data_15996 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 15996 _Entry.Title ; 1H, 15N and 13C resonance assignment of the pair of Factor-I like modules of the complement protein C7 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2008-10-21 _Entry.Accession_date 2008-10-21 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.8.125 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details ; The C-terminus of human complement component C7 comprises two Factor I-like Modules (FIMs) which are essential for formation of the Membrane Attack Complex, the terminal pathway of the innate immune system. C7-FIMs is a 16.9 kDa, recombinant, disulphide-rich, protein encompassing this C-terminal domain. Using conventional triple resonance experiments 93 % of the 1H, 15N and 13C assignment has been achieved, accounting for all assignment apart from a flexible N-terminus cloning artefact and an undefined loop. ; _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 Marie Phelan . M. . 15996 2 Chuong-Thu Thai . . . 15996 3 Andrew Herbert . P. . 15996 4 Juraj Bella . . . 15996 5 Dusan Uhrin . . . 15996 6 Ronald Ogata . T. . 15996 7 Paul Barlow . N. . 15996 8 Janice Bramham . . . 15996 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID . . 'Torrey Pines Institute for Molecular Studies' . 15996 1 . 'Edinburgh Biomolecular NMR Unit' . 15996 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 15996 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 578 15996 '15N chemical shifts' 159 15996 '1H chemical shifts' 939 15996 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 3 . . 2009-08-20 2008-10-21 update BMRB 'added PubMed ID' 15996 2 . . 2009-05-22 2008-10-21 update BMRB 'complete entry citation' 15996 1 . . 2009-01-15 2008-10-21 original author 'original release' 15996 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2WCY 'BMRB Entry Tracking System' 15996 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 15996 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI 10.1007/s12104-008-9139-z _Citation.PubMed_ID 19636945 _Citation.Full_citation . _Citation.Title '1H, 15N and 13C resonance assignment of the pair of Factor-I like modules of the complement protein C7' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assign.' _Citation.Journal_name_full . _Citation.Journal_volume 3 _Citation.Journal_issue 1 _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 49 _Citation.Page_last 52 _Citation.Year 2009 _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 Marie Phelan . M. . 15996 1 2 Chuong-Thu Thai . . . 15996 1 3 Andrew Herbert . P. . 15996 1 4 Juraj Bella . . . 15996 1 5 Dusan Uhrin . . . 15996 1 6 Ronald Ogata . T. . 15996 1 7 Paul Barlow . N. . 15996 1 8 Janice Bramham . . . 15996 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID C7 15996 1 complement 15996 1 'factor I module' 15996 1 FIM 15996 1 'membrane attack complex' 15996 1 NMR 15996 1 'resonance assignment' 15996 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 15996 _Assembly.ID 1 _Assembly.Name 'complement component C7' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass 16937.6 _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-FIMs 1 $C7-FIMs A . yes native no no . . . 15996 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID yes GenBank NP_000578 . . . . . 'C7 (Homo sapiens): complement component 7' 15996 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_C7-FIMs _Entity.Sf_category entity _Entity.Sf_framecode C7-FIMs _Entity.Entry_ID 15996 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name C7-FIMs _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSHMNPLTQAVPKCQRWEKL QNSRCVCKMPYECGPSLDVC AQDERSKRILPLTVCKMHVL HCQGRNYTLTGRDSCTLPAS AEKACGACPLWGKCDAESSK CVCREASECEEEGFSICVEV NGKEQTMSECEAGALRCRGQ SISVTSIRPCAAETQ ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 155 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all disulfide bound' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment C7-FIMs _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 16937.6 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details ; 4 N-terminal residues are vector-derived: G689, S690, H691 and M692. The residues 5 to 155 correspond to residues 693 to 843 within the full length protein. The protein has eighteen cysteines that are shown by mass spectrometry to form nine disulphide bonds. The predicted disulphide bonding pattern has yet to be confirmed experimentally. ; _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-26 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 no PDB 2WCY . "Nmr Solution Structure Of Factor I-Like Modules Of Complement C7" . . . . . 100.00 155 100.00 100.00 3.56e-107 . . . . 15996 1 2 no DBJ BAF83038 . "unnamed protein product [Homo sapiens]" . . . . . 97.42 843 100.00 100.00 3.39e-97 . . . . 15996 1 3 no DBJ BAG35608 . "unnamed protein product [Homo sapiens]" . . . . . 97.42 843 100.00 100.00 3.05e-97 . . . . 15996 1 4 no DBJ BAJ20698 . "complement component 7 [synthetic construct]" . . . . . 97.42 843 100.00 100.00 3.18e-97 . . . . 15996 1 5 no EMBL CAA60121 . "complement C7 [Homo sapiens]" . . . . . 82.58 820 100.00 100.00 6.20e-81 . . . . 15996 1 6 no EMBL CAH91280 . "hypothetical protein [Pongo abelii]" . . . . . 97.42 843 98.01 99.34 5.55e-95 . . . . 15996 1 7 no GB AAA51861 . "complement protein C7 precursor [Homo sapiens]" . . . . . 97.42 843 100.00 100.00 3.73e-97 . . . . 15996 1 8 no GB AAH63851 . "Complement component 7 [Homo sapiens]" . . . . . 97.42 843 100.00 100.00 3.18e-97 . . . . 15996 1 9 no GB ADR82762 . "complement component 7 [synthetic construct]" . . . . . 97.42 843 100.00 100.00 3.18e-97 . . . . 15996 1 10 no GB AIC48386 . "C7, partial [synthetic construct]" . . . . . 97.42 843 100.00 100.00 3.18e-97 . . . . 15996 1 11 no GB AKI71774 . "C7, partial [synthetic construct]" . . . . . 97.42 843 100.00 100.00 2.64e-97 . . . . 15996 1 12 no REF NP_000578 . "complement component C7 precursor [Homo sapiens]" . . . . . 97.42 843 100.00 100.00 3.18e-97 . . . . 15996 1 13 no REF NP_001125756 . "complement component C7 precursor [Pongo abelii]" . . . . . 97.42 843 98.01 99.34 5.55e-95 . . . . 15996 1 14 no REF XP_001085533 . "PREDICTED: complement component C7-like [Macaca mulatta]" . . . . . 97.42 843 97.35 99.34 1.10e-94 . . . . 15996 1 15 no REF XP_001138984 . "PREDICTED: complement component C7 [Pan troglodytes]" . . . . . 97.42 843 98.68 99.34 4.23e-96 . . . . 15996 1 16 no REF XP_003811023 . "PREDICTED: complement component C7 isoform X1 [Pan paniscus]" . . . . . 97.42 843 98.68 99.34 5.33e-96 . . . . 15996 1 17 no SP P10643 . "RecName: Full=Complement component C7; Flags: Precursor" . . . . . 97.42 843 100.00 100.00 3.18e-97 . . . . 15996 1 18 no SP Q5RAD0 . "RecName: Full=Complement component C7; Flags: Precursor" . . . . . 97.42 843 98.01 99.34 5.55e-95 . . . . 15996 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 1 689 GLY . 15996 1 2 690 SER . 15996 1 3 691 HIS . 15996 1 4 692 MET . 15996 1 5 693 ASN . 15996 1 6 694 PRO . 15996 1 7 695 LEU . 15996 1 8 696 THR . 15996 1 9 697 GLN . 15996 1 10 698 ALA . 15996 1 11 699 VAL . 15996 1 12 700 PRO . 15996 1 13 701 LYS . 15996 1 14 702 CYS . 15996 1 15 703 GLN . 15996 1 16 704 ARG . 15996 1 17 705 TRP . 15996 1 18 706 GLU . 15996 1 19 707 LYS . 15996 1 20 708 LEU . 15996 1 21 709 GLN . 15996 1 22 710 ASN . 15996 1 23 711 SER . 15996 1 24 712 ARG . 15996 1 25 713 CYS . 15996 1 26 714 VAL . 15996 1 27 715 CYS . 15996 1 28 716 LYS . 15996 1 29 717 MET . 15996 1 30 718 PRO . 15996 1 31 719 TYR . 15996 1 32 720 GLU . 15996 1 33 721 CYS . 15996 1 34 722 GLY . 15996 1 35 723 PRO . 15996 1 36 724 SER . 15996 1 37 725 LEU . 15996 1 38 726 ASP . 15996 1 39 727 VAL . 15996 1 40 728 CYS . 15996 1 41 729 ALA . 15996 1 42 730 GLN . 15996 1 43 731 ASP . 15996 1 44 732 GLU . 15996 1 45 733 ARG . 15996 1 46 734 SER . 15996 1 47 735 LYS . 15996 1 48 736 ARG . 15996 1 49 737 ILE . 15996 1 50 738 LEU . 15996 1 51 739 PRO . 15996 1 52 740 LEU . 15996 1 53 741 THR . 15996 1 54 742 VAL . 15996 1 55 743 CYS . 15996 1 56 744 LYS . 15996 1 57 745 MET . 15996 1 58 746 HIS . 15996 1 59 747 VAL . 15996 1 60 748 LEU . 15996 1 61 749 HIS . 15996 1 62 750 CYS . 15996 1 63 751 GLN . 15996 1 64 752 GLY . 15996 1 65 753 ARG . 15996 1 66 754 ASN . 15996 1 67 755 TYR . 15996 1 68 756 THR . 15996 1 69 757 LEU . 15996 1 70 758 THR . 15996 1 71 759 GLY . 15996 1 72 760 ARG . 15996 1 73 761 ASP . 15996 1 74 762 SER . 15996 1 75 763 CYS . 15996 1 76 764 THR . 15996 1 77 765 LEU . 15996 1 78 766 PRO . 15996 1 79 767 ALA . 15996 1 80 768 SER . 15996 1 81 769 ALA . 15996 1 82 770 GLU . 15996 1 83 771 LYS . 15996 1 84 772 ALA . 15996 1 85 773 CYS . 15996 1 86 774 GLY . 15996 1 87 775 ALA . 15996 1 88 776 CYS . 15996 1 89 777 PRO . 15996 1 90 778 LEU . 15996 1 91 779 TRP . 15996 1 92 780 GLY . 15996 1 93 781 LYS . 15996 1 94 782 CYS . 15996 1 95 783 ASP . 15996 1 96 784 ALA . 15996 1 97 785 GLU . 15996 1 98 786 SER . 15996 1 99 787 SER . 15996 1 100 788 LYS . 15996 1 101 789 CYS . 15996 1 102 790 VAL . 15996 1 103 791 CYS . 15996 1 104 792 ARG . 15996 1 105 793 GLU . 15996 1 106 794 ALA . 15996 1 107 795 SER . 15996 1 108 796 GLU . 15996 1 109 797 CYS . 15996 1 110 798 GLU . 15996 1 111 799 GLU . 15996 1 112 800 GLU . 15996 1 113 801 GLY . 15996 1 114 802 PHE . 15996 1 115 803 SER . 15996 1 116 804 ILE . 15996 1 117 805 CYS . 15996 1 118 806 VAL . 15996 1 119 807 GLU . 15996 1 120 808 VAL . 15996 1 121 809 ASN . 15996 1 122 810 GLY . 15996 1 123 811 LYS . 15996 1 124 812 GLU . 15996 1 125 813 GLN . 15996 1 126 814 THR . 15996 1 127 815 MET . 15996 1 128 816 SER . 15996 1 129 817 GLU . 15996 1 130 818 CYS . 15996 1 131 819 GLU . 15996 1 132 820 ALA . 15996 1 133 821 GLY . 15996 1 134 822 ALA . 15996 1 135 823 LEU . 15996 1 136 824 ARG . 15996 1 137 825 CYS . 15996 1 138 826 ARG . 15996 1 139 827 GLY . 15996 1 140 828 GLN . 15996 1 141 829 SER . 15996 1 142 830 ILE . 15996 1 143 831 SER . 15996 1 144 832 VAL . 15996 1 145 833 THR . 15996 1 146 834 SER . 15996 1 147 835 ILE . 15996 1 148 836 ARG . 15996 1 149 837 PRO . 15996 1 150 838 CYS . 15996 1 151 839 ALA . 15996 1 152 840 ALA . 15996 1 153 841 GLU . 15996 1 154 842 THR . 15996 1 155 843 GLN . 15996 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 15996 1 . SER 2 2 15996 1 . HIS 3 3 15996 1 . MET 4 4 15996 1 . ASN 5 5 15996 1 . PRO 6 6 15996 1 . LEU 7 7 15996 1 . THR 8 8 15996 1 . GLN 9 9 15996 1 . ALA 10 10 15996 1 . VAL 11 11 15996 1 . PRO 12 12 15996 1 . LYS 13 13 15996 1 . CYS 14 14 15996 1 . GLN 15 15 15996 1 . ARG 16 16 15996 1 . TRP 17 17 15996 1 . GLU 18 18 15996 1 . LYS 19 19 15996 1 . LEU 20 20 15996 1 . GLN 21 21 15996 1 . ASN 22 22 15996 1 . SER 23 23 15996 1 . ARG 24 24 15996 1 . CYS 25 25 15996 1 . VAL 26 26 15996 1 . CYS 27 27 15996 1 . LYS 28 28 15996 1 . MET 29 29 15996 1 . PRO 30 30 15996 1 . TYR 31 31 15996 1 . GLU 32 32 15996 1 . CYS 33 33 15996 1 . GLY 34 34 15996 1 . PRO 35 35 15996 1 . SER 36 36 15996 1 . LEU 37 37 15996 1 . ASP 38 38 15996 1 . VAL 39 39 15996 1 . CYS 40 40 15996 1 . ALA 41 41 15996 1 . GLN 42 42 15996 1 . ASP 43 43 15996 1 . GLU 44 44 15996 1 . ARG 45 45 15996 1 . SER 46 46 15996 1 . LYS 47 47 15996 1 . ARG 48 48 15996 1 . ILE 49 49 15996 1 . LEU 50 50 15996 1 . PRO 51 51 15996 1 . LEU 52 52 15996 1 . THR 53 53 15996 1 . VAL 54 54 15996 1 . CYS 55 55 15996 1 . LYS 56 56 15996 1 . MET 57 57 15996 1 . HIS 58 58 15996 1 . VAL 59 59 15996 1 . LEU 60 60 15996 1 . HIS 61 61 15996 1 . CYS 62 62 15996 1 . GLN 63 63 15996 1 . GLY 64 64 15996 1 . ARG 65 65 15996 1 . ASN 66 66 15996 1 . TYR 67 67 15996 1 . THR 68 68 15996 1 . LEU 69 69 15996 1 . THR 70 70 15996 1 . GLY 71 71 15996 1 . ARG 72 72 15996 1 . ASP 73 73 15996 1 . SER 74 74 15996 1 . CYS 75 75 15996 1 . THR 76 76 15996 1 . LEU 77 77 15996 1 . PRO 78 78 15996 1 . ALA 79 79 15996 1 . SER 80 80 15996 1 . ALA 81 81 15996 1 . GLU 82 82 15996 1 . LYS 83 83 15996 1 . ALA 84 84 15996 1 . CYS 85 85 15996 1 . GLY 86 86 15996 1 . ALA 87 87 15996 1 . CYS 88 88 15996 1 . PRO 89 89 15996 1 . LEU 90 90 15996 1 . TRP 91 91 15996 1 . GLY 92 92 15996 1 . LYS 93 93 15996 1 . CYS 94 94 15996 1 . ASP 95 95 15996 1 . ALA 96 96 15996 1 . GLU 97 97 15996 1 . SER 98 98 15996 1 . SER 99 99 15996 1 . LYS 100 100 15996 1 . CYS 101 101 15996 1 . VAL 102 102 15996 1 . CYS 103 103 15996 1 . ARG 104 104 15996 1 . GLU 105 105 15996 1 . ALA 106 106 15996 1 . SER 107 107 15996 1 . GLU 108 108 15996 1 . CYS 109 109 15996 1 . GLU 110 110 15996 1 . GLU 111 111 15996 1 . GLU 112 112 15996 1 . GLY 113 113 15996 1 . PHE 114 114 15996 1 . SER 115 115 15996 1 . ILE 116 116 15996 1 . CYS 117 117 15996 1 . VAL 118 118 15996 1 . GLU 119 119 15996 1 . VAL 120 120 15996 1 . ASN 121 121 15996 1 . GLY 122 122 15996 1 . LYS 123 123 15996 1 . GLU 124 124 15996 1 . GLN 125 125 15996 1 . THR 126 126 15996 1 . MET 127 127 15996 1 . SER 128 128 15996 1 . GLU 129 129 15996 1 . CYS 130 130 15996 1 . GLU 131 131 15996 1 . ALA 132 132 15996 1 . GLY 133 133 15996 1 . ALA 134 134 15996 1 . LEU 135 135 15996 1 . ARG 136 136 15996 1 . CYS 137 137 15996 1 . ARG 138 138 15996 1 . GLY 139 139 15996 1 . GLN 140 140 15996 1 . SER 141 141 15996 1 . ILE 142 142 15996 1 . SER 143 143 15996 1 . VAL 144 144 15996 1 . THR 145 145 15996 1 . SER 146 146 15996 1 . ILE 147 147 15996 1 . ARG 148 148 15996 1 . PRO 149 149 15996 1 . CYS 150 150 15996 1 . ALA 151 151 15996 1 . ALA 152 152 15996 1 . GLU 153 153 15996 1 . THR 154 154 15996 1 . GLN 155 155 15996 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 15996 _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-FIMs . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 15996 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 15996 _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-FIMs . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli 'Origami B' . . . . . . . . . . . . . . . pET15b . . . . . . 15996 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 15996 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 C7-FIMs '[U-98% 13C; U-98% 15N]' . . 1 $C7-FIMs . . 0.2-0.3 . . mM . . . . 15996 1 2 'potassium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 15996 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 15996 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 C7-FIMs '[U-98% 13C; U-98% 15N]' . . 1 $C7-FIMs . . 0.2-0.3 . . mM . . . . 15996 2 2 'potassium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 15996 2 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 15996 _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 6.5 . pH 15996 1 pressure 1 . atm 15996 1 temperature 298 . K 15996 1 stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 15996 _Software.ID 1 _Software.Name TOPSPIN _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 15996 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 15996 1 stop_ save_ save_AZARA _Software.Sf_category software _Software.Sf_framecode AZARA _Software.Entry_ID 15996 _Software.ID 2 _Software.Name AZARA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Boucher . . 15996 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 15996 2 stop_ save_ save_CCPN_Analysis _Software.Sf_category software _Software.Sf_framecode CCPN_Analysis _Software.Entry_ID 15996 _Software.ID 3 _Software.Name CCPN_Analysis _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID CCPN . . 15996 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 15996 3 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 15996 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details 'equipped with cryoprobe' _NMR_spectrometer.Manufacturer Bruker _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 15996 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details 'equipped with cryoprobe' _NMR_spectrometer.Manufacturer Bruker _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 15996 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 800 'equipped with cryoprobe' . . 15996 1 2 spectrometer_2 Bruker Avance . 600 'equipped with cryoprobe' . . 15996 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 15996 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15996 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15996 1 3 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15996 1 4 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15996 1 5 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 15996 1 6 '3D H(CCO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 15996 1 7 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 15996 1 8 '3D HBHANH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 15996 1 9 '3D HCCH-TOCSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15996 1 10 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15996 1 11 '3D HN(CA)CO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15996 1 12 '2D (HB)CB(CGCD)HD' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15996 1 13 '2D (HB)CB(CGCDCE)HE' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15996 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 15996 _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 0.0 . indirect 0.251449530 . . . . . . . . . 15996 1 H 1 water protons . . . . ppm 4.766 internal direct 1.0 . . . . . . . . . 15996 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 15996 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 15996 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 15996 1 2 '2D 1H-13C HSQC' . . . 15996 1 3 '3D CBCA(CO)NH' . . . 15996 1 4 '3D HNCACB' . . . 15996 1 5 '3D C(CO)NH' . . . 15996 1 6 '3D H(CCO)NH' . . . 15996 1 7 '3D HBHA(CO)NH' . . . 15996 1 8 '3D HBHANH' . . . 15996 1 9 '3D HCCH-TOCSY' . . . 15996 1 10 '3D HNCO' . . . 15996 1 11 '3D HN(CA)CO' . . . 15996 1 12 '2D (HB)CB(CGCD)HD' . . . 15996 1 13 '2D (HB)CB(CGCDCE)HE' . . . 15996 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $TOPSPIN . . 15996 1 2 $AZARA . . 15996 1 3 $CCPN_Analysis . . 15996 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 HA3 H 1 3.860 0.013 . 1 . . . . 689 GLY HA3 . 15996 1 2 . 1 1 1 1 GLY CA C 13 43.260 0.043 . 1 . . . . 689 GLY CA . 15996 1 3 . 1 1 2 2 SER H H 1 8.661 0.006 . 1 . . . . 690 SER H . 15996 1 4 . 1 1 2 2 SER HA H 1 4.446 0.006 . 1 . . . . 690 SER HA . 15996 1 5 . 1 1 2 2 SER HB3 H 1 3.804 0.006 . 1 . . . . 690 SER HB3 . 15996 1 6 . 1 1 2 2 SER CA C 13 58.386 0.066 . 1 . . . . 690 SER CA . 15996 1 7 . 1 1 2 2 SER CB C 13 63.976 0.028 . 1 . . . . 690 SER CB . 15996 1 8 . 1 1 2 2 SER N N 15 115.723 0.026 . 1 . . . . 690 SER N . 15996 1 9 . 1 1 3 3 HIS H H 1 8.492 0.003 . 1 . . . . 691 HIS H . 15996 1 10 . 1 1 3 3 HIS HA H 1 4.690 0.001 . 1 . . . . 691 HIS HA . 15996 1 11 . 1 1 3 3 HIS HB2 H 1 3.205 0.006 . 2 . . . . 691 HIS HB2 . 15996 1 12 . 1 1 3 3 HIS HB3 H 1 3.249 0.001 . 2 . . . . 691 HIS HB3 . 15996 1 13 . 1 1 3 3 HIS HD2 H 1 7.197 0.002 . 1 . . . . 691 HIS HD2 . 15996 1 14 . 1 1 3 3 HIS CA C 13 55.386 0.041 . 1 . . . . 691 HIS CA . 15996 1 15 . 1 1 3 3 HIS CB C 13 29.472 0.048 . 1 . . . . 691 HIS CB . 15996 1 16 . 1 1 3 3 HIS CD2 C 13 120.085 0.011 . 1 . . . . 691 HIS CD2 . 15996 1 17 . 1 1 3 3 HIS N N 15 120.283 0.004 . 1 . . . . 691 HIS N . 15996 1 18 . 1 1 4 4 MET H H 1 8.250 0.003 . 1 . . . . 692 MET H . 15996 1 19 . 1 1 4 4 MET HA H 1 4.133 0.004 . 1 . . . . 692 MET HA . 15996 1 20 . 1 1 4 4 MET HB3 H 1 1.552 0.001 . 1 . . . . 692 MET HB3 . 15996 1 21 . 1 1 4 4 MET HE1 H 1 2.087 0.001 . 1 . . . . 692 MET HE1 . 15996 1 22 . 1 1 4 4 MET HE2 H 1 2.087 0.001 . 1 . . . . 692 MET HE2 . 15996 1 23 . 1 1 4 4 MET HE3 H 1 2.087 0.001 . 1 . . . . 692 MET HE3 . 15996 1 24 . 1 1 4 4 MET CA C 13 57.209 0.004 . 1 . . . . 692 MET CA . 15996 1 25 . 1 1 4 4 MET CB C 13 33.312 0.001 . 1 . . . . 692 MET CB . 15996 1 26 . 1 1 4 4 MET CE C 13 16.608 0.001 . 1 . . . . 692 MET CE . 15996 1 27 . 1 1 4 4 MET N N 15 127.278 0.029 . 1 . . . . 692 MET N . 15996 1 28 . 1 1 5 5 ASN CA C 13 51.745 0.015 . 1 . . . . 693 ASN CA . 15996 1 29 . 1 1 6 6 PRO HA H 1 4.307 0.012 . 1 . . . . 694 PRO HA . 15996 1 30 . 1 1 6 6 PRO HB3 H 1 2.376 0.012 . 1 . . . . 694 PRO HB3 . 15996 1 31 . 1 1 6 6 PRO HG2 H 1 2.037 0.021 . 2 . . . . 694 PRO HG2 . 15996 1 32 . 1 1 6 6 PRO HG3 H 1 2.490 0.003 . 2 . . . . 694 PRO HG3 . 15996 1 33 . 1 1 6 6 PRO CA C 13 59.291 0.062 . 1 . . . . 694 PRO CA . 15996 1 34 . 1 1 6 6 PRO CB C 13 31.929 0.058 . 1 . . . . 694 PRO CB . 15996 1 35 . 1 1 6 6 PRO CG C 13 27.825 0.044 . 1 . . . . 694 PRO CG . 15996 1 36 . 1 1 7 7 LEU H H 1 7.854 0.004 . 1 . . . . 695 LEU H . 15996 1 37 . 1 1 7 7 LEU HA H 1 4.063 0.008 . 1 . . . . 695 LEU HA . 15996 1 38 . 1 1 7 7 LEU HB2 H 1 1.701 0.006 . 2 . . . . 695 LEU HB2 . 15996 1 39 . 1 1 7 7 LEU HB3 H 1 1.644 0.005 . 2 . . . . 695 LEU HB3 . 15996 1 40 . 1 1 7 7 LEU HG H 1 0.916 0.007 . 1 . . . . 695 LEU HG . 15996 1 41 . 1 1 7 7 LEU CA C 13 54.722 0.052 . 1 . . . . 695 LEU CA . 15996 1 42 . 1 1 7 7 LEU CB C 13 42.554 0.100 . 1 . . . . 695 LEU CB . 15996 1 43 . 1 1 7 7 LEU N N 15 125.525 0.007 . 1 . . . . 695 LEU N . 15996 1 44 . 1 1 8 8 THR H H 1 8.652 0.010 . 1 . . . . 696 THR H . 15996 1 45 . 1 1 8 8 THR HA H 1 4.331 0.014 . 1 . . . . 696 THR HA . 15996 1 46 . 1 1 8 8 THR HB H 1 4.080 0.004 . 1 . . . . 696 THR HB . 15996 1 47 . 1 1 8 8 THR HG21 H 1 1.173 0.014 . 1 . . . . 696 THR HG21 . 15996 1 48 . 1 1 8 8 THR HG22 H 1 1.173 0.014 . 1 . . . . 696 THR HG22 . 15996 1 49 . 1 1 8 8 THR HG23 H 1 1.173 0.014 . 1 . . . . 696 THR HG23 . 15996 1 50 . 1 1 8 8 THR C C 13 178.241 0.001 . 1 . . . . 696 THR C . 15996 1 51 . 1 1 8 8 THR CA C 13 62.040 0.023 . 1 . . . . 696 THR CA . 15996 1 52 . 1 1 8 8 THR CB C 13 69.801 0.040 . 1 . . . . 696 THR CB . 15996 1 53 . 1 1 8 8 THR CG2 C 13 21.492 0.102 . 1 . . . . 696 THR CG2 . 15996 1 54 . 1 1 8 8 THR N N 15 119.051 0.031 . 1 . . . . 696 THR N . 15996 1 55 . 1 1 9 9 GLN H H 1 8.523 0.002 . 1 . . . . 697 GLN H . 15996 1 56 . 1 1 9 9 GLN HA H 1 4.314 0.018 . 1 . . . . 697 GLN HA . 15996 1 57 . 1 1 9 9 GLN HB2 H 1 2.044 0.003 . 2 . . . . 697 GLN HB2 . 15996 1 58 . 1 1 9 9 GLN HB3 H 1 1.934 0.013 . 2 . . . . 697 GLN HB3 . 15996 1 59 . 1 1 9 9 GLN HE21 H 1 6.851 0.005 . 1 . . . . 697 GLN HE21 . 15996 1 60 . 1 1 9 9 GLN HE22 H 1 7.521 0.010 . 1 . . . . 697 GLN HE22 . 15996 1 61 . 1 1 9 9 GLN HG2 H 1 2.316 0.020 . 2 . . . . 697 GLN HG2 . 15996 1 62 . 1 1 9 9 GLN HG3 H 1 2.300 0.001 . 2 . . . . 697 GLN HG3 . 15996 1 63 . 1 1 9 9 GLN C C 13 176.838 0.014 . 1 . . . . 697 GLN C . 15996 1 64 . 1 1 9 9 GLN CA C 13 55.494 0.014 . 1 . . . . 697 GLN CA . 15996 1 65 . 1 1 9 9 GLN CB C 13 29.733 0.093 . 1 . . . . 697 GLN CB . 15996 1 66 . 1 1 9 9 GLN CG C 13 33.618 0.050 . 1 . . . . 697 GLN CG . 15996 1 67 . 1 1 9 9 GLN N N 15 124.287 0.025 . 1 . . . . 697 GLN N . 15996 1 68 . 1 1 9 9 GLN NE2 N 15 112.488 0.111 . 1 . . . . 697 GLN NE2 . 15996 1 69 . 1 1 10 10 ALA H H 1 8.410 0.002 . 1 . . . . 698 ALA H . 15996 1 70 . 1 1 10 10 ALA HA H 1 4.295 0.007 . 1 . . . . 698 ALA HA . 15996 1 71 . 1 1 10 10 ALA HB1 H 1 1.350 0.046 . 1 . . . . 698 ALA HB1 . 15996 1 72 . 1 1 10 10 ALA HB2 H 1 1.350 0.046 . 1 . . . . 698 ALA HB2 . 15996 1 73 . 1 1 10 10 ALA HB3 H 1 1.350 0.046 . 1 . . . . 698 ALA HB3 . 15996 1 74 . 1 1 10 10 ALA C C 13 174.657 0.034 . 1 . . . . 698 ALA C . 15996 1 75 . 1 1 10 10 ALA CA C 13 52.258 0.033 . 1 . . . . 698 ALA CA . 15996 1 76 . 1 1 10 10 ALA CB C 13 18.954 0.165 . 1 . . . . 698 ALA CB . 15996 1 77 . 1 1 10 10 ALA N N 15 126.594 0.035 . 1 . . . . 698 ALA N . 15996 1 78 . 1 1 11 11 VAL H H 1 8.134 0.003 . 1 . . . . 699 VAL H . 15996 1 79 . 1 1 11 11 VAL HA H 1 4.355 0.016 . 1 . . . . 699 VAL HA . 15996 1 80 . 1 1 11 11 VAL HB H 1 1.979 0.012 . 1 . . . . 699 VAL HB . 15996 1 81 . 1 1 11 11 VAL HG11 H 1 0.943 0.012 . 2 . . . . 699 VAL HG11 . 15996 1 82 . 1 1 11 11 VAL HG12 H 1 0.943 0.012 . 2 . . . . 699 VAL HG12 . 15996 1 83 . 1 1 11 11 VAL HG13 H 1 0.943 0.012 . 2 . . . . 699 VAL HG13 . 15996 1 84 . 1 1 11 11 VAL HG21 H 1 0.886 0.003 . 2 . . . . 699 VAL HG21 . 15996 1 85 . 1 1 11 11 VAL HG22 H 1 0.886 0.003 . 2 . . . . 699 VAL HG22 . 15996 1 86 . 1 1 11 11 VAL HG23 H 1 0.886 0.003 . 2 . . . . 699 VAL HG23 . 15996 1 87 . 1 1 11 11 VAL C C 13 177.762 0.001 . 1 . . . . 699 VAL C . 15996 1 88 . 1 1 11 11 VAL CA C 13 59.646 0.131 . 1 . . . . 699 VAL CA . 15996 1 89 . 1 1 11 11 VAL CB C 13 32.621 0.140 . 1 . . . . 699 VAL CB . 15996 1 90 . 1 1 11 11 VAL CG1 C 13 21.263 0.043 . 2 . . . . 699 VAL CG1 . 15996 1 91 . 1 1 11 11 VAL CG2 C 13 20.150 0.067 . 2 . . . . 699 VAL CG2 . 15996 1 92 . 1 1 11 11 VAL N N 15 121.225 0.058 . 1 . . . . 699 VAL N . 15996 1 93 . 1 1 12 12 PRO HA H 1 4.299 0.007 . 1 . . . . 700 PRO HA . 15996 1 94 . 1 1 12 12 PRO HB2 H 1 1.783 0.005 . 2 . . . . 700 PRO HB2 . 15996 1 95 . 1 1 12 12 PRO HB3 H 1 2.161 0.003 . 2 . . . . 700 PRO HB3 . 15996 1 96 . 1 1 12 12 PRO HD2 H 1 3.754 0.005 . 2 . . . . 700 PRO HD2 . 15996 1 97 . 1 1 12 12 PRO HD3 H 1 3.524 0.005 . 2 . . . . 700 PRO HD3 . 15996 1 98 . 1 1 12 12 PRO HG2 H 1 1.906 0.007 . 2 . . . . 700 PRO HG2 . 15996 1 99 . 1 1 12 12 PRO HG3 H 1 1.934 0.003 . 2 . . . . 700 PRO HG3 . 15996 1 100 . 1 1 12 12 PRO C C 13 176.810 0.005 . 1 . . . . 700 PRO C . 15996 1 101 . 1 1 12 12 PRO CA C 13 62.883 0.099 . 1 . . . . 700 PRO CA . 15996 1 102 . 1 1 12 12 PRO CB C 13 32.237 0.108 . 1 . . . . 700 PRO CB . 15996 1 103 . 1 1 12 12 PRO CD C 13 50.931 0.052 . 1 . . . . 700 PRO CD . 15996 1 104 . 1 1 12 12 PRO CG C 13 27.312 0.046 . 1 . . . . 700 PRO CG . 15996 1 105 . 1 1 13 13 LYS H H 1 8.138 0.004 . 1 . . . . 701 LYS H . 15996 1 106 . 1 1 13 13 LYS HA H 1 4.228 0.007 . 1 . . . . 701 LYS HA . 15996 1 107 . 1 1 13 13 LYS HB2 H 1 1.614 0.017 . 2 . . . . 701 LYS HB2 . 15996 1 108 . 1 1 13 13 LYS HB3 H 1 1.683 0.007 . 2 . . . . 701 LYS HB3 . 15996 1 109 . 1 1 13 13 LYS HD2 H 1 1.607 0.001 . 2 . . . . 701 LYS HD2 . 15996 1 110 . 1 1 13 13 LYS HD3 H 1 1.592 0.007 . 2 . . . . 701 LYS HD3 . 15996 1 111 . 1 1 13 13 LYS HE2 H 1 2.899 0.012 . 2 . . . . 701 LYS HE2 . 15996 1 112 . 1 1 13 13 LYS HE3 H 1 2.900 0.001 . 2 . . . . 701 LYS HE3 . 15996 1 113 . 1 1 13 13 LYS HG2 H 1 1.276 0.004 . 2 . . . . 701 LYS HG2 . 15996 1 114 . 1 1 13 13 LYS HG3 H 1 1.360 0.005 . 2 . . . . 701 LYS HG3 . 15996 1 115 . 1 1 13 13 LYS C C 13 175.650 0.007 . 1 . . . . 701 LYS C . 15996 1 116 . 1 1 13 13 LYS CA C 13 55.441 0.085 . 1 . . . . 701 LYS CA . 15996 1 117 . 1 1 13 13 LYS CB C 13 32.814 0.054 . 1 . . . . 701 LYS CB . 15996 1 118 . 1 1 13 13 LYS CD C 13 28.979 0.079 . 1 . . . . 701 LYS CD . 15996 1 119 . 1 1 13 13 LYS CE C 13 41.954 0.150 . 1 . . . . 701 LYS CE . 15996 1 120 . 1 1 13 13 LYS CG C 13 24.639 0.044 . 1 . . . . 701 LYS CG . 15996 1 121 . 1 1 13 13 LYS N N 15 120.547 0.022 . 1 . . . . 701 LYS N . 15996 1 122 . 1 1 14 14 CYS H H 1 8.209 0.007 . 1 . . . . 702 CYS H . 15996 1 123 . 1 1 14 14 CYS HA H 1 4.809 0.013 . 1 . . . . 702 CYS HA . 15996 1 124 . 1 1 14 14 CYS HB2 H 1 2.317 0.007 . 2 . . . . 702 CYS HB2 . 15996 1 125 . 1 1 14 14 CYS HB3 H 1 3.256 0.008 . 2 . . . . 702 CYS HB3 . 15996 1 126 . 1 1 14 14 CYS C C 13 176.437 0.003 . 1 . . . . 702 CYS C . 15996 1 127 . 1 1 14 14 CYS CA C 13 52.035 0.064 . 1 . . . . 702 CYS CA . 15996 1 128 . 1 1 14 14 CYS CB C 13 36.297 0.105 . 1 . . . . 702 CYS CB . 15996 1 129 . 1 1 14 14 CYS N N 15 121.506 0.065 . 1 . . . . 702 CYS N . 15996 1 130 . 1 1 15 15 GLN H H 1 8.926 0.006 . 1 . . . . 703 GLN H . 15996 1 131 . 1 1 15 15 GLN HA H 1 3.830 0.006 . 1 . . . . 703 GLN HA . 15996 1 132 . 1 1 15 15 GLN HB2 H 1 -0.164 0.003 . 2 . . . . 703 GLN HB2 . 15996 1 133 . 1 1 15 15 GLN HB3 H 1 0.273 0.006 . 2 . . . . 703 GLN HB3 . 15996 1 134 . 1 1 15 15 GLN HE21 H 1 6.807 0.002 . 1 . . . . 703 GLN HE21 . 15996 1 135 . 1 1 15 15 GLN HE22 H 1 7.599 0.001 . 1 . . . . 703 GLN HE22 . 15996 1 136 . 1 1 15 15 GLN HG2 H 1 2.099 0.007 . 2 . . . . 703 GLN HG2 . 15996 1 137 . 1 1 15 15 GLN HG3 H 1 2.089 0.002 . 2 . . . . 703 GLN HG3 . 15996 1 138 . 1 1 15 15 GLN C C 13 174.422 0.011 . 1 . . . . 703 GLN C . 15996 1 139 . 1 1 15 15 GLN CA C 13 54.493 0.061 . 1 . . . . 703 GLN CA . 15996 1 140 . 1 1 15 15 GLN CB C 13 26.722 0.085 . 1 . . . . 703 GLN CB . 15996 1 141 . 1 1 15 15 GLN CG C 13 32.596 0.088 . 1 . . . . 703 GLN CG . 15996 1 142 . 1 1 15 15 GLN N N 15 119.527 0.053 . 1 . . . . 703 GLN N . 15996 1 143 . 1 1 15 15 GLN NE2 N 15 113.158 0.025 . 1 . . . . 703 GLN NE2 . 15996 1 144 . 1 1 16 16 ARG H H 1 8.575 0.005 . 1 . . . . 704 ARG H . 15996 1 145 . 1 1 16 16 ARG HA H 1 3.827 0.006 . 1 . . . . 704 ARG HA . 15996 1 146 . 1 1 16 16 ARG HB2 H 1 1.464 0.001 . 2 . . . . 704 ARG HB2 . 15996 1 147 . 1 1 16 16 ARG HB3 H 1 1.465 0.008 . 2 . . . . 704 ARG HB3 . 15996 1 148 . 1 1 16 16 ARG HD2 H 1 2.326 0.012 . 2 . . . . 704 ARG HD2 . 15996 1 149 . 1 1 16 16 ARG HD3 H 1 2.099 0.011 . 2 . . . . 704 ARG HD3 . 15996 1 150 . 1 1 16 16 ARG HE H 1 6.993 0.003 . 1 . . . . 704 ARG HE . 15996 1 151 . 1 1 16 16 ARG HG2 H 1 1.320 0.009 . 2 . . . . 704 ARG HG2 . 15996 1 152 . 1 1 16 16 ARG HG3 H 1 1.476 0.010 . 2 . . . . 704 ARG HG3 . 15996 1 153 . 1 1 16 16 ARG C C 13 175.919 0.022 . 1 . . . . 704 ARG C . 15996 1 154 . 1 1 16 16 ARG CA C 13 59.245 0.029 . 1 . . . . 704 ARG CA . 15996 1 155 . 1 1 16 16 ARG CB C 13 30.586 0.104 . 1 . . . . 704 ARG CB . 15996 1 156 . 1 1 16 16 ARG CD C 13 42.085 0.064 . 1 . . . . 704 ARG CD . 15996 1 157 . 1 1 16 16 ARG CG C 13 28.266 0.059 . 1 . . . . 704 ARG CG . 15996 1 158 . 1 1 16 16 ARG N N 15 119.098 0.040 . 1 . . . . 704 ARG N . 15996 1 159 . 1 1 16 16 ARG NE N 15 83.976 0.031 . 1 . . . . 704 ARG NE . 15996 1 160 . 1 1 17 17 TRP H H 1 6.353 0.005 . 1 . . . . 705 TRP H . 15996 1 161 . 1 1 17 17 TRP HA H 1 4.778 0.024 . 1 . . . . 705 TRP HA . 15996 1 162 . 1 1 17 17 TRP HB2 H 1 3.772 0.010 . 2 . . . . 705 TRP HB2 . 15996 1 163 . 1 1 17 17 TRP HB3 H 1 3.027 0.010 . 2 . . . . 705 TRP HB3 . 15996 1 164 . 1 1 17 17 TRP HD1 H 1 7.299 0.014 . 1 . . . . 705 TRP HD1 . 15996 1 165 . 1 1 17 17 TRP HE1 H 1 10.911 0.001 . 1 . . . . 705 TRP HE1 . 15996 1 166 . 1 1 17 17 TRP HE3 H 1 7.455 0.009 . 1 . . . . 705 TRP HE3 . 15996 1 167 . 1 1 17 17 TRP HH2 H 1 7.310 0.004 . 1 . . . . 705 TRP HH2 . 15996 1 168 . 1 1 17 17 TRP HZ2 H 1 7.586 0.005 . 1 . . . . 705 TRP HZ2 . 15996 1 169 . 1 1 17 17 TRP HZ3 H 1 7.187 0.032 . 1 . . . . 705 TRP HZ3 . 15996 1 170 . 1 1 17 17 TRP C C 13 179.354 0.023 . 1 . . . . 705 TRP C . 15996 1 171 . 1 1 17 17 TRP CA C 13 56.878 0.110 . 1 . . . . 705 TRP CA . 15996 1 172 . 1 1 17 17 TRP CB C 13 28.121 0.048 . 1 . . . . 705 TRP CB . 15996 1 173 . 1 1 17 17 TRP CD1 C 13 127.818 0.065 . 1 . . . . 705 TRP CD1 . 15996 1 174 . 1 1 17 17 TRP CE3 C 13 119.195 0.072 . 1 . . . . 705 TRP CE3 . 15996 1 175 . 1 1 17 17 TRP CH2 C 13 125.757 0.024 . 1 . . . . 705 TRP CH2 . 15996 1 176 . 1 1 17 17 TRP CZ2 C 13 115.612 0.050 . 1 . . . . 705 TRP CZ2 . 15996 1 177 . 1 1 17 17 TRP CZ3 C 13 123.393 0.080 . 1 . . . . 705 TRP CZ3 . 15996 1 178 . 1 1 17 17 TRP N N 15 110.847 0.032 . 1 . . . . 705 TRP N . 15996 1 179 . 1 1 17 17 TRP NE1 N 15 132.744 0.024 . 1 . . . . 705 TRP NE1 . 15996 1 180 . 1 1 18 18 GLU H H 1 7.356 0.007 . 1 . . . . 706 GLU H . 15996 1 181 . 1 1 18 18 GLU HA H 1 5.161 0.007 . 1 . . . . 706 GLU HA . 15996 1 182 . 1 1 18 18 GLU HB2 H 1 1.693 0.015 . 2 . . . . 706 GLU HB2 . 15996 1 183 . 1 1 18 18 GLU HB3 H 1 1.941 0.005 . 2 . . . . 706 GLU HB3 . 15996 1 184 . 1 1 18 18 GLU HG2 H 1 1.489 0.008 . 2 . . . . 706 GLU HG2 . 15996 1 185 . 1 1 18 18 GLU HG3 H 1 1.813 0.011 . 2 . . . . 706 GLU HG3 . 15996 1 186 . 1 1 18 18 GLU C C 13 177.749 0.004 . 1 . . . . 706 GLU C . 15996 1 187 . 1 1 18 18 GLU CA C 13 53.998 0.064 . 1 . . . . 706 GLU CA . 15996 1 188 . 1 1 18 18 GLU CB C 13 35.650 0.099 . 1 . . . . 706 GLU CB . 15996 1 189 . 1 1 18 18 GLU CG C 13 36.885 0.080 . 1 . . . . 706 GLU CG . 15996 1 190 . 1 1 18 18 GLU N N 15 120.493 0.044 . 1 . . . . 706 GLU N . 15996 1 191 . 1 1 19 19 LYS H H 1 9.307 0.003 . 1 . . . . 707 LYS H . 15996 1 192 . 1 1 19 19 LYS HA H 1 4.580 0.010 . 1 . . . . 707 LYS HA . 15996 1 193 . 1 1 19 19 LYS HB2 H 1 1.757 0.010 . 2 . . . . 707 LYS HB2 . 15996 1 194 . 1 1 19 19 LYS HB3 H 1 1.553 0.012 . 2 . . . . 707 LYS HB3 . 15996 1 195 . 1 1 19 19 LYS HG2 H 1 1.035 0.009 . 2 . . . . 707 LYS HG2 . 15996 1 196 . 1 1 19 19 LYS HG3 H 1 0.871 0.007 . 2 . . . . 707 LYS HG3 . 15996 1 197 . 1 1 19 19 LYS C C 13 178.467 0.022 . 1 . . . . 707 LYS C . 15996 1 198 . 1 1 19 19 LYS CA C 13 53.731 0.084 . 1 . . . . 707 LYS CA . 15996 1 199 . 1 1 19 19 LYS CB C 13 35.972 0.067 . 1 . . . . 707 LYS CB . 15996 1 200 . 1 1 19 19 LYS CG C 13 23.710 0.092 . 1 . . . . 707 LYS CG . 15996 1 201 . 1 1 19 19 LYS N N 15 115.630 0.031 . 1 . . . . 707 LYS N . 15996 1 202 . 1 1 20 20 LEU H H 1 8.367 0.004 . 1 . . . . 708 LEU H . 15996 1 203 . 1 1 20 20 LEU HA H 1 4.629 0.012 . 1 . . . . 708 LEU HA . 15996 1 204 . 1 1 20 20 LEU HB2 H 1 1.585 0.006 . 2 . . . . 708 LEU HB2 . 15996 1 205 . 1 1 20 20 LEU HB3 H 1 1.373 0.006 . 2 . . . . 708 LEU HB3 . 15996 1 206 . 1 1 20 20 LEU HD11 H 1 0.732 0.007 . 2 . . . . 708 LEU HD11 . 15996 1 207 . 1 1 20 20 LEU HD12 H 1 0.732 0.007 . 2 . . . . 708 LEU HD12 . 15996 1 208 . 1 1 20 20 LEU HD13 H 1 0.732 0.007 . 2 . . . . 708 LEU HD13 . 15996 1 209 . 1 1 20 20 LEU HD21 H 1 0.658 0.004 . 2 . . . . 708 LEU HD21 . 15996 1 210 . 1 1 20 20 LEU HD22 H 1 0.658 0.004 . 2 . . . . 708 LEU HD22 . 15996 1 211 . 1 1 20 20 LEU HD23 H 1 0.658 0.004 . 2 . . . . 708 LEU HD23 . 15996 1 212 . 1 1 20 20 LEU HG H 1 1.361 0.004 . 1 . . . . 708 LEU HG . 15996 1 213 . 1 1 20 20 LEU C C 13 174.513 0.009 . 1 . . . . 708 LEU C . 15996 1 214 . 1 1 20 20 LEU CA C 13 54.686 0.089 . 1 . . . . 708 LEU CA . 15996 1 215 . 1 1 20 20 LEU CB C 13 42.937 0.055 . 1 . . . . 708 LEU CB . 15996 1 216 . 1 1 20 20 LEU CD1 C 13 25.686 0.063 . 2 . . . . 708 LEU CD1 . 15996 1 217 . 1 1 20 20 LEU CD2 C 13 24.067 0.076 . 2 . . . . 708 LEU CD2 . 15996 1 218 . 1 1 20 20 LEU CG C 13 27.253 0.067 . 1 . . . . 708 LEU CG . 15996 1 219 . 1 1 20 20 LEU N N 15 122.948 0.024 . 1 . . . . 708 LEU N . 15996 1 220 . 1 1 21 21 GLN H H 1 9.438 0.005 . 1 . . . . 709 GLN H . 15996 1 221 . 1 1 21 21 GLN HA H 1 4.447 0.008 . 1 . . . . 709 GLN HA . 15996 1 222 . 1 1 21 21 GLN HB2 H 1 1.716 0.005 . 2 . . . . 709 GLN HB2 . 15996 1 223 . 1 1 21 21 GLN HB3 H 1 1.968 0.013 . 2 . . . . 709 GLN HB3 . 15996 1 224 . 1 1 21 21 GLN HE21 H 1 6.915 0.003 . 1 . . . . 709 GLN HE21 . 15996 1 225 . 1 1 21 21 GLN HE22 H 1 7.560 0.002 . 1 . . . . 709 GLN HE22 . 15996 1 226 . 1 1 21 21 GLN HG2 H 1 2.091 0.006 . 2 . . . . 709 GLN HG2 . 15996 1 227 . 1 1 21 21 GLN HG3 H 1 2.240 0.020 . 2 . . . . 709 GLN HG3 . 15996 1 228 . 1 1 21 21 GLN C C 13 176.790 0.004 . 1 . . . . 709 GLN C . 15996 1 229 . 1 1 21 21 GLN CA C 13 55.659 0.068 . 1 . . . . 709 GLN CA . 15996 1 230 . 1 1 21 21 GLN CB C 13 32.839 0.108 . 1 . . . . 709 GLN CB . 15996 1 231 . 1 1 21 21 GLN CG C 13 34.206 0.112 . 1 . . . . 709 GLN CG . 15996 1 232 . 1 1 21 21 GLN N N 15 127.549 0.027 . 1 . . . . 709 GLN N . 15996 1 233 . 1 1 21 21 GLN NE2 N 15 111.737 0.049 . 1 . . . . 709 GLN NE2 . 15996 1 234 . 1 1 22 22 ASN H H 1 9.555 0.006 . 1 . . . . 710 ASN H . 15996 1 235 . 1 1 22 22 ASN HA H 1 4.312 0.009 . 1 . . . . 710 ASN HA . 15996 1 236 . 1 1 22 22 ASN HB2 H 1 2.775 0.004 . 2 . . . . 710 ASN HB2 . 15996 1 237 . 1 1 22 22 ASN HB3 H 1 3.008 0.009 . 2 . . . . 710 ASN HB3 . 15996 1 238 . 1 1 22 22 ASN HD21 H 1 6.947 0.001 . 1 . . . . 710 ASN HD21 . 15996 1 239 . 1 1 22 22 ASN HD22 H 1 7.611 0.006 . 1 . . . . 710 ASN HD22 . 15996 1 240 . 1 1 22 22 ASN C C 13 177.415 0.001 . 1 . . . . 710 ASN C . 15996 1 241 . 1 1 22 22 ASN CA C 13 55.069 0.114 . 1 . . . . 710 ASN CA . 15996 1 242 . 1 1 22 22 ASN CB C 13 37.200 0.109 . 1 . . . . 710 ASN CB . 15996 1 243 . 1 1 22 22 ASN N N 15 127.004 0.050 . 1 . . . . 710 ASN N . 15996 1 244 . 1 1 22 22 ASN ND2 N 15 112.954 0.057 . 1 . . . . 710 ASN ND2 . 15996 1 245 . 1 1 23 23 SER H H 1 8.697 0.007 . 1 . . . . 711 SER H . 15996 1 246 . 1 1 23 23 SER HA H 1 3.822 0.006 . 1 . . . . 711 SER HA . 15996 1 247 . 1 1 23 23 SER HB2 H 1 4.054 0.016 . 2 . . . . 711 SER HB2 . 15996 1 248 . 1 1 23 23 SER HB3 H 1 4.104 0.007 . 2 . . . . 711 SER HB3 . 15996 1 249 . 1 1 23 23 SER C C 13 179.888 0.001 . 1 . . . . 711 SER C . 15996 1 250 . 1 1 23 23 SER CA C 13 60.065 0.082 . 1 . . . . 711 SER CA . 15996 1 251 . 1 1 23 23 SER CB C 13 62.304 0.095 . 1 . . . . 711 SER CB . 15996 1 252 . 1 1 23 23 SER N N 15 106.988 0.027 . 1 . . . . 711 SER N . 15996 1 253 . 1 1 24 24 ARG H H 1 7.733 0.003 . 1 . . . . 712 ARG H . 15996 1 254 . 1 1 24 24 ARG HA H 1 4.623 0.014 . 1 . . . . 712 ARG HA . 15996 1 255 . 1 1 24 24 ARG HB2 H 1 1.793 0.010 . 2 . . . . 712 ARG HB2 . 15996 1 256 . 1 1 24 24 ARG HB3 H 1 1.730 0.011 . 2 . . . . 712 ARG HB3 . 15996 1 257 . 1 1 24 24 ARG HD2 H 1 3.167 0.003 . 2 . . . . 712 ARG HD2 . 15996 1 258 . 1 1 24 24 ARG HD3 H 1 3.176 0.001 . 2 . . . . 712 ARG HD3 . 15996 1 259 . 1 1 24 24 ARG HE H 1 7.102 0.002 . 1 . . . . 712 ARG HE . 15996 1 260 . 1 1 24 24 ARG HG2 H 1 1.626 0.012 . 2 . . . . 712 ARG HG2 . 15996 1 261 . 1 1 24 24 ARG HG3 H 1 1.589 0.014 . 2 . . . . 712 ARG HG3 . 15996 1 262 . 1 1 24 24 ARG C C 13 177.828 0.003 . 1 . . . . 712 ARG C . 15996 1 263 . 1 1 24 24 ARG CA C 13 53.924 0.101 . 1 . . . . 712 ARG CA . 15996 1 264 . 1 1 24 24 ARG CB C 13 33.398 0.079 . 1 . . . . 712 ARG CB . 15996 1 265 . 1 1 24 24 ARG CD C 13 43.428 0.094 . 1 . . . . 712 ARG CD . 15996 1 266 . 1 1 24 24 ARG CG C 13 26.684 0.101 . 1 . . . . 712 ARG CG . 15996 1 267 . 1 1 24 24 ARG N N 15 118.862 0.038 . 1 . . . . 712 ARG N . 15996 1 268 . 1 1 24 24 ARG NE N 15 84.987 0.015 . 1 . . . . 712 ARG NE . 15996 1 269 . 1 1 25 25 CYS H H 1 8.704 0.004 . 1 . . . . 713 CYS H . 15996 1 270 . 1 1 25 25 CYS HA H 1 5.060 0.007 . 1 . . . . 713 CYS HA . 15996 1 271 . 1 1 25 25 CYS HB2 H 1 2.665 0.005 . 2 . . . . 713 CYS HB2 . 15996 1 272 . 1 1 25 25 CYS HB3 H 1 2.580 0.008 . 2 . . . . 713 CYS HB3 . 15996 1 273 . 1 1 25 25 CYS C C 13 177.077 0.001 . 1 . . . . 713 CYS C . 15996 1 274 . 1 1 25 25 CYS CA C 13 54.609 0.078 . 1 . . . . 713 CYS CA . 15996 1 275 . 1 1 25 25 CYS CB C 13 39.911 0.083 . 1 . . . . 713 CYS CB . 15996 1 276 . 1 1 25 25 CYS N N 15 120.349 0.048 . 1 . . . . 713 CYS N . 15996 1 277 . 1 1 26 26 VAL H H 1 9.278 0.005 . 1 . . . . 714 VAL H . 15996 1 278 . 1 1 26 26 VAL HA H 1 4.833 0.013 . 1 . . . . 714 VAL HA . 15996 1 279 . 1 1 26 26 VAL HB H 1 2.300 0.003 . 1 . . . . 714 VAL HB . 15996 1 280 . 1 1 26 26 VAL HG11 H 1 0.711 0.002 . 2 . . . . 714 VAL HG11 . 15996 1 281 . 1 1 26 26 VAL HG12 H 1 0.711 0.002 . 2 . . . . 714 VAL HG12 . 15996 1 282 . 1 1 26 26 VAL HG13 H 1 0.711 0.002 . 2 . . . . 714 VAL HG13 . 15996 1 283 . 1 1 26 26 VAL HG21 H 1 0.884 0.007 . 2 . . . . 714 VAL HG21 . 15996 1 284 . 1 1 26 26 VAL HG22 H 1 0.884 0.007 . 2 . . . . 714 VAL HG22 . 15996 1 285 . 1 1 26 26 VAL HG23 H 1 0.884 0.007 . 2 . . . . 714 VAL HG23 . 15996 1 286 . 1 1 26 26 VAL C C 13 176.554 0.005 . 1 . . . . 714 VAL C . 15996 1 287 . 1 1 26 26 VAL CA C 13 58.780 0.064 . 1 . . . . 714 VAL CA . 15996 1 288 . 1 1 26 26 VAL CB C 13 35.193 0.071 . 1 . . . . 714 VAL CB . 15996 1 289 . 1 1 26 26 VAL CG1 C 13 19.127 0.042 . 2 . . . . 714 VAL CG1 . 15996 1 290 . 1 1 26 26 VAL CG2 C 13 21.464 0.096 . 2 . . . . 714 VAL CG2 . 15996 1 291 . 1 1 26 26 VAL N N 15 119.530 0.038 . 1 . . . . 714 VAL N . 15996 1 292 . 1 1 27 27 CYS H H 1 8.502 0.005 . 1 . . . . 715 CYS H . 15996 1 293 . 1 1 27 27 CYS HA H 1 4.689 0.004 . 1 . . . . 715 CYS HA . 15996 1 294 . 1 1 27 27 CYS HB2 H 1 3.544 0.011 . 2 . . . . 715 CYS HB2 . 15996 1 295 . 1 1 27 27 CYS HB3 H 1 2.792 0.012 . 2 . . . . 715 CYS HB3 . 15996 1 296 . 1 1 27 27 CYS C C 13 175.359 0.030 . 1 . . . . 715 CYS C . 15996 1 297 . 1 1 27 27 CYS CA C 13 55.720 0.063 . 1 . . . . 715 CYS CA . 15996 1 298 . 1 1 27 27 CYS CB C 13 38.535 0.058 . 1 . . . . 715 CYS CB . 15996 1 299 . 1 1 27 27 CYS N N 15 117.712 0.043 . 1 . . . . 715 CYS N . 15996 1 300 . 1 1 28 28 LYS H H 1 8.324 0.009 . 1 . . . . 716 LYS H . 15996 1 301 . 1 1 28 28 LYS HA H 1 3.946 0.006 . 1 . . . . 716 LYS HA . 15996 1 302 . 1 1 28 28 LYS HB2 H 1 1.455 0.011 . 2 . . . . 716 LYS HB2 . 15996 1 303 . 1 1 28 28 LYS HB3 H 1 1.876 0.014 . 2 . . . . 716 LYS HB3 . 15996 1 304 . 1 1 28 28 LYS HE2 H 1 2.958 0.001 . 2 . . . . 716 LYS HE2 . 15996 1 305 . 1 1 28 28 LYS HE3 H 1 2.935 0.001 . 2 . . . . 716 LYS HE3 . 15996 1 306 . 1 1 28 28 LYS C C 13 176.990 0.001 . 1 . . . . 716 LYS C . 15996 1 307 . 1 1 28 28 LYS CA C 13 57.971 0.071 . 1 . . . . 716 LYS CA . 15996 1 308 . 1 1 28 28 LYS CB C 13 34.319 0.065 . 1 . . . . 716 LYS CB . 15996 1 309 . 1 1 28 28 LYS N N 15 120.511 0.043 . 1 . . . . 716 LYS N . 15996 1 310 . 1 1 29 29 MET H H 1 8.676 0.004 . 1 . . . . 717 MET H . 15996 1 311 . 1 1 29 29 MET HA H 1 4.752 0.009 . 1 . . . . 717 MET HA . 15996 1 312 . 1 1 29 29 MET HB2 H 1 1.343 0.008 . 2 . . . . 717 MET HB2 . 15996 1 313 . 1 1 29 29 MET HB3 H 1 1.032 0.006 . 2 . . . . 717 MET HB3 . 15996 1 314 . 1 1 29 29 MET HE1 H 1 2.162 0.009 . 1 . . . . 717 MET HE1 . 15996 1 315 . 1 1 29 29 MET HE2 H 1 2.162 0.009 . 1 . . . . 717 MET HE2 . 15996 1 316 . 1 1 29 29 MET HE3 H 1 2.162 0.009 . 1 . . . . 717 MET HE3 . 15996 1 317 . 1 1 29 29 MET HG2 H 1 2.750 0.007 . 2 . . . . 717 MET HG2 . 15996 1 318 . 1 1 29 29 MET HG3 H 1 2.413 0.010 . 2 . . . . 717 MET HG3 . 15996 1 319 . 1 1 29 29 MET C C 13 174.075 0.001 . 1 . . . . 717 MET C . 15996 1 320 . 1 1 29 29 MET CA C 13 52.038 0.043 . 1 . . . . 717 MET CA . 15996 1 321 . 1 1 29 29 MET CB C 13 31.800 0.074 . 1 . . . . 717 MET CB . 15996 1 322 . 1 1 29 29 MET CE C 13 17.437 0.028 . 1 . . . . 717 MET CE . 15996 1 323 . 1 1 29 29 MET CG C 13 32.511 0.083 . 1 . . . . 717 MET CG . 15996 1 324 . 1 1 29 29 MET N N 15 114.327 0.031 . 1 . . . . 717 MET N . 15996 1 325 . 1 1 30 30 PRO HA H 1 3.872 0.002 . 1 . . . . 718 PRO HA . 15996 1 326 . 1 1 30 30 PRO HB2 H 1 2.144 0.001 . 2 . . . . 718 PRO HB2 . 15996 1 327 . 1 1 30 30 PRO HB3 H 1 2.323 0.002 . 2 . . . . 718 PRO HB3 . 15996 1 328 . 1 1 30 30 PRO HG2 H 1 1.996 0.001 . 2 . . . . 718 PRO HG2 . 15996 1 329 . 1 1 30 30 PRO HG3 H 1 2.056 0.001 . 2 . . . . 718 PRO HG3 . 15996 1 330 . 1 1 30 30 PRO C C 13 174.871 0.001 . 1 . . . . 718 PRO C . 15996 1 331 . 1 1 30 30 PRO CA C 13 66.865 0.071 . 1 . . . . 718 PRO CA . 15996 1 332 . 1 1 30 30 PRO CB C 13 31.114 0.046 . 1 . . . . 718 PRO CB . 15996 1 333 . 1 1 31 31 TYR H H 1 6.640 0.006 . 1 . . . . 719 TYR H . 15996 1 334 . 1 1 31 31 TYR HA H 1 4.526 0.004 . 1 . . . . 719 TYR HA . 15996 1 335 . 1 1 31 31 TYR HB2 H 1 2.913 0.006 . 2 . . . . 719 TYR HB2 . 15996 1 336 . 1 1 31 31 TYR HB3 H 1 3.371 0.006 . 2 . . . . 719 TYR HB3 . 15996 1 337 . 1 1 31 31 TYR HD1 H 1 7.053 0.005 . 3 . . . . 719 TYR HD1 . 15996 1 338 . 1 1 31 31 TYR HD2 H 1 7.053 0.005 . 3 . . . . 719 TYR HD2 . 15996 1 339 . 1 1 31 31 TYR HE1 H 1 6.842 0.008 . 3 . . . . 719 TYR HE1 . 15996 1 340 . 1 1 31 31 TYR HE2 H 1 6.842 0.008 . 3 . . . . 719 TYR HE2 . 15996 1 341 . 1 1 31 31 TYR C C 13 176.088 0.011 . 1 . . . . 719 TYR C . 15996 1 342 . 1 1 31 31 TYR CA C 13 57.504 0.111 . 1 . . . . 719 TYR CA . 15996 1 343 . 1 1 31 31 TYR CB C 13 36.118 0.046 . 1 . . . . 719 TYR CB . 15996 1 344 . 1 1 31 31 TYR CD1 C 13 133.677 0.054 . 3 . . . . 719 TYR CD1 . 15996 1 345 . 1 1 31 31 TYR CD2 C 13 133.677 0.054 . 3 . . . . 719 TYR CD2 . 15996 1 346 . 1 1 31 31 TYR CE1 C 13 118.967 0.051 . 3 . . . . 719 TYR CE1 . 15996 1 347 . 1 1 31 31 TYR CE2 C 13 118.967 0.051 . 3 . . . . 719 TYR CE2 . 15996 1 348 . 1 1 31 31 TYR N N 15 109.208 0.037 . 1 . . . . 719 TYR N . 15996 1 349 . 1 1 32 32 GLU H H 1 7.709 0.004 . 1 . . . . 720 GLU H . 15996 1 350 . 1 1 32 32 GLU HA H 1 4.221 0.007 . 1 . . . . 720 GLU HA . 15996 1 351 . 1 1 32 32 GLU HB2 H 1 2.104 0.006 . 2 . . . . 720 GLU HB2 . 15996 1 352 . 1 1 32 32 GLU HB3 H 1 2.116 0.005 . 2 . . . . 720 GLU HB3 . 15996 1 353 . 1 1 32 32 GLU C C 13 174.437 0.009 . 1 . . . . 720 GLU C . 15996 1 354 . 1 1 32 32 GLU CA C 13 56.393 0.078 . 1 . . . . 720 GLU CA . 15996 1 355 . 1 1 32 32 GLU CB C 13 29.833 0.097 . 1 . . . . 720 GLU CB . 15996 1 356 . 1 1 32 32 GLU N N 15 119.905 0.021 . 1 . . . . 720 GLU N . 15996 1 357 . 1 1 33 33 CYS H H 1 7.332 0.006 . 1 . . . . 721 CYS H . 15996 1 358 . 1 1 33 33 CYS HA H 1 4.332 0.005 . 1 . . . . 721 CYS HA . 15996 1 359 . 1 1 33 33 CYS HB2 H 1 3.224 0.011 . 2 . . . . 721 CYS HB2 . 15996 1 360 . 1 1 33 33 CYS HB3 H 1 3.353 0.009 . 2 . . . . 721 CYS HB3 . 15996 1 361 . 1 1 33 33 CYS C C 13 176.384 0.001 . 1 . . . . 721 CYS C . 15996 1 362 . 1 1 33 33 CYS CA C 13 60.410 0.096 . 1 . . . . 721 CYS CA . 15996 1 363 . 1 1 33 33 CYS CB C 13 42.826 0.092 . 1 . . . . 721 CYS CB . 15996 1 364 . 1 1 33 33 CYS N N 15 118.265 0.036 . 1 . . . . 721 CYS N . 15996 1 365 . 1 1 34 34 GLY H H 1 8.507 0.005 . 1 . . . . 722 GLY H . 15996 1 366 . 1 1 34 34 GLY HA2 H 1 3.814 0.007 . 2 . . . . 722 GLY HA2 . 15996 1 367 . 1 1 34 34 GLY HA3 H 1 4.298 0.005 . 2 . . . . 722 GLY HA3 . 15996 1 368 . 1 1 34 34 GLY C C 13 171.931 0.001 . 1 . . . . 722 GLY C . 15996 1 369 . 1 1 34 34 GLY CA C 13 43.668 0.050 . 1 . . . . 722 GLY CA . 15996 1 370 . 1 1 34 34 GLY N N 15 111.618 0.017 . 1 . . . . 722 GLY N . 15996 1 371 . 1 1 35 35 PRO HA H 1 4.345 0.007 . 1 . . . . 723 PRO HA . 15996 1 372 . 1 1 35 35 PRO HB2 H 1 1.626 0.008 . 2 . . . . 723 PRO HB2 . 15996 1 373 . 1 1 35 35 PRO HB3 H 1 1.873 0.004 . 2 . . . . 723 PRO HB3 . 15996 1 374 . 1 1 35 35 PRO HD2 H 1 3.193 0.001 . 1 . . . . 723 PRO HD2 . 15996 1 375 . 1 1 35 35 PRO C C 13 175.631 0.001 . 1 . . . . 723 PRO C . 15996 1 376 . 1 1 35 35 PRO CA C 13 64.047 0.111 . 1 . . . . 723 PRO CA . 15996 1 377 . 1 1 35 35 PRO CB C 13 31.805 0.081 . 1 . . . . 723 PRO CB . 15996 1 378 . 1 1 36 36 SER H H 1 8.081 0.004 . 1 . . . . 724 SER H . 15996 1 379 . 1 1 36 36 SER HA H 1 4.996 0.008 . 1 . . . . 724 SER HA . 15996 1 380 . 1 1 36 36 SER HB2 H 1 4.207 0.007 . 2 . . . . 724 SER HB2 . 15996 1 381 . 1 1 36 36 SER HB3 H 1 3.470 0.007 . 2 . . . . 724 SER HB3 . 15996 1 382 . 1 1 36 36 SER C C 13 179.159 0.006 . 1 . . . . 724 SER C . 15996 1 383 . 1 1 36 36 SER CA C 13 55.291 0.078 . 1 . . . . 724 SER CA . 15996 1 384 . 1 1 36 36 SER CB C 13 63.583 0.080 . 1 . . . . 724 SER CB . 15996 1 385 . 1 1 36 36 SER N N 15 117.870 0.046 . 1 . . . . 724 SER N . 15996 1 386 . 1 1 37 37 LEU H H 1 9.273 0.006 . 1 . . . . 725 LEU H . 15996 1 387 . 1 1 37 37 LEU HA H 1 4.192 0.008 . 1 . . . . 725 LEU HA . 15996 1 388 . 1 1 37 37 LEU HB2 H 1 1.489 0.008 . 2 . . . . 725 LEU HB2 . 15996 1 389 . 1 1 37 37 LEU HB3 H 1 1.741 0.006 . 2 . . . . 725 LEU HB3 . 15996 1 390 . 1 1 37 37 LEU HD11 H 1 0.540 0.007 . 2 . . . . 725 LEU HD11 . 15996 1 391 . 1 1 37 37 LEU HD12 H 1 0.540 0.007 . 2 . . . . 725 LEU HD12 . 15996 1 392 . 1 1 37 37 LEU HD13 H 1 0.540 0.007 . 2 . . . . 725 LEU HD13 . 15996 1 393 . 1 1 37 37 LEU HD21 H 1 0.514 0.006 . 2 . . . . 725 LEU HD21 . 15996 1 394 . 1 1 37 37 LEU HD22 H 1 0.514 0.006 . 2 . . . . 725 LEU HD22 . 15996 1 395 . 1 1 37 37 LEU HD23 H 1 0.514 0.006 . 2 . . . . 725 LEU HD23 . 15996 1 396 . 1 1 37 37 LEU HG H 1 1.698 0.026 . 1 . . . . 725 LEU HG . 15996 1 397 . 1 1 37 37 LEU C C 13 176.185 0.063 . 1 . . . . 725 LEU C . 15996 1 398 . 1 1 37 37 LEU CA C 13 56.732 0.081 . 1 . . . . 725 LEU CA . 15996 1 399 . 1 1 37 37 LEU CB C 13 43.576 0.075 . 1 . . . . 725 LEU CB . 15996 1 400 . 1 1 37 37 LEU CD1 C 13 24.894 0.047 . 2 . . . . 725 LEU CD1 . 15996 1 401 . 1 1 37 37 LEU CD2 C 13 26.135 0.050 . 2 . . . . 725 LEU CD2 . 15996 1 402 . 1 1 37 37 LEU N N 15 127.648 0.042 . 1 . . . . 725 LEU N . 15996 1 403 . 1 1 38 38 ASP H H 1 8.147 0.005 . 1 . . . . 726 ASP H . 15996 1 404 . 1 1 38 38 ASP HA H 1 5.030 0.011 . 1 . . . . 726 ASP HA . 15996 1 405 . 1 1 38 38 ASP HB2 H 1 2.745 0.006 . 2 . . . . 726 ASP HB2 . 15996 1 406 . 1 1 38 38 ASP HB3 H 1 2.415 0.008 . 2 . . . . 726 ASP HB3 . 15996 1 407 . 1 1 38 38 ASP C C 13 176.909 0.001 . 1 . . . . 726 ASP C . 15996 1 408 . 1 1 38 38 ASP CA C 13 54.637 0.051 . 1 . . . . 726 ASP CA . 15996 1 409 . 1 1 38 38 ASP CB C 13 42.786 0.099 . 1 . . . . 726 ASP CB . 15996 1 410 . 1 1 38 38 ASP N N 15 122.306 0.069 . 1 . . . . 726 ASP N . 15996 1 411 . 1 1 39 39 VAL H H 1 8.075 0.006 . 1 . . . . 727 VAL H . 15996 1 412 . 1 1 39 39 VAL HA H 1 4.447 0.007 . 1 . . . . 727 VAL HA . 15996 1 413 . 1 1 39 39 VAL HB H 1 2.031 0.006 . 1 . . . . 727 VAL HB . 15996 1 414 . 1 1 39 39 VAL HG11 H 1 0.320 0.007 . 2 . . . . 727 VAL HG11 . 15996 1 415 . 1 1 39 39 VAL HG12 H 1 0.320 0.007 . 2 . . . . 727 VAL HG12 . 15996 1 416 . 1 1 39 39 VAL HG13 H 1 0.320 0.007 . 2 . . . . 727 VAL HG13 . 15996 1 417 . 1 1 39 39 VAL HG21 H 1 0.689 0.012 . 2 . . . . 727 VAL HG21 . 15996 1 418 . 1 1 39 39 VAL HG22 H 1 0.689 0.012 . 2 . . . . 727 VAL HG22 . 15996 1 419 . 1 1 39 39 VAL HG23 H 1 0.689 0.012 . 2 . . . . 727 VAL HG23 . 15996 1 420 . 1 1 39 39 VAL C C 13 178.435 0.093 . 1 . . . . 727 VAL C . 15996 1 421 . 1 1 39 39 VAL CA C 13 59.366 0.077 . 1 . . . . 727 VAL CA . 15996 1 422 . 1 1 39 39 VAL CB C 13 36.032 0.073 . 1 . . . . 727 VAL CB . 15996 1 423 . 1 1 39 39 VAL CG1 C 13 18.096 0.053 . 2 . . . . 727 VAL CG1 . 15996 1 424 . 1 1 39 39 VAL CG2 C 13 22.949 0.075 . 2 . . . . 727 VAL CG2 . 15996 1 425 . 1 1 39 39 VAL N N 15 113.926 0.039 . 1 . . . . 727 VAL N . 15996 1 426 . 1 1 40 40 CYS H H 1 8.425 0.007 . 1 . . . . 728 CYS H . 15996 1 427 . 1 1 40 40 CYS HA H 1 4.968 0.007 . 1 . . . . 728 CYS HA . 15996 1 428 . 1 1 40 40 CYS HB2 H 1 2.407 0.007 . 2 . . . . 728 CYS HB2 . 15996 1 429 . 1 1 40 40 CYS HB3 H 1 2.559 0.010 . 2 . . . . 728 CYS HB3 . 15996 1 430 . 1 1 40 40 CYS C C 13 178.392 0.076 . 1 . . . . 728 CYS C . 15996 1 431 . 1 1 40 40 CYS CA C 13 52.952 0.061 . 1 . . . . 728 CYS CA . 15996 1 432 . 1 1 40 40 CYS CB C 13 39.864 0.072 . 1 . . . . 728 CYS CB . 15996 1 433 . 1 1 40 40 CYS N N 15 120.146 0.069 . 1 . . . . 728 CYS N . 15996 1 434 . 1 1 41 41 ALA H H 1 8.678 0.005 . 1 . . . . 729 ALA H . 15996 1 435 . 1 1 41 41 ALA HA H 1 5.139 0.012 . 1 . . . . 729 ALA HA . 15996 1 436 . 1 1 41 41 ALA HB1 H 1 1.274 0.015 . 1 . . . . 729 ALA HB1 . 15996 1 437 . 1 1 41 41 ALA HB2 H 1 1.274 0.015 . 1 . . . . 729 ALA HB2 . 15996 1 438 . 1 1 41 41 ALA HB3 H 1 1.274 0.015 . 1 . . . . 729 ALA HB3 . 15996 1 439 . 1 1 41 41 ALA C C 13 177.786 0.001 . 1 . . . . 729 ALA C . 15996 1 440 . 1 1 41 41 ALA CA C 13 50.865 0.067 . 1 . . . . 729 ALA CA . 15996 1 441 . 1 1 41 41 ALA CB C 13 24.473 0.084 . 1 . . . . 729 ALA CB . 15996 1 442 . 1 1 41 41 ALA N N 15 123.668 0.030 . 1 . . . . 729 ALA N . 15996 1 443 . 1 1 42 42 GLN H H 1 9.383 0.003 . 1 . . . . 730 GLN H . 15996 1 444 . 1 1 42 42 GLN HA H 1 5.106 0.005 . 1 . . . . 730 GLN HA . 15996 1 445 . 1 1 42 42 GLN HB2 H 1 1.563 0.007 . 2 . . . . 730 GLN HB2 . 15996 1 446 . 1 1 42 42 GLN HB3 H 1 1.950 0.007 . 2 . . . . 730 GLN HB3 . 15996 1 447 . 1 1 42 42 GLN HE21 H 1 6.932 0.004 . 1 . . . . 730 GLN HE21 . 15996 1 448 . 1 1 42 42 GLN HE22 H 1 7.439 0.002 . 1 . . . . 730 GLN HE22 . 15996 1 449 . 1 1 42 42 GLN HG2 H 1 1.721 0.015 . 2 . . . . 730 GLN HG2 . 15996 1 450 . 1 1 42 42 GLN HG3 H 1 1.788 0.006 . 2 . . . . 730 GLN HG3 . 15996 1 451 . 1 1 42 42 GLN C C 13 176.572 0.006 . 1 . . . . 730 GLN C . 15996 1 452 . 1 1 42 42 GLN CA C 13 53.497 0.043 . 1 . . . . 730 GLN CA . 15996 1 453 . 1 1 42 42 GLN CB C 13 32.560 0.059 . 1 . . . . 730 GLN CB . 15996 1 454 . 1 1 42 42 GLN CG C 13 33.741 0.103 . 1 . . . . 730 GLN CG . 15996 1 455 . 1 1 42 42 GLN N N 15 119.159 0.026 . 1 . . . . 730 GLN N . 15996 1 456 . 1 1 42 42 GLN NE2 N 15 112.172 0.060 . 1 . . . . 730 GLN NE2 . 15996 1 457 . 1 1 43 43 ASP H H 1 8.581 0.008 . 1 . . . . 731 ASP H . 15996 1 458 . 1 1 43 43 ASP HA H 1 3.462 0.007 . 1 . . . . 731 ASP HA . 15996 1 459 . 1 1 43 43 ASP HB2 H 1 2.433 0.013 . 2 . . . . 731 ASP HB2 . 15996 1 460 . 1 1 43 43 ASP HB3 H 1 2.814 0.009 . 2 . . . . 731 ASP HB3 . 15996 1 461 . 1 1 43 43 ASP C C 13 174.850 0.001 . 1 . . . . 731 ASP C . 15996 1 462 . 1 1 43 43 ASP CA C 13 53.340 0.087 . 1 . . . . 731 ASP CA . 15996 1 463 . 1 1 43 43 ASP CB C 13 42.078 0.105 . 1 . . . . 731 ASP CB . 15996 1 464 . 1 1 43 43 ASP N N 15 127.677 0.032 . 1 . . . . 731 ASP N . 15996 1 465 . 1 1 44 44 GLU H H 1 8.086 0.003 . 1 . . . . 732 GLU H . 15996 1 466 . 1 1 44 44 GLU HA H 1 3.907 0.003 . 1 . . . . 732 GLU HA . 15996 1 467 . 1 1 44 44 GLU HB2 H 1 1.789 0.006 . 2 . . . . 732 GLU HB2 . 15996 1 468 . 1 1 44 44 GLU HB3 H 1 1.959 0.008 . 2 . . . . 732 GLU HB3 . 15996 1 469 . 1 1 44 44 GLU HG2 H 1 2.104 0.001 . 2 . . . . 732 GLU HG2 . 15996 1 470 . 1 1 44 44 GLU HG3 H 1 2.112 0.008 . 2 . . . . 732 GLU HG3 . 15996 1 471 . 1 1 44 44 GLU C C 13 174.926 0.009 . 1 . . . . 732 GLU C . 15996 1 472 . 1 1 44 44 GLU CA C 13 58.953 0.044 . 1 . . . . 732 GLU CA . 15996 1 473 . 1 1 44 44 GLU CB C 13 29.794 0.098 . 1 . . . . 732 GLU CB . 15996 1 474 . 1 1 44 44 GLU CG C 13 36.173 0.038 . 1 . . . . 732 GLU CG . 15996 1 475 . 1 1 44 44 GLU N N 15 127.949 0.034 . 1 . . . . 732 GLU N . 15996 1 476 . 1 1 45 45 ARG H H 1 8.215 0.003 . 1 . . . . 733 ARG H . 15996 1 477 . 1 1 45 45 ARG HA H 1 4.221 0.004 . 1 . . . . 733 ARG HA . 15996 1 478 . 1 1 45 45 ARG HB2 H 1 1.905 0.001 . 2 . . . . 733 ARG HB2 . 15996 1 479 . 1 1 45 45 ARG HB3 H 1 1.880 0.005 . 2 . . . . 733 ARG HB3 . 15996 1 480 . 1 1 45 45 ARG HD2 H 1 3.190 0.001 . 2 . . . . 733 ARG HD2 . 15996 1 481 . 1 1 45 45 ARG HD3 H 1 3.180 0.005 . 2 . . . . 733 ARG HD3 . 15996 1 482 . 1 1 45 45 ARG HE H 1 7.273 0.002 . 1 . . . . 733 ARG HE . 15996 1 483 . 1 1 45 45 ARG HG2 H 1 1.573 0.013 . 2 . . . . 733 ARG HG2 . 15996 1 484 . 1 1 45 45 ARG HG3 H 1 1.652 0.010 . 2 . . . . 733 ARG HG3 . 15996 1 485 . 1 1 45 45 ARG C C 13 174.808 0.018 . 1 . . . . 733 ARG C . 15996 1 486 . 1 1 45 45 ARG CA C 13 57.992 0.084 . 1 . . . . 733 ARG CA . 15996 1 487 . 1 1 45 45 ARG CB C 13 30.243 0.065 . 1 . . . . 733 ARG CB . 15996 1 488 . 1 1 45 45 ARG CD C 13 43.284 0.063 . 1 . . . . 733 ARG CD . 15996 1 489 . 1 1 45 45 ARG CG C 13 26.873 0.125 . 1 . . . . 733 ARG CG . 15996 1 490 . 1 1 45 45 ARG N N 15 117.187 0.024 . 1 . . . . 733 ARG N . 15996 1 491 . 1 1 45 45 ARG NE N 15 84.502 0.008 . 1 . . . . 733 ARG NE . 15996 1 492 . 1 1 46 46 SER H H 1 7.654 0.004 . 1 . . . . 734 SER H . 15996 1 493 . 1 1 46 46 SER HA H 1 4.318 0.007 . 1 . . . . 734 SER HA . 15996 1 494 . 1 1 46 46 SER HB2 H 1 3.984 0.005 . 2 . . . . 734 SER HB2 . 15996 1 495 . 1 1 46 46 SER HB3 H 1 3.772 0.014 . 2 . . . . 734 SER HB3 . 15996 1 496 . 1 1 46 46 SER C C 13 176.602 0.001 . 1 . . . . 734 SER C . 15996 1 497 . 1 1 46 46 SER CA C 13 59.029 0.076 . 1 . . . . 734 SER CA . 15996 1 498 . 1 1 46 46 SER CB C 13 65.182 0.101 . 1 . . . . 734 SER CB . 15996 1 499 . 1 1 46 46 SER N N 15 112.524 0.020 . 1 . . . . 734 SER N . 15996 1 500 . 1 1 47 47 LYS H H 1 8.074 0.005 . 1 . . . . 735 LYS H . 15996 1 501 . 1 1 47 47 LYS HA H 1 3.852 0.013 . 1 . . . . 735 LYS HA . 15996 1 502 . 1 1 47 47 LYS HB2 H 1 2.261 0.009 . 2 . . . . 735 LYS HB2 . 15996 1 503 . 1 1 47 47 LYS HB3 H 1 1.906 0.008 . 2 . . . . 735 LYS HB3 . 15996 1 504 . 1 1 47 47 LYS HD2 H 1 1.395 0.013 . 2 . . . . 735 LYS HD2 . 15996 1 505 . 1 1 47 47 LYS HD3 H 1 1.492 0.010 . 2 . . . . 735 LYS HD3 . 15996 1 506 . 1 1 47 47 LYS HE2 H 1 2.899 0.002 . 2 . . . . 735 LYS HE2 . 15996 1 507 . 1 1 47 47 LYS HE3 H 1 2.940 0.003 . 2 . . . . 735 LYS HE3 . 15996 1 508 . 1 1 47 47 LYS HG2 H 1 1.155 0.003 . 2 . . . . 735 LYS HG2 . 15996 1 509 . 1 1 47 47 LYS HG3 H 1 1.345 0.010 . 2 . . . . 735 LYS HG3 . 15996 1 510 . 1 1 47 47 LYS C C 13 176.250 0.002 . 1 . . . . 735 LYS C . 15996 1 511 . 1 1 47 47 LYS CA C 13 57.220 0.059 . 1 . . . . 735 LYS CA . 15996 1 512 . 1 1 47 47 LYS CB C 13 29.075 0.076 . 1 . . . . 735 LYS CB . 15996 1 513 . 1 1 47 47 LYS CD C 13 28.099 0.076 . 1 . . . . 735 LYS CD . 15996 1 514 . 1 1 47 47 LYS CE C 13 42.244 0.122 . 1 . . . . 735 LYS CE . 15996 1 515 . 1 1 47 47 LYS CG C 13 24.580 0.048 . 1 . . . . 735 LYS CG . 15996 1 516 . 1 1 47 47 LYS N N 15 115.307 0.030 . 1 . . . . 735 LYS N . 15996 1 517 . 1 1 48 48 ARG H H 1 7.785 0.005 . 1 . . . . 736 ARG H . 15996 1 518 . 1 1 48 48 ARG HA H 1 4.236 0.006 . 1 . . . . 736 ARG HA . 15996 1 519 . 1 1 48 48 ARG HB2 H 1 1.657 0.013 . 2 . . . . 736 ARG HB2 . 15996 1 520 . 1 1 48 48 ARG HB3 H 1 1.738 0.008 . 2 . . . . 736 ARG HB3 . 15996 1 521 . 1 1 48 48 ARG HD2 H 1 3.217 0.008 . 2 . . . . 736 ARG HD2 . 15996 1 522 . 1 1 48 48 ARG HD3 H 1 3.198 0.002 . 2 . . . . 736 ARG HD3 . 15996 1 523 . 1 1 48 48 ARG HE H 1 7.228 0.002 . 1 . . . . 736 ARG HE . 15996 1 524 . 1 1 48 48 ARG HG2 H 1 1.585 0.008 . 2 . . . . 736 ARG HG2 . 15996 1 525 . 1 1 48 48 ARG HG3 H 1 1.658 0.004 . 2 . . . . 736 ARG HG3 . 15996 1 526 . 1 1 48 48 ARG C C 13 176.943 0.001 . 1 . . . . 736 ARG C . 15996 1 527 . 1 1 48 48 ARG CA C 13 56.849 0.084 . 1 . . . . 736 ARG CA . 15996 1 528 . 1 1 48 48 ARG CB C 13 31.325 0.058 . 1 . . . . 736 ARG CB . 15996 1 529 . 1 1 48 48 ARG CD C 13 43.355 0.093 . 1 . . . . 736 ARG CD . 15996 1 530 . 1 1 48 48 ARG CG C 13 27.708 0.089 . 1 . . . . 736 ARG CG . 15996 1 531 . 1 1 48 48 ARG N N 15 121.199 0.019 . 1 . . . . 736 ARG N . 15996 1 532 . 1 1 48 48 ARG NE N 15 84.562 0.028 . 1 . . . . 736 ARG NE . 15996 1 533 . 1 1 49 49 ILE H H 1 8.522 0.004 . 1 . . . . 737 ILE H . 15996 1 534 . 1 1 49 49 ILE HA H 1 4.901 0.007 . 1 . . . . 737 ILE HA . 15996 1 535 . 1 1 49 49 ILE HB H 1 1.663 0.007 . 1 . . . . 737 ILE HB . 15996 1 536 . 1 1 49 49 ILE HD11 H 1 0.907 0.008 . 1 . . . . 737 ILE HD11 . 15996 1 537 . 1 1 49 49 ILE HD12 H 1 0.907 0.008 . 1 . . . . 737 ILE HD12 . 15996 1 538 . 1 1 49 49 ILE HD13 H 1 0.907 0.008 . 1 . . . . 737 ILE HD13 . 15996 1 539 . 1 1 49 49 ILE HG12 H 1 1.746 0.017 . 2 . . . . 737 ILE HG12 . 15996 1 540 . 1 1 49 49 ILE HG13 H 1 1.755 0.002 . 2 . . . . 737 ILE HG13 . 15996 1 541 . 1 1 49 49 ILE HG21 H 1 0.726 0.009 . 1 . . . . 737 ILE HG21 . 15996 1 542 . 1 1 49 49 ILE HG22 H 1 0.726 0.009 . 1 . . . . 737 ILE HG22 . 15996 1 543 . 1 1 49 49 ILE HG23 H 1 0.726 0.009 . 1 . . . . 737 ILE HG23 . 15996 1 544 . 1 1 49 49 ILE C C 13 176.118 0.001 . 1 . . . . 737 ILE C . 15996 1 545 . 1 1 49 49 ILE CA C 13 60.704 0.043 . 1 . . . . 737 ILE CA . 15996 1 546 . 1 1 49 49 ILE CB C 13 38.571 0.064 . 1 . . . . 737 ILE CB . 15996 1 547 . 1 1 49 49 ILE CD1 C 13 13.567 0.053 . 1 . . . . 737 ILE CD1 . 15996 1 548 . 1 1 49 49 ILE CG1 C 13 28.597 0.073 . 1 . . . . 737 ILE CG1 . 15996 1 549 . 1 1 49 49 ILE CG2 C 13 18.293 0.103 . 1 . . . . 737 ILE CG2 . 15996 1 550 . 1 1 49 49 ILE N N 15 123.998 0.037 . 1 . . . . 737 ILE N . 15996 1 551 . 1 1 50 50 LEU H H 1 9.480 0.005 . 1 . . . . 738 LEU H . 15996 1 552 . 1 1 50 50 LEU HA H 1 4.979 0.009 . 1 . . . . 738 LEU HA . 15996 1 553 . 1 1 50 50 LEU HB2 H 1 1.497 0.004 . 2 . . . . 738 LEU HB2 . 15996 1 554 . 1 1 50 50 LEU HB3 H 1 1.640 0.006 . 2 . . . . 738 LEU HB3 . 15996 1 555 . 1 1 50 50 LEU HD11 H 1 0.905 0.010 . 2 . . . . 738 LEU HD11 . 15996 1 556 . 1 1 50 50 LEU HD12 H 1 0.905 0.010 . 2 . . . . 738 LEU HD12 . 15996 1 557 . 1 1 50 50 LEU HD13 H 1 0.905 0.010 . 2 . . . . 738 LEU HD13 . 15996 1 558 . 1 1 50 50 LEU HD21 H 1 0.950 0.006 . 2 . . . . 738 LEU HD21 . 15996 1 559 . 1 1 50 50 LEU HD22 H 1 0.950 0.006 . 2 . . . . 738 LEU HD22 . 15996 1 560 . 1 1 50 50 LEU HD23 H 1 0.950 0.006 . 2 . . . . 738 LEU HD23 . 15996 1 561 . 1 1 50 50 LEU HG H 1 1.597 0.019 . 1 . . . . 738 LEU HG . 15996 1 562 . 1 1 50 50 LEU C C 13 179.088 0.001 . 1 . . . . 738 LEU C . 15996 1 563 . 1 1 50 50 LEU CA C 13 52.790 0.055 . 1 . . . . 738 LEU CA . 15996 1 564 . 1 1 50 50 LEU CB C 13 43.974 0.061 . 1 . . . . 738 LEU CB . 15996 1 565 . 1 1 50 50 LEU CD1 C 13 26.267 0.050 . 2 . . . . 738 LEU CD1 . 15996 1 566 . 1 1 50 50 LEU CD2 C 13 24.815 0.068 . 2 . . . . 738 LEU CD2 . 15996 1 567 . 1 1 50 50 LEU CG C 13 27.163 0.106 . 1 . . . . 738 LEU CG . 15996 1 568 . 1 1 50 50 LEU N N 15 129.755 0.033 . 1 . . . . 738 LEU N . 15996 1 569 . 1 1 51 51 PRO HA H 1 4.994 0.007 . 1 . . . . 739 PRO HA . 15996 1 570 . 1 1 51 51 PRO HB2 H 1 2.101 0.008 . 2 . . . . 739 PRO HB2 . 15996 1 571 . 1 1 51 51 PRO HB3 H 1 2.074 0.003 . 2 . . . . 739 PRO HB3 . 15996 1 572 . 1 1 51 51 PRO HD2 H 1 3.699 0.013 . 2 . . . . 739 PRO HD2 . 15996 1 573 . 1 1 51 51 PRO HD3 H 1 3.706 0.001 . 2 . . . . 739 PRO HD3 . 15996 1 574 . 1 1 51 51 PRO HG2 H 1 2.261 0.001 . 2 . . . . 739 PRO HG2 . 15996 1 575 . 1 1 51 51 PRO HG3 H 1 2.263 0.007 . 2 . . . . 739 PRO HG3 . 15996 1 576 . 1 1 51 51 PRO C C 13 175.632 0.001 . 1 . . . . 739 PRO C . 15996 1 577 . 1 1 51 51 PRO CA C 13 62.233 0.049 . 1 . . . . 739 PRO CA . 15996 1 578 . 1 1 51 51 PRO CB C 13 31.480 0.048 . 1 . . . . 739 PRO CB . 15996 1 579 . 1 1 51 51 PRO CD C 13 50.309 0.075 . 1 . . . . 739 PRO CD . 15996 1 580 . 1 1 51 51 PRO CG C 13 27.558 0.067 . 1 . . . . 739 PRO CG . 15996 1 581 . 1 1 52 52 LEU H H 1 9.059 0.004 . 1 . . . . 740 LEU H . 15996 1 582 . 1 1 52 52 LEU HA H 1 4.791 0.005 . 1 . . . . 740 LEU HA . 15996 1 583 . 1 1 52 52 LEU HB2 H 1 1.304 0.005 . 2 . . . . 740 LEU HB2 . 15996 1 584 . 1 1 52 52 LEU HB3 H 1 1.179 0.010 . 2 . . . . 740 LEU HB3 . 15996 1 585 . 1 1 52 52 LEU HD11 H 1 0.619 0.018 . 2 . . . . 740 LEU HD11 . 15996 1 586 . 1 1 52 52 LEU HD12 H 1 0.619 0.018 . 2 . . . . 740 LEU HD12 . 15996 1 587 . 1 1 52 52 LEU HD13 H 1 0.619 0.018 . 2 . . . . 740 LEU HD13 . 15996 1 588 . 1 1 52 52 LEU HD21 H 1 0.258 0.011 . 2 . . . . 740 LEU HD21 . 15996 1 589 . 1 1 52 52 LEU HD22 H 1 0.258 0.011 . 2 . . . . 740 LEU HD22 . 15996 1 590 . 1 1 52 52 LEU HD23 H 1 0.258 0.011 . 2 . . . . 740 LEU HD23 . 15996 1 591 . 1 1 52 52 LEU HG H 1 1.407 0.004 . 1 . . . . 740 LEU HG . 15996 1 592 . 1 1 52 52 LEU C C 13 175.255 0.008 . 1 . . . . 740 LEU C . 15996 1 593 . 1 1 52 52 LEU CA C 13 52.749 0.046 . 1 . . . . 740 LEU CA . 15996 1 594 . 1 1 52 52 LEU CB C 13 46.958 0.061 . 1 . . . . 740 LEU CB . 15996 1 595 . 1 1 52 52 LEU CD1 C 13 23.966 0.039 . 2 . . . . 740 LEU CD1 . 15996 1 596 . 1 1 52 52 LEU CD2 C 13 26.153 0.044 . 2 . . . . 740 LEU CD2 . 15996 1 597 . 1 1 52 52 LEU CG C 13 27.292 0.067 . 1 . . . . 740 LEU CG . 15996 1 598 . 1 1 52 52 LEU N N 15 126.715 0.023 . 1 . . . . 740 LEU N . 15996 1 599 . 1 1 53 53 THR H H 1 6.743 0.005 . 1 . . . . 741 THR H . 15996 1 600 . 1 1 53 53 THR HA H 1 5.516 0.008 . 1 . . . . 741 THR HA . 15996 1 601 . 1 1 53 53 THR HB H 1 4.243 0.006 . 1 . . . . 741 THR HB . 15996 1 602 . 1 1 53 53 THR HG21 H 1 1.204 0.019 . 1 . . . . 741 THR HG21 . 15996 1 603 . 1 1 53 53 THR HG22 H 1 1.204 0.019 . 1 . . . . 741 THR HG22 . 15996 1 604 . 1 1 53 53 THR HG23 H 1 1.204 0.019 . 1 . . . . 741 THR HG23 . 15996 1 605 . 1 1 53 53 THR C C 13 177.312 0.021 . 1 . . . . 741 THR C . 15996 1 606 . 1 1 53 53 THR CA C 13 58.906 0.075 . 1 . . . . 741 THR CA . 15996 1 607 . 1 1 53 53 THR CB C 13 72.870 0.084 . 1 . . . . 741 THR CB . 15996 1 608 . 1 1 53 53 THR CG2 C 13 21.832 0.078 . 1 . . . . 741 THR CG2 . 15996 1 609 . 1 1 53 53 THR N N 15 107.895 0.035 . 1 . . . . 741 THR N . 15996 1 610 . 1 1 54 54 VAL H H 1 8.398 0.007 . 1 . . . . 742 VAL H . 15996 1 611 . 1 1 54 54 VAL HA H 1 3.214 0.009 . 1 . . . . 742 VAL HA . 15996 1 612 . 1 1 54 54 VAL HB H 1 2.338 0.006 . 1 . . . . 742 VAL HB . 15996 1 613 . 1 1 54 54 VAL HG11 H 1 1.039 0.003 . 2 . . . . 742 VAL HG11 . 15996 1 614 . 1 1 54 54 VAL HG12 H 1 1.039 0.003 . 2 . . . . 742 VAL HG12 . 15996 1 615 . 1 1 54 54 VAL HG13 H 1 1.039 0.003 . 2 . . . . 742 VAL HG13 . 15996 1 616 . 1 1 54 54 VAL HG21 H 1 0.674 0.017 . 2 . . . . 742 VAL HG21 . 15996 1 617 . 1 1 54 54 VAL HG22 H 1 0.674 0.017 . 2 . . . . 742 VAL HG22 . 15996 1 618 . 1 1 54 54 VAL HG23 H 1 0.674 0.017 . 2 . . . . 742 VAL HG23 . 15996 1 619 . 1 1 54 54 VAL C C 13 174.889 0.021 . 1 . . . . 742 VAL C . 15996 1 620 . 1 1 54 54 VAL CA C 13 67.895 0.094 . 1 . . . . 742 VAL CA . 15996 1 621 . 1 1 54 54 VAL CB C 13 31.577 0.032 . 1 . . . . 742 VAL CB . 15996 1 622 . 1 1 54 54 VAL CG1 C 13 23.518 0.089 . 2 . . . . 742 VAL CG1 . 15996 1 623 . 1 1 54 54 VAL CG2 C 13 21.583 0.065 . 2 . . . . 742 VAL CG2 . 15996 1 624 . 1 1 54 54 VAL N N 15 123.026 0.058 . 1 . . . . 742 VAL N . 15996 1 625 . 1 1 55 55 CYS H H 1 9.582 0.004 . 1 . . . . 743 CYS H . 15996 1 626 . 1 1 55 55 CYS HA H 1 4.089 0.007 . 1 . . . . 743 CYS HA . 15996 1 627 . 1 1 55 55 CYS HB2 H 1 2.909 0.009 . 2 . . . . 743 CYS HB2 . 15996 1 628 . 1 1 55 55 CYS HB3 H 1 3.864 0.010 . 2 . . . . 743 CYS HB3 . 15996 1 629 . 1 1 55 55 CYS C C 13 175.874 0.001 . 1 . . . . 743 CYS C . 15996 1 630 . 1 1 55 55 CYS CA C 13 61.071 0.103 . 1 . . . . 743 CYS CA . 15996 1 631 . 1 1 55 55 CYS CB C 13 39.778 0.047 . 1 . . . . 743 CYS CB . 15996 1 632 . 1 1 55 55 CYS N N 15 118.488 0.043 . 1 . . . . 743 CYS N . 15996 1 633 . 1 1 56 56 LYS H H 1 7.833 0.006 . 1 . . . . 744 LYS H . 15996 1 634 . 1 1 56 56 LYS HA H 1 3.729 0.017 . 1 . . . . 744 LYS HA . 15996 1 635 . 1 1 56 56 LYS HB2 H 1 1.612 0.011 . 2 . . . . 744 LYS HB2 . 15996 1 636 . 1 1 56 56 LYS HB3 H 1 1.618 0.001 . 2 . . . . 744 LYS HB3 . 15996 1 637 . 1 1 56 56 LYS HD2 H 1 2.013 0.005 . 2 . . . . 744 LYS HD2 . 15996 1 638 . 1 1 56 56 LYS HD3 H 1 2.111 0.024 . 2 . . . . 744 LYS HD3 . 15996 1 639 . 1 1 56 56 LYS HE2 H 1 2.303 0.011 . 2 . . . . 744 LYS HE2 . 15996 1 640 . 1 1 56 56 LYS HE3 H 1 2.397 0.001 . 2 . . . . 744 LYS HE3 . 15996 1 641 . 1 1 56 56 LYS C C 13 173.843 0.019 . 1 . . . . 744 LYS C . 15996 1 642 . 1 1 56 56 LYS CA C 13 60.845 0.075 . 1 . . . . 744 LYS CA . 15996 1 643 . 1 1 56 56 LYS CB C 13 33.400 0.084 . 1 . . . . 744 LYS CB . 15996 1 644 . 1 1 56 56 LYS CD C 13 29.602 0.046 . 1 . . . . 744 LYS CD . 15996 1 645 . 1 1 56 56 LYS CE C 13 36.149 0.060 . 1 . . . . 744 LYS CE . 15996 1 646 . 1 1 56 56 LYS N N 15 118.525 0.042 . 1 . . . . 744 LYS N . 15996 1 647 . 1 1 57 57 MET H H 1 8.145 0.008 . 1 . . . . 745 MET H . 15996 1 648 . 1 1 57 57 MET HA H 1 3.695 0.010 . 1 . . . . 745 MET HA . 15996 1 649 . 1 1 57 57 MET HB2 H 1 1.886 0.010 . 2 . . . . 745 MET HB2 . 15996 1 650 . 1 1 57 57 MET HB3 H 1 2.322 0.010 . 2 . . . . 745 MET HB3 . 15996 1 651 . 1 1 57 57 MET HE1 H 1 1.699 0.013 . 1 . . . . 745 MET HE1 . 15996 1 652 . 1 1 57 57 MET HE2 H 1 1.699 0.013 . 1 . . . . 745 MET HE2 . 15996 1 653 . 1 1 57 57 MET HE3 H 1 1.699 0.013 . 1 . . . . 745 MET HE3 . 15996 1 654 . 1 1 57 57 MET HG2 H 1 1.727 0.015 . 2 . . . . 745 MET HG2 . 15996 1 655 . 1 1 57 57 MET HG3 H 1 1.976 0.006 . 2 . . . . 745 MET HG3 . 15996 1 656 . 1 1 57 57 MET C C 13 172.738 0.007 . 1 . . . . 745 MET C . 15996 1 657 . 1 1 57 57 MET CA C 13 60.064 0.058 . 1 . . . . 745 MET CA . 15996 1 658 . 1 1 57 57 MET CB C 13 33.794 0.081 . 1 . . . . 745 MET CB . 15996 1 659 . 1 1 57 57 MET CE C 13 16.863 0.025 . 1 . . . . 745 MET CE . 15996 1 660 . 1 1 57 57 MET CG C 13 32.873 0.117 . 1 . . . . 745 MET CG . 15996 1 661 . 1 1 57 57 MET N N 15 116.959 0.017 . 1 . . . . 745 MET N . 15996 1 662 . 1 1 58 58 HIS H H 1 7.596 0.008 . 1 . . . . 746 HIS H . 15996 1 663 . 1 1 58 58 HIS HA H 1 3.813 0.013 . 1 . . . . 746 HIS HA . 15996 1 664 . 1 1 58 58 HIS HB2 H 1 2.470 0.006 . 2 . . . . 746 HIS HB2 . 15996 1 665 . 1 1 58 58 HIS HB3 H 1 2.966 0.011 . 2 . . . . 746 HIS HB3 . 15996 1 666 . 1 1 58 58 HIS HD2 H 1 5.806 0.007 . 1 . . . . 746 HIS HD2 . 15996 1 667 . 1 1 58 58 HIS C C 13 173.032 0.007 . 1 . . . . 746 HIS C . 15996 1 668 . 1 1 58 58 HIS CA C 13 60.949 0.069 . 1 . . . . 746 HIS CA . 15996 1 669 . 1 1 58 58 HIS CB C 13 31.361 0.080 . 1 . . . . 746 HIS CB . 15996 1 670 . 1 1 58 58 HIS CD2 C 13 118.141 0.095 . 1 . . . . 746 HIS CD2 . 15996 1 671 . 1 1 58 58 HIS N N 15 119.396 0.037 . 1 . . . . 746 HIS N . 15996 1 672 . 1 1 59 59 VAL H H 1 8.486 0.005 . 1 . . . . 747 VAL H . 15996 1 673 . 1 1 59 59 VAL HA H 1 3.776 0.011 . 1 . . . . 747 VAL HA . 15996 1 674 . 1 1 59 59 VAL HB H 1 2.166 0.009 . 1 . . . . 747 VAL HB . 15996 1 675 . 1 1 59 59 VAL HG11 H 1 1.202 0.007 . 2 . . . . 747 VAL HG11 . 15996 1 676 . 1 1 59 59 VAL HG12 H 1 1.202 0.007 . 2 . . . . 747 VAL HG12 . 15996 1 677 . 1 1 59 59 VAL HG13 H 1 1.202 0.007 . 2 . . . . 747 VAL HG13 . 15996 1 678 . 1 1 59 59 VAL HG21 H 1 0.788 0.011 . 2 . . . . 747 VAL HG21 . 15996 1 679 . 1 1 59 59 VAL HG22 H 1 0.788 0.011 . 2 . . . . 747 VAL HG22 . 15996 1 680 . 1 1 59 59 VAL HG23 H 1 0.788 0.011 . 2 . . . . 747 VAL HG23 . 15996 1 681 . 1 1 59 59 VAL C C 13 173.929 0.007 . 1 . . . . 747 VAL C . 15996 1 682 . 1 1 59 59 VAL CA C 13 67.440 0.076 . 1 . . . . 747 VAL CA . 15996 1 683 . 1 1 59 59 VAL CB C 13 31.619 0.076 . 1 . . . . 747 VAL CB . 15996 1 684 . 1 1 59 59 VAL CG1 C 13 24.352 0.048 . 2 . . . . 747 VAL CG1 . 15996 1 685 . 1 1 59 59 VAL CG2 C 13 22.870 0.039 . 2 . . . . 747 VAL CG2 . 15996 1 686 . 1 1 59 59 VAL N N 15 121.271 0.036 . 1 . . . . 747 VAL N . 15996 1 687 . 1 1 60 60 LEU H H 1 8.837 0.006 . 1 . . . . 748 LEU H . 15996 1 688 . 1 1 60 60 LEU HA H 1 4.013 0.010 . 1 . . . . 748 LEU HA . 15996 1 689 . 1 1 60 60 LEU HB2 H 1 1.581 0.016 . 2 . . . . 748 LEU HB2 . 15996 1 690 . 1 1 60 60 LEU HB3 H 1 1.746 0.014 . 2 . . . . 748 LEU HB3 . 15996 1 691 . 1 1 60 60 LEU HD11 H 1 0.852 0.003 . 2 . . . . 748 LEU HD11 . 15996 1 692 . 1 1 60 60 LEU HD12 H 1 0.852 0.003 . 2 . . . . 748 LEU HD12 . 15996 1 693 . 1 1 60 60 LEU HD13 H 1 0.852 0.003 . 2 . . . . 748 LEU HD13 . 15996 1 694 . 1 1 60 60 LEU HD21 H 1 0.329 0.004 . 2 . . . . 748 LEU HD21 . 15996 1 695 . 1 1 60 60 LEU HD22 H 1 0.329 0.004 . 2 . . . . 748 LEU HD22 . 15996 1 696 . 1 1 60 60 LEU HD23 H 1 0.329 0.004 . 2 . . . . 748 LEU HD23 . 15996 1 697 . 1 1 60 60 LEU C C 13 172.722 0.026 . 1 . . . . 748 LEU C . 15996 1 698 . 1 1 60 60 LEU CA C 13 58.656 0.067 . 1 . . . . 748 LEU CA . 15996 1 699 . 1 1 60 60 LEU CB C 13 40.320 0.076 . 1 . . . . 748 LEU CB . 15996 1 700 . 1 1 60 60 LEU CD1 C 13 22.861 0.067 . 2 . . . . 748 LEU CD1 . 15996 1 701 . 1 1 60 60 LEU CD2 C 13 25.223 0.061 . 2 . . . . 748 LEU CD2 . 15996 1 702 . 1 1 60 60 LEU N N 15 121.390 0.040 . 1 . . . . 748 LEU N . 15996 1 703 . 1 1 61 61 HIS H H 1 7.935 0.005 . 1 . . . . 749 HIS H . 15996 1 704 . 1 1 61 61 HIS HA H 1 4.351 0.009 . 1 . . . . 749 HIS HA . 15996 1 705 . 1 1 61 61 HIS HB2 H 1 3.139 0.015 . 2 . . . . 749 HIS HB2 . 15996 1 706 . 1 1 61 61 HIS HB3 H 1 3.263 0.012 . 2 . . . . 749 HIS HB3 . 15996 1 707 . 1 1 61 61 HIS HD2 H 1 7.189 0.019 . 1 . . . . 749 HIS HD2 . 15996 1 708 . 1 1 61 61 HIS C C 13 173.239 0.021 . 1 . . . . 749 HIS C . 15996 1 709 . 1 1 61 61 HIS CA C 13 59.499 0.093 . 1 . . . . 749 HIS CA . 15996 1 710 . 1 1 61 61 HIS CB C 13 27.719 0.108 . 1 . . . . 749 HIS CB . 15996 1 711 . 1 1 61 61 HIS CD2 C 13 120.693 0.068 . 1 . . . . 749 HIS CD2 . 15996 1 712 . 1 1 61 61 HIS N N 15 118.062 0.048 . 1 . . . . 749 HIS N . 15996 1 713 . 1 1 62 62 CYS H H 1 7.999 0.005 . 1 . . . . 750 CYS H . 15996 1 714 . 1 1 62 62 CYS HA H 1 4.161 0.005 . 1 . . . . 750 CYS HA . 15996 1 715 . 1 1 62 62 CYS HB2 H 1 3.055 0.011 . 2 . . . . 750 CYS HB2 . 15996 1 716 . 1 1 62 62 CYS HB3 H 1 4.083 0.015 . 2 . . . . 750 CYS HB3 . 15996 1 717 . 1 1 62 62 CYS C C 13 175.640 0.009 . 1 . . . . 750 CYS C . 15996 1 718 . 1 1 62 62 CYS CA C 13 60.177 0.050 . 1 . . . . 750 CYS CA . 15996 1 719 . 1 1 62 62 CYS CB C 13 36.968 0.076 . 1 . . . . 750 CYS CB . 15996 1 720 . 1 1 62 62 CYS N N 15 122.566 0.051 . 1 . . . . 750 CYS N . 15996 1 721 . 1 1 63 63 GLN H H 1 7.730 0.008 . 1 . . . . 751 GLN H . 15996 1 722 . 1 1 63 63 GLN HA H 1 4.262 0.011 . 1 . . . . 751 GLN HA . 15996 1 723 . 1 1 63 63 GLN HB2 H 1 2.412 0.006 . 2 . . . . 751 GLN HB2 . 15996 1 724 . 1 1 63 63 GLN HB3 H 1 2.254 0.009 . 2 . . . . 751 GLN HB3 . 15996 1 725 . 1 1 63 63 GLN HE21 H 1 6.498 0.003 . 1 . . . . 751 GLN HE21 . 15996 1 726 . 1 1 63 63 GLN HE22 H 1 7.398 0.002 . 1 . . . . 751 GLN HE22 . 15996 1 727 . 1 1 63 63 GLN HG2 H 1 2.486 0.005 . 2 . . . . 751 GLN HG2 . 15996 1 728 . 1 1 63 63 GLN HG3 H 1 2.749 0.010 . 2 . . . . 751 GLN HG3 . 15996 1 729 . 1 1 63 63 GLN C C 13 176.146 0.009 . 1 . . . . 751 GLN C . 15996 1 730 . 1 1 63 63 GLN CA C 13 56.608 0.075 . 1 . . . . 751 GLN CA . 15996 1 731 . 1 1 63 63 GLN CB C 13 29.113 0.079 . 1 . . . . 751 GLN CB . 15996 1 732 . 1 1 63 63 GLN CG C 13 33.704 0.083 . 1 . . . . 751 GLN CG . 15996 1 733 . 1 1 63 63 GLN N N 15 116.285 0.038 . 1 . . . . 751 GLN N . 15996 1 734 . 1 1 63 63 GLN NE2 N 15 110.004 0.043 . 1 . . . . 751 GLN NE2 . 15996 1 735 . 1 1 64 64 GLY H H 1 7.808 0.005 . 1 . . . . 752 GLY H . 15996 1 736 . 1 1 64 64 GLY HA2 H 1 3.705 0.005 . 2 . . . . 752 GLY HA2 . 15996 1 737 . 1 1 64 64 GLY HA3 H 1 4.204 0.007 . 2 . . . . 752 GLY HA3 . 15996 1 738 . 1 1 64 64 GLY C C 13 177.793 0.007 . 1 . . . . 752 GLY C . 15996 1 739 . 1 1 64 64 GLY CA C 13 45.462 0.054 . 1 . . . . 752 GLY CA . 15996 1 740 . 1 1 64 64 GLY N N 15 107.374 0.034 . 1 . . . . 752 GLY N . 15996 1 741 . 1 1 65 65 ARG H H 1 8.153 0.005 . 1 . . . . 753 ARG H . 15996 1 742 . 1 1 65 65 ARG HA H 1 4.480 0.009 . 1 . . . . 753 ARG HA . 15996 1 743 . 1 1 65 65 ARG HB2 H 1 1.745 0.007 . 2 . . . . 753 ARG HB2 . 15996 1 744 . 1 1 65 65 ARG HB3 H 1 1.900 0.014 . 2 . . . . 753 ARG HB3 . 15996 1 745 . 1 1 65 65 ARG HD2 H 1 3.194 0.001 . 2 . . . . 753 ARG HD2 . 15996 1 746 . 1 1 65 65 ARG HD3 H 1 3.195 0.008 . 2 . . . . 753 ARG HD3 . 15996 1 747 . 1 1 65 65 ARG HE H 1 7.410 0.004 . 1 . . . . 753 ARG HE . 15996 1 748 . 1 1 65 65 ARG HG2 H 1 1.595 0.014 . 2 . . . . 753 ARG HG2 . 15996 1 749 . 1 1 65 65 ARG HG3 H 1 1.636 0.005 . 2 . . . . 753 ARG HG3 . 15996 1 750 . 1 1 65 65 ARG C C 13 177.386 0.018 . 1 . . . . 753 ARG C . 15996 1 751 . 1 1 65 65 ARG CA C 13 54.089 0.069 . 1 . . . . 753 ARG CA . 15996 1 752 . 1 1 65 65 ARG CB C 13 30.978 0.091 . 1 . . . . 753 ARG CB . 15996 1 753 . 1 1 65 65 ARG CD C 13 43.036 0.080 . 1 . . . . 753 ARG CD . 15996 1 754 . 1 1 65 65 ARG CG C 13 26.468 0.098 . 1 . . . . 753 ARG CG . 15996 1 755 . 1 1 65 65 ARG N N 15 120.655 0.030 . 1 . . . . 753 ARG N . 15996 1 756 . 1 1 65 65 ARG NE N 15 84.147 0.023 . 1 . . . . 753 ARG NE . 15996 1 757 . 1 1 66 66 ASN H H 1 8.456 0.006 . 1 . . . . 754 ASN H . 15996 1 758 . 1 1 66 66 ASN HA H 1 4.801 0.004 . 1 . . . . 754 ASN HA . 15996 1 759 . 1 1 66 66 ASN HB2 H 1 2.565 0.010 . 2 . . . . 754 ASN HB2 . 15996 1 760 . 1 1 66 66 ASN HB3 H 1 2.649 0.010 . 2 . . . . 754 ASN HB3 . 15996 1 761 . 1 1 66 66 ASN HD21 H 1 6.854 0.014 . 1 . . . . 754 ASN HD21 . 15996 1 762 . 1 1 66 66 ASN HD22 H 1 7.598 0.003 . 1 . . . . 754 ASN HD22 . 15996 1 763 . 1 1 66 66 ASN C C 13 178.444 0.006 . 1 . . . . 754 ASN C . 15996 1 764 . 1 1 66 66 ASN CA C 13 53.687 0.087 . 1 . . . . 754 ASN CA . 15996 1 765 . 1 1 66 66 ASN CB C 13 39.104 0.041 . 1 . . . . 754 ASN CB . 15996 1 766 . 1 1 66 66 ASN N N 15 122.096 0.046 . 1 . . . . 754 ASN N . 15996 1 767 . 1 1 66 66 ASN ND2 N 15 113.074 0.041 . 1 . . . . 754 ASN ND2 . 15996 1 768 . 1 1 67 67 TYR H H 1 8.088 0.012 . 1 . . . . 755 TYR H . 15996 1 769 . 1 1 67 67 TYR HA H 1 5.236 0.009 . 1 . . . . 755 TYR HA . 15996 1 770 . 1 1 67 67 TYR HB2 H 1 2.444 0.010 . 2 . . . . 755 TYR HB2 . 15996 1 771 . 1 1 67 67 TYR HB3 H 1 2.739 0.029 . 2 . . . . 755 TYR HB3 . 15996 1 772 . 1 1 67 67 TYR HD1 H 1 6.756 0.003 . 3 . . . . 755 TYR HD1 . 15996 1 773 . 1 1 67 67 TYR HD2 H 1 6.756 0.003 . 3 . . . . 755 TYR HD2 . 15996 1 774 . 1 1 67 67 TYR HE1 H 1 6.595 0.004 . 3 . . . . 755 TYR HE1 . 15996 1 775 . 1 1 67 67 TYR HE2 H 1 6.595 0.004 . 3 . . . . 755 TYR HE2 . 15996 1 776 . 1 1 67 67 TYR C C 13 176.682 0.001 . 1 . . . . 755 TYR C . 15996 1 777 . 1 1 67 67 TYR CA C 13 56.674 0.053 . 1 . . . . 755 TYR CA . 15996 1 778 . 1 1 67 67 TYR CB C 13 42.308 0.102 . 1 . . . . 755 TYR CB . 15996 1 779 . 1 1 67 67 TYR CD1 C 13 132.362 0.066 . 3 . . . . 755 TYR CD1 . 15996 1 780 . 1 1 67 67 TYR CD2 C 13 132.362 0.066 . 3 . . . . 755 TYR CD2 . 15996 1 781 . 1 1 67 67 TYR CE1 C 13 118.933 0.033 . 3 . . . . 755 TYR CE1 . 15996 1 782 . 1 1 67 67 TYR CE2 C 13 118.933 0.033 . 3 . . . . 755 TYR CE2 . 15996 1 783 . 1 1 67 67 TYR N N 15 123.871 0.058 . 1 . . . . 755 TYR N . 15996 1 784 . 1 1 68 68 THR H H 1 8.733 0.006 . 1 . . . . 756 THR H . 15996 1 785 . 1 1 68 68 THR HA H 1 4.512 0.010 . 1 . . . . 756 THR HA . 15996 1 786 . 1 1 68 68 THR HB H 1 3.957 0.007 . 1 . . . . 756 THR HB . 15996 1 787 . 1 1 68 68 THR HG21 H 1 1.159 0.012 . 1 . . . . 756 THR HG21 . 15996 1 788 . 1 1 68 68 THR HG22 H 1 1.159 0.012 . 1 . . . . 756 THR HG22 . 15996 1 789 . 1 1 68 68 THR HG23 H 1 1.159 0.012 . 1 . . . . 756 THR HG23 . 15996 1 790 . 1 1 68 68 THR C C 13 178.124 0.006 . 1 . . . . 756 THR C . 15996 1 791 . 1 1 68 68 THR CA C 13 60.137 0.084 . 1 . . . . 756 THR CA . 15996 1 792 . 1 1 68 68 THR CB C 13 71.074 0.089 . 1 . . . . 756 THR CB . 15996 1 793 . 1 1 68 68 THR CG2 C 13 21.766 0.105 . 1 . . . . 756 THR CG2 . 15996 1 794 . 1 1 68 68 THR N N 15 115.077 0.037 . 1 . . . . 756 THR N . 15996 1 795 . 1 1 69 69 LEU H H 1 8.712 0.005 . 1 . . . . 757 LEU H . 15996 1 796 . 1 1 69 69 LEU HA H 1 4.434 0.004 . 1 . . . . 757 LEU HA . 15996 1 797 . 1 1 69 69 LEU HB2 H 1 1.541 0.005 . 2 . . . . 757 LEU HB2 . 15996 1 798 . 1 1 69 69 LEU HB3 H 1 1.559 0.001 . 2 . . . . 757 LEU HB3 . 15996 1 799 . 1 1 69 69 LEU HD11 H 1 0.724 0.008 . 2 . . . . 757 LEU HD11 . 15996 1 800 . 1 1 69 69 LEU HD12 H 1 0.724 0.008 . 2 . . . . 757 LEU HD12 . 15996 1 801 . 1 1 69 69 LEU HD13 H 1 0.724 0.008 . 2 . . . . 757 LEU HD13 . 15996 1 802 . 1 1 69 69 LEU HD21 H 1 0.698 0.004 . 2 . . . . 757 LEU HD21 . 15996 1 803 . 1 1 69 69 LEU HD22 H 1 0.698 0.004 . 2 . . . . 757 LEU HD22 . 15996 1 804 . 1 1 69 69 LEU HD23 H 1 0.698 0.004 . 2 . . . . 757 LEU HD23 . 15996 1 805 . 1 1 69 69 LEU C C 13 174.822 0.022 . 1 . . . . 757 LEU C . 15996 1 806 . 1 1 69 69 LEU CA C 13 55.967 0.086 . 1 . . . . 757 LEU CA . 15996 1 807 . 1 1 69 69 LEU CB C 13 42.968 0.077 . 1 . . . . 757 LEU CB . 15996 1 808 . 1 1 69 69 LEU CD1 C 13 25.760 0.066 . 2 . . . . 757 LEU CD1 . 15996 1 809 . 1 1 69 69 LEU CD2 C 13 24.366 0.028 . 2 . . . . 757 LEU CD2 . 15996 1 810 . 1 1 69 69 LEU N N 15 126.266 0.026 . 1 . . . . 757 LEU N . 15996 1 811 . 1 1 70 70 THR H H 1 8.117 0.005 . 1 . . . . 758 THR H . 15996 1 812 . 1 1 70 70 THR HA H 1 4.524 0.005 . 1 . . . . 758 THR HA . 15996 1 813 . 1 1 70 70 THR HB H 1 4.248 0.008 . 1 . . . . 758 THR HB . 15996 1 814 . 1 1 70 70 THR HG21 H 1 0.975 0.004 . 1 . . . . 758 THR HG21 . 15996 1 815 . 1 1 70 70 THR HG22 H 1 0.975 0.004 . 1 . . . . 758 THR HG22 . 15996 1 816 . 1 1 70 70 THR HG23 H 1 0.975 0.004 . 1 . . . . 758 THR HG23 . 15996 1 817 . 1 1 70 70 THR C C 13 176.637 0.009 . 1 . . . . 758 THR C . 15996 1 818 . 1 1 70 70 THR CA C 13 60.684 0.053 . 1 . . . . 758 THR CA . 15996 1 819 . 1 1 70 70 THR CB C 13 69.390 0.076 . 1 . . . . 758 THR CB . 15996 1 820 . 1 1 70 70 THR CG2 C 13 23.008 0.041 . 1 . . . . 758 THR CG2 . 15996 1 821 . 1 1 70 70 THR N N 15 115.872 0.053 . 1 . . . . 758 THR N . 15996 1 822 . 1 1 71 71 GLY H H 1 8.449 0.006 . 1 . . . . 759 GLY H . 15996 1 823 . 1 1 71 71 GLY HA2 H 1 3.927 0.005 . 2 . . . . 759 GLY HA2 . 15996 1 824 . 1 1 71 71 GLY HA3 H 1 4.073 0.008 . 2 . . . . 759 GLY HA3 . 15996 1 825 . 1 1 71 71 GLY C C 13 175.636 0.022 . 1 . . . . 759 GLY C . 15996 1 826 . 1 1 71 71 GLY CA C 13 45.117 0.111 . 1 . . . . 759 GLY CA . 15996 1 827 . 1 1 71 71 GLY N N 15 105.630 0.021 . 1 . . . . 759 GLY N . 15996 1 828 . 1 1 72 72 ARG H H 1 8.735 0.004 . 1 . . . . 760 ARG H . 15996 1 829 . 1 1 72 72 ARG HA H 1 4.147 0.007 . 1 . . . . 760 ARG HA . 15996 1 830 . 1 1 72 72 ARG HB2 H 1 1.788 0.006 . 2 . . . . 760 ARG HB2 . 15996 1 831 . 1 1 72 72 ARG HB3 H 1 1.899 0.005 . 2 . . . . 760 ARG HB3 . 15996 1 832 . 1 1 72 72 ARG HD2 H 1 3.176 0.005 . 2 . . . . 760 ARG HD2 . 15996 1 833 . 1 1 72 72 ARG HD3 H 1 3.186 0.003 . 2 . . . . 760 ARG HD3 . 15996 1 834 . 1 1 72 72 ARG HE H 1 7.222 0.005 . 1 . . . . 760 ARG HE . 15996 1 835 . 1 1 72 72 ARG HG2 H 1 1.629 0.005 . 2 . . . . 760 ARG HG2 . 15996 1 836 . 1 1 72 72 ARG HG3 H 1 1.644 0.004 . 2 . . . . 760 ARG HG3 . 15996 1 837 . 1 1 72 72 ARG C C 13 176.165 0.008 . 1 . . . . 760 ARG C . 15996 1 838 . 1 1 72 72 ARG CA C 13 58.362 0.107 . 1 . . . . 760 ARG CA . 15996 1 839 . 1 1 72 72 ARG CB C 13 29.994 0.093 . 1 . . . . 760 ARG CB . 15996 1 840 . 1 1 72 72 ARG CD C 13 43.417 0.087 . 1 . . . . 760 ARG CD . 15996 1 841 . 1 1 72 72 ARG CG C 13 26.552 0.091 . 1 . . . . 760 ARG CG . 15996 1 842 . 1 1 72 72 ARG N N 15 122.473 0.023 . 1 . . . . 760 ARG N . 15996 1 843 . 1 1 72 72 ARG NE N 15 84.796 0.047 . 1 . . . . 760 ARG NE . 15996 1 844 . 1 1 73 73 ASP H H 1 8.479 0.004 . 1 . . . . 761 ASP H . 15996 1 845 . 1 1 73 73 ASP HA H 1 4.742 0.015 . 1 . . . . 761 ASP HA . 15996 1 846 . 1 1 73 73 ASP HB2 H 1 2.660 0.004 . 2 . . . . 761 ASP HB2 . 15996 1 847 . 1 1 73 73 ASP HB3 H 1 2.770 0.008 . 2 . . . . 761 ASP HB3 . 15996 1 848 . 1 1 73 73 ASP C C 13 175.356 0.001 . 1 . . . . 761 ASP C . 15996 1 849 . 1 1 73 73 ASP CA C 13 54.393 0.097 . 1 . . . . 761 ASP CA . 15996 1 850 . 1 1 73 73 ASP CB C 13 40.042 0.037 . 1 . . . . 761 ASP CB . 15996 1 851 . 1 1 73 73 ASP N N 15 115.997 0.035 . 1 . . . . 761 ASP N . 15996 1 852 . 1 1 74 74 SER H H 1 7.853 0.004 . 1 . . . . 762 SER H . 15996 1 853 . 1 1 74 74 SER HA H 1 4.186 0.010 . 1 . . . . 762 SER HA . 15996 1 854 . 1 1 74 74 SER HB2 H 1 3.821 0.008 . 2 . . . . 762 SER HB2 . 15996 1 855 . 1 1 74 74 SER HB3 H 1 4.015 0.012 . 2 . . . . 762 SER HB3 . 15996 1 856 . 1 1 74 74 SER C C 13 179.606 0.001 . 1 . . . . 762 SER C . 15996 1 857 . 1 1 74 74 SER CA C 13 59.820 0.070 . 1 . . . . 762 SER CA . 15996 1 858 . 1 1 74 74 SER CB C 13 64.714 0.105 . 1 . . . . 762 SER CB . 15996 1 859 . 1 1 74 74 SER N N 15 113.728 0.029 . 1 . . . . 762 SER N . 15996 1 860 . 1 1 75 75 CYS H H 1 7.806 0.005 . 1 . . . . 763 CYS H . 15996 1 861 . 1 1 75 75 CYS HA H 1 4.963 0.005 . 1 . . . . 763 CYS HA . 15996 1 862 . 1 1 75 75 CYS HB2 H 1 2.653 0.007 . 2 . . . . 763 CYS HB2 . 15996 1 863 . 1 1 75 75 CYS HB3 H 1 2.951 0.006 . 2 . . . . 763 CYS HB3 . 15996 1 864 . 1 1 75 75 CYS C C 13 180.628 0.004 . 1 . . . . 763 CYS C . 15996 1 865 . 1 1 75 75 CYS CA C 13 56.229 0.062 . 1 . . . . 763 CYS CA . 15996 1 866 . 1 1 75 75 CYS CB C 13 37.640 0.038 . 1 . . . . 763 CYS CB . 15996 1 867 . 1 1 75 75 CYS N N 15 122.198 0.021 . 1 . . . . 763 CYS N . 15996 1 868 . 1 1 76 76 THR H H 1 8.566 0.007 . 1 . . . . 764 THR H . 15996 1 869 . 1 1 76 76 THR HA H 1 4.352 0.003 . 1 . . . . 764 THR HA . 15996 1 870 . 1 1 76 76 THR HB H 1 3.940 0.008 . 1 . . . . 764 THR HB . 15996 1 871 . 1 1 76 76 THR HG21 H 1 1.155 0.009 . 1 . . . . 764 THR HG21 . 15996 1 872 . 1 1 76 76 THR HG22 H 1 1.155 0.009 . 1 . . . . 764 THR HG22 . 15996 1 873 . 1 1 76 76 THR HG23 H 1 1.155 0.009 . 1 . . . . 764 THR HG23 . 15996 1 874 . 1 1 76 76 THR C C 13 178.310 0.006 . 1 . . . . 764 THR C . 15996 1 875 . 1 1 76 76 THR CA C 13 61.730 0.021 . 1 . . . . 764 THR CA . 15996 1 876 . 1 1 76 76 THR CB C 13 69.320 0.076 . 1 . . . . 764 THR CB . 15996 1 877 . 1 1 76 76 THR CG2 C 13 21.625 0.076 . 1 . . . . 764 THR CG2 . 15996 1 878 . 1 1 76 76 THR N N 15 117.976 0.037 . 1 . . . . 764 THR N . 15996 1 879 . 1 1 77 77 LEU H H 1 8.535 0.003 . 1 . . . . 765 LEU H . 15996 1 880 . 1 1 77 77 LEU HA H 1 4.476 0.005 . 1 . . . . 765 LEU HA . 15996 1 881 . 1 1 77 77 LEU HB2 H 1 1.424 0.009 . 2 . . . . 765 LEU HB2 . 15996 1 882 . 1 1 77 77 LEU HB3 H 1 1.625 0.005 . 2 . . . . 765 LEU HB3 . 15996 1 883 . 1 1 77 77 LEU HD11 H 1 0.854 0.004 . 2 . . . . 765 LEU HD11 . 15996 1 884 . 1 1 77 77 LEU HD12 H 1 0.854 0.004 . 2 . . . . 765 LEU HD12 . 15996 1 885 . 1 1 77 77 LEU HD13 H 1 0.854 0.004 . 2 . . . . 765 LEU HD13 . 15996 1 886 . 1 1 77 77 LEU HD21 H 1 0.731 0.007 . 2 . . . . 765 LEU HD21 . 15996 1 887 . 1 1 77 77 LEU HD22 H 1 0.731 0.007 . 2 . . . . 765 LEU HD22 . 15996 1 888 . 1 1 77 77 LEU HD23 H 1 0.731 0.007 . 2 . . . . 765 LEU HD23 . 15996 1 889 . 1 1 77 77 LEU HG H 1 1.693 0.008 . 1 . . . . 765 LEU HG . 15996 1 890 . 1 1 77 77 LEU C C 13 177.113 0.001 . 1 . . . . 765 LEU C . 15996 1 891 . 1 1 77 77 LEU CA C 13 52.598 0.044 . 1 . . . . 765 LEU CA . 15996 1 892 . 1 1 77 77 LEU CB C 13 40.621 0.102 . 1 . . . . 765 LEU CB . 15996 1 893 . 1 1 77 77 LEU CD1 C 13 25.319 0.065 . 2 . . . . 765 LEU CD1 . 15996 1 894 . 1 1 77 77 LEU CD2 C 13 22.803 0.047 . 2 . . . . 765 LEU CD2 . 15996 1 895 . 1 1 77 77 LEU CG C 13 26.396 0.125 . 1 . . . . 765 LEU CG . 15996 1 896 . 1 1 77 77 LEU N N 15 129.094 0.046 . 1 . . . . 765 LEU N . 15996 1 897 . 1 1 78 78 PRO HA H 1 4.346 0.016 . 1 . . . . 766 PRO HA . 15996 1 898 . 1 1 78 78 PRO HB2 H 1 1.887 0.004 . 2 . . . . 766 PRO HB2 . 15996 1 899 . 1 1 78 78 PRO HB3 H 1 2.256 0.005 . 2 . . . . 766 PRO HB3 . 15996 1 900 . 1 1 78 78 PRO HD2 H 1 3.547 0.013 . 2 . . . . 766 PRO HD2 . 15996 1 901 . 1 1 78 78 PRO HD3 H 1 3.660 0.008 . 2 . . . . 766 PRO HD3 . 15996 1 902 . 1 1 78 78 PRO HG2 H 1 2.046 0.008 . 2 . . . . 766 PRO HG2 . 15996 1 903 . 1 1 78 78 PRO HG3 H 1 1.962 0.024 . 2 . . . . 766 PRO HG3 . 15996 1 904 . 1 1 78 78 PRO C C 13 175.420 0.004 . 1 . . . . 766 PRO C . 15996 1 905 . 1 1 78 78 PRO CA C 13 62.797 0.044 . 1 . . . . 766 PRO CA . 15996 1 906 . 1 1 78 78 PRO CB C 13 31.979 0.068 . 1 . . . . 766 PRO CB . 15996 1 907 . 1 1 78 78 PRO CD C 13 50.740 0.039 . 1 . . . . 766 PRO CD . 15996 1 908 . 1 1 78 78 PRO CG C 13 27.567 0.082 . 1 . . . . 766 PRO CG . 15996 1 909 . 1 1 79 79 ALA H H 1 8.418 0.003 . 1 . . . . 767 ALA H . 15996 1 910 . 1 1 79 79 ALA HA H 1 4.307 0.006 . 1 . . . . 767 ALA HA . 15996 1 911 . 1 1 79 79 ALA HB1 H 1 1.389 0.006 . 1 . . . . 767 ALA HB1 . 15996 1 912 . 1 1 79 79 ALA HB2 H 1 1.389 0.006 . 1 . . . . 767 ALA HB2 . 15996 1 913 . 1 1 79 79 ALA HB3 H 1 1.389 0.006 . 1 . . . . 767 ALA HB3 . 15996 1 914 . 1 1 79 79 ALA C C 13 173.862 0.003 . 1 . . . . 767 ALA C . 15996 1 915 . 1 1 79 79 ALA CA C 13 52.099 0.075 . 1 . . . . 767 ALA CA . 15996 1 916 . 1 1 79 79 ALA CB C 13 19.034 0.109 . 1 . . . . 767 ALA CB . 15996 1 917 . 1 1 79 79 ALA N N 15 125.434 0.026 . 1 . . . . 767 ALA N . 15996 1 918 . 1 1 80 80 SER H H 1 8.558 0.006 . 1 . . . . 768 SER H . 15996 1 919 . 1 1 80 80 SER HA H 1 4.438 0.006 . 1 . . . . 768 SER HA . 15996 1 920 . 1 1 80 80 SER HB2 H 1 3.897 0.004 . 2 . . . . 768 SER HB2 . 15996 1 921 . 1 1 80 80 SER HB3 H 1 3.877 0.011 . 2 . . . . 768 SER HB3 . 15996 1 922 . 1 1 80 80 SER C C 13 177.855 0.012 . 1 . . . . 768 SER C . 15996 1 923 . 1 1 80 80 SER CA C 13 58.328 0.099 . 1 . . . . 768 SER CA . 15996 1 924 . 1 1 80 80 SER CB C 13 63.781 0.076 . 1 . . . . 768 SER CB . 15996 1 925 . 1 1 80 80 SER N N 15 116.943 0.016 . 1 . . . . 768 SER N . 15996 1 926 . 1 1 81 81 ALA H H 1 8.289 0.006 . 1 . . . . 769 ALA H . 15996 1 927 . 1 1 81 81 ALA HA H 1 4.433 0.003 . 1 . . . . 769 ALA HA . 15996 1 928 . 1 1 81 81 ALA HB1 H 1 1.394 0.005 . 1 . . . . 769 ALA HB1 . 15996 1 929 . 1 1 81 81 ALA HB2 H 1 1.394 0.005 . 1 . . . . 769 ALA HB2 . 15996 1 930 . 1 1 81 81 ALA HB3 H 1 1.394 0.005 . 1 . . . . 769 ALA HB3 . 15996 1 931 . 1 1 81 81 ALA C C 13 174.777 0.004 . 1 . . . . 769 ALA C . 15996 1 932 . 1 1 81 81 ALA CA C 13 51.919 0.068 . 1 . . . . 769 ALA CA . 15996 1 933 . 1 1 81 81 ALA CB C 13 20.057 0.068 . 1 . . . . 769 ALA CB . 15996 1 934 . 1 1 81 81 ALA N N 15 126.964 0.029 . 1 . . . . 769 ALA N . 15996 1 935 . 1 1 82 82 GLU H H 1 8.495 0.003 . 1 . . . . 770 GLU H . 15996 1 936 . 1 1 82 82 GLU HA H 1 4.226 0.007 . 1 . . . . 770 GLU HA . 15996 1 937 . 1 1 82 82 GLU HB2 H 1 1.978 0.011 . 2 . . . . 770 GLU HB2 . 15996 1 938 . 1 1 82 82 GLU HB3 H 1 1.952 0.003 . 2 . . . . 770 GLU HB3 . 15996 1 939 . 1 1 82 82 GLU HG2 H 1 2.283 0.008 . 2 . . . . 770 GLU HG2 . 15996 1 940 . 1 1 82 82 GLU HG3 H 1 2.207 0.006 . 2 . . . . 770 GLU HG3 . 15996 1 941 . 1 1 82 82 GLU C C 13 175.761 0.009 . 1 . . . . 770 GLU C . 15996 1 942 . 1 1 82 82 GLU CA C 13 56.767 0.036 . 1 . . . . 770 GLU CA . 15996 1 943 . 1 1 82 82 GLU CB C 13 29.926 0.124 . 1 . . . . 770 GLU CB . 15996 1 944 . 1 1 82 82 GLU CG C 13 36.406 0.073 . 1 . . . . 770 GLU CG . 15996 1 945 . 1 1 82 82 GLU N N 15 120.787 0.035 . 1 . . . . 770 GLU N . 15996 1 946 . 1 1 83 83 LYS H H 1 8.428 0.004 . 1 . . . . 771 LYS H . 15996 1 947 . 1 1 83 83 LYS HA H 1 4.461 0.007 . 1 . . . . 771 LYS HA . 15996 1 948 . 1 1 83 83 LYS HB2 H 1 1.652 0.011 . 2 . . . . 771 LYS HB2 . 15996 1 949 . 1 1 83 83 LYS HB3 H 1 1.719 0.004 . 2 . . . . 771 LYS HB3 . 15996 1 950 . 1 1 83 83 LYS HD2 H 1 1.619 0.009 . 2 . . . . 771 LYS HD2 . 15996 1 951 . 1 1 83 83 LYS HD3 H 1 1.707 0.010 . 2 . . . . 771 LYS HD3 . 15996 1 952 . 1 1 83 83 LYS HE2 H 1 3.005 0.001 . 2 . . . . 771 LYS HE2 . 15996 1 953 . 1 1 83 83 LYS HE3 H 1 2.950 0.010 . 2 . . . . 771 LYS HE3 . 15996 1 954 . 1 1 83 83 LYS HG2 H 1 1.404 0.001 . 2 . . . . 771 LYS HG2 . 15996 1 955 . 1 1 83 83 LYS HG3 H 1 1.430 0.018 . 2 . . . . 771 LYS HG3 . 15996 1 956 . 1 1 83 83 LYS C C 13 177.134 0.002 . 1 . . . . 771 LYS C . 15996 1 957 . 1 1 83 83 LYS CA C 13 54.114 0.072 . 1 . . . . 771 LYS CA . 15996 1 958 . 1 1 83 83 LYS CB C 13 34.639 0.092 . 1 . . . . 771 LYS CB . 15996 1 959 . 1 1 83 83 LYS CD C 13 28.123 0.099 . 1 . . . . 771 LYS CD . 15996 1 960 . 1 1 83 83 LYS CE C 13 42.242 0.077 . 1 . . . . 771 LYS CE . 15996 1 961 . 1 1 83 83 LYS CG C 13 24.706 0.005 . 1 . . . . 771 LYS CG . 15996 1 962 . 1 1 83 83 LYS N N 15 123.413 0.048 . 1 . . . . 771 LYS N . 15996 1 963 . 1 1 84 84 ALA H H 1 8.274 0.003 . 1 . . . . 772 ALA H . 15996 1 964 . 1 1 84 84 ALA HA H 1 4.575 0.008 . 1 . . . . 772 ALA HA . 15996 1 965 . 1 1 84 84 ALA HB1 H 1 1.378 0.004 . 1 . . . . 772 ALA HB1 . 15996 1 966 . 1 1 84 84 ALA HB2 H 1 1.378 0.004 . 1 . . . . 772 ALA HB2 . 15996 1 967 . 1 1 84 84 ALA HB3 H 1 1.378 0.004 . 1 . . . . 772 ALA HB3 . 15996 1 968 . 1 1 84 84 ALA C C 13 174.966 0.002 . 1 . . . . 772 ALA C . 15996 1 969 . 1 1 84 84 ALA CA C 13 50.757 0.015 . 1 . . . . 772 ALA CA . 15996 1 970 . 1 1 84 84 ALA CB C 13 20.450 0.097 . 1 . . . . 772 ALA CB . 15996 1 971 . 1 1 84 84 ALA N N 15 124.024 0.053 . 1 . . . . 772 ALA N . 15996 1 972 . 1 1 85 85 CYS H H 1 7.823 0.003 . 1 . . . . 773 CYS H . 15996 1 973 . 1 1 85 85 CYS HA H 1 4.137 0.002 . 1 . . . . 773 CYS HA . 15996 1 974 . 1 1 85 85 CYS HB2 H 1 2.788 0.001 . 2 . . . . 773 CYS HB2 . 15996 1 975 . 1 1 85 85 CYS HB3 H 1 3.266 0.001 . 2 . . . . 773 CYS HB3 . 15996 1 976 . 1 1 85 85 CYS N N 15 116.829 0.033 . 1 . . . . 773 CYS N . 15996 1 977 . 1 1 86 86 GLY HA2 H 1 3.586 0.007 . 2 . . . . 774 GLY HA2 . 15996 1 978 . 1 1 86 86 GLY HA3 H 1 4.386 0.015 . 2 . . . . 774 GLY HA3 . 15996 1 979 . 1 1 86 86 GLY C C 13 177.873 0.001 . 1 . . . . 774 GLY C . 15996 1 980 . 1 1 86 86 GLY CA C 13 45.101 0.110 . 1 . . . . 774 GLY CA . 15996 1 981 . 1 1 87 87 ALA H H 1 8.389 0.004 . 1 . . . . 775 ALA H . 15996 1 982 . 1 1 87 87 ALA HA H 1 4.600 0.009 . 1 . . . . 775 ALA HA . 15996 1 983 . 1 1 87 87 ALA HB1 H 1 1.302 0.006 . 1 . . . . 775 ALA HB1 . 15996 1 984 . 1 1 87 87 ALA HB2 H 1 1.302 0.006 . 1 . . . . 775 ALA HB2 . 15996 1 985 . 1 1 87 87 ALA HB3 H 1 1.302 0.006 . 1 . . . . 775 ALA HB3 . 15996 1 986 . 1 1 87 87 ALA C C 13 175.509 0.001 . 1 . . . . 775 ALA C . 15996 1 987 . 1 1 87 87 ALA CA C 13 50.678 0.045 . 1 . . . . 775 ALA CA . 15996 1 988 . 1 1 87 87 ALA CB C 13 18.997 0.061 . 1 . . . . 775 ALA CB . 15996 1 989 . 1 1 87 87 ALA N N 15 124.777 0.025 . 1 . . . . 775 ALA N . 15996 1 990 . 1 1 88 88 CYS H H 1 7.899 0.003 . 1 . . . . 776 CYS H . 15996 1 991 . 1 1 88 88 CYS HA H 1 4.612 0.006 . 1 . . . . 776 CYS HA . 15996 1 992 . 1 1 88 88 CYS HB2 H 1 2.588 0.008 . 2 . . . . 776 CYS HB2 . 15996 1 993 . 1 1 88 88 CYS HB3 H 1 2.501 0.009 . 2 . . . . 776 CYS HB3 . 15996 1 994 . 1 1 88 88 CYS C C 13 178.654 0.001 . 1 . . . . 776 CYS C . 15996 1 995 . 1 1 88 88 CYS CA C 13 51.490 0.026 . 1 . . . . 776 CYS CA . 15996 1 996 . 1 1 88 88 CYS CB C 13 34.046 0.069 . 1 . . . . 776 CYS CB . 15996 1 997 . 1 1 88 88 CYS N N 15 116.189 0.033 . 1 . . . . 776 CYS N . 15996 1 998 . 1 1 90 90 LEU HA H 1 3.899 0.008 . 1 . . . . 778 LEU HA . 15996 1 999 . 1 1 90 90 LEU HB2 H 1 1.444 0.007 . 2 . . . . 778 LEU HB2 . 15996 1 1000 . 1 1 90 90 LEU HB3 H 1 1.558 0.023 . 2 . . . . 778 LEU HB3 . 15996 1 1001 . 1 1 90 90 LEU HD11 H 1 0.808 0.019 . 2 . . . . 778 LEU HD11 . 15996 1 1002 . 1 1 90 90 LEU HD12 H 1 0.808 0.019 . 2 . . . . 778 LEU HD12 . 15996 1 1003 . 1 1 90 90 LEU HD13 H 1 0.808 0.019 . 2 . . . . 778 LEU HD13 . 15996 1 1004 . 1 1 90 90 LEU HD21 H 1 0.849 0.007 . 2 . . . . 778 LEU HD21 . 15996 1 1005 . 1 1 90 90 LEU HD22 H 1 0.849 0.007 . 2 . . . . 778 LEU HD22 . 15996 1 1006 . 1 1 90 90 LEU HD23 H 1 0.849 0.007 . 2 . . . . 778 LEU HD23 . 15996 1 1007 . 1 1 90 90 LEU CA C 13 57.973 0.039 . 1 . . . . 778 LEU CA . 15996 1 1008 . 1 1 90 90 LEU CB C 13 42.148 0.055 . 1 . . . . 778 LEU CB . 15996 1 1009 . 1 1 90 90 LEU CD1 C 13 24.802 0.065 . 2 . . . . 778 LEU CD1 . 15996 1 1010 . 1 1 90 90 LEU CD2 C 13 25.266 0.069 . 2 . . . . 778 LEU CD2 . 15996 1 1011 . 1 1 91 91 TRP H H 1 5.862 0.005 . 1 . . . . 779 TRP H . 15996 1 1012 . 1 1 91 91 TRP HD1 H 1 6.922 0.006 . 1 . . . . 779 TRP HD1 . 15996 1 1013 . 1 1 91 91 TRP HE1 H 1 10.760 0.002 . 1 . . . . 779 TRP HE1 . 15996 1 1014 . 1 1 91 91 TRP HE3 H 1 7.432 0.005 . 1 . . . . 779 TRP HE3 . 15996 1 1015 . 1 1 91 91 TRP HH2 H 1 7.228 0.005 . 1 . . . . 779 TRP HH2 . 15996 1 1016 . 1 1 91 91 TRP HZ2 H 1 7.640 0.011 . 1 . . . . 779 TRP HZ2 . 15996 1 1017 . 1 1 91 91 TRP HZ3 H 1 6.871 0.005 . 1 . . . . 779 TRP HZ3 . 15996 1 1018 . 1 1 91 91 TRP C C 13 178.366 0.001 . 1 . . . . 779 TRP C . 15996 1 1019 . 1 1 91 91 TRP CB C 13 27.884 0.001 . 1 . . . . 779 TRP CB . 15996 1 1020 . 1 1 91 91 TRP CD1 C 13 126.966 0.074 . 1 . . . . 779 TRP CD1 . 15996 1 1021 . 1 1 91 91 TRP CE3 C 13 119.615 0.098 . 1 . . . . 779 TRP CE3 . 15996 1 1022 . 1 1 91 91 TRP CH2 C 13 125.081 0.079 . 1 . . . . 779 TRP CH2 . 15996 1 1023 . 1 1 91 91 TRP CZ2 C 13 116.092 0.061 . 1 . . . . 779 TRP CZ2 . 15996 1 1024 . 1 1 91 91 TRP CZ3 C 13 121.779 0.051 . 1 . . . . 779 TRP CZ3 . 15996 1 1025 . 1 1 91 91 TRP N N 15 108.538 0.040 . 1 . . . . 779 TRP N . 15996 1 1026 . 1 1 91 91 TRP NE1 N 15 134.806 0.038 . 1 . . . . 779 TRP NE1 . 15996 1 1027 . 1 1 92 92 GLY H H 1 7.828 0.007 . 1 . . . . 780 GLY H . 15996 1 1028 . 1 1 92 92 GLY HA2 H 1 3.130 0.011 . 2 . . . . 780 GLY HA2 . 15996 1 1029 . 1 1 92 92 GLY HA3 H 1 5.392 0.014 . 2 . . . . 780 GLY HA3 . 15996 1 1030 . 1 1 92 92 GLY C C 13 180.778 0.001 . 1 . . . . 780 GLY C . 15996 1 1031 . 1 1 92 92 GLY CA C 13 43.644 0.073 . 1 . . . . 780 GLY CA . 15996 1 1032 . 1 1 92 92 GLY N N 15 110.812 0.044 . 1 . . . . 780 GLY N . 15996 1 1033 . 1 1 93 93 LYS H H 1 9.237 0.008 . 1 . . . . 781 LYS H . 15996 1 1034 . 1 1 93 93 LYS HA H 1 4.767 0.011 . 1 . . . . 781 LYS HA . 15996 1 1035 . 1 1 93 93 LYS HB2 H 1 1.484 0.012 . 2 . . . . 781 LYS HB2 . 15996 1 1036 . 1 1 93 93 LYS HB3 H 1 1.754 0.011 . 2 . . . . 781 LYS HB3 . 15996 1 1037 . 1 1 93 93 LYS HE2 H 1 2.974 0.001 . 2 . . . . 781 LYS HE2 . 15996 1 1038 . 1 1 93 93 LYS HE3 H 1 2.977 0.015 . 2 . . . . 781 LYS HE3 . 15996 1 1039 . 1 1 93 93 LYS HG2 H 1 1.031 0.011 . 2 . . . . 781 LYS HG2 . 15996 1 1040 . 1 1 93 93 LYS HG3 H 1 0.890 0.018 . 2 . . . . 781 LYS HG3 . 15996 1 1041 . 1 1 93 93 LYS C C 13 177.641 0.001 . 1 . . . . 781 LYS C . 15996 1 1042 . 1 1 93 93 LYS CA C 13 54.000 0.060 . 1 . . . . 781 LYS CA . 15996 1 1043 . 1 1 93 93 LYS CB C 13 35.943 0.093 . 1 . . . . 781 LYS CB . 15996 1 1044 . 1 1 93 93 LYS CE C 13 43.965 0.059 . 1 . . . . 781 LYS CE . 15996 1 1045 . 1 1 93 93 LYS CG C 13 23.629 0.101 . 1 . . . . 781 LYS CG . 15996 1 1046 . 1 1 93 93 LYS N N 15 117.042 0.047 . 1 . . . . 781 LYS N . 15996 1 1047 . 1 1 94 94 CYS H H 1 8.909 0.008 . 1 . . . . 782 CYS H . 15996 1 1048 . 1 1 94 94 CYS HA H 1 4.539 0.004 . 1 . . . . 782 CYS HA . 15996 1 1049 . 1 1 94 94 CYS HB2 H 1 2.864 0.001 . 2 . . . . 782 CYS HB2 . 15996 1 1050 . 1 1 94 94 CYS HB3 H 1 3.417 0.001 . 2 . . . . 782 CYS HB3 . 15996 1 1051 . 1 1 94 94 CYS CA C 13 52.478 0.001 . 1 . . . . 782 CYS CA . 15996 1 1052 . 1 1 94 94 CYS N N 15 120.007 0.040 . 1 . . . . 782 CYS N . 15996 1 1053 . 1 1 100 100 LYS HA H 1 4.789 0.006 . 1 . . . . 788 LYS HA . 15996 1 1054 . 1 1 100 100 LYS HB2 H 1 1.855 0.005 . 2 . . . . 788 LYS HB2 . 15996 1 1055 . 1 1 100 100 LYS HB3 H 1 1.709 0.019 . 2 . . . . 788 LYS HB3 . 15996 1 1056 . 1 1 100 100 LYS HD2 H 1 1.527 0.005 . 2 . . . . 788 LYS HD2 . 15996 1 1057 . 1 1 100 100 LYS HD3 H 1 1.607 0.008 . 2 . . . . 788 LYS HD3 . 15996 1 1058 . 1 1 100 100 LYS HE2 H 1 2.963 0.001 . 2 . . . . 788 LYS HE2 . 15996 1 1059 . 1 1 100 100 LYS HE3 H 1 2.940 0.015 . 2 . . . . 788 LYS HE3 . 15996 1 1060 . 1 1 100 100 LYS HG2 H 1 1.367 0.001 . 2 . . . . 788 LYS HG2 . 15996 1 1061 . 1 1 100 100 LYS HG3 H 1 1.373 0.011 . 2 . . . . 788 LYS HG3 . 15996 1 1062 . 1 1 100 100 LYS C C 13 176.651 0.001 . 1 . . . . 788 LYS C . 15996 1 1063 . 1 1 100 100 LYS CA C 13 54.441 0.048 . 1 . . . . 788 LYS CA . 15996 1 1064 . 1 1 100 100 LYS CB C 13 34.985 0.106 . 1 . . . . 788 LYS CB . 15996 1 1065 . 1 1 100 100 LYS CD C 13 28.850 0.074 . 1 . . . . 788 LYS CD . 15996 1 1066 . 1 1 100 100 LYS CE C 13 42.050 0.096 . 1 . . . . 788 LYS CE . 15996 1 1067 . 1 1 100 100 LYS CG C 13 24.657 0.028 . 1 . . . . 788 LYS CG . 15996 1 1068 . 1 1 101 101 CYS H H 1 8.227 0.004 . 1 . . . . 789 CYS H . 15996 1 1069 . 1 1 101 101 CYS HA H 1 5.118 0.008 . 1 . . . . 789 CYS HA . 15996 1 1070 . 1 1 101 101 CYS HB2 H 1 2.872 0.007 . 2 . . . . 789 CYS HB2 . 15996 1 1071 . 1 1 101 101 CYS HB3 H 1 2.465 0.012 . 2 . . . . 789 CYS HB3 . 15996 1 1072 . 1 1 101 101 CYS C C 13 176.854 0.001 . 1 . . . . 789 CYS C . 15996 1 1073 . 1 1 101 101 CYS CA C 13 55.856 0.079 . 1 . . . . 789 CYS CA . 15996 1 1074 . 1 1 101 101 CYS CB C 13 41.189 0.105 . 1 . . . . 789 CYS CB . 15996 1 1075 . 1 1 101 101 CYS N N 15 117.594 0.032 . 1 . . . . 789 CYS N . 15996 1 1076 . 1 1 102 102 VAL H H 1 9.493 0.004 . 1 . . . . 790 VAL H . 15996 1 1077 . 1 1 102 102 VAL HA H 1 4.790 0.017 . 1 . . . . 790 VAL HA . 15996 1 1078 . 1 1 102 102 VAL HB H 1 2.394 0.006 . 1 . . . . 790 VAL HB . 15996 1 1079 . 1 1 102 102 VAL HG11 H 1 0.945 0.004 . 2 . . . . 790 VAL HG11 . 15996 1 1080 . 1 1 102 102 VAL HG12 H 1 0.945 0.004 . 2 . . . . 790 VAL HG12 . 15996 1 1081 . 1 1 102 102 VAL HG13 H 1 0.945 0.004 . 2 . . . . 790 VAL HG13 . 15996 1 1082 . 1 1 102 102 VAL HG21 H 1 0.745 0.004 . 2 . . . . 790 VAL HG21 . 15996 1 1083 . 1 1 102 102 VAL HG22 H 1 0.745 0.004 . 2 . . . . 790 VAL HG22 . 15996 1 1084 . 1 1 102 102 VAL HG23 H 1 0.745 0.004 . 2 . . . . 790 VAL HG23 . 15996 1 1085 . 1 1 102 102 VAL C C 13 176.077 0.003 . 1 . . . . 790 VAL C . 15996 1 1086 . 1 1 102 102 VAL CA C 13 59.012 0.067 . 1 . . . . 790 VAL CA . 15996 1 1087 . 1 1 102 102 VAL CB C 13 34.826 0.046 . 1 . . . . 790 VAL CB . 15996 1 1088 . 1 1 102 102 VAL CG1 C 13 21.890 0.070 . 2 . . . . 790 VAL CG1 . 15996 1 1089 . 1 1 102 102 VAL CG2 C 13 18.572 0.095 . 2 . . . . 790 VAL CG2 . 15996 1 1090 . 1 1 102 102 VAL N N 15 118.228 0.041 . 1 . . . . 790 VAL N . 15996 1 1091 . 1 1 103 103 CYS H H 1 8.350 0.004 . 1 . . . . 791 CYS H . 15996 1 1092 . 1 1 103 103 CYS HA H 1 4.791 0.008 . 1 . . . . 791 CYS HA . 15996 1 1093 . 1 1 103 103 CYS HB2 H 1 2.672 0.009 . 2 . . . . 791 CYS HB2 . 15996 1 1094 . 1 1 103 103 CYS HB3 H 1 3.373 0.013 . 2 . . . . 791 CYS HB3 . 15996 1 1095 . 1 1 103 103 CYS C C 13 175.398 0.007 . 1 . . . . 791 CYS C . 15996 1 1096 . 1 1 103 103 CYS CA C 13 54.659 0.089 . 1 . . . . 791 CYS CA . 15996 1 1097 . 1 1 103 103 CYS CB C 13 38.065 0.063 . 1 . . . . 791 CYS CB . 15996 1 1098 . 1 1 103 103 CYS N N 15 117.298 0.032 . 1 . . . . 791 CYS N . 15996 1 1099 . 1 1 104 104 ARG H H 1 8.829 0.006 . 1 . . . . 792 ARG H . 15996 1 1100 . 1 1 104 104 ARG HA H 1 4.169 0.015 . 1 . . . . 792 ARG HA . 15996 1 1101 . 1 1 104 104 ARG HB2 H 1 1.633 0.001 . 2 . . . . 792 ARG HB2 . 15996 1 1102 . 1 1 104 104 ARG HB3 H 1 1.616 0.001 . 2 . . . . 792 ARG HB3 . 15996 1 1103 . 1 1 104 104 ARG HG2 H 1 -0.336 0.009 . 2 . . . . 792 ARG HG2 . 15996 1 1104 . 1 1 104 104 ARG HG3 H 1 1.413 0.016 . 2 . . . . 792 ARG HG3 . 15996 1 1105 . 1 1 104 104 ARG C C 13 174.598 0.010 . 1 . . . . 792 ARG C . 15996 1 1106 . 1 1 104 104 ARG CA C 13 57.130 0.078 . 1 . . . . 792 ARG CA . 15996 1 1107 . 1 1 104 104 ARG CB C 13 34.262 0.001 . 1 . . . . 792 ARG CB . 15996 1 1108 . 1 1 104 104 ARG CG C 13 32.262 0.105 . 1 . . . . 792 ARG CG . 15996 1 1109 . 1 1 104 104 ARG N N 15 122.463 0.039 . 1 . . . . 792 ARG N . 15996 1 1110 . 1 1 105 105 GLU H H 1 8.879 0.005 . 1 . . . . 793 GLU H . 15996 1 1111 . 1 1 105 105 GLU HA H 1 4.377 0.011 . 1 . . . . 793 GLU HA . 15996 1 1112 . 1 1 105 105 GLU HB2 H 1 2.182 0.013 . 2 . . . . 793 GLU HB2 . 15996 1 1113 . 1 1 105 105 GLU HB3 H 1 1.610 0.006 . 2 . . . . 793 GLU HB3 . 15996 1 1114 . 1 1 105 105 GLU HG2 H 1 2.220 0.011 . 2 . . . . 793 GLU HG2 . 15996 1 1115 . 1 1 105 105 GLU HG3 H 1 2.323 0.005 . 2 . . . . 793 GLU HG3 . 15996 1 1116 . 1 1 105 105 GLU C C 13 173.777 0.013 . 1 . . . . 793 GLU C . 15996 1 1117 . 1 1 105 105 GLU CA C 13 55.550 0.099 . 1 . . . . 793 GLU CA . 15996 1 1118 . 1 1 105 105 GLU CB C 13 30.137 0.101 . 1 . . . . 793 GLU CB . 15996 1 1119 . 1 1 105 105 GLU CG C 13 35.737 0.063 . 1 . . . . 793 GLU CG . 15996 1 1120 . 1 1 105 105 GLU N N 15 119.985 0.043 . 1 . . . . 793 GLU N . 15996 1 1121 . 1 1 106 106 ALA H H 1 9.049 0.005 . 1 . . . . 794 ALA H . 15996 1 1122 . 1 1 106 106 ALA HA H 1 3.911 0.011 . 1 . . . . 794 ALA HA . 15996 1 1123 . 1 1 106 106 ALA HB1 H 1 1.458 0.004 . 1 . . . . 794 ALA HB1 . 15996 1 1124 . 1 1 106 106 ALA HB2 H 1 1.458 0.004 . 1 . . . . 794 ALA HB2 . 15996 1 1125 . 1 1 106 106 ALA HB3 H 1 1.458 0.004 . 1 . . . . 794 ALA HB3 . 15996 1 1126 . 1 1 106 106 ALA C C 13 172.128 0.005 . 1 . . . . 794 ALA C . 15996 1 1127 . 1 1 106 106 ALA CA C 13 55.734 0.062 . 1 . . . . 794 ALA CA . 15996 1 1128 . 1 1 106 106 ALA CB C 13 17.901 0.093 . 1 . . . . 794 ALA CB . 15996 1 1129 . 1 1 106 106 ALA N N 15 125.195 0.047 . 1 . . . . 794 ALA N . 15996 1 1130 . 1 1 107 107 SER H H 1 8.177 0.005 . 1 . . . . 795 SER H . 15996 1 1131 . 1 1 107 107 SER HA H 1 4.213 0.016 . 1 . . . . 795 SER HA . 15996 1 1132 . 1 1 107 107 SER HB2 H 1 3.840 0.008 . 2 . . . . 795 SER HB2 . 15996 1 1133 . 1 1 107 107 SER HB3 H 1 4.015 0.007 . 2 . . . . 795 SER HB3 . 15996 1 1134 . 1 1 107 107 SER C C 13 176.714 0.001 . 1 . . . . 795 SER C . 15996 1 1135 . 1 1 107 107 SER CA C 13 59.701 0.060 . 1 . . . . 795 SER CA . 15996 1 1136 . 1 1 107 107 SER CB C 13 62.472 0.071 . 1 . . . . 795 SER CB . 15996 1 1137 . 1 1 107 107 SER N N 15 110.055 0.022 . 1 . . . . 795 SER N . 15996 1 1138 . 1 1 108 108 GLU H H 1 7.904 0.004 . 1 . . . . 796 GLU H . 15996 1 1139 . 1 1 108 108 GLU HA H 1 4.474 0.006 . 1 . . . . 796 GLU HA . 15996 1 1140 . 1 1 108 108 GLU HB2 H 1 2.227 0.012 . 2 . . . . 796 GLU HB2 . 15996 1 1141 . 1 1 108 108 GLU HB3 H 1 2.197 0.005 . 2 . . . . 796 GLU HB3 . 15996 1 1142 . 1 1 108 108 GLU HG2 H 1 2.176 0.001 . 2 . . . . 796 GLU HG2 . 15996 1 1143 . 1 1 108 108 GLU HG3 H 1 2.180 0.011 . 2 . . . . 796 GLU HG3 . 15996 1 1144 . 1 1 108 108 GLU C C 13 174.454 0.004 . 1 . . . . 796 GLU C . 15996 1 1145 . 1 1 108 108 GLU CA C 13 55.123 0.066 . 1 . . . . 796 GLU CA . 15996 1 1146 . 1 1 108 108 GLU CB C 13 29.937 0.082 . 1 . . . . 796 GLU CB . 15996 1 1147 . 1 1 108 108 GLU CG C 13 36.958 0.062 . 1 . . . . 796 GLU CG . 15996 1 1148 . 1 1 108 108 GLU N N 15 119.273 0.028 . 1 . . . . 796 GLU N . 15996 1 1149 . 1 1 109 109 CYS H H 1 7.669 0.007 . 1 . . . . 797 CYS H . 15996 1 1150 . 1 1 109 109 CYS HA H 1 4.299 0.029 . 1 . . . . 797 CYS HA . 15996 1 1151 . 1 1 109 109 CYS HB2 H 1 3.216 0.010 . 2 . . . . 797 CYS HB2 . 15996 1 1152 . 1 1 109 109 CYS HB3 H 1 2.787 0.005 . 2 . . . . 797 CYS HB3 . 15996 1 1153 . 1 1 109 109 CYS CA C 13 59.022 0.100 . 1 . . . . 797 CYS CA . 15996 1 1154 . 1 1 109 109 CYS CB C 13 43.080 0.086 . 1 . . . . 797 CYS CB . 15996 1 1155 . 1 1 109 109 CYS N N 15 120.896 0.030 . 1 . . . . 797 CYS N . 15996 1 1156 . 1 1 110 110 GLU H H 1 8.430 0.006 . 1 . . . . 798 GLU H . 15996 1 1157 . 1 1 110 110 GLU HA H 1 4.267 0.003 . 1 . . . . 798 GLU HA . 15996 1 1158 . 1 1 110 110 GLU HB2 H 1 2.068 0.004 . 2 . . . . 798 GLU HB2 . 15996 1 1159 . 1 1 110 110 GLU HB3 H 1 1.894 0.012 . 2 . . . . 798 GLU HB3 . 15996 1 1160 . 1 1 110 110 GLU HG2 H 1 2.200 0.013 . 2 . . . . 798 GLU HG2 . 15996 1 1161 . 1 1 110 110 GLU HG3 H 1 2.275 0.021 . 2 . . . . 798 GLU HG3 . 15996 1 1162 . 1 1 110 110 GLU C C 13 176.168 0.001 . 1 . . . . 798 GLU C . 15996 1 1163 . 1 1 110 110 GLU CA C 13 57.346 0.042 . 1 . . . . 798 GLU CA . 15996 1 1164 . 1 1 110 110 GLU CB C 13 30.412 0.079 . 1 . . . . 798 GLU CB . 15996 1 1165 . 1 1 110 110 GLU CG C 13 36.504 0.038 . 1 . . . . 798 GLU CG . 15996 1 1166 . 1 1 110 110 GLU N N 15 125.331 0.028 . 1 . . . . 798 GLU N . 15996 1 1167 . 1 1 111 111 GLU H H 1 8.037 0.005 . 1 . . . . 799 GLU H . 15996 1 1168 . 1 1 111 111 GLU HA H 1 4.365 0.007 . 1 . . . . 799 GLU HA . 15996 1 1169 . 1 1 111 111 GLU HB2 H 1 1.939 0.003 . 2 . . . . 799 GLU HB2 . 15996 1 1170 . 1 1 111 111 GLU HB3 H 1 1.932 0.001 . 2 . . . . 799 GLU HB3 . 15996 1 1171 . 1 1 111 111 GLU HG2 H 1 2.210 0.001 . 2 . . . . 799 GLU HG2 . 15996 1 1172 . 1 1 111 111 GLU HG3 H 1 2.148 0.008 . 2 . . . . 799 GLU HG3 . 15996 1 1173 . 1 1 111 111 GLU C C 13 176.158 0.001 . 1 . . . . 799 GLU C . 15996 1 1174 . 1 1 111 111 GLU CA C 13 55.785 0.037 . 1 . . . . 799 GLU CA . 15996 1 1175 . 1 1 111 111 GLU CB C 13 29.532 0.105 . 1 . . . . 799 GLU CB . 15996 1 1176 . 1 1 111 111 GLU CG C 13 36.207 0.059 . 1 . . . . 799 GLU CG . 15996 1 1177 . 1 1 111 111 GLU N N 15 121.107 0.014 . 1 . . . . 799 GLU N . 15996 1 1178 . 1 1 112 112 GLU H H 1 8.494 0.005 . 1 . . . . 800 GLU H . 15996 1 1179 . 1 1 112 112 GLU HA H 1 4.144 0.011 . 1 . . . . 800 GLU HA . 15996 1 1180 . 1 1 112 112 GLU HB2 H 1 1.970 0.005 . 2 . . . . 800 GLU HB2 . 15996 1 1181 . 1 1 112 112 GLU HB3 H 1 2.089 0.005 . 2 . . . . 800 GLU HB3 . 15996 1 1182 . 1 1 112 112 GLU HG2 H 1 2.474 0.005 . 2 . . . . 800 GLU HG2 . 15996 1 1183 . 1 1 112 112 GLU HG3 H 1 2.347 0.013 . 2 . . . . 800 GLU HG3 . 15996 1 1184 . 1 1 112 112 GLU C C 13 174.371 0.028 . 1 . . . . 800 GLU C . 15996 1 1185 . 1 1 112 112 GLU CA C 13 58.456 0.099 . 1 . . . . 800 GLU CA . 15996 1 1186 . 1 1 112 112 GLU CB C 13 30.664 0.056 . 1 . . . . 800 GLU CB . 15996 1 1187 . 1 1 112 112 GLU CG C 13 35.250 0.067 . 1 . . . . 800 GLU CG . 15996 1 1188 . 1 1 112 112 GLU N N 15 123.682 0.022 . 1 . . . . 800 GLU N . 15996 1 1189 . 1 1 113 113 GLY H H 1 8.174 0.006 . 1 . . . . 801 GLY H . 15996 1 1190 . 1 1 113 113 GLY HA2 H 1 3.517 0.012 . 2 . . . . 801 GLY HA2 . 15996 1 1191 . 1 1 113 113 GLY HA3 H 1 4.379 0.010 . 2 . . . . 801 GLY HA3 . 15996 1 1192 . 1 1 113 113 GLY C C 13 177.819 0.001 . 1 . . . . 801 GLY C . 15996 1 1193 . 1 1 113 113 GLY CA C 13 44.186 0.087 . 1 . . . . 801 GLY CA . 15996 1 1194 . 1 1 113 113 GLY N N 15 104.813 0.033 . 1 . . . . 801 GLY N . 15996 1 1195 . 1 1 114 114 PHE H H 1 10.104 0.008 . 1 . . . . 802 PHE H . 15996 1 1196 . 1 1 114 114 PHE HA H 1 4.167 0.006 . 1 . . . . 802 PHE HA . 15996 1 1197 . 1 1 114 114 PHE HB2 H 1 3.069 0.010 . 2 . . . . 802 PHE HB2 . 15996 1 1198 . 1 1 114 114 PHE HB3 H 1 2.711 0.006 . 2 . . . . 802 PHE HB3 . 15996 1 1199 . 1 1 114 114 PHE HD1 H 1 7.149 0.005 . 3 . . . . 802 PHE HD1 . 15996 1 1200 . 1 1 114 114 PHE HD2 H 1 7.149 0.005 . 3 . . . . 802 PHE HD2 . 15996 1 1201 . 1 1 114 114 PHE HE1 H 1 7.640 0.005 . 3 . . . . 802 PHE HE1 . 15996 1 1202 . 1 1 114 114 PHE HE2 H 1 7.640 0.005 . 3 . . . . 802 PHE HE2 . 15996 1 1203 . 1 1 114 114 PHE C C 13 176.472 0.001 . 1 . . . . 802 PHE C . 15996 1 1204 . 1 1 114 114 PHE CA C 13 60.066 0.088 . 1 . . . . 802 PHE CA . 15996 1 1205 . 1 1 114 114 PHE CB C 13 39.557 0.094 . 1 . . . . 802 PHE CB . 15996 1 1206 . 1 1 114 114 PHE CD1 C 13 130.763 0.027 . 3 . . . . 802 PHE CD1 . 15996 1 1207 . 1 1 114 114 PHE CD2 C 13 130.763 0.027 . 3 . . . . 802 PHE CD2 . 15996 1 1208 . 1 1 114 114 PHE CE1 C 13 132.698 0.035 . 3 . . . . 802 PHE CE1 . 15996 1 1209 . 1 1 114 114 PHE CE2 C 13 132.698 0.035 . 3 . . . . 802 PHE CE2 . 15996 1 1210 . 1 1 114 114 PHE N N 15 120.160 0.047 . 1 . . . . 802 PHE N . 15996 1 1211 . 1 1 115 115 SER H H 1 8.518 0.006 . 1 . . . . 803 SER H . 15996 1 1212 . 1 1 115 115 SER HA H 1 4.716 0.012 . 1 . . . . 803 SER HA . 15996 1 1213 . 1 1 115 115 SER HB2 H 1 3.624 0.006 . 2 . . . . 803 SER HB2 . 15996 1 1214 . 1 1 115 115 SER HB3 H 1 3.774 0.015 . 2 . . . . 803 SER HB3 . 15996 1 1215 . 1 1 115 115 SER C C 13 178.762 0.001 . 1 . . . . 803 SER C . 15996 1 1216 . 1 1 115 115 SER CA C 13 58.732 0.088 . 1 . . . . 803 SER CA . 15996 1 1217 . 1 1 115 115 SER CB C 13 63.308 0.074 . 1 . . . . 803 SER CB . 15996 1 1218 . 1 1 115 115 SER N N 15 116.412 0.035 . 1 . . . . 803 SER N . 15996 1 1219 . 1 1 116 116 ILE H H 1 8.907 0.008 . 1 . . . . 804 ILE H . 15996 1 1220 . 1 1 116 116 ILE HA H 1 4.246 0.011 . 1 . . . . 804 ILE HA . 15996 1 1221 . 1 1 116 116 ILE HB H 1 2.247 0.010 . 1 . . . . 804 ILE HB . 15996 1 1222 . 1 1 116 116 ILE HD11 H 1 0.606 0.011 . 1 . . . . 804 ILE HD11 . 15996 1 1223 . 1 1 116 116 ILE HD12 H 1 0.606 0.011 . 1 . . . . 804 ILE HD12 . 15996 1 1224 . 1 1 116 116 ILE HD13 H 1 0.606 0.011 . 1 . . . . 804 ILE HD13 . 15996 1 1225 . 1 1 116 116 ILE HG12 H 1 1.166 0.011 . 2 . . . . 804 ILE HG12 . 15996 1 1226 . 1 1 116 116 ILE HG13 H 1 1.181 0.009 . 2 . . . . 804 ILE HG13 . 15996 1 1227 . 1 1 116 116 ILE HG21 H 1 0.777 0.006 . 1 . . . . 804 ILE HG21 . 15996 1 1228 . 1 1 116 116 ILE HG22 H 1 0.777 0.006 . 1 . . . . 804 ILE HG22 . 15996 1 1229 . 1 1 116 116 ILE HG23 H 1 0.777 0.006 . 1 . . . . 804 ILE HG23 . 15996 1 1230 . 1 1 116 116 ILE C C 13 179.741 0.001 . 1 . . . . 804 ILE C . 15996 1 1231 . 1 1 116 116 ILE CA C 13 59.779 0.056 . 1 . . . . 804 ILE CA . 15996 1 1232 . 1 1 116 116 ILE CB C 13 41.123 0.120 . 1 . . . . 804 ILE CB . 15996 1 1233 . 1 1 116 116 ILE CD1 C 13 15.487 0.020 . 1 . . . . 804 ILE CD1 . 15996 1 1234 . 1 1 116 116 ILE CG1 C 13 25.131 0.079 . 1 . . . . 804 ILE CG1 . 15996 1 1235 . 1 1 116 116 ILE CG2 C 13 18.911 0.051 . 1 . . . . 804 ILE CG2 . 15996 1 1236 . 1 1 116 116 ILE N N 15 119.068 0.042 . 1 . . . . 804 ILE N . 15996 1 1237 . 1 1 117 117 CYS H H 1 7.737 0.005 . 1 . . . . 805 CYS H . 15996 1 1238 . 1 1 117 117 CYS HA H 1 5.219 0.011 . 1 . . . . 805 CYS HA . 15996 1 1239 . 1 1 117 117 CYS HB2 H 1 2.876 0.007 . 2 . . . . 805 CYS HB2 . 15996 1 1240 . 1 1 117 117 CYS HB3 H 1 2.904 0.006 . 2 . . . . 805 CYS HB3 . 15996 1 1241 . 1 1 117 117 CYS C C 13 178.104 0.025 . 1 . . . . 805 CYS C . 15996 1 1242 . 1 1 117 117 CYS CA C 13 55.131 0.087 . 1 . . . . 805 CYS CA . 15996 1 1243 . 1 1 117 117 CYS CB C 13 41.531 0.107 . 1 . . . . 805 CYS CB . 15996 1 1244 . 1 1 117 117 CYS N N 15 120.412 0.051 . 1 . . . . 805 CYS N . 15996 1 1245 . 1 1 118 118 VAL H H 1 8.814 0.005 . 1 . . . . 806 VAL H . 15996 1 1246 . 1 1 118 118 VAL HA H 1 4.990 0.013 . 1 . . . . 806 VAL HA . 15996 1 1247 . 1 1 118 118 VAL HB H 1 1.906 0.004 . 1 . . . . 806 VAL HB . 15996 1 1248 . 1 1 118 118 VAL HG11 H 1 0.784 0.004 . 2 . . . . 806 VAL HG11 . 15996 1 1249 . 1 1 118 118 VAL HG12 H 1 0.784 0.004 . 2 . . . . 806 VAL HG12 . 15996 1 1250 . 1 1 118 118 VAL HG13 H 1 0.784 0.004 . 2 . . . . 806 VAL HG13 . 15996 1 1251 . 1 1 118 118 VAL HG21 H 1 0.858 0.012 . 2 . . . . 806 VAL HG21 . 15996 1 1252 . 1 1 118 118 VAL HG22 H 1 0.858 0.012 . 2 . . . . 806 VAL HG22 . 15996 1 1253 . 1 1 118 118 VAL HG23 H 1 0.858 0.012 . 2 . . . . 806 VAL HG23 . 15996 1 1254 . 1 1 118 118 VAL C C 13 178.018 0.010 . 1 . . . . 806 VAL C . 15996 1 1255 . 1 1 118 118 VAL CA C 13 59.495 0.029 . 1 . . . . 806 VAL CA . 15996 1 1256 . 1 1 118 118 VAL CB C 13 36.047 0.057 . 1 . . . . 806 VAL CB . 15996 1 1257 . 1 1 118 118 VAL CG1 C 13 22.447 0.063 . 2 . . . . 806 VAL CG1 . 15996 1 1258 . 1 1 118 118 VAL CG2 C 13 21.515 0.073 . 2 . . . . 806 VAL CG2 . 15996 1 1259 . 1 1 118 118 VAL N N 15 126.373 0.023 . 1 . . . . 806 VAL N . 15996 1 1260 . 1 1 119 119 GLU H H 1 9.276 0.005 . 1 . . . . 807 GLU H . 15996 1 1261 . 1 1 119 119 GLU HA H 1 4.800 0.004 . 1 . . . . 807 GLU HA . 15996 1 1262 . 1 1 119 119 GLU HB2 H 1 1.747 0.012 . 2 . . . . 807 GLU HB2 . 15996 1 1263 . 1 1 119 119 GLU HB3 H 1 1.937 0.009 . 2 . . . . 807 GLU HB3 . 15996 1 1264 . 1 1 119 119 GLU HG2 H 1 2.033 0.006 . 2 . . . . 807 GLU HG2 . 15996 1 1265 . 1 1 119 119 GLU HG3 H 1 1.704 0.011 . 2 . . . . 807 GLU HG3 . 15996 1 1266 . 1 1 119 119 GLU C C 13 176.652 0.003 . 1 . . . . 807 GLU C . 15996 1 1267 . 1 1 119 119 GLU CA C 13 55.127 0.102 . 1 . . . . 807 GLU CA . 15996 1 1268 . 1 1 119 119 GLU CB C 13 31.260 0.102 . 1 . . . . 807 GLU CB . 15996 1 1269 . 1 1 119 119 GLU CG C 13 36.227 0.069 . 1 . . . . 807 GLU CG . 15996 1 1270 . 1 1 119 119 GLU N N 15 125.194 0.034 . 1 . . . . 807 GLU N . 15996 1 1271 . 1 1 120 120 VAL H H 1 8.542 0.005 . 1 . . . . 808 VAL H . 15996 1 1272 . 1 1 120 120 VAL HA H 1 4.320 0.007 . 1 . . . . 808 VAL HA . 15996 1 1273 . 1 1 120 120 VAL HB H 1 1.956 0.005 . 1 . . . . 808 VAL HB . 15996 1 1274 . 1 1 120 120 VAL HG11 H 1 0.848 0.008 . 2 . . . . 808 VAL HG11 . 15996 1 1275 . 1 1 120 120 VAL HG12 H 1 0.848 0.008 . 2 . . . . 808 VAL HG12 . 15996 1 1276 . 1 1 120 120 VAL HG13 H 1 0.848 0.008 . 2 . . . . 808 VAL HG13 . 15996 1 1277 . 1 1 120 120 VAL HG21 H 1 0.831 0.009 . 2 . . . . 808 VAL HG21 . 15996 1 1278 . 1 1 120 120 VAL HG22 H 1 0.831 0.009 . 2 . . . . 808 VAL HG22 . 15996 1 1279 . 1 1 120 120 VAL HG23 H 1 0.831 0.009 . 2 . . . . 808 VAL HG23 . 15996 1 1280 . 1 1 120 120 VAL C C 13 176.416 0.005 . 1 . . . . 808 VAL C . 15996 1 1281 . 1 1 120 120 VAL CA C 13 60.983 0.048 . 1 . . . . 808 VAL CA . 15996 1 1282 . 1 1 120 120 VAL CB C 13 33.757 0.088 . 1 . . . . 808 VAL CB . 15996 1 1283 . 1 1 120 120 VAL CG1 C 13 20.255 0.064 . 2 . . . . 808 VAL CG1 . 15996 1 1284 . 1 1 120 120 VAL CG2 C 13 21.361 0.013 . 2 . . . . 808 VAL CG2 . 15996 1 1285 . 1 1 120 120 VAL N N 15 126.284 0.033 . 1 . . . . 808 VAL N . 15996 1 1286 . 1 1 121 121 ASN H H 1 9.609 0.004 . 1 . . . . 809 ASN H . 15996 1 1287 . 1 1 121 121 ASN HA H 1 4.338 0.005 . 1 . . . . 809 ASN HA . 15996 1 1288 . 1 1 121 121 ASN HB2 H 1 2.773 0.005 . 2 . . . . 809 ASN HB2 . 15996 1 1289 . 1 1 121 121 ASN HB3 H 1 3.039 0.006 . 2 . . . . 809 ASN HB3 . 15996 1 1290 . 1 1 121 121 ASN HD21 H 1 6.934 0.001 . 1 . . . . 809 ASN HD21 . 15996 1 1291 . 1 1 121 121 ASN HD22 H 1 7.671 0.004 . 1 . . . . 809 ASN HD22 . 15996 1 1292 . 1 1 121 121 ASN C C 13 176.567 0.001 . 1 . . . . 809 ASN C . 15996 1 1293 . 1 1 121 121 ASN CA C 13 54.385 0.072 . 1 . . . . 809 ASN CA . 15996 1 1294 . 1 1 121 121 ASN CB C 13 37.508 0.108 . 1 . . . . 809 ASN CB . 15996 1 1295 . 1 1 121 121 ASN N N 15 126.566 0.033 . 1 . . . . 809 ASN N . 15996 1 1296 . 1 1 121 121 ASN ND2 N 15 113.557 0.025 . 1 . . . . 809 ASN ND2 . 15996 1 1297 . 1 1 122 122 GLY H H 1 8.971 0.007 . 1 . . . . 810 GLY H . 15996 1 1298 . 1 1 122 122 GLY HA2 H 1 3.557 0.029 . 2 . . . . 810 GLY HA2 . 15996 1 1299 . 1 1 122 122 GLY HA3 H 1 4.096 0.015 . 2 . . . . 810 GLY HA3 . 15996 1 1300 . 1 1 122 122 GLY C C 13 178.376 0.009 . 1 . . . . 810 GLY C . 15996 1 1301 . 1 1 122 122 GLY CA C 13 45.485 0.016 . 1 . . . . 810 GLY CA . 15996 1 1302 . 1 1 122 122 GLY N N 15 103.498 0.035 . 1 . . . . 810 GLY N . 15996 1 1303 . 1 1 123 123 LYS H H 1 7.673 0.004 . 1 . . . . 811 LYS H . 15996 1 1304 . 1 1 123 123 LYS HA H 1 4.686 0.002 . 1 . . . . 811 LYS HA . 15996 1 1305 . 1 1 123 123 LYS HB2 H 1 1.831 0.008 . 2 . . . . 811 LYS HB2 . 15996 1 1306 . 1 1 123 123 LYS HB3 H 1 1.716 0.003 . 2 . . . . 811 LYS HB3 . 15996 1 1307 . 1 1 123 123 LYS HD2 H 1 1.676 0.007 . 2 . . . . 811 LYS HD2 . 15996 1 1308 . 1 1 123 123 LYS HD3 H 1 1.821 0.006 . 2 . . . . 811 LYS HD3 . 15996 1 1309 . 1 1 123 123 LYS HE2 H 1 2.975 0.001 . 2 . . . . 811 LYS HE2 . 15996 1 1310 . 1 1 123 123 LYS HE3 H 1 2.985 0.009 . 2 . . . . 811 LYS HE3 . 15996 1 1311 . 1 1 123 123 LYS HG2 H 1 1.385 0.010 . 2 . . . . 811 LYS HG2 . 15996 1 1312 . 1 1 123 123 LYS HG3 H 1 1.334 0.008 . 2 . . . . 811 LYS HG3 . 15996 1 1313 . 1 1 123 123 LYS C C 13 176.606 0.005 . 1 . . . . 811 LYS C . 15996 1 1314 . 1 1 123 123 LYS CA C 13 54.606 0.067 . 1 . . . . 811 LYS CA . 15996 1 1315 . 1 1 123 123 LYS CB C 13 35.021 0.093 . 1 . . . . 811 LYS CB . 15996 1 1316 . 1 1 123 123 LYS CD C 13 28.968 0.057 . 1 . . . . 811 LYS CD . 15996 1 1317 . 1 1 123 123 LYS CE C 13 42.235 0.062 . 1 . . . . 811 LYS CE . 15996 1 1318 . 1 1 123 123 LYS CG C 13 24.548 0.096 . 1 . . . . 811 LYS CG . 15996 1 1319 . 1 1 123 123 LYS N N 15 120.928 0.026 . 1 . . . . 811 LYS N . 15996 1 1320 . 1 1 124 124 GLU H H 1 8.746 0.007 . 1 . . . . 812 GLU H . 15996 1 1321 . 1 1 124 124 GLU HA H 1 5.039 0.017 . 1 . . . . 812 GLU HA . 15996 1 1322 . 1 1 124 124 GLU HB2 H 1 1.943 0.006 . 2 . . . . 812 GLU HB2 . 15996 1 1323 . 1 1 124 124 GLU HB3 H 1 1.844 0.006 . 2 . . . . 812 GLU HB3 . 15996 1 1324 . 1 1 124 124 GLU HG2 H 1 2.035 0.005 . 2 . . . . 812 GLU HG2 . 15996 1 1325 . 1 1 124 124 GLU HG3 H 1 2.223 0.004 . 2 . . . . 812 GLU HG3 . 15996 1 1326 . 1 1 124 124 GLU C C 13 175.696 0.005 . 1 . . . . 812 GLU C . 15996 1 1327 . 1 1 124 124 GLU CA C 13 55.934 0.057 . 1 . . . . 812 GLU CA . 15996 1 1328 . 1 1 124 124 GLU CB C 13 31.010 0.089 . 1 . . . . 812 GLU CB . 15996 1 1329 . 1 1 124 124 GLU CG C 13 37.902 0.084 . 1 . . . . 812 GLU CG . 15996 1 1330 . 1 1 124 124 GLU N N 15 125.732 0.060 . 1 . . . . 812 GLU N . 15996 1 1331 . 1 1 125 125 GLN H H 1 9.268 0.009 . 1 . . . . 813 GLN H . 15996 1 1332 . 1 1 125 125 GLN HA H 1 4.635 0.003 . 1 . . . . 813 GLN HA . 15996 1 1333 . 1 1 125 125 GLN HB2 H 1 2.070 0.010 . 2 . . . . 813 GLN HB2 . 15996 1 1334 . 1 1 125 125 GLN HB3 H 1 1.971 0.014 . 2 . . . . 813 GLN HB3 . 15996 1 1335 . 1 1 125 125 GLN HE21 H 1 6.862 0.003 . 1 . . . . 813 GLN HE21 . 15996 1 1336 . 1 1 125 125 GLN HE22 H 1 7.267 0.002 . 1 . . . . 813 GLN HE22 . 15996 1 1337 . 1 1 125 125 GLN HG2 H 1 2.292 0.015 . 2 . . . . 813 GLN HG2 . 15996 1 1338 . 1 1 125 125 GLN HG3 H 1 2.072 0.005 . 2 . . . . 813 GLN HG3 . 15996 1 1339 . 1 1 125 125 GLN C C 13 177.635 0.010 . 1 . . . . 813 GLN C . 15996 1 1340 . 1 1 125 125 GLN CA C 13 54.781 0.052 . 1 . . . . 813 GLN CA . 15996 1 1341 . 1 1 125 125 GLN CB C 13 33.185 0.101 . 1 . . . . 813 GLN CB . 15996 1 1342 . 1 1 125 125 GLN CG C 13 33.530 0.103 . 1 . . . . 813 GLN CG . 15996 1 1343 . 1 1 125 125 GLN N N 15 122.595 0.033 . 1 . . . . 813 GLN N . 15996 1 1344 . 1 1 125 125 GLN NE2 N 15 111.393 0.030 . 1 . . . . 813 GLN NE2 . 15996 1 1345 . 1 1 126 126 THR H H 1 8.775 0.008 . 1 . . . . 814 THR H . 15996 1 1346 . 1 1 126 126 THR HA H 1 5.291 0.010 . 1 . . . . 814 THR HA . 15996 1 1347 . 1 1 126 126 THR HB H 1 4.029 0.008 . 1 . . . . 814 THR HB . 15996 1 1348 . 1 1 126 126 THR HG21 H 1 1.207 0.003 . 1 . . . . 814 THR HG21 . 15996 1 1349 . 1 1 126 126 THR HG22 H 1 1.207 0.003 . 1 . . . . 814 THR HG22 . 15996 1 1350 . 1 1 126 126 THR HG23 H 1 1.207 0.003 . 1 . . . . 814 THR HG23 . 15996 1 1351 . 1 1 126 126 THR C C 13 176.791 0.006 . 1 . . . . 814 THR C . 15996 1 1352 . 1 1 126 126 THR CA C 13 62.757 0.066 . 1 . . . . 814 THR CA . 15996 1 1353 . 1 1 126 126 THR CB C 13 69.067 0.092 . 1 . . . . 814 THR CB . 15996 1 1354 . 1 1 126 126 THR CG2 C 13 22.869 0.052 . 1 . . . . 814 THR CG2 . 15996 1 1355 . 1 1 126 126 THR N N 15 123.755 0.035 . 1 . . . . 814 THR N . 15996 1 1356 . 1 1 127 127 MET H H 1 9.171 0.019 . 1 . . . . 815 MET H . 15996 1 1357 . 1 1 127 127 MET HA H 1 4.814 0.009 . 1 . . . . 815 MET HA . 15996 1 1358 . 1 1 127 127 MET HB2 H 1 1.871 0.009 . 2 . . . . 815 MET HB2 . 15996 1 1359 . 1 1 127 127 MET HB3 H 1 2.233 0.006 . 2 . . . . 815 MET HB3 . 15996 1 1360 . 1 1 127 127 MET HE1 H 1 1.827 0.013 . 1 . . . . 815 MET HE1 . 15996 1 1361 . 1 1 127 127 MET HE2 H 1 1.827 0.013 . 1 . . . . 815 MET HE2 . 15996 1 1362 . 1 1 127 127 MET HE3 H 1 1.827 0.013 . 1 . . . . 815 MET HE3 . 15996 1 1363 . 1 1 127 127 MET HG2 H 1 2.469 0.006 . 2 . . . . 815 MET HG2 . 15996 1 1364 . 1 1 127 127 MET HG3 H 1 2.385 0.010 . 2 . . . . 815 MET HG3 . 15996 1 1365 . 1 1 127 127 MET C C 13 178.502 0.004 . 1 . . . . 815 MET C . 15996 1 1366 . 1 1 127 127 MET CA C 13 54.887 0.058 . 1 . . . . 815 MET CA . 15996 1 1367 . 1 1 127 127 MET CB C 13 37.312 0.092 . 1 . . . . 815 MET CB . 15996 1 1368 . 1 1 127 127 MET CE C 13 16.956 0.044 . 1 . . . . 815 MET CE . 15996 1 1369 . 1 1 127 127 MET CG C 13 31.500 0.048 . 1 . . . . 815 MET CG . 15996 1 1370 . 1 1 127 127 MET N N 15 126.165 0.046 . 1 . . . . 815 MET N . 15996 1 1371 . 1 1 128 128 SER H H 1 8.852 0.004 . 1 . . . . 816 SER H . 15996 1 1372 . 1 1 128 128 SER HA H 1 5.049 0.010 . 1 . . . . 816 SER HA . 15996 1 1373 . 1 1 128 128 SER HB2 H 1 3.980 0.008 . 2 . . . . 816 SER HB2 . 15996 1 1374 . 1 1 128 128 SER HB3 H 1 4.636 0.007 . 2 . . . . 816 SER HB3 . 15996 1 1375 . 1 1 128 128 SER C C 13 176.138 0.017 . 1 . . . . 816 SER C . 15996 1 1376 . 1 1 128 128 SER CA C 13 57.461 0.110 . 1 . . . . 816 SER CA . 15996 1 1377 . 1 1 128 128 SER CB C 13 65.593 0.098 . 1 . . . . 816 SER CB . 15996 1 1378 . 1 1 128 128 SER N N 15 115.644 0.035 . 1 . . . . 816 SER N . 15996 1 1379 . 1 1 129 129 GLU H H 1 8.651 0.009 . 1 . . . . 817 GLU H . 15996 1 1380 . 1 1 129 129 GLU HA H 1 3.992 0.003 . 1 . . . . 817 GLU HA . 15996 1 1381 . 1 1 129 129 GLU HB2 H 1 2.705 0.009 . 2 . . . . 817 GLU HB2 . 15996 1 1382 . 1 1 129 129 GLU HB3 H 1 2.265 0.013 . 2 . . . . 817 GLU HB3 . 15996 1 1383 . 1 1 129 129 GLU HG2 H 1 3.071 0.008 . 2 . . . . 817 GLU HG2 . 15996 1 1384 . 1 1 129 129 GLU HG3 H 1 2.268 0.013 . 2 . . . . 817 GLU HG3 . 15996 1 1385 . 1 1 129 129 GLU C C 13 173.164 0.044 . 1 . . . . 817 GLU C . 15996 1 1386 . 1 1 129 129 GLU CA C 13 60.868 0.052 . 1 . . . . 817 GLU CA . 15996 1 1387 . 1 1 129 129 GLU CB C 13 33.334 0.070 . 1 . . . . 817 GLU CB . 15996 1 1388 . 1 1 129 129 GLU CG C 13 39.789 0.076 . 1 . . . . 817 GLU CG . 15996 1 1389 . 1 1 129 129 GLU N N 15 120.113 0.051 . 1 . . . . 817 GLU N . 15996 1 1390 . 1 1 130 130 CYS H H 1 8.592 0.006 . 1 . . . . 818 CYS H . 15996 1 1391 . 1 1 130 130 CYS HA H 1 4.147 0.010 . 1 . . . . 818 CYS HA . 15996 1 1392 . 1 1 130 130 CYS HB2 H 1 3.060 0.003 . 2 . . . . 818 CYS HB2 . 15996 1 1393 . 1 1 130 130 CYS HB3 H 1 3.673 0.012 . 2 . . . . 818 CYS HB3 . 15996 1 1394 . 1 1 130 130 CYS C C 13 177.415 0.001 . 1 . . . . 818 CYS C . 15996 1 1395 . 1 1 130 130 CYS CA C 13 61.756 0.080 . 1 . . . . 818 CYS CA . 15996 1 1396 . 1 1 130 130 CYS CB C 13 42.956 0.095 . 1 . . . . 818 CYS CB . 15996 1 1397 . 1 1 130 130 CYS N N 15 116.974 0.036 . 1 . . . . 818 CYS N . 15996 1 1398 . 1 1 131 131 GLU H H 1 8.290 0.004 . 1 . . . . 819 GLU H . 15996 1 1399 . 1 1 131 131 GLU HA H 1 3.777 0.007 . 1 . . . . 819 GLU HA . 15996 1 1400 . 1 1 131 131 GLU HB2 H 1 2.233 0.024 . 2 . . . . 819 GLU HB2 . 15996 1 1401 . 1 1 131 131 GLU HB3 H 1 2.097 0.009 . 2 . . . . 819 GLU HB3 . 15996 1 1402 . 1 1 131 131 GLU HG2 H 1 2.384 0.001 . 2 . . . . 819 GLU HG2 . 15996 1 1403 . 1 1 131 131 GLU HG3 H 1 2.398 0.009 . 2 . . . . 819 GLU HG3 . 15996 1 1404 . 1 1 131 131 GLU C C 13 173.282 0.001 . 1 . . . . 819 GLU C . 15996 1 1405 . 1 1 131 131 GLU CA C 13 59.854 0.078 . 1 . . . . 819 GLU CA . 15996 1 1406 . 1 1 131 131 GLU CB C 13 29.563 0.081 . 1 . . . . 819 GLU CB . 15996 1 1407 . 1 1 131 131 GLU CG C 13 36.898 0.112 . 1 . . . . 819 GLU CG . 15996 1 1408 . 1 1 131 131 GLU N N 15 121.488 0.052 . 1 . . . . 819 GLU N . 15996 1 1409 . 1 1 132 132 ALA H H 1 8.714 0.011 . 1 . . . . 820 ALA H . 15996 1 1410 . 1 1 132 132 ALA HA H 1 3.994 0.009 . 1 . . . . 820 ALA HA . 15996 1 1411 . 1 1 132 132 ALA HB1 H 1 1.276 0.003 . 1 . . . . 820 ALA HB1 . 15996 1 1412 . 1 1 132 132 ALA HB2 H 1 1.276 0.003 . 1 . . . . 820 ALA HB2 . 15996 1 1413 . 1 1 132 132 ALA HB3 H 1 1.276 0.003 . 1 . . . . 820 ALA HB3 . 15996 1 1414 . 1 1 132 132 ALA C C 13 172.567 0.010 . 1 . . . . 820 ALA C . 15996 1 1415 . 1 1 132 132 ALA CA C 13 55.073 0.110 . 1 . . . . 820 ALA CA . 15996 1 1416 . 1 1 132 132 ALA CB C 13 19.535 0.072 . 1 . . . . 820 ALA CB . 15996 1 1417 . 1 1 132 132 ALA N N 15 120.818 0.047 . 1 . . . . 820 ALA N . 15996 1 1418 . 1 1 133 133 GLY H H 1 8.750 0.009 . 1 . . . . 821 GLY H . 15996 1 1419 . 1 1 133 133 GLY HA2 H 1 3.017 0.013 . 2 . . . . 821 GLY HA2 . 15996 1 1420 . 1 1 133 133 GLY HA3 H 1 2.829 0.008 . 2 . . . . 821 GLY HA3 . 15996 1 1421 . 1 1 133 133 GLY C C 13 175.740 0.001 . 1 . . . . 821 GLY C . 15996 1 1422 . 1 1 133 133 GLY CA C 13 46.362 0.047 . 1 . . . . 821 GLY CA . 15996 1 1423 . 1 1 133 133 GLY N N 15 105.247 0.041 . 1 . . . . 821 GLY N . 15996 1 1424 . 1 1 134 134 ALA H H 1 8.788 0.012 . 1 . . . . 822 ALA H . 15996 1 1425 . 1 1 134 134 ALA HA H 1 4.147 0.009 . 1 . . . . 822 ALA HA . 15996 1 1426 . 1 1 134 134 ALA HB1 H 1 1.610 0.003 . 1 . . . . 822 ALA HB1 . 15996 1 1427 . 1 1 134 134 ALA HB2 H 1 1.610 0.003 . 1 . . . . 822 ALA HB2 . 15996 1 1428 . 1 1 134 134 ALA HB3 H 1 1.610 0.003 . 1 . . . . 822 ALA HB3 . 15996 1 1429 . 1 1 134 134 ALA C C 13 172.141 0.008 . 1 . . . . 822 ALA C . 15996 1 1430 . 1 1 134 134 ALA CA C 13 56.205 0.102 . 1 . . . . 822 ALA CA . 15996 1 1431 . 1 1 134 134 ALA CB C 13 17.346 0.067 . 1 . . . . 822 ALA CB . 15996 1 1432 . 1 1 134 134 ALA N N 15 127.541 0.029 . 1 . . . . 822 ALA N . 15996 1 1433 . 1 1 135 135 LEU H H 1 7.768 0.006 . 1 . . . . 823 LEU H . 15996 1 1434 . 1 1 135 135 LEU HA H 1 3.973 0.007 . 1 . . . . 823 LEU HA . 15996 1 1435 . 1 1 135 135 LEU HB2 H 1 1.178 0.008 . 2 . . . . 823 LEU HB2 . 15996 1 1436 . 1 1 135 135 LEU HB3 H 1 1.956 0.013 . 2 . . . . 823 LEU HB3 . 15996 1 1437 . 1 1 135 135 LEU HD11 H 1 0.824 0.007 . 2 . . . . 823 LEU HD11 . 15996 1 1438 . 1 1 135 135 LEU HD12 H 1 0.824 0.007 . 2 . . . . 823 LEU HD12 . 15996 1 1439 . 1 1 135 135 LEU HD13 H 1 0.824 0.007 . 2 . . . . 823 LEU HD13 . 15996 1 1440 . 1 1 135 135 LEU HD21 H 1 0.816 0.022 . 2 . . . . 823 LEU HD21 . 15996 1 1441 . 1 1 135 135 LEU HD22 H 1 0.816 0.022 . 2 . . . . 823 LEU HD22 . 15996 1 1442 . 1 1 135 135 LEU HD23 H 1 0.816 0.022 . 2 . . . . 823 LEU HD23 . 15996 1 1443 . 1 1 135 135 LEU CA C 13 58.123 0.053 . 1 . . . . 823 LEU CA . 15996 1 1444 . 1 1 135 135 LEU CB C 13 41.594 0.052 . 1 . . . . 823 LEU CB . 15996 1 1445 . 1 1 135 135 LEU CD1 C 13 25.673 0.039 . 2 . . . . 823 LEU CD1 . 15996 1 1446 . 1 1 135 135 LEU CD2 C 13 22.834 0.037 . 2 . . . . 823 LEU CD2 . 15996 1 1447 . 1 1 135 135 LEU N N 15 119.450 0.020 . 1 . . . . 823 LEU N . 15996 1 1448 . 1 1 136 136 ARG H H 1 7.872 0.008 . 1 . . . . 824 ARG H . 15996 1 1449 . 1 1 136 136 ARG HA H 1 4.396 0.017 . 1 . . . . 824 ARG HA . 15996 1 1450 . 1 1 136 136 ARG HB2 H 1 1.608 0.009 . 2 . . . . 824 ARG HB2 . 15996 1 1451 . 1 1 136 136 ARG HB3 H 1 1.678 0.015 . 2 . . . . 824 ARG HB3 . 15996 1 1452 . 1 1 136 136 ARG HD2 H 1 3.032 0.014 . 2 . . . . 824 ARG HD2 . 15996 1 1453 . 1 1 136 136 ARG HD3 H 1 3.000 0.016 . 2 . . . . 824 ARG HD3 . 15996 1 1454 . 1 1 136 136 ARG HE H 1 7.332 0.006 . 1 . . . . 824 ARG HE . 15996 1 1455 . 1 1 136 136 ARG HG2 H 1 1.504 0.009 . 2 . . . . 824 ARG HG2 . 15996 1 1456 . 1 1 136 136 ARG HG3 H 1 1.520 0.001 . 2 . . . . 824 ARG HG3 . 15996 1 1457 . 1 1 136 136 ARG CA C 13 58.827 0.081 . 1 . . . . 824 ARG CA . 15996 1 1458 . 1 1 136 136 ARG CB C 13 30.079 0.104 . 1 . . . . 824 ARG CB . 15996 1 1459 . 1 1 136 136 ARG CD C 13 44.102 0.085 . 1 . . . . 824 ARG CD . 15996 1 1460 . 1 1 136 136 ARG CG C 13 25.898 0.049 . 1 . . . . 824 ARG CG . 15996 1 1461 . 1 1 136 136 ARG N N 15 120.254 0.022 . 1 . . . . 824 ARG N . 15996 1 1462 . 1 1 136 136 ARG NE N 15 83.808 0.081 . 1 . . . . 824 ARG NE . 15996 1 1463 . 1 1 137 137 CYS H H 1 8.598 0.009 . 1 . . . . 825 CYS H . 15996 1 1464 . 1 1 137 137 CYS HA H 1 4.177 0.007 . 1 . . . . 825 CYS HA . 15996 1 1465 . 1 1 137 137 CYS HB2 H 1 3.695 0.010 . 2 . . . . 825 CYS HB2 . 15996 1 1466 . 1 1 137 137 CYS HB3 H 1 3.055 0.006 . 2 . . . . 825 CYS HB3 . 15996 1 1467 . 1 1 137 137 CYS C C 13 175.515 0.001 . 1 . . . . 825 CYS C . 15996 1 1468 . 1 1 137 137 CYS CA C 13 59.840 0.053 . 1 . . . . 825 CYS CA . 15996 1 1469 . 1 1 137 137 CYS CB C 13 37.965 0.084 . 1 . . . . 825 CYS CB . 15996 1 1470 . 1 1 137 137 CYS N N 15 121.719 0.028 . 1 . . . . 825 CYS N . 15996 1 1471 . 1 1 138 138 ARG H H 1 7.586 0.003 . 1 . . . . 826 ARG H . 15996 1 1472 . 1 1 138 138 ARG HA H 1 4.324 0.006 . 1 . . . . 826 ARG HA . 15996 1 1473 . 1 1 138 138 ARG HB2 H 1 1.935 0.009 . 2 . . . . 826 ARG HB2 . 15996 1 1474 . 1 1 138 138 ARG HB3 H 1 2.147 0.011 . 2 . . . . 826 ARG HB3 . 15996 1 1475 . 1 1 138 138 ARG HD2 H 1 3.249 0.004 . 2 . . . . 826 ARG HD2 . 15996 1 1476 . 1 1 138 138 ARG HD3 H 1 3.222 0.001 . 2 . . . . 826 ARG HD3 . 15996 1 1477 . 1 1 138 138 ARG HE H 1 7.229 0.002 . 1 . . . . 826 ARG HE . 15996 1 1478 . 1 1 138 138 ARG HG2 H 1 1.767 0.009 . 2 . . . . 826 ARG HG2 . 15996 1 1479 . 1 1 138 138 ARG HG3 H 1 1.962 0.004 . 2 . . . . 826 ARG HG3 . 15996 1 1480 . 1 1 138 138 ARG C C 13 175.667 0.013 . 1 . . . . 826 ARG C . 15996 1 1481 . 1 1 138 138 ARG CA C 13 56.619 0.057 . 1 . . . . 826 ARG CA . 15996 1 1482 . 1 1 138 138 ARG CB C 13 30.156 0.091 . 1 . . . . 826 ARG CB . 15996 1 1483 . 1 1 138 138 ARG CD C 13 43.447 0.060 . 1 . . . . 826 ARG CD . 15996 1 1484 . 1 1 138 138 ARG CG C 13 28.656 0.072 . 1 . . . . 826 ARG CG . 15996 1 1485 . 1 1 138 138 ARG N N 15 117.401 0.026 . 1 . . . . 826 ARG N . 15996 1 1486 . 1 1 138 138 ARG NE N 15 85.084 0.037 . 1 . . . . 826 ARG NE . 15996 1 1487 . 1 1 139 139 GLY H H 1 7.896 0.005 . 1 . . . . 827 GLY H . 15996 1 1488 . 1 1 139 139 GLY HA2 H 1 3.713 0.007 . 2 . . . . 827 GLY HA2 . 15996 1 1489 . 1 1 139 139 GLY HA3 H 1 4.364 0.019 . 2 . . . . 827 GLY HA3 . 15996 1 1490 . 1 1 139 139 GLY C C 13 177.271 0.011 . 1 . . . . 827 GLY C . 15996 1 1491 . 1 1 139 139 GLY CA C 13 45.415 0.080 . 1 . . . . 827 GLY CA . 15996 1 1492 . 1 1 139 139 GLY N N 15 107.237 0.040 . 1 . . . . 827 GLY N . 15996 1 1493 . 1 1 140 140 GLN H H 1 7.863 0.006 . 1 . . . . 828 GLN H . 15996 1 1494 . 1 1 140 140 GLN HA H 1 4.311 0.006 . 1 . . . . 828 GLN HA . 15996 1 1495 . 1 1 140 140 GLN HB2 H 1 1.647 0.013 . 2 . . . . 828 GLN HB2 . 15996 1 1496 . 1 1 140 140 GLN HB3 H 1 1.809 0.012 . 2 . . . . 828 GLN HB3 . 15996 1 1497 . 1 1 140 140 GLN HE21 H 1 6.862 0.002 . 1 . . . . 828 GLN HE21 . 15996 1 1498 . 1 1 140 140 GLN HE22 H 1 7.504 0.001 . 1 . . . . 828 GLN HE22 . 15996 1 1499 . 1 1 140 140 GLN HG2 H 1 2.205 0.001 . 2 . . . . 828 GLN HG2 . 15996 1 1500 . 1 1 140 140 GLN HG3 H 1 2.206 0.004 . 2 . . . . 828 GLN HG3 . 15996 1 1501 . 1 1 140 140 GLN C C 13 176.478 0.002 . 1 . . . . 828 GLN C . 15996 1 1502 . 1 1 140 140 GLN CA C 13 54.994 0.110 . 1 . . . . 828 GLN CA . 15996 1 1503 . 1 1 140 140 GLN CB C 13 29.023 0.083 . 1 . . . . 828 GLN CB . 15996 1 1504 . 1 1 140 140 GLN CG C 13 33.883 0.042 . 1 . . . . 828 GLN CG . 15996 1 1505 . 1 1 140 140 GLN N N 15 120.290 0.035 . 1 . . . . 828 GLN N . 15996 1 1506 . 1 1 140 140 GLN NE2 N 15 112.884 0.041 . 1 . . . . 828 GLN NE2 . 15996 1 1507 . 1 1 141 141 SER H H 1 8.661 0.003 . 1 . . . . 829 SER H . 15996 1 1508 . 1 1 141 141 SER HA H 1 4.423 0.006 . 1 . . . . 829 SER HA . 15996 1 1509 . 1 1 141 141 SER HB2 H 1 3.794 0.014 . 2 . . . . 829 SER HB2 . 15996 1 1510 . 1 1 141 141 SER HB3 H 1 3.827 0.012 . 2 . . . . 829 SER HB3 . 15996 1 1511 . 1 1 141 141 SER C C 13 177.808 0.012 . 1 . . . . 829 SER C . 15996 1 1512 . 1 1 141 141 SER CA C 13 58.026 0.059 . 1 . . . . 829 SER CA . 15996 1 1513 . 1 1 141 141 SER CB C 13 62.709 0.076 . 1 . . . . 829 SER CB . 15996 1 1514 . 1 1 141 141 SER N N 15 119.535 0.023 . 1 . . . . 829 SER N . 15996 1 1515 . 1 1 142 142 ILE H H 1 8.243 0.004 . 1 . . . . 830 ILE H . 15996 1 1516 . 1 1 142 142 ILE HA H 1 4.924 0.025 . 1 . . . . 830 ILE HA . 15996 1 1517 . 1 1 142 142 ILE HB H 1 1.661 0.007 . 1 . . . . 830 ILE HB . 15996 1 1518 . 1 1 142 142 ILE HD11 H 1 0.657 0.016 . 1 . . . . 830 ILE HD11 . 15996 1 1519 . 1 1 142 142 ILE HD12 H 1 0.657 0.016 . 1 . . . . 830 ILE HD12 . 15996 1 1520 . 1 1 142 142 ILE HD13 H 1 0.657 0.016 . 1 . . . . 830 ILE HD13 . 15996 1 1521 . 1 1 142 142 ILE HG12 H 1 1.314 0.006 . 2 . . . . 830 ILE HG12 . 15996 1 1522 . 1 1 142 142 ILE HG13 H 1 0.972 0.004 . 2 . . . . 830 ILE HG13 . 15996 1 1523 . 1 1 142 142 ILE HG21 H 1 0.725 0.007 . 1 . . . . 830 ILE HG21 . 15996 1 1524 . 1 1 142 142 ILE HG22 H 1 0.725 0.007 . 1 . . . . 830 ILE HG22 . 15996 1 1525 . 1 1 142 142 ILE HG23 H 1 0.725 0.007 . 1 . . . . 830 ILE HG23 . 15996 1 1526 . 1 1 142 142 ILE C C 13 176.744 0.010 . 1 . . . . 830 ILE C . 15996 1 1527 . 1 1 142 142 ILE CA C 13 58.736 0.056 . 1 . . . . 830 ILE CA . 15996 1 1528 . 1 1 142 142 ILE CB C 13 41.193 0.083 . 1 . . . . 830 ILE CB . 15996 1 1529 . 1 1 142 142 ILE CD1 C 13 14.295 0.063 . 1 . . . . 830 ILE CD1 . 15996 1 1530 . 1 1 142 142 ILE CG1 C 13 26.011 0.090 . 1 . . . . 830 ILE CG1 . 15996 1 1531 . 1 1 142 142 ILE CG2 C 13 17.969 0.084 . 1 . . . . 830 ILE CG2 . 15996 1 1532 . 1 1 142 142 ILE N N 15 122.365 0.044 . 1 . . . . 830 ILE N . 15996 1 1533 . 1 1 143 143 SER H H 1 8.067 0.004 . 1 . . . . 831 SER H . 15996 1 1534 . 1 1 143 143 SER HA H 1 4.759 0.005 . 1 . . . . 831 SER HA . 15996 1 1535 . 1 1 143 143 SER HB2 H 1 3.650 0.006 . 2 . . . . 831 SER HB2 . 15996 1 1536 . 1 1 143 143 SER HB3 H 1 3.750 0.010 . 2 . . . . 831 SER HB3 . 15996 1 1537 . 1 1 143 143 SER C C 13 178.884 0.001 . 1 . . . . 831 SER C . 15996 1 1538 . 1 1 143 143 SER CA C 13 56.564 0.041 . 1 . . . . 831 SER CA . 15996 1 1539 . 1 1 143 143 SER CB C 13 64.759 0.061 . 1 . . . . 831 SER CB . 15996 1 1540 . 1 1 143 143 SER N N 15 117.363 0.035 . 1 . . . . 831 SER N . 15996 1 1541 . 1 1 144 144 VAL H H 1 8.772 0.017 . 1 . . . . 832 VAL H . 15996 1 1542 . 1 1 144 144 VAL HA H 1 4.209 0.006 . 1 . . . . 832 VAL HA . 15996 1 1543 . 1 1 144 144 VAL HB H 1 1.969 0.003 . 1 . . . . 832 VAL HB . 15996 1 1544 . 1 1 144 144 VAL HG11 H 1 0.748 0.001 . 2 . . . . 832 VAL HG11 . 15996 1 1545 . 1 1 144 144 VAL HG12 H 1 0.748 0.001 . 2 . . . . 832 VAL HG12 . 15996 1 1546 . 1 1 144 144 VAL HG13 H 1 0.748 0.001 . 2 . . . . 832 VAL HG13 . 15996 1 1547 . 1 1 144 144 VAL HG21 H 1 0.747 0.013 . 2 . . . . 832 VAL HG21 . 15996 1 1548 . 1 1 144 144 VAL HG22 H 1 0.747 0.013 . 2 . . . . 832 VAL HG22 . 15996 1 1549 . 1 1 144 144 VAL HG23 H 1 0.747 0.013 . 2 . . . . 832 VAL HG23 . 15996 1 1550 . 1 1 144 144 VAL C C 13 176.249 0.001 . 1 . . . . 832 VAL C . 15996 1 1551 . 1 1 144 144 VAL CA C 13 63.269 0.079 . 1 . . . . 832 VAL CA . 15996 1 1552 . 1 1 144 144 VAL CB C 13 31.649 0.094 . 1 . . . . 832 VAL CB . 15996 1 1553 . 1 1 144 144 VAL CG1 C 13 21.753 0.001 . 2 . . . . 832 VAL CG1 . 15996 1 1554 . 1 1 144 144 VAL CG2 C 13 21.708 0.069 . 2 . . . . 832 VAL CG2 . 15996 1 1555 . 1 1 144 144 VAL N N 15 127.482 0.033 . 1 . . . . 832 VAL N . 15996 1 1556 . 1 1 145 145 THR H H 1 9.126 0.007 . 1 . . . . 833 THR H . 15996 1 1557 . 1 1 145 145 THR HA H 1 4.353 0.011 . 1 . . . . 833 THR HA . 15996 1 1558 . 1 1 145 145 THR HB H 1 4.141 0.007 . 1 . . . . 833 THR HB . 15996 1 1559 . 1 1 145 145 THR HG21 H 1 1.002 0.005 . 1 . . . . 833 THR HG21 . 15996 1 1560 . 1 1 145 145 THR HG22 H 1 1.002 0.005 . 1 . . . . 833 THR HG22 . 15996 1 1561 . 1 1 145 145 THR HG23 H 1 1.002 0.005 . 1 . . . . 833 THR HG23 . 15996 1 1562 . 1 1 145 145 THR C C 13 175.915 0.001 . 1 . . . . 833 THR C . 15996 1 1563 . 1 1 145 145 THR CA C 13 61.797 0.062 . 1 . . . . 833 THR CA . 15996 1 1564 . 1 1 145 145 THR CB C 13 68.977 0.083 . 1 . . . . 833 THR CB . 15996 1 1565 . 1 1 145 145 THR CG2 C 13 22.625 0.087 . 1 . . . . 833 THR CG2 . 15996 1 1566 . 1 1 145 145 THR N N 15 119.758 0.048 . 1 . . . . 833 THR N . 15996 1 1567 . 1 1 146 146 SER H H 1 7.744 0.005 . 1 . . . . 834 SER H . 15996 1 1568 . 1 1 146 146 SER HA H 1 4.519 0.013 . 1 . . . . 834 SER HA . 15996 1 1569 . 1 1 146 146 SER HB2 H 1 3.797 0.017 . 2 . . . . 834 SER HB2 . 15996 1 1570 . 1 1 146 146 SER HB3 H 1 3.876 0.016 . 2 . . . . 834 SER HB3 . 15996 1 1571 . 1 1 146 146 SER C C 13 177.881 0.005 . 1 . . . . 834 SER C . 15996 1 1572 . 1 1 146 146 SER CA C 13 57.014 0.064 . 1 . . . . 834 SER CA . 15996 1 1573 . 1 1 146 146 SER CB C 13 63.395 0.096 . 1 . . . . 834 SER CB . 15996 1 1574 . 1 1 146 146 SER N N 15 115.095 0.027 . 1 . . . . 834 SER N . 15996 1 1575 . 1 1 147 147 ILE H H 1 8.114 0.009 . 1 . . . . 835 ILE H . 15996 1 1576 . 1 1 147 147 ILE HA H 1 4.281 0.009 . 1 . . . . 835 ILE HA . 15996 1 1577 . 1 1 147 147 ILE HB H 1 1.896 0.010 . 1 . . . . 835 ILE HB . 15996 1 1578 . 1 1 147 147 ILE HD11 H 1 -0.098 0.006 . 1 . . . . 835 ILE HD11 . 15996 1 1579 . 1 1 147 147 ILE HD12 H 1 -0.098 0.006 . 1 . . . . 835 ILE HD12 . 15996 1 1580 . 1 1 147 147 ILE HD13 H 1 -0.098 0.006 . 1 . . . . 835 ILE HD13 . 15996 1 1581 . 1 1 147 147 ILE HG12 H 1 1.074 0.008 . 2 . . . . 835 ILE HG12 . 15996 1 1582 . 1 1 147 147 ILE HG13 H 1 0.808 0.040 . 2 . . . . 835 ILE HG13 . 15996 1 1583 . 1 1 147 147 ILE HG21 H 1 0.816 0.007 . 1 . . . . 835 ILE HG21 . 15996 1 1584 . 1 1 147 147 ILE HG22 H 1 0.816 0.007 . 1 . . . . 835 ILE HG22 . 15996 1 1585 . 1 1 147 147 ILE HG23 H 1 0.816 0.007 . 1 . . . . 835 ILE HG23 . 15996 1 1586 . 1 1 147 147 ILE C C 13 179.311 0.002 . 1 . . . . 835 ILE C . 15996 1 1587 . 1 1 147 147 ILE CA C 13 62.385 0.095 . 1 . . . . 835 ILE CA . 15996 1 1588 . 1 1 147 147 ILE CB C 13 36.029 0.082 . 1 . . . . 835 ILE CB . 15996 1 1589 . 1 1 147 147 ILE CD1 C 13 12.500 0.061 . 1 . . . . 835 ILE CD1 . 15996 1 1590 . 1 1 147 147 ILE CG1 C 13 25.194 0.064 . 1 . . . . 835 ILE CG1 . 15996 1 1591 . 1 1 147 147 ILE CG2 C 13 18.863 0.045 . 1 . . . . 835 ILE CG2 . 15996 1 1592 . 1 1 147 147 ILE N N 15 117.134 0.032 . 1 . . . . 835 ILE N . 15996 1 1593 . 1 1 148 148 ARG H H 1 8.104 0.009 . 1 . . . . 836 ARG H . 15996 1 1594 . 1 1 148 148 ARG HA H 1 5.048 0.007 . 1 . . . . 836 ARG HA . 15996 1 1595 . 1 1 148 148 ARG HB2 H 1 1.937 0.010 . 2 . . . . 836 ARG HB2 . 15996 1 1596 . 1 1 148 148 ARG HB3 H 1 1.423 0.005 . 2 . . . . 836 ARG HB3 . 15996 1 1597 . 1 1 148 148 ARG HD2 H 1 3.196 0.006 . 2 . . . . 836 ARG HD2 . 15996 1 1598 . 1 1 148 148 ARG HD3 H 1 3.130 0.003 . 2 . . . . 836 ARG HD3 . 15996 1 1599 . 1 1 148 148 ARG HE H 1 7.273 0.002 . 1 . . . . 836 ARG HE . 15996 1 1600 . 1 1 148 148 ARG HG2 H 1 1.487 0.014 . 2 . . . . 836 ARG HG2 . 15996 1 1601 . 1 1 148 148 ARG HG3 H 1 1.656 0.013 . 2 . . . . 836 ARG HG3 . 15996 1 1602 . 1 1 148 148 ARG C C 13 180.522 0.001 . 1 . . . . 836 ARG C . 15996 1 1603 . 1 1 148 148 ARG CA C 13 54.171 0.080 . 1 . . . . 836 ARG CA . 15996 1 1604 . 1 1 148 148 ARG CB C 13 31.006 0.056 . 1 . . . . 836 ARG CB . 15996 1 1605 . 1 1 148 148 ARG CD C 13 43.101 0.086 . 1 . . . . 836 ARG CD . 15996 1 1606 . 1 1 148 148 ARG CG C 13 28.210 0.088 . 1 . . . . 836 ARG CG . 15996 1 1607 . 1 1 148 148 ARG N N 15 123.985 0.031 . 1 . . . . 836 ARG N . 15996 1 1608 . 1 1 148 148 ARG NE N 15 84.538 0.024 . 1 . . . . 836 ARG NE . 15996 1 1609 . 1 1 149 149 PRO HA H 1 3.779 0.009 . 1 . . . . 837 PRO HA . 15996 1 1610 . 1 1 149 149 PRO HB2 H 1 2.325 0.005 . 2 . . . . 837 PRO HB2 . 15996 1 1611 . 1 1 149 149 PRO HB3 H 1 1.639 0.004 . 2 . . . . 837 PRO HB3 . 15996 1 1612 . 1 1 149 149 PRO C C 13 175.544 0.001 . 1 . . . . 837 PRO C . 15996 1 1613 . 1 1 149 149 PRO CA C 13 63.167 0.100 . 1 . . . . 837 PRO CA . 15996 1 1614 . 1 1 149 149 PRO CB C 13 32.194 0.069 . 1 . . . . 837 PRO CB . 15996 1 1615 . 1 1 150 150 CYS H H 1 8.077 0.004 . 1 . . . . 838 CYS H . 15996 1 1616 . 1 1 150 150 CYS HA H 1 4.177 0.011 . 1 . . . . 838 CYS HA . 15996 1 1617 . 1 1 150 150 CYS HB2 H 1 2.491 0.015 . 2 . . . . 838 CYS HB2 . 15996 1 1618 . 1 1 150 150 CYS HB3 H 1 3.200 0.007 . 2 . . . . 838 CYS HB3 . 15996 1 1619 . 1 1 150 150 CYS C C 13 176.888 0.001 . 1 . . . . 838 CYS C . 15996 1 1620 . 1 1 150 150 CYS CA C 13 54.541 0.058 . 1 . . . . 838 CYS CA . 15996 1 1621 . 1 1 150 150 CYS CB C 13 38.773 0.060 . 1 . . . . 838 CYS CB . 15996 1 1622 . 1 1 150 150 CYS N N 15 120.898 0.053 . 1 . . . . 838 CYS N . 15996 1 1623 . 1 1 151 151 ALA H H 1 8.500 0.006 . 1 . . . . 839 ALA H . 15996 1 1624 . 1 1 151 151 ALA HA H 1 4.238 0.013 . 1 . . . . 839 ALA HA . 15996 1 1625 . 1 1 151 151 ALA HB1 H 1 1.334 0.003 . 1 . . . . 839 ALA HB1 . 15996 1 1626 . 1 1 151 151 ALA HB2 H 1 1.334 0.003 . 1 . . . . 839 ALA HB2 . 15996 1 1627 . 1 1 151 151 ALA HB3 H 1 1.334 0.003 . 1 . . . . 839 ALA HB3 . 15996 1 1628 . 1 1 151 151 ALA C C 13 174.979 0.001 . 1 . . . . 839 ALA C . 15996 1 1629 . 1 1 151 151 ALA CA C 13 52.476 0.071 . 1 . . . . 839 ALA CA . 15996 1 1630 . 1 1 151 151 ALA CB C 13 19.220 0.078 . 1 . . . . 839 ALA CB . 15996 1 1631 . 1 1 151 151 ALA N N 15 124.242 0.041 . 1 . . . . 839 ALA N . 15996 1 1632 . 1 1 152 152 ALA H H 1 8.089 0.003 . 1 . . . . 840 ALA H . 15996 1 1633 . 1 1 152 152 ALA HA H 1 4.242 0.013 . 1 . . . . 840 ALA HA . 15996 1 1634 . 1 1 152 152 ALA HB1 H 1 1.333 0.003 . 1 . . . . 840 ALA HB1 . 15996 1 1635 . 1 1 152 152 ALA HB2 H 1 1.333 0.003 . 1 . . . . 840 ALA HB2 . 15996 1 1636 . 1 1 152 152 ALA HB3 H 1 1.333 0.003 . 1 . . . . 840 ALA HB3 . 15996 1 1637 . 1 1 152 152 ALA C C 13 174.317 0.011 . 1 . . . . 840 ALA C . 15996 1 1638 . 1 1 152 152 ALA CA C 13 52.492 0.068 . 1 . . . . 840 ALA CA . 15996 1 1639 . 1 1 152 152 ALA CB C 13 19.261 0.062 . 1 . . . . 840 ALA CB . 15996 1 1640 . 1 1 152 152 ALA N N 15 123.062 0.034 . 1 . . . . 840 ALA N . 15996 1 1641 . 1 1 153 153 GLU H H 1 8.439 0.004 . 1 . . . . 841 GLU H . 15996 1 1642 . 1 1 153 153 GLU HA H 1 4.309 0.005 . 1 . . . . 841 GLU HA . 15996 1 1643 . 1 1 153 153 GLU HB2 H 1 1.935 0.013 . 2 . . . . 841 GLU HB2 . 15996 1 1644 . 1 1 153 153 GLU HB3 H 1 2.064 0.007 . 2 . . . . 841 GLU HB3 . 15996 1 1645 . 1 1 153 153 GLU HG2 H 1 2.279 0.005 . 2 . . . . 841 GLU HG2 . 15996 1 1646 . 1 1 153 153 GLU HG3 H 1 2.243 0.001 . 2 . . . . 841 GLU HG3 . 15996 1 1647 . 1 1 153 153 GLU C C 13 175.324 0.003 . 1 . . . . 841 GLU C . 15996 1 1648 . 1 1 153 153 GLU CA C 13 56.561 0.052 . 1 . . . . 841 GLU CA . 15996 1 1649 . 1 1 153 153 GLU CB C 13 30.235 0.085 . 1 . . . . 841 GLU CB . 15996 1 1650 . 1 1 153 153 GLU CG C 13 36.177 0.019 . 1 . . . . 841 GLU CG . 15996 1 1651 . 1 1 153 153 GLU N N 15 120.047 0.041 . 1 . . . . 841 GLU N . 15996 1 1652 . 1 1 154 154 THR H H 1 8.171 0.003 . 1 . . . . 842 THR H . 15996 1 1653 . 1 1 154 154 THR HA H 1 4.304 0.005 . 1 . . . . 842 THR HA . 15996 1 1654 . 1 1 154 154 THR HB H 1 4.202 0.008 . 1 . . . . 842 THR HB . 15996 1 1655 . 1 1 154 154 THR HG21 H 1 1.173 0.001 . 1 . . . . 842 THR HG21 . 15996 1 1656 . 1 1 154 154 THR HG22 H 1 1.173 0.001 . 1 . . . . 842 THR HG22 . 15996 1 1657 . 1 1 154 154 THR HG23 H 1 1.173 0.001 . 1 . . . . 842 THR HG23 . 15996 1 1658 . 1 1 154 154 THR C C 13 178.331 0.004 . 1 . . . . 842 THR C . 15996 1 1659 . 1 1 154 154 THR CA C 13 61.880 0.060 . 1 . . . . 842 THR CA . 15996 1 1660 . 1 1 154 154 THR CB C 13 69.905 0.086 . 1 . . . . 842 THR CB . 15996 1 1661 . 1 1 154 154 THR CG2 C 13 21.448 0.009 . 1 . . . . 842 THR CG2 . 15996 1 1662 . 1 1 154 154 THR N N 15 115.386 0.016 . 1 . . . . 842 THR N . 15996 1 1663 . 1 1 155 155 GLN H H 1 8.013 0.004 . 1 . . . . 843 GLN H . 15996 1 1664 . 1 1 155 155 GLN HA H 1 4.157 0.004 . 1 . . . . 843 GLN HA . 15996 1 1665 . 1 1 155 155 GLN HB2 H 1 2.087 0.005 . 2 . . . . 843 GLN HB2 . 15996 1 1666 . 1 1 155 155 GLN HB3 H 1 1.902 0.007 . 2 . . . . 843 GLN HB3 . 15996 1 1667 . 1 1 155 155 GLN HE21 H 1 6.785 0.002 . 1 . . . . 843 GLN HE21 . 15996 1 1668 . 1 1 155 155 GLN HE22 H 1 7.509 0.002 . 1 . . . . 843 GLN HE22 . 15996 1 1669 . 1 1 155 155 GLN HG2 H 1 2.246 0.001 . 2 . . . . 843 GLN HG2 . 15996 1 1670 . 1 1 155 155 GLN HG3 H 1 2.263 0.008 . 2 . . . . 843 GLN HG3 . 15996 1 1671 . 1 1 155 155 GLN C C 13 171.506 0.001 . 1 . . . . 843 GLN C . 15996 1 1672 . 1 1 155 155 GLN CA C 13 57.392 0.036 . 1 . . . . 843 GLN CA . 15996 1 1673 . 1 1 155 155 GLN CB C 13 30.372 0.081 . 1 . . . . 843 GLN CB . 15996 1 1674 . 1 1 155 155 GLN CG C 13 34.230 0.060 . 1 . . . . 843 GLN CG . 15996 1 1675 . 1 1 155 155 GLN N N 15 127.654 0.013 . 1 . . . . 843 GLN N . 15996 1 1676 . 1 1 155 155 GLN NE2 N 15 112.438 0.015 . 1 . . . . 843 GLN NE2 . 15996 1 stop_ save_