data_25698 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 25698 _Entry.Title ; human CFTR NBD1 deltaRI F508del mutant chemical shift assignments ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2015-07-09 _Entry.Accession_date 2015-07-09 _Entry.Last_release_date 2015-08-12 _Entry.Original_release_date 2015-08-12 _Entry.Origination author _Entry.NMR_STAR_version 3.1.2.6 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details 'chemical shift assignments for a protein construct comprising residues 387-404 and 437-646 of human CFTR with F508del mutation' _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.ORCID _Entry_author.Entry_ID 1 Rhea Hudson . P. . . 25698 2 Andrew Chong . . . . 25698 3 Julie Forman-Kay . D. . . 25698 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Hospital for Sick Children' . 25698 2 . 'University of Toronto' . 25698 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 25698 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 375 25698 '15N chemical shifts' 186 25698 '1H chemical shifts' 185 25698 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 2 . . 2016-08-12 2015-07-09 update BMRB 'update entry citation' 25698 1 . . 2015-08-12 2015-07-09 original author 'original release' 25698 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 25696 'hCFTR NBD1 deltaRI' 25698 BMRB 25697 'hCFTR NBD1 deltaRI I539T' 25698 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 25698 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 26149808 _Citation.Full_citation . _Citation.Title ; Deletion of Phenylalanine-508 in the First Nucleotide Binding Domain of the Cystic Fibrosis Transmembrane Conductance Regulator Increases Conformational Exchange and Inhibits Dimerization ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biol. Chem.' _Citation.Journal_name_full . _Citation.Journal_volume 290 _Citation.Journal_issue 38 _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 22862 _Citation.Page_last 22878 _Citation.Year 2015 _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.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Andrew Chong . . . . 25698 1 2 Patrick Farber . J. . . 25698 1 3 Robert Vernon . M. . . 25698 1 4 Rhea Hudson . P. . . 25698 1 5 Anthony Mittermaier . K. . . 25698 1 6 Julie Forman-Kay . D. . . 25698 1 stop_ save_ save_reference_citation _Citation.Sf_category citations _Citation.Sf_framecode reference_citation _Citation.Entry_ID 25698 _Citation.ID 2 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 22722932 _Citation.Full_citation . _Citation.Title ; Conformational changes relevant to channel activity and folding within the first nucleotide binding domain of the cystic fibrosis transmembrane conductance regulator. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biol. Chem.' _Citation.Journal_name_full . _Citation.Journal_volume 287 _Citation.Journal_issue 34 _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 28480 _Citation.Page_last 28494 _Citation.Year 2012 _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.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Rhea Hudson . P. . . 25698 2 2 Andrew Chong . . . . 25698 2 3 Irina Protasevich . . . . 25698 2 4 Robert Vernon . M. . . 25698 2 5 Efrat Noy . . . . 25698 2 6 Hermann Bihler . . . . 25698 2 7 'Jian Li' An . . . . 25698 2 8 Ori Kalid . . . . 25698 2 9 Inbal Sela-Culang . . . . 25698 2 10 Martin Mense . . . . 25698 2 11 Hanoch Senderowitz . . . . 25698 2 12 Chrisite Brouillette . . . . 25698 2 13 Julie Forman-Kay . D. . . 25698 2 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 25698 _Assembly.ID 1 _Assembly.Name 'hCFTR NBD1 deltaRI F508del' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _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 'hCFTR NBD1 delta RI F508del' 1 $hCFTR_NBD1_delta_RI_F508del A . yes native no no . . . 25698 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_hCFTR_NBD1_delta_RI_F508del _Entity.Sf_category entity _Entity.Sf_framecode hCFTR_NBD1_delta_RI_F508del _Entity.Entry_ID 25698 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name hCFTR_NBD1_delta_RI_F508del _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; SLTTTEVVMENVTAFWEEGG TPVLKDINFKIERGQLLAVA GSTGAGKTSLLMMIMGELEP SEGKIKHSGRISFCSQFSWI MPGTIKENIIGVSYDEYRYR SVIKACQLEEDISKFAEKDN IVLGEGGITLSGGQRARISL ARAVYKDADLYLLDSPFGYL DVLTEKEIFESCVCKLMANK TRILVTSKMEHLKKADKILI LHEGSSYFYGTFSELQNLQP DFSSKLMG ; _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 228 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not reported' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation 'F508del (deletion of F508)' _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _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 1 386 SER . 25698 1 2 387 LEU . 25698 1 3 388 THR . 25698 1 4 389 THR . 25698 1 5 390 THR . 25698 1 6 391 GLU . 25698 1 7 392 VAL . 25698 1 8 393 VAL . 25698 1 9 394 MET . 25698 1 10 395 GLU . 25698 1 11 396 ASN . 25698 1 12 397 VAL . 25698 1 13 398 THR . 25698 1 14 399 ALA . 25698 1 15 400 PHE . 25698 1 16 401 TRP . 25698 1 17 402 GLU . 25698 1 18 403 GLU . 25698 1 19 404 GLY . 25698 1 20 437 GLY . 25698 1 21 438 THR . 25698 1 22 439 PRO . 25698 1 23 440 VAL . 25698 1 24 441 LEU . 25698 1 25 442 LYS . 25698 1 26 443 ASP . 25698 1 27 444 ILE . 25698 1 28 445 ASN . 25698 1 29 446 PHE . 25698 1 30 447 LYS . 25698 1 31 448 ILE . 25698 1 32 449 GLU . 25698 1 33 450 ARG . 25698 1 34 451 GLY . 25698 1 35 452 GLN . 25698 1 36 453 LEU . 25698 1 37 454 LEU . 25698 1 38 455 ALA . 25698 1 39 456 VAL . 25698 1 40 457 ALA . 25698 1 41 458 GLY . 25698 1 42 459 SER . 25698 1 43 460 THR . 25698 1 44 461 GLY . 25698 1 45 462 ALA . 25698 1 46 463 GLY . 25698 1 47 464 LYS . 25698 1 48 465 THR . 25698 1 49 466 SER . 25698 1 50 467 LEU . 25698 1 51 468 LEU . 25698 1 52 469 MET . 25698 1 53 470 MET . 25698 1 54 471 ILE . 25698 1 55 472 MET . 25698 1 56 473 GLY . 25698 1 57 474 GLU . 25698 1 58 475 LEU . 25698 1 59 476 GLU . 25698 1 60 477 PRO . 25698 1 61 478 SER . 25698 1 62 479 GLU . 25698 1 63 480 GLY . 25698 1 64 481 LYS . 25698 1 65 482 ILE . 25698 1 66 483 LYS . 25698 1 67 484 HIS . 25698 1 68 485 SER . 25698 1 69 486 GLY . 25698 1 70 487 ARG . 25698 1 71 488 ILE . 25698 1 72 489 SER . 25698 1 73 490 PHE . 25698 1 74 491 CYS . 25698 1 75 492 SER . 25698 1 76 493 GLN . 25698 1 77 494 PHE . 25698 1 78 495 SER . 25698 1 79 496 TRP . 25698 1 80 497 ILE . 25698 1 81 498 MET . 25698 1 82 499 PRO . 25698 1 83 500 GLY . 25698 1 84 501 THR . 25698 1 85 502 ILE . 25698 1 86 503 LYS . 25698 1 87 504 GLU . 25698 1 88 505 ASN . 25698 1 89 506 ILE . 25698 1 90 507 ILE . 25698 1 91 508 GLY . 25698 1 92 509 VAL . 25698 1 93 510 SER . 25698 1 94 511 TYR . 25698 1 95 512 ASP . 25698 1 96 513 GLU . 25698 1 97 514 TYR . 25698 1 98 515 ARG . 25698 1 99 516 TYR . 25698 1 100 517 ARG . 25698 1 101 518 SER . 25698 1 102 519 VAL . 25698 1 103 520 ILE . 25698 1 104 521 LYS . 25698 1 105 522 ALA . 25698 1 106 523 CYS . 25698 1 107 524 GLN . 25698 1 108 525 LEU . 25698 1 109 526 GLU . 25698 1 110 527 GLU . 25698 1 111 528 ASP . 25698 1 112 529 ILE . 25698 1 113 530 SER . 25698 1 114 531 LYS . 25698 1 115 532 PHE . 25698 1 116 533 ALA . 25698 1 117 534 GLU . 25698 1 118 535 LYS . 25698 1 119 536 ASP . 25698 1 120 537 ASN . 25698 1 121 538 ILE . 25698 1 122 539 VAL . 25698 1 123 540 LEU . 25698 1 124 541 GLY . 25698 1 125 542 GLU . 25698 1 126 543 GLY . 25698 1 127 544 GLY . 25698 1 128 545 ILE . 25698 1 129 546 THR . 25698 1 130 547 LEU . 25698 1 131 548 SER . 25698 1 132 549 GLY . 25698 1 133 550 GLY . 25698 1 134 551 GLN . 25698 1 135 552 ARG . 25698 1 136 553 ALA . 25698 1 137 554 ARG . 25698 1 138 555 ILE . 25698 1 139 556 SER . 25698 1 140 557 LEU . 25698 1 141 558 ALA . 25698 1 142 559 ARG . 25698 1 143 560 ALA . 25698 1 144 561 VAL . 25698 1 145 562 TYR . 25698 1 146 563 LYS . 25698 1 147 564 ASP . 25698 1 148 565 ALA . 25698 1 149 566 ASP . 25698 1 150 567 LEU . 25698 1 151 568 TYR . 25698 1 152 569 LEU . 25698 1 153 570 LEU . 25698 1 154 571 ASP . 25698 1 155 572 SER . 25698 1 156 573 PRO . 25698 1 157 574 PHE . 25698 1 158 575 GLY . 25698 1 159 576 TYR . 25698 1 160 577 LEU . 25698 1 161 578 ASP . 25698 1 162 579 VAL . 25698 1 163 580 LEU . 25698 1 164 581 THR . 25698 1 165 582 GLU . 25698 1 166 583 LYS . 25698 1 167 584 GLU . 25698 1 168 585 ILE . 25698 1 169 586 PHE . 25698 1 170 587 GLU . 25698 1 171 588 SER . 25698 1 172 589 CYS . 25698 1 173 590 VAL . 25698 1 174 591 CYS . 25698 1 175 592 LYS . 25698 1 176 593 LEU . 25698 1 177 594 MET . 25698 1 178 595 ALA . 25698 1 179 596 ASN . 25698 1 180 597 LYS . 25698 1 181 598 THR . 25698 1 182 599 ARG . 25698 1 183 600 ILE . 25698 1 184 601 LEU . 25698 1 185 602 VAL . 25698 1 186 603 THR . 25698 1 187 604 SER . 25698 1 188 605 LYS . 25698 1 189 606 MET . 25698 1 190 607 GLU . 25698 1 191 608 HIS . 25698 1 192 609 LEU . 25698 1 193 610 LYS . 25698 1 194 611 LYS . 25698 1 195 612 ALA . 25698 1 196 613 ASP . 25698 1 197 614 LYS . 25698 1 198 615 ILE . 25698 1 199 616 LEU . 25698 1 200 617 ILE . 25698 1 201 618 LEU . 25698 1 202 619 HIS . 25698 1 203 620 GLU . 25698 1 204 621 GLY . 25698 1 205 622 SER . 25698 1 206 623 SER . 25698 1 207 624 TYR . 25698 1 208 625 PHE . 25698 1 209 626 TYR . 25698 1 210 627 GLY . 25698 1 211 628 THR . 25698 1 212 629 PHE . 25698 1 213 630 SER . 25698 1 214 631 GLU . 25698 1 215 632 LEU . 25698 1 216 633 GLN . 25698 1 217 634 ASN . 25698 1 218 635 LEU . 25698 1 219 636 GLN . 25698 1 220 637 PRO . 25698 1 221 638 ASP . 25698 1 222 639 PHE . 25698 1 223 640 SER . 25698 1 224 641 SER . 25698 1 225 642 LYS . 25698 1 226 643 LEU . 25698 1 227 644 MET . 25698 1 228 645 GLY . 25698 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 . SER 1 1 25698 1 . LEU 2 2 25698 1 . THR 3 3 25698 1 . THR 4 4 25698 1 . THR 5 5 25698 1 . GLU 6 6 25698 1 . VAL 7 7 25698 1 . VAL 8 8 25698 1 . MET 9 9 25698 1 . GLU 10 10 25698 1 . ASN 11 11 25698 1 . VAL 12 12 25698 1 . THR 13 13 25698 1 . ALA 14 14 25698 1 . PHE 15 15 25698 1 . TRP 16 16 25698 1 . GLU 17 17 25698 1 . GLU 18 18 25698 1 . GLY 19 19 25698 1 . GLY 20 20 25698 1 . THR 21 21 25698 1 . PRO 22 22 25698 1 . VAL 23 23 25698 1 . LEU 24 24 25698 1 . LYS 25 25 25698 1 . ASP 26 26 25698 1 . ILE 27 27 25698 1 . ASN 28 28 25698 1 . PHE 29 29 25698 1 . LYS 30 30 25698 1 . ILE 31 31 25698 1 . GLU 32 32 25698 1 . ARG 33 33 25698 1 . GLY 34 34 25698 1 . GLN 35 35 25698 1 . LEU 36 36 25698 1 . LEU 37 37 25698 1 . ALA 38 38 25698 1 . VAL 39 39 25698 1 . ALA 40 40 25698 1 . GLY 41 41 25698 1 . SER 42 42 25698 1 . THR 43 43 25698 1 . GLY 44 44 25698 1 . ALA 45 45 25698 1 . GLY 46 46 25698 1 . LYS 47 47 25698 1 . THR 48 48 25698 1 . SER 49 49 25698 1 . LEU 50 50 25698 1 . LEU 51 51 25698 1 . MET 52 52 25698 1 . MET 53 53 25698 1 . ILE 54 54 25698 1 . MET 55 55 25698 1 . GLY 56 56 25698 1 . GLU 57 57 25698 1 . LEU 58 58 25698 1 . GLU 59 59 25698 1 . PRO 60 60 25698 1 . SER 61 61 25698 1 . GLU 62 62 25698 1 . GLY 63 63 25698 1 . LYS 64 64 25698 1 . ILE 65 65 25698 1 . LYS 66 66 25698 1 . HIS 67 67 25698 1 . SER 68 68 25698 1 . GLY 69 69 25698 1 . ARG 70 70 25698 1 . ILE 71 71 25698 1 . SER 72 72 25698 1 . PHE 73 73 25698 1 . CYS 74 74 25698 1 . SER 75 75 25698 1 . GLN 76 76 25698 1 . PHE 77 77 25698 1 . SER 78 78 25698 1 . TRP 79 79 25698 1 . ILE 80 80 25698 1 . MET 81 81 25698 1 . PRO 82 82 25698 1 . GLY 83 83 25698 1 . THR 84 84 25698 1 . ILE 85 85 25698 1 . LYS 86 86 25698 1 . GLU 87 87 25698 1 . ASN 88 88 25698 1 . ILE 89 89 25698 1 . ILE 90 90 25698 1 . GLY 91 91 25698 1 . VAL 92 92 25698 1 . SER 93 93 25698 1 . TYR 94 94 25698 1 . ASP 95 95 25698 1 . GLU 96 96 25698 1 . TYR 97 97 25698 1 . ARG 98 98 25698 1 . TYR 99 99 25698 1 . ARG 100 100 25698 1 . SER 101 101 25698 1 . VAL 102 102 25698 1 . ILE 103 103 25698 1 . LYS 104 104 25698 1 . ALA 105 105 25698 1 . CYS 106 106 25698 1 . GLN 107 107 25698 1 . LEU 108 108 25698 1 . GLU 109 109 25698 1 . GLU 110 110 25698 1 . ASP 111 111 25698 1 . ILE 112 112 25698 1 . SER 113 113 25698 1 . LYS 114 114 25698 1 . PHE 115 115 25698 1 . ALA 116 116 25698 1 . GLU 117 117 25698 1 . LYS 118 118 25698 1 . ASP 119 119 25698 1 . ASN 120 120 25698 1 . ILE 121 121 25698 1 . VAL 122 122 25698 1 . LEU 123 123 25698 1 . GLY 124 124 25698 1 . GLU 125 125 25698 1 . GLY 126 126 25698 1 . GLY 127 127 25698 1 . ILE 128 128 25698 1 . THR 129 129 25698 1 . LEU 130 130 25698 1 . SER 131 131 25698 1 . GLY 132 132 25698 1 . GLY 133 133 25698 1 . GLN 134 134 25698 1 . ARG 135 135 25698 1 . ALA 136 136 25698 1 . ARG 137 137 25698 1 . ILE 138 138 25698 1 . SER 139 139 25698 1 . LEU 140 140 25698 1 . ALA 141 141 25698 1 . ARG 142 142 25698 1 . ALA 143 143 25698 1 . VAL 144 144 25698 1 . TYR 145 145 25698 1 . LYS 146 146 25698 1 . ASP 147 147 25698 1 . ALA 148 148 25698 1 . ASP 149 149 25698 1 . LEU 150 150 25698 1 . TYR 151 151 25698 1 . LEU 152 152 25698 1 . LEU 153 153 25698 1 . ASP 154 154 25698 1 . SER 155 155 25698 1 . PRO 156 156 25698 1 . PHE 157 157 25698 1 . GLY 158 158 25698 1 . TYR 159 159 25698 1 . LEU 160 160 25698 1 . ASP 161 161 25698 1 . VAL 162 162 25698 1 . LEU 163 163 25698 1 . THR 164 164 25698 1 . GLU 165 165 25698 1 . LYS 166 166 25698 1 . GLU 167 167 25698 1 . ILE 168 168 25698 1 . PHE 169 169 25698 1 . GLU 170 170 25698 1 . SER 171 171 25698 1 . CYS 172 172 25698 1 . VAL 173 173 25698 1 . CYS 174 174 25698 1 . LYS 175 175 25698 1 . LEU 176 176 25698 1 . MET 177 177 25698 1 . ALA 178 178 25698 1 . ASN 179 179 25698 1 . LYS 180 180 25698 1 . THR 181 181 25698 1 . ARG 182 182 25698 1 . ILE 183 183 25698 1 . LEU 184 184 25698 1 . VAL 185 185 25698 1 . THR 186 186 25698 1 . SER 187 187 25698 1 . LYS 188 188 25698 1 . MET 189 189 25698 1 . GLU 190 190 25698 1 . HIS 191 191 25698 1 . LEU 192 192 25698 1 . LYS 193 193 25698 1 . LYS 194 194 25698 1 . ALA 195 195 25698 1 . ASP 196 196 25698 1 . LYS 197 197 25698 1 . ILE 198 198 25698 1 . LEU 199 199 25698 1 . ILE 200 200 25698 1 . LEU 201 201 25698 1 . HIS 202 202 25698 1 . GLU 203 203 25698 1 . GLY 204 204 25698 1 . SER 205 205 25698 1 . SER 206 206 25698 1 . TYR 207 207 25698 1 . PHE 208 208 25698 1 . TYR 209 209 25698 1 . GLY 210 210 25698 1 . THR 211 211 25698 1 . PHE 212 212 25698 1 . SER 213 213 25698 1 . GLU 214 214 25698 1 . LEU 215 215 25698 1 . GLN 216 216 25698 1 . ASN 217 217 25698 1 . LEU 218 218 25698 1 . GLN 219 219 25698 1 . PRO 220 220 25698 1 . ASP 221 221 25698 1 . PHE 222 222 25698 1 . SER 223 223 25698 1 . SER 224 224 25698 1 . LYS 225 225 25698 1 . LEU 226 226 25698 1 . MET 227 227 25698 1 . GLY 228 228 25698 1 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 25698 _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 $hCFTR_NBD1_delta_RI_F508del . 9606 organism . 'Homo sapiens' human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 25698 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 25698 _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 $hCFTR_NBD1_delta_RI_F508del . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . 'pET-SUMO hNBD1 deltaRI F508del' . . . 25698 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 25698 _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 'hCFTR NBD1 delta RI F508del' '[U-99% 13C; U-99% 15N; 50%D20]' . . 1 $hCFTR_NBD1_delta_RI_F508del . . 1 . . mM . . . . 25698 1 2 'sodium phosphate' 'natural abundance' . . . . . . 50 . . mM . . . . 25698 1 3 'sodium chloride' 'natural abundance' . . . . . . 150 . . mM . . . . 25698 1 4 glycerol 'natural abundance' . . . . . . 274 . . mM . . . . 25698 1 5 'magnesium chloride' 'natural abundance' . . . . . . 5 . . mM . . . . 25698 1 6 'sodium azide' 'natural abundance' . . . . . . .08 . . mM . . . . 25698 1 7 DTT 'natural abundance' . . . . . . 5 . . mM . . . . 25698 1 8 'adenosine triphosphate' 'natural abundance' . . . . . . 5 . . mM . . . . 25698 1 9 H2O 'natural abundance' . . . . . . 90 . . % . . . . 25698 1 10 D2O 'natural abundance' . . . . . . 10 . . % . . . . 25698 1 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 25698 _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' 0.89 . M 25698 1 pH 7.6 . pH 25698 1 pressure 1 . atm 25698 1 temperature 293.15 . K 25698 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 25698 _Software.ID 1 _Software.Name NMRView _Software.Version 5.2.2 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . 25698 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 25698 1 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 25698 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details 'with cyroprobe' _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 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 25698 _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 Varian INOVA . 600 'with cyroprobe' . . 25698 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 25698 _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 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25698 1 2 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25698 1 3 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25698 1 4 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25698 1 5 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25698 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 25698 _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.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.0 external indirect 0.25148 . . . . . 25698 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 external direct 1 . . . . . 25698 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 external indirect 0.10134 . . . . . 25698 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 25698 _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 '2D 1H-15N HSQC' . . . 25698 1 2 '3D HNCO' . . . 25698 1 3 '3D HNCA' . . . 25698 1 4 '3D HN(CO)CA' . . . 25698 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 1 $NMRView . . 25698 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 SER N N 15 120.00 . . . . . . . 386 SER N . 25698 1 2 . 1 1 2 2 LEU C C 13 177.31 . . . . . . . 387 LEU C . 25698 1 3 . 1 1 2 2 LEU CA C 13 55.118 . . . . . . . 387 LEU CA . 25698 1 4 . 1 1 3 3 THR H H 1 8.267 . . . . . . . 388 THR HN . 25698 1 5 . 1 1 3 3 THR C C 13 174.06 . . . . . . . 388 THR C . 25698 1 6 . 1 1 3 3 THR CA C 13 61.305 . . . . . . . 388 THR CA . 25698 1 7 . 1 1 3 3 THR N N 15 115.20 . . . . . . . 388 THR N . 25698 1 8 . 1 1 4 4 THR H H 1 8.250 . . . . . . . 389 THR HN . 25698 1 9 . 1 1 4 4 THR N N 15 115.86 . . . . . . . 389 THR N . 25698 1 10 . 1 1 7 7 VAL C C 13 173.76 . . . . . . . 392 VAL C . 25698 1 11 . 1 1 7 7 VAL CA C 13 60.897 . . . . . . . 392 VAL CA . 25698 1 12 . 1 1 8 8 VAL H H 1 8.699 . . . . . . . 393 VAL HN . 25698 1 13 . 1 1 8 8 VAL C C 13 174.10 . . . . . . . 393 VAL C . 25698 1 14 . 1 1 8 8 VAL CA C 13 60.663 . . . . . . . 393 VAL CA . 25698 1 15 . 1 1 8 8 VAL N N 15 125.71 . . . . . . . 393 VAL N . 25698 1 16 . 1 1 9 9 MET H H 1 8.289 . . . . . . . 394 MET HN . 25698 1 17 . 1 1 9 9 MET C C 13 174.21 . . . . . . . 394 MET C . 25698 1 18 . 1 1 9 9 MET CA C 13 55.761 . . . . . . . 394 MET CA . 25698 1 19 . 1 1 9 9 MET N N 15 123.85 . . . . . . . 394 MET N . 25698 1 20 . 1 1 10 10 GLU H H 1 8.910 . . . . . . . 395 GLU HN . 25698 1 21 . 1 1 10 10 GLU C C 13 173.23 . . . . . . . 395 GLU C . 25698 1 22 . 1 1 10 10 GLU CA C 13 54.126 . . . . . . . 395 GLU CA . 25698 1 23 . 1 1 10 10 GLU N N 15 125.06 . . . . . . . 395 GLU N . 25698 1 24 . 1 1 11 11 ASN H H 1 8.876 . . . . . . . 396 ASN HN . 25698 1 25 . 1 1 11 11 ASN C C 13 174.17 . . . . . . . 396 ASN C . 25698 1 26 . 1 1 11 11 ASN CA C 13 54.010 . . . . . . . 396 ASN CA . 25698 1 27 . 1 1 11 11 ASN N N 15 123.58 . . . . . . . 396 ASN N . 25698 1 28 . 1 1 12 12 VAL H H 1 8.349 . . . . . . . 397 VAL HN . 25698 1 29 . 1 1 12 12 VAL C C 13 176.09 . . . . . . . 397 VAL C . 25698 1 30 . 1 1 12 12 VAL CA C 13 63.546 . . . . . . . 397 VAL CA . 25698 1 31 . 1 1 12 12 VAL N N 15 120.00 . . . . . . . 397 VAL N . 25698 1 32 . 1 1 13 13 THR H H 1 7.800 . . . . . . . 398 THR HN . 25698 1 33 . 1 1 13 13 THR C C 13 172.57 . . . . . . . 398 THR C . 25698 1 34 . 1 1 13 13 THR CA C 13 60.575 . . . . . . . 398 THR CA . 25698 1 35 . 1 1 13 13 THR N N 15 123.28 . . . . . . . 398 THR N . 25698 1 36 . 1 1 14 14 ALA H H 1 8.789 . . . . . . . 399 ALA HN . 25698 1 37 . 1 1 14 14 ALA C C 13 173.55 . . . . . . . 399 ALA C . 25698 1 38 . 1 1 14 14 ALA CA C 13 51.150 . . . . . . . 399 ALA CA . 25698 1 39 . 1 1 14 14 ALA N N 15 127.06 . . . . . . . 399 ALA N . 25698 1 40 . 1 1 15 15 PHE H H 1 9.237 . . . . . . . 400 PHE HN . 25698 1 41 . 1 1 15 15 PHE C C 13 174.83 . . . . . . . 400 PHE C . 25698 1 42 . 1 1 15 15 PHE CA C 13 56.519 . . . . . . . 400 PHE CA . 25698 1 43 . 1 1 15 15 PHE N N 15 118.81 . . . . . . . 400 PHE N . 25698 1 44 . 1 1 16 16 TRP H H 1 8.916 . . . . . . . 401 TRP HN . 25698 1 45 . 1 1 16 16 TRP C C 13 176.92 . . . . . . . 401 TRP C . 25698 1 46 . 1 1 16 16 TRP CA C 13 59.146 . . . . . . . 401 TRP CA . 25698 1 47 . 1 1 16 16 TRP N N 15 121.49 . . . . . . . 401 TRP N . 25698 1 48 . 1 1 17 17 GLU H H 1 7.939 . . . . . . . 402 GLU HN . 25698 1 49 . 1 1 17 17 GLU C C 13 175.28 . . . . . . . 402 GLU C . 25698 1 50 . 1 1 17 17 GLU CA C 13 54.418 . . . . . . . 402 GLU CA . 25698 1 51 . 1 1 17 17 GLU N N 15 117.72 . . . . . . . 402 GLU N . 25698 1 52 . 1 1 18 18 GLU H H 1 8.784 . . . . . . . 403 GLU HN . 25698 1 53 . 1 1 18 18 GLU C C 13 177.45 . . . . . . . 403 GLU C . 25698 1 54 . 1 1 18 18 GLU CA C 13 57.628 . . . . . . . 403 GLU CA . 25698 1 55 . 1 1 18 18 GLU N N 15 125.56 . . . . . . . 403 GLU N . 25698 1 56 . 1 1 20 20 GLY H H 1 7.959 . . . . . . . 437 GLY HN . 25698 1 57 . 1 1 20 20 GLY C C 13 173.32 . . . . . . . 437 GLY C . 25698 1 58 . 1 1 20 20 GLY CA C 13 44.262 . . . . . . . 437 GLY CA . 25698 1 59 . 1 1 20 20 GLY N N 15 108.29 . . . . . . . 437 GLY N . 25698 1 60 . 1 1 21 21 THR H H 1 8.568 . . . . . . . 438 THR HN . 25698 1 61 . 1 1 21 21 THR N N 15 117.99 . . . . . . . 438 THR N . 25698 1 62 . 1 1 22 22 PRO C C 13 176.33 . . . . . . . 439 PRO C . 25698 1 63 . 1 1 22 22 PRO CA C 13 63.465 . . . . . . . 439 PRO CA . 25698 1 64 . 1 1 23 23 VAL H H 1 8.248 . . . . . . . 440 VAL HN . 25698 1 65 . 1 1 23 23 VAL C C 13 172.66 . . . . . . . 440 VAL C . 25698 1 66 . 1 1 23 23 VAL CA C 13 61.247 . . . . . . . 440 VAL CA . 25698 1 67 . 1 1 23 23 VAL N N 15 122.70 . . . . . . . 440 VAL N . 25698 1 68 . 1 1 24 24 LEU H H 1 6.837 . . . . . . . 441 LEU HN . 25698 1 69 . 1 1 24 24 LEU C C 13 175.24 . . . . . . . 441 LEU C . 25698 1 70 . 1 1 24 24 LEU CA C 13 52.788 . . . . . . . 441 LEU CA . 25698 1 71 . 1 1 24 24 LEU N N 15 119.54 . . . . . . . 441 LEU N . 25698 1 72 . 1 1 25 25 LYS H H 1 8.508 . . . . . . . 442 LYS HN . 25698 1 73 . 1 1 25 25 LYS C C 13 173.10 . . . . . . . 442 LYS C . 25698 1 74 . 1 1 25 25 LYS CA C 13 54.710 . . . . . . . 442 LYS CA . 25698 1 75 . 1 1 25 25 LYS N N 15 121.80 . . . . . . . 442 LYS N . 25698 1 76 . 1 1 26 26 ASP H H 1 7.887 . . . . . . . 443 ASP HN . 25698 1 77 . 1 1 26 26 ASP C C 13 173.14 . . . . . . . 443 ASP C . 25698 1 78 . 1 1 26 26 ASP CA C 13 54.768 . . . . . . . 443 ASP CA . 25698 1 79 . 1 1 26 26 ASP N N 15 125.32 . . . . . . . 443 ASP N . 25698 1 80 . 1 1 27 27 ILE H H 1 9.222 . . . . . . . 444 ILE HN . 25698 1 81 . 1 1 27 27 ILE C C 13 175.69 . . . . . . . 444 ILE C . 25698 1 82 . 1 1 27 27 ILE CA C 13 59.438 . . . . . . . 444 ILE CA . 25698 1 83 . 1 1 27 27 ILE N N 15 119.38 . . . . . . . 444 ILE N . 25698 1 84 . 1 1 28 28 ASN H H 1 7.674 . . . . . . . 445 ASN HN . 25698 1 85 . 1 1 28 28 ASN C C 13 173.94 . . . . . . . 445 ASN C . 25698 1 86 . 1 1 28 28 ASN CA C 13 52.083 . . . . . . . 445 ASN CA . 25698 1 87 . 1 1 28 28 ASN N N 15 122.74 . . . . . . . 445 ASN N . 25698 1 88 . 1 1 29 29 PHE H H 1 8.269 . . . . . . . 446 PHE HN . 25698 1 89 . 1 1 29 29 PHE C C 13 172.02 . . . . . . . 446 PHE C . 25698 1 90 . 1 1 29 29 PHE CA C 13 57.095 . . . . . . . 446 PHE CA . 25698 1 91 . 1 1 29 29 PHE N N 15 114.50 . . . . . . . 446 PHE N . 25698 1 92 . 1 1 30 30 LYS H H 1 7.834 . . . . . . . 447 LYS HN . 25698 1 93 . 1 1 30 30 LYS C C 13 174.60 . . . . . . . 447 LYS C . 25698 1 94 . 1 1 30 30 LYS N N 15 118.63 . . . . . . . 447 LYS N . 25698 1 95 . 1 1 31 31 ILE H H 1 9.151 . . . . . . . 448 ILE HN . 25698 1 96 . 1 1 31 31 ILE C C 13 174.62 . . . . . . . 448 ILE C . 25698 1 97 . 1 1 31 31 ILE CA C 13 59.648 . . . . . . . 448 ILE CA . 25698 1 98 . 1 1 31 31 ILE N N 15 122.17 . . . . . . . 448 ILE N . 25698 1 99 . 1 1 32 32 GLU H H 1 8.313 . . . . . . . 449 GLU HN . 25698 1 100 . 1 1 32 32 GLU CA C 13 54.602 . . . . . . . 449 GLU CA . 25698 1 101 . 1 1 32 32 GLU N N 15 125.09 . . . . . . . 449 GLU N . 25698 1 102 . 1 1 33 33 ARG H H 1 8.568 . . . . . . . 450 ARG HN . 25698 1 103 . 1 1 33 33 ARG C C 13 177.97 . . . . . . . 450 ARG C . 25698 1 104 . 1 1 33 33 ARG N N 15 119.40 . . . . . . . 450 ARG N . 25698 1 105 . 1 1 34 34 GLY H H 1 9.112 . . . . . . . 451 GLY HN . 25698 1 106 . 1 1 34 34 GLY C C 13 173.62 . . . . . . . 451 GLY C . 25698 1 107 . 1 1 34 34 GLY CA C 13 44.559 . . . . . . . 451 GLY CA . 25698 1 108 . 1 1 34 34 GLY N N 15 113.74 . . . . . . . 451 GLY N . 25698 1 109 . 1 1 35 35 GLN H H 1 7.804 . . . . . . . 452 GLN HN . 25698 1 110 . 1 1 35 35 GLN C C 13 173.35 . . . . . . . 452 GLN C . 25698 1 111 . 1 1 35 35 GLN CA C 13 56.111 . . . . . . . 452 GLN CA . 25698 1 112 . 1 1 35 35 GLN N N 15 118.63 . . . . . . . 452 GLN N . 25698 1 113 . 1 1 36 36 LEU H H 1 9.541 . . . . . . . 453 LEU HN . 25698 1 114 . 1 1 36 36 LEU C C 13 175.19 . . . . . . . 453 LEU C . 25698 1 115 . 1 1 36 36 LEU CA C 13 53.251 . . . . . . . 453 LEU CA . 25698 1 116 . 1 1 36 36 LEU N N 15 120.84 . . . . . . . 453 LEU N . 25698 1 117 . 1 1 37 37 LEU H H 1 9.027 . . . . . . . 454 LEU HN . 25698 1 118 . 1 1 37 37 LEU C C 13 174.26 . . . . . . . 454 LEU C . 25698 1 119 . 1 1 37 37 LEU CA C 13 52.492 . . . . . . . 454 LEU CA . 25698 1 120 . 1 1 37 37 LEU N N 15 130.02 . . . . . . . 454 LEU N . 25698 1 121 . 1 1 38 38 ALA H H 1 8.731 . . . . . . . 455 ALA HN . 25698 1 122 . 1 1 38 38 ALA C C 13 174.92 . . . . . . . 455 ALA C . 25698 1 123 . 1 1 38 38 ALA CA C 13 49.340 . . . . . . . 455 ALA CA . 25698 1 124 . 1 1 38 38 ALA N N 15 129.29 . . . . . . . 455 ALA N . 25698 1 125 . 1 1 39 39 VAL H H 1 9.071 . . . . . . . 456 VAL HN . 25698 1 126 . 1 1 39 39 VAL C C 13 173.14 . . . . . . . 456 VAL C . 25698 1 127 . 1 1 39 39 VAL CA C 13 60.546 . . . . . . . 456 VAL CA . 25698 1 128 . 1 1 39 39 VAL N N 15 123.61 . . . . . . . 456 VAL N . 25698 1 129 . 1 1 40 40 ALA H H 1 9.033 . . . . . . . 457 ALA HN . 25698 1 130 . 1 1 40 40 ALA C C 13 175.74 . . . . . . . 457 ALA C . 25698 1 131 . 1 1 40 40 ALA CA C 13 49.515 . . . . . . . 457 ALA CA . 25698 1 132 . 1 1 40 40 ALA N N 15 128.29 . . . . . . . 457 ALA N . 25698 1 133 . 1 1 41 41 GLY H H 1 8.240 . . . . . . . 458 GLY HN . 25698 1 134 . 1 1 41 41 GLY C C 13 174.08 . . . . . . . 458 GLY C . 25698 1 135 . 1 1 41 41 GLY CA C 13 44.904 . . . . . . . 458 GLY CA . 25698 1 136 . 1 1 41 41 GLY N N 15 106.09 . . . . . . . 458 GLY N . 25698 1 137 . 1 1 42 42 SER H H 1 9.216 . . . . . . . 459 SER HN . 25698 1 138 . 1 1 42 42 SER C C 13 173.92 . . . . . . . 459 SER C . 25698 1 139 . 1 1 42 42 SER CA C 13 58.212 . . . . . . . 459 SER CA . 25698 1 140 . 1 1 42 42 SER N N 15 119.03 . . . . . . . 459 SER N . 25698 1 141 . 1 1 43 43 THR H H 1 8.610 . . . . . . . 460 THR HN . 25698 1 142 . 1 1 43 43 THR C C 13 175.63 . . . . . . . 460 THR C . 25698 1 143 . 1 1 43 43 THR CA C 13 63.271 . . . . . . . 460 THR CA . 25698 1 144 . 1 1 43 43 THR N N 15 117.12 . . . . . . . 460 THR N . 25698 1 145 . 1 1 44 44 GLY H H 1 8.036 . . . . . . . 461 GLY HN . 25698 1 146 . 1 1 44 44 GLY C C 13 174.26 . . . . . . . 461 GLY C . 25698 1 147 . 1 1 44 44 GLY CA C 13 45.857 . . . . . . . 461 GLY CA . 25698 1 148 . 1 1 44 44 GLY N N 15 114.45 . . . . . . . 461 GLY N . 25698 1 149 . 1 1 45 45 ALA H H 1 8.102 . . . . . . . 462 ALA HN . 25698 1 150 . 1 1 45 45 ALA C C 13 175.99 . . . . . . . 462 ALA C . 25698 1 151 . 1 1 45 45 ALA CA C 13 55.045 . . . . . . . 462 ALA CA . 25698 1 152 . 1 1 45 45 ALA N N 15 122.52 . . . . . . . 462 ALA N . 25698 1 153 . 1 1 46 46 GLY H H 1 7.964 . . . . . . . 463 GLY HN . 25698 1 154 . 1 1 46 46 GLY C C 13 173.39 . . . . . . . 463 GLY C . 25698 1 155 . 1 1 46 46 GLY CA C 13 44.563 . . . . . . . 463 GLY CA . 25698 1 156 . 1 1 46 46 GLY N N 15 99.630 . . . . . . . 463 GLY N . 25698 1 157 . 1 1 47 47 LYS H H 1 9.129 . . . . . . . 464 LYS HN . 25698 1 158 . 1 1 47 47 LYS C C 13 177.36 . . . . . . . 464 LYS C . 25698 1 159 . 1 1 47 47 LYS CA C 13 59.768 . . . . . . . 464 LYS CA . 25698 1 160 . 1 1 47 47 LYS N N 15 122.95 . . . . . . . 464 LYS N . 25698 1 161 . 1 1 48 48 THR H H 1 9.395 . . . . . . . 465 THR HN . 25698 1 162 . 1 1 48 48 THR C C 13 177.48 . . . . . . . 465 THR C . 25698 1 163 . 1 1 48 48 THR CA C 13 67.450 . . . . . . . 465 THR CA . 25698 1 164 . 1 1 48 48 THR N N 15 117.31 . . . . . . . 465 THR N . 25698 1 165 . 1 1 49 49 SER H H 1 8.349 . . . . . . . 466 SER HN . 25698 1 166 . 1 1 49 49 SER C C 13 173.75 . . . . . . . 466 SER C . 25698 1 167 . 1 1 49 49 SER CA C 13 64.683 . . . . . . . 466 SER CA . 25698 1 168 . 1 1 49 49 SER N N 15 118.82 . . . . . . . 466 SER N . 25698 1 169 . 1 1 50 50 LEU H H 1 8.175 . . . . . . . 467 LEU HN . 25698 1 170 . 1 1 50 50 LEU C C 13 178.37 . . . . . . . 467 LEU C . 25698 1 171 . 1 1 50 50 LEU CA C 13 58.966 . . . . . . . 467 LEU CA . 25698 1 172 . 1 1 50 50 LEU N N 15 123.21 . . . . . . . 467 LEU N . 25698 1 173 . 1 1 51 51 LEU H H 1 7.327 . . . . . . . 468 LEU HN . 25698 1 174 . 1 1 51 51 LEU C C 13 178.94 . . . . . . . 468 LEU C . 25698 1 175 . 1 1 51 51 LEU CA C 13 58.211 . . . . . . . 468 LEU CA . 25698 1 176 . 1 1 51 51 LEU N N 15 117.84 . . . . . . . 468 LEU N . 25698 1 177 . 1 1 52 52 MET H H 1 8.659 . . . . . . . 469 MET HN . 25698 1 178 . 1 1 52 52 MET C C 13 178.72 . . . . . . . 469 MET C . 25698 1 179 . 1 1 52 52 MET CA C 13 57.054 . . . . . . . 469 MET CA . 25698 1 180 . 1 1 52 52 MET N N 15 117.49 . . . . . . . 469 MET N . 25698 1 181 . 1 1 53 53 MET H H 1 8.026 . . . . . . . 470 MET HN . 25698 1 182 . 1 1 53 53 MET C C 13 179.73 . . . . . . . 470 MET C . 25698 1 183 . 1 1 53 53 MET CA C 13 58.143 . . . . . . . 470 MET CA . 25698 1 184 . 1 1 53 53 MET N N 15 120.49 . . . . . . . 470 MET N . 25698 1 185 . 1 1 54 54 ILE H H 1 7.482 . . . . . . . 471 ILE HN . 25698 1 186 . 1 1 54 54 ILE C C 13 175.69 . . . . . . . 471 ILE C . 25698 1 187 . 1 1 54 54 ILE CA C 13 65.098 . . . . . . . 471 ILE CA . 25698 1 188 . 1 1 54 54 ILE N N 15 122.36 . . . . . . . 471 ILE N . 25698 1 189 . 1 1 55 55 MET H H 1 7.434 . . . . . . . 472 MET HN . 25698 1 190 . 1 1 55 55 MET C C 13 175.75 . . . . . . . 472 MET C . 25698 1 191 . 1 1 55 55 MET CA C 13 56.059 . . . . . . . 472 MET CA . 25698 1 192 . 1 1 55 55 MET N N 15 113.27 . . . . . . . 472 MET N . 25698 1 193 . 1 1 56 56 GLY H H 1 7.474 . . . . . . . 473 GLY HN . 25698 1 194 . 1 1 56 56 GLY C C 13 174.04 . . . . . . . 473 GLY C . 25698 1 195 . 1 1 56 56 GLY CA C 13 45.001 . . . . . . . 473 GLY CA . 25698 1 196 . 1 1 56 56 GLY N N 15 106.52 . . . . . . . 473 GLY N . 25698 1 197 . 1 1 57 57 GLU H H 1 7.846 . . . . . . . 474 GLU HN . 25698 1 198 . 1 1 57 57 GLU C C 13 174.01 . . . . . . . 474 GLU C . 25698 1 199 . 1 1 57 57 GLU CA C 13 56.649 . . . . . . . 474 GLU CA . 25698 1 200 . 1 1 57 57 GLU N N 15 118.22 . . . . . . . 474 GLU N . 25698 1 201 . 1 1 58 58 LEU H H 1 6.452 . . . . . . . 475 LEU HN . 25698 1 202 . 1 1 58 58 LEU C C 13 174.01 . . . . . . . 475 LEU C . 25698 1 203 . 1 1 58 58 LEU CA C 13 52.818 . . . . . . . 475 LEU CA . 25698 1 204 . 1 1 58 58 LEU N N 15 119.55 . . . . . . . 475 LEU N . 25698 1 205 . 1 1 59 59 GLU H H 1 8.628 . . . . . . . 476 GLU HN . 25698 1 206 . 1 1 59 59 GLU N N 15 127.23 . . . . . . . 476 GLU N . 25698 1 207 . 1 1 60 60 PRO C C 13 176.75 . . . . . . . 477 PRO C . 25698 1 208 . 1 1 60 60 PRO CA C 13 62.519 . . . . . . . 477 PRO CA . 25698 1 209 . 1 1 61 61 SER H H 1 9.195 . . . . . . . 478 SER HN . 25698 1 210 . 1 1 61 61 SER C C 13 174.07 . . . . . . . 478 SER C . 25698 1 211 . 1 1 61 61 SER CA C 13 59.918 . . . . . . . 478 SER CA . 25698 1 212 . 1 1 61 61 SER N N 15 119.56 . . . . . . . 478 SER N . 25698 1 213 . 1 1 62 62 GLU H H 1 7.828 . . . . . . . 479 GLU HN . 25698 1 214 . 1 1 62 62 GLU C C 13 174.26 . . . . . . . 479 GLU C . 25698 1 215 . 1 1 62 62 GLU CA C 13 54.903 . . . . . . . 479 GLU CA . 25698 1 216 . 1 1 62 62 GLU N N 15 119.59 . . . . . . . 479 GLU N . 25698 1 217 . 1 1 63 63 GLY H H 1 8.330 . . . . . . . 480 GLY HN . 25698 1 218 . 1 1 63 63 GLY C C 13 173.51 . . . . . . . 480 GLY C . 25698 1 219 . 1 1 63 63 GLY CA C 13 44.731 . . . . . . . 480 GLY CA . 25698 1 220 . 1 1 63 63 GLY N N 15 107.88 . . . . . . . 480 GLY N . 25698 1 221 . 1 1 64 64 LYS H H 1 8.234 . . . . . . . 481 LYS HN . 25698 1 222 . 1 1 64 64 LYS C C 13 173.72 . . . . . . . 481 LYS C . 25698 1 223 . 1 1 64 64 LYS CA C 13 54.660 . . . . . . . 481 LYS CA . 25698 1 224 . 1 1 64 64 LYS N N 15 116.58 . . . . . . . 481 LYS N . 25698 1 225 . 1 1 65 65 ILE H H 1 8.484 . . . . . . . 482 ILE HN . 25698 1 226 . 1 1 65 65 ILE C C 13 174.68 . . . . . . . 482 ILE C . 25698 1 227 . 1 1 65 65 ILE CA C 13 59.144 . . . . . . . 482 ILE CA . 25698 1 228 . 1 1 65 65 ILE N N 15 121.80 . . . . . . . 482 ILE N . 25698 1 229 . 1 1 66 66 LYS H H 1 8.955 . . . . . . . 483 LYS HN . 25698 1 230 . 1 1 66 66 LYS C C 13 174.53 . . . . . . . 483 LYS C . 25698 1 231 . 1 1 66 66 LYS CA C 13 54.906 . . . . . . . 483 LYS CA . 25698 1 232 . 1 1 66 66 LYS N N 15 127.05 . . . . . . . 483 LYS N . 25698 1 233 . 1 1 67 67 HIS H H 1 8.043 . . . . . . . 484 HIS HN . 25698 1 234 . 1 1 67 67 HIS C C 13 173.79 . . . . . . . 484 HIS C . 25698 1 235 . 1 1 67 67 HIS CA C 13 56.025 . . . . . . . 484 HIS CA . 25698 1 236 . 1 1 67 67 HIS N N 15 119.08 . . . . . . . 484 HIS N . 25698 1 237 . 1 1 68 68 SER H H 1 8.706 . . . . . . . 485 SER HN . 25698 1 238 . 1 1 68 68 SER C C 13 174.65 . . . . . . . 485 SER C . 25698 1 239 . 1 1 68 68 SER CA C 13 58.015 . . . . . . . 485 SER CA . 25698 1 240 . 1 1 68 68 SER N N 15 116.11 . . . . . . . 485 SER N . 25698 1 241 . 1 1 69 69 GLY C C 13 173.48 . . . . . . . 486 GLY C . 25698 1 242 . 1 1 69 69 GLY CA C 13 44.866 . . . . . . . 486 GLY CA . 25698 1 243 . 1 1 70 70 ARG H H 1 8.962 . . . . . . . 487 ARG HN . 25698 1 244 . 1 1 70 70 ARG C C 13 176.05 . . . . . . . 487 ARG C . 25698 1 245 . 1 1 70 70 ARG CA C 13 55.572 . . . . . . . 487 ARG CA . 25698 1 246 . 1 1 70 70 ARG N N 15 121.51 . . . . . . . 487 ARG N . 25698 1 247 . 1 1 71 71 ILE H H 1 8.694 . . . . . . . 488 ILE HN . 25698 1 248 . 1 1 71 71 ILE C C 13 175.77 . . . . . . . 488 ILE C . 25698 1 249 . 1 1 71 71 ILE CA C 13 60.021 . . . . . . . 488 ILE CA . 25698 1 250 . 1 1 71 71 ILE N N 15 125.69 . . . . . . . 488 ILE N . 25698 1 251 . 1 1 72 72 SER H H 1 8.160 . . . . . . . 489 SER HN . 25698 1 252 . 1 1 72 72 SER C C 13 172.36 . . . . . . . 489 SER C . 25698 1 253 . 1 1 72 72 SER CA C 13 55.480 . . . . . . . 489 SER CA . 25698 1 254 . 1 1 72 72 SER N N 15 119.75 . . . . . . . 489 SER N . 25698 1 255 . 1 1 73 73 PHE H H 1 8.949 . . . . . . . 490 PHE HN . 25698 1 256 . 1 1 73 73 PHE C C 13 173.63 . . . . . . . 490 PHE C . 25698 1 257 . 1 1 73 73 PHE CA C 13 54.618 . . . . . . . 490 PHE CA . 25698 1 258 . 1 1 73 73 PHE N N 15 130.08 . . . . . . . 490 PHE N . 25698 1 259 . 1 1 74 74 CYS H H 1 8.869 . . . . . . . 491 CYS HN . 25698 1 260 . 1 1 74 74 CYS C C 13 170.70 . . . . . . . 491 CYS C . 25698 1 261 . 1 1 74 74 CYS CA C 13 56.528 . . . . . . . 491 CYS CA . 25698 1 262 . 1 1 74 74 CYS N N 15 130.63 . . . . . . . 491 CYS N . 25698 1 263 . 1 1 75 75 SER H H 1 8.011 . . . . . . . 492 SER HN . 25698 1 264 . 1 1 75 75 SER CA C 13 57.018 . . . . . . . 492 SER CA . 25698 1 265 . 1 1 75 75 SER N N 15 120.98 . . . . . . . 492 SER N . 25698 1 266 . 1 1 82 82 PRO C C 13 176.47 . . . . . . . 499 PRO C . 25698 1 267 . 1 1 82 82 PRO CA C 13 62.956 . . . . . . . 499 PRO CA . 25698 1 268 . 1 1 83 83 GLY H H 1 7.930 . . . . . . . 500 GLY HN . 25698 1 269 . 1 1 83 83 GLY C C 13 172.79 . . . . . . . 500 GLY C . 25698 1 270 . 1 1 83 83 GLY CA C 13 43.471 . . . . . . . 500 GLY CA . 25698 1 271 . 1 1 83 83 GLY N N 15 112.41 . . . . . . . 500 GLY N . 25698 1 272 . 1 1 84 84 THR H H 1 9.010 . . . . . . . 501 THR HN . 25698 1 273 . 1 1 84 84 THR N N 15 111.15 . . . . . . . 501 THR N . 25698 1 274 . 1 1 86 86 LYS C C 13 178.56 . . . . . . . 503 LYS C . 25698 1 275 . 1 1 86 86 LYS CA C 13 60.375 . . . . . . . 503 LYS CA . 25698 1 276 . 1 1 87 87 GLU C C 13 178.95 . . . . . . . 504 GLU C . 25698 1 277 . 1 1 87 87 GLU CA C 13 58.933 . . . . . . . 504 GLU CA . 25698 1 278 . 1 1 88 88 ASN H H 1 8.013 . . . . . . . 505 ASN HN . 25698 1 279 . 1 1 88 88 ASN C C 13 175.74 . . . . . . . 505 ASN C . 25698 1 280 . 1 1 88 88 ASN CA C 13 56.935 . . . . . . . 505 ASN CA . 25698 1 281 . 1 1 88 88 ASN N N 15 116.64 . . . . . . . 505 ASN N . 25698 1 282 . 1 1 89 89 ILE H H 1 7.561 . . . . . . . 506 ILE HN . 25698 1 283 . 1 1 89 89 ILE C C 13 175.48 . . . . . . . 506 ILE C . 25698 1 284 . 1 1 89 89 ILE CA C 13 64.515 . . . . . . . 506 ILE CA . 25698 1 285 . 1 1 89 89 ILE N N 15 117.86 . . . . . . . 506 ILE N . 25698 1 286 . 1 1 90 90 ILE H H 1 8.016 . . . . . . . 507 ILE HN . 25698 1 287 . 1 1 90 90 ILE C C 13 177.30 . . . . . . . 507 ILE C . 25698 1 288 . 1 1 90 90 ILE CA C 13 61.645 . . . . . . . 507 ILE CA . 25698 1 289 . 1 1 90 90 ILE N N 15 110.26 . . . . . . . 507 ILE N . 25698 1 290 . 1 1 91 91 GLY H H 1 7.801 . . . . . . . 508 GLY HN . 25698 1 291 . 1 1 91 91 GLY C C 13 174.56 . . . . . . . 508 GLY C . 25698 1 292 . 1 1 91 91 GLY CA C 13 46.564 . . . . . . . 508 GLY CA . 25698 1 293 . 1 1 91 91 GLY N N 15 110.89 . . . . . . . 508 GLY N . 25698 1 294 . 1 1 92 92 VAL H H 1 8.445 . . . . . . . 509 VAL HN . 25698 1 295 . 1 1 92 92 VAL C C 13 175.79 . . . . . . . 509 VAL C . 25698 1 296 . 1 1 92 92 VAL CA C 13 61.974 . . . . . . . 509 VAL CA . 25698 1 297 . 1 1 92 92 VAL N N 15 120.37 . . . . . . . 509 VAL N . 25698 1 298 . 1 1 93 93 SER H H 1 7.773 . . . . . . . 510 SER HN . 25698 1 299 . 1 1 93 93 SER CA C 13 56.876 . . . . . . . 510 SER CA . 25698 1 300 . 1 1 93 93 SER N N 15 115.55 . . . . . . . 510 SER N . 25698 1 301 . 1 1 94 94 TYR C C 13 172.72 . . . . . . . 511 TYR C . 25698 1 302 . 1 1 94 94 TYR CA C 13 57.625 . . . . . . . 511 TYR CA . 25698 1 303 . 1 1 95 95 ASP H H 1 7.493 . . . . . . . 512 ASP HN . 25698 1 304 . 1 1 95 95 ASP C C 13 174.52 . . . . . . . 512 ASP C . 25698 1 305 . 1 1 95 95 ASP CA C 13 52.709 . . . . . . . 512 ASP CA . 25698 1 306 . 1 1 95 95 ASP N N 15 131.23 . . . . . . . 512 ASP N . 25698 1 307 . 1 1 96 96 GLU H H 1 8.617 . . . . . . . 513 GLU HN . 25698 1 308 . 1 1 96 96 GLU C C 13 176.83 . . . . . . . 513 GLU C . 25698 1 309 . 1 1 96 96 GLU CA C 13 59.791 . . . . . . . 513 GLU CA . 25698 1 310 . 1 1 96 96 GLU N N 15 126.78 . . . . . . . 513 GLU N . 25698 1 311 . 1 1 97 97 TYR H H 1 8.139 . . . . . . . 514 TYR HN . 25698 1 312 . 1 1 97 97 TYR C C 13 179.02 . . . . . . . 514 TYR C . 25698 1 313 . 1 1 97 97 TYR CA C 13 61.128 . . . . . . . 514 TYR CA . 25698 1 314 . 1 1 97 97 TYR N N 15 118.90 . . . . . . . 514 TYR N . 25698 1 315 . 1 1 98 98 ARG H H 1 8.465 . . . . . . . 515 ARG HN . 25698 1 316 . 1 1 98 98 ARG C C 13 178.50 . . . . . . . 515 ARG C . 25698 1 317 . 1 1 98 98 ARG CA C 13 59.172 . . . . . . . 515 ARG CA . 25698 1 318 . 1 1 98 98 ARG N N 15 123.06 . . . . . . . 515 ARG N . 25698 1 319 . 1 1 99 99 TYR H H 1 9.025 . . . . . . . 516 TYR HN . 25698 1 320 . 1 1 99 99 TYR C C 13 176.37 . . . . . . . 516 TYR C . 25698 1 321 . 1 1 99 99 TYR CA C 13 61.810 . . . . . . . 516 TYR CA . 25698 1 322 . 1 1 99 99 TYR N N 15 119.99 . . . . . . . 516 TYR N . 25698 1 323 . 1 1 100 100 ARG H H 1 8.519 . . . . . . . 517 ARG HN . 25698 1 324 . 1 1 100 100 ARG C C 13 179.26 . . . . . . . 517 ARG C . 25698 1 325 . 1 1 100 100 ARG CA C 13 58.910 . . . . . . . 517 ARG CA . 25698 1 326 . 1 1 100 100 ARG N N 15 116.83 . . . . . . . 517 ARG N . 25698 1 327 . 1 1 101 101 SER H H 1 7.938 . . . . . . . 518 SER HN . 25698 1 328 . 1 1 101 101 SER C C 13 176.65 . . . . . . . 518 SER C . 25698 1 329 . 1 1 101 101 SER CA C 13 61.788 . . . . . . . 518 SER CA . 25698 1 330 . 1 1 101 101 SER N N 15 114.55 . . . . . . . 518 SER N . 25698 1 331 . 1 1 102 102 VAL H H 1 8.222 . . . . . . . 519 VAL HN . 25698 1 332 . 1 1 102 102 VAL C C 13 177.16 . . . . . . . 519 VAL C . 25698 1 333 . 1 1 102 102 VAL CA C 13 66.517 . . . . . . . 519 VAL CA . 25698 1 334 . 1 1 102 102 VAL N N 15 123.76 . . . . . . . 519 VAL N . 25698 1 335 . 1 1 103 103 ILE H H 1 8.281 . . . . . . . 520 ILE HN . 25698 1 336 . 1 1 103 103 ILE C C 13 178.03 . . . . . . . 520 ILE C . 25698 1 337 . 1 1 103 103 ILE CA C 13 64.180 . . . . . . . 520 ILE CA . 25698 1 338 . 1 1 103 103 ILE N N 15 118.96 . . . . . . . 520 ILE N . 25698 1 339 . 1 1 104 104 LYS H H 1 7.539 . . . . . . . 521 LYS HN . 25698 1 340 . 1 1 104 104 LYS C C 13 180.01 . . . . . . . 521 LYS C . 25698 1 341 . 1 1 104 104 LYS CA C 13 59.067 . . . . . . . 521 LYS CA . 25698 1 342 . 1 1 104 104 LYS N N 15 119.38 . . . . . . . 521 LYS N . 25698 1 343 . 1 1 105 105 ALA H H 1 8.018 . . . . . . . 522 ALA HN . 25698 1 344 . 1 1 105 105 ALA C C 13 178.46 . . . . . . . 522 ALA C . 25698 1 345 . 1 1 105 105 ALA CA C 13 54.984 . . . . . . . 522 ALA CA . 25698 1 346 . 1 1 105 105 ALA N N 15 121.89 . . . . . . . 522 ALA N . 25698 1 347 . 1 1 106 106 CYS H H 1 7.857 . . . . . . . 523 CYS HN . 25698 1 348 . 1 1 106 106 CYS C C 13 171.25 . . . . . . . 523 CYS C . 25698 1 349 . 1 1 106 106 CYS CA C 13 60.222 . . . . . . . 523 CYS CA . 25698 1 350 . 1 1 106 106 CYS N N 15 110.32 . . . . . . . 523 CYS N . 25698 1 351 . 1 1 107 107 GLN H H 1 7.772 . . . . . . . 524 GLN HN . 25698 1 352 . 1 1 107 107 GLN C C 13 175.76 . . . . . . . 524 GLN C . 25698 1 353 . 1 1 107 107 GLN CA C 13 56.084 . . . . . . . 524 GLN CA . 25698 1 354 . 1 1 107 107 GLN N N 15 112.57 . . . . . . . 524 GLN N . 25698 1 355 . 1 1 108 108 LEU H H 1 8.250 . . . . . . . 525 LEU HN . 25698 1 356 . 1 1 108 108 LEU C C 13 177.15 . . . . . . . 525 LEU C . 25698 1 357 . 1 1 108 108 LEU CA C 13 54.654 . . . . . . . 525 LEU CA . 25698 1 358 . 1 1 108 108 LEU N N 15 116.08 . . . . . . . 525 LEU N . 25698 1 359 . 1 1 109 109 GLU H H 1 7.850 . . . . . . . 526 GLU HN . 25698 1 360 . 1 1 109 109 GLU C C 13 178.85 . . . . . . . 526 GLU C . 25698 1 361 . 1 1 109 109 GLU CA C 13 60.370 . . . . . . . 526 GLU CA . 25698 1 362 . 1 1 109 109 GLU N N 15 121.17 . . . . . . . 526 GLU N . 25698 1 363 . 1 1 110 110 GLU H H 1 8.643 . . . . . . . 527 GLU HN . 25698 1 364 . 1 1 110 110 GLU C C 13 178.53 . . . . . . . 527 GLU C . 25698 1 365 . 1 1 110 110 GLU CA C 13 58.136 . . . . . . . 527 GLU CA . 25698 1 366 . 1 1 110 110 GLU N N 15 119.32 . . . . . . . 527 GLU N . 25698 1 367 . 1 1 111 111 ASP H H 1 7.831 . . . . . . . 528 ASP HN . 25698 1 368 . 1 1 111 111 ASP C C 13 177.76 . . . . . . . 528 ASP C . 25698 1 369 . 1 1 111 111 ASP CA C 13 57.070 . . . . . . . 528 ASP CA . 25698 1 370 . 1 1 111 111 ASP N N 15 118.49 . . . . . . . 528 ASP N . 25698 1 371 . 1 1 112 112 ILE H H 1 7.980 . . . . . . . 529 ILE HN . 25698 1 372 . 1 1 112 112 ILE C C 13 176.80 . . . . . . . 529 ILE C . 25698 1 373 . 1 1 112 112 ILE CA C 13 64.882 . . . . . . . 529 ILE CA . 25698 1 374 . 1 1 112 112 ILE N N 15 115.67 . . . . . . . 529 ILE N . 25698 1 375 . 1 1 113 113 SER H H 1 7.615 . . . . . . . 530 SER HN . 25698 1 376 . 1 1 113 113 SER C C 13 175.01 . . . . . . . 530 SER C . 25698 1 377 . 1 1 113 113 SER CA C 13 60.493 . . . . . . . 530 SER CA . 25698 1 378 . 1 1 113 113 SER N N 15 112.16 . . . . . . . 530 SER N . 25698 1 379 . 1 1 114 114 LYS H H 1 7.096 . . . . . . . 531 LYS HN . 25698 1 380 . 1 1 114 114 LYS C C 13 176.95 . . . . . . . 531 LYS C . 25698 1 381 . 1 1 114 114 LYS CA C 13 56.655 . . . . . . . 531 LYS CA . 25698 1 382 . 1 1 114 114 LYS N N 15 119.27 . . . . . . . 531 LYS N . 25698 1 383 . 1 1 115 115 PHE H H 1 7.420 . . . . . . . 532 PHE HN . 25698 1 384 . 1 1 115 115 PHE N N 15 118.74 . . . . . . . 532 PHE N . 25698 1 385 . 1 1 118 118 LYS C C 13 174.97 . . . . . . . 535 LYS C . 25698 1 386 . 1 1 119 119 ASP H H 1 8.746 . . . . . . . 536 ASP HN . 25698 1 387 . 1 1 119 119 ASP C C 13 174.57 . . . . . . . 536 ASP C . 25698 1 388 . 1 1 119 119 ASP CA C 13 53.697 . . . . . . . 536 ASP CA . 25698 1 389 . 1 1 119 119 ASP N N 15 116.71 . . . . . . . 536 ASP N . 25698 1 390 . 1 1 120 120 ASN H H 1 8.267 . . . . . . . 537 ASN HN . 25698 1 391 . 1 1 120 120 ASN C C 13 174.02 . . . . . . . 537 ASN C . 25698 1 392 . 1 1 120 120 ASN CA C 13 52.335 . . . . . . . 537 ASN CA . 25698 1 393 . 1 1 120 120 ASN N N 15 115.20 . . . . . . . 537 ASN N . 25698 1 394 . 1 1 121 121 ILE H H 1 7.240 . . . . . . . 538 ILE HN . 25698 1 395 . 1 1 121 121 ILE C C 13 172.96 . . . . . . . 538 ILE C . 25698 1 396 . 1 1 121 121 ILE CA C 13 60.594 . . . . . . . 538 ILE CA . 25698 1 397 . 1 1 121 121 ILE N N 15 120.77 . . . . . . . 538 ILE N . 25698 1 398 . 1 1 122 122 VAL H H 1 7.800 . . . . . . . 539 VAL HN . 25698 1 399 . 1 1 122 122 VAL C C 13 175.02 . . . . . . . 539 VAL C . 25698 1 400 . 1 1 122 122 VAL CA C 13 62.985 . . . . . . . 539 VAL CA . 25698 1 401 . 1 1 122 122 VAL N N 15 125.15 . . . . . . . 539 VAL N . 25698 1 402 . 1 1 123 123 LEU H H 1 8.508 . . . . . . . 540 LEU HN . 25698 1 403 . 1 1 123 123 LEU C C 13 177.21 . . . . . . . 540 LEU C . 25698 1 404 . 1 1 123 123 LEU CA C 13 53.044 . . . . . . . 540 LEU CA . 25698 1 405 . 1 1 123 123 LEU N N 15 126.85 . . . . . . . 540 LEU N . 25698 1 406 . 1 1 124 124 GLY H H 1 8.325 . . . . . . . 541 GLY HN . 25698 1 407 . 1 1 124 124 GLY C C 13 173.80 . . . . . . . 541 GLY C . 25698 1 408 . 1 1 124 124 GLY CA C 13 43.799 . . . . . . . 541 GLY CA . 25698 1 409 . 1 1 124 124 GLY N N 15 108.24 . . . . . . . 541 GLY N . 25698 1 410 . 1 1 125 125 GLU H H 1 8.572 . . . . . . . 542 GLU HN . 25698 1 411 . 1 1 125 125 GLU C C 13 177.70 . . . . . . . 542 GLU C . 25698 1 412 . 1 1 125 125 GLU CA C 13 57.630 . . . . . . . 542 GLU CA . 25698 1 413 . 1 1 125 125 GLU N N 15 121.61 . . . . . . . 542 GLU N . 25698 1 414 . 1 1 126 126 GLY H H 1 8.777 . . . . . . . 543 GLY HN . 25698 1 415 . 1 1 126 126 GLY C C 13 174.36 . . . . . . . 543 GLY C . 25698 1 416 . 1 1 126 126 GLY CA C 13 45.052 . . . . . . . 543 GLY CA . 25698 1 417 . 1 1 126 126 GLY N N 15 113.65 . . . . . . . 543 GLY N . 25698 1 418 . 1 1 127 127 GLY H H 1 8.256 . . . . . . . 544 GLY HN . 25698 1 419 . 1 1 127 127 GLY N N 15 110.13 . . . . . . . 544 GLY N . 25698 1 420 . 1 1 130 130 LEU C C 13 176.86 . . . . . . . 547 LEU C . 25698 1 421 . 1 1 130 130 LEU CA C 13 53.143 . . . . . . . 547 LEU CA . 25698 1 422 . 1 1 131 131 SER H H 1 9.039 . . . . . . . 548 SER HN . 25698 1 423 . 1 1 131 131 SER CA C 13 56.796 . . . . . . . 548 SER CA . 25698 1 424 . 1 1 131 131 SER N N 15 117.30 . . . . . . . 548 SER N . 25698 1 425 . 1 1 133 133 GLY C C 13 176.85 . . . . . . . 550 GLY C . 25698 1 426 . 1 1 134 134 GLN H H 1 7.758 . . . . . . . 551 GLN HN . 25698 1 427 . 1 1 134 134 GLN C C 13 178.24 . . . . . . . 551 GLN C . 25698 1 428 . 1 1 134 134 GLN CA C 13 59.526 . . . . . . . 551 GLN CA . 25698 1 429 . 1 1 134 134 GLN N N 15 122.21 . . . . . . . 551 GLN N . 25698 1 430 . 1 1 135 135 ARG H H 1 8.465 . . . . . . . 552 ARG HN . 25698 1 431 . 1 1 135 135 ARG C C 13 178.56 . . . . . . . 552 ARG C . 25698 1 432 . 1 1 135 135 ARG CA C 13 60.380 . . . . . . . 552 ARG CA . 25698 1 433 . 1 1 135 135 ARG N N 15 117.88 . . . . . . . 552 ARG N . 25698 1 434 . 1 1 136 136 ALA H H 1 8.246 . . . . . . . 553 ALA HN . 25698 1 435 . 1 1 136 136 ALA CA C 13 55.021 . . . . . . . 553 ALA CA . 25698 1 436 . 1 1 136 136 ALA N N 15 121.93 . . . . . . . 553 ALA N . 25698 1 437 . 1 1 137 137 ARG C C 13 177.79 . . . . . . . 554 ARG C . 25698 1 438 . 1 1 137 137 ARG CA C 13 61.084 . . . . . . . 554 ARG CA . 25698 1 439 . 1 1 138 138 ILE H H 1 8.301 . . . . . . . 555 ILE HN . 25698 1 440 . 1 1 138 138 ILE C C 13 176.06 . . . . . . . 555 ILE C . 25698 1 441 . 1 1 138 138 ILE CA C 13 65.366 . . . . . . . 555 ILE CA . 25698 1 442 . 1 1 138 138 ILE N N 15 120.07 . . . . . . . 555 ILE N . 25698 1 443 . 1 1 139 139 SER H H 1 7.982 . . . . . . . 556 SER HN . 25698 1 444 . 1 1 139 139 SER N N 15 114.67 . . . . . . . 556 SER N . 25698 1 445 . 1 1 142 142 ARG C C 13 178.78 . . . . . . . 559 ARG C . 25698 1 446 . 1 1 142 142 ARG CA C 13 58.414 . . . . . . . 559 ARG CA . 25698 1 447 . 1 1 143 143 ALA H H 1 7.380 . . . . . . . 560 ALA HN . 25698 1 448 . 1 1 143 143 ALA C C 13 180.34 . . . . . . . 560 ALA C . 25698 1 449 . 1 1 143 143 ALA CA C 13 54.036 . . . . . . . 560 ALA CA . 25698 1 450 . 1 1 143 143 ALA N N 15 119.88 . . . . . . . 560 ALA N . 25698 1 451 . 1 1 144 144 VAL H H 1 8.515 . . . . . . . 561 VAL HN . 25698 1 452 . 1 1 144 144 VAL C C 13 175.70 . . . . . . . 561 VAL C . 25698 1 453 . 1 1 144 144 VAL CA C 13 64.113 . . . . . . . 561 VAL CA . 25698 1 454 . 1 1 144 144 VAL N N 15 115.61 . . . . . . . 561 VAL N . 25698 1 455 . 1 1 145 145 TYR H H 1 8.764 . . . . . . . 562 TYR HN . 25698 1 456 . 1 1 145 145 TYR C C 13 176.77 . . . . . . . 562 TYR C . 25698 1 457 . 1 1 145 145 TYR CA C 13 61.351 . . . . . . . 562 TYR CA . 25698 1 458 . 1 1 145 145 TYR N N 15 119.81 . . . . . . . 562 TYR N . 25698 1 459 . 1 1 146 146 LYS H H 1 6.959 . . . . . . . 563 LYS HN . 25698 1 460 . 1 1 146 146 LYS CA C 13 56.948 . . . . . . . 563 LYS CA . 25698 1 461 . 1 1 146 146 LYS N N 15 118.65 . . . . . . . 563 LYS N . 25698 1 462 . 1 1 147 147 ASP C C 13 173.38 . . . . . . . 564 ASP C . 25698 1 463 . 1 1 147 147 ASP CA C 13 54.719 . . . . . . . 564 ASP CA . 25698 1 464 . 1 1 148 148 ALA H H 1 7.787 . . . . . . . 565 ALA HN . 25698 1 465 . 1 1 148 148 ALA N N 15 127.91 . . . . . . . 565 ALA N . 25698 1 466 . 1 1 149 149 ASP C C 13 174.75 . . . . . . . 566 ASP C . 25698 1 467 . 1 1 149 149 ASP CA C 13 55.268 . . . . . . . 566 ASP CA . 25698 1 468 . 1 1 150 150 LEU H H 1 7.563 . . . . . . . 567 LEU HN . 25698 1 469 . 1 1 150 150 LEU C C 13 172.79 . . . . . . . 567 LEU C . 25698 1 470 . 1 1 150 150 LEU CA C 13 53.535 . . . . . . . 567 LEU CA . 25698 1 471 . 1 1 150 150 LEU N N 15 121.03 . . . . . . . 567 LEU N . 25698 1 472 . 1 1 151 151 TYR H H 1 8.545 . . . . . . . 568 TYR HN . 25698 1 473 . 1 1 151 151 TYR C C 13 173.54 . . . . . . . 568 TYR C . 25698 1 474 . 1 1 151 151 TYR CA C 13 56.873 . . . . . . . 568 TYR CA . 25698 1 475 . 1 1 151 151 TYR N N 15 124.92 . . . . . . . 568 TYR N . 25698 1 476 . 1 1 152 152 LEU H H 1 9.215 . . . . . . . 569 LEU HN . 25698 1 477 . 1 1 152 152 LEU C C 13 173.69 . . . . . . . 569 LEU C . 25698 1 478 . 1 1 152 152 LEU CA C 13 52.519 . . . . . . . 569 LEU CA . 25698 1 479 . 1 1 152 152 LEU N N 15 123.54 . . . . . . . 569 LEU N . 25698 1 480 . 1 1 153 153 LEU H H 1 9.472 . . . . . . . 570 LEU HN . 25698 1 481 . 1 1 153 153 LEU N N 15 124.52 . . . . . . . 570 LEU N . 25698 1 482 . 1 1 159 159 TYR C C 13 175.31 . . . . . . . 576 TYR C . 25698 1 483 . 1 1 159 159 TYR CA C 13 59.576 . . . . . . . 576 TYR CA . 25698 1 484 . 1 1 160 160 LEU H H 1 7.652 . . . . . . . 577 LEU HN . 25698 1 485 . 1 1 160 160 LEU C C 13 176.64 . . . . . . . 577 LEU C . 25698 1 486 . 1 1 160 160 LEU CA C 13 53.619 . . . . . . . 577 LEU CA . 25698 1 487 . 1 1 160 160 LEU N N 15 118.50 . . . . . . . 577 LEU N . 25698 1 488 . 1 1 161 161 ASP H H 1 8.273 . . . . . . . 578 ASP HN . 25698 1 489 . 1 1 161 161 ASP N N 15 120.74 . . . . . . . 578 ASP N . 25698 1 490 . 1 1 162 162 VAL C C 13 178.01 . . . . . . . 579 VAL C . 25698 1 491 . 1 1 162 162 VAL CA C 13 65.451 . . . . . . . 579 VAL CA . 25698 1 492 . 1 1 163 163 LEU H H 1 8.102 . . . . . . . 580 LEU HN . 25698 1 493 . 1 1 163 163 LEU N N 15 121.97 . . . . . . . 580 LEU N . 25698 1 494 . 1 1 164 164 THR C C 13 175.90 . . . . . . . 581 THR C . 25698 1 495 . 1 1 164 164 THR CA C 13 66.409 . . . . . . . 581 THR CA . 25698 1 496 . 1 1 165 165 GLU H H 1 8.502 . . . . . . . 582 GLU HN . 25698 1 497 . 1 1 165 165 GLU C C 13 176.00 . . . . . . . 582 GLU C . 25698 1 498 . 1 1 165 165 GLU CA C 13 59.922 . . . . . . . 582 GLU CA . 25698 1 499 . 1 1 165 165 GLU N N 15 121.25 . . . . . . . 582 GLU N . 25698 1 500 . 1 1 166 166 LYS H H 1 7.607 . . . . . . . 583 LYS HN . 25698 1 501 . 1 1 166 166 LYS C C 13 178.69 . . . . . . . 583 LYS C . 25698 1 502 . 1 1 166 166 LYS CA C 13 59.535 . . . . . . . 583 LYS CA . 25698 1 503 . 1 1 166 166 LYS N N 15 119.39 . . . . . . . 583 LYS N . 25698 1 504 . 1 1 167 167 GLU H H 1 8.035 . . . . . . . 584 GLU HN . 25698 1 505 . 1 1 167 167 GLU C C 13 179.48 . . . . . . . 584 GLU C . 25698 1 506 . 1 1 167 167 GLU CA C 13 58.830 . . . . . . . 584 GLU CA . 25698 1 507 . 1 1 167 167 GLU N N 15 118.14 . . . . . . . 584 GLU N . 25698 1 508 . 1 1 168 168 ILE H H 1 8.528 . . . . . . . 585 ILE HN . 25698 1 509 . 1 1 168 168 ILE C C 13 179.05 . . . . . . . 585 ILE C . 25698 1 510 . 1 1 168 168 ILE CA C 13 64.615 . . . . . . . 585 ILE CA . 25698 1 511 . 1 1 168 168 ILE N N 15 119.60 . . . . . . . 585 ILE N . 25698 1 512 . 1 1 169 169 PHE H H 1 9.194 . . . . . . . 586 PHE HN . 25698 1 513 . 1 1 169 169 PHE C C 13 176.70 . . . . . . . 586 PHE C . 25698 1 514 . 1 1 169 169 PHE CA C 13 62.723 . . . . . . . 586 PHE CA . 25698 1 515 . 1 1 169 169 PHE N N 15 124.74 . . . . . . . 586 PHE N . 25698 1 516 . 1 1 170 170 GLU H H 1 8.158 . . . . . . . 587 GLU HN . 25698 1 517 . 1 1 170 170 GLU C C 13 171.85 . . . . . . . 587 GLU C . 25698 1 518 . 1 1 170 170 GLU CA C 13 59.624 . . . . . . . 587 GLU CA . 25698 1 519 . 1 1 170 170 GLU N N 15 117.14 . . . . . . . 587 GLU N . 25698 1 520 . 1 1 171 171 SER H H 1 8.970 . . . . . . . 588 SER HN . 25698 1 521 . 1 1 171 171 SER C C 13 175.90 . . . . . . . 588 SER C . 25698 1 522 . 1 1 171 171 SER CA C 13 61.821 . . . . . . . 588 SER CA . 25698 1 523 . 1 1 171 171 SER N N 15 112.90 . . . . . . . 588 SER N . 25698 1 524 . 1 1 172 172 CYS H H 1 9.199 . . . . . . . 589 CYS HN . 25698 1 525 . 1 1 172 172 CYS C C 13 173.76 . . . . . . . 589 CYS C . 25698 1 526 . 1 1 172 172 CYS CA C 13 60.581 . . . . . . . 589 CYS CA . 25698 1 527 . 1 1 172 172 CYS N N 15 121.45 . . . . . . . 589 CYS N . 25698 1 528 . 1 1 173 173 VAL H H 1 7.146 . . . . . . . 590 VAL HN . 25698 1 529 . 1 1 173 173 VAL C C 13 176.12 . . . . . . . 590 VAL C . 25698 1 530 . 1 1 173 173 VAL CA C 13 66.461 . . . . . . . 590 VAL CA . 25698 1 531 . 1 1 173 173 VAL N N 15 115.73 . . . . . . . 590 VAL N . 25698 1 532 . 1 1 174 174 CYS H H 1 7.299 . . . . . . . 591 CYS HN . 25698 1 533 . 1 1 174 174 CYS C C 13 175.01 . . . . . . . 591 CYS C . 25698 1 534 . 1 1 174 174 CYS CA C 13 61.118 . . . . . . . 591 CYS CA . 25698 1 535 . 1 1 174 174 CYS N N 15 112.60 . . . . . . . 591 CYS N . 25698 1 536 . 1 1 175 175 LYS H H 1 6.834 . . . . . . . 592 LYS HN . 25698 1 537 . 1 1 175 175 LYS C C 13 177.40 . . . . . . . 592 LYS C . 25698 1 538 . 1 1 175 175 LYS CA C 13 58.306 . . . . . . . 592 LYS CA . 25698 1 539 . 1 1 175 175 LYS N N 15 117.09 . . . . . . . 592 LYS N . 25698 1 540 . 1 1 176 176 LEU H H 1 7.936 . . . . . . . 593 LEU HN . 25698 1 541 . 1 1 176 176 LEU C C 13 178.61 . . . . . . . 593 LEU C . 25698 1 542 . 1 1 176 176 LEU CA C 13 58.708 . . . . . . . 593 LEU CA . 25698 1 543 . 1 1 176 176 LEU N N 15 122.20 . . . . . . . 593 LEU N . 25698 1 544 . 1 1 177 177 MET H H 1 7.125 . . . . . . . 594 MET HN . 25698 1 545 . 1 1 177 177 MET C C 13 174.06 . . . . . . . 594 MET C . 25698 1 546 . 1 1 177 177 MET CA C 13 54.222 . . . . . . . 594 MET CA . 25698 1 547 . 1 1 177 177 MET N N 15 111.61 . . . . . . . 594 MET N . 25698 1 548 . 1 1 178 178 ALA H H 1 6.757 . . . . . . . 595 ALA HN . 25698 1 549 . 1 1 178 178 ALA C C 13 177.14 . . . . . . . 595 ALA C . 25698 1 550 . 1 1 178 178 ALA CA C 13 54.624 . . . . . . . 595 ALA CA . 25698 1 551 . 1 1 178 178 ALA N N 15 118.93 . . . . . . . 595 ALA N . 25698 1 552 . 1 1 179 179 ASN H H 1 8.520 . . . . . . . 596 ASN HN . 25698 1 553 . 1 1 179 179 ASN C C 13 174.62 . . . . . . . 596 ASN C . 25698 1 554 . 1 1 179 179 ASN CA C 13 52.883 . . . . . . . 596 ASN CA . 25698 1 555 . 1 1 179 179 ASN N N 15 110.93 . . . . . . . 596 ASN N . 25698 1 556 . 1 1 180 180 LYS H H 1 7.805 . . . . . . . 597 LYS HN . 25698 1 557 . 1 1 180 180 LYS C C 13 175.69 . . . . . . . 597 LYS C . 25698 1 558 . 1 1 180 180 LYS CA C 13 52.624 . . . . . . . 597 LYS CA . 25698 1 559 . 1 1 180 180 LYS N N 15 118.07 . . . . . . . 597 LYS N . 25698 1 560 . 1 1 181 181 THR H H 1 8.804 . . . . . . . 598 THR HN . 25698 1 561 . 1 1 181 181 THR C C 13 174.09 . . . . . . . 598 THR C . 25698 1 562 . 1 1 181 181 THR CA C 13 63.681 . . . . . . . 598 THR CA . 25698 1 563 . 1 1 181 181 THR N N 15 122.92 . . . . . . . 598 THR N . 25698 1 564 . 1 1 182 182 ARG H H 1 9.303 . . . . . . . 599 ARG HN . 25698 1 565 . 1 1 182 182 ARG C C 13 173.33 . . . . . . . 599 ARG C . 25698 1 566 . 1 1 182 182 ARG CA C 13 53.995 . . . . . . . 599 ARG CA . 25698 1 567 . 1 1 182 182 ARG N N 15 126.91 . . . . . . . 599 ARG N . 25698 1 568 . 1 1 183 183 ILE H H 1 8.993 . . . . . . . 600 ILE HN . 25698 1 569 . 1 1 183 183 ILE C C 13 173.01 . . . . . . . 600 ILE C . 25698 1 570 . 1 1 183 183 ILE CA C 13 60.449 . . . . . . . 600 ILE CA . 25698 1 571 . 1 1 183 183 ILE N N 15 120.61 . . . . . . . 600 ILE N . 25698 1 572 . 1 1 184 184 LEU H H 1 9.182 . . . . . . . 601 LEU HN . 25698 1 573 . 1 1 184 184 LEU C C 13 174.64 . . . . . . . 601 LEU C . 25698 1 574 . 1 1 184 184 LEU CA C 13 51.946 . . . . . . . 601 LEU CA . 25698 1 575 . 1 1 184 184 LEU N N 15 129.29 . . . . . . . 601 LEU N . 25698 1 576 . 1 1 185 185 VAL H H 1 8.963 . . . . . . . 602 VAL HN . 25698 1 577 . 1 1 185 185 VAL C C 13 175.06 . . . . . . . 602 VAL C . 25698 1 578 . 1 1 185 185 VAL CA C 13 61.520 . . . . . . . 602 VAL CA . 25698 1 579 . 1 1 185 185 VAL N N 15 129.46 . . . . . . . 602 VAL N . 25698 1 580 . 1 1 186 186 THR H H 1 8.587 . . . . . . . 603 THR HN . 25698 1 581 . 1 1 186 186 THR C C 13 170.67 . . . . . . . 603 THR C . 25698 1 582 . 1 1 186 186 THR CA C 13 59.177 . . . . . . . 603 THR CA . 25698 1 583 . 1 1 186 186 THR N N 15 122.05 . . . . . . . 603 THR N . 25698 1 584 . 1 1 187 187 SER H H 1 8.119 . . . . . . . 604 SER HN . 25698 1 585 . 1 1 187 187 SER C C 13 173.62 . . . . . . . 604 SER C . 25698 1 586 . 1 1 187 187 SER CA C 13 56.633 . . . . . . . 604 SER CA . 25698 1 587 . 1 1 187 187 SER N N 15 117.77 . . . . . . . 604 SER N . 25698 1 588 . 1 1 188 188 LYS H H 1 7.853 . . . . . . . 605 LYS HN . 25698 1 589 . 1 1 188 188 LYS C C 13 177.30 . . . . . . . 605 LYS C . 25698 1 590 . 1 1 188 188 LYS CA C 13 54.557 . . . . . . . 605 LYS CA . 25698 1 591 . 1 1 188 188 LYS N N 15 121.17 . . . . . . . 605 LYS N . 25698 1 592 . 1 1 189 189 MET H H 1 9.035 . . . . . . . 606 MET HN . 25698 1 593 . 1 1 189 189 MET C C 13 177.37 . . . . . . . 606 MET C . 25698 1 594 . 1 1 189 189 MET CA C 13 58.105 . . . . . . . 606 MET CA . 25698 1 595 . 1 1 189 189 MET N N 15 127.74 . . . . . . . 606 MET N . 25698 1 596 . 1 1 190 190 GLU H H 1 9.043 . . . . . . . 607 GLU HN . 25698 1 597 . 1 1 190 190 GLU C C 13 177.61 . . . . . . . 607 GLU C . 25698 1 598 . 1 1 190 190 GLU CA C 13 58.976 . . . . . . . 607 GLU CA . 25698 1 599 . 1 1 190 190 GLU N N 15 115.92 . . . . . . . 607 GLU N . 25698 1 600 . 1 1 191 191 HIS H H 1 6.823 . . . . . . . 608 HIS HN . 25698 1 601 . 1 1 191 191 HIS C C 13 177.37 . . . . . . . 608 HIS C . 25698 1 602 . 1 1 191 191 HIS CA C 13 55.300 . . . . . . . 608 HIS CA . 25698 1 603 . 1 1 191 191 HIS N N 15 116.68 . . . . . . . 608 HIS N . 25698 1 604 . 1 1 192 192 LEU H H 1 7.414 . . . . . . . 609 LEU HN . 25698 1 605 . 1 1 192 192 LEU C C 13 177.72 . . . . . . . 609 LEU C . 25698 1 606 . 1 1 192 192 LEU CA C 13 58.172 . . . . . . . 609 LEU CA . 25698 1 607 . 1 1 192 192 LEU N N 15 117.99 . . . . . . . 609 LEU N . 25698 1 608 . 1 1 193 193 LYS H H 1 7.371 . . . . . . . 610 LYS HN . 25698 1 609 . 1 1 193 193 LYS C C 13 177.22 . . . . . . . 610 LYS C . 25698 1 610 . 1 1 193 193 LYS CA C 13 58.239 . . . . . . . 610 LYS CA . 25698 1 611 . 1 1 193 193 LYS N N 15 114.15 . . . . . . . 610 LYS N . 25698 1 612 . 1 1 194 194 LYS H H 1 6.967 . . . . . . . 611 LYS HN . 25698 1 613 . 1 1 194 194 LYS C C 13 175.54 . . . . . . . 611 LYS C . 25698 1 614 . 1 1 194 194 LYS CA C 13 54.624 . . . . . . . 611 LYS CA . 25698 1 615 . 1 1 194 194 LYS N N 15 115.75 . . . . . . . 611 LYS N . 25698 1 616 . 1 1 195 195 ALA H H 1 7.365 . . . . . . . 612 ALA HN . 25698 1 617 . 1 1 195 195 ALA C C 13 176.51 . . . . . . . 612 ALA C . 25698 1 618 . 1 1 195 195 ALA CA C 13 52.147 . . . . . . . 612 ALA CA . 25698 1 619 . 1 1 195 195 ALA N N 15 122.24 . . . . . . . 612 ALA N . 25698 1 620 . 1 1 196 196 ASP H H 1 9.026 . . . . . . . 613 ASP HN . 25698 1 621 . 1 1 196 196 ASP C C 13 176.85 . . . . . . . 613 ASP C . 25698 1 622 . 1 1 196 196 ASP CA C 13 57.570 . . . . . . . 613 ASP CA . 25698 1 623 . 1 1 196 196 ASP N N 15 120.94 . . . . . . . 613 ASP N . 25698 1 624 . 1 1 197 197 LYS H H 1 7.984 . . . . . . . 614 LYS HN . 25698 1 625 . 1 1 197 197 LYS C C 13 173.09 . . . . . . . 614 LYS C . 25698 1 626 . 1 1 197 197 LYS CA C 13 53.486 . . . . . . . 614 LYS CA . 25698 1 627 . 1 1 197 197 LYS N N 15 114.64 . . . . . . . 614 LYS N . 25698 1 628 . 1 1 198 198 ILE H H 1 9.223 . . . . . . . 615 ILE HN . 25698 1 629 . 1 1 198 198 ILE C C 13 172.70 . . . . . . . 615 ILE C . 25698 1 630 . 1 1 198 198 ILE CA C 13 59.578 . . . . . . . 615 ILE CA . 25698 1 631 . 1 1 198 198 ILE N N 15 120.04 . . . . . . . 615 ILE N . 25698 1 632 . 1 1 199 199 LEU H H 1 9.095 . . . . . . . 616 LEU HN . 25698 1 633 . 1 1 199 199 LEU C C 13 174.33 . . . . . . . 616 LEU C . 25698 1 634 . 1 1 199 199 LEU CA C 13 52.950 . . . . . . . 616 LEU CA . 25698 1 635 . 1 1 199 199 LEU N N 15 126.68 . . . . . . . 616 LEU N . 25698 1 636 . 1 1 200 200 ILE H H 1 9.570 . . . . . . . 617 ILE HN . 25698 1 637 . 1 1 200 200 ILE C C 13 175.61 . . . . . . . 617 ILE C . 25698 1 638 . 1 1 200 200 ILE CA C 13 59.244 . . . . . . . 617 ILE CA . 25698 1 639 . 1 1 200 200 ILE N N 15 124.79 . . . . . . . 617 ILE N . 25698 1 640 . 1 1 201 201 LEU H H 1 8.954 . . . . . . . 618 LEU HN . 25698 1 641 . 1 1 201 201 LEU C C 13 176.35 . . . . . . . 618 LEU C . 25698 1 642 . 1 1 201 201 LEU CA C 13 52.683 . . . . . . . 618 LEU CA . 25698 1 643 . 1 1 201 201 LEU N N 15 127.70 . . . . . . . 618 LEU N . 25698 1 644 . 1 1 202 202 HIS H H 1 9.237 . . . . . . . 619 HIS HN . 25698 1 645 . 1 1 202 202 HIS C C 13 174.80 . . . . . . . 619 HIS C . 25698 1 646 . 1 1 202 202 HIS CA C 13 56.700 . . . . . . . 619 HIS CA . 25698 1 647 . 1 1 202 202 HIS N N 15 119.04 . . . . . . . 619 HIS N . 25698 1 648 . 1 1 203 203 GLU H H 1 9.575 . . . . . . . 620 GLU HN . 25698 1 649 . 1 1 203 203 GLU C C 13 176.06 . . . . . . . 620 GLU C . 25698 1 650 . 1 1 203 203 GLU CA C 13 56.833 . . . . . . . 620 GLU CA . 25698 1 651 . 1 1 203 203 GLU N N 15 126.88 . . . . . . . 620 GLU N . 25698 1 652 . 1 1 204 204 GLY H H 1 7.886 . . . . . . . 621 GLY HN . 25698 1 653 . 1 1 204 204 GLY C C 13 172.33 . . . . . . . 621 GLY C . 25698 1 654 . 1 1 204 204 GLY CA C 13 46.858 . . . . . . . 621 GLY CA . 25698 1 655 . 1 1 204 204 GLY N N 15 105.28 . . . . . . . 621 GLY N . 25698 1 656 . 1 1 205 205 SER H H 1 7.981 . . . . . . . 622 SER HN . 25698 1 657 . 1 1 205 205 SER C C 13 173.38 . . . . . . . 622 SER C . 25698 1 658 . 1 1 205 205 SER CA C 13 56.900 . . . . . . . 622 SER CA . 25698 1 659 . 1 1 205 205 SER N N 15 113.99 . . . . . . . 622 SER N . 25698 1 660 . 1 1 206 206 SER H H 1 9.278 . . . . . . . 623 SER HN . 25698 1 661 . 1 1 206 206 SER C C 13 174.04 . . . . . . . 623 SER C . 25698 1 662 . 1 1 206 206 SER CA C 13 57.217 . . . . . . . 623 SER CA . 25698 1 663 . 1 1 206 206 SER N N 15 116.38 . . . . . . . 623 SER N . 25698 1 664 . 1 1 207 207 TYR H H 1 9.408 . . . . . . . 624 TYR HN . 25698 1 665 . 1 1 207 207 TYR C C 13 175.48 . . . . . . . 624 TYR C . 25698 1 666 . 1 1 207 207 TYR CA C 13 59.110 . . . . . . . 624 TYR CA . 25698 1 667 . 1 1 207 207 TYR N N 15 133.26 . . . . . . . 624 TYR N . 25698 1 668 . 1 1 208 208 PHE H H 1 7.896 . . . . . . . 625 PHE HN . 25698 1 669 . 1 1 208 208 PHE C C 13 171.38 . . . . . . . 625 PHE C . 25698 1 670 . 1 1 208 208 PHE CA C 13 58.440 . . . . . . . 625 PHE CA . 25698 1 671 . 1 1 208 208 PHE N N 15 116.70 . . . . . . . 625 PHE N . 25698 1 672 . 1 1 209 209 TYR H H 1 7.236 . . . . . . . 626 TYR HN . 25698 1 673 . 1 1 209 209 TYR C C 13 173.51 . . . . . . . 626 TYR C . 25698 1 674 . 1 1 209 209 TYR CA C 13 54.959 . . . . . . . 626 TYR CA . 25698 1 675 . 1 1 209 209 TYR N N 15 127.73 . . . . . . . 626 TYR N . 25698 1 676 . 1 1 210 210 GLY H H 1 7.982 . . . . . . . 627 GLY HN . 25698 1 677 . 1 1 210 210 GLY C C 13 171.57 . . . . . . . 627 GLY C . 25698 1 678 . 1 1 210 210 GLY CA C 13 45.452 . . . . . . . 627 GLY CA . 25698 1 679 . 1 1 210 210 GLY N N 15 115.67 . . . . . . . 627 GLY N . 25698 1 680 . 1 1 211 211 THR H H 1 8.888 . . . . . . . 628 THR HN . 25698 1 681 . 1 1 211 211 THR C C 13 175.32 . . . . . . . 628 THR C . 25698 1 682 . 1 1 211 211 THR CA C 13 60.248 . . . . . . . 628 THR CA . 25698 1 683 . 1 1 211 211 THR N N 15 113.00 . . . . . . . 628 THR N . 25698 1 684 . 1 1 212 212 PHE H H 1 9.439 . . . . . . . 629 PHE HN . 25698 1 685 . 1 1 212 212 PHE C C 13 176.64 . . . . . . . 629 PHE C . 25698 1 686 . 1 1 212 212 PHE CA C 13 62.390 . . . . . . . 629 PHE CA . 25698 1 687 . 1 1 212 212 PHE N N 15 121.91 . . . . . . . 629 PHE N . 25698 1 688 . 1 1 213 213 SER H H 1 8.626 . . . . . . . 630 SER HN . 25698 1 689 . 1 1 213 213 SER C C 13 177.01 . . . . . . . 630 SER C . 25698 1 690 . 1 1 213 213 SER CA C 13 61.252 . . . . . . . 630 SER CA . 25698 1 691 . 1 1 213 213 SER N N 15 112.80 . . . . . . . 630 SER N . 25698 1 692 . 1 1 214 214 GLU H H 1 7.443 . . . . . . . 631 GLU HN . 25698 1 693 . 1 1 214 214 GLU C C 13 178.22 . . . . . . . 631 GLU C . 25698 1 694 . 1 1 214 214 GLU CA C 13 58.507 . . . . . . . 631 GLU CA . 25698 1 695 . 1 1 214 214 GLU N N 15 121.13 . . . . . . . 631 GLU N . 25698 1 696 . 1 1 215 215 LEU H H 1 7.910 . . . . . . . 632 LEU HN . 25698 1 697 . 1 1 215 215 LEU C C 13 177.53 . . . . . . . 632 LEU C . 25698 1 698 . 1 1 215 215 LEU CA C 13 57.465 . . . . . . . 632 LEU CA . 25698 1 699 . 1 1 215 215 LEU N N 15 123.62 . . . . . . . 632 LEU N . 25698 1 700 . 1 1 216 216 GLN H H 1 7.673 . . . . . . . 633 GLN HN . 25698 1 701 . 1 1 216 216 GLN C C 13 176.76 . . . . . . . 633 GLN C . 25698 1 702 . 1 1 216 216 GLN CA C 13 57.803 . . . . . . . 633 GLN CA . 25698 1 703 . 1 1 216 216 GLN N N 15 114.58 . . . . . . . 633 GLN N . 25698 1 704 . 1 1 217 217 ASN H H 1 7.260 . . . . . . . 634 ASN HN . 25698 1 705 . 1 1 217 217 ASN C C 13 175.83 . . . . . . . 634 ASN C . 25698 1 706 . 1 1 217 217 ASN CA C 13 54.360 . . . . . . . 634 ASN CA . 25698 1 707 . 1 1 217 217 ASN N N 15 114.57 . . . . . . . 634 ASN N . 25698 1 708 . 1 1 218 218 LEU H H 1 7.825 . . . . . . . 635 LEU HN . 25698 1 709 . 1 1 218 218 LEU C C 13 177.26 . . . . . . . 635 LEU C . 25698 1 710 . 1 1 218 218 LEU CA C 13 55.819 . . . . . . . 635 LEU CA . 25698 1 711 . 1 1 218 218 LEU N N 15 119.74 . . . . . . . 635 LEU N . 25698 1 712 . 1 1 219 219 GLN H H 1 8.268 . . . . . . . 636 GLN HN . 25698 1 713 . 1 1 219 219 GLN N N 15 117.58 . . . . . . . 636 GLN N . 25698 1 714 . 1 1 220 220 PRO C C 13 177.06 . . . . . . . 637 PRO C . 25698 1 715 . 1 1 220 220 PRO CA C 13 64.340 . . . . . . . 637 PRO CA . 25698 1 716 . 1 1 221 221 ASP H H 1 8.363 . . . . . . . 638 ASP HN . 25698 1 717 . 1 1 221 221 ASP C C 13 176.69 . . . . . . . 638 ASP C . 25698 1 718 . 1 1 221 221 ASP CA C 13 53.543 . . . . . . . 638 ASP CA . 25698 1 719 . 1 1 221 221 ASP N N 15 117.22 . . . . . . . 638 ASP N . 25698 1 720 . 1 1 222 222 PHE H H 1 7.986 . . . . . . . 639 PHE HN . 25698 1 721 . 1 1 222 222 PHE C C 13 175.49 . . . . . . . 639 PHE C . 25698 1 722 . 1 1 222 222 PHE CA C 13 59.788 . . . . . . . 639 PHE CA . 25698 1 723 . 1 1 222 222 PHE N N 15 120.67 . . . . . . . 639 PHE N . 25698 1 724 . 1 1 223 223 SER H H 1 7.805 . . . . . . . 640 SER HN . 25698 1 725 . 1 1 223 223 SER C C 13 175.49 . . . . . . . 640 SER C . 25698 1 726 . 1 1 223 223 SER CA C 13 59.846 . . . . . . . 640 SER CA . 25698 1 727 . 1 1 223 223 SER N N 15 116.50 . . . . . . . 640 SER N . 25698 1 728 . 1 1 224 224 SER H H 1 8.032 . . . . . . . 641 SER HN . 25698 1 729 . 1 1 224 224 SER C C 13 175.37 . . . . . . . 641 SER C . 25698 1 730 . 1 1 224 224 SER CA C 13 60.080 . . . . . . . 641 SER CA . 25698 1 731 . 1 1 224 224 SER N N 15 117.18 . . . . . . . 641 SER N . 25698 1 732 . 1 1 225 225 LYS H H 1 7.789 . . . . . . . 642 LYS HN . 25698 1 733 . 1 1 225 225 LYS C C 13 176.53 . . . . . . . 642 LYS C . 25698 1 734 . 1 1 225 225 LYS CA C 13 56.519 . . . . . . . 642 LYS CA . 25698 1 735 . 1 1 225 225 LYS N N 15 121.06 . . . . . . . 642 LYS N . 25698 1 736 . 1 1 226 226 LEU H H 1 7.514 . . . . . . . 643 LEU HN . 25698 1 737 . 1 1 226 226 LEU C C 13 176.47 . . . . . . . 643 LEU C . 25698 1 738 . 1 1 226 226 LEU CA C 13 55.012 . . . . . . . 643 LEU CA . 25698 1 739 . 1 1 226 226 LEU N N 15 118.50 . . . . . . . 643 LEU N . 25698 1 740 . 1 1 227 227 MET H H 1 7.731 . . . . . . . 644 MET HN . 25698 1 741 . 1 1 227 227 MET C C 13 175.26 . . . . . . . 644 MET C . 25698 1 742 . 1 1 227 227 MET CA C 13 55.060 . . . . . . . 644 MET CA . 25698 1 743 . 1 1 227 227 MET N N 15 117.11 . . . . . . . 644 MET N . 25698 1 744 . 1 1 228 228 GLY H H 1 7.843 . . . . . . . 645 GLY HN . 25698 1 745 . 1 1 228 228 GLY CA C 13 46.031 . . . . . . . 645 GLY CA . 25698 1 746 . 1 1 228 228 GLY N N 15 115.09 . . . . . . . 645 GLY N . 25698 1 stop_ save_