277 -0.2258 75 ASN B CG 7167 O OD1 . ASN B 94 ? 1.5777 0.8244 1.5069 -0.2602 -0.0385 -0.2239 75 ASN B OD1 7168 N ND2 . ASN B 94 ? 1.6511 0.8893 1.6517 -0.2868 -0.0325 -0.2266 75 ASN B ND2 7169 N N . ASN B 95 ? 1.8065 0.9656 1.6409 -0.1918 0.0130 -0.2097 76 ASN B N 7170 C CA . ASN B 95 ? 1.7912 0.9745 1.6257 -0.1691 0.0231 -0.1819 76 ASN B CA 7171 C C . ASN B 95 ? 1.6848 0.8545 1.5519 -0.1588 0.0425 -0.1554 76 ASN B C 7172 O O . ASN B 95 ? 1.6728 0.8029 1.5391 -0.1487 0.0603 -0.1584 76 ASN B O 7173 C CB . ASN B 95 ? 1.9422 1.1108 1.7330 -0.1501 0.0319 -0.1930 76 ASN B CB 7174 C CG . ASN B 95 ? 2.1056 1.2916 1.8557 -0.1540 0.0112 -0.2122 76 ASN B CG 7175 O OD1 . ASN B 95 ? 2.1975 1.3593 1.9211 -0.1650 -0.0001 -0.2415 76 ASN B OD1 7176 N ND2 . ASN B 95 ? 2.0583 1.2846 1.8022 -0.1442 0.0051 -0.1962 76 ASN B ND2 7177 N N . LEU B 96 ? 1.5645 0.7694 1.4591 -0.1593 0.0377 -0.1291 77 LEU B N 7178 C CA . LEU B 96 ? 1.4074 0.6016 1.3280 -0.1477 0.0515 -0.1019 77 LEU B CA 7179 C C . LEU B 96 ? 1.3539 0.5836 1.2796 -0.1255 0.0516 -0.0790 77 LEU B C 7180 O O . LEU B 96 ? 1.3066 0.5802 1.2286 -0.1268 0.0385 -0.0747 77 LEU B O 7181 C CB . LEU B 96 ? 1.3017 0.4983 1.2479 -0.1660 0.0487 -0.0895 77 LEU B CB 7182 C CG . LEU B 96 ? 1.5100 0.6713 1.4720 -0.1732 0.0579 -0.0924 77 LEU B CG 7183 C CD1 . LEU B 96 ? 1.5497 0.6934 1.5011 -0.1873 0.0524 -0.1269 77 LEU B CD1 7184 C CD2 . LEU B 96 ? 1.5957 0.7671 1.5830 -0.1873 0.0578 -0.0739 77 LEU B CD2 7185 N N . LYS B 97 ? 1.3372 0.5476 1.2747 -0.1049 0.0656 -0.0654 78 LYS B N 7186 C CA . LYS B 97 ? 1.2880 0.5300 1.2375 -0.0829 0.0657 -0.0472 78 LYS B CA 7187 C C . LYS B 97 ? 1.3828 0.6304 1.3561 -0.0733 0.0634 -0.0187 78 LYS B C 7188 O O . LYS B 97 ? 1.6137 0.8228 1.5940 -0.0718 0.0717 -0.0116 78 LYS B O 7189 C CB . LYS B 97 ? 1.2801 0.5014 1.2283 -0.0629 0.0824 -0.0563 78 LYS B CB 7190 N N . PRO B 98 ? 1.3871 0.6794 1.3694 -0.0658 0.0521 -0.0024 79 PRO B N 7191 C CA . PRO B 98 ? 1.4169 0.7154 1.4147 -0.0534 0.0473 0.0241 79 PRO B CA 7192 C C . PRO B 98 ? 1.5034 0.7835 1.5189 -0.0263 0.0546 0.0321 79 PRO B C 7193 O O . PRO B 98 ? 1.4099 0.6989 1.4346 -0.0141 0.0606 0.0212 79 PRO B O 7194 C CB . PRO B 98 ? 1.2502 0.6029 1.2509 -0.0522 0.0328 0.0324 79 PRO B CB 7195 C CG . PRO B 98 ? 1.2745 0.6456 1.2686 -0.0530 0.0347 0.0132 79 PRO B CG 7196 C CD . PRO B 98 ? 1.3439 0.6804 1.3187 -0.0680 0.0429 -0.0085 79 PRO B CD 7197 N N . VAL B 99 ? 1.5604 0.8133 1.5810 -0.0163 0.0553 0.0510 80 VAL B N 7198 C CA . VAL B 99 ? 1.4885 0.7220 1.5282 0.0117 0.0597 0.0592 80 VAL B CA 7199 C C . VAL B 99 ? 1.5065 0.7500 1.5526 0.0310 0.0454 0.0863 80 VAL B C 7200 O O . VAL B 99 ? 1.5688 0.8244 1.6381 0.0571 0.0390 0.0922 80 VAL B O 7201 C CB . VAL B 99 ? 1.4525 0.6302 1.4878 0.0117 0.0750 0.0528 80 VAL B CB 7202 C CG1 . VAL B 99 ? 1.5132 0.6837 1.5710 0.0413 0.0784 0.0539 80 VAL B CG1 7203 C CG2 . VAL B 99 ? 1.3543 0.5202 1.3744 -0.0112 0.0849 0.0251 80 VAL B CG2 7204 N N . VAL B 100 ? 1.4454 0.6833 1.4710 0.0190 0.0404 0.1019 81 VAL B N 7205 C CA . VAL B 100 ? 1.4376 0.6758 1.4569 0.0377 0.0277 0.1286 81 VAL B CA 7206 C C . VAL B 100 ? 1.2438 0.5149 1.2455 0.0234 0.0173 0.1381 81 VAL B C 7207 O O . VAL B 100 ? 1.2003 0.4706 1.1901 -0.0036 0.0250 0.1315 81 VAL B O 7208 C CB . VAL B 100 ? 1.4182 0.5946 1.4227 0.0455 0.0378 0.1454 81 VAL B CB 7209 C CG1 . VAL B 100 ? 1.2974 0.4686 1.2811 0.0626 0.0250 0.1745 81 VAL B CG1 7210 C CG2 . VAL B 100 ? 1.4066 0.5634 1.4289 0.0655 0.0415 0.1366 81 VAL B CG2 7211 N N . ALA B 101 ? 1.2274 0.5278 1.2296 0.0420 -0.0007 0.1518 82 ALA B N 7212 C CA . ALA B 101 ? 1.3674 0.6990 1.3522 0.0313 -0.0103 0.1602 82 ALA B CA 7213 C C . ALA B 101 ? 1.3589 0.6724 1.3174 0.0491 -0.0196 0.1870 82 ALA B C 7214 O O . ALA B 101 ? 1.4130 0.7097 1.3741 0.0771 -0.0291 0.1978 82 ALA B O 7215 C CB . ALA B 101 ? 1.3499 0.7400 1.3546 0.0331 -0.0240 0.1475 82 ALA B CB 7216 N N . GLU B 102 ? 1.2918 0.6082 1.2240 0.0338 -0.0167 0.1973 83 GLU B N 7217 C CA . GLU B 102 ? 1.2714 0.5707 1.1688 0.0498 -0.0241 0.2228 83 GLU B CA 7218 C C . GLU B 102 ? 1.3564 0.7057 1.2548 0.0637 -0.0486 0.2225 83 GLU B C 7219 O O . GLU B 102 ? 1.2684 0.6542 1.1661 0.0466 -0.0496 0.2154 83 GLU B O 7220 C CB . GLU B 102 ? 1.2081 0.4847 1.0767 0.0263 -0.0050 0.2337 83 GLU B CB 7221 C CG . GLU B 102 ? 1.3444 0.5708 1.2142 0.0082 0.0206 0.2329 83 GLU B CG 7222 C CD . GLU B 102 ? 1.4048 0.6113 1.2528 -0.0150 0.0412 0.2439 83 GLU B CD 7223 O OE1 . GLU B 102 ? 1.3349 0.5451 1.1520 -0.0073 0.0380 0.2619 83 GLU B OE1 7224 O OE2 . GLU B 102 ? 1.4798 0.6768 1.3468 -0.0414 0.0589 0.2314 83 GLU B OE2 7225 N N . PHE B 103 ? 1.4197 0.7711 1.3226 0.0950 -0.0691 0.2290 84 PHE B N 7226 C CA . PHE B 103 ? 1.4203 0.8159 1.3246 0.1093 -0.0945 0.2279 84 PHE B CA 7227 C C . PHE B 103 ? 1.4359 0.8111 1.2861 0.1170 -0.0999 0.2504 84 PHE B C 7228 O O . PHE B 103 ? 1.3752 0.6968 1.1894 0.1267 -0.0914 0.2713 84 PHE B O 7229 C CB . PHE B 103 ? 1.4257 0.8373 1.3640 0.1395 -0.1169 0.2221 84 PHE B CB 7230 C CG . PHE B 103 ? 1.3311 0.7045 1.2425 0.1720 -0.1322 0.2434 84 PHE B CG 7231 C CD1 . PHE B 103 ? 1.3053 0.6921 1.1919 0.1934 -0.1596 0.2531 84 PHE B CD1 7232 C CD2 . PHE B 103 ? 1.3970 0.7193 1.3058 0.1828 -0.1205 0.2532 84 PHE B CD2 7233 C CE1 . PHE B 103 ? 1.3728 0.7256 1.2300 0.2253 -0.1754 0.2723 84 PHE B CE1 7234 C CE2 . PHE B 103 ? 1.4605 0.7503 1.3441 0.2142 -0.1337 0.2731 84 PHE B CE2 7235 C CZ . PHE B 103 ? 1.4953 0.8083 1.3551 0.2341 -0.1591 0.2815 84 PHE B CZ 7236 N N . TYR B 104 ? 1.5153 0.9296 1.3570 0.1129 -0.1118 0.2465 85 TYR B N 7237 C CA . TYR B 104 ? 1.5628 0.9596 1.3492 0.1213 -0.1167 0.2658 85 TYR B CA 7238 C C . TYR B 104 ? 1.6725 1.1004 1.4577 0.1484 -0.1517 0.2629 85 TYR B C 7239 O O . TYR B 104 ? 1.7273 1.1994 1.5619 0.1526 -0.1679 0.2433 85 TYR B O 7240 C CB . TYR B 104 ? 1.5681 0.9800 1.3410 0.0914 -0.0977 0.2632 85 TYR B CB 7241 C CG . TYR B 104 ? 1.6515 1.0443 1.4385 0.0620 -0.0670 0.2594 85 TYR B CG 7242 C CD1 . TYR B 104 ? 1.6028 1.0300 1.4116 0.0332 -0.0555 0.2438 85 TYR B CD1 7243 C CD2 . TYR B 104 ? 1.8405 1.1801 1.6201 0.0637 -0.0511 0.2704 85 TYR B CD2 7244 C CE1 . TYR B 104 ? 1.6284 1.0404 1.4528 0.0069 -0.0316 0.2375 85 TYR B CE1 7245 C CE2 . TYR B 104 ? 1.8608 1.1830 1.6562 0.0359 -0.0248 0.2639 85 TYR B CE2 7246 C CZ . TYR B 104 ? 1.7104 1.0702 1.5288 0.0075 -0.0165 0.2466 85 TYR B CZ 7247 O OH . TYR B 104 ? 1.5653 0.9097 1.4018 -0.0195 0.0057 0.2376 85 TYR B OH 7248 N N . GLY B 105 ? 1.7291 1.1322 1.4575 0.1667 -0.1629 0.2817 86 GLY B N 7249 C CA . GLY B 105 ? 1.7616 1.1906 1.4835 0.1938 -0.1997 0.2778 86 GLY B CA 7250 C C . GLY B 105 ? 1.8188 1.2518 1.5750 0.2231 -0.2237 0.2739 86 GLY B C 7251 O O . GLY B 105 ? 1.7777 1.1773 1.5372 0.2298 -0.2105 0.2836 86 GLY B O 7252 N N . SER B 106 ? 1.8522 1.3332 1.6419 0.2382 -0.2555 0.2566 87 SER B N 7253 C CA . SER B 106 ? 1.8559 1.3551 1.6880 0.2652 -0.2778 0.2484 87 SER B CA 7254 C C . SER B 106 ? 1.7835 1.2883 1.6828 0.2599 -0.2686 0.2359 87 SER B C 7255 O O . SER B 106 ? 1.6894 1.1971 1.6058 0.2309 -0.2417 0.2289 87 SER B O 7256 C CB . SER B 106 ? 1.7955 1.3487 1.6508 0.2789 -0.3127 0.2297 87 SER B CB 7257 O OG . SER B 106 ? 1.8366 1.3831 1.6277 0.2853 -0.3219 0.2392 87 SER B OG 7258 N N . LYS B 107 ? 1.7842 1.3026 1.7249 0.2838 -0.2834 0.2292 88 LYS B N 7259 C CA . LYS B 107 ? 1.7758 1.3048 1.7858 0.2817 -0.2744 0.2144 88 LYS B CA 7260 C C . LYS B 107 ? 1.7127 1.3024 1.7883 0.2750 -0.2884 0.1880 88 LYS B C 7261 O O . LYS B 107 ? 1.5612 1.1704 1.6835 0.2552 -0.2650 0.1722 88 LYS B O 7262 C CB . LYS B 107 ? 1.1219 0.6410 1.1525 0.3103 -0.2811 0.2180 88 LYS B CB 7263 N N . GLU B 108 ? 1.8357 1.4628 1.9107 0.2862 -0.3170 0.1800 89 GLU B N 7264 C CA . GLU B 108 ? 1.8232 1.5080 1.9585 0.2787 -0.3300 0.1547 89 GLU B CA 7265 C C . GLU B 108 ? 1.7636 1.4598 1.8770 0.2446 -0.3078 0.1509 89 GLU B C 7266 O O . GLU B 108 ? 1.6493 1.3864 1.8114 0.2273 -0.2991 0.1307 89 GLU B O 7267 C CB . GLU B 108 ? 1.8260 1.5478 1.9633 0.2971 -0.3639 0.1443 89 GLU B CB 7268 N N . ASP B 109 ? 1.7387 1.3977 1.7788 0.2352 -0.2964 0.1705 90 ASP B N 7269 C CA . ASP B 109 ? 1.5304 1.1972 1.5478 0.2033 -0.2727 0.1686 90 ASP B CA 7270 C C . ASP B 109 ? 1.5738 1.1928 1.5479 0.1870 -0.2413 0.1866 90 ASP B C 7271 O O . ASP B 109 ? 1.5544 1.1433 1.4673 0.1850 -0.2371 0.2042 90 ASP B O 7272 C CB . ASP B 109 ? 1.4726 1.1516 1.4479 0.2057 -0.2918 0.1702 90 ASP B CB 7273 C CG . ASP B 109 ? 1.5844 1.2787 1.5467 0.1746 -0.2694 0.1652 90 ASP B CG 7274 O OD1 . ASP B 109 ? 1.5363 1.2544 1.5428 0.1544 -0.2509 0.1511 90 ASP B OD1 7275 O OD2 . ASP B 109 ? 1.6492 1.3301 1.5556 0.1717 -0.2697 0.1757 90 ASP B OD2 7276 N N . PRO B 110 ? 1.5606 1.1712 1.5673 0.1750 -0.2180 0.1810 91 PRO B N 7277 C CA . PRO B 110 ? 1.4738 1.0409 1.4487 0.1575 -0.1886 0.1936 91 PRO B CA 7278 C C . PRO B 110 ? 1.6259 1.2089 1.5937 0.1244 -0.1672 0.1863 91 PRO B C 7279 O O . PRO B 110 ? 1.7664 1.3825 1.7730 0.1106 -0.1605 0.1679 91 PRO B O 7280 C CB . PRO B 110 ? 1.3481 0.9042 1.3658 0.1615 -0.1771 0.1857 91 PRO B CB 7281 C CG . PRO B 110 ? 1.3401 0.9473 1.4183 0.1642 -0.1868 0.1632 91 PRO B CG 7282 C CD . PRO B 110 ? 1.4487 1.0880 1.5245 0.1783 -0.2173 0.1615 91 PRO B CD 7283 N N . GLN B 111 ? 1.6458 1.2041 1.5646 0.1126 -0.1558 0.2010 92 GLN B N 7284 C CA . GLN B 111 ? 1.6135 1.1877 1.5284 0.0827 -0.1372 0.1942 92 GLN B CA 7285 C C . GLN B 111 ? 1.4947 1.0462 1.4207 0.0630 -0.1120 0.1906 92 GLN B C 7286 O O . GLN B 111 ? 1.5257 1.0536 1.4270 0.0454 -0.0938 0.1987 92 GLN B O 7287 C CB . GLN B 111 ? 1.7372 1.2978 1.6011 0.0775 -0.1333 0.2093 92 GLN B CB 7288 C CG . GLN B 111 ? 1.7547 1.3033 1.5813 0.1049 -0.1559 0.2230 92 GLN B CG 7289 C CD . GLN B 111 ? 1.5626 1.1583 1.4073 0.1154 -0.1824 0.2085 92 GLN B CD 7290 O OE1 . GLN B 111 ? 1.4659 1.0980 1.3628 0.1137 -0.1897 0.1896 92 GLN B OE1 7291 N NE2 . GLN B 111 ? 1.4958 1.0882 1.2961 0.1262 -0.1953 0.2167 92 GLN B NE2 7292 N N . THR B 112 ? 1.2745 0.8328 1.2392 0.0659 -0.1104 0.1771 93 THR B N 7293 C CA . THR B 112 ? 1.1572 0.6937 1.1317 0.0489 -0.0889 0.1698 93 THR B CA 7294 C C . THR B 112 ? 1.0883 0.6487 1.0644 0.0213 -0.0780 0.1578 93 THR B C 7295 O O . THR B 112 ? 1.0651 0.6050 1.0324 0.0020 -0.0616 0.1562 93 THR B O 7296 C CB . THR B 112 ? 1.1777 0.7185 1.1917 0.0598 -0.0887 0.1561 93 THR B CB 7297 O OG1 . THR B 112 ? 1.2470 0.7777 1.2690 0.0889 -0.1045 0.1650 93 THR B OG1 7298 C CG2 . THR B 112 ? 1.1992 0.7058 1.2142 0.0464 -0.0673 0.1502 93 THR B CG2 7299 N N . PHE B 113 ? 1.0271 0.6308 1.0164 0.0203 -0.0883 0.1485 94 PHE B N 7300 C CA . PHE B 113 ? 0.9497 0.5779 0.9400 -0.0019 -0.0811 0.1380 94 PHE B CA 7301 C C . PHE B 113 ? 1.0238 0.6753 0.9972 -0.0033 -0.0897 0.1445 94 PHE B C 7302 O O . PHE B 113 ? 1.0886 0.7486 1.0571 0.0144 -0.1052 0.1506 94 PHE B O 7303 C CB . PHE B 113 ? 0.7644 0.4197 0.7848 -0.0030 -0.0809 0.1199 94 PHE B CB 7304 C CG . PHE B 113 ? 0.9455 0.5786 0.9818 0.0006 -0.0709 0.1118 94 PHE B CG 7305 C CD1 . PHE B 113 ? 1.0816 0.6985 1.1116 -0.0163 -0.0566 0.1021 94 PHE B CD1 7306 C CD2 . PHE B 113 ? 1.0195 0.6484 1.0782 0.0218 -0.0764 0.1123 94 PHE B CD2 7307 C CE1 . PHE B 113 ? 1.1015 0.6946 1.1418 -0.0125 -0.0459 0.0932 94 PHE B CE1 7308 C CE2 . PHE B 113 ? 1.1102 0.7175 1.1847 0.0259 -0.0644 0.1041 94 PHE B CE2 7309 C CZ . PHE B 113 ? 1.1603 0.7481 1.2229 0.0086 -0.0481 0.0946 94 PHE B CZ 7310 N N . TYR B 114 ? 0.8906 0.5519 0.8554 -0.0234 -0.0807 0.1420 95 TYR B N 7311 C CA . TYR B 114 ? 0.9181 0.6076 0.8734 -0.0257 -0.0869 0.1434 95 TYR B CA 7312 C C . TYR B 114 ? 0.9247 0.6496 0.9015 -0.0358 -0.0878 0.1272 95 TYR B C 7313 O O . TYR B 114 ? 0.9242 0.6487 0.9175 -0.0412 -0.0828 0.1161 95 TYR B O 7314 C CB . TYR B 114 ? 1.0974 0.7718 1.0265 -0.0377 -0.0751 0.1552 95 TYR B CB 7315 C CG . TYR B 114 ? 1.2126 0.8851 1.1520 -0.0614 -0.0598 0.1479 95 TYR B CG 7316 C CD1 . TYR B 114 ? 1.2679 0.9731 1.2188 -0.0751 -0.0592 0.1376 95 TYR B CD1 7317 C CD2 . TYR B 114 ? 1.3385 0.9760 1.2776 -0.0696 -0.0473 0.1503 95 TYR B CD2 7318 C CE1 . TYR B 114 ? 1.3518 1.0583 1.3156 -0.0953 -0.0493 0.1290 95 TYR B CE1 7319 C CE2 . TYR B 114 ? 1.4752 1.1128 1.4276 -0.0919 -0.0362 0.1405 95 TYR B CE2 7320 C CZ . TYR B 114 ? 1.4749 1.1486 1.4403 -0.1043 -0.0386 0.1295 95 TYR B CZ 7321 O OH . TYR B 114 ? 1.5117 1.1883 1.4937 -0.1250 -0.0315 0.1179 95 TYR B OH 7322 N N . TYR B 115 ? 0.9591 0.7111 0.9320 -0.0369 -0.0935 0.1263 96 TYR B N 7323 C CA . TYR B 115 ? 0.8038 0.5869 0.7943 -0.0438 -0.0948 0.1130 96 TYR B CA 7324 C C . TYR B 115 ? 0.8289 0.6265 0.8114 -0.0584 -0.0890 0.1128 96 TYR B C 7325 O O . TYR B 115 ? 0.8291 0.6295 0.7952 -0.0572 -0.0893 0.1210 96 TYR B O 7326 C CB . TYR B 115 ? 0.8388 0.6451 0.8423 -0.0300 -0.1078 0.1083 96 TYR B CB 7327 C CG . TYR B 115 ? 0.9030 0.7045 0.9289 -0.0165 -0.1129 0.1037 96 TYR B CG 7328 C CD1 . TYR B 115 ? 1.1215 0.9098 1.1440 0.0002 -0.1239 0.1114 96 TYR B CD1 7329 C CD2 . TYR B 115 ? 0.8478 0.6570 0.8978 -0.0190 -0.1061 0.0917 96 TYR B CD2 7330 C CE1 . TYR B 115 ? 1.1488 0.9363 1.1996 0.0136 -0.1290 0.1059 96 TYR B CE1 7331 C CE2 . TYR B 115 ? 0.9614 0.7675 1.0373 -0.0070 -0.1072 0.0866 96 TYR B CE2 7332 C CZ . TYR B 115 ? 1.0884 0.8861 1.1687 0.0091 -0.1192 0.0930 96 TYR B CZ 7333 O OH . TYR B 115 ? 1.0582 0.8561 1.1717 0.0220 -0.1206 0.0867 96 TYR B OH 7334 N N . ALA B 116 ? 0.8141 0.6200 0.8073 -0.0711 -0.0838 0.1029 97 ALA B N 7335 C CA . ALA B 116 ? 0.6498 0.4753 0.6440 -0.0832 -0.0809 0.0999 97 ALA B CA 7336 C C . ALA B 116 ? 0.7544 0.6077 0.7547 -0.0763 -0.0881 0.0950 97 ALA B C 7337 O O . ALA B 116 ? 0.7329 0.5914 0.7431 -0.0693 -0.0921 0.0883 97 ALA B O 7338 C CB . ALA B 116 ? 0.6261 0.4506 0.6292 -0.0963 -0.0775 0.0897 97 ALA B CB 7339 N N . VAL B 117 ? 0.7384 0.6076 0.7337 -0.0787 -0.0873 0.0980 98 VAL B N 7340 C CA . VAL B 117 ? 0.5842 0.4747 0.5819 -0.0704 -0.0939 0.0946 98 VAL B CA 7341 C C . VAL B 117 ? 0.6927 0.6043 0.6934 -0.0779 -0.0899 0.0920 98 VAL B C 7342 O O . VAL B 117 ? 0.7243 0.6344 0.7229 -0.0877 -0.0816 0.0958 98 VAL B O 7343 C CB . VAL B 117 ? 0.6288 0.5113 0.6110 -0.0579 -0.1004 0.1020 98 VAL B CB 7344 C CG1 . VAL B 117 ? 0.7588 0.6550 0.7282 -0.0564 -0.1003 0.1034 98 VAL B CG1 7345 C CG2 . VAL B 117 ? 0.4894 0.3743 0.4854 -0.0455 -0.1111 0.0962 98 VAL B CG2 7346 N N . ALA B 118 ? 0.7389 0.6699 0.7483 -0.0735 -0.0944 0.0850 99 ALA B N 7347 C CA . ALA B 118 ? 0.5690 0.5204 0.5831 -0.0774 -0.0912 0.0822 99 ALA B CA 7348 C C . ALA B 118 ? 0.6621 0.6223 0.6680 -0.0690 -0.0936 0.0822 99 ALA B C 7349 O O . ALA B 118 ? 0.8545 0.8209 0.8671 -0.0615 -0.1000 0.0761 99 ALA B O 7350 C CB . ALA B 118 ? 0.4963 0.4592 0.5239 -0.0786 -0.0938 0.0741 99 ALA B CB 7351 N N . VAL B 119 ? 0.6564 0.6155 0.6476 -0.0705 -0.0870 0.0880 100 VAL B N 7352 C CA . VAL B 119 ? 0.6860 0.6490 0.6616 -0.0616 -0.0897 0.0870 100 VAL B CA 7353 C C . VAL B 119 ? 0.6452 0.6288 0.6299 -0.0633 -0.0839 0.0809 100 VAL B C 7354 O O . VAL B 119 ? 0.7060 0.6981 0.7001 -0.0717 -0.0733 0.0823 100 VAL B O 7355 C CB . VAL B 119 ? 0.6983 0.6417 0.6419 -0.0587 -0.0845 0.0977 100 VAL B CB 7356 C CG1 . VAL B 119 ? 0.8597 0.8037 0.7805 -0.0469 -0.0916 0.0944 100 VAL B CG1 7357 C CG2 . VAL B 119 ? 0.5907 0.5111 0.5258 -0.0557 -0.0897 0.1050 100 VAL B CG2 7358 N N . VAL B 120 ? 0.5736 0.5655 0.5596 -0.0552 -0.0909 0.0729 101 VAL B N 7359 C CA . VAL B 120 ? 0.7163 0.7252 0.7113 -0.0546 -0.0858 0.0662 101 VAL B CA 7360 C C . VAL B 120 ? 0.7386 0.7461 0.7152 -0.0458 -0.0895 0.0605 101 VAL B C 7361 O O . VAL B 120 ? 0.6508 0.6478 0.6138 -0.0391 -0.1009 0.0592 101 VAL B O 7362 C CB . VAL B 120 ? 0.6898 0.7086 0.7098 -0.0540 -0.0899 0.0592 101 VAL B CB 7363 C CG1 . VAL B 120 ? 0.5519 0.5742 0.5856 -0.0614 -0.0872 0.0623 101 VAL B CG1 7364 C CG2 . VAL B 120 ? 0.7483 0.7588 0.7729 -0.0488 -0.0996 0.0551 101 VAL B CG2 7365 N N . LYS B 121 ? 0.6129 0.6313 0.5901 -0.0449 -0.0812 0.0556 102 LYS B N 7366 C CA . LYS B 121 ? 0.5980 0.6144 0.5576 -0.0366 -0.0849 0.0468 102 LYS B CA 7367 C C . LYS B 121 ? 0.6148 0.6369 0.5960 -0.0325 -0.0962 0.0349 102 LYS B C 7368 O O . LYS B 121 ? 0.4866 0.5161 0.4946 -0.0356 -0.0940 0.0339 102 LYS B O 7369 C CB . LYS B 121 ? 0.5577 0.5818 0.5114 -0.0368 -0.0691 0.0447 102 LYS B CB 7370 C CG . LYS B 121 ? 0.7816 0.7956 0.7096 -0.0401 -0.0544 0.0554 102 LYS B CG 7371 C CD . LYS B 121 ? 0.8286 0.8474 0.7469 -0.0383 -0.0367 0.0517 102 LYS B CD 7372 C CE . LYS B 121 ? 0.9171 0.9196 0.8034 -0.0410 -0.0182 0.0629 102 LYS B CE 7373 N NZ . LYS B 121 ? 0.9957 0.9703 0.8314 -0.0325 -0.0280 0.0675 102 LYS B NZ 7374 N N . LYS B 122 ? 0.6544 0.6710 0.6234 -0.0254 -0.1082 0.0255 103 LYS B N 7375 C CA . LYS B 122 ? 0.6257 0.6468 0.6206 -0.0231 -0.1179 0.0124 103 LYS B CA 7376 C C . LYS B 122 ? 0.7562 0.7854 0.7708 -0.0243 -0.1077 0.0053 103 LYS B C 7377 O O . LYS B 122 ? 0.7406 0.7724 0.7424 -0.0226 -0.0990 0.0030 103 LYS B O 7378 C CB . LYS B 122 ? 0.5367 0.5531 0.5171 -0.0152 -0.1349 0.0005 103 LYS B CB 7379 C CG . LYS B 122 ? 0.7579 0.7808 0.7702 -0.0143 -0.1427 -0.0173 103 LYS B CG 7380 C CD . LYS B 122 ? 0.9443 0.9663 0.9560 -0.0074 -0.1657 -0.0297 103 LYS B CD 7381 C CE . LYS B 122 ? 1.0264 1.0481 1.0548 -0.0071 -0.1740 -0.0223 103 LYS B CE 7382 N NZ . LYS B 122 ? 1.0239 1.0478 1.0572 0.0018 -0.1992 -0.0347 103 LYS B NZ 7383 N N . ASP B 123 ? 0.8396 0.8702 0.8842 -0.0265 -0.1069 0.0026 104 ASP B N 7384 C CA . ASP B 123 ? 0.7464 0.7790 0.8095 -0.0260 -0.0975 -0.0027 104 ASP B CA 7385 C C . ASP B 123 ? 0.6217 0.6608 0.6819 -0.0262 -0.0859 0.0060 104 ASP B C 7386 O O . ASP B 123 ? 0.5446 0.5856 0.6126 -0.0227 -0.0786 0.0011 104 ASP B O 7387 C CB . ASP B 123 ? 0.5983 0.6299 0.6624 -0.0222 -0.1004 -0.0194 104 ASP B CB 7388 C CG . ASP B 123 ? 0.7821 0.8110 0.8630 -0.0223 -0.1133 -0.0321 104 ASP B CG 7389 O OD1 . ASP B 123 ? 0.9201 0.9475 1.0222 -0.0255 -0.1141 -0.0284 104 ASP B OD1 7390 O OD2 . ASP B 123 ? 0.7950 0.8238 0.8694 -0.0190 -0.1227 -0.0473 104 ASP B OD2 7391 N N . SER B 124 ? 0.5408 0.5833 0.5935 -0.0301 -0.0846 0.0177 105 SER B N 7392 C CA . SER B 124 ? 0.5958 0.6487 0.6532 -0.0310 -0.0759 0.0240 105 SER B CA 7393 C C . SER B 124 ? 0.6522 0.7058 0.7280 -0.0284 -0.0746 0.0261 105 SER B C 7394 O O . SER B 124 ? 0.5867 0.6510 0.6710 -0.0269 -0.0711 0.0295 105 SER B O 7395 C CB . SER B 124 ? 0.5516 0.6074 0.6001 -0.0375 -0.0748 0.0338 105 SER B CB 7396 O OG . SER B 124 ? 0.8171 0.8636 0.8644 -0.0411 -0.0823 0.0386 105 SER B OG 7397 N N . GLY B 125 ? 0.6370 0.6781 0.7188 -0.0272 -0.0771 0.0242 106 GLY B N 7398 C CA . GLY B 125 ? 0.7251 0.7589 0.8163 -0.0220 -0.0733 0.0260 106 GLY B CA 7399 C C . GLY B 125 ? 0.7557 0.7850 0.8434 -0.0220 -0.0759 0.0352 106 GLY B C 7400 O O . GLY B 125 ? 0.8237 0.8456 0.9119 -0.0150 -0.0738 0.0382 106 GLY B O 7401 N N . PHE B 126 ? 0.6367 0.6675 0.7177 -0.0287 -0.0810 0.0393 107 PHE B N 7402 C CA . PHE B 126 ? 0.4326 0.4575 0.5073 -0.0290 -0.0848 0.0455 107 PHE B CA 7403 C C . PHE B 126 ? 0.6325 0.6452 0.7002 -0.0348 -0.0863 0.0474 107 PHE B C 7404 O O . PHE B 126 ? 0.6746 0.6890 0.7433 -0.0393 -0.0874 0.0457 107 PHE B O 7405 C CB . PHE B 126 ? 0.5268 0.5698 0.6058 -0.0310 -0.0900 0.0475 107 PHE B CB 7406 C CG . PHE B 126 ? 0.6152 0.6676 0.6948 -0.0408 -0.0900 0.0482 107 PHE B CG 7407 C CD1 . PHE B 126 ? 0.7306 0.7769 0.8045 -0.0480 -0.0941 0.0513 107 PHE B CD1 7408 C CD2 . PHE B 126 ? 0.4870 0.5504 0.5696 -0.0421 -0.0841 0.0460 107 PHE B CD2 7409 C CE1 . PHE B 126 ? 0.8510 0.9008 0.9239 -0.0565 -0.0918 0.0535 107 PHE B CE1 7410 C CE2 . PHE B 126 ? 0.5706 0.6365 0.6477 -0.0500 -0.0811 0.0488 107 PHE B CE2 7411 C CZ . PHE B 126 ? 0.8095 0.8683 0.8827 -0.0573 -0.0847 0.0532 107 PHE B CZ 7412 N N . GLN B 127 ? 0.7194 0.7176 0.7772 -0.0329 -0.0865 0.0508 108 GLN B N 7413 C CA . GLN B 127 ? 0.6654 0.6500 0.7166 -0.0374 -0.0858 0.0520 108 GLN B CA 7414 C C . GLN B 127 ? 0.6940 0.6791 0.7346 -0.0416 -0.0932 0.0544 108 GLN B C 7415 O O . GLN B 127 ? 0.6656 0.6637 0.7076 -0.0412 -0.0999 0.0543 108 GLN B O 7416 C CB . GLN B 127 ? 0.5439 0.5057 0.5900 -0.0326 -0.0759 0.0524 108 GLN B CB 7417 C CG . GLN B 127 ? 0.5243 0.4847 0.5879 -0.0307 -0.0675 0.0477 108 GLN B CG 7418 C CD . GLN B 127 ? 0.7621 0.7310 0.8429 -0.0358 -0.0704 0.0421 108 GLN B CD 7419 O OE1 . GLN B 127 ? 0.9147 0.8832 0.9926 -0.0395 -0.0747 0.0436 108 GLN B OE1 7420 N NE2 . GLN B 127 ? 0.7202 0.6956 0.8184 -0.0351 -0.0693 0.0346 108 GLN B NE2 7421 N N . MET B 128 ? 0.6685 0.6398 0.7022 -0.0455 -0.0920 0.0549 109 MET B N 7422 C CA . MET B 128 ? 0.6744 0.6426 0.6990 -0.0511 -0.0985 0.0549 109 MET B CA 7423 C C . MET B 128 ? 0.7343 0.6997 0.7450 -0.0466 -0.1059 0.0536 109 MET B C 7424 O O . MET B 128 ? 0.7641 0.7392 0.7771 -0.0516 -0.1158 0.0508 109 MET B O 7425 C CB . MET B 128 ? 0.6927 0.6405 0.7100 -0.0532 -0.0935 0.0547 109 MET B CB 7426 C CG . MET B 128 ? 0.5949 0.5384 0.6065 -0.0610 -0.0991 0.0536 109 MET B CG 7427 S SD . MET B 128 ? 0.9067 0.8599 0.9325 -0.0690 -0.0995 0.0569 109 MET B SD 7428 C CE . MET B 128 ? 1.3659 1.3195 1.3904 -0.0797 -0.1057 0.0541 109 MET B CE 7429 N N . ASN B 129 ? 0.5104 0.4612 0.5069 -0.0366 -0.1016 0.0554 110 ASN B N 7430 C CA . ASN B 129 ? 0.6883 0.6325 0.6645 -0.0284 -0.1109 0.0552 110 ASN B CA 7431 C C . ASN B 129 ? 0.7331 0.6992 0.7231 -0.0223 -0.1191 0.0553 110 ASN B C 7432 O O . ASN B 129 ? 0.7859 0.7474 0.7606 -0.0117 -0.1286 0.0557 110 ASN B O 7433 C CB . ASN B 129 ? 0.7247 0.6354 0.6706 -0.0186 -0.1005 0.0589 110 ASN B CB 7434 C CG . ASN B 129 ? 0.8081 0.7125 0.7627 -0.0133 -0.0855 0.0631 110 ASN B CG 7435 O OD1 . ASN B 129 ? 0.8688 0.7929 0.8514 -0.0177 -0.0834 0.0615 110 ASN B OD1 7436 N ND2 . ASN B 129 ? 0.8775 0.7512 0.8063 -0.0038 -0.0737 0.0678 110 ASN B ND2 7437 N N . GLN B 130 ? 0.7438 0.7322 0.7607 -0.0276 -0.1155 0.0546 111 GLN B N 7438 C CA . GLN B 130 ? 0.7605 0.7711 0.7950 -0.0221 -0.1202 0.0536 111 GLN B CA 7439 C C . GLN B 130 ? 0.7096 0.7482 0.7698 -0.0327 -0.1241 0.0497 111 GLN B C 7440 O O . GLN B 130 ? 0.7069 0.7652 0.7871 -0.0318 -0.1206 0.0486 111 GLN B O 7441 C CB . GLN B 130 ? 0.5689 0.5771 0.6103 -0.0170 -0.1082 0.0554 111 GLN B CB 7442 C CG . GLN B 130 ? 0.5089 0.4880 0.5305 -0.0074 -0.0996 0.0596 111 GLN B CG 7443 C CD . GLN B 130 ? 0.6598 0.6365 0.6946 -0.0059 -0.0869 0.0585 111 GLN B CD 7444 O OE1 . GLN B 130 ? 0.6544 0.6325 0.6998 -0.0140 -0.0806 0.0551 111 GLN B OE1 7445 N NE2 . GLN B 130 ? 0.5753 0.5480 0.6105 0.0051 -0.0845 0.0603 111 GLN B NE2 7446 N N . LEU B 131 ? 0.6161 0.6540 0.6756 -0.0430 -0.1286 0.0474 112 LEU B N 7447 C CA . LEU B 131 ? 0.5749 0.6343 0.6588 -0.0548 -0.1282 0.0446 112 LEU B CA 7448 C C . LEU B 131 ? 0.5398 0.6252 0.6485 -0.0533 -0.1394 0.0384 112 LEU B C 7449 O O . LEU B 131 ? 0.7090 0.8169 0.8462 -0.0613 -0.1344 0.0359 112 LEU B O 7450 C CB . LEU B 131 ? 0.5839 0.6307 0.6613 -0.0667 -0.1280 0.0438 112 LEU B CB 7451 C CG . LEU B 131 ? 0.6186 0.6475 0.6833 -0.0697 -0.1167 0.0494 112 LEU B CG 7452 C CD1 . LEU B 131 ? 0.5948 0.6100 0.6548 -0.0799 -0.1170 0.0488 112 LEU B CD1 7453 C CD2 . LEU B 131 ? 0.5779 0.6186 0.6527 -0.0713 -0.1069 0.0528 112 LEU B CD2 7454 N N . ARG B 132 ? 0.5939 0.6755 0.6920 -0.0421 -0.1541 0.0358 113 ARG B N 7455 C CA . ARG B 132 ? 0.7552 0.8636 0.8801 -0.0384 -0.1698 0.0281 113 ARG B CA 7456 C C . ARG B 132 ? 0.7262 0.8601 0.8815 -0.0334 -0.1623 0.0287 113 ARG B C 7457 O O . ARG B 132 ? 0.7231 0.8471 0.8660 -0.0229 -0.1539 0.0345 113 ARG B O 7458 C CB . ARG B 132 ? 0.6559 0.7510 0.7550 -0.0228 -0.1894 0.0264 113 ARG B CB 7459 C CG . ARG B 132 ? 0.7129 0.8380 0.8420 -0.0167 -0.2114 0.0165 113 ARG B CG 7460 C CD . ARG B 132 ? 0.8822 0.9897 0.9765 0.0018 -0.2341 0.0153 113 ARG B CD 7461 N NE . ARG B 132 ? 1.0453 1.1332 1.1116 -0.0042 -0.2457 0.0089 113 ARG B NE 7462 C CZ . ARG B 132 ? 1.1109 1.1577 1.1238 0.0011 -0.2403 0.0151 113 ARG B CZ 7463 N NH1 . ARG B 132 ? 0.9962 1.0182 0.9816 0.0114 -0.2233 0.0280 113 ARG B NH1 7464 N NH2 . ARG B 132 ? 1.1356 1.1653 1.1244 -0.0044 -0.2503 0.0072 113 ARG B NH2 7465 N N . GLY B 133 ? 0.5944 0.7598 0.7917 -0.0416 -0.1632 0.0215 114 GLY B N 7466 C CA . GLY B 133 ? 0.6876 0.8787 0.9176 -0.0372 -0.1538 0.0204 114 GLY B CA 7467 C C . GLY B 133 ? 0.7232 0.9116 0.9530 -0.0466 -0.1286 0.0254 114 GLY B C 7468 O O . GLY B 133 ? 0.7871 0.9933 1.0395 -0.0438 -0.1167 0.0242 114 GLY B O 7469 N N . LYS B 134 ? 0.6447 0.8094 0.8469 -0.0563 -0.1209 0.0307 115 LYS B N 7470 C CA . LYS B 134 ? 0.5123 0.6708 0.7070 -0.0636 -0.1005 0.0356 115 LYS B CA 7471 C C . LYS B 134 ? 0.5789 0.7478 0.7954 -0.0801 -0.0905 0.0342 115 LYS B C 7472 O O . LYS B 134 ? 0.6826 0.8635 0.9227 -0.0872 -0.1004 0.0280 115 LYS B O 7473 C CB . LYS B 134 ? 0.4888 0.6164 0.6446 -0.0631 -0.0987 0.0421 115 LYS B CB 7474 C CG . LYS B 134 ? 0.6202 0.7339 0.7574 -0.0492 -0.1049 0.0433 115 LYS B CG 7475 C CD . LYS B 134 ? 0.6787 0.7949 0.8160 -0.0417 -0.0942 0.0431 115 LYS B CD 7476 C CE . LYS B 134 ? 0.7632 0.8724 0.8961 -0.0272 -0.0995 0.0429 115 LYS B CE 7477 N NZ . LYS B 134 ? 0.7954 0.8797 0.9045 -0.0243 -0.1062 0.0463 115 LYS B NZ 7478 N N . LYS B 135 ? 0.7046 0.8670 0.9121 -0.0858 -0.0707 0.0394 116 LYS B N 7479 C CA . LYS B 135 ? 0.7695 0.9359 0.9940 -0.1012 -0.0552 0.0404 116 LYS B CA 7480 C C . LYS B 135 ? 0.7417 0.8768 0.9322 -0.1087 -0.0505 0.0489 116 LYS B C 7481 O O . LYS B 135 ? 0.8774 0.9923 1.0322 -0.1016 -0.0491 0.0551 116 LYS B O 7482 C CB . LYS B 135 ? 0.8313 1.0102 1.0682 -0.1012 -0.0323 0.0410 116 LYS B CB 7483 C CG . LYS B 135 ? 0.7794 0.9903 1.0549 -0.0924 -0.0350 0.0323 116 LYS B CG 7484 C CD . LYS B 135 ? 0.8641 1.0835 1.1476 -0.0914 -0.0088 0.0325 116 LYS B CD 7485 C CE . LYS B 135 ? 0.9298 1.1762 1.2454 -0.0781 -0.0119 0.0244 116 LYS B CE 7486 N NZ . LYS B 135 ? 0.9827 1.2634 1.3562 -0.0802 -0.0242 0.0149 116 LYS B NZ 7487 N N . SER B 136 ? 0.6604 0.7918 0.8650 -0.1226 -0.0488 0.0481 117 SER B N 7488 C CA . SER B 136 ? 0.7938 0.8937 0.9685 -0.1282 -0.0475 0.0556 117 SER B CA 7489 C C . SER B 136 ? 0.7930 0.8787 0.9660 -0.1406 -0.0244 0.0632 117 SER B C 7490 O O . SER B 136 ? 0.8914 0.9938 1.0984 -0.1509 -0.0098 0.0598 117 SER B O 7491 C CB . SER B 136 ? 0.8138 0.9095 0.9960 -0.1328 -0.0654 0.0487 117 SER B CB 7492 O OG . SER B 136 ? 0.8636 0.9767 1.0867 -0.1467 -0.0639 0.0400 117 SER B OG 7493 N N . CYS B 137 ? 0.6710 0.7244 0.8053 -0.1388 -0.0207 0.0738 118 CYS B N 7494 C CA . CYS B 137 ? 0.6839 0.7137 0.8052 -0.1479 0.0011 0.0842 118 CYS B CA 7495 C C . CYS B 137 ? 0.6719 0.6733 0.7803 -0.1533 -0.0045 0.0883 118 CYS B C 7496 O O . CYS B 137 ? 0.7062 0.6901 0.7852 -0.1428 -0.0175 0.0921 118 CYS B O 7497 C CB . CYS B 137 ? 0.8840 0.8962 0.9618 -0.1365 0.0118 0.0950 118 CYS B CB 7498 S SG . CYS B 137 ? 0.8555 0.8943 0.9405 -0.1285 0.0213 0.0898 118 CYS B SG 7499 N N . HIS B 138 ? 0.7752 0.7720 0.9092 -0.1698 0.0062 0.0863 119 HIS B N 7500 C CA . HIS B 138 ? 0.7674 0.7354 0.8927 -0.1761 0.0026 0.0885 119 HIS B CA 7501 C C . HIS B 138 ? 0.8862 0.8193 0.9937 -0.1837 0.0280 0.1030 119 HIS B C 7502 O O . HIS B 138 ? 0.9078 0.8430 1.0224 -0.1901 0.0515 0.1081 119 HIS B O 7503 C CB . HIS B 138 ? 0.7931 0.7782 0.9611 -0.1895 -0.0085 0.0721 119 HIS B CB 7504 C CG . HIS B 138 ? 0.8087 0.8254 0.9916 -0.1812 -0.0321 0.0588 119 HIS B CG 7505 N ND1 . HIS B 138 ? 0.8036 0.8127 0.9686 -0.1725 -0.0533 0.0538 119 HIS B ND1 7506 C CD2 . HIS B 138 ? 0.7128 0.7657 0.9249 -0.1791 -0.0365 0.0504 119 HIS B CD2 7507 C CE1 . HIS B 138 ? 0.7268 0.7632 0.9047 -0.1652 -0.0695 0.0441 119 HIS B CE1 7508 N NE2 . HIS B 138 ? 0.7212 0.7853 0.9289 -0.1684 -0.0612 0.0418 119 HIS B NE2 7509 N N . THR B 139 ? 0.8700 0.7683 0.9533 -0.1821 0.0251 0.1100 120 THR B N 7510 C CA . THR B 139 ? 0.8506 0.7083 0.9114 -0.1870 0.0486 0.1259 120 THR B CA 7511 C C . THR B 139 ? 0.9495 0.8055 1.0525 -0.2106 0.0679 0.1200 120 THR B C 7512 O O . THR B 139 ? 0.9404 0.7713 1.0364 -0.2187 0.0966 0.1322 120 THR B O 7513 C CB . THR B 139 ? 0.8527 0.6723 0.8781 -0.1764 0.0390 0.1351 120 THR B CB 7514 O OG1 . THR B 139 ? 0.9781 0.8021 1.0273 -0.1823 0.0227 0.1213 120 THR B OG1 7515 C CG2 . THR B 139 ? 0.7698 0.5893 0.7570 -0.1536 0.0229 0.1414 120 THR B CG2 7516 N N . GLY B 140 ? 0.8808 0.7618 1.0269 -0.2213 0.0521 0.1008 121 GLY B N 7517 C CA . GLY B 140 ? 0.8190 0.7047 1.0148 -0.2447 0.0652 0.0899 121 GLY B CA 7518 C C . GLY B 140 ? 0.8712 0.7732 1.0958 -0.2507 0.0385 0.0686 121 GLY B C 7519 O O . GLY B 140 ? 0.8595 0.7488 1.0552 -0.2387 0.0184 0.0677 121 GLY B O 7520 N N . LEU B 141 ? 0.9468 0.8769 1.2286 -0.2686 0.0383 0.0504 122 LEU B N 7521 C CA . LEU B 141 ? 0.9443 0.8892 1.2526 -0.2749 0.0113 0.0276 122 LEU B CA 7522 C C . LEU B 141 ? 0.9672 0.8682 1.2549 -0.2799 0.0109 0.0276 122 LEU B C 7523 O O . LEU B 141 ? 0.8716 0.7395 1.1613 -0.2922 0.0362 0.0367 122 LEU B O 7524 C CB . LEU B 141 ? 0.9427 0.9236 1.3220 -0.2950 0.0129 0.0074 122 LEU B CB 7525 C CG . LEU B 141 ? 0.9737 0.9671 1.3856 -0.3052 -0.0143 -0.0195 122 LEU B CG 7526 C CD1 . LEU B 141 ? 1.0181 1.0283 1.4022 -0.2852 -0.0503 -0.0278 122 LEU B CD1 7527 C CD2 . LEU B 141 ? 1.0309 1.0634 1.5212 -0.3253 -0.0113 -0.0395 122 LEU B CD2 7528 N N . GLY B 142 ? 1.0640 0.9617 1.3297 -0.2695 -0.0156 0.0182 123 GLY B N 7529 C CA . GLY B 142 ? 1.0936 0.9517 1.3418 -0.2730 -0.0179 0.0146 123 GLY B CA 7530 C C . GLY B 142 ? 1.0145 0.8317 1.2112 -0.2577 -0.0078 0.0366 123 GLY B C 7531 O O . GLY B 142 ? 0.9721 0.7561 1.1507 -0.2562 -0.0107 0.0345 123 GLY B O 7532 N N . ARG B 143 ? 0.8736 0.6928 1.0474 -0.2454 0.0032 0.0564 124 ARG B N 7533 C CA . ARG B 143 ? 0.9119 0.6967 1.0387 -0.2281 0.0082 0.0761 124 ARG B CA 7534 C C . ARG B 143 ? 0.9380 0.7294 1.0407 -0.2095 -0.0152 0.0718 124 ARG B C 7535 O O . ARG B 143 ? 0.7847 0.6082 0.8982 -0.2068 -0.0326 0.0585 124 ARG B O 7536 C CB . ARG B 143 ? 1.0284 0.8108 1.1349 -0.2205 0.0256 0.0968 124 ARG B CB 7537 C CG . ARG B 143 ? 1.1832 0.9392 1.2992 -0.2363 0.0563 0.1070 124 ARG B CG 7538 C CD . ARG B 143 ? 1.4034 1.1569 1.4954 -0.2290 0.0755 0.1260 124 ARG B CD 7539 N NE . ARG B 143 ? 1.5466 1.2706 1.5827 -0.2063 0.0720 0.1451 124 ARG B NE 7540 C CZ . ARG B 143 ? 1.6112 1.3097 1.6100 -0.1982 0.0911 0.1656 124 ARG B CZ 7541 N NH1 . ARG B 143 ? 1.6701 1.3667 1.6812 -0.2122 0.1198 0.1706 124 ARG B NH1 7542 N NH2 . ARG B 143 ? 1.6054 1.2796 1.5548 -0.1756 0.0816 0.1803 124 ARG B NH2 7543 N N . SER B 144 ? 1.0386 0.7978 1.1101 -0.1961 -0.0144 0.0831 125 SER B N 7544 C CA . SER B 144 ? 1.0543 0.8138 1.1091 -0.1808 -0.0316 0.0776 125 SER B CA 7545 C C . SER B 144 ? 1.0211 0.8106 1.0657 -0.1655 -0.0427 0.0806 125 SER B C 7546 O O . SER B 144 ? 0.9639 0.7785 1.0160 -0.1639 -0.0561 0.0681 125 SER B O 7547 C CB . SER B 144 ? 1.1795 0.8978 1.2115 -0.1702 -0.0263 0.0884 125 SER B CB 7548 O OG . SER B 144 ? 1.3543 1.0735 1.3752 -0.1555 -0.0392 0.0828 125 SER B OG 7549 N N . ALA B 145 ? 0.9192 0.7036 0.9445 -0.1535 -0.0376 0.0969 126 ALA B N 7550 C CA . ALA B 145 ? 0.7103 0.5194 0.7266 -0.1389 -0.0476 0.0989 126 ALA B CA 7551 C C . ALA B 145 ? 0.7271 0.5709 0.7586 -0.1451 -0.0473 0.0944 126 ALA B C 7552 O O . ALA B 145 ? 0.7696 0.6382 0.8030 -0.1372 -0.0580 0.0889 126 ALA B O 7553 C CB . ALA B 145 ? 0.7243 0.5166 0.7150 -0.1237 -0.0455 0.1149 126 ALA B CB 7554 N N . GLY B 146 ? 0.7206 0.5651 0.7658 -0.1591 -0.0331 0.0967 127 GLY B N 7555 C CA . GLY B 146 ? 0.6894 0.5667 0.7541 -0.1647 -0.0297 0.0926 127 GLY B CA 7556 C C . GLY B 146 ? 0.6966 0.6014 0.7965 -0.1758 -0.0394 0.0746 127 GLY B C 7557 O O . GLY B 146 ? 0.7435 0.6803 0.8618 -0.1760 -0.0419 0.0693 127 GLY B O 7558 N N . TRP B 147 ? 0.7676 0.6595 0.8761 -0.1839 -0.0462 0.0642 128 TRP B N 7559 C CA . TRP B 147 ? 0.8027 0.7188 0.9419 -0.1936 -0.0593 0.0451 128 TRP B CA 7560 C C . TRP B 147 ? 0.7599 0.6659 0.8860 -0.1889 -0.0777 0.0327 128 TRP B C 7561 O O . TRP B 147 ? 0.7784 0.7024 0.8986 -0.1791 -0.0935 0.0257 128 TRP B O 7562 C CB . TRP B 147 ? 0.7602 0.6775 0.9369 -0.2151 -0.0471 0.0383 128 TRP B CB 7563 C CG . TRP B 147 ? 0.8047 0.7525 1.0182 -0.2239 -0.0645 0.0165 128 TRP B CG 7564 C CD1 . TRP B 147 ? 1.0223 0.9626 1.2443 -0.2317 -0.0795 -0.0012 128 TRP B CD1 7565 C CD2 . TRP B 147 ? 0.8385 0.8292 1.0842 -0.2238 -0.0714 0.0089 128 TRP B CD2 7566 N NE1 . TRP B 147 ? 1.1158 1.0922 1.3721 -0.2359 -0.0979 -0.0197 128 TRP B NE1 7567 C CE2 . TRP B 147 ? 0.9753 0.9840 1.2490 -0.2307 -0.0931 -0.0133 128 TRP B CE2 7568 C CE3 . TRP B 147 ? 0.7652 0.7799 1.0182 -0.2173 -0.0618 0.0178 128 TRP B CE3 7569 C CZ2 . TRP B 147 ? 0.8634 0.9149 1.1751 -0.2303 -0.1071 -0.0260 128 TRP B CZ2 7570 C CZ3 . TRP B 147 ? 0.6886 0.7447 0.9803 -0.2177 -0.0725 0.0054 128 TRP B CZ3 7571 C CH2 . TRP B 147 ? 0.7399 0.8149 1.0619 -0.2236 -0.0957 -0.0158 128 TRP B CH2 7572 N N . ASN B 148 ? 0.8007 0.6745 0.9199 -0.1955 -0.0737 0.0303 129 ASN B N 7573 C CA . ASN B 148 ? 0.7541 0.6138 0.8595 -0.1928 -0.0882 0.0164 129 ASN B CA 7574 C C . ASN B 148 ? 0.8412 0.7000 0.9155 -0.1733 -0.0971 0.0194 129 ASN B C 7575 O O . ASN B 148 ? 0.9844 0.8521 1.0506 -0.1684 -0.1122 0.0075 129 ASN B O 7576 C CB . ASN B 148 ? 0.8104 0.6300 0.9093 -0.2003 -0.0782 0.0161 129 ASN B CB 7577 C CG . ASN B 148 ? 0.8124 0.6283 0.9450 -0.2222 -0.0687 0.0092 129 ASN B CG 7578 O OD1 . ASN B 148 ? 0.6794 0.5263 0.8450 -0.2330 -0.0735 -0.0007 129 ASN B OD1 7579 N ND2 . ASN B 148 ? 0.8740 0.6516 1.0021 -0.2288 -0.0542 0.0140 129 ASN B ND2 7580 N N . ILE B 149 ? 0.6725 0.5193 0.7296 -0.1619 -0.0877 0.0351 130 ILE B N 7581 C CA . ILE B 149 ? 0.6317 0.4770 0.6669 -0.1450 -0.0925 0.0376 130 ILE B CA 7582 C C . ILE B 149 ? 0.7856 0.6612 0.8219 -0.1375 -0.1018 0.0356 130 ILE B C 7583 O O . ILE B 149 ? 0.8775 0.7518 0.8993 -0.1304 -0.1103 0.0279 130 ILE B O 7584 C CB . ILE B 149 ? 0.6906 0.5207 0.7151 -0.1342 -0.0831 0.0526 130 ILE B CB 7585 C CG1 . ILE B 149 ? 0.7423 0.5374 0.7620 -0.1374 -0.0751 0.0545 130 ILE B CG1 7586 C CG2 . ILE B 149 ? 0.7555 0.5894 0.7680 -0.1188 -0.0868 0.0530 130 ILE B CG2 7587 C CD1 . ILE B 149 ? 0.6094 0.3899 0.6218 -0.1274 -0.0678 0.0706 130 ILE B CD1 7588 N N . PRO B 150 ? 0.7227 0.6220 0.7730 -0.1383 -0.0987 0.0427 131 PRO B N 7589 C CA . PRO B 150 ? 0.7339 0.6590 0.7856 -0.1300 -0.1069 0.0406 131 PRO B CA 7590 C C . PRO B 150 ? 0.7469 0.6877 0.8088 -0.1341 -0.1211 0.0267 131 PRO B C 7591 O O . PRO B 150 ? 0.7811 0.7266 0.8292 -0.1234 -0.1306 0.0231 131 PRO B O 7592 C CB . PRO B 150 ? 0.6266 0.5705 0.6915 -0.1310 -0.0985 0.0498 131 PRO B CB 7593 C CG . PRO B 150 ? 0.5763 0.5093 0.6520 -0.1442 -0.0875 0.0533 131 PRO B CG 7594 C CD . PRO B 150 ? 0.6858 0.5862 0.7464 -0.1447 -0.0861 0.0535 131 PRO B CD 7595 N N . ILE B 151 ? 0.5840 0.5317 0.6700 -0.1488 -0.1227 0.0187 132 ILE B N 7596 C CA . ILE B 151 ? 0.6372 0.6025 0.7375 -0.1523 -0.1406 0.0026 132 ILE B CA 7597 C C . ILE B 151 ? 0.7368 0.6780 0.8076 -0.1476 -0.1529 -0.0080 132 ILE B C 7598 O O . ILE B 151 ? 0.7659 0.7148 0.8255 -0.1395 -0.1704 -0.0174 132 ILE B O 7599 C CB . ILE B 151 ? 0.6470 0.6269 0.7888 -0.1712 -0.1389 -0.0063 132 ILE B CB 7600 C CG1 . ILE B 151 ? 0.6315 0.6340 0.8000 -0.1750 -0.1234 0.0040 132 ILE B CG1 7601 C CG2 . ILE B 151 ? 0.6497 0.6504 0.8101 -0.1735 -0.1625 -0.0261 132 ILE B CG2 7602 C CD1 . ILE B 151 ? 0.6322 0.6619 0.8019 -0.1612 -0.1299 0.0069 132 ILE B CD1 7603 N N . GLY B 152 ? 0.8273 0.7367 0.8821 -0.1511 -0.1431 -0.0063 133 GLY B N 7604 C CA . GLY B 152 ? 0.8142 0.6958 0.8370 -0.1461 -0.1501 -0.0161 133 GLY B CA 7605 C C . GLY B 152 ? 0.7929 0.6679 0.7824 -0.1277 -0.1506 -0.0102 133 GLY B C 7606 O O . GLY B 152 ? 0.8635 0.7281 0.8251 -0.1199 -0.1623 -0.0196 133 GLY B O 7607 N N . LEU B 153 ? 0.7273 0.6064 0.7185 -0.1205 -0.1375 0.0050 134 LEU B N 7608 C CA . LEU B 153 ? 0.7276 0.6004 0.6946 -0.1049 -0.1340 0.0109 134 LEU B CA 7609 C C . LEU B 153 ? 0.8004 0.6941 0.7645 -0.0971 -0.1467 0.0090 134 LEU B C 7610 O O . LEU B 153 ? 0.7704 0.6520 0.7066 -0.0843 -0.1468 0.0103 134 LEU B O 7611 C CB . LEU B 153 ? 0.7187 0.5932 0.6952 -0.1005 -0.1190 0.0246 134 LEU B CB 7612 C CG . LEU B 153 ? 0.7849 0.6321 0.7478 -0.0944 -0.1063 0.0275 134 LEU B CG 7613 C CD1 . LEU B 153 ? 0.6563 0.4752 0.5954 -0.0954 -0.1073 0.0165 134 LEU B CD1 7614 C CD2 . LEU B 153 ? 0.8358 0.6809 0.8167 -0.0978 -0.0981 0.0358 134 LEU B CD2 7615 N N . LEU B 154 ? 0.8604 0.7836 0.8543 -0.1042 -0.1559 0.0061 135 LEU B N 7616 C CA . LEU B 154 ? 0.8826 0.8291 0.8810 -0.0958 -0.1690 0.0043 135 LEU B CA 7617 C C . LEU B 154 ? 0.9849 0.9351 0.9785 -0.0960 -0.1919 -0.0114 135 LEU B C 7618 O O . LEU B 154 ? 1.0616 1.0289 1.0560 -0.0862 -0.2069 -0.0142 135 LEU B O 7619 C CB . LEU B 154 ? 0.7334 0.7132 0.7716 -0.1018 -0.1649 0.0091 135 LEU B CB 7620 C CG . LEU B 154 ? 0.8817 0.8660 0.9219 -0.0958 -0.1496 0.0228 135 LEU B CG 7621 C CD1 . LEU B 154 ? 0.7806 0.7928 0.8556 -0.1036 -0.1438 0.0254 135 LEU B CD1 7622 C CD2 . LEU B 154 ? 0.9704 0.9528 0.9911 -0.0795 -0.1528 0.0262 135 LEU B CD2 7623 N N . TYR B 155 ? 0.9466 0.8800 0.9351 -0.1061 -0.1959 -0.0226 136 TYR B N 7624 C CA . TYR B 155 ? 0.9520 0.8934 0.9466 -0.1106 -0.2202 -0.0417 136 TYR B CA 7625 C C . TYR B 155 ? 1.0671 1.0079 1.0298 -0.0926 -0.2426 -0.0475 136 TYR B C 7626 O O . TYR B 155 ? 1.0889 1.0568 1.0747 -0.0921 -0.2658 -0.0592 136 TYR B O 7627 C CB . TYR B 155 ? 0.8314 0.7443 0.8133 -0.1216 -0.2199 -0.0537 136 TYR B CB 7628 C CG . TYR B 155 ? 0.9347 0.8598 0.9347 -0.1308 -0.2452 -0.0767 136 TYR B CG 7629 C CD1 . TYR B 155 ? 0.8285 0.7815 0.8869 -0.1498 -0.2460 -0.0844 136 TYR B CD1 7630 C CD2 . TYR B 155 ? 1.0740 0.9820 1.0329 -0.1203 -0.2681 -0.0916 136 TYR B CD2 7631 C CE1 . TYR B 155 ? 0.8139 0.7814 0.8979 -0.1596 -0.2700 -0.1081 136 TYR B CE1 7632 C CE2 . TYR B 155 ? 1.0379 0.9588 1.0153 -0.1282 -0.2955 -0.1156 136 TYR B CE2 7633 C CZ . TYR B 155 ? 0.8941 0.8470 0.9386 -0.1487 -0.2969 -0.1247 136 TYR B CZ 7634 O OH . TYR B 155 ? 0.9022 0.8711 0.9738 -0.1580 -0.3248 -0.1512 136 TYR B OH 7635 N N . CYS B 156 ? 1.1044 1.0138 1.0153 -0.0770 -0.2352 -0.0392 137 CYS B N 7636 C CA . CYS B 156 ? 1.1144 1.0127 0.9826 -0.0576 -0.2537 -0.0422 137 CYS B CA 7637 C C . CYS B 156 ? 1.1641 1.0898 1.0494 -0.0456 -0.2596 -0.0329 137 CYS B C 7638 O O . CYS B 156 ? 1.2186 1.1527 1.0927 -0.0326 -0.2847 -0.0396 137 CYS B O 7639 C CB . CYS B 156 ? 1.1589 1.0098 0.9645 -0.0451 -0.2382 -0.0352 137 CYS B CB 7640 S SG . CYS B 156 ? 2.1100 1.9224 1.8824 -0.0534 -0.2364 -0.0504 137 CYS B SG 7641 N N . ASP B 157 ? 1.0979 1.0362 1.0092 -0.0487 -0.2377 -0.0182 138 ASP B N 7642 C CA . ASP B 157 ? 1.0437 1.0056 0.9727 -0.0379 -0.2394 -0.0095 138 ASP B CA 7643 C C . ASP B 157 ? 0.9197 0.9265 0.9030 -0.0446 -0.2571 -0.0195 138 ASP B C 7644 O O . ASP B 157 ? 0.9452 0.9740 0.9452 -0.0336 -0.2645 -0.0163 138 ASP B O 7645 C CB . ASP B 157 ? 1.0512 1.0131 0.9930 -0.0404 -0.2117 0.0060 138 ASP B CB 7646 C CG . ASP B 157 ? 1.1412 1.0637 1.0419 -0.0349 -0.1921 0.0146 138 ASP B CG 7647 O OD1 . ASP B 157 ? 1.1617 1.0537 1.0171 -0.0261 -0.1971 0.0112 138 ASP B OD1 7648 O OD2 . ASP B 157 ? 1.1087 1.0308 1.0230 -0.0389 -0.1715 0.0238 138 ASP B OD2 7649 N N . LEU B 158 ? 0.7958 0.8153 0.8100 -0.0629 -0.2620 -0.0321 139 LEU B N 7650 C CA . LEU B 158 ? 0.8714 0.9341 0.9453 -0.0725 -0.2751 -0.0436 139 LEU B CA 7651 C C . LEU B 158 ? 1.0457 1.1240 1.1185 -0.0578 -0.3096 -0.0567 139 LEU B C 7652 O O . LEU B 158 ? 1.2039 1.2537 1.2240 -0.0445 -0.3260 -0.0609 139 LEU B O 7653 C CB . LEU B 158 ? 0.8620 0.9275 0.9662 -0.0962 -0.2707 -0.0549 139 LEU B CB 7654 C CG . LEU B 158 ? 0.7298 0.8035 0.8683 -0.1131 -0.2417 -0.0448 139 LEU B CG 7655 C CD1 . LEU B 158 ? 0.8376 0.8955 0.9492 -0.1039 -0.2194 -0.0246 139 LEU B CD1 7656 C CD2 . LEU B 158 ? 0.7192 0.7724 0.8600 -0.1317 -0.2334 -0.0512 139 LEU B CD2 7657 N N . PRO B 159 ? 1.0866 1.2090 1.2163 -0.0585 -0.3206 -0.0634 140 PRO B N 7658 C CA . PRO B 159 ? 1.1826 1.3248 1.3186 -0.0423 -0.3571 -0.0770 140 PRO B CA 7659 C C . PRO B 159 ? 1.3149 1.4680 1.4715 -0.0538 -0.3846 -0.1024 140 PRO B C 7660 O O . PRO B 159 ? 1.2777 1.4546 1.4921 -0.0772 -0.3769 -0.1129 140 PRO B O 7661 C CB . PRO B 159 ? 0.9733 1.1619 1.1734 -0.0409 -0.3538 -0.0752 140 PRO B CB 7662 C CG . PRO B 159 ? 0.8814 1.0816 1.1236 -0.0657 -0.3218 -0.0711 140 PRO B CG 7663 C CD . PRO B 159 ? 0.9612 1.1160 1.1493 -0.0714 -0.2988 -0.0579 140 PRO B CD 7664 N N . GLU B 160 ? 1.3977 1.5305 1.5052 -0.0372 -0.4156 -0.1124 141 GLU B N 7665 C CA . GLU B 160 ? 1.3768 1.5177 1.4965 -0.0449 -0.4386 -0.1371 141 GLU B CA 7666 C C . GLU B 160 ? 1.2767 1.4731 1.4740 -0.0489 -0.4472 -0.1497 141 GLU B C 7667 O O . GLU B 160 ? 1.2348 1.4550 1.4503 -0.0327 -0.4509 -0.1417 141 GLU B O 7668 C CB . GLU B 160 ? 1.5519 1.6560 1.5919 -0.0216 -0.4607 -0.1407 141 GLU B CB 7669 C CG . GLU B 160 ? 1.7032 1.7483 1.6606 -0.0151 -0.4494 -0.1277 141 GLU B CG 7670 C CD . GLU B 160 ? 1.7790 1.7840 1.6537 0.0087 -0.4664 -0.1304 141 GLU B CD 7671 O OE1 . GLU B 160 ? 1.8207 1.8445 1.7020 0.0208 -0.4902 -0.1418 141 GLU B OE1 7672 O OE2 . GLU B 160 ? 1.7297 1.6826 1.5316 0.0152 -0.4549 -0.1208 141 GLU B OE2 7673 N N . PRO B 161 ? 1.3203 1.5360 1.5649 -0.0705 -0.4494 -0.1696 142 PRO B N 7674 C CA . PRO B 161 ? 1.2912 1.4787 1.5190 -0.0902 -0.4450 -0.1811 142 PRO B CA 7675 C C . PRO B 161 ? 1.1957 1.3717 1.4436 -0.1134 -0.4129 -0.1703 142 PRO B C 7676 O O . PRO B 161 ? 1.0959 1.3026 1.4044 -0.1260 -0.3932 -0.1641 142 PRO B O 7677 C CB . PRO B 161 ? 1.2450 1.4660 1.5314 -0.1041 -0.4577 -0.2053 142 PRO B CB 7678 C CG . PRO B 161 ? 1.2389 1.5101 1.5973 -0.1043 -0.4516 -0.2021 142 PRO B CG 7679 C CD . PRO B 161 ? 1.2767 1.5444 1.5995 -0.0767 -0.4559 -0.1829 142 PRO B CD 7680 N N . ARG B 162 ? 1.1772 1.3065 1.3723 -0.1184 -0.4072 -0.1679 143 ARG B N 7681 C CA . ARG B 162 ? 1.1113 1.2210 1.3110 -0.1362 -0.3698 -0.1524 143 ARG B CA 7682 C C . ARG B 162 ? 1.2224 1.3381 1.4751 -0.1657 -0.3616 -0.1685 143 ARG B C 7683 O O . ARG B 162 ? 1.2114 1.3021 1.4590 -0.1798 -0.3307 -0.1572 143 ARG B O 7684 C CB . ARG B 162 ? 0.9747 1.0303 1.0926 -0.1252 -0.3558 -0.1382 143 ARG B CB 7685 C CG . ARG B 162 ? 0.8724 0.9156 0.9359 -0.0972 -0.3605 -0.1224 143 ARG B CG 7686 C CD . ARG B 162 ? 0.8481 0.8390 0.8395 -0.0889 -0.3416 -0.1094 143 ARG B CD 7687 N NE . ARG B 162 ? 0.9261 0.9002 0.8653 -0.0634 -0.3431 -0.0948 143 ARG B NE 7688 C CZ . ARG B 162 ? 1.4123 1.3616 1.2928 -0.0442 -0.3656 -0.1015 143 ARG B CZ 7689 N NH1 . ARG B 162 ? 1.4260 1.3668 1.2924 -0.0474 -0.3919 -0.1247 143 ARG B NH1 7690 N NH2 . ARG B 162 ? 1.6687 1.5990 1.5023 -0.0215 -0.3615 -0.0852 143 ARG B NH2 7691 N N . LYS B 163 ? 1.2631 1.4101 1.5589 -0.1712 -0.3791 -0.1903 144 LYS B N 7692 C CA . LYS B 163 ? 1.1515 1.3082 1.5021 -0.1984 -0.3656 -0.2047 144 LYS B CA 7693 C C . LYS B 163 ? 1.1883 1.3988 1.6103 -0.2021 -0.3694 -0.2140 144 LYS B C 7694 O O . LYS B 163 ? 1.2789 1.5103 1.6988 -0.1861 -0.3981 -0.2258 144 LYS B O 7695 C CB . LYS B 163 ? 1.0892 1.2164 1.4066 -0.2029 -0.3815 -0.2254 144 LYS B CB 7696 N N . PRO B 164 ? 1.1168 1.3473 1.6007 -0.2222 -0.3395 -0.2081 145 PRO B N 7697 C CA . PRO B 164 ? 1.0982 1.3025 1.5869 -0.2415 -0.3036 -0.1931 145 PRO B CA 7698 C C . PRO B 164 ? 1.1151 1.3053 1.5715 -0.2298 -0.2914 -0.1676 145 PRO B C 7699 O O . PRO B 164 ? 1.0642 1.2769 1.5164 -0.2108 -0.3020 -0.1601 145 PRO B O 7700 C CB . PRO B 164 ? 1.0011 1.2378 1.5662 -0.2612 -0.2785 -0.1951 145 PRO B CB 7701 C CG . PRO B 164 ? 0.9247 1.2092 1.5231 -0.2461 -0.2972 -0.2015 145 PRO B CG 7702 C CD . PRO B 164 ? 1.0118 1.2924 1.5668 -0.2260 -0.3387 -0.2157 145 PRO B CD 7703 N N . LEU B 165 ? 1.1265 1.2765 1.5525 -0.2385 -0.2648 -0.1518 146 LEU B N 7704 C CA . LEU B 165 ? 1.0222 1.1493 1.3929 -0.2222 -0.2446 -0.1232 146 LEU B CA 7705 C C . LEU B 165 ? 0.8933 1.0473 1.2955 -0.2215 -0.2210 -0.1064 146 LEU B C 7706 O O . LEU B 165 ? 0.8158 0.9718 1.1873 -0.2024 -0.2193 -0.0909 146 LEU B O 7707 C CB . LEU B 165 ? 0.9165 0.9941 1.2461 -0.2293 -0.2217 -0.1113 146 LEU B CB 7708 C CG . LEU B 165 ? 0.9092 0.9595 1.1817 -0.2130 -0.2038 -0.0852 146 LEU B CG 7709 C CD1 . LEU B 165 ? 0.8519 0.9040 1.0811 -0.1884 -0.2245 -0.0830 146 LEU B CD1 7710 C CD2 . LEU B 165 ? 0.7820 0.7853 1.0195 -0.2186 -0.1894 -0.0799 146 LEU B CD2 7711 N N . GLU B 166 ? 0.8773 1.0494 1.3402 -0.2425 -0.2011 -0.1103 147 GLU B N 7712 C CA . GLU B 166 ? 0.8389 1.0329 1.3305 -0.2433 -0.1742 -0.0954 147 GLU B CA 7713 C C . GLU B 166 ? 0.8916 1.1280 1.4050 -0.2260 -0.1922 -0.0993 147 GLU B C 7714 O O . GLU B 166 ? 0.9434 1.1826 1.4376 -0.2127 -0.1782 -0.0818 147 GLU B O 7715 C CB . GLU B 166 ? 0.8537 1.0589 1.4106 -0.2700 -0.1484 -0.1016 147 GLU B CB 7716 C CG . GLU B 166 ? 0.8788 1.0372 1.4106 -0.2848 -0.1188 -0.0886 147 GLU B CG 7717 C CD . GLU B 166 ? 1.0456 1.1972 1.6195 -0.3091 -0.1207 -0.1093 147 GLU B CD 7718 O OE1 . GLU B 166 ? 1.0993 1.2338 1.6972 -0.3288 -0.0874 -0.1029 147 GLU B OE1 7719 O OE2 . GLU B 166 ? 1.1686 1.3283 1.7444 -0.3069 -0.1541 -0.1314 147 GLU B OE2 7720 N N . LYS B 167 ? 0.8555 1.1240 1.4092 -0.2252 -0.2244 -0.1232 148 LYS B N 7721 C CA . LYS B 167 ? 0.7705 1.0792 1.3475 -0.2065 -0.2453 -0.1282 148 LYS B CA 7722 C C . LYS B 167 ? 0.8427 1.1292 1.3451 -0.1786 -0.2599 -0.1140 148 LYS B C 7723 O O . LYS B 167 ? 0.9606 1.2659 1.4645 -0.1612 -0.2612 -0.1059 148 LYS B O 7724 C CB . LYS B 167 ? 0.5952 0.9323 1.2043 -0.2045 -0.2717 -0.1522 148 LYS B CB 7725 N N . ALA B 168 ? 0.6997 0.9444 1.1389 -0.1748 -0.2681 -0.1112 149 ALA B N 7726 C CA . ALA B 168 ? 0.6706 0.8889 1.0388 -0.1505 -0.2773 -0.0979 149 ALA B CA 7727 C C . ALA B 168 ? 0.7887 0.9918 1.1304 -0.1453 -0.2455 -0.0727 149 ALA B C 7728 O O . ALA B 168 ? 0.8492 1.0563 1.1710 -0.1261 -0.2477 -0.0626 149 ALA B O 7729 C CB . ALA B 168 ? 0.6819 0.8585 0.9935 -0.1497 -0.2892 -0.1026 149 ALA B CB 7730 N N . VAL B 169 ? 0.7904 0.9742 1.1310 -0.1616 -0.2171 -0.0634 150 VAL B N 7731 C CA . VAL B 169 ? 0.7863 0.9557 1.1030 -0.1577 -0.1890 -0.0418 150 VAL B CA 7732 C C . VAL B 169 ? 0.7295 0.9341 1.0856 -0.1541 -0.1784 -0.0384 150 VAL B C 7733 O O . VAL B 169 ? 0.6465 0.8482 0.9789 -0.1398 -0.1707 -0.0257 150 VAL B O 7734 C CB . VAL B 169 ? 0.7645 0.9075 1.0762 -0.1753 -0.1626 -0.0334 150 VAL B CB 7735 C CG1 . VAL B 169 ? 0.5219 0.6522 0.8086 -0.1693 -0.1377 -0.0128 150 VAL B CG1 7736 C CG2 . VAL B 169 ? 0.8749 0.9812 1.1480 -0.1774 -0.1709 -0.0367 150 VAL B CG2 7737 N N . ALA B 170 ? 0.6821 0.9197 1.1016 -0.1675 -0.1772 -0.0514 151 ALA B N 7738 C CA . ALA B 170 ? 0.7051 0.9786 1.1704 -0.1652 -0.1647 -0.0507 151 ALA B CA 7739 C C . ALA B 170 ? 0.7608 1.0532 1.2200 -0.1408 -0.1859 -0.0515 151 ALA B C 7740 O O . ALA B 170 ? 0.7409 1.0445 1.2051 -0.1316 -0.1709 -0.0426 151 ALA B O 7741 C CB . ALA B 170 ? 0.6868 0.9948 1.2290 -0.1841 -0.1620 -0.0680 151 ALA B CB 7742 N N . ASN B 171 ? 0.7192 1.0110 1.1633 -0.1294 -0.2199 -0.0619 152 ASN B N 7743 C CA . ASN B 171 ? 0.7665 1.0700 1.1991 -0.1041 -0.2417 -0.0616 152 ASN B CA 7744 C C . ASN B 171 ? 0.8594 1.1227 1.2172 -0.0872 -0.2406 -0.0452 152 ASN B C 7745 O O . ASN B 171 ? 0.8251 1.0878 1.1624 -0.0654 -0.2566 -0.0425 152 ASN B O 7746 C CB . ASN B 171 ? 0.7124 1.0379 1.1687 -0.0974 -0.2813 -0.0820 152 ASN B CB 7747 C CG . ASN B 171 ? 0.6643 1.0387 1.2089 -0.1118 -0.2842 -0.1007 152 ASN B CG 7748 O OD1 . ASN B 171 ? 0.6591 1.0582 1.2494 -0.1176 -0.2591 -0.0969 152 ASN B OD1 7749 N ND2 . ASN B 171 ? 0.5447 0.9301 1.1092 -0.1173 -0.3108 -0.1210 152 ASN B ND2 7750 N N . PHE B 172 ? 0.8390 1.0682 1.1588 -0.0969 -0.2209 -0.0344 153 PHE B N 7751 C CA . PHE B 172 ? 0.6825 0.8760 0.9414 -0.0838 -0.2145 -0.0196 153 PHE B CA 7752 C C . PHE B 172 ? 0.6971 0.8902 0.9561 -0.0835 -0.1871 -0.0060 153 PHE B C 7753 O O . PHE B 172 ? 0.7805 0.9611 1.0112 -0.0686 -0.1839 0.0031 153 PHE B O 7754 C CB . PHE B 172 ? 0.5868 0.7435 0.8055 -0.0922 -0.2119 -0.0177 153 PHE B CB 7755 C CG . PHE B 172 ? 0.5947 0.7170 0.7603 -0.0810 -0.2018 -0.0037 153 PHE B CG 7756 C CD1 . PHE B 172 ? 0.5732 0.6755 0.6983 -0.0640 -0.2162 -0.0028 153 PHE B CD1 7757 C CD2 . PHE B 172 ? 0.6206 0.7296 0.7772 -0.0871 -0.1777 0.0080 153 PHE B CD2 7758 C CE1 . PHE B 172 ? 0.6325 0.7037 0.7157 -0.0554 -0.2034 0.0092 153 PHE B CE1 7759 C CE2 . PHE B 172 ? 0.6386 0.7200 0.7557 -0.0777 -0.1695 0.0182 153 PHE B CE2 7760 C CZ . PHE B 172 ? 0.5910 0.6543 0.6748 -0.0629 -0.1807 0.0185 153 PHE B CZ 7761 N N . PHE B 173 ? 0.6411 0.8449 0.9295 -0.1001 -0.1667 -0.0053 154 PHE B N 7762 C CA . PHE B 173 ? 0.7159 0.9204 1.0036 -0.0997 -0.1417 0.0053 154 PHE B CA 7763 C C . PHE B 173 ? 0.7694 1.0123 1.1081 -0.0976 -0.1374 -0.0010 154 PHE B C 7764 O O . PHE B 173 ? 0.9624 1.2330 1.3446 -0.1007 -0.1519 -0.0140 154 PHE B O 7765 C CB . PHE B 173 ? 0.6865 0.8730 0.9662 -0.1163 -0.1192 0.0122 154 PHE B CB 7766 C CG . PHE B 173 ? 0.6705 0.8202 0.9043 -0.1170 -0.1214 0.0188 154 PHE B CG 7767 C CD1 . PHE B 173 ? 0.7485 0.8775 0.9431 -0.1047 -0.1191 0.0280 154 PHE B CD1 7768 C CD2 . PHE B 173 ? 0.7191 0.8548 0.9532 -0.1301 -0.1244 0.0145 154 PHE B CD2 7769 C CE1 . PHE B 173 ? 0.7652 0.8634 0.9251 -0.1049 -0.1198 0.0330 154 PHE B CE1 7770 C CE2 . PHE B 173 ? 0.6669 0.7690 0.8619 -0.1295 -0.1248 0.0201 154 PHE B CE2 7771 C CZ . PHE B 173 ? 0.5865 0.6712 0.7459 -0.1166 -0.1224 0.0294 154 PHE B CZ 7772 N N . SER B 174 ? 0.6919 0.9369 1.0273 -0.0919 -0.1182 0.0064 155 SER B N 7773 C CA . SER B 174 ? 0.7573 1.0369 1.1401 -0.0879 -0.1105 0.0005 155 SER B CA 7774 C C . SER B 174 ? 0.7570 1.0452 1.1663 -0.1045 -0.0802 0.0016 155 SER B C 7775 O O . SER B 174 ? 0.8034 1.1064 1.2312 -0.1006 -0.0615 0.0020 155 SER B O 7776 C CB . SER B 174 ? 0.6697 0.9452 1.0326 -0.0687 -0.1080 0.0060 155 SER B CB 7777 O OG . SER B 174 ? 0.7885 1.0363 1.1097 -0.0703 -0.0890 0.0165 155 SER B OG 7778 N N . GLY B 175 ? 0.6043 0.8799 1.0133 -0.1225 -0.0735 0.0021 156 GLY B N 7779 C CA . GLY B 175 ? 0.5493 0.8235 0.9745 -0.1386 -0.0417 0.0059 156 GLY B CA 7780 C C . GLY B 175 ? 0.5900 0.8223 0.9632 -0.1463 -0.0306 0.0186 156 GLY B C 7781 O O . GLY B 175 ? 0.6967 0.9042 1.0189 -0.1354 -0.0330 0.0281 156 GLY B O 7782 N N . SER B 176 ? 0.5275 0.7516 0.9169 -0.1649 -0.0186 0.0182 157 SER B N 7783 C CA . SER B 176 ? 0.7425 0.9252 1.0851 -0.1711 -0.0109 0.0301 157 SER B CA 7784 C C . SER B 176 ? 0.8877 1.0565 1.2408 -0.1885 0.0215 0.0365 157 SER B C 7785 O O . SER B 176 ? 1.0651 1.2584 1.4730 -0.2011 0.0361 0.0282 157 SER B O 7786 C CB . SER B 176 ? 0.8478 1.0199 1.1845 -0.1742 -0.0365 0.0237 157 SER B CB 7787 O OG . SER B 176 ? 0.9148 1.0932 1.2347 -0.1576 -0.0632 0.0196 157 SER B OG 7788 N N . CYS B 177 ? 0.9188 1.0469 1.2199 -0.1883 0.0333 0.0515 158 CYS B N 7789 C CA . CYS B 177 ? 0.8952 0.9980 1.1946 -0.2038 0.0628 0.0605 158 CYS B CA 7790 C C . CYS B 177 ? 0.8979 0.9725 1.1840 -0.2119 0.0522 0.0619 158 CYS B C 7791 O O . CYS B 177 ? 0.9381 0.9796 1.1718 -0.2027 0.0465 0.0734 158 CYS B O 7792 C CB . CYS B 177 ? 0.8286 0.9007 1.0726 -0.1951 0.0862 0.0782 158 CYS B CB 7793 S SG . CYS B 177 ? 1.0363 1.0627 1.2593 -0.2101 0.1220 0.0943 158 CYS B SG 7794 N N . ALA B 178 ? 0.7813 0.8701 1.1183 -0.2287 0.0486 0.0484 159 ALA B N 7795 C CA . ALA B 178 ? 0.7535 0.8148 1.0827 -0.2383 0.0405 0.0470 159 ALA B CA 7796 C C . ALA B 178 ? 0.7997 0.8425 1.1550 -0.2601 0.0720 0.0501 159 ALA B C 7797 O O . ALA B 178 ? 0.8126 0.8774 1.2287 -0.2779 0.0726 0.0337 159 ALA B O 7798 C CB . ALA B 178 ? 0.7177 0.8040 1.0778 -0.2396 0.0072 0.0266 159 ALA B CB 7799 N N . PRO B 179 ? 0.8781 0.8786 1.1872 -0.2584 0.0982 0.0709 160 PRO B N 7800 C CA . PRO B 179 ? 1.0113 0.9859 1.3376 -0.2781 0.1342 0.0778 160 PRO B CA 7801 C C . PRO B 179 ? 0.9540 0.9154 1.3107 -0.2960 0.1275 0.0665 160 PRO B C 7802 O O . PRO B 179 ? 0.8982 0.8585 1.2430 -0.2897 0.0961 0.0580 160 PRO B O 7803 C CB . PRO B 179 ? 1.1529 1.0767 1.4042 -0.2654 0.1534 0.1041 160 PRO B CB 7804 C CG . PRO B 179 ? 1.0887 1.0102 1.2918 -0.2426 0.1205 0.1070 160 PRO B CG 7805 C CD . PRO B 179 ? 0.9354 0.9082 1.1734 -0.2373 0.0947 0.0888 160 PRO B CD 7806 N N . CYS B 180 ? 0.9929 0.9434 1.3896 -0.3186 0.1591 0.0655 161 CYS B N 7807 C CA . CYS B 180 ? 0.9172 0.8550 1.3529 -0.3398 0.1578 0.0520 161 CYS B CA 7808 C C . CYS B 180 ? 0.9801 0.9683 1.4807 -0.3483 0.1245 0.0209 161 CYS B C 7809 O O . CYS B 180 ? 0.9692 0.9510 1.5010 -0.3643 0.1159 0.0048 161 CYS B O 7810 C CB . CYS B 180 ? 0.7570 0.6419 1.1346 -0.3324 0.1499 0.0641 161 CYS B CB 7811 S SG . CYS B 180 ? 1.8481 1.6661 2.1537 -0.3240 0.1888 0.0999 161 CYS B SG 7812 N N . ALA B 181 ? 0.9923 1.0284 1.5094 -0.3360 0.1046 0.0120 162 ALA B N 7813 C CA . ALA B 181 ? 0.8836 0.9691 1.4595 -0.3402 0.0710 -0.0167 162 ALA B CA 7814 C C . ALA B 181 ? 0.9146 1.0422 1.5665 -0.3540 0.0870 -0.0305 162 ALA B C 7815 O O . ALA B 181 ? 0.9230 1.0441 1.5776 -0.3575 0.1250 -0.0166 162 ALA B O 7816 C CB . ALA B 181 ? 0.6931 0.8028 1.2367 -0.3144 0.0360 -0.0182 162 ALA B CB 7817 N N . ASP B 182 ? 0.9728 1.1403 1.6707 -0.3553 0.0555 -0.0564 163 ASP B N 7818 C CA . ASP B 182 ? 1.0195 1.2268 1.7826 -0.3627 0.0643 -0.0709 163 ASP B CA 7819 C C . ASP B 182 ? 0.8671 1.1198 1.6548 -0.3484 0.0614 -0.0718 163 ASP B C 7820 O O . ASP B 182 ? 0.7773 1.0612 1.5699 -0.3336 0.0238 -0.0836 163 ASP B O 7821 C CB . ASP B 182 ? 1.0825 1.3117 1.8833 -0.3688 0.0303 -0.0988 163 ASP B CB 7822 C CG . ASP B 182 ? 1.1647 1.4202 2.0340 -0.3825 0.0467 -0.1126 163 ASP B CG 7823 O OD1 . ASP B 182 ? 1.1662 1.4406 2.0635 -0.3818 0.0750 -0.1055 163 ASP B OD1 7824 O OD2 . ASP B 182 ? 1.1937 1.4502 2.0898 -0.3939 0.0322 -0.1314 163 ASP B OD2 7825 N N . GLY B 183 ? 0.9262 1.1796 1.7262 -0.3515 0.1021 -0.0593 164 GLY B N 7826 C CA . GLY B 183 ? 1.0237 1.3144 1.8435 -0.3378 0.1063 -0.0582 164 GLY B CA 7827 C C . GLY B 183 ? 1.0574 1.4053 1.9448 -0.3327 0.0817 -0.0824 164 GLY B C 7828 O O . GLY B 183 ? 1.0328 1.4145 1.9331 -0.3162 0.0696 -0.0851 164 GLY B O 7829 N N . THR B 184 ? 1.0730 1.4306 2.0037 -0.3459 0.0739 -0.1002 165 THR B N 7830 C CA . THR B 184 ? 1.0906 1.5007 2.0894 -0.3418 0.0520 -0.1237 165 THR B CA 7831 C C . THR B 184 ? 1.1641 1.5950 2.1553 -0.3274 -0.0045 -0.1402 165 THR B C 7832 O O . THR B 184 ? 1.2374 1.7074 2.2510 -0.3097 -0.0285 -0.1490 165 THR B O 7833 C CB . THR B 184 ? 1.0856 1.4985 2.1400 -0.3625 0.0691 -0.1374 165 THR B CB 7834 O OG1 . THR B 184 ? 1.1456 1.5317 2.1810 -0.3735 0.0499 -0.1451 165 THR B OG1 7835 C CG2 . THR B 184 ? 1.0293 1.4146 2.0836 -0.3755 0.1273 -0.1197 165 THR B CG2 7836 N N . ASP B 185 ? 1.2054 1.6069 2.1613 -0.3335 -0.0246 -0.1439 166 ASP B N 7837 C CA . ASP B 185 ? 1.2737 1.6867 2.2111 -0.3195 -0.0761 -0.1589 166 ASP B CA 7838 C C . ASP B 185 ? 1.1650 1.5744 2.0503 -0.2972 -0.0939 -0.1463 166 ASP B C 7839 O O . ASP B 185 ? 1.0940 1.5283 1.9766 -0.2776 -0.1310 -0.1561 166 ASP B O 7840 C CB . ASP B 185 ? 1.4013 1.7792 2.3114 -0.3323 -0.0890 -0.1665 166 ASP B CB 7841 C CG . ASP B 185 ? 1.4898 1.8791 2.4572 -0.3506 -0.0858 -0.1863 166 ASP B CG 7842 O OD1 . ASP B 185 ? 1.5111 1.9143 2.5296 -0.3620 -0.0526 -0.1849 166 ASP B OD1 7843 O OD2 . ASP B 185 ? 1.5080 1.8914 2.4693 -0.3535 -0.1158 -0.2039 166 ASP B OD2 7844 N N . PHE B 186 ? 1.1430 1.5193 1.9860 -0.2995 -0.0672 -0.1242 167 PHE B N 7845 C CA . PHE B 186 ? 1.0463 1.4157 1.8419 -0.2802 -0.0808 -0.1113 167 PHE B CA 7846 C C . PHE B 186 ? 0.9958 1.3673 1.7934 -0.2779 -0.0442 -0.0927 167 PHE B C 7847 O O . PHE B 186 ? 0.9101 1.2422 1.6612 -0.2820 -0.0179 -0.0726 167 PHE B O 7848 C CB . PHE B 186 ? 0.9773 1.2998 1.7120 -0.2827 -0.0894 -0.1029 167 PHE B CB 7849 C CG . PHE B 186 ? 1.0541 1.3644 1.7838 -0.2901 -0.1142 -0.1205 167 PHE B CG 7850 C CD1 . PHE B 186 ? 1.1026 1.3813 1.8332 -0.3115 -0.0926 -0.1202 167 PHE B CD1 7851 C CD2 . PHE B 186 ? 1.0502 1.3777 1.7705 -0.2745 -0.1581 -0.1371 167 PHE B CD2 7852 C CE1 . PHE B 186 ? 1.1607 1.4274 1.8875 -0.3186 -0.1147 -0.1379 167 PHE B CE1 7853 C CE2 . PHE B 186 ? 1.0951 1.4098 1.8072 -0.2809 -0.1801 -0.1544 167 PHE B CE2 7854 C CZ . PHE B 186 ? 1.1657 1.4513 1.8834 -0.3037 -0.1585 -0.1558 167 PHE B CZ 7855 N N . PRO B 187 ? 1.0223 1.4350 1.8616 -0.2674 -0.0422 -0.0981 168 PRO B N 7856 C CA . PRO B 187 ? 0.9415 1.3592 1.7877 -0.2650 -0.0044 -0.0835 168 PRO B CA 7857 C C . PRO B 187 ? 0.7898 1.1777 1.5553 -0.2450 -0.0055 -0.0627 168 PRO B C 7858 O O . PRO B 187 ? 0.6128 0.9704 1.3370 -0.2463 0.0294 -0.0437 168 PRO B O 7859 C CB . PRO B 187 ? 0.9557 1.4239 1.8578 -0.2521 -0.0149 -0.0977 168 PRO B CB 7860 C CG . PRO B 187 ? 0.9772 1.4623 1.8789 -0.2389 -0.0672 -0.1140 168 PRO B CG 7861 C CD . PRO B 187 ? 0.9961 1.4507 1.8749 -0.2548 -0.0772 -0.1185 168 PRO B CD 7862 N N . GLN B 188 ? 0.7475 1.1389 1.4807 -0.2245 -0.0450 -0.0657 169 GLN B N 7863 C CA . GLN B 188 ? 0.7795 1.1430 1.4353 -0.2032 -0.0480 -0.0476 169 GLN B CA 7864 C C . GLN B 188 ? 0.7313 1.0417 1.3168 -0.2086 -0.0317 -0.0294 169 GLN B C 7865 O O . GLN B 188 ? 0.8174 1.1041 1.3490 -0.1969 -0.0190 -0.0130 169 GLN B O 7866 C CB . GLN B 188 ? 0.8789 1.2498 1.5130 -0.1825 -0.0917 -0.0543 169 GLN B CB 7867 C CG . GLN B 188 ? 0.8617 1.2826 1.5580 -0.1716 -0.1134 -0.0710 169 GLN B CG 7868 C CD . GLN B 188 ? 0.7459 1.1642 1.4039 -0.1460 -0.1511 -0.0715 169 GLN B CD 7869 O OE1 . GLN B 188 ? 0.7363 1.1344 1.3429 -0.1293 -0.1466 -0.0568 169 GLN B OE1 7870 N NE2 . GLN B 188 ? 0.6312 1.0675 1.3121 -0.1428 -0.1883 -0.0888 169 GLN B NE2 7871 N N . LEU B 189 ? 0.7948 1.0866 1.3834 -0.2257 -0.0333 -0.0335 170 LEU B N 7872 C CA . LEU B 189 ? 0.8162 1.0573 1.3433 -0.2302 -0.0197 -0.0172 170 LEU B CA 7873 C C . LEU B 189 ? 0.9018 1.1226 1.4215 -0.2403 0.0241 -0.0018 170 LEU B C 7874 O O . LEU B 189 ? 0.9696 1.1472 1.4392 -0.2428 0.0381 0.0135 170 LEU B O 7875 C CB . LEU B 189 ? 0.8044 1.0299 1.3390 -0.2449 -0.0341 -0.0276 170 LEU B CB 7876 C CG . LEU B 189 ? 0.8108 1.0037 1.2826 -0.2334 -0.0580 -0.0231 170 LEU B CG 7877 C CD1 . LEU B 189 ? 0.4520 0.6609 0.9016 -0.2102 -0.0867 -0.0255 170 LEU B CD1 7878 C CD2 . LEU B 189 ? 0.7975 0.9806 1.2862 -0.2483 -0.0734 -0.0387 170 LEU B CD2 7879 N N . CYS B 190 ? 0.9419 1.1926 1.5102 -0.2445 0.0462 -0.0057 171 CYS B N 7880 C CA . CYS B 190 ? 1.0156 1.2463 1.5738 -0.2525 0.0914 0.0088 171 CYS B CA 7881 C C . CYS B 190 ? 0.8677 1.1179 1.4238 -0.2375 0.1048 0.0125 171 CYS B C 7882 O O . CYS B 190 ? 0.8250 1.0661 1.3806 -0.2427 0.1438 0.0212 171 CYS B O 7883 C CB . CYS B 190 ? 1.0668 1.3088 1.6947 -0.2785 0.1180 -0.0004 171 CYS B CB 7884 S SG . CYS B 190 ? 1.4958 1.7139 2.1347 -0.2990 0.1054 -0.0082 171 CYS B SG 7885 N N . GLN B 191 ? 0.7861 1.0597 1.3383 -0.2184 0.0740 0.0059 172 GLN B N 7886 C CA . GLN B 191 ? 0.7907 1.0846 1.3458 -0.2029 0.0829 0.0065 172 GLN B CA 7887 C C . GLN B 191 ? 0.7985 1.0545 1.2833 -0.1945 0.1088 0.0250 172 GLN B C 7888 O O . GLN B 191 ? 0.8099 1.0740 1.3005 -0.1900 0.1348 0.0266 172 GLN B O 7889 C CB . GLN B 191 ? 0.7530 1.0693 1.3075 -0.1829 0.0433 -0.0019 172 GLN B CB 7890 C CG . GLN B 191 ? 0.7683 1.1052 1.3293 -0.1655 0.0498 -0.0029 172 GLN B CG 7891 C CD . GLN B 191 ? 0.9233 1.2830 1.4941 -0.1468 0.0117 -0.0118 172 GLN B CD 7892 O OE1 . GLN B 191 ? 0.8940 1.2765 1.5035 -0.1489 -0.0156 -0.0244 172 GLN B OE1 7893 N NE2 . GLN B 191 ? 1.0266 1.3773 1.5595 -0.1277 0.0094 -0.0057 172 GLN B NE2 7894 N N . LEU B 192 ? 0.8124 1.0270 1.2314 -0.1917 0.1008 0.0377 173 LEU B N 7895 C CA . LEU B 192 ? 0.7569 0.9339 1.1051 -0.1820 0.1181 0.0539 173 LEU B CA 7896 C C . LEU B 192 ? 0.8052 0.9480 1.1334 -0.1958 0.1547 0.0669 173 LEU B C 7897 O O . LEU B 192 ? 0.9245 1.0370 1.1971 -0.1882 0.1753 0.0799 173 LEU B O 7898 C CB . LEU B 192 ? 0.8175 0.9695 1.1079 -0.1692 0.0888 0.0601 173 LEU B CB 7899 C CG . LEU B 192 ? 0.8602 1.0367 1.1616 -0.1554 0.0549 0.0498 173 LEU B CG 7900 C CD1 . LEU B 192 ? 0.8012 0.9497 1.0476 -0.1447 0.0332 0.0566 173 LEU B CD1 7901 C CD2 . LEU B 192 ? 0.8554 1.0552 1.1695 -0.1429 0.0618 0.0448 173 LEU B CD2 7902 N N . CYS B 193 ? 0.8813 1.0260 1.2521 -0.2155 0.1622 0.0631 174 CYS B N 7903 C CA . CYS B 193 ? 0.9908 1.1022 1.3519 -0.2308 0.2015 0.0753 174 CYS B CA 7904 C C . CYS B 193 ? 1.1154 1.2544 1.5624 -0.2543 0.2166 0.0618 174 CYS B C 7905 O O . CYS B 193 ? 1.0970 1.2327 1.5681 -0.2676 0.2026 0.0558 174 CYS B O 7906 C CB . CYS B 193 ? 1.0307 1.0907 1.3281 -0.2299 0.1956 0.0910 174 CYS B CB 7907 S SG . CYS B 193 ? 1.0012 1.0638 1.3163 -0.2355 0.1547 0.0810 174 CYS B SG 7908 N N . PRO B 194 ? 1.1925 1.3602 1.6898 -0.2596 0.2452 0.0551 175 PRO B N 7909 C CA . PRO B 194 ? 1.1597 1.3630 1.7531 -0.2817 0.2606 0.0388 175 PRO B CA 7910 C C . PRO B 194 ? 1.1364 1.3052 1.7379 -0.3053 0.2863 0.0452 175 PRO B C 7911 O O . PRO B 194 ? 1.1165 1.2390 1.6701 -0.3087 0.3261 0.0647 175 PRO B O 7912 C CB . PRO B 194 ? 1.1722 1.3943 1.7924 -0.2800 0.2998 0.0383 175 PRO B CB 7913 C CG . PRO B 194 ? 1.2178 1.4362 1.7758 -0.2534 0.2842 0.0445 175 PRO B CG 7914 C CD . PRO B 194 ? 1.1946 1.3640 1.6622 -0.2438 0.2643 0.0608 175 PRO B CD 7915 N N . GLY B 195 ? 1.0523 1.2405 1.7107 -0.3206 0.2632 0.0286 176 GLY B N 7916 C CA . GLY B 195 ? 0.9644 1.1202 1.6232 -0.3369 0.2775 0.0309 176 GLY B CA 7917 C C . GLY B 195 ? 0.9181 1.0374 1.5362 -0.3399 0.2547 0.0366 176 GLY B C 7918 O O . GLY B 195 ? 0.8681 0.9785 1.5080 -0.3528 0.2474 0.0277 176 GLY B O 7919 N N . CYS B 196 ? 0.9670 1.0634 1.5116 -0.3204 0.2365 0.0506 177 CYS B N 7920 C CA . CYS B 196 ? 0.9777 1.0344 1.4668 -0.3155 0.2135 0.0587 177 CYS B CA 7921 C C . CYS B 196 ? 1.0726 1.0717 1.5336 -0.3290 0.2492 0.0762 177 CYS B C 7922 O O . CYS B 196 ? 1.1229 1.1083 1.6111 -0.3460 0.2466 0.0689 177 CYS B O 7923 C CB . CYS B 196 ? 0.9354 1.0199 1.4678 -0.3213 0.1717 0.0357 177 CYS B CB 7924 S SG . CYS B 196 ? 1.4694 1.6057 2.0095 -0.2992 0.1241 0.0203 177 CYS B SG 7925 N N . GLY B 197 ? 1.1476 1.1102 1.5510 -0.3205 0.2825 0.0992 178 GLY B N 7926 C CA . GLY B 197 ? 1.3265 1.2275 1.6904 -0.3286 0.3180 0.1200 178 GLY B CA 7927 C C . GLY B 197 ? 1.4436 1.3042 1.7588 -0.3220 0.2938 0.1283 178 GLY B C 7928 O O . GLY B 197 ? 1.4841 1.3431 1.7485 -0.3000 0.2606 0.1321 178 GLY B O 7929 N N . CYS B 198 ? 1.4319 1.2637 1.7596 -0.3360 0.3044 0.1285 179 CYS B N 7930 C CA . CYS B 198 ? 1.4122 1.2021 1.7014 -0.3323 0.2871 0.1360 179 CYS B CA 7931 C C . CYS B 198 ? 1.4881 1.2119 1.6977 -0.3194 0.3122 0.1658 179 CYS B C 7932 O O . CYS B 198 ? 1.5407 1.2240 1.7281 -0.3193 0.3103 0.1728 179 CYS B O 7933 C CB . CYS B 198 ? 1.4411 1.2411 1.7869 -0.3505 0.2745 0.1150 179 CYS B CB 7934 S SG . CYS B 198 ? 1.5522 1.3206 1.8706 -0.3464 0.2416 0.1127 179 CYS B SG 7935 N N . SER B 199 ? 1.4841 1.1968 1.6487 -0.3068 0.3344 0.1824 180 SER B N 7936 C CA . SER B 199 ? 1.5130 1.1642 1.5948 -0.2904 0.3549 0.2103 180 SER B CA 7937 C C . SER B 199 ? 1.4728 1.1145 1.4868 -0.2684 0.3563 0.2257 180 SER B C 7938 O O . SER B 199 ? 1.1881 0.8760 1.2212 -0.2636 0.3372 0.2127 180 SER B O 7939 C CB . SER B 199 ? 1.5504 1.1843 1.6454 -0.3008 0.3940 0.2144 180 SER B CB 7940 O OG . SER B 199 ? 1.5711 1.2396 1.6963 -0.3058 0.4164 0.2070 180 SER B OG 7941 N N . THR B 200 ? 1.6669 1.2551 1.6003 -0.2499 0.3704 0.2496 181 THR B N 7942 C CA . THR B 200 ? 1.6884 1.2612 1.5464 -0.2262 0.3699 0.2638 181 THR B CA 7943 C C . THR B 200 ? 1.4625 1.0641 1.3398 -0.2315 0.3984 0.2573 181 THR B C 7944 O O . THR B 200 ? 1.3169 0.9192 1.1465 -0.2153 0.3972 0.2622 181 THR B O 7945 C CB . THR B 200 ? 1.9419 1.4506 1.7092 -0.2035 0.3752 0.2888 181 THR B CB 7946 O OG1 . THR B 200 ? 2.0177 1.4997 1.7861 -0.2035 0.3588 0.2932 181 THR B OG1 7947 C CG2 . THR B 200 ? 1.9689 1.4625 1.6548 -0.1747 0.3546 0.2998 181 THR B CG2 7948 N N . LEU B 201 ? 1.4717 1.0969 1.4197 -0.2533 0.4233 0.2449 182 LEU B N 7949 C CA . LEU B 201 ? 1.4411 1.0987 1.4216 -0.2595 0.4509 0.2357 182 LEU B CA 7950 C C . LEU B 201 ? 1.4184 1.1308 1.4349 -0.2591 0.4302 0.2197 182 LEU B C 7951 O O . LEU B 201 ? 1.3047 1.0313 1.3069 -0.2511 0.4451 0.2188 182 LEU B O 7952 C CB . LEU B 201 ? 1.3090 0.9878 1.3721 -0.2837 0.4749 0.2214 182 LEU B CB 7953 N N . ASN B 202 ? 1.4302 1.1740 1.4918 -0.2654 0.3931 0.2053 183 ASN B N 7954 C CA . ASN B 202 ? 1.3014 1.1029 1.3878 -0.2541 0.3527 0.1858 183 ASN B CA 7955 C C . ASN B 202 ? 1.3479 1.1304 1.3499 -0.2249 0.3243 0.1958 183 ASN B C 7956 O O . ASN B 202 ? 1.2804 1.0313 1.2384 -0.2146 0.3021 0.2055 183 ASN B O 7957 C CB . ASN B 202 ? 1.2238 1.0642 1.3775 -0.2652 0.3158 0.1652 183 ASN B CB 7958 C CG . ASN B 202 ? 1.2511 1.1410 1.4180 -0.2506 0.2725 0.1485 183 ASN B CG 7959 O OD1 . ASN B 202 ? 1.2007 1.1132 1.3610 -0.2397 0.2754 0.1455 183 ASN B OD1 7960 N ND2 . ASN B 202 ? 1.1759 1.0795 1.3596 -0.2500 0.2341 0.1379 183 ASN B ND2 7961 N N . GLN B 203 ? 1.4282 1.2310 1.4122 -0.2116 0.3248 0.1918 184 GLN B N 7962 C CA . GLN B 203 ? 1.5077 1.2946 1.4156 -0.1849 0.2997 0.1982 184 GLN B CA 7963 C C . GLN B 203 ? 1.3932 1.2013 1.3085 -0.1754 0.2481 0.1881 184 GLN B C 7964 O O . GLN B 203 ? 1.3312 1.1164 1.1864 -0.1557 0.2249 0.1956 184 GLN B O 7965 C CB . GLN B 203 ? 1.6061 1.4174 1.5076 -0.1755 0.3094 0.1902 184 GLN B CB 7966 C CG . GLN B 203 ? 1.5997 1.4765 1.5883 -0.1852 0.2988 0.1670 184 GLN B CG 7967 C CD . GLN B 203 ? 1.4993 1.3993 1.4763 -0.1708 0.2984 0.1580 184 GLN B CD 7968 O OE1 . GLN B 203 ? 1.5794 1.4468 1.4827 -0.1550 0.3079 0.1677 184 GLN B OE1 7969 N NE2 . GLN B 203 ? 1.2268 1.1814 1.2746 -0.1751 0.2860 0.1388 184 GLN B NE2 7970 N N . TYR B 204 ? 1.2833 1.1346 1.2727 -0.1889 0.2309 0.1706 185 TYR B N 7971 C CA . TYR B 204 ? 1.1926 1.0657 1.1928 -0.1809 0.1863 0.1597 185 TYR B CA 7972 C C . TYR B 204 ? 1.2483 1.1073 1.2683 -0.1918 0.1749 0.1598 185 TYR B C 7973 O O . TYR B 204 ? 1.1920 1.0817 1.2554 -0.1967 0.1492 0.1444 185 TYR B O 7974 C CB . TYR B 204 ? 1.0465 0.9771 1.1061 -0.1832 0.1701 0.1389 185 TYR B CB 7975 C CG . TYR B 204 ? 1.0703 1.0177 1.1120 -0.1693 0.1732 0.1355 185 TYR B CG 7976 C CD1 . TYR B 204 ? 1.1184 1.0342 1.0875 -0.1518 0.1751 0.1469 185 TYR B CD1 7977 C CD2 . TYR B 204 ? 0.9963 0.9907 1.0940 -0.1725 0.1723 0.1196 185 TYR B CD2 7978 C CE1 . TYR B 204 ? 1.0886 1.0179 1.0407 -0.1395 0.1776 0.1413 185 TYR B CE1 7979 C CE2 . TYR B 204 ? 0.9838 0.9915 1.0664 -0.1595 0.1763 0.1156 185 TYR B CE2 7980 C CZ . TYR B 204 ? 1.0551 1.0295 1.0645 -0.1438 0.1796 0.1258 185 TYR B CZ 7981 O OH . TYR B 204 ? 1.0194 1.0049 1.0129 -0.1313 0.1836 0.1196 185 TYR B OH 7982 N N . PHE B 205 ? 1.2489 1.0584 1.2335 -0.1945 0.1943 0.1772 186 PHE B N 7983 C CA . PHE B 205 ? 1.2438 1.0339 1.2455 -0.2051 0.1875 0.1775 186 PHE B CA 7984 C C . PHE B 205 ? 1.2260 0.9826 1.1726 -0.1863 0.1634 0.1884 186 PHE B C 7985 O O . PHE B 205 ? 1.3487 1.0734 1.2320 -0.1685 0.1667 0.2045 186 PHE B O 7986 C CB . PHE B 205 ? 1.4024 1.1584 1.4149 -0.2242 0.2287 0.1882 186 PHE B CB 7987 C CG . PHE B 205 ? 1.3376 1.0638 1.3597 -0.2341 0.2250 0.1902 186 PHE B CG 7988 C CD1 . PHE B 205 ? 1.2824 1.0366 1.3745 -0.2545 0.2162 0.1700 186 PHE B CD1 7989 C CD2 . PHE B 205 ? 1.2322 0.9008 1.1923 -0.2218 0.2290 0.2113 186 PHE B CD2 7990 C CE1 . PHE B 205 ? 1.3086 1.0332 1.4083 -0.2637 0.2133 0.1699 186 PHE B CE1 7991 C CE2 . PHE B 205 ? 1.2912 0.9303 1.2608 -0.2299 0.2268 0.2128 186 PHE B CE2 7992 C CZ . PHE B 205 ? 1.3578 1.0243 1.3972 -0.2517 0.2200 0.1915 186 PHE B CZ 7993 N N . GLY B 206 ? 1.0642 0.8274 1.0354 -0.1894 0.1391 0.1787 187 GLY B N 7994 C CA . GLY B 206 ? 1.1761 0.9079 1.1066 -0.1734 0.1193 0.1878 187 GLY B CA 7995 C C . GLY B 206 ? 1.2094 0.9617 1.1175 -0.1521 0.0878 0.1830 187 GLY B C 7996 O O . GLY B 206 ? 1.2492 1.0424 1.1794 -0.1515 0.0780 0.1700 187 GLY B O 7997 N N . TYR B 207 ? 1.1869 0.9107 1.0547 -0.1343 0.0723 0.1928 188 TYR B N 7998 C CA . TYR B 207 ? 1.0837 0.8259 0.9364 -0.1149 0.0426 0.1869 188 TYR B CA 7999 C C . TYR B 207 ? 1.0989 0.8515 0.9225 -0.1045 0.0457 0.1889 188 TYR B C 8000 O O . TYR B 207 ? 1.2309 1.0207 1.0731 -0.1021 0.0325 0.1754 188 TYR B O 8001 C CB . TYR B 207 ? 1.1263 0.8349 0.9447 -0.0970 0.0270 0.1973 188 TYR B CB 8002 C CG . TYR B 207 ? 1.3740 1.0621 1.2127 -0.1051 0.0279 0.1975 188 TYR B CG 8003 C CD1 . TYR B 207 ? 1.3845 1.0966 1.2615 -0.1096 0.0106 0.1812 188 TYR B CD1 8004 C CD2 . TYR B 207 ? 1.5701 1.2104 1.3859 -0.1075 0.0476 0.2142 188 TYR B CD2 8005 C CE1 . TYR B 207 ? 1.4662 1.1571 1.3586 -0.1166 0.0120 0.1797 188 TYR B CE1 8006 C CE2 . TYR B 207 ? 1.6773 1.2961 1.5119 -0.1149 0.0491 0.2132 188 TYR B CE2 8007 C CZ . TYR B 207 ? 1.6099 1.2549 1.4829 -0.1195 0.0308 0.1950 188 TYR B CZ 8008 O OH . TYR B 207 ? 1.6270 1.2481 1.5156 -0.1264 0.0331 0.1923 188 TYR B OH 8009 N N . SER B 208 ? 1.0599 0.7756 0.8341 -0.0978 0.0643 0.2061 189 SER B N 8010 C CA . SER B 208 ? 1.1381 0.8553 0.8735 -0.0863 0.0690 0.2085 189 SER B CA 8011 C C . SER B 208 ? 1.1925 0.9434 0.9641 -0.1017 0.0890 0.1981 189 SER B C 8012 O O . SER B 208 ? 1.3040 1.0766 1.0675 -0.0939 0.0838 0.1901 189 SER B O 8013 C CB . SER B 208 ? 1.1485 0.8111 0.8151 -0.0749 0.0872 0.2308 189 SER B CB 8014 O OG . SER B 208 ? 1.2125 0.8466 0.8869 -0.0917 0.1208 0.2429 189 SER B OG 8015 N N . GLY B 209 ? 0.9953 0.7512 0.8106 -0.1233 0.1112 0.1968 190 GLY B N 8016 C CA . GLY B 209 ? 1.0537 0.8439 0.9129 -0.1381 0.1303 0.1861 190 GLY B CA 8017 C C . GLY B 209 ? 1.0551 0.8968 0.9602 -0.1382 0.1049 0.1657 190 GLY B C 8018 O O . GLY B 209 ? 0.9462 0.8150 0.8619 -0.1360 0.1091 0.1576 190 GLY B O 8019 N N . ALA B 210 ? 0.9971 0.8490 0.9270 -0.1398 0.0801 0.1579 191 ALA B N 8020 C CA . ALA B 210 ? 0.9693 0.8627 0.9354 -0.1381 0.0558 0.1406 191 ALA B CA 8021 C C . ALA B 210 ? 1.0190 0.9200 0.9546 -0.1192 0.0397 0.1384 191 ALA B C 8022 O O . ALA B 210 ? 0.8685 0.8015 0.8263 -0.1173 0.0332 0.1268 191 ALA B O 8023 C CB . ALA B 210 ? 0.7531 0.6461 0.7388 -0.1413 0.0353 0.1347 191 ALA B CB 8024 N N . PHE B 211 ? 1.0213 0.8920 0.9075 -0.1048 0.0323 0.1487 192 PHE B N 8025 C CA . PHE B 211 ? 1.0005 0.8770 0.8591 -0.0874 0.0149 0.1443 192 PHE B CA 8026 C C . PHE B 211 ? 1.0088 0.8917 0.8502 -0.0845 0.0316 0.1430 192 PHE B C 8027 O O . PHE B 211 ? 1.0311 0.9354 0.8758 -0.0768 0.0203 0.1319 192 PHE B O 8028 C CB . PHE B 211 ? 0.9439 0.7876 0.7559 -0.0714 0.0005 0.1541 192 PHE B CB 8029 C CG . PHE B 211 ? 0.9063 0.7580 0.6958 -0.0542 -0.0205 0.1464 192 PHE B CG 8030 C CD1 . PHE B 211 ? 0.9354 0.8141 0.7569 -0.0513 -0.0427 0.1322 192 PHE B CD1 8031 C CD2 . PHE B 211 ? 0.9686 0.7991 0.7043 -0.0413 -0.0172 0.1522 192 PHE B CD2 8032 C CE1 . PHE B 211 ? 0.8387 0.7254 0.6467 -0.0376 -0.0612 0.1228 192 PHE B CE1 8033 C CE2 . PHE B 211 ? 1.1211 0.9599 0.8389 -0.0262 -0.0390 0.1416 192 PHE B CE2 8034 C CZ . PHE B 211 ? 0.9566 0.8249 0.7145 -0.0253 -0.0610 0.1263 192 PHE B CZ 8035 N N . LYS B 212 ? 0.9811 0.8429 0.8042 -0.0910 0.0611 0.1543 193 LYS B N 8036 C CA . LYS B 212 ? 0.8918 0.7567 0.6982 -0.0892 0.0832 0.1534 193 LYS B CA 8037 C C . LYS B 212 ? 0.9940 0.9044 0.8595 -0.0984 0.0862 0.1377 193 LYS B C 8038 O O . LYS B 212 ? 1.0048 0.9297 0.8646 -0.0910 0.0885 0.1296 193 LYS B O 8039 C CB . LYS B 212 ? 0.8491 0.6804 0.6299 -0.0967 0.1199 0.1693 193 LYS B CB 8040 N N . CYS B 213 ? 0.9128 0.8444 0.8339 -0.1132 0.0845 0.1327 194 CYS B N 8041 C CA . CYS B 213 ? 0.8869 0.8619 0.8666 -0.1201 0.0824 0.1178 194 CYS B CA 8042 C C . CYS B 213 ? 0.9496 0.9449 0.9303 -0.1068 0.0559 0.1067 194 CYS B C 8043 O O . CYS B 213 ? 0.8869 0.9110 0.8966 -0.1053 0.0569 0.0962 194 CYS B O 8044 C CB . CYS B 213 ? 0.7869 0.7762 0.8178 -0.1358 0.0774 0.1134 194 CYS B CB 8045 S SG . CYS B 213 ? 0.9358 0.9769 1.0345 -0.1400 0.0631 0.0946 194 CYS B SG 8046 N N . LEU B 214 ? 0.9914 0.9703 0.9425 -0.0969 0.0336 0.1088 195 LEU B N 8047 C CA . LEU B 214 ? 0.8240 0.8164 0.7738 -0.0850 0.0115 0.0988 195 LEU B CA 8048 C C . LEU B 214 ? 0.8390 0.8207 0.7474 -0.0724 0.0153 0.0976 195 LEU B C 8049 O O . LEU B 214 ? 0.8245 0.8244 0.7436 -0.0672 0.0138 0.0870 195 LEU B O 8050 C CB . LEU B 214 ? 0.6659 0.6474 0.6093 -0.0806 -0.0121 0.0997 195 LEU B CB 8051 C CG . LEU B 214 ? 0.6635 0.6550 0.6070 -0.0692 -0.0325 0.0896 195 LEU B CG 8052 C CD1 . LEU B 214 ? 0.4766 0.4968 0.4605 -0.0720 -0.0356 0.0794 195 LEU B CD1 8053 C CD2 . LEU B 214 ? 0.5095 0.4871 0.4452 -0.0642 -0.0513 0.0912 195 LEU B CD2 8054 N N . LYS B 215 ? 0.9070 0.8563 0.7652 -0.0665 0.0196 0.1081 196 LYS B N 8055 C CA . LYS B 215 ? 0.9542 0.8872 0.7621 -0.0528 0.0202 0.1065 196 LYS B CA 8056 C C . LYS B 215 ? 1.0178 0.9614 0.8274 -0.0541 0.0448 0.1013 196 LYS B C 8057 O O . LYS B 215 ? 1.0416 0.9869 0.8309 -0.0437 0.0401 0.0912 196 LYS B O 8058 C CB . LYS B 215 ? 1.0774 0.9695 0.8270 -0.0458 0.0234 0.1216 196 LYS B CB 8059 C CG . LYS B 215 ? 1.2650 1.1326 0.9512 -0.0325 0.0318 0.1228 196 LYS B CG 8060 C CD . LYS B 215 ? 1.4185 1.2407 1.0432 -0.0242 0.0354 0.1408 196 LYS B CD 8061 C CE . LYS B 215 ? 1.5051 1.2962 1.0606 -0.0135 0.0552 0.1460 196 LYS B CE 8062 N NZ . LYS B 215 ? 1.5962 1.3876 1.1159 0.0039 0.0304 0.1312 196 LYS B NZ 8063 N N . ASP B 216 ? 0.9170 0.8683 0.7548 -0.0673 0.0714 0.1064 197 ASP B N 8064 C CA . ASP B 216 ? 0.8992 0.8634 0.7482 -0.0692 0.0983 0.1012 197 ASP B CA 8065 C C . ASP B 216 ? 0.9287 0.9330 0.8322 -0.0693 0.0888 0.0856 197 ASP B C 8066 O O . ASP B 216 ? 1.0296 1.0449 0.9378 -0.0650 0.1034 0.0776 197 ASP B O 8067 C CB . ASP B 216 ? 0.9740 0.9342 0.8422 -0.0840 0.1322 0.1110 197 ASP B CB 8068 C CG . ASP B 216 ? 1.0789 0.9921 0.8839 -0.0819 0.1506 0.1282 197 ASP B CG 8069 O OD1 . ASP B 216 ? 1.0442 0.9296 0.7852 -0.0661 0.1380 0.1311 197 ASP B OD1 8070 O OD2 . ASP B 216 ? 1.0742 0.9770 0.8936 -0.0954 0.1774 0.1384 197 ASP B OD2 8071 N N . GLY B 217 ? 0.7721 0.7949 0.7138 -0.0730 0.0653 0.0819 198 GLY B N 8072 C CA . GLY B 217 ? 0.7958 0.8513 0.7840 -0.0713 0.0544 0.0696 198 GLY B CA 8073 C C . GLY B 217 ? 0.8367 0.9203 0.8840 -0.0830 0.0626 0.0679 198 GLY B C 8074 O O . GLY B 217 ? 0.6449 0.7562 0.7320 -0.0801 0.0565 0.0584 198 GLY B O 8075 N N . ALA B 218 ? 0.8039 0.8793 0.8579 -0.0958 0.0756 0.0764 199 ALA B N 8076 C CA . ALA B 218 ? 0.7377 0.8406 0.8522 -0.1087 0.0813 0.0723 199 ALA B CA 8077 C C . ALA B 218 ? 0.7889 0.9078 0.9310 -0.1085 0.0505 0.0662 199 ALA B C 8078 O O . ALA B 218 ? 0.7374 0.8872 0.9285 -0.1102 0.0438 0.0571 199 ALA B O 8079 C CB . ALA B 218 ? 0.7552 0.8407 0.8695 -0.1237 0.1029 0.0821 199 ALA B CB 8080 N N . GLY B 219 ? 0.7026 0.7993 0.8116 -0.1049 0.0320 0.0711 200 GLY B N 8081 C CA . GLY B 219 ? 0.7563 0.8609 0.8807 -0.1033 0.0058 0.0663 200 GLY B CA 8082 C C . GLY B 219 ? 0.7588 0.8512 0.8523 -0.0900 -0.0111 0.0655 200 GLY B C 8083 O O . GLY B 219 ? 0.7745 0.8522 0.8343 -0.0827 -0.0059 0.0678 200 GLY B O 8084 N N . ASP B 220 ? 0.5442 0.6415 0.6489 -0.0869 -0.0309 0.0614 201 ASP B N 8085 C CA . ASP B 220 ? 0.4850 0.5718 0.5694 -0.0760 -0.0444 0.0596 201 ASP B CA 8086 C C . ASP B 220 ? 0.5897 0.6550 0.6550 -0.0775 -0.0549 0.0643 201 ASP B C 8087 O O . ASP B 220 ? 0.6455 0.6996 0.6944 -0.0699 -0.0632 0.0632 201 ASP B O 8088 C CB . ASP B 220 ? 0.5504 0.6530 0.6569 -0.0689 -0.0552 0.0527 201 ASP B CB 8089 C CG . ASP B 220 ? 0.6406 0.7673 0.7743 -0.0665 -0.0465 0.0477 201 ASP B CG 8090 O OD1 . ASP B 220 ? 0.6733 0.8004 0.7984 -0.0608 -0.0358 0.0455 201 ASP B OD1 8091 O OD2 . ASP B 220 ? 0.7968 0.9422 0.9616 -0.0695 -0.0511 0.0445 201 ASP B OD2 8092 N N . VAL B 221 ? 0.5318 0.5918 0.6036 -0.0876 -0.0538 0.0681 202 VAL B N 8093 C CA . VAL B 221 ? 0.5741 0.6126 0.6302 -0.0888 -0.0618 0.0723 202 VAL B CA 8094 C C . VAL B 221 ? 0.7175 0.7421 0.7705 -0.0998 -0.0521 0.0793 202 VAL B C 8095 O O . VAL B 221 ? 0.6407 0.6765 0.7176 -0.1104 -0.0445 0.0773 202 VAL B O 8096 C CB . VAL B 221 ? 0.5469 0.5872 0.6142 -0.0873 -0.0756 0.0670 202 VAL B CB 8097 C CG1 . VAL B 221 ? 0.3925 0.4501 0.4866 -0.0944 -0.0779 0.0616 202 VAL B CG1 8098 C CG2 . VAL B 221 ? 0.5557 0.5731 0.6086 -0.0881 -0.0808 0.0705 202 VAL B CG2 8099 N N . ALA B 222 ? 0.8359 0.8356 0.8619 -0.0968 -0.0525 0.0870 203 ALA B N 8100 C CA . ALA B 222 ? 0.7505 0.7294 0.7684 -0.1056 -0.0421 0.0956 203 ALA B CA 8101 C C . ALA B 222 ? 0.7379 0.6978 0.7513 -0.1053 -0.0524 0.0968 203 ALA B C 8102 O O . ALA B 222 ? 0.8159 0.7670 0.8149 -0.0945 -0.0634 0.0973 203 ALA B O 8103 C CB . ALA B 222 ? 0.7992 0.7590 0.7826 -0.1001 -0.0308 0.1060 203 ALA B CB 8104 N N . PHE B 223 ? 0.6108 0.5648 0.6402 -0.1176 -0.0483 0.0958 204 PHE B N 8105 C CA . PHE B 223 ? 0.6940 0.6272 0.7193 -0.1182 -0.0554 0.0958 204 PHE B CA 8106 C C . PHE B 223 ? 0.8413 0.7421 0.8463 -0.1198 -0.0449 0.1082 204 PHE B C 8107 O O . PHE B 223 ? 0.7287 0.6199 0.7422 -0.1328 -0.0307 0.1113 204 PHE B O 8108 C CB . PHE B 223 ? 0.5992 0.5418 0.6506 -0.1294 -0.0602 0.0847 204 PHE B CB 8109 C CG . PHE B 223 ? 0.6481 0.6170 0.7129 -0.1248 -0.0721 0.0744 204 PHE B CG 8110 C CD1 . PHE B 223 ? 0.6247 0.5908 0.6778 -0.1132 -0.0827 0.0719 204 PHE B CD1 8111 C CD2 . PHE B 223 ? 0.6682 0.6634 0.7589 -0.1312 -0.0715 0.0674 204 PHE B CD2 8112 C CE1 . PHE B 223 ? 0.5474 0.5314 0.6077 -0.1078 -0.0913 0.0645 204 PHE B CE1 8113 C CE2 . PHE B 223 ? 0.5503 0.5662 0.6499 -0.1241 -0.0836 0.0594 204 PHE B CE2 8114 C CZ . PHE B 223 ? 0.4964 0.5042 0.5775 -0.1123 -0.0929 0.0589 204 PHE B CZ 8115 N N . VAL B 224 ? 0.7488 0.6321 0.7290 -0.1061 -0.0517 0.1151 205 VAL B N 8116 C CA . VAL B 224 ? 0.7544 0.6038 0.7084 -0.1025 -0.0441 0.1289 205 VAL B CA 8117 C C . VAL B 224 ? 0.8308 0.6625 0.7761 -0.0900 -0.0573 0.1305 205 VAL B C 8118 O O . VAL B 224 ? 0.6863 0.5315 0.6483 -0.0866 -0.0688 0.1202 205 VAL B O 8119 C CB . VAL B 224 ? 0.7957 0.6393 0.7182 -0.0935 -0.0380 0.1390 205 VAL B CB 8120 C CG1 . VAL B 224 ? 0.8452 0.7046 0.7775 -0.1052 -0.0204 0.1379 205 VAL B CG1 8121 C CG2 . VAL B 224 ? 0.6875 0.5459 0.6008 -0.0774 -0.0560 0.1336 205 VAL B CG2 8122 N N . LYS B 225 ? 0.8716 0.6716 0.7906 -0.0821 -0.0541 0.1438 206 LYS B N 8123 C CA . LYS B 225 ? 0.9145 0.6980 0.8272 -0.0672 -0.0673 0.1460 206 LYS B CA 8124 C C . LYS B 225 ? 0.9471 0.7439 0.8483 -0.0492 -0.0842 0.1445 206 LYS B C 8125 O O . LYS B 225 ? 0.9808 0.7842 0.8620 -0.0460 -0.0833 0.1475 206 LYS B O 8126 C CB . LYS B 225 ? 1.1947 0.9359 1.0840 -0.0638 -0.0586 0.1614 206 LYS B CB 8127 C CG . LYS B 225 ? 1.3618 1.0853 1.2684 -0.0802 -0.0449 0.1598 206 LYS B CG 8128 C CD . LYS B 225 ? 1.5563 1.2331 1.4391 -0.0746 -0.0360 0.1757 206 LYS B CD 8129 C CE . LYS B 225 ? 1.6247 1.2817 1.5271 -0.0925 -0.0216 0.1718 206 LYS B CE 8130 N NZ . LYS B 225 ? 1.6490 1.2555 1.5275 -0.0886 -0.0086 0.1889 206 LYS B NZ 8131 N N . HIS B 226 ? 0.9646 0.7650 0.8808 -0.0380 -0.0989 0.1384 207 HIS B N 8132 C CA . HIS B 226 ? 1.0135 0.8295 0.9302 -0.0219 -0.1173 0.1330 207 HIS B CA 8133 C C . HIS B 226 ? 1.1217 0.9213 0.9981 -0.0078 -0.1244 0.1440 207 HIS B C 8134 O O . HIS B 226 ? 1.2146 1.0303 1.0827 0.0003 -0.1362 0.1382 207 HIS B O 8135 C CB . HIS B 226 ? 1.0590 0.8738 1.0006 -0.0114 -0.1285 0.1272 207 HIS B CB 8136 C CG . HIS B 226 ? 1.2158 0.9973 1.1423 -0.0012 -0.1299 0.1393 207 HIS B CG 8137 N ND1 . HIS B 226 ? 1.1684 0.9235 1.0897 -0.0114 -0.1141 0.1468 207 HIS B ND1 8138 C CD2 . HIS B 226 ? 1.1708 0.9393 1.0860 0.0192 -0.1461 0.1451 207 HIS B CD2 8139 C CE1 . HIS B 226 ? 1.1410 0.8658 1.0475 0.0022 -0.1181 0.1578 207 HIS B CE1 8140 N NE2 . HIS B 226 ? 1.1155 0.8482 1.0172 0.0221 -0.1385 0.1576 207 HIS B NE2 8141 N N . SER B 227 ? 1.1545 0.9185 1.0028 -0.0047 -0.1168 0.1598 208 SER B N 8142 C CA . SER B 227 ? 1.1796 0.9178 0.9800 0.0120 -0.1233 0.1733 208 SER B CA 8143 C C . SER B 227 ? 1.3526 1.0885 1.1192 0.0057 -0.1089 0.1788 208 SER B C 8144 O O . SER B 227 ? 1.5081 1.2295 1.2306 0.0207 -0.1167 0.1856 208 SER B O 8145 C CB . SER B 227 ? 1.1208 0.8154 0.9001 0.0174 -0.1156 0.1903 208 SER B CB 8146 O OG . SER B 227 ? 1.0454 0.7248 0.8262 -0.0035 -0.0882 0.1968 208 SER B OG 8147 N N . THR B 228 ? 1.2843 1.0342 1.0714 -0.0156 -0.0884 0.1750 209 THR B N 8148 C CA . THR B 228 ? 1.2625 1.0091 1.0255 -0.0242 -0.0683 0.1807 209 THR B CA 8149 C C . THR B 228 ? 1.2790 1.0380 1.0146 -0.0124 -0.0783 0.1757 209 THR B C 8150 O O . THR B 228 ? 1.2594 0.9931 0.9452 -0.0049 -0.0692 0.1873 209 THR B O 8151 C CB . THR B 228 ? 1.1128 0.8838 0.9164 -0.0475 -0.0506 0.1721 209 THR B CB 8152 O OG1 . THR B 228 ? 1.0036 0.7567 0.8248 -0.0595 -0.0391 0.1767 209 THR B OG1 8153 C CG2 . THR B 228 ? 1.2650 1.0375 1.0522 -0.0556 -0.0289 0.1761 209 THR B CG2 8154 N N . ILE B 229 ? 1.1150 0.9094 0.8804 -0.0105 -0.0954 0.1584 210 ILE B N 8155 C CA . ILE B 229 ? 1.0807 0.8881 0.8254 -0.0006 -0.1057 0.1500 210 ILE B CA 8156 C C . ILE B 229 ? 1.1197 0.9039 0.8181 0.0226 -0.1268 0.1551 210 ILE B C 8157 O O . ILE B 229 ? 1.2302 1.0068 0.8864 0.0319 -0.1292 0.1546 210 ILE B O 8158 C CB . ILE B 229 ? 1.2114 1.0585 1.0016 -0.0042 -0.1184 0.1299 210 ILE B CB 8159 C CG1 . ILE B 229 ? 1.2815 1.1403 1.0516 0.0027 -0.1243 0.1200 210 ILE B CG1 8160 C CG2 . ILE B 229 ? 1.2387 1.0934 1.0580 0.0044 -0.1407 0.1225 210 ILE B CG2 8161 C CD1 . ILE B 229 ? 1.2491 1.1421 1.0621 -0.0016 -0.1326 0.1013 210 ILE B CD1 8162 N N . PHE B 230 ? 1.0576 0.8292 0.7621 0.0333 -0.1430 0.1593 211 PHE B N 8163 C CA . PHE B 230 ? 1.0741 0.8241 0.7369 0.0580 -0.1671 0.1640 211 PHE B CA 8164 C C . PHE B 230 ? 1.2347 0.9360 0.8309 0.0652 -0.1513 0.1872 211 PHE B C 8165 O O . PHE B 230 ? 1.2613 0.9371 0.8047 0.0875 -0.1686 0.1940 211 PHE B O 8166 C CB . PHE B 230 ? 1.0339 0.7879 0.7311 0.0689 -0.1894 0.1604 211 PHE B CB 8167 C CG . PHE B 230 ? 1.0436 0.8407 0.8029 0.0643 -0.2038 0.1381 211 PHE B CG 8168 C CD1 . PHE B 230 ? 1.0137 0.8311 0.7791 0.0776 -0.2311 0.1219 211 PHE B CD1 8169 C CD2 . PHE B 230 ? 1.0411 0.8557 0.8512 0.0468 -0.1895 0.1328 211 PHE B CD2 8170 C CE1 . PHE B 230 ? 1.0446 0.8990 0.8704 0.0719 -0.2402 0.1016 211 PHE B CE1 8171 C CE2 . PHE B 230 ? 0.8183 0.6669 0.6810 0.0431 -0.1986 0.1142 211 PHE B CE2 8172 C CZ . PHE B 230 ? 0.8548 0.7231 0.7275 0.0549 -0.2222 0.0991 211 PHE B CZ 8173 N N . GLU B 231 ? 1.2192 0.9064 0.8179 0.0467 -0.1184 0.1989 212 GLU B N 8174 C CA . GLU B 231 ? 1.2849 0.9225 0.8259 0.0499 -0.0959 0.2222 212 GLU B CA 8175 C C . GLU B 231 ? 1.2547 0.8876 0.7632 0.0410 -0.0691 0.2252 212 GLU B C 8176 O O . GLU B 231 ? 1.2784 0.8685 0.7345 0.0432 -0.0453 0.2444 212 GLU B O 8177 C CB . GLU B 231 ? 1.3521 0.9714 0.9194 0.0348 -0.0745 0.2334 212 GLU B CB 8178 C CG . GLU B 231 ? 1.5246 1.1375 1.1141 0.0462 -0.0962 0.2338 212 GLU B CG 8179 C CD . GLU B 231 ? 1.7077 1.3061 1.3292 0.0287 -0.0749 0.2399 212 GLU B CD 8180 O OE1 . GLU B 231 ? 1.6620 1.2620 1.2965 0.0060 -0.0463 0.2410 212 GLU B OE1 8181 O OE2 . GLU B 231 ? 1.7864 1.3727 1.4229 0.0377 -0.0873 0.2420 212 GLU B OE2 8182 N N . ASN B 232 ? 1.1845 0.8591 0.7245 0.0315 -0.0707 0.2065 213 ASN B N 8183 C CA . ASN B 232 ? 1.2404 0.9155 0.7570 0.0238 -0.0454 0.2064 213 ASN B CA 8184 C C . ASN B 232 ? 1.3243 1.0170 0.8193 0.0371 -0.0656 0.1907 213 ASN B C 8185 O O . ASN B 232 ? 1.2884 0.9754 0.7508 0.0364 -0.0476 0.1901 213 ASN B O 8186 C CB . ASN B 232 ? 1.1510 0.8580 0.7290 -0.0026 -0.0214 0.1989 213 ASN B CB 8187 C CG . ASN B 232 ? 1.4166 1.1040 1.0136 -0.0179 0.0016 0.2123 213 ASN B CG 8188 O OD1 . ASN B 232 ? 1.7236 1.3781 1.2889 -0.0228 0.0317 0.2280 213 ASN B OD1 8189 N ND2 . ASN B 232 ? 1.3040 1.0089 0.9519 -0.0258 -0.0106 0.2057 213 ASN B ND2 8190 N N . LEU B 233 ? 1.3472 1.0607 0.8636 0.0486 -0.1019 0.1767 214 LEU B N 8191 C CA . LEU B 233 ? 1.3305 1.0620 0.8344 0.0609 -0.1258 0.1583 214 LEU B CA 8192 C C . LEU B 233 ? 1.3403 1.0613 0.8240 0.0846 -0.1646 0.1558 214 LEU B C 8193 O O . LEU B 233 ? 1.3525 1.0982 0.8894 0.0851 -0.1865 0.1454 214 LEU B O 8194 C CB . LEU B 233 ? 1.1619 0.9426 0.7364 0.0465 -0.1302 0.1369 214 LEU B CB 8195 C CG . LEU B 233 ? 1.1443 0.9414 0.7172 0.0386 -0.1136 0.1260 214 LEU B CG 8196 C CD1 . LEU B 233 ? 0.8915 0.6703 0.4431 0.0268 -0.0740 0.1414 214 LEU B CD1 8197 C CD2 . LEU B 233 ? 0.7900 0.6307 0.4332 0.0258 -0.1181 0.1078 214 LEU B CD2 8198 N N . ALA B 234 ? 1.4554 1.1385 0.8617 0.1052 -0.1727 0.1652 215 ALA B N 8199 C CA . ALA B 234 ? 1.5317 1.2010 0.9128 0.1311 -0.2119 0.1645 215 ALA B CA 8200 C C . ALA B 234 ? 1.6204 1.3265 1.0300 0.1400 -0.2497 0.1357 215 ALA B C 8201 O O . ALA B 234 ? 1.5712 1.2853 0.9983 0.1561 -0.2854 0.1281 215 ALA B O 8202 C CB . ALA B 234 ? 1.4589 1.0721 0.7407 0.1526 -0.2097 0.1842 215 ALA B CB 8203 N N . ASN B 235 ? 1.6525 1.3813 1.0717 0.1291 -0.2409 0.1190 216 ASN B N 8204 C CA . ASN B 235 ? 1.7341 1.4944 1.1785 0.1354 -0.2730 0.0901 216 ASN B CA 8205 C C . ASN B 235 ? 1.5779 1.3852 1.1186 0.1194 -0.2785 0.0730 216 ASN B C 8206 O O . ASN B 235 ? 1.6495 1.4703 1.2326 0.0989 -0.2506 0.0790 216 ASN B O 8207 C CB . ASN B 235 ? 1.9077 1.6655 1.3129 0.1331 -0.2609 0.0789 216 ASN B CB 8208 C CG . ASN B 235 ? 2.0540 1.7619 1.3561 0.1509 -0.2548 0.0939 216 ASN B CG 8209 O OD1 . ASN B 235 ? 2.1625 1.8340 1.4227 0.1596 -0.2470 0.1186 216 ASN B OD1 8210 N ND2 . ASN B 235 ? 1.9997 1.7019 1.2573 0.1570 -0.2566 0.0792 216 ASN B ND2 8211 N N . LYS B 236 ? 1.5054 1.3363 1.0797 0.1293 -0.3146 0.0510 217 LYS B N 8212 C CA . LYS B 236 ? 1.3921 1.2647 1.0552 0.1153 -0.3185 0.0330 217 LYS B CA 8213 C C . LYS B 236 ? 1.2671 1.1596 0.9513 0.0981 -0.2991 0.0190 217 LYS B C 8214 O O . LYS B 236 ? 1.0894 1.0022 0.8278 0.0799 -0.2789 0.0185 217 LYS B O 8215 C CB . LYS B 236 ? 1.3502 1.2423 1.0460 0.1306 -0.3611 0.0113 217 LYS B CB 8216 C CG . LYS B 236 ? 1.2331 1.1664 1.0209 0.1165 -0.3636 -0.0098 217 LYS B CG 8217 C CD . LYS B 236 ? 1.1898 1.1297 1.0278 0.1054 -0.3447 0.0036 217 LYS B CD 8218 C CE . LYS B 236 ? 1.0937 1.0687 1.0183 0.0991 -0.3543 -0.0171 217 LYS B CE 8219 N NZ . LYS B 236 ? 1.0835 1.0803 1.0414 0.0842 -0.3449 -0.0367 217 LYS B NZ 8220 N N . ALA B 237 ? 1.2746 1.1583 0.9119 0.1055 -0.3056 0.0079 218 ALA B N 8221 C CA . ALA B 237 ? 1.1524 1.0517 0.8055 0.0922 -0.2889 -0.0069 218 ALA B CA 8222 C C . ALA B 237 ? 1.2048 1.0973 0.8509 0.0765 -0.2471 0.0114 218 ALA B C 8223 O O . ALA B 237 ? 1.1936 1.1063 0.8795 0.0619 -0.2294 0.0037 218 ALA B O 8224 C CB . ALA B 237 ? 0.9936 0.8803 0.5912 0.1057 -0.3057 -0.0237 218 ALA B CB 8225 N N . ASP B 238 ? 1.2316 1.0950 0.8287 0.0802 -0.2316 0.0353 219 ASP B N 8226 C CA . ASP B 238 ? 1.3174 1.1762 0.9154 0.0645 -0.1927 0.0520 219 ASP B CA 8227 C C . ASP B 238 ? 1.2042 1.0866 0.8723 0.0482 -0.1831 0.0559 219 ASP B C 8228 O O . ASP B 238 ? 1.1287 1.0283 0.8295 0.0334 -0.1617 0.0542 219 ASP B O 8229 C CB . ASP B 238 ? 1.4553 1.2745 0.9879 0.0712 -0.1766 0.0763 219 ASP B CB 8230 C CG . ASP B 238 ? 1.5169 1.3103 0.9769 0.0806 -0.1656 0.0760 219 ASP B CG 8231 O OD1 . ASP B 238 ? 1.4743 1.2838 0.9440 0.0751 -0.1572 0.0602 219 ASP B OD1 8232 O OD2 . ASP B 238 ? 1.6002 1.3543 0.9909 0.0942 -0.1638 0.0921 219 ASP B OD2 8233 N N . ARG B 239 ? 1.1247 1.0067 0.8139 0.0526 -0.1999 0.0605 220 ARG B N 8234 C CA . ARG B 239 ? 1.1312 1.0305 0.8793 0.0390 -0.1913 0.0639 220 ARG B CA 8235 C C . ARG B 239 ? 0.9951 0.9262 0.8022 0.0328 -0.2004 0.0435 220 ARG B C 8236 O O . ARG B 239 ? 1.0237 0.9690 0.8756 0.0206 -0.1890 0.0444 220 ARG B O 8237 C CB . ARG B 239 ? 1.2330 1.1176 0.9823 0.0464 -0.2026 0.0759 220 ARG B CB 8238 C CG . ARG B 239 ? 1.2820 1.1798 1.0603 0.0588 -0.2348 0.0615 220 ARG B CG 8239 C CD . ARG B 239 ? 1.2179 1.1008 1.0007 0.0668 -0.2430 0.0743 220 ARG B CD 8240 N NE . ARG B 239 ? 1.3336 1.1787 1.0497 0.0794 -0.2422 0.0935 220 ARG B NE 8241 C CZ . ARG B 239 ? 1.3438 1.1721 1.0234 0.1019 -0.2696 0.0943 220 ARG B CZ 8242 N NH1 . ARG B 239 ? 1.2000 1.0509 0.9112 0.1134 -0.3020 0.0745 220 ARG B NH1 8243 N NH2 . ARG B 239 ? 1.4396 1.2273 1.0519 0.1136 -0.2646 0.1146 220 ARG B NH2 8244 N N . ASP B 240 ? 0.9587 0.8981 0.7634 0.0414 -0.2202 0.0248 221 ASP B N 8245 C CA . ASP B 240 ? 0.9626 0.9283 0.8221 0.0347 -0.2252 0.0047 221 ASP B CA 8246 C C . ASP B 240 ? 0.8471 0.8216 0.7180 0.0214 -0.1995 0.0038 221 ASP B C 8247 O O . ASP B 240 ? 0.6685 0.6603 0.5850 0.0138 -0.1961 -0.0076 221 ASP B O 8248 C CB . ASP B 240 ? 1.1496 1.1209 1.0047 0.0463 -0.2532 -0.0176 221 ASP B CB 8249 C CG . ASP B 240 ? 1.3091 1.2873 1.1912 0.0567 -0.2820 -0.0248 221 ASP B CG 8250 O OD1 . ASP B 240 ? 1.3022 1.2919 1.1988 0.0643 -0.3076 -0.0470 221 ASP B OD1 8251 O OD2 . ASP B 240 ? 1.3256 1.2986 1.2181 0.0572 -0.2792 -0.0097 221 ASP B OD2 8252 N N . GLN B 241 ? 0.8769 0.8382 0.7076 0.0195 -0.1805 0.0162 222 GLN B N 8253 C CA . GLN B 241 ? 0.9501 0.9208 0.7930 0.0089 -0.1565 0.0162 222 GLN B CA 8254 C C . GLN B 241 ? 0.8493 0.8267 0.7228 -0.0032 -0.1397 0.0297 222 GLN B C 8255 O O . GLN B 241 ? 0.9415 0.9270 0.8257 -0.0112 -0.1208 0.0325 222 GLN B O 8256 C CB . GLN B 241 ? 1.1434 1.0990 0.9349 0.0124 -0.1415 0.0213 222 GLN B CB 8257 C CG . GLN B 241 ? 1.2197 1.1681 0.9768 0.0237 -0.1547 0.0045 222 GLN B CG 8258 C CD . GLN B 241 ? 1.4095 1.3385 1.1101 0.0276 -0.1350 0.0109 222 GLN B CD 8259 O OE1 . GLN B 241 ? 1.4603 1.3678 1.1210 0.0303 -0.1252 0.0286 222 GLN B OE1 8260 N NE2 . GLN B 241 ? 1.4701 1.4041 1.1674 0.0278 -0.1262 -0.0033 222 GLN B NE2 8261 N N . TYR B 242 ? 0.7404 0.7144 0.6282 -0.0035 -0.1479 0.0368 223 TYR B N 8262 C CA . TYR B 242 ? 0.5774 0.5543 0.4893 -0.0142 -0.1347 0.0478 223 TYR B CA 8263 C C . TYR B 242 ? 0.6037 0.5883 0.5552 -0.0155 -0.1441 0.0427 223 TYR B C 8264 O O . TYR B 242 ? 0.6426 0.6285 0.6036 -0.0077 -0.1614 0.0338 223 TYR B O 8265 C CB . TYR B 242 ? 0.5445 0.5016 0.4269 -0.0152 -0.1267 0.0653 223 TYR B CB 8266 C CG . TYR B 242 ? 0.8000 0.7480 0.6468 -0.0162 -0.1098 0.0718 223 TYR B CG 8267 C CD1 . TYR B 242 ? 0.7908 0.7479 0.6526 -0.0279 -0.0883 0.0761 223 TYR B CD1 8268 C CD2 . TYR B 242 ? 0.7856 0.7156 0.5840 -0.0045 -0.1152 0.0725 223 TYR B CD2 8269 C CE1 . TYR B 242 ? 0.7504 0.7005 0.5858 -0.0294 -0.0691 0.0811 223 TYR B CE1 8270 C CE2 . TYR B 242 ? 0.8439 0.7623 0.6067 -0.0051 -0.0954 0.0785 223 TYR B CE2 8271 C CZ . TYR B 242 ? 0.7986 0.7278 0.5830 -0.0182 -0.0706 0.0828 223 TYR B CZ 8272 O OH . TYR B 242 ? 1.0957 1.0142 0.8500 -0.0192 -0.0474 0.0882 223 TYR B OH 8273 N N . GLU B 243 ? 0.5871 0.5766 0.5622 -0.0249 -0.1323 0.0474 224 GLU B N 8274 C CA . GLU B 243 ? 0.6884 0.6811 0.6964 -0.0266 -0.1354 0.0439 224 GLU B CA 8275 C C . GLU B 243 ? 0.7155 0.7003 0.7259 -0.0338 -0.1263 0.0549 224 GLU B C 8276 O O . GLU B 243 ? 0.6744 0.6536 0.6669 -0.0388 -0.1180 0.0642 224 GLU B O 8277 C CB . GLU B 243 ? 0.7047 0.7096 0.7396 -0.0295 -0.1301 0.0335 224 GLU B CB 8278 C CG . GLU B 243 ? 0.7415 0.7532 0.7880 -0.0238 -0.1404 0.0184 224 GLU B CG 8279 C CD . GLU B 243 ? 0.7934 0.8120 0.8633 -0.0273 -0.1311 0.0099 224 GLU B CD 8280 O OE1 . GLU B 243 ? 0.7036 0.7230 0.7688 -0.0312 -0.1187 0.0162 224 GLU B OE1 8281 O OE2 . GLU B 243 ? 0.9026 0.9252 0.9976 -0.0257 -0.1363 -0.0034 224 GLU B OE2 8282 N N . LEU B 244 ? 0.7940 0.7775 0.8280 -0.0348 -0.1264 0.0524 225 LEU B N 8283 C CA . LEU B 244 ? 0.7841 0.7583 0.8195 -0.0412 -0.1187 0.0597 225 LEU B CA 8284 C C . LEU B 244 ? 0.6879 0.6663 0.7405 -0.0452 -0.1108 0.0551 225 LEU B C 8285 O O . LEU B 244 ? 0.7598 0.7427 0.8302 -0.0421 -0.1106 0.0473 225 LEU B O 8286 C CB . LEU B 244 ? 0.6793 0.6405 0.7188 -0.0367 -0.1244 0.0623 225 LEU B CB 8287 C CG . LEU B 244 ? 0.6144 0.5646 0.6312 -0.0297 -0.1332 0.0694 225 LEU B CG 8288 C CD1 . LEU B 244 ? 0.4552 0.3941 0.4833 -0.0224 -0.1404 0.0705 225 LEU B CD1 8289 C CD2 . LEU B 244 ? 0.4619 0.4014 0.4528 -0.0370 -0.1234 0.0809 225 LEU B CD2 8290 N N . LEU B 245 ? 0.5873 0.5622 0.6337 -0.0519 -0.1045 0.0597 226 LEU B N 8291 C CA . LEU B 245 ? 0.6390 0.6116 0.6923 -0.0533 -0.0989 0.0569 226 LEU B CA 8292 C C . LEU B 245 ? 0.6860 0.6423 0.7421 -0.0530 -0.0962 0.0569 226 LEU B C 8293 O O . LEU B 245 ? 0.8625 0.8090 0.9110 -0.0561 -0.0974 0.0611 226 LEU B O 8294 C CB . LEU B 245 ? 0.5612 0.5390 0.6068 -0.0589 -0.0972 0.0593 226 LEU B CB 8295 C CG . LEU B 245 ? 0.5945 0.5893 0.6406 -0.0595 -0.0970 0.0593 226 LEU B CG 8296 C CD1 . LEU B 245 ? 0.4728 0.4759 0.5211 -0.0638 -0.0970 0.0594 226 LEU B CD1 8297 C CD2 . LEU B 245 ? 0.5305 0.5320 0.5837 -0.0527 -0.0962 0.0539 226 LEU B CD2 8298 N N . CYS B 246 ? 0.5599 0.5109 0.6276 -0.0494 -0.0900 0.0522 227 CYS B N 8299 C CA . CYS B 246 ? 0.6184 0.5522 0.6882 -0.0486 -0.0830 0.0514 227 CYS B CA 8300 C C . CYS B 246 ? 0.7179 0.6390 0.7695 -0.0502 -0.0757 0.0519 227 CYS B C 8301 O O . CYS B 246 ? 0.6655 0.5919 0.7102 -0.0492 -0.0754 0.0522 227 CYS B O 8302 C CB . CYS B 246 ? 0.5079 0.4417 0.6045 -0.0435 -0.0776 0.0453 227 CYS B CB 8303 S SG . CYS B 246 ? 0.7697 0.7225 0.8871 -0.0390 -0.0921 0.0409 227 CYS B SG 8304 N N . LEU B 247 ? 0.7371 0.6396 0.7784 -0.0510 -0.0707 0.0516 228 LEU B N 8305 C CA . LEU B 247 ? 0.6705 0.5569 0.6865 -0.0511 -0.0665 0.0509 228 LEU B CA 8306 C C . LEU B 247 ? 0.6951 0.5707 0.7056 -0.0449 -0.0539 0.0504 228 LEU B C 8307 O O . LEU B 247 ? 0.6688 0.5327 0.6524 -0.0421 -0.0534 0.0514 228 LEU B O 8308 C CB . LEU B 247 ? 0.7388 0.6038 0.7429 -0.0527 -0.0625 0.0488 228 LEU B CB 8309 C CG . LEU B 247 ? 0.6301 0.4940 0.6238 -0.0602 -0.0732 0.0484 228 LEU B CG 8310 C CD1 . LEU B 247 ? 0.5357 0.4186 0.5261 -0.0645 -0.0850 0.0493 228 LEU B CD1 8311 C CD2 . LEU B 247 ? 0.4835 0.3489 0.4939 -0.0623 -0.0750 0.0512 228 LEU B CD2 8312 N N . ASP B 248 ? 0.6099 0.4880 0.6460 -0.0424 -0.0439 0.0485 229 ASP B N 8313 C CA . ASP B 248 ? 0.7664 0.6309 0.8021 -0.0379 -0.0270 0.0482 229 ASP B CA 8314 C C . ASP B 248 ? 0.8953 0.7723 0.9346 -0.0363 -0.0308 0.0497 229 ASP B C 8315 O O . ASP B 248 ? 0.8837 0.7517 0.9317 -0.0335 -0.0164 0.0491 229 ASP B O 8316 C CB . ASP B 248 ? 0.7399 0.6025 0.8107 -0.0374 -0.0125 0.0431 229 ASP B CB 8317 C CG . ASP B 248 ? 0.8764 0.7658 0.9855 -0.0388 -0.0226 0.0383 229 ASP B CG 8318 O OD1 . ASP B 248 ? 0.9359 0.8430 1.0407 -0.0404 -0.0410 0.0398 229 ASP B OD1 8319 O OD2 . ASP B 248 ? 1.0089 0.9008 1.1526 -0.0383 -0.0116 0.0320 229 ASP B OD2 8320 N N . ASN B 249 ? 0.8220 0.7182 0.8567 -0.0384 -0.0479 0.0512 230 ASN B N 8321 C CA . ASN B 249 ? 0.7428 0.6524 0.7817 -0.0363 -0.0522 0.0518 230 ASN B CA 8322 C C . ASN B 249 ? 0.7078 0.6294 0.7784 -0.0369 -0.0488 0.0463 230 ASN B C 8323 O O . ASN B 249 ? 0.7249 0.6432 0.8010 -0.0338 -0.0413 0.0453 230 ASN B O 8324 C CB . ASN B 249 ? 0.5779 0.4693 0.5912 -0.0292 -0.0457 0.0562 230 ASN B CB 8325 C CG . ASN B 249 ? 0.8630 0.7489 0.8457 -0.0276 -0.0567 0.0588 230 ASN B CG 8326 O OD1 . ASN B 249 ? 0.9269 0.8315 0.9139 -0.0329 -0.0711 0.0573 230 ASN B OD1 8327 N ND2 . ASN B 249 ? 0.9627 0.8211 0.9135 -0.0203 -0.0495 0.0620 230 ASN B ND2 8328 N N . THR B 250 ? 0.5946 0.5284 0.6849 -0.0400 -0.0555 0.0421 231 THR B N 8329 C CA . THR B 250 ? 0.5930 0.5423 0.7108 -0.0400 -0.0599 0.0344 231 THR B CA 8330 C C . THR B 250 ? 0.6056 0.5711 0.7195 -0.0412 -0.0767 0.0347 231 THR B C 8331 O O . THR B 250 ? 0.6762 0.6394 0.7722 -0.0431 -0.0816 0.0410 231 THR B O 8332 C CB . THR B 250 ? 0.6087 0.5545 0.7597 -0.0400 -0.0513 0.0267 231 THR B CB 8333 O OG1 . THR B 250 ? 0.7473 0.6925 0.9016 -0.0398 -0.0563 0.0276 231 THR B OG1 8334 C CG2 . THR B 250 ? 0.5046 0.4286 0.6571 -0.0394 -0.0288 0.0279 231 THR B CG2 8335 N N . ARG B 251 ? 0.6094 0.5883 0.7380 -0.0398 -0.0848 0.0274 232 ARG B N 8336 C CA . ARG B 251 ? 0.5309 0.5198 0.6497 -0.0386 -0.0995 0.0282 232 ARG B CA 8337 C C . ARG B 251 ? 0.5742 0.5675 0.7152 -0.0347 -0.1092 0.0205 232 ARG B C 8338 O O . ARG B 251 ? 0.6997 0.6954 0.8721 -0.0341 -0.1054 0.0107 232 ARG B O 8339 C CB . ARG B 251 ? 0.4571 0.4567 0.5649 -0.0378 -0.1040 0.0257 232 ARG B CB 8340 C CG . ARG B 251 ? 0.4382 0.4387 0.5258 -0.0405 -0.0988 0.0338 232 ARG B CG 8341 C CD . ARG B 251 ? 0.4805 0.4897 0.5676 -0.0385 -0.0969 0.0289 232 ARG B CD 8342 N NE . ARG B 251 ? 0.5059 0.5198 0.5814 -0.0397 -0.0927 0.0354 232 ARG B NE 8343 C CZ . ARG B 251 ? 0.5238 0.5474 0.5882 -0.0406 -0.0934 0.0372 232 ARG B CZ 8344 N NH1 . ARG B 251 ? 0.4608 0.4857 0.5149 -0.0393 -0.0981 0.0343 232 ARG B NH1 8345 N NH2 . ARG B 251 ? 0.5917 0.6230 0.6552 -0.0420 -0.0893 0.0415 232 ARG B NH2 8346 N N . LYS B 252 ? 0.5961 0.5894 0.7224 -0.0315 -0.1213 0.0250 233 LYS B N 8347 C CA . LYS B 252 ? 0.6850 0.6834 0.8280 -0.0243 -0.1362 0.0182 233 LYS B CA 8348 C C . LYS B 252 ? 0.7450 0.7429 0.8555 -0.0188 -0.1511 0.0229 233 LYS B C 8349 O O . LYS B 252 ? 0.7961 0.7860 0.8754 -0.0221 -0.1457 0.0344 233 LYS B O 8350 C CB . LYS B 252 ? 0.6655 0.6556 0.8249 -0.0224 -0.1332 0.0210 233 LYS B CB 8351 C CG . LYS B 252 ? 0.6985 0.6891 0.8964 -0.0248 -0.1193 0.0127 233 LYS B CG 8352 C CD . LYS B 252 ? 0.9094 0.8899 1.1208 -0.0223 -0.1134 0.0156 233 LYS B CD 8353 C CE . LYS B 252 ? 0.9750 0.9521 1.2212 -0.0252 -0.0934 0.0083 233 LYS B CE 8354 N NZ . LYS B 252 ? 1.0402 1.0033 1.2638 -0.0320 -0.0741 0.0138 233 LYS B NZ 8355 N N . PRO B 253 ? 0.6793 0.6844 0.7968 -0.0100 -0.1696 0.0134 234 PRO B N 8356 C CA . PRO B 253 ? 0.8157 0.8148 0.8945 -0.0017 -0.1845 0.0183 234 PRO B CA 8357 C C . PRO B 253 ? 0.8148 0.7959 0.8684 0.0007 -0.1829 0.0350 234 PRO B C 8358 O O . PRO B 253 ? 0.7659 0.7425 0.8405 -0.0004 -0.1780 0.0381 234 PRO B O 8359 C CB . PRO B 253 ? 0.6791 0.6889 0.7791 0.0092 -0.2080 0.0029 234 PRO B CB 8360 C CG . PRO B 253 ? 0.6064 0.6317 0.7557 0.0026 -0.2016 -0.0129 234 PRO B CG 8361 C CD . PRO B 253 ? 0.6014 0.6202 0.7641 -0.0073 -0.1774 -0.0038 234 PRO B CD 8362 N N . VAL B 254 ? 0.8276 0.7958 0.8362 0.0041 -0.1847 0.0453 235 VAL B N 8363 C CA . VAL B 254 ? 0.8392 0.7861 0.8219 0.0037 -0.1778 0.0625 235 VAL B CA 8364 C C . VAL B 254 ? 0.8539 0.7895 0.8416 0.0159 -0.1921 0.0659 235 VAL B C 8365 O O . VAL B 254 ? 0.9716 0.8874 0.9457 0.0152 -0.1849 0.0791 235 VAL B O 8366 C CB . VAL B 254 ? 0.6898 0.6218 0.6222 0.0045 -0.1723 0.0736 235 VAL B CB 8367 C CG1 . VAL B 254 ? 0.6131 0.5570 0.5451 -0.0071 -0.1562 0.0707 235 VAL B CG1 8368 C CG2 . VAL B 254 ? 0.6287 0.5544 0.5309 0.0205 -0.1926 0.0702 235 VAL B CG2 8369 N N . ASP B 255 ? 0.7963 0.7447 0.8068 0.0272 -0.2126 0.0529 236 ASP B N 8370 C CA . ASP B 255 ? 0.8918 0.8332 0.9135 0.0416 -0.2292 0.0544 236 ASP B CA 8371 C C . ASP B 255 ? 0.7833 0.7345 0.8589 0.0373 -0.2213 0.0479 236 ASP B C 8372 O O . ASP B 255 ? 0.8683 0.8177 0.9657 0.0488 -0.2326 0.0467 236 ASP B O 8373 C CB . ASP B 255 ? 1.0579 1.0086 1.0778 0.0587 -0.2595 0.0426 236 ASP B CB 8374 C CG . ASP B 255 ? 1.2388 1.2193 1.3040 0.0542 -0.2662 0.0198 236 ASP B CG 8375 O OD1 . ASP B 255 ? 1.2684 1.2566 1.3392 0.0396 -0.2478 0.0163 236 ASP B OD1 8376 O OD2 . ASP B 255 ? 1.2436 1.2396 1.3412 0.0658 -0.2901 0.0048 236 ASP B OD2 8377 N N . GLU B 256 ? 0.7044 0.6642 0.7995 0.0220 -0.2010 0.0439 237 GLU B N 8378 C CA . GLU B 256 ? 0.6650 0.6291 0.8031 0.0172 -0.1882 0.0384 237 GLU B CA 8379 C C . GLU B 256 ? 0.7501 0.6963 0.8702 0.0060 -0.1667 0.0500 237 GLU B C 8380 O O . GLU B 256 ? 0.7784 0.7268 0.9167 -0.0029 -0.1503 0.0458 237 GLU B O 8381 C CB . GLU B 256 ? 0.7321 0.7171 0.9082 0.0105 -0.1824 0.0227 237 GLU B CB 8382 C CG . GLU B 256 ? 0.9247 0.9297 1.1267 0.0195 -0.2044 0.0068 237 GLU B CG 8383 C CD . GLU B 256 ? 1.1269 1.1494 1.3747 0.0114 -0.1949 -0.0095 237 GLU B CD 8384 O OE1 . GLU B 256 ? 1.1628 1.1792 1.4180 0.0008 -0.1703 -0.0063 237 GLU B OE1 8385 O OE2 . GLU B 256 ? 1.2666 1.3070 1.5417 0.0160 -0.2119 -0.0259 237 GLU B OE2 8386 N N . TYR B 257 ? 0.9023 0.8286 0.9853 0.0069 -0.1667 0.0641 238 TYR B N 8387 C CA . TYR B 257 ? 0.9736 0.8830 1.0408 -0.0046 -0.1490 0.0729 238 TYR B CA 8388 C C . TYR B 257 ? 0.9553 0.8551 1.0467 -0.0045 -0.1399 0.0703 238 TYR B C 8389 O O . TYR B 257 ? 0.9152 0.8062 1.0020 -0.0151 -0.1249 0.0711 238 TYR B O 8390 C CB . TYR B 257 ? 1.0803 0.9682 1.1078 -0.0041 -0.1492 0.0878 238 TYR B CB 8391 C CG . TYR B 257 ? 1.0993 0.9713 1.1176 0.0122 -0.1635 0.0945 238 TYR B CG 8392 C CD1 . TYR B 257 ? 1.2418 1.0936 1.2674 0.0163 -0.1598 0.0997 238 TYR B CD1 8393 C CD2 . TYR B 257 ? 1.0351 0.9099 1.0342 0.0252 -0.1815 0.0955 238 TYR B CD2 8394 C CE1 . TYR B 257 ? 1.2749 1.1103 1.2918 0.0337 -0.1738 0.1069 238 TYR B CE1 8395 C CE2 . TYR B 257 ? 1.1423 1.0006 1.1286 0.0431 -0.1975 0.1024 238 TYR B CE2 8396 C CZ . TYR B 257 ? 1.2362 1.0750 1.2327 0.0478 -0.1936 0.1088 238 TYR B CZ 8397 O OH . TYR B 257 ? 1.3323 1.1529 1.3160 0.0681 -0.2106 0.1166 238 TYR B OH 8398 N N . LYS B 258 ? 0.9245 0.8260 1.0420 0.0083 -0.1495 0.0661 239 LYS B N 8399 C CA . LYS B 258 ? 0.9112 0.8027 1.0539 0.0102 -0.1390 0.0628 239 LYS B CA 8400 C C . LYS B 258 ? 0.8875 0.7889 1.0547 0.0016 -0.1222 0.0522 239 LYS B C 8401 O O . LYS B 258 ? 1.0624 0.9496 1.2354 -0.0014 -0.1063 0.0506 239 LYS B O 8402 C CB . LYS B 258 ? 0.9948 0.8900 1.1674 0.0278 -0.1540 0.0593 239 LYS B CB 8403 C CG . LYS B 258 ? 1.0522 0.9255 1.1957 0.0393 -0.1668 0.0728 239 LYS B CG 8404 C CD . LYS B 258 ? 1.0733 0.9545 1.2472 0.0602 -0.1876 0.0683 239 LYS B CD 8405 C CE . LYS B 258 ? 1.0141 0.8685 1.1509 0.0747 -0.2016 0.0841 239 LYS B CE 8406 N NZ . LYS B 258 ? 0.9134 0.7772 1.0766 0.0984 -0.2280 0.0794 239 LYS B NZ 8407 N N . ASP B 259 ? 0.8082 0.7301 0.9858 -0.0017 -0.1244 0.0451 240 ASP B N 8408 C CA . ASP B 259 ? 0.8621 0.7891 1.0580 -0.0092 -0.1067 0.0370 240 ASP B CA 8409 C C . ASP B 259 ? 0.8821 0.8081 1.0463 -0.0200 -0.1004 0.0410 240 ASP B C 8410 O O . ASP B 259 ? 0.8573 0.7855 1.0286 -0.0249 -0.0876 0.0362 240 ASP B O 8411 C CB . ASP B 259 ? 0.9587 0.9082 1.1999 -0.0049 -0.1110 0.0238 240 ASP B CB 8412 C CG . ASP B 259 ? 1.1897 1.1461 1.4726 0.0071 -0.1197 0.0172 240 ASP B CG 8413 O OD1 . ASP B 259 ? 1.2561 1.2049 1.5646 0.0078 -0.1026 0.0135 240 ASP B OD1 8414 O OD2 . ASP B 259 ? 1.1647 1.1335 1.4540 0.0170 -0.1440 0.0151 240 ASP B OD2 8415 N N . CYS B 260 ? 0.7413 0.6630 0.8722 -0.0230 -0.1083 0.0500 241 CYS B N 8416 C CA . CYS B 260 ? 0.6725 0.5981 0.7801 -0.0318 -0.1046 0.0527 241 CYS B CA 8417 C C . CYS B 260 ? 0.7029 0.6176 0.7800 -0.0376 -0.1058 0.0624 241 CYS B C 8418 O O . CYS B 260 ? 0.7932 0.7139 0.8550 -0.0383 -0.1126 0.0672 241 CYS B O 8419 C CB . CYS B 260 ? 0.6350 0.5800 0.7481 -0.0298 -0.1135 0.0483 241 CYS B CB 8420 S SG . CYS B 260 ? 0.7582 0.7108 0.8515 -0.0380 -0.1077 0.0499 241 CYS B SG 8421 N N . HIS B 261 ? 0.7473 0.6447 0.8161 -0.0424 -0.0976 0.0642 242 HIS B N 8422 C CA . HIS B 261 ? 0.7157 0.6015 0.7628 -0.0499 -0.0973 0.0711 242 HIS B CA 8423 C C . HIS B 261 ? 0.7114 0.5893 0.7492 -0.0589 -0.0897 0.0673 242 HIS B C 8424 O O . HIS B 261 ? 0.6868 0.5589 0.7283 -0.0569 -0.0831 0.0612 242 HIS B O 8425 C CB . HIS B 261 ? 0.7407 0.6069 0.7855 -0.0450 -0.0992 0.0770 242 HIS B CB 8426 C CG . HIS B 261 ? 0.8189 0.6723 0.8794 -0.0394 -0.0936 0.0718 242 HIS B CG 8427 N ND1 . HIS B 261 ? 0.8564 0.7144 0.9406 -0.0271 -0.0985 0.0692 242 HIS B ND1 8428 C CD2 . HIS B 261 ? 0.7796 0.6159 0.8366 -0.0439 -0.0831 0.0673 242 HIS B CD2 8429 C CE1 . HIS B 261 ? 0.8394 0.6843 0.9370 -0.0245 -0.0885 0.0641 242 HIS B CE1 8430 N NE2 . HIS B 261 ? 0.7777 0.6073 0.8554 -0.0344 -0.0786 0.0631 242 HIS B NE2 8431 N N . LEU B 262 ? 0.7426 0.6194 0.7681 -0.0685 -0.0904 0.0700 243 LEU B N 8432 C CA . LEU B 262 ? 0.6339 0.5040 0.6511 -0.0766 -0.0880 0.0641 243 LEU B CA 8433 C C . LEU B 262 ? 0.7410 0.5848 0.7534 -0.0771 -0.0831 0.0611 243 LEU B C 8434 O O . LEU B 262 ? 0.7239 0.5572 0.7274 -0.0774 -0.0798 0.0535 243 LEU B O 8435 C CB . LEU B 262 ? 0.5361 0.4152 0.5513 -0.0877 -0.0906 0.0655 243 LEU B CB 8436 C CG . LEU B 262 ? 0.5624 0.4672 0.5827 -0.0877 -0.0934 0.0673 243 LEU B CG 8437 C CD1 . LEU B 262 ? 0.5369 0.4529 0.5625 -0.0989 -0.0951 0.0639 243 LEU B CD1 8438 C CD2 . LEU B 262 ? 0.4942 0.4099 0.5162 -0.0793 -0.0949 0.0635 243 LEU B CD2 8439 N N . ALA B 263 ? 0.6492 0.4792 0.6640 -0.0759 -0.0820 0.0672 244 ALA B N 8440 C CA . ALA B 263 ? 0.7303 0.5327 0.7422 -0.0757 -0.0764 0.0646 244 ALA B CA 8441 C C . ALA B 263 ? 0.9293 0.7180 0.9460 -0.0684 -0.0765 0.0739 244 ALA B C 8442 O O . ALA B 263 ? 0.9648 0.7593 0.9783 -0.0677 -0.0807 0.0834 244 ALA B O 8443 C CB . ALA B 263 ? 0.8364 0.6269 0.8382 -0.0893 -0.0757 0.0588 244 ALA B CB 8444 N N . GLN B 264 ? 0.8987 0.6667 0.9204 -0.0615 -0.0713 0.0713 245 GLN B N 8445 C CA . GLN B 264 ? 0.8002 0.5495 0.8250 -0.0529 -0.0721 0.0802 245 GLN B CA 8446 C C . GLN B 264 ? 0.8080 0.5269 0.8214 -0.0626 -0.0648 0.0801 245 GLN B C 8447 O O . GLN B 264 ? 1.0097 0.7175 1.0191 -0.0699 -0.0589 0.0689 245 GLN B O 8448 C CB . GLN B 264 ? 0.8125 0.5594 0.8575 -0.0377 -0.0707 0.0766 245 GLN B CB 8449 C CG . GLN B 264 ? 0.6637 0.3931 0.7144 -0.0245 -0.0751 0.0857 245 GLN B CG 8450 C CD . GLN B 264 ? 0.8831 0.6206 0.9645 -0.0081 -0.0767 0.0806 245 GLN B CD 8451 O OE1 . GLN B 264 ? 0.8701 0.6229 0.9685 -0.0086 -0.0703 0.0701 245 GLN B OE1 8452 N NE2 . GLN B 264 ? 0.9282 0.6547 1.0183 0.0073 -0.0848 0.0881 245 GLN B NE2 8453 N N . VAL B 265 ? 0.8319 0.5346 0.8373 -0.0628 -0.0648 0.0922 246 VAL B N 8454 C CA . VAL B 265 ? 0.9168 0.5895 0.9141 -0.0748 -0.0560 0.0925 246 VAL B CA 8455 C C . VAL B 265 ? 0.9118 0.5508 0.9039 -0.0644 -0.0523 0.1053 246 VAL B C 8456 O O . VAL B 265 ? 0.8870 0.5267 0.8713 -0.0531 -0.0579 0.1194 246 VAL B O 8457 C CB . VAL B 265 ? 0.8290 0.5117 0.8208 -0.0920 -0.0540 0.0949 246 VAL B CB 8458 C CG1 . VAL B 265 ? 0.8412 0.4920 0.8309 -0.1058 -0.0433 0.0949 246 VAL B CG1 8459 C CG2 . VAL B 265 ? 0.7936 0.5062 0.7909 -0.1010 -0.0591 0.0817 246 VAL B CG2 8460 N N . PRO B 266 ? 0.9642 0.5707 0.9575 -0.0669 -0.0435 0.1001 247 PRO B N 8461 C CA . PRO B 266 ? 0.8426 0.4106 0.8299 -0.0575 -0.0382 0.1126 247 PRO B CA 8462 C C . PRO B 266 ? 0.9154 0.4624 0.8875 -0.0703 -0.0297 0.1246 247 PRO B C 8463 O O . PRO B 266 ? 1.0307 0.5763 1.0060 -0.0915 -0.0221 0.1155 247 PRO B O 8464 C CB . PRO B 266 ? 0.8337 0.3749 0.8281 -0.0595 -0.0291 0.0992 247 PRO B CB 8465 C CG . PRO B 266 ? 0.9853 0.5431 0.9800 -0.0777 -0.0281 0.0811 247 PRO B CG 8466 C CD . PRO B 266 ? 1.0997 0.7015 1.0970 -0.0761 -0.0385 0.0814 247 PRO B CD 8467 N N . SER B 267 ? 1.0107 0.5412 0.9667 -0.0571 -0.0307 0.1443 248 SER B N 8468 C CA . SER B 267 ? 1.1562 0.6630 1.0937 -0.0678 -0.0183 0.1586 248 SER B CA 8469 C C . SER B 267 ? 1.3119 0.7752 1.2525 -0.0810 -0.0013 0.1565 248 SER B C 8470 O O . SER B 267 ? 1.4685 0.9357 1.4221 -0.1047 0.0073 0.1437 248 SER B O 8471 C CB . SER B 267 ? 1.1042 0.5946 1.0142 -0.0465 -0.0233 0.1813 248 SER B CB 8472 O OG . SER B 267 ? 1.1027 0.6324 1.0119 -0.0338 -0.0412 0.1804 248 SER B OG 8473 N N . HIS B 268 ? 1.3007 0.7225 1.2314 -0.0650 0.0023 0.1678 249 HIS B N 8474 C CA . HIS B 268 ? 1.3356 0.7095 1.2687 -0.0757 0.0197 0.1664 249 HIS B CA 8475 C C . HIS B 268 ? 1.2736 0.6294 1.2187 -0.0618 0.0168 0.1567 249 HIS B C 8476 O O . HIS B 268 ? 1.3408 0.6873 1.2812 -0.0356 0.0084 0.1676 249 HIS B O 8477 C CB . HIS B 268 ? 1.4456 0.7727 1.3519 -0.0710 0.0339 0.1918 249 HIS B CB 8478 C CG . HIS B 268 ? 1.6105 0.9144 1.5216 -0.0995 0.0568 0.1905 249 HIS B CG 8479 N ND1 . HIS B 268 ? 1.6909 0.9571 1.6165 -0.1137 0.0714 0.1803 249 HIS B ND1 8480 C CD2 . HIS B 268 ? 1.7067 1.0204 1.6144 -0.1172 0.0687 0.1963 249 HIS B CD2 8481 C CE1 . HIS B 268 ? 1.7048 0.9630 1.6399 -0.1395 0.0894 0.1789 249 HIS B CE1 8482 N NE2 . HIS B 268 ? 1.7260 1.0102 1.6509 -0.1423 0.0901 0.1894 249 HIS B NE2 8483 N N . THR B 269 ? 1.0726 0.4231 1.0335 -0.0788 0.0235 0.1351 250 THR B N 8484 C CA . THR B 269 ? 1.0673 0.4035 1.0392 -0.0680 0.0235 0.1216 250 THR B CA 8485 C C . THR B 269 ? 1.2472 0.5326 1.2209 -0.0810 0.0405 0.1133 250 THR B C 8486 O O . THR B 269 ? 1.2254 0.5089 1.2041 -0.1072 0.0472 0.0996 250 THR B O 8487 C CB . THR B 269 ? 1.2102 0.5883 1.1939 -0.0730 0.0144 0.0989 250 THR B CB 8488 O OG1 . THR B 269 ? 1.1070 0.5292 1.0925 -0.0605 0.0001 0.1059 250 THR B OG1 8489 C CG2 . THR B 269 ? 1.1267 0.4863 1.1188 -0.0624 0.0192 0.0843 250 THR B CG2 8490 N N . VAL B 270 ? 1.2640 0.5086 1.2365 -0.0625 0.0468 0.1206 251 VAL B N 8491 C CA . VAL B 270 ? 1.3289 0.5239 1.3048 -0.0727 0.0630 0.1098 251 VAL B CA 8492 C C . VAL B 270 ? 1.3185 0.5201 1.3050 -0.0737 0.0623 0.0822 251 VAL B C 8493 O O . VAL B 270 ? 1.2385 0.4646 1.2313 -0.0544 0.0540 0.0794 251 VAL B O 8494 C CB . VAL B 270 ? 1.3842 0.5424 1.3532 -0.0520 0.0668 0.1289 251 VAL B CB 8495 C CG1 . VAL B 270 ? 1.2671 0.4320 1.2249 -0.0236 0.0555 0.1548 251 VAL B CG1 8496 C CG2 . VAL B 270 ? 1.3039 0.4384 1.2833 -0.0416 0.0711 0.1137 251 VAL B CG2 8497 N N . VAL B 271 ? 1.3605 0.5473 1.3492 -0.0958 0.0689 0.0604 252 VAL B N 8498 C CA . VAL B 271 ? 1.4595 0.6498 1.4483 -0.1006 0.0686 0.0321 252 VAL B CA 8499 C C . VAL B 271 ? 1.5573 0.7137 1.5470 -0.1065 0.0767 0.0138 252 VAL B C 8500 O O . VAL B 271 ? 1.5594 0.7011 1.5532 -0.1250 0.0801 0.0104 252 VAL B O 8501 C CB . VAL B 271 ? 1.5051 0.7379 1.4912 -0.1219 0.0567 0.0163 252 VAL B CB 8502 C CG1 . VAL B 271 ? 1.4408 0.6685 1.4339 -0.1483 0.0593 0.0171 252 VAL B CG1 8503 C CG2 . VAL B 271 ? 1.6212 0.8527 1.5979 -0.1272 0.0551 -0.0136 252 VAL B CG2 8504 N N . ALA B 272 ? 1.7121 0.8563 1.6997 -0.0906 0.0813 0.0015 253 ALA B N 8505 C CA . ALA B 272 ? 1.7805 0.8909 1.7662 -0.0933 0.0898 -0.0172 253 ALA B CA 8506 C C . ALA B 272 ? 1.7977 0.9109 1.7694 -0.1075 0.0881 -0.0498 253 ALA B C 8507 O O . ALA B 272 ? 1.7860 0.9264 1.7481 -0.1136 0.0805 -0.0568 253 ALA B O 8508 C CB . ALA B 272 ? 1.8234 0.9141 1.8151 -0.0648 0.0980 -0.0096 253 ALA B CB 8509 N N . ARG B 273 ? 1.8864 0.9688 1.8531 -0.1112 0.0947 -0.0698 254 ARG B N 8510 C CA . ARG B 273 ? 1.9445 1.0229 1.8917 -0.1252 0.0911 -0.1029 254 ARG B CA 8511 C C . ARG B 273 ? 1.9037 0.9821 1.8304 -0.1082 0.0978 -0.1159 254 ARG B C 8512 O O . ARG B 273 ? 1.9184 0.9751 1.8248 -0.1102 0.1020 -0.1416 254 ARG B O 8513 C CB . ARG B 273 ? 2.0089 1.0526 1.9577 -0.1375 0.0947 -0.1211 254 ARG B CB 8514 N N . SER B 274 ? 1.8466 0.9485 1.7781 -0.0914 0.0997 -0.0987 255 SER B N 8515 C CA . SER B 274 ? 1.8049 0.9115 1.7203 -0.0760 0.1087 -0.1087 255 SER B CA 8516 C C . SER B 274 ? 1.8176 0.8952 1.7327 -0.0590 0.1262 -0.1192 255 SER B C 8517 O O . SER B 274 ? 1.7630 0.8305 1.7036 -0.0441 0.1328 -0.1043 255 SER B O 8518 C CB . SER B 274 ? 1.7440 0.8570 1.6227 -0.0914 0.1005 -0.1316 255 SER B CB 8519 O OG . SER B 274 ? 1.7255 0.8376 1.5823 -0.0762 0.1128 -0.1403 255 SER B OG 8520 N N . MET B 275 ? 1.9292 0.9922 1.8121 -0.0604 0.1335 -0.1449 256 MET B N 8521 C CA . MET B 275 ? 2.0058 1.0405 1.8835 -0.0455 0.1525 -0.1580 256 MET B CA 8522 C C . MET B 275 ? 1.9934 0.9931 1.8649 -0.0578 0.1507 -0.1741 256 MET B C 8523 O O . MET B 275 ? 1.9393 0.9227 1.7778 -0.0713 0.1464 -0.2006 256 MET B O 8524 C CB . MET B 275 ? 1.9191 0.9506 1.7590 -0.0399 0.1642 -0.1775 256 MET B CB 8525 N N . GLY B 276 ? 2.0094 0.9965 1.9114 -0.0521 0.1532 -0.1585 257 GLY B N 8526 C CA . GLY B 276 ? 2.0962 1.0497 1.9982 -0.0643 0.1522 -0.1702 257 GLY B CA 8527 C C . GLY B 276 ? 2.1625 1.1191 2.0910 -0.0734 0.1427 -0.1472 257 GLY B C 8528 O O . GLY B 276 ? 2.1989 1.1568 2.1262 -0.0972 0.1308 -0.1535 257 GLY B O 8529 N N . GLY B 277 ? 2.1601 1.1180 2.1123 -0.0537 0.1482 -0.1207 258 GLY B N 8530 C CA . GLY B 277 ? 2.1727 1.1302 2.1430 -0.0579 0.1415 -0.0952 258 GLY B CA 8531 C C . GLY B 277 ? 2.1329 1.1019 2.1221 -0.0310 0.1427 -0.0667 258 GLY B C 8532 O O . GLY B 277 ? 2.0418 1.0387 2.0353 -0.0168 0.1421 -0.0632 258 GLY B O 8533 N N . LYS B 278 ? 2.1890 1.1354 2.1892 -0.0234 0.1440 -0.0469 259 LYS B N 8534 C CA . LYS B 278 ? 2.0962 1.0485 2.1123 0.0046 0.1417 -0.0205 259 LYS B CA 8535 C C . LYS B 278 ? 1.9657 0.9585 1.9850 0.0068 0.1285 -0.0027 259 LYS B C 8536 O O . LYS B 278 ? 1.8217 0.8246 1.8327 -0.0123 0.1209 0.0053 259 LYS B O 8537 C CB . LYS B 278 ? 2.1046 1.0212 2.1232 0.0098 0.1435 -0.0014 259 LYS B CB 8538 N N . GLU B 279 ? 2.0169 1.0339 2.0510 0.0300 0.1268 0.0022 260 GLU B N 8539 C CA . GLU B 279 ? 1.8876 0.9429 1.9282 0.0356 0.1140 0.0186 260 GLU B CA 8540 C C . GLU B 279 ? 1.9304 0.9902 1.9912 0.0674 0.1063 0.0410 260 GLU B C 8541 O O . GLU B 279 ? 1.9655 1.0348 2.0233 0.0726 0.0929 0.0638 260 GLU B O 8542 C CB . GLU B 279 ? 1.7154 0.8033 1.7576 0.0315 0.1166 0.0013 260 GLU B CB 8543 C CG . GLU B 279 ? 1.7506 0.8349 1.8044 0.0469 0.1316 -0.0170 260 GLU B CG 8544 C CD . GLU B 279 ? 1.8639 0.9835 1.9237 0.0492 0.1351 -0.0266 260 GLU B CD 8545 O OE1 . GLU B 279 ? 1.8297 0.9780 1.8887 0.0418 0.1237 -0.0171 260 GLU B OE1 8546 O OE2 . GLU B 279 ? 1.9432 1.0608 2.0083 0.0583 0.1512 -0.0432 260 GLU B OE2 8547 N N . ASP B 280 ? 1.9569 1.0095 2.0375 0.0895 0.1142 0.0335 261 ASP B N 8548 C CA . ASP B 280 ? 2.0177 1.0756 2.1225 0.1222 0.1049 0.0510 261 ASP B CA 8549 C C . ASP B 280 ? 2.0135 1.0325 2.1038 0.1295 0.0987 0.0713 261 ASP B C 8550 O O . ASP B 280 ? 1.9120 0.9330 2.0089 0.1538 0.0838 0.0924 261 ASP B O 8551 C CB . ASP B 280 ? 2.1628 1.2241 2.2969 0.1425 0.1174 0.0351 261 ASP B CB 8552 C CG . ASP B 280 ? 2.3898 1.4103 2.5119 0.1345 0.1357 0.0176 261 ASP B CG 8553 O OD1 . ASP B 280 ? 2.4704 1.4719 2.5641 0.1071 0.1408 0.0080 261 ASP B OD1 8554 O OD2 . ASP B 280 ? 2.4251 1.4339 2.5685 0.1559 0.1443 0.0125 261 ASP B OD2 8555 N N . LEU B 281 ? 2.0840 1.0668 2.1542 0.1087 0.1098 0.0642 262 LEU B N 8556 C CA . LEU B 281 ? 2.1537 1.0963 2.2094 0.1113 0.1082 0.0828 262 LEU B CA 8557 C C . LEU B 281 ? 2.0411 0.9907 2.0762 0.0978 0.0978 0.1039 262 LEU B C 8558 O O . LEU B 281 ? 2.0580 0.9865 2.0817 0.1102 0.0907 0.1282 262 LEU B O 8559 C CB . LEU B 281 ? 2.2439 1.1472 2.2906 0.0923 0.1255 0.0659 262 LEU B CB 8560 C CG . LEU B 281 ? 2.2720 1.1582 2.3346 0.1072 0.1381 0.0470 262 LEU B CG 8561 C CD1 . LEU B 281 ? 2.2951 1.1425 2.3456 0.0858 0.1537 0.0288 262 LEU B CD1 8562 C CD2 . LEU B 281 ? 2.2750 1.1466 2.3534 0.1432 0.1318 0.0646 262 LEU B CD2 8563 N N . ILE B 282 ? 1.8602 0.8386 1.8891 0.0732 0.0976 0.0945 263 ILE B N 8564 C CA . ILE B 282 ? 1.7995 0.7899 1.8114 0.0595 0.0897 0.1125 263 ILE B CA 8565 C C . ILE B 282 ? 1.8035 0.8160 1.8167 0.0860 0.0716 0.1353 263 ILE B C 8566 O O . ILE B 282 ? 1.7706 0.7731 1.7653 0.0901 0.0644 0.1593 263 ILE B O 8567 C CB . ILE B 282 ? 1.6855 0.7049 1.6939 0.0289 0.0919 0.0955 263 ILE B CB 8568 C CG1 . ILE B 282 ? 1.6420 0.6382 1.6468 0.0021 0.1054 0.0733 263 ILE B CG1 8569 C CG2 . ILE B 282 ? 1.5582 0.5953 1.5527 0.0181 0.0840 0.1147 263 ILE B CG2 8570 C CD1 . ILE B 282 ? 1.5020 0.5233 1.5024 -0.0286 0.1044 0.0572 263 ILE B CD1 8571 N N . TRP B 283 ? 1.8262 0.8689 1.8621 0.1046 0.0649 0.1270 264 TRP B N 8572 C CA . TRP B 283 ? 1.8424 0.9090 1.8858 0.1323 0.0451 0.1451 264 TRP B CA 8573 C C . TRP B 283 ? 2.0226 1.0595 2.0640 0.1630 0.0353 0.1630 264 TRP B C 8574 O O . TRP B 283 ? 2.0858 1.1228 2.1119 0.1790 0.0175 0.1861 264 TRP B O 8575 C CB . TRP B 283 ? 1.7211 0.8310 1.7993 0.1442 0.0421 0.1298 264 TRP B CB 8576 C CG . TRP B 283 ? 1.6884 0.8222 1.7852 0.1777 0.0207 0.1446 264 TRP B CG 8577 C CD1 . TRP B 283 ? 1.7441 0.8865 1.8748 0.2079 0.0154 0.1404 264 TRP B CD1 8578 C CD2 . TRP B 283 ? 1.5688 0.7225 1.6521 0.1853 0.0002 0.1648 264 TRP B CD2 8579 N NE1 . TRP B 283 ? 1.7259 0.8957 1.8675 0.2337 -0.0092 0.1553 264 TRP B NE1 8580 C CE2 . TRP B 283 ? 1.6122 0.7881 1.7225 0.2208 -0.0194 0.1706 264 TRP B CE2 8581 C CE3 . TRP B 283 ? 1.4574 0.6146 1.5094 0.1658 -0.0034 0.1775 264 TRP B CE3 8582 C CZ2 . TRP B 283 ? 1.4747 0.6761 1.5784 0.2374 -0.0445 0.1876 264 TRP B CZ2 8583 C CZ3 . TRP B 283 ? 1.4452 0.6239 1.4884 0.1824 -0.0259 0.1960 264 TRP B CZ3 8584 C CH2 . TRP B 283 ? 1.4221 0.6227 1.4894 0.2180 -0.0473 0.2004 264 TRP B CH2 8585 N N . GLU B 284 ? 2.0823 1.0934 2.1375 0.1719 0.0459 0.1518 265 GLU B N 8586 C CA . GLU B 284 ? 2.0886 1.0674 2.1434 0.2013 0.0373 0.1669 265 GLU B CA 8587 C C . GLU B 284 ? 2.0168 0.9603 2.0364 0.1938 0.0351 0.1916 265 GLU B C 8588 O O . GLU B 284 ? 2.0116 0.9399 2.0219 0.2193 0.0185 0.2137 265 GLU B O 8589 C CB . GLU B 284 ? 2.1098 1.0622 2.1823 0.2054 0.0544 0.1490 265 GLU B CB 8590 N N . LEU B 285 ? 1.8856 0.8180 1.8875 0.1587 0.0522 0.1870 266 LEU B N 8591 C CA . LEU B 285 ? 1.8596 0.7646 1.8311 0.1464 0.0563 0.2087 266 LEU B CA 8592 C C . LEU B 285 ? 1.7616 0.6930 1.7152 0.1521 0.0396 0.2298 266 LEU B C 8593 O O . LEU B 285 ? 1.6862 0.6038 1.6238 0.1748 0.0265 0.2545 266 LEU B O 8594 C CB . LEU B 285 ? 1.5618 0.4566 1.5267 0.1064 0.0784 0.1939 266 LEU B CB 8595 C CG . LEU B 285 ? 1.7760 0.6518 1.7139 0.0878 0.0870 0.2132 266 LEU B CG 8596 C CD1 . LEU B 285 ? 1.6697 0.4971 1.5913 0.1064 0.0899 0.2360 266 LEU B CD1 8597 C CD2 . LEU B 285 ? 1.5827 0.4559 1.5244 0.0483 0.1062 0.1934 266 LEU B CD2 8598 N N . LEU B 286 ? 1.7464 0.7158 1.7020 0.1321 0.0399 0.2196 267 LEU B N 8599 C CA . LEU B 286 ? 1.6982 0.6931 1.6345 0.1316 0.0280 0.2370 267 LEU B CA 8600 C C . LEU B 286 ? 1.6651 0.6777 1.6044 0.1690 0.0008 0.2527 267 LEU B C 8601 O O . LEU B 286 ? 1.6924 0.7103 1.6072 0.1768 -0.0096 0.2749 267 LEU B O 8602 C CB . LEU B 286 ? 1.7211 0.7554 1.6649 0.1059 0.0321 0.2199 267 LEU B CB 8603 C CG . LEU B 286 ? 1.7458 0.7755 1.6782 0.0671 0.0512 0.2132 267 LEU B CG 8604 C CD1 . LEU B 286 ? 1.7654 0.7790 1.6666 0.0627 0.0551 0.2387 267 LEU B CD1 8605 C CD2 . LEU B 286 ? 1.7757 0.7775 1.7201 0.0491 0.0692 0.1937 267 LEU B CD2 8606 N N . ASN B 287 ? 1.6642 0.6880 1.6344 0.1925 -0.0102 0.2400 268 ASN B N 8607 C CA . ASN B 287 ? 1.7360 0.7791 1.7186 0.2299 -0.0393 0.2514 268 ASN B CA 8608 C C . ASN B 287 ? 1.7588 0.7669 1.7298 0.2524 -0.0474 0.2751 268 ASN B C 8609 O O . ASN B 287 ? 1.7399 0.7617 1.7027 0.2725 -0.0654 0.2976 268 ASN B O 8610 C CB . ASN B 287 ? 1.7691 0.8345 1.7875 0.2500 -0.0446 0.2281 268 ASN B CB 8611 C CG . ASN B 287 ? 1.6413 0.7327 1.6647 0.2905 -0.0721 0.2344 268 ASN B CG 8612 O OD1 . ASN B 287 ? 1.4673 0.5861 1.4655 0.2999 -0.0736 0.2503 268 ASN B OD1 8613 N ND2 . ASN B 287 ? 1.5260 0.6167 1.5769 0.3203 -0.0715 0.2254 268 ASN B ND2 8614 N N . GLN B 288 ? 1.7947 0.7595 1.7648 0.2493 -0.0312 0.2704 269 GLN B N 8615 C CA . GLN B 288 ? 1.8546 0.7784 1.8095 0.2684 -0.0346 0.2930 269 GLN B CA 8616 C C . GLN B 288 ? 1.9059 0.8102 1.8134 0.2523 -0.0240 0.3172 269 GLN B C 8617 O O . GLN B 288 ? 2.0176 0.9049 1.9011 0.2731 -0.0342 0.3428 269 GLN B O 8618 C CB . GLN B 288 ? 1.7910 0.6710 1.7544 0.2650 -0.0157 0.2809 269 GLN B CB 8619 N N . ALA B 289 ? 1.7987 0.7061 1.6919 0.2157 -0.0028 0.3080 270 ALA B N 8620 C CA . ALA B 289 ? 1.8763 0.7691 1.7271 0.1974 0.0102 0.3268 270 ALA B CA 8621 C C . ALA B 289 ? 1.9773 0.9033 1.8075 0.2133 -0.0105 0.3436 270 ALA B C 8622 O O . ALA B 289 ? 2.1311 1.0383 1.9189 0.2171 -0.0080 0.3668 270 ALA B O 8623 C CB . ALA B 289 ? 1.7717 0.6703 1.6240 0.1555 0.0345 0.3093 270 ALA B CB 8624 N N . GLN B 290 ? 1.9248 0.8994 1.7835 0.2231 -0.0297 0.3308 271 GLN B N 8625 C CA . GLN B 290 ? 2.0076 1.0194 1.8514 0.2403 -0.0513 0.3429 271 GLN B CA 8626 C C . GLN B 290 ? 2.2224 1.2316 2.0656 0.2813 -0.0754 0.3601 271 GLN B C 8627 O O . GLN B 290 ? 2.2396 1.2466 2.0401 0.2948 -0.0860 0.3804 271 GLN B O 8628 C CB . GLN B 290 ? 1.8329 0.8981 1.7120 0.2368 -0.0615 0.3218 271 GLN B CB 8629 C CG . GLN B 290 ? 1.7600 0.8673 1.6226 0.2521 -0.0832 0.3294 271 GLN B CG 8630 C CD . GLN B 290 ? 1.7198 0.8767 1.6178 0.2495 -0.0915 0.3069 271 GLN B CD 8631 O OE1 . GLN B 290 ? 1.5880 0.7482 1.5267 0.2415 -0.0810 0.2875 271 GLN B OE1 8632 N NE2 . GLN B 290 ? 1.7010 0.8945 1.5804 0.2555 -0.1111 0.3076 271 GLN B NE2 8633 N N . GLU B 291 ? 2.3834 1.3932 2.2734 0.3011 -0.0837 0.3505 272 GLU B N 8634 C CA . GLU B 291 ? 2.5003 1.5121 2.4023 0.3414 -0.1062 0.3645 272 GLU B CA 8635 C C . GLU B 291 ? 2.5727 1.5334 2.4197 0.3501 -0.1037 0.3920 272 GLU B C 8636 O O . GLU B 291 ? 2.5902 1.5585 2.4001 0.3695 -0.1211 0.4101 272 GLU B O 8637 C CB . GLU B 291 ? 2.5599 1.5692 2.5231 0.3560 -0.1076 0.3490 272 GLU B CB 8638 C CG . GLU B 291 ? 2.4612 1.5285 2.4855 0.3631 -0.1120 0.3263 272 GLU B CG 8639 C CD . GLU B 291 ? 2.3879 1.4576 2.4670 0.3785 -0.1101 0.3085 272 GLU B CD 8640 O OE1 . GLU B 291 ? 2.3030 1.3222 2.3736 0.3871 -0.1145 0.3153 272 GLU B OE1 8641 O OE2 . GLU B 291 ? 2.3519 1.4622 2.4521 0.3920 -0.0857 0.2903 272 GLU B OE2 8642 N N . HIS B 292 ? 2.6416 1.5487 2.4798 0.3362 -0.0815 0.3938 273 HIS B N 8643 C CA . HIS B 292 ? 2.6893 1.5422 2.4721 0.3387 -0.0705 0.4196 273 HIS B CA 8644 C C . HIS B 292 ? 2.7999 1.6553 2.5300 0.3166 -0.0585 0.4295 273 HIS B C 8645 O O . HIS B 292 ? 2.7566 1.6127 2.4864 0.2811 -0.0351 0.4173 273 HIS B O 8646 C CB . HIS B 292 ? 2.4758 1.2739 2.2613 0.3216 -0.0431 0.4154 273 HIS B CB 8647 C CG . HIS B 292 ? 2.3098 1.0927 2.1361 0.3467 -0.0535 0.4096 273 HIS B CG 8648 N ND1 . HIS B 292 ? 2.3360 1.0742 2.1719 0.3348 -0.0318 0.4002 273 HIS B ND1 8649 C CD2 . HIS B 292 ? 2.2780 1.0863 2.1410 0.3834 -0.0823 0.4107 273 HIS B CD2 8650 C CE1 . HIS B 292 ? 2.4408 1.1742 2.3137 0.3636 -0.0474 0.3957 273 HIS B CE1 8651 N NE2 . HIS B 292 ? 2.4033 1.1801 2.2970 0.3933 -0.0781 0.4021 273 HIS B NE2 8652 N N . PHE B 293 ? 2.9092 1.7664 2.5944 0.3379 -0.0749 0.4503 274 PHE B N 8653 C CA . PHE B 293 ? 2.8827 1.7437 2.5153 0.3207 -0.0653 0.4592 274 PHE B CA 8654 C C . PHE B 293 ? 2.9044 1.7099 2.4963 0.2954 -0.0284 0.4719 274 PHE B C 8655 O O . PHE B 293 ? 2.9902 1.7787 2.5255 0.2930 -0.0195 0.4891 274 PHE B O 8656 C CB . PHE B 293 ? 2.8947 1.7716 2.4862 0.3522 -0.0944 0.4749 274 PHE B CB 8657 C CG . PHE B 293 ? 2.7559 1.7002 2.3788 0.3633 -0.1242 0.4579 274 PHE B CG 8658 C CD1 . PHE B 293 ? 2.6703 1.6472 2.2719 0.3464 -0.1244 0.4512 274 PHE B CD1 8659 C CD2 . PHE B 293 ? 2.6689 1.6446 2.3453 0.3906 -0.1504 0.4476 274 PHE B CD2 8660 C CE1 . PHE B 293 ? 2.5273 1.5646 2.1572 0.3561 -0.1515 0.4341 274 PHE B CE1 8661 C CE2 . PHE B 293 ? 2.5081 1.5468 2.2159 0.4001 -0.1756 0.4301 274 PHE B CE2 8662 C CZ . PHE B 293 ? 2.4476 1.5161 2.1306 0.3825 -0.1769 0.4231 274 PHE B CZ 8663 N N . GLY B 294 ? 2.7808 1.5587 2.4028 0.2765 -0.0061 0.4617 275 GLY B N 8664 C CA . GLY B 294 ? 2.6842 1.4201 2.2843 0.2454 0.0318 0.4659 275 GLY B CA 8665 C C . GLY B 294 ? 2.5419 1.3137 2.1530 0.2095 0.0463 0.4490 275 GLY B C 8666 O O . GLY B 294 ? 2.4991 1.2502 2.0954 0.1803 0.0770 0.4505 275 GLY B O 8667 N N . LYS B 295 ? 2.4927 1.3194 2.1335 0.2122 0.0242 0.4324 276 LYS B N 8668 C CA . LYS B 295 ? 2.4677 1.3340 2.1160 0.1838 0.0318 0.4181 276 LYS B CA 8669 C C . LYS B 295 ? 2.5671 1.4463 2.1659 0.1915 0.0253 0.4345 276 LYS B C 8670 O O . LYS B 295 ? 2.7661 1.6081 2.3159 0.2018 0.0336 0.4570 276 LYS B O 8671 C CB . LYS B 295 ? 2.2945 1.2106 1.9921 0.1856 0.0118 0.3940 276 LYS B CB 8672 N N . ASP B 296 ? 2.4220 1.3517 2.0308 0.1872 0.0111 0.4227 277 ASP B N 8673 C CA . ASP B 296 ? 2.4432 1.3889 2.0056 0.1938 0.0036 0.4343 277 ASP B CA 8674 C C . ASP B 296 ? 2.5155 1.4782 2.0610 0.2340 -0.0337 0.4424 277 ASP B C 8675 O O . ASP B 296 ? 2.5471 1.5076 2.1191 0.2577 -0.0522 0.4413 277 ASP B O 8676 C CB . ASP B 296 ? 2.3115 1.3022 1.8903 0.1686 0.0072 0.4172 277 ASP B CB 8677 N N . LYS B 297 ? 2.5135 1.4942 2.0166 0.2412 -0.0444 0.4488 278 LYS B N 8678 C CA . LYS B 297 ? 2.4577 1.4577 1.9387 0.2777 -0.0815 0.4541 278 LYS B CA 8679 C C . LYS B 297 ? 2.4579 1.4106 1.9014 0.3062 -0.0872 0.4766 278 LYS B C 8680 O O . LYS B 297 ? 2.4707 1.4373 1.9071 0.3395 -0.1209 0.4794 278 LYS B O 8681 C CB . LYS B 297 ? 1.7272 0.7806 1.2674 0.2914 -0.1127 0.4329 278 LYS B CB 8682 N N . SER B 298 ? 2.4196 1.3170 1.8391 0.2931 -0.0546 0.4916 279 SER B N 8683 C CA . SER B 298 ? 2.5549 1.3994 1.9348 0.3184 -0.0554 0.5146 279 SER B CA 8684 C C . SER B 298 ? 2.7381 1.5220 2.0840 0.2975 -0.0123 0.5305 279 SER B C 8685 O O . SER B 298 ? 2.7554 1.5410 2.1161 0.2619 0.0184 0.5219 279 SER B O 8686 C CB . SER B 298 ? 2.5541 1.3984 1.9830 0.3405 -0.0753 0.5107 279 SER B CB 8687 O OG . SER B 298 ? 2.1673 0.9537 1.5632 0.3597 -0.0695 0.5327 279 SER B OG 8688 N N . LYS B 299 ? 2.8984 1.6296 2.2011 0.3204 -0.0104 0.5530 280 LYS B N 8689 C CA . LYS B 299 ? 2.9827 1.6515 2.2483 0.3049 0.0307 0.5703 280 LYS B CA 8690 C C . LYS B 299 ? 3.0757 1.7201 2.3922 0.2849 0.0537 0.5629 280 LYS B C 8691 O O . LYS B 299 ? 3.1219 1.7606 2.4706 0.3035 0.0359 0.5608 280 LYS B O 8692 C CB . LYS B 299 ? 2.9393 1.5565 2.1339 0.3387 0.0244 0.5980 280 LYS B CB 8693 N N . GLU B 300 ? 3.0911 1.7217 2.4157 0.2474 0.0932 0.5576 281 GLU B N 8694 C CA . GLU B 300 ? 3.0537 1.6628 2.4259 0.2227 0.1180 0.5465 281 GLU B CA 8695 C C . GLU B 300 ? 3.0761 1.7307 2.5194 0.2158 0.0983 0.5192 281 GLU B C 8696 O O . GLU B 300 ? 3.1115 1.7764 2.5744 0.2437 0.0682 0.5174 281 GLU B O 8697 C CB . GLU B 300 ? 2.9776 1.5206 2.3269 0.2409 0.1282 0.5662 281 GLU B CB 8698 N N . PHE B 301 ? 2.9970 1.6787 2.4799 0.1791 0.1159 0.4974 282 PHE B N 8699 C CA . PHE B 301 ? 2.9485 1.6215 2.4164 0.1464 0.1514 0.4983 282 PHE B CA 8700 C C . PHE B 301 ? 2.6947 1.4271 2.1855 0.1250 0.1466 0.4796 282 PHE B C 8701 O O . PHE B 301 ? 2.6025 1.3444 2.1181 0.0898 0.1722 0.4663 282 PHE B O 8702 C CB . PHE B 301 ? 3.0241 1.6636 2.5231 0.1179 0.1842 0.4893 282 PHE B CB 8703 N N . GLN B 302 ? 2.6372 1.4092 2.1205 0.1471 0.1133 0.4786 283 GLN B N 8704 C CA . GLN B 302 ? 2.5910 1.4215 2.0972 0.1326 0.1026 0.4605 283 GLN B CA 8705 C C . GLN B 302 ? 2.5063 1.3610 2.0715 0.0971 0.1163 0.4340 283 GLN B C 8706 O O . GLN B 302 ? 2.5161 1.3680 2.0886 0.0656 0.1451 0.4286 283 GLN B O 8707 C CB . GLN B 302 ? 2.6124 1.4519 2.0717 0.1288 0.1113 0.4714 283 GLN B CB 8708 C CG . GLN B 302 ? 2.7060 1.5034 2.1352 0.1098 0.1518 0.4848 283 GLN B CG 8709 C CD . GLN B 302 ? 2.6843 1.4906 2.0658 0.1094 0.1601 0.4946 283 GLN B CD 8710 O OE1 . GLN B 302 ? 2.5311 1.3838 1.9159 0.1106 0.1413 0.4848 283 GLN B OE1 8711 N NE2 . GLN B 302 ? 2.7736 1.5336 2.1092 0.1082 0.1898 0.5136 283 GLN B NE2 8712 N N . LEU B 303 ? 2.3730 1.2521 1.9806 0.1035 0.0952 0.4164 284 LEU B N 8713 C CA . LEU B 303 ? 2.2086 1.1085 1.8690 0.0744 0.1039 0.3893 284 LEU B CA 8714 C C . LEU B 303 ? 2.0002 0.9380 1.6705 0.0452 0.1140 0.3771 284 LEU B C 8715 O O . LEU B 303 ? 1.9228 0.8589 1.6168 0.0128 0.1375 0.3644 284 LEU B O 8716 C CB . LEU B 303 ? 2.0958 1.0222 1.7914 0.0915 0.0765 0.3735 284 LEU B CB 8717 N N . PHE B 304 ? 1.8860 0.8594 1.5404 0.0575 0.0950 0.3801 285 PHE B N 8718 C CA . PHE B 304 ? 1.9541 0.9691 1.6220 0.0338 0.0993 0.3668 285 PHE B CA 8719 C C . PHE B 304 ? 2.0158 1.0207 1.6634 0.0111 0.1286 0.3752 285 PHE B C 8720 O O . PHE B 304 ? 1.8927 0.9189 1.5706 -0.0202 0.1442 0.3594 285 PHE B O 8721 C CB . PHE B 304 ? 2.0720 1.1254 1.7277 0.0557 0.0698 0.3672 285 PHE B CB 8722 C CG . PHE B 304 ? 2.1246 1.1912 1.8064 0.0785 0.0427 0.3578 285 PHE B CG 8723 C CD1 . PHE B 304 ? 2.1109 1.1743 1.8365 0.0669 0.0472 0.3392 285 PHE B CD1 8724 C CD2 . PHE B 304 ? 2.1269 1.2103 1.7915 0.1118 0.0129 0.3655 285 PHE B CD2 8725 C CE1 . PHE B 304 ? 2.0008 1.0755 1.7524 0.0881 0.0259 0.3297 285 PHE B CE1 8726 C CE2 . PHE B 304 ? 2.0418 1.1404 1.7383 0.1329 -0.0103 0.3554 285 PHE B CE2 8727 C CZ . PHE B 304 ? 1.9645 1.0577 1.7047 0.1211 -0.0021 0.3382 285 PHE B CZ 8728 N N . SER B 305 ? 2.2448 1.2173 1.8425 0.0273 0.1363 0.3992 286 SER B N 8729 C CA . SER B 305 ? 2.3885 1.3469 1.9644 0.0082 0.1678 0.4084 286 SER B CA 8730 C C . SER B 305 ? 2.4895 1.4071 2.0811 -0.0118 0.1990 0.4090 286 SER B C 8731 O O . SER B 305 ? 2.4511 1.3351 2.0445 0.0001 0.1961 0.4131 286 SER B O 8732 C CB . SER B 305 ? 2.4544 1.3942 1.9634 0.0344 0.1644 0.4329 286 SER B CB 8733 O OG . SER B 305 ? 2.4582 1.3847 1.9460 0.0162 0.1978 0.4407 286 SER B OG 8734 N N . SER B 306 ? 2.5693 1.4911 2.1751 -0.0418 0.2291 0.4038 287 SER B N 8735 C CA . SER B 306 ? 2.6630 1.5503 2.2895 -0.0639 0.2606 0.4017 287 SER B CA 8736 C C . SER B 306 ? 2.6541 1.5098 2.2425 -0.0677 0.2940 0.4213 287 SER B C 8737 O O . SER B 306 ? 2.6671 1.5441 2.2356 -0.0696 0.2999 0.4257 287 SER B O 8738 C CB . SER B 306 ? 2.6711 1.5932 2.3644 -0.1003 0.2677 0.3718 287 SER B CB 8739 O OG . SER B 306 ? 2.6441 1.6118 2.3500 -0.1159 0.2698 0.3630 287 SER B OG 8740 N N . PRO B 307 ? 2.6033 1.4057 2.1803 -0.0683 0.3178 0.4329 288 PRO B N 8741 C CA . PRO B 307 ? 2.7320 1.4967 2.2713 -0.0713 0.3540 0.4523 288 PRO B CA 8742 C C . PRO B 307 ? 2.7771 1.5660 2.3595 -0.1088 0.3855 0.4368 288 PRO B C 8743 O O . PRO B 307 ? 2.7509 1.5278 2.3044 -0.1117 0.4125 0.4494 288 PRO B O 8744 C CB . PRO B 307 ? 2.7806 1.4842 2.3096 -0.0648 0.3693 0.4640 288 PRO B CB 8745 C CG . PRO B 307 ? 2.7096 1.4289 2.2963 -0.0765 0.3527 0.4406 288 PRO B CG 8746 C CD . PRO B 307 ? 2.5576 1.3298 2.1559 -0.0655 0.3134 0.4282 288 PRO B CD 8747 N N . HIS B 308 ? 2.8015 1.6244 2.4527 -0.1363 0.3814 0.4089 289 HIS B N 8748 C CA . HIS B 308 ? 2.7543 1.6062 2.4570 -0.1722 0.4068 0.3906 289 HIS B CA 8749 C C . HIS B 308 ? 2.5460 1.4646 2.2992 -0.1881 0.3824 0.3635 289 HIS B C 8750 O O . HIS B 308 ? 2.4208 1.3601 2.2328 -0.2118 0.3790 0.3380 289 HIS B O 8751 C CB . HIS B 308 ? 2.8376 1.6594 2.5806 -0.1956 0.4333 0.3808 289 HIS B CB 8752 C CG . HIS B 308 ? 2.8535 1.6582 2.6129 -0.1900 0.4130 0.3715 289 HIS B CG 8753 N ND1 . HIS B 308 ? 2.9227 1.6670 2.6530 -0.1749 0.4232 0.3883 289 HIS B ND1 8754 C CD2 . HIS B 308 ? 2.7662 1.6046 2.5666 -0.1965 0.3841 0.3468 289 HIS B CD2 8755 C CE1 . HIS B 308 ? 2.8967 1.6394 2.6515 -0.1726 0.4018 0.3738 289 HIS B CE1 8756 N NE2 . HIS B 308 ? 2.8397 1.6383 2.6358 -0.1856 0.3783 0.3483 289 HIS B NE2 8757 N N . GLY B 309 ? 2.5037 1.4542 2.2313 -0.1744 0.3651 0.3686 290 GLY B N 8758 C CA . GLY B 309 ? 2.4731 1.4847 2.2422 -0.1872 0.3433 0.3457 290 GLY B CA 8759 C C . GLY B 309 ? 2.5032 1.5350 2.2353 -0.1599 0.3106 0.3533 290 GLY B C 8760 O O . GLY B 309 ? 2.5747 1.5755 2.2501 -0.1298 0.3014 0.3754 290 GLY B O 8761 N N . LYS B 310 ? 2.4265 1.5110 2.1920 -0.1701 0.2921 0.3342 291 LYS B N 8762 C CA . LYS B 310 ? 2.3679 1.4763 2.1070 -0.1472 0.2610 0.3376 291 LYS B CA 8763 C C . LYS B 310 ? 2.2912 1.4300 2.0734 -0.1533 0.2343 0.3141 291 LYS B C 8764 O O . LYS B 310 ? 2.2879 1.4563 2.1233 -0.1807 0.2380 0.2908 291 LYS B O 8765 C CB . LYS B 310 ? 2.3028 1.4444 2.0304 -0.1504 0.2665 0.3395 291 LYS B CB 8766 N N . ASP B 311 ? 2.1882 1.3200 1.9476 -0.1266 0.2072 0.3195 292 ASP B N 8767 C CA . ASP B 311 ? 1.8833 1.0368 1.6771 -0.1282 0.1836 0.2986 292 ASP B CA 8768 C C . ASP B 311 ? 1.8835 1.0254 1.7217 -0.1511 0.1937 0.2795 292 ASP B C 8769 O O . ASP B 311 ? 1.7686 0.9413 1.6499 -0.1713 0.1869 0.2542 292 ASP B O 8770 C CB . ASP B 311 ? 1.4184 0.6238 1.2324 -0.1375 0.1702 0.2834 292 ASP B CB 8771 C CG . ASP B 311 ? 1.5246 0.7412 1.2930 -0.1141 0.1583 0.3003 292 ASP B CG 8772 O OD1 . ASP B 311 ? 1.5750 0.7643 1.2998 -0.0841 0.1474 0.3193 292 ASP B OD1 8773 O OD2 . ASP B 311 ? 1.5876 0.8408 1.3638 -0.1245 0.1581 0.2935 292 ASP B OD2 8774 N N . LEU B 312 ? 1.9394 1.0353 1.7641 -0.1468 0.2089 0.2913 293 LEU B N 8775 C CA . LEU B 312 ? 1.9672 1.0459 1.8293 -0.1680 0.2211 0.2745 293 LEU B CA 8776 C C . LEU B 312 ? 1.9320 1.0156 1.8172 -0.1645 0.1994 0.2544 293 LEU B C 8777 O O . LEU B 312 ? 1.8506 0.9653 1.7752 -0.1851 0.1924 0.2278 293 LEU B O 8778 C CB . LEU B 312 ? 2.0055 1.0287 1.8421 -0.1609 0.2432 0.2943 293 LEU B CB 8779 N N . LEU B 313 ? 1.9224 0.9748 1.7824 -0.1373 0.1888 0.2665 294 LEU B N 8780 C CA . LEU B 313 ? 1.8800 0.9318 1.7592 -0.1307 0.1716 0.2486 294 LEU B CA 8781 C C . LEU B 313 ? 1.9524 1.0374 1.8261 -0.1122 0.1458 0.2458 294 LEU B C 8782 O O . LEU B 313 ? 1.8869 0.9959 1.7871 -0.1201 0.1341 0.2223 294 LEU B O 8783 C CB . LEU B 313 ? 1.9001 0.9016 1.7621 -0.1109 0.1749 0.2612 294 LEU B CB 8784 C CG . LEU B 313 ? 1.9759 0.9673 1.8628 -0.1103 0.1664 0.2398 294 LEU B CG 8785 C CD1 . LEU B 313 ? 1.9797 0.9817 1.9056 -0.1451 0.1766 0.2110 294 LEU B CD1 8786 C CD2 . LEU B 313 ? 2.0436 0.9834 1.9124 -0.0895 0.1718 0.2550 294 LEU B CD2 8787 N N . PHE B 314 ? 2.0203 1.1051 1.8578 -0.0870 0.1370 0.2690 295 PHE B N 8788 C CA . PHE B 314 ? 1.7354 0.8533 1.5668 -0.0695 0.1135 0.2680 295 PHE B CA 8789 C C . PHE B 314 ? 1.7905 0.9284 1.5953 -0.0684 0.1151 0.2828 295 PHE B C 8790 O O . PHE B 314 ? 1.8054 0.9244 1.5889 -0.0734 0.1334 0.2982 295 PHE B O 8791 C CB . PHE B 314 ? 1.6308 0.7308 1.4451 -0.0334 0.0949 0.2797 295 PHE B CB 8792 C CG . PHE B 314 ? 1.7805 0.8601 1.6194 -0.0309 0.0939 0.2653 295 PHE B CG 8793 C CD1 . PHE B 314 ? 1.8300 0.9276 1.7037 -0.0513 0.0947 0.2372 295 PHE B CD1 8794 C CD2 . PHE B 314 ? 1.9172 0.9588 1.7425 -0.0072 0.0919 0.2793 295 PHE B CD2 8795 C CE1 . PHE B 314 ? 1.9574 1.0347 1.8494 -0.0484 0.0950 0.2227 295 PHE B CE1 8796 C CE2 . PHE B 314 ? 2.0170 1.0388 1.8647 -0.0044 0.0923 0.2654 295 PHE B CE2 8797 C CZ . PHE B 314 ? 2.0192 1.0586 1.8992 -0.0251 0.0946 0.2367 295 PHE B CZ 8798 N N . LYS B 315 ? 1.8757 1.0497 1.6801 -0.0617 0.0974 0.2775 296 LYS B N 8799 C CA . LYS B 315 ? 1.8235 1.0165 1.5992 -0.0579 0.0964 0.2902 296 LYS B CA 8800 C C . LYS B 315 ? 1.8594 1.0260 1.5862 -0.0270 0.0902 0.3165 296 LYS B C 8801 O O . LYS B 315 ? 1.8205 0.9748 1.5394 0.0000 0.0714 0.3219 296 LYS B O 8802 C CB . LYS B 315 ? 1.6891 0.9222 1.4721 -0.0546 0.0759 0.2781 296 LYS B CB 8803 N N . ASP B 316 ? 1.9502 1.1089 1.6454 -0.0305 0.1059 0.3317 297 ASP B N 8804 C CA . ASP B 316 ? 2.0178 1.1492 1.6597 -0.0024 0.1014 0.3561 297 ASP B CA 8805 C C . ASP B 316 ? 1.8653 1.0190 1.4823 0.0281 0.0682 0.3598 297 ASP B C 8806 O O . ASP B 316 ? 1.7996 0.9345 1.3791 0.0572 0.0542 0.3757 297 ASP B O 8807 C CB . ASP B 316 ? 2.0626 1.1815 1.6740 -0.0144 0.1286 0.3690 297 ASP B CB 8808 C CG . ASP B 316 ? 2.1455 1.2273 1.7671 -0.0332 0.1600 0.3730 297 ASP B CG 8809 O OD1 . ASP B 316 ? 2.1550 1.2382 1.8238 -0.0534 0.1664 0.3563 297 ASP B OD1 8810 O OD2 . ASP B 316 ? 2.2629 1.3129 1.8437 -0.0274 0.1785 0.3918 297 ASP B OD2 8811 N N . SER B 317 ? 1.6046 0.7991 1.2432 0.0215 0.0544 0.3438 298 SER B N 8812 C CA . SER B 317 ? 1.6369 0.8575 1.2572 0.0475 0.0219 0.3432 298 SER B CA 8813 C C . SER B 317 ? 1.5543 0.7760 1.1953 0.0718 -0.0047 0.3378 298 SER B C 8814 O O . SER B 317 ? 1.4466 0.6891 1.0780 0.0974 -0.0351 0.3367 298 SER B O 8815 C CB . SER B 317 ? 1.7535 1.0144 1.3893 0.0306 0.0168 0.3274 298 SER B CB 8816 O OG . SER B 317 ? 1.7817 1.0787 1.4117 0.0534 -0.0175 0.3211 298 SER B OG 8817 N N . ALA B 318 ? 1.5132 0.7143 1.1861 0.0634 0.0068 0.3322 299 ALA B N 8818 C CA . ALA B 318 ? 1.5963 0.7991 1.2979 0.0830 -0.0131 0.3238 299 ALA B CA 8819 C C . ALA B 318 ? 1.6256 0.8200 1.3052 0.1213 -0.0370 0.3381 299 ALA B C 8820 O O . ALA B 318 ? 1.6485 0.8188 1.2869 0.1312 -0.0323 0.3573 299 ALA B O 8821 C CB . ALA B 318 ? 1.6397 0.8167 1.3741 0.0663 0.0071 0.3154 299 ALA B CB 8822 N N . HIS B 319 ? 1.5621 0.7779 1.2709 0.1424 -0.0629 0.3271 300 HIS B N 8823 C CA . HIS B 319 ? 1.6164 0.8327 1.3180 0.1793 -0.0890 0.3360 300 HIS B CA 8824 C C . HIS B 319 ? 1.6891 0.8939 1.4339 0.1918 -0.0912 0.3292 300 HIS B C 8825 O O . HIS B 319 ? 1.6843 0.8929 1.4368 0.2228 -0.1127 0.3335 300 HIS B O 8826 C CB . HIS B 319 ? 1.6104 0.8743 1.3146 0.1969 -0.1230 0.3262 300 HIS B CB 8827 C CG . HIS B 319 ? 1.7318 1.0043 1.3867 0.1940 -0.1257 0.3348 300 HIS B CG 8828 N ND1 . HIS B 319 ? 1.8289 1.0753 1.4481 0.1710 -0.0956 0.3469 300 HIS B ND1 8829 C CD2 . HIS B 319 ? 1.7963 1.1014 1.4342 0.2106 -0.1540 0.3310 300 HIS B CD2 8830 C CE1 . HIS B 319 ? 1.9121 1.1722 1.4913 0.1749 -0.1034 0.3514 300 HIS B CE1 8831 N NE2 . HIS B 319 ? 1.8959 1.1909 1.4836 0.1987 -0.1395 0.3416 300 HIS B NE2 8832 N N . GLY B 320 ? 1.7107 0.9029 1.4846 0.1675 -0.0688 0.3169 301 GLY B N 8833 C CA . GLY B 320 ? 1.7362 0.9150 1.5507 0.1759 -0.0663 0.3077 301 GLY B CA 8834 C C . GLY B 320 ? 1.6018 0.7956 1.4540 0.1542 -0.0567 0.2827 301 GLY B C 8835 O O . GLY B 320 ? 1.4787 0.6898 1.3248 0.1290 -0.0502 0.2738 301 GLY B O 8836 N N . PHE B 321 ? 1.6159 0.8036 1.5067 0.1642 -0.0559 0.2706 302 PHE B N 8837 C CA . PHE B 321 ? 1.5836 0.7849 1.5087 0.1430 -0.0435 0.2450 302 PHE B CA 8838 C C . PHE B 321 ? 1.5830 0.8277 1.5588 0.1605 -0.0595 0.2264 302 PHE B C 8839 O O . PHE B 321 ? 1.5512 0.7915 1.5405 0.1932 -0.0769 0.2334 302 PHE B O 8840 C CB . PHE B 321 ? 1.7433 0.9018 1.6727 0.1263 -0.0181 0.2397 302 PHE B CB 8841 C CG . PHE B 321 ? 1.9063 1.0391 1.8032 0.1030 -0.0015 0.2518 302 PHE B CG 8842 C CD1 . PHE B 321 ? 1.9407 1.0860 1.8325 0.0697 0.0129 0.2425 302 PHE B CD1 8843 C CD2 . PHE B 321 ? 1.9741 1.0713 1.8491 0.1146 0.0007 0.2718 302 PHE B CD2 8844 C CE1 . PHE B 321 ? 1.9659 1.0911 1.8363 0.0482 0.0298 0.2518 302 PHE B CE1 8845 C CE2 . PHE B 321 ? 2.0575 1.1305 1.9056 0.0930 0.0196 0.2823 302 PHE B CE2 8846 C CZ . PHE B 321 ? 2.0377 1.1262 1.8863 0.0595 0.0345 0.2717 302 PHE B CZ 8847 N N . LEU B 322 ? 1.5383 0.8243 1.5429 0.1390 -0.0528 0.2025 303 LEU B N 8848 C CA . LEU B 322 ? 1.3321 0.6559 1.3869 0.1502 -0.0592 0.1827 303 LEU B CA 8849 C C . LEU B 322 ? 1.4039 0.7179 1.4757 0.1298 -0.0341 0.1617 303 LEU B C 8850 O O . LEU B 322 ? 1.5397 0.8425 1.5892 0.1014 -0.0192 0.1566 303 LEU B O 8851 C CB . LEU B 322 ? 1.1204 0.5068 1.1906 0.1471 -0.0766 0.1739 303 LEU B CB 8852 C CG . LEU B 322 ? 1.2273 0.6325 1.2892 0.1712 -0.1064 0.1881 303 LEU B CG 8853 C CD1 . LEU B 322 ? 1.1839 0.6483 1.2608 0.1620 -0.1194 0.1760 303 LEU B CD1 8854 C CD2 . LEU B 322 ? 1.1997 0.6006 1.2946 0.2068 -0.1228 0.1902 303 LEU B CD2 8855 N N . LYS B 323 ? 1.3287 0.6465 1.4402 0.1451 -0.0298 0.1483 304 LYS B N 8856 C CA . LYS B 323 ? 1.2444 0.5501 1.3677 0.1291 -0.0055 0.1269 304 LYS B CA 8857 C C . LYS B 323 ? 1.2318 0.5859 1.3678 0.1118 -0.0030 0.1078 304 LYS B C 8858 O O . LYS B 323 ? 1.2054 0.6035 1.3720 0.1237 -0.0150 0.1039 304 LYS B O 8859 C CB . LYS B 323 ? 1.1255 0.4114 1.2848 0.1535 0.0025 0.1202 304 LYS B CB 8860 N N . VAL B 324 ? 1.2449 0.5897 1.3578 0.0842 0.0120 0.0956 305 VAL B N 8861 C CA . VAL B 324 ? 1.2197 0.6011 1.3378 0.0693 0.0167 0.0777 305 VAL B CA 8862 C C . VAL B 324 ? 1.3282 0.7084 1.4766 0.0807 0.0328 0.0604 305 VAL B C 8863 O O . VAL B 324 ? 1.5030 0.8423 1.6486 0.0825 0.0493 0.0527 305 VAL B O 8864 C CB . VAL B 324 ? 1.0884 0.4574 1.1718 0.0391 0.0256 0.0682 305 VAL B CB 8865 C CG1 . VAL B 324 ? 1.2054 0.6051 1.2891 0.0279 0.0310 0.0500 305 VAL B CG1 8866 C CG2 . VAL B 324 ? 0.9745 0.3492 1.0342 0.0263 0.0135 0.0839 305 VAL B CG2 8867 N N . PRO B 325 ? 1.1494 0.5729 1.3284 0.0882 0.0301 0.0535 306 PRO B N 8868 C CA . PRO B 325 ? 1.1660 0.5934 1.3792 0.0992 0.0489 0.0372 306 PRO B CA 8869 C C . PRO B 325 ? 1.3915 0.7851 1.5763 0.0840 0.0742 0.0195 306 PRO B C 8870 O O . PRO B 325 ? 1.4190 0.8047 1.5624 0.0617 0.0734 0.0162 306 PRO B O 8871 C CB . PRO B 325 ? 1.1806 0.6604 1.4173 0.0978 0.0434 0.0329 306 PRO B CB 8872 C CG . PRO B 325 ? 1.1855 0.6900 1.4185 0.1000 0.0149 0.0499 306 PRO B CG 8873 C CD . PRO B 325 ? 1.0785 0.5490 1.2630 0.0864 0.0106 0.0609 306 PRO B CD 8874 N N . PRO B 326 ? 1.5364 0.9099 1.7439 0.0970 0.0957 0.0071 307 PRO B N 8875 C CA . PRO B 326 ? 1.5943 0.9280 1.7725 0.0869 0.1209 -0.0114 307 PRO B CA 8876 C C . PRO B 326 ? 1.5679 0.9130 1.7100 0.0668 0.1286 -0.0241 307 PRO B C 8877 O O . PRO B 326 ? 1.4858 0.8048 1.5817 0.0485 0.1294 -0.0320 307 PRO B O 8878 C CB . PRO B 326 ? 1.5953 0.9228 1.8177 0.1090 0.1427 -0.0212 307 PRO B CB 8879 C CG . PRO B 326 ? 1.5266 0.8738 1.7978 0.1320 0.1239 -0.0051 307 PRO B CG 8880 C CD . PRO B 326 ? 1.4718 0.8601 1.7378 0.1244 0.0961 0.0093 307 PRO B CD 8881 N N . ARG B 327 ? 1.5225 0.9052 1.6868 0.0709 0.1334 -0.0264 308 ARG B N 8882 C CA . ARG B 327 ? 1.4819 0.8706 1.6117 0.0566 0.1448 -0.0376 308 ARG B CA 8883 C C . ARG B 327 ? 1.3143 0.7224 1.4094 0.0376 0.1219 -0.0302 308 ARG B C 8884 O O . ARG B 327 ? 1.3121 0.7323 1.3819 0.0279 0.1256 -0.0358 308 ARG B O 8885 C CB . ARG B 327 ? 1.5526 0.9727 1.7217 0.0671 0.1607 -0.0410 308 ARG B CB 8886 C CG . ARG B 327 ? 1.6241 1.0242 1.7617 0.0625 0.1914 -0.0572 308 ARG B CG 8887 C CD . ARG B 327 ? 1.5286 0.9558 1.6455 0.0513 0.1884 -0.0548 308 ARG B CD 8888 N NE . ARG B 327 ? 1.5381 0.9490 1.5887 0.0338 0.1753 -0.0571 308 ARG B NE 8889 C CZ . ARG B 327 ? 1.4550 0.8414 1.4517 0.0272 0.1908 -0.0686 308 ARG B CZ 8890 N NH1 . ARG B 327 ? 1.3674 0.7392 1.3644 0.0361 0.2242 -0.0774 308 ARG B NH1 8891 N NH2 . ARG B 327 ? 1.4335 0.8096 1.3760 0.0127 0.1731 -0.0715 308 ARG B NH2 8892 N N . MET B 328 ? 1.2262 0.6350 1.3198 0.0331 0.0999 -0.0172 309 MET B N 8893 C CA . MET B 328 ? 1.1720 0.6005 1.2396 0.0158 0.0796 -0.0099 309 MET B CA 8894 C C . MET B 328 ? 1.2372 0.6333 1.2608 -0.0030 0.0785 -0.0194 309 MET B C 8895 O O . MET B 328 ? 1.3995 0.7653 1.4208 -0.0052 0.0773 -0.0175 309 MET B O 8896 C CB . MET B 328 ? 1.0897 0.5386 1.1794 0.0213 0.0581 0.0101 309 MET B CB 8897 C CG . MET B 328 ? 0.9845 0.4580 1.0534 0.0053 0.0395 0.0185 309 MET B CG 8898 S SD . MET B 328 ? 1.3778 0.9062 1.4689 0.0101 0.0290 0.0244 309 MET B SD 8899 C CE . MET B 328 ? 0.7773 0.3182 0.9112 0.0329 0.0161 0.0391 309 MET B CE 8900 N N . ASP B 329 ? 1.1802 0.5816 1.1701 -0.0159 0.0784 -0.0305 310 ASP B N 8901 C CA . ASP B 329 ? 1.1843 0.5650 1.1370 -0.0350 0.0705 -0.0411 310 ASP B CA 8902 C C . ASP B 329 ? 1.1771 0.5894 1.1310 -0.0480 0.0484 -0.0291 310 ASP B C 8903 O O . ASP B 329 ? 1.1839 0.6302 1.1608 -0.0414 0.0405 -0.0136 310 ASP B O 8904 C CB . ASP B 329 ? 1.2726 0.6397 1.1836 -0.0397 0.0791 -0.0606 310 ASP B CB 8905 C CG . ASP B 329 ? 1.3727 0.7730 1.2796 -0.0353 0.0797 -0.0563 310 ASP B CG 8906 O OD1 . ASP B 329 ? 1.2679 0.7008 1.1757 -0.0434 0.0613 -0.0473 310 ASP B OD1 8907 O OD2 . ASP B 329 ? 1.4278 0.8196 1.3313 -0.0238 0.1008 -0.0621 310 ASP B OD2 8908 N N . ALA B 330 ? 1.1086 0.5105 1.0400 -0.0664 0.0387 -0.0381 311 ALA B N 8909 C CA . ALA B 330 ? 1.0503 0.4805 0.9867 -0.0799 0.0207 -0.0282 311 ALA B CA 8910 C C . ALA B 330 ? 1.0376 0.5109 0.9719 -0.0784 0.0111 -0.0227 311 ALA B C 8911 O O . ALA B 330 ? 0.9872 0.4896 0.9411 -0.0761 0.0030 -0.0063 311 ALA B O 8912 C CB . ALA B 330 ? 0.9192 0.3326 0.8390 -0.1005 0.0130 -0.0431 311 ALA B CB 8913 N N . LYS B 331 ? 1.0002 0.4740 0.9071 -0.0788 0.0126 -0.0363 312 LYS B N 8914 C CA . LYS B 331 ? 1.0319 0.5411 0.9330 -0.0777 0.0043 -0.0316 312 LYS B CA 8915 C C . LYS B 331 ? 0.9269 0.4600 0.8559 -0.0630 0.0113 -0.0170 312 LYS B C 8916 O O . LYS B 331 ? 0.8512 0.4181 0.7913 -0.0635 0.0012 -0.0067 312 LYS B O 8917 C CB . LYS B 331 ? 1.1345 0.6316 0.9937 -0.0780 0.0059 -0.0479 312 LYS B CB 8918 C CG . LYS B 331 ? 1.2756 0.7391 1.1171 -0.0661 0.0286 -0.0576 312 LYS B CG 8919 C CD . LYS B 331 ? 1.3464 0.7908 1.1345 -0.0661 0.0293 -0.0736 312 LYS B CD 8920 C CE . LYS B 331 ? 1.3512 0.7835 1.1149 -0.0808 0.0090 -0.0895 312 LYS B CE 8921 N NZ . LYS B 331 ? 1.4060 0.8140 1.1107 -0.0780 0.0069 -0.1072 312 LYS B NZ 8922 N N . MET B 332 ? 0.9045 0.4205 0.8485 -0.0498 0.0280 -0.0175 313 MET B N 8923 C CA . MET B 332 ? 0.9126 0.4525 0.8927 -0.0358 0.0327 -0.0063 313 MET B CA 8924 C C . MET B 332 ? 0.9608 0.5173 0.9683 -0.0341 0.0180 0.0095 313 MET B C 8925 O O . MET B 332 ? 0.9767 0.5624 1.0101 -0.0259 0.0121 0.0192 313 MET B O 8926 C CB . MET B 332 ? 0.9844 0.5031 0.9804 -0.0215 0.0547 -0.0126 313 MET B CB 8927 C CG . MET B 332 ? 0.9463 0.4937 0.9847 -0.0079 0.0605 -0.0059 313 MET B CG 8928 S SD . MET B 332 ? 0.9461 0.4756 1.0237 0.0107 0.0825 -0.0111 313 MET B SD 8929 C CE . MET B 332 ? 0.9910 0.4831 1.0275 0.0085 0.1119 -0.0293 313 MET B CE 8930 N N . TYR B 333 ? 0.9594 0.4946 0.9590 -0.0419 0.0127 0.0115 314 TYR B N 8931 C CA . TYR B 333 ? 0.9514 0.4924 0.9678 -0.0392 0.0021 0.0280 314 TYR B CA 8932 C C . TYR B 333 ? 0.9370 0.5056 0.9454 -0.0513 -0.0125 0.0358 314 TYR B C 8933 O O . TYR B 333 ? 0.9404 0.5308 0.9616 -0.0449 -0.0218 0.0494 314 TYR B O 8934 C CB . TYR B 333 ? 1.0003 0.5006 1.0119 -0.0419 0.0073 0.0284 314 TYR B CB 8935 C CG . TYR B 333 ? 1.0417 0.5377 1.0660 -0.0336 0.0004 0.0476 314 TYR B CG 8936 C CD1 . TYR B 333 ? 1.0766 0.5757 1.1250 -0.0116 -0.0009 0.0565 314 TYR B CD1 8937 C CD2 . TYR B 333 ? 1.0737 0.5611 1.0856 -0.0469 -0.0045 0.0567 314 TYR B CD2 8938 C CE1 . TYR B 333 ? 1.1540 0.6454 1.2063 -0.0010 -0.0099 0.0747 314 TYR B CE1 8939 C CE2 . TYR B 333 ? 1.0826 0.5595 1.0971 -0.0378 -0.0087 0.0761 314 TYR B CE2 8940 C CZ . TYR B 333 ? 1.1111 0.5887 1.1419 -0.0139 -0.0127 0.0854 314 TYR B CZ 8941 O OH . TYR B 333 ? 1.0727 0.5365 1.0987 -0.0021 -0.0194 0.1053 314 TYR B OH 8942 N N . LEU B 334 ? 0.9784 0.5460 0.9658 -0.0679 -0.0151 0.0258 315 LEU B N 8943 C CA . LEU B 334 ? 0.9941 0.5898 0.9777 -0.0796 -0.0274 0.0305 315 LEU B CA 8944 C C . LEU B 334 ? 1.0034 0.6341 0.9898 -0.0736 -0.0321 0.0318 315 LEU B C 8945 O O . LEU B 334 ? 1.0004 0.6582 0.9932 -0.0754 -0.0412 0.0411 315 LEU B O 8946 C CB . LEU B 334 ? 0.9595 0.5460 0.9264 -0.0978 -0.0308 0.0166 315 LEU B CB 8947 C CG . LEU B 334 ? 0.8842 0.4365 0.8524 -0.1077 -0.0257 0.0139 315 LEU B CG 8948 C CD1 . LEU B 334 ? 0.8781 0.4184 0.8320 -0.1238 -0.0296 -0.0069 315 LEU B CD1 8949 C CD2 . LEU B 334 ? 0.9749 0.5340 0.9558 -0.1140 -0.0278 0.0303 315 LEU B CD2 8950 N N . GLY B 335 ? 0.9634 0.5902 0.9437 -0.0665 -0.0236 0.0224 316 GLY B N 8951 C CA . GLY B 335 ? 0.8845 0.5382 0.8682 -0.0607 -0.0240 0.0235 316 GLY B CA 8952 C C . GLY B 335 ? 0.9134 0.5710 0.8692 -0.0681 -0.0270 0.0142 316 GLY B C 8953 O O . GLY B 335 ? 0.9120 0.5651 0.8517 -0.0800 -0.0362 0.0083 316 GLY B O 8954 N N . TYR B 336 ? 0.7672 0.4324 0.7186 -0.0606 -0.0192 0.0127 317 TYR B N 8955 C CA . TYR B 336 ? 0.8195 0.4846 0.7390 -0.0634 -0.0217 0.0061 317 TYR B CA 8956 C C . TYR B 336 ? 0.8570 0.5490 0.7761 -0.0723 -0.0408 0.0098 317 TYR B C 8957 O O . TYR B 336 ? 0.8051 0.4931 0.7008 -0.0791 -0.0512 0.0015 317 TYR B O 8958 C CB . TYR B 336 ? 0.7817 0.4489 0.6999 -0.0530 -0.0066 0.0075 317 TYR B CB 8959 C CG . TYR B 336 ? 0.8695 0.5306 0.7481 -0.0526 -0.0080 0.0032 317 TYR B CG 8960 C CD1 . TYR B 336 ? 1.0523 0.6806 0.8867 -0.0520 -0.0040 -0.0083 317 TYR B CD1 8961 C CD2 . TYR B 336 ? 0.7167 0.4017 0.5986 -0.0513 -0.0139 0.0102 317 TYR B CD2 8962 C CE1 . TYR B 336 ? 0.9519 0.5712 0.7434 -0.0487 -0.0078 -0.0115 317 TYR B CE1 8963 C CE2 . TYR B 336 ? 0.8048 0.4811 0.6479 -0.0483 -0.0160 0.0078 317 TYR B CE2 8964 C CZ . TYR B 336 ? 0.8875 0.5306 0.6839 -0.0462 -0.0138 -0.0025 317 TYR B CZ 8965 O OH . TYR B 336 ? 0.9405 0.5717 0.6920 -0.0404 -0.0184 -0.0041 317 TYR B OH 8966 N N . GLU B 337 ? 0.7686 0.4883 0.7148 -0.0714 -0.0459 0.0210 318 GLU B N 8967 C CA . GLU B 337 ? 0.7664 0.5129 0.7163 -0.0787 -0.0606 0.0250 318 GLU B CA 8968 C C . GLU B 337 ? 0.9460 0.6890 0.8957 -0.0918 -0.0700 0.0215 318 GLU B C 8969 O O . GLU B 337 ? 0.9529 0.7064 0.8947 -0.0992 -0.0810 0.0153 318 GLU B O 8970 C CB . GLU B 337 ? 0.7170 0.4888 0.6929 -0.0746 -0.0625 0.0366 318 GLU B CB 8971 C CG . GLU B 337 ? 0.7730 0.5569 0.7548 -0.0654 -0.0566 0.0382 318 GLU B CG 8972 C CD . GLU B 337 ? 0.9488 0.7176 0.9415 -0.0562 -0.0417 0.0361 318 GLU B CD 8973 O OE1 . GLU B 337 ? 1.0824 0.8363 1.0835 -0.0546 -0.0385 0.0359 318 GLU B OE1 8974 O OE2 . GLU B 337 ? 0.9188 0.6899 0.9143 -0.0503 -0.0315 0.0347 318 GLU B OE2 8975 N N . TYR B 338 ? 0.9604 0.6884 0.9217 -0.0943 -0.0654 0.0251 319 TYR B N 8976 C CA . TYR B 338 ? 0.8384 0.5596 0.8041 -0.1081 -0.0700 0.0226 319 TYR B CA 8977 C C . TYR B 338 ? 1.0010 0.7040 0.9487 -0.1162 -0.0742 0.0053 319 TYR B C 8978 O O . TYR B 338 ? 1.0794 0.7939 1.0304 -0.1280 -0.0851 -0.0022 319 TYR B O 8979 C CB . TYR B 338 ? 0.8332 0.5345 0.8105 -0.1070 -0.0620 0.0317 319 TYR B CB 8980 C CG . TYR B 338 ? 0.8131 0.5047 0.7972 -0.1226 -0.0624 0.0312 319 TYR B CG 8981 C CD1 . TYR B 338 ? 0.8585 0.5711 0.8546 -0.1301 -0.0651 0.0401 319 TYR B CD1 8982 C CD2 . TYR B 338 ? 0.7155 0.3755 0.6952 -0.1304 -0.0579 0.0209 319 TYR B CD2 8983 C CE1 . TYR B 338 ? 0.8685 0.5715 0.8750 -0.1457 -0.0613 0.0396 319 TYR B CE1 8984 C CE2 . TYR B 338 ? 0.8058 0.4558 0.7968 -0.1466 -0.0561 0.0195 319 TYR B CE2 8985 C CZ . TYR B 338 ? 0.8742 0.5463 0.8800 -0.1545 -0.0568 0.0293 319 TYR B CZ 8986 O OH . TYR B 338 ? 0.8357 0.4974 0.8570 -0.1718 -0.0508 0.0282 319 TYR B OH 8987 N N . VAL B 339 ? 0.9592 0.6339 0.8889 -0.1092 -0.0656 -0.0023 320 VAL B N 8988 C CA . VAL B 339 ? 0.9160 0.5679 0.8205 -0.1146 -0.0697 -0.0207 320 VAL B CA 8989 C C . VAL B 339 ? 0.9694 0.6398 0.8556 -0.1154 -0.0851 -0.0287 320 VAL B C 8990 O O . VAL B 339 ? 1.0951 0.7649 0.9757 -0.1257 -0.0994 -0.0429 320 VAL B O 8991 C CB . VAL B 339 ? 1.0311 0.6490 0.9139 -0.1037 -0.0544 -0.0269 320 VAL B CB 8992 C CG1 . VAL B 339 ? 0.7856 0.3799 0.6304 -0.1062 -0.0600 -0.0469 320 VAL B CG1 8993 C CG2 . VAL B 339 ? 1.0559 0.6510 0.9572 -0.1032 -0.0422 -0.0227 320 VAL B CG2 8994 N N . THR B 340 ? 0.8881 0.5749 0.7677 -0.1042 -0.0832 -0.0201 321 THR B N 8995 C CA . THR B 340 ? 0.9064 0.6091 0.7674 -0.1015 -0.0973 -0.0245 321 THR B CA 8996 C C . THR B 340 ? 0.9819 0.7160 0.8687 -0.1133 -0.1149 -0.0259 321 THR B C 8997 O O . THR B 340 ? 0.9678 0.7078 0.8441 -0.1168 -0.1326 -0.0386 321 THR B O 8998 C CB . THR B 340 ? 0.8606 0.5755 0.7179 -0.0884 -0.0889 -0.0122 321 THR B CB 8999 O OG1 . THR B 340 ? 1.0272 0.7131 0.8625 -0.0779 -0.0702 -0.0128 321 THR B OG1 9000 C CG2 . THR B 340 ? 0.8211 0.5508 0.6596 -0.0842 -0.1039 -0.0146 321 THR B CG2 9001 N N . ALA B 341 ? 0.9420 0.6956 0.8629 -0.1185 -0.1098 -0.0134 322 ALA B N 9002 C CA . ALA B 341 ? 0.8113 0.5957 0.7603 -0.1291 -0.1205 -0.0126 322 ALA B CA 9003 C C . ALA B 341 ? 0.8513 0.6295 0.8133 -0.1454 -0.1286 -0.0272 322 ALA B C 9004 O O . ALA B 341 ? 1.0214 0.8207 0.9956 -0.1523 -0.1447 -0.0379 322 ALA B O 9005 C CB . ALA B 341 ? 0.7815 0.5804 0.7554 -0.1298 -0.1098 0.0044 322 ALA B CB 9006 N N . ILE B 342 ? 0.8684 0.6178 0.8314 -0.1513 -0.1176 -0.0285 323 ILE B N 9007 C CA . ILE B 342 ? 0.9903 0.7291 0.9695 -0.1686 -0.1218 -0.0426 323 ILE B CA 9008 C C . ILE B 342 ? 1.1106 0.8398 1.0676 -0.1700 -0.1395 -0.0660 323 ILE B C 9009 O O . ILE B 342 ? 1.1295 0.8714 1.1069 -0.1835 -0.1544 -0.0819 323 ILE B O 9010 C CB . ILE B 342 ? 0.9432 0.6470 0.9250 -0.1722 -0.1040 -0.0373 323 ILE B CB 9011 C CG1 . ILE B 342 ? 1.0516 0.7625 1.0492 -0.1683 -0.0899 -0.0140 323 ILE B CG1 9012 C CG2 . ILE B 342 ? 0.8676 0.5570 0.8686 -0.1917 -0.1059 -0.0524 323 ILE B CG2 9013 C CD1 . ILE B 342 ? 1.0431 0.7818 1.0706 -0.1802 -0.0903 -0.0078 323 ILE B CD1 9014 N N . ARG B 343 ? 1.2187 0.9249 1.1339 -0.1555 -0.1378 -0.0689 324 ARG B N 9015 C CA . ARG B 343 ? 1.1949 0.8852 1.0747 -0.1526 -0.1542 -0.0902 324 ARG B CA 9016 C C . ARG B 343 ? 1.0515 0.7753 0.9341 -0.1510 -0.1790 -0.0971 324 ARG B C 9017 O O . ARG B 343 ? 1.0409 0.7663 0.9209 -0.1576 -0.2010 -0.1186 324 ARG B O 9018 C CB . ARG B 343 ? 1.2536 0.9127 1.0847 -0.1348 -0.1418 -0.0874 324 ARG B CB 9019 C CG . ARG B 343 ? 1.3294 0.9601 1.1113 -0.1298 -0.1543 -0.1089 324 ARG B CG 9020 C CD . ARG B 343 ? 1.4201 1.0205 1.1535 -0.1113 -0.1362 -0.1029 324 ARG B CD 9021 N NE . ARG B 343 ? 1.6020 1.2241 1.3376 -0.0995 -0.1292 -0.0831 324 ARG B NE 9022 C CZ . ARG B 343 ? 1.6039 1.2396 1.3169 -0.0903 -0.1441 -0.0821 324 ARG B CZ 9023 N NH1 . ARG B 343 ? 1.6451 1.2770 1.3304 -0.0901 -0.1698 -0.0999 324 ARG B NH1 9024 N NH2 . ARG B 343 ? 1.4129 1.0652 1.1315 -0.0806 -0.1345 -0.0640 324 ARG B NH2 9025 N N . ASN B 344 ? 0.8534 0.6037 0.7429 -0.1416 -0.1767 -0.0801 325 ASN B N 9026 C CA . ASN B 344 ? 0.9291 0.7141 0.8288 -0.1386 -0.1984 -0.0836 325 ASN B CA 9027 C C . ASN B 344 ? 0.9044 0.7183 0.8572 -0.1577 -0.2100 -0.0942 325 ASN B C 9028 O O . ASN B 344 ? 1.0448 0.8782 1.0071 -0.1598 -0.2351 -0.1109 325 ASN B O 9029 C CB . ASN B 344 ? 0.6921 0.4992 0.5983 -0.1274 -0.1888 -0.0623 325 ASN B CB 9030 C CG . ASN B 344 ? 1.0873 0.8741 0.9440 -0.1076 -0.1839 -0.0556 325 ASN B CG 9031 O OD1 . ASN B 344 ? 1.1123 0.8657 0.9253 -0.1010 -0.1847 -0.0650 325 ASN B OD1 9032 N ND2 . ASN B 344 ? 0.9448 0.7489 0.8074 -0.0982 -0.1767 -0.0396 325 ASN B ND2 9033 N N . LEU B 345 ? 1.0194 0.8348 1.0074 -0.1709 -0.1908 -0.0845 326 LEU B N 9034 C CA . LEU B 345 ? 1.0302 0.8712 1.0728 -0.1902 -0.1931 -0.0906 326 LEU B CA 9035 C C . LEU B 345 ? 1.0944 0.9241 1.1494 -0.2057 -0.2074 -0.1169 326 LEU B C 9036 O O . LEU B 345 ? 1.1775 1.0351 1.2793 -0.2204 -0.2187 -0.1302 326 LEU B O 9037 C CB . LEU B 345 ? 0.9201 0.7550 0.9851 -0.1981 -0.1657 -0.0712 326 LEU B CB 9038 C CG . LEU B 345 ? 0.8444 0.7153 0.9534 -0.2060 -0.1593 -0.0616 326 LEU B CG 9039 C CD1 . LEU B 345 ? 0.8983 0.8012 1.0022 -0.1910 -0.1709 -0.0563 326 LEU B CD1 9040 C CD2 . LEU B 345 ? 0.7391 0.5947 0.8512 -0.2080 -0.1324 -0.0398 326 LEU B CD2 9041 N N . ARG B 346 ? 1.0890 0.8783 1.1052 -0.2026 -0.2061 -0.1260 327 ARG B N 9042 C CA . ARG B 346 ? 1.2223 0.9947 1.2460 -0.2174 -0.2188 -0.1530 327 ARG B CA 9043 C C . ARG B 346 ? 1.1897 0.9610 1.1769 -0.2072 -0.2506 -0.1759 327 ARG B C 9044 O O . ARG B 346 ? 1.2177 1.0137 1.2338 -0.2164 -0.2767 -0.1978 327 ARG B O 9045 C CB . ARG B 346 ? 1.3373 1.0615 1.3415 -0.2212 -0.1973 -0.1516 327 ARG B CB 9046 C CG . ARG B 346 ? 1.3130 1.0320 1.3483 -0.2298 -0.1683 -0.1296 327 ARG B CG 9047 C CD . ARG B 346 ? 1.4737 1.1436 1.4900 -0.2308 -0.1493 -0.1289 327 ARG B CD 9048 N NE . ARG B 346 ? 1.6400 1.3012 1.6742 -0.2321 -0.1233 -0.1037 327 ARG B NE 9049 C CZ . ARG B 346 ? 1.6619 1.3121 1.7310 -0.2499 -0.1093 -0.1016 327 ARG B CZ 9050 N NH1 . ARG B 346 ? 1.7067 1.3555 1.8044 -0.2704 -0.1178 -0.1250 327 ARG B NH1 9051 N NH2 . ARG B 346 ? 1.5802 1.2186 1.6547 -0.2466 -0.0869 -0.0765 327 ARG B NH2 9052 N N . GLU B 347 ? 1.1803 0.9223 1.1040 -0.1875 -0.2482 -0.1710 328 GLU B N 9053 C CA . GLU B 347 ? 1.2701 1.0003 1.1431 -0.1742 -0.2755 -0.1903 328 GLU B CA 9054 C C . GLU B 347 ? 1.2863 1.0567 1.1660 -0.1634 -0.3013 -0.1897 328 GLU B C 9055 O O . GLU B 347 ? 1.1899 0.9660 1.0543 -0.1590 -0.3344 -0.2120 328 GLU B O 9056 C CB . GLU B 347 ? 1.2989 0.9843 1.1013 -0.1553 -0.2590 -0.1817 328 GLU B CB 9057 C CG . GLU B 347 ? 1.3808 1.0241 1.1748 -0.1636 -0.2365 -0.1864 328 GLU B CG 9058 C CD . GLU B 347 ? 1.4045 1.0077 1.1397 -0.1451 -0.2143 -0.1759 328 GLU B CD 9059 O OE1 . GLU B 347 ? 1.3615 0.9301 1.0904 -0.1489 -0.1938 -0.1783 328 GLU B OE1 9060 O OE2 . GLU B 347 ? 1.3863 0.9916 1.0843 -0.1268 -0.2154 -0.1652 328 GLU B OE2 9061 N N . GLY B 348 ? 1.2401 1.0372 1.1418 -0.1579 -0.2875 -0.1651 329 GLY B N 9062 C CA . GLY B 348 ? 1.2070 1.0433 1.1225 -0.1475 -0.3082 -0.1623 329 GLY B CA 9063 C C . GLY B 348 ? 1.3212 1.1401 1.1689 -0.1225 -0.3268 -0.1642 329 GLY B C 9064 O O . GLY B 348 ? 1.3437 1.1901 1.1960 -0.1116 -0.3519 -0.1673 329 GLY B O 9065 N N . THR B 349 ? 1.3814 1.1525 1.1652 -0.1122 -0.3130 -0.1615 330 THR B N 9066 C CA . THR B 349 ? 1.4926 1.2365 1.2014 -0.0878 -0.3252 -0.1620 330 THR B CA 9067 C C . THR B 349 ? 1.4002 1.1468 1.0917 -0.0705 -0.3072 -0.1342 330 THR B C 9068 O O . THR B 349 ? 1.2840 1.0120 0.9676 -0.0694 -0.2739 -0.1163 330 THR B O 9069 C CB . THR B 349 ? 1.6267 1.3143 1.2706 -0.0834 -0.3143 -0.1719 330 THR B CB 9070 O OG1 . THR B 349 ? 1.5386 1.1934 1.1070 -0.0586 -0.3092 -0.1614 330 THR B OG1 9071 C CG2 . THR B 349 ? 1.7103 1.3809 1.3759 -0.0961 -0.2768 -0.1609 330 THR B CG2 9072 N N . CYS B 350 ? 1.3700 1.1404 1.0595 -0.0569 -0.3302 -0.1320 331 CYS B N 9073 C CA . CYS B 350 ? 1.4001 1.1696 1.0694 -0.0390 -0.3161 -0.1080 331 CYS B CA 9074 C C . CYS B 350 ? 1.6077 1.3580 1.2120 -0.0138 -0.3410 -0.1112 331 CYS B C 9075 O O . CYS B 350 ? 1.6938 1.4562 1.2955 -0.0107 -0.3786 -0.1316 331 CYS B O 9076 C CB . CYS B 350 ? 1.2584 1.0789 0.9985 -0.0461 -0.3144 -0.0966 331 CYS B CB 9077 S SG . CYS B 350 ? 1.8386 1.6707 1.6330 -0.0662 -0.2763 -0.0810 331 CYS B SG 9078 N N . PRO B 351 ? 1.6219 1.3404 1.1734 0.0050 -0.3203 -0.0914 332 PRO B N 9079 C CA . PRO B 351 ? 1.7352 1.4283 1.2170 0.0319 -0.3396 -0.0895 332 PRO B CA 9080 C C . PRO B 351 ? 1.9121 1.6489 1.4284 0.0409 -0.3734 -0.0910 332 PRO B C 9081 O O . PRO B 351 ? 1.8930 1.6635 1.4628 0.0372 -0.3621 -0.0766 332 PRO B O 9082 C CB . PRO B 351 ? 1.6113 1.2697 1.0544 0.0443 -0.3004 -0.0636 332 PRO B CB 9083 C CG . PRO B 351 ? 1.4446 1.1293 0.9567 0.0246 -0.2697 -0.0523 332 PRO B CG 9084 C CD . PRO B 351 ? 1.4126 1.1149 0.9672 0.0020 -0.2769 -0.0704 332 PRO B CD 9085 N N . GLU B 352 ? 2.0623 1.7983 1.5487 0.0535 -0.4154 -0.1096 333 GLU B N 9086 C CA . GLU B 352 ? 2.0475 1.8278 1.5733 0.0647 -0.4445 -0.1113 333 GLU B CA 9087 C C . GLU B 352 ? 2.0662 1.8249 1.5457 0.0922 -0.4357 -0.0873 333 GLU B C 9088 O O . GLU B 352 ? 1.9055 1.6989 1.4213 0.1029 -0.4497 -0.0827 333 GLU B O 9089 C CB . GLU B 352 ? 2.0691 1.8651 1.5998 0.0680 -0.4756 -0.1352 333 GLU B CB 9090 C CG . GLU B 352 ? 2.0087 1.8365 1.6041 0.0394 -0.4850 -0.1599 333 GLU B CG 9091 C CD . GLU B 352 ? 1.9228 1.7857 1.5516 0.0409 -0.5181 -0.1823 333 GLU B CD 9092 O OE1 . GLU B 352 ? 1.8263 1.6872 1.4242 0.0655 -0.5365 -0.1789 333 GLU B OE1 9093 O OE2 . GLU B 352 ? 1.8622 1.7531 1.5491 0.0173 -0.5252 -0.2031 333 GLU B OE2 9094 N N . ALA B 353 ? 2.2329 1.9319 1.6334 0.1033 -0.4096 -0.0720 334 ALA B N 9095 C CA . ALA B 353 ? 2.2819 1.9523 1.6381 0.1266 -0.3918 -0.0467 334 ALA B CA 9096 C C . ALA B 353 ? 2.2893 1.9436 1.6566 0.1153 -0.3415 -0.0261 334 ALA B C 9097 O O . ALA B 353 ? 2.3450 1.9473 1.6526 0.1199 -0.3116 -0.0177 334 ALA B O 9098 C CB . ALA B 353 ? 2.2749 1.8924 1.5426 0.1503 -0.3906 -0.0447 334 ALA B CB 9099 N N . PRO B 354 ? 2.1449 1.8460 1.5944 0.1001 -0.3296 -0.0191 335 PRO B N 9100 C CA . PRO B 354 ? 2.0906 1.7863 1.5654 0.0879 -0.2845 -0.0021 335 PRO B CA 9101 C C . PRO B 354 ? 2.0871 1.7510 1.5242 0.1074 -0.2621 0.0206 335 PRO B C 9102 O O . PRO B 354 ? 2.0836 1.7746 1.5655 0.1076 -0.2563 0.0312 335 PRO B O 9103 C CB . PRO B 354 ? 2.0005 1.7577 1.5690 0.0686 -0.2882 -0.0051 335 PRO B CB 9104 C CG . PRO B 354 ? 1.9732 1.7634 1.5604 0.0798 -0.3280 -0.0137 335 PRO B CG 9105 C CD . PRO B 354 ? 2.0200 1.7828 1.5446 0.0935 -0.3590 -0.0286 335 PRO B CD 9106 N N . THR B 355 ? 2.0593 1.6634 1.4139 0.1233 -0.2471 0.0277 336 THR B N 9107 C CA . THR B 355 ? 2.0099 1.5744 1.3200 0.1431 -0.2238 0.0496 336 THR B CA 9108 C C . THR B 355 ? 1.9817 1.5528 1.3405 0.1295 -0.1815 0.0638 336 THR B C 9109 O O . THR B 355 ? 2.0278 1.5783 1.3733 0.1417 -0.1627 0.0811 336 THR B O 9110 C CB . THR B 355 ? 2.0470 1.5395 1.2540 0.1614 -0.2101 0.0545 336 THR B CB 9111 O OG1 . THR B 355 ? 2.1316 1.6086 1.3334 0.1449 -0.1886 0.0448 336 THR B OG1 9112 C CG2 . THR B 355 ? 1.9722 1.4504 1.1162 0.1842 -0.2557 0.0445 336 THR B CG2 9113 N N . ASP B 356 ? 1.9518 1.5499 1.3663 0.1050 -0.1679 0.0559 337 ASP B N 9114 C CA . ASP B 356 ? 1.9971 1.6056 1.4620 0.0912 -0.1325 0.0656 337 ASP B CA 9115 C C . ASP B 356 ? 2.0061 1.5596 1.4248 0.1002 -0.0918 0.0798 337 ASP B C 9116 O O . ASP B 356 ? 1.9171 1.4699 1.3628 0.0988 -0.0665 0.0916 337 ASP B O 9117 C CB . ASP B 356 ? 2.0950 1.7457 1.6179 0.0897 -0.1406 0.0713 337 ASP B CB 9118 C CG . ASP B 356 ? 2.1464 1.8215 1.7332 0.0711 -0.1147 0.0742 337 ASP B CG 9119 O OD1 . ASP B 356 ? 2.1547 1.8292 1.7565 0.0566 -0.1002 0.0684 337 ASP B OD1 9120 O OD2 . ASP B 356 ? 2.1294 1.8233 1.7506 0.0722 -0.1101 0.0814 337 ASP B OD2 9121 N N . GLU B 357 ? 1.9827 1.4885 1.3315 0.1091 -0.0846 0.0775 338 GLU B N 9122 C CA . GLU B 357 ? 1.7244 1.1754 1.0303 0.1150 -0.0403 0.0890 338 GLU B CA 9123 C C . GLU B 357 ? 1.5917 1.0350 0.9048 0.1004 -0.0212 0.0780 338 GLU B C 9124 O O . GLU B 357 ? 1.6253 1.1048 0.9770 0.0861 -0.0425 0.0633 338 GLU B O 9125 C CB . GLU B 357 ? 1.8586 1.2495 1.0650 0.1418 -0.0413 0.0984 338 GLU B CB 9126 C CG . GLU B 357 ? 2.0758 1.4527 1.2211 0.1516 -0.0763 0.0838 338 GLU B CG 9127 C CD . GLU B 357 ? 2.2158 1.5308 1.2554 0.1815 -0.0807 0.0940 338 GLU B CD 9128 O OE1 . GLU B 357 ? 2.1643 1.4466 1.1796 0.1947 -0.0551 0.1143 338 GLU B OE1 9129 O OE2 . GLU B 357 ? 2.2818 1.5785 1.2607 0.1925 -0.1101 0.0813 338 GLU B OE2 9130 N N . CYS B 358 ? 1.4009 0.7958 0.6788 0.1042 0.0209 0.0851 339 CYS B N 9131 C CA . CYS B 358 ? 1.2992 0.6893 0.5970 0.0904 0.0452 0.0758 339 CYS B CA 9132 C C . CYS B 358 ? 1.4550 0.8107 0.6854 0.0965 0.0365 0.0631 339 CYS B C 9133 O O . CYS B 358 ? 1.7808 1.0819 0.9241 0.1151 0.0438 0.0679 339 CYS B O 9134 C CB . CYS B 358 ? 1.2366 0.5975 0.5456 0.0888 0.0984 0.0869 339 CYS B CB 9135 S SG . CYS B 358 ? 1.3765 0.7890 0.7917 0.0727 0.1104 0.0926 339 CYS B SG 9136 N N . LYS B 359 ? 1.3726 0.7569 0.6404 0.0815 0.0216 0.0469 340 LYS B N 9137 C CA . LYS B 359 ? 1.4903 0.8418 0.7027 0.0843 0.0173 0.0320 340 LYS B CA 9138 C C . LYS B 359 ? 1.4646 0.7750 0.6624 0.0838 0.0679 0.0343 340 LYS B C 9139 O O . LYS B 359 ? 1.6266 0.9532 0.8859 0.0744 0.0981 0.0420 340 LYS B O 9140 C CB . LYS B 359 ? 1.4081 0.8026 0.6696 0.0676 -0.0148 0.0137 340 LYS B CB 9141 C CG . LYS B 359 ? 1.6417 1.0768 0.9202 0.0671 -0.0635 0.0083 340 LYS B CG 9142 C CD . LYS B 359 ? 2.0114 1.4128 1.2048 0.0891 -0.0868 0.0076 340 LYS B CD 9143 C CE . LYS B 359 ? 2.1037 1.5501 1.3247 0.0907 -0.1333 0.0037 340 LYS B CE 9144 N NZ . LYS B 359 ? 2.2021 1.6169 1.3422 0.1157 -0.1586 0.0045 340 LYS B NZ 9145 N N . PRO B 360 ? 1.4465 0.7032 0.5634 0.0945 0.0773 0.0264 341 PRO B N 9146 C CA . PRO B 360 ? 1.5295 0.7417 0.6254 0.0958 0.1281 0.0270 341 PRO B CA 9147 C C . PRO B 360 ? 1.4893 0.7367 0.6782 0.0769 0.1491 0.0219 341 PRO B C 9148 O O . PRO B 360 ? 1.3573 0.6473 0.5993 0.0635 0.1210 0.0104 341 PRO B O 9149 C CB . PRO B 360 ? 1.5571 0.7247 0.5667 0.1053 0.1162 0.0107 341 PRO B CB 9150 C CG . PRO B 360 ? 1.5814 0.7462 0.5338 0.1190 0.0709 0.0104 341 PRO B CG 9151 C CD . PRO B 360 ? 1.5263 0.7594 0.5630 0.1079 0.0395 0.0153 341 PRO B CD 9152 N N . VAL B 361 ? 0.8776 0.5286 0.6699 -0.0934 -0.0951 -0.0364 342 VAL B N 9153 C CA . VAL B 361 ? 0.9442 0.5820 0.7278 -0.0865 -0.0941 -0.0359 342 VAL B CA 9154 C C . VAL B 361 ? 1.0155 0.6428 0.7920 -0.0798 -0.0988 -0.0454 342 VAL B C 9155 O O . VAL B 361 ? 1.0228 0.6639 0.7968 -0.0747 -0.1008 -0.0523 342 VAL B O 9156 C CB . VAL B 361 ? 0.8393 0.4915 0.6228 -0.0798 -0.0909 -0.0317 342 VAL B CB 9157 C CG1 . VAL B 361 ? 0.8029 0.4423 0.5774 -0.0722 -0.0909 -0.0314 342 VAL B CG1 9158 C CG2 . VAL B 361 ? 0.8459 0.5090 0.6407 -0.0859 -0.0863 -0.0249 342 VAL B CG2 9159 N N . LYS B 362 ? 0.9685 0.5730 0.7437 -0.0803 -0.1008 -0.0459 343 LYS B N 9160 C CA . LYS B 362 ? 0.9003 0.4923 0.6746 -0.0741 -0.1060 -0.0565 343 LYS B CA 9161 C C . LYS B 362 ? 0.9381 0.5266 0.7081 -0.0634 -0.1062 -0.0564 343 LYS B C 9162 O O . LYS B 362 ? 0.9904 0.5654 0.7599 -0.0630 -0.1059 -0.0476 343 LYS B O 9163 C CB . LYS B 362 ? 0.8845 0.4526 0.6652 -0.0805 -0.1095 -0.0563 343 LYS B CB 9164 C CG . LYS B 362 ? 0.8073 0.3782 0.5933 -0.0919 -0.1088 -0.0549 343 LYS B CG 9165 C CD . LYS B 362 ? 0.9969 0.5450 0.7913 -0.0979 -0.1131 -0.0567 343 LYS B CD 9166 C CE . LYS B 362 ? 1.2195 0.7511 1.0152 -0.1021 -0.1117 -0.0424 343 LYS B CE 9167 N NZ . LYS B 362 ? 1.2075 0.7497 1.0014 -0.1113 -0.1053 -0.0310 343 LYS B NZ 9168 N N . TRP B 363 ? 0.8322 0.4354 0.5991 -0.0551 -0.1069 -0.0658 344 TRP B N 9169 C CA . TRP B 363 ? 0.9265 0.5291 0.6907 -0.0444 -0.1070 -0.0672 344 TRP B CA 9170 C C . TRP B 363 ? 1.0544 0.6374 0.8249 -0.0385 -0.1127 -0.0776 344 TRP B C 9171 O O . TRP B 363 ? 1.2475 0.8254 1.0237 -0.0407 -0.1164 -0.0892 344 TRP B O 9172 C CB . TRP B 363 ? 0.7348 0.3645 0.4947 -0.0385 -0.1047 -0.0722 344 TRP B CB 9173 C CG . TRP B 363 ? 1.0497 0.6833 0.8069 -0.0295 -0.1029 -0.0686 344 TRP B CG 9174 C CD1 . TRP B 363 ? 1.0590 0.6886 0.8169 -0.0192 -0.1052 -0.0774 344 TRP B CD1 9175 C CD2 . TRP B 363 ? 0.9354 0.5784 0.6913 -0.0298 -0.0986 -0.0564 344 TRP B CD2 9176 N NE1 . TRP B 363 ? 1.0191 0.6548 0.7748 -0.0133 -0.1026 -0.0702 344 TRP B NE1 9177 C CE2 . TRP B 363 ? 0.9082 0.5522 0.6624 -0.0197 -0.0986 -0.0577 344 TRP B CE2 9178 C CE3 . TRP B 363 ? 0.8984 0.5497 0.6568 -0.0376 -0.0949 -0.0461 344 TRP B CE3 9179 C CZ2 . TRP B 363 ? 0.9375 0.5907 0.6912 -0.0174 -0.0952 -0.0487 344 TRP B CZ2 9180 C CZ3 . TRP B 363 ? 0.6824 0.3430 0.4421 -0.0351 -0.0915 -0.0385 344 TRP B CZ3 9181 C CH2 . TRP B 363 ? 0.9005 0.5620 0.6572 -0.0253 -0.0917 -0.0397 344 TRP B CH2 9182 N N . CYS B 364 ? 0.9406 0.5128 0.7124 -0.0311 -0.1141 -0.0741 345 CYS B N 9183 C CA . CYS B 364 ? 0.9754 0.5275 0.7585 -0.0249 -0.1204 -0.0829 345 CYS B CA 9184 C C . CYS B 364 ? 1.1034 0.6663 0.8884 -0.0124 -0.1213 -0.0966 345 CYS B C 9185 O O . CYS B 364 ? 1.0983 0.6695 0.8779 -0.0063 -0.1187 -0.0905 345 CYS B O 9186 C CB . CYS B 364 ? 0.8660 0.3950 0.6540 -0.0268 -0.1233 -0.0672 345 CYS B CB 9187 S SG . CYS B 364 ? 1.2388 0.7372 1.0485 -0.0240 -0.1331 -0.0735 345 CYS B SG 9188 N N . ALA B 365 ? 0.9643 0.5286 0.7580 -0.0087 -0.1248 -0.1164 346 ALA B N 9189 C CA . ALA B 365 ? 0.8849 0.4632 0.6817 0.0027 -0.1250 -0.1331 346 ALA B CA 9190 C C . ALA B 365 ? 1.0265 0.5820 0.8427 0.0112 -0.1318 -0.1412 346 ALA B C 9191 O O . ALA B 365 ? 0.8558 0.3883 0.6873 0.0081 -0.1377 -0.1443 346 ALA B O 9192 C CB . ALA B 365 ? 0.9089 0.5113 0.7032 0.0016 -0.1240 -0.1523 346 ALA B CB 9193 N N . LEU B 366 ? 1.0283 0.5906 0.8465 0.0219 -0.1313 -0.1447 347 LEU B N 9194 C CA . LEU B 366 ? 0.9542 0.4953 0.7932 0.0309 -0.1381 -0.1497 347 LEU B CA 9195 C C . LEU B 366 ? 1.0658 0.6144 0.9221 0.0399 -0.1410 -0.1789 347 LEU B C 9196 O O . LEU B 366 ? 1.0693 0.5999 0.9487 0.0479 -0.1476 -0.1860 347 LEU B O 9197 C CB . LEU B 366 ? 0.9127 0.4555 0.7469 0.0377 -0.1367 -0.1360 347 LEU B CB 9198 C CG . LEU B 366 ? 1.1544 0.6849 0.9785 0.0302 -0.1362 -0.1087 347 LEU B CG 9199 C CD1 . LEU B 366 ? 1.3622 0.8944 1.1846 0.0378 -0.1363 -0.0979 347 LEU B CD1 9200 C CD2 . LEU B 366 ? 1.1715 0.6725 1.0096 0.0238 -0.1432 -0.1000 347 LEU B CD2 9201 N N . SER B 367 ? 1.1221 0.6992 0.9688 0.0385 -0.1365 -0.1959 348 SER B N 9202 C CA . SER B 367 ? 1.1082 0.7004 0.9691 0.0464 -0.1379 -0.2267 348 SER B CA 9203 C C . SER B 367 ? 1.2124 0.8331 1.0614 0.0397 -0.1343 -0.2415 348 SER B C 9204 O O . SER B 367 ? 1.3109 0.9386 1.1417 0.0296 -0.1310 -0.2265 348 SER B O 9205 C CB . SER B 367 ? 1.0913 0.7034 0.9514 0.0577 -0.1345 -0.2336 348 SER B CB 9206 O OG . SER B 367 ? 1.0305 0.6727 0.8651 0.0547 -0.1264 -0.2231 348 SER B OG 9207 N N . HIS B 368 ? 1.3022 0.9413 1.1629 0.0452 -0.1353 -0.2717 349 HIS B N 9208 C CA . HIS B 368 ? 1.3167 0.9878 1.1663 0.0389 -0.1326 -0.2879 349 HIS B CA 9209 C C . HIS B 368 ? 1.3028 1.0124 1.1250 0.0359 -0.1245 -0.2770 349 HIS B C 9210 O O . HIS B 368 ? 1.2064 0.9348 1.0127 0.0262 -0.1223 -0.2711 349 HIS B O 9211 C CB . HIS B 368 ? 1.1623 0.8485 1.0317 0.0459 -0.1352 -0.3255 349 HIS B CB 9212 C CG . HIS B 368 ? 1.0689 0.7918 0.9269 0.0390 -0.1330 -0.3439 349 HIS B CG 9213 N ND1 . HIS B 368 ? 1.1791 0.8937 1.0368 0.0288 -0.1364 -0.3437 349 HIS B ND1 9214 C CD2 . HIS B 368 ? 0.9205 0.6912 0.7666 0.0403 -0.1279 -0.3619 349 HIS B CD2 9215 C CE1 . HIS B 368 ? 1.2539 1.0092 1.0998 0.0243 -0.1340 -0.3612 349 HIS B CE1 9216 N NE2 . HIS B 368 ? 1.1348 0.9257 0.9730 0.0308 -0.1287 -0.3721 349 HIS B NE2 9217 N N . HIS B 369 ? 1.2298 0.9511 1.0489 0.0442 -0.1208 -0.2737 350 HIS B N 9218 C CA . HIS B 369 ? 1.2257 0.9828 1.0230 0.0417 -0.1136 -0.2617 350 HIS B CA 9219 C C . HIS B 369 ? 1.3324 1.0782 1.1153 0.0329 -0.1118 -0.2297 350 HIS B C 9220 O O . HIS B 369 ? 1.3165 1.0889 1.0841 0.0254 -0.1081 -0.2196 350 HIS B O 9221 C CB . HIS B 369 ? 1.3068 1.0777 1.1072 0.0529 -0.1103 -0.2662 350 HIS B CB 9222 C CG . HIS B 369 ? 1.4214 1.2213 1.2311 0.0599 -0.1093 -0.2989 350 HIS B CG 9223 N ND1 . HIS B 369 ? 1.3965 1.2452 1.1919 0.0563 -0.1041 -0.3091 350 HIS B ND1 9224 C CD2 . HIS B 369 ? 1.5368 1.3262 1.3706 0.0700 -0.1131 -0.3243 350 HIS B CD2 9225 C CE1 . HIS B 369 ? 1.4191 1.2881 1.2275 0.0638 -0.1038 -0.3411 350 HIS B CE1 9226 N NE2 . HIS B 369 ? 1.5589 1.3915 1.3922 0.0726 -0.1093 -0.3518 350 HIS B NE2 9227 N N . GLU B 370 ? 1.3612 1.0694 1.1508 0.0335 -0.1147 -0.2139 351 GLU B N 9228 C CA . GLU B 370 ? 1.1460 0.8425 0.9249 0.0250 -0.1130 -0.1867 351 GLU B CA 9229 C C . GLU B 370 ? 1.0890 0.7839 0.8642 0.0135 -0.1146 -0.1851 351 GLU B C 9230 O O . GLU B 370 ? 1.0432 0.7484 0.8074 0.0053 -0.1117 -0.1687 351 GLU B O 9231 C CB . GLU B 370 ? 1.1141 0.7739 0.9011 0.0274 -0.1161 -0.1721 351 GLU B CB 9232 C CG . GLU B 370 ? 1.2161 0.8789 1.0010 0.0351 -0.1136 -0.1619 351 GLU B CG 9233 C CD . GLU B 370 ? 1.1712 0.8051 0.9575 0.0333 -0.1157 -0.1412 351 GLU B CD 9234 O OE1 . GLU B 370 ? 1.0740 0.7087 0.8591 0.0391 -0.1144 -0.1321 351 GLU B OE1 9235 O OE2 . GLU B 370 ? 1.1969 0.8098 0.9857 0.0256 -0.1186 -0.1341 351 GLU B OE2 9236 N N . ARG B 371 ? 0.9292 0.6108 0.7166 0.0131 -0.1196 -0.2028 352 ARG B N 9237 C CA . ARG B 371 ? 0.9379 0.6162 0.7240 0.0025 -0.1218 -0.2031 352 ARG B CA 9238 C C . ARG B 371 ? 1.1119 0.8311 0.8856 -0.0024 -0.1192 -0.2112 352 ARG B C 9239 O O . ARG B 371 ? 1.1510 0.8770 0.9173 -0.0125 -0.1190 -0.2009 352 ARG B O 9240 C CB . ARG B 371 ? 0.9476 0.6003 0.7537 0.0035 -0.1285 -0.2204 352 ARG B CB 9241 C CG . ARG B 371 ? 0.9773 0.6279 0.7843 -0.0071 -0.1313 -0.2240 352 ARG B CG 9242 C CD . ARG B 371 ? 1.0086 0.6482 0.8055 -0.0174 -0.1292 -0.1973 352 ARG B CD 9243 N NE . ARG B 371 ? 1.1392 0.7779 0.9382 -0.0275 -0.1320 -0.2012 352 ARG B NE 9244 C CZ . ARG B 371 ? 1.2968 0.9052 1.1095 -0.0324 -0.1365 -0.1998 352 ARG B CZ 9245 N NH1 . ARG B 371 ? 1.2356 0.8125 1.0610 -0.0285 -0.1391 -0.1927 352 ARG B NH1 9246 N NH2 . ARG B 371 ? 1.3935 1.0042 1.2081 -0.0416 -0.1388 -0.2041 352 ARG B NH2 9247 N N . LEU B 372 ? 1.1998 0.9483 0.9721 0.0044 -0.1173 -0.2292 353 LEU B N 9248 C CA . LEU B 372 ? 1.0903 0.8839 0.8496 -0.0004 -0.1148 -0.2352 353 LEU B CA 9249 C C . LEU B 372 ? 0.9998 0.8104 0.7450 -0.0061 -0.1105 -0.2078 353 LEU B C 9250 O O . LEU B 372 ? 1.0437 0.8715 0.7815 -0.0159 -0.1109 -0.1987 353 LEU B O 9251 C CB . LEU B 372 ? 0.9637 0.7880 0.7245 0.0081 -0.1128 -0.2598 353 LEU B CB 9252 C CG . LEU B 372 ? 0.9892 0.8137 0.7645 0.0111 -0.1171 -0.2934 353 LEU B CG 9253 C CD1 . LEU B 372 ? 0.8715 0.7304 0.6495 0.0199 -0.1142 -0.3191 353 LEU B CD1 9254 C CD2 . LEU B 372 ? 0.9968 0.8361 0.7668 0.0001 -0.1200 -0.2995 353 LEU B CD2 9255 N N . LYS B 373 ? 0.8768 0.6822 0.6213 0.0001 -0.1071 -0.1948 354 LYS B N 9256 C CA . LYS B 373 ? 0.9974 0.8159 0.7341 -0.0044 -0.1035 -0.1694 354 LYS B CA 9257 C C . LYS B 373 ? 1.0046 0.8013 0.7424 -0.0138 -0.1050 -0.1508 354 LYS B C 9258 O O . LYS B 373 ? 0.9852 0.8006 0.7190 -0.0217 -0.1041 -0.1359 354 LYS B O 9259 C CB . LYS B 373 ? 0.7531 0.5644 0.4919 0.0044 -0.1002 -0.1610 354 LYS B CB 9260 C CG . LYS B 373 ? 0.7310 0.5486 0.4668 0.0001 -0.0971 -0.1353 354 LYS B CG 9261 C CD . LYS B 373 ? 0.9425 0.7598 0.6805 0.0091 -0.0940 -0.1301 354 LYS B CD 9262 C CE . LYS B 373 ? 0.8423 0.6687 0.5810 0.0049 -0.0912 -0.1068 354 LYS B CE 9263 N NZ . LYS B 373 ? 0.9451 0.7760 0.6865 0.0134 -0.0882 -0.1029 354 LYS B NZ 9264 N N . CYS B 374 ? 0.9394 0.6978 0.6846 -0.0131 -0.1075 -0.1513 355 CYS B N 9265 C CA . CYS B 374 ? 0.9946 0.7324 0.7417 -0.0220 -0.1084 -0.1359 355 CYS B CA 9266 C C . CYS B 374 ? 1.0490 0.8009 0.7944 -0.0317 -0.1110 -0.1398 355 CYS B C 9267 O O . CYS B 374 ? 1.1158 0.8718 0.8607 -0.0402 -0.1105 -0.1244 355 CYS B O 9268 C CB . CYS B 374 ? 1.0680 0.7654 0.8234 -0.0200 -0.1111 -0.1364 355 CYS B CB 9269 S SG . CYS B 374 ? 1.1751 0.8487 0.9325 -0.0306 -0.1106 -0.1157 355 CYS B SG 9270 N N . ASP B 375 ? 1.0174 0.7779 0.7637 -0.0304 -0.1141 -0.1616 356 ASP B N 9271 C CA . ASP B 375 ? 1.1694 0.9465 0.9138 -0.0393 -0.1171 -0.1677 356 ASP B CA 9272 C C . ASP B 375 ? 1.0956 0.9131 0.8308 -0.0448 -0.1154 -0.1559 356 ASP B C 9273 O O . ASP B 375 ? 0.9196 0.7445 0.6548 -0.0544 -0.1174 -0.1452 356 ASP B O 9274 C CB . ASP B 375 ? 1.3092 1.0926 1.0575 -0.0360 -0.1206 -0.1968 356 ASP B CB 9275 C CG . ASP B 375 ? 1.3560 1.0995 1.1185 -0.0356 -0.1249 -0.2063 356 ASP B CG 9276 O OD1 . ASP B 375 ? 1.2868 1.0049 1.0527 -0.0419 -0.1256 -0.1902 356 ASP B OD1 9277 O OD2 . ASP B 375 ? 1.4018 1.1408 1.1743 -0.0292 -0.1277 -0.2299 356 ASP B OD2 9278 N N . GLU B 376 ? 1.0982 0.9424 0.8275 -0.0389 -0.1123 -0.1568 357 GLU B N 9279 C CA . GLU B 376 ? 1.0722 0.9563 0.7950 -0.0440 -0.1109 -0.1422 357 GLU B CA 9280 C C . GLU B 376 ? 1.0567 0.9299 0.7854 -0.0490 -0.1097 -0.1150 357 GLU B C 9281 O O . GLU B 376 ? 1.0425 0.9357 0.7727 -0.0577 -0.1116 -0.1007 357 GLU B O 9282 C CB . GLU B 376 ? 1.1038 1.0158 0.8211 -0.0362 -0.1071 -0.1476 357 GLU B CB 9283 C CG . GLU B 376 ? 1.2407 1.1931 0.9539 -0.0413 -0.1055 -0.1280 357 GLU B CG 9284 C CD . GLU B 376 ? 1.1918 1.1871 0.8971 -0.0499 -0.1086 -0.1318 357 GLU B CD 9285 O OE1 . GLU B 376 ? 1.0249 1.0185 0.7276 -0.0521 -0.1118 -0.1514 357 GLU B OE1 9286 O OE2 . GLU B 376 ? 1.0489 1.0812 0.7518 -0.0550 -0.1082 -0.1144 357 GLU B OE2 9287 N N . TRP B 377 ? 1.0394 0.8821 0.7732 -0.0434 -0.1070 -0.1087 358 TRP B N 9288 C CA . TRP B 377 ? 0.8899 0.7210 0.6315 -0.0474 -0.1055 -0.0869 358 TRP B CA 9289 C C . TRP B 377 ? 0.8447 0.6631 0.5921 -0.0572 -0.1084 -0.0814 358 TRP B C 9290 O O . TRP B 377 ? 0.9926 0.8233 0.7474 -0.0643 -0.1091 -0.0654 358 TRP B O 9291 C CB . TRP B 377 ? 0.7287 0.5292 0.4733 -0.0401 -0.1025 -0.0850 358 TRP B CB 9292 C CG . TRP B 377 ? 0.8419 0.6355 0.5954 -0.0433 -0.1002 -0.0657 358 TRP B CG 9293 C CD1 . TRP B 377 ? 0.9336 0.7468 0.6954 -0.0502 -0.1004 -0.0504 358 TRP B CD1 9294 C CD2 . TRP B 377 ? 0.8808 0.6477 0.6379 -0.0401 -0.0978 -0.0607 358 TRP B CD2 9295 N NE1 . TRP B 377 ? 0.9663 0.7663 0.7386 -0.0510 -0.0979 -0.0386 358 TRP B NE1 9296 C CE2 . TRP B 377 ? 0.9047 0.6778 0.6724 -0.0451 -0.0960 -0.0449 358 TRP B CE2 9297 C CE3 . TRP B 377 ? 0.8896 0.6299 0.6435 -0.0337 -0.0976 -0.0678 358 TRP B CE3 9298 C CZ2 . TRP B 377 ? 0.8341 0.5898 0.6074 -0.0440 -0.0933 -0.0384 358 TRP B CZ2 9299 C CZ3 . TRP B 377 ? 0.7688 0.4922 0.5266 -0.0332 -0.0953 -0.0583 358 TRP B CZ3 9300 C CH2 . TRP B 377 ? 0.8255 0.5577 0.5919 -0.0384 -0.0928 -0.0449 358 TRP B CH2 9301 N N . SER B 378 ? 0.8528 0.6465 0.5996 -0.0576 -0.1105 -0.0947 359 SER B N 9302 C CA . SER B 378 ? 0.9620 0.7419 0.7146 -0.0668 -0.1132 -0.0915 359 SER B CA 9303 C C . SER B 378 ? 1.0672 0.8785 0.8198 -0.0751 -0.1167 -0.0878 359 SER B C 9304 O O . SER B 378 ? 1.0680 0.8790 0.8292 -0.0833 -0.1181 -0.0752 359 SER B O 9305 C CB . SER B 378 ? 0.9064 0.6597 0.6593 -0.0655 -0.1158 -0.1087 359 SER B CB 9306 O OG . SER B 378 ? 0.8481 0.5890 0.6072 -0.0748 -0.1183 -0.1061 359 SER B OG 9307 N N . VAL B 379 ? 0.9876 0.8283 0.7314 -0.0732 -0.1183 -0.0990 360 VAL B N 9308 C CA . VAL B 379 ? 1.1385 1.0149 0.8803 -0.0814 -0.1224 -0.0952 360 VAL B CA 9309 C C . VAL B 379 ? 1.0857 0.9845 0.8343 -0.0854 -0.1219 -0.0704 360 VAL B C 9310 O O . VAL B 379 ? 1.0787 0.9862 0.8362 -0.0943 -0.1255 -0.0572 360 VAL B O 9311 C CB . VAL B 379 ? 1.0445 0.9525 0.7742 -0.0785 -0.1236 -0.1144 360 VAL B CB 9312 C CG1 . VAL B 379 ? 0.9794 0.9317 0.7053 -0.0874 -0.1276 -0.1060 360 VAL B CG1 9313 C CG2 . VAL B 379 ? 1.0313 0.9195 0.7601 -0.0762 -0.1258 -0.1403 360 VAL B CG2 9314 N N . ASN B 380 ? 0.9535 0.8613 0.7010 -0.0789 -0.1180 -0.0640 361 ASN B N 9315 C CA . ASN B 380 ? 0.9043 0.8323 0.6624 -0.0820 -0.1177 -0.0405 361 ASN B CA 9316 C C . ASN B 380 ? 0.8193 0.7220 0.5952 -0.0849 -0.1169 -0.0256 361 ASN B C 9317 O O . ASN B 380 ? 0.9628 0.8812 0.7542 -0.0898 -0.1186 -0.0063 361 ASN B O 9318 C CB . ASN B 380 ? 0.9262 0.8688 0.6800 -0.0739 -0.1135 -0.0389 361 ASN B CB 9319 C CG . ASN B 380 ? 0.9719 0.9574 0.7131 -0.0744 -0.1146 -0.0450 361 ASN B CG 9320 O OD1 . ASN B 380 ? 0.8845 0.9059 0.6295 -0.0812 -0.1174 -0.0283 361 ASN B OD1 9321 N ND2 . ASN B 380 ? 0.9218 0.9059 0.6499 -0.0674 -0.1125 -0.0687 361 ASN B ND2 9322 N N . SER B 381 ? 0.7575 0.6230 0.5333 -0.0823 -0.1145 -0.0347 362 SER B N 9323 C CA . SER B 381 ? 0.8602 0.7035 0.6515 -0.0849 -0.1126 -0.0239 362 SER B CA 9324 C C . SER B 381 ? 0.8132 0.6507 0.6139 -0.0945 -0.1162 -0.0212 362 SER B C 9325 O O . SER B 381 ? 0.8042 0.6227 0.6176 -0.0976 -0.1144 -0.0161 362 SER B O 9326 C CB . SER B 381 ? 0.8901 0.6997 0.6763 -0.0782 -0.1081 -0.0327 362 SER B CB 9327 O OG . SER B 381 ? 1.0375 0.8249 0.8173 -0.0802 -0.1095 -0.0453 362 SER B OG 9328 N N . VAL B 382 ? 0.7187 0.5748 0.5131 -0.0994 -0.1212 -0.0259 363 VAL B N 9329 C CA . VAL B 382 ? 0.8013 0.6569 0.6044 -0.1089 -0.1257 -0.0236 363 VAL B CA 9330 C C . VAL B 382 ? 0.8726 0.6914 0.6792 -0.1105 -0.1234 -0.0310 363 VAL B C 9331 O O . VAL B 382 ? 0.8890 0.7020 0.7101 -0.1179 -0.1249 -0.0244 363 VAL B O 9332 C CB . VAL B 382 ? 0.9662 0.8464 0.7896 -0.1161 -0.1297 -0.0023 363 VAL B CB 9333 C CG1 . VAL B 382 ? 0.9095 0.7730 0.7544 -0.1162 -0.1262 0.0087 363 VAL B CG1 9334 C CG2 . VAL B 382 ? 1.0274 0.9197 0.8557 -0.1256 -0.1364 -0.0009 363 VAL B CG2 9335 N N . GLY B 383 ? 0.8068 0.6022 0.6016 -0.1038 -0.1200 -0.0441 364 GLY B N 9336 C CA . GLY B 383 ? 0.7302 0.4931 0.5266 -0.1058 -0.1185 -0.0507 364 GLY B CA 9337 C C . GLY B 383 ? 0.8255 0.5662 0.6259 -0.1026 -0.1128 -0.0451 364 GLY B C 9338 O O . GLY B 383 ? 0.9268 0.6416 0.7259 -0.1034 -0.1111 -0.0499 364 GLY B O 9339 N N . LYS B 384 ? 0.7652 0.5178 0.5718 -0.0996 -0.1100 -0.0345 365 LYS B N 9340 C CA . LYS B 384 ? 0.8032 0.5400 0.6151 -0.0974 -0.1047 -0.0295 365 LYS B CA 9341 C C . LYS B 384 ? 0.8443 0.5620 0.6421 -0.0893 -0.1023 -0.0374 365 LYS B C 9342 O O . LYS B 384 ? 0.8865 0.5870 0.6850 -0.0888 -0.0987 -0.0353 365 LYS B O 9343 C CB . LYS B 384 ? 0.8628 0.6187 0.6885 -0.0962 -0.1030 -0.0177 365 LYS B CB 9344 C CG . LYS B 384 ? 0.7998 0.5700 0.6472 -0.1047 -0.1055 -0.0079 365 LYS B CG 9345 C CD . LYS B 384 ? 0.8632 0.6167 0.7229 -0.1105 -0.1022 -0.0083 365 LYS B CD 9346 C CE . LYS B 384 ? 0.8748 0.6427 0.7608 -0.1183 -0.1048 0.0003 365 LYS B CE 9347 N NZ . LYS B 384 ? 0.8035 0.5604 0.7053 -0.1233 -0.1002 -0.0013 365 LYS B NZ 9348 N N . ILE B 385 ? 0.8364 0.5593 0.6224 -0.0832 -0.1047 -0.0466 366 ILE B N 9349 C CA . ILE B 385 ? 0.7778 0.4817 0.5538 -0.0755 -0.1040 -0.0556 366 ILE B CA 9350 C C . ILE B 385 ? 0.9489 0.6435 0.7203 -0.0763 -0.1084 -0.0700 366 ILE B C 9351 O O . ILE B 385 ? 0.9338 0.6473 0.7036 -0.0786 -0.1116 -0.0763 366 ILE B O 9352 C CB . ILE B 385 ? 0.9176 0.6358 0.6875 -0.0657 -0.1027 -0.0571 366 ILE B CB 9353 C CG1 . ILE B 385 ? 0.8242 0.5522 0.6015 -0.0649 -0.0989 -0.0438 366 ILE B CG1 9354 C CG2 . ILE B 385 ? 0.9893 0.6874 0.7522 -0.0574 -0.1028 -0.0666 366 ILE B CG2 9355 C CD1 . ILE B 385 ? 0.7167 0.4234 0.4959 -0.0641 -0.0955 -0.0395 366 ILE B CD1 9356 N N . GLU B 386 ? 0.9212 0.5883 0.6924 -0.0750 -0.1089 -0.0747 367 GLU B N 9357 C CA . GLU B 386 ? 0.9240 0.5795 0.6954 -0.0744 -0.1135 -0.0898 367 GLU B CA 9358 C C . GLU B 386 ? 0.9780 0.6180 0.7478 -0.0644 -0.1142 -0.0969 367 GLU B C 9359 O O . GLU B 386 ? 1.0695 0.7089 0.8362 -0.0588 -0.1111 -0.0892 367 GLU B O 9360 C CB . GLU B 386 ? 0.7493 0.3845 0.5281 -0.0836 -0.1152 -0.0879 367 GLU B CB 9361 C CG . GLU B 386 ? 1.0982 0.7486 0.8813 -0.0934 -0.1154 -0.0824 367 GLU B CG 9362 C CD . GLU B 386 ? 1.1726 0.8036 0.9641 -0.1028 -0.1159 -0.0790 367 GLU B CD 9363 O OE1 . GLU B 386 ? 1.1262 0.7323 0.9198 -0.1023 -0.1165 -0.0801 367 GLU B OE1 9364 O OE2 . GLU B 386 ? 1.2065 0.8478 1.0039 -0.1111 -0.1160 -0.0741 367 GLU B OE2 9365 N N . CYS B 387 ? 1.0170 0.6449 0.7914 -0.0621 -0.1188 -0.1123 368 CYS B N 9366 C CA . CYS B 387 ? 0.9805 0.5962 0.7577 -0.0517 -0.1204 -0.1208 368 CYS B CA 9367 C C . CYS B 387 ? 1.0102 0.5945 0.8004 -0.0520 -0.1254 -0.1263 368 CYS B C 9368 O O . CYS B 387 ? 1.0731 0.6506 0.8711 -0.0579 -0.1291 -0.1347 368 CYS B O 9369 C CB . CYS B 387 ? 0.9458 0.5864 0.7194 -0.0443 -0.1211 -0.1385 368 CYS B CB 9370 S SG . CYS B 387 ? 1.7355 1.4096 1.4967 -0.0410 -0.1154 -0.1282 368 CYS B SG 9371 N N . VAL B 388 ? 0.8139 0.3798 0.6082 -0.0458 -0.1261 -0.1202 369 VAL B N 9372 C CA . VAL B 388 ? 0.8560 0.3931 0.6667 -0.0440 -0.1322 -0.1248 369 VAL B CA 9373 C C . VAL B 388 ? 0.9891 0.5218 0.8055 -0.0315 -0.1343 -0.1315 369 VAL B C 9374 O O . VAL B 388 ? 0.9830 0.5269 0.7892 -0.0260 -0.1303 -0.1238 369 VAL B O 9375 C CB . VAL B 388 ? 0.8569 0.3706 0.6713 -0.0523 -0.1326 -0.1044 369 VAL B CB 9376 C CG1 . VAL B 388 ? 0.8338 0.3506 0.6464 -0.0647 -0.1309 -0.1002 369 VAL B CG1 9377 C CG2 . VAL B 388 ? 1.0339 0.5509 0.8372 -0.0506 -0.1279 -0.0862 369 VAL B CG2 9378 N N . SER B 389 ? 1.2017 0.7187 1.0374 -0.0268 -0.1409 -0.1470 370 SER B N 9379 C CA . SER B 389 ? 1.1173 0.6295 0.9638 -0.0145 -0.1439 -0.1560 370 SER B CA 9380 C C . SER B 389 ? 1.0325 0.5116 0.8975 -0.0139 -0.1503 -0.1434 370 SER B C 9381 O O . SER B 389 ? 1.0509 0.5108 0.9236 -0.0231 -0.1533 -0.1326 370 SER B O 9382 C CB . SER B 389 ? 1.2042 0.7277 1.0635 -0.0080 -0.1470 -0.1867 370 SER B CB 9383 O OG . SER B 389 ? 1.3026 0.8618 1.1440 -0.0079 -0.1414 -0.1972 370 SER B OG 9384 N N . ALA B 390 ? 1.0993 0.5730 0.9723 -0.0034 -0.1527 -0.1438 371 ALA B N 9385 C CA . ALA B 390 ? 1.1800 0.6240 1.0749 -0.0015 -0.1605 -0.1325 371 ALA B CA 9386 C C . ALA B 390 ? 1.3102 0.7544 1.2200 0.0127 -0.1641 -0.1455 371 ALA B C 9387 O O . ALA B 390 ? 1.3652 0.8338 1.2619 0.0199 -0.1586 -0.1566 371 ALA B O 9388 C CB . ALA B 390 ? 1.1045 0.5412 0.9859 -0.0083 -0.1584 -0.1016 371 ALA B CB 9389 N N . GLU B 391 ? 1.2989 0.7165 1.2383 0.0165 -0.1736 -0.1435 372 GLU B N 9390 C CA . GLU B 391 ? 1.2258 0.6409 1.1867 0.0303 -0.1785 -0.1578 372 GLU B CA 9391 C C . GLU B 391 ? 1.1617 0.5848 1.1077 0.0364 -0.1755 -0.1414 372 GLU B C 9392 O O . GLU B 391 ? 1.1606 0.6013 1.1048 0.0470 -0.1727 -0.1566 372 GLU B O 9393 C CB . GLU B 391 ? 1.3487 0.7312 1.3505 0.0320 -0.1909 -0.1572 372 GLU B CB 9394 C CG . GLU B 391 ? 1.5341 0.9058 1.5559 0.0257 -0.1950 -0.1733 372 GLU B CG 9395 C CD . GLU B 391 ? 1.7640 1.1014 1.8304 0.0264 -0.2082 -0.1689 372 GLU B CD 9396 O OE1 . GLU B 391 ? 1.7689 1.0929 1.8522 0.0329 -0.2144 -0.1554 372 GLU B OE1 9397 O OE2 . GLU B 391 ? 1.7975 1.1293 1.8828 0.0197 -0.2100 -0.1760 372 GLU B OE2 9398 N N . THR B 392 ? 1.1950 0.6073 1.1306 0.0294 -0.1761 -0.1111 373 THR B N 9399 C CA . THR B 392 ? 1.1598 0.5779 1.0843 0.0345 -0.1749 -0.0945 373 THR B CA 9400 C C . THR B 392 ? 1.1451 0.5792 1.0358 0.0257 -0.1661 -0.0751 373 THR B C 9401 O O . THR B 392 ? 1.1814 0.6185 1.0595 0.0148 -0.1618 -0.0710 373 THR B O 9402 C CB . THR B 392 ? 1.2245 0.6163 1.1730 0.0359 -0.1859 -0.0748 373 THR B CB 9403 O OG1 . THR B 392 ? 1.3056 0.6837 1.2506 0.0221 -0.1879 -0.0507 373 THR B OG1 9404 C CG2 . THR B 392 ? 1.0655 0.4390 1.0547 0.0446 -0.1959 -0.0939 373 THR B CG2 9405 N N . THR B 393 ? 1.1495 0.5943 1.0282 0.0306 -0.1637 -0.0643 374 THR B N 9406 C CA . THR B 393 ? 1.0472 0.5075 0.8984 0.0231 -0.1562 -0.0468 374 THR B CA 9407 C C . THR B 393 ? 1.0745 0.5208 0.9238 0.0102 -0.1587 -0.0237 374 THR B C 9408 O O . THR B 393 ? 1.1318 0.5873 0.9645 -0.0002 -0.1522 -0.0181 374 THR B O 9409 C CB . THR B 393 ? 1.1240 0.5957 0.9677 0.0310 -0.1552 -0.0391 374 THR B CB 9410 O OG1 . THR B 393 ? 1.1628 0.6525 1.0052 0.0414 -0.1510 -0.0595 374 THR B OG1 9411 C CG2 . THR B 393 ? 1.1949 0.6816 1.0146 0.0225 -0.1484 -0.0215 374 THR B CG2 9412 N N . GLU B 394 ? 1.1882 0.6134 1.0566 0.0106 -0.1684 -0.0102 375 GLU B N 9413 C CA . GLU B 394 ? 1.1009 0.5151 0.9689 -0.0022 -0.1715 0.0147 375 GLU B CA 9414 C C . GLU B 394 ? 1.1199 0.5243 0.9930 -0.0127 -0.1709 0.0112 375 GLU B C 9415 O O . GLU B 394 ? 1.3421 0.7485 1.2041 -0.0254 -0.1681 0.0280 375 GLU B O 9416 C CB . GLU B 394 ? 1.0987 0.4934 0.9895 0.0007 -0.1835 0.0318 375 GLU B CB 9417 C CG . GLU B 394 ? 1.2192 0.6247 1.1036 0.0093 -0.1847 0.0394 375 GLU B CG 9418 C CD . GLU B 394 ? 1.3533 0.7420 1.2591 0.0100 -0.1972 0.0617 375 GLU B CD 9419 O OE1 . GLU B 394 ? 1.4524 0.8195 1.3813 0.0044 -0.2056 0.0709 375 GLU B OE1 9420 O OE2 . GLU B 394 ? 1.3549 0.7526 1.2559 0.0159 -0.1993 0.0709 375 GLU B OE2 9421 N N . ASP B 395 ? 1.0578 0.4537 0.9481 -0.0076 -0.1734 -0.0115 376 ASP B N 9422 C CA . ASP B 395 ? 1.1373 0.5257 1.0329 -0.0170 -0.1728 -0.0179 376 ASP B CA 9423 C C . ASP B 395 ? 1.1116 0.5224 0.9792 -0.0244 -0.1616 -0.0210 376 ASP B C 9424 O O . ASP B 395 ? 1.1661 0.5743 1.0302 -0.0363 -0.1595 -0.0141 376 ASP B O 9425 C CB . ASP B 395 ? 1.0887 0.4675 1.0090 -0.0093 -0.1779 -0.0452 376 ASP B CB 9426 C CG . ASP B 395 ? 1.4003 0.7522 1.3573 -0.0046 -0.1905 -0.0420 376 ASP B CG 9427 O OD1 . ASP B 395 ? 1.5971 0.9435 1.5777 0.0052 -0.1952 -0.0665 376 ASP B OD1 9428 O OD2 . ASP B 395 ? 1.4100 0.7478 1.3741 -0.0110 -0.1962 -0.0149 376 ASP B OD2 9429 N N . CYS B 396 ? 0.9250 0.3579 0.7752 -0.0175 -0.1547 -0.0310 377 CYS B N 9430 C CA . CYS B 396 ? 0.9642 0.4194 0.7919 -0.0235 -0.1449 -0.0331 377 CYS B CA 9431 C C . CYS B 396 ? 0.9976 0.4589 0.8104 -0.0335 -0.1406 -0.0106 377 CYS B C 9432 O O . CYS B 396 ? 1.1095 0.5768 0.9145 -0.0441 -0.1358 -0.0070 377 CYS B O 9433 C CB . CYS B 396 ? 0.9319 0.4097 0.7485 -0.0137 -0.1396 -0.0469 377 CYS B CB 9434 S SG . CYS B 396 ? 1.2011 0.6897 1.0232 -0.0082 -0.1390 -0.0761 377 CYS B SG 9435 N N . ILE B 397 ? 1.0348 0.4965 0.8446 -0.0302 -0.1424 0.0034 378 ILE B N 9436 C CA . ILE B 397 ? 0.9915 0.4628 0.7874 -0.0393 -0.1386 0.0236 378 ILE B CA 9437 C C . ILE B 397 ? 1.0587 0.5179 0.8602 -0.0528 -0.1408 0.0373 378 ILE B C 9438 O O . ILE B 397 ? 1.1606 0.6324 0.9501 -0.0635 -0.1342 0.0441 378 ILE B O 9439 C CB . ILE B 397 ? 0.9459 0.4179 0.7411 -0.0337 -0.1428 0.0371 378 ILE B CB 9440 C CG1 . ILE B 397 ? 0.8606 0.3471 0.6500 -0.0210 -0.1398 0.0242 378 ILE B CG1 9441 C CG2 . ILE B 397 ? 0.9231 0.4083 0.7040 -0.0444 -0.1392 0.0569 378 ILE B CG2 9442 C CD1 . ILE B 397 ? 0.9370 0.4265 0.7252 -0.0152 -0.1436 0.0363 378 ILE B CD1 9443 N N . ALA B 398 ? 0.9752 0.4106 0.7976 -0.0522 -0.1501 0.0406 379 ALA B N 9444 C CA . ALA B 398 ? 0.9786 0.4003 0.8107 -0.0649 -0.1533 0.0538 379 ALA B CA 9445 C C . ALA B 398 ? 1.0517 0.4773 0.8808 -0.0721 -0.1476 0.0410 379 ALA B C 9446 O O . ALA B 398 ? 1.0448 0.4711 0.8717 -0.0851 -0.1452 0.0525 379 ALA B O 9447 C CB . ALA B 398 ? 0.9416 0.3359 0.8026 -0.0614 -0.1655 0.0572 379 ALA B CB 9448 N N . LYS B 399 ? 1.0709 0.5010 0.9000 -0.0641 -0.1455 0.0178 380 LYS B N 9449 C CA . LYS B 399 ? 0.9287 0.3654 0.7546 -0.0701 -0.1408 0.0051 380 LYS B CA 9450 C C . LYS B 399 ? 0.9895 0.4503 0.7949 -0.0767 -0.1307 0.0095 380 LYS B C 9451 O O . LYS B 399 ? 0.9747 0.4400 0.7785 -0.0865 -0.1269 0.0090 380 LYS B O 9452 C CB . LYS B 399 ? 0.9324 0.3712 0.7642 -0.0601 -0.1422 -0.0202 380 LYS B CB 9453 C CG . LYS B 399 ? 0.9012 0.3192 0.7569 -0.0601 -0.1502 -0.0318 380 LYS B CG 9454 C CD . LYS B 399 ? 1.3014 0.7247 1.1637 -0.0480 -0.1522 -0.0578 380 LYS B CD 9455 C CE . LYS B 399 ? 1.3069 0.7132 1.1945 -0.0482 -0.1597 -0.0742 380 LYS B CE 9456 N NZ . LYS B 399 ? 1.3098 0.7209 1.1941 -0.0589 -0.1571 -0.0793 380 LYS B NZ 9457 N N . ILE B 400 ? 1.0679 0.5443 0.8603 -0.0711 -0.1267 0.0130 381 ILE B N 9458 C CA . ILE B 400 ? 0.9192 0.4183 0.6967 -0.0771 -0.1178 0.0175 381 ILE B CA 9459 C C . ILE B 400 ? 0.9936 0.4937 0.7681 -0.0896 -0.1162 0.0363 381 ILE B C 9460 O O . ILE B 400 ? 0.9756 0.4887 0.7454 -0.0993 -0.1098 0.0378 381 ILE B O 9461 C CB . ILE B 400 ? 0.9057 0.4214 0.6734 -0.0678 -0.1147 0.0155 381 ILE B CB 9462 C CG1 . ILE B 400 ? 0.9481 0.4677 0.7179 -0.0568 -0.1153 -0.0025 381 ILE B CG1 9463 C CG2 . ILE B 400 ? 0.9188 0.4576 0.6760 -0.0742 -0.1061 0.0194 381 ILE B CG2 9464 C CD1 . ILE B 400 ? 1.0215 0.5615 0.7826 -0.0494 -0.1106 -0.0054 381 ILE B CD1 9465 N N . MET B 401 ? 0.8723 0.3605 0.6511 -0.0896 -0.1223 0.0511 382 MET B N 9466 C CA . MET B 401 ? 0.8915 0.3824 0.6676 -0.1023 -0.1217 0.0713 382 MET B CA 9467 C C . MET B 401 ? 0.9448 0.4276 0.7292 -0.1145 -0.1212 0.0734 382 MET B C 9468 O O . MET B 401 ? 1.0207 0.5189 0.7980 -0.1260 -0.1146 0.0797 382 MET B O 9469 C CB . MET B 401 ? 0.9440 0.4213 0.7272 -0.1000 -0.1308 0.0885 382 MET B CB 9470 C CG . MET B 401 ? 0.8809 0.3690 0.6552 -0.0901 -0.1313 0.0904 382 MET B CG 9471 S SD . MET B 401 ? 1.1275 0.5955 0.9168 -0.0856 -0.1445 0.1091 382 MET B SD 9472 C CE . MET B 401 ? 1.1282 0.5995 0.9169 -0.1045 -0.1458 0.1374 382 MET B CE 9473 N N . ASN B 402 ? 0.8853 0.3450 0.6865 -0.1120 -0.1282 0.0668 383 ASN B N 9474 C CA . ASN B 402 ? 0.9684 0.4186 0.7802 -0.1235 -0.1289 0.0690 383 ASN B CA 9475 C C . ASN B 402 ? 0.9649 0.4251 0.7734 -0.1256 -0.1226 0.0514 383 ASN B C 9476 O O . ASN B 402 ? 1.0364 0.4931 0.8517 -0.1360 -0.1216 0.0525 383 ASN B O 9477 C CB . ASN B 402 ? 0.9901 0.4111 0.8258 -0.1220 -0.1400 0.0711 383 ASN B CB 9478 C CG . ASN B 402 ? 1.0916 0.5014 0.9377 -0.1083 -0.1446 0.0479 383 ASN B CG 9479 O OD1 . ASN B 402 ? 1.1381 0.5606 0.9750 -0.1036 -0.1395 0.0294 383 ASN B OD1 9480 N ND2 . ASN B 402 ? 1.0982 0.4858 0.9656 -0.1024 -0.1548 0.0489 383 ASN B ND2 9481 N N . GLY B 403 ? 0.8868 0.3600 0.6862 -0.1161 -0.1189 0.0364 384 GLY B N 9482 C CA . GLY B 403 ? 0.9085 0.3957 0.7044 -0.1182 -0.1131 0.0229 384 GLY B CA 9483 C C . GLY B 403 ? 1.0241 0.5044 0.8278 -0.1117 -0.1171 0.0040 384 GLY B C 9484 O O . GLY B 403 ? 1.0252 0.5178 0.8272 -0.1142 -0.1136 -0.0057 384 GLY B O 9485 N N . GLU B 404 ? 1.1478 0.6104 0.9617 -0.1037 -0.1248 -0.0016 385 GLU B N 9486 C CA . GLU B 404 ? 0.9001 0.3596 0.7216 -0.0971 -0.1287 -0.0223 385 GLU B CA 9487 C C . GLU B 404 ? 1.0504 0.5306 0.8597 -0.0872 -0.1249 -0.0338 385 GLU B C 9488 O O . GLU B 404 ? 1.1066 0.5957 0.9166 -0.0841 -0.1255 -0.0501 385 GLU B O 9489 C CB . GLU B 404 ? 0.9221 0.3582 0.7620 -0.0910 -0.1381 -0.0270 385 GLU B CB 9490 C CG . GLU B 404 ? 1.2838 0.6983 1.1411 -0.1010 -0.1433 -0.0161 385 GLU B CG 9491 C CD . GLU B 404 ? 1.4396 0.8301 1.3214 -0.0945 -0.1537 -0.0217 385 GLU B CD 9492 O OE1 . GLU B 404 ? 1.4029 0.7739 1.3025 -0.1018 -0.1594 -0.0083 385 GLU B OE1 9493 O OE2 . GLU B 404 ? 1.5332 0.9255 1.4189 -0.0824 -0.1563 -0.0397 385 GLU B OE2 9494 N N . ALA B 405 ? 1.0257 0.5155 0.8242 -0.0830 -0.1212 -0.0246 386 ALA B N 9495 C CA . ALA B 405 ? 1.0070 0.5178 0.7951 -0.0748 -0.1170 -0.0320 386 ALA B CA 9496 C C . ALA B 405 ? 0.8829 0.4102 0.6608 -0.0797 -0.1098 -0.0202 386 ALA B C 9497 O O . ALA B 405 ? 0.8479 0.3708 0.6252 -0.0878 -0.1082 -0.0071 386 ALA B O 9498 C CB . ALA B 405 ? 0.8146 0.3208 0.6040 -0.0620 -0.1207 -0.0367 386 ALA B CB 9499 N N . ASP B 406 ? 0.9473 0.4954 0.7190 -0.0752 -0.1055 -0.0250 387 ASP B N 9500 C CA . ASP B 406 ? 0.8871 0.4522 0.6538 -0.0793 -0.0989 -0.0168 387 ASP B CA 9501 C C . ASP B 406 ? 0.9423 0.5174 0.7032 -0.0703 -0.0972 -0.0147 387 ASP B C 9502 O O . ASP B 406 ? 1.0354 0.6168 0.7928 -0.0730 -0.0939 -0.0059 387 ASP B O 9503 C CB . ASP B 406 ? 0.9460 0.5287 0.7162 -0.0842 -0.0952 -0.0218 387 ASP B CB 9504 C CG . ASP B 406 ? 1.1141 0.6904 0.8904 -0.0956 -0.0952 -0.0207 387 ASP B CG 9505 O OD1 . ASP B 406 ? 1.0155 0.5792 0.7925 -0.1021 -0.0954 -0.0128 387 ASP B OD1 9506 O OD2 . ASP B 406 ? 1.2587 0.8443 1.0398 -0.0986 -0.0953 -0.0268 387 ASP B OD2 9507 N N . ALA B 407 ? 0.8432 0.4220 0.6034 -0.0600 -0.0994 -0.0236 388 ALA B N 9508 C CA . ALA B 407 ? 0.8320 0.4222 0.5880 -0.0514 -0.0976 -0.0222 388 ALA B CA 9509 C C . ALA B 407 ? 0.8959 0.4831 0.6522 -0.0396 -0.1015 -0.0313 388 ALA B C 9510 O O . ALA B 407 ? 1.0179 0.6007 0.7777 -0.0377 -0.1047 -0.0419 388 ALA B O 9511 C CB . ALA B 407 ? 0.7707 0.3846 0.5281 -0.0531 -0.0921 -0.0225 388 ALA B CB 9512 N N . MET B 408 ? 0.8150 0.4069 0.5685 -0.0318 -0.1012 -0.0283 389 MET B N 9513 C CA . MET B 408 ? 0.7622 0.3554 0.5170 -0.0201 -0.1039 -0.0374 389 MET B CA 9514 C C . MET B 408 ? 0.8107 0.4152 0.5624 -0.0137 -0.1017 -0.0321 389 MET B C 9515 O O . MET B 408 ? 0.9738 0.5806 0.7226 -0.0182 -0.0994 -0.0217 389 MET B O 9516 C CB . MET B 408 ? 0.9092 0.4790 0.6708 -0.0162 -0.1107 -0.0407 389 MET B CB 9517 C CG . MET B 408 ? 0.9849 0.5447 0.7478 -0.0105 -0.1141 -0.0318 389 MET B CG 9518 S SD . MET B 408 ? 1.1046 0.6351 0.8825 -0.0073 -0.1237 -0.0331 389 MET B SD 9519 C CE . MET B 408 ? 1.5926 1.1102 1.3690 -0.0220 -0.1243 -0.0155 389 MET B CE 9520 N N . SER B 409 ? 0.9101 0.5239 0.6629 -0.0035 -0.1021 -0.0403 390 SER B N 9521 C CA . SER B 409 ? 0.9835 0.6081 0.7349 0.0031 -0.1004 -0.0361 390 SER B CA 9522 C C . SER B 409 ? 0.9436 0.5524 0.6976 0.0109 -0.1059 -0.0345 390 SER B C 9523 O O . SER B 409 ? 0.8895 0.4864 0.6498 0.0164 -0.1105 -0.0431 390 SER B O 9524 C CB . SER B 409 ? 1.1768 0.8241 0.9292 0.0090 -0.0973 -0.0438 390 SER B CB 9525 O OG . SER B 409 ? 1.2086 0.8692 0.9615 0.0127 -0.0946 -0.0381 390 SER B OG 9526 N N . LEU B 410 ? 0.9175 0.5275 0.6687 0.0112 -0.1058 -0.0239 391 LEU B N 9527 C CA . LEU B 410 ? 0.8246 0.4200 0.5791 0.0169 -0.1121 -0.0182 391 LEU B CA 9528 C C . LEU B 410 ? 0.9634 0.5718 0.7165 0.0242 -0.1114 -0.0150 391 LEU B C 9529 O O . LEU B 410 ? 1.0536 0.6798 0.8022 0.0211 -0.1061 -0.0123 391 LEU B O 9530 C CB . LEU B 410 ? 0.8505 0.4318 0.6026 0.0074 -0.1150 -0.0042 391 LEU B CB 9531 C CG . LEU B 410 ? 0.9619 0.5261 0.7184 0.0005 -0.1174 -0.0055 391 LEU B CG 9532 C CD1 . LEU B 410 ? 0.9573 0.5116 0.7114 -0.0099 -0.1196 0.0110 391 LEU B CD1 9533 C CD2 . LEU B 410 ? 0.9702 0.5181 0.7396 0.0091 -0.1239 -0.0158 391 LEU B CD2 9534 N N . ASP B 411 ? 0.9386 0.5382 0.6983 0.0339 -0.1171 -0.0161 392 ASP B N 9535 C CA . ASP B 411 ? 0.9206 0.5308 0.6801 0.0408 -0.1178 -0.0121 392 ASP B CA 9536 C C . ASP B 411 ? 0.9525 0.5596 0.7063 0.0343 -0.1206 0.0043 392 ASP B C 9537 O O . ASP B 411 ? 1.0835 0.6772 0.8359 0.0262 -0.1233 0.0127 392 ASP B O 9538 C CB . ASP B 411 ? 1.1594 0.7621 0.9304 0.0535 -0.1234 -0.0194 392 ASP B CB 9539 C CG . ASP B 411 ? 1.2916 0.8691 1.0725 0.0542 -0.1326 -0.0131 392 ASP B CG 9540 O OD1 . ASP B 411 ? 1.1081 0.6803 0.8940 0.0588 -0.1388 -0.0035 392 ASP B OD1 9541 O OD2 . ASP B 411 ? 1.4907 1.0539 1.2762 0.0499 -0.1342 -0.0170 392 ASP B OD2 9542 N N . GLY B 412 ? 1.0567 0.6782 0.8075 0.0375 -0.1200 0.0087 393 GLY B N 9543 C CA . GLY B 412 ? 1.0443 0.6705 0.7878 0.0307 -0.1219 0.0230 393 GLY B CA 9544 C C . GLY B 412 ? 1.0387 0.6454 0.7843 0.0276 -0.1304 0.0368 393 GLY B C 9545 O O . GLY B 412 ? 1.1022 0.7096 0.8404 0.0165 -0.1304 0.0485 393 GLY B O 9546 N N . GLY B 413 ? 0.8144 0.4049 0.5724 0.0373 -0.1378 0.0354 394 GLY B N 9547 C CA . GLY B 413 ? 0.9503 0.5199 0.7167 0.0353 -0.1475 0.0490 394 GLY B CA 9548 C C . GLY B 413 ? 1.0407 0.5977 0.8061 0.0242 -0.1467 0.0528 394 GLY B C 9549 O O . GLY B 413 ? 1.0400 0.5938 0.8016 0.0144 -0.1501 0.0702 394 GLY B O 9550 N N . PHE B 414 ? 1.0716 0.6238 0.8401 0.0250 -0.1421 0.0371 395 PHE B N 9551 C CA . PHE B 414 ? 1.0031 0.5434 0.7720 0.0148 -0.1414 0.0388 395 PHE B CA 9552 C C . PHE B 414 ? 1.1852 0.7416 0.9384 0.0023 -0.1331 0.0433 395 PHE B C 9553 O O . PHE B 414 ? 1.3242 0.8731 1.0768 -0.0074 -0.1319 0.0460 395 PHE B O 9554 C CB . PHE B 414 ? 0.9294 0.4598 0.7086 0.0199 -0.1406 0.0199 395 PHE B CB 9555 C CG . PHE B 414 ? 0.9959 0.5034 0.7963 0.0271 -0.1504 0.0173 395 PHE B CG 9556 C CD1 . PHE B 414 ? 1.0365 0.5442 0.8487 0.0406 -0.1528 0.0030 395 PHE B CD1 9557 C CD2 . PHE B 414 ? 1.0601 0.5467 0.8716 0.0202 -0.1574 0.0290 395 PHE B CD2 9558 C CE1 . PHE B 414 ? 0.9978 0.4851 0.8342 0.0477 -0.1620 -0.0016 395 PHE B CE1 9559 C CE2 . PHE B 414 ? 1.0348 0.4995 0.8714 0.0269 -0.1673 0.0263 395 PHE B CE2 9560 C CZ . PHE B 414 ? 1.0121 0.4770 0.8620 0.0410 -0.1697 0.0099 395 PHE B CZ 9561 N N . VAL B 415 ? 1.0964 0.6754 0.8392 0.0024 -0.1276 0.0430 396 VAL B N 9562 C CA . VAL B 415 ? 1.0522 0.6486 0.7839 -0.0092 -0.1204 0.0465 396 VAL B CA 9563 C C . VAL B 415 ? 1.1185 0.7180 0.8438 -0.0179 -0.1241 0.0655 396 VAL B C 9564 O O . VAL B 415 ? 1.2196 0.8251 0.9385 -0.0302 -0.1206 0.0718 396 VAL B O 9565 C CB . VAL B 415 ? 0.9362 0.5570 0.6638 -0.0061 -0.1130 0.0367 396 VAL B CB 9566 C CG1 . VAL B 415 ? 0.8208 0.4606 0.5413 -0.0180 -0.1062 0.0389 396 VAL B CG1 9567 C CG2 . VAL B 415 ? 0.7422 0.3634 0.4760 0.0003 -0.1093 0.0210 396 VAL B CG2 9568 N N . TYR B 416 ? 1.0079 0.6048 0.7355 -0.0117 -0.1316 0.0752 397 TYR B N 9569 C CA . TYR B 416 ? 0.9189 0.5205 0.6408 -0.0197 -0.1370 0.0960 397 TYR B CA 9570 C C . TYR B 416 ? 0.9973 0.5794 0.7252 -0.0286 -0.1422 0.1095 397 TYR B C 9571 O O . TYR B 416 ? 1.0979 0.6902 0.8171 -0.0417 -0.1406 0.1227 397 TYR B O 9572 C CB . TYR B 416 ? 0.9301 0.5309 0.6568 -0.0102 -0.1457 0.1044 397 TYR B CB 9573 C CG . TYR B 416 ? 0.9996 0.6091 0.7202 -0.0187 -0.1524 0.1283 397 TYR B CG 9574 C CD1 . TYR B 416 ? 0.9892 0.6298 0.6941 -0.0254 -0.1481 0.1323 397 TYR B CD1 9575 C CD2 . TYR B 416 ? 1.0041 0.5931 0.7365 -0.0206 -0.1633 0.1470 397 TYR B CD2 9576 C CE1 . TYR B 416 ? 1.2306 0.8841 0.9282 -0.0343 -0.1542 0.1547 397 TYR B CE1 9577 C CE2 . TYR B 416 ? 1.0469 0.6467 0.7741 -0.0296 -0.1701 0.1720 397 TYR B CE2 9578 C CZ . TYR B 416 ? 1.1869 0.8203 0.8949 -0.0366 -0.1654 0.1760 397 TYR B CZ 9579 O OH . TYR B 416 ? 1.2468 0.8956 0.9478 -0.0464 -0.1722 0.2013 397 TYR B OH 9580 N N . ILE B 417 ? 1.0458 0.6013 0.7901 -0.0216 -0.1483 0.1055 398 ILE B N 9581 C CA . ILE B 417 ? 1.1427 0.6771 0.8977 -0.0292 -0.1540 0.1168 398 ILE B CA 9582 C C . ILE B 417 ? 1.1434 0.6803 0.8921 -0.0400 -0.1456 0.1101 398 ILE B C 9583 O O . ILE B 417 ? 1.1166 0.6521 0.8639 -0.0526 -0.1466 0.1249 398 ILE B O 9584 C CB . ILE B 417 ? 0.9726 0.4780 0.7520 -0.0182 -0.1637 0.1118 398 ILE B CB 9585 C CG1 . ILE B 417 ? 0.9216 0.4069 0.7128 -0.0233 -0.1642 0.1062 398 ILE B CG1 9586 C CG2 . ILE B 417 ? 1.0815 0.5894 0.8644 -0.0030 -0.1616 0.0909 398 ILE B CG2 9587 C CD1 . ILE B 417 ? 1.1996 0.6723 1.0000 -0.0348 -0.1717 0.1296 398 ILE B CD1 9588 N N . ALA B 418 ? 1.0333 0.5758 0.7788 -0.0356 -0.1377 0.0891 399 ALA B N 9589 C CA . ALA B 418 ? 0.9731 0.5202 0.7139 -0.0453 -0.1299 0.0821 399 ALA B CA 9590 C C . ALA B 418 ? 0.9927 0.5636 0.7192 -0.0580 -0.1234 0.0915 399 ALA B C 9591 O O . ALA B 418 ? 0.8789 0.4511 0.6039 -0.0696 -0.1197 0.0947 399 ALA B O 9592 C CB . ALA B 418 ? 0.8593 0.4122 0.6000 -0.0382 -0.1235 0.0603 399 ALA B CB 9593 N N . GLY B 419 ? 0.9937 0.5854 0.7110 -0.0558 -0.1218 0.0945 400 GLY B N 9594 C CA . GLY B 419 ? 0.9682 0.5871 0.6729 -0.0672 -0.1158 0.1007 400 GLY B CA 9595 C C . GLY B 419 ? 1.1222 0.7418 0.8232 -0.0785 -0.1210 0.1239 400 GLY B C 9596 O O . GLY B 419 ? 1.2770 0.9129 0.9706 -0.0919 -0.1155 0.1291 400 GLY B O 9597 N N . LYS B 420 ? 1.1219 0.7252 0.8299 -0.0735 -0.1318 0.1385 401 LYS B N 9598 C CA . LYS B 420 ? 1.0494 0.6500 0.7582 -0.0841 -0.1389 0.1643 401 LYS B CA 9599 C C . LYS B 420 ? 1.0754 0.6571 0.7937 -0.0929 -0.1390 0.1676 401 LYS B C 9600 O O . LYS B 420 ? 1.1878 0.7706 0.9068 -0.1051 -0.1427 0.1887 401 LYS B O 9601 C CB . LYS B 420 ? 0.9769 0.5607 0.6974 -0.0754 -0.1521 0.1788 401 LYS B CB 9602 C CG . LYS B 420 ? 0.9523 0.5590 0.6624 -0.0716 -0.1544 0.1855 401 LYS B CG 9603 C CD . LYS B 420 ? 1.0681 0.7026 0.7638 -0.0871 -0.1546 0.2078 401 LYS B CD 9604 C CE . LYS B 420 ? 1.0968 0.7522 0.7846 -0.0835 -0.1601 0.2183 401 LYS B CE 9605 N NZ . LYS B 420 ? 1.1337 0.8179 0.8079 -0.0996 -0.1621 0.2431 401 LYS B NZ 9606 N N . CYS B 421 ? 1.0060 0.5722 0.7320 -0.0870 -0.1352 0.1473 402 CYS B N 9607 C CA . CYS B 421 ? 1.0291 0.5777 0.7649 -0.0944 -0.1350 0.1468 402 CYS B CA 9608 C C . CYS B 421 ? 1.1038 0.6708 0.8298 -0.1038 -0.1232 0.1355 402 CYS B C 9609 O O . CYS B 421 ? 1.0205 0.5759 0.7538 -0.1100 -0.1217 0.1321 402 CYS B O 9610 C CB . CYS B 421 ? 0.8970 0.4166 0.6504 -0.0825 -0.1402 0.1321 402 CYS B CB 9611 S SG . CYS B 421 ? 1.1082 0.6002 0.8835 -0.0740 -0.1556 0.1456 402 CYS B SG 9612 N N . GLY B 422 ? 1.1186 0.7145 0.8307 -0.1047 -0.1152 0.1287 403 GLY B N 9613 C CA . GLY B 422 ? 0.8443 0.4612 0.5502 -0.1143 -0.1044 0.1191 403 GLY B CA 9614 C C . GLY B 422 ? 0.9699 0.5872 0.6801 -0.1070 -0.0981 0.0957 403 GLY B C 9615 O O . GLY B 422 ? 0.8828 0.5135 0.5932 -0.1143 -0.0902 0.0868 403 GLY B O 9616 N N . LEU B 423 ? 0.9673 0.5713 0.6823 -0.0929 -0.1020 0.0863 404 LEU B N 9617 C CA . LEU B 423 ? 0.8854 0.4925 0.6045 -0.0859 -0.0970 0.0667 404 LEU B CA 9618 C C . LEU B 423 ? 0.9243 0.5562 0.6386 -0.0814 -0.0918 0.0591 404 LEU B C 9619 O O . LEU B 423 ? 0.9345 0.5767 0.6421 -0.0796 -0.0938 0.0667 404 LEU B O 9620 C CB . LEU B 423 ? 0.7925 0.3766 0.5200 -0.0739 -0.1030 0.0591 404 LEU B CB 9621 C CG . LEU B 423 ? 0.9641 0.5228 0.7008 -0.0772 -0.1089 0.0631 404 LEU B CG 9622 C CD1 . LEU B 423 ? 0.8110 0.3531 0.5571 -0.0654 -0.1131 0.0493 404 LEU B CD1 9623 C CD2 . LEU B 423 ? 0.8720 0.4346 0.6095 -0.0898 -0.1036 0.0623 404 LEU B CD2 9624 N N . VAL B 424 ? 0.8764 0.5184 0.5961 -0.0798 -0.0857 0.0444 405 VAL B N 9625 C CA . VAL B 424 ? 0.9171 0.5819 0.6376 -0.0756 -0.0810 0.0357 405 VAL B CA 9626 C C . VAL B 424 ? 0.8744 0.5354 0.6028 -0.0644 -0.0812 0.0241 405 VAL B C 9627 O O . VAL B 424 ? 0.9321 0.5805 0.6658 -0.0633 -0.0822 0.0194 405 VAL B O 9628 C CB . VAL B 424 ? 0.8439 0.5323 0.5682 -0.0861 -0.0727 0.0296 405 VAL B CB 9629 C CG1 . VAL B 424 ? 0.7311 0.4336 0.4455 -0.0965 -0.0715 0.0400 405 VAL B CG1 9630 C CG2 . VAL B 424 ? 0.7311 0.4115 0.4641 -0.0918 -0.0702 0.0243 405 VAL B CG2 9631 N N . PRO B 425 ? 0.7774 0.4515 0.5068 -0.0566 -0.0806 0.0200 406 PRO B N 9632 C CA . PRO B 425 ? 0.8265 0.5029 0.5646 -0.0475 -0.0799 0.0101 406 PRO B CA 9633 C C . PRO B 425 ? 0.8328 0.5265 0.5835 -0.0525 -0.0736 0.0016 406 PRO B C 9634 O O . PRO B 425 ? 0.8969 0.6087 0.6513 -0.0585 -0.0692 -0.0006 406 PRO B O 9635 C CB . PRO B 425 ? 0.7623 0.4477 0.4984 -0.0386 -0.0817 0.0106 406 PRO B CB 9636 C CG . PRO B 425 ? 0.7747 0.4730 0.5037 -0.0456 -0.0806 0.0168 406 PRO B CG 9637 C CD . PRO B 425 ? 0.7089 0.3951 0.4310 -0.0553 -0.0820 0.0260 406 PRO B CD 9638 N N . VAL B 426 ? 0.8405 0.5301 0.5993 -0.0504 -0.0736 -0.0034 407 VAL B N 9639 C CA . VAL B 426 ? 0.8278 0.5325 0.6026 -0.0547 -0.0693 -0.0096 407 VAL B CA 9640 C C . VAL B 426 ? 0.9375 0.6556 0.7239 -0.0468 -0.0689 -0.0136 407 VAL B C 9641 O O . VAL B 426 ? 1.0764 0.8123 0.8785 -0.0489 -0.0655 -0.0179 407 VAL B O 9642 C CB . VAL B 426 ? 0.7321 0.4275 0.5108 -0.0587 -0.0702 -0.0106 407 VAL B CB 9643 C CG1 . VAL B 426 ? 0.6793 0.3815 0.4670 -0.0701 -0.0662 -0.0121 407 VAL B CG1 9644 C CG2 . VAL B 426 ? 0.7559 0.4290 0.5212 -0.0567 -0.0751 -0.0072 407 VAL B CG2 9645 N N . LEU B 427 ? 0.8333 0.5437 0.6141 -0.0378 -0.0725 -0.0129 408 LEU B N 9646 C CA . LEU B 427 ? 0.7592 0.4827 0.5506 -0.0307 -0.0725 -0.0151 408 LEU B CA 9647 C C . LEU B 427 ? 0.7284 0.4473 0.5102 -0.0200 -0.0755 -0.0146 408 LEU B C 9648 O O . LEU B 427 ? 0.7407 0.4432 0.5098 -0.0168 -0.0789 -0.0134 408 LEU B O 9649 C CB . LEU B 427 ? 0.7272 0.4532 0.5261 -0.0320 -0.0732 -0.0156 408 LEU B CB 9650 C CG . LEU B 427 ? 0.6839 0.4160 0.4969 -0.0419 -0.0710 -0.0157 408 LEU B CG 9651 C CD1 . LEU B 427 ? 0.6400 0.3679 0.4519 -0.0443 -0.0734 -0.0149 408 LEU B CD1 9652 C CD2 . LEU B 427 ? 0.7090 0.4613 0.5458 -0.0426 -0.0688 -0.0165 408 LEU B CD2 9653 N N . ALA B 428 ? 0.6788 0.4125 0.4698 -0.0145 -0.0745 -0.0158 409 ALA B N 9654 C CA . ALA B 428 ? 0.6556 0.3879 0.4404 -0.0042 -0.0770 -0.0159 409 ALA B CA 9655 C C . ALA B 428 ? 0.6914 0.4331 0.4831 0.0013 -0.0771 -0.0174 409 ALA B C 9656 O O . ALA B 428 ? 0.7391 0.4955 0.5457 -0.0021 -0.0751 -0.0164 409 ALA B O 9657 C CB . ALA B 428 ? 0.7477 0.4917 0.5374 -0.0019 -0.0760 -0.0162 409 ALA B CB 9658 N N . GLU B 429 ? 0.7079 0.4429 0.4904 0.0094 -0.0797 -0.0195 410 GLU B N 9659 C CA . GLU B 429 ? 0.7199 0.4687 0.5075 0.0149 -0.0794 -0.0214 410 GLU B CA 9660 C C . GLU B 429 ? 0.8957 0.6609 0.6944 0.0200 -0.0780 -0.0198 410 GLU B C 9661 O O . GLU B 429 ? 1.0795 0.8406 0.8750 0.0249 -0.0791 -0.0204 410 GLU B O 9662 C CB . GLU B 429 ? 0.6252 0.3642 0.4018 0.0221 -0.0822 -0.0272 410 GLU B CB 9663 C CG . GLU B 429 ? 0.8059 0.5316 0.5752 0.0174 -0.0839 -0.0307 410 GLU B CG 9664 C CD . GLU B 429 ? 1.0242 0.7418 0.7873 0.0251 -0.0869 -0.0396 410 GLU B CD 9665 O OE1 . GLU B 429 ? 0.9755 0.6958 0.7396 0.0342 -0.0877 -0.0424 410 GLU B OE1 9666 O OE2 . GLU B 429 ? 1.2084 0.9179 0.9679 0.0223 -0.0885 -0.0452 410 GLU B OE2 9667 N N . ASN B 430 ? 0.8349 0.6194 0.6482 0.0183 -0.0761 -0.0169 411 ASN B N 9668 C CA . ASN B 430 ? 0.7716 0.5729 0.5997 0.0223 -0.0750 -0.0148 411 ASN B CA 9669 C C . ASN B 430 ? 0.7901 0.6073 0.6207 0.0278 -0.0747 -0.0137 411 ASN B C 9670 O O . ASN B 430 ? 0.8051 0.6300 0.6345 0.0247 -0.0745 -0.0119 411 ASN B O 9671 C CB . ASN B 430 ? 0.7311 0.5443 0.5816 0.0148 -0.0734 -0.0110 411 ASN B CB 9672 C CG . ASN B 430 ? 0.7715 0.5795 0.6250 0.0125 -0.0727 -0.0147 411 ASN B CG 9673 O OD1 . ASN B 430 ? 0.8941 0.6890 0.7304 0.0151 -0.0738 -0.0175 411 ASN B OD1 9674 N ND2 . ASN B 430 ? 0.7635 0.5837 0.6405 0.0073 -0.0713 -0.0147 411 ASN B ND2 9675 N N . TYR B 431 ? 0.8107 0.6351 0.6449 0.0355 -0.0746 -0.0149 412 TYR B N 9676 C CA . TYR B 431 ? 0.7578 0.5991 0.5933 0.0414 -0.0737 -0.0149 412 TYR B CA 9677 C C . TYR B 431 ? 0.9009 0.7646 0.7585 0.0415 -0.0723 -0.0081 412 TYR B C 9678 O O . TYR B 431 ? 0.9350 0.8180 0.7968 0.0442 -0.0712 -0.0053 412 TYR B O 9679 C CB . TYR B 431 ? 0.7517 0.5827 0.5734 0.0514 -0.0752 -0.0230 412 TYR B CB 9680 C CG . TYR B 431 ? 0.7809 0.5876 0.5860 0.0511 -0.0776 -0.0287 412 TYR B CG 9681 C CD1 . TYR B 431 ? 0.7645 0.5693 0.5618 0.0475 -0.0777 -0.0320 412 TYR B CD1 9682 C CD2 . TYR B 431 ? 0.9466 0.7336 0.7450 0.0537 -0.0805 -0.0299 412 TYR B CD2 9683 C CE1 . TYR B 431 ? 0.8426 0.6249 0.6283 0.0469 -0.0804 -0.0372 412 TYR B CE1 9684 C CE2 . TYR B 431 ? 0.8859 0.6509 0.6724 0.0527 -0.0834 -0.0328 412 TYR B CE2 9685 C CZ . TYR B 431 ? 0.8733 0.6351 0.6546 0.0494 -0.0833 -0.0369 412 TYR B CZ 9686 O OH . TYR B 431 ? 0.8507 0.5900 0.6234 0.0482 -0.0866 -0.0399 412 TYR B OH 9687 N N . ASN B 432 ? 0.9083 0.7712 0.7814 0.0382 -0.0725 -0.0059 413 ASN B N 9688 C CA . ASN B 432 ? 0.7877 0.6703 0.6872 0.0377 -0.0719 -0.0001 413 ASN B CA 9689 C C . ASN B 432 ? 0.8973 0.7958 0.8169 0.0295 -0.0719 0.0103 413 ASN B C 9690 O O . ASN B 432 ? 0.9515 0.8433 0.8738 0.0222 -0.0725 0.0118 413 ASN B O 9691 C CB . ASN B 432 ? 0.8783 0.7562 0.7902 0.0372 -0.0724 -0.0044 413 ASN B CB 9692 C CG . ASN B 432 ? 0.9115 0.7833 0.8117 0.0458 -0.0733 -0.0109 413 ASN B CG 9693 O OD1 . ASN B 432 ? 0.9538 0.8196 0.8357 0.0525 -0.0738 -0.0132 413 ASN B OD1 9694 N ND2 . ASN B 432 ? 0.9765 0.8512 0.8893 0.0457 -0.0738 -0.0148 413 ASN B ND2 9695 N N . LYS B 433 ? 0.8709 0.7918 0.8063 0.0305 -0.0715 0.0187 414 LYS B N 9696 C CA . LYS B 433 ? 0.7405 0.6796 0.7010 0.0224 -0.0727 0.0321 414 LYS B CA 9697 C C . LYS B 433 ? 0.7434 0.6836 0.7378 0.0188 -0.0741 0.0337 414 LYS B C 9698 O O . LYS B 433 ? 0.7776 0.7254 0.7887 0.0229 -0.0740 0.0328 414 LYS B O 9699 C CB . LYS B 433 ? 0.6830 0.6486 0.6495 0.0238 -0.0721 0.0422 414 LYS B CB 9700 C CG . LYS B 433 ? 0.8666 0.8398 0.8068 0.0238 -0.0709 0.0421 414 LYS B CG 9701 C CD . LYS B 433 ? 1.0855 1.0839 1.0237 0.0283 -0.0688 0.0454 414 LYS B CD 9702 C CE . LYS B 433 ? 1.3159 1.3032 1.2410 0.0395 -0.0668 0.0316 414 LYS B CE 9703 N NZ . LYS B 433 ? 1.3442 1.3566 1.2664 0.0443 -0.0641 0.0324 414 LYS B NZ 9704 N N . SER B 434 ? 0.6872 0.6207 0.6935 0.0113 -0.0754 0.0346 415 SER B N 9705 C CA . SER B 434 ? 0.6589 0.5950 0.7019 0.0074 -0.0769 0.0336 415 SER B CA 9706 C C . SER B 434 ? 0.5711 0.5069 0.6323 -0.0019 -0.0790 0.0395 415 SER B C 9707 O O . SER B 434 ? 0.4994 0.4255 0.5375 -0.0048 -0.0787 0.0390 415 SER B O 9708 C CB . SER B 434 ? 0.6948 0.6165 0.7298 0.0110 -0.0752 0.0172 415 SER B CB 9709 O OG . SER B 434 ? 0.8266 0.7304 0.8370 0.0084 -0.0740 0.0100 415 SER B OG 9710 N N . ASP B 435 ? 0.4416 0.3881 0.5470 -0.0065 -0.0816 0.0445 416 ASP B N 9711 C CA . ASP B 435 ? 0.6367 0.5845 0.7672 -0.0152 -0.0846 0.0507 416 ASP B CA 9712 C C . ASP B 435 ? 0.6623 0.5918 0.7785 -0.0177 -0.0824 0.0363 416 ASP B C 9713 O O . ASP B 435 ? 0.6753 0.6015 0.7930 -0.0240 -0.0839 0.0407 416 ASP B O 9714 C CB . ASP B 435 ? 0.4211 0.3824 0.6082 -0.0187 -0.0883 0.0562 416 ASP B CB 9715 C CG . ASP B 435 ? 0.5721 0.5537 0.7791 -0.0180 -0.0911 0.0741 416 ASP B CG 9716 O OD1 . ASP B 435 ? 0.5136 0.5088 0.7613 -0.0244 -0.0963 0.0901 416 ASP B OD1 9717 O OD2 . ASP B 435 ? 0.5902 0.5752 0.7744 -0.0114 -0.0885 0.0729 416 ASP B OD2 9718 N N . ASN B 436 ? 0.7687 0.6881 0.8715 -0.0135 -0.0791 0.0198 417 ASN B N 9719 C CA . ASN B 436 ? 0.7752 0.6806 0.8647 -0.0167 -0.0767 0.0067 417 ASN B CA 9720 C C . ASN B 436 ? 0.7373 0.6261 0.7772 -0.0130 -0.0739 0.0012 417 ASN B C 9721 O O . ASN B 436 ? 0.9303 0.8101 0.9559 -0.0129 -0.0715 -0.0109 417 ASN B O 9722 C CB . ASN B 436 ? 0.6901 0.5999 0.8058 -0.0172 -0.0753 -0.0085 417 ASN B CB 9723 C CG . ASN B 436 ? 0.6540 0.5739 0.8202 -0.0237 -0.0779 -0.0082 417 ASN B CG 9724 O OD1 . ASN B 436 ? 0.6993 0.6155 0.8713 -0.0299 -0.0788 -0.0048 417 ASN B OD1 9725 N ND2 . ASN B 436 ? 0.5530 0.4860 0.7594 -0.0224 -0.0796 -0.0118 417 ASN B ND2 9726 N N . CYS B 437 ? 0.6780 0.5648 0.6938 -0.0105 -0.0748 0.0103 418 CYS B N 9727 C CA . CYS B 437 ? 0.7432 0.6145 0.7171 -0.0059 -0.0731 0.0053 418 CYS B CA 9728 C C . CYS B 437 ? 0.7625 0.6175 0.7197 -0.0110 -0.0719 -0.0013 418 CYS B C 9729 O O . CYS B 437 ? 0.8616 0.7040 0.7954 -0.0083 -0.0705 -0.0088 418 CYS B O 9730 C CB . CYS B 437 ? 0.5656 0.4408 0.5219 -0.0034 -0.0743 0.0139 418 CYS B CB 9731 S SG . CYS B 437 ? 1.1435 0.9982 1.0556 0.0008 -0.0734 0.0067 418 CYS B SG 9732 N N . GLU B 438 ? 0.7728 0.6289 0.7432 -0.0186 -0.0729 0.0026 419 GLU B N 9733 C CA . GLU B 438 ? 0.8294 0.6708 0.7836 -0.0240 -0.0717 -0.0023 419 GLU B CA 9734 C C . GLU B 438 ? 0.8022 0.6421 0.7669 -0.0279 -0.0690 -0.0131 419 GLU B C 9735 O O . GLU B 438 ? 0.7717 0.6014 0.7244 -0.0331 -0.0675 -0.0173 419 GLU B O 9736 C CB . GLU B 438 ? 0.7706 0.6150 0.7343 -0.0307 -0.0741 0.0058 419 GLU B CB 9737 C CG . GLU B 438 ? 0.9827 0.8453 0.9872 -0.0342 -0.0767 0.0141 419 GLU B CG 9738 C CD . GLU B 438 ? 0.9744 0.8426 0.9868 -0.0406 -0.0804 0.0252 419 GLU B CD 9739 O OE1 . GLU B 438 ? 0.9294 0.7860 0.9231 -0.0444 -0.0801 0.0224 419 GLU B OE1 9740 O OE2 . GLU B 438 ? 0.9794 0.8647 1.0175 -0.0422 -0.0840 0.0378 419 GLU B OE2 9741 N N . ASP B 439 ? 0.7868 0.6386 0.7742 -0.0257 -0.0683 -0.0182 420 ASP B N 9742 C CA . ASP B 439 ? 0.8352 0.6911 0.8337 -0.0294 -0.0654 -0.0311 420 ASP B CA 9743 C C . ASP B 439 ? 0.8750 0.7304 0.8537 -0.0239 -0.0639 -0.0381 420 ASP B C 9744 O O . ASP B 439 ? 0.9425 0.8020 0.9197 -0.0272 -0.0612 -0.0488 420 ASP B O 9745 C CB . ASP B 439 ? 0.9293 0.8022 0.9759 -0.0324 -0.0661 -0.0350 420 ASP B CB 9746 C CG . ASP B 439 ? 1.1302 1.0041 1.1998 -0.0406 -0.0666 -0.0345 420 ASP B CG 9747 O OD1 . ASP B 439 ? 1.0148 0.8807 1.0727 -0.0429 -0.0686 -0.0237 420 ASP B OD1 9748 O OD2 . ASP B 439 ? 1.2231 1.1072 1.3240 -0.0449 -0.0651 -0.0462 420 ASP B OD2 9749 N N . THR B 440 ? 0.9015 0.7542 0.8655 -0.0160 -0.0658 -0.0321 421 THR B N 9750 C CA . THR B 440 ? 0.9813 0.8355 0.9313 -0.0100 -0.0655 -0.0373 421 THR B CA 9751 C C . THR B 440 ? 0.9146 0.7529 0.8277 -0.0041 -0.0670 -0.0318 421 THR B C 9752 O O . THR B 440 ? 0.8286 0.6659 0.7375 0.0023 -0.0688 -0.0257 421 THR B O 9753 C CB . THR B 440 ? 1.1126 0.9824 1.0891 -0.0047 -0.0667 -0.0382 421 THR B CB 9754 O OG1 . THR B 440 ? 1.1048 0.9743 1.0813 -0.0002 -0.0688 -0.0268 421 THR B OG1 9755 C CG2 . THR B 440 ? 1.0200 0.9052 1.0393 -0.0102 -0.0662 -0.0448 421 THR B CG2 9756 N N . PRO B 441 ? 0.9153 0.7426 0.8041 -0.0065 -0.0665 -0.0340 422 PRO B N 9757 C CA . PRO B 441 ? 0.8982 0.7090 0.7565 -0.0014 -0.0689 -0.0291 422 PRO B CA 9758 C C . PRO B 441 ? 0.8229 0.6380 0.6767 0.0076 -0.0710 -0.0295 422 PRO B C 9759 O O . PRO B 441 ? 0.8966 0.7241 0.7578 0.0075 -0.0705 -0.0350 422 PRO B O 9760 C CB . PRO B 441 ? 0.8166 0.6205 0.6584 -0.0080 -0.0680 -0.0307 422 PRO B CB 9761 C CG . PRO B 441 ? 0.8920 0.7070 0.7530 -0.0171 -0.0644 -0.0367 422 PRO B CG 9762 C CD . PRO B 441 ? 0.8751 0.7074 0.7671 -0.0149 -0.0637 -0.0413 422 PRO B CD 9763 N N . GLU B 442 ? 0.8212 0.6278 0.6640 0.0153 -0.0733 -0.0250 423 GLU B N 9764 C CA . GLU B 442 ? 0.8553 0.6657 0.6952 0.0245 -0.0755 -0.0252 423 GLU B CA 9765 C C . GLU B 442 ? 0.9371 0.7376 0.7567 0.0260 -0.0785 -0.0243 423 GLU B C 9766 O O . GLU B 442 ? 1.0436 0.8295 0.8477 0.0219 -0.0795 -0.0211 423 GLU B O 9767 C CB . GLU B 442 ? 0.8843 0.6918 0.7216 0.0319 -0.0766 -0.0222 423 GLU B CB 9768 C CG . GLU B 442 ? 0.8348 0.6569 0.6927 0.0303 -0.0745 -0.0201 423 GLU B CG 9769 C CD . GLU B 442 ? 1.0118 0.8326 0.8620 0.0344 -0.0748 -0.0172 423 GLU B CD 9770 O OE1 . GLU B 442 ? 1.1635 0.9722 0.9957 0.0403 -0.0767 -0.0193 423 GLU B OE1 9771 O OE2 . GLU B 442 ? 0.9593 0.7932 0.8234 0.0315 -0.0736 -0.0129 423 GLU B OE2 9772 N N . ALA B 443 ? 0.8796 0.6892 0.7010 0.0314 -0.0804 -0.0259 424 ALA B N 9773 C CA . ALA B 443 ? 0.9187 0.7226 0.7229 0.0326 -0.0844 -0.0228 424 ALA B CA 9774 C C . ALA B 443 ? 1.0201 0.8031 0.8087 0.0389 -0.0888 -0.0166 424 ALA B C 9775 O O . ALA B 443 ? 1.1887 0.9599 0.9628 0.0362 -0.0922 -0.0108 424 ALA B O 9776 C CB . ALA B 443 ? 0.5903 0.4111 0.4018 0.0372 -0.0860 -0.0264 424 ALA B CB 9777 N N . GLY B 444 ? 0.9512 0.7315 0.7450 0.0467 -0.0889 -0.0181 425 GLY B N 9778 C CA . GLY B 444 ? 0.9092 0.6719 0.6933 0.0534 -0.0929 -0.0159 425 GLY B CA 9779 C C . GLY B 444 ? 0.9002 0.6674 0.6891 0.0649 -0.0956 -0.0177 425 GLY B C 9780 O O . GLY B 444 ? 1.0486 0.8325 0.8499 0.0681 -0.0929 -0.0212 425 GLY B O 9781 N N . TYR B 445 ? 0.8015 0.5540 0.5833 0.0709 -0.1015 -0.0149 426 TYR B N 9782 C CA . TYR B 445 ? 0.8704 0.6263 0.6581 0.0822 -0.1048 -0.0170 426 TYR B CA 9783 C C . TYR B 445 ? 1.0203 0.7730 0.8040 0.0848 -0.1117 -0.0102 426 TYR B C 9784 O O . TYR B 445 ? 1.0852 0.8382 0.8608 0.0769 -0.1133 -0.0037 426 TYR B O 9785 C CB . TYR B 445 ? 0.8145 0.5592 0.6040 0.0896 -0.1059 -0.0224 426 TYR B CB 9786 C CG . TYR B 445 ? 1.0056 0.7265 0.7882 0.0883 -0.1109 -0.0196 426 TYR B CG 9787 C CD1 . TYR B 445 ? 1.0960 0.8032 0.8803 0.0945 -0.1189 -0.0153 426 TYR B CD1 9788 C CD2 . TYR B 445 ? 1.0778 0.7900 0.8551 0.0808 -0.1082 -0.0208 426 TYR B CD2 9789 C CE1 . TYR B 445 ? 1.1198 0.8045 0.9025 0.0930 -0.1242 -0.0118 426 TYR B CE1 9790 C CE2 . TYR B 445 ? 0.9939 0.6842 0.7678 0.0793 -0.1130 -0.0185 426 TYR B CE2 9791 C CZ . TYR B 445 ? 1.0906 0.7668 0.8682 0.0853 -0.1211 -0.0139 426 TYR B CZ 9792 O OH . TYR B 445 ? 0.8648 0.5185 0.6434 0.0835 -0.1266 -0.0106 426 TYR B OH 9793 N N . PHE B 446 ? 0.9066 0.6587 0.6966 0.0955 -0.1160 -0.0115 427 PHE B N 9794 C CA . PHE B 446 ? 0.8184 0.5675 0.6066 0.0989 -0.1241 -0.0036 427 PHE B CA 9795 C C . PHE B 446 ? 0.8328 0.5627 0.6258 0.1078 -0.1311 -0.0024 427 PHE B C 9796 O O . PHE B 446 ? 0.8710 0.6003 0.6735 0.1161 -0.1294 -0.0120 427 PHE B O 9797 C CB . PHE B 446 ? 0.7007 0.4703 0.4971 0.1042 -0.1242 -0.0063 427 PHE B CB 9798 C CG . PHE B 446 ? 0.7653 0.5541 0.5602 0.0957 -0.1202 -0.0070 427 PHE B CG 9799 C CD1 . PHE B 446 ? 0.8606 0.6657 0.6669 0.0949 -0.1131 -0.0152 427 PHE B CD1 9800 C CD2 . PHE B 446 ? 0.7879 0.5806 0.5725 0.0883 -0.1238 0.0003 427 PHE B CD2 9801 C CE1 . PHE B 446 ? 0.7089 0.5319 0.5193 0.0875 -0.1099 -0.0180 427 PHE B CE1 9802 C CE2 . PHE B 446 ? 0.8074 0.6208 0.5930 0.0807 -0.1198 -0.0037 427 PHE B CE2 9803 C CZ . PHE B 446 ? 0.7708 0.5982 0.5708 0.0807 -0.1130 -0.0139 427 PHE B CZ 9804 N N . ALA B 447 ? 0.8389 0.5551 0.6275 0.1056 -0.1392 0.0092 428 ALA B N 9805 C CA . ALA B 447 ? 0.8135 0.5113 0.6122 0.1142 -0.1480 0.0120 428 ALA B CA 9806 C C . ALA B 447 ? 0.9410 0.6482 0.7476 0.1225 -0.1544 0.0158 428 ALA B C 9807 O O . ALA B 447 ? 0.8928 0.6119 0.6920 0.1178 -0.1575 0.0256 428 ALA B O 9808 C CB . ALA B 447 ? 0.8004 0.4790 0.5942 0.1071 -0.1547 0.0255 428 ALA B CB 9809 N N . VAL B 448 ? 0.8842 0.5887 0.7065 0.1347 -0.1564 0.0069 429 VAL B N 9810 C CA . VAL B 448 ? 0.8898 0.6050 0.7220 0.1436 -0.1618 0.0085 429 VAL B CA 9811 C C . VAL B 448 ? 0.9415 0.6398 0.7925 0.1544 -0.1718 0.0093 429 VAL B C 9812 O O . VAL B 448 ? 1.0417 0.7215 0.9007 0.1565 -0.1730 0.0043 429 VAL B O 9813 C CB . VAL B 448 ? 0.9199 0.6564 0.7577 0.1491 -0.1534 -0.0053 429 VAL B CB 9814 C CG1 . VAL B 448 ? 0.7044 0.4582 0.5301 0.1390 -0.1446 -0.0062 429 VAL B CG1 9815 C CG2 . VAL B 448 ? 0.8118 0.5441 0.6599 0.1561 -0.1484 -0.0203 429 VAL B CG2 9816 N N . ALA B 449 ? 0.8135 0.5189 0.6737 0.1614 -0.1792 0.0148 430 ALA B N 9817 C CA . ALA B 449 ? 0.8230 0.5149 0.7062 0.1730 -0.1893 0.0148 430 ALA B CA 9818 C C . ALA B 449 ? 0.7908 0.4983 0.6884 0.1849 -0.1859 0.0000 430 ALA B C 9819 O O . ALA B 449 ? 0.8143 0.5405 0.7093 0.1861 -0.1858 0.0027 430 ALA B O 9820 C CB . ALA B 449 ? 0.8100 0.4968 0.6954 0.1713 -0.2030 0.0365 430 ALA B CB 9821 N N . VAL B 450 ? 0.8899 0.5915 0.8033 0.1934 -0.1829 -0.0166 431 VAL B N 9822 C CA . VAL B 450 ? 0.8916 0.6111 0.8183 0.2038 -0.1777 -0.0324 431 VAL B CA 9823 C C . VAL B 450 ? 1.0053 0.7172 0.9598 0.2171 -0.1881 -0.0351 431 VAL B C 9824 O O . VAL B 450 ? 1.1570 0.8478 1.1278 0.2209 -0.1955 -0.0360 431 VAL B O 9825 C CB . VAL B 450 ? 0.7591 0.4856 0.6848 0.2043 -0.1658 -0.0517 431 VAL B CB 9826 C CG1 . VAL B 450 ? 0.7460 0.4968 0.6826 0.2129 -0.1593 -0.0658 431 VAL B CG1 9827 C CG2 . VAL B 450 ? 0.7446 0.4757 0.6462 0.1911 -0.1570 -0.0479 431 VAL B CG2 9828 N N . VAL B 451 ? 0.9336 0.6631 0.8965 0.2241 -0.1890 -0.0366 432 VAL B N 9829 C CA . VAL B 451 ? 0.8986 0.6250 0.8906 0.2376 -0.1980 -0.0411 432 VAL B CA 9830 C C . VAL B 451 ? 0.9234 0.6745 0.9250 0.2459 -0.1891 -0.0590 432 VAL B C 9831 O O . VAL B 451 ? 0.9594 0.7303 0.9448 0.2403 -0.1780 -0.0627 432 VAL B O 9832 C CB . VAL B 451 ? 1.0510 0.7743 1.0468 0.2380 -0.2119 -0.0200 432 VAL B CB 9833 C CG1 . VAL B 451 ? 1.0763 0.7765 1.0664 0.2300 -0.2219 -0.0005 432 VAL B CG1 9834 C CG2 . VAL B 451 ? 0.7855 0.5325 0.7619 0.2321 -0.2076 -0.0133 432 VAL B CG2 9835 N N . LYS B 452 ? 0.7871 0.5380 0.8177 0.2590 -0.1942 -0.0698 433 LYS B N 9836 C CA . LYS B 452 ? 1.0813 0.8578 1.1233 0.2672 -0.1870 -0.0849 433 LYS B CA 9837 C C . LYS B 452 ? 1.0361 0.8255 1.0775 0.2683 -0.1923 -0.0720 433 LYS B C 9838 O O . LYS B 452 ? 1.0013 0.7783 1.0458 0.2682 -0.2053 -0.0549 433 LYS B O 9839 C CB . LYS B 452 ? 1.0165 0.7904 1.0923 0.2812 -0.1903 -0.1033 433 LYS B CB 9840 C CG . LYS B 452 ? 1.0558 0.8164 1.1381 0.2815 -0.1874 -0.1184 433 LYS B CG 9841 C CD . LYS B 452 ? 1.0400 0.8048 1.1585 0.2958 -0.1891 -0.1414 433 LYS B CD 9842 C CE . LYS B 452 ? 1.0332 0.7804 1.1647 0.2969 -0.1901 -0.1558 433 LYS B CE 9843 N NZ . LYS B 452 ? 1.1771 0.8906 1.3087 0.2917 -0.2033 -0.1351 433 LYS B NZ 9844 N N . LYS B 453 ? 0.8853 0.7012 0.9238 0.2690 -0.1827 -0.0797 434 LYS B N 9845 C CA . LYS B 453 ? 0.9877 0.8186 1.0288 0.2707 -0.1871 -0.0708 434 LYS B CA 9846 C C . LYS B 453 ? 0.8985 0.7277 0.9699 0.2844 -0.1978 -0.0736 434 LYS B C 9847 O O . LYS B 453 ? 0.9988 0.8311 1.0747 0.2862 -0.2077 -0.0611 434 LYS B O 9848 C CB . LYS B 453 ? 0.9359 0.7955 0.9709 0.2678 -0.1741 -0.0787 434 LYS B CB 9849 C CG . LYS B 453 ? 0.8698 0.7332 0.8786 0.2539 -0.1658 -0.0724 434 LYS B CG 9850 C CD . LYS B 453 ? 0.8968 0.7884 0.9061 0.2513 -0.1546 -0.0783 434 LYS B CD 9851 C CE . LYS B 453 ? 0.8727 0.7677 0.8611 0.2377 -0.1475 -0.0718 434 LYS B CE 9852 N NZ . LYS B 453 ? 0.7005 0.6224 0.6940 0.2347 -0.1377 -0.0757 434 LYS B NZ 9853 N N . SER B 454 ? 0.8081 0.6339 0.9016 0.2939 -0.1961 -0.0909 435 SER B N 9854 C CA . SER B 454 ? 0.9792 0.8034 1.1070 0.3079 -0.2058 -0.0969 435 SER B CA 9855 C C . SER B 454 ? 1.1431 0.9394 1.2834 0.3100 -0.2236 -0.0803 435 SER B C 9856 O O . SER B 454 ? 1.1771 0.9716 1.3430 0.3194 -0.2355 -0.0760 435 SER B O 9857 C CB . SER B 454 ? 0.9938 0.8253 1.1436 0.3171 -0.1979 -0.1235 435 SER B CB 9858 O OG . SER B 454 ? 0.9504 0.7636 1.0962 0.3137 -0.1961 -0.1299 435 SER B OG 9859 N N . ALA B 455 ? 1.2906 1.0660 1.4139 0.3007 -0.2259 -0.0695 436 ALA B N 9860 C CA . ALA B 455 ? 1.4413 1.1894 1.5794 0.3018 -0.2424 -0.0536 436 ALA B CA 9861 C C . ALA B 455 ? 1.4201 1.1673 1.5461 0.2957 -0.2548 -0.0253 436 ALA B C 9862 O O . ALA B 455 ? 1.5014 1.2318 1.6150 0.2867 -0.2621 -0.0063 436 ALA B O 9863 C CB . ALA B 455 ? 1.5857 1.3123 1.7144 0.2946 -0.2399 -0.0544 436 ALA B CB 9864 N N . SER B 456 ? 1.3473 1.1147 1.4773 0.3000 -0.2572 -0.0229 437 SER B N 9865 C CA . SER B 456 ? 1.4109 1.1820 1.5330 0.2954 -0.2702 0.0021 437 SER B CA 9866 C C . SER B 456 ? 1.3038 1.0531 1.4540 0.3009 -0.2895 0.0183 437 SER B C 9867 O O . SER B 456 ? 1.2949 1.0347 1.4813 0.3135 -0.2940 0.0061 437 SER B O 9868 C CB . SER B 456 ? 1.4847 1.2828 1.6112 0.3007 -0.2691 -0.0023 437 SER B CB 9869 O OG . SER B 456 ? 1.5092 1.3135 1.6316 0.2974 -0.2832 0.0204 437 SER B OG 9870 N N . ASP B 457 ? 1.3122 1.0549 1.4483 0.2913 -0.3013 0.0458 438 ASP B N 9871 C CA . ASP B 457 ? 1.3536 1.1106 1.4488 0.2763 -0.2961 0.0582 438 ASP B CA 9872 C C . ASP B 457 ? 1.2617 1.0001 1.3379 0.2642 -0.2955 0.0700 438 ASP B C 9873 O O . ASP B 457 ? 1.2401 0.9607 1.3280 0.2623 -0.3096 0.0901 438 ASP B O 9874 C CB . ASP B 457 ? 1.5245 1.2979 1.6160 0.2737 -0.3099 0.0804 438 ASP B CB 9875 C CG . ASP B 457 ? 1.5943 1.3814 1.6467 0.2571 -0.3077 0.0956 438 ASP B CG 9876 O OD1 . ASP B 457 ? 1.5776 1.3745 1.6054 0.2501 -0.2919 0.0821 438 ASP B OD1 9877 O OD2 . ASP B 457 ? 1.5939 1.3836 1.6414 0.2508 -0.3220 0.1213 438 ASP B OD2 9878 N N . LEU B 458 ? 1.1626 0.9060 1.2112 0.2556 -0.2795 0.0586 439 LEU B N 9879 C CA . LEU B 458 ? 1.0695 0.7964 1.0998 0.2441 -0.2770 0.0668 439 LEU B CA 9880 C C . LEU B 458 ? 1.0723 0.8166 1.0650 0.2291 -0.2708 0.0762 439 LEU B C 9881 O O . LEU B 458 ? 1.1904 0.9547 1.1683 0.2272 -0.2586 0.0626 439 LEU B O 9882 C CB . LEU B 458 ? 1.0615 0.7765 1.0953 0.2469 -0.2637 0.0435 439 LEU B CB 9883 C CG . LEU B 458 ? 0.9828 0.6728 1.0505 0.2567 -0.2702 0.0361 439 LEU B CG 9884 C CD1 . LEU B 458 ? 0.9560 0.6472 1.0274 0.2617 -0.2551 0.0067 439 LEU B CD1 9885 C CD2 . LEU B 458 ? 0.9444 0.6104 1.0104 0.2480 -0.2792 0.0555 439 LEU B CD2 9886 N N . THR B 459 ? 1.0156 0.7537 0.9954 0.2183 -0.2794 0.0994 440 THR B N 9887 C CA . THR B 459 ? 1.0803 0.8338 1.0251 0.2029 -0.2727 0.1064 440 THR B CA 9888 C C . THR B 459 ? 1.0881 0.8223 1.0234 0.1924 -0.2751 0.1208 440 THR B C 9889 O O . THR B 459 ? 1.0405 0.7495 0.9976 0.1969 -0.2834 0.1272 440 THR B O 9890 C CB . THR B 459 ? 0.8687 0.6487 0.8012 0.1973 -0.2814 0.1229 440 THR B CB 9891 O OG1 . THR B 459 ? 0.9616 0.7333 0.8997 0.1932 -0.2982 0.1509 440 THR B OG1 9892 C CG2 . THR B 459 ? 0.8920 0.6888 0.8403 0.2088 -0.2834 0.1128 440 THR B CG2 9893 N N . TRP B 460 ? 1.1150 0.8619 1.0203 0.1782 -0.2680 0.1254 441 TRP B N 9894 C CA . TRP B 460 ? 1.1064 0.8388 0.9999 0.1666 -0.2690 0.1393 441 TRP B CA 9895 C C . TRP B 460 ? 1.2107 0.9408 1.1096 0.1616 -0.2868 0.1705 441 TRP B C 9896 O O . TRP B 460 ? 1.3390 1.0514 1.2385 0.1543 -0.2916 0.1858 441 TRP B O 9897 C CB . TRP B 460 ? 1.0597 0.8106 0.9211 0.1529 -0.2561 0.1340 441 TRP B CB 9898 C CG . TRP B 460 ? 1.1317 0.8721 0.9787 0.1396 -0.2558 0.1477 441 TRP B CG 9899 C CD1 . TRP B 460 ? 1.1313 0.8871 0.9594 0.1260 -0.2612 0.1688 441 TRP B CD1 9900 C CD2 . TRP B 460 ? 1.2496 0.9644 1.0998 0.1382 -0.2497 0.1409 441 TRP B CD2 9901 N NE1 . TRP B 460 ? 1.2407 0.9812 1.0608 0.1161 -0.2585 0.1763 441 TRP B NE1 9902 C CE2 . TRP B 460 ? 1.2945 1.0088 1.1283 0.1235 -0.2518 0.1593 441 TRP B CE2 9903 C CE3 . TRP B 460 ? 1.1446 0.8395 1.0099 0.1474 -0.2427 0.1206 441 TRP B CE3 9904 C CZ2 . TRP B 460 ? 1.1482 0.8404 0.9815 0.1182 -0.2474 0.1581 441 TRP B CZ2 9905 C CZ3 . TRP B 460 ? 1.0916 0.7658 0.9554 0.1420 -0.2386 0.1188 441 TRP B CZ3 9906 C CH2 . TRP B 460 ? 1.0739 0.7458 0.9225 0.1278 -0.2411 0.1375 441 TRP B CH2 9907 N N . ASP B 461 ? 1.1850 0.9337 1.0889 0.1651 -0.2971 0.1809 442 ASP B N 9908 C CA . ASP B 461 ? 1.3064 1.0592 1.2140 0.1593 -0.3150 0.2134 442 ASP B CA 9909 C C . ASP B 461 ? 1.3906 1.1144 1.3372 0.1699 -0.3301 0.2251 442 ASP B C 9910 O O . ASP B 461 ? 1.4629 1.1694 1.4179 0.1637 -0.3396 0.2468 442 ASP B O 9911 C CB . ASP B 461 ? 1.3424 1.1304 1.2392 0.1578 -0.3207 0.2204 442 ASP B CB 9912 C CG . ASP B 461 ? 1.3671 1.1855 1.2302 0.1474 -0.3066 0.2070 442 ASP B CG 9913 O OD1 . ASP B 461 ? 1.2946 1.1126 1.1369 0.1352 -0.2982 0.2077 442 ASP B OD1 9914 O OD2 . ASP B 461 ? 1.4246 1.2672 1.2845 0.1514 -0.3042 0.1950 442 ASP B OD2 9915 N N . ASN B 462 ? 1.4324 1.1516 1.4056 0.1858 -0.3325 0.2105 443 ASN B N 9916 C CA . ASN B 462 ? 1.5203 1.2130 1.5361 0.1976 -0.3466 0.2172 443 ASN B CA 9917 C C . ASN B 462 ? 1.4926 1.1562 1.5273 0.2053 -0.3377 0.1934 443 ASN B C 9918 O O . ASN B 462 ? 1.6421 1.2932 1.7101 0.2202 -0.3401 0.1775 443 ASN B O 9919 C CB . ASN B 462 ? 1.5438 1.2479 1.5826 0.2110 -0.3552 0.2140 443 ASN B CB 9920 C CG . ASN B 462 ? 1.4742 1.1892 1.5097 0.2207 -0.3394 0.1800 443 ASN B CG 9921 O OD1 . ASN B 462 ? 1.3773 1.0991 1.3867 0.2151 -0.3223 0.1624 443 ASN B OD1 9922 N ND2 . ASN B 462 ? 1.5567 1.2743 1.6208 0.2351 -0.3454 0.1717 443 ASN B ND2 9923 N N . LEU B 463 ? 1.2870 0.9422 1.3009 0.1948 -0.3275 0.1902 444 LEU B N 9924 C CA . LEU B 463 ? 1.2346 0.8653 1.2622 0.2001 -0.3186 0.1678 444 LEU B CA 9925 C C . LEU B 463 ? 1.3176 0.9174 1.3828 0.2033 -0.3336 0.1814 444 LEU B C 9926 O O . LEU B 463 ? 1.4364 1.0151 1.5275 0.2122 -0.3309 0.1613 444 LEU B O 9927 C CB . LEU B 463 ? 1.1244 0.7586 1.1167 0.1872 -0.3029 0.1603 444 LEU B CB 9928 C CG . LEU B 463 ? 1.2239 0.8500 1.2151 0.1921 -0.2866 0.1284 444 LEU B CG 9929 C CD1 . LEU B 463 ? 1.0892 0.7301 1.0881 0.2050 -0.2792 0.1042 444 LEU B CD1 9930 C CD2 . LEU B 463 ? 0.9183 0.5534 0.8726 0.1781 -0.2725 0.1250 444 LEU B CD2 9931 N N . LYS B 464 ? 1.1939 0.7932 1.2637 0.1956 -0.3499 0.2159 445 LYS B N 9932 C CA . LYS B 464 ? 1.2851 0.8560 1.3938 0.1970 -0.3666 0.2348 445 LYS B CA 9933 C C . LYS B 464 ? 1.3300 0.8930 1.4867 0.2122 -0.3708 0.2203 445 LYS B C 9934 O O . LYS B 464 ? 1.0618 0.6414 1.2273 0.2185 -0.3765 0.2244 445 LYS B O 9935 C CB . LYS B 464 ? 1.4230 1.0093 1.5225 0.1817 -0.3769 0.2741 445 LYS B CB 9936 C CG . LYS B 464 ? 1.4327 1.0031 1.5705 0.1774 -0.3854 0.2919 445 LYS B CG 9937 C CD . LYS B 464 ? 1.3421 0.9328 1.4668 0.1617 -0.3944 0.3310 445 LYS B CD 9938 C CE . LYS B 464 ? 1.3564 0.9307 1.5193 0.1563 -0.4034 0.3499 445 LYS B CE 9939 N NZ . LYS B 464 ? 1.4719 1.0683 1.6203 0.1398 -0.4115 0.3884 445 LYS B NZ 9940 N N . GLY B 465 ? 1.3251 0.8645 1.5134 0.2174 -0.3678 0.2022 446 GLY B N 9941 C CA . GLY B 465 ? 1.2553 0.7880 1.4913 0.2308 -0.3709 0.1853 446 GLY B CA 9942 C C . GLY B 465 ? 1.2159 0.7491 1.4564 0.2456 -0.3593 0.1451 446 GLY B C 9943 O O . GLY B 465 ? 1.0890 0.6214 1.3667 0.2573 -0.3598 0.1262 446 GLY B O 9944 N N . LYS B 466 ? 1.1110 0.6476 1.3136 0.2445 -0.3486 0.1318 447 LYS B N 9945 C CA . LYS B 466 ? 1.1119 0.6550 1.3128 0.2554 -0.3339 0.0935 447 LYS B CA 9946 C C . LYS B 466 ? 1.1528 0.6775 1.3588 0.2536 -0.3255 0.0734 447 LYS B C 9947 O O . LYS B 466 ? 1.2307 0.7385 1.4324 0.2429 -0.3300 0.0903 447 LYS B O 9948 C CB . LYS B 466 ? 1.1415 0.7145 1.2945 0.2493 -0.3183 0.0881 447 LYS B CB 9949 C CG . LYS B 466 ? 1.0703 0.6640 1.2126 0.2482 -0.3263 0.1092 447 LYS B CG 9950 C CD . LYS B 466 ? 1.1070 0.7020 1.2897 0.2644 -0.3366 0.1030 447 LYS B CD 9951 C CE . LYS B 466 ? 1.0907 0.7105 1.2604 0.2638 -0.3426 0.1196 447 LYS B CE 9952 N NZ . LYS B 466 ? 1.1217 0.7429 1.2777 0.2512 -0.3563 0.1576 447 LYS B NZ 9953 N N . LYS B 467 ? 1.1718 0.7019 1.3873 0.2635 -0.3135 0.0376 448 LYS B N 9954 C CA . LYS B 467 ? 1.2207 0.7369 1.4427 0.2626 -0.3056 0.0150 448 LYS B CA 9955 C C . LYS B 467 ? 1.2188 0.7510 1.3923 0.2523 -0.2861 0.0039 448 LYS B C 9956 O O . LYS B 467 ? 1.1706 0.7275 1.3243 0.2553 -0.2732 -0.0123 448 LYS B O 9957 C CB . LYS B 467 ? 1.1048 0.6201 1.3694 0.2782 -0.3042 -0.0189 448 LYS B CB 9958 N N . SER B 468 ? 1.1116 0.6299 1.2693 0.2401 -0.2846 0.0134 449 SER B N 9959 C CA . SER B 468 ? 1.1308 0.6629 1.2424 0.2282 -0.2687 0.0100 449 SER B CA 9960 C C . SER B 468 ? 1.0961 0.6275 1.2063 0.2290 -0.2561 -0.0199 449 SER B C 9961 O O . SER B 468 ? 1.1124 0.6262 1.2554 0.2348 -0.2611 -0.0343 449 SER B O 9962 C CB . SER B 468 ? 1.1738 0.6965 1.2626 0.2124 -0.2735 0.0408 449 SER B CB 9963 O OG . SER B 468 ? 1.1305 0.6253 1.2444 0.2097 -0.2829 0.0469 449 SER B OG 9964 N N . CYS B 469 ? 1.1740 0.7258 1.2475 0.2227 -0.2404 -0.0291 450 CYS B N 9965 C CA . CYS B 469 ? 1.0948 0.6509 1.1614 0.2214 -0.2280 -0.0546 450 CYS B CA 9966 C C . CYS B 469 ? 1.1495 0.7065 1.1792 0.2058 -0.2199 -0.0440 450 CYS B C 9967 O O . CYS B 469 ? 1.1582 0.7338 1.1569 0.1993 -0.2118 -0.0361 450 CYS B O 9968 C CB . CYS B 469 ? 0.9223 0.5066 0.9847 0.2296 -0.2158 -0.0794 450 CYS B CB 9969 S SG . CYS B 469 ? 1.2690 0.8547 1.3790 0.2485 -0.2221 -0.1027 450 CYS B SG 9970 N N . HIS B 470 ? 1.2058 0.7426 1.2416 0.2000 -0.2223 -0.0446 451 HIS B N 9971 C CA . HIS B 470 ? 1.1341 0.6703 1.1385 0.1854 -0.2152 -0.0356 451 HIS B CA 9972 C C . HIS B 470 ? 1.0552 0.5950 1.0573 0.1847 -0.2051 -0.0615 451 HIS B C 9973 O O . HIS B 470 ? 0.9083 0.4422 0.9386 0.1938 -0.2074 -0.0833 451 HIS B O 9974 C CB . HIS B 470 ? 1.1231 0.6343 1.1337 0.1764 -0.2267 -0.0104 451 HIS B CB 9975 C CG . HIS B 470 ? 1.0733 0.5786 1.0970 0.1786 -0.2404 0.0145 451 HIS B CG 9976 N ND1 . HIS B 470 ? 1.1136 0.6274 1.1119 0.1684 -0.2421 0.0414 451 HIS B ND1 9977 C CD2 . HIS B 470 ? 1.0338 0.5274 1.0948 0.1896 -0.2536 0.0167 451 HIS B CD2 9978 C CE1 . HIS B 470 ? 1.1457 0.6544 1.1627 0.1725 -0.2559 0.0603 451 HIS B CE1 9979 N NE2 . HIS B 470 ? 1.0649 0.5601 1.1210 0.1855 -0.2634 0.0467 451 HIS B NE2 9980 N N . THR B 471 ? 1.1022 0.6533 1.0719 0.1738 -0.1942 -0.0599 452 THR B N 9981 C CA . THR B 471 ? 1.1167 0.6732 1.0804 0.1710 -0.1851 -0.0810 452 THR B CA 9982 C C . THR B 471 ? 1.3030 0.8325 1.2880 0.1689 -0.1930 -0.0840 452 THR B C 9983 O O . THR B 471 ? 1.4534 0.9798 1.4631 0.1767 -0.1942 -0.1077 452 THR B O 9984 C CB . THR B 471 ? 1.1248 0.6954 1.0524 0.1583 -0.1742 -0.0736 452 THR B CB 9985 O OG1 . THR B 471 ? 1.0343 0.5899 0.9504 0.1473 -0.1792 -0.0485 452 THR B OG1 9986 C CG2 . THR B 471 ? 1.2554 0.8535 1.1663 0.1604 -0.1661 -0.0733 452 THR B CG2 9987 N N . ALA B 472 ? 1.3679 0.8799 1.3447 0.1580 -0.1982 -0.0606 453 ALA B N 9988 C CA . ALA B 472 ? 1.5343 1.0188 1.5334 0.1546 -0.2073 -0.0579 453 ALA B CA 9989 C C . ALA B 472 ? 1.5051 0.9755 1.4946 0.1432 -0.2145 -0.0243 453 ALA B C 9990 O O . ALA B 472 ? 1.5096 0.9943 1.4675 0.1347 -0.2084 -0.0093 453 ALA B O 9991 C CB . ALA B 472 ? 1.6810 1.1669 1.6727 0.1492 -0.1993 -0.0771 453 ALA B CB 9992 N N . VAL B 473 ? 1.3947 0.8390 1.4133 0.1426 -0.2277 -0.0127 454 VAL B N 9993 C CA . VAL B 473 ? 1.3585 0.7918 1.3701 0.1311 -0.2355 0.0213 454 VAL B CA 9994 C C . VAL B 473 ? 1.4063 0.8398 1.3913 0.1161 -0.2277 0.0273 454 VAL B C 9995 O O . VAL B 473 ? 1.5987 1.0219 1.5923 0.1140 -0.2254 0.0118 454 VAL B O 9996 C CB . VAL B 473 ? 1.3887 0.7942 1.4429 0.1340 -0.2528 0.0349 454 VAL B CB 9997 C CG1 . VAL B 473 ? 1.4539 0.8416 1.5414 0.1397 -0.2551 0.0090 454 VAL B CG1 9998 C CG2 . VAL B 473 ? 1.4159 0.8114 1.4618 0.1191 -0.2598 0.0701 454 VAL B CG2 9999 N N . GLY B 474 ? 1.2626 0.7099 1.2164 0.1055 -0.2237 0.0484 455 GLY B N 10000 C CA . GLY B 474 ? 1.2754 0.7262 1.2037 0.0911 -0.2158 0.0544 455 GLY B CA 10001 C C . GLY B 474 ? 1.4119 0.8885 1.3080 0.0891 -0.2007 0.0410 455 GLY B C 10002 O O . GLY B 474 ? 1.4428 0.9281 1.3149 0.0770 -0.1938 0.0489 455 GLY B O 10003 N N . ARG B 475 ? 1.4130 0.9027 1.3112 0.1007 -0.1959 0.0211 456 ARG B N 10004 C CA . ARG B 475 ? 1.3619 0.8767 1.2345 0.0996 -0.1826 0.0092 456 ARG B CA 10005 C C . ARG B 475 ? 1.3354 0.8690 1.1875 0.0956 -0.1803 0.0254 456 ARG B C 10006 O O . ARG B 475 ? 1.2272 0.7590 1.0863 0.0984 -0.1888 0.0406 456 ARG B O 10007 C CB . ARG B 475 ? 1.4000 0.9252 1.2828 0.1124 -0.1782 -0.0167 456 ARG B CB 10008 C CG . ARG B 475 ? 1.4752 0.9927 1.3693 0.1136 -0.1758 -0.0383 456 ARG B CG 10009 C CD . ARG B 475 ? 1.5028 1.0366 1.4052 0.1253 -0.1707 -0.0644 456 ARG B CD 10010 N NE . ARG B 475 ? 1.5307 1.0926 1.4095 0.1240 -0.1594 -0.0680 456 ARG B NE 10011 C CZ . ARG B 475 ? 1.5464 1.1290 1.4256 0.1306 -0.1524 -0.0885 456 ARG B CZ 10012 N NH1 . ARG B 475 ? 1.4815 1.0618 1.3822 0.1391 -0.1547 -0.1099 456 ARG B NH1 10013 N NH2 . ARG B 475 ? 1.5904 1.1980 1.4506 0.1282 -0.1431 -0.0879 456 ARG B NH2 10014 N N . THR B 476 ? 1.2854 0.8381 1.1144 0.0890 -0.1691 0.0213 457 THR B N 10015 C CA . THR B 476 ? 1.2844 0.8571 1.0945 0.0834 -0.1656 0.0335 457 THR B CA 10016 C C . THR B 476 ? 1.2891 0.8735 1.1043 0.0931 -0.1693 0.0353 457 THR B C 10017 O O . THR B 476 ? 1.3034 0.8857 1.1210 0.0923 -0.1780 0.0527 457 THR B O 10018 C CB . THR B 476 ? 1.3222 0.9143 1.1147 0.0778 -0.1530 0.0231 457 THR B CB 10019 O OG1 . THR B 476 ? 1.4953 1.0777 1.2844 0.0696 -0.1494 0.0194 457 THR B OG1 10020 C CG2 . THR B 476 ? 1.1081 0.7196 0.8844 0.0700 -0.1498 0.0346 457 THR B CG2 10021 N N . ALA B 477 ? 1.2667 0.8650 1.0836 0.1017 -0.1630 0.0184 458 ALA B N 10022 C CA . ALA B 477 ? 1.1400 0.7527 0.9608 0.1105 -0.1649 0.0186 458 ALA B CA 10023 C C . ALA B 477 ? 1.1407 0.7391 0.9852 0.1219 -0.1759 0.0194 458 ALA B C 10024 O O . ALA B 477 ? 1.1404 0.7448 0.9893 0.1266 -0.1821 0.0287 458 ALA B O 10025 C CB . ALA B 477 ? 0.9360 0.5693 0.7534 0.1153 -0.1546 0.0014 458 ALA B CB 10026 N N . GLY B 478 ? 1.0453 0.6256 0.9069 0.1265 -0.1787 0.0087 459 GLY B N 10027 C CA . GLY B 478 ? 1.0829 0.6500 0.9729 0.1385 -0.1886 0.0049 459 GLY B CA 10028 C C . GLY B 478 ? 1.1985 0.7452 1.1026 0.1361 -0.2027 0.0270 459 GLY B C 10029 O O . GLY B 478 ? 1.2365 0.7741 1.1660 0.1460 -0.2129 0.0285 459 GLY B O 10030 N N . TRP B 479 ? 1.1466 0.6875 1.0361 0.1227 -0.2038 0.0450 460 TRP B N 10031 C CA . TRP B 479 ? 1.0806 0.6032 0.9842 0.1185 -0.2175 0.0687 460 TRP B CA 10032 C C . TRP B 479 ? 1.1606 0.6934 1.0397 0.1039 -0.2178 0.0938 460 TRP B C 10033 O O . TRP B 479 ? 1.1563 0.6958 1.0357 0.1029 -0.2264 0.1137 460 TRP B O 10034 C CB . TRP B 479 ? 1.0594 0.5554 0.9849 0.1178 -0.2220 0.0634 460 TRP B CB 10035 C CG . TRP B 479 ? 1.2323 0.7074 1.1809 0.1149 -0.2377 0.0878 460 TRP B CG 10036 C CD1 . TRP B 479 ? 1.1899 0.6584 1.1304 0.1008 -0.2420 0.1125 460 TRP B CD1 10037 C CD2 . TRP B 479 ? 1.2272 0.6866 1.2136 0.1260 -0.2517 0.0911 460 TRP B CD2 10038 N NE1 . TRP B 479 ? 1.1071 0.5568 1.0777 0.1019 -0.2582 0.1330 460 TRP B NE1 10039 C CE2 . TRP B 479 ? 1.1773 0.6201 1.1777 0.1176 -0.2648 0.1202 460 TRP B CE2 10040 C CE3 . TRP B 479 ? 1.1330 0.5920 1.1447 0.1421 -0.2546 0.0725 460 TRP B CE3 10041 C CZ2 . TRP B 479 ? 1.2521 0.6764 1.2929 0.1248 -0.2815 0.1323 460 TRP B CZ2 10042 C CZ3 . TRP B 479 ? 1.1874 0.6281 1.2391 0.1499 -0.2706 0.0821 460 TRP B CZ3 10043 C CH2 . TRP B 479 ? 1.2524 0.6752 1.3194 0.1413 -0.2843 0.1123 460 TRP B CH2 10044 N N . ASN B 480 ? 1.1511 0.6874 1.0099 0.0923 -0.2087 0.0922 461 ASN B N 10045 C CA . ASN B 480 ? 1.1379 0.6844 0.9755 0.0773 -0.2085 0.1140 461 ASN B CA 10046 C C . ASN B 480 ? 1.1369 0.7110 0.9565 0.0756 -0.2072 0.1226 461 ASN B C 10047 O O . ASN B 480 ? 1.3223 0.9027 1.1385 0.0693 -0.2155 0.1459 461 ASN B O 10048 C CB . ASN B 480 ? 1.2265 0.7756 1.0461 0.0664 -0.1971 0.1063 461 ASN B CB 10049 C CG . ASN B 480 ? 1.4335 0.9562 1.2695 0.0647 -0.1999 0.1024 461 ASN B CG 10050 O OD1 . ASN B 480 ? 1.3586 0.8608 1.2176 0.0665 -0.2118 0.1143 461 ASN B OD1 10051 N ND2 . ASN B 480 ? 1.6132 1.1367 1.4399 0.0611 -0.1895 0.0859 461 ASN B ND2 10052 N N . ILE B 481 ? 1.0275 0.6195 0.8370 0.0809 -0.1972 0.1041 462 ILE B N 10053 C CA . ILE B 481 ? 0.8856 0.5049 0.6807 0.0799 -0.1954 0.1083 462 ILE B CA 10054 C C . ILE B 481 ? 1.0679 0.6888 0.8769 0.0890 -0.2074 0.1191 462 ILE B C 10055 O O . ILE B 481 ? 1.2806 0.9168 1.0802 0.0827 -0.2132 0.1375 462 ILE B O 10056 C CB . ILE B 481 ? 0.9289 0.5666 0.7144 0.0832 -0.1823 0.0863 462 ILE B CB 10057 C CG1 . ILE B 481 ? 0.9148 0.5534 0.6873 0.0732 -0.1716 0.0784 462 ILE B CG1 10058 C CG2 . ILE B 481 ? 1.1048 0.7703 0.8791 0.0820 -0.1813 0.0897 462 ILE B CG2 10059 C CD1 . ILE B 481 ? 0.9090 0.5665 0.6748 0.0748 -0.1599 0.0604 462 ILE B CD1 10060 N N . PRO B 482 ? 1.0387 0.6463 0.8706 0.1033 -0.2112 0.1074 463 PRO B N 10061 C CA . PRO B 482 ? 1.0955 0.7060 0.9424 0.1120 -0.2229 0.1176 463 PRO B CA 10062 C C . PRO B 482 ? 1.0801 0.6774 0.9387 0.1072 -0.2381 0.1456 463 PRO B C 10063 O O . PRO B 482 ? 1.1191 0.7316 0.9729 0.1045 -0.2461 0.1643 463 PRO B O 10064 C CB . PRO B 482 ? 1.0690 0.6669 0.9408 0.1279 -0.2228 0.0968 463 PRO B CB 10065 C CG . PRO B 482 ? 1.0945 0.6759 0.9691 0.1259 -0.2162 0.0826 463 PRO B CG 10066 C CD . PRO B 482 ? 1.0512 0.6454 0.8966 0.1123 -0.2054 0.0839 463 PRO B CD 10067 N N . MET B 483 ? 1.1777 0.7487 1.0526 0.1055 -0.2427 0.1492 464 MET B N 10068 C CA . MET B 483 ? 1.2018 0.7598 1.0901 0.0990 -0.2574 0.1783 464 MET B CA 10069 C C . MET B 483 ? 1.2297 0.8066 1.0893 0.0815 -0.2558 0.2000 464 MET B C 10070 O O . MET B 483 ? 1.3497 0.9279 1.2141 0.0747 -0.2682 0.2289 464 MET B O 10071 C CB . MET B 483 ? 1.1658 0.6911 1.0807 0.1003 -0.2621 0.1755 464 MET B CB 10072 C CG . MET B 483 ? 1.1402 0.6480 1.0880 0.1172 -0.2653 0.1539 464 MET B CG 10073 S SD . MET B 483 ? 1.3194 0.8355 1.2874 0.1305 -0.2772 0.1608 464 MET B SD 10074 C CE . MET B 483 ? 1.2034 0.7403 1.1565 0.1414 -0.2612 0.1266 464 MET B CE 10075 N N . GLY B 484 ? 1.2406 0.8339 1.0723 0.0739 -0.2408 0.1865 465 GLY B N 10076 C CA . GLY B 484 ? 1.3123 0.9293 1.1161 0.0576 -0.2373 0.2021 465 GLY B CA 10077 C C . GLY B 484 ? 1.3436 0.9918 1.1339 0.0559 -0.2410 0.2130 465 GLY B C 10078 O O . GLY B 484 ? 1.1742 0.8388 0.9531 0.0440 -0.2472 0.2376 465 GLY B O 10079 N N . LEU B 485 ? 1.3524 1.0099 1.1454 0.0679 -0.2378 0.1953 466 LEU B N 10080 C CA . LEU B 485 ? 1.3305 1.0166 1.1145 0.0686 -0.2420 0.2025 466 LEU B CA 10081 C C . LEU B 485 ? 1.4389 1.1173 1.2431 0.0733 -0.2602 0.2267 466 LEU B C 10082 O O . LEU B 485 ? 1.4921 1.1951 1.2873 0.0687 -0.2676 0.2438 466 LEU B O 10083 C CB . LEU B 485 ? 1.1614 0.8592 0.9451 0.0799 -0.2331 0.1760 466 LEU B CB 10084 C CG . LEU B 485 ? 1.1245 0.8417 0.8877 0.0741 -0.2168 0.1557 466 LEU B CG 10085 C CD1 . LEU B 485 ? 1.0986 0.8247 0.8422 0.0571 -0.2125 0.1657 466 LEU B CD1 10086 C CD2 . LEU B 485 ? 1.0576 0.7593 0.8297 0.0829 -0.2063 0.1303 466 LEU B CD2 10087 N N . LEU B 486 ? 1.4282 1.0736 1.2615 0.0819 -0.2679 0.2281 467 LEU B N 10088 C CA . LEU B 486 ? 1.5118 1.1455 1.3724 0.0877 -0.2862 0.2503 467 LEU B CA 10089 C C . LEU B 486 ? 1.5759 1.2016 1.4411 0.0746 -0.2977 0.2834 467 LEU B C 10090 O O . LEU B 486 ? 1.6449 1.2661 1.5308 0.0759 -0.3144 0.3086 467 LEU B O 10091 C CB . LEU B 486 ? 1.5831 1.1866 1.4792 0.1047 -0.2896 0.2328 467 LEU B CB 10092 C CG . LEU B 486 ? 1.6512 1.2640 1.5496 0.1191 -0.2820 0.2052 467 LEU B CG 10093 C CD1 . LEU B 486 ? 1.6963 1.2826 1.6334 0.1352 -0.2880 0.1917 467 LEU B CD1 10094 C CD2 . LEU B 486 ? 1.6651 1.3071 1.5529 0.1198 -0.2870 0.2152 467 LEU B CD2 10095 N N . TYR B 487 ? 1.5978 1.2226 1.4455 0.0615 -0.2892 0.2847 468 TYR B N 10096 C CA . TYR B 487 ? 1.6428 1.2638 1.4931 0.0472 -0.2990 0.3174 468 TYR B CA 10097 C C . TYR B 487 ? 1.7600 1.4196 1.5858 0.0345 -0.3039 0.3430 468 TYR B C 10098 O O . TYR B 487 ? 1.8841 1.5469 1.7162 0.0244 -0.3170 0.3772 468 TYR B O 10099 C CB . TYR B 487 ? 1.6964 1.3070 1.5354 0.0366 -0.2880 0.3105 468 TYR B CB 10100 C CG . TYR B 487 ? 1.8022 1.4004 1.6532 0.0240 -0.2988 0.3425 468 TYR B CG 10101 C CD1 . TYR B 487 ? 1.8576 1.4177 1.7470 0.0301 -0.3089 0.3469 468 TYR B CD1 10102 C CD2 . TYR B 487 ? 1.8903 1.5167 1.7164 0.0055 -0.2990 0.3677 468 TYR B CD2 10103 C CE1 . TYR B 487 ? 1.9404 1.4885 1.8447 0.0181 -0.3195 0.3774 468 TYR B CE1 10104 C CE2 . TYR B 487 ? 1.9747 1.5917 1.8127 -0.0071 -0.3090 0.3991 468 TYR B CE2 10105 C CZ . TYR B 487 ? 1.9571 1.5343 1.8351 -0.0007 -0.3190 0.4040 468 TYR B CZ 10106 O OH . TYR B 487 ? 1.8936 1.4703 1.7891 -0.0130 -0.3220 0.4268 468 TYR B OH 10107 N N . ASN B 488 ? 1.7941 1.4850 1.5936 0.0348 -0.2937 0.3261 469 ASN B N 10108 C CA . ASN B 488 ? 1.8195 1.5521 1.5954 0.0241 -0.2975 0.3446 469 ASN B CA 10109 C C . ASN B 488 ? 1.8920 1.6319 1.6837 0.0336 -0.3126 0.3578 469 ASN B C 10110 O O . ASN B 488 ? 1.8758 1.6528 1.6484 0.0286 -0.3146 0.3647 469 ASN B O 10111 C CB . ASN B 488 ? 1.7015 1.4664 1.4455 0.0195 -0.2804 0.3193 469 ASN B CB 10112 C CG . ASN B 488 ? 1.7889 1.5550 1.5152 0.0069 -0.2670 0.3116 469 ASN B CG 10113 O OD1 . ASN B 488 ? 1.8124 1.5996 1.5221 -0.0097 -0.2679 0.3317 469 ASN B OD1 10114 N ND2 . ASN B 488 ? 1.8539 1.5996 1.5839 0.0142 -0.2544 0.2827 469 ASN B ND2 10115 N N . LYS B 489 ? 1.9350 1.6404 1.7630 0.0473 -0.3232 0.3597 470 LYS B N 10116 C CA . LYS B 489 ? 1.9289 1.6364 1.7788 0.0572 -0.3393 0.3739 470 LYS B CA 10117 C C . LYS B 489 ? 1.8450 1.5312 1.7277 0.0546 -0.3560 0.4057 470 LYS B C 10118 O O . LYS B 489 ? 1.9996 1.7091 1.8874 0.0484 -0.3636 0.4296 470 LYS B O 10119 C CB . LYS B 489 ? 2.0083 1.6969 1.8796 0.0777 -0.3355 0.3430 470 LYS B CB 10120 C CG . LYS B 489 ? 1.9545 1.6634 1.8003 0.0814 -0.3175 0.3094 470 LYS B CG 10121 C CD . LYS B 489 ? 1.8151 1.5641 1.6420 0.0788 -0.3203 0.3149 470 LYS B CD 10122 C CE . LYS B 489 ? 1.6975 1.4588 1.5149 0.0881 -0.3061 0.2803 470 LYS B CE 10123 N NZ . LYS B 489 ? 1.6086 1.3428 1.4568 0.1070 -0.3072 0.2620 470 LYS B NZ 10124 N N . ILE B 490 ? 1.7256 1.3740 1.6336 0.0590 -0.3546 0.3974 471 ILE B N 10125 C CA . ILE B 490 ? 1.8555 1.4866 1.8017 0.0567 -0.3625 0.4159 471 ILE B CA 10126 C C . ILE B 490 ? 2.0018 1.6149 1.9481 0.0456 -0.3567 0.4189 471 ILE B C 10127 O O . ILE B 490 ? 2.0323 1.6141 1.9908 0.0532 -0.3519 0.3967 471 ILE B O 10128 C CB . ILE B 490 ? 1.7622 1.3647 1.7549 0.0758 -0.3694 0.4013 471 ILE B CB 10129 C CG1 . ILE B 490 ? 1.6024 1.1921 1.5891 0.0920 -0.3627 0.3662 471 ILE B CG1 10130 C CG2 . ILE B 490 ? 1.7661 1.3866 1.7770 0.0791 -0.3811 0.4197 471 ILE B CG2 10131 C CD1 . ILE B 490 ? 1.5016 1.0594 1.4941 0.0959 -0.3545 0.3423 471 ILE B CD1 10132 N N . ASN B 491 ? 2.0300 1.6650 1.9627 0.0274 -0.3572 0.4461 472 ASN B N 10133 C CA . ASN B 491 ? 2.0166 1.6425 1.9423 0.0140 -0.3508 0.4512 472 ASN B CA 10134 C C . ASN B 491 ? 2.0054 1.5936 1.9760 0.0180 -0.3554 0.4505 472 ASN B C 10135 O O . ASN B 491 ? 1.9211 1.5118 1.9083 0.0065 -0.3607 0.4747 472 ASN B O 10136 C CB . ASN B 491 ? 2.0053 1.6692 1.9074 -0.0066 -0.3504 0.4808 472 ASN B CB 10137 C CG . ASN B 491 ? 1.9416 1.6488 1.8023 -0.0115 -0.3462 0.4809 472 ASN B CG 10138 O OD1 . ASN B 491 ? 1.9569 1.6652 1.8089 0.0009 -0.3453 0.4614 472 ASN B OD1 10139 N ND2 . ASN B 491 ? 1.8902 1.6353 1.7266 -0.0298 -0.3437 0.5016 472 ASN B ND2 10140 N N . HIS B 492 ? 2.0388 1.5944 2.0296 0.0336 -0.3534 0.4216 473 HIS B N 10141 C CA . HIS B 492 ? 2.0372 1.5585 2.0704 0.0379 -0.3564 0.4144 473 HIS B CA 10142 C C . HIS B 492 ? 1.9299 1.4226 1.9708 0.0527 -0.3496 0.3766 473 HIS B C 10143 O O . HIS B 492 ? 1.8286 1.3234 1.8593 0.0654 -0.3471 0.3565 473 HIS B O 10144 C CB . HIS B 492 ? 2.0921 1.6077 2.1717 0.0434 -0.3701 0.4288 473 HIS B CB 10145 C CG . HIS B 492 ? 2.1190 1.6417 2.2063 0.0582 -0.3752 0.4205 473 HIS B CG 10146 N ND1 . HIS B 492 ? 2.1179 1.6170 2.2403 0.0763 -0.3775 0.3945 473 HIS B ND1 10147 C CD2 . HIS B 492 ? 2.1130 1.6659 2.1782 0.0573 -0.3783 0.4335 473 HIS B CD2 10148 C CE1 . HIS B 492 ? 2.0951 1.6082 2.2170 0.0861 -0.3817 0.3929 473 HIS B CE1 10149 N NE2 . HIS B 492 ? 2.1054 1.6506 2.1930 0.0749 -0.3826 0.4165 473 HIS B NE2 10150 N N . CYS B 493 ? 1.8866 1.3545 1.9461 0.0507 -0.3466 0.3665 474 CYS B N 10151 C CA . CYS B 493 ? 1.8231 1.2656 1.8910 0.0632 -0.3397 0.3299 474 CYS B CA 10152 C C . CYS B 493 ? 1.8511 1.2756 1.9683 0.0797 -0.3465 0.3125 474 CYS B C 10153 O O . CYS B 493 ? 1.8796 1.2813 2.0240 0.0853 -0.3445 0.2905 474 CYS B O 10154 C CB . CYS B 493 ? 1.8304 1.2569 1.8972 0.0534 -0.3335 0.3252 474 CYS B CB 10155 S SG . CYS B 493 ? 2.3327 1.7825 2.3510 0.0306 -0.3267 0.3509 474 CYS B SG 10156 N N . ARG B 494 ? 1.8514 1.2883 1.9804 0.0869 -0.3544 0.3214 475 ARG B N 10157 C CA . ARG B 494 ? 1.7355 1.1589 1.9118 0.1022 -0.3612 0.3056 475 ARG B CA 10158 C C . ARG B 494 ? 1.5987 1.0292 1.7650 0.1180 -0.3577 0.2825 475 ARG B C 10159 O O . ARG B 494 ? 1.5281 0.9662 1.7148 0.1265 -0.3652 0.2863 475 ARG B O 10160 C CB . ARG B 494 ? 1.6370 1.0669 1.8447 0.0978 -0.3750 0.3359 475 ARG B CB 10161 N N . PHE B 495 ? 1.4615 0.8901 1.5973 0.1217 -0.3465 0.2585 476 PHE B N 10162 C CA . PHE B 495 ? 1.4524 0.8883 1.5766 0.1364 -0.3419 0.2342 476 PHE B CA 10163 C C . PHE B 495 ? 1.6524 1.0778 1.8230 0.1530 -0.3448 0.2098 476 PHE B C 10164 O O . PHE B 495 ? 1.7013 1.1361 1.8731 0.1658 -0.3439 0.1948 476 PHE B O 10165 C CB . PHE B 495 ? 1.4518 0.8891 1.5392 0.1357 -0.3265 0.2092 476 PHE B CB 10166 C CG . PHE B 495 ? 1.5468 0.9990 1.5921 0.1171 -0.3187 0.2269 476 PHE B CG 10167 C CD1 . PHE B 495 ? 1.5023 0.9852 1.5112 0.1098 -0.3151 0.2413 476 PHE B CD1 10168 C CD2 . PHE B 495 ? 1.5985 1.0355 1.6422 0.1069 -0.3152 0.2278 476 PHE B CD2 10169 C CE1 . PHE B 495 ? 1.4860 0.9853 1.4583 0.0928 -0.3076 0.2551 476 PHE B CE1 10170 C CE2 . PHE B 495 ? 1.5602 1.0124 1.5668 0.0899 -0.3077 0.2430 476 PHE B CE2 10171 C CZ . PHE B 495 ? 1.5226 1.0067 1.4938 0.0829 -0.3037 0.2561 476 PHE B CZ 10172 N N . ASP B 496 ? 1.7438 1.1513 1.9534 0.1522 -0.3482 0.2052 477 ASP B N 10173 C CA . ASP B 496 ? 1.7376 1.1370 1.9967 0.1656 -0.3524 0.1845 477 ASP B CA 10174 C C . ASP B 496 ? 1.6881 1.0998 1.9655 0.1703 -0.3632 0.2028 477 ASP B C 10175 O O . ASP B 496 ? 1.7194 1.1337 2.0211 0.1845 -0.3638 0.1820 477 ASP B O 10176 C CB . ASP B 496 ? 1.8809 1.2612 2.1789 0.1607 -0.3566 0.1832 477 ASP B CB 10177 C CG . ASP B 496 ? 2.0169 1.3937 2.3670 0.1649 -0.3696 0.1924 477 ASP B CG 10178 O OD1 . ASP B 496 ? 1.9737 1.3463 2.3593 0.1781 -0.3697 0.1636 477 ASP B OD1 10179 O OD2 . ASP B 496 ? 2.0974 1.4774 2.4536 0.1543 -0.3799 0.2283 477 ASP B OD2 10180 N N . GLU B 497 ? 1.7051 1.1270 1.9702 0.1579 -0.3712 0.2412 478 GLU B N 10181 C CA . GLU B 497 ? 1.6979 1.1326 1.9810 0.1605 -0.3826 0.2618 478 GLU B CA 10182 C C . GLU B 497 ? 1.4759 0.9356 1.7182 0.1608 -0.3810 0.2725 478 GLU B C 10183 O O . GLU B 497 ? 1.2858 0.7605 1.5348 0.1604 -0.3903 0.2938 478 GLU B O 10184 C CB . GLU B 497 ? 1.7980 1.2308 2.1029 0.1472 -0.3946 0.2975 478 GLU B CB 10185 C CG . GLU B 497 ? 1.8148 1.2632 2.0776 0.1290 -0.3941 0.3309 478 GLU B CG 10186 C CD . GLU B 497 ? 1.7507 1.1961 2.0378 0.1153 -0.4046 0.3627 478 GLU B CD 10187 O OE1 . GLU B 497 ? 1.6696 1.0940 2.0021 0.1182 -0.4094 0.3541 478 GLU B OE1 10188 O OE2 . GLU B 497 ? 1.6682 1.1342 1.9299 0.1013 -0.4080 0.3956 478 GLU B OE2 10189 N N . PHE B 498 ? 1.4439 0.9090 1.6452 0.1614 -0.3697 0.2571 479 PHE B N 10190 C CA . PHE B 498 ? 1.4654 0.9543 1.6306 0.1634 -0.3678 0.2610 479 PHE B CA 10191 C C . PHE B 498 ? 1.3988 0.8893 1.5763 0.1820 -0.3639 0.2292 479 PHE B C 10192 O O . PHE B 498 ? 1.3063 0.8124 1.4894 0.1886 -0.3692 0.2342 479 PHE B O 10193 C CB . PHE B 498 ? 1.3702 0.8674 1.4835 0.1530 -0.3588 0.2632 479 PHE B CB 10194 C CG . PHE B 498 ? 1.3201 0.8433 1.3972 0.1543 -0.3573 0.2654 479 PHE B CG 10195 C CD1 . PHE B 498 ? 1.2177 0.7525 1.2746 0.1617 -0.3405 0.2316 479 PHE B CD1 10196 C CD2 . PHE B 498 ? 1.3137 0.8625 1.3767 0.1450 -0.3648 0.2955 479 PHE B CD2 10197 C CE1 . PHE B 498 ? 1.0795 0.6459 1.1056 0.1607 -0.3336 0.2289 479 PHE B CE1 10198 C CE2 . PHE B 498 ? 1.2290 0.8066 1.2599 0.1453 -0.3615 0.2939 479 PHE B CE2 10199 C CZ . PHE B 498 ? 1.0555 0.6429 1.0690 0.1527 -0.3440 0.2587 479 PHE B CZ 10200 N N . PHE B 499 ? 1.3509 0.8272 1.5321 0.1900 -0.3541 0.1961 480 PHE B N 10201 C CA . PHE B 499 ? 1.3300 0.8093 1.5260 0.2073 -0.3488 0.1633 480 PHE B CA 10202 C C . PHE B 499 ? 1.3671 0.8367 1.6182 0.2160 -0.3551 0.1537 480 PHE B C 10203 O O . PHE B 499 ? 1.4402 0.8960 1.7181 0.2092 -0.3620 0.1670 480 PHE B O 10204 C CB . PHE B 499 ? 1.3624 0.8349 1.5402 0.2116 -0.3351 0.1309 480 PHE B CB 10205 C CG . PHE B 499 ? 1.2798 0.7763 1.4013 0.1996 -0.3195 0.1324 480 PHE B CG 10206 C CD1 . PHE B 499 ? 1.1410 0.6651 1.2386 0.2027 -0.3119 0.1261 480 PHE B CD1 10207 C CD2 . PHE B 499 ? 1.2879 0.7796 1.3839 0.1852 -0.3128 0.1392 480 PHE B CD2 10208 C CE1 . PHE B 499 ? 1.1192 0.6651 1.1706 0.1919 -0.2982 0.1261 480 PHE B CE1 10209 C CE2 . PHE B 499 ? 1.1313 0.6453 1.1799 0.1745 -0.2988 0.1392 480 PHE B CE2 10210 C CZ . PHE B 499 ? 1.0789 0.6197 1.1065 0.1779 -0.2917 0.1323 480 PHE B CZ 10211 N N . SER B 500 ? 1.3602 0.8385 1.6292 0.2307 -0.3529 0.1306 481 SER B N 10212 C CA . SER B 500 ? 1.3459 0.8170 1.6677 0.2401 -0.3575 0.1154 481 SER B CA 10213 C C . SER B 500 ? 1.4199 0.8740 1.7614 0.2408 -0.3512 0.0894 481 SER B C 10214 O O . SER B 500 ? 1.4323 0.8716 1.8077 0.2364 -0.3584 0.0961 481 SER B O 10215 C CB . SER B 500 ? 1.3057 0.7930 1.6375 0.2554 -0.3535 0.0916 481 SER B CB 10216 O OG . SER B 500 ? 1.3982 0.8797 1.7759 0.2652 -0.3526 0.0636 481 SER B OG 10217 N N . GLU B 501 ? 1.4546 0.9127 1.7745 0.2461 -0.3378 0.0595 482 GLU B N 10218 C CA . GLU B 501 ? 1.4269 0.8737 1.7584 0.2466 -0.3299 0.0316 482 GLU B CA 10219 C C . GLU B 501 ? 1.4646 0.9186 1.7521 0.2472 -0.3161 0.0131 482 GLU B C 10220 O O . GLU B 501 ? 1.5063 0.9673 1.7534 0.2426 -0.3150 0.0305 482 GLU B O 10221 C CB . GLU B 501 ? 1.3645 0.8143 1.7437 0.2587 -0.3292 0.0001 482 GLU B CB 10222 C CG . GLU B 501 ? 1.3502 0.8199 1.7360 0.2713 -0.3277 -0.0116 482 GLU B CG 10223 C CD . GLU B 501 ? 1.4022 0.8747 1.8409 0.2814 -0.3302 -0.0359 482 GLU B CD 10224 O OE1 . GLU B 501 ? 1.4006 0.8772 1.8517 0.2863 -0.3209 -0.0713 482 GLU B OE1 10225 O OE2 . GLU B 501 ? 1.3934 0.8657 1.8611 0.2838 -0.3417 -0.0200 482 GLU B OE2 10226 N N . GLY B 502 ? 1.4409 0.8953 1.7360 0.2523 -0.3060 -0.0220 483 GLY B N 10227 C CA . GLY B 502 ? 1.2959 0.7592 1.5515 0.2532 -0.2928 -0.0408 483 GLY B CA 10228 C C . GLY B 502 ? 1.2858 0.7412 1.5414 0.2496 -0.2847 -0.0644 483 GLY B C 10229 O O . GLY B 502 ? 1.3235 0.7722 1.6167 0.2506 -0.2868 -0.0787 483 GLY B O 10230 N N . CYS B 503 ? 1.1823 0.6519 1.3915 0.2398 -0.2699 -0.0677 484 CYS B N 10231 C CA . CYS B 503 ? 1.0456 0.5120 1.2491 0.2349 -0.2611 -0.0891 484 CYS B CA 10232 C C . CYS B 503 ? 1.2147 0.6826 1.3721 0.2182 -0.2534 -0.0707 484 CYS B C 10233 O O . CYS B 503 ? 1.2856 0.7763 1.4032 0.2132 -0.2416 -0.0677 484 CYS B O 10234 C CB . CYS B 503 ? 1.0117 0.5041 1.2125 0.2433 -0.2471 -0.1275 484 CYS B CB 10235 S SG . CYS B 503 ? 1.8525 1.3444 2.0529 0.2390 -0.2380 -0.1580 484 CYS B SG 10236 N N . ALA B 504 ? 1.3114 0.7551 1.4775 0.2096 -0.2603 -0.0586 485 ALA B N 10237 C CA . ALA B 504 ? 1.3285 0.7724 1.4558 0.1937 -0.2532 -0.0436 485 ALA B CA 10238 C C . ALA B 504 ? 1.4170 0.8448 1.5577 0.1895 -0.2524 -0.0593 485 ALA B C 10239 O O . ALA B 504 ? 1.4056 0.8087 1.5640 0.1831 -0.2630 -0.0418 485 ALA B O 10240 C CB . ALA B 504 ? 1.1978 0.6313 1.3157 0.1837 -0.2632 -0.0035 485 ALA B CB 10241 N N . PRO B 505 ? 1.4758 0.9196 1.6087 0.1927 -0.2401 -0.0918 486 PRO B N 10242 C CA . PRO B 505 ? 1.5275 0.9622 1.6733 0.1903 -0.2380 -0.1140 486 PRO B CA 10243 C C . PRO B 505 ? 1.6205 1.0345 1.7566 0.1757 -0.2416 -0.0924 486 PRO B C 10244 O O . PRO B 505 ? 1.6443 1.0674 1.7400 0.1641 -0.2340 -0.0753 486 PRO B O 10245 C CB . PRO B 505 ? 1.3797 0.8457 1.4933 0.1898 -0.2208 -0.1382 486 PRO B CB 10246 C CG . PRO B 505 ? 1.2884 0.7762 1.3991 0.1999 -0.2173 -0.1428 486 PRO B CG 10247 C CD . PRO B 505 ? 1.3511 0.8271 1.4608 0.1983 -0.2271 -0.1086 486 PRO B CD 10248 N N . GLY B 506 ? 1.6724 1.0595 1.8487 0.1764 -0.2534 -0.0939 487 GLY B N 10249 C CA . GLY B 506 ? 1.6990 1.0647 1.8732 0.1628 -0.2585 -0.0726 487 GLY B CA 10250 C C . GLY B 506 ? 1.7259 1.0708 1.9305 0.1603 -0.2742 -0.0409 487 GLY B C 10251 O O . GLY B 506 ? 1.6720 1.0034 1.8865 0.1489 -0.2787 -0.0237 487 GLY B O 10252 N N . SER B 507 ? 1.7744 1.1256 1.9924 0.1688 -0.2800 -0.0320 488 SER B N 10253 C CA . SER B 507 ? 1.6955 1.0385 1.9409 0.1651 -0.2926 -0.0005 488 SER B CA 10254 C C . SER B 507 ? 1.6057 0.9409 1.9049 0.1676 -0.2985 -0.0133 488 SER B C 10255 O O . SER B 507 ? 1.6458 0.9854 1.9614 0.1740 -0.2926 -0.0489 488 SER B O 10256 C CB . SER B 507 ? 1.6721 1.0264 1.9165 0.1741 -0.2970 0.0102 488 SER B CB 10257 O OG . SER B 507 ? 1.6362 0.9988 1.8321 0.1718 -0.2923 0.0220 488 SER B OG 10258 N N . LYS B 508 ? 1.5580 0.8840 1.8848 0.1621 -0.3105 0.0159 489 LYS B N 10259 C CA . LYS B 508 ? 1.5545 0.8721 1.9364 0.1641 -0.3184 0.0074 489 LYS B CA 10260 C C . LYS B 508 ? 1.6603 0.9884 2.0749 0.1800 -0.3185 -0.0237 489 LYS B C 10261 O O . LYS B 508 ? 1.7205 1.0601 2.1239 0.1884 -0.3176 -0.0235 489 LYS B O 10262 C CB . LYS B 508 ? 1.3918 0.7002 1.7956 0.1551 -0.3321 0.0480 489 LYS B CB 10263 N N . LYS B 509 ? 1.6339 0.9599 2.0895 0.1838 -0.3194 -0.0511 490 LYS B N 10264 C CA . LYS B 509 ? 1.6916 1.0306 2.1802 0.1980 -0.3185 -0.0846 490 LYS B CA 10265 C C . LYS B 509 ? 1.9044 1.2423 2.4276 0.2034 -0.3310 -0.0663 490 LYS B C 10266 O O . LYS B 509 ? 1.9402 1.2918 2.4767 0.2154 -0.3296 -0.0854 490 LYS B O 10267 C CB . LYS B 509 ? 1.6381 0.9769 2.1643 0.1993 -0.3176 -0.1175 490 LYS B CB 10268 C CG . LYS B 509 ? 1.5518 0.8951 2.0458 0.1946 -0.3051 -0.1393 490 LYS B CG 10269 C CD . LYS B 509 ? 1.5563 0.9208 2.0113 0.2022 -0.2915 -0.1633 490 LYS B CD 10270 C CE . LYS B 509 ? 1.5394 0.9102 1.9619 0.1967 -0.2797 -0.1838 490 LYS B CE 10271 N NZ . LYS B 509 ? 1.5448 0.8986 1.9324 0.1832 -0.2799 -0.1528 490 LYS B NZ 10272 N N . ASP B 510 ? 2.0143 1.3377 2.5520 0.1939 -0.3432 -0.0287 491 ASP B N 10273 C CA . ASP B 510 ? 2.0383 1.3607 2.6085 0.1970 -0.3565 -0.0065 491 ASP B CA 10274 C C . ASP B 510 ? 1.9829 1.3111 2.5131 0.1943 -0.3576 0.0269 491 ASP B C 10275 O O . ASP B 510 ? 1.9453 1.2727 2.4940 0.1930 -0.3694 0.0549 491 ASP B O 10276 C CB . ASP B 510 ? 2.0561 1.3631 2.6712 0.1883 -0.3706 0.0154 491 ASP B CB 10277 C CG . ASP B 510 ? 2.0399 1.3359 2.6289 0.1726 -0.3697 0.0407 491 ASP B CG 10278 O OD1 . ASP B 510 ? 1.9445 1.2444 2.4788 0.1676 -0.3602 0.0496 491 ASP B OD1 10279 O OD2 . ASP B 510 ? 2.0982 1.3824 2.7231 0.1652 -0.3788 0.0516 491 ASP B OD2 10280 N N . SER B 511 ? 1.8640 1.1995 2.3404 0.1931 -0.3457 0.0234 492 SER B N 10281 C CA . SER B 511 ? 1.7522 1.0963 2.1883 0.1910 -0.3458 0.0508 492 SER B CA 10282 C C . SER B 511 ? 1.6940 1.0542 2.1285 0.2056 -0.3420 0.0311 492 SER B C 10283 O O . SER B 511 ? 1.5895 0.9561 2.0440 0.2164 -0.3361 -0.0062 492 SER B O 10284 C CB . SER B 511 ? 1.6275 0.9720 2.0080 0.1816 -0.3360 0.0584 492 SER B CB 10285 O OG . SER B 511 ? 1.4740 0.8291 1.8165 0.1793 -0.3365 0.0835 492 SER B OG 10286 N N . SER B 512 ? 1.7300 1.0993 2.1405 0.2054 -0.3453 0.0561 493 SER B N 10287 C CA . SER B 512 ? 1.7647 1.1503 2.1737 0.2187 -0.3425 0.0411 493 SER B CA 10288 C C . SER B 512 ? 1.7553 1.1526 2.1203 0.2232 -0.3280 0.0185 493 SER B C 10289 O O . SER B 512 ? 1.8558 1.2684 2.2180 0.2347 -0.3231 -0.0002 493 SER B O 10290 C CB . SER B 512 ? 1.8202 1.2130 2.2233 0.2166 -0.3526 0.0766 493 SER B CB 10291 O OG . SER B 512 ? 1.8712 1.2675 2.2255 0.2056 -0.3509 0.1042 493 SER B OG 10292 N N . LEU B 513 ? 1.6523 1.0430 1.9841 0.2139 -0.3213 0.0204 494 LEU B N 10293 C CA . LEU B 513 ? 1.5413 0.9420 1.8309 0.2168 -0.3082 0.0006 494 LEU B CA 10294 C C . LEU B 513 ? 1.5858 0.9894 1.8876 0.2229 -0.2979 -0.0414 494 LEU B C 10295 O O . LEU B 513 ? 1.6622 1.0693 1.9311 0.2209 -0.2875 -0.0563 494 LEU B O 10296 C CB . LEU B 513 ? 1.4254 0.8199 1.6700 0.2031 -0.3062 0.0246 494 LEU B CB 10297 C CG . LEU B 513 ? 1.3658 0.7647 1.5909 0.1960 -0.3147 0.0646 494 LEU B CG 10298 C CD1 . LEU B 513 ? 1.3518 0.7477 1.5329 0.1814 -0.3116 0.0854 494 LEU B CD1 10299 C CD2 . LEU B 513 ? 1.3534 0.7708 1.5669 0.2069 -0.3137 0.0602 494 LEU B CD2 10300 N N . CYS B 514 ? 1.6181 1.0219 1.9675 0.2298 -0.3013 -0.0606 495 CYS B N 10301 C CA . CYS B 514 ? 1.5356 0.9485 1.9006 0.2362 -0.2920 -0.1030 495 CYS B CA 10302 C C . CYS B 514 ? 1.4651 0.8927 1.8684 0.2494 -0.2933 -0.1251 495 CYS B C 10303 O O . CYS B 514 ? 1.5269 0.9677 1.9487 0.2557 -0.2862 -0.1618 495 CYS B O 10304 C CB . CYS B 514 ? 1.5223 0.9196 1.9117 0.2282 -0.2949 -0.1076 495 CYS B CB 10305 S SG . CYS B 514 ? 1.5451 0.9271 1.8927 0.2122 -0.2913 -0.0887 495 CYS B SG 10306 N N . LYS B 515 ? 1.3802 0.8080 1.7947 0.2528 -0.3024 -0.1026 496 LYS B N 10307 C CA . LYS B 515 ? 1.4231 0.8619 1.8794 0.2641 -0.3064 -0.1181 496 LYS B CA 10308 C C . LYS B 515 ? 1.4883 0.9538 1.9322 0.2757 -0.2943 -0.1489 496 LYS B C 10309 O O . LYS B 515 ? 1.5709 1.0488 2.0472 0.2853 -0.2961 -0.1644 496 LYS B O 10310 C CB . LYS B 515 ? 1.3405 0.7717 1.8120 0.2632 -0.3206 -0.0822 496 LYS B CB 10311 N N . LEU B 516 ? 1.5372 1.0128 1.9355 0.2744 -0.2823 -0.1574 497 LEU B N 10312 C CA . LEU B 516 ? 1.5497 1.0538 1.9345 0.2842 -0.2698 -0.1865 497 LEU B CA 10313 C C . LEU B 516 ? 1.5240 1.0387 1.8692 0.2808 -0.2559 -0.2052 497 LEU B C 10314 O O . LEU B 516 ? 1.5291 1.0643 1.8450 0.2854 -0.2462 -0.2147 497 LEU B O 10315 C CB . LEU B 516 ? 1.4557 0.9693 1.8256 0.2898 -0.2721 -0.1686 497 LEU B CB 10316 C CG . LEU B 516 ? 1.2658 0.7668 1.5985 0.2823 -0.2777 -0.1300 497 LEU B CG 10317 C CD1 . LEU B 516 ? 1.3003 0.8129 1.5829 0.2812 -0.2659 -0.1361 497 LEU B CD1 10318 C CD2 . LEU B 516 ? 1.0849 0.5896 1.4286 0.2867 -0.2873 -0.1075 497 LEU B CD2 10319 N N . CYS B 517 ? 1.4560 0.9576 1.8015 0.2726 -0.2552 -0.2099 498 CYS B N 10320 C CA . CYS B 517 ? 1.3989 0.9127 1.7129 0.2692 -0.2423 -0.2318 498 CYS B CA 10321 C C . CYS B 517 ? 1.5135 1.0557 1.8496 0.2761 -0.2329 -0.2744 498 CYS B C 10322 O O . CYS B 517 ? 1.5929 1.1448 1.9661 0.2841 -0.2361 -0.2864 498 CYS B O 10323 C CB . CYS B 517 ? 1.3752 0.8655 1.6814 0.2569 -0.2454 -0.2203 498 CYS B CB 10324 S SG . CYS B 517 ? 1.6393 1.1021 1.9118 0.2461 -0.2541 -0.1716 498 CYS B SG 10325 N N . MET B 518 ? 1.5938 1.1516 1.9065 0.2724 -0.2214 -0.2971 499 MET B N 10326 C CA . MET B 518 ? 1.6568 1.2448 1.9884 0.2764 -0.2123 -0.3375 499 MET B CA 10327 C C . MET B 518 ? 1.6848 1.2690 2.0125 0.2674 -0.2094 -0.3509 499 MET B C 10328 O O . MET B 518 ? 1.7717 1.3251 2.1041 0.2597 -0.2180 -0.3305 499 MET B O 10329 C CB . MET B 518 ? 1.7181 1.3444 2.0226 0.2821 -0.1984 -0.3569 499 MET B CB 10330 C CG . MET B 518 ? 1.7898 1.4172 2.0409 0.2771 -0.1917 -0.3428 499 MET B CG 10331 S SD . MET B 518 ? 1.3871 1.0701 1.6080 0.2788 -0.1727 -0.3645 499 MET B SD 10332 C CE . MET B 518 ? 0.9525 0.6481 1.2154 0.2948 -0.1765 -0.3782 499 MET B CE 10333 N N . GLY B 519 ? 1.6755 1.2936 1.9944 0.2676 -0.1971 -0.3844 500 GLY B N 10334 C CA . GLY B 519 ? 1.7340 1.3539 2.0494 0.2591 -0.1938 -0.3999 500 GLY B CA 10335 C C . GLY B 519 ? 1.7469 1.3522 2.1130 0.2589 -0.2034 -0.4085 500 GLY B C 10336 O O . GLY B 519 ? 1.7691 1.3387 2.1498 0.2542 -0.2148 -0.3835 500 GLY B O 10337 N N . SER B 520 ? 1.7051 1.3404 2.0990 0.2635 -0.1987 -0.4438 501 SER B N 10338 C CA . SER B 520 ? 1.7421 1.3684 2.1902 0.2649 -0.2080 -0.4567 501 SER B CA 10339 C C . SER B 520 ? 1.6387 1.2431 2.0921 0.2551 -0.2129 -0.4527 501 SER B C 10340 O O . SER B 520 ? 1.4219 1.0232 1.8353 0.2468 -0.2072 -0.4454 501 SER B O 10341 C CB . SER B 520 ? 1.8504 1.5194 2.3232 0.2712 -0.2007 -0.4988 501 SER B CB 10342 O OG . SER B 520 ? 1.8515 1.5562 2.2873 0.2669 -0.1863 -0.5204 501 SER B OG 10343 N N . GLY B 521 ? 1.6859 1.2754 2.1907 0.2560 -0.2238 -0.4572 502 GLY B N 10344 C CA . GLY B 521 ? 1.6681 1.2383 2.1862 0.2473 -0.2292 -0.4552 502 GLY B CA 10345 C C . GLY B 521 ? 1.6203 1.1471 2.1325 0.2402 -0.2399 -0.4120 502 GLY B C 10346 O O . GLY B 521 ? 1.4590 0.9663 1.9867 0.2436 -0.2493 -0.3863 502 GLY B O 10347 N N . LEU B 522 ? 1.7283 1.2420 2.2182 0.2298 -0.2385 -0.4037 503 LEU B N 10348 C CA . LEU B 522 ? 1.7753 1.2517 2.2539 0.2211 -0.2469 -0.3626 503 LEU B CA 10349 C C . LEU B 522 ? 1.7971 1.2726 2.2151 0.2166 -0.2388 -0.3441 503 LEU B C 10350 O O . LEU B 522 ? 1.7991 1.2490 2.1969 0.2079 -0.2431 -0.3119 503 LEU B O 10351 C CB . LEU B 522 ? 1.8080 1.2690 2.3042 0.2117 -0.2515 -0.3633 503 LEU B CB 10352 N N . ASN B 523 ? 1.8429 1.3490 2.2335 0.2222 -0.2272 -0.3650 504 ASN B N 10353 C CA . ASN B 523 ? 1.8312 1.3408 2.1673 0.2195 -0.2195 -0.3505 504 ASN B CA 10354 C C . ASN B 523 ? 1.7997 1.2971 2.1302 0.2249 -0.2250 -0.3224 504 ASN B C 10355 O O . ASN B 523 ? 1.8017 1.2948 2.0912 0.2224 -0.2220 -0.3028 504 ASN B O 10356 C CB . ASN B 523 ? 1.7665 1.3173 2.0769 0.2228 -0.2051 -0.3831 504 ASN B CB 10357 C CG . ASN B 523 ? 1.6339 1.1994 1.9373 0.2152 -0.1989 -0.4066 504 ASN B CG 10358 O OD1 . ASN B 523 ? 1.5653 1.1092 1.8575 0.2052 -0.2018 -0.3922 504 ASN B OD1 10359 N ND2 . ASN B 523 ? 1.5181 1.1231 1.8279 0.2192 -0.1901 -0.4426 504 ASN B ND2 10360 N N . LEU B 524 ? 1.6744 1.1676 2.0476 0.2324 -0.2334 -0.3212 505 LEU B N 10361 C CA . LEU B 524 ? 1.5230 1.0053 1.8973 0.2374 -0.2403 -0.2939 505 LEU B CA 10362 C C . LEU B 524 ? 1.5589 1.0102 1.9117 0.2276 -0.2479 -0.2518 505 LEU B C 10363 O O . LEU B 524 ? 1.5860 1.0159 1.9566 0.2195 -0.2555 -0.2381 505 LEU B O 10364 C CB . LEU B 524 ? 1.4359 0.9155 1.8658 0.2449 -0.2503 -0.2982 505 LEU B CB 10365 C CG . LEU B 524 ? 1.4147 0.8946 1.8544 0.2532 -0.2560 -0.2818 505 LEU B CG 10366 C CD1 . LEU B 524 ? 1.2681 0.7601 1.7613 0.2625 -0.2605 -0.3050 505 LEU B CD1 10367 C CD2 . LEU B 524 ? 1.4934 0.9429 1.9312 0.2470 -0.2686 -0.2363 505 LEU B CD2 10368 N N . CYS B 525 ? 1.5982 1.0497 1.9130 0.2280 -0.2457 -0.2319 506 CYS B N 10369 C CA . CYS B 525 ? 1.6249 1.0525 1.9139 0.2184 -0.2520 -0.1921 506 CYS B CA 10370 C C . CYS B 525 ? 1.5221 0.9387 1.7882 0.2060 -0.2485 -0.1895 506 CYS B C 10371 O O . CYS B 525 ? 1.5143 0.9084 1.7813 0.1959 -0.2561 -0.1610 506 CYS B O 10372 C CB . CYS B 525 ? 1.7232 1.1308 2.0462 0.2167 -0.2666 -0.1621 506 CYS B CB 10373 S SG . CYS B 525 ? 1.6621 1.0518 1.9529 0.2071 -0.2744 -0.1108 506 CYS B SG 10374 N N . GLU B 526 ? 1.4180 0.8529 1.6636 0.2063 -0.2370 -0.2189 507 GLU B N 10375 C CA . GLU B 526 ? 1.4418 0.8694 1.6635 0.1948 -0.2329 -0.2190 507 GLU B CA 10376 C C . GLU B 526 ? 1.3218 0.7729 1.4869 0.1880 -0.2192 -0.2126 507 GLU B C 10377 O O . GLU B 526 ? 1.2856 0.7671 1.4358 0.1940 -0.2091 -0.2302 507 GLU B O 10378 C CB . GLU B 526 ? 1.5874 1.0291 1.8316 0.1948 -0.2279 -0.2544 507 GLU B CB 10379 C CG . GLU B 526 ? 1.7340 1.1560 1.9885 0.1831 -0.2321 -0.2467 507 GLU B CG 10380 C CD . GLU B 526 ? 1.8532 1.2527 2.1523 0.1819 -0.2451 -0.2272 507 GLU B CD 10381 O OE1 . GLU B 526 ? 1.8970 1.3008 2.2280 0.1915 -0.2501 -0.2311 507 GLU B OE1 10382 O OE2 . GLU B 526 ? 1.8585 1.2374 2.1614 0.1711 -0.2503 -0.2076 507 GLU B OE2 10383 N N . PRO B 527 ? 1.3080 0.7500 1.4424 0.1739 -0.2174 -0.1859 508 PRO B N 10384 C CA . PRO B 527 ? 1.3302 0.7954 1.4134 0.1650 -0.2044 -0.1744 508 PRO B CA 10385 C C . PRO B 527 ? 1.3182 0.8116 1.3812 0.1631 -0.1915 -0.2018 508 PRO B C 10386 O O . PRO B 527 ? 1.1381 0.6359 1.1722 0.1514 -0.1851 -0.1940 508 PRO B O 10387 C CB . PRO B 527 ? 1.2801 0.7245 1.3474 0.1506 -0.2079 -0.1440 508 PRO B CB 10388 C CG . PRO B 527 ? 1.2413 0.6536 1.3481 0.1528 -0.2237 -0.1303 508 PRO B CG 10389 C CD . PRO B 527 ? 1.3115 0.7201 1.4620 0.1655 -0.2287 -0.1631 508 PRO B CD 10390 N N . ASN B 528 ? 1.4463 0.9608 1.5246 0.1739 -0.1878 -0.2327 509 ASN B N 10391 C CA . ASN B 528 ? 1.4717 1.0189 1.5304 0.1719 -0.1758 -0.2580 509 ASN B CA 10392 C C . ASN B 528 ? 1.4359 1.0153 1.4995 0.1833 -0.1694 -0.2808 509 ASN B C 10393 O O . ASN B 528 ? 1.3810 0.9536 1.4736 0.1948 -0.1757 -0.2856 509 ASN B O 10394 C CB . ASN B 528 ? 1.4932 1.0329 1.5714 0.1693 -0.1785 -0.2818 509 ASN B CB 10395 C CG . ASN B 528 ? 1.5055 1.0429 1.6307 0.1823 -0.1850 -0.3139 509 ASN B CG 10396 O OD1 . ASN B 528 ? 1.4366 0.9457 1.5979 0.1888 -0.1970 -0.3070 509 ASN B OD1 10397 N ND2 . ASN B 528 ? 1.5762 1.1454 1.7032 0.1859 -0.1775 -0.3495 509 ASN B ND2 10398 N N . ASN B 529 ? 1.3818 0.9976 1.4186 0.1799 -0.1571 -0.2942 510 ASN B N 10399 C CA . ASN B 529 ? 1.3699 1.0222 1.4043 0.1882 -0.1491 -0.3111 510 ASN B CA 10400 C C . ASN B 529 ? 1.2684 0.9272 1.3437 0.2021 -0.1528 -0.3448 510 ASN B C 10401 O O . ASN B 529 ? 1.1798 0.8643 1.2592 0.2106 -0.1480 -0.3560 510 ASN B O 10402 C CB . ASN B 529 ? 1.3621 1.0540 1.3623 0.1803 -0.1361 -0.3183 510 ASN B CB 10403 C CG . ASN B 529 ? 1.4481 1.1499 1.4524 0.1758 -0.1347 -0.3439 510 ASN B CG 10404 O OD1 . ASN B 529 ? 1.4899 1.2081 1.5180 0.1835 -0.1345 -0.3774 510 ASN B OD1 10405 N ND2 . ASN B 529 ? 1.3962 1.0899 1.3780 0.1633 -0.1336 -0.3297 510 ASN B ND2 10406 N N . LYS B 530 ? 1.3202 0.9567 1.4285 0.2043 -0.1614 -0.3616 511 LYS B N 10407 C CA . LYS B 530 ? 1.4343 1.0730 1.5890 0.2179 -0.1666 -0.3943 511 LYS B CA 10408 C C . LYS B 530 ? 1.5005 1.1207 1.6782 0.2281 -0.1747 -0.3788 511 LYS B C 10409 O O . LYS B 530 ? 1.4523 1.0901 1.6576 0.2384 -0.1740 -0.3981 511 LYS B O 10410 C CB . LYS B 530 ? 1.3423 0.9615 1.5302 0.2144 -0.1739 -0.4060 511 LYS B CB 10411 N N . GLU B 531 ? 1.5118 1.1029 1.6762 0.2224 -0.1809 -0.3399 512 GLU B N 10412 C CA . GLU B 531 ? 1.5266 1.1037 1.7044 0.2298 -0.1883 -0.3191 512 GLU B CA 10413 C C . GLU B 531 ? 1.5770 1.1858 1.7202 0.2300 -0.1771 -0.3103 512 GLU B C 10414 O O . GLU B 531 ? 1.4938 1.1081 1.5965 0.2193 -0.1708 -0.2870 512 GLU B O 10415 C CB . GLU B 531 ? 1.5001 1.0384 1.6757 0.2222 -0.1992 -0.2809 512 GLU B CB 10416 C CG . GLU B 531 ? 1.5331 1.0610 1.7130 0.2272 -0.2063 -0.2540 512 GLU B CG 10417 C CD . GLU B 531 ? 1.5358 1.0574 1.7663 0.2426 -0.2159 -0.2705 512 GLU B CD 10418 O OE1 . GLU B 531 ? 1.7210 1.2200 1.9874 0.2411 -0.2268 -0.2614 512 GLU B OE1 10419 O OE2 . GLU B 531 ? 1.4556 1.0043 1.6883 0.2519 -0.2095 -0.2877 512 GLU B OE2 10420 N N . GLY B 532 ? 1.6578 1.2877 1.8200 0.2421 -0.1750 -0.3295 513 GLY B N 10421 C CA . GLY B 532 ? 1.5987 1.2623 1.7334 0.2430 -0.1640 -0.3254 513 GLY B CA 10422 C C . GLY B 532 ? 1.4850 1.1373 1.5963 0.2388 -0.1662 -0.2874 513 GLY B C 10423 O O . GLY B 532 ? 1.3957 1.0741 1.4787 0.2361 -0.1566 -0.2795 513 GLY B O 10424 N N . TYR B 533 ? 1.3642 0.9796 1.4887 0.2377 -0.1790 -0.2638 514 TYR B N 10425 C CA . TYR B 533 ? 1.1648 0.7709 1.2679 0.2331 -0.1819 -0.2285 514 TYR B CA 10426 C C . TYR B 533 ? 1.2607 0.8497 1.3345 0.2182 -0.1821 -0.2032 514 TYR B C 10427 O O . TYR B 533 ? 1.2599 0.8387 1.3180 0.2129 -0.1859 -0.1738 514 TYR B O 10428 C CB . TYR B 533 ? 1.1227 0.7064 1.2596 0.2424 -0.1963 -0.2162 514 TYR B CB 10429 C CG . TYR B 533 ? 1.0713 0.6742 1.2338 0.2569 -0.1956 -0.2366 514 TYR B CG 10430 C CD1 . TYR B 533 ? 1.1359 0.7768 1.2837 0.2595 -0.1816 -0.2584 514 TYR B CD1 10431 C CD2 . TYR B 533 ? 1.0472 0.6317 1.2500 0.2676 -0.2092 -0.2328 514 TYR B CD2 10432 C CE1 . TYR B 533 ? 1.1746 0.8354 1.3463 0.2724 -0.1803 -0.2774 514 TYR B CE1 10433 C CE2 . TYR B 533 ? 1.1316 0.7343 1.3600 0.2812 -0.2086 -0.2523 514 TYR B CE2 10434 C CZ . TYR B 533 ? 1.1813 0.8225 1.3935 0.2835 -0.1937 -0.2753 514 TYR B CZ 10435 O OH . TYR B 533 ? 1.2436 0.9050 1.4816 0.2966 -0.1924 -0.2951 514 TYR B OH 10436 N N . TYR B 534 ? 1.2546 0.8429 1.3215 0.2112 -0.1780 -0.2156 515 TYR B N 10437 C CA . TYR B 534 ? 1.1886 0.7653 1.2267 0.1967 -0.1763 -0.1945 515 TYR B CA 10438 C C . TYR B 534 ? 1.2177 0.8220 1.2154 0.1892 -0.1637 -0.1861 515 TYR B C 10439 O O . TYR B 534 ? 1.2169 0.8519 1.2080 0.1930 -0.1543 -0.2036 515 TYR B O 10440 C CB . TYR B 534 ? 1.1084 0.6756 1.1544 0.1917 -0.1766 -0.2110 515 TYR B CB 10441 C CG . TYR B 534 ? 1.1519 0.7148 1.1653 0.1766 -0.1720 -0.1938 515 TYR B CG 10442 C CD1 . TYR B 534 ? 1.1127 0.6507 1.1188 0.1684 -0.1788 -0.1634 515 TYR B CD1 10443 C CD2 . TYR B 534 ? 1.1553 0.7414 1.1459 0.1702 -0.1611 -0.2075 515 TYR B CD2 10444 C CE1 . TYR B 534 ? 1.0416 0.5772 1.0197 0.1547 -0.1742 -0.1491 515 TYR B CE1 10445 C CE2 . TYR B 534 ? 1.0685 0.6508 1.0322 0.1567 -0.1574 -0.1920 515 TYR B CE2 10446 C CZ . TYR B 534 ? 1.1221 0.6787 1.0802 0.1493 -0.1637 -0.1638 515 TYR B CZ 10447 O OH . TYR B 534 ? 1.1351 0.6893 1.0684 0.1359 -0.1596 -0.1499 515 TYR B OH 10448 N N . GLY B 535 ? 1.2450 0.8399 1.2179 0.1783 -0.1636 -0.1593 516 GLY B N 10449 C CA . GLY B 535 ? 1.1331 0.7512 1.0723 0.1703 -0.1527 -0.1505 516 GLY B CA 10450 C C . GLY B 535 ? 1.1264 0.7597 1.0592 0.1748 -0.1509 -0.1397 516 GLY B C 10451 O O . GLY B 535 ? 1.1230 0.7514 1.0768 0.1851 -0.1575 -0.1410 516 GLY B O 10452 N N . TYR B 536 ? 1.0451 0.6966 0.9514 0.1671 -0.1425 -0.1293 517 TYR B N 10453 C CA . TYR B 536 ? 0.9171 0.5854 0.8171 0.1703 -0.1399 -0.1199 517 TYR B CA 10454 C C . TYR B 536 ? 0.9711 0.6591 0.8883 0.1827 -0.1377 -0.1389 517 TYR B C 10455 O O . TYR B 536 ? 1.0193 0.7056 0.9502 0.1912 -0.1430 -0.1353 517 TYR B O 10456 C CB . TYR B 536 ? 0.8679 0.5569 0.7427 0.1605 -0.1301 -0.1117 517 TYR B CB 10457 C CG . TYR B 536 ? 0.9641 0.6390 0.8217 0.1479 -0.1309 -0.0936 517 TYR B CG 10458 C CD1 . TYR B 536 ? 0.9393 0.6167 0.7842 0.1384 -0.1254 -0.0962 517 TYR B CD1 10459 C CD2 . TYR B 536 ? 1.0484 0.7106 0.9026 0.1453 -0.1370 -0.0744 517 TYR B CD2 10460 C CE1 . TYR B 536 ? 0.9349 0.6011 0.7658 0.1270 -0.1257 -0.0808 517 TYR B CE1 10461 C CE2 . TYR B 536 ? 1.0937 0.7470 0.9325 0.1334 -0.1369 -0.0594 517 TYR B CE2 10462 C CZ . TYR B 536 ? 1.0626 0.7172 0.8906 0.1245 -0.1311 -0.0631 517 TYR B CZ 10463 O OH . TYR B 536 ? 1.1318 0.7788 0.9462 0.1128 -0.1307 -0.0493 517 TYR B OH 10464 N N . THR B 537 ? 0.9637 0.6724 0.8800 0.1832 -0.1298 -0.1591 518 THR B N 10465 C CA . THR B 537 ? 0.8897 0.6238 0.8201 0.1935 -0.1255 -0.1793 518 THR B CA 10466 C C . THR B 537 ? 0.9844 0.7022 0.9467 0.2060 -0.1348 -0.1911 518 THR B C 10467 O O . THR B 537 ? 1.0789 0.8060 1.0552 0.2155 -0.1362 -0.1941 518 THR B O 10468 C CB . THR B 537 ? 0.8768 0.6362 0.8019 0.1908 -0.1166 -0.2005 518 THR B CB 10469 O OG1 . THR B 537 ? 1.0700 0.8444 0.9684 0.1789 -0.1090 -0.1880 518 THR B OG1 10470 C CG2 . THR B 537 ? 0.8639 0.6551 0.8023 0.2006 -0.1112 -0.2210 518 THR B CG2 10471 N N . GLY B 538 ? 1.0966 0.7897 1.0728 0.2058 -0.1418 -0.1977 519 GLY B N 10472 C CA . GLY B 538 ? 1.0633 0.7385 1.0758 0.2172 -0.1519 -0.2096 519 GLY B CA 10473 C C . GLY B 538 ? 1.0691 0.7243 1.0921 0.2213 -0.1625 -0.1872 519 GLY B C 10474 O O . GLY B 538 ? 0.9215 0.5747 0.9733 0.2332 -0.1688 -0.1953 519 GLY B O 10475 N N . ALA B 539 ? 0.8480 0.4904 0.8484 0.2113 -0.1646 -0.1596 520 ALA B N 10476 C CA . ALA B 539 ? 1.0338 0.6615 1.0395 0.2132 -0.1745 -0.1361 520 ALA B CA 10477 C C . ALA B 539 ? 1.0603 0.7119 1.0653 0.2205 -0.1709 -0.1367 520 ALA B C 10478 O O . ALA B 539 ? 1.0490 0.6935 1.0743 0.2289 -0.1801 -0.1307 520 ALA B O 10479 C CB . ALA B 539 ? 0.8469 0.4628 0.8261 0.1997 -0.1757 -0.1092 520 ALA B CB 10480 N N . PHE B 540 ? 0.8638 0.5438 0.8474 0.2170 -0.1582 -0.1432 521 PHE B N 10481 C CA . PHE B 540 ? 0.9051 0.6098 0.8899 0.2235 -0.1540 -0.1452 521 PHE B CA 10482 C C . PHE B 540 ? 1.0401 0.7565 1.0545 0.2372 -0.1541 -0.1703 521 PHE B C 10483 O O . PHE B 540 ? 1.0140 0.7381 1.0433 0.2462 -0.1572 -0.1703 521 PHE B O 10484 C CB . PHE B 540 ? 1.0199 0.7523 0.9778 0.2154 -0.1410 -0.1435 521 PHE B CB 10485 C CG . PHE B 540 ? 1.0911 0.8515 1.0530 0.2217 -0.1358 -0.1476 521 PHE B CG 10486 C CD1 . PHE B 540 ? 0.9813 0.7388 0.9493 0.2261 -0.1422 -0.1342 521 PHE B CD1 10487 C CD2 . PHE B 540 ? 1.0978 0.8895 1.0577 0.2227 -0.1247 -0.1641 521 PHE B CD2 10488 C CE1 . PHE B 540 ? 0.9562 0.7393 0.9297 0.2318 -0.1375 -0.1382 521 PHE B CE1 10489 C CE2 . PHE B 540 ? 0.9882 0.8066 0.9533 0.2278 -0.1197 -0.1667 521 PHE B CE2 10490 C CZ . PHE B 540 ? 0.9532 0.7662 0.9257 0.2327 -0.1262 -0.1542 521 PHE B CZ 10491 N N . ARG B 541 ? 1.0591 0.7783 1.0829 0.2386 -0.1507 -0.1930 522 ARG B N 10492 C CA . ARG B 541 ? 1.1250 0.8556 1.1802 0.2515 -0.1510 -0.2203 522 ARG B CA 10493 C C . ARG B 541 ? 1.1534 0.8559 1.2432 0.2613 -0.1661 -0.2164 522 ARG B C 10494 O O . ARG B 541 ? 1.1644 0.8760 1.2807 0.2733 -0.1687 -0.2282 522 ARG B O 10495 C CB . ARG B 541 ? 1.1955 0.9345 1.2553 0.2503 -0.1455 -0.2467 522 ARG B CB 10496 C CG . ARG B 541 ? 1.2870 1.0417 1.3813 0.2636 -0.1451 -0.2789 522 ARG B CG 10497 C CD . ARG B 541 ? 1.2561 1.0220 1.3557 0.2621 -0.1399 -0.3076 522 ARG B CD 10498 N NE . ARG B 541 ? 1.2529 1.0377 1.3874 0.2749 -0.1391 -0.3412 522 ARG B NE 10499 C CZ . ARG B 541 ? 1.2617 1.0671 1.4054 0.2759 -0.1332 -0.3734 522 ARG B CZ 10500 N NH1 . ARG B 541 ? 1.2361 1.0450 1.3558 0.2647 -0.1282 -0.3748 522 ARG B NH1 10501 N NH2 . ARG B 541 ? 1.1438 0.9684 1.3214 0.2880 -0.1323 -0.4054 522 ARG B NH2 10502 N N . CYS B 542 ? 1.1384 0.8078 1.2295 0.2558 -0.1762 -0.1986 523 CYS B N 10503 C CA . CYS B 542 ? 1.1925 0.8338 1.3158 0.2630 -0.1922 -0.1880 523 CYS B CA 10504 C C . CYS B 542 ? 1.2126 0.8610 1.3360 0.2678 -0.1964 -0.1711 523 CYS B C 10505 O O . CYS B 542 ? 1.2427 0.8851 1.4001 0.2793 -0.2059 -0.1745 523 CYS B O 10506 C CB . CYS B 542 ? 1.1587 0.7678 1.2753 0.2528 -0.2012 -0.1649 523 CYS B CB 10507 S SG . CYS B 542 ? 1.4476 1.0237 1.5999 0.2583 -0.2222 -0.1420 523 CYS B SG 10508 N N . LEU B 543 ? 1.0555 0.7177 1.1431 0.2590 -0.1894 -0.1538 524 LEU B N 10509 C CA . LEU B 543 ? 0.9893 0.6612 1.0732 0.2620 -0.1924 -0.1379 524 LEU B CA 10510 C C . LEU B 543 ? 1.0011 0.6982 1.1044 0.2744 -0.1879 -0.1581 524 LEU B C 10511 O O . LEU B 543 ? 1.0536 0.7480 1.1791 0.2834 -0.1970 -0.1530 524 LEU B O 10512 C CB . LEU B 543 ? 1.0352 0.7197 1.0791 0.2497 -0.1844 -0.1202 524 LEU B CB 10513 C CG . LEU B 543 ? 0.9765 0.6778 1.0138 0.2516 -0.1848 -0.1079 524 LEU B CG 10514 C CD1 . LEU B 543 ? 0.9650 0.6482 1.0202 0.2562 -0.2008 -0.0897 524 LEU B CD1 10515 C CD2 . LEU B 543 ? 0.9602 0.6730 0.9620 0.2388 -0.1769 -0.0937 524 LEU B CD2 10516 N N . VAL B 544 ? 0.9822 0.7054 1.0775 0.2745 -0.1741 -0.1804 525 VAL B N 10517 C CA . VAL B 544 ? 1.0210 0.7737 1.1313 0.2846 -0.1678 -0.1991 525 VAL B CA 10518 C C . VAL B 544 ? 1.1227 0.8717 1.2763 0.2986 -0.1737 -0.2237 525 VAL B C 10519 O O . VAL B 544 ? 1.0934 0.8620 1.2668 0.3088 -0.1721 -0.2364 525 VAL B O 10520 C CB . VAL B 544 ? 0.9796 0.7668 1.0669 0.2788 -0.1508 -0.2128 525 VAL B CB 10521 C CG1 . VAL B 544 ? 0.9780 0.7643 1.0273 0.2641 -0.1456 -0.1915 525 VAL B CG1 10522 C CG2 . VAL B 544 ? 0.8559 0.6508 0.9541 0.2808 -0.1455 -0.2411 525 VAL B CG2 10523 N N . GLU B 545 ? 1.1642 0.8885 1.3353 0.2991 -0.1808 -0.2309 526 GLU B N 10524 C CA . GLU B 545 ? 1.2102 0.9314 1.4265 0.3120 -0.1860 -0.2583 526 GLU B CA 10525 C C . GLU B 545 ? 1.2311 0.9178 1.4841 0.3192 -0.2050 -0.2450 526 GLU B C 10526 O O . GLU B 545 ? 1.0608 0.7495 1.3536 0.3324 -0.2115 -0.2586 526 GLU B O 10527 C CB . GLU B 545 ? 1.2824 1.0055 1.5010 0.3090 -0.1801 -0.2833 526 GLU B CB 10528 C CG . GLU B 545 ? 1.2976 1.0620 1.4920 0.3051 -0.1621 -0.3040 526 GLU B CG 10529 C CD . GLU B 545 ? 1.3286 1.0959 1.5216 0.3005 -0.1570 -0.3265 526 GLU B CD 10530 O OE1 . GLU B 545 ? 1.4266 1.1616 1.6372 0.3000 -0.1672 -0.3258 526 GLU B OE1 10531 O OE2 . GLU B 545 ? 1.2179 1.0213 1.3928 0.2969 -0.1431 -0.3443 526 GLU B OE2 10532 N N . LYS B 546 ? 1.2855 0.9421 1.5267 0.3101 -0.2142 -0.2178 527 LYS B N 10533 C CA . LYS B 546 ? 1.2581 0.8813 1.5351 0.3149 -0.2332 -0.2024 527 LYS B CA 10534 C C . LYS B 546 ? 1.2852 0.8939 1.5414 0.3070 -0.2427 -0.1618 527 LYS B C 10535 O O . LYS B 546 ? 1.4113 1.0140 1.6896 0.3139 -0.2548 -0.1476 527 LYS B O 10536 C CB . LYS B 546 ? 1.2601 0.8582 1.5569 0.3123 -0.2385 -0.2118 527 LYS B CB 10537 C CG . LYS B 546 ? 1.2861 0.9046 1.6054 0.3164 -0.2285 -0.2517 527 LYS B CG 10538 C CD . LYS B 546 ? 1.3269 0.9269 1.6608 0.3091 -0.2312 -0.2587 527 LYS B CD 10539 C CE . LYS B 546 ? 1.4118 1.0368 1.7664 0.3125 -0.2212 -0.2997 527 LYS B CE 10540 N NZ . LYS B 546 ? 1.4556 1.0637 1.8306 0.3059 -0.2251 -0.3078 527 LYS B NZ 10541 N N . GLY B 547 ? 1.2086 0.8142 1.4233 0.2925 -0.2372 -0.1438 528 GLY B N 10542 C CA . GLY B 547 ? 1.2125 0.8070 1.4060 0.2834 -0.2455 -0.1072 528 GLY B CA 10543 C C . GLY B 547 ? 1.2832 0.9014 1.4549 0.2836 -0.2415 -0.0963 528 GLY B C 10544 O O . GLY B 547 ? 1.3210 0.9632 1.4970 0.2915 -0.2330 -0.1157 528 GLY B O 10545 N N . ASP B 548 ? 1.2000 0.8135 1.3493 0.2743 -0.2475 -0.0657 529 ASP B N 10546 C CA . ASP B 548 ? 1.2364 0.8726 1.3650 0.2733 -0.2445 -0.0550 529 ASP B CA 10547 C C . ASP B 548 ? 1.2251 0.8680 1.3096 0.2578 -0.2384 -0.0361 529 ASP B C 10548 O O . ASP B 548 ? 1.1337 0.7963 1.1996 0.2554 -0.2351 -0.0283 529 ASP B O 10549 C CB . ASP B 548 ? 1.2458 0.8778 1.4009 0.2815 -0.2606 -0.0393 529 ASP B CB 10550 C CG . ASP B 548 ? 1.3324 0.9379 1.4995 0.2765 -0.2776 -0.0119 529 ASP B CG 10551 O OD1 . ASP B 548 ? 1.1397 0.7338 1.3441 0.2856 -0.2929 -0.0046 529 ASP B OD1 10552 O OD2 . ASP B 548 ? 1.4955 1.0924 1.6363 0.2632 -0.2762 0.0033 529 ASP B OD2 10553 N N . VAL B 549 ? 1.2167 0.8442 1.2869 0.2475 -0.2367 -0.0306 530 VAL B N 10554 C CA . VAL B 549 ? 1.0572 0.6915 1.0879 0.2327 -0.2297 -0.0164 530 VAL B CA 10555 C C . VAL B 549 ? 1.0383 0.6608 1.0566 0.2242 -0.2224 -0.0233 530 VAL B C 10556 O O . VAL B 549 ? 1.2727 0.8714 1.3076 0.2235 -0.2304 -0.0197 530 VAL B O 10557 C CB . VAL B 549 ? 0.8783 0.5070 0.9003 0.2252 -0.2419 0.0148 530 VAL B CB 10558 C CG1 . VAL B 549 ? 1.1853 0.7876 1.2378 0.2284 -0.2584 0.0281 530 VAL B CG1 10559 C CG2 . VAL B 549 ? 0.9262 0.5587 0.9120 0.2092 -0.2351 0.0269 530 VAL B CG2 10560 N N . ALA B 550 ? 0.8793 0.5188 0.8710 0.2176 -0.2079 -0.0328 531 ALA B N 10561 C CA . ALA B 550 ? 0.8930 0.5249 0.8709 0.2091 -0.2002 -0.0398 531 ALA B CA 10562 C C . ALA B 550 ? 0.9136 0.5494 0.8587 0.1942 -0.1958 -0.0227 531 ALA B C 10563 O O . ALA B 550 ? 0.8243 0.4805 0.7519 0.1910 -0.1901 -0.0186 531 ALA B O 10564 C CB . ALA B 550 ? 0.8265 0.4761 0.8036 0.2134 -0.1872 -0.0662 531 ALA B CB 10565 N N . PHE B 551 ? 0.9220 0.5391 0.8613 0.1852 -0.1985 -0.0138 532 PHE B N 10566 C CA . PHE B 551 ? 1.0080 0.6292 0.9180 0.1707 -0.1937 0.0002 532 PHE B CA 10567 C C . PHE B 551 ? 1.0229 0.6484 0.9193 0.1651 -0.1813 -0.0148 532 PHE B C 10568 O O . PHE B 551 ? 1.0011 0.6099 0.9027 0.1624 -0.1820 -0.0196 532 PHE B O 10569 C CB . PHE B 551 ? 0.9852 0.5864 0.8960 0.1627 -0.2046 0.0228 532 PHE B CB 10570 C CG . PHE B 551 ? 1.0161 0.6146 0.9408 0.1672 -0.2182 0.0407 532 PHE B CG 10571 C CD1 . PHE B 551 ? 0.9007 0.5180 0.8082 0.1625 -0.2193 0.0554 532 PHE B CD1 10572 C CD2 . PHE B 551 ? 1.0194 0.5979 0.9768 0.1762 -0.2305 0.0422 532 PHE B CD2 10573 C CE1 . PHE B 551 ? 0.9457 0.5632 0.8654 0.1662 -0.2325 0.0728 532 PHE B CE1 10574 C CE2 . PHE B 551 ? 1.1232 0.7000 1.0957 0.1803 -0.2442 0.0606 532 PHE B CE2 10575 C CZ . PHE B 551 ? 1.0986 0.6955 1.0508 0.1750 -0.2453 0.0767 532 PHE B CZ 10576 N N . VAL B 552 ? 1.1706 0.8194 1.0513 0.1629 -0.1705 -0.0215 533 VAL B N 10577 C CA . VAL B 552 ? 1.0918 0.7499 0.9653 0.1606 -0.1592 -0.0378 533 VAL B CA 10578 C C . VAL B 552 ? 0.9158 0.5928 0.7672 0.1507 -0.1497 -0.0333 533 VAL B C 10579 O O . VAL B 552 ? 0.9342 0.6153 0.7756 0.1449 -0.1519 -0.0191 533 VAL B O 10580 C CB . VAL B 552 ? 0.8136 0.4834 0.7045 0.1731 -0.1560 -0.0585 533 VAL B CB 10581 C CG1 . VAL B 552 ? 0.7591 0.4558 0.6461 0.1764 -0.1497 -0.0609 533 VAL B CG1 10582 C CG2 . VAL B 552 ? 0.8930 0.5636 0.7846 0.1722 -0.1494 -0.0762 533 VAL B CG2 10583 N N . LYS B 553 ? 0.8687 0.5584 0.7145 0.1483 -0.1398 -0.0454 534 LYS B N 10584 C CA . LYS B 553 ? 0.9667 0.6735 0.7974 0.1391 -0.1314 -0.0418 534 LYS B CA 10585 C C . LYS B 553 ? 1.0241 0.7552 0.8590 0.1440 -0.1273 -0.0445 534 LYS B C 10586 O O . LYS B 553 ? 1.1888 0.9270 1.0366 0.1544 -0.1280 -0.0534 534 LYS B O 10587 C CB . LYS B 553 ? 1.0884 0.7986 0.9134 0.1337 -0.1238 -0.0512 534 LYS B CB 10588 C CG . LYS B 553 ? 1.0777 0.7825 0.8883 0.1207 -0.1212 -0.0424 534 LYS B CG 10589 C CD . LYS B 553 ? 1.0750 0.7811 0.8820 0.1161 -0.1156 -0.0516 534 LYS B CD 10590 C CE . LYS B 553 ? 1.0349 0.7660 0.8458 0.1200 -0.1084 -0.0624 534 LYS B CE 10591 N NZ . LYS B 553 ? 0.9369 0.6745 0.7421 0.1134 -0.1030 -0.0684 534 LYS B NZ 10592 N N . HIS B 554 ? 0.8974 0.6420 0.7240 0.1364 -0.1230 -0.0379 535 HIS B N 10593 C CA . HIS B 554 ? 0.9577 0.7251 0.7910 0.1400 -0.1196 -0.0395 535 HIS B CA 10594 C C . HIS B 554 ? 0.9658 0.7525 0.8052 0.1419 -0.1112 -0.0495 535 HIS B C 10595 O O . HIS B 554 ? 0.9506 0.7569 0.7985 0.1454 -0.1083 -0.0510 535 HIS B O 10596 C CB . HIS B 554 ? 0.9025 0.6793 0.7293 0.1312 -0.1184 -0.0309 535 HIS B CB 10597 C CG . HIS B 554 ? 0.8615 0.6492 0.6855 0.1222 -0.1102 -0.0323 535 HIS B CG 10598 N ND1 . HIS B 554 ? 0.8561 0.6331 0.6700 0.1127 -0.1085 -0.0294 535 HIS B ND1 10599 C CD2 . HIS B 554 ? 0.8625 0.6711 0.6955 0.1209 -0.1039 -0.0353 535 HIS B CD2 10600 C CE1 . HIS B 554 ? 0.8339 0.6246 0.6508 0.1064 -0.1017 -0.0309 535 HIS B CE1 10601 N NE2 . HIS B 554 ? 0.8005 0.6104 0.6297 0.1110 -0.0991 -0.0338 535 HIS B NE2 10602 N N . GLN B 555 ? 0.8680 0.6510 0.7033 0.1391 -0.1076 -0.0557 536 GLN B N 10603 C CA . GLN B 555 ? 0.7312 0.5354 0.5712 0.1406 -0.1002 -0.0645 536 GLN B CA 10604 C C . GLN B 555 ? 0.7987 0.6028 0.6471 0.1510 -0.1016 -0.0779 536 GLN B C 10605 O O . GLN B 555 ? 0.7361 0.5625 0.5902 0.1544 -0.0960 -0.0866 536 GLN B O 10606 C CB . GLN B 555 ? 0.7912 0.5971 0.6221 0.1306 -0.0952 -0.0641 536 GLN B CB 10607 C CG . GLN B 555 ? 0.9812 0.7870 0.8067 0.1198 -0.0936 -0.0530 536 GLN B CG 10608 C CD . GLN B 555 ? 0.9988 0.7800 0.8140 0.1141 -0.0982 -0.0477 536 GLN B CD 10609 O OE1 . GLN B 555 ? 1.0484 0.8128 0.8626 0.1187 -0.1046 -0.0463 536 GLN B OE1 10610 N NE2 . GLN B 555 ? 0.8613 0.6412 0.6702 0.1038 -0.0951 -0.0437 536 GLN B NE2 10611 N N . THR B 556 ? 0.8554 0.6357 0.7064 0.1556 -0.1092 -0.0796 537 THR B N 10612 C CA . THR B 556 ? 0.8040 0.5802 0.6669 0.1652 -0.1115 -0.0946 537 THR B CA 10613 C C . THR B 556 ? 0.8608 0.6587 0.7377 0.1755 -0.1092 -0.1043 537 THR B C 10614 O O . THR B 556 ? 0.9347 0.7493 0.8170 0.1792 -0.1041 -0.1194 537 THR B O 10615 C CB . THR B 556 ? 0.9027 0.6490 0.7726 0.1691 -0.1222 -0.0912 537 THR B CB 10616 O OG1 . THR B 556 ? 0.7718 0.4991 0.6299 0.1594 -0.1238 -0.0839 537 THR B OG1 10617 C CG2 . THR B 556 ? 0.7397 0.4820 0.6288 0.1803 -0.1253 -0.1089 537 THR B CG2 10618 N N . VAL B 557 ? 0.7676 0.5677 0.6503 0.1797 -0.1127 -0.0961 538 VAL B N 10619 C CA . VAL B 557 ? 0.7694 0.5895 0.6671 0.1897 -0.1110 -0.1047 538 VAL B CA 10620 C C . VAL B 557 ? 0.9069 0.7603 0.8030 0.1867 -0.1003 -0.1089 538 VAL B C 10621 O O . VAL B 557 ? 1.0754 0.9481 0.9813 0.1931 -0.0961 -0.1229 538 VAL B O 10622 C CB . VAL B 557 ? 0.7216 0.5371 0.6269 0.1949 -0.1181 -0.0949 538 VAL B CB 10623 C CG1 . VAL B 557 ? 0.6870 0.5249 0.6085 0.2047 -0.1157 -0.1040 538 VAL B CG1 10624 C CG2 . VAL B 557 ? 0.7671 0.5535 0.6780 0.1989 -0.1296 -0.0905 538 VAL B CG2 10625 N N . PRO B 558 ? 0.8837 0.7459 0.7698 0.1766 -0.0961 -0.0967 539 PRO B N 10626 C CA . PRO B 558 ? 0.9724 0.8662 0.8597 0.1729 -0.0868 -0.0988 539 PRO B CA 10627 C C . PRO B 558 ? 0.9280 0.8301 0.8083 0.1694 -0.0819 -0.1089 539 PRO B C 10628 O O . PRO B 558 ? 0.8760 0.8080 0.7600 0.1697 -0.0751 -0.1152 539 PRO B O 10629 C CB . PRO B 558 ? 0.9553 0.8526 0.8376 0.1624 -0.0850 -0.0831 539 PRO B CB 10630 C CG . PRO B 558 ? 1.0318 0.8998 0.9050 0.1590 -0.0917 -0.0759 539 PRO B CG 10631 C CD . PRO B 558 ? 0.9384 0.7882 0.8165 0.1691 -0.0993 -0.0814 539 PRO B CD 10632 N N . GLN B 559 ? 0.7868 0.6653 0.6578 0.1659 -0.0853 -0.1105 540 GLN B N 10633 C CA . GLN B 559 ? 0.8252 0.7108 0.6898 0.1626 -0.0815 -0.1216 540 GLN B CA 10634 C C . GLN B 559 ? 0.8649 0.7650 0.7407 0.1725 -0.0799 -0.1425 540 GLN B C 10635 O O . GLN B 559 ? 0.9538 0.8763 0.8261 0.1700 -0.0742 -0.1536 540 GLN B O 10636 C CB . GLN B 559 ? 0.8246 0.6790 0.6803 0.1580 -0.0867 -0.1202 540 GLN B CB 10637 C CG . GLN B 559 ? 0.8762 0.7305 0.7180 0.1450 -0.0838 -0.1086 540 GLN B CG 10638 C CD . GLN B 559 ? 1.0327 0.8558 0.8670 0.1406 -0.0892 -0.1067 540 GLN B CD 10639 O OE1 . GLN B 559 ? 1.1782 0.9801 1.0187 0.1470 -0.0952 -0.1139 540 GLN B OE1 10640 N NE2 . GLN B 559 ? 1.1017 0.9219 0.9253 0.1295 -0.0873 -0.0964 540 GLN B NE2 10641 N N . ASN B 560 ? 0.7307 0.6200 0.6210 0.1836 -0.0852 -0.1485 541 ASN B N 10642 C CA . ASN B 560 ? 0.8063 0.7054 0.7118 0.1940 -0.0849 -0.1709 541 ASN B CA 10643 C C . ASN B 560 ? 0.9065 0.8287 0.8264 0.2027 -0.0824 -0.1755 541 ASN B C 10644 O O . ASN B 560 ? 0.8817 0.8064 0.8194 0.2136 -0.0843 -0.1930 541 ASN B O 10645 C CB . ASN B 560 ? 0.9007 0.7644 0.8173 0.2007 -0.0948 -0.1778 541 ASN B CB 10646 C CG . ASN B 560 ? 0.9129 0.7544 0.8175 0.1922 -0.0973 -0.1750 541 ASN B CG 10647 O OD1 . ASN B 560 ? 0.8916 0.7412 0.7954 0.1907 -0.0942 -0.1909 541 ASN B OD1 10648 N ND2 . ASN B 560 ? 0.9494 0.7648 0.8447 0.1863 -0.1028 -0.1555 541 ASN B ND2 10649 N N . THR B 561 ? 0.8524 0.7918 0.7678 0.1980 -0.0783 -0.1603 542 THR B N 10650 C CA . THR B 561 ? 0.8947 0.8599 0.8238 0.2048 -0.0749 -0.1633 542 THR B CA 10651 C C . THR B 561 ? 0.8219 0.8266 0.7454 0.1969 -0.0648 -0.1581 542 THR B C 10652 O O . THR B 561 ? 0.8581 0.8671 0.7674 0.1858 -0.0616 -0.1487 542 THR B O 10653 C CB . THR B 561 ? 0.9200 0.8690 0.8561 0.2086 -0.0816 -0.1494 542 THR B CB 10654 O OG1 . THR B 561 ? 0.9156 0.8553 0.8384 0.1980 -0.0822 -0.1298 542 THR B OG1 10655 C CG2 . THR B 561 ? 0.7559 0.6718 0.7016 0.2176 -0.0923 -0.1537 542 THR B CG2 10656 N N . GLY B 562 ? 0.8495 0.8838 0.7859 0.2023 -0.0601 -0.1635 543 GLY B N 10657 C CA . GLY B 562 ? 0.9639 1.0382 0.8985 0.1946 -0.0511 -0.1557 543 GLY B CA 10658 C C . GLY B 562 ? 1.0803 1.1871 1.0079 0.1905 -0.0433 -0.1686 543 GLY B C 10659 O O . GLY B 562 ? 0.9151 1.0621 0.8436 0.1851 -0.0356 -0.1641 543 GLY B O 10660 N N . GLY B 563 ? 1.1568 1.2482 1.0783 0.1923 -0.0456 -0.1843 544 GLY B N 10661 C CA . GLY B 563 ? 1.0516 1.1742 0.9661 0.1885 -0.0389 -0.1998 544 GLY B CA 10662 C C . GLY B 563 ? 1.1120 1.2208 1.0085 0.1786 -0.0404 -0.1949 544 GLY B C 10663 O O . GLY B 563 ? 1.2300 1.3620 1.1191 0.1748 -0.0360 -0.2086 544 GLY B O 10664 N N . LYS B 564 ? 1.0336 1.1068 0.9235 0.1740 -0.0465 -0.1764 545 LYS B N 10665 C CA . LYS B 564 ? 1.0759 1.1329 0.9502 0.1645 -0.0484 -0.1707 545 LYS B CA 10666 C C . LYS B 564 ? 1.0475 1.0885 0.9219 0.1696 -0.0516 -0.1937 545 LYS B C 10667 O O . LYS B 564 ? 0.9608 1.0057 0.8237 0.1624 -0.0504 -0.1980 545 LYS B O 10668 C CB . LYS B 564 ? 1.1376 1.1581 1.0079 0.1603 -0.0546 -0.1499 545 LYS B CB 10669 C CG . LYS B 564 ? 1.1960 1.2286 1.0716 0.1565 -0.0528 -0.1298 545 LYS B CG 10670 C CD . LYS B 564 ? 1.1583 1.1569 1.0313 0.1528 -0.0588 -0.1136 545 LYS B CD 10671 C CE . LYS B 564 ? 1.0414 1.0493 0.9257 0.1524 -0.0583 -0.0991 545 LYS B CE 10672 N NZ . LYS B 564 ? 1.0067 1.0282 0.9045 0.1633 -0.0574 -0.1084 545 LYS B NZ 10673 N N . ASN B 565 ? 1.0484 1.0716 0.9387 0.1820 -0.0562 -0.2082 546 ASN B N 10674 C CA . ASN B 565 ? 1.0788 1.0897 0.9776 0.1886 -0.0595 -0.2330 546 ASN B CA 10675 C C . ASN B 565 ? 1.1304 1.1800 1.0424 0.1963 -0.0533 -0.2584 546 ASN B C 10676 O O . ASN B 565 ? 1.2951 1.3439 1.2259 0.2073 -0.0549 -0.2666 546 ASN B O 10677 C CB . ASN B 565 ? 1.1157 1.0805 1.0279 0.1971 -0.0701 -0.2314 546 ASN B CB 10678 C CG . ASN B 565 ? 1.1541 1.0983 1.0774 0.2020 -0.0755 -0.2526 546 ASN B CG 10679 O OD1 . ASN B 565 ? 1.3000 1.2536 1.2437 0.2122 -0.0758 -0.2767 546 ASN B OD1 10680 N ND2 . ASN B 565 ? 1.0764 0.9927 0.9891 0.1947 -0.0800 -0.2444 546 ASN B ND2 10681 N N . PRO B 566 ? 1.1188 1.2048 1.0214 0.1901 -0.0461 -0.2715 547 PRO B N 10682 C CA . PRO B 566 ? 1.0822 1.2167 0.9934 0.1944 -0.0379 -0.2941 547 PRO B CA 10683 C C . PRO B 566 ? 1.1599 1.2875 1.0953 0.2077 -0.0409 -0.3275 547 PRO B C 10684 O O . PRO B 566 ? 1.1919 1.3578 1.1392 0.2134 -0.0345 -0.3489 547 PRO B O 10685 C CB . PRO B 566 ? 0.9939 1.1648 0.8855 0.1820 -0.0313 -0.2967 547 PRO B CB 10686 C CG . PRO B 566 ? 1.0898 1.2220 0.9715 0.1767 -0.0382 -0.2912 547 PRO B CG 10687 C CD . PRO B 566 ? 1.1390 1.2235 1.0226 0.1784 -0.0458 -0.2667 547 PRO B CD 10688 N N . ASP B 567 ? 1.2363 1.3170 1.1812 0.2123 -0.0507 -0.3316 548 ASP B N 10689 C CA . ASP B 567 ? 1.1619 1.2296 1.1359 0.2252 -0.0558 -0.3615 548 ASP B CA 10690 C C . ASP B 567 ? 1.1505 1.2232 1.1477 0.2376 -0.0564 -0.3663 548 ASP B C 10691 O O . ASP B 567 ? 1.0625 1.1321 1.0532 0.2365 -0.0563 -0.3419 548 ASP B O 10692 C CB . ASP B 567 ? 1.0651 1.0774 1.0461 0.2265 -0.0676 -0.3564 548 ASP B CB 10693 C CG . ASP B 567 ? 1.0794 1.0876 1.0412 0.2151 -0.0672 -0.3559 548 ASP B CG 10694 O OD1 . ASP B 567 ? 1.1425 1.1140 1.0928 0.2089 -0.0733 -0.3333 548 ASP B OD1 10695 O OD2 . ASP B 567 ? 1.0687 1.1129 1.0269 0.2120 -0.0606 -0.3786 548 ASP B OD2 10696 N N . PRO B 568 ? 1.1734 1.2555 1.1999 0.2493 -0.0572 -0.3991 549 PRO B N 10697 C CA . PRO B 568 ? 1.1395 1.2328 1.1906 0.2614 -0.0569 -0.4071 549 PRO B CA 10698 C C . PRO B 568 ? 1.2123 1.2595 1.2760 0.2683 -0.0683 -0.3850 549 PRO B C 10699 O O . PRO B 568 ? 1.1225 1.1803 1.1912 0.2726 -0.0668 -0.3750 549 PRO B O 10700 C CB . PRO B 568 ? 1.0558 1.1622 1.1391 0.2722 -0.0571 -0.4494 549 PRO B CB 10701 C CG . PRO B 568 ? 1.1169 1.1960 1.1991 0.2682 -0.0631 -0.4576 549 PRO B CG 10702 C CD . PRO B 568 ? 1.1990 1.2848 1.2402 0.2521 -0.0581 -0.4326 549 PRO B CD 10703 N N . TRP B 569 ? 1.3004 1.2994 1.3691 0.2686 -0.0796 -0.3767 550 TRP B N 10704 C CA . TRP B 569 ? 1.3105 1.2680 1.3925 0.2748 -0.0916 -0.3563 550 TRP B CA 10705 C C . TRP B 569 ? 1.2592 1.2121 1.3146 0.2668 -0.0905 -0.3211 550 TRP B C 10706 O O . TRP B 569 ? 1.2217 1.1528 1.2861 0.2718 -0.0983 -0.3046 550 TRP B O 10707 C CB . TRP B 569 ? 1.2375 1.1474 1.3312 0.2755 -0.1041 -0.3539 550 TRP B CB 10708 C CG . TRP B 569 ? 1.0967 0.9886 1.1586 0.2615 -0.1041 -0.3327 550 TRP B CG 10709 C CD1 . TRP B 569 ? 1.0570 0.9554 1.1064 0.2536 -0.1000 -0.3442 550 TRP B CD1 10710 C CD2 . TRP B 569 ? 1.0009 0.8671 1.0411 0.2537 -0.1086 -0.2979 550 TRP B CD2 10711 N NE1 . TRP B 569 ? 1.0789 0.9560 1.1010 0.2416 -0.1017 -0.3180 550 TRP B NE1 10712 C CE2 . TRP B 569 ? 1.0475 0.9054 1.0639 0.2415 -0.1066 -0.2900 550 TRP B CE2 10713 C CE3 . TRP B 569 ? 0.9496 0.8013 0.9891 0.2558 -0.1140 -0.2739 550 TRP B CE3 10714 C CZ2 . TRP B 569 ? 1.0126 0.8486 1.0056 0.2315 -0.1093 -0.2601 550 TRP B CZ2 10715 C CZ3 . TRP B 569 ? 1.0041 0.8356 1.0194 0.2456 -0.1167 -0.2449 550 TRP B CZ3 10716 C CH2 . TRP B 569 ? 0.9897 0.8135 0.9826 0.2337 -0.1141 -0.2386 550 TRP B CH2 10717 N N . ALA B 570 ? 1.1565 1.1314 1.1815 0.2543 -0.0814 -0.3101 551 ALA B N 10718 C CA . ALA B 570 ? 1.1209 1.0893 1.1230 0.2454 -0.0809 -0.2780 551 ALA B CA 10719 C C . ALA B 570 ? 1.2994 1.3122 1.2877 0.2393 -0.0692 -0.2722 551 ALA B C 10720 O O . ALA B 570 ? 1.3444 1.3558 1.3177 0.2320 -0.0682 -0.2473 551 ALA B O 10721 C CB . ALA B 570 ? 1.0037 0.9451 0.9841 0.2342 -0.0841 -0.2620 551 ALA B CB 10722 N N . LYS B 571 ? 1.4355 1.4891 1.4309 0.2421 -0.0605 -0.2951 552 LYS B N 10723 C CA . LYS B 571 ? 1.4404 1.5411 1.4232 0.2347 -0.0491 -0.2892 552 LYS B CA 10724 C C . LYS B 571 ? 1.3863 1.4940 1.3750 0.2372 -0.0485 -0.2716 552 LYS B C 10725 O O . LYS B 571 ? 1.3914 1.5150 1.3657 0.2274 -0.0438 -0.2503 552 LYS B O 10726 C CB . LYS B 571 ? 1.4173 1.5642 1.4086 0.2377 -0.0401 -0.3194 552 LYS B CB 10727 N N . ASN B 572 ? 1.2264 1.3220 1.2389 0.2500 -0.0540 -0.2804 553 ASN B N 10728 C CA . ASN B 572 ? 1.1024 1.2078 1.1238 0.2536 -0.0536 -0.2676 553 ASN B CA 10729 C C . ASN B 572 ? 1.0585 1.1225 1.0793 0.2546 -0.0643 -0.2447 553 ASN B C 10730 O O . ASN B 572 ? 0.9270 0.9951 0.9566 0.2581 -0.0657 -0.2344 553 ASN B O 10731 C CB . ASN B 572 ? 1.1251 1.2513 1.1745 0.2670 -0.0520 -0.2917 553 ASN B CB 10732 C CG . ASN B 572 ? 1.1545 1.3283 1.2052 0.2658 -0.0405 -0.3165 553 ASN B CG 10733 O OD1 . ASN B 572 ? 1.0591 1.2601 1.0883 0.2538 -0.0322 -0.3102 553 ASN B OD1 10734 N ND2 . ASN B 572 ? 1.2342 1.4203 1.3114 0.2781 -0.0402 -0.3453 553 ASN B ND2 10735 N N . LEU B 573 ? 1.0000 1.0265 1.0104 0.2510 -0.0718 -0.2371 554 LEU B N 10736 C CA . LEU B 573 ? 0.8385 0.8285 0.8462 0.2507 -0.0820 -0.2159 554 LEU B CA 10737 C C . LEU B 573 ? 0.8642 0.8632 0.8559 0.2405 -0.0784 -0.1921 554 LEU B C 10738 O O . LEU B 573 ? 0.7823 0.8035 0.7597 0.2304 -0.0700 -0.1872 554 LEU B O 10739 C CB . LEU B 573 ? 0.7998 0.7514 0.7998 0.2478 -0.0899 -0.2131 554 LEU B CB 10740 C CG . LEU B 573 ? 0.8496 0.7850 0.8707 0.2578 -0.0960 -0.2347 554 LEU B CG 10741 C CD1 . LEU B 573 ? 0.8556 0.7502 0.8702 0.2537 -0.1052 -0.2257 554 LEU B CD1 10742 C CD2 . LEU B 573 ? 0.7498 0.6824 0.8002 0.2718 -0.1026 -0.2425 554 LEU B CD2 10743 N N . ASN B 574 ? 0.8784 0.8612 0.8750 0.2431 -0.0855 -0.1778 555 ASN B N 10744 C CA . ASN B 574 ? 0.8439 0.8331 0.8308 0.2347 -0.0836 -0.1574 555 ASN B CA 10745 C C . ASN B 574 ? 0.8064 0.7604 0.7834 0.2308 -0.0931 -0.1415 555 ASN B C 10746 O O . ASN B 574 ? 0.8362 0.7671 0.8217 0.2382 -0.1028 -0.1417 555 ASN B O 10747 C CB . ASN B 574 ? 0.8910 0.9020 0.8951 0.2411 -0.0824 -0.1569 555 ASN B CB 10748 C CG . ASN B 574 ? 0.9460 0.9739 0.9455 0.2318 -0.0779 -0.1400 555 ASN B CG 10749 O OD1 . ASN B 574 ? 1.1116 1.1243 1.0981 0.2229 -0.0801 -0.1257 555 ASN B OD1 10750 N ND2 . ASN B 574 ? 0.8791 0.9397 0.8919 0.2339 -0.0716 -0.1422 555 ASN B ND2 10751 N N . GLU B 575 ? 0.8690 0.8209 0.8295 0.2189 -0.0904 -0.1276 556 GLU B N 10752 C CA . GLU B 575 ? 0.8544 0.7775 0.8039 0.2137 -0.0980 -0.1136 556 GLU B CA 10753 C C . GLU B 575 ? 0.8782 0.7959 0.8364 0.2183 -0.1054 -0.1051 556 GLU B C 10754 O O . GLU B 575 ? 0.8420 0.7354 0.7957 0.2184 -0.1144 -0.0975 556 GLU B O 10755 C CB . GLU B 575 ? 0.7310 0.6575 0.6650 0.2002 -0.0929 -0.1022 556 GLU B CB 10756 C CG . GLU B 575 ? 0.9389 0.8932 0.8794 0.1955 -0.0866 -0.0950 556 GLU B CG 10757 C CD . GLU B 575 ? 1.2296 1.1843 1.1600 0.1825 -0.0834 -0.0831 556 GLU B CD 10758 O OE1 . GLU B 575 ? 1.3539 1.2857 1.2708 0.1774 -0.0866 -0.0798 556 GLU B OE1 10759 O OE2 . GLU B 575 ? 1.3084 1.2865 1.2468 0.1773 -0.0780 -0.0768 556 GLU B OE2 10760 N N . LYS B 576 ? 0.9012 0.8435 0.8722 0.2216 -0.1019 -0.1059 557 LYS B N 10761 C CA . LYS B 576 ? 0.8108 0.7525 0.7906 0.2252 -0.1084 -0.0985 557 LYS B CA 10762 C C . LYS B 576 ? 0.7051 0.6355 0.6989 0.2377 -0.1174 -0.1045 557 LYS B C 10763 O O . LYS B 576 ? 0.6480 0.5802 0.6512 0.2422 -0.1237 -0.0996 557 LYS B O 10764 C CB . LYS B 576 ? 0.7771 0.7494 0.7686 0.2237 -0.1017 -0.0968 557 LYS B CB 10765 C CG . LYS B 576 ? 0.8696 0.8523 0.8531 0.2110 -0.0950 -0.0877 557 LYS B CG 10766 C CD . LYS B 576 ? 0.9021 0.9144 0.9022 0.2095 -0.0895 -0.0846 557 LYS B CD 10767 C CE . LYS B 576 ? 0.9261 0.9491 0.9237 0.1968 -0.0835 -0.0748 557 LYS B CE 10768 N NZ . LYS B 576 ? 0.8756 0.8798 0.8654 0.1898 -0.0886 -0.0668 557 LYS B NZ 10769 N N . ASP B 577 ? 0.6944 0.6137 0.6917 0.2434 -0.1187 -0.1156 558 ASP B N 10770 C CA . ASP B 577 ? 0.7170 0.6220 0.7316 0.2552 -0.1286 -0.1209 558 ASP B CA 10771 C C . ASP B 577 ? 0.7258 0.5986 0.7319 0.2526 -0.1400 -0.1084 558 ASP B C 10772 O O . ASP B 577 ? 0.8822 0.7391 0.9029 0.2609 -0.1506 -0.1080 558 ASP B O 10773 C CB . ASP B 577 ? 0.7321 0.6420 0.7604 0.2631 -0.1250 -0.1412 558 ASP B CB 10774 C CG . ASP B 577 ? 0.8515 0.7960 0.8941 0.2686 -0.1160 -0.1542 558 ASP B CG 10775 O OD1 . ASP B 577 ? 0.6777 0.6346 0.7301 0.2720 -0.1176 -0.1490 558 ASP B OD1 10776 O OD2 . ASP B 577 ? 0.8978 0.8590 0.9422 0.2691 -0.1075 -0.1699 558 ASP B OD2 10777 N N . TYR B 578 ? 0.6895 0.5542 0.6737 0.2406 -0.1381 -0.0972 559 TYR B N 10778 C CA . TYR B 578 ? 0.7483 0.5848 0.7222 0.2362 -0.1472 -0.0856 559 TYR B CA 10779 C C . TYR B 578 ? 0.7548 0.5913 0.7123 0.2265 -0.1495 -0.0691 559 TYR B C 10780 O O . TYR B 578 ? 0.9160 0.7697 0.8656 0.2196 -0.1415 -0.0681 559 TYR B O 10781 C CB . TYR B 578 ? 0.7462 0.5696 0.7102 0.2309 -0.1430 -0.0912 559 TYR B CB 10782 C CG . TYR B 578 ? 0.8914 0.7182 0.8721 0.2400 -0.1402 -0.1108 559 TYR B CG 10783 C CD1 . TYR B 578 ? 0.8575 0.7108 0.8387 0.2400 -0.1284 -0.1245 559 TYR B CD1 10784 C CD2 . TYR B 578 ? 1.0903 0.8962 1.0887 0.2482 -0.1497 -0.1159 559 TYR B CD2 10785 C CE1 . TYR B 578 ? 0.8100 0.6713 0.8065 0.2479 -0.1253 -0.1447 559 TYR B CE1 10786 C CE2 . TYR B 578 ? 1.0403 0.8513 1.0576 0.2568 -0.1472 -0.1372 559 TYR B CE2 10787 C CZ . TYR B 578 ? 0.8437 0.6836 0.8587 0.2566 -0.1345 -0.1526 559 TYR B CZ 10788 O OH . TYR B 578 ? 0.8375 0.6869 0.8709 0.2647 -0.1314 -0.1761 559 TYR B OH 10789 N N . GLU B 579 ? 0.7695 0.5888 0.7245 0.2258 -0.1609 -0.0564 560 GLU B N 10790 C CA . GLU B 579 ? 0.8704 0.6914 0.8086 0.2158 -0.1635 -0.0422 560 GLU B CA 10791 C C . GLU B 579 ? 0.8727 0.6709 0.7966 0.2080 -0.1690 -0.0309 560 GLU B C 10792 O O . GLU B 579 ? 0.7964 0.5761 0.7245 0.2103 -0.1707 -0.0341 560 GLU B O 10793 C CB . GLU B 579 ? 0.8639 0.6958 0.8103 0.2203 -0.1719 -0.0352 560 GLU B CB 10794 C CG . GLU B 579 ? 0.9016 0.7223 0.8667 0.2315 -0.1839 -0.0327 560 GLU B CG 10795 C CD . GLU B 579 ? 0.9201 0.7557 0.8941 0.2361 -0.1917 -0.0267 560 GLU B CD 10796 O OE1 . GLU B 579 ? 0.8934 0.7476 0.8584 0.2301 -0.1879 -0.0251 560 GLU B OE1 10797 O OE2 . GLU B 579 ? 0.9683 0.7974 0.9609 0.2459 -0.2021 -0.0242 560 GLU B OE2 10798 N N . LEU B 580 ? 0.9434 0.7450 0.8517 0.1984 -0.1713 -0.0188 561 LEU B N 10799 C CA . LEU B 580 ? 0.7264 0.5110 0.6190 0.1888 -0.1751 -0.0071 561 LEU B CA 10800 C C . LEU B 580 ? 0.8634 0.6470 0.7524 0.1866 -0.1874 0.0098 561 LEU B C 10801 O O . LEU B 580 ? 0.7697 0.5718 0.6602 0.1878 -0.1902 0.0122 561 LEU B O 10802 C CB . LEU B 580 ? 0.7097 0.5024 0.5847 0.1766 -0.1650 -0.0086 561 LEU B CB 10803 C CG . LEU B 580 ? 0.9331 0.7273 0.8087 0.1758 -0.1534 -0.0215 561 LEU B CG 10804 C CD1 . LEU B 580 ? 0.6795 0.4834 0.5416 0.1636 -0.1452 -0.0208 561 LEU B CD1 10805 C CD2 . LEU B 580 ? 0.7110 0.4829 0.5884 0.1781 -0.1548 -0.0246 561 LEU B CD2 10806 N N . LEU B 581 ? 0.9209 0.6846 0.8059 0.1828 -0.1950 0.0222 562 LEU B N 10807 C CA . LEU B 581 ? 0.8619 0.6261 0.7417 0.1786 -0.2073 0.0419 562 LEU B CA 10808 C C . LEU B 581 ? 0.8382 0.6141 0.6935 0.1638 -0.2031 0.0491 562 LEU B C 10809 O O . LEU B 581 ? 0.9884 0.7550 0.8325 0.1559 -0.1964 0.0474 562 LEU B O 10810 C CB . LEU B 581 ? 0.8044 0.5424 0.6955 0.1810 -0.2185 0.0541 562 LEU B CB 10811 C CG . LEU B 581 ? 0.8997 0.6263 0.8203 0.1962 -0.2245 0.0465 562 LEU B CG 10812 C CD1 . LEU B 581 ? 0.9809 0.6806 0.9171 0.1977 -0.2366 0.0591 562 LEU B CD1 10813 C CD2 . LEU B 581 ? 0.8786 0.6231 0.8096 0.2038 -0.2309 0.0488 562 LEU B CD2 10814 N N . CYS B 582 ? 0.7712 0.5695 0.6191 0.1600 -0.2070 0.0557 563 CYS B N 10815 C CA . CYS B 582 ? 0.8942 0.7087 0.7205 0.1459 -0.2031 0.0600 563 CYS B CA 10816 C C . CYS B 582 ? 0.8998 0.7140 0.7156 0.1381 -0.2147 0.0825 563 CYS B C 10817 O O . CYS B 582 ? 0.9013 0.7094 0.7279 0.1442 -0.2274 0.0958 563 CYS B O 10818 C CB . CYS B 582 ? 0.7892 0.6339 0.6145 0.1450 -0.1986 0.0496 563 CYS B CB 10819 S SG . CYS B 582 ? 1.0627 0.9124 0.9045 0.1538 -0.1866 0.0271 563 CYS B SG 10820 N N . LEU B 583 ? 0.8491 0.6712 0.6451 0.1244 -0.2106 0.0874 564 LEU B N 10821 C CA . LEU B 583 ? 0.8603 0.6855 0.6441 0.1146 -0.2204 0.1100 564 LEU B CA 10822 C C . LEU B 583 ? 0.8841 0.7378 0.6634 0.1129 -0.2299 0.1203 564 LEU B C 10823 O O . LEU B 583 ? 1.0464 0.9049 0.8187 0.1064 -0.2409 0.1427 564 LEU B O 10824 C CB . LEU B 583 ? 0.8116 0.6418 0.5755 0.0998 -0.2120 0.1103 564 LEU B CB 10825 C CG . LEU B 583 ? 0.8562 0.6570 0.6228 0.0993 -0.2057 0.1062 564 LEU B CG 10826 C CD1 . LEU B 583 ? 0.8534 0.6626 0.6014 0.0845 -0.1972 0.1055 564 LEU B CD1 10827 C CD2 . LEU B 583 ? 0.8355 0.6084 0.6141 0.1034 -0.2174 0.1237 564 LEU B CD2 10828 N N . ASP B 584 ? 0.8283 0.7022 0.6128 0.1184 -0.2262 0.1048 565 ASP B N 10829 C CA . ASP B 584 ? 0.9145 0.8179 0.6962 0.1175 -0.2350 0.1115 565 ASP B CA 10830 C C . ASP B 584 ? 0.8800 0.7748 0.6828 0.1318 -0.2461 0.1167 565 ASP B C 10831 O O . ASP B 584 ? 0.9156 0.8340 0.7209 0.1341 -0.2529 0.1185 565 ASP B O 10832 C CB . ASP B 584 ? 1.0904 1.0247 0.8670 0.1138 -0.2254 0.0910 565 ASP B CB 10833 C CG . ASP B 584 ? 1.1950 1.1248 0.9915 0.1260 -0.2186 0.0708 565 ASP B CG 10834 O OD1 . ASP B 584 ? 1.3265 1.2290 1.1351 0.1344 -0.2152 0.0669 565 ASP B OD1 10835 O OD2 . ASP B 584 ? 1.0750 1.0307 0.8758 0.1267 -0.2166 0.0585 565 ASP B OD2 10836 N N . GLY B 585 ? 0.8264 0.6890 0.6462 0.1414 -0.2477 0.1176 566 GLY B N 10837 C CA . GLY B 585 ? 0.9488 0.8009 0.7926 0.1553 -0.2583 0.1220 566 GLY B CA 10838 C C . GLY B 585 ? 0.8987 0.7550 0.7591 0.1677 -0.2514 0.0999 566 GLY B C 10839 O O . GLY B 585 ? 0.8713 0.7229 0.7528 0.1796 -0.2595 0.1010 566 GLY B O 10840 N N . THR B 586 ? 0.8528 0.7187 0.7059 0.1647 -0.2367 0.0805 567 THR B N 10841 C CA . THR B 586 ? 0.7696 0.6434 0.6383 0.1746 -0.2296 0.0612 567 THR B CA 10842 C C . THR B 586 ? 0.8790 0.7320 0.7570 0.1803 -0.2191 0.0473 567 THR B C 10843 O O . THR B 586 ? 0.8033 0.6353 0.6756 0.1767 -0.2174 0.0513 567 THR B O 10844 C CB . THR B 586 ? 0.7495 0.6527 0.6095 0.1677 -0.2216 0.0490 567 THR B CB 10845 O OG1 . THR B 586 ? 0.9070 0.8069 0.7558 0.1590 -0.2090 0.0401 567 THR B OG1 10846 C CG2 . THR B 586 ? 0.7619 0.6894 0.6082 0.1593 -0.2307 0.0609 567 THR B CG2 10847 N N . ARG B 587 ? 0.9286 0.7896 0.8213 0.1887 -0.2122 0.0313 568 ARG B N 10848 C CA . ARG B 587 ? 0.7430 0.5910 0.6441 0.1936 -0.2018 0.0175 568 ARG B CA 10849 C C . ARG B 587 ? 0.7332 0.5991 0.6352 0.1913 -0.1886 0.0023 568 ARG B C 10850 O O . ARG B 587 ? 0.7647 0.6521 0.6733 0.1926 -0.1884 -0.0021 568 ARG B O 10851 C CB . ARG B 587 ? 0.7385 0.5754 0.6627 0.2080 -0.2068 0.0136 568 ARG B CB 10852 C CG . ARG B 587 ? 0.8035 0.6165 0.7336 0.2109 -0.2188 0.0268 568 ARG B CG 10853 C CD . ARG B 587 ? 0.7917 0.5950 0.7497 0.2257 -0.2229 0.0188 568 ARG B CD 10854 N NE . ARG B 587 ? 0.7645 0.5879 0.7364 0.2339 -0.2248 0.0134 568 ARG B NE 10855 C CZ . ARG B 587 ? 0.8059 0.6357 0.7860 0.2374 -0.2379 0.0257 568 ARG B CZ 10856 N NH1 . ARG B 587 ? 0.8243 0.6426 0.7999 0.2330 -0.2506 0.0457 568 ARG B NH1 10857 N NH2 . ARG B 587 ? 0.9272 0.7760 0.9207 0.2448 -0.2388 0.0192 568 ARG B NH2 10858 N N . LYS B 588 ? 0.9002 0.7574 0.7974 0.1875 -0.1783 -0.0048 569 LYS B N 10859 C CA . LYS B 588 ? 0.7686 0.6410 0.6691 0.1844 -0.1663 -0.0167 569 LYS B CA 10860 C C . LYS B 588 ? 0.8271 0.6899 0.7338 0.1887 -0.1582 -0.0255 569 LYS B C 10861 O O . LYS B 588 ? 0.9412 0.7839 0.8449 0.1907 -0.1606 -0.0236 569 LYS B O 10862 C CB . LYS B 588 ? 0.6779 0.5568 0.5632 0.1710 -0.1617 -0.0149 569 LYS B CB 10863 C CG . LYS B 588 ? 0.6886 0.5856 0.5693 0.1662 -0.1679 -0.0106 569 LYS B CG 10864 C CD . LYS B 588 ? 0.7641 0.6691 0.6315 0.1528 -0.1630 -0.0113 569 LYS B CD 10865 C CE . LYS B 588 ? 0.8682 0.7995 0.7365 0.1487 -0.1667 -0.0137 569 LYS B CE 10866 N NZ . LYS B 588 ? 1.0396 0.9734 0.9030 0.1526 -0.1794 -0.0024 569 LYS B NZ 10867 N N . PRO B 589 ? 0.8074 0.6865 0.7244 0.1897 -0.1490 -0.0350 570 PRO B N 10868 C CA . PRO B 589 ? 0.7840 0.6602 0.7061 0.1931 -0.1411 -0.0433 570 PRO B CA 10869 C C . PRO B 589 ? 0.7484 0.6124 0.6556 0.1839 -0.1356 -0.0423 570 PRO B C 10870 O O . PRO B 589 ? 0.6905 0.5515 0.5854 0.1743 -0.1360 -0.0361 570 PRO B O 10871 C CB . PRO B 589 ? 0.7040 0.6051 0.6404 0.1939 -0.1334 -0.0497 570 PRO B CB 10872 C CG . PRO B 589 ? 0.6856 0.5984 0.6213 0.1869 -0.1349 -0.0458 570 PRO B CG 10873 C CD . PRO B 589 ? 0.7577 0.6608 0.6848 0.1881 -0.1461 -0.0384 570 PRO B CD 10874 N N . VAL B 590 ? 0.7082 0.5676 0.6173 0.1868 -0.1304 -0.0494 571 VAL B N 10875 C CA . VAL B 590 ? 0.7574 0.6034 0.6532 0.1793 -0.1265 -0.0490 571 VAL B CA 10876 C C . VAL B 590 ? 0.7670 0.6228 0.6560 0.1678 -0.1191 -0.0465 571 VAL B C 10877 O O . VAL B 590 ? 0.8055 0.6492 0.6821 0.1600 -0.1176 -0.0437 571 VAL B O 10878 C CB . VAL B 590 ? 0.7641 0.6084 0.6649 0.1849 -0.1222 -0.0598 571 VAL B CB 10879 C CG1 . VAL B 590 ? 0.8980 0.7309 0.8101 0.1966 -0.1300 -0.0642 571 VAL B CG1 10880 C CG2 . VAL B 590 ? 0.8320 0.7027 0.7422 0.1859 -0.1130 -0.0665 571 VAL B CG2 10881 N N . GLU B 591 ? 0.7063 0.5836 0.6062 0.1666 -0.1151 -0.0474 572 GLU B N 10882 C CA . GLU B 591 ? 0.6994 0.5867 0.5994 0.1561 -0.1090 -0.0451 572 GLU B CA 10883 C C . GLU B 591 ? 0.7052 0.5920 0.6009 0.1495 -0.1129 -0.0406 572 GLU B C 10884 O O . GLU B 591 ? 0.7987 0.6918 0.6960 0.1404 -0.1088 -0.0398 572 GLU B O 10885 C CB . GLU B 591 ? 0.7591 0.6709 0.6775 0.1570 -0.1028 -0.0476 572 GLU B CB 10886 C CG . GLU B 591 ? 0.7804 0.7072 0.7139 0.1604 -0.1057 -0.0479 572 GLU B CG 10887 C CD . GLU B 591 ? 0.8155 0.7456 0.7563 0.1724 -0.1094 -0.0518 572 GLU B CD 10888 O OE1 . GLU B 591 ? 0.7740 0.6915 0.7077 0.1785 -0.1111 -0.0547 572 GLU B OE1 10889 O OE2 . GLU B 591 ? 0.7974 0.7430 0.7533 0.1759 -0.1108 -0.0529 572 GLU B OE2 10890 N N . GLU B 592 ? 0.6979 0.5791 0.5894 0.1538 -0.1210 -0.0379 573 GLU B N 10891 C CA . GLU B 592 ? 0.7647 0.6498 0.6502 0.1473 -0.1252 -0.0343 573 GLU B CA 10892 C C . GLU B 592 ? 0.8286 0.6947 0.6943 0.1420 -0.1295 -0.0272 573 GLU B C 10893 O O . GLU B 592 ? 0.7480 0.6146 0.6057 0.1400 -0.1363 -0.0215 573 GLU B O 10894 C CB . GLU B 592 ? 0.6351 0.5322 0.5291 0.1539 -0.1319 -0.0344 573 GLU B CB 10895 C CG . GLU B 592 ? 0.6426 0.5609 0.5580 0.1574 -0.1278 -0.0410 573 GLU B CG 10896 C CD . GLU B 592 ? 0.9117 0.8459 0.8360 0.1481 -0.1234 -0.0448 573 GLU B CD 10897 O OE1 . GLU B 592 ? 1.1193 1.0529 1.0331 0.1403 -0.1253 -0.0439 573 GLU B OE1 10898 O OE2 . GLU B 592 ? 0.9256 0.8743 0.8698 0.1484 -0.1181 -0.0488 573 GLU B OE2 10899 N N . TYR B 593 ? 0.8414 0.6926 0.6996 0.1390 -0.1255 -0.0270 574 TYR B N 10900 C CA . TYR B 593 ? 0.7494 0.5812 0.5911 0.1336 -0.1290 -0.0200 574 TYR B CA 10901 C C . TYR B 593 ? 0.7697 0.6081 0.6015 0.1221 -0.1287 -0.0164 574 TYR B C 10902 O O . TYR B 593 ? 0.9227 0.7511 0.7409 0.1175 -0.1337 -0.0081 574 TYR B O 10903 C CB . TYR B 593 ? 0.6853 0.5036 0.5237 0.1322 -0.1237 -0.0230 574 TYR B CB 10904 C CG . TYR B 593 ? 0.6900 0.5220 0.5355 0.1274 -0.1145 -0.0287 574 TYR B CG 10905 C CD1 . TYR B 593 ? 0.8108 0.6464 0.6524 0.1164 -0.1106 -0.0275 574 TYR B CD1 10906 C CD2 . TYR B 593 ? 0.6471 0.4903 0.5051 0.1334 -0.1101 -0.0345 574 TYR B CD2 10907 C CE1 . TYR B 593 ? 0.8990 0.7469 0.7511 0.1119 -0.1035 -0.0310 574 TYR B CE1 10908 C CE2 . TYR B 593 ? 0.8641 0.7215 0.7307 0.1282 -0.1027 -0.0365 574 TYR B CE2 10909 C CZ . TYR B 593 ? 0.9363 0.7950 0.8009 0.1176 -0.1000 -0.0342 574 TYR B CZ 10910 O OH . TYR B 593 ? 1.0894 0.9616 0.9663 0.1123 -0.0939 -0.0345 574 TYR B OH 10911 N N . ALA B 594 ? 0.8802 0.7369 0.7208 0.1172 -0.1229 -0.0228 575 ALA B N 10912 C CA . ALA B 594 ? 0.8523 0.7183 0.6870 0.1061 -0.1213 -0.0232 575 ALA B CA 10913 C C . ALA B 594 ? 0.8905 0.7680 0.7184 0.1049 -0.1284 -0.0196 575 ALA B C 10914 O O . ALA B 594 ? 0.9307 0.8138 0.7471 0.0956 -0.1290 -0.0174 575 ALA B O 10915 C CB . ALA B 594 ? 0.7159 0.5989 0.5683 0.1020 -0.1140 -0.0323 575 ALA B CB 10916 N N . ASN B 595 ? 0.8268 0.7102 0.6617 0.1140 -0.1339 -0.0189 576 ASN B N 10917 C CA . ASN B 595 ? 0.7593 0.6541 0.5872 0.1137 -0.1423 -0.0135 576 ASN B CA 10918 C C . ASN B 595 ? 0.7748 0.6532 0.5969 0.1214 -0.1517 -0.0016 576 ASN B C 10919 O O . ASN B 595 ? 0.8482 0.7365 0.6702 0.1247 -0.1600 0.0037 576 ASN B O 10920 C CB . ASN B 595 ? 0.8498 0.7694 0.6936 0.1169 -0.1427 -0.0227 576 ASN B CB 10921 C CG . ASN B 595 ? 1.1304 1.0685 0.9841 0.1085 -0.1353 -0.0347 576 ASN B CG 10922 O OD1 . ASN B 595 ? 1.1360 1.0897 0.9825 0.0998 -0.1360 -0.0374 576 ASN B OD1 10923 N ND2 . ASN B 595 ? 1.1874 1.1258 1.0598 0.1107 -0.1284 -0.0421 576 ASN B ND2 10924 N N . CYS B 596 ? 0.8313 0.6853 0.6510 0.1244 -0.1510 0.0021 577 CYS B N 10925 C CA . CYS B 596 ? 0.8379 0.6742 0.6584 0.1325 -0.1602 0.0117 577 CYS B CA 10926 C C . CYS B 596 ? 0.8192 0.6291 0.6348 0.1315 -0.1595 0.0155 577 CYS B C 10927 O O . CYS B 596 ? 0.8399 0.6362 0.6660 0.1404 -0.1594 0.0109 577 CYS B O 10928 C CB . CYS B 596 ? 0.6869 0.5265 0.5255 0.1456 -0.1615 0.0050 577 CYS B CB 10929 S SG . CYS B 596 ? 0.9919 0.8163 0.8380 0.1563 -0.1751 0.0159 577 CYS B SG 10930 N N . HIS B 597 ? 0.7094 0.5140 0.5102 0.1204 -0.1591 0.0228 578 HIS B N 10931 C CA . HIS B 597 ? 0.7698 0.5500 0.5664 0.1181 -0.1587 0.0266 578 HIS B CA 10932 C C . HIS B 597 ? 0.8065 0.5770 0.5927 0.1115 -0.1676 0.0442 578 HIS B C 10933 O O . HIS B 597 ? 0.9866 0.7729 0.7652 0.1068 -0.1729 0.0536 578 HIS B O 10934 C CB . HIS B 597 ? 0.8257 0.6073 0.6165 0.1098 -0.1477 0.0181 578 HIS B CB 10935 C CG . HIS B 597 ? 0.9232 0.7234 0.7036 0.0980 -0.1442 0.0189 578 HIS B CG 10936 N ND1 . HIS B 597 ? 0.8800 0.7042 0.6668 0.0971 -0.1395 0.0094 578 HIS B ND1 10937 C CD2 . HIS B 597 ? 0.9396 0.7397 0.7061 0.0865 -0.1444 0.0267 578 HIS B CD2 10938 C CE1 . HIS B 597 ? 0.8909 0.7292 0.6688 0.0859 -0.1370 0.0095 578 HIS B CE1 10939 N NE2 . HIS B 597 ? 0.7222 0.5472 0.4865 0.0791 -0.1395 0.0201 578 HIS B NE2 10940 N N . LEU B 598 ? 0.9197 0.6660 0.7063 0.1106 -0.1695 0.0490 579 LEU B N 10941 C CA . LEU B 598 ? 0.9441 0.6802 0.7228 0.1028 -0.1776 0.0674 579 LEU B CA 10942 C C . LEU B 598 ? 0.9097 0.6541 0.6709 0.0882 -0.1705 0.0689 579 LEU B C 10943 O O . LEU B 598 ? 0.9633 0.7218 0.7124 0.0788 -0.1739 0.0812 579 LEU B O 10944 C CB . LEU B 598 ? 0.8449 0.5509 0.6362 0.1082 -0.1837 0.0716 579 LEU B CB 10945 C CG . LEU B 598 ? 0.9034 0.6000 0.7163 0.1233 -0.1908 0.0676 579 LEU B CG 10946 C CD1 . LEU B 598 ? 0.9359 0.6039 0.7643 0.1267 -0.1996 0.0748 579 LEU B CD1 10947 C CD2 . LEU B 598 ? 0.8655 0.5790 0.6810 0.1272 -0.1989 0.0768 579 LEU B CD2 10948 N N . ALA B 599 ? 0.8855 0.6238 0.6464 0.0862 -0.1606 0.0562 580 ALA B N 10949 C CA . ALA B 599 ? 0.9381 0.6847 0.6863 0.0732 -0.1528 0.0546 580 ALA B CA 10950 C C . ALA B 599 ? 0.9799 0.7229 0.7327 0.0740 -0.1424 0.0387 580 ALA B C 10951 O O . ALA B 599 ? 0.9189 0.6479 0.6816 0.0827 -0.1420 0.0317 580 ALA B O 10952 C CB . ALA B 599 ? 0.8479 0.5800 0.5876 0.0640 -0.1575 0.0701 580 ALA B CB 10953 N N . ARG B 600 ? 0.9164 0.6740 0.6632 0.0645 -0.1345 0.0329 581 ARG B N 10954 C CA . ARG B 600 ? 1.0143 0.7696 0.7660 0.0631 -0.1255 0.0210 581 ARG B CA 10955 C C . ARG B 600 ? 1.0135 0.7481 0.7598 0.0573 -0.1248 0.0248 581 ARG B C 10956 O O . ARG B 600 ? 1.0010 0.7327 0.7374 0.0481 -0.1270 0.0348 581 ARG B O 10957 C CB . ARG B 600 ? 0.8832 0.6622 0.6363 0.0556 -0.1180 0.0127 581 ARG B CB 10958 C CG . ARG B 600 ? 1.0266 0.8032 0.7860 0.0521 -0.1099 0.0038 581 ARG B CG 10959 C CD . ARG B 600 ? 1.2057 1.0047 0.9721 0.0447 -0.1034 -0.0046 581 ARG B CD 10960 N NE . ARG B 600 ? 1.2286 1.0453 1.0100 0.0508 -0.1021 -0.0125 581 ARG B NE 10961 C CZ . ARG B 600 ? 1.1603 0.9767 0.9551 0.0575 -0.0996 -0.0175 581 ARG B CZ 10962 N NH1 . ARG B 600 ? 1.1043 0.9052 0.8980 0.0593 -0.0980 -0.0165 581 ARG B NH1 10963 N NH2 . ARG B 600 ? 1.0769 0.9105 0.8868 0.0620 -0.0987 -0.0235 581 ARG B NH2 10964 N N . ALA B 601 ? 0.9663 0.6890 0.7194 0.0622 -0.1218 0.0168 582 ALA B N 10965 C CA . ALA B 601 ? 1.0320 0.7367 0.7818 0.0569 -0.1206 0.0175 582 ALA B CA 10966 C C . ALA B 601 ? 0.9871 0.6997 0.7395 0.0524 -0.1117 0.0075 582 ALA B C 10967 O O . ALA B 601 ? 0.9285 0.6539 0.6892 0.0574 -0.1077 -0.0008 582 ALA B O 10968 C CB . ALA B 601 ? 1.0356 0.7192 0.7924 0.0658 -0.1261 0.0164 582 ALA B CB 10969 N N . PRO B 602 ? 0.8895 0.5952 0.6363 0.0426 -0.1092 0.0095 583 PRO B N 10970 C CA . PRO B 602 ? 1.0125 0.7257 0.7633 0.0374 -0.1018 0.0018 583 PRO B CA 10971 C C . PRO B 602 ? 1.0399 0.7435 0.7952 0.0424 -0.1009 -0.0050 583 PRO B C 10972 O O . PRO B 602 ? 0.9633 0.6502 0.7179 0.0478 -0.1057 -0.0048 583 PRO B O 10973 C CB . PRO B 602 ? 1.0196 0.7281 0.7627 0.0252 -0.1005 0.0072 583 PRO B CB 10974 C CG . PRO B 602 ? 0.9937 0.6833 0.7298 0.0256 -0.1077 0.0172 583 PRO B CG 10975 C CD . PRO B 602 ? 0.8288 0.5219 0.5667 0.0348 -0.1133 0.0207 583 PRO B CD 10976 N N . ASN B 603 ? 0.8987 0.6147 0.6606 0.0404 -0.0951 -0.0112 584 ASN B N 10977 C CA . ASN B 603 ? 0.8317 0.5438 0.5959 0.0424 -0.0937 -0.0171 584 ASN B CA 10978 C C . ASN B 603 ? 0.8646 0.5593 0.6223 0.0354 -0.0949 -0.0155 584 ASN B C 10979 O O . ASN B 603 ? 0.7254 0.4133 0.4776 0.0280 -0.0959 -0.0090 584 ASN B O 10980 C CB . ASN B 603 ? 0.7673 0.4990 0.5411 0.0397 -0.0880 -0.0202 584 ASN B CB 10981 C CG . ASN B 603 ? 0.8558 0.6052 0.6392 0.0466 -0.0869 -0.0218 584 ASN B CG 10982 O OD1 . ASN B 603 ? 0.9050 0.6531 0.6879 0.0559 -0.0894 -0.0241 584 ASN B OD1 10983 N ND2 . ASN B 603 ? 0.8616 0.6279 0.6568 0.0422 -0.0832 -0.0210 584 ASN B ND2 10984 N N . HIS B 604 ? 0.8643 0.5539 0.6228 0.0370 -0.0948 -0.0219 585 HIS B N 10985 C CA . HIS B 604 ? 0.7796 0.4534 0.5339 0.0302 -0.0961 -0.0218 585 HIS B CA 10986 C C . HIS B 604 ? 0.8195 0.4995 0.5733 0.0187 -0.0919 -0.0178 585 HIS B C 10987 O O . HIS B 604 ? 0.7668 0.4648 0.5268 0.0165 -0.0876 -0.0182 585 HIS B O 10988 C CB . HIS B 604 ? 0.8764 0.5489 0.6327 0.0338 -0.0964 -0.0319 585 HIS B CB 10989 C CG . HIS B 604 ? 0.9743 0.6349 0.7336 0.0436 -0.1015 -0.0383 585 HIS B CG 10990 N ND1 . HIS B 604 ? 1.0371 0.7048 0.8006 0.0537 -0.1026 -0.0404 585 HIS B ND1 10991 C CD2 . HIS B 604 ? 1.0366 0.6788 0.7987 0.0452 -0.1062 -0.0439 585 HIS B CD2 10992 C CE1 . HIS B 604 ? 1.1615 0.8159 0.9307 0.0612 -0.1077 -0.0473 585 HIS B CE1 10993 N NE2 . HIS B 604 ? 1.1583 0.7969 0.9277 0.0563 -0.1101 -0.0499 585 HIS B NE2 10994 N N . ALA B 605 ? 0.8437 0.5088 0.5928 0.0111 -0.0934 -0.0139 586 ALA B N 10995 C CA . ALA B 605 ? 0.7133 0.3838 0.4629 -0.0001 -0.0895 -0.0110 586 ALA B CA 10996 C C . ALA B 605 ? 0.7707 0.4270 0.5186 -0.0062 -0.0906 -0.0123 586 ALA B C 10997 O O . ALA B 605 ? 0.8324 0.4707 0.5777 -0.0037 -0.0954 -0.0126 586 ALA B O 10998 C CB . ALA B 605 ? 0.8451 0.5176 0.5906 -0.0055 -0.0892 -0.0034 586 ALA B CB 10999 N N . VAL B 606 ? 0.7905 0.4551 0.5425 -0.0141 -0.0868 -0.0136 587 VAL B N 11000 C CA . VAL B 606 ? 0.8248 0.4774 0.5757 -0.0214 -0.0877 -0.0143 587 VAL B CA 11001 C C . VAL B 606 ? 0.8970 0.5420 0.6441 -0.0301 -0.0874 -0.0064 587 VAL B C 11002 O O . VAL B 606 ? 0.8618 0.5203 0.6106 -0.0348 -0.0835 -0.0036 587 VAL B O 11003 C CB . VAL B 606 ? 0.8522 0.5183 0.6108 -0.0269 -0.0844 -0.0176 587 VAL B CB 11004 C CG1 . VAL B 606 ? 0.9357 0.5900 0.6935 -0.0352 -0.0854 -0.0182 587 VAL B CG1 11005 C CG2 . VAL B 606 ? 0.6577 0.3355 0.4191 -0.0196 -0.0849 -0.0232 587 VAL B CG2 11006 N N . VAL B 607 ? 0.7427 0.3680 0.4861 -0.0326 -0.0915 -0.0031 588 VAL B N 11007 C CA . VAL B 607 ? 0.9299 0.5499 0.6697 -0.0423 -0.0913 0.0064 588 VAL B CA 11008 C C . VAL B 607 ? 0.9331 0.5435 0.6757 -0.0514 -0.0910 0.0056 588 VAL B C 11009 O O . VAL B 607 ? 0.9090 0.5108 0.6552 -0.0488 -0.0934 -0.0016 588 VAL B O 11010 C CB . VAL B 607 ? 0.9451 0.5509 0.6806 -0.0395 -0.0973 0.0161 588 VAL B CB 11011 C CG1 . VAL B 607 ? 0.8281 0.4406 0.5625 -0.0283 -0.0991 0.0151 588 VAL B CG1 11012 C CG2 . VAL B 607 ? 0.7577 0.3394 0.4979 -0.0381 -0.1037 0.0158 588 VAL B CG2 11013 N N . THR B 608 ? 0.8996 0.5140 0.6408 -0.0624 -0.0879 0.0121 589 THR B N 11014 C CA . THR B 608 ? 0.8352 0.4414 0.5800 -0.0720 -0.0875 0.0123 589 THR B CA 11015 C C . THR B 608 ? 0.9216 0.5290 0.6627 -0.0833 -0.0858 0.0234 589 THR B C 11016 O O . THR B 608 ? 0.7442 0.3597 0.4789 -0.0836 -0.0855 0.0311 589 THR B O 11017 C CB . THR B 608 ? 0.9078 0.5282 0.6601 -0.0753 -0.0826 0.0037 589 THR B CB 11018 O OG1 . THR B 608 ? 0.9377 0.5490 0.6941 -0.0838 -0.0831 0.0032 589 THR B OG1 11019 C CG2 . THR B 608 ? 0.6941 0.3366 0.4496 -0.0800 -0.0762 0.0039 589 THR B CG2 11020 N N . ARG B 609 ? 0.9447 0.5461 0.6897 -0.0930 -0.0848 0.0244 590 ARG B N 11021 C CA . ARG B 609 ? 0.8499 0.4575 0.5924 -0.1055 -0.0818 0.0342 590 ARG B CA 11022 C C . ARG B 609 ? 0.8884 0.5233 0.6325 -0.1109 -0.0734 0.0289 590 ARG B C 11023 O O . ARG B 609 ? 0.8911 0.5361 0.6427 -0.1066 -0.0706 0.0180 590 ARG B O 11024 C CB . ARG B 609 ? 0.8976 0.4910 0.6461 -0.1143 -0.0832 0.0359 590 ARG B CB 11025 C CG . ARG B 609 ? 0.9718 0.5398 0.7221 -0.1135 -0.0913 0.0447 590 ARG B CG 11026 C CD . ARG B 609 ? 1.0290 0.5861 0.7873 -0.1237 -0.0919 0.0459 590 ARG B CD 11027 N NE . ARG B 609 ? 1.0167 0.5797 0.7805 -0.1237 -0.0886 0.0317 590 ARG B NE 11028 C CZ . ARG B 609 ? 0.9589 0.5120 0.7275 -0.1159 -0.0926 0.0204 590 ARG B CZ 11029 N NH1 . ARG B 609 ? 1.1225 0.6587 0.8922 -0.1070 -0.0994 0.0191 590 ARG B NH1 11030 N NH2 . ARG B 609 ? 0.9777 0.5396 0.7510 -0.1173 -0.0899 0.0100 590 ARG B NH2 11031 N N . LYS B 610 ? 0.9050 0.5535 0.6441 -0.1207 -0.0698 0.0365 591 LYS B N 11032 C CA . LYS B 610 ? 0.9487 0.6262 0.6914 -0.1259 -0.0618 0.0293 591 LYS B CA 11033 C C . LYS B 610 ? 0.8805 0.5639 0.6370 -0.1325 -0.0569 0.0196 591 LYS B C 11034 O O . LYS B 610 ? 0.8169 0.5200 0.5846 -0.1327 -0.0516 0.0086 591 LYS B O 11035 C CB . LYS B 610 ? 0.9538 0.6481 0.6863 -0.1356 -0.0592 0.0395 591 LYS B CB 11036 C CG . LYS B 610 ? 1.2142 0.9425 0.9503 -0.1406 -0.0509 0.0295 591 LYS B CG 11037 C CD . LYS B 610 ? 1.3711 1.1098 1.1091 -0.1296 -0.0511 0.0208 591 LYS B CD 11038 C CE . LYS B 610 ? 1.3782 1.1518 1.1238 -0.1348 -0.0431 0.0084 591 LYS B CE 11039 N NZ . LYS B 610 ? 1.3518 1.1354 1.1036 -0.1243 -0.0434 -0.0012 591 LYS B NZ 11040 N N . ASP B 611 ? 0.9033 0.5694 0.6619 -0.1378 -0.0594 0.0235 592 ASP B N 11041 C CA . ASP B 611 ? 0.7982 0.4690 0.5704 -0.1446 -0.0556 0.0156 592 ASP B CA 11042 C C . ASP B 611 ? 0.8024 0.4668 0.5846 -0.1361 -0.0584 0.0063 592 ASP B C 11043 O O . ASP B 611 ? 0.9355 0.6042 0.7310 -0.1404 -0.0566 0.0000 592 ASP B O 11044 C CB . ASP B 611 ? 0.7885 0.4445 0.5599 -0.1544 -0.0574 0.0237 592 ASP B CB 11045 C CG . ASP B 611 ? 1.0515 0.6784 0.8208 -0.1481 -0.0659 0.0270 592 ASP B CG 11046 O OD1 . ASP B 611 ? 1.3041 0.9182 1.0646 -0.1432 -0.0711 0.0356 592 ASP B OD1 11047 O OD2 . ASP B 611 ? 1.1557 0.7737 0.9338 -0.1482 -0.0678 0.0203 592 ASP B OD2 11048 N N . LYS B 612 ? 0.9238 0.5798 0.7000 -0.1245 -0.0629 0.0061 593 LYS B N 11049 C CA . LYS B 612 ? 1.0017 0.6544 0.7849 -0.1165 -0.0660 -0.0011 593 LYS B CA 11050 C C . LYS B 612 ? 1.0514 0.7203 0.8392 -0.1085 -0.0641 -0.0057 593 LYS B C 11051 O O . LYS B 612 ? 1.2406 0.9131 1.0366 -0.1030 -0.0659 -0.0102 593 LYS B O 11052 C CB . LYS B 612 ? 0.9796 0.6100 0.7543 -0.1095 -0.0731 0.0008 593 LYS B CB 11053 C CG . LYS B 612 ? 0.8963 0.5112 0.6740 -0.1154 -0.0763 0.0005 593 LYS B CG 11054 C CD . LYS B 612 ? 0.7705 0.3917 0.5580 -0.1148 -0.0771 -0.0077 593 LYS B CD 11055 C CE . LYS B 612 ? 1.0260 0.6327 0.8164 -0.1203 -0.0810 -0.0096 593 LYS B CE 11056 N NZ . LYS B 612 ? 1.1406 0.7552 0.9386 -0.1190 -0.0831 -0.0170 593 LYS B NZ 11057 N N . GLU B 613 ? 0.8576 0.5378 0.6407 -0.1085 -0.0610 -0.0039 594 GLU B N 11058 C CA . GLU B 613 ? 0.8431 0.5381 0.6308 -0.1007 -0.0597 -0.0082 594 GLU B CA 11059 C C . GLU B 613 ? 0.8807 0.5897 0.6897 -0.1000 -0.0578 -0.0160 594 GLU B C 11060 O O . GLU B 613 ? 1.0514 0.7615 0.8649 -0.0918 -0.0605 -0.0172 594 GLU B O 11061 C CB . GLU B 613 ? 0.7850 0.4962 0.5682 -0.1042 -0.0556 -0.0076 594 GLU B CB 11062 C CG . GLU B 613 ? 0.9411 0.6649 0.7265 -0.0954 -0.0554 -0.0114 594 GLU B CG 11063 C CD . GLU B 613 ? 1.2456 0.9844 1.0217 -0.0985 -0.0529 -0.0096 594 GLU B CD 11064 O OE1 . GLU B 613 ? 1.2641 1.0090 1.0345 -0.1088 -0.0499 -0.0065 594 GLU B OE1 11065 O OE2 . GLU B 613 ? 1.2145 0.9609 0.9887 -0.0910 -0.0540 -0.0110 594 GLU B OE2 11066 N N . ALA B 614 ? 0.7782 0.4986 0.6021 -0.1091 -0.0536 -0.0205 595 ALA B N 11067 C CA . ALA B 614 ? 0.7772 0.5116 0.6269 -0.1095 -0.0525 -0.0269 595 ALA B CA 11068 C C . ALA B 614 ? 0.9141 0.6393 0.7679 -0.1059 -0.0579 -0.0239 595 ALA B C 11069 O O . ALA B 614 ? 0.8727 0.6070 0.7405 -0.1006 -0.0598 -0.0243 595 ALA B O 11070 C CB . ALA B 614 ? 0.6976 0.4447 0.5639 -0.1202 -0.0473 -0.0329 595 ALA B CB 11071 N N . CYS B 615 ? 0.7876 0.4968 0.6302 -0.1093 -0.0606 -0.0206 596 CYS B N 11072 C CA . CYS B 615 ? 0.7675 0.4712 0.6125 -0.1071 -0.0658 -0.0191 596 CYS B CA 11073 C C . CYS B 615 ? 0.8988 0.5986 0.7320 -0.0964 -0.0698 -0.0173 596 CYS B C 11074 O O . CYS B 615 ? 0.9871 0.6962 0.8290 -0.0929 -0.0725 -0.0165 596 CYS B O 11075 C CB . CYS B 615 ? 0.6285 0.3168 0.4655 -0.1135 -0.0679 -0.0182 596 CYS B CB 11076 S SG . CYS B 615 ? 1.2497 0.9468 1.1085 -0.1255 -0.0653 -0.0207 596 CYS B SG 11077 N N . VAL B 616 ? 0.8579 0.5454 0.6724 -0.0918 -0.0704 -0.0161 597 VAL B N 11078 C CA . VAL B 616 ? 0.8132 0.4979 0.6179 -0.0813 -0.0736 -0.0159 597 VAL B CA 11079 C C . VAL B 616 ? 0.8738 0.5769 0.6903 -0.0760 -0.0719 -0.0160 597 VAL B C 11080 O O . VAL B 616 ? 0.9755 0.6856 0.7941 -0.0701 -0.0745 -0.0155 597 VAL B O 11081 C CB . VAL B 616 ? 0.7130 0.3822 0.5005 -0.0771 -0.0749 -0.0140 597 VAL B CB 11082 C CG1 . VAL B 616 ? 0.7125 0.3810 0.4932 -0.0657 -0.0779 -0.0156 597 VAL B CG1 11083 C CG2 . VAL B 616 ? 0.7664 0.4163 0.5464 -0.0822 -0.0776 -0.0131 597 VAL B CG2 11084 N N . HIS B 617 ? 0.8442 0.5571 0.6697 -0.0788 -0.0677 -0.0170 598 HIS B N 11085 C CA . HIS B 617 ? 0.6269 0.3579 0.4695 -0.0750 -0.0660 -0.0184 598 HIS B CA 11086 C C . HIS B 617 ? 0.7893 0.5318 0.6532 -0.0768 -0.0680 -0.0167 598 HIS B C 11087 O O . HIS B 617 ? 0.7271 0.4789 0.5976 -0.0710 -0.0702 -0.0137 598 HIS B O 11088 C CB . HIS B 617 ? 0.7076 0.4493 0.5602 -0.0801 -0.0610 -0.0230 598 HIS B CB 11089 C CG . HIS B 617 ? 0.8255 0.5853 0.6978 -0.0761 -0.0595 -0.0266 598 HIS B CG 11090 N ND1 . HIS B 617 ? 0.6480 0.4226 0.5513 -0.0791 -0.0589 -0.0293 598 HIS B ND1 11091 C CD2 . HIS B 617 ? 0.8932 0.6588 0.7615 -0.0696 -0.0589 -0.0281 598 HIS B CD2 11092 C CE1 . HIS B 617 ? 0.8108 0.5990 0.7295 -0.0745 -0.0581 -0.0326 598 HIS B CE1 11093 N NE2 . HIS B 617 ? 0.8999 0.6833 0.7967 -0.0688 -0.0578 -0.0323 598 HIS B NE2 11094 N N . LYS B 618 ? 0.8790 0.6221 0.7543 -0.0852 -0.0677 -0.0174 599 LYS B N 11095 C CA . LYS B 618 ? 0.7906 0.5459 0.6893 -0.0879 -0.0706 -0.0140 599 LYS B CA 11096 C C . LYS B 618 ? 0.8954 0.6506 0.7841 -0.0839 -0.0759 -0.0082 599 LYS B C 11097 O O . LYS B 618 ? 1.0301 0.8001 0.9329 -0.0812 -0.0784 -0.0027 599 LYS B O 11098 C CB . LYS B 618 ? 0.8321 0.5865 0.7434 -0.0978 -0.0697 -0.0160 599 LYS B CB 11099 C CG . LYS B 618 ? 0.7694 0.5370 0.7087 -0.1013 -0.0736 -0.0113 599 LYS B CG 11100 C CD . LYS B 618 ? 0.9839 0.7508 0.9376 -0.1108 -0.0725 -0.0145 599 LYS B CD 11101 C CE . LYS B 618 ? 1.1045 0.8865 1.0934 -0.1144 -0.0768 -0.0094 599 LYS B CE 11102 N NZ . LYS B 618 ? 1.0938 0.8764 1.1007 -0.1234 -0.0758 -0.0135 599 LYS B NZ 11103 N N . ILE B 619 ? 0.9727 0.7133 0.8386 -0.0840 -0.0776 -0.0099 600 ILE B N 11104 C CA . ILE B 619 ? 0.9581 0.7020 0.8157 -0.0819 -0.0824 -0.0075 600 ILE B CA 11105 C C . ILE B 619 ? 0.9457 0.6956 0.7925 -0.0724 -0.0834 -0.0068 600 ILE B C 11106 O O . ILE B 619 ? 0.9139 0.6804 0.7655 -0.0710 -0.0864 -0.0020 600 ILE B O 11107 C CB . ILE B 619 ? 0.8924 0.6201 0.7333 -0.0853 -0.0843 -0.0121 600 ILE B CB 11108 C CG1 . ILE B 619 ? 0.7747 0.5012 0.6294 -0.0955 -0.0841 -0.0117 600 ILE B CG1 11109 C CG2 . ILE B 619 ? 0.9101 0.6440 0.7406 -0.0823 -0.0890 -0.0132 600 ILE B CG2 11110 C CD1 . ILE B 619 ? 0.8823 0.5922 0.7236 -0.0997 -0.0860 -0.0161 600 ILE B CD1 11111 N N . LEU B 620 ? 0.8596 0.5982 0.6925 -0.0664 -0.0811 -0.0107 601 LEU B N 11112 C CA . LEU B 620 ? 0.8024 0.5462 0.6262 -0.0570 -0.0818 -0.0111 601 LEU B CA 11113 C C . LEU B 620 ? 0.7721 0.5369 0.6146 -0.0548 -0.0811 -0.0047 601 LEU B C 11114 O O . LEU B 620 ? 0.6948 0.4725 0.5352 -0.0497 -0.0826 -0.0023 601 LEU B O 11115 C CB . LEU B 620 ? 0.8105 0.5378 0.6189 -0.0511 -0.0802 -0.0154 601 LEU B CB 11116 C CG . LEU B 620 ? 0.8896 0.6008 0.6795 -0.0471 -0.0830 -0.0214 601 LEU B CG 11117 C CD1 . LEU B 620 ? 0.9259 0.6494 0.7110 -0.0399 -0.0850 -0.0245 601 LEU B CD1 11118 C CD2 . LEU B 620 ? 0.9554 0.6558 0.7431 -0.0548 -0.0849 -0.0237 601 LEU B CD2 11119 N N . ARG B 621 ? 0.7124 0.4823 0.5756 -0.0591 -0.0790 -0.0027 602 ARG B N 11120 C CA . ARG B 621 ? 0.7476 0.5368 0.6351 -0.0578 -0.0793 0.0034 602 ARG B CA 11121 C C . ARG B 621 ? 0.8105 0.6157 0.7128 -0.0625 -0.0835 0.0124 602 ARG B C 11122 O O . ARG B 621 ? 0.8189 0.6421 0.7341 -0.0603 -0.0855 0.0206 602 ARG B O 11123 C CB . ARG B 621 ? 0.6568 0.4483 0.5667 -0.0611 -0.0761 0.0003 602 ARG B CB 11124 C CG . ARG B 621 ? 0.6882 0.4687 0.5833 -0.0578 -0.0722 -0.0074 602 ARG B CG 11125 C CD . ARG B 621 ? 0.7610 0.5533 0.6720 -0.0533 -0.0705 -0.0090 602 ARG B CD 11126 N NE . ARG B 621 ? 0.8339 0.6387 0.7787 -0.0588 -0.0693 -0.0113 602 ARG B NE 11127 C CZ . ARG B 621 ? 0.8377 0.6560 0.8069 -0.0562 -0.0688 -0.0130 602 ARG B CZ 11128 N NH1 . ARG B 621 ? 0.9621 0.7833 0.9233 -0.0484 -0.0692 -0.0115 602 ARG B NH1 11129 N NH2 . ARG B 621 ? 0.8272 0.6566 0.8313 -0.0612 -0.0682 -0.0172 602 ARG B NH2 11130 N N . GLN B 622 ? 0.7518 0.5519 0.6527 -0.0694 -0.0854 0.0121 603 GLN B N 11131 C CA . GLN B 622 ? 0.7720 0.5881 0.6842 -0.0744 -0.0904 0.0213 603 GLN B CA 11132 C C . GLN B 622 ? 0.8370 0.6625 0.7276 -0.0703 -0.0928 0.0227 603 GLN B C 11133 O O . GLN B 622 ? 0.9063 0.7542 0.8064 -0.0720 -0.0965 0.0332 603 GLN B O 11134 C CB . GLN B 622 ? 0.6340 0.4420 0.5487 -0.0827 -0.0919 0.0192 603 GLN B CB 11135 C CG . GLN B 622 ? 0.5395 0.3466 0.4829 -0.0884 -0.0903 0.0188 603 GLN B CG 11136 C CD . GLN B 622 ? 0.7079 0.5062 0.6515 -0.0963 -0.0912 0.0156 603 GLN B CD 11137 O OE1 . GLN B 622 ? 0.6486 0.4370 0.5680 -0.0971 -0.0923 0.0118 603 GLN B OE1 11138 N NE2 . GLN B 622 ? 0.7292 0.5320 0.7028 -0.1023 -0.0910 0.0161 603 GLN B NE2 11139 N N . GLN B 623 ? 0.8005 0.6104 0.6637 -0.0652 -0.0909 0.0120 604 GLN B N 11140 C CA . GLN B 623 ? 0.7838 0.6025 0.6272 -0.0612 -0.0927 0.0088 604 GLN B CA 11141 C C . GLN B 623 ? 0.7983 0.6355 0.6434 -0.0546 -0.0919 0.0137 604 GLN B C 11142 O O . GLN B 623 ? 0.7574 0.6157 0.5961 -0.0541 -0.0939 0.0164 604 GLN B O 11143 C CB . GLN B 623 ? 0.7260 0.5217 0.5457 -0.0571 -0.0915 -0.0050 604 GLN B CB 11144 C CG . GLN B 623 ? 0.7492 0.5301 0.5653 -0.0641 -0.0932 -0.0097 604 GLN B CG 11145 C CD . GLN B 623 ? 0.7559 0.5545 0.5716 -0.0695 -0.0977 -0.0082 604 GLN B CD 11146 O OE1 . GLN B 623 ? 0.9275 0.7403 0.7312 -0.0661 -0.0993 -0.0127 604 GLN B OE1 11147 N NE2 . GLN B 623 ? 0.7472 0.5474 0.5766 -0.0782 -0.0998 -0.0025 604 GLN B NE2 11148 N N . GLN B 624 ? 0.6897 0.5213 0.5437 -0.0501 -0.0888 0.0145 605 GLN B N 11149 C CA . GLN B 624 ? 0.8169 0.6644 0.6736 -0.0437 -0.0878 0.0187 605 GLN B CA 11150 C C . GLN B 624 ? 0.7353 0.6086 0.6188 -0.0482 -0.0903 0.0345 605 GLN B C 11151 O O . GLN B 624 ? 0.8651 0.7567 0.7533 -0.0446 -0.0902 0.0408 605 GLN B O 11152 C CB . GLN B 624 ? 0.7572 0.5902 0.6132 -0.0368 -0.0841 0.0131 605 GLN B CB 11153 C CG . GLN B 624 ? 0.8124 0.6394 0.6903 -0.0407 -0.0827 0.0153 605 GLN B CG 11154 C CD . GLN B 624 ? 0.8364 0.6566 0.7143 -0.0341 -0.0796 0.0105 605 GLN B CD 11155 O OE1 . GLN B 624 ? 0.7741 0.5956 0.6392 -0.0263 -0.0789 0.0080 605 GLN B OE1 11156 N NE2 . GLN B 624 ? 0.8388 0.6537 0.7321 -0.0372 -0.0777 0.0082 605 GLN B NE2 11157 N N . HIS B 625 ? 0.7210 0.5961 0.6246 -0.0564 -0.0930 0.0415 606 HIS B N 11158 C CA . HIS B 625 ? 0.6597 0.5588 0.5933 -0.0617 -0.0971 0.0585 606 HIS B CA 11159 C C . HIS B 625 ? 0.7409 0.6604 0.6675 -0.0676 -0.1020 0.0671 606 HIS B C 11160 O O . HIS B 625 ? 0.8523 0.7972 0.7993 -0.0723 -0.1064 0.0842 606 HIS B O 11161 C CB . HIS B 625 ? 0.7305 0.6225 0.6968 -0.0671 -0.0981 0.0614 606 HIS B CB 11162 C CG . HIS B 625 ? 0.8066 0.6921 0.7907 -0.0626 -0.0946 0.0571 606 HIS B CG 11163 N ND1 . HIS B 625 ? 0.8556 0.7577 0.8737 -0.0629 -0.0967 0.0681 606 HIS B ND1 11164 C CD2 . HIS B 625 ? 0.7894 0.6556 0.7635 -0.0584 -0.0895 0.0430 606 HIS B CD2 11165 C CE1 . HIS B 625 ? 0.7224 0.6154 0.7505 -0.0585 -0.0930 0.0589 606 HIS B CE1 11166 N NE2 . HIS B 625 ? 0.7826 0.6550 0.7830 -0.0559 -0.0885 0.0439 606 HIS B NE2 11167 N N . LEU B 626 ? 0.7658 0.6752 0.6646 -0.0676 -0.1015 0.0554 607 LEU B N 11168 C CA . LEU B 626 ? 0.7573 0.6870 0.6446 -0.0728 -0.1058 0.0592 607 LEU B CA 11169 C C . LEU B 626 ? 0.8259 0.7721 0.6889 -0.0670 -0.1040 0.0533 607 LEU B C 11170 O O . LEU B 626 ? 0.8642 0.8425 0.7260 -0.0708 -0.1071 0.0632 607 LEU B O 11171 C CB . LEU B 626 ? 0.6135 0.5243 0.4876 -0.0766 -0.1067 0.0478 607 LEU B CB 11172 C CG . LEU B 626 ? 0.6074 0.5081 0.5054 -0.0841 -0.1091 0.0535 607 LEU B CG 11173 C CD1 . LEU B 626 ? 0.7077 0.5850 0.5905 -0.0866 -0.1085 0.0398 607 LEU B CD1 11174 C CD2 . LEU B 626 ? 0.5779 0.5067 0.4975 -0.0924 -0.1161 0.0721 607 LEU B CD2 11175 N N . PHE B 627 ? 0.9149 0.8412 0.7599 -0.0583 -0.0992 0.0374 608 PHE B N 11176 C CA . PHE B 627 ? 0.9062 0.8456 0.7294 -0.0519 -0.0972 0.0275 608 PHE B CA 11177 C C . PHE B 627 ? 0.8917 0.8231 0.7141 -0.0422 -0.0927 0.0234 608 PHE B C 11178 O O . PHE B 627 ? 0.8706 0.7997 0.6750 -0.0348 -0.0903 0.0096 608 PHE B O 11179 C CB . PHE B 627 ? 0.8034 0.7270 0.6038 -0.0503 -0.0972 0.0081 608 PHE B CB 11180 C CG . PHE B 627 ? 0.7520 0.6744 0.5538 -0.0593 -0.1015 0.0093 608 PHE B CG 11181 C CD1 . PHE B 627 ? 0.6177 0.5727 0.4181 -0.0663 -0.1056 0.0162 608 PHE B CD1 11182 C CD2 . PHE B 627 ? 0.7636 0.6544 0.5680 -0.0614 -0.1014 0.0040 608 PHE B CD2 11183 C CE1 . PHE B 627 ? 0.6806 0.6351 0.4828 -0.0746 -0.1101 0.0173 608 PHE B CE1 11184 C CE2 . PHE B 627 ? 0.7482 0.6381 0.5551 -0.0698 -0.1053 0.0048 608 PHE B CE2 11185 C CZ . PHE B 627 ? 0.6940 0.6150 0.5001 -0.0761 -0.1099 0.0112 608 PHE B CZ 11186 N N . GLY B 628 ? 0.7286 0.6568 0.5728 -0.0423 -0.0920 0.0345 609 GLY B N 11187 C CA . GLY B 628 ? 0.7694 0.6905 0.6153 -0.0337 -0.0882 0.0313 609 GLY B CA 11188 C C . GLY B 628 ? 0.8915 0.8399 0.7331 -0.0292 -0.0868 0.0341 609 GLY B C 11189 O O . GLY B 628 ? 0.9000 0.8769 0.7367 -0.0333 -0.0886 0.0394 609 GLY B O 11190 N N . SER B 629 ? 1.1831 1.1248 1.0265 -0.0211 -0.0836 0.0304 610 SER B N 11191 C CA . SER B 629 ? 1.4169 1.3815 1.2557 -0.0153 -0.0813 0.0304 610 SER B CA 11192 C C . SER B 629 ? 1.5057 1.5094 1.3567 -0.0223 -0.0833 0.0482 610 SER B C 11193 O O . SER B 629 ? 1.5360 1.5651 1.3724 -0.0236 -0.0832 0.0459 610 SER B O 11194 C CB . SER B 629 ? 1.4472 1.4009 1.2965 -0.0079 -0.0788 0.0298 610 SER B CB 11195 O OG . SER B 629 ? 1.3936 1.3144 1.2310 -0.0020 -0.0776 0.0155 610 SER B OG 11196 N N . ASN B 630 ? 1.4860 1.4964 1.3657 -0.0270 -0.0854 0.0659 611 ASN B N 11197 C CA . ASN B 630 ? 1.3602 1.4061 1.2568 -0.0356 -0.0890 0.0873 611 ASN B CA 11198 C C . ASN B 630 ? 1.2855 1.3291 1.1908 -0.0453 -0.0942 0.0955 611 ASN B C 11199 O O . ASN B 630 ? 1.3943 1.4219 1.2797 -0.0457 -0.0942 0.0822 611 ASN B O 11200 C CB . ASN B 630 ? 1.2399 1.2960 1.1685 -0.0356 -0.0896 0.1033 611 ASN B CB 11201 C CG . ASN B 630 ? 1.1841 1.2416 1.1051 -0.0259 -0.0846 0.0947 611 ASN B CG 11202 O OD1 . ASN B 630 ? 0.9288 0.9582 0.8436 -0.0181 -0.0818 0.0796 611 ASN B OD1 11203 N ND2 . ASN B 630 ? 1.4709 1.5633 1.3928 -0.0268 -0.0837 0.1049 611 ASN B ND2 11204 N N . VAL B 631 ? 1.0464 1.1059 0.9837 -0.0530 -0.0990 0.1175 612 VAL B N 11205 C CA . VAL B 631 ? 1.1096 1.1711 1.0609 -0.0628 -0.1050 0.1284 612 VAL B CA 11206 C C . VAL B 631 ? 1.0786 1.1549 1.0030 -0.0678 -0.1071 0.1248 612 VAL B C 11207 O O . VAL B 631 ? 1.0338 1.1063 0.9650 -0.0749 -0.1117 0.1293 612 VAL B O 11208 C CB . VAL B 631 ? 1.2136 1.2394 1.1813 -0.0627 -0.1053 0.1205 612 VAL B CB 11209 C CG1 . VAL B 631 ? 1.3023 1.3164 1.2953 -0.0576 -0.1030 0.1204 612 VAL B CG1 11210 C CG2 . VAL B 631 ? 1.0648 1.0616 1.0010 -0.0585 -0.1016 0.0973 612 VAL B CG2 11211 N N . THR B 632 ? 1.1194 1.2142 1.0153 -0.0641 -0.1037 0.1156 613 THR B N 11212 C CA . THR B 632 ? 1.2847 1.4005 1.1557 -0.0687 -0.1054 0.1101 613 THR B CA 11213 C C . THR B 632 ? 1.2651 1.4129 1.1147 -0.0652 -0.1014 0.1038 613 THR B C 11214 O O . THR B 632 ? 1.1455 1.2865 0.9918 -0.0564 -0.0961 0.0954 613 THR B O 11215 C CB . THR B 632 ? 1.4814 1.5647 1.3309 -0.0657 -0.1041 0.0862 613 THR B CB 11216 O OG1 . THR B 632 ? 1.5692 1.6115 1.4232 -0.0581 -0.1004 0.0748 613 THR B OG1 11217 C CG2 . THR B 632 ? 1.4728 1.5567 1.3295 -0.0756 -0.1104 0.0941 613 THR B CG2 11218 N N . ASP B 633 ? 1.3468 1.5315 1.1822 -0.0723 -0.1040 0.1073 614 ASP B N 11219 C CA . ASP B 633 ? 1.4804 1.7011 1.2941 -0.0699 -0.0998 0.0982 614 ASP B CA 11220 C C . ASP B 633 ? 1.4959 1.6979 1.2815 -0.0620 -0.0957 0.0646 614 ASP B C 11221 O O . ASP B 633 ? 1.5599 1.7644 1.3319 -0.0662 -0.0984 0.0544 614 ASP B O 11222 C CB . ASP B 633 ? 1.6594 1.9337 1.4703 -0.0820 -0.1045 0.1165 614 ASP B CB 11223 C CG . ASP B 633 ? 1.8462 2.1400 1.6896 -0.0909 -0.1102 0.1529 614 ASP B CG 11224 O OD1 . ASP B 633 ? 1.8973 2.2224 1.7482 -0.0919 -0.1085 0.1675 614 ASP B OD1 11225 O OD2 . ASP B 633 ? 1.9124 2.1905 1.7765 -0.0969 -0.1168 0.1669 614 ASP B OD2 11226 N N . CYS B 634 ? 1.5098 1.6931 1.2893 -0.0505 -0.0897 0.0476 615 CYS B N 11227 C CA . CYS B 634 ? 1.5331 1.6925 1.2924 -0.0419 -0.0866 0.0163 615 CYS B CA 11228 C C . CYS B 634 ? 1.3628 1.5600 1.1011 -0.0433 -0.0853 -0.0010 615 CYS B C 11229 O O . CYS B 634 ? 1.2762 1.4574 1.0008 -0.0382 -0.0843 -0.0275 615 CYS B O 11230 C CB . CYS B 634 ? 1.5479 1.6805 1.3092 -0.0294 -0.0815 0.0049 615 CYS B CB 11231 S SG . CYS B 634 ? 1.5284 1.6088 1.3086 -0.0264 -0.0827 0.0136 615 CYS B SG 11232 N N . SER B 635 ? 1.2940 1.5431 1.0315 -0.0508 -0.0856 0.0142 616 SER B N 11233 C CA . SER B 635 ? 1.3308 1.6251 1.0484 -0.0541 -0.0844 -0.0009 616 SER B CA 11234 C C . SER B 635 ? 1.3728 1.6765 1.0832 -0.0642 -0.0906 -0.0004 616 SER B C 11235 O O . SER B 635 ? 1.2378 1.5553 0.9311 -0.0640 -0.0902 -0.0253 616 SER B O 11236 C CB . SER B 635 ? 1.2592 1.6103 0.9780 -0.0596 -0.0823 0.0173 616 SER B CB 11237 O OG . SER B 635 ? 1.1786 1.5385 0.9176 -0.0691 -0.0874 0.0539 616 SER B OG 11238 N N . GLY B 636 ? 1.4155 1.7119 1.1417 -0.0729 -0.0967 0.0269 617 GLY B N 11239 C CA . GLY B 636 ? 1.4203 1.7292 1.1428 -0.0834 -0.1034 0.0320 617 GLY B CA 11240 C C . GLY B 636 ? 1.3159 1.5735 1.0405 -0.0812 -0.1061 0.0193 617 GLY B C 11241 O O . GLY B 636 ? 1.4018 1.6656 1.1166 -0.0866 -0.1100 0.0092 617 GLY B O 11242 N N . ASN B 637 ? 1.1812 1.3902 0.9188 -0.0738 -0.1040 0.0197 618 ASN B N 11243 C CA . ASN B 637 ? 1.2050 1.3667 0.9468 -0.0728 -0.1063 0.0114 618 ASN B CA 11244 C C . ASN B 637 ? 1.0465 1.1641 0.7828 -0.0607 -0.1013 -0.0123 618 ASN B C 11245 O O . ASN B 637 ? 1.0341 1.1577 0.7620 -0.0523 -0.0965 -0.0265 618 ASN B O 11246 C CB . ASN B 637 ? 1.3623 1.5070 1.1292 -0.0783 -0.1102 0.0380 618 ASN B CB 11247 C CG . ASN B 637 ? 1.4385 1.6251 1.2165 -0.0906 -0.1166 0.0650 618 ASN B CG 11248 O OD1 . ASN B 637 ? 1.5127 1.7036 1.2924 -0.0988 -0.1225 0.0696 618 ASN B OD1 11249 N ND2 . ASN B 637 ? 1.3390 1.5576 1.1261 -0.0922 -0.1159 0.0841 618 ASN B ND2 11250 N N . PHE B 638 ? 0.9284 1.0031 0.6706 -0.0603 -0.1029 -0.0157 619 PHE B N 11251 C CA . PHE B 638 ? 0.9931 1.0245 0.7327 -0.0503 -0.0995 -0.0334 619 PHE B CA 11252 C C . PHE B 638 ? 1.0258 1.0371 0.7791 -0.0450 -0.0964 -0.0207 619 PHE B C 11253 O O . PHE B 638 ? 1.1028 1.1135 0.8730 -0.0504 -0.0982 0.0000 619 PHE B O 11254 C CB . PHE B 638 ? 0.9980 0.9953 0.7377 -0.0532 -0.1025 -0.0419 619 PHE B CB 11255 C CG . PHE B 638 ? 0.9823 0.9338 0.7237 -0.0453 -0.0999 -0.0520 619 PHE B CG 11256 C CD1 . PHE B 638 ? 1.0400 0.9778 0.7718 -0.0368 -0.0983 -0.0748 619 PHE B CD1 11257 C CD2 . PHE B 638 ? 0.9499 0.8740 0.7042 -0.0467 -0.0995 -0.0387 619 PHE B CD2 11258 C CE1 . PHE B 638 ? 0.9512 0.8485 0.6858 -0.0303 -0.0970 -0.0810 619 PHE B CE1 11259 C CE2 . PHE B 638 ? 1.0779 0.9643 0.8324 -0.0405 -0.0974 -0.0464 619 PHE B CE2 11260 C CZ . PHE B 638 ? 0.9703 0.8429 0.7146 -0.0325 -0.0965 -0.0659 619 PHE B CZ 11261 N N . CYS B 639 ? 0.9240 0.9198 0.6722 -0.0345 -0.0923 -0.0341 620 CYS B N 11262 C CA . CYS B 639 ? 0.9046 0.8799 0.6640 -0.0288 -0.0895 -0.0255 620 CYS B CA 11263 C C . CYS B 639 ? 0.9196 0.8520 0.6751 -0.0214 -0.0884 -0.0401 620 CYS B C 11264 O O . CYS B 639 ? 1.0624 0.9883 0.8075 -0.0144 -0.0875 -0.0592 620 CYS B O 11265 C CB . CYS B 639 ? 0.7898 0.7920 0.5498 -0.0233 -0.0860 -0.0225 620 CYS B CB 11266 S SG . CYS B 639 ? 1.2253 1.2742 0.9983 -0.0326 -0.0876 0.0044 620 CYS B SG 11267 N N . LEU B 640 ? 0.8903 0.7955 0.6560 -0.0233 -0.0887 -0.0310 621 LEU B N 11268 C CA . LEU B 640 ? 0.9866 0.8533 0.7492 -0.0184 -0.0882 -0.0408 621 LEU B CA 11269 C C . LEU B 640 ? 0.9010 0.7600 0.6596 -0.0072 -0.0858 -0.0496 621 LEU B C 11270 O O . LEU B 640 ? 0.8064 0.6414 0.5591 -0.0018 -0.0865 -0.0625 621 LEU B O 11271 C CB . LEU B 640 ? 0.9840 0.8312 0.7591 -0.0230 -0.0881 -0.0284 621 LEU B CB 11272 C CG . LEU B 640 ? 0.9167 0.7347 0.6896 -0.0274 -0.0897 -0.0330 621 LEU B CG 11273 C CD1 . LEU B 640 ? 0.7567 0.5539 0.5381 -0.0275 -0.0878 -0.0266 621 LEU B CD1 11274 C CD2 . LEU B 640 ? 0.8535 0.6546 0.6132 -0.0227 -0.0910 -0.0501 621 LEU B CD2 11275 N N . PHE B 641 ? 0.8332 0.7131 0.5975 -0.0039 -0.0834 -0.0417 622 PHE B N 11276 C CA . PHE B 641 ? 0.6368 0.5100 0.4004 0.0065 -0.0811 -0.0476 622 PHE B CA 11277 C C . PHE B 641 ? 0.7926 0.6922 0.5496 0.0125 -0.0794 -0.0587 622 PHE B C 11278 O O . PHE B 641 ? 0.8428 0.7515 0.6031 0.0194 -0.0769 -0.0584 622 PHE B O 11279 C CB . PHE B 641 ? 0.6721 0.5467 0.4493 0.0069 -0.0794 -0.0326 622 PHE B CB 11280 C CG . PHE B 641 ? 0.7882 0.6410 0.5736 0.0010 -0.0804 -0.0243 622 PHE B CG 11281 C CD1 . PHE B 641 ? 0.9146 0.7371 0.6928 0.0010 -0.0817 -0.0316 622 PHE B CD1 11282 C CD2 . PHE B 641 ? 0.9087 0.7731 0.7115 -0.0049 -0.0803 -0.0094 622 PHE B CD2 11283 C CE1 . PHE B 641 ? 0.9268 0.7333 0.7122 -0.0051 -0.0819 -0.0249 622 PHE B CE1 11284 C CE2 . PHE B 641 ? 0.9488 0.7960 0.7614 -0.0102 -0.0807 -0.0046 622 PHE B CE2 11285 C CZ . PHE B 641 ? 0.8629 0.6822 0.6653 -0.0104 -0.0811 -0.0127 622 PHE B CZ 11286 N N . ARG B 642 ? 0.7524 0.6660 0.5007 0.0095 -0.0806 -0.0698 623 ARG B N 11287 C CA . ARG B 642 ? 1.0118 0.9523 0.7534 0.0147 -0.0787 -0.0855 623 ARG B CA 11288 C C . ARG B 642 ? 1.0228 0.9485 0.7578 0.0171 -0.0811 -0.1081 623 ARG B C 11289 O O . ARG B 642 ? 0.8655 0.7778 0.5985 0.0104 -0.0843 -0.1085 623 ARG B O 11290 C CB . ARG B 642 ? 1.0897 1.0762 0.8290 0.0069 -0.0778 -0.0763 623 ARG B CB 11291 C CG . ARG B 642 ? 1.2465 1.2507 0.9968 0.0040 -0.0762 -0.0529 623 ARG B CG 11292 C CD . ARG B 642 ? 1.3689 1.3838 1.1221 0.0132 -0.0722 -0.0563 623 ARG B CD 11293 N NE . ARG B 642 ? 1.4081 1.4435 1.1743 0.0096 -0.0710 -0.0340 623 ARG B NE 11294 C CZ . ARG B 642 ? 1.5088 1.5875 1.2768 0.0032 -0.0701 -0.0222 623 ARG B CZ 11295 N NH1 . ARG B 642 ? 1.4966 1.6050 1.2513 -0.0005 -0.0700 -0.0318 623 ARG B NH1 11296 N NH2 . ARG B 642 ? 1.5810 1.6749 1.3653 0.0000 -0.0698 -0.0007 623 ARG B NH2 11297 N N . SER B 643 ? 1.0793 1.0077 0.8139 0.0266 -0.0800 -0.1278 624 SER B N 11298 C CA . SER B 643 ? 1.2205 1.1330 0.9548 0.0300 -0.0829 -0.1513 624 SER B CA 11299 C C . SER B 643 ? 1.1067 1.0519 0.8393 0.0352 -0.0808 -0.1753 624 SER B C 11300 O O . SER B 643 ? 1.1677 1.1372 0.9010 0.0405 -0.0768 -0.1764 624 SER B O 11301 C CB . SER B 643 ? 1.2864 1.1536 1.0290 0.0374 -0.0857 -0.1541 624 SER B CB 11302 O OG . SER B 643 ? 1.1854 1.0507 0.9327 0.0457 -0.0835 -0.1487 624 SER B OG 11303 N N . GLU B 644 ? 1.0013 0.9483 0.7328 0.0334 -0.0834 -0.1957 625 GLU B N 11304 C CA . GLU B 644 ? 0.9431 0.9254 0.6736 0.0370 -0.0815 -0.2224 625 GLU B CA 11305 C C . GLU B 644 ? 1.0790 1.0543 0.8211 0.0505 -0.0799 -0.2399 625 GLU B C 11306 O O . GLU B 644 ? 1.1547 1.1677 0.8962 0.0545 -0.0758 -0.2552 625 GLU B O 11307 C CB . GLU B 644 ? 1.0187 0.9983 0.7498 0.0330 -0.0855 -0.2434 625 GLU B CB 11308 C CG . GLU B 644 ? 1.3815 1.4061 1.1105 0.0344 -0.0833 -0.2727 625 GLU B CG 11309 C CD . GLU B 644 ? 1.5475 1.6276 1.2600 0.0245 -0.0798 -0.2619 625 GLU B CD 11310 O OE1 . GLU B 644 ? 1.5935 1.6749 1.2978 0.0138 -0.0820 -0.2398 625 GLU B OE1 11311 O OE2 . GLU B 644 ? 1.4784 1.6022 1.1875 0.0272 -0.0751 -0.2748 625 GLU B OE2 11312 N N . THR B 645 ? 1.1035 1.0327 0.8571 0.0571 -0.0835 -0.2372 626 THR B N 11313 C CA . THR B 645 ? 1.0507 0.9693 0.8180 0.0700 -0.0833 -0.2496 626 THR B CA 11314 C C . THR B 645 ? 1.0711 0.9762 0.8377 0.0727 -0.0817 -0.2247 626 THR B C 11315 O O . THR B 645 ? 1.1651 1.1009 0.9257 0.0721 -0.0766 -0.2149 626 THR B O 11316 C CB . THR B 645 ? 1.1046 0.9825 0.8898 0.0764 -0.0899 -0.2664 626 THR B CB 11317 O OG1 . THR B 645 ? 1.2011 1.0379 0.9855 0.0714 -0.0943 -0.2455 626 THR B OG1 11318 C CG2 . THR B 645 ? 0.8217 0.7140 0.6116 0.0746 -0.0917 -0.2950 626 THR B CG2 11319 N N . LYS B 646 ? 1.0403 0.9014 0.8139 0.0750 -0.0863 -0.2141 627 LYS B N 11320 C CA . LYS B 646 ? 0.9931 0.8407 0.7660 0.0767 -0.0855 -0.1912 627 LYS B CA 11321 C C . LYS B 646 ? 1.0766 0.8850 0.8488 0.0714 -0.0898 -0.1736 627 LYS B C 11322 O O . LYS B 646 ? 1.1928 0.9722 0.9725 0.0724 -0.0950 -0.1809 627 LYS B O 11323 C CB . LYS B 646 ? 1.0648 0.9075 0.8503 0.0895 -0.0858 -0.1998 627 LYS B CB 11324 C CG . LYS B 646 ? 1.2439 1.0743 1.0293 0.0915 -0.0854 -0.1778 627 LYS B CG 11325 C CD . LYS B 646 ? 1.4582 1.2829 1.2573 0.1043 -0.0868 -0.1864 627 LYS B CD 11326 C CE . LYS B 646 ? 1.5852 1.4505 1.3866 0.1098 -0.0812 -0.2021 627 LYS B CE 11327 N NZ . LYS B 646 ? 1.5950 1.4559 1.4115 0.1224 -0.0824 -0.2098 627 LYS B NZ 11328 N N . ASP B 647 ? 1.0390 0.8492 0.8041 0.0655 -0.0875 -0.1509 628 ASP B N 11329 C CA . ASP B 647 ? 0.9790 0.7574 0.7438 0.0612 -0.0903 -0.1334 628 ASP B CA 11330 C C . ASP B 647 ? 0.9502 0.7027 0.7149 0.0549 -0.0946 -0.1354 628 ASP B C 11331 O O . ASP B 647 ? 1.0477 0.7690 0.8181 0.0567 -0.0989 -0.1320 628 ASP B O 11332 C CB . ASP B 647 ? 1.0734 0.8317 0.8459 0.0701 -0.0926 -0.1296 628 ASP B CB 11333 C CG . ASP B 647 ? 1.2291 1.0091 1.0018 0.0744 -0.0885 -0.1221 628 ASP B CG 11334 O OD1 . ASP B 647 ? 1.1734 0.9735 0.9411 0.0677 -0.0845 -0.1102 628 ASP B OD1 11335 O OD2 . ASP B 647 ? 1.3277 1.1046 1.1082 0.0843 -0.0897 -0.1277 628 ASP B OD2 11336 N N . LEU B 648 ? 0.9426 0.7093 0.7016 0.0470 -0.0937 -0.1396 629 LEU B N 11337 C CA . LEU B 648 ? 0.9655 0.7097 0.7253 0.0403 -0.0976 -0.1415 629 LEU B CA 11338 C C . LEU B 648 ? 1.0439 0.7784 0.7985 0.0304 -0.0968 -0.1206 629 LEU B C 11339 O O . LEU B 648 ? 1.0625 0.8184 0.8127 0.0258 -0.0931 -0.1091 629 LEU B O 11340 C CB . LEU B 648 ? 0.8863 0.6510 0.6437 0.0367 -0.0979 -0.1586 629 LEU B CB 11341 C CG . LEU B 648 ? 0.8807 0.6613 0.6446 0.0460 -0.0980 -0.1836 629 LEU B CG 11342 C CD1 . LEU B 648 ? 0.8691 0.6726 0.6300 0.0411 -0.0984 -0.2016 629 LEU B CD1 11343 C CD2 . LEU B 648 ? 1.0024 0.7505 0.7821 0.0550 -0.1030 -0.1936 629 LEU B CD2 11344 N N . LEU B 649 ? 1.1563 0.8596 0.9139 0.0270 -0.1003 -0.1156 630 LEU B N 11345 C CA . LEU B 649 ? 1.0222 0.7153 0.7766 0.0177 -0.0993 -0.0978 630 LEU B CA 11346 C C . LEU B 649 ? 0.8850 0.5815 0.6386 0.0196 -0.0963 -0.0832 630 LEU B C 11347 O O . LEU B 649 ? 1.0043 0.6811 0.7588 0.0183 -0.0975 -0.0737 630 LEU B O 11348 C CB . LEU B 649 ? 0.8728 0.5834 0.6232 0.0079 -0.0976 -0.0953 630 LEU B CB 11349 C CG . LEU B 649 ? 0.8088 0.5186 0.5596 0.0050 -0.1007 -0.1104 630 LEU B CG 11350 C CD1 . LEU B 649 ? 0.7529 0.4810 0.5000 -0.0053 -0.0998 -0.1054 630 LEU B CD1 11351 C CD2 . LEU B 649 ? 0.7488 0.4241 0.5059 0.0042 -0.1052 -0.1131 630 LEU B CD2 11352 N N . PHE B 650 ? 0.7612 0.4848 0.5140 0.0220 -0.0926 -0.0814 631 PHE B N 11353 C CA . PHE B 650 ? 0.8499 0.5799 0.6050 0.0244 -0.0900 -0.0699 631 PHE B CA 11354 C C . PHE B 650 ? 0.8358 0.5828 0.5926 0.0345 -0.0887 -0.0768 631 PHE B C 11355 O O . PHE B 650 ? 0.8481 0.6083 0.6038 0.0380 -0.0887 -0.0899 631 PHE B O 11356 C CB . PHE B 650 ? 0.7575 0.5058 0.5153 0.0161 -0.0868 -0.0581 631 PHE B CB 11357 C CG . PHE B 650 ? 0.7578 0.4942 0.5158 0.0058 -0.0875 -0.0527 631 PHE B CG 11358 C CD1 . PHE B 650 ? 0.8318 0.5549 0.5928 0.0017 -0.0868 -0.0435 631 PHE B CD1 11359 C CD2 . PHE B 650 ? 0.8065 0.5477 0.5623 0.0000 -0.0889 -0.0576 631 PHE B CD2 11360 C CE1 . PHE B 650 ? 0.9862 0.7006 0.7487 -0.0080 -0.0869 -0.0394 631 PHE B CE1 11361 C CE2 . PHE B 650 ? 0.9741 0.7049 0.7315 -0.0095 -0.0896 -0.0527 631 PHE B CE2 11362 C CZ . PHE B 650 ? 1.0205 0.7376 0.7816 -0.0134 -0.0884 -0.0436 631 PHE B CZ 11363 N N . ARG B 651 ? 0.7772 0.5264 0.5374 0.0391 -0.0873 -0.0694 632 ARG B N 11364 C CA . ARG B 651 ? 0.9826 0.7510 0.7457 0.0480 -0.0855 -0.0750 632 ARG B CA 11365 C C . ARG B 651 ? 1.0358 0.8378 0.7993 0.0439 -0.0817 -0.0725 632 ARG B C 11366 O O . ARG B 651 ? 1.1304 0.9398 0.8958 0.0351 -0.0806 -0.0613 632 ARG B O 11367 C CB . ARG B 651 ? 1.1235 0.8882 0.8912 0.0534 -0.0853 -0.0671 632 ARG B CB 11368 C CG . ARG B 651 ? 1.2318 0.9671 0.9987 0.0546 -0.0893 -0.0634 632 ARG B CG 11369 C CD . ARG B 651 ? 1.2886 1.0054 1.0574 0.0624 -0.0942 -0.0740 632 ARG B CD 11370 N NE . ARG B 651 ? 1.4076 1.1123 1.1749 0.0585 -0.0965 -0.0822 632 ARG B NE 11371 C CZ . ARG B 651 ? 1.4190 1.1072 1.1828 0.0496 -0.0980 -0.0758 632 ARG B CZ 11372 N NH1 . ARG B 651 ? 1.3002 0.9836 1.0610 0.0433 -0.0969 -0.0617 632 ARG B NH1 11373 N NH2 . ARG B 651 ? 1.5253 1.2037 1.2899 0.0467 -0.1004 -0.0847 632 ARG B NH2 11374 N N . ASP B 652 ? 1.0340 0.8579 0.7973 0.0499 -0.0800 -0.0826 633 ASP B N 11375 C CA . ASP B 652 ? 0.9451 0.8052 0.7078 0.0452 -0.0769 -0.0796 633 ASP B CA 11376 C C . ASP B 652 ? 0.9196 0.7979 0.6910 0.0435 -0.0742 -0.0633 633 ASP B C 11377 O O . ASP B 652 ? 0.9908 0.8971 0.7649 0.0371 -0.0725 -0.0543 633 ASP B O 11378 C CB . ASP B 652 ? 1.0542 0.9362 0.8137 0.0515 -0.0754 -0.0971 633 ASP B CB 11379 C CG . ASP B 652 ? 1.1602 1.0347 0.9141 0.0502 -0.0779 -0.1138 633 ASP B CG 11380 O OD1 . ASP B 652 ? 1.2130 1.0776 0.9635 0.0416 -0.0799 -0.1085 633 ASP B OD1 11381 O OD2 . ASP B 652 ? 1.2991 1.1784 1.0542 0.0578 -0.0780 -0.1333 633 ASP B OD2 11382 N N . ASP B 653 ? 0.9272 0.7909 0.7046 0.0488 -0.0743 -0.0589 634 ASP B N 11383 C CA . ASP B 653 ? 0.9726 0.8513 0.7617 0.0473 -0.0723 -0.0448 634 ASP B CA 11384 C C . ASP B 653 ? 0.9767 0.8378 0.7726 0.0409 -0.0736 -0.0338 634 ASP B C 11385 O O . ASP B 653 ? 0.9581 0.8225 0.7660 0.0413 -0.0728 -0.0257 634 ASP B O 11386 C CB . ASP B 653 ? 1.0343 0.9175 0.8281 0.0574 -0.0711 -0.0484 634 ASP B CB 11387 C CG . ASP B 653 ? 1.2799 1.1336 1.0691 0.0653 -0.0741 -0.0578 634 ASP B CG 11388 O OD1 . ASP B 653 ? 1.4716 1.2999 1.2577 0.0618 -0.0768 -0.0549 634 ASP B OD1 11389 O OD2 . ASP B 653 ? 1.4069 1.2640 1.1969 0.0747 -0.0740 -0.0675 634 ASP B OD2 11390 N N . THR B 654 ? 0.8876 0.7316 0.6772 0.0348 -0.0755 -0.0351 635 THR B N 11391 C CA . THR B 654 ? 0.8711 0.7030 0.6678 0.0273 -0.0761 -0.0262 635 THR B CA 11392 C C . THR B 654 ? 0.8868 0.7425 0.6992 0.0201 -0.0750 -0.0138 635 THR B C 11393 O O . THR B 654 ? 0.9597 0.8331 0.7712 0.0154 -0.0753 -0.0110 635 THR B O 11394 C CB . THR B 654 ? 0.9941 0.8066 0.7816 0.0214 -0.0781 -0.0300 635 THR B CB 11395 O OG1 . THR B 654 ? 0.9448 0.7355 0.7210 0.0276 -0.0801 -0.0405 635 THR B OG1 11396 C CG2 . THR B 654 ? 0.5992 0.4007 0.3947 0.0138 -0.0780 -0.0223 635 THR B CG2 11397 N N . VAL B 655 ? 0.8798 0.7372 0.7085 0.0191 -0.0744 -0.0063 636 VAL B N 11398 C CA . VAL B 655 ? 0.7333 0.6102 0.5839 0.0120 -0.0745 0.0063 636 VAL B CA 11399 C C . VAL B 655 ? 0.6733 0.5404 0.5295 0.0028 -0.0759 0.0095 636 VAL B C 11400 O O . VAL B 655 ? 0.8363 0.7180 0.7015 -0.0042 -0.0774 0.0179 636 VAL B O 11401 C CB . VAL B 655 ? 0.7216 0.6040 0.5925 0.0146 -0.0736 0.0107 636 VAL B CB 11402 C CG1 . VAL B 655 ? 0.6803 0.5779 0.5803 0.0066 -0.0748 0.0231 636 VAL B CG1 11403 C CG2 . VAL B 655 ? 0.6119 0.5085 0.4810 0.0229 -0.0723 0.0097 636 VAL B CG2 11404 N N . CYS B 656 ? 0.7684 0.6125 0.6195 0.0024 -0.0756 0.0033 637 CYS B N 11405 C CA . CYS B 656 ? 0.9125 0.7466 0.7686 -0.0062 -0.0763 0.0044 637 CYS B CA 11406 C C . CYS B 656 ? 0.8877 0.6970 0.7302 -0.0057 -0.0756 -0.0037 637 CYS B C 11407 O O . CYS B 656 ? 0.7067 0.5077 0.5397 0.0011 -0.0751 -0.0084 637 CYS B O 11408 C CB . CYS B 656 ? 0.6732 0.5200 0.5599 -0.0120 -0.0764 0.0125 637 CYS B CB 11409 S SG . CYS B 656 ? 1.0392 0.8818 0.9400 -0.0087 -0.0744 0.0075 637 CYS B SG 11410 N N . LEU B 657 ? 0.6955 0.4949 0.5384 -0.0134 -0.0758 -0.0041 638 LEU B N 11411 C CA . LEU B 657 ? 0.6797 0.4598 0.5129 -0.0153 -0.0749 -0.0092 638 LEU B CA 11412 C C . LEU B 657 ? 0.7801 0.5663 0.6326 -0.0196 -0.0728 -0.0090 638 LEU B C 11413 O O . LEU B 657 ? 0.7978 0.5939 0.6711 -0.0260 -0.0726 -0.0059 638 LEU B O 11414 C CB . LEU B 657 ? 0.6693 0.4369 0.4930 -0.0218 -0.0760 -0.0106 638 LEU B CB 11415 C CG . LEU B 657 ? 0.6950 0.4590 0.5029 -0.0182 -0.0784 -0.0137 638 LEU B CG 11416 C CD1 . LEU B 657 ? 0.7512 0.5038 0.5527 -0.0252 -0.0799 -0.0158 638 LEU B CD1 11417 C CD2 . LEU B 657 ? 0.6053 0.3573 0.3985 -0.0092 -0.0791 -0.0191 638 LEU B CD2 11418 N N . ALA B 658 ? 0.8868 0.6687 0.7344 -0.0163 -0.0715 -0.0128 639 ALA B N 11419 C CA . ALA B 658 ? 0.8191 0.6105 0.6852 -0.0199 -0.0692 -0.0158 639 ALA B CA 11420 C C . ALA B 658 ? 0.8181 0.6002 0.6755 -0.0265 -0.0673 -0.0200 639 ALA B C 11421 O O . ALA B 658 ? 0.7532 0.5201 0.5875 -0.0257 -0.0683 -0.0195 639 ALA B O 11422 C CB . ALA B 658 ? 0.6853 0.4848 0.5546 -0.0126 -0.0691 -0.0178 639 ALA B CB 11423 N N . LYS B 659 ? 0.8110 0.6033 0.6892 -0.0335 -0.0649 -0.0239 640 LYS B N 11424 C CA . LYS B 659 ? 0.9241 0.7131 0.7967 -0.0412 -0.0621 -0.0287 640 LYS B CA 11425 C C . LYS B 659 ? 0.9413 0.7353 0.8042 -0.0396 -0.0606 -0.0332 640 LYS B C 11426 O O . LYS B 659 ? 0.7885 0.5931 0.6597 -0.0338 -0.0610 -0.0357 640 LYS B O 11427 C CB . LYS B 659 ? 0.8355 0.6366 0.7368 -0.0491 -0.0598 -0.0334 640 LYS B CB 11428 C CG . LYS B 659 ? 0.7052 0.5255 0.6393 -0.0474 -0.0593 -0.0385 640 LYS B CG 11429 C CD . LYS B 659 ? 0.8054 0.6355 0.7729 -0.0547 -0.0583 -0.0423 640 LYS B CD 11430 C CE . LYS B 659 ? 0.9351 0.7840 0.9415 -0.0533 -0.0584 -0.0486 640 LYS B CE 11431 N NZ . LYS B 659 ? 0.9505 0.8089 0.9941 -0.0605 -0.0579 -0.0539 640 LYS B NZ 11432 N N . LEU B 660 ? 0.9867 0.7747 0.8325 -0.0453 -0.0592 -0.0335 641 LEU B N 11433 C CA . LEU B 660 ? 0.9667 0.7609 0.7991 -0.0452 -0.0585 -0.0352 641 LEU B CA 11434 C C . LEU B 660 ? 1.1989 1.0112 1.0409 -0.0547 -0.0536 -0.0441 641 LEU B C 11435 O O . LEU B 660 ? 1.1953 1.0042 1.0341 -0.0632 -0.0513 -0.0437 641 LEU B O 11436 C CB . LEU B 660 ? 0.8893 0.6643 0.6931 -0.0443 -0.0617 -0.0257 641 LEU B CB 11437 C CG . LEU B 660 ? 0.7738 0.5318 0.5672 -0.0345 -0.0666 -0.0195 641 LEU B CG 11438 C CD1 . LEU B 660 ? 0.7076 0.4451 0.4803 -0.0356 -0.0701 -0.0116 641 LEU B CD1 11439 C CD2 . LEU B 660 ? 0.9293 0.6959 0.7238 -0.0256 -0.0684 -0.0206 641 LEU B CD2 11440 N N . HIS B 661 ? 1.2259 1.0591 1.0806 -0.0537 -0.0517 -0.0533 642 HIS B N 11441 C CA . HIS B 661 ? 1.3199 1.1754 1.1845 -0.0625 -0.0467 -0.0651 642 HIS B CA 11442 C C . HIS B 661 ? 1.3500 1.2133 1.1883 -0.0653 -0.0466 -0.0624 642 HIS B C 11443 O O . HIS B 661 ? 1.2910 1.1490 1.1102 -0.0725 -0.0457 -0.0556 642 HIS B O 11444 C CB . HIS B 661 ? 1.5729 1.4505 1.4718 -0.0608 -0.0448 -0.0797 642 HIS B CB 11445 C CG . HIS B 661 ? 1.8480 1.7182 1.7647 -0.0520 -0.0485 -0.0757 642 HIS B CG 11446 N ND1 . HIS B 661 ? 1.9416 1.8091 1.8497 -0.0428 -0.0520 -0.0710 642 HIS B ND1 11447 C CD2 . HIS B 661 ? 1.8957 1.7629 1.8392 -0.0515 -0.0494 -0.0746 642 HIS B CD2 11448 C CE1 . HIS B 661 ? 1.9446 1.8086 1.8725 -0.0374 -0.0543 -0.0675 642 HIS B CE1 11449 N NE2 . HIS B 661 ? 1.9028 1.7668 1.8522 -0.0427 -0.0531 -0.0686 642 HIS B NE2 11450 N N . ASP B 662 ? 1.4122 1.2893 1.2508 -0.0601 -0.0480 -0.0665 643 ASP B N 11451 C CA . ASP B 662 ? 1.3805 1.2691 1.1956 -0.0626 -0.0490 -0.0630 643 ASP B CA 11452 C C . ASP B 662 ? 1.1424 1.0057 0.9286 -0.0602 -0.0543 -0.0438 643 ASP B C 11453 O O . ASP B 662 ? 1.1612 1.0271 0.9276 -0.0674 -0.0546 -0.0356 643 ASP B O 11454 C CB . ASP B 662 ? 1.6450 1.5509 1.4672 -0.0558 -0.0508 -0.0703 643 ASP B CB 11455 C CG . ASP B 662 ? 1.7704 1.6969 1.6287 -0.0557 -0.0471 -0.0895 643 ASP B CG 11456 O OD1 . ASP B 662 ? 1.8533 1.7709 1.7341 -0.0555 -0.0457 -0.0922 643 ASP B OD1 11457 O OD2 . ASP B 662 ? 1.6851 1.6373 1.5511 -0.0560 -0.0461 -0.1018 643 ASP B OD2 11458 N N . ARG B 663 ? 0.9441 0.7844 0.7302 -0.0503 -0.0587 -0.0368 644 ARG B N 11459 C CA . ARG B 663 ? 0.9731 0.7895 0.7373 -0.0460 -0.0646 -0.0214 644 ARG B CA 11460 C C . ARG B 663 ? 0.9905 0.7847 0.7490 -0.0504 -0.0648 -0.0144 644 ARG B C 11461 O O . ARG B 663 ? 1.0862 0.8576 0.8399 -0.0438 -0.0690 -0.0078 644 ARG B O 11462 C CB . ARG B 663 ? 0.9611 0.7668 0.7286 -0.0330 -0.0690 -0.0197 644 ARG B CB 11463 C CG . ARG B 663 ? 0.9061 0.7319 0.6794 -0.0279 -0.0698 -0.0257 644 ARG B CG 11464 C CD . ARG B 663 ? 0.9204 0.7380 0.7025 -0.0158 -0.0727 -0.0260 644 ARG B CD 11465 N NE . ARG B 663 ? 1.1176 0.9104 0.8854 -0.0094 -0.0778 -0.0152 644 ARG B NE 11466 C CZ . ARG B 663 ? 1.0841 0.8682 0.8568 0.0008 -0.0801 -0.0149 644 ARG B CZ 11467 N NH1 . ARG B 663 ? 1.1809 0.9786 0.9717 0.0052 -0.0780 -0.0222 644 ARG B NH1 11468 N NH2 . ARG B 663 ? 1.0986 0.8620 0.8605 0.0062 -0.0845 -0.0078 644 ARG B NH2 11469 N N . ASN B 664 ? 1.0542 0.8567 0.8142 -0.0616 -0.0602 -0.0170 645 ASN B N 11470 C CA . ASN B 664 ? 1.0843 0.8676 0.8408 -0.0668 -0.0601 -0.0114 645 ASN B CA 11471 C C . ASN B 664 ? 1.0178 0.7887 0.7538 -0.0719 -0.0638 0.0034 645 ASN B C 11472 O O . ASN B 664 ? 1.0097 0.7661 0.7431 -0.0776 -0.0638 0.0085 645 ASN B O 11473 C CB . ASN B 664 ? 1.0823 0.8795 0.8551 -0.0761 -0.0535 -0.0217 645 ASN B CB 11474 C CG . ASN B 664 ? 1.2424 1.0669 1.0130 -0.0862 -0.0485 -0.0269 645 ASN B CG 11475 O OD1 . ASN B 664 ? 1.3065 1.1457 1.0669 -0.0855 -0.0496 -0.0256 645 ASN B OD1 11476 N ND2 . ASN B 664 ? 1.2526 1.0863 1.0331 -0.0960 -0.0430 -0.0336 645 ASN B ND2 11477 N N . THR B 665 ? 0.9314 0.7086 0.6546 -0.0700 -0.0675 0.0112 646 THR B N 11478 C CA . THR B 665 ? 1.0340 0.7991 0.7408 -0.0742 -0.0728 0.0284 646 THR B CA 11479 C C . THR B 665 ? 1.1144 0.8628 0.8163 -0.0626 -0.0811 0.0369 646 THR B C 11480 O O . THR B 665 ? 1.1659 0.9214 0.8728 -0.0534 -0.0816 0.0297 646 THR B O 11481 C CB . THR B 665 ? 0.9814 0.7738 0.6773 -0.0851 -0.0707 0.0337 646 THR B CB 11482 O OG1 . THR B 665 ? 0.9593 0.7683 0.6513 -0.0793 -0.0733 0.0328 646 THR B OG1 11483 C CG2 . THR B 665 ? 0.9561 0.7732 0.6608 -0.0952 -0.0614 0.0197 646 THR B CG2 11484 N N . TYR B 666 ? 1.0153 0.7418 0.7102 -0.0630 -0.0877 0.0518 647 TYR B N 11485 C CA . TYR B 666 ? 0.8906 0.5985 0.5855 -0.0513 -0.0961 0.0584 647 TYR B CA 11486 C C . TYR B 666 ? 0.9001 0.6257 0.5891 -0.0476 -0.0995 0.0631 647 TYR B C 11487 O O . TYR B 666 ? 0.9076 0.6273 0.6009 -0.0357 -0.1033 0.0602 647 TYR B O 11488 C CB . TYR B 666 ? 0.8157 0.4964 0.5098 -0.0529 -0.1033 0.0728 647 TYR B CB 11489 C CG . TYR B 666 ? 0.8622 0.5478 0.5473 -0.0614 -0.1088 0.0931 647 TYR B CG 11490 C CD1 . TYR B 666 ? 0.9341 0.6148 0.6183 -0.0550 -0.1179 0.1057 647 TYR B CD1 11491 C CD2 . TYR B 666 ? 0.9723 0.6684 0.6511 -0.0762 -0.1052 0.1010 647 TYR B CD2 11492 C CE1 . TYR B 666 ? 0.9032 0.5900 0.5804 -0.0634 -0.1240 0.1274 647 TYR B CE1 11493 C CE2 . TYR B 666 ? 1.0038 0.7075 0.6744 -0.0851 -0.1105 0.1222 647 TYR B CE2 11494 C CZ . TYR B 666 ? 1.0204 0.7195 0.6902 -0.0788 -0.1203 0.1363 647 TYR B CZ 11495 O OH . TYR B 666 ? 0.9500 0.6583 0.6127 -0.0884 -0.1266 0.1602 647 TYR B OH 11496 N N . GLU B 667 ? 0.8290 0.5787 0.5082 -0.0581 -0.0978 0.0697 648 GLU B N 11497 C CA . GLU B 667 ? 0.9720 0.7427 0.6445 -0.0560 -0.1014 0.0743 648 GLU B CA 11498 C C . GLU B 667 ? 1.1081 0.8975 0.7887 -0.0492 -0.0962 0.0552 648 GLU B C 11499 O O . GLU B 667 ? 1.2185 1.0133 0.8996 -0.0407 -0.1004 0.0551 648 GLU B O 11500 C CB . GLU B 667 ? 1.0417 0.8395 0.7008 -0.0703 -0.1005 0.0852 648 GLU B CB 11501 C CG . GLU B 667 ? 1.2798 1.0633 0.9328 -0.0798 -0.1049 0.1059 648 GLU B CG 11502 C CD . GLU B 667 ? 1.4423 1.2312 1.0956 -0.0919 -0.0964 0.1003 648 GLU B CD 11503 O OE1 . GLU B 667 ? 1.5696 1.3584 1.2161 -0.1033 -0.0983 0.1171 648 GLU B OE1 11504 O OE2 . GLU B 667 ? 1.3328 1.1264 0.9948 -0.0903 -0.0882 0.0801 648 GLU B OE2 11505 N N . LYS B 668 ? 0.9700 0.7691 0.6595 -0.0532 -0.0875 0.0394 649 LYS B N 11506 C CA . LYS B 668 ? 0.9605 0.7780 0.6629 -0.0480 -0.0826 0.0215 649 LYS B CA 11507 C C . LYS B 668 ? 0.9849 0.7820 0.6997 -0.0354 -0.0839 0.0156 649 LYS B C 11508 O O . LYS B 668 ? 0.9909 0.7984 0.7158 -0.0280 -0.0832 0.0062 649 LYS B O 11509 C CB . LYS B 668 ? 0.9646 0.8029 0.6765 -0.0578 -0.0735 0.0071 649 LYS B CB 11510 C CG . LYS B 668 ? 1.1280 0.9937 0.8283 -0.0711 -0.0708 0.0098 649 LYS B CG 11511 C CD . LYS B 668 ? 1.1918 1.0750 0.9042 -0.0807 -0.0616 -0.0054 649 LYS B CD 11512 C CE . LYS B 668 ? 1.2789 1.1932 1.0078 -0.0799 -0.0566 -0.0264 649 LYS B CE 11513 N NZ . LYS B 668 ? 1.2965 1.2437 1.0127 -0.0850 -0.0574 -0.0265 649 LYS B NZ 11514 N N . TYR B 669 ? 1.0629 0.8329 0.7775 -0.0335 -0.0858 0.0208 650 TYR B N 11515 C CA . TYR B 669 ? 0.9847 0.7386 0.7092 -0.0226 -0.0867 0.0152 650 TYR B CA 11516 C C . TYR B 669 ? 1.0191 0.7629 0.7406 -0.0112 -0.0939 0.0211 650 TYR B C 11517 O O . TYR B 669 ? 1.1216 0.8662 0.8521 -0.0016 -0.0938 0.0140 650 TYR B O 11518 C CB . TYR B 669 ? 0.8810 0.6130 0.6069 -0.0247 -0.0862 0.0162 650 TYR B CB 11519 C CG . TYR B 669 ? 0.8486 0.5704 0.5840 -0.0149 -0.0865 0.0094 650 TYR B CG 11520 C CD1 . TYR B 669 ? 0.8602 0.5950 0.6093 -0.0142 -0.0813 -0.0008 650 TYR B CD1 11521 C CD2 . TYR B 669 ? 0.7820 0.4834 0.5145 -0.0066 -0.0922 0.0131 650 TYR B CD2 11522 C CE1 . TYR B 669 ? 0.7647 0.4944 0.5216 -0.0064 -0.0817 -0.0051 650 TYR B CE1 11523 C CE2 . TYR B 669 ? 0.7993 0.4963 0.5394 0.0018 -0.0919 0.0057 650 TYR B CE2 11524 C CZ . TYR B 669 ? 0.7737 0.4860 0.5245 0.0014 -0.0865 -0.0023 650 TYR B CZ 11525 O OH . TYR B 669 ? 0.8581 0.5700 0.6156 0.0085 -0.0862 -0.0076 650 TYR B OH 11526 N N . LEU B 670 ? 0.9328 0.6681 0.6435 -0.0127 -0.1004 0.0349 651 LEU B N 11527 C CA . LEU B 670 ? 0.9227 0.6475 0.6332 -0.0021 -0.1085 0.0418 651 LEU B CA 11528 C C . LEU B 670 ? 0.9750 0.7220 0.6848 0.0017 -0.1099 0.0406 651 LEU B C 11529 O O . LEU B 670 ? 1.1475 0.8908 0.8630 0.0129 -0.1138 0.0390 651 LEU B O 11530 C CB . LEU B 670 ? 1.0052 0.7125 0.7090 -0.0056 -0.1163 0.0590 651 LEU B CB 11531 C CG . LEU B 670 ? 0.9638 0.6439 0.6722 -0.0059 -0.1176 0.0599 651 LEU B CG 11532 C CD1 . LEU B 670 ? 1.0959 0.7645 0.7995 -0.0137 -0.1241 0.0782 651 LEU B CD1 11533 C CD2 . LEU B 670 ? 0.9785 0.6413 0.6973 0.0078 -0.1214 0.0531 651 LEU B CD2 11534 N N . GLY B 671 ? 0.8557 0.6278 0.5593 -0.0077 -0.1068 0.0405 652 GLY B N 11535 C CA . GLY B 671 ? 0.8626 0.6592 0.5653 -0.0054 -0.1083 0.0380 652 GLY B CA 11536 C C . GLY B 671 ? 1.0277 0.8305 0.7172 -0.0090 -0.1164 0.0554 652 GLY B C 11537 O O . GLY B 671 ? 1.1290 0.9100 0.8149 -0.0082 -0.1233 0.0708 652 GLY B O 11538 N N . GLU B 672 ? 1.0481 0.8820 0.7323 -0.0134 -0.1160 0.0533 653 GLU B N 11539 C CA . GLU B 672 ? 1.1803 1.0262 0.8509 -0.0182 -0.1241 0.0714 653 GLU B CA 11540 C C . GLU B 672 ? 1.1315 0.9591 0.8059 -0.0063 -0.1350 0.0836 653 GLU B C 11541 O O . GLU B 672 ? 1.2189 1.0393 0.8868 -0.0090 -0.1440 0.1044 653 GLU B O 11542 C CB . GLU B 672 ? 1.4223 1.3101 1.0867 -0.0252 -0.1213 0.0636 653 GLU B CB 11543 C CG . GLU B 672 ? 1.7267 1.6284 1.4045 -0.0163 -0.1183 0.0441 653 GLU B CG 11544 C CD . GLU B 672 ? 1.8612 1.8060 1.5352 -0.0238 -0.1155 0.0336 653 GLU B CD 11545 O OE1 . GLU B 672 ? 1.8337 1.8000 1.4926 -0.0365 -0.1153 0.0412 653 GLU B OE1 11546 O OE2 . GLU B 672 ? 1.9137 1.8728 1.6008 -0.0175 -0.1136 0.0172 653 GLU B OE2 11547 N N . GLU B 673 ? 1.0762 0.8967 0.7632 0.0065 -0.1344 0.0712 654 GLU B N 11548 C CA . GLU B 673 ? 1.1417 0.9458 0.8356 0.0187 -0.1439 0.0796 654 GLU B CA 11549 C C . GLU B 673 ? 1.2444 1.0140 0.9425 0.0216 -0.1495 0.0914 654 GLU B C 11550 O O . GLU B 673 ? 1.2810 1.0407 0.9802 0.0238 -0.1601 0.1087 654 GLU B O 11551 C CB . GLU B 673 ? 1.1378 0.9425 0.8456 0.0313 -0.1408 0.0627 654 GLU B CB 11552 C CG . GLU B 673 ? 1.2169 1.0543 0.9253 0.0309 -0.1387 0.0528 654 GLU B CG 11553 C CD . GLU B 673 ? 1.2810 1.1179 1.0048 0.0441 -0.1384 0.0413 654 GLU B CD 11554 O OE1 . GLU B 673 ? 1.2480 1.0626 0.9813 0.0523 -0.1371 0.0375 654 GLU B OE1 11555 O OE2 . GLU B 673 ? 1.2445 1.1054 0.9712 0.0458 -0.1395 0.0356 654 GLU B OE2 11556 N N . TYR B 674 ? 1.3062 1.0582 1.0088 0.0213 -0.1429 0.0820 655 TYR B N 11557 C CA . TYR B 674 ? 1.2666 0.9871 0.9752 0.0234 -0.1477 0.0899 655 TYR B CA 11558 C C . TYR B 674 ? 1.3123 1.0298 1.0126 0.0119 -0.1536 0.1111 655 TYR B C 11559 O O . TYR B 674 ? 1.3441 1.0417 1.0519 0.0149 -0.1636 0.1258 655 TYR B O 11560 C CB . TYR B 674 ? 1.1741 0.8810 0.8874 0.0235 -0.1393 0.0754 655 TYR B CB 11561 C CG . TYR B 674 ? 1.1695 0.8455 0.8903 0.0255 -0.1442 0.0807 655 TYR B CG 11562 C CD1 . TYR B 674 ? 1.1682 0.8264 0.9029 0.0383 -0.1474 0.0728 655 TYR B CD1 11563 C CD2 . TYR B 674 ? 1.2047 0.8712 0.9207 0.0144 -0.1457 0.0927 655 TYR B CD2 11564 C CE1 . TYR B 674 ? 1.2491 0.8806 0.9937 0.0403 -0.1521 0.0748 655 TYR B CE1 11565 C CE2 . TYR B 674 ? 1.2736 0.9117 0.9998 0.0162 -0.1508 0.0967 655 TYR B CE2 11566 C CZ . TYR B 674 ? 1.2573 0.8780 0.9985 0.0293 -0.1541 0.0868 655 TYR B CZ 11567 O OH . TYR B 674 ? 1.1793 0.7733 0.9337 0.0312 -0.1594 0.0878 655 TYR B OH 11568 N N . VAL B 675 ? 1.3277 1.0660 1.0148 -0.0016 -0.1475 0.1125 656 VAL B N 11569 C CA . VAL B 675 ? 1.2809 1.0208 0.9591 -0.0146 -0.1517 0.1329 656 VAL B CA 11570 C C . VAL B 675 ? 1.3123 1.0613 0.9874 -0.0152 -0.1636 0.1551 656 VAL B C 11571 O O . VAL B 675 ? 1.3236 1.0559 1.0032 -0.0183 -0.1729 0.1761 656 VAL B O 11572 C CB . VAL B 675 ? 1.1408 0.9079 0.8056 -0.0291 -0.1417 0.1275 656 VAL B CB 11573 C CG1 . VAL B 675 ? 1.0350 0.8106 0.6890 -0.0436 -0.1461 0.1506 656 VAL B CG1 11574 C CG2 . VAL B 675 ? 0.9789 0.7338 0.6493 -0.0297 -0.1318 0.1101 656 VAL B CG2 11575 N N . LYS B 676 ? 1.3490 1.1247 1.0186 -0.0125 -0.1640 0.1508 657 LYS B N 11576 C CA . LYS B 676 ? 1.4444 1.2326 1.1110 -0.0128 -0.1758 0.1716 657 LYS B CA 11577 C C . LYS B 676 ? 1.3755 1.1323 1.0608 0.0004 -0.1875 0.1811 657 LYS B C 11578 O O . LYS B 676 ? 1.5703 1.3234 1.2593 -0.0017 -0.1999 0.2056 657 LYS B O 11579 C CB . LYS B 676 ? 1.6082 1.4324 1.2667 -0.0117 -0.1735 0.1612 657 LYS B CB 11580 C CG . LYS B 676 ? 1.7275 1.5896 1.3689 -0.0264 -0.1646 0.1550 657 LYS B CG 11581 C CD . LYS B 676 ? 1.7258 1.6242 1.3628 -0.0247 -0.1628 0.1419 657 LYS B CD 11582 C CE . LYS B 676 ? 1.6321 1.5704 1.2554 -0.0393 -0.1534 0.1315 657 LYS B CE 11583 N NZ . LYS B 676 ? 1.4875 1.4634 1.1088 -0.0382 -0.1518 0.1163 657 LYS B NZ 11584 N N . ALA B 677 ? 1.2409 0.9770 0.9399 0.0136 -0.1837 0.1617 658 ALA B N 11585 C CA . ALA B 677 ? 1.1861 0.8942 0.9057 0.0273 -0.1933 0.1650 658 ALA B CA 11586 C C . ALA B 677 ? 1.2316 0.9099 0.9631 0.0242 -0.2007 0.1806 658 ALA B C 11587 O O . ALA B 677 ? 1.4238 1.0908 1.1685 0.0271 -0.2140 0.1999 658 ALA B O 11588 C CB . ALA B 677 ? 1.1402 0.8381 0.8700 0.0403 -0.1859 0.1392 658 ALA B CB 11589 N N . VAL B 678 ? 1.1384 0.8042 0.8677 0.0184 -0.1929 0.1726 659 VAL B N 11590 C CA . VAL B 678 ? 1.3967 1.0349 1.1385 0.0144 -0.1994 0.1860 659 VAL B CA 11591 C C . VAL B 678 ? 1.5265 1.1777 1.2582 -0.0013 -0.2053 0.2142 659 VAL B C 11592 O O . VAL B 678 ? 1.6896 1.3596 1.4164 -0.0034 -0.2130 0.2314 659 VAL B O 11593 C CB . VAL B 678 ? 1.4850 1.1072 1.2278 0.0125 -0.1895 0.1683 659 VAL B CB 11594 C CG1 . VAL B 678 ? 1.4375 1.0424 1.1957 0.0280 -0.1873 0.1454 659 VAL B CG1 11595 C CG2 . VAL B 678 ? 1.5745 1.2217 1.2957 0.0023 -0.1761 0.1578 659 VAL B CG2 11596 N N . GLY B 679 ? 1.6052 1.2485 1.3337 -0.0128 -0.2019 0.2199 660 GLY B N 11597 C CA . GLY B 679 ? 1.7947 1.4547 1.5118 -0.0294 -0.2056 0.2464 660 GLY B CA 11598 C C . GLY B 679 ? 1.8917 1.5449 1.6231 -0.0300 -0.2227 0.2775 660 GLY B C 11599 O O . GLY B 679 ? 1.9266 1.5647 1.6689 -0.0384 -0.2298 0.2985 660 GLY B O 11600 N N . ASN B 680 ? 1.8622 1.5272 1.5954 -0.0217 -0.2297 0.2813 661 ASN B N 11601 C CA . ASN B 680 ? 1.8695 1.5244 1.6224 -0.0189 -0.2474 0.3090 661 ASN B CA 11602 C C . ASN B 680 ? 1.8153 1.4256 1.6034 -0.0083 -0.2558 0.3073 661 ASN B C 11603 O O . ASN B 680 ? 1.9326 1.5270 1.7401 -0.0136 -0.2683 0.3337 661 ASN B O 11604 C CB . ASN B 680 ? 1.8829 1.5571 1.6339 -0.0096 -0.2532 0.3093 661 ASN B CB 11605 C CG . ASN B 680 ? 2.2596 1.9780 1.9785 -0.0159 -0.2421 0.2978 661 ASN B CG 11606 O OD1 . ASN B 680 ? 2.2102 1.9408 1.9277 -0.0055 -0.2415 0.2842 661 ASN B OD1 11607 N ND2 . ASN B 680 ? 2.3054 2.0486 2.0012 -0.0327 -0.2337 0.3020 661 ASN B ND2 11608 N N . LEU B 681 ? 1.5681 1.1609 1.3653 0.0060 -0.2487 0.2762 662 LEU B N 11609 C CA . LEU B 681 ? 1.2985 0.8533 1.1283 0.0178 -0.2540 0.2655 662 LEU B CA 11610 C C . LEU B 681 ? 1.4725 1.0066 1.3107 0.0083 -0.2535 0.2708 662 LEU B C 11611 O O . LEU B 681 ? 1.5129 1.0182 1.3829 0.0109 -0.2648 0.2803 662 LEU B O 11612 C CB . LEU B 681 ? 1.1994 0.7507 1.0271 0.0311 -0.2423 0.2287 662 LEU B CB 11613 N N . ARG B 682 ? 1.7262 1.2763 1.5376 -0.0029 -0.2402 0.2632 663 ARG B N 11614 C CA . ARG B 682 ? 1.8214 1.3570 1.6359 -0.0134 -0.2374 0.2665 663 ARG B CA 11615 C C . ARG B 682 ? 1.7524 1.2908 1.5734 -0.0261 -0.2498 0.3044 663 ARG B C 11616 O O . ARG B 682 ? 1.7008 1.2634 1.5111 -0.0300 -0.2553 0.3241 663 ARG B O 11617 C CB . ARG B 682 ? 1.8182 1.3756 1.6022 -0.0230 -0.2208 0.2518 663 ARG B CB 11618 N N . LYS B 683 ? 1.7193 1.2348 1.5587 -0.0332 -0.2544 0.3153 664 LYS B N 11619 C CA . LYS B 683 ? 1.8079 1.3195 1.6638 -0.0438 -0.2691 0.3537 664 LYS B CA 11620 C C . LYS B 683 ? 1.8564 1.3535 1.7428 -0.0313 -0.2857 0.3655 664 LYS B C 11621 O O . LYS B 683 ? 1.7785 1.2937 1.6626 -0.0359 -0.2958 0.3939 664 LYS B O 11622 C CB . LYS B 683 ? 1.8262 1.3771 1.6506 -0.0620 -0.2661 0.3787 664 LYS B CB 11623 N N . CYS B 684 ? 1.8862 1.3514 1.8025 -0.0160 -0.2884 0.3427 665 CYS B N 11624 C CA . CYS B 684 ? 1.8519 1.2984 1.8031 -0.0001 -0.3018 0.3419 665 CYS B CA 11625 C C . CYS B 684 ? 1.8206 1.2447 1.7853 0.0139 -0.2938 0.3016 665 CYS B C 11626 O O . CYS B 684 ? 1.8040 1.2077 1.8020 0.0289 -0.3015 0.2885 665 CYS B O 11627 C CB . CYS B 684 ? 1.8148 1.2879 1.7487 0.0062 -0.3028 0.3448 665 CYS B CB 11628 S SG . CYS B 684 ? 1.7782 1.2357 1.7409 0.0307 -0.3081 0.3197 665 CYS B SG 11629 N N . SER B 685 ? 1.7577 1.1880 1.6970 0.0078 -0.2783 0.2824 666 SER B N 11630 C CA . SER B 685 ? 1.6107 1.0273 1.5549 0.0179 -0.2686 0.2449 666 SER B CA 11631 C C . SER B 685 ? 1.6296 1.0124 1.6112 0.0190 -0.2758 0.2399 666 SER B C 11632 O O . SER B 685 ? 1.6140 0.9819 1.6202 0.0114 -0.2886 0.2669 666 SER B O 11633 C CB . SER B 685 ? 1.5847 1.0219 1.4895 0.0096 -0.2507 0.2296 666 SER B CB 11634 O OG . SER B 685 ? 1.6090 1.0313 1.5205 0.0147 -0.2430 0.2001 666 SER B OG 11635 N N . THR B 686 ? 1.6431 1.0160 1.6299 0.0279 -0.2678 0.2052 667 THR B N 11636 C CA . THR B 686 ? 1.6891 1.0320 1.7131 0.0310 -0.2738 0.1928 667 THR B CA 11637 C C . THR B 686 ? 1.6180 0.9604 1.6255 0.0226 -0.2619 0.1762 667 THR B C 11638 O O . THR B 686 ? 1.4790 0.7991 1.5125 0.0188 -0.2671 0.1746 667 THR B O 11639 C CB . THR B 686 ? 1.5090 0.8399 1.5632 0.0504 -0.2775 0.1637 667 THR B CB 11640 O OG1 . THR B 686 ? 1.4815 0.7938 1.5856 0.0536 -0.2904 0.1705 667 THR B OG1 11641 C CG2 . THR B 686 ? 1.4883 0.8201 1.5351 0.0558 -0.2649 0.1248 667 THR B CG2 11642 N N . SER B 687 ? 1.5797 0.9467 1.5463 0.0195 -0.2467 0.1645 668 SER B N 11643 C CA . SER B 687 ? 1.3857 0.7562 1.3341 0.0118 -0.2347 0.1486 668 SER B CA 11644 C C . SER B 687 ? 1.2505 0.6124 1.2019 -0.0049 -0.2378 0.1716 668 SER B C 11645 O O . SER B 687 ? 1.0917 0.4682 1.0252 -0.0166 -0.2380 0.1988 668 SER B O 11646 C CB . SER B 687 ? 1.3019 0.7027 1.2086 0.0096 -0.2197 0.1398 668 SER B CB 11647 O OG . SER B 687 ? 1.1045 0.5102 0.9941 0.0001 -0.2092 0.1301 668 SER B OG 11648 N N . SER B 688 ? 1.2568 0.5972 1.2308 -0.0064 -0.2401 0.1600 669 SER B N 11649 C CA . SER B 688 ? 1.2666 0.5963 1.2493 -0.0219 -0.2442 0.1817 669 SER B CA 11650 C C . SER B 688 ? 1.2318 0.5816 1.1778 -0.0353 -0.2302 0.1816 669 SER B C 11651 O O . SER B 688 ? 1.2664 0.6170 1.2097 -0.0504 -0.2313 0.2045 669 SER B O 11652 C CB . SER B 688 ? 1.1530 0.4519 1.1771 -0.0189 -0.2525 0.1688 669 SER B CB 11653 O OG . SER B 688 ? 1.2643 0.5644 1.2811 -0.0139 -0.2426 0.1337 669 SER B OG 11654 N N . LEU B 689 ? 1.0986 0.4655 1.0188 -0.0299 -0.2173 0.1563 670 LEU B N 11655 C CA . LEU B 689 ? 1.1075 0.4952 0.9954 -0.0413 -0.2041 0.1546 670 LEU B CA 11656 C C . LEU B 689 ? 1.1006 0.5141 0.9627 -0.0495 -0.2010 0.1776 670 LEU B C 11657 O O . LEU B 689 ? 1.1333 0.5590 0.9810 -0.0645 -0.1966 0.1928 670 LEU B O 11658 C CB . LEU B 689 ? 0.9775 0.3767 0.8494 -0.0332 -0.1926 0.1227 670 LEU B CB 11659 C CG . LEU B 689 ? 0.9578 0.3757 0.8032 -0.0442 -0.1798 0.1181 670 LEU B CG 11660 C CD1 . LEU B 689 ? 1.1474 0.5512 1.0037 -0.0563 -0.1811 0.1236 670 LEU B CD1 11661 C CD2 . LEU B 689 ? 0.9323 0.3620 0.7656 -0.0355 -0.1703 0.0896 670 LEU B CD2 11662 N N . LEU B 690 ? 1.1019 0.5256 0.9591 -0.0398 -0.2033 0.1789 671 LEU B N 11663 C CA . LEU B 690 ? 1.0284 0.4786 0.8630 -0.0465 -0.2017 0.1993 671 LEU B CA 11664 C C . LEU B 690 ? 1.1468 0.5944 0.9900 -0.0599 -0.2112 0.2339 671 LEU B C 11665 O O . LEU B 690 ? 1.2348 0.7067 1.0562 -0.0736 -0.2062 0.2502 671 LEU B O 11666 C CB . LEU B 690 ? 1.0143 0.4719 0.8487 -0.0328 -0.2053 0.1956 671 LEU B CB 11667 C CG . LEU B 690 ? 1.1705 0.6586 0.9812 -0.0387 -0.2037 0.2134 671 LEU B CG 11668 C CD1 . LEU B 690 ? 1.2439 0.7593 1.0245 -0.0483 -0.1889 0.2045 671 LEU B CD1 11669 C CD2 . LEU B 690 ? 0.9815 0.4763 0.7932 -0.0243 -0.2069 0.2068 671 LEU B CD2 11670 N N . GLU B 691 ? 1.1560 0.5757 1.0335 -0.0564 -0.2250 0.2448 672 GLU B N 11671 C CA . GLU B 691 ? 1.2427 0.6573 1.1348 -0.0691 -0.2361 0.2804 672 GLU B CA 11672 C C . GLU B 691 ? 1.3208 0.7408 1.2026 -0.0864 -0.2292 0.2881 672 GLU B C 11673 O O . GLU B 691 ? 1.4416 0.8812 1.3105 -0.1015 -0.2296 0.3157 672 GLU B O 11674 C CB . GLU B 691 ? 1.2734 0.6527 1.2118 -0.0612 -0.2522 0.2861 672 GLU B CB 11675 C CG . GLU B 691 ? 1.3214 0.7018 1.2814 -0.0727 -0.2633 0.3232 672 GLU B CG 11676 C CD . GLU B 691 ? 1.4094 0.7672 1.4192 -0.0673 -0.2706 0.3176 672 GLU B CD 11677 O OE1 . GLU B 691 ? 1.5101 0.8487 1.5312 -0.0633 -0.2668 0.2916 672 GLU B OE1 11678 O OE2 . GLU B 691 ? 1.3242 0.6849 1.3623 -0.0674 -0.2804 0.3385 672 GLU B OE2 11679 N N . ALA B 692 ? 1.3209 0.7261 1.2081 -0.0845 -0.2227 0.2632 673 ALA B N 11680 C CA . ALA B 692 ? 1.3596 0.7669 1.2412 -0.0998 -0.2165 0.2675 673 ALA B CA 11681 C C . ALA B 692 ? 1.2758 0.7195 1.1187 -0.1106 -0.2023 0.2680 673 ALA B C 11682 O O . ALA B 692 ? 1.4059 0.8635 1.2407 -0.1272 -0.2001 0.2884 673 ALA B O 11683 C CB . ALA B 692 ? 1.3931 0.7782 1.2893 -0.0939 -0.2132 0.2382 673 ALA B CB 11684 N N . CYS B 693 ? 1.0985 0.5588 0.9198 -0.1015 -0.1926 0.2451 674 CYS B N 11685 C CA . CYS B 693 ? 1.2050 0.6997 0.9943 -0.1102 -0.1791 0.2410 674 CYS B CA 11686 C C . CYS B 693 ? 1.2124 0.7363 0.9853 -0.1181 -0.1810 0.2658 674 CYS B C 11687 O O . CYS B 693 ? 1.2579 0.8125 1.0086 -0.1303 -0.1718 0.2697 674 CYS B O 11688 C CB . CYS B 693 ? 0.9728 0.4756 0.7490 -0.0981 -0.1691 0.2093 674 CYS B CB 11689 S SG . CYS B 693 ? 1.1315 0.6067 0.9240 -0.0893 -0.1669 0.1799 674 CYS B SG 11690 N N . THR B 694 ? 1.1364 0.6524 0.9216 -0.1113 -0.1932 0.2818 675 THR B N 11691 C CA . THR B 694 ? 1.0424 0.5862 0.8140 -0.1189 -0.1974 0.3080 675 THR B CA 11692 C C . THR B 694 ? 1.1261 0.6749 0.9031 -0.1374 -0.2030 0.3414 675 THR B C 11693 O O . THR B 694 ? 1.1446 0.7266 0.9031 -0.1498 -0.2022 0.3626 675 THR B O 11694 C CB . THR B 694 ? 1.1515 0.6852 0.9368 -0.1051 -0.2097 0.3148 675 THR B CB 11695 O OG1 . THR B 694 ? 1.1100 0.6474 0.8856 -0.0900 -0.2026 0.2850 675 THR B OG1 11696 C CG2 . THR B 694 ? 1.0691 0.6312 0.8430 -0.1139 -0.2164 0.3458 675 THR B CG2 11697 N N . PHE B 695 ? 1.2048 0.7227 1.0073 -0.1400 -0.2084 0.3454 676 PHE B N 11698 C CA . PHE B 695 ? 1.2414 0.7622 1.0524 -0.1582 -0.2135 0.3772 676 PHE B CA 11699 C C . PHE B 695 ? 1.2978 0.8488 1.0827 -0.1741 -0.1987 0.3735 676 PHE B C 11700 O O . PHE B 695 ? 1.3809 0.9528 1.1602 -0.1918 -0.1996 0.4014 676 PHE B O 11701 C CB . PHE B 695 ? 1.1675 0.6455 1.0176 -0.1559 -0.2239 0.3804 676 PHE B CB 11702 C CG . PHE B 695 ? 1.1490 0.6360 1.0151 -0.1718 -0.2264 0.4072 676 PHE B CG 11703 C CD1 . PHE B 695 ? 1.1738 0.6762 1.0569 -0.1749 -0.2354 0.4356 676 PHE B CD1 11704 C CD2 . PHE B 695 ? 1.1461 0.6298 1.0122 -0.1829 -0.2188 0.4018 676 PHE B CD2 11705 C CE1 . PHE B 695 ? 1.1962 0.7104 1.0951 -0.1889 -0.2369 0.4587 676 PHE B CE1 11706 C CE2 . PHE B 695 ? 1.1673 0.6628 1.0497 -0.1965 -0.2200 0.4242 676 PHE B CE2 11707 C CZ . PHE B 695 ? 1.1927 0.7035 1.0912 -0.1995 -0.2291 0.4530 676 PHE B CZ 11708 N N . ARG B 696 ? 1.2000 0.7548 0.9707 -0.1681 -0.1852 0.3395 677 ARG B N 11709 C CA . ARG B 696 ? 1.2574 0.8400 1.0069 -0.1815 -0.1707 0.3314 677 ARG B CA 11710 C C . ARG B 696 ? 1.2717 0.8973 0.9908 -0.1831 -0.1605 0.3228 677 ARG B C 11711 O O . ARG B 696 ? 1.1670 0.8262 0.8686 -0.1975 -0.1508 0.3255 677 ARG B O 11712 C CB . ARG B 696 ? 1.1063 0.6685 0.8625 -0.1760 -0.1627 0.3011 677 ARG B CB 11713 C CG . ARG B 696 ? 1.1161 0.6435 0.9006 -0.1792 -0.1704 0.3083 677 ARG B CG 11714 C CD . ARG B 696 ? 1.1604 0.6704 0.9501 -0.1729 -0.1631 0.2768 677 ARG B CD 11715 N NE . ARG B 696 ? 1.1046 0.6416 0.8745 -0.1832 -0.1486 0.2655 677 ARG B NE 11716 C CZ . ARG B 696 ? 1.1802 0.7249 0.9387 -0.1758 -0.1383 0.2363 677 ARG B CZ 11717 N NH1 . ARG B 696 ? 1.1443 0.6734 0.9066 -0.1587 -0.1403 0.2161 677 ARG B NH1 11718 N NH2 . ARG B 696 ? 1.2133 0.7825 0.9586 -0.1860 -0.1263 0.2279 677 ARG B NH2 11719 N N . ARG B 697 ? 1.2192 0.8449 0.9339 -0.1682 -0.1626 0.3110 678 ARG B N 11720 C CA . ARG B 697 ? 1.2485 0.9138 0.9380 -0.1685 -0.1544 0.3019 678 ARG B CA 11721 C C . ARG B 697 ? 1.1630 0.8289 0.8526 -0.1568 -0.1638 0.3086 678 ARG B C 11722 O O . ARG B 697 ? 1.1791 0.8304 0.8729 -0.1404 -0.1634 0.2870 678 ARG B O 11723 C CB . ARG B 697 ? 1.3227 0.9937 1.0040 -0.1619 -0.1406 0.2659 678 ARG B CB 11724 C CG . ARG B 697 ? 1.4416 1.1553 1.1010 -0.1640 -0.1311 0.2539 678 ARG B CG 11725 C CD . ARG B 697 ? 1.5383 1.2527 1.1967 -0.1553 -0.1198 0.2194 678 ARG B CD 11726 N NE . ARG B 697 ? 1.5487 1.3030 1.1914 -0.1568 -0.1114 0.2064 678 ARG B NE 11727 C CZ . ARG B 697 ? 1.5498 1.3394 1.1821 -0.1702 -0.1011 0.2010 678 ARG B CZ 11728 N NH1 . ARG B 697 ? 1.6161 1.4058 1.2503 -0.1834 -0.0976 0.2088 678 ARG B NH1 11729 N NH2 . ARG B 697 ? 1.5253 1.3510 1.1471 -0.1703 -0.0942 0.1864 678 ARG B NH2 11730 N N . PRO B 698 ? 1.1625 0.8473 0.8477 -0.1659 -0.1725 0.3397 679 PRO B N 11731 C CA . PRO B 698 ? 1.2037 0.9094 0.8839 -0.1865 -0.1734 0.3684 679 PRO B CA 11732 C C . PRO B 698 ? 1.3965 1.0657 1.1049 -0.1900 -0.1858 0.3927 679 PRO B C 11733 O O . PRO B 698 ? 1.3953 1.0774 1.1062 -0.2045 -0.1934 0.4274 679 PRO B O 11734 C CB . PRO B 698 ? 1.2191 0.9620 0.8833 -0.1922 -0.1790 0.3907 679 PRO B CB 11735 C CG . PRO B 698 ? 1.1863 0.9060 0.8630 -0.1736 -0.1895 0.3872 679 PRO B CG 11736 C CD . PRO B 698 ? 1.1427 0.8366 0.8251 -0.1572 -0.1814 0.3488 679 PRO B CD # 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 MET 1 12 ? ? ? A . n A 1 2 ASP 2 13 ? ? ? A . n A 1 3 ILE 3 14 ? ? ? A . n A 1 4 HIS 4 15 ? ? ? A . n A 1 5 HIS 5 16 ? ? ? A . n A 1 6 HIS 6 17 ? ? ? A . n A 1 7 HIS 7 18 ? ? ? A . n A 1 8 HIS 8 19 ? ? ? A . n A 1 9 HIS 9 20 ? ? ? A . n A 1 10 HIS 10 21 ? ? ? A . n A 1 11 HIS 11 22 ? ? ? A . n A 1 12 HIS 12 23 ? ? ? A . n A 1 13 HIS 13 24 ? ? ? A . n A 1 14 GLU 14 25 ? ? ? A . n A 1 15 ASN 15 26 ? ? ? A . n A 1 16 VAL 16 27 ? ? ? A . n A 1 17 GLN 17 28 ? ? ? A . n A 1 18 ALA 18 29 ? ? ? A . n A 1 19 GLY 19 30 ? ? ? A . n A 1 20 GLN 20 31 ? ? ? A . n A 1 21 ALA 21 32 ? ? ? A . n A 1 22 GLN 22 33 ? ? ? A . n A 1 23 GLU 23 34 ? ? ? A . n A 1 24 LYS 24 35 ? ? ? A . n A 1 25 GLN 25 36 ? ? ? A . n A 1 26 LEU 26 37 ? ? ? A . n A 1 27 ASP 27 38 ? ? ? A . n A 1 28 THR 28 39 ? ? ? A . n A 1 29 ILE 29 40 ? ? ? A . n A 1 30 GLN 30 41 ? ? ? A . n A 1 31 VAL 31 42 ? ? ? A . n A 1 32 LYS 32 43 ? ? ? A . n A 1 33 ALA 33 44 ? ? ? A . n A 1 34 LYS 34 45 ? ? ? A . n A 1 35 LYS 35 46 ? ? ? A . n A 1 36 GLN 36 47 ? ? ? A . n A 1 37 LYS 37 48 ? ? ? A . n A 1 38 THR 38 49 ? ? ? A . n A 1 39 ARG 39 50 ? ? ? A . n A 1 40 ARG 40 51 ? ? ? A . n A 1 41 ASP 41 52 ? ? ? A . n A 1 42 ASN 42 53 ? ? ? A . n A 1 43 GLU 43 54 54 GLU GLU A . n A 1 44 VAL 44 55 55 VAL VAL A . n A 1 45 THR 45 56 56 THR THR A . n A 1 46 GLY 46 57 57 GLY GLY A . n A 1 47 LEU 47 58 58 LEU LEU A . n A 1 48 GLY 48 59 59 GLY GLY A . n A 1 49 LYS 49 60 60 LYS LYS A . n A 1 50 LEU 50 61 61 LEU LEU A . n A 1 51 VAL 51 62 62 VAL VAL A . n A 1 52 LYS 52 63 63 LYS LYS A . n A 1 53 SER 53 64 64 SER SER A . n A 1 54 SER 54 65 65 SER SER A . n A 1 55 ASP 55 66 66 ASP ASP A . n A 1 56 THR 56 67 67 THR THR A . n A 1 57 LEU 57 68 68 LEU LEU A . n A 1 58 SER 58 69 69 SER SER A . n A 1 59 LYS 59 70 70 LYS LYS A . n A 1 60 GLU 60 71 71 GLU GLU A . n A 1 61 GLN 61 72 72 GLN GLN A . n A 1 62 VAL 62 73 73 VAL VAL A . n A 1 63 LEU 63 74 74 LEU LEU A . n A 1 64 ASN 64 75 75 ASN ASN A . n A 1 65 ILE 65 76 76 ILE ILE A . n A 1 66 ARG 66 77 77 ARG ARG A . n A 1 67 ASP 67 78 78 ASP ASP A . n A 1 68 LEU 68 79 79 LEU LEU A . n A 1 69 THR 69 80 80 THR THR A . n A 1 70 ARG 70 81 81 ARG ARG A . n A 1 71 TYR 71 82 82 TYR TYR A . n A 1 72 ASP 72 83 83 ASP ASP A . n A 1 73 PRO 73 84 84 PRO PRO A . n A 1 74 GLY 74 85 85 GLY GLY A . n A 1 75 ILE 75 86 86 ILE ILE A . n A 1 76 ALA 76 87 87 ALA ALA A . n A 1 77 VAL 77 88 88 VAL VAL A . n A 1 78 VAL 78 89 89 VAL VAL A . n A 1 79 GLU 79 90 90 GLU GLU A . n A 1 80 GLN 80 91 91 GLN GLN A . n A 1 81 GLY 81 92 92 GLY GLY A . n A 1 82 ARG 82 93 93 ARG ARG A . n A 1 83 GLY 83 94 94 GLY GLY A . n A 1 84 ALA 84 95 95 ALA ALA A . n A 1 85 SER 85 96 96 SER SER A . n A 1 86 SER 86 97 97 SER SER A . n A 1 87 GLY 87 98 98 GLY GLY A . n A 1 88 TYR 88 99 99 TYR TYR A . n A 1 89 SER 89 100 100 SER SER A . n A 1 90 ILE 90 101 101 ILE ILE A . n A 1 91 ARG 91 102 102 ARG ARG A . n A 1 92 GLY 92 103 103 GLY GLY A . n A 1 93 MET 93 104 104 MET MET A . n A 1 94 ASP 94 105 105 ASP ASP A . n A 1 95 LYS 95 106 106 LYS LYS A . n A 1 96 ASN 96 107 107 ASN ASN A . n A 1 97 ARG 97 108 108 ARG ARG A . n A 1 98 VAL 98 109 109 VAL VAL A . n A 1 99 SER 99 110 110 SER SER A . n A 1 100 LEU 100 111 111 LEU LEU A . n A 1 101 THR 101 112 112 THR THR A . n A 1 102 VAL 102 113 113 VAL VAL A . n A 1 103 ASP 103 114 114 ASP ASP A . n A 1 104 GLY 104 115 115 GLY GLY A . n A 1 105 VAL 105 116 116 VAL VAL A . n A 1 106 SER 106 117 117 SER SER A . n A 1 107 GLN 107 118 118 GLN GLN A . n A 1 108 ILE 108 119 119 ILE ILE A . n A 1 109 GLN 109 120 120 GLN GLN A . n A 1 110 SER 110 121 121 SER SER A . n A 1 111 TYR 111 122 122 TYR TYR A . n A 1 112 THR 112 123 123 THR THR A . n A 1 113 ALA 113 124 124 ALA ALA A . n A 1 114 GLN 114 125 125 GLN GLN A . n A 1 115 ALA 115 126 126 ALA ALA A . n A 1 116 ALA 116 127 127 ALA ALA A . n A 1 117 LEU 117 128 128 LEU LEU A . n A 1 118 GLY 118 129 129 GLY GLY A . n A 1 119 GLY 119 130 130 GLY GLY A . n A 1 120 THR 120 131 131 THR THR A . n A 1 121 ARG 121 132 132 ARG ARG A . n A 1 122 THR 122 133 133 THR THR A . n A 1 123 ALA 123 134 134 ALA ALA A . n A 1 124 GLY 124 135 135 GLY GLY A . n A 1 125 SER 125 136 136 SER SER A . n A 1 126 SER 126 137 137 SER SER A . n A 1 127 GLY 127 138 138 GLY GLY A . n A 1 128 ALA 128 139 139 ALA ALA A . n A 1 129 ILE 129 140 140 ILE ILE A . n A 1 130 ASN 130 141 141 ASN ASN A . n A 1 131 GLU 131 142 142 GLU GLU A . n A 1 132 ILE 132 143 143 ILE ILE A . n A 1 133 GLU 133 144 144 GLU GLU A . n A 1 134 TYR 134 145 145 TYR TYR A . n A 1 135 GLU 135 146 146 GLU GLU A . n A 1 136 ASN 136 147 147 ASN ASN A . n A 1 137 VAL 137 148 148 VAL VAL A . n A 1 138 LYS 138 149 149 LYS LYS A . n A 1 139 ALA 139 150 150 ALA ALA A . n A 1 140 VAL 140 151 151 VAL VAL A . n A 1 141 GLU 141 152 152 GLU GLU A . n A 1 142 ILE 142 153 153 ILE ILE A . n A 1 143 SER 143 154 154 SER SER A . n A 1 144 LYS 144 155 155 LYS LYS A . n A 1 145 GLY 145 156 156 GLY GLY A . n A 1 146 SER 146 157 157 SER SER A . n A 1 147 ASN 147 158 158 ASN ASN A . n A 1 148 SER 148 159 159 SER SER A . n A 1 149 VAL 149 160 160 VAL VAL A . n A 1 150 GLU 150 161 161 GLU GLU A . n A 1 151 GLN 151 162 162 GLN GLN A . n A 1 152 GLY 152 163 163 GLY GLY A . n A 1 153 SER 153 164 164 SER SER A . n A 1 154 GLY 154 165 165 GLY GLY A . n A 1 155 ALA 155 166 166 ALA ALA A . n A 1 156 LEU 156 167 167 LEU LEU A . n A 1 157 ALA 157 168 168 ALA ALA A . n A 1 158 GLY 158 169 169 GLY GLY A . n A 1 159 SER 159 170 170 SER SER A . n A 1 160 VAL 160 171 171 VAL VAL A . n A 1 161 ALA 161 172 172 ALA ALA A . n A 1 162 PHE 162 173 173 PHE PHE A . n A 1 163 GLN 163 174 174 GLN GLN A . n A 1 164 THR 164 175 175 THR THR A . n A 1 165 LYS 165 176 176 LYS LYS A . n A 1 166 THR 166 177 177 THR THR A . n A 1 167 ALA 167 178 178 ALA ALA A . n A 1 168 ASP 168 179 179 ASP ASP A . n A 1 169 ASP 169 180 180 ASP ASP A . n A 1 170 VAL 170 181 181 VAL VAL A . n A 1 171 ILE 171 182 182 ILE ILE A . n A 1 172 GLY 172 183 183 GLY GLY A . n A 1 173 GLU 173 184 184 GLU GLU A . n A 1 174 GLY 174 185 185 GLY GLY A . n A 1 175 ARG 175 186 186 ARG ARG A . n A 1 176 GLN 176 187 187 GLN GLN A . n A 1 177 TRP 177 188 188 TRP TRP A . n A 1 178 GLY 178 189 189 GLY GLY A . n A 1 179 ILE 179 190 190 ILE ILE A . n A 1 180 GLN 180 191 191 GLN GLN A . n A 1 181 SER 181 192 192 SER SER A . n A 1 182 LYS 182 193 193 LYS LYS A . n A 1 183 THR 183 194 194 THR THR A . n A 1 184 ALA 184 195 195 ALA ALA A . n A 1 185 TYR 185 196 196 TYR TYR A . n A 1 186 SER 186 197 197 SER SER A . n A 1 187 GLY 187 198 198 GLY GLY A . n A 1 188 LYS 188 199 199 LYS LYS A . n A 1 189 ASN 189 200 200 ASN ASN A . n A 1 190 ARG 190 201 201 ARG ARG A . n A 1 191 GLY 191 202 202 GLY GLY A . n A 1 192 LEU 192 203 203 LEU LEU A . n A 1 193 THR 193 204 204 THR THR A . n A 1 194 GLN 194 205 205 GLN GLN A . n A 1 195 SER 195 206 206 SER SER A . n A 1 196 ILE 196 207 207 ILE ILE A . n A 1 197 ALA 197 208 208 ALA ALA A . n A 1 198 LEU 198 209 209 LEU LEU A . n A 1 199 ALA 199 210 210 ALA ALA A . n A 1 200 GLY 200 211 211 GLY GLY A . n A 1 201 ARG 201 212 212 ARG ARG A . n A 1 202 ILE 202 213 213 ILE ILE A . n A 1 203 GLY 203 214 214 GLY GLY A . n A 1 204 GLY 204 215 215 GLY GLY A . n A 1 205 ALA 205 216 216 ALA ALA A . n A 1 206 GLU 206 217 217 GLU GLU A . n A 1 207 ALA 207 218 218 ALA ALA A . n A 1 208 LEU 208 219 219 LEU LEU A . n A 1 209 LEU 209 220 220 LEU LEU A . n A 1 210 ILE 210 221 221 ILE ILE A . n A 1 211 HIS 211 222 222 HIS HIS A . n A 1 212 THR 212 223 223 THR THR A . n A 1 213 GLY 213 224 224 GLY GLY A . n A 1 214 ARG 214 225 225 ARG ARG A . n A 1 215 ARG 215 226 226 ARG ARG A . n A 1 216 ALA 216 227 227 ALA ALA A . n A 1 217 GLY 217 228 228 GLY GLY A . n A 1 218 GLU 218 229 229 GLU GLU A . n A 1 219 ILE 219 230 230 ILE ILE A . n A 1 220 ARG 220 231 231 ARG ARG A . n A 1 221 ALA 221 232 232 ALA ALA A . n A 1 222 HIS 222 233 233 HIS HIS A . n A 1 223 GLU 223 234 234 GLU GLU A . n A 1 224 ASP 224 235 235 ASP ASP A . n A 1 225 ALA 225 236 236 ALA ALA A . n A 1 226 GLY 226 237 237 GLY GLY A . n A 1 227 ARG 227 238 238 ARG ARG A . n A 1 228 GLY 228 239 239 GLY GLY A . n A 1 229 VAL 229 240 240 VAL VAL A . n A 1 230 GLN 230 241 241 GLN GLN A . n A 1 231 SER 231 242 242 SER SER A . n A 1 232 PHE 232 243 243 PHE PHE A . n A 1 233 ASN 233 244 244 ASN ASN A . n A 1 234 ARG 234 245 245 ARG ARG A . n A 1 235 LEU 235 246 246 LEU LEU A . n A 1 236 VAL 236 247 247 VAL VAL A . n A 1 237 PRO 237 248 248 PRO PRO A . n A 1 238 VAL 238 249 249 VAL VAL A . n A 1 239 GLU 239 250 250 GLU GLU A . n A 1 240 ASP 240 251 251 ASP ASP A . n A 1 241 SER 241 252 252 SER SER A . n A 1 242 SER 242 253 253 SER SER A . n A 1 243 ASN 243 254 254 ASN ASN A . n A 1 244 TYR 244 255 255 TYR TYR A . n A 1 245 ALA 245 256 256 ALA ALA A . n A 1 246 TYR 246 257 257 TYR TYR A . n A 1 247 PHE 247 258 258 PHE PHE A . n A 1 248 ILE 248 259 259 ILE ILE A . n A 1 249 VAL 249 260 260 VAL VAL A . n A 1 250 LYS 250 261 261 LYS LYS A . n A 1 251 GLU 251 262 262 GLU GLU A . n A 1 252 GLU 252 263 263 GLU GLU A . n A 1 253 CYS 253 264 264 CYS CYS A . n A 1 254 LYS 254 265 265 LYS LYS A . n A 1 255 ASN 255 266 266 ASN ASN A . n A 1 256 GLY 256 267 267 GLY GLY A . n A 1 257 SER 257 268 268 SER SER A . n A 1 258 TYR 258 269 269 TYR TYR A . n A 1 259 GLU 259 270 270 GLU GLU A . n A 1 260 THR 260 271 271 THR THR A . n A 1 261 CYS 261 272 272 CYS CYS A . n A 1 262 LYS 262 273 273 LYS LYS A . n A 1 263 ALA 263 274 274 ALA ALA A . n A 1 264 ASN 264 275 275 ASN ASN A . n A 1 265 PRO 265 276 276 PRO PRO A . n A 1 266 LYS 266 277 277 LYS LYS A . n A 1 267 LYS 267 278 278 LYS LYS A . n A 1 268 ASP 268 279 279 ASP ASP A . n A 1 269 VAL 269 280 280 VAL VAL A . n A 1 270 VAL 270 281 281 VAL VAL A . n A 1 271 GLY 271 282 282 GLY GLY A . n A 1 272 LYS 272 283 283 LYS LYS A . n A 1 273 ASP 273 284 284 ASP ASP A . n A 1 274 GLU 274 285 285 GLU GLU A . n A 1 275 ARG 275 286 286 ARG ARG A . n A 1 276 GLN 276 287 287 GLN GLN A . n A 1 277 THR 277 288 288 THR THR A . n A 1 278 VAL 278 289 289 VAL VAL A . n A 1 279 SER 279 290 290 SER SER A . n A 1 280 THR 280 291 291 THR THR A . n A 1 281 ARG 281 292 292 ARG ARG A . n A 1 282 ASP 282 293 293 ASP ASP A . n A 1 283 TYR 283 294 294 TYR TYR A . n A 1 284 THR 284 295 295 THR THR A . n A 1 285 GLY 285 296 296 GLY GLY A . n A 1 286 PRO 286 297 297 PRO PRO A . n A 1 287 ASN 287 298 298 ASN ASN A . n A 1 288 ARG 288 299 299 ARG ARG A . n A 1 289 PHE 289 300 300 PHE PHE A . n A 1 290 LEU 290 301 301 LEU LEU A . n A 1 291 ALA 291 302 302 ALA ALA A . n A 1 292 ASP 292 303 303 ASP ASP A . n A 1 293 PRO 293 304 304 PRO PRO A . n A 1 294 LEU 294 305 305 LEU LEU A . n A 1 295 SER 295 306 306 SER SER A . n A 1 296 TYR 296 307 307 TYR TYR A . n A 1 297 GLU 297 308 308 GLU GLU A . n A 1 298 SER 298 309 309 SER SER A . n A 1 299 ARG 299 310 310 ARG ARG A . n A 1 300 SER 300 311 311 SER SER A . n A 1 301 TRP 301 312 312 TRP TRP A . n A 1 302 LEU 302 313 313 LEU LEU A . n A 1 303 PHE 303 314 314 PHE PHE A . n A 1 304 ARG 304 315 315 ARG ARG A . n A 1 305 PRO 305 316 316 PRO PRO A . n A 1 306 GLY 306 317 317 GLY GLY A . n A 1 307 PHE 307 318 318 PHE PHE A . n A 1 308 ARG 308 319 319 ARG ARG A . n A 1 309 PHE 309 320 320 PHE PHE A . n A 1 310 GLU 310 321 321 GLU GLU A . n A 1 311 ASN 311 322 322 ASN ASN A . n A 1 312 LYS 312 323 323 LYS LYS A . n A 1 313 ARG 313 324 324 ARG ARG A . n A 1 314 HIS 314 325 325 HIS HIS A . n A 1 315 TYR 315 326 326 TYR TYR A . n A 1 316 ILE 316 327 327 ILE ILE A . n A 1 317 GLY 317 328 328 GLY GLY A . n A 1 318 GLY 318 329 329 GLY GLY A . n A 1 319 ILE 319 330 330 ILE ILE A . n A 1 320 LEU 320 331 331 LEU LEU A . n A 1 321 GLU 321 332 332 GLU GLU A . n A 1 322 HIS 322 333 333 HIS HIS A . n A 1 323 THR 323 334 334 THR THR A . n A 1 324 GLN 324 335 335 GLN GLN A . n A 1 325 GLN 325 336 336 GLN GLN A . n A 1 326 THR 326 337 337 THR THR A . n A 1 327 PHE 327 338 338 PHE PHE A . n A 1 328 ASP 328 339 339 ASP ASP A . n A 1 329 THR 329 340 340 THR THR A . n A 1 330 ARG 330 341 341 ARG ARG A . n A 1 331 ASP 331 342 342 ASP ASP A . n A 1 332 MET 332 343 343 MET MET A . n A 1 333 THR 333 344 344 THR THR A . n A 1 334 VAL 334 345 345 VAL VAL A . n A 1 335 PRO 335 346 346 PRO PRO A . n A 1 336 ALA 336 347 347 ALA ALA A . n A 1 337 PHE 337 348 348 PHE PHE A . n A 1 338 LEU 338 349 349 LEU LEU A . n A 1 339 THR 339 350 350 THR THR A . n A 1 340 LYS 340 351 351 LYS LYS A . n A 1 341 ALA 341 352 352 ALA ALA A . n A 1 342 VAL 342 353 353 VAL VAL A . n A 1 343 PHE 343 354 354 PHE PHE A . n A 1 344 ASP 344 355 355 ASP ASP A . n A 1 345 ALA 345 356 356 ALA ALA A . n A 1 346 ASN 346 357 357 ASN ASN A . n A 1 347 LYS 347 358 358 LYS LYS A . n A 1 348 LYS 348 359 359 LYS LYS A . n A 1 349 GLN 349 360 360 GLN GLN A . n A 1 350 ALA 350 361 361 ALA ALA A . n A 1 351 GLY 351 362 362 GLY GLY A . n A 1 352 SER 352 363 363 SER SER A . n A 1 353 LEU 353 364 364 LEU LEU A . n A 1 354 PRO 354 365 365 PRO PRO A . n A 1 355 GLY 355 366 366 GLY GLY A . n A 1 356 ASN 356 367 367 ASN ASN A . n A 1 357 GLY 357 368 368 GLY GLY A . n A 1 358 LYS 358 369 369 LYS LYS A . n A 1 359 TYR 359 370 370 TYR TYR A . n A 1 360 ALA 360 371 371 ALA ALA A . n A 1 361 GLY 361 372 372 GLY GLY A . n A 1 362 ASN 362 373 373 ASN ASN A . n A 1 363 HIS 363 374 374 HIS HIS A . n A 1 364 LYS 364 375 375 LYS LYS A . n A 1 365 TYR 365 376 376 TYR TYR A . n A 1 366 GLY 366 377 377 GLY GLY A . n A 1 367 GLY 367 378 378 GLY GLY A . n A 1 368 LEU 368 379 379 LEU LEU A . n A 1 369 PHE 369 380 380 PHE PHE A . n A 1 370 THR 370 381 381 THR THR A . n A 1 371 ASN 371 382 382 ASN ASN A . n A 1 372 GLY 372 383 383 GLY GLY A . n A 1 373 GLU 373 384 384 GLU GLU A . n A 1 374 ASN 374 385 385 ASN ASN A . n A 1 375 GLY 375 386 386 GLY GLY A . n A 1 376 ALA 376 387 387 ALA ALA A . n A 1 377 LEU 377 388 388 LEU LEU A . n A 1 378 VAL 378 389 389 VAL VAL A . n A 1 379 GLY 379 390 390 GLY GLY A . n A 1 380 ALA 380 391 391 ALA ALA A . n A 1 381 GLU 381 392 392 GLU GLU A . n A 1 382 TYR 382 393 393 TYR TYR A . n A 1 383 GLY 383 394 394 GLY GLY A . n A 1 384 THR 384 395 395 THR THR A . n A 1 385 GLY 385 396 396 GLY GLY A . n A 1 386 VAL 386 397 397 VAL VAL A . n A 1 387 PHE 387 398 398 PHE PHE A . n A 1 388 TYR 388 399 399 TYR TYR A . n A 1 389 ASP 389 400 400 ASP ASP A . n A 1 390 GLU 390 401 401 GLU GLU A . n A 1 391 THR 391 402 402 THR THR A . n A 1 392 HIS 392 403 403 HIS HIS A . n A 1 393 THR 393 404 404 THR THR A . n A 1 394 LYS 394 405 405 LYS LYS A . n A 1 395 SER 395 406 406 SER SER A . n A 1 396 ARG 396 407 407 ARG ARG A . n A 1 397 TYR 397 408 408 TYR TYR A . n A 1 398 GLY 398 409 409 GLY GLY A . n A 1 399 LEU 399 410 410 LEU LEU A . n A 1 400 GLU 400 411 411 GLU GLU A . n A 1 401 TYR 401 412 412 TYR TYR A . n A 1 402 VAL 402 413 413 VAL VAL A . n A 1 403 TYR 403 414 414 TYR TYR A . n A 1 404 THR 404 415 415 THR THR A . n A 1 405 ASN 405 416 416 ASN ASN A . n A 1 406 ALA 406 417 417 ALA ALA A . n A 1 407 ASP 407 418 418 ASP ASP A . n A 1 408 LYS 408 419 419 LYS LYS A . n A 1 409 ASP 409 420 420 ASP ASP A . n A 1 410 THR 410 421 421 THR THR A . n A 1 411 TRP 411 422 422 TRP TRP A . n A 1 412 ALA 412 423 423 ALA ALA A . n A 1 413 ASP 413 424 424 ASP ASP A . n A 1 414 TYR 414 425 425 TYR TYR A . n A 1 415 ALA 415 426 426 ALA ALA A . n A 1 416 ARG 416 427 427 ARG ARG A . n A 1 417 LEU 417 428 428 LEU LEU A . n A 1 418 SER 418 429 429 SER SER A . n A 1 419 TYR 419 430 430 TYR TYR A . n A 1 420 ASP 420 431 431 ASP ASP A . n A 1 421 ARG 421 432 432 ARG ARG A . n A 1 422 GLN 422 433 433 GLN GLN A . n A 1 423 GLY 423 434 434 GLY GLY A . n A 1 424 VAL 424 435 435 VAL VAL A . n A 1 425 GLY 425 436 436 GLY GLY A . n A 1 426 LEU 426 437 437 LEU LEU A . n A 1 427 ASP 427 438 438 ASP ASP A . n A 1 428 ASN 428 439 439 ASN ASN A . n A 1 429 HIS 429 440 440 HIS HIS A . n A 1 430 PHE 430 441 441 PHE PHE A . n A 1 431 GLN 431 442 442 GLN GLN A . n A 1 432 GLN 432 443 443 GLN GLN A . n A 1 433 THR 433 444 444 THR THR A . n A 1 434 HIS 434 445 445 HIS HIS A . n A 1 435 CYS 435 446 446 CYS CYS A . n A 1 436 SER 436 447 447 SER SER A . n A 1 437 ALA 437 448 448 ALA ALA A . n A 1 438 ASP 438 449 449 ASP ASP A . n A 1 439 GLY 439 450 450 GLY GLY A . n A 1 440 SER 440 451 451 SER SER A . n A 1 441 ASP 441 452 452 ASP ASP A . n A 1 442 LYS 442 453 453 LYS LYS A . n A 1 443 TYR 443 454 454 TYR TYR A . n A 1 444 CYS 444 455 455 CYS CYS A . n A 1 445 ARG 445 456 456 ARG ARG A . n A 1 446 PRO 446 457 457 PRO PRO A . n A 1 447 SER 447 458 458 SER SER A . n A 1 448 ALA 448 459 459 ALA ALA A . n A 1 449 ASP 449 460 460 ASP ASP A . n A 1 450 LYS 450 461 461 LYS LYS A . n A 1 451 PRO 451 462 462 PRO PRO A . n A 1 452 PHE 452 463 463 PHE PHE A . n A 1 453 SER 453 464 464 SER SER A . n A 1 454 TYR 454 465 465 TYR TYR A . n A 1 455 TYR 455 466 466 TYR TYR A . n A 1 456 LYS 456 467 467 LYS LYS A . n A 1 457 SER 457 468 468 SER SER A . n A 1 458 ASP 458 469 469 ASP ASP A . n A 1 459 ARG 459 470 470 ARG ARG A . n A 1 460 VAL 460 471 471 VAL VAL A . n A 1 461 ILE 461 472 472 ILE ILE A . n A 1 462 TYR 462 473 473 TYR TYR A . n A 1 463 GLY 463 474 474 GLY GLY A . n A 1 464 GLU 464 475 475 GLU GLU A . n A 1 465 SER 465 476 476 SER SER A . n A 1 466 HIS 466 477 477 HIS HIS A . n A 1 467 ARG 467 478 478 ARG ARG A . n A 1 468 LEU 468 479 479 LEU LEU A . n A 1 469 LEU 469 480 480 LEU LEU A . n A 1 470 GLN 470 481 481 GLN GLN A . n A 1 471 ALA 471 482 482 ALA ALA A . n A 1 472 ALA 472 483 483 ALA ALA A . n A 1 473 PHE 473 484 484 PHE PHE A . n A 1 474 LYS 474 485 485 LYS LYS A . n A 1 475 LYS 475 486 486 LYS LYS A . n A 1 476 SER 476 487 487 SER SER A . n A 1 477 PHE 477 488 488 PHE PHE A . n A 1 478 ASP 478 489 489 ASP ASP A . n A 1 479 THR 479 490 ? ? ? A . n A 1 480 ALA 480 491 ? ? ? A . n A 1 481 LYS 481 492 492 LYS LYS A . n A 1 482 ILE 482 493 493 ILE ILE A . n A 1 483 ARG 483 494 494 ARG ARG A . n A 1 484 HIS 484 495 495 HIS HIS A . n A 1 485 ASN 485 496 496 ASN ASN A . n A 1 486 LEU 486 497 497 LEU LEU A . n A 1 487 SER 487 498 498 SER SER A . n A 1 488 VAL 488 499 499 VAL VAL A . n A 1 489 ASN 489 500 500 ASN ASN A . n A 1 490 LEU 490 501 501 LEU LEU A . n A 1 491 GLY 491 502 502 GLY GLY A . n A 1 492 PHE 492 503 503 PHE PHE A . n A 1 493 ASP 493 504 504 ASP ASP A . n A 1 494 ARG 494 505 505 ARG ARG A . n A 1 495 PHE 495 506 506 PHE PHE A . n A 1 496 GLY 496 507 507 GLY GLY A . n A 1 497 SER 497 508 508 SER SER A . n A 1 498 ASN 498 509 509 ASN ASN A . n A 1 499 LEU 499 510 510 LEU LEU A . n A 1 500 ARG 500 511 511 ARG ARG A . n A 1 501 HIS 501 512 512 HIS HIS A . n A 1 502 GLN 502 513 513 GLN GLN A . n A 1 503 ASP 503 514 514 ASP ASP A . n A 1 504 TYR 504 515 515 TYR TYR A . n A 1 505 TYR 505 516 516 TYR TYR A . n A 1 506 TYR 506 517 517 TYR TYR A . n A 1 507 GLN 507 518 518 GLN GLN A . n A 1 508 HIS 508 519 519 HIS HIS A . n A 1 509 ALA 509 520 520 ALA ALA A . n A 1 510 ASN 510 521 521 ASN ASN A . n A 1 511 ARG 511 522 522 ARG ARG A . n A 1 512 ALA 512 523 523 ALA ALA A . n A 1 513 TYR 513 524 524 TYR TYR A . n A 1 514 SER 514 525 525 SER SER A . n A 1 515 SER 515 526 526 SER SER A . n A 1 516 ASN 516 527 527 ASN ASN A . n A 1 517 THR 517 528 528 THR THR A . n A 1 518 PRO 518 529 529 PRO PRO A . n A 1 519 PRO 519 530 530 PRO PRO A . n A 1 520 GLN 520 531 531 GLN GLN A . n A 1 521 ASN 521 532 532 ASN ASN A . n A 1 522 ASN 522 533 533 ASN ASN A . n A 1 523 GLY 523 534 534 GLY GLY A . n A 1 524 LYS 524 535 535 LYS LYS A . n A 1 525 LYS 525 536 536 LYS LYS A . n A 1 526 ILE 526 537 537 ILE ILE A . n A 1 527 SER 527 538 538 SER SER A . n A 1 528 PRO 528 539 539 PRO PRO A . n A 1 529 ASN 529 540 540 ASN ASN A . n A 1 530 GLY 530 541 541 GLY GLY A . n A 1 531 SER 531 542 542 SER SER A . n A 1 532 GLU 532 543 543 GLU GLU A . n A 1 533 THR 533 544 544 THR THR A . n A 1 534 SER 534 545 545 SER SER A . n A 1 535 PRO 535 546 546 PRO PRO A . n A 1 536 TYR 536 547 547 TYR TYR A . n A 1 537 TRP 537 548 548 TRP TRP A . n A 1 538 VAL 538 549 549 VAL VAL A . n A 1 539 THR 539 550 550 THR THR A . n A 1 540 ILE 540 551 551 ILE ILE A . n A 1 541 GLY 541 552 552 GLY GLY A . n A 1 542 ARG 542 553 553 ARG ARG A . n A 1 543 GLY 543 554 554 GLY GLY A . n A 1 544 ASN 544 555 555 ASN ASN A . n A 1 545 VAL 545 556 556 VAL VAL A . n A 1 546 VAL 546 557 557 VAL VAL A . n A 1 547 THR 547 558 558 THR THR A . n A 1 548 GLY 548 559 559 GLY GLY A . n A 1 549 GLN 549 560 560 GLN GLN A . n A 1 550 ILE 550 561 561 ILE ILE A . n A 1 551 CYS 551 562 562 CYS CYS A . n A 1 552 ARG 552 563 563 ARG ARG A . n A 1 553 LEU 553 564 564 LEU LEU A . n A 1 554 GLY 554 565 565 GLY GLY A . n A 1 555 ASN 555 566 566 ASN ASN A . n A 1 556 ASN 556 567 567 ASN ASN A . n A 1 557 THR 557 568 568 THR THR A . n A 1 558 TYR 558 569 569 TYR TYR A . n A 1 559 THR 559 570 570 THR THR A . n A 1 560 ASP 560 571 571 ASP ASP A . n A 1 561 CYS 561 572 572 CYS CYS A . n A 1 562 THR 562 573 573 THR THR A . n A 1 563 PRO 563 574 574 PRO PRO A . n A 1 564 ARG 564 575 575 ARG ARG A . n A 1 565 SER 565 576 576 SER SER A . n A 1 566 ILE 566 577 577 ILE ILE A . n A 1 567 ASN 567 578 578 ASN ASN A . n A 1 568 GLY 568 579 579 GLY GLY A . n A 1 569 LYS 569 580 580 LYS LYS A . n A 1 570 SER 570 581 581 SER SER A . n A 1 571 TYR 571 582 582 TYR TYR A . n A 1 572 TYR 572 583 583 TYR TYR A . n A 1 573 ALA 573 584 584 ALA ALA A . n A 1 574 ALA 574 585 585 ALA ALA A . n A 1 575 VAL 575 586 586 VAL VAL A . n A 1 576 ARG 576 587 587 ARG ARG A . n A 1 577 ASP 577 588 588 ASP ASP A . n A 1 578 ASN 578 589 589 ASN ASN A . n A 1 579 VAL 579 590 590 VAL VAL A . n A 1 580 ARG 580 591 591 ARG ARG A . n A 1 581 LEU 581 592 592 LEU LEU A . n A 1 582 GLY 582 593 593 GLY GLY A . n A 1 583 ARG 583 594 594 ARG ARG A . n A 1 584 TRP 584 595 595 TRP TRP A . n A 1 585 ALA 585 596 596 ALA ALA A . n A 1 586 ASP 586 597 597 ASP ASP A . n A 1 587 VAL 587 598 598 VAL VAL A . n A 1 588 GLY 588 599 599 GLY GLY A . n A 1 589 ALA 589 600 600 ALA ALA A . n A 1 590 GLY 590 601 601 GLY GLY A . n A 1 591 LEU 591 602 602 LEU LEU A . n A 1 592 ARG 592 603 603 ARG ARG A . n A 1 593 TYR 593 604 604 TYR TYR A . n A 1 594 ASP 594 605 605 ASP ASP A . n A 1 595 TYR 595 606 606 TYR TYR A . n A 1 596 ARG 596 607 607 ARG ARG A . n A 1 597 SER 597 608 608 SER SER A . n A 1 598 THR 598 609 609 THR THR A . n A 1 599 HIS 599 610 610 HIS HIS A . n A 1 600 SER 600 611 611 SER SER A . n A 1 601 ASP 601 612 612 ASP ASP A . n A 1 602 ASP 602 613 613 ASP ASP A . n A 1 603 GLY 603 614 614 GLY GLY A . n A 1 604 SER 604 615 615 SER SER A . n A 1 605 VAL 605 616 616 VAL VAL A . n A 1 606 SER 606 617 617 SER SER A . n A 1 607 THR 607 618 618 THR THR A . n A 1 608 GLY 608 619 619 GLY GLY A . n A 1 609 THR 609 620 620 THR THR A . n A 1 610 HIS 610 621 621 HIS HIS A . n A 1 611 ARG 611 622 622 ARG ARG A . n A 1 612 THR 612 623 623 THR THR A . n A 1 613 LEU 613 624 624 LEU LEU A . n A 1 614 SER 614 625 625 SER SER A . n A 1 615 TRP 615 626 626 TRP TRP A . n A 1 616 ASN 616 627 627 ASN ASN A . n A 1 617 ALA 617 628 628 ALA ALA A . n A 1 618 GLY 618 629 629 GLY GLY A . n A 1 619 ILE 619 630 630 ILE ILE A . n A 1 620 VAL 620 631 631 VAL VAL A . n A 1 621 LEU 621 632 632 LEU LEU A . n A 1 622 LYS 622 633 633 LYS LYS A . n A 1 623 PRO 623 634 634 PRO PRO A . n A 1 624 THR 624 635 635 THR THR A . n A 1 625 ASP 625 636 636 ASP ASP A . n A 1 626 TRP 626 637 637 TRP TRP A . n A 1 627 LEU 627 638 638 LEU LEU A . n A 1 628 ASP 628 639 639 ASP ASP A . n A 1 629 LEU 629 640 640 LEU LEU A . n A 1 630 THR 630 641 641 THR THR A . n A 1 631 TYR 631 642 642 TYR TYR A . n A 1 632 ARG 632 643 643 ARG ARG A . n A 1 633 THR 633 644 644 THR THR A . n A 1 634 SER 634 645 645 SER SER A . n A 1 635 THR 635 646 646 THR THR A . n A 1 636 GLY 636 647 647 GLY GLY A . n A 1 637 PHE 637 648 648 PHE PHE A . n A 1 638 ARG 638 649 649 ARG ARG A . n A 1 639 LEU 639 650 650 LEU LEU A . n A 1 640 PRO 640 651 651 PRO PRO A . n A 1 641 SER 641 652 652 SER SER A . n A 1 642 PHE 642 653 653 PHE PHE A . n A 1 643 ALA 643 654 654 ALA ALA A . n A 1 644 GLU 644 655 655 GLU GLU A . n A 1 645 MET 645 656 656 MET MET A . n A 1 646 TYR 646 657 657 TYR TYR A . n A 1 647 GLY 647 658 658 GLY GLY A . n A 1 648 TRP 648 659 659 TRP TRP A . n A 1 649 ARG 649 660 660 ARG ARG A . n A 1 650 ALA 650 661 661 ALA ALA A . n A 1 651 GLY 651 662 662 GLY GLY A . n A 1 652 VAL 652 663 663 VAL VAL A . n A 1 653 GLN 653 664 664 GLN GLN A . n A 1 654 SER 654 665 665 SER SER A . n A 1 655 LYS 655 666 666 LYS LYS A . n A 1 656 ALA 656 667 667 ALA ALA A . n A 1 657 VAL 657 668 668 VAL VAL A . n A 1 658 LYS 658 669 669 LYS LYS A . n A 1 659 ILE 659 670 670 ILE ILE A . n A 1 660 ASP 660 671 671 ASP ASP A . n A 1 661 PRO 661 672 672 PRO PRO A . n A 1 662 GLU 662 673 673 GLU GLU A . n A 1 663 LYS 663 674 674 LYS LYS A . n A 1 664 SER 664 675 675 SER SER A . n A 1 665 PHE 665 676 676 PHE PHE A . n A 1 666 ASN 666 677 677 ASN ASN A . n A 1 667 LYS 667 678 678 LYS LYS A . n A 1 668 GLU 668 679 679 GLU GLU A . n A 1 669 ALA 669 680 680 ALA ALA A . n A 1 670 GLY 670 681 681 GLY GLY A . n A 1 671 ILE 671 682 682 ILE ILE A . n A 1 672 VAL 672 683 683 VAL VAL A . n A 1 673 PHE 673 684 684 PHE PHE A . n A 1 674 LYS 674 685 685 LYS LYS A . n A 1 675 GLY 675 686 686 GLY GLY A . n A 1 676 ASP 676 687 687 ASP ASP A . n A 1 677 PHE 677 688 688 PHE PHE A . n A 1 678 GLY 678 689 689 GLY GLY A . n A 1 679 ASN 679 690 690 ASN ASN A . n A 1 680 LEU 680 691 691 LEU LEU A . n A 1 681 GLU 681 692 692 GLU GLU A . n A 1 682 ALA 682 693 693 ALA ALA A . n A 1 683 SER 683 694 694 SER SER A . n A 1 684 TRP 684 695 695 TRP TRP A . n A 1 685 PHE 685 696 696 PHE PHE A . n A 1 686 ASN 686 697 697 ASN ASN A . n A 1 687 ASN 687 698 698 ASN ASN A . n A 1 688 ALA 688 699 699 ALA ALA A . n A 1 689 TYR 689 700 700 TYR TYR A . n A 1 690 ARG 690 701 701 ARG ARG A . n A 1 691 ASP 691 702 702 ASP ASP A . n A 1 692 LEU 692 703 703 LEU LEU A . n A 1 693 ILE 693 704 704 ILE ILE A . n A 1 694 VAL 694 705 705 VAL VAL A . n A 1 695 ARG 695 706 706 ARG ARG A . n A 1 696 GLY 696 707 707 GLY GLY A . n A 1 697 TYR 697 708 708 TYR TYR A . n A 1 698 GLU 698 709 709 GLU GLU A . n A 1 699 ALA 699 710 710 ALA ALA A . n A 1 700 GLN 700 711 711 GLN GLN A . n A 1 701 ILE 701 712 712 ILE ILE A . n A 1 702 LYS 702 713 713 LYS LYS A . n A 1 703 ASP 703 714 714 ASP ASP A . n A 1 704 GLY 704 715 715 GLY GLY A . n A 1 705 LYS 705 716 716 LYS LYS A . n A 1 706 GLU 706 717 717 GLU GLU A . n A 1 707 GLU 707 718 718 GLU GLU A . n A 1 708 ALA 708 719 719 ALA ALA A . n A 1 709 LYS 709 720 720 LYS LYS A . n A 1 710 GLY 710 721 721 GLY GLY A . n A 1 711 ASP 711 722 722 ASP ASP A . n A 1 712 PRO 712 723 723 PRO PRO A . n A 1 713 ALA 713 724 724 ALA ALA A . n A 1 714 TYR 714 725 725 TYR TYR A . n A 1 715 LEU 715 726 726 LEU LEU A . n A 1 716 ASN 716 727 727 ASN ASN A . n A 1 717 ALA 717 728 728 ALA ALA A . n A 1 718 GLN 718 729 729 GLN GLN A . n A 1 719 SER 719 730 730 SER SER A . n A 1 720 ALA 720 731 731 ALA ALA A . n A 1 721 ARG 721 732 732 ARG ARG A . n A 1 722 ILE 722 733 733 ILE ILE A . n A 1 723 THR 723 734 734 THR THR A . n A 1 724 GLY 724 735 735 GLY GLY A . n A 1 725 ILE 725 736 736 ILE ILE A . n A 1 726 ASN 726 737 737 ASN ASN A . n A 1 727 ILE 727 738 738 ILE ILE A . n A 1 728 LEU 728 739 739 LEU LEU A . n A 1 729 GLY 729 740 740 GLY GLY A . n A 1 730 LYS 730 741 741 LYS LYS A . n A 1 731 ILE 731 742 742 ILE ILE A . n A 1 732 ASP 732 743 743 ASP ASP A . n A 1 733 TRP 733 744 744 TRP TRP A . n A 1 734 ASN 734 745 745 ASN ASN A . n A 1 735 GLY 735 746 746 GLY GLY A . n A 1 736 VAL 736 747 747 VAL VAL A . n A 1 737 TRP 737 748 ? ? ? A . n A 1 738 ASP 738 749 ? ? ? A . n A 1 739 LYS 739 750 ? ? ? A . n A 1 740 LEU 740 751 ? ? ? A . n A 1 741 PRO 741 752 ? ? ? A . n A 1 742 GLU 742 753 ? ? ? A . n A 1 743 GLY 743 754 ? ? ? A . n A 1 744 TRP 744 755 755 TRP TRP A . n A 1 745 TYR 745 756 756 TYR TYR A . n A 1 746 SER 746 757 757 SER SER A . n A 1 747 THR 747 758 758 THR THR A . n A 1 748 PHE 748 759 759 PHE PHE A . n A 1 749 ALA 749 760 760 ALA ALA A . n A 1 750 TYR 750 761 761 TYR TYR A . n A 1 751 ASN 751 762 762 ASN ASN A . n A 1 752 ARG 752 763 763 ARG ARG A . n A 1 753 VAL 753 764 764 VAL VAL A . n A 1 754 ARG 754 765 765 ARG ARG A . n A 1 755 VAL 755 766 766 VAL VAL A . n A 1 756 ARG 756 767 767 ARG ARG A . n A 1 757 ASP 757 768 768 ASP ASP A . n A 1 758 ILE 758 769 769 ILE ILE A . n A 1 759 LYS 759 770 770 LYS LYS A . n A 1 760 LYS 760 771 771 LYS LYS A . n A 1 761 ARG 761 772 772 ARG ARG A . n A 1 762 ALA 762 773 773 ALA ALA A . n A 1 763 ASP 763 774 774 ASP ASP A . n A 1 764 ARG 764 775 775 ARG ARG A . n A 1 765 THR 765 776 776 THR THR A . n A 1 766 ASP 766 777 777 ASP ASP A . n A 1 767 ILE 767 778 778 ILE ILE A . n A 1 768 GLN 768 779 779 GLN GLN A . n A 1 769 SER 769 780 780 SER SER A . n A 1 770 HIS 770 781 781 HIS HIS A . n A 1 771 LEU 771 782 782 LEU LEU A . n A 1 772 PHE 772 783 783 PHE PHE A . n A 1 773 ASP 773 784 784 ASP ASP A . n A 1 774 ALA 774 785 785 ALA ALA A . n A 1 775 ILE 775 786 786 ILE ILE A . n A 1 776 GLN 776 787 787 GLN GLN A . n A 1 777 PRO 777 788 788 PRO PRO A . n A 1 778 SER 778 789 789 SER SER A . n A 1 779 ARG 779 790 790 ARG ARG A . n A 1 780 TYR 780 791 791 TYR TYR A . n A 1 781 VAL 781 792 792 VAL VAL A . n A 1 782 VAL 782 793 793 VAL VAL A . n A 1 783 GLY 783 794 794 GLY GLY A . n A 1 784 LEU 784 795 795 LEU LEU A . n A 1 785 GLY 785 796 796 GLY GLY A . n A 1 786 TYR 786 797 797 TYR TYR A . n A 1 787 ASP 787 798 798 ASP ASP A . n A 1 788 GLN 788 799 799 GLN GLN A . n A 1 789 PRO 789 800 800 PRO PRO A . n A 1 790 GLU 790 801 801 GLU GLU A . n A 1 791 GLY 791 802 802 GLY GLY A . n A 1 792 LYS 792 803 803 LYS LYS A . n A 1 793 TRP 793 804 804 TRP TRP A . n A 1 794 GLY 794 805 805 GLY GLY A . n A 1 795 VAL 795 806 806 VAL VAL A . n A 1 796 ASN 796 807 807 ASN ASN A . n A 1 797 GLY 797 808 808 GLY GLY A . n A 1 798 MET 798 809 809 MET MET A . n A 1 799 LEU 799 810 810 LEU LEU A . n A 1 800 THR 800 811 811 THR THR A . n A 1 801 TYR 801 812 812 TYR TYR A . n A 1 802 SER 802 813 813 SER SER A . n A 1 803 LYS 803 814 814 LYS LYS A . n A 1 804 ALA 804 815 815 ALA ALA A . n A 1 805 LYS 805 816 816 LYS LYS A . n A 1 806 GLU 806 817 817 GLU GLU A . n A 1 807 ILE 807 818 818 ILE ILE A . n A 1 808 THR 808 819 819 THR THR A . n A 1 809 GLU 809 820 820 GLU GLU A . n A 1 810 LEU 810 821 821 LEU LEU A . n A 1 811 LEU 811 822 822 LEU LEU A . n A 1 812 GLY 812 823 823 GLY GLY A . n A 1 813 SER 813 824 824 SER SER A . n A 1 814 ARG 814 825 825 ARG ARG A . n A 1 815 ALA 815 826 826 ALA ALA A . n A 1 816 LEU 816 827 827 LEU LEU A . n A 1 817 LEU 817 828 828 LEU LEU A . n A 1 818 ASN 818 829 829 ASN ASN A . n A 1 819 GLY 819 830 830 GLY GLY A . n A 1 820 ASN 820 831 831 ASN ASN A . n A 1 821 SER 821 832 832 SER SER A . n A 1 822 ARG 822 833 833 ARG ARG A . n A 1 823 ASN 823 834 834 ASN ASN A . n A 1 824 THR 824 835 835 THR THR A . n A 1 825 LYS 825 836 836 LYS LYS A . n A 1 826 ALA 826 837 837 ALA ALA A . n A 1 827 THR 827 838 838 THR THR A . n A 1 828 ALA 828 839 839 ALA ALA A . n A 1 829 ARG 829 840 840 ARG ARG A . n A 1 830 ARG 830 841 841 ARG ARG A . n A 1 831 THR 831 842 842 THR THR A . n A 1 832 ARG 832 843 843 ARG ARG A . n A 1 833 PRO 833 844 844 PRO PRO A . n A 1 834 TRP 834 845 845 TRP TRP A . n A 1 835 TYR 835 846 846 TYR TYR A . n A 1 836 ILE 836 847 847 ILE ILE A . n A 1 837 VAL 837 848 848 VAL VAL A . n A 1 838 ASP 838 849 849 ASP ASP A . n A 1 839 VAL 839 850 850 VAL VAL A . n A 1 840 SER 840 851 851 SER SER A . n A 1 841 GLY 841 852 852 GLY GLY A . n A 1 842 TYR 842 853 853 TYR TYR A . n A 1 843 TYR 843 854 854 TYR TYR A . n A 1 844 THR 844 855 855 THR THR A . n A 1 845 VAL 845 856 856 VAL VAL A . n A 1 846 LYS 846 857 857 LYS LYS A . n A 1 847 LYS 847 858 858 LYS LYS A . n A 1 848 HIS 848 859 859 HIS HIS A . n A 1 849 PHE 849 860 860 PHE PHE A . n A 1 850 THR 850 861 861 THR THR A . n A 1 851 LEU 851 862 862 LEU LEU A . n A 1 852 ARG 852 863 863 ARG ARG A . n A 1 853 ALA 853 864 864 ALA ALA A . n A 1 854 GLY 854 865 865 GLY GLY A . n A 1 855 VAL 855 866 866 VAL VAL A . n A 1 856 TYR 856 867 867 TYR TYR A . n A 1 857 ASN 857 868 868 ASN ASN A . n A 1 858 LEU 858 869 869 LEU LEU A . n A 1 859 LEU 859 870 870 LEU LEU A . n A 1 860 ASN 860 871 871 ASN ASN A . n A 1 861 TYR 861 872 872 TYR TYR A . n A 1 862 ARG 862 873 873 ARG ARG A . n A 1 863 TYR 863 874 874 TYR TYR A . n A 1 864 VAL 864 875 875 VAL VAL A . n A 1 865 THR 865 876 876 THR THR A . n A 1 866 TRP 866 877 877 TRP TRP A . n A 1 867 GLU 867 878 878 GLU GLU A . n A 1 868 ASN 868 879 879 ASN ASN A . n A 1 869 VAL 869 880 880 VAL VAL A . n A 1 870 ARG 870 881 881 ARG ARG A . n A 1 871 GLN 871 882 882 GLN GLN A . n A 1 872 THR 872 883 883 THR THR A . n A 1 873 ALA 873 884 884 ALA ALA A . n A 1 874 GLY 874 885 885 GLY GLY A . n A 1 875 GLY 875 886 886 GLY GLY A . n A 1 876 ALA 876 887 887 ALA ALA A . n A 1 877 VAL 877 888 888 VAL VAL A . n A 1 878 ASN 878 889 889 ASN ASN A . n A 1 879 GLN 879 890 890 GLN GLN A . n A 1 880 HIS 880 891 891 HIS HIS A . n A 1 881 LYS 881 892 892 LYS LYS A . n A 1 882 ASN 882 893 893 ASN ASN A . n A 1 883 VAL 883 894 894 VAL VAL A . n A 1 884 GLY 884 895 895 GLY GLY A . n A 1 885 VAL 885 896 896 VAL VAL A . n A 1 886 TYR 886 897 897 TYR TYR A . n A 1 887 ASN 887 898 898 ASN ASN A . n A 1 888 ARG 888 899 899 ARG ARG A . n A 1 889 TYR 889 900 900 TYR TYR A . n A 1 890 ALA 890 901 901 ALA ALA A . n A 1 891 ALA 891 902 902 ALA ALA A . n A 1 892 PRO 892 903 903 PRO PRO A . n A 1 893 GLY 893 904 904 GLY GLY A . n A 1 894 ARG 894 905 905 ARG ARG A . n A 1 895 ASN 895 906 906 ASN ASN A . n A 1 896 TYR 896 907 907 TYR TYR A . n A 1 897 THR 897 908 908 THR THR A . n A 1 898 PHE 898 909 909 PHE PHE A . n A 1 899 SER 899 910 910 SER SER A . n A 1 900 LEU 900 911 911 LEU LEU A . n A 1 901 GLU 901 912 912 GLU GLU A . n A 1 902 TYR 902 913 913 TYR TYR A . n A 1 903 LYS 903 914 914 LYS LYS A . n A 1 904 PHE 904 915 915 PHE PHE A . n B 2 1 MET 1 -18 ? ? ? B . n B 2 2 ARG 2 -17 ? ? ? B . n B 2 3 LEU 3 -16 ? ? ? B . n B 2 4 ALA 4 -15 ? ? ? B . n B 2 5 VAL 5 -14 ? ? ? B . n B 2 6 GLY 6 -13 ? ? ? B . n B 2 7 ALA 7 -12 ? ? ? B . n B 2 8 LEU 8 -11 ? ? ? B . n B 2 9 LEU 9 -10 ? ? ? B . n B 2 10 VAL 10 -9 ? ? ? B . n B 2 11 CYS 11 -8 ? ? ? B . n B 2 12 ALA 12 -7 ? ? ? B . n B 2 13 VAL 13 -6 ? ? ? B . n B 2 14 LEU 14 -5 ? ? ? B . n B 2 15 GLY 15 -4 ? ? ? B . n B 2 16 LEU 16 -3 ? ? ? B . n B 2 17 CYS 17 -2 ? ? ? B . n B 2 18 LEU 18 -1 ? ? ? B . n B 2 19 ALA 19 0 ? ? ? B . n B 2 20 VAL 20 1 ? ? ? B . n B 2 21 PRO 21 2 ? ? ? B . n B 2 22 ASP 22 3 ? ? ? B . n B 2 23 LYS 23 4 4 LYS LYS B . n B 2 24 THR 24 5 5 THR THR B . n B 2 25 VAL 25 6 6 VAL VAL B . n B 2 26 ARG 26 7 7 ARG ARG B . n B 2 27 TRP 27 8 8 TRP TRP B . n B 2 28 CYS 28 9 9 CYS CYS B . n B 2 29 ALA 29 10 10 ALA ALA B . n B 2 30 VAL 30 11 11 VAL VAL B . n B 2 31 SER 31 12 12 SER SER B . n B 2 32 GLU 32 13 13 GLU GLU B . n B 2 33 HIS 33 14 14 HIS HIS B . n B 2 34 GLU 34 15 15 GLU GLU B . n B 2 35 ALA 35 16 16 ALA ALA B . n B 2 36 THR 36 17 17 THR THR B . n B 2 37 LYS 37 18 18 LYS LYS B . n B 2 38 CYS 38 19 19 CYS CYS B . n B 2 39 GLN 39 20 20 GLN GLN B . n B 2 40 SER 40 21 21 SER SER B . n B 2 41 PHE 41 22 22 PHE PHE B . n B 2 42 ARG 42 23 23 ARG ARG B . n B 2 43 ASP 43 24 24 ASP ASP B . n B 2 44 HIS 44 25 25 HIS HIS B . n B 2 45 MET 45 26 26 MET MET B . n B 2 46 LYS 46 27 27 LYS LYS B . n B 2 47 SER 47 28 28 SER SER B . n B 2 48 VAL 48 29 29 VAL VAL B . n B 2 49 ILE 49 30 30 ILE ILE B . n B 2 50 PRO 50 31 31 PRO PRO B . n B 2 51 SER 51 32 32 SER SER B . n B 2 52 ASP 52 33 33 ASP ASP B . n B 2 53 GLY 53 34 34 GLY GLY B . n B 2 54 PRO 54 35 35 PRO PRO B . n B 2 55 SER 55 36 36 SER SER B . n B 2 56 VAL 56 37 37 VAL VAL B . n B 2 57 ALA 57 38 38 ALA ALA B . n B 2 58 CYS 58 39 39 CYS CYS B . n B 2 59 VAL 59 40 40 VAL VAL B . n B 2 60 LYS 60 41 41 LYS LYS B . n B 2 61 LYS 61 42 42 LYS LYS B . n B 2 62 ALA 62 43 43 ALA ALA B . n B 2 63 SER 63 44 44 SER SER B . n B 2 64 TYR 64 45 45 TYR TYR B . n B 2 65 LEU 65 46 46 LEU LEU B . n B 2 66 ASP 66 47 47 ASP ASP B . n B 2 67 CYS 67 48 48 CYS CYS B . n B 2 68 ILE 68 49 49 ILE ILE B . n B 2 69 ARG 69 50 50 ARG ARG B . n B 2 70 ALA 70 51 51 ALA ALA B . n B 2 71 ILE 71 52 52 ILE ILE B . n B 2 72 ALA 72 53 53 ALA ALA B . n B 2 73 ALA 73 54 54 ALA ALA B . n B 2 74 ASN 74 55 55 ASN ASN B . n B 2 75 GLU 75 56 56 GLU GLU B . n B 2 76 ALA 76 57 57 ALA ALA B . n B 2 77 ASP 77 58 58 ASP ASP B . n B 2 78 ALA 78 59 59 ALA ALA B . n B 2 79 VAL 79 60 60 VAL VAL B . n B 2 80 THR 80 61 61 THR THR B . n B 2 81 LEU 81 62 62 LEU LEU B . n B 2 82 ASP 82 63 63 ASP ASP B . n B 2 83 ALA 83 64 64 ALA ALA B . n B 2 84 GLY 84 65 65 GLY GLY B . n B 2 85 LEU 85 66 66 LEU LEU B . n B 2 86 VAL 86 67 67 VAL VAL B . n B 2 87 TYR 87 68 68 TYR TYR B . n B 2 88 ASP 88 69 69 ASP ASP B . n B 2 89 ALA 89 70 70 ALA ALA B . n B 2 90 TYR 90 71 71 TYR TYR B . n B 2 91 LEU 91 72 72 LEU LEU B . n B 2 92 ALA 92 73 73 ALA ALA B . n B 2 93 PRO 93 74 74 PRO PRO B . n B 2 94 ASN 94 75 75 ASN ASN B . n B 2 95 ASN 95 76 76 ASN ASN B . n B 2 96 LEU 96 77 77 LEU LEU B . n B 2 97 LYS 97 78 78 LYS LYS B . n B 2 98 PRO 98 79 79 PRO PRO B . n B 2 99 VAL 99 80 80 VAL VAL B . n B 2 100 VAL 100 81 81 VAL VAL B . n B 2 101 ALA 101 82 82 ALA ALA B . n B 2 102 GLU 102 83 83 GLU GLU B . n B 2 103 PHE 103 84 84 PHE PHE B . n B 2 104 TYR 104 85 85 TYR TYR B . n B 2 105 GLY 105 86 86 GLY GLY B . n B 2 106 SER 106 87 87 SER SER B . n B 2 107 LYS 107 88 88 LYS LYS B . n B 2 108 GLU 108 89 89 GLU GLU B . n B 2 109 ASP 109 90 90 ASP ASP B . n B 2 110 PRO 110 91 91 PRO PRO B . n B 2 111 GLN 111 92 92 GLN GLN B . n B 2 112 THR 112 93 93 THR THR B . n B 2 113 PHE 113 94 94 PHE PHE B . n B 2 114 TYR 114 95 95 TYR TYR B . n B 2 115 TYR 115 96 96 TYR TYR B . n B 2 116 ALA 116 97 97 ALA ALA B . n B 2 117 VAL 117 98 98 VAL VAL B . n B 2 118 ALA 118 99 99 ALA ALA B . n B 2 119 VAL 119 100 100 VAL VAL B . n B 2 120 VAL 120 101 101 VAL VAL B . n B 2 121 LYS 121 102 102 LYS LYS B . n B 2 122 LYS 122 103 103 LYS LYS B . n B 2 123 ASP 123 104 104 ASP ASP B . n B 2 124 SER 124 105 105 SER SER B . n B 2 125 GLY 125 106 106 GLY GLY B . n B 2 126 PHE 126 107 107 PHE PHE B . n B 2 127 GLN 127 108 108 GLN GLN B . n B 2 128 MET 128 109 109 MET MET B . n B 2 129 ASN 129 110 110 ASN ASN B . n B 2 130 GLN 130 111 111 GLN GLN B . n B 2 131 LEU 131 112 112 LEU LEU B . n B 2 132 ARG 132 113 113 ARG ARG B . n B 2 133 GLY 133 114 114 GLY GLY B . n B 2 134 LYS 134 115 115 LYS LYS B . n B 2 135 LYS 135 116 116 LYS LYS B . n B 2 136 SER 136 117 117 SER SER B . n B 2 137 CYS 137 118 118 CYS CYS B . n B 2 138 HIS 138 119 119 HIS HIS B . n B 2 139 THR 139 120 120 THR THR B . n B 2 140 GLY 140 121 121 GLY GLY B . n B 2 141 LEU 141 122 122 LEU LEU B . n B 2 142 GLY 142 123 123 GLY GLY B . n B 2 143 ARG 143 124 124 ARG ARG B . n B 2 144 SER 144 125 125 SER SER B . n B 2 145 ALA 145 126 126 ALA ALA B . n B 2 146 GLY 146 127 127 GLY GLY B . n B 2 147 TRP 147 128 128 TRP TRP B . n B 2 148 ASN 148 129 129 ASN ASN B . n B 2 149 ILE 149 130 130 ILE ILE B . n B 2 150 PRO 150 131 131 PRO PRO B . n B 2 151 ILE 151 132 132 ILE ILE B . n B 2 152 GLY 152 133 133 GLY GLY B . n B 2 153 LEU 153 134 134 LEU LEU B . n B 2 154 LEU 154 135 135 LEU LEU B . n B 2 155 TYR 155 136 136 TYR TYR B . n B 2 156 CYS 156 137 137 CYS CYS B . n B 2 157 ASP 157 138 138 ASP ASP B . n B 2 158 LEU 158 139 139 LEU LEU B . n B 2 159 PRO 159 140 140 PRO PRO B . n B 2 160 GLU 160 141 141 GLU GLU B . n B 2 161 PRO 161 142 142 PRO PRO B . n B 2 162 ARG 162 143 143 ARG ARG B . n B 2 163 LYS 163 144 144 LYS LYS B . n B 2 164 PRO 164 145 145 PRO PRO B . n B 2 165 LEU 165 146 146 LEU LEU B . n B 2 166 GLU 166 147 147 GLU GLU B . n B 2 167 LYS 167 148 148 LYS LYS B . n B 2 168 ALA 168 149 149 ALA ALA B . n B 2 169 VAL 169 150 150 VAL VAL B . n B 2 170 ALA 170 151 151 ALA ALA B . n B 2 171 ASN 171 152 152 ASN ASN B . n B 2 172 PHE 172 153 153 PHE PHE B . n B 2 173 PHE 173 154 154 PHE PHE B . n B 2 174 SER 174 155 155 SER SER B . n B 2 175 GLY 175 156 156 GLY GLY B . n B 2 176 SER 176 157 157 SER SER B . n B 2 177 CYS 177 158 158 CYS CYS B . n B 2 178 ALA 178 159 159 ALA ALA B . n B 2 179 PRO 179 160 160 PRO PRO B . n B 2 180 CYS 180 161 161 CYS CYS B . n B 2 181 ALA 181 162 162 ALA ALA B . n B 2 182 ASP 182 163 163 ASP ASP B . n B 2 183 GLY 183 164 164 GLY GLY B . n B 2 184 THR 184 165 165 THR THR B . n B 2 185 ASP 185 166 166 ASP ASP B . n B 2 186 PHE 186 167 167 PHE PHE B . n B 2 187 PRO 187 168 168 PRO PRO B . n B 2 188 GLN 188 169 169 GLN GLN B . n B 2 189 LEU 189 170 170 LEU LEU B . n B 2 190 CYS 190 171 171 CYS CYS B . n B 2 191 GLN 191 172 172 GLN GLN B . n B 2 192 LEU 192 173 173 LEU LEU B . n B 2 193 CYS 193 174 174 CYS CYS B . n B 2 194 PRO 194 175 175 PRO PRO B . n B 2 195 GLY 195 176 176 GLY GLY B . n B 2 196 CYS 196 177 177 CYS CYS B . n B 2 197 GLY 197 178 178 GLY GLY B . n B 2 198 CYS 198 179 179 CYS CYS B . n B 2 199 SER 199 180 180 SER SER B . n B 2 200 THR 200 181 181 THR THR B . n B 2 201 LEU 201 182 182 LEU LEU B . n B 2 202 ASN 202 183 183 ASN ASN B . n B 2 203 GLN 203 184 184 GLN GLN B . n B 2 204 TYR 204 185 185 TYR TYR B . n B 2 205 PHE 205 186 186 PHE PHE B . n B 2 206 GLY 206 187 187 GLY GLY B . n B 2 207 TYR 207 188 188 TYR TYR B . n B 2 208 SER 208 189 189 SER SER B . n B 2 209 GLY 209 190 190 GLY GLY B . n B 2 210 ALA 210 191 191 ALA ALA B . n B 2 211 PHE 211 192 192 PHE PHE B . n B 2 212 LYS 212 193 193 LYS LYS B . n B 2 213 CYS 213 194 194 CYS CYS B . n B 2 214 LEU 214 195 195 LEU LEU B . n B 2 215 LYS 215 196 196 LYS LYS B . n B 2 216 ASP 216 197 197 ASP ASP B . n B 2 217 GLY 217 198 198 GLY GLY B . n B 2 218 ALA 218 199 199 ALA ALA B . n B 2 219 GLY 219 200 200 GLY GLY B . n B 2 220 ASP 220 201 201 ASP ASP B . n B 2 221 VAL 221 202 202 VAL VAL B . n B 2 222 ALA 222 203 203 ALA ALA B . n B 2 223 PHE 223 204 204 PHE PHE B . n B 2 224 VAL 224 205 205 VAL VAL B . n B 2 225 LYS 225 206 206 LYS LYS B . n B 2 226 HIS 226 207 207 HIS HIS B . n B 2 227 SER 227 208 208 SER SER B . n B 2 228 THR 228 209 209 THR THR B . n B 2 229 ILE 229 210 210 ILE ILE B . n B 2 230 PHE 230 211 211 PHE PHE B . n B 2 231 GLU 231 212 212 GLU GLU B . n B 2 232 ASN 232 213 213 ASN ASN B . n B 2 233 LEU 233 214 214 LEU LEU B . n B 2 234 ALA 234 215 215 ALA ALA B . n B 2 235 ASN 235 216 216 ASN ASN B . n B 2 236 LYS 236 217 217 LYS LYS B . n B 2 237 ALA 237 218 218 ALA ALA B . n B 2 238 ASP 238 219 219 ASP ASP B . n B 2 239 ARG 239 220 220 ARG ARG B . n B 2 240 ASP 240 221 221 ASP ASP B . n B 2 241 GLN 241 222 222 GLN GLN B . n B 2 242 TYR 242 223 223 TYR TYR B . n B 2 243 GLU 243 224 224 GLU GLU B . n B 2 244 LEU 244 225 225 LEU LEU B . n B 2 245 LEU 245 226 226 LEU LEU B . n B 2 246 CYS 246 227 227 CYS CYS B . n B 2 247 LEU 247 228 228 LEU LEU B . n B 2 248 ASP 248 229 229 ASP ASP B . n B 2 249 ASN 249 230 230 ASN ASN B . n B 2 250 THR 250 231 231 THR THR B . n B 2 251 ARG 251 232 232 ARG ARG B . n B 2 252 LYS 252 233 233 LYS LYS B . n B 2 253 PRO 253 234 234 PRO PRO B . n B 2 254 VAL 254 235 235 VAL VAL B . n B 2 255 ASP 255 236 236 ASP ASP B . n B 2 256 GLU 256 237 237 GLU GLU B . n B 2 257 TYR 257 238 238 TYR TYR B . n B 2 258 LYS 258 239 239 LYS LYS B . n B 2 259 ASP 259 240 240 ASP ASP B . n B 2 260 CYS 260 241 241 CYS CYS B . n B 2 261 HIS 261 242 242 HIS HIS B . n B 2 262 LEU 262 243 243 LEU LEU B . n B 2 263 ALA 263 244 244 ALA ALA B . n B 2 264 GLN 264 245 245 GLN GLN B . n B 2 265 VAL 265 246 246 VAL VAL B . n B 2 266 PRO 266 247 247 PRO PRO B . n B 2 267 SER 267 248 248 SER SER B . n B 2 268 HIS 268 249 249 HIS HIS B . n B 2 269 THR 269 250 250 THR THR B . n B 2 270 VAL 270 251 251 VAL VAL B . n B 2 271 VAL 271 252 252 VAL VAL B . n B 2 272 ALA 272 253 253 ALA ALA B . n B 2 273 ARG 273 254 254 ARG ARG B . n B 2 274 SER 274 255 255 SER SER B . n B 2 275 MET 275 256 256 MET MET B . n B 2 276 GLY 276 257 257 GLY GLY B . n B 2 277 GLY 277 258 258 GLY GLY B . n B 2 278 LYS 278 259 259 LYS LYS B . n B 2 279 GLU 279 260 260 GLU GLU B . n B 2 280 ASP 280 261 261 ASP ASP B . n B 2 281 LEU 281 262 262 LEU LEU B . n B 2 282 ILE 282 263 263 ILE ILE B . n B 2 283 TRP 283 264 264 TRP TRP B . n B 2 284 GLU 284 265 265 GLU GLU B . n B 2 285 LEU 285 266 266 LEU LEU B . n B 2 286 LEU 286 267 267 LEU LEU B . n B 2 287 ASN 287 268 268 ASN ASN B . n B 2 288 GLN 288 269 269 GLN GLN B . n B 2 289 ALA 289 270 270 ALA ALA B . n B 2 290 GLN 290 271 271 GLN GLN B . n B 2 291 GLU 291 272 272 GLU GLU B . n B 2 292 HIS 292 273 273 HIS HIS B . n B 2 293 PHE 293 274 274 PHE PHE B . n B 2 294 GLY 294 275 275 GLY GLY B . n B 2 295 LYS 295 276 276 LYS LYS B . n B 2 296 ASP 296 277 277 ASP ASP B . n B 2 297 LYS 297 278 278 LYS ASP B . n B 2 298 SER 298 279 279 SER SER B . n B 2 299 LYS 299 280 280 LYS LYS B . n B 2 300 GLU 300 281 281 GLU GLU B . n B 2 301 PHE 301 282 282 PHE PHE B . n B 2 302 GLN 302 283 283 GLN GLN B . n B 2 303 LEU 303 284 284 LEU LEU B . n B 2 304 PHE 304 285 285 PHE PHE B . n B 2 305 SER 305 286 286 SER SER B . n B 2 306 SER 306 287 287 SER SER B . n B 2 307 PRO 307 288 288 PRO PRO B . n B 2 308 HIS 308 289 289 HIS HIS B . n B 2 309 GLY 309 290 290 GLY GLY B . n B 2 310 LYS 310 291 291 LYS LYS B . n B 2 311 ASP 311 292 292 ASP ASP B . n B 2 312 LEU 312 293 293 LEU LEU B . n B 2 313 LEU 313 294 294 LEU LEU B . n B 2 314 PHE 314 295 295 PHE PHE B . n B 2 315 LYS 315 296 296 LYS LYS B . n B 2 316 ASP 316 297 297 ASP ASP B . n B 2 317 SER 317 298 298 SER SER B . n B 2 318 ALA 318 299 299 ALA ALA B . n B 2 319 HIS 319 300 300 HIS HIS B . n B 2 320 GLY 320 301 301 GLY GLY B . n B 2 321 PHE 321 302 302 PHE PHE B . n B 2 322 LEU 322 303 303 LEU LEU B . n B 2 323 LYS 323 304 304 LYS LYS B . n B 2 324 VAL 324 305 305 VAL VAL B . n B 2 325 PRO 325 306 306 PRO PRO B . n B 2 326 PRO 326 307 307 PRO PRO B . n B 2 327 ARG 327 308 308 ARG ARG B . n B 2 328 MET 328 309 309 MET MET B . n B 2 329 ASP 329 310 310 ASP ASP B . n B 2 330 ALA 330 311 311 ALA ALA B . n B 2 331 LYS 331 312 312 LYS LYS B . n B 2 332 MET 332 313 313 MET MET B . n B 2 333 TYR 333 314 314 TYR TYR B . n B 2 334 LEU 334 315 315 LEU LEU B . n B 2 335 GLY 335 316 316 GLY GLY B . n B 2 336 TYR 336 317 317 TYR TYR B . n B 2 337 GLU 337 318 318 GLU GLU B . n B 2 338 TYR 338 319 319 TYR TYR B . n B 2 339 VAL 339 320 320 VAL VAL B . n B 2 340 THR 340 321 321 THR THR B . n B 2 341 ALA 341 322 322 ALA ALA B . n B 2 342 ILE 342 323 323 ILE ILE B . n B 2 343 ARG 343 324 324 ARG ARG B . n B 2 344 ASN 344 325 325 ASN ASN B . n B 2 345 LEU 345 326 326 LEU LEU B . n B 2 346 ARG 346 327 327 ARG ARG B . n B 2 347 GLU 347 328 328 GLU GLU B . n B 2 348 GLY 348 329 329 GLY GLY B . n B 2 349 THR 349 330 330 THR THR B . n B 2 350 CYS 350 331 331 CYS CYS B . n B 2 351 PRO 351 332 332 PRO PRO B . n B 2 352 GLU 352 333 333 GLU GLU B . n B 2 353 ALA 353 334 334 ALA ALA B . n B 2 354 PRO 354 335 335 PRO PRO B . n B 2 355 THR 355 336 336 THR THR B . n B 2 356 ASP 356 337 337 ASP ASP B . n B 2 357 GLU 357 338 338 GLU GLU B . n B 2 358 CYS 358 339 339 CYS CYS B . n B 2 359 LYS 359 340 340 LYS LYS B . n B 2 360 PRO 360 341 341 PRO PRO B . n B 2 361 VAL 361 342 342 VAL VAL B . n B 2 362 LYS 362 343 343 LYS LYS B . n B 2 363 TRP 363 344 344 TRP TRP B . n B 2 364 CYS 364 345 345 CYS CYS B . n B 2 365 ALA 365 346 346 ALA ALA B . n B 2 366 LEU 366 347 347 LEU LEU B . n B 2 367 SER 367 348 348 SER SER B . n B 2 368 HIS 368 349 349 HIS HIS B . n B 2 369 HIS 369 350 350 HIS HIS B . n B 2 370 GLU 370 351 351 GLU GLU B . n B 2 371 ARG 371 352 352 ARG ARG B . n B 2 372 LEU 372 353 353 LEU LEU B . n B 2 373 LYS 373 354 354 LYS LYS B . n B 2 374 CYS 374 355 355 CYS CYS B . n B 2 375 ASP 375 356 356 ASP ASP B . n B 2 376 GLU 376 357 357 GLU GLU B . n B 2 377 TRP 377 358 358 TRP TRP B . n B 2 378 SER 378 359 359 SER SER B . n B 2 379 VAL 379 360 360 VAL VAL B . n B 2 380 ASN 380 361 361 ASN ASN B . n B 2 381 SER 381 362 362 SER SER B . n B 2 382 VAL 382 363 363 VAL VAL B . n B 2 383 GLY 383 364 364 GLY GLY B . n B 2 384 LYS 384 365 365 LYS LYS B . n B 2 385 ILE 385 366 366 ILE ILE B . n B 2 386 GLU 386 367 367 GLU GLU B . n B 2 387 CYS 387 368 368 CYS CYS B . n B 2 388 VAL 388 369 369 VAL VAL B . n B 2 389 SER 389 370 370 SER SER B . n B 2 390 ALA 390 371 371 ALA ALA B . n B 2 391 GLU 391 372 372 GLU GLU B . n B 2 392 THR 392 373 373 THR THR B . n B 2 393 THR 393 374 374 THR THR B . n B 2 394 GLU 394 375 375 GLU GLU B . n B 2 395 ASP 395 376 376 ASP ASP B . n B 2 396 CYS 396 377 377 CYS CYS B . n B 2 397 ILE 397 378 378 ILE ILE B . n B 2 398 ALA 398 379 379 ALA ALA B . n B 2 399 LYS 399 380 380 LYS LYS B . n B 2 400 ILE 400 381 381 ILE ILE B . n B 2 401 MET 401 382 382 MET MET B . n B 2 402 ASN 402 383 383 ASN ASN B . n B 2 403 GLY 403 384 384 GLY GLY B . n B 2 404 GLU 404 385 385 GLU GLU B . n B 2 405 ALA 405 386 386 ALA ALA B . n B 2 406 ASP 406 387 387 ASP ASP B . n B 2 407 ALA 407 388 388 ALA ALA B . n B 2 408 MET 408 389 389 MET MET B . n B 2 409 SER 409 390 390 SER SER B . n B 2 410 LEU 410 391 391 LEU LEU B . n B 2 411 ASP 411 392 392 ASP ASP B . n B 2 412 GLY 412 393 393 GLY GLY B . n B 2 413 GLY 413 394 394 GLY GLY B . n B 2 414 PHE 414 395 395 PHE PHE B . n B 2 415 VAL 415 396 396 VAL VAL B . n B 2 416 TYR 416 397 397 TYR TYR B . n B 2 417 ILE 417 398 398 ILE ILE B . n B 2 418 ALA 418 399 399 ALA ALA B . n B 2 419 GLY 419 400 400 GLY GLY B . n B 2 420 LYS 420 401 401 LYS LYS B . n B 2 421 CYS 421 402 402 CYS CYS B . n B 2 422 GLY 422 403 403 GLY GLY B . n B 2 423 LEU 423 404 404 LEU LEU B . n B 2 424 VAL 424 405 405 VAL VAL B . n B 2 425 PRO 425 406 406 PRO PRO B . n B 2 426 VAL 426 407 407 VAL VAL B . n B 2 427 LEU 427 408 408 LEU LEU B . n B 2 428 ALA 428 409 409 ALA ALA B . n B 2 429 GLU 429 410 410 GLU GLU B . n B 2 430 ASN 430 411 411 ASN ASN B . n B 2 431 TYR 431 412 412 TYR TYR B . n B 2 432 ASN 432 413 413 ASN ASN B . n B 2 433 LYS 433 414 414 LYS LYS B . n B 2 434 SER 434 415 415 SER SER B . n B 2 435 ASP 435 416 416 ASP ASP B . n B 2 436 ASN 436 417 417 ASN ASN B . n B 2 437 CYS 437 418 418 CYS CYS B . n B 2 438 GLU 438 419 419 GLU GLU B . n B 2 439 ASP 439 420 420 ASP ASP B . n B 2 440 THR 440 421 421 THR THR B . n B 2 441 PRO 441 422 422 PRO PRO B . n B 2 442 GLU 442 423 423 GLU GLU B . n B 2 443 ALA 443 424 424 ALA ALA B . n B 2 444 GLY 444 425 425 GLY GLY B . n B 2 445 TYR 445 426 426 TYR TYR B . n B 2 446 PHE 446 427 427 PHE PHE B . n B 2 447 ALA 447 428 428 ALA ALA B . n B 2 448 VAL 448 429 429 VAL VAL B . n B 2 449 ALA 449 430 430 ALA ALA B . n B 2 450 VAL 450 431 431 VAL VAL B . n B 2 451 VAL 451 432 432 VAL VAL B . n B 2 452 LYS 452 433 433 LYS LYS B . n B 2 453 LYS 453 434 434 LYS LYS B . n B 2 454 SER 454 435 435 SER SER B . n B 2 455 ALA 455 436 436 ALA ALA B . n B 2 456 SER 456 437 437 SER SER B . n B 2 457 ASP 457 438 438 ASP ASP B . n B 2 458 LEU 458 439 439 LEU LEU B . n B 2 459 THR 459 440 440 THR THR B . n B 2 460 TRP 460 441 441 TRP TRP B . n B 2 461 ASP 461 442 442 ASP ASP B . n B 2 462 ASN 462 443 443 ASN ASN B . n B 2 463 LEU 463 444 444 LEU LEU B . n B 2 464 LYS 464 445 445 LYS LYS B . n B 2 465 GLY 465 446 446 GLY GLY B . n B 2 466 LYS 466 447 447 LYS LYS B . n B 2 467 LYS 467 448 448 LYS LYS B . n B 2 468 SER 468 449 449 SER SER B . n B 2 469 CYS 469 450 450 CYS CYS B . n B 2 470 HIS 470 451 451 HIS HIS B . n B 2 471 THR 471 452 452 THR THR B . n B 2 472 ALA 472 453 453 ALA ALA B . n B 2 473 VAL 473 454 454 VAL VAL B . n B 2 474 GLY 474 455 455 GLY GLY B . n B 2 475 ARG 475 456 456 ARG ARG B . n B 2 476 THR 476 457 457 THR THR B . n B 2 477 ALA 477 458 458 ALA ALA B . n B 2 478 GLY 478 459 459 GLY GLY B . n B 2 479 TRP 479 460 460 TRP TRP B . n B 2 480 ASN 480 461 461 ASN ASN B . n B 2 481 ILE 481 462 462 ILE ILE B . n B 2 482 PRO 482 463 463 PRO PRO B . n B 2 483 MET 483 464 464 MET MET B . n B 2 484 GLY 484 465 465 GLY GLY B . n B 2 485 LEU 485 466 466 LEU LEU B . n B 2 486 LEU 486 467 467 LEU LEU B . n B 2 487 TYR 487 468 468 TYR TYR B . n B 2 488 ASN 488 469 469 ASN ASN B . n B 2 489 LYS 489 470 470 LYS LYS B . n B 2 490 ILE 490 471 471 ILE ILE B . n B 2 491 ASN 491 472 472 ASN ASN B . n B 2 492 HIS 492 473 473 HIS HIS B . n B 2 493 CYS 493 474 474 CYS CYS B . n B 2 494 ARG 494 475 475 ARG ARG B . n B 2 495 PHE 495 476 476 PHE PHE B . n B 2 496 ASP 496 477 477 ASP ASP B . n B 2 497 GLU 497 478 478 GLU GLU B . n B 2 498 PHE 498 479 479 PHE PHE B . n B 2 499 PHE 499 480 480 PHE PHE B . n B 2 500 SER 500 481 481 SER SER B . n B 2 501 GLU 501 482 482 GLU GLU B . n B 2 502 GLY 502 483 483 GLY GLY B . n B 2 503 CYS 503 484 484 CYS CYS B . n B 2 504 ALA 504 485 485 ALA ALA B . n B 2 505 PRO 505 486 486 PRO PRO B . n B 2 506 GLY 506 487 487 GLY GLY B . n B 2 507 SER 507 488 488 SER SER B . n B 2 508 LYS 508 489 489 LYS LYS B . n B 2 509 LYS 509 490 490 LYS LYS B . n B 2 510 ASP 510 491 491 ASP ASP B . n B 2 511 SER 511 492 492 SER SER B . n B 2 512 SER 512 493 493 SER SER B . n B 2 513 LEU 513 494 494 LEU LEU B . n B 2 514 CYS 514 495 495 CYS CYS B . n B 2 515 LYS 515 496 496 LYS LYS B . n B 2 516 LEU 516 497 497 LEU LEU B . n B 2 517 CYS 517 498 498 CYS CYS B . n B 2 518 MET 518 499 499 MET MET B . n B 2 519 GLY 519 500 500 GLY GLY B . n B 2 520 SER 520 501 501 SER SER B . n B 2 521 GLY 521 502 502 GLY GLY B . n B 2 522 LEU 522 503 503 LEU LEU B . n B 2 523 ASN 523 504 504 ASN ASN B . n B 2 524 LEU 524 505 505 LEU LEU B . n B 2 525 CYS 525 506 506 CYS CYS B . n B 2 526 GLU 526 507 507 GLU GLU B . n B 2 527 PRO 527 508 508 PRO PRO B . n B 2 528 ASN 528 509 509 ASN ASN B . n B 2 529 ASN 529 510 510 ASN ASN B . n B 2 530 LYS 530 511 511 LYS LYS B . n B 2 531 GLU 531 512 512 GLU GLU B . n B 2 532 GLY 532 513 513 GLY GLY B . n B 2 533 TYR 533 514 514 TYR TYR B . n B 2 534 TYR 534 515 515 TYR TYR B . n B 2 535 GLY 535 516 516 GLY GLY B . n B 2 536 TYR 536 517 517 TYR TYR B . n B 2 537 THR 537 518 518 THR THR B . n B 2 538 GLY 538 519 519 GLY GLY B . n B 2 539 ALA 539 520 520 ALA ALA B . n B 2 540 PHE 540 521 521 PHE PHE B . n B 2 541 ARG 541 522 522 ARG ARG B . n B 2 542 CYS 542 523 523 CYS CYS B . n B 2 543 LEU 543 524 524 LEU LEU B . n B 2 544 VAL 544 525 525 VAL VAL B . n B 2 545 GLU 545 526 526 GLU GLU B . n B 2 546 LYS 546 527 527 LYS LYS B . n B 2 547 GLY 547 528 528 GLY GLY B . n B 2 548 ASP 548 529 529 ASP ASP B . n B 2 549 VAL 549 530 530 VAL VAL B . n B 2 550 ALA 550 531 531 ALA ALA B . n B 2 551 PHE 551 532 532 PHE PHE B . n B 2 552 VAL 552 533 533 VAL VAL B . n B 2 553 LYS 553 534 534 LYS LYS B . n B 2 554 HIS 554 535 535 HIS HIS B . n B 2 555 GLN 555 536 536 GLN GLN B . n B 2 556 THR 556 537 537 THR THR B . n B 2 557 VAL 557 538 538 VAL VAL B . n B 2 558 PRO 558 539 539 PRO PRO B . n B 2 559 GLN 559 540 540 GLN GLN B . n B 2 560 ASN 560 541 541 ASN ASN B . n B 2 561 THR 561 542 542 THR THR B . n B 2 562 GLY 562 543 543 GLY GLY B . n B 2 563 GLY 563 544 544 GLY GLY B . n B 2 564 LYS 564 545 545 LYS LYS B . n B 2 565 ASN 565 546 546 ASN ASN B . n B 2 566 PRO 566 547 547 PRO PRO B . n B 2 567 ASP 567 548 548 ASP ASP B . n B 2 568 PRO 568 549 549 PRO PRO B . n B 2 569 TRP 569 550 550 TRP TRP B . n B 2 570 ALA 570 551 551 ALA ALA B . n B 2 571 LYS 571 552 552 LYS LYS B . n B 2 572 ASN 572 553 553 ASN ASN B . n B 2 573 LEU 573 554 554 LEU LEU B . n B 2 574 ASN 574 555 555 ASN ASN B . n B 2 575 GLU 575 556 556 GLU GLU B . n B 2 576 LYS 576 557 557 LYS LYS B . n B 2 577 ASP 577 558 558 ASP ASP B . n B 2 578 TYR 578 559 559 TYR TYR B . n B 2 579 GLU 579 560 560 GLU GLU B . n B 2 580 LEU 580 561 561 LEU LEU B . n B 2 581 LEU 581 562 562 LEU LEU B . n B 2 582 CYS 582 563 563 CYS CYS B . n B 2 583 LEU 583 564 564 LEU LEU B . n B 2 584 ASP 584 565 565 ASP ASP B . n B 2 585 GLY 585 566 566 GLY GLY B . n B 2 586 THR 586 567 567 THR THR B . n B 2 587 ARG 587 568 568 ARG ARG B . n B 2 588 LYS 588 569 569 LYS LYS B . n B 2 589 PRO 589 570 570 PRO PRO B . n B 2 590 VAL 590 571 571 VAL VAL B . n B 2 591 GLU 591 572 572 GLU GLU B . n B 2 592 GLU 592 573 573 GLU GLU B . n B 2 593 TYR 593 574 574 TYR TYR B . n B 2 594 ALA 594 575 575 ALA ALA B . n B 2 595 ASN 595 576 576 ASN ASN B . n B 2 596 CYS 596 577 577 CYS CYS B . n B 2 597 HIS 597 578 578 HIS HIS B . n B 2 598 LEU 598 579 579 LEU LEU B . n B 2 599 ALA 599 580 580 ALA ALA B . n B 2 600 ARG 600 581 581 ARG ARG B . n B 2 601 ALA 601 582 582 ALA ALA B . n B 2 602 PRO 602 583 583 PRO PRO B . n B 2 603 ASN 603 584 584 ASN ASN B . n B 2 604 HIS 604 585 585 HIS HIS B . n B 2 605 ALA 605 586 586 ALA ALA B . n B 2 606 VAL 606 587 587 VAL VAL B . n B 2 607 VAL 607 588 588 VAL VAL B . n B 2 608 THR 608 589 589 THR THR B . n B 2 609 ARG 609 590 590 ARG ARG B . n B 2 610 LYS 610 591 591 LYS LYS B . n B 2 611 ASP 611 592 592 ASP ASP B . n B 2 612 LYS 612 593 593 LYS LYS B . n B 2 613 GLU 613 594 594 GLU GLU B . n B 2 614 ALA 614 595 595 ALA ALA B . n B 2 615 CYS 615 596 596 CYS CYS B . n B 2 616 VAL 616 597 597 VAL VAL B . n B 2 617 HIS 617 598 598 HIS HIS B . n B 2 618 LYS 618 599 599 LYS LYS B . n B 2 619 ILE 619 600 600 ILE ILE B . n B 2 620 LEU 620 601 601 LEU LEU B . n B 2 621 ARG 621 602 602 ARG ARG B . n B 2 622 GLN 622 603 603 GLN GLN B . n B 2 623 GLN 623 604 604 GLN GLN B . n B 2 624 GLN 624 605 605 GLN GLN B . n B 2 625 HIS 625 606 606 HIS HIS B . n B 2 626 LEU 626 607 607 LEU LEU B . n B 2 627 PHE 627 608 608 PHE PHE B . n B 2 628 GLY 628 609 609 GLY GLY B . n B 2 629 SER 629 610 610 SER SER B . n B 2 630 ASN 630 611 611 ASN ASN B . n B 2 631 VAL 631 612 612 VAL VAL B . n B 2 632 THR 632 613 613 THR THR B . n B 2 633 ASP 633 614 614 ASP ASP B . n B 2 634 CYS 634 615 615 CYS CYS B . n B 2 635 SER 635 616 616 SER SER B . n B 2 636 GLY 636 617 617 GLY GLY B . n B 2 637 ASN 637 618 618 ASN ASN B . n B 2 638 PHE 638 619 619 PHE PHE B . n B 2 639 CYS 639 620 620 CYS CYS B . n B 2 640 LEU 640 621 621 LEU LEU B . n B 2 641 PHE 641 622 622 PHE PHE B . n B 2 642 ARG 642 623 623 ARG ARG B . n B 2 643 SER 643 624 624 SER SER B . n B 2 644 GLU 644 625 625 GLU GLU B . n B 2 645 THR 645 626 626 THR THR B . n B 2 646 LYS 646 627 627 LYS LYS B . n B 2 647 ASP 647 628 628 ASP ASP B . n B 2 648 LEU 648 629 629 LEU LEU B . n B 2 649 LEU 649 630 630 LEU LEU B . n B 2 650 PHE 650 631 631 PHE PHE B . n B 2 651 ARG 651 632 632 ARG ARG B . n B 2 652 ASP 652 633 633 ASP ASP B . n B 2 653 ASP 653 634 634 ASP ASP B . n B 2 654 THR 654 635 635 THR THR B . n B 2 655 VAL 655 636 636 VAL VAL B . n B 2 656 CYS 656 637 637 CYS CYS B . n B 2 657 LEU 657 638 638 LEU LEU B . n B 2 658 ALA 658 639 639 ALA ALA B . n B 2 659 LYS 659 640 640 LYS LYS B . n B 2 660 LEU 660 641 641 LEU LEU B . n B 2 661 HIS 661 642 642 HIS HIS B . n B 2 662 ASP 662 643 643 ASP ASP B . n B 2 663 ARG 663 644 644 ARG ARG B . n B 2 664 ASN 664 645 645 ASN ASN B . n B 2 665 THR 665 646 646 THR THR B . n B 2 666 TYR 666 647 647 TYR TYR B . n B 2 667 GLU 667 648 648 GLU GLU B . n B 2 668 LYS 668 649 649 LYS LYS B . n B 2 669 TYR 669 650 650 TYR TYR B . n B 2 670 LEU 670 651 651 LEU LEU B . n B 2 671 GLY 671 652 652 GLY GLY B . n B 2 672 GLU 672 653 653 GLU GLU B . n B 2 673 GLU 673 654 654 GLU GLU B . n B 2 674 TYR 674 655 655 TYR TYR B . n B 2 675 VAL 675 656 656 VAL VAL B . n B 2 676 LYS 676 657 657 LYS LYS B . n B 2 677 ALA 677 658 658 ALA ALA B . n B 2 678 VAL 678 659 659 VAL VAL B . n B 2 679 GLY 679 660 660 GLY GLY B . n B 2 680 ASN 680 661 661 ASN ASN B . n B 2 681 LEU 681 662 662 LEU LEU B . n B 2 682 ARG 682 663 663 ARG ARG B . n B 2 683 LYS 683 664 664 LYS LYS B . n B 2 684 CYS 684 665 665 CYS CYS B . n B 2 685 SER 685 666 666 SER SER B . n B 2 686 THR 686 667 667 THR THR B . n B 2 687 SER 687 668 668 SER SER B . n B 2 688 SER 688 669 669 SER SER B . n B 2 689 LEU 689 670 670 LEU LEU B . n B 2 690 LEU 690 671 671 LEU LEU B . n B 2 691 GLU 691 672 672 GLU GLU B . n B 2 692 ALA 692 673 673 ALA ALA B . n B 2 693 CYS 693 674 674 CYS CYS B . n B 2 694 THR 694 675 675 THR THR B . n B 2 695 PHE 695 676 676 PHE PHE B . n B 2 696 ARG 696 677 677 ARG ARG B . n B 2 697 ARG 697 678 678 ARG ARG B . n B 2 698 PRO 698 679 679 PRO PRO B . n # 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 B ASN 432 B ASN 413 ? ASN 'GLYCOSYLATION SITE' 2 B ASN 630 B ASN 611 ? 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 dimeric _pdbx_struct_assembly.oligomeric_count 2 # _pdbx_struct_assembly_gen.assembly_id 1 _pdbx_struct_assembly_gen.oper_expression 1 _pdbx_struct_assembly_gen.asym_id_list A,B,C,D,E,F,G,H,I,J,K,L,M,N,O,P,Q,R,S,T,U,V,W,X,Y # loop_ _pdbx_struct_assembly_prop.biol_id _pdbx_struct_assembly_prop.type _pdbx_struct_assembly_prop.value _pdbx_struct_assembly_prop.details 1 'ABSA (A^2)' 10350 ? 1 MORE 66 ? 1 'SSA (A^2)' 64870 ? # _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_audit_revision_history.ordinal _pdbx_audit_revision_history.data_content_type _pdbx_audit_revision_history.major_revision _pdbx_audit_revision_history.minor_revision _pdbx_audit_revision_history.revision_date 1 'Structure model' 1 0 2012-02-29 2 'Structure model' 1 1 2012-04-18 # _pdbx_audit_revision_details.ordinal 1 _pdbx_audit_revision_details.revision_ordinal 1 _pdbx_audit_revision_details.data_content_type 'Structure model' _pdbx_audit_revision_details.provider repository _pdbx_audit_revision_details.type 'Initial release' _pdbx_audit_revision_details.description ? # _pdbx_audit_revision_group.ordinal 1 _pdbx_audit_revision_group.revision_ordinal 2 _pdbx_audit_revision_group.data_content_type 'Structure model' _pdbx_audit_revision_group.group 'Database references' # loop_ _pdbx_refine_tls.pdbx_refine_id _pdbx_refine_tls.id _pdbx_refine_tls.details _pdbx_refine_tls.method _pdbx_refine_tls.origin_x _pdbx_refine_tls.origin_y _pdbx_refine_tls.origin_z _pdbx_refine_tls.T[1][1] _pdbx_refine_tls.T[2][2] _pdbx_refine_tls.T[3][3] _pdbx_refine_tls.T[1][2] _pdbx_refine_tls.T[1][3] _pdbx_refine_tls.T[2][3] _pdbx_refine_tls.L[1][1] _pdbx_refine_tls.L[2][2] _pdbx_refine_tls.L[3][3] _pdbx_refine_tls.L[1][2] _pdbx_refine_tls.L[1][3] _pdbx_refine_tls.L[2][3] _pdbx_refine_tls.S[1][1] _pdbx_refine_tls.S[1][2] _pdbx_refine_tls.S[1][3] _pdbx_refine_tls.S[2][1] _pdbx_refine_tls.S[2][2] _pdbx_refine_tls.S[2][3] _pdbx_refine_tls.S[3][1] _pdbx_refine_tls.S[3][2] _pdbx_refine_tls.S[3][3] 'X-RAY DIFFRACTION' 1 ? refined 34.2542 -52.3659 41.3379 0.6257 0.6078 0.4843 0.0131 -0.1268 0.1962 1.1591 1.3166 1.3849 0.0236 0.2140 -0.3209 0.0183 -0.5204 -0.3115 0.5983 0.0549 -0.1475 0.1191 0.0109 -0.0507 'X-RAY DIFFRACTION' 2 ? refined 7.5760 -35.8178 24.6932 0.4142 0.4951 0.3496 0.0221 -0.0166 0.0397 1.8511 1.6239 1.6354 -1.1154 1.1725 -1.0543 -0.1910 -0.5722 -0.1407 0.3933 0.2345 0.1485 -0.1289 -0.4141 -0.0202 'X-RAY DIFFRACTION' 3 ? refined 34.0756 -49.5878 27.3137 0.3939 0.3096 0.3852 0.0217 -0.0510 0.0767 3.0215 1.9939 1.7125 -1.3417 0.7965 -0.5234 0.1176 -0.1065 -0.4133 0.0946 -0.0439 -0.1838 0.3347 0.1894 -0.0698 'X-RAY DIFFRACTION' 4 ? refined 5.6784 -26.7350 4.4654 0.3855 0.4894 0.2968 0.0816 -0.0276 0.0347 6.4269 2.3362 0.6549 -2.4777 1.9772 -0.4379 0.1793 0.6205 -0.1383 -0.1947 -0.1610 0.4378 -0.1291 0.0176 -0.0202 'X-RAY DIFFRACTION' 5 ? refined 54.4004 -44.1959 39.3016 0.4507 0.6353 0.7020 -0.0644 -0.2252 0.1624 2.0480 1.9246 2.7001 -0.6064 2.4747 -0.5702 0.1333 -0.0004 -0.0445 0.3691 -0.2585 -0.6089 0.2628 0.4882 0.0055 'X-RAY DIFFRACTION' 6 ? refined 47.8987 -29.9741 38.2163 0.6902 0.6286 0.6407 -0.0266 -0.2946 -0.0219 1.1282 0.8398 1.2911 0.0634 0.1536 0.4455 -0.2014 -0.2407 0.0897 0.4689 -0.0843 -0.6068 -0.4801 0.6525 0.2760 'X-RAY DIFFRACTION' 7 ? refined 37.5097 -39.5112 55.6364 1.1133 0.8407 0.4275 0.0759 -0.1769 0.0823 1.5635 0.8702 2.1144 0.3526 -0.4135 -1.7087 -0.2698 -0.4568 -0.0992 0.5518 0.2368 -0.2326 -0.3093 -0.1423 0.0668 'X-RAY DIFFRACTION' 8 ? refined 28.8924 -36.4112 49.8796 0.7795 0.7922 0.3623 0.0743 -0.1078 0.0579 1.6267 4.1196 3.1994 0.6528 -0.6034 -2.7260 0.0427 -0.7109 0.0644 1.3926 -0.1888 -0.2067 -0.7624 -0.0724 0.2376 'X-RAY DIFFRACTION' 9 ? refined 21.0436 -40.7328 46.7788 0.7884 0.8657 0.4534 0.1600 -0.1344 0.1537 1.2209 1.6959 1.7295 0.2419 -0.7609 0.5023 -0.2422 -0.3719 0.0223 1.3902 0.4238 -0.3552 -0.5132 -0.5379 -0.2172 'X-RAY DIFFRACTION' 10 ? refined 49.2433 8.0617 -8.2706 0.7061 0.3603 0.7001 -0.1370 -0.0273 0.1048 2.2343 4.6522 1.9997 -0.9309 -0.8154 0.9573 0.2464 0.1406 0.7913 -0.2707 -0.0136 -0.2720 -0.8308 0.2346 -0.1167 'X-RAY DIFFRACTION' 11 ? refined 17.0248 -3.4638 9.8064 0.7624 0.3783 0.5510 0.0800 -0.1291 -0.0282 3.2346 0.7042 0.3792 0.4819 0.4728 0.1651 -0.1657 -0.0283 0.6981 -0.0912 0.0046 0.1671 -0.4619 -0.1447 0.1336 # loop_ _pdbx_refine_tls_group.pdbx_refine_id _pdbx_refine_tls_group.id _pdbx_refine_tls_group.refine_tls_id _pdbx_refine_tls_group.beg_auth_asym_id _pdbx_refine_tls_group.beg_auth_seq_id _pdbx_refine_tls_group.beg_label_asym_id _pdbx_refine_tls_group.beg_label_seq_id _pdbx_refine_tls_group.end_auth_asym_id _pdbx_refine_tls_group.end_auth_seq_id _pdbx_refine_tls_group.end_label_asym_id _pdbx_refine_tls_group.end_label_seq_id _pdbx_refine_tls_group.selection _pdbx_refine_tls_group.selection_details 'X-RAY DIFFRACTION' 1 1 ? ? ? ? ? ? ? ? ? ;chain 'A' and (resseq 54:228) ; 'X-RAY DIFFRACTION' 2 2 ? ? ? ? ? ? ? ? ? ;chain 'A' and (resseq 229:382) ; 'X-RAY DIFFRACTION' 3 3 ? ? ? ? ? ? ? ? ? ;chain 'A' and (resseq 383:513) ; 'X-RAY DIFFRACTION' 4 4 ? ? ? ? ? ? ? ? ? ;chain 'A' and (resseq 514:574) ; 'X-RAY DIFFRACTION' 5 5 ? ? ? ? ? ? ? ? ? ;chain 'A' and (resseq 575:657) ; 'X-RAY DIFFRACTION' 6 6 ? ? ? ? ? ? ? ? ? ;chain 'A' and (resseq 658:728) ; 'X-RAY DIFFRACTION' 7 7 ? ? ? ? ? ? ? ? ? ;chain 'A' and (resseq 729:813) ; 'X-RAY DIFFRACTION' 8 8 ? ? ? ? ? ? ? ? ? ;chain 'A' and (resseq 814:867) ; 'X-RAY DIFFRACTION' 9 9 ? ? ? ? ? ? ? ? ? ;chain 'A' and (resseq 868:915) ; 'X-RAY DIFFRACTION' 10 10 ? ? ? ? ? ? ? ? ? ;chain 'B' and (resseq 4:341) ; 'X-RAY DIFFRACTION' 11 11 ? ? ? ? ? ? ? ? ? ;chain 'B' and (resseq 342:679) ; # loop_ _software.name _software.classification _software.version _software.citation_id _software.pdbx_ordinal SERGUI 'data collection' . ? 1 PHASER phasing . ? 2 PHENIX refinement '(phenix.refine: 1.7.3_928)' ? 3 HKL-2000 'data reduction' . ? 4 HKL-2000 'data scaling' . ? 5 # loop_ _pdbx_validate_close_contact.id _pdbx_validate_close_contact.PDB_model_num _pdbx_validate_close_contact.auth_atom_id_1 _pdbx_validate_close_contact.auth_asym_id_1 _pdbx_validate_close_contact.auth_comp_id_1 _pdbx_validate_close_contact.auth_seq_id_1 _pdbx_validate_close_contact.PDB_ins_code_1 _pdbx_validate_close_contact.label_alt_id_1 _pdbx_validate_close_contact.auth_atom_id_2 _pdbx_validate_close_contact.auth_asym_id_2 _pdbx_validate_close_contact.auth_comp_id_2 _pdbx_validate_close_contact.auth_seq_id_2 _pdbx_validate_close_contact.PDB_ins_code_2 _pdbx_validate_close_contact.label_alt_id_2 _pdbx_validate_close_contact.dist 1 1 O6 B GAL 716 ? ? C1 B SIA 717 ? ? 1.72 2 1 O6 B GAL 706 ? ? C1 B SIA 707 ? ? 1.84 3 1 O6 B GAL 706 ? ? O1A B SIA 707 ? ? 2.03 4 1 ND2 B ASN 413 ? ? C2 B NAG 701 ? ? 2.05 5 1 O6 B GAL 706 ? ? O6 B SIA 707 ? ? 2.19 # loop_ _pdbx_validate_torsion.id _pdbx_validate_torsion.PDB_model_num _pdbx_validate_torsion.auth_comp_id _pdbx_validate_torsion.auth_asym_id _pdbx_validate_torsion.auth_seq_id _pdbx_validate_torsion.PDB_ins_code _pdbx_validate_torsion.label_alt_id _pdbx_validate_torsion.phi _pdbx_validate_torsion.psi 1 1 LYS A 106 ? ? 53.57 -119.58 2 1 ASN A 158 ? ? -166.96 37.99 3 1 ALA A 166 ? ? -91.93 47.72 4 1 ALA A 256 ? ? -107.18 44.26 5 1 LYS A 323 ? ? -66.55 11.04 6 1 TYR A 376 ? ? -115.18 50.23 7 1 ASN A 416 ? ? -162.40 89.13 8 1 LYS A 419 ? ? -108.45 73.42 9 1 CYS A 446 ? ? -160.76 27.97 10 1 ASP A 469 ? ? -160.15 119.02 11 1 ASN A 532 ? ? -164.36 85.83 12 1 SER A 617 ? ? -68.42 92.72 13 1 ASP A 636 ? ? -93.46 31.51 14 1 ARG A 767 ? ? -112.10 -117.49 15 1 SER A 780 ? ? -58.00 -101.99 16 1 HIS A 781 ? ? -163.73 109.99 17 1 PHE A 783 ? ? -90.16 54.09 18 1 LEU A 827 ? ? -126.61 -160.00 19 1 VAL A 856 ? ? -114.88 56.31 20 1 LYS A 857 ? ? 59.81 89.75 21 1 LYS A 858 ? ? 65.46 -25.43 22 1 HIS A 859 ? ? -90.52 -103.96 23 1 ASN A 871 ? ? -63.31 61.56 24 1 TRP B 8 ? ? -85.09 -141.36 25 1 CYS B 9 ? ? 172.87 131.42 26 1 PHE B 22 ? ? 63.04 -134.01 27 1 ASP B 24 ? ? -75.79 -98.50 28 1 HIS B 25 ? ? -82.34 33.96 29 1 PRO B 31 ? ? -67.16 -109.13 30 1 SER B 32 ? ? -118.06 -85.02 31 1 ALA B 43 ? ? -74.89 -75.73 32 1 ALA B 54 ? ? -84.63 -105.25 33 1 ASN B 55 ? ? -163.44 -1.11 34 1 ASN B 76 ? ? -59.63 108.71 35 1 VAL B 80 ? ? -130.90 -33.60 36 1 TRP B 128 ? ? -136.04 -69.04 37 1 TYR B 185 ? ? -108.83 42.05 38 1 CYS B 241 ? ? -154.56 72.01 39 1 SER B 248 ? ? -64.94 -80.31 40 1 ARG B 254 ? ? -82.06 36.81 41 1 SER B 255 ? ? 58.94 -126.22 42 1 GLN B 271 ? ? -75.93 -80.18 43 1 GLU B 272 ? ? -0.63 -107.08 44 1 HIS B 273 ? ? -44.03 97.39 45 1 PHE B 274 ? ? -53.19 3.03 46 1 LYS B 276 ? ? -59.07 -86.43 47 1 ASP B 277 ? ? 178.27 62.34 48 1 LYS B 278 ? ? -167.15 24.84 49 1 SER B 279 ? ? -139.18 -151.44 50 1 GLU B 281 ? ? 44.33 110.23 51 1 GLN B 283 ? ? 53.02 110.77 52 1 LEU B 293 ? ? -65.90 -75.02 53 1 ARG B 327 ? ? -98.21 -61.64 54 1 TYR B 426 ? ? -121.13 -169.11 55 1 ALA B 436 ? ? -83.21 48.70 56 1 ASN B 443 ? ? -89.55 45.47 57 1 THR B 457 ? ? -52.71 -76.42 58 1 TRP B 460 ? ? -143.62 -61.16 59 1 ASN B 472 ? ? -67.61 67.95 60 1 CYS B 474 ? ? -84.01 42.97 61 1 ARG B 475 ? ? -115.23 50.83 62 1 GLU B 482 ? ? -158.39 -154.52 63 1 LEU B 497 ? ? -152.89 32.30 64 1 MET B 499 ? ? -133.15 -148.25 65 1 PRO B 508 ? ? -65.85 52.86 66 1 LYS B 527 ? ? -127.81 -55.51 67 1 CYS B 577 ? ? -160.64 61.54 68 1 ASN B 611 ? ? -92.73 -139.83 69 1 VAL B 612 ? ? 47.07 14.65 70 1 THR B 626 ? ? -108.41 -97.08 71 1 LEU B 630 ? ? 63.73 -59.61 72 1 HIS B 642 ? ? -97.06 -82.99 73 1 ARG B 644 ? ? -88.71 44.31 74 1 VAL B 659 ? ? -79.11 -118.74 75 1 ASN B 661 ? ? -30.93 -81.05 76 1 ARG B 663 ? ? -60.15 -158.61 77 1 LYS B 664 ? ? 22.77 68.78 78 1 CYS B 665 ? ? 154.21 -5.26 # 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 GLU 184 ? CG ? A GLU 173 CG 2 1 Y 1 A GLU 184 ? CD ? A GLU 173 CD 3 1 Y 1 A GLU 184 ? OE1 ? A GLU 173 OE1 4 1 Y 1 A GLU 184 ? OE2 ? A GLU 173 OE2 5 1 Y 1 A ARG 238 ? CG ? A ARG 227 CG 6 1 Y 1 A ARG 238 ? CD ? A ARG 227 CD 7 1 Y 1 A ARG 238 ? NE ? A ARG 227 NE 8 1 Y 1 A ARG 238 ? CZ ? A ARG 227 CZ 9 1 Y 1 A ARG 238 ? NH1 ? A ARG 227 NH1 10 1 Y 1 A ARG 238 ? NH2 ? A ARG 227 NH2 11 1 Y 1 A ARG 292 ? CG ? A ARG 281 CG 12 1 Y 1 A ARG 292 ? CD ? A ARG 281 CD 13 1 Y 1 A ARG 292 ? NE ? A ARG 281 NE 14 1 Y 1 A ARG 292 ? CZ ? A ARG 281 CZ 15 1 Y 1 A ARG 292 ? NH1 ? A ARG 281 NH1 16 1 Y 1 A ARG 292 ? NH2 ? A ARG 281 NH2 17 1 Y 1 A ASN 322 ? CG ? A ASN 311 CG 18 1 Y 1 A ASN 322 ? OD1 ? A ASN 311 OD1 19 1 Y 1 A ASN 322 ? ND2 ? A ASN 311 ND2 20 1 Y 1 A LYS 323 ? CG ? A LYS 312 CG 21 1 Y 1 A LYS 323 ? CD ? A LYS 312 CD 22 1 Y 1 A LYS 323 ? CE ? A LYS 312 CE 23 1 Y 1 A LYS 323 ? NZ ? A LYS 312 NZ 24 1 Y 1 A LYS 492 ? CG ? A LYS 481 CG 25 1 Y 1 A LYS 492 ? CD ? A LYS 481 CD 26 1 Y 1 A LYS 492 ? CE ? A LYS 481 CE 27 1 Y 1 A LYS 492 ? NZ ? A LYS 481 NZ 28 1 Y 1 A ILE 493 ? CG1 ? A ILE 482 CG1 29 1 Y 1 A ILE 493 ? CG2 ? A ILE 482 CG2 30 1 Y 1 A ILE 493 ? CD1 ? A ILE 482 CD1 31 1 Y 1 A ARG 494 ? CG ? A ARG 483 CG 32 1 Y 1 A ARG 494 ? CD ? A ARG 483 CD 33 1 Y 1 A ARG 494 ? NE ? A ARG 483 NE 34 1 Y 1 A ARG 494 ? CZ ? A ARG 483 CZ 35 1 Y 1 A ARG 494 ? NH1 ? A ARG 483 NH1 36 1 Y 1 A ARG 494 ? NH2 ? A ARG 483 NH2 37 1 Y 1 A ASP 714 ? CG ? A ASP 703 CG 38 1 Y 1 A ASP 714 ? OD1 ? A ASP 703 OD1 39 1 Y 1 A ASP 714 ? OD2 ? A ASP 703 OD2 40 1 Y 1 A LYS 716 ? CG ? A LYS 705 CG 41 1 Y 1 A LYS 716 ? CD ? A LYS 705 CD 42 1 Y 1 A LYS 716 ? CE ? A LYS 705 CE 43 1 Y 1 A LYS 716 ? NZ ? A LYS 705 NZ 44 1 Y 1 A ILE 742 ? CG1 ? A ILE 731 CG1 45 1 Y 1 A ILE 742 ? CG2 ? A ILE 731 CG2 46 1 Y 1 A ILE 742 ? CD1 ? A ILE 731 CD1 47 1 Y 1 A LYS 803 ? CG ? A LYS 792 CG 48 1 Y 1 A LYS 803 ? CD ? A LYS 792 CD 49 1 Y 1 A LYS 803 ? CE ? A LYS 792 CE 50 1 Y 1 A LYS 803 ? NZ ? A LYS 792 NZ 51 1 Y 1 A LYS 857 ? CG ? A LYS 846 CG 52 1 Y 1 A LYS 857 ? CD ? A LYS 846 CD 53 1 Y 1 A LYS 857 ? CE ? A LYS 846 CE 54 1 Y 1 A LYS 857 ? NZ ? A LYS 846 NZ 55 1 Y 1 B LYS 4 ? CG ? B LYS 23 CG 56 1 Y 1 B LYS 4 ? CD ? B LYS 23 CD 57 1 Y 1 B LYS 4 ? CE ? B LYS 23 CE 58 1 Y 1 B LYS 4 ? NZ ? B LYS 23 NZ 59 1 Y 1 B ARG 7 ? CG ? B ARG 26 CG 60 1 Y 1 B ARG 7 ? CD ? B ARG 26 CD 61 1 Y 1 B ARG 7 ? NE ? B ARG 26 NE 62 1 Y 1 B ARG 7 ? CZ ? B ARG 26 CZ 63 1 Y 1 B ARG 7 ? NH1 ? B ARG 26 NH1 64 1 Y 1 B ARG 7 ? NH2 ? B ARG 26 NH2 65 1 Y 1 B GLU 13 ? CG ? B GLU 32 CG 66 1 Y 1 B GLU 13 ? CD ? B GLU 32 CD 67 1 Y 1 B GLU 13 ? OE1 ? B GLU 32 OE1 68 1 Y 1 B GLU 13 ? OE2 ? B GLU 32 OE2 69 1 Y 1 B THR 17 ? OG1 ? B THR 36 OG1 70 1 Y 1 B THR 17 ? CG2 ? B THR 36 CG2 71 1 Y 1 B LYS 18 ? CG ? B LYS 37 CG 72 1 Y 1 B LYS 18 ? CD ? B LYS 37 CD 73 1 Y 1 B LYS 18 ? CE ? B LYS 37 CE 74 1 Y 1 B LYS 18 ? NZ ? B LYS 37 NZ 75 1 Y 1 B GLN 20 ? CG ? B GLN 39 CG 76 1 Y 1 B GLN 20 ? CD ? B GLN 39 CD 77 1 Y 1 B GLN 20 ? OE1 ? B GLN 39 OE1 78 1 Y 1 B GLN 20 ? NE2 ? B GLN 39 NE2 79 1 Y 1 B SER 21 ? OG ? B SER 40 OG 80 1 Y 1 B PHE 22 ? CG ? B PHE 41 CG 81 1 Y 1 B PHE 22 ? CD1 ? B PHE 41 CD1 82 1 Y 1 B PHE 22 ? CD2 ? B PHE 41 CD2 83 1 Y 1 B PHE 22 ? CE1 ? B PHE 41 CE1 84 1 Y 1 B PHE 22 ? CE2 ? B PHE 41 CE2 85 1 Y 1 B PHE 22 ? CZ ? B PHE 41 CZ 86 1 Y 1 B ARG 23 ? CG ? B ARG 42 CG 87 1 Y 1 B ARG 23 ? CD ? B ARG 42 CD 88 1 Y 1 B ARG 23 ? NE ? B ARG 42 NE 89 1 Y 1 B ARG 23 ? CZ ? B ARG 42 CZ 90 1 Y 1 B ARG 23 ? NH1 ? B ARG 42 NH1 91 1 Y 1 B ARG 23 ? NH2 ? B ARG 42 NH2 92 1 Y 1 B ASP 24 ? CG ? B ASP 43 CG 93 1 Y 1 B ASP 24 ? OD1 ? B ASP 43 OD1 94 1 Y 1 B ASP 24 ? OD2 ? B ASP 43 OD2 95 1 Y 1 B HIS 25 ? CG ? B HIS 44 CG 96 1 Y 1 B HIS 25 ? ND1 ? B HIS 44 ND1 97 1 Y 1 B HIS 25 ? CD2 ? B HIS 44 CD2 98 1 Y 1 B HIS 25 ? CE1 ? B HIS 44 CE1 99 1 Y 1 B HIS 25 ? NE2 ? B HIS 44 NE2 100 1 Y 1 B MET 26 ? CG ? B MET 45 CG 101 1 Y 1 B MET 26 ? SD ? B MET 45 SD 102 1 Y 1 B MET 26 ? CE ? B MET 45 CE 103 1 Y 1 B LYS 27 ? CG ? B LYS 46 CG 104 1 Y 1 B LYS 27 ? CD ? B LYS 46 CD 105 1 Y 1 B LYS 27 ? CE ? B LYS 46 CE 106 1 Y 1 B LYS 27 ? NZ ? B LYS 46 NZ 107 1 Y 1 B SER 32 ? OG ? B SER 51 OG 108 1 Y 1 B ASP 33 ? CG ? B ASP 52 CG 109 1 Y 1 B ASP 33 ? OD1 ? B ASP 52 OD1 110 1 Y 1 B ASP 33 ? OD2 ? B ASP 52 OD2 111 1 Y 1 B LYS 41 ? CG ? B LYS 60 CG 112 1 Y 1 B LYS 41 ? CD ? B LYS 60 CD 113 1 Y 1 B LYS 41 ? CE ? B LYS 60 CE 114 1 Y 1 B LYS 41 ? NZ ? B LYS 60 NZ 115 1 Y 1 B LYS 78 ? CG ? B LYS 97 CG 116 1 Y 1 B LYS 78 ? CD ? B LYS 97 CD 117 1 Y 1 B LYS 78 ? CE ? B LYS 97 CE 118 1 Y 1 B LYS 78 ? NZ ? B LYS 97 NZ 119 1 Y 1 B LYS 88 ? CG ? B LYS 107 CG 120 1 Y 1 B LYS 88 ? CD ? B LYS 107 CD 121 1 Y 1 B LYS 88 ? CE ? B LYS 107 CE 122 1 Y 1 B LYS 88 ? NZ ? B LYS 107 NZ 123 1 Y 1 B GLU 89 ? CG ? B GLU 108 CG 124 1 Y 1 B GLU 89 ? CD ? B GLU 108 CD 125 1 Y 1 B GLU 89 ? OE1 ? B GLU 108 OE1 126 1 Y 1 B GLU 89 ? OE2 ? B GLU 108 OE2 127 1 Y 1 B LYS 144 ? CG ? B LYS 163 CG 128 1 Y 1 B LYS 144 ? CD ? B LYS 163 CD 129 1 Y 1 B LYS 144 ? CE ? B LYS 163 CE 130 1 Y 1 B LYS 144 ? NZ ? B LYS 163 NZ 131 1 Y 1 B LYS 148 ? CG ? B LYS 167 CG 132 1 Y 1 B LYS 148 ? CD ? B LYS 167 CD 133 1 Y 1 B LYS 148 ? CE ? B LYS 167 CE 134 1 Y 1 B LYS 148 ? NZ ? B LYS 167 NZ 135 1 Y 1 B LEU 182 ? CG ? B LEU 201 CG 136 1 Y 1 B LEU 182 ? CD1 ? B LEU 201 CD1 137 1 Y 1 B LEU 182 ? CD2 ? B LEU 201 CD2 138 1 Y 1 B LYS 193 ? CG ? B LYS 212 CG 139 1 Y 1 B LYS 193 ? CD ? B LYS 212 CD 140 1 Y 1 B LYS 193 ? CE ? B LYS 212 CE 141 1 Y 1 B LYS 193 ? NZ ? B LYS 212 NZ 142 1 Y 1 B ARG 254 ? CG ? B ARG 273 CG 143 1 Y 1 B ARG 254 ? CD ? B ARG 273 CD 144 1 Y 1 B ARG 254 ? NE ? B ARG 273 NE 145 1 Y 1 B ARG 254 ? CZ ? B ARG 273 CZ 146 1 Y 1 B ARG 254 ? NH1 ? B ARG 273 NH1 147 1 Y 1 B ARG 254 ? NH2 ? B ARG 273 NH2 148 1 Y 1 B MET 256 ? CG ? B MET 275 CG 149 1 Y 1 B MET 256 ? SD ? B MET 275 SD 150 1 Y 1 B MET 256 ? CE ? B MET 275 CE 151 1 Y 1 B LYS 259 ? CG ? B LYS 278 CG 152 1 Y 1 B LYS 259 ? CD ? B LYS 278 CD 153 1 Y 1 B LYS 259 ? CE ? B LYS 278 CE 154 1 Y 1 B LYS 259 ? NZ ? B LYS 278 NZ 155 1 Y 1 B GLU 265 ? CG ? B GLU 284 CG 156 1 Y 1 B GLU 265 ? CD ? B GLU 284 CD 157 1 Y 1 B GLU 265 ? OE1 ? B GLU 284 OE1 158 1 Y 1 B GLU 265 ? OE2 ? B GLU 284 OE2 159 1 Y 1 B GLN 269 ? CG ? B GLN 288 CG 160 1 Y 1 B GLN 269 ? CD ? B GLN 288 CD 161 1 Y 1 B GLN 269 ? OE1 ? B GLN 288 OE1 162 1 Y 1 B GLN 269 ? NE2 ? B GLN 288 NE2 163 1 Y 1 B LYS 276 ? CG ? B LYS 295 CG 164 1 Y 1 B LYS 276 ? CD ? B LYS 295 CD 165 1 Y 1 B LYS 276 ? CE ? B LYS 295 CE 166 1 Y 1 B LYS 276 ? NZ ? B LYS 295 NZ 167 1 Y 1 B ASP 277 ? CG ? B ASP 296 CG 168 1 Y 1 B ASP 277 ? OD1 ? B ASP 296 OD1 169 1 Y 1 B ASP 277 ? OD2 ? B ASP 296 OD2 170 1 Y 1 B LYS 278 ? CG ? B LYS 297 CG 171 1 Y 1 B LYS 278 ? CD ? B LYS 297 CD 172 1 Y 1 B LYS 278 ? CE ? B LYS 297 CE 173 1 Y 1 B LYS 278 ? NZ ? B LYS 297 NZ 174 1 Y 1 B LYS 280 ? CG ? B LYS 299 CG 175 1 Y 1 B LYS 280 ? CD ? B LYS 299 CD 176 1 Y 1 B LYS 280 ? CE ? B LYS 299 CE 177 1 Y 1 B LYS 280 ? NZ ? B LYS 299 NZ 178 1 Y 1 B GLU 281 ? CG ? B GLU 300 CG 179 1 Y 1 B GLU 281 ? CD ? B GLU 300 CD 180 1 Y 1 B GLU 281 ? OE1 ? B GLU 300 OE1 181 1 Y 1 B GLU 281 ? OE2 ? B GLU 300 OE2 182 1 Y 1 B PHE 282 ? CG ? B PHE 301 CG 183 1 Y 1 B PHE 282 ? CD1 ? B PHE 301 CD1 184 1 Y 1 B PHE 282 ? CD2 ? B PHE 301 CD2 185 1 Y 1 B PHE 282 ? CE1 ? B PHE 301 CE1 186 1 Y 1 B PHE 282 ? CE2 ? B PHE 301 CE2 187 1 Y 1 B PHE 282 ? CZ ? B PHE 301 CZ 188 1 Y 1 B LEU 284 ? CG ? B LEU 303 CG 189 1 Y 1 B LEU 284 ? CD1 ? B LEU 303 CD1 190 1 Y 1 B LEU 284 ? CD2 ? B LEU 303 CD2 191 1 Y 1 B LYS 291 ? CG ? B LYS 310 CG 192 1 Y 1 B LYS 291 ? CD ? B LYS 310 CD 193 1 Y 1 B LYS 291 ? CE ? B LYS 310 CE 194 1 Y 1 B LYS 291 ? NZ ? B LYS 310 NZ 195 1 Y 1 B LEU 293 ? CG ? B LEU 312 CG 196 1 Y 1 B LEU 293 ? CD1 ? B LEU 312 CD1 197 1 Y 1 B LEU 293 ? CD2 ? B LEU 312 CD2 198 1 Y 1 B LYS 296 ? CG ? B LYS 315 CG 199 1 Y 1 B LYS 296 ? CD ? B LYS 315 CD 200 1 Y 1 B LYS 296 ? CE ? B LYS 315 CE 201 1 Y 1 B LYS 296 ? NZ ? B LYS 315 NZ 202 1 Y 1 B LYS 304 ? CG ? B LYS 323 CG 203 1 Y 1 B LYS 304 ? CD ? B LYS 323 CD 204 1 Y 1 B LYS 304 ? CE ? B LYS 323 CE 205 1 Y 1 B LYS 304 ? NZ ? B LYS 323 NZ 206 1 Y 1 B LYS 448 ? CG ? B LYS 467 CG 207 1 Y 1 B LYS 448 ? CD ? B LYS 467 CD 208 1 Y 1 B LYS 448 ? CE ? B LYS 467 CE 209 1 Y 1 B LYS 448 ? NZ ? B LYS 467 NZ 210 1 Y 1 B ARG 475 ? CG ? B ARG 494 CG 211 1 Y 1 B ARG 475 ? CD ? B ARG 494 CD 212 1 Y 1 B ARG 475 ? NE ? B ARG 494 NE 213 1 Y 1 B ARG 475 ? CZ ? B ARG 494 CZ 214 1 Y 1 B ARG 475 ? NH1 ? B ARG 494 NH1 215 1 Y 1 B ARG 475 ? NH2 ? B ARG 494 NH2 216 1 Y 1 B LYS 489 ? CG ? B LYS 508 CG 217 1 Y 1 B LYS 489 ? CD ? B LYS 508 CD 218 1 Y 1 B LYS 489 ? CE ? B LYS 508 CE 219 1 Y 1 B LYS 489 ? NZ ? B LYS 508 NZ 220 1 Y 1 B LYS 496 ? CG ? B LYS 515 CG 221 1 Y 1 B LYS 496 ? CD ? B LYS 515 CD 222 1 Y 1 B LYS 496 ? CE ? B LYS 515 CE 223 1 Y 1 B LYS 496 ? NZ ? B LYS 515 NZ 224 1 Y 1 B LEU 503 ? CG ? B LEU 522 CG 225 1 Y 1 B LEU 503 ? CD1 ? B LEU 522 CD1 226 1 Y 1 B LEU 503 ? CD2 ? B LEU 522 CD2 227 1 Y 1 B LYS 511 ? CG ? B LYS 530 CG 228 1 Y 1 B LYS 511 ? CD ? B LYS 530 CD 229 1 Y 1 B LYS 511 ? CE ? B LYS 530 CE 230 1 Y 1 B LYS 511 ? NZ ? B LYS 530 NZ 231 1 Y 1 B LYS 552 ? CG ? B LYS 571 CG 232 1 Y 1 B LYS 552 ? CD ? B LYS 571 CD 233 1 Y 1 B LYS 552 ? CE ? B LYS 571 CE 234 1 Y 1 B LYS 552 ? NZ ? B LYS 571 NZ 235 1 Y 1 B LEU 662 ? CG ? B LEU 681 CG 236 1 Y 1 B LEU 662 ? CD1 ? B LEU 681 CD1 237 1 Y 1 B LEU 662 ? CD2 ? B LEU 681 CD2 238 1 Y 1 B ARG 663 ? CG ? B ARG 682 CG 239 1 Y 1 B ARG 663 ? CD ? B ARG 682 CD 240 1 Y 1 B ARG 663 ? NE ? B ARG 682 NE 241 1 Y 1 B ARG 663 ? CZ ? B ARG 682 CZ 242 1 Y 1 B ARG 663 ? NH1 ? B ARG 682 NH1 243 1 Y 1 B ARG 663 ? NH2 ? B ARG 682 NH2 244 1 Y 1 B LYS 664 ? CG ? B LYS 683 CG 245 1 Y 1 B LYS 664 ? CD ? B LYS 683 CD 246 1 Y 1 B LYS 664 ? CE ? B LYS 683 CE 247 1 Y 1 B LYS 664 ? NZ ? B LYS 683 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 MET 12 ? A MET 1 2 1 Y 1 A ASP 13 ? A ASP 2 3 1 Y 1 A ILE 14 ? A ILE 3 4 1 Y 1 A HIS 15 ? A HIS 4 5 1 Y 1 A HIS 16 ? A HIS 5 6 1 Y 1 A HIS 17 ? A HIS 6 7 1 Y 1 A HIS 18 ? A HIS 7 8 1 Y 1 A HIS 19 ? A HIS 8 9 1 Y 1 A HIS 20 ? A HIS 9 10 1 Y 1 A HIS 21 ? A HIS 10 11 1 Y 1 A HIS 22 ? A HIS 11 12 1 Y 1 A HIS 23 ? A HIS 12 13 1 Y 1 A HIS 24 ? A HIS 13 14 1 Y 1 A GLU 25 ? A GLU 14 15 1 Y 1 A ASN 26 ? A ASN 15 16 1 Y 1 A VAL 27 ? A VAL 16 17 1 Y 1 A GLN 28 ? A GLN 17 18 1 Y 1 A ALA 29 ? A ALA 18 19 1 Y 1 A GLY 30 ? A GLY 19 20 1 Y 1 A GLN 31 ? A GLN 20 21 1 Y 1 A ALA 32 ? A ALA 21 22 1 Y 1 A GLN 33 ? A GLN 22 23 1 Y 1 A GLU 34 ? A GLU 23 24 1 Y 1 A LYS 35 ? A LYS 24 25 1 Y 1 A GLN 36 ? A GLN 25 26 1 Y 1 A LEU 37 ? A LEU 26 27 1 Y 1 A ASP 38 ? A ASP 27 28 1 Y 1 A THR 39 ? A THR 28 29 1 Y 1 A ILE 40 ? A ILE 29 30 1 Y 1 A GLN 41 ? A GLN 30 31 1 Y 1 A VAL 42 ? A VAL 31 32 1 Y 1 A LYS 43 ? A LYS 32 33 1 Y 1 A ALA 44 ? A ALA 33 34 1 Y 1 A LYS 45 ? A LYS 34 35 1 Y 1 A LYS 46 ? A LYS 35 36 1 Y 1 A GLN 47 ? A GLN 36 37 1 Y 1 A LYS 48 ? A LYS 37 38 1 Y 1 A THR 49 ? A THR 38 39 1 Y 1 A ARG 50 ? A ARG 39 40 1 Y 1 A ARG 51 ? A ARG 40 41 1 Y 1 A ASP 52 ? A ASP 41 42 1 Y 1 A ASN 53 ? A ASN 42 43 1 Y 1 A THR 490 ? A THR 479 44 1 Y 1 A ALA 491 ? A ALA 480 45 1 Y 1 A TRP 748 ? A TRP 737 46 1 Y 1 A ASP 749 ? A ASP 738 47 1 Y 1 A LYS 750 ? A LYS 739 48 1 Y 1 A LEU 751 ? A LEU 740 49 1 Y 1 A PRO 752 ? A PRO 741 50 1 Y 1 A GLU 753 ? A GLU 742 51 1 Y 1 A GLY 754 ? A GLY 743 52 1 Y 1 B MET -18 ? B MET 1 53 1 Y 1 B ARG -17 ? B ARG 2 54 1 Y 1 B LEU -16 ? B LEU 3 55 1 Y 1 B ALA -15 ? B ALA 4 56 1 Y 1 B VAL -14 ? B VAL 5 57 1 Y 1 B GLY -13 ? B GLY 6 58 1 Y 1 B ALA -12 ? B ALA 7 59 1 Y 1 B LEU -11 ? B LEU 8 60 1 Y 1 B LEU -10 ? B LEU 9 61 1 Y 1 B VAL -9 ? B VAL 10 62 1 Y 1 B CYS -8 ? B CYS 11 63 1 Y 1 B ALA -7 ? B ALA 12 64 1 Y 1 B VAL -6 ? B VAL 13 65 1 Y 1 B LEU -5 ? B LEU 14 66 1 Y 1 B GLY -4 ? B GLY 15 67 1 Y 1 B LEU -3 ? B LEU 16 68 1 Y 1 B CYS -2 ? B CYS 17 69 1 Y 1 B LEU -1 ? B LEU 18 70 1 Y 1 B ALA 0 ? B ALA 19 71 1 Y 1 B VAL 1 ? B VAL 20 72 1 Y 1 B PRO 2 ? B PRO 21 73 1 Y 1 B ASP 3 ? B ASP 22 # loop_ _pdbx_entity_nonpoly.entity_id _pdbx_entity_nonpoly.name _pdbx_entity_nonpoly.comp_id 3 '(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE' C8E 4 N-ACETYL-D-GLUCOSAMINE NAG 5 BETA-D-MANNOSE BMA 6 ALPHA-D-MANNOSE MAN 7 BETA-D-GALACTOSE GAL 8 'O-SIALIC ACID' SIA 9 water HOH # loop_ _pdbx_nonpoly_scheme.asym_id _pdbx_nonpoly_scheme.entity_id _pdbx_nonpoly_scheme.mon_id _pdbx_nonpoly_scheme.ndb_seq_num _pdbx_nonpoly_scheme.pdb_seq_num _pdbx_nonpoly_scheme.auth_seq_num _pdbx_nonpoly_scheme.pdb_mon_id _pdbx_nonpoly_scheme.auth_mon_id _pdbx_nonpoly_scheme.pdb_strand_id _pdbx_nonpoly_scheme.pdb_ins_code C 3 C8E 1 1001 1001 C8E C8E A . D 3 C8E 1 1002 1002 C8E C8E A . E 4 NAG 1 701 701 NAG NAG B . F 4 NAG 2 702 702 NAG NAG B . G 5 BMA 3 703 703 BMA BMA B . H 6 MAN 4 704 704 MAN MAN B . I 4 NAG 5 705 705 NAG NAG B . J 7 GAL 6 706 706 GAL GAL B . K 8 SIA 7 707 707 SIA SIA B . L 6 MAN 8 708 708 MAN MAN B . M 4 NAG 9 709 709 NAG NAG B . N 7 GAL 10 710 710 GAL GAL B . O 4 NAG 1 711 711 NAG NAG B . P 4 NAG 2 712 712 NAG NAG B . Q 5 BMA 3 713 713 BMA BMA B . R 6 MAN 4 714 714 MAN MAN B . S 4 NAG 5 715 715 NAG NAG B . T 7 GAL 6 716 716 GAL GAL B . U 8 SIA 7 717 717 SIA SIA B . V 6 MAN 8 718 718 MAN MAN B . W 4 NAG 9 719 719 NAG NAG B . X 9 HOH 1 1101 1101 HOH HOH A . X 9 HOH 2 1102 1102 HOH HOH A . X 9 HOH 3 1103 1103 HOH HOH A . X 9 HOH 4 1104 1104 HOH HOH A . X 9 HOH 5 1105 1105 HOH HOH A . X 9 HOH 6 1106 1106 HOH HOH A . X 9 HOH 7 1107 1107 HOH HOH A . X 9 HOH 8 1108 1108 HOH HOH A . X 9 HOH 9 1109 1109 HOH HOH A . X 9 HOH 10 1110 1110 HOH HOH A . X 9 HOH 11 1111 1111 HOH HOH A . X 9 HOH 12 1112 1112 HOH HOH A . X 9 HOH 13 1113 1113 HOH HOH A . X 9 HOH 14 1114 1114 HOH HOH A . X 9 HOH 15 1115 1115 HOH HOH A . X 9 HOH 16 1116 1116 HOH HOH A . X 9 HOH 17 1117 1117 HOH HOH A . X 9 HOH 18 1118 1118 HOH HOH A . X 9 HOH 19 1119 1119 HOH HOH A . X 9 HOH 20 1120 1120 HOH HOH A . X 9 HOH 21 1121 1121 HOH HOH A . X 9 HOH 22 1122 1122 HOH HOH A . X 9 HOH 23 1123 1123 HOH HOH A . X 9 HOH 24 1124 1124 HOH HOH A . X 9 HOH 25 1125 1125 HOH HOH A . X 9 HOH 26 1126 1126 HOH HOH A . X 9 HOH 27 1127 1127 HOH HOH A . X 9 HOH 28 1128 1128 HOH HOH A . X 9 HOH 29 1129 1129 HOH HOH A . X 9 HOH 30 1130 1130 HOH HOH A . X 9 HOH 31 1131 1131 HOH HOH A . X 9 HOH 32 1132 1132 HOH HOH A . X 9 HOH 33 1133 1133 HOH HOH A . X 9 HOH 34 1134 1134 HOH HOH A . X 9 HOH 35 1135 1135 HOH HOH A . X 9 HOH 36 1136 1136 HOH HOH A . X 9 HOH 37 1137 1137 HOH HOH A . X 9 HOH 38 1138 1138 HOH HOH A . X 9 HOH 39 1139 1139 HOH HOH A . X 9 HOH 40 1140 1140 HOH HOH A . X 9 HOH 41 1141 1141 HOH HOH A . X 9 HOH 42 1142 1142 HOH HOH A . X 9 HOH 43 1143 1143 HOH HOH A . X 9 HOH 44 1144 1144 HOH HOH A . X 9 HOH 45 1145 1145 HOH HOH A . X 9 HOH 46 1146 1146 HOH HOH A . X 9 HOH 47 1147 1147 HOH HOH A . X 9 HOH 48 1148 1148 HOH HOH A . X 9 HOH 49 1149 1149 HOH HOH A . X 9 HOH 50 1150 1150 HOH HOH A . X 9 HOH 51 1151 1152 HOH HOH A . X 9 HOH 52 1152 1153 HOH HOH A . X 9 HOH 53 1153 1154 HOH HOH A . X 9 HOH 54 1154 1155 HOH HOH A . X 9 HOH 55 1155 1156 HOH HOH A . X 9 HOH 56 1156 1157 HOH HOH A . X 9 HOH 57 1157 1158 HOH HOH A . X 9 HOH 58 1158 1159 HOH HOH A . X 9 HOH 59 1159 1160 HOH HOH A . X 9 HOH 60 1160 1161 HOH HOH A . X 9 HOH 61 1161 1162 HOH HOH A . X 9 HOH 62 1162 1163 HOH HOH A . X 9 HOH 63 1163 1164 HOH HOH A . X 9 HOH 64 1164 1165 HOH HOH A . X 9 HOH 65 1165 1166 HOH HOH A . X 9 HOH 66 1166 1167 HOH HOH A . X 9 HOH 67 1167 1168 HOH HOH A . X 9 HOH 68 1168 1170 HOH HOH A . X 9 HOH 69 1169 1171 HOH HOH A . X 9 HOH 70 1170 1172 HOH HOH A . X 9 HOH 71 1171 1173 HOH HOH A . X 9 HOH 72 1172 1174 HOH HOH A . X 9 HOH 73 1173 1175 HOH HOH A . X 9 HOH 74 1174 1176 HOH HOH A . X 9 HOH 75 1175 1177 HOH HOH A . X 9 HOH 76 1176 1178 HOH HOH A . X 9 HOH 77 1177 1179 HOH HOH A . X 9 HOH 78 1178 1180 HOH HOH A . X 9 HOH 79 1179 1181 HOH HOH A . X 9 HOH 80 1180 1182 HOH HOH A . X 9 HOH 81 1181 1183 HOH HOH A . X 9 HOH 82 1182 1184 HOH HOH A . X 9 HOH 83 1183 1185 HOH HOH A . X 9 HOH 84 1184 1186 HOH HOH A . X 9 HOH 85 1185 1187 HOH HOH A . X 9 HOH 86 1186 1188 HOH HOH A . X 9 HOH 87 1187 1189 HOH HOH A . X 9 HOH 88 1188 1190 HOH HOH A . X 9 HOH 89 1189 1191 HOH HOH A . X 9 HOH 90 1190 1192 HOH HOH A . X 9 HOH 91 1191 1193 HOH HOH A . X 9 HOH 92 1192 1194 HOH HOH A . X 9 HOH 93 1193 1195 HOH HOH A . X 9 HOH 94 1194 1196 HOH HOH A . X 9 HOH 95 1195 1197 HOH HOH A . X 9 HOH 96 1196 1198 HOH HOH A . X 9 HOH 97 1197 1199 HOH HOH A . X 9 HOH 98 1198 1200 HOH HOH A . X 9 HOH 99 1199 1201 HOH HOH A . X 9 HOH 100 1200 1202 HOH HOH A . X 9 HOH 101 1201 1203 HOH HOH A . X 9 HOH 102 1202 1204 HOH HOH A . X 9 HOH 103 1203 1205 HOH HOH A . X 9 HOH 104 1204 1206 HOH HOH A . X 9 HOH 105 1205 1207 HOH HOH A . X 9 HOH 106 1206 1208 HOH HOH A . X 9 HOH 107 1207 1209 HOH HOH A . X 9 HOH 108 1208 1210 HOH HOH A . X 9 HOH 109 1209 1211 HOH HOH A . X 9 HOH 110 1210 1212 HOH HOH A . X 9 HOH 111 1211 1213 HOH HOH A . X 9 HOH 112 1212 1215 HOH HOH A . X 9 HOH 113 1213 1216 HOH HOH A . X 9 HOH 114 1214 1217 HOH HOH A . X 9 HOH 115 1215 1218 HOH HOH A . X 9 HOH 116 1216 1219 HOH HOH A . X 9 HOH 117 1217 1220 HOH HOH A . X 9 HOH 118 1218 1221 HOH HOH A . X 9 HOH 119 1219 1222 HOH HOH A . X 9 HOH 120 1220 1223 HOH HOH A . X 9 HOH 121 1221 1224 HOH HOH A . X 9 HOH 122 1222 1225 HOH HOH A . X 9 HOH 123 1223 1226 HOH HOH A . X 9 HOH 124 1224 1227 HOH HOH A . X 9 HOH 125 1225 1228 HOH HOH A . X 9 HOH 126 1226 1229 HOH HOH A . X 9 HOH 127 1227 1230 HOH HOH A . X 9 HOH 128 1228 1231 HOH HOH A . X 9 HOH 129 1229 824 HOH HOH A . X 9 HOH 130 1230 856 HOH HOH A . X 9 HOH 131 1231 1 HOH HOH A . X 9 HOH 132 1232 2 HOH HOH A . X 9 HOH 133 1233 3 HOH HOH A . X 9 HOH 134 1234 4 HOH HOH A . X 9 HOH 135 1235 5 HOH HOH A . X 9 HOH 136 1236 6 HOH HOH A . X 9 HOH 137 1237 8 HOH HOH A . X 9 HOH 138 1238 9 HOH HOH A . X 9 HOH 139 1239 10 HOH HOH A . X 9 HOH 140 1240 11 HOH HOH A . X 9 HOH 141 1241 14 HOH HOH A . X 9 HOH 142 1242 19 HOH HOH A . Y 9 HOH 1 801 1151 HOH HOH B . Y 9 HOH 2 802 1214 HOH HOH B . Y 9 HOH 3 803 801 HOH HOH B . Y 9 HOH 4 804 802 HOH HOH B . Y 9 HOH 5 805 803 HOH HOH B . Y 9 HOH 6 806 804 HOH HOH B . Y 9 HOH 7 807 805 HOH HOH B . Y 9 HOH 8 808 806 HOH HOH B . Y 9 HOH 9 809 807 HOH HOH B . Y 9 HOH 10 810 808 HOH HOH B . Y 9 HOH 11 811 809 HOH HOH B . Y 9 HOH 12 812 810 HOH HOH B . Y 9 HOH 13 813 811 HOH HOH B . Y 9 HOH 14 814 812 HOH HOH B . Y 9 HOH 15 815 813 HOH HOH B . Y 9 HOH 16 816 814 HOH HOH B . Y 9 HOH 17 817 815 HOH HOH B . Y 9 HOH 18 818 816 HOH HOH B . Y 9 HOH 19 819 817 HOH HOH B . Y 9 HOH 20 820 818 HOH HOH B . Y 9 HOH 21 821 819 HOH HOH B . Y 9 HOH 22 822 820 HOH HOH B . Y 9 HOH 23 823 821 HOH HOH B . Y 9 HOH 24 824 822 HOH HOH B . Y 9 HOH 25 825 823 HOH HOH B . Y 9 HOH 26 826 825 HOH HOH B . Y 9 HOH 27 827 826 HOH HOH B . Y 9 HOH 28 828 827 HOH HOH B . Y 9 HOH 29 829 828 HOH HOH B . Y 9 HOH 30 830 829 HOH HOH B . Y 9 HOH 31 831 830 HOH HOH B . Y 9 HOH 32 832 831 HOH HOH B . Y 9 HOH 33 833 832 HOH HOH B . Y 9 HOH 34 834 833 HOH HOH B . Y 9 HOH 35 835 834 HOH HOH B . Y 9 HOH 36 836 835 HOH HOH B . Y 9 HOH 37 837 836 HOH HOH B . Y 9 HOH 38 838 837 HOH HOH B . Y 9 HOH 39 839 838 HOH HOH B . Y 9 HOH 40 840 839 HOH HOH B . Y 9 HOH 41 841 840 HOH HOH B . Y 9 HOH 42 842 841 HOH HOH B . Y 9 HOH 43 843 842 HOH HOH B . Y 9 HOH 44 844 843 HOH HOH B . Y 9 HOH 45 845 845 HOH HOH B . Y 9 HOH 46 846 846 HOH HOH B . Y 9 HOH 47 847 847 HOH HOH B . Y 9 HOH 48 848 848 HOH HOH B . Y 9 HOH 49 849 849 HOH HOH B . Y 9 HOH 50 850 850 HOH HOH B . Y 9 HOH 51 851 852 HOH HOH B . Y 9 HOH 52 852 853 HOH HOH B . Y 9 HOH 53 853 854 HOH HOH B . Y 9 HOH 54 854 855 HOH HOH B . Y 9 HOH 55 855 12 HOH HOH B . Y 9 HOH 56 856 13 HOH HOH B . Y 9 HOH 57 857 15 HOH HOH B . Y 9 HOH 58 858 16 HOH HOH B . Y 9 HOH 59 859 17 HOH HOH B . Y 9 HOH 60 860 18 HOH HOH B . Y 9 HOH 61 861 20 HOH HOH B . Y 9 HOH 62 862 21 HOH HOH B . #