data_25043 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 25043 _Entry.Title ; Structural Investigation of hnRNP L bound to RNA ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2014-06-24 _Entry.Accession_date 2014-06-24 _Entry.Last_release_date 2015-12-21 _Entry.Original_release_date 2015-12-21 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.81 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype 'NMR, 20 STRUCTURES' _Entry.Details 'Most two C-terminal RNA Recognition Motif Domain of hnRNP L bound to two equivalents ACACA RNA' _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Markus Blatter . . . 25043 2 Frederic Allain . . . 25043 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 25043 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'Protein/RNA Complex' . 25043 RRM . 25043 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 3 25043 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 700 25043 '15N chemical shifts' 223 25043 '1H chemical shifts' 1466 25043 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2015-12-21 . original BMRB . 25043 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 25039 'Second RNA Recognition Motif Domain of hnRNP L' 25043 BMRB 25040 'most two C-terminal RNA Recognition Motif Domain of hnRNP L' 25043 BMRB 25041 'First RNA Recognition Motif Domain of hnRNP L bound to CACACA RNA' 25043 BMRB 25042 'Second RNA Recognition Motif Domain of hnRNP L bound to ACACAC RNA' 25043 PDB 2MQQ 'BMRB Entry Tracking System' 25043 stop_ save_ ############### # Citations # ############### save_citations _Citation.Sf_category citations _Citation.Sf_framecode citations _Citation.Entry_ID 25043 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title ; Most two C-terminal RNA Recognition Motif Domain of hnRNP L bound to two equivalents ACACA RNA ; _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev 'To be Published' _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Markus Blatter . . . 25043 1 2 Frederic Allain . . . 25043 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 25043 _Assembly.ID 1 _Assembly.Name 'Most two C-terminal RNA Recognition Motif Domain of hnRNP L bound to two equivalents ACACA RNA' _Assembly.BMRB_code . _Assembly.Number_of_components 3 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 entity_1 1 $entity_1 A . yes native no no . . . 25043 1 2 "RNA (5'-R(*AP*CP*AP*CP*A)-3')_1" 2 $RNA_(5'-R(*AP*CP*AP*CP*A)-3') B . yes native no no . . . 25043 1 3 "RNA (5'-R(*AP*CP*AP*CP*A)-3')_2" 2 $RNA_(5'-R(*AP*CP*AP*CP*A)-3') C . yes native no no . . . 25043 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 25043 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; YGPHADSPVLMVYGLDQSKM NCDRVFNVFCLYGNVEKVKF MKSKPGAAMVEMADGYAVDR AITHLNNNFMFGQKMNVCVS KQPAIMPGQSYGLEDGSCSY KDFSESRNNRFSTPEQAAKN RIQHPSNVLHFFNAPLEVTE ENFFEICDELGVKRPTSVKV FSGKSERSSSGLLEWDSKSD ALETLGFLNHYQMKNPNGPY PYTLKLCFSTAQHAS ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 215 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state . _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 24141.418 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 372 TYR . 25043 1 2 373 GLY . 25043 1 3 374 PRO . 25043 1 4 375 HIS . 25043 1 5 376 ALA . 25043 1 6 377 ASP . 25043 1 7 378 SER . 25043 1 8 379 PRO . 25043 1 9 380 VAL . 25043 1 10 381 LEU . 25043 1 11 382 MET . 25043 1 12 383 VAL . 25043 1 13 384 TYR . 25043 1 14 385 GLY . 25043 1 15 386 LEU . 25043 1 16 387 ASP . 25043 1 17 388 GLN . 25043 1 18 389 SER . 25043 1 19 390 LYS . 25043 1 20 391 MET . 25043 1 21 392 ASN . 25043 1 22 393 CYS . 25043 1 23 394 ASP . 25043 1 24 395 ARG . 25043 1 25 396 VAL . 25043 1 26 397 PHE . 25043 1 27 398 ASN . 25043 1 28 399 VAL . 25043 1 29 400 PHE . 25043 1 30 401 CYS . 25043 1 31 402 LEU . 25043 1 32 403 TYR . 25043 1 33 404 GLY . 25043 1 34 405 ASN . 25043 1 35 406 VAL . 25043 1 36 407 GLU . 25043 1 37 408 LYS . 25043 1 38 409 VAL . 25043 1 39 410 LYS . 25043 1 40 411 PHE . 25043 1 41 412 MET . 25043 1 42 413 LYS . 25043 1 43 414 SER . 25043 1 44 415 LYS . 25043 1 45 416 PRO . 25043 1 46 417 GLY . 25043 1 47 418 ALA . 25043 1 48 419 ALA . 25043 1 49 420 MET . 25043 1 50 421 VAL . 25043 1 51 422 GLU . 25043 1 52 423 MET . 25043 1 53 424 ALA . 25043 1 54 425 ASP . 25043 1 55 426 GLY . 25043 1 56 427 TYR . 25043 1 57 428 ALA . 25043 1 58 429 VAL . 25043 1 59 430 ASP . 25043 1 60 431 ARG . 25043 1 61 432 ALA . 25043 1 62 433 ILE . 25043 1 63 434 THR . 25043 1 64 435 HIS . 25043 1 65 436 LEU . 25043 1 66 437 ASN . 25043 1 67 438 ASN . 25043 1 68 439 ASN . 25043 1 69 440 PHE . 25043 1 70 441 MET . 25043 1 71 442 PHE . 25043 1 72 443 GLY . 25043 1 73 444 GLN . 25043 1 74 445 LYS . 25043 1 75 446 MET . 25043 1 76 447 ASN . 25043 1 77 448 VAL . 25043 1 78 449 CYS . 25043 1 79 450 VAL . 25043 1 80 451 SER . 25043 1 81 452 LYS . 25043 1 82 453 GLN . 25043 1 83 454 PRO . 25043 1 84 455 ALA . 25043 1 85 456 ILE . 25043 1 86 457 MET . 25043 1 87 458 PRO . 25043 1 88 459 GLY . 25043 1 89 460 GLN . 25043 1 90 461 SER . 25043 1 91 462 TYR . 25043 1 92 463 GLY . 25043 1 93 464 LEU . 25043 1 94 465 GLU . 25043 1 95 466 ASP . 25043 1 96 467 GLY . 25043 1 97 468 SER . 25043 1 98 469 CYS . 25043 1 99 470 SER . 25043 1 100 471 TYR . 25043 1 101 472 LYS . 25043 1 102 473 ASP . 25043 1 103 474 PHE . 25043 1 104 475 SER . 25043 1 105 476 GLU . 25043 1 106 477 SER . 25043 1 107 478 ARG . 25043 1 108 479 ASN . 25043 1 109 480 ASN . 25043 1 110 481 ARG . 25043 1 111 482 PHE . 25043 1 112 483 SER . 25043 1 113 484 THR . 25043 1 114 485 PRO . 25043 1 115 486 GLU . 25043 1 116 487 GLN . 25043 1 117 488 ALA . 25043 1 118 489 ALA . 25043 1 119 490 LYS . 25043 1 120 491 ASN . 25043 1 121 492 ARG . 25043 1 122 493 ILE . 25043 1 123 494 GLN . 25043 1 124 495 HIS . 25043 1 125 496 PRO . 25043 1 126 497 SER . 25043 1 127 498 ASN . 25043 1 128 499 VAL . 25043 1 129 500 LEU . 25043 1 130 501 HIS . 25043 1 131 502 PHE . 25043 1 132 503 PHE . 25043 1 133 504 ASN . 25043 1 134 505 ALA . 25043 1 135 506 PRO . 25043 1 136 507 LEU . 25043 1 137 508 GLU . 25043 1 138 509 VAL . 25043 1 139 510 THR . 25043 1 140 511 GLU . 25043 1 141 512 GLU . 25043 1 142 513 ASN . 25043 1 143 514 PHE . 25043 1 144 515 PHE . 25043 1 145 516 GLU . 25043 1 146 517 ILE . 25043 1 147 518 CYS . 25043 1 148 519 ASP . 25043 1 149 520 GLU . 25043 1 150 521 LEU . 25043 1 151 522 GLY . 25043 1 152 523 VAL . 25043 1 153 524 LYS . 25043 1 154 525 ARG . 25043 1 155 526 PRO . 25043 1 156 527 THR . 25043 1 157 528 SER . 25043 1 158 529 VAL . 25043 1 159 530 LYS . 25043 1 160 531 VAL . 25043 1 161 532 PHE . 25043 1 162 533 SER . 25043 1 163 534 GLY . 25043 1 164 535 LYS . 25043 1 165 536 SER . 25043 1 166 537 GLU . 25043 1 167 538 ARG . 25043 1 168 539 SER . 25043 1 169 540 SER . 25043 1 170 541 SER . 25043 1 171 542 GLY . 25043 1 172 543 LEU . 25043 1 173 544 LEU . 25043 1 174 545 GLU . 25043 1 175 546 TRP . 25043 1 176 547 ASP . 25043 1 177 548 SER . 25043 1 178 549 LYS . 25043 1 179 550 SER . 25043 1 180 551 ASP . 25043 1 181 552 ALA . 25043 1 182 553 LEU . 25043 1 183 554 GLU . 25043 1 184 555 THR . 25043 1 185 556 LEU . 25043 1 186 557 GLY . 25043 1 187 558 PHE . 25043 1 188 559 LEU . 25043 1 189 560 ASN . 25043 1 190 561 HIS . 25043 1 191 562 TYR . 25043 1 192 563 GLN . 25043 1 193 564 MET . 25043 1 194 565 LYS . 25043 1 195 566 ASN . 25043 1 196 567 PRO . 25043 1 197 568 ASN . 25043 1 198 569 GLY . 25043 1 199 570 PRO . 25043 1 200 571 TYR . 25043 1 201 572 PRO . 25043 1 202 573 TYR . 25043 1 203 574 THR . 25043 1 204 575 LEU . 25043 1 205 576 LYS . 25043 1 206 577 LEU . 25043 1 207 578 CYS . 25043 1 208 579 PHE . 25043 1 209 580 SER . 25043 1 210 581 THR . 25043 1 211 582 ALA . 25043 1 212 583 GLN . 25043 1 213 584 HIS . 25043 1 214 585 ALA . 25043 1 215 586 SER . 25043 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . TYR 1 1 25043 1 . GLY 2 2 25043 1 . PRO 3 3 25043 1 . HIS 4 4 25043 1 . ALA 5 5 25043 1 . ASP 6 6 25043 1 . SER 7 7 25043 1 . PRO 8 8 25043 1 . VAL 9 9 25043 1 . LEU 10 10 25043 1 . MET 11 11 25043 1 . VAL 12 12 25043 1 . TYR 13 13 25043 1 . GLY 14 14 25043 1 . LEU 15 15 25043 1 . ASP 16 16 25043 1 . GLN 17 17 25043 1 . SER 18 18 25043 1 . LYS 19 19 25043 1 . MET 20 20 25043 1 . ASN 21 21 25043 1 . CYS 22 22 25043 1 . ASP 23 23 25043 1 . ARG 24 24 25043 1 . VAL 25 25 25043 1 . PHE 26 26 25043 1 . ASN 27 27 25043 1 . VAL 28 28 25043 1 . PHE 29 29 25043 1 . CYS 30 30 25043 1 . LEU 31 31 25043 1 . TYR 32 32 25043 1 . GLY 33 33 25043 1 . ASN 34 34 25043 1 . VAL 35 35 25043 1 . GLU 36 36 25043 1 . LYS 37 37 25043 1 . VAL 38 38 25043 1 . LYS 39 39 25043 1 . PHE 40 40 25043 1 . MET 41 41 25043 1 . LYS 42 42 25043 1 . SER 43 43 25043 1 . LYS 44 44 25043 1 . PRO 45 45 25043 1 . GLY 46 46 25043 1 . ALA 47 47 25043 1 . ALA 48 48 25043 1 . MET 49 49 25043 1 . VAL 50 50 25043 1 . GLU 51 51 25043 1 . MET 52 52 25043 1 . ALA 53 53 25043 1 . ASP 54 54 25043 1 . GLY 55 55 25043 1 . TYR 56 56 25043 1 . ALA 57 57 25043 1 . VAL 58 58 25043 1 . ASP 59 59 25043 1 . ARG 60 60 25043 1 . ALA 61 61 25043 1 . ILE 62 62 25043 1 . THR 63 63 25043 1 . HIS 64 64 25043 1 . LEU 65 65 25043 1 . ASN 66 66 25043 1 . ASN 67 67 25043 1 . ASN 68 68 25043 1 . PHE 69 69 25043 1 . MET 70 70 25043 1 . PHE 71 71 25043 1 . GLY 72 72 25043 1 . GLN 73 73 25043 1 . LYS 74 74 25043 1 . MET 75 75 25043 1 . ASN 76 76 25043 1 . VAL 77 77 25043 1 . CYS 78 78 25043 1 . VAL 79 79 25043 1 . SER 80 80 25043 1 . LYS 81 81 25043 1 . GLN 82 82 25043 1 . PRO 83 83 25043 1 . ALA 84 84 25043 1 . ILE 85 85 25043 1 . MET 86 86 25043 1 . PRO 87 87 25043 1 . GLY 88 88 25043 1 . GLN 89 89 25043 1 . SER 90 90 25043 1 . TYR 91 91 25043 1 . GLY 92 92 25043 1 . LEU 93 93 25043 1 . GLU 94 94 25043 1 . ASP 95 95 25043 1 . GLY 96 96 25043 1 . SER 97 97 25043 1 . CYS 98 98 25043 1 . SER 99 99 25043 1 . TYR 100 100 25043 1 . LYS 101 101 25043 1 . ASP 102 102 25043 1 . PHE 103 103 25043 1 . SER 104 104 25043 1 . GLU 105 105 25043 1 . SER 106 106 25043 1 . ARG 107 107 25043 1 . ASN 108 108 25043 1 . ASN 109 109 25043 1 . ARG 110 110 25043 1 . PHE 111 111 25043 1 . SER 112 112 25043 1 . THR 113 113 25043 1 . PRO 114 114 25043 1 . GLU 115 115 25043 1 . GLN 116 116 25043 1 . ALA 117 117 25043 1 . ALA 118 118 25043 1 . LYS 119 119 25043 1 . ASN 120 120 25043 1 . ARG 121 121 25043 1 . ILE 122 122 25043 1 . GLN 123 123 25043 1 . HIS 124 124 25043 1 . PRO 125 125 25043 1 . SER 126 126 25043 1 . ASN 127 127 25043 1 . VAL 128 128 25043 1 . LEU 129 129 25043 1 . HIS 130 130 25043 1 . PHE 131 131 25043 1 . PHE 132 132 25043 1 . ASN 133 133 25043 1 . ALA 134 134 25043 1 . PRO 135 135 25043 1 . LEU 136 136 25043 1 . GLU 137 137 25043 1 . VAL 138 138 25043 1 . THR 139 139 25043 1 . GLU 140 140 25043 1 . GLU 141 141 25043 1 . ASN 142 142 25043 1 . PHE 143 143 25043 1 . PHE 144 144 25043 1 . GLU 145 145 25043 1 . ILE 146 146 25043 1 . CYS 147 147 25043 1 . ASP 148 148 25043 1 . GLU 149 149 25043 1 . LEU 150 150 25043 1 . GLY 151 151 25043 1 . VAL 152 152 25043 1 . LYS 153 153 25043 1 . ARG 154 154 25043 1 . PRO 155 155 25043 1 . THR 156 156 25043 1 . SER 157 157 25043 1 . VAL 158 158 25043 1 . LYS 159 159 25043 1 . VAL 160 160 25043 1 . PHE 161 161 25043 1 . SER 162 162 25043 1 . GLY 163 163 25043 1 . LYS 164 164 25043 1 . SER 165 165 25043 1 . GLU 166 166 25043 1 . ARG 167 167 25043 1 . SER 168 168 25043 1 . SER 169 169 25043 1 . SER 170 170 25043 1 . GLY 171 171 25043 1 . LEU 172 172 25043 1 . LEU 173 173 25043 1 . GLU 174 174 25043 1 . TRP 175 175 25043 1 . ASP 176 176 25043 1 . SER 177 177 25043 1 . LYS 178 178 25043 1 . SER 179 179 25043 1 . ASP 180 180 25043 1 . ALA 181 181 25043 1 . LEU 182 182 25043 1 . GLU 183 183 25043 1 . THR 184 184 25043 1 . LEU 185 185 25043 1 . GLY 186 186 25043 1 . PHE 187 187 25043 1 . LEU 188 188 25043 1 . ASN 189 189 25043 1 . HIS 190 190 25043 1 . TYR 191 191 25043 1 . GLN 192 192 25043 1 . MET 193 193 25043 1 . LYS 194 194 25043 1 . ASN 195 195 25043 1 . PRO 196 196 25043 1 . ASN 197 197 25043 1 . GLY 198 198 25043 1 . PRO 199 199 25043 1 . TYR 200 200 25043 1 . PRO 201 201 25043 1 . TYR 202 202 25043 1 . THR 203 203 25043 1 . LEU 204 204 25043 1 . LYS 205 205 25043 1 . LEU 206 206 25043 1 . CYS 207 207 25043 1 . PHE 208 208 25043 1 . SER 209 209 25043 1 . THR 210 210 25043 1 . ALA 211 211 25043 1 . GLN 212 212 25043 1 . HIS 213 213 25043 1 . ALA 214 214 25043 1 . SER 215 215 25043 1 stop_ save_ save_RNA_(5'-R(*AP*CP*AP*CP*A)-3') _Entity.Sf_category entity _Entity.Sf_framecode RNA_(5'-R(*AP*CP*AP*CP*A)-3') _Entity.Entry_ID 25043 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name RNA_(5'-R(*AP*CP*AP*CP*A)-3') _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polyribonucleotide _Entity.Polymer_type_details . _Entity.Polymer_strand_ID B,C _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; ACACA ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 5 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state . _Entity.Src_method syn _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 1553.035 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 1 A . 25043 2 2 2 C . 25043 2 3 3 A . 25043 2 4 4 C . 25043 2 5 5 A . 25043 2 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . A 1 1 25043 2 . C 2 2 25043 2 . A 3 3 25043 2 . C 4 4 25043 2 . A 5 5 25043 2 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 25043 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 10116 organism . 'Rattus norvegicus' 'Norway rat' . . Eukaryota Metazoa Rattus norvegicus . . . . . . . . . . . . . 25043 1 2 2 $RNA_(5'-R(*AP*CP*AP*CP*A)-3') . . 'no natural source' . . . . . . . . . . . . . . . . . . . . . . 25043 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 25043 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pTYB11 . . . 25043 1 2 2 $RNA_(5'-R(*AP*CP*AP*CP*A)-3') . 'chemical synthesis' . . . . . . . . . . . . . . . . 25043 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 25043 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 entity_1 '[U-100% 15N]' . . 1 $entity_1 . . 1.5 . . mM . . . . 25043 1 2 "RNA (5'-R(*AP*CP*AP*CP*A)-3')" 'natural abundance' . . 2 $RNA_(5'-R(*AP*CP*AP*CP*A)-3') . . 3.0 . . mM . . . . 25043 1 3 'sodium chloride' 'natural abundance' . . . . . . 60 . . mM . . . . 25043 1 4 'sodium phosphate' 'natural abundance' . . . . . . 40 . . mM . . . . 25043 1 5 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 25043 1 6 H2O 'natural abundance' . . . . . . 90 . . % . . . . 25043 1 7 D2O 'natural abundance' . . . . . . 10 . . % . . . . 25043 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 25043 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 entity_1 '[U-100% 13C; U-100% 15N]' . . 1 $entity_1 . . 1.5 . . mM . . . . 25043 2 2 "RNA (5'-R(*AP*CP*AP*CP*A)-3')" 'natural abundance' . . 2 $RNA_(5'-R(*AP*CP*AP*CP*A)-3') . . 3.0 . . mM . . . . 25043 2 3 'sodium chloride' 'natural abundance' . . . . . . 60 . . mM . . . . 25043 2 4 'sodium phosphate' 'natural abundance' . . . . . . 40 . . mM . . . . 25043 2 5 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 25043 2 6 H2O 'natural abundance' . . . . . . 90 . . % . . . . 25043 2 7 D2O 'natural abundance' . . . . . . 10 . . % . . . . 25043 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 25043 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 entity_1 '[U-100% 15N]' . . 1 $entity_1 . . 1.5 . . mM . . . . 25043 3 2 "RNA (5'-R(*AP*CP*AP*CP*A)-3')" 'natural abundance' . . 2 $RNA_(5'-R(*AP*CP*AP*CP*A)-3') . . 3.0 . . mM . . . . 25043 3 3 'sodium chloride' 'natural abundance' . . . . . . 60 . . mM . . . . 25043 3 4 'sodium phosphate' 'natural abundance' . . . . . . 40 . . mM . . . . 25043 3 5 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 25043 3 6 D2O 'natural abundance' . . . . . . 100 . . % . . . . 25043 3 stop_ save_ save_sample_4 _Sample.Sf_category sample _Sample.Sf_framecode sample_4 _Sample.Entry_ID 25043 _Sample.ID 4 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 entity_1 '[U-100% 13C; U-100% 15N]' . . 1 $entity_1 . . 1.5 . . mM . . . . 25043 4 2 "RNA (5'-R(*AP*CP*AP*CP*A)-3')" 'natural abundance' . . 2 $RNA_(5'-R(*AP*CP*AP*CP*A)-3') . . 3.0 . . mM . . . . 25043 4 3 'sodium chloride' 'natural abundance' . . . . . . 60 . . mM . . . . 25043 4 4 'sodium phosphate' 'natural abundance' . . . . . . 40 . . mM . . . . 25043 4 5 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 25043 4 6 D2O 'natural abundance' . . . . . . 100 . . % . . . . 25043 4 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 25043 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.1 . M 25043 1 pH 6.5 . pH 25043 1 pressure 1 . atm 25043 1 temperature 313.15 . K 25043 1 stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 25043 _Software.ID 1 _Software.Name TOPSPIN _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 25043 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 25043 1 processing 25043 1 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 25043 _Software.ID 2 _Software.Name SPARKY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 25043 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 25043 2 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 25043 _Software.ID 3 _Software.Name CYANA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 25043 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 25043 3 stop_ save_ save_AMBER _Software.Sf_category software _Software.Sf_framecode AMBER _Software.Entry_ID 25043 _Software.ID 4 _Software.Name AMBER _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Case, Darden, Cheatham, III, Simmerling, Wang, Duke, Luo, ... and Kollman' . . 25043 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 25043 4 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 25043 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 25043 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 25043 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 900 . . . 25043 1 2 spectrometer_2 Bruker Avance . 700 . . . 25043 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 25043 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25043 1 2 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25043 1 3 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25043 1 4 '2D 1H-1H NOESY' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25043 1 5 '2D 1H-1H TOCSY' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25043 1 6 '3D F3-filtered-F2-edited NOESY' no . . . . . . . . . . 4 $sample_4 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25043 1 7 '2D F2-filtered NOESY' no . . . . . . . . . . 4 $sample_4 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25043 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 25043 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . . . . . 25043 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 25043 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 25043 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 25043 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D 1H-15N NOESY' . . . 25043 1 2 '3D 1H-13C NOESY aliphatic' . . . 25043 1 3 '3D 1H-13C NOESY aromatic' . . . 25043 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 2 $SPARKY . . 25043 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 TYR HB2 H 1 3.896 0.020 . 2 . . . A 372 TYR HB2 . 25043 1 2 . 1 1 1 1 TYR HB3 H 1 3.130 0.020 . 2 . . . A 372 TYR HB3 . 25043 1 3 . 1 1 1 1 TYR HD1 H 1 7.239 0.020 . 1 . . . A 372 TYR HD1 . 25043 1 4 . 1 1 1 1 TYR HD2 H 1 7.239 0.020 . 1 . . . A 372 TYR HD2 . 25043 1 5 . 1 1 1 1 TYR HE1 H 1 6.941 0.020 . 1 . . . A 372 TYR HE1 . 25043 1 6 . 1 1 1 1 TYR HE2 H 1 6.941 0.020 . 1 . . . A 372 TYR HE2 . 25043 1 7 . 1 1 1 1 TYR H H 1 6.813 0.020 . 1 . . . A 372 TYR H . 25043 1 8 . 1 1 1 1 TYR CD2 C 13 130.973 0.400 . 1 . . . A 372 TYR CD2 . 25043 1 9 . 1 1 1 1 TYR CE2 C 13 116.095 0.400 . 1 . . . A 372 TYR CE2 . 25043 1 10 . 1 1 1 1 TYR N N 15 112.043 0.400 . 1 . . . A 372 TYR N . 25043 1 11 . 1 1 2 2 GLY H H 1 8.124 0.020 . 1 . . . A 373 GLY H . 25043 1 12 . 1 1 2 2 GLY HA2 H 1 4.165 0.020 . 2 . . . A 373 GLY HA2 . 25043 1 13 . 1 1 2 2 GLY HA3 H 1 4.130 0.020 . 2 . . . A 373 GLY HA3 . 25043 1 14 . 1 1 2 2 GLY CA C 13 41.882 0.400 . 1 . . . A 373 GLY CA . 25043 1 15 . 1 1 2 2 GLY N N 15 112.009 0.400 . 1 . . . A 373 GLY N . 25043 1 16 . 1 1 4 4 HIS H H 1 9.015 0.020 . 1 . . . A 375 HIS H . 25043 1 17 . 1 1 4 4 HIS HA H 1 4.681 0.020 . 1 . . . A 375 HIS HA . 25043 1 18 . 1 1 4 4 HIS HB2 H 1 3.037 0.020 . 2 . . . A 375 HIS HB2 . 25043 1 19 . 1 1 4 4 HIS HB3 H 1 3.037 0.020 . 2 . . . A 375 HIS HB3 . 25043 1 20 . 1 1 4 4 HIS HD2 H 1 7.129 0.020 . 1 . . . A 375 HIS HD2 . 25043 1 21 . 1 1 4 4 HIS HE1 H 1 8.316 0.020 . 1 . . . A 375 HIS HE1 . 25043 1 22 . 1 1 4 4 HIS CB C 13 26.601 0.400 . 1 . . . A 375 HIS CB . 25043 1 23 . 1 1 4 4 HIS CD2 C 13 118.056 0.400 . 1 . . . A 375 HIS CD2 . 25043 1 24 . 1 1 4 4 HIS CE1 C 13 134.717 0.400 . 1 . . . A 375 HIS CE1 . 25043 1 25 . 1 1 4 4 HIS N N 15 119.794 0.400 . 1 . . . A 375 HIS N . 25043 1 26 . 1 1 5 5 ALA H H 1 9.088 0.020 . 1 . . . A 376 ALA H . 25043 1 27 . 1 1 5 5 ALA HA H 1 4.150 0.020 . 1 . . . A 376 ALA HA . 25043 1 28 . 1 1 5 5 ALA HB1 H 1 1.477 0.020 . 1 . . . A 376 ALA HB1 . 25043 1 29 . 1 1 5 5 ALA HB2 H 1 1.477 0.020 . 1 . . . A 376 ALA HB2 . 25043 1 30 . 1 1 5 5 ALA HB3 H 1 1.477 0.020 . 1 . . . A 376 ALA HB3 . 25043 1 31 . 1 1 5 5 ALA CA C 13 50.069 0.400 . 1 . . . A 376 ALA CA . 25043 1 32 . 1 1 5 5 ALA CB C 13 17.217 0.400 . 1 . . . A 376 ALA CB . 25043 1 33 . 1 1 5 5 ALA N N 15 127.815 0.400 . 1 . . . A 376 ALA N . 25043 1 34 . 1 1 6 6 ASP H H 1 8.278 0.020 . 1 . . . A 377 ASP H . 25043 1 35 . 1 1 6 6 ASP HA H 1 4.534 0.020 . 1 . . . A 377 ASP HA . 25043 1 36 . 1 1 6 6 ASP HB2 H 1 2.708 0.020 . 2 . . . A 377 ASP HB2 . 25043 1 37 . 1 1 6 6 ASP HB3 H 1 2.708 0.020 . 2 . . . A 377 ASP HB3 . 25043 1 38 . 1 1 6 6 ASP CA C 13 51.130 0.400 . 1 . . . A 377 ASP CA . 25043 1 39 . 1 1 6 6 ASP CB C 13 38.388 0.400 . 1 . . . A 377 ASP CB . 25043 1 40 . 1 1 6 6 ASP N N 15 119.660 0.400 . 1 . . . A 377 ASP N . 25043 1 41 . 1 1 7 7 SER H H 1 7.405 0.020 . 1 . . . A 378 SER H . 25043 1 42 . 1 1 7 7 SER HA H 1 4.924 0.020 . 1 . . . A 378 SER HA . 25043 1 43 . 1 1 7 7 SER HB2 H 1 3.773 0.020 . 2 . . . A 378 SER HB2 . 25043 1 44 . 1 1 7 7 SER HB3 H 1 3.978 0.020 . 2 . . . A 378 SER HB3 . 25043 1 45 . 1 1 7 7 SER CA C 13 51.422 0.400 . 1 . . . A 378 SER CA . 25043 1 46 . 1 1 7 7 SER CB C 13 62.735 0.400 . 1 . . . A 378 SER CB . 25043 1 47 . 1 1 7 7 SER N N 15 114.338 0.400 . 1 . . . A 378 SER N . 25043 1 48 . 1 1 8 8 PRO HA H 1 4.364 0.020 . 1 . . . A 379 PRO HA . 25043 1 49 . 1 1 8 8 PRO HD2 H 1 4.091 0.020 . 2 . . . A 379 PRO HD2 . 25043 1 50 . 1 1 8 8 PRO HD3 H 1 3.648 0.020 . 2 . . . A 379 PRO HD3 . 25043 1 51 . 1 1 8 8 PRO CA C 13 60.980 0.400 . 1 . . . A 379 PRO CA . 25043 1 52 . 1 1 8 8 PRO CD C 13 47.275 0.400 . 1 . . . A 379 PRO CD . 25043 1 53 . 1 1 9 9 VAL H H 1 8.514 0.020 . 1 . . . A 380 VAL H . 25043 1 54 . 1 1 9 9 VAL HA H 1 4.666 0.020 . 1 . . . A 380 VAL HA . 25043 1 55 . 1 1 9 9 VAL HB H 1 2.022 0.020 . 1 . . . A 380 VAL HB . 25043 1 56 . 1 1 9 9 VAL HG11 H 1 0.515 0.020 . 2 . . . A 380 VAL HG11 . 25043 1 57 . 1 1 9 9 VAL HG12 H 1 0.515 0.020 . 2 . . . A 380 VAL HG12 . 25043 1 58 . 1 1 9 9 VAL HG13 H 1 0.515 0.020 . 2 . . . A 380 VAL HG13 . 25043 1 59 . 1 1 9 9 VAL HG21 H 1 0.648 0.020 . 2 . . . A 380 VAL HG21 . 25043 1 60 . 1 1 9 9 VAL HG22 H 1 0.648 0.020 . 2 . . . A 380 VAL HG22 . 25043 1 61 . 1 1 9 9 VAL HG23 H 1 0.648 0.020 . 2 . . . A 380 VAL HG23 . 25043 1 62 . 1 1 9 9 VAL CB C 13 28.878 0.400 . 1 . . . A 380 VAL CB . 25043 1 63 . 1 1 9 9 VAL CG1 C 13 19.602 0.400 . 1 . . . A 380 VAL CG1 . 25043 1 64 . 1 1 9 9 VAL CG2 C 13 19.204 0.400 . 1 . . . A 380 VAL CG2 . 25043 1 65 . 1 1 9 9 VAL N N 15 122.395 0.400 . 1 . . . A 380 VAL N . 25043 1 66 . 1 1 10 10 LEU H H 1 9.275 0.020 . 1 . . . A 381 LEU H . 25043 1 67 . 1 1 10 10 LEU HA H 1 4.959 0.020 . 1 . . . A 381 LEU HA . 25043 1 68 . 1 1 10 10 LEU HB2 H 1 1.738 0.020 . 1 . . . A 381 LEU HB2 . 25043 1 69 . 1 1 10 10 LEU HB3 H 1 1.521 0.020 . 1 . . . A 381 LEU HB3 . 25043 1 70 . 1 1 10 10 LEU HG H 1 1.862 0.020 . 1 . . . A 381 LEU HG . 25043 1 71 . 1 1 10 10 LEU HD11 H 1 0.841 0.020 . 2 . . . A 381 LEU HD11 . 25043 1 72 . 1 1 10 10 LEU HD12 H 1 0.841 0.020 . 2 . . . A 381 LEU HD12 . 25043 1 73 . 1 1 10 10 LEU HD13 H 1 0.841 0.020 . 2 . . . A 381 LEU HD13 . 25043 1 74 . 1 1 10 10 LEU HD21 H 1 0.487 0.020 . 2 . . . A 381 LEU HD21 . 25043 1 75 . 1 1 10 10 LEU HD22 H 1 0.487 0.020 . 2 . . . A 381 LEU HD22 . 25043 1 76 . 1 1 10 10 LEU HD23 H 1 0.487 0.020 . 2 . . . A 381 LEU HD23 . 25043 1 77 . 1 1 10 10 LEU CA C 13 49.863 0.400 . 1 . . . A 381 LEU CA . 25043 1 78 . 1 1 10 10 LEU CB C 13 42.799 0.400 . 1 . . . A 381 LEU CB . 25043 1 79 . 1 1 10 10 LEU CG C 13 22.837 0.400 . 1 . . . A 381 LEU CG . 25043 1 80 . 1 1 10 10 LEU CD1 C 13 25.384 0.400 . 1 . . . A 381 LEU CD1 . 25043 1 81 . 1 1 10 10 LEU CD2 C 13 23.526 0.400 . 1 . . . A 381 LEU CD2 . 25043 1 82 . 1 1 10 10 LEU N N 15 125.326 0.400 . 1 . . . A 381 LEU N . 25043 1 83 . 1 1 11 11 MET H H 1 8.947 0.020 . 1 . . . A 382 MET H . 25043 1 84 . 1 1 11 11 MET HA H 1 4.846 0.020 . 1 . . . A 382 MET HA . 25043 1 85 . 1 1 11 11 MET HB2 H 1 1.825 0.020 . 2 . . . A 382 MET HB2 . 25043 1 86 . 1 1 11 11 MET HB3 H 1 1.989 0.020 . 2 . . . A 382 MET HB3 . 25043 1 87 . 1 1 11 11 MET HG2 H 1 2.312 0.020 . 2 . . . A 382 MET HG2 . 25043 1 88 . 1 1 11 11 MET HG3 H 1 2.240 0.020 . 2 . . . A 382 MET HG3 . 25043 1 89 . 1 1 11 11 MET HE1 H 1 1.500 0.020 . 1 . . . A 382 MET HE1 . 25043 1 90 . 1 1 11 11 MET HE2 H 1 1.500 0.020 . 1 . . . A 382 MET HE2 . 25043 1 91 . 1 1 11 11 MET HE3 H 1 1.500 0.020 . 1 . . . A 382 MET HE3 . 25043 1 92 . 1 1 11 11 MET CA C 13 49.770 0.400 . 1 . . . A 382 MET CA . 25043 1 93 . 1 1 11 11 MET CE C 13 12.920 0.400 . 1 . . . A 382 MET CE . 25043 1 94 . 1 1 11 11 MET N N 15 118.150 0.400 . 1 . . . A 382 MET N . 25043 1 95 . 1 1 12 12 VAL H H 1 8.500 0.020 . 1 . . . A 383 VAL H . 25043 1 96 . 1 1 12 12 VAL HA H 1 5.010 0.020 . 1 . . . A 383 VAL HA . 25043 1 97 . 1 1 12 12 VAL HB H 1 1.680 0.020 . 1 . . . A 383 VAL HB . 25043 1 98 . 1 1 12 12 VAL HG11 H 1 0.794 0.020 . 2 . . . A 383 VAL HG11 . 25043 1 99 . 1 1 12 12 VAL HG12 H 1 0.794 0.020 . 2 . . . A 383 VAL HG12 . 25043 1 100 . 1 1 12 12 VAL HG13 H 1 0.794 0.020 . 2 . . . A 383 VAL HG13 . 25043 1 101 . 1 1 12 12 VAL HG21 H 1 0.791 0.020 . 2 . . . A 383 VAL HG21 . 25043 1 102 . 1 1 12 12 VAL HG22 H 1 0.791 0.020 . 2 . . . A 383 VAL HG22 . 25043 1 103 . 1 1 12 12 VAL HG23 H 1 0.791 0.020 . 2 . . . A 383 VAL HG23 . 25043 1 104 . 1 1 12 12 VAL CA C 13 56.313 0.400 . 1 . . . A 383 VAL CA . 25043 1 105 . 1 1 12 12 VAL CB C 13 31.297 0.400 . 1 . . . A 383 VAL CB . 25043 1 106 . 1 1 12 12 VAL CG1 C 13 18.093 0.400 . 1 . . . A 383 VAL CG1 . 25043 1 107 . 1 1 12 12 VAL CG2 C 13 19.860 0.400 . 1 . . . A 383 VAL CG2 . 25043 1 108 . 1 1 12 12 VAL N N 15 121.391 0.400 . 1 . . . A 383 VAL N . 25043 1 109 . 1 1 13 13 TYR H H 1 8.944 0.020 . 1 . . . A 384 TYR H . 25043 1 110 . 1 1 13 13 TYR HA H 1 5.037 0.020 . 1 . . . A 384 TYR HA . 25043 1 111 . 1 1 13 13 TYR HB2 H 1 2.680 0.020 . 1 . . . A 384 TYR HB2 . 25043 1 112 . 1 1 13 13 TYR HB3 H 1 3.110 0.020 . 1 . . . A 384 TYR HB3 . 25043 1 113 . 1 1 13 13 TYR HD1 H 1 6.611 0.020 . 1 . . . A 384 TYR HD1 . 25043 1 114 . 1 1 13 13 TYR HD2 H 1 6.611 0.020 . 1 . . . A 384 TYR HD2 . 25043 1 115 . 1 1 13 13 TYR HE1 H 1 6.020 0.020 . 1 . . . A 384 TYR HE1 . 25043 1 116 . 1 1 13 13 TYR HE2 H 1 6.020 0.020 . 1 . . . A 384 TYR HE2 . 25043 1 117 . 1 1 13 13 TYR CA C 13 53.264 0.400 . 1 . . . A 384 TYR CA . 25043 1 118 . 1 1 13 13 TYR CB C 13 39.263 0.400 . 1 . . . A 384 TYR CB . 25043 1 119 . 1 1 13 13 TYR CD2 C 13 130.429 0.400 . 1 . . . A 384 TYR CD2 . 25043 1 120 . 1 1 13 13 TYR CE2 C 13 114.407 0.400 . 1 . . . A 384 TYR CE2 . 25043 1 121 . 1 1 13 13 TYR N N 15 122.905 0.400 . 1 . . . A 384 TYR N . 25043 1 122 . 1 1 14 14 GLY H H 1 8.346 0.020 . 1 . . . A 385 GLY H . 25043 1 123 . 1 1 14 14 GLY HA2 H 1 4.667 0.020 . 1 . . . A 385 GLY HA2 . 25043 1 124 . 1 1 14 14 GLY HA3 H 1 3.771 0.020 . 1 . . . A 385 GLY HA3 . 25043 1 125 . 1 1 14 14 GLY CA C 13 42.903 0.400 . 1 . . . A 385 GLY CA . 25043 1 126 . 1 1 14 14 GLY N N 15 108.207 0.400 . 1 . . . A 385 GLY N . 25043 1 127 . 1 1 15 15 LEU H H 1 8.843 0.020 . 1 . . . A 386 LEU H . 25043 1 128 . 1 1 15 15 LEU HA H 1 4.453 0.020 . 1 . . . A 386 LEU HA . 25043 1 129 . 1 1 15 15 LEU HB2 H 1 1.831 0.020 . 1 . . . A 386 LEU HB2 . 25043 1 130 . 1 1 15 15 LEU HB3 H 1 1.033 0.020 . 1 . . . A 386 LEU HB3 . 25043 1 131 . 1 1 15 15 LEU HG H 1 1.626 0.020 . 1 . . . A 386 LEU HG . 25043 1 132 . 1 1 15 15 LEU HD11 H 1 0.897 0.020 . 2 . . . A 386 LEU HD11 . 25043 1 133 . 1 1 15 15 LEU HD12 H 1 0.897 0.020 . 2 . . . A 386 LEU HD12 . 25043 1 134 . 1 1 15 15 LEU HD13 H 1 0.897 0.020 . 2 . . . A 386 LEU HD13 . 25043 1 135 . 1 1 15 15 LEU HD21 H 1 0.544 0.020 . 2 . . . A 386 LEU HD21 . 25043 1 136 . 1 1 15 15 LEU HD22 H 1 0.544 0.020 . 2 . . . A 386 LEU HD22 . 25043 1 137 . 1 1 15 15 LEU HD23 H 1 0.544 0.020 . 2 . . . A 386 LEU HD23 . 25043 1 138 . 1 1 15 15 LEU CA C 13 50.862 0.400 . 1 . . . A 386 LEU CA . 25043 1 139 . 1 1 15 15 LEU CB C 13 39.814 0.400 . 1 . . . A 386 LEU CB . 25043 1 140 . 1 1 15 15 LEU CG C 13 23.896 0.400 . 1 . . . A 386 LEU CG . 25043 1 141 . 1 1 15 15 LEU CD1 C 13 20.131 0.400 . 1 . . . A 386 LEU CD1 . 25043 1 142 . 1 1 15 15 LEU CD2 C 13 24.446 0.400 . 1 . . . A 386 LEU CD2 . 25043 1 143 . 1 1 15 15 LEU N N 15 117.987 0.400 . 1 . . . A 386 LEU N . 25043 1 144 . 1 1 16 16 ASP H H 1 8.326 0.020 . 1 . . . A 387 ASP H . 25043 1 145 . 1 1 16 16 ASP HA H 1 4.441 0.020 . 1 . . . A 387 ASP HA . 25043 1 146 . 1 1 16 16 ASP HB2 H 1 2.770 0.020 . 2 . . . A 387 ASP HB2 . 25043 1 147 . 1 1 16 16 ASP HB3 H 1 2.639 0.020 . 2 . . . A 387 ASP HB3 . 25043 1 148 . 1 1 16 16 ASP CA C 13 52.850 0.400 . 1 . . . A 387 ASP CA . 25043 1 149 . 1 1 16 16 ASP CB C 13 39.577 0.400 . 1 . . . A 387 ASP CB . 25043 1 150 . 1 1 16 16 ASP N N 15 122.067 0.400 . 1 . . . A 387 ASP N . 25043 1 151 . 1 1 17 17 GLN H H 1 8.977 0.020 . 1 . . . A 388 GLN H . 25043 1 152 . 1 1 17 17 GLN HA H 1 4.204 0.020 . 1 . . . A 388 GLN HA . 25043 1 153 . 1 1 17 17 GLN HB2 H 1 2.254 0.020 . 2 . . . A 388 GLN HB2 . 25043 1 154 . 1 1 17 17 GLN HB3 H 1 2.193 0.020 . 2 . . . A 388 GLN HB3 . 25043 1 155 . 1 1 17 17 GLN HG2 H 1 2.581 0.020 . 2 . . . A 388 GLN HG2 . 25043 1 156 . 1 1 17 17 GLN HG3 H 1 2.514 0.020 . 2 . . . A 388 GLN HG3 . 25043 1 157 . 1 1 17 17 GLN HE21 H 1 7.701 0.020 . 1 . . . A 388 GLN HE21 . 25043 1 158 . 1 1 17 17 GLN HE22 H 1 6.861 0.020 . 1 . . . A 388 GLN HE22 . 25043 1 159 . 1 1 17 17 GLN CA C 13 55.393 0.400 . 1 . . . A 388 GLN CA . 25043 1 160 . 1 1 17 17 GLN CB C 13 26.670 0.400 . 1 . . . A 388 GLN CB . 25043 1 161 . 1 1 17 17 GLN CG C 13 31.653 0.400 . 1 . . . A 388 GLN CG . 25043 1 162 . 1 1 17 17 GLN N N 15 127.122 0.400 . 1 . . . A 388 GLN N . 25043 1 163 . 1 1 17 17 GLN NE2 N 15 111.772 0.400 . 1 . . . A 388 GLN NE2 . 25043 1 164 . 1 1 18 18 SER H H 1 8.577 0.020 . 1 . . . A 389 SER H . 25043 1 165 . 1 1 18 18 SER HA H 1 4.483 0.020 . 1 . . . A 389 SER HA . 25043 1 166 . 1 1 18 18 SER HB2 H 1 3.933 0.020 . 2 . . . A 389 SER HB2 . 25043 1 167 . 1 1 18 18 SER HB3 H 1 3.933 0.020 . 2 . . . A 389 SER HB3 . 25043 1 168 . 1 1 18 18 SER CA C 13 57.311 0.400 . 1 . . . A 389 SER CA . 25043 1 169 . 1 1 18 18 SER CB C 13 61.220 0.400 . 1 . . . A 389 SER CB . 25043 1 170 . 1 1 18 18 SER N N 15 114.688 0.400 . 1 . . . A 389 SER N . 25043 1 171 . 1 1 19 19 LYS H H 1 7.929 0.020 . 1 . . . A 390 LYS H . 25043 1 172 . 1 1 19 19 LYS HA H 1 4.380 0.020 . 1 . . . A 390 LYS HA . 25043 1 173 . 1 1 19 19 LYS HB2 H 1 1.601 0.020 . 1 . . . A 390 LYS HB2 . 25043 1 174 . 1 1 19 19 LYS HB3 H 1 1.130 0.020 . 1 . . . A 390 LYS HB3 . 25043 1 175 . 1 1 19 19 LYS HG2 H 1 0.785 0.020 . 1 . . . A 390 LYS HG2 . 25043 1 176 . 1 1 19 19 LYS HG3 H 1 1.119 0.020 . 1 . . . A 390 LYS HG3 . 25043 1 177 . 1 1 19 19 LYS HD2 H 1 1.025 0.020 . 1 . . . A 390 LYS HD2 . 25043 1 178 . 1 1 19 19 LYS HD3 H 1 0.772 0.020 . 1 . . . A 390 LYS HD3 . 25043 1 179 . 1 1 19 19 LYS HE2 H 1 2.715 0.020 . 2 . . . A 390 LYS HE2 . 25043 1 180 . 1 1 19 19 LYS HE3 H 1 2.692 0.020 . 2 . . . A 390 LYS HE3 . 25043 1 181 . 1 1 19 19 LYS CA C 13 53.822 0.400 . 1 . . . A 390 LYS CA . 25043 1 182 . 1 1 19 19 LYS CB C 13 33.376 0.400 . 1 . . . A 390 LYS CB . 25043 1 183 . 1 1 19 19 LYS CG C 13 21.901 0.400 . 1 . . . A 390 LYS CG . 25043 1 184 . 1 1 19 19 LYS CD C 13 25.508 0.400 . 1 . . . A 390 LYS CD . 25043 1 185 . 1 1 19 19 LYS CE C 13 39.422 0.400 . 1 . . . A 390 LYS CE . 25043 1 186 . 1 1 19 19 LYS N N 15 118.774 0.400 . 1 . . . A 390 LYS N . 25043 1 187 . 1 1 20 20 MET H H 1 7.581 0.020 . 1 . . . A 391 MET H . 25043 1 188 . 1 1 20 20 MET HA H 1 4.914 0.020 . 1 . . . A 391 MET HA . 25043 1 189 . 1 1 20 20 MET HB2 H 1 2.279 0.020 . 2 . . . A 391 MET HB2 . 25043 1 190 . 1 1 20 20 MET HB3 H 1 1.840 0.020 . 2 . . . A 391 MET HB3 . 25043 1 191 . 1 1 20 20 MET HG2 H 1 3.026 0.020 . 2 . . . A 391 MET HG2 . 25043 1 192 . 1 1 20 20 MET HG3 H 1 2.765 0.020 . 2 . . . A 391 MET HG3 . 25043 1 193 . 1 1 20 20 MET HE1 H 1 2.108 0.020 . 1 . . . A 391 MET HE1 . 25043 1 194 . 1 1 20 20 MET HE2 H 1 2.108 0.020 . 1 . . . A 391 MET HE2 . 25043 1 195 . 1 1 20 20 MET HE3 H 1 2.108 0.020 . 1 . . . A 391 MET HE3 . 25043 1 196 . 1 1 20 20 MET CA C 13 50.778 0.400 . 1 . . . A 391 MET CA . 25043 1 197 . 1 1 20 20 MET CB C 13 29.697 0.400 . 1 . . . A 391 MET CB . 25043 1 198 . 1 1 20 20 MET CG C 13 31.124 0.400 . 1 . . . A 391 MET CG . 25043 1 199 . 1 1 20 20 MET CE C 13 13.989 0.400 . 1 . . . A 391 MET CE . 25043 1 200 . 1 1 20 20 MET N N 15 112.932 0.400 . 1 . . . A 391 MET N . 25043 1 201 . 1 1 21 21 ASN H H 1 6.778 0.020 . 1 . . . A 392 ASN H . 25043 1 202 . 1 1 21 21 ASN HA H 1 4.109 0.020 . 1 . . . A 392 ASN HA . 25043 1 203 . 1 1 21 21 ASN HB2 H 1 3.123 0.020 . 1 . . . A 392 ASN HB2 . 25043 1 204 . 1 1 21 21 ASN HB3 H 1 2.876 0.020 . 1 . . . A 392 ASN HB3 . 25043 1 205 . 1 1 21 21 ASN HD21 H 1 8.032 0.020 . 1 . . . A 392 ASN HD21 . 25043 1 206 . 1 1 21 21 ASN HD22 H 1 6.772 0.020 . 1 . . . A 392 ASN HD22 . 25043 1 207 . 1 1 21 21 ASN CA C 13 48.524 0.400 . 1 . . . A 392 ASN CA . 25043 1 208 . 1 1 21 21 ASN CB C 13 35.895 0.400 . 1 . . . A 392 ASN CB . 25043 1 209 . 1 1 21 21 ASN N N 15 114.995 0.400 . 1 . . . A 392 ASN N . 25043 1 210 . 1 1 21 21 ASN ND2 N 15 111.072 0.400 . 1 . . . A 392 ASN ND2 . 25043 1 211 . 1 1 22 22 CYS H H 1 9.322 0.020 . 1 . . . A 393 CYS H . 25043 1 212 . 1 1 22 22 CYS HA H 1 4.190 0.020 . 1 . . . A 393 CYS HA . 25043 1 213 . 1 1 22 22 CYS HB2 H 1 3.026 0.020 . 2 . . . A 393 CYS HB2 . 25043 1 214 . 1 1 22 22 CYS HB3 H 1 2.782 0.020 . 2 . . . A 393 CYS HB3 . 25043 1 215 . 1 1 22 22 CYS CA C 13 62.837 0.400 . 1 . . . A 393 CYS CA . 25043 1 216 . 1 1 22 22 CYS CB C 13 24.396 0.400 . 1 . . . A 393 CYS CB . 25043 1 217 . 1 1 22 22 CYS N N 15 116.257 0.400 . 1 . . . A 393 CYS N . 25043 1 218 . 1 1 23 23 ASP H H 1 8.163 0.020 . 1 . . . A 394 ASP H . 25043 1 219 . 1 1 23 23 ASP HA H 1 4.596 0.020 . 1 . . . A 394 ASP HA . 25043 1 220 . 1 1 23 23 ASP HB2 H 1 3.048 0.020 . 2 . . . A 394 ASP HB2 . 25043 1 221 . 1 1 23 23 ASP HB3 H 1 2.782 0.020 . 2 . . . A 394 ASP HB3 . 25043 1 222 . 1 1 23 23 ASP CA C 13 56.056 0.400 . 1 . . . A 394 ASP CA . 25043 1 223 . 1 1 23 23 ASP CB C 13 37.786 0.400 . 1 . . . A 394 ASP CB . 25043 1 224 . 1 1 23 23 ASP N N 15 120.330 0.400 . 1 . . . A 394 ASP N . 25043 1 225 . 1 1 24 24 ARG H H 1 8.480 0.020 . 1 . . . A 395 ARG H . 25043 1 226 . 1 1 24 24 ARG HB2 H 1 1.937 0.020 . 2 . . . A 395 ARG HB2 . 25043 1 227 . 1 1 24 24 ARG HB3 H 1 1.737 0.020 . 2 . . . A 395 ARG HB3 . 25043 1 228 . 1 1 24 24 ARG HD2 H 1 2.763 0.020 . 2 . . . A 395 ARG HD2 . 25043 1 229 . 1 1 24 24 ARG HD3 H 1 2.367 0.020 . 2 . . . A 395 ARG HD3 . 25043 1 230 . 1 1 24 24 ARG HE H 1 6.667 0.020 . 1 . . . A 395 ARG HE . 25043 1 231 . 1 1 24 24 ARG CB C 13 28.098 0.400 . 1 . . . A 395 ARG CB . 25043 1 232 . 1 1 24 24 ARG CD C 13 40.787 0.400 . 1 . . . A 395 ARG CD . 25043 1 233 . 1 1 24 24 ARG N N 15 118.893 0.400 . 1 . . . A 395 ARG N . 25043 1 234 . 1 1 24 24 ARG NE N 15 119.221 0.400 . 1 . . . A 395 ARG NE . 25043 1 235 . 1 1 25 25 VAL H H 1 8.013 0.020 . 1 . . . A 396 VAL H . 25043 1 236 . 1 1 25 25 VAL HA H 1 3.742 0.020 . 1 . . . A 396 VAL HA . 25043 1 237 . 1 1 25 25 VAL HB H 1 2.326 0.020 . 1 . . . A 396 VAL HB . 25043 1 238 . 1 1 25 25 VAL HG11 H 1 1.047 0.020 . 2 . . . A 396 VAL HG11 . 25043 1 239 . 1 1 25 25 VAL HG12 H 1 1.047 0.020 . 2 . . . A 396 VAL HG12 . 25043 1 240 . 1 1 25 25 VAL HG13 H 1 1.047 0.020 . 2 . . . A 396 VAL HG13 . 25043 1 241 . 1 1 25 25 VAL HG21 H 1 0.683 0.020 . 2 . . . A 396 VAL HG21 . 25043 1 242 . 1 1 25 25 VAL HG22 H 1 0.683 0.020 . 2 . . . A 396 VAL HG22 . 25043 1 243 . 1 1 25 25 VAL HG23 H 1 0.683 0.020 . 2 . . . A 396 VAL HG23 . 25043 1 244 . 1 1 25 25 VAL CA C 13 64.787 0.400 . 1 . . . A 396 VAL CA . 25043 1 245 . 1 1 25 25 VAL CB C 13 28.864 0.400 . 1 . . . A 396 VAL CB . 25043 1 246 . 1 1 25 25 VAL CG1 C 13 22.437 0.400 . 1 . . . A 396 VAL CG1 . 25043 1 247 . 1 1 25 25 VAL CG2 C 13 20.520 0.400 . 1 . . . A 396 VAL CG2 . 25043 1 248 . 1 1 25 25 VAL N N 15 117.636 0.400 . 1 . . . A 396 VAL N . 25043 1 249 . 1 1 26 26 PHE H H 1 8.496 0.020 . 1 . . . A 397 PHE H . 25043 1 250 . 1 1 26 26 PHE HA H 1 3.520 0.020 . 1 . . . A 397 PHE HA . 25043 1 251 . 1 1 26 26 PHE HB2 H 1 3.259 0.020 . 2 . . . A 397 PHE HB2 . 25043 1 252 . 1 1 26 26 PHE HB3 H 1 2.044 0.020 . 2 . . . A 397 PHE HB3 . 25043 1 253 . 1 1 26 26 PHE HD1 H 1 6.441 0.020 . 1 . . . A 397 PHE HD1 . 25043 1 254 . 1 1 26 26 PHE HD2 H 1 6.441 0.020 . 1 . . . A 397 PHE HD2 . 25043 1 255 . 1 1 26 26 PHE HE1 H 1 6.959 0.020 . 1 . . . A 397 PHE HE1 . 25043 1 256 . 1 1 26 26 PHE HE2 H 1 6.959 0.020 . 1 . . . A 397 PHE HE2 . 25043 1 257 . 1 1 26 26 PHE HZ H 1 6.628 0.020 . 1 . . . A 397 PHE HZ . 25043 1 258 . 1 1 26 26 PHE CA C 13 60.428 0.400 . 1 . . . A 397 PHE CA . 25043 1 259 . 1 1 26 26 PHE CB C 13 35.947 0.400 . 1 . . . A 397 PHE CB . 25043 1 260 . 1 1 26 26 PHE CD2 C 13 128.928 0.400 . 1 . . . A 397 PHE CD2 . 25043 1 261 . 1 1 26 26 PHE CE2 C 13 127.869 0.400 . 1 . . . A 397 PHE CE2 . 25043 1 262 . 1 1 26 26 PHE CZ C 13 126.558 0.400 . 1 . . . A 397 PHE CZ . 25043 1 263 . 1 1 26 26 PHE N N 15 123.337 0.400 . 1 . . . A 397 PHE N . 25043 1 264 . 1 1 27 27 ASN H H 1 8.651 0.020 . 1 . . . A 398 ASN H . 25043 1 265 . 1 1 27 27 ASN HA H 1 4.473 0.020 . 1 . . . A 398 ASN HA . 25043 1 266 . 1 1 27 27 ASN HD21 H 1 7.350 0.020 . 2 . . . A 398 ASN HD21 . 25043 1 267 . 1 1 27 27 ASN HD22 H 1 6.813 0.020 . 2 . . . A 398 ASN HD22 . 25043 1 268 . 1 1 27 27 ASN CA C 13 52.532 0.400 . 1 . . . A 398 ASN CA . 25043 1 269 . 1 1 27 27 ASN N N 15 116.437 0.400 . 1 . . . A 398 ASN N . 25043 1 270 . 1 1 27 27 ASN ND2 N 15 110.804 0.400 . 1 . . . A 398 ASN ND2 . 25043 1 271 . 1 1 28 28 VAL H H 1 7.235 0.020 . 1 . . . A 399 VAL H . 25043 1 272 . 1 1 28 28 VAL HA H 1 4.025 0.020 . 1 . . . A 399 VAL HA . 25043 1 273 . 1 1 28 28 VAL HB H 1 2.144 0.020 . 1 . . . A 399 VAL HB . 25043 1 274 . 1 1 28 28 VAL HG11 H 1 1.054 0.020 . 2 . . . A 399 VAL HG11 . 25043 1 275 . 1 1 28 28 VAL HG12 H 1 1.054 0.020 . 2 . . . A 399 VAL HG12 . 25043 1 276 . 1 1 28 28 VAL HG13 H 1 1.054 0.020 . 2 . . . A 399 VAL HG13 . 25043 1 277 . 1 1 28 28 VAL HG21 H 1 0.658 0.020 . 2 . . . A 399 VAL HG21 . 25043 1 278 . 1 1 28 28 VAL HG22 H 1 0.658 0.020 . 2 . . . A 399 VAL HG22 . 25043 1 279 . 1 1 28 28 VAL HG23 H 1 0.658 0.020 . 2 . . . A 399 VAL HG23 . 25043 1 280 . 1 1 28 28 VAL CA C 13 61.687 0.400 . 1 . . . A 399 VAL CA . 25043 1 281 . 1 1 28 28 VAL CB C 13 30.672 0.400 . 1 . . . A 399 VAL CB . 25043 1 282 . 1 1 28 28 VAL CG1 C 13 18.450 0.400 . 1 . . . A 399 VAL CG1 . 25043 1 283 . 1 1 28 28 VAL CG2 C 13 19.322 0.400 . 1 . . . A 399 VAL CG2 . 25043 1 284 . 1 1 28 28 VAL N N 15 116.137 0.400 . 1 . . . A 399 VAL N . 25043 1 285 . 1 1 29 29 PHE H H 1 8.341 0.020 . 1 . . . A 400 PHE H . 25043 1 286 . 1 1 29 29 PHE HA H 1 3.994 0.020 . 1 . . . A 400 PHE HA . 25043 1 287 . 1 1 29 29 PHE HB2 H 1 2.864 0.020 . 2 . . . A 400 PHE HB2 . 25043 1 288 . 1 1 29 29 PHE HB3 H 1 2.631 0.020 . 2 . . . A 400 PHE HB3 . 25043 1 289 . 1 1 29 29 PHE HD1 H 1 7.434 0.020 . 1 . . . A 400 PHE HD1 . 25043 1 290 . 1 1 29 29 PHE HD2 H 1 7.434 0.020 . 1 . . . A 400 PHE HD2 . 25043 1 291 . 1 1 29 29 PHE HE1 H 1 6.985 0.020 . 1 . . . A 400 PHE HE1 . 25043 1 292 . 1 1 29 29 PHE HE2 H 1 6.985 0.020 . 1 . . . A 400 PHE HE2 . 25043 1 293 . 1 1 29 29 PHE CA C 13 60.357 0.400 . 1 . . . A 400 PHE CA . 25043 1 294 . 1 1 29 29 PHE CB C 13 36.086 0.400 . 1 . . . A 400 PHE CB . 25043 1 295 . 1 1 29 29 PHE CD2 C 13 128.841 0.400 . 1 . . . A 400 PHE CD2 . 25043 1 296 . 1 1 29 29 PHE N N 15 113.979 0.400 . 1 . . . A 400 PHE N . 25043 1 297 . 1 1 30 30 CYS H H 1 8.734 0.020 . 1 . . . A 401 CYS H . 25043 1 298 . 1 1 30 30 CYS HA H 1 4.679 0.020 . 1 . . . A 401 CYS HA . 25043 1 299 . 1 1 30 30 CYS HB2 H 1 3.085 0.020 . 1 . . . A 401 CYS HB2 . 25043 1 300 . 1 1 30 30 CYS HB3 H 1 1.998 0.020 . 1 . . . A 401 CYS HB3 . 25043 1 301 . 1 1 30 30 CYS CB C 13 23.892 0.400 . 1 . . . A 401 CYS CB . 25043 1 302 . 1 1 30 30 CYS N N 15 115.433 0.400 . 1 . . . A 401 CYS N . 25043 1 303 . 1 1 31 31 LEU H H 1 6.804 0.020 . 1 . . . A 402 LEU H . 25043 1 304 . 1 1 31 31 LEU HA H 1 4.062 0.020 . 1 . . . A 402 LEU HA . 25043 1 305 . 1 1 31 31 LEU HB2 H 1 1.359 0.020 . 2 . . . A 402 LEU HB2 . 25043 1 306 . 1 1 31 31 LEU HB3 H 1 1.115 0.020 . 2 . . . A 402 LEU HB3 . 25043 1 307 . 1 1 31 31 LEU HG H 1 1.763 0.020 . 1 . . . A 402 LEU HG . 25043 1 308 . 1 1 31 31 LEU HD11 H 1 0.932 0.020 . 2 . . . A 402 LEU HD11 . 25043 1 309 . 1 1 31 31 LEU HD12 H 1 0.932 0.020 . 2 . . . A 402 LEU HD12 . 25043 1 310 . 1 1 31 31 LEU HD13 H 1 0.932 0.020 . 2 . . . A 402 LEU HD13 . 25043 1 311 . 1 1 31 31 LEU HD21 H 1 0.881 0.020 . 2 . . . A 402 LEU HD21 . 25043 1 312 . 1 1 31 31 LEU HD22 H 1 0.881 0.020 . 2 . . . A 402 LEU HD22 . 25043 1 313 . 1 1 31 31 LEU HD23 H 1 0.881 0.020 . 2 . . . A 402 LEU HD23 . 25043 1 314 . 1 1 31 31 LEU CA C 13 53.699 0.400 . 1 . . . A 402 LEU CA . 25043 1 315 . 1 1 31 31 LEU CB C 13 38.881 0.400 . 1 . . . A 402 LEU CB . 25043 1 316 . 1 1 31 31 LEU CG C 13 26.239 0.400 . 1 . . . A 402 LEU CG . 25043 1 317 . 1 1 31 31 LEU CD1 C 13 23.136 0.400 . 1 . . . A 402 LEU CD1 . 25043 1 318 . 1 1 31 31 LEU CD2 C 13 23.075 0.400 . 1 . . . A 402 LEU CD2 . 25043 1 319 . 1 1 31 31 LEU N N 15 119.355 0.400 . 1 . . . A 402 LEU N . 25043 1 320 . 1 1 32 32 TYR H H 1 7.744 0.020 . 1 . . . A 403 TYR H . 25043 1 321 . 1 1 32 32 TYR HA H 1 4.441 0.020 . 1 . . . A 403 TYR HA . 25043 1 322 . 1 1 32 32 TYR HB2 H 1 2.516 0.020 . 2 . . . A 403 TYR HB2 . 25043 1 323 . 1 1 32 32 TYR HB3 H 1 3.303 0.020 . 2 . . . A 403 TYR HB3 . 25043 1 324 . 1 1 32 32 TYR HD1 H 1 6.932 0.020 . 1 . . . A 403 TYR HD1 . 25043 1 325 . 1 1 32 32 TYR HD2 H 1 6.932 0.020 . 1 . . . A 403 TYR HD2 . 25043 1 326 . 1 1 32 32 TYR HE1 H 1 6.624 0.020 . 1 . . . A 403 TYR HE1 . 25043 1 327 . 1 1 32 32 TYR HE2 H 1 6.624 0.020 . 1 . . . A 403 TYR HE2 . 25043 1 328 . 1 1 32 32 TYR CA C 13 56.779 0.400 . 1 . . . A 403 TYR CA . 25043 1 329 . 1 1 32 32 TYR CB C 13 37.251 0.400 . 1 . . . A 403 TYR CB . 25043 1 330 . 1 1 32 32 TYR CD1 C 13 129.707 0.400 . 1 . . . A 403 TYR CD1 . 25043 1 331 . 1 1 32 32 TYR CE1 C 13 116.262 0.400 . 1 . . . A 403 TYR CE1 . 25043 1 332 . 1 1 32 32 TYR N N 15 112.912 0.400 . 1 . . . A 403 TYR N . 25043 1 333 . 1 1 33 33 GLY H H 1 7.208 0.020 . 1 . . . A 404 GLY H . 25043 1 334 . 1 1 33 33 GLY HA2 H 1 3.320 0.020 . 1 . . . A 404 GLY HA2 . 25043 1 335 . 1 1 33 33 GLY HA3 H 1 1.781 0.020 . 1 . . . A 404 GLY HA3 . 25043 1 336 . 1 1 33 33 GLY CA C 13 41.134 0.400 . 1 . . . A 404 GLY CA . 25043 1 337 . 1 1 33 33 GLY N N 15 108.749 0.400 . 1 . . . A 404 GLY N . 25043 1 338 . 1 1 34 34 ASN H H 1 8.445 0.020 . 1 . . . A 405 ASN H . 25043 1 339 . 1 1 34 34 ASN HA H 1 4.741 0.020 . 1 . . . A 405 ASN HA . 25043 1 340 . 1 1 34 34 ASN HB2 H 1 2.630 0.020 . 2 . . . A 405 ASN HB2 . 25043 1 341 . 1 1 34 34 ASN HB3 H 1 2.630 0.020 . 2 . . . A 405 ASN HB3 . 25043 1 342 . 1 1 34 34 ASN HD21 H 1 7.576 0.020 . 2 . . . A 405 ASN HD21 . 25043 1 343 . 1 1 34 34 ASN HD22 H 1 6.945 0.020 . 2 . . . A 405 ASN HD22 . 25043 1 344 . 1 1 34 34 ASN CA C 13 50.864 0.400 . 1 . . . A 405 ASN CA . 25043 1 345 . 1 1 34 34 ASN CB C 13 34.932 0.400 . 1 . . . A 405 ASN CB . 25043 1 346 . 1 1 34 34 ASN N N 15 119.687 0.400 . 1 . . . A 405 ASN N . 25043 1 347 . 1 1 34 34 ASN ND2 N 15 110.870 0.400 . 1 . . . A 405 ASN ND2 . 25043 1 348 . 1 1 35 35 VAL H H 1 8.938 0.020 . 1 . . . A 406 VAL H . 25043 1 349 . 1 1 35 35 VAL HB H 1 2.120 0.020 . 1 . . . A 406 VAL HB . 25043 1 350 . 1 1 35 35 VAL HG11 H 1 0.630 0.020 . 2 . . . A 406 VAL HG11 . 25043 1 351 . 1 1 35 35 VAL HG12 H 1 0.630 0.020 . 2 . . . A 406 VAL HG12 . 25043 1 352 . 1 1 35 35 VAL HG13 H 1 0.630 0.020 . 2 . . . A 406 VAL HG13 . 25043 1 353 . 1 1 35 35 VAL HG21 H 1 0.702 0.020 . 2 . . . A 406 VAL HG21 . 25043 1 354 . 1 1 35 35 VAL HG22 H 1 0.702 0.020 . 2 . . . A 406 VAL HG22 . 25043 1 355 . 1 1 35 35 VAL HG23 H 1 0.702 0.020 . 2 . . . A 406 VAL HG23 . 25043 1 356 . 1 1 35 35 VAL CB C 13 30.146 0.400 . 1 . . . A 406 VAL CB . 25043 1 357 . 1 1 35 35 VAL CG1 C 13 17.643 0.400 . 1 . . . A 406 VAL CG1 . 25043 1 358 . 1 1 35 35 VAL CG2 C 13 19.163 0.400 . 1 . . . A 406 VAL CG2 . 25043 1 359 . 1 1 35 35 VAL N N 15 125.533 0.400 . 1 . . . A 406 VAL N . 25043 1 360 . 1 1 36 36 GLU H H 1 9.372 0.020 . 1 . . . A 407 GLU H . 25043 1 361 . 1 1 36 36 GLU HA H 1 4.520 0.020 . 1 . . . A 407 GLU HA . 25043 1 362 . 1 1 36 36 GLU HB2 H 1 2.340 0.020 . 1 . . . A 407 GLU HB2 . 25043 1 363 . 1 1 36 36 GLU HB3 H 1 1.652 0.020 . 1 . . . A 407 GLU HB3 . 25043 1 364 . 1 1 36 36 GLU HG2 H 1 2.424 0.020 . 2 . . . A 407 GLU HG2 . 25043 1 365 . 1 1 36 36 GLU HG3 H 1 1.971 0.020 . 2 . . . A 407 GLU HG3 . 25043 1 366 . 1 1 36 36 GLU CA C 13 53.667 0.400 . 1 . . . A 407 GLU CA . 25043 1 367 . 1 1 36 36 GLU CB C 13 27.342 0.400 . 1 . . . A 407 GLU CB . 25043 1 368 . 1 1 36 36 GLU CG C 13 30.548 0.400 . 1 . . . A 407 GLU CG . 25043 1 369 . 1 1 36 36 GLU N N 15 122.543 0.400 . 1 . . . A 407 GLU N . 25043 1 370 . 1 1 37 37 LYS H H 1 7.860 0.020 . 1 . . . A 408 LYS H . 25043 1 371 . 1 1 37 37 LYS HA H 1 5.448 0.020 . 1 . . . A 408 LYS HA . 25043 1 372 . 1 1 37 37 LYS HB2 H 1 1.642 0.020 . 2 . . . A 408 LYS HB2 . 25043 1 373 . 1 1 37 37 LYS HB3 H 1 1.867 0.020 . 2 . . . A 408 LYS HB3 . 25043 1 374 . 1 1 37 37 LYS HG2 H 1 1.510 0.020 . 2 . . . A 408 LYS HG2 . 25043 1 375 . 1 1 37 37 LYS HD2 H 1 1.945 0.020 . 2 . . . A 408 LYS HD2 . 25043 1 376 . 1 1 37 37 LYS HD3 H 1 1.733 0.020 . 2 . . . A 408 LYS HD3 . 25043 1 377 . 1 1 37 37 LYS HE2 H 1 3.151 0.020 . 2 . . . A 408 LYS HE2 . 25043 1 378 . 1 1 37 37 LYS HE3 H 1 3.015 0.020 . 2 . . . A 408 LYS HE3 . 25043 1 379 . 1 1 37 37 LYS CA C 13 52.736 0.400 . 1 . . . A 408 LYS CA . 25043 1 380 . 1 1 37 37 LYS CB C 13 37.883 0.400 . 1 . . . A 408 LYS CB . 25043 1 381 . 1 1 37 37 LYS CG C 13 23.517 0.400 . 1 . . . A 408 LYS CG . 25043 1 382 . 1 1 37 37 LYS CD C 13 28.062 0.400 . 1 . . . A 408 LYS CD . 25043 1 383 . 1 1 37 37 LYS CE C 13 39.728 0.400 . 1 . . . A 408 LYS CE . 25043 1 384 . 1 1 37 37 LYS N N 15 114.519 0.400 . 1 . . . A 408 LYS N . 25043 1 385 . 1 1 38 38 VAL H H 1 8.519 0.020 . 1 . . . A 409 VAL H . 25043 1 386 . 1 1 38 38 VAL HA H 1 4.654 0.020 . 1 . . . A 409 VAL HA . 25043 1 387 . 1 1 38 38 VAL HB H 1 1.950 0.020 . 1 . . . A 409 VAL HB . 25043 1 388 . 1 1 38 38 VAL HG11 H 1 1.040 0.020 . 2 . . . A 409 VAL HG11 . 25043 1 389 . 1 1 38 38 VAL HG12 H 1 1.040 0.020 . 2 . . . A 409 VAL HG12 . 25043 1 390 . 1 1 38 38 VAL HG13 H 1 1.040 0.020 . 2 . . . A 409 VAL HG13 . 25043 1 391 . 1 1 38 38 VAL HG21 H 1 0.922 0.020 . 2 . . . A 409 VAL HG21 . 25043 1 392 . 1 1 38 38 VAL HG22 H 1 0.922 0.020 . 2 . . . A 409 VAL HG22 . 25043 1 393 . 1 1 38 38 VAL HG23 H 1 0.922 0.020 . 2 . . . A 409 VAL HG23 . 25043 1 394 . 1 1 38 38 VAL CA C 13 58.692 0.400 . 1 . . . A 409 VAL CA . 25043 1 395 . 1 1 38 38 VAL CB C 13 33.401 0.400 . 1 . . . A 409 VAL CB . 25043 1 396 . 1 1 38 38 VAL CG1 C 13 19.364 0.400 . 1 . . . A 409 VAL CG1 . 25043 1 397 . 1 1 38 38 VAL CG2 C 13 19.489 0.400 . 1 . . . A 409 VAL CG2 . 25043 1 398 . 1 1 38 38 VAL N N 15 120.407 0.400 . 1 . . . A 409 VAL N . 25043 1 399 . 1 1 39 39 LYS H H 1 9.107 0.020 . 1 . . . A 410 LYS H . 25043 1 400 . 1 1 39 39 LYS HA H 1 5.564 0.020 . 1 . . . A 410 LYS HA . 25043 1 401 . 1 1 39 39 LYS HB2 H 1 1.880 0.020 . 2 . . . A 410 LYS HB2 . 25043 1 402 . 1 1 39 39 LYS HB3 H 1 1.880 0.020 . 2 . . . A 410 LYS HB3 . 25043 1 403 . 1 1 39 39 LYS HG2 H 1 1.721 0.020 . 2 . . . A 410 LYS HG2 . 25043 1 404 . 1 1 39 39 LYS HG3 H 1 1.721 0.020 . 2 . . . A 410 LYS HG3 . 25043 1 405 . 1 1 39 39 LYS HD2 H 1 3.327 0.020 . 2 . . . A 410 LYS HD2 . 25043 1 406 . 1 1 39 39 LYS HD3 H 1 3.327 0.020 . 2 . . . A 410 LYS HD3 . 25043 1 407 . 1 1 39 39 LYS HE2 H 1 3.418 0.020 . 2 . . . A 410 LYS HE2 . 25043 1 408 . 1 1 39 39 LYS HE3 H 1 3.418 0.020 . 2 . . . A 410 LYS HE3 . 25043 1 409 . 1 1 39 39 LYS CA C 13 53.016 0.400 . 1 . . . A 410 LYS CA . 25043 1 410 . 1 1 39 39 LYS CB C 13 35.740 0.400 . 1 . . . A 410 LYS CB . 25043 1 411 . 1 1 39 39 LYS CG C 13 24.045 0.400 . 1 . . . A 410 LYS CG . 25043 1 412 . 1 1 39 39 LYS CD C 13 28.288 0.400 . 1 . . . A 410 LYS CD . 25043 1 413 . 1 1 39 39 LYS CE C 13 40.469 0.400 . 1 . . . A 410 LYS CE . 25043 1 414 . 1 1 39 39 LYS N N 15 126.164 0.400 . 1 . . . A 410 LYS N . 25043 1 415 . 1 1 40 40 PHE H H 1 9.533 0.020 . 1 . . . A 411 PHE H . 25043 1 416 . 1 1 40 40 PHE HA H 1 4.594 0.020 . 1 . . . A 411 PHE HA . 25043 1 417 . 1 1 40 40 PHE HB2 H 1 3.549 0.020 . 1 . . . A 411 PHE HB2 . 25043 1 418 . 1 1 40 40 PHE HB3 H 1 2.963 0.020 . 1 . . . A 411 PHE HB3 . 25043 1 419 . 1 1 40 40 PHE HD1 H 1 7.519 0.020 . 1 . . . A 411 PHE HD1 . 25043 1 420 . 1 1 40 40 PHE HD2 H 1 7.519 0.020 . 1 . . . A 411 PHE HD2 . 25043 1 421 . 1 1 40 40 PHE HE1 H 1 6.909 0.020 . 1 . . . A 411 PHE HE1 . 25043 1 422 . 1 1 40 40 PHE HE2 H 1 6.909 0.020 . 1 . . . A 411 PHE HE2 . 25043 1 423 . 1 1 40 40 PHE HZ H 1 6.582 0.020 . 1 . . . A 411 PHE HZ . 25043 1 424 . 1 1 40 40 PHE CA C 13 56.796 0.400 . 1 . . . A 411 PHE CA . 25043 1 425 . 1 1 40 40 PHE CB C 13 37.108 0.400 . 1 . . . A 411 PHE CB . 25043 1 426 . 1 1 40 40 PHE CD1 C 13 129.816 0.400 . 1 . . . A 411 PHE CD1 . 25043 1 427 . 1 1 40 40 PHE CE1 C 13 127.712 0.400 . 1 . . . A 411 PHE CE1 . 25043 1 428 . 1 1 40 40 PHE CZ C 13 125.207 0.400 . 1 . . . A 411 PHE CZ . 25043 1 429 . 1 1 40 40 PHE N N 15 128.188 0.400 . 1 . . . A 411 PHE N . 25043 1 430 . 1 1 41 41 MET H H 1 8.070 0.020 . 1 . . . A 412 MET H . 25043 1 431 . 1 1 41 41 MET HA H 1 4.913 0.020 . 1 . . . A 412 MET HA . 25043 1 432 . 1 1 41 41 MET HB2 H 1 2.272 0.020 . 2 . . . A 412 MET HB2 . 25043 1 433 . 1 1 41 41 MET HB3 H 1 2.226 0.020 . 2 . . . A 412 MET HB3 . 25043 1 434 . 1 1 41 41 MET HG2 H 1 2.447 0.020 . 2 . . . A 412 MET HG2 . 25043 1 435 . 1 1 41 41 MET HG3 H 1 2.389 0.020 . 2 . . . A 412 MET HG3 . 25043 1 436 . 1 1 41 41 MET HE1 H 1 1.818 0.020 . 1 . . . A 412 MET HE1 . 25043 1 437 . 1 1 41 41 MET HE2 H 1 1.818 0.020 . 1 . . . A 412 MET HE2 . 25043 1 438 . 1 1 41 41 MET HE3 H 1 1.818 0.020 . 1 . . . A 412 MET HE3 . 25043 1 439 . 1 1 41 41 MET CA C 13 52.260 0.400 . 1 . . . A 412 MET CA . 25043 1 440 . 1 1 41 41 MET CB C 13 31.262 0.400 . 1 . . . A 412 MET CB . 25043 1 441 . 1 1 41 41 MET CG C 13 28.986 0.400 . 1 . . . A 412 MET CG . 25043 1 442 . 1 1 41 41 MET CE C 13 14.642 0.400 . 1 . . . A 412 MET CE . 25043 1 443 . 1 1 41 41 MET N N 15 118.660 0.400 . 1 . . . A 412 MET N . 25043 1 444 . 1 1 42 42 LYS H H 1 9.571 0.020 . 1 . . . A 413 LYS H . 25043 1 445 . 1 1 42 42 LYS HA H 1 3.675 0.020 . 1 . . . A 413 LYS HA . 25043 1 446 . 1 1 42 42 LYS HB2 H 1 1.346 0.020 . 2 . . . A 413 LYS HB2 . 25043 1 447 . 1 1 42 42 LYS HB3 H 1 1.239 0.020 . 2 . . . A 413 LYS HB3 . 25043 1 448 . 1 1 42 42 LYS HG2 H 1 0.680 0.020 . 2 . . . A 413 LYS HG2 . 25043 1 449 . 1 1 42 42 LYS HG3 H 1 0.680 0.020 . 2 . . . A 413 LYS HG3 . 25043 1 450 . 1 1 42 42 LYS HD2 H 1 1.210 0.020 . 2 . . . A 413 LYS HD2 . 25043 1 451 . 1 1 42 42 LYS HD3 H 1 1.168 0.020 . 2 . . . A 413 LYS HD3 . 25043 1 452 . 1 1 42 42 LYS HE2 H 1 2.626 0.020 . 2 . . . A 413 LYS HE2 . 25043 1 453 . 1 1 42 42 LYS HE3 H 1 2.557 0.020 . 2 . . . A 413 LYS HE3 . 25043 1 454 . 1 1 42 42 LYS CA C 13 56.460 0.400 . 1 . . . A 413 LYS CA . 25043 1 455 . 1 1 42 42 LYS CB C 13 30.751 0.400 . 1 . . . A 413 LYS CB . 25043 1 456 . 1 1 42 42 LYS CG C 13 21.976 0.400 . 1 . . . A 413 LYS CG . 25043 1 457 . 1 1 42 42 LYS CD C 13 26.493 0.400 . 1 . . . A 413 LYS CD . 25043 1 458 . 1 1 42 42 LYS CE C 13 39.213 0.400 . 1 . . . A 413 LYS CE . 25043 1 459 . 1 1 42 42 LYS N N 15 131.562 0.400 . 1 . . . A 413 LYS N . 25043 1 460 . 1 1 43 43 SER H H 1 9.158 0.020 . 1 . . . A 414 SER H . 25043 1 461 . 1 1 43 43 SER HA H 1 4.195 0.020 . 1 . . . A 414 SER HA . 25043 1 462 . 1 1 43 43 SER HB2 H 1 3.654 0.020 . 2 . . . A 414 SER HB2 . 25043 1 463 . 1 1 43 43 SER HB3 H 1 3.654 0.020 . 2 . . . A 414 SER HB3 . 25043 1 464 . 1 1 43 43 SER CA C 13 56.637 0.400 . 1 . . . A 414 SER CA . 25043 1 465 . 1 1 43 43 SER CB C 13 61.828 0.400 . 1 . . . A 414 SER CB . 25043 1 466 . 1 1 43 43 SER N N 15 109.714 0.400 . 1 . . . A 414 SER N . 25043 1 467 . 1 1 44 44 LYS H H 1 6.991 0.020 . 1 . . . A 415 LYS H . 25043 1 468 . 1 1 44 44 LYS HA H 1 4.857 0.020 . 1 . . . A 415 LYS HA . 25043 1 469 . 1 1 44 44 LYS HB2 H 1 1.891 0.020 . 2 . . . A 415 LYS HB2 . 25043 1 470 . 1 1 44 44 LYS HB3 H 1 1.638 0.020 . 2 . . . A 415 LYS HB3 . 25043 1 471 . 1 1 44 44 LYS HG2 H 1 1.466 0.020 . 2 . . . A 415 LYS HG2 . 25043 1 472 . 1 1 44 44 LYS HG3 H 1 1.442 0.020 . 2 . . . A 415 LYS HG3 . 25043 1 473 . 1 1 44 44 LYS HD2 H 1 1.864 0.020 . 2 . . . A 415 LYS HD2 . 25043 1 474 . 1 1 44 44 LYS HD3 H 1 1.797 0.020 . 2 . . . A 415 LYS HD3 . 25043 1 475 . 1 1 44 44 LYS HE2 H 1 2.906 0.020 . 2 . . . A 415 LYS HE2 . 25043 1 476 . 1 1 44 44 LYS HE3 H 1 2.844 0.020 . 2 . . . A 415 LYS HE3 . 25043 1 477 . 1 1 44 44 LYS CA C 13 49.834 0.400 . 1 . . . A 415 LYS CA . 25043 1 478 . 1 1 44 44 LYS CB C 13 30.447 0.400 . 1 . . . A 415 LYS CB . 25043 1 479 . 1 1 44 44 LYS CG C 13 21.151 0.400 . 1 . . . A 415 LYS CG . 25043 1 480 . 1 1 44 44 LYS CD C 13 25.813 0.400 . 1 . . . A 415 LYS CD . 25043 1 481 . 1 1 44 44 LYS CE C 13 39.321 0.400 . 1 . . . A 415 LYS CE . 25043 1 482 . 1 1 44 44 LYS N N 15 122.152 0.400 . 1 . . . A 415 LYS N . 25043 1 483 . 1 1 45 45 PRO HA H 1 4.552 0.020 . 1 . . . A 416 PRO HA . 25043 1 484 . 1 1 45 45 PRO HB2 H 1 2.450 0.020 . 1 . . . A 416 PRO HB2 . 25043 1 485 . 1 1 45 45 PRO HB3 H 1 2.027 0.020 . 1 . . . A 416 PRO HB3 . 25043 1 486 . 1 1 45 45 PRO HG2 H 1 2.226 0.020 . 1 . . . A 416 PRO HG2 . 25043 1 487 . 1 1 45 45 PRO HG3 H 1 2.131 0.020 . 1 . . . A 416 PRO HG3 . 25043 1 488 . 1 1 45 45 PRO HD2 H 1 3.741 0.020 . 1 . . . A 416 PRO HD2 . 25043 1 489 . 1 1 45 45 PRO HD3 H 1 3.553 0.020 . 1 . . . A 416 PRO HD3 . 25043 1 490 . 1 1 45 45 PRO CA C 13 61.045 0.400 . 1 . . . A 416 PRO CA . 25043 1 491 . 1 1 45 45 PRO CB C 13 28.994 0.400 . 1 . . . A 416 PRO CB . 25043 1 492 . 1 1 45 45 PRO CG C 13 24.963 0.400 . 1 . . . A 416 PRO CG . 25043 1 493 . 1 1 45 45 PRO CD C 13 47.289 0.400 . 1 . . . A 416 PRO CD . 25043 1 494 . 1 1 46 46 GLY H H 1 9.037 0.020 . 1 . . . A 417 GLY H . 25043 1 495 . 1 1 46 46 GLY HA2 H 1 3.940 0.020 . 2 . . . A 417 GLY HA2 . 25043 1 496 . 1 1 46 46 GLY HA3 H 1 4.573 0.020 . 2 . . . A 417 GLY HA3 . 25043 1 497 . 1 1 46 46 GLY CA C 13 43.180 0.400 . 1 . . . A 417 GLY CA . 25043 1 498 . 1 1 46 46 GLY N N 15 112.962 0.400 . 1 . . . A 417 GLY N . 25043 1 499 . 1 1 47 47 ALA H H 1 8.273 0.020 . 1 . . . A 418 ALA H . 25043 1 500 . 1 1 47 47 ALA HA H 1 5.846 0.020 . 1 . . . A 418 ALA HA . 25043 1 501 . 1 1 47 47 ALA HB1 H 1 1.326 0.020 . 1 . . . A 418 ALA HB1 . 25043 1 502 . 1 1 47 47 ALA HB2 H 1 1.326 0.020 . 1 . . . A 418 ALA HB2 . 25043 1 503 . 1 1 47 47 ALA HB3 H 1 1.326 0.020 . 1 . . . A 418 ALA HB3 . 25043 1 504 . 1 1 47 47 ALA CA C 13 46.753 0.400 . 1 . . . A 418 ALA CA . 25043 1 505 . 1 1 47 47 ALA CB C 13 20.850 0.400 . 1 . . . A 418 ALA CB . 25043 1 506 . 1 1 47 47 ALA N N 15 120.488 0.400 . 1 . . . A 418 ALA N . 25043 1 507 . 1 1 48 48 ALA H H 1 8.752 0.020 . 1 . . . A 419 ALA H . 25043 1 508 . 1 1 48 48 ALA HA H 1 4.559 0.020 . 1 . . . A 419 ALA HA . 25043 1 509 . 1 1 48 48 ALA HB1 H 1 0.126 0.020 . 1 . . . A 419 ALA HB1 . 25043 1 510 . 1 1 48 48 ALA HB2 H 1 0.126 0.020 . 1 . . . A 419 ALA HB2 . 25043 1 511 . 1 1 48 48 ALA HB3 H 1 0.126 0.020 . 1 . . . A 419 ALA HB3 . 25043 1 512 . 1 1 48 48 ALA CA C 13 47.686 0.400 . 1 . . . A 419 ALA CA . 25043 1 513 . 1 1 48 48 ALA CB C 13 18.110 0.400 . 1 . . . A 419 ALA CB . 25043 1 514 . 1 1 48 48 ALA N N 15 120.509 0.400 . 1 . . . A 419 ALA N . 25043 1 515 . 1 1 49 49 MET H H 1 8.503 0.020 . 1 . . . A 420 MET H . 25043 1 516 . 1 1 49 49 MET HA H 1 5.042 0.020 . 1 . . . A 420 MET HA . 25043 1 517 . 1 1 49 49 MET HB2 H 1 1.516 0.020 . 2 . . . A 420 MET HB2 . 25043 1 518 . 1 1 49 49 MET HB3 H 1 1.516 0.020 . 2 . . . A 420 MET HB3 . 25043 1 519 . 1 1 49 49 MET HG2 H 1 2.314 0.020 . 2 . . . A 420 MET HG2 . 25043 1 520 . 1 1 49 49 MET HG3 H 1 2.236 0.020 . 2 . . . A 420 MET HG3 . 25043 1 521 . 1 1 49 49 MET HE1 H 1 1.353 0.020 . 1 . . . A 420 MET HE1 . 25043 1 522 . 1 1 49 49 MET HE2 H 1 1.353 0.020 . 1 . . . A 420 MET HE2 . 25043 1 523 . 1 1 49 49 MET HE3 H 1 1.353 0.020 . 1 . . . A 420 MET HE3 . 25043 1 524 . 1 1 49 49 MET CA C 13 51.397 0.400 . 1 . . . A 420 MET CA . 25043 1 525 . 1 1 49 49 MET CB C 13 33.322 0.400 . 1 . . . A 420 MET CB . 25043 1 526 . 1 1 49 49 MET CG C 13 30.410 0.400 . 1 . . . A 420 MET CG . 25043 1 527 . 1 1 49 49 MET CE C 13 14.230 0.400 . 1 . . . A 420 MET CE . 25043 1 528 . 1 1 49 49 MET N N 15 117.529 0.400 . 1 . . . A 420 MET N . 25043 1 529 . 1 1 50 50 VAL H H 1 8.668 0.020 . 1 . . . A 421 VAL H . 25043 1 530 . 1 1 50 50 VAL HA H 1 4.455 0.020 . 1 . . . A 421 VAL HA . 25043 1 531 . 1 1 50 50 VAL HB H 1 1.439 0.020 . 1 . . . A 421 VAL HB . 25043 1 532 . 1 1 50 50 VAL HG11 H 1 0.489 0.020 . 2 . . . A 421 VAL HG11 . 25043 1 533 . 1 1 50 50 VAL HG12 H 1 0.489 0.020 . 2 . . . A 421 VAL HG12 . 25043 1 534 . 1 1 50 50 VAL HG13 H 1 0.489 0.020 . 2 . . . A 421 VAL HG13 . 25043 1 535 . 1 1 50 50 VAL HG21 H 1 0.076 0.020 . 2 . . . A 421 VAL HG21 . 25043 1 536 . 1 1 50 50 VAL HG22 H 1 0.076 0.020 . 2 . . . A 421 VAL HG22 . 25043 1 537 . 1 1 50 50 VAL HG23 H 1 0.076 0.020 . 2 . . . A 421 VAL HG23 . 25043 1 538 . 1 1 50 50 VAL CA C 13 57.930 0.400 . 1 . . . A 421 VAL CA . 25043 1 539 . 1 1 50 50 VAL CB C 13 31.678 0.400 . 1 . . . A 421 VAL CB . 25043 1 540 . 1 1 50 50 VAL CG1 C 13 18.571 0.400 . 1 . . . A 421 VAL CG1 . 25043 1 541 . 1 1 50 50 VAL CG2 C 13 18.112 0.400 . 1 . . . A 421 VAL CG2 . 25043 1 542 . 1 1 50 50 VAL N N 15 121.580 0.400 . 1 . . . A 421 VAL N . 25043 1 543 . 1 1 51 51 GLU H H 1 9.126 0.020 . 1 . . . A 422 GLU H . 25043 1 544 . 1 1 51 51 GLU N N 15 128.962 0.400 . 1 . . . A 422 GLU N . 25043 1 545 . 1 1 52 52 MET H H 1 9.363 0.020 . 1 . . . A 423 MET H . 25043 1 546 . 1 1 52 52 MET HA H 1 5.401 0.020 . 1 . . . A 423 MET HA . 25043 1 547 . 1 1 52 52 MET HB2 H 1 2.277 0.020 . 2 . . . A 423 MET HB2 . 25043 1 548 . 1 1 52 52 MET HB3 H 1 2.238 0.020 . 2 . . . A 423 MET HB3 . 25043 1 549 . 1 1 52 52 MET HE1 H 1 1.752 0.020 . 1 . . . A 423 MET HE1 . 25043 1 550 . 1 1 52 52 MET HE2 H 1 1.752 0.020 . 1 . . . A 423 MET HE2 . 25043 1 551 . 1 1 52 52 MET HE3 H 1 1.752 0.020 . 1 . . . A 423 MET HE3 . 25043 1 552 . 1 1 52 52 MET CA C 13 49.920 0.400 . 1 . . . A 423 MET CA . 25043 1 553 . 1 1 52 52 MET CB C 13 30.447 0.400 . 1 . . . A 423 MET CB . 25043 1 554 . 1 1 52 52 MET CE C 13 13.738 0.400 . 1 . . . A 423 MET CE . 25043 1 555 . 1 1 52 52 MET N N 15 125.991 0.400 . 1 . . . A 423 MET N . 25043 1 556 . 1 1 53 53 ALA H H 1 8.099 0.020 . 1 . . . A 424 ALA H . 25043 1 557 . 1 1 53 53 ALA HA H 1 4.095 0.020 . 1 . . . A 424 ALA HA . 25043 1 558 . 1 1 53 53 ALA HB1 H 1 1.567 0.020 . 1 . . . A 424 ALA HB1 . 25043 1 559 . 1 1 53 53 ALA HB2 H 1 1.567 0.020 . 1 . . . A 424 ALA HB2 . 25043 1 560 . 1 1 53 53 ALA HB3 H 1 1.567 0.020 . 1 . . . A 424 ALA HB3 . 25043 1 561 . 1 1 53 53 ALA CA C 13 52.432 0.400 . 1 . . . A 424 ALA CA . 25043 1 562 . 1 1 53 53 ALA CB C 13 17.684 0.400 . 1 . . . A 424 ALA CB . 25043 1 563 . 1 1 53 53 ALA N N 15 118.267 0.400 . 1 . . . A 424 ALA N . 25043 1 564 . 1 1 54 54 ASP H H 1 7.276 0.020 . 1 . . . A 425 ASP H . 25043 1 565 . 1 1 54 54 ASP HA H 1 4.640 0.020 . 1 . . . A 425 ASP HA . 25043 1 566 . 1 1 54 54 ASP HB2 H 1 3.234 0.020 . 2 . . . A 425 ASP HB2 . 25043 1 567 . 1 1 54 54 ASP HB3 H 1 3.234 0.020 . 2 . . . A 425 ASP HB3 . 25043 1 568 . 1 1 54 54 ASP CA C 13 50.037 0.400 . 1 . . . A 425 ASP CA . 25043 1 569 . 1 1 54 54 ASP CB C 13 40.153 0.400 . 1 . . . A 425 ASP CB . 25043 1 570 . 1 1 54 54 ASP N N 15 106.098 0.400 . 1 . . . A 425 ASP N . 25043 1 571 . 1 1 55 55 GLY H H 1 8.920 0.020 . 1 . . . A 426 GLY H . 25043 1 572 . 1 1 55 55 GLY HA2 H 1 3.898 0.020 . 2 . . . A 426 GLY HA2 . 25043 1 573 . 1 1 55 55 GLY HA3 H 1 3.599 0.020 . 2 . . . A 426 GLY HA3 . 25043 1 574 . 1 1 55 55 GLY CA C 13 43.435 0.400 . 1 . . . A 426 GLY CA . 25043 1 575 . 1 1 55 55 GLY N N 15 103.937 0.400 . 1 . . . A 426 GLY N . 25043 1 576 . 1 1 56 56 TYR H H 1 7.847 0.020 . 1 . . . A 427 TYR H . 25043 1 577 . 1 1 56 56 TYR HA H 1 4.502 0.020 . 1 . . . A 427 TYR HA . 25043 1 578 . 1 1 56 56 TYR HB2 H 1 3.214 0.020 . 1 . . . A 427 TYR HB2 . 25043 1 579 . 1 1 56 56 TYR HB3 H 1 3.248 0.020 . 1 . . . A 427 TYR HB3 . 25043 1 580 . 1 1 56 56 TYR HD1 H 1 7.280 0.020 . 1 . . . A 427 TYR HD1 . 25043 1 581 . 1 1 56 56 TYR HD2 H 1 7.280 0.020 . 1 . . . A 427 TYR HD2 . 25043 1 582 . 1 1 56 56 TYR HE1 H 1 6.810 0.020 . 1 . . . A 427 TYR HE1 . 25043 1 583 . 1 1 56 56 TYR HE2 H 1 6.810 0.020 . 1 . . . A 427 TYR HE2 . 25043 1 584 . 1 1 56 56 TYR CA C 13 58.587 0.400 . 1 . . . A 427 TYR CA . 25043 1 585 . 1 1 56 56 TYR CB C 13 34.165 0.400 . 1 . . . A 427 TYR CB . 25043 1 586 . 1 1 56 56 TYR CD2 C 13 130.627 0.400 . 1 . . . A 427 TYR CD2 . 25043 1 587 . 1 1 56 56 TYR CE2 C 13 115.966 0.400 . 1 . . . A 427 TYR CE2 . 25043 1 588 . 1 1 56 56 TYR N N 15 121.746 0.400 . 1 . . . A 427 TYR N . 25043 1 589 . 1 1 57 57 ALA H H 1 8.244 0.020 . 1 . . . A 428 ALA H . 25043 1 590 . 1 1 57 57 ALA HA H 1 4.106 0.020 . 1 . . . A 428 ALA HA . 25043 1 591 . 1 1 57 57 ALA HB1 H 1 1.563 0.020 . 1 . . . A 428 ALA HB1 . 25043 1 592 . 1 1 57 57 ALA HB2 H 1 1.563 0.020 . 1 . . . A 428 ALA HB2 . 25043 1 593 . 1 1 57 57 ALA HB3 H 1 1.563 0.020 . 1 . . . A 428 ALA HB3 . 25043 1 594 . 1 1 57 57 ALA CA C 13 52.173 0.400 . 1 . . . A 428 ALA CA . 25043 1 595 . 1 1 57 57 ALA CB C 13 17.023 0.400 . 1 . . . A 428 ALA CB . 25043 1 596 . 1 1 57 57 ALA N N 15 122.252 0.400 . 1 . . . A 428 ALA N . 25043 1 597 . 1 1 58 58 VAL H H 1 6.941 0.020 . 1 . . . A 429 VAL H . 25043 1 598 . 1 1 58 58 VAL HA H 1 3.500 0.020 . 1 . . . A 429 VAL HA . 25043 1 599 . 1 1 58 58 VAL HB H 1 2.325 0.020 . 1 . . . A 429 VAL HB . 25043 1 600 . 1 1 58 58 VAL HG11 H 1 1.050 0.020 . 2 . . . A 429 VAL HG11 . 25043 1 601 . 1 1 58 58 VAL HG12 H 1 1.050 0.020 . 2 . . . A 429 VAL HG12 . 25043 1 602 . 1 1 58 58 VAL HG13 H 1 1.050 0.020 . 2 . . . A 429 VAL HG13 . 25043 1 603 . 1 1 58 58 VAL HG21 H 1 0.963 0.020 . 2 . . . A 429 VAL HG21 . 25043 1 604 . 1 1 58 58 VAL HG22 H 1 0.963 0.020 . 2 . . . A 429 VAL HG22 . 25043 1 605 . 1 1 58 58 VAL HG23 H 1 0.963 0.020 . 2 . . . A 429 VAL HG23 . 25043 1 606 . 1 1 58 58 VAL CA C 13 64.253 0.400 . 1 . . . A 429 VAL CA . 25043 1 607 . 1 1 58 58 VAL CG1 C 13 20.704 0.400 . 1 . . . A 429 VAL CG1 . 25043 1 608 . 1 1 58 58 VAL CG2 C 13 19.776 0.400 . 1 . . . A 429 VAL CG2 . 25043 1 609 . 1 1 58 58 VAL N N 15 117.284 0.400 . 1 . . . A 429 VAL N . 25043 1 610 . 1 1 59 59 ASP H H 1 8.007 0.020 . 1 . . . A 430 ASP H . 25043 1 611 . 1 1 59 59 ASP HA H 1 4.359 0.020 . 1 . . . A 430 ASP HA . 25043 1 612 . 1 1 59 59 ASP HB2 H 1 3.047 0.020 . 1 . . . A 430 ASP HB2 . 25043 1 613 . 1 1 59 59 ASP HB3 H 1 2.831 0.020 . 1 . . . A 430 ASP HB3 . 25043 1 614 . 1 1 59 59 ASP CA C 13 55.047 0.400 . 1 . . . A 430 ASP CA . 25043 1 615 . 1 1 59 59 ASP CB C 13 38.023 0.400 . 1 . . . A 430 ASP CB . 25043 1 616 . 1 1 59 59 ASP N N 15 118.656 0.400 . 1 . . . A 430 ASP N . 25043 1 617 . 1 1 60 60 ARG H H 1 8.163 0.020 . 1 . . . A 431 ARG H . 25043 1 618 . 1 1 60 60 ARG HA H 1 4.236 0.020 . 1 . . . A 431 ARG HA . 25043 1 619 . 1 1 60 60 ARG HB2 H 1 2.021 0.020 . 2 . . . A 431 ARG HB2 . 25043 1 620 . 1 1 60 60 ARG HB3 H 1 1.910 0.020 . 2 . . . A 431 ARG HB3 . 25043 1 621 . 1 1 60 60 ARG HG2 H 1 2.402 0.020 . 2 . . . A 431 ARG HG2 . 25043 1 622 . 1 1 60 60 ARG HG3 H 1 2.370 0.020 . 2 . . . A 431 ARG HG3 . 25043 1 623 . 1 1 60 60 ARG HD2 H 1 3.797 0.020 . 2 . . . A 431 ARG HD2 . 25043 1 624 . 1 1 60 60 ARG HD3 H 1 3.413 0.020 . 2 . . . A 431 ARG HD3 . 25043 1 625 . 1 1 60 60 ARG HE H 1 7.655 0.020 . 1 . . . A 431 ARG HE . 25043 1 626 . 1 1 60 60 ARG CA C 13 57.918 0.400 . 1 . . . A 431 ARG CA . 25043 1 627 . 1 1 60 60 ARG CB C 13 29.954 0.400 . 1 . . . A 431 ARG CB . 25043 1 628 . 1 1 60 60 ARG CG C 13 26.860 0.400 . 1 . . . A 431 ARG CG . 25043 1 629 . 1 1 60 60 ARG CD C 13 41.779 0.400 . 1 . . . A 431 ARG CD . 25043 1 630 . 1 1 60 60 ARG N N 15 118.805 0.400 . 1 . . . A 431 ARG N . 25043 1 631 . 1 1 60 60 ARG NE N 15 114.643 0.400 . 1 . . . A 431 ARG NE . 25043 1 632 . 1 1 61 61 ALA H H 1 8.299 0.020 . 1 . . . A 432 ALA H . 25043 1 633 . 1 1 61 61 ALA HA H 1 3.247 0.020 . 1 . . . A 432 ALA HA . 25043 1 634 . 1 1 61 61 ALA HB1 H 1 1.448 0.020 . 1 . . . A 432 ALA HB1 . 25043 1 635 . 1 1 61 61 ALA HB2 H 1 1.448 0.020 . 1 . . . A 432 ALA HB2 . 25043 1 636 . 1 1 61 61 ALA HB3 H 1 1.448 0.020 . 1 . . . A 432 ALA HB3 . 25043 1 637 . 1 1 61 61 ALA CA C 13 52.592 0.400 . 1 . . . A 432 ALA CA . 25043 1 638 . 1 1 61 61 ALA CB C 13 15.406 0.400 . 1 . . . A 432 ALA CB . 25043 1 639 . 1 1 61 61 ALA N N 15 121.937 0.400 . 1 . . . A 432 ALA N . 25043 1 640 . 1 1 62 62 ILE H H 1 8.634 0.020 . 1 . . . A 433 ILE H . 25043 1 641 . 1 1 62 62 ILE HA H 1 3.338 0.020 . 1 . . . A 433 ILE HA . 25043 1 642 . 1 1 62 62 ILE HB H 1 1.842 0.020 . 1 . . . A 433 ILE HB . 25043 1 643 . 1 1 62 62 ILE HG12 H 1 0.730 0.020 . 1 . . . A 433 ILE HG12 . 25043 1 644 . 1 1 62 62 ILE HG13 H 1 0.727 0.020 . 1 . . . A 433 ILE HG13 . 25043 1 645 . 1 1 62 62 ILE HG21 H 1 0.910 0.020 . 1 . . . A 433 ILE HG21 . 25043 1 646 . 1 1 62 62 ILE HG22 H 1 0.910 0.020 . 1 . . . A 433 ILE HG22 . 25043 1 647 . 1 1 62 62 ILE HG23 H 1 0.910 0.020 . 1 . . . A 433 ILE HG23 . 25043 1 648 . 1 1 62 62 ILE HD11 H 1 0.831 0.020 . 1 . . . A 433 ILE HD11 . 25043 1 649 . 1 1 62 62 ILE HD12 H 1 0.831 0.020 . 1 . . . A 433 ILE HD12 . 25043 1 650 . 1 1 62 62 ILE HD13 H 1 0.831 0.020 . 1 . . . A 433 ILE HD13 . 25043 1 651 . 1 1 62 62 ILE CA C 13 63.663 0.400 . 1 . . . A 433 ILE CA . 25043 1 652 . 1 1 62 62 ILE CB C 13 35.757 0.400 . 1 . . . A 433 ILE CB . 25043 1 653 . 1 1 62 62 ILE CG1 C 13 27.037 0.400 . 1 . . . A 433 ILE CG1 . 25043 1 654 . 1 1 62 62 ILE CG2 C 13 14.256 0.400 . 1 . . . A 433 ILE CG2 . 25043 1 655 . 1 1 62 62 ILE CD1 C 13 13.150 0.400 . 1 . . . A 433 ILE CD1 . 25043 1 656 . 1 1 62 62 ILE N N 15 117.617 0.400 . 1 . . . A 433 ILE N . 25043 1 657 . 1 1 63 63 THR H H 1 8.005 0.020 . 1 . . . A 434 THR H . 25043 1 658 . 1 1 63 63 THR HA H 1 3.721 0.020 . 1 . . . A 434 THR HA . 25043 1 659 . 1 1 63 63 THR HB H 1 3.970 0.020 . 1 . . . A 434 THR HB . 25043 1 660 . 1 1 63 63 THR HG21 H 1 0.691 0.020 . 1 . . . A 434 THR HG21 . 25043 1 661 . 1 1 63 63 THR HG22 H 1 0.691 0.020 . 1 . . . A 434 THR HG22 . 25043 1 662 . 1 1 63 63 THR HG23 H 1 0.691 0.020 . 1 . . . A 434 THR HG23 . 25043 1 663 . 1 1 63 63 THR CA C 13 63.821 0.400 . 1 . . . A 434 THR CA . 25043 1 664 . 1 1 63 63 THR CB C 13 66.549 0.400 . 1 . . . A 434 THR CB . 25043 1 665 . 1 1 63 63 THR CG2 C 13 17.701 0.400 . 1 . . . A 434 THR CG2 . 25043 1 666 . 1 1 63 63 THR N N 15 113.846 0.400 . 1 . . . A 434 THR N . 25043 1 667 . 1 1 64 64 HIS H H 1 7.354 0.020 . 1 . . . A 435 HIS H . 25043 1 668 . 1 1 64 64 HIS HA H 1 4.613 0.020 . 1 . . . A 435 HIS HA . 25043 1 669 . 1 1 64 64 HIS HB2 H 1 3.250 0.020 . 2 . . . A 435 HIS HB2 . 25043 1 670 . 1 1 64 64 HIS HB3 H 1 3.044 0.020 . 2 . . . A 435 HIS HB3 . 25043 1 671 . 1 1 64 64 HIS HD2 H 1 7.350 0.020 . 1 . . . A 435 HIS HD2 . 25043 1 672 . 1 1 64 64 HIS HE1 H 1 8.200 0.020 . 1 . . . A 435 HIS HE1 . 25043 1 673 . 1 1 64 64 HIS CA C 13 56.316 0.400 . 1 . . . A 435 HIS CA . 25043 1 674 . 1 1 64 64 HIS CB C 13 27.013 0.400 . 1 . . . A 435 HIS CB . 25043 1 675 . 1 1 64 64 HIS CD2 C 13 118.063 0.400 . 1 . . . A 435 HIS CD2 . 25043 1 676 . 1 1 64 64 HIS CE1 C 13 135.813 0.400 . 1 . . . A 435 HIS CE1 . 25043 1 677 . 1 1 64 64 HIS N N 15 115.113 0.400 . 1 . . . A 435 HIS N . 25043 1 678 . 1 1 65 65 LEU H H 1 8.122 0.020 . 1 . . . A 436 LEU H . 25043 1 679 . 1 1 65 65 LEU HA H 1 4.399 0.020 . 1 . . . A 436 LEU HA . 25043 1 680 . 1 1 65 65 LEU HB2 H 1 1.750 0.020 . 2 . . . A 436 LEU HB2 . 25043 1 681 . 1 1 65 65 LEU HB3 H 1 1.201 0.020 . 2 . . . A 436 LEU HB3 . 25043 1 682 . 1 1 65 65 LEU HG H 1 1.107 0.020 . 1 . . . A 436 LEU HG . 25043 1 683 . 1 1 65 65 LEU HD11 H 1 0.055 0.020 . 2 . . . A 436 LEU HD11 . 25043 1 684 . 1 1 65 65 LEU HD12 H 1 0.055 0.020 . 2 . . . A 436 LEU HD12 . 25043 1 685 . 1 1 65 65 LEU HD13 H 1 0.055 0.020 . 2 . . . A 436 LEU HD13 . 25043 1 686 . 1 1 65 65 LEU HD21 H 1 0.659 0.020 . 2 . . . A 436 LEU HD21 . 25043 1 687 . 1 1 65 65 LEU HD22 H 1 0.659 0.020 . 2 . . . A 436 LEU HD22 . 25043 1 688 . 1 1 65 65 LEU HD23 H 1 0.659 0.020 . 2 . . . A 436 LEU HD23 . 25043 1 689 . 1 1 65 65 LEU CA C 13 52.420 0.400 . 1 . . . A 436 LEU CA . 25043 1 690 . 1 1 65 65 LEU CB C 13 40.690 0.400 . 1 . . . A 436 LEU CB . 25043 1 691 . 1 1 65 65 LEU CG C 13 23.518 0.400 . 1 . . . A 436 LEU CG . 25043 1 692 . 1 1 65 65 LEU CD1 C 13 23.365 0.400 . 1 . . . A 436 LEU CD1 . 25043 1 693 . 1 1 65 65 LEU CD2 C 13 19.413 0.400 . 1 . . . A 436 LEU CD2 . 25043 1 694 . 1 1 65 65 LEU N N 15 114.966 0.400 . 1 . . . A 436 LEU N . 25043 1 695 . 1 1 66 66 ASN H H 1 7.419 0.020 . 1 . . . A 437 ASN H . 25043 1 696 . 1 1 66 66 ASN HA H 1 4.379 0.020 . 1 . . . A 437 ASN HA . 25043 1 697 . 1 1 66 66 ASN HB2 H 1 3.217 0.020 . 2 . . . A 437 ASN HB2 . 25043 1 698 . 1 1 66 66 ASN HB3 H 1 2.922 0.020 . 2 . . . A 437 ASN HB3 . 25043 1 699 . 1 1 66 66 ASN HD21 H 1 7.853 0.020 . 2 . . . A 437 ASN HD21 . 25043 1 700 . 1 1 66 66 ASN HD22 H 1 7.231 0.020 . 2 . . . A 437 ASN HD22 . 25043 1 701 . 1 1 66 66 ASN CA C 13 53.339 0.400 . 1 . . . A 437 ASN CA . 25043 1 702 . 1 1 66 66 ASN CB C 13 36.597 0.400 . 1 . . . A 437 ASN CB . 25043 1 703 . 1 1 66 66 ASN N N 15 115.523 0.400 . 1 . . . A 437 ASN N . 25043 1 704 . 1 1 66 66 ASN ND2 N 15 115.258 0.400 . 1 . . . A 437 ASN ND2 . 25043 1 705 . 1 1 67 67 ASN H H 1 8.565 0.020 . 1 . . . A 438 ASN H . 25043 1 706 . 1 1 67 67 ASN HA H 1 4.207 0.020 . 1 . . . A 438 ASN HA . 25043 1 707 . 1 1 67 67 ASN HB2 H 1 3.099 0.020 . 1 . . . A 438 ASN HB2 . 25043 1 708 . 1 1 67 67 ASN HB3 H 1 3.099 0.020 . 1 . . . A 438 ASN HB3 . 25043 1 709 . 1 1 67 67 ASN HD21 H 1 6.787 0.020 . 2 . . . A 438 ASN HD21 . 25043 1 710 . 1 1 67 67 ASN HD22 H 1 7.610 0.020 . 2 . . . A 438 ASN HD22 . 25043 1 711 . 1 1 67 67 ASN CA C 13 52.555 0.400 . 1 . . . A 438 ASN CA . 25043 1 712 . 1 1 67 67 ASN CB C 13 33.929 0.400 . 1 . . . A 438 ASN CB . 25043 1 713 . 1 1 67 67 ASN N N 15 117.085 0.400 . 1 . . . A 438 ASN N . 25043 1 714 . 1 1 67 67 ASN ND2 N 15 109.699 0.400 . 1 . . . A 438 ASN ND2 . 25043 1 715 . 1 1 68 68 ASN H H 1 7.349 0.020 . 1 . . . A 439 ASN H . 25043 1 716 . 1 1 68 68 ASN HA H 1 4.903 0.020 . 1 . . . A 439 ASN HA . 25043 1 717 . 1 1 68 68 ASN HB2 H 1 2.738 0.020 . 2 . . . A 439 ASN HB2 . 25043 1 718 . 1 1 68 68 ASN HB3 H 1 2.354 0.020 . 2 . . . A 439 ASN HB3 . 25043 1 719 . 1 1 68 68 ASN HD21 H 1 6.617 0.020 . 2 . . . A 439 ASN HD21 . 25043 1 720 . 1 1 68 68 ASN HD22 H 1 6.501 0.020 . 2 . . . A 439 ASN HD22 . 25043 1 721 . 1 1 68 68 ASN CA C 13 50.961 0.400 . 1 . . . A 439 ASN CA . 25043 1 722 . 1 1 68 68 ASN CB C 13 38.601 0.400 . 1 . . . A 439 ASN CB . 25043 1 723 . 1 1 68 68 ASN N N 15 115.677 0.400 . 1 . . . A 439 ASN N . 25043 1 724 . 1 1 68 68 ASN ND2 N 15 111.305 0.400 . 1 . . . A 439 ASN ND2 . 25043 1 725 . 1 1 69 69 PHE H H 1 8.515 0.020 . 1 . . . A 440 PHE H . 25043 1 726 . 1 1 69 69 PHE HA H 1 5.106 0.020 . 1 . . . A 440 PHE HA . 25043 1 727 . 1 1 69 69 PHE HB2 H 1 2.900 0.020 . 1 . . . A 440 PHE HB2 . 25043 1 728 . 1 1 69 69 PHE HB3 H 1 2.856 0.020 . 1 . . . A 440 PHE HB3 . 25043 1 729 . 1 1 69 69 PHE HD1 H 1 7.026 0.020 . 1 . . . A 440 PHE HD1 . 25043 1 730 . 1 1 69 69 PHE HD2 H 1 7.026 0.020 . 1 . . . A 440 PHE HD2 . 25043 1 731 . 1 1 69 69 PHE HE1 H 1 7.384 0.020 . 1 . . . A 440 PHE HE1 . 25043 1 732 . 1 1 69 69 PHE HE2 H 1 7.384 0.020 . 1 . . . A 440 PHE HE2 . 25043 1 733 . 1 1 69 69 PHE HZ H 1 7.373 0.020 . 1 . . . A 440 PHE HZ . 25043 1 734 . 1 1 69 69 PHE CA C 13 55.149 0.400 . 1 . . . A 440 PHE CA . 25043 1 735 . 1 1 69 69 PHE CB C 13 38.995 0.400 . 1 . . . A 440 PHE CB . 25043 1 736 . 1 1 69 69 PHE CD1 C 13 128.851 0.400 . 1 . . . A 440 PHE CD1 . 25043 1 737 . 1 1 69 69 PHE CE1 C 13 128.856 0.400 . 1 . . . A 440 PHE CE1 . 25043 1 738 . 1 1 69 69 PHE CZ C 13 127.148 0.400 . 1 . . . A 440 PHE CZ . 25043 1 739 . 1 1 69 69 PHE N N 15 119.861 0.400 . 1 . . . A 440 PHE N . 25043 1 740 . 1 1 70 70 MET H H 1 8.720 0.020 . 1 . . . A 441 MET H . 25043 1 741 . 1 1 70 70 MET HA H 1 4.324 0.020 . 1 . . . A 441 MET HA . 25043 1 742 . 1 1 70 70 MET HB2 H 1 1.936 0.020 . 1 . . . A 441 MET HB2 . 25043 1 743 . 1 1 70 70 MET HB3 H 1 2.146 0.020 . 1 . . . A 441 MET HB3 . 25043 1 744 . 1 1 70 70 MET HG2 H 1 2.357 0.020 . 2 . . . A 441 MET HG2 . 25043 1 745 . 1 1 70 70 MET HG3 H 1 2.275 0.020 . 2 . . . A 441 MET HG3 . 25043 1 746 . 1 1 70 70 MET HE1 H 1 2.181 0.020 . 1 . . . A 441 MET HE1 . 25043 1 747 . 1 1 70 70 MET HE2 H 1 2.181 0.020 . 1 . . . A 441 MET HE2 . 25043 1 748 . 1 1 70 70 MET HE3 H 1 2.181 0.020 . 1 . . . A 441 MET HE3 . 25043 1 749 . 1 1 70 70 MET CA C 13 53.811 0.400 . 1 . . . A 441 MET CA . 25043 1 750 . 1 1 70 70 MET CB C 13 33.959 0.400 . 1 . . . A 441 MET CB . 25043 1 751 . 1 1 70 70 MET CG C 13 29.850 0.400 . 1 . . . A 441 MET CG . 25043 1 752 . 1 1 70 70 MET CE C 13 14.539 0.400 . 1 . . . A 441 MET CE . 25043 1 753 . 1 1 70 70 MET N N 15 118.599 0.400 . 1 . . . A 441 MET N . 25043 1 754 . 1 1 71 71 PHE H H 1 10.402 0.020 . 1 . . . A 442 PHE H . 25043 1 755 . 1 1 71 71 PHE HA H 1 4.314 0.020 . 1 . . . A 442 PHE HA . 25043 1 756 . 1 1 71 71 PHE HB2 H 1 3.600 0.020 . 2 . . . A 442 PHE HB2 . 25043 1 757 . 1 1 71 71 PHE HB3 H 1 3.297 0.020 . 2 . . . A 442 PHE HB3 . 25043 1 758 . 1 1 71 71 PHE HD1 H 1 7.435 0.020 . 1 . . . A 442 PHE HD1 . 25043 1 759 . 1 1 71 71 PHE HD2 H 1 7.435 0.020 . 1 . . . A 442 PHE HD2 . 25043 1 760 . 1 1 71 71 PHE HE1 H 1 7.436 0.020 . 1 . . . A 442 PHE HE1 . 25043 1 761 . 1 1 71 71 PHE HE2 H 1 7.436 0.020 . 1 . . . A 442 PHE HE2 . 25043 1 762 . 1 1 71 71 PHE HZ H 1 7.078 0.020 . 1 . . . A 442 PHE HZ . 25043 1 763 . 1 1 71 71 PHE CA C 13 56.391 0.400 . 1 . . . A 442 PHE CA . 25043 1 764 . 1 1 71 71 PHE CB C 13 33.661 0.400 . 1 . . . A 442 PHE CB . 25043 1 765 . 1 1 71 71 PHE CD1 C 13 129.669 0.400 . 1 . . . A 442 PHE CD1 . 25043 1 766 . 1 1 71 71 PHE CE1 C 13 129.069 0.400 . 1 . . . A 442 PHE CE1 . 25043 1 767 . 1 1 71 71 PHE CZ C 13 127.234 0.400 . 1 . . . A 442 PHE CZ . 25043 1 768 . 1 1 71 71 PHE N N 15 126.522 0.400 . 1 . . . A 442 PHE N . 25043 1 769 . 1 1 72 72 GLY H H 1 9.035 0.020 . 1 . . . A 443 GLY H . 25043 1 770 . 1 1 72 72 GLY HA2 H 1 4.294 0.020 . 1 . . . A 443 GLY HA2 . 25043 1 771 . 1 1 72 72 GLY HA3 H 1 3.771 0.020 . 1 . . . A 443 GLY HA3 . 25043 1 772 . 1 1 72 72 GLY CA C 13 42.935 0.400 . 1 . . . A 443 GLY CA . 25043 1 773 . 1 1 72 72 GLY N N 15 104.246 0.400 . 1 . . . A 443 GLY N . 25043 1 774 . 1 1 73 73 GLN H H 1 7.968 0.020 . 1 . . . A 444 GLN H . 25043 1 775 . 1 1 73 73 GLN HA H 1 4.820 0.020 . 1 . . . A 444 GLN HA . 25043 1 776 . 1 1 73 73 GLN HB2 H 1 2.157 0.020 . 2 . . . A 444 GLN HB2 . 25043 1 777 . 1 1 73 73 GLN HB3 H 1 2.237 0.020 . 2 . . . A 444 GLN HB3 . 25043 1 778 . 1 1 73 73 GLN HG2 H 1 2.444 0.020 . 2 . . . A 444 GLN HG2 . 25043 1 779 . 1 1 73 73 GLN HG3 H 1 2.403 0.020 . 2 . . . A 444 GLN HG3 . 25043 1 780 . 1 1 73 73 GLN CA C 13 51.542 0.400 . 1 . . . A 444 GLN CA . 25043 1 781 . 1 1 73 73 GLN CB C 13 29.820 0.400 . 1 . . . A 444 GLN CB . 25043 1 782 . 1 1 73 73 GLN CG C 13 31.377 0.400 . 1 . . . A 444 GLN CG . 25043 1 783 . 1 1 73 73 GLN N N 15 119.205 0.400 . 1 . . . A 444 GLN N . 25043 1 784 . 1 1 74 74 LYS H H 1 8.365 0.020 . 1 . . . A 445 LYS H . 25043 1 785 . 1 1 74 74 LYS HA H 1 3.585 0.020 . 1 . . . A 445 LYS HA . 25043 1 786 . 1 1 74 74 LYS HB2 H 1 1.524 0.020 . 1 . . . A 445 LYS HB2 . 25043 1 787 . 1 1 74 74 LYS HB3 H 1 1.119 0.020 . 1 . . . A 445 LYS HB3 . 25043 1 788 . 1 1 74 74 LYS HG2 H 1 0.946 0.020 . 2 . . . A 445 LYS HG2 . 25043 1 789 . 1 1 74 74 LYS HG3 H 1 0.612 0.020 . 2 . . . A 445 LYS HG3 . 25043 1 790 . 1 1 74 74 LYS HD2 H 1 1.591 0.020 . 2 . . . A 445 LYS HD2 . 25043 1 791 . 1 1 74 74 LYS HD3 H 1 1.591 0.020 . 2 . . . A 445 LYS HD3 . 25043 1 792 . 1 1 74 74 LYS HE2 H 1 2.909 0.020 . 2 . . . A 445 LYS HE2 . 25043 1 793 . 1 1 74 74 LYS HE3 H 1 2.909 0.020 . 2 . . . A 445 LYS HE3 . 25043 1 794 . 1 1 74 74 LYS CA C 13 53.527 0.400 . 1 . . . A 445 LYS CA . 25043 1 795 . 1 1 74 74 LYS CB C 13 30.040 0.400 . 1 . . . A 445 LYS CB . 25043 1 796 . 1 1 74 74 LYS CG C 13 21.719 0.400 . 1 . . . A 445 LYS CG . 25043 1 797 . 1 1 74 74 LYS CD C 13 26.393 0.400 . 1 . . . A 445 LYS CD . 25043 1 798 . 1 1 74 74 LYS CE C 13 38.975 0.400 . 1 . . . A 445 LYS CE . 25043 1 799 . 1 1 74 74 LYS N N 15 124.009 0.400 . 1 . . . A 445 LYS N . 25043 1 800 . 1 1 75 75 MET H H 1 8.849 0.020 . 1 . . . A 446 MET H . 25043 1 801 . 1 1 75 75 MET HA H 1 5.185 0.020 . 1 . . . A 446 MET HA . 25043 1 802 . 1 1 75 75 MET HB2 H 1 2.063 0.020 . 2 . . . A 446 MET HB2 . 25043 1 803 . 1 1 75 75 MET HB3 H 1 2.052 0.020 . 2 . . . A 446 MET HB3 . 25043 1 804 . 1 1 75 75 MET HG2 H 1 2.543 0.020 . 2 . . . A 446 MET HG2 . 25043 1 805 . 1 1 75 75 MET HG3 H 1 2.315 0.020 . 2 . . . A 446 MET HG3 . 25043 1 806 . 1 1 75 75 MET HE1 H 1 1.939 0.020 . 1 . . . A 446 MET HE1 . 25043 1 807 . 1 1 75 75 MET HE2 H 1 1.939 0.020 . 1 . . . A 446 MET HE2 . 25043 1 808 . 1 1 75 75 MET HE3 H 1 1.939 0.020 . 1 . . . A 446 MET HE3 . 25043 1 809 . 1 1 75 75 MET CA C 13 52.446 0.400 . 1 . . . A 446 MET CA . 25043 1 810 . 1 1 75 75 MET CB C 13 32.421 0.400 . 1 . . . A 446 MET CB . 25043 1 811 . 1 1 75 75 MET CG C 13 28.795 0.400 . 1 . . . A 446 MET CG . 25043 1 812 . 1 1 75 75 MET CE C 13 13.791 0.400 . 1 . . . A 446 MET CE . 25043 1 813 . 1 1 75 75 MET N N 15 127.570 0.400 . 1 . . . A 446 MET N . 25043 1 814 . 1 1 76 76 ASN H H 1 8.514 0.020 . 1 . . . A 447 ASN H . 25043 1 815 . 1 1 76 76 ASN HA H 1 5.695 0.020 . 1 . . . A 447 ASN HA . 25043 1 816 . 1 1 76 76 ASN HB2 H 1 2.994 0.020 . 2 . . . A 447 ASN HB2 . 25043 1 817 . 1 1 76 76 ASN HB3 H 1 2.614 0.020 . 2 . . . A 447 ASN HB3 . 25043 1 818 . 1 1 76 76 ASN HD21 H 1 7.655 0.020 . 2 . . . A 447 ASN HD21 . 25043 1 819 . 1 1 76 76 ASN CA C 13 49.483 0.400 . 1 . . . A 447 ASN CA . 25043 1 820 . 1 1 76 76 ASN CB C 13 40.595 0.400 . 1 . . . A 447 ASN CB . 25043 1 821 . 1 1 76 76 ASN N N 15 122.394 0.400 . 1 . . . A 447 ASN N . 25043 1 822 . 1 1 77 77 VAL H H 1 8.659 0.020 . 1 . . . A 448 VAL H . 25043 1 823 . 1 1 77 77 VAL HA H 1 5.264 0.020 . 1 . . . A 448 VAL HA . 25043 1 824 . 1 1 77 77 VAL HB H 1 1.847 0.020 . 1 . . . A 448 VAL HB . 25043 1 825 . 1 1 77 77 VAL HG11 H 1 1.075 0.020 . 2 . . . A 448 VAL HG11 . 25043 1 826 . 1 1 77 77 VAL HG12 H 1 1.075 0.020 . 2 . . . A 448 VAL HG12 . 25043 1 827 . 1 1 77 77 VAL HG13 H 1 1.075 0.020 . 2 . . . A 448 VAL HG13 . 25043 1 828 . 1 1 77 77 VAL HG21 H 1 0.982 0.020 . 2 . . . A 448 VAL HG21 . 25043 1 829 . 1 1 77 77 VAL HG22 H 1 0.982 0.020 . 2 . . . A 448 VAL HG22 . 25043 1 830 . 1 1 77 77 VAL HG23 H 1 0.982 0.020 . 2 . . . A 448 VAL HG23 . 25043 1 831 . 1 1 77 77 VAL CA C 13 57.683 0.400 . 1 . . . A 448 VAL CA . 25043 1 832 . 1 1 77 77 VAL CB C 13 32.043 0.400 . 1 . . . A 448 VAL CB . 25043 1 833 . 1 1 77 77 VAL CG1 C 13 21.593 0.400 . 1 . . . A 448 VAL CG1 . 25043 1 834 . 1 1 77 77 VAL CG2 C 13 18.917 0.400 . 1 . . . A 448 VAL CG2 . 25043 1 835 . 1 1 77 77 VAL N N 15 122.444 0.400 . 1 . . . A 448 VAL N . 25043 1 836 . 1 1 78 78 CYS H H 1 9.123 0.020 . 1 . . . A 449 CYS H . 25043 1 837 . 1 1 78 78 CYS HA H 1 4.977 0.020 . 1 . . . A 449 CYS HA . 25043 1 838 . 1 1 78 78 CYS HB2 H 1 3.099 0.020 . 2 . . . A 449 CYS HB2 . 25043 1 839 . 1 1 78 78 CYS HB3 H 1 3.049 0.020 . 2 . . . A 449 CYS HB3 . 25043 1 840 . 1 1 78 78 CYS CA C 13 53.010 0.400 . 1 . . . A 449 CYS CA . 25043 1 841 . 1 1 78 78 CYS CB C 13 29.438 0.400 . 1 . . . A 449 CYS CB . 25043 1 842 . 1 1 78 78 CYS N N 15 121.989 0.400 . 1 . . . A 449 CYS N . 25043 1 843 . 1 1 79 79 VAL H H 1 8.499 0.020 . 1 . . . A 450 VAL H . 25043 1 844 . 1 1 79 79 VAL HA H 1 3.904 0.020 . 1 . . . A 450 VAL HA . 25043 1 845 . 1 1 79 79 VAL HB H 1 2.044 0.020 . 1 . . . A 450 VAL HB . 25043 1 846 . 1 1 79 79 VAL HG11 H 1 1.130 0.020 . 2 . . . A 450 VAL HG11 . 25043 1 847 . 1 1 79 79 VAL HG12 H 1 1.130 0.020 . 2 . . . A 450 VAL HG12 . 25043 1 848 . 1 1 79 79 VAL HG13 H 1 1.130 0.020 . 2 . . . A 450 VAL HG13 . 25043 1 849 . 1 1 79 79 VAL HG21 H 1 1.096 0.020 . 2 . . . A 450 VAL HG21 . 25043 1 850 . 1 1 79 79 VAL HG22 H 1 1.096 0.020 . 2 . . . A 450 VAL HG22 . 25043 1 851 . 1 1 79 79 VAL HG23 H 1 1.096 0.020 . 2 . . . A 450 VAL HG23 . 25043 1 852 . 1 1 79 79 VAL CA C 13 61.280 0.400 . 1 . . . A 450 VAL CA . 25043 1 853 . 1 1 79 79 VAL CB C 13 29.676 0.400 . 1 . . . A 450 VAL CB . 25043 1 854 . 1 1 79 79 VAL CG1 C 13 18.987 0.400 . 1 . . . A 450 VAL CG1 . 25043 1 855 . 1 1 79 79 VAL CG2 C 13 19.659 0.400 . 1 . . . A 450 VAL CG2 . 25043 1 856 . 1 1 79 79 VAL N N 15 121.225 0.400 . 1 . . . A 450 VAL N . 25043 1 857 . 1 1 80 80 SER H H 1 8.660 0.020 . 1 . . . A 451 SER H . 25043 1 858 . 1 1 80 80 SER HA H 1 5.083 0.020 . 1 . . . A 451 SER HA . 25043 1 859 . 1 1 80 80 SER HB2 H 1 3.576 0.020 . 1 . . . A 451 SER HB2 . 25043 1 860 . 1 1 80 80 SER HB3 H 1 3.400 0.020 . 1 . . . A 451 SER HB3 . 25043 1 861 . 1 1 80 80 SER CA C 13 53.758 0.400 . 1 . . . A 451 SER CA . 25043 1 862 . 1 1 80 80 SER CB C 13 62.033 0.400 . 1 . . . A 451 SER CB . 25043 1 863 . 1 1 80 80 SER N N 15 120.784 0.400 . 1 . . . A 451 SER N . 25043 1 864 . 1 1 81 81 LYS H H 1 9.729 0.020 . 1 . . . A 452 LYS H . 25043 1 865 . 1 1 81 81 LYS HA H 1 4.269 0.020 . 1 . . . A 452 LYS HA . 25043 1 866 . 1 1 81 81 LYS HB2 H 1 1.852 0.020 . 2 . . . A 452 LYS HB2 . 25043 1 867 . 1 1 81 81 LYS HB3 H 1 1.641 0.020 . 2 . . . A 452 LYS HB3 . 25043 1 868 . 1 1 81 81 LYS HG2 H 1 1.411 0.020 . 2 . . . A 452 LYS HG2 . 25043 1 869 . 1 1 81 81 LYS HG3 H 1 1.362 0.020 . 2 . . . A 452 LYS HG3 . 25043 1 870 . 1 1 81 81 LYS HD2 H 1 1.597 0.020 . 2 . . . A 452 LYS HD2 . 25043 1 871 . 1 1 81 81 LYS HD3 H 1 1.506 0.020 . 2 . . . A 452 LYS HD3 . 25043 1 872 . 1 1 81 81 LYS HE2 H 1 2.878 0.020 . 2 . . . A 452 LYS HE2 . 25043 1 873 . 1 1 81 81 LYS HE3 H 1 2.878 0.020 . 2 . . . A 452 LYS HE3 . 25043 1 874 . 1 1 81 81 LYS CA C 13 54.293 0.400 . 1 . . . A 452 LYS CA . 25043 1 875 . 1 1 81 81 LYS CB C 13 29.997 0.400 . 1 . . . A 452 LYS CB . 25043 1 876 . 1 1 81 81 LYS CG C 13 22.339 0.400 . 1 . . . A 452 LYS CG . 25043 1 877 . 1 1 81 81 LYS CD C 13 26.380 0.400 . 1 . . . A 452 LYS CD . 25043 1 878 . 1 1 81 81 LYS CE C 13 39.013 0.400 . 1 . . . A 452 LYS CE . 25043 1 879 . 1 1 81 81 LYS N N 15 126.768 0.400 . 1 . . . A 452 LYS N . 25043 1 880 . 1 1 82 82 GLN H H 1 8.989 0.020 . 1 . . . A 453 GLN H . 25043 1 881 . 1 1 82 82 GLN HA H 1 4.520 0.020 . 1 . . . A 453 GLN HA . 25043 1 882 . 1 1 82 82 GLN HB2 H 1 1.658 0.020 . 2 . . . A 453 GLN HB2 . 25043 1 883 . 1 1 82 82 GLN HB3 H 1 1.658 0.020 . 2 . . . A 453 GLN HB3 . 25043 1 884 . 1 1 82 82 GLN HG2 H 1 2.704 0.020 . 2 . . . A 453 GLN HG2 . 25043 1 885 . 1 1 82 82 GLN HG3 H 1 2.704 0.020 . 2 . . . A 453 GLN HG3 . 25043 1 886 . 1 1 82 82 GLN HE21 H 1 7.367 0.020 . 2 . . . A 453 GLN HE21 . 25043 1 887 . 1 1 82 82 GLN HE22 H 1 7.007 0.020 . 2 . . . A 453 GLN HE22 . 25043 1 888 . 1 1 82 82 GLN CA C 13 49.599 0.400 . 1 . . . A 453 GLN CA . 25043 1 889 . 1 1 82 82 GLN CB C 13 24.934 0.400 . 1 . . . A 453 GLN CB . 25043 1 890 . 1 1 82 82 GLN CG C 13 29.862 0.400 . 1 . . . A 453 GLN CG . 25043 1 891 . 1 1 82 82 GLN N N 15 120.466 0.400 . 1 . . . A 453 GLN N . 25043 1 892 . 1 1 82 82 GLN NE2 N 15 114.970 0.400 . 1 . . . A 453 GLN NE2 . 25043 1 893 . 1 1 83 83 PRO HA H 1 4.532 0.020 . 1 . . . A 454 PRO HA . 25043 1 894 . 1 1 83 83 PRO HB2 H 1 2.339 0.020 . 2 . . . A 454 PRO HB2 . 25043 1 895 . 1 1 83 83 PRO HB3 H 1 2.339 0.020 . 2 . . . A 454 PRO HB3 . 25043 1 896 . 1 1 83 83 PRO HG2 H 1 2.214 0.020 . 1 . . . A 454 PRO HG2 . 25043 1 897 . 1 1 83 83 PRO HG3 H 1 2.136 0.020 . 1 . . . A 454 PRO HG3 . 25043 1 898 . 1 1 83 83 PRO HD2 H 1 3.954 0.020 . 2 . . . A 454 PRO HD2 . 25043 1 899 . 1 1 83 83 PRO HD3 H 1 4.196 0.020 . 2 . . . A 454 PRO HD3 . 25043 1 900 . 1 1 83 83 PRO CB C 13 28.974 0.400 . 1 . . . A 454 PRO CB . 25043 1 901 . 1 1 83 83 PRO CG C 13 24.274 0.400 . 1 . . . A 454 PRO CG . 25043 1 902 . 1 1 83 83 PRO CD C 13 47.600 0.400 . 1 . . . A 454 PRO CD . 25043 1 903 . 1 1 84 84 ALA H H 1 7.000 0.020 . 1 . . . A 455 ALA H . 25043 1 904 . 1 1 84 84 ALA HA H 1 3.976 0.020 . 1 . . . A 455 ALA HA . 25043 1 905 . 1 1 84 84 ALA HB1 H 1 1.390 0.020 . 1 . . . A 455 ALA HB1 . 25043 1 906 . 1 1 84 84 ALA HB2 H 1 1.390 0.020 . 1 . . . A 455 ALA HB2 . 25043 1 907 . 1 1 84 84 ALA HB3 H 1 1.390 0.020 . 1 . . . A 455 ALA HB3 . 25043 1 908 . 1 1 84 84 ALA CA C 13 48.684 0.400 . 1 . . . A 455 ALA CA . 25043 1 909 . 1 1 84 84 ALA CB C 13 19.080 0.400 . 1 . . . A 455 ALA CB . 25043 1 910 . 1 1 84 84 ALA N N 15 115.701 0.400 . 1 . . . A 455 ALA N . 25043 1 911 . 1 1 85 85 ILE H H 1 8.864 0.020 . 1 . . . A 456 ILE H . 25043 1 912 . 1 1 85 85 ILE HA H 1 4.532 0.020 . 1 . . . A 456 ILE HA . 25043 1 913 . 1 1 85 85 ILE HB H 1 1.888 0.020 . 1 . . . A 456 ILE HB . 25043 1 914 . 1 1 85 85 ILE HG12 H 1 0.720 0.020 . 2 . . . A 456 ILE HG12 . 25043 1 915 . 1 1 85 85 ILE HG13 H 1 0.720 0.020 . 2 . . . A 456 ILE HG13 . 25043 1 916 . 1 1 85 85 ILE HG21 H 1 0.931 0.020 . 1 . . . A 456 ILE HG21 . 25043 1 917 . 1 1 85 85 ILE HG22 H 1 0.931 0.020 . 1 . . . A 456 ILE HG22 . 25043 1 918 . 1 1 85 85 ILE HG23 H 1 0.931 0.020 . 1 . . . A 456 ILE HG23 . 25043 1 919 . 1 1 85 85 ILE HD11 H 1 0.637 0.020 . 1 . . . A 456 ILE HD11 . 25043 1 920 . 1 1 85 85 ILE HD12 H 1 0.637 0.020 . 1 . . . A 456 ILE HD12 . 25043 1 921 . 1 1 85 85 ILE HD13 H 1 0.637 0.020 . 1 . . . A 456 ILE HD13 . 25043 1 922 . 1 1 85 85 ILE CA C 13 58.750 0.400 . 1 . . . A 456 ILE CA . 25043 1 923 . 1 1 85 85 ILE CB C 13 35.655 0.400 . 1 . . . A 456 ILE CB . 25043 1 924 . 1 1 85 85 ILE CG1 C 13 25.097 0.400 . 1 . . . A 456 ILE CG1 . 25043 1 925 . 1 1 85 85 ILE CG2 C 13 16.158 0.400 . 1 . . . A 456 ILE CG2 . 25043 1 926 . 1 1 85 85 ILE CD1 C 13 12.912 0.400 . 1 . . . A 456 ILE CD1 . 25043 1 927 . 1 1 85 85 ILE N N 15 121.194 0.400 . 1 . . . A 456 ILE N . 25043 1 928 . 1 1 86 86 MET HA H 1 5.008 0.020 . 1 . . . A 457 MET HA . 25043 1 929 . 1 1 86 86 MET HB2 H 1 1.901 0.020 . 2 . . . A 457 MET HB2 . 25043 1 930 . 1 1 86 86 MET HB3 H 1 1.901 0.020 . 2 . . . A 457 MET HB3 . 25043 1 931 . 1 1 86 86 MET HG2 H 1 2.737 0.020 . 2 . . . A 457 MET HG2 . 25043 1 932 . 1 1 86 86 MET HG3 H 1 2.602 0.020 . 2 . . . A 457 MET HG3 . 25043 1 933 . 1 1 86 86 MET HE1 H 1 2.063 0.020 . 1 . . . A 457 MET HE1 . 25043 1 934 . 1 1 86 86 MET HE2 H 1 2.063 0.020 . 1 . . . A 457 MET HE2 . 25043 1 935 . 1 1 86 86 MET HE3 H 1 2.063 0.020 . 1 . . . A 457 MET HE3 . 25043 1 936 . 1 1 86 86 MET CA C 13 49.555 0.400 . 1 . . . A 457 MET CA . 25043 1 937 . 1 1 86 86 MET CB C 13 29.508 0.400 . 1 . . . A 457 MET CB . 25043 1 938 . 1 1 86 86 MET CG C 13 29.574 0.400 . 1 . . . A 457 MET CG . 25043 1 939 . 1 1 86 86 MET CE C 13 14.490 0.400 . 1 . . . A 457 MET CE . 25043 1 940 . 1 1 87 87 PRO HA H 1 3.826 0.020 . 1 . . . A 458 PRO HA . 25043 1 941 . 1 1 87 87 PRO HB2 H 1 1.980 0.020 . 2 . . . A 458 PRO HB2 . 25043 1 942 . 1 1 87 87 PRO HB3 H 1 1.935 0.020 . 2 . . . A 458 PRO HB3 . 25043 1 943 . 1 1 87 87 PRO HG2 H 1 2.056 0.020 . 2 . . . A 458 PRO HG2 . 25043 1 944 . 1 1 87 87 PRO HG3 H 1 1.745 0.020 . 2 . . . A 458 PRO HG3 . 25043 1 945 . 1 1 87 87 PRO HD2 H 1 3.960 0.020 . 2 . . . A 458 PRO HD2 . 25043 1 946 . 1 1 87 87 PRO HD3 H 1 3.299 0.020 . 2 . . . A 458 PRO HD3 . 25043 1 947 . 1 1 87 87 PRO CA C 13 60.089 0.400 . 1 . . . A 458 PRO CA . 25043 1 948 . 1 1 87 87 PRO CB C 13 29.388 0.400 . 1 . . . A 458 PRO CB . 25043 1 949 . 1 1 87 87 PRO CG C 13 25.157 0.400 . 1 . . . A 458 PRO CG . 25043 1 950 . 1 1 87 87 PRO CD C 13 48.667 0.400 . 1 . . . A 458 PRO CD . 25043 1 951 . 1 1 88 88 GLY H H 1 7.541 0.020 . 1 . . . A 459 GLY H . 25043 1 952 . 1 1 88 88 GLY HA2 H 1 4.026 0.020 . 2 . . . A 459 GLY HA2 . 25043 1 953 . 1 1 88 88 GLY HA3 H 1 3.765 0.020 . 2 . . . A 459 GLY HA3 . 25043 1 954 . 1 1 88 88 GLY CA C 13 42.804 0.400 . 1 . . . A 459 GLY CA . 25043 1 955 . 1 1 88 88 GLY N N 15 106.937 0.400 . 1 . . . A 459 GLY N . 25043 1 956 . 1 1 89 89 GLN H H 1 8.487 0.020 . 1 . . . A 460 GLN H . 25043 1 957 . 1 1 89 89 GLN HA H 1 4.429 0.020 . 1 . . . A 460 GLN HA . 25043 1 958 . 1 1 89 89 GLN HB2 H 1 2.111 0.020 . 2 . . . A 460 GLN HB2 . 25043 1 959 . 1 1 89 89 GLN HB3 H 1 2.019 0.020 . 2 . . . A 460 GLN HB3 . 25043 1 960 . 1 1 89 89 GLN CA C 13 53.124 0.400 . 1 . . . A 460 GLN CA . 25043 1 961 . 1 1 89 89 GLN CB C 13 26.835 0.400 . 1 . . . A 460 GLN CB . 25043 1 962 . 1 1 89 89 GLN N N 15 121.303 0.400 . 1 . . . A 460 GLN N . 25043 1 963 . 1 1 90 90 SER H H 1 8.326 0.020 . 1 . . . A 461 SER H . 25043 1 964 . 1 1 90 90 SER HA H 1 4.600 0.020 . 1 . . . A 461 SER HA . 25043 1 965 . 1 1 90 90 SER HB2 H 1 4.234 0.020 . 2 . . . A 461 SER HB2 . 25043 1 966 . 1 1 90 90 SER HB3 H 1 3.928 0.020 . 2 . . . A 461 SER HB3 . 25043 1 967 . 1 1 90 90 SER CA C 13 55.405 0.400 . 1 . . . A 461 SER CA . 25043 1 968 . 1 1 90 90 SER CB C 13 62.931 0.400 . 1 . . . A 461 SER CB . 25043 1 969 . 1 1 90 90 SER N N 15 116.576 0.400 . 1 . . . A 461 SER N . 25043 1 970 . 1 1 91 91 TYR H H 1 9.473 0.020 . 1 . . . A 462 TYR H . 25043 1 971 . 1 1 91 91 TYR HA H 1 5.046 0.020 . 1 . . . A 462 TYR HA . 25043 1 972 . 1 1 91 91 TYR HB2 H 1 3.043 0.020 . 1 . . . A 462 TYR HB2 . 25043 1 973 . 1 1 91 91 TYR HB3 H 1 3.194 0.020 . 1 . . . A 462 TYR HB3 . 25043 1 974 . 1 1 91 91 TYR HD1 H 1 7.168 0.020 . 1 . . . A 462 TYR HD1 . 25043 1 975 . 1 1 91 91 TYR HD2 H 1 7.168 0.020 . 1 . . . A 462 TYR HD2 . 25043 1 976 . 1 1 91 91 TYR HE1 H 1 6.723 0.020 . 1 . . . A 462 TYR HE1 . 25043 1 977 . 1 1 91 91 TYR HE2 H 1 6.723 0.020 . 1 . . . A 462 TYR HE2 . 25043 1 978 . 1 1 91 91 TYR CA C 13 53.347 0.400 . 1 . . . A 462 TYR CA . 25043 1 979 . 1 1 91 91 TYR CB C 13 37.633 0.400 . 1 . . . A 462 TYR CB . 25043 1 980 . 1 1 91 91 TYR CD2 C 13 131.743 0.400 . 1 . . . A 462 TYR CD2 . 25043 1 981 . 1 1 91 91 TYR CE2 C 13 115.524 0.400 . 1 . . . A 462 TYR CE2 . 25043 1 982 . 1 1 91 91 TYR N N 15 120.273 0.400 . 1 . . . A 462 TYR N . 25043 1 983 . 1 1 92 92 GLY H H 1 8.495 0.020 . 1 . . . A 463 GLY H . 25043 1 984 . 1 1 92 92 GLY HA2 H 1 3.566 0.020 . 2 . . . A 463 GLY HA2 . 25043 1 985 . 1 1 92 92 GLY HA3 H 1 4.448 0.020 . 2 . . . A 463 GLY HA3 . 25043 1 986 . 1 1 92 92 GLY CA C 13 42.058 0.400 . 1 . . . A 463 GLY CA . 25043 1 987 . 1 1 92 92 GLY N N 15 107.050 0.400 . 1 . . . A 463 GLY N . 25043 1 988 . 1 1 93 93 LEU H H 1 8.904 0.020 . 1 . . . A 464 LEU H . 25043 1 989 . 1 1 93 93 LEU HA H 1 4.388 0.020 . 1 . . . A 464 LEU HA . 25043 1 990 . 1 1 93 93 LEU HB2 H 1 1.775 0.020 . 1 . . . A 464 LEU HB2 . 25043 1 991 . 1 1 93 93 LEU HB3 H 1 1.651 0.020 . 1 . . . A 464 LEU HB3 . 25043 1 992 . 1 1 93 93 LEU HG H 1 1.138 0.020 . 1 . . . A 464 LEU HG . 25043 1 993 . 1 1 93 93 LEU HD11 H 1 0.291 0.020 . 2 . . . A 464 LEU HD11 . 25043 1 994 . 1 1 93 93 LEU HD12 H 1 0.291 0.020 . 2 . . . A 464 LEU HD12 . 25043 1 995 . 1 1 93 93 LEU HD13 H 1 0.291 0.020 . 2 . . . A 464 LEU HD13 . 25043 1 996 . 1 1 93 93 LEU HD21 H 1 0.392 0.020 . 2 . . . A 464 LEU HD21 . 25043 1 997 . 1 1 93 93 LEU HD22 H 1 0.392 0.020 . 2 . . . A 464 LEU HD22 . 25043 1 998 . 1 1 93 93 LEU HD23 H 1 0.392 0.020 . 2 . . . A 464 LEU HD23 . 25043 1 999 . 1 1 93 93 LEU CA C 13 51.497 0.400 . 1 . . . A 464 LEU CA . 25043 1 1000 . 1 1 93 93 LEU CB C 13 38.408 0.400 . 1 . . . A 464 LEU CB . 25043 1 1001 . 1 1 93 93 LEU CG C 13 23.719 0.400 . 1 . . . A 464 LEU CG . 25043 1 1002 . 1 1 93 93 LEU CD1 C 13 22.794 0.400 . 1 . . . A 464 LEU CD1 . 25043 1 1003 . 1 1 93 93 LEU CD2 C 13 18.877 0.400 . 1 . . . A 464 LEU CD2 . 25043 1 1004 . 1 1 93 93 LEU N N 15 124.407 0.400 . 1 . . . A 464 LEU N . 25043 1 1005 . 1 1 94 94 GLU H H 1 8.884 0.020 . 1 . . . A 465 GLU H . 25043 1 1006 . 1 1 94 94 GLU HA H 1 4.054 0.020 . 1 . . . A 465 GLU HA . 25043 1 1007 . 1 1 94 94 GLU HB2 H 1 2.161 0.020 . 2 . . . A 465 GLU HB2 . 25043 1 1008 . 1 1 94 94 GLU HB3 H 1 2.161 0.020 . 2 . . . A 465 GLU HB3 . 25043 1 1009 . 1 1 94 94 GLU HG2 H 1 2.430 0.020 . 2 . . . A 465 GLU HG2 . 25043 1 1010 . 1 1 94 94 GLU HG3 H 1 2.385 0.020 . 2 . . . A 465 GLU HG3 . 25043 1 1011 . 1 1 94 94 GLU CA C 13 57.258 0.400 . 1 . . . A 465 GLU CA . 25043 1 1012 . 1 1 94 94 GLU CB C 13 26.658 0.400 . 1 . . . A 465 GLU CB . 25043 1 1013 . 1 1 94 94 GLU CG C 13 33.917 0.400 . 1 . . . A 465 GLU CG . 25043 1 1014 . 1 1 94 94 GLU N N 15 122.321 0.400 . 1 . . . A 465 GLU N . 25043 1 1015 . 1 1 95 95 ASP H H 1 7.868 0.020 . 1 . . . A 466 ASP H . 25043 1 1016 . 1 1 95 95 ASP HA H 1 4.555 0.020 . 1 . . . A 466 ASP HA . 25043 1 1017 . 1 1 95 95 ASP HB2 H 1 3.073 0.020 . 2 . . . A 466 ASP HB2 . 25043 1 1018 . 1 1 95 95 ASP HB3 H 1 2.721 0.020 . 2 . . . A 466 ASP HB3 . 25043 1 1019 . 1 1 95 95 ASP CA C 13 50.516 0.400 . 1 . . . A 466 ASP CA . 25043 1 1020 . 1 1 95 95 ASP CB C 13 37.460 0.400 . 1 . . . A 466 ASP CB . 25043 1 1021 . 1 1 95 95 ASP N N 15 115.343 0.400 . 1 . . . A 466 ASP N . 25043 1 1022 . 1 1 96 96 GLY H H 1 8.253 0.020 . 1 . . . A 467 GLY H . 25043 1 1023 . 1 1 96 96 GLY HA2 H 1 4.338 0.020 . 2 . . . A 467 GLY HA2 . 25043 1 1024 . 1 1 96 96 GLY HA3 H 1 3.690 0.020 . 2 . . . A 467 GLY HA3 . 25043 1 1025 . 1 1 96 96 GLY CA C 13 42.163 0.400 . 1 . . . A 467 GLY CA . 25043 1 1026 . 1 1 96 96 GLY N N 15 108.986 0.400 . 1 . . . A 467 GLY N . 25043 1 1027 . 1 1 97 97 SER H H 1 8.324 0.020 . 1 . . . A 468 SER H . 25043 1 1028 . 1 1 97 97 SER HA H 1 4.516 0.020 . 1 . . . A 468 SER HA . 25043 1 1029 . 1 1 97 97 SER CA C 13 56.046 0.400 . 1 . . . A 468 SER CA . 25043 1 1030 . 1 1 97 97 SER N N 15 118.455 0.400 . 1 . . . A 468 SER N . 25043 1 1031 . 1 1 98 98 CYS H H 1 8.426 0.020 . 1 . . . A 469 CYS H . 25043 1 1032 . 1 1 98 98 CYS HA H 1 4.413 0.020 . 1 . . . A 469 CYS HA . 25043 1 1033 . 1 1 98 98 CYS HB2 H 1 3.227 0.020 . 2 . . . A 469 CYS HB2 . 25043 1 1034 . 1 1 98 98 CYS HB3 H 1 2.942 0.020 . 2 . . . A 469 CYS HB3 . 25043 1 1035 . 1 1 98 98 CYS CA C 13 57.062 0.400 . 1 . . . A 469 CYS CA . 25043 1 1036 . 1 1 98 98 CYS CB C 13 25.463 0.400 . 1 . . . A 469 CYS CB . 25043 1 1037 . 1 1 98 98 CYS N N 15 118.872 0.400 . 1 . . . A 469 CYS N . 25043 1 1038 . 1 1 99 99 SER H H 1 8.811 0.020 . 1 . . . A 470 SER H . 25043 1 1039 . 1 1 99 99 SER HA H 1 3.731 0.020 . 1 . . . A 470 SER HA . 25043 1 1040 . 1 1 99 99 SER HB2 H 1 4.453 0.020 . 2 . . . A 470 SER HB2 . 25043 1 1041 . 1 1 99 99 SER HB3 H 1 2.461 0.020 . 2 . . . A 470 SER HB3 . 25043 1 1042 . 1 1 99 99 SER CA C 13 58.335 0.400 . 1 . . . A 470 SER CA . 25043 1 1043 . 1 1 99 99 SER CB C 13 59.585 0.400 . 1 . . . A 470 SER CB . 25043 1 1044 . 1 1 99 99 SER N N 15 121.861 0.400 . 1 . . . A 470 SER N . 25043 1 1045 . 1 1 100 100 TYR H H 1 7.558 0.020 . 1 . . . A 471 TYR H . 25043 1 1046 . 1 1 100 100 TYR HA H 1 5.730 0.020 . 1 . . . A 471 TYR HA . 25043 1 1047 . 1 1 100 100 TYR HB2 H 1 3.086 0.020 . 2 . . . A 471 TYR HB2 . 25043 1 1048 . 1 1 100 100 TYR HB3 H 1 2.794 0.020 . 2 . . . A 471 TYR HB3 . 25043 1 1049 . 1 1 100 100 TYR HD1 H 1 7.020 0.020 . 1 . . . A 471 TYR HD1 . 25043 1 1050 . 1 1 100 100 TYR HD2 H 1 7.020 0.020 . 1 . . . A 471 TYR HD2 . 25043 1 1051 . 1 1 100 100 TYR HE1 H 1 6.679 0.020 . 1 . . . A 471 TYR HE1 . 25043 1 1052 . 1 1 100 100 TYR HE2 H 1 6.679 0.020 . 1 . . . A 471 TYR HE2 . 25043 1 1053 . 1 1 100 100 TYR CA C 13 53.212 0.400 . 1 . . . A 471 TYR CA . 25043 1 1054 . 1 1 100 100 TYR CB C 13 40.512 0.400 . 1 . . . A 471 TYR CB . 25043 1 1055 . 1 1 100 100 TYR CD1 C 13 130.501 0.400 . 1 . . . A 471 TYR CD1 . 25043 1 1056 . 1 1 100 100 TYR CE1 C 13 114.677 0.400 . 1 . . . A 471 TYR CE1 . 25043 1 1057 . 1 1 100 100 TYR N N 15 123.626 0.400 . 1 . . . A 471 TYR N . 25043 1 1058 . 1 1 101 101 LYS H H 1 8.205 0.020 . 1 . . . A 472 LYS H . 25043 1 1059 . 1 1 101 101 LYS HA H 1 3.847 0.020 . 1 . . . A 472 LYS HA . 25043 1 1060 . 1 1 101 101 LYS HB2 H 1 1.424 0.020 . 1 . . . A 472 LYS HB2 . 25043 1 1061 . 1 1 101 101 LYS HB3 H 1 1.090 0.020 . 1 . . . A 472 LYS HB3 . 25043 1 1062 . 1 1 101 101 LYS HG2 H 1 0.867 0.020 . 2 . . . A 472 LYS HG2 . 25043 1 1063 . 1 1 101 101 LYS HG3 H 1 -0.118 0.020 . 2 . . . A 472 LYS HG3 . 25043 1 1064 . 1 1 101 101 LYS HD2 H 1 1.413 0.020 . 2 . . . A 472 LYS HD2 . 25043 1 1065 . 1 1 101 101 LYS HD3 H 1 1.241 0.020 . 2 . . . A 472 LYS HD3 . 25043 1 1066 . 1 1 101 101 LYS HE2 H 1 2.629 0.020 . 2 . . . A 472 LYS HE2 . 25043 1 1067 . 1 1 101 101 LYS HE3 H 1 2.351 0.020 . 2 . . . A 472 LYS HE3 . 25043 1 1068 . 1 1 101 101 LYS CA C 13 54.341 0.400 . 1 . . . A 472 LYS CA . 25043 1 1069 . 1 1 101 101 LYS CB C 13 34.305 0.400 . 1 . . . A 472 LYS CB . 25043 1 1070 . 1 1 101 101 LYS CG C 13 22.641 0.400 . 1 . . . A 472 LYS CG . 25043 1 1071 . 1 1 101 101 LYS CD C 13 27.236 0.400 . 1 . . . A 472 LYS CD . 25043 1 1072 . 1 1 101 101 LYS CE C 13 39.059 0.400 . 1 . . . A 472 LYS CE . 25043 1 1073 . 1 1 101 101 LYS N N 15 127.352 0.400 . 1 . . . A 472 LYS N . 25043 1 1074 . 1 1 102 102 ASP H H 1 7.899 0.020 . 1 . . . A 473 ASP H . 25043 1 1075 . 1 1 102 102 ASP HA H 1 4.835 0.020 . 1 . . . A 473 ASP HA . 25043 1 1076 . 1 1 102 102 ASP HB2 H 1 2.859 0.020 . 2 . . . A 473 ASP HB2 . 25043 1 1077 . 1 1 102 102 ASP HB3 H 1 2.472 0.020 . 2 . . . A 473 ASP HB3 . 25043 1 1078 . 1 1 102 102 ASP CA C 13 49.749 0.400 . 1 . . . A 473 ASP CA . 25043 1 1079 . 1 1 102 102 ASP CB C 13 39.350 0.400 . 1 . . . A 473 ASP CB . 25043 1 1080 . 1 1 102 102 ASP N N 15 124.188 0.400 . 1 . . . A 473 ASP N . 25043 1 1081 . 1 1 103 103 PHE H H 1 8.932 0.020 . 1 . . . A 474 PHE H . 25043 1 1082 . 1 1 103 103 PHE HA H 1 4.457 0.020 . 1 . . . A 474 PHE HA . 25043 1 1083 . 1 1 103 103 PHE HB2 H 1 3.380 0.020 . 1 . . . A 474 PHE HB2 . 25043 1 1084 . 1 1 103 103 PHE HB3 H 1 2.461 0.020 . 1 . . . A 474 PHE HB3 . 25043 1 1085 . 1 1 103 103 PHE HD1 H 1 6.601 0.020 . 1 . . . A 474 PHE HD1 . 25043 1 1086 . 1 1 103 103 PHE HD2 H 1 6.601 0.020 . 1 . . . A 474 PHE HD2 . 25043 1 1087 . 1 1 103 103 PHE HE1 H 1 6.964 0.020 . 1 . . . A 474 PHE HE1 . 25043 1 1088 . 1 1 103 103 PHE HE2 H 1 6.964 0.020 . 1 . . . A 474 PHE HE2 . 25043 1 1089 . 1 1 103 103 PHE HZ H 1 6.498 0.020 . 1 . . . A 474 PHE HZ . 25043 1 1090 . 1 1 103 103 PHE CA C 13 55.734 0.400 . 1 . . . A 474 PHE CA . 25043 1 1091 . 1 1 103 103 PHE CB C 13 38.713 0.400 . 1 . . . A 474 PHE CB . 25043 1 1092 . 1 1 103 103 PHE CD1 C 13 129.416 0.400 . 1 . . . A 474 PHE CD1 . 25043 1 1093 . 1 1 103 103 PHE CE1 C 13 127.919 0.400 . 1 . . . A 474 PHE CE1 . 25043 1 1094 . 1 1 103 103 PHE N N 15 125.873 0.400 . 1 . . . A 474 PHE N . 25043 1 1095 . 1 1 104 104 SER H H 1 9.056 0.020 . 1 . . . A 475 SER H . 25043 1 1096 . 1 1 104 104 SER HA H 1 4.163 0.020 . 1 . . . A 475 SER HA . 25043 1 1097 . 1 1 104 104 SER HB2 H 1 4.201 0.020 . 2 . . . A 475 SER HB2 . 25043 1 1098 . 1 1 104 104 SER HB3 H 1 4.037 0.020 . 2 . . . A 475 SER HB3 . 25043 1 1099 . 1 1 104 104 SER CA C 13 60.090 0.400 . 1 . . . A 475 SER CA . 25043 1 1100 . 1 1 104 104 SER CB C 13 60.478 0.400 . 1 . . . A 475 SER CB . 25043 1 1101 . 1 1 104 104 SER N N 15 119.240 0.400 . 1 . . . A 475 SER N . 25043 1 1102 . 1 1 105 105 GLU H H 1 8.491 0.020 . 1 . . . A 476 GLU H . 25043 1 1103 . 1 1 105 105 GLU HA H 1 4.612 0.020 . 1 . . . A 476 GLU HA . 25043 1 1104 . 1 1 105 105 GLU HB2 H 1 2.323 0.020 . 2 . . . A 476 GLU HB2 . 25043 1 1105 . 1 1 105 105 GLU HB3 H 1 1.771 0.020 . 2 . . . A 476 GLU HB3 . 25043 1 1106 . 1 1 105 105 GLU HG2 H 1 2.321 0.020 . 2 . . . A 476 GLU HG2 . 25043 1 1107 . 1 1 105 105 GLU HG3 H 1 2.203 0.020 . 2 . . . A 476 GLU HG3 . 25043 1 1108 . 1 1 105 105 GLU CA C 13 52.470 0.400 . 1 . . . A 476 GLU CA . 25043 1 1109 . 1 1 105 105 GLU CB C 13 26.691 0.400 . 1 . . . A 476 GLU CB . 25043 1 1110 . 1 1 105 105 GLU CG C 13 33.723 0.400 . 1 . . . A 476 GLU CG . 25043 1 1111 . 1 1 105 105 GLU N N 15 119.722 0.400 . 1 . . . A 476 GLU N . 25043 1 1112 . 1 1 106 106 SER H H 1 8.022 0.020 . 1 . . . A 477 SER H . 25043 1 1113 . 1 1 106 106 SER HA H 1 4.061 0.020 . 1 . . . A 477 SER HA . 25043 1 1114 . 1 1 106 106 SER HB2 H 1 4.247 0.020 . 2 . . . A 477 SER HB2 . 25043 1 1115 . 1 1 106 106 SER HB3 H 1 4.247 0.020 . 2 . . . A 477 SER HB3 . 25043 1 1116 . 1 1 106 106 SER CA C 13 56.746 0.400 . 1 . . . A 477 SER CA . 25043 1 1117 . 1 1 106 106 SER CB C 13 56.442 0.400 . 1 . . . A 477 SER CB . 25043 1 1118 . 1 1 106 106 SER N N 15 114.856 0.400 . 1 . . . A 477 SER N . 25043 1 1119 . 1 1 107 107 ARG H H 1 9.223 0.020 . 1 . . . A 478 ARG H . 25043 1 1120 . 1 1 107 107 ARG N N 15 129.770 0.400 . 1 . . . A 478 ARG N . 25043 1 1121 . 1 1 108 108 ASN H H 1 8.411 0.020 . 1 . . . A 479 ASN H . 25043 1 1122 . 1 1 108 108 ASN HA H 1 4.878 0.020 . 1 . . . A 479 ASN HA . 25043 1 1123 . 1 1 108 108 ASN HB2 H 1 2.457 0.020 . 2 . . . A 479 ASN HB2 . 25043 1 1124 . 1 1 108 108 ASN HB3 H 1 2.244 0.020 . 2 . . . A 479 ASN HB3 . 25043 1 1125 . 1 1 108 108 ASN HD21 H 1 6.984 0.020 . 2 . . . A 479 ASN HD21 . 25043 1 1126 . 1 1 108 108 ASN HD22 H 1 6.836 0.020 . 2 . . . A 479 ASN HD22 . 25043 1 1127 . 1 1 108 108 ASN CA C 13 50.222 0.400 . 1 . . . A 479 ASN CA . 25043 1 1128 . 1 1 108 108 ASN CB C 13 35.972 0.400 . 1 . . . A 479 ASN CB . 25043 1 1129 . 1 1 108 108 ASN N N 15 114.996 0.400 . 1 . . . A 479 ASN N . 25043 1 1130 . 1 1 108 108 ASN ND2 N 15 110.896 0.400 . 1 . . . A 479 ASN ND2 . 25043 1 1131 . 1 1 109 109 ASN H H 1 7.111 0.020 . 1 . . . A 480 ASN H . 25043 1 1132 . 1 1 109 109 ASN HA H 1 5.308 0.020 . 1 . . . A 480 ASN HA . 25043 1 1133 . 1 1 109 109 ASN HB2 H 1 3.304 0.020 . 2 . . . A 480 ASN HB2 . 25043 1 1134 . 1 1 109 109 ASN HB3 H 1 2.884 0.020 . 2 . . . A 480 ASN HB3 . 25043 1 1135 . 1 1 109 109 ASN CA C 13 52.102 0.400 . 1 . . . A 480 ASN CA . 25043 1 1136 . 1 1 109 109 ASN CB C 13 36.121 0.400 . 1 . . . A 480 ASN CB . 25043 1 1137 . 1 1 109 109 ASN N N 15 120.323 0.400 . 1 . . . A 480 ASN N . 25043 1 1138 . 1 1 110 110 ARG H H 1 10.666 0.020 . 1 . . . A 481 ARG H . 25043 1 1139 . 1 1 110 110 ARG HB2 H 1 2.162 0.020 . 2 . . . A 481 ARG HB2 . 25043 1 1140 . 1 1 110 110 ARG HB3 H 1 1.867 0.020 . 2 . . . A 481 ARG HB3 . 25043 1 1141 . 1 1 110 110 ARG HG2 H 1 1.656 0.020 . 2 . . . A 481 ARG HG2 . 25043 1 1142 . 1 1 110 110 ARG HG3 H 1 1.656 0.020 . 2 . . . A 481 ARG HG3 . 25043 1 1143 . 1 1 110 110 ARG HD2 H 1 3.189 0.020 . 2 . . . A 481 ARG HD2 . 25043 1 1144 . 1 1 110 110 ARG HD3 H 1 3.189 0.020 . 2 . . . A 481 ARG HD3 . 25043 1 1145 . 1 1 110 110 ARG HE H 1 9.368 0.020 . 1 . . . A 481 ARG HE . 25043 1 1146 . 1 1 110 110 ARG N N 15 120.597 0.400 . 1 . . . A 481 ARG N . 25043 1 1147 . 1 1 110 110 ARG NE N 15 123.003 0.400 . 1 . . . A 481 ARG NE . 25043 1 1148 . 1 1 111 111 PHE H H 1 8.932 0.020 . 1 . . . A 482 PHE H . 25043 1 1149 . 1 1 111 111 PHE HA H 1 4.584 0.020 . 1 . . . A 482 PHE HA . 25043 1 1150 . 1 1 111 111 PHE HB2 H 1 3.267 0.020 . 2 . . . A 482 PHE HB2 . 25043 1 1151 . 1 1 111 111 PHE HB3 H 1 2.971 0.020 . 2 . . . A 482 PHE HB3 . 25043 1 1152 . 1 1 111 111 PHE HD1 H 1 7.310 0.020 . 1 . . . A 482 PHE HD1 . 25043 1 1153 . 1 1 111 111 PHE HD2 H 1 7.310 0.020 . 1 . . . A 482 PHE HD2 . 25043 1 1154 . 1 1 111 111 PHE HE1 H 1 7.402 0.020 . 1 . . . A 482 PHE HE1 . 25043 1 1155 . 1 1 111 111 PHE HE2 H 1 7.402 0.020 . 1 . . . A 482 PHE HE2 . 25043 1 1156 . 1 1 111 111 PHE HZ H 1 6.981 0.020 . 1 . . . A 482 PHE HZ . 25043 1 1157 . 1 1 111 111 PHE CA C 13 52.775 0.400 . 1 . . . A 482 PHE CA . 25043 1 1158 . 1 1 111 111 PHE CB C 13 34.892 0.400 . 1 . . . A 482 PHE CB . 25043 1 1159 . 1 1 111 111 PHE CD1 C 13 129.631 0.400 . 1 . . . A 482 PHE CD1 . 25043 1 1160 . 1 1 111 111 PHE CE1 C 13 129.374 0.400 . 1 . . . A 482 PHE CE1 . 25043 1 1161 . 1 1 111 111 PHE CZ C 13 126.893 0.400 . 1 . . . A 482 PHE CZ . 25043 1 1162 . 1 1 111 111 PHE N N 15 118.206 0.400 . 1 . . . A 482 PHE N . 25043 1 1163 . 1 1 112 112 SER H H 1 8.603 0.020 . 1 . . . A 483 SER H . 25043 1 1164 . 1 1 112 112 SER HA H 1 4.296 0.020 . 1 . . . A 483 SER HA . 25043 1 1165 . 1 1 112 112 SER HB2 H 1 4.096 0.020 . 2 . . . A 483 SER HB2 . 25043 1 1166 . 1 1 112 112 SER HB3 H 1 4.096 0.020 . 2 . . . A 483 SER HB3 . 25043 1 1167 . 1 1 112 112 SER CA C 13 59.337 0.400 . 1 . . . A 483 SER CA . 25043 1 1168 . 1 1 112 112 SER CB C 13 60.417 0.400 . 1 . . . A 483 SER CB . 25043 1 1169 . 1 1 112 112 SER N N 15 116.704 0.400 . 1 . . . A 483 SER N . 25043 1 1170 . 1 1 113 113 THR H H 1 7.304 0.020 . 1 . . . A 484 THR H . 25043 1 1171 . 1 1 113 113 THR HA H 1 4.945 0.020 . 1 . . . A 484 THR HA . 25043 1 1172 . 1 1 113 113 THR HB H 1 4.643 0.020 . 1 . . . A 484 THR HB . 25043 1 1173 . 1 1 113 113 THR HG21 H 1 1.225 0.020 . 1 . . . A 484 THR HG21 . 25043 1 1174 . 1 1 113 113 THR HG22 H 1 1.225 0.020 . 1 . . . A 484 THR HG22 . 25043 1 1175 . 1 1 113 113 THR HG23 H 1 1.225 0.020 . 1 . . . A 484 THR HG23 . 25043 1 1176 . 1 1 113 113 THR CA C 13 55.248 0.400 . 1 . . . A 484 THR CA . 25043 1 1177 . 1 1 113 113 THR CB C 13 67.230 0.400 . 1 . . . A 484 THR CB . 25043 1 1178 . 1 1 113 113 THR CG2 C 13 19.367 0.400 . 1 . . . A 484 THR CG2 . 25043 1 1179 . 1 1 113 113 THR N N 15 108.193 0.400 . 1 . . . A 484 THR N . 25043 1 1180 . 1 1 114 114 PRO HA H 1 4.309 0.020 . 1 . . . A 485 PRO HA . 25043 1 1181 . 1 1 114 114 PRO HB2 H 1 2.448 0.020 . 2 . . . A 485 PRO HB2 . 25043 1 1182 . 1 1 114 114 PRO HB3 H 1 1.998 0.020 . 2 . . . A 485 PRO HB3 . 25043 1 1183 . 1 1 114 114 PRO HG2 H 1 2.033 0.020 . 2 . . . A 485 PRO HG2 . 25043 1 1184 . 1 1 114 114 PRO HG3 H 1 2.276 0.020 . 2 . . . A 485 PRO HG3 . 25043 1 1185 . 1 1 114 114 PRO HD2 H 1 4.042 0.020 . 1 . . . A 485 PRO HD2 . 25043 1 1186 . 1 1 114 114 PRO HD3 H 1 3.950 0.020 . 1 . . . A 485 PRO HD3 . 25043 1 1187 . 1 1 114 114 PRO CA C 13 62.914 0.400 . 1 . . . A 485 PRO CA . 25043 1 1188 . 1 1 114 114 PRO CB C 13 29.146 0.400 . 1 . . . A 485 PRO CB . 25043 1 1189 . 1 1 114 114 PRO CG C 13 25.182 0.400 . 1 . . . A 485 PRO CG . 25043 1 1190 . 1 1 114 114 PRO CD C 13 47.950 0.400 . 1 . . . A 485 PRO CD . 25043 1 1191 . 1 1 115 115 GLU H H 1 8.793 0.020 . 1 . . . A 486 GLU H . 25043 1 1192 . 1 1 115 115 GLU HA H 1 4.018 0.020 . 1 . . . A 486 GLU HA . 25043 1 1193 . 1 1 115 115 GLU HB2 H 1 2.061 0.020 . 2 . . . A 486 GLU HB2 . 25043 1 1194 . 1 1 115 115 GLU HB3 H 1 1.936 0.020 . 2 . . . A 486 GLU HB3 . 25043 1 1195 . 1 1 115 115 GLU HG2 H 1 2.276 0.020 . 2 . . . A 486 GLU HG2 . 25043 1 1196 . 1 1 115 115 GLU HG3 H 1 2.389 0.020 . 2 . . . A 486 GLU HG3 . 25043 1 1197 . 1 1 115 115 GLU CA C 13 57.111 0.400 . 1 . . . A 486 GLU CA . 25043 1 1198 . 1 1 115 115 GLU CB C 13 26.088 0.400 . 1 . . . A 486 GLU CB . 25043 1 1199 . 1 1 115 115 GLU CG C 13 33.949 0.400 . 1 . . . A 486 GLU CG . 25043 1 1200 . 1 1 115 115 GLU N N 15 117.603 0.400 . 1 . . . A 486 GLU N . 25043 1 1201 . 1 1 116 116 GLN H H 1 7.490 0.020 . 1 . . . A 487 GLN H . 25043 1 1202 . 1 1 116 116 GLN HA H 1 3.971 0.020 . 1 . . . A 487 GLN HA . 25043 1 1203 . 1 1 116 116 GLN HB2 H 1 2.200 0.020 . 1 . . . A 487 GLN HB2 . 25043 1 1204 . 1 1 116 116 GLN HB3 H 1 1.843 0.020 . 1 . . . A 487 GLN HB3 . 25043 1 1205 . 1 1 116 116 GLN HG2 H 1 2.377 0.020 . 2 . . . A 487 GLN HG2 . 25043 1 1206 . 1 1 116 116 GLN HG3 H 1 2.377 0.020 . 2 . . . A 487 GLN HG3 . 25043 1 1207 . 1 1 116 116 GLN CA C 13 55.722 0.400 . 1 . . . A 487 GLN CA . 25043 1 1208 . 1 1 116 116 GLN CB C 13 26.158 0.400 . 1 . . . A 487 GLN CB . 25043 1 1209 . 1 1 116 116 GLN CG C 13 31.648 0.400 . 1 . . . A 487 GLN CG . 25043 1 1210 . 1 1 116 116 GLN N N 15 118.274 0.400 . 1 . . . A 487 GLN N . 25043 1 1211 . 1 1 117 117 ALA H H 1 8.862 0.020 . 1 . . . A 488 ALA H . 25043 1 1212 . 1 1 117 117 ALA HA H 1 3.558 0.020 . 1 . . . A 488 ALA HA . 25043 1 1213 . 1 1 117 117 ALA HB1 H 1 1.625 0.020 . 1 . . . A 488 ALA HB1 . 25043 1 1214 . 1 1 117 117 ALA HB2 H 1 1.625 0.020 . 1 . . . A 488 ALA HB2 . 25043 1 1215 . 1 1 117 117 ALA HB3 H 1 1.625 0.020 . 1 . . . A 488 ALA HB3 . 25043 1 1216 . 1 1 117 117 ALA CA C 13 52.045 0.400 . 1 . . . A 488 ALA CA . 25043 1 1217 . 1 1 117 117 ALA CB C 13 16.232 0.400 . 1 . . . A 488 ALA CB . 25043 1 1218 . 1 1 117 117 ALA N N 15 120.467 0.400 . 1 . . . A 488 ALA N . 25043 1 1219 . 1 1 118 118 ALA H H 1 7.529 0.020 . 1 . . . A 489 ALA H . 25043 1 1220 . 1 1 118 118 ALA HA H 1 4.161 0.020 . 1 . . . A 489 ALA HA . 25043 1 1221 . 1 1 118 118 ALA HB1 H 1 1.472 0.020 . 1 . . . A 489 ALA HB1 . 25043 1 1222 . 1 1 118 118 ALA HB2 H 1 1.472 0.020 . 1 . . . A 489 ALA HB2 . 25043 1 1223 . 1 1 118 118 ALA HB3 H 1 1.472 0.020 . 1 . . . A 489 ALA HB3 . 25043 1 1224 . 1 1 118 118 ALA CA C 13 51.002 0.400 . 1 . . . A 489 ALA CA . 25043 1 1225 . 1 1 118 118 ALA CB C 13 15.921 0.400 . 1 . . . A 489 ALA CB . 25043 1 1226 . 1 1 118 118 ALA N N 15 117.745 0.400 . 1 . . . A 489 ALA N . 25043 1 1227 . 1 1 119 119 LYS H H 1 7.194 0.020 . 1 . . . A 490 LYS H . 25043 1 1228 . 1 1 119 119 LYS HA H 1 3.895 0.020 . 1 . . . A 490 LYS HA . 25043 1 1229 . 1 1 119 119 LYS HB2 H 1 1.246 0.020 . 2 . . . A 490 LYS HB2 . 25043 1 1230 . 1 1 119 119 LYS HB3 H 1 1.221 0.020 . 2 . . . A 490 LYS HB3 . 25043 1 1231 . 1 1 119 119 LYS HG2 H 1 1.554 0.020 . 2 . . . A 490 LYS HG2 . 25043 1 1232 . 1 1 119 119 LYS HG3 H 1 1.247 0.020 . 2 . . . A 490 LYS HG3 . 25043 1 1233 . 1 1 119 119 LYS HD2 H 1 1.552 0.020 . 2 . . . A 490 LYS HD2 . 25043 1 1234 . 1 1 119 119 LYS HD3 H 1 1.550 0.020 . 2 . . . A 490 LYS HD3 . 25043 1 1235 . 1 1 119 119 LYS HE2 H 1 2.875 0.020 . 2 . . . A 490 LYS HE2 . 25043 1 1236 . 1 1 119 119 LYS HE3 H 1 2.848 0.020 . 2 . . . A 490 LYS HE3 . 25043 1 1237 . 1 1 119 119 LYS CA C 13 54.149 0.400 . 1 . . . A 490 LYS CA . 25043 1 1238 . 1 1 119 119 LYS CB C 13 29.887 0.400 . 1 . . . A 490 LYS CB . 25043 1 1239 . 1 1 119 119 LYS CG C 13 22.157 0.400 . 1 . . . A 490 LYS CG . 25043 1 1240 . 1 1 119 119 LYS CD C 13 26.474 0.400 . 1 . . . A 490 LYS CD . 25043 1 1241 . 1 1 119 119 LYS CE C 13 39.317 0.400 . 1 . . . A 490 LYS CE . 25043 1 1242 . 1 1 119 119 LYS N N 15 115.565 0.400 . 1 . . . A 490 LYS N . 25043 1 1243 . 1 1 120 120 ASN H H 1 6.981 0.020 . 1 . . . A 491 ASN H . 25043 1 1244 . 1 1 120 120 ASN HA H 1 4.531 0.020 . 1 . . . A 491 ASN HA . 25043 1 1245 . 1 1 120 120 ASN HB2 H 1 2.466 0.020 . 2 . . . A 491 ASN HB2 . 25043 1 1246 . 1 1 120 120 ASN HB3 H 1 2.466 0.020 . 2 . . . A 491 ASN HB3 . 25043 1 1247 . 1 1 120 120 ASN HD21 H 1 6.146 0.020 . 2 . . . A 491 ASN HD21 . 25043 1 1248 . 1 1 120 120 ASN HD22 H 1 5.952 0.020 . 2 . . . A 491 ASN HD22 . 25043 1 1249 . 1 1 120 120 ASN CA C 13 51.544 0.400 . 1 . . . A 491 ASN CA . 25043 1 1250 . 1 1 120 120 ASN CB C 13 37.886 0.400 . 1 . . . A 491 ASN CB . 25043 1 1251 . 1 1 120 120 ASN N N 15 113.869 0.400 . 1 . . . A 491 ASN N . 25043 1 1252 . 1 1 120 120 ASN ND2 N 15 119.007 0.400 . 1 . . . A 491 ASN ND2 . 25043 1 1253 . 1 1 121 121 ARG HB2 H 1 1.867 0.020 . 2 . . . A 492 ARG HB2 . 25043 1 1254 . 1 1 121 121 ARG HB3 H 1 1.867 0.020 . 2 . . . A 492 ARG HB3 . 25043 1 1255 . 1 1 121 121 ARG HG2 H 1 1.540 0.020 . 2 . . . A 492 ARG HG2 . 25043 1 1256 . 1 1 121 121 ARG HG3 H 1 1.540 0.020 . 2 . . . A 492 ARG HG3 . 25043 1 1257 . 1 1 121 121 ARG HD2 H 1 2.837 0.020 . 2 . . . A 492 ARG HD2 . 25043 1 1258 . 1 1 121 121 ARG HD3 H 1 2.837 0.020 . 2 . . . A 492 ARG HD3 . 25043 1 1259 . 1 1 121 121 ARG HE H 1 7.006 0.020 . 1 . . . A 492 ARG HE . 25043 1 1260 . 1 1 121 121 ARG NE N 15 118.578 0.400 . 1 . . . A 492 ARG NE . 25043 1 1261 . 1 1 122 122 ILE H H 1 8.363 0.020 . 1 . . . A 493 ILE H . 25043 1 1262 . 1 1 122 122 ILE HA H 1 4.100 0.020 . 1 . . . A 493 ILE HA . 25043 1 1263 . 1 1 122 122 ILE HB H 1 2.089 0.020 . 1 . . . A 493 ILE HB . 25043 1 1264 . 1 1 122 122 ILE HG12 H 1 1.627 0.020 . 2 . . . A 493 ILE HG12 . 25043 1 1265 . 1 1 122 122 ILE HG13 H 1 1.536 0.020 . 2 . . . A 493 ILE HG13 . 25043 1 1266 . 1 1 122 122 ILE HG21 H 1 0.859 0.020 . 1 . . . A 493 ILE HG21 . 25043 1 1267 . 1 1 122 122 ILE HG22 H 1 0.859 0.020 . 1 . . . A 493 ILE HG22 . 25043 1 1268 . 1 1 122 122 ILE HG23 H 1 0.859 0.020 . 1 . . . A 493 ILE HG23 . 25043 1 1269 . 1 1 122 122 ILE HD11 H 1 0.996 0.020 . 1 . . . A 493 ILE HD11 . 25043 1 1270 . 1 1 122 122 ILE HD12 H 1 0.996 0.020 . 1 . . . A 493 ILE HD12 . 25043 1 1271 . 1 1 122 122 ILE HD13 H 1 0.996 0.020 . 1 . . . A 493 ILE HD13 . 25043 1 1272 . 1 1 122 122 ILE CA C 13 54.488 0.400 . 1 . . . A 493 ILE CA . 25043 1 1273 . 1 1 122 122 ILE CB C 13 33.561 0.400 . 1 . . . A 493 ILE CB . 25043 1 1274 . 1 1 122 122 ILE CG1 C 13 24.398 0.400 . 1 . . . A 493 ILE CG1 . 25043 1 1275 . 1 1 122 122 ILE CG2 C 13 14.843 0.400 . 1 . . . A 493 ILE CG2 . 25043 1 1276 . 1 1 122 122 ILE CD1 C 13 8.639 0.400 . 1 . . . A 493 ILE CD1 . 25043 1 1277 . 1 1 122 122 ILE N N 15 126.524 0.400 . 1 . . . A 493 ILE N . 25043 1 1278 . 1 1 123 123 GLN H H 1 7.885 0.020 . 1 . . . A 494 GLN H . 25043 1 1279 . 1 1 123 123 GLN N N 15 122.534 0.400 . 1 . . . A 494 GLN N . 25043 1 1280 . 1 1 124 124 HIS HE1 H 1 8.212 0.020 . 1 . . . A 495 HIS HE1 . 25043 1 1281 . 1 1 124 124 HIS CE1 C 13 135.005 0.400 . 1 . . . A 495 HIS CE1 . 25043 1 1282 . 1 1 125 125 PRO HA H 1 1.442 0.020 . 1 . . . A 496 PRO HA . 25043 1 1283 . 1 1 125 125 PRO HB2 H 1 1.651 0.020 . 1 . . . A 496 PRO HB2 . 25043 1 1284 . 1 1 125 125 PRO HB3 H 1 1.500 0.020 . 1 . . . A 496 PRO HB3 . 25043 1 1285 . 1 1 125 125 PRO HG2 H 1 2.060 0.020 . 2 . . . A 496 PRO HG2 . 25043 1 1286 . 1 1 125 125 PRO HG3 H 1 2.060 0.020 . 2 . . . A 496 PRO HG3 . 25043 1 1287 . 1 1 125 125 PRO CA C 13 60.470 0.400 . 1 . . . A 496 PRO CA . 25043 1 1288 . 1 1 125 125 PRO CB C 13 29.552 0.400 . 1 . . . A 496 PRO CB . 25043 1 1289 . 1 1 125 125 PRO CG C 13 25.138 0.400 . 1 . . . A 496 PRO CG . 25043 1 1290 . 1 1 126 126 SER H H 1 6.528 0.020 . 1 . . . A 497 SER H . 25043 1 1291 . 1 1 126 126 SER HA H 1 4.806 0.020 . 1 . . . A 497 SER HA . 25043 1 1292 . 1 1 126 126 SER HB2 H 1 4.287 0.020 . 2 . . . A 497 SER HB2 . 25043 1 1293 . 1 1 126 126 SER HB3 H 1 3.970 0.020 . 2 . . . A 497 SER HB3 . 25043 1 1294 . 1 1 126 126 SER CA C 13 52.917 0.400 . 1 . . . A 497 SER CA . 25043 1 1295 . 1 1 126 126 SER CB C 13 63.073 0.400 . 1 . . . A 497 SER CB . 25043 1 1296 . 1 1 126 126 SER N N 15 117.874 0.400 . 1 . . . A 497 SER N . 25043 1 1297 . 1 1 127 127 ASN H H 1 8.635 0.020 . 1 . . . A 498 ASN H . 25043 1 1298 . 1 1 127 127 ASN HA H 1 4.262 0.020 . 1 . . . A 498 ASN HA . 25043 1 1299 . 1 1 127 127 ASN HB2 H 1 3.237 0.020 . 1 . . . A 498 ASN HB2 . 25043 1 1300 . 1 1 127 127 ASN HB3 H 1 2.310 0.020 . 1 . . . A 498 ASN HB3 . 25043 1 1301 . 1 1 127 127 ASN HD21 H 1 7.070 0.020 . 1 . . . A 498 ASN HD21 . 25043 1 1302 . 1 1 127 127 ASN HD22 H 1 8.053 0.020 . 1 . . . A 498 ASN HD22 . 25043 1 1303 . 1 1 127 127 ASN CA C 13 54.958 0.400 . 1 . . . A 498 ASN CA . 25043 1 1304 . 1 1 127 127 ASN CB C 13 34.003 0.400 . 1 . . . A 498 ASN CB . 25043 1 1305 . 1 1 127 127 ASN N N 15 114.589 0.400 . 1 . . . A 498 ASN N . 25043 1 1306 . 1 1 127 127 ASN ND2 N 15 115.031 0.400 . 1 . . . A 498 ASN ND2 . 25043 1 1307 . 1 1 128 128 VAL H H 1 8.309 0.020 . 1 . . . A 499 VAL H . 25043 1 1308 . 1 1 128 128 VAL HA H 1 5.287 0.020 . 1 . . . A 499 VAL HA . 25043 1 1309 . 1 1 128 128 VAL HB H 1 2.107 0.020 . 1 . . . A 499 VAL HB . 25043 1 1310 . 1 1 128 128 VAL HG11 H 1 0.928 0.020 . 2 . . . A 499 VAL HG11 . 25043 1 1311 . 1 1 128 128 VAL HG12 H 1 0.928 0.020 . 2 . . . A 499 VAL HG12 . 25043 1 1312 . 1 1 128 128 VAL HG13 H 1 0.928 0.020 . 2 . . . A 499 VAL HG13 . 25043 1 1313 . 1 1 128 128 VAL HG21 H 1 0.834 0.020 . 2 . . . A 499 VAL HG21 . 25043 1 1314 . 1 1 128 128 VAL HG22 H 1 0.834 0.020 . 2 . . . A 499 VAL HG22 . 25043 1 1315 . 1 1 128 128 VAL HG23 H 1 0.834 0.020 . 2 . . . A 499 VAL HG23 . 25043 1 1316 . 1 1 128 128 VAL CA C 13 58.438 0.400 . 1 . . . A 499 VAL CA . 25043 1 1317 . 1 1 128 128 VAL CB C 13 31.033 0.400 . 1 . . . A 499 VAL CB . 25043 1 1318 . 1 1 128 128 VAL CG1 C 13 20.153 0.400 . 1 . . . A 499 VAL CG1 . 25043 1 1319 . 1 1 128 128 VAL CG2 C 13 18.546 0.400 . 1 . . . A 499 VAL CG2 . 25043 1 1320 . 1 1 128 128 VAL N N 15 120.056 0.400 . 1 . . . A 499 VAL N . 25043 1 1321 . 1 1 129 129 LEU H H 1 9.818 0.020 . 1 . . . A 500 LEU H . 25043 1 1322 . 1 1 129 129 LEU HA H 1 5.436 0.020 . 1 . . . A 500 LEU HA . 25043 1 1323 . 1 1 129 129 LEU HB2 H 1 1.546 0.020 . 1 . . . A 500 LEU HB2 . 25043 1 1324 . 1 1 129 129 LEU HB3 H 1 2.000 0.020 . 1 . . . A 500 LEU HB3 . 25043 1 1325 . 1 1 129 129 LEU HD11 H 1 0.834 0.020 . 2 . . . A 500 LEU HD11 . 25043 1 1326 . 1 1 129 129 LEU HD12 H 1 0.834 0.020 . 2 . . . A 500 LEU HD12 . 25043 1 1327 . 1 1 129 129 LEU HD13 H 1 0.834 0.020 . 2 . . . A 500 LEU HD13 . 25043 1 1328 . 1 1 129 129 LEU HD21 H 1 0.646 0.020 . 2 . . . A 500 LEU HD21 . 25043 1 1329 . 1 1 129 129 LEU HD22 H 1 0.646 0.020 . 2 . . . A 500 LEU HD22 . 25043 1 1330 . 1 1 129 129 LEU HD23 H 1 0.646 0.020 . 2 . . . A 500 LEU HD23 . 25043 1 1331 . 1 1 129 129 LEU CA C 13 49.764 0.400 . 1 . . . A 500 LEU CA . 25043 1 1332 . 1 1 129 129 LEU CB C 13 41.133 0.400 . 1 . . . A 500 LEU CB . 25043 1 1333 . 1 1 129 129 LEU CD1 C 13 24.118 0.400 . 1 . . . A 500 LEU CD1 . 25043 1 1334 . 1 1 129 129 LEU CD2 C 13 21.800 0.400 . 1 . . . A 500 LEU CD2 . 25043 1 1335 . 1 1 129 129 LEU N N 15 123.711 0.400 . 1 . . . A 500 LEU N . 25043 1 1336 . 1 1 130 130 HIS H H 1 9.072 0.020 . 1 . . . A 501 HIS H . 25043 1 1337 . 1 1 130 130 HIS HA H 1 5.562 0.020 . 1 . . . A 501 HIS HA . 25043 1 1338 . 1 1 130 130 HIS HB2 H 1 3.328 0.020 . 1 . . . A 501 HIS HB2 . 25043 1 1339 . 1 1 130 130 HIS HB3 H 1 2.708 0.020 . 1 . . . A 501 HIS HB3 . 25043 1 1340 . 1 1 130 130 HIS HE1 H 1 7.867 0.020 . 1 . . . A 501 HIS HE1 . 25043 1 1341 . 1 1 130 130 HIS CA C 13 50.706 0.400 . 1 . . . A 501 HIS CA . 25043 1 1342 . 1 1 130 130 HIS CB C 13 28.170 0.400 . 1 . . . A 501 HIS CB . 25043 1 1343 . 1 1 130 130 HIS CE1 C 13 135.301 0.400 . 1 . . . A 501 HIS CE1 . 25043 1 1344 . 1 1 130 130 HIS N N 15 122.353 0.400 . 1 . . . A 501 HIS N . 25043 1 1345 . 1 1 131 131 PHE H H 1 9.339 0.020 . 1 . . . A 502 PHE H . 25043 1 1346 . 1 1 131 131 PHE HA H 1 6.037 0.020 . 1 . . . A 502 PHE HA . 25043 1 1347 . 1 1 131 131 PHE HB2 H 1 2.982 0.020 . 1 . . . A 502 PHE HB2 . 25043 1 1348 . 1 1 131 131 PHE HB3 H 1 2.327 0.020 . 1 . . . A 502 PHE HB3 . 25043 1 1349 . 1 1 131 131 PHE HD1 H 1 6.523 0.020 . 1 . . . A 502 PHE HD1 . 25043 1 1350 . 1 1 131 131 PHE HD2 H 1 6.523 0.020 . 1 . . . A 502 PHE HD2 . 25043 1 1351 . 1 1 131 131 PHE HE1 H 1 6.800 0.020 . 1 . . . A 502 PHE HE1 . 25043 1 1352 . 1 1 131 131 PHE HE2 H 1 6.800 0.020 . 1 . . . A 502 PHE HE2 . 25043 1 1353 . 1 1 131 131 PHE HZ H 1 6.905 0.020 . 1 . . . A 502 PHE HZ . 25043 1 1354 . 1 1 131 131 PHE CA C 13 50.713 0.400 . 1 . . . A 502 PHE CA . 25043 1 1355 . 1 1 131 131 PHE CB C 13 40.946 0.400 . 1 . . . A 502 PHE CB . 25043 1 1356 . 1 1 131 131 PHE CD1 C 13 129.166 0.400 . 1 . . . A 502 PHE CD1 . 25043 1 1357 . 1 1 131 131 PHE CE1 C 13 128.281 0.400 . 1 . . . A 502 PHE CE1 . 25043 1 1358 . 1 1 131 131 PHE CZ C 13 126.938 0.400 . 1 . . . A 502 PHE CZ . 25043 1 1359 . 1 1 131 131 PHE N N 15 121.601 0.400 . 1 . . . A 502 PHE N . 25043 1 1360 . 1 1 132 132 PHE H H 1 8.909 0.020 . 1 . . . A 503 PHE H . 25043 1 1361 . 1 1 132 132 PHE HA H 1 4.885 0.020 . 1 . . . A 503 PHE HA . 25043 1 1362 . 1 1 132 132 PHE HB2 H 1 2.999 0.020 . 2 . . . A 503 PHE HB2 . 25043 1 1363 . 1 1 132 132 PHE HB3 H 1 2.967 0.020 . 2 . . . A 503 PHE HB3 . 25043 1 1364 . 1 1 132 132 PHE HD1 H 1 6.546 0.020 . 1 . . . A 503 PHE HD1 . 25043 1 1365 . 1 1 132 132 PHE HD2 H 1 6.546 0.020 . 1 . . . A 503 PHE HD2 . 25043 1 1366 . 1 1 132 132 PHE CA C 13 52.748 0.400 . 1 . . . A 503 PHE CA . 25043 1 1367 . 1 1 132 132 PHE CB C 13 36.146 0.400 . 1 . . . A 503 PHE CB . 25043 1 1368 . 1 1 132 132 PHE N N 15 115.735 0.400 . 1 . . . A 503 PHE N . 25043 1 1369 . 1 1 133 133 ASN H H 1 9.407 0.020 . 1 . . . A 504 ASN H . 25043 1 1370 . 1 1 133 133 ASN HA H 1 4.214 0.020 . 1 . . . A 504 ASN HA . 25043 1 1371 . 1 1 133 133 ASN HB2 H 1 1.979 0.020 . 1 . . . A 504 ASN HB2 . 25043 1 1372 . 1 1 133 133 ASN HB3 H 1 3.702 0.020 . 1 . . . A 504 ASN HB3 . 25043 1 1373 . 1 1 133 133 ASN CA C 13 52.092 0.400 . 1 . . . A 504 ASN CA . 25043 1 1374 . 1 1 133 133 ASN CB C 13 37.130 0.400 . 1 . . . A 504 ASN CB . 25043 1 1375 . 1 1 133 133 ASN N N 15 116.592 0.400 . 1 . . . A 504 ASN N . 25043 1 1376 . 1 1 134 134 ALA H H 1 7.506 0.020 . 1 . . . A 505 ALA H . 25043 1 1377 . 1 1 134 134 ALA HA H 1 4.551 0.020 . 1 . . . A 505 ALA HA . 25043 1 1378 . 1 1 134 134 ALA HB1 H 1 1.204 0.020 . 1 . . . A 505 ALA HB1 . 25043 1 1379 . 1 1 134 134 ALA HB2 H 1 1.204 0.020 . 1 . . . A 505 ALA HB2 . 25043 1 1380 . 1 1 134 134 ALA HB3 H 1 1.204 0.020 . 1 . . . A 505 ALA HB3 . 25043 1 1381 . 1 1 134 134 ALA CA C 13 46.111 0.400 . 1 . . . A 505 ALA CA . 25043 1 1382 . 1 1 134 134 ALA CB C 13 15.838 0.400 . 1 . . . A 505 ALA CB . 25043 1 1383 . 1 1 134 134 ALA N N 15 114.549 0.400 . 1 . . . A 505 ALA N . 25043 1 1384 . 1 1 135 135 PRO HA H 1 2.780 0.020 . 1 . . . A 506 PRO HA . 25043 1 1385 . 1 1 135 135 PRO HB2 H 1 1.846 0.020 . 1 . . . A 506 PRO HB2 . 25043 1 1386 . 1 1 135 135 PRO HB3 H 1 1.457 0.020 . 1 . . . A 506 PRO HB3 . 25043 1 1387 . 1 1 135 135 PRO HD2 H 1 3.061 0.020 . 2 . . . A 506 PRO HD2 . 25043 1 1388 . 1 1 135 135 PRO HD3 H 1 3.061 0.020 . 2 . . . A 506 PRO HD3 . 25043 1 1389 . 1 1 135 135 PRO CA C 13 59.346 0.400 . 1 . . . A 506 PRO CA . 25043 1 1390 . 1 1 135 135 PRO CB C 13 28.522 0.400 . 1 . . . A 506 PRO CB . 25043 1 1391 . 1 1 135 135 PRO CD C 13 47.721 0.400 . 1 . . . A 506 PRO CD . 25043 1 1392 . 1 1 136 136 LEU H H 1 7.780 0.020 . 1 . . . A 507 LEU H . 25043 1 1393 . 1 1 136 136 LEU HB2 H 1 1.503 0.020 . 2 . . . A 507 LEU HB2 . 25043 1 1394 . 1 1 136 136 LEU HB3 H 1 1.503 0.020 . 2 . . . A 507 LEU HB3 . 25043 1 1395 . 1 1 136 136 LEU HG H 1 1.481 0.020 . 1 . . . A 507 LEU HG . 25043 1 1396 . 1 1 136 136 LEU HD11 H 1 0.917 0.020 . 2 . . . A 507 LEU HD11 . 25043 1 1397 . 1 1 136 136 LEU HD12 H 1 0.917 0.020 . 2 . . . A 507 LEU HD12 . 25043 1 1398 . 1 1 136 136 LEU HD13 H 1 0.917 0.020 . 2 . . . A 507 LEU HD13 . 25043 1 1399 . 1 1 136 136 LEU HD21 H 1 0.819 0.020 . 2 . . . A 507 LEU HD21 . 25043 1 1400 . 1 1 136 136 LEU HD22 H 1 0.819 0.020 . 2 . . . A 507 LEU HD22 . 25043 1 1401 . 1 1 136 136 LEU HD23 H 1 0.819 0.020 . 2 . . . A 507 LEU HD23 . 25043 1 1402 . 1 1 136 136 LEU CB C 13 39.813 0.400 . 1 . . . A 507 LEU CB . 25043 1 1403 . 1 1 136 136 LEU CG C 13 24.538 0.400 . 1 . . . A 507 LEU CG . 25043 1 1404 . 1 1 136 136 LEU CD1 C 13 21.956 0.400 . 1 . . . A 507 LEU CD1 . 25043 1 1405 . 1 1 136 136 LEU CD2 C 13 21.252 0.400 . 1 . . . A 507 LEU CD2 . 25043 1 1406 . 1 1 136 136 LEU N N 15 122.513 0.400 . 1 . . . A 507 LEU N . 25043 1 1407 . 1 1 137 137 GLU H H 1 8.448 0.020 . 1 . . . A 508 GLU H . 25043 1 1408 . 1 1 137 137 GLU HA H 1 4.103 0.020 . 1 . . . A 508 GLU HA . 25043 1 1409 . 1 1 137 137 GLU HB2 H 1 2.166 0.020 . 2 . . . A 508 GLU HB2 . 25043 1 1410 . 1 1 137 137 GLU HB3 H 1 1.974 0.020 . 2 . . . A 508 GLU HB3 . 25043 1 1411 . 1 1 137 137 GLU HG2 H 1 2.194 0.020 . 2 . . . A 508 GLU HG2 . 25043 1 1412 . 1 1 137 137 GLU HG3 H 1 2.164 0.020 . 2 . . . A 508 GLU HG3 . 25043 1 1413 . 1 1 137 137 GLU CA C 13 53.754 0.400 . 1 . . . A 508 GLU CA . 25043 1 1414 . 1 1 137 137 GLU CB C 13 24.681 0.400 . 1 . . . A 508 GLU CB . 25043 1 1415 . 1 1 137 137 GLU CG C 13 33.715 0.400 . 1 . . . A 508 GLU CG . 25043 1 1416 . 1 1 137 137 GLU N N 15 113.644 0.400 . 1 . . . A 508 GLU N . 25043 1 1417 . 1 1 138 138 VAL H H 1 6.831 0.020 . 1 . . . A 509 VAL H . 25043 1 1418 . 1 1 138 138 VAL HA H 1 4.050 0.020 . 1 . . . A 509 VAL HA . 25043 1 1419 . 1 1 138 138 VAL HB H 1 1.849 0.020 . 1 . . . A 509 VAL HB . 25043 1 1420 . 1 1 138 138 VAL HG11 H 1 0.722 0.020 . 2 . . . A 509 VAL HG11 . 25043 1 1421 . 1 1 138 138 VAL HG12 H 1 0.722 0.020 . 2 . . . A 509 VAL HG12 . 25043 1 1422 . 1 1 138 138 VAL HG13 H 1 0.722 0.020 . 2 . . . A 509 VAL HG13 . 25043 1 1423 . 1 1 138 138 VAL HG21 H 1 0.607 0.020 . 2 . . . A 509 VAL HG21 . 25043 1 1424 . 1 1 138 138 VAL HG22 H 1 0.607 0.020 . 2 . . . A 509 VAL HG22 . 25043 1 1425 . 1 1 138 138 VAL HG23 H 1 0.607 0.020 . 2 . . . A 509 VAL HG23 . 25043 1 1426 . 1 1 138 138 VAL CA C 13 58.837 0.400 . 1 . . . A 509 VAL CA . 25043 1 1427 . 1 1 138 138 VAL CB C 13 29.907 0.400 . 1 . . . A 509 VAL CB . 25043 1 1428 . 1 1 138 138 VAL CG1 C 13 18.478 0.400 . 1 . . . A 509 VAL CG1 . 25043 1 1429 . 1 1 138 138 VAL CG2 C 13 19.199 0.400 . 1 . . . A 509 VAL CG2 . 25043 1 1430 . 1 1 138 138 VAL N N 15 117.551 0.400 . 1 . . . A 509 VAL N . 25043 1 1431 . 1 1 139 139 THR H H 1 8.091 0.020 . 1 . . . A 510 THR H . 25043 1 1432 . 1 1 139 139 THR HA H 1 4.731 0.020 . 1 . . . A 510 THR HA . 25043 1 1433 . 1 1 139 139 THR HB H 1 4.541 0.020 . 1 . . . A 510 THR HB . 25043 1 1434 . 1 1 139 139 THR HG21 H 1 1.229 0.020 . 1 . . . A 510 THR HG21 . 25043 1 1435 . 1 1 139 139 THR HG22 H 1 1.229 0.020 . 1 . . . A 510 THR HG22 . 25043 1 1436 . 1 1 139 139 THR HG23 H 1 1.229 0.020 . 1 . . . A 510 THR HG23 . 25043 1 1437 . 1 1 139 139 THR CA C 13 56.322 0.400 . 1 . . . A 510 THR CA . 25043 1 1438 . 1 1 139 139 THR CB C 13 70.426 0.400 . 1 . . . A 510 THR CB . 25043 1 1439 . 1 1 139 139 THR CG2 C 13 18.717 0.400 . 1 . . . A 510 THR CG2 . 25043 1 1440 . 1 1 139 139 THR N N 15 113.312 0.400 . 1 . . . A 510 THR N . 25043 1 1441 . 1 1 140 140 GLU H H 1 9.141 0.020 . 1 . . . A 511 GLU H . 25043 1 1442 . 1 1 140 140 GLU HA H 1 3.702 0.020 . 1 . . . A 511 GLU HA . 25043 1 1443 . 1 1 140 140 GLU HB2 H 1 1.791 0.020 . 2 . . . A 511 GLU HB2 . 25043 1 1444 . 1 1 140 140 GLU HB3 H 1 1.597 0.020 . 2 . . . A 511 GLU HB3 . 25043 1 1445 . 1 1 140 140 GLU HG2 H 1 1.850 0.020 . 2 . . . A 511 GLU HG2 . 25043 1 1446 . 1 1 140 140 GLU HG3 H 1 1.791 0.020 . 2 . . . A 511 GLU HG3 . 25043 1 1447 . 1 1 140 140 GLU CA C 13 57.227 0.400 . 1 . . . A 511 GLU CA . 25043 1 1448 . 1 1 140 140 GLU CB C 13 26.043 0.400 . 1 . . . A 511 GLU CB . 25043 1 1449 . 1 1 140 140 GLU CG C 13 32.687 0.400 . 1 . . . A 511 GLU CG . 25043 1 1450 . 1 1 140 140 GLU N N 15 118.957 0.400 . 1 . . . A 511 GLU N . 25043 1 1451 . 1 1 141 141 GLU H H 1 8.092 0.020 . 1 . . . A 512 GLU H . 25043 1 1452 . 1 1 141 141 GLU HA H 1 3.755 0.020 . 1 . . . A 512 GLU HA . 25043 1 1453 . 1 1 141 141 GLU HB2 H 1 1.951 0.020 . 2 . . . A 512 GLU HB2 . 25043 1 1454 . 1 1 141 141 GLU HB3 H 1 1.951 0.020 . 2 . . . A 512 GLU HB3 . 25043 1 1455 . 1 1 141 141 GLU HG2 H 1 2.419 0.020 . 1 . . . A 512 GLU HG2 . 25043 1 1456 . 1 1 141 141 GLU HG3 H 1 2.353 0.020 . 1 . . . A 512 GLU HG3 . 25043 1 1457 . 1 1 141 141 GLU CA C 13 57.042 0.400 . 1 . . . A 512 GLU CA . 25043 1 1458 . 1 1 141 141 GLU CB C 13 26.074 0.400 . 1 . . . A 512 GLU CB . 25043 1 1459 . 1 1 141 141 GLU CG C 13 33.658 0.400 . 1 . . . A 512 GLU CG . 25043 1 1460 . 1 1 141 141 GLU N N 15 117.198 0.400 . 1 . . . A 512 GLU N . 25043 1 1461 . 1 1 142 142 ASN H H 1 7.601 0.020 . 1 . . . A 513 ASN H . 25043 1 1462 . 1 1 142 142 ASN HA H 1 4.441 0.020 . 1 . . . A 513 ASN HA . 25043 1 1463 . 1 1 142 142 ASN HB2 H 1 2.416 0.020 . 2 . . . A 513 ASN HB2 . 25043 1 1464 . 1 1 142 142 ASN HB3 H 1 2.323 0.020 . 2 . . . A 513 ASN HB3 . 25043 1 1465 . 1 1 142 142 ASN HD21 H 1 7.599 0.020 . 1 . . . A 513 ASN HD21 . 25043 1 1466 . 1 1 142 142 ASN HD22 H 1 6.954 0.020 . 1 . . . A 513 ASN HD22 . 25043 1 1467 . 1 1 142 142 ASN CA C 13 53.991 0.400 . 1 . . . A 513 ASN CA . 25043 1 1468 . 1 1 142 142 ASN CB C 13 36.015 0.400 . 1 . . . A 513 ASN CB . 25043 1 1469 . 1 1 142 142 ASN N N 15 115.829 0.400 . 1 . . . A 513 ASN N . 25043 1 1470 . 1 1 142 142 ASN ND2 N 15 109.692 0.400 . 1 . . . A 513 ASN ND2 . 25043 1 1471 . 1 1 143 143 PHE H H 1 6.999 0.020 . 1 . . . A 514 PHE H . 25043 1 1472 . 1 1 143 143 PHE HA H 1 4.071 0.020 . 1 . . . A 514 PHE HA . 25043 1 1473 . 1 1 143 143 PHE HB2 H 1 2.710 0.020 . 1 . . . A 514 PHE HB2 . 25043 1 1474 . 1 1 143 143 PHE HB3 H 1 2.630 0.020 . 1 . . . A 514 PHE HB3 . 25043 1 1475 . 1 1 143 143 PHE HD1 H 1 6.717 0.020 . 1 . . . A 514 PHE HD1 . 25043 1 1476 . 1 1 143 143 PHE HD2 H 1 6.717 0.020 . 1 . . . A 514 PHE HD2 . 25043 1 1477 . 1 1 143 143 PHE HE1 H 1 6.385 0.020 . 1 . . . A 514 PHE HE1 . 25043 1 1478 . 1 1 143 143 PHE HE2 H 1 6.385 0.020 . 1 . . . A 514 PHE HE2 . 25043 1 1479 . 1 1 143 143 PHE HZ H 1 5.317 0.020 . 1 . . . A 514 PHE HZ . 25043 1 1480 . 1 1 143 143 PHE CA C 13 59.714 0.400 . 1 . . . A 514 PHE CA . 25043 1 1481 . 1 1 143 143 PHE CB C 13 35.641 0.400 . 1 . . . A 514 PHE CB . 25043 1 1482 . 1 1 143 143 PHE CD1 C 13 127.775 0.400 . 1 . . . A 514 PHE CD1 . 25043 1 1483 . 1 1 143 143 PHE CE1 C 13 128.029 0.400 . 1 . . . A 514 PHE CE1 . 25043 1 1484 . 1 1 143 143 PHE CZ C 13 125.719 0.400 . 1 . . . A 514 PHE CZ . 25043 1 1485 . 1 1 143 143 PHE N N 15 114.893 0.400 . 1 . . . A 514 PHE N . 25043 1 1486 . 1 1 144 144 PHE H H 1 8.467 0.020 . 1 . . . A 515 PHE H . 25043 1 1487 . 1 1 144 144 PHE HA H 1 4.421 0.020 . 1 . . . A 515 PHE HA . 25043 1 1488 . 1 1 144 144 PHE HB2 H 1 3.138 0.020 . 1 . . . A 515 PHE HB2 . 25043 1 1489 . 1 1 144 144 PHE HB3 H 1 3.430 0.020 . 1 . . . A 515 PHE HB3 . 25043 1 1490 . 1 1 144 144 PHE HD1 H 1 7.021 0.020 . 1 . . . A 515 PHE HD1 . 25043 1 1491 . 1 1 144 144 PHE HD2 H 1 7.021 0.020 . 1 . . . A 515 PHE HD2 . 25043 1 1492 . 1 1 144 144 PHE HE1 H 1 7.299 0.020 . 1 . . . A 515 PHE HE1 . 25043 1 1493 . 1 1 144 144 PHE HE2 H 1 7.299 0.020 . 1 . . . A 515 PHE HE2 . 25043 1 1494 . 1 1 144 144 PHE CA C 13 55.540 0.400 . 1 . . . A 515 PHE CA . 25043 1 1495 . 1 1 144 144 PHE CB C 13 33.174 0.400 . 1 . . . A 515 PHE CB . 25043 1 1496 . 1 1 144 144 PHE CD2 C 13 126.486 0.400 . 1 . . . A 515 PHE CD2 . 25043 1 1497 . 1 1 144 144 PHE CE2 C 13 128.987 0.400 . 1 . . . A 515 PHE CE2 . 25043 1 1498 . 1 1 144 144 PHE N N 15 120.565 0.400 . 1 . . . A 515 PHE N . 25043 1 1499 . 1 1 145 145 GLU H H 1 8.088 0.020 . 1 . . . A 516 GLU H . 25043 1 1500 . 1 1 145 145 GLU HA H 1 4.140 0.020 . 1 . . . A 516 GLU HA . 25043 1 1501 . 1 1 145 145 GLU HB2 H 1 2.210 0.020 . 1 . . . A 516 GLU HB2 . 25043 1 1502 . 1 1 145 145 GLU HB3 H 1 2.105 0.020 . 1 . . . A 516 GLU HB3 . 25043 1 1503 . 1 1 145 145 GLU HG2 H 1 2.516 0.020 . 1 . . . A 516 GLU HG2 . 25043 1 1504 . 1 1 145 145 GLU HG3 H 1 2.359 0.020 . 1 . . . A 516 GLU HG3 . 25043 1 1505 . 1 1 145 145 GLU CA C 13 56.814 0.400 . 1 . . . A 516 GLU CA . 25043 1 1506 . 1 1 145 145 GLU CB C 13 26.774 0.400 . 1 . . . A 516 GLU CB . 25043 1 1507 . 1 1 145 145 GLU CG C 13 33.220 0.400 . 1 . . . A 516 GLU CG . 25043 1 1508 . 1 1 145 145 GLU N N 15 117.051 0.400 . 1 . . . A 516 GLU N . 25043 1 1509 . 1 1 146 146 ILE H H 1 7.357 0.020 . 1 . . . A 517 ILE H . 25043 1 1510 . 1 1 146 146 ILE HA H 1 3.812 0.020 . 1 . . . A 517 ILE HA . 25043 1 1511 . 1 1 146 146 ILE HB H 1 1.455 0.020 . 1 . . . A 517 ILE HB . 25043 1 1512 . 1 1 146 146 ILE HG12 H 1 1.636 0.020 . 1 . . . A 517 ILE HG12 . 25043 1 1513 . 1 1 146 146 ILE HG13 H 1 1.040 0.020 . 1 . . . A 517 ILE HG13 . 25043 1 1514 . 1 1 146 146 ILE HG21 H 1 0.339 0.020 . 1 . . . A 517 ILE HG21 . 25043 1 1515 . 1 1 146 146 ILE HG22 H 1 0.339 0.020 . 1 . . . A 517 ILE HG22 . 25043 1 1516 . 1 1 146 146 ILE HG23 H 1 0.339 0.020 . 1 . . . A 517 ILE HG23 . 25043 1 1517 . 1 1 146 146 ILE HD11 H 1 0.528 0.020 . 1 . . . A 517 ILE HD11 . 25043 1 1518 . 1 1 146 146 ILE HD12 H 1 0.528 0.020 . 1 . . . A 517 ILE HD12 . 25043 1 1519 . 1 1 146 146 ILE HD13 H 1 0.528 0.020 . 1 . . . A 517 ILE HD13 . 25043 1 1520 . 1 1 146 146 ILE CA C 13 62.369 0.400 . 1 . . . A 517 ILE CA . 25043 1 1521 . 1 1 146 146 ILE CB C 13 35.409 0.400 . 1 . . . A 517 ILE CB . 25043 1 1522 . 1 1 146 146 ILE CG1 C 13 24.705 0.400 . 1 . . . A 517 ILE CG1 . 25043 1 1523 . 1 1 146 146 ILE CG2 C 13 14.919 0.400 . 1 . . . A 517 ILE CG2 . 25043 1 1524 . 1 1 146 146 ILE CD1 C 13 11.914 0.400 . 1 . . . A 517 ILE CD1 . 25043 1 1525 . 1 1 146 146 ILE N N 15 118.214 0.400 . 1 . . . A 517 ILE N . 25043 1 1526 . 1 1 147 147 CYS H H 1 8.133 0.020 . 1 . . . A 518 CYS H . 25043 1 1527 . 1 1 147 147 CYS HA H 1 4.045 0.020 . 1 . . . A 518 CYS HA . 25043 1 1528 . 1 1 147 147 CYS HB2 H 1 3.115 0.020 . 2 . . . A 518 CYS HB2 . 25043 1 1529 . 1 1 147 147 CYS HB3 H 1 2.952 0.020 . 2 . . . A 518 CYS HB3 . 25043 1 1530 . 1 1 147 147 CYS CA C 13 62.385 0.400 . 1 . . . A 518 CYS CA . 25043 1 1531 . 1 1 147 147 CYS CB C 13 22.963 0.400 . 1 . . . A 518 CYS CB . 25043 1 1532 . 1 1 147 147 CYS N N 15 118.416 0.400 . 1 . . . A 518 CYS N . 25043 1 1533 . 1 1 148 148 ASP H H 1 8.396 0.020 . 1 . . . A 519 ASP H . 25043 1 1534 . 1 1 148 148 ASP HA H 1 4.397 0.020 . 1 . . . A 519 ASP HA . 25043 1 1535 . 1 1 148 148 ASP HB2 H 1 2.726 0.020 . 2 . . . A 519 ASP HB2 . 25043 1 1536 . 1 1 148 148 ASP HB3 H 1 2.924 0.020 . 2 . . . A 519 ASP HB3 . 25043 1 1537 . 1 1 148 148 ASP CA C 13 54.221 0.400 . 1 . . . A 519 ASP CA . 25043 1 1538 . 1 1 148 148 ASP CB C 13 36.785 0.400 . 1 . . . A 519 ASP CB . 25043 1 1539 . 1 1 148 148 ASP N N 15 119.278 0.400 . 1 . . . A 519 ASP N . 25043 1 1540 . 1 1 149 149 GLU H H 1 7.987 0.020 . 1 . . . A 520 GLU H . 25043 1 1541 . 1 1 149 149 GLU HA H 1 4.138 0.020 . 1 . . . A 520 GLU HA . 25043 1 1542 . 1 1 149 149 GLU HB2 H 1 2.371 0.020 . 2 . . . A 520 GLU HB2 . 25043 1 1543 . 1 1 149 149 GLU HB3 H 1 2.306 0.020 . 2 . . . A 520 GLU HB3 . 25043 1 1544 . 1 1 149 149 GLU HG2 H 1 2.517 0.020 . 2 . . . A 520 GLU HG2 . 25043 1 1545 . 1 1 149 149 GLU HG3 H 1 2.279 0.020 . 2 . . . A 520 GLU HG3 . 25043 1 1546 . 1 1 149 149 GLU CA C 13 56.802 0.400 . 1 . . . A 520 GLU CA . 25043 1 1547 . 1 1 149 149 GLU CB C 13 27.065 0.400 . 1 . . . A 520 GLU CB . 25043 1 1548 . 1 1 149 149 GLU CG C 13 33.196 0.400 . 1 . . . A 520 GLU CG . 25043 1 1549 . 1 1 149 149 GLU N N 15 121.513 0.400 . 1 . . . A 520 GLU N . 25043 1 1550 . 1 1 150 150 LEU H H 1 7.990 0.020 . 1 . . . A 521 LEU H . 25043 1 1551 . 1 1 150 150 LEU HA H 1 4.406 0.020 . 1 . . . A 521 LEU HA . 25043 1 1552 . 1 1 150 150 LEU HB2 H 1 1.901 0.020 . 2 . . . A 521 LEU HB2 . 25043 1 1553 . 1 1 150 150 LEU HB3 H 1 1.749 0.020 . 2 . . . A 521 LEU HB3 . 25043 1 1554 . 1 1 150 150 LEU HG H 1 2.005 0.020 . 1 . . . A 521 LEU HG . 25043 1 1555 . 1 1 150 150 LEU HD11 H 1 1.151 0.020 . 2 . . . A 521 LEU HD11 . 25043 1 1556 . 1 1 150 150 LEU HD12 H 1 1.151 0.020 . 2 . . . A 521 LEU HD12 . 25043 1 1557 . 1 1 150 150 LEU HD13 H 1 1.151 0.020 . 2 . . . A 521 LEU HD13 . 25043 1 1558 . 1 1 150 150 LEU HD21 H 1 0.912 0.020 . 2 . . . A 521 LEU HD21 . 25043 1 1559 . 1 1 150 150 LEU HD22 H 1 0.912 0.020 . 2 . . . A 521 LEU HD22 . 25043 1 1560 . 1 1 150 150 LEU HD23 H 1 0.912 0.020 . 2 . . . A 521 LEU HD23 . 25043 1 1561 . 1 1 150 150 LEU CA C 13 52.504 0.400 . 1 . . . A 521 LEU CA . 25043 1 1562 . 1 1 150 150 LEU CB C 13 41.071 0.400 . 1 . . . A 521 LEU CB . 25043 1 1563 . 1 1 150 150 LEU CG C 13 24.360 0.400 . 1 . . . A 521 LEU CG . 25043 1 1564 . 1 1 150 150 LEU CD1 C 13 20.163 0.400 . 1 . . . A 521 LEU CD1 . 25043 1 1565 . 1 1 150 150 LEU CD2 C 13 23.952 0.400 . 1 . . . A 521 LEU CD2 . 25043 1 1566 . 1 1 150 150 LEU N N 15 116.915 0.400 . 1 . . . A 521 LEU N . 25043 1 1567 . 1 1 151 151 GLY H H 1 7.999 0.020 . 1 . . . A 522 GLY H . 25043 1 1568 . 1 1 151 151 GLY HA2 H 1 4.056 0.020 . 2 . . . A 522 GLY HA2 . 25043 1 1569 . 1 1 151 151 GLY HA3 H 1 3.901 0.020 . 2 . . . A 522 GLY HA3 . 25043 1 1570 . 1 1 151 151 GLY CA C 13 43.488 0.400 . 1 . . . A 522 GLY CA . 25043 1 1571 . 1 1 151 151 GLY N N 15 107.938 0.400 . 1 . . . A 522 GLY N . 25043 1 1572 . 1 1 152 152 VAL H H 1 7.828 0.020 . 1 . . . A 523 VAL H . 25043 1 1573 . 1 1 152 152 VAL HA H 1 4.515 0.020 . 1 . . . A 523 VAL HA . 25043 1 1574 . 1 1 152 152 VAL HB H 1 2.353 0.020 . 1 . . . A 523 VAL HB . 25043 1 1575 . 1 1 152 152 VAL HG11 H 1 0.899 0.020 . 2 . . . A 523 VAL HG11 . 25043 1 1576 . 1 1 152 152 VAL HG12 H 1 0.899 0.020 . 2 . . . A 523 VAL HG12 . 25043 1 1577 . 1 1 152 152 VAL HG13 H 1 0.899 0.020 . 2 . . . A 523 VAL HG13 . 25043 1 1578 . 1 1 152 152 VAL HG21 H 1 0.572 0.020 . 2 . . . A 523 VAL HG21 . 25043 1 1579 . 1 1 152 152 VAL HG22 H 1 0.572 0.020 . 2 . . . A 523 VAL HG22 . 25043 1 1580 . 1 1 152 152 VAL HG23 H 1 0.572 0.020 . 2 . . . A 523 VAL HG23 . 25043 1 1581 . 1 1 152 152 VAL CA C 13 56.010 0.400 . 1 . . . A 523 VAL CA . 25043 1 1582 . 1 1 152 152 VAL CB C 13 30.420 0.400 . 1 . . . A 523 VAL CB . 25043 1 1583 . 1 1 152 152 VAL CG1 C 13 17.098 0.400 . 1 . . . A 523 VAL CG1 . 25043 1 1584 . 1 1 152 152 VAL CG2 C 13 19.430 0.400 . 1 . . . A 523 VAL CG2 . 25043 1 1585 . 1 1 152 152 VAL N N 15 113.411 0.400 . 1 . . . A 523 VAL N . 25043 1 1586 . 1 1 153 153 LYS H H 1 8.294 0.020 . 1 . . . A 524 LYS H . 25043 1 1587 . 1 1 153 153 LYS HA H 1 4.088 0.020 . 1 . . . A 524 LYS HA . 25043 1 1588 . 1 1 153 153 LYS HB2 H 1 1.933 0.020 . 2 . . . A 524 LYS HB2 . 25043 1 1589 . 1 1 153 153 LYS HB3 H 1 1.775 0.020 . 2 . . . A 524 LYS HB3 . 25043 1 1590 . 1 1 153 153 LYS HG2 H 1 1.651 0.020 . 2 . . . A 524 LYS HG2 . 25043 1 1591 . 1 1 153 153 LYS HG3 H 1 1.651 0.020 . 2 . . . A 524 LYS HG3 . 25043 1 1592 . 1 1 153 153 LYS HD2 H 1 1.806 0.020 . 2 . . . A 524 LYS HD2 . 25043 1 1593 . 1 1 153 153 LYS HD3 H 1 1.688 0.020 . 2 . . . A 524 LYS HD3 . 25043 1 1594 . 1 1 153 153 LYS HE2 H 1 3.098 0.020 . 2 . . . A 524 LYS HE2 . 25043 1 1595 . 1 1 153 153 LYS HE3 H 1 3.098 0.020 . 2 . . . A 524 LYS HE3 . 25043 1 1596 . 1 1 153 153 LYS CA C 13 54.313 0.400 . 1 . . . A 524 LYS CA . 25043 1 1597 . 1 1 153 153 LYS CB C 13 30.407 0.400 . 1 . . . A 524 LYS CB . 25043 1 1598 . 1 1 153 153 LYS CG C 13 22.582 0.400 . 1 . . . A 524 LYS CG . 25043 1 1599 . 1 1 153 153 LYS CD C 13 26.868 0.400 . 1 . . . A 524 LYS CD . 25043 1 1600 . 1 1 153 153 LYS CE C 13 39.392 0.400 . 1 . . . A 524 LYS CE . 25043 1 1601 . 1 1 153 153 LYS N N 15 121.774 0.400 . 1 . . . A 524 LYS N . 25043 1 1602 . 1 1 154 154 ARG H H 1 8.431 0.020 . 1 . . . A 525 ARG H . 25043 1 1603 . 1 1 154 154 ARG HA H 1 4.584 0.020 . 1 . . . A 525 ARG HA . 25043 1 1604 . 1 1 154 154 ARG HD2 H 1 2.746 0.020 . 2 . . . A 525 ARG HD2 . 25043 1 1605 . 1 1 154 154 ARG HD3 H 1 2.075 0.020 . 2 . . . A 525 ARG HD3 . 25043 1 1606 . 1 1 154 154 ARG HE H 1 7.991 0.020 . 1 . . . A 525 ARG HE . 25043 1 1607 . 1 1 154 154 ARG HH11 H 1 6.468 0.020 . 2 . . . A 525 ARG HH11 . 25043 1 1608 . 1 1 154 154 ARG HH12 H 1 6.468 0.020 . 2 . . . A 525 ARG HH12 . 25043 1 1609 . 1 1 154 154 ARG CA C 13 52.812 0.400 . 1 . . . A 525 ARG CA . 25043 1 1610 . 1 1 154 154 ARG CD C 13 41.205 0.400 . 1 . . . A 525 ARG CD . 25043 1 1611 . 1 1 154 154 ARG N N 15 123.332 0.400 . 1 . . . A 525 ARG N . 25043 1 1612 . 1 1 154 154 ARG NE N 15 117.630 0.400 . 1 . . . A 525 ARG NE . 25043 1 1613 . 1 1 154 154 ARG NH1 N 15 104.697 0.400 . 1 . . . A 525 ARG NH1 . 25043 1 1614 . 1 1 155 155 PRO HA H 1 2.710 0.020 . 1 . . . A 526 PRO HA . 25043 1 1615 . 1 1 155 155 PRO HB2 H 1 1.366 0.020 . 1 . . . A 526 PRO HB2 . 25043 1 1616 . 1 1 155 155 PRO HB3 H 1 0.460 0.020 . 1 . . . A 526 PRO HB3 . 25043 1 1617 . 1 1 155 155 PRO HG2 H 1 1.619 0.020 . 2 . . . A 526 PRO HG2 . 25043 1 1618 . 1 1 155 155 PRO HG3 H 1 1.619 0.020 . 2 . . . A 526 PRO HG3 . 25043 1 1619 . 1 1 155 155 PRO HD2 H 1 3.957 0.020 . 2 . . . A 526 PRO HD2 . 25043 1 1620 . 1 1 155 155 PRO HD3 H 1 3.957 0.020 . 2 . . . A 526 PRO HD3 . 25043 1 1621 . 1 1 155 155 PRO CA C 13 59.026 0.400 . 1 . . . A 526 PRO CA . 25043 1 1622 . 1 1 155 155 PRO CB C 13 27.796 0.400 . 1 . . . A 526 PRO CB . 25043 1 1623 . 1 1 155 155 PRO CG C 13 23.847 0.400 . 1 . . . A 526 PRO CG . 25043 1 1624 . 1 1 155 155 PRO CD C 13 47.820 0.400 . 1 . . . A 526 PRO CD . 25043 1 1625 . 1 1 156 156 THR H H 1 8.874 0.020 . 1 . . . A 527 THR H . 25043 1 1626 . 1 1 156 156 THR HA H 1 3.959 0.020 . 1 . . . A 527 THR HA . 25043 1 1627 . 1 1 156 156 THR HB H 1 4.064 0.020 . 1 . . . A 527 THR HB . 25043 1 1628 . 1 1 156 156 THR HG21 H 1 1.240 0.020 . 1 . . . A 527 THR HG21 . 25043 1 1629 . 1 1 156 156 THR HG22 H 1 1.240 0.020 . 1 . . . A 527 THR HG22 . 25043 1 1630 . 1 1 156 156 THR HG23 H 1 1.240 0.020 . 1 . . . A 527 THR HG23 . 25043 1 1631 . 1 1 156 156 THR CA C 13 60.646 0.400 . 1 . . . A 527 THR CA . 25043 1 1632 . 1 1 156 156 THR CB C 13 66.214 0.400 . 1 . . . A 527 THR CB . 25043 1 1633 . 1 1 156 156 THR CG2 C 13 19.960 0.400 . 1 . . . A 527 THR CG2 . 25043 1 1634 . 1 1 156 156 THR N N 15 115.929 0.400 . 1 . . . A 527 THR N . 25043 1 1635 . 1 1 157 157 SER H H 1 7.313 0.020 . 1 . . . A 528 SER H . 25043 1 1636 . 1 1 157 157 SER HA H 1 4.662 0.020 . 1 . . . A 528 SER HA . 25043 1 1637 . 1 1 157 157 SER HB2 H 1 3.699 0.020 . 2 . . . A 528 SER HB2 . 25043 1 1638 . 1 1 157 157 SER HB3 H 1 3.699 0.020 . 2 . . . A 528 SER HB3 . 25043 1 1639 . 1 1 157 157 SER CA C 13 55.325 0.400 . 1 . . . A 528 SER CA . 25043 1 1640 . 1 1 157 157 SER CB C 13 62.700 0.400 . 1 . . . A 528 SER CB . 25043 1 1641 . 1 1 157 157 SER N N 15 113.074 0.400 . 1 . . . A 528 SER N . 25043 1 1642 . 1 1 158 158 VAL H H 1 8.487 0.020 . 1 . . . A 529 VAL H . 25043 1 1643 . 1 1 158 158 VAL HA H 1 4.512 0.020 . 1 . . . A 529 VAL HA . 25043 1 1644 . 1 1 158 158 VAL HB H 1 1.884 0.020 . 1 . . . A 529 VAL HB . 25043 1 1645 . 1 1 158 158 VAL HG11 H 1 0.647 0.020 . 2 . . . A 529 VAL HG11 . 25043 1 1646 . 1 1 158 158 VAL HG12 H 1 0.647 0.020 . 2 . . . A 529 VAL HG12 . 25043 1 1647 . 1 1 158 158 VAL HG13 H 1 0.647 0.020 . 2 . . . A 529 VAL HG13 . 25043 1 1648 . 1 1 158 158 VAL HG21 H 1 0.626 0.020 . 2 . . . A 529 VAL HG21 . 25043 1 1649 . 1 1 158 158 VAL HG22 H 1 0.626 0.020 . 2 . . . A 529 VAL HG22 . 25043 1 1650 . 1 1 158 158 VAL HG23 H 1 0.626 0.020 . 2 . . . A 529 VAL HG23 . 25043 1 1651 . 1 1 158 158 VAL CA C 13 58.386 0.400 . 1 . . . A 529 VAL CA . 25043 1 1652 . 1 1 158 158 VAL CB C 13 32.448 0.400 . 1 . . . A 529 VAL CB . 25043 1 1653 . 1 1 158 158 VAL CG1 C 13 18.692 0.400 . 1 . . . A 529 VAL CG1 . 25043 1 1654 . 1 1 158 158 VAL CG2 C 13 17.529 0.400 . 1 . . . A 529 VAL CG2 . 25043 1 1655 . 1 1 158 158 VAL N N 15 124.506 0.400 . 1 . . . A 529 VAL N . 25043 1 1656 . 1 1 159 159 LYS H H 1 9.061 0.020 . 1 . . . A 530 LYS H . 25043 1 1657 . 1 1 159 159 LYS HA H 1 4.727 0.020 . 1 . . . A 530 LYS HA . 25043 1 1658 . 1 1 159 159 LYS HB2 H 1 1.673 0.020 . 2 . . . A 530 LYS HB2 . 25043 1 1659 . 1 1 159 159 LYS HB3 H 1 1.614 0.020 . 2 . . . A 530 LYS HB3 . 25043 1 1660 . 1 1 159 159 LYS HG2 H 1 1.381 0.020 . 2 . . . A 530 LYS HG2 . 25043 1 1661 . 1 1 159 159 LYS HG3 H 1 1.329 0.020 . 2 . . . A 530 LYS HG3 . 25043 1 1662 . 1 1 159 159 LYS HD2 H 1 1.757 0.020 . 2 . . . A 530 LYS HD2 . 25043 1 1663 . 1 1 159 159 LYS HD3 H 1 1.757 0.020 . 2 . . . A 530 LYS HD3 . 25043 1 1664 . 1 1 159 159 LYS CA C 13 51.670 0.400 . 1 . . . A 530 LYS CA . 25043 1 1665 . 1 1 159 159 LYS CB C 13 32.987 0.400 . 1 . . . A 530 LYS CB . 25043 1 1666 . 1 1 159 159 LYS CG C 13 22.204 0.400 . 1 . . . A 530 LYS CG . 25043 1 1667 . 1 1 159 159 LYS CD C 13 26.403 0.400 . 1 . . . A 530 LYS CD . 25043 1 1668 . 1 1 159 159 LYS N N 15 128.243 0.400 . 1 . . . A 530 LYS N . 25043 1 1669 . 1 1 160 160 VAL H H 1 8.950 0.020 . 1 . . . A 531 VAL H . 25043 1 1670 . 1 1 160 160 VAL HA H 1 4.295 0.020 . 1 . . . A 531 VAL HA . 25043 1 1671 . 1 1 160 160 VAL HB H 1 2.150 0.020 . 1 . . . A 531 VAL HB . 25043 1 1672 . 1 1 160 160 VAL HG11 H 1 0.980 0.020 . 2 . . . A 531 VAL HG11 . 25043 1 1673 . 1 1 160 160 VAL HG12 H 1 0.980 0.020 . 2 . . . A 531 VAL HG12 . 25043 1 1674 . 1 1 160 160 VAL HG13 H 1 0.980 0.020 . 2 . . . A 531 VAL HG13 . 25043 1 1675 . 1 1 160 160 VAL HG21 H 1 0.949 0.020 . 2 . . . A 531 VAL HG21 . 25043 1 1676 . 1 1 160 160 VAL HG22 H 1 0.949 0.020 . 2 . . . A 531 VAL HG22 . 25043 1 1677 . 1 1 160 160 VAL HG23 H 1 0.949 0.020 . 2 . . . A 531 VAL HG23 . 25043 1 1678 . 1 1 160 160 VAL CA C 13 59.372 0.400 . 1 . . . A 531 VAL CA . 25043 1 1679 . 1 1 160 160 VAL CB C 13 29.962 0.400 . 1 . . . A 531 VAL CB . 25043 1 1680 . 1 1 160 160 VAL CG1 C 13 18.687 0.400 . 1 . . . A 531 VAL CG1 . 25043 1 1681 . 1 1 160 160 VAL CG2 C 13 17.914 0.400 . 1 . . . A 531 VAL CG2 . 25043 1 1682 . 1 1 160 160 VAL N N 15 127.182 0.400 . 1 . . . A 531 VAL N . 25043 1 1683 . 1 1 161 161 PHE H H 1 9.335 0.020 . 1 . . . A 532 PHE H . 25043 1 1684 . 1 1 161 161 PHE HA H 1 5.066 0.020 . 1 . . . A 532 PHE HA . 25043 1 1685 . 1 1 161 161 PHE HB2 H 1 3.194 0.020 . 1 . . . A 532 PHE HB2 . 25043 1 1686 . 1 1 161 161 PHE HB3 H 1 3.155 0.020 . 1 . . . A 532 PHE HB3 . 25043 1 1687 . 1 1 161 161 PHE HD1 H 1 7.178 0.020 . 1 . . . A 532 PHE HD1 . 25043 1 1688 . 1 1 161 161 PHE HD2 H 1 7.178 0.020 . 1 . . . A 532 PHE HD2 . 25043 1 1689 . 1 1 161 161 PHE HE1 H 1 6.887 0.020 . 1 . . . A 532 PHE HE1 . 25043 1 1690 . 1 1 161 161 PHE HE2 H 1 6.887 0.020 . 1 . . . A 532 PHE HE2 . 25043 1 1691 . 1 1 161 161 PHE CA C 13 51.681 0.400 . 1 . . . A 532 PHE CA . 25043 1 1692 . 1 1 161 161 PHE CB C 13 34.463 0.400 . 1 . . . A 532 PHE CB . 25043 1 1693 . 1 1 161 161 PHE CD2 C 13 128.054 0.400 . 1 . . . A 532 PHE CD2 . 25043 1 1694 . 1 1 161 161 PHE N N 15 128.000 0.400 . 1 . . . A 532 PHE N . 25043 1 1695 . 1 1 162 162 SER H H 1 8.667 0.020 . 1 . . . A 533 SER H . 25043 1 1696 . 1 1 162 162 SER HA H 1 4.674 0.020 . 1 . . . A 533 SER HA . 25043 1 1697 . 1 1 162 162 SER HB2 H 1 4.004 0.020 . 2 . . . A 533 SER HB2 . 25043 1 1698 . 1 1 162 162 SER HB3 H 1 3.978 0.020 . 2 . . . A 533 SER HB3 . 25043 1 1699 . 1 1 162 162 SER CA C 13 55.921 0.400 . 1 . . . A 533 SER CA . 25043 1 1700 . 1 1 162 162 SER CB C 13 61.204 0.400 . 1 . . . A 533 SER CB . 25043 1 1701 . 1 1 162 162 SER N N 15 118.067 0.400 . 1 . . . A 533 SER N . 25043 1 1702 . 1 1 163 163 GLY H H 1 8.656 0.020 . 1 . . . A 534 GLY H . 25043 1 1703 . 1 1 163 163 GLY HA2 H 1 4.146 0.020 . 2 . . . A 534 GLY HA2 . 25043 1 1704 . 1 1 163 163 GLY HA3 H 1 4.097 0.020 . 2 . . . A 534 GLY HA3 . 25043 1 1705 . 1 1 163 163 GLY CA C 13 43.136 0.400 . 1 . . . A 534 GLY CA . 25043 1 1706 . 1 1 163 163 GLY N N 15 111.474 0.400 . 1 . . . A 534 GLY N . 25043 1 1707 . 1 1 164 164 LYS H H 1 8.257 0.020 . 1 . . . A 535 LYS H . 25043 1 1708 . 1 1 164 164 LYS HA H 1 4.459 0.020 . 1 . . . A 535 LYS HA . 25043 1 1709 . 1 1 164 164 LYS HB2 H 1 2.023 0.020 . 2 . . . A 535 LYS HB2 . 25043 1 1710 . 1 1 164 164 LYS HB3 H 1 1.899 0.020 . 2 . . . A 535 LYS HB3 . 25043 1 1711 . 1 1 164 164 LYS HG2 H 1 1.479 0.020 . 2 . . . A 535 LYS HG2 . 25043 1 1712 . 1 1 164 164 LYS HG3 H 1 1.510 0.020 . 2 . . . A 535 LYS HG3 . 25043 1 1713 . 1 1 164 164 LYS HD2 H 1 1.878 0.020 . 2 . . . A 535 LYS HD2 . 25043 1 1714 . 1 1 164 164 LYS HD3 H 1 1.816 0.020 . 2 . . . A 535 LYS HD3 . 25043 1 1715 . 1 1 164 164 LYS HE2 H 1 3.248 0.020 . 2 . . . A 535 LYS HE2 . 25043 1 1716 . 1 1 164 164 LYS HE3 H 1 3.248 0.020 . 2 . . . A 535 LYS HE3 . 25043 1 1717 . 1 1 164 164 LYS CA C 13 53.870 0.400 . 1 . . . A 535 LYS CA . 25043 1 1718 . 1 1 164 164 LYS CB C 13 29.960 0.400 . 1 . . . A 535 LYS CB . 25043 1 1719 . 1 1 164 164 LYS CG C 13 22.043 0.400 . 1 . . . A 535 LYS CG . 25043 1 1720 . 1 1 164 164 LYS CD C 13 25.857 0.400 . 1 . . . A 535 LYS CD . 25043 1 1721 . 1 1 164 164 LYS CE C 13 38.946 0.400 . 1 . . . A 535 LYS CE . 25043 1 1722 . 1 1 164 164 LYS N N 15 120.395 0.400 . 1 . . . A 535 LYS N . 25043 1 1723 . 1 1 165 165 SER H H 1 8.158 0.020 . 1 . . . A 536 SER H . 25043 1 1724 . 1 1 165 165 SER HA H 1 4.673 0.020 . 1 . . . A 536 SER HA . 25043 1 1725 . 1 1 165 165 SER HB2 H 1 4.110 0.020 . 2 . . . A 536 SER HB2 . 25043 1 1726 . 1 1 165 165 SER HB3 H 1 4.110 0.020 . 2 . . . A 536 SER HB3 . 25043 1 1727 . 1 1 165 165 SER CA C 13 54.984 0.400 . 1 . . . A 536 SER CA . 25043 1 1728 . 1 1 165 165 SER CB C 13 61.233 0.400 . 1 . . . A 536 SER CB . 25043 1 1729 . 1 1 165 165 SER N N 15 114.228 0.400 . 1 . . . A 536 SER N . 25043 1 1730 . 1 1 166 166 GLU H H 1 8.817 0.020 . 1 . . . A 537 GLU H . 25043 1 1731 . 1 1 166 166 GLU HA H 1 4.515 0.020 . 1 . . . A 537 GLU HA . 25043 1 1732 . 1 1 166 166 GLU HB2 H 1 2.355 0.020 . 1 . . . A 537 GLU HB2 . 25043 1 1733 . 1 1 166 166 GLU HB3 H 1 2.120 0.020 . 1 . . . A 537 GLU HB3 . 25043 1 1734 . 1 1 166 166 GLU HG2 H 1 2.375 0.020 . 2 . . . A 537 GLU HG2 . 25043 1 1735 . 1 1 166 166 GLU HG3 H 1 2.425 0.020 . 2 . . . A 537 GLU HG3 . 25043 1 1736 . 1 1 166 166 GLU CA C 13 54.275 0.400 . 1 . . . A 537 GLU CA . 25043 1 1737 . 1 1 166 166 GLU CB C 13 27.724 0.400 . 1 . . . A 537 GLU CB . 25043 1 1738 . 1 1 166 166 GLU CG C 13 33.852 0.400 . 1 . . . A 537 GLU CG . 25043 1 1739 . 1 1 166 166 GLU N N 15 122.450 0.400 . 1 . . . A 537 GLU N . 25043 1 1740 . 1 1 167 167 ARG H H 1 8.809 0.020 . 1 . . . A 538 ARG H . 25043 1 1741 . 1 1 167 167 ARG HA H 1 4.656 0.020 . 1 . . . A 538 ARG HA . 25043 1 1742 . 1 1 167 167 ARG HB2 H 1 2.440 0.020 . 2 . . . A 538 ARG HB2 . 25043 1 1743 . 1 1 167 167 ARG HB3 H 1 2.039 0.020 . 2 . . . A 538 ARG HB3 . 25043 1 1744 . 1 1 167 167 ARG HG2 H 1 1.858 0.020 . 2 . . . A 538 ARG HG2 . 25043 1 1745 . 1 1 167 167 ARG HG3 H 1 1.796 0.020 . 2 . . . A 538 ARG HG3 . 25043 1 1746 . 1 1 167 167 ARG HD2 H 1 3.416 0.020 . 2 . . . A 538 ARG HD2 . 25043 1 1747 . 1 1 167 167 ARG HD3 H 1 3.416 0.020 . 2 . . . A 538 ARG HD3 . 25043 1 1748 . 1 1 167 167 ARG HE H 1 7.585 0.020 . 1 . . . A 538 ARG HE . 25043 1 1749 . 1 1 167 167 ARG CA C 13 53.825 0.400 . 1 . . . A 538 ARG CA . 25043 1 1750 . 1 1 167 167 ARG CB C 13 29.319 0.400 . 1 . . . A 538 ARG CB . 25043 1 1751 . 1 1 167 167 ARG CG C 13 24.774 0.400 . 1 . . . A 538 ARG CG . 25043 1 1752 . 1 1 167 167 ARG CD C 13 40.627 0.400 . 1 . . . A 538 ARG CD . 25043 1 1753 . 1 1 167 167 ARG N N 15 116.825 0.400 . 1 . . . A 538 ARG N . 25043 1 1754 . 1 1 167 167 ARG NE N 15 118.540 0.400 . 1 . . . A 538 ARG NE . 25043 1 1755 . 1 1 168 168 SER H H 1 7.863 0.020 . 1 . . . A 539 SER H . 25043 1 1756 . 1 1 168 168 SER HA H 1 4.754 0.020 . 1 . . . A 539 SER HA . 25043 1 1757 . 1 1 168 168 SER HB2 H 1 4.104 0.020 . 2 . . . A 539 SER HB2 . 25043 1 1758 . 1 1 168 168 SER HB3 H 1 4.104 0.020 . 2 . . . A 539 SER HB3 . 25043 1 1759 . 1 1 168 168 SER CA C 13 54.627 0.400 . 1 . . . A 539 SER CA . 25043 1 1760 . 1 1 168 168 SER CB C 13 61.282 0.400 . 1 . . . A 539 SER CB . 25043 1 1761 . 1 1 168 168 SER N N 15 112.672 0.400 . 1 . . . A 539 SER N . 25043 1 1762 . 1 1 169 169 SER H H 1 9.002 0.020 . 1 . . . A 540 SER H . 25043 1 1763 . 1 1 169 169 SER HA H 1 5.095 0.020 . 1 . . . A 540 SER HA . 25043 1 1764 . 1 1 169 169 SER HB2 H 1 3.871 0.020 . 2 . . . A 540 SER HB2 . 25043 1 1765 . 1 1 169 169 SER HB3 H 1 3.871 0.020 . 2 . . . A 540 SER HB3 . 25043 1 1766 . 1 1 169 169 SER CA C 13 54.923 0.400 . 1 . . . A 540 SER CA . 25043 1 1767 . 1 1 169 169 SER CB C 13 63.913 0.400 . 1 . . . A 540 SER CB . 25043 1 1768 . 1 1 169 169 SER N N 15 115.645 0.400 . 1 . . . A 540 SER N . 25043 1 1769 . 1 1 170 170 SER H H 1 8.363 0.020 . 1 . . . A 541 SER H . 25043 1 1770 . 1 1 170 170 SER HA H 1 4.446 0.020 . 1 . . . A 541 SER HA . 25043 1 1771 . 1 1 170 170 SER HB2 H 1 4.096 0.020 . 2 . . . A 541 SER HB2 . 25043 1 1772 . 1 1 170 170 SER HB3 H 1 4.057 0.020 . 2 . . . A 541 SER HB3 . 25043 1 1773 . 1 1 170 170 SER CA C 13 53.830 0.400 . 1 . . . A 541 SER CA . 25043 1 1774 . 1 1 170 170 SER CB C 13 63.961 0.400 . 1 . . . A 541 SER CB . 25043 1 1775 . 1 1 170 170 SER N N 15 113.441 0.400 . 1 . . . A 541 SER N . 25043 1 1776 . 1 1 171 171 GLY H H 1 6.904 0.020 . 1 . . . A 542 GLY H . 25043 1 1777 . 1 1 171 171 GLY HA2 H 1 3.881 0.020 . 1 . . . A 542 GLY HA2 . 25043 1 1778 . 1 1 171 171 GLY HA3 H 1 1.827 0.020 . 1 . . . A 542 GLY HA3 . 25043 1 1779 . 1 1 171 171 GLY CA C 13 43.290 0.400 . 1 . . . A 542 GLY CA . 25043 1 1780 . 1 1 171 171 GLY N N 15 103.572 0.400 . 1 . . . A 542 GLY N . 25043 1 1781 . 1 1 172 172 LEU H H 1 9.319 0.020 . 1 . . . A 543 LEU H . 25043 1 1782 . 1 1 172 172 LEU HB2 H 1 1.542 0.020 . 1 . . . A 543 LEU HB2 . 25043 1 1783 . 1 1 172 172 LEU HB3 H 1 1.274 0.020 . 1 . . . A 543 LEU HB3 . 25043 1 1784 . 1 1 172 172 LEU HG H 1 1.095 0.020 . 1 . . . A 543 LEU HG . 25043 1 1785 . 1 1 172 172 LEU CB C 13 44.827 0.400 . 1 . . . A 543 LEU CB . 25043 1 1786 . 1 1 172 172 LEU CG C 13 23.557 0.400 . 1 . . . A 543 LEU CG . 25043 1 1787 . 1 1 172 172 LEU N N 15 123.270 0.400 . 1 . . . A 543 LEU N . 25043 1 1788 . 1 1 173 173 LEU H H 1 9.309 0.020 . 1 . . . A 544 LEU H . 25043 1 1789 . 1 1 173 173 LEU HB2 H 1 1.941 0.020 . 2 . . . A 544 LEU HB2 . 25043 1 1790 . 1 1 173 173 LEU HB3 H 1 0.914 0.020 . 2 . . . A 544 LEU HB3 . 25043 1 1791 . 1 1 173 173 LEU HD11 H 1 -0.089 0.020 . 2 . . . A 544 LEU HD11 . 25043 1 1792 . 1 1 173 173 LEU HD12 H 1 -0.089 0.020 . 2 . . . A 544 LEU HD12 . 25043 1 1793 . 1 1 173 173 LEU HD13 H 1 -0.089 0.020 . 2 . . . A 544 LEU HD13 . 25043 1 1794 . 1 1 173 173 LEU HD21 H 1 0.466 0.020 . 2 . . . A 544 LEU HD21 . 25043 1 1795 . 1 1 173 173 LEU HD22 H 1 0.466 0.020 . 2 . . . A 544 LEU HD22 . 25043 1 1796 . 1 1 173 173 LEU HD23 H 1 0.466 0.020 . 2 . . . A 544 LEU HD23 . 25043 1 1797 . 1 1 173 173 LEU CB C 13 43.776 0.400 . 1 . . . A 544 LEU CB . 25043 1 1798 . 1 1 173 173 LEU CD1 C 13 21.624 0.400 . 1 . . . A 544 LEU CD1 . 25043 1 1799 . 1 1 173 173 LEU CD2 C 13 23.243 0.400 . 1 . . . A 544 LEU CD2 . 25043 1 1800 . 1 1 173 173 LEU N N 15 121.597 0.400 . 1 . . . A 544 LEU N . 25043 1 1801 . 1 1 174 174 GLU H H 1 8.266 0.020 . 1 . . . A 545 GLU H . 25043 1 1802 . 1 1 174 174 GLU HA H 1 5.346 0.020 . 1 . . . A 545 GLU HA . 25043 1 1803 . 1 1 174 174 GLU HB2 H 1 1.931 0.020 . 2 . . . A 545 GLU HB2 . 25043 1 1804 . 1 1 174 174 GLU HB3 H 1 1.856 0.020 . 2 . . . A 545 GLU HB3 . 25043 1 1805 . 1 1 174 174 GLU HG2 H 1 2.322 0.020 . 1 . . . A 545 GLU HG2 . 25043 1 1806 . 1 1 174 174 GLU HG3 H 1 2.196 0.020 . 1 . . . A 545 GLU HG3 . 25043 1 1807 . 1 1 174 174 GLU CA C 13 52.141 0.400 . 1 . . . A 545 GLU CA . 25043 1 1808 . 1 1 174 174 GLU CB C 13 31.129 0.400 . 1 . . . A 545 GLU CB . 25043 1 1809 . 1 1 174 174 GLU CG C 13 33.413 0.400 . 1 . . . A 545 GLU CG . 25043 1 1810 . 1 1 174 174 GLU N N 15 123.458 0.400 . 1 . . . A 545 GLU N . 25043 1 1811 . 1 1 175 175 TRP H H 1 8.914 0.020 . 1 . . . A 546 TRP H . 25043 1 1812 . 1 1 175 175 TRP HA H 1 4.902 0.020 . 1 . . . A 546 TRP HA . 25043 1 1813 . 1 1 175 175 TRP HB2 H 1 3.330 0.020 . 1 . . . A 546 TRP HB2 . 25043 1 1814 . 1 1 175 175 TRP HB3 H 1 3.877 0.020 . 1 . . . A 546 TRP HB3 . 25043 1 1815 . 1 1 175 175 TRP HD1 H 1 7.249 0.020 . 1 . . . A 546 TRP HD1 . 25043 1 1816 . 1 1 175 175 TRP HE1 H 1 9.759 0.020 . 1 . . . A 546 TRP HE1 . 25043 1 1817 . 1 1 175 175 TRP HE3 H 1 6.702 0.020 . 1 . . . A 546 TRP HE3 . 25043 1 1818 . 1 1 175 175 TRP HZ2 H 1 7.306 0.020 . 1 . . . A 546 TRP HZ2 . 25043 1 1819 . 1 1 175 175 TRP HZ3 H 1 6.831 0.020 . 1 . . . A 546 TRP HZ3 . 25043 1 1820 . 1 1 175 175 TRP HH2 H 1 7.811 0.020 . 1 . . . A 546 TRP HH2 . 25043 1 1821 . 1 1 175 175 TRP CA C 13 56.585 0.400 . 1 . . . A 546 TRP CA . 25043 1 1822 . 1 1 175 175 TRP CB C 13 31.979 0.400 . 1 . . . A 546 TRP CB . 25043 1 1823 . 1 1 175 175 TRP CD1 C 13 124.192 0.400 . 1 . . . A 546 TRP CD1 . 25043 1 1824 . 1 1 175 175 TRP CE3 C 13 120.170 0.400 . 1 . . . A 546 TRP CE3 . 25043 1 1825 . 1 1 175 175 TRP CZ2 C 13 111.704 0.400 . 1 . . . A 546 TRP CZ2 . 25043 1 1826 . 1 1 175 175 TRP CZ3 C 13 120.308 0.400 . 1 . . . A 546 TRP CZ3 . 25043 1 1827 . 1 1 175 175 TRP CH2 C 13 118.754 0.400 . 1 . . . A 546 TRP CH2 . 25043 1 1828 . 1 1 175 175 TRP N N 15 125.358 0.400 . 1 . . . A 546 TRP N . 25043 1 1829 . 1 1 175 175 TRP NE1 N 15 130.792 0.400 . 1 . . . A 546 TRP NE1 . 25043 1 1830 . 1 1 176 176 ASP H H 1 9.505 0.020 . 1 . . . A 547 ASP H . 25043 1 1831 . 1 1 176 176 ASP HA H 1 4.761 0.020 . 1 . . . A 547 ASP HA . 25043 1 1832 . 1 1 176 176 ASP HB2 H 1 2.858 0.020 . 2 . . . A 547 ASP HB2 . 25043 1 1833 . 1 1 176 176 ASP HB3 H 1 2.858 0.020 . 2 . . . A 547 ASP HB3 . 25043 1 1834 . 1 1 176 176 ASP CA C 13 53.678 0.400 . 1 . . . A 547 ASP CA . 25043 1 1835 . 1 1 176 176 ASP CB C 13 38.743 0.400 . 1 . . . A 547 ASP CB . 25043 1 1836 . 1 1 176 176 ASP N N 15 119.084 0.400 . 1 . . . A 547 ASP N . 25043 1 1837 . 1 1 177 177 SER H H 1 7.680 0.020 . 1 . . . A 548 SER H . 25043 1 1838 . 1 1 177 177 SER HA H 1 5.041 0.020 . 1 . . . A 548 SER HA . 25043 1 1839 . 1 1 177 177 SER HB2 H 1 4.193 0.020 . 2 . . . A 548 SER HB2 . 25043 1 1840 . 1 1 177 177 SER HB3 H 1 3.914 0.020 . 2 . . . A 548 SER HB3 . 25043 1 1841 . 1 1 177 177 SER CA C 13 53.263 0.400 . 1 . . . A 548 SER CA . 25043 1 1842 . 1 1 177 177 SER CB C 13 64.107 0.400 . 1 . . . A 548 SER CB . 25043 1 1843 . 1 1 177 177 SER N N 15 109.798 0.400 . 1 . . . A 548 SER N . 25043 1 1844 . 1 1 178 178 LYS H H 1 8.972 0.020 . 1 . . . A 549 LYS H . 25043 1 1845 . 1 1 178 178 LYS N N 15 122.748 0.400 . 1 . . . A 549 LYS N . 25043 1 1846 . 1 1 179 179 SER H H 1 8.249 0.020 . 1 . . . A 550 SER H . 25043 1 1847 . 1 1 179 179 SER HA H 1 4.296 0.020 . 1 . . . A 550 SER HA . 25043 1 1848 . 1 1 179 179 SER HB2 H 1 3.873 0.020 . 2 . . . A 550 SER HB2 . 25043 1 1849 . 1 1 179 179 SER HB3 H 1 3.810 0.020 . 2 . . . A 550 SER HB3 . 25043 1 1850 . 1 1 179 179 SER CA C 13 59.411 0.400 . 1 . . . A 550 SER CA . 25043 1 1851 . 1 1 179 179 SER CB C 13 59.636 0.400 . 1 . . . A 550 SER CB . 25043 1 1852 . 1 1 179 179 SER N N 15 116.154 0.400 . 1 . . . A 550 SER N . 25043 1 1853 . 1 1 180 180 ASP H H 1 7.334 0.020 . 1 . . . A 551 ASP H . 25043 1 1854 . 1 1 180 180 ASP HA H 1 4.093 0.020 . 1 . . . A 551 ASP HA . 25043 1 1855 . 1 1 180 180 ASP HB2 H 1 2.861 0.020 . 1 . . . A 551 ASP HB2 . 25043 1 1856 . 1 1 180 180 ASP HB3 H 1 2.499 0.020 . 1 . . . A 551 ASP HB3 . 25043 1 1857 . 1 1 180 180 ASP CA C 13 54.274 0.400 . 1 . . . A 551 ASP CA . 25043 1 1858 . 1 1 180 180 ASP CB C 13 38.174 0.400 . 1 . . . A 551 ASP CB . 25043 1 1859 . 1 1 180 180 ASP N N 15 121.499 0.400 . 1 . . . A 551 ASP N . 25043 1 1860 . 1 1 181 181 ALA H H 1 7.028 0.020 . 1 . . . A 552 ALA H . 25043 1 1861 . 1 1 181 181 ALA HA H 1 2.885 0.020 . 1 . . . A 552 ALA HA . 25043 1 1862 . 1 1 181 181 ALA HB1 H 1 1.690 0.020 . 1 . . . A 552 ALA HB1 . 25043 1 1863 . 1 1 181 181 ALA HB2 H 1 1.690 0.020 . 1 . . . A 552 ALA HB2 . 25043 1 1864 . 1 1 181 181 ALA HB3 H 1 1.690 0.020 . 1 . . . A 552 ALA HB3 . 25043 1 1865 . 1 1 181 181 ALA CA C 13 51.947 0.400 . 1 . . . A 552 ALA CA . 25043 1 1866 . 1 1 181 181 ALA CB C 13 16.305 0.400 . 1 . . . A 552 ALA CB . 25043 1 1867 . 1 1 181 181 ALA N N 15 121.178 0.400 . 1 . . . A 552 ALA N . 25043 1 1868 . 1 1 182 182 LEU H H 1 8.093 0.020 . 1 . . . A 553 LEU H . 25043 1 1869 . 1 1 182 182 LEU HA H 1 4.105 0.020 . 1 . . . A 553 LEU HA . 25043 1 1870 . 1 1 182 182 LEU HB2 H 1 1.983 0.020 . 1 . . . A 553 LEU HB2 . 25043 1 1871 . 1 1 182 182 LEU HB3 H 1 1.852 0.020 . 1 . . . A 553 LEU HB3 . 25043 1 1872 . 1 1 182 182 LEU HG H 1 0.403 0.020 . 1 . . . A 553 LEU HG . 25043 1 1873 . 1 1 182 182 LEU HD11 H 1 1.111 0.020 . 2 . . . A 553 LEU HD11 . 25043 1 1874 . 1 1 182 182 LEU HD12 H 1 1.111 0.020 . 2 . . . A 553 LEU HD12 . 25043 1 1875 . 1 1 182 182 LEU HD13 H 1 1.111 0.020 . 2 . . . A 553 LEU HD13 . 25043 1 1876 . 1 1 182 182 LEU HD21 H 1 0.990 0.020 . 2 . . . A 553 LEU HD21 . 25043 1 1877 . 1 1 182 182 LEU HD22 H 1 0.990 0.020 . 2 . . . A 553 LEU HD22 . 25043 1 1878 . 1 1 182 182 LEU HD23 H 1 0.990 0.020 . 2 . . . A 553 LEU HD23 . 25043 1 1879 . 1 1 182 182 LEU CA C 13 55.658 0.400 . 1 . . . A 553 LEU CA . 25043 1 1880 . 1 1 182 182 LEU CB C 13 39.418 0.400 . 1 . . . A 553 LEU CB . 25043 1 1881 . 1 1 182 182 LEU CG C 13 33.598 0.400 . 1 . . . A 553 LEU CG . 25043 1 1882 . 1 1 182 182 LEU CD1 C 13 20.879 0.400 . 1 . . . A 553 LEU CD1 . 25043 1 1883 . 1 1 182 182 LEU CD2 C 13 23.336 0.400 . 1 . . . A 553 LEU CD2 . 25043 1 1884 . 1 1 182 182 LEU N N 15 120.087 0.400 . 1 . . . A 553 LEU N . 25043 1 1885 . 1 1 183 183 GLU H H 1 8.083 0.020 . 1 . . . A 554 GLU H . 25043 1 1886 . 1 1 183 183 GLU HA H 1 3.431 0.020 . 1 . . . A 554 GLU HA . 25043 1 1887 . 1 1 183 183 GLU HB2 H 1 1.938 0.020 . 2 . . . A 554 GLU HB2 . 25043 1 1888 . 1 1 183 183 GLU HB3 H 1 1.541 0.020 . 2 . . . A 554 GLU HB3 . 25043 1 1889 . 1 1 183 183 GLU HG2 H 1 2.209 0.020 . 2 . . . A 554 GLU HG2 . 25043 1 1890 . 1 1 183 183 GLU HG3 H 1 2.152 0.020 . 2 . . . A 554 GLU HG3 . 25043 1 1891 . 1 1 183 183 GLU CA C 13 56.205 0.400 . 1 . . . A 554 GLU CA . 25043 1 1892 . 1 1 183 183 GLU CB C 13 26.599 0.400 . 1 . . . A 554 GLU CB . 25043 1 1893 . 1 1 183 183 GLU CG C 13 33.879 0.400 . 1 . . . A 554 GLU CG . 25043 1 1894 . 1 1 183 183 GLU N N 15 116.972 0.400 . 1 . . . A 554 GLU N . 25043 1 1895 . 1 1 184 184 THR H H 1 7.430 0.020 . 1 . . . A 555 THR H . 25043 1 1896 . 1 1 184 184 THR HA H 1 3.667 0.020 . 1 . . . A 555 THR HA . 25043 1 1897 . 1 1 184 184 THR HB H 1 3.356 0.020 . 1 . . . A 555 THR HB . 25043 1 1898 . 1 1 184 184 THR HG21 H 1 1.108 0.020 . 1 . . . A 555 THR HG21 . 25043 1 1899 . 1 1 184 184 THR HG22 H 1 1.108 0.020 . 1 . . . A 555 THR HG22 . 25043 1 1900 . 1 1 184 184 THR HG23 H 1 1.108 0.020 . 1 . . . A 555 THR HG23 . 25043 1 1901 . 1 1 184 184 THR CA C 13 64.772 0.400 . 1 . . . A 555 THR CA . 25043 1 1902 . 1 1 184 184 THR CB C 13 64.259 0.400 . 1 . . . A 555 THR CB . 25043 1 1903 . 1 1 184 184 THR CG2 C 13 20.841 0.400 . 1 . . . A 555 THR CG2 . 25043 1 1904 . 1 1 184 184 THR N N 15 113.323 0.400 . 1 . . . A 555 THR N . 25043 1 1905 . 1 1 185 185 LEU H H 1 8.511 0.020 . 1 . . . A 556 LEU H . 25043 1 1906 . 1 1 185 185 LEU HA H 1 3.563 0.020 . 1 . . . A 556 LEU HA . 25043 1 1907 . 1 1 185 185 LEU HB2 H 1 1.463 0.020 . 1 . . . A 556 LEU HB2 . 25043 1 1908 . 1 1 185 185 LEU HB3 H 1 2.099 0.020 . 1 . . . A 556 LEU HB3 . 25043 1 1909 . 1 1 185 185 LEU HG H 1 1.372 0.020 . 1 . . . A 556 LEU HG . 25043 1 1910 . 1 1 185 185 LEU HD11 H 1 0.735 0.020 . 2 . . . A 556 LEU HD11 . 25043 1 1911 . 1 1 185 185 LEU HD12 H 1 0.735 0.020 . 2 . . . A 556 LEU HD12 . 25043 1 1912 . 1 1 185 185 LEU HD13 H 1 0.735 0.020 . 2 . . . A 556 LEU HD13 . 25043 1 1913 . 1 1 185 185 LEU HD21 H 1 0.481 0.020 . 2 . . . A 556 LEU HD21 . 25043 1 1914 . 1 1 185 185 LEU HD22 H 1 0.481 0.020 . 2 . . . A 556 LEU HD22 . 25043 1 1915 . 1 1 185 185 LEU HD23 H 1 0.481 0.020 . 2 . . . A 556 LEU HD23 . 25043 1 1916 . 1 1 185 185 LEU CA C 13 56.271 0.400 . 1 . . . A 556 LEU CA . 25043 1 1917 . 1 1 185 185 LEU CB C 13 39.161 0.400 . 1 . . . A 556 LEU CB . 25043 1 1918 . 1 1 185 185 LEU CG C 13 23.858 0.400 . 1 . . . A 556 LEU CG . 25043 1 1919 . 1 1 185 185 LEU CD1 C 13 25.138 0.400 . 1 . . . A 556 LEU CD1 . 25043 1 1920 . 1 1 185 185 LEU CD2 C 13 22.302 0.400 . 1 . . . A 556 LEU CD2 . 25043 1 1921 . 1 1 185 185 LEU N N 15 124.634 0.400 . 1 . . . A 556 LEU N . 25043 1 1922 . 1 1 186 186 GLY H H 1 7.801 0.020 . 1 . . . A 557 GLY H . 25043 1 1923 . 1 1 186 186 GLY HA2 H 1 3.837 0.020 . 1 . . . A 557 GLY HA2 . 25043 1 1924 . 1 1 186 186 GLY HA3 H 1 3.936 0.020 . 1 . . . A 557 GLY HA3 . 25043 1 1925 . 1 1 186 186 GLY CA C 13 44.411 0.400 . 1 . . . A 557 GLY CA . 25043 1 1926 . 1 1 186 186 GLY N N 15 101.086 0.400 . 1 . . . A 557 GLY N . 25043 1 1927 . 1 1 187 187 PHE H H 1 7.707 0.020 . 1 . . . A 558 PHE H . 25043 1 1928 . 1 1 187 187 PHE HA H 1 4.565 0.020 . 1 . . . A 558 PHE HA . 25043 1 1929 . 1 1 187 187 PHE HB2 H 1 2.953 0.020 . 1 . . . A 558 PHE HB2 . 25043 1 1930 . 1 1 187 187 PHE HB3 H 1 3.215 0.020 . 1 . . . A 558 PHE HB3 . 25043 1 1931 . 1 1 187 187 PHE HD1 H 1 7.496 0.020 . 1 . . . A 558 PHE HD1 . 25043 1 1932 . 1 1 187 187 PHE HD2 H 1 7.496 0.020 . 1 . . . A 558 PHE HD2 . 25043 1 1933 . 1 1 187 187 PHE HZ H 1 7.228 0.020 . 1 . . . A 558 PHE HZ . 25043 1 1934 . 1 1 187 187 PHE CA C 13 57.338 0.400 . 1 . . . A 558 PHE CA . 25043 1 1935 . 1 1 187 187 PHE CB C 13 38.711 0.400 . 1 . . . A 558 PHE CB . 25043 1 1936 . 1 1 187 187 PHE CD2 C 13 128.079 0.400 . 1 . . . A 558 PHE CD2 . 25043 1 1937 . 1 1 187 187 PHE CZ C 13 127.550 0.400 . 1 . . . A 558 PHE CZ . 25043 1 1938 . 1 1 187 187 PHE N N 15 118.088 0.400 . 1 . . . A 558 PHE N . 25043 1 1939 . 1 1 188 188 LEU H H 1 9.428 0.020 . 1 . . . A 559 LEU H . 25043 1 1940 . 1 1 188 188 LEU HA H 1 4.330 0.020 . 1 . . . A 559 LEU HA . 25043 1 1941 . 1 1 188 188 LEU HB2 H 1 1.599 0.020 . 2 . . . A 559 LEU HB2 . 25043 1 1942 . 1 1 188 188 LEU HB3 H 1 1.289 0.020 . 2 . . . A 559 LEU HB3 . 25043 1 1943 . 1 1 188 188 LEU HG H 1 1.715 0.020 . 1 . . . A 559 LEU HG . 25043 1 1944 . 1 1 188 188 LEU HD11 H 1 0.784 0.020 . 2 . . . A 559 LEU HD11 . 25043 1 1945 . 1 1 188 188 LEU HD12 H 1 0.784 0.020 . 2 . . . A 559 LEU HD12 . 25043 1 1946 . 1 1 188 188 LEU HD13 H 1 0.784 0.020 . 2 . . . A 559 LEU HD13 . 25043 1 1947 . 1 1 188 188 LEU HD21 H 1 0.697 0.020 . 2 . . . A 559 LEU HD21 . 25043 1 1948 . 1 1 188 188 LEU HD22 H 1 0.697 0.020 . 2 . . . A 559 LEU HD22 . 25043 1 1949 . 1 1 188 188 LEU HD23 H 1 0.697 0.020 . 2 . . . A 559 LEU HD23 . 25043 1 1950 . 1 1 188 188 LEU CA C 13 52.870 0.400 . 1 . . . A 559 LEU CA . 25043 1 1951 . 1 1 188 188 LEU CB C 13 41.784 0.400 . 1 . . . A 559 LEU CB . 25043 1 1952 . 1 1 188 188 LEU CG C 13 24.956 0.400 . 1 . . . A 559 LEU CG . 25043 1 1953 . 1 1 188 188 LEU CD1 C 13 21.964 0.400 . 1 . . . A 559 LEU CD1 . 25043 1 1954 . 1 1 188 188 LEU CD2 C 13 21.883 0.400 . 1 . . . A 559 LEU CD2 . 25043 1 1955 . 1 1 188 188 LEU N N 15 119.827 0.400 . 1 . . . A 559 LEU N . 25043 1 1956 . 1 1 189 189 ASN H H 1 7.510 0.020 . 1 . . . A 560 ASN H . 25043 1 1957 . 1 1 189 189 ASN HA H 1 4.016 0.020 . 1 . . . A 560 ASN HA . 25043 1 1958 . 1 1 189 189 ASN HB2 H 1 3.186 0.020 . 2 . . . A 560 ASN HB2 . 25043 1 1959 . 1 1 189 189 ASN HB3 H 1 3.186 0.020 . 2 . . . A 560 ASN HB3 . 25043 1 1960 . 1 1 189 189 ASN HD21 H 1 8.280 0.020 . 1 . . . A 560 ASN HD21 . 25043 1 1961 . 1 1 189 189 ASN HD22 H 1 5.184 0.020 . 1 . . . A 560 ASN HD22 . 25043 1 1962 . 1 1 189 189 ASN CA C 13 50.751 0.400 . 1 . . . A 560 ASN CA . 25043 1 1963 . 1 1 189 189 ASN CB C 13 34.014 0.400 . 1 . . . A 560 ASN CB . 25043 1 1964 . 1 1 189 189 ASN N N 15 117.252 0.400 . 1 . . . A 560 ASN N . 25043 1 1965 . 1 1 189 189 ASN ND2 N 15 106.327 0.400 . 1 . . . A 560 ASN ND2 . 25043 1 1966 . 1 1 190 190 HIS H H 1 8.079 0.020 . 1 . . . A 561 HIS H . 25043 1 1967 . 1 1 190 190 HIS HA H 1 4.322 0.020 . 1 . . . A 561 HIS HA . 25043 1 1968 . 1 1 190 190 HIS HB2 H 1 3.589 0.020 . 1 . . . A 561 HIS HB2 . 25043 1 1969 . 1 1 190 190 HIS HB3 H 1 3.248 0.020 . 1 . . . A 561 HIS HB3 . 25043 1 1970 . 1 1 190 190 HIS HD2 H 1 6.499 0.020 . 1 . . . A 561 HIS HD2 . 25043 1 1971 . 1 1 190 190 HIS HE1 H 1 7.930 0.020 . 1 . . . A 561 HIS HE1 . 25043 1 1972 . 1 1 190 190 HIS CA C 13 56.611 0.400 . 1 . . . A 561 HIS CA . 25043 1 1973 . 1 1 190 190 HIS CB C 13 22.363 0.400 . 1 . . . A 561 HIS CB . 25043 1 1974 . 1 1 190 190 HIS CD2 C 13 123.416 0.400 . 1 . . . A 561 HIS CD2 . 25043 1 1975 . 1 1 190 190 HIS CE1 C 13 134.243 0.400 . 1 . . . A 561 HIS CE1 . 25043 1 1976 . 1 1 190 190 HIS N N 15 118.056 0.400 . 1 . . . A 561 HIS N . 25043 1 1977 . 1 1 191 191 TYR H H 1 7.910 0.020 . 1 . . . A 562 TYR H . 25043 1 1978 . 1 1 191 191 TYR HA H 1 4.069 0.020 . 1 . . . A 562 TYR HA . 25043 1 1979 . 1 1 191 191 TYR HB2 H 1 3.428 0.020 . 2 . . . A 562 TYR HB2 . 25043 1 1980 . 1 1 191 191 TYR HB3 H 1 2.760 0.020 . 2 . . . A 562 TYR HB3 . 25043 1 1981 . 1 1 191 191 TYR HD1 H 1 6.955 0.020 . 1 . . . A 562 TYR HD1 . 25043 1 1982 . 1 1 191 191 TYR HD2 H 1 6.955 0.020 . 1 . . . A 562 TYR HD2 . 25043 1 1983 . 1 1 191 191 TYR HE1 H 1 6.816 0.020 . 1 . . . A 562 TYR HE1 . 25043 1 1984 . 1 1 191 191 TYR HE2 H 1 6.816 0.020 . 1 . . . A 562 TYR HE2 . 25043 1 1985 . 1 1 191 191 TYR CA C 13 57.317 0.400 . 1 . . . A 562 TYR CA . 25043 1 1986 . 1 1 191 191 TYR CB C 13 37.339 0.400 . 1 . . . A 562 TYR CB . 25043 1 1987 . 1 1 191 191 TYR CD1 C 13 130.430 0.400 . 1 . . . A 562 TYR CD1 . 25043 1 1988 . 1 1 191 191 TYR CE1 C 13 116.302 0.400 . 1 . . . A 562 TYR CE1 . 25043 1 1989 . 1 1 191 191 TYR N N 15 122.825 0.400 . 1 . . . A 562 TYR N . 25043 1 1990 . 1 1 192 192 GLN H H 1 7.550 0.020 . 1 . . . A 563 GLN H . 25043 1 1991 . 1 1 192 192 GLN HA H 1 4.677 0.020 . 1 . . . A 563 GLN HA . 25043 1 1992 . 1 1 192 192 GLN HB2 H 1 1.864 0.020 . 2 . . . A 563 GLN HB2 . 25043 1 1993 . 1 1 192 192 GLN HB3 H 1 1.564 0.020 . 2 . . . A 563 GLN HB3 . 25043 1 1994 . 1 1 192 192 GLN HG2 H 1 2.356 0.020 . 2 . . . A 563 GLN HG2 . 25043 1 1995 . 1 1 192 192 GLN HG3 H 1 2.221 0.020 . 2 . . . A 563 GLN HG3 . 25043 1 1996 . 1 1 192 192 GLN CA C 13 51.765 0.400 . 1 . . . A 563 GLN CA . 25043 1 1997 . 1 1 192 192 GLN CB C 13 25.430 0.400 . 1 . . . A 563 GLN CB . 25043 1 1998 . 1 1 192 192 GLN CG C 13 31.441 0.400 . 1 . . . A 563 GLN CG . 25043 1 1999 . 1 1 192 192 GLN N N 15 125.147 0.400 . 1 . . . A 563 GLN N . 25043 1 2000 . 1 1 193 193 MET H H 1 9.241 0.020 . 1 . . . A 564 MET H . 25043 1 2001 . 1 1 193 193 MET HA H 1 4.556 0.020 . 1 . . . A 564 MET HA . 25043 1 2002 . 1 1 193 193 MET HB2 H 1 1.887 0.020 . 1 . . . A 564 MET HB2 . 25043 1 2003 . 1 1 193 193 MET HB3 H 1 2.138 0.020 . 1 . . . A 564 MET HB3 . 25043 1 2004 . 1 1 193 193 MET HG2 H 1 2.756 0.020 . 2 . . . A 564 MET HG2 . 25043 1 2005 . 1 1 193 193 MET HG3 H 1 2.516 0.020 . 2 . . . A 564 MET HG3 . 25043 1 2006 . 1 1 193 193 MET HE1 H 1 1.417 0.020 . 1 . . . A 564 MET HE1 . 25043 1 2007 . 1 1 193 193 MET HE2 H 1 1.417 0.020 . 1 . . . A 564 MET HE2 . 25043 1 2008 . 1 1 193 193 MET HE3 H 1 1.417 0.020 . 1 . . . A 564 MET HE3 . 25043 1 2009 . 1 1 193 193 MET CA C 13 53.072 0.400 . 1 . . . A 564 MET CA . 25043 1 2010 . 1 1 193 193 MET CB C 13 32.556 0.400 . 1 . . . A 564 MET CB . 25043 1 2011 . 1 1 193 193 MET CG C 13 30.686 0.400 . 1 . . . A 564 MET CG . 25043 1 2012 . 1 1 193 193 MET CE C 13 14.077 0.400 . 1 . . . A 564 MET CE . 25043 1 2013 . 1 1 193 193 MET N N 15 126.933 0.400 . 1 . . . A 564 MET N . 25043 1 2014 . 1 1 194 194 LYS H H 1 8.690 0.020 . 1 . . . A 565 LYS H . 25043 1 2015 . 1 1 194 194 LYS HA H 1 3.940 0.020 . 1 . . . A 565 LYS HA . 25043 1 2016 . 1 1 194 194 LYS HB2 H 1 1.792 0.020 . 2 . . . A 565 LYS HB2 . 25043 1 2017 . 1 1 194 194 LYS HB3 H 1 1.727 0.020 . 2 . . . A 565 LYS HB3 . 25043 1 2018 . 1 1 194 194 LYS HG2 H 1 1.376 0.020 . 2 . . . A 565 LYS HG2 . 25043 1 2019 . 1 1 194 194 LYS HG3 H 1 1.520 0.020 . 2 . . . A 565 LYS HG3 . 25043 1 2020 . 1 1 194 194 LYS HD2 H 1 1.705 0.020 . 2 . . . A 565 LYS HD2 . 25043 1 2021 . 1 1 194 194 LYS HD3 H 1 1.705 0.020 . 2 . . . A 565 LYS HD3 . 25043 1 2022 . 1 1 194 194 LYS HE2 H 1 3.018 0.020 . 2 . . . A 565 LYS HE2 . 25043 1 2023 . 1 1 194 194 LYS HE3 H 1 3.018 0.020 . 2 . . . A 565 LYS HE3 . 25043 1 2024 . 1 1 194 194 LYS CA C 13 54.565 0.400 . 1 . . . A 565 LYS CA . 25043 1 2025 . 1 1 194 194 LYS CB C 13 30.176 0.400 . 1 . . . A 565 LYS CB . 25043 1 2026 . 1 1 194 194 LYS CG C 13 22.223 0.400 . 1 . . . A 565 LYS CG . 25043 1 2027 . 1 1 194 194 LYS CD C 13 26.446 0.400 . 1 . . . A 565 LYS CD . 25043 1 2028 . 1 1 194 194 LYS CE C 13 39.433 0.400 . 1 . . . A 565 LYS CE . 25043 1 2029 . 1 1 194 194 LYS N N 15 123.574 0.400 . 1 . . . A 565 LYS N . 25043 1 2030 . 1 1 195 195 ASN H H 1 8.736 0.020 . 1 . . . A 566 ASN H . 25043 1 2031 . 1 1 195 195 ASN HA H 1 5.074 0.020 . 1 . . . A 566 ASN HA . 25043 1 2032 . 1 1 195 195 ASN HB2 H 1 3.349 0.020 . 2 . . . A 566 ASN HB2 . 25043 1 2033 . 1 1 195 195 ASN HB3 H 1 2.928 0.020 . 2 . . . A 566 ASN HB3 . 25043 1 2034 . 1 1 195 195 ASN HD21 H 1 7.246 0.020 . 2 . . . A 566 ASN HD21 . 25043 1 2035 . 1 1 195 195 ASN HD22 H 1 7.829 0.020 . 2 . . . A 566 ASN HD22 . 25043 1 2036 . 1 1 195 195 ASN CA C 13 46.262 0.400 . 1 . . . A 566 ASN CA . 25043 1 2037 . 1 1 195 195 ASN CB C 13 37.613 0.400 . 1 . . . A 566 ASN CB . 25043 1 2038 . 1 1 195 195 ASN N N 15 121.195 0.400 . 1 . . . A 566 ASN N . 25043 1 2039 . 1 1 195 195 ASN ND2 N 15 113.034 0.400 . 1 . . . A 566 ASN ND2 . 25043 1 2040 . 1 1 196 196 PRO HA H 1 4.416 0.020 . 1 . . . A 567 PRO HA . 25043 1 2041 . 1 1 196 196 PRO HB2 H 1 1.930 0.020 . 1 . . . A 567 PRO HB2 . 25043 1 2042 . 1 1 196 196 PRO HB3 H 1 2.362 0.020 . 1 . . . A 567 PRO HB3 . 25043 1 2043 . 1 1 196 196 PRO HG2 H 1 1.997 0.020 . 1 . . . A 567 PRO HG2 . 25043 1 2044 . 1 1 196 196 PRO HG3 H 1 2.016 0.020 . 1 . . . A 567 PRO HG3 . 25043 1 2045 . 1 1 196 196 PRO HD2 H 1 3.958 0.020 . 2 . . . A 567 PRO HD2 . 25043 1 2046 . 1 1 196 196 PRO HD3 H 1 3.958 0.020 . 2 . . . A 567 PRO HD3 . 25043 1 2047 . 1 1 196 196 PRO CA C 13 61.265 0.400 . 1 . . . A 567 PRO CA . 25043 1 2048 . 1 1 196 196 PRO CB C 13 29.677 0.400 . 1 . . . A 567 PRO CB . 25043 1 2049 . 1 1 196 196 PRO CG C 13 24.349 0.400 . 1 . . . A 567 PRO CG . 25043 1 2050 . 1 1 196 196 PRO CD C 13 47.977 0.400 . 1 . . . A 567 PRO CD . 25043 1 2051 . 1 1 197 197 ASN H H 1 7.866 0.020 . 1 . . . A 568 ASN H . 25043 1 2052 . 1 1 197 197 ASN HA H 1 4.988 0.020 . 1 . . . A 568 ASN HA . 25043 1 2053 . 1 1 197 197 ASN HB2 H 1 3.065 0.020 . 2 . . . A 568 ASN HB2 . 25043 1 2054 . 1 1 197 197 ASN HB3 H 1 2.722 0.020 . 2 . . . A 568 ASN HB3 . 25043 1 2055 . 1 1 197 197 ASN CA C 13 50.022 0.400 . 1 . . . A 568 ASN CA . 25043 1 2056 . 1 1 197 197 ASN CB C 13 37.492 0.400 . 1 . . . A 568 ASN CB . 25043 1 2057 . 1 1 197 197 ASN N N 15 113.287 0.400 . 1 . . . A 568 ASN N . 25043 1 2058 . 1 1 198 198 GLY H H 1 7.403 0.020 . 1 . . . A 569 GLY H . 25043 1 2059 . 1 1 198 198 GLY HA2 H 1 4.297 0.020 . 1 . . . A 569 GLY HA2 . 25043 1 2060 . 1 1 198 198 GLY HA3 H 1 4.160 0.020 . 1 . . . A 569 GLY HA3 . 25043 1 2061 . 1 1 198 198 GLY CA C 13 43.121 0.400 . 1 . . . A 569 GLY CA . 25043 1 2062 . 1 1 198 198 GLY N N 15 108.585 0.400 . 1 . . . A 569 GLY N . 25043 1 2063 . 1 1 199 199 PRO HA H 1 4.371 0.020 . 1 . . . A 570 PRO HA . 25043 1 2064 . 1 1 199 199 PRO HB2 H 1 2.042 0.020 . 2 . . . A 570 PRO HB2 . 25043 1 2065 . 1 1 199 199 PRO HB3 H 1 1.431 0.020 . 2 . . . A 570 PRO HB3 . 25043 1 2066 . 1 1 199 199 PRO HG2 H 1 1.896 0.020 . 1 . . . A 570 PRO HG2 . 25043 1 2067 . 1 1 199 199 PRO HG3 H 1 1.505 0.020 . 1 . . . A 570 PRO HG3 . 25043 1 2068 . 1 1 199 199 PRO HD2 H 1 3.456 0.020 . 1 . . . A 570 PRO HD2 . 25043 1 2069 . 1 1 199 199 PRO HD3 H 1 3.596 0.020 . 1 . . . A 570 PRO HD3 . 25043 1 2070 . 1 1 199 199 PRO CA C 13 61.106 0.400 . 1 . . . A 570 PRO CA . 25043 1 2071 . 1 1 199 199 PRO CB C 13 29.373 0.400 . 1 . . . A 570 PRO CB . 25043 1 2072 . 1 1 199 199 PRO CG C 13 23.743 0.400 . 1 . . . A 570 PRO CG . 25043 1 2073 . 1 1 199 199 PRO CD C 13 46.860 0.400 . 1 . . . A 570 PRO CD . 25043 1 2074 . 1 1 200 200 TYR H H 1 7.899 0.020 . 1 . . . A 571 TYR H . 25043 1 2075 . 1 1 200 200 TYR HA H 1 5.171 0.020 . 1 . . . A 571 TYR HA . 25043 1 2076 . 1 1 200 200 TYR HB2 H 1 3.125 0.020 . 1 . . . A 571 TYR HB2 . 25043 1 2077 . 1 1 200 200 TYR HB3 H 1 2.873 0.020 . 1 . . . A 571 TYR HB3 . 25043 1 2078 . 1 1 200 200 TYR HD1 H 1 7.124 0.020 . 1 . . . A 571 TYR HD1 . 25043 1 2079 . 1 1 200 200 TYR HD2 H 1 7.124 0.020 . 1 . . . A 571 TYR HD2 . 25043 1 2080 . 1 1 200 200 TYR HE1 H 1 6.786 0.020 . 1 . . . A 571 TYR HE1 . 25043 1 2081 . 1 1 200 200 TYR HE2 H 1 6.786 0.020 . 1 . . . A 571 TYR HE2 . 25043 1 2082 . 1 1 200 200 TYR CA C 13 51.906 0.400 . 1 . . . A 571 TYR CA . 25043 1 2083 . 1 1 200 200 TYR CB C 13 35.681 0.400 . 1 . . . A 571 TYR CB . 25043 1 2084 . 1 1 200 200 TYR CD2 C 13 130.814 0.400 . 1 . . . A 571 TYR CD2 . 25043 1 2085 . 1 1 200 200 TYR CE2 C 13 115.479 0.400 . 1 . . . A 571 TYR CE2 . 25043 1 2086 . 1 1 200 200 TYR N N 15 119.225 0.400 . 1 . . . A 571 TYR N . 25043 1 2087 . 1 1 201 201 PRO HA H 1 4.775 0.020 . 1 . . . A 572 PRO HA . 25043 1 2088 . 1 1 201 201 PRO HB2 H 1 1.600 0.020 . 1 . . . A 572 PRO HB2 . 25043 1 2089 . 1 1 201 201 PRO HB3 H 1 2.107 0.020 . 1 . . . A 572 PRO HB3 . 25043 1 2090 . 1 1 201 201 PRO HG2 H 1 2.004 0.020 . 2 . . . A 572 PRO HG2 . 25043 1 2091 . 1 1 201 201 PRO HG3 H 1 1.901 0.020 . 2 . . . A 572 PRO HG3 . 25043 1 2092 . 1 1 201 201 PRO HD2 H 1 3.784 0.020 . 1 . . . A 572 PRO HD2 . 25043 1 2093 . 1 1 201 201 PRO HD3 H 1 3.957 0.020 . 1 . . . A 572 PRO HD3 . 25043 1 2094 . 1 1 201 201 PRO CA C 13 59.914 0.400 . 1 . . . A 572 PRO CA . 25043 1 2095 . 1 1 201 201 PRO CB C 13 30.353 0.400 . 1 . . . A 572 PRO CB . 25043 1 2096 . 1 1 201 201 PRO CG C 13 23.885 0.400 . 1 . . . A 572 PRO CG . 25043 1 2097 . 1 1 201 201 PRO CD C 13 47.974 0.400 . 1 . . . A 572 PRO CD . 25043 1 2098 . 1 1 202 202 TYR H H 1 8.743 0.020 . 1 . . . A 573 TYR H . 25043 1 2099 . 1 1 202 202 TYR HA H 1 4.606 0.020 . 1 . . . A 573 TYR HA . 25043 1 2100 . 1 1 202 202 TYR HB2 H 1 3.260 0.020 . 1 . . . A 573 TYR HB2 . 25043 1 2101 . 1 1 202 202 TYR HB3 H 1 2.549 0.020 . 1 . . . A 573 TYR HB3 . 25043 1 2102 . 1 1 202 202 TYR HD1 H 1 6.622 0.020 . 1 . . . A 573 TYR HD1 . 25043 1 2103 . 1 1 202 202 TYR HD2 H 1 6.622 0.020 . 1 . . . A 573 TYR HD2 . 25043 1 2104 . 1 1 202 202 TYR CA C 13 55.477 0.400 . 1 . . . A 573 TYR CA . 25043 1 2105 . 1 1 202 202 TYR CB C 13 36.680 0.400 . 1 . . . A 573 TYR CB . 25043 1 2106 . 1 1 202 202 TYR N N 15 120.703 0.400 . 1 . . . A 573 TYR N . 25043 1 2107 . 1 1 203 203 THR H H 1 8.949 0.020 . 1 . . . A 574 THR H . 25043 1 2108 . 1 1 203 203 THR HA H 1 4.231 0.020 . 1 . . . A 574 THR HA . 25043 1 2109 . 1 1 203 203 THR HB H 1 4.098 0.020 . 1 . . . A 574 THR HB . 25043 1 2110 . 1 1 203 203 THR HG21 H 1 1.193 0.020 . 1 . . . A 574 THR HG21 . 25043 1 2111 . 1 1 203 203 THR HG22 H 1 1.193 0.020 . 1 . . . A 574 THR HG22 . 25043 1 2112 . 1 1 203 203 THR HG23 H 1 1.193 0.020 . 1 . . . A 574 THR HG23 . 25043 1 2113 . 1 1 203 203 THR CA C 13 59.444 0.400 . 1 . . . A 574 THR CA . 25043 1 2114 . 1 1 203 203 THR CB C 13 66.043 0.400 . 1 . . . A 574 THR CB . 25043 1 2115 . 1 1 203 203 THR CG2 C 13 18.659 0.400 . 1 . . . A 574 THR CG2 . 25043 1 2116 . 1 1 203 203 THR N N 15 127.132 0.400 . 1 . . . A 574 THR N . 25043 1 2117 . 1 1 204 204 LEU H H 1 8.773 0.020 . 1 . . . A 575 LEU H . 25043 1 2118 . 1 1 204 204 LEU HA H 1 3.897 0.020 . 1 . . . A 575 LEU HA . 25043 1 2119 . 1 1 204 204 LEU HB2 H 1 1.528 0.020 . 1 . . . A 575 LEU HB2 . 25043 1 2120 . 1 1 204 204 LEU HB3 H 1 2.169 0.020 . 1 . . . A 575 LEU HB3 . 25043 1 2121 . 1 1 204 204 LEU HG H 1 1.433 0.020 . 1 . . . A 575 LEU HG . 25043 1 2122 . 1 1 204 204 LEU HD11 H 1 0.990 0.020 . 2 . . . A 575 LEU HD11 . 25043 1 2123 . 1 1 204 204 LEU HD12 H 1 0.990 0.020 . 2 . . . A 575 LEU HD12 . 25043 1 2124 . 1 1 204 204 LEU HD13 H 1 0.990 0.020 . 2 . . . A 575 LEU HD13 . 25043 1 2125 . 1 1 204 204 LEU HD21 H 1 0.982 0.020 . 2 . . . A 575 LEU HD21 . 25043 1 2126 . 1 1 204 204 LEU HD22 H 1 0.982 0.020 . 2 . . . A 575 LEU HD22 . 25043 1 2127 . 1 1 204 204 LEU HD23 H 1 0.982 0.020 . 2 . . . A 575 LEU HD23 . 25043 1 2128 . 1 1 204 204 LEU CA C 13 53.588 0.400 . 1 . . . A 575 LEU CA . 25043 1 2129 . 1 1 204 204 LEU CB C 13 40.593 0.400 . 1 . . . A 575 LEU CB . 25043 1 2130 . 1 1 204 204 LEU CG C 13 24.439 0.400 . 1 . . . A 575 LEU CG . 25043 1 2131 . 1 1 204 204 LEU CD1 C 13 23.315 0.400 . 1 . . . A 575 LEU CD1 . 25043 1 2132 . 1 1 204 204 LEU CD2 C 13 21.159 0.400 . 1 . . . A 575 LEU CD2 . 25043 1 2133 . 1 1 204 204 LEU N N 15 131.682 0.400 . 1 . . . A 575 LEU N . 25043 1 2134 . 1 1 205 205 LYS H H 1 7.858 0.020 . 1 . . . A 576 LYS H . 25043 1 2135 . 1 1 205 205 LYS HA H 1 4.392 0.020 . 1 . . . A 576 LYS HA . 25043 1 2136 . 1 1 205 205 LYS HB2 H 1 0.559 0.020 . 2 . . . A 576 LYS HB2 . 25043 1 2137 . 1 1 205 205 LYS HB3 H 1 -0.247 0.020 . 2 . . . A 576 LYS HB3 . 25043 1 2138 . 1 1 205 205 LYS HG2 H 1 1.087 0.020 . 1 . . . A 576 LYS HG2 . 25043 1 2139 . 1 1 205 205 LYS HG3 H 1 1.437 0.020 . 1 . . . A 576 LYS HG3 . 25043 1 2140 . 1 1 205 205 LYS HD2 H 1 1.536 0.020 . 2 . . . A 576 LYS HD2 . 25043 1 2141 . 1 1 205 205 LYS HD3 H 1 1.457 0.020 . 2 . . . A 576 LYS HD3 . 25043 1 2142 . 1 1 205 205 LYS HE2 H 1 2.999 0.020 . 2 . . . A 576 LYS HE2 . 25043 1 2143 . 1 1 205 205 LYS HE3 H 1 2.961 0.020 . 2 . . . A 576 LYS HE3 . 25043 1 2144 . 1 1 205 205 LYS CA C 13 51.670 0.400 . 1 . . . A 576 LYS CA . 25043 1 2145 . 1 1 205 205 LYS CB C 13 31.434 0.400 . 1 . . . A 576 LYS CB . 25043 1 2146 . 1 1 205 205 LYS CG C 13 23.480 0.400 . 1 . . . A 576 LYS CG . 25043 1 2147 . 1 1 205 205 LYS CD C 13 27.474 0.400 . 1 . . . A 576 LYS CD . 25043 1 2148 . 1 1 205 205 LYS CE C 13 39.440 0.400 . 1 . . . A 576 LYS CE . 25043 1 2149 . 1 1 205 205 LYS N N 15 123.405 0.400 . 1 . . . A 576 LYS N . 25043 1 2150 . 1 1 206 206 LEU H H 1 7.564 0.020 . 1 . . . A 577 LEU H . 25043 1 2151 . 1 1 206 206 LEU HA H 1 5.704 0.020 . 1 . . . A 577 LEU HA . 25043 1 2152 . 1 1 206 206 LEU HB2 H 1 1.168 0.020 . 1 . . . A 577 LEU HB2 . 25043 1 2153 . 1 1 206 206 LEU HB3 H 1 1.145 0.020 . 1 . . . A 577 LEU HB3 . 25043 1 2154 . 1 1 206 206 LEU HG H 1 1.340 0.020 . 1 . . . A 577 LEU HG . 25043 1 2155 . 1 1 206 206 LEU HD11 H 1 0.837 0.020 . 2 . . . A 577 LEU HD11 . 25043 1 2156 . 1 1 206 206 LEU HD12 H 1 0.837 0.020 . 2 . . . A 577 LEU HD12 . 25043 1 2157 . 1 1 206 206 LEU HD13 H 1 0.837 0.020 . 2 . . . A 577 LEU HD13 . 25043 1 2158 . 1 1 206 206 LEU HD21 H 1 0.648 0.020 . 2 . . . A 577 LEU HD21 . 25043 1 2159 . 1 1 206 206 LEU HD22 H 1 0.648 0.020 . 2 . . . A 577 LEU HD22 . 25043 1 2160 . 1 1 206 206 LEU HD23 H 1 0.648 0.020 . 2 . . . A 577 LEU HD23 . 25043 1 2161 . 1 1 206 206 LEU CA C 13 49.299 0.400 . 1 . . . A 577 LEU CA . 25043 1 2162 . 1 1 206 206 LEU CB C 13 44.623 0.400 . 1 . . . A 577 LEU CB . 25043 1 2163 . 1 1 206 206 LEU CG C 13 24.635 0.400 . 1 . . . A 577 LEU CG . 25043 1 2164 . 1 1 206 206 LEU CD1 C 13 21.765 0.400 . 1 . . . A 577 LEU CD1 . 25043 1 2165 . 1 1 206 206 LEU CD2 C 13 23.845 0.400 . 1 . . . A 577 LEU CD2 . 25043 1 2166 . 1 1 206 206 LEU N N 15 115.883 0.400 . 1 . . . A 577 LEU N . 25043 1 2167 . 1 1 207 207 CYS H H 1 8.916 0.020 . 1 . . . A 578 CYS H . 25043 1 2168 . 1 1 207 207 CYS HA H 1 4.529 0.020 . 1 . . . A 578 CYS HA . 25043 1 2169 . 1 1 207 207 CYS HB2 H 1 3.628 0.020 . 2 . . . A 578 CYS HB2 . 25043 1 2170 . 1 1 207 207 CYS HB3 H 1 3.003 0.020 . 2 . . . A 578 CYS HB3 . 25043 1 2171 . 1 1 207 207 CYS CA C 13 53.765 0.400 . 1 . . . A 578 CYS CA . 25043 1 2172 . 1 1 207 207 CYS CB C 13 28.496 0.400 . 1 . . . A 578 CYS CB . 25043 1 2173 . 1 1 207 207 CYS N N 15 115.022 0.400 . 1 . . . A 578 CYS N . 25043 1 2174 . 1 1 208 208 PHE H H 1 9.072 0.020 . 1 . . . A 579 PHE H . 25043 1 2175 . 1 1 208 208 PHE HA H 1 5.072 0.020 . 1 . . . A 579 PHE HA . 25043 1 2176 . 1 1 208 208 PHE HB2 H 1 3.350 0.020 . 2 . . . A 579 PHE HB2 . 25043 1 2177 . 1 1 208 208 PHE HB3 H 1 2.931 0.020 . 2 . . . A 579 PHE HB3 . 25043 1 2178 . 1 1 208 208 PHE CA C 13 57.603 0.400 . 1 . . . A 579 PHE CA . 25043 1 2179 . 1 1 208 208 PHE CB C 13 37.586 0.400 . 1 . . . A 579 PHE CB . 25043 1 2180 . 1 1 208 208 PHE N N 15 115.795 0.400 . 1 . . . A 579 PHE N . 25043 1 2181 . 1 1 209 209 SER H H 1 8.635 0.020 . 1 . . . A 580 SER H . 25043 1 2182 . 1 1 209 209 SER HA H 1 5.569 0.020 . 1 . . . A 580 SER HA . 25043 1 2183 . 1 1 209 209 SER HB2 H 1 3.905 0.020 . 2 . . . A 580 SER HB2 . 25043 1 2184 . 1 1 209 209 SER HB3 H 1 3.627 0.020 . 2 . . . A 580 SER HB3 . 25043 1 2185 . 1 1 209 209 SER CA C 13 53.694 0.400 . 1 . . . A 580 SER CA . 25043 1 2186 . 1 1 209 209 SER CB C 13 62.024 0.400 . 1 . . . A 580 SER CB . 25043 1 2187 . 1 1 209 209 SER N N 15 115.714 0.400 . 1 . . . A 580 SER N . 25043 1 2188 . 1 1 210 210 THR H H 1 8.559 0.020 . 1 . . . A 581 THR H . 25043 1 2189 . 1 1 210 210 THR HA H 1 4.453 0.020 . 1 . . . A 581 THR HA . 25043 1 2190 . 1 1 210 210 THR HB H 1 4.393 0.020 . 1 . . . A 581 THR HB . 25043 1 2191 . 1 1 210 210 THR HG21 H 1 1.228 0.020 . 1 . . . A 581 THR HG21 . 25043 1 2192 . 1 1 210 210 THR HG22 H 1 1.228 0.020 . 1 . . . A 581 THR HG22 . 25043 1 2193 . 1 1 210 210 THR HG23 H 1 1.228 0.020 . 1 . . . A 581 THR HG23 . 25043 1 2194 . 1 1 210 210 THR CA C 13 59.444 0.400 . 1 . . . A 581 THR CA . 25043 1 2195 . 1 1 210 210 THR CB C 13 66.569 0.400 . 1 . . . A 581 THR CB . 25043 1 2196 . 1 1 210 210 THR CG2 C 13 19.337 0.400 . 1 . . . A 581 THR CG2 . 25043 1 2197 . 1 1 210 210 THR N N 15 118.043 0.400 . 1 . . . A 581 THR N . 25043 1 2198 . 1 1 211 211 ALA H H 1 8.807 0.020 . 1 . . . A 582 ALA H . 25043 1 2199 . 1 1 211 211 ALA HA H 1 4.296 0.020 . 1 . . . A 582 ALA HA . 25043 1 2200 . 1 1 211 211 ALA HB1 H 1 1.478 0.020 . 1 . . . A 582 ALA HB1 . 25043 1 2201 . 1 1 211 211 ALA HB2 H 1 1.478 0.020 . 1 . . . A 582 ALA HB2 . 25043 1 2202 . 1 1 211 211 ALA HB3 H 1 1.478 0.020 . 1 . . . A 582 ALA HB3 . 25043 1 2203 . 1 1 211 211 ALA CA C 13 49.892 0.400 . 1 . . . A 582 ALA CA . 25043 1 2204 . 1 1 211 211 ALA CB C 13 16.825 0.400 . 1 . . . A 582 ALA CB . 25043 1 2205 . 1 1 211 211 ALA N N 15 127.341 0.400 . 1 . . . A 582 ALA N . 25043 1 2206 . 1 1 212 212 GLN H H 1 8.421 0.020 . 1 . . . A 583 GLN H . 25043 1 2207 . 1 1 212 212 GLN HA H 1 4.173 0.020 . 1 . . . A 583 GLN HA . 25043 1 2208 . 1 1 212 212 GLN HB2 H 1 1.961 0.020 . 2 . . . A 583 GLN HB2 . 25043 1 2209 . 1 1 212 212 GLN HB3 H 1 1.961 0.020 . 2 . . . A 583 GLN HB3 . 25043 1 2210 . 1 1 212 212 GLN HG2 H 1 2.382 0.020 . 2 . . . A 583 GLN HG2 . 25043 1 2211 . 1 1 212 212 GLN HG3 H 1 2.308 0.020 . 2 . . . A 583 GLN HG3 . 25043 1 2212 . 1 1 212 212 GLN HE21 H 1 7.495 0.020 . 2 . . . A 583 GLN HE21 . 25043 1 2213 . 1 1 212 212 GLN HE22 H 1 6.856 0.020 . 2 . . . A 583 GLN HE22 . 25043 1 2214 . 1 1 212 212 GLN CA C 13 54.009 0.400 . 1 . . . A 583 GLN CA . 25043 1 2215 . 1 1 212 212 GLN CB C 13 27.096 0.400 . 1 . . . A 583 GLN CB . 25043 1 2216 . 1 1 212 212 GLN CG C 13 31.494 0.400 . 1 . . . A 583 GLN CG . 25043 1 2217 . 1 1 212 212 GLN N N 15 118.850 0.400 . 1 . . . A 583 GLN N . 25043 1 2218 . 1 1 212 212 GLN NE2 N 15 112.248 0.400 . 1 . . . A 583 GLN NE2 . 25043 1 2219 . 1 1 213 213 HIS H H 1 7.936 0.020 . 1 . . . A 584 HIS H . 25043 1 2220 . 1 1 213 213 HIS HA H 1 4.668 0.020 . 1 . . . A 584 HIS HA . 25043 1 2221 . 1 1 213 213 HIS HB2 H 1 3.038 0.020 . 2 . . . A 584 HIS HB2 . 25043 1 2222 . 1 1 213 213 HIS HB3 H 1 3.331 0.020 . 2 . . . A 584 HIS HB3 . 25043 1 2223 . 1 1 213 213 HIS HD2 H 1 7.223 0.020 . 1 . . . A 584 HIS HD2 . 25043 1 2224 . 1 1 213 213 HIS HE1 H 1 7.628 0.020 . 1 . . . A 584 HIS HE1 . 25043 1 2225 . 1 1 213 213 HIS CB C 13 29.146 0.400 . 1 . . . A 584 HIS CB . 25043 1 2226 . 1 1 213 213 HIS CD2 C 13 117.458 0.400 . 1 . . . A 584 HIS CD2 . 25043 1 2227 . 1 1 213 213 HIS CE1 C 13 136.254 0.400 . 1 . . . A 584 HIS CE1 . 25043 1 2228 . 1 1 213 213 HIS N N 15 114.085 0.400 . 1 . . . A 584 HIS N . 25043 1 2229 . 1 1 214 214 ALA H H 1 8.871 0.020 . 1 . . . A 585 ALA H . 25043 1 2230 . 1 1 214 214 ALA HA H 1 4.450 0.020 . 1 . . . A 585 ALA HA . 25043 1 2231 . 1 1 214 214 ALA HB1 H 1 1.247 0.020 . 1 . . . A 585 ALA HB1 . 25043 1 2232 . 1 1 214 214 ALA HB2 H 1 1.247 0.020 . 1 . . . A 585 ALA HB2 . 25043 1 2233 . 1 1 214 214 ALA HB3 H 1 1.247 0.020 . 1 . . . A 585 ALA HB3 . 25043 1 2234 . 1 1 214 214 ALA CA C 13 49.011 0.400 . 1 . . . A 585 ALA CA . 25043 1 2235 . 1 1 214 214 ALA CB C 13 16.327 0.400 . 1 . . . A 585 ALA CB . 25043 1 2236 . 1 1 214 214 ALA N N 15 125.305 0.400 . 1 . . . A 585 ALA N . 25043 1 2237 . 1 1 215 215 SER H H 1 7.628 0.020 . 1 . . . A 586 SER H . 25043 1 2238 . 1 1 215 215 SER HA H 1 4.258 0.020 . 1 . . . A 586 SER HA . 25043 1 2239 . 1 1 215 215 SER HB2 H 1 3.838 0.020 . 2 . . . A 586 SER HB2 . 25043 1 2240 . 1 1 215 215 SER HB3 H 1 3.838 0.020 . 2 . . . A 586 SER HB3 . 25043 1 2241 . 1 1 215 215 SER CA C 13 56.870 0.400 . 1 . . . A 586 SER CA . 25043 1 2242 . 1 1 215 215 SER CB C 13 62.182 0.400 . 1 . . . A 586 SER CB . 25043 1 2243 . 1 1 215 215 SER N N 15 120.028 0.400 . 1 . . . A 586 SER N . 25043 1 stop_ save_ save_assigned_chem_shift_list_2 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_2 _Assigned_chem_shift_list.Entry_ID 25043 _Assigned_chem_shift_list.ID 2 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 4 '2D 1H-1H NOESY' . . . 25043 2 5 '2D 1H-1H TOCSY' . . . 25043 2 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 2 $SPARKY . . 25043 2 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 2 2 1 1 A H1' H 1 5.927 0.003 . . . . . B 1 A H1' . 25043 2 2 . 2 2 1 1 A H2 H 1 8.041 0.009 . . . . . B 1 A H2 . 25043 2 3 . 2 2 1 1 A H2' H 1 4.865 0.000 . . . . . B 1 A H2' . 25043 2 4 . 2 2 1 1 A H3' H 1 4.710 0.000 . . . . . B 1 A H3' . 25043 2 5 . 2 2 1 1 A H4' H 1 4.421 0.000 . . . . . B 1 A H4' . 25043 2 6 . 2 2 1 1 A H5' H 1 3.896 0.004 . . . . . B 1 A H5' . 25043 2 7 . 2 2 1 1 A H5'' H 1 3.844 0.004 . . . . . B 1 A H5'' . 25043 2 8 . 2 2 1 1 A H8 H 1 8.130 0.015 . . . . . B 1 A H8 . 25043 2 9 . 2 2 1 1 A C1' C 13 91.148 0.000 . . . . . B 1 A C1' . 25043 2 10 . 2 2 1 1 A C2 C 13 154.823 0.000 . . . . . B 1 A C2 . 25043 2 11 . 2 2 1 1 A C2' C 13 75.556 0.000 . . . . . B 1 A C2' . 25043 2 12 . 2 2 1 1 A C3' C 13 77.767 0.000 . . . . . B 1 A C3' . 25043 2 13 . 2 2 1 1 A C4' C 13 88.318 0.000 . . . . . B 1 A C4' . 25043 2 14 . 2 2 1 1 A C8 C 13 142.845 0.000 . . . . . B 1 A C8 . 25043 2 15 . 2 2 2 2 C H1' H 1 5.923 0.000 . . . . . B 2 C H1' . 25043 2 16 . 2 2 2 2 C H2' H 1 4.385 0.000 . . . . . B 2 C H2' . 25043 2 17 . 2 2 2 2 C H3' H 1 4.755 0.000 . . . . . B 2 C H3' . 25043 2 18 . 2 2 2 2 C H4' H 1 4.368 0.000 . . . . . B 2 C H4' . 25043 2 19 . 2 2 2 2 C H5 H 1 6.017 0.000 . . . . . B 2 C H5 . 25043 2 20 . 2 2 2 2 C H5' H 1 4.279 0.000 . . . . . B 2 C H5' . 25043 2 21 . 2 2 2 2 C H5'' H 1 4.203 0.000 . . . . . B 2 C H5'' . 25043 2 22 . 2 2 2 2 C H6 H 1 7.924 0.000 . . . . . B 2 C H6 . 25043 2 23 . 2 2 2 2 C C1' C 13 91.512 0.000 . . . . . B 2 C C1' . 25043 2 24 . 2 2 2 2 C C2' C 13 77.133 0.000 . . . . . B 2 C C2' . 25043 2 25 . 2 2 2 2 C C3' C 13 77.516 0.000 . . . . . B 2 C C3' . 25043 2 26 . 2 2 2 2 C C4' C 13 86.398 0.000 . . . . . B 2 C C4' . 25043 2 27 . 2 2 2 2 C C5 C 13 98.897 0.000 . . . . . B 2 C C5 . 25043 2 28 . 2 2 2 2 C C5' C 13 64.487 0.036 . . . . . B 2 C C5' . 25043 2 29 . 2 2 2 2 C C6 C 13 143.849 0.000 . . . . . B 2 C C6 . 25043 2 30 . 2 2 3 3 A H1' H 1 5.980 0.000 . . . . . B 3 A H1' . 25043 2 31 . 2 2 3 3 A H2 H 1 8.111 0.000 . . . . . B 3 A H2 . 25043 2 32 . 2 2 3 3 A H2' H 1 4.799 0.000 . . . . . B 3 A H2' . 25043 2 33 . 2 2 3 3 A H3' H 1 4.528 0.000 . . . . . B 3 A H3' . 25043 2 34 . 2 2 3 3 A H4' H 1 4.560 0.000 . . . . . B 3 A H4' . 25043 2 35 . 2 2 3 3 A H5' H 1 4.242 0.000 . . . . . B 3 A H5' . 25043 2 36 . 2 2 3 3 A H5'' H 1 4.110 0.000 . . . . . B 3 A H5'' . 25043 2 37 . 2 2 3 3 A H8 H 1 8.279 0.000 . . . . . B 3 A H8 . 25043 2 38 . 2 2 3 3 A C1' C 13 89.690 0.000 . . . . . B 3 A C1' . 25043 2 39 . 2 2 3 3 A C2 C 13 155.084 0.000 . . . . . B 3 A C2 . 25043 2 40 . 2 2 3 3 A C2' C 13 75.759 0.000 . . . . . B 3 A C2' . 25043 2 41 . 2 2 3 3 A C3' C 13 73.056 0.000 . . . . . B 3 A C3' . 25043 2 42 . 2 2 3 3 A C4' C 13 85.666 0.000 . . . . . B 3 A C4' . 25043 2 43 . 2 2 3 3 A C5' C 13 67.428 0.006 . . . . . B 3 A C5' . 25043 2 44 . 2 2 3 3 A C8 C 13 141.881 0.000 . . . . . B 3 A C8 . 25043 2 45 . 2 2 4 4 C H1' H 1 5.723 0.002 . . . . . B 4 C H1' . 25043 2 46 . 2 2 4 4 C H2' H 1 4.144 0.000 . . . . . B 4 C H2' . 25043 2 47 . 2 2 4 4 C H3' H 1 4.477 0.000 . . . . . B 4 C H3' . 25043 2 48 . 2 2 4 4 C H4' H 1 4.324 0.000 . . . . . B 4 C H4' . 25043 2 49 . 2 2 4 4 C H5 H 1 5.837 0.000 . . . . . B 4 C H5 . 25043 2 50 . 2 2 4 4 C H5' H 1 4.062 0.000 . . . . . B 4 C H5' . 25043 2 51 . 2 2 4 4 C H5'' H 1 4.019 0.000 . . . . . B 4 C H5'' . 25043 2 52 . 2 2 4 4 C H6 H 1 7.532 0.000 . . . . . B 4 C H6 . 25043 2 53 . 2 2 4 4 C C1' C 13 91.615 0.000 . . . . . B 4 C C1' . 25043 2 54 . 2 2 4 4 C C2' C 13 77.052 0.000 . . . . . B 4 C C2' . 25043 2 55 . 2 2 4 4 C C3' C 13 77.635 0.000 . . . . . B 4 C C3' . 25043 2 56 . 2 2 4 4 C C4' C 13 84.285 0.000 . . . . . B 4 C C4' . 25043 2 57 . 2 2 4 4 C C5 C 13 98.625 0.000 . . . . . B 4 C C5 . 25043 2 58 . 2 2 4 4 C C5' C 13 66.168 0.000 . . . . . B 4 C C5' . 25043 2 59 . 2 2 4 4 C C6 C 13 142.447 0.000 . . . . . B 4 C C6 . 25043 2 60 . 2 2 5 5 A H1' H 1 6.040 0.000 . . . . . B 5 A H1' . 25043 2 61 . 2 2 5 5 A H2 H 1 8.152 0.009 . . . . . B 5 A H2 . 25043 2 62 . 2 2 5 5 A H2' H 1 4.663 0.000 . . . . . B 5 A H2' . 25043 2 63 . 2 2 5 5 A H3' H 1 4.440 0.000 . . . . . B 5 A H3' . 25043 2 64 . 2 2 5 5 A H4' H 1 4.325 0.000 . . . . . B 5 A H4' . 25043 2 65 . 2 2 5 5 A H5' H 1 4.196 0.000 . . . . . B 5 A H5' . 25043 2 66 . 2 2 5 5 A H5'' H 1 4.105 0.000 . . . . . B 5 A H5'' . 25043 2 67 . 2 2 5 5 A H8 H 1 8.307 0.000 . . . . . B 5 A H8 . 25043 2 68 . 2 2 5 5 A C1' C 13 90.101 0.000 . . . . . B 5 A C1' . 25043 2 69 . 2 2 5 5 A C2 C 13 155.503 0.000 . . . . . B 5 A C2 . 25043 2 70 . 2 2 5 5 A C2' C 13 76.824 0.000 . . . . . B 5 A C2' . 25043 2 71 . 2 2 5 5 A C3' C 13 72.748 0.000 . . . . . B 5 A C3' . 25043 2 72 . 2 2 5 5 A C4' C 13 86.085 0.000 . . . . . B 5 A C4' . 25043 2 73 . 2 2 5 5 A C5' C 13 68.055 0.003 . . . . . B 5 A C5' . 25043 2 74 . 2 2 5 5 A C8 C 13 142.160 0.000 . . . . . B 5 A C8 . 25043 2 stop_ save_ save_assigned_chem_shift_list_3 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_3 _Assigned_chem_shift_list.Entry_ID 25043 _Assigned_chem_shift_list.ID 3 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 4 '2D 1H-1H NOESY' . . . 25043 3 5 '2D 1H-1H TOCSY' . . . 25043 3 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 2 $SPARKY . . 25043 3 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 3 2 1 1 A H1' H 1 5.909 0.000 . . . . . B 1 A H1' . 25043 3 2 . 3 2 1 1 A H2 H 1 8.135 0.000 . . . . . B 1 A H2 . 25043 3 3 . 3 2 1 1 A H2' H 1 4.879 0.000 . . . . . B 1 A H2' . 25043 3 4 . 3 2 1 1 A H3' H 1 4.725 0.000 . . . . . B 1 A H3' . 25043 3 5 . 3 2 1 1 A H4' H 1 4.411 0.000 . . . . . B 1 A H4' . 25043 3 6 . 3 2 1 1 A H5' H 1 3.807 0.000 . . . . . B 1 A H5' . 25043 3 7 . 3 2 1 1 A H5'' H 1 3.907 0.000 . . . . . B 1 A H5'' . 25043 3 8 . 3 2 1 1 A H8 H 1 8.290 0.000 . . . . . B 1 A H8 . 25043 3 9 . 3 2 1 1 A C1' C 13 91.257 0.000 . . . . . B 1 A C1' . 25043 3 10 . 3 2 1 1 A C2 C 13 155.162 0.000 . . . . . B 1 A C2 . 25043 3 11 . 3 2 1 1 A C2' C 13 75.261 0.000 . . . . . B 1 A C2' . 25043 3 12 . 3 2 1 1 A C3' C 13 77.056 0.000 . . . . . B 1 A C3' . 25043 3 13 . 3 2 1 1 A C4' C 13 87.617 0.000 . . . . . B 1 A C4' . 25043 3 14 . 3 2 1 1 A C5' C 13 66.531 0.010 . . . . . B 1 A C5' . 25043 3 15 . 3 2 1 1 A C8 C 13 143.139 0.000 . . . . . B 1 A C8 . 25043 3 16 . 3 2 2 2 C H1' H 1 5.871 0.000 . . . . . B 2 C H1' . 25043 3 17 . 3 2 2 2 C H2' H 1 4.328 0.000 . . . . . B 2 C H2' . 25043 3 18 . 3 2 2 2 C H3' H 1 4.404 0.000 . . . . . B 2 C H3' . 25043 3 19 . 3 2 2 2 C H4' H 1 4.433 0.000 . . . . . B 2 C H4' . 25043 3 20 . 3 2 2 2 C H5 H 1 5.888 0.000 . . . . . B 2 C H5 . 25043 3 21 . 3 2 2 2 C H5' H 1 4.126 0.000 . . . . . B 2 C H5' . 25043 3 22 . 3 2 2 2 C H5'' H 1 4.233 0.000 . . . . . B 2 C H5'' . 25043 3 23 . 3 2 2 2 C H6 H 1 7.732 0.000 . . . . . B 2 C H6 . 25043 3 24 . 3 2 2 2 C C1' C 13 91.183 0.000 . . . . . B 2 C C1' . 25043 3 25 . 3 2 2 2 C C2' C 13 76.336 0.000 . . . . . B 2 C C2' . 25043 3 26 . 3 2 2 2 C C3' C 13 72.514 0.000 . . . . . B 2 C C3' . 25043 3 27 . 3 2 2 2 C C4' C 13 87.181 0.000 . . . . . B 2 C C4' . 25043 3 28 . 3 2 2 2 C C5 C 13 98.913 0.000 . . . . . B 2 C C5 . 25043 3 29 . 3 2 2 2 C C5' C 13 67.290 0.007 . . . . . B 2 C C5' . 25043 3 30 . 3 2 2 2 C C6 C 13 143.319 0.000 . . . . . B 2 C C6 . 25043 3 31 . 3 2 3 3 A H1' H 1 5.975 0.000 . . . . . B 3 A H1' . 25043 3 32 . 3 2 3 3 A H2 H 1 8.145 0.000 . . . . . B 3 A H2 . 25043 3 33 . 3 2 3 3 A H2' H 1 4.805 0.000 . . . . . B 3 A H2' . 25043 3 34 . 3 2 3 3 A H3' H 1 4.513 0.000 . . . . . B 3 A H3' . 25043 3 35 . 3 2 3 3 A H4' H 1 4.313 0.000 . . . . . B 3 A H4' . 25043 3 36 . 3 2 3 3 A H5' H 1 4.024 0.000 . . . . . B 3 A H5' . 25043 3 37 . 3 2 3 3 A H5'' H 1 4.101 0.004 . . . . . B 3 A H5'' . 25043 3 38 . 3 2 3 3 A H8 H 1 8.301 0.000 . . . . . B 3 A H8 . 25043 3 39 . 3 2 3 3 A C1' C 13 91.367 0.000 . . . . . B 3 A C1' . 25043 3 40 . 3 2 3 3 A C2 C 13 155.000 0.000 . . . . . B 3 A C2 . 25043 3 41 . 3 2 3 3 A C2' C 13 75.587 0.000 . . . . . B 3 A C2' . 25043 3 42 . 3 2 3 3 A C3' C 13 74.819 0.000 . . . . . B 3 A C3' . 25043 3 43 . 3 2 3 3 A C4' C 13 86.010 0.000 . . . . . B 3 A C4' . 25043 3 44 . 3 2 3 3 A C5' C 13 66.848 0.000 . . . . . B 3 A C5' . 25043 3 45 . 3 2 3 3 A C8 C 13 141.760 0.000 . . . . . B 3 A C8 . 25043 3 46 . 3 2 4 4 C H1' H 1 5.614 0.000 . . . . . B 4 C H1' . 25043 3 47 . 3 2 4 4 C H2' H 1 4.157 0.000 . . . . . B 4 C H2' . 25043 3 48 . 3 2 4 4 C H3' H 1 4.832 0.000 . . . . . B 4 C H3' . 25043 3 49 . 3 2 4 4 C H4' H 1 4.441 0.000 . . . . . B 4 C H4' . 25043 3 50 . 3 2 4 4 C H5 H 1 5.805 0.000 . . . . . B 4 C H5 . 25043 3 51 . 3 2 4 4 C H6 H 1 7.624 0.000 . . . . . B 4 C H6 . 25043 3 52 . 3 2 4 4 C C1' C 13 92.100 0.000 . . . . . B 4 C C1' . 25043 3 53 . 3 2 4 4 C C2' C 13 76.374 0.000 . . . . . B 4 C C2' . 25043 3 54 . 3 2 4 4 C C3' C 13 75.556 0.000 . . . . . B 4 C C3' . 25043 3 55 . 3 2 4 4 C C4' C 13 86.737 0.000 . . . . . B 4 C C4' . 25043 3 56 . 3 2 4 4 C C5 C 13 98.595 0.000 . . . . . B 4 C C5 . 25043 3 57 . 3 2 4 4 C C6 C 13 142.622 0.000 . . . . . B 4 C C6 . 25043 3 58 . 3 2 5 5 A H1' H 1 5.946 0.000 . . . . . B 5 A H1' . 25043 3 59 . 3 2 5 5 A H2 H 1 8.146 0.000 . . . . . B 5 A H2 . 25043 3 60 . 3 2 5 5 A H2' H 1 4.538 0.000 . . . . . B 5 A H2' . 25043 3 61 . 3 2 5 5 A H3' H 1 4.376 0.000 . . . . . B 5 A H3' . 25043 3 62 . 3 2 5 5 A H4' H 1 4.271 0.000 . . . . . B 5 A H4' . 25043 3 63 . 3 2 5 5 A H5' H 1 4.061 0.000 . . . . . B 5 A H5' . 25043 3 64 . 3 2 5 5 A H5'' H 1 4.163 0.000 . . . . . B 5 A H5'' . 25043 3 65 . 3 2 5 5 A H8 H 1 8.265 0.000 . . . . . B 5 A H8 . 25043 3 66 . 3 2 5 5 A C1' C 13 90.067 0.000 . . . . . B 5 A C1' . 25043 3 67 . 3 2 5 5 A C2 C 13 155.244 0.000 . . . . . B 5 A C2 . 25043 3 68 . 3 2 5 5 A C2' C 13 77.159 0.000 . . . . . B 5 A C2' . 25043 3 69 . 3 2 5 5 A C3' C 13 72.590 0.000 . . . . . B 5 A C3' . 25043 3 70 . 3 2 5 5 A C4' C 13 86.008 0.000 . . . . . B 5 A C4' . 25043 3 71 . 3 2 5 5 A C5' C 13 67.521 0.003 . . . . . B 5 A C5' . 25043 3 72 . 3 2 5 5 A C8 C 13 141.924 0.000 . . . . . B 5 A C8 . 25043 3 stop_ save_