data_18530 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 18530 _Entry.Title ; 1H, 13C and 15N resonance assignment of the pair of complement control protein modules of human C7 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2012-06-18 _Entry.Accession_date 2012-06-18 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _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 Janice Bramham . . . 18530 2 Carla Clark . A. . 18530 3 Paul Barlow . N. . 18530 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' . 18530 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 18530 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 569 18530 '15N chemical shifts' 132 18530 '1H chemical shifts' 880 18530 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 . . 2014-02-19 2012-06-18 update BMRB 'update entry citation' 18530 1 . . 2012-11-02 2012-06-18 original author 'original release' 18530 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 18530 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 23054935 _Citation.Full_citation . _Citation.Title '1H, 13C and 15N resonance assignments of the complement control protein modules of the complement component C7.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full 'Biomolecular NMR assignments' _Citation.Journal_volume 7 _Citation.Journal_issue 2 _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 285 _Citation.Page_last 288 _Citation.Year 2013 _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 Carla Clark . . . 18530 1 2 Chuong-Thu Thai . . . 18530 1 3 Marie Phelan . M. . 18530 1 4 Juraj Bella . . . 18530 1 5 Duan Uhrin . . . 18530 1 6 Ronald Ogata . T. . 18530 1 7 Paul Barlow . N. . 18530 1 8 Janice Bramham . . . 18530 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID C7 18530 1 'complement control protein' 18530 1 NMR 18530 1 structure 18530 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 18530 _Assembly.ID 1 _Assembly.Name C7CCPs _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _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 'all free' _Assembly.Molecular_mass 13990.1061 _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 C7_CCPs 1 $C7_CCPs B . yes native no no . . . 18530 1 stop_ loop_ _Bond.ID _Bond.Type _Bond.Value_order _Bond.Assembly_atom_ID_1 _Bond.Entity_assembly_ID_1 _Bond.Entity_assembly_name_1 _Bond.Entity_ID_1 _Bond.Comp_ID_1 _Bond.Comp_index_ID_1 _Bond.Seq_ID_1 _Bond.Atom_ID_1 _Bond.Assembly_atom_ID_2 _Bond.Entity_assembly_ID_2 _Bond.Entity_assembly_name_2 _Bond.Entity_ID_2 _Bond.Comp_ID_2 _Bond.Comp_index_ID_2 _Bond.Seq_ID_2 _Bond.Atom_ID_2 _Bond.Auth_entity_assembly_ID_1 _Bond.Auth_entity_assembly_name_1 _Bond.Auth_seq_ID_1 _Bond.Auth_comp_ID_1 _Bond.Auth_atom_ID_1 _Bond.Auth_entity_assembly_ID_2 _Bond.Auth_entity_assembly_name_2 _Bond.Auth_seq_ID_2 _Bond.Auth_comp_ID_2 _Bond.Auth_atom_ID_2 _Bond.Entry_ID _Bond.Assembly_ID 1 disulfide single . 1 C7_CCPs 1 CYS 8 8 SG . 1 C7_CCPs 1 CYS 50 50 SG . C7_CCPs 570 CYS SG . C7_CCPs 612 CYS SG 18530 1 2 disulfide single . 1 C7_CCPs 1 CYS 36 36 SG . 1 C7_CCPs 1 CYS 63 63 SG . C7_CCPs 598 CYS SG . C7_CCPs 625 CYS SG 18530 1 3 disulfide single . 1 C7_CCPs 1 CYS 68 68 SG . 1 C7_CCPs 1 CYS 110 110 SG . C7_CCPs 630 CYS SG . C7_CCPs 672 CYS SG 18530 1 4 disulfide single . 1 C7_CCPs 1 CYS 96 96 SG . 1 C7_CCPs 1 CYS 125 125 SG . C7_CCPs 658 CYS SG . C7_CCPs 687 CYS SG 18530 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_C7_CCPs _Entity.Sf_category entity _Entity.Sf_framecode C7_CCPs _Entity.Entry_ID 18530 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name C7_CCPs _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID B _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSHMTEFCPSPPALKDGFVQ DEGTMFPVGKNVVYTCNEGY SLIGNPVARCGEDLRWLVGE MHCQKIACVLPVLMDGIQSH PQKPFYTVGEKVTVSCSGGM SLEGPSAFLCGSSLKWSPEM KNARCVQKE ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'Residues 1-4 represent a cloning artefact' _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 129 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all disulfide bound' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 13990.1061 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 yes SP P10643 . CO7_HUMAN . . . . . . . . . . . . . . 18530 1 2 no DBJ BAF83038 . "unnamed protein product [Homo sapiens]" . . . . . 96.90 843 100.00 100.00 2.41e-79 . . . . 18530 1 3 no DBJ BAG35608 . "unnamed protein product [Homo sapiens]" . . . . . 96.90 843 100.00 100.00 1.53e-79 . . . . 18530 1 4 no DBJ BAJ20698 . "complement component 7 [synthetic construct]" . . . . . 96.90 843 100.00 100.00 1.73e-79 . . . . 18530 1 5 no EMBL CAA60121 . "complement C7 [Homo sapiens]" . . . . . 96.90 820 100.00 100.00 1.52e-79 . . . . 18530 1 6 no EMBL CAH91280 . "hypothetical protein [Pongo abelii]" . . . . . 96.90 843 98.40 99.20 3.92e-78 . . . . 18530 1 7 no GB AAA51861 . "complement protein C7 precursor [Homo sapiens]" . . . . . 96.90 843 99.20 99.20 1.76e-78 . . . . 18530 1 8 no GB AAH63851 . "Complement component 7 [Homo sapiens]" . . . . . 96.90 843 100.00 100.00 1.73e-79 . . . . 18530 1 9 no GB ADR82762 . "complement component 7 [synthetic construct]" . . . . . 96.90 843 100.00 100.00 1.73e-79 . . . . 18530 1 10 no GB AIC48386 . "C7, partial [synthetic construct]" . . . . . 96.90 843 100.00 100.00 1.73e-79 . . . . 18530 1 11 no GB AKI71774 . "C7, partial [synthetic construct]" . . . . . 96.90 843 100.00 100.00 1.75e-79 . . . . 18530 1 12 no REF NP_000578 . "complement component C7 precursor [Homo sapiens]" . . . . . 96.90 843 100.00 100.00 1.73e-79 . . . . 18530 1 13 no REF NP_001125756 . "complement component C7 precursor [Pongo abelii]" . . . . . 96.90 843 98.40 99.20 3.92e-78 . . . . 18530 1 14 no REF XP_001138984 . "PREDICTED: complement component C7 [Pan troglodytes]" . . . . . 96.90 843 100.00 100.00 1.61e-79 . . . . 18530 1 15 no REF XP_003274433 . "PREDICTED: complement component C7 [Nomascus leucogenys]" . . . . . 96.90 842 97.60 99.20 7.40e-78 . . . . 18530 1 16 no REF XP_003811023 . "PREDICTED: complement component C7 isoform X1 [Pan paniscus]" . . . . . 96.90 843 100.00 100.00 1.61e-79 . . . . 18530 1 17 no SP P10643 . "RecName: Full=Complement component C7; Flags: Precursor" . . . . . 96.90 843 100.00 100.00 1.73e-79 . . . . 18530 1 18 no SP Q5RAD0 . "RecName: Full=Complement component C7; Flags: Precursor" . . . . . 96.90 843 98.40 99.20 3.92e-78 . . . . 18530 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'extracellular component of membrane attack complex of complement' 18530 1 stop_ 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 1 564 GLY . 18530 1 2 565 SER . 18530 1 3 566 HIS . 18530 1 4 567 MET . 18530 1 5 568 THR . 18530 1 6 569 GLU . 18530 1 7 570 PHE . 18530 1 8 571 CYS . 18530 1 9 572 PRO . 18530 1 10 573 SER . 18530 1 11 574 PRO . 18530 1 12 575 PRO . 18530 1 13 576 ALA . 18530 1 14 577 LEU . 18530 1 15 578 LYS . 18530 1 16 579 ASP . 18530 1 17 580 GLY . 18530 1 18 581 PHE . 18530 1 19 582 VAL . 18530 1 20 583 GLN . 18530 1 21 584 ASP . 18530 1 22 585 GLU . 18530 1 23 586 GLY . 18530 1 24 587 THR . 18530 1 25 588 MET . 18530 1 26 589 PHE . 18530 1 27 590 PRO . 18530 1 28 591 VAL . 18530 1 29 592 GLY . 18530 1 30 593 LYS . 18530 1 31 594 ASN . 18530 1 32 595 VAL . 18530 1 33 596 VAL . 18530 1 34 597 TYR . 18530 1 35 598 THR . 18530 1 36 599 CYS . 18530 1 37 600 ASN . 18530 1 38 601 GLU . 18530 1 39 602 GLY . 18530 1 40 603 TYR . 18530 1 41 604 SER . 18530 1 42 605 LEU . 18530 1 43 606 ILE . 18530 1 44 607 GLY . 18530 1 45 608 ASN . 18530 1 46 609 PRO . 18530 1 47 610 VAL . 18530 1 48 611 ALA . 18530 1 49 612 ARG . 18530 1 50 613 CYS . 18530 1 51 614 GLY . 18530 1 52 615 GLU . 18530 1 53 616 ASP . 18530 1 54 617 LEU . 18530 1 55 618 ARG . 18530 1 56 619 TRP . 18530 1 57 620 LEU . 18530 1 58 621 VAL . 18530 1 59 622 GLY . 18530 1 60 623 GLU . 18530 1 61 624 MET . 18530 1 62 625 HIS . 18530 1 63 626 CYS . 18530 1 64 627 GLN . 18530 1 65 628 LYS . 18530 1 66 629 ILE . 18530 1 67 630 ALA . 18530 1 68 631 CYS . 18530 1 69 632 VAL . 18530 1 70 633 LEU . 18530 1 71 634 PRO . 18530 1 72 635 VAL . 18530 1 73 636 LEU . 18530 1 74 637 MET . 18530 1 75 638 ASP . 18530 1 76 639 GLY . 18530 1 77 640 ILE . 18530 1 78 641 GLN . 18530 1 79 642 SER . 18530 1 80 643 HIS . 18530 1 81 644 PRO . 18530 1 82 645 GLN . 18530 1 83 646 LYS . 18530 1 84 647 PRO . 18530 1 85 648 PHE . 18530 1 86 649 TYR . 18530 1 87 650 THR . 18530 1 88 651 VAL . 18530 1 89 652 GLY . 18530 1 90 653 GLU . 18530 1 91 654 LYS . 18530 1 92 655 VAL . 18530 1 93 656 THR . 18530 1 94 657 VAL . 18530 1 95 658 SER . 18530 1 96 659 CYS . 18530 1 97 660 SER . 18530 1 98 661 GLY . 18530 1 99 662 GLY . 18530 1 100 663 MET . 18530 1 101 664 SER . 18530 1 102 665 LEU . 18530 1 103 666 GLU . 18530 1 104 667 GLY . 18530 1 105 668 PRO . 18530 1 106 669 SER . 18530 1 107 670 ALA . 18530 1 108 671 PHE . 18530 1 109 672 LEU . 18530 1 110 673 CYS . 18530 1 111 674 GLY . 18530 1 112 675 SER . 18530 1 113 676 SER . 18530 1 114 677 LEU . 18530 1 115 678 LYS . 18530 1 116 679 TRP . 18530 1 117 680 SER . 18530 1 118 681 PRO . 18530 1 119 682 GLU . 18530 1 120 683 MET . 18530 1 121 684 LYS . 18530 1 122 685 ASN . 18530 1 123 686 ALA . 18530 1 124 687 ARG . 18530 1 125 688 CYS . 18530 1 126 689 VAL . 18530 1 127 690 GLN . 18530 1 128 691 LYS . 18530 1 129 692 GLU . 18530 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 . GLY 1 1 18530 1 . SER 2 2 18530 1 . HIS 3 3 18530 1 . MET 4 4 18530 1 . THR 5 5 18530 1 . GLU 6 6 18530 1 . PHE 7 7 18530 1 . CYS 8 8 18530 1 . PRO 9 9 18530 1 . SER 10 10 18530 1 . PRO 11 11 18530 1 . PRO 12 12 18530 1 . ALA 13 13 18530 1 . LEU 14 14 18530 1 . LYS 15 15 18530 1 . ASP 16 16 18530 1 . GLY 17 17 18530 1 . PHE 18 18 18530 1 . VAL 19 19 18530 1 . GLN 20 20 18530 1 . ASP 21 21 18530 1 . GLU 22 22 18530 1 . GLY 23 23 18530 1 . THR 24 24 18530 1 . MET 25 25 18530 1 . PHE 26 26 18530 1 . PRO 27 27 18530 1 . VAL 28 28 18530 1 . GLY 29 29 18530 1 . LYS 30 30 18530 1 . ASN 31 31 18530 1 . VAL 32 32 18530 1 . VAL 33 33 18530 1 . TYR 34 34 18530 1 . THR 35 35 18530 1 . CYS 36 36 18530 1 . ASN 37 37 18530 1 . GLU 38 38 18530 1 . GLY 39 39 18530 1 . TYR 40 40 18530 1 . SER 41 41 18530 1 . LEU 42 42 18530 1 . ILE 43 43 18530 1 . GLY 44 44 18530 1 . ASN 45 45 18530 1 . PRO 46 46 18530 1 . VAL 47 47 18530 1 . ALA 48 48 18530 1 . ARG 49 49 18530 1 . CYS 50 50 18530 1 . GLY 51 51 18530 1 . GLU 52 52 18530 1 . ASP 53 53 18530 1 . LEU 54 54 18530 1 . ARG 55 55 18530 1 . TRP 56 56 18530 1 . LEU 57 57 18530 1 . VAL 58 58 18530 1 . GLY 59 59 18530 1 . GLU 60 60 18530 1 . MET 61 61 18530 1 . HIS 62 62 18530 1 . CYS 63 63 18530 1 . GLN 64 64 18530 1 . LYS 65 65 18530 1 . ILE 66 66 18530 1 . ALA 67 67 18530 1 . CYS 68 68 18530 1 . VAL 69 69 18530 1 . LEU 70 70 18530 1 . PRO 71 71 18530 1 . VAL 72 72 18530 1 . LEU 73 73 18530 1 . MET 74 74 18530 1 . ASP 75 75 18530 1 . GLY 76 76 18530 1 . ILE 77 77 18530 1 . GLN 78 78 18530 1 . SER 79 79 18530 1 . HIS 80 80 18530 1 . PRO 81 81 18530 1 . GLN 82 82 18530 1 . LYS 83 83 18530 1 . PRO 84 84 18530 1 . PHE 85 85 18530 1 . TYR 86 86 18530 1 . THR 87 87 18530 1 . VAL 88 88 18530 1 . GLY 89 89 18530 1 . GLU 90 90 18530 1 . LYS 91 91 18530 1 . VAL 92 92 18530 1 . THR 93 93 18530 1 . VAL 94 94 18530 1 . SER 95 95 18530 1 . CYS 96 96 18530 1 . SER 97 97 18530 1 . GLY 98 98 18530 1 . GLY 99 99 18530 1 . MET 100 100 18530 1 . SER 101 101 18530 1 . LEU 102 102 18530 1 . GLU 103 103 18530 1 . GLY 104 104 18530 1 . PRO 105 105 18530 1 . SER 106 106 18530 1 . ALA 107 107 18530 1 . PHE 108 108 18530 1 . LEU 109 109 18530 1 . CYS 110 110 18530 1 . GLY 111 111 18530 1 . SER 112 112 18530 1 . SER 113 113 18530 1 . LEU 114 114 18530 1 . LYS 115 115 18530 1 . TRP 116 116 18530 1 . SER 117 117 18530 1 . PRO 118 118 18530 1 . GLU 119 119 18530 1 . MET 120 120 18530 1 . LYS 121 121 18530 1 . ASN 122 122 18530 1 . ALA 123 123 18530 1 . ARG 124 124 18530 1 . CYS 125 125 18530 1 . VAL 126 126 18530 1 . GLN 127 127 18530 1 . LYS 128 128 18530 1 . GLU 129 129 18530 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 18530 _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.Subvariant _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.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $C7_CCPs . 9606 organism . 'Homo sapiens' Humans . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . C7 . . . . 18530 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 18530 _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_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _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.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $C7_CCPs . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli OrigamiB pLysS . . . . . . . . . . . . . . pET15b . . . . . . 18530 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 18530 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 3 _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 'potassium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 18530 1 2 EDTA 'natural abundance' . . . . . . 1 . . mM . . . . 18530 1 3 'sodium azide' 'natural abundance' . . . . . . 0.02 . . % . . . . 18530 1 4 C7_CCPs 'natural abundance' . . 1 $C7_CCPs . . 300 . . uM . . . . 18530 1 5 H2O 'natural abundance' . . . . . . 90 . . % . . . . 18530 1 6 D2O 'natural abundance' . . . . . . 10 . . % . . . . 18530 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 18530 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 3 _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 'potassium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 18530 2 2 EDTA 'natural abundance' . . . . . . 1 . . mM . . . . 18530 2 3 'sodium azide' 'natural abundance' . . . . . . 0.02 . . % . . . . 18530 2 4 C7_CCPs [U-15N] . . 1 $C7_CCPs . . 300 . . uM . . . . 18530 2 5 H2O 'natural abundance' . . . . . . 90 . . % . . . . 18530 2 6 D2O 'natural abundance' . . . . . . 10 . . % . . . . 18530 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 18530 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 3 _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 'potassium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 18530 3 2 EDTA 'natural abundance' . . . . . . 1 . . mM . . . . 18530 3 3 'sodium azide' 'natural abundance' . . . . . . 0.02 . . % . . . . 18530 3 4 C7_CCPs '[U-13C; U-15N]' . . 1 $C7_CCPs . . 300 . . uM . . . . 18530 3 5 H2O 'natural abundance' . . . . . . 90 . . % . . . . 18530 3 6 D2O 'natural abundance' . . . . . . 10 . . % . . . . 18530 3 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 18530 _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 pH 5.0 . pH 18530 1 pressure 1 . atm 18530 1 temperature 298 . K 18530 1 stop_ save_ ############################ # Computer software used # ############################ save_CcpNmr_Analysis _Software.Sf_category software _Software.Sf_framecode CcpNmr_Analysis _Software.Entry_ID 18530 _Software.ID 1 _Software.Name ANALYSIS _Software.Version 2.2.2 _Software.Details 'The CCPN NMR assignment and data analysis application' loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID CCPN 'Department of Biochemistry, Cambridge CB2 1GA, UK' http://www.ccpn.ac.uk 18530 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 18530 1 'peak picking' 18530 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 18530 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer spectrometer_1 _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 18530 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer spectrometer_2 _NMR_spectrometer.Model Avance _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 18530 _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 spectrometer_1 Avance . 800 . . . 18530 1 2 spectrometer_2 spectrometer_2 Avance . 600 . . . 18530 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 18530 _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 . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18530 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 18530 1 3 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18530 1 4 '2D hbCBcgcdHD' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18530 1 5 '2D hbCBcgcdceHE' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18530 1 6 '3D CBCANH' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18530 1 7 '3D CBCA(CO)NH' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18530 1 8 '3D HBHANH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18530 1 9 '3D HBHA(CO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18530 1 10 '3D HNCO' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18530 1 11 '3D H(CCO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18530 1 12 '3D C(CO)NH' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18530 1 13 '3D 1H-13C NOESY' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18530 1 14 '3D HCCH-TOCSY' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18530 1 15 '3D 1H-15N NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18530 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 18530 _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 . . . . . . . . . 18530 1 H 1 water protons . . . . ppm 4.772 internal direct 1 . . . . . . . . . 18530 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 18530 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 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list _Assigned_chem_shift_list.Entry_ID 18530 _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 0.01 _Assigned_chem_shift_list.Chem_shift_13C_err 0.1 _Assigned_chem_shift_list.Chem_shift_15N_err 0.1 _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' . . . 18530 1 2 '2D 1H-13C HSQC' . . . 18530 1 3 '2D 1H-13C HSQC aromatic' . . . 18530 1 4 '2D hbCBcgcdHD' . . . 18530 1 5 '2D hbCBcgcdceHE' . . . 18530 1 6 '3D CBCANH' . . . 18530 1 7 '3D CBCA(CO)NH' . . . 18530 1 8 '3D HBHANH' . . . 18530 1 9 '3D HBHA(CO)NH' . . . 18530 1 10 '3D HNCO' . . . 18530 1 11 '3D H(CCO)NH' . . . 18530 1 12 '3D C(CO)NH' . . . 18530 1 13 '3D 1H-13C NOESY' . . . 18530 1 14 '3D HCCH-TOCSY' . . . 18530 1 15 '3D 1H-15N NOESY' . . . 18530 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 GLY HA2 H 1 3.847 0.01 . 1 . . . . 564 GLY HA2 . 18530 1 2 . 1 1 1 1 GLY HA3 H 1 3.847 0.01 . 1 . . . . 564 GLY HA3 . 18530 1 3 . 1 1 1 1 GLY CA C 13 43.330 0.1 . 1 . . . . 564 GLY CA . 18530 1 4 . 1 1 2 2 SER H H 1 8.643 0.01 . 1 . . . . 565 SER H . 18530 1 5 . 1 1 2 2 SER HA H 1 4.446 0.01 . 1 . . . . 565 SER HA . 18530 1 6 . 1 1 2 2 SER HB2 H 1 3.794 0.01 . 2 . . . . 565 SER HB2 . 18530 1 7 . 1 1 2 2 SER HB3 H 1 3.794 0.01 . 2 . . . . 565 SER HB3 . 18530 1 8 . 1 1 2 2 SER C C 13 176.892 0.1 . 1 . . . . 565 SER C . 18530 1 9 . 1 1 2 2 SER CA C 13 58.206 0.1 . 1 . . . . 565 SER CA . 18530 1 10 . 1 1 2 2 SER CB C 13 63.908 0.1 . 1 . . . . 565 SER CB . 18530 1 11 . 1 1 2 2 SER N N 15 115.543 0.1 . 1 . . . . 565 SER N . 18530 1 12 . 1 1 3 3 HIS H H 1 8.668 0.01 . 1 . . . . 566 HIS H . 18530 1 13 . 1 1 3 3 HIS HA H 1 4.679 0.01 . 1 . . . . 566 HIS HA . 18530 1 14 . 1 1 3 3 HIS HB2 H 1 3.216 0.01 . 2 . . . . 566 HIS HB2 . 18530 1 15 . 1 1 3 3 HIS HB3 H 1 3.111 0.01 . 2 . . . . 566 HIS HB3 . 18530 1 16 . 1 1 3 3 HIS HD2 H 1 7.172 0.01 . 1 . . . . 566 HIS HD2 . 18530 1 17 . 1 1 3 3 HIS C C 13 176.637 0.1 . 1 . . . . 566 HIS C . 18530 1 18 . 1 1 3 3 HIS CA C 13 55.765 0.1 . 1 . . . . 566 HIS CA . 18530 1 19 . 1 1 3 3 HIS CB C 13 29.688 0.1 . 1 . . . . 566 HIS CB . 18530 1 20 . 1 1 3 3 HIS CD2 C 13 120.107 0.1 . 1 . . . . 566 HIS CD2 . 18530 1 21 . 1 1 3 3 HIS N N 15 120.676 0.1 . 1 . . . . 566 HIS N . 18530 1 22 . 1 1 4 4 MET H H 1 8.423 0.01 . 1 . . . . 567 MET H . 18530 1 23 . 1 1 4 4 MET HA H 1 4.470 0.01 . 1 . . . . 567 MET HA . 18530 1 24 . 1 1 4 4 MET HB2 H 1 1.973 0.01 . 2 . . . . 567 MET HB2 . 18530 1 25 . 1 1 4 4 MET HB3 H 1 2.068 0.01 . 2 . . . . 567 MET HB3 . 18530 1 26 . 1 1 4 4 MET HG2 H 1 2.463 0.01 . 2 . . . . 567 MET HG2 . 18530 1 27 . 1 1 4 4 MET HG3 H 1 2.535 0.01 . 2 . . . . 567 MET HG3 . 18530 1 28 . 1 1 4 4 MET HE1 H 1 2.053 0.01 . 1 . . . . 567 MET HE1 . 18530 1 29 . 1 1 4 4 MET HE2 H 1 2.053 0.01 . 1 . . . . 567 MET HE2 . 18530 1 30 . 1 1 4 4 MET HE3 H 1 2.053 0.01 . 1 . . . . 567 MET HE3 . 18530 1 31 . 1 1 4 4 MET C C 13 175.135 0.1 . 1 . . . . 567 MET C . 18530 1 32 . 1 1 4 4 MET CA C 13 55.795 0.1 . 1 . . . . 567 MET CA . 18530 1 33 . 1 1 4 4 MET CB C 13 32.870 0.1 . 1 . . . . 567 MET CB . 18530 1 34 . 1 1 4 4 MET CG C 13 31.955 0.1 . 1 . . . . 567 MET CG . 18530 1 35 . 1 1 4 4 MET CE C 13 16.945 0.1 . 1 . . . . 567 MET CE . 18530 1 36 . 1 1 4 4 MET N N 15 121.542 0.1 . 1 . . . . 567 MET N . 18530 1 37 . 1 1 5 5 THR H H 1 8.130 0.01 . 1 . . . . 568 THR H . 18530 1 38 . 1 1 5 5 THR HA H 1 4.278 0.01 . 1 . . . . 568 THR HA . 18530 1 39 . 1 1 5 5 THR HB H 1 4.145 0.01 . 1 . . . . 568 THR HB . 18530 1 40 . 1 1 5 5 THR HG21 H 1 1.048 0.01 . 1 . . . . 568 THR HG21 . 18530 1 41 . 1 1 5 5 THR HG22 H 1 1.048 0.01 . 1 . . . . 568 THR HG22 . 18530 1 42 . 1 1 5 5 THR HG23 H 1 1.048 0.01 . 1 . . . . 568 THR HG23 . 18530 1 43 . 1 1 5 5 THR C C 13 177.489 0.1 . 1 . . . . 568 THR C . 18530 1 44 . 1 1 5 5 THR CA C 13 62.009 0.1 . 1 . . . . 568 THR CA . 18530 1 45 . 1 1 5 5 THR CB C 13 69.384 0.1 . 1 . . . . 568 THR CB . 18530 1 46 . 1 1 5 5 THR CG2 C 13 21.884 0.1 . 1 . . . . 568 THR CG2 . 18530 1 47 . 1 1 5 5 THR N N 15 114.584 0.1 . 1 . . . . 568 THR N . 18530 1 48 . 1 1 6 6 GLU H H 1 7.880 0.01 . 1 . . . . 569 GLU H . 18530 1 49 . 1 1 6 6 GLU HA H 1 4.358 0.01 . 1 . . . . 569 GLU HA . 18530 1 50 . 1 1 6 6 GLU HB2 H 1 1.745 0.01 . 2 . . . . 569 GLU HB2 . 18530 1 51 . 1 1 6 6 GLU HB3 H 1 1.943 0.01 . 2 . . . . 569 GLU HB3 . 18530 1 52 . 1 1 6 6 GLU HG2 H 1 2.127 0.01 . 2 . . . . 569 GLU HG2 . 18530 1 53 . 1 1 6 6 GLU HG3 H 1 2.055 0.01 . 2 . . . . 569 GLU HG3 . 18530 1 54 . 1 1 6 6 GLU C C 13 177.141 0.1 . 1 . . . . 569 GLU C . 18530 1 55 . 1 1 6 6 GLU CA C 13 55.664 0.1 . 1 . . . . 569 GLU CA . 18530 1 56 . 1 1 6 6 GLU CB C 13 31.251 0.1 . 1 . . . . 569 GLU CB . 18530 1 57 . 1 1 6 6 GLU CG C 13 36.542 0.1 . 1 . . . . 569 GLU CG . 18530 1 58 . 1 1 6 6 GLU N N 15 122.950 0.1 . 1 . . . . 569 GLU N . 18530 1 59 . 1 1 7 7 PHE H H 1 7.911 0.01 . 1 . . . . 570 PHE H . 18530 1 60 . 1 1 7 7 PHE HA H 1 5.087 0.01 . 1 . . . . 570 PHE HA . 18530 1 61 . 1 1 7 7 PHE HB2 H 1 2.651 0.01 . 2 . . . . 570 PHE HB2 . 18530 1 62 . 1 1 7 7 PHE HB3 H 1 3.167 0.01 . 2 . . . . 570 PHE HB3 . 18530 1 63 . 1 1 7 7 PHE HD1 H 1 6.929 0.01 . 3 . . . . 570 PHE HD1 . 18530 1 64 . 1 1 7 7 PHE HD2 H 1 6.929 0.01 . 3 . . . . 570 PHE HD2 . 18530 1 65 . 1 1 7 7 PHE HE1 H 1 7.201 0.01 . 3 . . . . 570 PHE HE1 . 18530 1 66 . 1 1 7 7 PHE HE2 H 1 7.201 0.01 . 3 . . . . 570 PHE HE2 . 18530 1 67 . 1 1 7 7 PHE HZ H 1 7.196 0.01 . 1 . . . . 570 PHE HZ . 18530 1 68 . 1 1 7 7 PHE C C 13 175.181 0.1 . 1 . . . . 570 PHE C . 18530 1 69 . 1 1 7 7 PHE CA C 13 56.259 0.1 . 1 . . . . 570 PHE CA . 18530 1 70 . 1 1 7 7 PHE CB C 13 42.593 0.1 . 1 . . . . 570 PHE CB . 18530 1 71 . 1 1 7 7 PHE CD1 C 13 131.949 0.1 . 3 . . . . 570 PHE CD1 . 18530 1 72 . 1 1 7 7 PHE CD2 C 13 131.949 0.1 . 3 . . . . 570 PHE CD2 . 18530 1 73 . 1 1 7 7 PHE CE1 C 13 131.187 0.1 . 3 . . . . 570 PHE CE1 . 18530 1 74 . 1 1 7 7 PHE CE2 C 13 131.187 0.1 . 3 . . . . 570 PHE CE2 . 18530 1 75 . 1 1 7 7 PHE CZ C 13 129.719 0.1 . 1 . . . . 570 PHE CZ . 18530 1 76 . 1 1 7 7 PHE N N 15 117.898 0.1 . 1 . . . . 570 PHE N . 18530 1 77 . 1 1 8 8 CYS H H 1 9.169 0.01 . 1 . . . . 571 CYS H . 18530 1 78 . 1 1 8 8 CYS HA H 1 4.576 0.01 . 1 . . . . 571 CYS HA . 18530 1 79 . 1 1 8 8 CYS HB2 H 1 2.904 0.01 . 2 . . . . 571 CYS HB2 . 18530 1 80 . 1 1 8 8 CYS HB3 H 1 2.389 0.01 . 2 . . . . 571 CYS HB3 . 18530 1 81 . 1 1 8 8 CYS C C 13 178.405 0.1 . 1 . . . . 571 CYS C . 18530 1 82 . 1 1 8 8 CYS CA C 13 58.596 0.1 . 1 . . . . 571 CYS CA . 18530 1 83 . 1 1 8 8 CYS CB C 13 42.778 0.1 . 1 . . . . 571 CYS CB . 18530 1 84 . 1 1 8 8 CYS N N 15 118.552 0.1 . 1 . . . . 571 CYS N . 18530 1 85 . 1 1 9 9 PRO HA H 1 5.070 0.01 . 1 . . . . 572 PRO HA . 18530 1 86 . 1 1 9 9 PRO HB2 H 1 2.421 0.01 . 2 . . . . 572 PRO HB2 . 18530 1 87 . 1 1 9 9 PRO HB3 H 1 2.373 0.01 . 2 . . . . 572 PRO HB3 . 18530 1 88 . 1 1 9 9 PRO HG2 H 1 1.998 0.01 . 2 . . . . 572 PRO HG2 . 18530 1 89 . 1 1 9 9 PRO HG3 H 1 2.256 0.01 . 2 . . . . 572 PRO HG3 . 18530 1 90 . 1 1 9 9 PRO HD2 H 1 3.414 0.01 . 2 . . . . 572 PRO HD2 . 18530 1 91 . 1 1 9 9 PRO HD3 H 1 3.839 0.01 . 2 . . . . 572 PRO HD3 . 18530 1 92 . 1 1 9 9 PRO C C 13 176.009 0.1 . 1 . . . . 572 PRO C . 18530 1 93 . 1 1 9 9 PRO CA C 13 62.227 0.1 . 1 . . . . 572 PRO CA . 18530 1 94 . 1 1 9 9 PRO CB C 13 32.421 0.1 . 1 . . . . 572 PRO CB . 18530 1 95 . 1 1 9 9 PRO CG C 13 27.264 0.1 . 1 . . . . 572 PRO CG . 18530 1 96 . 1 1 9 9 PRO CD C 13 49.855 0.1 . 1 . . . . 572 PRO CD . 18530 1 97 . 1 1 10 10 SER H H 1 8.390 0.01 . 1 . . . . 573 SER H . 18530 1 98 . 1 1 10 10 SER HA H 1 4.354 0.01 . 1 . . . . 573 SER HA . 18530 1 99 . 1 1 10 10 SER HB2 H 1 3.776 0.01 . 2 . . . . 573 SER HB2 . 18530 1 100 . 1 1 10 10 SER HB3 H 1 3.912 0.01 . 2 . . . . 573 SER HB3 . 18530 1 101 . 1 1 10 10 SER CA C 13 58.719 0.1 . 1 . . . . 573 SER CA . 18530 1 102 . 1 1 10 10 SER CB C 13 62.131 0.1 . 1 . . . . 573 SER CB . 18530 1 103 . 1 1 10 10 SER N N 15 114.719 0.1 . 1 . . . . 573 SER N . 18530 1 104 . 1 1 11 11 PRO HA H 1 3.058 0.01 . 1 . . . . 574 PRO HA . 18530 1 105 . 1 1 11 11 PRO HB2 H 1 1.350 0.01 . 2 . . . . 574 PRO HB2 . 18530 1 106 . 1 1 11 11 PRO HB3 H 1 0.055 0.01 . 2 . . . . 574 PRO HB3 . 18530 1 107 . 1 1 11 11 PRO HG2 H 1 0.658 0.01 . 2 . . . . 574 PRO HG2 . 18530 1 108 . 1 1 11 11 PRO HG3 H 1 1.223 0.01 . 2 . . . . 574 PRO HG3 . 18530 1 109 . 1 1 11 11 PRO HD2 H 1 3.328 0.01 . 2 . . . . 574 PRO HD2 . 18530 1 110 . 1 1 11 11 PRO HD3 H 1 2.828 0.01 . 2 . . . . 574 PRO HD3 . 18530 1 111 . 1 1 11 11 PRO CA C 13 61.098 0.1 . 1 . . . . 574 PRO CA . 18530 1 112 . 1 1 11 11 PRO CB C 13 28.680 0.1 . 1 . . . . 574 PRO CB . 18530 1 113 . 1 1 11 11 PRO CG C 13 26.805 0.1 . 1 . . . . 574 PRO CG . 18530 1 114 . 1 1 11 11 PRO CD C 13 50.150 0.1 . 1 . . . . 574 PRO CD . 18530 1 115 . 1 1 12 12 PRO HA H 1 4.224 0.01 . 1 . . . . 575 PRO HA . 18530 1 116 . 1 1 12 12 PRO HB2 H 1 1.792 0.01 . 2 . . . . 575 PRO HB2 . 18530 1 117 . 1 1 12 12 PRO HB3 H 1 2.221 0.01 . 2 . . . . 575 PRO HB3 . 18530 1 118 . 1 1 12 12 PRO HG2 H 1 1.800 0.01 . 2 . . . . 575 PRO HG2 . 18530 1 119 . 1 1 12 12 PRO HG3 H 1 1.919 0.01 . 2 . . . . 575 PRO HG3 . 18530 1 120 . 1 1 12 12 PRO HD2 H 1 3.161 0.01 . 2 . . . . 575 PRO HD2 . 18530 1 121 . 1 1 12 12 PRO HD3 H 1 2.840 0.01 . 2 . . . . 575 PRO HD3 . 18530 1 122 . 1 1 12 12 PRO C C 13 174.335 0.1 . 1 . . . . 575 PRO C . 18530 1 123 . 1 1 12 12 PRO CA C 13 62.315 0.1 . 1 . . . . 575 PRO CA . 18530 1 124 . 1 1 12 12 PRO CB C 13 32.197 0.1 . 1 . . . . 575 PRO CB . 18530 1 125 . 1 1 12 12 PRO CG C 13 27.253 0.1 . 1 . . . . 575 PRO CG . 18530 1 126 . 1 1 12 12 PRO CD C 13 49.836 0.1 . 1 . . . . 575 PRO CD . 18530 1 127 . 1 1 13 13 ALA H H 1 8.349 0.01 . 1 . . . . 576 ALA H . 18530 1 128 . 1 1 13 13 ALA HA H 1 4.137 0.01 . 1 . . . . 576 ALA HA . 18530 1 129 . 1 1 13 13 ALA HB1 H 1 1.316 0.01 . 1 . . . . 576 ALA HB1 . 18530 1 130 . 1 1 13 13 ALA HB2 H 1 1.316 0.01 . 1 . . . . 576 ALA HB2 . 18530 1 131 . 1 1 13 13 ALA HB3 H 1 1.316 0.01 . 1 . . . . 576 ALA HB3 . 18530 1 132 . 1 1 13 13 ALA C C 13 174.749 0.1 . 1 . . . . 576 ALA C . 18530 1 133 . 1 1 13 13 ALA CA C 13 52.318 0.1 . 1 . . . . 576 ALA CA . 18530 1 134 . 1 1 13 13 ALA CB C 13 19.269 0.1 . 1 . . . . 576 ALA CB . 18530 1 135 . 1 1 13 13 ALA N N 15 123.692 0.1 . 1 . . . . 576 ALA N . 18530 1 136 . 1 1 14 14 LEU H H 1 8.857 0.01 . 1 . . . . 577 LEU H . 18530 1 137 . 1 1 14 14 LEU HA H 1 4.364 0.01 . 1 . . . . 577 LEU HA . 18530 1 138 . 1 1 14 14 LEU HB2 H 1 1.055 0.01 . 2 . . . . 577 LEU HB2 . 18530 1 139 . 1 1 14 14 LEU HB3 H 1 1.413 0.01 . 2 . . . . 577 LEU HB3 . 18530 1 140 . 1 1 14 14 LEU HG H 1 1.165 0.01 . 1 . . . . 577 LEU HG . 18530 1 141 . 1 1 14 14 LEU HD11 H 1 0.561 0.01 . 2 . . . . 577 LEU HD11 . 18530 1 142 . 1 1 14 14 LEU HD12 H 1 0.561 0.01 . 2 . . . . 577 LEU HD12 . 18530 1 143 . 1 1 14 14 LEU HD13 H 1 0.561 0.01 . 2 . . . . 577 LEU HD13 . 18530 1 144 . 1 1 14 14 LEU HD21 H 1 0.561 0.01 . 2 . . . . 577 LEU HD21 . 18530 1 145 . 1 1 14 14 LEU HD22 H 1 0.561 0.01 . 2 . . . . 577 LEU HD22 . 18530 1 146 . 1 1 14 14 LEU HD23 H 1 0.561 0.01 . 2 . . . . 577 LEU HD23 . 18530 1 147 . 1 1 14 14 LEU C C 13 175.704 0.1 . 1 . . . . 577 LEU C . 18530 1 148 . 1 1 14 14 LEU CA C 13 52.955 0.1 . 1 . . . . 577 LEU CA . 18530 1 149 . 1 1 14 14 LEU CB C 13 45.728 0.1 . 1 . . . . 577 LEU CB . 18530 1 150 . 1 1 14 14 LEU CG C 13 26.799 0.1 . 1 . . . . 577 LEU CG . 18530 1 151 . 1 1 14 14 LEU CD1 C 13 23.018 0.1 . 2 . . . . 577 LEU CD1 . 18530 1 152 . 1 1 14 14 LEU CD2 C 13 27.819 0.1 . 2 . . . . 577 LEU CD2 . 18530 1 153 . 1 1 14 14 LEU N N 15 124.859 0.1 . 1 . . . . 577 LEU N . 18530 1 154 . 1 1 15 15 LYS H H 1 8.624 0.01 . 1 . . . . 578 LYS H . 18530 1 155 . 1 1 15 15 LYS HA H 1 3.899 0.01 . 1 . . . . 578 LYS HA . 18530 1 156 . 1 1 15 15 LYS HB2 H 1 1.638 0.01 . 2 . . . . 578 LYS HB2 . 18530 1 157 . 1 1 15 15 LYS HB3 H 1 1.676 0.01 . 2 . . . . 578 LYS HB3 . 18530 1 158 . 1 1 15 15 LYS HG2 H 1 1.353 0.01 . 2 . . . . 578 LYS HG2 . 18530 1 159 . 1 1 15 15 LYS HG3 H 1 1.392 0.01 . 2 . . . . 578 LYS HG3 . 18530 1 160 . 1 1 15 15 LYS HD2 H 1 1.628 0.01 . 2 . . . . 578 LYS HD2 . 18530 1 161 . 1 1 15 15 LYS HD3 H 1 1.690 0.01 . 2 . . . . 578 LYS HD3 . 18530 1 162 . 1 1 15 15 LYS HE2 H 1 3.008 0.01 . 1 . . . . 578 LYS HE2 . 18530 1 163 . 1 1 15 15 LYS HE3 H 1 3.008 0.01 . 1 . . . . 578 LYS HE3 . 18530 1 164 . 1 1 15 15 LYS C C 13 174.289 0.1 . 1 . . . . 578 LYS C . 18530 1 165 . 1 1 15 15 LYS CA C 13 58.325 0.1 . 1 . . . . 578 LYS CA . 18530 1 166 . 1 1 15 15 LYS CB C 13 31.522 0.1 . 1 . . . . 578 LYS CB . 18530 1 167 . 1 1 15 15 LYS CG C 13 24.415 0.1 . 1 . . . . 578 LYS CG . 18530 1 168 . 1 1 15 15 LYS CD C 13 29.111 0.1 . 1 . . . . 578 LYS CD . 18530 1 169 . 1 1 15 15 LYS CE C 13 42.031 0.1 . 1 . . . . 578 LYS CE . 18530 1 170 . 1 1 15 15 LYS N N 15 130.444 0.1 . 1 . . . . 578 LYS N . 18530 1 171 . 1 1 16 16 ASP H H 1 8.901 0.01 . 1 . . . . 579 ASP H . 18530 1 172 . 1 1 16 16 ASP HA H 1 3.849 0.01 . 1 . . . . 579 ASP HA . 18530 1 173 . 1 1 16 16 ASP HB2 H 1 1.507 0.01 . 2 . . . . 579 ASP HB2 . 18530 1 174 . 1 1 16 16 ASP HB3 H 1 2.229 0.01 . 2 . . . . 579 ASP HB3 . 18530 1 175 . 1 1 16 16 ASP C C 13 178.090 0.1 . 1 . . . . 579 ASP C . 18530 1 176 . 1 1 16 16 ASP CA C 13 57.338 0.1 . 1 . . . . 579 ASP CA . 18530 1 177 . 1 1 16 16 ASP CB C 13 38.914 0.1 . 1 . . . . 579 ASP CB . 18530 1 178 . 1 1 16 16 ASP N N 15 119.748 0.1 . 1 . . . . 579 ASP N . 18530 1 179 . 1 1 17 17 GLY H H 1 8.026 0.01 . 1 . . . . 580 GLY H . 18530 1 180 . 1 1 17 17 GLY HA2 H 1 4.046 0.01 . 2 . . . . 580 GLY HA2 . 18530 1 181 . 1 1 17 17 GLY HA3 H 1 4.446 0.01 . 2 . . . . 580 GLY HA3 . 18530 1 182 . 1 1 17 17 GLY C C 13 178.606 0.1 . 1 . . . . 580 GLY C . 18530 1 183 . 1 1 17 17 GLY CA C 13 46.583 0.1 . 1 . . . . 580 GLY CA . 18530 1 184 . 1 1 17 17 GLY N N 15 104.305 0.1 . 1 . . . . 580 GLY N . 18530 1 185 . 1 1 18 18 PHE H H 1 8.554 0.01 . 1 . . . . 581 PHE H . 18530 1 186 . 1 1 18 18 PHE HA H 1 4.935 0.01 . 1 . . . . 581 PHE HA . 18530 1 187 . 1 1 18 18 PHE HB2 H 1 2.909 0.01 . 2 . . . . 581 PHE HB2 . 18530 1 188 . 1 1 18 18 PHE HB3 H 1 3.418 0.01 . 2 . . . . 581 PHE HB3 . 18530 1 189 . 1 1 18 18 PHE HD1 H 1 6.886 0.01 . 3 . . . . 581 PHE HD1 . 18530 1 190 . 1 1 18 18 PHE HD2 H 1 6.886 0.01 . 3 . . . . 581 PHE HD2 . 18530 1 191 . 1 1 18 18 PHE HE1 H 1 7.117 0.01 . 3 . . . . 581 PHE HE1 . 18530 1 192 . 1 1 18 18 PHE HE2 H 1 7.117 0.01 . 3 . . . . 581 PHE HE2 . 18530 1 193 . 1 1 18 18 PHE HZ H 1 7.129 0.01 . 1 . . . . 581 PHE HZ . 18530 1 194 . 1 1 18 18 PHE C C 13 179.109 0.1 . 1 . . . . 581 PHE C . 18530 1 195 . 1 1 18 18 PHE CA C 13 56.557 0.1 . 1 . . . . 581 PHE CA . 18530 1 196 . 1 1 18 18 PHE CB C 13 39.079 0.1 . 1 . . . . 581 PHE CB . 18530 1 197 . 1 1 18 18 PHE CD1 C 13 132.821 0.1 . 3 . . . . 581 PHE CD1 . 18530 1 198 . 1 1 18 18 PHE CD2 C 13 132.821 0.1 . 3 . . . . 581 PHE CD2 . 18530 1 199 . 1 1 18 18 PHE CE1 C 13 130.836 0.1 . 3 . . . . 581 PHE CE1 . 18530 1 200 . 1 1 18 18 PHE CE2 C 13 130.836 0.1 . 3 . . . . 581 PHE CE2 . 18530 1 201 . 1 1 18 18 PHE CZ C 13 130.130 0.1 . 1 . . . . 581 PHE CZ . 18530 1 202 . 1 1 18 18 PHE N N 15 114.879 0.1 . 1 . . . . 581 PHE N . 18530 1 203 . 1 1 19 19 VAL H H 1 8.197 0.01 . 1 . . . . 582 VAL H . 18530 1 204 . 1 1 19 19 VAL HA H 1 3.584 0.01 . 1 . . . . 582 VAL HA . 18530 1 205 . 1 1 19 19 VAL HB H 1 1.419 0.01 . 1 . . . . 582 VAL HB . 18530 1 206 . 1 1 19 19 VAL HG11 H 1 0.006 0.01 . 2 . . . . 582 VAL HG11 . 18530 1 207 . 1 1 19 19 VAL HG12 H 1 0.006 0.01 . 2 . . . . 582 VAL HG12 . 18530 1 208 . 1 1 19 19 VAL HG13 H 1 0.006 0.01 . 2 . . . . 582 VAL HG13 . 18530 1 209 . 1 1 19 19 VAL HG21 H 1 0.508 0.01 . 2 . . . . 582 VAL HG21 . 18530 1 210 . 1 1 19 19 VAL HG22 H 1 0.508 0.01 . 2 . . . . 582 VAL HG22 . 18530 1 211 . 1 1 19 19 VAL HG23 H 1 0.508 0.01 . 2 . . . . 582 VAL HG23 . 18530 1 212 . 1 1 19 19 VAL C C 13 175.579 0.1 . 1 . . . . 582 VAL C . 18530 1 213 . 1 1 19 19 VAL CA C 13 60.937 0.1 . 1 . . . . 582 VAL CA . 18530 1 214 . 1 1 19 19 VAL CB C 13 32.419 0.1 . 1 . . . . 582 VAL CB . 18530 1 215 . 1 1 19 19 VAL CG1 C 13 21.911 0.1 . 2 . . . . 582 VAL CG1 . 18530 1 216 . 1 1 19 19 VAL CG2 C 13 20.650 0.1 . 2 . . . . 582 VAL CG2 . 18530 1 217 . 1 1 19 19 VAL N N 15 119.028 0.1 . 1 . . . . 582 VAL N . 18530 1 218 . 1 1 20 20 GLN H H 1 8.693 0.01 . 1 . . . . 583 GLN H . 18530 1 219 . 1 1 20 20 GLN HA H 1 4.246 0.01 . 1 . . . . 583 GLN HA . 18530 1 220 . 1 1 20 20 GLN HB2 H 1 1.934 0.01 . 2 . . . . 583 GLN HB2 . 18530 1 221 . 1 1 20 20 GLN HB3 H 1 2.049 0.01 . 2 . . . . 583 GLN HB3 . 18530 1 222 . 1 1 20 20 GLN HG2 H 1 2.149 0.01 . 1 . . . . 583 GLN HG2 . 18530 1 223 . 1 1 20 20 GLN HG3 H 1 2.149 0.01 . 1 . . . . 583 GLN HG3 . 18530 1 224 . 1 1 20 20 GLN HE21 H 1 6.854 0.01 . 1 . . . . 583 GLN HE21 . 18530 1 225 . 1 1 20 20 GLN HE22 H 1 7.031 0.01 . 1 . . . . 583 GLN HE22 . 18530 1 226 . 1 1 20 20 GLN C C 13 175.287 0.1 . 1 . . . . 583 GLN C . 18530 1 227 . 1 1 20 20 GLN CA C 13 57.049 0.1 . 1 . . . . 583 GLN CA . 18530 1 228 . 1 1 20 20 GLN CB C 13 29.274 0.1 . 1 . . . . 583 GLN CB . 18530 1 229 . 1 1 20 20 GLN CG C 13 35.045 0.1 . 1 . . . . 583 GLN CG . 18530 1 230 . 1 1 20 20 GLN CD C 13 178.020 0.1 . 1 . . . . 583 GLN CD . 18530 1 231 . 1 1 20 20 GLN N N 15 127.071 0.1 . 1 . . . . 583 GLN N . 18530 1 232 . 1 1 20 20 GLN NE2 N 15 110.662 0.1 . 1 . . . . 583 GLN NE2 . 18530 1 233 . 1 1 21 21 ASP H H 1 8.006 0.01 . 1 . . . . 584 ASP H . 18530 1 234 . 1 1 21 21 ASP HA H 1 4.470 0.01 . 1 . . . . 584 ASP HA . 18530 1 235 . 1 1 21 21 ASP HB2 H 1 2.426 0.01 . 2 . . . . 584 ASP HB2 . 18530 1 236 . 1 1 21 21 ASP HB3 H 1 2.656 0.01 . 2 . . . . 584 ASP HB3 . 18530 1 237 . 1 1 21 21 ASP C C 13 176.028 0.1 . 1 . . . . 584 ASP C . 18530 1 238 . 1 1 21 21 ASP CA C 13 54.652 0.1 . 1 . . . . 584 ASP CA . 18530 1 239 . 1 1 21 21 ASP CB C 13 42.385 0.1 . 1 . . . . 584 ASP CB . 18530 1 240 . 1 1 21 21 ASP N N 15 120.794 0.1 . 1 . . . . 584 ASP N . 18530 1 241 . 1 1 22 22 GLU H H 1 8.516 0.01 . 1 . . . . 585 GLU H . 18530 1 242 . 1 1 22 22 GLU HA H 1 4.271 0.01 . 1 . . . . 585 GLU HA . 18530 1 243 . 1 1 22 22 GLU HB2 H 1 2.103 0.01 . 2 . . . . 585 GLU HB2 . 18530 1 244 . 1 1 22 22 GLU HB3 H 1 1.952 0.01 . 2 . . . . 585 GLU HB3 . 18530 1 245 . 1 1 22 22 GLU HG2 H 1 2.267 0.01 . 2 . . . . 585 GLU HG2 . 18530 1 246 . 1 1 22 22 GLU HG3 H 1 2.338 0.01 . 2 . . . . 585 GLU HG3 . 18530 1 247 . 1 1 22 22 GLU C C 13 174.347 0.1 . 1 . . . . 585 GLU C . 18530 1 248 . 1 1 22 22 GLU CA C 13 56.896 0.1 . 1 . . . . 585 GLU CA . 18530 1 249 . 1 1 22 22 GLU CB C 13 30.618 0.1 . 1 . . . . 585 GLU CB . 18530 1 250 . 1 1 22 22 GLU CG C 13 36.205 0.1 . 1 . . . . 585 GLU CG . 18530 1 251 . 1 1 22 22 GLU N N 15 122.358 0.1 . 1 . . . . 585 GLU N . 18530 1 252 . 1 1 23 23 GLY H H 1 8.669 0.01 . 1 . . . . 586 GLY H . 18530 1 253 . 1 1 23 23 GLY HA2 H 1 3.928 0.01 . 2 . . . . 586 GLY HA2 . 18530 1 254 . 1 1 23 23 GLY HA3 H 1 4.010 0.01 . 2 . . . . 586 GLY HA3 . 18530 1 255 . 1 1 23 23 GLY C C 13 177.760 0.1 . 1 . . . . 586 GLY C . 18530 1 256 . 1 1 23 23 GLY CA C 13 44.872 0.1 . 1 . . . . 586 GLY CA . 18530 1 257 . 1 1 23 23 GLY N N 15 109.838 0.1 . 1 . . . . 586 GLY N . 18530 1 258 . 1 1 24 24 THR H H 1 8.083 0.01 . 1 . . . . 587 THR H . 18530 1 259 . 1 1 24 24 THR HA H 1 4.439 0.01 . 1 . . . . 587 THR HA . 18530 1 260 . 1 1 24 24 THR HB H 1 4.269 0.01 . 1 . . . . 587 THR HB . 18530 1 261 . 1 1 24 24 THR HG21 H 1 1.107 0.01 . 1 . . . . 587 THR HG21 . 18530 1 262 . 1 1 24 24 THR HG22 H 1 1.107 0.01 . 1 . . . . 587 THR HG22 . 18530 1 263 . 1 1 24 24 THR HG23 H 1 1.107 0.01 . 1 . . . . 587 THR HG23 . 18530 1 264 . 1 1 24 24 THR C C 13 177.526 0.1 . 1 . . . . 587 THR C . 18530 1 265 . 1 1 24 24 THR CA C 13 61.249 0.1 . 1 . . . . 587 THR CA . 18530 1 266 . 1 1 24 24 THR CB C 13 69.980 0.1 . 1 . . . . 587 THR CB . 18530 1 267 . 1 1 24 24 THR CG2 C 13 21.587 0.1 . 1 . . . . 587 THR CG2 . 18530 1 268 . 1 1 24 24 THR N N 15 107.664 0.1 . 1 . . . . 587 THR N . 18530 1 269 . 1 1 25 25 MET H H 1 7.153 0.01 . 1 . . . . 588 MET H . 18530 1 270 . 1 1 25 25 MET HA H 1 4.599 0.01 . 1 . . . . 588 MET HA . 18530 1 271 . 1 1 25 25 MET HB2 H 1 1.518 0.01 . 2 . . . . 588 MET HB2 . 18530 1 272 . 1 1 25 25 MET HB3 H 1 1.578 0.01 . 2 . . . . 588 MET HB3 . 18530 1 273 . 1 1 25 25 MET HG2 H 1 2.095 0.01 . 2 . . . . 588 MET HG2 . 18530 1 274 . 1 1 25 25 MET HG3 H 1 2.156 0.01 . 2 . . . . 588 MET HG3 . 18530 1 275 . 1 1 25 25 MET HE1 H 1 1.664 0.01 . 1 . . . . 588 MET HE1 . 18530 1 276 . 1 1 25 25 MET HE2 H 1 1.664 0.01 . 1 . . . . 588 MET HE2 . 18530 1 277 . 1 1 25 25 MET HE3 H 1 1.664 0.01 . 1 . . . . 588 MET HE3 . 18530 1 278 . 1 1 25 25 MET C C 13 176.412 0.1 . 1 . . . . 588 MET C . 18530 1 279 . 1 1 25 25 MET CA C 13 54.303 0.1 . 1 . . . . 588 MET CA . 18530 1 280 . 1 1 25 25 MET CB C 13 34.922 0.1 . 1 . . . . 588 MET CB . 18530 1 281 . 1 1 25 25 MET CG C 13 31.463 0.1 . 1 . . . . 588 MET CG . 18530 1 282 . 1 1 25 25 MET CE C 13 16.515 0.1 . 1 . . . . 588 MET CE . 18530 1 283 . 1 1 25 25 MET N N 15 119.705 0.1 . 1 . . . . 588 MET N . 18530 1 284 . 1 1 26 26 PHE H H 1 8.826 0.01 . 1 . . . . 589 PHE H . 18530 1 285 . 1 1 26 26 PHE HA H 1 5.086 0.01 . 1 . . . . 589 PHE HA . 18530 1 286 . 1 1 26 26 PHE HB2 H 1 3.024 0.01 . 2 . . . . 589 PHE HB2 . 18530 1 287 . 1 1 26 26 PHE HB3 H 1 3.134 0.01 . 2 . . . . 589 PHE HB3 . 18530 1 288 . 1 1 26 26 PHE HD1 H 1 7.268 0.01 . 3 . . . . 589 PHE HD1 . 18530 1 289 . 1 1 26 26 PHE HD2 H 1 7.268 0.01 . 3 . . . . 589 PHE HD2 . 18530 1 290 . 1 1 26 26 PHE HE1 H 1 7.166 0.01 . 3 . . . . 589 PHE HE1 . 18530 1 291 . 1 1 26 26 PHE HE2 H 1 7.166 0.01 . 3 . . . . 589 PHE HE2 . 18530 1 292 . 1 1 26 26 PHE C C 13 173.253 0.1 . 1 . . . . 589 PHE C . 18530 1 293 . 1 1 26 26 PHE CA C 13 54.945 0.1 . 1 . . . . 589 PHE CA . 18530 1 294 . 1 1 26 26 PHE CB C 13 41.233 0.1 . 1 . . . . 589 PHE CB . 18530 1 295 . 1 1 26 26 PHE CD1 C 13 132.157 0.1 . 3 . . . . 589 PHE CD1 . 18530 1 296 . 1 1 26 26 PHE CD2 C 13 132.157 0.1 . 3 . . . . 589 PHE CD2 . 18530 1 297 . 1 1 26 26 PHE CE1 C 13 131.205 0.1 . 3 . . . . 589 PHE CE1 . 18530 1 298 . 1 1 26 26 PHE CE2 C 13 131.205 0.1 . 3 . . . . 589 PHE CE2 . 18530 1 299 . 1 1 26 26 PHE N N 15 121.715 0.1 . 1 . . . . 589 PHE N . 18530 1 300 . 1 1 27 27 PRO HA H 1 4.650 0.01 . 1 . . . . 590 PRO HA . 18530 1 301 . 1 1 27 27 PRO HB2 H 1 1.921 0.01 . 2 . . . . 590 PRO HB2 . 18530 1 302 . 1 1 27 27 PRO HB3 H 1 2.155 0.01 . 2 . . . . 590 PRO HB3 . 18530 1 303 . 1 1 27 27 PRO HG2 H 1 2.071 0.01 . 2 . . . . 590 PRO HG2 . 18530 1 304 . 1 1 27 27 PRO HG3 H 1 1.988 0.01 . 2 . . . . 590 PRO HG3 . 18530 1 305 . 1 1 27 27 PRO HD2 H 1 3.720 0.01 . 1 . . . . 590 PRO HD2 . 18530 1 306 . 1 1 27 27 PRO HD3 H 1 3.720 0.01 . 1 . . . . 590 PRO HD3 . 18530 1 307 . 1 1 27 27 PRO C C 13 175.326 0.1 . 1 . . . . 590 PRO C . 18530 1 308 . 1 1 27 27 PRO CA C 13 62.096 0.1 . 1 . . . . 590 PRO CA . 18530 1 309 . 1 1 27 27 PRO CB C 13 32.819 0.1 . 1 . . . . 590 PRO CB . 18530 1 310 . 1 1 27 27 PRO CG C 13 27.230 0.1 . 1 . . . . 590 PRO CG . 18530 1 311 . 1 1 27 27 PRO CD C 13 50.783 0.1 . 1 . . . . 590 PRO CD . 18530 1 312 . 1 1 28 28 VAL H H 1 7.698 0.01 . 1 . . . . 591 VAL H . 18530 1 313 . 1 1 28 28 VAL HA H 1 3.277 0.01 . 1 . . . . 591 VAL HA . 18530 1 314 . 1 1 28 28 VAL HB H 1 1.670 0.01 . 1 . . . . 591 VAL HB . 18530 1 315 . 1 1 28 28 VAL HG11 H 1 0.707 0.01 . 2 . . . . 591 VAL HG11 . 18530 1 316 . 1 1 28 28 VAL HG12 H 1 0.707 0.01 . 2 . . . . 591 VAL HG12 . 18530 1 317 . 1 1 28 28 VAL HG13 H 1 0.707 0.01 . 2 . . . . 591 VAL HG13 . 18530 1 318 . 1 1 28 28 VAL HG21 H 1 0.847 0.01 . 2 . . . . 591 VAL HG21 . 18530 1 319 . 1 1 28 28 VAL HG22 H 1 0.847 0.01 . 2 . . . . 591 VAL HG22 . 18530 1 320 . 1 1 28 28 VAL HG23 H 1 0.847 0.01 . 2 . . . . 591 VAL HG23 . 18530 1 321 . 1 1 28 28 VAL C C 13 173.356 0.1 . 1 . . . . 591 VAL C . 18530 1 322 . 1 1 28 28 VAL CA C 13 65.273 0.1 . 1 . . . . 591 VAL CA . 18530 1 323 . 1 1 28 28 VAL CB C 13 31.736 0.1 . 1 . . . . 591 VAL CB . 18530 1 324 . 1 1 28 28 VAL CG1 C 13 21.218 0.1 . 2 . . . . 591 VAL CG1 . 18530 1 325 . 1 1 28 28 VAL CG2 C 13 22.378 0.1 . 2 . . . . 591 VAL CG2 . 18530 1 326 . 1 1 28 28 VAL N N 15 119.146 0.1 . 1 . . . . 591 VAL N . 18530 1 327 . 1 1 29 29 GLY H H 1 8.918 0.01 . 1 . . . . 592 GLY H . 18530 1 328 . 1 1 29 29 GLY HA2 H 1 3.440 0.01 . 2 . . . . 592 GLY HA2 . 18530 1 329 . 1 1 29 29 GLY HA3 H 1 4.326 0.01 . 2 . . . . 592 GLY HA3 . 18530 1 330 . 1 1 29 29 GLY C C 13 177.086 0.1 . 1 . . . . 592 GLY C . 18530 1 331 . 1 1 29 29 GLY CA C 13 44.341 0.1 . 1 . . . . 592 GLY CA . 18530 1 332 . 1 1 29 29 GLY N N 15 116.301 0.1 . 1 . . . . 592 GLY N . 18530 1 333 . 1 1 30 30 LYS H H 1 8.030 0.01 . 1 . . . . 593 LYS H . 18530 1 334 . 1 1 30 30 LYS HA H 1 4.301 0.01 . 1 . . . . 593 LYS HA . 18530 1 335 . 1 1 30 30 LYS HB2 H 1 1.970 0.01 . 2 . . . . 593 LYS HB2 . 18530 1 336 . 1 1 30 30 LYS HB3 H 1 2.076 0.01 . 2 . . . . 593 LYS HB3 . 18530 1 337 . 1 1 30 30 LYS HG2 H 1 1.582 0.01 . 2 . . . . 593 LYS HG2 . 18530 1 338 . 1 1 30 30 LYS HG3 H 1 1.760 0.01 . 2 . . . . 593 LYS HG3 . 18530 1 339 . 1 1 30 30 LYS HD2 H 1 1.854 0.01 . 2 . . . . 593 LYS HD2 . 18530 1 340 . 1 1 30 30 LYS HD3 H 1 2.082 0.01 . 2 . . . . 593 LYS HD3 . 18530 1 341 . 1 1 30 30 LYS HE2 H 1 3.136 0.01 . 1 . . . . 593 LYS HE2 . 18530 1 342 . 1 1 30 30 LYS HE3 H 1 3.136 0.01 . 1 . . . . 593 LYS HE3 . 18530 1 343 . 1 1 30 30 LYS C C 13 175.938 0.1 . 1 . . . . 593 LYS C . 18530 1 344 . 1 1 30 30 LYS CA C 13 56.151 0.1 . 1 . . . . 593 LYS CA . 18530 1 345 . 1 1 30 30 LYS CB C 13 33.590 0.1 . 1 . . . . 593 LYS CB . 18530 1 346 . 1 1 30 30 LYS CG C 13 25.468 0.1 . 1 . . . . 593 LYS CG . 18530 1 347 . 1 1 30 30 LYS CD C 13 29.163 0.1 . 1 . . . . 593 LYS CD . 18530 1 348 . 1 1 30 30 LYS CE C 13 42.338 0.1 . 1 . . . . 593 LYS CE . 18530 1 349 . 1 1 30 30 LYS N N 15 122.085 0.1 . 1 . . . . 593 LYS N . 18530 1 350 . 1 1 31 31 ASN H H 1 8.682 0.01 . 1 . . . . 594 ASN H . 18530 1 351 . 1 1 31 31 ASN HA H 1 6.034 0.01 . 1 . . . . 594 ASN HA . 18530 1 352 . 1 1 31 31 ASN HB2 H 1 2.498 0.01 . 2 . . . . 594 ASN HB2 . 18530 1 353 . 1 1 31 31 ASN HB3 H 1 2.751 0.01 . 2 . . . . 594 ASN HB3 . 18530 1 354 . 1 1 31 31 ASN HD21 H 1 6.734 0.01 . 1 . . . . 594 ASN HD21 . 18530 1 355 . 1 1 31 31 ASN HD22 H 1 7.192 0.01 . 1 . . . . 594 ASN HD22 . 18530 1 356 . 1 1 31 31 ASN C C 13 175.419 0.1 . 1 . . . . 594 ASN C . 18530 1 357 . 1 1 31 31 ASN CA C 13 51.813 0.1 . 1 . . . . 594 ASN CA . 18530 1 358 . 1 1 31 31 ASN CB C 13 40.786 0.1 . 1 . . . . 594 ASN CB . 18530 1 359 . 1 1 31 31 ASN CG C 13 175.106 0.1 . 1 . . . . 594 ASN CG . 18530 1 360 . 1 1 31 31 ASN N N 15 124.131 0.1 . 1 . . . . 594 ASN N . 18530 1 361 . 1 1 31 31 ASN ND2 N 15 110.527 0.1 . 1 . . . . 594 ASN ND2 . 18530 1 362 . 1 1 32 32 VAL H H 1 9.247 0.01 . 1 . . . . 595 VAL H . 18530 1 363 . 1 1 32 32 VAL HA H 1 4.694 0.01 . 1 . . . . 595 VAL HA . 18530 1 364 . 1 1 32 32 VAL HB H 1 1.769 0.01 . 1 . . . . 595 VAL HB . 18530 1 365 . 1 1 32 32 VAL HG11 H 1 0.289 0.01 . 2 . . . . 595 VAL HG11 . 18530 1 366 . 1 1 32 32 VAL HG12 H 1 0.289 0.01 . 2 . . . . 595 VAL HG12 . 18530 1 367 . 1 1 32 32 VAL HG13 H 1 0.289 0.01 . 2 . . . . 595 VAL HG13 . 18530 1 368 . 1 1 32 32 VAL HG21 H 1 0.590 0.01 . 2 . . . . 595 VAL HG21 . 18530 1 369 . 1 1 32 32 VAL HG22 H 1 0.590 0.01 . 2 . . . . 595 VAL HG22 . 18530 1 370 . 1 1 32 32 VAL HG23 H 1 0.590 0.01 . 2 . . . . 595 VAL HG23 . 18530 1 371 . 1 1 32 32 VAL C C 13 177.770 0.1 . 1 . . . . 595 VAL C . 18530 1 372 . 1 1 32 32 VAL CA C 13 59.146 0.1 . 1 . . . . 595 VAL CA . 18530 1 373 . 1 1 32 32 VAL CB C 13 34.443 0.1 . 1 . . . . 595 VAL CB . 18530 1 374 . 1 1 32 32 VAL CG1 C 13 19.108 0.1 . 2 . . . . 595 VAL CG1 . 18530 1 375 . 1 1 32 32 VAL CG2 C 13 22.230 0.1 . 2 . . . . 595 VAL CG2 . 18530 1 376 . 1 1 32 32 VAL N N 15 115.674 0.1 . 1 . . . . 595 VAL N . 18530 1 377 . 1 1 33 33 VAL H H 1 8.337 0.01 . 1 . . . . 596 VAL H . 18530 1 378 . 1 1 33 33 VAL HA H 1 4.771 0.01 . 1 . . . . 596 VAL HA . 18530 1 379 . 1 1 33 33 VAL HB H 1 1.815 0.01 . 1 . . . . 596 VAL HB . 18530 1 380 . 1 1 33 33 VAL HG11 H 1 0.866 0.01 . 2 . . . . 596 VAL HG11 . 18530 1 381 . 1 1 33 33 VAL HG12 H 1 0.866 0.01 . 2 . . . . 596 VAL HG12 . 18530 1 382 . 1 1 33 33 VAL HG13 H 1 0.866 0.01 . 2 . . . . 596 VAL HG13 . 18530 1 383 . 1 1 33 33 VAL HG21 H 1 0.866 0.01 . 2 . . . . 596 VAL HG21 . 18530 1 384 . 1 1 33 33 VAL HG22 H 1 0.866 0.01 . 2 . . . . 596 VAL HG22 . 18530 1 385 . 1 1 33 33 VAL HG23 H 1 0.866 0.01 . 2 . . . . 596 VAL HG23 . 18530 1 386 . 1 1 33 33 VAL C C 13 175.681 0.1 . 1 . . . . 596 VAL C . 18530 1 387 . 1 1 33 33 VAL CA C 13 61.026 0.1 . 1 . . . . 596 VAL CA . 18530 1 388 . 1 1 33 33 VAL CB C 13 34.434 0.1 . 1 . . . . 596 VAL CB . 18530 1 389 . 1 1 33 33 VAL CG1 C 13 21.524 0.1 . 2 . . . . 596 VAL CG1 . 18530 1 390 . 1 1 33 33 VAL CG2 C 13 21.524 0.1 . 2 . . . . 596 VAL CG2 . 18530 1 391 . 1 1 33 33 VAL N N 15 120.335 0.1 . 1 . . . . 596 VAL N . 18530 1 392 . 1 1 34 34 TYR H H 1 9.063 0.01 . 1 . . . . 597 TYR H . 18530 1 393 . 1 1 34 34 TYR HA H 1 4.584 0.01 . 1 . . . . 597 TYR HA . 18530 1 394 . 1 1 34 34 TYR HB2 H 1 2.388 0.01 . 2 . . . . 597 TYR HB2 . 18530 1 395 . 1 1 34 34 TYR HB3 H 1 2.664 0.01 . 2 . . . . 597 TYR HB3 . 18530 1 396 . 1 1 34 34 TYR HD1 H 1 6.740 0.01 . 3 . . . . 597 TYR HD1 . 18530 1 397 . 1 1 34 34 TYR HD2 H 1 6.740 0.01 . 3 . . . . 597 TYR HD2 . 18530 1 398 . 1 1 34 34 TYR HE1 H 1 6.243 0.01 . 3 . . . . 597 TYR HE1 . 18530 1 399 . 1 1 34 34 TYR HE2 H 1 6.243 0.01 . 3 . . . . 597 TYR HE2 . 18530 1 400 . 1 1 34 34 TYR C C 13 176.525 0.1 . 1 . . . . 597 TYR C . 18530 1 401 . 1 1 34 34 TYR CA C 13 58.320 0.1 . 1 . . . . 597 TYR CA . 18530 1 402 . 1 1 34 34 TYR CB C 13 41.219 0.1 . 1 . . . . 597 TYR CB . 18530 1 403 . 1 1 34 34 TYR CD1 C 13 133.200 0.1 . 3 . . . . 597 TYR CD1 . 18530 1 404 . 1 1 34 34 TYR CD2 C 13 133.200 0.1 . 3 . . . . 597 TYR CD2 . 18530 1 405 . 1 1 34 34 TYR CE1 C 13 116.868 0.1 . 3 . . . . 597 TYR CE1 . 18530 1 406 . 1 1 34 34 TYR CE2 C 13 116.868 0.1 . 3 . . . . 597 TYR CE2 . 18530 1 407 . 1 1 34 34 TYR N N 15 126.909 0.1 . 1 . . . . 597 TYR N . 18530 1 408 . 1 1 35 35 THR H H 1 8.338 0.01 . 1 . . . . 598 THR H . 18530 1 409 . 1 1 35 35 THR HA H 1 4.183 0.01 . 1 . . . . 598 THR HA . 18530 1 410 . 1 1 35 35 THR HB H 1 3.469 0.01 . 1 . . . . 598 THR HB . 18530 1 411 . 1 1 35 35 THR HG21 H 1 0.375 0.01 . 1 . . . . 598 THR HG21 . 18530 1 412 . 1 1 35 35 THR HG22 H 1 0.375 0.01 . 1 . . . . 598 THR HG22 . 18530 1 413 . 1 1 35 35 THR HG23 H 1 0.375 0.01 . 1 . . . . 598 THR HG23 . 18530 1 414 . 1 1 35 35 THR C C 13 179.295 0.1 . 1 . . . . 598 THR C . 18530 1 415 . 1 1 35 35 THR CA C 13 59.638 0.1 . 1 . . . . 598 THR CA . 18530 1 416 . 1 1 35 35 THR CB C 13 70.308 0.1 . 1 . . . . 598 THR CB . 18530 1 417 . 1 1 35 35 THR CG2 C 13 19.450 0.1 . 1 . . . . 598 THR CG2 . 18530 1 418 . 1 1 35 35 THR N N 15 112.227 0.1 . 1 . . . . 598 THR N . 18530 1 419 . 1 1 36 36 CYS H H 1 7.837 0.01 . 1 . . . . 599 CYS H . 18530 1 420 . 1 1 36 36 CYS HA H 1 5.181 0.01 . 1 . . . . 599 CYS HA . 18530 1 421 . 1 1 36 36 CYS HB2 H 1 2.456 0.01 . 2 . . . . 599 CYS HB2 . 18530 1 422 . 1 1 36 36 CYS HB3 H 1 2.986 0.01 . 2 . . . . 599 CYS HB3 . 18530 1 423 . 1 1 36 36 CYS C C 13 177.438 0.1 . 1 . . . . 599 CYS C . 18530 1 424 . 1 1 36 36 CYS CA C 13 54.549 0.1 . 1 . . . . 599 CYS CA . 18530 1 425 . 1 1 36 36 CYS CB C 13 44.050 0.1 . 1 . . . . 599 CYS CB . 18530 1 426 . 1 1 36 36 CYS N N 15 116.289 0.1 . 1 . . . . 599 CYS N . 18530 1 427 . 1 1 37 37 ASN H H 1 9.107 0.01 . 1 . . . . 600 ASN H . 18530 1 428 . 1 1 37 37 ASN HA H 1 4.716 0.01 . 1 . . . . 600 ASN HA . 18530 1 429 . 1 1 37 37 ASN HB2 H 1 2.410 0.01 . 2 . . . . 600 ASN HB2 . 18530 1 430 . 1 1 37 37 ASN HB3 H 1 3.013 0.01 . 2 . . . . 600 ASN HB3 . 18530 1 431 . 1 1 37 37 ASN HD21 H 1 6.735 0.01 . 1 . . . . 600 ASN HD21 . 18530 1 432 . 1 1 37 37 ASN HD22 H 1 7.594 0.01 . 1 . . . . 600 ASN HD22 . 18530 1 433 . 1 1 37 37 ASN C C 13 177.034 0.1 . 1 . . . . 600 ASN C . 18530 1 434 . 1 1 37 37 ASN CA C 13 52.947 0.1 . 1 . . . . 600 ASN CA . 18530 1 435 . 1 1 37 37 ASN CB C 13 38.644 0.1 . 1 . . . . 600 ASN CB . 18530 1 436 . 1 1 37 37 ASN N N 15 121.481 0.1 . 1 . . . . 600 ASN N . 18530 1 437 . 1 1 37 37 ASN ND2 N 15 108.625 0.1 . 1 . . . . 600 ASN ND2 . 18530 1 438 . 1 1 38 38 GLU H H 1 8.544 0.01 . 1 . . . . 601 GLU H . 18530 1 439 . 1 1 38 38 GLU HA H 1 4.128 0.01 . 1 . . . . 601 GLU HA . 18530 1 440 . 1 1 38 38 GLU HB2 H 1 2.037 0.01 . 1 . . . . 601 GLU HB2 . 18530 1 441 . 1 1 38 38 GLU HB3 H 1 2.037 0.01 . 1 . . . . 601 GLU HB3 . 18530 1 442 . 1 1 38 38 GLU HG2 H 1 2.417 0.01 . 2 . . . . 601 GLU HG2 . 18530 1 443 . 1 1 38 38 GLU HG3 H 1 2.360 0.01 . 2 . . . . 601 GLU HG3 . 18530 1 444 . 1 1 38 38 GLU C C 13 174.148 0.1 . 1 . . . . 601 GLU C . 18530 1 445 . 1 1 38 38 GLU CA C 13 58.277 0.1 . 1 . . . . 601 GLU CA . 18530 1 446 . 1 1 38 38 GLU CB C 13 29.658 0.1 . 1 . . . . 601 GLU CB . 18530 1 447 . 1 1 38 38 GLU CG C 13 36.515 0.1 . 1 . . . . 601 GLU CG . 18530 1 448 . 1 1 38 38 GLU N N 15 118.663 0.1 . 1 . . . . 601 GLU N . 18530 1 449 . 1 1 39 39 GLY H H 1 8.609 0.01 . 1 . . . . 602 GLY H . 18530 1 450 . 1 1 39 39 GLY HA2 H 1 2.826 0.01 . 2 . . . . 602 GLY HA2 . 18530 1 451 . 1 1 39 39 GLY HA3 H 1 3.898 0.01 . 2 . . . . 602 GLY HA3 . 18530 1 452 . 1 1 39 39 GLY C C 13 178.651 0.1 . 1 . . . . 602 GLY C . 18530 1 453 . 1 1 39 39 GLY CA C 13 44.531 0.1 . 1 . . . . 602 GLY CA . 18530 1 454 . 1 1 39 39 GLY N N 15 110.663 0.1 . 1 . . . . 602 GLY N . 18530 1 455 . 1 1 40 40 TYR H H 1 8.136 0.01 . 1 . . . . 603 TYR H . 18530 1 456 . 1 1 40 40 TYR HA H 1 5.140 0.01 . 1 . . . . 603 TYR HA . 18530 1 457 . 1 1 40 40 TYR HB2 H 1 2.315 0.01 . 2 . . . . 603 TYR HB2 . 18530 1 458 . 1 1 40 40 TYR HB3 H 1 3.389 0.01 . 2 . . . . 603 TYR HB3 . 18530 1 459 . 1 1 40 40 TYR HD1 H 1 6.655 0.01 . 3 . . . . 603 TYR HD1 . 18530 1 460 . 1 1 40 40 TYR HD2 H 1 6.655 0.01 . 3 . . . . 603 TYR HD2 . 18530 1 461 . 1 1 40 40 TYR HE1 H 1 6.718 0.01 . 3 . . . . 603 TYR HE1 . 18530 1 462 . 1 1 40 40 TYR HE2 H 1 6.718 0.01 . 3 . . . . 603 TYR HE2 . 18530 1 463 . 1 1 40 40 TYR C C 13 176.330 0.1 . 1 . . . . 603 TYR C . 18530 1 464 . 1 1 40 40 TYR CA C 13 56.503 0.1 . 1 . . . . 603 TYR CA . 18530 1 465 . 1 1 40 40 TYR CB C 13 42.056 0.1 . 1 . . . . 603 TYR CB . 18530 1 466 . 1 1 40 40 TYR CD1 C 13 132.808 0.1 . 3 . . . . 603 TYR CD1 . 18530 1 467 . 1 1 40 40 TYR CD2 C 13 132.808 0.1 . 3 . . . . 603 TYR CD2 . 18530 1 468 . 1 1 40 40 TYR CE1 C 13 117.990 0.1 . 3 . . . . 603 TYR CE1 . 18530 1 469 . 1 1 40 40 TYR CE2 C 13 117.990 0.1 . 3 . . . . 603 TYR CE2 . 18530 1 470 . 1 1 40 40 TYR N N 15 118.279 0.1 . 1 . . . . 603 TYR N . 18530 1 471 . 1 1 41 41 SER H H 1 9.163 0.01 . 1 . . . . 604 SER H . 18530 1 472 . 1 1 41 41 SER HA H 1 4.621 0.01 . 1 . . . . 604 SER HA . 18530 1 473 . 1 1 41 41 SER HB2 H 1 3.514 0.01 . 2 . . . . 604 SER HB2 . 18530 1 474 . 1 1 41 41 SER HB3 H 1 3.558 0.01 . 2 . . . . 604 SER HB3 . 18530 1 475 . 1 1 41 41 SER C C 13 178.371 0.1 . 1 . . . . 604 SER C . 18530 1 476 . 1 1 41 41 SER CA C 13 56.517 0.1 . 1 . . . . 604 SER CA . 18530 1 477 . 1 1 41 41 SER CB C 13 65.815 0.1 . 1 . . . . 604 SER CB . 18530 1 478 . 1 1 41 41 SER N N 15 115.685 0.1 . 1 . . . . 604 SER N . 18530 1 479 . 1 1 42 42 LEU H H 1 8.520 0.01 . 1 . . . . 605 LEU H . 18530 1 480 . 1 1 42 42 LEU HA H 1 4.437 0.01 . 1 . . . . 605 LEU HA . 18530 1 481 . 1 1 42 42 LEU HB2 H 1 1.525 0.01 . 2 . . . . 605 LEU HB2 . 18530 1 482 . 1 1 42 42 LEU HB3 H 1 1.726 0.01 . 2 . . . . 605 LEU HB3 . 18530 1 483 . 1 1 42 42 LEU HG H 1 1.248 0.01 . 1 . . . . 605 LEU HG . 18530 1 484 . 1 1 42 42 LEU HD11 H 1 0.487 0.01 . 2 . . . . 605 LEU HD11 . 18530 1 485 . 1 1 42 42 LEU HD12 H 1 0.487 0.01 . 2 . . . . 605 LEU HD12 . 18530 1 486 . 1 1 42 42 LEU HD13 H 1 0.487 0.01 . 2 . . . . 605 LEU HD13 . 18530 1 487 . 1 1 42 42 LEU HD21 H 1 0.541 0.01 . 2 . . . . 605 LEU HD21 . 18530 1 488 . 1 1 42 42 LEU HD22 H 1 0.541 0.01 . 2 . . . . 605 LEU HD22 . 18530 1 489 . 1 1 42 42 LEU HD23 H 1 0.541 0.01 . 2 . . . . 605 LEU HD23 . 18530 1 490 . 1 1 42 42 LEU C C 13 175.165 0.1 . 1 . . . . 605 LEU C . 18530 1 491 . 1 1 42 42 LEU CA C 13 56.792 0.1 . 1 . . . . 605 LEU CA . 18530 1 492 . 1 1 42 42 LEU CB C 13 41.736 0.1 . 1 . . . . 605 LEU CB . 18530 1 493 . 1 1 42 42 LEU CG C 13 28.684 0.1 . 1 . . . . 605 LEU CG . 18530 1 494 . 1 1 42 42 LEU CD1 C 13 25.175 0.1 . 2 . . . . 605 LEU CD1 . 18530 1 495 . 1 1 42 42 LEU CD2 C 13 25.350 0.1 . 2 . . . . 605 LEU CD2 . 18530 1 496 . 1 1 42 42 LEU N N 15 129.408 0.1 . 1 . . . . 605 LEU N . 18530 1 497 . 1 1 43 43 ILE H H 1 9.120 0.01 . 1 . . . . 606 ILE H . 18530 1 498 . 1 1 43 43 ILE HA H 1 4.217 0.01 . 1 . . . . 606 ILE HA . 18530 1 499 . 1 1 43 43 ILE HB H 1 1.389 0.01 . 1 . . . . 606 ILE HB . 18530 1 500 . 1 1 43 43 ILE HG12 H 1 1.261 0.01 . 2 . . . . 606 ILE HG12 . 18530 1 501 . 1 1 43 43 ILE HG13 H 1 1.338 0.01 . 2 . . . . 606 ILE HG13 . 18530 1 502 . 1 1 43 43 ILE HG21 H 1 0.827 0.01 . 1 . . . . 606 ILE HG21 . 18530 1 503 . 1 1 43 43 ILE HG22 H 1 0.827 0.01 . 1 . . . . 606 ILE HG22 . 18530 1 504 . 1 1 43 43 ILE HG23 H 1 0.827 0.01 . 1 . . . . 606 ILE HG23 . 18530 1 505 . 1 1 43 43 ILE HD11 H 1 0.635 0.01 . 1 . . . . 606 ILE HD11 . 18530 1 506 . 1 1 43 43 ILE HD12 H 1 0.635 0.01 . 1 . . . . 606 ILE HD12 . 18530 1 507 . 1 1 43 43 ILE HD13 H 1 0.635 0.01 . 1 . . . . 606 ILE HD13 . 18530 1 508 . 1 1 43 43 ILE C C 13 176.234 0.1 . 1 . . . . 606 ILE C . 18530 1 509 . 1 1 43 43 ILE CA C 13 59.236 0.1 . 1 . . . . 606 ILE CA . 18530 1 510 . 1 1 43 43 ILE CB C 13 37.313 0.1 . 1 . . . . 606 ILE CB . 18530 1 511 . 1 1 43 43 ILE CG1 C 13 26.965 0.1 . 1 . . . . 606 ILE CG1 . 18530 1 512 . 1 1 43 43 ILE CG2 C 13 17.116 0.1 . 1 . . . . 606 ILE CG2 . 18530 1 513 . 1 1 43 43 ILE CD1 C 13 10.364 0.1 . 1 . . . . 606 ILE CD1 . 18530 1 514 . 1 1 43 43 ILE N N 15 131.108 0.1 . 1 . . . . 606 ILE N . 18530 1 515 . 1 1 44 44 GLY H H 1 8.475 0.01 . 1 . . . . 607 GLY H . 18530 1 516 . 1 1 44 44 GLY HA2 H 1 3.542 0.01 . 2 . . . . 607 GLY HA2 . 18530 1 517 . 1 1 44 44 GLY HA3 H 1 4.739 0.01 . 2 . . . . 607 GLY HA3 . 18530 1 518 . 1 1 44 44 GLY C C 13 178.884 0.1 . 1 . . . . 607 GLY C . 18530 1 519 . 1 1 44 44 GLY CA C 13 43.177 0.1 . 1 . . . . 607 GLY CA . 18530 1 520 . 1 1 44 44 GLY N N 15 115.207 0.1 . 1 . . . . 607 GLY N . 18530 1 521 . 1 1 45 45 ASN H H 1 8.273 0.01 . 1 . . . . 608 ASN H . 18530 1 522 . 1 1 45 45 ASN HA H 1 4.969 0.01 . 1 . . . . 608 ASN HA . 18530 1 523 . 1 1 45 45 ASN HB2 H 1 2.758 0.01 . 2 . . . . 608 ASN HB2 . 18530 1 524 . 1 1 45 45 ASN HB3 H 1 2.974 0.01 . 2 . . . . 608 ASN HB3 . 18530 1 525 . 1 1 45 45 ASN HD21 H 1 6.815 0.01 . 1 . . . . 608 ASN HD21 . 18530 1 526 . 1 1 45 45 ASN HD22 H 1 7.568 0.01 . 1 . . . . 608 ASN HD22 . 18530 1 527 . 1 1 45 45 ASN C C 13 177.027 0.1 . 1 . . . . 608 ASN C . 18530 1 528 . 1 1 45 45 ASN CA C 13 49.299 0.1 . 1 . . . . 608 ASN CA . 18530 1 529 . 1 1 45 45 ASN CB C 13 39.422 0.1 . 1 . . . . 608 ASN CB . 18530 1 530 . 1 1 45 45 ASN CG C 13 173.611 0.1 . 1 . . . . 608 ASN CG . 18530 1 531 . 1 1 45 45 ASN N N 15 121.125 0.1 . 1 . . . . 608 ASN N . 18530 1 532 . 1 1 45 45 ASN ND2 N 15 110.547 0.1 . 1 . . . . 608 ASN ND2 . 18530 1 533 . 1 1 46 46 PRO HA H 1 4.562 0.01 . 1 . . . . 609 PRO HA . 18530 1 534 . 1 1 46 46 PRO HB2 H 1 2.070 0.01 . 2 . . . . 609 PRO HB2 . 18530 1 535 . 1 1 46 46 PRO HB3 H 1 2.534 0.01 . 2 . . . . 609 PRO HB3 . 18530 1 536 . 1 1 46 46 PRO HG2 H 1 1.877 0.01 . 2 . . . . 609 PRO HG2 . 18530 1 537 . 1 1 46 46 PRO HG3 H 1 2.074 0.01 . 2 . . . . 609 PRO HG3 . 18530 1 538 . 1 1 46 46 PRO HD2 H 1 3.937 0.01 . 2 . . . . 609 PRO HD2 . 18530 1 539 . 1 1 46 46 PRO HD3 H 1 3.937 0.01 . 2 . . . . 609 PRO HD3 . 18530 1 540 . 1 1 46 46 PRO C C 13 175.788 0.1 . 1 . . . . 609 PRO C . 18530 1 541 . 1 1 46 46 PRO CA C 13 63.530 0.1 . 1 . . . . 609 PRO CA . 18530 1 542 . 1 1 46 46 PRO CB C 13 33.232 0.1 . 1 . . . . 609 PRO CB . 18530 1 543 . 1 1 46 46 PRO CG C 13 26.256 0.1 . 1 . . . . 609 PRO CG . 18530 1 544 . 1 1 46 46 PRO CD C 13 50.265 0.1 . 1 . . . . 609 PRO CD . 18530 1 545 . 1 1 47 47 VAL H H 1 7.424 0.01 . 1 . . . . 610 VAL H . 18530 1 546 . 1 1 47 47 VAL HA H 1 4.823 0.01 . 1 . . . . 610 VAL HA . 18530 1 547 . 1 1 47 47 VAL HB H 1 2.002 0.01 . 1 . . . . 610 VAL HB . 18530 1 548 . 1 1 47 47 VAL HG11 H 1 0.878 0.01 . 2 . . . . 610 VAL HG11 . 18530 1 549 . 1 1 47 47 VAL HG12 H 1 0.878 0.01 . 2 . . . . 610 VAL HG12 . 18530 1 550 . 1 1 47 47 VAL HG13 H 1 0.878 0.01 . 2 . . . . 610 VAL HG13 . 18530 1 551 . 1 1 47 47 VAL HG21 H 1 0.979 0.01 . 2 . . . . 610 VAL HG21 . 18530 1 552 . 1 1 47 47 VAL HG22 H 1 0.979 0.01 . 2 . . . . 610 VAL HG22 . 18530 1 553 . 1 1 47 47 VAL HG23 H 1 0.979 0.01 . 2 . . . . 610 VAL HG23 . 18530 1 554 . 1 1 47 47 VAL C C 13 175.113 0.1 . 1 . . . . 610 VAL C . 18530 1 555 . 1 1 47 47 VAL CA C 13 62.519 0.1 . 1 . . . . 610 VAL CA . 18530 1 556 . 1 1 47 47 VAL CB C 13 32.880 0.1 . 1 . . . . 610 VAL CB . 18530 1 557 . 1 1 47 47 VAL CG1 C 13 21.657 0.1 . 2 . . . . 610 VAL CG1 . 18530 1 558 . 1 1 47 47 VAL CG2 C 13 22.346 0.1 . 2 . . . . 610 VAL CG2 . 18530 1 559 . 1 1 47 47 VAL N N 15 119.275 0.1 . 1 . . . . 610 VAL N . 18530 1 560 . 1 1 48 48 ALA H H 1 9.144 0.01 . 1 . . . . 611 ALA H . 18530 1 561 . 1 1 48 48 ALA HA H 1 5.340 0.01 . 1 . . . . 611 ALA HA . 18530 1 562 . 1 1 48 48 ALA HB1 H 1 1.422 0.01 . 1 . . . . 611 ALA HB1 . 18530 1 563 . 1 1 48 48 ALA HB2 H 1 1.422 0.01 . 1 . . . . 611 ALA HB2 . 18530 1 564 . 1 1 48 48 ALA HB3 H 1 1.422 0.01 . 1 . . . . 611 ALA HB3 . 18530 1 565 . 1 1 48 48 ALA C C 13 176.060 0.1 . 1 . . . . 611 ALA C . 18530 1 566 . 1 1 48 48 ALA CA C 13 50.077 0.1 . 1 . . . . 611 ALA CA . 18530 1 567 . 1 1 48 48 ALA CB C 13 23.873 0.1 . 1 . . . . 611 ALA CB . 18530 1 568 . 1 1 48 48 ALA N N 15 131.169 0.1 . 1 . . . . 611 ALA N . 18530 1 569 . 1 1 49 49 ARG H H 1 8.468 0.01 . 1 . . . . 612 ARG H . 18530 1 570 . 1 1 49 49 ARG HA H 1 5.597 0.01 . 1 . . . . 612 ARG HA . 18530 1 571 . 1 1 49 49 ARG HB2 H 1 1.714 0.01 . 2 . . . . 612 ARG HB2 . 18530 1 572 . 1 1 49 49 ARG HB3 H 1 1.760 0.01 . 2 . . . . 612 ARG HB3 . 18530 1 573 . 1 1 49 49 ARG HG2 H 1 1.245 0.01 . 2 . . . . 612 ARG HG2 . 18530 1 574 . 1 1 49 49 ARG HG3 H 1 1.327 0.01 . 2 . . . . 612 ARG HG3 . 18530 1 575 . 1 1 49 49 ARG HD2 H 1 3.140 0.01 . 2 . . . . 612 ARG HD2 . 18530 1 576 . 1 1 49 49 ARG HD3 H 1 3.139 0.01 . 2 . . . . 612 ARG HD3 . 18530 1 577 . 1 1 49 49 ARG HE H 1 7.303 0.01 . 1 . . . . 612 ARG HE . 18530 1 578 . 1 1 49 49 ARG C C 13 175.899 0.1 . 1 . . . . 612 ARG C . 18530 1 579 . 1 1 49 49 ARG CA C 13 54.407 0.1 . 1 . . . . 612 ARG CA . 18530 1 580 . 1 1 49 49 ARG CB C 13 34.957 0.1 . 1 . . . . 612 ARG CB . 18530 1 581 . 1 1 49 49 ARG CG C 13 27.840 0.1 . 1 . . . . 612 ARG CG . 18530 1 582 . 1 1 49 49 ARG CD C 13 43.437 0.1 . 1 . . . . 612 ARG CD . 18530 1 583 . 1 1 49 49 ARG N N 15 120.758 0.1 . 1 . . . . 612 ARG N . 18530 1 584 . 1 1 49 49 ARG NE N 15 84.979 0.1 . 1 . . . . 612 ARG NE . 18530 1 585 . 1 1 50 50 CYS H H 1 8.519 0.01 . 1 . . . . 613 CYS H . 18530 1 586 . 1 1 50 50 CYS HA H 1 3.555 0.01 . 1 . . . . 613 CYS HA . 18530 1 587 . 1 1 50 50 CYS HB2 H 1 1.450 0.01 . 2 . . . . 613 CYS HB2 . 18530 1 588 . 1 1 50 50 CYS HB3 H 1 2.508 0.01 . 2 . . . . 613 CYS HB3 . 18530 1 589 . 1 1 50 50 CYS C C 13 176.681 0.1 . 1 . . . . 613 CYS C . 18530 1 590 . 1 1 50 50 CYS CA C 13 55.076 0.1 . 1 . . . . 613 CYS CA . 18530 1 591 . 1 1 50 50 CYS CB C 13 36.827 0.1 . 1 . . . . 613 CYS CB . 18530 1 592 . 1 1 50 50 CYS N N 15 127.225 0.1 . 1 . . . . 613 CYS N . 18530 1 593 . 1 1 51 51 GLY H H 1 8.193 0.01 . 1 . . . . 614 GLY H . 18530 1 594 . 1 1 51 51 GLY HA2 H 1 3.953 0.01 . 2 . . . . 614 GLY HA2 . 18530 1 595 . 1 1 51 51 GLY HA3 H 1 4.194 0.01 . 2 . . . . 614 GLY HA3 . 18530 1 596 . 1 1 51 51 GLY C C 13 177.637 0.1 . 1 . . . . 614 GLY C . 18530 1 597 . 1 1 51 51 GLY CA C 13 44.648 0.1 . 1 . . . . 614 GLY CA . 18530 1 598 . 1 1 51 51 GLY N N 15 119.684 0.1 . 1 . . . . 614 GLY N . 18530 1 599 . 1 1 52 52 GLU H H 1 8.804 0.01 . 1 . . . . 615 GLU H . 18530 1 600 . 1 1 52 52 GLU HA H 1 3.882 0.01 . 1 . . . . 615 GLU HA . 18530 1 601 . 1 1 52 52 GLU HB2 H 1 1.963 0.01 . 2 . . . . 615 GLU HB2 . 18530 1 602 . 1 1 52 52 GLU HB3 H 1 1.963 0.01 . 2 . . . . 615 GLU HB3 . 18530 1 603 . 1 1 52 52 GLU HG2 H 1 2.237 0.01 . 2 . . . . 615 GLU HG2 . 18530 1 604 . 1 1 52 52 GLU HG3 H 1 2.367 0.01 . 2 . . . . 615 GLU HG3 . 18530 1 605 . 1 1 52 52 GLU C C 13 174.893 0.1 . 1 . . . . 615 GLU C . 18530 1 606 . 1 1 52 52 GLU CA C 13 59.387 0.1 . 1 . . . . 615 GLU CA . 18530 1 607 . 1 1 52 52 GLU CB C 13 28.989 0.1 . 1 . . . . 615 GLU CB . 18530 1 608 . 1 1 52 52 GLU CG C 13 37.039 0.1 . 1 . . . . 615 GLU CG . 18530 1 609 . 1 1 52 52 GLU N N 15 117.241 0.1 . 1 . . . . 615 GLU N . 18530 1 610 . 1 1 53 53 ASP H H 1 8.222 0.01 . 1 . . . . 616 ASP H . 18530 1 611 . 1 1 53 53 ASP HA H 1 4.356 0.01 . 1 . . . . 616 ASP HA . 18530 1 612 . 1 1 53 53 ASP HB2 H 1 2.525 0.01 . 2 . . . . 616 ASP HB2 . 18530 1 613 . 1 1 53 53 ASP HB3 H 1 2.855 0.01 . 2 . . . . 616 ASP HB3 . 18530 1 614 . 1 1 53 53 ASP C C 13 175.766 0.1 . 1 . . . . 616 ASP C . 18530 1 615 . 1 1 53 53 ASP CA C 13 52.753 0.1 . 1 . . . . 616 ASP CA . 18530 1 616 . 1 1 53 53 ASP CB C 13 39.133 0.1 . 1 . . . . 616 ASP CB . 18530 1 617 . 1 1 53 53 ASP N N 15 116.296 0.1 . 1 . . . . 616 ASP N . 18530 1 618 . 1 1 54 54 LEU H H 1 8.191 0.01 . 1 . . . . 617 LEU H . 18530 1 619 . 1 1 54 54 LEU HA H 1 3.860 0.01 . 1 . . . . 617 LEU HA . 18530 1 620 . 1 1 54 54 LEU HB2 H 1 1.480 0.01 . 2 . . . . 617 LEU HB2 . 18530 1 621 . 1 1 54 54 LEU HB3 H 1 2.018 0.01 . 2 . . . . 617 LEU HB3 . 18530 1 622 . 1 1 54 54 LEU HG H 1 1.233 0.01 . 1 . . . . 617 LEU HG . 18530 1 623 . 1 1 54 54 LEU HD11 H 1 0.513 0.01 . 2 . . . . 617 LEU HD11 . 18530 1 624 . 1 1 54 54 LEU HD12 H 1 0.513 0.01 . 2 . . . . 617 LEU HD12 . 18530 1 625 . 1 1 54 54 LEU HD13 H 1 0.513 0.01 . 2 . . . . 617 LEU HD13 . 18530 1 626 . 1 1 54 54 LEU HD21 H 1 0.799 0.01 . 2 . . . . 617 LEU HD21 . 18530 1 627 . 1 1 54 54 LEU HD22 H 1 0.799 0.01 . 2 . . . . 617 LEU HD22 . 18530 1 628 . 1 1 54 54 LEU HD23 H 1 0.799 0.01 . 2 . . . . 617 LEU HD23 . 18530 1 629 . 1 1 54 54 LEU C C 13 175.789 0.1 . 1 . . . . 617 LEU C . 18530 1 630 . 1 1 54 54 LEU CA C 13 56.248 0.1 . 1 . . . . 617 LEU CA . 18530 1 631 . 1 1 54 54 LEU CB C 13 36.491 0.1 . 1 . . . . 617 LEU CB . 18530 1 632 . 1 1 54 54 LEU CG C 13 26.944 0.1 . 1 . . . . 617 LEU CG . 18530 1 633 . 1 1 54 54 LEU CD1 C 13 22.460 0.1 . 2 . . . . 617 LEU CD1 . 18530 1 634 . 1 1 54 54 LEU CD2 C 13 25.038 0.1 . 2 . . . . 617 LEU CD2 . 18530 1 635 . 1 1 54 54 LEU N N 15 114.112 0.1 . 1 . . . . 617 LEU N . 18530 1 636 . 1 1 55 55 ARG H H 1 7.086 0.01 . 1 . . . . 618 ARG H . 18530 1 637 . 1 1 55 55 ARG HA H 1 4.525 0.01 . 1 . . . . 618 ARG HA . 18530 1 638 . 1 1 55 55 ARG HB2 H 1 1.700 0.01 . 1 . . . . 618 ARG HB2 . 18530 1 639 . 1 1 55 55 ARG HB3 H 1 1.700 0.01 . 1 . . . . 618 ARG HB3 . 18530 1 640 . 1 1 55 55 ARG HG2 H 1 1.455 0.01 . 2 . . . . 618 ARG HG2 . 18530 1 641 . 1 1 55 55 ARG HG3 H 1 1.459 0.01 . 2 . . . . 618 ARG HG3 . 18530 1 642 . 1 1 55 55 ARG HD2 H 1 3.134 0.01 . 2 . . . . 618 ARG HD2 . 18530 1 643 . 1 1 55 55 ARG HD3 H 1 3.134 0.01 . 2 . . . . 618 ARG HD3 . 18530 1 644 . 1 1 55 55 ARG HE H 1 7.178 0.01 . 1 . . . . 618 ARG HE . 18530 1 645 . 1 1 55 55 ARG C C 13 174.230 0.1 . 1 . . . . 618 ARG C . 18530 1 646 . 1 1 55 55 ARG CA C 13 53.407 0.1 . 1 . . . . 618 ARG CA . 18530 1 647 . 1 1 55 55 ARG CB C 13 32.563 0.1 . 1 . . . . 618 ARG CB . 18530 1 648 . 1 1 55 55 ARG CG C 13 27.327 0.1 . 1 . . . . 618 ARG CG . 18530 1 649 . 1 1 55 55 ARG CD C 13 43.387 0.1 . 1 . . . . 618 ARG CD . 18530 1 650 . 1 1 55 55 ARG N N 15 115.175 0.1 . 1 . . . . 618 ARG N . 18530 1 651 . 1 1 55 55 ARG NE N 15 85.527 0.1 . 1 . . . . 618 ARG NE . 18530 1 652 . 1 1 56 56 TRP H H 1 8.655 0.01 . 1 . . . . 619 TRP H . 18530 1 653 . 1 1 56 56 TRP HA H 1 4.635 0.01 . 1 . . . . 619 TRP HA . 18530 1 654 . 1 1 56 56 TRP HB2 H 1 2.799 0.01 . 2 . . . . 619 TRP HB2 . 18530 1 655 . 1 1 56 56 TRP HB3 H 1 2.938 0.01 . 2 . . . . 619 TRP HB3 . 18530 1 656 . 1 1 56 56 TRP HD1 H 1 7.227 0.01 . 1 . . . . 619 TRP HD1 . 18530 1 657 . 1 1 56 56 TRP HE1 H 1 10.080 0.01 . 1 . . . . 619 TRP HE1 . 18530 1 658 . 1 1 56 56 TRP HE3 H 1 7.087 0.01 . 1 . . . . 619 TRP HE3 . 18530 1 659 . 1 1 56 56 TRP HZ2 H 1 7.167 0.01 . 1 . . . . 619 TRP HZ2 . 18530 1 660 . 1 1 56 56 TRP HZ3 H 1 6.959 0.01 . 1 . . . . 619 TRP HZ3 . 18530 1 661 . 1 1 56 56 TRP HH2 H 1 6.528 0.01 . 1 . . . . 619 TRP HH2 . 18530 1 662 . 1 1 56 56 TRP C C 13 174.895 0.1 . 1 . . . . 619 TRP C . 18530 1 663 . 1 1 56 56 TRP CA C 13 57.643 0.1 . 1 . . . . 619 TRP CA . 18530 1 664 . 1 1 56 56 TRP CB C 13 29.429 0.1 . 1 . . . . 619 TRP CB . 18530 1 665 . 1 1 56 56 TRP CD1 C 13 125.677 0.1 . 1 . . . . 619 TRP CD1 . 18530 1 666 . 1 1 56 56 TRP CE2 C 13 135.322 0.1 . 1 . . . . 619 TRP CE2 . 18530 1 667 . 1 1 56 56 TRP CE3 C 13 119.580 0.1 . 1 . . . . 619 TRP CE3 . 18530 1 668 . 1 1 56 56 TRP CZ2 C 13 113.968 0.1 . 1 . . . . 619 TRP CZ2 . 18530 1 669 . 1 1 56 56 TRP CZ3 C 13 123.207 0.1 . 1 . . . . 619 TRP CZ3 . 18530 1 670 . 1 1 56 56 TRP CH2 C 13 123.197 0.1 . 1 . . . . 619 TRP CH2 . 18530 1 671 . 1 1 56 56 TRP N N 15 123.212 0.1 . 1 . . . . 619 TRP N . 18530 1 672 . 1 1 56 56 TRP NE1 N 15 129.961 0.1 . 1 . . . . 619 TRP NE1 . 18530 1 673 . 1 1 57 57 LEU H H 1 9.722 0.01 . 1 . . . . 620 LEU H . 18530 1 674 . 1 1 57 57 LEU HA H 1 4.705 0.01 . 1 . . . . 620 LEU HA . 18530 1 675 . 1 1 57 57 LEU HB2 H 1 1.767 0.01 . 1 . . . . 620 LEU HB2 . 18530 1 676 . 1 1 57 57 LEU HB3 H 1 1.767 0.01 . 1 . . . . 620 LEU HB3 . 18530 1 677 . 1 1 57 57 LEU HG H 1 1.591 0.01 . 1 . . . . 620 LEU HG . 18530 1 678 . 1 1 57 57 LEU HD11 H 1 0.917 0.01 . 2 . . . . 620 LEU HD11 . 18530 1 679 . 1 1 57 57 LEU HD12 H 1 0.917 0.01 . 2 . . . . 620 LEU HD12 . 18530 1 680 . 1 1 57 57 LEU HD13 H 1 0.917 0.01 . 2 . . . . 620 LEU HD13 . 18530 1 681 . 1 1 57 57 LEU HD21 H 1 0.931 0.01 . 2 . . . . 620 LEU HD21 . 18530 1 682 . 1 1 57 57 LEU HD22 H 1 0.931 0.01 . 2 . . . . 620 LEU HD22 . 18530 1 683 . 1 1 57 57 LEU HD23 H 1 0.931 0.01 . 2 . . . . 620 LEU HD23 . 18530 1 684 . 1 1 57 57 LEU C C 13 175.004 0.1 . 1 . . . . 620 LEU C . 18530 1 685 . 1 1 57 57 LEU CA C 13 54.491 0.1 . 1 . . . . 620 LEU CA . 18530 1 686 . 1 1 57 57 LEU CB C 13 41.501 0.1 . 1 . . . . 620 LEU CB . 18530 1 687 . 1 1 57 57 LEU CG C 13 27.214 0.1 . 1 . . . . 620 LEU CG . 18530 1 688 . 1 1 57 57 LEU CD1 C 13 24.547 0.1 . 2 . . . . 620 LEU CD1 . 18530 1 689 . 1 1 57 57 LEU CD2 C 13 24.651 0.1 . 2 . . . . 620 LEU CD2 . 18530 1 690 . 1 1 57 57 LEU N N 15 128.225 0.1 . 1 . . . . 620 LEU N . 18530 1 691 . 1 1 58 58 VAL H H 1 8.543 0.01 . 1 . . . . 621 VAL H . 18530 1 692 . 1 1 58 58 VAL HA H 1 4.367 0.01 . 1 . . . . 621 VAL HA . 18530 1 693 . 1 1 58 58 VAL HB H 1 2.030 0.01 . 1 . . . . 621 VAL HB . 18530 1 694 . 1 1 58 58 VAL HG11 H 1 0.902 0.01 . 2 . . . . 621 VAL HG11 . 18530 1 695 . 1 1 58 58 VAL HG12 H 1 0.902 0.01 . 2 . . . . 621 VAL HG12 . 18530 1 696 . 1 1 58 58 VAL HG13 H 1 0.902 0.01 . 2 . . . . 621 VAL HG13 . 18530 1 697 . 1 1 58 58 VAL HG21 H 1 0.902 0.01 . 2 . . . . 621 VAL HG21 . 18530 1 698 . 1 1 58 58 VAL HG22 H 1 0.902 0.01 . 2 . . . . 621 VAL HG22 . 18530 1 699 . 1 1 58 58 VAL HG23 H 1 0.902 0.01 . 2 . . . . 621 VAL HG23 . 18530 1 700 . 1 1 58 58 VAL C C 13 175.895 0.1 . 1 . . . . 621 VAL C . 18530 1 701 . 1 1 58 58 VAL CA C 13 60.961 0.1 . 1 . . . . 621 VAL CA . 18530 1 702 . 1 1 58 58 VAL CB C 13 34.578 0.1 . 1 . . . . 621 VAL CB . 18530 1 703 . 1 1 58 58 VAL CG1 C 13 21.052 0.1 . 2 . . . . 621 VAL CG1 . 18530 1 704 . 1 1 58 58 VAL CG2 C 13 21.054 0.1 . 2 . . . . 621 VAL CG2 . 18530 1 705 . 1 1 58 58 VAL N N 15 125.782 0.1 . 1 . . . . 621 VAL N . 18530 1 706 . 1 1 59 59 GLY H H 1 8.917 0.01 . 1 . . . . 622 GLY H . 18530 1 707 . 1 1 59 59 GLY HA2 H 1 4.309 0.01 . 2 . . . . 622 GLY HA2 . 18530 1 708 . 1 1 59 59 GLY HA3 H 1 3.673 0.01 . 2 . . . . 622 GLY HA3 . 18530 1 709 . 1 1 59 59 GLY C C 13 178.686 0.1 . 1 . . . . 622 GLY C . 18530 1 710 . 1 1 59 59 GLY CA C 13 44.066 0.1 . 1 . . . . 622 GLY CA . 18530 1 711 . 1 1 59 59 GLY N N 15 115.419 0.1 . 1 . . . . 622 GLY N . 18530 1 712 . 1 1 60 60 GLU H H 1 8.354 0.01 . 1 . . . . 623 GLU H . 18530 1 713 . 1 1 60 60 GLU HA H 1 4.150 0.01 . 1 . . . . 623 GLU HA . 18530 1 714 . 1 1 60 60 GLU HB2 H 1 1.945 0.01 . 1 . . . . 623 GLU HB2 . 18530 1 715 . 1 1 60 60 GLU HB3 H 1 1.945 0.01 . 1 . . . . 623 GLU HB3 . 18530 1 716 . 1 1 60 60 GLU HG2 H 1 2.201 0.01 . 2 . . . . 623 GLU HG2 . 18530 1 717 . 1 1 60 60 GLU HG3 H 1 2.265 0.01 . 2 . . . . 623 GLU HG3 . 18530 1 718 . 1 1 60 60 GLU C C 13 175.663 0.1 . 1 . . . . 623 GLU C . 18530 1 719 . 1 1 60 60 GLU CA C 13 56.807 0.1 . 1 . . . . 623 GLU CA . 18530 1 720 . 1 1 60 60 GLU CB C 13 29.208 0.1 . 1 . . . . 623 GLU CB . 18530 1 721 . 1 1 60 60 GLU CG C 13 36.173 0.1 . 1 . . . . 623 GLU CG . 18530 1 722 . 1 1 60 60 GLU N N 15 120.314 0.1 . 1 . . . . 623 GLU N . 18530 1 723 . 1 1 61 61 MET H H 1 7.878 0.01 . 1 . . . . 624 MET H . 18530 1 724 . 1 1 61 61 MET HA H 1 5.188 0.01 . 1 . . . . 624 MET HA . 18530 1 725 . 1 1 61 61 MET HB2 H 1 1.380 0.01 . 2 . . . . 624 MET HB2 . 18530 1 726 . 1 1 61 61 MET HB3 H 1 1.825 0.01 . 2 . . . . 624 MET HB3 . 18530 1 727 . 1 1 61 61 MET HG2 H 1 1.945 0.01 . 2 . . . . 624 MET HG2 . 18530 1 728 . 1 1 61 61 MET HG3 H 1 2.024 0.01 . 2 . . . . 624 MET HG3 . 18530 1 729 . 1 1 61 61 MET HE1 H 1 1.401 0.01 . 1 . . . . 624 MET HE1 . 18530 1 730 . 1 1 61 61 MET HE2 H 1 1.401 0.01 . 1 . . . . 624 MET HE2 . 18530 1 731 . 1 1 61 61 MET HE3 H 1 1.401 0.01 . 1 . . . . 624 MET HE3 . 18530 1 732 . 1 1 61 61 MET C C 13 176.865 0.1 . 1 . . . . 624 MET C . 18530 1 733 . 1 1 61 61 MET CA C 13 54.799 0.1 . 1 . . . . 624 MET CA . 18530 1 734 . 1 1 61 61 MET CB C 13 36.520 0.1 . 1 . . . . 624 MET CB . 18530 1 735 . 1 1 61 61 MET CG C 13 30.381 0.1 . 1 . . . . 624 MET CG . 18530 1 736 . 1 1 61 61 MET CE C 13 17.044 0.1 . 1 . . . . 624 MET CE . 18530 1 737 . 1 1 61 61 MET N N 15 123.352 0.1 . 1 . . . . 624 MET N . 18530 1 738 . 1 1 62 62 HIS H H 1 8.429 0.01 . 1 . . . . 625 HIS H . 18530 1 739 . 1 1 62 62 HIS HA H 1 4.577 0.01 . 1 . . . . 625 HIS HA . 18530 1 740 . 1 1 62 62 HIS HB2 H 1 2.996 0.01 . 2 . . . . 625 HIS HB2 . 18530 1 741 . 1 1 62 62 HIS HB3 H 1 3.235 0.01 . 2 . . . . 625 HIS HB3 . 18530 1 742 . 1 1 62 62 HIS HD2 H 1 6.942 0.01 . 1 . . . . 625 HIS HD2 . 18530 1 743 . 1 1 62 62 HIS HE1 H 1 8.321 0.01 . 1 . . . . 625 HIS HE1 . 18530 1 744 . 1 1 62 62 HIS C C 13 179.072 0.1 . 1 . . . . 625 HIS C . 18530 1 745 . 1 1 62 62 HIS CA C 13 55.467 0.1 . 1 . . . . 625 HIS CA . 18530 1 746 . 1 1 62 62 HIS CB C 13 32.012 0.1 . 1 . . . . 625 HIS CB . 18530 1 747 . 1 1 62 62 HIS CD2 C 13 120.144 0.1 . 1 . . . . 625 HIS CD2 . 18530 1 748 . 1 1 62 62 HIS CE1 C 13 136.903 0.1 . 1 . . . . 625 HIS CE1 . 18530 1 749 . 1 1 62 62 HIS N N 15 114.449 0.1 . 1 . . . . 625 HIS N . 18530 1 750 . 1 1 63 63 CYS H H 1 9.360 0.01 . 1 . . . . 626 CYS H . 18530 1 751 . 1 1 63 63 CYS HA H 1 5.184 0.01 . 1 . . . . 626 CYS HA . 18530 1 752 . 1 1 63 63 CYS HB2 H 1 2.511 0.01 . 2 . . . . 626 CYS HB2 . 18530 1 753 . 1 1 63 63 CYS HB3 H 1 2.860 0.01 . 2 . . . . 626 CYS HB3 . 18530 1 754 . 1 1 63 63 CYS C C 13 177.418 0.1 . 1 . . . . 626 CYS C . 18530 1 755 . 1 1 63 63 CYS CA C 13 54.142 0.1 . 1 . . . . 626 CYS CA . 18530 1 756 . 1 1 63 63 CYS CB C 13 40.864 0.1 . 1 . . . . 626 CYS CB . 18530 1 757 . 1 1 63 63 CYS N N 15 121.498 0.1 . 1 . . . . 626 CYS N . 18530 1 758 . 1 1 64 64 GLN H H 1 9.439 0.01 . 1 . . . . 627 GLN H . 18530 1 759 . 1 1 64 64 GLN HA H 1 4.689 0.01 . 1 . . . . 627 GLN HA . 18530 1 760 . 1 1 64 64 GLN HB2 H 1 1.957 0.01 . 2 . . . . 627 GLN HB2 . 18530 1 761 . 1 1 64 64 GLN HB3 H 1 2.018 0.01 . 2 . . . . 627 GLN HB3 . 18530 1 762 . 1 1 64 64 GLN HG2 H 1 2.264 0.01 . 2 . . . . 627 GLN HG2 . 18530 1 763 . 1 1 64 64 GLN HG3 H 1 2.265 0.01 . 2 . . . . 627 GLN HG3 . 18530 1 764 . 1 1 64 64 GLN HE21 H 1 6.862 0.01 . 1 . . . . 627 GLN HE21 . 18530 1 765 . 1 1 64 64 GLN HE22 H 1 7.502 0.01 . 1 . . . . 627 GLN HE22 . 18530 1 766 . 1 1 64 64 GLN C C 13 176.129 0.1 . 1 . . . . 627 GLN C . 18530 1 767 . 1 1 64 64 GLN CA C 13 53.898 0.1 . 1 . . . . 627 GLN CA . 18530 1 768 . 1 1 64 64 GLN CB C 13 31.619 0.1 . 1 . . . . 627 GLN CB . 18530 1 769 . 1 1 64 64 GLN CG C 13 33.037 0.1 . 1 . . . . 627 GLN CG . 18530 1 770 . 1 1 64 64 GLN CD C 13 178.494 0.1 . 1 . . . . 627 GLN CD . 18530 1 771 . 1 1 64 64 GLN N N 15 127.956 0.1 . 1 . . . . 627 GLN N . 18530 1 772 . 1 1 64 64 GLN NE2 N 15 112.237 0.1 . 1 . . . . 627 GLN NE2 . 18530 1 773 . 1 1 65 65 LYS H H 1 9.118 0.01 . 1 . . . . 628 LYS H . 18530 1 774 . 1 1 65 65 LYS HA H 1 3.462 0.01 . 1 . . . . 628 LYS HA . 18530 1 775 . 1 1 65 65 LYS HB2 H 1 1.421 0.01 . 2 . . . . 628 LYS HB2 . 18530 1 776 . 1 1 65 65 LYS HB3 H 1 1.559 0.01 . 2 . . . . 628 LYS HB3 . 18530 1 777 . 1 1 65 65 LYS HG2 H 1 1.094 0.01 . 2 . . . . 628 LYS HG2 . 18530 1 778 . 1 1 65 65 LYS HG3 H 1 0.713 0.01 . 2 . . . . 628 LYS HG3 . 18530 1 779 . 1 1 65 65 LYS HD2 H 1 1.401 0.01 . 2 . . . . 628 LYS HD2 . 18530 1 780 . 1 1 65 65 LYS HD3 H 1 1.401 0.01 . 2 . . . . 628 LYS HD3 . 18530 1 781 . 1 1 65 65 LYS HE2 H 1 2.889 0.01 . 2 . . . . 628 LYS HE2 . 18530 1 782 . 1 1 65 65 LYS HE3 H 1 2.786 0.01 . 2 . . . . 628 LYS HE3 . 18530 1 783 . 1 1 65 65 LYS C C 13 174.462 0.1 . 1 . . . . 628 LYS C . 18530 1 784 . 1 1 65 65 LYS CA C 13 58.133 0.1 . 1 . . . . 628 LYS CA . 18530 1 785 . 1 1 65 65 LYS CB C 13 32.699 0.1 . 1 . . . . 628 LYS CB . 18530 1 786 . 1 1 65 65 LYS CG C 13 25.338 0.1 . 1 . . . . 628 LYS CG . 18530 1 787 . 1 1 65 65 LYS CD C 13 29.471 0.1 . 1 . . . . 628 LYS CD . 18530 1 788 . 1 1 65 65 LYS CE C 13 41.856 0.1 . 1 . . . . 628 LYS CE . 18530 1 789 . 1 1 65 65 LYS N N 15 131.520 0.1 . 1 . . . . 628 LYS N . 18530 1 790 . 1 1 66 66 ILE H H 1 8.338 0.01 . 1 . . . . 629 ILE H . 18530 1 791 . 1 1 66 66 ILE HA H 1 4.266 0.01 . 1 . . . . 629 ILE HA . 18530 1 792 . 1 1 66 66 ILE HB H 1 1.923 0.01 . 1 . . . . 629 ILE HB . 18530 1 793 . 1 1 66 66 ILE HG12 H 1 0.711 0.01 . 2 . . . . 629 ILE HG12 . 18530 1 794 . 1 1 66 66 ILE HG13 H 1 0.890 0.01 . 2 . . . . 629 ILE HG13 . 18530 1 795 . 1 1 66 66 ILE HG21 H 1 0.753 0.01 . 1 . . . . 629 ILE HG21 . 18530 1 796 . 1 1 66 66 ILE HG22 H 1 0.753 0.01 . 1 . . . . 629 ILE HG22 . 18530 1 797 . 1 1 66 66 ILE HG23 H 1 0.753 0.01 . 1 . . . . 629 ILE HG23 . 18530 1 798 . 1 1 66 66 ILE HD11 H 1 0.543 0.01 . 1 . . . . 629 ILE HD11 . 18530 1 799 . 1 1 66 66 ILE HD12 H 1 0.543 0.01 . 1 . . . . 629 ILE HD12 . 18530 1 800 . 1 1 66 66 ILE HD13 H 1 0.543 0.01 . 1 . . . . 629 ILE HD13 . 18530 1 801 . 1 1 66 66 ILE C C 13 177.306 0.1 . 1 . . . . 629 ILE C . 18530 1 802 . 1 1 66 66 ILE CA C 13 60.582 0.1 . 1 . . . . 629 ILE CA . 18530 1 803 . 1 1 66 66 ILE CB C 13 39.450 0.1 . 1 . . . . 629 ILE CB . 18530 1 804 . 1 1 66 66 ILE CG1 C 13 26.962 0.1 . 1 . . . . 629 ILE CG1 . 18530 1 805 . 1 1 66 66 ILE CG2 C 13 18.885 0.1 . 1 . . . . 629 ILE CG2 . 18530 1 806 . 1 1 66 66 ILE CD1 C 13 13.958 0.1 . 1 . . . . 629 ILE CD1 . 18530 1 807 . 1 1 66 66 ILE N N 15 120.775 0.1 . 1 . . . . 629 ILE N . 18530 1 808 . 1 1 67 67 ALA H H 1 7.360 0.01 . 1 . . . . 630 ALA H . 18530 1 809 . 1 1 67 67 ALA HA H 1 4.660 0.01 . 1 . . . . 630 ALA HA . 18530 1 810 . 1 1 67 67 ALA HB1 H 1 1.328 0.01 . 1 . . . . 630 ALA HB1 . 18530 1 811 . 1 1 67 67 ALA HB2 H 1 1.328 0.01 . 1 . . . . 630 ALA HB2 . 18530 1 812 . 1 1 67 67 ALA HB3 H 1 1.328 0.01 . 1 . . . . 630 ALA HB3 . 18530 1 813 . 1 1 67 67 ALA C C 13 175.201 0.1 . 1 . . . . 630 ALA C . 18530 1 814 . 1 1 67 67 ALA CA C 13 51.196 0.1 . 1 . . . . 630 ALA CA . 18530 1 815 . 1 1 67 67 ALA CB C 13 23.540 0.1 . 1 . . . . 630 ALA CB . 18530 1 816 . 1 1 67 67 ALA N N 15 125.585 0.1 . 1 . . . . 630 ALA N . 18530 1 817 . 1 1 68 68 CYS H H 1 8.960 0.01 . 1 . . . . 631 CYS H . 18530 1 818 . 1 1 68 68 CYS HA H 1 4.450 0.01 . 1 . . . . 631 CYS HA . 18530 1 819 . 1 1 68 68 CYS HB2 H 1 2.049 0.01 . 2 . . . . 631 CYS HB2 . 18530 1 820 . 1 1 68 68 CYS HB3 H 1 2.344 0.01 . 2 . . . . 631 CYS HB3 . 18530 1 821 . 1 1 68 68 CYS C C 13 176.630 0.1 . 1 . . . . 631 CYS C . 18530 1 822 . 1 1 68 68 CYS CA C 13 57.958 0.1 . 1 . . . . 631 CYS CA . 18530 1 823 . 1 1 68 68 CYS CB C 13 44.895 0.1 . 1 . . . . 631 CYS CB . 18530 1 824 . 1 1 68 68 CYS N N 15 114.579 0.1 . 1 . . . . 631 CYS N . 18530 1 825 . 1 1 69 69 VAL H H 1 8.226 0.01 . 1 . . . . 632 VAL H . 18530 1 826 . 1 1 69 69 VAL HA H 1 4.983 0.01 . 1 . . . . 632 VAL HA . 18530 1 827 . 1 1 69 69 VAL HB H 1 2.285 0.01 . 1 . . . . 632 VAL HB . 18530 1 828 . 1 1 69 69 VAL HG11 H 1 0.933 0.01 . 2 . . . . 632 VAL HG11 . 18530 1 829 . 1 1 69 69 VAL HG12 H 1 0.933 0.01 . 2 . . . . 632 VAL HG12 . 18530 1 830 . 1 1 69 69 VAL HG13 H 1 0.933 0.01 . 2 . . . . 632 VAL HG13 . 18530 1 831 . 1 1 69 69 VAL HG21 H 1 1.162 0.01 . 2 . . . . 632 VAL HG21 . 18530 1 832 . 1 1 69 69 VAL HG22 H 1 1.162 0.01 . 2 . . . . 632 VAL HG22 . 18530 1 833 . 1 1 69 69 VAL HG23 H 1 1.162 0.01 . 2 . . . . 632 VAL HG23 . 18530 1 834 . 1 1 69 69 VAL C C 13 173.886 0.1 . 1 . . . . 632 VAL C . 18530 1 835 . 1 1 69 69 VAL CA C 13 59.648 0.1 . 1 . . . . 632 VAL CA . 18530 1 836 . 1 1 69 69 VAL CB C 13 35.456 0.1 . 1 . . . . 632 VAL CB . 18530 1 837 . 1 1 69 69 VAL CG1 C 13 19.162 0.1 . 2 . . . . 632 VAL CG1 . 18530 1 838 . 1 1 69 69 VAL CG2 C 13 21.717 0.1 . 2 . . . . 632 VAL CG2 . 18530 1 839 . 1 1 69 69 VAL N N 15 114.744 0.1 . 1 . . . . 632 VAL N . 18530 1 840 . 1 1 70 70 LEU H H 1 9.536 0.01 . 1 . . . . 633 LEU H . 18530 1 841 . 1 1 70 70 LEU HA H 1 4.516 0.01 . 1 . . . . 633 LEU HA . 18530 1 842 . 1 1 70 70 LEU HB2 H 1 1.446 0.01 . 2 . . . . 633 LEU HB2 . 18530 1 843 . 1 1 70 70 LEU HB3 H 1 1.816 0.01 . 2 . . . . 633 LEU HB3 . 18530 1 844 . 1 1 70 70 LEU HG H 1 1.978 0.01 . 1 . . . . 633 LEU HG . 18530 1 845 . 1 1 70 70 LEU HD11 H 1 0.388 0.01 . 2 . . . . 633 LEU HD11 . 18530 1 846 . 1 1 70 70 LEU HD12 H 1 0.388 0.01 . 2 . . . . 633 LEU HD12 . 18530 1 847 . 1 1 70 70 LEU HD13 H 1 0.388 0.01 . 2 . . . . 633 LEU HD13 . 18530 1 848 . 1 1 70 70 LEU HD21 H 1 0.949 0.01 . 2 . . . . 633 LEU HD21 . 18530 1 849 . 1 1 70 70 LEU HD22 H 1 0.949 0.01 . 2 . . . . 633 LEU HD22 . 18530 1 850 . 1 1 70 70 LEU HD23 H 1 0.949 0.01 . 2 . . . . 633 LEU HD23 . 18530 1 851 . 1 1 70 70 LEU C C 13 175.862 0.1 . 1 . . . . 633 LEU C . 18530 1 852 . 1 1 70 70 LEU CA C 13 54.096 0.1 . 1 . . . . 633 LEU CA . 18530 1 853 . 1 1 70 70 LEU CB C 13 40.998 0.1 . 1 . . . . 633 LEU CB . 18530 1 854 . 1 1 70 70 LEU CG C 13 27.278 0.1 . 1 . . . . 633 LEU CG . 18530 1 855 . 1 1 70 70 LEU CD1 C 13 22.824 0.1 . 2 . . . . 633 LEU CD1 . 18530 1 856 . 1 1 70 70 LEU CD2 C 13 25.528 0.1 . 2 . . . . 633 LEU CD2 . 18530 1 857 . 1 1 70 70 LEU N N 15 128.416 0.1 . 1 . . . . 633 LEU N . 18530 1 858 . 1 1 71 71 PRO HA H 1 4.737 0.01 . 1 . . . . 634 PRO HA . 18530 1 859 . 1 1 71 71 PRO HB2 H 1 1.990 0.01 . 2 . . . . 634 PRO HB2 . 18530 1 860 . 1 1 71 71 PRO HB3 H 1 2.223 0.01 . 2 . . . . 634 PRO HB3 . 18530 1 861 . 1 1 71 71 PRO HG2 H 1 1.937 0.01 . 2 . . . . 634 PRO HG2 . 18530 1 862 . 1 1 71 71 PRO HG3 H 1 1.478 0.01 . 2 . . . . 634 PRO HG3 . 18530 1 863 . 1 1 71 71 PRO HD2 H 1 3.330 0.01 . 2 . . . . 634 PRO HD2 . 18530 1 864 . 1 1 71 71 PRO HD3 H 1 3.651 0.01 . 2 . . . . 634 PRO HD3 . 18530 1 865 . 1 1 71 71 PRO C C 13 176.560 0.1 . 1 . . . . 634 PRO C . 18530 1 866 . 1 1 71 71 PRO CA C 13 62.027 0.1 . 1 . . . . 634 PRO CA . 18530 1 867 . 1 1 71 71 PRO CB C 13 32.186 0.1 . 1 . . . . 634 PRO CB . 18530 1 868 . 1 1 71 71 PRO CG C 13 26.193 0.1 . 1 . . . . 634 PRO CG . 18530 1 869 . 1 1 71 71 PRO CD C 13 50.083 0.1 . 1 . . . . 634 PRO CD . 18530 1 870 . 1 1 72 72 VAL H H 1 7.959 0.01 . 1 . . . . 635 VAL H . 18530 1 871 . 1 1 72 72 VAL HA H 1 3.683 0.01 . 1 . . . . 635 VAL HA . 18530 1 872 . 1 1 72 72 VAL HB H 1 1.859 0.01 . 1 . . . . 635 VAL HB . 18530 1 873 . 1 1 72 72 VAL HG11 H 1 0.860 0.01 . 2 . . . . 635 VAL HG11 . 18530 1 874 . 1 1 72 72 VAL HG12 H 1 0.860 0.01 . 2 . . . . 635 VAL HG12 . 18530 1 875 . 1 1 72 72 VAL HG13 H 1 0.860 0.01 . 2 . . . . 635 VAL HG13 . 18530 1 876 . 1 1 72 72 VAL HG21 H 1 0.987 0.01 . 2 . . . . 635 VAL HG21 . 18530 1 877 . 1 1 72 72 VAL HG22 H 1 0.987 0.01 . 2 . . . . 635 VAL HG22 . 18530 1 878 . 1 1 72 72 VAL HG23 H 1 0.987 0.01 . 2 . . . . 635 VAL HG23 . 18530 1 879 . 1 1 72 72 VAL C C 13 175.210 0.1 . 1 . . . . 635 VAL C . 18530 1 880 . 1 1 72 72 VAL CA C 13 64.509 0.1 . 1 . . . . 635 VAL CA . 18530 1 881 . 1 1 72 72 VAL CB C 13 31.193 0.1 . 1 . . . . 635 VAL CB . 18530 1 882 . 1 1 72 72 VAL CG1 C 13 21.108 0.1 . 2 . . . . 635 VAL CG1 . 18530 1 883 . 1 1 72 72 VAL CG2 C 13 21.530 0.1 . 2 . . . . 635 VAL CG2 . 18530 1 884 . 1 1 72 72 VAL N N 15 118.518 0.1 . 1 . . . . 635 VAL N . 18530 1 885 . 1 1 73 73 LEU H H 1 8.096 0.01 . 1 . . . . 636 LEU H . 18530 1 886 . 1 1 73 73 LEU HA H 1 4.441 0.01 . 1 . . . . 636 LEU HA . 18530 1 887 . 1 1 73 73 LEU HB2 H 1 1.255 0.01 . 2 . . . . 636 LEU HB2 . 18530 1 888 . 1 1 73 73 LEU HB3 H 1 1.582 0.01 . 2 . . . . 636 LEU HB3 . 18530 1 889 . 1 1 73 73 LEU HG H 1 1.611 0.01 . 1 . . . . 636 LEU HG . 18530 1 890 . 1 1 73 73 LEU HD11 H 1 0.492 0.01 . 2 . . . . 636 LEU HD11 . 18530 1 891 . 1 1 73 73 LEU HD12 H 1 0.492 0.01 . 2 . . . . 636 LEU HD12 . 18530 1 892 . 1 1 73 73 LEU HD13 H 1 0.492 0.01 . 2 . . . . 636 LEU HD13 . 18530 1 893 . 1 1 73 73 LEU HD21 H 1 0.644 0.01 . 2 . . . . 636 LEU HD21 . 18530 1 894 . 1 1 73 73 LEU HD22 H 1 0.644 0.01 . 2 . . . . 636 LEU HD22 . 18530 1 895 . 1 1 73 73 LEU HD23 H 1 0.644 0.01 . 2 . . . . 636 LEU HD23 . 18530 1 896 . 1 1 73 73 LEU C C 13 174.182 0.1 . 1 . . . . 636 LEU C . 18530 1 897 . 1 1 73 73 LEU CA C 13 53.192 0.1 . 1 . . . . 636 LEU CA . 18530 1 898 . 1 1 73 73 LEU CB C 13 43.563 0.1 . 1 . . . . 636 LEU CB . 18530 1 899 . 1 1 73 73 LEU CG C 13 25.892 0.1 . 1 . . . . 636 LEU CG . 18530 1 900 . 1 1 73 73 LEU CD1 C 13 25.171 0.1 . 2 . . . . 636 LEU CD1 . 18530 1 901 . 1 1 73 73 LEU CD2 C 13 25.347 0.1 . 2 . . . . 636 LEU CD2 . 18530 1 902 . 1 1 73 73 LEU N N 15 129.039 0.1 . 1 . . . . 636 LEU N . 18530 1 903 . 1 1 74 74 MET H H 1 8.448 0.01 . 1 . . . . 637 MET H . 18530 1 904 . 1 1 74 74 MET HA H 1 4.318 0.01 . 1 . . . . 637 MET HA . 18530 1 905 . 1 1 74 74 MET HB2 H 1 2.154 0.01 . 2 . . . . 637 MET HB2 . 18530 1 906 . 1 1 74 74 MET HB3 H 1 2.153 0.01 . 2 . . . . 637 MET HB3 . 18530 1 907 . 1 1 74 74 MET HG2 H 1 2.661 0.01 . 2 . . . . 637 MET HG2 . 18530 1 908 . 1 1 74 74 MET HG3 H 1 2.720 0.01 . 2 . . . . 637 MET HG3 . 18530 1 909 . 1 1 74 74 MET HE1 H 1 2.134 0.01 . 1 . . . . 637 MET HE1 . 18530 1 910 . 1 1 74 74 MET HE2 H 1 2.134 0.01 . 1 . . . . 637 MET HE2 . 18530 1 911 . 1 1 74 74 MET HE3 H 1 2.134 0.01 . 1 . . . . 637 MET HE3 . 18530 1 912 . 1 1 74 74 MET C C 13 175.305 0.1 . 1 . . . . 637 MET C . 18530 1 913 . 1 1 74 74 MET CA C 13 55.206 0.1 . 1 . . . . 637 MET CA . 18530 1 914 . 1 1 74 74 MET CB C 13 33.018 0.1 . 1 . . . . 637 MET CB . 18530 1 915 . 1 1 74 74 MET CG C 13 32.662 0.1 . 1 . . . . 637 MET CG . 18530 1 916 . 1 1 74 74 MET CE C 13 17.527 0.1 . 1 . . . . 637 MET CE . 18530 1 917 . 1 1 74 74 MET N N 15 120.060 0.1 . 1 . . . . 637 MET N . 18530 1 918 . 1 1 75 75 ASP H H 1 8.311 0.01 . 1 . . . . 638 ASP H . 18530 1 919 . 1 1 75 75 ASP HA H 1 4.260 0.01 . 1 . . . . 638 ASP HA . 18530 1 920 . 1 1 75 75 ASP HB2 H 1 2.558 0.01 . 2 . . . . 638 ASP HB2 . 18530 1 921 . 1 1 75 75 ASP HB3 H 1 2.558 0.01 . 2 . . . . 638 ASP HB3 . 18530 1 922 . 1 1 75 75 ASP C C 13 174.694 0.1 . 1 . . . . 638 ASP C . 18530 1 923 . 1 1 75 75 ASP CA C 13 56.237 0.1 . 1 . . . . 638 ASP CA . 18530 1 924 . 1 1 75 75 ASP CB C 13 40.888 0.1 . 1 . . . . 638 ASP CB . 18530 1 925 . 1 1 75 75 ASP N N 15 120.371 0.1 . 1 . . . . 638 ASP N . 18530 1 926 . 1 1 76 76 GLY H H 1 8.480 0.01 . 1 . . . . 639 GLY H . 18530 1 927 . 1 1 76 76 GLY HA2 H 1 3.528 0.01 . 2 . . . . 639 GLY HA2 . 18530 1 928 . 1 1 76 76 GLY HA3 H 1 4.176 0.01 . 2 . . . . 639 GLY HA3 . 18530 1 929 . 1 1 76 76 GLY C C 13 177.011 0.1 . 1 . . . . 639 GLY C . 18530 1 930 . 1 1 76 76 GLY CA C 13 45.388 0.1 . 1 . . . . 639 GLY CA . 18530 1 931 . 1 1 76 76 GLY N N 15 111.405 0.1 . 1 . . . . 639 GLY N . 18530 1 932 . 1 1 77 77 ILE H H 1 7.349 0.01 . 1 . . . . 640 ILE H . 18530 1 933 . 1 1 77 77 ILE HA H 1 4.315 0.01 . 1 . . . . 640 ILE HA . 18530 1 934 . 1 1 77 77 ILE HB H 1 1.992 0.01 . 1 . . . . 640 ILE HB . 18530 1 935 . 1 1 77 77 ILE HG12 H 1 1.153 0.01 . 2 . . . . 640 ILE HG12 . 18530 1 936 . 1 1 77 77 ILE HG13 H 1 1.362 0.01 . 2 . . . . 640 ILE HG13 . 18530 1 937 . 1 1 77 77 ILE HG21 H 1 0.654 0.01 . 1 . . . . 640 ILE HG21 . 18530 1 938 . 1 1 77 77 ILE HG22 H 1 0.654 0.01 . 1 . . . . 640 ILE HG22 . 18530 1 939 . 1 1 77 77 ILE HG23 H 1 0.654 0.01 . 1 . . . . 640 ILE HG23 . 18530 1 940 . 1 1 77 77 ILE HD11 H 1 0.452 0.01 . 1 . . . . 640 ILE HD11 . 18530 1 941 . 1 1 77 77 ILE HD12 H 1 0.452 0.01 . 1 . . . . 640 ILE HD12 . 18530 1 942 . 1 1 77 77 ILE HD13 H 1 0.452 0.01 . 1 . . . . 640 ILE HD13 . 18530 1 943 . 1 1 77 77 ILE C C 13 174.900 0.1 . 1 . . . . 640 ILE C . 18530 1 944 . 1 1 77 77 ILE CA C 13 60.115 0.1 . 1 . . . . 640 ILE CA . 18530 1 945 . 1 1 77 77 ILE CB C 13 35.812 0.1 . 1 . . . . 640 ILE CB . 18530 1 946 . 1 1 77 77 ILE CG1 C 13 27.158 0.1 . 1 . . . . 640 ILE CG1 . 18530 1 947 . 1 1 77 77 ILE CG2 C 13 17.918 0.1 . 1 . . . . 640 ILE CG2 . 18530 1 948 . 1 1 77 77 ILE CD1 C 13 12.173 0.1 . 1 . . . . 640 ILE CD1 . 18530 1 949 . 1 1 77 77 ILE N N 15 121.066 0.1 . 1 . . . . 640 ILE N . 18530 1 950 . 1 1 78 78 GLN H H 1 9.013 0.01 . 1 . . . . 641 GLN H . 18530 1 951 . 1 1 78 78 GLN HA H 1 4.470 0.01 . 1 . . . . 641 GLN HA . 18530 1 952 . 1 1 78 78 GLN HB2 H 1 1.799 0.01 . 2 . . . . 641 GLN HB2 . 18530 1 953 . 1 1 78 78 GLN HB3 H 1 1.847 0.01 . 2 . . . . 641 GLN HB3 . 18530 1 954 . 1 1 78 78 GLN HG2 H 1 2.168 0.01 . 2 . . . . 641 GLN HG2 . 18530 1 955 . 1 1 78 78 GLN HG3 H 1 2.191 0.01 . 2 . . . . 641 GLN HG3 . 18530 1 956 . 1 1 78 78 GLN HE21 H 1 6.823 0.01 . 1 . . . . 641 GLN HE21 . 18530 1 957 . 1 1 78 78 GLN HE22 H 1 7.233 0.01 . 1 . . . . 641 GLN HE22 . 18530 1 958 . 1 1 78 78 GLN C C 13 176.799 0.1 . 1 . . . . 641 GLN C . 18530 1 959 . 1 1 78 78 GLN CA C 13 53.788 0.1 . 1 . . . . 641 GLN CA . 18530 1 960 . 1 1 78 78 GLN CB C 13 30.778 0.1 . 1 . . . . 641 GLN CB . 18530 1 961 . 1 1 78 78 GLN CG C 13 33.465 0.1 . 1 . . . . 641 GLN CG . 18530 1 962 . 1 1 78 78 GLN CD C 13 177.712 0.1 . 1 . . . . 641 GLN CD . 18530 1 963 . 1 1 78 78 GLN N N 15 127.268 0.1 . 1 . . . . 641 GLN N . 18530 1 964 . 1 1 78 78 GLN NE2 N 15 112.317 0.1 . 1 . . . . 641 GLN NE2 . 18530 1 965 . 1 1 79 79 SER H H 1 8.172 0.01 . 1 . . . . 642 SER H . 18530 1 966 . 1 1 79 79 SER HA H 1 4.797 0.01 . 1 . . . . 642 SER HA . 18530 1 967 . 1 1 79 79 SER HB2 H 1 3.296 0.01 . 2 . . . . 642 SER HB2 . 18530 1 968 . 1 1 79 79 SER HB3 H 1 3.410 0.01 . 2 . . . . 642 SER HB3 . 18530 1 969 . 1 1 79 79 SER C C 13 177.644 0.1 . 1 . . . . 642 SER C . 18530 1 970 . 1 1 79 79 SER CA C 13 57.456 0.1 . 1 . . . . 642 SER CA . 18530 1 971 . 1 1 79 79 SER CB C 13 65.382 0.1 . 1 . . . . 642 SER CB . 18530 1 972 . 1 1 79 79 SER N N 15 117.110 0.1 . 1 . . . . 642 SER N . 18530 1 973 . 1 1 80 80 HIS H H 1 8.811 0.01 . 1 . . . . 643 HIS H . 18530 1 974 . 1 1 80 80 HIS HA H 1 4.965 0.01 . 1 . . . . 643 HIS HA . 18530 1 975 . 1 1 80 80 HIS HB2 H 1 2.931 0.01 . 2 . . . . 643 HIS HB2 . 18530 1 976 . 1 1 80 80 HIS HB3 H 1 3.251 0.01 . 2 . . . . 643 HIS HB3 . 18530 1 977 . 1 1 80 80 HIS HD2 H 1 6.862 0.01 . 1 . . . . 643 HIS HD2 . 18530 1 978 . 1 1 80 80 HIS HE1 H 1 8.071 0.01 . 1 . . . . 643 HIS HE1 . 18530 1 979 . 1 1 80 80 HIS C C 13 178.362 0.1 . 1 . . . . 643 HIS C . 18530 1 980 . 1 1 80 80 HIS CA C 13 52.800 0.1 . 1 . . . . 643 HIS CA . 18530 1 981 . 1 1 80 80 HIS CB C 13 31.211 0.1 . 1 . . . . 643 HIS CB . 18530 1 982 . 1 1 80 80 HIS CD2 C 13 121.091 0.1 . 1 . . . . 643 HIS CD2 . 18530 1 983 . 1 1 80 80 HIS CE1 C 13 136.982 0.1 . 1 . . . . 643 HIS CE1 . 18530 1 984 . 1 1 80 80 HIS N N 15 118.806 0.1 . 1 . . . . 643 HIS N . 18530 1 985 . 1 1 81 81 PRO HA H 1 4.819 0.01 . 1 . . . . 644 PRO HA . 18530 1 986 . 1 1 81 81 PRO HB2 H 1 1.959 0.01 . 2 . . . . 644 PRO HB2 . 18530 1 987 . 1 1 81 81 PRO HB3 H 1 2.399 0.01 . 2 . . . . 644 PRO HB3 . 18530 1 988 . 1 1 81 81 PRO HG2 H 1 2.232 0.01 . 2 . . . . 644 PRO HG2 . 18530 1 989 . 1 1 81 81 PRO HG3 H 1 2.055 0.01 . 2 . . . . 644 PRO HG3 . 18530 1 990 . 1 1 81 81 PRO HD2 H 1 3.718 0.01 . 2 . . . . 644 PRO HD2 . 18530 1 991 . 1 1 81 81 PRO HD3 H 1 4.189 0.01 . 2 . . . . 644 PRO HD3 . 18530 1 992 . 1 1 81 81 PRO C C 13 175.840 0.1 . 1 . . . . 644 PRO C . 18530 1 993 . 1 1 81 81 PRO CA C 13 63.307 0.1 . 1 . . . . 644 PRO CA . 18530 1 994 . 1 1 81 81 PRO CB C 13 34.502 0.1 . 1 . . . . 644 PRO CB . 18530 1 995 . 1 1 81 81 PRO CG C 13 25.332 0.1 . 1 . . . . 644 PRO CG . 18530 1 996 . 1 1 81 81 PRO CD C 13 50.300 0.1 . 1 . . . . 644 PRO CD . 18530 1 997 . 1 1 82 82 GLN H H 1 8.986 0.01 . 1 . . . . 645 GLN H . 18530 1 998 . 1 1 82 82 GLN HA H 1 4.198 0.01 . 1 . . . . 645 GLN HA . 18530 1 999 . 1 1 82 82 GLN HB2 H 1 1.993 0.01 . 1 . . . . 645 GLN HB2 . 18530 1 1000 . 1 1 82 82 GLN HB3 H 1 1.993 0.01 . 1 . . . . 645 GLN HB3 . 18530 1 1001 . 1 1 82 82 GLN HG2 H 1 2.143 0.01 . 2 . . . . 645 GLN HG2 . 18530 1 1002 . 1 1 82 82 GLN HG3 H 1 2.143 0.01 . 2 . . . . 645 GLN HG3 . 18530 1 1003 . 1 1 82 82 GLN HE21 H 1 6.756 0.01 . 1 . . . . 645 GLN HE21 . 18530 1 1004 . 1 1 82 82 GLN HE22 H 1 7.438 0.01 . 1 . . . . 645 GLN HE22 . 18530 1 1005 . 1 1 82 82 GLN C C 13 177.395 0.1 . 1 . . . . 645 GLN C . 18530 1 1006 . 1 1 82 82 GLN CA C 13 56.198 0.1 . 1 . . . . 645 GLN CA . 18530 1 1007 . 1 1 82 82 GLN CB C 13 28.686 0.1 . 1 . . . . 645 GLN CB . 18530 1 1008 . 1 1 82 82 GLN CG C 13 33.734 0.1 . 1 . . . . 645 GLN CG . 18530 1 1009 . 1 1 82 82 GLN CD C 13 178.008 0.1 . 1 . . . . 645 GLN CD . 18530 1 1010 . 1 1 82 82 GLN N N 15 123.721 0.1 . 1 . . . . 645 GLN N . 18530 1 1011 . 1 1 82 82 GLN NE2 N 15 112.283 0.1 . 1 . . . . 645 GLN NE2 . 18530 1 1012 . 1 1 83 83 LYS H H 1 8.062 0.01 . 1 . . . . 646 LYS H . 18530 1 1013 . 1 1 83 83 LYS HA H 1 4.667 0.01 . 1 . . . . 646 LYS HA . 18530 1 1014 . 1 1 83 83 LYS HB2 H 1 0.644 0.01 . 2 . . . . 646 LYS HB2 . 18530 1 1015 . 1 1 83 83 LYS HB3 H 1 1.429 0.01 . 2 . . . . 646 LYS HB3 . 18530 1 1016 . 1 1 83 83 LYS HG2 H 1 0.768 0.01 . 2 . . . . 646 LYS HG2 . 18530 1 1017 . 1 1 83 83 LYS HG3 H 1 1.138 0.01 . 2 . . . . 646 LYS HG3 . 18530 1 1018 . 1 1 83 83 LYS HD2 H 1 1.428 0.01 . 2 . . . . 646 LYS HD2 . 18530 1 1019 . 1 1 83 83 LYS HD3 H 1 1.484 0.01 . 2 . . . . 646 LYS HD3 . 18530 1 1020 . 1 1 83 83 LYS HE2 H 1 2.638 0.01 . 2 . . . . 646 LYS HE2 . 18530 1 1021 . 1 1 83 83 LYS HE3 H 1 2.750 0.01 . 2 . . . . 646 LYS HE3 . 18530 1 1022 . 1 1 83 83 LYS C C 13 177.178 0.1 . 1 . . . . 646 LYS C . 18530 1 1023 . 1 1 83 83 LYS CA C 13 53.752 0.1 . 1 . . . . 646 LYS CA . 18530 1 1024 . 1 1 83 83 LYS CB C 13 34.553 0.1 . 1 . . . . 646 LYS CB . 18530 1 1025 . 1 1 83 83 LYS CG C 13 24.555 0.1 . 1 . . . . 646 LYS CG . 18530 1 1026 . 1 1 83 83 LYS CD C 13 29.685 0.1 . 1 . . . . 646 LYS CD . 18530 1 1027 . 1 1 83 83 LYS CE C 13 41.405 0.1 . 1 . . . . 646 LYS CE . 18530 1 1028 . 1 1 83 83 LYS N N 15 126.403 0.1 . 1 . . . . 646 LYS N . 18530 1 1029 . 1 1 84 84 PRO HA H 1 4.238 0.01 . 1 . . . . 647 PRO HA . 18530 1 1030 . 1 1 84 84 PRO HB2 H 1 1.780 0.01 . 2 . . . . 647 PRO HB2 . 18530 1 1031 . 1 1 84 84 PRO HB3 H 1 2.264 0.01 . 2 . . . . 647 PRO HB3 . 18530 1 1032 . 1 1 84 84 PRO HG2 H 1 1.987 0.01 . 2 . . . . 647 PRO HG2 . 18530 1 1033 . 1 1 84 84 PRO HG3 H 1 1.923 0.01 . 2 . . . . 647 PRO HG3 . 18530 1 1034 . 1 1 84 84 PRO HD2 H 1 3.587 0.01 . 2 . . . . 647 PRO HD2 . 18530 1 1035 . 1 1 84 84 PRO HD3 H 1 3.587 0.01 . 2 . . . . 647 PRO HD3 . 18530 1 1036 . 1 1 84 84 PRO C C 13 174.372 0.1 . 1 . . . . 647 PRO C . 18530 1 1037 . 1 1 84 84 PRO CA C 13 64.357 0.1 . 1 . . . . 647 PRO CA . 18530 1 1038 . 1 1 84 84 PRO CB C 13 32.177 0.1 . 1 . . . . 647 PRO CB . 18530 1 1039 . 1 1 84 84 PRO CG C 13 27.276 0.1 . 1 . . . . 647 PRO CG . 18530 1 1040 . 1 1 84 84 PRO CD C 13 50.247 0.1 . 1 . . . . 647 PRO CD . 18530 1 1041 . 1 1 85 85 PHE H H 1 6.603 0.01 . 1 . . . . 648 PHE H . 18530 1 1042 . 1 1 85 85 PHE HA H 1 5.088 0.01 . 1 . . . . 648 PHE HA . 18530 1 1043 . 1 1 85 85 PHE HB2 H 1 2.766 0.01 . 2 . . . . 648 PHE HB2 . 18530 1 1044 . 1 1 85 85 PHE HB3 H 1 3.026 0.01 . 2 . . . . 648 PHE HB3 . 18530 1 1045 . 1 1 85 85 PHE HD1 H 1 6.871 0.01 . 3 . . . . 648 PHE HD1 . 18530 1 1046 . 1 1 85 85 PHE HD2 H 1 6.871 0.01 . 3 . . . . 648 PHE HD2 . 18530 1 1047 . 1 1 85 85 PHE HE1 H 1 7.250 0.01 . 3 . . . . 648 PHE HE1 . 18530 1 1048 . 1 1 85 85 PHE HE2 H 1 7.250 0.01 . 3 . . . . 648 PHE HE2 . 18530 1 1049 . 1 1 85 85 PHE HZ H 1 7.272 0.01 . 1 . . . . 648 PHE HZ . 18530 1 1050 . 1 1 85 85 PHE C C 13 178.508 0.1 . 1 . . . . 648 PHE C . 18530 1 1051 . 1 1 85 85 PHE CA C 13 56.305 0.1 . 1 . . . . 648 PHE CA . 18530 1 1052 . 1 1 85 85 PHE CB C 13 40.657 0.1 . 1 . . . . 648 PHE CB . 18530 1 1053 . 1 1 85 85 PHE CD1 C 13 131.915 0.1 . 3 . . . . 648 PHE CD1 . 18530 1 1054 . 1 1 85 85 PHE CD2 C 13 131.915 0.1 . 3 . . . . 648 PHE CD2 . 18530 1 1055 . 1 1 85 85 PHE CE1 C 13 131.329 0.1 . 3 . . . . 648 PHE CE1 . 18530 1 1056 . 1 1 85 85 PHE CE2 C 13 131.329 0.1 . 3 . . . . 648 PHE CE2 . 18530 1 1057 . 1 1 85 85 PHE CZ C 13 130.276 0.1 . 1 . . . . 648 PHE CZ . 18530 1 1058 . 1 1 85 85 PHE N N 15 110.023 0.1 . 1 . . . . 648 PHE N . 18530 1 1059 . 1 1 86 86 TYR H H 1 9.098 0.01 . 1 . . . . 649 TYR H . 18530 1 1060 . 1 1 86 86 TYR HA H 1 4.638 0.01 . 1 . . . . 649 TYR HA . 18530 1 1061 . 1 1 86 86 TYR HB2 H 1 2.552 0.01 . 2 . . . . 649 TYR HB2 . 18530 1 1062 . 1 1 86 86 TYR HB3 H 1 2.865 0.01 . 2 . . . . 649 TYR HB3 . 18530 1 1063 . 1 1 86 86 TYR HD1 H 1 7.061 0.01 . 3 . . . . 649 TYR HD1 . 18530 1 1064 . 1 1 86 86 TYR HD2 H 1 7.061 0.01 . 3 . . . . 649 TYR HD2 . 18530 1 1065 . 1 1 86 86 TYR C C 13 176.979 0.1 . 1 . . . . 649 TYR C . 18530 1 1066 . 1 1 86 86 TYR CA C 13 56.616 0.1 . 1 . . . . 649 TYR CA . 18530 1 1067 . 1 1 86 86 TYR CB C 13 41.410 0.1 . 1 . . . . 649 TYR CB . 18530 1 1068 . 1 1 86 86 TYR CD1 C 13 132.820 0.1 . 3 . . . . 649 TYR CD1 . 18530 1 1069 . 1 1 86 86 TYR CD2 C 13 132.820 0.1 . 3 . . . . 649 TYR CD2 . 18530 1 1070 . 1 1 86 86 TYR N N 15 119.825 0.1 . 1 . . . . 649 TYR N . 18530 1 1071 . 1 1 87 87 THR H H 1 9.190 0.01 . 1 . . . . 650 THR H . 18530 1 1072 . 1 1 87 87 THR HA H 1 4.507 0.01 . 1 . . . . 650 THR HA . 18530 1 1073 . 1 1 87 87 THR HB H 1 4.361 0.01 . 1 . . . . 650 THR HB . 18530 1 1074 . 1 1 87 87 THR HG21 H 1 1.346 0.01 . 1 . . . . 650 THR HG21 . 18530 1 1075 . 1 1 87 87 THR HG22 H 1 1.346 0.01 . 1 . . . . 650 THR HG22 . 18530 1 1076 . 1 1 87 87 THR HG23 H 1 1.346 0.01 . 1 . . . . 650 THR HG23 . 18530 1 1077 . 1 1 87 87 THR C C 13 176.638 0.1 . 1 . . . . 650 THR C . 18530 1 1078 . 1 1 87 87 THR CA C 13 61.231 0.1 . 1 . . . . 650 THR CA . 18530 1 1079 . 1 1 87 87 THR CB C 13 70.637 0.1 . 1 . . . . 650 THR CB . 18530 1 1080 . 1 1 87 87 THR CG2 C 13 22.031 0.1 . 1 . . . . 650 THR CG2 . 18530 1 1081 . 1 1 87 87 THR N N 15 115.785 0.1 . 1 . . . . 650 THR N . 18530 1 1082 . 1 1 88 88 VAL H H 1 8.111 0.01 . 1 . . . . 651 VAL H . 18530 1 1083 . 1 1 88 88 VAL HA H 1 3.265 0.01 . 1 . . . . 651 VAL HA . 18530 1 1084 . 1 1 88 88 VAL HB H 1 1.797 0.01 . 1 . . . . 651 VAL HB . 18530 1 1085 . 1 1 88 88 VAL HG11 H 1 0.754 0.01 . 2 . . . . 651 VAL HG11 . 18530 1 1086 . 1 1 88 88 VAL HG12 H 1 0.754 0.01 . 2 . . . . 651 VAL HG12 . 18530 1 1087 . 1 1 88 88 VAL HG13 H 1 0.754 0.01 . 2 . . . . 651 VAL HG13 . 18530 1 1088 . 1 1 88 88 VAL HG21 H 1 0.893 0.01 . 2 . . . . 651 VAL HG21 . 18530 1 1089 . 1 1 88 88 VAL HG22 H 1 0.893 0.01 . 2 . . . . 651 VAL HG22 . 18530 1 1090 . 1 1 88 88 VAL HG23 H 1 0.893 0.01 . 2 . . . . 651 VAL HG23 . 18530 1 1091 . 1 1 88 88 VAL C C 13 173.050 0.1 . 1 . . . . 651 VAL C . 18530 1 1092 . 1 1 88 88 VAL CA C 13 65.488 0.1 . 1 . . . . 651 VAL CA . 18530 1 1093 . 1 1 88 88 VAL CB C 13 31.231 0.1 . 1 . . . . 651 VAL CB . 18530 1 1094 . 1 1 88 88 VAL CG1 C 13 20.756 0.1 . 2 . . . . 651 VAL CG1 . 18530 1 1095 . 1 1 88 88 VAL CG2 C 13 22.482 0.1 . 2 . . . . 651 VAL CG2 . 18530 1 1096 . 1 1 88 88 VAL N N 15 120.517 0.1 . 1 . . . . 651 VAL N . 18530 1 1097 . 1 1 89 89 GLY H H 1 9.217 0.01 . 1 . . . . 652 GLY H . 18530 1 1098 . 1 1 89 89 GLY HA2 H 1 3.556 0.01 . 2 . . . . 652 GLY HA2 . 18530 1 1099 . 1 1 89 89 GLY HA3 H 1 4.441 0.01 . 2 . . . . 652 GLY HA3 . 18530 1 1100 . 1 1 89 89 GLY C C 13 176.852 0.1 . 1 . . . . 652 GLY C . 18530 1 1101 . 1 1 89 89 GLY CA C 13 44.426 0.1 . 1 . . . . 652 GLY CA . 18530 1 1102 . 1 1 89 89 GLY N N 15 116.819 0.1 . 1 . . . . 652 GLY N . 18530 1 1103 . 1 1 90 90 GLU H H 1 8.318 0.01 . 1 . . . . 653 GLU H . 18530 1 1104 . 1 1 90 90 GLU HA H 1 4.321 0.01 . 1 . . . . 653 GLU HA . 18530 1 1105 . 1 1 90 90 GLU HB2 H 1 2.305 0.01 . 2 . . . . 653 GLU HB2 . 18530 1 1106 . 1 1 90 90 GLU HB3 H 1 2.404 0.01 . 2 . . . . 653 GLU HB3 . 18530 1 1107 . 1 1 90 90 GLU HG2 H 1 2.343 0.01 . 2 . . . . 653 GLU HG2 . 18530 1 1108 . 1 1 90 90 GLU HG3 H 1 2.650 0.01 . 2 . . . . 653 GLU HG3 . 18530 1 1109 . 1 1 90 90 GLU C C 13 176.590 0.1 . 1 . . . . 653 GLU C . 18530 1 1110 . 1 1 90 90 GLU CA C 13 58.481 0.1 . 1 . . . . 653 GLU CA . 18530 1 1111 . 1 1 90 90 GLU CB C 13 31.928 0.1 . 1 . . . . 653 GLU CB . 18530 1 1112 . 1 1 90 90 GLU CG C 13 38.456 0.1 . 1 . . . . 653 GLU CG . 18530 1 1113 . 1 1 90 90 GLU N N 15 121.072 0.1 . 1 . . . . 653 GLU N . 18530 1 1114 . 1 1 91 91 LYS H H 1 8.235 0.01 . 1 . . . . 654 LYS H . 18530 1 1115 . 1 1 91 91 LYS HA H 1 5.716 0.01 . 1 . . . . 654 LYS HA . 18530 1 1116 . 1 1 91 91 LYS HB2 H 1 1.715 0.01 . 2 . . . . 654 LYS HB2 . 18530 1 1117 . 1 1 91 91 LYS HB3 H 1 1.821 0.01 . 2 . . . . 654 LYS HB3 . 18530 1 1118 . 1 1 91 91 LYS HG2 H 1 1.342 0.01 . 2 . . . . 654 LYS HG2 . 18530 1 1119 . 1 1 91 91 LYS HG3 H 1 1.489 0.01 . 2 . . . . 654 LYS HG3 . 18530 1 1120 . 1 1 91 91 LYS HD2 H 1 1.647 0.01 . 2 . . . . 654 LYS HD2 . 18530 1 1121 . 1 1 91 91 LYS HD3 H 1 1.647 0.01 . 2 . . . . 654 LYS HD3 . 18530 1 1122 . 1 1 91 91 LYS HE2 H 1 2.893 0.01 . 2 . . . . 654 LYS HE2 . 18530 1 1123 . 1 1 91 91 LYS HE3 H 1 2.893 0.01 . 2 . . . . 654 LYS HE3 . 18530 1 1124 . 1 1 91 91 LYS C C 13 174.833 0.1 . 1 . . . . 654 LYS C . 18530 1 1125 . 1 1 91 91 LYS CA C 13 54.419 0.1 . 1 . . . . 654 LYS CA . 18530 1 1126 . 1 1 91 91 LYS CB C 13 35.992 0.1 . 1 . . . . 654 LYS CB . 18530 1 1127 . 1 1 91 91 LYS CG C 13 25.295 0.1 . 1 . . . . 654 LYS CG . 18530 1 1128 . 1 1 91 91 LYS CD C 13 29.457 0.1 . 1 . . . . 654 LYS CD . 18530 1 1129 . 1 1 91 91 LYS CE C 13 41.802 0.1 . 1 . . . . 654 LYS CE . 18530 1 1130 . 1 1 91 91 LYS N N 15 120.639 0.1 . 1 . . . . 654 LYS N . 18530 1 1131 . 1 1 92 92 VAL H H 1 9.014 0.01 . 1 . . . . 655 VAL H . 18530 1 1132 . 1 1 92 92 VAL HA H 1 4.821 0.01 . 1 . . . . 655 VAL HA . 18530 1 1133 . 1 1 92 92 VAL HB H 1 1.371 0.01 . 1 . . . . 655 VAL HB . 18530 1 1134 . 1 1 92 92 VAL HG11 H 1 0.239 0.01 . 2 . . . . 655 VAL HG11 . 18530 1 1135 . 1 1 92 92 VAL HG12 H 1 0.239 0.01 . 2 . . . . 655 VAL HG12 . 18530 1 1136 . 1 1 92 92 VAL HG13 H 1 0.239 0.01 . 2 . . . . 655 VAL HG13 . 18530 1 1137 . 1 1 92 92 VAL HG21 H 1 0.556 0.01 . 2 . . . . 655 VAL HG21 . 18530 1 1138 . 1 1 92 92 VAL HG22 H 1 0.556 0.01 . 2 . . . . 655 VAL HG22 . 18530 1 1139 . 1 1 92 92 VAL HG23 H 1 0.556 0.01 . 2 . . . . 655 VAL HG23 . 18530 1 1140 . 1 1 92 92 VAL C C 13 176.870 0.1 . 1 . . . . 655 VAL C . 18530 1 1141 . 1 1 92 92 VAL CA C 13 60.066 0.1 . 1 . . . . 655 VAL CA . 18530 1 1142 . 1 1 92 92 VAL CB C 13 36.007 0.1 . 1 . . . . 655 VAL CB . 18530 1 1143 . 1 1 92 92 VAL CG1 C 13 21.692 0.1 . 2 . . . . 655 VAL CG1 . 18530 1 1144 . 1 1 92 92 VAL CG2 C 13 23.498 0.1 . 2 . . . . 655 VAL CG2 . 18530 1 1145 . 1 1 92 92 VAL N N 15 123.596 0.1 . 1 . . . . 655 VAL N . 18530 1 1146 . 1 1 93 93 THR H H 1 8.698 0.01 . 1 . . . . 656 THR H . 18530 1 1147 . 1 1 93 93 THR HA H 1 5.692 0.01 . 1 . . . . 656 THR HA . 18530 1 1148 . 1 1 93 93 THR HB H 1 4.325 0.01 . 1 . . . . 656 THR HB . 18530 1 1149 . 1 1 93 93 THR HG21 H 1 1.257 0.01 . 1 . . . . 656 THR HG21 . 18530 1 1150 . 1 1 93 93 THR HG22 H 1 1.257 0.01 . 1 . . . . 656 THR HG22 . 18530 1 1151 . 1 1 93 93 THR HG23 H 1 1.257 0.01 . 1 . . . . 656 THR HG23 . 18530 1 1152 . 1 1 93 93 THR C C 13 176.649 0.1 . 1 . . . . 656 THR C . 18530 1 1153 . 1 1 93 93 THR CA C 13 59.904 0.1 . 1 . . . . 656 THR CA . 18530 1 1154 . 1 1 93 93 THR CB C 13 71.446 0.1 . 1 . . . . 656 THR CB . 18530 1 1155 . 1 1 93 93 THR CG2 C 13 21.469 0.1 . 1 . . . . 656 THR CG2 . 18530 1 1156 . 1 1 93 93 THR N N 15 117.961 0.1 . 1 . . . . 656 THR N . 18530 1 1157 . 1 1 94 94 VAL H H 1 8.527 0.01 . 1 . . . . 657 VAL H . 18530 1 1158 . 1 1 94 94 VAL HA H 1 5.766 0.01 . 1 . . . . 657 VAL HA . 18530 1 1159 . 1 1 94 94 VAL HB H 1 2.105 0.01 . 1 . . . . 657 VAL HB . 18530 1 1160 . 1 1 94 94 VAL HG11 H 1 0.577 0.01 . 2 . . . . 657 VAL HG11 . 18530 1 1161 . 1 1 94 94 VAL HG12 H 1 0.577 0.01 . 2 . . . . 657 VAL HG12 . 18530 1 1162 . 1 1 94 94 VAL HG13 H 1 0.577 0.01 . 2 . . . . 657 VAL HG13 . 18530 1 1163 . 1 1 94 94 VAL HG21 H 1 0.894 0.01 . 2 . . . . 657 VAL HG21 . 18530 1 1164 . 1 1 94 94 VAL HG22 H 1 0.894 0.01 . 2 . . . . 657 VAL HG22 . 18530 1 1165 . 1 1 94 94 VAL HG23 H 1 0.894 0.01 . 2 . . . . 657 VAL HG23 . 18530 1 1166 . 1 1 94 94 VAL C C 13 176.421 0.1 . 1 . . . . 657 VAL C . 18530 1 1167 . 1 1 94 94 VAL CA C 13 58.306 0.1 . 1 . . . . 657 VAL CA . 18530 1 1168 . 1 1 94 94 VAL CB C 13 35.551 0.1 . 1 . . . . 657 VAL CB . 18530 1 1169 . 1 1 94 94 VAL CG1 C 13 21.355 0.1 . 2 . . . . 657 VAL CG1 . 18530 1 1170 . 1 1 94 94 VAL CG2 C 13 20.245 0.1 . 2 . . . . 657 VAL CG2 . 18530 1 1171 . 1 1 94 94 VAL N N 15 113.761 0.1 . 1 . . . . 657 VAL N . 18530 1 1172 . 1 1 95 95 SER H H 1 8.775 0.01 . 1 . . . . 658 SER H . 18530 1 1173 . 1 1 95 95 SER HA H 1 4.609 0.01 . 1 . . . . 658 SER HA . 18530 1 1174 . 1 1 95 95 SER HB2 H 1 3.827 0.01 . 2 . . . . 658 SER HB2 . 18530 1 1175 . 1 1 95 95 SER HB3 H 1 4.103 0.01 . 2 . . . . 658 SER HB3 . 18530 1 1176 . 1 1 95 95 SER C C 13 178.957 0.1 . 1 . . . . 658 SER C . 18530 1 1177 . 1 1 95 95 SER CA C 13 56.967 0.1 . 1 . . . . 658 SER CA . 18530 1 1178 . 1 1 95 95 SER CB C 13 65.983 0.1 . 1 . . . . 658 SER CB . 18530 1 1179 . 1 1 95 95 SER N N 15 114.119 0.1 . 1 . . . . 658 SER N . 18530 1 1180 . 1 1 96 96 CYS H H 1 8.664 0.01 . 1 . . . . 659 CYS H . 18530 1 1181 . 1 1 96 96 CYS HA H 1 5.470 0.01 . 1 . . . . 659 CYS HA . 18530 1 1182 . 1 1 96 96 CYS HB2 H 1 2.653 0.01 . 2 . . . . 659 CYS HB2 . 18530 1 1183 . 1 1 96 96 CYS HB3 H 1 2.816 0.01 . 2 . . . . 659 CYS HB3 . 18530 1 1184 . 1 1 96 96 CYS C C 13 175.708 0.1 . 1 . . . . 659 CYS C . 18530 1 1185 . 1 1 96 96 CYS CA C 13 55.429 0.1 . 1 . . . . 659 CYS CA . 18530 1 1186 . 1 1 96 96 CYS CB C 13 46.251 0.1 . 1 . . . . 659 CYS CB . 18530 1 1187 . 1 1 96 96 CYS N N 15 115.628 0.1 . 1 . . . . 659 CYS N . 18530 1 1188 . 1 1 97 97 SER H H 1 8.915 0.01 . 1 . . . . 660 SER H . 18530 1 1189 . 1 1 97 97 SER HA H 1 4.530 0.01 . 1 . . . . 660 SER HA . 18530 1 1190 . 1 1 97 97 SER HB2 H 1 3.829 0.01 . 2 . . . . 660 SER HB2 . 18530 1 1191 . 1 1 97 97 SER HB3 H 1 3.962 0.01 . 2 . . . . 660 SER HB3 . 18530 1 1192 . 1 1 97 97 SER C C 13 176.310 0.1 . 1 . . . . 660 SER C . 18530 1 1193 . 1 1 97 97 SER CA C 13 57.671 0.1 . 1 . . . . 660 SER CA . 18530 1 1194 . 1 1 97 97 SER CB C 13 64.502 0.1 . 1 . . . . 660 SER CB . 18530 1 1195 . 1 1 97 97 SER N N 15 118.552 0.1 . 1 . . . . 660 SER N . 18530 1 1196 . 1 1 98 98 GLY H H 1 8.567 0.01 . 1 . . . . 661 GLY H . 18530 1 1197 . 1 1 98 98 GLY HA2 H 1 3.854 0.01 . 1 . . . . 661 GLY HA2 . 18530 1 1198 . 1 1 98 98 GLY HA3 H 1 3.854 0.01 . 1 . . . . 661 GLY HA3 . 18530 1 1199 . 1 1 98 98 GLY C C 13 175.844 0.1 . 1 . . . . 661 GLY C . 18530 1 1200 . 1 1 98 98 GLY CA C 13 47.028 0.1 . 1 . . . . 661 GLY CA . 18530 1 1201 . 1 1 98 98 GLY N N 15 105.809 0.1 . 1 . . . . 661 GLY N . 18530 1 1202 . 1 1 99 99 GLY H H 1 8.756 0.01 . 1 . . . . 662 GLY H . 18530 1 1203 . 1 1 99 99 GLY HA2 H 1 3.784 0.01 . 2 . . . . 662 GLY HA2 . 18530 1 1204 . 1 1 99 99 GLY HA3 H 1 4.071 0.01 . 2 . . . . 662 GLY HA3 . 18530 1 1205 . 1 1 99 99 GLY C C 13 176.394 0.1 . 1 . . . . 662 GLY C . 18530 1 1206 . 1 1 99 99 GLY CA C 13 45.249 0.1 . 1 . . . . 662 GLY CA . 18530 1 1207 . 1 1 99 99 GLY N N 15 109.367 0.1 . 1 . . . . 662 GLY N . 18530 1 1208 . 1 1 100 100 MET H H 1 7.315 0.01 . 1 . . . . 663 MET H . 18530 1 1209 . 1 1 100 100 MET HA H 1 4.457 0.01 . 1 . . . . 663 MET HA . 18530 1 1210 . 1 1 100 100 MET HB2 H 1 1.931 0.01 . 2 . . . . 663 MET HB2 . 18530 1 1211 . 1 1 100 100 MET HB3 H 1 2.108 0.01 . 2 . . . . 663 MET HB3 . 18530 1 1212 . 1 1 100 100 MET HG2 H 1 2.198 0.01 . 2 . . . . 663 MET HG2 . 18530 1 1213 . 1 1 100 100 MET HG3 H 1 2.599 0.01 . 2 . . . . 663 MET HG3 . 18530 1 1214 . 1 1 100 100 MET HE1 H 1 1.952 0.01 . 1 . . . . 663 MET HE1 . 18530 1 1215 . 1 1 100 100 MET HE2 H 1 1.952 0.01 . 1 . . . . 663 MET HE2 . 18530 1 1216 . 1 1 100 100 MET HE3 H 1 1.952 0.01 . 1 . . . . 663 MET HE3 . 18530 1 1217 . 1 1 100 100 MET C C 13 176.512 0.1 . 1 . . . . 663 MET C . 18530 1 1218 . 1 1 100 100 MET CA C 13 56.127 0.1 . 1 . . . . 663 MET CA . 18530 1 1219 . 1 1 100 100 MET CB C 13 35.734 0.1 . 1 . . . . 663 MET CB . 18530 1 1220 . 1 1 100 100 MET CG C 13 33.498 0.1 . 1 . . . . 663 MET CG . 18530 1 1221 . 1 1 100 100 MET CE C 13 17.896 0.1 . 1 . . . . 663 MET CE . 18530 1 1222 . 1 1 100 100 MET N N 15 117.964 0.1 . 1 . . . . 663 MET N . 18530 1 1223 . 1 1 101 101 SER H H 1 8.972 0.01 . 1 . . . . 664 SER H . 18530 1 1224 . 1 1 101 101 SER HA H 1 4.632 0.01 . 1 . . . . 664 SER HA . 18530 1 1225 . 1 1 101 101 SER HB2 H 1 3.615 0.01 . 2 . . . . 664 SER HB2 . 18530 1 1226 . 1 1 101 101 SER HB3 H 1 3.770 0.01 . 2 . . . . 664 SER HB3 . 18530 1 1227 . 1 1 101 101 SER C C 13 178.606 0.1 . 1 . . . . 664 SER C . 18530 1 1228 . 1 1 101 101 SER CA C 13 57.426 0.1 . 1 . . . . 664 SER CA . 18530 1 1229 . 1 1 101 101 SER CB C 13 64.985 0.1 . 1 . . . . 664 SER CB . 18530 1 1230 . 1 1 101 101 SER N N 15 115.458 0.1 . 1 . . . . 664 SER N . 18530 1 1231 . 1 1 102 102 LEU H H 1 8.436 0.01 . 1 . . . . 665 LEU H . 18530 1 1232 . 1 1 102 102 LEU HA H 1 4.782 0.01 . 1 . . . . 665 LEU HA . 18530 1 1233 . 1 1 102 102 LEU HB2 H 1 1.322 0.01 . 2 . . . . 665 LEU HB2 . 18530 1 1234 . 1 1 102 102 LEU HB3 H 1 1.717 0.01 . 2 . . . . 665 LEU HB3 . 18530 1 1235 . 1 1 102 102 LEU HG H 1 0.712 0.01 . 1 . . . . 665 LEU HG . 18530 1 1236 . 1 1 102 102 LEU HD11 H 1 0.703 0.01 . 2 . . . . 665 LEU HD11 . 18530 1 1237 . 1 1 102 102 LEU HD12 H 1 0.703 0.01 . 2 . . . . 665 LEU HD12 . 18530 1 1238 . 1 1 102 102 LEU HD13 H 1 0.703 0.01 . 2 . . . . 665 LEU HD13 . 18530 1 1239 . 1 1 102 102 LEU HD21 H 1 1.289 0.01 . 2 . . . . 665 LEU HD21 . 18530 1 1240 . 1 1 102 102 LEU HD22 H 1 1.289 0.01 . 2 . . . . 665 LEU HD22 . 18530 1 1241 . 1 1 102 102 LEU HD23 H 1 1.289 0.01 . 2 . . . . 665 LEU HD23 . 18530 1 1242 . 1 1 102 102 LEU C C 13 174.108 0.1 . 1 . . . . 665 LEU C . 18530 1 1243 . 1 1 102 102 LEU CA C 13 55.266 0.1 . 1 . . . . 665 LEU CA . 18530 1 1244 . 1 1 102 102 LEU CB C 13 43.236 0.1 . 1 . . . . 665 LEU CB . 18530 1 1245 . 1 1 102 102 LEU CG C 13 27.028 0.1 . 1 . . . . 665 LEU CG . 18530 1 1246 . 1 1 102 102 LEU CD1 C 13 24.098 0.1 . 2 . . . . 665 LEU CD1 . 18530 1 1247 . 1 1 102 102 LEU CD2 C 13 27.309 0.1 . 2 . . . . 665 LEU CD2 . 18530 1 1248 . 1 1 102 102 LEU N N 15 127.114 0.1 . 1 . . . . 665 LEU N . 18530 1 1249 . 1 1 103 103 GLU H H 1 9.252 0.01 . 1 . . . . 666 GLU H . 18530 1 1250 . 1 1 103 103 GLU HA H 1 4.556 0.01 . 1 . . . . 666 GLU HA . 18530 1 1251 . 1 1 103 103 GLU HB2 H 1 1.777 0.01 . 2 . . . . 666 GLU HB2 . 18530 1 1252 . 1 1 103 103 GLU HB3 H 1 1.939 0.01 . 2 . . . . 666 GLU HB3 . 18530 1 1253 . 1 1 103 103 GLU HG2 H 1 2.119 0.01 . 2 . . . . 666 GLU HG2 . 18530 1 1254 . 1 1 103 103 GLU HG3 H 1 2.154 0.01 . 2 . . . . 666 GLU HG3 . 18530 1 1255 . 1 1 103 103 GLU C C 13 176.207 0.1 . 1 . . . . 666 GLU C . 18530 1 1256 . 1 1 103 103 GLU CA C 13 55.540 0.1 . 1 . . . . 666 GLU CA . 18530 1 1257 . 1 1 103 103 GLU CB C 13 32.178 0.1 . 1 . . . . 666 GLU CB . 18530 1 1258 . 1 1 103 103 GLU CG C 13 36.541 0.1 . 1 . . . . 666 GLU CG . 18530 1 1259 . 1 1 103 103 GLU N N 15 129.856 0.1 . 1 . . . . 666 GLU N . 18530 1 1260 . 1 1 104 104 GLY H H 1 8.248 0.01 . 1 . . . . 667 GLY H . 18530 1 1261 . 1 1 104 104 GLY HA2 H 1 3.685 0.01 . 2 . . . . 667 GLY HA2 . 18530 1 1262 . 1 1 104 104 GLY HA3 H 1 4.818 0.01 . 2 . . . . 667 GLY HA3 . 18530 1 1263 . 1 1 104 104 GLY C C 13 173.497 0.1 . 1 . . . . 667 GLY C . 18530 1 1264 . 1 1 104 104 GLY CA C 13 43.585 0.1 . 1 . . . . 667 GLY CA . 18530 1 1265 . 1 1 104 104 GLY N N 15 111.254 0.1 . 1 . . . . 667 GLY N . 18530 1 1266 . 1 1 105 105 PRO HA H 1 4.251 0.01 . 1 . . . . 668 PRO HA . 18530 1 1267 . 1 1 105 105 PRO HB2 H 1 1.426 0.01 . 2 . . . . 668 PRO HB2 . 18530 1 1268 . 1 1 105 105 PRO HB3 H 1 2.113 0.01 . 2 . . . . 668 PRO HB3 . 18530 1 1269 . 1 1 105 105 PRO HG2 H 1 1.981 0.01 . 2 . . . . 668 PRO HG2 . 18530 1 1270 . 1 1 105 105 PRO HG3 H 1 1.981 0.01 . 2 . . . . 668 PRO HG3 . 18530 1 1271 . 1 1 105 105 PRO HD2 H 1 3.503 0.01 . 2 . . . . 668 PRO HD2 . 18530 1 1272 . 1 1 105 105 PRO HD3 H 1 3.503 0.01 . 2 . . . . 668 PRO HD3 . 18530 1 1273 . 1 1 105 105 PRO C C 13 177.527 0.1 . 1 . . . . 668 PRO C . 18530 1 1274 . 1 1 105 105 PRO CA C 13 62.538 0.1 . 1 . . . . 668 PRO CA . 18530 1 1275 . 1 1 105 105 PRO CB C 13 31.720 0.1 . 1 . . . . 668 PRO CB . 18530 1 1276 . 1 1 105 105 PRO CG C 13 27.292 0.1 . 1 . . . . 668 PRO CG . 18530 1 1277 . 1 1 105 105 PRO CD C 13 49.298 0.1 . 1 . . . . 668 PRO CD . 18530 1 1278 . 1 1 106 106 SER H H 1 7.775 0.01 . 1 . . . . 669 SER H . 18530 1 1279 . 1 1 106 106 SER HA H 1 4.601 0.01 . 1 . . . . 669 SER HA . 18530 1 1280 . 1 1 106 106 SER HB2 H 1 3.602 0.01 . 2 . . . . 669 SER HB2 . 18530 1 1281 . 1 1 106 106 SER HB3 H 1 4.189 0.01 . 2 . . . . 669 SER HB3 . 18530 1 1282 . 1 1 106 106 SER C C 13 177.862 0.1 . 1 . . . . 669 SER C . 18530 1 1283 . 1 1 106 106 SER CA C 13 56.967 0.1 . 1 . . . . 669 SER CA . 18530 1 1284 . 1 1 106 106 SER CB C 13 65.586 0.1 . 1 . . . . 669 SER CB . 18530 1 1285 . 1 1 106 106 SER N N 15 107.197 0.1 . 1 . . . . 669 SER N . 18530 1 1286 . 1 1 107 107 ALA H H 1 6.653 0.01 . 1 . . . . 670 ALA H . 18530 1 1287 . 1 1 107 107 ALA HA H 1 5.165 0.01 . 1 . . . . 670 ALA HA . 18530 1 1288 . 1 1 107 107 ALA HB1 H 1 1.165 0.01 . 1 . . . . 670 ALA HB1 . 18530 1 1289 . 1 1 107 107 ALA HB2 H 1 1.165 0.01 . 1 . . . . 670 ALA HB2 . 18530 1 1290 . 1 1 107 107 ALA HB3 H 1 1.165 0.01 . 1 . . . . 670 ALA HB3 . 18530 1 1291 . 1 1 107 107 ALA C C 13 175.675 0.1 . 1 . . . . 670 ALA C . 18530 1 1292 . 1 1 107 107 ALA CA C 13 50.784 0.1 . 1 . . . . 670 ALA CA . 18530 1 1293 . 1 1 107 107 ALA CB C 13 22.225 0.1 . 1 . . . . 670 ALA CB . 18530 1 1294 . 1 1 107 107 ALA N N 15 122.466 0.1 . 1 . . . . 670 ALA N . 18530 1 1295 . 1 1 108 108 PHE H H 1 8.815 0.01 . 1 . . . . 671 PHE H . 18530 1 1296 . 1 1 108 108 PHE HA H 1 5.000 0.01 . 1 . . . . 671 PHE HA . 18530 1 1297 . 1 1 108 108 PHE HB2 H 1 2.346 0.01 . 2 . . . . 671 PHE HB2 . 18530 1 1298 . 1 1 108 108 PHE HB3 H 1 2.931 0.01 . 2 . . . . 671 PHE HB3 . 18530 1 1299 . 1 1 108 108 PHE HD1 H 1 7.055 0.01 . 3 . . . . 671 PHE HD1 . 18530 1 1300 . 1 1 108 108 PHE HD2 H 1 7.055 0.01 . 3 . . . . 671 PHE HD2 . 18530 1 1301 . 1 1 108 108 PHE HE1 H 1 6.816 0.01 . 3 . . . . 671 PHE HE1 . 18530 1 1302 . 1 1 108 108 PHE HE2 H 1 6.816 0.01 . 3 . . . . 671 PHE HE2 . 18530 1 1303 . 1 1 108 108 PHE HZ H 1 6.969 0.01 . 1 . . . . 671 PHE HZ . 18530 1 1304 . 1 1 108 108 PHE C C 13 177.401 0.1 . 1 . . . . 671 PHE C . 18530 1 1305 . 1 1 108 108 PHE CA C 13 56.962 0.1 . 1 . . . . 671 PHE CA . 18530 1 1306 . 1 1 108 108 PHE CB C 13 44.003 0.1 . 1 . . . . 671 PHE CB . 18530 1 1307 . 1 1 108 108 PHE CD1 C 13 132.854 0.1 . 3 . . . . 671 PHE CD1 . 18530 1 1308 . 1 1 108 108 PHE CD2 C 13 132.854 0.1 . 3 . . . . 671 PHE CD2 . 18530 1 1309 . 1 1 108 108 PHE CE1 C 13 130.462 0.1 . 3 . . . . 671 PHE CE1 . 18530 1 1310 . 1 1 108 108 PHE CE2 C 13 130.462 0.1 . 3 . . . . 671 PHE CE2 . 18530 1 1311 . 1 1 108 108 PHE CZ C 13 129.483 0.1 . 1 . . . . 671 PHE CZ . 18530 1 1312 . 1 1 108 108 PHE N N 15 119.061 0.1 . 1 . . . . 671 PHE N . 18530 1 1313 . 1 1 109 109 LEU H H 1 8.980 0.01 . 1 . . . . 672 LEU H . 18530 1 1314 . 1 1 109 109 LEU HA H 1 5.290 0.01 . 1 . . . . 672 LEU HA . 18530 1 1315 . 1 1 109 109 LEU HB2 H 1 1.594 0.01 . 2 . . . . 672 LEU HB2 . 18530 1 1316 . 1 1 109 109 LEU HB3 H 1 1.754 0.01 . 2 . . . . 672 LEU HB3 . 18530 1 1317 . 1 1 109 109 LEU HG H 1 1.427 0.01 . 1 . . . . 672 LEU HG . 18530 1 1318 . 1 1 109 109 LEU HD11 H 1 0.838 0.01 . 2 . . . . 672 LEU HD11 . 18530 1 1319 . 1 1 109 109 LEU HD12 H 1 0.838 0.01 . 2 . . . . 672 LEU HD12 . 18530 1 1320 . 1 1 109 109 LEU HD13 H 1 0.838 0.01 . 2 . . . . 672 LEU HD13 . 18530 1 1321 . 1 1 109 109 LEU HD21 H 1 0.871 0.01 . 2 . . . . 672 LEU HD21 . 18530 1 1322 . 1 1 109 109 LEU HD22 H 1 0.871 0.01 . 2 . . . . 672 LEU HD22 . 18530 1 1323 . 1 1 109 109 LEU HD23 H 1 0.871 0.01 . 2 . . . . 672 LEU HD23 . 18530 1 1324 . 1 1 109 109 LEU C C 13 174.343 0.1 . 1 . . . . 672 LEU C . 18530 1 1325 . 1 1 109 109 LEU CA C 13 53.405 0.1 . 1 . . . . 672 LEU CA . 18530 1 1326 . 1 1 109 109 LEU CB C 13 46.467 0.1 . 1 . . . . 672 LEU CB . 18530 1 1327 . 1 1 109 109 LEU CG C 13 27.341 0.1 . 1 . . . . 672 LEU CG . 18530 1 1328 . 1 1 109 109 LEU CD1 C 13 24.428 0.1 . 2 . . . . 672 LEU CD1 . 18530 1 1329 . 1 1 109 109 LEU CD2 C 13 25.306 0.1 . 2 . . . . 672 LEU CD2 . 18530 1 1330 . 1 1 109 109 LEU N N 15 122.774 0.1 . 1 . . . . 672 LEU N . 18530 1 1331 . 1 1 110 110 CYS H H 1 8.722 0.01 . 1 . . . . 673 CYS H . 18530 1 1332 . 1 1 110 110 CYS HA H 1 3.908 0.01 . 1 . . . . 673 CYS HA . 18530 1 1333 . 1 1 110 110 CYS HB2 H 1 1.867 0.01 . 2 . . . . 673 CYS HB2 . 18530 1 1334 . 1 1 110 110 CYS HB3 H 1 2.802 0.01 . 2 . . . . 673 CYS HB3 . 18530 1 1335 . 1 1 110 110 CYS C C 13 176.668 0.1 . 1 . . . . 673 CYS C . 18530 1 1336 . 1 1 110 110 CYS CA C 13 54.697 0.1 . 1 . . . . 673 CYS CA . 18530 1 1337 . 1 1 110 110 CYS CB C 13 36.823 0.1 . 1 . . . . 673 CYS CB . 18530 1 1338 . 1 1 110 110 CYS N N 15 125.327 0.1 . 1 . . . . 673 CYS N . 18530 1 1339 . 1 1 111 111 GLY H H 1 7.906 0.01 . 1 . . . . 674 GLY H . 18530 1 1340 . 1 1 111 111 GLY HA2 H 1 3.944 0.01 . 2 . . . . 674 GLY HA2 . 18530 1 1341 . 1 1 111 111 GLY HA3 H 1 4.419 0.01 . 2 . . . . 674 GLY HA3 . 18530 1 1342 . 1 1 111 111 GLY C C 13 176.682 0.1 . 1 . . . . 674 GLY C . 18530 1 1343 . 1 1 111 111 GLY CA C 13 44.497 0.1 . 1 . . . . 674 GLY CA . 18530 1 1344 . 1 1 111 111 GLY N N 15 118.672 0.1 . 1 . . . . 674 GLY N . 18530 1 1345 . 1 1 112 112 SER H H 1 8.657 0.01 . 1 . . . . 675 SER H . 18530 1 1346 . 1 1 112 112 SER HA H 1 4.037 0.01 . 1 . . . . 675 SER HA . 18530 1 1347 . 1 1 112 112 SER HB2 H 1 3.861 0.01 . 2 . . . . 675 SER HB2 . 18530 1 1348 . 1 1 112 112 SER HB3 H 1 3.935 0.01 . 2 . . . . 675 SER HB3 . 18530 1 1349 . 1 1 112 112 SER C C 13 175.808 0.1 . 1 . . . . 675 SER C . 18530 1 1350 . 1 1 112 112 SER CA C 13 61.234 0.1 . 1 . . . . 675 SER CA . 18530 1 1351 . 1 1 112 112 SER CB C 13 62.615 0.1 . 1 . . . . 675 SER CB . 18530 1 1352 . 1 1 112 112 SER N N 15 114.079 0.1 . 1 . . . . 675 SER N . 18530 1 1353 . 1 1 113 113 SER H H 1 8.036 0.01 . 1 . . . . 676 SER H . 18530 1 1354 . 1 1 113 113 SER HA H 1 4.293 0.01 . 1 . . . . 676 SER HA . 18530 1 1355 . 1 1 113 113 SER HB2 H 1 3.846 0.01 . 2 . . . . 676 SER HB2 . 18530 1 1356 . 1 1 113 113 SER HB3 H 1 3.947 0.01 . 2 . . . . 676 SER HB3 . 18530 1 1357 . 1 1 113 113 SER C C 13 177.088 0.1 . 1 . . . . 676 SER C . 18530 1 1358 . 1 1 113 113 SER CA C 13 58.139 0.1 . 1 . . . . 676 SER CA . 18530 1 1359 . 1 1 113 113 SER CB C 13 63.351 0.1 . 1 . . . . 676 SER CB . 18530 1 1360 . 1 1 113 113 SER N N 15 115.401 0.1 . 1 . . . . 676 SER N . 18530 1 1361 . 1 1 114 114 LEU H H 1 8.419 0.01 . 1 . . . . 677 LEU H . 18530 1 1362 . 1 1 114 114 LEU HA H 1 3.822 0.01 . 1 . . . . 677 LEU HA . 18530 1 1363 . 1 1 114 114 LEU HB2 H 1 1.243 0.01 . 2 . . . . 677 LEU HB2 . 18530 1 1364 . 1 1 114 114 LEU HB3 H 1 2.028 0.01 . 2 . . . . 677 LEU HB3 . 18530 1 1365 . 1 1 114 114 LEU HG H 1 1.250 0.01 . 1 . . . . 677 LEU HG . 18530 1 1366 . 1 1 114 114 LEU HD11 H 1 0.652 0.01 . 2 . . . . 677 LEU HD11 . 18530 1 1367 . 1 1 114 114 LEU HD12 H 1 0.652 0.01 . 2 . . . . 677 LEU HD12 . 18530 1 1368 . 1 1 114 114 LEU HD13 H 1 0.652 0.01 . 2 . . . . 677 LEU HD13 . 18530 1 1369 . 1 1 114 114 LEU HD21 H 1 0.506 0.01 . 2 . . . . 677 LEU HD21 . 18530 1 1370 . 1 1 114 114 LEU HD22 H 1 0.506 0.01 . 2 . . . . 677 LEU HD22 . 18530 1 1371 . 1 1 114 114 LEU HD23 H 1 0.506 0.01 . 2 . . . . 677 LEU HD23 . 18530 1 1372 . 1 1 114 114 LEU C C 13 176.191 0.1 . 1 . . . . 677 LEU C . 18530 1 1373 . 1 1 114 114 LEU CA C 13 56.152 0.1 . 1 . . . . 677 LEU CA . 18530 1 1374 . 1 1 114 114 LEU CB C 13 36.235 0.1 . 1 . . . . 677 LEU CB . 18530 1 1375 . 1 1 114 114 LEU CG C 13 26.778 0.1 . 1 . . . . 677 LEU CG . 18530 1 1376 . 1 1 114 114 LEU CD1 C 13 22.435 0.1 . 2 . . . . 677 LEU CD1 . 18530 1 1377 . 1 1 114 114 LEU CD2 C 13 25.265 0.1 . 2 . . . . 677 LEU CD2 . 18530 1 1378 . 1 1 114 114 LEU N N 15 116.805 0.1 . 1 . . . . 677 LEU N . 18530 1 1379 . 1 1 115 115 LYS H H 1 7.090 0.01 . 1 . . . . 678 LYS H . 18530 1 1380 . 1 1 115 115 LYS HA H 1 4.488 0.01 . 1 . . . . 678 LYS HA . 18530 1 1381 . 1 1 115 115 LYS HB2 H 1 1.498 0.01 . 2 . . . . 678 LYS HB2 . 18530 1 1382 . 1 1 115 115 LYS HB3 H 1 1.834 0.01 . 2 . . . . 678 LYS HB3 . 18530 1 1383 . 1 1 115 115 LYS HG2 H 1 1.309 0.01 . 1 . . . . 678 LYS HG2 . 18530 1 1384 . 1 1 115 115 LYS HG3 H 1 1.309 0.01 . 1 . . . . 678 LYS HG3 . 18530 1 1385 . 1 1 115 115 LYS HD2 H 1 1.598 0.01 . 2 . . . . 678 LYS HD2 . 18530 1 1386 . 1 1 115 115 LYS HD3 H 1 1.673 0.01 . 2 . . . . 678 LYS HD3 . 18530 1 1387 . 1 1 115 115 LYS HE2 H 1 2.978 0.01 . 1 . . . . 678 LYS HE2 . 18530 1 1388 . 1 1 115 115 LYS HE3 H 1 2.978 0.01 . 1 . . . . 678 LYS HE3 . 18530 1 1389 . 1 1 115 115 LYS C C 13 174.574 0.1 . 1 . . . . 678 LYS C . 18530 1 1390 . 1 1 115 115 LYS CA C 13 53.680 0.1 . 1 . . . . 678 LYS CA . 18530 1 1391 . 1 1 115 115 LYS CB C 13 35.007 0.1 . 1 . . . . 678 LYS CB . 18530 1 1392 . 1 1 115 115 LYS CG C 13 24.716 0.1 . 1 . . . . 678 LYS CG . 18530 1 1393 . 1 1 115 115 LYS CD C 13 28.980 0.1 . 1 . . . . 678 LYS CD . 18530 1 1394 . 1 1 115 115 LYS CE C 13 41.965 0.1 . 1 . . . . 678 LYS CE . 18530 1 1395 . 1 1 115 115 LYS N N 15 116.583 0.1 . 1 . . . . 678 LYS N . 18530 1 1396 . 1 1 116 116 TRP H H 1 8.155 0.01 . 1 . . . . 679 TRP H . 18530 1 1397 . 1 1 116 116 TRP HA H 1 5.035 0.01 . 1 . . . . 679 TRP HA . 18530 1 1398 . 1 1 116 116 TRP HB2 H 1 3.070 0.01 . 2 . . . . 679 TRP HB2 . 18530 1 1399 . 1 1 116 116 TRP HB3 H 1 3.283 0.01 . 2 . . . . 679 TRP HB3 . 18530 1 1400 . 1 1 116 116 TRP HD1 H 1 7.284 0.01 . 1 . . . . 679 TRP HD1 . 18530 1 1401 . 1 1 116 116 TRP HE1 H 1 9.475 0.01 . 1 . . . . 679 TRP HE1 . 18530 1 1402 . 1 1 116 116 TRP HE3 H 1 7.106 0.01 . 1 . . . . 679 TRP HE3 . 18530 1 1403 . 1 1 116 116 TRP HZ2 H 1 6.382 0.01 . 1 . . . . 679 TRP HZ2 . 18530 1 1404 . 1 1 116 116 TRP HZ3 H 1 6.725 0.01 . 1 . . . . 679 TRP HZ3 . 18530 1 1405 . 1 1 116 116 TRP HH2 H 1 5.917 0.01 . 1 . . . . 679 TRP HH2 . 18530 1 1406 . 1 1 116 116 TRP C C 13 174.448 0.1 . 1 . . . . 679 TRP C . 18530 1 1407 . 1 1 116 116 TRP CA C 13 56.862 0.1 . 1 . . . . 679 TRP CA . 18530 1 1408 . 1 1 116 116 TRP CB C 13 30.842 0.1 . 1 . . . . 679 TRP CB . 18530 1 1409 . 1 1 116 116 TRP CD1 C 13 126.165 0.1 . 1 . . . . 679 TRP CD1 . 18530 1 1410 . 1 1 116 116 TRP CE3 C 13 120.213 0.1 . 1 . . . . 679 TRP CE3 . 18530 1 1411 . 1 1 116 116 TRP CZ2 C 13 112.762 0.1 . 1 . . . . 679 TRP CZ2 . 18530 1 1412 . 1 1 116 116 TRP CZ3 C 13 122.575 0.1 . 1 . . . . 679 TRP CZ3 . 18530 1 1413 . 1 1 116 116 TRP CH2 C 13 123.754 0.1 . 1 . . . . 679 TRP CH2 . 18530 1 1414 . 1 1 116 116 TRP N N 15 124.588 0.1 . 1 . . . . 679 TRP N . 18530 1 1415 . 1 1 116 116 TRP NE1 N 15 126.187 0.1 . 1 . . . . 679 TRP NE1 . 18530 1 1416 . 1 1 117 117 SER H H 1 9.115 0.01 . 1 . . . . 680 SER H . 18530 1 1417 . 1 1 117 117 SER HA H 1 4.862 0.01 . 1 . . . . 680 SER HA . 18530 1 1418 . 1 1 117 117 SER HB2 H 1 3.795 0.01 . 2 . . . . 680 SER HB2 . 18530 1 1419 . 1 1 117 117 SER HB3 H 1 3.865 0.01 . 2 . . . . 680 SER HB3 . 18530 1 1420 . 1 1 117 117 SER C C 13 176.123 0.1 . 1 . . . . 680 SER C . 18530 1 1421 . 1 1 117 117 SER CA C 13 55.670 0.1 . 1 . . . . 680 SER CA . 18530 1 1422 . 1 1 117 117 SER CB C 13 65.433 0.1 . 1 . . . . 680 SER CB . 18530 1 1423 . 1 1 117 117 SER N N 15 116.505 0.1 . 1 . . . . 680 SER N . 18530 1 1424 . 1 1 118 118 PRO HA H 1 5.011 0.01 . 1 . . . . 681 PRO HA . 18530 1 1425 . 1 1 118 118 PRO HB2 H 1 2.299 0.01 . 2 . . . . 681 PRO HB2 . 18530 1 1426 . 1 1 118 118 PRO HB3 H 1 2.556 0.01 . 2 . . . . 681 PRO HB3 . 18530 1 1427 . 1 1 118 118 PRO HG2 H 1 1.642 0.01 . 2 . . . . 681 PRO HG2 . 18530 1 1428 . 1 1 118 118 PRO HG3 H 1 1.883 0.01 . 2 . . . . 681 PRO HG3 . 18530 1 1429 . 1 1 118 118 PRO HD2 H 1 3.805 0.01 . 2 . . . . 681 PRO HD2 . 18530 1 1430 . 1 1 118 118 PRO HD3 H 1 3.438 0.01 . 2 . . . . 681 PRO HD3 . 18530 1 1431 . 1 1 118 118 PRO C C 13 177.500 0.1 . 1 . . . . 681 PRO C . 18530 1 1432 . 1 1 118 118 PRO CA C 13 63.719 0.1 . 1 . . . . 681 PRO CA . 18530 1 1433 . 1 1 118 118 PRO CB C 13 33.844 0.1 . 1 . . . . 681 PRO CB . 18530 1 1434 . 1 1 118 118 PRO CG C 13 25.411 0.1 . 1 . . . . 681 PRO CG . 18530 1 1435 . 1 1 118 118 PRO CD C 13 49.721 0.1 . 1 . . . . 681 PRO CD . 18530 1 1436 . 1 1 119 119 GLU H H 1 8.151 0.01 . 1 . . . . 682 GLU H . 18530 1 1437 . 1 1 119 119 GLU HA H 1 4.249 0.01 . 1 . . . . 682 GLU HA . 18530 1 1438 . 1 1 119 119 GLU HB2 H 1 2.056 0.01 . 2 . . . . 682 GLU HB2 . 18530 1 1439 . 1 1 119 119 GLU HB3 H 1 2.057 0.01 . 2 . . . . 682 GLU HB3 . 18530 1 1440 . 1 1 119 119 GLU HG2 H 1 2.422 0.01 . 2 . . . . 682 GLU HG2 . 18530 1 1441 . 1 1 119 119 GLU HG3 H 1 2.343 0.01 . 2 . . . . 682 GLU HG3 . 18530 1 1442 . 1 1 119 119 GLU C C 13 172.993 0.1 . 1 . . . . 682 GLU C . 18530 1 1443 . 1 1 119 119 GLU CA C 13 57.707 0.1 . 1 . . . . 682 GLU CA . 18530 1 1444 . 1 1 119 119 GLU CB C 13 29.940 0.1 . 1 . . . . 682 GLU CB . 18530 1 1445 . 1 1 119 119 GLU CG C 13 37.126 0.1 . 1 . . . . 682 GLU CG . 18530 1 1446 . 1 1 119 119 GLU N N 15 114.048 0.1 . 1 . . . . 682 GLU N . 18530 1 1447 . 1 1 120 120 MET H H 1 8.163 0.01 . 1 . . . . 683 MET H . 18530 1 1448 . 1 1 120 120 MET HA H 1 3.457 0.01 . 1 . . . . 683 MET HA . 18530 1 1449 . 1 1 120 120 MET HB2 H 1 1.092 0.01 . 2 . . . . 683 MET HB2 . 18530 1 1450 . 1 1 120 120 MET HB3 H 1 1.170 0.01 . 2 . . . . 683 MET HB3 . 18530 1 1451 . 1 1 120 120 MET HG2 H 1 0.808 0.01 . 2 . . . . 683 MET HG2 . 18530 1 1452 . 1 1 120 120 MET HG3 H 1 1.172 0.01 . 2 . . . . 683 MET HG3 . 18530 1 1453 . 1 1 120 120 MET HE1 H 1 0.291 0.01 . 1 . . . . 683 MET HE1 . 18530 1 1454 . 1 1 120 120 MET HE2 H 1 0.291 0.01 . 1 . . . . 683 MET HE2 . 18530 1 1455 . 1 1 120 120 MET HE3 H 1 0.291 0.01 . 1 . . . . 683 MET HE3 . 18530 1 1456 . 1 1 120 120 MET C C 13 173.577 0.1 . 1 . . . . 683 MET C . 18530 1 1457 . 1 1 120 120 MET CA C 13 58.429 0.1 . 1 . . . . 683 MET CA . 18530 1 1458 . 1 1 120 120 MET CB C 13 32.915 0.1 . 1 . . . . 683 MET CB . 18530 1 1459 . 1 1 120 120 MET CG C 13 31.543 0.1 . 1 . . . . 683 MET CG . 18530 1 1460 . 1 1 120 120 MET CE C 13 15.511 0.1 . 1 . . . . 683 MET CE . 18530 1 1461 . 1 1 120 120 MET N N 15 126.310 0.1 . 1 . . . . 683 MET N . 18530 1 1462 . 1 1 121 121 LYS H H 1 8.231 0.01 . 1 . . . . 684 LYS H . 18530 1 1463 . 1 1 121 121 LYS HA H 1 4.097 0.01 . 1 . . . . 684 LYS HA . 18530 1 1464 . 1 1 121 121 LYS HB2 H 1 1.810 0.01 . 2 . . . . 684 LYS HB2 . 18530 1 1465 . 1 1 121 121 LYS HB3 H 1 1.875 0.01 . 2 . . . . 684 LYS HB3 . 18530 1 1466 . 1 1 121 121 LYS HG2 H 1 1.239 0.01 . 2 . . . . 684 LYS HG2 . 18530 1 1467 . 1 1 121 121 LYS HG3 H 1 1.340 0.01 . 2 . . . . 684 LYS HG3 . 18530 1 1468 . 1 1 121 121 LYS HD2 H 1 1.643 0.01 . 2 . . . . 684 LYS HD2 . 18530 1 1469 . 1 1 121 121 LYS HD3 H 1 1.643 0.01 . 2 . . . . 684 LYS HD3 . 18530 1 1470 . 1 1 121 121 LYS HE2 H 1 2.944 0.01 . 2 . . . . 684 LYS HE2 . 18530 1 1471 . 1 1 121 121 LYS HE3 H 1 2.944 0.01 . 2 . . . . 684 LYS HE3 . 18530 1 1472 . 1 1 121 121 LYS C C 13 175.685 0.1 . 1 . . . . 684 LYS C . 18530 1 1473 . 1 1 121 121 LYS CA C 13 57.871 0.1 . 1 . . . . 684 LYS CA . 18530 1 1474 . 1 1 121 121 LYS CB C 13 31.502 0.1 . 1 . . . . 684 LYS CB . 18530 1 1475 . 1 1 121 121 LYS CG C 13 24.205 0.1 . 1 . . . . 684 LYS CG . 18530 1 1476 . 1 1 121 121 LYS CD C 13 29.233 0.1 . 1 . . . . 684 LYS CD . 18530 1 1477 . 1 1 121 121 LYS CE C 13 41.771 0.1 . 1 . . . . 684 LYS CE . 18530 1 1478 . 1 1 121 121 LYS N N 15 115.956 0.1 . 1 . . . . 684 LYS N . 18530 1 1479 . 1 1 122 122 ASN H H 1 7.479 0.01 . 1 . . . . 685 ASN H . 18530 1 1480 . 1 1 122 122 ASN HA H 1 4.604 0.01 . 1 . . . . 685 ASN HA . 18530 1 1481 . 1 1 122 122 ASN HB2 H 1 2.726 0.01 . 2 . . . . 685 ASN HB2 . 18530 1 1482 . 1 1 122 122 ASN HB3 H 1 2.974 0.01 . 2 . . . . 685 ASN HB3 . 18530 1 1483 . 1 1 122 122 ASN HD21 H 1 7.225 0.01 . 1 . . . . 685 ASN HD21 . 18530 1 1484 . 1 1 122 122 ASN HD22 H 1 7.656 0.01 . 1 . . . . 685 ASN HD22 . 18530 1 1485 . 1 1 122 122 ASN C C 13 176.643 0.1 . 1 . . . . 685 ASN C . 18530 1 1486 . 1 1 122 122 ASN CA C 13 53.818 0.1 . 1 . . . . 685 ASN CA . 18530 1 1487 . 1 1 122 122 ASN CB C 13 38.920 0.1 . 1 . . . . 685 ASN CB . 18530 1 1488 . 1 1 122 122 ASN CG C 13 174.446 0.1 . 1 . . . . 685 ASN CG . 18530 1 1489 . 1 1 122 122 ASN N N 15 115.371 0.1 . 1 . . . . 685 ASN N . 18530 1 1490 . 1 1 122 122 ASN ND2 N 15 113.289 0.1 . 1 . . . . 685 ASN ND2 . 18530 1 1491 . 1 1 123 123 ALA H H 1 7.473 0.01 . 1 . . . . 686 ALA H . 18530 1 1492 . 1 1 123 123 ALA HA H 1 4.825 0.01 . 1 . . . . 686 ALA HA . 18530 1 1493 . 1 1 123 123 ALA HB1 H 1 1.417 0.01 . 1 . . . . 686 ALA HB1 . 18530 1 1494 . 1 1 123 123 ALA HB2 H 1 1.417 0.01 . 1 . . . . 686 ALA HB2 . 18530 1 1495 . 1 1 123 123 ALA HB3 H 1 1.417 0.01 . 1 . . . . 686 ALA HB3 . 18530 1 1496 . 1 1 123 123 ALA C C 13 175.430 0.1 . 1 . . . . 686 ALA C . 18530 1 1497 . 1 1 123 123 ALA CA C 13 52.202 0.1 . 1 . . . . 686 ALA CA . 18530 1 1498 . 1 1 123 123 ALA CB C 13 19.232 0.1 . 1 . . . . 686 ALA CB . 18530 1 1499 . 1 1 123 123 ALA N N 15 124.070 0.1 . 1 . . . . 686 ALA N . 18530 1 1500 . 1 1 124 124 ARG H H 1 8.321 0.01 . 1 . . . . 687 ARG H . 18530 1 1501 . 1 1 124 124 ARG HA H 1 4.640 0.01 . 1 . . . . 687 ARG HA . 18530 1 1502 . 1 1 124 124 ARG HB2 H 1 1.757 0.01 . 2 . . . . 687 ARG HB2 . 18530 1 1503 . 1 1 124 124 ARG HB3 H 1 1.757 0.01 . 2 . . . . 687 ARG HB3 . 18530 1 1504 . 1 1 124 124 ARG HG2 H 1 1.406 0.01 . 2 . . . . 687 ARG HG2 . 18530 1 1505 . 1 1 124 124 ARG HG3 H 1 1.589 0.01 . 2 . . . . 687 ARG HG3 . 18530 1 1506 . 1 1 124 124 ARG HD2 H 1 3.131 0.01 . 2 . . . . 687 ARG HD2 . 18530 1 1507 . 1 1 124 124 ARG HD3 H 1 3.130 0.01 . 2 . . . . 687 ARG HD3 . 18530 1 1508 . 1 1 124 124 ARG HE H 1 7.150 0.01 . 1 . . . . 687 ARG HE . 18530 1 1509 . 1 1 124 124 ARG C C 13 177.745 0.1 . 1 . . . . 687 ARG C . 18530 1 1510 . 1 1 124 124 ARG CA C 13 54.586 0.1 . 1 . . . . 687 ARG CA . 18530 1 1511 . 1 1 124 124 ARG CB C 13 33.908 0.1 . 1 . . . . 687 ARG CB . 18530 1 1512 . 1 1 124 124 ARG CG C 13 26.789 0.1 . 1 . . . . 687 ARG CG . 18530 1 1513 . 1 1 124 124 ARG CD C 13 43.427 0.1 . 1 . . . . 687 ARG CD . 18530 1 1514 . 1 1 124 124 ARG N N 15 118.987 0.1 . 1 . . . . 687 ARG N . 18530 1 1515 . 1 1 124 124 ARG NE N 15 84.900 0.1 . 1 . . . . 687 ARG NE . 18530 1 1516 . 1 1 125 125 CYS H H 1 8.545 0.01 . 1 . . . . 688 CYS H . 18530 1 1517 . 1 1 125 125 CYS HA H 1 5.429 0.01 . 1 . . . . 688 CYS HA . 18530 1 1518 . 1 1 125 125 CYS HB2 H 1 2.829 0.01 . 2 . . . . 688 CYS HB2 . 18530 1 1519 . 1 1 125 125 CYS HB3 H 1 2.917 0.01 . 2 . . . . 688 CYS HB3 . 18530 1 1520 . 1 1 125 125 CYS C C 13 176.542 0.1 . 1 . . . . 688 CYS C . 18530 1 1521 . 1 1 125 125 CYS CA C 13 54.101 0.1 . 1 . . . . 688 CYS CA . 18530 1 1522 . 1 1 125 125 CYS CB C 13 43.861 0.1 . 1 . . . . 688 CYS CB . 18530 1 1523 . 1 1 125 125 CYS N N 15 119.605 0.1 . 1 . . . . 688 CYS N . 18530 1 1524 . 1 1 126 126 VAL H H 1 9.408 0.01 . 1 . . . . 689 VAL H . 18530 1 1525 . 1 1 126 126 VAL HA H 1 4.485 0.01 . 1 . . . . 689 VAL HA . 18530 1 1526 . 1 1 126 126 VAL HB H 1 2.074 0.01 . 1 . . . . 689 VAL HB . 18530 1 1527 . 1 1 126 126 VAL HG11 H 1 0.790 0.01 . 2 . . . . 689 VAL HG11 . 18530 1 1528 . 1 1 126 126 VAL HG12 H 1 0.790 0.01 . 2 . . . . 689 VAL HG12 . 18530 1 1529 . 1 1 126 126 VAL HG13 H 1 0.790 0.01 . 2 . . . . 689 VAL HG13 . 18530 1 1530 . 1 1 126 126 VAL HG21 H 1 0.829 0.01 . 2 . . . . 689 VAL HG21 . 18530 1 1531 . 1 1 126 126 VAL HG22 H 1 0.829 0.01 . 2 . . . . 689 VAL HG22 . 18530 1 1532 . 1 1 126 126 VAL HG23 H 1 0.829 0.01 . 2 . . . . 689 VAL HG23 . 18530 1 1533 . 1 1 126 126 VAL C C 13 176.210 0.1 . 1 . . . . 689 VAL C . 18530 1 1534 . 1 1 126 126 VAL CA C 13 60.036 0.1 . 1 . . . . 689 VAL CA . 18530 1 1535 . 1 1 126 126 VAL CB C 13 35.277 0.1 . 1 . . . . 689 VAL CB . 18530 1 1536 . 1 1 126 126 VAL CG1 C 13 19.508 0.1 . 2 . . . . 689 VAL CG1 . 18530 1 1537 . 1 1 126 126 VAL CG2 C 13 21.237 0.1 . 2 . . . . 689 VAL CG2 . 18530 1 1538 . 1 1 126 126 VAL N N 15 120.522 0.1 . 1 . . . . 689 VAL N . 18530 1 1539 . 1 1 127 127 GLN H H 1 8.726 0.01 . 1 . . . . 690 GLN H . 18530 1 1540 . 1 1 127 127 GLN HA H 1 4.392 0.01 . 1 . . . . 690 GLN HA . 18530 1 1541 . 1 1 127 127 GLN HB2 H 1 1.942 0.01 . 2 . . . . 690 GLN HB2 . 18530 1 1542 . 1 1 127 127 GLN HB3 H 1 2.072 0.01 . 2 . . . . 690 GLN HB3 . 18530 1 1543 . 1 1 127 127 GLN HG2 H 1 2.341 0.01 . 2 . . . . 690 GLN HG2 . 18530 1 1544 . 1 1 127 127 GLN HG3 H 1 2.341 0.01 . 2 . . . . 690 GLN HG3 . 18530 1 1545 . 1 1 127 127 GLN HE21 H 1 6.766 0.01 . 1 . . . . 690 GLN HE21 . 18530 1 1546 . 1 1 127 127 GLN HE22 H 1 7.606 0.01 . 1 . . . . 690 GLN HE22 . 18530 1 1547 . 1 1 127 127 GLN C C 13 175.649 0.1 . 1 . . . . 690 GLN C . 18530 1 1548 . 1 1 127 127 GLN CA C 13 55.752 0.1 . 1 . . . . 690 GLN CA . 18530 1 1549 . 1 1 127 127 GLN CB C 13 29.183 0.1 . 1 . . . . 690 GLN CB . 18530 1 1550 . 1 1 127 127 GLN CG C 13 33.598 0.1 . 1 . . . . 690 GLN CG . 18530 1 1551 . 1 1 127 127 GLN CD C 13 178.141 0.1 . 1 . . . . 690 GLN CD . 18530 1 1552 . 1 1 127 127 GLN N N 15 124.504 0.1 . 1 . . . . 690 GLN N . 18530 1 1553 . 1 1 127 127 GLN NE2 N 15 112.354 0.1 . 1 . . . . 690 GLN NE2 . 18530 1 1554 . 1 1 128 128 LYS H H 1 8.558 0.01 . 1 . . . . 691 LYS H . 18530 1 1555 . 1 1 128 128 LYS HA H 1 4.326 0.01 . 1 . . . . 691 LYS HA . 18530 1 1556 . 1 1 128 128 LYS HB2 H 1 1.707 0.01 . 2 . . . . 691 LYS HB2 . 18530 1 1557 . 1 1 128 128 LYS HB3 H 1 1.819 0.01 . 2 . . . . 691 LYS HB3 . 18530 1 1558 . 1 1 128 128 LYS HG2 H 1 1.399 0.01 . 2 . . . . 691 LYS HG2 . 18530 1 1559 . 1 1 128 128 LYS HG3 H 1 1.399 0.01 . 2 . . . . 691 LYS HG3 . 18530 1 1560 . 1 1 128 128 LYS HD2 H 1 1.645 0.01 . 1 . . . . 691 LYS HD2 . 18530 1 1561 . 1 1 128 128 LYS HD3 H 1 1.645 0.01 . 1 . . . . 691 LYS HD3 . 18530 1 1562 . 1 1 128 128 LYS HE2 H 1 2.919 0.01 . 2 . . . . 691 LYS HE2 . 18530 1 1563 . 1 1 128 128 LYS HE3 H 1 2.919 0.01 . 2 . . . . 691 LYS HE3 . 18530 1 1564 . 1 1 128 128 LYS C C 13 175.743 0.1 . 1 . . . . 691 LYS C . 18530 1 1565 . 1 1 128 128 LYS CA C 13 56.413 0.1 . 1 . . . . 691 LYS CA . 18530 1 1566 . 1 1 128 128 LYS CB C 13 33.372 0.1 . 1 . . . . 691 LYS CB . 18530 1 1567 . 1 1 128 128 LYS CG C 13 24.733 0.1 . 1 . . . . 691 LYS CG . 18530 1 1568 . 1 1 128 128 LYS CD C 13 29.013 0.1 . 1 . . . . 691 LYS CD . 18530 1 1569 . 1 1 128 128 LYS CE C 13 41.898 0.1 . 1 . . . . 691 LYS CE . 18530 1 1570 . 1 1 128 128 LYS N N 15 126.325 0.1 . 1 . . . . 691 LYS N . 18530 1 1571 . 1 1 129 129 GLU H H 1 8.112 0.01 . 1 . . . . 692 GLU H . 18530 1 1572 . 1 1 129 129 GLU HA H 1 4.104 0.01 . 1 . . . . 692 GLU HA . 18530 1 1573 . 1 1 129 129 GLU HB2 H 1 2.020 0.01 . 2 . . . . 692 GLU HB2 . 18530 1 1574 . 1 1 129 129 GLU HB3 H 1 1.860 0.01 . 2 . . . . 692 GLU HB3 . 18530 1 1575 . 1 1 129 129 GLU HG2 H 1 2.179 0.01 . 1 . . . . 692 GLU HG2 . 18530 1 1576 . 1 1 129 129 GLU HG3 H 1 2.179 0.01 . 1 . . . . 692 GLU HG3 . 18530 1 1577 . 1 1 129 129 GLU C C 13 177.218 0.1 . 1 . . . . 692 GLU C . 18530 1 1578 . 1 1 129 129 GLU CA C 13 58.037 0.1 . 1 . . . . 692 GLU CA . 18530 1 1579 . 1 1 129 129 GLU CB C 13 31.062 0.1 . 1 . . . . 692 GLU CB . 18530 1 1580 . 1 1 129 129 GLU CG C 13 36.606 0.1 . 1 . . . . 692 GLU CG . 18530 1 1581 . 1 1 129 129 GLU N N 15 128.023 0.1 . 1 . . . . 692 GLU N . 18530 1 stop_ save_