data_2PT3 # _entry.id 2PT3 # _audit_conform.dict_name mmcif_pdbx.dic _audit_conform.dict_version 5.279 _audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic # loop_ _database_2.database_id _database_2.database_code PDB 2PT3 RCSB RCSB042751 WWPDB D_1000042751 # loop_ _pdbx_database_related.db_name _pdbx_database_related.db_id _pdbx_database_related.details _pdbx_database_related.content_type PDB 2NQX 'Crystal Structure of bovine lactoperoxidase with iodide ions at 2.9A resolution' unspecified PDB 2PUM 'Crystal structure of bovine lactoperoxidase complex with catechol and iodide at 2.7 A resolution' unspecified # _pdbx_database_status.status_code REL _pdbx_database_status.entry_id 2PT3 _pdbx_database_status.recvd_initial_deposition_date 2007-05-08 _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.pdb_format_compatible Y _pdbx_database_status.status_code_cs ? # loop_ _audit_author.name _audit_author.pdbx_ordinal 'Singh, A.K.' 1 'Singh, N.' 2 'Sharma, S.' 3 'Kaur, P.' 4 'Betzel, C.' 5 'Singh, T.P.' 6 # _citation.id primary _citation.title 'Crystal structure of bovine lactoperoxidase at 2.34 A resolution reveals multiple anion binding sites' _citation.journal_abbrev 'To be Published' _citation.journal_volume ? _citation.page_first ? _citation.page_last ? _citation.year ? _citation.journal_id_ASTM ? _citation.country ? _citation.journal_id_ISSN ? _citation.journal_id_CSD 0353 _citation.book_publisher ? _citation.pdbx_database_id_PubMed ? _citation.pdbx_database_id_DOI ? # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Singh, A.K.' 1 primary 'Singh, N.' 2 primary 'Sharma, S.' 3 primary 'Perbandt, M.' 4 primary 'Kaur, P.' 5 primary 'Betzel, C.' 6 primary 'Srinivasan, A.' 7 primary 'Singh, T.P.' 8 # _cell.entry_id 2PT3 _cell.length_a 53.910 _cell.length_b 80.051 _cell.length_c 75.675 _cell.angle_alpha 90.00 _cell.angle_beta 103.23 _cell.angle_gamma 90.00 _cell.Z_PDB 2 _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 2PT3 _symmetry.space_group_name_H-M 'P 1 21 1' _symmetry.pdbx_full_space_group_name_H-M ? _symmetry.cell_setting ? _symmetry.Int_Tables_number 4 _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 nat Lactoperoxidase 67853.281 1 1.11.1.7 ? Lactoperoxidase ? 2 non-polymer man N-ACETYL-D-GLUCOSAMINE 221.208 8 ? ? ? ? 3 non-polymer man ALPHA-D-MANNOSE 180.156 2 ? ? ? ? 4 non-polymer syn 'CALCIUM ION' 40.078 1 ? ? ? ? 5 non-polymer syn 'PHOSPHATE ION' 94.971 16 ? ? ? ? 6 non-polymer syn 'PROTOPORPHYRIN IX CONTAINING FE' 616.487 1 ? ? ? ? 7 water nat water 18.015 249 ? ? ? ? # _entity_name_com.entity_id 1 _entity_name_com.name LPO # _entity_poly.entity_id 1 _entity_poly.type 'polypeptide(L)' _entity_poly.nstd_linkage no _entity_poly.nstd_monomer yes _entity_poly.pdbx_seq_one_letter_code ;SWEVGCGAPVPLVKCDENSPYRTITGDCNNRRSPALGAANRALARWLPAEYEDGLALPFGWTQRKTRNGFRVPLAREVSN KIVGYLDEEGVLDQNRSLLFMQWGQIVDHDLDFAPETELGSNEHSKTQCEEYCIQGDNCFPIMFPKNDPKLKTQGKCMPF FRAGFVCPTPPYQSLAREQINAVTSFLDASLVYGSEP(SEP)LASRLRNLSSPLGLMAVNQEAWDHGLAYLPFNNKKPSP CEFINTTARVPCFLAGDFRASEQILLATAHTLLLREHNRLARELKKLNPHWNGEKLYQEARKILGAFIQIITFRDYLPIV LGSEMQKWIPPYQGYNNSVDPRISNVFTFAFRFGHMEVPSTVSRLDENYQPWGPEAELPLHTLFFNTWRIIKDGGIDPLV RGLLAKKSKLMNQDKMVTSELRNKLFQPTHKIHGFDLAAINLQRCRDHGMPGYNSWRGFCGLSQPKTLKGLQTVLKNKIL AKKLMDLYKTPDNIDIWIGGNAEPMVERGRVGPLLACLLGRQFQQIRDGDRFWWENPGVFTEKQRDSLQKVSFSRLICDN THITKVPLHAFQANNYPHDFVDCSTVDKLDLSPWASREN ; _entity_poly.pdbx_seq_one_letter_code_can ;SWEVGCGAPVPLVKCDENSPYRTITGDCNNRRSPALGAANRALARWLPAEYEDGLALPFGWTQRKTRNGFRVPLAREVSN KIVGYLDEEGVLDQNRSLLFMQWGQIVDHDLDFAPETELGSNEHSKTQCEEYCIQGDNCFPIMFPKNDPKLKTQGKCMPF FRAGFVCPTPPYQSLAREQINAVTSFLDASLVYGSEPSLASRLRNLSSPLGLMAVNQEAWDHGLAYLPFNNKKPSPCEFI NTTARVPCFLAGDFRASEQILLATAHTLLLREHNRLARELKKLNPHWNGEKLYQEARKILGAFIQIITFRDYLPIVLGSE MQKWIPPYQGYNNSVDPRISNVFTFAFRFGHMEVPSTVSRLDENYQPWGPEAELPLHTLFFNTWRIIKDGGIDPLVRGLL AKKSKLMNQDKMVTSELRNKLFQPTHKIHGFDLAAINLQRCRDHGMPGYNSWRGFCGLSQPKTLKGLQTVLKNKILAKKL MDLYKTPDNIDIWIGGNAEPMVERGRVGPLLACLLGRQFQQIRDGDRFWWENPGVFTEKQRDSLQKVSFSRLICDNTHIT KVPLHAFQANNYPHDFVDCSTVDKLDLSPWASREN ; _entity_poly.pdbx_strand_id A _entity_poly.pdbx_target_identifier ? # loop_ _entity_poly_seq.entity_id _entity_poly_seq.num _entity_poly_seq.mon_id _entity_poly_seq.hetero 1 1 SER n 1 2 TRP n 1 3 GLU n 1 4 VAL n 1 5 GLY n 1 6 CYS n 1 7 GLY n 1 8 ALA n 1 9 PRO n 1 10 VAL n 1 11 PRO n 1 12 LEU n 1 13 VAL n 1 14 LYS n 1 15 CYS n 1 16 ASP n 1 17 GLU n 1 18 ASN n 1 19 SER n 1 20 PRO n 1 21 TYR n 1 22 ARG n 1 23 THR n 1 24 ILE n 1 25 THR n 1 26 GLY n 1 27 ASP n 1 28 CYS n 1 29 ASN n 1 30 ASN n 1 31 ARG n 1 32 ARG n 1 33 SER n 1 34 PRO n 1 35 ALA n 1 36 LEU n 1 37 GLY n 1 38 ALA n 1 39 ALA n 1 40 ASN n 1 41 ARG n 1 42 ALA n 1 43 LEU n 1 44 ALA n 1 45 ARG n 1 46 TRP n 1 47 LEU n 1 48 PRO n 1 49 ALA n 1 50 GLU n 1 51 TYR n 1 52 GLU n 1 53 ASP n 1 54 GLY n 1 55 LEU n 1 56 ALA n 1 57 LEU n 1 58 PRO n 1 59 PHE n 1 60 GLY n 1 61 TRP n 1 62 THR n 1 63 GLN n 1 64 ARG n 1 65 LYS n 1 66 THR n 1 67 ARG n 1 68 ASN n 1 69 GLY n 1 70 PHE n 1 71 ARG n 1 72 VAL n 1 73 PRO n 1 74 LEU n 1 75 ALA n 1 76 ARG n 1 77 GLU n 1 78 VAL n 1 79 SER n 1 80 ASN n 1 81 LYS n 1 82 ILE n 1 83 VAL n 1 84 GLY n 1 85 TYR n 1 86 LEU n 1 87 ASP n 1 88 GLU n 1 89 GLU n 1 90 GLY n 1 91 VAL n 1 92 LEU n 1 93 ASP n 1 94 GLN n 1 95 ASN n 1 96 ARG n 1 97 SER n 1 98 LEU n 1 99 LEU n 1 100 PHE n 1 101 MET n 1 102 GLN n 1 103 TRP n 1 104 GLY n 1 105 GLN n 1 106 ILE n 1 107 VAL n 1 108 ASP n 1 109 HIS n 1 110 ASP n 1 111 LEU n 1 112 ASP n 1 113 PHE n 1 114 ALA n 1 115 PRO n 1 116 GLU n 1 117 THR n 1 118 GLU n 1 119 LEU n 1 120 GLY n 1 121 SER n 1 122 ASN n 1 123 GLU n 1 124 HIS n 1 125 SER n 1 126 LYS n 1 127 THR n 1 128 GLN n 1 129 CYS n 1 130 GLU n 1 131 GLU n 1 132 TYR n 1 133 CYS n 1 134 ILE n 1 135 GLN n 1 136 GLY n 1 137 ASP n 1 138 ASN n 1 139 CYS n 1 140 PHE n 1 141 PRO n 1 142 ILE n 1 143 MET n 1 144 PHE n 1 145 PRO n 1 146 LYS n 1 147 ASN n 1 148 ASP n 1 149 PRO n 1 150 LYS n 1 151 LEU n 1 152 LYS n 1 153 THR n 1 154 GLN n 1 155 GLY n 1 156 LYS n 1 157 CYS n 1 158 MET n 1 159 PRO n 1 160 PHE n 1 161 PHE n 1 162 ARG n 1 163 ALA n 1 164 GLY n 1 165 PHE n 1 166 VAL n 1 167 CYS n 1 168 PRO n 1 169 THR n 1 170 PRO n 1 171 PRO n 1 172 TYR n 1 173 GLN n 1 174 SER n 1 175 LEU n 1 176 ALA n 1 177 ARG n 1 178 GLU n 1 179 GLN n 1 180 ILE n 1 181 ASN n 1 182 ALA n 1 183 VAL n 1 184 THR n 1 185 SER n 1 186 PHE n 1 187 LEU n 1 188 ASP n 1 189 ALA n 1 190 SER n 1 191 LEU n 1 192 VAL n 1 193 TYR n 1 194 GLY n 1 195 SER n 1 196 GLU n 1 197 PRO n 1 198 SEP n 1 199 LEU n 1 200 ALA n 1 201 SER n 1 202 ARG n 1 203 LEU n 1 204 ARG n 1 205 ASN n 1 206 LEU n 1 207 SER n 1 208 SER n 1 209 PRO n 1 210 LEU n 1 211 GLY n 1 212 LEU n 1 213 MET n 1 214 ALA n 1 215 VAL n 1 216 ASN n 1 217 GLN n 1 218 GLU n 1 219 ALA n 1 220 TRP n 1 221 ASP n 1 222 HIS n 1 223 GLY n 1 224 LEU n 1 225 ALA n 1 226 TYR n 1 227 LEU n 1 228 PRO n 1 229 PHE n 1 230 ASN n 1 231 ASN n 1 232 LYS n 1 233 LYS n 1 234 PRO n 1 235 SER n 1 236 PRO n 1 237 CYS n 1 238 GLU n 1 239 PHE n 1 240 ILE n 1 241 ASN n 1 242 THR n 1 243 THR n 1 244 ALA n 1 245 ARG n 1 246 VAL n 1 247 PRO n 1 248 CYS n 1 249 PHE n 1 250 LEU n 1 251 ALA n 1 252 GLY n 1 253 ASP n 1 254 PHE n 1 255 ARG n 1 256 ALA n 1 257 SER n 1 258 GLU n 1 259 GLN n 1 260 ILE n 1 261 LEU n 1 262 LEU n 1 263 ALA n 1 264 THR n 1 265 ALA n 1 266 HIS n 1 267 THR n 1 268 LEU n 1 269 LEU n 1 270 LEU n 1 271 ARG n 1 272 GLU n 1 273 HIS n 1 274 ASN n 1 275 ARG n 1 276 LEU n 1 277 ALA n 1 278 ARG n 1 279 GLU n 1 280 LEU n 1 281 LYS n 1 282 LYS n 1 283 LEU n 1 284 ASN n 1 285 PRO n 1 286 HIS n 1 287 TRP n 1 288 ASN n 1 289 GLY n 1 290 GLU n 1 291 LYS n 1 292 LEU n 1 293 TYR n 1 294 GLN n 1 295 GLU n 1 296 ALA n 1 297 ARG n 1 298 LYS n 1 299 ILE n 1 300 LEU n 1 301 GLY n 1 302 ALA n 1 303 PHE n 1 304 ILE n 1 305 GLN n 1 306 ILE n 1 307 ILE n 1 308 THR n 1 309 PHE n 1 310 ARG n 1 311 ASP n 1 312 TYR n 1 313 LEU n 1 314 PRO n 1 315 ILE n 1 316 VAL n 1 317 LEU n 1 318 GLY n 1 319 SER n 1 320 GLU n 1 321 MET n 1 322 GLN n 1 323 LYS n 1 324 TRP n 1 325 ILE n 1 326 PRO n 1 327 PRO n 1 328 TYR n 1 329 GLN n 1 330 GLY n 1 331 TYR n 1 332 ASN n 1 333 ASN n 1 334 SER n 1 335 VAL n 1 336 ASP n 1 337 PRO n 1 338 ARG n 1 339 ILE n 1 340 SER n 1 341 ASN n 1 342 VAL n 1 343 PHE n 1 344 THR n 1 345 PHE n 1 346 ALA n 1 347 PHE n 1 348 ARG n 1 349 PHE n 1 350 GLY n 1 351 HIS n 1 352 MET n 1 353 GLU n 1 354 VAL n 1 355 PRO n 1 356 SER n 1 357 THR n 1 358 VAL n 1 359 SER n 1 360 ARG n 1 361 LEU n 1 362 ASP n 1 363 GLU n 1 364 ASN n 1 365 TYR n 1 366 GLN n 1 367 PRO n 1 368 TRP n 1 369 GLY n 1 370 PRO n 1 371 GLU n 1 372 ALA n 1 373 GLU n 1 374 LEU n 1 375 PRO n 1 376 LEU n 1 377 HIS n 1 378 THR n 1 379 LEU n 1 380 PHE n 1 381 PHE n 1 382 ASN n 1 383 THR n 1 384 TRP n 1 385 ARG n 1 386 ILE n 1 387 ILE n 1 388 LYS n 1 389 ASP n 1 390 GLY n 1 391 GLY n 1 392 ILE n 1 393 ASP n 1 394 PRO n 1 395 LEU n 1 396 VAL n 1 397 ARG n 1 398 GLY n 1 399 LEU n 1 400 LEU n 1 401 ALA n 1 402 LYS n 1 403 LYS n 1 404 SER n 1 405 LYS n 1 406 LEU n 1 407 MET n 1 408 ASN n 1 409 GLN n 1 410 ASP n 1 411 LYS n 1 412 MET n 1 413 VAL n 1 414 THR n 1 415 SER n 1 416 GLU n 1 417 LEU n 1 418 ARG n 1 419 ASN n 1 420 LYS n 1 421 LEU n 1 422 PHE n 1 423 GLN n 1 424 PRO n 1 425 THR n 1 426 HIS n 1 427 LYS n 1 428 ILE n 1 429 HIS n 1 430 GLY n 1 431 PHE n 1 432 ASP n 1 433 LEU n 1 434 ALA n 1 435 ALA n 1 436 ILE n 1 437 ASN n 1 438 LEU n 1 439 GLN n 1 440 ARG n 1 441 CYS n 1 442 ARG n 1 443 ASP n 1 444 HIS n 1 445 GLY n 1 446 MET n 1 447 PRO n 1 448 GLY n 1 449 TYR n 1 450 ASN n 1 451 SER n 1 452 TRP n 1 453 ARG n 1 454 GLY n 1 455 PHE n 1 456 CYS n 1 457 GLY n 1 458 LEU n 1 459 SER n 1 460 GLN n 1 461 PRO n 1 462 LYS n 1 463 THR n 1 464 LEU n 1 465 LYS n 1 466 GLY n 1 467 LEU n 1 468 GLN n 1 469 THR n 1 470 VAL n 1 471 LEU n 1 472 LYS n 1 473 ASN n 1 474 LYS n 1 475 ILE n 1 476 LEU n 1 477 ALA n 1 478 LYS n 1 479 LYS n 1 480 LEU n 1 481 MET n 1 482 ASP n 1 483 LEU n 1 484 TYR n 1 485 LYS n 1 486 THR n 1 487 PRO n 1 488 ASP n 1 489 ASN n 1 490 ILE n 1 491 ASP n 1 492 ILE n 1 493 TRP n 1 494 ILE n 1 495 GLY n 1 496 GLY n 1 497 ASN n 1 498 ALA n 1 499 GLU n 1 500 PRO n 1 501 MET n 1 502 VAL n 1 503 GLU n 1 504 ARG n 1 505 GLY n 1 506 ARG n 1 507 VAL n 1 508 GLY n 1 509 PRO n 1 510 LEU n 1 511 LEU n 1 512 ALA n 1 513 CYS n 1 514 LEU n 1 515 LEU n 1 516 GLY n 1 517 ARG n 1 518 GLN n 1 519 PHE n 1 520 GLN n 1 521 GLN n 1 522 ILE n 1 523 ARG n 1 524 ASP n 1 525 GLY n 1 526 ASP n 1 527 ARG n 1 528 PHE n 1 529 TRP n 1 530 TRP n 1 531 GLU n 1 532 ASN n 1 533 PRO n 1 534 GLY n 1 535 VAL n 1 536 PHE n 1 537 THR n 1 538 GLU n 1 539 LYS n 1 540 GLN n 1 541 ARG n 1 542 ASP n 1 543 SER n 1 544 LEU n 1 545 GLN n 1 546 LYS n 1 547 VAL n 1 548 SER n 1 549 PHE n 1 550 SER n 1 551 ARG n 1 552 LEU n 1 553 ILE n 1 554 CYS n 1 555 ASP n 1 556 ASN n 1 557 THR n 1 558 HIS n 1 559 ILE n 1 560 THR n 1 561 LYS n 1 562 VAL n 1 563 PRO n 1 564 LEU n 1 565 HIS n 1 566 ALA n 1 567 PHE n 1 568 GLN n 1 569 ALA n 1 570 ASN n 1 571 ASN n 1 572 TYR n 1 573 PRO n 1 574 HIS n 1 575 ASP n 1 576 PHE n 1 577 VAL n 1 578 ASP n 1 579 CYS n 1 580 SER n 1 581 THR n 1 582 VAL n 1 583 ASP n 1 584 LYS n 1 585 LEU n 1 586 ASP n 1 587 LEU n 1 588 SER n 1 589 PRO n 1 590 TRP n 1 591 ALA n 1 592 SER n 1 593 ARG n 1 594 GLU n 1 595 ASN n # _entity_src_nat.entity_id 1 _entity_src_nat.pdbx_src_id 1 _entity_src_nat.pdbx_alt_source_flag sample _entity_src_nat.pdbx_beg_seq_num ? _entity_src_nat.pdbx_end_seq_num ? _entity_src_nat.common_name cattle _entity_src_nat.pdbx_organism_scientific 'Bos taurus' _entity_src_nat.pdbx_ncbi_taxonomy_id 9913 _entity_src_nat.genus Bos _entity_src_nat.species ? _entity_src_nat.strain ? _entity_src_nat.tissue ? _entity_src_nat.tissue_fraction ? _entity_src_nat.pdbx_secretion ? _entity_src_nat.pdbx_fragment ? _entity_src_nat.pdbx_variant ? _entity_src_nat.pdbx_cell_line ? _entity_src_nat.pdbx_atcc ? _entity_src_nat.pdbx_cellular_location ? _entity_src_nat.pdbx_organ ? _entity_src_nat.pdbx_organelle ? _entity_src_nat.pdbx_cell ? _entity_src_nat.pdbx_plasmid_name ? _entity_src_nat.pdbx_plasmid_details ? _entity_src_nat.details ? # _struct_ref.id 1 _struct_ref.db_name UNP _struct_ref.db_code PERL_BOVIN _struct_ref.pdbx_db_accession P80025 _struct_ref.entity_id 1 _struct_ref.pdbx_seq_one_letter_code ;SWEVGCGAPVPLVKCDENSPYRTITGDCNNRRSPALGAANRALARWLPAEYEDGLALPFGWTQRKTRNGFRVPLAREVSN KIVGYLDEEGVLDQNRSLLFMQWGQIVDHDLDFAPETELGSNEHSKTQCEEYCIQGDNCFPIMFPKNDPKLKTQGKCMPF FRAGFVCPTPPYQSLAREQINAVTSFLDASLVYGSEPSLASRLRNLSSPLGLMAVNQEAWDHGLAYLPFNNKKPSPCEFI NTTARVPCFLAGDFRASEQILLATAHTLLLREHNRLARELKKLNPHWNGEKLYQEARKILGAFIQIITFRDYLPIVLGSE MQKWIPPYQGYNNSVDPRISNVFTFAFRFGHMEVPSTVSRLDENYQPWGPEAELPLHTLFFNTWRIIKDGGIDPLVRGLL AKKSKLMNQDKMVTSELRNKLFQPTHKIHGFDLAAINLQRCRDHGMPGYNSWRGFCGLSQPKTLKGLQTVLKNKILAKKL MDLYKTPDNIDIWIGGNAEPMVERGRVGPLLACLLGRQFQQIRDGDRFWWENPGVFTEKQRDSLQKVSFSRLICDNTHIT KVPLHAFQANNYPHDFVDCSTVDKLDLSPWASREN ; _struct_ref.pdbx_align_begin 118 _struct_ref.pdbx_db_isoform ? # _struct_ref_seq.align_id 1 _struct_ref_seq.ref_id 1 _struct_ref_seq.pdbx_PDB_id_code 2PT3 _struct_ref_seq.pdbx_strand_id A _struct_ref_seq.seq_align_beg 1 _struct_ref_seq.pdbx_seq_align_beg_ins_code ? _struct_ref_seq.seq_align_end 595 _struct_ref_seq.pdbx_seq_align_end_ins_code ? _struct_ref_seq.pdbx_db_accession P80025 _struct_ref_seq.db_align_beg 118 _struct_ref_seq.pdbx_db_align_beg_ins_code ? _struct_ref_seq.db_align_end 712 _struct_ref_seq.pdbx_db_align_end_ins_code ? _struct_ref_seq.pdbx_auth_seq_align_beg 1 _struct_ref_seq.pdbx_auth_seq_align_end 595 # _struct_ref_seq_dif.align_id 1 _struct_ref_seq_dif.pdbx_pdb_id_code 2PT3 _struct_ref_seq_dif.mon_id SEP _struct_ref_seq_dif.pdbx_pdb_strand_id A _struct_ref_seq_dif.seq_num 198 _struct_ref_seq_dif.pdbx_pdb_ins_code ? _struct_ref_seq_dif.pdbx_seq_db_name UNP _struct_ref_seq_dif.pdbx_seq_db_accession_code P80025 _struct_ref_seq_dif.db_mon_id SER _struct_ref_seq_dif.pdbx_seq_db_seq_num 315 _struct_ref_seq_dif.details 'MODIFIED RESIDUE' _struct_ref_seq_dif.pdbx_auth_seq_num 198 _struct_ref_seq_dif.pdbx_ordinal 1 # 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 CA non-polymer . 'CALCIUM ION' ? 'Ca 2' 40.078 CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 HEM non-polymer . 'PROTOPORPHYRIN IX CONTAINING FE' HEME 'C34 H32 Fe N4 O4' 616.487 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 PO4 non-polymer . 'PHOSPHATE ION' ? 'O4 P -3' 94.971 PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130 SEP 'L-peptide linking' n PHOSPHOSERINE PHOSPHONOSERINE 'C3 H8 N O6 P' 185.072 SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093 THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.119 TRP 'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2' 204.225 TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 # _exptl.entry_id 2PT3 _exptl.method 'X-RAY DIFFRACTION' _exptl.crystals_number 1 # _exptl_crystal.id 1 _exptl_crystal.density_meas ? _exptl_crystal.density_Matthews 2.34 _exptl_crystal.density_percent_sol 47.46 _exptl_crystal.description ? _exptl_crystal.F_000 ? _exptl_crystal.preparation ? # _exptl_crystal_grow.crystal_id 1 _exptl_crystal_grow.method 'VAPOR DIFFUSION, SITTING DROP' _exptl_crystal_grow.temp 298 _exptl_crystal_grow.temp_details ? _exptl_crystal_grow.pH 5.8 _exptl_crystal_grow.pdbx_details 'Tris-HCl, Phosphate, pH 5.8, VAPOR DIFFUSION, SITTING DROP, temperature 298K' _exptl_crystal_grow.pdbx_pH_range . # _diffrn.id 1 _diffrn.ambient_temp 200 _diffrn.ambient_temp_details ? _diffrn.crystal_id 1 # _diffrn_detector.diffrn_id 1 _diffrn_detector.detector 'IMAGE PLATE' _diffrn_detector.type 'MAR scanner 345 mm plate' _diffrn_detector.pdbx_collection_date 2006-10-20 _diffrn_detector.details Mirror # _diffrn_radiation.diffrn_id 1 _diffrn_radiation.wavelength_id 1 _diffrn_radiation.pdbx_monochromatic_or_laue_m_l M _diffrn_radiation.monochromator Graphite _diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' _diffrn_radiation.pdbx_scattering_type x-ray # _diffrn_radiation_wavelength.id 1 _diffrn_radiation_wavelength.wavelength 0.81 _diffrn_radiation_wavelength.wt 1.0 # _diffrn_source.diffrn_id 1 _diffrn_source.source SYNCHROTRON _diffrn_source.type 'EMBL/DESY, HAMBURG BEAMLINE X13' _diffrn_source.pdbx_synchrotron_site 'EMBL/DESY, Hamburg' _diffrn_source.pdbx_synchrotron_beamline X13 _diffrn_source.pdbx_wavelength 0.81 _diffrn_source.pdbx_wavelength_list ? # _reflns.entry_id 2PT3 _reflns.observed_criterion_sigma_F 0 _reflns.observed_criterion_sigma_I 0 _reflns.d_resolution_high 2.34 _reflns.d_resolution_low 74.7 _reflns.number_all 26553 _reflns.number_obs 24867 _reflns.percent_possible_obs 98.5 _reflns.pdbx_Rmerge_I_obs ? _reflns.pdbx_Rsym_value 0.064 _reflns.pdbx_netI_over_sigmaI 26.5 _reflns.B_iso_Wilson_estimate ? _reflns.pdbx_redundancy ? _reflns.R_free_details ? _reflns.limit_h_max ? _reflns.limit_h_min ? _reflns.limit_k_max ? _reflns.limit_k_min ? _reflns.limit_l_max ? _reflns.limit_l_min ? _reflns.observed_criterion_F_max ? _reflns.observed_criterion_F_min ? _reflns.pdbx_chi_squared ? _reflns.pdbx_scaling_rejects ? _reflns.pdbx_ordinal 1 _reflns.pdbx_diffrn_id 1 # _reflns_shell.d_res_high 2.34 _reflns_shell.d_res_low 2.38 _reflns_shell.percent_possible_all 99.8 _reflns_shell.Rmerge_I_obs ? _reflns_shell.pdbx_Rsym_value ? _reflns_shell.meanI_over_sigI_obs ? _reflns_shell.pdbx_redundancy ? _reflns_shell.percent_possible_obs ? _reflns_shell.number_unique_all ? _reflns_shell.number_measured_all ? _reflns_shell.number_measured_obs ? _reflns_shell.number_unique_obs ? _reflns_shell.pdbx_chi_squared ? _reflns_shell.pdbx_ordinal 1 _reflns_shell.pdbx_diffrn_id 1 # _refine.entry_id 2PT3 _refine.ls_number_reflns_obs 24867 _refine.ls_number_reflns_all 26553 _refine.pdbx_ls_sigma_I 0 _refine.pdbx_ls_sigma_F 0 _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.ls_d_res_low 19.38 _refine.ls_d_res_high 2.34 _refine.ls_percent_reflns_obs 96.75 _refine.ls_R_factor_obs 0.2319 _refine.ls_R_factor_all ? _refine.ls_R_factor_R_work 0.23138 _refine.ls_R_factor_R_free 0.24682 _refine.ls_R_factor_R_free_error ? _refine.ls_R_factor_R_free_error_details ? _refine.ls_percent_reflns_R_free 3.2 _refine.ls_number_reflns_R_free 822 _refine.ls_number_parameters ? _refine.ls_number_restraints ? _refine.occupancy_min ? _refine.occupancy_max ? _refine.correlation_coeff_Fo_to_Fc 0.943 _refine.correlation_coeff_Fo_to_Fc_free 0.937 _refine.B_iso_mean 61.388 _refine.aniso_B[1][1] 1.15 _refine.aniso_B[2][2] -5.05 _refine.aniso_B[3][3] 5.94 _refine.aniso_B[1][2] 0.00 _refine.aniso_B[1][3] 4.46 _refine.aniso_B[2][3] 0.00 _refine.solvent_model_details 'BABINET MODEL WITH MASK' _refine.solvent_model_param_ksol ? _refine.solvent_model_param_bsol ? _refine.pdbx_solvent_vdw_probe_radii 1.40 _refine.pdbx_solvent_ion_probe_radii 0.80 _refine.pdbx_solvent_shrinkage_radii 0.80 _refine.pdbx_ls_cross_valid_method THROUGHOUT _refine.details ? _refine.pdbx_starting_model 2NQX _refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' _refine.pdbx_isotropic_thermal_model ? _refine.pdbx_stereochemistry_target_values 'MAXIMUM LIKELIHOOD' _refine.pdbx_stereochem_target_val_spec_case ? _refine.pdbx_R_Free_selection_details RANDOM _refine.pdbx_overall_ESU_R 0.661 _refine.pdbx_overall_ESU_R_Free 0.272 _refine.overall_SU_ML 0.220 _refine.overall_SU_B 9.133 _refine.ls_redundancy_reflns_obs ? _refine.B_iso_min ? _refine.B_iso_max ? _refine.overall_SU_R_Cruickshank_DPI ? _refine.overall_SU_R_free ? _refine.ls_wR_factor_R_free ? _refine.ls_wR_factor_R_work ? _refine.overall_FOM_free_R_set ? _refine.overall_FOM_work_R_set ? _refine.pdbx_overall_phase_error ? _refine.pdbx_refine_id 'X-RAY DIFFRACTION' _refine.pdbx_diffrn_id 1 _refine.pdbx_TLS_residual_ADP_flag ? _refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_Blow_DPI ? _refine.pdbx_overall_SU_R_free_Blow_DPI ? # _refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_hist.cycle_id LAST _refine_hist.pdbx_number_atoms_protein 4774 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 258 _refine_hist.number_atoms_solvent 249 _refine_hist.number_atoms_total 5281 _refine_hist.d_res_high 2.34 _refine_hist.d_res_low 19.38 # 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 r_bond_refined_d 0.018 0.021 ? 5176 'X-RAY DIFFRACTION' ? r_bond_other_d ? ? ? ? 'X-RAY DIFFRACTION' ? r_angle_refined_deg 2.075 2.022 ? 7055 'X-RAY DIFFRACTION' ? r_angle_other_deg ? ? ? ? 'X-RAY DIFFRACTION' ? r_dihedral_angle_1_deg 3.693 3.000 ? 594 'X-RAY DIFFRACTION' ? r_dihedral_angle_2_deg ? ? ? ? 'X-RAY DIFFRACTION' ? r_dihedral_angle_3_deg 21.481 15.017 ? 895 'X-RAY DIFFRACTION' ? r_dihedral_angle_4_deg ? ? ? ? 'X-RAY DIFFRACTION' ? r_chiral_restr 0.129 0.200 ? 748 'X-RAY DIFFRACTION' ? r_gen_planes_refined 0.008 0.020 ? 3903 'X-RAY DIFFRACTION' ? r_gen_planes_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_nbd_refined 0.283 0.300 ? 2989 'X-RAY DIFFRACTION' ? r_nbd_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_nbtor_refined ? ? ? ? 'X-RAY DIFFRACTION' ? r_nbtor_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_xyhbond_nbd_refined 0.209 0.500 ? 479 'X-RAY DIFFRACTION' ? r_xyhbond_nbd_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_metal_ion_refined 0.218 0.500 ? 3 'X-RAY DIFFRACTION' ? r_metal_ion_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_symmetry_vdw_refined 0.349 0.300 ? 38 'X-RAY DIFFRACTION' ? r_symmetry_vdw_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_symmetry_hbond_refined 0.211 0.500 ? 7 'X-RAY DIFFRACTION' ? r_symmetry_hbond_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_symmetry_metal_ion_refined ? ? ? ? 'X-RAY DIFFRACTION' ? r_symmetry_metal_ion_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_mcbond_it 0.931 1.500 ? 2996 'X-RAY DIFFRACTION' ? r_mcbond_other ? ? ? ? 'X-RAY DIFFRACTION' ? r_mcangle_it 1.651 2.000 ? 4805 'X-RAY DIFFRACTION' ? r_scbond_it 3.175 3.000 ? 2180 'X-RAY DIFFRACTION' ? r_scangle_it 3.863 4.500 ? 2250 'X-RAY DIFFRACTION' ? r_rigid_bond_restr ? ? ? ? 'X-RAY DIFFRACTION' ? r_sphericity_free ? ? ? ? 'X-RAY DIFFRACTION' ? r_sphericity_bonded ? ? ? ? 'X-RAY DIFFRACTION' ? # _refine_ls_shell.pdbx_total_number_of_bins_used 20 _refine_ls_shell.d_res_high 2.340 _refine_ls_shell.d_res_low 2.401 _refine_ls_shell.number_reflns_R_work 1871 _refine_ls_shell.R_factor_R_work 0.292 _refine_ls_shell.percent_reflns_obs ? _refine_ls_shell.R_factor_R_free 0.339 _refine_ls_shell.R_factor_R_free_error ? _refine_ls_shell.percent_reflns_R_free ? _refine_ls_shell.number_reflns_R_free 58 _refine_ls_shell.number_reflns_all ? _refine_ls_shell.R_factor_all ? _refine_ls_shell.number_reflns_obs ? _refine_ls_shell.redundancy_reflns_obs ? _refine_ls_shell.pdbx_refine_id 'X-RAY DIFFRACTION' # _struct.entry_id 2PT3 _struct.title 'Crystal structure of bovine lactoperoxidase at 2.34 A resolution reveals multiple anion binding sites' _struct.pdbx_descriptor 'Lactoperoxidase (E.C.1.11.1.7)' _struct.pdbx_model_details ? _struct.pdbx_CASP_flag ? _struct.pdbx_model_type_details ? # _struct_keywords.entry_id 2PT3 _struct_keywords.pdbx_keywords OXIDOREDUCTASE _struct_keywords.text 'Heme, Anion binding sites, OXIDOREDUCTASE' # loop_ _struct_asym.id _struct_asym.pdbx_blank_PDB_chainid_flag _struct_asym.pdbx_modified _struct_asym.entity_id _struct_asym.details A N N 1 ? B N N 2 ? C N N 2 ? D N N 3 ? E N N 2 ? F N N 2 ? G N N 2 ? H N N 2 ? I N N 3 ? J N N 2 ? K N N 2 ? L N N 4 ? M N N 5 ? N N N 5 ? O N N 5 ? P N N 5 ? Q N N 5 ? R N N 5 ? S N N 5 ? T N N 5 ? U N N 5 ? V N N 5 ? W N N 5 ? X N N 5 ? Y N N 5 ? Z N N 5 ? AA N N 5 ? BA N N 5 ? CA N N 6 ? DA N N 7 ? # _struct_biol.id 1 # 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 LEU A 74 ? VAL A 83 ? LEU A 74 VAL A 83 1 ? 10 HELX_P HELX_P2 2 LEU A 98 ? ASP A 112 ? LEU A 98 ASP A 112 1 ? 15 HELX_P HELX_P3 3 HIS A 124 ? CYS A 133 ? HIS A 124 CYS A 133 1 ? 10 HELX_P HELX_P4 4 ALA A 189 ? GLY A 194 ? ALA A 189 GLY A 194 1 ? 6 HELX_P HELX_P5 5 GLU A 196 ? ARG A 204 ? GLU A 196 ARG A 204 1 ? 9 HELX_P HELX_P6 6 SER A 235 ? ILE A 240 ? SER A 235 ILE A 240 1 ? 6 HELX_P HELX_P7 7 ASP A 253 ? GLU A 258 ? ASP A 253 GLU A 258 5 ? 6 HELX_P HELX_P8 8 GLN A 259 ? ASN A 284 ? GLN A 259 ASN A 284 1 ? 26 HELX_P HELX_P9 9 ASN A 288 ? ARG A 310 ? ASN A 288 ARG A 310 1 ? 23 HELX_P HELX_P10 10 TYR A 312 ? GLY A 318 ? TYR A 312 GLY A 318 1 ? 7 HELX_P HELX_P11 11 GLU A 320 ? ILE A 325 ? GLU A 320 ILE A 325 1 ? 6 HELX_P HELX_P12 12 VAL A 342 ? PHE A 347 ? VAL A 342 PHE A 347 1 ? 6 HELX_P HELX_P13 13 ARG A 348 ? VAL A 354 ? ARG A 348 VAL A 354 5 ? 7 HELX_P HELX_P14 14 HIS A 377 ? LEU A 379 ? HIS A 377 LEU A 379 5 ? 3 HELX_P HELX_P15 15 THR A 383 ? LYS A 388 ? THR A 383 LYS A 388 1 ? 6 HELX_P HELX_P16 16 ILE A 392 ? LYS A 402 ? ILE A 392 LYS A 402 1 ? 11 HELX_P HELX_P17 17 THR A 414 ? ASN A 419 ? THR A 414 ASN A 419 1 ? 6 HELX_P HELX_P18 18 ASP A 432 ? HIS A 444 ? ASP A 432 HIS A 444 1 ? 13 HELX_P HELX_P19 19 GLY A 448 ? CYS A 456 ? GLY A 448 CYS A 456 1 ? 9 HELX_P HELX_P20 20 THR A 463 ? LYS A 472 ? THR A 463 LYS A 472 1 ? 10 HELX_P HELX_P21 21 ASN A 473 ? LYS A 485 ? ASN A 473 LYS A 485 1 ? 13 HELX_P HELX_P22 22 THR A 486 ? ILE A 490 ? THR A 486 ILE A 490 5 ? 5 HELX_P HELX_P23 23 ASP A 491 ? GLU A 499 ? ASP A 491 GLU A 499 1 ? 9 HELX_P HELX_P24 24 GLY A 508 ? GLY A 525 ? GLY A 508 GLY A 525 1 ? 18 HELX_P HELX_P25 25 THR A 537 ? GLN A 545 ? THR A 537 GLN A 545 1 ? 9 HELX_P HELX_P26 26 SER A 550 ? THR A 557 ? SER A 550 THR A 557 1 ? 8 HELX_P HELX_P27 27 SER A 580 ? VAL A 582 ? SER A 580 VAL A 582 5 ? 3 HELX_P HELX_P28 28 LEU A 587 ? ALA A 591 ? LEU A 587 ALA A 591 5 ? 5 # _struct_conf_type.id HELX_P _struct_conf_type.criteria ? _struct_conf_type.reference ? # loop_ _struct_conn.id _struct_conn.conn_type_id _struct_conn.pdbx_leaving_atom_flag _struct_conn.pdbx_PDB_id _struct_conn.ptnr1_label_asym_id _struct_conn.ptnr1_label_comp_id _struct_conn.ptnr1_label_seq_id _struct_conn.ptnr1_label_atom_id _struct_conn.pdbx_ptnr1_label_alt_id _struct_conn.pdbx_ptnr1_PDB_ins_code _struct_conn.pdbx_ptnr1_standard_comp_id _struct_conn.ptnr1_symmetry _struct_conn.ptnr2_label_asym_id _struct_conn.ptnr2_label_comp_id _struct_conn.ptnr2_label_seq_id _struct_conn.ptnr2_label_atom_id _struct_conn.pdbx_ptnr2_label_alt_id _struct_conn.pdbx_ptnr2_PDB_ins_code _struct_conn.ptnr1_auth_asym_id _struct_conn.ptnr1_auth_comp_id _struct_conn.ptnr1_auth_seq_id _struct_conn.ptnr2_auth_asym_id _struct_conn.ptnr2_auth_comp_id _struct_conn.ptnr2_auth_seq_id _struct_conn.ptnr2_symmetry _struct_conn.pdbx_ptnr3_label_atom_id _struct_conn.pdbx_ptnr3_label_seq_id _struct_conn.pdbx_ptnr3_label_comp_id _struct_conn.pdbx_ptnr3_label_asym_id _struct_conn.pdbx_ptnr3_label_alt_id _struct_conn.pdbx_ptnr3_PDB_ins_code _struct_conn.details _struct_conn.pdbx_dist_value _struct_conn.pdbx_value_order disulf1 disulf ? ? A CYS 6 SG ? ? ? 1_555 A CYS 167 SG ? ? A CYS 6 A CYS 167 1_555 ? ? ? ? ? ? ? 1.482 ? disulf2 disulf ? ? A CYS 15 SG ? ? ? 1_555 A CYS 28 SG ? ? A CYS 15 A CYS 28 1_555 ? ? ? ? ? ? ? 2.145 ? disulf3 disulf ? ? A CYS 129 SG ? ? ? 1_555 A CYS 139 SG ? ? A CYS 129 A CYS 139 1_555 ? ? ? ? ? ? ? 2.033 ? disulf4 disulf ? ? A CYS 133 SG ? ? ? 1_555 A CYS 157 SG ? ? A CYS 133 A CYS 157 1_555 ? ? ? ? ? ? ? 2.056 ? disulf5 disulf ? ? A CYS 237 SG ? ? ? 1_555 A CYS 248 SG ? ? A CYS 237 A CYS 248 1_555 ? ? ? ? ? ? ? 2.027 ? disulf6 disulf ? ? A CYS 456 SG ? ? ? 1_555 A CYS 513 SG ? ? A CYS 456 A CYS 513 1_555 ? ? ? ? ? ? ? 1.994 ? disulf7 disulf ? ? A CYS 554 SG ? ? ? 1_555 A CYS 579 SG ? ? A CYS 554 A CYS 579 1_555 ? ? ? ? ? ? ? 2.054 ? covale1 covale ? ? A ASN 95 ND2 ? ? ? 1_555 B NAG . C1 ? ? A ASN 95 A NAG 596 1_555 ? ? ? ? ? ? ? 1.449 ? metalc1 metalc ? ? A ASP 110 O ? ? ? 1_555 L CA . CA ? ? A ASP 110 A CA 606 1_555 ? ? ? ? ? ? ? 2.105 ? metalc2 metalc ? ? A ASP 110 OD1 ? ? ? 1_555 L CA . CA ? ? A ASP 110 A CA 606 1_555 ? ? ? ? ? ? ? 2.627 ? metalc3 metalc ? ? A THR 184 O ? ? ? 1_555 L CA . CA ? ? A THR 184 A CA 606 1_555 ? ? ? ? ? ? ? 2.227 ? metalc4 metalc ? ? A THR 184 OG1 ? ? ? 1_555 L CA . CA ? ? A THR 184 A CA 606 1_555 ? ? ? ? ? ? ? 2.516 ? metalc5 metalc ? ? A PHE 186 O ? ? ? 1_555 L CA . CA ? ? A PHE 186 A CA 606 1_555 ? ? ? ? ? ? ? 2.208 ? metalc6 metalc ? ? A ASP 188 OD1 ? ? ? 1_555 L CA . CA ? ? A ASP 188 A CA 606 1_555 ? ? ? ? ? ? ? 2.638 ? metalc7 metalc ? ? A SER 190 OG ? ? ? 1_555 L CA . CA ? ? A SER 190 A CA 606 1_555 ? ? ? ? ? ? ? 2.609 ? covale2 covale ? ? A ASN 205 ND2 ? ? ? 1_555 E NAG . C1 ? ? A ASN 205 A NAG 599 1_555 ? ? ? ? ? ? ? 1.445 ? covale3 covale ? ? A ASN 241 ND2 ? ? ? 1_555 G NAG . C1 ? ? A ASN 241 A NAG 601 1_555 ? ? ? ? ? ? ? 1.444 ? covale4 covale ? ? A ASN 332 ND2 ? ? ? 1_555 J NAG . C1 ? ? A ASN 332 A NAG 604 1_555 ? ? ? ? ? ? ? 1.426 ? metalc8 metalc ? ? A HIS 351 NE2 ? ? ? 1_555 CA HEM . FE ? ? A HIS 351 A HEM 623 1_555 ? ? ? ? ? ? ? 2.306 ? covale5 covale ? ? B NAG . O4 ? ? ? 1_555 C NAG . C1 ? ? A NAG 596 A NAG 597 1_555 ? ? ? ? ? ? ? 1.441 ? covale6 covale ? ? C NAG . O4 ? ? ? 1_555 D MAN . C1 ? ? A NAG 597 A MAN 598 1_555 ? ? ? ? ? ? ? 1.445 ? covale7 covale ? ? E NAG . O4 ? ? ? 1_555 F NAG . C1 ? ? A NAG 599 A NAG 600 1_555 ? ? ? ? ? ? ? 1.449 ? covale8 covale ? ? G NAG . O4 ? ? ? 1_555 H NAG . C1 ? ? A NAG 601 A NAG 602 1_555 ? ? ? ? ? ? ? 1.419 ? covale9 covale ? ? H NAG . O4 ? ? ? 1_555 I MAN . C1 ? ? A NAG 602 A MAN 603 1_555 ? ? ? ? ? ? ? 1.463 ? covale10 covale ? ? J NAG . O4 ? ? ? 1_555 K NAG . C1 ? ? A NAG 604 A NAG 605 1_555 ? ? ? ? ? ? ? 1.454 ? covale11 covale ? ? A ASP 108 OD2 ? ? ? 1_555 CA HEM . CMD ? ? A ASP 108 A HEM 623 1_555 ? ? ? ? ? ? ? 1.546 ? covale12 covale ? ? A GLU 258 OE2 ? ? ? 1_555 CA HEM . CMB ? ? A GLU 258 A HEM 623 1_555 ? ? ? ? ? ? ? 1.565 ? covale13 covale ? ? A PRO 197 C ? ? ? 1_555 A SEP 198 N ? ? A PRO 197 A SEP 198 1_555 ? ? ? ? ? ? ? 1.299 ? covale14 covale ? ? A SEP 198 C ? ? ? 1_555 A LEU 199 N ? ? A SEP 198 A LEU 199 1_555 ? ? ? ? ? ? ? 1.315 ? metalc9 metalc ? ? CA HEM . FE ? ? ? 1_555 DA HOH . O ? ? A HEM 623 A HOH 748 1_555 ? ? ? ? ? ? ? 2.674 ? # loop_ _struct_conn_type.id _struct_conn_type.criteria _struct_conn_type.reference disulf ? ? covale ? ? metalc ? ? # _struct_mon_prot_cis.pdbx_id 1 _struct_mon_prot_cis.label_comp_id TYR _struct_mon_prot_cis.label_seq_id 572 _struct_mon_prot_cis.label_asym_id A _struct_mon_prot_cis.label_alt_id . _struct_mon_prot_cis.pdbx_PDB_ins_code ? _struct_mon_prot_cis.auth_comp_id TYR _struct_mon_prot_cis.auth_seq_id 572 _struct_mon_prot_cis.auth_asym_id A _struct_mon_prot_cis.pdbx_label_comp_id_2 PRO _struct_mon_prot_cis.pdbx_label_seq_id_2 573 _struct_mon_prot_cis.pdbx_label_asym_id_2 A _struct_mon_prot_cis.pdbx_PDB_ins_code_2 ? _struct_mon_prot_cis.pdbx_auth_comp_id_2 PRO _struct_mon_prot_cis.pdbx_auth_seq_id_2 573 _struct_mon_prot_cis.pdbx_auth_asym_id_2 A _struct_mon_prot_cis.pdbx_PDB_model_num 1 _struct_mon_prot_cis.pdbx_omega_angle 7.15 # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details A ? 2 ? B ? 2 ? C ? 2 ? D ? 2 ? E ? 2 ? # loop_ _struct_sheet_order.sheet_id _struct_sheet_order.range_id_1 _struct_sheet_order.range_id_2 _struct_sheet_order.offset _struct_sheet_order.sense A 1 2 ? anti-parallel B 1 2 ? anti-parallel C 1 2 ? anti-parallel D 1 2 ? anti-parallel E 1 2 ? anti-parallel # loop_ _struct_sheet_range.sheet_id _struct_sheet_range.id _struct_sheet_range.beg_label_comp_id _struct_sheet_range.beg_label_asym_id _struct_sheet_range.beg_label_seq_id _struct_sheet_range.pdbx_beg_PDB_ins_code _struct_sheet_range.end_label_comp_id _struct_sheet_range.end_label_asym_id _struct_sheet_range.end_label_seq_id _struct_sheet_range.pdbx_end_PDB_ins_code _struct_sheet_range.beg_auth_comp_id _struct_sheet_range.beg_auth_asym_id _struct_sheet_range.beg_auth_seq_id _struct_sheet_range.end_auth_comp_id _struct_sheet_range.end_auth_asym_id _struct_sheet_range.end_auth_seq_id A 1 ARG A 41 ? ALA A 42 ? ARG A 41 ALA A 42 A 2 ILE A 180 ? ASN A 181 ? ILE A 180 ASN A 181 B 1 LEU A 92 ? SER A 97 ? LEU A 92 SER A 97 B 2 LYS A 403 ? LYS A 405 ? LYS A 403 LYS A 405 C 1 ILE A 142 ? MET A 143 ? ILE A 142 MET A 143 C 2 CYS A 157 ? MET A 158 ? CYS A 157 MET A 158 D 1 THR A 357 ? SER A 359 ? THR A 357 SER A 359 D 2 GLU A 373 ? PRO A 375 ? GLU A 373 PRO A 375 E 1 LYS A 561 ? VAL A 562 ? LYS A 561 VAL A 562 E 2 VAL A 577 ? ASP A 578 ? VAL A 577 ASP A 578 # 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 ARG A 41 ? N ARG A 41 O ASN A 181 ? O ASN A 181 B 1 2 N ASP A 93 ? N ASP A 93 O SER A 404 ? O SER A 404 C 1 2 N ILE A 142 ? N ILE A 142 O MET A 158 ? O MET A 158 D 1 2 N VAL A 358 ? N VAL A 358 O LEU A 374 ? O LEU A 374 E 1 2 N VAL A 562 ? N VAL A 562 O VAL A 577 ? O VAL A 577 # 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 ? ? ? ? 7 'BINDING SITE FOR RESIDUE NAG A 596' AC2 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE NAG A 597' AC3 Software ? ? ? ? 1 'BINDING SITE FOR RESIDUE MAN A 598' AC4 Software ? ? ? ? 7 'BINDING SITE FOR RESIDUE NAG A 599' AC5 Software ? ? ? ? 2 'BINDING SITE FOR RESIDUE NAG A 600' AC6 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE NAG A 601' AC7 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE NAG A 602' AC8 Software ? ? ? ? 2 'BINDING SITE FOR RESIDUE MAN A 603' AC9 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE NAG A 604' BC1 Software ? ? ? ? 1 'BINDING SITE FOR RESIDUE NAG A 605' BC2 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE CA A 606' BC3 Software ? ? ? ? 7 'BINDING SITE FOR RESIDUE PO4 A 607' BC4 Software ? ? ? ? 8 'BINDING SITE FOR RESIDUE PO4 A 608' BC5 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE PO4 A 609' BC6 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE PO4 A 610' BC7 Software ? ? ? ? 2 'BINDING SITE FOR RESIDUE PO4 A 611' BC8 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE PO4 A 612' BC9 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE PO4 A 613' CC1 Software ? ? ? ? 7 'BINDING SITE FOR RESIDUE PO4 A 614' CC2 Software ? ? ? ? 8 'BINDING SITE FOR RESIDUE PO4 A 615' CC3 Software ? ? ? ? 7 'BINDING SITE FOR RESIDUE PO4 A 616' CC4 Software ? ? ? ? 2 'BINDING SITE FOR RESIDUE PO4 A 617' CC5 Software ? ? ? ? 8 'BINDING SITE FOR RESIDUE PO4 A 618' CC6 Software ? ? ? ? 6 'BINDING SITE FOR RESIDUE PO4 A 619' CC7 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE PO4 A 620' CC8 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE PO4 A 621' CC9 Software ? ? ? ? 1 'BINDING SITE FOR RESIDUE PO4 A 622' DC1 Software ? ? ? ? 20 'BINDING SITE FOR RESIDUE HEM A 623' # 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 7 ASN A 95 ? ASN A 95 . ? 1_555 ? 2 AC1 7 ARG A 96 ? ARG A 96 . ? 1_555 ? 3 AC1 7 ILE A 315 ? ILE A 315 . ? 1_555 ? 4 AC1 7 ARG A 504 ? ARG A 504 . ? 1_555 ? 5 AC1 7 NAG C . ? NAG A 597 . ? 1_555 ? 6 AC1 7 PO4 P . ? PO4 A 610 . ? 1_555 ? 7 AC1 7 HOH DA . ? HOH A 757 . ? 1_655 ? 8 AC2 4 ARG A 504 ? ARG A 504 . ? 1_555 ? 9 AC2 4 NAG B . ? NAG A 596 . ? 1_555 ? 10 AC2 4 MAN D . ? MAN A 598 . ? 1_555 ? 11 AC2 4 HOH DA . ? HOH A 796 . ? 1_555 ? 12 AC3 1 NAG C . ? NAG A 597 . ? 1_555 ? 13 AC4 7 ASN A 205 ? ASN A 205 . ? 1_555 ? 14 AC4 7 SER A 208 ? SER A 208 . ? 1_555 ? 15 AC4 7 ALA A 214 ? ALA A 214 . ? 1_555 ? 16 AC4 7 VAL A 215 ? VAL A 215 . ? 1_555 ? 17 AC4 7 GLN A 217 ? GLN A 217 . ? 1_555 ? 18 AC4 7 NAG F . ? NAG A 600 . ? 1_555 ? 19 AC4 7 HOH DA . ? HOH A 836 . ? 1_555 ? 20 AC5 2 GLN A 217 ? GLN A 217 . ? 1_555 ? 21 AC5 2 NAG E . ? NAG A 599 . ? 1_555 ? 22 AC6 5 ASN A 241 ? ASN A 241 . ? 1_555 ? 23 AC6 5 ALA A 244 ? ALA A 244 . ? 1_555 ? 24 AC6 5 TRP A 384 ? TRP A 384 . ? 1_555 ? 25 AC6 5 LYS A 388 ? LYS A 388 . ? 1_555 ? 26 AC6 5 NAG H . ? NAG A 602 . ? 1_555 ? 27 AC7 4 NAG G . ? NAG A 601 . ? 1_555 ? 28 AC7 4 MAN I . ? MAN A 603 . ? 1_555 ? 29 AC7 4 HOH DA . ? HOH A 624 . ? 1_555 ? 30 AC7 4 HOH DA . ? HOH A 639 . ? 1_555 ? 31 AC8 2 NAG H . ? NAG A 602 . ? 1_555 ? 32 AC8 2 HOH DA . ? HOH A 663 . ? 1_555 ? 33 AC9 4 ASN A 332 ? ASN A 332 . ? 1_555 ? 34 AC9 4 NAG K . ? NAG A 605 . ? 1_555 ? 35 AC9 4 HOH DA . ? HOH A 703 . ? 1_555 ? 36 AC9 4 HOH DA . ? HOH A 793 . ? 1_555 ? 37 BC1 1 NAG J . ? NAG A 604 . ? 1_555 ? 38 BC2 5 ASP A 110 ? ASP A 110 . ? 1_555 ? 39 BC2 5 THR A 184 ? THR A 184 . ? 1_555 ? 40 BC2 5 PHE A 186 ? PHE A 186 . ? 1_555 ? 41 BC2 5 ASP A 188 ? ASP A 188 . ? 1_555 ? 42 BC2 5 SER A 190 ? SER A 190 . ? 1_555 ? 43 BC3 7 HIS A 109 ? HIS A 109 . ? 1_555 ? 44 BC3 7 ARG A 255 ? ARG A 255 . ? 1_555 ? 45 BC3 7 GLU A 258 ? GLU A 258 . ? 1_555 ? 46 BC3 7 HEM CA . ? HEM A 623 . ? 1_555 ? 47 BC3 7 HOH DA . ? HOH A 696 . ? 1_555 ? 48 BC3 7 HOH DA . ? HOH A 748 . ? 1_555 ? 49 BC3 7 HOH DA . ? HOH A 804 . ? 1_555 ? 50 BC4 8 ALA A 44 ? ALA A 44 . ? 1_555 ? 51 BC4 8 ARG A 45 ? ARG A 45 . ? 1_555 ? 52 BC4 8 TRP A 46 ? TRP A 46 . ? 1_555 ? 53 BC4 8 LEU A 47 ? LEU A 47 . ? 1_555 ? 54 BC4 8 ASN A 341 ? ASN A 341 . ? 1_555 ? 55 BC4 8 VAL A 342 ? VAL A 342 . ? 1_555 ? 56 BC4 8 MET A 446 ? MET A 446 . ? 1_555 ? 57 BC4 8 TRP A 452 ? TRP A 452 . ? 1_555 ? 58 BC5 5 GLU A 77 ? GLU A 77 . ? 1_555 ? 59 BC5 5 ASN A 80 ? ASN A 80 . ? 1_555 ? 60 BC5 5 LYS A 81 ? LYS A 81 . ? 1_555 ? 61 BC5 5 PRO A 145 ? PRO A 145 . ? 1_555 ? 62 BC5 5 ASN A 147 ? ASN A 147 . ? 1_555 ? 63 BC6 5 ASN A 95 ? ASN A 95 . ? 1_555 ? 64 BC6 5 ARG A 96 ? ARG A 96 . ? 1_555 ? 65 BC6 5 ARG A 504 ? ARG A 504 . ? 1_555 ? 66 BC6 5 ARG A 506 ? ARG A 506 . ? 1_555 ? 67 BC6 5 NAG B . ? NAG A 596 . ? 1_555 ? 68 BC7 2 LEU A 199 ? LEU A 199 . ? 1_555 ? 69 BC7 2 ARG A 202 ? ARG A 202 . ? 1_555 ? 70 BC8 5 ASN A 216 ? ASN A 216 . ? 1_555 ? 71 BC8 5 GLN A 217 ? GLN A 217 . ? 1_555 ? 72 BC8 5 GLU A 218 ? GLU A 218 . ? 1_555 ? 73 BC8 5 PRO A 228 ? PRO A 228 . ? 1_555 ? 74 BC8 5 PHE A 229 ? PHE A 229 . ? 1_555 ? 75 BC9 5 GLY A 223 ? GLY A 223 . ? 1_555 ? 76 BC9 5 LEU A 224 ? LEU A 224 . ? 1_555 ? 77 BC9 5 ALA A 225 ? ALA A 225 . ? 1_555 ? 78 BC9 5 ARG A 271 ? ARG A 271 . ? 1_555 ? 79 BC9 5 ARG A 278 ? ARG A 278 . ? 1_555 ? 80 CC1 7 PRO A 234 ? PRO A 234 . ? 1_555 ? 81 CC1 7 SER A 235 ? SER A 235 . ? 1_555 ? 82 CC1 7 PRO A 236 ? PRO A 236 . ? 1_555 ? 83 CC1 7 PHE A 239 ? PHE A 239 . ? 1_555 ? 84 CC1 7 PHE A 422 ? PHE A 422 . ? 1_555 ? 85 CC1 7 PRO A 424 ? PRO A 424 . ? 1_555 ? 86 CC1 7 THR A 425 ? THR A 425 . ? 1_555 ? 87 CC2 8 ILE A 306 ? ILE A 306 . ? 1_555 ? 88 CC2 8 PHE A 309 ? PHE A 309 . ? 1_555 ? 89 CC2 8 ARG A 310 ? ARG A 310 . ? 1_555 ? 90 CC2 8 TRP A 529 ? TRP A 529 . ? 1_555 ? 91 CC2 8 TRP A 530 ? TRP A 530 . ? 1_555 ? 92 CC2 8 GLU A 531 ? GLU A 531 . ? 1_555 ? 93 CC2 8 HOH DA . ? HOH A 800 . ? 1_555 ? 94 CC2 8 HOH DA . ? HOH A 861 . ? 1_555 ? 95 CC3 7 SER A 359 ? SER A 359 . ? 1_555 ? 96 CC3 7 LEU A 361 ? LEU A 361 . ? 1_555 ? 97 CC3 7 PRO A 367 ? PRO A 367 . ? 1_555 ? 98 CC3 7 ALA A 372 ? ALA A 372 . ? 1_555 ? 99 CC3 7 GLU A 373 ? GLU A 373 . ? 1_555 ? 100 CC3 7 LYS A 402 ? LYS A 402 . ? 1_555 ? 101 CC3 7 HOH DA . ? HOH A 719 . ? 1_555 ? 102 CC4 2 HIS A 377 ? HIS A 377 . ? 1_555 ? 103 CC4 2 HIS A 429 ? HIS A 429 . ? 1_555 ? 104 CC5 8 GLU A 363 ? GLU A 363 . ? 1_555 ? 105 CC5 8 TYR A 365 ? TYR A 365 . ? 1_555 ? 106 CC5 8 ARG A 397 ? ARG A 397 . ? 1_555 ? 107 CC5 8 HIS A 558 ? HIS A 558 . ? 1_555 ? 108 CC5 8 ILE A 559 ? ILE A 559 . ? 1_555 ? 109 CC5 8 THR A 560 ? THR A 560 . ? 1_555 ? 110 CC5 8 LYS A 561 ? LYS A 561 . ? 1_555 ? 111 CC5 8 HOH DA . ? HOH A 638 . ? 1_555 ? 112 CC6 6 PRO A 11 ? PRO A 11 . ? 1_655 ? 113 CC6 6 PRO A 461 ? PRO A 461 . ? 1_555 ? 114 CC6 6 LYS A 462 ? LYS A 462 . ? 1_555 ? 115 CC6 6 THR A 463 ? THR A 463 . ? 1_555 ? 116 CC6 6 GLY A 466 ? GLY A 466 . ? 1_555 ? 117 CC6 6 HOH DA . ? HOH A 832 . ? 1_555 ? 118 CC7 5 ARG A 551 ? ARG A 551 . ? 1_555 ? 119 CC7 5 CYS A 579 ? CYS A 579 . ? 1_555 ? 120 CC7 5 SER A 580 ? SER A 580 . ? 1_555 ? 121 CC7 5 LYS A 584 ? LYS A 584 . ? 1_555 ? 122 CC7 5 HOH DA . ? HOH A 760 . ? 1_555 ? 123 CC8 4 ASP A 311 ? ASP A 311 . ? 1_555 ? 124 CC8 4 HIS A 565 ? HIS A 565 . ? 1_555 ? 125 CC8 4 ALA A 566 ? ALA A 566 . ? 1_555 ? 126 CC8 4 PHE A 567 ? PHE A 567 . ? 1_555 ? 127 CC9 1 ARG A 593 ? ARG A 593 . ? 1_555 ? 128 DC1 20 MET A 101 ? MET A 101 . ? 1_555 ? 129 DC1 20 GLY A 104 ? GLY A 104 . ? 1_555 ? 130 DC1 20 GLN A 105 ? GLN A 105 . ? 1_555 ? 131 DC1 20 ASP A 108 ? ASP A 108 . ? 1_555 ? 132 DC1 20 ASP A 112 ? ASP A 112 . ? 1_555 ? 133 DC1 20 PHE A 113 ? PHE A 113 . ? 1_555 ? 134 DC1 20 ALA A 114 ? ALA A 114 . ? 1_555 ? 135 DC1 20 ARG A 255 ? ARG A 255 . ? 1_555 ? 136 DC1 20 GLU A 258 ? GLU A 258 . ? 1_555 ? 137 DC1 20 THR A 344 ? THR A 344 . ? 1_555 ? 138 DC1 20 PHE A 347 ? PHE A 347 . ? 1_555 ? 139 DC1 20 ARG A 348 ? ARG A 348 . ? 1_555 ? 140 DC1 20 GLY A 350 ? GLY A 350 . ? 1_555 ? 141 DC1 20 HIS A 351 ? HIS A 351 . ? 1_555 ? 142 DC1 20 VAL A 354 ? VAL A 354 . ? 1_555 ? 143 DC1 20 LEU A 417 ? LEU A 417 . ? 1_555 ? 144 DC1 20 ILE A 436 ? ILE A 436 . ? 1_555 ? 145 DC1 20 ARG A 440 ? ARG A 440 . ? 1_555 ? 146 DC1 20 PO4 M . ? PO4 A 607 . ? 1_555 ? 147 DC1 20 HOH DA . ? HOH A 748 . ? 1_555 ? # _database_PDB_matrix.entry_id 2PT3 _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 2PT3 _atom_sites.fract_transf_matrix[1][1] 0.018549 _atom_sites.fract_transf_matrix[1][2] 0.000000 _atom_sites.fract_transf_matrix[1][3] 0.004360 _atom_sites.fract_transf_matrix[2][1] 0.000000 _atom_sites.fract_transf_matrix[2][2] 0.012492 _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] 0.013574 _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 CA FE N O P S # loop_ _atom_site.group_PDB _atom_site.id _atom_site.type_symbol _atom_site.label_atom_id _atom_site.label_alt_id _atom_site.label_comp_id _atom_site.label_asym_id _atom_site.label_entity_id _atom_site.label_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.B_iso_or_equiv _atom_site.pdbx_formal_charge _atom_site.auth_seq_id _atom_site.auth_comp_id _atom_site.auth_asym_id _atom_site.auth_atom_id _atom_site.pdbx_PDB_model_num ATOM 1 N N . SER A 1 1 ? 6.845 -29.087 31.443 1.00 98.34 ? 1 SER A N 1 ATOM 2 C CA . SER A 1 1 ? 6.792 -29.101 32.938 1.00 98.33 ? 1 SER A CA 1 ATOM 3 C C . SER A 1 1 ? 5.396 -29.526 33.447 1.00 98.20 ? 1 SER A C 1 ATOM 4 O O . SER A 1 1 ? 4.371 -28.956 33.052 1.00 98.16 ? 1 SER A O 1 ATOM 5 C CB . SER A 1 1 ? 7.199 -27.726 33.487 1.00 98.57 ? 1 SER A CB 1 ATOM 6 O OG . SER A 1 1 ? 8.076 -27.848 34.594 1.00 98.18 ? 1 SER A OG 1 ATOM 7 N N . TRP A 1 2 ? 5.383 -30.523 34.334 1.00 97.96 ? 2 TRP A N 1 ATOM 8 C CA . TRP A 1 2 ? 4.155 -31.157 34.854 1.00 97.36 ? 2 TRP A CA 1 ATOM 9 C C . TRP A 1 2 ? 3.021 -30.246 35.308 1.00 96.95 ? 2 TRP A C 1 ATOM 10 O O . TRP A 1 2 ? 2.956 -29.832 36.467 1.00 97.03 ? 2 TRP A O 1 ATOM 11 C CB . TRP A 1 2 ? 4.473 -32.124 35.992 1.00 97.14 ? 2 TRP A CB 1 ATOM 12 C CG . TRP A 1 2 ? 4.646 -33.557 35.593 1.00 97.15 ? 2 TRP A CG 1 ATOM 13 C CD1 . TRP A 1 2 ? 5.100 -34.564 36.396 1.00 97.06 ? 2 TRP A CD1 1 ATOM 14 C CD2 . TRP A 1 2 ? 4.367 -34.163 34.317 1.00 97.85 ? 2 TRP A CD2 1 ATOM 15 N NE1 . TRP A 1 2 ? 5.123 -35.755 35.708 1.00 96.88 ? 2 TRP A NE1 1 ATOM 16 C CE2 . TRP A 1 2 ? 4.680 -35.540 34.430 1.00 97.30 ? 2 TRP A CE2 1 ATOM 17 C CE3 . TRP A 1 2 ? 3.891 -33.685 33.088 1.00 98.67 ? 2 TRP A CE3 1 ATOM 18 C CZ2 . TRP A 1 2 ? 4.535 -36.433 33.370 1.00 98.02 ? 2 TRP A CZ2 1 ATOM 19 C CZ3 . TRP A 1 2 ? 3.746 -34.579 32.032 1.00 99.38 ? 2 TRP A CZ3 1 ATOM 20 C CH2 . TRP A 1 2 ? 4.067 -35.936 32.183 1.00 98.96 ? 2 TRP A CH2 1 ATOM 21 N N . GLU A 1 3 ? 2.109 -30.008 34.409 1.00 96.46 ? 3 GLU A N 1 ATOM 22 C CA . GLU A 1 3 ? 0.956 -29.182 34.548 1.00 96.12 ? 3 GLU A CA 1 ATOM 23 C C . GLU A 1 3 ? 0.606 -28.930 33.097 1.00 96.25 ? 3 GLU A C 1 ATOM 24 O O . GLU A 1 3 ? 1.486 -28.944 32.250 1.00 96.26 ? 3 GLU A O 1 ATOM 25 C CB . GLU A 1 3 ? 1.234 -27.839 35.237 1.00 95.93 ? 3 GLU A CB 1 ATOM 26 C CG . GLU A 1 3 ? 0.327 -27.519 36.417 1.00 94.57 ? 3 GLU A CG 1 ATOM 27 C CD . GLU A 1 3 ? -0.994 -26.843 36.023 1.00 93.54 ? 3 GLU A CD 1 ATOM 28 O OE1 . GLU A 1 3 ? -1.263 -26.735 34.815 1.00 93.74 ? 3 GLU A OE1 1 ATOM 29 O OE2 . GLU A 1 3 ? -1.738 -26.438 36.938 1.00 92.86 ? 3 GLU A OE2 1 ATOM 30 N N . VAL A 1 4 ? -0.664 -28.709 32.781 1.00 96.15 ? 4 VAL A N 1 ATOM 31 C CA . VAL A 1 4 ? -1.006 -28.422 31.391 1.00 96.06 ? 4 VAL A CA 1 ATOM 32 C C . VAL A 1 4 ? -2.156 -27.462 31.217 1.00 95.94 ? 4 VAL A C 1 ATOM 33 O O . VAL A 1 4 ? -3.289 -27.849 30.924 1.00 96.31 ? 4 VAL A O 1 ATOM 34 C CB . VAL A 1 4 ? -1.184 -29.723 30.581 1.00 96.01 ? 4 VAL A CB 1 ATOM 35 C CG1 . VAL A 1 4 ? 0.008 -29.932 29.675 1.00 96.30 ? 4 VAL A CG1 1 ATOM 36 C CG2 . VAL A 1 4 ? -1.363 -30.913 31.520 1.00 96.33 ? 4 VAL A CG2 1 ATOM 37 N N . GLY A 1 5 ? -1.820 -26.176 31.431 1.00 95.79 ? 5 GLY A N 1 ATOM 38 C CA . GLY A 1 5 ? -2.699 -25.002 31.198 1.00 95.85 ? 5 GLY A CA 1 ATOM 39 C C . GLY A 1 5 ? -3.582 -24.505 32.345 1.00 95.82 ? 5 GLY A C 1 ATOM 40 O O . GLY A 1 5 ? -4.504 -25.204 32.783 1.00 95.75 ? 5 GLY A O 1 ATOM 41 N N . CYS A 1 6 ? -3.264 -23.320 32.815 1.00 95.79 ? 6 CYS A N 1 ATOM 42 C CA . CYS A 1 6 ? -3.995 -22.545 33.802 1.00 96.05 ? 6 CYS A CA 1 ATOM 43 C C . CYS A 1 6 ? -4.211 -21.236 33.067 1.00 96.12 ? 6 CYS A C 1 ATOM 44 O O . CYS A 1 6 ? -3.621 -21.025 32.015 1.00 96.01 ? 6 CYS A O 1 ATOM 45 C CB . CYS A 1 6 ? -3.211 -22.316 35.105 1.00 95.79 ? 6 CYS A CB 1 ATOM 46 S SG . CYS A 1 6 ? -2.678 -20.596 35.361 1.00 97.21 ? 6 CYS A SG 1 ATOM 47 N N . GLY A 1 7 ? -5.000 -20.338 33.583 1.00 96.33 ? 7 GLY A N 1 ATOM 48 C CA . GLY A 1 7 ? -5.289 -19.097 32.878 1.00 96.46 ? 7 GLY A CA 1 ATOM 49 C C . GLY A 1 7 ? -6.789 -18.983 32.889 1.00 96.73 ? 7 GLY A C 1 ATOM 50 O O . GLY A 1 7 ? -7.488 -19.210 31.898 1.00 96.48 ? 7 GLY A O 1 ATOM 51 N N . ALA A 1 8 ? -7.283 -18.631 34.067 1.00 96.76 ? 8 ALA A N 1 ATOM 52 C CA . ALA A 1 8 ? -8.702 -18.567 34.296 1.00 96.63 ? 8 ALA A CA 1 ATOM 53 C C . ALA A 1 8 ? -9.329 -17.342 33.630 1.00 96.52 ? 8 ALA A C 1 ATOM 54 O O . ALA A 1 8 ? -10.298 -17.472 32.894 1.00 96.87 ? 8 ALA A O 1 ATOM 55 C CB . ALA A 1 8 ? -8.991 -18.586 35.799 1.00 96.68 ? 8 ALA A CB 1 ATOM 56 N N . PRO A 1 9 ? -8.891 -16.150 34.014 1.00 96.39 ? 9 PRO A N 1 ATOM 57 C CA . PRO A 1 9 ? -9.433 -14.896 33.478 1.00 96.04 ? 9 PRO A CA 1 ATOM 58 C C . PRO A 1 9 ? -9.938 -14.775 32.022 1.00 95.74 ? 9 PRO A C 1 ATOM 59 O O . PRO A 1 9 ? -10.901 -14.031 31.813 1.00 95.54 ? 9 PRO A O 1 ATOM 60 C CB . PRO A 1 9 ? -8.371 -13.869 33.880 1.00 95.80 ? 9 PRO A CB 1 ATOM 61 C CG . PRO A 1 9 ? -7.987 -14.347 35.277 1.00 96.17 ? 9 PRO A CG 1 ATOM 62 C CD . PRO A 1 9 ? -8.067 -15.889 35.211 1.00 96.40 ? 9 PRO A CD 1 ATOM 63 N N . VAL A 1 10 ? -9.390 -15.505 31.063 1.00 95.19 ? 10 VAL A N 1 ATOM 64 C CA . VAL A 1 10 ? -9.829 -15.288 29.688 1.00 94.86 ? 10 VAL A CA 1 ATOM 65 C C . VAL A 1 10 ? -10.851 -16.282 29.099 1.00 94.69 ? 10 VAL A C 1 ATOM 66 O O . VAL A 1 10 ? -10.550 -17.470 28.984 1.00 94.91 ? 10 VAL A O 1 ATOM 67 C CB . VAL A 1 10 ? -8.610 -15.144 28.770 1.00 94.69 ? 10 VAL A CB 1 ATOM 68 C CG1 . VAL A 1 10 ? -7.795 -13.943 29.207 1.00 94.79 ? 10 VAL A CG1 1 ATOM 69 C CG2 . VAL A 1 10 ? -7.760 -16.403 28.817 1.00 95.10 ? 10 VAL A CG2 1 ATOM 70 N N . PRO A 1 11 ? -12.104 -15.848 28.951 1.00 94.42 ? 11 PRO A N 1 ATOM 71 C CA . PRO A 1 11 ? -13.152 -16.560 28.227 1.00 94.43 ? 11 PRO A CA 1 ATOM 72 C C . PRO A 1 11 ? -12.785 -17.088 26.904 1.00 94.36 ? 11 PRO A C 1 ATOM 73 O O . PRO A 1 11 ? -12.018 -16.478 26.165 1.00 94.33 ? 11 PRO A O 1 ATOM 74 C CB . PRO A 1 11 ? -14.268 -15.521 28.110 1.00 94.57 ? 11 PRO A CB 1 ATOM 75 C CG . PRO A 1 11 ? -14.214 -14.866 29.426 1.00 94.31 ? 11 PRO A CG 1 ATOM 76 C CD . PRO A 1 11 ? -12.722 -14.849 29.837 1.00 94.48 ? 11 PRO A CD 1 ATOM 77 N N . LEU A 1 12 ? -13.336 -18.249 26.607 1.00 94.11 ? 12 LEU A N 1 ATOM 78 C CA . LEU A 1 12 ? -13.041 -18.776 25.330 1.00 93.64 ? 12 LEU A CA 1 ATOM 79 C C . LEU A 1 12 ? -13.938 -18.073 24.384 1.00 93.54 ? 12 LEU A C 1 ATOM 80 O O . LEU A 1 12 ? -14.876 -17.361 24.752 1.00 93.01 ? 12 LEU A O 1 ATOM 81 C CB . LEU A 1 12 ? -13.306 -20.262 25.247 1.00 93.62 ? 12 LEU A CB 1 ATOM 82 C CG . LEU A 1 12 ? -11.997 -21.011 25.378 1.00 93.49 ? 12 LEU A CG 1 ATOM 83 C CD1 . LEU A 1 12 ? -11.703 -21.191 26.865 1.00 93.15 ? 12 LEU A CD1 1 ATOM 84 C CD2 . LEU A 1 12 ? -12.101 -22.331 24.657 1.00 92.95 ? 12 LEU A CD2 1 ATOM 85 N N . VAL A 1 13 ? -13.627 -18.321 23.132 1.00 93.52 ? 13 VAL A N 1 ATOM 86 C CA . VAL A 1 13 ? -14.389 -17.783 22.063 1.00 93.29 ? 13 VAL A CA 1 ATOM 87 C C . VAL A 1 13 ? -14.330 -18.824 20.945 1.00 93.22 ? 13 VAL A C 1 ATOM 88 O O . VAL A 1 13 ? -13.230 -19.190 20.509 1.00 93.30 ? 13 VAL A O 1 ATOM 89 C CB . VAL A 1 13 ? -13.765 -16.426 21.648 1.00 93.21 ? 13 VAL A CB 1 ATOM 90 C CG1 . VAL A 1 13 ? -14.661 -15.273 22.083 1.00 93.37 ? 13 VAL A CG1 1 ATOM 91 C CG2 . VAL A 1 13 ? -12.354 -16.266 22.263 1.00 92.83 ? 13 VAL A CG2 1 ATOM 92 N N . LYS A 1 14 ? -15.547 -19.375 20.570 1.00 93.02 ? 14 LYS A N 1 ATOM 93 C CA . LYS A 1 14 ? -15.627 -20.378 19.506 1.00 92.71 ? 14 LYS A CA 1 ATOM 94 C C . LYS A 1 14 ? -15.343 -19.627 18.272 1.00 91.86 ? 14 LYS A C 1 ATOM 95 O O . LYS A 1 14 ? -16.055 -18.749 17.791 1.00 91.84 ? 14 LYS A O 1 ATOM 96 C CB . LYS A 1 14 ? -16.916 -21.180 19.393 1.00 93.26 ? 14 LYS A CB 1 ATOM 97 C CG . LYS A 1 14 ? -16.737 -22.353 18.468 1.00 93.77 ? 14 LYS A CG 1 ATOM 98 C CD . LYS A 1 14 ? -16.167 -23.545 19.232 1.00 94.69 ? 14 LYS A CD 1 ATOM 99 C CE . LYS A 1 14 ? -14.721 -23.357 19.649 1.00 95.87 ? 14 LYS A CE 1 ATOM 100 N NZ . LYS A 1 14 ? -14.234 -24.485 20.486 1.00 94.91 ? 14 LYS A NZ 1 ATOM 101 N N . CYS A 1 15 ? -14.210 -20.049 17.854 1.00 90.67 ? 15 CYS A N 1 ATOM 102 C CA . CYS A 1 15 ? -13.438 -19.480 16.825 1.00 89.41 ? 15 CYS A CA 1 ATOM 103 C C . CYS A 1 15 ? -14.012 -19.260 15.468 1.00 89.93 ? 15 CYS A C 1 ATOM 104 O O . CYS A 1 15 ? -14.954 -19.869 14.967 1.00 89.98 ? 15 CYS A O 1 ATOM 105 C CB . CYS A 1 15 ? -12.170 -20.304 16.691 1.00 88.15 ? 15 CYS A CB 1 ATOM 106 S SG . CYS A 1 15 ? -10.796 -19.746 17.757 1.00 83.18 ? 15 CYS A SG 1 ATOM 107 N N . ASP A 1 16 ? -13.279 -18.304 14.925 1.00 90.12 ? 16 ASP A N 1 ATOM 108 C CA . ASP A 1 16 ? -13.393 -17.822 13.605 1.00 90.62 ? 16 ASP A CA 1 ATOM 109 C C . ASP A 1 16 ? -12.761 -18.848 12.690 1.00 90.73 ? 16 ASP A C 1 ATOM 110 O O . ASP A 1 16 ? -11.654 -18.692 12.184 1.00 90.20 ? 16 ASP A O 1 ATOM 111 C CB . ASP A 1 16 ? -12.740 -16.463 13.460 1.00 90.57 ? 16 ASP A CB 1 ATOM 112 C CG . ASP A 1 16 ? -13.667 -15.320 13.849 1.00 91.09 ? 16 ASP A CG 1 ATOM 113 O OD1 . ASP A 1 16 ? -14.790 -15.599 14.307 1.00 90.52 ? 16 ASP A OD1 1 ATOM 114 O OD2 . ASP A 1 16 ? -13.249 -14.153 13.710 1.00 90.77 ? 16 ASP A OD2 1 ATOM 115 N N . GLU A 1 17 ? -13.541 -19.889 12.508 1.00 90.86 ? 17 GLU A N 1 ATOM 116 C CA . GLU A 1 17 ? -13.292 -21.013 11.636 1.00 90.90 ? 17 GLU A CA 1 ATOM 117 C C . GLU A 1 17 ? -13.932 -20.357 10.446 1.00 90.40 ? 17 GLU A C 1 ATOM 118 O O . GLU A 1 17 ? -13.708 -20.698 9.275 1.00 90.34 ? 17 GLU A O 1 ATOM 119 C CB . GLU A 1 17 ? -14.121 -22.201 12.120 1.00 91.19 ? 17 GLU A CB 1 ATOM 120 C CG . GLU A 1 17 ? -15.625 -21.906 12.139 1.00 92.90 ? 17 GLU A CG 1 ATOM 121 C CD . GLU A 1 17 ? -16.362 -22.355 13.406 1.00 93.22 ? 17 GLU A CD 1 ATOM 122 O OE1 . GLU A 1 17 ? -16.386 -23.572 13.724 1.00 94.16 ? 17 GLU A OE1 1 ATOM 123 O OE2 . GLU A 1 17 ? -16.956 -21.477 14.069 1.00 92.60 ? 17 GLU A OE2 1 ATOM 124 N N . ASN A 1 18 ? -14.715 -19.350 10.810 1.00 89.42 ? 18 ASN A N 1 ATOM 125 C CA . ASN A 1 18 ? -15.368 -18.473 9.879 1.00 88.55 ? 18 ASN A CA 1 ATOM 126 C C . ASN A 1 18 ? -14.360 -17.501 9.271 1.00 87.39 ? 18 ASN A C 1 ATOM 127 O O . ASN A 1 18 ? -13.930 -17.629 8.121 1.00 87.20 ? 18 ASN A O 1 ATOM 128 C CB . ASN A 1 18 ? -16.397 -17.595 10.620 1.00 88.68 ? 18 ASN A CB 1 ATOM 129 C CG . ASN A 1 18 ? -17.251 -18.366 11.635 1.00 89.71 ? 18 ASN A CG 1 ATOM 130 O OD1 . ASN A 1 18 ? -18.129 -19.157 11.261 1.00 92.17 ? 18 ASN A OD1 1 ATOM 131 N ND2 . ASN A 1 18 ? -17.035 -18.093 12.920 1.00 88.75 ? 18 ASN A ND2 1 ATOM 132 N N . SER A 1 19 ? -13.984 -16.532 10.098 1.00 85.83 ? 19 SER A N 1 ATOM 133 C CA . SER A 1 19 ? -13.264 -15.330 9.669 1.00 84.09 ? 19 SER A CA 1 ATOM 134 C C . SER A 1 19 ? -12.158 -15.328 8.621 1.00 82.45 ? 19 SER A C 1 ATOM 135 O O . SER A 1 19 ? -11.153 -16.019 8.732 1.00 82.95 ? 19 SER A O 1 ATOM 136 C CB . SER A 1 19 ? -12.800 -14.523 10.874 1.00 84.02 ? 19 SER A CB 1 ATOM 137 O OG . SER A 1 19 ? -13.569 -13.339 11.005 1.00 84.78 ? 19 SER A OG 1 ATOM 138 N N . PRO A 1 20 ? -12.400 -14.538 7.582 1.00 80.49 ? 20 PRO A N 1 ATOM 139 C CA . PRO A 1 20 ? -11.369 -14.163 6.616 1.00 78.35 ? 20 PRO A CA 1 ATOM 140 C C . PRO A 1 20 ? -10.498 -13.076 7.237 1.00 76.22 ? 20 PRO A C 1 ATOM 141 O O . PRO A 1 20 ? -9.473 -12.721 6.664 1.00 76.14 ? 20 PRO A O 1 ATOM 142 C CB . PRO A 1 20 ? -12.167 -13.563 5.462 1.00 78.76 ? 20 PRO A CB 1 ATOM 143 C CG . PRO A 1 20 ? -13.595 -13.981 5.722 1.00 80.25 ? 20 PRO A CG 1 ATOM 144 C CD . PRO A 1 20 ? -13.733 -14.026 7.216 1.00 80.30 ? 20 PRO A CD 1 ATOM 145 N N . TYR A 1 21 ? -10.888 -12.560 8.405 1.00 73.30 ? 21 TYR A N 1 ATOM 146 C CA . TYR A 1 21 ? -10.098 -11.522 9.077 1.00 70.07 ? 21 TYR A CA 1 ATOM 147 C C . TYR A 1 21 ? -9.612 -11.973 10.451 1.00 68.21 ? 21 TYR A C 1 ATOM 148 O O . TYR A 1 21 ? -10.229 -12.823 11.070 1.00 68.15 ? 21 TYR A O 1 ATOM 149 C CB . TYR A 1 21 ? -10.916 -10.242 9.182 1.00 69.75 ? 21 TYR A CB 1 ATOM 150 C CG . TYR A 1 21 ? -11.512 -9.857 7.867 1.00 69.34 ? 21 TYR A CG 1 ATOM 151 C CD1 . TYR A 1 21 ? -10.711 -9.353 6.861 1.00 69.38 ? 21 TYR A CD1 1 ATOM 152 C CD2 . TYR A 1 21 ? -12.875 -10.028 7.612 1.00 70.05 ? 21 TYR A CD2 1 ATOM 153 C CE1 . TYR A 1 21 ? -11.226 -9.009 5.645 1.00 70.53 ? 21 TYR A CE1 1 ATOM 154 C CE2 . TYR A 1 21 ? -13.420 -9.677 6.385 1.00 69.70 ? 21 TYR A CE2 1 ATOM 155 C CZ . TYR A 1 21 ? -12.570 -9.165 5.404 1.00 70.15 ? 21 TYR A CZ 1 ATOM 156 O OH . TYR A 1 21 ? -13.033 -8.815 4.175 1.00 69.02 ? 21 TYR A OH 1 ATOM 157 N N . ARG A 1 22 ? -8.501 -11.417 10.924 1.00 65.64 ? 22 ARG A N 1 ATOM 158 C CA . ARG A 1 22 ? -8.006 -11.765 12.241 1.00 63.75 ? 22 ARG A CA 1 ATOM 159 C C . ARG A 1 22 ? -9.099 -11.414 13.199 1.00 62.63 ? 22 ARG A C 1 ATOM 160 O O . ARG A 1 22 ? -9.949 -10.597 12.862 1.00 62.68 ? 22 ARG A O 1 ATOM 161 C CB . ARG A 1 22 ? -6.802 -10.895 12.626 1.00 63.36 ? 22 ARG A CB 1 ATOM 162 C CG . ARG A 1 22 ? -5.600 -10.963 11.702 1.00 61.70 ? 22 ARG A CG 1 ATOM 163 C CD . ARG A 1 22 ? -4.547 -9.874 11.992 1.00 58.63 ? 22 ARG A CD 1 ATOM 164 N NE . ARG A 1 22 ? -3.328 -9.996 11.190 1.00 51.25 ? 22 ARG A NE 1 ATOM 165 C CZ . ARG A 1 22 ? -2.370 -10.837 11.471 1.00 51.53 ? 22 ARG A CZ 1 ATOM 166 N NH1 . ARG A 1 22 ? -2.480 -11.601 12.537 1.00 54.10 ? 22 ARG A NH1 1 ATOM 167 N NH2 . ARG A 1 22 ? -1.301 -10.924 10.708 1.00 51.66 ? 22 ARG A NH2 1 ATOM 168 N N . THR A 1 23 ? -9.089 -11.995 14.393 1.00 60.83 ? 23 THR A N 1 ATOM 169 C CA . THR A 1 23 ? -9.979 -11.456 15.415 1.00 60.21 ? 23 THR A CA 1 ATOM 170 C C . THR A 1 23 ? -9.249 -10.273 16.086 1.00 59.80 ? 23 THR A C 1 ATOM 171 O O . THR A 1 23 ? -8.030 -10.071 15.902 1.00 58.42 ? 23 THR A O 1 ATOM 172 C CB . THR A 1 23 ? -10.376 -12.487 16.534 1.00 60.56 ? 23 THR A CB 1 ATOM 173 O OG1 . THR A 1 23 ? -9.257 -12.742 17.403 1.00 59.09 ? 23 THR A OG1 1 ATOM 174 C CG2 . THR A 1 23 ? -10.818 -13.864 15.967 1.00 59.40 ? 23 THR A CG2 1 ATOM 175 N N . ILE A 1 24 ? -10.005 -9.506 16.869 1.00 59.82 ? 24 ILE A N 1 ATOM 176 C CA . ILE A 1 24 ? -9.442 -8.402 17.647 1.00 59.47 ? 24 ILE A CA 1 ATOM 177 C C . ILE A 1 24 ? -8.561 -8.920 18.761 1.00 59.55 ? 24 ILE A C 1 ATOM 178 O O . ILE A 1 24 ? -7.482 -8.377 18.979 1.00 60.28 ? 24 ILE A O 1 ATOM 179 C CB . ILE A 1 24 ? -10.527 -7.448 18.184 1.00 59.13 ? 24 ILE A CB 1 ATOM 180 C CG1 . ILE A 1 24 ? -10.741 -6.296 17.204 1.00 59.91 ? 24 ILE A CG1 1 ATOM 181 C CG2 . ILE A 1 24 ? -10.087 -6.827 19.483 1.00 58.61 ? 24 ILE A CG2 1 ATOM 182 C CD1 . ILE A 1 24 ? -9.562 -5.310 17.159 1.00 59.60 ? 24 ILE A CD1 1 ATOM 183 N N . THR A 1 25 ? -8.989 -9.974 19.454 1.00 58.57 ? 25 THR A N 1 ATOM 184 C CA . THR A 1 25 ? -8.164 -10.531 20.507 1.00 58.14 ? 25 THR A CA 1 ATOM 185 C C . THR A 1 25 ? -6.997 -11.398 20.034 1.00 57.42 ? 25 THR A C 1 ATOM 186 O O . THR A 1 25 ? -6.185 -11.825 20.854 1.00 55.58 ? 25 THR A O 1 ATOM 187 C CB . THR A 1 25 ? -9.001 -11.386 21.446 1.00 58.98 ? 25 THR A CB 1 ATOM 188 O OG1 . THR A 1 25 ? -9.731 -12.353 20.670 1.00 60.50 ? 25 THR A OG1 1 ATOM 189 C CG2 . THR A 1 25 ? -10.053 -10.521 22.187 1.00 58.22 ? 25 THR A CG2 1 ATOM 190 N N . GLY A 1 26 ? -6.949 -11.708 18.735 1.00 57.08 ? 26 GLY A N 1 ATOM 191 C CA . GLY A 1 26 ? -5.898 -12.551 18.189 1.00 56.28 ? 26 GLY A CA 1 ATOM 192 C C . GLY A 1 26 ? -6.170 -14.017 18.361 1.00 56.52 ? 26 GLY A C 1 ATOM 193 O O . GLY A 1 26 ? -5.387 -14.896 17.957 1.00 55.06 ? 26 GLY A O 1 ATOM 194 N N . ASP A 1 27 ? -7.312 -14.306 18.974 1.00 57.53 ? 27 ASP A N 1 ATOM 195 C CA . ASP A 1 27 ? -7.745 -15.678 19.096 1.00 57.31 ? 27 ASP A CA 1 ATOM 196 C C . ASP A 1 27 ? -7.950 -16.272 17.711 1.00 56.83 ? 27 ASP A C 1 ATOM 197 O O . ASP A 1 27 ? -7.998 -15.549 16.736 1.00 54.88 ? 27 ASP A O 1 ATOM 198 C CB . ASP A 1 27 ? -9.025 -15.708 19.877 1.00 57.72 ? 27 ASP A CB 1 ATOM 199 C CG . ASP A 1 27 ? -8.789 -15.735 21.337 1.00 58.49 ? 27 ASP A CG 1 ATOM 200 O OD1 . ASP A 1 27 ? -8.439 -16.826 21.813 1.00 57.86 ? 27 ASP A OD1 1 ATOM 201 O OD2 . ASP A 1 27 ? -8.927 -14.729 22.084 1.00 60.45 ? 27 ASP A OD2 1 ATOM 202 N N . CYS A 1 28 ? -8.013 -17.599 17.641 1.00 57.84 ? 28 CYS A N 1 ATOM 203 C CA . CYS A 1 28 ? -8.298 -18.320 16.393 1.00 59.08 ? 28 CYS A CA 1 ATOM 204 C C . CYS A 1 28 ? -7.296 -18.174 15.266 1.00 58.81 ? 28 CYS A C 1 ATOM 205 O O . CYS A 1 28 ? -7.569 -18.573 14.143 1.00 59.16 ? 28 CYS A O 1 ATOM 206 C CB . CYS A 1 28 ? -9.653 -17.894 15.862 1.00 59.43 ? 28 CYS A CB 1 ATOM 207 S SG . CYS A 1 28 ? -10.771 -17.670 17.218 1.00 64.06 ? 28 CYS A SG 1 ATOM 208 N N . ASN A 1 29 ? -6.161 -17.562 15.535 1.00 58.82 ? 29 ASN A N 1 ATOM 209 C CA . ASN A 1 29 ? -5.163 -17.432 14.494 1.00 58.46 ? 29 ASN A CA 1 ATOM 210 C C . ASN A 1 29 ? -4.655 -18.829 14.211 1.00 58.64 ? 29 ASN A C 1 ATOM 211 O O . ASN A 1 29 ? -4.608 -19.264 13.084 1.00 59.03 ? 29 ASN A O 1 ATOM 212 C CB . ASN A 1 29 ? -4.025 -16.513 14.938 1.00 57.86 ? 29 ASN A CB 1 ATOM 213 C CG . ASN A 1 29 ? -3.054 -16.196 13.796 1.00 59.46 ? 29 ASN A CG 1 ATOM 214 O OD1 . ASN A 1 29 ? -2.314 -17.074 13.342 1.00 57.57 ? 29 ASN A OD1 1 ATOM 215 N ND2 . ASN A 1 29 ? -3.068 -14.934 13.320 1.00 58.63 ? 29 ASN A ND2 1 ATOM 216 N N . ASN A 1 30 ? -4.307 -19.542 15.265 1.00 59.08 ? 30 ASN A N 1 ATOM 217 C CA . ASN A 1 30 ? -3.792 -20.862 15.126 1.00 59.72 ? 30 ASN A CA 1 ATOM 218 C C . ASN A 1 30 ? -4.932 -21.779 15.414 1.00 60.77 ? 30 ASN A C 1 ATOM 219 O O . ASN A 1 30 ? -5.603 -21.641 16.432 1.00 61.05 ? 30 ASN A O 1 ATOM 220 C CB . ASN A 1 30 ? -2.650 -21.092 16.091 1.00 59.08 ? 30 ASN A CB 1 ATOM 221 C CG . ASN A 1 30 ? -1.989 -22.419 15.889 1.00 59.64 ? 30 ASN A CG 1 ATOM 222 O OD1 . ASN A 1 30 ? -2.560 -23.454 16.247 1.00 61.52 ? 30 ASN A OD1 1 ATOM 223 N ND2 . ASN A 1 30 ? -0.766 -22.418 15.331 1.00 58.81 ? 30 ASN A ND2 1 ATOM 224 N N . ARG A 1 31 ? -5.129 -22.727 14.510 1.00 62.33 ? 31 ARG A N 1 ATOM 225 C CA . ARG A 1 31 ? -6.271 -23.623 14.546 1.00 64.05 ? 31 ARG A CA 1 ATOM 226 C C . ARG A 1 31 ? -6.248 -24.734 15.607 1.00 64.50 ? 31 ARG A C 1 ATOM 227 O O . ARG A 1 31 ? -7.278 -24.980 16.235 1.00 65.37 ? 31 ARG A O 1 ATOM 228 C CB . ARG A 1 31 ? -6.617 -24.119 13.124 1.00 64.16 ? 31 ARG A CB 1 ATOM 229 C CG . ARG A 1 31 ? -7.262 -22.994 12.285 1.00 64.68 ? 31 ARG A CG 1 ATOM 230 C CD . ARG A 1 31 ? -7.499 -23.273 10.780 1.00 66.16 ? 31 ARG A CD 1 ATOM 231 N NE . ARG A 1 31 ? -8.727 -22.607 10.337 1.00 66.33 ? 31 ARG A NE 1 ATOM 232 C CZ . ARG A 1 31 ? -8.905 -21.948 9.176 1.00 67.33 ? 31 ARG A CZ 1 ATOM 233 N NH1 . ARG A 1 31 ? -7.929 -21.844 8.293 1.00 65.61 ? 31 ARG A NH1 1 ATOM 234 N NH2 . ARG A 1 31 ? -10.086 -21.388 8.899 1.00 66.93 ? 31 ARG A NH2 1 ATOM 235 N N . ARG A 1 32 ? -5.095 -25.342 15.856 1.00 64.51 ? 32 ARG A N 1 ATOM 236 C CA . ARG A 1 32 ? -5.009 -26.409 16.858 1.00 65.13 ? 32 ARG A CA 1 ATOM 237 C C . ARG A 1 32 ? -4.943 -25.891 18.290 1.00 64.92 ? 32 ARG A C 1 ATOM 238 O O . ARG A 1 32 ? -5.352 -26.580 19.243 1.00 64.11 ? 32 ARG A O 1 ATOM 239 C CB . ARG A 1 32 ? -3.825 -27.336 16.572 1.00 65.72 ? 32 ARG A CB 1 ATOM 240 C CG . ARG A 1 32 ? -4.105 -28.305 15.411 1.00 68.61 ? 32 ARG A CG 1 ATOM 241 C CD . ARG A 1 32 ? -2.888 -29.005 14.839 1.00 74.19 ? 32 ARG A CD 1 ATOM 242 N NE . ARG A 1 32 ? -2.080 -29.635 15.883 1.00 81.03 ? 32 ARG A NE 1 ATOM 243 C CZ . ARG A 1 32 ? -0.750 -29.692 15.862 1.00 83.35 ? 32 ARG A CZ 1 ATOM 244 N NH1 . ARG A 1 32 ? -0.074 -29.159 14.837 1.00 83.90 ? 32 ARG A NH1 1 ATOM 245 N NH2 . ARG A 1 32 ? -0.096 -30.277 16.864 1.00 82.60 ? 32 ARG A NH2 1 ATOM 246 N N . SER A 1 33 ? -4.412 -24.677 18.430 1.00 64.34 ? 33 SER A N 1 ATOM 247 C CA . SER A 1 33 ? -4.312 -24.018 19.715 1.00 63.74 ? 33 SER A CA 1 ATOM 248 C C . SER A 1 33 ? -4.681 -22.546 19.541 1.00 62.72 ? 33 SER A C 1 ATOM 249 O O . SER A 1 33 ? -3.829 -21.658 19.495 1.00 63.02 ? 33 SER A O 1 ATOM 250 C CB . SER A 1 33 ? -2.930 -24.196 20.305 1.00 63.85 ? 33 SER A CB 1 ATOM 251 O OG . SER A 1 33 ? -2.796 -23.305 21.393 1.00 67.36 ? 33 SER A OG 1 ATOM 252 N N . PRO A 1 34 ? -5.985 -22.318 19.471 1.00 61.53 ? 34 PRO A N 1 ATOM 253 C CA . PRO A 1 34 ? -6.565 -21.009 19.164 1.00 60.10 ? 34 PRO A CA 1 ATOM 254 C C . PRO A 1 34 ? -6.248 -19.882 20.144 1.00 58.39 ? 34 PRO A C 1 ATOM 255 O O . PRO A 1 34 ? -6.442 -18.732 19.740 1.00 58.45 ? 34 PRO A O 1 ATOM 256 C CB . PRO A 1 34 ? -8.071 -21.306 19.171 1.00 60.44 ? 34 PRO A CB 1 ATOM 257 C CG . PRO A 1 34 ? -8.163 -22.480 20.146 1.00 61.50 ? 34 PRO A CG 1 ATOM 258 C CD . PRO A 1 34 ? -7.020 -23.338 19.735 1.00 60.88 ? 34 PRO A CD 1 ATOM 259 N N . ALA A 1 35 ? -5.825 -20.169 21.371 1.00 56.65 ? 35 ALA A N 1 ATOM 260 C CA . ALA A 1 35 ? -5.402 -19.085 22.270 1.00 56.83 ? 35 ALA A CA 1 ATOM 261 C C . ALA A 1 35 ? -3.947 -18.598 22.038 1.00 56.24 ? 35 ALA A C 1 ATOM 262 O O . ALA A 1 35 ? -3.592 -17.519 22.496 1.00 56.17 ? 35 ALA A O 1 ATOM 263 C CB . ALA A 1 35 ? -5.617 -19.435 23.763 1.00 56.40 ? 35 ALA A CB 1 ATOM 264 N N . LEU A 1 36 ? -3.125 -19.373 21.329 1.00 55.32 ? 36 LEU A N 1 ATOM 265 C CA . LEU A 1 36 ? -1.737 -18.971 21.040 1.00 54.63 ? 36 LEU A CA 1 ATOM 266 C C . LEU A 1 36 ? -1.613 -17.597 20.344 1.00 54.33 ? 36 LEU A C 1 ATOM 267 O O . LEU A 1 36 ? -2.070 -17.384 19.225 1.00 52.88 ? 36 LEU A O 1 ATOM 268 C CB . LEU A 1 36 ? -1.047 -20.032 20.217 1.00 54.25 ? 36 LEU A CB 1 ATOM 269 C CG . LEU A 1 36 ? 0.033 -20.918 20.830 1.00 56.80 ? 36 LEU A CG 1 ATOM 270 C CD1 . LEU A 1 36 ? 0.045 -21.054 22.376 1.00 56.60 ? 36 LEU A CD1 1 ATOM 271 C CD2 . LEU A 1 36 ? 0.030 -22.290 20.135 1.00 56.36 ? 36 LEU A CD2 1 ATOM 272 N N . GLY A 1 37 ? -0.998 -16.653 21.043 1.00 54.32 ? 37 GLY A N 1 ATOM 273 C CA . GLY A 1 37 ? -0.838 -15.329 20.500 1.00 53.74 ? 37 GLY A CA 1 ATOM 274 C C . GLY A 1 37 ? -2.054 -14.506 20.777 1.00 53.58 ? 37 GLY A C 1 ATOM 275 O O . GLY A 1 37 ? -2.191 -13.415 20.252 1.00 55.01 ? 37 GLY A O 1 ATOM 276 N N . ALA A 1 38 ? -2.977 -15.017 21.570 1.00 52.71 ? 38 ALA A N 1 ATOM 277 C CA . ALA A 1 38 ? -4.083 -14.162 21.990 1.00 51.55 ? 38 ALA A CA 1 ATOM 278 C C . ALA A 1 38 ? -3.566 -13.234 23.082 1.00 50.50 ? 38 ALA A C 1 ATOM 279 O O . ALA A 1 38 ? -2.696 -13.590 23.857 1.00 50.40 ? 38 ALA A O 1 ATOM 280 C CB . ALA A 1 38 ? -5.290 -14.981 22.519 1.00 50.86 ? 38 ALA A CB 1 ATOM 281 N N . ALA A 1 39 ? -4.147 -12.063 23.134 1.00 50.29 ? 39 ALA A N 1 ATOM 282 C CA . ALA A 1 39 ? -3.898 -11.067 24.127 1.00 51.64 ? 39 ALA A CA 1 ATOM 283 C C . ALA A 1 39 ? -4.507 -11.485 25.446 1.00 52.21 ? 39 ALA A C 1 ATOM 284 O O . ALA A 1 39 ? -5.367 -12.362 25.502 1.00 54.20 ? 39 ALA A O 1 ATOM 285 C CB . ALA A 1 39 ? -4.528 -9.716 23.639 1.00 52.00 ? 39 ALA A CB 1 ATOM 286 N N . ASN A 1 40 ? -4.071 -10.860 26.519 1.00 52.32 ? 40 ASN A N 1 ATOM 287 C CA . ASN A 1 40 ? -4.596 -11.165 27.832 1.00 52.37 ? 40 ASN A CA 1 ATOM 288 C C . ASN A 1 40 ? -4.251 -12.532 28.406 1.00 52.02 ? 40 ASN A C 1 ATOM 289 O O . ASN A 1 40 ? -4.867 -12.965 29.375 1.00 52.03 ? 40 ASN A O 1 ATOM 290 C CB . ASN A 1 40 ? -6.105 -10.921 27.862 1.00 52.94 ? 40 ASN A CB 1 ATOM 291 C CG . ASN A 1 40 ? -6.450 -9.454 27.631 1.00 55.12 ? 40 ASN A CG 1 ATOM 292 O OD1 . ASN A 1 40 ? -7.236 -9.129 26.744 1.00 58.67 ? 40 ASN A OD1 1 ATOM 293 N ND2 . ASN A 1 40 ? -5.817 -8.556 28.399 1.00 55.85 ? 40 ASN A ND2 1 ATOM 294 N N . ARG A 1 41 ? -3.234 -13.170 27.832 1.00 51.52 ? 41 ARG A N 1 ATOM 295 C CA . ARG A 1 41 ? -2.700 -14.464 28.265 1.00 50.07 ? 41 ARG A CA 1 ATOM 296 C C . ARG A 1 41 ? -1.228 -14.327 28.671 1.00 48.07 ? 41 ARG A C 1 ATOM 297 O O . ARG A 1 41 ? -0.630 -13.289 28.433 1.00 47.01 ? 41 ARG A O 1 ATOM 298 C CB . ARG A 1 41 ? -2.853 -15.467 27.138 1.00 51.18 ? 41 ARG A CB 1 ATOM 299 C CG . ARG A 1 41 ? -4.252 -16.110 27.115 1.00 56.26 ? 41 ARG A CG 1 ATOM 300 C CD . ARG A 1 41 ? -4.901 -16.175 25.737 1.00 62.28 ? 41 ARG A CD 1 ATOM 301 N NE . ARG A 1 41 ? -6.165 -16.933 25.731 1.00 68.23 ? 41 ARG A NE 1 ATOM 302 C CZ . ARG A 1 41 ? -7.377 -16.393 25.549 1.00 70.42 ? 41 ARG A CZ 1 ATOM 303 N NH1 . ARG A 1 41 ? -7.517 -15.071 25.394 1.00 73.60 ? 41 ARG A NH1 1 ATOM 304 N NH2 . ARG A 1 41 ? -8.454 -17.166 25.537 1.00 69.53 ? 41 ARG A NH2 1 ATOM 305 N N . ALA A 1 42 ? -0.656 -15.339 29.330 1.00 45.92 ? 42 ALA A N 1 ATOM 306 C CA . ALA A 1 42 ? 0.723 -15.215 29.819 1.00 45.22 ? 42 ALA A CA 1 ATOM 307 C C . ALA A 1 42 ? 1.771 -14.942 28.731 1.00 43.88 ? 42 ALA A C 1 ATOM 308 O O . ALA A 1 42 ? 1.668 -15.483 27.639 1.00 41.99 ? 42 ALA A O 1 ATOM 309 C CB . ALA A 1 42 ? 1.133 -16.468 30.566 1.00 45.42 ? 42 ALA A CB 1 ATOM 310 N N . LEU A 1 43 ? 2.782 -14.133 29.046 1.00 42.97 ? 43 LEU A N 1 ATOM 311 C CA . LEU A 1 43 ? 3.937 -14.034 28.144 1.00 43.34 ? 43 LEU A CA 1 ATOM 312 C C . LEU A 1 43 ? 4.625 -15.393 28.049 1.00 44.22 ? 43 LEU A C 1 ATOM 313 O O . LEU A 1 43 ? 4.557 -16.206 28.951 1.00 44.80 ? 43 LEU A O 1 ATOM 314 C CB . LEU A 1 43 ? 4.923 -12.909 28.514 1.00 42.84 ? 43 LEU A CB 1 ATOM 315 C CG . LEU A 1 43 ? 4.501 -11.451 28.127 1.00 37.44 ? 43 LEU A CG 1 ATOM 316 C CD1 . LEU A 1 43 ? 4.970 -10.546 29.147 1.00 32.84 ? 43 LEU A CD1 1 ATOM 317 C CD2 . LEU A 1 43 ? 4.972 -10.982 26.744 1.00 31.70 ? 43 LEU A CD2 1 ATOM 318 N N . ALA A 1 44 ? 5.226 -15.691 26.917 1.00 44.56 ? 44 ALA A N 1 ATOM 319 C CA . ALA A 1 44 ? 5.894 -16.979 26.814 1.00 44.94 ? 44 ALA A CA 1 ATOM 320 C C . ALA A 1 44 ? 7.223 -16.993 27.558 1.00 46.24 ? 44 ALA A C 1 ATOM 321 O O . ALA A 1 44 ? 7.915 -15.968 27.673 1.00 46.35 ? 44 ALA A O 1 ATOM 322 C CB . ALA A 1 44 ? 6.080 -17.375 25.328 1.00 43.65 ? 44 ALA A CB 1 ATOM 323 N N . ARG A 1 45 ? 7.591 -18.173 28.054 1.00 47.81 ? 45 ARG A N 1 ATOM 324 C CA . ARG A 1 45 ? 8.861 -18.396 28.712 1.00 48.98 ? 45 ARG A CA 1 ATOM 325 C C . ARG A 1 45 ? 9.766 -19.179 27.759 1.00 50.01 ? 45 ARG A C 1 ATOM 326 O O . ARG A 1 45 ? 9.442 -20.286 27.377 1.00 51.70 ? 45 ARG A O 1 ATOM 327 C CB . ARG A 1 45 ? 8.669 -19.233 29.971 1.00 49.54 ? 45 ARG A CB 1 ATOM 328 C CG . ARG A 1 45 ? 8.037 -18.483 31.164 1.00 49.01 ? 45 ARG A CG 1 ATOM 329 C CD . ARG A 1 45 ? 8.955 -17.386 31.716 1.00 46.21 ? 45 ARG A CD 1 ATOM 330 N NE . ARG A 1 45 ? 8.306 -16.689 32.810 1.00 44.77 ? 45 ARG A NE 1 ATOM 331 C CZ . ARG A 1 45 ? 8.851 -15.715 33.506 1.00 46.33 ? 45 ARG A CZ 1 ATOM 332 N NH1 . ARG A 1 45 ? 10.112 -15.315 33.263 1.00 48.97 ? 45 ARG A NH1 1 ATOM 333 N NH2 . ARG A 1 45 ? 8.169 -15.208 34.512 1.00 45.65 ? 45 ARG A NH2 1 ATOM 334 N N . TRP A 1 46 ? 10.887 -18.590 27.370 1.00 50.14 ? 46 TRP A N 1 ATOM 335 C CA . TRP A 1 46 ? 11.856 -19.266 26.539 1.00 49.73 ? 46 TRP A CA 1 ATOM 336 C C . TRP A 1 46 ? 12.761 -20.107 27.432 1.00 49.78 ? 46 TRP A C 1 ATOM 337 O O . TRP A 1 46 ? 13.246 -21.191 27.040 1.00 49.24 ? 46 TRP A O 1 ATOM 338 C CB . TRP A 1 46 ? 12.651 -18.244 25.746 1.00 48.96 ? 46 TRP A CB 1 ATOM 339 C CG . TRP A 1 46 ? 11.877 -17.856 24.540 1.00 49.47 ? 46 TRP A CG 1 ATOM 340 C CD1 . TRP A 1 46 ? 10.650 -18.339 24.169 1.00 50.10 ? 46 TRP A CD1 1 ATOM 341 C CD2 . TRP A 1 46 ? 12.265 -16.941 23.521 1.00 48.16 ? 46 TRP A CD2 1 ATOM 342 N NE1 . TRP A 1 46 ? 10.239 -17.737 23.007 1.00 47.08 ? 46 TRP A NE1 1 ATOM 343 C CE2 . TRP A 1 46 ? 11.216 -16.869 22.596 1.00 46.80 ? 46 TRP A CE2 1 ATOM 344 C CE3 . TRP A 1 46 ? 13.406 -16.154 23.296 1.00 49.33 ? 46 TRP A CE3 1 ATOM 345 C CZ2 . TRP A 1 46 ? 11.281 -16.072 21.461 1.00 47.49 ? 46 TRP A CZ2 1 ATOM 346 C CZ3 . TRP A 1 46 ? 13.456 -15.346 22.171 1.00 44.35 ? 46 TRP A CZ3 1 ATOM 347 C CH2 . TRP A 1 46 ? 12.408 -15.318 21.282 1.00 48.98 ? 46 TRP A CH2 1 ATOM 348 N N . LEU A 1 47 ? 12.952 -19.573 28.635 1.00 48.75 ? 47 LEU A N 1 ATOM 349 C CA . LEU A 1 47 ? 13.670 -20.187 29.701 1.00 48.19 ? 47 LEU A CA 1 ATOM 350 C C . LEU A 1 47 ? 12.850 -20.021 30.947 1.00 48.67 ? 47 LEU A C 1 ATOM 351 O O . LEU A 1 47 ? 12.023 -19.116 31.040 1.00 49.03 ? 47 LEU A O 1 ATOM 352 C CB . LEU A 1 47 ? 15.000 -19.460 29.897 1.00 48.75 ? 47 LEU A CB 1 ATOM 353 C CG . LEU A 1 47 ? 16.269 -20.021 29.228 1.00 48.67 ? 47 LEU A CG 1 ATOM 354 C CD1 . LEU A 1 47 ? 16.038 -21.106 28.234 1.00 45.68 ? 47 LEU A CD1 1 ATOM 355 C CD2 . LEU A 1 47 ? 17.001 -18.849 28.556 1.00 51.30 ? 47 LEU A CD2 1 ATOM 356 N N . PRO A 1 48 ? 13.084 -20.885 31.926 1.00 49.19 ? 48 PRO A N 1 ATOM 357 C CA . PRO A 1 48 ? 12.354 -20.840 33.193 1.00 49.72 ? 48 PRO A CA 1 ATOM 358 C C . PRO A 1 48 ? 12.595 -19.592 33.971 1.00 49.21 ? 48 PRO A C 1 ATOM 359 O O . PRO A 1 48 ? 13.707 -19.089 34.001 1.00 47.85 ? 48 PRO A O 1 ATOM 360 C CB . PRO A 1 48 ? 12.927 -22.030 33.943 1.00 49.92 ? 48 PRO A CB 1 ATOM 361 C CG . PRO A 1 48 ? 13.349 -22.896 32.863 1.00 50.03 ? 48 PRO A CG 1 ATOM 362 C CD . PRO A 1 48 ? 14.032 -22.000 31.889 1.00 49.16 ? 48 PRO A CD 1 ATOM 363 N N . ALA A 1 49 ? 11.563 -19.141 34.667 1.00 50.03 ? 49 ALA A N 1 ATOM 364 C CA . ALA A 1 49 ? 11.640 -17.860 35.398 1.00 49.65 ? 49 ALA A CA 1 ATOM 365 C C . ALA A 1 49 ? 12.663 -17.993 36.515 1.00 49.34 ? 49 ALA A C 1 ATOM 366 O O . ALA A 1 49 ? 12.955 -19.089 36.962 1.00 47.43 ? 49 ALA A O 1 ATOM 367 C CB . ALA A 1 49 ? 10.292 -17.528 35.968 1.00 49.66 ? 49 ALA A CB 1 ATOM 368 N N . GLU A 1 50 ? 13.221 -16.881 36.975 1.00 50.44 ? 50 GLU A N 1 ATOM 369 C CA . GLU A 1 50 ? 14.180 -16.961 38.079 1.00 52.18 ? 50 GLU A CA 1 ATOM 370 C C . GLU A 1 50 ? 13.826 -15.937 39.101 1.00 52.36 ? 50 GLU A C 1 ATOM 371 O O . GLU A 1 50 ? 14.020 -14.727 38.918 1.00 53.72 ? 50 GLU A O 1 ATOM 372 C CB . GLU A 1 50 ? 15.652 -16.845 37.608 1.00 52.51 ? 50 GLU A CB 1 ATOM 373 C CG . GLU A 1 50 ? 16.121 -18.100 36.883 1.00 51.63 ? 50 GLU A CG 1 ATOM 374 C CD . GLU A 1 50 ? 17.395 -17.908 36.116 1.00 54.30 ? 50 GLU A CD 1 ATOM 375 O OE1 . GLU A 1 50 ? 18.156 -17.014 36.479 1.00 49.12 ? 50 GLU A OE1 1 ATOM 376 O OE2 . GLU A 1 50 ? 17.632 -18.662 35.154 1.00 55.25 ? 50 GLU A OE2 1 ATOM 377 N N . TYR A 1 51 ? 13.299 -16.460 40.183 1.00 52.50 ? 51 TYR A N 1 ATOM 378 C CA . TYR A 1 51 ? 12.831 -15.695 41.279 1.00 52.29 ? 51 TYR A CA 1 ATOM 379 C C . TYR A 1 51 ? 13.629 -16.129 42.472 1.00 52.90 ? 51 TYR A C 1 ATOM 380 O O . TYR A 1 51 ? 14.112 -17.245 42.541 1.00 53.07 ? 51 TYR A O 1 ATOM 381 C CB . TYR A 1 51 ? 11.345 -15.985 41.502 1.00 51.76 ? 51 TYR A CB 1 ATOM 382 C CG . TYR A 1 51 ? 10.421 -15.396 40.445 1.00 51.11 ? 51 TYR A CG 1 ATOM 383 C CD1 . TYR A 1 51 ? 9.715 -16.215 39.589 1.00 51.00 ? 51 TYR A CD1 1 ATOM 384 C CD2 . TYR A 1 51 ? 10.242 -14.037 40.323 1.00 49.56 ? 51 TYR A CD2 1 ATOM 385 C CE1 . TYR A 1 51 ? 8.877 -15.708 38.644 1.00 50.12 ? 51 TYR A CE1 1 ATOM 386 C CE2 . TYR A 1 51 ? 9.390 -13.514 39.368 1.00 47.78 ? 51 TYR A CE2 1 ATOM 387 C CZ . TYR A 1 51 ? 8.713 -14.349 38.522 1.00 50.06 ? 51 TYR A CZ 1 ATOM 388 O OH . TYR A 1 51 ? 7.838 -13.850 37.535 1.00 47.98 ? 51 TYR A OH 1 ATOM 389 N N . GLU A 1 52 ? 13.744 -15.211 43.413 1.00 54.05 ? 52 GLU A N 1 ATOM 390 C CA . GLU A 1 52 ? 14.422 -15.402 44.673 1.00 55.48 ? 52 GLU A CA 1 ATOM 391 C C . GLU A 1 52 ? 13.919 -16.652 45.395 1.00 55.63 ? 52 GLU A C 1 ATOM 392 O O . GLU A 1 52 ? 14.701 -17.445 45.945 1.00 57.21 ? 52 GLU A O 1 ATOM 393 C CB . GLU A 1 52 ? 14.096 -14.190 45.535 1.00 55.27 ? 52 GLU A CB 1 ATOM 394 C CG . GLU A 1 52 ? 15.094 -13.866 46.627 1.00 57.34 ? 52 GLU A CG 1 ATOM 395 C CD . GLU A 1 52 ? 14.620 -12.710 47.490 1.00 54.87 ? 52 GLU A CD 1 ATOM 396 O OE1 . GLU A 1 52 ? 13.633 -12.871 48.211 1.00 60.30 ? 52 GLU A OE1 1 ATOM 397 O OE2 . GLU A 1 52 ? 15.208 -11.641 47.436 1.00 55.03 ? 52 GLU A OE2 1 ATOM 398 N N . ASP A 1 53 ? 12.606 -16.794 45.435 1.00 54.91 ? 53 ASP A N 1 ATOM 399 C CA . ASP A 1 53 ? 11.989 -17.906 46.137 1.00 55.51 ? 53 ASP A CA 1 ATOM 400 C C . ASP A 1 53 ? 11.613 -19.011 45.164 1.00 55.66 ? 53 ASP A C 1 ATOM 401 O O . ASP A 1 53 ? 10.857 -19.898 45.494 1.00 56.67 ? 53 ASP A O 1 ATOM 402 C CB . ASP A 1 53 ? 10.750 -17.451 46.931 1.00 55.05 ? 53 ASP A CB 1 ATOM 403 C CG . ASP A 1 53 ? 9.654 -16.825 46.042 1.00 53.18 ? 53 ASP A CG 1 ATOM 404 O OD1 . ASP A 1 53 ? 9.908 -16.600 44.840 1.00 50.47 ? 53 ASP A OD1 1 ATOM 405 O OD2 . ASP A 1 53 ? 8.529 -16.486 46.483 1.00 50.76 ? 53 ASP A OD2 1 ATOM 406 N N . GLY A 1 54 ? 12.150 -18.954 43.963 1.00 55.51 ? 54 GLY A N 1 ATOM 407 C CA . GLY A 1 54 ? 11.787 -19.924 42.953 1.00 55.63 ? 54 GLY A CA 1 ATOM 408 C C . GLY A 1 54 ? 10.406 -19.778 42.355 1.00 55.44 ? 54 GLY A C 1 ATOM 409 O O . GLY A 1 54 ? 10.097 -20.490 41.418 1.00 56.91 ? 54 GLY A O 1 ATOM 410 N N . LEU A 1 55 ? 9.574 -18.855 42.833 1.00 55.52 ? 55 LEU A N 1 ATOM 411 C CA . LEU A 1 55 ? 8.189 -18.772 42.329 1.00 54.34 ? 55 LEU A CA 1 ATOM 412 C C . LEU A 1 55 ? 7.669 -17.407 41.940 1.00 54.09 ? 55 LEU A C 1 ATOM 413 O O . LEU A 1 55 ? 6.988 -17.281 40.920 1.00 54.37 ? 55 LEU A O 1 ATOM 414 C CB . LEU A 1 55 ? 7.201 -19.349 43.354 1.00 55.37 ? 55 LEU A CB 1 ATOM 415 C CG . LEU A 1 55 ? 7.564 -20.608 44.185 1.00 55.38 ? 55 LEU A CG 1 ATOM 416 C CD1 . LEU A 1 55 ? 7.044 -20.464 45.617 1.00 56.19 ? 55 LEU A CD1 1 ATOM 417 C CD2 . LEU A 1 55 ? 7.029 -21.876 43.575 1.00 53.60 ? 55 LEU A CD2 1 ATOM 418 N N . ALA A 1 56 ? 7.915 -16.389 42.763 1.00 53.69 ? 56 ALA A N 1 ATOM 419 C CA . ALA A 1 56 ? 7.361 -15.065 42.495 1.00 53.40 ? 56 ALA A CA 1 ATOM 420 C C . ALA A 1 56 ? 8.126 -13.871 43.075 1.00 53.25 ? 56 ALA A C 1 ATOM 421 O O . ALA A 1 56 ? 7.929 -12.752 42.642 1.00 53.64 ? 56 ALA A O 1 ATOM 422 C CB . ALA A 1 56 ? 5.886 -15.002 42.958 1.00 52.80 ? 56 ALA A CB 1 ATOM 423 N N . LEU A 1 57 ? 8.949 -14.085 44.077 1.00 52.98 ? 57 LEU A N 1 ATOM 424 C CA . LEU A 1 57 ? 9.643 -12.971 44.702 1.00 53.37 ? 57 LEU A CA 1 ATOM 425 C C . LEU A 1 57 ? 10.819 -12.554 43.828 1.00 53.21 ? 57 LEU A C 1 ATOM 426 O O . LEU A 1 57 ? 11.655 -13.379 43.453 1.00 53.15 ? 57 LEU A O 1 ATOM 427 C CB . LEU A 1 57 ? 10.137 -13.393 46.080 1.00 53.68 ? 57 LEU A CB 1 ATOM 428 C CG . LEU A 1 57 ? 9.766 -12.453 47.241 1.00 55.59 ? 57 LEU A CG 1 ATOM 429 C CD1 . LEU A 1 57 ? 8.311 -11.931 47.092 1.00 54.99 ? 57 LEU A CD1 1 ATOM 430 C CD2 . LEU A 1 57 ? 9.990 -13.171 48.574 1.00 52.93 ? 57 LEU A CD2 1 ATOM 431 N N . PRO A 1 58 ? 10.865 -11.298 43.432 1.00 52.85 ? 58 PRO A N 1 ATOM 432 C CA . PRO A 1 58 ? 11.951 -10.855 42.545 1.00 52.60 ? 58 PRO A CA 1 ATOM 433 C C . PRO A 1 58 ? 13.345 -10.853 43.234 1.00 52.10 ? 58 PRO A C 1 ATOM 434 O O . PRO A 1 58 ? 13.447 -10.620 44.412 1.00 50.48 ? 58 PRO A O 1 ATOM 435 C CB . PRO A 1 58 ? 11.500 -9.454 42.108 1.00 52.11 ? 58 PRO A CB 1 ATOM 436 C CG . PRO A 1 58 ? 10.598 -8.989 43.253 1.00 53.81 ? 58 PRO A CG 1 ATOM 437 C CD . PRO A 1 58 ? 9.859 -10.251 43.679 1.00 52.98 ? 58 PRO A CD 1 ATOM 438 N N . PHE A 1 59 ? 14.420 -11.122 42.498 1.00 52.63 ? 59 PHE A N 1 ATOM 439 C CA . PHE A 1 59 ? 15.744 -11.030 43.121 1.00 52.69 ? 59 PHE A CA 1 ATOM 440 C C . PHE A 1 59 ? 15.959 -9.603 43.552 1.00 53.32 ? 59 PHE A C 1 ATOM 441 O O . PHE A 1 59 ? 15.686 -8.683 42.808 1.00 54.58 ? 59 PHE A O 1 ATOM 442 C CB . PHE A 1 59 ? 16.822 -11.430 42.162 1.00 52.30 ? 59 PHE A CB 1 ATOM 443 C CG . PHE A 1 59 ? 17.132 -12.892 42.177 1.00 53.47 ? 59 PHE A CG 1 ATOM 444 C CD1 . PHE A 1 59 ? 16.790 -13.696 41.090 1.00 53.87 ? 59 PHE A CD1 1 ATOM 445 C CD2 . PHE A 1 59 ? 17.802 -13.463 43.246 1.00 53.07 ? 59 PHE A CD2 1 ATOM 446 C CE1 . PHE A 1 59 ? 17.081 -15.076 41.093 1.00 53.81 ? 59 PHE A CE1 1 ATOM 447 C CE2 . PHE A 1 59 ? 18.095 -14.820 43.261 1.00 53.04 ? 59 PHE A CE2 1 ATOM 448 C CZ . PHE A 1 59 ? 17.730 -15.639 42.171 1.00 53.76 ? 59 PHE A CZ 1 ATOM 449 N N . GLY A 1 60 ? 16.431 -9.398 44.758 1.00 53.24 ? 60 GLY A N 1 ATOM 450 C CA . GLY A 1 60 ? 16.598 -8.054 45.209 1.00 54.21 ? 60 GLY A CA 1 ATOM 451 C C . GLY A 1 60 ? 15.478 -7.733 46.176 1.00 54.92 ? 60 GLY A C 1 ATOM 452 O O . GLY A 1 60 ? 15.458 -6.641 46.758 1.00 54.98 ? 60 GLY A O 1 ATOM 453 N N . TRP A 1 61 ? 14.550 -8.675 46.346 1.00 54.41 ? 61 TRP A N 1 ATOM 454 C CA . TRP A 1 61 ? 13.413 -8.454 47.222 1.00 55.16 ? 61 TRP A CA 1 ATOM 455 C C . TRP A 1 61 ? 13.766 -8.600 48.706 1.00 56.15 ? 61 TRP A C 1 ATOM 456 O O . TRP A 1 61 ? 13.368 -7.781 49.504 1.00 55.09 ? 61 TRP A O 1 ATOM 457 C CB . TRP A 1 61 ? 12.285 -9.394 46.874 1.00 54.76 ? 61 TRP A CB 1 ATOM 458 C CG . TRP A 1 61 ? 11.109 -9.281 47.780 1.00 54.24 ? 61 TRP A CG 1 ATOM 459 C CD1 . TRP A 1 61 ? 10.924 -9.920 48.968 1.00 52.83 ? 61 TRP A CD1 1 ATOM 460 C CD2 . TRP A 1 61 ? 9.941 -8.504 47.555 1.00 51.91 ? 61 TRP A CD2 1 ATOM 461 N NE1 . TRP A 1 61 ? 9.703 -9.583 49.489 1.00 50.75 ? 61 TRP A NE1 1 ATOM 462 C CE2 . TRP A 1 61 ? 9.091 -8.696 48.652 1.00 51.35 ? 61 TRP A CE2 1 ATOM 463 C CE3 . TRP A 1 61 ? 9.537 -7.628 46.545 1.00 53.23 ? 61 TRP A CE3 1 ATOM 464 C CZ2 . TRP A 1 61 ? 7.859 -8.056 48.768 1.00 50.47 ? 61 TRP A CZ2 1 ATOM 465 C CZ3 . TRP A 1 61 ? 8.307 -7.008 46.644 1.00 50.76 ? 61 TRP A CZ3 1 ATOM 466 C CH2 . TRP A 1 61 ? 7.482 -7.221 47.759 1.00 50.99 ? 61 TRP A CH2 1 ATOM 467 N N . THR A 1 62 ? 14.488 -9.672 49.042 1.00 57.76 ? 62 THR A N 1 ATOM 468 C CA . THR A 1 62 ? 14.985 -9.916 50.373 1.00 59.76 ? 62 THR A CA 1 ATOM 469 C C . THR A 1 62 ? 16.481 -9.571 50.420 1.00 61.83 ? 62 THR A C 1 ATOM 470 O O . THR A 1 62 ? 17.296 -10.231 49.772 1.00 61.42 ? 62 THR A O 1 ATOM 471 C CB . THR A 1 62 ? 14.827 -11.367 50.716 1.00 59.81 ? 62 THR A CB 1 ATOM 472 O OG1 . THR A 1 62 ? 13.560 -11.856 50.251 1.00 57.69 ? 62 THR A OG1 1 ATOM 473 C CG2 . THR A 1 62 ? 14.799 -11.536 52.227 1.00 61.36 ? 62 THR A CG2 1 ATOM 474 N N . GLN A 1 63 ? 16.849 -8.554 51.192 1.00 64.26 ? 63 GLN A N 1 ATOM 475 C CA . GLN A 1 63 ? 18.263 -8.129 51.235 1.00 67.23 ? 63 GLN A CA 1 ATOM 476 C C . GLN A 1 63 ? 19.231 -9.287 51.524 1.00 66.98 ? 63 GLN A C 1 ATOM 477 O O . GLN A 1 63 ? 20.231 -9.463 50.827 1.00 67.43 ? 63 GLN A O 1 ATOM 478 C CB . GLN A 1 63 ? 18.464 -6.941 52.204 1.00 68.43 ? 63 GLN A CB 1 ATOM 479 C CG . GLN A 1 63 ? 19.167 -5.718 51.536 1.00 74.14 ? 63 GLN A CG 1 ATOM 480 C CD . GLN A 1 63 ? 18.836 -4.353 52.181 1.00 80.17 ? 63 GLN A CD 1 ATOM 481 O OE1 . GLN A 1 63 ? 17.767 -4.171 52.794 1.00 82.79 ? 63 GLN A OE1 1 ATOM 482 N NE2 . GLN A 1 63 ? 19.752 -3.393 52.026 1.00 81.08 ? 63 GLN A NE2 1 ATOM 483 N N . ARG A 1 64 ? 18.908 -10.096 52.526 1.00 67.37 ? 64 ARG A N 1 ATOM 484 C CA . ARG A 1 64 ? 19.722 -11.267 52.890 1.00 67.53 ? 64 ARG A CA 1 ATOM 485 C C . ARG A 1 64 ? 19.855 -12.345 51.799 1.00 67.03 ? 64 ARG A C 1 ATOM 486 O O . ARG A 1 64 ? 20.705 -13.238 51.916 1.00 67.56 ? 64 ARG A O 1 ATOM 487 C CB . ARG A 1 64 ? 19.140 -11.936 54.135 1.00 68.25 ? 64 ARG A CB 1 ATOM 488 C CG . ARG A 1 64 ? 17.903 -12.824 53.834 1.00 70.97 ? 64 ARG A CG 1 ATOM 489 C CD . ARG A 1 64 ? 16.992 -13.170 55.036 1.00 73.81 ? 64 ARG A CD 1 ATOM 490 N NE . ARG A 1 64 ? 15.834 -13.973 54.618 1.00 76.31 ? 64 ARG A NE 1 ATOM 491 C CZ . ARG A 1 64 ? 15.734 -15.306 54.739 1.00 77.12 ? 64 ARG A CZ 1 ATOM 492 N NH1 . ARG A 1 64 ? 16.719 -16.015 55.289 1.00 76.86 ? 64 ARG A NH1 1 ATOM 493 N NH2 . ARG A 1 64 ? 14.640 -15.936 54.311 1.00 75.61 ? 64 ARG A NH2 1 ATOM 494 N N . LYS A 1 65 ? 19.022 -12.295 50.757 1.00 65.22 ? 65 LYS A N 1 ATOM 495 C CA . LYS A 1 65 ? 19.067 -13.336 49.732 1.00 63.73 ? 65 LYS A CA 1 ATOM 496 C C . LYS A 1 65 ? 19.927 -12.925 48.517 1.00 62.16 ? 65 LYS A C 1 ATOM 497 O O . LYS A 1 65 ? 19.668 -11.931 47.859 1.00 60.92 ? 65 LYS A O 1 ATOM 498 C CB . LYS A 1 65 ? 17.659 -13.737 49.261 1.00 64.11 ? 65 LYS A CB 1 ATOM 499 C CG . LYS A 1 65 ? 16.817 -14.550 50.239 1.00 66.87 ? 65 LYS A CG 1 ATOM 500 C CD . LYS A 1 65 ? 17.183 -16.032 50.246 1.00 71.67 ? 65 LYS A CD 1 ATOM 501 C CE . LYS A 1 65 ? 16.352 -16.821 51.268 1.00 74.51 ? 65 LYS A CE 1 ATOM 502 N NZ . LYS A 1 65 ? 16.682 -18.288 51.306 1.00 75.95 ? 65 LYS A NZ 1 ATOM 503 N N . THR A 1 66 ? 20.949 -13.712 48.248 1.00 59.87 ? 66 THR A N 1 ATOM 504 C CA . THR A 1 66 ? 21.833 -13.446 47.158 1.00 59.00 ? 66 THR A CA 1 ATOM 505 C C . THR A 1 66 ? 21.454 -14.210 45.900 1.00 58.94 ? 66 THR A C 1 ATOM 506 O O . THR A 1 66 ? 20.790 -15.259 45.936 1.00 58.25 ? 66 THR A O 1 ATOM 507 C CB . THR A 1 66 ? 23.261 -13.908 47.518 1.00 58.83 ? 66 THR A CB 1 ATOM 508 O OG1 . THR A 1 66 ? 23.343 -15.337 47.360 1.00 56.34 ? 66 THR A OG1 1 ATOM 509 C CG2 . THR A 1 66 ? 23.539 -13.689 48.977 1.00 58.79 ? 66 THR A CG2 1 ATOM 510 N N . ARG A 1 67 ? 21.951 -13.686 44.787 1.00 58.42 ? 67 ARG A N 1 ATOM 511 C CA . ARG A 1 67 ? 21.883 -14.365 43.506 1.00 57.94 ? 67 ARG A CA 1 ATOM 512 C C . ARG A 1 67 ? 23.307 -14.871 43.248 1.00 57.96 ? 67 ARG A C 1 ATOM 513 O O . ARG A 1 67 ? 24.237 -14.072 43.177 1.00 57.96 ? 67 ARG A O 1 ATOM 514 C CB . ARG A 1 67 ? 21.439 -13.392 42.408 1.00 56.93 ? 67 ARG A CB 1 ATOM 515 C CG . ARG A 1 67 ? 21.286 -14.050 41.046 1.00 57.42 ? 67 ARG A CG 1 ATOM 516 C CD . ARG A 1 67 ? 20.827 -13.100 39.928 1.00 55.81 ? 67 ARG A CD 1 ATOM 517 N NE . ARG A 1 67 ? 19.999 -13.827 38.969 1.00 53.70 ? 67 ARG A NE 1 ATOM 518 C CZ . ARG A 1 67 ? 19.028 -13.288 38.269 1.00 50.51 ? 67 ARG A CZ 1 ATOM 519 N NH1 . ARG A 1 67 ? 18.776 -11.985 38.370 1.00 50.35 ? 67 ARG A NH1 1 ATOM 520 N NH2 . ARG A 1 67 ? 18.325 -14.046 37.455 1.00 45.94 ? 67 ARG A NH2 1 ATOM 521 N N . ASN A 1 68 ? 23.484 -16.192 43.151 1.00 57.76 ? 68 ASN A N 1 ATOM 522 C CA . ASN A 1 68 ? 24.794 -16.779 42.862 1.00 57.52 ? 68 ASN A CA 1 ATOM 523 C C . ASN A 1 68 ? 25.926 -16.384 43.825 1.00 57.58 ? 68 ASN A C 1 ATOM 524 O O . ASN A 1 68 ? 27.112 -16.331 43.450 1.00 58.49 ? 68 ASN A O 1 ATOM 525 C CB . ASN A 1 68 ? 25.192 -16.450 41.436 1.00 57.86 ? 68 ASN A CB 1 ATOM 526 C CG . ASN A 1 68 ? 24.260 -17.061 40.421 1.00 58.00 ? 68 ASN A CG 1 ATOM 527 O OD1 . ASN A 1 68 ? 24.051 -18.289 40.417 1.00 58.89 ? 68 ASN A OD1 1 ATOM 528 N ND2 . ASN A 1 68 ? 23.682 -16.218 39.544 1.00 56.35 ? 68 ASN A ND2 1 ATOM 529 N N . GLY A 1 69 ? 25.561 -16.148 45.070 1.00 56.27 ? 69 GLY A N 1 ATOM 530 C CA . GLY A 1 69 ? 26.507 -15.769 46.081 1.00 55.91 ? 69 GLY A CA 1 ATOM 531 C C . GLY A 1 69 ? 26.521 -14.288 46.423 1.00 56.47 ? 69 GLY A C 1 ATOM 532 O O . GLY A 1 69 ? 27.084 -13.936 47.428 1.00 56.14 ? 69 GLY A O 1 ATOM 533 N N . PHE A 1 70 ? 25.872 -13.424 45.634 1.00 57.16 ? 70 PHE A N 1 ATOM 534 C CA . PHE A 1 70 ? 26.050 -11.974 45.813 1.00 57.55 ? 70 PHE A CA 1 ATOM 535 C C . PHE A 1 70 ? 24.770 -11.190 45.848 1.00 57.74 ? 70 PHE A C 1 ATOM 536 O O . PHE A 1 70 ? 23.774 -11.602 45.282 1.00 58.94 ? 70 PHE A O 1 ATOM 537 C CB . PHE A 1 70 ? 26.844 -11.379 44.646 1.00 57.49 ? 70 PHE A CB 1 ATOM 538 C CG . PHE A 1 70 ? 28.188 -11.991 44.425 1.00 57.64 ? 70 PHE A CG 1 ATOM 539 C CD1 . PHE A 1 70 ? 28.328 -13.118 43.658 1.00 57.78 ? 70 PHE A CD1 1 ATOM 540 C CD2 . PHE A 1 70 ? 29.315 -11.415 44.945 1.00 58.50 ? 70 PHE A CD2 1 ATOM 541 C CE1 . PHE A 1 70 ? 29.564 -13.656 43.428 1.00 56.91 ? 70 PHE A CE1 1 ATOM 542 C CE2 . PHE A 1 70 ? 30.547 -11.963 44.722 1.00 58.69 ? 70 PHE A CE2 1 ATOM 543 C CZ . PHE A 1 70 ? 30.665 -13.086 43.972 1.00 57.47 ? 70 PHE A CZ 1 ATOM 544 N N . ARG A 1 71 ? 24.808 -10.037 46.498 1.00 57.62 ? 71 ARG A N 1 ATOM 545 C CA . ARG A 1 71 ? 23.667 -9.142 46.487 1.00 57.37 ? 71 ARG A CA 1 ATOM 546 C C . ARG A 1 71 ? 23.633 -8.573 45.113 1.00 55.33 ? 71 ARG A C 1 ATOM 547 O O . ARG A 1 71 ? 24.674 -8.341 44.510 1.00 54.23 ? 71 ARG A O 1 ATOM 548 C CB . ARG A 1 71 ? 23.861 -7.963 47.436 1.00 58.22 ? 71 ARG A CB 1 ATOM 549 C CG . ARG A 1 71 ? 23.523 -8.206 48.873 1.00 63.36 ? 71 ARG A CG 1 ATOM 550 C CD . ARG A 1 71 ? 24.751 -8.181 49.778 1.00 71.78 ? 71 ARG A CD 1 ATOM 551 N NE . ARG A 1 71 ? 24.590 -7.215 50.850 1.00 77.35 ? 71 ARG A NE 1 ATOM 552 C CZ . ARG A 1 71 ? 23.672 -7.314 51.803 1.00 79.41 ? 71 ARG A CZ 1 ATOM 553 N NH1 . ARG A 1 71 ? 22.848 -8.352 51.813 1.00 78.51 ? 71 ARG A NH1 1 ATOM 554 N NH2 . ARG A 1 71 ? 23.580 -6.371 52.743 1.00 81.27 ? 71 ARG A NH2 1 ATOM 555 N N . VAL A 1 72 ? 22.435 -8.323 44.612 1.00 54.57 ? 72 VAL A N 1 ATOM 556 C CA . VAL A 1 72 ? 22.336 -7.695 43.320 1.00 53.72 ? 72 VAL A CA 1 ATOM 557 C C . VAL A 1 72 ? 22.316 -6.229 43.667 1.00 52.61 ? 72 VAL A C 1 ATOM 558 O O . VAL A 1 72 ? 21.814 -5.871 44.723 1.00 52.29 ? 72 VAL A O 1 ATOM 559 C CB . VAL A 1 72 ? 21.041 -8.075 42.584 1.00 54.79 ? 72 VAL A CB 1 ATOM 560 C CG1 . VAL A 1 72 ? 21.126 -9.513 42.062 1.00 56.53 ? 72 VAL A CG1 1 ATOM 561 C CG2 . VAL A 1 72 ? 19.810 -7.861 43.473 1.00 53.92 ? 72 VAL A CG2 1 ATOM 562 N N . PRO A 1 73 ? 22.832 -5.387 42.774 1.00 51.51 ? 73 PRO A N 1 ATOM 563 C CA . PRO A 1 73 ? 22.880 -3.954 43.019 1.00 50.01 ? 73 PRO A CA 1 ATOM 564 C C . PRO A 1 73 ? 21.476 -3.356 42.900 1.00 49.13 ? 73 PRO A C 1 ATOM 565 O O . PRO A 1 73 ? 20.593 -4.032 42.376 1.00 49.59 ? 73 PRO A O 1 ATOM 566 C CB . PRO A 1 73 ? 23.776 -3.424 41.906 1.00 49.32 ? 73 PRO A CB 1 ATOM 567 C CG . PRO A 1 73 ? 23.994 -4.522 40.929 1.00 51.04 ? 73 PRO A CG 1 ATOM 568 C CD . PRO A 1 73 ? 23.349 -5.756 41.437 1.00 52.10 ? 73 PRO A CD 1 ATOM 569 N N . LEU A 1 74 ? 21.285 -2.154 43.442 1.00 47.37 ? 74 LEU A N 1 ATOM 570 C CA . LEU A 1 74 ? 20.071 -1.401 43.319 1.00 46.86 ? 74 LEU A CA 1 ATOM 571 C C . LEU A 1 74 ? 19.953 -0.928 41.899 1.00 46.62 ? 74 LEU A C 1 ATOM 572 O O . LEU A 1 74 ? 20.922 -0.479 41.288 1.00 47.43 ? 74 LEU A O 1 ATOM 573 C CB . LEU A 1 74 ? 20.091 -0.188 44.254 1.00 46.40 ? 74 LEU A CB 1 ATOM 574 C CG . LEU A 1 74 ? 20.044 -0.476 45.761 1.00 47.63 ? 74 LEU A CG 1 ATOM 575 C CD1 . LEU A 1 74 ? 20.480 0.766 46.572 1.00 46.65 ? 74 LEU A CD1 1 ATOM 576 C CD2 . LEU A 1 74 ? 18.663 -0.981 46.215 1.00 45.07 ? 74 LEU A CD2 1 ATOM 577 N N . ALA A 1 75 ? 18.755 -1.007 41.369 1.00 46.24 ? 75 ALA A N 1 ATOM 578 C CA . ALA A 1 75 ? 18.551 -0.645 40.004 1.00 46.40 ? 75 ALA A CA 1 ATOM 579 C C . ALA A 1 75 ? 18.944 0.816 39.715 1.00 47.14 ? 75 ALA A C 1 ATOM 580 O O . ALA A 1 75 ? 19.504 1.101 38.655 1.00 46.42 ? 75 ALA A O 1 ATOM 581 C CB . ALA A 1 75 ? 17.126 -0.894 39.632 1.00 46.40 ? 75 ALA A CB 1 ATOM 582 N N . ARG A 1 76 ? 18.624 1.733 40.629 1.00 45.91 ? 76 ARG A N 1 ATOM 583 C CA . ARG A 1 76 ? 18.956 3.124 40.398 1.00 47.23 ? 76 ARG A CA 1 ATOM 584 C C . ARG A 1 76 ? 20.481 3.338 40.520 1.00 48.24 ? 76 ARG A C 1 ATOM 585 O O . ARG A 1 76 ? 21.040 4.241 39.897 1.00 48.14 ? 76 ARG A O 1 ATOM 586 C CB . ARG A 1 76 ? 18.122 4.055 41.284 1.00 46.56 ? 76 ARG A CB 1 ATOM 587 C CG . ARG A 1 76 ? 18.561 5.503 41.325 1.00 47.89 ? 76 ARG A CG 1 ATOM 588 C CD . ARG A 1 76 ? 18.135 6.338 40.123 1.00 52.27 ? 76 ARG A CD 1 ATOM 589 N NE . ARG A 1 76 ? 18.559 7.732 40.222 1.00 50.45 ? 76 ARG A NE 1 ATOM 590 C CZ . ARG A 1 76 ? 18.477 8.593 39.221 1.00 51.60 ? 76 ARG A CZ 1 ATOM 591 N NH1 . ARG A 1 76 ? 18.032 8.190 38.043 1.00 51.77 ? 76 ARG A NH1 1 ATOM 592 N NH2 . ARG A 1 76 ? 18.853 9.851 39.370 1.00 48.47 ? 76 ARG A NH2 1 ATOM 593 N N . GLU A 1 77 ? 21.147 2.475 41.276 1.00 49.33 ? 77 GLU A N 1 ATOM 594 C CA . GLU A 1 77 ? 22.606 2.565 41.402 1.00 51.86 ? 77 GLU A CA 1 ATOM 595 C C . GLU A 1 77 ? 23.272 2.066 40.111 1.00 51.25 ? 77 GLU A C 1 ATOM 596 O O . GLU A 1 77 ? 24.288 2.593 39.720 1.00 51.94 ? 77 GLU A O 1 ATOM 597 C CB . GLU A 1 77 ? 23.139 1.874 42.682 1.00 52.72 ? 77 GLU A CB 1 ATOM 598 C CG . GLU A 1 77 ? 24.680 1.781 42.792 1.00 58.35 ? 77 GLU A CG 1 ATOM 599 C CD . GLU A 1 77 ? 25.207 1.603 44.229 1.00 63.10 ? 77 GLU A CD 1 ATOM 600 O OE1 . GLU A 1 77 ? 24.708 0.765 45.031 1.00 66.19 ? 77 GLU A OE1 1 ATOM 601 O OE2 . GLU A 1 77 ? 26.141 2.333 44.576 1.00 67.00 ? 77 GLU A OE2 1 ATOM 602 N N . VAL A 1 78 ? 22.651 1.118 39.399 1.00 51.10 ? 78 VAL A N 1 ATOM 603 C CA . VAL A 1 78 ? 23.238 0.669 38.146 1.00 49.64 ? 78 VAL A CA 1 ATOM 604 C C . VAL A 1 78 ? 23.062 1.820 37.198 1.00 49.74 ? 78 VAL A C 1 ATOM 605 O O . VAL A 1 78 ? 23.998 2.254 36.510 1.00 49.72 ? 78 VAL A O 1 ATOM 606 C CB . VAL A 1 78 ? 22.559 -0.570 37.581 1.00 49.20 ? 78 VAL A CB 1 ATOM 607 C CG1 . VAL A 1 78 ? 23.223 -0.956 36.286 1.00 47.64 ? 78 VAL A CG1 1 ATOM 608 C CG2 . VAL A 1 78 ? 22.639 -1.718 38.565 1.00 49.64 ? 78 VAL A CG2 1 ATOM 609 N N . SER A 1 79 ? 21.847 2.351 37.213 1.00 49.02 ? 79 SER A N 1 ATOM 610 C CA . SER A 1 79 ? 21.522 3.487 36.339 1.00 48.35 ? 79 SER A CA 1 ATOM 611 C C . SER A 1 79 ? 22.527 4.649 36.451 1.00 48.26 ? 79 SER A C 1 ATOM 612 O O . SER A 1 79 ? 23.045 5.106 35.434 1.00 48.03 ? 79 SER A O 1 ATOM 613 C CB . SER A 1 79 ? 20.109 3.978 36.645 1.00 48.66 ? 79 SER A CB 1 ATOM 614 O OG . SER A 1 79 ? 19.776 5.100 35.857 1.00 44.94 ? 79 SER A OG 1 ATOM 615 N N . ASN A 1 80 ? 22.798 5.193 37.667 1.00 47.73 ? 80 ASN A N 1 ATOM 616 C CA . ASN A 1 80 ? 23.711 6.342 37.838 1.00 49.23 ? 80 ASN A CA 1 ATOM 617 C C . ASN A 1 80 ? 25.101 5.993 37.440 1.00 49.10 ? 80 ASN A C 1 ATOM 618 O O . ASN A 1 80 ? 25.733 6.653 36.620 1.00 50.35 ? 80 ASN A O 1 ATOM 619 C CB . ASN A 1 80 ? 23.758 6.801 39.281 1.00 47.85 ? 80 ASN A CB 1 ATOM 620 C CG . ASN A 1 80 ? 22.403 7.224 39.786 1.00 48.94 ? 80 ASN A CG 1 ATOM 621 O OD1 . ASN A 1 80 ? 21.623 7.863 39.083 1.00 55.27 ? 80 ASN A OD1 1 ATOM 622 N ND2 . ASN A 1 80 ? 22.113 6.861 41.045 1.00 49.83 ? 80 ASN A ND2 1 ATOM 623 N N . LYS A 1 81 ? 25.554 4.920 37.984 1.00 50.06 ? 81 LYS A N 1 ATOM 624 C CA . LYS A 1 81 ? 26.889 4.591 37.653 1.00 51.58 ? 81 LYS A CA 1 ATOM 625 C C . LYS A 1 81 ? 27.086 4.110 36.206 1.00 51.79 ? 81 LYS A C 1 ATOM 626 O O . LYS A 1 81 ? 28.230 4.191 35.737 1.00 51.46 ? 81 LYS A O 1 ATOM 627 C CB . LYS A 1 81 ? 27.416 3.554 38.633 1.00 52.15 ? 81 LYS A CB 1 ATOM 628 C CG . LYS A 1 81 ? 27.397 4.097 40.068 1.00 55.07 ? 81 LYS A CG 1 ATOM 629 C CD . LYS A 1 81 ? 27.784 3.015 41.065 1.00 60.67 ? 81 LYS A CD 1 ATOM 630 C CE . LYS A 1 81 ? 28.891 3.502 41.988 1.00 63.17 ? 81 LYS A CE 1 ATOM 631 N NZ . LYS A 1 81 ? 28.615 3.146 43.409 1.00 62.95 ? 81 LYS A NZ 1 ATOM 632 N N . ILE A 1 82 ? 26.104 3.612 35.485 1.00 51.45 ? 82 ILE A N 1 ATOM 633 C CA . ILE A 1 82 ? 26.519 3.140 34.183 1.00 51.30 ? 82 ILE A CA 1 ATOM 634 C C . ILE A 1 82 ? 25.712 3.740 33.074 1.00 50.46 ? 82 ILE A C 1 ATOM 635 O O . ILE A 1 82 ? 26.254 4.047 32.007 1.00 49.95 ? 82 ILE A O 1 ATOM 636 C CB . ILE A 1 82 ? 26.305 1.602 34.093 1.00 52.70 ? 82 ILE A CB 1 ATOM 637 C CG1 . ILE A 1 82 ? 27.404 0.848 34.852 1.00 55.94 ? 82 ILE A CG1 1 ATOM 638 C CG2 . ILE A 1 82 ? 26.271 1.154 32.628 1.00 53.26 ? 82 ILE A CG2 1 ATOM 639 C CD1 . ILE A 1 82 ? 27.554 -0.598 34.433 1.00 62.89 ? 82 ILE A CD1 1 ATOM 640 N N . VAL A 1 83 ? 24.406 3.932 33.327 1.00 48.34 ? 83 VAL A N 1 ATOM 641 C CA . VAL A 1 83 ? 23.527 4.330 32.242 1.00 47.05 ? 83 VAL A CA 1 ATOM 642 C C . VAL A 1 83 ? 23.576 5.809 31.929 1.00 47.18 ? 83 VAL A C 1 ATOM 643 O O . VAL A 1 83 ? 23.400 6.186 30.807 1.00 46.83 ? 83 VAL A O 1 ATOM 644 C CB . VAL A 1 83 ? 21.999 3.851 32.423 1.00 46.68 ? 83 VAL A CB 1 ATOM 645 C CG1 . VAL A 1 83 ? 21.211 4.095 31.166 1.00 44.03 ? 83 VAL A CG1 1 ATOM 646 C CG2 . VAL A 1 83 ? 21.898 2.392 32.767 1.00 45.63 ? 83 VAL A CG2 1 ATOM 647 N N . GLY A 1 84 ? 23.802 6.643 32.925 1.00 47.84 ? 84 GLY A N 1 ATOM 648 C CA . GLY A 1 84 ? 23.731 8.076 32.745 1.00 49.13 ? 84 GLY A CA 1 ATOM 649 C C . GLY A 1 84 ? 24.888 8.826 32.121 1.00 50.76 ? 84 GLY A C 1 ATOM 650 O O . GLY A 1 84 ? 26.030 8.346 32.100 1.00 51.37 ? 84 GLY A O 1 ATOM 651 N N . TYR A 1 85 ? 24.600 10.023 31.628 1.00 51.18 ? 85 TYR A N 1 ATOM 652 C CA . TYR A 1 85 ? 25.659 10.847 31.038 1.00 52.44 ? 85 TYR A CA 1 ATOM 653 C C . TYR A 1 85 ? 25.276 12.315 30.944 1.00 53.20 ? 85 TYR A C 1 ATOM 654 O O . TYR A 1 85 ? 24.102 12.653 30.828 1.00 52.67 ? 85 TYR A O 1 ATOM 655 C CB . TYR A 1 85 ? 26.026 10.345 29.632 1.00 50.99 ? 85 TYR A CB 1 ATOM 656 C CG . TYR A 1 85 ? 24.970 10.584 28.593 1.00 47.54 ? 85 TYR A CG 1 ATOM 657 C CD1 . TYR A 1 85 ? 25.045 11.681 27.739 1.00 44.43 ? 85 TYR A CD1 1 ATOM 658 C CD2 . TYR A 1 85 ? 23.892 9.709 28.451 1.00 44.78 ? 85 TYR A CD2 1 ATOM 659 C CE1 . TYR A 1 85 ? 24.096 11.898 26.778 1.00 40.10 ? 85 TYR A CE1 1 ATOM 660 C CE2 . TYR A 1 85 ? 22.943 9.911 27.489 1.00 38.70 ? 85 TYR A CE2 1 ATOM 661 C CZ . TYR A 1 85 ? 23.039 10.981 26.660 1.00 41.24 ? 85 TYR A CZ 1 ATOM 662 O OH . TYR A 1 85 ? 22.068 11.167 25.703 1.00 39.50 ? 85 TYR A OH 1 ATOM 663 N N . LEU A 1 86 ? 26.283 13.183 30.902 1.00 54.55 ? 86 LEU A N 1 ATOM 664 C CA . LEU A 1 86 ? 26.002 14.619 30.903 1.00 55.37 ? 86 LEU A CA 1 ATOM 665 C C . LEU A 1 86 ? 25.887 15.243 29.537 1.00 54.92 ? 86 LEU A C 1 ATOM 666 O O . LEU A 1 86 ? 24.948 15.978 29.202 1.00 54.62 ? 86 LEU A O 1 ATOM 667 C CB . LEU A 1 86 ? 27.087 15.349 31.689 1.00 55.21 ? 86 LEU A CB 1 ATOM 668 C CG . LEU A 1 86 ? 27.007 15.082 33.186 1.00 57.84 ? 86 LEU A CG 1 ATOM 669 C CD1 . LEU A 1 86 ? 27.442 16.303 34.048 1.00 58.68 ? 86 LEU A CD1 1 ATOM 670 C CD2 . LEU A 1 86 ? 25.564 14.679 33.539 1.00 60.87 ? 86 LEU A CD2 1 ATOM 671 N N . ASP A 1 87 ? 26.875 14.931 28.736 1.00 56.18 ? 87 ASP A N 1 ATOM 672 C CA . ASP A 1 87 ? 27.082 15.625 27.471 1.00 56.40 ? 87 ASP A CA 1 ATOM 673 C C . ASP A 1 87 ? 26.357 15.037 26.288 1.00 55.77 ? 87 ASP A C 1 ATOM 674 O O . ASP A 1 87 ? 26.738 13.992 25.764 1.00 56.58 ? 87 ASP A O 1 ATOM 675 C CB . ASP A 1 87 ? 28.584 15.631 27.209 1.00 56.10 ? 87 ASP A CB 1 ATOM 676 C CG . ASP A 1 87 ? 28.982 16.639 26.196 1.00 58.55 ? 87 ASP A CG 1 ATOM 677 O OD1 . ASP A 1 87 ? 28.134 17.063 25.375 1.00 60.12 ? 87 ASP A OD1 1 ATOM 678 O OD2 . ASP A 1 87 ? 30.153 17.066 26.156 1.00 63.92 ? 87 ASP A OD2 1 ATOM 679 N N . GLU A 1 88 ? 25.361 15.755 25.808 1.00 55.80 ? 88 GLU A N 1 ATOM 680 C CA . GLU A 1 88 ? 24.571 15.293 24.675 1.00 54.93 ? 88 GLU A CA 1 ATOM 681 C C . GLU A 1 88 ? 25.277 15.596 23.355 1.00 55.15 ? 88 GLU A C 1 ATOM 682 O O . GLU A 1 88 ? 24.741 15.342 22.269 1.00 54.78 ? 88 GLU A O 1 ATOM 683 C CB . GLU A 1 88 ? 23.196 15.978 24.680 1.00 55.01 ? 88 GLU A CB 1 ATOM 684 C CG . GLU A 1 88 ? 22.256 15.609 25.829 1.00 53.63 ? 88 GLU A CG 1 ATOM 685 C CD . GLU A 1 88 ? 21.824 14.142 25.791 1.00 54.57 ? 88 GLU A CD 1 ATOM 686 O OE1 . GLU A 1 88 ? 21.890 13.519 24.675 1.00 52.92 ? 88 GLU A OE1 1 ATOM 687 O OE2 . GLU A 1 88 ? 21.454 13.617 26.870 1.00 45.12 ? 88 GLU A OE2 1 ATOM 688 N N . GLU A 1 89 ? 26.476 16.159 23.425 1.00 55.29 ? 89 GLU A N 1 ATOM 689 C CA . GLU A 1 89 ? 27.167 16.472 22.181 1.00 54.74 ? 89 GLU A CA 1 ATOM 690 C C . GLU A 1 89 ? 27.739 15.179 21.687 1.00 52.49 ? 89 GLU A C 1 ATOM 691 O O . GLU A 1 89 ? 28.014 14.323 22.475 1.00 51.36 ? 89 GLU A O 1 ATOM 692 C CB . GLU A 1 89 ? 28.273 17.515 22.389 1.00 55.42 ? 89 GLU A CB 1 ATOM 693 C CG . GLU A 1 89 ? 28.789 18.130 21.075 1.00 59.72 ? 89 GLU A CG 1 ATOM 694 C CD . GLU A 1 89 ? 30.315 18.119 21.001 1.00 66.94 ? 89 GLU A CD 1 ATOM 695 O OE1 . GLU A 1 89 ? 30.909 17.083 21.412 1.00 67.77 ? 89 GLU A OE1 1 ATOM 696 O OE2 . GLU A 1 89 ? 30.923 19.144 20.549 1.00 69.63 ? 89 GLU A OE2 1 ATOM 697 N N . GLY A 1 90 ? 27.875 15.018 20.387 1.00 52.25 ? 90 GLY A N 1 ATOM 698 C CA . GLY A 1 90 ? 28.486 13.802 19.851 1.00 52.50 ? 90 GLY A CA 1 ATOM 699 C C . GLY A 1 90 ? 27.693 12.503 20.032 1.00 52.59 ? 90 GLY A C 1 ATOM 700 O O . GLY A 1 90 ? 28.215 11.403 19.788 1.00 52.23 ? 90 GLY A O 1 ATOM 701 N N . VAL A 1 91 ? 26.403 12.647 20.375 1.00 51.56 ? 91 VAL A N 1 ATOM 702 C CA . VAL A 1 91 ? 25.581 11.519 20.758 1.00 50.42 ? 91 VAL A CA 1 ATOM 703 C C . VAL A 1 91 ? 24.681 11.004 19.650 1.00 49.31 ? 91 VAL A C 1 ATOM 704 O O . VAL A 1 91 ? 24.252 9.888 19.696 1.00 48.93 ? 91 VAL A O 1 ATOM 705 C CB . VAL A 1 91 ? 24.773 11.851 22.052 1.00 50.49 ? 91 VAL A CB 1 ATOM 706 C CG1 . VAL A 1 91 ? 23.309 12.123 21.753 1.00 47.89 ? 91 VAL A CG1 1 ATOM 707 C CG2 . VAL A 1 91 ? 24.842 10.689 22.973 1.00 52.63 ? 91 VAL A CG2 1 ATOM 708 N N . LEU A 1 92 ? 24.462 11.811 18.622 1.00 49.56 ? 92 LEU A N 1 ATOM 709 C CA . LEU A 1 92 ? 23.519 11.495 17.563 1.00 48.80 ? 92 LEU A CA 1 ATOM 710 C C . LEU A 1 92 ? 23.964 10.459 16.522 1.00 49.74 ? 92 LEU A C 1 ATOM 711 O O . LEU A 1 92 ? 25.160 10.236 16.309 1.00 49.67 ? 92 LEU A O 1 ATOM 712 C CB . LEU A 1 92 ? 23.069 12.786 16.882 1.00 48.52 ? 92 LEU A CB 1 ATOM 713 C CG . LEU A 1 92 ? 22.072 13.695 17.575 1.00 49.07 ? 92 LEU A CG 1 ATOM 714 C CD1 . LEU A 1 92 ? 21.623 14.752 16.566 1.00 52.28 ? 92 LEU A CD1 1 ATOM 715 C CD2 . LEU A 1 92 ? 20.836 12.944 18.223 1.00 48.64 ? 92 LEU A CD2 1 ATOM 716 N N . ASP A 1 93 ? 22.976 9.828 15.880 1.00 50.40 ? 93 ASP A N 1 ATOM 717 C CA . ASP A 1 93 ? 23.212 8.765 14.915 1.00 50.75 ? 93 ASP A CA 1 ATOM 718 C C . ASP A 1 93 ? 23.301 9.335 13.501 1.00 50.78 ? 93 ASP A C 1 ATOM 719 O O . ASP A 1 93 ? 22.281 9.681 12.871 1.00 49.80 ? 93 ASP A O 1 ATOM 720 C CB . ASP A 1 93 ? 22.082 7.729 14.983 1.00 50.78 ? 93 ASP A CB 1 ATOM 721 C CG . ASP A 1 93 ? 22.453 6.392 14.312 1.00 52.97 ? 93 ASP A CG 1 ATOM 722 O OD1 . ASP A 1 93 ? 23.295 6.377 13.382 1.00 51.91 ? 93 ASP A OD1 1 ATOM 723 O OD2 . ASP A 1 93 ? 21.952 5.285 14.666 1.00 57.40 ? 93 ASP A OD2 1 ATOM 724 N N . GLN A 1 94 ? 24.521 9.422 12.995 1.00 51.58 ? 94 GLN A N 1 ATOM 725 C CA . GLN A 1 94 ? 24.728 9.945 11.637 1.00 52.79 ? 94 GLN A CA 1 ATOM 726 C C . GLN A 1 94 ? 23.971 9.166 10.588 1.00 52.71 ? 94 GLN A C 1 ATOM 727 O O . GLN A 1 94 ? 23.571 9.749 9.562 1.00 54.21 ? 94 GLN A O 1 ATOM 728 C CB . GLN A 1 94 ? 26.229 10.012 11.303 1.00 53.46 ? 94 GLN A CB 1 ATOM 729 C CG . GLN A 1 94 ? 27.013 10.586 12.466 1.00 53.10 ? 94 GLN A CG 1 ATOM 730 C CD . GLN A 1 94 ? 26.322 11.819 13.047 1.00 56.55 ? 94 GLN A CD 1 ATOM 731 O OE1 . GLN A 1 94 ? 25.824 12.694 12.278 1.00 51.41 ? 94 GLN A OE1 1 ATOM 732 N NE2 . GLN A 1 94 ? 26.274 11.902 14.421 1.00 55.66 ? 94 GLN A NE2 1 ATOM 733 N N . ASN A 1 95 ? 23.703 7.882 10.835 1.00 52.19 ? 95 ASN A N 1 ATOM 734 C CA . ASN A 1 95 ? 22.943 7.115 9.835 1.00 52.87 ? 95 ASN A CA 1 ATOM 735 C C . ASN A 1 95 ? 21.523 6.642 10.178 1.00 52.15 ? 95 ASN A C 1 ATOM 736 O O . ASN A 1 95 ? 21.039 5.669 9.571 1.00 50.80 ? 95 ASN A O 1 ATOM 737 C CB . ASN A 1 95 ? 23.770 5.970 9.212 1.00 53.75 ? 95 ASN A CB 1 ATOM 738 C CG . ASN A 1 95 ? 23.499 5.812 7.706 1.00 59.34 ? 95 ASN A CG 1 ATOM 739 O OD1 . ASN A 1 95 ? 22.559 6.412 7.161 1.00 60.27 ? 95 ASN A OD1 1 ATOM 740 N ND2 . ASN A 1 95 ? 24.339 5.030 7.028 1.00 67.57 ? 95 ASN A ND2 1 ATOM 741 N N . ARG A 1 96 ? 20.843 7.320 11.115 1.00 51.14 ? 96 ARG A N 1 ATOM 742 C CA . ARG A 1 96 ? 19.463 6.945 11.428 1.00 50.21 ? 96 ARG A CA 1 ATOM 743 C C . ARG A 1 96 ? 18.494 8.097 11.736 1.00 50.04 ? 96 ARG A C 1 ATOM 744 O O . ARG A 1 96 ? 18.670 8.831 12.738 1.00 48.56 ? 96 ARG A O 1 ATOM 745 C CB . ARG A 1 96 ? 19.457 6.003 12.620 1.00 51.70 ? 96 ARG A CB 1 ATOM 746 C CG . ARG A 1 96 ? 20.090 4.682 12.364 1.00 52.02 ? 96 ARG A CG 1 ATOM 747 C CD . ARG A 1 96 ? 19.349 3.850 11.404 1.00 52.04 ? 96 ARG A CD 1 ATOM 748 N NE . ARG A 1 96 ? 20.038 2.572 11.306 1.00 55.99 ? 96 ARG A NE 1 ATOM 749 C CZ . ARG A 1 96 ? 20.862 2.207 10.303 1.00 55.81 ? 96 ARG A CZ 1 ATOM 750 N NH1 . ARG A 1 96 ? 21.058 3.001 9.254 1.00 53.03 ? 96 ARG A NH1 1 ATOM 751 N NH2 . ARG A 1 96 ? 21.452 1.017 10.355 1.00 52.85 ? 96 ARG A NH2 1 ATOM 752 N N . SER A 1 97 ? 17.421 8.195 10.941 1.00 49.39 ? 97 SER A N 1 ATOM 753 C CA . SER A 1 97 ? 16.405 9.188 11.197 1.00 50.17 ? 97 SER A CA 1 ATOM 754 C C . SER A 1 97 ? 15.808 8.924 12.567 1.00 50.44 ? 97 SER A C 1 ATOM 755 O O . SER A 1 97 ? 16.043 7.878 13.177 1.00 50.38 ? 97 SER A O 1 ATOM 756 C CB . SER A 1 97 ? 15.296 9.172 10.146 1.00 50.83 ? 97 SER A CB 1 ATOM 757 O OG . SER A 1 97 ? 14.360 8.120 10.336 1.00 52.48 ? 97 SER A OG 1 ATOM 758 N N . LEU A 1 98 ? 15.038 9.894 13.037 1.00 50.27 ? 98 LEU A N 1 ATOM 759 C CA . LEU A 1 98 ? 14.393 9.820 14.320 1.00 49.84 ? 98 LEU A CA 1 ATOM 760 C C . LEU A 1 98 ? 13.191 8.910 14.133 1.00 49.46 ? 98 LEU A C 1 ATOM 761 O O . LEU A 1 98 ? 12.609 8.378 15.104 1.00 48.81 ? 98 LEU A O 1 ATOM 762 C CB . LEU A 1 98 ? 13.922 11.206 14.745 1.00 49.16 ? 98 LEU A CB 1 ATOM 763 C CG . LEU A 1 98 ? 13.952 11.536 16.255 1.00 48.50 ? 98 LEU A CG 1 ATOM 764 C CD1 . LEU A 1 98 ? 12.714 12.239 16.667 1.00 39.32 ? 98 LEU A CD1 1 ATOM 765 C CD2 . LEU A 1 98 ? 14.195 10.356 17.133 1.00 44.67 ? 98 LEU A CD2 1 ATOM 766 N N . LEU A 1 99 ? 12.809 8.725 12.883 1.00 48.86 ? 99 LEU A N 1 ATOM 767 C CA . LEU A 1 99 ? 11.653 7.881 12.659 1.00 49.42 ? 99 LEU A CA 1 ATOM 768 C C . LEU A 1 99 ? 12.028 6.462 12.941 1.00 49.15 ? 99 LEU A C 1 ATOM 769 O O . LEU A 1 99 ? 11.131 5.639 13.057 1.00 50.04 ? 99 LEU A O 1 ATOM 770 C CB . LEU A 1 99 ? 11.138 7.960 11.237 1.00 50.37 ? 99 LEU A CB 1 ATOM 771 C CG . LEU A 1 99 ? 9.800 7.289 10.960 1.00 52.70 ? 99 LEU A CG 1 ATOM 772 C CD1 . LEU A 1 99 ? 8.798 7.595 12.060 1.00 55.21 ? 99 LEU A CD1 1 ATOM 773 C CD2 . LEU A 1 99 ? 9.286 7.763 9.619 1.00 56.51 ? 99 LEU A CD2 1 ATOM 774 N N . PHE A 1 100 ? 13.342 6.200 13.073 1.00 48.24 ? 100 PHE A N 1 ATOM 775 C CA . PHE A 1 100 ? 13.884 4.875 13.321 1.00 47.22 ? 100 PHE A CA 1 ATOM 776 C C . PHE A 1 100 ? 13.580 4.477 14.735 1.00 46.69 ? 100 PHE A C 1 ATOM 777 O O . PHE A 1 100 ? 13.054 3.397 14.964 1.00 47.20 ? 100 PHE A O 1 ATOM 778 C CB . PHE A 1 100 ? 15.383 4.823 13.005 1.00 48.15 ? 100 PHE A CB 1 ATOM 779 C CG . PHE A 1 100 ? 16.115 3.588 13.524 1.00 47.13 ? 100 PHE A CG 1 ATOM 780 C CD1 . PHE A 1 100 ? 15.915 2.343 12.958 1.00 49.89 ? 100 PHE A CD1 1 ATOM 781 C CD2 . PHE A 1 100 ? 17.072 3.718 14.509 1.00 46.90 ? 100 PHE A CD2 1 ATOM 782 C CE1 . PHE A 1 100 ? 16.630 1.228 13.403 1.00 47.38 ? 100 PHE A CE1 1 ATOM 783 C CE2 . PHE A 1 100 ? 17.782 2.645 14.976 1.00 49.49 ? 100 PHE A CE2 1 ATOM 784 C CZ . PHE A 1 100 ? 17.543 1.372 14.424 1.00 52.05 ? 100 PHE A CZ 1 ATOM 785 N N . MET A 1 101 ? 13.906 5.326 15.690 1.00 45.35 ? 101 MET A N 1 ATOM 786 C CA . MET A 1 101 ? 13.461 5.073 17.072 1.00 44.36 ? 101 MET A CA 1 ATOM 787 C C . MET A 1 101 ? 11.908 5.007 17.134 1.00 44.03 ? 101 MET A C 1 ATOM 788 O O . MET A 1 101 ? 11.347 4.117 17.735 1.00 44.34 ? 101 MET A O 1 ATOM 789 C CB . MET A 1 101 ? 14.027 6.152 18.010 1.00 43.60 ? 101 MET A CB 1 ATOM 790 C CG . MET A 1 101 ? 13.566 6.148 19.441 1.00 42.87 ? 101 MET A CG 1 ATOM 791 S SD . MET A 1 101 ? 11.905 6.913 19.696 1.00 46.43 ? 101 MET A SD 1 ATOM 792 C CE . MET A 1 101 ? 12.084 8.670 19.259 1.00 33.12 ? 101 MET A CE 1 ATOM 793 N N . GLN A 1 102 ? 11.212 5.875 16.426 1.00 43.78 ? 102 GLN A N 1 ATOM 794 C CA . GLN A 1 102 ? 9.750 5.945 16.565 1.00 43.63 ? 102 GLN A CA 1 ATOM 795 C C . GLN A 1 102 ? 9.040 4.686 16.068 1.00 44.25 ? 102 GLN A C 1 ATOM 796 O O . GLN A 1 102 ? 8.143 4.197 16.701 1.00 45.20 ? 102 GLN A O 1 ATOM 797 C CB . GLN A 1 102 ? 9.203 7.228 15.907 1.00 42.88 ? 102 GLN A CB 1 ATOM 798 C CG . GLN A 1 102 ? 7.813 7.528 16.291 1.00 43.82 ? 102 GLN A CG 1 ATOM 799 C CD . GLN A 1 102 ? 7.607 7.415 17.780 1.00 48.41 ? 102 GLN A CD 1 ATOM 800 O OE1 . GLN A 1 102 ? 8.119 8.265 18.593 1.00 47.26 ? 102 GLN A OE1 1 ATOM 801 N NE2 . GLN A 1 102 ? 6.906 6.340 18.178 1.00 46.87 ? 102 GLN A NE2 1 ATOM 802 N N . TRP A 1 103 ? 9.463 4.168 14.914 1.00 44.16 ? 103 TRP A N 1 ATOM 803 C CA . TRP A 1 103 ? 9.000 2.921 14.440 1.00 42.59 ? 103 TRP A CA 1 ATOM 804 C C . TRP A 1 103 ? 9.164 1.796 15.488 1.00 43.62 ? 103 TRP A C 1 ATOM 805 O O . TRP A 1 103 ? 8.237 1.043 15.718 1.00 44.64 ? 103 TRP A O 1 ATOM 806 C CB . TRP A 1 103 ? 9.709 2.568 13.119 1.00 42.70 ? 103 TRP A CB 1 ATOM 807 C CG . TRP A 1 103 ? 8.954 1.523 12.483 1.00 40.09 ? 103 TRP A CG 1 ATOM 808 C CD1 . TRP A 1 103 ? 9.310 0.225 12.366 1.00 38.62 ? 103 TRP A CD1 1 ATOM 809 C CD2 . TRP A 1 103 ? 7.609 1.633 11.998 1.00 42.15 ? 103 TRP A CD2 1 ATOM 810 N NE1 . TRP A 1 103 ? 8.285 -0.480 11.778 1.00 44.81 ? 103 TRP A NE1 1 ATOM 811 C CE2 . TRP A 1 103 ? 7.219 0.365 11.568 1.00 41.62 ? 103 TRP A CE2 1 ATOM 812 C CE3 . TRP A 1 103 ? 6.687 2.698 11.868 1.00 46.29 ? 103 TRP A CE3 1 ATOM 813 C CZ2 . TRP A 1 103 ? 5.959 0.114 11.019 1.00 44.79 ? 103 TRP A CZ2 1 ATOM 814 C CZ3 . TRP A 1 103 ? 5.387 2.433 11.294 1.00 41.41 ? 103 TRP A CZ3 1 ATOM 815 C CH2 . TRP A 1 103 ? 5.068 1.164 10.884 1.00 41.23 ? 103 TRP A CH2 1 ATOM 816 N N . GLY A 1 104 ? 10.338 1.646 16.091 1.00 43.34 ? 104 GLY A N 1 ATOM 817 C CA . GLY A 1 104 ? 10.495 0.641 17.091 1.00 45.06 ? 104 GLY A CA 1 ATOM 818 C C . GLY A 1 104 ? 9.520 0.666 18.279 1.00 45.26 ? 104 GLY A C 1 ATOM 819 O O . GLY A 1 104 ? 9.059 -0.404 18.667 1.00 45.72 ? 104 GLY A O 1 ATOM 820 N N . GLN A 1 105 ? 9.261 1.838 18.877 1.00 45.26 ? 105 GLN A N 1 ATOM 821 C CA . GLN A 1 105 ? 8.251 1.987 19.943 1.00 44.77 ? 105 GLN A CA 1 ATOM 822 C C . GLN A 1 105 ? 6.899 1.524 19.429 1.00 45.55 ? 105 GLN A C 1 ATOM 823 O O . GLN A 1 105 ? 6.161 0.830 20.133 1.00 46.26 ? 105 GLN A O 1 ATOM 824 C CB . GLN A 1 105 ? 8.117 3.436 20.427 1.00 44.21 ? 105 GLN A CB 1 ATOM 825 C CG . GLN A 1 105 ? 7.508 3.569 21.893 1.00 40.67 ? 105 GLN A CG 1 ATOM 826 C CD . GLN A 1 105 ? 7.380 4.997 22.365 1.00 35.10 ? 105 GLN A CD 1 ATOM 827 O OE1 . GLN A 1 105 ? 7.422 5.916 21.578 1.00 42.47 ? 105 GLN A OE1 1 ATOM 828 N NE2 . GLN A 1 105 ? 7.228 5.190 23.654 1.00 36.21 ? 105 GLN A NE2 1 ATOM 829 N N . ILE A 1 106 ? 6.609 1.848 18.174 1.00 45.94 ? 106 ILE A N 1 ATOM 830 C CA . ILE A 1 106 ? 5.316 1.504 17.587 1.00 47.37 ? 106 ILE A CA 1 ATOM 831 C C . ILE A 1 106 ? 5.181 0.004 17.400 1.00 47.19 ? 106 ILE A C 1 ATOM 832 O O . ILE A 1 106 ? 4.125 -0.576 17.698 1.00 47.32 ? 106 ILE A O 1 ATOM 833 C CB . ILE A 1 106 ? 5.136 2.164 16.258 1.00 47.56 ? 106 ILE A CB 1 ATOM 834 C CG1 . ILE A 1 106 ? 4.131 3.281 16.352 1.00 49.60 ? 106 ILE A CG1 1 ATOM 835 C CG2 . ILE A 1 106 ? 4.611 1.171 15.287 1.00 48.82 ? 106 ILE A CG2 1 ATOM 836 C CD1 . ILE A 1 106 ? 4.772 4.504 16.178 1.00 56.26 ? 106 ILE A CD1 1 ATOM 837 N N . VAL A 1 107 ? 6.259 -0.625 16.889 1.00 46.47 ? 107 VAL A N 1 ATOM 838 C CA . VAL A 1 107 ? 6.230 -2.057 16.674 1.00 45.41 ? 107 VAL A CA 1 ATOM 839 C C . VAL A 1 107 ? 6.135 -2.720 18.032 1.00 44.59 ? 107 VAL A C 1 ATOM 840 O O . VAL A 1 107 ? 5.353 -3.664 18.218 1.00 45.61 ? 107 VAL A O 1 ATOM 841 C CB . VAL A 1 107 ? 7.427 -2.546 15.838 1.00 45.31 ? 107 VAL A CB 1 ATOM 842 C CG1 . VAL A 1 107 ? 7.476 -4.061 15.799 1.00 42.01 ? 107 VAL A CG1 1 ATOM 843 C CG2 . VAL A 1 107 ? 7.351 -1.978 14.417 1.00 44.29 ? 107 VAL A CG2 1 ATOM 844 N N . ASP A 1 108 ? 6.902 -2.236 18.946 1.00 44.31 ? 108 ASP A N 1 ATOM 845 C CA . ASP A 1 108 ? 6.810 -2.744 20.289 1.00 44.43 ? 108 ASP A CA 1 ATOM 846 C C . ASP A 1 108 ? 5.393 -2.716 20.801 1.00 44.31 ? 108 ASP A C 1 ATOM 847 O O . ASP A 1 108 ? 4.872 -3.723 21.250 1.00 44.43 ? 108 ASP A O 1 ATOM 848 C CB . ASP A 1 108 ? 7.722 -1.935 21.214 1.00 43.77 ? 108 ASP A CB 1 ATOM 849 C CG . ASP A 1 108 ? 7.819 -2.474 22.624 1.00 45.69 ? 108 ASP A CG 1 ATOM 850 O OD1 . ASP A 1 108 ? 6.771 -2.505 23.317 1.00 50.73 ? 108 ASP A OD1 1 ATOM 851 O OD2 . ASP A 1 108 ? 8.930 -2.871 23.039 1.00 44.71 ? 108 ASP A OD2 1 ATOM 852 N N . HIS A 1 109 ? 4.741 -1.566 20.691 1.00 44.42 ? 109 HIS A N 1 ATOM 853 C CA . HIS A 1 109 ? 3.398 -1.444 21.203 1.00 44.90 ? 109 HIS A CA 1 ATOM 854 C C . HIS A 1 109 ? 2.402 -2.328 20.468 1.00 44.76 ? 109 HIS A C 1 ATOM 855 O O . HIS A 1 109 ? 1.356 -2.652 21.011 1.00 45.40 ? 109 HIS A O 1 ATOM 856 C CB . HIS A 1 109 ? 2.979 0.026 21.264 1.00 43.92 ? 109 HIS A CB 1 ATOM 857 C CG . HIS A 1 109 ? 3.754 0.762 22.388 1.00 44.36 ? 109 HIS A CG 1 ATOM 858 N ND1 . HIS A 1 109 ? 3.651 2.121 22.595 1.00 42.28 ? 109 HIS A ND1 1 ATOM 859 C CD2 . HIS A 1 109 ? 4.637 0.309 23.311 1.00 41.58 ? 109 HIS A CD2 1 ATOM 860 C CE1 . HIS A 1 109 ? 4.417 2.476 23.614 1.00 42.29 ? 109 HIS A CE1 1 ATOM 861 N NE2 . HIS A 1 109 ? 5.041 1.391 24.078 1.00 43.68 ? 109 HIS A NE2 1 ATOM 862 N N . ASP A 1 110 ? 2.706 -2.726 19.241 1.00 44.08 ? 110 ASP A N 1 ATOM 863 C CA . ASP A 1 110 ? 1.819 -3.675 18.565 1.00 43.41 ? 110 ASP A CA 1 ATOM 864 C C . ASP A 1 110 ? 1.949 -5.062 19.193 1.00 42.41 ? 110 ASP A C 1 ATOM 865 O O . ASP A 1 110 ? 1.033 -5.871 19.114 1.00 41.63 ? 110 ASP A O 1 ATOM 866 C CB . ASP A 1 110 ? 2.181 -3.777 17.073 1.00 44.08 ? 110 ASP A CB 1 ATOM 867 C CG . ASP A 1 110 ? 1.028 -4.279 16.200 1.00 44.44 ? 110 ASP A CG 1 ATOM 868 O OD1 . ASP A 1 110 ? 0.622 -5.440 16.284 1.00 49.25 ? 110 ASP A OD1 1 ATOM 869 O OD2 . ASP A 1 110 ? 0.441 -3.578 15.381 1.00 50.35 ? 110 ASP A OD2 1 ATOM 870 N N . LEU A 1 111 ? 3.088 -5.316 19.821 1.00 42.65 ? 111 LEU A N 1 ATOM 871 C CA . LEU A 1 111 ? 3.487 -6.672 20.231 1.00 42.88 ? 111 LEU A CA 1 ATOM 872 C C . LEU A 1 111 ? 3.382 -7.012 21.695 1.00 42.55 ? 111 LEU A C 1 ATOM 873 O O . LEU A 1 111 ? 3.179 -8.164 22.014 1.00 43.86 ? 111 LEU A O 1 ATOM 874 C CB . LEU A 1 111 ? 4.960 -6.932 19.843 1.00 42.44 ? 111 LEU A CB 1 ATOM 875 C CG . LEU A 1 111 ? 5.196 -6.830 18.337 1.00 43.42 ? 111 LEU A CG 1 ATOM 876 C CD1 . LEU A 1 111 ? 6.686 -7.095 17.975 1.00 43.55 ? 111 LEU A CD1 1 ATOM 877 C CD2 . LEU A 1 111 ? 4.300 -7.846 17.644 1.00 38.43 ? 111 LEU A CD2 1 ATOM 878 N N . ASP A 1 112 ? 3.506 -6.042 22.564 1.00 41.50 ? 112 ASP A N 1 ATOM 879 C CA . ASP A 1 112 ? 3.554 -6.439 23.941 1.00 43.16 ? 112 ASP A CA 1 ATOM 880 C C . ASP A 1 112 ? 3.247 -5.290 24.899 1.00 45.22 ? 112 ASP A C 1 ATOM 881 O O . ASP A 1 112 ? 3.444 -4.132 24.554 1.00 44.49 ? 112 ASP A O 1 ATOM 882 C CB . ASP A 1 112 ? 4.949 -7.075 24.177 1.00 43.54 ? 112 ASP A CB 1 ATOM 883 C CG . ASP A 1 112 ? 6.111 -6.353 23.528 1.00 43.83 ? 112 ASP A CG 1 ATOM 884 O OD1 . ASP A 1 112 ? 6.515 -6.743 22.417 1.00 45.37 ? 112 ASP A OD1 1 ATOM 885 O OD2 . ASP A 1 112 ? 6.610 -5.397 24.137 1.00 45.85 ? 112 ASP A OD2 1 ATOM 886 N N . PHE A 1 113 ? 2.758 -5.619 26.078 1.00 46.31 ? 113 PHE A N 1 ATOM 887 C CA . PHE A 1 113 ? 2.347 -4.687 27.117 1.00 47.80 ? 113 PHE A CA 1 ATOM 888 C C . PHE A 1 113 ? 2.043 -5.474 28.407 1.00 48.99 ? 113 PHE A C 1 ATOM 889 O O . PHE A 1 113 ? 1.022 -6.171 28.495 1.00 50.43 ? 113 PHE A O 1 ATOM 890 C CB . PHE A 1 113 ? 1.080 -3.955 26.719 1.00 47.25 ? 113 PHE A CB 1 ATOM 891 C CG . PHE A 1 113 ? 0.712 -2.835 27.664 1.00 49.20 ? 113 PHE A CG 1 ATOM 892 C CD1 . PHE A 1 113 ? 1.691 -2.198 28.415 1.00 48.36 ? 113 PHE A CD1 1 ATOM 893 C CD2 . PHE A 1 113 ? -0.601 -2.427 27.807 1.00 49.57 ? 113 PHE A CD2 1 ATOM 894 C CE1 . PHE A 1 113 ? 1.360 -1.165 29.266 1.00 50.30 ? 113 PHE A CE1 1 ATOM 895 C CE2 . PHE A 1 113 ? -0.943 -1.385 28.664 1.00 51.83 ? 113 PHE A CE2 1 ATOM 896 C CZ . PHE A 1 113 ? 0.040 -0.752 29.394 1.00 51.43 ? 113 PHE A CZ 1 ATOM 897 N N . ALA A 1 114 ? 2.936 -5.382 29.376 1.00 48.59 ? 114 ALA A N 1 ATOM 898 C CA . ALA A 1 114 ? 2.759 -5.995 30.671 1.00 50.02 ? 114 ALA A CA 1 ATOM 899 C C . ALA A 1 114 ? 2.356 -4.938 31.720 1.00 51.16 ? 114 ALA A C 1 ATOM 900 O O . ALA A 1 114 ? 3.187 -4.488 32.529 1.00 50.90 ? 114 ALA A O 1 ATOM 901 C CB . ALA A 1 114 ? 4.011 -6.710 31.113 1.00 47.90 ? 114 ALA A CB 1 ATOM 902 N N . PRO A 1 115 ? 1.078 -4.587 31.707 1.00 52.72 ? 115 PRO A N 1 ATOM 903 C CA . PRO A 1 115 ? 0.492 -3.640 32.662 1.00 55.51 ? 115 PRO A CA 1 ATOM 904 C C . PRO A 1 115 ? 0.790 -4.026 34.103 1.00 57.90 ? 115 PRO A C 1 ATOM 905 O O . PRO A 1 115 ? 0.863 -5.230 34.442 1.00 56.44 ? 115 PRO A O 1 ATOM 906 C CB . PRO A 1 115 ? -1.025 -3.792 32.412 1.00 55.96 ? 115 PRO A CB 1 ATOM 907 C CG . PRO A 1 115 ? -1.090 -4.186 30.949 1.00 53.53 ? 115 PRO A CG 1 ATOM 908 C CD . PRO A 1 115 ? 0.076 -5.137 30.791 1.00 52.06 ? 115 PRO A CD 1 ATOM 909 N N . GLU A 1 116 ? 0.969 -2.989 34.926 1.00 61.86 ? 116 GLU A N 1 ATOM 910 C CA . GLU A 1 116 ? 1.162 -3.148 36.357 1.00 66.13 ? 116 GLU A CA 1 ATOM 911 C C . GLU A 1 116 ? -0.159 -3.703 36.846 1.00 68.16 ? 116 GLU A C 1 ATOM 912 O O . GLU A 1 116 ? -1.187 -3.396 36.246 1.00 67.88 ? 116 GLU A O 1 ATOM 913 C CB . GLU A 1 116 ? 1.386 -1.784 37.035 1.00 66.44 ? 116 GLU A CB 1 ATOM 914 C CG . GLU A 1 116 ? 2.508 -0.912 36.503 1.00 69.37 ? 116 GLU A CG 1 ATOM 915 C CD . GLU A 1 116 ? 2.374 0.539 36.971 1.00 73.63 ? 116 GLU A CD 1 ATOM 916 O OE1 . GLU A 1 116 ? 1.415 0.871 37.710 1.00 71.15 ? 116 GLU A OE1 1 ATOM 917 O OE2 . GLU A 1 116 ? 3.234 1.361 36.602 1.00 77.86 ? 116 GLU A OE2 1 ATOM 918 N N . THR A 1 117 ? -0.148 -4.502 37.918 1.00 71.69 ? 117 THR A N 1 ATOM 919 C CA . THR A 1 117 ? -1.404 -5.044 38.476 1.00 75.52 ? 117 THR A CA 1 ATOM 920 C C . THR A 1 117 ? -2.378 -3.936 38.931 1.00 78.06 ? 117 THR A C 1 ATOM 921 O O . THR A 1 117 ? -1.999 -3.105 39.761 1.00 78.35 ? 117 THR A O 1 ATOM 922 C CB . THR A 1 117 ? -1.149 -6.010 39.705 1.00 75.17 ? 117 THR A CB 1 ATOM 923 O OG1 . THR A 1 117 ? -0.148 -5.472 40.575 1.00 75.74 ? 117 THR A OG1 1 ATOM 924 C CG2 . THR A 1 117 ? -0.536 -7.309 39.286 1.00 75.89 ? 117 THR A CG2 1 ATOM 925 N N . GLU A 1 118 ? -3.599 -3.880 38.390 1.00 81.16 ? 118 GLU A N 1 ATOM 926 C CA . GLU A 1 118 ? -4.560 -2.983 39.021 1.00 85.06 ? 118 GLU A CA 1 ATOM 927 C C . GLU A 1 118 ? -5.181 -3.748 40.177 1.00 87.00 ? 118 GLU A C 1 ATOM 928 O O . GLU A 1 118 ? -6.027 -4.631 39.978 1.00 87.54 ? 118 GLU A O 1 ATOM 929 C CB . GLU A 1 118 ? -5.702 -2.467 38.143 1.00 85.41 ? 118 GLU A CB 1 ATOM 930 C CG . GLU A 1 118 ? -6.724 -1.719 39.017 1.00 87.45 ? 118 GLU A CG 1 ATOM 931 C CD . GLU A 1 118 ? -7.951 -1.177 38.286 1.00 91.06 ? 118 GLU A CD 1 ATOM 932 O OE1 . GLU A 1 118 ? -7.935 0.024 37.914 1.00 92.64 ? 118 GLU A OE1 1 ATOM 933 O OE2 . GLU A 1 118 ? -8.954 -1.924 38.116 1.00 91.34 ? 118 GLU A OE2 1 ATOM 934 N N . LEU A 1 119 ? -4.740 -3.425 41.380 1.00 88.96 ? 119 LEU A N 1 ATOM 935 C CA . LEU A 1 119 ? -5.301 -4.029 42.573 1.00 91.23 ? 119 LEU A CA 1 ATOM 936 C C . LEU A 1 119 ? -5.361 -2.889 43.588 1.00 92.30 ? 119 LEU A C 1 ATOM 937 O O . LEU A 1 119 ? -4.621 -2.879 44.575 1.00 92.38 ? 119 LEU A O 1 ATOM 938 C CB . LEU A 1 119 ? -4.427 -5.186 43.060 1.00 91.36 ? 119 LEU A CB 1 ATOM 939 C CG . LEU A 1 119 ? -5.122 -6.351 43.777 1.00 92.73 ? 119 LEU A CG 1 ATOM 940 C CD1 . LEU A 1 119 ? -4.216 -7.589 43.775 1.00 93.41 ? 119 LEU A CD1 1 ATOM 941 C CD2 . LEU A 1 119 ? -5.544 -5.978 45.209 1.00 94.13 ? 119 LEU A CD2 1 ATOM 942 N N . GLY A 1 120 ? -6.218 -1.909 43.295 1.00 93.37 ? 120 GLY A N 1 ATOM 943 C CA . GLY A 1 120 ? -6.404 -0.754 44.153 1.00 94.63 ? 120 GLY A CA 1 ATOM 944 C C . GLY A 1 120 ? -6.597 0.588 43.457 1.00 95.44 ? 120 GLY A C 1 ATOM 945 O O . GLY A 1 120 ? -5.623 1.292 43.166 1.00 95.78 ? 120 GLY A O 1 ATOM 946 N N . SER A 1 121 ? -7.849 0.945 43.170 1.00 96.11 ? 121 SER A N 1 ATOM 947 C CA . SER A 1 121 ? -8.152 2.275 42.626 1.00 96.61 ? 121 SER A CA 1 ATOM 948 C C . SER A 1 121 ? -8.950 3.029 43.690 1.00 97.19 ? 121 SER A C 1 ATOM 949 O O . SER A 1 121 ? -9.150 4.249 43.614 1.00 97.27 ? 121 SER A O 1 ATOM 950 C CB . SER A 1 121 ? -8.910 2.205 41.300 1.00 96.55 ? 121 SER A CB 1 ATOM 951 O OG . SER A 1 121 ? -8.900 3.475 40.663 1.00 95.32 ? 121 SER A OG 1 ATOM 952 N N . ASN A 1 122 ? -9.414 2.257 44.672 1.00 97.75 ? 122 ASN A N 1 ATOM 953 C CA . ASN A 1 122 ? -10.045 2.772 45.880 1.00 98.13 ? 122 ASN A CA 1 ATOM 954 C C . ASN A 1 122 ? -9.217 2.163 47.029 1.00 98.49 ? 122 ASN A C 1 ATOM 955 O O . ASN A 1 122 ? -9.713 1.378 47.859 1.00 98.26 ? 122 ASN A O 1 ATOM 956 C CB . ASN A 1 122 ? -11.534 2.391 45.956 1.00 98.12 ? 122 ASN A CB 1 ATOM 957 C CG . ASN A 1 122 ? -12.443 3.597 46.285 1.00 97.82 ? 122 ASN A CG 1 ATOM 958 O OD1 . ASN A 1 122 ? -12.478 4.080 47.426 1.00 96.09 ? 122 ASN A OD1 1 ATOM 959 N ND2 . ASN A 1 122 ? -13.177 4.084 45.275 1.00 96.67 ? 122 ASN A ND2 1 ATOM 960 N N . GLU A 1 123 ? -7.933 2.532 47.030 1.00 98.68 ? 123 GLU A N 1 ATOM 961 C CA . GLU A 1 123 ? -6.950 2.034 47.980 1.00 98.94 ? 123 GLU A CA 1 ATOM 962 C C . GLU A 1 123 ? -5.857 3.079 48.218 1.00 99.21 ? 123 GLU A C 1 ATOM 963 O O . GLU A 1 123 ? -5.284 3.609 47.269 1.00 99.35 ? 123 GLU A O 1 ATOM 964 C CB . GLU A 1 123 ? -6.323 0.749 47.429 1.00 98.90 ? 123 GLU A CB 1 ATOM 965 C CG . GLU A 1 123 ? -5.576 -0.089 48.457 1.00 98.76 ? 123 GLU A CG 1 ATOM 966 C CD . GLU A 1 123 ? -6.476 -0.646 49.547 1.00 97.51 ? 123 GLU A CD 1 ATOM 967 O OE1 . GLU A 1 123 ? -7.630 -1.019 49.245 1.00 95.21 ? 123 GLU A OE1 1 ATOM 968 O OE2 . GLU A 1 123 ? -6.018 -0.715 50.710 1.00 98.67 ? 123 GLU A OE2 1 ATOM 969 N N . HIS A 1 124 ? -5.560 3.374 49.483 1.00 99.38 ? 124 HIS A N 1 ATOM 970 C CA . HIS A 1 124 ? -4.507 4.345 49.790 1.00 99.26 ? 124 HIS A CA 1 ATOM 971 C C . HIS A 1 124 ? -3.116 3.706 49.708 1.00 98.74 ? 124 HIS A C 1 ATOM 972 O O . HIS A 1 124 ? -2.100 4.365 49.916 1.00 98.71 ? 124 HIS A O 1 ATOM 973 C CB . HIS A 1 124 ? -4.725 4.981 51.163 1.00 99.56 ? 124 HIS A CB 1 ATOM 974 C CG . HIS A 1 124 ? -4.185 6.373 51.269 1.00 100.20 ? 124 HIS A CG 1 ATOM 975 N ND1 . HIS A 1 124 ? -4.877 7.475 50.815 1.00 100.98 ? 124 HIS A ND1 1 ATOM 976 C CD2 . HIS A 1 124 ? -3.017 6.843 51.770 1.00 101.40 ? 124 HIS A CD2 1 ATOM 977 C CE1 . HIS A 1 124 ? -4.162 8.565 51.035 1.00 101.58 ? 124 HIS A CE1 1 ATOM 978 N NE2 . HIS A 1 124 ? -3.029 8.209 51.615 1.00 101.83 ? 124 HIS A NE2 1 ATOM 979 N N . SER A 1 125 ? -3.087 2.410 49.421 1.00 98.16 ? 125 SER A N 1 ATOM 980 C CA . SER A 1 125 ? -1.838 1.688 49.244 1.00 97.58 ? 125 SER A CA 1 ATOM 981 C C . SER A 1 125 ? -1.435 1.901 47.800 1.00 97.12 ? 125 SER A C 1 ATOM 982 O O . SER A 1 125 ? -0.362 1.497 47.357 1.00 96.90 ? 125 SER A O 1 ATOM 983 C CB . SER A 1 125 ? -2.025 0.207 49.539 1.00 97.61 ? 125 SER A CB 1 ATOM 984 O OG . SER A 1 125 ? -2.508 0.037 50.859 1.00 97.72 ? 125 SER A OG 1 ATOM 985 N N . LYS A 1 126 ? -2.343 2.543 47.079 1.00 96.40 ? 126 LYS A N 1 ATOM 986 C CA . LYS A 1 126 ? -2.132 2.953 45.709 1.00 95.77 ? 126 LYS A CA 1 ATOM 987 C C . LYS A 1 126 ? -1.242 4.195 45.766 1.00 95.00 ? 126 LYS A C 1 ATOM 988 O O . LYS A 1 126 ? -0.467 4.466 44.849 1.00 95.04 ? 126 LYS A O 1 ATOM 989 C CB . LYS A 1 126 ? -3.497 3.283 45.086 1.00 96.24 ? 126 LYS A CB 1 ATOM 990 C CG . LYS A 1 126 ? -3.496 4.086 43.784 1.00 97.10 ? 126 LYS A CG 1 ATOM 991 C CD . LYS A 1 126 ? -4.923 4.551 43.428 1.00 97.30 ? 126 LYS A CD 1 ATOM 992 C CE . LYS A 1 126 ? -5.500 5.487 44.490 1.00 97.71 ? 126 LYS A CE 1 ATOM 993 N NZ . LYS A 1 126 ? -6.800 6.101 44.078 1.00 97.79 ? 126 LYS A NZ 1 ATOM 994 N N . THR A 1 127 ? -1.346 4.943 46.862 1.00 93.93 ? 127 THR A N 1 ATOM 995 C CA . THR A 1 127 ? -0.511 6.122 47.047 1.00 92.33 ? 127 THR A CA 1 ATOM 996 C C . THR A 1 127 ? 0.439 5.906 48.220 1.00 91.13 ? 127 THR A C 1 ATOM 997 O O . THR A 1 127 ? 1.378 6.670 48.419 1.00 91.09 ? 127 THR A O 1 ATOM 998 C CB . THR A 1 127 ? -1.373 7.384 47.229 1.00 92.57 ? 127 THR A CB 1 ATOM 999 O OG1 . THR A 1 127 ? -0.794 8.469 46.493 1.00 92.19 ? 127 THR A OG1 1 ATOM 1000 C CG2 . THR A 1 127 ? -1.349 7.864 48.683 1.00 92.85 ? 127 THR A CG2 1 ATOM 1001 N N . GLN A 1 128 ? 0.207 4.840 48.975 1.00 89.56 ? 128 GLN A N 1 ATOM 1002 C CA . GLN A 1 128 ? 1.068 4.495 50.096 1.00 88.36 ? 128 GLN A CA 1 ATOM 1003 C C . GLN A 1 128 ? 2.448 4.058 49.595 1.00 87.05 ? 128 GLN A C 1 ATOM 1004 O O . GLN A 1 128 ? 3.469 4.299 50.245 1.00 87.00 ? 128 GLN A O 1 ATOM 1005 C CB . GLN A 1 128 ? 0.424 3.381 50.933 1.00 88.74 ? 128 GLN A CB 1 ATOM 1006 C CG . GLN A 1 128 ? 1.289 2.852 52.080 1.00 90.57 ? 128 GLN A CG 1 ATOM 1007 C CD . GLN A 1 128 ? 0.946 1.421 52.493 1.00 93.42 ? 128 GLN A CD 1 ATOM 1008 O OE1 . GLN A 1 128 ? -0.076 1.175 53.147 1.00 94.37 ? 128 GLN A OE1 1 ATOM 1009 N NE2 . GLN A 1 128 ? 1.808 0.479 52.125 1.00 94.97 ? 128 GLN A NE2 1 ATOM 1010 N N . CYS A 1 129 ? 2.487 3.416 48.431 1.00 85.29 ? 129 CYS A N 1 ATOM 1011 C CA . CYS A 1 129 ? 3.762 2.983 47.861 1.00 83.17 ? 129 CYS A CA 1 ATOM 1012 C C . CYS A 1 129 ? 4.660 4.176 47.592 1.00 83.49 ? 129 CYS A C 1 ATOM 1013 O O . CYS A 1 129 ? 5.869 4.129 47.837 1.00 83.18 ? 129 CYS A O 1 ATOM 1014 C CB . CYS A 1 129 ? 3.554 2.207 46.557 1.00 82.36 ? 129 CYS A CB 1 ATOM 1015 S SG . CYS A 1 129 ? 5.040 1.370 45.939 1.00 75.07 ? 129 CYS A SG 1 ATOM 1016 N N . GLU A 1 130 ? 4.052 5.249 47.095 1.00 83.44 ? 130 GLU A N 1 ATOM 1017 C CA . GLU A 1 130 ? 4.783 6.464 46.777 1.00 83.81 ? 130 GLU A CA 1 ATOM 1018 C C . GLU A 1 130 ? 5.156 7.257 48.032 1.00 83.64 ? 130 GLU A C 1 ATOM 1019 O O . GLU A 1 130 ? 6.322 7.627 48.211 1.00 83.17 ? 130 GLU A O 1 ATOM 1020 C CB . GLU A 1 130 ? 3.960 7.330 45.803 1.00 84.56 ? 130 GLU A CB 1 ATOM 1021 C CG . GLU A 1 130 ? 4.527 8.706 45.465 1.00 85.65 ? 130 GLU A CG 1 ATOM 1022 C CD . GLU A 1 130 ? 3.483 9.602 44.809 1.00 88.88 ? 130 GLU A CD 1 ATOM 1023 O OE1 . GLU A 1 130 ? 2.603 9.055 44.101 1.00 90.27 ? 130 GLU A OE1 1 ATOM 1024 O OE2 . GLU A 1 130 ? 3.536 10.847 44.996 1.00 89.12 ? 130 GLU A OE2 1 ATOM 1025 N N . GLU A 1 131 ? 4.170 7.495 48.905 1.00 83.38 ? 131 GLU A N 1 ATOM 1026 C CA . GLU A 1 131 ? 4.371 8.348 50.085 1.00 82.72 ? 131 GLU A CA 1 ATOM 1027 C C . GLU A 1 131 ? 5.334 7.791 51.134 1.00 81.42 ? 131 GLU A C 1 ATOM 1028 O O . GLU A 1 131 ? 6.053 8.545 51.780 1.00 81.52 ? 131 GLU A O 1 ATOM 1029 C CB . GLU A 1 131 ? 3.031 8.719 50.757 1.00 83.22 ? 131 GLU A CB 1 ATOM 1030 C CG . GLU A 1 131 ? 1.963 9.359 49.870 1.00 85.66 ? 131 GLU A CG 1 ATOM 1031 C CD . GLU A 1 131 ? 2.230 10.818 49.483 1.00 90.41 ? 131 GLU A CD 1 ATOM 1032 O OE1 . GLU A 1 131 ? 1.254 11.523 49.106 1.00 92.17 ? 131 GLU A OE1 1 ATOM 1033 O OE2 . GLU A 1 131 ? 3.401 11.272 49.529 1.00 91.46 ? 131 GLU A OE2 1 ATOM 1034 N N . TYR A 1 132 ? 5.362 6.479 51.310 1.00 79.89 ? 132 TYR A N 1 ATOM 1035 C CA . TYR A 1 132 ? 6.208 5.931 52.369 1.00 78.78 ? 132 TYR A CA 1 ATOM 1036 C C . TYR A 1 132 ? 7.307 4.945 51.961 1.00 76.99 ? 132 TYR A C 1 ATOM 1037 O O . TYR A 1 132 ? 8.129 4.584 52.788 1.00 76.90 ? 132 TYR A O 1 ATOM 1038 C CB . TYR A 1 132 ? 5.332 5.349 53.476 1.00 79.38 ? 132 TYR A CB 1 ATOM 1039 C CG . TYR A 1 132 ? 4.181 6.259 53.850 1.00 81.36 ? 132 TYR A CG 1 ATOM 1040 C CD1 . TYR A 1 132 ? 2.881 5.972 53.462 1.00 83.03 ? 132 TYR A CD1 1 ATOM 1041 C CD2 . TYR A 1 132 ? 4.397 7.411 54.587 1.00 83.55 ? 132 TYR A CD2 1 ATOM 1042 C CE1 . TYR A 1 132 ? 1.830 6.813 53.796 1.00 83.89 ? 132 TYR A CE1 1 ATOM 1043 C CE2 . TYR A 1 132 ? 3.352 8.247 54.933 1.00 84.62 ? 132 TYR A CE2 1 ATOM 1044 C CZ . TYR A 1 132 ? 2.073 7.948 54.534 1.00 84.44 ? 132 TYR A CZ 1 ATOM 1045 O OH . TYR A 1 132 ? 1.031 8.790 54.889 1.00 86.17 ? 132 TYR A OH 1 ATOM 1046 N N . CYS A 1 133 ? 7.312 4.505 50.701 1.00 75.36 ? 133 CYS A N 1 ATOM 1047 C CA . CYS A 1 133 ? 8.358 3.609 50.178 1.00 73.35 ? 133 CYS A CA 1 ATOM 1048 C C . CYS A 1 133 ? 8.432 2.254 50.885 1.00 72.87 ? 133 CYS A C 1 ATOM 1049 O O . CYS A 1 133 ? 9.527 1.710 51.069 1.00 72.77 ? 133 CYS A O 1 ATOM 1050 C CB . CYS A 1 133 ? 9.736 4.318 50.207 1.00 72.53 ? 133 CYS A CB 1 ATOM 1051 S SG . CYS A 1 133 ? 9.844 5.801 49.128 1.00 70.70 ? 133 CYS A SG 1 ATOM 1052 N N . ILE A 1 134 ? 7.280 1.700 51.272 1.00 71.97 ? 134 ILE A N 1 ATOM 1053 C CA . ILE A 1 134 ? 7.287 0.430 52.004 1.00 71.51 ? 134 ILE A CA 1 ATOM 1054 C C . ILE A 1 134 ? 7.114 -0.753 51.096 1.00 70.50 ? 134 ILE A C 1 ATOM 1055 O O . ILE A 1 134 ? 6.033 -0.970 50.577 1.00 71.39 ? 134 ILE A O 1 ATOM 1056 C CB . ILE A 1 134 ? 6.181 0.371 53.076 1.00 71.61 ? 134 ILE A CB 1 ATOM 1057 C CG1 . ILE A 1 134 ? 6.050 1.701 53.823 1.00 71.76 ? 134 ILE A CG1 1 ATOM 1058 C CG2 . ILE A 1 134 ? 6.468 -0.753 54.046 1.00 72.43 ? 134 ILE A CG2 1 ATOM 1059 C CD1 . ILE A 1 134 ? 7.175 1.980 54.767 1.00 73.87 ? 134 ILE A CD1 1 ATOM 1060 N N . GLN A 1 135 ? 8.180 -1.522 50.912 1.00 69.39 ? 135 GLN A N 1 ATOM 1061 C CA . GLN A 1 135 ? 8.120 -2.729 50.091 1.00 67.91 ? 135 GLN A CA 1 ATOM 1062 C C . GLN A 1 135 ? 7.024 -3.625 50.636 1.00 68.21 ? 135 GLN A C 1 ATOM 1063 O O . GLN A 1 135 ? 7.030 -4.097 51.794 1.00 68.21 ? 135 GLN A O 1 ATOM 1064 C CB . GLN A 1 135 ? 9.459 -3.418 49.982 1.00 67.07 ? 135 GLN A CB 1 ATOM 1065 C CG . GLN A 1 135 ? 9.431 -4.652 49.125 1.00 62.81 ? 135 GLN A CG 1 ATOM 1066 C CD . GLN A 1 135 ? 10.828 -5.172 48.885 1.00 59.99 ? 135 GLN A CD 1 ATOM 1067 O OE1 . GLN A 1 135 ? 11.613 -4.562 48.125 1.00 57.19 ? 135 GLN A OE1 1 ATOM 1068 N NE2 . GLN A 1 135 ? 11.169 -6.269 49.555 1.00 55.91 ? 135 GLN A NE2 1 ATOM 1069 N N . GLY A 1 136 ? 6.155 -3.933 49.701 1.00 67.91 ? 136 GLY A N 1 ATOM 1070 C CA . GLY A 1 136 ? 4.770 -4.027 50.099 1.00 69.04 ? 136 GLY A CA 1 ATOM 1071 C C . GLY A 1 136 ? 3.824 -4.619 49.095 1.00 68.78 ? 136 GLY A C 1 ATOM 1072 O O . GLY A 1 136 ? 2.880 -4.001 48.580 1.00 68.89 ? 136 GLY A O 1 ATOM 1073 N N . ASP A 1 137 ? 4.066 -5.897 48.902 1.00 68.84 ? 137 ASP A N 1 ATOM 1074 C CA . ASP A 1 137 ? 3.304 -6.682 47.979 1.00 69.11 ? 137 ASP A CA 1 ATOM 1075 C C . ASP A 1 137 ? 3.523 -6.189 46.558 1.00 68.31 ? 137 ASP A C 1 ATOM 1076 O O . ASP A 1 137 ? 4.658 -6.109 46.084 1.00 68.85 ? 137 ASP A O 1 ATOM 1077 C CB . ASP A 1 137 ? 1.822 -6.654 48.336 1.00 69.86 ? 137 ASP A CB 1 ATOM 1078 C CG . ASP A 1 137 ? 1.314 -8.009 48.759 1.00 73.96 ? 137 ASP A CG 1 ATOM 1079 O OD1 . ASP A 1 137 ? 0.881 -8.783 47.864 1.00 78.44 ? 137 ASP A OD1 1 ATOM 1080 O OD2 . ASP A 1 137 ? 1.329 -8.414 49.948 1.00 74.30 ? 137 ASP A OD2 1 ATOM 1081 N N . ASN A 1 138 ? 2.437 -5.897 45.867 1.00 66.48 ? 138 ASN A N 1 ATOM 1082 C CA . ASN A 1 138 ? 2.549 -5.322 44.554 1.00 65.67 ? 138 ASN A CA 1 ATOM 1083 C C . ASN A 1 138 ? 3.322 -4.004 44.557 1.00 64.07 ? 138 ASN A C 1 ATOM 1084 O O . ASN A 1 138 ? 3.289 -3.280 43.606 1.00 65.12 ? 138 ASN A O 1 ATOM 1085 C CB . ASN A 1 138 ? 1.170 -5.150 43.930 1.00 66.12 ? 138 ASN A CB 1 ATOM 1086 C CG . ASN A 1 138 ? 0.580 -6.479 43.455 1.00 66.76 ? 138 ASN A CG 1 ATOM 1087 O OD1 . ASN A 1 138 ? 1.316 -7.404 43.087 1.00 66.86 ? 138 ASN A OD1 1 ATOM 1088 N ND2 . ASN A 1 138 ? -0.746 -6.574 43.449 1.00 66.97 ? 138 ASN A ND2 1 ATOM 1089 N N . CYS A 1 139 ? 4.016 -3.702 45.634 1.00 62.03 ? 139 CYS A N 1 ATOM 1090 C CA . CYS A 1 139 ? 4.810 -2.483 45.724 1.00 61.13 ? 139 CYS A CA 1 ATOM 1091 C C . CYS A 1 139 ? 6.303 -2.856 45.896 1.00 58.09 ? 139 CYS A C 1 ATOM 1092 O O . CYS A 1 139 ? 6.683 -3.509 46.850 1.00 56.84 ? 139 CYS A O 1 ATOM 1093 C CB . CYS A 1 139 ? 4.287 -1.598 46.865 1.00 62.46 ? 139 CYS A CB 1 ATOM 1094 S SG . CYS A 1 139 ? 5.292 -0.143 47.273 1.00 69.90 ? 139 CYS A SG 1 ATOM 1095 N N . PHE A 1 140 ? 7.135 -2.461 44.939 1.00 55.78 ? 140 PHE A N 1 ATOM 1096 C CA . PHE A 1 140 ? 8.534 -2.910 44.880 1.00 53.45 ? 140 PHE A CA 1 ATOM 1097 C C . PHE A 1 140 ? 9.383 -1.682 44.523 1.00 52.91 ? 140 PHE A C 1 ATOM 1098 O O . PHE A 1 140 ? 9.933 -1.577 43.416 1.00 51.21 ? 140 PHE A O 1 ATOM 1099 C CB . PHE A 1 140 ? 8.614 -3.993 43.807 1.00 53.36 ? 140 PHE A CB 1 ATOM 1100 C CG . PHE A 1 140 ? 9.981 -4.636 43.629 1.00 50.78 ? 140 PHE A CG 1 ATOM 1101 C CD1 . PHE A 1 140 ? 10.846 -4.785 44.681 1.00 50.58 ? 140 PHE A CD1 1 ATOM 1102 C CD2 . PHE A 1 140 ? 10.364 -5.119 42.373 1.00 49.61 ? 140 PHE A CD2 1 ATOM 1103 C CE1 . PHE A 1 140 ? 12.087 -5.387 44.491 1.00 53.48 ? 140 PHE A CE1 1 ATOM 1104 C CE2 . PHE A 1 140 ? 11.613 -5.711 42.162 1.00 47.70 ? 140 PHE A CE2 1 ATOM 1105 C CZ . PHE A 1 140 ? 12.461 -5.854 43.207 1.00 51.29 ? 140 PHE A CZ 1 ATOM 1106 N N . PRO A 1 141 ? 9.443 -0.743 45.474 1.00 52.60 ? 141 PRO A N 1 ATOM 1107 C CA . PRO A 1 141 ? 10.024 0.580 45.243 1.00 52.35 ? 141 PRO A CA 1 ATOM 1108 C C . PRO A 1 141 ? 11.502 0.543 44.888 1.00 51.91 ? 141 PRO A C 1 ATOM 1109 O O . PRO A 1 141 ? 12.282 -0.272 45.382 1.00 49.89 ? 141 PRO A O 1 ATOM 1110 C CB . PRO A 1 141 ? 9.837 1.288 46.579 1.00 53.77 ? 141 PRO A CB 1 ATOM 1111 C CG . PRO A 1 141 ? 8.849 0.476 47.360 1.00 53.61 ? 141 PRO A CG 1 ATOM 1112 C CD . PRO A 1 141 ? 8.959 -0.912 46.854 1.00 52.21 ? 141 PRO A CD 1 ATOM 1113 N N . ILE A 1 142 ? 11.872 1.421 43.970 1.00 52.23 ? 142 ILE A N 1 ATOM 1114 C CA . ILE A 1 142 ? 13.258 1.543 43.587 1.00 52.70 ? 142 ILE A CA 1 ATOM 1115 C C . ILE A 1 142 ? 13.839 2.489 44.615 1.00 53.36 ? 142 ILE A C 1 ATOM 1116 O O . ILE A 1 142 ? 13.450 3.634 44.717 1.00 54.34 ? 142 ILE A O 1 ATOM 1117 C CB . ILE A 1 142 ? 13.313 2.104 42.215 1.00 52.28 ? 142 ILE A CB 1 ATOM 1118 C CG1 . ILE A 1 142 ? 12.811 1.049 41.269 1.00 52.14 ? 142 ILE A CG1 1 ATOM 1119 C CG2 . ILE A 1 142 ? 14.730 2.545 41.864 1.00 53.67 ? 142 ILE A CG2 1 ATOM 1120 C CD1 . ILE A 1 142 ? 12.401 1.631 39.927 1.00 55.37 ? 142 ILE A CD1 1 ATOM 1121 N N . MET A 1 143 ? 14.694 1.973 45.452 1.00 54.18 ? 143 MET A N 1 ATOM 1122 C CA . MET A 1 143 ? 15.308 2.788 46.456 1.00 56.06 ? 143 MET A CA 1 ATOM 1123 C C . MET A 1 143 ? 16.488 3.538 45.846 1.00 55.51 ? 143 MET A C 1 ATOM 1124 O O . MET A 1 143 ? 17.159 2.994 44.988 1.00 53.53 ? 143 MET A O 1 ATOM 1125 C CB . MET A 1 143 ? 15.842 1.880 47.556 1.00 55.97 ? 143 MET A CB 1 ATOM 1126 C CG . MET A 1 143 ? 14.942 1.701 48.742 1.00 61.64 ? 143 MET A CG 1 ATOM 1127 S SD . MET A 1 143 ? 13.192 2.030 48.526 1.00 63.53 ? 143 MET A SD 1 ATOM 1128 C CE . MET A 1 143 ? 12.841 2.555 50.118 1.00 64.00 ? 143 MET A CE 1 ATOM 1129 N N . PHE A 1 144 ? 16.737 4.770 46.298 1.00 56.16 ? 144 PHE A N 1 ATOM 1130 C CA . PHE A 1 144 ? 17.943 5.502 45.880 1.00 57.58 ? 144 PHE A CA 1 ATOM 1131 C C . PHE A 1 144 ? 19.203 5.040 46.640 1.00 58.63 ? 144 PHE A C 1 ATOM 1132 O O . PHE A 1 144 ? 19.136 4.667 47.812 1.00 58.97 ? 144 PHE A O 1 ATOM 1133 C CB . PHE A 1 144 ? 17.797 6.993 46.163 1.00 57.42 ? 144 PHE A CB 1 ATOM 1134 C CG . PHE A 1 144 ? 16.660 7.643 45.455 1.00 56.48 ? 144 PHE A CG 1 ATOM 1135 C CD1 . PHE A 1 144 ? 15.614 8.172 46.165 1.00 55.57 ? 144 PHE A CD1 1 ATOM 1136 C CD2 . PHE A 1 144 ? 16.660 7.755 44.093 1.00 55.70 ? 144 PHE A CD2 1 ATOM 1137 C CE1 . PHE A 1 144 ? 14.564 8.786 45.532 1.00 55.32 ? 144 PHE A CE1 1 ATOM 1138 C CE2 . PHE A 1 144 ? 15.613 8.354 43.442 1.00 58.94 ? 144 PHE A CE2 1 ATOM 1139 C CZ . PHE A 1 144 ? 14.560 8.876 44.162 1.00 57.81 ? 144 PHE A CZ 1 ATOM 1140 N N . PRO A 1 145 ? 20.348 5.059 45.978 1.00 59.56 ? 145 PRO A N 1 ATOM 1141 C CA . PRO A 1 145 ? 21.626 4.835 46.654 1.00 61.15 ? 145 PRO A CA 1 ATOM 1142 C C . PRO A 1 145 ? 21.965 6.038 47.530 1.00 62.56 ? 145 PRO A C 1 ATOM 1143 O O . PRO A 1 145 ? 21.403 7.102 47.353 1.00 62.36 ? 145 PRO A O 1 ATOM 1144 C CB . PRO A 1 145 ? 22.634 4.764 45.502 1.00 59.97 ? 145 PRO A CB 1 ATOM 1145 C CG . PRO A 1 145 ? 21.895 4.638 44.348 1.00 59.68 ? 145 PRO A CG 1 ATOM 1146 C CD . PRO A 1 145 ? 20.523 5.233 44.536 1.00 60.05 ? 145 PRO A CD 1 ATOM 1147 N N . LYS A 1 146 ? 22.924 5.877 48.423 1.00 64.87 ? 146 LYS A N 1 ATOM 1148 C CA . LYS A 1 146 ? 23.325 6.947 49.338 1.00 67.02 ? 146 LYS A CA 1 ATOM 1149 C C . LYS A 1 146 ? 23.759 8.276 48.706 1.00 67.18 ? 146 LYS A C 1 ATOM 1150 O O . LYS A 1 146 ? 23.474 9.338 49.261 1.00 68.01 ? 146 LYS A O 1 ATOM 1151 C CB . LYS A 1 146 ? 24.436 6.426 50.264 1.00 68.00 ? 146 LYS A CB 1 ATOM 1152 C CG . LYS A 1 146 ? 25.325 7.501 50.868 1.00 71.44 ? 146 LYS A CG 1 ATOM 1153 C CD . LYS A 1 146 ? 26.483 6.864 51.622 1.00 77.53 ? 146 LYS A CD 1 ATOM 1154 C CE . LYS A 1 146 ? 27.543 7.882 52.032 1.00 80.25 ? 146 LYS A CE 1 ATOM 1155 N NZ . LYS A 1 146 ? 28.199 8.529 50.863 1.00 80.54 ? 146 LYS A NZ 1 ATOM 1156 N N . ASN A 1 147 ? 24.421 8.228 47.556 1.00 67.08 ? 147 ASN A N 1 ATOM 1157 C CA . ASN A 1 147 ? 24.979 9.437 46.935 1.00 66.93 ? 147 ASN A CA 1 ATOM 1158 C C . ASN A 1 147 ? 24.178 10.008 45.773 1.00 66.79 ? 147 ASN A C 1 ATOM 1159 O O . ASN A 1 147 ? 24.742 10.709 44.919 1.00 67.15 ? 147 ASN A O 1 ATOM 1160 C CB . ASN A 1 147 ? 26.395 9.150 46.402 1.00 67.39 ? 147 ASN A CB 1 ATOM 1161 C CG . ASN A 1 147 ? 27.394 8.780 47.502 1.00 66.81 ? 147 ASN A CG 1 ATOM 1162 O OD1 . ASN A 1 147 ? 27.269 9.204 48.646 1.00 67.57 ? 147 ASN A OD1 1 ATOM 1163 N ND2 . ASN A 1 147 ? 28.389 7.986 47.143 1.00 67.66 ? 147 ASN A ND2 1 ATOM 1164 N N . ASP A 1 148 ? 22.877 9.718 45.758 1.00 65.56 ? 148 ASP A N 1 ATOM 1165 C CA . ASP A 1 148 ? 21.971 10.071 44.693 1.00 64.11 ? 148 ASP A CA 1 ATOM 1166 C C . ASP A 1 148 ? 21.336 11.423 44.960 1.00 64.09 ? 148 ASP A C 1 ATOM 1167 O O . ASP A 1 148 ? 20.691 11.616 45.972 1.00 64.86 ? 148 ASP A O 1 ATOM 1168 C CB . ASP A 1 148 ? 20.853 8.995 44.622 1.00 64.40 ? 148 ASP A CB 1 ATOM 1169 C CG . ASP A 1 148 ? 20.100 8.992 43.277 1.00 63.48 ? 148 ASP A CG 1 ATOM 1170 O OD1 . ASP A 1 148 ? 19.527 10.025 42.887 1.00 58.31 ? 148 ASP A OD1 1 ATOM 1171 O OD2 . ASP A 1 148 ? 20.042 7.985 42.535 1.00 65.67 ? 148 ASP A OD2 1 ATOM 1172 N N . PRO A 1 149 ? 21.506 12.368 44.052 1.00 63.33 ? 149 PRO A N 1 ATOM 1173 C CA . PRO A 1 149 ? 20.858 13.676 44.149 1.00 62.67 ? 149 PRO A CA 1 ATOM 1174 C C . PRO A 1 149 ? 19.338 13.666 44.291 1.00 61.71 ? 149 PRO A C 1 ATOM 1175 O O . PRO A 1 149 ? 18.784 14.681 44.706 1.00 61.40 ? 149 PRO A O 1 ATOM 1176 C CB . PRO A 1 149 ? 21.226 14.316 42.810 1.00 62.56 ? 149 PRO A CB 1 ATOM 1177 C CG . PRO A 1 149 ? 22.525 13.705 42.510 1.00 63.15 ? 149 PRO A CG 1 ATOM 1178 C CD . PRO A 1 149 ? 22.379 12.280 42.875 1.00 63.41 ? 149 PRO A CD 1 ATOM 1179 N N . LYS A 1 150 ? 18.663 12.591 43.903 1.00 60.91 ? 150 LYS A N 1 ATOM 1180 C CA . LYS A 1 150 ? 17.211 12.563 44.036 1.00 60.43 ? 150 LYS A CA 1 ATOM 1181 C C . LYS A 1 150 ? 16.813 12.301 45.502 1.00 60.10 ? 150 LYS A C 1 ATOM 1182 O O . LYS A 1 150 ? 15.656 12.313 45.877 1.00 60.88 ? 150 LYS A O 1 ATOM 1183 C CB . LYS A 1 150 ? 16.619 11.497 43.122 1.00 59.68 ? 150 LYS A CB 1 ATOM 1184 C CG . LYS A 1 150 ? 16.419 11.998 41.705 1.00 60.30 ? 150 LYS A CG 1 ATOM 1185 C CD . LYS A 1 150 ? 15.716 10.998 40.808 1.00 55.93 ? 150 LYS A CD 1 ATOM 1186 C CE . LYS A 1 150 ? 15.772 11.471 39.382 1.00 58.30 ? 150 LYS A CE 1 ATOM 1187 N NZ . LYS A 1 150 ? 14.853 12.625 39.065 1.00 54.31 ? 150 LYS A NZ 1 ATOM 1188 N N . LEU A 1 151 ? 17.785 12.065 46.343 1.00 59.57 ? 151 LEU A N 1 ATOM 1189 C CA . LEU A 1 151 ? 17.468 11.797 47.703 1.00 60.11 ? 151 LEU A CA 1 ATOM 1190 C C . LEU A 1 151 ? 17.193 13.114 48.348 1.00 60.32 ? 151 LEU A C 1 ATOM 1191 O O . LEU A 1 151 ? 16.261 13.288 49.135 1.00 61.40 ? 151 LEU A O 1 ATOM 1192 C CB . LEU A 1 151 ? 18.690 11.213 48.360 1.00 60.29 ? 151 LEU A CB 1 ATOM 1193 C CG . LEU A 1 151 ? 18.527 9.745 48.714 1.00 61.67 ? 151 LEU A CG 1 ATOM 1194 C CD1 . LEU A 1 151 ? 19.828 9.211 49.319 1.00 63.94 ? 151 LEU A CD1 1 ATOM 1195 C CD2 . LEU A 1 151 ? 17.399 9.602 49.724 1.00 57.25 ? 151 LEU A CD2 1 ATOM 1196 N N . LYS A 1 152 ? 18.041 14.051 47.995 1.00 59.66 ? 152 LYS A N 1 ATOM 1197 C CA . LYS A 1 152 ? 17.934 15.366 48.527 1.00 59.58 ? 152 LYS A CA 1 ATOM 1198 C C . LYS A 1 152 ? 16.695 15.991 47.997 1.00 58.71 ? 152 LYS A C 1 ATOM 1199 O O . LYS A 1 152 ? 16.203 16.950 48.542 1.00 58.31 ? 152 LYS A O 1 ATOM 1200 C CB . LYS A 1 152 ? 19.154 16.173 48.079 1.00 59.43 ? 152 LYS A CB 1 ATOM 1201 C CG . LYS A 1 152 ? 20.478 15.428 48.324 1.00 60.29 ? 152 LYS A CG 1 ATOM 1202 C CD . LYS A 1 152 ? 21.624 16.367 48.068 1.00 64.97 ? 152 LYS A CD 1 ATOM 1203 C CE . LYS A 1 152 ? 22.983 15.791 48.479 1.00 67.30 ? 152 LYS A CE 1 ATOM 1204 N NZ . LYS A 1 152 ? 24.028 16.875 48.639 1.00 68.03 ? 152 LYS A NZ 1 ATOM 1205 N N . THR A 1 153 ? 16.156 15.438 46.937 1.00 59.32 ? 153 THR A N 1 ATOM 1206 C CA . THR A 1 153 ? 15.067 16.156 46.280 1.00 60.37 ? 153 THR A CA 1 ATOM 1207 C C . THR A 1 153 ? 13.698 15.495 46.195 1.00 59.89 ? 153 THR A C 1 ATOM 1208 O O . THR A 1 153 ? 12.680 16.155 46.299 1.00 59.67 ? 153 THR A O 1 ATOM 1209 C CB . THR A 1 153 ? 15.532 16.540 44.871 1.00 60.04 ? 153 THR A CB 1 ATOM 1210 O OG1 . THR A 1 153 ? 15.757 17.954 44.838 1.00 62.65 ? 153 THR A OG1 1 ATOM 1211 C CG2 . THR A 1 153 ? 14.431 16.347 43.899 1.00 59.63 ? 153 THR A CG2 1 ATOM 1212 N N . GLN A 1 154 ? 13.672 14.190 45.998 1.00 60.80 ? 154 GLN A N 1 ATOM 1213 C CA . GLN A 1 154 ? 12.402 13.538 45.776 1.00 61.55 ? 154 GLN A CA 1 ATOM 1214 C C . GLN A 1 154 ? 11.968 12.650 46.883 1.00 61.75 ? 154 GLN A C 1 ATOM 1215 O O . GLN A 1 154 ? 10.794 12.372 47.010 1.00 63.45 ? 154 GLN A O 1 ATOM 1216 C CB . GLN A 1 154 ? 12.444 12.746 44.482 1.00 61.67 ? 154 GLN A CB 1 ATOM 1217 C CG . GLN A 1 154 ? 12.456 13.648 43.337 1.00 60.26 ? 154 GLN A CG 1 ATOM 1218 C CD . GLN A 1 154 ? 12.703 12.912 42.072 1.00 58.30 ? 154 GLN A CD 1 ATOM 1219 O OE1 . GLN A 1 154 ? 13.361 13.432 41.197 1.00 59.10 ? 154 GLN A OE1 1 ATOM 1220 N NE2 . GLN A 1 154 ? 12.161 11.712 41.955 1.00 56.93 ? 154 GLN A NE2 1 ATOM 1221 N N . GLY A 1 155 ? 12.903 12.172 47.673 1.00 61.91 ? 155 GLY A N 1 ATOM 1222 C CA . GLY A 1 155 ? 12.530 11.342 48.787 1.00 61.78 ? 155 GLY A CA 1 ATOM 1223 C C . GLY A 1 155 ? 13.474 10.191 48.896 1.00 62.18 ? 155 GLY A C 1 ATOM 1224 O O . GLY A 1 155 ? 14.680 10.325 48.663 1.00 63.02 ? 155 GLY A O 1 ATOM 1225 N N . LYS A 1 156 ? 12.932 9.042 49.254 1.00 61.66 ? 156 LYS A N 1 ATOM 1226 C CA . LYS A 1 156 ? 13.769 7.904 49.500 1.00 61.19 ? 156 LYS A CA 1 ATOM 1227 C C . LYS A 1 156 ? 13.739 6.918 48.355 1.00 59.58 ? 156 LYS A C 1 ATOM 1228 O O . LYS A 1 156 ? 14.646 6.107 48.216 1.00 58.51 ? 156 LYS A O 1 ATOM 1229 C CB . LYS A 1 156 ? 13.285 7.221 50.756 1.00 61.74 ? 156 LYS A CB 1 ATOM 1230 C CG . LYS A 1 156 ? 13.397 8.091 51.968 1.00 65.61 ? 156 LYS A CG 1 ATOM 1231 C CD . LYS A 1 156 ? 14.636 7.680 52.800 1.00 69.02 ? 156 LYS A CD 1 ATOM 1232 C CE . LYS A 1 156 ? 14.374 7.741 54.298 1.00 68.39 ? 156 LYS A CE 1 ATOM 1233 N NZ . LYS A 1 156 ? 15.487 7.069 55.014 1.00 68.79 ? 156 LYS A NZ 1 ATOM 1234 N N . CYS A 1 157 ? 12.703 7.016 47.527 1.00 59.14 ? 157 CYS A N 1 ATOM 1235 C CA . CYS A 1 157 ? 12.501 6.071 46.441 1.00 58.37 ? 157 CYS A CA 1 ATOM 1236 C C . CYS A 1 157 ? 11.698 6.640 45.279 1.00 58.31 ? 157 CYS A C 1 ATOM 1237 O O . CYS A 1 157 ? 11.233 7.784 45.332 1.00 57.05 ? 157 CYS A O 1 ATOM 1238 C CB . CYS A 1 157 ? 11.766 4.859 46.968 1.00 58.36 ? 157 CYS A CB 1 ATOM 1239 S SG . CYS A 1 157 ? 9.983 5.105 47.198 1.00 60.07 ? 157 CYS A SG 1 ATOM 1240 N N . MET A 1 158 ? 11.596 5.820 44.220 1.00 57.86 ? 158 MET A N 1 ATOM 1241 C CA . MET A 1 158 ? 10.686 6.021 43.104 1.00 57.21 ? 158 MET A CA 1 ATOM 1242 C C . MET A 1 158 ? 9.697 4.856 43.131 1.00 57.16 ? 158 MET A C 1 ATOM 1243 O O . MET A 1 158 ? 10.080 3.695 43.107 1.00 57.84 ? 158 MET A O 1 ATOM 1244 C CB . MET A 1 158 ? 11.424 6.001 41.774 1.00 56.89 ? 158 MET A CB 1 ATOM 1245 C CG . MET A 1 158 ? 12.077 7.308 41.402 1.00 57.01 ? 158 MET A CG 1 ATOM 1246 S SD . MET A 1 158 ? 13.368 7.098 40.144 1.00 61.48 ? 158 MET A SD 1 ATOM 1247 C CE . MET A 1 158 ? 12.445 5.752 38.874 1.00 50.46 ? 158 MET A CE 1 ATOM 1248 N N . PRO A 1 159 ? 8.417 5.145 43.209 1.00 57.26 ? 159 PRO A N 1 ATOM 1249 C CA . PRO A 1 159 ? 7.408 4.084 43.244 1.00 56.10 ? 159 PRO A CA 1 ATOM 1250 C C . PRO A 1 159 ? 7.594 3.105 42.135 1.00 55.00 ? 159 PRO A C 1 ATOM 1251 O O . PRO A 1 159 ? 8.205 3.427 41.131 1.00 56.68 ? 159 PRO A O 1 ATOM 1252 C CB . PRO A 1 159 ? 6.116 4.848 43.029 1.00 56.81 ? 159 PRO A CB 1 ATOM 1253 C CG . PRO A 1 159 ? 6.383 6.114 43.708 1.00 58.58 ? 159 PRO A CG 1 ATOM 1254 C CD . PRO A 1 159 ? 7.826 6.485 43.354 1.00 57.57 ? 159 PRO A CD 1 ATOM 1255 N N . PHE A 1 160 ? 7.058 1.914 42.301 1.00 52.70 ? 160 PHE A N 1 ATOM 1256 C CA . PHE A 1 160 ? 7.108 0.942 41.244 1.00 51.14 ? 160 PHE A CA 1 ATOM 1257 C C . PHE A 1 160 ? 6.256 -0.206 41.713 1.00 50.06 ? 160 PHE A C 1 ATOM 1258 O O . PHE A 1 160 ? 6.273 -0.590 42.876 1.00 49.33 ? 160 PHE A O 1 ATOM 1259 C CB . PHE A 1 160 ? 8.570 0.581 40.924 1.00 50.91 ? 160 PHE A CB 1 ATOM 1260 C CG . PHE A 1 160 ? 8.752 -0.609 40.013 1.00 49.76 ? 160 PHE A CG 1 ATOM 1261 C CD1 . PHE A 1 160 ? 9.196 -0.444 38.693 1.00 47.99 ? 160 PHE A CD1 1 ATOM 1262 C CD2 . PHE A 1 160 ? 8.576 -1.896 40.493 1.00 49.82 ? 160 PHE A CD2 1 ATOM 1263 C CE1 . PHE A 1 160 ? 9.423 -1.513 37.872 1.00 45.37 ? 160 PHE A CE1 1 ATOM 1264 C CE2 . PHE A 1 160 ? 8.801 -2.989 39.658 1.00 50.94 ? 160 PHE A CE2 1 ATOM 1265 C CZ . PHE A 1 160 ? 9.226 -2.784 38.344 1.00 49.95 ? 160 PHE A CZ 1 ATOM 1266 N N . PHE A 1 161 ? 5.509 -0.764 40.787 1.00 49.73 ? 161 PHE A N 1 ATOM 1267 C CA . PHE A 1 161 ? 4.491 -1.728 41.133 1.00 49.69 ? 161 PHE A CA 1 ATOM 1268 C C . PHE A 1 161 ? 4.641 -2.873 40.241 1.00 49.38 ? 161 PHE A C 1 ATOM 1269 O O . PHE A 1 161 ? 4.735 -2.692 39.018 1.00 49.15 ? 161 PHE A O 1 ATOM 1270 C CB . PHE A 1 161 ? 3.130 -1.071 40.979 1.00 48.72 ? 161 PHE A CB 1 ATOM 1271 C CG . PHE A 1 161 ? 3.041 0.197 41.741 1.00 53.07 ? 161 PHE A CG 1 ATOM 1272 C CD1 . PHE A 1 161 ? 3.320 1.410 41.139 1.00 54.77 ? 161 PHE A CD1 1 ATOM 1273 C CD2 . PHE A 1 161 ? 2.803 0.178 43.096 1.00 53.51 ? 161 PHE A CD2 1 ATOM 1274 C CE1 . PHE A 1 161 ? 3.281 2.594 41.845 1.00 52.72 ? 161 PHE A CE1 1 ATOM 1275 C CE2 . PHE A 1 161 ? 2.780 1.357 43.788 1.00 56.08 ? 161 PHE A CE2 1 ATOM 1276 C CZ . PHE A 1 161 ? 3.044 2.581 43.141 1.00 52.58 ? 161 PHE A CZ 1 ATOM 1277 N N . ARG A 1 162 ? 4.649 -4.052 40.849 1.00 49.60 ? 162 ARG A N 1 ATOM 1278 C CA . ARG A 1 162 ? 4.845 -5.281 40.108 1.00 50.80 ? 162 ARG A CA 1 ATOM 1279 C C . ARG A 1 162 ? 3.800 -5.447 39.051 1.00 51.54 ? 162 ARG A C 1 ATOM 1280 O O . ARG A 1 162 ? 2.660 -5.047 39.255 1.00 52.73 ? 162 ARG A O 1 ATOM 1281 C CB . ARG A 1 162 ? 4.888 -6.478 41.037 1.00 50.04 ? 162 ARG A CB 1 ATOM 1282 C CG . ARG A 1 162 ? 5.904 -6.316 42.115 1.00 49.60 ? 162 ARG A CG 1 ATOM 1283 C CD . ARG A 1 162 ? 6.356 -7.609 42.744 1.00 46.19 ? 162 ARG A CD 1 ATOM 1284 N NE . ARG A 1 162 ? 6.702 -8.560 41.705 1.00 41.93 ? 162 ARG A NE 1 ATOM 1285 C CZ . ARG A 1 162 ? 6.779 -9.869 41.892 1.00 43.34 ? 162 ARG A CZ 1 ATOM 1286 N NH1 . ARG A 1 162 ? 6.500 -10.404 43.091 1.00 42.84 ? 162 ARG A NH1 1 ATOM 1287 N NH2 . ARG A 1 162 ? 7.119 -10.648 40.879 1.00 37.29 ? 162 ARG A NH2 1 ATOM 1288 N N . ALA A 1 163 ? 4.225 -5.996 37.907 1.00 52.92 ? 163 ALA A N 1 ATOM 1289 C CA . ALA A 1 163 ? 3.407 -6.272 36.732 1.00 53.22 ? 163 ALA A CA 1 ATOM 1290 C C . ALA A 1 163 ? 2.305 -7.279 36.961 1.00 54.51 ? 163 ALA A C 1 ATOM 1291 O O . ALA A 1 163 ? 2.472 -8.256 37.676 1.00 52.23 ? 163 ALA A O 1 ATOM 1292 C CB . ALA A 1 163 ? 4.303 -6.807 35.638 1.00 53.02 ? 163 ALA A CB 1 ATOM 1293 N N . GLY A 1 164 ? 1.175 -7.123 36.323 1.00 57.59 ? 164 GLY A N 1 ATOM 1294 C CA . GLY A 1 164 ? 0.102 -8.114 36.499 1.00 61.36 ? 164 GLY A CA 1 ATOM 1295 C C . GLY A 1 164 ? 0.442 -9.555 36.032 1.00 64.20 ? 164 GLY A C 1 ATOM 1296 O O . GLY A 1 164 ? 1.173 -9.741 35.071 1.00 64.18 ? 164 GLY A O 1 ATOM 1297 N N . PHE A 1 165 ? -0.126 -10.595 36.700 1.00 66.31 ? 165 PHE A N 1 ATOM 1298 C CA . PHE A 1 165 ? 0.152 -12.006 36.331 1.00 69.17 ? 165 PHE A CA 1 ATOM 1299 C C . PHE A 1 165 ? -1.120 -12.832 35.991 1.00 71.44 ? 165 PHE A C 1 ATOM 1300 O O . PHE A 1 165 ? -2.211 -12.451 36.391 1.00 71.53 ? 165 PHE A O 1 ATOM 1301 C CB . PHE A 1 165 ? 1.033 -12.694 37.431 1.00 68.83 ? 165 PHE A CB 1 ATOM 1302 C CG . PHE A 1 165 ? 0.762 -12.421 38.901 1.00 68.71 ? 165 PHE A CG 1 ATOM 1303 C CD1 . PHE A 1 165 ? 1.026 -11.206 39.495 1.00 67.37 ? 165 PHE A CD1 1 ATOM 1304 C CD2 . PHE A 1 165 ? 0.241 -13.436 39.701 1.00 69.11 ? 165 PHE A CD2 1 ATOM 1305 C CE1 . PHE A 1 165 ? 0.755 -11.000 40.828 1.00 67.67 ? 165 PHE A CE1 1 ATOM 1306 C CE2 . PHE A 1 165 ? -0.061 -13.228 41.031 1.00 68.42 ? 165 PHE A CE2 1 ATOM 1307 C CZ . PHE A 1 165 ? 0.196 -12.013 41.605 1.00 67.78 ? 165 PHE A CZ 1 ATOM 1308 N N . VAL A 1 166 ? -0.968 -13.962 35.254 1.00 75.03 ? 166 VAL A N 1 ATOM 1309 C CA . VAL A 1 166 ? -2.121 -14.802 34.811 1.00 78.84 ? 166 VAL A CA 1 ATOM 1310 C C . VAL A 1 166 ? -2.564 -15.746 35.922 1.00 81.76 ? 166 VAL A C 1 ATOM 1311 O O . VAL A 1 166 ? -1.841 -15.989 36.871 1.00 81.95 ? 166 VAL A O 1 ATOM 1312 C CB . VAL A 1 166 ? -1.764 -15.574 33.530 1.00 78.75 ? 166 VAL A CB 1 ATOM 1313 C CG1 . VAL A 1 166 ? -2.119 -14.759 32.292 1.00 79.52 ? 166 VAL A CG1 1 ATOM 1314 C CG2 . VAL A 1 166 ? -0.277 -15.927 33.511 1.00 79.00 ? 166 VAL A CG2 1 ATOM 1315 N N . CYS A 1 167 ? -3.786 -16.278 35.772 1.00 85.28 ? 167 CYS A N 1 ATOM 1316 C CA . CYS A 1 167 ? -4.360 -16.985 36.891 1.00 88.74 ? 167 CYS A CA 1 ATOM 1317 C C . CYS A 1 167 ? -4.530 -15.807 37.908 1.00 90.19 ? 167 CYS A C 1 ATOM 1318 O O . CYS A 1 167 ? -4.841 -14.684 37.525 1.00 90.54 ? 167 CYS A O 1 ATOM 1319 C CB . CYS A 1 167 ? -3.519 -18.177 37.369 1.00 89.00 ? 167 CYS A CB 1 ATOM 1320 S SG . CYS A 1 167 ? -3.309 -19.497 36.130 1.00 93.98 ? 167 CYS A SG 1 ATOM 1321 N N . PRO A 1 168 ? -4.307 -16.083 39.207 1.00 91.53 ? 168 PRO A N 1 ATOM 1322 C CA . PRO A 1 168 ? -4.583 -15.065 40.213 1.00 92.40 ? 168 PRO A CA 1 ATOM 1323 C C . PRO A 1 168 ? -4.153 -13.655 40.027 1.00 93.45 ? 168 PRO A C 1 ATOM 1324 O O . PRO A 1 168 ? -3.045 -13.345 39.559 1.00 94.03 ? 168 PRO A O 1 ATOM 1325 C CB . PRO A 1 168 ? -4.141 -15.692 41.497 1.00 92.38 ? 168 PRO A CB 1 ATOM 1326 C CG . PRO A 1 168 ? -4.607 -17.092 41.320 1.00 91.81 ? 168 PRO A CG 1 ATOM 1327 C CD . PRO A 1 168 ? -4.637 -17.381 39.851 1.00 91.77 ? 168 PRO A CD 1 ATOM 1328 N N . THR A 1 169 ? -5.074 -12.792 40.449 1.00 94.58 ? 169 THR A N 1 ATOM 1329 C CA . THR A 1 169 ? -4.657 -11.463 40.556 1.00 95.48 ? 169 THR A CA 1 ATOM 1330 C C . THR A 1 169 ? -3.876 -11.607 41.862 1.00 96.05 ? 169 THR A C 1 ATOM 1331 O O . THR A 1 169 ? -2.651 -11.490 41.876 1.00 96.47 ? 169 THR A O 1 ATOM 1332 C CB . THR A 1 169 ? -5.832 -10.481 40.406 1.00 95.88 ? 169 THR A CB 1 ATOM 1333 O OG1 . THR A 1 169 ? -6.145 -10.326 39.019 1.00 96.51 ? 169 THR A OG1 1 ATOM 1334 C CG2 . THR A 1 169 ? -5.460 -9.122 40.995 1.00 95.89 ? 169 THR A CG2 1 ATOM 1335 N N . PRO A 1 170 ? -4.574 -11.860 43.001 1.00 96.46 ? 170 PRO A N 1 ATOM 1336 C CA . PRO A 1 170 ? -3.895 -12.157 44.342 1.00 96.42 ? 170 PRO A CA 1 ATOM 1337 C C . PRO A 1 170 ? -2.945 -13.403 44.501 1.00 96.43 ? 170 PRO A C 1 ATOM 1338 O O . PRO A 1 170 ? -2.450 -14.003 43.563 1.00 96.34 ? 170 PRO A O 1 ATOM 1339 C CB . PRO A 1 170 ? -5.120 -12.095 45.258 1.00 96.67 ? 170 PRO A CB 1 ATOM 1340 C CG . PRO A 1 170 ? -5.964 -10.999 44.706 1.00 97.10 ? 170 PRO A CG 1 ATOM 1341 C CD . PRO A 1 170 ? -5.638 -10.861 43.252 1.00 96.55 ? 170 PRO A CD 1 ATOM 1342 N N . PRO A 1 171 ? -2.769 -13.710 45.821 1.00 96.47 ? 171 PRO A N 1 ATOM 1343 C CA . PRO A 1 171 ? -1.995 -14.901 46.270 1.00 96.28 ? 171 PRO A CA 1 ATOM 1344 C C . PRO A 1 171 ? -2.299 -16.273 45.758 1.00 96.15 ? 171 PRO A C 1 ATOM 1345 O O . PRO A 1 171 ? -3.363 -16.837 45.985 1.00 96.50 ? 171 PRO A O 1 ATOM 1346 C CB . PRO A 1 171 ? -2.034 -14.823 47.795 1.00 96.45 ? 171 PRO A CB 1 ATOM 1347 C CG . PRO A 1 171 ? -1.868 -13.367 47.973 1.00 96.42 ? 171 PRO A CG 1 ATOM 1348 C CD . PRO A 1 171 ? -2.386 -12.638 46.771 1.00 96.53 ? 171 PRO A CD 1 ATOM 1349 N N . TYR A 1 172 ? -1.330 -16.828 45.052 1.00 95.66 ? 172 TYR A N 1 ATOM 1350 C CA . TYR A 1 172 ? -1.300 -18.256 44.810 1.00 94.73 ? 172 TYR A CA 1 ATOM 1351 C C . TYR A 1 172 ? 0.178 -18.617 44.621 1.00 93.81 ? 172 TYR A C 1 ATOM 1352 O O . TYR A 1 172 ? 0.994 -17.751 44.265 1.00 93.57 ? 172 TYR A O 1 ATOM 1353 C CB . TYR A 1 172 ? -2.231 -18.739 43.699 1.00 94.96 ? 172 TYR A CB 1 ATOM 1354 C CG . TYR A 1 172 ? -2.277 -20.246 43.700 1.00 95.49 ? 172 TYR A CG 1 ATOM 1355 C CD1 . TYR A 1 172 ? -2.392 -20.951 44.894 1.00 95.49 ? 172 TYR A CD1 1 ATOM 1356 C CD2 . TYR A 1 172 ? -2.145 -20.964 42.521 1.00 96.34 ? 172 TYR A CD2 1 ATOM 1357 C CE1 . TYR A 1 172 ? -2.394 -22.333 44.910 1.00 96.25 ? 172 TYR A CE1 1 ATOM 1358 C CE2 . TYR A 1 172 ? -2.159 -22.338 42.519 1.00 96.46 ? 172 TYR A CE2 1 ATOM 1359 C CZ . TYR A 1 172 ? -2.281 -23.025 43.713 1.00 96.79 ? 172 TYR A CZ 1 ATOM 1360 O OH . TYR A 1 172 ? -2.283 -24.408 43.699 1.00 96.13 ? 172 TYR A OH 1 ATOM 1361 N N . GLN A 1 173 ? 0.521 -19.878 44.880 1.00 92.54 ? 173 GLN A N 1 ATOM 1362 C CA . GLN A 1 173 ? 1.921 -20.273 44.945 1.00 91.14 ? 173 GLN A CA 1 ATOM 1363 C C . GLN A 1 173 ? 2.205 -21.783 44.863 1.00 89.72 ? 173 GLN A C 1 ATOM 1364 O O . GLN A 1 173 ? 2.188 -22.478 45.889 1.00 89.79 ? 173 GLN A O 1 ATOM 1365 C CB . GLN A 1 173 ? 2.506 -19.720 46.258 1.00 91.77 ? 173 GLN A CB 1 ATOM 1366 C CG . GLN A 1 173 ? 1.834 -20.229 47.579 1.00 92.38 ? 173 GLN A CG 1 ATOM 1367 C CD . GLN A 1 173 ? 0.317 -19.921 47.712 1.00 93.47 ? 173 GLN A CD 1 ATOM 1368 O OE1 . GLN A 1 173 ? -0.068 -18.832 48.161 1.00 93.25 ? 173 GLN A OE1 1 ATOM 1369 N NE2 . GLN A 1 173 ? -0.530 -20.897 47.354 1.00 91.37 ? 173 GLN A NE2 1 ATOM 1370 N N . SER A 1 174 ? 2.495 -22.277 43.656 1.00 87.43 ? 174 SER A N 1 ATOM 1371 C CA . SER A 1 174 ? 2.851 -23.693 43.427 1.00 85.14 ? 174 SER A CA 1 ATOM 1372 C C . SER A 1 174 ? 3.749 -23.832 42.165 1.00 83.16 ? 174 SER A C 1 ATOM 1373 O O . SER A 1 174 ? 4.589 -24.748 42.048 1.00 83.12 ? 174 SER A O 1 ATOM 1374 C CB . SER A 1 174 ? 1.585 -24.580 43.293 1.00 85.65 ? 174 SER A CB 1 ATOM 1375 O OG . SER A 1 174 ? 0.807 -24.659 44.491 1.00 85.33 ? 174 SER A OG 1 ATOM 1376 N N . LEU A 1 175 ? 3.548 -22.905 41.230 1.00 79.88 ? 175 LEU A N 1 ATOM 1377 C CA . LEU A 1 175 ? 4.286 -22.833 39.979 1.00 76.45 ? 175 LEU A CA 1 ATOM 1378 C C . LEU A 1 175 ? 4.744 -21.367 39.832 1.00 73.28 ? 175 LEU A C 1 ATOM 1379 O O . LEU A 1 175 ? 4.205 -20.482 40.477 1.00 72.62 ? 175 LEU A O 1 ATOM 1380 C CB . LEU A 1 175 ? 3.350 -23.269 38.842 1.00 77.20 ? 175 LEU A CB 1 ATOM 1381 C CG . LEU A 1 175 ? 3.764 -23.603 37.403 1.00 77.53 ? 175 LEU A CG 1 ATOM 1382 C CD1 . LEU A 1 175 ? 3.066 -22.657 36.468 1.00 78.91 ? 175 LEU A CD1 1 ATOM 1383 C CD2 . LEU A 1 175 ? 5.283 -23.630 37.180 1.00 78.22 ? 175 LEU A CD2 1 ATOM 1384 N N . ALA A 1 176 ? 5.729 -21.111 38.982 1.00 69.70 ? 176 ALA A N 1 ATOM 1385 C CA . ALA A 1 176 ? 6.317 -19.779 38.864 1.00 65.72 ? 176 ALA A CA 1 ATOM 1386 C C . ALA A 1 176 ? 5.360 -18.692 38.390 1.00 63.70 ? 176 ALA A C 1 ATOM 1387 O O . ALA A 1 176 ? 4.431 -18.941 37.638 1.00 63.97 ? 176 ALA A O 1 ATOM 1388 C CB . ALA A 1 176 ? 7.480 -19.843 37.970 1.00 65.99 ? 176 ALA A CB 1 ATOM 1389 N N . ARG A 1 177 ? 5.600 -17.466 38.829 1.00 60.69 ? 177 ARG A N 1 ATOM 1390 C CA . ARG A 1 177 ? 4.762 -16.319 38.462 1.00 57.22 ? 177 ARG A CA 1 ATOM 1391 C C . ARG A 1 177 ? 4.950 -15.880 36.998 1.00 55.58 ? 177 ARG A C 1 ATOM 1392 O O . ARG A 1 177 ? 6.076 -15.676 36.525 1.00 55.22 ? 177 ARG A O 1 ATOM 1393 C CB . ARG A 1 177 ? 5.070 -15.188 39.415 1.00 56.40 ? 177 ARG A CB 1 ATOM 1394 C CG . ARG A 1 177 ? 4.942 -13.811 38.855 1.00 55.94 ? 177 ARG A CG 1 ATOM 1395 C CD . ARG A 1 177 ? 3.728 -13.109 39.318 1.00 53.37 ? 177 ARG A CD 1 ATOM 1396 N NE . ARG A 1 177 ? 4.011 -11.776 39.840 1.00 51.66 ? 177 ARG A NE 1 ATOM 1397 C CZ . ARG A 1 177 ? 3.771 -11.386 41.086 1.00 47.81 ? 177 ARG A CZ 1 ATOM 1398 N NH1 . ARG A 1 177 ? 3.220 -12.189 41.975 1.00 44.47 ? 177 ARG A NH1 1 ATOM 1399 N NH2 . ARG A 1 177 ? 4.035 -10.152 41.426 1.00 48.94 ? 177 ARG A NH2 1 ATOM 1400 N N . GLU A 1 178 ? 3.837 -15.724 36.289 1.00 53.43 ? 178 GLU A N 1 ATOM 1401 C CA . GLU A 1 178 ? 3.865 -15.410 34.865 1.00 51.98 ? 178 GLU A CA 1 ATOM 1402 C C . GLU A 1 178 ? 3.158 -14.104 34.534 1.00 50.65 ? 178 GLU A C 1 ATOM 1403 O O . GLU A 1 178 ? 1.980 -13.921 34.841 1.00 51.50 ? 178 GLU A O 1 ATOM 1404 C CB . GLU A 1 178 ? 3.236 -16.548 34.069 1.00 51.58 ? 178 GLU A CB 1 ATOM 1405 C CG . GLU A 1 178 ? 3.872 -17.894 34.336 1.00 51.83 ? 178 GLU A CG 1 ATOM 1406 C CD . GLU A 1 178 ? 5.367 -17.907 34.089 1.00 54.36 ? 178 GLU A CD 1 ATOM 1407 O OE1 . GLU A 1 178 ? 5.892 -16.904 33.548 1.00 53.74 ? 178 GLU A OE1 1 ATOM 1408 O OE2 . GLU A 1 178 ? 6.002 -18.946 34.427 1.00 55.88 ? 178 GLU A OE2 1 ATOM 1409 N N . GLN A 1 179 ? 3.874 -13.183 33.896 1.00 48.41 ? 179 GLN A N 1 ATOM 1410 C CA . GLN A 1 179 ? 3.286 -11.871 33.568 1.00 46.44 ? 179 GLN A CA 1 ATOM 1411 C C . GLN A 1 179 ? 2.410 -11.956 32.346 1.00 46.39 ? 179 GLN A C 1 ATOM 1412 O O . GLN A 1 179 ? 2.561 -12.864 31.531 1.00 46.64 ? 179 GLN A O 1 ATOM 1413 C CB . GLN A 1 179 ? 4.352 -10.815 33.362 1.00 44.85 ? 179 GLN A CB 1 ATOM 1414 C CG . GLN A 1 179 ? 5.091 -10.438 34.662 1.00 45.74 ? 179 GLN A CG 1 ATOM 1415 C CD . GLN A 1 179 ? 6.131 -11.490 35.083 1.00 43.13 ? 179 GLN A CD 1 ATOM 1416 O OE1 . GLN A 1 179 ? 6.792 -12.051 34.230 1.00 42.13 ? 179 GLN A OE1 1 ATOM 1417 N NE2 . GLN A 1 179 ? 6.344 -11.647 36.390 1.00 41.57 ? 179 GLN A NE2 1 ATOM 1418 N N . ILE A 1 180 ? 1.501 -11.002 32.210 1.00 45.28 ? 180 ILE A N 1 ATOM 1419 C CA . ILE A 1 180 ? 0.598 -10.975 31.099 1.00 44.12 ? 180 ILE A CA 1 ATOM 1420 C C . ILE A 1 180 ? 1.023 -10.084 29.945 1.00 43.63 ? 180 ILE A C 1 ATOM 1421 O O . ILE A 1 180 ? 1.573 -9.029 30.145 1.00 42.13 ? 180 ILE A O 1 ATOM 1422 C CB . ILE A 1 180 ? -0.737 -10.454 31.602 1.00 45.81 ? 180 ILE A CB 1 ATOM 1423 C CG1 . ILE A 1 180 ? -1.227 -11.300 32.812 1.00 48.03 ? 180 ILE A CG1 1 ATOM 1424 C CG2 . ILE A 1 180 ? -1.797 -10.414 30.454 1.00 44.66 ? 180 ILE A CG2 1 ATOM 1425 C CD1 . ILE A 1 180 ? -2.389 -10.681 33.496 1.00 54.37 ? 180 ILE A CD1 1 ATOM 1426 N N . ASN A 1 181 ? 0.751 -10.536 28.724 1.00 42.59 ? 181 ASN A N 1 ATOM 1427 C CA . ASN A 1 181 ? 0.819 -9.678 27.568 1.00 43.01 ? 181 ASN A CA 1 ATOM 1428 C C . ASN A 1 181 ? -0.662 -9.320 27.258 1.00 43.15 ? 181 ASN A C 1 ATOM 1429 O O . ASN A 1 181 ? -1.449 -10.199 27.004 1.00 42.78 ? 181 ASN A O 1 ATOM 1430 C CB . ASN A 1 181 ? 1.437 -10.431 26.422 1.00 40.68 ? 181 ASN A CB 1 ATOM 1431 C CG . ASN A 1 181 ? 1.585 -9.591 25.194 1.00 43.65 ? 181 ASN A CG 1 ATOM 1432 O OD1 . ASN A 1 181 ? 1.120 -8.426 25.156 1.00 44.98 ? 181 ASN A OD1 1 ATOM 1433 N ND2 . ASN A 1 181 ? 2.247 -10.160 24.144 1.00 40.20 ? 181 ASN A ND2 1 ATOM 1434 N N . ALA A 1 182 ? -1.009 -8.040 27.231 1.00 43.47 ? 182 ALA A N 1 ATOM 1435 C CA . ALA A 1 182 ? -2.405 -7.616 27.011 1.00 43.79 ? 182 ALA A CA 1 ATOM 1436 C C . ALA A 1 182 ? -2.683 -7.133 25.584 1.00 44.57 ? 182 ALA A C 1 ATOM 1437 O O . ALA A 1 182 ? -3.760 -6.583 25.274 1.00 44.82 ? 182 ALA A O 1 ATOM 1438 C CB . ALA A 1 182 ? -2.782 -6.525 28.010 1.00 44.10 ? 182 ALA A CB 1 ATOM 1439 N N . VAL A 1 183 ? -1.714 -7.295 24.704 1.00 43.71 ? 183 VAL A N 1 ATOM 1440 C CA . VAL A 1 183 ? -2.003 -6.994 23.304 1.00 42.87 ? 183 VAL A CA 1 ATOM 1441 C C . VAL A 1 183 ? -1.812 -8.272 22.534 1.00 42.24 ? 183 VAL A C 1 ATOM 1442 O O . VAL A 1 183 ? -1.372 -9.256 23.088 1.00 41.86 ? 183 VAL A O 1 ATOM 1443 C CB . VAL A 1 183 ? -1.159 -5.797 22.777 1.00 43.73 ? 183 VAL A CB 1 ATOM 1444 C CG1 . VAL A 1 183 ? -1.486 -4.580 23.585 1.00 39.38 ? 183 VAL A CG1 1 ATOM 1445 C CG2 . VAL A 1 183 ? 0.378 -6.101 22.846 1.00 41.98 ? 183 VAL A CG2 1 ATOM 1446 N N . THR A 1 184 ? -2.142 -8.274 21.257 1.00 43.51 ? 184 THR A N 1 ATOM 1447 C CA . THR A 1 184 ? -1.986 -9.498 20.469 1.00 42.92 ? 184 THR A CA 1 ATOM 1448 C C . THR A 1 184 ? -0.530 -9.656 20.050 1.00 43.27 ? 184 THR A C 1 ATOM 1449 O O . THR A 1 184 ? 0.058 -8.741 19.573 1.00 43.30 ? 184 THR A O 1 ATOM 1450 C CB . THR A 1 184 ? -2.850 -9.433 19.229 1.00 43.43 ? 184 THR A CB 1 ATOM 1451 O OG1 . THR A 1 184 ? -2.489 -8.298 18.453 1.00 42.29 ? 184 THR A OG1 1 ATOM 1452 C CG2 . THR A 1 184 ? -4.320 -9.161 19.582 1.00 42.91 ? 184 THR A CG2 1 ATOM 1453 N N . SER A 1 185 ? 0.028 -10.838 20.213 1.00 44.70 ? 185 SER A N 1 ATOM 1454 C CA . SER A 1 185 ? 1.386 -11.153 19.801 1.00 45.39 ? 185 SER A CA 1 ATOM 1455 C C . SER A 1 185 ? 1.648 -11.018 18.277 1.00 46.85 ? 185 SER A C 1 ATOM 1456 O O . SER A 1 185 ? 2.785 -11.171 17.816 1.00 47.60 ? 185 SER A O 1 ATOM 1457 C CB . SER A 1 185 ? 1.703 -12.559 20.245 1.00 44.58 ? 185 SER A CB 1 ATOM 1458 O OG . SER A 1 185 ? 2.023 -12.628 21.627 1.00 42.36 ? 185 SER A OG 1 ATOM 1459 N N . PHE A 1 186 ? 0.609 -10.716 17.515 1.00 47.79 ? 186 PHE A N 1 ATOM 1460 C CA . PHE A 1 186 ? 0.717 -10.563 16.063 1.00 48.88 ? 186 PHE A CA 1 ATOM 1461 C C . PHE A 1 186 ? 0.938 -9.130 15.643 1.00 48.95 ? 186 PHE A C 1 ATOM 1462 O O . PHE A 1 186 ? 0.400 -8.229 16.285 1.00 49.23 ? 186 PHE A O 1 ATOM 1463 C CB . PHE A 1 186 ? -0.555 -11.066 15.407 1.00 48.96 ? 186 PHE A CB 1 ATOM 1464 C CG . PHE A 1 186 ? -0.826 -12.513 15.692 1.00 52.89 ? 186 PHE A CG 1 ATOM 1465 C CD1 . PHE A 1 186 ? -0.124 -13.498 15.023 1.00 52.21 ? 186 PHE A CD1 1 ATOM 1466 C CD2 . PHE A 1 186 ? -1.759 -12.892 16.667 1.00 55.49 ? 186 PHE A CD2 1 ATOM 1467 C CE1 . PHE A 1 186 ? -0.355 -14.844 15.301 1.00 55.58 ? 186 PHE A CE1 1 ATOM 1468 C CE2 . PHE A 1 186 ? -1.983 -14.237 16.965 1.00 54.20 ? 186 PHE A CE2 1 ATOM 1469 C CZ . PHE A 1 186 ? -1.271 -15.211 16.283 1.00 54.65 ? 186 PHE A CZ 1 ATOM 1470 N N . LEU A 1 187 ? 1.781 -8.921 14.617 1.00 48.84 ? 187 LEU A N 1 ATOM 1471 C CA . LEU A 1 187 ? 1.958 -7.612 14.020 1.00 48.85 ? 187 LEU A CA 1 ATOM 1472 C C . LEU A 1 187 ? 0.701 -7.444 13.227 1.00 49.72 ? 187 LEU A C 1 ATOM 1473 O O . LEU A 1 187 ? 0.665 -7.719 12.011 1.00 50.45 ? 187 LEU A O 1 ATOM 1474 C CB . LEU A 1 187 ? 3.131 -7.569 13.062 1.00 47.54 ? 187 LEU A CB 1 ATOM 1475 C CG . LEU A 1 187 ? 4.377 -6.841 13.509 1.00 48.97 ? 187 LEU A CG 1 ATOM 1476 C CD1 . LEU A 1 187 ? 5.327 -6.596 12.314 1.00 45.54 ? 187 LEU A CD1 1 ATOM 1477 C CD2 . LEU A 1 187 ? 4.080 -5.529 14.319 1.00 41.32 ? 187 LEU A CD2 1 ATOM 1478 N N . ASP A 1 188 ? -0.338 -7.000 13.903 1.00 50.30 ? 188 ASP A N 1 ATOM 1479 C CA . ASP A 1 188 ? -1.664 -6.932 13.289 1.00 51.14 ? 188 ASP A CA 1 ATOM 1480 C C . ASP A 1 188 ? -2.305 -5.569 13.472 1.00 51.17 ? 188 ASP A C 1 ATOM 1481 O O . ASP A 1 188 ? -3.495 -5.421 13.282 1.00 51.63 ? 188 ASP A O 1 ATOM 1482 C CB . ASP A 1 188 ? -2.536 -7.954 13.967 1.00 51.12 ? 188 ASP A CB 1 ATOM 1483 C CG . ASP A 1 188 ? -2.632 -7.724 15.489 1.00 52.61 ? 188 ASP A CG 1 ATOM 1484 O OD1 . ASP A 1 188 ? -1.978 -6.806 16.070 1.00 53.27 ? 188 ASP A OD1 1 ATOM 1485 O OD2 . ASP A 1 188 ? -3.357 -8.424 16.192 1.00 56.36 ? 188 ASP A OD2 1 ATOM 1486 N N . ALA A 1 189 ? -1.527 -4.585 13.888 1.00 51.18 ? 189 ALA A N 1 ATOM 1487 C CA . ALA A 1 189 ? -2.055 -3.229 14.028 1.00 51.84 ? 189 ALA A CA 1 ATOM 1488 C C . ALA A 1 189 ? -2.943 -3.125 15.273 1.00 51.51 ? 189 ALA A C 1 ATOM 1489 O O . ALA A 1 189 ? -3.773 -2.215 15.415 1.00 51.44 ? 189 ALA A O 1 ATOM 1490 C CB . ALA A 1 189 ? -2.859 -2.845 12.786 1.00 50.68 ? 189 ALA A CB 1 ATOM 1491 N N . SER A 1 190 ? -2.781 -4.070 16.164 1.00 50.14 ? 190 SER A N 1 ATOM 1492 C CA . SER A 1 190 ? -3.555 -4.017 17.362 1.00 49.75 ? 190 SER A CA 1 ATOM 1493 C C . SER A 1 190 ? -3.390 -2.658 18.029 1.00 49.87 ? 190 SER A C 1 ATOM 1494 O O . SER A 1 190 ? -4.232 -2.269 18.846 1.00 50.83 ? 190 SER A O 1 ATOM 1495 C CB . SER A 1 190 ? -3.147 -5.145 18.296 1.00 49.47 ? 190 SER A CB 1 ATOM 1496 O OG . SER A 1 190 ? -1.746 -5.041 18.634 1.00 53.44 ? 190 SER A OG 1 ATOM 1497 N N . LEU A 1 191 ? -2.337 -1.917 17.696 1.00 48.80 ? 191 LEU A N 1 ATOM 1498 C CA . LEU A 1 191 ? -2.158 -0.610 18.326 1.00 48.80 ? 191 LEU A CA 1 ATOM 1499 C C . LEU A 1 191 ? -3.127 0.434 17.774 1.00 48.32 ? 191 LEU A C 1 ATOM 1500 O O . LEU A 1 191 ? -3.419 1.444 18.428 1.00 46.50 ? 191 LEU A O 1 ATOM 1501 C CB . LEU A 1 191 ? -0.690 -0.121 18.283 1.00 48.83 ? 191 LEU A CB 1 ATOM 1502 C CG . LEU A 1 191 ? -0.202 0.602 17.027 1.00 51.00 ? 191 LEU A CG 1 ATOM 1503 C CD1 . LEU A 1 191 ? 1.182 1.290 17.235 1.00 50.40 ? 191 LEU A CD1 1 ATOM 1504 C CD2 . LEU A 1 191 ? -0.146 -0.387 15.890 1.00 49.38 ? 191 LEU A CD2 1 ATOM 1505 N N . VAL A 1 192 ? -3.647 0.155 16.583 1.00 49.00 ? 192 VAL A N 1 ATOM 1506 C CA . VAL A 1 192 ? -4.593 1.027 15.917 1.00 49.39 ? 192 VAL A CA 1 ATOM 1507 C C . VAL A 1 192 ? -6.043 0.605 16.146 1.00 49.82 ? 192 VAL A C 1 ATOM 1508 O O . VAL A 1 192 ? -6.918 1.433 16.177 1.00 50.42 ? 192 VAL A O 1 ATOM 1509 C CB . VAL A 1 192 ? -4.384 1.001 14.396 1.00 50.27 ? 192 VAL A CB 1 ATOM 1510 C CG1 . VAL A 1 192 ? -5.560 1.629 13.707 1.00 50.76 ? 192 VAL A CG1 1 ATOM 1511 C CG2 . VAL A 1 192 ? -3.041 1.688 13.989 1.00 48.78 ? 192 VAL A CG2 1 ATOM 1512 N N . TYR A 1 193 ? -6.302 -0.679 16.296 1.00 50.80 ? 193 TYR A N 1 ATOM 1513 C CA . TYR A 1 193 ? -7.676 -1.160 16.451 1.00 51.10 ? 193 TYR A CA 1 ATOM 1514 C C . TYR A 1 193 ? -7.981 -1.700 17.854 1.00 50.90 ? 193 TYR A C 1 ATOM 1515 O O . TYR A 1 193 ? -9.139 -1.928 18.174 1.00 51.44 ? 193 TYR A O 1 ATOM 1516 C CB . TYR A 1 193 ? -8.046 -2.195 15.370 1.00 51.20 ? 193 TYR A CB 1 ATOM 1517 C CG . TYR A 1 193 ? -7.705 -1.710 14.002 1.00 51.69 ? 193 TYR A CG 1 ATOM 1518 C CD1 . TYR A 1 193 ? -8.376 -0.647 13.446 1.00 53.36 ? 193 TYR A CD1 1 ATOM 1519 C CD2 . TYR A 1 193 ? -6.670 -2.283 13.277 1.00 53.16 ? 193 TYR A CD2 1 ATOM 1520 C CE1 . TYR A 1 193 ? -8.008 -0.159 12.193 1.00 54.99 ? 193 TYR A CE1 1 ATOM 1521 C CE2 . TYR A 1 193 ? -6.317 -1.826 12.023 1.00 51.16 ? 193 TYR A CE2 1 ATOM 1522 C CZ . TYR A 1 193 ? -6.973 -0.758 11.500 1.00 55.06 ? 193 TYR A CZ 1 ATOM 1523 O OH . TYR A 1 193 ? -6.623 -0.295 10.251 1.00 58.27 ? 193 TYR A OH 1 ATOM 1524 N N . GLY A 1 194 ? -6.954 -1.903 18.673 1.00 50.16 ? 194 GLY A N 1 ATOM 1525 C CA . GLY A 1 194 ? -7.157 -2.378 20.033 1.00 49.01 ? 194 GLY A CA 1 ATOM 1526 C C . GLY A 1 194 ? -7.089 -3.874 20.105 1.00 48.15 ? 194 GLY A C 1 ATOM 1527 O O . GLY A 1 194 ? -7.082 -4.516 19.100 1.00 48.13 ? 194 GLY A O 1 ATOM 1528 N N . SER A 1 195 ? -7.020 -4.430 21.300 1.00 48.79 ? 195 SER A N 1 ATOM 1529 C CA . SER A 1 195 ? -6.963 -5.876 21.454 1.00 49.42 ? 195 SER A CA 1 ATOM 1530 C C . SER A 1 195 ? -8.097 -6.453 22.308 1.00 50.88 ? 195 SER A C 1 ATOM 1531 O O . SER A 1 195 ? -8.035 -7.613 22.732 1.00 52.30 ? 195 SER A O 1 ATOM 1532 C CB . SER A 1 195 ? -5.588 -6.311 21.961 1.00 49.08 ? 195 SER A CB 1 ATOM 1533 O OG . SER A 1 195 ? -4.571 -5.888 21.064 1.00 47.54 ? 195 SER A OG 1 ATOM 1534 N N . GLU A 1 196 ? -9.123 -5.642 22.558 1.00 52.01 ? 196 GLU A N 1 ATOM 1535 C CA . GLU A 1 196 ? -10.345 -6.103 23.208 1.00 53.75 ? 196 GLU A CA 1 ATOM 1536 C C . GLU A 1 196 ? -11.562 -5.654 22.368 1.00 54.30 ? 196 GLU A C 1 ATOM 1537 O O . GLU A 1 196 ? -11.532 -4.587 21.741 1.00 54.62 ? 196 GLU A O 1 ATOM 1538 C CB . GLU A 1 196 ? -10.452 -5.563 24.637 1.00 54.52 ? 196 GLU A CB 1 ATOM 1539 C CG . GLU A 1 196 ? -9.265 -5.875 25.556 1.00 55.78 ? 196 GLU A CG 1 ATOM 1540 C CD . GLU A 1 196 ? -9.016 -4.758 26.583 1.00 59.81 ? 196 GLU A CD 1 ATOM 1541 O OE1 . GLU A 1 196 ? -9.203 -3.549 26.248 1.00 61.61 ? 196 GLU A OE1 1 ATOM 1542 O OE2 . GLU A 1 196 ? -8.616 -5.061 27.730 1.00 61.64 ? 196 GLU A OE2 1 ATOM 1543 N N . PRO A 1 197 ? -12.613 -6.478 22.336 1.00 54.77 ? 197 PRO A N 1 ATOM 1544 C CA . PRO A 1 197 ? -13.856 -6.185 21.588 1.00 55.25 ? 197 PRO A CA 1 ATOM 1545 C C . PRO A 1 197 ? -14.360 -4.812 21.982 1.00 54.87 ? 197 PRO A C 1 ATOM 1546 O O . PRO A 1 197 ? -14.723 -3.895 21.265 1.00 53.71 ? 197 PRO A O 1 ATOM 1547 C CB . PRO A 1 197 ? -14.857 -7.223 22.161 1.00 55.59 ? 197 PRO A CB 1 ATOM 1548 C CG . PRO A 1 197 ? -13.969 -8.363 22.761 1.00 55.54 ? 197 PRO A CG 1 ATOM 1549 C CD . PRO A 1 197 ? -12.660 -7.768 23.045 1.00 54.97 ? 197 PRO A CD 1 HETATM 1550 N N . SEP A 1 198 ? -14.378 -4.748 23.279 1.00 55.06 ? 198 SEP A N 1 HETATM 1551 C CA . SEP A 1 198 ? -14.705 -3.622 24.036 1.00 55.38 ? 198 SEP A CA 1 HETATM 1552 C CB . SEP A 1 198 ? -14.169 -4.047 25.408 1.00 55.36 ? 198 SEP A CB 1 HETATM 1553 O OG . SEP A 1 198 ? -14.400 -5.519 25.466 1.00 55.67 ? 198 SEP A OG 1 HETATM 1554 C C . SEP A 1 198 ? -14.070 -2.382 23.330 1.00 57.26 ? 198 SEP A C 1 HETATM 1555 O O . SEP A 1 198 ? -14.786 -1.549 22.719 1.00 56.80 ? 198 SEP A O 1 HETATM 1556 P P . SEP A 1 198 ? -13.794 -6.526 26.577 1.00 43.62 ? 198 SEP A P 1 HETATM 1557 O O1P . SEP A 1 198 ? -14.186 -8.027 26.675 1.00 54.11 ? 198 SEP A O1P 1 HETATM 1558 O O2P . SEP A 1 198 ? -13.681 -5.990 28.068 1.00 50.62 ? 198 SEP A O2P 1 HETATM 1559 O O3P . SEP A 1 198 ? -12.316 -6.724 26.048 1.00 61.38 ? 198 SEP A O3P 1 ATOM 1560 N N . LEU A 1 199 ? -12.771 -2.201 23.419 1.00 57.24 ? 199 LEU A N 1 ATOM 1561 C CA . LEU A 1 199 ? -12.175 -1.023 22.848 1.00 57.53 ? 199 LEU A CA 1 ATOM 1562 C C . LEU A 1 199 ? -12.179 -0.967 21.324 1.00 58.04 ? 199 LEU A C 1 ATOM 1563 O O . LEU A 1 199 ? -12.112 0.119 20.755 1.00 57.54 ? 199 LEU A O 1 ATOM 1564 C CB . LEU A 1 199 ? -10.737 -0.873 23.392 1.00 57.81 ? 199 LEU A CB 1 ATOM 1565 C CG . LEU A 1 199 ? -9.696 -0.105 22.549 1.00 57.58 ? 199 LEU A CG 1 ATOM 1566 C CD1 . LEU A 1 199 ? -9.989 1.401 22.558 1.00 59.08 ? 199 LEU A CD1 1 ATOM 1567 C CD2 . LEU A 1 199 ? -8.301 -0.376 23.086 1.00 55.77 ? 199 LEU A CD2 1 ATOM 1568 N N . ALA A 1 200 ? -12.240 -2.103 20.626 1.00 58.44 ? 200 ALA A N 1 ATOM 1569 C CA . ALA A 1 200 ? -12.304 -2.040 19.160 1.00 58.95 ? 200 ALA A CA 1 ATOM 1570 C C . ALA A 1 200 ? -13.548 -1.241 18.776 1.00 59.76 ? 200 ALA A C 1 ATOM 1571 O O . ALA A 1 200 ? -13.524 -0.322 17.962 1.00 60.13 ? 200 ALA A O 1 ATOM 1572 C CB . ALA A 1 200 ? -12.348 -3.421 18.525 1.00 58.41 ? 200 ALA A CB 1 ATOM 1573 N N . SER A 1 201 ? -14.644 -1.650 19.427 1.00 60.20 ? 201 SER A N 1 ATOM 1574 C CA . SER A 1 201 ? -15.929 -1.003 19.154 1.00 61.91 ? 201 SER A CA 1 ATOM 1575 C C . SER A 1 201 ? -15.889 0.505 19.390 1.00 61.69 ? 201 SER A C 1 ATOM 1576 O O . SER A 1 201 ? -16.199 1.300 18.496 1.00 61.29 ? 201 SER A O 1 ATOM 1577 C CB . SER A 1 201 ? -17.037 -1.664 19.966 1.00 62.19 ? 201 SER A CB 1 ATOM 1578 O OG . SER A 1 201 ? -18.240 -1.748 19.208 1.00 64.16 ? 201 SER A OG 1 ATOM 1579 N N . ARG A 1 202 ? -15.509 0.926 20.579 1.00 62.26 ? 202 ARG A N 1 ATOM 1580 C CA . ARG A 1 202 ? -15.471 2.347 20.885 1.00 63.65 ? 202 ARG A CA 1 ATOM 1581 C C . ARG A 1 202 ? -14.641 3.155 19.888 1.00 65.04 ? 202 ARG A C 1 ATOM 1582 O O . ARG A 1 202 ? -14.862 4.352 19.710 1.00 65.56 ? 202 ARG A O 1 ATOM 1583 C CB . ARG A 1 202 ? -14.886 2.582 22.274 1.00 63.62 ? 202 ARG A CB 1 ATOM 1584 C CG . ARG A 1 202 ? -15.676 3.537 23.104 1.00 64.40 ? 202 ARG A CG 1 ATOM 1585 C CD . ARG A 1 202 ? -14.849 4.558 23.866 1.00 67.37 ? 202 ARG A CD 1 ATOM 1586 N NE . ARG A 1 202 ? -13.997 3.933 24.851 1.00 66.68 ? 202 ARG A NE 1 ATOM 1587 C CZ . ARG A 1 202 ? -13.297 4.593 25.753 1.00 67.48 ? 202 ARG A CZ 1 ATOM 1588 N NH1 . ARG A 1 202 ? -13.344 5.922 25.800 1.00 67.55 ? 202 ARG A NH1 1 ATOM 1589 N NH2 . ARG A 1 202 ? -12.543 3.915 26.611 1.00 67.43 ? 202 ARG A NH2 1 ATOM 1590 N N . LEU A 1 203 ? -13.686 2.497 19.246 1.00 66.21 ? 203 LEU A N 1 ATOM 1591 C CA . LEU A 1 203 ? -12.807 3.153 18.290 1.00 67.33 ? 203 LEU A CA 1 ATOM 1592 C C . LEU A 1 203 ? -13.488 3.360 16.966 1.00 68.24 ? 203 LEU A C 1 ATOM 1593 O O . LEU A 1 203 ? -13.111 4.228 16.198 1.00 68.11 ? 203 LEU A O 1 ATOM 1594 C CB . LEU A 1 203 ? -11.561 2.297 18.063 1.00 66.74 ? 203 LEU A CB 1 ATOM 1595 C CG . LEU A 1 203 ? -10.457 2.529 19.082 1.00 67.64 ? 203 LEU A CG 1 ATOM 1596 C CD1 . LEU A 1 203 ? -11.000 3.247 20.272 1.00 66.98 ? 203 LEU A CD1 1 ATOM 1597 C CD2 . LEU A 1 203 ? -9.799 1.233 19.490 1.00 69.17 ? 203 LEU A CD2 1 ATOM 1598 N N . ARG A 1 204 ? -14.493 2.542 16.695 1.00 70.01 ? 204 ARG A N 1 ATOM 1599 C CA . ARG A 1 204 ? -15.136 2.546 15.389 1.00 71.66 ? 204 ARG A CA 1 ATOM 1600 C C . ARG A 1 204 ? -16.203 3.642 15.148 1.00 72.82 ? 204 ARG A C 1 ATOM 1601 O O . ARG A 1 204 ? -16.747 4.196 16.097 1.00 72.35 ? 204 ARG A O 1 ATOM 1602 C CB . ARG A 1 204 ? -15.709 1.154 15.099 1.00 71.52 ? 204 ARG A CB 1 ATOM 1603 C CG . ARG A 1 204 ? -14.657 0.151 14.629 1.00 72.03 ? 204 ARG A CG 1 ATOM 1604 C CD . ARG A 1 204 ? -15.192 -1.178 14.073 1.00 68.14 ? 204 ARG A CD 1 ATOM 1605 N NE . ARG A 1 204 ? -15.901 -1.005 12.810 1.00 66.04 ? 204 ARG A NE 1 ATOM 1606 C CZ . ARG A 1 204 ? -16.695 -1.924 12.283 1.00 64.16 ? 204 ARG A CZ 1 ATOM 1607 N NH1 . ARG A 1 204 ? -16.878 -3.084 12.895 1.00 62.69 ? 204 ARG A NH1 1 ATOM 1608 N NH2 . ARG A 1 204 ? -17.321 -1.690 11.148 1.00 66.10 ? 204 ARG A NH2 1 ATOM 1609 N N . ASN A 1 205 ? -16.444 3.975 13.875 1.00 74.44 ? 205 ASN A N 1 ATOM 1610 C CA . ASN A 1 205 ? -17.555 4.859 13.504 1.00 76.54 ? 205 ASN A CA 1 ATOM 1611 C C . ASN A 1 205 ? -18.710 3.984 13.049 1.00 77.05 ? 205 ASN A C 1 ATOM 1612 O O . ASN A 1 205 ? -18.760 3.507 11.902 1.00 76.55 ? 205 ASN A O 1 ATOM 1613 C CB . ASN A 1 205 ? -17.188 5.886 12.411 1.00 76.73 ? 205 ASN A CB 1 ATOM 1614 C CG . ASN A 1 205 ? -18.253 7.011 12.260 1.00 79.01 ? 205 ASN A CG 1 ATOM 1615 O OD1 . ASN A 1 205 ? -19.326 6.949 12.854 1.00 78.60 ? 205 ASN A OD1 1 ATOM 1616 N ND2 . ASN A 1 205 ? -17.924 8.046 11.467 1.00 82.06 ? 205 ASN A ND2 1 ATOM 1617 N N . LEU A 1 206 ? -19.618 3.736 13.977 1.00 78.42 ? 206 LEU A N 1 ATOM 1618 C CA . LEU A 1 206 ? -20.788 2.929 13.668 1.00 80.33 ? 206 LEU A CA 1 ATOM 1619 C C . LEU A 1 206 ? -21.993 3.840 13.467 1.00 80.33 ? 206 LEU A C 1 ATOM 1620 O O . LEU A 1 206 ? -23.127 3.401 13.568 1.00 80.90 ? 206 LEU A O 1 ATOM 1621 C CB . LEU A 1 206 ? -21.070 1.944 14.804 1.00 80.99 ? 206 LEU A CB 1 ATOM 1622 C CG . LEU A 1 206 ? -19.866 1.503 15.641 1.00 82.73 ? 206 LEU A CG 1 ATOM 1623 C CD1 . LEU A 1 206 ? -20.251 1.333 17.095 1.00 85.12 ? 206 LEU A CD1 1 ATOM 1624 C CD2 . LEU A 1 206 ? -19.285 0.234 15.105 1.00 84.94 ? 206 LEU A CD2 1 ATOM 1625 N N . SER A 1 207 ? -21.735 5.116 13.221 1.00 80.55 ? 207 SER A N 1 ATOM 1626 C CA . SER A 1 207 ? -22.788 6.077 12.981 1.00 80.57 ? 207 SER A CA 1 ATOM 1627 C C . SER A 1 207 ? -22.958 6.177 11.475 1.00 80.65 ? 207 SER A C 1 ATOM 1628 O O . SER A 1 207 ? -23.940 6.701 10.955 1.00 81.29 ? 207 SER A O 1 ATOM 1629 C CB . SER A 1 207 ? -22.398 7.427 13.575 1.00 81.02 ? 207 SER A CB 1 ATOM 1630 O OG . SER A 1 207 ? -22.116 7.303 14.961 1.00 80.16 ? 207 SER A OG 1 ATOM 1631 N N . SER A 1 208 ? -21.979 5.651 10.772 1.00 80.26 ? 208 SER A N 1 ATOM 1632 C CA . SER A 1 208 ? -21.978 5.691 9.333 1.00 80.02 ? 208 SER A CA 1 ATOM 1633 C C . SER A 1 208 ? -21.601 4.287 8.832 1.00 79.58 ? 208 SER A C 1 ATOM 1634 O O . SER A 1 208 ? -20.983 3.529 9.549 1.00 79.20 ? 208 SER A O 1 ATOM 1635 C CB . SER A 1 208 ? -21.004 6.788 8.858 1.00 80.25 ? 208 SER A CB 1 ATOM 1636 O OG . SER A 1 208 ? -20.102 6.327 7.855 1.00 80.45 ? 208 SER A OG 1 ATOM 1637 N N . PRO A 1 209 ? -22.030 3.921 7.627 1.00 79.34 ? 209 PRO A N 1 ATOM 1638 C CA . PRO A 1 209 ? -21.711 2.614 7.064 1.00 78.53 ? 209 PRO A CA 1 ATOM 1639 C C . PRO A 1 209 ? -20.457 2.640 6.212 1.00 77.77 ? 209 PRO A C 1 ATOM 1640 O O . PRO A 1 209 ? -20.327 1.797 5.320 1.00 77.91 ? 209 PRO A O 1 ATOM 1641 C CB . PRO A 1 209 ? -22.911 2.367 6.157 1.00 78.50 ? 209 PRO A CB 1 ATOM 1642 C CG . PRO A 1 209 ? -23.156 3.687 5.597 1.00 78.81 ? 209 PRO A CG 1 ATOM 1643 C CD . PRO A 1 209 ? -22.891 4.694 6.712 1.00 78.96 ? 209 PRO A CD 1 ATOM 1644 N N . LEU A 1 210 ? -19.540 3.565 6.467 1.00 76.46 ? 210 LEU A N 1 ATOM 1645 C CA . LEU A 1 210 ? -18.351 3.629 5.635 1.00 75.32 ? 210 LEU A CA 1 ATOM 1646 C C . LEU A 1 210 ? -17.161 2.858 6.190 1.00 74.80 ? 210 LEU A C 1 ATOM 1647 O O . LEU A 1 210 ? -16.108 2.773 5.550 1.00 75.14 ? 210 LEU A O 1 ATOM 1648 C CB . LEU A 1 210 ? -18.001 5.076 5.328 1.00 75.68 ? 210 LEU A CB 1 ATOM 1649 C CG . LEU A 1 210 ? -19.249 5.797 4.803 1.00 76.13 ? 210 LEU A CG 1 ATOM 1650 C CD1 . LEU A 1 210 ? -19.144 7.286 5.072 1.00 78.13 ? 210 LEU A CD1 1 ATOM 1651 C CD2 . LEU A 1 210 ? -19.481 5.505 3.317 1.00 76.90 ? 210 LEU A CD2 1 ATOM 1652 N N . GLY A 1 211 ? -17.317 2.286 7.376 1.00 73.75 ? 211 GLY A N 1 ATOM 1653 C CA . GLY A 1 211 ? -16.244 1.491 7.939 1.00 72.30 ? 211 GLY A CA 1 ATOM 1654 C C . GLY A 1 211 ? -15.089 2.330 8.431 1.00 71.06 ? 211 GLY A C 1 ATOM 1655 O O . GLY A 1 211 ? -13.965 1.868 8.520 1.00 70.75 ? 211 GLY A O 1 ATOM 1656 N N . LEU A 1 212 ? -15.378 3.578 8.763 1.00 70.42 ? 212 LEU A N 1 ATOM 1657 C CA . LEU A 1 212 ? -14.361 4.494 9.251 1.00 68.90 ? 212 LEU A CA 1 ATOM 1658 C C . LEU A 1 212 ? -14.103 4.268 10.729 1.00 67.91 ? 212 LEU A C 1 ATOM 1659 O O . LEU A 1 212 ? -14.899 3.628 11.414 1.00 66.05 ? 212 LEU A O 1 ATOM 1660 C CB . LEU A 1 212 ? -14.818 5.931 9.028 1.00 69.30 ? 212 LEU A CB 1 ATOM 1661 C CG . LEU A 1 212 ? -15.168 6.209 7.564 1.00 71.56 ? 212 LEU A CG 1 ATOM 1662 C CD1 . LEU A 1 212 ? -15.919 7.555 7.400 1.00 74.25 ? 212 LEU A CD1 1 ATOM 1663 C CD2 . LEU A 1 212 ? -13.899 6.181 6.741 1.00 70.21 ? 212 LEU A CD2 1 ATOM 1664 N N . MET A 1 213 ? -12.968 4.791 11.207 1.00 67.43 ? 213 MET A N 1 ATOM 1665 C CA . MET A 1 213 ? -12.609 4.720 12.614 1.00 67.05 ? 213 MET A CA 1 ATOM 1666 C C . MET A 1 213 ? -13.098 6.020 13.190 1.00 66.74 ? 213 MET A C 1 ATOM 1667 O O . MET A 1 213 ? -13.103 7.016 12.498 1.00 66.60 ? 213 MET A O 1 ATOM 1668 C CB . MET A 1 213 ? -11.083 4.631 12.774 1.00 67.65 ? 213 MET A CB 1 ATOM 1669 C CG . MET A 1 213 ? -10.462 3.233 12.585 1.00 67.40 ? 213 MET A CG 1 ATOM 1670 S SD . MET A 1 213 ? -10.594 2.276 14.134 1.00 67.53 ? 213 MET A SD 1 ATOM 1671 C CE . MET A 1 213 ? -11.919 1.320 13.782 1.00 67.30 ? 213 MET A CE 1 ATOM 1672 N N . ALA A 1 214 ? -13.525 6.021 14.442 1.00 66.82 ? 214 ALA A N 1 ATOM 1673 C CA . ALA A 1 214 ? -13.945 7.262 15.083 1.00 66.92 ? 214 ALA A CA 1 ATOM 1674 C C . ALA A 1 214 ? -12.886 8.357 14.988 1.00 67.12 ? 214 ALA A C 1 ATOM 1675 O O . ALA A 1 214 ? -11.705 8.098 15.133 1.00 67.80 ? 214 ALA A O 1 ATOM 1676 C CB . ALA A 1 214 ? -14.270 7.014 16.526 1.00 66.94 ? 214 ALA A CB 1 ATOM 1677 N N . VAL A 1 215 ? -13.297 9.587 14.724 1.00 67.60 ? 215 VAL A N 1 ATOM 1678 C CA . VAL A 1 215 ? -12.348 10.686 14.767 1.00 68.00 ? 215 VAL A CA 1 ATOM 1679 C C . VAL A 1 215 ? -12.832 11.731 15.761 1.00 68.64 ? 215 VAL A C 1 ATOM 1680 O O . VAL A 1 215 ? -13.999 11.784 16.162 1.00 68.91 ? 215 VAL A O 1 ATOM 1681 C CB . VAL A 1 215 ? -12.102 11.343 13.414 1.00 67.92 ? 215 VAL A CB 1 ATOM 1682 C CG1 . VAL A 1 215 ? -11.794 10.300 12.364 1.00 67.99 ? 215 VAL A CG1 1 ATOM 1683 C CG2 . VAL A 1 215 ? -13.293 12.190 13.018 1.00 67.19 ? 215 VAL A CG2 1 ATOM 1684 N N . ASN A 1 216 ? -11.905 12.560 16.175 1.00 69.23 ? 216 ASN A N 1 ATOM 1685 C CA . ASN A 1 216 ? -12.208 13.606 17.115 1.00 69.74 ? 216 ASN A CA 1 ATOM 1686 C C . ASN A 1 216 ? -13.026 14.716 16.422 1.00 69.97 ? 216 ASN A C 1 ATOM 1687 O O . ASN A 1 216 ? -12.672 15.223 15.390 1.00 69.75 ? 216 ASN A O 1 ATOM 1688 C CB . ASN A 1 216 ? -10.868 14.090 17.629 1.00 69.55 ? 216 ASN A CB 1 ATOM 1689 C CG . ASN A 1 216 ? -10.969 15.137 18.682 1.00 69.11 ? 216 ASN A CG 1 ATOM 1690 O OD1 . ASN A 1 216 ? -11.836 16.015 18.645 1.00 67.57 ? 216 ASN A OD1 1 ATOM 1691 N ND2 . ASN A 1 216 ? -10.033 15.087 19.614 1.00 67.68 ? 216 ASN A ND2 1 ATOM 1692 N N . GLN A 1 217 ? -14.157 15.083 16.962 1.00 71.56 ? 217 GLN A N 1 ATOM 1693 C CA . GLN A 1 217 ? -14.890 16.139 16.296 1.00 73.37 ? 217 GLN A CA 1 ATOM 1694 C C . GLN A 1 217 ? -14.748 17.418 17.107 1.00 73.86 ? 217 GLN A C 1 ATOM 1695 O O . GLN A 1 217 ? -15.378 18.437 16.807 1.00 74.21 ? 217 GLN A O 1 ATOM 1696 C CB . GLN A 1 217 ? -16.349 15.742 16.042 1.00 73.51 ? 217 GLN A CB 1 ATOM 1697 C CG . GLN A 1 217 ? -16.523 14.708 14.922 1.00 74.87 ? 217 GLN A CG 1 ATOM 1698 C CD . GLN A 1 217 ? -16.308 15.289 13.512 1.00 77.15 ? 217 GLN A CD 1 ATOM 1699 O OE1 . GLN A 1 217 ? -16.364 16.518 13.302 1.00 75.48 ? 217 GLN A OE1 1 ATOM 1700 N NE2 . GLN A 1 217 ? -16.059 14.401 12.543 1.00 78.51 ? 217 GLN A NE2 1 ATOM 1701 N N . GLU A 1 218 ? -13.866 17.349 18.102 1.00 74.27 ? 218 GLU A N 1 ATOM 1702 C CA . GLU A 1 218 ? -13.566 18.466 18.973 1.00 74.95 ? 218 GLU A CA 1 ATOM 1703 C C . GLU A 1 218 ? -12.463 19.356 18.393 1.00 75.21 ? 218 GLU A C 1 ATOM 1704 O O . GLU A 1 218 ? -12.385 20.527 18.747 1.00 75.52 ? 218 GLU A O 1 ATOM 1705 C CB . GLU A 1 218 ? -13.110 17.936 20.320 1.00 75.19 ? 218 GLU A CB 1 ATOM 1706 C CG . GLU A 1 218 ? -13.702 18.627 21.531 1.00 78.42 ? 218 GLU A CG 1 ATOM 1707 C CD . GLU A 1 218 ? -14.690 17.746 22.281 1.00 81.84 ? 218 GLU A CD 1 ATOM 1708 O OE1 . GLU A 1 218 ? -14.567 17.655 23.521 1.00 84.82 ? 218 GLU A OE1 1 ATOM 1709 O OE2 . GLU A 1 218 ? -15.585 17.137 21.650 1.00 82.07 ? 218 GLU A OE2 1 ATOM 1710 N N . ALA A 1 219 ? -11.608 18.814 17.517 1.00 75.38 ? 219 ALA A N 1 ATOM 1711 C CA . ALA A 1 219 ? -10.490 19.589 16.938 1.00 75.33 ? 219 ALA A CA 1 ATOM 1712 C C . ALA A 1 219 ? -9.924 18.975 15.664 1.00 75.22 ? 219 ALA A C 1 ATOM 1713 O O . ALA A 1 219 ? -9.969 17.760 15.506 1.00 75.76 ? 219 ALA A O 1 ATOM 1714 C CB . ALA A 1 219 ? -9.395 19.768 17.945 1.00 75.55 ? 219 ALA A CB 1 ATOM 1715 N N . TRP A 1 220 ? -9.372 19.803 14.772 1.00 75.26 ? 220 TRP A N 1 ATOM 1716 C CA . TRP A 1 220 ? -8.913 19.328 13.447 1.00 75.57 ? 220 TRP A CA 1 ATOM 1717 C C . TRP A 1 220 ? -7.517 19.780 12.964 1.00 74.71 ? 220 TRP A C 1 ATOM 1718 O O . TRP A 1 220 ? -7.027 20.841 13.329 1.00 74.86 ? 220 TRP A O 1 ATOM 1719 C CB . TRP A 1 220 ? -9.951 19.670 12.370 1.00 76.17 ? 220 TRP A CB 1 ATOM 1720 C CG . TRP A 1 220 ? -11.093 18.731 12.333 1.00 78.72 ? 220 TRP A CG 1 ATOM 1721 C CD1 . TRP A 1 220 ? -12.158 18.691 13.195 1.00 81.50 ? 220 TRP A CD1 1 ATOM 1722 C CD2 . TRP A 1 220 ? -11.301 17.667 11.394 1.00 82.16 ? 220 TRP A CD2 1 ATOM 1723 N NE1 . TRP A 1 220 ? -13.013 17.671 12.846 1.00 81.80 ? 220 TRP A NE1 1 ATOM 1724 C CE2 . TRP A 1 220 ? -12.512 17.029 11.741 1.00 83.11 ? 220 TRP A CE2 1 ATOM 1725 C CE3 . TRP A 1 220 ? -10.591 17.190 10.281 1.00 83.73 ? 220 TRP A CE3 1 ATOM 1726 C CZ2 . TRP A 1 220 ? -13.019 15.938 11.019 1.00 84.57 ? 220 TRP A CZ2 1 ATOM 1727 C CZ3 . TRP A 1 220 ? -11.105 16.115 9.560 1.00 84.48 ? 220 TRP A CZ3 1 ATOM 1728 C CH2 . TRP A 1 220 ? -12.305 15.502 9.934 1.00 84.67 ? 220 TRP A CH2 1 ATOM 1729 N N . ASP A 1 221 ? -6.889 18.968 12.118 1.00 73.45 ? 221 ASP A N 1 ATOM 1730 C CA . ASP A 1 221 ? -5.552 19.284 11.609 1.00 71.89 ? 221 ASP A CA 1 ATOM 1731 C C . ASP A 1 221 ? -5.694 19.643 10.152 1.00 70.80 ? 221 ASP A C 1 ATOM 1732 O O . ASP A 1 221 ? -5.454 18.809 9.293 1.00 70.24 ? 221 ASP A O 1 ATOM 1733 C CB . ASP A 1 221 ? -4.604 18.063 11.792 1.00 71.62 ? 221 ASP A CB 1 ATOM 1734 C CG . ASP A 1 221 ? -3.125 18.408 11.607 1.00 69.14 ? 221 ASP A CG 1 ATOM 1735 O OD1 . ASP A 1 221 ? -2.769 19.575 11.471 1.00 68.65 ? 221 ASP A OD1 1 ATOM 1736 O OD2 . ASP A 1 221 ? -2.228 17.570 11.556 1.00 68.32 ? 221 ASP A OD2 1 ATOM 1737 N N . HIS A 1 222 ? -6.078 20.885 9.892 1.00 71.08 ? 222 HIS A N 1 ATOM 1738 C CA . HIS A 1 222 ? -6.305 21.423 8.533 1.00 70.74 ? 222 HIS A CA 1 ATOM 1739 C C . HIS A 1 222 ? -7.156 20.538 7.694 1.00 71.06 ? 222 HIS A C 1 ATOM 1740 O O . HIS A 1 222 ? -6.781 20.208 6.567 1.00 71.43 ? 222 HIS A O 1 ATOM 1741 C CB . HIS A 1 222 ? -5.042 21.558 7.708 1.00 70.80 ? 222 HIS A CB 1 ATOM 1742 C CG . HIS A 1 222 ? -3.919 22.395 8.342 1.00 70.35 ? 222 HIS A CG 1 ATOM 1743 N ND1 . HIS A 1 222 ? -3.908 23.773 8.361 1.00 72.18 ? 222 HIS A ND1 1 ATOM 1744 C CD2 . HIS A 1 222 ? -2.773 21.996 8.944 1.00 71.48 ? 222 HIS A CD2 1 ATOM 1745 C CE1 . HIS A 1 222 ? -2.798 24.190 8.950 1.00 73.78 ? 222 HIS A CE1 1 ATOM 1746 N NE2 . HIS A 1 222 ? -2.095 23.131 9.319 1.00 71.45 ? 222 HIS A NE2 1 ATOM 1747 N N . GLY A 1 223 ? -8.315 20.154 8.210 1.00 70.98 ? 223 GLY A N 1 ATOM 1748 C CA . GLY A 1 223 ? -9.162 19.216 7.507 1.00 70.68 ? 223 GLY A CA 1 ATOM 1749 C C . GLY A 1 223 ? -8.707 17.780 7.757 1.00 70.20 ? 223 GLY A C 1 ATOM 1750 O O . GLY A 1 223 ? -9.378 16.795 7.380 1.00 70.58 ? 223 GLY A O 1 ATOM 1751 N N . LEU A 1 224 ? -7.563 17.626 8.399 1.00 69.02 ? 224 LEU A N 1 ATOM 1752 C CA . LEU A 1 224 ? -7.108 16.269 8.648 1.00 67.97 ? 224 LEU A CA 1 ATOM 1753 C C . LEU A 1 224 ? -7.443 15.815 10.072 1.00 66.59 ? 224 LEU A C 1 ATOM 1754 O O . LEU A 1 224 ? -7.359 16.579 11.030 1.00 66.36 ? 224 LEU A O 1 ATOM 1755 C CB . LEU A 1 224 ? -5.634 16.107 8.291 1.00 68.51 ? 224 LEU A CB 1 ATOM 1756 C CG . LEU A 1 224 ? -5.137 16.515 6.885 1.00 69.42 ? 224 LEU A CG 1 ATOM 1757 C CD1 . LEU A 1 224 ? -3.723 17.018 6.987 1.00 71.30 ? 224 LEU A CD1 1 ATOM 1758 C CD2 . LEU A 1 224 ? -5.175 15.407 5.865 1.00 68.81 ? 224 LEU A CD2 1 ATOM 1759 N N . ALA A 1 225 ? -7.843 14.557 10.178 1.00 65.70 ? 225 ALA A N 1 ATOM 1760 C CA . ALA A 1 225 ? -8.268 13.931 11.428 1.00 64.45 ? 225 ALA A CA 1 ATOM 1761 C C . ALA A 1 225 ? -7.224 13.877 12.521 1.00 63.54 ? 225 ALA A C 1 ATOM 1762 O O . ALA A 1 225 ? -6.013 13.906 12.275 1.00 63.03 ? 225 ALA A O 1 ATOM 1763 C CB . ALA A 1 225 ? -8.785 12.488 11.147 1.00 64.40 ? 225 ALA A CB 1 ATOM 1764 N N . TYR A 1 226 ? -7.742 13.750 13.732 1.00 62.73 ? 226 TYR A N 1 ATOM 1765 C CA . TYR A 1 226 ? -6.985 13.584 14.944 1.00 61.93 ? 226 TYR A CA 1 ATOM 1766 C C . TYR A 1 226 ? -7.579 12.389 15.678 1.00 62.66 ? 226 TYR A C 1 ATOM 1767 O O . TYR A 1 226 ? -8.772 12.135 15.556 1.00 62.92 ? 226 TYR A O 1 ATOM 1768 C CB . TYR A 1 226 ? -7.246 14.763 15.808 1.00 61.26 ? 226 TYR A CB 1 ATOM 1769 C CG . TYR A 1 226 ? -6.351 15.921 15.543 1.00 60.57 ? 226 TYR A CG 1 ATOM 1770 C CD1 . TYR A 1 226 ? -6.858 17.217 15.518 1.00 57.15 ? 226 TYR A CD1 1 ATOM 1771 C CD2 . TYR A 1 226 ? -4.994 15.737 15.346 1.00 57.89 ? 226 TYR A CD2 1 ATOM 1772 C CE1 . TYR A 1 226 ? -6.035 18.299 15.308 1.00 57.69 ? 226 TYR A CE1 1 ATOM 1773 C CE2 . TYR A 1 226 ? -4.161 16.811 15.131 1.00 57.17 ? 226 TYR A CE2 1 ATOM 1774 C CZ . TYR A 1 226 ? -4.689 18.087 15.109 1.00 57.93 ? 226 TYR A CZ 1 ATOM 1775 O OH . TYR A 1 226 ? -3.873 19.160 14.879 1.00 58.61 ? 226 TYR A OH 1 ATOM 1776 N N . LEU A 1 227 ? -6.799 11.667 16.476 1.00 62.68 ? 227 LEU A N 1 ATOM 1777 C CA . LEU A 1 227 ? -7.412 10.563 17.209 1.00 63.11 ? 227 LEU A CA 1 ATOM 1778 C C . LEU A 1 227 ? -8.427 11.202 18.141 1.00 63.33 ? 227 LEU A C 1 ATOM 1779 O O . LEU A 1 227 ? -8.251 12.360 18.494 1.00 63.08 ? 227 LEU A O 1 ATOM 1780 C CB . LEU A 1 227 ? -6.364 9.799 18.022 1.00 62.68 ? 227 LEU A CB 1 ATOM 1781 C CG . LEU A 1 227 ? -5.256 9.074 17.250 1.00 61.99 ? 227 LEU A CG 1 ATOM 1782 C CD1 . LEU A 1 227 ? -3.890 9.446 17.787 1.00 60.46 ? 227 LEU A CD1 1 ATOM 1783 C CD2 . LEU A 1 227 ? -5.487 7.591 17.365 1.00 61.87 ? 227 LEU A CD2 1 ATOM 1784 N N . PRO A 1 228 ? -9.483 10.474 18.525 1.00 63.74 ? 228 PRO A N 1 ATOM 1785 C CA . PRO A 1 228 ? -10.446 10.985 19.509 1.00 64.15 ? 228 PRO A CA 1 ATOM 1786 C C . PRO A 1 228 ? -9.776 11.149 20.855 1.00 64.95 ? 228 PRO A C 1 ATOM 1787 O O . PRO A 1 228 ? -8.793 10.455 21.126 1.00 63.89 ? 228 PRO A O 1 ATOM 1788 C CB . PRO A 1 228 ? -11.494 9.879 19.581 1.00 63.96 ? 228 PRO A CB 1 ATOM 1789 C CG . PRO A 1 228 ? -11.315 9.133 18.265 1.00 63.47 ? 228 PRO A CG 1 ATOM 1790 C CD . PRO A 1 228 ? -9.858 9.138 18.036 1.00 63.50 ? 228 PRO A CD 1 ATOM 1791 N N . PHE A 1 229 ? -10.287 12.069 21.668 1.00 65.82 ? 229 PHE A N 1 ATOM 1792 C CA . PHE A 1 229 ? -9.745 12.280 22.992 1.00 67.67 ? 229 PHE A CA 1 ATOM 1793 C C . PHE A 1 229 ? -10.139 11.106 23.833 1.00 68.77 ? 229 PHE A C 1 ATOM 1794 O O . PHE A 1 229 ? -11.029 10.368 23.473 1.00 68.70 ? 229 PHE A O 1 ATOM 1795 C CB . PHE A 1 229 ? -10.319 13.533 23.631 1.00 67.21 ? 229 PHE A CB 1 ATOM 1796 C CG . PHE A 1 229 ? -9.800 14.786 23.055 1.00 67.28 ? 229 PHE A CG 1 ATOM 1797 C CD1 . PHE A 1 229 ? -8.455 15.056 23.081 1.00 67.14 ? 229 PHE A CD1 1 ATOM 1798 C CD2 . PHE A 1 229 ? -10.660 15.720 22.497 1.00 67.58 ? 229 PHE A CD2 1 ATOM 1799 C CE1 . PHE A 1 229 ? -7.964 16.235 22.549 1.00 67.75 ? 229 PHE A CE1 1 ATOM 1800 C CE2 . PHE A 1 229 ? -10.181 16.918 21.962 1.00 66.47 ? 229 PHE A CE2 1 ATOM 1801 C CZ . PHE A 1 229 ? -8.822 17.167 21.989 1.00 69.39 ? 229 PHE A CZ 1 ATOM 1802 N N . ASN A 1 230 ? -9.453 10.926 24.945 1.00 71.13 ? 230 ASN A N 1 ATOM 1803 C CA . ASN A 1 230 ? -9.797 9.873 25.888 1.00 73.92 ? 230 ASN A CA 1 ATOM 1804 C C . ASN A 1 230 ? -10.889 10.331 26.856 1.00 75.81 ? 230 ASN A C 1 ATOM 1805 O O . ASN A 1 230 ? -11.159 11.523 26.996 1.00 76.42 ? 230 ASN A O 1 ATOM 1806 C CB . ASN A 1 230 ? -8.566 9.323 26.610 1.00 73.65 ? 230 ASN A CB 1 ATOM 1807 C CG . ASN A 1 230 ? -8.791 7.921 27.154 1.00 74.17 ? 230 ASN A CG 1 ATOM 1808 O OD1 . ASN A 1 230 ? -9.902 7.571 27.576 1.00 73.79 ? 230 ASN A OD1 1 ATOM 1809 N ND2 . ASN A 1 230 ? -7.738 7.106 27.140 1.00 74.14 ? 230 ASN A ND2 1 ATOM 1810 N N . ASN A 1 231 ? -11.437 9.379 27.593 1.00 78.06 ? 231 ASN A N 1 ATOM 1811 C CA . ASN A 1 231 ? -12.830 9.511 28.033 1.00 80.35 ? 231 ASN A CA 1 ATOM 1812 C C . ASN A 1 231 ? -12.985 10.032 29.406 1.00 81.31 ? 231 ASN A C 1 ATOM 1813 O O . ASN A 1 231 ? -14.077 10.450 29.850 1.00 81.91 ? 231 ASN A O 1 ATOM 1814 C CB . ASN A 1 231 ? -13.384 8.074 28.052 1.00 80.65 ? 231 ASN A CB 1 ATOM 1815 C CG . ASN A 1 231 ? -14.891 8.015 28.208 1.00 82.07 ? 231 ASN A CG 1 ATOM 1816 O OD1 . ASN A 1 231 ? -15.532 9.041 28.383 1.00 83.12 ? 231 ASN A OD1 1 ATOM 1817 N ND2 . ASN A 1 231 ? -15.469 6.805 28.124 1.00 82.95 ? 231 ASN A ND2 1 ATOM 1818 N N . LYS A 1 232 ? -11.801 10.227 29.927 1.00 81.89 ? 232 LYS A N 1 ATOM 1819 C CA . LYS A 1 232 ? -11.545 9.560 31.166 1.00 82.48 ? 232 LYS A CA 1 ATOM 1820 C C . LYS A 1 232 ? -10.622 10.203 32.135 1.00 82.45 ? 232 LYS A C 1 ATOM 1821 O O . LYS A 1 232 ? -9.498 10.541 31.799 1.00 82.63 ? 232 LYS A O 1 ATOM 1822 C CB . LYS A 1 232 ? -10.859 8.275 30.654 1.00 82.80 ? 232 LYS A CB 1 ATOM 1823 C CG . LYS A 1 232 ? -9.968 7.518 31.595 1.00 83.91 ? 232 LYS A CG 1 ATOM 1824 C CD . LYS A 1 232 ? -9.093 6.504 30.835 1.00 86.87 ? 232 LYS A CD 1 ATOM 1825 C CE . LYS A 1 232 ? -8.327 5.588 31.800 1.00 87.32 ? 232 LYS A CE 1 ATOM 1826 N NZ . LYS A 1 232 ? -9.218 4.539 32.394 1.00 88.60 ? 232 LYS A NZ 1 ATOM 1827 N N . LYS A 1 233 ? -11.119 10.379 33.349 1.00 82.50 ? 233 LYS A N 1 ATOM 1828 C CA . LYS A 1 233 ? -10.280 10.774 34.452 1.00 82.13 ? 233 LYS A CA 1 ATOM 1829 C C . LYS A 1 233 ? -9.602 9.544 35.042 1.00 81.37 ? 233 LYS A C 1 ATOM 1830 O O . LYS A 1 233 ? -9.888 8.370 34.668 1.00 82.03 ? 233 LYS A O 1 ATOM 1831 C CB . LYS A 1 233 ? -11.155 11.354 35.558 1.00 82.70 ? 233 LYS A CB 1 ATOM 1832 C CG . LYS A 1 233 ? -11.090 12.889 35.654 1.00 84.55 ? 233 LYS A CG 1 ATOM 1833 C CD . LYS A 1 233 ? -12.430 13.506 36.043 1.00 87.29 ? 233 LYS A CD 1 ATOM 1834 C CE . LYS A 1 233 ? -12.256 14.638 37.066 1.00 88.61 ? 233 LYS A CE 1 ATOM 1835 N NZ . LYS A 1 233 ? -12.363 14.071 38.457 1.00 90.26 ? 233 LYS A NZ 1 ATOM 1836 N N . PRO A 1 234 ? -8.624 9.805 35.891 1.00 80.35 ? 234 PRO A N 1 ATOM 1837 C CA . PRO A 1 234 ? -7.731 10.966 35.855 1.00 78.87 ? 234 PRO A CA 1 ATOM 1838 C C . PRO A 1 234 ? -6.625 10.757 34.833 1.00 77.05 ? 234 PRO A C 1 ATOM 1839 O O . PRO A 1 234 ? -6.182 9.610 34.587 1.00 76.65 ? 234 PRO A O 1 ATOM 1840 C CB . PRO A 1 234 ? -7.171 11.011 37.264 1.00 79.18 ? 234 PRO A CB 1 ATOM 1841 C CG . PRO A 1 234 ? -8.277 10.386 38.089 1.00 81.01 ? 234 PRO A CG 1 ATOM 1842 C CD . PRO A 1 234 ? -8.748 9.244 37.246 1.00 80.25 ? 234 PRO A CD 1 ATOM 1843 N N . SER A 1 235 ? -6.135 11.889 34.331 1.00 74.41 ? 235 SER A N 1 ATOM 1844 C CA . SER A 1 235 ? -5.518 11.929 33.011 1.00 71.94 ? 235 SER A CA 1 ATOM 1845 C C . SER A 1 235 ? -4.142 12.538 32.957 1.00 69.79 ? 235 SER A C 1 ATOM 1846 O O . SER A 1 235 ? -3.884 13.567 33.572 1.00 71.01 ? 235 SER A O 1 ATOM 1847 C CB . SER A 1 235 ? -6.466 12.730 32.122 1.00 71.91 ? 235 SER A CB 1 ATOM 1848 O OG . SER A 1 235 ? -5.895 13.155 30.903 1.00 72.55 ? 235 SER A OG 1 ATOM 1849 N N . PRO A 1 236 ? -3.239 11.861 32.285 1.00 67.12 ? 236 PRO A N 1 ATOM 1850 C CA . PRO A 1 236 ? -1.858 12.332 32.166 1.00 64.98 ? 236 PRO A CA 1 ATOM 1851 C C . PRO A 1 236 ? -1.765 13.672 31.431 1.00 63.06 ? 236 PRO A C 1 ATOM 1852 O O . PRO A 1 236 ? -1.038 14.561 31.858 1.00 61.71 ? 236 PRO A O 1 ATOM 1853 C CB . PRO A 1 236 ? -1.194 11.227 31.326 1.00 65.71 ? 236 PRO A CB 1 ATOM 1854 C CG . PRO A 1 236 ? -2.039 10.036 31.479 1.00 65.94 ? 236 PRO A CG 1 ATOM 1855 C CD . PRO A 1 236 ? -3.450 10.536 31.683 1.00 67.32 ? 236 PRO A CD 1 ATOM 1856 N N . CYS A 1 237 ? -2.534 13.819 30.355 1.00 61.06 ? 237 CYS A N 1 ATOM 1857 C CA . CYS A 1 237 ? -2.292 14.910 29.427 1.00 60.17 ? 237 CYS A CA 1 ATOM 1858 C C . CYS A 1 237 ? -2.896 16.237 29.802 1.00 60.26 ? 237 CYS A C 1 ATOM 1859 O O . CYS A 1 237 ? -2.470 17.294 29.301 1.00 59.02 ? 237 CYS A O 1 ATOM 1860 C CB . CYS A 1 237 ? -2.703 14.519 28.008 1.00 59.98 ? 237 CYS A CB 1 ATOM 1861 S SG . CYS A 1 237 ? -2.190 12.870 27.523 1.00 57.94 ? 237 CYS A SG 1 ATOM 1862 N N . GLU A 1 238 ? -3.892 16.176 30.666 1.00 60.45 ? 238 GLU A N 1 ATOM 1863 C CA . GLU A 1 238 ? -4.539 17.372 31.136 1.00 61.98 ? 238 GLU A CA 1 ATOM 1864 C C . GLU A 1 238 ? -3.696 17.944 32.250 1.00 62.05 ? 238 GLU A C 1 ATOM 1865 O O . GLU A 1 238 ? -3.573 19.162 32.400 1.00 63.19 ? 238 GLU A O 1 ATOM 1866 C CB . GLU A 1 238 ? -5.945 17.057 31.631 1.00 61.51 ? 238 GLU A CB 1 ATOM 1867 C CG . GLU A 1 238 ? -6.956 16.937 30.495 1.00 64.93 ? 238 GLU A CG 1 ATOM 1868 C CD . GLU A 1 238 ? -8.370 16.713 30.981 1.00 66.85 ? 238 GLU A CD 1 ATOM 1869 O OE1 . GLU A 1 238 ? -9.226 16.304 30.191 1.00 67.52 ? 238 GLU A OE1 1 ATOM 1870 O OE2 . GLU A 1 238 ? -8.634 16.943 32.171 1.00 72.11 ? 238 GLU A OE2 1 ATOM 1871 N N . PHE A 1 239 ? -3.107 17.037 33.009 1.00 61.97 ? 239 PHE A N 1 ATOM 1872 C CA . PHE A 1 239 ? -2.282 17.327 34.175 1.00 61.86 ? 239 PHE A CA 1 ATOM 1873 C C . PHE A 1 239 ? -0.985 18.055 33.859 1.00 62.03 ? 239 PHE A C 1 ATOM 1874 O O . PHE A 1 239 ? -0.592 18.958 34.593 1.00 62.01 ? 239 PHE A O 1 ATOM 1875 C CB . PHE A 1 239 ? -1.950 15.987 34.862 1.00 61.35 ? 239 PHE A CB 1 ATOM 1876 C CG . PHE A 1 239 ? -1.186 16.119 36.153 1.00 62.40 ? 239 PHE A CG 1 ATOM 1877 C CD1 . PHE A 1 239 ? -1.798 15.832 37.357 1.00 61.68 ? 239 PHE A CD1 1 ATOM 1878 C CD2 . PHE A 1 239 ? 0.147 16.522 36.163 1.00 64.58 ? 239 PHE A CD2 1 ATOM 1879 C CE1 . PHE A 1 239 ? -1.097 15.953 38.545 1.00 62.96 ? 239 PHE A CE1 1 ATOM 1880 C CE2 . PHE A 1 239 ? 0.849 16.633 37.350 1.00 63.19 ? 239 PHE A CE2 1 ATOM 1881 C CZ . PHE A 1 239 ? 0.217 16.361 38.541 1.00 62.86 ? 239 PHE A CZ 1 ATOM 1882 N N . ILE A 1 240 ? -0.313 17.670 32.777 1.00 61.64 ? 240 ILE A N 1 ATOM 1883 C CA . ILE A 1 240 ? 0.979 18.280 32.522 1.00 61.68 ? 240 ILE A CA 1 ATOM 1884 C C . ILE A 1 240 ? 0.850 19.701 32.073 1.00 61.88 ? 240 ILE A C 1 ATOM 1885 O O . ILE A 1 240 ? 1.858 20.353 31.846 1.00 62.76 ? 240 ILE A O 1 ATOM 1886 C CB . ILE A 1 240 ? 1.801 17.488 31.532 1.00 61.76 ? 240 ILE A CB 1 ATOM 1887 C CG1 . ILE A 1 240 ? 1.103 17.467 30.184 1.00 61.64 ? 240 ILE A CG1 1 ATOM 1888 C CG2 . ILE A 1 240 ? 2.063 16.097 32.059 1.00 61.13 ? 240 ILE A CG2 1 ATOM 1889 C CD1 . ILE A 1 240 ? 2.063 17.448 29.093 1.00 67.77 ? 240 ILE A CD1 1 ATOM 1890 N N . ASN A 1 241 ? -0.391 20.139 31.883 1.00 61.96 ? 241 ASN A N 1 ATOM 1891 C CA . ASN A 1 241 ? -0.761 21.533 31.622 1.00 62.39 ? 241 ASN A CA 1 ATOM 1892 C C . ASN A 1 241 ? -2.275 21.697 31.924 1.00 62.11 ? 241 ASN A C 1 ATOM 1893 O O . ASN A 1 241 ? -3.116 21.423 31.069 1.00 61.65 ? 241 ASN A O 1 ATOM 1894 C CB . ASN A 1 241 ? -0.417 21.955 30.199 1.00 62.40 ? 241 ASN A CB 1 ATOM 1895 C CG . ASN A 1 241 ? -0.559 23.471 29.981 1.00 64.48 ? 241 ASN A CG 1 ATOM 1896 O OD1 . ASN A 1 241 ? -1.129 24.175 30.814 1.00 66.61 ? 241 ASN A OD1 1 ATOM 1897 N ND2 . ASN A 1 241 ? 0.001 23.967 28.869 1.00 64.77 ? 241 ASN A ND2 1 ATOM 1898 N N . THR A 1 242 ? -2.622 22.074 33.153 1.00 62.20 ? 242 THR A N 1 ATOM 1899 C CA . THR A 1 242 ? -4.046 22.210 33.496 1.00 62.51 ? 242 THR A CA 1 ATOM 1900 C C . THR A 1 242 ? -4.716 23.448 32.859 1.00 62.66 ? 242 THR A C 1 ATOM 1901 O O . THR A 1 242 ? -5.922 23.655 32.967 1.00 62.78 ? 242 THR A O 1 ATOM 1902 C CB . THR A 1 242 ? -4.326 22.078 35.040 1.00 63.26 ? 242 THR A CB 1 ATOM 1903 O OG1 . THR A 1 242 ? -3.425 22.892 35.810 1.00 64.38 ? 242 THR A OG1 1 ATOM 1904 C CG2 . THR A 1 242 ? -4.035 20.633 35.514 1.00 59.91 ? 242 THR A CG2 1 ATOM 1905 N N . THR A 1 243 ? -3.946 24.240 32.134 1.00 61.27 ? 243 THR A N 1 ATOM 1906 C CA . THR A 1 243 ? -4.520 25.426 31.572 1.00 61.62 ? 243 THR A CA 1 ATOM 1907 C C . THR A 1 243 ? -5.062 25.157 30.173 1.00 61.49 ? 243 THR A C 1 ATOM 1908 O O . THR A 1 243 ? -6.165 25.607 29.804 1.00 60.64 ? 243 THR A O 1 ATOM 1909 C CB . THR A 1 243 ? -3.481 26.558 31.566 1.00 61.48 ? 243 THR A CB 1 ATOM 1910 O OG1 . THR A 1 243 ? -3.272 27.007 32.908 1.00 62.79 ? 243 THR A OG1 1 ATOM 1911 C CG2 . THR A 1 243 ? -4.048 27.763 30.893 1.00 61.89 ? 243 THR A CG2 1 ATOM 1912 N N . ALA A 1 244 ? -4.278 24.416 29.402 1.00 60.99 ? 244 ALA A N 1 ATOM 1913 C CA . ALA A 1 244 ? -4.693 24.005 28.073 1.00 61.03 ? 244 ALA A CA 1 ATOM 1914 C C . ALA A 1 244 ? -5.806 22.967 28.202 1.00 60.93 ? 244 ALA A C 1 ATOM 1915 O O . ALA A 1 244 ? -6.681 22.891 27.334 1.00 61.38 ? 244 ALA A O 1 ATOM 1916 C CB . ALA A 1 244 ? -3.506 23.432 27.298 1.00 60.62 ? 244 ALA A CB 1 ATOM 1917 N N . ARG A 1 245 ? -5.770 22.173 29.278 1.00 60.71 ? 245 ARG A N 1 ATOM 1918 C CA . ARG A 1 245 ? -6.794 21.148 29.509 1.00 61.45 ? 245 ARG A CA 1 ATOM 1919 C C . ARG A 1 245 ? -6.997 20.277 28.296 1.00 60.43 ? 245 ARG A C 1 ATOM 1920 O O . ARG A 1 245 ? -8.140 20.038 27.906 1.00 60.55 ? 245 ARG A O 1 ATOM 1921 C CB . ARG A 1 245 ? -8.157 21.799 29.817 1.00 62.35 ? 245 ARG A CB 1 ATOM 1922 C CG . ARG A 1 245 ? -8.392 22.187 31.284 1.00 66.68 ? 245 ARG A CG 1 ATOM 1923 C CD . ARG A 1 245 ? -8.639 20.971 32.161 1.00 73.38 ? 245 ARG A CD 1 ATOM 1924 N NE . ARG A 1 245 ? -8.945 21.213 33.573 1.00 75.91 ? 245 ARG A NE 1 ATOM 1925 C CZ . ARG A 1 245 ? -8.879 20.239 34.481 1.00 78.87 ? 245 ARG A CZ 1 ATOM 1926 N NH1 . ARG A 1 245 ? -8.513 19.025 34.102 1.00 80.76 ? 245 ARG A NH1 1 ATOM 1927 N NH2 . ARG A 1 245 ? -9.170 20.440 35.754 1.00 80.98 ? 245 ARG A NH2 1 ATOM 1928 N N . VAL A 1 246 ? -5.922 19.808 27.668 1.00 59.79 ? 246 VAL A N 1 ATOM 1929 C CA . VAL A 1 246 ? -6.099 19.001 26.449 1.00 58.35 ? 246 VAL A CA 1 ATOM 1930 C C . VAL A 1 246 ? -5.842 17.534 26.707 1.00 57.56 ? 246 VAL A C 1 ATOM 1931 O O . VAL A 1 246 ? -4.720 17.133 26.921 1.00 57.28 ? 246 VAL A O 1 ATOM 1932 C CB . VAL A 1 246 ? -5.235 19.483 25.313 1.00 58.49 ? 246 VAL A CB 1 ATOM 1933 C CG1 . VAL A 1 246 ? -5.344 18.519 24.111 1.00 58.78 ? 246 VAL A CG1 1 ATOM 1934 C CG2 . VAL A 1 246 ? -5.661 20.877 24.915 1.00 58.76 ? 246 VAL A CG2 1 ATOM 1935 N N . PRO A 1 247 ? -6.897 16.737 26.625 1.00 56.79 ? 247 PRO A N 1 ATOM 1936 C CA . PRO A 1 247 ? -6.854 15.328 26.994 1.00 56.91 ? 247 PRO A CA 1 ATOM 1937 C C . PRO A 1 247 ? -5.854 14.514 26.239 1.00 56.08 ? 247 PRO A C 1 ATOM 1938 O O . PRO A 1 247 ? -5.467 14.938 25.149 1.00 55.77 ? 247 PRO A O 1 ATOM 1939 C CB . PRO A 1 247 ? -8.229 14.817 26.554 1.00 56.60 ? 247 PRO A CB 1 ATOM 1940 C CG . PRO A 1 247 ? -9.077 15.993 26.542 1.00 56.58 ? 247 PRO A CG 1 ATOM 1941 C CD . PRO A 1 247 ? -8.219 17.126 26.121 1.00 56.92 ? 247 PRO A CD 1 ATOM 1942 N N . CYS A 1 248 ? -5.508 13.366 26.829 1.00 55.53 ? 248 CYS A N 1 ATOM 1943 C CA . CYS A 1 248 ? -4.743 12.282 26.223 1.00 55.84 ? 248 CYS A CA 1 ATOM 1944 C C . CYS A 1 248 ? -5.608 11.741 25.084 1.00 54.54 ? 248 CYS A C 1 ATOM 1945 O O . CYS A 1 248 ? -6.837 11.869 25.146 1.00 54.19 ? 248 CYS A O 1 ATOM 1946 C CB . CYS A 1 248 ? -4.519 11.149 27.250 1.00 55.80 ? 248 CYS A CB 1 ATOM 1947 S SG . CYS A 1 248 ? -3.270 11.475 28.522 1.00 61.41 ? 248 CYS A SG 1 ATOM 1948 N N . PHE A 1 249 ? -4.989 11.155 24.055 1.00 53.03 ? 249 PHE A N 1 ATOM 1949 C CA . PHE A 1 249 ? -5.732 10.578 22.920 1.00 52.54 ? 249 PHE A CA 1 ATOM 1950 C C . PHE A 1 249 ? -6.260 9.162 23.184 1.00 52.92 ? 249 PHE A C 1 ATOM 1951 O O . PHE A 1 249 ? -5.908 8.547 24.170 1.00 52.71 ? 249 PHE A O 1 ATOM 1952 C CB . PHE A 1 249 ? -4.875 10.533 21.655 1.00 52.33 ? 249 PHE A CB 1 ATOM 1953 C CG . PHE A 1 249 ? -4.645 11.870 21.001 1.00 50.63 ? 249 PHE A CG 1 ATOM 1954 C CD1 . PHE A 1 249 ? -5.682 12.739 20.756 1.00 51.88 ? 249 PHE A CD1 1 ATOM 1955 C CD2 . PHE A 1 249 ? -3.386 12.235 20.604 1.00 50.79 ? 249 PHE A CD2 1 ATOM 1956 C CE1 . PHE A 1 249 ? -5.478 13.930 20.118 1.00 47.11 ? 249 PHE A CE1 1 ATOM 1957 C CE2 . PHE A 1 249 ? -3.168 13.425 19.985 1.00 49.19 ? 249 PHE A CE2 1 ATOM 1958 C CZ . PHE A 1 249 ? -4.210 14.281 19.748 1.00 46.89 ? 249 PHE A CZ 1 ATOM 1959 N N . LEU A 1 250 ? -7.140 8.658 22.310 1.00 53.95 ? 250 LEU A N 1 ATOM 1960 C CA . LEU A 1 250 ? -7.675 7.291 22.432 1.00 53.37 ? 250 LEU A CA 1 ATOM 1961 C C . LEU A 1 250 ? -7.299 6.461 21.210 1.00 53.54 ? 250 LEU A C 1 ATOM 1962 O O . LEU A 1 250 ? -7.638 6.803 20.068 1.00 52.35 ? 250 LEU A O 1 ATOM 1963 C CB . LEU A 1 250 ? -9.173 7.292 22.512 1.00 53.80 ? 250 LEU A CB 1 ATOM 1964 C CG . LEU A 1 250 ? -9.691 5.860 22.665 1.00 54.75 ? 250 LEU A CG 1 ATOM 1965 C CD1 . LEU A 1 250 ? -9.630 5.460 24.158 1.00 52.79 ? 250 LEU A CD1 1 ATOM 1966 C CD2 . LEU A 1 250 ? -11.140 5.694 22.113 1.00 54.63 ? 250 LEU A CD2 1 ATOM 1967 N N . ALA A 1 251 ? -6.579 5.370 21.449 1.00 53.10 ? 251 ALA A N 1 ATOM 1968 C CA . ALA A 1 251 ? -6.200 4.515 20.356 1.00 52.53 ? 251 ALA A CA 1 ATOM 1969 C C . ALA A 1 251 ? -6.310 3.074 20.776 1.00 52.17 ? 251 ALA A C 1 ATOM 1970 O O . ALA A 1 251 ? -6.700 2.763 21.923 1.00 51.50 ? 251 ALA A O 1 ATOM 1971 C CB . ALA A 1 251 ? -4.818 4.843 19.903 1.00 53.23 ? 251 ALA A CB 1 ATOM 1972 N N . GLY A 1 252 ? -5.982 2.191 19.842 1.00 51.74 ? 252 GLY A N 1 ATOM 1973 C CA . GLY A 1 252 ? -6.063 0.767 20.101 1.00 51.77 ? 252 GLY A CA 1 ATOM 1974 C C . GLY A 1 252 ? -5.092 0.316 21.157 1.00 52.24 ? 252 GLY A C 1 ATOM 1975 O O . GLY A 1 252 ? -5.130 -0.823 21.583 1.00 52.63 ? 252 GLY A O 1 ATOM 1976 N N . ASP A 1 253 ? -4.205 1.210 21.590 1.00 53.01 ? 253 ASP A N 1 ATOM 1977 C CA . ASP A 1 253 ? -3.197 0.864 22.564 1.00 53.26 ? 253 ASP A CA 1 ATOM 1978 C C . ASP A 1 253 ? -3.172 1.978 23.540 1.00 54.34 ? 253 ASP A C 1 ATOM 1979 O O . ASP A 1 253 ? -3.110 3.137 23.145 1.00 56.43 ? 253 ASP A O 1 ATOM 1980 C CB . ASP A 1 253 ? -1.831 0.756 21.916 1.00 52.61 ? 253 ASP A CB 1 ATOM 1981 C CG . ASP A 1 253 ? -0.730 0.546 22.942 1.00 52.45 ? 253 ASP A CG 1 ATOM 1982 O OD1 . ASP A 1 253 ? -0.425 -0.628 23.248 1.00 52.71 ? 253 ASP A OD1 1 ATOM 1983 O OD2 . ASP A 1 253 ? -0.171 1.485 23.550 1.00 48.60 ? 253 ASP A OD2 1 ATOM 1984 N N . PHE A 1 254 ? -3.146 1.659 24.811 1.00 54.58 ? 254 PHE A N 1 ATOM 1985 C CA . PHE A 1 254 ? -3.218 2.710 25.815 1.00 56.36 ? 254 PHE A CA 1 ATOM 1986 C C . PHE A 1 254 ? -2.032 3.697 26.024 1.00 55.79 ? 254 PHE A C 1 ATOM 1987 O O . PHE A 1 254 ? -2.241 4.800 26.564 1.00 55.75 ? 254 PHE A O 1 ATOM 1988 C CB . PHE A 1 254 ? -3.775 2.117 27.137 1.00 57.68 ? 254 PHE A CB 1 ATOM 1989 C CG . PHE A 1 254 ? -5.260 1.802 27.049 1.00 61.81 ? 254 PHE A CG 1 ATOM 1990 C CD1 . PHE A 1 254 ? -5.702 0.505 26.807 1.00 64.98 ? 254 PHE A CD1 1 ATOM 1991 C CD2 . PHE A 1 254 ? -6.211 2.833 27.116 1.00 67.10 ? 254 PHE A CD2 1 ATOM 1992 C CE1 . PHE A 1 254 ? -7.064 0.224 26.680 1.00 67.57 ? 254 PHE A CE1 1 ATOM 1993 C CE2 . PHE A 1 254 ? -7.597 2.568 26.989 1.00 67.18 ? 254 PHE A CE2 1 ATOM 1994 C CZ . PHE A 1 254 ? -8.022 1.257 26.770 1.00 69.45 ? 254 PHE A CZ 1 ATOM 1995 N N . ARG A 1 255 ? -0.803 3.336 25.622 1.00 54.70 ? 255 ARG A N 1 ATOM 1996 C CA . ARG A 1 255 ? 0.307 4.261 25.845 1.00 53.12 ? 255 ARG A CA 1 ATOM 1997 C C . ARG A 1 255 ? 0.443 5.289 24.723 1.00 52.54 ? 255 ARG A C 1 ATOM 1998 O O . ARG A 1 255 ? 1.464 5.978 24.631 1.00 52.59 ? 255 ARG A O 1 ATOM 1999 C CB . ARG A 1 255 ? 1.649 3.519 26.015 1.00 53.22 ? 255 ARG A CB 1 ATOM 2000 C CG . ARG A 1 255 ? 1.632 2.260 26.894 1.00 52.83 ? 255 ARG A CG 1 ATOM 2001 C CD . ARG A 1 255 ? 1.341 1.037 26.046 1.00 55.51 ? 255 ARG A CD 1 ATOM 2002 N NE . ARG A 1 255 ? 2.429 0.051 26.062 1.00 53.06 ? 255 ARG A NE 1 ATOM 2003 C CZ . ARG A 1 255 ? 2.517 -0.976 25.223 1.00 52.36 ? 255 ARG A CZ 1 ATOM 2004 N NH1 . ARG A 1 255 ? 1.594 -1.160 24.300 1.00 51.92 ? 255 ARG A NH1 1 ATOM 2005 N NH2 . ARG A 1 255 ? 3.522 -1.823 25.305 1.00 50.72 ? 255 ARG A NH2 1 ATOM 2006 N N . ALA A 1 256 ? -0.568 5.372 23.867 1.00 51.37 ? 256 ALA A N 1 ATOM 2007 C CA . ALA A 1 256 ? -0.532 6.230 22.679 1.00 50.02 ? 256 ALA A CA 1 ATOM 2008 C C . ALA A 1 256 ? -0.079 7.632 22.904 1.00 49.32 ? 256 ALA A C 1 ATOM 2009 O O . ALA A 1 256 ? 0.570 8.242 22.046 1.00 49.24 ? 256 ALA A O 1 ATOM 2010 C CB . ALA A 1 256 ? -1.904 6.223 22.008 1.00 50.08 ? 256 ALA A CB 1 ATOM 2011 N N . SER A 1 257 ? -0.387 8.153 24.052 1.00 47.27 ? 257 SER A N 1 ATOM 2012 C CA . SER A 1 257 ? 0.008 9.543 24.151 1.00 47.17 ? 257 SER A CA 1 ATOM 2013 C C . SER A 1 257 ? 1.275 9.739 25.032 1.00 47.57 ? 257 SER A C 1 ATOM 2014 O O . SER A 1 257 ? 1.592 10.889 25.360 1.00 47.67 ? 257 SER A O 1 ATOM 2015 C CB . SER A 1 257 ? -1.184 10.352 24.640 1.00 46.00 ? 257 SER A CB 1 ATOM 2016 O OG . SER A 1 257 ? -2.387 9.898 24.048 1.00 47.27 ? 257 SER A OG 1 ATOM 2017 N N . GLU A 1 258 ? 2.000 8.638 25.383 1.00 47.22 ? 258 GLU A N 1 ATOM 2018 C CA . GLU A 1 258 ? 3.234 8.672 26.233 1.00 47.67 ? 258 GLU A CA 1 ATOM 2019 C C . GLU A 1 258 ? 4.123 9.837 25.809 1.00 47.17 ? 258 GLU A C 1 ATOM 2020 O O . GLU A 1 258 ? 4.650 10.550 26.669 1.00 47.24 ? 258 GLU A O 1 ATOM 2021 C CB . GLU A 1 258 ? 4.055 7.370 26.154 1.00 47.79 ? 258 GLU A CB 1 ATOM 2022 C CG . GLU A 1 258 ? 5.231 7.301 27.128 1.00 49.29 ? 258 GLU A CG 1 ATOM 2023 C CD . GLU A 1 258 ? 6.600 7.566 26.489 1.00 50.83 ? 258 GLU A CD 1 ATOM 2024 O OE1 . GLU A 1 258 ? 6.699 7.426 25.259 1.00 58.09 ? 258 GLU A OE1 1 ATOM 2025 O OE2 . GLU A 1 258 ? 7.569 7.898 27.211 1.00 51.04 ? 258 GLU A OE2 1 ATOM 2026 N N . GLN A 1 259 ? 4.286 10.049 24.509 1.00 46.27 ? 259 GLN A N 1 ATOM 2027 C CA . GLN A 1 259 ? 5.108 11.191 24.069 1.00 44.98 ? 259 GLN A CA 1 ATOM 2028 C C . GLN A 1 259 ? 4.616 11.566 22.708 1.00 45.45 ? 259 GLN A C 1 ATOM 2029 O O . GLN A 1 259 ? 4.113 10.723 21.959 1.00 46.83 ? 259 GLN A O 1 ATOM 2030 C CB . GLN A 1 259 ? 6.633 10.894 24.084 1.00 44.01 ? 259 GLN A CB 1 ATOM 2031 C CG . GLN A 1 259 ? 7.058 9.600 23.422 1.00 43.45 ? 259 GLN A CG 1 ATOM 2032 C CD . GLN A 1 259 ? 7.400 9.770 21.943 1.00 45.58 ? 259 GLN A CD 1 ATOM 2033 O OE1 . GLN A 1 259 ? 7.457 10.911 21.434 1.00 45.66 ? 259 GLN A OE1 1 ATOM 2034 N NE2 . GLN A 1 259 ? 7.637 8.642 21.247 1.00 42.65 ? 259 GLN A NE2 1 ATOM 2035 N N . ILE A 1 260 ? 4.805 12.814 22.351 1.00 45.31 ? 260 ILE A N 1 ATOM 2036 C CA . ILE A 1 260 ? 4.141 13.403 21.190 1.00 45.90 ? 260 ILE A CA 1 ATOM 2037 C C . ILE A 1 260 ? 4.448 12.781 19.790 1.00 45.69 ? 260 ILE A C 1 ATOM 2038 O O . ILE A 1 260 ? 3.649 12.915 18.839 1.00 45.90 ? 260 ILE A O 1 ATOM 2039 C CB . ILE A 1 260 ? 4.498 14.913 21.227 1.00 45.75 ? 260 ILE A CB 1 ATOM 2040 C CG1 . ILE A 1 260 ? 3.421 15.718 20.576 1.00 47.12 ? 260 ILE A CG1 1 ATOM 2041 C CG2 . ILE A 1 260 ? 5.855 15.174 20.533 1.00 47.88 ? 260 ILE A CG2 1 ATOM 2042 C CD1 . ILE A 1 260 ? 3.591 17.186 20.783 1.00 49.73 ? 260 ILE A CD1 1 ATOM 2043 N N . LEU A 1 261 ? 5.583 12.097 19.655 1.00 44.26 ? 261 LEU A N 1 ATOM 2044 C CA . LEU A 1 261 ? 5.927 11.512 18.361 1.00 43.28 ? 261 LEU A CA 1 ATOM 2045 C C . LEU A 1 261 ? 5.223 10.180 18.172 1.00 44.18 ? 261 LEU A C 1 ATOM 2046 O O . LEU A 1 261 ? 4.904 9.773 17.072 1.00 45.61 ? 261 LEU A O 1 ATOM 2047 C CB . LEU A 1 261 ? 7.426 11.354 18.223 1.00 42.00 ? 261 LEU A CB 1 ATOM 2048 C CG . LEU A 1 261 ? 8.219 12.651 18.400 1.00 39.35 ? 261 LEU A CG 1 ATOM 2049 C CD1 . LEU A 1 261 ? 9.712 12.436 18.157 1.00 37.09 ? 261 LEU A CD1 1 ATOM 2050 C CD2 . LEU A 1 261 ? 7.740 13.716 17.452 1.00 37.65 ? 261 LEU A CD2 1 ATOM 2051 N N . LEU A 1 262 ? 4.964 9.498 19.272 1.00 44.54 ? 262 LEU A N 1 ATOM 2052 C CA . LEU A 1 262 ? 4.200 8.283 19.200 1.00 44.06 ? 262 LEU A CA 1 ATOM 2053 C C . LEU A 1 262 ? 2.741 8.664 18.876 1.00 43.80 ? 262 LEU A C 1 ATOM 2054 O O . LEU A 1 262 ? 2.125 8.037 17.994 1.00 44.24 ? 262 LEU A O 1 ATOM 2055 C CB . LEU A 1 262 ? 4.364 7.497 20.515 1.00 42.96 ? 262 LEU A CB 1 ATOM 2056 C CG . LEU A 1 262 ? 3.384 6.374 20.788 1.00 44.28 ? 262 LEU A CG 1 ATOM 2057 C CD1 . LEU A 1 262 ? 3.715 5.261 19.889 1.00 43.37 ? 262 LEU A CD1 1 ATOM 2058 C CD2 . LEU A 1 262 ? 3.454 5.923 22.286 1.00 44.60 ? 262 LEU A CD2 1 ATOM 2059 N N . ALA A 1 263 ? 2.202 9.703 19.518 1.00 43.82 ? 263 ALA A N 1 ATOM 2060 C CA . ALA A 1 263 ? 0.783 10.116 19.243 1.00 45.82 ? 263 ALA A CA 1 ATOM 2061 C C . ALA A 1 263 ? 0.687 10.502 17.794 1.00 46.94 ? 263 ALA A C 1 ATOM 2062 O O . ALA A 1 263 ? -0.342 10.290 17.096 1.00 48.15 ? 263 ALA A O 1 ATOM 2063 C CB . ALA A 1 263 ? 0.342 11.274 20.114 1.00 43.74 ? 263 ALA A CB 1 ATOM 2064 N N . THR A 1 264 ? 1.792 11.078 17.354 1.00 47.72 ? 264 THR A N 1 ATOM 2065 C CA . THR A 1 264 ? 1.908 11.503 15.993 1.00 48.88 ? 264 THR A CA 1 ATOM 2066 C C . THR A 1 264 ? 1.874 10.289 15.193 1.00 47.95 ? 264 THR A C 1 ATOM 2067 O O . THR A 1 264 ? 1.116 10.169 14.275 1.00 48.46 ? 264 THR A O 1 ATOM 2068 C CB . THR A 1 264 ? 3.259 12.188 15.806 1.00 49.24 ? 264 THR A CB 1 ATOM 2069 O OG1 . THR A 1 264 ? 3.094 13.554 16.160 1.00 49.16 ? 264 THR A OG1 1 ATOM 2070 C CG2 . THR A 1 264 ? 3.670 12.228 14.330 1.00 51.63 ? 264 THR A CG2 1 ATOM 2071 N N . ALA A 1 265 ? 2.751 9.384 15.533 1.00 49.06 ? 265 ALA A N 1 ATOM 2072 C CA . ALA A 1 265 ? 2.819 8.136 14.814 1.00 49.64 ? 265 ALA A CA 1 ATOM 2073 C C . ALA A 1 265 ? 1.438 7.509 14.829 1.00 50.32 ? 265 ALA A C 1 ATOM 2074 O O . ALA A 1 265 ? 0.963 7.100 13.787 1.00 51.73 ? 265 ALA A O 1 ATOM 2075 C CB . ALA A 1 265 ? 3.875 7.217 15.433 1.00 48.57 ? 265 ALA A CB 1 ATOM 2076 N N . HIS A 1 266 ? 0.775 7.453 15.989 1.00 50.39 ? 266 HIS A N 1 ATOM 2077 C CA . HIS A 1 266 ? -0.575 6.892 16.028 1.00 50.98 ? 266 HIS A CA 1 ATOM 2078 C C . HIS A 1 266 ? -1.481 7.676 15.086 1.00 51.65 ? 266 HIS A C 1 ATOM 2079 O O . HIS A 1 266 ? -2.337 7.105 14.419 1.00 51.43 ? 266 HIS A O 1 ATOM 2080 C CB . HIS A 1 266 ? -1.172 6.892 17.466 1.00 50.82 ? 266 HIS A CB 1 ATOM 2081 C CG . HIS A 1 266 ? -0.863 5.652 18.241 1.00 50.10 ? 266 HIS A CG 1 ATOM 2082 N ND1 . HIS A 1 266 ? -1.603 4.502 18.121 1.00 48.43 ? 266 HIS A ND1 1 ATOM 2083 C CD2 . HIS A 1 266 ? 0.118 5.373 19.132 1.00 52.67 ? 266 HIS A CD2 1 ATOM 2084 C CE1 . HIS A 1 266 ? -1.093 3.565 18.899 1.00 49.01 ? 266 HIS A CE1 1 ATOM 2085 N NE2 . HIS A 1 266 ? -0.060 4.073 19.540 1.00 51.41 ? 266 HIS A NE2 1 ATOM 2086 N N . THR A 1 267 ? -1.312 8.995 15.048 1.00 52.47 ? 267 THR A N 1 ATOM 2087 C CA . THR A 1 267 ? -2.126 9.782 14.135 1.00 54.21 ? 267 THR A CA 1 ATOM 2088 C C . THR A 1 267 ? -1.912 9.440 12.653 1.00 55.19 ? 267 THR A C 1 ATOM 2089 O O . THR A 1 267 ? -2.867 9.433 11.881 1.00 55.46 ? 267 THR A O 1 ATOM 2090 C CB . THR A 1 267 ? -2.008 11.281 14.408 1.00 54.77 ? 267 THR A CB 1 ATOM 2091 O OG1 . THR A 1 267 ? -2.139 11.525 15.823 1.00 54.70 ? 267 THR A OG1 1 ATOM 2092 C CG2 . THR A 1 267 ? -3.216 11.988 13.813 1.00 55.14 ? 267 THR A CG2 1 ATOM 2093 N N . LEU A 1 268 ? -0.703 9.120 12.219 1.00 56.01 ? 268 LEU A N 1 ATOM 2094 C CA . LEU A 1 268 ? -0.611 8.746 10.808 1.00 57.03 ? 268 LEU A CA 1 ATOM 2095 C C . LEU A 1 268 ? -1.428 7.468 10.522 1.00 58.09 ? 268 LEU A C 1 ATOM 2096 O O . LEU A 1 268 ? -2.029 7.310 9.451 1.00 57.78 ? 268 LEU A O 1 ATOM 2097 C CB . LEU A 1 268 ? 0.830 8.502 10.381 1.00 57.15 ? 268 LEU A CB 1 ATOM 2098 C CG . LEU A 1 268 ? 1.745 9.628 9.900 1.00 56.86 ? 268 LEU A CG 1 ATOM 2099 C CD1 . LEU A 1 268 ? 0.948 10.854 9.595 1.00 54.09 ? 268 LEU A CD1 1 ATOM 2100 C CD2 . LEU A 1 268 ? 2.899 9.916 10.874 1.00 55.53 ? 268 LEU A CD2 1 ATOM 2101 N N . LEU A 1 269 ? -1.451 6.545 11.476 1.00 58.65 ? 269 LEU A N 1 ATOM 2102 C CA . LEU A 1 269 ? -2.059 5.254 11.178 1.00 59.89 ? 269 LEU A CA 1 ATOM 2103 C C . LEU A 1 269 ? -3.560 5.354 11.099 1.00 60.90 ? 269 LEU A C 1 ATOM 2104 O O . LEU A 1 269 ? -4.184 4.717 10.273 1.00 61.92 ? 269 LEU A O 1 ATOM 2105 C CB . LEU A 1 269 ? -1.595 4.161 12.154 1.00 59.53 ? 269 LEU A CB 1 ATOM 2106 C CG . LEU A 1 269 ? -0.080 4.008 12.111 1.00 57.65 ? 269 LEU A CG 1 ATOM 2107 C CD1 . LEU A 1 269 ? 0.424 3.058 13.185 1.00 54.69 ? 269 LEU A CD1 1 ATOM 2108 C CD2 . LEU A 1 269 ? 0.258 3.525 10.704 1.00 58.62 ? 269 LEU A CD2 1 ATOM 2109 N N . LEU A 1 270 ? -4.151 6.152 11.959 1.00 61.57 ? 270 LEU A N 1 ATOM 2110 C CA . LEU A 1 270 ? -5.594 6.331 11.895 1.00 62.23 ? 270 LEU A CA 1 ATOM 2111 C C . LEU A 1 270 ? -5.997 6.871 10.527 1.00 62.03 ? 270 LEU A C 1 ATOM 2112 O O . LEU A 1 270 ? -6.960 6.408 9.912 1.00 62.20 ? 270 LEU A O 1 ATOM 2113 C CB . LEU A 1 270 ? -6.024 7.300 12.987 1.00 62.19 ? 270 LEU A CB 1 ATOM 2114 C CG . LEU A 1 270 ? -7.474 7.596 13.272 1.00 63.19 ? 270 LEU A CG 1 ATOM 2115 C CD1 . LEU A 1 270 ? -8.145 6.369 13.874 1.00 65.68 ? 270 LEU A CD1 1 ATOM 2116 C CD2 . LEU A 1 270 ? -7.486 8.749 14.265 1.00 62.02 ? 270 LEU A CD2 1 ATOM 2117 N N . ARG A 1 271 ? -5.268 7.873 10.053 1.00 62.08 ? 271 ARG A N 1 ATOM 2118 C CA . ARG A 1 271 ? -5.604 8.471 8.771 1.00 61.83 ? 271 ARG A CA 1 ATOM 2119 C C . ARG A 1 271 ? -5.525 7.434 7.642 1.00 62.89 ? 271 ARG A C 1 ATOM 2120 O O . ARG A 1 271 ? -6.444 7.309 6.808 1.00 62.81 ? 271 ARG A O 1 ATOM 2121 C CB . ARG A 1 271 ? -4.720 9.679 8.487 1.00 60.95 ? 271 ARG A CB 1 ATOM 2122 C CG . ARG A 1 271 ? -4.944 10.802 9.470 1.00 58.77 ? 271 ARG A CG 1 ATOM 2123 C CD . ARG A 1 271 ? -4.216 12.062 9.155 1.00 55.08 ? 271 ARG A CD 1 ATOM 2124 N NE . ARG A 1 271 ? -4.357 12.985 10.255 1.00 57.56 ? 271 ARG A NE 1 ATOM 2125 C CZ . ARG A 1 271 ? -3.565 14.022 10.466 1.00 55.28 ? 271 ARG A CZ 1 ATOM 2126 N NH1 . ARG A 1 271 ? -2.572 14.268 9.620 1.00 54.54 ? 271 ARG A NH1 1 ATOM 2127 N NH2 . ARG A 1 271 ? -3.757 14.800 11.539 1.00 51.83 ? 271 ARG A NH2 1 ATOM 2128 N N . GLU A 1 272 ? -4.446 6.670 7.618 1.00 62.92 ? 272 GLU A N 1 ATOM 2129 C CA . GLU A 1 272 ? -4.359 5.659 6.590 1.00 63.79 ? 272 GLU A CA 1 ATOM 2130 C C . GLU A 1 272 ? -5.572 4.746 6.638 1.00 64.23 ? 272 GLU A C 1 ATOM 2131 O O . GLU A 1 272 ? -6.076 4.357 5.615 1.00 64.70 ? 272 GLU A O 1 ATOM 2132 C CB . GLU A 1 272 ? -3.078 4.861 6.707 1.00 63.02 ? 272 GLU A CB 1 ATOM 2133 C CG . GLU A 1 272 ? -3.037 3.639 5.813 1.00 63.87 ? 272 GLU A CG 1 ATOM 2134 C CD . GLU A 1 272 ? -2.617 3.932 4.385 1.00 61.85 ? 272 GLU A CD 1 ATOM 2135 O OE1 . GLU A 1 272 ? -2.620 5.113 4.032 1.00 66.76 ? 272 GLU A OE1 1 ATOM 2136 O OE2 . GLU A 1 272 ? -2.282 2.987 3.628 1.00 56.77 ? 272 GLU A OE2 1 ATOM 2137 N N . HIS A 1 273 ? -6.053 4.405 7.819 1.00 65.38 ? 273 HIS A N 1 ATOM 2138 C CA . HIS A 1 273 ? -7.217 3.536 7.871 1.00 66.80 ? 273 HIS A CA 1 ATOM 2139 C C . HIS A 1 273 ? -8.484 4.136 7.241 1.00 67.23 ? 273 HIS A C 1 ATOM 2140 O O . HIS A 1 273 ? -9.186 3.473 6.495 1.00 68.09 ? 273 HIS A O 1 ATOM 2141 C CB . HIS A 1 273 ? -7.552 3.102 9.288 1.00 66.73 ? 273 HIS A CB 1 ATOM 2142 C CG . HIS A 1 273 ? -8.813 2.313 9.349 1.00 67.48 ? 273 HIS A CG 1 ATOM 2143 N ND1 . HIS A 1 273 ? -8.824 0.936 9.395 1.00 69.74 ? 273 HIS A ND1 1 ATOM 2144 C CD2 . HIS A 1 273 ? -10.108 2.701 9.277 1.00 68.91 ? 273 HIS A CD2 1 ATOM 2145 C CE1 . HIS A 1 273 ? -10.077 0.511 9.384 1.00 69.93 ? 273 HIS A CE1 1 ATOM 2146 N NE2 . HIS A 1 273 ? -10.875 1.563 9.311 1.00 69.33 ? 273 HIS A NE2 1 ATOM 2147 N N . ASN A 1 274 ? -8.789 5.380 7.569 1.00 67.79 ? 274 ASN A N 1 ATOM 2148 C CA . ASN A 1 274 ? -9.944 6.057 7.013 1.00 67.70 ? 274 ASN A CA 1 ATOM 2149 C C . ASN A 1 274 ? -9.788 6.316 5.497 1.00 68.85 ? 274 ASN A C 1 ATOM 2150 O O . ASN A 1 274 ? -10.752 6.151 4.717 1.00 68.91 ? 274 ASN A O 1 ATOM 2151 C CB . ASN A 1 274 ? -10.198 7.342 7.799 1.00 67.20 ? 274 ASN A CB 1 ATOM 2152 C CG . ASN A 1 274 ? -10.836 7.069 9.161 1.00 65.71 ? 274 ASN A CG 1 ATOM 2153 O OD1 . ASN A 1 274 ? -11.113 5.933 9.498 1.00 63.65 ? 274 ASN A OD1 1 ATOM 2154 N ND2 . ASN A 1 274 ? -11.088 8.119 9.931 1.00 65.91 ? 274 ASN A ND2 1 ATOM 2155 N N . ARG A 1 275 ? -8.572 6.671 5.081 1.00 69.58 ? 275 ARG A N 1 ATOM 2156 C CA . ARG A 1 275 ? -8.257 6.968 3.678 1.00 70.77 ? 275 ARG A CA 1 ATOM 2157 C C . ARG A 1 275 ? -8.249 5.677 2.871 1.00 71.54 ? 275 ARG A C 1 ATOM 2158 O O . ARG A 1 275 ? -8.197 5.673 1.640 1.00 72.19 ? 275 ARG A O 1 ATOM 2159 C CB . ARG A 1 275 ? -6.875 7.617 3.580 1.00 70.72 ? 275 ARG A CB 1 ATOM 2160 C CG . ARG A 1 275 ? -6.605 8.403 2.308 1.00 71.17 ? 275 ARG A CG 1 ATOM 2161 C CD . ARG A 1 275 ? -5.122 8.544 1.936 1.00 71.30 ? 275 ARG A CD 1 ATOM 2162 N NE . ARG A 1 275 ? -4.747 7.533 0.963 1.00 75.26 ? 275 ARG A NE 1 ATOM 2163 C CZ . ARG A 1 275 ? -4.507 6.269 1.306 1.00 75.85 ? 275 ARG A CZ 1 ATOM 2164 N NH1 . ARG A 1 275 ? -4.579 5.947 2.587 1.00 75.35 ? 275 ARG A NH1 1 ATOM 2165 N NH2 . ARG A 1 275 ? -4.186 5.346 0.404 1.00 74.75 ? 275 ARG A NH2 1 ATOM 2166 N N . LEU A 1 276 ? -8.287 4.570 3.583 1.00 72.38 ? 276 LEU A N 1 ATOM 2167 C CA . LEU A 1 276 ? -8.263 3.272 2.946 1.00 73.55 ? 276 LEU A CA 1 ATOM 2168 C C . LEU A 1 276 ? -9.706 2.863 2.815 1.00 74.23 ? 276 LEU A C 1 ATOM 2169 O O . LEU A 1 276 ? -10.123 2.241 1.840 1.00 73.99 ? 276 LEU A O 1 ATOM 2170 C CB . LEU A 1 276 ? -7.526 2.297 3.857 1.00 73.30 ? 276 LEU A CB 1 ATOM 2171 C CG . LEU A 1 276 ? -6.415 1.437 3.284 1.00 73.17 ? 276 LEU A CG 1 ATOM 2172 C CD1 . LEU A 1 276 ? -5.940 1.943 1.937 1.00 73.47 ? 276 LEU A CD1 1 ATOM 2173 C CD2 . LEU A 1 276 ? -5.278 1.401 4.286 1.00 73.53 ? 276 LEU A CD2 1 ATOM 2174 N N . ALA A 1 277 ? -10.463 3.243 3.836 1.00 75.48 ? 277 ALA A N 1 ATOM 2175 C CA . ALA A 1 277 ? -11.877 2.967 3.912 1.00 76.67 ? 277 ALA A CA 1 ATOM 2176 C C . ALA A 1 277 ? -12.711 3.810 2.919 1.00 77.60 ? 277 ALA A C 1 ATOM 2177 O O . ALA A 1 277 ? -13.659 3.293 2.328 1.00 77.68 ? 277 ALA A O 1 ATOM 2178 C CB . ALA A 1 277 ? -12.367 3.162 5.346 1.00 76.44 ? 277 ALA A CB 1 ATOM 2179 N N . ARG A 1 278 ? -12.390 5.095 2.750 1.00 78.35 ? 278 ARG A N 1 ATOM 2180 C CA . ARG A 1 278 ? -13.148 5.914 1.800 1.00 78.99 ? 278 ARG A CA 1 ATOM 2181 C C . ARG A 1 278 ? -12.841 5.462 0.372 1.00 79.07 ? 278 ARG A C 1 ATOM 2182 O O . ARG A 1 278 ? -13.725 5.387 -0.480 1.00 78.13 ? 278 ARG A O 1 ATOM 2183 C CB . ARG A 1 278 ? -12.913 7.410 2.003 1.00 78.68 ? 278 ARG A CB 1 ATOM 2184 C CG . ARG A 1 278 ? -11.493 7.929 1.807 1.00 80.48 ? 278 ARG A CG 1 ATOM 2185 C CD . ARG A 1 278 ? -11.303 9.362 2.366 1.00 82.07 ? 278 ARG A CD 1 ATOM 2186 N NE . ARG A 1 278 ? -11.890 9.447 3.702 1.00 82.47 ? 278 ARG A NE 1 ATOM 2187 C CZ . ARG A 1 278 ? -11.220 9.788 4.797 1.00 81.78 ? 278 ARG A CZ 1 ATOM 2188 N NH1 . ARG A 1 278 ? -9.927 10.113 4.723 1.00 79.73 ? 278 ARG A NH1 1 ATOM 2189 N NH2 . ARG A 1 278 ? -11.854 9.818 5.962 1.00 80.55 ? 278 ARG A NH2 1 ATOM 2190 N N . GLU A 1 279 ? -11.586 5.114 0.127 1.00 79.54 ? 279 GLU A N 1 ATOM 2191 C CA . GLU A 1 279 ? -11.204 4.705 -1.211 1.00 80.44 ? 279 GLU A CA 1 ATOM 2192 C C . GLU A 1 279 ? -11.652 3.286 -1.591 1.00 81.06 ? 279 GLU A C 1 ATOM 2193 O O . GLU A 1 279 ? -11.876 3.010 -2.785 1.00 81.92 ? 279 GLU A O 1 ATOM 2194 C CB . GLU A 1 279 ? -9.714 4.909 -1.462 1.00 80.36 ? 279 GLU A CB 1 ATOM 2195 C CG . GLU A 1 279 ? -9.427 5.408 -2.879 1.00 81.11 ? 279 GLU A CG 1 ATOM 2196 C CD . GLU A 1 279 ? -10.028 6.778 -3.173 1.00 79.75 ? 279 GLU A CD 1 ATOM 2197 O OE1 . GLU A 1 279 ? -10.251 7.112 -4.365 1.00 78.86 ? 279 GLU A OE1 1 ATOM 2198 O OE2 . GLU A 1 279 ? -10.268 7.534 -2.211 1.00 79.93 ? 279 GLU A OE2 1 ATOM 2199 N N . LEU A 1 280 ? -11.772 2.375 -0.621 1.00 80.94 ? 280 LEU A N 1 ATOM 2200 C CA . LEU A 1 280 ? -12.258 1.038 -0.952 1.00 80.62 ? 280 LEU A CA 1 ATOM 2201 C C . LEU A 1 280 ? -13.763 1.166 -1.189 1.00 80.94 ? 280 LEU A C 1 ATOM 2202 O O . LEU A 1 280 ? -14.375 0.358 -1.885 1.00 80.52 ? 280 LEU A O 1 ATOM 2203 C CB . LEU A 1 280 ? -11.953 0.005 0.144 1.00 80.42 ? 280 LEU A CB 1 ATOM 2204 C CG . LEU A 1 280 ? -10.511 -0.447 0.406 1.00 80.40 ? 280 LEU A CG 1 ATOM 2205 C CD1 . LEU A 1 280 ? -10.345 -0.820 1.875 1.00 79.55 ? 280 LEU A CD1 1 ATOM 2206 C CD2 . LEU A 1 280 ? -10.088 -1.591 -0.505 1.00 78.99 ? 280 LEU A CD2 1 ATOM 2207 N N . LYS A 1 281 ? -14.362 2.193 -0.605 1.00 81.51 ? 281 LYS A N 1 ATOM 2208 C CA . LYS A 1 281 ? -15.787 2.417 -0.811 1.00 81.82 ? 281 LYS A CA 1 ATOM 2209 C C . LYS A 1 281 ? -15.975 2.842 -2.266 1.00 82.07 ? 281 LYS A C 1 ATOM 2210 O O . LYS A 1 281 ? -16.846 2.311 -2.967 1.00 81.81 ? 281 LYS A O 1 ATOM 2211 C CB . LYS A 1 281 ? -16.321 3.456 0.173 1.00 81.62 ? 281 LYS A CB 1 ATOM 2212 C CG . LYS A 1 281 ? -17.770 3.846 -0.018 1.00 82.28 ? 281 LYS A CG 1 ATOM 2213 C CD . LYS A 1 281 ? -18.656 2.633 0.187 1.00 84.60 ? 281 LYS A CD 1 ATOM 2214 C CE . LYS A 1 281 ? -20.138 2.961 0.241 1.00 85.37 ? 281 LYS A CE 1 ATOM 2215 N NZ . LYS A 1 281 ? -20.904 1.692 0.543 1.00 86.03 ? 281 LYS A NZ 1 ATOM 2216 N N . LYS A 1 282 ? -15.127 3.776 -2.707 1.00 82.27 ? 282 LYS A N 1 ATOM 2217 C CA . LYS A 1 282 ? -15.116 4.264 -4.085 1.00 82.59 ? 282 LYS A CA 1 ATOM 2218 C C . LYS A 1 282 ? -15.171 3.095 -5.061 1.00 82.59 ? 282 LYS A C 1 ATOM 2219 O O . LYS A 1 282 ? -16.077 3.009 -5.892 1.00 82.50 ? 282 LYS A O 1 ATOM 2220 C CB . LYS A 1 282 ? -13.834 5.066 -4.381 1.00 82.81 ? 282 LYS A CB 1 ATOM 2221 C CG . LYS A 1 282 ? -14.021 6.549 -4.718 1.00 83.51 ? 282 LYS A CG 1 ATOM 2222 C CD . LYS A 1 282 ? -13.846 7.463 -3.508 1.00 83.88 ? 282 LYS A CD 1 ATOM 2223 C CE . LYS A 1 282 ? -13.818 8.934 -3.938 1.00 85.23 ? 282 LYS A CE 1 ATOM 2224 N NZ . LYS A 1 282 ? -12.716 9.246 -4.923 1.00 85.34 ? 282 LYS A NZ 1 ATOM 2225 N N . LEU A 1 283 ? -14.174 2.217 -4.972 1.00 82.10 ? 283 LEU A N 1 ATOM 2226 C CA . LEU A 1 283 ? -14.105 1.072 -5.852 1.00 81.65 ? 283 LEU A CA 1 ATOM 2227 C C . LEU A 1 283 ? -15.289 0.169 -5.602 1.00 81.43 ? 283 LEU A C 1 ATOM 2228 O O . LEU A 1 283 ? -15.890 -0.339 -6.534 1.00 81.58 ? 283 LEU A O 1 ATOM 2229 C CB . LEU A 1 283 ? -12.831 0.266 -5.614 1.00 81.56 ? 283 LEU A CB 1 ATOM 2230 C CG . LEU A 1 283 ? -11.472 0.870 -5.956 1.00 81.62 ? 283 LEU A CG 1 ATOM 2231 C CD1 . LEU A 1 283 ? -10.373 -0.115 -5.535 1.00 81.80 ? 283 LEU A CD1 1 ATOM 2232 C CD2 . LEU A 1 283 ? -11.351 1.253 -7.438 1.00 80.63 ? 283 LEU A CD2 1 ATOM 2233 N N . ASN A 1 284 ? -15.623 -0.035 -4.337 1.00 81.14 ? 284 ASN A N 1 ATOM 2234 C CA . ASN A 1 284 ? -16.690 -0.954 -3.985 1.00 80.81 ? 284 ASN A CA 1 ATOM 2235 C C . ASN A 1 284 ? -17.764 -0.287 -3.131 1.00 81.24 ? 284 ASN A C 1 ATOM 2236 O O . ASN A 1 284 ? -17.804 -0.438 -1.905 1.00 81.71 ? 284 ASN A O 1 ATOM 2237 C CB . ASN A 1 284 ? -16.106 -2.207 -3.315 1.00 80.44 ? 284 ASN A CB 1 ATOM 2238 C CG . ASN A 1 284 ? -14.968 -2.837 -4.137 1.00 80.16 ? 284 ASN A CG 1 ATOM 2239 O OD1 . ASN A 1 284 ? -15.078 -2.978 -5.350 1.00 81.08 ? 284 ASN A OD1 1 ATOM 2240 N ND2 . ASN A 1 284 ? -13.878 -3.209 -3.477 1.00 77.91 ? 284 ASN A ND2 1 ATOM 2241 N N . PRO A 1 285 ? -18.677 0.422 -3.790 1.00 81.42 ? 285 PRO A N 1 ATOM 2242 C CA . PRO A 1 285 ? -19.707 1.182 -3.076 1.00 80.87 ? 285 PRO A CA 1 ATOM 2243 C C . PRO A 1 285 ? -20.686 0.180 -2.550 1.00 80.27 ? 285 PRO A C 1 ATOM 2244 O O . PRO A 1 285 ? -21.543 0.482 -1.717 1.00 79.21 ? 285 PRO A O 1 ATOM 2245 C CB . PRO A 1 285 ? -20.356 2.025 -4.176 1.00 81.20 ? 285 PRO A CB 1 ATOM 2246 C CG . PRO A 1 285 ? -20.136 1.241 -5.461 1.00 81.30 ? 285 PRO A CG 1 ATOM 2247 C CD . PRO A 1 285 ? -18.841 0.478 -5.260 1.00 81.48 ? 285 PRO A CD 1 ATOM 2248 N N . HIS A 1 286 ? -20.529 -1.040 -3.040 1.00 80.02 ? 286 HIS A N 1 ATOM 2249 C CA . HIS A 1 286 ? -21.432 -2.096 -2.649 1.00 80.70 ? 286 HIS A CA 1 ATOM 2250 C C . HIS A 1 286 ? -21.065 -2.781 -1.328 1.00 80.52 ? 286 HIS A C 1 ATOM 2251 O O . HIS A 1 286 ? -21.909 -3.438 -0.738 1.00 80.90 ? 286 HIS A O 1 ATOM 2252 C CB . HIS A 1 286 ? -21.647 -3.101 -3.795 1.00 81.16 ? 286 HIS A CB 1 ATOM 2253 C CG . HIS A 1 286 ? -20.479 -4.000 -4.053 1.00 82.36 ? 286 HIS A CG 1 ATOM 2254 N ND1 . HIS A 1 286 ? -19.263 -3.534 -4.503 1.00 82.89 ? 286 HIS A ND1 1 ATOM 2255 C CD2 . HIS A 1 286 ? -20.350 -5.344 -3.940 1.00 83.78 ? 286 HIS A CD2 1 ATOM 2256 C CE1 . HIS A 1 286 ? -18.432 -4.549 -4.647 1.00 83.71 ? 286 HIS A CE1 1 ATOM 2257 N NE2 . HIS A 1 286 ? -19.068 -5.660 -4.316 1.00 84.84 ? 286 HIS A NE2 1 ATOM 2258 N N . TRP A 1 287 ? -19.828 -2.613 -0.854 1.00 80.30 ? 287 TRP A N 1 ATOM 2259 C CA . TRP A 1 287 ? -19.416 -3.204 0.424 1.00 79.79 ? 287 TRP A CA 1 ATOM 2260 C C . TRP A 1 287 ? -19.998 -2.463 1.630 1.00 79.00 ? 287 TRP A C 1 ATOM 2261 O O . TRP A 1 287 ? -20.135 -1.232 1.609 1.00 78.42 ? 287 TRP A O 1 ATOM 2262 C CB . TRP A 1 287 ? -17.898 -3.205 0.561 1.00 79.92 ? 287 TRP A CB 1 ATOM 2263 C CG . TRP A 1 287 ? -17.218 -4.276 -0.189 1.00 81.18 ? 287 TRP A CG 1 ATOM 2264 C CD1 . TRP A 1 287 ? -17.799 -5.313 -0.853 1.00 82.35 ? 287 TRP A CD1 1 ATOM 2265 C CD2 . TRP A 1 287 ? -15.807 -4.431 -0.359 1.00 81.53 ? 287 TRP A CD2 1 ATOM 2266 N NE1 . TRP A 1 287 ? -16.832 -6.102 -1.429 1.00 82.57 ? 287 TRP A NE1 1 ATOM 2267 C CE2 . TRP A 1 287 ? -15.601 -5.575 -1.146 1.00 81.50 ? 287 TRP A CE2 1 ATOM 2268 C CE3 . TRP A 1 287 ? -14.694 -3.720 0.084 1.00 80.63 ? 287 TRP A CE3 1 ATOM 2269 C CZ2 . TRP A 1 287 ? -14.335 -6.021 -1.497 1.00 81.93 ? 287 TRP A CZ2 1 ATOM 2270 C CZ3 . TRP A 1 287 ? -13.450 -4.161 -0.263 1.00 80.65 ? 287 TRP A CZ3 1 ATOM 2271 C CH2 . TRP A 1 287 ? -13.274 -5.302 -1.046 1.00 81.19 ? 287 TRP A CH2 1 ATOM 2272 N N . ASN A 1 288 ? -20.305 -3.207 2.693 1.00 78.77 ? 288 ASN A N 1 ATOM 2273 C CA . ASN A 1 288 ? -20.863 -2.593 3.899 1.00 77.92 ? 288 ASN A CA 1 ATOM 2274 C C . ASN A 1 288 ? -19.795 -2.079 4.889 1.00 77.58 ? 288 ASN A C 1 ATOM 2275 O O . ASN A 1 288 ? -18.579 -2.211 4.654 1.00 76.92 ? 288 ASN A O 1 ATOM 2276 C CB . ASN A 1 288 ? -21.843 -3.546 4.579 1.00 77.95 ? 288 ASN A CB 1 ATOM 2277 C CG . ASN A 1 288 ? -21.157 -4.651 5.359 1.00 79.30 ? 288 ASN A CG 1 ATOM 2278 O OD1 . ASN A 1 288 ? -20.602 -5.599 4.779 1.00 79.66 ? 288 ASN A OD1 1 ATOM 2279 N ND2 . ASN A 1 288 ? -21.209 -4.548 6.697 1.00 79.96 ? 288 ASN A ND2 1 ATOM 2280 N N . GLY A 1 289 ? -20.260 -1.480 5.987 1.00 76.73 ? 289 GLY A N 1 ATOM 2281 C CA . GLY A 1 289 ? -19.371 -0.977 7.013 1.00 75.26 ? 289 GLY A CA 1 ATOM 2282 C C . GLY A 1 289 ? -18.282 -1.949 7.418 1.00 74.48 ? 289 GLY A C 1 ATOM 2283 O O . GLY A 1 289 ? -17.084 -1.650 7.257 1.00 75.26 ? 289 GLY A O 1 ATOM 2284 N N . GLU A 1 290 ? -18.690 -3.077 7.958 1.00 73.16 ? 290 GLU A N 1 ATOM 2285 C CA . GLU A 1 290 ? -17.770 -4.065 8.416 1.00 72.40 ? 290 GLU A CA 1 ATOM 2286 C C . GLU A 1 290 ? -16.750 -4.469 7.362 1.00 71.91 ? 290 GLU A C 1 ATOM 2287 O O . GLU A 1 290 ? -15.543 -4.456 7.616 1.00 71.80 ? 290 GLU A O 1 ATOM 2288 C CB . GLU A 1 290 ? -18.532 -5.302 8.851 1.00 72.33 ? 290 GLU A CB 1 ATOM 2289 C CG . GLU A 1 290 ? -18.377 -5.623 10.330 1.00 73.17 ? 290 GLU A CG 1 ATOM 2290 C CD . GLU A 1 290 ? -17.271 -6.600 10.604 1.00 73.30 ? 290 GLU A CD 1 ATOM 2291 O OE1 . GLU A 1 290 ? -16.799 -6.648 11.766 1.00 72.79 ? 290 GLU A OE1 1 ATOM 2292 O OE2 . GLU A 1 290 ? -16.871 -7.319 9.675 1.00 72.62 ? 290 GLU A OE2 1 ATOM 2293 N N . LYS A 1 291 ? -17.234 -4.842 6.196 1.00 71.12 ? 291 LYS A N 1 ATOM 2294 C CA . LYS A 1 291 ? -16.325 -5.227 5.138 1.00 71.10 ? 291 LYS A CA 1 ATOM 2295 C C . LYS A 1 291 ? -15.324 -4.114 4.911 1.00 70.39 ? 291 LYS A C 1 ATOM 2296 O O . LYS A 1 291 ? -14.165 -4.357 4.578 1.00 70.54 ? 291 LYS A O 1 ATOM 2297 C CB . LYS A 1 291 ? -17.077 -5.552 3.842 1.00 70.94 ? 291 LYS A CB 1 ATOM 2298 C CG . LYS A 1 291 ? -16.178 -5.923 2.670 1.00 71.39 ? 291 LYS A CG 1 ATOM 2299 C CD . LYS A 1 291 ? -15.798 -7.419 2.657 1.00 70.39 ? 291 LYS A CD 1 ATOM 2300 C CE . LYS A 1 291 ? -14.912 -7.710 1.456 1.00 70.95 ? 291 LYS A CE 1 ATOM 2301 N NZ . LYS A 1 291 ? -14.404 -9.098 1.415 1.00 71.10 ? 291 LYS A NZ 1 ATOM 2302 N N . LEU A 1 292 ? -15.768 -2.887 5.112 1.00 70.13 ? 292 LEU A N 1 ATOM 2303 C CA . LEU A 1 292 ? -14.891 -1.750 4.877 1.00 69.59 ? 292 LEU A CA 1 ATOM 2304 C C . LEU A 1 292 ? -13.853 -1.663 5.990 1.00 68.74 ? 292 LEU A C 1 ATOM 2305 O O . LEU A 1 292 ? -12.669 -1.486 5.742 1.00 68.62 ? 292 LEU A O 1 ATOM 2306 C CB . LEU A 1 292 ? -15.714 -0.472 4.783 1.00 69.65 ? 292 LEU A CB 1 ATOM 2307 C CG . LEU A 1 292 ? -16.072 -0.035 3.360 1.00 70.40 ? 292 LEU A CG 1 ATOM 2308 C CD1 . LEU A 1 292 ? -14.807 0.078 2.518 1.00 71.35 ? 292 LEU A CD1 1 ATOM 2309 C CD2 . LEU A 1 292 ? -17.067 -0.964 2.712 1.00 69.98 ? 292 LEU A CD2 1 ATOM 2310 N N . TYR A 1 293 ? -14.318 -1.798 7.222 1.00 67.93 ? 293 TYR A N 1 ATOM 2311 C CA . TYR A 1 293 ? -13.432 -1.798 8.361 1.00 67.15 ? 293 TYR A CA 1 ATOM 2312 C C . TYR A 1 293 ? -12.378 -2.908 8.195 1.00 66.73 ? 293 TYR A C 1 ATOM 2313 O O . TYR A 1 293 ? -11.209 -2.618 7.913 1.00 66.51 ? 293 TYR A O 1 ATOM 2314 C CB . TYR A 1 293 ? -14.250 -2.000 9.633 1.00 67.01 ? 293 TYR A CB 1 ATOM 2315 C CG . TYR A 1 293 ? -13.468 -2.274 10.891 1.00 66.23 ? 293 TYR A CG 1 ATOM 2316 C CD1 . TYR A 1 293 ? -12.749 -1.268 11.513 1.00 66.63 ? 293 TYR A CD1 1 ATOM 2317 C CD2 . TYR A 1 293 ? -13.509 -3.517 11.499 1.00 66.29 ? 293 TYR A CD2 1 ATOM 2318 C CE1 . TYR A 1 293 ? -12.063 -1.507 12.683 1.00 65.59 ? 293 TYR A CE1 1 ATOM 2319 C CE2 . TYR A 1 293 ? -12.828 -3.765 12.679 1.00 65.40 ? 293 TYR A CE2 1 ATOM 2320 C CZ . TYR A 1 293 ? -12.099 -2.757 13.258 1.00 64.88 ? 293 TYR A CZ 1 ATOM 2321 O OH . TYR A 1 293 ? -11.405 -2.981 14.425 1.00 63.39 ? 293 TYR A OH 1 ATOM 2322 N N . GLN A 1 294 ? -12.785 -4.166 8.334 1.00 65.48 ? 294 GLN A N 1 ATOM 2323 C CA . GLN A 1 294 ? -11.821 -5.252 8.247 1.00 65.37 ? 294 GLN A CA 1 ATOM 2324 C C . GLN A 1 294 ? -10.899 -5.128 7.026 1.00 64.97 ? 294 GLN A C 1 ATOM 2325 O O . GLN A 1 294 ? -9.682 -5.375 7.102 1.00 64.92 ? 294 GLN A O 1 ATOM 2326 C CB . GLN A 1 294 ? -12.499 -6.626 8.253 1.00 65.29 ? 294 GLN A CB 1 ATOM 2327 C CG . GLN A 1 294 ? -13.364 -6.934 9.479 1.00 67.16 ? 294 GLN A CG 1 ATOM 2328 C CD . GLN A 1 294 ? -12.602 -6.928 10.801 1.00 68.60 ? 294 GLN A CD 1 ATOM 2329 O OE1 . GLN A 1 294 ? -11.372 -6.864 10.816 1.00 69.38 ? 294 GLN A OE1 1 ATOM 2330 N NE2 . GLN A 1 294 ? -13.338 -6.983 11.916 1.00 67.38 ? 294 GLN A NE2 1 ATOM 2331 N N . GLU A 1 295 ? -11.444 -4.732 5.891 1.00 63.79 ? 295 GLU A N 1 ATOM 2332 C CA . GLU A 1 295 ? -10.574 -4.759 4.729 1.00 63.36 ? 295 GLU A CA 1 ATOM 2333 C C . GLU A 1 295 ? -9.493 -3.691 4.837 1.00 61.89 ? 295 GLU A C 1 ATOM 2334 O O . GLU A 1 295 ? -8.375 -3.885 4.378 1.00 61.12 ? 295 GLU A O 1 ATOM 2335 C CB . GLU A 1 295 ? -11.360 -4.744 3.406 1.00 63.49 ? 295 GLU A CB 1 ATOM 2336 C CG . GLU A 1 295 ? -11.646 -6.133 2.843 1.00 64.59 ? 295 GLU A CG 1 ATOM 2337 C CD . GLU A 1 295 ? -10.419 -6.721 2.178 1.00 68.45 ? 295 GLU A CD 1 ATOM 2338 O OE1 . GLU A 1 295 ? -9.373 -6.030 2.200 1.00 69.56 ? 295 GLU A OE1 1 ATOM 2339 O OE2 . GLU A 1 295 ? -10.498 -7.835 1.620 1.00 66.87 ? 295 GLU A OE2 1 ATOM 2340 N N . ALA A 1 296 ? -9.843 -2.581 5.480 1.00 60.70 ? 296 ALA A N 1 ATOM 2341 C CA . ALA A 1 296 ? -8.909 -1.485 5.721 1.00 59.37 ? 296 ALA A CA 1 ATOM 2342 C C . ALA A 1 296 ? -7.886 -1.936 6.777 1.00 58.51 ? 296 ALA A C 1 ATOM 2343 O O . ALA A 1 296 ? -6.653 -1.846 6.596 1.00 57.69 ? 296 ALA A O 1 ATOM 2344 C CB . ALA A 1 296 ? -9.684 -0.249 6.212 1.00 59.34 ? 296 ALA A CB 1 ATOM 2345 N N . ARG A 1 297 ? -8.444 -2.426 7.882 1.00 57.47 ? 297 ARG A N 1 ATOM 2346 C CA . ARG A 1 297 ? -7.704 -3.013 8.965 1.00 56.55 ? 297 ARG A CA 1 ATOM 2347 C C . ARG A 1 297 ? -6.678 -3.970 8.387 1.00 56.29 ? 297 ARG A C 1 ATOM 2348 O O . ARG A 1 297 ? -5.494 -3.868 8.674 1.00 56.02 ? 297 ARG A O 1 ATOM 2349 C CB . ARG A 1 297 ? -8.672 -3.775 9.863 1.00 56.31 ? 297 ARG A CB 1 ATOM 2350 C CG . ARG A 1 297 ? -8.012 -4.758 10.795 1.00 55.36 ? 297 ARG A CG 1 ATOM 2351 C CD . ARG A 1 297 ? -8.775 -4.949 12.104 1.00 54.32 ? 297 ARG A CD 1 ATOM 2352 N NE . ARG A 1 297 ? -8.109 -5.883 12.993 1.00 54.02 ? 297 ARG A NE 1 ATOM 2353 C CZ . ARG A 1 297 ? -8.541 -7.105 13.258 1.00 53.85 ? 297 ARG A CZ 1 ATOM 2354 N NH1 . ARG A 1 297 ? -9.666 -7.546 12.687 1.00 55.85 ? 297 ARG A NH1 1 ATOM 2355 N NH2 . ARG A 1 297 ? -7.857 -7.891 14.087 1.00 48.20 ? 297 ARG A NH2 1 ATOM 2356 N N . LYS A 1 298 ? -7.160 -4.884 7.555 1.00 56.38 ? 298 LYS A N 1 ATOM 2357 C CA . LYS A 1 298 ? -6.338 -5.871 6.895 1.00 57.02 ? 298 LYS A CA 1 ATOM 2358 C C . LYS A 1 298 ? -5.226 -5.229 6.061 1.00 57.31 ? 298 LYS A C 1 ATOM 2359 O O . LYS A 1 298 ? -4.043 -5.595 6.190 1.00 56.84 ? 298 LYS A O 1 ATOM 2360 C CB . LYS A 1 298 ? -7.208 -6.765 6.008 1.00 57.15 ? 298 LYS A CB 1 ATOM 2361 C CG . LYS A 1 298 ? -6.413 -7.691 5.124 1.00 58.45 ? 298 LYS A CG 1 ATOM 2362 C CD . LYS A 1 298 ? -7.331 -8.671 4.450 1.00 63.01 ? 298 LYS A CD 1 ATOM 2363 C CE . LYS A 1 298 ? -6.572 -9.744 3.681 1.00 63.45 ? 298 LYS A CE 1 ATOM 2364 N NZ . LYS A 1 298 ? -7.537 -10.826 3.346 1.00 63.14 ? 298 LYS A NZ 1 ATOM 2365 N N . ILE A 1 299 ? -5.583 -4.263 5.219 1.00 57.16 ? 299 ILE A N 1 ATOM 2366 C CA . ILE A 1 299 ? -4.532 -3.598 4.472 1.00 57.82 ? 299 ILE A CA 1 ATOM 2367 C C . ILE A 1 299 ? -3.579 -2.855 5.420 1.00 57.04 ? 299 ILE A C 1 ATOM 2368 O O . ILE A 1 299 ? -2.364 -2.904 5.245 1.00 58.14 ? 299 ILE A O 1 ATOM 2369 C CB . ILE A 1 299 ? -5.108 -2.661 3.406 1.00 58.23 ? 299 ILE A CB 1 ATOM 2370 C CG1 . ILE A 1 299 ? -5.777 -3.471 2.299 1.00 58.55 ? 299 ILE A CG1 1 ATOM 2371 C CG2 . ILE A 1 299 ? -3.997 -1.823 2.795 1.00 57.68 ? 299 ILE A CG2 1 ATOM 2372 C CD1 . ILE A 1 299 ? -6.211 -2.605 1.146 1.00 62.12 ? 299 ILE A CD1 1 ATOM 2373 N N . LEU A 1 300 ? -4.116 -2.189 6.440 1.00 56.03 ? 300 LEU A N 1 ATOM 2374 C CA . LEU A 1 300 ? -3.247 -1.471 7.370 1.00 54.16 ? 300 LEU A CA 1 ATOM 2375 C C . LEU A 1 300 ? -2.256 -2.420 8.012 1.00 53.94 ? 300 LEU A C 1 ATOM 2376 O O . LEU A 1 300 ? -1.068 -2.094 8.208 1.00 53.49 ? 300 LEU A O 1 ATOM 2377 C CB . LEU A 1 300 ? -4.038 -0.733 8.441 1.00 53.07 ? 300 LEU A CB 1 ATOM 2378 C CG . LEU A 1 300 ? -3.054 0.040 9.342 1.00 54.29 ? 300 LEU A CG 1 ATOM 2379 C CD1 . LEU A 1 300 ? -2.101 0.935 8.535 1.00 55.55 ? 300 LEU A CD1 1 ATOM 2380 C CD2 . LEU A 1 300 ? -3.733 0.865 10.355 1.00 54.77 ? 300 LEU A CD2 1 ATOM 2381 N N . GLY A 1 301 ? -2.747 -3.610 8.335 1.00 53.29 ? 301 GLY A N 1 ATOM 2382 C CA . GLY A 1 301 ? -1.902 -4.608 8.974 1.00 53.73 ? 301 GLY A CA 1 ATOM 2383 C C . GLY A 1 301 ? -0.761 -5.114 8.118 1.00 53.32 ? 301 GLY A C 1 ATOM 2384 O O . GLY A 1 301 ? 0.342 -5.246 8.594 1.00 53.64 ? 301 GLY A O 1 ATOM 2385 N N . ALA A 1 302 ? -1.031 -5.430 6.856 1.00 53.39 ? 302 ALA A N 1 ATOM 2386 C CA . ALA A 1 302 ? 0.045 -5.804 5.964 1.00 53.90 ? 302 ALA A CA 1 ATOM 2387 C C . ALA A 1 302 ? 1.064 -4.665 5.949 1.00 54.08 ? 302 ALA A C 1 ATOM 2388 O O . ALA A 1 302 ? 2.279 -4.907 6.090 1.00 54.54 ? 302 ALA A O 1 ATOM 2389 C CB . ALA A 1 302 ? -0.477 -6.074 4.541 1.00 53.30 ? 302 ALA A CB 1 ATOM 2390 N N . PHE A 1 303 ? 0.568 -3.439 5.767 1.00 52.84 ? 303 PHE A N 1 ATOM 2391 C CA . PHE A 1 303 ? 1.452 -2.278 5.771 1.00 53.15 ? 303 PHE A CA 1 ATOM 2392 C C . PHE A 1 303 ? 2.417 -2.342 6.948 1.00 53.58 ? 303 PHE A C 1 ATOM 2393 O O . PHE A 1 303 ? 3.626 -2.186 6.771 1.00 53.37 ? 303 PHE A O 1 ATOM 2394 C CB . PHE A 1 303 ? 0.678 -0.946 5.844 1.00 52.48 ? 303 PHE A CB 1 ATOM 2395 C CG . PHE A 1 303 ? 1.559 0.247 6.060 1.00 53.08 ? 303 PHE A CG 1 ATOM 2396 C CD1 . PHE A 1 303 ? 2.168 0.877 4.985 1.00 56.79 ? 303 PHE A CD1 1 ATOM 2397 C CD2 . PHE A 1 303 ? 1.823 0.713 7.328 1.00 51.75 ? 303 PHE A CD2 1 ATOM 2398 C CE1 . PHE A 1 303 ? 2.989 1.976 5.186 1.00 55.71 ? 303 PHE A CE1 1 ATOM 2399 C CE2 . PHE A 1 303 ? 2.631 1.772 7.529 1.00 51.81 ? 303 PHE A CE2 1 ATOM 2400 C CZ . PHE A 1 303 ? 3.219 2.410 6.465 1.00 56.38 ? 303 PHE A CZ 1 ATOM 2401 N N . ILE A 1 304 ? 1.905 -2.562 8.160 1.00 53.35 ? 304 ILE A N 1 ATOM 2402 C CA . ILE A 1 304 ? 2.829 -2.557 9.303 1.00 53.55 ? 304 ILE A CA 1 ATOM 2403 C C . ILE A 1 304 ? 3.848 -3.635 9.176 1.00 53.57 ? 304 ILE A C 1 ATOM 2404 O O . ILE A 1 304 ? 5.001 -3.434 9.471 1.00 54.94 ? 304 ILE A O 1 ATOM 2405 C CB . ILE A 1 304 ? 2.129 -2.638 10.678 1.00 53.03 ? 304 ILE A CB 1 ATOM 2406 C CG1 . ILE A 1 304 ? 1.419 -1.324 10.976 1.00 52.92 ? 304 ILE A CG1 1 ATOM 2407 C CG2 . ILE A 1 304 ? 3.141 -2.779 11.753 1.00 53.48 ? 304 ILE A CG2 1 ATOM 2408 C CD1 . ILE A 1 304 ? 0.739 -1.292 12.346 1.00 53.89 ? 304 ILE A CD1 1 ATOM 2409 N N . GLN A 1 305 ? 3.437 -4.803 8.722 1.00 54.66 ? 305 GLN A N 1 ATOM 2410 C CA . GLN A 1 305 ? 4.377 -5.905 8.623 1.00 53.95 ? 305 GLN A CA 1 ATOM 2411 C C . GLN A 1 305 ? 5.461 -5.613 7.554 1.00 54.78 ? 305 GLN A C 1 ATOM 2412 O O . GLN A 1 305 ? 6.654 -5.890 7.778 1.00 55.07 ? 305 GLN A O 1 ATOM 2413 C CB . GLN A 1 305 ? 3.649 -7.240 8.368 1.00 54.03 ? 305 GLN A CB 1 ATOM 2414 C CG . GLN A 1 305 ? 2.393 -7.562 9.233 1.00 53.51 ? 305 GLN A CG 1 ATOM 2415 C CD . GLN A 1 305 ? 1.723 -8.895 8.803 1.00 52.27 ? 305 GLN A CD 1 ATOM 2416 O OE1 . GLN A 1 305 ? 1.823 -9.286 7.652 1.00 54.24 ? 305 GLN A OE1 1 ATOM 2417 N NE2 . GLN A 1 305 ? 1.107 -9.591 9.731 1.00 51.10 ? 305 GLN A NE2 1 ATOM 2418 N N . ILE A 1 306 ? 5.093 -5.050 6.402 1.00 54.71 ? 306 ILE A N 1 ATOM 2419 C CA . ILE A 1 306 ? 6.138 -4.827 5.388 1.00 55.24 ? 306 ILE A CA 1 ATOM 2420 C C . ILE A 1 306 ? 7.144 -3.784 5.834 1.00 55.10 ? 306 ILE A C 1 ATOM 2421 O O . ILE A 1 306 ? 8.361 -4.038 5.861 1.00 54.70 ? 306 ILE A O 1 ATOM 2422 C CB . ILE A 1 306 ? 5.592 -4.513 3.944 1.00 56.34 ? 306 ILE A CB 1 ATOM 2423 C CG1 . ILE A 1 306 ? 4.945 -5.750 3.287 1.00 55.50 ? 306 ILE A CG1 1 ATOM 2424 C CG2 . ILE A 1 306 ? 6.696 -3.975 3.022 1.00 56.46 ? 306 ILE A CG2 1 ATOM 2425 C CD1 . ILE A 1 306 ? 3.456 -5.526 2.986 1.00 55.58 ? 306 ILE A CD1 1 ATOM 2426 N N . ILE A 1 307 ? 6.668 -2.619 6.229 1.00 55.17 ? 307 ILE A N 1 ATOM 2427 C CA . ILE A 1 307 ? 7.637 -1.648 6.697 1.00 56.00 ? 307 ILE A CA 1 ATOM 2428 C C . ILE A 1 307 ? 8.514 -2.215 7.832 1.00 54.64 ? 307 ILE A C 1 ATOM 2429 O O . ILE A 1 307 ? 9.704 -1.929 7.917 1.00 54.36 ? 307 ILE A O 1 ATOM 2430 C CB . ILE A 1 307 ? 6.985 -0.310 7.072 1.00 56.22 ? 307 ILE A CB 1 ATOM 2431 C CG1 . ILE A 1 307 ? 6.905 0.591 5.826 1.00 59.29 ? 307 ILE A CG1 1 ATOM 2432 C CG2 . ILE A 1 307 ? 7.876 0.443 8.027 1.00 56.92 ? 307 ILE A CG2 1 ATOM 2433 C CD1 . ILE A 1 307 ? 5.603 0.539 5.064 1.00 60.03 ? 307 ILE A CD1 1 ATOM 2434 N N . THR A 1 308 ? 7.939 -3.046 8.689 1.00 53.74 ? 308 THR A N 1 ATOM 2435 C CA . THR A 1 308 ? 8.725 -3.559 9.787 1.00 53.19 ? 308 THR A CA 1 ATOM 2436 C C . THR A 1 308 ? 9.763 -4.543 9.321 1.00 52.76 ? 308 THR A C 1 ATOM 2437 O O . THR A 1 308 ? 10.917 -4.452 9.707 1.00 52.14 ? 308 THR A O 1 ATOM 2438 C CB . THR A 1 308 ? 7.851 -4.276 10.826 1.00 53.03 ? 308 THR A CB 1 ATOM 2439 O OG1 . THR A 1 308 ? 6.958 -3.350 11.440 1.00 54.69 ? 308 THR A OG1 1 ATOM 2440 C CG2 . THR A 1 308 ? 8.727 -4.765 12.006 1.00 51.69 ? 308 THR A CG2 1 ATOM 2441 N N . PHE A 1 309 ? 9.317 -5.521 8.539 1.00 53.05 ? 309 PHE A N 1 ATOM 2442 C CA . PHE A 1 309 ? 10.186 -6.592 8.115 1.00 53.86 ? 309 PHE A CA 1 ATOM 2443 C C . PHE A 1 309 ? 11.081 -6.300 6.938 1.00 54.37 ? 309 PHE A C 1 ATOM 2444 O O . PHE A 1 309 ? 12.142 -6.859 6.871 1.00 55.47 ? 309 PHE A O 1 ATOM 2445 C CB . PHE A 1 309 ? 9.406 -7.864 7.860 1.00 53.05 ? 309 PHE A CB 1 ATOM 2446 C CG . PHE A 1 309 ? 9.152 -8.664 9.098 1.00 53.39 ? 309 PHE A CG 1 ATOM 2447 C CD1 . PHE A 1 309 ? 8.181 -8.249 10.019 1.00 51.42 ? 309 PHE A CD1 1 ATOM 2448 C CD2 . PHE A 1 309 ? 9.873 -9.831 9.347 1.00 49.18 ? 309 PHE A CD2 1 ATOM 2449 C CE1 . PHE A 1 309 ? 7.944 -8.983 11.137 1.00 51.21 ? 309 PHE A CE1 1 ATOM 2450 C CE2 . PHE A 1 309 ? 9.642 -10.563 10.485 1.00 50.53 ? 309 PHE A CE2 1 ATOM 2451 C CZ . PHE A 1 309 ? 8.670 -10.139 11.388 1.00 50.15 ? 309 PHE A CZ 1 ATOM 2452 N N . ARG A 1 310 ? 10.658 -5.457 6.015 1.00 55.53 ? 310 ARG A N 1 ATOM 2453 C CA . ARG A 1 310 ? 11.483 -5.127 4.842 1.00 57.39 ? 310 ARG A CA 1 ATOM 2454 C C . ARG A 1 310 ? 12.357 -3.885 5.087 1.00 57.52 ? 310 ARG A C 1 ATOM 2455 O O . ARG A 1 310 ? 13.566 -3.861 4.808 1.00 57.31 ? 310 ARG A O 1 ATOM 2456 C CB . ARG A 1 310 ? 10.586 -4.826 3.654 1.00 57.67 ? 310 ARG A CB 1 ATOM 2457 C CG . ARG A 1 310 ? 11.301 -4.182 2.497 1.00 59.69 ? 310 ARG A CG 1 ATOM 2458 C CD . ARG A 1 310 ? 10.357 -3.639 1.485 1.00 60.20 ? 310 ARG A CD 1 ATOM 2459 N NE . ARG A 1 310 ? 10.006 -2.279 1.850 1.00 59.98 ? 310 ARG A NE 1 ATOM 2460 C CZ . ARG A 1 310 ? 8.868 -1.675 1.550 1.00 56.49 ? 310 ARG A CZ 1 ATOM 2461 N NH1 . ARG A 1 310 ? 7.919 -2.274 0.864 1.00 57.86 ? 310 ARG A NH1 1 ATOM 2462 N NH2 . ARG A 1 310 ? 8.676 -0.438 1.940 1.00 55.41 ? 310 ARG A NH2 1 ATOM 2463 N N . ASP A 1 311 ? 11.742 -2.859 5.644 1.00 57.22 ? 311 ASP A N 1 ATOM 2464 C CA . ASP A 1 311 ? 12.492 -1.630 5.911 1.00 57.49 ? 311 ASP A CA 1 ATOM 2465 C C . ASP A 1 311 ? 13.157 -1.571 7.283 1.00 55.22 ? 311 ASP A C 1 ATOM 2466 O O . ASP A 1 311 ? 14.294 -1.134 7.365 1.00 55.24 ? 311 ASP A O 1 ATOM 2467 C CB . ASP A 1 311 ? 11.648 -0.367 5.647 1.00 56.82 ? 311 ASP A CB 1 ATOM 2468 C CG . ASP A 1 311 ? 10.907 -0.445 4.372 1.00 60.68 ? 311 ASP A CG 1 ATOM 2469 O OD1 . ASP A 1 311 ? 11.458 -0.959 3.377 1.00 68.23 ? 311 ASP A OD1 1 ATOM 2470 O OD2 . ASP A 1 311 ? 9.752 -0.024 4.235 1.00 68.42 ? 311 ASP A OD2 1 ATOM 2471 N N . TYR A 1 312 ? 12.491 -2.040 8.340 1.00 53.77 ? 312 TYR A N 1 ATOM 2472 C CA . TYR A 1 312 ? 13.043 -1.853 9.732 1.00 51.72 ? 312 TYR A CA 1 ATOM 2473 C C . TYR A 1 312 ? 14.000 -2.882 10.329 1.00 50.22 ? 312 TYR A C 1 ATOM 2474 O O . TYR A 1 312 ? 15.058 -2.541 10.879 1.00 50.23 ? 312 TYR A O 1 ATOM 2475 C CB . TYR A 1 312 ? 11.898 -1.556 10.707 1.00 51.24 ? 312 TYR A CB 1 ATOM 2476 C CG . TYR A 1 312 ? 12.302 -1.348 12.149 1.00 50.98 ? 312 TYR A CG 1 ATOM 2477 C CD1 . TYR A 1 312 ? 12.801 -0.123 12.586 1.00 50.51 ? 312 TYR A CD1 1 ATOM 2478 C CD2 . TYR A 1 312 ? 12.155 -2.370 13.088 1.00 48.15 ? 312 TYR A CD2 1 ATOM 2479 C CE1 . TYR A 1 312 ? 13.177 0.078 13.907 1.00 49.52 ? 312 TYR A CE1 1 ATOM 2480 C CE2 . TYR A 1 312 ? 12.517 -2.168 14.424 1.00 49.79 ? 312 TYR A CE2 1 ATOM 2481 C CZ . TYR A 1 312 ? 13.001 -0.932 14.822 1.00 49.46 ? 312 TYR A CZ 1 ATOM 2482 O OH . TYR A 1 312 ? 13.394 -0.744 16.118 1.00 50.04 ? 312 TYR A OH 1 ATOM 2483 N N . LEU A 1 313 ? 13.647 -4.147 10.254 1.00 49.52 ? 313 LEU A N 1 ATOM 2484 C CA . LEU A 1 313 ? 14.487 -5.171 10.893 1.00 49.50 ? 313 LEU A CA 1 ATOM 2485 C C . LEU A 1 313 ? 15.903 -5.337 10.318 1.00 48.70 ? 313 LEU A C 1 ATOM 2486 O O . LEU A 1 313 ? 16.863 -5.618 11.049 1.00 49.28 ? 313 LEU A O 1 ATOM 2487 C CB . LEU A 1 313 ? 13.762 -6.525 11.006 1.00 48.76 ? 313 LEU A CB 1 ATOM 2488 C CG . LEU A 1 313 ? 12.552 -6.471 11.962 1.00 50.14 ? 313 LEU A CG 1 ATOM 2489 C CD1 . LEU A 1 313 ? 11.818 -7.812 12.089 1.00 47.38 ? 313 LEU A CD1 1 ATOM 2490 C CD2 . LEU A 1 313 ? 12.948 -5.956 13.331 1.00 46.36 ? 313 LEU A CD2 1 ATOM 2491 N N . PRO A 1 314 ? 16.065 -5.173 9.022 1.00 47.90 ? 314 PRO A N 1 ATOM 2492 C CA . PRO A 1 314 ? 17.407 -5.285 8.472 1.00 47.78 ? 314 PRO A CA 1 ATOM 2493 C C . PRO A 1 314 ? 18.358 -4.191 8.981 1.00 47.56 ? 314 PRO A C 1 ATOM 2494 O O . PRO A 1 314 ? 19.569 -4.422 9.145 1.00 47.27 ? 314 PRO A O 1 ATOM 2495 C CB . PRO A 1 314 ? 17.169 -5.244 6.954 1.00 48.42 ? 314 PRO A CB 1 ATOM 2496 C CG . PRO A 1 314 ? 15.764 -5.663 6.784 1.00 48.09 ? 314 PRO A CG 1 ATOM 2497 C CD . PRO A 1 314 ? 15.042 -5.003 7.977 1.00 47.71 ? 314 PRO A CD 1 ATOM 2498 N N . ILE A 1 315 ? 17.853 -2.994 9.248 1.00 47.79 ? 315 ILE A N 1 ATOM 2499 C CA . ILE A 1 315 ? 18.759 -2.006 9.806 1.00 47.04 ? 315 ILE A CA 1 ATOM 2500 C C . ILE A 1 315 ? 18.870 -2.113 11.299 1.00 48.58 ? 315 ILE A C 1 ATOM 2501 O O . ILE A 1 315 ? 19.751 -1.461 11.903 1.00 49.98 ? 315 ILE A O 1 ATOM 2502 C CB . ILE A 1 315 ? 18.525 -0.567 9.338 1.00 46.68 ? 315 ILE A CB 1 ATOM 2503 C CG1 . ILE A 1 315 ? 17.172 -0.041 9.786 1.00 46.39 ? 315 ILE A CG1 1 ATOM 2504 C CG2 . ILE A 1 315 ? 18.714 -0.506 7.881 1.00 43.99 ? 315 ILE A CG2 1 ATOM 2505 C CD1 . ILE A 1 315 ? 16.733 1.153 9.096 1.00 42.08 ? 315 ILE A CD1 1 ATOM 2506 N N . VAL A 1 316 ? 18.031 -2.956 11.924 1.00 48.02 ? 316 VAL A N 1 ATOM 2507 C CA . VAL A 1 316 ? 18.278 -3.223 13.345 1.00 46.51 ? 316 VAL A CA 1 ATOM 2508 C C . VAL A 1 316 ? 19.221 -4.407 13.417 1.00 47.48 ? 316 VAL A C 1 ATOM 2509 O O . VAL A 1 316 ? 20.229 -4.416 14.115 1.00 46.88 ? 316 VAL A O 1 ATOM 2510 C CB . VAL A 1 316 ? 16.994 -3.601 14.189 1.00 46.14 ? 316 VAL A CB 1 ATOM 2511 C CG1 . VAL A 1 316 ? 17.414 -4.069 15.581 1.00 45.51 ? 316 VAL A CG1 1 ATOM 2512 C CG2 . VAL A 1 316 ? 15.992 -2.460 14.287 1.00 41.10 ? 316 VAL A CG2 1 ATOM 2513 N N . LEU A 1 317 ? 18.861 -5.446 12.704 1.00 49.30 ? 317 LEU A N 1 ATOM 2514 C CA . LEU A 1 317 ? 19.588 -6.693 12.841 1.00 50.99 ? 317 LEU A CA 1 ATOM 2515 C C . LEU A 1 317 ? 20.913 -6.676 12.056 1.00 51.46 ? 317 LEU A C 1 ATOM 2516 O O . LEU A 1 317 ? 21.951 -7.186 12.513 1.00 52.16 ? 317 LEU A O 1 ATOM 2517 C CB . LEU A 1 317 ? 18.669 -7.805 12.425 1.00 50.97 ? 317 LEU A CB 1 ATOM 2518 C CG . LEU A 1 317 ? 17.825 -8.452 13.525 1.00 51.92 ? 317 LEU A CG 1 ATOM 2519 C CD1 . LEU A 1 317 ? 17.542 -7.550 14.702 1.00 49.48 ? 317 LEU A CD1 1 ATOM 2520 C CD2 . LEU A 1 317 ? 16.551 -8.990 12.921 1.00 52.84 ? 317 LEU A CD2 1 ATOM 2521 N N . GLY A 1 318 ? 20.910 -6.003 10.923 1.00 51.81 ? 318 GLY A N 1 ATOM 2522 C CA . GLY A 1 318 ? 22.154 -5.870 10.196 1.00 53.75 ? 318 GLY A CA 1 ATOM 2523 C C . GLY A 1 318 ? 22.657 -7.213 9.722 1.00 54.70 ? 318 GLY A C 1 ATOM 2524 O O . GLY A 1 318 ? 21.922 -7.948 9.083 1.00 53.97 ? 318 GLY A O 1 ATOM 2525 N N . SER A 1 319 ? 23.894 -7.542 10.054 1.00 56.44 ? 319 SER A N 1 ATOM 2526 C CA . SER A 1 319 ? 24.475 -8.781 9.576 1.00 59.13 ? 319 SER A CA 1 ATOM 2527 C C . SER A 1 319 ? 23.797 -10.037 10.144 1.00 59.64 ? 319 SER A C 1 ATOM 2528 O O . SER A 1 319 ? 24.057 -11.165 9.685 1.00 59.84 ? 319 SER A O 1 ATOM 2529 C CB . SER A 1 319 ? 26.002 -8.815 9.839 1.00 59.46 ? 319 SER A CB 1 ATOM 2530 O OG . SER A 1 319 ? 26.353 -9.250 11.164 1.00 63.58 ? 319 SER A OG 1 ATOM 2531 N N . GLU A 1 320 ? 22.934 -9.873 11.133 1.00 59.73 ? 320 GLU A N 1 ATOM 2532 C CA . GLU A 1 320 ? 22.363 -11.066 11.734 1.00 60.59 ? 320 GLU A CA 1 ATOM 2533 C C . GLU A 1 320 ? 20.982 -11.323 11.168 1.00 60.69 ? 320 GLU A C 1 ATOM 2534 O O . GLU A 1 320 ? 20.375 -12.361 11.402 1.00 60.77 ? 320 GLU A O 1 ATOM 2535 C CB . GLU A 1 320 ? 22.327 -10.965 13.265 1.00 61.13 ? 320 GLU A CB 1 ATOM 2536 C CG . GLU A 1 320 ? 23.647 -10.630 13.962 1.00 63.12 ? 320 GLU A CG 1 ATOM 2537 C CD . GLU A 1 320 ? 24.653 -11.789 14.028 1.00 67.72 ? 320 GLU A CD 1 ATOM 2538 O OE1 . GLU A 1 320 ? 25.682 -11.653 14.756 1.00 66.79 ? 320 GLU A OE1 1 ATOM 2539 O OE2 . GLU A 1 320 ? 24.432 -12.827 13.354 1.00 65.82 ? 320 GLU A OE2 1 ATOM 2540 N N . MET A 1 321 ? 20.494 -10.364 10.412 1.00 61.36 ? 321 MET A N 1 ATOM 2541 C CA . MET A 1 321 ? 19.176 -10.465 9.836 1.00 62.76 ? 321 MET A CA 1 ATOM 2542 C C . MET A 1 321 ? 18.964 -11.832 9.182 1.00 64.38 ? 321 MET A C 1 ATOM 2543 O O . MET A 1 321 ? 18.076 -12.582 9.599 1.00 64.65 ? 321 MET A O 1 ATOM 2544 C CB . MET A 1 321 ? 18.927 -9.336 8.846 1.00 61.65 ? 321 MET A CB 1 ATOM 2545 C CG . MET A 1 321 ? 17.570 -9.423 8.130 1.00 61.53 ? 321 MET A CG 1 ATOM 2546 S SD . MET A 1 321 ? 16.195 -9.013 9.218 1.00 56.70 ? 321 MET A SD 1 ATOM 2547 C CE . MET A 1 321 ? 14.765 -8.893 8.096 1.00 56.69 ? 321 MET A CE 1 ATOM 2548 N N . GLN A 1 322 ? 19.793 -12.162 8.190 1.00 66.12 ? 322 GLN A N 1 ATOM 2549 C CA . GLN A 1 322 ? 19.661 -13.423 7.443 1.00 67.66 ? 322 GLN A CA 1 ATOM 2550 C C . GLN A 1 322 ? 19.741 -14.604 8.382 1.00 67.00 ? 322 GLN A C 1 ATOM 2551 O O . GLN A 1 322 ? 19.005 -15.566 8.243 1.00 66.55 ? 322 GLN A O 1 ATOM 2552 C CB . GLN A 1 322 ? 20.769 -13.582 6.382 1.00 68.55 ? 322 GLN A CB 1 ATOM 2553 C CG . GLN A 1 322 ? 20.515 -12.957 4.985 1.00 73.29 ? 322 GLN A CG 1 ATOM 2554 C CD . GLN A 1 322 ? 21.607 -13.364 3.963 1.00 79.03 ? 322 GLN A CD 1 ATOM 2555 O OE1 . GLN A 1 322 ? 22.813 -13.181 4.214 1.00 81.52 ? 322 GLN A OE1 1 ATOM 2556 N NE2 . GLN A 1 322 ? 21.188 -13.927 2.839 1.00 78.66 ? 322 GLN A NE2 1 ATOM 2557 N N . LYS A 1 323 ? 20.674 -14.523 9.320 1.00 67.35 ? 323 LYS A N 1 ATOM 2558 C CA . LYS A 1 323 ? 20.909 -15.584 10.294 1.00 67.67 ? 323 LYS A CA 1 ATOM 2559 C C . LYS A 1 323 ? 19.700 -15.957 11.166 1.00 67.26 ? 323 LYS A C 1 ATOM 2560 O O . LYS A 1 323 ? 19.726 -17.008 11.806 1.00 68.29 ? 323 LYS A O 1 ATOM 2561 C CB . LYS A 1 323 ? 22.043 -15.152 11.218 1.00 68.35 ? 323 LYS A CB 1 ATOM 2562 C CG . LYS A 1 323 ? 22.732 -16.277 11.997 1.00 71.19 ? 323 LYS A CG 1 ATOM 2563 C CD . LYS A 1 323 ? 23.051 -15.840 13.421 1.00 74.54 ? 323 LYS A CD 1 ATOM 2564 C CE . LYS A 1 323 ? 24.546 -15.972 13.722 1.00 78.13 ? 323 LYS A CE 1 ATOM 2565 N NZ . LYS A 1 323 ? 25.406 -15.199 12.742 1.00 78.84 ? 323 LYS A NZ 1 ATOM 2566 N N . TRP A 1 324 ? 18.674 -15.099 11.242 1.00 66.37 ? 324 TRP A N 1 ATOM 2567 C CA . TRP A 1 324 ? 17.512 -15.367 12.121 1.00 65.18 ? 324 TRP A CA 1 ATOM 2568 C C . TRP A 1 324 ? 16.195 -15.185 11.427 1.00 64.57 ? 324 TRP A C 1 ATOM 2569 O O . TRP A 1 324 ? 15.201 -15.824 11.789 1.00 64.87 ? 324 TRP A O 1 ATOM 2570 C CB . TRP A 1 324 ? 17.501 -14.489 13.380 1.00 65.07 ? 324 TRP A CB 1 ATOM 2571 C CG . TRP A 1 324 ? 18.676 -14.640 14.238 1.00 63.17 ? 324 TRP A CG 1 ATOM 2572 C CD1 . TRP A 1 324 ? 19.774 -13.838 14.272 1.00 62.78 ? 324 TRP A CD1 1 ATOM 2573 C CD2 . TRP A 1 324 ? 18.900 -15.670 15.181 1.00 63.14 ? 324 TRP A CD2 1 ATOM 2574 N NE1 . TRP A 1 324 ? 20.672 -14.298 15.203 1.00 62.97 ? 324 TRP A NE1 1 ATOM 2575 C CE2 . TRP A 1 324 ? 20.161 -15.433 15.770 1.00 64.36 ? 324 TRP A CE2 1 ATOM 2576 C CE3 . TRP A 1 324 ? 18.158 -16.770 15.605 1.00 63.92 ? 324 TRP A CE3 1 ATOM 2577 C CZ2 . TRP A 1 324 ? 20.692 -16.256 16.739 1.00 65.10 ? 324 TRP A CZ2 1 ATOM 2578 C CZ3 . TRP A 1 324 ? 18.672 -17.582 16.555 1.00 66.21 ? 324 TRP A CZ3 1 ATOM 2579 C CH2 . TRP A 1 324 ? 19.934 -17.333 17.120 1.00 67.94 ? 324 TRP A CH2 1 ATOM 2580 N N . ILE A 1 325 ? 16.158 -14.295 10.455 1.00 63.62 ? 325 ILE A N 1 ATOM 2581 C CA . ILE A 1 325 ? 14.924 -14.113 9.714 1.00 63.00 ? 325 ILE A CA 1 ATOM 2582 C C . ILE A 1 325 ? 15.235 -14.444 8.283 1.00 63.63 ? 325 ILE A C 1 ATOM 2583 O O . ILE A 1 325 ? 15.421 -13.548 7.473 1.00 62.30 ? 325 ILE A O 1 ATOM 2584 C CB . ILE A 1 325 ? 14.322 -12.674 9.813 1.00 62.95 ? 325 ILE A CB 1 ATOM 2585 C CG1 . ILE A 1 325 ? 14.068 -12.236 11.257 1.00 61.87 ? 325 ILE A CG1 1 ATOM 2586 C CG2 . ILE A 1 325 ? 13.000 -12.594 9.040 1.00 60.70 ? 325 ILE A CG2 1 ATOM 2587 C CD1 . ILE A 1 325 ? 15.272 -12.286 12.131 1.00 63.57 ? 325 ILE A CD1 1 ATOM 2588 N N . PRO A 1 326 ? 15.336 -15.742 7.995 1.00 65.02 ? 326 PRO A N 1 ATOM 2589 C CA . PRO A 1 326 ? 15.552 -16.219 6.628 1.00 65.83 ? 326 PRO A CA 1 ATOM 2590 C C . PRO A 1 326 ? 14.391 -15.668 5.864 1.00 66.82 ? 326 PRO A C 1 ATOM 2591 O O . PRO A 1 326 ? 13.403 -15.268 6.512 1.00 67.57 ? 326 PRO A O 1 ATOM 2592 C CB . PRO A 1 326 ? 15.408 -17.735 6.756 1.00 66.17 ? 326 PRO A CB 1 ATOM 2593 C CG . PRO A 1 326 ? 15.736 -18.054 8.162 1.00 65.33 ? 326 PRO A CG 1 ATOM 2594 C CD . PRO A 1 326 ? 15.275 -16.853 8.962 1.00 65.37 ? 326 PRO A CD 1 ATOM 2595 N N . PRO A 1 327 ? 14.502 -15.584 4.547 1.00 66.79 ? 327 PRO A N 1 ATOM 2596 C CA . PRO A 1 327 ? 13.403 -15.084 3.721 1.00 66.66 ? 327 PRO A CA 1 ATOM 2597 C C . PRO A 1 327 ? 12.222 -16.018 3.966 1.00 66.77 ? 327 PRO A C 1 ATOM 2598 O O . PRO A 1 327 ? 12.450 -17.137 4.405 1.00 66.87 ? 327 PRO A O 1 ATOM 2599 C CB . PRO A 1 327 ? 13.951 -15.179 2.293 1.00 66.96 ? 327 PRO A CB 1 ATOM 2600 C CG . PRO A 1 327 ? 15.444 -15.234 2.459 1.00 66.91 ? 327 PRO A CG 1 ATOM 2601 C CD . PRO A 1 327 ? 15.697 -15.933 3.769 1.00 67.64 ? 327 PRO A CD 1 ATOM 2602 N N . TYR A 1 328 ? 11.003 -15.563 3.682 1.00 66.83 ? 328 TYR A N 1 ATOM 2603 C CA . TYR A 1 328 ? 9.749 -16.272 4.007 1.00 66.28 ? 328 TYR A CA 1 ATOM 2604 C C . TYR A 1 328 ? 9.481 -17.528 3.188 1.00 66.69 ? 328 TYR A C 1 ATOM 2605 O O . TYR A 1 328 ? 9.434 -17.460 1.959 1.00 67.61 ? 328 TYR A O 1 ATOM 2606 C CB . TYR A 1 328 ? 8.590 -15.278 3.843 1.00 65.10 ? 328 TYR A CB 1 ATOM 2607 C CG . TYR A 1 328 ? 7.203 -15.688 4.308 1.00 63.56 ? 328 TYR A CG 1 ATOM 2608 C CD1 . TYR A 1 328 ? 6.970 -16.186 5.592 1.00 61.61 ? 328 TYR A CD1 1 ATOM 2609 C CD2 . TYR A 1 328 ? 6.102 -15.506 3.470 1.00 58.83 ? 328 TYR A CD2 1 ATOM 2610 C CE1 . TYR A 1 328 ? 5.671 -16.523 6.002 1.00 59.85 ? 328 TYR A CE1 1 ATOM 2611 C CE2 . TYR A 1 328 ? 4.848 -15.854 3.851 1.00 58.57 ? 328 TYR A CE2 1 ATOM 2612 C CZ . TYR A 1 328 ? 4.617 -16.361 5.119 1.00 60.70 ? 328 TYR A CZ 1 ATOM 2613 O OH . TYR A 1 328 ? 3.317 -16.691 5.477 1.00 59.40 ? 328 TYR A OH 1 ATOM 2614 N N . GLN A 1 329 ? 9.274 -18.650 3.894 1.00 66.75 ? 329 GLN A N 1 ATOM 2615 C CA . GLN A 1 329 ? 8.911 -19.966 3.343 1.00 66.20 ? 329 GLN A CA 1 ATOM 2616 C C . GLN A 1 329 ? 7.481 -20.383 3.688 1.00 65.92 ? 329 GLN A C 1 ATOM 2617 O O . GLN A 1 329 ? 7.197 -21.580 3.784 1.00 65.83 ? 329 GLN A O 1 ATOM 2618 C CB . GLN A 1 329 ? 9.809 -21.060 3.929 1.00 66.68 ? 329 GLN A CB 1 ATOM 2619 C CG . GLN A 1 329 ? 11.246 -21.067 3.436 1.00 68.18 ? 329 GLN A CG 1 ATOM 2620 C CD . GLN A 1 329 ? 11.339 -21.049 1.919 1.00 70.06 ? 329 GLN A CD 1 ATOM 2621 O OE1 . GLN A 1 329 ? 11.457 -19.974 1.313 1.00 69.16 ? 329 GLN A OE1 1 ATOM 2622 N NE2 . GLN A 1 329 ? 11.287 -22.236 1.299 1.00 70.75 ? 329 GLN A NE2 1 ATOM 2623 N N . GLY A 1 330 ? 6.594 -19.419 3.929 1.00 65.74 ? 330 GLY A N 1 ATOM 2624 C CA . GLY A 1 330 ? 5.213 -19.710 4.315 1.00 64.96 ? 330 GLY A CA 1 ATOM 2625 C C . GLY A 1 330 ? 4.868 -19.941 5.784 1.00 64.70 ? 330 GLY A C 1 ATOM 2626 O O . GLY A 1 330 ? 5.727 -20.157 6.627 1.00 63.42 ? 330 GLY A O 1 ATOM 2627 N N . TYR A 1 331 ? 3.566 -19.908 6.068 1.00 65.11 ? 331 TYR A N 1 ATOM 2628 C CA . TYR A 1 331 ? 3.012 -20.124 7.399 1.00 64.45 ? 331 TYR A CA 1 ATOM 2629 C C . TYR A 1 331 ? 3.302 -21.504 7.901 1.00 65.44 ? 331 TYR A C 1 ATOM 2630 O O . TYR A 1 331 ? 3.017 -22.513 7.241 1.00 65.70 ? 331 TYR A O 1 ATOM 2631 C CB . TYR A 1 331 ? 1.497 -19.950 7.377 1.00 64.37 ? 331 TYR A CB 1 ATOM 2632 C CG . TYR A 1 331 ? 0.768 -20.238 8.690 1.00 63.29 ? 331 TYR A CG 1 ATOM 2633 C CD1 . TYR A 1 331 ? 1.158 -19.627 9.868 1.00 63.83 ? 331 TYR A CD1 1 ATOM 2634 C CD2 . TYR A 1 331 ? -0.331 -21.104 8.734 1.00 63.20 ? 331 TYR A CD2 1 ATOM 2635 C CE1 . TYR A 1 331 ? 0.502 -19.876 11.060 1.00 63.39 ? 331 TYR A CE1 1 ATOM 2636 C CE2 . TYR A 1 331 ? -1.017 -21.368 9.924 1.00 62.12 ? 331 TYR A CE2 1 ATOM 2637 C CZ . TYR A 1 331 ? -0.595 -20.738 11.089 1.00 63.10 ? 331 TYR A CZ 1 ATOM 2638 O OH . TYR A 1 331 ? -1.222 -20.955 12.287 1.00 57.09 ? 331 TYR A OH 1 ATOM 2639 N N . ASN A 1 332 ? 3.840 -21.550 9.101 1.00 65.42 ? 332 ASN A N 1 ATOM 2640 C CA . ASN A 1 332 ? 4.079 -22.795 9.760 1.00 66.01 ? 332 ASN A CA 1 ATOM 2641 C C . ASN A 1 332 ? 3.282 -22.804 11.086 1.00 66.11 ? 332 ASN A C 1 ATOM 2642 O O . ASN A 1 332 ? 3.545 -22.021 11.999 1.00 66.34 ? 332 ASN A O 1 ATOM 2643 C CB . ASN A 1 332 ? 5.570 -22.925 9.995 1.00 66.37 ? 332 ASN A CB 1 ATOM 2644 C CG . ASN A 1 332 ? 5.913 -24.076 10.868 1.00 67.84 ? 332 ASN A CG 1 ATOM 2645 O OD1 . ASN A 1 332 ? 5.038 -24.724 11.447 1.00 63.99 ? 332 ASN A OD1 1 ATOM 2646 N ND2 . ASN A 1 332 ? 7.207 -24.330 10.988 1.00 73.90 ? 332 ASN A ND2 1 ATOM 2647 N N . ASN A 1 333 ? 2.304 -23.695 11.176 1.00 65.67 ? 333 ASN A N 1 ATOM 2648 C CA . ASN A 1 333 ? 1.411 -23.760 12.327 1.00 65.07 ? 333 ASN A CA 1 ATOM 2649 C C . ASN A 1 333 ? 2.029 -24.369 13.556 1.00 63.57 ? 333 ASN A C 1 ATOM 2650 O O . ASN A 1 333 ? 1.392 -24.415 14.606 1.00 63.52 ? 333 ASN A O 1 ATOM 2651 C CB . ASN A 1 333 ? 0.185 -24.606 11.988 1.00 65.57 ? 333 ASN A CB 1 ATOM 2652 C CG . ASN A 1 333 ? 0.517 -26.073 11.946 1.00 67.39 ? 333 ASN A CG 1 ATOM 2653 O OD1 . ASN A 1 333 ? 0.879 -26.615 10.902 1.00 68.26 ? 333 ASN A OD1 1 ATOM 2654 N ND2 . ASN A 1 333 ? 0.435 -26.723 13.101 1.00 71.76 ? 333 ASN A ND2 1 ATOM 2655 N N . SER A 1 334 ? 3.240 -24.892 13.422 1.00 62.70 ? 334 SER A N 1 ATOM 2656 C CA . SER A 1 334 ? 3.914 -25.514 14.544 1.00 60.83 ? 334 SER A CA 1 ATOM 2657 C C . SER A 1 334 ? 4.702 -24.478 15.295 1.00 59.78 ? 334 SER A C 1 ATOM 2658 O O . SER A 1 334 ? 5.185 -24.729 16.379 1.00 59.97 ? 334 SER A O 1 ATOM 2659 C CB . SER A 1 334 ? 4.825 -26.643 14.068 1.00 61.39 ? 334 SER A CB 1 ATOM 2660 O OG . SER A 1 334 ? 4.188 -27.902 14.181 1.00 61.77 ? 334 SER A OG 1 ATOM 2661 N N . VAL A 1 335 ? 4.841 -23.296 14.718 1.00 58.50 ? 335 VAL A N 1 ATOM 2662 C CA . VAL A 1 335 ? 5.563 -22.214 15.406 1.00 57.14 ? 335 VAL A CA 1 ATOM 2663 C C . VAL A 1 335 ? 4.794 -21.473 16.535 1.00 55.98 ? 335 VAL A C 1 ATOM 2664 O O . VAL A 1 335 ? 3.624 -21.112 16.365 1.00 55.81 ? 335 VAL A O 1 ATOM 2665 C CB . VAL A 1 335 ? 6.048 -21.190 14.362 1.00 57.05 ? 335 VAL A CB 1 ATOM 2666 C CG1 . VAL A 1 335 ? 6.558 -19.894 15.048 1.00 55.61 ? 335 VAL A CG1 1 ATOM 2667 C CG2 . VAL A 1 335 ? 7.114 -21.825 13.494 1.00 53.96 ? 335 VAL A CG2 1 ATOM 2668 N N . ASP A 1 336 ? 5.443 -21.244 17.673 1.00 54.61 ? 336 ASP A N 1 ATOM 2669 C CA . ASP A 1 336 ? 4.845 -20.426 18.766 1.00 53.33 ? 336 ASP A CA 1 ATOM 2670 C C . ASP A 1 336 ? 4.926 -18.923 18.444 1.00 52.09 ? 336 ASP A C 1 ATOM 2671 O O . ASP A 1 336 ? 5.990 -18.354 18.423 1.00 52.38 ? 336 ASP A O 1 ATOM 2672 C CB . ASP A 1 336 ? 5.568 -20.704 20.082 1.00 53.47 ? 336 ASP A CB 1 ATOM 2673 C CG . ASP A 1 336 ? 4.954 -19.971 21.284 1.00 53.21 ? 336 ASP A CG 1 ATOM 2674 O OD1 . ASP A 1 336 ? 3.923 -19.303 21.147 1.00 53.97 ? 336 ASP A OD1 1 ATOM 2675 O OD2 . ASP A 1 336 ? 5.456 -20.008 22.416 1.00 51.78 ? 336 ASP A OD2 1 ATOM 2676 N N . PRO A 1 337 ? 3.814 -18.267 18.165 1.00 51.81 ? 337 PRO A N 1 ATOM 2677 C CA . PRO A 1 337 ? 3.864 -16.844 17.797 1.00 51.49 ? 337 PRO A CA 1 ATOM 2678 C C . PRO A 1 337 ? 3.690 -15.870 18.980 1.00 51.81 ? 337 PRO A C 1 ATOM 2679 O O . PRO A 1 337 ? 3.453 -14.643 18.764 1.00 52.11 ? 337 PRO A O 1 ATOM 2680 C CB . PRO A 1 337 ? 2.690 -16.720 16.874 1.00 51.60 ? 337 PRO A CB 1 ATOM 2681 C CG . PRO A 1 337 ? 1.658 -17.614 17.603 1.00 52.04 ? 337 PRO A CG 1 ATOM 2682 C CD . PRO A 1 337 ? 2.435 -18.798 18.141 1.00 51.19 ? 337 PRO A CD 1 ATOM 2683 N N . ARG A 1 338 ? 3.789 -16.406 20.198 1.00 50.06 ? 338 ARG A N 1 ATOM 2684 C CA . ARG A 1 338 ? 3.659 -15.602 21.400 1.00 49.01 ? 338 ARG A CA 1 ATOM 2685 C C . ARG A 1 338 ? 4.945 -14.776 21.687 1.00 47.78 ? 338 ARG A C 1 ATOM 2686 O O . ARG A 1 338 ? 6.054 -15.307 21.554 1.00 46.80 ? 338 ARG A O 1 ATOM 2687 C CB . ARG A 1 338 ? 3.466 -16.544 22.589 1.00 48.56 ? 338 ARG A CB 1 ATOM 2688 C CG . ARG A 1 338 ? 2.056 -16.875 23.013 1.00 47.26 ? 338 ARG A CG 1 ATOM 2689 C CD . ARG A 1 338 ? 1.991 -17.901 24.172 1.00 43.29 ? 338 ARG A CD 1 ATOM 2690 N NE . ARG A 1 338 ? 2.865 -19.049 23.930 1.00 42.40 ? 338 ARG A NE 1 ATOM 2691 C CZ . ARG A 1 338 ? 3.379 -19.798 24.887 1.00 46.67 ? 338 ARG A CZ 1 ATOM 2692 N NH1 . ARG A 1 338 ? 3.099 -19.526 26.167 1.00 49.37 ? 338 ARG A NH1 1 ATOM 2693 N NH2 . ARG A 1 338 ? 4.180 -20.817 24.585 1.00 47.12 ? 338 ARG A NH2 1 ATOM 2694 N N . ILE A 1 339 ? 4.790 -13.525 22.141 1.00 45.64 ? 339 ILE A N 1 ATOM 2695 C CA . ILE A 1 339 ? 5.931 -12.722 22.584 1.00 42.67 ? 339 ILE A CA 1 ATOM 2696 C C . ILE A 1 339 ? 6.522 -13.394 23.817 1.00 42.85 ? 339 ILE A C 1 ATOM 2697 O O . ILE A 1 339 ? 5.806 -13.785 24.733 1.00 41.81 ? 339 ILE A O 1 ATOM 2698 C CB . ILE A 1 339 ? 5.478 -11.286 22.909 1.00 41.79 ? 339 ILE A CB 1 ATOM 2699 C CG1 . ILE A 1 339 ? 4.981 -10.635 21.641 1.00 42.04 ? 339 ILE A CG1 1 ATOM 2700 C CG2 . ILE A 1 339 ? 6.590 -10.431 23.452 1.00 38.96 ? 339 ILE A CG2 1 ATOM 2701 C CD1 . ILE A 1 339 ? 5.953 -10.761 20.420 1.00 40.21 ? 339 ILE A CD1 1 ATOM 2702 N N . SER A 1 340 ? 7.840 -13.525 23.846 1.00 41.72 ? 340 SER A N 1 ATOM 2703 C CA . SER A 1 340 ? 8.475 -14.075 25.002 1.00 40.80 ? 340 SER A CA 1 ATOM 2704 C C . SER A 1 340 ? 8.567 -13.007 26.084 1.00 42.06 ? 340 SER A C 1 ATOM 2705 O O . SER A 1 340 ? 8.385 -11.816 25.824 1.00 41.65 ? 340 SER A O 1 ATOM 2706 C CB . SER A 1 340 ? 9.845 -14.641 24.640 1.00 42.02 ? 340 SER A CB 1 ATOM 2707 O OG . SER A 1 340 ? 10.796 -13.671 24.157 1.00 39.11 ? 340 SER A OG 1 ATOM 2708 N N . ASN A 1 341 ? 8.859 -13.419 27.311 1.00 41.84 ? 341 ASN A N 1 ATOM 2709 C CA . ASN A 1 341 ? 8.956 -12.451 28.365 1.00 42.01 ? 341 ASN A CA 1 ATOM 2710 C C . ASN A 1 341 ? 10.298 -11.740 28.190 1.00 42.56 ? 341 ASN A C 1 ATOM 2711 O O . ASN A 1 341 ? 10.379 -10.552 28.471 1.00 44.46 ? 341 ASN A O 1 ATOM 2712 C CB . ASN A 1 341 ? 8.752 -13.110 29.755 1.00 41.15 ? 341 ASN A CB 1 ATOM 2713 C CG . ASN A 1 341 ? 8.371 -12.098 30.859 1.00 41.13 ? 341 ASN A CG 1 ATOM 2714 O OD1 . ASN A 1 341 ? 8.662 -10.919 30.747 1.00 45.74 ? 341 ASN A OD1 1 ATOM 2715 N ND2 . ASN A 1 341 ? 7.699 -12.562 31.907 1.00 35.54 ? 341 ASN A ND2 1 ATOM 2716 N N . VAL A 1 342 ? 11.334 -12.409 27.687 1.00 41.53 ? 342 VAL A N 1 ATOM 2717 C CA . VAL A 1 342 ? 12.619 -11.716 27.489 1.00 40.47 ? 342 VAL A CA 1 ATOM 2718 C C . VAL A 1 342 ? 12.562 -10.714 26.283 1.00 41.27 ? 342 VAL A C 1 ATOM 2719 O O . VAL A 1 342 ? 13.195 -9.680 26.293 1.00 40.92 ? 342 VAL A O 1 ATOM 2720 C CB . VAL A 1 342 ? 13.822 -12.675 27.348 1.00 39.77 ? 342 VAL A CB 1 ATOM 2721 C CG1 . VAL A 1 342 ? 13.812 -13.295 25.984 1.00 40.54 ? 342 VAL A CG1 1 ATOM 2722 C CG2 . VAL A 1 342 ? 15.199 -11.936 27.533 1.00 39.43 ? 342 VAL A CG2 1 ATOM 2723 N N . PHE A 1 343 ? 11.773 -10.980 25.254 1.00 42.00 ? 343 PHE A N 1 ATOM 2724 C CA . PHE A 1 343 ? 11.636 -9.960 24.192 1.00 42.29 ? 343 PHE A CA 1 ATOM 2725 C C . PHE A 1 343 ? 11.207 -8.580 24.719 1.00 43.40 ? 343 PHE A C 1 ATOM 2726 O O . PHE A 1 343 ? 11.570 -7.534 24.141 1.00 43.75 ? 343 PHE A O 1 ATOM 2727 C CB . PHE A 1 343 ? 10.545 -10.382 23.210 1.00 41.04 ? 343 PHE A CB 1 ATOM 2728 C CG . PHE A 1 343 ? 10.413 -9.508 22.005 1.00 39.22 ? 343 PHE A CG 1 ATOM 2729 C CD1 . PHE A 1 343 ? 11.344 -9.545 20.996 1.00 39.72 ? 343 PHE A CD1 1 ATOM 2730 C CD2 . PHE A 1 343 ? 9.284 -8.714 21.828 1.00 40.36 ? 343 PHE A CD2 1 ATOM 2731 C CE1 . PHE A 1 343 ? 11.145 -8.790 19.830 1.00 38.98 ? 343 PHE A CE1 1 ATOM 2732 C CE2 . PHE A 1 343 ? 9.109 -7.969 20.750 1.00 36.00 ? 343 PHE A CE2 1 ATOM 2733 C CZ . PHE A 1 343 ? 10.049 -8.007 19.711 1.00 38.24 ? 343 PHE A CZ 1 ATOM 2734 N N . THR A 1 344 ? 10.389 -8.546 25.766 1.00 42.95 ? 344 THR A N 1 ATOM 2735 C CA . THR A 1 344 ? 9.879 -7.239 26.143 1.00 44.41 ? 344 THR A CA 1 ATOM 2736 C C . THR A 1 344 ? 10.991 -6.499 26.859 1.00 44.71 ? 344 THR A C 1 ATOM 2737 O O . THR A 1 344 ? 10.916 -5.327 27.147 1.00 46.42 ? 344 THR A O 1 ATOM 2738 C CB . THR A 1 344 ? 8.536 -7.295 26.916 1.00 44.79 ? 344 THR A CB 1 ATOM 2739 O OG1 . THR A 1 344 ? 8.710 -8.009 28.132 1.00 43.32 ? 344 THR A OG1 1 ATOM 2740 C CG2 . THR A 1 344 ? 7.528 -8.210 26.201 1.00 43.35 ? 344 THR A CG2 1 ATOM 2741 N N . PHE A 1 345 ? 12.072 -7.171 27.142 1.00 44.63 ? 345 PHE A N 1 ATOM 2742 C CA . PHE A 1 345 ? 13.165 -6.384 27.693 1.00 44.34 ? 345 PHE A CA 1 ATOM 2743 C C . PHE A 1 345 ? 14.131 -6.089 26.560 1.00 43.22 ? 345 PHE A C 1 ATOM 2744 O O . PHE A 1 345 ? 14.517 -4.957 26.392 1.00 43.26 ? 345 PHE A O 1 ATOM 2745 C CB . PHE A 1 345 ? 13.782 -7.070 28.895 1.00 45.43 ? 345 PHE A CB 1 ATOM 2746 C CG . PHE A 1 345 ? 12.825 -7.151 30.029 1.00 46.23 ? 345 PHE A CG 1 ATOM 2747 C CD1 . PHE A 1 345 ? 12.220 -8.333 30.349 1.00 46.34 ? 345 PHE A CD1 1 ATOM 2748 C CD2 . PHE A 1 345 ? 12.475 -6.002 30.727 1.00 48.79 ? 345 PHE A CD2 1 ATOM 2749 C CE1 . PHE A 1 345 ? 11.289 -8.407 31.371 1.00 47.08 ? 345 PHE A CE1 1 ATOM 2750 C CE2 . PHE A 1 345 ? 11.524 -6.075 31.758 1.00 50.50 ? 345 PHE A CE2 1 ATOM 2751 C CZ . PHE A 1 345 ? 10.956 -7.294 32.077 1.00 47.18 ? 345 PHE A CZ 1 ATOM 2752 N N . ALA A 1 346 ? 14.365 -7.083 25.707 1.00 41.05 ? 346 ALA A N 1 ATOM 2753 C CA . ALA A 1 346 ? 15.256 -6.955 24.577 1.00 40.35 ? 346 ALA A CA 1 ATOM 2754 C C . ALA A 1 346 ? 14.923 -5.761 23.701 1.00 40.09 ? 346 ALA A C 1 ATOM 2755 O O . ALA A 1 346 ? 15.800 -5.027 23.281 1.00 39.92 ? 346 ALA A O 1 ATOM 2756 C CB . ALA A 1 346 ? 15.207 -8.203 23.783 1.00 39.72 ? 346 ALA A CB 1 ATOM 2757 N N . PHE A 1 347 ? 13.648 -5.568 23.433 1.00 40.49 ? 347 PHE A N 1 ATOM 2758 C CA . PHE A 1 347 ? 13.204 -4.524 22.557 1.00 41.38 ? 347 PHE A CA 1 ATOM 2759 C C . PHE A 1 347 ? 13.340 -3.217 23.276 1.00 42.13 ? 347 PHE A C 1 ATOM 2760 O O . PHE A 1 347 ? 13.162 -2.152 22.705 1.00 43.09 ? 347 PHE A O 1 ATOM 2761 C CB . PHE A 1 347 ? 11.770 -4.773 22.167 1.00 43.78 ? 347 PHE A CB 1 ATOM 2762 C CG . PHE A 1 347 ? 11.417 -4.302 20.789 1.00 43.68 ? 347 PHE A CG 1 ATOM 2763 C CD1 . PHE A 1 347 ? 12.307 -3.514 20.061 1.00 45.47 ? 347 PHE A CD1 1 ATOM 2764 C CD2 . PHE A 1 347 ? 10.170 -4.591 20.259 1.00 42.41 ? 347 PHE A CD2 1 ATOM 2765 C CE1 . PHE A 1 347 ? 11.965 -3.063 18.775 1.00 49.07 ? 347 PHE A CE1 1 ATOM 2766 C CE2 . PHE A 1 347 ? 9.821 -4.149 18.980 1.00 44.77 ? 347 PHE A CE2 1 ATOM 2767 C CZ . PHE A 1 347 ? 10.723 -3.393 18.238 1.00 46.19 ? 347 PHE A CZ 1 ATOM 2768 N N . ARG A 1 348 ? 13.773 -3.257 24.517 1.00 41.57 ? 348 ARG A N 1 ATOM 2769 C CA . ARG A 1 348 ? 13.918 -1.994 25.169 1.00 42.03 ? 348 ARG A CA 1 ATOM 2770 C C . ARG A 1 348 ? 15.223 -1.348 24.737 1.00 41.96 ? 348 ARG A C 1 ATOM 2771 O O . ARG A 1 348 ? 15.645 -0.373 25.338 1.00 42.89 ? 348 ARG A O 1 ATOM 2772 C CB . ARG A 1 348 ? 13.825 -2.179 26.700 1.00 42.02 ? 348 ARG A CB 1 ATOM 2773 C CG . ARG A 1 348 ? 12.363 -2.355 27.154 1.00 44.38 ? 348 ARG A CG 1 ATOM 2774 C CD . ARG A 1 348 ? 12.149 -2.507 28.642 1.00 47.25 ? 348 ARG A CD 1 ATOM 2775 N NE . ARG A 1 348 ? 10.880 -3.188 28.913 1.00 45.69 ? 348 ARG A NE 1 ATOM 2776 C CZ . ARG A 1 348 ? 10.226 -3.092 30.058 1.00 47.65 ? 348 ARG A CZ 1 ATOM 2777 N NH1 . ARG A 1 348 ? 10.697 -2.325 31.041 1.00 42.23 ? 348 ARG A NH1 1 ATOM 2778 N NH2 . ARG A 1 348 ? 9.081 -3.751 30.212 1.00 50.32 ? 348 ARG A NH2 1 ATOM 2779 N N . PHE A 1 349 ? 15.887 -1.889 23.716 1.00 40.69 ? 349 PHE A N 1 ATOM 2780 C CA . PHE A 1 349 ? 17.161 -1.286 23.277 1.00 38.47 ? 349 PHE A CA 1 ATOM 2781 C C . PHE A 1 349 ? 16.834 0.094 22.740 1.00 37.28 ? 349 PHE A C 1 ATOM 2782 O O . PHE A 1 349 ? 17.654 0.998 22.707 1.00 37.32 ? 349 PHE A O 1 ATOM 2783 C CB . PHE A 1 349 ? 17.826 -2.150 22.195 1.00 37.81 ? 349 PHE A CB 1 ATOM 2784 C CG . PHE A 1 349 ? 17.094 -2.133 20.903 1.00 36.63 ? 349 PHE A CG 1 ATOM 2785 C CD1 . PHE A 1 349 ? 17.172 -1.041 20.069 1.00 35.89 ? 349 PHE A CD1 1 ATOM 2786 C CD2 . PHE A 1 349 ? 16.321 -3.210 20.496 1.00 38.59 ? 349 PHE A CD2 1 ATOM 2787 C CE1 . PHE A 1 349 ? 16.455 -1.017 18.939 1.00 32.31 ? 349 PHE A CE1 1 ATOM 2788 C CE2 . PHE A 1 349 ? 15.638 -3.186 19.258 1.00 33.68 ? 349 PHE A CE2 1 ATOM 2789 C CZ . PHE A 1 349 ? 15.708 -2.108 18.517 1.00 32.37 ? 349 PHE A CZ 1 ATOM 2790 N N . GLY A 1 350 ? 15.585 0.264 22.372 1.00 36.62 ? 350 GLY A N 1 ATOM 2791 C CA . GLY A 1 350 ? 15.115 1.525 21.826 1.00 37.59 ? 350 GLY A CA 1 ATOM 2792 C C . GLY A 1 350 ? 15.311 2.730 22.744 1.00 38.90 ? 350 GLY A C 1 ATOM 2793 O O . GLY A 1 350 ? 15.322 3.859 22.264 1.00 37.56 ? 350 GLY A O 1 ATOM 2794 N N . HIS A 1 351 ? 15.397 2.463 24.055 1.00 39.13 ? 351 HIS A N 1 ATOM 2795 C CA . HIS A 1 351 ? 15.581 3.475 25.075 1.00 40.79 ? 351 HIS A CA 1 ATOM 2796 C C . HIS A 1 351 ? 16.910 4.251 24.939 1.00 42.23 ? 351 HIS A C 1 ATOM 2797 O O . HIS A 1 351 ? 16.964 5.448 25.217 1.00 43.31 ? 351 HIS A O 1 ATOM 2798 C CB . HIS A 1 351 ? 15.463 2.786 26.446 1.00 38.84 ? 351 HIS A CB 1 ATOM 2799 C CG . HIS A 1 351 ? 14.059 2.407 26.766 1.00 38.47 ? 351 HIS A CG 1 ATOM 2800 N ND1 . HIS A 1 351 ? 13.718 1.581 27.810 1.00 37.15 ? 351 HIS A ND1 1 ATOM 2801 C CD2 . HIS A 1 351 ? 12.893 2.730 26.138 1.00 35.36 ? 351 HIS A CD2 1 ATOM 2802 C CE1 . HIS A 1 351 ? 12.403 1.417 27.809 1.00 39.36 ? 351 HIS A CE1 1 ATOM 2803 N NE2 . HIS A 1 351 ? 11.887 2.090 26.794 1.00 32.18 ? 351 HIS A NE2 1 ATOM 2804 N N . MET A 1 352 ? 17.953 3.579 24.456 1.00 43.18 ? 352 MET A N 1 ATOM 2805 C CA . MET A 1 352 ? 19.242 4.235 24.216 1.00 43.76 ? 352 MET A CA 1 ATOM 2806 C C . MET A 1 352 ? 19.209 4.943 22.861 1.00 43.82 ? 352 MET A C 1 ATOM 2807 O O . MET A 1 352 ? 20.247 5.515 22.412 1.00 44.36 ? 352 MET A O 1 ATOM 2808 C CB . MET A 1 352 ? 20.349 3.195 24.242 1.00 43.52 ? 352 MET A CB 1 ATOM 2809 C CG . MET A 1 352 ? 20.061 2.137 25.301 1.00 48.36 ? 352 MET A CG 1 ATOM 2810 S SD . MET A 1 352 ? 21.542 1.701 25.990 1.00 56.82 ? 352 MET A SD 1 ATOM 2811 C CE . MET A 1 352 ? 21.092 0.688 27.542 1.00 51.53 ? 352 MET A CE 1 ATOM 2812 N N . GLU A 1 353 ? 18.039 4.930 22.212 1.00 39.47 ? 353 GLU A N 1 ATOM 2813 C CA . GLU A 1 353 ? 17.973 5.564 20.926 1.00 38.92 ? 353 GLU A CA 1 ATOM 2814 C C . GLU A 1 353 ? 17.236 6.882 20.906 1.00 38.82 ? 353 GLU A C 1 ATOM 2815 O O . GLU A 1 353 ? 17.188 7.553 19.862 1.00 38.74 ? 353 GLU A O 1 ATOM 2816 C CB . GLU A 1 353 ? 17.392 4.625 19.855 1.00 39.72 ? 353 GLU A CB 1 ATOM 2817 C CG . GLU A 1 353 ? 18.274 3.434 19.527 1.00 38.97 ? 353 GLU A CG 1 ATOM 2818 C CD . GLU A 1 353 ? 17.615 2.540 18.501 1.00 48.54 ? 353 GLU A CD 1 ATOM 2819 O OE1 . GLU A 1 353 ? 16.488 2.872 17.972 1.00 43.93 ? 353 GLU A OE1 1 ATOM 2820 O OE2 . GLU A 1 353 ? 18.239 1.477 18.230 1.00 51.26 ? 353 GLU A OE2 1 ATOM 2821 N N . VAL A 1 354 ? 16.678 7.237 22.053 1.00 37.81 ? 354 VAL A N 1 ATOM 2822 C CA . VAL A 1 354 ? 15.870 8.399 22.207 1.00 37.72 ? 354 VAL A CA 1 ATOM 2823 C C . VAL A 1 354 ? 16.767 9.547 22.552 1.00 39.21 ? 354 VAL A C 1 ATOM 2824 O O . VAL A 1 354 ? 17.603 9.468 23.434 1.00 38.58 ? 354 VAL A O 1 ATOM 2825 C CB . VAL A 1 354 ? 14.798 8.193 23.342 1.00 38.89 ? 354 VAL A CB 1 ATOM 2826 C CG1 . VAL A 1 354 ? 13.938 9.465 23.535 1.00 36.58 ? 354 VAL A CG1 1 ATOM 2827 C CG2 . VAL A 1 354 ? 13.944 6.871 23.108 1.00 33.58 ? 354 VAL A CG2 1 ATOM 2828 N N . PRO A 1 355 ? 16.655 10.617 21.798 1.00 39.99 ? 355 PRO A N 1 ATOM 2829 C CA . PRO A 1 355 ? 17.530 11.746 22.014 1.00 41.61 ? 355 PRO A CA 1 ATOM 2830 C C . PRO A 1 355 ? 16.861 12.725 22.971 1.00 42.31 ? 355 PRO A C 1 ATOM 2831 O O . PRO A 1 355 ? 15.663 12.583 23.286 1.00 43.16 ? 355 PRO A O 1 ATOM 2832 C CB . PRO A 1 355 ? 17.641 12.340 20.617 1.00 40.70 ? 355 PRO A CB 1 ATOM 2833 C CG . PRO A 1 355 ? 16.522 11.851 19.904 1.00 39.30 ? 355 PRO A CG 1 ATOM 2834 C CD . PRO A 1 355 ? 15.789 10.831 20.645 1.00 40.10 ? 355 PRO A CD 1 ATOM 2835 N N . SER A 1 356 ? 17.610 13.713 23.413 1.00 41.95 ? 356 SER A N 1 ATOM 2836 C CA . SER A 1 356 ? 17.083 14.652 24.411 1.00 42.14 ? 356 SER A CA 1 ATOM 2837 C C . SER A 1 356 ? 16.116 15.736 23.908 1.00 41.94 ? 356 SER A C 1 ATOM 2838 O O . SER A 1 356 ? 15.509 16.402 24.704 1.00 42.24 ? 356 SER A O 1 ATOM 2839 C CB . SER A 1 356 ? 18.225 15.348 25.057 1.00 41.03 ? 356 SER A CB 1 ATOM 2840 O OG . SER A 1 356 ? 18.812 16.171 24.081 1.00 45.02 ? 356 SER A OG 1 ATOM 2841 N N . THR A 1 357 ? 15.979 15.933 22.605 1.00 42.17 ? 357 THR A N 1 ATOM 2842 C CA . THR A 1 357 ? 15.086 16.993 22.128 1.00 43.52 ? 357 THR A CA 1 ATOM 2843 C C . THR A 1 357 ? 14.278 16.543 20.925 1.00 43.28 ? 357 THR A C 1 ATOM 2844 O O . THR A 1 357 ? 14.661 15.599 20.231 1.00 42.95 ? 357 THR A O 1 ATOM 2845 C CB . THR A 1 357 ? 15.890 18.220 21.729 1.00 43.54 ? 357 THR A CB 1 ATOM 2846 O OG1 . THR A 1 357 ? 16.672 17.887 20.562 1.00 45.54 ? 357 THR A OG1 1 ATOM 2847 C CG2 . THR A 1 357 ? 16.921 18.541 22.785 1.00 43.45 ? 357 THR A CG2 1 ATOM 2848 N N . VAL A 1 358 ? 13.173 17.242 20.690 1.00 43.89 ? 358 VAL A N 1 ATOM 2849 C CA . VAL A 1 358 ? 12.274 17.000 19.584 1.00 43.61 ? 358 VAL A CA 1 ATOM 2850 C C . VAL A 1 358 ? 12.054 18.320 18.927 1.00 44.35 ? 358 VAL A C 1 ATOM 2851 O O . VAL A 1 358 ? 11.803 19.293 19.583 1.00 44.82 ? 358 VAL A O 1 ATOM 2852 C CB . VAL A 1 358 ? 10.898 16.559 20.083 1.00 44.13 ? 358 VAL A CB 1 ATOM 2853 C CG1 . VAL A 1 358 ? 9.828 16.702 18.974 1.00 43.68 ? 358 VAL A CG1 1 ATOM 2854 C CG2 . VAL A 1 358 ? 10.926 15.127 20.645 1.00 44.02 ? 358 VAL A CG2 1 ATOM 2855 N N . SER A 1 359 ? 12.062 18.351 17.610 1.00 46.13 ? 359 SER A N 1 ATOM 2856 C CA . SER A 1 359 ? 11.837 19.588 16.868 1.00 47.29 ? 359 SER A CA 1 ATOM 2857 C C . SER A 1 359 ? 10.605 19.585 15.966 1.00 48.34 ? 359 SER A C 1 ATOM 2858 O O . SER A 1 359 ? 10.089 18.575 15.578 1.00 48.44 ? 359 SER A O 1 ATOM 2859 C CB . SER A 1 359 ? 13.025 19.863 15.945 1.00 46.64 ? 359 SER A CB 1 ATOM 2860 O OG . SER A 1 359 ? 14.243 19.872 16.640 1.00 46.39 ? 359 SER A OG 1 ATOM 2861 N N . ARG A 1 360 ? 10.205 20.768 15.563 1.00 50.18 ? 360 ARG A N 1 ATOM 2862 C CA . ARG A 1 360 ? 9.104 20.923 14.654 1.00 52.26 ? 360 ARG A CA 1 ATOM 2863 C C . ARG A 1 360 ? 9.684 21.807 13.581 1.00 53.44 ? 360 ARG A C 1 ATOM 2864 O O . ARG A 1 360 ? 10.437 22.758 13.885 1.00 52.49 ? 360 ARG A O 1 ATOM 2865 C CB . ARG A 1 360 ? 7.951 21.564 15.411 1.00 53.07 ? 360 ARG A CB 1 ATOM 2866 C CG . ARG A 1 360 ? 7.754 20.749 16.669 1.00 51.71 ? 360 ARG A CG 1 ATOM 2867 C CD . ARG A 1 360 ? 6.970 21.317 17.689 1.00 51.30 ? 360 ARG A CD 1 ATOM 2868 N NE . ARG A 1 360 ? 7.651 22.409 18.354 1.00 52.79 ? 360 ARG A NE 1 ATOM 2869 C CZ . ARG A 1 360 ? 6.972 23.361 18.988 1.00 53.45 ? 360 ARG A CZ 1 ATOM 2870 N NH1 . ARG A 1 360 ? 5.647 23.272 19.049 1.00 53.37 ? 360 ARG A NH1 1 ATOM 2871 N NH2 . ARG A 1 360 ? 7.595 24.376 19.558 1.00 52.78 ? 360 ARG A NH2 1 ATOM 2872 N N . LEU A 1 361 ? 9.396 21.418 12.344 1.00 54.78 ? 361 LEU A N 1 ATOM 2873 C CA . LEU A 1 361 ? 9.982 22.020 11.153 1.00 57.19 ? 361 LEU A CA 1 ATOM 2874 C C . LEU A 1 361 ? 8.914 22.412 10.149 1.00 58.61 ? 361 LEU A C 1 ATOM 2875 O O . LEU A 1 361 ? 7.955 21.645 9.911 1.00 58.77 ? 361 LEU A O 1 ATOM 2876 C CB . LEU A 1 361 ? 10.956 21.046 10.493 1.00 56.64 ? 361 LEU A CB 1 ATOM 2877 C CG . LEU A 1 361 ? 12.005 20.456 11.448 1.00 58.43 ? 361 LEU A CG 1 ATOM 2878 C CD1 . LEU A 1 361 ? 12.969 19.560 10.710 1.00 58.62 ? 361 LEU A CD1 1 ATOM 2879 C CD2 . LEU A 1 361 ? 12.787 21.583 12.094 1.00 58.02 ? 361 LEU A CD2 1 ATOM 2880 N N . ASP A 1 362 ? 9.073 23.602 9.560 1.00 60.03 ? 362 ASP A N 1 ATOM 2881 C CA . ASP A 1 362 ? 8.092 24.112 8.599 1.00 61.78 ? 362 ASP A CA 1 ATOM 2882 C C . ASP A 1 362 ? 8.404 23.559 7.225 1.00 62.94 ? 362 ASP A C 1 ATOM 2883 O O . ASP A 1 362 ? 9.337 22.771 7.075 1.00 63.46 ? 362 ASP A O 1 ATOM 2884 C CB . ASP A 1 362 ? 8.121 25.641 8.552 1.00 61.61 ? 362 ASP A CB 1 ATOM 2885 C CG . ASP A 1 362 ? 9.408 26.178 7.935 1.00 61.61 ? 362 ASP A CG 1 ATOM 2886 O OD1 . ASP A 1 362 ? 9.927 25.531 6.993 1.00 57.80 ? 362 ASP A OD1 1 ATOM 2887 O OD2 . ASP A 1 362 ? 9.982 27.215 8.347 1.00 61.83 ? 362 ASP A OD2 1 ATOM 2888 N N . GLU A 1 363 ? 7.677 24.016 6.212 1.00 64.80 ? 363 GLU A N 1 ATOM 2889 C CA . GLU A 1 363 ? 7.854 23.439 4.865 1.00 66.37 ? 363 GLU A CA 1 ATOM 2890 C C . GLU A 1 363 ? 9.227 23.533 4.170 1.00 66.12 ? 363 GLU A C 1 ATOM 2891 O O . GLU A 1 363 ? 9.427 22.898 3.132 1.00 66.49 ? 363 GLU A O 1 ATOM 2892 C CB . GLU A 1 363 ? 6.708 23.808 3.905 1.00 67.08 ? 363 GLU A CB 1 ATOM 2893 C CG . GLU A 1 363 ? 5.812 24.941 4.383 1.00 69.09 ? 363 GLU A CG 1 ATOM 2894 C CD . GLU A 1 363 ? 4.753 24.494 5.378 1.00 71.29 ? 363 GLU A CD 1 ATOM 2895 O OE1 . GLU A 1 363 ? 3.815 23.770 4.956 1.00 71.78 ? 363 GLU A OE1 1 ATOM 2896 O OE2 . GLU A 1 363 ? 4.852 24.889 6.569 1.00 69.51 ? 363 GLU A OE2 1 ATOM 2897 N N . ASN A 1 364 ? 10.143 24.333 4.714 1.00 65.57 ? 364 ASN A N 1 ATOM 2898 C CA . ASN A 1 364 ? 11.510 24.387 4.211 1.00 65.73 ? 364 ASN A CA 1 ATOM 2899 C C . ASN A 1 364 ? 12.430 23.604 5.134 1.00 65.87 ? 364 ASN A C 1 ATOM 2900 O O . ASN A 1 364 ? 13.654 23.777 5.092 1.00 65.47 ? 364 ASN A O 1 ATOM 2901 C CB . ASN A 1 364 ? 12.041 25.832 4.080 1.00 66.39 ? 364 ASN A CB 1 ATOM 2902 C CG . ASN A 1 364 ? 11.272 26.668 3.051 1.00 67.20 ? 364 ASN A CG 1 ATOM 2903 O OD1 . ASN A 1 364 ? 11.002 27.849 3.276 1.00 67.95 ? 364 ASN A OD1 1 ATOM 2904 N ND2 . ASN A 1 364 ? 10.908 26.051 1.931 1.00 65.83 ? 364 ASN A ND2 1 ATOM 2905 N N . TYR A 1 365 ? 11.833 22.758 5.980 1.00 66.21 ? 365 TYR A N 1 ATOM 2906 C CA . TYR A 1 365 ? 12.587 21.932 6.928 1.00 66.61 ? 365 TYR A CA 1 ATOM 2907 C C . TYR A 1 365 ? 13.564 22.765 7.730 1.00 66.22 ? 365 TYR A C 1 ATOM 2908 O O . TYR A 1 365 ? 14.753 22.482 7.756 1.00 66.43 ? 365 TYR A O 1 ATOM 2909 C CB . TYR A 1 365 ? 13.314 20.784 6.201 1.00 66.84 ? 365 TYR A CB 1 ATOM 2910 C CG . TYR A 1 365 ? 12.366 19.664 5.901 1.00 67.26 ? 365 TYR A CG 1 ATOM 2911 C CD1 . TYR A 1 365 ? 12.401 18.500 6.634 1.00 66.36 ? 365 TYR A CD1 1 ATOM 2912 C CD2 . TYR A 1 365 ? 11.397 19.791 4.919 1.00 66.19 ? 365 TYR A CD2 1 ATOM 2913 C CE1 . TYR A 1 365 ? 11.521 17.487 6.384 1.00 65.58 ? 365 TYR A CE1 1 ATOM 2914 C CE2 . TYR A 1 365 ? 10.517 18.776 4.682 1.00 65.31 ? 365 TYR A CE2 1 ATOM 2915 C CZ . TYR A 1 365 ? 10.590 17.633 5.429 1.00 64.82 ? 365 TYR A CZ 1 ATOM 2916 O OH . TYR A 1 365 ? 9.738 16.591 5.230 1.00 65.78 ? 365 TYR A OH 1 ATOM 2917 N N . GLN A 1 366 ? 13.027 23.811 8.346 1.00 66.37 ? 366 GLN A N 1 ATOM 2918 C CA . GLN A 1 366 ? 13.762 24.771 9.157 1.00 66.50 ? 366 GLN A CA 1 ATOM 2919 C C . GLN A 1 366 ? 12.922 25.005 10.403 1.00 66.04 ? 366 GLN A C 1 ATOM 2920 O O . GLN A 1 366 ? 11.706 24.809 10.391 1.00 66.00 ? 366 GLN A O 1 ATOM 2921 C CB . GLN A 1 366 ? 13.940 26.104 8.393 1.00 67.34 ? 366 GLN A CB 1 ATOM 2922 C CG . GLN A 1 366 ? 15.169 26.194 7.479 1.00 68.58 ? 366 GLN A CG 1 ATOM 2923 C CD . GLN A 1 366 ? 16.483 26.380 8.255 1.00 71.73 ? 366 GLN A CD 1 ATOM 2924 O OE1 . GLN A 1 366 ? 17.437 25.613 8.089 1.00 69.43 ? 366 GLN A OE1 1 ATOM 2925 N NE2 . GLN A 1 366 ? 16.530 27.415 9.098 1.00 75.32 ? 366 GLN A NE2 1 ATOM 2926 N N . PRO A 1 367 ? 13.553 25.453 11.480 1.00 65.76 ? 367 PRO A N 1 ATOM 2927 C CA . PRO A 1 367 ? 12.848 25.611 12.744 1.00 65.21 ? 367 PRO A CA 1 ATOM 2928 C C . PRO A 1 367 ? 11.500 26.276 12.543 1.00 65.56 ? 367 PRO A C 1 ATOM 2929 O O . PRO A 1 367 ? 11.413 27.377 12.002 1.00 65.56 ? 367 PRO A O 1 ATOM 2930 C CB . PRO A 1 367 ? 13.788 26.497 13.550 1.00 65.11 ? 367 PRO A CB 1 ATOM 2931 C CG . PRO A 1 367 ? 15.124 26.165 13.049 1.00 64.62 ? 367 PRO A CG 1 ATOM 2932 C CD . PRO A 1 367 ? 14.968 25.852 11.585 1.00 65.37 ? 367 PRO A CD 1 ATOM 2933 N N . TRP A 1 368 ? 10.451 25.587 12.980 1.00 65.40 ? 368 TRP A N 1 ATOM 2934 C CA . TRP A 1 368 ? 9.099 26.091 12.893 1.00 64.93 ? 368 TRP A CA 1 ATOM 2935 C C . TRP A 1 368 ? 8.830 26.847 14.193 1.00 64.61 ? 368 TRP A C 1 ATOM 2936 O O . TRP A 1 368 ? 8.617 26.252 15.252 1.00 64.62 ? 368 TRP A O 1 ATOM 2937 C CB . TRP A 1 368 ? 8.134 24.905 12.675 1.00 65.13 ? 368 TRP A CB 1 ATOM 2938 C CG . TRP A 1 368 ? 6.654 25.208 12.561 1.00 65.94 ? 368 TRP A CG 1 ATOM 2939 C CD1 . TRP A 1 368 ? 5.919 25.270 11.419 1.00 68.41 ? 368 TRP A CD1 1 ATOM 2940 C CD2 . TRP A 1 368 ? 5.724 25.423 13.637 1.00 68.86 ? 368 TRP A CD2 1 ATOM 2941 N NE1 . TRP A 1 368 ? 4.598 25.529 11.707 1.00 69.35 ? 368 TRP A NE1 1 ATOM 2942 C CE2 . TRP A 1 368 ? 4.453 25.626 13.064 1.00 68.83 ? 368 TRP A CE2 1 ATOM 2943 C CE3 . TRP A 1 368 ? 5.836 25.446 15.027 1.00 70.03 ? 368 TRP A CE3 1 ATOM 2944 C CZ2 . TRP A 1 368 ? 3.317 25.873 13.824 1.00 70.28 ? 368 TRP A CZ2 1 ATOM 2945 C CZ3 . TRP A 1 368 ? 4.702 25.691 15.783 1.00 72.78 ? 368 TRP A CZ3 1 ATOM 2946 C CH2 . TRP A 1 368 ? 3.460 25.905 15.177 1.00 71.95 ? 368 TRP A CH2 1 ATOM 2947 N N . GLY A 1 369 ? 8.910 28.167 14.128 1.00 63.98 ? 369 GLY A N 1 ATOM 2948 C CA . GLY A 1 369 ? 8.597 28.976 15.285 1.00 63.85 ? 369 GLY A CA 1 ATOM 2949 C C . GLY A 1 369 ? 9.746 29.253 16.212 1.00 63.47 ? 369 GLY A C 1 ATOM 2950 O O . GLY A 1 369 ? 10.830 28.717 16.049 1.00 64.22 ? 369 GLY A O 1 ATOM 2951 N N . PRO A 1 370 ? 9.473 30.069 17.222 1.00 63.24 ? 370 PRO A N 1 ATOM 2952 C CA . PRO A 1 370 ? 10.471 30.534 18.211 1.00 62.59 ? 370 PRO A CA 1 ATOM 2953 C C . PRO A 1 370 ? 11.094 29.465 19.132 1.00 62.39 ? 370 PRO A C 1 ATOM 2954 O O . PRO A 1 370 ? 12.294 29.502 19.428 1.00 61.97 ? 370 PRO A O 1 ATOM 2955 C CB . PRO A 1 370 ? 9.645 31.504 19.065 1.00 63.39 ? 370 PRO A CB 1 ATOM 2956 C CG . PRO A 1 370 ? 8.241 30.954 18.955 1.00 63.21 ? 370 PRO A CG 1 ATOM 2957 C CD . PRO A 1 370 ? 8.129 30.622 17.477 1.00 62.83 ? 370 PRO A CD 1 ATOM 2958 N N . GLU A 1 371 ? 10.270 28.547 19.626 1.00 62.60 ? 371 GLU A N 1 ATOM 2959 C CA . GLU A 1 371 ? 10.731 27.444 20.459 1.00 61.97 ? 371 GLU A CA 1 ATOM 2960 C C . GLU A 1 371 ? 10.529 26.182 19.660 1.00 61.07 ? 371 GLU A C 1 ATOM 2961 O O . GLU A 1 371 ? 9.829 25.275 20.118 1.00 61.51 ? 371 GLU A O 1 ATOM 2962 C CB . GLU A 1 371 ? 9.874 27.301 21.716 1.00 62.53 ? 371 GLU A CB 1 ATOM 2963 C CG . GLU A 1 371 ? 10.127 28.311 22.815 1.00 65.45 ? 371 GLU A CG 1 ATOM 2964 C CD . GLU A 1 371 ? 9.267 29.540 22.683 1.00 66.79 ? 371 GLU A CD 1 ATOM 2965 O OE1 . GLU A 1 371 ? 8.527 29.650 21.662 1.00 67.27 ? 371 GLU A OE1 1 ATOM 2966 O OE2 . GLU A 1 371 ? 9.335 30.385 23.610 1.00 66.57 ? 371 GLU A OE2 1 ATOM 2967 N N . ALA A 1 372 ? 11.119 26.092 18.475 1.00 59.61 ? 372 ALA A N 1 ATOM 2968 C CA . ALA A 1 372 ? 10.828 24.929 17.619 1.00 58.18 ? 372 ALA A CA 1 ATOM 2969 C C . ALA A 1 372 ? 11.341 23.624 18.198 1.00 56.82 ? 372 ALA A C 1 ATOM 2970 O O . ALA A 1 372 ? 10.753 22.566 18.010 1.00 56.70 ? 372 ALA A O 1 ATOM 2971 C CB . ALA A 1 372 ? 11.389 25.130 16.233 1.00 58.54 ? 372 ALA A CB 1 ATOM 2972 N N . GLU A 1 373 ? 12.467 23.716 18.869 1.00 55.65 ? 373 GLU A N 1 ATOM 2973 C CA . GLU A 1 373 ? 13.077 22.597 19.509 1.00 54.95 ? 373 GLU A CA 1 ATOM 2974 C C . GLU A 1 373 ? 12.674 22.594 20.976 1.00 54.31 ? 373 GLU A C 1 ATOM 2975 O O . GLU A 1 373 ? 12.683 23.653 21.617 1.00 53.76 ? 373 GLU A O 1 ATOM 2976 C CB . GLU A 1 373 ? 14.590 22.725 19.419 1.00 55.24 ? 373 GLU A CB 1 ATOM 2977 C CG . GLU A 1 373 ? 15.296 21.627 20.191 1.00 56.43 ? 373 GLU A CG 1 ATOM 2978 C CD . GLU A 1 373 ? 16.789 21.785 20.209 1.00 60.02 ? 373 GLU A CD 1 ATOM 2979 O OE1 . GLU A 1 373 ? 17.309 22.483 21.138 1.00 62.55 ? 373 GLU A OE1 1 ATOM 2980 O OE2 . GLU A 1 373 ? 17.438 21.200 19.300 1.00 60.14 ? 373 GLU A OE2 1 ATOM 2981 N N . LEU A 1 374 ? 12.387 21.408 21.526 1.00 52.81 ? 374 LEU A N 1 ATOM 2982 C CA . LEU A 1 374 ? 11.937 21.320 22.918 1.00 51.55 ? 374 LEU A CA 1 ATOM 2983 C C . LEU A 1 374 ? 12.519 20.097 23.499 1.00 50.12 ? 374 LEU A C 1 ATOM 2984 O O . LEU A 1 374 ? 12.713 19.160 22.778 1.00 51.56 ? 374 LEU A O 1 ATOM 2985 C CB . LEU A 1 374 ? 10.415 21.160 22.970 1.00 51.42 ? 374 LEU A CB 1 ATOM 2986 C CG . LEU A 1 374 ? 9.719 22.416 22.444 1.00 49.45 ? 374 LEU A CG 1 ATOM 2987 C CD1 . LEU A 1 374 ? 8.329 22.085 22.051 1.00 49.69 ? 374 LEU A CD1 1 ATOM 2988 C CD2 . LEU A 1 374 ? 9.747 23.493 23.518 1.00 43.80 ? 374 LEU A CD2 1 ATOM 2989 N N . PRO A 1 375 ? 12.812 20.111 24.786 1.00 48.75 ? 375 PRO A N 1 ATOM 2990 C CA . PRO A 1 375 ? 13.341 18.941 25.478 1.00 48.30 ? 375 PRO A CA 1 ATOM 2991 C C . PRO A 1 375 ? 12.268 17.857 25.499 1.00 47.80 ? 375 PRO A C 1 ATOM 2992 O O . PRO A 1 375 ? 11.091 18.168 25.737 1.00 46.30 ? 375 PRO A O 1 ATOM 2993 C CB . PRO A 1 375 ? 13.541 19.448 26.927 1.00 48.20 ? 375 PRO A CB 1 ATOM 2994 C CG . PRO A 1 375 ? 13.496 20.917 26.814 1.00 48.34 ? 375 PRO A CG 1 ATOM 2995 C CD . PRO A 1 375 ? 12.632 21.260 25.692 1.00 48.52 ? 375 PRO A CD 1 ATOM 2996 N N . LEU A 1 376 ? 12.679 16.612 25.253 1.00 46.72 ? 376 LEU A N 1 ATOM 2997 C CA . LEU A 1 376 ? 11.774 15.489 25.260 1.00 46.16 ? 376 LEU A CA 1 ATOM 2998 C C . LEU A 1 376 ? 10.927 15.485 26.561 1.00 47.30 ? 376 LEU A C 1 ATOM 2999 O O . LEU A 1 376 ? 9.705 15.312 26.541 1.00 46.61 ? 376 LEU A O 1 ATOM 3000 C CB . LEU A 1 376 ? 12.612 14.223 25.203 1.00 45.79 ? 376 LEU A CB 1 ATOM 3001 C CG . LEU A 1 376 ? 12.174 12.886 24.649 1.00 42.69 ? 376 LEU A CG 1 ATOM 3002 C CD1 . LEU A 1 376 ? 12.644 11.901 25.673 1.00 44.99 ? 376 LEU A CD1 1 ATOM 3003 C CD2 . LEU A 1 376 ? 10.706 12.802 24.434 1.00 43.99 ? 376 LEU A CD2 1 ATOM 3004 N N . HIS A 1 377 ? 11.557 15.680 27.707 1.00 47.15 ? 377 HIS A N 1 ATOM 3005 C CA . HIS A 1 377 ? 10.739 15.544 28.892 1.00 48.29 ? 377 HIS A CA 1 ATOM 3006 C C . HIS A 1 377 ? 9.446 16.403 28.965 1.00 48.63 ? 377 HIS A C 1 ATOM 3007 O O . HIS A 1 377 ? 8.565 16.077 29.743 1.00 48.40 ? 377 HIS A O 1 ATOM 3008 C CB . HIS A 1 377 ? 11.554 15.651 30.154 1.00 47.22 ? 377 HIS A CB 1 ATOM 3009 C CG . HIS A 1 377 ? 11.830 17.047 30.578 1.00 50.59 ? 377 HIS A CG 1 ATOM 3010 N ND1 . HIS A 1 377 ? 12.906 17.767 30.108 1.00 52.48 ? 377 HIS A ND1 1 ATOM 3011 C CD2 . HIS A 1 377 ? 11.204 17.846 31.481 1.00 54.11 ? 377 HIS A CD2 1 ATOM 3012 C CE1 . HIS A 1 377 ? 12.925 18.954 30.693 1.00 52.75 ? 377 HIS A CE1 1 ATOM 3013 N NE2 . HIS A 1 377 ? 11.896 19.031 31.520 1.00 53.44 ? 377 HIS A NE2 1 ATOM 3014 N N . THR A 1 378 ? 9.324 17.483 28.179 1.00 47.81 ? 378 THR A N 1 ATOM 3015 C CA . THR A 1 378 ? 8.099 18.292 28.249 1.00 47.51 ? 378 THR A CA 1 ATOM 3016 C C . THR A 1 378 ? 7.081 17.769 27.278 1.00 47.71 ? 378 THR A C 1 ATOM 3017 O O . THR A 1 378 ? 6.020 18.359 27.121 1.00 47.38 ? 378 THR A O 1 ATOM 3018 C CB . THR A 1 378 ? 8.296 19.803 27.893 1.00 46.90 ? 378 THR A CB 1 ATOM 3019 O OG1 . THR A 1 378 ? 8.909 19.936 26.619 1.00 47.98 ? 378 THR A OG1 1 ATOM 3020 C CG2 . THR A 1 378 ? 9.247 20.518 28.822 1.00 46.99 ? 378 THR A CG2 1 ATOM 3021 N N . LEU A 1 379 ? 7.436 16.693 26.571 1.00 47.35 ? 379 LEU A N 1 ATOM 3022 C CA . LEU A 1 379 ? 6.548 16.174 25.588 1.00 46.52 ? 379 LEU A CA 1 ATOM 3023 C C . LEU A 1 379 ? 5.892 14.902 26.091 1.00 46.05 ? 379 LEU A C 1 ATOM 3024 O O . LEU A 1 379 ? 5.032 14.343 25.435 1.00 45.85 ? 379 LEU A O 1 ATOM 3025 C CB . LEU A 1 379 ? 7.254 16.051 24.238 1.00 45.84 ? 379 LEU A CB 1 ATOM 3026 C CG . LEU A 1 379 ? 7.730 17.448 23.779 1.00 48.91 ? 379 LEU A CG 1 ATOM 3027 C CD1 . LEU A 1 379 ? 8.767 17.366 22.624 1.00 46.82 ? 379 LEU A CD1 1 ATOM 3028 C CD2 . LEU A 1 379 ? 6.586 18.407 23.381 1.00 47.48 ? 379 LEU A CD2 1 ATOM 3029 N N . PHE A 1 380 ? 6.283 14.444 27.265 1.00 45.83 ? 380 PHE A N 1 ATOM 3030 C CA . PHE A 1 380 ? 5.620 13.301 27.842 1.00 46.58 ? 380 PHE A CA 1 ATOM 3031 C C . PHE A 1 380 ? 4.113 13.667 28.024 1.00 47.37 ? 380 PHE A C 1 ATOM 3032 O O . PHE A 1 380 ? 3.779 14.700 28.624 1.00 48.02 ? 380 PHE A O 1 ATOM 3033 C CB . PHE A 1 380 ? 6.238 12.950 29.206 1.00 46.60 ? 380 PHE A CB 1 ATOM 3034 C CG . PHE A 1 380 ? 7.674 12.523 29.139 1.00 46.14 ? 380 PHE A CG 1 ATOM 3035 C CD1 . PHE A 1 380 ? 8.130 11.706 28.118 1.00 47.15 ? 380 PHE A CD1 1 ATOM 3036 C CD2 . PHE A 1 380 ? 8.562 12.902 30.128 1.00 45.22 ? 380 PHE A CD2 1 ATOM 3037 C CE1 . PHE A 1 380 ? 9.469 11.281 28.102 1.00 46.29 ? 380 PHE A CE1 1 ATOM 3038 C CE2 . PHE A 1 380 ? 9.855 12.490 30.112 1.00 44.25 ? 380 PHE A CE2 1 ATOM 3039 C CZ . PHE A 1 380 ? 10.320 11.683 29.082 1.00 44.70 ? 380 PHE A CZ 1 ATOM 3040 N N . PHE A 1 381 ? 3.235 12.857 27.461 1.00 47.66 ? 381 PHE A N 1 ATOM 3041 C CA . PHE A 1 381 ? 1.800 13.028 27.597 1.00 49.82 ? 381 PHE A CA 1 ATOM 3042 C C . PHE A 1 381 ? 1.305 14.392 27.179 1.00 51.13 ? 381 PHE A C 1 ATOM 3043 O O . PHE A 1 381 ? 0.328 14.915 27.754 1.00 51.27 ? 381 PHE A O 1 ATOM 3044 C CB . PHE A 1 381 ? 1.356 12.722 29.034 1.00 50.64 ? 381 PHE A CB 1 ATOM 3045 C CG . PHE A 1 381 ? 1.612 11.315 29.434 1.00 48.97 ? 381 PHE A CG 1 ATOM 3046 C CD1 . PHE A 1 381 ? 0.744 10.333 29.051 1.00 47.87 ? 381 PHE A CD1 1 ATOM 3047 C CD2 . PHE A 1 381 ? 2.744 10.984 30.107 1.00 47.95 ? 381 PHE A CD2 1 ATOM 3048 C CE1 . PHE A 1 381 ? 0.945 9.067 29.381 1.00 46.47 ? 381 PHE A CE1 1 ATOM 3049 C CE2 . PHE A 1 381 ? 2.978 9.700 30.435 1.00 51.61 ? 381 PHE A CE2 1 ATOM 3050 C CZ . PHE A 1 381 ? 2.083 8.727 30.052 1.00 51.57 ? 381 PHE A CZ 1 ATOM 3051 N N . ASN A 1 382 ? 1.996 14.954 26.188 1.00 51.11 ? 382 ASN A N 1 ATOM 3052 C CA . ASN A 1 382 ? 1.700 16.241 25.684 1.00 51.52 ? 382 ASN A CA 1 ATOM 3053 C C . ASN A 1 382 ? 0.896 16.142 24.406 1.00 52.16 ? 382 ASN A C 1 ATOM 3054 O O . ASN A 1 382 ? 1.435 15.862 23.342 1.00 52.49 ? 382 ASN A O 1 ATOM 3055 C CB . ASN A 1 382 ? 2.990 17.017 25.449 1.00 52.30 ? 382 ASN A CB 1 ATOM 3056 C CG . ASN A 1 382 ? 2.745 18.498 25.304 1.00 51.77 ? 382 ASN A CG 1 ATOM 3057 O OD1 . ASN A 1 382 ? 1.761 18.902 24.689 1.00 49.31 ? 382 ASN A OD1 1 ATOM 3058 N ND2 . ASN A 1 382 ? 3.639 19.316 25.861 1.00 51.59 ? 382 ASN A ND2 1 ATOM 3059 N N . THR A 1 383 ? -0.401 16.382 24.531 1.00 51.89 ? 383 THR A N 1 ATOM 3060 C CA . THR A 1 383 ? -1.309 16.347 23.412 1.00 52.63 ? 383 THR A CA 1 ATOM 3061 C C . THR A 1 383 ? -1.522 17.794 22.953 1.00 52.98 ? 383 THR A C 1 ATOM 3062 O O . THR A 1 383 ? -1.718 18.050 21.762 1.00 52.43 ? 383 THR A O 1 ATOM 3063 C CB . THR A 1 383 ? -2.628 15.691 23.797 1.00 51.92 ? 383 THR A CB 1 ATOM 3064 O OG1 . THR A 1 383 ? -3.005 16.143 25.098 1.00 53.11 ? 383 THR A OG1 1 ATOM 3065 C CG2 . THR A 1 383 ? -2.435 14.217 24.050 1.00 53.63 ? 383 THR A CG2 1 ATOM 3066 N N . TRP A 1 384 ? -1.412 18.734 23.886 1.00 52.93 ? 384 TRP A N 1 ATOM 3067 C CA . TRP A 1 384 ? -1.639 20.131 23.563 1.00 53.84 ? 384 TRP A CA 1 ATOM 3068 C C . TRP A 1 384 ? -0.698 20.741 22.535 1.00 54.53 ? 384 TRP A C 1 ATOM 3069 O O . TRP A 1 384 ? -1.152 21.516 21.694 1.00 54.51 ? 384 TRP A O 1 ATOM 3070 C CB . TRP A 1 384 ? -1.700 21.011 24.811 1.00 53.71 ? 384 TRP A CB 1 ATOM 3071 C CG . TRP A 1 384 ? -0.473 21.197 25.559 1.00 53.97 ? 384 TRP A CG 1 ATOM 3072 C CD1 . TRP A 1 384 ? -0.070 20.496 26.650 1.00 54.31 ? 384 TRP A CD1 1 ATOM 3073 C CD2 . TRP A 1 384 ? 0.495 22.225 25.370 1.00 55.32 ? 384 TRP A CD2 1 ATOM 3074 N NE1 . TRP A 1 384 ? 1.112 21.000 27.133 1.00 52.28 ? 384 TRP A NE1 1 ATOM 3075 C CE2 . TRP A 1 384 ? 1.478 22.068 26.360 1.00 55.31 ? 384 TRP A CE2 1 ATOM 3076 C CE3 . TRP A 1 384 ? 0.634 23.273 24.461 1.00 56.36 ? 384 TRP A CE3 1 ATOM 3077 C CZ2 . TRP A 1 384 ? 2.603 22.913 26.450 1.00 56.63 ? 384 TRP A CZ2 1 ATOM 3078 C CZ3 . TRP A 1 384 ? 1.742 24.105 24.557 1.00 53.38 ? 384 TRP A CZ3 1 ATOM 3079 C CH2 . TRP A 1 384 ? 2.701 23.924 25.538 1.00 54.46 ? 384 TRP A CH2 1 ATOM 3080 N N . ARG A 1 385 ? 0.592 20.411 22.609 1.00 54.80 ? 385 ARG A N 1 ATOM 3081 C CA . ARG A 1 385 ? 1.542 20.915 21.638 1.00 55.41 ? 385 ARG A CA 1 ATOM 3082 C C . ARG A 1 385 ? 1.174 20.463 20.208 1.00 56.40 ? 385 ARG A C 1 ATOM 3083 O O . ARG A 1 385 ? 1.769 20.936 19.245 1.00 55.69 ? 385 ARG A O 1 ATOM 3084 C CB . ARG A 1 385 ? 2.975 20.495 21.985 1.00 54.90 ? 385 ARG A CB 1 ATOM 3085 C CG . ARG A 1 385 ? 3.582 21.214 23.146 1.00 54.06 ? 385 ARG A CG 1 ATOM 3086 C CD . ARG A 1 385 ? 4.362 22.421 22.824 1.00 51.80 ? 385 ARG A CD 1 ATOM 3087 N NE . ARG A 1 385 ? 5.099 22.892 24.001 1.00 55.93 ? 385 ARG A NE 1 ATOM 3088 C CZ . ARG A 1 385 ? 5.706 24.090 24.107 1.00 58.86 ? 385 ARG A CZ 1 ATOM 3089 N NH1 . ARG A 1 385 ? 5.682 24.942 23.099 1.00 57.78 ? 385 ARG A NH1 1 ATOM 3090 N NH2 . ARG A 1 385 ? 6.356 24.439 25.228 1.00 60.19 ? 385 ARG A NH2 1 ATOM 3091 N N . ILE A 1 386 ? 0.208 19.552 20.086 1.00 57.49 ? 386 ILE A N 1 ATOM 3092 C CA . ILE A 1 386 ? -0.239 19.121 18.790 1.00 59.43 ? 386 ILE A CA 1 ATOM 3093 C C . ILE A 1 386 ? -1.509 19.838 18.367 1.00 61.51 ? 386 ILE A C 1 ATOM 3094 O O . ILE A 1 386 ? -1.608 20.324 17.224 1.00 62.10 ? 386 ILE A O 1 ATOM 3095 C CB . ILE A 1 386 ? -0.521 17.641 18.735 1.00 58.40 ? 386 ILE A CB 1 ATOM 3096 C CG1 . ILE A 1 386 ? 0.758 16.843 18.896 1.00 59.87 ? 386 ILE A CG1 1 ATOM 3097 C CG2 . ILE A 1 386 ? -1.040 17.304 17.376 1.00 57.98 ? 386 ILE A CG2 1 ATOM 3098 C CD1 . ILE A 1 386 ? 0.576 15.353 18.536 1.00 57.75 ? 386 ILE A CD1 1 ATOM 3099 N N . ILE A 1 387 ? -2.481 19.878 19.268 1.00 62.81 ? 387 ILE A N 1 ATOM 3100 C CA . ILE A 1 387 ? -3.779 20.423 18.938 1.00 64.82 ? 387 ILE A CA 1 ATOM 3101 C C . ILE A 1 387 ? -3.705 21.933 18.893 1.00 65.91 ? 387 ILE A C 1 ATOM 3102 O O . ILE A 1 387 ? -4.307 22.569 18.028 1.00 66.89 ? 387 ILE A O 1 ATOM 3103 C CB . ILE A 1 387 ? -4.817 19.984 19.979 1.00 65.14 ? 387 ILE A CB 1 ATOM 3104 C CG1 . ILE A 1 387 ? -5.042 18.489 19.890 1.00 64.42 ? 387 ILE A CG1 1 ATOM 3105 C CG2 . ILE A 1 387 ? -6.133 20.736 19.772 1.00 65.27 ? 387 ILE A CG2 1 ATOM 3106 C CD1 . ILE A 1 387 ? -5.712 18.104 18.640 1.00 68.67 ? 387 ILE A CD1 1 ATOM 3107 N N . LYS A 1 388 ? -2.928 22.504 19.808 1.00 66.73 ? 388 LYS A N 1 ATOM 3108 C CA . LYS A 1 388 ? -2.817 23.960 19.917 1.00 66.83 ? 388 LYS A CA 1 ATOM 3109 C C . LYS A 1 388 ? -1.495 24.567 19.414 1.00 66.48 ? 388 LYS A C 1 ATOM 3110 O O . LYS A 1 388 ? -1.244 25.762 19.652 1.00 66.82 ? 388 LYS A O 1 ATOM 3111 C CB . LYS A 1 388 ? -3.054 24.397 21.385 1.00 67.18 ? 388 LYS A CB 1 ATOM 3112 C CG . LYS A 1 388 ? -4.377 23.918 21.993 1.00 67.98 ? 388 LYS A CG 1 ATOM 3113 C CD . LYS A 1 388 ? -4.626 24.488 23.399 1.00 72.34 ? 388 LYS A CD 1 ATOM 3114 C CE . LYS A 1 388 ? -4.809 26.022 23.398 1.00 76.49 ? 388 LYS A CE 1 ATOM 3115 N NZ . LYS A 1 388 ? -5.555 26.571 24.605 1.00 79.18 ? 388 LYS A NZ 1 ATOM 3116 N N . ASP A 1 389 ? -0.659 23.782 18.730 1.00 65.38 ? 389 ASP A N 1 ATOM 3117 C CA . ASP A 1 389 ? 0.637 24.291 18.265 1.00 63.90 ? 389 ASP A CA 1 ATOM 3118 C C . ASP A 1 389 ? 1.194 23.756 16.919 1.00 62.82 ? 389 ASP A C 1 ATOM 3119 O O . ASP A 1 389 ? 2.403 23.558 16.796 1.00 62.85 ? 389 ASP A O 1 ATOM 3120 C CB . ASP A 1 389 ? 1.664 24.035 19.365 1.00 64.48 ? 389 ASP A CB 1 ATOM 3121 C CG . ASP A 1 389 ? 2.849 24.980 19.314 1.00 65.35 ? 389 ASP A CG 1 ATOM 3122 O OD1 . ASP A 1 389 ? 2.694 26.150 18.900 1.00 68.27 ? 389 ASP A OD1 1 ATOM 3123 O OD2 . ASP A 1 389 ? 3.978 24.643 19.714 1.00 66.68 ? 389 ASP A OD2 1 ATOM 3124 N N . GLY A 1 390 ? 0.355 23.507 15.920 1.00 61.57 ? 390 GLY A N 1 ATOM 3125 C CA . GLY A 1 390 ? 0.877 23.123 14.612 1.00 60.58 ? 390 GLY A CA 1 ATOM 3126 C C . GLY A 1 390 ? 0.442 21.832 13.918 1.00 59.96 ? 390 GLY A C 1 ATOM 3127 O O . GLY A 1 390 ? 0.841 21.567 12.766 1.00 59.84 ? 390 GLY A O 1 ATOM 3128 N N . GLY A 1 391 ? -0.375 21.020 14.581 1.00 58.81 ? 391 GLY A N 1 ATOM 3129 C CA . GLY A 1 391 ? -0.790 19.754 13.981 1.00 57.55 ? 391 GLY A CA 1 ATOM 3130 C C . GLY A 1 391 ? 0.399 18.809 13.880 1.00 55.64 ? 391 GLY A C 1 ATOM 3131 O O . GLY A 1 391 ? 1.483 19.186 14.274 1.00 55.00 ? 391 GLY A O 1 ATOM 3132 N N . ILE A 1 392 ? 0.231 17.604 13.346 1.00 54.28 ? 392 ILE A N 1 ATOM 3133 C CA . ILE A 1 392 ? 1.375 16.711 13.353 1.00 54.13 ? 392 ILE A CA 1 ATOM 3134 C C . ILE A 1 392 ? 2.423 16.967 12.296 1.00 54.35 ? 392 ILE A C 1 ATOM 3135 O O . ILE A 1 392 ? 3.534 16.478 12.423 1.00 54.56 ? 392 ILE A O 1 ATOM 3136 C CB . ILE A 1 392 ? 0.962 15.288 13.216 1.00 54.14 ? 392 ILE A CB 1 ATOM 3137 C CG1 . ILE A 1 392 ? 0.823 14.961 11.717 1.00 54.58 ? 392 ILE A CG1 1 ATOM 3138 C CG2 . ILE A 1 392 ? -0.243 14.999 14.087 1.00 52.91 ? 392 ILE A CG2 1 ATOM 3139 C CD1 . ILE A 1 392 ? 0.588 13.476 11.401 1.00 52.80 ? 392 ILE A CD1 1 ATOM 3140 N N . ASP A 1 393 ? 2.074 17.713 11.250 1.00 54.42 ? 393 ASP A N 1 ATOM 3141 C CA . ASP A 1 393 ? 2.987 17.945 10.124 1.00 54.33 ? 393 ASP A CA 1 ATOM 3142 C C . ASP A 1 393 ? 4.425 18.385 10.466 1.00 53.49 ? 393 ASP A C 1 ATOM 3143 O O . ASP A 1 393 ? 5.403 17.767 10.038 1.00 52.68 ? 393 ASP A O 1 ATOM 3144 C CB . ASP A 1 393 ? 2.319 18.936 9.173 1.00 55.82 ? 393 ASP A CB 1 ATOM 3145 C CG . ASP A 1 393 ? 1.399 18.220 8.179 1.00 59.08 ? 393 ASP A CG 1 ATOM 3146 O OD1 . ASP A 1 393 ? 1.071 17.034 8.416 1.00 62.01 ? 393 ASP A OD1 1 ATOM 3147 O OD2 . ASP A 1 393 ? 0.997 18.858 7.188 1.00 60.17 ? 393 ASP A OD2 1 ATOM 3148 N N . PRO A 1 394 ? 4.564 19.459 11.250 1.00 52.51 ? 394 PRO A N 1 ATOM 3149 C CA . PRO A 1 394 ? 5.888 19.901 11.677 1.00 51.69 ? 394 PRO A CA 1 ATOM 3150 C C . PRO A 1 394 ? 6.658 18.822 12.439 1.00 52.47 ? 394 PRO A C 1 ATOM 3151 O O . PRO A 1 394 ? 7.904 18.812 12.374 1.00 52.54 ? 394 PRO A O 1 ATOM 3152 C CB . PRO A 1 394 ? 5.589 21.137 12.569 1.00 51.32 ? 394 PRO A CB 1 ATOM 3153 C CG . PRO A 1 394 ? 4.232 21.596 12.145 1.00 50.50 ? 394 PRO A CG 1 ATOM 3154 C CD . PRO A 1 394 ? 3.491 20.377 11.692 1.00 51.16 ? 394 PRO A CD 1 ATOM 3155 N N . LEU A 1 395 ? 5.960 17.939 13.152 1.00 52.27 ? 395 LEU A N 1 ATOM 3156 C CA . LEU A 1 395 ? 6.656 16.937 13.970 1.00 52.68 ? 395 LEU A CA 1 ATOM 3157 C C . LEU A 1 395 ? 7.089 15.790 13.081 1.00 52.28 ? 395 LEU A C 1 ATOM 3158 O O . LEU A 1 395 ? 8.153 15.187 13.302 1.00 52.63 ? 395 LEU A O 1 ATOM 3159 C CB . LEU A 1 395 ? 5.797 16.423 15.155 1.00 52.63 ? 395 LEU A CB 1 ATOM 3160 C CG . LEU A 1 395 ? 5.470 17.410 16.288 1.00 53.38 ? 395 LEU A CG 1 ATOM 3161 C CD1 . LEU A 1 395 ? 4.235 17.010 17.104 1.00 52.78 ? 395 LEU A CD1 1 ATOM 3162 C CD2 . LEU A 1 395 ? 6.685 17.619 17.226 1.00 50.42 ? 395 LEU A CD2 1 ATOM 3163 N N . VAL A 1 396 ? 6.264 15.459 12.096 1.00 51.56 ? 396 VAL A N 1 ATOM 3164 C CA . VAL A 1 396 ? 6.666 14.427 11.160 1.00 52.08 ? 396 VAL A CA 1 ATOM 3165 C C . VAL A 1 396 ? 7.919 14.809 10.365 1.00 52.32 ? 396 VAL A C 1 ATOM 3166 O O . VAL A 1 396 ? 8.670 13.939 9.945 1.00 52.93 ? 396 VAL A O 1 ATOM 3167 C CB . VAL A 1 396 ? 5.645 14.122 10.162 1.00 51.85 ? 396 VAL A CB 1 ATOM 3168 C CG1 . VAL A 1 396 ? 6.134 12.973 9.341 1.00 53.35 ? 396 VAL A CG1 1 ATOM 3169 C CG2 . VAL A 1 396 ? 4.346 13.827 10.815 1.00 51.86 ? 396 VAL A CG2 1 ATOM 3170 N N . ARG A 1 397 ? 8.142 16.096 10.142 1.00 52.31 ? 397 ARG A N 1 ATOM 3171 C CA . ARG A 1 397 ? 9.372 16.519 9.480 1.00 52.65 ? 397 ARG A CA 1 ATOM 3172 C C . ARG A 1 397 ? 10.510 16.385 10.471 1.00 52.46 ? 397 ARG A C 1 ATOM 3173 O O . ARG A 1 397 ? 11.630 16.016 10.100 1.00 52.35 ? 397 ARG A O 1 ATOM 3174 C CB . ARG A 1 397 ? 9.269 17.958 8.971 1.00 53.34 ? 397 ARG A CB 1 ATOM 3175 C CG . ARG A 1 397 ? 8.120 18.232 8.012 1.00 52.25 ? 397 ARG A CG 1 ATOM 3176 C CD . ARG A 1 397 ? 8.104 19.683 7.550 1.00 55.50 ? 397 ARG A CD 1 ATOM 3177 N NE . ARG A 1 397 ? 6.913 19.977 6.741 1.00 54.77 ? 397 ARG A NE 1 ATOM 3178 C CZ . ARG A 1 397 ? 5.858 20.666 7.183 1.00 54.92 ? 397 ARG A CZ 1 ATOM 3179 N NH1 . ARG A 1 397 ? 5.827 21.165 8.417 1.00 52.31 ? 397 ARG A NH1 1 ATOM 3180 N NH2 . ARG A 1 397 ? 4.810 20.841 6.373 1.00 56.11 ? 397 ARG A NH2 1 ATOM 3181 N N . GLY A 1 398 ? 10.233 16.704 11.722 1.00 51.67 ? 398 GLY A N 1 ATOM 3182 C CA . GLY A 1 398 ? 11.232 16.425 12.723 1.00 51.13 ? 398 GLY A CA 1 ATOM 3183 C C . GLY A 1 398 ? 11.609 14.948 12.685 1.00 50.55 ? 398 GLY A C 1 ATOM 3184 O O . GLY A 1 398 ? 12.771 14.588 12.876 1.00 50.70 ? 398 GLY A O 1 ATOM 3185 N N . LEU A 1 399 ? 10.624 14.083 12.474 1.00 50.26 ? 399 LEU A N 1 ATOM 3186 C CA . LEU A 1 399 ? 10.894 12.641 12.358 1.00 50.36 ? 399 LEU A CA 1 ATOM 3187 C C . LEU A 1 399 ? 11.751 12.254 11.117 1.00 50.89 ? 399 LEU A C 1 ATOM 3188 O O . LEU A 1 399 ? 12.548 11.311 11.205 1.00 49.60 ? 399 LEU A O 1 ATOM 3189 C CB . LEU A 1 399 ? 9.583 11.843 12.322 1.00 49.31 ? 399 LEU A CB 1 ATOM 3190 C CG . LEU A 1 399 ? 8.805 11.760 13.629 1.00 49.43 ? 399 LEU A CG 1 ATOM 3191 C CD1 . LEU A 1 399 ? 7.373 11.317 13.386 1.00 45.65 ? 399 LEU A CD1 1 ATOM 3192 C CD2 . LEU A 1 399 ? 9.533 10.847 14.660 1.00 45.40 ? 399 LEU A CD2 1 ATOM 3193 N N . LEU A 1 400 ? 11.555 12.950 9.974 1.00 51.07 ? 400 LEU A N 1 ATOM 3194 C CA . LEU A 1 400 ? 12.363 12.713 8.774 1.00 52.18 ? 400 LEU A CA 1 ATOM 3195 C C . LEU A 1 400 ? 13.767 13.324 8.854 1.00 52.51 ? 400 LEU A C 1 ATOM 3196 O O . LEU A 1 400 ? 14.791 12.702 8.493 1.00 52.47 ? 400 LEU A O 1 ATOM 3197 C CB . LEU A 1 400 ? 11.636 13.223 7.522 1.00 52.71 ? 400 LEU A CB 1 ATOM 3198 C CG . LEU A 1 400 ? 10.300 12.491 7.364 1.00 53.89 ? 400 LEU A CG 1 ATOM 3199 C CD1 . LEU A 1 400 ? 9.305 13.158 6.470 1.00 52.40 ? 400 LEU A CD1 1 ATOM 3200 C CD2 . LEU A 1 400 ? 10.501 10.985 7.022 1.00 52.81 ? 400 LEU A CD2 1 ATOM 3201 N N . ALA A 1 401 ? 13.836 14.523 9.414 1.00 53.32 ? 401 ALA A N 1 ATOM 3202 C CA . ALA A 1 401 ? 15.071 15.321 9.327 1.00 52.45 ? 401 ALA A CA 1 ATOM 3203 C C . ALA A 1 401 ? 15.956 15.277 10.524 1.00 52.27 ? 401 ALA A C 1 ATOM 3204 O O . ALA A 1 401 ? 17.143 15.596 10.430 1.00 52.21 ? 401 ALA A O 1 ATOM 3205 C CB . ALA A 1 401 ? 14.732 16.763 9.012 1.00 52.78 ? 401 ALA A CB 1 ATOM 3206 N N . LYS A 1 402 ? 15.408 14.921 11.679 1.00 50.98 ? 402 LYS A N 1 ATOM 3207 C CA . LYS A 1 402 ? 16.288 14.909 12.813 1.00 50.13 ? 402 LYS A CA 1 ATOM 3208 C C . LYS A 1 402 ? 16.886 13.523 12.980 1.00 49.41 ? 402 LYS A C 1 ATOM 3209 O O . LYS A 1 402 ? 16.508 12.614 12.253 1.00 48.08 ? 402 LYS A O 1 ATOM 3210 C CB . LYS A 1 402 ? 15.574 15.466 14.034 1.00 50.93 ? 402 LYS A CB 1 ATOM 3211 C CG . LYS A 1 402 ? 15.155 16.907 13.827 1.00 50.29 ? 402 LYS A CG 1 ATOM 3212 C CD . LYS A 1 402 ? 16.374 17.771 13.752 1.00 49.93 ? 402 LYS A CD 1 ATOM 3213 C CE . LYS A 1 402 ? 16.024 19.236 13.548 1.00 53.34 ? 402 LYS A CE 1 ATOM 3214 N NZ . LYS A 1 402 ? 17.160 20.113 14.056 1.00 54.12 ? 402 LYS A NZ 1 ATOM 3215 N N . LYS A 1 403 ? 17.828 13.356 13.910 1.00 49.65 ? 403 LYS A N 1 ATOM 3216 C CA . LYS A 1 403 ? 18.438 12.023 14.131 1.00 49.92 ? 403 LYS A CA 1 ATOM 3217 C C . LYS A 1 403 ? 18.056 11.351 15.426 1.00 49.03 ? 403 LYS A C 1 ATOM 3218 O O . LYS A 1 403 ? 17.606 11.998 16.336 1.00 50.07 ? 403 LYS A O 1 ATOM 3219 C CB . LYS A 1 403 ? 19.966 12.094 14.042 1.00 50.23 ? 403 LYS A CB 1 ATOM 3220 C CG . LYS A 1 403 ? 20.440 12.471 12.642 1.00 50.55 ? 403 LYS A CG 1 ATOM 3221 C CD . LYS A 1 403 ? 21.858 13.136 12.635 1.00 51.87 ? 403 LYS A CD 1 ATOM 3222 C CE . LYS A 1 403 ? 22.273 13.424 11.141 1.00 52.26 ? 403 LYS A CE 1 ATOM 3223 N NZ . LYS A 1 403 ? 21.174 14.201 10.390 1.00 50.57 ? 403 LYS A NZ 1 ATOM 3224 N N . SER A 1 404 ? 18.256 10.042 15.505 1.00 48.85 ? 404 SER A N 1 ATOM 3225 C CA . SER A 1 404 ? 17.975 9.281 16.709 1.00 47.47 ? 404 SER A CA 1 ATOM 3226 C C . SER A 1 404 ? 19.219 9.372 17.492 1.00 48.01 ? 404 SER A C 1 ATOM 3227 O O . SER A 1 404 ? 20.271 9.800 16.975 1.00 48.22 ? 404 SER A O 1 ATOM 3228 C CB . SER A 1 404 ? 17.809 7.789 16.406 1.00 46.53 ? 404 SER A CB 1 ATOM 3229 O OG . SER A 1 404 ? 16.518 7.448 15.942 1.00 47.01 ? 404 SER A OG 1 ATOM 3230 N N . LYS A 1 405 ? 19.133 8.922 18.733 1.00 47.17 ? 405 LYS A N 1 ATOM 3231 C CA . LYS A 1 405 ? 20.328 8.807 19.462 1.00 47.33 ? 405 LYS A CA 1 ATOM 3232 C C . LYS A 1 405 ? 20.986 7.487 19.072 1.00 47.32 ? 405 LYS A C 1 ATOM 3233 O O . LYS A 1 405 ? 20.324 6.581 18.617 1.00 45.65 ? 405 LYS A O 1 ATOM 3234 C CB . LYS A 1 405 ? 20.065 8.878 20.929 1.00 47.45 ? 405 LYS A CB 1 ATOM 3235 C CG . LYS A 1 405 ? 21.376 8.756 21.769 1.00 46.65 ? 405 LYS A CG 1 ATOM 3236 C CD . LYS A 1 405 ? 21.007 8.732 23.240 1.00 41.17 ? 405 LYS A CD 1 ATOM 3237 C CE . LYS A 1 405 ? 22.131 8.256 24.099 1.00 46.24 ? 405 LYS A CE 1 ATOM 3238 N NZ . LYS A 1 405 ? 22.364 6.795 24.021 1.00 47.81 ? 405 LYS A NZ 1 ATOM 3239 N N . LEU A 1 406 ? 22.309 7.432 19.212 1.00 47.91 ? 406 LEU A N 1 ATOM 3240 C CA . LEU A 1 406 ? 23.099 6.231 18.932 1.00 48.18 ? 406 LEU A CA 1 ATOM 3241 C C . LEU A 1 406 ? 23.356 5.557 20.257 1.00 48.11 ? 406 LEU A C 1 ATOM 3242 O O . LEU A 1 406 ? 23.631 6.226 21.245 1.00 47.58 ? 406 LEU A O 1 ATOM 3243 C CB . LEU A 1 406 ? 24.453 6.663 18.343 1.00 48.29 ? 406 LEU A CB 1 ATOM 3244 C CG . LEU A 1 406 ? 25.310 5.576 17.706 1.00 49.25 ? 406 LEU A CG 1 ATOM 3245 C CD1 . LEU A 1 406 ? 24.620 4.881 16.510 1.00 47.26 ? 406 LEU A CD1 1 ATOM 3246 C CD2 . LEU A 1 406 ? 26.691 6.071 17.316 1.00 49.07 ? 406 LEU A CD2 1 ATOM 3247 N N . MET A 1 407 ? 23.248 4.246 20.328 1.00 49.77 ? 407 MET A N 1 ATOM 3248 C CA . MET A 1 407 ? 23.636 3.586 21.576 1.00 50.93 ? 407 MET A CA 1 ATOM 3249 C C . MET A 1 407 ? 25.105 3.997 21.696 1.00 51.33 ? 407 MET A C 1 ATOM 3250 O O . MET A 1 407 ? 25.788 4.160 20.690 1.00 49.99 ? 407 MET A O 1 ATOM 3251 C CB . MET A 1 407 ? 23.570 2.070 21.427 1.00 51.56 ? 407 MET A CB 1 ATOM 3252 C CG . MET A 1 407 ? 23.381 1.259 22.715 1.00 53.34 ? 407 MET A CG 1 ATOM 3253 S SD . MET A 1 407 ? 23.700 2.136 24.311 1.00 61.29 ? 407 MET A SD 1 ATOM 3254 C CE . MET A 1 407 ? 25.287 1.175 24.926 1.00 52.94 ? 407 MET A CE 1 ATOM 3255 N N . ASN A 1 408 ? 25.592 4.085 22.923 1.00 52.00 ? 408 ASN A N 1 ATOM 3256 C CA . ASN A 1 408 ? 26.927 4.507 23.207 1.00 52.16 ? 408 ASN A CA 1 ATOM 3257 C C . ASN A 1 408 ? 27.211 3.918 24.577 1.00 52.31 ? 408 ASN A C 1 ATOM 3258 O O . ASN A 1 408 ? 26.434 4.160 25.504 1.00 52.42 ? 408 ASN A O 1 ATOM 3259 C CB . ASN A 1 408 ? 26.879 6.030 23.307 1.00 53.06 ? 408 ASN A CB 1 ATOM 3260 C CG . ASN A 1 408 ? 28.213 6.670 23.105 1.00 55.11 ? 408 ASN A CG 1 ATOM 3261 O OD1 . ASN A 1 408 ? 29.212 6.238 23.678 1.00 56.37 ? 408 ASN A OD1 1 ATOM 3262 N ND2 . ASN A 1 408 ? 28.247 7.711 22.268 1.00 57.38 ? 408 ASN A ND2 1 ATOM 3263 N N . GLN A 1 409 ? 28.331 3.218 24.747 1.00 51.83 ? 409 GLN A N 1 ATOM 3264 C CA . GLN A 1 409 ? 28.591 2.517 25.991 1.00 50.95 ? 409 GLN A CA 1 ATOM 3265 C C . GLN A 1 409 ? 28.905 3.438 27.147 1.00 51.89 ? 409 GLN A C 1 ATOM 3266 O O . GLN A 1 409 ? 28.878 3.036 28.342 1.00 51.10 ? 409 GLN A O 1 ATOM 3267 C CB . GLN A 1 409 ? 29.716 1.511 25.834 1.00 50.82 ? 409 GLN A CB 1 ATOM 3268 C CG . GLN A 1 409 ? 29.450 0.356 24.891 1.00 49.71 ? 409 GLN A CG 1 ATOM 3269 C CD . GLN A 1 409 ? 30.726 -0.439 24.692 1.00 50.22 ? 409 GLN A CD 1 ATOM 3270 O OE1 . GLN A 1 409 ? 31.810 0.154 24.519 1.00 50.69 ? 409 GLN A OE1 1 ATOM 3271 N NE2 . GLN A 1 409 ? 30.628 -1.760 24.780 1.00 47.53 ? 409 GLN A NE2 1 ATOM 3272 N N . ASP A 1 410 ? 29.242 4.675 26.810 1.00 51.77 ? 410 ASP A N 1 ATOM 3273 C CA . ASP A 1 410 ? 29.537 5.613 27.867 1.00 51.72 ? 410 ASP A CA 1 ATOM 3274 C C . ASP A 1 410 ? 28.411 6.657 27.918 1.00 50.15 ? 410 ASP A C 1 ATOM 3275 O O . ASP A 1 410 ? 28.496 7.632 28.646 1.00 49.98 ? 410 ASP A O 1 ATOM 3276 C CB . ASP A 1 410 ? 30.952 6.233 27.680 1.00 53.05 ? 410 ASP A CB 1 ATOM 3277 C CG . ASP A 1 410 ? 32.013 5.175 27.424 1.00 55.61 ? 410 ASP A CG 1 ATOM 3278 O OD1 . ASP A 1 410 ? 32.392 4.456 28.382 1.00 61.93 ? 410 ASP A OD1 1 ATOM 3279 O OD2 . ASP A 1 410 ? 32.495 4.935 26.286 1.00 58.20 ? 410 ASP A OD2 1 ATOM 3280 N N . LYS A 1 411 ? 27.357 6.460 27.129 1.00 48.49 ? 411 LYS A N 1 ATOM 3281 C CA . LYS A 1 411 ? 26.236 7.424 27.120 1.00 46.79 ? 411 LYS A CA 1 ATOM 3282 C C . LYS A 1 411 ? 24.972 6.628 26.802 1.00 45.20 ? 411 LYS A C 1 ATOM 3283 O O . LYS A 1 411 ? 24.404 6.730 25.724 1.00 44.18 ? 411 LYS A O 1 ATOM 3284 C CB . LYS A 1 411 ? 26.446 8.530 26.088 1.00 47.74 ? 411 LYS A CB 1 ATOM 3285 C CG . LYS A 1 411 ? 27.705 9.404 26.307 1.00 49.07 ? 411 LYS A CG 1 ATOM 3286 C CD . LYS A 1 411 ? 27.682 10.626 25.396 1.00 50.77 ? 411 LYS A CD 1 ATOM 3287 C CE . LYS A 1 411 ? 28.908 11.531 25.654 1.00 54.69 ? 411 LYS A CE 1 ATOM 3288 N NZ . LYS A 1 411 ? 29.020 12.643 24.659 1.00 52.73 ? 411 LYS A NZ 1 ATOM 3289 N N . MET A 1 412 ? 24.550 5.792 27.739 1.00 43.13 ? 412 MET A N 1 ATOM 3290 C CA . MET A 1 412 ? 23.461 4.911 27.420 1.00 43.06 ? 412 MET A CA 1 ATOM 3291 C C . MET A 1 412 ? 22.074 5.566 27.312 1.00 41.93 ? 412 MET A C 1 ATOM 3292 O O . MET A 1 412 ? 21.526 5.636 26.233 1.00 42.04 ? 412 MET A O 1 ATOM 3293 C CB . MET A 1 412 ? 23.480 3.737 28.350 1.00 43.32 ? 412 MET A CB 1 ATOM 3294 C CG . MET A 1 412 ? 24.732 2.971 28.197 1.00 43.70 ? 412 MET A CG 1 ATOM 3295 S SD . MET A 1 412 ? 24.451 1.561 29.130 1.00 48.01 ? 412 MET A SD 1 ATOM 3296 C CE . MET A 1 412 ? 26.174 1.047 29.501 1.00 49.20 ? 412 MET A CE 1 ATOM 3297 N N . VAL A 1 413 ? 21.562 6.134 28.384 1.00 40.31 ? 413 VAL A N 1 ATOM 3298 C CA . VAL A 1 413 ? 20.213 6.685 28.306 1.00 40.87 ? 413 VAL A CA 1 ATOM 3299 C C . VAL A 1 413 ? 20.166 8.126 28.764 1.00 40.94 ? 413 VAL A C 1 ATOM 3300 O O . VAL A 1 413 ? 20.569 8.454 29.879 1.00 42.11 ? 413 VAL A O 1 ATOM 3301 C CB . VAL A 1 413 ? 19.195 5.811 29.113 1.00 40.92 ? 413 VAL A CB 1 ATOM 3302 C CG1 . VAL A 1 413 ? 17.837 6.465 29.152 1.00 40.00 ? 413 VAL A CG1 1 ATOM 3303 C CG2 . VAL A 1 413 ? 19.108 4.299 28.534 1.00 37.17 ? 413 VAL A CG2 1 ATOM 3304 N N . THR A 1 414 ? 19.698 8.988 27.893 1.00 40.95 ? 414 THR A N 1 ATOM 3305 C CA . THR A 1 414 ? 19.522 10.405 28.205 1.00 42.21 ? 414 THR A CA 1 ATOM 3306 C C . THR A 1 414 ? 18.720 10.765 29.473 1.00 42.86 ? 414 THR A C 1 ATOM 3307 O O . THR A 1 414 ? 17.682 10.189 29.819 1.00 43.22 ? 414 THR A O 1 ATOM 3308 C CB . THR A 1 414 ? 18.896 11.074 27.007 1.00 42.08 ? 414 THR A CB 1 ATOM 3309 O OG1 . THR A 1 414 ? 18.793 12.474 27.270 1.00 45.33 ? 414 THR A OG1 1 ATOM 3310 C CG2 . THR A 1 414 ? 17.425 10.592 26.846 1.00 42.57 ? 414 THR A CG2 1 ATOM 3311 N N . SER A 1 415 ? 19.243 11.741 30.180 1.00 44.29 ? 415 SER A N 1 ATOM 3312 C CA . SER A 1 415 ? 18.694 12.192 31.445 1.00 43.91 ? 415 SER A CA 1 ATOM 3313 C C . SER A 1 415 ? 17.228 12.585 31.295 1.00 44.02 ? 415 SER A C 1 ATOM 3314 O O . SER A 1 415 ? 16.502 12.695 32.258 1.00 42.35 ? 415 SER A O 1 ATOM 3315 C CB . SER A 1 415 ? 19.496 13.369 31.898 1.00 42.98 ? 415 SER A CB 1 ATOM 3316 O OG . SER A 1 415 ? 20.717 12.886 32.423 1.00 47.49 ? 415 SER A OG 1 ATOM 3317 N N . GLU A 1 416 ? 16.800 12.791 30.067 1.00 44.93 ? 416 GLU A N 1 ATOM 3318 C CA . GLU A 1 416 ? 15.421 13.177 29.871 1.00 46.31 ? 416 GLU A CA 1 ATOM 3319 C C . GLU A 1 416 ? 14.554 11.974 30.283 1.00 46.10 ? 416 GLU A C 1 ATOM 3320 O O . GLU A 1 416 ? 13.521 12.142 30.929 1.00 46.63 ? 416 GLU A O 1 ATOM 3321 C CB . GLU A 1 416 ? 15.193 13.620 28.438 1.00 46.85 ? 416 GLU A CB 1 ATOM 3322 C CG . GLU A 1 416 ? 15.956 14.882 28.037 1.00 49.30 ? 416 GLU A CG 1 ATOM 3323 C CD . GLU A 1 416 ? 15.393 16.145 28.681 1.00 55.15 ? 416 GLU A CD 1 ATOM 3324 O OE1 . GLU A 1 416 ? 16.145 16.881 29.347 1.00 54.44 ? 416 GLU A OE1 1 ATOM 3325 O OE2 . GLU A 1 416 ? 14.178 16.400 28.522 1.00 59.42 ? 416 GLU A OE2 1 ATOM 3326 N N . LEU A 1 417 ? 15.039 10.765 29.995 1.00 44.00 ? 417 LEU A N 1 ATOM 3327 C CA . LEU A 1 417 ? 14.326 9.545 30.373 1.00 42.88 ? 417 LEU A CA 1 ATOM 3328 C C . LEU A 1 417 ? 14.835 8.987 31.682 1.00 42.54 ? 417 LEU A C 1 ATOM 3329 O O . LEU A 1 417 ? 14.076 8.427 32.458 1.00 41.93 ? 417 LEU A O 1 ATOM 3330 C CB . LEU A 1 417 ? 14.470 8.440 29.314 1.00 40.70 ? 417 LEU A CB 1 ATOM 3331 C CG . LEU A 1 417 ? 13.808 8.710 28.011 1.00 41.30 ? 417 LEU A CG 1 ATOM 3332 C CD1 . LEU A 1 417 ? 14.467 7.869 26.889 1.00 39.88 ? 417 LEU A CD1 1 ATOM 3333 C CD2 . LEU A 1 417 ? 12.245 8.436 28.105 1.00 39.66 ? 417 LEU A CD2 1 ATOM 3334 N N . ARG A 1 418 ? 16.138 9.090 31.882 1.00 43.35 ? 418 ARG A N 1 ATOM 3335 C CA . ARG A 1 418 ? 16.784 8.575 33.091 1.00 44.96 ? 418 ARG A CA 1 ATOM 3336 C C . ARG A 1 418 ? 16.529 9.419 34.347 1.00 44.81 ? 418 ARG A C 1 ATOM 3337 O O . ARG A 1 418 ? 16.585 8.904 35.458 1.00 45.92 ? 418 ARG A O 1 ATOM 3338 C CB . ARG A 1 418 ? 18.310 8.431 32.871 1.00 44.14 ? 418 ARG A CB 1 ATOM 3339 C CG . ARG A 1 418 ? 18.977 7.310 33.612 1.00 42.65 ? 418 ARG A CG 1 ATOM 3340 C CD . ARG A 1 418 ? 20.564 7.330 33.537 1.00 45.11 ? 418 ARG A CD 1 ATOM 3341 N NE . ARG A 1 418 ? 21.165 8.492 34.236 1.00 44.92 ? 418 ARG A NE 1 ATOM 3342 C CZ . ARG A 1 418 ? 21.352 8.557 35.554 1.00 44.96 ? 418 ARG A CZ 1 ATOM 3343 N NH1 . ARG A 1 418 ? 21.021 7.528 36.326 1.00 47.42 ? 418 ARG A NH1 1 ATOM 3344 N NH2 . ARG A 1 418 ? 21.884 9.639 36.103 1.00 46.06 ? 418 ARG A NH2 1 ATOM 3345 N N . ASN A 1 419 ? 16.238 10.696 34.177 1.00 45.34 ? 419 ASN A N 1 ATOM 3346 C CA . ASN A 1 419 ? 16.140 11.574 35.345 1.00 47.66 ? 419 ASN A CA 1 ATOM 3347 C C . ASN A 1 419 ? 14.827 12.305 35.443 1.00 47.88 ? 419 ASN A C 1 ATOM 3348 O O . ASN A 1 419 ? 14.363 12.652 36.533 1.00 48.95 ? 419 ASN A O 1 ATOM 3349 C CB . ASN A 1 419 ? 17.249 12.643 35.310 1.00 46.71 ? 419 ASN A CB 1 ATOM 3350 C CG . ASN A 1 419 ? 18.528 12.183 35.974 1.00 47.44 ? 419 ASN A CG 1 ATOM 3351 O OD1 . ASN A 1 419 ? 18.503 11.663 37.090 1.00 50.67 ? 419 ASN A OD1 1 ATOM 3352 N ND2 . ASN A 1 419 ? 19.653 12.355 35.294 1.00 50.11 ? 419 ASN A ND2 1 ATOM 3353 N N . LYS A 1 420 ? 14.247 12.533 34.276 1.00 48.47 ? 420 LYS A N 1 ATOM 3354 C CA . LYS A 1 420 ? 13.070 13.390 34.114 1.00 49.62 ? 420 LYS A CA 1 ATOM 3355 C C . LYS A 1 420 ? 11.799 12.755 33.546 1.00 49.55 ? 420 LYS A C 1 ATOM 3356 O O . LYS A 1 420 ? 11.000 13.458 32.933 1.00 51.41 ? 420 LYS A O 1 ATOM 3357 C CB . LYS A 1 420 ? 13.436 14.542 33.191 1.00 48.06 ? 420 LYS A CB 1 ATOM 3358 C CG . LYS A 1 420 ? 14.385 15.545 33.795 1.00 51.13 ? 420 LYS A CG 1 ATOM 3359 C CD . LYS A 1 420 ? 14.412 16.836 32.986 1.00 53.97 ? 420 LYS A CD 1 ATOM 3360 C CE . LYS A 1 420 ? 15.656 17.681 33.231 1.00 52.35 ? 420 LYS A CE 1 ATOM 3361 N NZ . LYS A 1 420 ? 15.784 18.630 32.087 1.00 53.42 ? 420 LYS A NZ 1 ATOM 3362 N N . LEU A 1 421 ? 11.615 11.456 33.706 1.00 50.08 ? 421 LEU A N 1 ATOM 3363 C CA . LEU A 1 421 ? 10.436 10.767 33.157 1.00 50.14 ? 421 LEU A CA 1 ATOM 3364 C C . LEU A 1 421 ? 9.266 11.030 34.092 1.00 51.30 ? 421 LEU A C 1 ATOM 3365 O O . LEU A 1 421 ? 9.410 11.079 35.316 1.00 52.12 ? 421 LEU A O 1 ATOM 3366 C CB . LEU A 1 421 ? 10.672 9.250 33.044 1.00 49.02 ? 421 LEU A CB 1 ATOM 3367 C CG . LEU A 1 421 ? 9.493 8.374 32.647 1.00 49.11 ? 421 LEU A CG 1 ATOM 3368 C CD1 . LEU A 1 421 ? 9.209 8.456 31.177 1.00 50.91 ? 421 LEU A CD1 1 ATOM 3369 C CD2 . LEU A 1 421 ? 9.658 6.936 33.030 1.00 50.52 ? 421 LEU A CD2 1 ATOM 3370 N N . PHE A 1 422 ? 8.125 11.261 33.491 1.00 51.92 ? 422 PHE A N 1 ATOM 3371 C CA . PHE A 1 422 ? 6.920 11.499 34.222 1.00 52.00 ? 422 PHE A CA 1 ATOM 3372 C C . PHE A 1 422 ? 6.127 10.197 34.243 1.00 52.78 ? 422 PHE A C 1 ATOM 3373 O O . PHE A 1 422 ? 5.865 9.609 33.199 1.00 51.80 ? 422 PHE A O 1 ATOM 3374 C CB . PHE A 1 422 ? 6.134 12.599 33.508 1.00 50.33 ? 422 PHE A CB 1 ATOM 3375 C CG . PHE A 1 422 ? 4.784 12.786 34.033 1.00 46.78 ? 422 PHE A CG 1 ATOM 3376 C CD1 . PHE A 1 422 ? 4.545 13.741 34.986 1.00 51.32 ? 422 PHE A CD1 1 ATOM 3377 C CD2 . PHE A 1 422 ? 3.755 12.012 33.611 1.00 43.69 ? 422 PHE A CD2 1 ATOM 3378 C CE1 . PHE A 1 422 ? 3.281 13.955 35.480 1.00 45.78 ? 422 PHE A CE1 1 ATOM 3379 C CE2 . PHE A 1 422 ? 2.505 12.165 34.095 1.00 45.65 ? 422 PHE A CE2 1 ATOM 3380 C CZ . PHE A 1 422 ? 2.249 13.151 35.042 1.00 49.92 ? 422 PHE A CZ 1 ATOM 3381 N N . GLN A 1 423 ? 5.730 9.774 35.434 1.00 55.00 ? 423 GLN A N 1 ATOM 3382 C CA . GLN A 1 423 ? 4.918 8.543 35.539 1.00 58.94 ? 423 GLN A CA 1 ATOM 3383 C C . GLN A 1 423 ? 3.544 8.934 36.028 1.00 60.23 ? 423 GLN A C 1 ATOM 3384 O O . GLN A 1 423 ? 3.427 9.477 37.128 1.00 61.58 ? 423 GLN A O 1 ATOM 3385 C CB . GLN A 1 423 ? 5.538 7.517 36.477 1.00 59.47 ? 423 GLN A CB 1 ATOM 3386 C CG . GLN A 1 423 ? 6.617 6.701 35.815 1.00 62.02 ? 423 GLN A CG 1 ATOM 3387 C CD . GLN A 1 423 ? 6.085 5.848 34.659 1.00 64.28 ? 423 GLN A CD 1 ATOM 3388 O OE1 . GLN A 1 423 ? 6.097 4.643 34.744 1.00 64.18 ? 423 GLN A OE1 1 ATOM 3389 N NE2 . GLN A 1 423 ? 5.630 6.495 33.574 1.00 65.68 ? 423 GLN A NE2 1 ATOM 3390 N N . PRO A 1 424 ? 2.519 8.650 35.221 1.00 60.61 ? 424 PRO A N 1 ATOM 3391 C CA . PRO A 1 424 ? 1.133 9.005 35.530 1.00 61.75 ? 424 PRO A CA 1 ATOM 3392 C C . PRO A 1 424 ? 0.797 8.665 36.968 1.00 61.95 ? 424 PRO A C 1 ATOM 3393 O O . PRO A 1 424 ? 0.986 7.545 37.424 1.00 60.63 ? 424 PRO A O 1 ATOM 3394 C CB . PRO A 1 424 ? 0.314 8.128 34.584 1.00 61.34 ? 424 PRO A CB 1 ATOM 3395 C CG . PRO A 1 424 ? 1.222 7.812 33.420 1.00 61.80 ? 424 PRO A CG 1 ATOM 3396 C CD . PRO A 1 424 ? 2.620 7.822 34.008 1.00 61.19 ? 424 PRO A CD 1 ATOM 3397 N N . THR A 1 425 ? 0.348 9.690 37.679 1.00 63.54 ? 425 THR A N 1 ATOM 3398 C CA . THR A 1 425 ? -0.102 9.601 39.068 1.00 65.69 ? 425 THR A CA 1 ATOM 3399 C C . THR A 1 425 ? 1.045 9.739 40.051 1.00 66.33 ? 425 THR A C 1 ATOM 3400 O O . THR A 1 425 ? 0.890 9.476 41.248 1.00 67.00 ? 425 THR A O 1 ATOM 3401 C CB . THR A 1 425 ? -0.872 8.296 39.296 1.00 66.10 ? 425 THR A CB 1 ATOM 3402 O OG1 . THR A 1 425 ? 0.038 7.266 39.696 1.00 64.79 ? 425 THR A OG1 1 ATOM 3403 C CG2 . THR A 1 425 ? -1.467 7.795 37.957 1.00 68.66 ? 425 THR A CG2 1 ATOM 3404 N N . HIS A 1 426 ? 2.214 10.112 39.539 1.00 66.86 ? 426 HIS A N 1 ATOM 3405 C CA . HIS A 1 426 ? 3.351 10.382 40.402 1.00 67.77 ? 426 HIS A CA 1 ATOM 3406 C C . HIS A 1 426 ? 3.865 11.810 40.236 1.00 67.44 ? 426 HIS A C 1 ATOM 3407 O O . HIS A 1 426 ? 4.980 12.140 40.645 1.00 68.61 ? 426 HIS A O 1 ATOM 3408 C CB . HIS A 1 426 ? 4.445 9.363 40.191 1.00 67.83 ? 426 HIS A CB 1 ATOM 3409 C CG . HIS A 1 426 ? 3.994 7.957 40.406 1.00 70.03 ? 426 HIS A CG 1 ATOM 3410 N ND1 . HIS A 1 426 ? 3.853 7.395 41.657 1.00 71.40 ? 426 HIS A ND1 1 ATOM 3411 C CD2 . HIS A 1 426 ? 3.666 6.986 39.522 1.00 72.54 ? 426 HIS A CD2 1 ATOM 3412 C CE1 . HIS A 1 426 ? 3.467 6.138 41.532 1.00 69.89 ? 426 HIS A CE1 1 ATOM 3413 N NE2 . HIS A 1 426 ? 3.338 5.867 40.249 1.00 70.55 ? 426 HIS A NE2 1 ATOM 3414 N N . LYS A 1 427 ? 3.048 12.639 39.606 1.00 66.67 ? 427 LYS A N 1 ATOM 3415 C CA . LYS A 1 427 ? 3.266 14.078 39.553 1.00 67.24 ? 427 LYS A CA 1 ATOM 3416 C C . LYS A 1 427 ? 4.691 14.627 39.775 1.00 66.41 ? 427 LYS A C 1 ATOM 3417 O O . LYS A 1 427 ? 4.903 15.359 40.746 1.00 68.50 ? 427 LYS A O 1 ATOM 3418 C CB . LYS A 1 427 ? 2.381 14.713 40.631 1.00 67.20 ? 427 LYS A CB 1 ATOM 3419 C CG . LYS A 1 427 ? 2.680 14.151 42.007 1.00 70.29 ? 427 LYS A CG 1 ATOM 3420 C CD . LYS A 1 427 ? 1.599 14.459 43.025 1.00 74.84 ? 427 LYS A CD 1 ATOM 3421 C CE . LYS A 1 427 ? 0.425 13.482 42.907 1.00 78.43 ? 427 LYS A CE 1 ATOM 3422 N NZ . LYS A 1 427 ? -0.689 13.878 43.799 1.00 79.48 ? 427 LYS A NZ 1 ATOM 3423 N N . ILE A 1 428 ? 5.664 14.302 38.942 1.00 63.96 ? 428 ILE A N 1 ATOM 3424 C CA . ILE A 1 428 ? 6.984 14.969 38.944 1.00 61.96 ? 428 ILE A CA 1 ATOM 3425 C C . ILE A 1 428 ? 7.810 14.496 37.774 1.00 60.34 ? 428 ILE A C 1 ATOM 3426 O O . ILE A 1 428 ? 8.139 13.312 37.681 1.00 60.88 ? 428 ILE A O 1 ATOM 3427 C CB . ILE A 1 428 ? 7.889 14.686 40.177 1.00 61.68 ? 428 ILE A CB 1 ATOM 3428 C CG1 . ILE A 1 428 ? 7.807 13.231 40.676 1.00 62.86 ? 428 ILE A CG1 1 ATOM 3429 C CG2 . ILE A 1 428 ? 7.548 15.644 41.312 1.00 60.58 ? 428 ILE A CG2 1 ATOM 3430 C CD1 . ILE A 1 428 ? 8.891 12.870 41.661 1.00 63.45 ? 428 ILE A CD1 1 ATOM 3431 N N . HIS A 1 429 ? 8.137 15.416 36.890 1.00 58.26 ? 429 HIS A N 1 ATOM 3432 C CA . HIS A 1 429 ? 9.046 15.018 35.837 1.00 56.18 ? 429 HIS A CA 1 ATOM 3433 C C . HIS A 1 429 ? 10.363 14.569 36.494 1.00 55.25 ? 429 HIS A C 1 ATOM 3434 O O . HIS A 1 429 ? 11.387 15.228 36.421 1.00 55.21 ? 429 HIS A O 1 ATOM 3435 C CB . HIS A 1 429 ? 9.204 16.064 34.752 1.00 55.72 ? 429 HIS A CB 1 ATOM 3436 C CG . HIS A 1 429 ? 8.013 16.169 33.850 1.00 53.77 ? 429 HIS A CG 1 ATOM 3437 N ND1 . HIS A 1 429 ? 6.879 16.876 34.187 1.00 55.60 ? 429 HIS A ND1 1 ATOM 3438 C CD2 . HIS A 1 429 ? 7.781 15.665 32.617 1.00 53.95 ? 429 HIS A CD2 1 ATOM 3439 C CE1 . HIS A 1 429 ? 6.001 16.805 33.200 1.00 56.41 ? 429 HIS A CE1 1 ATOM 3440 N NE2 . HIS A 1 429 ? 6.526 16.079 32.231 1.00 54.12 ? 429 HIS A NE2 1 ATOM 3441 N N . GLY A 1 430 ? 10.320 13.405 37.142 1.00 54.14 ? 430 GLY A N 1 ATOM 3442 C CA . GLY A 1 430 ? 11.492 12.930 37.860 1.00 53.59 ? 430 GLY A CA 1 ATOM 3443 C C . GLY A 1 430 ? 11.762 11.451 38.104 1.00 52.62 ? 430 GLY A C 1 ATOM 3444 O O . GLY A 1 430 ? 12.394 11.120 39.095 1.00 52.33 ? 430 GLY A O 1 ATOM 3445 N N . PHE A 1 431 ? 11.334 10.572 37.207 1.00 51.61 ? 431 PHE A N 1 ATOM 3446 C CA . PHE A 1 431 ? 11.621 9.144 37.378 1.00 52.05 ? 431 PHE A CA 1 ATOM 3447 C C . PHE A 1 431 ? 12.788 8.621 36.549 1.00 50.33 ? 431 PHE A C 1 ATOM 3448 O O . PHE A 1 431 ? 13.414 9.335 35.797 1.00 50.72 ? 431 PHE A O 1 ATOM 3449 C CB . PHE A 1 431 ? 10.417 8.310 37.017 1.00 51.73 ? 431 PHE A CB 1 ATOM 3450 C CG . PHE A 1 431 ? 9.404 8.226 38.090 1.00 57.71 ? 431 PHE A CG 1 ATOM 3451 C CD1 . PHE A 1 431 ? 8.760 9.366 38.539 1.00 61.97 ? 431 PHE A CD1 1 ATOM 3452 C CD2 . PHE A 1 431 ? 9.042 6.988 38.617 1.00 61.22 ? 431 PHE A CD2 1 ATOM 3453 C CE1 . PHE A 1 431 ? 7.802 9.290 39.540 1.00 63.78 ? 431 PHE A CE1 1 ATOM 3454 C CE2 . PHE A 1 431 ? 8.080 6.900 39.582 1.00 63.79 ? 431 PHE A CE2 1 ATOM 3455 C CZ . PHE A 1 431 ? 7.449 8.058 40.046 1.00 64.58 ? 431 PHE A CZ 1 ATOM 3456 N N . ASP A 1 432 ? 13.041 7.330 36.633 1.00 48.95 ? 432 ASP A N 1 ATOM 3457 C CA . ASP A 1 432 ? 14.164 6.788 35.895 1.00 46.65 ? 432 ASP A CA 1 ATOM 3458 C C . ASP A 1 432 ? 13.802 5.528 35.099 1.00 45.20 ? 432 ASP A C 1 ATOM 3459 O O . ASP A 1 432 ? 13.623 4.448 35.652 1.00 44.97 ? 432 ASP A O 1 ATOM 3460 C CB . ASP A 1 432 ? 15.297 6.499 36.860 1.00 45.62 ? 432 ASP A CB 1 ATOM 3461 C CG . ASP A 1 432 ? 16.519 5.979 36.172 1.00 44.98 ? 432 ASP A CG 1 ATOM 3462 O OD1 . ASP A 1 432 ? 16.423 5.487 35.024 1.00 43.94 ? 432 ASP A OD1 1 ATOM 3463 O OD2 . ASP A 1 432 ? 17.618 5.903 36.734 1.00 47.45 ? 432 ASP A OD2 1 ATOM 3464 N N . LEU A 1 433 ? 13.709 5.705 33.788 1.00 43.63 ? 433 LEU A N 1 ATOM 3465 C CA . LEU A 1 433 ? 13.342 4.631 32.879 1.00 42.78 ? 433 LEU A CA 1 ATOM 3466 C C . LEU A 1 433 ? 14.340 3.505 32.899 1.00 42.18 ? 433 LEU A C 1 ATOM 3467 O O . LEU A 1 433 ? 13.941 2.348 32.768 1.00 40.26 ? 433 LEU A O 1 ATOM 3468 C CB . LEU A 1 433 ? 13.167 5.147 31.452 1.00 43.41 ? 433 LEU A CB 1 ATOM 3469 C CG . LEU A 1 433 ? 12.662 4.090 30.460 1.00 44.54 ? 433 LEU A CG 1 ATOM 3470 C CD1 . LEU A 1 433 ? 11.443 3.329 31.022 1.00 41.19 ? 433 LEU A CD1 1 ATOM 3471 C CD2 . LEU A 1 433 ? 12.357 4.766 29.139 1.00 38.20 ? 433 LEU A CD2 1 ATOM 3472 N N . ALA A 1 434 ? 15.640 3.840 33.083 1.00 41.73 ? 434 ALA A N 1 ATOM 3473 C CA . ALA A 1 434 ? 16.659 2.793 33.140 1.00 39.85 ? 434 ALA A CA 1 ATOM 3474 C C . ALA A 1 434 ? 16.423 1.967 34.392 1.00 40.03 ? 434 ALA A C 1 ATOM 3475 O O . ALA A 1 434 ? 16.369 0.723 34.347 1.00 40.10 ? 434 ALA A O 1 ATOM 3476 C CB . ALA A 1 434 ? 18.078 3.390 33.150 1.00 38.75 ? 434 ALA A CB 1 ATOM 3477 N N . ALA A 1 435 ? 16.322 2.668 35.523 1.00 39.39 ? 435 ALA A N 1 ATOM 3478 C CA . ALA A 1 435 ? 16.141 1.994 36.801 1.00 39.88 ? 435 ALA A CA 1 ATOM 3479 C C . ALA A 1 435 ? 14.966 1.078 36.719 1.00 40.78 ? 435 ALA A C 1 ATOM 3480 O O . ALA A 1 435 ? 15.016 -0.007 37.223 1.00 41.43 ? 435 ALA A O 1 ATOM 3481 C CB . ALA A 1 435 ? 15.926 2.984 37.941 1.00 40.57 ? 435 ALA A CB 1 ATOM 3482 N N . ILE A 1 436 ? 13.899 1.566 36.098 1.00 41.12 ? 436 ILE A N 1 ATOM 3483 C CA . ILE A 1 436 ? 12.649 0.845 35.995 1.00 41.62 ? 436 ILE A CA 1 ATOM 3484 C C . ILE A 1 436 ? 12.780 -0.327 35.091 1.00 42.60 ? 436 ILE A C 1 ATOM 3485 O O . ILE A 1 436 ? 12.258 -1.338 35.441 1.00 43.80 ? 436 ILE A O 1 ATOM 3486 C CB . ILE A 1 436 ? 11.545 1.783 35.511 1.00 42.44 ? 436 ILE A CB 1 ATOM 3487 C CG1 . ILE A 1 436 ? 11.341 2.924 36.495 1.00 42.72 ? 436 ILE A CG1 1 ATOM 3488 C CG2 . ILE A 1 436 ? 10.216 1.074 35.379 1.00 40.22 ? 436 ILE A CG2 1 ATOM 3489 C CD1 . ILE A 1 436 ? 10.305 3.798 35.960 1.00 40.58 ? 436 ILE A CD1 1 ATOM 3490 N N . ASN A 1 437 ? 13.462 -0.224 33.950 1.00 42.91 ? 437 ASN A N 1 ATOM 3491 C CA . ASN A 1 437 ? 13.663 -1.395 33.094 1.00 42.85 ? 437 ASN A CA 1 ATOM 3492 C C . ASN A 1 437 ? 14.364 -2.506 33.889 1.00 44.28 ? 437 ASN A C 1 ATOM 3493 O O . ASN A 1 437 ? 14.100 -3.696 33.683 1.00 44.11 ? 437 ASN A O 1 ATOM 3494 C CB . ASN A 1 437 ? 14.628 -1.068 31.944 1.00 42.39 ? 437 ASN A CB 1 ATOM 3495 C CG . ASN A 1 437 ? 14.033 -0.187 30.873 1.00 39.32 ? 437 ASN A CG 1 ATOM 3496 O OD1 . ASN A 1 437 ? 14.773 0.391 30.065 1.00 39.10 ? 437 ASN A OD1 1 ATOM 3497 N ND2 . ASN A 1 437 ? 12.719 -0.130 30.796 1.00 39.00 ? 437 ASN A ND2 1 ATOM 3498 N N . LEU A 1 438 ? 15.305 -2.088 34.750 1.00 44.34 ? 438 LEU A N 1 ATOM 3499 C CA . LEU A 1 438 ? 16.125 -2.974 35.592 1.00 45.31 ? 438 LEU A CA 1 ATOM 3500 C C . LEU A 1 438 ? 15.326 -3.617 36.716 1.00 45.20 ? 438 LEU A C 1 ATOM 3501 O O . LEU A 1 438 ? 15.464 -4.794 37.006 1.00 44.36 ? 438 LEU A O 1 ATOM 3502 C CB . LEU A 1 438 ? 17.358 -2.258 36.174 1.00 44.88 ? 438 LEU A CB 1 ATOM 3503 C CG . LEU A 1 438 ? 18.454 -1.938 35.159 1.00 46.91 ? 438 LEU A CG 1 ATOM 3504 C CD1 . LEU A 1 438 ? 19.610 -1.246 35.834 1.00 52.01 ? 438 LEU A CD1 1 ATOM 3505 C CD2 . LEU A 1 438 ? 18.939 -3.175 34.458 1.00 49.85 ? 438 LEU A CD2 1 ATOM 3506 N N . GLN A 1 439 ? 14.505 -2.823 37.366 1.00 46.23 ? 439 GLN A N 1 ATOM 3507 C CA . GLN A 1 439 ? 13.596 -3.373 38.380 1.00 47.20 ? 439 GLN A CA 1 ATOM 3508 C C . GLN A 1 439 ? 12.570 -4.355 37.738 1.00 46.10 ? 439 GLN A C 1 ATOM 3509 O O . GLN A 1 439 ? 12.278 -5.411 38.274 1.00 45.63 ? 439 GLN A O 1 ATOM 3510 C CB . GLN A 1 439 ? 12.876 -2.220 39.094 1.00 47.44 ? 439 GLN A CB 1 ATOM 3511 C CG . GLN A 1 439 ? 12.188 -2.673 40.335 1.00 48.66 ? 439 GLN A CG 1 ATOM 3512 C CD . GLN A 1 439 ? 13.027 -2.479 41.563 1.00 52.10 ? 439 GLN A CD 1 ATOM 3513 O OE1 . GLN A 1 439 ? 14.262 -2.596 41.521 1.00 51.50 ? 439 GLN A OE1 1 ATOM 3514 N NE2 . GLN A 1 439 ? 12.367 -2.155 42.672 1.00 51.22 ? 439 GLN A NE2 1 ATOM 3515 N N . ARG A 1 440 ? 12.095 -4.014 36.554 1.00 45.78 ? 440 ARG A N 1 ATOM 3516 C CA . ARG A 1 440 ? 11.137 -4.824 35.806 1.00 46.09 ? 440 ARG A CA 1 ATOM 3517 C C . ARG A 1 440 ? 11.695 -6.227 35.423 1.00 46.75 ? 440 ARG A C 1 ATOM 3518 O O . ARG A 1 440 ? 10.977 -7.221 35.481 1.00 45.67 ? 440 ARG A O 1 ATOM 3519 C CB . ARG A 1 440 ? 10.614 -4.033 34.572 1.00 45.20 ? 440 ARG A CB 1 ATOM 3520 C CG . ARG A 1 440 ? 9.265 -4.535 33.972 1.00 46.09 ? 440 ARG A CG 1 ATOM 3521 C CD . ARG A 1 440 ? 8.111 -4.384 34.917 1.00 46.63 ? 440 ARG A CD 1 ATOM 3522 N NE . ARG A 1 440 ? 7.726 -3.003 35.031 1.00 46.45 ? 440 ARG A NE 1 ATOM 3523 C CZ . ARG A 1 440 ? 7.042 -2.504 36.042 1.00 46.77 ? 440 ARG A CZ 1 ATOM 3524 N NH1 . ARG A 1 440 ? 6.667 -3.318 37.039 1.00 46.33 ? 440 ARG A NH1 1 ATOM 3525 N NH2 . ARG A 1 440 ? 6.743 -1.194 36.054 1.00 40.35 ? 440 ARG A NH2 1 ATOM 3526 N N . CYS A 1 441 ? 12.973 -6.281 35.048 1.00 46.93 ? 441 CYS A N 1 ATOM 3527 C CA . CYS A 1 441 ? 13.617 -7.510 34.686 1.00 46.28 ? 441 CYS A CA 1 ATOM 3528 C C . CYS A 1 441 ? 13.430 -8.421 35.863 1.00 45.16 ? 441 CYS A C 1 ATOM 3529 O O . CYS A 1 441 ? 12.984 -9.535 35.713 1.00 44.48 ? 441 CYS A O 1 ATOM 3530 C CB . CYS A 1 441 ? 15.122 -7.352 34.450 1.00 47.34 ? 441 CYS A CB 1 ATOM 3531 S SG . CYS A 1 441 ? 15.620 -6.631 32.868 1.00 50.05 ? 441 CYS A SG 1 ATOM 3532 N N . ARG A 1 442 ? 13.787 -7.928 37.036 1.00 45.18 ? 442 ARG A N 1 ATOM 3533 C CA . ARG A 1 442 ? 13.718 -8.674 38.283 1.00 45.62 ? 442 ARG A CA 1 ATOM 3534 C C . ARG A 1 442 ? 12.294 -9.027 38.604 1.00 46.18 ? 442 ARG A C 1 ATOM 3535 O O . ARG A 1 442 ? 11.997 -10.158 38.897 1.00 46.59 ? 442 ARG A O 1 ATOM 3536 C CB . ARG A 1 442 ? 14.348 -7.840 39.371 1.00 45.66 ? 442 ARG A CB 1 ATOM 3537 C CG . ARG A 1 442 ? 15.836 -7.744 39.185 1.00 45.35 ? 442 ARG A CG 1 ATOM 3538 C CD . ARG A 1 442 ? 16.467 -6.710 40.035 1.00 47.87 ? 442 ARG A CD 1 ATOM 3539 N NE . ARG A 1 442 ? 17.791 -6.425 39.567 1.00 45.93 ? 442 ARG A NE 1 ATOM 3540 C CZ . ARG A 1 442 ? 18.607 -5.610 40.185 1.00 47.67 ? 442 ARG A CZ 1 ATOM 3541 N NH1 . ARG A 1 442 ? 18.211 -5.014 41.304 1.00 44.71 ? 442 ARG A NH1 1 ATOM 3542 N NH2 . ARG A 1 442 ? 19.830 -5.413 39.702 1.00 45.80 ? 442 ARG A NH2 1 ATOM 3543 N N . ASP A 1 443 ? 11.401 -8.058 38.423 1.00 47.78 ? 443 ASP A N 1 ATOM 3544 C CA . ASP A 1 443 ? 9.984 -8.250 38.639 1.00 47.59 ? 443 ASP A CA 1 ATOM 3545 C C . ASP A 1 443 ? 9.482 -9.460 37.847 1.00 48.13 ? 443 ASP A C 1 ATOM 3546 O O . ASP A 1 443 ? 8.677 -10.257 38.355 1.00 48.16 ? 443 ASP A O 1 ATOM 3547 C CB . ASP A 1 443 ? 9.229 -6.956 38.313 1.00 46.06 ? 443 ASP A CB 1 ATOM 3548 C CG . ASP A 1 443 ? 7.693 -7.134 38.343 1.00 48.55 ? 443 ASP A CG 1 ATOM 3549 O OD1 . ASP A 1 443 ? 7.169 -8.069 39.031 1.00 45.28 ? 443 ASP A OD1 1 ATOM 3550 O OD2 . ASP A 1 443 ? 6.925 -6.390 37.678 1.00 48.10 ? 443 ASP A OD2 1 ATOM 3551 N N . HIS A 1 444 ? 9.995 -9.625 36.624 1.00 47.65 ? 444 HIS A N 1 ATOM 3552 C CA . HIS A 1 444 ? 9.570 -10.717 35.749 1.00 46.78 ? 444 HIS A CA 1 ATOM 3553 C C . HIS A 1 444 ? 10.424 -11.984 35.820 1.00 45.54 ? 444 HIS A C 1 ATOM 3554 O O . HIS A 1 444 ? 10.445 -12.707 34.860 1.00 46.05 ? 444 HIS A O 1 ATOM 3555 C CB . HIS A 1 444 ? 9.615 -10.288 34.292 1.00 48.19 ? 444 HIS A CB 1 ATOM 3556 C CG . HIS A 1 444 ? 8.629 -9.237 33.930 1.00 47.69 ? 444 HIS A CG 1 ATOM 3557 N ND1 . HIS A 1 444 ? 7.882 -9.297 32.785 1.00 45.57 ? 444 HIS A ND1 1 ATOM 3558 C CD2 . HIS A 1 444 ? 8.324 -8.072 34.526 1.00 47.71 ? 444 HIS A CD2 1 ATOM 3559 C CE1 . HIS A 1 444 ? 7.141 -8.216 32.691 1.00 45.45 ? 444 HIS A CE1 1 ATOM 3560 N NE2 . HIS A 1 444 ? 7.403 -7.449 33.727 1.00 45.79 ? 444 HIS A NE2 1 ATOM 3561 N N . GLY A 1 445 ? 11.178 -12.150 36.901 1.00 45.06 ? 445 GLY A N 1 ATOM 3562 C CA . GLY A 1 445 ? 12.054 -13.282 37.084 1.00 44.45 ? 445 GLY A CA 1 ATOM 3563 C C . GLY A 1 445 ? 12.984 -13.553 35.921 1.00 44.22 ? 445 GLY A C 1 ATOM 3564 O O . GLY A 1 445 ? 13.228 -14.750 35.630 1.00 44.86 ? 445 GLY A O 1 ATOM 3565 N N . MET A 1 446 ? 13.513 -12.541 35.257 1.00 42.37 ? 446 MET A N 1 ATOM 3566 C CA . MET A 1 446 ? 14.397 -12.771 34.122 1.00 42.90 ? 446 MET A CA 1 ATOM 3567 C C . MET A 1 446 ? 15.642 -13.479 34.561 1.00 42.48 ? 446 MET A C 1 ATOM 3568 O O . MET A 1 446 ? 16.196 -13.251 35.633 1.00 42.86 ? 446 MET A O 1 ATOM 3569 C CB . MET A 1 446 ? 14.834 -11.439 33.446 1.00 42.59 ? 446 MET A CB 1 ATOM 3570 C CG . MET A 1 446 ? 13.940 -10.870 32.351 1.00 39.84 ? 446 MET A CG 1 ATOM 3571 S SD . MET A 1 446 ? 13.511 -12.109 31.171 1.00 47.95 ? 446 MET A SD 1 ATOM 3572 C CE . MET A 1 446 ? 11.968 -12.758 31.824 1.00 45.54 ? 446 MET A CE 1 ATOM 3573 N N . PRO A 1 447 ? 16.009 -14.441 33.750 1.00 42.97 ? 447 PRO A N 1 ATOM 3574 C CA . PRO A 1 447 ? 17.318 -15.088 33.859 1.00 43.37 ? 447 PRO A CA 1 ATOM 3575 C C . PRO A 1 447 ? 18.403 -14.028 33.616 1.00 43.99 ? 447 PRO A C 1 ATOM 3576 O O . PRO A 1 447 ? 18.174 -12.978 32.987 1.00 41.56 ? 447 PRO A O 1 ATOM 3577 C CB . PRO A 1 447 ? 17.311 -16.117 32.732 1.00 43.22 ? 447 PRO A CB 1 ATOM 3578 C CG . PRO A 1 447 ? 15.808 -16.375 32.447 1.00 43.04 ? 447 PRO A CG 1 ATOM 3579 C CD . PRO A 1 447 ? 15.130 -15.053 32.726 1.00 42.96 ? 447 PRO A CD 1 ATOM 3580 N N . GLY A 1 448 ? 19.594 -14.316 34.117 1.00 44.80 ? 448 GLY A N 1 ATOM 3581 C CA . GLY A 1 448 ? 20.683 -13.376 33.983 1.00 46.24 ? 448 GLY A CA 1 ATOM 3582 C C . GLY A 1 448 ? 21.357 -13.381 32.640 1.00 46.91 ? 448 GLY A C 1 ATOM 3583 O O . GLY A 1 448 ? 21.023 -14.194 31.810 1.00 46.42 ? 448 GLY A O 1 ATOM 3584 N N . TYR A 1 449 ? 22.362 -12.502 32.478 1.00 48.84 ? 449 TYR A N 1 ATOM 3585 C CA . TYR A 1 449 ? 23.067 -12.263 31.200 1.00 48.58 ? 449 TYR A CA 1 ATOM 3586 C C . TYR A 1 449 ? 23.699 -13.502 30.567 1.00 48.68 ? 449 TYR A C 1 ATOM 3587 O O . TYR A 1 449 ? 23.499 -13.776 29.376 1.00 49.80 ? 449 TYR A O 1 ATOM 3588 C CB . TYR A 1 449 ? 24.042 -11.061 31.354 1.00 49.13 ? 449 TYR A CB 1 ATOM 3589 C CG . TYR A 1 449 ? 24.969 -10.785 30.183 1.00 48.71 ? 449 TYR A CG 1 ATOM 3590 C CD1 . TYR A 1 449 ? 24.487 -10.234 29.001 1.00 50.05 ? 449 TYR A CD1 1 ATOM 3591 C CD2 . TYR A 1 449 ? 26.318 -11.081 30.259 1.00 49.88 ? 449 TYR A CD2 1 ATOM 3592 C CE1 . TYR A 1 449 ? 25.301 -9.989 27.930 1.00 49.57 ? 449 TYR A CE1 1 ATOM 3593 C CE2 . TYR A 1 449 ? 27.160 -10.834 29.175 1.00 51.31 ? 449 TYR A CE2 1 ATOM 3594 C CZ . TYR A 1 449 ? 26.633 -10.291 28.013 1.00 51.08 ? 449 TYR A CZ 1 ATOM 3595 O OH . TYR A 1 449 ? 27.423 -10.063 26.919 1.00 47.91 ? 449 TYR A OH 1 ATOM 3596 N N . ASN A 1 450 ? 24.424 -14.291 31.330 1.00 49.06 ? 450 ASN A N 1 ATOM 3597 C CA . ASN A 1 450 ? 25.031 -15.507 30.762 1.00 49.30 ? 450 ASN A CA 1 ATOM 3598 C C . ASN A 1 450 ? 24.010 -16.595 30.298 1.00 48.27 ? 450 ASN A C 1 ATOM 3599 O O . ASN A 1 450 ? 24.174 -17.268 29.234 1.00 47.22 ? 450 ASN A O 1 ATOM 3600 C CB . ASN A 1 450 ? 26.082 -16.091 31.722 1.00 49.80 ? 450 ASN A CB 1 ATOM 3601 C CG . ASN A 1 450 ? 27.474 -15.330 31.665 1.00 50.68 ? 450 ASN A CG 1 ATOM 3602 O OD1 . ASN A 1 450 ? 27.820 -14.697 30.662 1.00 49.59 ? 450 ASN A OD1 1 ATOM 3603 N ND2 . ASN A 1 450 ? 28.224 -15.382 32.765 1.00 46.66 ? 450 ASN A ND2 1 ATOM 3604 N N . SER A 1 451 ? 22.952 -16.747 31.091 1.00 47.66 ? 451 SER A N 1 ATOM 3605 C CA . SER A 1 451 ? 21.869 -17.711 30.797 1.00 45.26 ? 451 SER A CA 1 ATOM 3606 C C . SER A 1 451 ? 21.433 -17.392 29.414 1.00 45.07 ? 451 SER A C 1 ATOM 3607 O O . SER A 1 451 ? 21.308 -18.307 28.548 1.00 46.85 ? 451 SER A O 1 ATOM 3608 C CB . SER A 1 451 ? 20.711 -17.612 31.796 1.00 44.85 ? 451 SER A CB 1 ATOM 3609 O OG . SER A 1 451 ? 21.095 -17.950 33.140 1.00 42.01 ? 451 SER A OG 1 ATOM 3610 N N . TRP A 1 452 ? 21.263 -16.105 29.152 1.00 44.05 ? 452 TRP A N 1 ATOM 3611 C CA . TRP A 1 452 ? 20.893 -15.670 27.799 1.00 43.80 ? 452 TRP A CA 1 ATOM 3612 C C . TRP A 1 452 ? 22.067 -15.807 26.821 1.00 43.95 ? 452 TRP A C 1 ATOM 3613 O O . TRP A 1 452 ? 21.843 -16.071 25.665 1.00 44.97 ? 452 TRP A O 1 ATOM 3614 C CB . TRP A 1 452 ? 20.249 -14.270 27.769 1.00 43.18 ? 452 TRP A CB 1 ATOM 3615 C CG . TRP A 1 452 ? 18.942 -14.231 28.570 1.00 45.19 ? 452 TRP A CG 1 ATOM 3616 C CD1 . TRP A 1 452 ? 18.753 -13.680 29.822 1.00 42.24 ? 452 TRP A CD1 1 ATOM 3617 C CD2 . TRP A 1 452 ? 17.695 -14.849 28.212 1.00 41.71 ? 452 TRP A CD2 1 ATOM 3618 N NE1 . TRP A 1 452 ? 17.462 -13.905 30.233 1.00 46.30 ? 452 TRP A NE1 1 ATOM 3619 C CE2 . TRP A 1 452 ? 16.798 -14.630 29.271 1.00 43.70 ? 452 TRP A CE2 1 ATOM 3620 C CE3 . TRP A 1 452 ? 17.264 -15.601 27.116 1.00 42.61 ? 452 TRP A CE3 1 ATOM 3621 C CZ2 . TRP A 1 452 ? 15.461 -15.103 29.250 1.00 48.50 ? 452 TRP A CZ2 1 ATOM 3622 C CZ3 . TRP A 1 452 ? 15.920 -16.052 27.068 1.00 44.80 ? 452 TRP A CZ3 1 ATOM 3623 C CH2 . TRP A 1 452 ? 15.037 -15.800 28.133 1.00 46.75 ? 452 TRP A CH2 1 ATOM 3624 N N . ARG A 1 453 ? 23.315 -15.621 27.269 1.00 44.50 ? 453 ARG A N 1 ATOM 3625 C CA . ARG A 1 453 ? 24.467 -15.830 26.386 1.00 43.97 ? 453 ARG A CA 1 ATOM 3626 C C . ARG A 1 453 ? 24.487 -17.288 25.922 1.00 44.09 ? 453 ARG A C 1 ATOM 3627 O O . ARG A 1 453 ? 24.570 -17.569 24.729 1.00 43.50 ? 453 ARG A O 1 ATOM 3628 C CB . ARG A 1 453 ? 25.796 -15.488 27.083 1.00 43.26 ? 453 ARG A CB 1 ATOM 3629 C CG . ARG A 1 453 ? 26.067 -13.970 27.263 1.00 46.39 ? 453 ARG A CG 1 ATOM 3630 C CD . ARG A 1 453 ? 26.458 -13.218 25.989 1.00 44.58 ? 453 ARG A CD 1 ATOM 3631 N NE . ARG A 1 453 ? 27.797 -13.601 25.533 1.00 45.61 ? 453 ARG A NE 1 ATOM 3632 C CZ . ARG A 1 453 ? 28.430 -13.053 24.467 1.00 44.97 ? 453 ARG A CZ 1 ATOM 3633 N NH1 . ARG A 1 453 ? 27.909 -12.076 23.758 1.00 40.37 ? 453 ARG A NH1 1 ATOM 3634 N NH2 . ARG A 1 453 ? 29.604 -13.494 24.112 1.00 48.46 ? 453 ARG A NH2 1 ATOM 3635 N N . GLY A 1 454 ? 24.375 -18.205 26.879 1.00 44.13 ? 454 GLY A N 1 ATOM 3636 C CA . GLY A 1 454 ? 24.356 -19.608 26.562 1.00 46.03 ? 454 GLY A CA 1 ATOM 3637 C C . GLY A 1 454 ? 23.222 -19.937 25.632 1.00 47.62 ? 454 GLY A C 1 ATOM 3638 O O . GLY A 1 454 ? 23.410 -20.616 24.611 1.00 48.87 ? 454 GLY A O 1 ATOM 3639 N N . PHE A 1 455 ? 22.050 -19.386 25.939 1.00 48.48 ? 455 PHE A N 1 ATOM 3640 C CA . PHE A 1 455 ? 20.851 -19.651 25.176 1.00 47.88 ? 455 PHE A CA 1 ATOM 3641 C C . PHE A 1 455 ? 21.040 -19.251 23.745 1.00 48.42 ? 455 PHE A C 1 ATOM 3642 O O . PHE A 1 455 ? 20.507 -19.868 22.830 1.00 48.13 ? 455 PHE A O 1 ATOM 3643 C CB . PHE A 1 455 ? 19.716 -18.856 25.798 1.00 47.89 ? 455 PHE A CB 1 ATOM 3644 C CG . PHE A 1 455 ? 18.417 -18.998 25.079 1.00 46.05 ? 455 PHE A CG 1 ATOM 3645 C CD1 . PHE A 1 455 ? 17.573 -20.030 25.375 1.00 45.64 ? 455 PHE A CD1 1 ATOM 3646 C CD2 . PHE A 1 455 ? 18.038 -18.066 24.129 1.00 44.35 ? 455 PHE A CD2 1 ATOM 3647 C CE1 . PHE A 1 455 ? 16.333 -20.126 24.727 1.00 50.33 ? 455 PHE A CE1 1 ATOM 3648 C CE2 . PHE A 1 455 ? 16.855 -18.157 23.489 1.00 45.05 ? 455 PHE A CE2 1 ATOM 3649 C CZ . PHE A 1 455 ? 15.994 -19.199 23.777 1.00 49.00 ? 455 PHE A CZ 1 ATOM 3650 N N . CYS A 1 456 ? 21.805 -18.197 23.543 1.00 49.17 ? 456 CYS A N 1 ATOM 3651 C CA . CYS A 1 456 ? 22.072 -17.728 22.180 1.00 50.02 ? 456 CYS A CA 1 ATOM 3652 C C . CYS A 1 456 ? 23.343 -18.354 21.567 1.00 50.98 ? 456 CYS A C 1 ATOM 3653 O O . CYS A 1 456 ? 23.853 -17.894 20.530 1.00 52.06 ? 456 CYS A O 1 ATOM 3654 C CB . CYS A 1 456 ? 22.113 -16.184 22.174 1.00 49.72 ? 456 CYS A CB 1 ATOM 3655 S SG . CYS A 1 456 ? 20.465 -15.476 21.993 1.00 49.65 ? 456 CYS A SG 1 ATOM 3656 N N . GLY A 1 457 ? 23.895 -19.381 22.215 1.00 51.09 ? 457 GLY A N 1 ATOM 3657 C CA . GLY A 1 457 ? 25.024 -20.068 21.617 1.00 51.79 ? 457 GLY A CA 1 ATOM 3658 C C . GLY A 1 457 ? 26.276 -19.203 21.523 1.00 52.29 ? 457 GLY A C 1 ATOM 3659 O O . GLY A 1 457 ? 27.198 -19.482 20.740 1.00 51.04 ? 457 GLY A O 1 ATOM 3660 N N . LEU A 1 458 ? 26.300 -18.163 22.348 1.00 51.99 ? 458 LEU A N 1 ATOM 3661 C CA . LEU A 1 458 ? 27.444 -17.284 22.443 1.00 52.88 ? 458 LEU A CA 1 ATOM 3662 C C . LEU A 1 458 ? 28.080 -17.647 23.733 1.00 53.41 ? 458 LEU A C 1 ATOM 3663 O O . LEU A 1 458 ? 27.459 -18.330 24.511 1.00 55.17 ? 458 LEU A O 1 ATOM 3664 C CB . LEU A 1 458 ? 27.011 -15.821 22.506 1.00 52.75 ? 458 LEU A CB 1 ATOM 3665 C CG . LEU A 1 458 ? 26.314 -15.362 21.241 1.00 52.54 ? 458 LEU A CG 1 ATOM 3666 C CD1 . LEU A 1 458 ? 25.445 -14.114 21.432 1.00 52.64 ? 458 LEU A CD1 1 ATOM 3667 C CD2 . LEU A 1 458 ? 27.368 -15.140 20.259 1.00 49.43 ? 458 LEU A CD2 1 ATOM 3668 N N . SER A 1 459 ? 29.304 -17.169 23.962 1.00 53.91 ? 459 SER A N 1 ATOM 3669 C CA . SER A 1 459 ? 30.106 -17.424 25.159 1.00 54.10 ? 459 SER A CA 1 ATOM 3670 C C . SER A 1 459 ? 29.616 -16.703 26.380 1.00 53.32 ? 459 SER A C 1 ATOM 3671 O O . SER A 1 459 ? 28.932 -15.686 26.280 1.00 53.80 ? 459 SER A O 1 ATOM 3672 C CB . SER A 1 459 ? 31.541 -16.927 24.900 1.00 54.85 ? 459 SER A CB 1 ATOM 3673 O OG . SER A 1 459 ? 31.469 -15.586 24.422 1.00 56.35 ? 459 SER A OG 1 ATOM 3674 N N . GLN A 1 460 ? 30.068 -17.174 27.536 1.00 53.15 ? 460 GLN A N 1 ATOM 3675 C CA . GLN A 1 460 ? 29.622 -16.678 28.805 1.00 52.30 ? 460 GLN A CA 1 ATOM 3676 C C . GLN A 1 460 ? 30.782 -16.257 29.637 1.00 53.79 ? 460 GLN A C 1 ATOM 3677 O O . GLN A 1 460 ? 31.277 -17.058 30.406 1.00 54.04 ? 460 GLN A O 1 ATOM 3678 C CB . GLN A 1 460 ? 28.934 -17.817 29.559 1.00 53.12 ? 460 GLN A CB 1 ATOM 3679 C CG . GLN A 1 460 ? 27.540 -18.243 29.017 1.00 51.14 ? 460 GLN A CG 1 ATOM 3680 C CD . GLN A 1 460 ? 27.017 -19.544 29.683 1.00 53.04 ? 460 GLN A CD 1 ATOM 3681 O OE1 . GLN A 1 460 ? 26.761 -19.586 30.928 1.00 52.24 ? 460 GLN A OE1 1 ATOM 3682 N NE2 . GLN A 1 460 ? 26.877 -20.598 28.871 1.00 47.59 ? 460 GLN A NE2 1 ATOM 3683 N N . PRO A 1 461 ? 31.145 -14.976 29.598 1.00 54.64 ? 461 PRO A N 1 ATOM 3684 C CA . PRO A 1 461 ? 32.324 -14.510 30.310 1.00 55.56 ? 461 PRO A CA 1 ATOM 3685 C C . PRO A 1 461 ? 32.052 -14.686 31.797 1.00 55.86 ? 461 PRO A C 1 ATOM 3686 O O . PRO A 1 461 ? 30.919 -14.583 32.289 1.00 54.08 ? 461 PRO A O 1 ATOM 3687 C CB . PRO A 1 461 ? 32.387 -13.011 29.985 1.00 56.63 ? 461 PRO A CB 1 ATOM 3688 C CG . PRO A 1 461 ? 31.369 -12.788 28.937 1.00 55.80 ? 461 PRO A CG 1 ATOM 3689 C CD . PRO A 1 461 ? 30.369 -13.867 29.036 1.00 54.54 ? 461 PRO A CD 1 ATOM 3690 N N . LYS A 1 462 ? 33.134 -14.980 32.492 1.00 54.96 ? 462 LYS A N 1 ATOM 3691 C CA . LYS A 1 462 ? 33.088 -15.166 33.896 1.00 56.25 ? 462 LYS A CA 1 ATOM 3692 C C . LYS A 1 462 ? 33.990 -14.205 34.619 1.00 55.71 ? 462 LYS A C 1 ATOM 3693 O O . LYS A 1 462 ? 33.734 -13.899 35.758 1.00 54.75 ? 462 LYS A O 1 ATOM 3694 C CB . LYS A 1 462 ? 33.589 -16.555 34.219 1.00 56.74 ? 462 LYS A CB 1 ATOM 3695 C CG . LYS A 1 462 ? 32.705 -17.652 33.708 1.00 60.14 ? 462 LYS A CG 1 ATOM 3696 C CD . LYS A 1 462 ? 31.272 -17.377 34.097 1.00 64.07 ? 462 LYS A CD 1 ATOM 3697 C CE . LYS A 1 462 ? 30.408 -18.548 33.663 1.00 68.40 ? 462 LYS A CE 1 ATOM 3698 N NZ . LYS A 1 462 ? 29.329 -18.810 34.661 1.00 69.68 ? 462 LYS A NZ 1 ATOM 3699 N N . THR A 1 463 ? 35.077 -13.741 34.009 1.00 55.55 ? 463 THR A N 1 ATOM 3700 C CA . THR A 1 463 ? 35.957 -12.823 34.724 1.00 55.09 ? 463 THR A CA 1 ATOM 3701 C C . THR A 1 463 ? 35.791 -11.462 34.219 1.00 55.19 ? 463 THR A C 1 ATOM 3702 O O . THR A 1 463 ? 35.282 -11.259 33.139 1.00 53.76 ? 463 THR A O 1 ATOM 3703 C CB . THR A 1 463 ? 37.414 -13.143 34.434 1.00 55.19 ? 463 THR A CB 1 ATOM 3704 O OG1 . THR A 1 463 ? 37.596 -13.215 33.008 1.00 52.10 ? 463 THR A OG1 1 ATOM 3705 C CG2 . THR A 1 463 ? 37.777 -14.510 34.954 1.00 55.26 ? 463 THR A CG2 1 ATOM 3706 N N . LEU A 1 464 ? 36.303 -10.535 35.006 1.00 56.99 ? 464 LEU A N 1 ATOM 3707 C CA . LEU A 1 464 ? 36.409 -9.160 34.633 1.00 58.05 ? 464 LEU A CA 1 ATOM 3708 C C . LEU A 1 464 ? 37.016 -9.172 33.223 1.00 58.84 ? 464 LEU A C 1 ATOM 3709 O O . LEU A 1 464 ? 36.385 -8.740 32.262 1.00 60.08 ? 464 LEU A O 1 ATOM 3710 C CB . LEU A 1 464 ? 37.333 -8.520 35.648 1.00 58.91 ? 464 LEU A CB 1 ATOM 3711 C CG . LEU A 1 464 ? 37.123 -6.998 35.711 1.00 60.91 ? 464 LEU A CG 1 ATOM 3712 C CD1 . LEU A 1 464 ? 38.325 -6.319 36.304 1.00 59.92 ? 464 LEU A CD1 1 ATOM 3713 C CD2 . LEU A 1 464 ? 36.866 -6.550 34.297 1.00 57.99 ? 464 LEU A CD2 1 ATOM 3714 N N . LYS A 1 465 ? 38.206 -9.740 33.081 1.00 58.77 ? 465 LYS A N 1 ATOM 3715 C CA . LYS A 1 465 ? 38.870 -9.810 31.781 1.00 59.26 ? 465 LYS A CA 1 ATOM 3716 C C . LYS A 1 465 ? 37.999 -10.480 30.739 1.00 57.60 ? 465 LYS A C 1 ATOM 3717 O O . LYS A 1 465 ? 38.050 -10.155 29.568 1.00 57.52 ? 465 LYS A O 1 ATOM 3718 C CB . LYS A 1 465 ? 40.178 -10.625 31.906 1.00 59.54 ? 465 LYS A CB 1 ATOM 3719 C CG . LYS A 1 465 ? 41.413 -9.964 31.344 1.00 63.92 ? 465 LYS A CG 1 ATOM 3720 C CD . LYS A 1 465 ? 41.429 -9.865 29.819 1.00 69.19 ? 465 LYS A CD 1 ATOM 3721 C CE . LYS A 1 465 ? 42.582 -8.971 29.362 1.00 70.92 ? 465 LYS A CE 1 ATOM 3722 N NZ . LYS A 1 465 ? 42.202 -8.156 28.163 1.00 73.03 ? 465 LYS A NZ 1 ATOM 3723 N N . GLY A 1 466 ? 37.263 -11.495 31.141 1.00 57.89 ? 466 GLY A N 1 ATOM 3724 C CA . GLY A 1 466 ? 36.399 -12.161 30.181 1.00 57.48 ? 466 GLY A CA 1 ATOM 3725 C C . GLY A 1 466 ? 35.369 -11.175 29.668 1.00 56.47 ? 466 GLY A C 1 ATOM 3726 O O . GLY A 1 466 ? 35.141 -11.064 28.470 1.00 57.17 ? 466 GLY A O 1 ATOM 3727 N N . LEU A 1 467 ? 34.766 -10.431 30.572 1.00 56.08 ? 467 LEU A N 1 ATOM 3728 C CA . LEU A 1 467 ? 33.744 -9.484 30.171 1.00 57.09 ? 467 LEU A CA 1 ATOM 3729 C C . LEU A 1 467 ? 34.345 -8.366 29.345 1.00 57.49 ? 467 LEU A C 1 ATOM 3730 O O . LEU A 1 467 ? 33.692 -7.850 28.424 1.00 58.14 ? 467 LEU A O 1 ATOM 3731 C CB . LEU A 1 467 ? 33.017 -8.906 31.377 1.00 56.94 ? 467 LEU A CB 1 ATOM 3732 C CG . LEU A 1 467 ? 31.707 -8.137 31.132 1.00 56.86 ? 467 LEU A CG 1 ATOM 3733 C CD1 . LEU A 1 467 ? 30.585 -8.981 30.481 1.00 54.05 ? 467 LEU A CD1 1 ATOM 3734 C CD2 . LEU A 1 467 ? 31.233 -7.643 32.457 1.00 52.75 ? 467 LEU A CD2 1 ATOM 3735 N N . GLN A 1 468 ? 35.576 -7.977 29.674 1.00 57.34 ? 468 GLN A N 1 ATOM 3736 C CA . GLN A 1 468 ? 36.212 -6.901 28.933 1.00 57.45 ? 468 GLN A CA 1 ATOM 3737 C C . GLN A 1 468 ? 36.251 -7.293 27.472 1.00 56.78 ? 468 GLN A C 1 ATOM 3738 O O . GLN A 1 468 ? 35.767 -6.560 26.608 1.00 58.28 ? 468 GLN A O 1 ATOM 3739 C CB . GLN A 1 468 ? 37.607 -6.592 29.469 1.00 57.70 ? 468 GLN A CB 1 ATOM 3740 C CG . GLN A 1 468 ? 37.639 -6.231 30.943 1.00 60.37 ? 468 GLN A CG 1 ATOM 3741 C CD . GLN A 1 468 ? 38.935 -5.547 31.343 1.00 65.54 ? 468 GLN A CD 1 ATOM 3742 O OE1 . GLN A 1 468 ? 38.962 -4.778 32.306 1.00 68.94 ? 468 GLN A OE1 1 ATOM 3743 N NE2 . GLN A 1 468 ? 40.000 -5.795 30.588 1.00 66.51 ? 468 GLN A NE2 1 ATOM 3744 N N . THR A 1 469 ? 36.797 -8.459 27.177 1.00 55.56 ? 469 THR A N 1 ATOM 3745 C CA . THR A 1 469 ? 36.828 -8.920 25.789 1.00 54.96 ? 469 THR A CA 1 ATOM 3746 C C . THR A 1 469 ? 35.462 -8.889 25.115 1.00 53.84 ? 469 THR A C 1 ATOM 3747 O O . THR A 1 469 ? 35.324 -8.381 24.020 1.00 54.15 ? 469 THR A O 1 ATOM 3748 C CB . THR A 1 469 ? 37.358 -10.331 25.766 1.00 55.45 ? 469 THR A CB 1 ATOM 3749 O OG1 . THR A 1 469 ? 38.649 -10.318 26.361 1.00 55.30 ? 469 THR A OG1 1 ATOM 3750 C CG2 . THR A 1 469 ? 37.596 -10.815 24.322 1.00 57.34 ? 469 THR A CG2 1 ATOM 3751 N N . VAL A 1 470 ? 34.451 -9.456 25.757 1.00 52.92 ? 470 VAL A N 1 ATOM 3752 C CA . VAL A 1 470 ? 33.086 -9.447 25.170 1.00 51.62 ? 470 VAL A CA 1 ATOM 3753 C C . VAL A 1 470 ? 32.505 -8.019 24.940 1.00 50.32 ? 470 VAL A C 1 ATOM 3754 O O . VAL A 1 470 ? 32.051 -7.733 23.840 1.00 50.97 ? 470 VAL A O 1 ATOM 3755 C CB . VAL A 1 470 ? 32.106 -10.391 25.968 1.00 51.98 ? 470 VAL A CB 1 ATOM 3756 C CG1 . VAL A 1 470 ? 30.656 -10.201 25.563 1.00 51.26 ? 470 VAL A CG1 1 ATOM 3757 C CG2 . VAL A 1 470 ? 32.517 -11.846 25.739 1.00 52.76 ? 470 VAL A CG2 1 ATOM 3758 N N . LEU A 1 471 ? 32.539 -7.132 25.935 1.00 47.54 ? 471 LEU A N 1 ATOM 3759 C CA . LEU A 1 471 ? 32.054 -5.773 25.751 1.00 46.44 ? 471 LEU A CA 1 ATOM 3760 C C . LEU A 1 471 ? 33.013 -4.945 24.876 1.00 47.74 ? 471 LEU A C 1 ATOM 3761 O O . LEU A 1 471 ? 32.650 -3.904 24.301 1.00 45.64 ? 471 LEU A O 1 ATOM 3762 C CB . LEU A 1 471 ? 31.889 -5.084 27.111 1.00 45.57 ? 471 LEU A CB 1 ATOM 3763 C CG . LEU A 1 471 ? 30.530 -5.415 27.837 1.00 44.90 ? 471 LEU A CG 1 ATOM 3764 C CD1 . LEU A 1 471 ? 29.929 -6.704 27.325 1.00 40.88 ? 471 LEU A CD1 1 ATOM 3765 C CD2 . LEU A 1 471 ? 30.672 -5.485 29.335 1.00 39.54 ? 471 LEU A CD2 1 ATOM 3766 N N . LYS A 1 472 ? 34.253 -5.433 24.766 1.00 48.88 ? 472 LYS A N 1 ATOM 3767 C CA . LYS A 1 472 ? 35.270 -4.702 24.078 1.00 49.34 ? 472 LYS A CA 1 ATOM 3768 C C . LYS A 1 472 ? 35.329 -3.351 24.751 1.00 49.40 ? 472 LYS A C 1 ATOM 3769 O O . LYS A 1 472 ? 35.409 -2.315 24.104 1.00 48.21 ? 472 LYS A O 1 ATOM 3770 C CB . LYS A 1 472 ? 34.920 -4.542 22.623 1.00 49.70 ? 472 LYS A CB 1 ATOM 3771 C CG . LYS A 1 472 ? 35.157 -5.743 21.751 1.00 51.91 ? 472 LYS A CG 1 ATOM 3772 C CD . LYS A 1 472 ? 34.810 -5.373 20.265 1.00 52.78 ? 472 LYS A CD 1 ATOM 3773 C CE . LYS A 1 472 ? 35.194 -6.527 19.325 1.00 56.97 ? 472 LYS A CE 1 ATOM 3774 N NZ . LYS A 1 472 ? 35.456 -6.129 17.870 1.00 59.67 ? 472 LYS A NZ 1 ATOM 3775 N N . ASN A 1 473 ? 35.262 -3.356 26.075 1.00 49.95 ? 473 ASN A N 1 ATOM 3776 C CA . ASN A 1 473 ? 35.343 -2.095 26.793 1.00 50.92 ? 473 ASN A CA 1 ATOM 3777 C C . ASN A 1 473 ? 35.748 -2.380 28.174 1.00 52.05 ? 473 ASN A C 1 ATOM 3778 O O . ASN A 1 473 ? 34.936 -2.896 28.941 1.00 53.99 ? 473 ASN A O 1 ATOM 3779 C CB . ASN A 1 473 ? 33.998 -1.350 26.842 1.00 50.86 ? 473 ASN A CB 1 ATOM 3780 C CG . ASN A 1 473 ? 34.103 0.069 27.503 1.00 48.18 ? 473 ASN A CG 1 ATOM 3781 O OD1 . ASN A 1 473 ? 34.699 0.260 28.538 1.00 48.56 ? 473 ASN A OD1 1 ATOM 3782 N ND2 . ASN A 1 473 ? 33.491 1.026 26.886 1.00 47.31 ? 473 ASN A ND2 1 ATOM 3783 N N . LYS A 1 474 ? 36.966 -1.988 28.517 1.00 52.58 ? 474 LYS A N 1 ATOM 3784 C CA . LYS A 1 474 ? 37.504 -2.216 29.832 1.00 53.82 ? 474 LYS A CA 1 ATOM 3785 C C . LYS A 1 474 ? 36.694 -1.532 30.857 1.00 54.12 ? 474 LYS A C 1 ATOM 3786 O O . LYS A 1 474 ? 36.244 -2.157 31.785 1.00 55.88 ? 474 LYS A O 1 ATOM 3787 C CB . LYS A 1 474 ? 38.959 -1.723 29.969 1.00 54.17 ? 474 LYS A CB 1 ATOM 3788 C CG . LYS A 1 474 ? 39.976 -2.697 29.391 1.00 57.78 ? 474 LYS A CG 1 ATOM 3789 C CD . LYS A 1 474 ? 41.391 -2.560 30.024 1.00 62.27 ? 474 LYS A CD 1 ATOM 3790 C CE . LYS A 1 474 ? 42.467 -3.303 29.189 1.00 62.22 ? 474 LYS A CE 1 ATOM 3791 N NZ . LYS A 1 474 ? 43.758 -3.492 29.949 1.00 64.72 ? 474 LYS A NZ 1 ATOM 3792 N N . ILE A 1 475 ? 36.505 -0.234 30.713 1.00 54.44 ? 475 ILE A N 1 ATOM 3793 C CA . ILE A 1 475 ? 35.847 0.515 31.781 1.00 54.28 ? 475 ILE A CA 1 ATOM 3794 C C . ILE A 1 475 ? 34.410 0.065 32.077 1.00 53.35 ? 475 ILE A C 1 ATOM 3795 O O . ILE A 1 475 ? 34.063 -0.205 33.218 1.00 53.07 ? 475 ILE A O 1 ATOM 3796 C CB . ILE A 1 475 ? 35.938 2.019 31.502 1.00 54.76 ? 475 ILE A CB 1 ATOM 3797 C CG1 . ILE A 1 475 ? 37.411 2.394 31.318 1.00 56.55 ? 475 ILE A CG1 1 ATOM 3798 C CG2 . ILE A 1 475 ? 35.308 2.823 32.639 1.00 54.31 ? 475 ILE A CG2 1 ATOM 3799 C CD1 . ILE A 1 475 ? 37.778 3.874 31.659 1.00 58.14 ? 475 ILE A CD1 1 ATOM 3800 N N . LEU A 1 476 ? 33.590 -0.031 31.048 1.00 52.44 ? 476 LEU A N 1 ATOM 3801 C CA . LEU A 1 476 ? 32.214 -0.460 31.240 1.00 52.29 ? 476 LEU A CA 1 ATOM 3802 C C . LEU A 1 476 ? 32.272 -1.831 31.939 1.00 52.77 ? 476 LEU A C 1 ATOM 3803 O O . LEU A 1 476 ? 31.494 -2.132 32.869 1.00 52.85 ? 476 LEU A O 1 ATOM 3804 C CB . LEU A 1 476 ? 31.472 -0.512 29.903 1.00 50.60 ? 476 LEU A CB 1 ATOM 3805 C CG . LEU A 1 476 ? 30.074 -1.131 30.019 1.00 51.45 ? 476 LEU A CG 1 ATOM 3806 C CD1 . LEU A 1 476 ? 29.187 -0.302 30.925 1.00 44.64 ? 476 LEU A CD1 1 ATOM 3807 C CD2 . LEU A 1 476 ? 29.450 -1.271 28.642 1.00 50.43 ? 476 LEU A CD2 1 ATOM 3808 N N . ALA A 1 477 ? 33.253 -2.641 31.552 1.00 52.93 ? 477 ALA A N 1 ATOM 3809 C CA . ALA A 1 477 ? 33.357 -3.954 32.178 1.00 52.91 ? 477 ALA A CA 1 ATOM 3810 C C . ALA A 1 477 ? 33.778 -3.911 33.654 1.00 53.01 ? 477 ALA A C 1 ATOM 3811 O O . ALA A 1 477 ? 33.400 -4.798 34.410 1.00 53.73 ? 477 ALA A O 1 ATOM 3812 C CB . ALA A 1 477 ? 34.184 -4.917 31.338 1.00 51.68 ? 477 ALA A CB 1 ATOM 3813 N N . LYS A 1 478 ? 34.494 -2.868 34.099 1.00 53.18 ? 478 LYS A N 1 ATOM 3814 C CA . LYS A 1 478 ? 34.852 -2.782 35.525 1.00 54.12 ? 478 LYS A CA 1 ATOM 3815 C C . LYS A 1 478 ? 33.602 -2.371 36.287 1.00 53.20 ? 478 LYS A C 1 ATOM 3816 O O . LYS A 1 478 ? 33.225 -2.955 37.293 1.00 53.75 ? 478 LYS A O 1 ATOM 3817 C CB . LYS A 1 478 ? 35.886 -1.664 35.780 1.00 54.96 ? 478 LYS A CB 1 ATOM 3818 C CG . LYS A 1 478 ? 37.250 -1.876 35.163 1.00 57.62 ? 478 LYS A CG 1 ATOM 3819 C CD . LYS A 1 478 ? 38.136 -0.651 35.374 1.00 59.00 ? 478 LYS A CD 1 ATOM 3820 C CE . LYS A 1 478 ? 39.363 -0.690 34.474 1.00 52.87 ? 478 LYS A CE 1 ATOM 3821 N NZ . LYS A 1 478 ? 40.048 -2.023 34.551 1.00 54.33 ? 478 LYS A NZ 1 ATOM 3822 N N . LYS A 1 479 ? 33.021 -1.259 35.846 1.00 54.04 ? 479 LYS A N 1 ATOM 3823 C CA . LYS A 1 479 ? 31.775 -0.771 36.423 1.00 54.56 ? 479 LYS A CA 1 ATOM 3824 C C . LYS A 1 479 ? 30.860 -1.979 36.619 1.00 53.81 ? 479 LYS A C 1 ATOM 3825 O O . LYS A 1 479 ? 30.548 -2.385 37.727 1.00 52.19 ? 479 LYS A O 1 ATOM 3826 C CB . LYS A 1 479 ? 31.109 0.217 35.475 1.00 54.82 ? 479 LYS A CB 1 ATOM 3827 C CG . LYS A 1 479 ? 31.998 1.386 35.098 1.00 55.90 ? 479 LYS A CG 1 ATOM 3828 C CD . LYS A 1 479 ? 31.233 2.459 34.326 1.00 56.80 ? 479 LYS A CD 1 ATOM 3829 C CE . LYS A 1 479 ? 32.109 3.660 34.035 1.00 56.18 ? 479 LYS A CE 1 ATOM 3830 N NZ . LYS A 1 479 ? 31.513 4.561 32.982 1.00 58.10 ? 479 LYS A NZ 1 ATOM 3831 N N . LEU A 1 480 ? 30.461 -2.542 35.499 1.00 54.79 ? 480 LEU A N 1 ATOM 3832 C CA . LEU A 1 480 ? 29.634 -3.743 35.477 1.00 55.86 ? 480 LEU A CA 1 ATOM 3833 C C . LEU A 1 480 ? 29.992 -4.741 36.564 1.00 55.75 ? 480 LEU A C 1 ATOM 3834 O O . LEU A 1 480 ? 29.118 -5.176 37.328 1.00 54.51 ? 480 LEU A O 1 ATOM 3835 C CB . LEU A 1 480 ? 29.719 -4.356 34.091 1.00 55.91 ? 480 LEU A CB 1 ATOM 3836 C CG . LEU A 1 480 ? 28.317 -4.474 33.520 1.00 57.70 ? 480 LEU A CG 1 ATOM 3837 C CD1 . LEU A 1 480 ? 27.407 -3.407 34.076 1.00 55.98 ? 480 LEU A CD1 1 ATOM 3838 C CD2 . LEU A 1 480 ? 28.302 -4.494 31.965 1.00 56.44 ? 480 LEU A CD2 1 ATOM 3839 N N . MET A 1 481 ? 31.286 -5.018 36.694 1.00 56.42 ? 481 MET A N 1 ATOM 3840 C CA . MET A 1 481 ? 31.735 -6.085 37.587 1.00 56.98 ? 481 MET A CA 1 ATOM 3841 C C . MET A 1 481 ? 31.741 -5.729 39.046 1.00 57.73 ? 481 MET A C 1 ATOM 3842 O O . MET A 1 481 ? 31.636 -6.611 39.925 1.00 58.23 ? 481 MET A O 1 ATOM 3843 C CB . MET A 1 481 ? 33.106 -6.601 37.170 1.00 56.60 ? 481 MET A CB 1 ATOM 3844 C CG . MET A 1 481 ? 33.042 -7.636 36.040 1.00 58.68 ? 481 MET A CG 1 ATOM 3845 S SD . MET A 1 481 ? 32.488 -9.362 36.534 1.00 59.71 ? 481 MET A SD 1 ATOM 3846 C CE . MET A 1 481 ? 33.573 -9.587 37.977 1.00 63.96 ? 481 MET A CE 1 ATOM 3847 N N . ASP A 1 482 ? 31.894 -4.431 39.309 1.00 58.49 ? 482 ASP A N 1 ATOM 3848 C CA . ASP A 1 482 ? 31.919 -3.907 40.661 1.00 57.88 ? 482 ASP A CA 1 ATOM 3849 C C . ASP A 1 482 ? 30.501 -3.779 41.154 1.00 57.74 ? 482 ASP A C 1 ATOM 3850 O O . ASP A 1 482 ? 30.249 -3.671 42.351 1.00 57.76 ? 482 ASP A O 1 ATOM 3851 C CB . ASP A 1 482 ? 32.550 -2.524 40.643 1.00 59.75 ? 482 ASP A CB 1 ATOM 3852 C CG . ASP A 1 482 ? 34.048 -2.553 40.929 1.00 60.68 ? 482 ASP A CG 1 ATOM 3853 O OD1 . ASP A 1 482 ? 34.554 -3.579 41.445 1.00 61.54 ? 482 ASP A OD1 1 ATOM 3854 O OD2 . ASP A 1 482 ? 34.774 -1.576 40.673 1.00 63.25 ? 482 ASP A OD2 1 ATOM 3855 N N . LEU A 1 483 ? 29.556 -3.776 40.223 1.00 56.53 ? 483 LEU A N 1 ATOM 3856 C CA . LEU A 1 483 ? 28.168 -3.620 40.596 1.00 55.61 ? 483 LEU A CA 1 ATOM 3857 C C . LEU A 1 483 ? 27.508 -4.963 40.868 1.00 55.61 ? 483 LEU A C 1 ATOM 3858 O O . LEU A 1 483 ? 26.923 -5.182 41.932 1.00 55.82 ? 483 LEU A O 1 ATOM 3859 C CB . LEU A 1 483 ? 27.401 -2.905 39.481 1.00 54.55 ? 483 LEU A CB 1 ATOM 3860 C CG . LEU A 1 483 ? 27.461 -1.389 39.494 1.00 53.20 ? 483 LEU A CG 1 ATOM 3861 C CD1 . LEU A 1 483 ? 27.162 -0.816 38.116 1.00 50.60 ? 483 LEU A CD1 1 ATOM 3862 C CD2 . LEU A 1 483 ? 26.509 -0.817 40.524 1.00 51.13 ? 483 LEU A CD2 1 ATOM 3863 N N . TYR A 1 484 ? 27.632 -5.839 39.874 1.00 55.69 ? 484 TYR A N 1 ATOM 3864 C CA . TYR A 1 484 ? 26.979 -7.157 39.921 1.00 55.42 ? 484 TYR A CA 1 ATOM 3865 C C . TYR A 1 484 ? 27.821 -8.314 40.533 1.00 56.92 ? 484 TYR A C 1 ATOM 3866 O O . TYR A 1 484 ? 27.278 -9.328 40.976 1.00 56.73 ? 484 TYR A O 1 ATOM 3867 C CB . TYR A 1 484 ? 26.488 -7.472 38.523 1.00 54.71 ? 484 TYR A CB 1 ATOM 3868 C CG . TYR A 1 484 ? 25.325 -6.623 38.050 1.00 50.27 ? 484 TYR A CG 1 ATOM 3869 C CD1 . TYR A 1 484 ? 23.986 -7.013 38.287 1.00 48.72 ? 484 TYR A CD1 1 ATOM 3870 C CD2 . TYR A 1 484 ? 25.543 -5.458 37.331 1.00 46.74 ? 484 TYR A CD2 1 ATOM 3871 C CE1 . TYR A 1 484 ? 22.929 -6.256 37.802 1.00 46.36 ? 484 TYR A CE1 1 ATOM 3872 C CE2 . TYR A 1 484 ? 24.459 -4.714 36.865 1.00 47.22 ? 484 TYR A CE2 1 ATOM 3873 C CZ . TYR A 1 484 ? 23.172 -5.112 37.100 1.00 45.46 ? 484 TYR A CZ 1 ATOM 3874 O OH . TYR A 1 484 ? 22.116 -4.359 36.624 1.00 47.90 ? 484 TYR A OH 1 ATOM 3875 N N . LYS A 1 485 ? 29.168 -8.157 40.569 1.00 57.99 ? 485 LYS A N 1 ATOM 3876 C CA . LYS A 1 485 ? 30.087 -9.163 41.148 1.00 60.21 ? 485 LYS A CA 1 ATOM 3877 C C . LYS A 1 485 ? 30.345 -10.380 40.265 1.00 61.16 ? 485 LYS A C 1 ATOM 3878 O O . LYS A 1 485 ? 31.107 -11.283 40.624 1.00 62.46 ? 485 LYS A O 1 ATOM 3879 C CB . LYS A 1 485 ? 29.524 -9.657 42.489 1.00 60.32 ? 485 LYS A CB 1 ATOM 3880 C CG . LYS A 1 485 ? 29.667 -8.641 43.612 1.00 62.21 ? 485 LYS A CG 1 ATOM 3881 C CD . LYS A 1 485 ? 30.911 -7.813 43.441 1.00 66.66 ? 485 LYS A CD 1 ATOM 3882 C CE . LYS A 1 485 ? 31.055 -6.759 44.530 1.00 67.16 ? 485 LYS A CE 1 ATOM 3883 N NZ . LYS A 1 485 ? 29.794 -5.983 44.729 1.00 64.73 ? 485 LYS A NZ 1 ATOM 3884 N N . THR A 1 486 ? 29.672 -10.393 39.135 1.00 61.89 ? 486 THR A N 1 ATOM 3885 C CA . THR A 1 486 ? 29.843 -11.480 38.174 1.00 61.52 ? 486 THR A CA 1 ATOM 3886 C C . THR A 1 486 ? 28.984 -11.314 36.943 1.00 61.48 ? 486 THR A C 1 ATOM 3887 O O . THR A 1 486 ? 27.926 -10.681 36.973 1.00 62.23 ? 486 THR A O 1 ATOM 3888 C CB . THR A 1 486 ? 29.489 -12.842 38.794 1.00 62.19 ? 486 THR A CB 1 ATOM 3889 O OG1 . THR A 1 486 ? 29.787 -13.886 37.843 1.00 61.22 ? 486 THR A OG1 1 ATOM 3890 C CG2 . THR A 1 486 ? 28.012 -12.891 39.173 1.00 64.81 ? 486 THR A CG2 1 ATOM 3891 N N . PRO A 1 487 ? 29.449 -11.909 35.854 1.00 61.36 ? 487 PRO A N 1 ATOM 3892 C CA . PRO A 1 487 ? 28.674 -11.875 34.575 1.00 60.65 ? 487 PRO A CA 1 ATOM 3893 C C . PRO A 1 487 ? 27.334 -12.491 34.764 1.00 60.19 ? 487 PRO A C 1 ATOM 3894 O O . PRO A 1 487 ? 26.343 -12.142 34.126 1.00 59.48 ? 487 PRO A O 1 ATOM 3895 C CB . PRO A 1 487 ? 29.579 -12.555 33.586 1.00 61.22 ? 487 PRO A CB 1 ATOM 3896 C CG . PRO A 1 487 ? 30.922 -12.065 34.045 1.00 61.50 ? 487 PRO A CG 1 ATOM 3897 C CD . PRO A 1 487 ? 30.826 -11.638 35.487 1.00 60.93 ? 487 PRO A CD 1 ATOM 3898 N N . ASP A 1 488 ? 27.329 -13.445 35.692 1.00 59.44 ? 488 ASP A N 1 ATOM 3899 C CA . ASP A 1 488 ? 26.146 -14.279 35.942 1.00 57.94 ? 488 ASP A CA 1 ATOM 3900 C C . ASP A 1 488 ? 24.943 -13.459 36.364 1.00 56.44 ? 488 ASP A C 1 ATOM 3901 O O . ASP A 1 488 ? 23.814 -13.759 35.994 1.00 55.16 ? 488 ASP A O 1 ATOM 3902 C CB . ASP A 1 488 ? 26.409 -15.340 37.037 1.00 58.31 ? 488 ASP A CB 1 ATOM 3903 C CG . ASP A 1 488 ? 27.207 -16.547 36.537 1.00 59.11 ? 488 ASP A CG 1 ATOM 3904 O OD1 . ASP A 1 488 ? 27.278 -16.741 35.305 1.00 60.24 ? 488 ASP A OD1 1 ATOM 3905 O OD2 . ASP A 1 488 ? 27.809 -17.340 37.316 1.00 59.87 ? 488 ASP A OD2 1 ATOM 3906 N N . ASN A 1 489 ? 25.215 -12.399 37.105 1.00 55.86 ? 489 ASN A N 1 ATOM 3907 C CA . ASN A 1 489 ? 24.198 -11.654 37.839 1.00 53.83 ? 489 ASN A CA 1 ATOM 3908 C C . ASN A 1 489 ? 23.707 -10.398 37.155 1.00 54.06 ? 489 ASN A C 1 ATOM 3909 O O . ASN A 1 489 ? 22.739 -9.783 37.637 1.00 55.20 ? 489 ASN A O 1 ATOM 3910 C CB . ASN A 1 489 ? 24.741 -11.277 39.226 1.00 53.28 ? 489 ASN A CB 1 ATOM 3911 C CG . ASN A 1 489 ? 24.428 -12.315 40.294 1.00 50.21 ? 489 ASN A CG 1 ATOM 3912 O OD1 . ASN A 1 489 ? 24.243 -13.471 40.002 1.00 52.51 ? 489 ASN A OD1 1 ATOM 3913 N ND2 . ASN A 1 489 ? 24.371 -11.890 41.538 1.00 45.46 ? 489 ASN A ND2 1 ATOM 3914 N N . ILE A 1 490 ? 24.313 -10.043 36.016 1.00 52.89 ? 490 ILE A N 1 ATOM 3915 C CA . ILE A 1 490 ? 23.972 -8.774 35.314 1.00 51.30 ? 490 ILE A CA 1 ATOM 3916 C C . ILE A 1 490 ? 22.567 -8.791 34.709 1.00 50.71 ? 490 ILE A C 1 ATOM 3917 O O . ILE A 1 490 ? 22.250 -9.612 33.883 1.00 51.07 ? 490 ILE A O 1 ATOM 3918 C CB . ILE A 1 490 ? 24.997 -8.450 34.188 1.00 50.91 ? 490 ILE A CB 1 ATOM 3919 C CG1 . ILE A 1 490 ? 26.406 -8.222 34.751 1.00 51.33 ? 490 ILE A CG1 1 ATOM 3920 C CG2 . ILE A 1 490 ? 24.513 -7.281 33.339 1.00 47.69 ? 490 ILE A CG2 1 ATOM 3921 C CD1 . ILE A 1 490 ? 27.527 -8.413 33.707 1.00 46.95 ? 490 ILE A CD1 1 ATOM 3922 N N . ASP A 1 491 ? 21.722 -7.850 35.089 1.00 50.96 ? 491 ASP A N 1 ATOM 3923 C CA . ASP A 1 491 ? 20.395 -7.797 34.486 1.00 49.99 ? 491 ASP A CA 1 ATOM 3924 C C . ASP A 1 491 ? 20.472 -7.791 32.949 1.00 50.40 ? 491 ASP A C 1 ATOM 3925 O O . ASP A 1 491 ? 21.256 -7.058 32.366 1.00 51.50 ? 491 ASP A O 1 ATOM 3926 C CB . ASP A 1 491 ? 19.529 -6.689 35.066 1.00 49.05 ? 491 ASP A CB 1 ATOM 3927 C CG . ASP A 1 491 ? 19.506 -6.700 36.594 1.00 48.25 ? 491 ASP A CG 1 ATOM 3928 O OD1 . ASP A 1 491 ? 18.772 -7.561 37.174 1.00 43.56 ? 491 ASP A OD1 1 ATOM 3929 O OD2 . ASP A 1 491 ? 20.187 -5.867 37.287 1.00 47.67 ? 491 ASP A OD2 1 ATOM 3930 N N . ILE A 1 492 ? 19.625 -8.598 32.305 1.00 49.53 ? 492 ILE A N 1 ATOM 3931 C CA . ILE A 1 492 ? 19.587 -8.755 30.860 1.00 48.10 ? 492 ILE A CA 1 ATOM 3932 C C . ILE A 1 492 ? 19.427 -7.472 30.019 1.00 48.90 ? 492 ILE A C 1 ATOM 3933 O O . ILE A 1 492 ? 20.000 -7.337 28.925 1.00 47.83 ? 492 ILE A O 1 ATOM 3934 C CB . ILE A 1 492 ? 18.486 -9.764 30.481 1.00 48.53 ? 492 ILE A CB 1 ATOM 3935 C CG1 . ILE A 1 492 ? 18.655 -10.224 29.041 1.00 45.54 ? 492 ILE A CG1 1 ATOM 3936 C CG2 . ILE A 1 492 ? 17.072 -9.169 30.693 1.00 47.55 ? 492 ILE A CG2 1 ATOM 3937 C CD1 . ILE A 1 492 ? 20.080 -10.532 28.726 1.00 43.70 ? 492 ILE A CD1 1 ATOM 3938 N N . TRP A 1 493 ? 18.588 -6.569 30.488 1.00 48.37 ? 493 TRP A N 1 ATOM 3939 C CA . TRP A 1 493 ? 18.313 -5.337 29.761 1.00 48.04 ? 493 TRP A CA 1 ATOM 3940 C C . TRP A 1 493 ? 19.628 -4.618 29.505 1.00 48.71 ? 493 TRP A C 1 ATOM 3941 O O . TRP A 1 493 ? 19.924 -4.160 28.400 1.00 47.88 ? 493 TRP A O 1 ATOM 3942 C CB . TRP A 1 493 ? 17.489 -4.370 30.614 1.00 47.39 ? 493 TRP A CB 1 ATOM 3943 C CG . TRP A 1 493 ? 17.332 -3.084 29.904 1.00 45.94 ? 493 TRP A CG 1 ATOM 3944 C CD1 . TRP A 1 493 ? 16.648 -2.896 28.758 1.00 38.87 ? 493 TRP A CD1 1 ATOM 3945 C CD2 . TRP A 1 493 ? 17.882 -1.798 30.272 1.00 42.89 ? 493 TRP A CD2 1 ATOM 3946 N NE1 . TRP A 1 493 ? 16.712 -1.577 28.395 1.00 41.95 ? 493 TRP A NE1 1 ATOM 3947 C CE2 . TRP A 1 493 ? 17.471 -0.886 29.311 1.00 42.79 ? 493 TRP A CE2 1 ATOM 3948 C CE3 . TRP A 1 493 ? 18.675 -1.334 31.333 1.00 44.87 ? 493 TRP A CE3 1 ATOM 3949 C CZ2 . TRP A 1 493 ? 17.827 0.479 29.358 1.00 43.35 ? 493 TRP A CZ2 1 ATOM 3950 C CZ3 . TRP A 1 493 ? 19.032 0.005 31.382 1.00 44.83 ? 493 TRP A CZ3 1 ATOM 3951 C CH2 . TRP A 1 493 ? 18.611 0.896 30.403 1.00 43.06 ? 493 TRP A CH2 1 ATOM 3952 N N . ILE A 1 494 ? 20.412 -4.551 30.562 1.00 48.93 ? 494 ILE A N 1 ATOM 3953 C CA . ILE A 1 494 ? 21.638 -3.794 30.530 1.00 49.46 ? 494 ILE A CA 1 ATOM 3954 C C . ILE A 1 494 ? 22.885 -4.557 30.025 1.00 49.20 ? 494 ILE A C 1 ATOM 3955 O O . ILE A 1 494 ? 23.717 -3.980 29.360 1.00 49.37 ? 494 ILE A O 1 ATOM 3956 C CB . ILE A 1 494 ? 21.857 -3.068 31.869 1.00 49.00 ? 494 ILE A CB 1 ATOM 3957 C CG1 . ILE A 1 494 ? 22.625 -1.775 31.607 1.00 50.26 ? 494 ILE A CG1 1 ATOM 3958 C CG2 . ILE A 1 494 ? 22.677 -3.909 32.773 1.00 50.13 ? 494 ILE A CG2 1 ATOM 3959 C CD1 . ILE A 1 494 ? 23.969 -1.888 32.142 1.00 52.75 ? 494 ILE A CD1 1 ATOM 3960 N N . GLY A 1 495 ? 22.989 -5.855 30.281 1.00 49.37 ? 495 GLY A N 1 ATOM 3961 C CA . GLY A 1 495 ? 24.102 -6.603 29.713 1.00 48.19 ? 495 GLY A CA 1 ATOM 3962 C C . GLY A 1 495 ? 23.919 -6.743 28.223 1.00 47.02 ? 495 GLY A C 1 ATOM 3963 O O . GLY A 1 495 ? 24.885 -6.773 27.451 1.00 47.17 ? 495 GLY A O 1 ATOM 3964 N N . GLY A 1 496 ? 22.667 -6.801 27.803 1.00 45.32 ? 496 GLY A N 1 ATOM 3965 C CA . GLY A 1 496 ? 22.351 -6.933 26.396 1.00 43.53 ? 496 GLY A CA 1 ATOM 3966 C C . GLY A 1 496 ? 22.601 -5.647 25.637 1.00 43.70 ? 496 GLY A C 1 ATOM 3967 O O . GLY A 1 496 ? 22.911 -5.682 24.453 1.00 45.91 ? 496 GLY A O 1 ATOM 3968 N N . ASN A 1 497 ? 22.490 -4.512 26.302 1.00 42.17 ? 497 ASN A N 1 ATOM 3969 C CA . ASN A 1 497 ? 22.652 -3.253 25.647 1.00 42.96 ? 497 ASN A CA 1 ATOM 3970 C C . ASN A 1 497 ? 24.116 -2.757 25.718 1.00 44.09 ? 497 ASN A C 1 ATOM 3971 O O . ASN A 1 497 ? 24.513 -1.901 24.955 1.00 43.39 ? 497 ASN A O 1 ATOM 3972 C CB . ASN A 1 497 ? 21.704 -2.222 26.233 1.00 42.08 ? 497 ASN A CB 1 ATOM 3973 C CG . ASN A 1 497 ? 20.271 -2.406 25.749 1.00 43.18 ? 497 ASN A CG 1 ATOM 3974 O OD1 . ASN A 1 497 ? 19.974 -2.245 24.547 1.00 45.11 ? 497 ASN A OD1 1 ATOM 3975 N ND2 . ASN A 1 497 ? 19.375 -2.780 26.673 1.00 38.18 ? 497 ASN A ND2 1 ATOM 3976 N N . ALA A 1 498 ? 24.873 -3.337 26.629 1.00 45.43 ? 498 ALA A N 1 ATOM 3977 C CA . ALA A 1 498 ? 26.278 -3.044 26.860 1.00 48.53 ? 498 ALA A CA 1 ATOM 3978 C C . ALA A 1 498 ? 27.211 -3.598 25.788 1.00 50.05 ? 498 ALA A C 1 ATOM 3979 O O . ALA A 1 498 ? 28.304 -3.117 25.649 1.00 52.03 ? 498 ALA A O 1 ATOM 3980 C CB . ALA A 1 498 ? 26.714 -3.553 28.254 1.00 47.79 ? 498 ALA A CB 1 ATOM 3981 N N . GLU A 1 499 ? 26.862 -4.685 25.030 1.00 51.98 ? 499 GLU A N 1 ATOM 3982 C CA . GLU A 1 499 ? 27.773 -5.205 23.987 1.00 53.10 ? 499 GLU A CA 1 ATOM 3983 C C . GLU A 1 499 ? 27.613 -4.370 22.757 1.00 53.96 ? 499 GLU A C 1 ATOM 3984 O O . GLU A 1 499 ? 26.539 -3.891 22.412 1.00 54.86 ? 499 GLU A O 1 ATOM 3985 C CB . GLU A 1 499 ? 27.521 -6.660 23.619 1.00 52.17 ? 499 GLU A CB 1 ATOM 3986 C CG . GLU A 1 499 ? 26.493 -7.350 24.492 1.00 51.64 ? 499 GLU A CG 1 ATOM 3987 C CD . GLU A 1 499 ? 26.096 -8.729 23.958 1.00 48.07 ? 499 GLU A CD 1 ATOM 3988 O OE1 . GLU A 1 499 ? 25.587 -8.783 22.822 1.00 45.11 ? 499 GLU A OE1 1 ATOM 3989 O OE2 . GLU A 1 499 ? 26.302 -9.725 24.664 1.00 47.16 ? 499 GLU A OE2 1 ATOM 3990 N N . PRO A 1 500 ? 28.748 -4.199 22.087 1.00 54.37 ? 500 PRO A N 1 ATOM 3991 C CA . PRO A 1 500 ? 28.886 -3.380 20.879 1.00 55.33 ? 500 PRO A CA 1 ATOM 3992 C C . PRO A 1 500 ? 28.019 -3.931 19.756 1.00 56.53 ? 500 PRO A C 1 ATOM 3993 O O . PRO A 1 500 ? 27.788 -5.131 19.780 1.00 57.10 ? 500 PRO A O 1 ATOM 3994 C CB . PRO A 1 500 ? 30.379 -3.536 20.490 1.00 55.45 ? 500 PRO A CB 1 ATOM 3995 C CG . PRO A 1 500 ? 31.067 -4.134 21.690 1.00 55.56 ? 500 PRO A CG 1 ATOM 3996 C CD . PRO A 1 500 ? 30.006 -4.836 22.513 1.00 54.62 ? 500 PRO A CD 1 ATOM 3997 N N . MET A 1 501 ? 27.609 -3.083 18.801 1.00 57.11 ? 501 MET A N 1 ATOM 3998 C CA . MET A 1 501 ? 26.724 -3.534 17.706 1.00 58.74 ? 501 MET A CA 1 ATOM 3999 C C . MET A 1 501 ? 27.315 -4.126 16.414 1.00 58.32 ? 501 MET A C 1 ATOM 4000 O O . MET A 1 501 ? 28.235 -3.569 15.817 1.00 58.34 ? 501 MET A O 1 ATOM 4001 C CB . MET A 1 501 ? 25.839 -2.401 17.242 1.00 59.21 ? 501 MET A CB 1 ATOM 4002 C CG . MET A 1 501 ? 25.579 -1.366 18.293 1.00 61.78 ? 501 MET A CG 1 ATOM 4003 S SD . MET A 1 501 ? 25.008 0.167 17.534 1.00 73.67 ? 501 MET A SD 1 ATOM 4004 C CE . MET A 1 501 ? 24.361 1.026 18.964 1.00 68.62 ? 501 MET A CE 1 ATOM 4005 N N . VAL A 1 502 ? 26.749 -5.297 15.996 1.00 58.16 ? 502 VAL A N 1 ATOM 4006 C CA . VAL A 1 502 ? 27.085 -6.006 14.759 1.00 58.85 ? 502 VAL A CA 1 ATOM 4007 C C . VAL A 1 502 ? 27.133 -5.079 13.540 1.00 59.75 ? 502 VAL A C 1 ATOM 4008 O O . VAL A 1 502 ? 26.475 -4.045 13.459 1.00 59.63 ? 502 VAL A O 1 ATOM 4009 C CB . VAL A 1 502 ? 25.978 -7.053 14.352 1.00 57.89 ? 502 VAL A CB 1 ATOM 4010 C CG1 . VAL A 1 502 ? 25.929 -8.210 15.351 1.00 57.44 ? 502 VAL A CG1 1 ATOM 4011 C CG2 . VAL A 1 502 ? 24.609 -6.400 14.256 1.00 56.94 ? 502 VAL A CG2 1 ATOM 4012 N N . GLU A 1 503 ? 27.958 -5.520 12.579 1.00 60.53 ? 503 GLU A N 1 ATOM 4013 C CA . GLU A 1 503 ? 28.109 -4.924 11.302 1.00 60.52 ? 503 GLU A CA 1 ATOM 4014 C C . GLU A 1 503 ? 26.735 -4.505 10.784 1.00 59.77 ? 503 GLU A C 1 ATOM 4015 O O . GLU A 1 503 ? 25.912 -5.363 10.463 1.00 60.65 ? 503 GLU A O 1 ATOM 4016 C CB . GLU A 1 503 ? 28.768 -5.922 10.318 1.00 61.28 ? 503 GLU A CB 1 ATOM 4017 C CG . GLU A 1 503 ? 29.054 -5.389 8.893 1.00 65.28 ? 503 GLU A CG 1 ATOM 4018 C CD . GLU A 1 503 ? 29.439 -6.473 7.882 1.00 69.98 ? 503 GLU A CD 1 ATOM 4019 O OE1 . GLU A 1 503 ? 30.615 -6.931 7.899 1.00 70.42 ? 503 GLU A OE1 1 ATOM 4020 O OE2 . GLU A 1 503 ? 28.579 -6.881 7.081 1.00 70.29 ? 503 GLU A OE2 1 ATOM 4021 N N . ARG A 1 504 ? 26.513 -3.206 10.684 1.00 58.62 ? 504 ARG A N 1 ATOM 4022 C CA . ARG A 1 504 ? 25.296 -2.689 10.096 1.00 57.91 ? 504 ARG A CA 1 ATOM 4023 C C . ARG A 1 504 ? 24.008 -2.896 10.868 1.00 56.14 ? 504 ARG A C 1 ATOM 4024 O O . ARG A 1 504 ? 22.918 -2.895 10.277 1.00 56.60 ? 504 ARG A O 1 ATOM 4025 C CB . ARG A 1 504 ? 25.115 -3.244 8.680 1.00 58.19 ? 504 ARG A CB 1 ATOM 4026 C CG . ARG A 1 504 ? 25.811 -2.399 7.587 1.00 61.61 ? 504 ARG A CG 1 ATOM 4027 C CD . ARG A 1 504 ? 24.866 -1.924 6.465 1.00 67.82 ? 504 ARG A CD 1 ATOM 4028 N NE . ARG A 1 504 ? 25.203 -0.588 5.944 1.00 67.88 ? 504 ARG A NE 1 ATOM 4029 C CZ . ARG A 1 504 ? 26.359 0.049 6.214 1.00 68.59 ? 504 ARG A CZ 1 ATOM 4030 N NH1 . ARG A 1 504 ? 27.268 -0.545 6.969 1.00 65.47 ? 504 ARG A NH1 1 ATOM 4031 N NH2 . ARG A 1 504 ? 26.575 1.268 5.745 1.00 68.09 ? 504 ARG A NH2 1 ATOM 4032 N N . GLY A 1 505 ? 24.121 -3.062 12.165 1.00 53.63 ? 505 GLY A N 1 ATOM 4033 C CA . GLY A 1 505 ? 22.974 -3.211 13.031 1.00 51.32 ? 505 GLY A CA 1 ATOM 4034 C C . GLY A 1 505 ? 22.955 -2.077 14.073 1.00 49.57 ? 505 GLY A C 1 ATOM 4035 O O . GLY A 1 505 ? 23.663 -1.083 13.927 1.00 48.22 ? 505 GLY A O 1 ATOM 4036 N N . ARG A 1 506 ? 22.148 -2.236 15.132 1.00 48.23 ? 506 ARG A N 1 ATOM 4037 C CA . ARG A 1 506 ? 22.117 -1.244 16.157 1.00 46.53 ? 506 ARG A CA 1 ATOM 4038 C C . ARG A 1 506 ? 22.006 -1.907 17.518 1.00 46.12 ? 506 ARG A C 1 ATOM 4039 O O . ARG A 1 506 ? 21.826 -1.238 18.525 1.00 46.53 ? 506 ARG A O 1 ATOM 4040 C CB . ARG A 1 506 ? 21.033 -0.223 15.883 1.00 46.82 ? 506 ARG A CB 1 ATOM 4041 C CG . ARG A 1 506 ? 21.336 0.711 14.717 1.00 47.26 ? 506 ARG A CG 1 ATOM 4042 C CD . ARG A 1 506 ? 22.443 1.721 15.025 1.00 51.60 ? 506 ARG A CD 1 ATOM 4043 N NE . ARG A 1 506 ? 22.688 2.639 13.909 1.00 56.31 ? 506 ARG A NE 1 ATOM 4044 C CZ . ARG A 1 506 ? 23.630 2.497 12.975 1.00 58.43 ? 506 ARG A CZ 1 ATOM 4045 N NH1 . ARG A 1 506 ? 24.469 1.455 13.012 1.00 55.62 ? 506 ARG A NH1 1 ATOM 4046 N NH2 . ARG A 1 506 ? 23.733 3.377 11.994 1.00 53.77 ? 506 ARG A NH2 1 ATOM 4047 N N . VAL A 1 507 ? 22.135 -3.241 17.522 1.00 45.01 ? 507 VAL A N 1 ATOM 4048 C CA . VAL A 1 507 ? 22.119 -4.038 18.748 1.00 42.30 ? 507 VAL A CA 1 ATOM 4049 C C . VAL A 1 507 ? 23.297 -5.007 18.667 1.00 43.35 ? 507 VAL A C 1 ATOM 4050 O O . VAL A 1 507 ? 23.814 -5.271 17.587 1.00 42.88 ? 507 VAL A O 1 ATOM 4051 C CB . VAL A 1 507 ? 20.830 -4.849 18.903 1.00 43.57 ? 507 VAL A CB 1 ATOM 4052 C CG1 . VAL A 1 507 ? 19.647 -3.929 19.176 1.00 39.10 ? 507 VAL A CG1 1 ATOM 4053 C CG2 . VAL A 1 507 ? 20.574 -5.700 17.679 1.00 38.68 ? 507 VAL A CG2 1 ATOM 4054 N N . GLY A 1 508 ? 23.739 -5.532 19.798 1.00 43.74 ? 508 GLY A N 1 ATOM 4055 C CA . GLY A 1 508 ? 24.863 -6.448 19.758 1.00 43.71 ? 508 GLY A CA 1 ATOM 4056 C C . GLY A 1 508 ? 24.384 -7.800 19.284 1.00 44.65 ? 508 GLY A C 1 ATOM 4057 O O . GLY A 1 508 ? 23.273 -7.900 18.792 1.00 44.22 ? 508 GLY A O 1 ATOM 4058 N N . PRO A 1 509 ? 25.228 -8.820 19.462 1.00 45.85 ? 509 PRO A N 1 ATOM 4059 C CA . PRO A 1 509 ? 24.930 -10.230 19.133 1.00 45.40 ? 509 PRO A CA 1 ATOM 4060 C C . PRO A 1 509 ? 23.812 -10.892 19.956 1.00 44.94 ? 509 PRO A C 1 ATOM 4061 O O . PRO A 1 509 ? 22.945 -11.579 19.397 1.00 44.80 ? 509 PRO A O 1 ATOM 4062 C CB . PRO A 1 509 ? 26.225 -10.949 19.493 1.00 45.08 ? 509 PRO A CB 1 ATOM 4063 C CG . PRO A 1 509 ? 27.298 -9.840 19.555 1.00 46.82 ? 509 PRO A CG 1 ATOM 4064 C CD . PRO A 1 509 ? 26.569 -8.650 20.068 1.00 45.97 ? 509 PRO A CD 1 ATOM 4065 N N . LEU A 1 510 ? 23.812 -10.680 21.258 1.00 44.11 ? 510 LEU A N 1 ATOM 4066 C CA . LEU A 1 510 ? 22.826 -11.327 22.114 1.00 44.29 ? 510 LEU A CA 1 ATOM 4067 C C . LEU A 1 510 ? 21.412 -10.838 21.734 1.00 44.60 ? 510 LEU A C 1 ATOM 4068 O O . LEU A 1 510 ? 20.509 -11.641 21.471 1.00 44.24 ? 510 LEU A O 1 ATOM 4069 C CB . LEU A 1 510 ? 23.131 -11.047 23.583 1.00 44.21 ? 510 LEU A CB 1 ATOM 4070 C CG . LEU A 1 510 ? 22.254 -11.746 24.609 1.00 45.24 ? 510 LEU A CG 1 ATOM 4071 C CD1 . LEU A 1 510 ? 22.366 -13.243 24.477 1.00 46.60 ? 510 LEU A CD1 1 ATOM 4072 C CD2 . LEU A 1 510 ? 22.635 -11.307 26.038 1.00 46.54 ? 510 LEU A CD2 1 ATOM 4073 N N . LEU A 1 511 ? 21.264 -9.529 21.631 1.00 43.76 ? 511 LEU A N 1 ATOM 4074 C CA . LEU A 1 511 ? 20.012 -8.921 21.273 1.00 44.45 ? 511 LEU A CA 1 ATOM 4075 C C . LEU A 1 511 ? 19.549 -9.299 19.888 1.00 44.99 ? 511 LEU A C 1 ATOM 4076 O O . LEU A 1 511 ? 18.347 -9.492 19.659 1.00 44.95 ? 511 LEU A O 1 ATOM 4077 C CB . LEU A 1 511 ? 20.122 -7.394 21.411 1.00 44.72 ? 511 LEU A CB 1 ATOM 4078 C CG . LEU A 1 511 ? 19.717 -6.770 22.778 1.00 46.14 ? 511 LEU A CG 1 ATOM 4079 C CD1 . LEU A 1 511 ? 19.905 -7.723 23.948 1.00 45.78 ? 511 LEU A CD1 1 ATOM 4080 C CD2 . LEU A 1 511 ? 20.411 -5.480 23.066 1.00 45.03 ? 511 LEU A CD2 1 ATOM 4081 N N . ALA A 1 512 ? 20.486 -9.414 18.948 1.00 44.48 ? 512 ALA A N 1 ATOM 4082 C CA . ALA A 1 512 ? 20.082 -9.735 17.577 1.00 44.83 ? 512 ALA A CA 1 ATOM 4083 C C . ALA A 1 512 ? 19.541 -11.157 17.568 1.00 44.79 ? 512 ALA A C 1 ATOM 4084 O O . ALA A 1 512 ? 18.701 -11.499 16.780 1.00 45.73 ? 512 ALA A O 1 ATOM 4085 C CB . ALA A 1 512 ? 21.308 -9.557 16.548 1.00 43.91 ? 512 ALA A CB 1 ATOM 4086 N N . CYS A 1 513 ? 20.056 -11.994 18.457 1.00 45.37 ? 513 CYS A N 1 ATOM 4087 C CA . CYS A 1 513 ? 19.546 -13.343 18.613 1.00 46.33 ? 513 CYS A CA 1 ATOM 4088 C C . CYS A 1 513 ? 18.157 -13.354 19.321 1.00 45.98 ? 513 CYS A C 1 ATOM 4089 O O . CYS A 1 513 ? 17.221 -13.933 18.810 1.00 46.12 ? 513 CYS A O 1 ATOM 4090 C CB . CYS A 1 513 ? 20.592 -14.164 19.359 1.00 45.35 ? 513 CYS A CB 1 ATOM 4091 S SG . CYS A 1 513 ? 20.019 -15.713 20.064 1.00 52.33 ? 513 CYS A SG 1 ATOM 4092 N N . LEU A 1 514 ? 18.043 -12.716 20.486 1.00 46.37 ? 514 LEU A N 1 ATOM 4093 C CA . LEU A 1 514 ? 16.775 -12.628 21.205 1.00 47.37 ? 514 LEU A CA 1 ATOM 4094 C C . LEU A 1 514 ? 15.677 -12.037 20.285 1.00 47.40 ? 514 LEU A C 1 ATOM 4095 O O . LEU A 1 514 ? 14.661 -12.667 20.038 1.00 47.17 ? 514 LEU A O 1 ATOM 4096 C CB . LEU A 1 514 ? 16.946 -11.781 22.470 1.00 46.27 ? 514 LEU A CB 1 ATOM 4097 C CG . LEU A 1 514 ? 17.936 -12.446 23.445 1.00 47.10 ? 514 LEU A CG 1 ATOM 4098 C CD1 . LEU A 1 514 ? 18.121 -11.700 24.833 1.00 38.94 ? 514 LEU A CD1 1 ATOM 4099 C CD2 . LEU A 1 514 ? 17.608 -13.948 23.649 1.00 41.54 ? 514 LEU A CD2 1 ATOM 4100 N N . LEU A 1 515 ? 15.944 -10.863 19.729 1.00 48.59 ? 515 LEU A N 1 ATOM 4101 C CA . LEU A 1 515 ? 15.016 -10.151 18.857 1.00 49.22 ? 515 LEU A CA 1 ATOM 4102 C C . LEU A 1 515 ? 14.774 -10.936 17.591 1.00 49.72 ? 515 LEU A C 1 ATOM 4103 O O . LEU A 1 515 ? 13.631 -11.036 17.111 1.00 49.34 ? 515 LEU A O 1 ATOM 4104 C CB . LEU A 1 515 ? 15.631 -8.814 18.420 1.00 48.97 ? 515 LEU A CB 1 ATOM 4105 C CG . LEU A 1 515 ? 15.773 -7.663 19.392 1.00 49.10 ? 515 LEU A CG 1 ATOM 4106 C CD1 . LEU A 1 515 ? 16.802 -6.687 18.841 1.00 47.95 ? 515 LEU A CD1 1 ATOM 4107 C CD2 . LEU A 1 515 ? 14.442 -6.978 19.549 1.00 47.04 ? 515 LEU A CD2 1 ATOM 4108 N N . GLY A 1 516 ? 15.872 -11.406 17.005 1.00 49.44 ? 516 GLY A N 1 ATOM 4109 C CA . GLY A 1 516 ? 15.830 -12.201 15.783 1.00 50.66 ? 516 GLY A CA 1 ATOM 4110 C C . GLY A 1 516 ? 14.895 -13.408 15.819 1.00 51.12 ? 516 GLY A C 1 ATOM 4111 O O . GLY A 1 516 ? 14.100 -13.572 14.934 1.00 50.62 ? 516 GLY A O 1 ATOM 4112 N N . ARG A 1 517 ? 15.007 -14.270 16.827 1.00 52.03 ? 517 ARG A N 1 ATOM 4113 C CA . ARG A 1 517 ? 14.075 -15.385 16.926 1.00 52.92 ? 517 ARG A CA 1 ATOM 4114 C C . ARG A 1 517 ? 12.609 -14.908 16.937 1.00 52.50 ? 517 ARG A C 1 ATOM 4115 O O . ARG A 1 517 ? 11.758 -15.394 16.151 1.00 52.19 ? 517 ARG A O 1 ATOM 4116 C CB . ARG A 1 517 ? 14.268 -16.125 18.237 1.00 53.55 ? 517 ARG A CB 1 ATOM 4117 C CG . ARG A 1 517 ? 15.329 -17.165 18.312 1.00 57.98 ? 517 ARG A CG 1 ATOM 4118 C CD . ARG A 1 517 ? 15.838 -17.311 19.741 1.00 64.32 ? 517 ARG A CD 1 ATOM 4119 N NE . ARG A 1 517 ? 16.909 -18.287 19.871 1.00 68.66 ? 517 ARG A NE 1 ATOM 4120 C CZ . ARG A 1 517 ? 16.745 -19.593 19.727 1.00 68.91 ? 517 ARG A CZ 1 ATOM 4121 N NH1 . ARG A 1 517 ? 15.544 -20.090 19.437 1.00 66.92 ? 517 ARG A NH1 1 ATOM 4122 N NH2 . ARG A 1 517 ? 17.786 -20.397 19.877 1.00 66.95 ? 517 ARG A NH2 1 ATOM 4123 N N . GLN A 1 518 ? 12.323 -14.001 17.876 1.00 51.04 ? 518 GLN A N 1 ATOM 4124 C CA . GLN A 1 518 ? 10.973 -13.541 18.160 1.00 49.74 ? 518 GLN A CA 1 ATOM 4125 C C . GLN A 1 518 ? 10.293 -13.071 16.934 1.00 48.81 ? 518 GLN A C 1 ATOM 4126 O O . GLN A 1 518 ? 9.186 -13.530 16.594 1.00 49.33 ? 518 GLN A O 1 ATOM 4127 C CB . GLN A 1 518 ? 10.973 -12.413 19.194 1.00 50.39 ? 518 GLN A CB 1 ATOM 4128 C CG . GLN A 1 518 ? 9.559 -12.029 19.635 1.00 48.36 ? 518 GLN A CG 1 ATOM 4129 C CD . GLN A 1 518 ? 9.005 -13.045 20.581 1.00 47.51 ? 518 GLN A CD 1 ATOM 4130 O OE1 . GLN A 1 518 ? 9.375 -13.068 21.757 1.00 45.60 ? 518 GLN A OE1 1 ATOM 4131 N NE2 . GLN A 1 518 ? 8.156 -13.930 20.070 1.00 46.37 ? 518 GLN A NE2 1 ATOM 4132 N N . PHE A 1 519 ? 10.923 -12.129 16.251 1.00 48.38 ? 519 PHE A N 1 ATOM 4133 C CA . PHE A 1 519 ? 10.370 -11.696 14.965 1.00 47.14 ? 519 PHE A CA 1 ATOM 4134 C C . PHE A 1 519 ? 10.226 -12.881 14.001 1.00 47.57 ? 519 PHE A C 1 ATOM 4135 O O . PHE A 1 519 ? 9.265 -12.968 13.255 1.00 47.75 ? 519 PHE A O 1 ATOM 4136 C CB . PHE A 1 519 ? 11.187 -10.561 14.368 1.00 46.93 ? 519 PHE A CB 1 ATOM 4137 C CG . PHE A 1 519 ? 10.918 -9.189 15.014 1.00 46.59 ? 519 PHE A CG 1 ATOM 4138 C CD1 . PHE A 1 519 ? 9.692 -8.553 14.862 1.00 46.73 ? 519 PHE A CD1 1 ATOM 4139 C CD2 . PHE A 1 519 ? 11.883 -8.568 15.750 1.00 41.80 ? 519 PHE A CD2 1 ATOM 4140 C CE1 . PHE A 1 519 ? 9.456 -7.328 15.441 1.00 45.87 ? 519 PHE A CE1 1 ATOM 4141 C CE2 . PHE A 1 519 ? 11.659 -7.387 16.320 1.00 45.39 ? 519 PHE A CE2 1 ATOM 4142 C CZ . PHE A 1 519 ? 10.428 -6.743 16.161 1.00 46.70 ? 519 PHE A CZ 1 ATOM 4143 N N . GLN A 1 520 ? 11.165 -13.816 14.014 1.00 48.12 ? 520 GLN A N 1 ATOM 4144 C CA . GLN A 1 520 ? 11.029 -14.945 13.120 1.00 49.21 ? 520 GLN A CA 1 ATOM 4145 C C . GLN A 1 520 ? 9.746 -15.654 13.455 1.00 49.01 ? 520 GLN A C 1 ATOM 4146 O O . GLN A 1 520 ? 8.964 -16.005 12.568 1.00 48.53 ? 520 GLN A O 1 ATOM 4147 C CB . GLN A 1 520 ? 12.236 -15.890 13.215 1.00 50.07 ? 520 GLN A CB 1 ATOM 4148 C CG . GLN A 1 520 ? 12.063 -17.174 12.412 1.00 51.27 ? 520 GLN A CG 1 ATOM 4149 C CD . GLN A 1 520 ? 11.739 -18.332 13.310 1.00 53.27 ? 520 GLN A CD 1 ATOM 4150 O OE1 . GLN A 1 520 ? 12.477 -18.585 14.258 1.00 51.92 ? 520 GLN A OE1 1 ATOM 4151 N NE2 . GLN A 1 520 ? 10.609 -19.023 13.046 1.00 52.92 ? 520 GLN A NE2 1 ATOM 4152 N N . GLN A 1 521 ? 9.503 -15.807 14.754 1.00 49.56 ? 521 GLN A N 1 ATOM 4153 C CA . GLN A 1 521 ? 8.338 -16.522 15.210 1.00 50.23 ? 521 GLN A CA 1 ATOM 4154 C C . GLN A 1 521 ? 7.013 -15.838 14.966 1.00 50.87 ? 521 GLN A C 1 ATOM 4155 O O . GLN A 1 521 ? 6.031 -16.476 14.645 1.00 50.64 ? 521 GLN A O 1 ATOM 4156 C CB . GLN A 1 521 ? 8.496 -16.837 16.672 1.00 51.46 ? 521 GLN A CB 1 ATOM 4157 C CG . GLN A 1 521 ? 9.691 -17.635 16.880 1.00 51.93 ? 521 GLN A CG 1 ATOM 4158 C CD . GLN A 1 521 ? 9.737 -18.236 18.207 1.00 56.34 ? 521 GLN A CD 1 ATOM 4159 O OE1 . GLN A 1 521 ? 10.797 -18.706 18.636 1.00 60.61 ? 521 GLN A OE1 1 ATOM 4160 N NE2 . GLN A 1 521 ? 8.614 -18.213 18.909 1.00 59.37 ? 521 GLN A NE2 1 ATOM 4161 N N . ILE A 1 522 ? 6.981 -14.524 15.109 1.00 52.10 ? 522 ILE A N 1 ATOM 4162 C CA . ILE A 1 522 ? 5.738 -13.821 14.913 1.00 52.34 ? 522 ILE A CA 1 ATOM 4163 C C . ILE A 1 522 ? 5.428 -13.793 13.443 1.00 52.44 ? 522 ILE A C 1 ATOM 4164 O O . ILE A 1 522 ? 4.261 -13.698 13.051 1.00 52.61 ? 522 ILE A O 1 ATOM 4165 C CB . ILE A 1 522 ? 5.741 -12.371 15.541 1.00 52.90 ? 522 ILE A CB 1 ATOM 4166 C CG1 . ILE A 1 522 ? 6.381 -11.362 14.619 1.00 52.21 ? 522 ILE A CG1 1 ATOM 4167 C CG2 . ILE A 1 522 ? 6.351 -12.344 16.883 1.00 53.89 ? 522 ILE A CG2 1 ATOM 4168 C CD1 . ILE A 1 522 ? 5.353 -10.549 13.919 1.00 53.82 ? 522 ILE A CD1 1 ATOM 4169 N N . ARG A 1 523 ? 6.441 -13.850 12.599 1.00 52.56 ? 523 ARG A N 1 ATOM 4170 C CA . ARG A 1 523 ? 6.075 -13.912 11.182 1.00 53.62 ? 523 ARG A CA 1 ATOM 4171 C C . ARG A 1 523 ? 5.747 -15.358 10.759 1.00 53.26 ? 523 ARG A C 1 ATOM 4172 O O . ARG A 1 523 ? 4.711 -15.602 10.176 1.00 53.61 ? 523 ARG A O 1 ATOM 4173 C CB . ARG A 1 523 ? 7.092 -13.247 10.270 1.00 53.71 ? 523 ARG A CB 1 ATOM 4174 C CG . ARG A 1 523 ? 6.971 -13.711 8.842 1.00 54.19 ? 523 ARG A CG 1 ATOM 4175 C CD . ARG A 1 523 ? 8.125 -14.658 8.425 1.00 57.60 ? 523 ARG A CD 1 ATOM 4176 N NE . ARG A 1 523 ? 9.182 -13.928 7.725 1.00 54.82 ? 523 ARG A NE 1 ATOM 4177 C CZ . ARG A 1 523 ? 10.402 -14.388 7.485 1.00 54.63 ? 523 ARG A CZ 1 ATOM 4178 N NH1 . ARG A 1 523 ? 10.782 -15.589 7.906 1.00 52.90 ? 523 ARG A NH1 1 ATOM 4179 N NH2 . ARG A 1 523 ? 11.259 -13.631 6.819 1.00 56.37 ? 523 ARG A NH2 1 ATOM 4180 N N . ASP A 1 524 ? 6.575 -16.321 11.154 1.00 52.92 ? 524 ASP A N 1 ATOM 4181 C CA . ASP A 1 524 ? 6.336 -17.703 10.740 1.00 52.64 ? 524 ASP A CA 1 ATOM 4182 C C . ASP A 1 524 ? 5.078 -18.269 11.374 1.00 52.38 ? 524 ASP A C 1 ATOM 4183 O O . ASP A 1 524 ? 4.460 -19.200 10.831 1.00 53.00 ? 524 ASP A O 1 ATOM 4184 C CB . ASP A 1 524 ? 7.510 -18.608 11.136 1.00 52.14 ? 524 ASP A CB 1 ATOM 4185 C CG . ASP A 1 524 ? 8.798 -18.303 10.383 1.00 52.08 ? 524 ASP A CG 1 ATOM 4186 O OD1 . ASP A 1 524 ? 8.785 -17.566 9.386 1.00 51.86 ? 524 ASP A OD1 1 ATOM 4187 O OD2 . ASP A 1 524 ? 9.895 -18.790 10.726 1.00 53.81 ? 524 ASP A OD2 1 ATOM 4188 N N . GLY A 1 525 ? 4.704 -17.740 12.535 1.00 51.20 ? 525 GLY A N 1 ATOM 4189 C CA . GLY A 1 525 ? 3.585 -18.303 13.252 1.00 50.14 ? 525 GLY A CA 1 ATOM 4190 C C . GLY A 1 525 ? 2.276 -17.607 13.000 1.00 50.11 ? 525 GLY A C 1 ATOM 4191 O O . GLY A 1 525 ? 1.303 -17.881 13.671 1.00 49.60 ? 525 GLY A O 1 ATOM 4192 N N . ASP A 1 526 ? 2.233 -16.723 12.015 1.00 51.51 ? 526 ASP A N 1 ATOM 4193 C CA . ASP A 1 526 ? 1.055 -15.886 11.793 1.00 53.28 ? 526 ASP A CA 1 ATOM 4194 C C . ASP A 1 526 ? 0.207 -16.401 10.629 1.00 54.93 ? 526 ASP A C 1 ATOM 4195 O O . ASP A 1 526 ? 0.646 -16.382 9.478 1.00 56.10 ? 526 ASP A O 1 ATOM 4196 C CB . ASP A 1 526 ? 1.519 -14.451 11.531 1.00 52.65 ? 526 ASP A CB 1 ATOM 4197 C CG . ASP A 1 526 ? 0.401 -13.477 11.438 1.00 51.62 ? 526 ASP A CG 1 ATOM 4198 O OD1 . ASP A 1 526 ? -0.707 -13.781 11.891 1.00 52.14 ? 526 ASP A OD1 1 ATOM 4199 O OD2 . ASP A 1 526 ? 0.529 -12.361 10.911 1.00 49.91 ? 526 ASP A OD2 1 ATOM 4200 N N . ARG A 1 527 ? -1.019 -16.830 10.914 1.00 56.02 ? 527 ARG A N 1 ATOM 4201 C CA . ARG A 1 527 ? -1.828 -17.425 9.871 1.00 56.84 ? 527 ARG A CA 1 ATOM 4202 C C . ARG A 1 527 ? -2.277 -16.363 8.903 1.00 57.03 ? 527 ARG A C 1 ATOM 4203 O O . ARG A 1 527 ? -2.569 -16.645 7.747 1.00 57.23 ? 527 ARG A O 1 ATOM 4204 C CB . ARG A 1 527 ? -2.985 -18.246 10.457 1.00 56.87 ? 527 ARG A CB 1 ATOM 4205 C CG . ARG A 1 527 ? -4.016 -18.726 9.423 1.00 57.98 ? 527 ARG A CG 1 ATOM 4206 C CD . ARG A 1 527 ? -4.873 -19.925 9.870 1.00 56.43 ? 527 ARG A CD 1 ATOM 4207 N NE . ARG A 1 527 ? -5.910 -19.544 10.824 1.00 55.75 ? 527 ARG A NE 1 ATOM 4208 C CZ . ARG A 1 527 ? -7.026 -18.900 10.502 1.00 57.08 ? 527 ARG A CZ 1 ATOM 4209 N NH1 . ARG A 1 527 ? -7.251 -18.560 9.238 1.00 55.78 ? 527 ARG A NH1 1 ATOM 4210 N NH2 . ARG A 1 527 ? -7.918 -18.585 11.449 1.00 54.88 ? 527 ARG A NH2 1 ATOM 4211 N N . PHE A 1 528 ? -2.279 -15.120 9.357 1.00 57.93 ? 528 PHE A N 1 ATOM 4212 C CA . PHE A 1 528 ? -2.719 -14.020 8.477 1.00 58.16 ? 528 PHE A CA 1 ATOM 4213 C C . PHE A 1 528 ? -1.584 -13.129 7.958 1.00 57.69 ? 528 PHE A C 1 ATOM 4214 O O . PHE A 1 528 ? -1.814 -12.037 7.501 1.00 58.44 ? 528 PHE A O 1 ATOM 4215 C CB . PHE A 1 528 ? -3.797 -13.183 9.194 1.00 58.34 ? 528 PHE A CB 1 ATOM 4216 C CG . PHE A 1 528 ? -5.107 -13.898 9.351 1.00 59.73 ? 528 PHE A CG 1 ATOM 4217 C CD1 . PHE A 1 528 ? -5.408 -14.567 10.524 1.00 62.35 ? 528 PHE A CD1 1 ATOM 4218 C CD2 . PHE A 1 528 ? -6.030 -13.903 8.324 1.00 58.61 ? 528 PHE A CD2 1 ATOM 4219 C CE1 . PHE A 1 528 ? -6.613 -15.210 10.676 1.00 62.92 ? 528 PHE A CE1 1 ATOM 4220 C CE2 . PHE A 1 528 ? -7.220 -14.561 8.448 1.00 61.04 ? 528 PHE A CE2 1 ATOM 4221 C CZ . PHE A 1 528 ? -7.524 -15.222 9.622 1.00 62.87 ? 528 PHE A CZ 1 ATOM 4222 N N . TRP A 1 529 ? -0.352 -13.594 8.025 1.00 58.46 ? 529 TRP A N 1 ATOM 4223 C CA . TRP A 1 529 ? 0.778 -12.823 7.515 1.00 59.43 ? 529 TRP A CA 1 ATOM 4224 C C . TRP A 1 529 ? 0.460 -12.292 6.123 1.00 60.22 ? 529 TRP A C 1 ATOM 4225 O O . TRP A 1 529 ? -0.334 -12.898 5.420 1.00 61.10 ? 529 TRP A O 1 ATOM 4226 C CB . TRP A 1 529 ? 1.996 -13.713 7.475 1.00 59.16 ? 529 TRP A CB 1 ATOM 4227 C CG . TRP A 1 529 ? 3.238 -13.014 7.034 1.00 60.30 ? 529 TRP A CG 1 ATOM 4228 C CD1 . TRP A 1 529 ? 3.902 -13.202 5.861 1.00 59.56 ? 529 TRP A CD1 1 ATOM 4229 C CD2 . TRP A 1 529 ? 3.986 -12.043 7.764 1.00 59.08 ? 529 TRP A CD2 1 ATOM 4230 N NE1 . TRP A 1 529 ? 5.004 -12.388 5.806 1.00 58.58 ? 529 TRP A NE1 1 ATOM 4231 C CE2 . TRP A 1 529 ? 5.067 -11.650 6.953 1.00 59.20 ? 529 TRP A CE2 1 ATOM 4232 C CE3 . TRP A 1 529 ? 3.835 -11.438 9.011 1.00 58.85 ? 529 TRP A CE3 1 ATOM 4233 C CZ2 . TRP A 1 529 ? 6.012 -10.714 7.362 1.00 60.23 ? 529 TRP A CZ2 1 ATOM 4234 C CZ3 . TRP A 1 529 ? 4.756 -10.499 9.407 1.00 60.59 ? 529 TRP A CZ3 1 ATOM 4235 C CH2 . TRP A 1 529 ? 5.839 -10.150 8.590 1.00 61.02 ? 529 TRP A CH2 1 ATOM 4236 N N . TRP A 1 530 ? 1.067 -11.183 5.699 1.00 60.83 ? 530 TRP A N 1 ATOM 4237 C CA . TRP A 1 530 ? 0.693 -10.596 4.390 1.00 62.13 ? 530 TRP A CA 1 ATOM 4238 C C . TRP A 1 530 ? 1.059 -11.418 3.136 1.00 62.49 ? 530 TRP A C 1 ATOM 4239 O O . TRP A 1 530 ? 0.395 -11.332 2.100 1.00 64.08 ? 530 TRP A O 1 ATOM 4240 C CB . TRP A 1 530 ? 1.220 -9.156 4.247 1.00 61.55 ? 530 TRP A CB 1 ATOM 4241 C CG . TRP A 1 530 ? 2.607 -9.082 3.800 1.00 60.43 ? 530 TRP A CG 1 ATOM 4242 C CD1 . TRP A 1 530 ? 3.717 -9.116 4.576 1.00 59.14 ? 530 TRP A CD1 1 ATOM 4243 C CD2 . TRP A 1 530 ? 3.056 -8.951 2.461 1.00 61.53 ? 530 TRP A CD2 1 ATOM 4244 N NE1 . TRP A 1 530 ? 4.844 -9.011 3.802 1.00 57.83 ? 530 TRP A NE1 1 ATOM 4245 C CE2 . TRP A 1 530 ? 4.462 -8.900 2.492 1.00 60.13 ? 530 TRP A CE2 1 ATOM 4246 C CE3 . TRP A 1 530 ? 2.410 -8.851 1.230 1.00 59.49 ? 530 TRP A CE3 1 ATOM 4247 C CZ2 . TRP A 1 530 ? 5.228 -8.789 1.346 1.00 59.13 ? 530 TRP A CZ2 1 ATOM 4248 C CZ3 . TRP A 1 530 ? 3.161 -8.762 0.100 1.00 61.43 ? 530 TRP A CZ3 1 ATOM 4249 C CH2 . TRP A 1 530 ? 4.563 -8.735 0.159 1.00 61.52 ? 530 TRP A CH2 1 ATOM 4250 N N . GLU A 1 531 ? 2.128 -12.185 3.239 1.00 63.42 ? 531 GLU A N 1 ATOM 4251 C CA . GLU A 1 531 ? 2.686 -12.947 2.142 1.00 64.74 ? 531 GLU A CA 1 ATOM 4252 C C . GLU A 1 531 ? 2.245 -14.431 2.267 1.00 64.92 ? 531 GLU A C 1 ATOM 4253 O O . GLU A 1 531 ? 2.576 -15.317 1.434 1.00 65.42 ? 531 GLU A O 1 ATOM 4254 C CB . GLU A 1 531 ? 4.206 -12.870 2.222 1.00 65.24 ? 531 GLU A CB 1 ATOM 4255 C CG . GLU A 1 531 ? 4.891 -11.822 1.372 1.00 67.13 ? 531 GLU A CG 1 ATOM 4256 C CD . GLU A 1 531 ? 6.299 -12.261 1.025 1.00 68.93 ? 531 GLU A CD 1 ATOM 4257 O OE1 . GLU A 1 531 ? 7.155 -12.292 1.937 1.00 69.29 ? 531 GLU A OE1 1 ATOM 4258 O OE2 . GLU A 1 531 ? 6.542 -12.601 -0.153 1.00 70.78 ? 531 GLU A OE2 1 ATOM 4259 N N . ASN A 1 532 ? 1.533 -14.726 3.348 1.00 63.92 ? 532 ASN A N 1 ATOM 4260 C CA . ASN A 1 532 ? 1.002 -16.062 3.434 1.00 63.06 ? 532 ASN A CA 1 ATOM 4261 C C . ASN A 1 532 ? 0.082 -16.228 2.241 1.00 62.30 ? 532 ASN A C 1 ATOM 4262 O O . ASN A 1 532 ? -0.889 -15.488 2.077 1.00 61.24 ? 532 ASN A O 1 ATOM 4263 C CB . ASN A 1 532 ? 0.256 -16.328 4.724 1.00 63.04 ? 532 ASN A CB 1 ATOM 4264 C CG . ASN A 1 532 ? -0.150 -17.774 4.851 1.00 63.35 ? 532 ASN A CG 1 ATOM 4265 O OD1 . ASN A 1 532 ? 0.570 -18.681 4.403 1.00 61.94 ? 532 ASN A OD1 1 ATOM 4266 N ND2 . ASN A 1 532 ? -1.319 -18.010 5.457 1.00 64.65 ? 532 ASN A ND2 1 ATOM 4267 N N . PRO A 1 533 ? 0.468 -17.158 1.377 1.00 62.09 ? 533 PRO A N 1 ATOM 4268 C CA . PRO A 1 533 ? -0.276 -17.531 0.168 1.00 62.18 ? 533 PRO A CA 1 ATOM 4269 C C . PRO A 1 533 ? -1.731 -17.679 0.480 1.00 62.44 ? 533 PRO A C 1 ATOM 4270 O O . PRO A 1 533 ? -2.086 -18.485 1.342 1.00 62.16 ? 533 PRO A O 1 ATOM 4271 C CB . PRO A 1 533 ? 0.306 -18.897 -0.189 1.00 62.16 ? 533 PRO A CB 1 ATOM 4272 C CG . PRO A 1 533 ? 1.713 -18.901 0.369 1.00 62.39 ? 533 PRO A CG 1 ATOM 4273 C CD . PRO A 1 533 ? 1.742 -17.880 1.504 1.00 62.24 ? 533 PRO A CD 1 ATOM 4274 N N . GLY A 1 534 ? -2.568 -16.892 -0.178 1.00 63.42 ? 534 GLY A N 1 ATOM 4275 C CA . GLY A 1 534 ? -3.993 -17.046 0.009 1.00 64.86 ? 534 GLY A CA 1 ATOM 4276 C C . GLY A 1 534 ? -4.684 -16.016 0.862 1.00 66.29 ? 534 GLY A C 1 ATOM 4277 O O . GLY A 1 534 ? -5.911 -15.991 0.901 1.00 66.20 ? 534 GLY A O 1 ATOM 4278 N N . VAL A 1 535 ? -3.903 -15.162 1.531 1.00 67.55 ? 535 VAL A N 1 ATOM 4279 C CA . VAL A 1 535 ? -4.412 -14.069 2.382 1.00 68.80 ? 535 VAL A CA 1 ATOM 4280 C C . VAL A 1 535 ? -4.769 -12.897 1.508 1.00 69.42 ? 535 VAL A C 1 ATOM 4281 O O . VAL A 1 535 ? -5.884 -12.389 1.565 1.00 69.53 ? 535 VAL A O 1 ATOM 4282 C CB . VAL A 1 535 ? -3.380 -13.677 3.455 1.00 68.92 ? 535 VAL A CB 1 ATOM 4283 C CG1 . VAL A 1 535 ? -3.763 -12.378 4.167 1.00 68.85 ? 535 VAL A CG1 1 ATOM 4284 C CG2 . VAL A 1 535 ? -3.248 -14.812 4.443 1.00 68.14 ? 535 VAL A CG2 1 ATOM 4285 N N . PHE A 1 536 ? -3.811 -12.502 0.682 1.00 71.07 ? 536 PHE A N 1 ATOM 4286 C CA . PHE A 1 536 ? -4.024 -11.469 -0.309 1.00 72.87 ? 536 PHE A CA 1 ATOM 4287 C C . PHE A 1 536 ? -3.911 -12.116 -1.679 1.00 73.99 ? 536 PHE A C 1 ATOM 4288 O O . PHE A 1 536 ? -3.268 -13.158 -1.813 1.00 74.11 ? 536 PHE A O 1 ATOM 4289 C CB . PHE A 1 536 ? -2.978 -10.368 -0.165 1.00 73.21 ? 536 PHE A CB 1 ATOM 4290 C CG . PHE A 1 536 ? -3.234 -9.432 0.982 1.00 73.06 ? 536 PHE A CG 1 ATOM 4291 C CD1 . PHE A 1 536 ? -2.481 -9.524 2.140 1.00 74.11 ? 536 PHE A CD1 1 ATOM 4292 C CD2 . PHE A 1 536 ? -4.229 -8.484 0.907 1.00 73.21 ? 536 PHE A CD2 1 ATOM 4293 C CE1 . PHE A 1 536 ? -2.706 -8.682 3.195 1.00 74.33 ? 536 PHE A CE1 1 ATOM 4294 C CE2 . PHE A 1 536 ? -4.458 -7.633 1.961 1.00 75.45 ? 536 PHE A CE2 1 ATOM 4295 C CZ . PHE A 1 536 ? -3.687 -7.735 3.108 1.00 75.44 ? 536 PHE A CZ 1 ATOM 4296 N N . THR A 1 537 ? -4.532 -11.520 -2.696 1.00 75.23 ? 537 THR A N 1 ATOM 4297 C CA . THR A 1 537 ? -4.427 -12.103 -4.039 1.00 76.14 ? 537 THR A CA 1 ATOM 4298 C C . THR A 1 537 ? -3.084 -11.806 -4.662 1.00 77.18 ? 537 THR A C 1 ATOM 4299 O O . THR A 1 537 ? -2.275 -11.028 -4.138 1.00 77.97 ? 537 THR A O 1 ATOM 4300 C CB . THR A 1 537 ? -5.467 -11.550 -5.026 1.00 75.73 ? 537 THR A CB 1 ATOM 4301 O OG1 . THR A 1 537 ? -5.085 -10.228 -5.424 1.00 75.05 ? 537 THR A OG1 1 ATOM 4302 C CG2 . THR A 1 537 ? -6.846 -11.380 -4.397 1.00 76.41 ? 537 THR A CG2 1 ATOM 4303 N N . GLU A 1 538 ? -2.873 -12.449 -5.801 1.00 77.70 ? 538 GLU A N 1 ATOM 4304 C CA . GLU A 1 538 ? -1.752 -12.197 -6.661 1.00 77.93 ? 538 GLU A CA 1 ATOM 4305 C C . GLU A 1 538 ? -1.579 -10.695 -6.785 1.00 77.89 ? 538 GLU A C 1 ATOM 4306 O O . GLU A 1 538 ? -0.558 -10.148 -6.404 1.00 77.57 ? 538 GLU A O 1 ATOM 4307 C CB . GLU A 1 538 ? -2.108 -12.751 -8.043 1.00 78.50 ? 538 GLU A CB 1 ATOM 4308 C CG . GLU A 1 538 ? -1.021 -12.642 -9.089 1.00 79.16 ? 538 GLU A CG 1 ATOM 4309 C CD . GLU A 1 538 ? -0.195 -13.890 -9.134 1.00 81.80 ? 538 GLU A CD 1 ATOM 4310 O OE1 . GLU A 1 538 ? 0.471 -14.124 -10.177 1.00 84.17 ? 538 GLU A OE1 1 ATOM 4311 O OE2 . GLU A 1 538 ? -0.238 -14.647 -8.133 1.00 80.32 ? 538 GLU A OE2 1 ATOM 4312 N N . LYS A 1 539 ? -2.605 -10.048 -7.329 1.00 78.25 ? 539 LYS A N 1 ATOM 4313 C CA . LYS A 1 539 ? -2.596 -8.616 -7.607 1.00 79.03 ? 539 LYS A CA 1 ATOM 4314 C C . LYS A 1 539 ? -2.300 -7.771 -6.382 1.00 78.83 ? 539 LYS A C 1 ATOM 4315 O O . LYS A 1 539 ? -1.433 -6.886 -6.394 1.00 78.68 ? 539 LYS A O 1 ATOM 4316 C CB . LYS A 1 539 ? -3.943 -8.182 -8.192 1.00 79.36 ? 539 LYS A CB 1 ATOM 4317 C CG . LYS A 1 539 ? -4.197 -8.591 -9.659 1.00 81.59 ? 539 LYS A CG 1 ATOM 4318 C CD . LYS A 1 539 ? -5.574 -8.090 -10.155 1.00 83.36 ? 539 LYS A CD 1 ATOM 4319 C CE . LYS A 1 539 ? -5.520 -6.625 -10.643 1.00 85.43 ? 539 LYS A CE 1 ATOM 4320 N NZ . LYS A 1 539 ? -6.773 -6.187 -11.356 1.00 86.09 ? 539 LYS A NZ 1 ATOM 4321 N N . GLN A 1 540 ? -3.051 -8.043 -5.324 1.00 78.49 ? 540 GLN A N 1 ATOM 4322 C CA . GLN A 1 540 ? -2.918 -7.300 -4.095 1.00 77.18 ? 540 GLN A CA 1 ATOM 4323 C C . GLN A 1 540 ? -1.472 -7.341 -3.648 1.00 77.27 ? 540 GLN A C 1 ATOM 4324 O O . GLN A 1 540 ? -0.872 -6.309 -3.372 1.00 77.36 ? 540 GLN A O 1 ATOM 4325 C CB . GLN A 1 540 ? -3.851 -7.894 -3.054 1.00 76.82 ? 540 GLN A CB 1 ATOM 4326 C CG . GLN A 1 540 ? -5.301 -7.664 -3.404 1.00 74.95 ? 540 GLN A CG 1 ATOM 4327 C CD . GLN A 1 540 ? -6.241 -8.568 -2.651 1.00 74.37 ? 540 GLN A CD 1 ATOM 4328 O OE1 . GLN A 1 540 ? -5.817 -9.533 -2.013 1.00 73.71 ? 540 GLN A OE1 1 ATOM 4329 N NE2 . GLN A 1 540 ? -7.531 -8.271 -2.736 1.00 73.99 ? 540 GLN A NE2 1 ATOM 4330 N N . ARG A 1 541 ? -0.886 -8.526 -3.628 1.00 76.98 ? 541 ARG A N 1 ATOM 4331 C CA . ARG A 1 541 ? 0.490 -8.628 -3.160 1.00 76.99 ? 541 ARG A CA 1 ATOM 4332 C C . ARG A 1 541 ? 1.470 -7.814 -3.985 1.00 77.03 ? 541 ARG A C 1 ATOM 4333 O O . ARG A 1 541 ? 2.373 -7.199 -3.434 1.00 77.08 ? 541 ARG A O 1 ATOM 4334 C CB . ARG A 1 541 ? 0.931 -10.078 -3.035 1.00 76.99 ? 541 ARG A CB 1 ATOM 4335 C CG . ARG A 1 541 ? 0.411 -10.756 -1.773 1.00 77.95 ? 541 ARG A CG 1 ATOM 4336 C CD . ARG A 1 541 ? 0.962 -12.162 -1.530 1.00 82.27 ? 541 ARG A CD 1 ATOM 4337 N NE . ARG A 1 541 ? 0.851 -13.010 -2.719 1.00 83.06 ? 541 ARG A NE 1 ATOM 4338 C CZ . ARG A 1 541 ? 0.065 -14.070 -2.824 1.00 83.51 ? 541 ARG A CZ 1 ATOM 4339 N NH1 . ARG A 1 541 ? -0.705 -14.451 -1.809 1.00 82.47 ? 541 ARG A NH1 1 ATOM 4340 N NH2 . ARG A 1 541 ? 0.044 -14.752 -3.968 1.00 86.60 ? 541 ARG A NH2 1 ATOM 4341 N N . ASP A 1 542 ? 1.302 -7.790 -5.306 1.00 77.26 ? 542 ASP A N 1 ATOM 4342 C CA . ASP A 1 542 ? 2.204 -6.987 -6.136 1.00 76.83 ? 542 ASP A CA 1 ATOM 4343 C C . ASP A 1 542 ? 1.959 -5.485 -5.821 1.00 76.02 ? 542 ASP A C 1 ATOM 4344 O O . ASP A 1 542 ? 2.876 -4.644 -5.818 1.00 75.01 ? 542 ASP A O 1 ATOM 4345 C CB . ASP A 1 542 ? 1.988 -7.315 -7.622 1.00 77.51 ? 542 ASP A CB 1 ATOM 4346 C CG . ASP A 1 542 ? 2.771 -8.555 -8.089 1.00 78.84 ? 542 ASP A CG 1 ATOM 4347 O OD1 . ASP A 1 542 ? 4.026 -8.488 -8.182 1.00 80.99 ? 542 ASP A OD1 1 ATOM 4348 O OD2 . ASP A 1 542 ? 2.218 -9.630 -8.414 1.00 78.94 ? 542 ASP A OD2 1 ATOM 4349 N N . SER A 1 543 ? 0.703 -5.170 -5.522 1.00 74.95 ? 543 SER A N 1 ATOM 4350 C CA . SER A 1 543 ? 0.317 -3.813 -5.179 1.00 74.28 ? 543 SER A CA 1 ATOM 4351 C C . SER A 1 543 ? 0.860 -3.395 -3.783 1.00 73.62 ? 543 SER A C 1 ATOM 4352 O O . SER A 1 543 ? 1.256 -2.247 -3.607 1.00 73.42 ? 543 SER A O 1 ATOM 4353 C CB . SER A 1 543 ? -1.204 -3.698 -5.243 1.00 74.28 ? 543 SER A CB 1 ATOM 4354 O OG . SER A 1 543 ? -1.624 -2.434 -5.710 1.00 75.20 ? 543 SER A OG 1 ATOM 4355 N N . LEU A 1 544 ? 0.899 -4.337 -2.823 1.00 72.50 ? 544 LEU A N 1 ATOM 4356 C CA . LEU A 1 544 ? 1.406 -4.096 -1.450 1.00 70.78 ? 544 LEU A CA 1 ATOM 4357 C C . LEU A 1 544 ? 2.902 -3.937 -1.386 1.00 70.29 ? 544 LEU A C 1 ATOM 4358 O O . LEU A 1 544 ? 3.422 -3.258 -0.496 1.00 70.52 ? 544 LEU A O 1 ATOM 4359 C CB . LEU A 1 544 ? 1.112 -5.277 -0.529 1.00 70.29 ? 544 LEU A CB 1 ATOM 4360 C CG . LEU A 1 544 ? -0.282 -5.540 0.024 1.00 69.44 ? 544 LEU A CG 1 ATOM 4361 C CD1 . LEU A 1 544 ? -0.283 -6.718 1.001 1.00 65.94 ? 544 LEU A CD1 1 ATOM 4362 C CD2 . LEU A 1 544 ? -0.786 -4.278 0.711 1.00 69.65 ? 544 LEU A CD2 1 ATOM 4363 N N . GLN A 1 545 ? 3.607 -4.604 -2.292 1.00 69.48 ? 545 GLN A N 1 ATOM 4364 C CA . GLN A 1 545 ? 5.069 -4.573 -2.267 1.00 68.96 ? 545 GLN A CA 1 ATOM 4365 C C . GLN A 1 545 ? 5.650 -3.160 -2.412 1.00 68.24 ? 545 GLN A C 1 ATOM 4366 O O . GLN A 1 545 ? 6.827 -2.950 -2.170 1.00 67.85 ? 545 GLN A O 1 ATOM 4367 C CB . GLN A 1 545 ? 5.676 -5.562 -3.282 1.00 69.07 ? 545 GLN A CB 1 ATOM 4368 C CG . GLN A 1 545 ? 6.193 -6.878 -2.653 1.00 70.04 ? 545 GLN A CG 1 ATOM 4369 C CD . GLN A 1 545 ? 6.086 -8.113 -3.597 1.00 72.25 ? 545 GLN A CD 1 ATOM 4370 O OE1 . GLN A 1 545 ? 5.750 -9.219 -3.151 1.00 71.20 ? 545 GLN A OE1 1 ATOM 4371 N NE2 . GLN A 1 545 ? 6.385 -7.918 -4.886 1.00 72.33 ? 545 GLN A NE2 1 ATOM 4372 N N . LYS A 1 546 ? 4.818 -2.183 -2.762 1.00 67.67 ? 546 LYS A N 1 ATOM 4373 C CA . LYS A 1 546 ? 5.328 -0.823 -2.962 1.00 67.09 ? 546 LYS A CA 1 ATOM 4374 C C . LYS A 1 546 ? 5.116 0.206 -1.811 1.00 65.97 ? 546 LYS A C 1 ATOM 4375 O O . LYS A 1 546 ? 5.565 1.342 -1.927 1.00 65.97 ? 546 LYS A O 1 ATOM 4376 C CB . LYS A 1 546 ? 4.831 -0.262 -4.315 1.00 67.84 ? 546 LYS A CB 1 ATOM 4377 C CG . LYS A 1 546 ? 5.295 -1.065 -5.565 1.00 69.61 ? 546 LYS A CG 1 ATOM 4378 C CD . LYS A 1 546 ? 4.448 -0.780 -6.830 1.00 72.83 ? 546 LYS A CD 1 ATOM 4379 C CE . LYS A 1 546 ? 5.129 0.199 -7.834 1.00 75.34 ? 546 LYS A CE 1 ATOM 4380 N NZ . LYS A 1 546 ? 5.991 -0.476 -8.883 1.00 76.01 ? 546 LYS A NZ 1 ATOM 4381 N N . VAL A 1 547 ? 4.479 -0.173 -0.699 1.00 64.61 ? 547 VAL A N 1 ATOM 4382 C CA . VAL A 1 547 ? 4.256 0.798 0.390 1.00 63.04 ? 547 VAL A CA 1 ATOM 4383 C C . VAL A 1 547 ? 5.561 1.270 0.978 1.00 61.56 ? 547 VAL A C 1 ATOM 4384 O O . VAL A 1 547 ? 6.538 0.531 1.053 1.00 60.93 ? 547 VAL A O 1 ATOM 4385 C CB . VAL A 1 547 ? 3.419 0.254 1.564 1.00 63.35 ? 547 VAL A CB 1 ATOM 4386 C CG1 . VAL A 1 547 ? 1.983 0.003 1.156 1.00 64.08 ? 547 VAL A CG1 1 ATOM 4387 C CG2 . VAL A 1 547 ? 4.063 -0.970 2.140 1.00 63.61 ? 547 VAL A CG2 1 ATOM 4388 N N . SER A 1 548 ? 5.547 2.508 1.430 1.00 60.61 ? 548 SER A N 1 ATOM 4389 C CA . SER A 1 548 ? 6.728 3.130 1.948 1.00 60.70 ? 548 SER A CA 1 ATOM 4390 C C . SER A 1 548 ? 6.262 3.980 3.082 1.00 60.02 ? 548 SER A C 1 ATOM 4391 O O . SER A 1 548 ? 5.163 4.486 3.044 1.00 59.69 ? 548 SER A O 1 ATOM 4392 C CB . SER A 1 548 ? 7.241 4.071 0.880 1.00 60.70 ? 548 SER A CB 1 ATOM 4393 O OG . SER A 1 548 ? 6.124 4.648 0.213 1.00 60.25 ? 548 SER A OG 1 ATOM 4394 N N . PHE A 1 549 ? 7.096 4.206 4.083 1.00 60.30 ? 549 PHE A N 1 ATOM 4395 C CA . PHE A 1 549 ? 6.712 5.144 5.115 1.00 61.16 ? 549 PHE A CA 1 ATOM 4396 C C . PHE A 1 549 ? 6.842 6.556 4.551 1.00 61.07 ? 549 PHE A C 1 ATOM 4397 O O . PHE A 1 549 ? 6.788 7.510 5.314 1.00 61.82 ? 549 PHE A O 1 ATOM 4398 C CB . PHE A 1 549 ? 7.568 5.016 6.386 1.00 60.30 ? 549 PHE A CB 1 ATOM 4399 C CG . PHE A 1 549 ? 6.917 5.594 7.620 1.00 60.91 ? 549 PHE A CG 1 ATOM 4400 C CD1 . PHE A 1 549 ? 6.650 4.793 8.717 1.00 61.77 ? 549 PHE A CD1 1 ATOM 4401 C CD2 . PHE A 1 549 ? 6.601 6.932 7.703 1.00 59.74 ? 549 PHE A CD2 1 ATOM 4402 C CE1 . PHE A 1 549 ? 6.074 5.317 9.844 1.00 61.82 ? 549 PHE A CE1 1 ATOM 4403 C CE2 . PHE A 1 549 ? 6.018 7.453 8.834 1.00 61.71 ? 549 PHE A CE2 1 ATOM 4404 C CZ . PHE A 1 549 ? 5.748 6.641 9.899 1.00 61.52 ? 549 PHE A CZ 1 ATOM 4405 N N . SER A 1 550 ? 7.025 6.695 3.257 1.00 61.78 ? 550 SER A N 1 ATOM 4406 C CA . SER A 1 550 ? 7.109 8.039 2.668 1.00 62.22 ? 550 SER A CA 1 ATOM 4407 C C . SER A 1 550 ? 5.830 8.278 1.908 1.00 62.19 ? 550 SER A C 1 ATOM 4408 O O . SER A 1 550 ? 5.547 9.349 1.378 1.00 62.83 ? 550 SER A O 1 ATOM 4409 C CB . SER A 1 550 ? 8.304 8.184 1.729 1.00 62.29 ? 550 SER A CB 1 ATOM 4410 O OG . SER A 1 550 ? 9.272 7.178 1.964 1.00 62.98 ? 550 SER A OG 1 ATOM 4411 N N . ARG A 1 551 ? 5.080 7.197 1.850 1.00 61.56 ? 551 ARG A N 1 ATOM 4412 C CA . ARG A 1 551 ? 3.813 7.168 1.191 1.00 61.26 ? 551 ARG A CA 1 ATOM 4413 C C . ARG A 1 551 ? 2.782 7.558 2.212 1.00 61.06 ? 551 ARG A C 1 ATOM 4414 O O . ARG A 1 551 ? 1.986 8.461 2.003 1.00 61.05 ? 551 ARG A O 1 ATOM 4415 C CB . ARG A 1 551 ? 3.573 5.795 0.570 1.00 61.23 ? 551 ARG A CB 1 ATOM 4416 C CG . ARG A 1 551 ? 2.894 5.698 -0.806 1.00 63.53 ? 551 ARG A CG 1 ATOM 4417 C CD . ARG A 1 551 ? 3.367 6.747 -1.788 1.00 65.98 ? 551 ARG A CD 1 ATOM 4418 N NE . ARG A 1 551 ? 2.572 7.954 -1.648 1.00 68.66 ? 551 ARG A NE 1 ATOM 4419 C CZ . ARG A 1 551 ? 2.248 8.836 -2.597 1.00 70.04 ? 551 ARG A CZ 1 ATOM 4420 N NH1 . ARG A 1 551 ? 2.646 8.660 -3.860 1.00 70.65 ? 551 ARG A NH1 1 ATOM 4421 N NH2 . ARG A 1 551 ? 1.522 9.908 -2.271 1.00 69.55 ? 551 ARG A NH2 1 ATOM 4422 N N . LEU A 1 552 ? 2.803 6.873 3.329 1.00 60.15 ? 552 LEU A N 1 ATOM 4423 C CA . LEU A 1 552 ? 1.908 7.134 4.408 1.00 60.62 ? 552 LEU A CA 1 ATOM 4424 C C . LEU A 1 552 ? 1.852 8.563 4.750 1.00 60.24 ? 552 LEU A C 1 ATOM 4425 O O . LEU A 1 552 ? 0.824 9.182 4.969 1.00 59.71 ? 552 LEU A O 1 ATOM 4426 C CB . LEU A 1 552 ? 2.413 6.339 5.590 1.00 60.07 ? 552 LEU A CB 1 ATOM 4427 C CG . LEU A 1 552 ? 1.608 6.496 6.850 1.00 59.37 ? 552 LEU A CG 1 ATOM 4428 C CD1 . LEU A 1 552 ? 0.555 5.402 6.927 1.00 59.61 ? 552 LEU A CD1 1 ATOM 4429 C CD2 . LEU A 1 552 ? 2.513 6.476 8.087 1.00 61.72 ? 552 LEU A CD2 1 ATOM 4430 N N . ILE A 1 553 ? 3.088 9.057 4.791 1.00 61.13 ? 553 ILE A N 1 ATOM 4431 C CA . ILE A 1 553 ? 3.315 10.452 5.088 1.00 61.08 ? 553 ILE A CA 1 ATOM 4432 C C . ILE A 1 553 ? 2.637 11.354 4.057 1.00 62.11 ? 553 ILE A C 1 ATOM 4433 O O . ILE A 1 553 ? 1.917 12.285 4.404 1.00 61.90 ? 553 ILE A O 1 ATOM 4434 C CB . ILE A 1 553 ? 4.790 10.809 5.143 1.00 60.25 ? 553 ILE A CB 1 ATOM 4435 C CG1 . ILE A 1 553 ? 5.459 10.065 6.287 1.00 59.12 ? 553 ILE A CG1 1 ATOM 4436 C CG2 . ILE A 1 553 ? 4.968 12.309 5.287 1.00 60.87 ? 553 ILE A CG2 1 ATOM 4437 C CD1 . ILE A 1 553 ? 6.937 10.347 6.412 1.00 58.74 ? 553 ILE A CD1 1 ATOM 4438 N N . CYS A 1 554 ? 2.878 11.079 2.762 1.00 63.49 ? 554 CYS A N 1 ATOM 4439 C CA . CYS A 1 554 ? 2.254 11.925 1.734 1.00 65.27 ? 554 CYS A CA 1 ATOM 4440 C C . CYS A 1 554 ? 0.749 11.755 1.737 1.00 64.51 ? 554 CYS A C 1 ATOM 4441 O O . CYS A 1 554 ? 0.016 12.742 1.789 1.00 64.92 ? 554 CYS A O 1 ATOM 4442 C CB . CYS A 1 554 ? 2.784 11.635 0.327 1.00 66.54 ? 554 CYS A CB 1 ATOM 4443 S SG . CYS A 1 554 ? 4.506 12.065 0.093 1.00 72.19 ? 554 CYS A SG 1 ATOM 4444 N N . ASP A 1 555 ? 0.279 10.521 1.682 1.00 63.58 ? 555 ASP A N 1 ATOM 4445 C CA . ASP A 1 555 ? -1.150 10.292 1.657 1.00 63.53 ? 555 ASP A CA 1 ATOM 4446 C C . ASP A 1 555 ? -1.860 10.833 2.901 1.00 62.46 ? 555 ASP A C 1 ATOM 4447 O O . ASP A 1 555 ? -3.068 11.012 2.885 1.00 61.57 ? 555 ASP A O 1 ATOM 4448 C CB . ASP A 1 555 ? -1.426 8.777 1.514 1.00 64.11 ? 555 ASP A CB 1 ATOM 4449 C CG . ASP A 1 555 ? -0.913 8.214 0.200 1.00 66.45 ? 555 ASP A CG 1 ATOM 4450 O OD1 . ASP A 1 555 ? -0.730 9.042 -0.732 1.00 68.24 ? 555 ASP A OD1 1 ATOM 4451 O OD2 . ASP A 1 555 ? -0.677 6.988 0.012 1.00 65.44 ? 555 ASP A OD2 1 ATOM 4452 N N . ASN A 1 556 ? -1.124 11.112 3.974 1.00 62.17 ? 556 ASN A N 1 ATOM 4453 C CA . ASN A 1 556 ? -1.782 11.398 5.259 1.00 61.85 ? 556 ASN A CA 1 ATOM 4454 C C . ASN A 1 556 ? -1.366 12.670 6.024 1.00 62.25 ? 556 ASN A C 1 ATOM 4455 O O . ASN A 1 556 ? -1.675 12.834 7.206 1.00 61.23 ? 556 ASN A O 1 ATOM 4456 C CB . ASN A 1 556 ? -1.662 10.162 6.165 1.00 61.18 ? 556 ASN A CB 1 ATOM 4457 C CG . ASN A 1 556 ? -2.462 8.979 5.647 1.00 59.10 ? 556 ASN A CG 1 ATOM 4458 O OD1 . ASN A 1 556 ? -3.677 9.038 5.604 1.00 59.91 ? 556 ASN A OD1 1 ATOM 4459 N ND2 . ASN A 1 556 ? -1.789 7.899 5.273 1.00 56.74 ? 556 ASN A ND2 1 ATOM 4460 N N . THR A 1 557 ? -0.666 13.567 5.339 1.00 62.96 ? 557 THR A N 1 ATOM 4461 C CA . THR A 1 557 ? -0.253 14.834 5.924 1.00 63.07 ? 557 THR A CA 1 ATOM 4462 C C . THR A 1 557 ? -0.172 15.752 4.729 1.00 64.28 ? 557 THR A C 1 ATOM 4463 O O . THR A 1 557 ? -0.394 15.309 3.611 1.00 63.73 ? 557 THR A O 1 ATOM 4464 C CB . THR A 1 557 ? 1.152 14.710 6.523 1.00 63.32 ? 557 THR A CB 1 ATOM 4465 O OG1 . THR A 1 557 ? 2.116 14.689 5.454 1.00 62.51 ? 557 THR A OG1 1 ATOM 4466 C CG2 . THR A 1 557 ? 1.347 13.351 7.215 1.00 60.62 ? 557 THR A CG2 1 ATOM 4467 N N . HIS A 1 558 ? 0.165 17.015 4.936 1.00 65.21 ? 558 HIS A N 1 ATOM 4468 C CA . HIS A 1 558 ? 0.329 17.910 3.794 1.00 66.88 ? 558 HIS A CA 1 ATOM 4469 C C . HIS A 1 558 ? 1.810 18.172 3.582 1.00 67.27 ? 558 HIS A C 1 ATOM 4470 O O . HIS A 1 558 ? 2.224 19.321 3.397 1.00 67.61 ? 558 HIS A O 1 ATOM 4471 C CB . HIS A 1 558 ? -0.419 19.243 3.994 1.00 67.09 ? 558 HIS A CB 1 ATOM 4472 C CG . HIS A 1 558 ? -1.917 19.138 3.910 1.00 68.63 ? 558 HIS A CG 1 ATOM 4473 N ND1 . HIS A 1 558 ? -2.750 19.530 4.940 1.00 69.28 ? 558 HIS A ND1 1 ATOM 4474 C CD2 . HIS A 1 558 ? -2.733 18.717 2.910 1.00 70.81 ? 558 HIS A CD2 1 ATOM 4475 C CE1 . HIS A 1 558 ? -4.012 19.354 4.583 1.00 69.85 ? 558 HIS A CE1 1 ATOM 4476 N NE2 . HIS A 1 558 ? -4.031 18.865 3.353 1.00 72.62 ? 558 HIS A NE2 1 ATOM 4477 N N . ILE A 1 559 ? 2.606 17.078 3.659 1.00 67.90 ? 559 ILE A N 1 ATOM 4478 C CA . ILE A 1 559 ? 4.041 17.125 3.446 1.00 68.21 ? 559 ILE A CA 1 ATOM 4479 C C . ILE A 1 559 ? 4.202 16.733 2.003 1.00 69.27 ? 559 ILE A C 1 ATOM 4480 O O . ILE A 1 559 ? 3.587 15.767 1.549 1.00 69.36 ? 559 ILE A O 1 ATOM 4481 C CB . ILE A 1 559 ? 4.803 16.179 4.391 1.00 68.25 ? 559 ILE A CB 1 ATOM 4482 C CG1 . ILE A 1 559 ? 4.447 16.659 5.781 1.00 69.23 ? 559 ILE A CG1 1 ATOM 4483 C CG2 . ILE A 1 559 ? 6.309 16.211 4.174 1.00 66.82 ? 559 ILE A CG2 1 ATOM 4484 C CD1 . ILE A 1 559 ? 4.833 15.687 6.873 1.00 70.13 ? 559 ILE A CD1 1 ATOM 4485 N N . THR A 1 560 ? 5.021 17.473 1.240 1.00 69.81 ? 560 THR A N 1 ATOM 4486 C CA . THR A 1 560 ? 5.162 17.159 -0.181 1.00 70.55 ? 560 THR A CA 1 ATOM 4487 C C . THR A 1 560 ? 6.573 16.802 -0.607 1.00 70.96 ? 560 THR A C 1 ATOM 4488 O O . THR A 1 560 ? 6.811 16.452 -1.789 1.00 71.34 ? 560 THR A O 1 ATOM 4489 C CB . THR A 1 560 ? 4.678 18.353 -1.038 1.00 71.16 ? 560 THR A CB 1 ATOM 4490 O OG1 . THR A 1 560 ? 5.252 19.574 -0.544 1.00 69.65 ? 560 THR A OG1 1 ATOM 4491 C CG2 . THR A 1 560 ? 3.201 18.558 -0.849 1.00 71.07 ? 560 THR A CG2 1 ATOM 4492 N N . LYS A 1 561 ? 7.489 16.927 0.352 1.00 71.07 ? 561 LYS A N 1 ATOM 4493 C CA . LYS A 1 561 ? 8.898 16.633 0.155 1.00 72.12 ? 561 LYS A CA 1 ATOM 4494 C C . LYS A 1 561 ? 9.329 15.597 1.195 1.00 71.97 ? 561 LYS A C 1 ATOM 4495 O O . LYS A 1 561 ? 9.343 15.904 2.390 1.00 72.22 ? 561 LYS A O 1 ATOM 4496 C CB . LYS A 1 561 ? 9.713 17.912 0.312 1.00 72.85 ? 561 LYS A CB 1 ATOM 4497 C CG . LYS A 1 561 ? 9.316 19.037 -0.675 1.00 75.29 ? 561 LYS A CG 1 ATOM 4498 C CD . LYS A 1 561 ? 9.551 18.597 -2.123 1.00 78.89 ? 561 LYS A CD 1 ATOM 4499 C CE . LYS A 1 561 ? 9.145 19.667 -3.159 1.00 81.00 ? 561 LYS A CE 1 ATOM 4500 N NZ . LYS A 1 561 ? 8.996 19.077 -4.546 1.00 79.98 ? 561 LYS A NZ 1 ATOM 4501 N N . VAL A 1 562 ? 9.683 14.389 0.754 1.00 71.09 ? 562 VAL A N 1 ATOM 4502 C CA . VAL A 1 562 ? 10.027 13.358 1.694 1.00 70.27 ? 562 VAL A CA 1 ATOM 4503 C C . VAL A 1 562 ? 11.191 12.528 1.291 1.00 69.31 ? 562 VAL A C 1 ATOM 4504 O O . VAL A 1 562 ? 11.708 12.576 0.174 1.00 70.47 ? 562 VAL A O 1 ATOM 4505 C CB . VAL A 1 562 ? 8.833 12.410 1.892 1.00 70.57 ? 562 VAL A CB 1 ATOM 4506 C CG1 . VAL A 1 562 ? 7.621 13.177 2.381 1.00 70.27 ? 562 VAL A CG1 1 ATOM 4507 C CG2 . VAL A 1 562 ? 8.513 11.682 0.588 1.00 70.62 ? 562 VAL A CG2 1 ATOM 4508 N N . PRO A 1 563 ? 11.612 11.745 2.280 1.00 68.38 ? 563 PRO A N 1 ATOM 4509 C CA . PRO A 1 563 ? 12.678 10.774 2.042 1.00 67.93 ? 563 PRO A CA 1 ATOM 4510 C C . PRO A 1 563 ? 12.272 9.784 1.009 1.00 67.93 ? 563 PRO A C 1 ATOM 4511 O O . PRO A 1 563 ? 11.132 9.767 0.561 1.00 68.33 ? 563 PRO A O 1 ATOM 4512 C CB . PRO A 1 563 ? 12.950 10.159 3.391 1.00 68.79 ? 563 PRO A CB 1 ATOM 4513 C CG . PRO A 1 563 ? 12.785 11.334 4.297 1.00 68.58 ? 563 PRO A CG 1 ATOM 4514 C CD . PRO A 1 563 ? 11.943 12.370 3.570 1.00 68.71 ? 563 PRO A CD 1 ATOM 4515 N N . LEU A 1 564 ? 13.197 8.991 0.626 1.00 67.21 ? 564 LEU A N 1 ATOM 4516 C CA . LEU A 1 564 ? 12.857 7.889 -0.215 1.00 66.59 ? 564 LEU A CA 1 ATOM 4517 C C . LEU A 1 564 ? 13.003 6.741 0.719 1.00 65.42 ? 564 LEU A C 1 ATOM 4518 O O . LEU A 1 564 ? 12.225 5.783 0.682 1.00 64.91 ? 564 LEU A O 1 ATOM 4519 C CB . LEU A 1 564 ? 13.873 7.780 -1.354 1.00 67.10 ? 564 LEU A CB 1 ATOM 4520 C CG . LEU A 1 564 ? 13.392 7.297 -2.722 1.00 68.52 ? 564 LEU A CG 1 ATOM 4521 C CD1 . LEU A 1 564 ? 11.933 7.626 -2.927 1.00 68.73 ? 564 LEU A CD1 1 ATOM 4522 C CD2 . LEU A 1 564 ? 14.226 7.898 -3.840 1.00 69.10 ? 564 LEU A CD2 1 ATOM 4523 N N . HIS A 1 565 ? 14.026 6.868 1.587 1.00 64.30 ? 565 HIS A N 1 ATOM 4524 C CA . HIS A 1 565 ? 14.353 5.845 2.567 1.00 63.73 ? 565 HIS A CA 1 ATOM 4525 C C . HIS A 1 565 ? 14.320 6.513 3.935 1.00 62.33 ? 565 HIS A C 1 ATOM 4526 O O . HIS A 1 565 ? 15.316 7.053 4.411 1.00 61.98 ? 565 HIS A O 1 ATOM 4527 C CB . HIS A 1 565 ? 15.713 5.252 2.240 1.00 63.78 ? 565 HIS A CB 1 ATOM 4528 C CG . HIS A 1 565 ? 15.755 4.573 0.905 1.00 65.83 ? 565 HIS A CG 1 ATOM 4529 N ND1 . HIS A 1 565 ? 14.948 3.494 0.598 1.00 69.23 ? 565 HIS A ND1 1 ATOM 4530 C CD2 . HIS A 1 565 ? 16.516 4.794 -0.190 1.00 65.11 ? 565 HIS A CD2 1 ATOM 4531 C CE1 . HIS A 1 565 ? 15.192 3.104 -0.637 1.00 65.58 ? 565 HIS A CE1 1 ATOM 4532 N NE2 . HIS A 1 565 ? 16.141 3.876 -1.134 1.00 62.97 ? 565 HIS A NE2 1 ATOM 4533 N N . ALA A 1 566 ? 13.143 6.469 4.549 1.00 61.44 ? 566 ALA A N 1 ATOM 4534 C CA . ALA A 1 566 ? 12.853 7.178 5.790 1.00 60.55 ? 566 ALA A CA 1 ATOM 4535 C C . ALA A 1 566 ? 13.576 6.769 7.047 1.00 59.95 ? 566 ALA A C 1 ATOM 4536 O O . ALA A 1 566 ? 13.663 7.538 7.984 1.00 59.62 ? 566 ALA A O 1 ATOM 4537 C CB . ALA A 1 566 ? 11.370 7.210 6.036 1.00 61.36 ? 566 ALA A CB 1 ATOM 4538 N N . PHE A 1 567 ? 14.108 5.573 7.114 1.00 59.31 ? 567 PHE A N 1 ATOM 4539 C CA . PHE A 1 567 ? 14.788 5.258 8.363 1.00 59.57 ? 567 PHE A CA 1 ATOM 4540 C C . PHE A 1 567 ? 16.247 5.736 8.445 1.00 59.77 ? 567 PHE A C 1 ATOM 4541 O O . PHE A 1 567 ? 16.789 5.936 9.535 1.00 59.23 ? 567 PHE A O 1 ATOM 4542 C CB . PHE A 1 567 ? 14.632 3.791 8.694 1.00 58.94 ? 567 PHE A CB 1 ATOM 4543 C CG . PHE A 1 567 ? 13.224 3.411 8.969 1.00 58.65 ? 567 PHE A CG 1 ATOM 4544 C CD1 . PHE A 1 567 ? 12.380 4.288 9.641 1.00 57.65 ? 567 PHE A CD1 1 ATOM 4545 C CD2 . PHE A 1 567 ? 12.721 2.202 8.555 1.00 56.49 ? 567 PHE A CD2 1 ATOM 4546 C CE1 . PHE A 1 567 ? 11.070 3.945 9.904 1.00 56.06 ? 567 PHE A CE1 1 ATOM 4547 C CE2 . PHE A 1 567 ? 11.410 1.868 8.836 1.00 57.40 ? 567 PHE A CE2 1 ATOM 4548 C CZ . PHE A 1 567 ? 10.590 2.745 9.510 1.00 54.23 ? 567 PHE A CZ 1 ATOM 4549 N N . GLN A 1 568 ? 16.858 5.987 7.306 1.00 59.93 ? 568 GLN A N 1 ATOM 4550 C CA . GLN A 1 568 ? 18.241 6.459 7.312 1.00 61.65 ? 568 GLN A CA 1 ATOM 4551 C C . GLN A 1 568 ? 18.340 7.980 7.626 1.00 61.44 ? 568 GLN A C 1 ATOM 4552 O O . GLN A 1 568 ? 17.354 8.711 7.573 1.00 60.61 ? 568 GLN A O 1 ATOM 4553 C CB . GLN A 1 568 ? 18.899 6.111 5.956 1.00 61.73 ? 568 GLN A CB 1 ATOM 4554 C CG . GLN A 1 568 ? 18.278 6.881 4.842 1.00 65.27 ? 568 GLN A CG 1 ATOM 4555 C CD . GLN A 1 568 ? 18.616 6.378 3.452 1.00 72.28 ? 568 GLN A CD 1 ATOM 4556 O OE1 . GLN A 1 568 ? 18.385 5.191 3.113 1.00 74.47 ? 568 GLN A OE1 1 ATOM 4557 N NE2 . GLN A 1 568 ? 19.129 7.294 2.615 1.00 72.67 ? 568 GLN A NE2 1 ATOM 4558 N N . ALA A 1 569 ? 19.515 8.454 8.000 1.00 62.60 ? 569 ALA A N 1 ATOM 4559 C CA . ALA A 1 569 ? 19.677 9.891 8.266 1.00 64.29 ? 569 ALA A CA 1 ATOM 4560 C C . ALA A 1 569 ? 19.450 10.626 6.953 1.00 65.74 ? 569 ALA A C 1 ATOM 4561 O O . ALA A 1 569 ? 20.163 10.368 5.968 1.00 66.37 ? 569 ALA A O 1 ATOM 4562 C CB . ALA A 1 569 ? 21.057 10.171 8.762 1.00 64.38 ? 569 ALA A CB 1 ATOM 4563 N N . ASN A 1 570 ? 18.450 11.504 6.915 1.00 66.54 ? 570 ASN A N 1 ATOM 4564 C CA . ASN A 1 570 ? 18.116 12.219 5.686 1.00 67.65 ? 570 ASN A CA 1 ATOM 4565 C C . ASN A 1 570 ? 18.169 13.730 5.858 1.00 68.36 ? 570 ASN A C 1 ATOM 4566 O O . ASN A 1 570 ? 17.558 14.288 6.764 1.00 67.99 ? 570 ASN A O 1 ATOM 4567 C CB . ASN A 1 570 ? 16.748 11.804 5.154 1.00 67.37 ? 570 ASN A CB 1 ATOM 4568 C CG . ASN A 1 570 ? 16.794 10.511 4.342 1.00 69.39 ? 570 ASN A CG 1 ATOM 4569 O OD1 . ASN A 1 570 ? 17.274 10.484 3.199 1.00 70.41 ? 570 ASN A OD1 1 ATOM 4570 N ND2 . ASN A 1 570 ? 16.276 9.430 4.925 1.00 71.05 ? 570 ASN A ND2 1 ATOM 4571 N N . ASN A 1 571 ? 18.905 14.392 4.972 1.00 69.28 ? 571 ASN A N 1 ATOM 4572 C CA . ASN A 1 571 ? 19.043 15.843 5.044 1.00 69.99 ? 571 ASN A CA 1 ATOM 4573 C C . ASN A 1 571 ? 18.371 16.544 3.873 1.00 70.61 ? 571 ASN A C 1 ATOM 4574 O O . ASN A 1 571 ? 18.481 16.096 2.728 1.00 70.63 ? 571 ASN A O 1 ATOM 4575 C CB . ASN A 1 571 ? 20.510 16.217 5.173 1.00 69.42 ? 571 ASN A CB 1 ATOM 4576 C CG . ASN A 1 571 ? 21.097 15.797 6.508 1.00 70.14 ? 571 ASN A CG 1 ATOM 4577 O OD1 . ASN A 1 571 ? 20.524 16.061 7.586 1.00 65.16 ? 571 ASN A OD1 1 ATOM 4578 N ND2 . ASN A 1 571 ? 22.251 15.136 6.450 1.00 71.33 ? 571 ASN A ND2 1 ATOM 4579 N N . TYR A 1 572 ? 17.658 17.626 4.179 1.00 71.91 ? 572 TYR A N 1 ATOM 4580 C CA . TYR A 1 572 ? 16.866 18.390 3.202 1.00 73.14 ? 572 TYR A CA 1 ATOM 4581 C C . TYR A 1 572 ? 17.600 19.658 2.772 1.00 73.88 ? 572 TYR A C 1 ATOM 4582 O O . TYR A 1 572 ? 18.245 20.313 3.601 1.00 73.35 ? 572 TYR A O 1 ATOM 4583 C CB . TYR A 1 572 ? 15.515 18.754 3.819 1.00 73.38 ? 572 TYR A CB 1 ATOM 4584 C CG . TYR A 1 572 ? 14.633 19.561 2.924 1.00 74.67 ? 572 TYR A CG 1 ATOM 4585 C CD1 . TYR A 1 572 ? 13.662 18.945 2.139 1.00 77.38 ? 572 TYR A CD1 1 ATOM 4586 C CD2 . TYR A 1 572 ? 14.772 20.942 2.840 1.00 76.22 ? 572 TYR A CD2 1 ATOM 4587 C CE1 . TYR A 1 572 ? 12.846 19.683 1.301 1.00 78.96 ? 572 TYR A CE1 1 ATOM 4588 C CE2 . TYR A 1 572 ? 13.952 21.695 2.008 1.00 78.11 ? 572 TYR A CE2 1 ATOM 4589 C CZ . TYR A 1 572 ? 12.995 21.058 1.239 1.00 79.59 ? 572 TYR A CZ 1 ATOM 4590 O OH . TYR A 1 572 ? 12.181 21.795 0.407 1.00 80.55 ? 572 TYR A OH 1 ATOM 4591 N N . PRO A 1 573 ? 17.446 20.074 1.519 1.00 74.51 ? 573 PRO A N 1 ATOM 4592 C CA . PRO A 1 573 ? 16.514 19.509 0.537 1.00 75.22 ? 573 PRO A CA 1 ATOM 4593 C C . PRO A 1 573 ? 17.084 18.392 -0.343 1.00 76.03 ? 573 PRO A C 1 ATOM 4594 O O . PRO A 1 573 ? 16.356 17.858 -1.190 1.00 75.86 ? 573 PRO A O 1 ATOM 4595 C CB . PRO A 1 573 ? 16.198 20.722 -0.351 1.00 75.30 ? 573 PRO A CB 1 ATOM 4596 C CG . PRO A 1 573 ? 17.052 21.901 0.260 1.00 75.26 ? 573 PRO A CG 1 ATOM 4597 C CD . PRO A 1 573 ? 18.181 21.219 0.965 1.00 74.99 ? 573 PRO A CD 1 ATOM 4598 N N . HIS A 1 574 ? 18.349 18.045 -0.127 1.00 76.46 ? 574 HIS A N 1 ATOM 4599 C CA . HIS A 1 574 ? 19.069 17.062 -0.936 1.00 77.79 ? 574 HIS A CA 1 ATOM 4600 C C . HIS A 1 574 ? 18.455 15.658 -1.012 1.00 77.75 ? 574 HIS A C 1 ATOM 4601 O O . HIS A 1 574 ? 18.234 15.126 -2.108 1.00 77.43 ? 574 HIS A O 1 ATOM 4602 C CB . HIS A 1 574 ? 20.507 16.952 -0.440 1.00 78.30 ? 574 HIS A CB 1 ATOM 4603 C CG . HIS A 1 574 ? 21.306 15.913 -1.163 1.00 82.37 ? 574 HIS A CG 1 ATOM 4604 N ND1 . HIS A 1 574 ? 22.606 15.593 -0.821 1.00 84.52 ? 574 HIS A ND1 1 ATOM 4605 C CD2 . HIS A 1 574 ? 20.986 15.117 -2.215 1.00 84.92 ? 574 HIS A CD2 1 ATOM 4606 C CE1 . HIS A 1 574 ? 23.050 14.647 -1.634 1.00 86.95 ? 574 HIS A CE1 1 ATOM 4607 N NE2 . HIS A 1 574 ? 22.086 14.338 -2.486 1.00 86.60 ? 574 HIS A NE2 1 ATOM 4608 N N . ASP A 1 575 ? 18.203 15.060 0.154 1.00 77.65 ? 575 ASP A N 1 ATOM 4609 C CA . ASP A 1 575 ? 17.595 13.735 0.232 1.00 77.50 ? 575 ASP A CA 1 ATOM 4610 C C . ASP A 1 575 ? 16.060 13.770 0.189 1.00 77.30 ? 575 ASP A C 1 ATOM 4611 O O . ASP A 1 575 ? 15.412 12.757 0.377 1.00 77.47 ? 575 ASP A O 1 ATOM 4612 C CB . ASP A 1 575 ? 18.091 12.991 1.476 1.00 77.68 ? 575 ASP A CB 1 ATOM 4613 C CG . ASP A 1 575 ? 19.603 12.832 1.497 1.00 77.91 ? 575 ASP A CG 1 ATOM 4614 O OD1 . ASP A 1 575 ? 20.199 12.582 0.428 1.00 79.02 ? 575 ASP A OD1 1 ATOM 4615 O OD2 . ASP A 1 575 ? 20.284 12.917 2.538 1.00 80.44 ? 575 ASP A OD2 1 ATOM 4616 N N . PHE A 1 576 ? 15.467 14.927 -0.068 1.00 77.45 ? 576 PHE A N 1 ATOM 4617 C CA . PHE A 1 576 ? 14.000 14.992 -0.132 1.00 77.76 ? 576 PHE A CA 1 ATOM 4618 C C . PHE A 1 576 ? 13.479 15.206 -1.564 1.00 78.56 ? 576 PHE A C 1 ATOM 4619 O O . PHE A 1 576 ? 13.856 16.163 -2.252 1.00 79.60 ? 576 PHE A O 1 ATOM 4620 C CB . PHE A 1 576 ? 13.434 16.049 0.825 1.00 77.23 ? 576 PHE A CB 1 ATOM 4621 C CG . PHE A 1 576 ? 13.598 15.704 2.281 1.00 74.41 ? 576 PHE A CG 1 ATOM 4622 C CD1 . PHE A 1 576 ? 14.832 15.338 2.786 1.00 71.50 ? 576 PHE A CD1 1 ATOM 4623 C CD2 . PHE A 1 576 ? 12.517 15.769 3.148 1.00 70.81 ? 576 PHE A CD2 1 ATOM 4624 C CE1 . PHE A 1 576 ? 14.983 15.055 4.124 1.00 73.03 ? 576 PHE A CE1 1 ATOM 4625 C CE2 . PHE A 1 576 ? 12.656 15.466 4.477 1.00 68.94 ? 576 PHE A CE2 1 ATOM 4626 C CZ . PHE A 1 576 ? 13.879 15.112 4.973 1.00 70.70 ? 576 PHE A CZ 1 ATOM 4627 N N . VAL A 1 577 ? 12.608 14.311 -2.002 1.00 78.49 ? 577 VAL A N 1 ATOM 4628 C CA . VAL A 1 577 ? 12.079 14.386 -3.339 1.00 78.95 ? 577 VAL A CA 1 ATOM 4629 C C . VAL A 1 577 ? 10.592 14.661 -3.237 1.00 79.61 ? 577 VAL A C 1 ATOM 4630 O O . VAL A 1 577 ? 10.013 14.578 -2.140 1.00 80.02 ? 577 VAL A O 1 ATOM 4631 C CB . VAL A 1 577 ? 12.306 13.059 -4.085 1.00 78.96 ? 577 VAL A CB 1 ATOM 4632 C CG1 . VAL A 1 577 ? 13.741 12.613 -3.925 1.00 78.60 ? 577 VAL A CG1 1 ATOM 4633 C CG2 . VAL A 1 577 ? 11.375 11.981 -3.551 1.00 78.73 ? 577 VAL A CG2 1 ATOM 4634 N N . ASP A 1 578 ? 9.972 14.979 -4.368 1.00 79.49 ? 578 ASP A N 1 ATOM 4635 C CA . ASP A 1 578 ? 8.551 15.277 -4.374 1.00 80.09 ? 578 ASP A CA 1 ATOM 4636 C C . ASP A 1 578 ? 7.720 14.042 -4.220 1.00 80.26 ? 578 ASP A C 1 ATOM 4637 O O . ASP A 1 578 ? 8.061 12.985 -4.740 1.00 80.66 ? 578 ASP A O 1 ATOM 4638 C CB . ASP A 1 578 ? 8.109 15.991 -5.653 1.00 80.16 ? 578 ASP A CB 1 ATOM 4639 C CG . ASP A 1 578 ? 6.788 16.695 -5.466 1.00 79.59 ? 578 ASP A CG 1 ATOM 4640 O OD1 . ASP A 1 578 ? 5.741 16.020 -5.373 1.00 78.40 ? 578 ASP A OD1 1 ATOM 4641 O OD2 . ASP A 1 578 ? 6.712 17.927 -5.331 1.00 80.62 ? 578 ASP A OD2 1 ATOM 4642 N N . CYS A 1 579 ? 6.597 14.211 -3.541 1.00 80.82 ? 579 CYS A N 1 ATOM 4643 C CA . CYS A 1 579 ? 5.688 13.118 -3.239 1.00 80.90 ? 579 CYS A CA 1 ATOM 4644 C C . CYS A 1 579 ? 5.327 12.318 -4.497 1.00 81.71 ? 579 CYS A C 1 ATOM 4645 O O . CYS A 1 579 ? 5.200 11.082 -4.456 1.00 81.66 ? 579 CYS A O 1 ATOM 4646 C CB . CYS A 1 579 ? 4.436 13.675 -2.533 1.00 80.58 ? 579 CYS A CB 1 ATOM 4647 S SG . CYS A 1 579 ? 4.604 13.944 -0.730 1.00 78.30 ? 579 CYS A SG 1 ATOM 4648 N N . SER A 1 580 ? 5.202 13.023 -5.619 1.00 82.08 ? 580 SER A N 1 ATOM 4649 C CA . SER A 1 580 ? 4.778 12.401 -6.879 1.00 82.62 ? 580 SER A CA 1 ATOM 4650 C C . SER A 1 580 ? 5.757 11.402 -7.436 1.00 82.65 ? 580 SER A C 1 ATOM 4651 O O . SER A 1 580 ? 5.392 10.595 -8.269 1.00 82.52 ? 580 SER A O 1 ATOM 4652 C CB . SER A 1 580 ? 4.526 13.449 -7.944 1.00 82.40 ? 580 SER A CB 1 ATOM 4653 O OG . SER A 1 580 ? 4.217 14.677 -7.350 1.00 83.66 ? 580 SER A OG 1 ATOM 4654 N N . THR A 1 581 ? 7.003 11.456 -6.992 1.00 83.18 ? 581 THR A N 1 ATOM 4655 C CA . THR A 1 581 ? 7.996 10.528 -7.509 1.00 83.83 ? 581 THR A CA 1 ATOM 4656 C C . THR A 1 581 ? 8.029 9.189 -6.738 1.00 84.00 ? 581 THR A C 1 ATOM 4657 O O . THR A 1 581 ? 8.893 8.335 -6.976 1.00 83.85 ? 581 THR A O 1 ATOM 4658 C CB . THR A 1 581 ? 9.373 11.221 -7.535 1.00 83.81 ? 581 THR A CB 1 ATOM 4659 O OG1 . THR A 1 581 ? 9.271 12.418 -8.306 1.00 83.66 ? 581 THR A OG1 1 ATOM 4660 C CG2 . THR A 1 581 ? 10.371 10.419 -8.345 1.00 84.69 ? 581 THR A CG2 1 ATOM 4661 N N . VAL A 1 582 ? 7.070 8.999 -5.832 1.00 84.29 ? 582 VAL A N 1 ATOM 4662 C CA . VAL A 1 582 ? 7.027 7.795 -4.985 1.00 84.21 ? 582 VAL A CA 1 ATOM 4663 C C . VAL A 1 582 ? 5.839 6.858 -5.256 1.00 84.23 ? 582 VAL A C 1 ATOM 4664 O O . VAL A 1 582 ? 4.682 7.285 -5.229 1.00 83.68 ? 582 VAL A O 1 ATOM 4665 C CB . VAL A 1 582 ? 6.999 8.179 -3.495 1.00 84.41 ? 582 VAL A CB 1 ATOM 4666 C CG1 . VAL A 1 582 ? 7.009 6.953 -2.613 1.00 84.88 ? 582 VAL A CG1 1 ATOM 4667 C CG2 . VAL A 1 582 ? 8.185 9.059 -3.149 1.00 84.06 ? 582 VAL A CG2 1 ATOM 4668 N N . ASP A 1 583 ? 6.091 5.569 -5.547 1.00 84.26 ? 583 ASP A N 1 ATOM 4669 C CA . ASP A 1 583 ? 5.087 4.523 -5.838 1.00 84.23 ? 583 ASP A CA 1 ATOM 4670 C C . ASP A 1 583 ? 3.951 4.541 -4.820 1.00 84.65 ? 583 ASP A C 1 ATOM 4671 O O . ASP A 1 583 ? 4.206 4.544 -3.616 1.00 84.70 ? 583 ASP A O 1 ATOM 4672 C CB . ASP A 1 583 ? 5.699 3.093 -5.804 1.00 84.25 ? 583 ASP A CB 1 ATOM 4673 C CG . ASP A 1 583 ? 7.126 3.068 -6.254 1.00 83.52 ? 583 ASP A CG 1 ATOM 4674 O OD1 . ASP A 1 583 ? 7.460 3.725 -7.271 1.00 80.63 ? 583 ASP A OD1 1 ATOM 4675 O OD2 . ASP A 1 583 ? 7.947 2.380 -5.611 1.00 83.71 ? 583 ASP A OD2 1 ATOM 4676 N N . LYS A 1 584 ? 2.714 4.568 -5.292 1.00 85.16 ? 584 LYS A N 1 ATOM 4677 C CA . LYS A 1 584 ? 1.504 4.576 -4.424 1.00 85.32 ? 584 LYS A CA 1 ATOM 4678 C C . LYS A 1 584 ? 1.034 3.166 -4.101 1.00 85.41 ? 584 LYS A C 1 ATOM 4679 O O . LYS A 1 584 ? 1.478 2.199 -4.727 1.00 85.43 ? 584 LYS A O 1 ATOM 4680 C CB . LYS A 1 584 ? 0.322 5.253 -5.155 1.00 85.37 ? 584 LYS A CB 1 ATOM 4681 C CG . LYS A 1 584 ? 0.270 6.761 -4.989 1.00 86.75 ? 584 LYS A CG 1 ATOM 4682 C CD . LYS A 1 584 ? -0.507 7.407 -6.116 1.00 87.74 ? 584 LYS A CD 1 ATOM 4683 C CE . LYS A 1 584 ? -0.740 8.877 -5.845 1.00 87.64 ? 584 LYS A CE 1 ATOM 4684 N NZ . LYS A 1 584 ? -0.646 9.704 -7.086 1.00 86.46 ? 584 LYS A NZ 1 ATOM 4685 N N . LEU A 1 585 ? 0.134 3.051 -3.137 1.00 85.61 ? 585 LEU A N 1 ATOM 4686 C CA . LEU A 1 585 ? -0.524 1.789 -2.928 1.00 85.61 ? 585 LEU A CA 1 ATOM 4687 C C . LEU A 1 585 ? -1.711 1.815 -3.883 1.00 85.61 ? 585 LEU A C 1 ATOM 4688 O O . LEU A 1 585 ? -2.689 2.516 -3.646 1.00 85.41 ? 585 LEU A O 1 ATOM 4689 C CB . LEU A 1 585 ? -1.014 1.660 -1.497 1.00 85.50 ? 585 LEU A CB 1 ATOM 4690 C CG . LEU A 1 585 ? -1.920 0.447 -1.294 1.00 85.47 ? 585 LEU A CG 1 ATOM 4691 C CD1 . LEU A 1 585 ? -1.120 -0.850 -1.392 1.00 84.23 ? 585 LEU A CD1 1 ATOM 4692 C CD2 . LEU A 1 585 ? -2.654 0.558 0.035 1.00 85.48 ? 585 LEU A CD2 1 ATOM 4693 N N . ASP A 1 586 ? -1.617 1.080 -4.984 1.00 85.79 ? 586 ASP A N 1 ATOM 4694 C CA . ASP A 1 586 ? -2.714 1.054 -5.954 1.00 85.71 ? 586 ASP A CA 1 ATOM 4695 C C . ASP A 1 586 ? -3.761 0.028 -5.519 1.00 85.38 ? 586 ASP A C 1 ATOM 4696 O O . ASP A 1 586 ? -3.476 -1.161 -5.475 1.00 85.31 ? 586 ASP A O 1 ATOM 4697 C CB . ASP A 1 586 ? -2.177 0.721 -7.348 1.00 85.84 ? 586 ASP A CB 1 ATOM 4698 C CG . ASP A 1 586 ? -3.260 0.719 -8.414 1.00 85.78 ? 586 ASP A CG 1 ATOM 4699 O OD1 . ASP A 1 586 ? -3.714 1.815 -8.823 1.00 85.88 ? 586 ASP A OD1 1 ATOM 4700 O OD2 . ASP A 1 586 ? -3.697 -0.336 -8.916 1.00 85.69 ? 586 ASP A OD2 1 ATOM 4701 N N . LEU A 1 587 ? -4.968 0.491 -5.202 1.00 84.90 ? 587 LEU A N 1 ATOM 4702 C CA . LEU A 1 587 ? -6.016 -0.393 -4.699 1.00 84.18 ? 587 LEU A CA 1 ATOM 4703 C C . LEU A 1 587 ? -6.888 -1.066 -5.771 1.00 83.67 ? 587 LEU A C 1 ATOM 4704 O O . LEU A 1 587 ? -7.851 -1.771 -5.449 1.00 83.34 ? 587 LEU A O 1 ATOM 4705 C CB . LEU A 1 587 ? -6.890 0.352 -3.691 1.00 84.02 ? 587 LEU A CB 1 ATOM 4706 C CG . LEU A 1 587 ? -6.240 0.723 -2.351 1.00 84.60 ? 587 LEU A CG 1 ATOM 4707 C CD1 . LEU A 1 587 ? -6.588 2.178 -1.973 1.00 86.32 ? 587 LEU A CD1 1 ATOM 4708 C CD2 . LEU A 1 587 ? -6.600 -0.246 -1.226 1.00 82.59 ? 587 LEU A CD2 1 ATOM 4709 N N . SER A 1 588 ? -6.549 -0.872 -7.041 1.00 83.00 ? 588 SER A N 1 ATOM 4710 C CA . SER A 1 588 ? -7.337 -1.481 -8.120 1.00 82.28 ? 588 SER A CA 1 ATOM 4711 C C . SER A 1 588 ? -7.619 -2.967 -7.905 1.00 81.60 ? 588 SER A C 1 ATOM 4712 O O . SER A 1 588 ? -8.711 -3.443 -8.212 1.00 81.51 ? 588 SER A O 1 ATOM 4713 C CB . SER A 1 588 ? -6.705 -1.251 -9.498 1.00 82.34 ? 588 SER A CB 1 ATOM 4714 O OG . SER A 1 588 ? -7.383 -0.229 -10.215 1.00 82.74 ? 588 SER A OG 1 ATOM 4715 N N . PRO A 1 589 ? -6.638 -3.703 -7.391 1.00 80.81 ? 589 PRO A N 1 ATOM 4716 C CA . PRO A 1 589 ? -6.816 -5.139 -7.146 1.00 80.17 ? 589 PRO A CA 1 ATOM 4717 C C . PRO A 1 589 ? -7.842 -5.441 -6.064 1.00 79.84 ? 589 PRO A C 1 ATOM 4718 O O . PRO A 1 589 ? -8.142 -6.606 -5.845 1.00 79.11 ? 589 PRO A O 1 ATOM 4719 C CB . PRO A 1 589 ? -5.433 -5.580 -6.687 1.00 79.83 ? 589 PRO A CB 1 ATOM 4720 C CG . PRO A 1 589 ? -4.525 -4.514 -7.229 1.00 80.43 ? 589 PRO A CG 1 ATOM 4721 C CD . PRO A 1 589 ? -5.280 -3.247 -7.058 1.00 80.22 ? 589 PRO A CD 1 ATOM 4722 N N . TRP A 1 590 ? -8.367 -4.414 -5.407 1.00 79.55 ? 590 TRP A N 1 ATOM 4723 C CA . TRP A 1 590 ? -9.321 -4.631 -4.329 1.00 79.90 ? 590 TRP A CA 1 ATOM 4724 C C . TRP A 1 590 ? -10.743 -4.463 -4.829 1.00 81.55 ? 590 TRP A C 1 ATOM 4725 O O . TRP A 1 590 ? -11.696 -4.420 -4.053 1.00 81.47 ? 590 TRP A O 1 ATOM 4726 C CB . TRP A 1 590 ? -9.055 -3.692 -3.152 1.00 78.58 ? 590 TRP A CB 1 ATOM 4727 C CG . TRP A 1 590 ? -8.088 -4.266 -2.193 1.00 75.01 ? 590 TRP A CG 1 ATOM 4728 C CD1 . TRP A 1 590 ? -8.365 -4.997 -1.071 1.00 68.81 ? 590 TRP A CD1 1 ATOM 4729 C CD2 . TRP A 1 590 ? -6.669 -4.195 -2.283 1.00 72.12 ? 590 TRP A CD2 1 ATOM 4730 N NE1 . TRP A 1 590 ? -7.199 -5.373 -0.460 1.00 66.90 ? 590 TRP A NE1 1 ATOM 4731 C CE2 . TRP A 1 590 ? -6.144 -4.886 -1.184 1.00 68.89 ? 590 TRP A CE2 1 ATOM 4732 C CE3 . TRP A 1 590 ? -5.779 -3.609 -3.194 1.00 72.02 ? 590 TRP A CE3 1 ATOM 4733 C CZ2 . TRP A 1 590 ? -4.780 -5.005 -0.970 1.00 69.46 ? 590 TRP A CZ2 1 ATOM 4734 C CZ3 . TRP A 1 590 ? -4.421 -3.719 -2.967 1.00 70.06 ? 590 TRP A CZ3 1 ATOM 4735 C CH2 . TRP A 1 590 ? -3.938 -4.409 -1.868 1.00 69.46 ? 590 TRP A CH2 1 ATOM 4736 N N . ALA A 1 591 ? -10.876 -4.362 -6.143 1.00 83.46 ? 591 ALA A N 1 ATOM 4737 C CA . ALA A 1 591 ? -12.181 -4.257 -6.756 1.00 84.84 ? 591 ALA A CA 1 ATOM 4738 C C . ALA A 1 591 ? -12.894 -5.567 -6.521 1.00 86.29 ? 591 ALA A C 1 ATOM 4739 O O . ALA A 1 591 ? -12.413 -6.609 -6.951 1.00 86.43 ? 591 ALA A O 1 ATOM 4740 C CB . ALA A 1 591 ? -12.041 -3.999 -8.244 1.00 84.78 ? 591 ALA A CB 1 ATOM 4741 N N . SER A 1 592 ? -14.014 -5.520 -5.801 1.00 88.03 ? 592 SER A N 1 ATOM 4742 C CA . SER A 1 592 ? -14.858 -6.689 -5.619 1.00 89.98 ? 592 SER A CA 1 ATOM 4743 C C . SER A 1 592 ? -15.610 -6.788 -6.935 1.00 91.48 ? 592 SER A C 1 ATOM 4744 O O . SER A 1 592 ? -16.813 -6.498 -6.993 1.00 91.87 ? 592 SER A O 1 ATOM 4745 C CB . SER A 1 592 ? -15.836 -6.468 -4.460 1.00 89.93 ? 592 SER A CB 1 ATOM 4746 O OG . SER A 1 592 ? -16.913 -7.403 -4.461 1.00 90.15 ? 592 SER A OG 1 ATOM 4747 N N . ARG A 1 593 ? -14.875 -7.192 -7.978 1.00 92.93 ? 593 ARG A N 1 ATOM 4748 C CA . ARG A 1 593 ? -15.318 -7.193 -9.390 1.00 94.14 ? 593 ARG A CA 1 ATOM 4749 C C . ARG A 1 593 ? -16.818 -7.436 -9.688 1.00 94.99 ? 593 ARG A C 1 ATOM 4750 O O . ARG A 1 593 ? -17.627 -6.496 -9.728 1.00 95.19 ? 593 ARG A O 1 ATOM 4751 C CB . ARG A 1 593 ? -14.373 -8.055 -10.283 1.00 94.23 ? 593 ARG A CB 1 ATOM 4752 C CG . ARG A 1 593 ? -13.602 -7.239 -11.382 1.00 94.85 ? 593 ARG A CG 1 ATOM 4753 C CD . ARG A 1 593 ? -12.201 -7.783 -11.828 1.00 96.66 ? 593 ARG A CD 1 ATOM 4754 N NE . ARG A 1 593 ? -12.033 -7.820 -13.295 1.00 95.59 ? 593 ARG A NE 1 ATOM 4755 C CZ . ARG A 1 593 ? -10.904 -7.522 -13.951 1.00 95.20 ? 593 ARG A CZ 1 ATOM 4756 N NH1 . ARG A 1 593 ? -9.819 -7.151 -13.289 1.00 94.17 ? 593 ARG A NH1 1 ATOM 4757 N NH2 . ARG A 1 593 ? -10.862 -7.581 -15.280 1.00 94.23 ? 593 ARG A NH2 1 ATOM 4758 N N . GLU A 1 594 ? -17.189 -8.693 -9.901 1.00 95.93 ? 594 GLU A N 1 ATOM 4759 C CA . GLU A 1 594 ? -18.562 -9.010 -10.265 1.00 96.45 ? 594 GLU A CA 1 ATOM 4760 C C . GLU A 1 594 ? -19.389 -9.540 -9.100 1.00 97.16 ? 594 GLU A C 1 ATOM 4761 O O . GLU A 1 594 ? -19.215 -10.683 -8.649 1.00 97.15 ? 594 GLU A O 1 ATOM 4762 C CB . GLU A 1 594 ? -18.592 -10.012 -11.423 1.00 96.37 ? 594 GLU A CB 1 ATOM 4763 C CG . GLU A 1 594 ? -18.041 -11.380 -11.062 1.00 96.17 ? 594 GLU A CG 1 ATOM 4764 C CD . GLU A 1 594 ? -18.617 -12.485 -11.926 1.00 97.01 ? 594 GLU A CD 1 ATOM 4765 O OE1 . GLU A 1 594 ? -18.938 -13.564 -11.375 1.00 96.13 ? 594 GLU A OE1 1 ATOM 4766 O OE2 . GLU A 1 594 ? -18.746 -12.273 -13.160 1.00 96.23 ? 594 GLU A OE2 1 ATOM 4767 N N . ASN A 1 595 ? -20.299 -8.701 -8.618 1.00 97.83 ? 595 ASN A N 1 ATOM 4768 C CA . ASN A 1 595 ? -21.215 -9.122 -7.578 1.00 98.42 ? 595 ASN A CA 1 ATOM 4769 C C . ASN A 1 595 ? -20.466 -9.731 -6.383 1.00 98.72 ? 595 ASN A C 1 ATOM 4770 O O . ASN A 1 595 ? -20.308 -9.099 -5.329 1.00 99.24 ? 595 ASN A O 1 ATOM 4771 C CB . ASN A 1 595 ? -22.224 -10.133 -8.161 1.00 98.67 ? 595 ASN A CB 1 ATOM 4772 C CG . ASN A 1 595 ? -22.407 -9.999 -9.701 1.00 99.15 ? 595 ASN A CG 1 ATOM 4773 O OD1 . ASN A 1 595 ? -22.393 -8.898 -10.262 1.00 98.71 ? 595 ASN A OD1 1 ATOM 4774 N ND2 . ASN A 1 595 ? -22.584 -11.136 -10.374 1.00 100.17 ? 595 ASN A ND2 1 HETATM 4775 C C1 . NAG B 2 . ? 23.838 3.740 6.599 1.00 73.37 ? 596 NAG A C1 1 HETATM 4776 C C2 . NAG B 2 . ? 24.761 3.378 5.418 1.00 78.90 ? 596 NAG A C2 1 HETATM 4777 C C3 . NAG B 2 . ? 24.030 2.963 4.151 1.00 80.82 ? 596 NAG A C3 1 HETATM 4778 C C4 . NAG B 2 . ? 22.917 1.998 4.539 1.00 81.14 ? 596 NAG A C4 1 HETATM 4779 C C5 . NAG B 2 . ? 21.924 2.787 5.410 1.00 78.58 ? 596 NAG A C5 1 HETATM 4780 C C6 . NAG B 2 . ? 20.876 1.887 6.078 1.00 77.19 ? 596 NAG A C6 1 HETATM 4781 C C7 . NAG B 2 . ? 26.692 4.824 5.842 1.00 83.61 ? 596 NAG A C7 1 HETATM 4782 C C8 . NAG B 2 . ? 27.536 5.956 5.322 1.00 84.97 ? 596 NAG A C8 1 HETATM 4783 N N2 . NAG B 2 . ? 25.671 4.453 5.060 1.00 81.02 ? 596 NAG A N2 1 HETATM 4784 O O3 . NAG B 2 . ? 24.981 2.450 3.224 1.00 80.05 ? 596 NAG A O3 1 HETATM 4785 O O4 . NAG B 2 . ? 22.175 1.673 3.385 1.00 86.58 ? 596 NAG A O4 1 HETATM 4786 O O5 . NAG B 2 . ? 22.466 3.755 6.307 1.00 74.07 ? 596 NAG A O5 1 HETATM 4787 O O6 . NAG B 2 . ? 19.576 2.459 5.950 1.00 75.61 ? 596 NAG A O6 1 HETATM 4788 O O7 . NAG B 2 . ? 26.950 4.304 6.942 1.00 82.85 ? 596 NAG A O7 1 HETATM 4789 C C1 . NAG C 2 . ? 22.361 0.380 2.777 1.00 91.65 ? 597 NAG A C1 1 HETATM 4790 C C2 . NAG C 2 . ? 22.411 0.619 1.266 1.00 94.01 ? 597 NAG A C2 1 HETATM 4791 C C3 . NAG C 2 . ? 22.975 -0.557 0.468 1.00 95.26 ? 597 NAG A C3 1 HETATM 4792 C C4 . NAG C 2 . ? 23.258 -1.829 1.280 1.00 94.87 ? 597 NAG A C4 1 HETATM 4793 C C5 . NAG C 2 . ? 23.572 -1.623 2.769 1.00 94.63 ? 597 NAG A C5 1 HETATM 4794 C C6 . NAG C 2 . ? 24.967 -2.160 3.074 1.00 94.07 ? 597 NAG A C6 1 HETATM 4795 C C7 . NAG C 2 . ? 20.698 1.027 -0.536 1.00 95.95 ? 597 NAG A C7 1 HETATM 4796 C C8 . NAG C 2 . ? 19.457 1.819 -0.840 1.00 96.37 ? 597 NAG A C8 1 HETATM 4797 N N2 . NAG C 2 . ? 21.106 1.032 0.748 1.00 95.00 ? 597 NAG A N2 1 HETATM 4798 O O3 . NAG C 2 . ? 24.149 -0.116 -0.200 1.00 97.07 ? 597 NAG A O3 1 HETATM 4799 O O4 . NAG C 2 . ? 22.204 -2.781 1.202 1.00 94.89 ? 597 NAG A O4 1 HETATM 4800 O O5 . NAG C 2 . ? 23.534 -0.272 3.168 1.00 93.71 ? 597 NAG A O5 1 HETATM 4801 O O6 . NAG C 2 . ? 25.904 -1.298 2.465 1.00 93.50 ? 597 NAG A O6 1 HETATM 4802 O O7 . NAG C 2 . ? 21.241 0.421 -1.467 1.00 97.60 ? 597 NAG A O7 1 HETATM 4803 C C1 . MAN D 3 . ? 21.599 -2.908 -0.104 1.00 94.45 ? 598 MAN A C1 1 HETATM 4804 C C2 . MAN D 3 . ? 20.476 -3.957 -0.071 1.00 94.01 ? 598 MAN A C2 1 HETATM 4805 C C3 . MAN D 3 . ? 19.624 -3.869 -1.361 1.00 94.28 ? 598 MAN A C3 1 HETATM 4806 C C4 . MAN D 3 . ? 20.424 -3.069 -2.375 1.00 94.57 ? 598 MAN A C4 1 HETATM 4807 C C5 . MAN D 3 . ? 21.878 -3.558 -2.371 1.00 95.40 ? 598 MAN A C5 1 HETATM 4808 C C6 . MAN D 3 . ? 22.648 -2.946 -3.553 1.00 95.12 ? 598 MAN A C6 1 HETATM 4809 O O2 . MAN D 3 . ? 19.725 -3.857 1.135 1.00 90.57 ? 598 MAN A O2 1 HETATM 4810 O O3 . MAN D 3 . ? 18.325 -3.300 -1.226 1.00 93.93 ? 598 MAN A O3 1 HETATM 4811 O O4 . MAN D 3 . ? 19.851 -3.169 -3.662 1.00 93.08 ? 598 MAN A O4 1 HETATM 4812 O O5 . MAN D 3 . ? 22.513 -3.267 -1.119 1.00 95.42 ? 598 MAN A O5 1 HETATM 4813 O O6 . MAN D 3 . ? 22.635 -3.786 -4.698 1.00 94.45 ? 598 MAN A O6 1 HETATM 4814 C C1 . NAG E 2 . ? -18.925 9.084 11.379 1.00 83.54 ? 599 NAG A C1 1 HETATM 4815 C C2 . NAG E 2 . ? -18.348 10.358 11.992 1.00 83.48 ? 599 NAG A C2 1 HETATM 4816 C C3 . NAG E 2 . ? -19.114 11.613 11.630 1.00 85.27 ? 599 NAG A C3 1 HETATM 4817 C C4 . NAG E 2 . ? -19.240 11.759 10.123 1.00 87.46 ? 599 NAG A C4 1 HETATM 4818 C C5 . NAG E 2 . ? -19.657 10.457 9.437 1.00 87.26 ? 599 NAG A C5 1 HETATM 4819 C C6 . NAG E 2 . ? -19.022 10.503 8.060 1.00 86.37 ? 599 NAG A C6 1 HETATM 4820 C C7 . NAG E 2 . ? -17.242 10.079 14.133 1.00 81.08 ? 599 NAG A C7 1 HETATM 4821 C C8 . NAG E 2 . ? -17.403 10.172 15.624 1.00 79.02 ? 599 NAG A C8 1 HETATM 4822 N N2 . NAG E 2 . ? -18.357 10.296 13.434 1.00 81.32 ? 599 NAG A N2 1 HETATM 4823 O O3 . NAG E 2 . ? -18.399 12.712 12.149 1.00 83.45 ? 599 NAG A O3 1 HETATM 4824 O O4 . NAG E 2 . ? -20.181 12.772 9.816 1.00 91.21 ? 599 NAG A O4 1 HETATM 4825 O O5 . NAG E 2 . ? -19.213 9.227 10.006 1.00 85.90 ? 599 NAG A O5 1 HETATM 4826 O O6 . NAG E 2 . ? -17.771 11.130 8.232 1.00 86.12 ? 599 NAG A O6 1 HETATM 4827 O O7 . NAG E 2 . ? -16.136 9.813 13.624 1.00 78.50 ? 599 NAG A O7 1 HETATM 4828 C C1 . NAG F 2 . ? -19.568 13.874 9.102 1.00 95.28 ? 600 NAG A C1 1 HETATM 4829 C C2 . NAG F 2 . ? -20.620 14.713 8.353 1.00 96.17 ? 600 NAG A C2 1 HETATM 4830 C C3 . NAG F 2 . ? -20.219 16.186 8.240 1.00 96.94 ? 600 NAG A C3 1 HETATM 4831 C C4 . NAG F 2 . ? -18.700 16.374 8.183 1.00 96.83 ? 600 NAG A C4 1 HETATM 4832 C C5 . NAG F 2 . ? -17.991 15.633 9.313 1.00 97.28 ? 600 NAG A C5 1 HETATM 4833 C C6 . NAG F 2 . ? -17.540 16.646 10.352 1.00 98.88 ? 600 NAG A C6 1 HETATM 4834 C C7 . NAG F 2 . ? -21.352 13.097 6.642 1.00 96.15 ? 600 NAG A C7 1 HETATM 4835 C C8 . NAG F 2 . ? -21.388 12.809 5.167 1.00 96.87 ? 600 NAG A C8 1 HETATM 4836 N N2 . NAG F 2 . ? -20.812 14.261 6.987 1.00 95.87 ? 600 NAG A N2 1 HETATM 4837 O O3 . NAG F 2 . ? -20.768 16.957 9.294 1.00 97.28 ? 600 NAG A O3 1 HETATM 4838 O O4 . NAG F 2 . ? -18.191 15.982 6.923 1.00 95.74 ? 600 NAG A O4 1 HETATM 4839 O O5 . NAG F 2 . ? -18.835 14.707 9.972 1.00 96.82 ? 600 NAG A O5 1 HETATM 4840 O O6 . NAG F 2 . ? -18.601 16.909 11.253 1.00 100.15 ? 600 NAG A O6 1 HETATM 4841 O O7 . NAG F 2 . ? -21.807 12.284 7.445 1.00 95.87 ? 600 NAG A O7 1 HETATM 4842 C C1 . NAG G 2 . ? -0.241 25.367 28.612 1.00 65.62 ? 601 NAG A C1 1 HETATM 4843 C C2 . NAG G 2 . ? 1.139 26.025 28.676 1.00 67.90 ? 601 NAG A C2 1 HETATM 4844 C C3 . NAG G 2 . ? 1.134 27.482 28.266 1.00 67.92 ? 601 NAG A C3 1 HETATM 4845 C C4 . NAG G 2 . ? 0.439 27.630 26.920 1.00 70.86 ? 601 NAG A C4 1 HETATM 4846 C C5 . NAG G 2 . ? -0.865 26.829 26.907 1.00 68.20 ? 601 NAG A C5 1 HETATM 4847 C C6 . NAG G 2 . ? -1.462 26.853 25.511 1.00 68.13 ? 601 NAG A C6 1 HETATM 4848 C C7 . NAG G 2 . ? 2.630 24.988 30.207 1.00 69.44 ? 601 NAG A C7 1 HETATM 4849 C C8 . NAG G 2 . ? 3.353 25.020 31.520 1.00 72.82 ? 601 NAG A C8 1 HETATM 4850 N N2 . NAG G 2 . ? 1.744 25.957 29.987 1.00 67.86 ? 601 NAG A N2 1 HETATM 4851 O O3 . NAG G 2 . ? 2.483 27.908 28.249 1.00 65.52 ? 601 NAG A O3 1 HETATM 4852 O O4 . NAG G 2 . ? 0.109 28.985 26.714 1.00 76.41 ? 601 NAG A O4 1 HETATM 4853 O O5 . NAG G 2 . ? -0.638 25.500 27.270 1.00 64.17 ? 601 NAG A O5 1 HETATM 4854 O O6 . NAG G 2 . ? -2.687 26.158 25.533 1.00 70.36 ? 601 NAG A O6 1 HETATM 4855 O O7 . NAG G 2 . ? 2.855 24.087 29.402 1.00 66.88 ? 601 NAG A O7 1 HETATM 4856 C C1 . NAG H 2 . ? 0.384 29.446 25.400 1.00 81.18 ? 602 NAG A C1 1 HETATM 4857 C C2 . NAG H 2 . ? -0.443 30.705 25.251 1.00 84.93 ? 602 NAG A C2 1 HETATM 4858 C C3 . NAG H 2 . ? -0.099 31.486 23.998 1.00 87.02 ? 602 NAG A C3 1 HETATM 4859 C C4 . NAG H 2 . ? 1.386 31.801 23.966 1.00 88.71 ? 602 NAG A C4 1 HETATM 4860 C C5 . NAG H 2 . ? 2.115 31.076 25.115 1.00 88.08 ? 602 NAG A C5 1 HETATM 4861 C C6 . NAG H 2 . ? 1.938 31.782 26.467 1.00 89.30 ? 602 NAG A C6 1 HETATM 4862 C C7 . NAG H 2 . ? -2.595 30.564 26.315 1.00 84.90 ? 602 NAG A C7 1 HETATM 4863 C C8 . NAG H 2 . ? -4.027 30.119 26.249 1.00 85.12 ? 602 NAG A C8 1 HETATM 4864 N N2 . NAG H 2 . ? -1.849 30.361 25.237 1.00 85.56 ? 602 NAG A N2 1 HETATM 4865 O O3 . NAG H 2 . ? -0.814 32.700 24.068 1.00 87.64 ? 602 NAG A O3 1 HETATM 4866 O O4 . NAG H 2 . ? 1.902 31.487 22.676 1.00 91.85 ? 602 NAG A O4 1 HETATM 4867 O O5 . NAG H 2 . ? 1.742 29.713 25.228 1.00 84.29 ? 602 NAG A O5 1 HETATM 4868 O O6 . NAG H 2 . ? 2.787 31.217 27.451 1.00 90.75 ? 602 NAG A O6 1 HETATM 4869 O O7 . NAG H 2 . ? -2.138 31.091 27.325 1.00 84.81 ? 602 NAG A O7 1 HETATM 4870 C C1 . MAN I 3 . ? 2.293 32.670 21.910 1.00 94.85 ? 603 MAN A C1 1 HETATM 4871 C C2 . MAN I 3 . ? 3.476 33.410 22.577 1.00 96.32 ? 603 MAN A C2 1 HETATM 4872 C C3 . MAN I 3 . ? 3.155 34.788 23.187 1.00 96.84 ? 603 MAN A C3 1 HETATM 4873 C C4 . MAN I 3 . ? 2.043 35.532 22.445 1.00 96.38 ? 603 MAN A C4 1 HETATM 4874 C C5 . MAN I 3 . ? 0.846 34.599 22.257 1.00 95.55 ? 603 MAN A C5 1 HETATM 4875 C C6 . MAN I 3 . ? -0.326 35.313 21.594 1.00 94.90 ? 603 MAN A C6 1 HETATM 4876 O O2 . MAN I 3 . ? 4.546 33.531 21.649 1.00 97.71 ? 603 MAN A O2 1 HETATM 4877 O O3 . MAN I 3 . ? 4.321 35.592 23.211 1.00 99.17 ? 603 MAN A O3 1 HETATM 4878 O O4 . MAN I 3 . ? 1.668 36.718 23.127 1.00 94.14 ? 603 MAN A O4 1 HETATM 4879 O O5 . MAN I 3 . ? 1.209 33.489 21.447 1.00 94.74 ? 603 MAN A O5 1 HETATM 4880 O O6 . MAN I 3 . ? -0.502 34.764 20.307 1.00 93.42 ? 603 MAN A O6 1 HETATM 4881 C C1 . NAG J 2 . ? 7.546 -25.630 11.466 1.00 82.92 ? 604 NAG A C1 1 HETATM 4882 C C2 . NAG J 2 . ? 8.596 -26.164 10.485 1.00 89.20 ? 604 NAG A C2 1 HETATM 4883 C C3 . NAG J 2 . ? 9.072 -27.534 10.943 1.00 91.12 ? 604 NAG A C3 1 HETATM 4884 C C4 . NAG J 2 . ? 9.603 -27.448 12.372 1.00 92.16 ? 604 NAG A C4 1 HETATM 4885 C C5 . NAG J 2 . ? 8.697 -26.603 13.293 1.00 90.59 ? 604 NAG A C5 1 HETATM 4886 C C6 . NAG J 2 . ? 9.409 -26.203 14.589 1.00 89.93 ? 604 NAG A C6 1 HETATM 4887 C C7 . NAG J 2 . ? 8.720 -25.563 8.120 1.00 91.88 ? 604 NAG A C7 1 HETATM 4888 C C8 . NAG J 2 . ? 8.178 -25.816 6.740 1.00 92.51 ? 604 NAG A C8 1 HETATM 4889 N N2 . NAG J 2 . ? 8.127 -26.242 9.110 1.00 90.03 ? 604 NAG A N2 1 HETATM 4890 O O3 . NAG J 2 . ? 10.063 -28.045 10.064 1.00 91.71 ? 604 NAG A O3 1 HETATM 4891 O O4 . NAG J 2 . ? 9.734 -28.772 12.865 1.00 96.11 ? 604 NAG A O4 1 HETATM 4892 O O5 . NAG J 2 . ? 8.217 -25.417 12.674 1.00 85.83 ? 604 NAG A O5 1 HETATM 4893 O O6 . NAG J 2 . ? 9.388 -24.797 14.773 1.00 90.10 ? 604 NAG A O6 1 HETATM 4894 O O7 . NAG J 2 . ? 9.656 -24.770 8.281 1.00 91.04 ? 604 NAG A O7 1 HETATM 4895 C C1 . NAG K 2 . ? 11.148 -29.109 12.851 1.00 98.61 ? 605 NAG A C1 1 HETATM 4896 C C2 . NAG K 2 . ? 11.739 -28.916 14.254 1.00 99.74 ? 605 NAG A C2 1 HETATM 4897 C C3 . NAG K 2 . ? 12.305 -30.169 14.920 1.00 99.88 ? 605 NAG A C3 1 HETATM 4898 C C4 . NAG K 2 . ? 12.887 -31.199 13.953 1.00 100.41 ? 605 NAG A C4 1 HETATM 4899 C C5 . NAG K 2 . ? 12.754 -30.793 12.484 1.00 99.93 ? 605 NAG A C5 1 HETATM 4900 C C6 . NAG K 2 . ? 13.028 -31.985 11.567 1.00 100.28 ? 605 NAG A C6 1 HETATM 4901 C C7 . NAG K 2 . ? 12.619 -26.786 15.051 1.00 102.28 ? 605 NAG A C7 1 HETATM 4902 C C8 . NAG K 2 . ? 13.573 -25.651 14.813 1.00 103.25 ? 605 NAG A C8 1 HETATM 4903 N N2 . NAG K 2 . ? 12.732 -27.845 14.246 1.00 101.79 ? 605 NAG A N2 1 HETATM 4904 O O3 . NAG K 2 . ? 11.283 -30.772 15.684 1.00 100.12 ? 605 NAG A O3 1 HETATM 4905 O O4 . NAG K 2 . ? 14.231 -31.444 14.311 1.00 100.13 ? 605 NAG A O4 1 HETATM 4906 O O5 . NAG K 2 . ? 11.425 -30.375 12.287 1.00 98.98 ? 605 NAG A O5 1 HETATM 4907 O O6 . NAG K 2 . ? 14.083 -31.717 10.666 1.00 101.15 ? 605 NAG A O6 1 HETATM 4908 O O7 . NAG K 2 . ? 11.779 -26.715 15.950 1.00 101.82 ? 605 NAG A O7 1 HETATM 4909 CA CA . CA L 4 . ? -0.292 -7.133 18.073 1.00 44.63 ? 606 CA A CA 1 HETATM 4910 P P . PO4 M 5 . ? 4.916 3.523 27.335 1.00 47.50 ? 607 PO4 A P 1 HETATM 4911 O O1 . PO4 M 5 . ? 6.331 3.890 27.722 1.00 51.88 ? 607 PO4 A O1 1 HETATM 4912 O O2 . PO4 M 5 . ? 4.606 4.335 26.130 1.00 53.06 ? 607 PO4 A O2 1 HETATM 4913 O O3 . PO4 M 5 . ? 4.856 2.089 26.851 1.00 55.47 ? 607 PO4 A O3 1 HETATM 4914 O O4 . PO4 M 5 . ? 3.969 3.717 28.489 1.00 49.23 ? 607 PO4 A O4 1 HETATM 4915 P P . PO4 N 5 . ? 11.695 -15.689 29.067 1.00 14.50 ? 608 PO4 A P 1 HETATM 4916 O O1 . PO4 N 5 . ? 10.172 -15.342 28.676 1.00 23.41 ? 608 PO4 A O1 1 HETATM 4917 O O2 . PO4 N 5 . ? 12.570 -14.337 29.074 1.00 40.62 ? 608 PO4 A O2 1 HETATM 4918 O O3 . PO4 N 5 . ? 11.733 -16.361 30.530 1.00 33.50 ? 608 PO4 A O3 1 HETATM 4919 O O4 . PO4 N 5 . ? 12.256 -16.635 28.076 1.00 30.52 ? 608 PO4 A O4 1 HETATM 4920 P P . PO4 O 5 . ? 25.257 6.166 43.113 1.00 31.11 ? 609 PO4 A P 1 HETATM 4921 O O1 . PO4 O 5 . ? 25.929 7.161 42.312 1.00 51.20 ? 609 PO4 A O1 1 HETATM 4922 O O2 . PO4 O 5 . ? 23.804 6.205 42.779 1.00 47.89 ? 609 PO4 A O2 1 HETATM 4923 O O3 . PO4 O 5 . ? 25.831 4.887 42.783 1.00 43.58 ? 609 PO4 A O3 1 HETATM 4924 O O4 . PO4 O 5 . ? 25.219 6.351 44.559 1.00 45.24 ? 609 PO4 A O4 1 HETATM 4925 P P . PO4 P 5 . ? 24.752 1.270 9.236 1.00 54.28 ? 610 PO4 A P 1 HETATM 4926 O O1 . PO4 P 5 . ? 24.166 2.625 9.313 1.00 58.58 ? 610 PO4 A O1 1 HETATM 4927 O O2 . PO4 P 5 . ? 25.936 1.185 10.214 1.00 52.81 ? 610 PO4 A O2 1 HETATM 4928 O O3 . PO4 P 5 . ? 23.875 0.118 9.104 1.00 58.32 ? 610 PO4 A O3 1 HETATM 4929 O O4 . PO4 P 5 . ? 25.057 1.053 7.805 1.00 62.47 ? 610 PO4 A O4 1 HETATM 4930 P P . PO4 Q 5 . ? -12.791 0.615 26.482 1.00 33.97 ? 611 PO4 A P 1 HETATM 4931 O O1 . PO4 Q 5 . ? -12.695 1.698 25.475 1.00 41.08 ? 611 PO4 A O1 1 HETATM 4932 O O2 . PO4 Q 5 . ? -14.225 0.114 26.299 1.00 48.10 ? 611 PO4 A O2 1 HETATM 4933 O O3 . PO4 Q 5 . ? -11.845 -0.437 26.216 1.00 49.55 ? 611 PO4 A O3 1 HETATM 4934 O O4 . PO4 Q 5 . ? -12.496 0.927 27.853 1.00 33.94 ? 611 PO4 A O4 1 HETATM 4935 P P . PO4 R 5 . ? -13.540 13.621 20.640 1.00 40.95 ? 612 PO4 A P 1 HETATM 4936 O O1 . PO4 R 5 . ? -12.094 13.390 20.403 1.00 56.94 ? 612 PO4 A O1 1 HETATM 4937 O O2 . PO4 R 5 . ? -13.958 14.668 19.688 1.00 51.06 ? 612 PO4 A O2 1 HETATM 4938 O O3 . PO4 R 5 . ? -14.392 12.474 20.272 1.00 48.36 ? 612 PO4 A O3 1 HETATM 4939 O O4 . PO4 R 5 . ? -13.515 13.935 22.091 1.00 45.41 ? 612 PO4 A O4 1 HETATM 4940 P P . PO4 S 5 . ? -8.244 12.026 7.266 1.00 69.18 ? 613 PO4 A P 1 HETATM 4941 O O1 . PO4 S 5 . ? -7.536 12.487 8.499 1.00 71.55 ? 613 PO4 A O1 1 HETATM 4942 O O2 . PO4 S 5 . ? -9.311 10.979 7.571 1.00 70.76 ? 613 PO4 A O2 1 HETATM 4943 O O3 . PO4 S 5 . ? -8.946 13.232 6.670 1.00 72.96 ? 613 PO4 A O3 1 HETATM 4944 O O4 . PO4 S 5 . ? -7.198 11.477 6.342 1.00 71.17 ? 613 PO4 A O4 1 HETATM 4945 P P . PO4 T 5 . ? -2.333 11.841 36.243 1.00 27.74 ? 614 PO4 A P 1 HETATM 4946 O O1 . PO4 T 5 . ? -3.490 11.510 35.350 1.00 40.33 ? 614 PO4 A O1 1 HETATM 4947 O O2 . PO4 T 5 . ? -2.908 12.848 37.145 1.00 54.23 ? 614 PO4 A O2 1 HETATM 4948 O O3 . PO4 T 5 . ? -1.787 11.031 37.315 1.00 43.01 ? 614 PO4 A O3 1 HETATM 4949 O O4 . PO4 T 5 . ? -1.129 12.260 35.456 1.00 54.36 ? 614 PO4 A O4 1 HETATM 4950 P P . PO4 U 5 . ? 8.355 -8.516 4.248 1.00 29.24 ? 615 PO4 A P 1 HETATM 4951 O O1 . PO4 U 5 . ? 7.278 -7.826 3.854 1.00 31.41 ? 615 PO4 A O1 1 HETATM 4952 O O2 . PO4 U 5 . ? 9.684 -7.973 4.229 1.00 45.19 ? 615 PO4 A O2 1 HETATM 4953 O O3 . PO4 U 5 . ? 8.319 -9.560 5.244 1.00 45.54 ? 615 PO4 A O3 1 HETATM 4954 O O4 . PO4 U 5 . ? 8.403 -9.252 3.025 1.00 53.48 ? 615 PO4 A O4 1 HETATM 4955 P P . PO4 V 5 . ? 15.092 22.878 15.265 1.00 54.24 ? 616 PO4 A P 1 HETATM 4956 O O1 . PO4 V 5 . ? 14.461 24.125 14.791 1.00 60.81 ? 616 PO4 A O1 1 HETATM 4957 O O2 . PO4 V 5 . ? 16.300 22.468 14.494 1.00 61.80 ? 616 PO4 A O2 1 HETATM 4958 O O3 . PO4 V 5 . ? 15.421 22.883 16.730 1.00 60.37 ? 616 PO4 A O3 1 HETATM 4959 O O4 . PO4 V 5 . ? 13.966 21.963 14.990 1.00 65.40 ? 616 PO4 A O4 1 HETATM 4960 P P . PO4 W 5 . ? 8.536 20.169 33.319 1.00 58.52 ? 617 PO4 A P 1 HETATM 4961 O O1 . PO4 W 5 . ? 7.573 19.687 32.282 1.00 55.98 ? 617 PO4 A O1 1 HETATM 4962 O O2 . PO4 W 5 . ? 8.081 19.817 34.718 1.00 62.63 ? 617 PO4 A O2 1 HETATM 4963 O O3 . PO4 W 5 . ? 9.929 19.716 33.195 1.00 63.89 ? 617 PO4 A O3 1 HETATM 4964 O O4 . PO4 W 5 . ? 8.640 21.672 33.158 1.00 67.34 ? 617 PO4 A O4 1 HETATM 4965 P P . PO4 X 5 . ? 6.953 19.844 2.814 1.00 40.95 ? 618 PO4 A P 1 HETATM 4966 O O1 . PO4 X 5 . ? 7.609 20.449 1.611 1.00 57.65 ? 618 PO4 A O1 1 HETATM 4967 O O2 . PO4 X 5 . ? 5.529 19.817 2.526 1.00 35.70 ? 618 PO4 A O2 1 HETATM 4968 O O3 . PO4 X 5 . ? 7.633 18.568 2.843 1.00 50.65 ? 618 PO4 A O3 1 HETATM 4969 O O4 . PO4 X 5 . ? 7.069 20.640 4.066 1.00 50.26 ? 618 PO4 A O4 1 HETATM 4970 P P . PO4 Y 5 . ? 36.112 -15.993 31.064 1.00 49.04 ? 619 PO4 A P 1 HETATM 4971 O O1 . PO4 Y 5 . ? 35.520 -16.211 29.695 1.00 54.41 ? 619 PO4 A O1 1 HETATM 4972 O O2 . PO4 Y 5 . ? 37.558 -15.645 30.883 1.00 64.36 ? 619 PO4 A O2 1 HETATM 4973 O O3 . PO4 Y 5 . ? 35.708 -14.799 31.831 1.00 61.31 ? 619 PO4 A O3 1 HETATM 4974 O O4 . PO4 Y 5 . ? 35.978 -17.151 31.981 1.00 57.68 ? 619 PO4 A O4 1 HETATM 4975 P P . PO4 Z 5 . ? 1.007 12.420 -5.109 1.00 95.84 ? 620 PO4 A P 1 HETATM 4976 O O1 . PO4 Z 5 . ? 2.442 12.576 -4.679 1.00 95.78 ? 620 PO4 A O1 1 HETATM 4977 O O2 . PO4 Z 5 . ? 0.191 13.534 -4.524 1.00 97.67 ? 620 PO4 A O2 1 HETATM 4978 O O3 . PO4 Z 5 . ? 0.881 12.425 -6.621 1.00 97.10 ? 620 PO4 A O3 1 HETATM 4979 O O4 . PO4 Z 5 . ? 0.469 11.134 -4.557 1.00 97.63 ? 620 PO4 A O4 1 HETATM 4980 P P . PO4 AA 5 . ? 14.039 2.744 4.947 1.00 49.38 ? 621 PO4 A P 1 HETATM 4981 O O1 . PO4 AA 5 . ? 14.189 2.385 3.453 1.00 63.02 ? 621 PO4 A O1 1 HETATM 4982 O O2 . PO4 AA 5 . ? 12.956 1.879 5.383 1.00 53.82 ? 621 PO4 A O2 1 HETATM 4983 O O3 . PO4 AA 5 . ? 15.456 2.731 5.398 1.00 45.73 ? 621 PO4 A O3 1 HETATM 4984 O O4 . PO4 AA 5 . ? 13.397 4.049 5.139 1.00 60.48 ? 621 PO4 A O4 1 HETATM 4985 P P . PO4 BA 5 . ? -14.137 -9.775 -15.265 1.00 100.24 ? 622 PO4 A P 1 HETATM 4986 O O1 . PO4 BA 5 . ? -15.627 -9.819 -14.951 1.00 97.24 ? 622 PO4 A O1 1 HETATM 4987 O O2 . PO4 BA 5 . ? -13.778 -8.458 -15.946 1.00 99.06 ? 622 PO4 A O2 1 HETATM 4988 O O3 . PO4 BA 5 . ? -13.323 -9.886 -13.990 1.00 98.03 ? 622 PO4 A O3 1 HETATM 4989 O O4 . PO4 BA 5 . ? -13.790 -10.940 -16.176 1.00 98.23 ? 622 PO4 A O4 1 HETATM 4990 C CHA . HEM CA 6 . ? 8.548 0.040 28.383 1.00 36.18 ? 623 HEM A CHA 1 HETATM 4991 C CHB . HEM CA 6 . ? 8.803 4.798 28.033 1.00 37.75 ? 623 HEM A CHB 1 HETATM 4992 C CHC . HEM CA 6 . ? 10.556 4.462 23.559 1.00 30.33 ? 623 HEM A CHC 1 HETATM 4993 C CHD . HEM CA 6 . ? 10.341 -0.231 23.873 1.00 37.23 ? 623 HEM A CHD 1 HETATM 4994 C C1A . HEM CA 6 . ? 8.465 1.354 28.680 1.00 36.49 ? 623 HEM A C1A 1 HETATM 4995 C C2A . HEM CA 6 . ? 7.888 1.873 29.910 1.00 40.92 ? 623 HEM A C2A 1 HETATM 4996 C C3A . HEM CA 6 . ? 7.938 3.193 29.820 1.00 40.89 ? 623 HEM A C3A 1 HETATM 4997 C C4A . HEM CA 6 . ? 8.544 3.530 28.528 1.00 38.45 ? 623 HEM A C4A 1 HETATM 4998 C CMA . HEM CA 6 . ? 7.385 4.128 30.894 1.00 39.21 ? 623 HEM A CMA 1 HETATM 4999 C CAA . HEM CA 6 . ? 7.271 1.034 31.044 1.00 33.58 ? 623 HEM A CAA 1 HETATM 5000 C CBA . HEM CA 6 . ? 8.437 0.573 31.817 1.00 42.90 ? 623 HEM A CBA 1 HETATM 5001 C CGA . HEM CA 6 . ? 8.038 -0.421 32.856 1.00 48.19 ? 623 HEM A CGA 1 HETATM 5002 O O1A . HEM CA 6 . ? 7.158 -0.091 33.706 1.00 50.85 ? 623 HEM A O1A 1 HETATM 5003 O O2A . HEM CA 6 . ? 8.685 -1.506 32.831 1.00 48.45 ? 623 HEM A O2A 1 HETATM 5004 C C1B . HEM CA 6 . ? 9.287 5.111 26.791 1.00 35.26 ? 623 HEM A C1B 1 HETATM 5005 C C2B . HEM CA 6 . ? 9.394 6.446 26.215 1.00 33.15 ? 623 HEM A C2B 1 HETATM 5006 C C3B . HEM CA 6 . ? 9.899 6.346 24.987 1.00 29.13 ? 623 HEM A C3B 1 HETATM 5007 C C4B . HEM CA 6 . ? 10.054 4.940 24.731 1.00 34.21 ? 623 HEM A C4B 1 HETATM 5008 C CMB . HEM CA 6 . ? 9.106 7.779 26.942 1.00 32.88 ? 623 HEM A CMB 1 HETATM 5009 C CAB . HEM CA 6 . ? 10.262 7.484 23.977 1.00 36.06 ? 623 HEM A CAB 1 HETATM 5010 C CBB . HEM CA 6 . ? 10.566 8.766 24.310 1.00 37.18 ? 623 HEM A CBB 1 HETATM 5011 C C1C . HEM CA 6 . ? 10.648 3.174 23.222 1.00 32.15 ? 623 HEM A C1C 1 HETATM 5012 C C2C . HEM CA 6 . ? 11.363 2.667 22.089 1.00 37.15 ? 623 HEM A C2C 1 HETATM 5013 C C3C . HEM CA 6 . ? 11.187 1.348 22.120 1.00 36.95 ? 623 HEM A C3C 1 HETATM 5014 C C4C . HEM CA 6 . ? 10.584 1.008 23.388 1.00 34.90 ? 623 HEM A C4C 1 HETATM 5015 C CMC . HEM CA 6 . ? 11.814 3.574 20.908 1.00 39.83 ? 623 HEM A CMC 1 HETATM 5016 C CAC . HEM CA 6 . ? 11.668 0.308 21.101 1.00 38.34 ? 623 HEM A CAC 1 HETATM 5017 C CBC . HEM CA 6 . ? 12.089 0.690 19.869 1.00 42.74 ? 623 HEM A CBC 1 HETATM 5018 C C1D . HEM CA 6 . ? 9.748 -0.547 25.074 1.00 37.68 ? 623 HEM A C1D 1 HETATM 5019 C C2D . HEM CA 6 . ? 9.279 -1.876 25.374 1.00 34.55 ? 623 HEM A C2D 1 HETATM 5020 C C3D . HEM CA 6 . ? 8.739 -1.804 26.762 1.00 35.22 ? 623 HEM A C3D 1 HETATM 5021 C C4D . HEM CA 6 . ? 8.926 -0.427 27.156 1.00 36.11 ? 623 HEM A C4D 1 HETATM 5022 C CMD . HEM CA 6 . ? 9.263 -3.167 24.519 1.00 35.74 ? 623 HEM A CMD 1 HETATM 5023 C CAD . HEM CA 6 . ? 8.037 -2.991 27.489 1.00 35.66 ? 623 HEM A CAD 1 HETATM 5024 C CBD . HEM CA 6 . ? 6.573 -2.974 26.950 1.00 40.75 ? 623 HEM A CBD 1 HETATM 5025 C CGD . HEM CA 6 . ? 5.782 -4.134 27.591 1.00 47.52 ? 623 HEM A CGD 1 HETATM 5026 O O1D . HEM CA 6 . ? 5.860 -5.257 26.994 1.00 44.51 ? 623 HEM A O1D 1 HETATM 5027 O O2D . HEM CA 6 . ? 5.107 -3.960 28.678 1.00 42.02 ? 623 HEM A O2D 1 HETATM 5028 N NA . HEM CA 6 . ? 8.854 2.365 27.882 1.00 35.42 ? 623 HEM A NA 1 HETATM 5029 N NB . HEM CA 6 . ? 9.670 4.181 25.838 1.00 34.05 ? 623 HEM A NB 1 HETATM 5030 N NC . HEM CA 6 . ? 10.266 2.141 24.028 1.00 36.21 ? 623 HEM A NC 1 HETATM 5031 N ND . HEM CA 6 . ? 9.507 0.315 26.144 1.00 34.63 ? 623 HEM A ND 1 HETATM 5032 FE FE . HEM CA 6 . ? 9.759 2.317 25.934 1.00 37.36 ? 623 HEM A FE 1 HETATM 5033 O O . HOH DA 7 . ? -0.593 30.611 29.268 1.00 61.80 ? 624 HOH A O 1 HETATM 5034 O O . HOH DA 7 . ? 29.442 12.753 29.567 1.00 32.30 ? 625 HOH A O 1 HETATM 5035 O O . HOH DA 7 . ? 23.437 -7.587 22.039 1.00 39.16 ? 626 HOH A O 1 HETATM 5036 O O . HOH DA 7 . ? 1.928 10.409 -11.414 1.00 64.28 ? 627 HOH A O 1 HETATM 5037 O O . HOH DA 7 . ? -7.264 11.532 28.325 1.00 55.69 ? 628 HOH A O 1 HETATM 5038 O O . HOH DA 7 . ? -10.788 -1.095 16.757 1.00 53.51 ? 629 HOH A O 1 HETATM 5039 O O . HOH DA 7 . ? 26.325 5.932 30.206 1.00 50.73 ? 630 HOH A O 1 HETATM 5040 O O . HOH DA 7 . ? 10.031 15.584 15.304 1.00 49.19 ? 631 HOH A O 1 HETATM 5041 O O . HOH DA 7 . ? 18.473 7.926 25.458 1.00 33.99 ? 632 HOH A O 1 HETATM 5042 O O . HOH DA 7 . ? 18.323 -10.359 34.107 1.00 42.96 ? 633 HOH A O 1 HETATM 5043 O O . HOH DA 7 . ? 2.870 -12.711 24.535 1.00 44.73 ? 634 HOH A O 1 HETATM 5044 O O . HOH DA 7 . ? -2.257 -22.347 24.205 1.00 57.35 ? 635 HOH A O 1 HETATM 5045 O O . HOH DA 7 . ? -4.974 -22.785 23.317 1.00 49.06 ? 636 HOH A O 1 HETATM 5046 O O . HOH DA 7 . ? 29.960 10.987 22.511 1.00 54.89 ? 637 HOH A O 1 HETATM 5047 O O . HOH DA 7 . ? 9.733 21.329 -0.018 1.00 64.59 ? 638 HOH A O 1 HETATM 5048 O O . HOH DA 7 . ? -2.350 28.873 23.051 1.00 65.88 ? 639 HOH A O 1 HETATM 5049 O O . HOH DA 7 . ? 5.264 -9.597 45.410 1.00 49.28 ? 640 HOH A O 1 HETATM 5050 O O . HOH DA 7 . ? 19.764 -9.587 38.829 1.00 54.43 ? 641 HOH A O 1 HETATM 5051 O O . HOH DA 7 . ? -0.767 -13.461 0.819 1.00 51.44 ? 642 HOH A O 1 HETATM 5052 O O . HOH DA 7 . ? 17.824 18.708 6.783 1.00 65.18 ? 643 HOH A O 1 HETATM 5053 O O . HOH DA 7 . ? 15.017 15.336 17.549 1.00 41.42 ? 644 HOH A O 1 HETATM 5054 O O . HOH DA 7 . ? 25.606 -7.110 6.605 1.00 58.55 ? 645 HOH A O 1 HETATM 5055 O O . HOH DA 7 . ? -23.950 9.684 9.805 1.00 52.55 ? 646 HOH A O 1 HETATM 5056 O O . HOH DA 7 . ? 14.055 -12.244 6.316 1.00 55.07 ? 647 HOH A O 1 HETATM 5057 O O . HOH DA 7 . ? 32.047 -19.909 27.259 1.00 52.99 ? 648 HOH A O 1 HETATM 5058 O O . HOH DA 7 . ? -5.432 -17.458 44.083 1.00 69.46 ? 649 HOH A O 1 HETATM 5059 O O . HOH DA 7 . ? 14.077 1.688 16.870 1.00 48.86 ? 650 HOH A O 1 HETATM 5060 O O . HOH DA 7 . ? 5.913 -20.730 35.769 1.00 82.24 ? 651 HOH A O 1 HETATM 5061 O O . HOH DA 7 . ? -20.163 -21.256 15.290 1.00 60.97 ? 652 HOH A O 1 HETATM 5062 O O . HOH DA 7 . ? -3.454 -8.685 37.733 1.00 60.98 ? 653 HOH A O 1 HETATM 5063 O O . HOH DA 7 . ? 25.994 3.903 47.210 1.00 64.15 ? 654 HOH A O 1 HETATM 5064 O O . HOH DA 7 . ? -1.549 7.448 26.788 1.00 38.82 ? 655 HOH A O 1 HETATM 5065 O O . HOH DA 7 . ? 5.897 -4.982 32.847 1.00 60.26 ? 656 HOH A O 1 HETATM 5066 O O . HOH DA 7 . ? 20.231 -18.029 43.181 1.00 41.13 ? 657 HOH A O 1 HETATM 5067 O O . HOH DA 7 . ? -15.744 -3.220 -8.747 1.00 80.78 ? 658 HOH A O 1 HETATM 5068 O O . HOH DA 7 . ? -11.009 -24.366 7.708 1.00 51.03 ? 659 HOH A O 1 HETATM 5069 O O . HOH DA 7 . ? 37.051 -11.139 37.008 1.00 54.95 ? 660 HOH A O 1 HETATM 5070 O O . HOH DA 7 . ? 5.135 -0.739 29.276 1.00 56.18 ? 661 HOH A O 1 HETATM 5071 O O . HOH DA 7 . ? -8.006 -9.026 9.289 1.00 51.16 ? 662 HOH A O 1 HETATM 5072 O O . HOH DA 7 . ? 1.290 36.682 25.750 1.00 66.41 ? 663 HOH A O 1 HETATM 5073 O O . HOH DA 7 . ? 3.145 -17.039 7.955 1.00 43.40 ? 664 HOH A O 1 HETATM 5074 O O . HOH DA 7 . ? 5.199 11.704 37.208 1.00 48.07 ? 665 HOH A O 1 HETATM 5075 O O . HOH DA 7 . ? -4.795 -3.366 51.584 1.00 69.68 ? 666 HOH A O 1 HETATM 5076 O O . HOH DA 7 . ? -0.936 -15.779 23.694 1.00 46.10 ? 667 HOH A O 1 HETATM 5077 O O . HOH DA 7 . ? 32.396 -9.044 20.850 1.00 40.92 ? 668 HOH A O 1 HETATM 5078 O O . HOH DA 7 . ? 21.729 10.166 31.709 1.00 45.01 ? 669 HOH A O 1 HETATM 5079 O O . HOH DA 7 . ? 23.806 -20.492 31.628 1.00 51.23 ? 670 HOH A O 1 HETATM 5080 O O . HOH DA 7 . ? -1.283 -3.370 20.368 1.00 37.27 ? 671 HOH A O 1 HETATM 5081 O O . HOH DA 7 . ? -9.431 -13.873 2.523 1.00 68.49 ? 672 HOH A O 1 HETATM 5082 O O . HOH DA 7 . ? 3.816 16.575 -8.662 1.00 62.80 ? 673 HOH A O 1 HETATM 5083 O O . HOH DA 7 . ? 34.027 1.559 46.213 1.00 55.84 ? 674 HOH A O 1 HETATM 5084 O O . HOH DA 7 . ? 20.568 0.578 21.883 1.00 49.94 ? 675 HOH A O 1 HETATM 5085 O O . HOH DA 7 . ? -1.282 -7.486 10.255 1.00 85.23 ? 676 HOH A O 1 HETATM 5086 O O . HOH DA 7 . ? -8.787 15.531 34.172 1.00 61.44 ? 677 HOH A O 1 HETATM 5087 O O . HOH DA 7 . ? 25.050 -8.924 41.780 1.00 54.65 ? 678 HOH A O 1 HETATM 5088 O O . HOH DA 7 . ? 4.740 -12.174 46.379 1.00 59.98 ? 679 HOH A O 1 HETATM 5089 O O . HOH DA 7 . ? -1.988 17.519 26.547 1.00 51.75 ? 680 HOH A O 1 HETATM 5090 O O . HOH DA 7 . ? 8.422 31.048 25.593 1.00 47.28 ? 681 HOH A O 1 HETATM 5091 O O . HOH DA 7 . ? 5.372 -15.199 31.483 1.00 50.63 ? 682 HOH A O 1 HETATM 5092 O O . HOH DA 7 . ? 13.973 -11.847 40.000 1.00 44.46 ? 683 HOH A O 1 HETATM 5093 O O . HOH DA 7 . ? 2.611 -11.345 13.118 1.00 41.64 ? 684 HOH A O 1 HETATM 5094 O O . HOH DA 7 . ? 6.206 21.823 25.916 1.00 46.76 ? 685 HOH A O 1 HETATM 5095 O O . HOH DA 7 . ? 5.874 11.137 43.058 1.00 47.13 ? 686 HOH A O 1 HETATM 5096 O O . HOH DA 7 . ? -7.316 -14.345 14.410 1.00 49.16 ? 687 HOH A O 1 HETATM 5097 O O . HOH DA 7 . ? -4.520 -12.445 -8.109 1.00 46.47 ? 688 HOH A O 1 HETATM 5098 O O . HOH DA 7 . ? -7.049 6.853 48.524 1.00 72.79 ? 689 HOH A O 1 HETATM 5099 O O . HOH DA 7 . ? -21.680 -6.240 -12.250 1.00 69.06 ? 690 HOH A O 1 HETATM 5100 O O . HOH DA 7 . ? 1.837 -15.074 48.170 1.00 65.99 ? 691 HOH A O 1 HETATM 5101 O O . HOH DA 7 . ? -4.463 -31.153 31.097 1.00 59.33 ? 692 HOH A O 1 HETATM 5102 O O . HOH DA 7 . ? -1.151 -20.726 25.973 1.00 59.61 ? 693 HOH A O 1 HETATM 5103 O O . HOH DA 7 . ? 20.813 -10.040 6.616 1.00 55.92 ? 694 HOH A O 1 HETATM 5104 O O . HOH DA 7 . ? 29.814 16.408 18.338 1.00 66.45 ? 695 HOH A O 1 HETATM 5105 O O . HOH DA 7 . ? 4.205 1.523 30.197 1.00 60.34 ? 696 HOH A O 1 HETATM 5106 O O . HOH DA 7 . ? 5.633 16.327 29.682 1.00 60.07 ? 697 HOH A O 1 HETATM 5107 O O . HOH DA 7 . ? -17.306 -25.525 19.708 1.00 74.50 ? 698 HOH A O 1 HETATM 5108 O O . HOH DA 7 . ? 8.737 -22.415 10.346 1.00 56.61 ? 699 HOH A O 1 HETATM 5109 O O . HOH DA 7 . ? 31.596 6.191 22.518 1.00 66.88 ? 700 HOH A O 1 HETATM 5110 O O . HOH DA 7 . ? 36.597 -1.401 37.952 1.00 81.78 ? 701 HOH A O 1 HETATM 5111 O O . HOH DA 7 . ? 21.441 11.633 -2.886 1.00 79.74 ? 702 HOH A O 1 HETATM 5112 O O . HOH DA 7 . ? 6.681 -23.360 6.324 1.00 68.68 ? 703 HOH A O 1 HETATM 5113 O O . HOH DA 7 . ? 22.145 10.227 38.698 1.00 46.90 ? 704 HOH A O 1 HETATM 5114 O O . HOH DA 7 . ? 24.208 14.533 51.234 1.00 61.79 ? 705 HOH A O 1 HETATM 5115 O O . HOH DA 7 . ? 0.889 15.216 1.009 1.00 48.67 ? 706 HOH A O 1 HETATM 5116 O O . HOH DA 7 . ? 30.090 -11.633 21.388 1.00 46.37 ? 707 HOH A O 1 HETATM 5117 O O . HOH DA 7 . ? 23.903 18.675 50.947 1.00 47.08 ? 708 HOH A O 1 HETATM 5118 O O . HOH DA 7 . ? -23.311 9.266 7.310 1.00 68.22 ? 709 HOH A O 1 HETATM 5119 O O . HOH DA 7 . ? 0.767 5.130 29.839 1.00 34.27 ? 710 HOH A O 1 HETATM 5120 O O . HOH DA 7 . ? -10.170 10.434 -7.615 1.00 75.90 ? 711 HOH A O 1 HETATM 5121 O O . HOH DA 7 . ? 18.175 15.948 19.796 1.00 49.79 ? 712 HOH A O 1 HETATM 5122 O O . HOH DA 7 . ? 5.377 -27.282 19.178 1.00 59.67 ? 713 HOH A O 1 HETATM 5123 O O . HOH DA 7 . ? -16.931 23.867 18.190 1.00 74.54 ? 714 HOH A O 1 HETATM 5124 O O . HOH DA 7 . ? -9.517 0.788 -11.099 1.00 70.39 ? 715 HOH A O 1 HETATM 5125 O O . HOH DA 7 . ? 12.287 -1.304 49.496 1.00 50.68 ? 716 HOH A O 1 HETATM 5126 O O . HOH DA 7 . ? -0.172 19.703 10.699 1.00 48.63 ? 717 HOH A O 1 HETATM 5127 O O . HOH DA 7 . ? 0.493 -1.349 45.976 1.00 56.69 ? 718 HOH A O 1 HETATM 5128 O O . HOH DA 7 . ? 16.223 22.481 11.700 1.00 60.87 ? 719 HOH A O 1 HETATM 5129 O O . HOH DA 7 . ? 17.174 5.438 49.198 1.00 69.90 ? 720 HOH A O 1 HETATM 5130 O O . HOH DA 7 . ? 22.243 -18.756 36.266 1.00 62.42 ? 721 HOH A O 1 HETATM 5131 O O . HOH DA 7 . ? 20.121 -17.679 45.595 1.00 52.20 ? 722 HOH A O 1 HETATM 5132 O O . HOH DA 7 . ? -3.832 19.741 28.956 1.00 54.80 ? 723 HOH A O 1 HETATM 5133 O O . HOH DA 7 . ? -10.097 -25.081 18.716 1.00 62.47 ? 724 HOH A O 1 HETATM 5134 O O . HOH DA 7 . ? 23.374 -15.217 34.232 1.00 43.67 ? 725 HOH A O 1 HETATM 5135 O O . HOH DA 7 . ? 25.185 8.604 6.544 1.00 82.95 ? 726 HOH A O 1 HETATM 5136 O O . HOH DA 7 . ? -7.541 -29.270 33.685 1.00 92.65 ? 727 HOH A O 1 HETATM 5137 O O . HOH DA 7 . ? 7.532 27.214 17.918 1.00 53.10 ? 728 HOH A O 1 HETATM 5138 O O . HOH DA 7 . ? 17.333 12.539 9.460 1.00 51.75 ? 729 HOH A O 1 HETATM 5139 O O . HOH DA 7 . ? 28.811 -0.129 20.131 1.00 54.52 ? 730 HOH A O 1 HETATM 5140 O O . HOH DA 7 . ? -9.634 10.806 -5.177 1.00 55.35 ? 731 HOH A O 1 HETATM 5141 O O . HOH DA 7 . ? -8.724 26.633 4.518 1.00 67.79 ? 732 HOH A O 1 HETATM 5142 O O . HOH DA 7 . ? 4.432 -2.204 32.045 1.00 54.25 ? 733 HOH A O 1 HETATM 5143 O O . HOH DA 7 . ? 11.881 -1.963 47.223 1.00 43.49 ? 734 HOH A O 1 HETATM 5144 O O . HOH DA 7 . ? 16.182 -1.841 42.705 1.00 33.77 ? 735 HOH A O 1 HETATM 5145 O O . HOH DA 7 . ? -22.921 10.995 12.540 1.00 61.81 ? 736 HOH A O 1 HETATM 5146 O O . HOH DA 7 . ? -3.885 -3.263 21.496 1.00 41.72 ? 737 HOH A O 1 HETATM 5147 O O . HOH DA 7 . ? 22.855 -14.010 52.648 1.00 45.22 ? 738 HOH A O 1 HETATM 5148 O O . HOH DA 7 . ? 19.038 -15.339 3.054 1.00 66.90 ? 739 HOH A O 1 HETATM 5149 O O . HOH DA 7 . ? 16.054 18.208 18.434 1.00 58.13 ? 740 HOH A O 1 HETATM 5150 O O . HOH DA 7 . ? 3.148 18.335 -5.351 1.00 67.65 ? 741 HOH A O 1 HETATM 5151 O O . HOH DA 7 . ? 4.219 20.685 18.225 1.00 55.19 ? 742 HOH A O 1 HETATM 5152 O O . HOH DA 7 . ? 17.678 -19.830 39.409 1.00 51.98 ? 743 HOH A O 1 HETATM 5153 O O . HOH DA 7 . ? 10.927 -21.533 37.138 1.00 53.32 ? 744 HOH A O 1 HETATM 5154 O O . HOH DA 7 . ? -9.883 12.618 30.415 1.00 47.49 ? 745 HOH A O 1 HETATM 5155 O O . HOH DA 7 . ? -23.623 -1.182 6.141 1.00 69.34 ? 746 HOH A O 1 HETATM 5156 O O . HOH DA 7 . ? 4.551 2.147 50.903 1.00 83.48 ? 747 HOH A O 1 HETATM 5157 O O . HOH DA 7 . ? 7.169 2.328 25.270 1.00 40.30 ? 748 HOH A O 1 HETATM 5158 O O . HOH DA 7 . ? 9.236 14.452 45.353 1.00 60.18 ? 749 HOH A O 1 HETATM 5159 O O . HOH DA 7 . ? -1.247 -21.943 32.770 1.00 64.55 ? 750 HOH A O 1 HETATM 5160 O O . HOH DA 7 . ? 19.304 15.679 14.050 1.00 59.04 ? 751 HOH A O 1 HETATM 5161 O O . HOH DA 7 . ? -11.951 -23.380 18.525 1.00 77.40 ? 752 HOH A O 1 HETATM 5162 O O . HOH DA 7 . ? -1.529 -18.318 25.437 1.00 43.25 ? 753 HOH A O 1 HETATM 5163 O O . HOH DA 7 . ? 17.776 24.510 5.061 1.00 57.07 ? 754 HOH A O 1 HETATM 5164 O O . HOH DA 7 . ? 1.715 -0.172 47.955 1.00 91.98 ? 755 HOH A O 1 HETATM 5165 O O . HOH DA 7 . ? -6.662 -3.352 23.480 1.00 45.43 ? 756 HOH A O 1 HETATM 5166 O O . HOH DA 7 . ? -24.924 3.447 8.915 1.00 50.05 ? 757 HOH A O 1 HETATM 5167 O O . HOH DA 7 . ? -6.614 25.038 6.612 1.00 59.18 ? 758 HOH A O 1 HETATM 5168 O O . HOH DA 7 . ? -26.697 10.313 7.778 1.00 60.25 ? 759 HOH A O 1 HETATM 5169 O O . HOH DA 7 . ? -0.409 14.993 -7.749 1.00 62.40 ? 760 HOH A O 1 HETATM 5170 O O . HOH DA 7 . ? 29.900 10.261 28.809 1.00 54.09 ? 761 HOH A O 1 HETATM 5171 O O . HOH DA 7 . ? 30.047 -0.396 43.248 1.00 55.89 ? 762 HOH A O 1 HETATM 5172 O O . HOH DA 7 . ? -12.214 9.957 39.608 1.00 78.04 ? 763 HOH A O 1 HETATM 5173 O O . HOH DA 7 . ? -4.449 12.705 16.891 1.00 61.71 ? 764 HOH A O 1 HETATM 5174 O O . HOH DA 7 . ? -0.714 27.364 17.694 1.00 54.66 ? 765 HOH A O 1 HETATM 5175 O O . HOH DA 7 . ? -12.271 17.609 29.288 1.00 67.08 ? 766 HOH A O 1 HETATM 5176 O O . HOH DA 7 . ? -3.340 -1.056 31.492 1.00 76.10 ? 767 HOH A O 1 HETATM 5177 O O . HOH DA 7 . ? 5.405 17.037 37.259 1.00 58.00 ? 768 HOH A O 1 HETATM 5178 O O . HOH DA 7 . ? 7.605 -17.844 22.334 1.00 54.12 ? 769 HOH A O 1 HETATM 5179 O O . HOH DA 7 . ? -14.389 22.944 18.804 1.00 57.81 ? 770 HOH A O 1 HETATM 5180 O O . HOH DA 7 . ? 16.939 -9.373 35.953 1.00 44.11 ? 771 HOH A O 1 HETATM 5181 O O . HOH DA 7 . ? 8.872 -20.461 34.300 1.00 44.82 ? 772 HOH A O 1 HETATM 5182 O O . HOH DA 7 . ? 10.789 -12.538 2.927 1.00 49.14 ? 773 HOH A O 1 HETATM 5183 O O . HOH DA 7 . ? 19.551 18.862 24.873 1.00 61.48 ? 774 HOH A O 1 HETATM 5184 O O . HOH DA 7 . ? -21.064 -6.207 -6.466 1.00 80.41 ? 775 HOH A O 1 HETATM 5185 O O . HOH DA 7 . ? 15.883 -2.539 47.493 1.00 49.42 ? 776 HOH A O 1 HETATM 5186 O O . HOH DA 7 . ? -10.078 20.981 21.281 1.00 36.82 ? 777 HOH A O 1 HETATM 5187 O O . HOH DA 7 . ? -19.721 4.665 16.142 1.00 57.46 ? 778 HOH A O 1 HETATM 5188 O O . HOH DA 7 . ? -8.499 -10.541 -1.320 1.00 74.74 ? 779 HOH A O 1 HETATM 5189 O O . HOH DA 7 . ? 8.017 -21.981 0.459 1.00 76.34 ? 780 HOH A O 1 HETATM 5190 O O . HOH DA 7 . ? -9.614 8.495 47.231 1.00 79.74 ? 781 HOH A O 1 HETATM 5191 O O . HOH DA 7 . ? -17.054 -8.863 6.734 1.00 48.29 ? 782 HOH A O 1 HETATM 5192 O O . HOH DA 7 . ? -20.762 -1.174 9.953 1.00 60.08 ? 783 HOH A O 1 HETATM 5193 O O . HOH DA 7 . ? 15.391 -1.298 45.396 1.00 52.95 ? 784 HOH A O 1 HETATM 5194 O O . HOH DA 7 . ? -2.806 30.136 17.624 1.00 62.84 ? 785 HOH A O 1 HETATM 5195 O O . HOH DA 7 . ? 12.977 -2.815 -0.823 1.00 75.01 ? 786 HOH A O 1 HETATM 5196 O O . HOH DA 7 . ? 10.716 9.555 43.679 1.00 52.49 ? 787 HOH A O 1 HETATM 5197 O O . HOH DA 7 . ? 14.200 -21.966 2.060 1.00 63.39 ? 788 HOH A O 1 HETATM 5198 O O . HOH DA 7 . ? -8.498 3.997 29.271 1.00 78.44 ? 789 HOH A O 1 HETATM 5199 O O . HOH DA 7 . ? 39.940 -10.963 36.646 1.00 54.58 ? 790 HOH A O 1 HETATM 5200 O O . HOH DA 7 . ? 30.051 -18.124 19.978 1.00 57.23 ? 791 HOH A O 1 HETATM 5201 O O . HOH DA 7 . ? 20.299 4.789 17.011 1.00 51.43 ? 792 HOH A O 1 HETATM 5202 O O . HOH DA 7 . ? 6.113 -28.286 8.857 1.00 77.32 ? 793 HOH A O 1 HETATM 5203 O O . HOH DA 7 . ? -9.994 -10.477 2.285 1.00 58.25 ? 794 HOH A O 1 HETATM 5204 O O . HOH DA 7 . ? 3.835 -27.693 9.631 1.00 70.92 ? 795 HOH A O 1 HETATM 5205 O O . HOH DA 7 . ? 19.022 0.466 2.174 1.00 65.08 ? 796 HOH A O 1 HETATM 5206 O O . HOH DA 7 . ? -20.168 -6.685 1.613 1.00 36.83 ? 797 HOH A O 1 HETATM 5207 O O . HOH DA 7 . ? -2.485 -17.794 30.566 1.00 46.17 ? 798 HOH A O 1 HETATM 5208 O O . HOH DA 7 . ? 1.944 4.965 35.803 1.00 70.98 ? 799 HOH A O 1 HETATM 5209 O O . HOH DA 7 . ? 7.312 -12.011 4.416 1.00 45.64 ? 800 HOH A O 1 HETATM 5210 O O . HOH DA 7 . ? -1.246 5.458 -2.055 1.00 67.53 ? 801 HOH A O 1 HETATM 5211 O O . HOH DA 7 . ? 8.964 -21.904 32.204 1.00 53.59 ? 802 HOH A O 1 HETATM 5212 O O . HOH DA 7 . ? 17.088 1.481 43.035 1.00 49.93 ? 803 HOH A O 1 HETATM 5213 O O . HOH DA 7 . ? 3.404 5.216 30.388 1.00 60.12 ? 804 HOH A O 1 HETATM 5214 O O . HOH DA 7 . ? 3.510 -23.907 21.006 1.00 62.83 ? 805 HOH A O 1 HETATM 5215 O O . HOH DA 7 . ? -8.002 6.084 17.593 1.00 50.13 ? 806 HOH A O 1 HETATM 5216 O O . HOH DA 7 . ? 24.656 11.600 51.462 1.00 62.92 ? 807 HOH A O 1 HETATM 5217 O O . HOH DA 7 . ? -4.721 -12.251 14.852 1.00 62.80 ? 808 HOH A O 1 HETATM 5218 O O . HOH DA 7 . ? -5.762 8.705 29.647 1.00 52.53 ? 809 HOH A O 1 HETATM 5219 O O . HOH DA 7 . ? 18.327 14.318 39.123 1.00 58.99 ? 810 HOH A O 1 HETATM 5220 O O . HOH DA 7 . ? -1.113 1.724 36.936 1.00 72.93 ? 811 HOH A O 1 HETATM 5221 O O . HOH DA 7 . ? 0.992 2.975 21.750 1.00 48.31 ? 812 HOH A O 1 HETATM 5222 O O . HOH DA 7 . ? 10.211 9.001 51.374 1.00 44.44 ? 813 HOH A O 1 HETATM 5223 O O . HOH DA 7 . ? 3.811 3.596 39.254 1.00 65.58 ? 814 HOH A O 1 HETATM 5224 O O . HOH DA 7 . ? 1.176 -13.869 45.506 1.00 69.72 ? 815 HOH A O 1 HETATM 5225 O O . HOH DA 7 . ? 23.409 13.783 37.964 1.00 68.21 ? 816 HOH A O 1 HETATM 5226 O O . HOH DA 7 . ? 16.199 -11.504 37.628 1.00 43.44 ? 817 HOH A O 1 HETATM 5227 O O . HOH DA 7 . ? -10.749 15.029 13.674 1.00 50.07 ? 818 HOH A O 1 HETATM 5228 O O . HOH DA 7 . ? 4.929 12.068 -11.277 1.00 47.74 ? 819 HOH A O 1 HETATM 5229 O O . HOH DA 7 . ? 11.940 -21.600 46.901 1.00 54.71 ? 820 HOH A O 1 HETATM 5230 O O . HOH DA 7 . ? 20.455 13.188 39.389 1.00 35.01 ? 821 HOH A O 1 HETATM 5231 O O . HOH DA 7 . ? 1.047 -11.420 46.915 1.00 64.10 ? 822 HOH A O 1 HETATM 5232 O O . HOH DA 7 . ? 29.077 11.658 16.445 1.00 52.80 ? 823 HOH A O 1 HETATM 5233 O O . HOH DA 7 . ? 19.101 17.033 17.280 1.00 45.24 ? 824 HOH A O 1 HETATM 5234 O O . HOH DA 7 . ? -1.322 17.258 9.187 1.00 48.23 ? 825 HOH A O 1 HETATM 5235 O O . HOH DA 7 . ? -13.048 13.553 26.665 1.00 62.57 ? 826 HOH A O 1 HETATM 5236 O O . HOH DA 7 . ? 7.612 34.320 20.800 1.00 76.04 ? 827 HOH A O 1 HETATM 5237 O O . HOH DA 7 . ? 14.489 -4.832 48.289 1.00 45.10 ? 828 HOH A O 1 HETATM 5238 O O . HOH DA 7 . ? 1.099 -24.262 47.720 1.00 68.92 ? 829 HOH A O 1 HETATM 5239 O O . HOH DA 7 . ? 24.979 15.175 16.234 1.00 55.69 ? 830 HOH A O 1 HETATM 5240 O O . HOH DA 7 . ? 0.604 0.200 33.680 1.00 55.49 ? 831 HOH A O 1 HETATM 5241 O O . HOH DA 7 . ? 34.560 -15.233 27.368 1.00 48.43 ? 832 HOH A O 1 HETATM 5242 O O . HOH DA 7 . ? 20.179 -18.189 40.498 1.00 58.13 ? 833 HOH A O 1 HETATM 5243 O O . HOH DA 7 . ? 24.634 15.417 14.027 1.00 57.47 ? 834 HOH A O 1 HETATM 5244 O O . HOH DA 7 . ? 34.270 -6.778 41.777 1.00 63.31 ? 835 HOH A O 1 HETATM 5245 O O . HOH DA 7 . ? -14.907 8.679 11.548 1.00 50.53 ? 836 HOH A O 1 HETATM 5246 O O . HOH DA 7 . ? 29.319 6.153 32.212 1.00 52.06 ? 837 HOH A O 1 HETATM 5247 O O . HOH DA 7 . ? -8.653 -10.002 24.832 1.00 74.08 ? 838 HOH A O 1 HETATM 5248 O O . HOH DA 7 . ? 24.362 11.776 34.406 1.00 55.21 ? 839 HOH A O 1 HETATM 5249 O O . HOH DA 7 . ? -1.882 0.653 32.583 1.00 45.81 ? 840 HOH A O 1 HETATM 5250 O O . HOH DA 7 . ? 17.466 14.528 17.279 1.00 65.16 ? 841 HOH A O 1 HETATM 5251 O O . HOH DA 7 . ? 27.354 15.825 14.977 1.00 58.44 ? 842 HOH A O 1 HETATM 5252 O O . HOH DA 7 . ? 24.491 10.576 39.502 1.00 45.51 ? 843 HOH A O 1 HETATM 5253 O O . HOH DA 7 . ? 32.632 1.754 43.779 1.00 58.22 ? 844 HOH A O 1 HETATM 5254 O O . HOH DA 7 . ? 8.486 -21.555 22.244 1.00 59.15 ? 845 HOH A O 1 HETATM 5255 O O . HOH DA 7 . ? 32.576 2.796 23.555 1.00 66.01 ? 846 HOH A O 1 HETATM 5256 O O . HOH DA 7 . ? 5.941 28.144 21.712 1.00 66.40 ? 847 HOH A O 1 HETATM 5257 O O . HOH DA 7 . ? 19.564 -18.021 6.814 1.00 60.30 ? 848 HOH A O 1 HETATM 5258 O O . HOH DA 7 . ? -3.292 -24.920 26.156 1.00 85.19 ? 849 HOH A O 1 HETATM 5259 O O . HOH DA 7 . ? 6.486 -17.561 0.350 1.00 69.09 ? 850 HOH A O 1 HETATM 5260 O O . HOH DA 7 . ? 3.565 27.937 22.017 1.00 68.54 ? 851 HOH A O 1 HETATM 5261 O O . HOH DA 7 . ? -18.422 -11.108 -3.314 1.00 58.61 ? 852 HOH A O 1 HETATM 5262 O O . HOH DA 7 . ? 4.337 -28.463 21.882 1.00 61.02 ? 853 HOH A O 1 HETATM 5263 O O . HOH DA 7 . ? -17.895 -20.887 16.460 1.00 88.98 ? 854 HOH A O 1 HETATM 5264 O O . HOH DA 7 . ? 15.404 -2.654 -2.949 1.00 75.37 ? 855 HOH A O 1 HETATM 5265 O O . HOH DA 7 . ? 31.956 3.202 30.928 1.00 49.34 ? 856 HOH A O 1 HETATM 5266 O O . HOH DA 7 . ? -10.536 -22.226 12.244 1.00 89.06 ? 857 HOH A O 1 HETATM 5267 O O . HOH DA 7 . ? 5.137 -24.732 19.181 1.00 73.91 ? 858 HOH A O 1 HETATM 5268 O O . HOH DA 7 . ? 2.843 -27.531 17.812 1.00 53.50 ? 859 HOH A O 1 HETATM 5269 O O . HOH DA 7 . ? -7.817 2.330 -7.553 1.00 56.60 ? 860 HOH A O 1 HETATM 5270 O O . HOH DA 7 . ? 9.582 -7.879 1.083 1.00 58.14 ? 861 HOH A O 1 HETATM 5271 O O . HOH DA 7 . ? 8.909 2.932 4.156 1.00 60.98 ? 862 HOH A O 1 HETATM 5272 O O . HOH DA 7 . ? 0.147 -28.950 19.048 1.00 78.74 ? 863 HOH A O 1 HETATM 5273 O O . HOH DA 7 . ? 21.076 18.431 21.808 1.00 58.25 ? 864 HOH A O 1 HETATM 5274 O O . HOH DA 7 . ? -12.096 14.009 5.515 1.00 59.22 ? 865 HOH A O 1 HETATM 5275 O O . HOH DA 7 . ? 16.229 -4.052 55.365 1.00 74.50 ? 866 HOH A O 1 HETATM 5276 O O . HOH DA 7 . ? 31.796 20.615 19.051 1.00 63.62 ? 867 HOH A O 1 HETATM 5277 O O . HOH DA 7 . ? 23.884 -1.594 45.307 1.00 51.39 ? 868 HOH A O 1 HETATM 5278 O O . HOH DA 7 . ? 8.791 -21.987 17.877 1.00 41.16 ? 869 HOH A O 1 HETATM 5279 O O . HOH DA 7 . ? 5.606 -20.749 27.687 1.00 46.22 ? 870 HOH A O 1 HETATM 5280 O O . HOH DA 7 . ? 12.190 -23.988 28.791 1.00 40.77 ? 871 HOH A O 1 HETATM 5281 O O . HOH DA 7 . ? 15.560 22.852 23.769 1.00 35.98 ? 872 HOH A O 1 # loop_ _pdbx_poly_seq_scheme.asym_id _pdbx_poly_seq_scheme.entity_id _pdbx_poly_seq_scheme.seq_id _pdbx_poly_seq_scheme.mon_id _pdbx_poly_seq_scheme.ndb_seq_num _pdbx_poly_seq_scheme.pdb_seq_num _pdbx_poly_seq_scheme.auth_seq_num _pdbx_poly_seq_scheme.pdb_mon_id _pdbx_poly_seq_scheme.auth_mon_id _pdbx_poly_seq_scheme.pdb_strand_id _pdbx_poly_seq_scheme.pdb_ins_code _pdbx_poly_seq_scheme.hetero A 1 1 SER 1 1 1 SER SER A . n A 1 2 TRP 2 2 2 TRP TRP A . n A 1 3 GLU 3 3 3 GLU GLU A . n A 1 4 VAL 4 4 4 VAL VAL A . n A 1 5 GLY 5 5 5 GLY GLY A . n A 1 6 CYS 6 6 6 CYS CYS A . n A 1 7 GLY 7 7 7 GLY GLY A . n A 1 8 ALA 8 8 8 ALA ALA A . n A 1 9 PRO 9 9 9 PRO PRO A . n A 1 10 VAL 10 10 10 VAL VAL A . n A 1 11 PRO 11 11 11 PRO PRO A . n A 1 12 LEU 12 12 12 LEU LEU A . n A 1 13 VAL 13 13 13 VAL VAL A . n A 1 14 LYS 14 14 14 LYS LYS A . n A 1 15 CYS 15 15 15 CYS CYS A . n A 1 16 ASP 16 16 16 ASP ASP A . n A 1 17 GLU 17 17 17 GLU GLU A . n A 1 18 ASN 18 18 18 ASN ASN A . n A 1 19 SER 19 19 19 SER SER A . n A 1 20 PRO 20 20 20 PRO PRO A . n A 1 21 TYR 21 21 21 TYR TYR A . n A 1 22 ARG 22 22 22 ARG ARG A . n A 1 23 THR 23 23 23 THR THR A . n A 1 24 ILE 24 24 24 ILE ILE A . n A 1 25 THR 25 25 25 THR THR A . n A 1 26 GLY 26 26 26 GLY GLY A . n A 1 27 ASP 27 27 27 ASP ASP A . n A 1 28 CYS 28 28 28 CYS CYS A . n A 1 29 ASN 29 29 29 ASN ASN A . n A 1 30 ASN 30 30 30 ASN ASN A . n A 1 31 ARG 31 31 31 ARG ARG A . n A 1 32 ARG 32 32 32 ARG ARG A . n A 1 33 SER 33 33 33 SER SER A . n A 1 34 PRO 34 34 34 PRO PRO A . n A 1 35 ALA 35 35 35 ALA ALA A . n A 1 36 LEU 36 36 36 LEU LEU A . n A 1 37 GLY 37 37 37 GLY GLY A . n A 1 38 ALA 38 38 38 ALA ALA A . n A 1 39 ALA 39 39 39 ALA ALA A . n A 1 40 ASN 40 40 40 ASN ASN A . n A 1 41 ARG 41 41 41 ARG ARG A . n A 1 42 ALA 42 42 42 ALA ALA A . n A 1 43 LEU 43 43 43 LEU LEU A . n A 1 44 ALA 44 44 44 ALA ALA A . n A 1 45 ARG 45 45 45 ARG ARG A . n A 1 46 TRP 46 46 46 TRP TRP A . n A 1 47 LEU 47 47 47 LEU LEU A . n A 1 48 PRO 48 48 48 PRO PRO A . n A 1 49 ALA 49 49 49 ALA ALA A . n A 1 50 GLU 50 50 50 GLU GLU A . n A 1 51 TYR 51 51 51 TYR TYR A . n A 1 52 GLU 52 52 52 GLU GLU A . n A 1 53 ASP 53 53 53 ASP ASP A . n A 1 54 GLY 54 54 54 GLY GLY A . n A 1 55 LEU 55 55 55 LEU LEU A . n A 1 56 ALA 56 56 56 ALA ALA A . n A 1 57 LEU 57 57 57 LEU LEU A . n A 1 58 PRO 58 58 58 PRO PRO A . n A 1 59 PHE 59 59 59 PHE PHE A . n A 1 60 GLY 60 60 60 GLY GLY A . n A 1 61 TRP 61 61 61 TRP TRP A . n A 1 62 THR 62 62 62 THR THR A . n A 1 63 GLN 63 63 63 GLN GLN A . n A 1 64 ARG 64 64 64 ARG ARG A . n A 1 65 LYS 65 65 65 LYS LYS A . n A 1 66 THR 66 66 66 THR THR A . n A 1 67 ARG 67 67 67 ARG ARG A . n A 1 68 ASN 68 68 68 ASN ASN A . n A 1 69 GLY 69 69 69 GLY GLY A . n A 1 70 PHE 70 70 70 PHE PHE A . n A 1 71 ARG 71 71 71 ARG ARG A . n A 1 72 VAL 72 72 72 VAL VAL A . n A 1 73 PRO 73 73 73 PRO PRO A . n A 1 74 LEU 74 74 74 LEU LEU A . n A 1 75 ALA 75 75 75 ALA ALA A . n A 1 76 ARG 76 76 76 ARG ARG A . n A 1 77 GLU 77 77 77 GLU GLU A . n A 1 78 VAL 78 78 78 VAL VAL A . n A 1 79 SER 79 79 79 SER SER A . n A 1 80 ASN 80 80 80 ASN ASN A . n A 1 81 LYS 81 81 81 LYS LYS A . n A 1 82 ILE 82 82 82 ILE ILE A . n A 1 83 VAL 83 83 83 VAL VAL A . n A 1 84 GLY 84 84 84 GLY GLY A . n A 1 85 TYR 85 85 85 TYR TYR A . n A 1 86 LEU 86 86 86 LEU LEU A . n A 1 87 ASP 87 87 87 ASP ASP A . n A 1 88 GLU 88 88 88 GLU GLU A . n A 1 89 GLU 89 89 89 GLU GLU A . n A 1 90 GLY 90 90 90 GLY GLY A . n A 1 91 VAL 91 91 91 VAL VAL A . n A 1 92 LEU 92 92 92 LEU LEU A . n A 1 93 ASP 93 93 93 ASP ASP A . n A 1 94 GLN 94 94 94 GLN GLN A . n A 1 95 ASN 95 95 95 ASN ASN A . n A 1 96 ARG 96 96 96 ARG ARG A . n A 1 97 SER 97 97 97 SER SER A . n A 1 98 LEU 98 98 98 LEU LEU A . n A 1 99 LEU 99 99 99 LEU LEU A . n A 1 100 PHE 100 100 100 PHE PHE A . n A 1 101 MET 101 101 101 MET MET A . n A 1 102 GLN 102 102 102 GLN GLN A . n A 1 103 TRP 103 103 103 TRP TRP A . n A 1 104 GLY 104 104 104 GLY GLY A . n A 1 105 GLN 105 105 105 GLN GLN A . n A 1 106 ILE 106 106 106 ILE ILE A . n A 1 107 VAL 107 107 107 VAL VAL A . n A 1 108 ASP 108 108 108 ASP ASP A . n A 1 109 HIS 109 109 109 HIS HIS A . n A 1 110 ASP 110 110 110 ASP ASP A . n A 1 111 LEU 111 111 111 LEU LEU A . n A 1 112 ASP 112 112 112 ASP ASP A . n A 1 113 PHE 113 113 113 PHE PHE A . n A 1 114 ALA 114 114 114 ALA ALA A . n A 1 115 PRO 115 115 115 PRO PRO A . n A 1 116 GLU 116 116 116 GLU GLU A . n A 1 117 THR 117 117 117 THR THR A . n A 1 118 GLU 118 118 118 GLU GLU A . n A 1 119 LEU 119 119 119 LEU LEU A . n A 1 120 GLY 120 120 120 GLY GLY A . n A 1 121 SER 121 121 121 SER SER A . n A 1 122 ASN 122 122 122 ASN ASN A . n A 1 123 GLU 123 123 123 GLU GLU A . n A 1 124 HIS 124 124 124 HIS HIS A . n A 1 125 SER 125 125 125 SER SER A . n A 1 126 LYS 126 126 126 LYS LYS A . n A 1 127 THR 127 127 127 THR THR A . n A 1 128 GLN 128 128 128 GLN GLN A . n A 1 129 CYS 129 129 129 CYS CYS A . n A 1 130 GLU 130 130 130 GLU GLU A . n A 1 131 GLU 131 131 131 GLU GLU A . n A 1 132 TYR 132 132 132 TYR TYR A . n A 1 133 CYS 133 133 133 CYS CYS A . n A 1 134 ILE 134 134 134 ILE ILE A . n A 1 135 GLN 135 135 135 GLN GLN A . n A 1 136 GLY 136 136 136 GLY GLY A . n A 1 137 ASP 137 137 137 ASP ASP A . n A 1 138 ASN 138 138 138 ASN ASN A . n A 1 139 CYS 139 139 139 CYS CYS A . n A 1 140 PHE 140 140 140 PHE PHE A . n A 1 141 PRO 141 141 141 PRO PRO A . n A 1 142 ILE 142 142 142 ILE ILE A . n A 1 143 MET 143 143 143 MET MET A . n A 1 144 PHE 144 144 144 PHE PHE A . n A 1 145 PRO 145 145 145 PRO PRO A . n A 1 146 LYS 146 146 146 LYS LYS A . n A 1 147 ASN 147 147 147 ASN ASN A . n A 1 148 ASP 148 148 148 ASP ASP A . n A 1 149 PRO 149 149 149 PRO PRO A . n A 1 150 LYS 150 150 150 LYS LYS A . n A 1 151 LEU 151 151 151 LEU LEU A . n A 1 152 LYS 152 152 152 LYS LYS A . n A 1 153 THR 153 153 153 THR THR A . n A 1 154 GLN 154 154 154 GLN GLN A . n A 1 155 GLY 155 155 155 GLY GLY A . n A 1 156 LYS 156 156 156 LYS LYS A . n A 1 157 CYS 157 157 157 CYS CYS A . n A 1 158 MET 158 158 158 MET MET A . n A 1 159 PRO 159 159 159 PRO PRO A . n A 1 160 PHE 160 160 160 PHE PHE A . n A 1 161 PHE 161 161 161 PHE PHE A . n A 1 162 ARG 162 162 162 ARG ARG A . n A 1 163 ALA 163 163 163 ALA ALA A . n A 1 164 GLY 164 164 164 GLY GLY A . n A 1 165 PHE 165 165 165 PHE PHE A . n A 1 166 VAL 166 166 166 VAL VAL A . n A 1 167 CYS 167 167 167 CYS CYS A . n A 1 168 PRO 168 168 168 PRO PRO A . n A 1 169 THR 169 169 169 THR THR A . n A 1 170 PRO 170 170 170 PRO PRO A . n A 1 171 PRO 171 171 171 PRO PRO A . n A 1 172 TYR 172 172 172 TYR TYR A . n A 1 173 GLN 173 173 173 GLN GLN A . n A 1 174 SER 174 174 174 SER SER A . n A 1 175 LEU 175 175 175 LEU LEU A . n A 1 176 ALA 176 176 176 ALA ALA A . n A 1 177 ARG 177 177 177 ARG ARG A . n A 1 178 GLU 178 178 178 GLU GLU A . n A 1 179 GLN 179 179 179 GLN GLN A . n A 1 180 ILE 180 180 180 ILE ILE A . n A 1 181 ASN 181 181 181 ASN ASN A . n A 1 182 ALA 182 182 182 ALA ALA A . n A 1 183 VAL 183 183 183 VAL VAL A . n A 1 184 THR 184 184 184 THR THR A . n A 1 185 SER 185 185 185 SER SER A . n A 1 186 PHE 186 186 186 PHE PHE A . n A 1 187 LEU 187 187 187 LEU LEU A . n A 1 188 ASP 188 188 188 ASP ASP A . n A 1 189 ALA 189 189 189 ALA ALA A . n A 1 190 SER 190 190 190 SER SER A . n A 1 191 LEU 191 191 191 LEU LEU A . n A 1 192 VAL 192 192 192 VAL VAL A . n A 1 193 TYR 193 193 193 TYR TYR A . n A 1 194 GLY 194 194 194 GLY GLY A . n A 1 195 SER 195 195 195 SER SER A . n A 1 196 GLU 196 196 196 GLU GLU A . n A 1 197 PRO 197 197 197 PRO PRO A . n A 1 198 SEP 198 198 198 SEP SEP A . n A 1 199 LEU 199 199 199 LEU LEU A . n A 1 200 ALA 200 200 200 ALA ALA A . n A 1 201 SER 201 201 201 SER SER A . n A 1 202 ARG 202 202 202 ARG ARG A . n A 1 203 LEU 203 203 203 LEU LEU A . n A 1 204 ARG 204 204 204 ARG ARG A . n A 1 205 ASN 205 205 205 ASN ASN A . n A 1 206 LEU 206 206 206 LEU LEU A . n A 1 207 SER 207 207 207 SER SER A . n A 1 208 SER 208 208 208 SER SER A . n A 1 209 PRO 209 209 209 PRO PRO A . n A 1 210 LEU 210 210 210 LEU LEU A . n A 1 211 GLY 211 211 211 GLY GLY A . n A 1 212 LEU 212 212 212 LEU LEU A . n A 1 213 MET 213 213 213 MET MET A . n A 1 214 ALA 214 214 214 ALA ALA A . n A 1 215 VAL 215 215 215 VAL VAL A . n A 1 216 ASN 216 216 216 ASN ASN A . n A 1 217 GLN 217 217 217 GLN GLN A . n A 1 218 GLU 218 218 218 GLU GLU A . n A 1 219 ALA 219 219 219 ALA ALA A . n A 1 220 TRP 220 220 220 TRP TRP A . n A 1 221 ASP 221 221 221 ASP ASP A . n A 1 222 HIS 222 222 222 HIS HIS A . n A 1 223 GLY 223 223 223 GLY GLY A . n A 1 224 LEU 224 224 224 LEU LEU A . n A 1 225 ALA 225 225 225 ALA ALA A . n A 1 226 TYR 226 226 226 TYR TYR A . n A 1 227 LEU 227 227 227 LEU LEU A . n A 1 228 PRO 228 228 228 PRO PRO A . n A 1 229 PHE 229 229 229 PHE PHE A . n A 1 230 ASN 230 230 230 ASN ASN A . n A 1 231 ASN 231 231 231 ASN ASN A . n A 1 232 LYS 232 232 232 LYS LYS A . n A 1 233 LYS 233 233 233 LYS LYS A . n A 1 234 PRO 234 234 234 PRO PRO A . n A 1 235 SER 235 235 235 SER SER A . n A 1 236 PRO 236 236 236 PRO PRO A . n A 1 237 CYS 237 237 237 CYS CYS A . n A 1 238 GLU 238 238 238 GLU GLU A . n A 1 239 PHE 239 239 239 PHE PHE A . n A 1 240 ILE 240 240 240 ILE ILE A . n A 1 241 ASN 241 241 241 ASN ASN A . n A 1 242 THR 242 242 242 THR THR A . n A 1 243 THR 243 243 243 THR THR A . n A 1 244 ALA 244 244 244 ALA ALA A . n A 1 245 ARG 245 245 245 ARG ARG A . n A 1 246 VAL 246 246 246 VAL VAL A . n A 1 247 PRO 247 247 247 PRO PRO A . n A 1 248 CYS 248 248 248 CYS CYS A . n A 1 249 PHE 249 249 249 PHE PHE A . n A 1 250 LEU 250 250 250 LEU LEU A . n A 1 251 ALA 251 251 251 ALA ALA A . n A 1 252 GLY 252 252 252 GLY GLY A . n A 1 253 ASP 253 253 253 ASP ASP A . n A 1 254 PHE 254 254 254 PHE PHE A . n A 1 255 ARG 255 255 255 ARG ARG A . n A 1 256 ALA 256 256 256 ALA ALA A . n A 1 257 SER 257 257 257 SER SER A . n A 1 258 GLU 258 258 258 GLU GLU A . n A 1 259 GLN 259 259 259 GLN GLN A . n A 1 260 ILE 260 260 260 ILE ILE A . n A 1 261 LEU 261 261 261 LEU LEU A . n A 1 262 LEU 262 262 262 LEU LEU A . n A 1 263 ALA 263 263 263 ALA ALA A . n A 1 264 THR 264 264 264 THR THR A . n A 1 265 ALA 265 265 265 ALA ALA A . n A 1 266 HIS 266 266 266 HIS HIS A . n A 1 267 THR 267 267 267 THR THR A . n A 1 268 LEU 268 268 268 LEU LEU A . n A 1 269 LEU 269 269 269 LEU LEU A . n A 1 270 LEU 270 270 270 LEU LEU A . n A 1 271 ARG 271 271 271 ARG ARG A . n A 1 272 GLU 272 272 272 GLU GLU A . n A 1 273 HIS 273 273 273 HIS HIS A . n A 1 274 ASN 274 274 274 ASN ASN A . n A 1 275 ARG 275 275 275 ARG ARG A . n A 1 276 LEU 276 276 276 LEU LEU A . n A 1 277 ALA 277 277 277 ALA ALA A . n A 1 278 ARG 278 278 278 ARG ARG A . n A 1 279 GLU 279 279 279 GLU GLU A . n A 1 280 LEU 280 280 280 LEU LEU A . n A 1 281 LYS 281 281 281 LYS LYS A . n A 1 282 LYS 282 282 282 LYS LYS A . n A 1 283 LEU 283 283 283 LEU LEU A . n A 1 284 ASN 284 284 284 ASN ASN A . n A 1 285 PRO 285 285 285 PRO PRO A . n A 1 286 HIS 286 286 286 HIS HIS A . n A 1 287 TRP 287 287 287 TRP TRP A . n A 1 288 ASN 288 288 288 ASN ASN A . n A 1 289 GLY 289 289 289 GLY GLY A . n A 1 290 GLU 290 290 290 GLU GLU A . n A 1 291 LYS 291 291 291 LYS LYS A . n A 1 292 LEU 292 292 292 LEU LEU A . n A 1 293 TYR 293 293 293 TYR TYR A . n A 1 294 GLN 294 294 294 GLN GLN A . n A 1 295 GLU 295 295 295 GLU GLU A . n A 1 296 ALA 296 296 296 ALA ALA A . n A 1 297 ARG 297 297 297 ARG ARG A . n A 1 298 LYS 298 298 298 LYS LYS A . n A 1 299 ILE 299 299 299 ILE ILE A . n A 1 300 LEU 300 300 300 LEU LEU A . n A 1 301 GLY 301 301 301 GLY GLY A . n A 1 302 ALA 302 302 302 ALA ALA A . n A 1 303 PHE 303 303 303 PHE PHE A . n A 1 304 ILE 304 304 304 ILE ILE A . n A 1 305 GLN 305 305 305 GLN GLN A . n A 1 306 ILE 306 306 306 ILE ILE A . n A 1 307 ILE 307 307 307 ILE ILE A . n A 1 308 THR 308 308 308 THR THR A . n A 1 309 PHE 309 309 309 PHE PHE A . n A 1 310 ARG 310 310 310 ARG ARG A . n A 1 311 ASP 311 311 311 ASP ASP A . n A 1 312 TYR 312 312 312 TYR TYR A . n A 1 313 LEU 313 313 313 LEU LEU A . n A 1 314 PRO 314 314 314 PRO PRO A . n A 1 315 ILE 315 315 315 ILE ILE A . n A 1 316 VAL 316 316 316 VAL VAL A . n A 1 317 LEU 317 317 317 LEU LEU A . n A 1 318 GLY 318 318 318 GLY GLY A . n A 1 319 SER 319 319 319 SER SER A . n A 1 320 GLU 320 320 320 GLU GLU A . n A 1 321 MET 321 321 321 MET MET A . n A 1 322 GLN 322 322 322 GLN GLN A . n A 1 323 LYS 323 323 323 LYS LYS A . n A 1 324 TRP 324 324 324 TRP TRP A . n A 1 325 ILE 325 325 325 ILE ILE A . n A 1 326 PRO 326 326 326 PRO PRO A . n A 1 327 PRO 327 327 327 PRO PRO A . n A 1 328 TYR 328 328 328 TYR TYR A . n A 1 329 GLN 329 329 329 GLN GLN A . n A 1 330 GLY 330 330 330 GLY GLY A . n A 1 331 TYR 331 331 331 TYR TYR A . n A 1 332 ASN 332 332 332 ASN ASN A . n A 1 333 ASN 333 333 333 ASN ASN A . n A 1 334 SER 334 334 334 SER SER A . n A 1 335 VAL 335 335 335 VAL VAL A . n A 1 336 ASP 336 336 336 ASP ASP A . n A 1 337 PRO 337 337 337 PRO PRO A . n A 1 338 ARG 338 338 338 ARG ARG A . n A 1 339 ILE 339 339 339 ILE ILE A . n A 1 340 SER 340 340 340 SER SER A . n A 1 341 ASN 341 341 341 ASN ASN A . n A 1 342 VAL 342 342 342 VAL VAL A . n A 1 343 PHE 343 343 343 PHE PHE A . n A 1 344 THR 344 344 344 THR THR A . n A 1 345 PHE 345 345 345 PHE PHE A . n A 1 346 ALA 346 346 346 ALA ALA A . n A 1 347 PHE 347 347 347 PHE PHE A . n A 1 348 ARG 348 348 348 ARG ARG A . n A 1 349 PHE 349 349 349 PHE PHE A . n A 1 350 GLY 350 350 350 GLY GLY A . n A 1 351 HIS 351 351 351 HIS HIS A . n A 1 352 MET 352 352 352 MET MET A . n A 1 353 GLU 353 353 353 GLU GLU A . n A 1 354 VAL 354 354 354 VAL VAL A . n A 1 355 PRO 355 355 355 PRO PRO A . n A 1 356 SER 356 356 356 SER SER A . n A 1 357 THR 357 357 357 THR THR A . n A 1 358 VAL 358 358 358 VAL VAL A . n A 1 359 SER 359 359 359 SER SER A . n A 1 360 ARG 360 360 360 ARG ARG A . n A 1 361 LEU 361 361 361 LEU LEU A . n A 1 362 ASP 362 362 362 ASP ASP A . n A 1 363 GLU 363 363 363 GLU GLU A . n A 1 364 ASN 364 364 364 ASN ASN A . n A 1 365 TYR 365 365 365 TYR TYR A . n A 1 366 GLN 366 366 366 GLN GLN A . n A 1 367 PRO 367 367 367 PRO PRO A . n A 1 368 TRP 368 368 368 TRP TRP A . n A 1 369 GLY 369 369 369 GLY GLY A . n A 1 370 PRO 370 370 370 PRO PRO A . n A 1 371 GLU 371 371 371 GLU GLU A . n A 1 372 ALA 372 372 372 ALA ALA A . n A 1 373 GLU 373 373 373 GLU GLU A . n A 1 374 LEU 374 374 374 LEU LEU A . n A 1 375 PRO 375 375 375 PRO PRO A . n A 1 376 LEU 376 376 376 LEU LEU A . n A 1 377 HIS 377 377 377 HIS HIS A . n A 1 378 THR 378 378 378 THR THR A . n A 1 379 LEU 379 379 379 LEU LEU A . n A 1 380 PHE 380 380 380 PHE PHE A . n A 1 381 PHE 381 381 381 PHE PHE A . n A 1 382 ASN 382 382 382 ASN ASN A . n A 1 383 THR 383 383 383 THR THR A . n A 1 384 TRP 384 384 384 TRP TRP A . n A 1 385 ARG 385 385 385 ARG ARG A . n A 1 386 ILE 386 386 386 ILE ILE A . n A 1 387 ILE 387 387 387 ILE ILE A . n A 1 388 LYS 388 388 388 LYS LYS A . n A 1 389 ASP 389 389 389 ASP ASP A . n A 1 390 GLY 390 390 390 GLY GLY A . n A 1 391 GLY 391 391 391 GLY GLY A . n A 1 392 ILE 392 392 392 ILE ILE A . n A 1 393 ASP 393 393 393 ASP ASP A . n A 1 394 PRO 394 394 394 PRO PRO A . n A 1 395 LEU 395 395 395 LEU LEU A . n A 1 396 VAL 396 396 396 VAL VAL A . n A 1 397 ARG 397 397 397 ARG ARG A . n A 1 398 GLY 398 398 398 GLY GLY A . n A 1 399 LEU 399 399 399 LEU LEU A . n A 1 400 LEU 400 400 400 LEU LEU A . n A 1 401 ALA 401 401 401 ALA ALA A . n A 1 402 LYS 402 402 402 LYS LYS A . n A 1 403 LYS 403 403 403 LYS LYS A . n A 1 404 SER 404 404 404 SER SER A . n A 1 405 LYS 405 405 405 LYS LYS A . n A 1 406 LEU 406 406 406 LEU LEU A . n A 1 407 MET 407 407 407 MET MET A . n A 1 408 ASN 408 408 408 ASN ASN A . n A 1 409 GLN 409 409 409 GLN GLN A . n A 1 410 ASP 410 410 410 ASP ASP A . n A 1 411 LYS 411 411 411 LYS LYS A . n A 1 412 MET 412 412 412 MET MET A . n A 1 413 VAL 413 413 413 VAL VAL A . n A 1 414 THR 414 414 414 THR THR A . n A 1 415 SER 415 415 415 SER SER A . n A 1 416 GLU 416 416 416 GLU GLU A . n A 1 417 LEU 417 417 417 LEU LEU A . n A 1 418 ARG 418 418 418 ARG ARG A . n A 1 419 ASN 419 419 419 ASN ASN A . n A 1 420 LYS 420 420 420 LYS LYS A . n A 1 421 LEU 421 421 421 LEU LEU A . n A 1 422 PHE 422 422 422 PHE PHE A . n A 1 423 GLN 423 423 423 GLN GLN A . n A 1 424 PRO 424 424 424 PRO PRO A . n A 1 425 THR 425 425 425 THR THR A . n A 1 426 HIS 426 426 426 HIS HIS A . n A 1 427 LYS 427 427 427 LYS LYS A . n A 1 428 ILE 428 428 428 ILE ILE A . n A 1 429 HIS 429 429 429 HIS HIS A . n A 1 430 GLY 430 430 430 GLY GLY A . n A 1 431 PHE 431 431 431 PHE PHE A . n A 1 432 ASP 432 432 432 ASP ASP A . n A 1 433 LEU 433 433 433 LEU LEU A . n A 1 434 ALA 434 434 434 ALA ALA A . n A 1 435 ALA 435 435 435 ALA ALA A . n A 1 436 ILE 436 436 436 ILE ILE A . n A 1 437 ASN 437 437 437 ASN ASN A . n A 1 438 LEU 438 438 438 LEU LEU A . n A 1 439 GLN 439 439 439 GLN GLN A . n A 1 440 ARG 440 440 440 ARG ARG A . n A 1 441 CYS 441 441 441 CYS CYS A . n A 1 442 ARG 442 442 442 ARG ARG A . n A 1 443 ASP 443 443 443 ASP ASP A . n A 1 444 HIS 444 444 444 HIS HIS A . n A 1 445 GLY 445 445 445 GLY GLY A . n A 1 446 MET 446 446 446 MET MET A . n A 1 447 PRO 447 447 447 PRO PRO A . n A 1 448 GLY 448 448 448 GLY GLY A . n A 1 449 TYR 449 449 449 TYR TYR A . n A 1 450 ASN 450 450 450 ASN ASN A . n A 1 451 SER 451 451 451 SER SER A . n A 1 452 TRP 452 452 452 TRP TRP A . n A 1 453 ARG 453 453 453 ARG ARG A . n A 1 454 GLY 454 454 454 GLY GLY A . n A 1 455 PHE 455 455 455 PHE PHE A . n A 1 456 CYS 456 456 456 CYS CYS A . n A 1 457 GLY 457 457 457 GLY GLY A . n A 1 458 LEU 458 458 458 LEU LEU A . n A 1 459 SER 459 459 459 SER SER A . n A 1 460 GLN 460 460 460 GLN GLN A . n A 1 461 PRO 461 461 461 PRO PRO A . n A 1 462 LYS 462 462 462 LYS LYS A . n A 1 463 THR 463 463 463 THR THR A . n A 1 464 LEU 464 464 464 LEU LEU A . n A 1 465 LYS 465 465 465 LYS LYS A . n A 1 466 GLY 466 466 466 GLY GLY A . n A 1 467 LEU 467 467 467 LEU LEU A . n A 1 468 GLN 468 468 468 GLN GLN A . n A 1 469 THR 469 469 469 THR THR A . n A 1 470 VAL 470 470 470 VAL VAL A . n A 1 471 LEU 471 471 471 LEU LEU A . n A 1 472 LYS 472 472 472 LYS LYS A . n A 1 473 ASN 473 473 473 ASN ASN A . n A 1 474 LYS 474 474 474 LYS LYS A . n A 1 475 ILE 475 475 475 ILE ILE A . n A 1 476 LEU 476 476 476 LEU LEU A . n A 1 477 ALA 477 477 477 ALA ALA A . n A 1 478 LYS 478 478 478 LYS LYS A . n A 1 479 LYS 479 479 479 LYS LYS A . n A 1 480 LEU 480 480 480 LEU LEU A . n A 1 481 MET 481 481 481 MET MET A . n A 1 482 ASP 482 482 482 ASP ASP A . n A 1 483 LEU 483 483 483 LEU LEU A . n A 1 484 TYR 484 484 484 TYR TYR A . n A 1 485 LYS 485 485 485 LYS LYS A . n A 1 486 THR 486 486 486 THR THR A . n A 1 487 PRO 487 487 487 PRO PRO A . n A 1 488 ASP 488 488 488 ASP ASP A . n A 1 489 ASN 489 489 489 ASN ASN A . n A 1 490 ILE 490 490 490 ILE ILE A . n A 1 491 ASP 491 491 491 ASP ASP A . n A 1 492 ILE 492 492 492 ILE ILE A . n A 1 493 TRP 493 493 493 TRP TRP A . n A 1 494 ILE 494 494 494 ILE ILE A . n A 1 495 GLY 495 495 495 GLY GLY A . n A 1 496 GLY 496 496 496 GLY GLY A . n A 1 497 ASN 497 497 497 ASN ASN A . n A 1 498 ALA 498 498 498 ALA ALA A . n A 1 499 GLU 499 499 499 GLU GLU A . n A 1 500 PRO 500 500 500 PRO PRO A . n A 1 501 MET 501 501 501 MET MET A . n A 1 502 VAL 502 502 502 VAL VAL A . n A 1 503 GLU 503 503 503 GLU GLU A . n A 1 504 ARG 504 504 504 ARG ARG A . n A 1 505 GLY 505 505 505 GLY GLY A . n A 1 506 ARG 506 506 506 ARG ARG A . n A 1 507 VAL 507 507 507 VAL VAL A . n A 1 508 GLY 508 508 508 GLY GLY A . n A 1 509 PRO 509 509 509 PRO PRO A . n A 1 510 LEU 510 510 510 LEU LEU A . n A 1 511 LEU 511 511 511 LEU LEU A . n A 1 512 ALA 512 512 512 ALA ALA A . n A 1 513 CYS 513 513 513 CYS CYS A . n A 1 514 LEU 514 514 514 LEU LEU A . n A 1 515 LEU 515 515 515 LEU LEU A . n A 1 516 GLY 516 516 516 GLY GLY A . n A 1 517 ARG 517 517 517 ARG ARG A . n A 1 518 GLN 518 518 518 GLN GLN A . n A 1 519 PHE 519 519 519 PHE PHE A . n A 1 520 GLN 520 520 520 GLN GLN A . n A 1 521 GLN 521 521 521 GLN GLN A . n A 1 522 ILE 522 522 522 ILE ILE A . n A 1 523 ARG 523 523 523 ARG ARG A . n A 1 524 ASP 524 524 524 ASP ASP A . n A 1 525 GLY 525 525 525 GLY GLY A . n A 1 526 ASP 526 526 526 ASP ASP A . n A 1 527 ARG 527 527 527 ARG ARG A . n A 1 528 PHE 528 528 528 PHE PHE A . n A 1 529 TRP 529 529 529 TRP TRP A . n A 1 530 TRP 530 530 530 TRP TRP A . n A 1 531 GLU 531 531 531 GLU GLU A . n A 1 532 ASN 532 532 532 ASN ASN A . n A 1 533 PRO 533 533 533 PRO PRO A . n A 1 534 GLY 534 534 534 GLY GLY A . n A 1 535 VAL 535 535 535 VAL VAL A . n A 1 536 PHE 536 536 536 PHE PHE A . n A 1 537 THR 537 537 537 THR THR A . n A 1 538 GLU 538 538 538 GLU GLU A . n A 1 539 LYS 539 539 539 LYS LYS A . n A 1 540 GLN 540 540 540 GLN GLN A . n A 1 541 ARG 541 541 541 ARG ARG A . n A 1 542 ASP 542 542 542 ASP ASP A . n A 1 543 SER 543 543 543 SER SER A . n A 1 544 LEU 544 544 544 LEU LEU A . n A 1 545 GLN 545 545 545 GLN GLN A . n A 1 546 LYS 546 546 546 LYS LYS A . n A 1 547 VAL 547 547 547 VAL VAL A . n A 1 548 SER 548 548 548 SER SER A . n A 1 549 PHE 549 549 549 PHE PHE A . n A 1 550 SER 550 550 550 SER SER A . n A 1 551 ARG 551 551 551 ARG ARG A . n A 1 552 LEU 552 552 552 LEU LEU A . n A 1 553 ILE 553 553 553 ILE ILE A . n A 1 554 CYS 554 554 554 CYS CYS A . n A 1 555 ASP 555 555 555 ASP ASP A . n A 1 556 ASN 556 556 556 ASN ASN A . n A 1 557 THR 557 557 557 THR THR A . n A 1 558 HIS 558 558 558 HIS HIS A . n A 1 559 ILE 559 559 559 ILE ILE A . n A 1 560 THR 560 560 560 THR THR A . n A 1 561 LYS 561 561 561 LYS LYS A . n A 1 562 VAL 562 562 562 VAL VAL A . n A 1 563 PRO 563 563 563 PRO PRO A . n A 1 564 LEU 564 564 564 LEU LEU A . n A 1 565 HIS 565 565 565 HIS HIS A . n A 1 566 ALA 566 566 566 ALA ALA A . n A 1 567 PHE 567 567 567 PHE PHE A . n A 1 568 GLN 568 568 568 GLN GLN A . n A 1 569 ALA 569 569 569 ALA ALA A . n A 1 570 ASN 570 570 570 ASN ASN A . n A 1 571 ASN 571 571 571 ASN ASN A . n A 1 572 TYR 572 572 572 TYR TYR A . n A 1 573 PRO 573 573 573 PRO PRO A . n A 1 574 HIS 574 574 574 HIS HIS A . n A 1 575 ASP 575 575 575 ASP ASP A . n A 1 576 PHE 576 576 576 PHE PHE A . n A 1 577 VAL 577 577 577 VAL VAL A . n A 1 578 ASP 578 578 578 ASP ASP A . n A 1 579 CYS 579 579 579 CYS CYS A . n A 1 580 SER 580 580 580 SER SER A . n A 1 581 THR 581 581 581 THR THR A . n A 1 582 VAL 582 582 582 VAL VAL A . n A 1 583 ASP 583 583 583 ASP ASP A . n A 1 584 LYS 584 584 584 LYS LYS A . n A 1 585 LEU 585 585 585 LEU LEU A . n A 1 586 ASP 586 586 586 ASP ASP A . n A 1 587 LEU 587 587 587 LEU LEU A . n A 1 588 SER 588 588 588 SER SER A . n A 1 589 PRO 589 589 589 PRO PRO A . n A 1 590 TRP 590 590 590 TRP TRP A . n A 1 591 ALA 591 591 591 ALA ALA A . n A 1 592 SER 592 592 592 SER SER A . n A 1 593 ARG 593 593 593 ARG ARG A . n A 1 594 GLU 594 594 594 GLU GLU A . n A 1 595 ASN 595 595 595 ASN ASN A . n # loop_ _pdbx_nonpoly_scheme.asym_id _pdbx_nonpoly_scheme.entity_id _pdbx_nonpoly_scheme.mon_id _pdbx_nonpoly_scheme.ndb_seq_num _pdbx_nonpoly_scheme.pdb_seq_num _pdbx_nonpoly_scheme.auth_seq_num _pdbx_nonpoly_scheme.pdb_mon_id _pdbx_nonpoly_scheme.auth_mon_id _pdbx_nonpoly_scheme.pdb_strand_id _pdbx_nonpoly_scheme.pdb_ins_code B 2 NAG 1 596 1 NAG NAG A . C 2 NAG 2 597 2 NAG NAG A . D 3 MAN 3 598 10 MAN MAN A . E 2 NAG 1 599 3 NAG NAG A . F 2 NAG 2 600 4 NAG NAG A . G 2 NAG 1 601 5 NAG NAG A . H 2 NAG 2 602 6 NAG NAG A . I 3 MAN 3 603 9 MAN MAN A . J 2 NAG 1 604 7 NAG NAG A . K 2 NAG 2 605 8 NAG NAG A . L 4 CA 1 606 606 CA CA A . M 5 PO4 1 607 1 PO4 PO4 A . N 5 PO4 1 608 2 PO4 PO4 A . O 5 PO4 1 609 3 PO4 PO4 A . P 5 PO4 1 610 4 PO4 PO4 A . Q 5 PO4 1 611 5 PO4 PO4 A . R 5 PO4 1 612 6 PO4 PO4 A . S 5 PO4 1 613 7 PO4 PO4 A . T 5 PO4 1 614 8 PO4 PO4 A . U 5 PO4 1 615 9 PO4 PO4 A . V 5 PO4 1 616 10 PO4 PO4 A . W 5 PO4 1 617 11 PO4 PO4 A . X 5 PO4 1 618 12 PO4 PO4 A . Y 5 PO4 1 619 13 PO4 PO4 A . Z 5 PO4 1 620 14 PO4 PO4 A . AA 5 PO4 1 621 15 PO4 PO4 A . BA 5 PO4 1 622 16 PO4 PO4 A . CA 6 HEM 1 623 605 HEM HEM A . DA 7 HOH 1 624 1 HOH HOH A . DA 7 HOH 2 625 2 HOH HOH A . DA 7 HOH 3 626 3 HOH HOH A . DA 7 HOH 4 627 4 HOH HOH A . DA 7 HOH 5 628 5 HOH HOH A . DA 7 HOH 6 629 6 HOH HOH A . DA 7 HOH 7 630 7 HOH HOH A . DA 7 HOH 8 631 8 HOH HOH A . DA 7 HOH 9 632 9 HOH HOH A . DA 7 HOH 10 633 10 HOH HOH A . DA 7 HOH 11 634 11 HOH HOH A . DA 7 HOH 12 635 12 HOH HOH A . DA 7 HOH 13 636 13 HOH HOH A . DA 7 HOH 14 637 14 HOH HOH A . DA 7 HOH 15 638 15 HOH HOH A . DA 7 HOH 16 639 16 HOH HOH A . DA 7 HOH 17 640 17 HOH HOH A . DA 7 HOH 18 641 18 HOH HOH A . DA 7 HOH 19 642 19 HOH HOH A . DA 7 HOH 20 643 20 HOH HOH A . DA 7 HOH 21 644 21 HOH HOH A . DA 7 HOH 22 645 22 HOH HOH A . DA 7 HOH 23 646 23 HOH HOH A . DA 7 HOH 24 647 24 HOH HOH A . DA 7 HOH 25 648 25 HOH HOH A . DA 7 HOH 26 649 26 HOH HOH A . DA 7 HOH 27 650 27 HOH HOH A . DA 7 HOH 28 651 28 HOH HOH A . DA 7 HOH 29 652 29 HOH HOH A . DA 7 HOH 30 653 30 HOH HOH A . DA 7 HOH 31 654 31 HOH HOH A . DA 7 HOH 32 655 32 HOH HOH A . DA 7 HOH 33 656 33 HOH HOH A . DA 7 HOH 34 657 34 HOH HOH A . DA 7 HOH 35 658 35 HOH HOH A . DA 7 HOH 36 659 36 HOH HOH A . DA 7 HOH 37 660 37 HOH HOH A . DA 7 HOH 38 661 38 HOH HOH A . DA 7 HOH 39 662 39 HOH HOH A . DA 7 HOH 40 663 40 HOH HOH A . DA 7 HOH 41 664 41 HOH HOH A . DA 7 HOH 42 665 42 HOH HOH A . DA 7 HOH 43 666 43 HOH HOH A . DA 7 HOH 44 667 44 HOH HOH A . DA 7 HOH 45 668 45 HOH HOH A . DA 7 HOH 46 669 46 HOH HOH A . DA 7 HOH 47 670 47 HOH HOH A . DA 7 HOH 48 671 48 HOH HOH A . DA 7 HOH 49 672 49 HOH HOH A . DA 7 HOH 50 673 50 HOH HOH A . DA 7 HOH 51 674 51 HOH HOH A . DA 7 HOH 52 675 52 HOH HOH A . DA 7 HOH 53 676 53 HOH HOH A . DA 7 HOH 54 677 54 HOH HOH A . DA 7 HOH 55 678 55 HOH HOH A . DA 7 HOH 56 679 56 HOH HOH A . DA 7 HOH 57 680 57 HOH HOH A . DA 7 HOH 58 681 58 HOH HOH A . DA 7 HOH 59 682 59 HOH HOH A . DA 7 HOH 60 683 60 HOH HOH A . DA 7 HOH 61 684 61 HOH HOH A . DA 7 HOH 62 685 62 HOH HOH A . DA 7 HOH 63 686 63 HOH HOH A . DA 7 HOH 64 687 64 HOH HOH A . DA 7 HOH 65 688 65 HOH HOH A . DA 7 HOH 66 689 66 HOH HOH A . DA 7 HOH 67 690 67 HOH HOH A . DA 7 HOH 68 691 68 HOH HOH A . DA 7 HOH 69 692 69 HOH HOH A . DA 7 HOH 70 693 70 HOH HOH A . DA 7 HOH 71 694 71 HOH HOH A . DA 7 HOH 72 695 72 HOH HOH A . DA 7 HOH 73 696 73 HOH HOH A . DA 7 HOH 74 697 74 HOH HOH A . DA 7 HOH 75 698 75 HOH HOH A . DA 7 HOH 76 699 76 HOH HOH A . DA 7 HOH 77 700 77 HOH HOH A . DA 7 HOH 78 701 78 HOH HOH A . DA 7 HOH 79 702 79 HOH HOH A . DA 7 HOH 80 703 80 HOH HOH A . DA 7 HOH 81 704 81 HOH HOH A . DA 7 HOH 82 705 82 HOH HOH A . DA 7 HOH 83 706 83 HOH HOH A . DA 7 HOH 84 707 84 HOH HOH A . DA 7 HOH 85 708 85 HOH HOH A . DA 7 HOH 86 709 86 HOH HOH A . DA 7 HOH 87 710 87 HOH HOH A . DA 7 HOH 88 711 88 HOH HOH A . DA 7 HOH 89 712 89 HOH HOH A . DA 7 HOH 90 713 90 HOH HOH A . DA 7 HOH 91 714 91 HOH HOH A . DA 7 HOH 92 715 92 HOH HOH A . DA 7 HOH 93 716 93 HOH HOH A . DA 7 HOH 94 717 94 HOH HOH A . DA 7 HOH 95 718 95 HOH HOH A . DA 7 HOH 96 719 96 HOH HOH A . DA 7 HOH 97 720 97 HOH HOH A . DA 7 HOH 98 721 98 HOH HOH A . DA 7 HOH 99 722 99 HOH HOH A . DA 7 HOH 100 723 100 HOH HOH A . DA 7 HOH 101 724 101 HOH HOH A . DA 7 HOH 102 725 102 HOH HOH A . DA 7 HOH 103 726 103 HOH HOH A . DA 7 HOH 104 727 104 HOH HOH A . DA 7 HOH 105 728 105 HOH HOH A . DA 7 HOH 106 729 106 HOH HOH A . DA 7 HOH 107 730 107 HOH HOH A . DA 7 HOH 108 731 108 HOH HOH A . DA 7 HOH 109 732 109 HOH HOH A . DA 7 HOH 110 733 110 HOH HOH A . DA 7 HOH 111 734 111 HOH HOH A . DA 7 HOH 112 735 112 HOH HOH A . DA 7 HOH 113 736 113 HOH HOH A . DA 7 HOH 114 737 114 HOH HOH A . DA 7 HOH 115 738 115 HOH HOH A . DA 7 HOH 116 739 116 HOH HOH A . DA 7 HOH 117 740 117 HOH HOH A . DA 7 HOH 118 741 118 HOH HOH A . DA 7 HOH 119 742 119 HOH HOH A . DA 7 HOH 120 743 120 HOH HOH A . DA 7 HOH 121 744 121 HOH HOH A . DA 7 HOH 122 745 122 HOH HOH A . DA 7 HOH 123 746 123 HOH HOH A . DA 7 HOH 124 747 124 HOH HOH A . DA 7 HOH 125 748 125 HOH HOH A . DA 7 HOH 126 749 126 HOH HOH A . DA 7 HOH 127 750 127 HOH HOH A . DA 7 HOH 128 751 128 HOH HOH A . DA 7 HOH 129 752 129 HOH HOH A . DA 7 HOH 130 753 130 HOH HOH A . DA 7 HOH 131 754 131 HOH HOH A . DA 7 HOH 132 755 132 HOH HOH A . DA 7 HOH 133 756 133 HOH HOH A . DA 7 HOH 134 757 134 HOH HOH A . DA 7 HOH 135 758 135 HOH HOH A . DA 7 HOH 136 759 136 HOH HOH A . DA 7 HOH 137 760 137 HOH HOH A . DA 7 HOH 138 761 138 HOH HOH A . DA 7 HOH 139 762 139 HOH HOH A . DA 7 HOH 140 763 140 HOH HOH A . DA 7 HOH 141 764 141 HOH HOH A . DA 7 HOH 142 765 142 HOH HOH A . DA 7 HOH 143 766 143 HOH HOH A . DA 7 HOH 144 767 144 HOH HOH A . DA 7 HOH 145 768 145 HOH HOH A . DA 7 HOH 146 769 146 HOH HOH A . DA 7 HOH 147 770 147 HOH HOH A . DA 7 HOH 148 771 148 HOH HOH A . DA 7 HOH 149 772 149 HOH HOH A . DA 7 HOH 150 773 150 HOH HOH A . DA 7 HOH 151 774 151 HOH HOH A . DA 7 HOH 152 775 152 HOH HOH A . DA 7 HOH 153 776 153 HOH HOH A . DA 7 HOH 154 777 154 HOH HOH A . DA 7 HOH 155 778 155 HOH HOH A . DA 7 HOH 156 779 156 HOH HOH A . DA 7 HOH 157 780 157 HOH HOH A . DA 7 HOH 158 781 158 HOH HOH A . DA 7 HOH 159 782 159 HOH HOH A . DA 7 HOH 160 783 160 HOH HOH A . DA 7 HOH 161 784 161 HOH HOH A . DA 7 HOH 162 785 162 HOH HOH A . DA 7 HOH 163 786 163 HOH HOH A . DA 7 HOH 164 787 164 HOH HOH A . DA 7 HOH 165 788 165 HOH HOH A . DA 7 HOH 166 789 166 HOH HOH A . DA 7 HOH 167 790 167 HOH HOH A . DA 7 HOH 168 791 168 HOH HOH A . DA 7 HOH 169 792 169 HOH HOH A . DA 7 HOH 170 793 170 HOH HOH A . DA 7 HOH 171 794 171 HOH HOH A . DA 7 HOH 172 795 172 HOH HOH A . DA 7 HOH 173 796 173 HOH HOH A . DA 7 HOH 174 797 174 HOH HOH A . DA 7 HOH 175 798 175 HOH HOH A . DA 7 HOH 176 799 176 HOH HOH A . DA 7 HOH 177 800 177 HOH HOH A . DA 7 HOH 178 801 178 HOH HOH A . DA 7 HOH 179 802 179 HOH HOH A . DA 7 HOH 180 803 180 HOH HOH A . DA 7 HOH 181 804 181 HOH HOH A . DA 7 HOH 182 805 182 HOH HOH A . DA 7 HOH 183 806 183 HOH HOH A . DA 7 HOH 184 807 184 HOH HOH A . DA 7 HOH 185 808 185 HOH HOH A . DA 7 HOH 186 809 186 HOH HOH A . DA 7 HOH 187 810 187 HOH HOH A . DA 7 HOH 188 811 188 HOH HOH A . DA 7 HOH 189 812 189 HOH HOH A . DA 7 HOH 190 813 190 HOH HOH A . DA 7 HOH 191 814 191 HOH HOH A . DA 7 HOH 192 815 192 HOH HOH A . DA 7 HOH 193 816 193 HOH HOH A . DA 7 HOH 194 817 194 HOH HOH A . DA 7 HOH 195 818 195 HOH HOH A . DA 7 HOH 196 819 196 HOH HOH A . DA 7 HOH 197 820 197 HOH HOH A . DA 7 HOH 198 821 198 HOH HOH A . DA 7 HOH 199 822 199 HOH HOH A . DA 7 HOH 200 823 200 HOH HOH A . DA 7 HOH 201 824 201 HOH HOH A . DA 7 HOH 202 825 202 HOH HOH A . DA 7 HOH 203 826 203 HOH HOH A . DA 7 HOH 204 827 204 HOH HOH A . DA 7 HOH 205 828 205 HOH HOH A . DA 7 HOH 206 829 206 HOH HOH A . DA 7 HOH 207 830 207 HOH HOH A . DA 7 HOH 208 831 208 HOH HOH A . DA 7 HOH 209 832 209 HOH HOH A . DA 7 HOH 210 833 210 HOH HOH A . DA 7 HOH 211 834 211 HOH HOH A . DA 7 HOH 212 835 212 HOH HOH A . DA 7 HOH 213 836 213 HOH HOH A . DA 7 HOH 214 837 214 HOH HOH A . DA 7 HOH 215 838 215 HOH HOH A . DA 7 HOH 216 839 216 HOH HOH A . DA 7 HOH 217 840 217 HOH HOH A . DA 7 HOH 218 841 218 HOH HOH A . DA 7 HOH 219 842 219 HOH HOH A . DA 7 HOH 220 843 220 HOH HOH A . DA 7 HOH 221 844 221 HOH HOH A . DA 7 HOH 222 845 222 HOH HOH A . DA 7 HOH 223 846 223 HOH HOH A . DA 7 HOH 224 847 224 HOH HOH A . DA 7 HOH 225 848 225 HOH HOH A . DA 7 HOH 226 849 226 HOH HOH A . DA 7 HOH 227 850 227 HOH HOH A . DA 7 HOH 228 851 228 HOH HOH A . DA 7 HOH 229 852 229 HOH HOH A . DA 7 HOH 230 853 230 HOH HOH A . DA 7 HOH 231 854 231 HOH HOH A . DA 7 HOH 232 855 232 HOH HOH A . DA 7 HOH 233 856 233 HOH HOH A . DA 7 HOH 234 857 234 HOH HOH A . DA 7 HOH 235 858 235 HOH HOH A . DA 7 HOH 236 859 236 HOH HOH A . DA 7 HOH 237 860 237 HOH HOH A . DA 7 HOH 238 861 238 HOH HOH A . DA 7 HOH 239 862 239 HOH HOH A . DA 7 HOH 240 863 240 HOH HOH A . DA 7 HOH 241 864 241 HOH HOH A . DA 7 HOH 242 865 242 HOH HOH A . DA 7 HOH 243 866 243 HOH HOH A . DA 7 HOH 244 867 244 HOH HOH A . DA 7 HOH 245 868 245 HOH HOH A . DA 7 HOH 246 869 246 HOH HOH A . DA 7 HOH 247 870 247 HOH HOH A . DA 7 HOH 248 871 248 HOH HOH A . DA 7 HOH 249 872 249 HOH HOH A . # loop_ _pdbx_struct_mod_residue.id _pdbx_struct_mod_residue.label_asym_id _pdbx_struct_mod_residue.label_comp_id _pdbx_struct_mod_residue.label_seq_id _pdbx_struct_mod_residue.auth_asym_id _pdbx_struct_mod_residue.auth_comp_id _pdbx_struct_mod_residue.auth_seq_id _pdbx_struct_mod_residue.PDB_ins_code _pdbx_struct_mod_residue.parent_comp_id _pdbx_struct_mod_residue.details 1 A ASN 95 A ASN 95 ? ASN 'GLYCOSYLATION SITE' 2 A ASN 205 A ASN 205 ? ASN 'GLYCOSYLATION SITE' 3 A ASN 241 A ASN 241 ? ASN 'GLYCOSYLATION SITE' 4 A ASN 332 A ASN 332 ? ASN 'GLYCOSYLATION SITE' 5 A SEP 198 A SEP 198 ? SER PHOSPHOSERINE # _pdbx_struct_assembly.id 1 _pdbx_struct_assembly.details author_defined_assembly _pdbx_struct_assembly.method_details ? _pdbx_struct_assembly.oligomeric_details monomeric _pdbx_struct_assembly.oligomeric_count 1 # _pdbx_struct_assembly_gen.assembly_id 1 _pdbx_struct_assembly_gen.oper_expression 1 _pdbx_struct_assembly_gen.asym_id_list A,B,C,D,E,F,G,H,I,J,K,L,M,N,O,P,Q,R,S,T,U,V,W,X,Y,Z,AA,BA,CA,DA # _pdbx_struct_oper_list.id 1 _pdbx_struct_oper_list.type 'identity operation' _pdbx_struct_oper_list.name 1_555 _pdbx_struct_oper_list.symmetry_operation x,y,z _pdbx_struct_oper_list.matrix[1][1] 1.0000000000 _pdbx_struct_oper_list.matrix[1][2] 0.0000000000 _pdbx_struct_oper_list.matrix[1][3] 0.0000000000 _pdbx_struct_oper_list.vector[1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][2] 1.0000000000 _pdbx_struct_oper_list.matrix[2][3] 0.0000000000 _pdbx_struct_oper_list.vector[2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][1] 0.0000000000 _pdbx_struct_oper_list.matrix[3][2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][3] 1.0000000000 _pdbx_struct_oper_list.vector[3] 0.0000000000 # loop_ _pdbx_struct_conn_angle.id _pdbx_struct_conn_angle.ptnr1_label_atom_id _pdbx_struct_conn_angle.ptnr1_label_alt_id _pdbx_struct_conn_angle.ptnr1_label_asym_id _pdbx_struct_conn_angle.ptnr1_label_comp_id _pdbx_struct_conn_angle.ptnr1_label_seq_id _pdbx_struct_conn_angle.ptnr1_auth_atom_id _pdbx_struct_conn_angle.ptnr1_auth_asym_id _pdbx_struct_conn_angle.ptnr1_auth_comp_id _pdbx_struct_conn_angle.ptnr1_auth_seq_id _pdbx_struct_conn_angle.ptnr1_PDB_ins_code _pdbx_struct_conn_angle.ptnr1_symmetry _pdbx_struct_conn_angle.ptnr2_label_atom_id _pdbx_struct_conn_angle.ptnr2_label_alt_id _pdbx_struct_conn_angle.ptnr2_label_asym_id _pdbx_struct_conn_angle.ptnr2_label_comp_id _pdbx_struct_conn_angle.ptnr2_label_seq_id _pdbx_struct_conn_angle.ptnr2_auth_atom_id _pdbx_struct_conn_angle.ptnr2_auth_asym_id _pdbx_struct_conn_angle.ptnr2_auth_comp_id _pdbx_struct_conn_angle.ptnr2_auth_seq_id _pdbx_struct_conn_angle.ptnr2_PDB_ins_code _pdbx_struct_conn_angle.ptnr2_symmetry _pdbx_struct_conn_angle.ptnr3_label_atom_id _pdbx_struct_conn_angle.ptnr3_label_alt_id _pdbx_struct_conn_angle.ptnr3_label_asym_id _pdbx_struct_conn_angle.ptnr3_label_comp_id _pdbx_struct_conn_angle.ptnr3_label_seq_id _pdbx_struct_conn_angle.ptnr3_auth_atom_id _pdbx_struct_conn_angle.ptnr3_auth_asym_id _pdbx_struct_conn_angle.ptnr3_auth_comp_id _pdbx_struct_conn_angle.ptnr3_auth_seq_id _pdbx_struct_conn_angle.ptnr3_PDB_ins_code _pdbx_struct_conn_angle.ptnr3_symmetry _pdbx_struct_conn_angle.value _pdbx_struct_conn_angle.value_esd 1 O ? A ASP 110 ? A ASP 110 ? 1_555 CA ? L CA . ? A CA 606 ? 1_555 OD1 ? A ASP 110 ? A ASP 110 ? 1_555 74.4 ? 2 O ? A ASP 110 ? A ASP 110 ? 1_555 CA ? L CA . ? A CA 606 ? 1_555 O ? A THR 184 ? A THR 184 ? 1_555 90.0 ? 3 OD1 ? A ASP 110 ? A ASP 110 ? 1_555 CA ? L CA . ? A CA 606 ? 1_555 O ? A THR 184 ? A THR 184 ? 1_555 150.4 ? 4 O ? A ASP 110 ? A ASP 110 ? 1_555 CA ? L CA . ? A CA 606 ? 1_555 OG1 ? A THR 184 ? A THR 184 ? 1_555 138.8 ? 5 OD1 ? A ASP 110 ? A ASP 110 ? 1_555 CA ? L CA . ? A CA 606 ? 1_555 OG1 ? A THR 184 ? A THR 184 ? 1_555 134.8 ? 6 O ? A THR 184 ? A THR 184 ? 1_555 CA ? L CA . ? A CA 606 ? 1_555 OG1 ? A THR 184 ? A THR 184 ? 1_555 72.6 ? 7 O ? A ASP 110 ? A ASP 110 ? 1_555 CA ? L CA . ? A CA 606 ? 1_555 O ? A PHE 186 ? A PHE 186 ? 1_555 120.0 ? 8 OD1 ? A ASP 110 ? A ASP 110 ? 1_555 CA ? L CA . ? A CA 606 ? 1_555 O ? A PHE 186 ? A PHE 186 ? 1_555 70.1 ? 9 O ? A THR 184 ? A THR 184 ? 1_555 CA ? L CA . ? A CA 606 ? 1_555 O ? A PHE 186 ? A PHE 186 ? 1_555 97.9 ? 10 OG1 ? A THR 184 ? A THR 184 ? 1_555 CA ? L CA . ? A CA 606 ? 1_555 O ? A PHE 186 ? A PHE 186 ? 1_555 99.6 ? 11 O ? A ASP 110 ? A ASP 110 ? 1_555 CA ? L CA . ? A CA 606 ? 1_555 OD1 ? A ASP 188 ? A ASP 188 ? 1_555 134.7 ? 12 OD1 ? A ASP 110 ? A ASP 110 ? 1_555 CA ? L CA . ? A CA 606 ? 1_555 OD1 ? A ASP 188 ? A ASP 188 ? 1_555 68.0 ? 13 O ? A THR 184 ? A THR 184 ? 1_555 CA ? L CA . ? A CA 606 ? 1_555 OD1 ? A ASP 188 ? A ASP 188 ? 1_555 134.5 ? 14 OG1 ? A THR 184 ? A THR 184 ? 1_555 CA ? L CA . ? A CA 606 ? 1_555 OD1 ? A ASP 188 ? A ASP 188 ? 1_555 67.3 ? 15 O ? A PHE 186 ? A PHE 186 ? 1_555 CA ? L CA . ? A CA 606 ? 1_555 OD1 ? A ASP 188 ? A ASP 188 ? 1_555 69.3 ? 16 O ? A ASP 110 ? A ASP 110 ? 1_555 CA ? L CA . ? A CA 606 ? 1_555 OG ? A SER 190 ? A SER 190 ? 1_555 76.3 ? 17 OD1 ? A ASP 110 ? A ASP 110 ? 1_555 CA ? L CA . ? A CA 606 ? 1_555 OG ? A SER 190 ? A SER 190 ? 1_555 79.8 ? 18 O ? A THR 184 ? A THR 184 ? 1_555 CA ? L CA . ? A CA 606 ? 1_555 OG ? A SER 190 ? A SER 190 ? 1_555 121.5 ? 19 OG1 ? A THR 184 ? A THR 184 ? 1_555 CA ? L CA . ? A CA 606 ? 1_555 OG ? A SER 190 ? A SER 190 ? 1_555 81.5 ? 20 O ? A PHE 186 ? A PHE 186 ? 1_555 CA ? L CA . ? A CA 606 ? 1_555 OG ? A SER 190 ? A SER 190 ? 1_555 138.3 ? 21 OD1 ? A ASP 188 ? A ASP 188 ? 1_555 CA ? L CA . ? A CA 606 ? 1_555 OG ? A SER 190 ? A SER 190 ? 1_555 73.0 ? 22 NE2 ? A HIS 351 ? A HIS 351 ? 1_555 FE ? CA HEM . ? A HEM 623 ? 1_555 NA ? CA HEM . ? A HEM 623 ? 1_555 93.0 ? 23 NE2 ? A HIS 351 ? A HIS 351 ? 1_555 FE ? CA HEM . ? A HEM 623 ? 1_555 NB ? CA HEM . ? A HEM 623 ? 1_555 99.3 ? 24 NA ? CA HEM . ? A HEM 623 ? 1_555 FE ? CA HEM . ? A HEM 623 ? 1_555 NB ? CA HEM . ? A HEM 623 ? 1_555 90.2 ? 25 NE2 ? A HIS 351 ? A HIS 351 ? 1_555 FE ? CA HEM . ? A HEM 623 ? 1_555 NC ? CA HEM . ? A HEM 623 ? 1_555 96.5 ? 26 NA ? CA HEM . ? A HEM 623 ? 1_555 FE ? CA HEM . ? A HEM 623 ? 1_555 NC ? CA HEM . ? A HEM 623 ? 1_555 169.3 ? 27 NB ? CA HEM . ? A HEM 623 ? 1_555 FE ? CA HEM . ? A HEM 623 ? 1_555 NC ? CA HEM . ? A HEM 623 ? 1_555 92.9 ? 28 NE2 ? A HIS 351 ? A HIS 351 ? 1_555 FE ? CA HEM . ? A HEM 623 ? 1_555 ND ? CA HEM . ? A HEM 623 ? 1_555 88.8 ? 29 NA ? CA HEM . ? A HEM 623 ? 1_555 FE ? CA HEM . ? A HEM 623 ? 1_555 ND ? CA HEM . ? A HEM 623 ? 1_555 82.9 ? 30 NB ? CA HEM . ? A HEM 623 ? 1_555 FE ? CA HEM . ? A HEM 623 ? 1_555 ND ? CA HEM . ? A HEM 623 ? 1_555 169.7 ? 31 NC ? CA HEM . ? A HEM 623 ? 1_555 FE ? CA HEM . ? A HEM 623 ? 1_555 ND ? CA HEM . ? A HEM 623 ? 1_555 92.5 ? 32 NE2 ? A HIS 351 ? A HIS 351 ? 1_555 FE ? CA HEM . ? A HEM 623 ? 1_555 O ? DA HOH . ? A HOH 748 ? 1_555 170.7 ? 33 NA ? CA HEM . ? A HEM 623 ? 1_555 FE ? CA HEM . ? A HEM 623 ? 1_555 O ? DA HOH . ? A HOH 748 ? 1_555 79.5 ? 34 NB ? CA HEM . ? A HEM 623 ? 1_555 FE ? CA HEM . ? A HEM 623 ? 1_555 O ? DA HOH . ? A HOH 748 ? 1_555 86.4 ? 35 NC ? CA HEM . ? A HEM 623 ? 1_555 FE ? CA HEM . ? A HEM 623 ? 1_555 O ? DA HOH . ? A HOH 748 ? 1_555 90.5 ? 36 ND ? CA HEM . ? A HEM 623 ? 1_555 FE ? CA HEM . ? A HEM 623 ? 1_555 O ? DA HOH . ? A HOH 748 ? 1_555 84.8 ? # 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 2007-05-22 2 'Structure model' 1 1 2008-05-01 3 'Structure model' 1 2 2011-07-13 # _pdbx_audit_revision_details.ordinal 1 _pdbx_audit_revision_details.revision_ordinal 1 _pdbx_audit_revision_details.data_content_type 'Structure model' _pdbx_audit_revision_details.provider repository _pdbx_audit_revision_details.type 'Initial release' _pdbx_audit_revision_details.description ? # loop_ _pdbx_audit_revision_group.ordinal _pdbx_audit_revision_group.revision_ordinal _pdbx_audit_revision_group.data_content_type _pdbx_audit_revision_group.group 1 2 'Structure model' 'Version format compliance' 2 3 'Structure model' 'Non-polymer description' 3 3 'Structure model' 'Version format compliance' # loop_ _software.name _software.classification _software.version _software.citation_id _software.pdbx_ordinal REFMAC refinement 5.0 ? 1 HKL-2000 'data collection' . ? 2 DENZO 'data reduction' . ? 3 SCALEPACK 'data scaling' . ? 4 AMoRE phasing . ? 5 # loop_ _pdbx_validate_rmsd_angle.id _pdbx_validate_rmsd_angle.PDB_model_num _pdbx_validate_rmsd_angle.auth_atom_id_1 _pdbx_validate_rmsd_angle.auth_asym_id_1 _pdbx_validate_rmsd_angle.auth_comp_id_1 _pdbx_validate_rmsd_angle.auth_seq_id_1 _pdbx_validate_rmsd_angle.PDB_ins_code_1 _pdbx_validate_rmsd_angle.label_alt_id_1 _pdbx_validate_rmsd_angle.auth_atom_id_2 _pdbx_validate_rmsd_angle.auth_asym_id_2 _pdbx_validate_rmsd_angle.auth_comp_id_2 _pdbx_validate_rmsd_angle.auth_seq_id_2 _pdbx_validate_rmsd_angle.PDB_ins_code_2 _pdbx_validate_rmsd_angle.label_alt_id_2 _pdbx_validate_rmsd_angle.auth_atom_id_3 _pdbx_validate_rmsd_angle.auth_asym_id_3 _pdbx_validate_rmsd_angle.auth_comp_id_3 _pdbx_validate_rmsd_angle.auth_seq_id_3 _pdbx_validate_rmsd_angle.PDB_ins_code_3 _pdbx_validate_rmsd_angle.label_alt_id_3 _pdbx_validate_rmsd_angle.angle_value _pdbx_validate_rmsd_angle.angle_target_value _pdbx_validate_rmsd_angle.angle_deviation _pdbx_validate_rmsd_angle.angle_standard_deviation _pdbx_validate_rmsd_angle.linker_flag 1 1 N A GLU 17 ? ? CA A GLU 17 ? ? C A GLU 17 ? ? 93.73 111.00 -17.27 2.70 N 2 1 C A THR 169 ? ? N A PRO 170 ? ? CD A PRO 170 ? ? 112.66 128.40 -15.74 2.10 Y 3 1 CB A ASP 221 ? ? CG A ASP 221 ? ? OD2 A ASP 221 ? ? 123.85 118.30 5.55 0.90 N # 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 TRP A 2 ? ? -46.36 94.47 2 1 GLU A 3 ? ? 160.96 151.29 3 1 PRO A 9 ? ? -33.09 -30.97 4 1 ASN A 18 ? ? -74.56 -74.68 5 1 SER A 19 ? ? -39.48 121.90 6 1 LEU A 55 ? ? -132.35 -44.74 7 1 ALA A 56 ? ? -154.36 -20.42 8 1 PHE A 113 ? ? -171.31 105.93 9 1 ALA A 114 ? ? -103.14 79.60 10 1 ASP A 137 ? ? 65.00 -126.51 11 1 ASN A 138 ? ? -58.39 14.10 12 1 PHE A 160 ? ? -172.80 140.43 13 1 CYS A 167 ? ? 65.80 -143.19 14 1 PRO A 170 ? ? -60.73 -162.09 15 1 GLN A 173 ? ? -163.79 94.99 16 1 SER A 174 ? ? -153.19 -29.21 17 1 SEP A 198 ? ? -39.93 -74.19 18 1 ASN A 241 ? ? -161.59 91.77 19 1 TYR A 293 ? ? -56.78 -71.87 20 1 ILE A 325 ? ? -119.33 76.63 21 1 GLU A 371 ? ? -112.53 57.47 22 1 ASP A 389 ? ? -146.30 36.71 23 1 THR A 425 ? ? 86.10 9.68 24 1 LYS A 427 ? ? 22.31 62.20 25 1 ILE A 428 ? ? -173.02 117.09 26 1 HIS A 429 ? ? -60.58 71.82 27 1 LYS A 485 ? ? 77.03 -2.67 28 1 THR A 486 ? ? 179.96 154.15 29 1 VAL A 502 ? ? -47.19 152.69 30 1 TRP A 529 ? ? -47.58 153.72 31 1 HIS A 558 ? ? -106.33 44.42 32 1 ARG A 593 ? ? -31.95 -91.76 # loop_ _pdbx_validate_peptide_omega.id _pdbx_validate_peptide_omega.PDB_model_num _pdbx_validate_peptide_omega.auth_comp_id_1 _pdbx_validate_peptide_omega.auth_asym_id_1 _pdbx_validate_peptide_omega.auth_seq_id_1 _pdbx_validate_peptide_omega.PDB_ins_code_1 _pdbx_validate_peptide_omega.label_alt_id_1 _pdbx_validate_peptide_omega.auth_comp_id_2 _pdbx_validate_peptide_omega.auth_asym_id_2 _pdbx_validate_peptide_omega.auth_seq_id_2 _pdbx_validate_peptide_omega.PDB_ins_code_2 _pdbx_validate_peptide_omega.label_alt_id_2 _pdbx_validate_peptide_omega.omega 1 1 GLN A 135 ? ? GLY A 136 ? ? -143.34 2 1 ASN A 231 ? ? LYS A 232 ? ? -124.30 3 1 LYS A 233 ? ? PRO A 234 ? ? -31.20 # _pdbx_validate_chiral.id 1 _pdbx_validate_chiral.PDB_model_num 1 _pdbx_validate_chiral.auth_atom_id C1 _pdbx_validate_chiral.label_alt_id ? _pdbx_validate_chiral.auth_asym_id A _pdbx_validate_chiral.auth_comp_id NAG _pdbx_validate_chiral.auth_seq_id 596 _pdbx_validate_chiral.PDB_ins_code ? _pdbx_validate_chiral.details 'WRONG HAND' _pdbx_validate_chiral.omega . # loop_ _pdbx_entity_nonpoly.entity_id _pdbx_entity_nonpoly.name _pdbx_entity_nonpoly.comp_id 2 N-ACETYL-D-GLUCOSAMINE NAG 3 ALPHA-D-MANNOSE MAN 4 'CALCIUM ION' CA 5 'PHOSPHATE ION' PO4 6 'PROTOPORPHYRIN IX CONTAINING FE' HEM 7 water HOH #