data_30458 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 30458 _Entry.Title ; Direct Activation of the Executioner Domain of MLKL by a Select Repertoire of Inositol Phosphates ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2018-04-24 _Entry.Accession_date 2018-04-24 _Entry.Last_release_date 2018-07-27 _Entry.Original_release_date 2018-07-27 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_experimental_methods.ID _Entry_experimental_methods.Method _Entry_experimental_methods.Subtype _Entry_experimental_methods.Entry_ID 1 'SOLUTION NMR' 'SOLUTION NMR' 30458 stop_ loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 G. Royappa G. C. . . 30458 2 D. McNamara D. E. . . 30458 3 T. Moldoveanu T. . . . 30458 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'LIPID BINDING PROTEIN' . 30458 Membrane . 30458 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 30458 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 696 30458 '15N chemical shifts' 174 30458 '1H chemical shifts' 1156 30458 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2022-05-15 2018-04-24 update BMRB 'update entry citation' 30458 1 . . 2019-05-07 2018-04-24 original author 'original release' 30458 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 6D74 . 30458 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 30458 _Citation.ID 1 _Citation.Name . _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 29883610 _Citation.DOI 10.1016/j.molcel.2018.05.010 _Citation.Full_citation . _Citation.Title ; MLKL Requires the Inositol Phosphate Code to Execute Necroptosis. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Mol. Cell' _Citation.Journal_name_full . _Citation.Journal_volume 70 _Citation.Journal_issue 5 _Citation.Journal_ASTM MOCEFL _Citation.Journal_ISSN 1097-4164 _Citation.Journal_CSD 2168 _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 936 _Citation.Page_last 948 _Citation.Year 2018 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 C. Dovey C. M. . . 30458 1 2 J. Diep J. . . . 30458 1 3 B. Clarke B. P. . . 30458 1 4 A. Hale A. T. . . 30458 1 5 D. McNamara D. E. . . 30458 1 6 H. Guo H. . . . 30458 1 7 N. Brown N. W. . . 30458 1 8 J. Cao J. Y. . . 30458 1 9 C. Grace C. R. . . 30458 1 10 P. Gough P. J. . . 30458 1 11 J. Bertin J. . . . 30458 1 12 S. Dixon S. J. . . 30458 1 13 D. Fiedler D. . . . 30458 1 14 E. Mocarski E. S. . . 30458 1 15 W. Kaiser W. J. . . 30458 1 16 T. Moldoveanu T. . . . 30458 1 17 J. York J. D. . . 30458 1 18 J. Carette J. E. . . 30458 1 stop_ save_ save_citation_2 _Citation.Sf_category citations _Citation.Sf_framecode citation_2 _Citation.Entry_ID 30458 _Citation.ID 2 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 31031142 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Direct Activation of Human MLKL by a Select Repertoire of Inositol Phosphate Metabolites ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Cell Chem. Biol.' _Citation.Journal_name_full . _Citation.Journal_volume 26 _Citation.Journal_issue 6 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD 0353 _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 863 _Citation.Page_last 877 _Citation.Year 2019 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 D. McNamara D. E. . . 30458 2 2 C. Dovey C. M. . . 30458 2 3 A. Hale A. T. . . 30458 2 4 G. Quarato G. . . . 30458 2 5 C. Grace C. R. . . 30458 2 6 C. Guibao C. D. . . 30458 2 7 J. Diep J. . . . 30458 2 8 A. Nourse A. . . . 30458 2 9 C. Cai C. R. . . 30458 2 10 H. Wu H. . . . 30458 2 11 R. Kalathur R. C. . . 30458 2 12 D. Green D. R. . . 30458 2 13 J. York J. D. . . 30458 2 14 J. Carette J. . . . 30458 2 15 T. Moldoveanu T. . . . 30458 2 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 30458 _Assembly.ID 1 _Assembly.Name 'Mixed lineage kinase domain-like protein' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 entity_1 1 $entity_1 A A yes . . . . . . 30458 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 30458 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MENLKHIITLGQVIHKRCEE MKYCKKQCRRLGHRVLGLIK PLEMLQDQGKRSVPSEKLTT AMNRFKAALEEANGEIEKFS NRSNICRFLTASQDKILFKD VNRKLSDVWKELSLLLQVEQ RMPVSPISQGASWAQEDQQD ADEDRRAFQMLRRDNE ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer no _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 156 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment 'residues 1-156' _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 18261.078 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID hMLKL na 30458 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 . MET . 30458 1 2 . GLU . 30458 1 3 . ASN . 30458 1 4 . LEU . 30458 1 5 . LYS . 30458 1 6 . HIS . 30458 1 7 . ILE . 30458 1 8 . ILE . 30458 1 9 . THR . 30458 1 10 . LEU . 30458 1 11 . GLY . 30458 1 12 . GLN . 30458 1 13 . VAL . 30458 1 14 . ILE . 30458 1 15 . HIS . 30458 1 16 . LYS . 30458 1 17 . ARG . 30458 1 18 . CYS . 30458 1 19 . GLU . 30458 1 20 . GLU . 30458 1 21 . MET . 30458 1 22 . LYS . 30458 1 23 . TYR . 30458 1 24 . CYS . 30458 1 25 . LYS . 30458 1 26 . LYS . 30458 1 27 . GLN . 30458 1 28 . CYS . 30458 1 29 . ARG . 30458 1 30 . ARG . 30458 1 31 . LEU . 30458 1 32 . GLY . 30458 1 33 . HIS . 30458 1 34 . ARG . 30458 1 35 . VAL . 30458 1 36 . LEU . 30458 1 37 . GLY . 30458 1 38 . LEU . 30458 1 39 . ILE . 30458 1 40 . LYS . 30458 1 41 . PRO . 30458 1 42 . LEU . 30458 1 43 . GLU . 30458 1 44 . MET . 30458 1 45 . LEU . 30458 1 46 . GLN . 30458 1 47 . ASP . 30458 1 48 . GLN . 30458 1 49 . GLY . 30458 1 50 . LYS . 30458 1 51 . ARG . 30458 1 52 . SER . 30458 1 53 . VAL . 30458 1 54 . PRO . 30458 1 55 . SER . 30458 1 56 . GLU . 30458 1 57 . LYS . 30458 1 58 . LEU . 30458 1 59 . THR . 30458 1 60 . THR . 30458 1 61 . ALA . 30458 1 62 . MET . 30458 1 63 . ASN . 30458 1 64 . ARG . 30458 1 65 . PHE . 30458 1 66 . LYS . 30458 1 67 . ALA . 30458 1 68 . ALA . 30458 1 69 . LEU . 30458 1 70 . GLU . 30458 1 71 . GLU . 30458 1 72 . ALA . 30458 1 73 . ASN . 30458 1 74 . GLY . 30458 1 75 . GLU . 30458 1 76 . ILE . 30458 1 77 . GLU . 30458 1 78 . LYS . 30458 1 79 . PHE . 30458 1 80 . SER . 30458 1 81 . ASN . 30458 1 82 . ARG . 30458 1 83 . SER . 30458 1 84 . ASN . 30458 1 85 . ILE . 30458 1 86 . CYS . 30458 1 87 . ARG . 30458 1 88 . PHE . 30458 1 89 . LEU . 30458 1 90 . THR . 30458 1 91 . ALA . 30458 1 92 . SER . 30458 1 93 . GLN . 30458 1 94 . ASP . 30458 1 95 . LYS . 30458 1 96 . ILE . 30458 1 97 . LEU . 30458 1 98 . PHE . 30458 1 99 . LYS . 30458 1 100 . ASP . 30458 1 101 . VAL . 30458 1 102 . ASN . 30458 1 103 . ARG . 30458 1 104 . LYS . 30458 1 105 . LEU . 30458 1 106 . SER . 30458 1 107 . ASP . 30458 1 108 . VAL . 30458 1 109 . TRP . 30458 1 110 . LYS . 30458 1 111 . GLU . 30458 1 112 . LEU . 30458 1 113 . SER . 30458 1 114 . LEU . 30458 1 115 . LEU . 30458 1 116 . LEU . 30458 1 117 . GLN . 30458 1 118 . VAL . 30458 1 119 . GLU . 30458 1 120 . GLN . 30458 1 121 . ARG . 30458 1 122 . MET . 30458 1 123 . PRO . 30458 1 124 . VAL . 30458 1 125 . SER . 30458 1 126 . PRO . 30458 1 127 . ILE . 30458 1 128 . SER . 30458 1 129 . GLN . 30458 1 130 . GLY . 30458 1 131 . ALA . 30458 1 132 . SER . 30458 1 133 . TRP . 30458 1 134 . ALA . 30458 1 135 . GLN . 30458 1 136 . GLU . 30458 1 137 . ASP . 30458 1 138 . GLN . 30458 1 139 . GLN . 30458 1 140 . ASP . 30458 1 141 . ALA . 30458 1 142 . ASP . 30458 1 143 . GLU . 30458 1 144 . ASP . 30458 1 145 . ARG . 30458 1 146 . ARG . 30458 1 147 . ALA . 30458 1 148 . PHE . 30458 1 149 . GLN . 30458 1 150 . MET . 30458 1 151 . LEU . 30458 1 152 . ARG . 30458 1 153 . ARG . 30458 1 154 . ASP . 30458 1 155 . ASN . 30458 1 156 . GLU . 30458 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 . MET 1 1 30458 1 . GLU 2 2 30458 1 . ASN 3 3 30458 1 . LEU 4 4 30458 1 . LYS 5 5 30458 1 . HIS 6 6 30458 1 . ILE 7 7 30458 1 . ILE 8 8 30458 1 . THR 9 9 30458 1 . LEU 10 10 30458 1 . GLY 11 11 30458 1 . GLN 12 12 30458 1 . VAL 13 13 30458 1 . ILE 14 14 30458 1 . HIS 15 15 30458 1 . LYS 16 16 30458 1 . ARG 17 17 30458 1 . CYS 18 18 30458 1 . GLU 19 19 30458 1 . GLU 20 20 30458 1 . MET 21 21 30458 1 . LYS 22 22 30458 1 . TYR 23 23 30458 1 . CYS 24 24 30458 1 . LYS 25 25 30458 1 . LYS 26 26 30458 1 . GLN 27 27 30458 1 . CYS 28 28 30458 1 . ARG 29 29 30458 1 . ARG 30 30 30458 1 . LEU 31 31 30458 1 . GLY 32 32 30458 1 . HIS 33 33 30458 1 . ARG 34 34 30458 1 . VAL 35 35 30458 1 . LEU 36 36 30458 1 . GLY 37 37 30458 1 . LEU 38 38 30458 1 . ILE 39 39 30458 1 . LYS 40 40 30458 1 . PRO 41 41 30458 1 . LEU 42 42 30458 1 . GLU 43 43 30458 1 . MET 44 44 30458 1 . LEU 45 45 30458 1 . GLN 46 46 30458 1 . ASP 47 47 30458 1 . GLN 48 48 30458 1 . GLY 49 49 30458 1 . LYS 50 50 30458 1 . ARG 51 51 30458 1 . SER 52 52 30458 1 . VAL 53 53 30458 1 . PRO 54 54 30458 1 . SER 55 55 30458 1 . GLU 56 56 30458 1 . LYS 57 57 30458 1 . LEU 58 58 30458 1 . THR 59 59 30458 1 . THR 60 60 30458 1 . ALA 61 61 30458 1 . MET 62 62 30458 1 . ASN 63 63 30458 1 . ARG 64 64 30458 1 . PHE 65 65 30458 1 . LYS 66 66 30458 1 . ALA 67 67 30458 1 . ALA 68 68 30458 1 . LEU 69 69 30458 1 . GLU 70 70 30458 1 . GLU 71 71 30458 1 . ALA 72 72 30458 1 . ASN 73 73 30458 1 . GLY 74 74 30458 1 . GLU 75 75 30458 1 . ILE 76 76 30458 1 . GLU 77 77 30458 1 . LYS 78 78 30458 1 . PHE 79 79 30458 1 . SER 80 80 30458 1 . ASN 81 81 30458 1 . ARG 82 82 30458 1 . SER 83 83 30458 1 . ASN 84 84 30458 1 . ILE 85 85 30458 1 . CYS 86 86 30458 1 . ARG 87 87 30458 1 . PHE 88 88 30458 1 . LEU 89 89 30458 1 . THR 90 90 30458 1 . ALA 91 91 30458 1 . SER 92 92 30458 1 . GLN 93 93 30458 1 . ASP 94 94 30458 1 . LYS 95 95 30458 1 . ILE 96 96 30458 1 . LEU 97 97 30458 1 . PHE 98 98 30458 1 . LYS 99 99 30458 1 . ASP 100 100 30458 1 . VAL 101 101 30458 1 . ASN 102 102 30458 1 . ARG 103 103 30458 1 . LYS 104 104 30458 1 . LEU 105 105 30458 1 . SER 106 106 30458 1 . ASP 107 107 30458 1 . VAL 108 108 30458 1 . TRP 109 109 30458 1 . LYS 110 110 30458 1 . GLU 111 111 30458 1 . LEU 112 112 30458 1 . SER 113 113 30458 1 . LEU 114 114 30458 1 . LEU 115 115 30458 1 . LEU 116 116 30458 1 . GLN 117 117 30458 1 . VAL 118 118 30458 1 . GLU 119 119 30458 1 . GLN 120 120 30458 1 . ARG 121 121 30458 1 . MET 122 122 30458 1 . PRO 123 123 30458 1 . VAL 124 124 30458 1 . SER 125 125 30458 1 . PRO 126 126 30458 1 . ILE 127 127 30458 1 . SER 128 128 30458 1 . GLN 129 129 30458 1 . GLY 130 130 30458 1 . ALA 131 131 30458 1 . SER 132 132 30458 1 . TRP 133 133 30458 1 . ALA 134 134 30458 1 . GLN 135 135 30458 1 . GLU 136 136 30458 1 . ASP 137 137 30458 1 . GLN 138 138 30458 1 . GLN 139 139 30458 1 . ASP 140 140 30458 1 . ALA 141 141 30458 1 . ASP 142 142 30458 1 . GLU 143 143 30458 1 . ASP 144 144 30458 1 . ARG 145 145 30458 1 . ARG 146 146 30458 1 . ALA 147 147 30458 1 . PHE 148 148 30458 1 . GLN 149 149 30458 1 . MET 150 150 30458 1 . LEU 151 151 30458 1 . ARG 152 152 30458 1 . ARG 153 153 30458 1 . ASP 154 154 30458 1 . ASN 155 155 30458 1 . GLU 156 156 30458 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 30458 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . MLKL . 30458 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 30458 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . 562 Escherichia coli . . . . . . . . . . 30458 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 30458 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details '500 uM [U-13C; U-15N] protein, 90% H2O/10% D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 entity_1 '[U-13C; U-15N]' . . 1 $entity_1 . . 500 . . uM . . . . 30458 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 30458 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0 . mM 30458 1 pH 6.8 . pH 30458 1 pressure 1 . atm 30458 1 temperature 303 . K 30458 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 30458 _Software.ID 1 _Software.Type . _Software.Name CYANA _Software.Version 2.1 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 30458 1 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID refinement . 30458 1 'structure calculation' . 30458 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 30458 _Software.ID 2 _Software.Type . _Software.Name CARA _Software.Version 1.9 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Keller and Wuthrich' . . 30458 2 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 30458 2 'peak picking' . 30458 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 30458 _Software.ID 3 _Software.Type . _Software.Name TOPSPIN _Software.Version 3.5 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 30458 3 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID collection . 30458 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 30458 _Software.ID 4 _Software.Type . _Software.Name CNS _Software.Version 1.3 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Brunger, Adams, Clore, Gros, Nilges and Read' . . 30458 4 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'geometry optimization' . 30458 4 refinement . 30458 4 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 30458 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AvanceII _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 30458 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AvanceIII _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 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 30458 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . 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 NMR_spectrometer_1 Bruker AvanceII . 600 . . . 30458 1 2 NMR_spectrometer_2 Bruker AvanceIII . 800 . . . 30458 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 30458 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_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.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 30458 1 2 '3D 1H-15N NOESY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 30458 1 3 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 30458 1 4 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 30458 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 30458 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.25144953 . . . . . 30458 1 H 1 DSS 'methyl protons' . . . . ppm 0.000 internal direct 1.0 . . . . . 30458 1 N 15 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.10132912 . . . . . 30458 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_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 30458 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _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 $chem_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' . . . 30458 1 2 '3D 1H-15N NOESY' . . . 30458 1 3 '3D 1H-13C NOESY aliphatic' . . . 30458 1 4 '3D 1H-13C NOESY aromatic' . . . 30458 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_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.Ambiguity_set_ID _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 MET HA H 1 4.505 0.020 . 1 . . . . A 1 MET HA . 30458 1 2 . 1 . 1 1 1 MET HB2 H 1 2.104 0.020 . 1 . . . . A 1 MET HB2 . 30458 1 3 . 1 . 1 1 1 MET HB3 H 1 2.104 0.020 . 1 . . . . A 1 MET HB3 . 30458 1 4 . 1 . 1 1 1 MET HG2 H 1 2.506 0.020 . 2 . . . . A 1 MET HG2 . 30458 1 5 . 1 . 1 1 1 MET HG3 H 1 2.629 0.020 . 2 . . . . A 1 MET HG3 . 30458 1 6 . 1 . 1 1 1 MET HE1 H 1 1.966 0.020 . 1 . . . . A 1 MET HE1 . 30458 1 7 . 1 . 1 1 1 MET HE2 H 1 1.966 0.020 . 1 . . . . A 1 MET HE2 . 30458 1 8 . 1 . 1 1 1 MET HE3 H 1 1.966 0.020 . 1 . . . . A 1 MET HE3 . 30458 1 9 . 1 . 1 1 1 MET CA C 13 56.037 0.3 . 1 . . . . A 1 MET CA . 30458 1 10 . 1 . 1 1 1 MET CB C 13 32.791 0.3 . 1 . . . . A 1 MET CB . 30458 1 11 . 1 . 1 1 1 MET CG C 13 32.571 0.3 . 1 . . . . A 1 MET CG . 30458 1 12 . 1 . 1 1 1 MET CE C 13 17.293 0.3 . 1 . . . . A 1 MET CE . 30458 1 13 . 1 . 1 2 2 GLU H H 1 8.789 0.020 . 1 . . . . A 2 GLU H . 30458 1 14 . 1 . 1 2 2 GLU HA H 1 3.990 0.020 . 1 . . . . A 2 GLU HA . 30458 1 15 . 1 . 1 2 2 GLU HB2 H 1 2.007 0.020 . 2 . . . . A 2 GLU HB2 . 30458 1 16 . 1 . 1 2 2 GLU HB3 H 1 2.167 0.020 . 2 . . . . A 2 GLU HB3 . 30458 1 17 . 1 . 1 2 2 GLU HG2 H 1 2.243 0.020 . 2 . . . . A 2 GLU HG2 . 30458 1 18 . 1 . 1 2 2 GLU HG3 H 1 2.448 0.020 . 2 . . . . A 2 GLU HG3 . 30458 1 19 . 1 . 1 2 2 GLU C C 13 177.593 0.3 . 1 . . . . A 2 GLU C . 30458 1 20 . 1 . 1 2 2 GLU CA C 13 59.397 0.3 . 1 . . . . A 2 GLU CA . 30458 1 21 . 1 . 1 2 2 GLU CB C 13 29.664 0.3 . 1 . . . . A 2 GLU CB . 30458 1 22 . 1 . 1 2 2 GLU CG C 13 36.436 0.3 . 1 . . . . A 2 GLU CG . 30458 1 23 . 1 . 1 2 2 GLU N N 15 122.681 0.3 . 1 . . . . A 2 GLU N . 30458 1 24 . 1 . 1 3 3 ASN H H 1 8.368 0.020 . 1 . . . . A 3 ASN H . 30458 1 25 . 1 . 1 3 3 ASN HA H 1 4.616 0.020 . 1 . . . . A 3 ASN HA . 30458 1 26 . 1 . 1 3 3 ASN HB2 H 1 2.801 0.020 . 2 . . . . A 3 ASN HB2 . 30458 1 27 . 1 . 1 3 3 ASN HB3 H 1 2.883 0.020 . 2 . . . . A 3 ASN HB3 . 30458 1 28 . 1 . 1 3 3 ASN HD21 H 1 7.693 0.020 . 1 . . . . A 3 ASN HD21 . 30458 1 29 . 1 . 1 3 3 ASN HD22 H 1 6.907 0.020 . 1 . . . . A 3 ASN HD22 . 30458 1 30 . 1 . 1 3 3 ASN C C 13 177.040 0.3 . 1 . . . . A 3 ASN C . 30458 1 31 . 1 . 1 3 3 ASN CA C 13 55.098 0.3 . 1 . . . . A 3 ASN CA . 30458 1 32 . 1 . 1 3 3 ASN CB C 13 38.042 0.3 . 1 . . . . A 3 ASN CB . 30458 1 33 . 1 . 1 3 3 ASN N N 15 116.111 0.3 . 1 . . . . A 3 ASN N . 30458 1 34 . 1 . 1 3 3 ASN ND2 N 15 111.742 0.3 . 1 . . . . A 3 ASN ND2 . 30458 1 35 . 1 . 1 4 4 LEU H H 1 7.833 0.020 . 1 . . . . A 4 LEU H . 30458 1 36 . 1 . 1 4 4 LEU HA H 1 4.013 0.020 . 1 . . . . A 4 LEU HA . 30458 1 37 . 1 . 1 4 4 LEU HB2 H 1 1.738 0.020 . 2 . . . . A 4 LEU HB2 . 30458 1 38 . 1 . 1 4 4 LEU HB3 H 1 1.694 0.020 . 2 . . . . A 4 LEU HB3 . 30458 1 39 . 1 . 1 4 4 LEU HD11 H 1 0.979 0.020 . 1 . . . . A 4 LEU HD11 . 30458 1 40 . 1 . 1 4 4 LEU HD12 H 1 0.979 0.020 . 1 . . . . A 4 LEU HD12 . 30458 1 41 . 1 . 1 4 4 LEU HD13 H 1 0.979 0.020 . 1 . . . . A 4 LEU HD13 . 30458 1 42 . 1 . 1 4 4 LEU HD21 H 1 0.915 0.020 . 1 . . . . A 4 LEU HD21 . 30458 1 43 . 1 . 1 4 4 LEU HD22 H 1 0.915 0.020 . 1 . . . . A 4 LEU HD22 . 30458 1 44 . 1 . 1 4 4 LEU HD23 H 1 0.915 0.020 . 1 . . . . A 4 LEU HD23 . 30458 1 45 . 1 . 1 4 4 LEU C C 13 177.900 0.3 . 1 . . . . A 4 LEU C . 30458 1 46 . 1 . 1 4 4 LEU CA C 13 58.418 0.3 . 1 . . . . A 4 LEU CA . 30458 1 47 . 1 . 1 4 4 LEU CB C 13 42.098 0.3 . 1 . . . . A 4 LEU CB . 30458 1 48 . 1 . 1 4 4 LEU CD1 C 13 25.427 0.3 . 1 . . . . A 4 LEU CD1 . 30458 1 49 . 1 . 1 4 4 LEU CD2 C 13 25.512 0.3 . 1 . . . . A 4 LEU CD2 . 30458 1 50 . 1 . 1 4 4 LEU N N 15 120.600 0.3 . 1 . . . . A 4 LEU N . 30458 1 51 . 1 . 1 5 5 LYS H H 1 7.907 0.020 . 1 . . . . A 5 LYS H . 30458 1 52 . 1 . 1 5 5 LYS HA H 1 3.899 0.020 . 1 . . . . A 5 LYS HA . 30458 1 53 . 1 . 1 5 5 LYS HB2 H 1 1.757 0.020 . 2 . . . . A 5 LYS HB2 . 30458 1 54 . 1 . 1 5 5 LYS HB3 H 1 1.798 0.020 . 2 . . . . A 5 LYS HB3 . 30458 1 55 . 1 . 1 5 5 LYS HG2 H 1 1.340 0.020 . 1 . . . . A 5 LYS HG2 . 30458 1 56 . 1 . 1 5 5 LYS HG3 H 1 1.340 0.020 . 1 . . . . A 5 LYS HG3 . 30458 1 57 . 1 . 1 5 5 LYS HD2 H 1 1.640 0.020 . 1 . . . . A 5 LYS HD2 . 30458 1 58 . 1 . 1 5 5 LYS HD3 H 1 1.640 0.020 . 1 . . . . A 5 LYS HD3 . 30458 1 59 . 1 . 1 5 5 LYS HE2 H 1 2.880 0.020 . 1 . . . . A 5 LYS HE2 . 30458 1 60 . 1 . 1 5 5 LYS HE3 H 1 2.880 0.020 . 1 . . . . A 5 LYS HE3 . 30458 1 61 . 1 . 1 5 5 LYS C C 13 178.864 0.3 . 1 . . . . A 5 LYS C . 30458 1 62 . 1 . 1 5 5 LYS CA C 13 59.829 0.3 . 1 . . . . A 5 LYS CA . 30458 1 63 . 1 . 1 5 5 LYS CB C 13 31.730 0.3 . 1 . . . . A 5 LYS CB . 30458 1 64 . 1 . 1 5 5 LYS CG C 13 24.910 0.3 . 1 . . . . A 5 LYS CG . 30458 1 65 . 1 . 1 5 5 LYS CD C 13 29.400 0.3 . 1 . . . . A 5 LYS CD . 30458 1 66 . 1 . 1 5 5 LYS CE C 13 41.946 0.3 . 1 . . . . A 5 LYS CE . 30458 1 67 . 1 . 1 5 5 LYS N N 15 117.781 0.3 . 1 . . . . A 5 LYS N . 30458 1 68 . 1 . 1 6 6 HIS H H 1 7.667 0.020 . 1 . . . . A 6 HIS H . 30458 1 69 . 1 . 1 6 6 HIS HA H 1 4.380 0.020 . 1 . . . . A 6 HIS HA . 30458 1 70 . 1 . 1 6 6 HIS HB2 H 1 3.125 0.020 . 1 . . . . A 6 HIS HB2 . 30458 1 71 . 1 . 1 6 6 HIS HB3 H 1 3.125 0.020 . 1 . . . . A 6 HIS HB3 . 30458 1 72 . 1 . 1 6 6 HIS HD2 H 1 6.901 0.020 . 1 . . . . A 6 HIS HD2 . 30458 1 73 . 1 . 1 6 6 HIS HE1 H 1 7.707 0.020 . 1 . . . . A 6 HIS HE1 . 30458 1 74 . 1 . 1 6 6 HIS C C 13 178.200 0.3 . 1 . . . . A 6 HIS C . 30458 1 75 . 1 . 1 6 6 HIS CA C 13 59.012 0.3 . 1 . . . . A 6 HIS CA . 30458 1 76 . 1 . 1 6 6 HIS CB C 13 30.931 0.3 . 1 . . . . A 6 HIS CB . 30458 1 77 . 1 . 1 6 6 HIS CD2 C 13 118.367 0.3 . 1 . . . . A 6 HIS CD2 . 30458 1 78 . 1 . 1 6 6 HIS CE1 C 13 138.962 0.3 . 1 . . . . A 6 HIS CE1 . 30458 1 79 . 1 . 1 6 6 HIS N N 15 118.129 0.3 . 1 . . . . A 6 HIS N . 30458 1 80 . 1 . 1 7 7 ILE H H 1 7.824 0.020 . 1 . . . . A 7 ILE H . 30458 1 81 . 1 . 1 7 7 ILE HA H 1 3.380 0.020 . 1 . . . . A 7 ILE HA . 30458 1 82 . 1 . 1 7 7 ILE HB H 1 2.035 0.020 . 1 . . . . A 7 ILE HB . 30458 1 83 . 1 . 1 7 7 ILE HG12 H 1 0.705 0.020 . 2 . . . . A 7 ILE HG12 . 30458 1 84 . 1 . 1 7 7 ILE HG13 H 1 1.885 0.020 . 2 . . . . A 7 ILE HG13 . 30458 1 85 . 1 . 1 7 7 ILE HG21 H 1 0.812 0.020 . 1 . . . . A 7 ILE HG21 . 30458 1 86 . 1 . 1 7 7 ILE HG22 H 1 0.812 0.020 . 1 . . . . A 7 ILE HG22 . 30458 1 87 . 1 . 1 7 7 ILE HG23 H 1 0.812 0.020 . 1 . . . . A 7 ILE HG23 . 30458 1 88 . 1 . 1 7 7 ILE HD11 H 1 1.010 0.020 . 1 . . . . A 7 ILE HD11 . 30458 1 89 . 1 . 1 7 7 ILE HD12 H 1 1.010 0.020 . 1 . . . . A 7 ILE HD12 . 30458 1 90 . 1 . 1 7 7 ILE HD13 H 1 1.010 0.020 . 1 . . . . A 7 ILE HD13 . 30458 1 91 . 1 . 1 7 7 ILE C C 13 176.500 0.3 . 1 . . . . A 7 ILE C . 30458 1 92 . 1 . 1 7 7 ILE CA C 13 66.075 0.3 . 1 . . . . A 7 ILE CA . 30458 1 93 . 1 . 1 7 7 ILE CB C 13 38.513 0.3 . 1 . . . . A 7 ILE CB . 30458 1 94 . 1 . 1 7 7 ILE CG1 C 13 30.746 0.3 . 1 . . . . A 7 ILE CG1 . 30458 1 95 . 1 . 1 7 7 ILE CG2 C 13 18.337 0.3 . 1 . . . . A 7 ILE CG2 . 30458 1 96 . 1 . 1 7 7 ILE CD1 C 13 14.542 0.3 . 1 . . . . A 7 ILE CD1 . 30458 1 97 . 1 . 1 7 7 ILE N N 15 120.386 0.3 . 1 . . . . A 7 ILE N . 30458 1 98 . 1 . 1 8 8 ILE H H 1 8.057 0.020 . 1 . . . . A 8 ILE H . 30458 1 99 . 1 . 1 8 8 ILE HA H 1 3.523 0.020 . 1 . . . . A 8 ILE HA . 30458 1 100 . 1 . 1 8 8 ILE HB H 1 1.799 0.020 . 1 . . . . A 8 ILE HB . 30458 1 101 . 1 . 1 8 8 ILE HG12 H 1 0.923 0.020 . 2 . . . . A 8 ILE HG12 . 30458 1 102 . 1 . 1 8 8 ILE HG13 H 1 1.703 0.020 . 2 . . . . A 8 ILE HG13 . 30458 1 103 . 1 . 1 8 8 ILE HG21 H 1 0.833 0.020 . 1 . . . . A 8 ILE HG21 . 30458 1 104 . 1 . 1 8 8 ILE HG22 H 1 0.833 0.020 . 1 . . . . A 8 ILE HG22 . 30458 1 105 . 1 . 1 8 8 ILE HG23 H 1 0.833 0.020 . 1 . . . . A 8 ILE HG23 . 30458 1 106 . 1 . 1 8 8 ILE HD11 H 1 0.697 0.020 . 1 . . . . A 8 ILE HD11 . 30458 1 107 . 1 . 1 8 8 ILE HD12 H 1 0.697 0.020 . 1 . . . . A 8 ILE HD12 . 30458 1 108 . 1 . 1 8 8 ILE HD13 H 1 0.697 0.020 . 1 . . . . A 8 ILE HD13 . 30458 1 109 . 1 . 1 8 8 ILE C C 13 178.000 0.3 . 1 . . . . A 8 ILE C . 30458 1 110 . 1 . 1 8 8 ILE CA C 13 65.976 0.3 . 1 . . . . A 8 ILE CA . 30458 1 111 . 1 . 1 8 8 ILE CB C 13 38.630 0.3 . 1 . . . . A 8 ILE CB . 30458 1 112 . 1 . 1 8 8 ILE CG1 C 13 30.116 0.3 . 1 . . . . A 8 ILE CG1 . 30458 1 113 . 1 . 1 8 8 ILE CG2 C 13 17.578 0.3 . 1 . . . . A 8 ILE CG2 . 30458 1 114 . 1 . 1 8 8 ILE CD1 C 13 14.418 0.3 . 1 . . . . A 8 ILE CD1 . 30458 1 115 . 1 . 1 8 8 ILE N N 15 119.765 0.3 . 1 . . . . A 8 ILE N . 30458 1 116 . 1 . 1 9 9 THR H H 1 8.148 0.020 . 1 . . . . A 9 THR H . 30458 1 117 . 1 . 1 9 9 THR HA H 1 3.833 0.020 . 1 . . . . A 9 THR HA . 30458 1 118 . 1 . 1 9 9 THR HB H 1 4.146 0.020 . 1 . . . . A 9 THR HB . 30458 1 119 . 1 . 1 9 9 THR HG21 H 1 1.180 0.020 . 1 . . . . A 9 THR HG21 . 30458 1 120 . 1 . 1 9 9 THR HG22 H 1 1.180 0.020 . 1 . . . . A 9 THR HG22 . 30458 1 121 . 1 . 1 9 9 THR HG23 H 1 1.180 0.020 . 1 . . . . A 9 THR HG23 . 30458 1 122 . 1 . 1 9 9 THR C C 13 176.300 0.3 . 1 . . . . A 9 THR C . 30458 1 123 . 1 . 1 9 9 THR CA C 13 66.988 0.3 . 1 . . . . A 9 THR CA . 30458 1 124 . 1 . 1 9 9 THR CB C 13 69.057 0.3 . 1 . . . . A 9 THR CB . 30458 1 125 . 1 . 1 9 9 THR CG2 C 13 21.645 0.3 . 1 . . . . A 9 THR CG2 . 30458 1 126 . 1 . 1 9 9 THR N N 15 115.105 0.3 . 1 . . . . A 9 THR N . 30458 1 127 . 1 . 1 10 10 LEU H H 1 7.945 0.020 . 1 . . . . A 10 LEU H . 30458 1 128 . 1 . 1 10 10 LEU HA H 1 4.050 0.020 . 1 . . . . A 10 LEU HA . 30458 1 129 . 1 . 1 10 10 LEU HB2 H 1 1.684 0.020 . 2 . . . . A 10 LEU HB2 . 30458 1 130 . 1 . 1 10 10 LEU HB3 H 1 1.573 0.020 . 2 . . . . A 10 LEU HB3 . 30458 1 131 . 1 . 1 10 10 LEU HG H 1 1.427 0.020 . 1 . . . . A 10 LEU HG . 30458 1 132 . 1 . 1 10 10 LEU HD11 H 1 0.793 0.020 . 1 . . . . A 10 LEU HD11 . 30458 1 133 . 1 . 1 10 10 LEU HD12 H 1 0.793 0.020 . 1 . . . . A 10 LEU HD12 . 30458 1 134 . 1 . 1 10 10 LEU HD13 H 1 0.793 0.020 . 1 . . . . A 10 LEU HD13 . 30458 1 135 . 1 . 1 10 10 LEU HD21 H 1 0.748 0.020 . 1 . . . . A 10 LEU HD21 . 30458 1 136 . 1 . 1 10 10 LEU HD22 H 1 0.748 0.020 . 1 . . . . A 10 LEU HD22 . 30458 1 137 . 1 . 1 10 10 LEU HD23 H 1 0.748 0.020 . 1 . . . . A 10 LEU HD23 . 30458 1 138 . 1 . 1 10 10 LEU C C 13 178.800 0.3 . 1 . . . . A 10 LEU C . 30458 1 139 . 1 . 1 10 10 LEU CA C 13 57.900 0.3 . 1 . . . . A 10 LEU CA . 30458 1 140 . 1 . 1 10 10 LEU CB C 13 42.157 0.3 . 1 . . . . A 10 LEU CB . 30458 1 141 . 1 . 1 10 10 LEU CG C 13 27.434 0.3 . 1 . . . . A 10 LEU CG . 30458 1 142 . 1 . 1 10 10 LEU CD1 C 13 23.679 0.3 . 1 . . . . A 10 LEU CD1 . 30458 1 143 . 1 . 1 10 10 LEU CD2 C 13 26.398 0.3 . 1 . . . . A 10 LEU CD2 . 30458 1 144 . 1 . 1 10 10 LEU N N 15 121.950 0.3 . 1 . . . . A 10 LEU N . 30458 1 145 . 1 . 1 11 11 GLY H H 1 8.552 0.020 . 1 . . . . A 11 GLY H . 30458 1 146 . 1 . 1 11 11 GLY HA2 H 1 3.472 0.020 . 2 . . . . A 11 GLY HA2 . 30458 1 147 . 1 . 1 11 11 GLY HA3 H 1 3.540 0.020 . 2 . . . . A 11 GLY HA3 . 30458 1 148 . 1 . 1 11 11 GLY C C 13 174.700 0.3 . 1 . . . . A 11 GLY C . 30458 1 149 . 1 . 1 11 11 GLY CA C 13 47.650 0.3 . 1 . . . . A 11 GLY CA . 30458 1 150 . 1 . 1 11 11 GLY N N 15 105.513 0.3 . 1 . . . . A 11 GLY N . 30458 1 151 . 1 . 1 12 12 GLN H H 1 7.994 0.020 . 1 . . . . A 12 GLN H . 30458 1 152 . 1 . 1 12 12 GLN HA H 1 3.948 0.020 . 1 . . . . A 12 GLN HA . 30458 1 153 . 1 . 1 12 12 GLN HB2 H 1 1.974 0.020 . 2 . . . . A 12 GLN HB2 . 30458 1 154 . 1 . 1 12 12 GLN HB3 H 1 2.347 0.020 . 2 . . . . A 12 GLN HB3 . 30458 1 155 . 1 . 1 12 12 GLN HG2 H 1 2.271 0.020 . 2 . . . . A 12 GLN HG2 . 30458 1 156 . 1 . 1 12 12 GLN HG3 H 1 2.584 0.020 . 2 . . . . A 12 GLN HG3 . 30458 1 157 . 1 . 1 12 12 GLN HE21 H 1 7.171 0.020 . 1 . . . . A 12 GLN HE21 . 30458 1 158 . 1 . 1 12 12 GLN HE22 H 1 6.598 0.020 . 1 . . . . A 12 GLN HE22 . 30458 1 159 . 1 . 1 12 12 GLN C C 13 179.600 0.3 . 1 . . . . A 12 GLN C . 30458 1 160 . 1 . 1 12 12 GLN CA C 13 59.694 0.3 . 1 . . . . A 12 GLN CA . 30458 1 161 . 1 . 1 12 12 GLN CB C 13 27.893 0.3 . 1 . . . . A 12 GLN CB . 30458 1 162 . 1 . 1 12 12 GLN CG C 13 34.008 0.3 . 1 . . . . A 12 GLN CG . 30458 1 163 . 1 . 1 12 12 GLN N N 15 119.570 0.3 . 1 . . . . A 12 GLN N . 30458 1 164 . 1 . 1 12 12 GLN NE2 N 15 110.582 0.3 . 1 . . . . A 12 GLN NE2 . 30458 1 165 . 1 . 1 13 13 VAL H H 1 8.358 0.020 . 1 . . . . A 13 VAL H . 30458 1 166 . 1 . 1 13 13 VAL HA H 1 3.629 0.020 . 1 . . . . A 13 VAL HA . 30458 1 167 . 1 . 1 13 13 VAL HB H 1 2.286 0.020 . 1 . . . . A 13 VAL HB . 30458 1 168 . 1 . 1 13 13 VAL HG11 H 1 0.888 0.020 . 1 . . . . A 13 VAL HG11 . 30458 1 169 . 1 . 1 13 13 VAL HG12 H 1 0.888 0.020 . 1 . . . . A 13 VAL HG12 . 30458 1 170 . 1 . 1 13 13 VAL HG13 H 1 0.888 0.020 . 1 . . . . A 13 VAL HG13 . 30458 1 171 . 1 . 1 13 13 VAL HG21 H 1 1.024 0.020 . 1 . . . . A 13 VAL HG21 . 30458 1 172 . 1 . 1 13 13 VAL HG22 H 1 1.024 0.020 . 1 . . . . A 13 VAL HG22 . 30458 1 173 . 1 . 1 13 13 VAL HG23 H 1 1.024 0.020 . 1 . . . . A 13 VAL HG23 . 30458 1 174 . 1 . 1 13 13 VAL C C 13 178.500 0.3 . 1 . . . . A 13 VAL C . 30458 1 175 . 1 . 1 13 13 VAL CA C 13 66.829 0.3 . 1 . . . . A 13 VAL CA . 30458 1 176 . 1 . 1 13 13 VAL CB C 13 31.847 0.3 . 1 . . . . A 13 VAL CB . 30458 1 177 . 1 . 1 13 13 VAL CG1 C 13 20.850 0.3 . 1 . . . . A 13 VAL CG1 . 30458 1 178 . 1 . 1 13 13 VAL CG2 C 13 23.189 0.3 . 1 . . . . A 13 VAL CG2 . 30458 1 179 . 1 . 1 13 13 VAL N N 15 122.707 0.3 . 1 . . . . A 13 VAL N . 30458 1 180 . 1 . 1 14 14 ILE H H 1 8.476 0.020 . 1 . . . . A 14 ILE H . 30458 1 181 . 1 . 1 14 14 ILE HA H 1 3.430 0.020 . 1 . . . . A 14 ILE HA . 30458 1 182 . 1 . 1 14 14 ILE HB H 1 1.929 0.020 . 1 . . . . A 14 ILE HB . 30458 1 183 . 1 . 1 14 14 ILE HG12 H 1 0.790 0.020 . 2 . . . . A 14 ILE HG12 . 30458 1 184 . 1 . 1 14 14 ILE HG13 H 1 1.731 0.020 . 2 . . . . A 14 ILE HG13 . 30458 1 185 . 1 . 1 14 14 ILE HG21 H 1 0.647 0.020 . 1 . . . . A 14 ILE HG21 . 30458 1 186 . 1 . 1 14 14 ILE HG22 H 1 0.647 0.020 . 1 . . . . A 14 ILE HG22 . 30458 1 187 . 1 . 1 14 14 ILE HG23 H 1 0.647 0.020 . 1 . . . . A 14 ILE HG23 . 30458 1 188 . 1 . 1 14 14 ILE HD11 H 1 0.780 0.020 . 1 . . . . A 14 ILE HD11 . 30458 1 189 . 1 . 1 14 14 ILE HD12 H 1 0.780 0.020 . 1 . . . . A 14 ILE HD12 . 30458 1 190 . 1 . 1 14 14 ILE HD13 H 1 0.780 0.020 . 1 . . . . A 14 ILE HD13 . 30458 1 191 . 1 . 1 14 14 ILE C C 13 177.700 0.3 . 1 . . . . A 14 ILE C . 30458 1 192 . 1 . 1 14 14 ILE CA C 13 65.967 0.3 . 1 . . . . A 14 ILE CA . 30458 1 193 . 1 . 1 14 14 ILE CB C 13 38.130 0.3 . 1 . . . . A 14 ILE CB . 30458 1 194 . 1 . 1 14 14 ILE CG1 C 13 30.209 0.3 . 1 . . . . A 14 ILE CG1 . 30458 1 195 . 1 . 1 14 14 ILE CG2 C 13 17.058 0.3 . 1 . . . . A 14 ILE CG2 . 30458 1 196 . 1 . 1 14 14 ILE CD1 C 13 16.056 0.3 . 1 . . . . A 14 ILE CD1 . 30458 1 197 . 1 . 1 14 14 ILE N N 15 121.008 0.3 . 1 . . . . A 14 ILE N . 30458 1 198 . 1 . 1 15 15 HIS H H 1 8.196 0.020 . 1 . . . . A 15 HIS H . 30458 1 199 . 1 . 1 15 15 HIS HA H 1 3.853 0.020 . 1 . . . . A 15 HIS HA . 30458 1 200 . 1 . 1 15 15 HIS HB2 H 1 3.098 0.020 . 1 . . . . A 15 HIS HB2 . 30458 1 201 . 1 . 1 15 15 HIS HB3 H 1 3.098 0.020 . 1 . . . . A 15 HIS HB3 . 30458 1 202 . 1 . 1 15 15 HIS HD2 H 1 6.724 0.020 . 1 . . . . A 15 HIS HD2 . 30458 1 203 . 1 . 1 15 15 HIS HE1 H 1 7.527 0.020 . 1 . . . . A 15 HIS HE1 . 30458 1 204 . 1 . 1 15 15 HIS C C 13 176.200 0.3 . 1 . . . . A 15 HIS C . 30458 1 205 . 1 . 1 15 15 HIS CA C 13 61.473 0.3 . 1 . . . . A 15 HIS CA . 30458 1 206 . 1 . 1 15 15 HIS CB C 13 30.177 0.3 . 1 . . . . A 15 HIS CB . 30458 1 207 . 1 . 1 15 15 HIS CD2 C 13 121.488 0.3 . 1 . . . . A 15 HIS CD2 . 30458 1 208 . 1 . 1 15 15 HIS CE1 C 13 137.968 0.3 . 1 . . . . A 15 HIS CE1 . 30458 1 209 . 1 . 1 15 15 HIS N N 15 118.872 0.3 . 1 . . . . A 15 HIS N . 30458 1 210 . 1 . 1 16 16 LYS H H 1 7.783 0.020 . 1 . . . . A 16 LYS H . 30458 1 211 . 1 . 1 16 16 LYS HA H 1 3.625 0.020 . 1 . . . . A 16 LYS HA . 30458 1 212 . 1 . 1 16 16 LYS HB2 H 1 1.864 0.020 . 1 . . . . A 16 LYS HB2 . 30458 1 213 . 1 . 1 16 16 LYS HB3 H 1 1.864 0.020 . 1 . . . . A 16 LYS HB3 . 30458 1 214 . 1 . 1 16 16 LYS HG2 H 1 1.338 0.020 . 2 . . . . A 16 LYS HG2 . 30458 1 215 . 1 . 1 16 16 LYS HG3 H 1 1.436 0.020 . 2 . . . . A 16 LYS HG3 . 30458 1 216 . 1 . 1 16 16 LYS HD2 H 1 1.591 0.020 . 1 . . . . A 16 LYS HD2 . 30458 1 217 . 1 . 1 16 16 LYS HD3 H 1 1.591 0.020 . 1 . . . . A 16 LYS HD3 . 30458 1 218 . 1 . 1 16 16 LYS HE2 H 1 2.925 0.020 . 1 . . . . A 16 LYS HE2 . 30458 1 219 . 1 . 1 16 16 LYS HE3 H 1 2.925 0.020 . 1 . . . . A 16 LYS HE3 . 30458 1 220 . 1 . 1 16 16 LYS C C 13 179.200 0.3 . 1 . . . . A 16 LYS C . 30458 1 221 . 1 . 1 16 16 LYS CA C 13 59.607 0.3 . 1 . . . . A 16 LYS CA . 30458 1 222 . 1 . 1 16 16 LYS CB C 13 32.270 0.3 . 1 . . . . A 16 LYS CB . 30458 1 223 . 1 . 1 16 16 LYS CG C 13 25.097 0.3 . 1 . . . . A 16 LYS CG . 30458 1 224 . 1 . 1 16 16 LYS CD C 13 28.945 0.3 . 1 . . . . A 16 LYS CD . 30458 1 225 . 1 . 1 16 16 LYS CE C 13 41.867 0.3 . 1 . . . . A 16 LYS CE . 30458 1 226 . 1 . 1 16 16 LYS N N 15 118.417 0.3 . 1 . . . . A 16 LYS N . 30458 1 227 . 1 . 1 17 17 ARG H H 1 8.340 0.020 . 1 . . . . A 17 ARG H . 30458 1 228 . 1 . 1 17 17 ARG HA H 1 3.918 0.020 . 1 . . . . A 17 ARG HA . 30458 1 229 . 1 . 1 17 17 ARG HB2 H 1 1.814 0.020 . 2 . . . . A 17 ARG HB2 . 30458 1 230 . 1 . 1 17 17 ARG HB3 H 1 1.911 0.020 . 2 . . . . A 17 ARG HB3 . 30458 1 231 . 1 . 1 17 17 ARG HG2 H 1 1.649 0.020 . 2 . . . . A 17 ARG HG2 . 30458 1 232 . 1 . 1 17 17 ARG HG3 H 1 1.842 0.020 . 2 . . . . A 17 ARG HG3 . 30458 1 233 . 1 . 1 17 17 ARG HD2 H 1 3.176 0.020 . 1 . . . . A 17 ARG HD2 . 30458 1 234 . 1 . 1 17 17 ARG HD3 H 1 3.176 0.020 . 1 . . . . A 17 ARG HD3 . 30458 1 235 . 1 . 1 17 17 ARG C C 13 180.600 0.3 . 1 . . . . A 17 ARG C . 30458 1 236 . 1 . 1 17 17 ARG CA C 13 59.333 0.3 . 1 . . . . A 17 ARG CA . 30458 1 237 . 1 . 1 17 17 ARG CB C 13 30.350 0.3 . 1 . . . . A 17 ARG CB . 30458 1 238 . 1 . 1 17 17 ARG CG C 13 27.594 0.3 . 1 . . . . A 17 ARG CG . 30458 1 239 . 1 . 1 17 17 ARG CD C 13 43.591 0.3 . 1 . . . . A 17 ARG CD . 30458 1 240 . 1 . 1 17 17 ARG N N 15 117.621 0.3 . 1 . . . . A 17 ARG N . 30458 1 241 . 1 . 1 18 18 CYS H H 1 8.526 0.020 . 1 . . . . A 18 CYS H . 30458 1 242 . 1 . 1 18 18 CYS HA H 1 3.852 0.020 . 1 . . . . A 18 CYS HA . 30458 1 243 . 1 . 1 18 18 CYS HB2 H 1 2.528 0.020 . 2 . . . . A 18 CYS HB2 . 30458 1 244 . 1 . 1 18 18 CYS HB3 H 1 3.037 0.020 . 2 . . . . A 18 CYS HB3 . 30458 1 245 . 1 . 1 18 18 CYS C C 13 177.300 0.3 . 1 . . . . A 18 CYS C . 30458 1 246 . 1 . 1 18 18 CYS CA C 13 66.005 0.3 . 1 . . . . A 18 CYS CA . 30458 1 247 . 1 . 1 18 18 CYS CB C 13 27.690 0.3 . 1 . . . . A 18 CYS CB . 30458 1 248 . 1 . 1 18 18 CYS N N 15 118.030 0.3 . 1 . . . . A 18 CYS N . 30458 1 249 . 1 . 1 19 19 GLU H H 1 7.504 0.020 . 1 . . . . A 19 GLU H . 30458 1 250 . 1 . 1 19 19 GLU HA H 1 3.773 0.020 . 1 . . . . A 19 GLU HA . 30458 1 251 . 1 . 1 19 19 GLU HB2 H 1 1.899 0.020 . 2 . . . . A 19 GLU HB2 . 30458 1 252 . 1 . 1 19 19 GLU HB3 H 1 1.953 0.020 . 2 . . . . A 19 GLU HB3 . 30458 1 253 . 1 . 1 19 19 GLU HG2 H 1 1.879 0.020 . 2 . . . . A 19 GLU HG2 . 30458 1 254 . 1 . 1 19 19 GLU HG3 H 1 1.910 0.020 . 2 . . . . A 19 GLU HG3 . 30458 1 255 . 1 . 1 19 19 GLU C C 13 177.100 0.3 . 1 . . . . A 19 GLU C . 30458 1 256 . 1 . 1 19 19 GLU CA C 13 58.432 0.3 . 1 . . . . A 19 GLU CA . 30458 1 257 . 1 . 1 19 19 GLU CB C 13 29.450 0.3 . 1 . . . . A 19 GLU CB . 30458 1 258 . 1 . 1 19 19 GLU CG C 13 36.430 0.3 . 1 . . . . A 19 GLU CG . 30458 1 259 . 1 . 1 19 19 GLU N N 15 117.871 0.3 . 1 . . . . A 19 GLU N . 30458 1 260 . 1 . 1 20 20 GLU H H 1 7.171 0.020 . 1 . . . . A 20 GLU H . 30458 1 261 . 1 . 1 20 20 GLU HA H 1 4.179 0.020 . 1 . . . . A 20 GLU HA . 30458 1 262 . 1 . 1 20 20 GLU HB2 H 1 1.907 0.020 . 2 . . . . A 20 GLU HB2 . 30458 1 263 . 1 . 1 20 20 GLU HB3 H 1 2.046 0.020 . 2 . . . . A 20 GLU HB3 . 30458 1 264 . 1 . 1 20 20 GLU HG2 H 1 2.175 0.020 . 2 . . . . A 20 GLU HG2 . 30458 1 265 . 1 . 1 20 20 GLU HG3 H 1 2.391 0.020 . 2 . . . . A 20 GLU HG3 . 30458 1 266 . 1 . 1 20 20 GLU C C 13 177.100 0.3 . 1 . . . . A 20 GLU C . 30458 1 267 . 1 . 1 20 20 GLU CA C 13 56.057 0.3 . 1 . . . . A 20 GLU CA . 30458 1 268 . 1 . 1 20 20 GLU CB C 13 30.449 0.3 . 1 . . . . A 20 GLU CB . 30458 1 269 . 1 . 1 20 20 GLU CG C 13 36.212 0.3 . 1 . . . . A 20 GLU CG . 30458 1 270 . 1 . 1 20 20 GLU N N 15 115.294 0.3 . 1 . . . . A 20 GLU N . 30458 1 271 . 1 . 1 21 21 MET H H 1 6.921 0.020 . 1 . . . . A 21 MET H . 30458 1 272 . 1 . 1 21 21 MET HA H 1 4.200 0.020 . 1 . . . . A 21 MET HA . 30458 1 273 . 1 . 1 21 21 MET HB2 H 1 2.321 0.020 . 1 . . . . A 21 MET HB2 . 30458 1 274 . 1 . 1 21 21 MET HB3 H 1 2.321 0.020 . 1 . . . . A 21 MET HB3 . 30458 1 275 . 1 . 1 21 21 MET HG2 H 1 2.902 0.020 . 2 . . . . A 21 MET HG2 . 30458 1 276 . 1 . 1 21 21 MET HG3 H 1 2.950 0.020 . 2 . . . . A 21 MET HG3 . 30458 1 277 . 1 . 1 21 21 MET HE1 H 1 2.167 0.020 . 1 . . . . A 21 MET HE1 . 30458 1 278 . 1 . 1 21 21 MET HE2 H 1 2.167 0.020 . 1 . . . . A 21 MET HE2 . 30458 1 279 . 1 . 1 21 21 MET HE3 H 1 2.167 0.020 . 1 . . . . A 21 MET HE3 . 30458 1 280 . 1 . 1 21 21 MET C C 13 177.800 0.3 . 1 . . . . A 21 MET C . 30458 1 281 . 1 . 1 21 21 MET CA C 13 56.325 0.3 . 1 . . . . A 21 MET CA . 30458 1 282 . 1 . 1 21 21 MET CB C 13 33.103 0.3 . 1 . . . . A 21 MET CB . 30458 1 283 . 1 . 1 21 21 MET CG C 13 33.252 0.3 . 1 . . . . A 21 MET CG . 30458 1 284 . 1 . 1 21 21 MET CE C 13 18.509 0.3 . 1 . . . . A 21 MET CE . 30458 1 285 . 1 . 1 21 21 MET N N 15 120.428 0.3 . 1 . . . . A 21 MET N . 30458 1 286 . 1 . 1 22 22 LYS H H 1 8.750 0.020 . 1 . . . . A 22 LYS H . 30458 1 287 . 1 . 1 22 22 LYS HA H 1 3.903 0.020 . 1 . . . . A 22 LYS HA . 30458 1 288 . 1 . 1 22 22 LYS HB2 H 1 1.078 0.020 . 2 . . . . A 22 LYS HB2 . 30458 1 289 . 1 . 1 22 22 LYS HB3 H 1 1.253 0.020 . 2 . . . . A 22 LYS HB3 . 30458 1 290 . 1 . 1 22 22 LYS HG2 H 1 1.135 0.020 . 2 . . . . A 22 LYS HG2 . 30458 1 291 . 1 . 1 22 22 LYS HG3 H 1 1.329 0.020 . 2 . . . . A 22 LYS HG3 . 30458 1 292 . 1 . 1 22 22 LYS HD2 H 1 1.544 0.020 . 1 . . . . A 22 LYS HD2 . 30458 1 293 . 1 . 1 22 22 LYS HD3 H 1 1.544 0.020 . 1 . . . . A 22 LYS HD3 . 30458 1 294 . 1 . 1 22 22 LYS HE2 H 1 2.928 0.020 . 1 . . . . A 22 LYS HE2 . 30458 1 295 . 1 . 1 22 22 LYS HE3 H 1 2.928 0.020 . 1 . . . . A 22 LYS HE3 . 30458 1 296 . 1 . 1 22 22 LYS C C 13 175.400 0.3 . 1 . . . . A 22 LYS C . 30458 1 297 . 1 . 1 22 22 LYS CA C 13 57.239 0.3 . 1 . . . . A 22 LYS CA . 30458 1 298 . 1 . 1 22 22 LYS CB C 13 33.659 0.3 . 1 . . . . A 22 LYS CB . 30458 1 299 . 1 . 1 22 22 LYS CG C 13 25.153 0.3 . 1 . . . . A 22 LYS CG . 30458 1 300 . 1 . 1 22 22 LYS CD C 13 29.428 0.3 . 1 . . . . A 22 LYS CD . 30458 1 301 . 1 . 1 22 22 LYS CE C 13 42.235 0.3 . 1 . . . . A 22 LYS CE . 30458 1 302 . 1 . 1 22 22 LYS N N 15 120.445 0.3 . 1 . . . . A 22 LYS N . 30458 1 303 . 1 . 1 23 23 TYR H H 1 7.272 0.020 . 1 . . . . A 23 TYR H . 30458 1 304 . 1 . 1 23 23 TYR HA H 1 4.843 0.020 . 1 . . . . A 23 TYR HA . 30458 1 305 . 1 . 1 23 23 TYR HB2 H 1 2.745 0.020 . 2 . . . . A 23 TYR HB2 . 30458 1 306 . 1 . 1 23 23 TYR HB3 H 1 3.162 0.020 . 2 . . . . A 23 TYR HB3 . 30458 1 307 . 1 . 1 23 23 TYR HD1 H 1 7.174 0.020 . 1 . . . . A 23 TYR HD1 . 30458 1 308 . 1 . 1 23 23 TYR HD2 H 1 7.174 0.020 . 1 . . . . A 23 TYR HD2 . 30458 1 309 . 1 . 1 23 23 TYR HE1 H 1 6.849 0.020 . 1 . . . . A 23 TYR HE1 . 30458 1 310 . 1 . 1 23 23 TYR HE2 H 1 6.849 0.020 . 1 . . . . A 23 TYR HE2 . 30458 1 311 . 1 . 1 23 23 TYR C C 13 173.700 0.3 . 1 . . . . A 23 TYR C . 30458 1 312 . 1 . 1 23 23 TYR CA C 13 55.219 0.3 . 1 . . . . A 23 TYR CA . 30458 1 313 . 1 . 1 23 23 TYR CB C 13 41.987 0.3 . 1 . . . . A 23 TYR CB . 30458 1 314 . 1 . 1 23 23 TYR CD1 C 13 133.735 0.3 . 1 . . . . A 23 TYR CD1 . 30458 1 315 . 1 . 1 23 23 TYR CE1 C 13 118.138 0.3 . 1 . . . . A 23 TYR CE1 . 30458 1 316 . 1 . 1 23 23 TYR N N 15 115.487 0.3 . 1 . . . . A 23 TYR N . 30458 1 317 . 1 . 1 24 24 CYS H H 1 8.677 0.020 . 1 . . . . A 24 CYS H . 30458 1 318 . 1 . 1 24 24 CYS HA H 1 3.662 0.020 . 1 . . . . A 24 CYS HA . 30458 1 319 . 1 . 1 24 24 CYS HB2 H 1 2.781 0.020 . 2 . . . . A 24 CYS HB2 . 30458 1 320 . 1 . 1 24 24 CYS HB3 H 1 2.861 0.020 . 2 . . . . A 24 CYS HB3 . 30458 1 321 . 1 . 1 24 24 CYS C C 13 174.700 0.3 . 1 . . . . A 24 CYS C . 30458 1 322 . 1 . 1 24 24 CYS CA C 13 60.571 0.3 . 1 . . . . A 24 CYS CA . 30458 1 323 . 1 . 1 24 24 CYS CB C 13 26.102 0.3 . 1 . . . . A 24 CYS CB . 30458 1 324 . 1 . 1 24 24 CYS N N 15 113.360 0.3 . 1 . . . . A 24 CYS N . 30458 1 325 . 1 . 1 25 25 LYS H H 1 8.026 0.020 . 1 . . . . A 25 LYS H . 30458 1 326 . 1 . 1 25 25 LYS HA H 1 3.549 0.020 . 1 . . . . A 25 LYS HA . 30458 1 327 . 1 . 1 25 25 LYS HB2 H 1 1.619 0.020 . 1 . . . . A 25 LYS HB2 . 30458 1 328 . 1 . 1 25 25 LYS HB3 H 1 1.619 0.020 . 1 . . . . A 25 LYS HB3 . 30458 1 329 . 1 . 1 25 25 LYS HG2 H 1 1.056 0.020 . 2 . . . . A 25 LYS HG2 . 30458 1 330 . 1 . 1 25 25 LYS HG3 H 1 1.176 0.020 . 2 . . . . A 25 LYS HG3 . 30458 1 331 . 1 . 1 25 25 LYS HD2 H 1 1.650 0.020 . 1 . . . . A 25 LYS HD2 . 30458 1 332 . 1 . 1 25 25 LYS HD3 H 1 1.650 0.020 . 1 . . . . A 25 LYS HD3 . 30458 1 333 . 1 . 1 25 25 LYS HE2 H 1 2.896 0.020 . 1 . . . . A 25 LYS HE2 . 30458 1 334 . 1 . 1 25 25 LYS HE3 H 1 2.896 0.020 . 1 . . . . A 25 LYS HE3 . 30458 1 335 . 1 . 1 25 25 LYS C C 13 179.800 0.3 . 1 . . . . A 25 LYS C . 30458 1 336 . 1 . 1 25 25 LYS CA C 13 60.734 0.3 . 1 . . . . A 25 LYS CA . 30458 1 337 . 1 . 1 25 25 LYS CB C 13 33.447 0.3 . 1 . . . . A 25 LYS CB . 30458 1 338 . 1 . 1 25 25 LYS CG C 13 25.838 0.3 . 1 . . . . A 25 LYS CG . 30458 1 339 . 1 . 1 25 25 LYS CD C 13 29.458 0.3 . 1 . . . . A 25 LYS CD . 30458 1 340 . 1 . 1 25 25 LYS CE C 13 41.821 0.3 . 1 . . . . A 25 LYS CE . 30458 1 341 . 1 . 1 25 25 LYS N N 15 115.689 0.3 . 1 . . . . A 25 LYS N . 30458 1 342 . 1 . 1 26 26 LYS H H 1 10.578 0.020 . 1 . . . . A 26 LYS H . 30458 1 343 . 1 . 1 26 26 LYS HA H 1 3.946 0.020 . 1 . . . . A 26 LYS HA . 30458 1 344 . 1 . 1 26 26 LYS HB2 H 1 1.661 0.020 . 2 . . . . A 26 LYS HB2 . 30458 1 345 . 1 . 1 26 26 LYS HB3 H 1 2.109 0.020 . 2 . . . . A 26 LYS HB3 . 30458 1 346 . 1 . 1 26 26 LYS HG2 H 1 1.430 0.020 . 1 . . . . A 26 LYS HG2 . 30458 1 347 . 1 . 1 26 26 LYS HG3 H 1 1.430 0.020 . 1 . . . . A 26 LYS HG3 . 30458 1 348 . 1 . 1 26 26 LYS HD2 H 1 1.572 0.020 . 1 . . . . A 26 LYS HD2 . 30458 1 349 . 1 . 1 26 26 LYS HD3 H 1 1.572 0.020 . 1 . . . . A 26 LYS HD3 . 30458 1 350 . 1 . 1 26 26 LYS HE2 H 1 2.854 0.020 . 1 . . . . A 26 LYS HE2 . 30458 1 351 . 1 . 1 26 26 LYS HE3 H 1 2.854 0.020 . 1 . . . . A 26 LYS HE3 . 30458 1 352 . 1 . 1 26 26 LYS C C 13 181.300 0.3 . 1 . . . . A 26 LYS C . 30458 1 353 . 1 . 1 26 26 LYS CA C 13 59.271 0.3 . 1 . . . . A 26 LYS CA . 30458 1 354 . 1 . 1 26 26 LYS CB C 13 30.205 0.3 . 1 . . . . A 26 LYS CB . 30458 1 355 . 1 . 1 26 26 LYS CG C 13 24.720 0.3 . 1 . . . . A 26 LYS CG . 30458 1 356 . 1 . 1 26 26 LYS CD C 13 27.817 0.3 . 1 . . . . A 26 LYS CD . 30458 1 357 . 1 . 1 26 26 LYS CE C 13 41.881 0.3 . 1 . . . . A 26 LYS CE . 30458 1 358 . 1 . 1 26 26 LYS N N 15 120.745 0.3 . 1 . . . . A 26 LYS N . 30458 1 359 . 1 . 1 27 27 GLN H H 1 9.886 0.020 . 1 . . . . A 27 GLN H . 30458 1 360 . 1 . 1 27 27 GLN HA H 1 3.900 0.020 . 1 . . . . A 27 GLN HA . 30458 1 361 . 1 . 1 27 27 GLN HB2 H 1 2.026 0.020 . 2 . . . . A 27 GLN HB2 . 30458 1 362 . 1 . 1 27 27 GLN HB3 H 1 2.333 0.020 . 2 . . . . A 27 GLN HB3 . 30458 1 363 . 1 . 1 27 27 GLN HG2 H 1 1.963 0.020 . 2 . . . . A 27 GLN HG2 . 30458 1 364 . 1 . 1 27 27 GLN HG3 H 1 2.162 0.020 . 2 . . . . A 27 GLN HG3 . 30458 1 365 . 1 . 1 27 27 GLN HE21 H 1 9.237 0.020 . 1 . . . . A 27 GLN HE21 . 30458 1 366 . 1 . 1 27 27 GLN HE22 H 1 7.095 0.020 . 1 . . . . A 27 GLN HE22 . 30458 1 367 . 1 . 1 27 27 GLN C C 13 180.200 0.3 . 1 . . . . A 27 GLN C . 30458 1 368 . 1 . 1 27 27 GLN CA C 13 59.456 0.3 . 1 . . . . A 27 GLN CA . 30458 1 369 . 1 . 1 27 27 GLN CB C 13 32.422 0.3 . 1 . . . . A 27 GLN CB . 30458 1 370 . 1 . 1 27 27 GLN CG C 13 33.630 0.3 . 1 . . . . A 27 GLN CG . 30458 1 371 . 1 . 1 27 27 GLN N N 15 120.418 0.3 . 1 . . . . A 27 GLN N . 30458 1 372 . 1 . 1 27 27 GLN NE2 N 15 111.792 0.3 . 1 . . . . A 27 GLN NE2 . 30458 1 373 . 1 . 1 28 28 CYS H H 1 8.537 0.020 . 1 . . . . A 28 CYS H . 30458 1 374 . 1 . 1 28 28 CYS HA H 1 4.170 0.020 . 1 . . . . A 28 CYS HA . 30458 1 375 . 1 . 1 28 28 CYS HB2 H 1 2.735 0.020 . 2 . . . . A 28 CYS HB2 . 30458 1 376 . 1 . 1 28 28 CYS HB3 H 1 2.893 0.020 . 2 . . . . A 28 CYS HB3 . 30458 1 377 . 1 . 1 28 28 CYS C C 13 176.200 0.3 . 1 . . . . A 28 CYS C . 30458 1 378 . 1 . 1 28 28 CYS CA C 13 64.503 0.3 . 1 . . . . A 28 CYS CA . 30458 1 379 . 1 . 1 28 28 CYS CB C 13 26.838 0.3 . 1 . . . . A 28 CYS CB . 30458 1 380 . 1 . 1 28 28 CYS N N 15 118.861 0.3 . 1 . . . . A 28 CYS N . 30458 1 381 . 1 . 1 29 29 ARG H H 1 8.680 0.020 . 1 . . . . A 29 ARG H . 30458 1 382 . 1 . 1 29 29 ARG HA H 1 3.828 0.020 . 1 . . . . A 29 ARG HA . 30458 1 383 . 1 . 1 29 29 ARG HB2 H 1 1.799 0.020 . 1 . . . . A 29 ARG HB2 . 30458 1 384 . 1 . 1 29 29 ARG HB3 H 1 1.799 0.020 . 1 . . . . A 29 ARG HB3 . 30458 1 385 . 1 . 1 29 29 ARG HG2 H 1 1.434 0.020 . 1 . . . . A 29 ARG HG2 . 30458 1 386 . 1 . 1 29 29 ARG HG3 H 1 1.434 0.020 . 1 . . . . A 29 ARG HG3 . 30458 1 387 . 1 . 1 29 29 ARG HD2 H 1 2.987 0.020 . 2 . . . . A 29 ARG HD2 . 30458 1 388 . 1 . 1 29 29 ARG HD3 H 1 3.079 0.020 . 2 . . . . A 29 ARG HD3 . 30458 1 389 . 1 . 1 29 29 ARG C C 13 178.900 0.3 . 1 . . . . A 29 ARG C . 30458 1 390 . 1 . 1 29 29 ARG CA C 13 59.459 0.3 . 1 . . . . A 29 ARG CA . 30458 1 391 . 1 . 1 29 29 ARG CB C 13 29.181 0.3 . 1 . . . . A 29 ARG CB . 30458 1 392 . 1 . 1 29 29 ARG CG C 13 28.258 0.3 . 1 . . . . A 29 ARG CG . 30458 1 393 . 1 . 1 29 29 ARG CD C 13 43.594 0.3 . 1 . . . . A 29 ARG CD . 30458 1 394 . 1 . 1 29 29 ARG N N 15 119.203 0.3 . 1 . . . . A 29 ARG N . 30458 1 395 . 1 . 1 30 30 ARG H H 1 7.796 0.020 . 1 . . . . A 30 ARG H . 30458 1 396 . 1 . 1 30 30 ARG HA H 1 3.847 0.020 . 1 . . . . A 30 ARG HA . 30458 1 397 . 1 . 1 30 30 ARG HB2 H 1 1.772 0.020 . 2 . . . . A 30 ARG HB2 . 30458 1 398 . 1 . 1 30 30 ARG HB3 H 1 1.940 0.020 . 2 . . . . A 30 ARG HB3 . 30458 1 399 . 1 . 1 30 30 ARG HG2 H 1 1.709 0.020 . 1 . . . . A 30 ARG HG2 . 30458 1 400 . 1 . 1 30 30 ARG HG3 H 1 1.709 0.020 . 1 . . . . A 30 ARG HG3 . 30458 1 401 . 1 . 1 30 30 ARG HD2 H 1 2.895 0.020 . 1 . . . . A 30 ARG HD2 . 30458 1 402 . 1 . 1 30 30 ARG HD3 H 1 2.895 0.020 . 1 . . . . A 30 ARG HD3 . 30458 1 403 . 1 . 1 30 30 ARG C C 13 178.000 0.3 . 1 . . . . A 30 ARG C . 30458 1 404 . 1 . 1 30 30 ARG CA C 13 58.347 0.3 . 1 . . . . A 30 ARG CA . 30458 1 405 . 1 . 1 30 30 ARG CB C 13 29.000 0.3 . 1 . . . . A 30 ARG CB . 30458 1 406 . 1 . 1 30 30 ARG CG C 13 27.523 0.3 . 1 . . . . A 30 ARG CG . 30458 1 407 . 1 . 1 30 30 ARG CD C 13 43.736 0.3 . 1 . . . . A 30 ARG CD . 30458 1 408 . 1 . 1 30 30 ARG N N 15 119.694 0.3 . 1 . . . . A 30 ARG N . 30458 1 409 . 1 . 1 31 31 LEU H H 1 7.307 0.020 . 1 . . . . A 31 LEU H . 30458 1 410 . 1 . 1 31 31 LEU HA H 1 4.002 0.020 . 1 . . . . A 31 LEU HA . 30458 1 411 . 1 . 1 31 31 LEU HB2 H 1 1.731 0.020 . 2 . . . . A 31 LEU HB2 . 30458 1 412 . 1 . 1 31 31 LEU HB3 H 1 1.007 0.020 . 2 . . . . A 31 LEU HB3 . 30458 1 413 . 1 . 1 31 31 LEU HG H 1 0.936 0.020 . 1 . . . . A 31 LEU HG . 30458 1 414 . 1 . 1 31 31 LEU HD11 H 1 0.449 0.020 . 1 . . . . A 31 LEU HD11 . 30458 1 415 . 1 . 1 31 31 LEU HD12 H 1 0.449 0.020 . 1 . . . . A 31 LEU HD12 . 30458 1 416 . 1 . 1 31 31 LEU HD13 H 1 0.449 0.020 . 1 . . . . A 31 LEU HD13 . 30458 1 417 . 1 . 1 31 31 LEU HD21 H 1 -0.288 0.020 . 1 . . . . A 31 LEU HD21 . 30458 1 418 . 1 . 1 31 31 LEU HD22 H 1 -0.288 0.020 . 1 . . . . A 31 LEU HD22 . 30458 1 419 . 1 . 1 31 31 LEU HD23 H 1 -0.288 0.020 . 1 . . . . A 31 LEU HD23 . 30458 1 420 . 1 . 1 31 31 LEU C C 13 178.400 0.3 . 1 . . . . A 31 LEU C . 30458 1 421 . 1 . 1 31 31 LEU CA C 13 58.413 0.3 . 1 . . . . A 31 LEU CA . 30458 1 422 . 1 . 1 31 31 LEU CB C 13 40.332 0.3 . 1 . . . . A 31 LEU CB . 30458 1 423 . 1 . 1 31 31 LEU CG C 13 27.169 0.3 . 1 . . . . A 31 LEU CG . 30458 1 424 . 1 . 1 31 31 LEU CD1 C 13 22.812 0.3 . 1 . . . . A 31 LEU CD1 . 30458 1 425 . 1 . 1 31 31 LEU CD2 C 13 25.194 0.3 . 1 . . . . A 31 LEU CD2 . 30458 1 426 . 1 . 1 31 31 LEU N N 15 120.548 0.3 . 1 . . . . A 31 LEU N . 30458 1 427 . 1 . 1 32 32 GLY H H 1 7.973 0.020 . 1 . . . . A 32 GLY H . 30458 1 428 . 1 . 1 32 32 GLY HA2 H 1 3.388 0.020 . 2 . . . . A 32 GLY HA2 . 30458 1 429 . 1 . 1 32 32 GLY HA3 H 1 4.031 0.020 . 2 . . . . A 32 GLY HA3 . 30458 1 430 . 1 . 1 32 32 GLY C C 13 175.600 0.3 . 1 . . . . A 32 GLY C . 30458 1 431 . 1 . 1 32 32 GLY CA C 13 48.499 0.3 . 1 . . . . A 32 GLY CA . 30458 1 432 . 1 . 1 32 32 GLY N N 15 105.181 0.3 . 1 . . . . A 32 GLY N . 30458 1 433 . 1 . 1 33 33 HIS H H 1 8.344 0.020 . 1 . . . . A 33 HIS H . 30458 1 434 . 1 . 1 33 33 HIS HA H 1 4.191 0.020 . 1 . . . . A 33 HIS HA . 30458 1 435 . 1 . 1 33 33 HIS HB2 H 1 3.077 0.020 . 2 . . . . A 33 HIS HB2 . 30458 1 436 . 1 . 1 33 33 HIS HB3 H 1 3.131 0.020 . 2 . . . . A 33 HIS HB3 . 30458 1 437 . 1 . 1 33 33 HIS HD2 H 1 6.890 0.020 . 1 . . . . A 33 HIS HD2 . 30458 1 438 . 1 . 1 33 33 HIS HE1 H 1 7.743 0.020 . 1 . . . . A 33 HIS HE1 . 30458 1 439 . 1 . 1 33 33 HIS C C 13 179.400 0.3 . 1 . . . . A 33 HIS C . 30458 1 440 . 1 . 1 33 33 HIS CA C 13 59.938 0.3 . 1 . . . . A 33 HIS CA . 30458 1 441 . 1 . 1 33 33 HIS CB C 13 30.722 0.3 . 1 . . . . A 33 HIS CB . 30458 1 442 . 1 . 1 33 33 HIS CD2 C 13 119.220 0.3 . 1 . . . . A 33 HIS CD2 . 30458 1 443 . 1 . 1 33 33 HIS CE1 C 13 138.243 0.3 . 1 . . . . A 33 HIS CE1 . 30458 1 444 . 1 . 1 33 33 HIS N N 15 120.454 0.3 . 1 . . . . A 33 HIS N . 30458 1 445 . 1 . 1 34 34 ARG H H 1 8.642 0.020 . 1 . . . . A 34 ARG H . 30458 1 446 . 1 . 1 34 34 ARG HA H 1 4.182 0.020 . 1 . . . . A 34 ARG HA . 30458 1 447 . 1 . 1 34 34 ARG HB2 H 1 1.231 0.020 . 2 . . . . A 34 ARG HB2 . 30458 1 448 . 1 . 1 34 34 ARG HB3 H 1 1.544 0.020 . 2 . . . . A 34 ARG HB3 . 30458 1 449 . 1 . 1 34 34 ARG HG2 H 1 0.900 0.020 . 2 . . . . A 34 ARG HG2 . 30458 1 450 . 1 . 1 34 34 ARG HG3 H 1 1.419 0.020 . 2 . . . . A 34 ARG HG3 . 30458 1 451 . 1 . 1 34 34 ARG HD2 H 1 0.270 0.020 . 2 . . . . A 34 ARG HD2 . 30458 1 452 . 1 . 1 34 34 ARG HD3 H 1 2.130 0.020 . 2 . . . . A 34 ARG HD3 . 30458 1 453 . 1 . 1 34 34 ARG HE H 1 6.050 0.020 . 1 . . . . A 34 ARG HE . 30458 1 454 . 1 . 1 34 34 ARG C C 13 179.600 0.3 . 1 . . . . A 34 ARG C . 30458 1 455 . 1 . 1 34 34 ARG CA C 13 59.692 0.3 . 1 . . . . A 34 ARG CA . 30458 1 456 . 1 . 1 34 34 ARG CB C 13 30.085 0.3 . 1 . . . . A 34 ARG CB . 30458 1 457 . 1 . 1 34 34 ARG CG C 13 27.548 0.3 . 1 . . . . A 34 ARG CG . 30458 1 458 . 1 . 1 34 34 ARG CD C 13 42.572 0.3 . 1 . . . . A 34 ARG CD . 30458 1 459 . 1 . 1 34 34 ARG N N 15 121.792 0.3 . 1 . . . . A 34 ARG N . 30458 1 460 . 1 . 1 34 34 ARG NE N 15 88.443 0.3 . 1 . . . . A 34 ARG NE . 30458 1 461 . 1 . 1 35 35 VAL H H 1 8.493 0.020 . 1 . . . . A 35 VAL H . 30458 1 462 . 1 . 1 35 35 VAL HA H 1 3.379 0.020 . 1 . . . . A 35 VAL HA . 30458 1 463 . 1 . 1 35 35 VAL HB H 1 2.111 0.020 . 1 . . . . A 35 VAL HB . 30458 1 464 . 1 . 1 35 35 VAL HG11 H 1 0.865 0.020 . 1 . . . . A 35 VAL HG11 . 30458 1 465 . 1 . 1 35 35 VAL HG12 H 1 0.865 0.020 . 1 . . . . A 35 VAL HG12 . 30458 1 466 . 1 . 1 35 35 VAL HG13 H 1 0.865 0.020 . 1 . . . . A 35 VAL HG13 . 30458 1 467 . 1 . 1 35 35 VAL HG21 H 1 0.793 0.020 . 1 . . . . A 35 VAL HG21 . 30458 1 468 . 1 . 1 35 35 VAL HG22 H 1 0.793 0.020 . 1 . . . . A 35 VAL HG22 . 30458 1 469 . 1 . 1 35 35 VAL HG23 H 1 0.793 0.020 . 1 . . . . A 35 VAL HG23 . 30458 1 470 . 1 . 1 35 35 VAL C C 13 177.600 0.3 . 1 . . . . A 35 VAL C . 30458 1 471 . 1 . 1 35 35 VAL CA C 13 68.045 0.3 . 1 . . . . A 35 VAL CA . 30458 1 472 . 1 . 1 35 35 VAL CB C 13 31.248 0.3 . 1 . . . . A 35 VAL CB . 30458 1 473 . 1 . 1 35 35 VAL CG1 C 13 22.998 0.3 . 1 . . . . A 35 VAL CG1 . 30458 1 474 . 1 . 1 35 35 VAL CG2 C 13 23.955 0.3 . 1 . . . . A 35 VAL CG2 . 30458 1 475 . 1 . 1 35 35 VAL N N 15 118.502 0.3 . 1 . . . . A 35 VAL N . 30458 1 476 . 1 . 1 36 36 LEU H H 1 7.910 0.020 . 1 . . . . A 36 LEU H . 30458 1 477 . 1 . 1 36 36 LEU HA H 1 3.848 0.020 . 1 . . . . A 36 LEU HA . 30458 1 478 . 1 . 1 36 36 LEU HB2 H 1 1.483 0.020 . 2 . . . . A 36 LEU HB2 . 30458 1 479 . 1 . 1 36 36 LEU HB3 H 1 1.340 0.020 . 2 . . . . A 36 LEU HB3 . 30458 1 480 . 1 . 1 36 36 LEU HG H 1 1.480 0.020 . 1 . . . . A 36 LEU HG . 30458 1 481 . 1 . 1 36 36 LEU HD11 H 1 0.228 0.020 . 1 . . . . A 36 LEU HD11 . 30458 1 482 . 1 . 1 36 36 LEU HD12 H 1 0.228 0.020 . 1 . . . . A 36 LEU HD12 . 30458 1 483 . 1 . 1 36 36 LEU HD13 H 1 0.228 0.020 . 1 . . . . A 36 LEU HD13 . 30458 1 484 . 1 . 1 36 36 LEU HD21 H 1 0.339 0.020 . 1 . . . . A 36 LEU HD21 . 30458 1 485 . 1 . 1 36 36 LEU HD22 H 1 0.339 0.020 . 1 . . . . A 36 LEU HD22 . 30458 1 486 . 1 . 1 36 36 LEU HD23 H 1 0.339 0.020 . 1 . . . . A 36 LEU HD23 . 30458 1 487 . 1 . 1 36 36 LEU C C 13 179.600 0.3 . 1 . . . . A 36 LEU C . 30458 1 488 . 1 . 1 36 36 LEU CA C 13 57.904 0.3 . 1 . . . . A 36 LEU CA . 30458 1 489 . 1 . 1 36 36 LEU CB C 13 41.521 0.3 . 1 . . . . A 36 LEU CB . 30458 1 490 . 1 . 1 36 36 LEU CG C 13 26.256 0.3 . 1 . . . . A 36 LEU CG . 30458 1 491 . 1 . 1 36 36 LEU CD1 C 13 24.014 0.3 . 1 . . . . A 36 LEU CD1 . 30458 1 492 . 1 . 1 36 36 LEU CD2 C 13 22.770 0.3 . 1 . . . . A 36 LEU CD2 . 30458 1 493 . 1 . 1 36 36 LEU N N 15 118.277 0.3 . 1 . . . . A 36 LEU N . 30458 1 494 . 1 . 1 37 37 GLY H H 1 7.719 0.020 . 1 . . . . A 37 GLY H . 30458 1 495 . 1 . 1 37 37 GLY HA2 H 1 3.714 0.020 . 1 . . . . A 37 GLY HA2 . 30458 1 496 . 1 . 1 37 37 GLY HA3 H 1 3.714 0.020 . 1 . . . . A 37 GLY HA3 . 30458 1 497 . 1 . 1 37 37 GLY C C 13 175.700 0.3 . 1 . . . . A 37 GLY C . 30458 1 498 . 1 . 1 37 37 GLY CA C 13 46.860 0.3 . 1 . . . . A 37 GLY CA . 30458 1 499 . 1 . 1 37 37 GLY N N 15 104.675 0.3 . 1 . . . . A 37 GLY N . 30458 1 500 . 1 . 1 38 38 LEU H H 1 7.713 0.020 . 1 . . . . A 38 LEU H . 30458 1 501 . 1 . 1 38 38 LEU HA H 1 3.568 0.020 . 1 . . . . A 38 LEU HA . 30458 1 502 . 1 . 1 38 38 LEU HB2 H 1 1.789 0.020 . 2 . . . . A 38 LEU HB2 . 30458 1 503 . 1 . 1 38 38 LEU HB3 H 1 0.938 0.020 . 2 . . . . A 38 LEU HB3 . 30458 1 504 . 1 . 1 38 38 LEU HG H 1 1.771 0.020 . 1 . . . . A 38 LEU HG . 30458 1 505 . 1 . 1 38 38 LEU HD11 H 1 0.738 0.020 . 1 . . . . A 38 LEU HD11 . 30458 1 506 . 1 . 1 38 38 LEU HD12 H 1 0.738 0.020 . 1 . . . . A 38 LEU HD12 . 30458 1 507 . 1 . 1 38 38 LEU HD13 H 1 0.738 0.020 . 1 . . . . A 38 LEU HD13 . 30458 1 508 . 1 . 1 38 38 LEU HD21 H 1 -0.149 0.020 . 1 . . . . A 38 LEU HD21 . 30458 1 509 . 1 . 1 38 38 LEU HD22 H 1 -0.149 0.020 . 1 . . . . A 38 LEU HD22 . 30458 1 510 . 1 . 1 38 38 LEU HD23 H 1 -0.149 0.020 . 1 . . . . A 38 LEU HD23 . 30458 1 511 . 1 . 1 38 38 LEU C C 13 176.900 0.3 . 1 . . . . A 38 LEU C . 30458 1 512 . 1 . 1 38 38 LEU CA C 13 56.714 0.3 . 1 . . . . A 38 LEU CA . 30458 1 513 . 1 . 1 38 38 LEU CB C 13 41.778 0.3 . 1 . . . . A 38 LEU CB . 30458 1 514 . 1 . 1 38 38 LEU CG C 13 25.965 0.3 . 1 . . . . A 38 LEU CG . 30458 1 515 . 1 . 1 38 38 LEU CD1 C 13 26.061 0.3 . 1 . . . . A 38 LEU CD1 . 30458 1 516 . 1 . 1 38 38 LEU CD2 C 13 21.140 0.3 . 1 . . . . A 38 LEU CD2 . 30458 1 517 . 1 . 1 38 38 LEU N N 15 120.554 0.3 . 1 . . . . A 38 LEU N . 30458 1 518 . 1 . 1 39 39 ILE H H 1 7.554 0.020 . 1 . . . . A 39 ILE H . 30458 1 519 . 1 . 1 39 39 ILE HA H 1 4.188 0.020 . 1 . . . . A 39 ILE HA . 30458 1 520 . 1 . 1 39 39 ILE HB H 1 2.093 0.020 . 1 . . . . A 39 ILE HB . 30458 1 521 . 1 . 1 39 39 ILE HG12 H 1 1.516 0.020 . 2 . . . . A 39 ILE HG12 . 30458 1 522 . 1 . 1 39 39 ILE HG13 H 1 1.590 0.020 . 2 . . . . A 39 ILE HG13 . 30458 1 523 . 1 . 1 39 39 ILE HG21 H 1 1.019 0.020 . 1 . . . . A 39 ILE HG21 . 30458 1 524 . 1 . 1 39 39 ILE HG22 H 1 1.019 0.020 . 1 . . . . A 39 ILE HG22 . 30458 1 525 . 1 . 1 39 39 ILE HG23 H 1 1.019 0.020 . 1 . . . . A 39 ILE HG23 . 30458 1 526 . 1 . 1 39 39 ILE HD11 H 1 0.886 0.020 . 1 . . . . A 39 ILE HD11 . 30458 1 527 . 1 . 1 39 39 ILE HD12 H 1 0.886 0.020 . 1 . . . . A 39 ILE HD12 . 30458 1 528 . 1 . 1 39 39 ILE HD13 H 1 0.886 0.020 . 1 . . . . A 39 ILE HD13 . 30458 1 529 . 1 . 1 39 39 ILE C C 13 178.100 0.3 . 1 . . . . A 39 ILE C . 30458 1 530 . 1 . 1 39 39 ILE CA C 13 62.745 0.3 . 1 . . . . A 39 ILE CA . 30458 1 531 . 1 . 1 39 39 ILE CB C 13 38.482 0.3 . 1 . . . . A 39 ILE CB . 30458 1 532 . 1 . 1 39 39 ILE CG1 C 13 27.781 0.3 . 1 . . . . A 39 ILE CG1 . 30458 1 533 . 1 . 1 39 39 ILE CG2 C 13 18.958 0.3 . 1 . . . . A 39 ILE CG2 . 30458 1 534 . 1 . 1 39 39 ILE CD1 C 13 14.683 0.3 . 1 . . . . A 39 ILE CD1 . 30458 1 535 . 1 . 1 39 39 ILE N N 15 108.547 0.3 . 1 . . . . A 39 ILE N . 30458 1 536 . 1 . 1 40 40 LYS H H 1 7.572 0.020 . 1 . . . . A 40 LYS H . 30458 1 537 . 1 . 1 40 40 LYS HA H 1 4.420 0.020 . 1 . . . . A 40 LYS HA . 30458 1 538 . 1 . 1 40 40 LYS HB2 H 1 1.960 0.020 . 1 . . . . A 40 LYS HB2 . 30458 1 539 . 1 . 1 40 40 LYS HB3 H 1 1.960 0.020 . 1 . . . . A 40 LYS HB3 . 30458 1 540 . 1 . 1 40 40 LYS HG2 H 1 1.488 0.020 . 1 . . . . A 40 LYS HG2 . 30458 1 541 . 1 . 1 40 40 LYS HG3 H 1 1.488 0.020 . 1 . . . . A 40 LYS HG3 . 30458 1 542 . 1 . 1 40 40 LYS HD2 H 1 1.656 0.020 . 1 . . . . A 40 LYS HD2 . 30458 1 543 . 1 . 1 40 40 LYS HD3 H 1 1.656 0.020 . 1 . . . . A 40 LYS HD3 . 30458 1 544 . 1 . 1 40 40 LYS HE2 H 1 2.870 0.020 . 1 . . . . A 40 LYS HE2 . 30458 1 545 . 1 . 1 40 40 LYS HE3 H 1 2.870 0.020 . 1 . . . . A 40 LYS HE3 . 30458 1 546 . 1 . 1 40 40 LYS C C 13 176.340 0.3 . 1 . . . . A 40 LYS C . 30458 1 547 . 1 . 1 40 40 LYS CA C 13 60.691 0.3 . 1 . . . . A 40 LYS CA . 30458 1 548 . 1 . 1 40 40 LYS CB C 13 29.469 0.3 . 1 . . . . A 40 LYS CB . 30458 1 549 . 1 . 1 40 40 LYS CG C 13 24.951 0.3 . 1 . . . . A 40 LYS CG . 30458 1 550 . 1 . 1 40 40 LYS CD C 13 28.615 0.3 . 1 . . . . A 40 LYS CD . 30458 1 551 . 1 . 1 40 40 LYS CE C 13 42.176 0.3 . 1 . . . . A 40 LYS CE . 30458 1 552 . 1 . 1 40 40 LYS N N 15 122.758 0.3 . 1 . . . . A 40 LYS N . 30458 1 553 . 1 . 1 41 41 PRO HA H 1 4.389 0.020 . 1 . . . . A 41 PRO HA . 30458 1 554 . 1 . 1 41 41 PRO HB2 H 1 2.393 0.020 . 2 . . . . A 41 PRO HB2 . 30458 1 555 . 1 . 1 41 41 PRO HB3 H 1 1.749 0.020 . 2 . . . . A 41 PRO HB3 . 30458 1 556 . 1 . 1 41 41 PRO HG2 H 1 2.142 0.020 . 2 . . . . A 41 PRO HG2 . 30458 1 557 . 1 . 1 41 41 PRO HG3 H 1 2.061 0.020 . 2 . . . . A 41 PRO HG3 . 30458 1 558 . 1 . 1 41 41 PRO HD2 H 1 3.843 0.020 . 2 . . . . A 41 PRO HD2 . 30458 1 559 . 1 . 1 41 41 PRO HD3 H 1 3.539 0.020 . 2 . . . . A 41 PRO HD3 . 30458 1 560 . 1 . 1 41 41 PRO C C 13 178.700 0.3 . 1 . . . . A 41 PRO C . 30458 1 561 . 1 . 1 41 41 PRO CA C 13 65.723 0.3 . 1 . . . . A 41 PRO CA . 30458 1 562 . 1 . 1 41 41 PRO CB C 13 31.687 0.3 . 1 . . . . A 41 PRO CB . 30458 1 563 . 1 . 1 41 41 PRO CG C 13 28.750 0.3 . 1 . . . . A 41 PRO CG . 30458 1 564 . 1 . 1 41 41 PRO CD C 13 50.436 0.3 . 1 . . . . A 41 PRO CD . 30458 1 565 . 1 . 1 42 42 LEU H H 1 7.129 0.020 . 1 . . . . A 42 LEU H . 30458 1 566 . 1 . 1 42 42 LEU HA H 1 4.047 0.020 . 1 . . . . A 42 LEU HA . 30458 1 567 . 1 . 1 42 42 LEU HB2 H 1 2.182 0.020 . 2 . . . . A 42 LEU HB2 . 30458 1 568 . 1 . 1 42 42 LEU HB3 H 1 1.463 0.020 . 2 . . . . A 42 LEU HB3 . 30458 1 569 . 1 . 1 42 42 LEU HG H 1 1.986 0.020 . 1 . . . . A 42 LEU HG . 30458 1 570 . 1 . 1 42 42 LEU HD11 H 1 0.986 0.020 . 1 . . . . A 42 LEU HD11 . 30458 1 571 . 1 . 1 42 42 LEU HD12 H 1 0.986 0.020 . 1 . . . . A 42 LEU HD12 . 30458 1 572 . 1 . 1 42 42 LEU HD13 H 1 0.986 0.020 . 1 . . . . A 42 LEU HD13 . 30458 1 573 . 1 . 1 42 42 LEU HD21 H 1 0.846 0.020 . 1 . . . . A 42 LEU HD21 . 30458 1 574 . 1 . 1 42 42 LEU HD22 H 1 0.846 0.020 . 1 . . . . A 42 LEU HD22 . 30458 1 575 . 1 . 1 42 42 LEU HD23 H 1 0.846 0.020 . 1 . . . . A 42 LEU HD23 . 30458 1 576 . 1 . 1 42 42 LEU C C 13 178.800 0.3 . 1 . . . . A 42 LEU C . 30458 1 577 . 1 . 1 42 42 LEU CA C 13 57.299 0.3 . 1 . . . . A 42 LEU CA . 30458 1 578 . 1 . 1 42 42 LEU CB C 13 40.407 0.3 . 1 . . . . A 42 LEU CB . 30458 1 579 . 1 . 1 42 42 LEU CG C 13 27.160 0.3 . 1 . . . . A 42 LEU CG . 30458 1 580 . 1 . 1 42 42 LEU CD1 C 13 26.396 0.3 . 1 . . . . A 42 LEU CD1 . 30458 1 581 . 1 . 1 42 42 LEU CD2 C 13 23.409 0.3 . 1 . . . . A 42 LEU CD2 . 30458 1 582 . 1 . 1 42 42 LEU N N 15 114.725 0.3 . 1 . . . . A 42 LEU N . 30458 1 583 . 1 . 1 43 43 GLU H H 1 8.172 0.020 . 1 . . . . A 43 GLU H . 30458 1 584 . 1 . 1 43 43 GLU HA H 1 3.867 0.020 . 1 . . . . A 43 GLU HA . 30458 1 585 . 1 . 1 43 43 GLU HB2 H 1 2.051 0.020 . 2 . . . . A 43 GLU HB2 . 30458 1 586 . 1 . 1 43 43 GLU HB3 H 1 2.254 0.020 . 2 . . . . A 43 GLU HB3 . 30458 1 587 . 1 . 1 43 43 GLU HG2 H 1 2.075 0.020 . 2 . . . . A 43 GLU HG2 . 30458 1 588 . 1 . 1 43 43 GLU HG3 H 1 2.364 0.020 . 2 . . . . A 43 GLU HG3 . 30458 1 589 . 1 . 1 43 43 GLU C C 13 179.252 0.3 . 1 . . . . A 43 GLU C . 30458 1 590 . 1 . 1 43 43 GLU CA C 13 59.574 0.3 . 1 . . . . A 43 GLU CA . 30458 1 591 . 1 . 1 43 43 GLU CB C 13 30.161 0.3 . 1 . . . . A 43 GLU CB . 30458 1 592 . 1 . 1 43 43 GLU CG C 13 37.868 0.3 . 1 . . . . A 43 GLU CG . 30458 1 593 . 1 . 1 43 43 GLU N N 15 119.517 0.3 . 1 . . . . A 43 GLU N . 30458 1 594 . 1 . 1 44 44 MET H H 1 7.623 0.020 . 1 . . . . A 44 MET H . 30458 1 595 . 1 . 1 44 44 MET HA H 1 4.236 0.020 . 1 . . . . A 44 MET HA . 30458 1 596 . 1 . 1 44 44 MET HB2 H 1 2.152 0.020 . 1 . . . . A 44 MET HB2 . 30458 1 597 . 1 . 1 44 44 MET HB3 H 1 2.152 0.020 . 1 . . . . A 44 MET HB3 . 30458 1 598 . 1 . 1 44 44 MET HG2 H 1 2.556 0.020 . 2 . . . . A 44 MET HG2 . 30458 1 599 . 1 . 1 44 44 MET HG3 H 1 2.683 0.020 . 2 . . . . A 44 MET HG3 . 30458 1 600 . 1 . 1 44 44 MET HE1 H 1 2.062 0.020 . 1 . . . . A 44 MET HE1 . 30458 1 601 . 1 . 1 44 44 MET HE2 H 1 2.062 0.020 . 1 . . . . A 44 MET HE2 . 30458 1 602 . 1 . 1 44 44 MET HE3 H 1 2.062 0.020 . 1 . . . . A 44 MET HE3 . 30458 1 603 . 1 . 1 44 44 MET C C 13 178.017 0.3 . 1 . . . . A 44 MET C . 30458 1 604 . 1 . 1 44 44 MET CA C 13 57.914 0.3 . 1 . . . . A 44 MET CA . 30458 1 605 . 1 . 1 44 44 MET CB C 13 32.448 0.3 . 1 . . . . A 44 MET CB . 30458 1 606 . 1 . 1 44 44 MET CG C 13 32.218 0.3 . 1 . . . . A 44 MET CG . 30458 1 607 . 1 . 1 44 44 MET CE C 13 17.124 0.3 . 1 . . . . A 44 MET CE . 30458 1 608 . 1 . 1 44 44 MET N N 15 116.605 0.3 . 1 . . . . A 44 MET N . 30458 1 609 . 1 . 1 45 45 LEU H H 1 7.629 0.020 . 1 . . . . A 45 LEU H . 30458 1 610 . 1 . 1 45 45 LEU HA H 1 4.095 0.020 . 1 . . . . A 45 LEU HA . 30458 1 611 . 1 . 1 45 45 LEU HB2 H 1 1.776 0.020 . 2 . . . . A 45 LEU HB2 . 30458 1 612 . 1 . 1 45 45 LEU HB3 H 1 1.681 0.020 . 2 . . . . A 45 LEU HB3 . 30458 1 613 . 1 . 1 45 45 LEU HG H 1 1.721 0.020 . 1 . . . . A 45 LEU HG . 30458 1 614 . 1 . 1 45 45 LEU HD11 H 1 0.873 0.020 . 1 . . . . A 45 LEU HD11 . 30458 1 615 . 1 . 1 45 45 LEU HD12 H 1 0.873 0.020 . 1 . . . . A 45 LEU HD12 . 30458 1 616 . 1 . 1 45 45 LEU HD13 H 1 0.873 0.020 . 1 . . . . A 45 LEU HD13 . 30458 1 617 . 1 . 1 45 45 LEU HD21 H 1 0.799 0.020 . 1 . . . . A 45 LEU HD21 . 30458 1 618 . 1 . 1 45 45 LEU HD22 H 1 0.799 0.020 . 1 . . . . A 45 LEU HD22 . 30458 1 619 . 1 . 1 45 45 LEU HD23 H 1 0.799 0.020 . 1 . . . . A 45 LEU HD23 . 30458 1 620 . 1 . 1 45 45 LEU C C 13 178.385 0.3 . 1 . . . . A 45 LEU C . 30458 1 621 . 1 . 1 45 45 LEU CA C 13 56.960 0.3 . 1 . . . . A 45 LEU CA . 30458 1 622 . 1 . 1 45 45 LEU CB C 13 42.292 0.3 . 1 . . . . A 45 LEU CB . 30458 1 623 . 1 . 1 45 45 LEU CG C 13 27.172 0.3 . 1 . . . . A 45 LEU CG . 30458 1 624 . 1 . 1 45 45 LEU CD1 C 13 25.473 0.3 . 1 . . . . A 45 LEU CD1 . 30458 1 625 . 1 . 1 45 45 LEU CD2 C 13 24.603 0.3 . 1 . . . . A 45 LEU CD2 . 30458 1 626 . 1 . 1 45 45 LEU N N 15 120.037 0.3 . 1 . . . . A 45 LEU N . 30458 1 627 . 1 . 1 46 46 GLN H H 1 7.993 0.020 . 1 . . . . A 46 GLN H . 30458 1 628 . 1 . 1 46 46 GLN HA H 1 4.066 0.020 . 1 . . . . A 46 GLN HA . 30458 1 629 . 1 . 1 46 46 GLN HB2 H 1 2.040 0.020 . 2 . . . . A 46 GLN HB2 . 30458 1 630 . 1 . 1 46 46 GLN HB3 H 1 2.151 0.020 . 2 . . . . A 46 GLN HB3 . 30458 1 631 . 1 . 1 46 46 GLN HG2 H 1 2.271 0.020 . 1 . . . . A 46 GLN HG2 . 30458 1 632 . 1 . 1 46 46 GLN HG3 H 1 2.271 0.020 . 1 . . . . A 46 GLN HG3 . 30458 1 633 . 1 . 1 46 46 GLN HE21 H 1 7.456 0.020 . 1 . . . . A 46 GLN HE21 . 30458 1 634 . 1 . 1 46 46 GLN HE22 H 1 6.704 0.020 . 1 . . . . A 46 GLN HE22 . 30458 1 635 . 1 . 1 46 46 GLN C C 13 176.763 0.3 . 1 . . . . A 46 GLN C . 30458 1 636 . 1 . 1 46 46 GLN CA C 13 58.678 0.3 . 1 . . . . A 46 GLN CA . 30458 1 637 . 1 . 1 46 46 GLN CB C 13 29.515 0.3 . 1 . . . . A 46 GLN CB . 30458 1 638 . 1 . 1 46 46 GLN CG C 13 34.110 0.3 . 1 . . . . A 46 GLN CG . 30458 1 639 . 1 . 1 46 46 GLN N N 15 118.881 0.3 . 1 . . . . A 46 GLN N . 30458 1 640 . 1 . 1 46 46 GLN NE2 N 15 109.974 0.3 . 1 . . . . A 46 GLN NE2 . 30458 1 641 . 1 . 1 47 47 ASP H H 1 7.923 0.020 . 1 . . . . A 47 ASP H . 30458 1 642 . 1 . 1 47 47 ASP HA H 1 4.521 0.020 . 1 . . . . A 47 ASP HA . 30458 1 643 . 1 . 1 47 47 ASP HB2 H 1 2.652 0.020 . 2 . . . . A 47 ASP HB2 . 30458 1 644 . 1 . 1 47 47 ASP HB3 H 1 2.704 0.020 . 2 . . . . A 47 ASP HB3 . 30458 1 645 . 1 . 1 47 47 ASP C C 13 176.985 0.3 . 1 . . . . A 47 ASP C . 30458 1 646 . 1 . 1 47 47 ASP CA C 13 55.325 0.3 . 1 . . . . A 47 ASP CA . 30458 1 647 . 1 . 1 47 47 ASP CB C 13 41.232 0.3 . 1 . . . . A 47 ASP CB . 30458 1 648 . 1 . 1 47 47 ASP N N 15 118.999 0.3 . 1 . . . . A 47 ASP N . 30458 1 649 . 1 . 1 48 48 GLN H H 1 8.036 0.020 . 1 . . . . A 48 GLN H . 30458 1 650 . 1 . 1 48 48 GLN HA H 1 4.201 0.020 . 1 . . . . A 48 GLN HA . 30458 1 651 . 1 . 1 48 48 GLN HB2 H 1 2.025 0.020 . 2 . . . . A 48 GLN HB2 . 30458 1 652 . 1 . 1 48 48 GLN HB3 H 1 2.155 0.020 . 2 . . . . A 48 GLN HB3 . 30458 1 653 . 1 . 1 48 48 GLN HG2 H 1 2.430 0.020 . 1 . . . . A 48 GLN HG2 . 30458 1 654 . 1 . 1 48 48 GLN HG3 H 1 2.430 0.020 . 1 . . . . A 48 GLN HG3 . 30458 1 655 . 1 . 1 48 48 GLN HE21 H 1 7.485 0.020 . 1 . . . . A 48 GLN HE21 . 30458 1 656 . 1 . 1 48 48 GLN HE22 H 1 6.839 0.020 . 1 . . . . A 48 GLN HE22 . 30458 1 657 . 1 . 1 48 48 GLN C C 13 177.200 0.3 . 1 . . . . A 48 GLN C . 30458 1 658 . 1 . 1 48 48 GLN CA C 13 56.632 0.3 . 1 . . . . A 48 GLN CA . 30458 1 659 . 1 . 1 48 48 GLN CB C 13 29.291 0.3 . 1 . . . . A 48 GLN CB . 30458 1 660 . 1 . 1 48 48 GLN CG C 13 34.100 0.3 . 1 . . . . A 48 GLN CG . 30458 1 661 . 1 . 1 48 48 GLN N N 15 118.852 0.3 . 1 . . . . A 48 GLN N . 30458 1 662 . 1 . 1 48 48 GLN NE2 N 15 111.844 0.3 . 1 . . . . A 48 GLN NE2 . 30458 1 663 . 1 . 1 49 49 GLY H H 1 8.238 0.020 . 1 . . . . A 49 GLY H . 30458 1 664 . 1 . 1 49 49 GLY HA2 H 1 3.890 0.020 . 1 . . . . A 49 GLY HA2 . 30458 1 665 . 1 . 1 49 49 GLY HA3 H 1 3.890 0.020 . 1 . . . . A 49 GLY HA3 . 30458 1 666 . 1 . 1 49 49 GLY C C 13 174.607 0.3 . 1 . . . . A 49 GLY C . 30458 1 667 . 1 . 1 49 49 GLY CA C 13 46.121 0.3 . 1 . . . . A 49 GLY CA . 30458 1 668 . 1 . 1 49 49 GLY N N 15 108.391 0.3 . 1 . . . . A 49 GLY N . 30458 1 669 . 1 . 1 50 50 LYS H H 1 8.081 0.020 . 1 . . . . A 50 LYS H . 30458 1 670 . 1 . 1 50 50 LYS HA H 1 4.381 0.020 . 1 . . . . A 50 LYS HA . 30458 1 671 . 1 . 1 50 50 LYS HB2 H 1 1.732 0.020 . 2 . . . . A 50 LYS HB2 . 30458 1 672 . 1 . 1 50 50 LYS HB3 H 1 1.799 0.020 . 2 . . . . A 50 LYS HB3 . 30458 1 673 . 1 . 1 50 50 LYS HD2 H 1 1.642 0.020 . 1 . . . . A 50 LYS HD2 . 30458 1 674 . 1 . 1 50 50 LYS HD3 H 1 1.642 0.020 . 1 . . . . A 50 LYS HD3 . 30458 1 675 . 1 . 1 50 50 LYS HE2 H 1 2.951 0.020 . 1 . . . . A 50 LYS HE2 . 30458 1 676 . 1 . 1 50 50 LYS HE3 H 1 2.951 0.020 . 1 . . . . A 50 LYS HE3 . 30458 1 677 . 1 . 1 50 50 LYS C C 13 176.634 0.3 . 1 . . . . A 50 LYS C . 30458 1 678 . 1 . 1 50 50 LYS CA C 13 56.185 0.3 . 1 . . . . A 50 LYS CA . 30458 1 679 . 1 . 1 50 50 LYS CB C 13 32.624 0.3 . 1 . . . . A 50 LYS CB . 30458 1 680 . 1 . 1 50 50 LYS CG C 13 25.000 0.3 . 1 . . . . A 50 LYS CG . 30458 1 681 . 1 . 1 50 50 LYS CD C 13 29.349 0.3 . 1 . . . . A 50 LYS CD . 30458 1 682 . 1 . 1 50 50 LYS CE C 13 42.128 0.3 . 1 . . . . A 50 LYS CE . 30458 1 683 . 1 . 1 50 50 LYS N N 15 120.211 0.3 . 1 . . . . A 50 LYS N . 30458 1 684 . 1 . 1 51 51 ARG H H 1 8.291 0.020 . 1 . . . . A 51 ARG H . 30458 1 685 . 1 . 1 51 51 ARG HA H 1 4.282 0.020 . 1 . . . . A 51 ARG HA . 30458 1 686 . 1 . 1 51 51 ARG HB2 H 1 1.806 0.020 . 2 . . . . A 51 ARG HB2 . 30458 1 687 . 1 . 1 51 51 ARG HB3 H 1 1.930 0.020 . 2 . . . . A 51 ARG HB3 . 30458 1 688 . 1 . 1 51 51 ARG HG2 H 1 1.640 0.020 . 1 . . . . A 51 ARG HG2 . 30458 1 689 . 1 . 1 51 51 ARG HG3 H 1 1.640 0.020 . 1 . . . . A 51 ARG HG3 . 30458 1 690 . 1 . 1 51 51 ARG HD2 H 1 3.162 0.020 . 1 . . . . A 51 ARG HD2 . 30458 1 691 . 1 . 1 51 51 ARG HD3 H 1 3.162 0.020 . 1 . . . . A 51 ARG HD3 . 30458 1 692 . 1 . 1 51 51 ARG C C 13 176.192 0.3 . 1 . . . . A 51 ARG C . 30458 1 693 . 1 . 1 51 51 ARG CA C 13 56.172 0.3 . 1 . . . . A 51 ARG CA . 30458 1 694 . 1 . 1 51 51 ARG CB C 13 30.844 0.3 . 1 . . . . A 51 ARG CB . 30458 1 695 . 1 . 1 51 51 ARG CG C 13 27.500 0.3 . 1 . . . . A 51 ARG CG . 30458 1 696 . 1 . 1 51 51 ARG CD C 13 43.501 0.3 . 1 . . . . A 51 ARG CD . 30458 1 697 . 1 . 1 51 51 ARG N N 15 120.945 0.3 . 1 . . . . A 51 ARG N . 30458 1 698 . 1 . 1 52 52 SER H H 1 8.115 0.020 . 1 . . . . A 52 SER H . 30458 1 699 . 1 . 1 52 52 SER HA H 1 4.494 0.020 . 1 . . . . A 52 SER HA . 30458 1 700 . 1 . 1 52 52 SER HB2 H 1 3.717 0.020 . 2 . . . . A 52 SER HB2 . 30458 1 701 . 1 . 1 52 52 SER HB3 H 1 3.767 0.020 . 2 . . . . A 52 SER HB3 . 30458 1 702 . 1 . 1 52 52 SER C C 13 173.796 0.3 . 1 . . . . A 52 SER C . 30458 1 703 . 1 . 1 52 52 SER CA C 13 57.918 0.3 . 1 . . . . A 52 SER CA . 30458 1 704 . 1 . 1 52 52 SER CB C 13 64.456 0.3 . 1 . . . . A 52 SER CB . 30458 1 705 . 1 . 1 52 52 SER N N 15 116.941 0.3 . 1 . . . . A 52 SER N . 30458 1 706 . 1 . 1 53 53 VAL H H 1 8.398 0.020 . 1 . . . . A 53 VAL H . 30458 1 707 . 1 . 1 53 53 VAL HA H 1 4.280 0.020 . 1 . . . . A 53 VAL HA . 30458 1 708 . 1 . 1 53 53 VAL HB H 1 1.981 0.020 . 1 . . . . A 53 VAL HB . 30458 1 709 . 1 . 1 53 53 VAL HG11 H 1 0.928 0.020 . 1 . . . . A 53 VAL HG11 . 30458 1 710 . 1 . 1 53 53 VAL HG12 H 1 0.928 0.020 . 1 . . . . A 53 VAL HG12 . 30458 1 711 . 1 . 1 53 53 VAL HG13 H 1 0.928 0.020 . 1 . . . . A 53 VAL HG13 . 30458 1 712 . 1 . 1 53 53 VAL HG21 H 1 0.928 0.020 . 1 . . . . A 53 VAL HG21 . 30458 1 713 . 1 . 1 53 53 VAL HG22 H 1 0.928 0.020 . 1 . . . . A 53 VAL HG22 . 30458 1 714 . 1 . 1 53 53 VAL HG23 H 1 0.928 0.020 . 1 . . . . A 53 VAL HG23 . 30458 1 715 . 1 . 1 53 53 VAL C C 13 174.681 0.3 . 1 . . . . A 53 VAL C . 30458 1 716 . 1 . 1 53 53 VAL CA C 13 60.395 0.3 . 1 . . . . A 53 VAL CA . 30458 1 717 . 1 . 1 53 53 VAL CB C 13 32.627 0.3 . 1 . . . . A 53 VAL CB . 30458 1 718 . 1 . 1 53 53 VAL CG1 C 13 20.957 0.3 . 1 . . . . A 53 VAL CG1 . 30458 1 719 . 1 . 1 53 53 VAL N N 15 124.123 0.3 . 1 . . . . A 53 VAL N . 30458 1 720 . 1 . 1 54 54 PRO HA H 1 4.413 0.020 . 1 . . . . A 54 PRO HA . 30458 1 721 . 1 . 1 54 54 PRO HB2 H 1 2.035 0.020 . 2 . . . . A 54 PRO HB2 . 30458 1 722 . 1 . 1 54 54 PRO HB3 H 1 1.990 0.020 . 2 . . . . A 54 PRO HB3 . 30458 1 723 . 1 . 1 54 54 PRO HG2 H 1 2.000 0.020 . 2 . . . . A 54 PRO HG2 . 30458 1 724 . 1 . 1 54 54 PRO HG3 H 1 1.850 0.020 . 2 . . . . A 54 PRO HG3 . 30458 1 725 . 1 . 1 54 54 PRO HD2 H 1 3.800 0.020 . 2 . . . . A 54 PRO HD2 . 30458 1 726 . 1 . 1 54 54 PRO HD3 H 1 3.719 0.020 . 2 . . . . A 54 PRO HD3 . 30458 1 727 . 1 . 1 54 54 PRO C C 13 176.600 0.3 . 1 . . . . A 54 PRO C . 30458 1 728 . 1 . 1 54 54 PRO CA C 13 62.768 0.3 . 1 . . . . A 54 PRO CA . 30458 1 729 . 1 . 1 54 54 PRO CB C 13 32.502 0.3 . 1 . . . . A 54 PRO CB . 30458 1 730 . 1 . 1 54 54 PRO CG C 13 27.600 0.3 . 1 . . . . A 54 PRO CG . 30458 1 731 . 1 . 1 54 54 PRO CD C 13 51.000 0.3 . 1 . . . . A 54 PRO CD . 30458 1 732 . 1 . 1 55 55 SER H H 1 8.955 0.020 . 1 . . . . A 55 SER H . 30458 1 733 . 1 . 1 55 55 SER HA H 1 4.328 0.020 . 1 . . . . A 55 SER HA . 30458 1 734 . 1 . 1 55 55 SER HB2 H 1 3.977 0.020 . 2 . . . . A 55 SER HB2 . 30458 1 735 . 1 . 1 55 55 SER HB3 H 1 4.234 0.020 . 2 . . . . A 55 SER HB3 . 30458 1 736 . 1 . 1 55 55 SER C C 13 175.326 0.3 . 1 . . . . A 55 SER C . 30458 1 737 . 1 . 1 55 55 SER CA C 13 58.198 0.3 . 1 . . . . A 55 SER CA . 30458 1 738 . 1 . 1 55 55 SER CB C 13 64.383 0.3 . 1 . . . . A 55 SER CB . 30458 1 739 . 1 . 1 55 55 SER N N 15 119.515 0.3 . 1 . . . . A 55 SER N . 30458 1 740 . 1 . 1 56 56 GLU H H 1 9.002 0.020 . 1 . . . . A 56 GLU H . 30458 1 741 . 1 . 1 56 56 GLU HA H 1 4.143 0.020 . 1 . . . . A 56 GLU HA . 30458 1 742 . 1 . 1 56 56 GLU HB2 H 1 2.096 0.020 . 1 . . . . A 56 GLU HB2 . 30458 1 743 . 1 . 1 56 56 GLU HB3 H 1 2.096 0.020 . 1 . . . . A 56 GLU HB3 . 30458 1 744 . 1 . 1 56 56 GLU HG2 H 1 2.246 0.020 . 2 . . . . A 56 GLU HG2 . 30458 1 745 . 1 . 1 56 56 GLU HG3 H 1 2.319 0.020 . 2 . . . . A 56 GLU HG3 . 30458 1 746 . 1 . 1 56 56 GLU C C 13 179.300 0.3 . 1 . . . . A 56 GLU C . 30458 1 747 . 1 . 1 56 56 GLU CA C 13 60.017 0.3 . 1 . . . . A 56 GLU CA . 30458 1 748 . 1 . 1 56 56 GLU CB C 13 29.467 0.3 . 1 . . . . A 56 GLU CB . 30458 1 749 . 1 . 1 56 56 GLU CG C 13 36.958 0.3 . 1 . . . . A 56 GLU CG . 30458 1 750 . 1 . 1 56 56 GLU N N 15 122.939 0.3 . 1 . . . . A 56 GLU N . 30458 1 751 . 1 . 1 57 57 LYS H H 1 8.165 0.020 . 1 . . . . A 57 LYS H . 30458 1 752 . 1 . 1 57 57 LYS HA H 1 4.031 0.020 . 1 . . . . A 57 LYS HA . 30458 1 753 . 1 . 1 57 57 LYS HB2 H 1 1.729 0.020 . 2 . . . . A 57 LYS HB2 . 30458 1 754 . 1 . 1 57 57 LYS HB3 H 1 1.792 0.020 . 2 . . . . A 57 LYS HB3 . 30458 1 755 . 1 . 1 57 57 LYS HG2 H 1 1.412 0.020 . 2 . . . . A 57 LYS HG2 . 30458 1 756 . 1 . 1 57 57 LYS HG3 H 1 1.572 0.020 . 2 . . . . A 57 LYS HG3 . 30458 1 757 . 1 . 1 57 57 LYS HD2 H 1 1.684 0.020 . 1 . . . . A 57 LYS HD2 . 30458 1 758 . 1 . 1 57 57 LYS HD3 H 1 1.684 0.020 . 1 . . . . A 57 LYS HD3 . 30458 1 759 . 1 . 1 57 57 LYS HE2 H 1 2.945 0.020 . 1 . . . . A 57 LYS HE2 . 30458 1 760 . 1 . 1 57 57 LYS HE3 H 1 2.945 0.020 . 1 . . . . A 57 LYS HE3 . 30458 1 761 . 1 . 1 57 57 LYS C C 13 179.400 0.3 . 1 . . . . A 57 LYS C . 30458 1 762 . 1 . 1 57 57 LYS CA C 13 59.486 0.3 . 1 . . . . A 57 LYS CA . 30458 1 763 . 1 . 1 57 57 LYS CB C 13 32.799 0.3 . 1 . . . . A 57 LYS CB . 30458 1 764 . 1 . 1 57 57 LYS CG C 13 25.962 0.3 . 1 . . . . A 57 LYS CG . 30458 1 765 . 1 . 1 57 57 LYS CD C 13 28.935 0.3 . 1 . . . . A 57 LYS CD . 30458 1 766 . 1 . 1 57 57 LYS CE C 13 41.912 0.3 . 1 . . . . A 57 LYS CE . 30458 1 767 . 1 . 1 57 57 LYS N N 15 118.879 0.3 . 1 . . . . A 57 LYS N . 30458 1 768 . 1 . 1 58 58 LEU H H 1 8.377 0.020 . 1 . . . . A 58 LEU H . 30458 1 769 . 1 . 1 58 58 LEU HA H 1 4.060 0.020 . 1 . . . . A 58 LEU HA . 30458 1 770 . 1 . 1 58 58 LEU HB2 H 1 1.972 0.020 . 2 . . . . A 58 LEU HB2 . 30458 1 771 . 1 . 1 58 58 LEU HB3 H 1 1.496 0.020 . 2 . . . . A 58 LEU HB3 . 30458 1 772 . 1 . 1 58 58 LEU HG H 1 1.495 0.020 . 1 . . . . A 58 LEU HG . 30458 1 773 . 1 . 1 58 58 LEU HD11 H 1 0.802 0.020 . 1 . . . . A 58 LEU HD11 . 30458 1 774 . 1 . 1 58 58 LEU HD12 H 1 0.802 0.020 . 1 . . . . A 58 LEU HD12 . 30458 1 775 . 1 . 1 58 58 LEU HD13 H 1 0.802 0.020 . 1 . . . . A 58 LEU HD13 . 30458 1 776 . 1 . 1 58 58 LEU HD21 H 1 0.846 0.020 . 1 . . . . A 58 LEU HD21 . 30458 1 777 . 1 . 1 58 58 LEU HD22 H 1 0.846 0.020 . 1 . . . . A 58 LEU HD22 . 30458 1 778 . 1 . 1 58 58 LEU HD23 H 1 0.846 0.020 . 1 . . . . A 58 LEU HD23 . 30458 1 779 . 1 . 1 58 58 LEU C C 13 178.200 0.3 . 1 . . . . A 58 LEU C . 30458 1 780 . 1 . 1 58 58 LEU CA C 13 58.324 0.3 . 1 . . . . A 58 LEU CA . 30458 1 781 . 1 . 1 58 58 LEU CB C 13 40.690 0.3 . 1 . . . . A 58 LEU CB . 30458 1 782 . 1 . 1 58 58 LEU CG C 13 27.839 0.3 . 1 . . . . A 58 LEU CG . 30458 1 783 . 1 . 1 58 58 LEU CD1 C 13 24.245 0.3 . 1 . . . . A 58 LEU CD1 . 30458 1 784 . 1 . 1 58 58 LEU CD2 C 13 26.538 0.3 . 1 . . . . A 58 LEU CD2 . 30458 1 785 . 1 . 1 58 58 LEU N N 15 122.905 0.3 . 1 . . . . A 58 LEU N . 30458 1 786 . 1 . 1 59 59 THR H H 1 8.685 0.020 . 1 . . . . A 59 THR H . 30458 1 787 . 1 . 1 59 59 THR HA H 1 3.736 0.020 . 1 . . . . A 59 THR HA . 30458 1 788 . 1 . 1 59 59 THR HB H 1 4.270 0.020 . 1 . . . . A 59 THR HB . 30458 1 789 . 1 . 1 59 59 THR HG21 H 1 1.178 0.020 . 1 . . . . A 59 THR HG21 . 30458 1 790 . 1 . 1 59 59 THR HG22 H 1 1.178 0.020 . 1 . . . . A 59 THR HG22 . 30458 1 791 . 1 . 1 59 59 THR HG23 H 1 1.178 0.020 . 1 . . . . A 59 THR HG23 . 30458 1 792 . 1 . 1 59 59 THR C C 13 176.800 0.3 . 1 . . . . A 59 THR C . 30458 1 793 . 1 . 1 59 59 THR CA C 13 67.780 0.3 . 1 . . . . A 59 THR CA . 30458 1 794 . 1 . 1 59 59 THR CB C 13 68.440 0.3 . 1 . . . . A 59 THR CB . 30458 1 795 . 1 . 1 59 59 THR CG2 C 13 22.136 0.3 . 1 . . . . A 59 THR CG2 . 30458 1 796 . 1 . 1 59 59 THR N N 15 118.213 0.3 . 1 . . . . A 59 THR N . 30458 1 797 . 1 . 1 60 60 THR H H 1 8.388 0.020 . 1 . . . . A 60 THR H . 30458 1 798 . 1 . 1 60 60 THR HA H 1 3.930 0.020 . 1 . . . . A 60 THR HA . 30458 1 799 . 1 . 1 60 60 THR HB H 1 4.198 0.020 . 1 . . . . A 60 THR HB . 30458 1 800 . 1 . 1 60 60 THR HG21 H 1 1.212 0.020 . 1 . . . . A 60 THR HG21 . 30458 1 801 . 1 . 1 60 60 THR HG22 H 1 1.212 0.020 . 1 . . . . A 60 THR HG22 . 30458 1 802 . 1 . 1 60 60 THR HG23 H 1 1.212 0.020 . 1 . . . . A 60 THR HG23 . 30458 1 803 . 1 . 1 60 60 THR C C 13 176.400 0.3 . 1 . . . . A 60 THR C . 30458 1 804 . 1 . 1 60 60 THR CA C 13 67.131 0.3 . 1 . . . . A 60 THR CA . 30458 1 805 . 1 . 1 60 60 THR CB C 13 68.618 0.3 . 1 . . . . A 60 THR CB . 30458 1 806 . 1 . 1 60 60 THR CG2 C 13 21.743 0.3 . 1 . . . . A 60 THR CG2 . 30458 1 807 . 1 . 1 60 60 THR N N 15 118.340 0.3 . 1 . . . . A 60 THR N . 30458 1 808 . 1 . 1 61 61 ALA H H 1 8.001 0.020 . 1 . . . . A 61 ALA H . 30458 1 809 . 1 . 1 61 61 ALA HA H 1 4.091 0.020 . 1 . . . . A 61 ALA HA . 30458 1 810 . 1 . 1 61 61 ALA HB1 H 1 1.365 0.020 . 1 . . . . A 61 ALA HB1 . 30458 1 811 . 1 . 1 61 61 ALA HB2 H 1 1.365 0.020 . 1 . . . . A 61 ALA HB2 . 30458 1 812 . 1 . 1 61 61 ALA HB3 H 1 1.365 0.020 . 1 . . . . A 61 ALA HB3 . 30458 1 813 . 1 . 1 61 61 ALA C C 13 180.081 0.3 . 1 . . . . A 61 ALA C . 30458 1 814 . 1 . 1 61 61 ALA CA C 13 55.771 0.3 . 1 . . . . A 61 ALA CA . 30458 1 815 . 1 . 1 61 61 ALA CB C 13 18.832 0.3 . 1 . . . . A 61 ALA CB . 30458 1 816 . 1 . 1 61 61 ALA N N 15 124.782 0.3 . 1 . . . . A 61 ALA N . 30458 1 817 . 1 . 1 62 62 MET H H 1 8.863 0.020 . 1 . . . . A 62 MET H . 30458 1 818 . 1 . 1 62 62 MET HA H 1 4.078 0.020 . 1 . . . . A 62 MET HA . 30458 1 819 . 1 . 1 62 62 MET HB2 H 1 1.975 0.020 . 2 . . . . A 62 MET HB2 . 30458 1 820 . 1 . 1 62 62 MET HB3 H 1 2.348 0.020 . 2 . . . . A 62 MET HB3 . 30458 1 821 . 1 . 1 62 62 MET HG2 H 1 2.303 0.020 . 2 . . . . A 62 MET HG2 . 30458 1 822 . 1 . 1 62 62 MET HG3 H 1 2.706 0.020 . 2 . . . . A 62 MET HG3 . 30458 1 823 . 1 . 1 62 62 MET HE1 H 1 1.965 0.020 . 1 . . . . A 62 MET HE1 . 30458 1 824 . 1 . 1 62 62 MET HE2 H 1 1.965 0.020 . 1 . . . . A 62 MET HE2 . 30458 1 825 . 1 . 1 62 62 MET HE3 H 1 1.965 0.020 . 1 . . . . A 62 MET HE3 . 30458 1 826 . 1 . 1 62 62 MET C C 13 178.300 0.3 . 1 . . . . A 62 MET C . 30458 1 827 . 1 . 1 62 62 MET CA C 13 59.755 0.3 . 1 . . . . A 62 MET CA . 30458 1 828 . 1 . 1 62 62 MET CB C 13 32.945 0.3 . 1 . . . . A 62 MET CB . 30458 1 829 . 1 . 1 62 62 MET CG C 13 33.644 0.3 . 1 . . . . A 62 MET CG . 30458 1 830 . 1 . 1 62 62 MET CE C 13 17.411 0.3 . 1 . . . . A 62 MET CE . 30458 1 831 . 1 . 1 62 62 MET N N 15 118.350 0.3 . 1 . . . . A 62 MET N . 30458 1 832 . 1 . 1 63 63 ASN H H 1 8.384 0.020 . 1 . . . . A 63 ASN H . 30458 1 833 . 1 . 1 63 63 ASN HA H 1 4.532 0.020 . 1 . . . . A 63 ASN HA . 30458 1 834 . 1 . 1 63 63 ASN HB2 H 1 2.826 0.020 . 2 . . . . A 63 ASN HB2 . 30458 1 835 . 1 . 1 63 63 ASN HB3 H 1 3.038 0.020 . 2 . . . . A 63 ASN HB3 . 30458 1 836 . 1 . 1 63 63 ASN HD21 H 1 7.588 0.020 . 1 . . . . A 63 ASN HD21 . 30458 1 837 . 1 . 1 63 63 ASN HD22 H 1 6.907 0.020 . 1 . . . . A 63 ASN HD22 . 30458 1 838 . 1 . 1 63 63 ASN C C 13 179.159 0.3 . 1 . . . . A 63 ASN C . 30458 1 839 . 1 . 1 63 63 ASN CA C 13 56.286 0.3 . 1 . . . . A 63 ASN CA . 30458 1 840 . 1 . 1 63 63 ASN CB C 13 37.640 0.3 . 1 . . . . A 63 ASN CB . 30458 1 841 . 1 . 1 63 63 ASN N N 15 119.704 0.3 . 1 . . . . A 63 ASN N . 30458 1 842 . 1 . 1 63 63 ASN ND2 N 15 111.440 0.3 . 1 . . . . A 63 ASN ND2 . 30458 1 843 . 1 . 1 64 64 ARG H H 1 8.443 0.020 . 1 . . . . A 64 ARG H . 30458 1 844 . 1 . 1 64 64 ARG HA H 1 4.153 0.020 . 1 . . . . A 64 ARG HA . 30458 1 845 . 1 . 1 64 64 ARG HB2 H 1 1.917 0.020 . 2 . . . . A 64 ARG HB2 . 30458 1 846 . 1 . 1 64 64 ARG HB3 H 1 2.027 0.020 . 2 . . . . A 64 ARG HB3 . 30458 1 847 . 1 . 1 64 64 ARG HG2 H 1 1.668 0.020 . 2 . . . . A 64 ARG HG2 . 30458 1 848 . 1 . 1 64 64 ARG HG3 H 1 1.935 0.020 . 2 . . . . A 64 ARG HG3 . 30458 1 849 . 1 . 1 64 64 ARG HD2 H 1 3.199 0.020 . 1 . . . . A 64 ARG HD2 . 30458 1 850 . 1 . 1 64 64 ARG HD3 H 1 3.199 0.020 . 1 . . . . A 64 ARG HD3 . 30458 1 851 . 1 . 1 64 64 ARG C C 13 179.300 0.3 . 1 . . . . A 64 ARG C . 30458 1 852 . 1 . 1 64 64 ARG CA C 13 59.952 0.3 . 1 . . . . A 64 ARG CA . 30458 1 853 . 1 . 1 64 64 ARG CB C 13 30.640 0.3 . 1 . . . . A 64 ARG CB . 30458 1 854 . 1 . 1 64 64 ARG CG C 13 28.316 0.3 . 1 . . . . A 64 ARG CG . 30458 1 855 . 1 . 1 64 64 ARG CD C 13 43.801 0.3 . 1 . . . . A 64 ARG CD . 30458 1 856 . 1 . 1 64 64 ARG N N 15 122.612 0.3 . 1 . . . . A 64 ARG N . 30458 1 857 . 1 . 1 65 65 PHE H H 1 8.538 0.020 . 1 . . . . A 65 PHE H . 30458 1 858 . 1 . 1 65 65 PHE HA H 1 4.446 0.020 . 1 . . . . A 65 PHE HA . 30458 1 859 . 1 . 1 65 65 PHE HB2 H 1 3.244 0.020 . 2 . . . . A 65 PHE HB2 . 30458 1 860 . 1 . 1 65 65 PHE HB3 H 1 3.345 0.020 . 2 . . . . A 65 PHE HB3 . 30458 1 861 . 1 . 1 65 65 PHE HD1 H 1 7.145 0.020 . 1 . . . . A 65 PHE HD1 . 30458 1 862 . 1 . 1 65 65 PHE HD2 H 1 7.145 0.020 . 1 . . . . A 65 PHE HD2 . 30458 1 863 . 1 . 1 65 65 PHE HE1 H 1 7.178 0.020 . 1 . . . . A 65 PHE HE1 . 30458 1 864 . 1 . 1 65 65 PHE HE2 H 1 7.178 0.020 . 1 . . . . A 65 PHE HE2 . 30458 1 865 . 1 . 1 65 65 PHE HZ H 1 6.949 0.020 . 1 . . . . A 65 PHE HZ . 30458 1 866 . 1 . 1 65 65 PHE C C 13 176.400 0.3 . 1 . . . . A 65 PHE C . 30458 1 867 . 1 . 1 65 65 PHE CA C 13 60.475 0.3 . 1 . . . . A 65 PHE CA . 30458 1 868 . 1 . 1 65 65 PHE CB C 13 39.553 0.3 . 1 . . . . A 65 PHE CB . 30458 1 869 . 1 . 1 65 65 PHE CD1 C 13 130.989 0.3 . 1 . . . . A 65 PHE CD1 . 30458 1 870 . 1 . 1 65 65 PHE CE1 C 13 130.897 0.3 . 1 . . . . A 65 PHE CE1 . 30458 1 871 . 1 . 1 65 65 PHE CZ C 13 129.476 0.3 . 1 . . . . A 65 PHE CZ . 30458 1 872 . 1 . 1 65 65 PHE N N 15 122.963 0.3 . 1 . . . . A 65 PHE N . 30458 1 873 . 1 . 1 66 66 LYS H H 1 8.688 0.020 . 1 . . . . A 66 LYS H . 30458 1 874 . 1 . 1 66 66 LYS HA H 1 3.552 0.020 . 1 . . . . A 66 LYS HA . 30458 1 875 . 1 . 1 66 66 LYS HB2 H 1 1.785 0.020 . 2 . . . . A 66 LYS HB2 . 30458 1 876 . 1 . 1 66 66 LYS HB3 H 1 2.108 0.020 . 2 . . . . A 66 LYS HB3 . 30458 1 877 . 1 . 1 66 66 LYS HG2 H 1 1.184 0.020 . 2 . . . . A 66 LYS HG2 . 30458 1 878 . 1 . 1 66 66 LYS HG3 H 1 1.351 0.020 . 2 . . . . A 66 LYS HG3 . 30458 1 879 . 1 . 1 66 66 LYS HD2 H 1 1.629 0.020 . 1 . . . . A 66 LYS HD2 . 30458 1 880 . 1 . 1 66 66 LYS HD3 H 1 1.629 0.020 . 1 . . . . A 66 LYS HD3 . 30458 1 881 . 1 . 1 66 66 LYS HE2 H 1 2.835 0.020 . 1 . . . . A 66 LYS HE2 . 30458 1 882 . 1 . 1 66 66 LYS HE3 H 1 2.835 0.020 . 1 . . . . A 66 LYS HE3 . 30458 1 883 . 1 . 1 66 66 LYS C C 13 177.482 0.3 . 1 . . . . A 66 LYS C . 30458 1 884 . 1 . 1 66 66 LYS CA C 13 60.811 0.3 . 1 . . . . A 66 LYS CA . 30458 1 885 . 1 . 1 66 66 LYS CB C 13 32.589 0.3 . 1 . . . . A 66 LYS CB . 30458 1 886 . 1 . 1 66 66 LYS CG C 13 25.164 0.3 . 1 . . . . A 66 LYS CG . 30458 1 887 . 1 . 1 66 66 LYS CD C 13 29.685 0.3 . 1 . . . . A 66 LYS CD . 30458 1 888 . 1 . 1 66 66 LYS CE C 13 41.700 0.3 . 1 . . . . A 66 LYS CE . 30458 1 889 . 1 . 1 66 66 LYS N N 15 119.866 0.3 . 1 . . . . A 66 LYS N . 30458 1 890 . 1 . 1 67 67 ALA H H 1 7.913 0.020 . 1 . . . . A 67 ALA H . 30458 1 891 . 1 . 1 67 67 ALA HA H 1 4.204 0.020 . 1 . . . . A 67 ALA HA . 30458 1 892 . 1 . 1 67 67 ALA HB1 H 1 1.492 0.020 . 1 . . . . A 67 ALA HB1 . 30458 1 893 . 1 . 1 67 67 ALA HB2 H 1 1.492 0.020 . 1 . . . . A 67 ALA HB2 . 30458 1 894 . 1 . 1 67 67 ALA HB3 H 1 1.492 0.020 . 1 . . . . A 67 ALA HB3 . 30458 1 895 . 1 . 1 67 67 ALA C C 13 180.400 0.3 . 1 . . . . A 67 ALA C . 30458 1 896 . 1 . 1 67 67 ALA CA C 13 55.266 0.3 . 1 . . . . A 67 ALA CA . 30458 1 897 . 1 . 1 67 67 ALA CB C 13 18.116 0.3 . 1 . . . . A 67 ALA CB . 30458 1 898 . 1 . 1 67 67 ALA N N 15 118.932 0.3 . 1 . . . . A 67 ALA N . 30458 1 899 . 1 . 1 68 68 ALA H H 1 7.913 0.020 . 1 . . . . A 68 ALA H . 30458 1 900 . 1 . 1 68 68 ALA HA H 1 4.150 0.020 . 1 . . . . A 68 ALA HA . 30458 1 901 . 1 . 1 68 68 ALA HB1 H 1 1.477 0.020 . 1 . . . . A 68 ALA HB1 . 30458 1 902 . 1 . 1 68 68 ALA HB2 H 1 1.477 0.020 . 1 . . . . A 68 ALA HB2 . 30458 1 903 . 1 . 1 68 68 ALA HB3 H 1 1.477 0.020 . 1 . . . . A 68 ALA HB3 . 30458 1 904 . 1 . 1 68 68 ALA C C 13 179.800 0.3 . 1 . . . . A 68 ALA C . 30458 1 905 . 1 . 1 68 68 ALA CA C 13 55.333 0.3 . 1 . . . . A 68 ALA CA . 30458 1 906 . 1 . 1 68 68 ALA CB C 13 17.875 0.3 . 1 . . . . A 68 ALA CB . 30458 1 907 . 1 . 1 68 68 ALA N N 15 122.024 0.3 . 1 . . . . A 68 ALA N . 30458 1 908 . 1 . 1 69 69 LEU H H 1 8.063 0.020 . 1 . . . . A 69 LEU H . 30458 1 909 . 1 . 1 69 69 LEU HA H 1 3.811 0.020 . 1 . . . . A 69 LEU HA . 30458 1 910 . 1 . 1 69 69 LEU HB2 H 1 1.939 0.020 . 2 . . . . A 69 LEU HB2 . 30458 1 911 . 1 . 1 69 69 LEU HB3 H 1 1.019 0.020 . 2 . . . . A 69 LEU HB3 . 30458 1 912 . 1 . 1 69 69 LEU HG H 1 1.155 0.020 . 1 . . . . A 69 LEU HG . 30458 1 913 . 1 . 1 69 69 LEU HD11 H 1 0.480 0.020 . 1 . . . . A 69 LEU HD11 . 30458 1 914 . 1 . 1 69 69 LEU HD12 H 1 0.480 0.020 . 1 . . . . A 69 LEU HD12 . 30458 1 915 . 1 . 1 69 69 LEU HD13 H 1 0.480 0.020 . 1 . . . . A 69 LEU HD13 . 30458 1 916 . 1 . 1 69 69 LEU HD21 H 1 0.339 0.020 . 1 . . . . A 69 LEU HD21 . 30458 1 917 . 1 . 1 69 69 LEU HD22 H 1 0.339 0.020 . 1 . . . . A 69 LEU HD22 . 30458 1 918 . 1 . 1 69 69 LEU HD23 H 1 0.339 0.020 . 1 . . . . A 69 LEU HD23 . 30458 1 919 . 1 . 1 69 69 LEU C C 13 179.200 0.3 . 1 . . . . A 69 LEU C . 30458 1 920 . 1 . 1 69 69 LEU CA C 13 57.756 0.3 . 1 . . . . A 69 LEU CA . 30458 1 921 . 1 . 1 69 69 LEU CB C 13 41.630 0.3 . 1 . . . . A 69 LEU CB . 30458 1 922 . 1 . 1 69 69 LEU CG C 13 26.158 0.3 . 1 . . . . A 69 LEU CG . 30458 1 923 . 1 . 1 69 69 LEU CD1 C 13 23.509 0.3 . 1 . . . . A 69 LEU CD1 . 30458 1 924 . 1 . 1 69 69 LEU CD2 C 13 27.432 0.3 . 1 . . . . A 69 LEU CD2 . 30458 1 925 . 1 . 1 69 69 LEU N N 15 118.742 0.3 . 1 . . . . A 69 LEU N . 30458 1 926 . 1 . 1 70 70 GLU H H 1 8.572 0.020 . 1 . . . . A 70 GLU H . 30458 1 927 . 1 . 1 70 70 GLU HA H 1 3.889 0.020 . 1 . . . . A 70 GLU HA . 30458 1 928 . 1 . 1 70 70 GLU HB2 H 1 1.930 0.020 . 2 . . . . A 70 GLU HB2 . 30458 1 929 . 1 . 1 70 70 GLU HB3 H 1 2.203 0.020 . 2 . . . . A 70 GLU HB3 . 30458 1 930 . 1 . 1 70 70 GLU HG2 H 1 2.143 0.020 . 2 . . . . A 70 GLU HG2 . 30458 1 931 . 1 . 1 70 70 GLU HG3 H 1 2.427 0.020 . 2 . . . . A 70 GLU HG3 . 30458 1 932 . 1 . 1 70 70 GLU C C 13 180.500 0.3 . 1 . . . . A 70 GLU C . 30458 1 933 . 1 . 1 70 70 GLU CA C 13 60.030 0.3 . 1 . . . . A 70 GLU CA . 30458 1 934 . 1 . 1 70 70 GLU CB C 13 29.201 0.3 . 1 . . . . A 70 GLU CB . 30458 1 935 . 1 . 1 70 70 GLU CG C 13 37.461 0.3 . 1 . . . . A 70 GLU CG . 30458 1 936 . 1 . 1 70 70 GLU N N 15 120.447 0.3 . 1 . . . . A 70 GLU N . 30458 1 937 . 1 . 1 71 71 GLU H H 1 8.223 0.020 . 1 . . . . A 71 GLU H . 30458 1 938 . 1 . 1 71 71 GLU HA H 1 4.033 0.020 . 1 . . . . A 71 GLU HA . 30458 1 939 . 1 . 1 71 71 GLU HB2 H 1 2.147 0.020 . 1 . . . . A 71 GLU HB2 . 30458 1 940 . 1 . 1 71 71 GLU HB3 H 1 2.147 0.020 . 1 . . . . A 71 GLU HB3 . 30458 1 941 . 1 . 1 71 71 GLU HG2 H 1 2.039 0.020 . 2 . . . . A 71 GLU HG2 . 30458 1 942 . 1 . 1 71 71 GLU HG3 H 1 2.399 0.020 . 2 . . . . A 71 GLU HG3 . 30458 1 943 . 1 . 1 71 71 GLU C C 13 179.600 0.3 . 1 . . . . A 71 GLU C . 30458 1 944 . 1 . 1 71 71 GLU CA C 13 59.900 0.3 . 1 . . . . A 71 GLU CA . 30458 1 945 . 1 . 1 71 71 GLU CB C 13 29.386 0.3 . 1 . . . . A 71 GLU CB . 30458 1 946 . 1 . 1 71 71 GLU CG C 13 36.660 0.3 . 1 . . . . A 71 GLU CG . 30458 1 947 . 1 . 1 71 71 GLU N N 15 122.078 0.3 . 1 . . . . A 71 GLU N . 30458 1 948 . 1 . 1 72 72 ALA H H 1 8.357 0.020 . 1 . . . . A 72 ALA H . 30458 1 949 . 1 . 1 72 72 ALA HA H 1 3.848 0.020 . 1 . . . . A 72 ALA HA . 30458 1 950 . 1 . 1 72 72 ALA HB1 H 1 1.373 0.020 . 1 . . . . A 72 ALA HB1 . 30458 1 951 . 1 . 1 72 72 ALA HB2 H 1 1.373 0.020 . 1 . . . . A 72 ALA HB2 . 30458 1 952 . 1 . 1 72 72 ALA HB3 H 1 1.373 0.020 . 1 . . . . A 72 ALA HB3 . 30458 1 953 . 1 . 1 72 72 ALA C C 13 178.500 0.3 . 1 . . . . A 72 ALA C . 30458 1 954 . 1 . 1 72 72 ALA CA C 13 55.928 0.3 . 1 . . . . A 72 ALA CA . 30458 1 955 . 1 . 1 72 72 ALA CB C 13 17.288 0.3 . 1 . . . . A 72 ALA CB . 30458 1 956 . 1 . 1 72 72 ALA N N 15 122.800 0.3 . 1 . . . . A 72 ALA N . 30458 1 957 . 1 . 1 73 73 ASN H H 1 8.481 0.020 . 1 . . . . A 73 ASN H . 30458 1 958 . 1 . 1 73 73 ASN HA H 1 4.402 0.020 . 1 . . . . A 73 ASN HA . 30458 1 959 . 1 . 1 73 73 ASN HB2 H 1 2.472 0.020 . 2 . . . . A 73 ASN HB2 . 30458 1 960 . 1 . 1 73 73 ASN HB3 H 1 2.877 0.020 . 2 . . . . A 73 ASN HB3 . 30458 1 961 . 1 . 1 73 73 ASN HD21 H 1 7.453 0.020 . 1 . . . . A 73 ASN HD21 . 30458 1 962 . 1 . 1 73 73 ASN HD22 H 1 6.370 0.020 . 1 . . . . A 73 ASN HD22 . 30458 1 963 . 1 . 1 73 73 ASN C C 13 177.482 0.3 . 1 . . . . A 73 ASN C . 30458 1 964 . 1 . 1 73 73 ASN CA C 13 56.442 0.3 . 1 . . . . A 73 ASN CA . 30458 1 965 . 1 . 1 73 73 ASN CB C 13 39.009 0.3 . 1 . . . . A 73 ASN CB . 30458 1 966 . 1 . 1 73 73 ASN N N 15 115.649 0.3 . 1 . . . . A 73 ASN N . 30458 1 967 . 1 . 1 73 73 ASN ND2 N 15 109.983 0.3 . 1 . . . . A 73 ASN ND2 . 30458 1 968 . 1 . 1 74 74 GLY H H 1 8.016 0.020 . 1 . . . . A 74 GLY H . 30458 1 969 . 1 . 1 74 74 GLY HA2 H 1 3.838 0.020 . 2 . . . . A 74 GLY HA2 . 30458 1 970 . 1 . 1 74 74 GLY HA3 H 1 3.950 0.020 . 2 . . . . A 74 GLY HA3 . 30458 1 971 . 1 . 1 74 74 GLY C C 13 177.100 0.3 . 1 . . . . A 74 GLY C . 30458 1 972 . 1 . 1 74 74 GLY CA C 13 47.099 0.3 . 1 . . . . A 74 GLY CA . 30458 1 973 . 1 . 1 74 74 GLY N N 15 105.250 0.3 . 1 . . . . A 74 GLY N . 30458 1 974 . 1 . 1 75 75 GLU H H 1 8.059 0.020 . 1 . . . . A 75 GLU H . 30458 1 975 . 1 . 1 75 75 GLU HA H 1 4.075 0.020 . 1 . . . . A 75 GLU HA . 30458 1 976 . 1 . 1 75 75 GLU HB2 H 1 2.247 0.020 . 2 . . . . A 75 GLU HB2 . 30458 1 977 . 1 . 1 75 75 GLU HB3 H 1 2.326 0.020 . 2 . . . . A 75 GLU HB3 . 30458 1 978 . 1 . 1 75 75 GLU HG2 H 1 2.403 0.020 . 1 . . . . A 75 GLU HG2 . 30458 1 979 . 1 . 1 75 75 GLU HG3 H 1 2.403 0.020 . 1 . . . . A 75 GLU HG3 . 30458 1 980 . 1 . 1 75 75 GLU C C 13 178.500 0.3 . 1 . . . . A 75 GLU C . 30458 1 981 . 1 . 1 75 75 GLU CA C 13 58.715 0.3 . 1 . . . . A 75 GLU CA . 30458 1 982 . 1 . 1 75 75 GLU CB C 13 29.868 0.3 . 1 . . . . A 75 GLU CB . 30458 1 983 . 1 . 1 75 75 GLU CG C 13 36.385 0.3 . 1 . . . . A 75 GLU CG . 30458 1 984 . 1 . 1 75 75 GLU N N 15 123.325 0.3 . 1 . . . . A 75 GLU N . 30458 1 985 . 1 . 1 76 76 ILE H H 1 8.335 0.020 . 1 . . . . A 76 ILE H . 30458 1 986 . 1 . 1 76 76 ILE HA H 1 3.775 0.020 . 1 . . . . A 76 ILE HA . 30458 1 987 . 1 . 1 76 76 ILE HB H 1 1.970 0.020 . 1 . . . . A 76 ILE HB . 30458 1 988 . 1 . 1 76 76 ILE HG12 H 1 0.984 0.020 . 2 . . . . A 76 ILE HG12 . 30458 1 989 . 1 . 1 76 76 ILE HG13 H 1 1.566 0.020 . 2 . . . . A 76 ILE HG13 . 30458 1 990 . 1 . 1 76 76 ILE HG21 H 1 0.870 0.020 . 1 . . . . A 76 ILE HG21 . 30458 1 991 . 1 . 1 76 76 ILE HG22 H 1 0.870 0.020 . 1 . . . . A 76 ILE HG22 . 30458 1 992 . 1 . 1 76 76 ILE HG23 H 1 0.870 0.020 . 1 . . . . A 76 ILE HG23 . 30458 1 993 . 1 . 1 76 76 ILE HD11 H 1 0.735 0.020 . 1 . . . . A 76 ILE HD11 . 30458 1 994 . 1 . 1 76 76 ILE HD12 H 1 0.735 0.020 . 1 . . . . A 76 ILE HD12 . 30458 1 995 . 1 . 1 76 76 ILE HD13 H 1 0.735 0.020 . 1 . . . . A 76 ILE HD13 . 30458 1 996 . 1 . 1 76 76 ILE C C 13 178.300 0.3 . 1 . . . . A 76 ILE C . 30458 1 997 . 1 . 1 76 76 ILE CA C 13 65.639 0.3 . 1 . . . . A 76 ILE CA . 30458 1 998 . 1 . 1 76 76 ILE CB C 13 37.794 0.3 . 1 . . . . A 76 ILE CB . 30458 1 999 . 1 . 1 76 76 ILE CG1 C 13 29.154 0.3 . 1 . . . . A 76 ILE CG1 . 30458 1 1000 . 1 . 1 76 76 ILE CG2 C 13 18.064 0.3 . 1 . . . . A 76 ILE CG2 . 30458 1 1001 . 1 . 1 76 76 ILE CD1 C 13 16.828 0.3 . 1 . . . . A 76 ILE CD1 . 30458 1 1002 . 1 . 1 76 76 ILE N N 15 120.296 0.3 . 1 . . . . A 76 ILE N . 30458 1 1003 . 1 . 1 77 77 GLU H H 1 7.833 0.020 . 1 . . . . A 77 GLU H . 30458 1 1004 . 1 . 1 77 77 GLU HA H 1 3.920 0.020 . 1 . . . . A 77 GLU HA . 30458 1 1005 . 1 . 1 77 77 GLU HB2 H 1 2.044 0.020 . 1 . . . . A 77 GLU HB2 . 30458 1 1006 . 1 . 1 77 77 GLU HB3 H 1 2.044 0.020 . 1 . . . . A 77 GLU HB3 . 30458 1 1007 . 1 . 1 77 77 GLU HG2 H 1 2.206 0.020 . 1 . . . . A 77 GLU HG2 . 30458 1 1008 . 1 . 1 77 77 GLU HG3 H 1 2.206 0.020 . 1 . . . . A 77 GLU HG3 . 30458 1 1009 . 1 . 1 77 77 GLU C C 13 180.200 0.3 . 1 . . . . A 77 GLU C . 30458 1 1010 . 1 . 1 77 77 GLU CA C 13 59.700 0.3 . 1 . . . . A 77 GLU CA . 30458 1 1011 . 1 . 1 77 77 GLU CB C 13 29.256 0.3 . 1 . . . . A 77 GLU CB . 30458 1 1012 . 1 . 1 77 77 GLU CG C 13 35.669 0.3 . 1 . . . . A 77 GLU CG . 30458 1 1013 . 1 . 1 77 77 GLU N N 15 119.274 0.3 . 1 . . . . A 77 GLU N . 30458 1 1014 . 1 . 1 78 78 LYS H H 1 7.711 0.020 . 1 . . . . A 78 LYS H . 30458 1 1015 . 1 . 1 78 78 LYS HA H 1 3.852 0.020 . 1 . . . . A 78 LYS HA . 30458 1 1016 . 1 . 1 78 78 LYS HB2 H 1 1.479 0.020 . 2 . . . . A 78 LYS HB2 . 30458 1 1017 . 1 . 1 78 78 LYS HB3 H 1 1.588 0.020 . 2 . . . . A 78 LYS HB3 . 30458 1 1018 . 1 . 1 78 78 LYS HG2 H 1 0.489 0.020 . 2 . . . . A 78 LYS HG2 . 30458 1 1019 . 1 . 1 78 78 LYS HG3 H 1 1.170 0.020 . 2 . . . . A 78 LYS HG3 . 30458 1 1020 . 1 . 1 78 78 LYS HD2 H 1 1.196 0.020 . 2 . . . . A 78 LYS HD2 . 30458 1 1021 . 1 . 1 78 78 LYS HD3 H 1 1.292 0.020 . 2 . . . . A 78 LYS HD3 . 30458 1 1022 . 1 . 1 78 78 LYS HE2 H 1 2.307 0.020 . 2 . . . . A 78 LYS HE2 . 30458 1 1023 . 1 . 1 78 78 LYS HE3 H 1 2.453 0.020 . 2 . . . . A 78 LYS HE3 . 30458 1 1024 . 1 . 1 78 78 LYS C C 13 179.200 0.3 . 1 . . . . A 78 LYS C . 30458 1 1025 . 1 . 1 78 78 LYS CA C 13 60.037 0.3 . 1 . . . . A 78 LYS CA . 30458 1 1026 . 1 . 1 78 78 LYS CB C 13 32.339 0.3 . 1 . . . . A 78 LYS CB . 30458 1 1027 . 1 . 1 78 78 LYS CG C 13 24.174 0.3 . 1 . . . . A 78 LYS CG . 30458 1 1028 . 1 . 1 78 78 LYS CD C 13 29.465 0.3 . 1 . . . . A 78 LYS CD . 30458 1 1029 . 1 . 1 78 78 LYS CE C 13 41.475 0.3 . 1 . . . . A 78 LYS CE . 30458 1 1030 . 1 . 1 78 78 LYS N N 15 121.462 0.3 . 1 . . . . A 78 LYS N . 30458 1 1031 . 1 . 1 79 79 PHE H H 1 8.160 0.020 . 1 . . . . A 79 PHE H . 30458 1 1032 . 1 . 1 79 79 PHE HA H 1 4.642 0.020 . 1 . . . . A 79 PHE HA . 30458 1 1033 . 1 . 1 79 79 PHE HB2 H 1 2.675 0.020 . 2 . . . . A 79 PHE HB2 . 30458 1 1034 . 1 . 1 79 79 PHE HB3 H 1 3.279 0.020 . 2 . . . . A 79 PHE HB3 . 30458 1 1035 . 1 . 1 79 79 PHE HD1 H 1 6.741 0.020 . 1 . . . . A 79 PHE HD1 . 30458 1 1036 . 1 . 1 79 79 PHE HD2 H 1 6.741 0.020 . 1 . . . . A 79 PHE HD2 . 30458 1 1037 . 1 . 1 79 79 PHE HE1 H 1 6.842 0.020 . 1 . . . . A 79 PHE HE1 . 30458 1 1038 . 1 . 1 79 79 PHE HE2 H 1 6.842 0.020 . 1 . . . . A 79 PHE HE2 . 30458 1 1039 . 1 . 1 79 79 PHE HZ H 1 6.542 0.020 . 1 . . . . A 79 PHE HZ . 30458 1 1040 . 1 . 1 79 79 PHE C C 13 174.100 0.3 . 1 . . . . A 79 PHE C . 30458 1 1041 . 1 . 1 79 79 PHE CA C 13 58.304 0.3 . 1 . . . . A 79 PHE CA . 30458 1 1042 . 1 . 1 79 79 PHE CB C 13 36.984 0.3 . 1 . . . . A 79 PHE CB . 30458 1 1043 . 1 . 1 79 79 PHE CD1 C 13 130.274 0.3 . 1 . . . . A 79 PHE CD1 . 30458 1 1044 . 1 . 1 79 79 PHE CE1 C 13 131.106 0.3 . 1 . . . . A 79 PHE CE1 . 30458 1 1045 . 1 . 1 79 79 PHE CZ C 13 129.942 0.3 . 1 . . . . A 79 PHE CZ . 30458 1 1046 . 1 . 1 79 79 PHE N N 15 115.784 0.3 . 1 . . . . A 79 PHE N . 30458 1 1047 . 1 . 1 80 80 SER H H 1 7.649 0.020 . 1 . . . . A 80 SER H . 30458 1 1048 . 1 . 1 80 80 SER HA H 1 4.454 0.020 . 1 . . . . A 80 SER HA . 30458 1 1049 . 1 . 1 80 80 SER HB2 H 1 4.034 0.020 . 2 . . . . A 80 SER HB2 . 30458 1 1050 . 1 . 1 80 80 SER HB3 H 1 4.084 0.020 . 2 . . . . A 80 SER HB3 . 30458 1 1051 . 1 . 1 80 80 SER C C 13 173.700 0.3 . 1 . . . . A 80 SER C . 30458 1 1052 . 1 . 1 80 80 SER CA C 13 60.734 0.3 . 1 . . . . A 80 SER CA . 30458 1 1053 . 1 . 1 80 80 SER CB C 13 63.712 0.3 . 1 . . . . A 80 SER CB . 30458 1 1054 . 1 . 1 80 80 SER N N 15 113.079 0.3 . 1 . . . . A 80 SER N . 30458 1 1055 . 1 . 1 81 81 ASN H H 1 7.267 0.020 . 1 . . . . A 81 ASN H . 30458 1 1056 . 1 . 1 81 81 ASN HA H 1 4.929 0.020 . 1 . . . . A 81 ASN HA . 30458 1 1057 . 1 . 1 81 81 ASN HB2 H 1 2.836 0.020 . 2 . . . . A 81 ASN HB2 . 30458 1 1058 . 1 . 1 81 81 ASN HB3 H 1 2.981 0.020 . 2 . . . . A 81 ASN HB3 . 30458 1 1059 . 1 . 1 81 81 ASN HD21 H 1 7.674 0.020 . 1 . . . . A 81 ASN HD21 . 30458 1 1060 . 1 . 1 81 81 ASN HD22 H 1 7.021 0.020 . 1 . . . . A 81 ASN HD22 . 30458 1 1061 . 1 . 1 81 81 ASN C C 13 175.178 0.3 . 1 . . . . A 81 ASN C . 30458 1 1062 . 1 . 1 81 81 ASN CA C 13 52.384 0.3 . 1 . . . . A 81 ASN CA . 30458 1 1063 . 1 . 1 81 81 ASN CB C 13 40.386 0.3 . 1 . . . . A 81 ASN CB . 30458 1 1064 . 1 . 1 81 81 ASN N N 15 119.440 0.3 . 1 . . . . A 81 ASN N . 30458 1 1065 . 1 . 1 81 81 ASN ND2 N 15 113.318 0.3 . 1 . . . . A 81 ASN ND2 . 30458 1 1066 . 1 . 1 82 82 ARG H H 1 8.390 0.020 . 1 . . . . A 82 ARG H . 30458 1 1067 . 1 . 1 82 82 ARG HA H 1 3.549 0.020 . 1 . . . . A 82 ARG HA . 30458 1 1068 . 1 . 1 82 82 ARG HB2 H 1 1.725 0.020 . 1 . . . . A 82 ARG HB2 . 30458 1 1069 . 1 . 1 82 82 ARG HB3 H 1 1.725 0.020 . 1 . . . . A 82 ARG HB3 . 30458 1 1070 . 1 . 1 82 82 ARG HG2 H 1 1.108 0.020 . 2 . . . . A 82 ARG HG2 . 30458 1 1071 . 1 . 1 82 82 ARG HG3 H 1 1.500 0.020 . 2 . . . . A 82 ARG HG3 . 30458 1 1072 . 1 . 1 82 82 ARG HD2 H 1 2.954 0.020 . 2 . . . . A 82 ARG HD2 . 30458 1 1073 . 1 . 1 82 82 ARG HD3 H 1 2.993 0.020 . 2 . . . . A 82 ARG HD3 . 30458 1 1074 . 1 . 1 82 82 ARG HE H 1 9.966 0.020 . 1 . . . . A 82 ARG HE . 30458 1 1075 . 1 . 1 82 82 ARG C C 13 177.700 0.3 . 1 . . . . A 82 ARG C . 30458 1 1076 . 1 . 1 82 82 ARG CA C 13 59.896 0.3 . 1 . . . . A 82 ARG CA . 30458 1 1077 . 1 . 1 82 82 ARG CB C 13 30.246 0.3 . 1 . . . . A 82 ARG CB . 30458 1 1078 . 1 . 1 82 82 ARG CG C 13 27.807 0.3 . 1 . . . . A 82 ARG CG . 30458 1 1079 . 1 . 1 82 82 ARG CD C 13 43.338 0.3 . 1 . . . . A 82 ARG CD . 30458 1 1080 . 1 . 1 82 82 ARG N N 15 127.019 0.3 . 1 . . . . A 82 ARG N . 30458 1 1081 . 1 . 1 82 82 ARG NE N 15 84.932 0.3 . 1 . . . . A 82 ARG NE . 30458 1 1082 . 1 . 1 83 83 SER H H 1 8.406 0.020 . 1 . . . . A 83 SER H . 30458 1 1083 . 1 . 1 83 83 SER HA H 1 3.892 0.020 . 1 . . . . A 83 SER HA . 30458 1 1084 . 1 . 1 83 83 SER HB2 H 1 4.180 0.020 . 1 . . . . A 83 SER HB2 . 30458 1 1085 . 1 . 1 83 83 SER HB3 H 1 4.180 0.020 . 1 . . . . A 83 SER HB3 . 30458 1 1086 . 1 . 1 83 83 SER C C 13 177.100 0.3 . 1 . . . . A 83 SER C . 30458 1 1087 . 1 . 1 83 83 SER CA C 13 62.346 0.3 . 1 . . . . A 83 SER CA . 30458 1 1088 . 1 . 1 83 83 SER CB C 13 61.936 0.3 . 1 . . . . A 83 SER CB . 30458 1 1089 . 1 . 1 83 83 SER N N 15 114.499 0.3 . 1 . . . . A 83 SER N . 30458 1 1090 . 1 . 1 84 84 ASN H H 1 7.963 0.020 . 1 . . . . A 84 ASN H . 30458 1 1091 . 1 . 1 84 84 ASN HA H 1 4.558 0.020 . 1 . . . . A 84 ASN HA . 30458 1 1092 . 1 . 1 84 84 ASN HB2 H 1 2.538 0.020 . 2 . . . . A 84 ASN HB2 . 30458 1 1093 . 1 . 1 84 84 ASN HB3 H 1 3.232 0.020 . 2 . . . . A 84 ASN HB3 . 30458 1 1094 . 1 . 1 84 84 ASN HD21 H 1 8.212 0.020 . 1 . . . . A 84 ASN HD21 . 30458 1 1095 . 1 . 1 84 84 ASN HD22 H 1 7.173 0.020 . 1 . . . . A 84 ASN HD22 . 30458 1 1096 . 1 . 1 84 84 ASN C C 13 178.206 0.3 . 1 . . . . A 84 ASN C . 30458 1 1097 . 1 . 1 84 84 ASN CA C 13 55.479 0.3 . 1 . . . . A 84 ASN CA . 30458 1 1098 . 1 . 1 84 84 ASN CB C 13 37.655 0.3 . 1 . . . . A 84 ASN CB . 30458 1 1099 . 1 . 1 84 84 ASN N N 15 119.619 0.3 . 1 . . . . A 84 ASN N . 30458 1 1100 . 1 . 1 84 84 ASN ND2 N 15 113.069 0.3 . 1 . . . . A 84 ASN ND2 . 30458 1 1101 . 1 . 1 85 85 ILE H H 1 7.752 0.020 . 1 . . . . A 85 ILE H . 30458 1 1102 . 1 . 1 85 85 ILE HA H 1 3.775 0.020 . 1 . . . . A 85 ILE HA . 30458 1 1103 . 1 . 1 85 85 ILE HB H 1 1.963 0.020 . 1 . . . . A 85 ILE HB . 30458 1 1104 . 1 . 1 85 85 ILE HG12 H 1 0.959 0.020 . 2 . . . . A 85 ILE HG12 . 30458 1 1105 . 1 . 1 85 85 ILE HG13 H 1 1.485 0.020 . 2 . . . . A 85 ILE HG13 . 30458 1 1106 . 1 . 1 85 85 ILE HG21 H 1 0.389 0.020 . 1 . . . . A 85 ILE HG21 . 30458 1 1107 . 1 . 1 85 85 ILE HG22 H 1 0.389 0.020 . 1 . . . . A 85 ILE HG22 . 30458 1 1108 . 1 . 1 85 85 ILE HG23 H 1 0.389 0.020 . 1 . . . . A 85 ILE HG23 . 30458 1 1109 . 1 . 1 85 85 ILE HD11 H 1 0.788 0.020 . 1 . . . . A 85 ILE HD11 . 30458 1 1110 . 1 . 1 85 85 ILE HD12 H 1 0.788 0.020 . 1 . . . . A 85 ILE HD12 . 30458 1 1111 . 1 . 1 85 85 ILE HD13 H 1 0.788 0.020 . 1 . . . . A 85 ILE HD13 . 30458 1 1112 . 1 . 1 85 85 ILE C C 13 176.900 0.3 . 1 . . . . A 85 ILE C . 30458 1 1113 . 1 . 1 85 85 ILE CA C 13 64.757 0.3 . 1 . . . . A 85 ILE CA . 30458 1 1114 . 1 . 1 85 85 ILE CB C 13 37.347 0.3 . 1 . . . . A 85 ILE CB . 30458 1 1115 . 1 . 1 85 85 ILE CG1 C 13 29.012 0.3 . 1 . . . . A 85 ILE CG1 . 30458 1 1116 . 1 . 1 85 85 ILE CG2 C 13 18.070 0.3 . 1 . . . . A 85 ILE CG2 . 30458 1 1117 . 1 . 1 85 85 ILE CD1 C 13 14.124 0.3 . 1 . . . . A 85 ILE CD1 . 30458 1 1118 . 1 . 1 85 85 ILE N N 15 122.120 0.3 . 1 . . . . A 85 ILE N . 30458 1 1119 . 1 . 1 86 86 CYS H H 1 8.330 0.020 . 1 . . . . A 86 CYS H . 30458 1 1120 . 1 . 1 86 86 CYS HA H 1 3.889 0.020 . 1 . . . . A 86 CYS HA . 30458 1 1121 . 1 . 1 86 86 CYS HB2 H 1 3.032 0.020 . 1 . . . . A 86 CYS HB2 . 30458 1 1122 . 1 . 1 86 86 CYS HB3 H 1 3.032 0.020 . 1 . . . . A 86 CYS HB3 . 30458 1 1123 . 1 . 1 86 86 CYS C C 13 177.400 0.3 . 1 . . . . A 86 CYS C . 30458 1 1124 . 1 . 1 86 86 CYS CA C 13 63.950 0.3 . 1 . . . . A 86 CYS CA . 30458 1 1125 . 1 . 1 86 86 CYS CB C 13 26.908 0.3 . 1 . . . . A 86 CYS CB . 30458 1 1126 . 1 . 1 86 86 CYS N N 15 119.200 0.3 . 1 . . . . A 86 CYS N . 30458 1 1127 . 1 . 1 87 87 ARG H H 1 7.897 0.020 . 1 . . . . A 87 ARG H . 30458 1 1128 . 1 . 1 87 87 ARG HA H 1 3.982 0.020 . 1 . . . . A 87 ARG HA . 30458 1 1129 . 1 . 1 87 87 ARG HB2 H 1 1.915 0.020 . 1 . . . . A 87 ARG HB2 . 30458 1 1130 . 1 . 1 87 87 ARG HB3 H 1 1.915 0.020 . 1 . . . . A 87 ARG HB3 . 30458 1 1131 . 1 . 1 87 87 ARG HG2 H 1 1.608 0.020 . 2 . . . . A 87 ARG HG2 . 30458 1 1132 . 1 . 1 87 87 ARG HG3 H 1 1.774 0.020 . 2 . . . . A 87 ARG HG3 . 30458 1 1133 . 1 . 1 87 87 ARG HD2 H 1 3.157 0.020 . 2 . . . . A 87 ARG HD2 . 30458 1 1134 . 1 . 1 87 87 ARG HD3 H 1 3.212 0.020 . 2 . . . . A 87 ARG HD3 . 30458 1 1135 . 1 . 1 87 87 ARG C C 13 178.500 0.3 . 1 . . . . A 87 ARG C . 30458 1 1136 . 1 . 1 87 87 ARG CA C 13 59.660 0.3 . 1 . . . . A 87 ARG CA . 30458 1 1137 . 1 . 1 87 87 ARG CB C 13 30.428 0.3 . 1 . . . . A 87 ARG CB . 30458 1 1138 . 1 . 1 87 87 ARG CG C 13 27.848 0.3 . 1 . . . . A 87 ARG CG . 30458 1 1139 . 1 . 1 87 87 ARG CD C 13 43.558 0.3 . 1 . . . . A 87 ARG CD . 30458 1 1140 . 1 . 1 87 87 ARG N N 15 119.031 0.3 . 1 . . . . A 87 ARG N . 30458 1 1141 . 1 . 1 88 88 PHE H H 1 7.750 0.020 . 1 . . . . A 88 PHE H . 30458 1 1142 . 1 . 1 88 88 PHE HA H 1 4.172 0.020 . 1 . . . . A 88 PHE HA . 30458 1 1143 . 1 . 1 88 88 PHE HB2 H 1 3.036 0.020 . 2 . . . . A 88 PHE HB2 . 30458 1 1144 . 1 . 1 88 88 PHE HB3 H 1 3.332 0.020 . 2 . . . . A 88 PHE HB3 . 30458 1 1145 . 1 . 1 88 88 PHE HD1 H 1 6.963 0.020 . 1 . . . . A 88 PHE HD1 . 30458 1 1146 . 1 . 1 88 88 PHE HD2 H 1 6.963 0.020 . 1 . . . . A 88 PHE HD2 . 30458 1 1147 . 1 . 1 88 88 PHE HE1 H 1 7.074 0.020 . 1 . . . . A 88 PHE HE1 . 30458 1 1148 . 1 . 1 88 88 PHE HE2 H 1 7.074 0.020 . 1 . . . . A 88 PHE HE2 . 30458 1 1149 . 1 . 1 88 88 PHE HZ H 1 7.050 0.020 . 1 . . . . A 88 PHE HZ . 30458 1 1150 . 1 . 1 88 88 PHE C C 13 177.200 0.3 . 1 . . . . A 88 PHE C . 30458 1 1151 . 1 . 1 88 88 PHE CA C 13 61.765 0.3 . 1 . . . . A 88 PHE CA . 30458 1 1152 . 1 . 1 88 88 PHE CB C 13 39.946 0.3 . 1 . . . . A 88 PHE CB . 30458 1 1153 . 1 . 1 88 88 PHE CD1 C 13 132.099 0.3 . 1 . . . . A 88 PHE CD1 . 30458 1 1154 . 1 . 1 88 88 PHE CE1 C 13 131.119 0.3 . 1 . . . . A 88 PHE CE1 . 30458 1 1155 . 1 . 1 88 88 PHE CZ C 13 129.391 0.3 . 1 . . . . A 88 PHE CZ . 30458 1 1156 . 1 . 1 88 88 PHE N N 15 120.216 0.3 . 1 . . . . A 88 PHE N . 30458 1 1157 . 1 . 1 89 89 LEU H H 1 8.590 0.020 . 1 . . . . A 89 LEU H . 30458 1 1158 . 1 . 1 89 89 LEU HA H 1 3.591 0.020 . 1 . . . . A 89 LEU HA . 30458 1 1159 . 1 . 1 89 89 LEU HB2 H 1 1.621 0.020 . 2 . . . . A 89 LEU HB2 . 30458 1 1160 . 1 . 1 89 89 LEU HB3 H 1 1.145 0.020 . 2 . . . . A 89 LEU HB3 . 30458 1 1161 . 1 . 1 89 89 LEU HG H 1 1.645 0.020 . 1 . . . . A 89 LEU HG . 30458 1 1162 . 1 . 1 89 89 LEU HD11 H 1 0.688 0.020 . 1 . . . . A 89 LEU HD11 . 30458 1 1163 . 1 . 1 89 89 LEU HD12 H 1 0.688 0.020 . 1 . . . . A 89 LEU HD12 . 30458 1 1164 . 1 . 1 89 89 LEU HD13 H 1 0.688 0.020 . 1 . . . . A 89 LEU HD13 . 30458 1 1165 . 1 . 1 89 89 LEU HD21 H 1 0.332 0.020 . 1 . . . . A 89 LEU HD21 . 30458 1 1166 . 1 . 1 89 89 LEU HD22 H 1 0.332 0.020 . 1 . . . . A 89 LEU HD22 . 30458 1 1167 . 1 . 1 89 89 LEU HD23 H 1 0.332 0.020 . 1 . . . . A 89 LEU HD23 . 30458 1 1168 . 1 . 1 89 89 LEU C C 13 178.700 0.3 . 1 . . . . A 89 LEU C . 30458 1 1169 . 1 . 1 89 89 LEU CA C 13 57.511 0.3 . 1 . . . . A 89 LEU CA . 30458 1 1170 . 1 . 1 89 89 LEU CB C 13 41.732 0.3 . 1 . . . . A 89 LEU CB . 30458 1 1171 . 1 . 1 89 89 LEU CG C 13 27.154 0.3 . 1 . . . . A 89 LEU CG . 30458 1 1172 . 1 . 1 89 89 LEU CD1 C 13 22.848 0.3 . 1 . . . . A 89 LEU CD1 . 30458 1 1173 . 1 . 1 89 89 LEU CD2 C 13 26.380 0.3 . 1 . . . . A 89 LEU CD2 . 30458 1 1174 . 1 . 1 89 89 LEU N N 15 117.900 0.3 . 1 . . . . A 89 LEU N . 30458 1 1175 . 1 . 1 90 90 THR H H 1 7.675 0.020 . 1 . . . . A 90 THR H . 30458 1 1176 . 1 . 1 90 90 THR HA H 1 3.946 0.020 . 1 . . . . A 90 THR HA . 30458 1 1177 . 1 . 1 90 90 THR HB H 1 4.146 0.020 . 1 . . . . A 90 THR HB . 30458 1 1178 . 1 . 1 90 90 THR HG21 H 1 1.189 0.020 . 1 . . . . A 90 THR HG21 . 30458 1 1179 . 1 . 1 90 90 THR HG22 H 1 1.189 0.020 . 1 . . . . A 90 THR HG22 . 30458 1 1180 . 1 . 1 90 90 THR HG23 H 1 1.189 0.020 . 1 . . . . A 90 THR HG23 . 30458 1 1181 . 1 . 1 90 90 THR C C 13 174.900 0.3 . 1 . . . . A 90 THR C . 30458 1 1182 . 1 . 1 90 90 THR CA C 13 65.365 0.3 . 1 . . . . A 90 THR CA . 30458 1 1183 . 1 . 1 90 90 THR CB C 13 69.498 0.3 . 1 . . . . A 90 THR CB . 30458 1 1184 . 1 . 1 90 90 THR CG2 C 13 21.653 0.3 . 1 . . . . A 90 THR CG2 . 30458 1 1185 . 1 . 1 90 90 THR N N 15 112.054 0.3 . 1 . . . . A 90 THR N . 30458 1 1186 . 1 . 1 91 91 ALA H H 1 7.206 0.020 . 1 . . . . A 91 ALA H . 30458 1 1187 . 1 . 1 91 91 ALA HA H 1 4.230 0.020 . 1 . . . . A 91 ALA HA . 30458 1 1188 . 1 . 1 91 91 ALA HB1 H 1 1.301 0.020 . 1 . . . . A 91 ALA HB1 . 30458 1 1189 . 1 . 1 91 91 ALA HB2 H 1 1.301 0.020 . 1 . . . . A 91 ALA HB2 . 30458 1 1190 . 1 . 1 91 91 ALA HB3 H 1 1.301 0.020 . 1 . . . . A 91 ALA HB3 . 30458 1 1191 . 1 . 1 91 91 ALA C C 13 177.500 0.3 . 1 . . . . A 91 ALA C . 30458 1 1192 . 1 . 1 91 91 ALA CA C 13 53.097 0.3 . 1 . . . . A 91 ALA CA . 30458 1 1193 . 1 . 1 91 91 ALA CB C 13 20.044 0.3 . 1 . . . . A 91 ALA CB . 30458 1 1194 . 1 . 1 91 91 ALA N N 15 122.263 0.3 . 1 . . . . A 91 ALA N . 30458 1 1195 . 1 . 1 92 92 SER H H 1 7.506 0.020 . 1 . . . . A 92 SER H . 30458 1 1196 . 1 . 1 92 92 SER HA H 1 4.084 0.020 . 1 . . . . A 92 SER HA . 30458 1 1197 . 1 . 1 92 92 SER HB2 H 1 3.036 0.020 . 1 . . . . A 92 SER HB2 . 30458 1 1198 . 1 . 1 92 92 SER HB3 H 1 3.036 0.020 . 1 . . . . A 92 SER HB3 . 30458 1 1199 . 1 . 1 92 92 SER C C 13 175.344 0.3 . 1 . . . . A 92 SER C . 30458 1 1200 . 1 . 1 92 92 SER CA C 13 57.421 0.3 . 1 . . . . A 92 SER CA . 30458 1 1201 . 1 . 1 92 92 SER CB C 13 64.092 0.3 . 1 . . . . A 92 SER CB . 30458 1 1202 . 1 . 1 92 92 SER N N 15 112.869 0.3 . 1 . . . . A 92 SER N . 30458 1 1203 . 1 . 1 93 93 GLN H H 1 8.736 0.020 . 1 . . . . A 93 GLN H . 30458 1 1204 . 1 . 1 93 93 GLN HA H 1 4.092 0.020 . 1 . . . . A 93 GLN HA . 30458 1 1205 . 1 . 1 93 93 GLN HB2 H 1 2.138 0.020 . 1 . . . . A 93 GLN HB2 . 30458 1 1206 . 1 . 1 93 93 GLN HB3 H 1 2.138 0.020 . 1 . . . . A 93 GLN HB3 . 30458 1 1207 . 1 . 1 93 93 GLN HG2 H 1 2.393 0.020 . 1 . . . . A 93 GLN HG2 . 30458 1 1208 . 1 . 1 93 93 GLN HG3 H 1 2.393 0.020 . 1 . . . . A 93 GLN HG3 . 30458 1 1209 . 1 . 1 93 93 GLN HE21 H 1 7.493 0.020 . 1 . . . . A 93 GLN HE21 . 30458 1 1210 . 1 . 1 93 93 GLN HE22 H 1 6.833 0.020 . 1 . . . . A 93 GLN HE22 . 30458 1 1211 . 1 . 1 93 93 GLN C C 13 176.700 0.3 . 1 . . . . A 93 GLN C . 30458 1 1212 . 1 . 1 93 93 GLN CA C 13 57.767 0.3 . 1 . . . . A 93 GLN CA . 30458 1 1213 . 1 . 1 93 93 GLN CB C 13 29.203 0.3 . 1 . . . . A 93 GLN CB . 30458 1 1214 . 1 . 1 93 93 GLN CG C 13 34.000 0.3 . 1 . . . . A 93 GLN CG . 30458 1 1215 . 1 . 1 93 93 GLN N N 15 125.781 0.3 . 1 . . . . A 93 GLN N . 30458 1 1216 . 1 . 1 93 93 GLN NE2 N 15 112.046 0.3 . 1 . . . . A 93 GLN NE2 . 30458 1 1217 . 1 . 1 94 94 ASP H H 1 7.777 0.020 . 1 . . . . A 94 ASP H . 30458 1 1218 . 1 . 1 94 94 ASP HA H 1 4.520 0.020 . 1 . . . . A 94 ASP HA . 30458 1 1219 . 1 . 1 94 94 ASP HB2 H 1 2.522 0.020 . 2 . . . . A 94 ASP HB2 . 30458 1 1220 . 1 . 1 94 94 ASP HB3 H 1 2.789 0.020 . 2 . . . . A 94 ASP HB3 . 30458 1 1221 . 1 . 1 94 94 ASP C C 13 176.303 0.3 . 1 . . . . A 94 ASP C . 30458 1 1222 . 1 . 1 94 94 ASP CA C 13 54.153 0.3 . 1 . . . . A 94 ASP CA . 30458 1 1223 . 1 . 1 94 94 ASP CB C 13 41.827 0.3 . 1 . . . . A 94 ASP CB . 30458 1 1224 . 1 . 1 94 94 ASP N N 15 116.341 0.3 . 1 . . . . A 94 ASP N . 30458 1 1225 . 1 . 1 95 95 LYS H H 1 8.290 0.020 . 1 . . . . A 95 LYS H . 30458 1 1226 . 1 . 1 95 95 LYS HA H 1 3.544 0.020 . 1 . . . . A 95 LYS HA . 30458 1 1227 . 1 . 1 95 95 LYS HB2 H 1 1.882 0.020 . 1 . . . . A 95 LYS HB2 . 30458 1 1228 . 1 . 1 95 95 LYS HB3 H 1 1.882 0.020 . 1 . . . . A 95 LYS HB3 . 30458 1 1229 . 1 . 1 95 95 LYS CA C 13 56.625 0.3 . 1 . . . . A 95 LYS CA . 30458 1 1230 . 1 . 1 95 95 LYS CB C 13 29.793 0.3 . 1 . . . . A 95 LYS CB . 30458 1 1231 . 1 . 1 95 95 LYS N N 15 114.139 0.3 . 1 . . . . A 95 LYS N . 30458 1 1232 . 1 . 1 96 96 ILE H H 1 7.794 0.020 . 1 . . . . A 96 ILE H . 30458 1 1233 . 1 . 1 96 96 ILE HA H 1 4.283 0.020 . 1 . . . . A 96 ILE HA . 30458 1 1234 . 1 . 1 96 96 ILE HB H 1 1.637 0.020 . 1 . . . . A 96 ILE HB . 30458 1 1235 . 1 . 1 96 96 ILE HG12 H 1 1.510 0.020 . 2 . . . . A 96 ILE HG12 . 30458 1 1236 . 1 . 1 96 96 ILE HG13 H 1 0.655 0.020 . 2 . . . . A 96 ILE HG13 . 30458 1 1237 . 1 . 1 96 96 ILE HG21 H 1 0.895 0.020 . 1 . . . . A 96 ILE HG21 . 30458 1 1238 . 1 . 1 96 96 ILE HG22 H 1 0.895 0.020 . 1 . . . . A 96 ILE HG22 . 30458 1 1239 . 1 . 1 96 96 ILE HG23 H 1 0.895 0.020 . 1 . . . . A 96 ILE HG23 . 30458 1 1240 . 1 . 1 96 96 ILE HD11 H 1 0.751 0.020 . 1 . . . . A 96 ILE HD11 . 30458 1 1241 . 1 . 1 96 96 ILE HD12 H 1 0.751 0.020 . 1 . . . . A 96 ILE HD12 . 30458 1 1242 . 1 . 1 96 96 ILE HD13 H 1 0.751 0.020 . 1 . . . . A 96 ILE HD13 . 30458 1 1243 . 1 . 1 96 96 ILE C C 13 177.000 0.3 . 1 . . . . A 96 ILE C . 30458 1 1244 . 1 . 1 96 96 ILE CA C 13 60.904 0.3 . 1 . . . . A 96 ILE CA . 30458 1 1245 . 1 . 1 96 96 ILE CB C 13 38.046 0.3 . 1 . . . . A 96 ILE CB . 30458 1 1246 . 1 . 1 96 96 ILE CG1 C 13 27.283 0.3 . 1 . . . . A 96 ILE CG1 . 30458 1 1247 . 1 . 1 96 96 ILE CG2 C 13 19.051 0.3 . 1 . . . . A 96 ILE CG2 . 30458 1 1248 . 1 . 1 96 96 ILE CD1 C 13 13.581 0.3 . 1 . . . . A 96 ILE CD1 . 30458 1 1249 . 1 . 1 96 96 ILE N N 15 118.702 0.3 . 1 . . . . A 96 ILE N . 30458 1 1250 . 1 . 1 97 97 LEU H H 1 8.613 0.020 . 1 . . . . A 97 LEU H . 30458 1 1251 . 1 . 1 97 97 LEU HA H 1 3.072 0.020 . 1 . . . . A 97 LEU HA . 30458 1 1252 . 1 . 1 97 97 LEU HB2 H 1 0.445 0.020 . 2 . . . . A 97 LEU HB2 . 30458 1 1253 . 1 . 1 97 97 LEU HB3 H 1 0.147 0.020 . 2 . . . . A 97 LEU HB3 . 30458 1 1254 . 1 . 1 97 97 LEU HG H 1 0.052 0.020 . 1 . . . . A 97 LEU HG . 30458 1 1255 . 1 . 1 97 97 LEU HD11 H 1 -0.467 0.020 . 1 . . . . A 97 LEU HD11 . 30458 1 1256 . 1 . 1 97 97 LEU HD12 H 1 -0.467 0.020 . 1 . . . . A 97 LEU HD12 . 30458 1 1257 . 1 . 1 97 97 LEU HD13 H 1 -0.467 0.020 . 1 . . . . A 97 LEU HD13 . 30458 1 1258 . 1 . 1 97 97 LEU HD21 H 1 -0.314 0.020 . 1 . . . . A 97 LEU HD21 . 30458 1 1259 . 1 . 1 97 97 LEU HD22 H 1 -0.314 0.020 . 1 . . . . A 97 LEU HD22 . 30458 1 1260 . 1 . 1 97 97 LEU HD23 H 1 -0.314 0.020 . 1 . . . . A 97 LEU HD23 . 30458 1 1261 . 1 . 1 97 97 LEU C C 13 177.200 0.3 . 1 . . . . A 97 LEU C . 30458 1 1262 . 1 . 1 97 97 LEU CA C 13 58.146 0.3 . 1 . . . . A 97 LEU CA . 30458 1 1263 . 1 . 1 97 97 LEU CB C 13 43.058 0.3 . 1 . . . . A 97 LEU CB . 30458 1 1264 . 1 . 1 97 97 LEU CG C 13 26.115 0.3 . 1 . . . . A 97 LEU CG . 30458 1 1265 . 1 . 1 97 97 LEU CD1 C 13 23.366 0.3 . 1 . . . . A 97 LEU CD1 . 30458 1 1266 . 1 . 1 97 97 LEU CD2 C 13 24.362 0.3 . 1 . . . . A 97 LEU CD2 . 30458 1 1267 . 1 . 1 97 97 LEU N N 15 131.063 0.3 . 1 . . . . A 97 LEU N . 30458 1 1268 . 1 . 1 98 98 PHE H H 1 8.429 0.020 . 1 . . . . A 98 PHE H . 30458 1 1269 . 1 . 1 98 98 PHE HA H 1 5.059 0.020 . 1 . . . . A 98 PHE HA . 30458 1 1270 . 1 . 1 98 98 PHE HB2 H 1 2.582 0.020 . 2 . . . . A 98 PHE HB2 . 30458 1 1271 . 1 . 1 98 98 PHE HB3 H 1 3.343 0.020 . 2 . . . . A 98 PHE HB3 . 30458 1 1272 . 1 . 1 98 98 PHE HD1 H 1 7.064 0.020 . 1 . . . . A 98 PHE HD1 . 30458 1 1273 . 1 . 1 98 98 PHE HD2 H 1 7.064 0.020 . 1 . . . . A 98 PHE HD2 . 30458 1 1274 . 1 . 1 98 98 PHE HE1 H 1 7.039 0.020 . 1 . . . . A 98 PHE HE1 . 30458 1 1275 . 1 . 1 98 98 PHE HE2 H 1 7.039 0.020 . 1 . . . . A 98 PHE HE2 . 30458 1 1276 . 1 . 1 98 98 PHE HZ H 1 6.955 0.020 . 1 . . . . A 98 PHE HZ . 30458 1 1277 . 1 . 1 98 98 PHE C C 13 175.400 0.3 . 1 . . . . A 98 PHE C . 30458 1 1278 . 1 . 1 98 98 PHE CA C 13 55.796 0.3 . 1 . . . . A 98 PHE CA . 30458 1 1279 . 1 . 1 98 98 PHE CB C 13 37.651 0.3 . 1 . . . . A 98 PHE CB . 30458 1 1280 . 1 . 1 98 98 PHE CD1 C 13 131.473 0.3 . 1 . . . . A 98 PHE CD1 . 30458 1 1281 . 1 . 1 98 98 PHE CE1 C 13 131.425 0.3 . 1 . . . . A 98 PHE CE1 . 30458 1 1282 . 1 . 1 98 98 PHE CZ C 13 129.021 0.3 . 1 . . . . A 98 PHE CZ . 30458 1 1283 . 1 . 1 98 98 PHE N N 15 113.590 0.3 . 1 . . . . A 98 PHE N . 30458 1 1284 . 1 . 1 99 99 LYS H H 1 6.773 0.020 . 1 . . . . A 99 LYS H . 30458 1 1285 . 1 . 1 99 99 LYS HA H 1 3.836 0.020 . 1 . . . . A 99 LYS HA . 30458 1 1286 . 1 . 1 99 99 LYS HB2 H 1 1.797 0.020 . 2 . . . . A 99 LYS HB2 . 30458 1 1287 . 1 . 1 99 99 LYS HB3 H 1 1.848 0.020 . 2 . . . . A 99 LYS HB3 . 30458 1 1288 . 1 . 1 99 99 LYS HG2 H 1 1.347 0.020 . 2 . . . . A 99 LYS HG2 . 30458 1 1289 . 1 . 1 99 99 LYS HG3 H 1 1.569 0.020 . 2 . . . . A 99 LYS HG3 . 30458 1 1290 . 1 . 1 99 99 LYS HD2 H 1 1.762 0.020 . 1 . . . . A 99 LYS HD2 . 30458 1 1291 . 1 . 1 99 99 LYS HD3 H 1 1.762 0.020 . 1 . . . . A 99 LYS HD3 . 30458 1 1292 . 1 . 1 99 99 LYS HE2 H 1 2.927 0.020 . 1 . . . . A 99 LYS HE2 . 30458 1 1293 . 1 . 1 99 99 LYS HE3 H 1 2.927 0.020 . 1 . . . . A 99 LYS HE3 . 30458 1 1294 . 1 . 1 99 99 LYS C C 13 178.900 0.3 . 1 . . . . A 99 LYS C . 30458 1 1295 . 1 . 1 99 99 LYS CA C 13 61.142 0.3 . 1 . . . . A 99 LYS CA . 30458 1 1296 . 1 . 1 99 99 LYS CB C 13 33.603 0.3 . 1 . . . . A 99 LYS CB . 30458 1 1297 . 1 . 1 99 99 LYS CG C 13 24.414 0.3 . 1 . . . . A 99 LYS CG . 30458 1 1298 . 1 . 1 99 99 LYS CD C 13 29.724 0.3 . 1 . . . . A 99 LYS CD . 30458 1 1299 . 1 . 1 99 99 LYS CE C 13 42.041 0.3 . 1 . . . . A 99 LYS CE . 30458 1 1300 . 1 . 1 99 99 LYS N N 15 119.435 0.3 . 1 . . . . A 99 LYS N . 30458 1 1301 . 1 . 1 100 100 ASP H H 1 8.518 0.020 . 1 . . . . A 100 ASP H . 30458 1 1302 . 1 . 1 100 100 ASP HA H 1 4.575 0.020 . 1 . . . . A 100 ASP HA . 30458 1 1303 . 1 . 1 100 100 ASP HB2 H 1 2.657 0.020 . 2 . . . . A 100 ASP HB2 . 30458 1 1304 . 1 . 1 100 100 ASP HB3 H 1 2.735 0.020 . 2 . . . . A 100 ASP HB3 . 30458 1 1305 . 1 . 1 100 100 ASP C C 13 179.000 0.3 . 1 . . . . A 100 ASP C . 30458 1 1306 . 1 . 1 100 100 ASP CA C 13 57.998 0.3 . 1 . . . . A 100 ASP CA . 30458 1 1307 . 1 . 1 100 100 ASP CB C 13 40.605 0.3 . 1 . . . . A 100 ASP CB . 30458 1 1308 . 1 . 1 100 100 ASP N N 15 117.815 0.3 . 1 . . . . A 100 ASP N . 30458 1 1309 . 1 . 1 101 101 VAL H H 1 8.206 0.020 . 1 . . . . A 101 VAL H . 30458 1 1310 . 1 . 1 101 101 VAL HA H 1 3.808 0.020 . 1 . . . . A 101 VAL HA . 30458 1 1311 . 1 . 1 101 101 VAL HB H 1 2.119 0.020 . 1 . . . . A 101 VAL HB . 30458 1 1312 . 1 . 1 101 101 VAL HG11 H 1 0.920 0.020 . 1 . . . . A 101 VAL HG11 . 30458 1 1313 . 1 . 1 101 101 VAL HG12 H 1 0.920 0.020 . 1 . . . . A 101 VAL HG12 . 30458 1 1314 . 1 . 1 101 101 VAL HG13 H 1 0.920 0.020 . 1 . . . . A 101 VAL HG13 . 30458 1 1315 . 1 . 1 101 101 VAL HG21 H 1 1.086 0.020 . 1 . . . . A 101 VAL HG21 . 30458 1 1316 . 1 . 1 101 101 VAL HG22 H 1 1.086 0.020 . 1 . . . . A 101 VAL HG22 . 30458 1 1317 . 1 . 1 101 101 VAL HG23 H 1 1.086 0.020 . 1 . . . . A 101 VAL HG23 . 30458 1 1318 . 1 . 1 101 101 VAL C C 13 177.100 0.3 . 1 . . . . A 101 VAL C . 30458 1 1319 . 1 . 1 101 101 VAL CA C 13 65.781 0.3 . 1 . . . . A 101 VAL CA . 30458 1 1320 . 1 . 1 101 101 VAL CB C 13 32.369 0.3 . 1 . . . . A 101 VAL CB . 30458 1 1321 . 1 . 1 101 101 VAL CG1 C 13 21.273 0.3 . 1 . . . . A 101 VAL CG1 . 30458 1 1322 . 1 . 1 101 101 VAL CG2 C 13 23.642 0.3 . 1 . . . . A 101 VAL CG2 . 30458 1 1323 . 1 . 1 101 101 VAL N N 15 122.472 0.3 . 1 . . . . A 101 VAL N . 30458 1 1324 . 1 . 1 102 102 ASN H H 1 9.057 0.020 . 1 . . . . A 102 ASN H . 30458 1 1325 . 1 . 1 102 102 ASN HA H 1 4.521 0.020 . 1 . . . . A 102 ASN HA . 30458 1 1326 . 1 . 1 102 102 ASN HB2 H 1 2.874 0.020 . 2 . . . . A 102 ASN HB2 . 30458 1 1327 . 1 . 1 102 102 ASN HB3 H 1 2.934 0.020 . 2 . . . . A 102 ASN HB3 . 30458 1 1328 . 1 . 1 102 102 ASN HD21 H 1 7.780 0.020 . 1 . . . . A 102 ASN HD21 . 30458 1 1329 . 1 . 1 102 102 ASN HD22 H 1 5.584 0.020 . 1 . . . . A 102 ASN HD22 . 30458 1 1330 . 1 . 1 102 102 ASN C C 13 178.500 0.3 . 1 . . . . A 102 ASN C . 30458 1 1331 . 1 . 1 102 102 ASN CA C 13 56.380 0.3 . 1 . . . . A 102 ASN CA . 30458 1 1332 . 1 . 1 102 102 ASN CB C 13 37.999 0.3 . 1 . . . . A 102 ASN CB . 30458 1 1333 . 1 . 1 102 102 ASN N N 15 120.935 0.3 . 1 . . . . A 102 ASN N . 30458 1 1334 . 1 . 1 102 102 ASN ND2 N 15 105.879 0.3 . 1 . . . . A 102 ASN ND2 . 30458 1 1335 . 1 . 1 103 103 ARG H H 1 7.638 0.020 . 1 . . . . A 103 ARG H . 30458 1 1336 . 1 . 1 103 103 ARG HA H 1 4.131 0.020 . 1 . . . . A 103 ARG HA . 30458 1 1337 . 1 . 1 103 103 ARG HB2 H 1 2.004 0.020 . 2 . . . . A 103 ARG HB2 . 30458 1 1338 . 1 . 1 103 103 ARG HB3 H 1 2.100 0.020 . 2 . . . . A 103 ARG HB3 . 30458 1 1339 . 1 . 1 103 103 ARG HG2 H 1 1.724 0.020 . 1 . . . . A 103 ARG HG2 . 30458 1 1340 . 1 . 1 103 103 ARG HG3 H 1 1.724 0.020 . 1 . . . . A 103 ARG HG3 . 30458 1 1341 . 1 . 1 103 103 ARG HD2 H 1 3.215 0.020 . 2 . . . . A 103 ARG HD2 . 30458 1 1342 . 1 . 1 103 103 ARG HD3 H 1 3.292 0.020 . 2 . . . . A 103 ARG HD3 . 30458 1 1343 . 1 . 1 103 103 ARG C C 13 177.995 0.3 . 1 . . . . A 103 ARG C . 30458 1 1344 . 1 . 1 103 103 ARG CA C 13 59.361 0.3 . 1 . . . . A 103 ARG CA . 30458 1 1345 . 1 . 1 103 103 ARG CB C 13 29.745 0.3 . 1 . . . . A 103 ARG CB . 30458 1 1346 . 1 . 1 103 103 ARG CG C 13 26.834 0.3 . 1 . . . . A 103 ARG CG . 30458 1 1347 . 1 . 1 103 103 ARG CD C 13 43.347 0.3 . 1 . . . . A 103 ARG CD . 30458 1 1348 . 1 . 1 103 103 ARG N N 15 120.761 0.3 . 1 . . . . A 103 ARG N . 30458 1 1349 . 1 . 1 104 104 LYS H H 1 7.944 0.020 . 1 . . . . A 104 LYS H . 30458 1 1350 . 1 . 1 104 104 LYS HA H 1 4.147 0.020 . 1 . . . . A 104 LYS HA . 30458 1 1351 . 1 . 1 104 104 LYS HB2 H 1 1.895 0.020 . 2 . . . . A 104 LYS HB2 . 30458 1 1352 . 1 . 1 104 104 LYS HB3 H 1 1.992 0.020 . 2 . . . . A 104 LYS HB3 . 30458 1 1353 . 1 . 1 104 104 LYS HG2 H 1 1.469 0.020 . 2 . . . . A 104 LYS HG2 . 30458 1 1354 . 1 . 1 104 104 LYS HG3 H 1 1.635 0.020 . 2 . . . . A 104 LYS HG3 . 30458 1 1355 . 1 . 1 104 104 LYS HD2 H 1 1.642 0.020 . 1 . . . . A 104 LYS HD2 . 30458 1 1356 . 1 . 1 104 104 LYS HD3 H 1 1.642 0.020 . 1 . . . . A 104 LYS HD3 . 30458 1 1357 . 1 . 1 104 104 LYS HE2 H 1 2.934 0.020 . 1 . . . . A 104 LYS HE2 . 30458 1 1358 . 1 . 1 104 104 LYS HE3 H 1 2.934 0.020 . 1 . . . . A 104 LYS HE3 . 30458 1 1359 . 1 . 1 104 104 LYS C C 13 179.454 0.3 . 1 . . . . A 104 LYS C . 30458 1 1360 . 1 . 1 104 104 LYS CA C 13 60.278 0.3 . 1 . . . . A 104 LYS CA . 30458 1 1361 . 1 . 1 104 104 LYS CB C 13 32.501 0.3 . 1 . . . . A 104 LYS CB . 30458 1 1362 . 1 . 1 104 104 LYS CG C 13 26.032 0.3 . 1 . . . . A 104 LYS CG . 30458 1 1363 . 1 . 1 104 104 LYS CD C 13 29.657 0.3 . 1 . . . . A 104 LYS CD . 30458 1 1364 . 1 . 1 104 104 LYS CE C 13 42.056 0.3 . 1 . . . . A 104 LYS CE . 30458 1 1365 . 1 . 1 104 104 LYS N N 15 119.658 0.3 . 1 . . . . A 104 LYS N . 30458 1 1366 . 1 . 1 105 105 LEU H H 1 8.990 0.020 . 1 . . . . A 105 LEU H . 30458 1 1367 . 1 . 1 105 105 LEU HA H 1 4.015 0.020 . 1 . . . . A 105 LEU HA . 30458 1 1368 . 1 . 1 105 105 LEU HB2 H 1 2.250 0.020 . 2 . . . . A 105 LEU HB2 . 30458 1 1369 . 1 . 1 105 105 LEU HB3 H 1 1.482 0.020 . 2 . . . . A 105 LEU HB3 . 30458 1 1370 . 1 . 1 105 105 LEU HG H 1 1.882 0.020 . 1 . . . . A 105 LEU HG . 30458 1 1371 . 1 . 1 105 105 LEU HD11 H 1 0.685 0.020 . 1 . . . . A 105 LEU HD11 . 30458 1 1372 . 1 . 1 105 105 LEU HD12 H 1 0.685 0.020 . 1 . . . . A 105 LEU HD12 . 30458 1 1373 . 1 . 1 105 105 LEU HD13 H 1 0.685 0.020 . 1 . . . . A 105 LEU HD13 . 30458 1 1374 . 1 . 1 105 105 LEU HD21 H 1 0.690 0.020 . 1 . . . . A 105 LEU HD21 . 30458 1 1375 . 1 . 1 105 105 LEU HD22 H 1 0.690 0.020 . 1 . . . . A 105 LEU HD22 . 30458 1 1376 . 1 . 1 105 105 LEU HD23 H 1 0.690 0.020 . 1 . . . . A 105 LEU HD23 . 30458 1 1377 . 1 . 1 105 105 LEU C C 13 178.400 0.3 . 1 . . . . A 105 LEU C . 30458 1 1378 . 1 . 1 105 105 LEU CA C 13 58.588 0.3 . 1 . . . . A 105 LEU CA . 30458 1 1379 . 1 . 1 105 105 LEU CB C 13 42.528 0.3 . 1 . . . . A 105 LEU CB . 30458 1 1380 . 1 . 1 105 105 LEU CG C 13 27.049 0.3 . 1 . . . . A 105 LEU CG . 30458 1 1381 . 1 . 1 105 105 LEU CD1 C 13 26.249 0.3 . 1 . . . . A 105 LEU CD1 . 30458 1 1382 . 1 . 1 105 105 LEU CD2 C 13 23.964 0.3 . 1 . . . . A 105 LEU CD2 . 30458 1 1383 . 1 . 1 105 105 LEU N N 15 118.264 0.3 . 1 . . . . A 105 LEU N . 30458 1 1384 . 1 . 1 106 106 SER H H 1 8.030 0.020 . 1 . . . . A 106 SER H . 30458 1 1385 . 1 . 1 106 106 SER HA H 1 3.795 0.020 . 1 . . . . A 106 SER HA . 30458 1 1386 . 1 . 1 106 106 SER HB2 H 1 3.654 0.020 . 2 . . . . A 106 SER HB2 . 30458 1 1387 . 1 . 1 106 106 SER HB3 H 1 3.766 0.020 . 2 . . . . A 106 SER HB3 . 30458 1 1388 . 1 . 1 106 106 SER C C 13 177.500 0.3 . 1 . . . . A 106 SER C . 30458 1 1389 . 1 . 1 106 106 SER CA C 13 61.619 0.3 . 1 . . . . A 106 SER CA . 30458 1 1390 . 1 . 1 106 106 SER CB C 13 62.898 0.3 . 1 . . . . A 106 SER CB . 30458 1 1391 . 1 . 1 106 106 SER N N 15 112.056 0.3 . 1 . . . . A 106 SER N . 30458 1 1392 . 1 . 1 107 107 ASP H H 1 8.439 0.020 . 1 . . . . A 107 ASP H . 30458 1 1393 . 1 . 1 107 107 ASP HA H 1 4.400 0.020 . 1 . . . . A 107 ASP HA . 30458 1 1394 . 1 . 1 107 107 ASP HB2 H 1 2.664 0.020 . 2 . . . . A 107 ASP HB2 . 30458 1 1395 . 1 . 1 107 107 ASP HB3 H 1 2.896 0.020 . 2 . . . . A 107 ASP HB3 . 30458 1 1396 . 1 . 1 107 107 ASP C C 13 179.700 0.3 . 1 . . . . A 107 ASP C . 30458 1 1397 . 1 . 1 107 107 ASP CA C 13 57.893 0.3 . 1 . . . . A 107 ASP CA . 30458 1 1398 . 1 . 1 107 107 ASP CB C 13 40.791 0.3 . 1 . . . . A 107 ASP CB . 30458 1 1399 . 1 . 1 107 107 ASP N N 15 121.932 0.3 . 1 . . . . A 107 ASP N . 30458 1 1400 . 1 . 1 108 108 VAL H H 1 8.730 0.020 . 1 . . . . A 108 VAL H . 30458 1 1401 . 1 . 1 108 108 VAL HA H 1 3.974 0.020 . 1 . . . . A 108 VAL HA . 30458 1 1402 . 1 . 1 108 108 VAL HB H 1 2.275 0.020 . 1 . . . . A 108 VAL HB . 30458 1 1403 . 1 . 1 108 108 VAL HG11 H 1 1.166 0.020 . 1 . . . . A 108 VAL HG11 . 30458 1 1404 . 1 . 1 108 108 VAL HG12 H 1 1.166 0.020 . 1 . . . . A 108 VAL HG12 . 30458 1 1405 . 1 . 1 108 108 VAL HG13 H 1 1.166 0.020 . 1 . . . . A 108 VAL HG13 . 30458 1 1406 . 1 . 1 108 108 VAL HG21 H 1 1.041 0.020 . 1 . . . . A 108 VAL HG21 . 30458 1 1407 . 1 . 1 108 108 VAL HG22 H 1 1.041 0.020 . 1 . . . . A 108 VAL HG22 . 30458 1 1408 . 1 . 1 108 108 VAL HG23 H 1 1.041 0.020 . 1 . . . . A 108 VAL HG23 . 30458 1 1409 . 1 . 1 108 108 VAL C C 13 178.293 0.3 . 1 . . . . A 108 VAL C . 30458 1 1410 . 1 . 1 108 108 VAL CA C 13 65.761 0.3 . 1 . . . . A 108 VAL CA . 30458 1 1411 . 1 . 1 108 108 VAL CB C 13 31.590 0.3 . 1 . . . . A 108 VAL CB . 30458 1 1412 . 1 . 1 108 108 VAL CG1 C 13 23.246 0.3 . 1 . . . . A 108 VAL CG1 . 30458 1 1413 . 1 . 1 108 108 VAL CG2 C 13 22.374 0.3 . 1 . . . . A 108 VAL CG2 . 30458 1 1414 . 1 . 1 108 108 VAL N N 15 119.216 0.3 . 1 . . . . A 108 VAL N . 30458 1 1415 . 1 . 1 109 109 TRP H H 1 8.710 0.020 . 1 . . . . A 109 TRP H . 30458 1 1416 . 1 . 1 109 109 TRP HA H 1 4.249 0.020 . 1 . . . . A 109 TRP HA . 30458 1 1417 . 1 . 1 109 109 TRP HB2 H 1 3.274 0.020 . 2 . . . . A 109 TRP HB2 . 30458 1 1418 . 1 . 1 109 109 TRP HB3 H 1 3.361 0.020 . 2 . . . . A 109 TRP HB3 . 30458 1 1419 . 1 . 1 109 109 TRP HD1 H 1 6.872 0.020 . 1 . . . . A 109 TRP HD1 . 30458 1 1420 . 1 . 1 109 109 TRP HE1 H 1 9.896 0.020 . 1 . . . . A 109 TRP HE1 . 30458 1 1421 . 1 . 1 109 109 TRP HE3 H 1 6.913 0.020 . 1 . . . . A 109 TRP HE3 . 30458 1 1422 . 1 . 1 109 109 TRP HZ2 H 1 7.285 0.020 . 1 . . . . A 109 TRP HZ2 . 30458 1 1423 . 1 . 1 109 109 TRP HZ3 H 1 6.607 0.020 . 1 . . . . A 109 TRP HZ3 . 30458 1 1424 . 1 . 1 109 109 TRP HH2 H 1 6.921 0.020 . 1 . . . . A 109 TRP HH2 . 30458 1 1425 . 1 . 1 109 109 TRP C C 13 178.000 0.3 . 1 . . . . A 109 TRP C . 30458 1 1426 . 1 . 1 109 109 TRP CA C 13 60.400 0.3 . 1 . . . . A 109 TRP CA . 30458 1 1427 . 1 . 1 109 109 TRP CB C 13 29.704 0.3 . 1 . . . . A 109 TRP CB . 30458 1 1428 . 1 . 1 109 109 TRP CD1 C 13 126.375 0.3 . 1 . . . . A 109 TRP CD1 . 30458 1 1429 . 1 . 1 109 109 TRP CE3 C 13 120.535 0.3 . 1 . . . . A 109 TRP CE3 . 30458 1 1430 . 1 . 1 109 109 TRP CZ2 C 13 114.106 0.3 . 1 . . . . A 109 TRP CZ2 . 30458 1 1431 . 1 . 1 109 109 TRP CZ3 C 13 121.762 0.3 . 1 . . . . A 109 TRP CZ3 . 30458 1 1432 . 1 . 1 109 109 TRP CH2 C 13 124.519 0.3 . 1 . . . . A 109 TRP CH2 . 30458 1 1433 . 1 . 1 109 109 TRP N N 15 121.918 0.3 . 1 . . . . A 109 TRP N . 30458 1 1434 . 1 . 1 109 109 TRP NE1 N 15 127.384 0.3 . 1 . . . . A 109 TRP NE1 . 30458 1 1435 . 1 . 1 110 110 LYS H H 1 7.986 0.020 . 1 . . . . A 110 LYS H . 30458 1 1436 . 1 . 1 110 110 LYS HA H 1 3.607 0.020 . 1 . . . . A 110 LYS HA . 30458 1 1437 . 1 . 1 110 110 LYS HB2 H 1 1.892 0.020 . 2 . . . . A 110 LYS HB2 . 30458 1 1438 . 1 . 1 110 110 LYS HB3 H 1 1.941 0.020 . 2 . . . . A 110 LYS HB3 . 30458 1 1439 . 1 . 1 110 110 LYS HG2 H 1 1.352 0.020 . 2 . . . . A 110 LYS HG2 . 30458 1 1440 . 1 . 1 110 110 LYS HG3 H 1 1.569 0.020 . 2 . . . . A 110 LYS HG3 . 30458 1 1441 . 1 . 1 110 110 LYS HD2 H 1 1.647 0.020 . 1 . . . . A 110 LYS HD2 . 30458 1 1442 . 1 . 1 110 110 LYS HD3 H 1 1.647 0.020 . 1 . . . . A 110 LYS HD3 . 30458 1 1443 . 1 . 1 110 110 LYS HE2 H 1 2.882 0.020 . 1 . . . . A 110 LYS HE2 . 30458 1 1444 . 1 . 1 110 110 LYS HE3 H 1 2.882 0.020 . 1 . . . . A 110 LYS HE3 . 30458 1 1445 . 1 . 1 110 110 LYS C C 13 178.000 0.3 . 1 . . . . A 110 LYS C . 30458 1 1446 . 1 . 1 110 110 LYS CA C 13 60.632 0.3 . 1 . . . . A 110 LYS CA . 30458 1 1447 . 1 . 1 110 110 LYS CB C 13 32.233 0.3 . 1 . . . . A 110 LYS CB . 30458 1 1448 . 1 . 1 110 110 LYS CG C 13 25.245 0.3 . 1 . . . . A 110 LYS CG . 30458 1 1449 . 1 . 1 110 110 LYS CD C 13 29.649 0.3 . 1 . . . . A 110 LYS CD . 30458 1 1450 . 1 . 1 110 110 LYS CE C 13 42.260 0.3 . 1 . . . . A 110 LYS CE . 30458 1 1451 . 1 . 1 110 110 LYS N N 15 119.504 0.3 . 1 . . . . A 110 LYS N . 30458 1 1452 . 1 . 1 111 111 GLU H H 1 7.001 0.020 . 1 . . . . A 111 GLU H . 30458 1 1453 . 1 . 1 111 111 GLU HA H 1 3.986 0.020 . 1 . . . . A 111 GLU HA . 30458 1 1454 . 1 . 1 111 111 GLU HB2 H 1 2.031 0.020 . 1 . . . . A 111 GLU HB2 . 30458 1 1455 . 1 . 1 111 111 GLU HB3 H 1 2.031 0.020 . 1 . . . . A 111 GLU HB3 . 30458 1 1456 . 1 . 1 111 111 GLU HG2 H 1 2.078 0.020 . 2 . . . . A 111 GLU HG2 . 30458 1 1457 . 1 . 1 111 111 GLU HG3 H 1 2.281 0.020 . 2 . . . . A 111 GLU HG3 . 30458 1 1458 . 1 . 1 111 111 GLU C C 13 178.400 0.3 . 1 . . . . A 111 GLU C . 30458 1 1459 . 1 . 1 111 111 GLU CA C 13 58.928 0.3 . 1 . . . . A 111 GLU CA . 30458 1 1460 . 1 . 1 111 111 GLU CB C 13 30.423 0.3 . 1 . . . . A 111 GLU CB . 30458 1 1461 . 1 . 1 111 111 GLU CG C 13 36.335 0.3 . 1 . . . . A 111 GLU CG . 30458 1 1462 . 1 . 1 111 111 GLU N N 15 116.619 0.3 . 1 . . . . A 111 GLU N . 30458 1 1463 . 1 . 1 112 112 LEU H H 1 8.383 0.020 . 1 . . . . A 112 LEU H . 30458 1 1464 . 1 . 1 112 112 LEU HA H 1 3.700 0.020 . 1 . . . . A 112 LEU HA . 30458 1 1465 . 1 . 1 112 112 LEU HB2 H 1 1.356 0.020 . 2 . . . . A 112 LEU HB2 . 30458 1 1466 . 1 . 1 112 112 LEU HB3 H 1 1.233 0.020 . 2 . . . . A 112 LEU HB3 . 30458 1 1467 . 1 . 1 112 112 LEU HG H 1 1.163 0.020 . 1 . . . . A 112 LEU HG . 30458 1 1468 . 1 . 1 112 112 LEU HD11 H 1 0.625 0.020 . 1 . . . . A 112 LEU HD11 . 30458 1 1469 . 1 . 1 112 112 LEU HD12 H 1 0.625 0.020 . 1 . . . . A 112 LEU HD12 . 30458 1 1470 . 1 . 1 112 112 LEU HD13 H 1 0.625 0.020 . 1 . . . . A 112 LEU HD13 . 30458 1 1471 . 1 . 1 112 112 LEU HD21 H 1 0.514 0.020 . 1 . . . . A 112 LEU HD21 . 30458 1 1472 . 1 . 1 112 112 LEU HD22 H 1 0.514 0.020 . 1 . . . . A 112 LEU HD22 . 30458 1 1473 . 1 . 1 112 112 LEU HD23 H 1 0.514 0.020 . 1 . . . . A 112 LEU HD23 . 30458 1 1474 . 1 . 1 112 112 LEU C C 13 177.600 0.3 . 1 . . . . A 112 LEU C . 30458 1 1475 . 1 . 1 112 112 LEU CA C 13 57.980 0.3 . 1 . . . . A 112 LEU CA . 30458 1 1476 . 1 . 1 112 112 LEU CB C 13 42.451 0.3 . 1 . . . . A 112 LEU CB . 30458 1 1477 . 1 . 1 112 112 LEU CG C 13 26.850 0.3 . 1 . . . . A 112 LEU CG . 30458 1 1478 . 1 . 1 112 112 LEU CD1 C 13 24.601 0.3 . 1 . . . . A 112 LEU CD1 . 30458 1 1479 . 1 . 1 112 112 LEU CD2 C 13 26.033 0.3 . 1 . . . . A 112 LEU CD2 . 30458 1 1480 . 1 . 1 112 112 LEU N N 15 119.057 0.3 . 1 . . . . A 112 LEU N . 30458 1 1481 . 1 . 1 113 113 SER H H 1 8.462 0.020 . 1 . . . . A 113 SER H . 30458 1 1482 . 1 . 1 113 113 SER HA H 1 3.182 0.020 . 1 . . . . A 113 SER HA . 30458 1 1483 . 1 . 1 113 113 SER HB2 H 1 2.485 0.020 . 2 . . . . A 113 SER HB2 . 30458 1 1484 . 1 . 1 113 113 SER HB3 H 1 2.918 0.020 . 2 . . . . A 113 SER HB3 . 30458 1 1485 . 1 . 1 113 113 SER C C 13 176.300 0.3 . 1 . . . . A 113 SER C . 30458 1 1486 . 1 . 1 113 113 SER CA C 13 61.804 0.3 . 1 . . . . A 113 SER CA . 30458 1 1487 . 1 . 1 113 113 SER CB C 13 61.896 0.3 . 1 . . . . A 113 SER CB . 30458 1 1488 . 1 . 1 113 113 SER N N 15 113.021 0.3 . 1 . . . . A 113 SER N . 30458 1 1489 . 1 . 1 114 114 LEU H H 1 6.791 0.020 . 1 . . . . A 114 LEU H . 30458 1 1490 . 1 . 1 114 114 LEU HA H 1 3.994 0.020 . 1 . . . . A 114 LEU HA . 30458 1 1491 . 1 . 1 114 114 LEU HB2 H 1 1.605 0.020 . 1 . . . . A 114 LEU HB2 . 30458 1 1492 . 1 . 1 114 114 LEU HB3 H 1 1.605 0.020 . 1 . . . . A 114 LEU HB3 . 30458 1 1493 . 1 . 1 114 114 LEU HG H 1 1.597 0.020 . 1 . . . . A 114 LEU HG . 30458 1 1494 . 1 . 1 114 114 LEU HD11 H 1 0.829 0.020 . 1 . . . . A 114 LEU HD11 . 30458 1 1495 . 1 . 1 114 114 LEU HD12 H 1 0.829 0.020 . 1 . . . . A 114 LEU HD12 . 30458 1 1496 . 1 . 1 114 114 LEU HD13 H 1 0.829 0.020 . 1 . . . . A 114 LEU HD13 . 30458 1 1497 . 1 . 1 114 114 LEU HD21 H 1 0.691 0.020 . 1 . . . . A 114 LEU HD21 . 30458 1 1498 . 1 . 1 114 114 LEU HD22 H 1 0.691 0.020 . 1 . . . . A 114 LEU HD22 . 30458 1 1499 . 1 . 1 114 114 LEU HD23 H 1 0.691 0.020 . 1 . . . . A 114 LEU HD23 . 30458 1 1500 . 1 . 1 114 114 LEU C C 13 179.100 0.3 . 1 . . . . A 114 LEU C . 30458 1 1501 . 1 . 1 114 114 LEU CA C 13 58.159 0.3 . 1 . . . . A 114 LEU CA . 30458 1 1502 . 1 . 1 114 114 LEU CB C 13 41.993 0.3 . 1 . . . . A 114 LEU CB . 30458 1 1503 . 1 . 1 114 114 LEU CG C 13 27.118 0.3 . 1 . . . . A 114 LEU CG . 30458 1 1504 . 1 . 1 114 114 LEU CD1 C 13 24.514 0.3 . 1 . . . . A 114 LEU CD1 . 30458 1 1505 . 1 . 1 114 114 LEU CD2 C 13 25.794 0.3 . 1 . . . . A 114 LEU CD2 . 30458 1 1506 . 1 . 1 114 114 LEU N N 15 121.478 0.3 . 1 . . . . A 114 LEU N . 30458 1 1507 . 1 . 1 115 115 LEU H H 1 7.279 0.020 . 1 . . . . A 115 LEU H . 30458 1 1508 . 1 . 1 115 115 LEU HA H 1 4.014 0.020 . 1 . . . . A 115 LEU HA . 30458 1 1509 . 1 . 1 115 115 LEU HB2 H 1 1.785 0.020 . 2 . . . . A 115 LEU HB2 . 30458 1 1510 . 1 . 1 115 115 LEU HB3 H 1 1.254 0.020 . 2 . . . . A 115 LEU HB3 . 30458 1 1511 . 1 . 1 115 115 LEU HG H 1 1.730 0.020 . 1 . . . . A 115 LEU HG . 30458 1 1512 . 1 . 1 115 115 LEU HD11 H 1 0.748 0.020 . 1 . . . . A 115 LEU HD11 . 30458 1 1513 . 1 . 1 115 115 LEU HD12 H 1 0.748 0.020 . 1 . . . . A 115 LEU HD12 . 30458 1 1514 . 1 . 1 115 115 LEU HD13 H 1 0.748 0.020 . 1 . . . . A 115 LEU HD13 . 30458 1 1515 . 1 . 1 115 115 LEU HD21 H 1 0.656 0.020 . 1 . . . . A 115 LEU HD21 . 30458 1 1516 . 1 . 1 115 115 LEU HD22 H 1 0.656 0.020 . 1 . . . . A 115 LEU HD22 . 30458 1 1517 . 1 . 1 115 115 LEU HD23 H 1 0.656 0.020 . 1 . . . . A 115 LEU HD23 . 30458 1 1518 . 1 . 1 115 115 LEU C C 13 179.600 0.3 . 1 . . . . A 115 LEU C . 30458 1 1519 . 1 . 1 115 115 LEU CA C 13 58.111 0.3 . 1 . . . . A 115 LEU CA . 30458 1 1520 . 1 . 1 115 115 LEU CB C 13 43.230 0.3 . 1 . . . . A 115 LEU CB . 30458 1 1521 . 1 . 1 115 115 LEU CG C 13 27.110 0.3 . 1 . . . . A 115 LEU CG . 30458 1 1522 . 1 . 1 115 115 LEU CD1 C 13 23.054 0.3 . 1 . . . . A 115 LEU CD1 . 30458 1 1523 . 1 . 1 115 115 LEU CD2 C 13 26.858 0.3 . 1 . . . . A 115 LEU CD2 . 30458 1 1524 . 1 . 1 115 115 LEU N N 15 118.106 0.3 . 1 . . . . A 115 LEU N . 30458 1 1525 . 1 . 1 116 116 LEU H H 1 8.413 0.020 . 1 . . . . A 116 LEU H . 30458 1 1526 . 1 . 1 116 116 LEU HA H 1 3.803 0.020 . 1 . . . . A 116 LEU HA . 30458 1 1527 . 1 . 1 116 116 LEU HB2 H 1 1.785 0.020 . 2 . . . . A 116 LEU HB2 . 30458 1 1528 . 1 . 1 116 116 LEU HB3 H 1 1.306 0.020 . 2 . . . . A 116 LEU HB3 . 30458 1 1529 . 1 . 1 116 116 LEU HG H 1 1.619 0.020 . 1 . . . . A 116 LEU HG . 30458 1 1530 . 1 . 1 116 116 LEU HD11 H 1 0.686 0.020 . 1 . . . . A 116 LEU HD11 . 30458 1 1531 . 1 . 1 116 116 LEU HD12 H 1 0.686 0.020 . 1 . . . . A 116 LEU HD12 . 30458 1 1532 . 1 . 1 116 116 LEU HD13 H 1 0.686 0.020 . 1 . . . . A 116 LEU HD13 . 30458 1 1533 . 1 . 1 116 116 LEU HD21 H 1 0.598 0.020 . 1 . . . . A 116 LEU HD21 . 30458 1 1534 . 1 . 1 116 116 LEU HD22 H 1 0.598 0.020 . 1 . . . . A 116 LEU HD22 . 30458 1 1535 . 1 . 1 116 116 LEU HD23 H 1 0.598 0.020 . 1 . . . . A 116 LEU HD23 . 30458 1 1536 . 1 . 1 116 116 LEU C C 13 179.141 0.3 . 1 . . . . A 116 LEU C . 30458 1 1537 . 1 . 1 116 116 LEU CA C 13 57.797 0.3 . 1 . . . . A 116 LEU CA . 30458 1 1538 . 1 . 1 116 116 LEU CB C 13 41.635 0.3 . 1 . . . . A 116 LEU CB . 30458 1 1539 . 1 . 1 116 116 LEU CG C 13 26.838 0.3 . 1 . . . . A 116 LEU CG . 30458 1 1540 . 1 . 1 116 116 LEU CD1 C 13 23.690 0.3 . 1 . . . . A 116 LEU CD1 . 30458 1 1541 . 1 . 1 116 116 LEU CD2 C 13 26.294 0.3 . 1 . . . . A 116 LEU CD2 . 30458 1 1542 . 1 . 1 116 116 LEU N N 15 118.654 0.3 . 1 . . . . A 116 LEU N . 30458 1 1543 . 1 . 1 117 117 GLN H H 1 7.951 0.020 . 1 . . . . A 117 GLN H . 30458 1 1544 . 1 . 1 117 117 GLN HA H 1 4.286 0.020 . 1 . . . . A 117 GLN HA . 30458 1 1545 . 1 . 1 117 117 GLN HB2 H 1 2.135 0.020 . 2 . . . . A 117 GLN HB2 . 30458 1 1546 . 1 . 1 117 117 GLN HB3 H 1 2.170 0.020 . 2 . . . . A 117 GLN HB3 . 30458 1 1547 . 1 . 1 117 117 GLN HG2 H 1 2.234 0.020 . 2 . . . . A 117 GLN HG2 . 30458 1 1548 . 1 . 1 117 117 GLN HG3 H 1 2.427 0.020 . 2 . . . . A 117 GLN HG3 . 30458 1 1549 . 1 . 1 117 117 GLN HE21 H 1 7.205 0.020 . 1 . . . . A 117 GLN HE21 . 30458 1 1550 . 1 . 1 117 117 GLN HE22 H 1 6.734 0.020 . 1 . . . . A 117 GLN HE22 . 30458 1 1551 . 1 . 1 117 117 GLN C C 13 178.200 0.3 . 1 . . . . A 117 GLN C . 30458 1 1552 . 1 . 1 117 117 GLN CA C 13 58.961 0.3 . 1 . . . . A 117 GLN CA . 30458 1 1553 . 1 . 1 117 117 GLN CB C 13 29.107 0.3 . 1 . . . . A 117 GLN CB . 30458 1 1554 . 1 . 1 117 117 GLN CG C 13 34.221 0.3 . 1 . . . . A 117 GLN CG . 30458 1 1555 . 1 . 1 117 117 GLN N N 15 119.143 0.3 . 1 . . . . A 117 GLN N . 30458 1 1556 . 1 . 1 117 117 GLN NE2 N 15 110.751 0.3 . 1 . . . . A 117 GLN NE2 . 30458 1 1557 . 1 . 1 118 118 VAL H H 1 8.110 0.020 . 1 . . . . A 118 VAL H . 30458 1 1558 . 1 . 1 118 118 VAL HA H 1 3.798 0.020 . 1 . . . . A 118 VAL HA . 30458 1 1559 . 1 . 1 118 118 VAL HB H 1 2.045 0.020 . 1 . . . . A 118 VAL HB . 30458 1 1560 . 1 . 1 118 118 VAL HG11 H 1 1.021 0.020 . 1 . . . . A 118 VAL HG11 . 30458 1 1561 . 1 . 1 118 118 VAL HG12 H 1 1.021 0.020 . 1 . . . . A 118 VAL HG12 . 30458 1 1562 . 1 . 1 118 118 VAL HG13 H 1 1.021 0.020 . 1 . . . . A 118 VAL HG13 . 30458 1 1563 . 1 . 1 118 118 VAL HG21 H 1 0.929 0.020 . 1 . . . . A 118 VAL HG21 . 30458 1 1564 . 1 . 1 118 118 VAL HG22 H 1 0.929 0.020 . 1 . . . . A 118 VAL HG22 . 30458 1 1565 . 1 . 1 118 118 VAL HG23 H 1 0.929 0.020 . 1 . . . . A 118 VAL HG23 . 30458 1 1566 . 1 . 1 118 118 VAL C C 13 177.900 0.3 . 1 . . . . A 118 VAL C . 30458 1 1567 . 1 . 1 118 118 VAL CA C 13 65.518 0.3 . 1 . . . . A 118 VAL CA . 30458 1 1568 . 1 . 1 118 118 VAL CB C 13 32.992 0.3 . 1 . . . . A 118 VAL CB . 30458 1 1569 . 1 . 1 118 118 VAL CG1 C 13 22.264 0.3 . 1 . . . . A 118 VAL CG1 . 30458 1 1570 . 1 . 1 118 118 VAL CG2 C 13 21.267 0.3 . 1 . . . . A 118 VAL CG2 . 30458 1 1571 . 1 . 1 118 118 VAL N N 15 117.600 0.3 . 1 . . . . A 118 VAL N . 30458 1 1572 . 1 . 1 119 119 GLU H H 1 8.595 0.020 . 1 . . . . A 119 GLU H . 30458 1 1573 . 1 . 1 119 119 GLU HA H 1 4.260 0.020 . 1 . . . . A 119 GLU HA . 30458 1 1574 . 1 . 1 119 119 GLU HB2 H 1 2.030 0.020 . 2 . . . . A 119 GLU HB2 . 30458 1 1575 . 1 . 1 119 119 GLU HB3 H 1 2.139 0.020 . 2 . . . . A 119 GLU HB3 . 30458 1 1576 . 1 . 1 119 119 GLU HG2 H 1 2.158 0.020 . 2 . . . . A 119 GLU HG2 . 30458 1 1577 . 1 . 1 119 119 GLU HG3 H 1 2.419 0.020 . 2 . . . . A 119 GLU HG3 . 30458 1 1578 . 1 . 1 119 119 GLU C C 13 177.700 0.3 . 1 . . . . A 119 GLU C . 30458 1 1579 . 1 . 1 119 119 GLU CA C 13 58.539 0.3 . 1 . . . . A 119 GLU CA . 30458 1 1580 . 1 . 1 119 119 GLU CB C 13 30.781 0.3 . 1 . . . . A 119 GLU CB . 30458 1 1581 . 1 . 1 119 119 GLU CG C 13 37.004 0.3 . 1 . . . . A 119 GLU CG . 30458 1 1582 . 1 . 1 119 119 GLU N N 15 116.946 0.3 . 1 . . . . A 119 GLU N . 30458 1 1583 . 1 . 1 120 120 GLN H H 1 7.324 0.020 . 1 . . . . A 120 GLN H . 30458 1 1584 . 1 . 1 120 120 GLN HA H 1 4.419 0.020 . 1 . . . . A 120 GLN HA . 30458 1 1585 . 1 . 1 120 120 GLN HB2 H 1 2.066 0.020 . 2 . . . . A 120 GLN HB2 . 30458 1 1586 . 1 . 1 120 120 GLN HB3 H 1 2.408 0.020 . 2 . . . . A 120 GLN HB3 . 30458 1 1587 . 1 . 1 120 120 GLN HG2 H 1 2.071 0.020 . 2 . . . . A 120 GLN HG2 . 30458 1 1588 . 1 . 1 120 120 GLN HG3 H 1 2.160 0.020 . 2 . . . . A 120 GLN HG3 . 30458 1 1589 . 1 . 1 120 120 GLN HE21 H 1 7.150 0.020 . 1 . . . . A 120 GLN HE21 . 30458 1 1590 . 1 . 1 120 120 GLN HE22 H 1 6.715 0.020 . 1 . . . . A 120 GLN HE22 . 30458 1 1591 . 1 . 1 120 120 GLN C C 13 174.700 0.3 . 1 . . . . A 120 GLN C . 30458 1 1592 . 1 . 1 120 120 GLN CA C 13 54.736 0.3 . 1 . . . . A 120 GLN CA . 30458 1 1593 . 1 . 1 120 120 GLN CB C 13 28.781 0.3 . 1 . . . . A 120 GLN CB . 30458 1 1594 . 1 . 1 120 120 GLN CG C 13 33.613 0.3 . 1 . . . . A 120 GLN CG . 30458 1 1595 . 1 . 1 120 120 GLN N N 15 113.246 0.3 . 1 . . . . A 120 GLN N . 30458 1 1596 . 1 . 1 120 120 GLN NE2 N 15 110.720 0.3 . 1 . . . . A 120 GLN NE2 . 30458 1 1597 . 1 . 1 121 121 ARG H H 1 7.410 0.020 . 1 . . . . A 121 ARG H . 30458 1 1598 . 1 . 1 121 121 ARG HA H 1 4.094 0.020 . 1 . . . . A 121 ARG HA . 30458 1 1599 . 1 . 1 121 121 ARG HB2 H 1 1.832 0.020 . 2 . . . . A 121 ARG HB2 . 30458 1 1600 . 1 . 1 121 121 ARG HB3 H 1 1.908 0.020 . 2 . . . . A 121 ARG HB3 . 30458 1 1601 . 1 . 1 121 121 ARG HG2 H 1 1.495 0.020 . 1 . . . . A 121 ARG HG2 . 30458 1 1602 . 1 . 1 121 121 ARG HG3 H 1 1.495 0.020 . 1 . . . . A 121 ARG HG3 . 30458 1 1603 . 1 . 1 121 121 ARG HD2 H 1 3.143 0.020 . 1 . . . . A 121 ARG HD2 . 30458 1 1604 . 1 . 1 121 121 ARG HD3 H 1 3.143 0.020 . 1 . . . . A 121 ARG HD3 . 30458 1 1605 . 1 . 1 121 121 ARG C C 13 175.600 0.3 . 1 . . . . A 121 ARG C . 30458 1 1606 . 1 . 1 121 121 ARG CA C 13 56.717 0.3 . 1 . . . . A 121 ARG CA . 30458 1 1607 . 1 . 1 121 121 ARG CB C 13 27.780 0.3 . 1 . . . . A 121 ARG CB . 30458 1 1608 . 1 . 1 121 121 ARG CG C 13 27.551 0.3 . 1 . . . . A 121 ARG CG . 30458 1 1609 . 1 . 1 121 121 ARG CD C 13 43.415 0.3 . 1 . . . . A 121 ARG CD . 30458 1 1610 . 1 . 1 121 121 ARG N N 15 114.800 0.3 . 1 . . . . A 121 ARG N . 30458 1 1611 . 1 . 1 122 122 MET H H 1 7.755 0.020 . 1 . . . . A 122 MET H . 30458 1 1612 . 1 . 1 122 122 MET HA H 1 4.612 0.020 . 1 . . . . A 122 MET HA . 30458 1 1613 . 1 . 1 122 122 MET HB2 H 1 1.595 0.020 . 2 . . . . A 122 MET HB2 . 30458 1 1614 . 1 . 1 122 122 MET HB3 H 1 1.773 0.020 . 2 . . . . A 122 MET HB3 . 30458 1 1615 . 1 . 1 122 122 MET HG2 H 1 2.479 0.020 . 1 . . . . A 122 MET HG2 . 30458 1 1616 . 1 . 1 122 122 MET HG3 H 1 2.479 0.020 . 1 . . . . A 122 MET HG3 . 30458 1 1617 . 1 . 1 122 122 MET HE1 H 1 2.001 0.020 . 1 . . . . A 122 MET HE1 . 30458 1 1618 . 1 . 1 122 122 MET HE2 H 1 2.001 0.020 . 1 . . . . A 122 MET HE2 . 30458 1 1619 . 1 . 1 122 122 MET HE3 H 1 2.001 0.020 . 1 . . . . A 122 MET HE3 . 30458 1 1620 . 1 . 1 122 122 MET C C 13 174.054 0.3 . 1 . . . . A 122 MET C . 30458 1 1621 . 1 . 1 122 122 MET CA C 13 53.753 0.3 . 1 . . . . A 122 MET CA . 30458 1 1622 . 1 . 1 122 122 MET CB C 13 34.451 0.3 . 1 . . . . A 122 MET CB . 30458 1 1623 . 1 . 1 122 122 MET CG C 13 32.063 0.3 . 1 . . . . A 122 MET CG . 30458 1 1624 . 1 . 1 122 122 MET CE C 13 17.784 0.3 . 1 . . . . A 122 MET CE . 30458 1 1625 . 1 . 1 122 122 MET N N 15 120.009 0.3 . 1 . . . . A 122 MET N . 30458 1 1626 . 1 . 1 123 123 PRO HA H 1 4.438 0.020 . 1 . . . . A 123 PRO HA . 30458 1 1627 . 1 . 1 123 123 PRO HB2 H 1 2.140 0.020 . 2 . . . . A 123 PRO HB2 . 30458 1 1628 . 1 . 1 123 123 PRO HB3 H 1 1.885 0.020 . 2 . . . . A 123 PRO HB3 . 30458 1 1629 . 1 . 1 123 123 PRO HG2 H 1 1.948 0.020 . 1 . . . . A 123 PRO HG2 . 30458 1 1630 . 1 . 1 123 123 PRO HG3 H 1 1.948 0.020 . 1 . . . . A 123 PRO HG3 . 30458 1 1631 . 1 . 1 123 123 PRO HD2 H 1 3.824 0.020 . 2 . . . . A 123 PRO HD2 . 30458 1 1632 . 1 . 1 123 123 PRO HD3 H 1 3.622 0.020 . 2 . . . . A 123 PRO HD3 . 30458 1 1633 . 1 . 1 123 123 PRO C C 13 176.300 0.3 . 1 . . . . A 123 PRO C . 30458 1 1634 . 1 . 1 123 123 PRO CA C 13 62.958 0.3 . 1 . . . . A 123 PRO CA . 30458 1 1635 . 1 . 1 123 123 PRO CB C 13 31.371 0.3 . 1 . . . . A 123 PRO CB . 30458 1 1636 . 1 . 1 123 123 PRO CG C 13 27.659 0.3 . 1 . . . . A 123 PRO CG . 30458 1 1637 . 1 . 1 123 123 PRO CD C 13 50.813 0.3 . 1 . . . . A 123 PRO CD . 30458 1 1638 . 1 . 1 124 124 VAL H H 1 8.062 0.020 . 1 . . . . A 124 VAL H . 30458 1 1639 . 1 . 1 124 124 VAL HA H 1 4.062 0.020 . 1 . . . . A 124 VAL HA . 30458 1 1640 . 1 . 1 124 124 VAL HB H 1 1.943 0.020 . 1 . . . . A 124 VAL HB . 30458 1 1641 . 1 . 1 124 124 VAL HG11 H 1 0.837 0.020 . 1 . . . . A 124 VAL HG11 . 30458 1 1642 . 1 . 1 124 124 VAL HG12 H 1 0.837 0.020 . 1 . . . . A 124 VAL HG12 . 30458 1 1643 . 1 . 1 124 124 VAL HG13 H 1 0.837 0.020 . 1 . . . . A 124 VAL HG13 . 30458 1 1644 . 1 . 1 124 124 VAL HG21 H 1 0.819 0.020 . 1 . . . . A 124 VAL HG21 . 30458 1 1645 . 1 . 1 124 124 VAL HG22 H 1 0.819 0.020 . 1 . . . . A 124 VAL HG22 . 30458 1 1646 . 1 . 1 124 124 VAL HG23 H 1 0.819 0.020 . 1 . . . . A 124 VAL HG23 . 30458 1 1647 . 1 . 1 124 124 VAL C C 13 175.800 0.3 . 1 . . . . A 124 VAL C . 30458 1 1648 . 1 . 1 124 124 VAL CA C 13 61.788 0.3 . 1 . . . . A 124 VAL CA . 30458 1 1649 . 1 . 1 124 124 VAL CB C 13 33.426 0.3 . 1 . . . . A 124 VAL CB . 30458 1 1650 . 1 . 1 124 124 VAL CG1 C 13 21.680 0.3 . 1 . . . . A 124 VAL CG1 . 30458 1 1651 . 1 . 1 124 124 VAL CG2 C 13 20.965 0.3 . 1 . . . . A 124 VAL CG2 . 30458 1 1652 . 1 . 1 124 124 VAL N N 15 119.957 0.3 . 1 . . . . A 124 VAL N . 30458 1 1653 . 1 . 1 125 125 SER H H 1 8.417 0.020 . 1 . . . . A 125 SER H . 30458 1 1654 . 1 . 1 125 125 SER HA H 1 4.751 0.020 . 1 . . . . A 125 SER HA . 30458 1 1655 . 1 . 1 125 125 SER HB2 H 1 3.841 0.020 . 1 . . . . A 125 SER HB2 . 30458 1 1656 . 1 . 1 125 125 SER HB3 H 1 3.841 0.020 . 1 . . . . A 125 SER HB3 . 30458 1 1657 . 1 . 1 125 125 SER C C 13 173.114 0.3 . 1 . . . . A 125 SER C . 30458 1 1658 . 1 . 1 125 125 SER CA C 13 56.296 0.3 . 1 . . . . A 125 SER CA . 30458 1 1659 . 1 . 1 125 125 SER CB C 13 63.769 0.3 . 1 . . . . A 125 SER CB . 30458 1 1660 . 1 . 1 125 125 SER N N 15 121.207 0.3 . 1 . . . . A 125 SER N . 30458 1 1661 . 1 . 1 126 126 PRO HA H 1 4.440 0.020 . 1 . . . . A 126 PRO HA . 30458 1 1662 . 1 . 1 126 126 PRO HB2 H 1 2.214 0.020 . 1 . . . . A 126 PRO HB2 . 30458 1 1663 . 1 . 1 126 126 PRO HB3 H 1 2.214 0.020 . 1 . . . . A 126 PRO HB3 . 30458 1 1664 . 1 . 1 126 126 PRO HG2 H 1 1.959 0.020 . 1 . . . . A 126 PRO HG2 . 30458 1 1665 . 1 . 1 126 126 PRO HG3 H 1 1.959 0.020 . 1 . . . . A 126 PRO HG3 . 30458 1 1666 . 1 . 1 126 126 PRO HD2 H 1 3.774 0.020 . 2 . . . . A 126 PRO HD2 . 30458 1 1667 . 1 . 1 126 126 PRO HD3 H 1 3.713 0.020 . 2 . . . . A 126 PRO HD3 . 30458 1 1668 . 1 . 1 126 126 PRO C C 13 177.100 0.3 . 1 . . . . A 126 PRO C . 30458 1 1669 . 1 . 1 126 126 PRO CA C 13 63.695 0.3 . 1 . . . . A 126 PRO CA . 30458 1 1670 . 1 . 1 126 126 PRO CB C 13 32.224 0.3 . 1 . . . . A 126 PRO CB . 30458 1 1671 . 1 . 1 126 126 PRO CG C 13 27.754 0.3 . 1 . . . . A 126 PRO CG . 30458 1 1672 . 1 . 1 126 126 PRO CD C 13 50.989 0.3 . 1 . . . . A 126 PRO CD . 30458 1 1673 . 1 . 1 127 127 ILE H H 1 8.012 0.020 . 1 . . . . A 127 ILE H . 30458 1 1674 . 1 . 1 127 127 ILE HA H 1 4.094 0.020 . 1 . . . . A 127 ILE HA . 30458 1 1675 . 1 . 1 127 127 ILE HB H 1 1.765 0.020 . 1 . . . . A 127 ILE HB . 30458 1 1676 . 1 . 1 127 127 ILE HG12 H 1 1.063 0.020 . 2 . . . . A 127 ILE HG12 . 30458 1 1677 . 1 . 1 127 127 ILE HG13 H 1 1.327 0.020 . 2 . . . . A 127 ILE HG13 . 30458 1 1678 . 1 . 1 127 127 ILE HG21 H 1 0.773 0.020 . 1 . . . . A 127 ILE HG21 . 30458 1 1679 . 1 . 1 127 127 ILE HG22 H 1 0.773 0.020 . 1 . . . . A 127 ILE HG22 . 30458 1 1680 . 1 . 1 127 127 ILE HG23 H 1 0.773 0.020 . 1 . . . . A 127 ILE HG23 . 30458 1 1681 . 1 . 1 127 127 ILE HD11 H 1 0.681 0.020 . 1 . . . . A 127 ILE HD11 . 30458 1 1682 . 1 . 1 127 127 ILE HD12 H 1 0.681 0.020 . 1 . . . . A 127 ILE HD12 . 30458 1 1683 . 1 . 1 127 127 ILE HD13 H 1 0.681 0.020 . 1 . . . . A 127 ILE HD13 . 30458 1 1684 . 1 . 1 127 127 ILE C C 13 176.300 0.3 . 1 . . . . A 127 ILE C . 30458 1 1685 . 1 . 1 127 127 ILE CA C 13 61.569 0.3 . 1 . . . . A 127 ILE CA . 30458 1 1686 . 1 . 1 127 127 ILE CB C 13 38.759 0.3 . 1 . . . . A 127 ILE CB . 30458 1 1687 . 1 . 1 127 127 ILE CG1 C 13 27.534 0.3 . 1 . . . . A 127 ILE CG1 . 30458 1 1688 . 1 . 1 127 127 ILE CG2 C 13 17.776 0.3 . 1 . . . . A 127 ILE CG2 . 30458 1 1689 . 1 . 1 127 127 ILE CD1 C 13 13.245 0.3 . 1 . . . . A 127 ILE CD1 . 30458 1 1690 . 1 . 1 127 127 ILE N N 15 119.775 0.3 . 1 . . . . A 127 ILE N . 30458 1 1691 . 1 . 1 128 128 SER H H 1 8.189 0.020 . 1 . . . . A 128 SER H . 30458 1 1692 . 1 . 1 128 128 SER HA H 1 4.347 0.020 . 1 . . . . A 128 SER HA . 30458 1 1693 . 1 . 1 128 128 SER HB2 H 1 3.776 0.020 . 2 . . . . A 128 SER HB2 . 30458 1 1694 . 1 . 1 128 128 SER HB3 H 1 3.815 0.020 . 2 . . . . A 128 SER HB3 . 30458 1 1695 . 1 . 1 128 128 SER C C 13 174.600 0.3 . 1 . . . . A 128 SER C . 30458 1 1696 . 1 . 1 128 128 SER CA C 13 58.565 0.3 . 1 . . . . A 128 SER CA . 30458 1 1697 . 1 . 1 128 128 SER CB C 13 63.697 0.3 . 1 . . . . A 128 SER CB . 30458 1 1698 . 1 . 1 128 128 SER N N 15 118.734 0.3 . 1 . . . . A 128 SER N . 30458 1 1699 . 1 . 1 129 129 GLN H H 1 8.306 0.020 . 1 . . . . A 129 GLN H . 30458 1 1700 . 1 . 1 129 129 GLN HA H 1 4.159 0.020 . 1 . . . . A 129 GLN HA . 30458 1 1701 . 1 . 1 129 129 GLN HB2 H 1 1.821 0.020 . 1 . . . . A 129 GLN HB2 . 30458 1 1702 . 1 . 1 129 129 GLN HB3 H 1 1.821 0.020 . 1 . . . . A 129 GLN HB3 . 30458 1 1703 . 1 . 1 129 129 GLN HG2 H 1 2.170 0.020 . 1 . . . . A 129 GLN HG2 . 30458 1 1704 . 1 . 1 129 129 GLN HG3 H 1 2.170 0.020 . 1 . . . . A 129 GLN HG3 . 30458 1 1705 . 1 . 1 129 129 GLN HE21 H 1 7.275 0.020 . 1 . . . . A 129 GLN HE21 . 30458 1 1706 . 1 . 1 129 129 GLN HE22 H 1 6.620 0.020 . 1 . . . . A 129 GLN HE22 . 30458 1 1707 . 1 . 1 129 129 GLN C C 13 176.200 0.3 . 1 . . . . A 129 GLN C . 30458 1 1708 . 1 . 1 129 129 GLN CA C 13 57.889 0.3 . 1 . . . . A 129 GLN CA . 30458 1 1709 . 1 . 1 129 129 GLN CB C 13 29.100 0.3 . 1 . . . . A 129 GLN CB . 30458 1 1710 . 1 . 1 129 129 GLN CG C 13 33.951 0.3 . 1 . . . . A 129 GLN CG . 30458 1 1711 . 1 . 1 129 129 GLN N N 15 122.493 0.3 . 1 . . . . A 129 GLN N . 30458 1 1712 . 1 . 1 129 129 GLN NE2 N 15 111.544 0.3 . 1 . . . . A 129 GLN NE2 . 30458 1 1713 . 1 . 1 130 130 GLY H H 1 8.138 0.020 . 1 . . . . A 130 GLY H . 30458 1 1714 . 1 . 1 130 130 GLY HA2 H 1 2.970 0.020 . 2 . . . . A 130 GLY HA2 . 30458 1 1715 . 1 . 1 130 130 GLY HA3 H 1 3.569 0.020 . 2 . . . . A 130 GLY HA3 . 30458 1 1716 . 1 . 1 130 130 GLY C C 13 175.100 0.3 . 1 . . . . A 130 GLY C . 30458 1 1717 . 1 . 1 130 130 GLY CA C 13 45.409 0.3 . 1 . . . . A 130 GLY CA . 30458 1 1718 . 1 . 1 130 130 GLY N N 15 109.162 0.3 . 1 . . . . A 130 GLY N . 30458 1 1719 . 1 . 1 131 131 ALA H H 1 8.057 0.020 . 1 . . . . A 131 ALA H . 30458 1 1720 . 1 . 1 131 131 ALA HA H 1 4.205 0.020 . 1 . . . . A 131 ALA HA . 30458 1 1721 . 1 . 1 131 131 ALA HB1 H 1 1.374 0.020 . 1 . . . . A 131 ALA HB1 . 30458 1 1722 . 1 . 1 131 131 ALA HB2 H 1 1.374 0.020 . 1 . . . . A 131 ALA HB2 . 30458 1 1723 . 1 . 1 131 131 ALA HB3 H 1 1.374 0.020 . 1 . . . . A 131 ALA HB3 . 30458 1 1724 . 1 . 1 131 131 ALA C C 13 178.700 0.3 . 1 . . . . A 131 ALA C . 30458 1 1725 . 1 . 1 131 131 ALA CA C 13 53.902 0.3 . 1 . . . . A 131 ALA CA . 30458 1 1726 . 1 . 1 131 131 ALA CB C 13 19.082 0.3 . 1 . . . . A 131 ALA CB . 30458 1 1727 . 1 . 1 131 131 ALA N N 15 124.751 0.3 . 1 . . . . A 131 ALA N . 30458 1 1728 . 1 . 1 132 132 SER H H 1 8.324 0.020 . 1 . . . . A 132 SER H . 30458 1 1729 . 1 . 1 132 132 SER HA H 1 4.529 0.020 . 1 . . . . A 132 SER HA . 30458 1 1730 . 1 . 1 132 132 SER HB2 H 1 3.942 0.020 . 2 . . . . A 132 SER HB2 . 30458 1 1731 . 1 . 1 132 132 SER HB3 H 1 4.088 0.020 . 2 . . . . A 132 SER HB3 . 30458 1 1732 . 1 . 1 132 132 SER C C 13 175.700 0.3 . 1 . . . . A 132 SER C . 30458 1 1733 . 1 . 1 132 132 SER CA C 13 58.772 0.3 . 1 . . . . A 132 SER CA . 30458 1 1734 . 1 . 1 132 132 SER CB C 13 63.999 0.3 . 1 . . . . A 132 SER CB . 30458 1 1735 . 1 . 1 132 132 SER N N 15 113.295 0.3 . 1 . . . . A 132 SER N . 30458 1 1736 . 1 . 1 133 133 TRP H H 1 8.418 0.020 . 1 . . . . A 133 TRP H . 30458 1 1737 . 1 . 1 133 133 TRP HA H 1 4.489 0.020 . 1 . . . . A 133 TRP HA . 30458 1 1738 . 1 . 1 133 133 TRP HB2 H 1 3.125 0.020 . 1 . . . . A 133 TRP HB2 . 30458 1 1739 . 1 . 1 133 133 TRP HB3 H 1 3.125 0.020 . 1 . . . . A 133 TRP HB3 . 30458 1 1740 . 1 . 1 133 133 TRP HD1 H 1 6.946 0.020 . 1 . . . . A 133 TRP HD1 . 30458 1 1741 . 1 . 1 133 133 TRP HE1 H 1 9.969 0.020 . 1 . . . . A 133 TRP HE1 . 30458 1 1742 . 1 . 1 133 133 TRP HE3 H 1 7.462 0.020 . 1 . . . . A 133 TRP HE3 . 30458 1 1743 . 1 . 1 133 133 TRP HZ2 H 1 7.228 0.020 . 1 . . . . A 133 TRP HZ2 . 30458 1 1744 . 1 . 1 133 133 TRP HZ3 H 1 7.201 0.020 . 1 . . . . A 133 TRP HZ3 . 30458 1 1745 . 1 . 1 133 133 TRP HH2 H 1 6.749 0.020 . 1 . . . . A 133 TRP HH2 . 30458 1 1746 . 1 . 1 133 133 TRP C C 13 178.200 0.3 . 1 . . . . A 133 TRP C . 30458 1 1747 . 1 . 1 133 133 TRP CA C 13 59.005 0.3 . 1 . . . . A 133 TRP CA . 30458 1 1748 . 1 . 1 133 133 TRP CB C 13 29.037 0.3 . 1 . . . . A 133 TRP CB . 30458 1 1749 . 1 . 1 133 133 TRP CD1 C 13 124.080 0.3 . 1 . . . . A 133 TRP CD1 . 30458 1 1750 . 1 . 1 133 133 TRP CE3 C 13 121.507 0.3 . 1 . . . . A 133 TRP CE3 . 30458 1 1751 . 1 . 1 133 133 TRP CZ2 C 13 113.728 0.3 . 1 . . . . A 133 TRP CZ2 . 30458 1 1752 . 1 . 1 133 133 TRP CZ3 C 13 121.501 0.3 . 1 . . . . A 133 TRP CZ3 . 30458 1 1753 . 1 . 1 133 133 TRP CH2 C 13 123.089 0.3 . 1 . . . . A 133 TRP CH2 . 30458 1 1754 . 1 . 1 133 133 TRP N N 15 122.866 0.3 . 1 . . . . A 133 TRP N . 30458 1 1755 . 1 . 1 133 133 TRP NE1 N 15 127.797 0.3 . 1 . . . . A 133 TRP NE1 . 30458 1 1756 . 1 . 1 134 134 ALA H H 1 8.386 0.020 . 1 . . . . A 134 ALA H . 30458 1 1757 . 1 . 1 134 134 ALA HA H 1 4.195 0.020 . 1 . . . . A 134 ALA HA . 30458 1 1758 . 1 . 1 134 134 ALA HB1 H 1 1.456 0.020 . 1 . . . . A 134 ALA HB1 . 30458 1 1759 . 1 . 1 134 134 ALA HB2 H 1 1.456 0.020 . 1 . . . . A 134 ALA HB2 . 30458 1 1760 . 1 . 1 134 134 ALA HB3 H 1 1.456 0.020 . 1 . . . . A 134 ALA HB3 . 30458 1 1761 . 1 . 1 134 134 ALA C C 13 180.700 0.3 . 1 . . . . A 134 ALA C . 30458 1 1762 . 1 . 1 134 134 ALA CA C 13 55.752 0.3 . 1 . . . . A 134 ALA CA . 30458 1 1763 . 1 . 1 134 134 ALA CB C 13 18.126 0.3 . 1 . . . . A 134 ALA CB . 30458 1 1764 . 1 . 1 134 134 ALA N N 15 120.478 0.3 . 1 . . . . A 134 ALA N . 30458 1 1765 . 1 . 1 135 135 GLN H H 1 7.838 0.020 . 1 . . . . A 135 GLN H . 30458 1 1766 . 1 . 1 135 135 GLN HA H 1 4.055 0.020 . 1 . . . . A 135 GLN HA . 30458 1 1767 . 1 . 1 135 135 GLN HB2 H 1 2.102 0.020 . 2 . . . . A 135 GLN HB2 . 30458 1 1768 . 1 . 1 135 135 GLN HB3 H 1 2.155 0.020 . 2 . . . . A 135 GLN HB3 . 30458 1 1769 . 1 . 1 135 135 GLN HG2 H 1 2.388 0.020 . 1 . . . . A 135 GLN HG2 . 30458 1 1770 . 1 . 1 135 135 GLN HG3 H 1 2.388 0.020 . 1 . . . . A 135 GLN HG3 . 30458 1 1771 . 1 . 1 135 135 GLN HE21 H 1 7.509 0.020 . 1 . . . . A 135 GLN HE21 . 30458 1 1772 . 1 . 1 135 135 GLN HE22 H 1 6.844 0.020 . 1 . . . . A 135 GLN HE22 . 30458 1 1773 . 1 . 1 135 135 GLN C C 13 179.200 0.3 . 1 . . . . A 135 GLN C . 30458 1 1774 . 1 . 1 135 135 GLN CA C 13 58.981 0.3 . 1 . . . . A 135 GLN CA . 30458 1 1775 . 1 . 1 135 135 GLN CB C 13 28.461 0.3 . 1 . . . . A 135 GLN CB . 30458 1 1776 . 1 . 1 135 135 GLN CG C 13 34.272 0.3 . 1 . . . . A 135 GLN CG . 30458 1 1777 . 1 . 1 135 135 GLN N N 15 118.881 0.3 . 1 . . . . A 135 GLN N . 30458 1 1778 . 1 . 1 135 135 GLN NE2 N 15 111.845 0.3 . 1 . . . . A 135 GLN NE2 . 30458 1 1779 . 1 . 1 136 136 GLU H H 1 7.715 0.020 . 1 . . . . A 136 GLU H . 30458 1 1780 . 1 . 1 136 136 GLU HA H 1 3.780 0.020 . 1 . . . . A 136 GLU HA . 30458 1 1781 . 1 . 1 136 136 GLU HB2 H 1 1.526 0.020 . 2 . . . . A 136 GLU HB2 . 30458 1 1782 . 1 . 1 136 136 GLU HB3 H 1 1.884 0.020 . 2 . . . . A 136 GLU HB3 . 30458 1 1783 . 1 . 1 136 136 GLU HG2 H 1 2.087 0.020 . 2 . . . . A 136 GLU HG2 . 30458 1 1784 . 1 . 1 136 136 GLU HG3 H 1 2.449 0.020 . 2 . . . . A 136 GLU HG3 . 30458 1 1785 . 1 . 1 136 136 GLU C C 13 177.800 0.3 . 1 . . . . A 136 GLU C . 30458 1 1786 . 1 . 1 136 136 GLU CA C 13 59.194 0.3 . 1 . . . . A 136 GLU CA . 30458 1 1787 . 1 . 1 136 136 GLU CB C 13 30.178 0.3 . 1 . . . . A 136 GLU CB . 30458 1 1788 . 1 . 1 136 136 GLU CG C 13 36.352 0.3 . 1 . . . . A 136 GLU CG . 30458 1 1789 . 1 . 1 136 136 GLU N N 15 120.900 0.3 . 1 . . . . A 136 GLU N . 30458 1 1790 . 1 . 1 137 137 ASP H H 1 8.778 0.020 . 1 . . . . A 137 ASP H . 30458 1 1791 . 1 . 1 137 137 ASP HA H 1 4.418 0.020 . 1 . . . . A 137 ASP HA . 30458 1 1792 . 1 . 1 137 137 ASP HB2 H 1 2.600 0.020 . 2 . . . . A 137 ASP HB2 . 30458 1 1793 . 1 . 1 137 137 ASP HB3 H 1 2.882 0.020 . 2 . . . . A 137 ASP HB3 . 30458 1 1794 . 1 . 1 137 137 ASP C C 13 178.100 0.3 . 1 . . . . A 137 ASP C . 30458 1 1795 . 1 . 1 137 137 ASP CA C 13 57.446 0.3 . 1 . . . . A 137 ASP CA . 30458 1 1796 . 1 . 1 137 137 ASP CB C 13 40.253 0.3 . 1 . . . . A 137 ASP CB . 30458 1 1797 . 1 . 1 137 137 ASP N N 15 118.144 0.3 . 1 . . . . A 137 ASP N . 30458 1 1798 . 1 . 1 138 138 GLN H H 1 7.497 0.020 . 1 . . . . A 138 GLN H . 30458 1 1799 . 1 . 1 138 138 GLN HA H 1 3.850 0.020 . 1 . . . . A 138 GLN HA . 30458 1 1800 . 1 . 1 138 138 GLN HB2 H 1 2.155 0.020 . 1 . . . . A 138 GLN HB2 . 30458 1 1801 . 1 . 1 138 138 GLN HB3 H 1 2.155 0.020 . 1 . . . . A 138 GLN HB3 . 30458 1 1802 . 1 . 1 138 138 GLN HG2 H 1 2.378 0.020 . 2 . . . . A 138 GLN HG2 . 30458 1 1803 . 1 . 1 138 138 GLN HG3 H 1 2.462 0.020 . 2 . . . . A 138 GLN HG3 . 30458 1 1804 . 1 . 1 138 138 GLN HE21 H 1 7.482 0.020 . 1 . . . . A 138 GLN HE21 . 30458 1 1805 . 1 . 1 138 138 GLN HE22 H 1 6.896 0.020 . 1 . . . . A 138 GLN HE22 . 30458 1 1806 . 1 . 1 138 138 GLN C C 13 178.400 0.3 . 1 . . . . A 138 GLN C . 30458 1 1807 . 1 . 1 138 138 GLN CA C 13 59.096 0.3 . 1 . . . . A 138 GLN CA . 30458 1 1808 . 1 . 1 138 138 GLN CB C 13 28.664 0.3 . 1 . . . . A 138 GLN CB . 30458 1 1809 . 1 . 1 138 138 GLN CG C 13 34.001 0.3 . 1 . . . . A 138 GLN CG . 30458 1 1810 . 1 . 1 138 138 GLN N N 15 116.856 0.3 . 1 . . . . A 138 GLN N . 30458 1 1811 . 1 . 1 138 138 GLN NE2 N 15 113.038 0.3 . 1 . . . . A 138 GLN NE2 . 30458 1 1812 . 1 . 1 139 139 GLN H H 1 7.512 0.020 . 1 . . . . A 139 GLN H . 30458 1 1813 . 1 . 1 139 139 GLN HA H 1 4.074 0.020 . 1 . . . . A 139 GLN HA . 30458 1 1814 . 1 . 1 139 139 GLN HB2 H 1 2.156 0.020 . 1 . . . . A 139 GLN HB2 . 30458 1 1815 . 1 . 1 139 139 GLN HB3 H 1 2.156 0.020 . 1 . . . . A 139 GLN HB3 . 30458 1 1816 . 1 . 1 139 139 GLN HG2 H 1 2.430 0.020 . 2 . . . . A 139 GLN HG2 . 30458 1 1817 . 1 . 1 139 139 GLN HG3 H 1 2.492 0.020 . 2 . . . . A 139 GLN HG3 . 30458 1 1818 . 1 . 1 139 139 GLN HE21 H 1 7.478 0.020 . 1 . . . . A 139 GLN HE21 . 30458 1 1819 . 1 . 1 139 139 GLN HE22 H 1 6.901 0.020 . 1 . . . . A 139 GLN HE22 . 30458 1 1820 . 1 . 1 139 139 GLN C C 13 178.900 0.3 . 1 . . . . A 139 GLN C . 30458 1 1821 . 1 . 1 139 139 GLN CA C 13 58.900 0.3 . 1 . . . . A 139 GLN CA . 30458 1 1822 . 1 . 1 139 139 GLN CB C 13 28.600 0.3 . 1 . . . . A 139 GLN CB . 30458 1 1823 . 1 . 1 139 139 GLN CG C 13 34.189 0.3 . 1 . . . . A 139 GLN CG . 30458 1 1824 . 1 . 1 139 139 GLN N N 15 119.420 0.3 . 1 . . . . A 139 GLN N . 30458 1 1825 . 1 . 1 139 139 GLN NE2 N 15 113.027 0.3 . 1 . . . . A 139 GLN NE2 . 30458 1 1826 . 1 . 1 140 140 ASP H H 1 9.106 0.020 . 1 . . . . A 140 ASP H . 30458 1 1827 . 1 . 1 140 140 ASP HA H 1 3.981 0.020 . 1 . . . . A 140 ASP HA . 30458 1 1828 . 1 . 1 140 140 ASP HB2 H 1 2.092 0.020 . 2 . . . . A 140 ASP HB2 . 30458 1 1829 . 1 . 1 140 140 ASP HB3 H 1 2.772 0.020 . 2 . . . . A 140 ASP HB3 . 30458 1 1830 . 1 . 1 140 140 ASP C C 13 177.700 0.3 . 1 . . . . A 140 ASP C . 30458 1 1831 . 1 . 1 140 140 ASP CA C 13 57.444 0.3 . 1 . . . . A 140 ASP CA . 30458 1 1832 . 1 . 1 140 140 ASP CB C 13 40.868 0.3 . 1 . . . . A 140 ASP CB . 30458 1 1833 . 1 . 1 140 140 ASP N N 15 121.597 0.3 . 1 . . . . A 140 ASP N . 30458 1 1834 . 1 . 1 141 141 ALA H H 1 8.702 0.020 . 1 . . . . A 141 ALA H . 30458 1 1835 . 1 . 1 141 141 ALA HA H 1 4.211 0.020 . 1 . . . . A 141 ALA HA . 30458 1 1836 . 1 . 1 141 141 ALA HB1 H 1 1.362 0.020 . 1 . . . . A 141 ALA HB1 . 30458 1 1837 . 1 . 1 141 141 ALA HB2 H 1 1.362 0.020 . 1 . . . . A 141 ALA HB2 . 30458 1 1838 . 1 . 1 141 141 ALA HB3 H 1 1.362 0.020 . 1 . . . . A 141 ALA HB3 . 30458 1 1839 . 1 . 1 141 141 ALA C C 13 180.800 0.3 . 1 . . . . A 141 ALA C . 30458 1 1840 . 1 . 1 141 141 ALA CA C 13 55.042 0.3 . 1 . . . . A 141 ALA CA . 30458 1 1841 . 1 . 1 141 141 ALA CB C 13 19.643 0.3 . 1 . . . . A 141 ALA CB . 30458 1 1842 . 1 . 1 141 141 ALA N N 15 120.867 0.3 . 1 . . . . A 141 ALA N . 30458 1 1843 . 1 . 1 142 142 ASP H H 1 7.833 0.020 . 1 . . . . A 142 ASP H . 30458 1 1844 . 1 . 1 142 142 ASP HA H 1 4.390 0.020 . 1 . . . . A 142 ASP HA . 30458 1 1845 . 1 . 1 142 142 ASP HB2 H 1 2.694 0.020 . 2 . . . . A 142 ASP HB2 . 30458 1 1846 . 1 . 1 142 142 ASP HB3 H 1 2.837 0.020 . 2 . . . . A 142 ASP HB3 . 30458 1 1847 . 1 . 1 142 142 ASP C C 13 178.600 0.3 . 1 . . . . A 142 ASP C . 30458 1 1848 . 1 . 1 142 142 ASP CA C 13 57.833 0.3 . 1 . . . . A 142 ASP CA . 30458 1 1849 . 1 . 1 142 142 ASP CB C 13 41.480 0.3 . 1 . . . . A 142 ASP CB . 30458 1 1850 . 1 . 1 142 142 ASP N N 15 119.138 0.3 . 1 . . . . A 142 ASP N . 30458 1 1851 . 1 . 1 143 143 GLU H H 1 7.835 0.020 . 1 . . . . A 143 GLU H . 30458 1 1852 . 1 . 1 143 143 GLU HA H 1 3.987 0.020 . 1 . . . . A 143 GLU HA . 30458 1 1853 . 1 . 1 143 143 GLU HB2 H 1 2.033 0.020 . 2 . . . . A 143 GLU HB2 . 30458 1 1854 . 1 . 1 143 143 GLU HB3 H 1 2.169 0.020 . 2 . . . . A 143 GLU HB3 . 30458 1 1855 . 1 . 1 143 143 GLU HG2 H 1 2.218 0.020 . 2 . . . . A 143 GLU HG2 . 30458 1 1856 . 1 . 1 143 143 GLU HG3 H 1 2.462 0.020 . 2 . . . . A 143 GLU HG3 . 30458 1 1857 . 1 . 1 143 143 GLU C C 13 180.100 0.3 . 1 . . . . A 143 GLU C . 30458 1 1858 . 1 . 1 143 143 GLU CA C 13 59.969 0.3 . 1 . . . . A 143 GLU CA . 30458 1 1859 . 1 . 1 143 143 GLU CB C 13 29.664 0.3 . 1 . . . . A 143 GLU CB . 30458 1 1860 . 1 . 1 143 143 GLU CG C 13 36.675 0.3 . 1 . . . . A 143 GLU CG . 30458 1 1861 . 1 . 1 143 143 GLU N N 15 119.500 0.3 . 1 . . . . A 143 GLU N . 30458 1 1862 . 1 . 1 144 144 ASP H H 1 8.834 0.020 . 1 . . . . A 144 ASP H . 30458 1 1863 . 1 . 1 144 144 ASP HA H 1 4.612 0.020 . 1 . . . . A 144 ASP HA . 30458 1 1864 . 1 . 1 144 144 ASP HB2 H 1 2.779 0.020 . 2 . . . . A 144 ASP HB2 . 30458 1 1865 . 1 . 1 144 144 ASP HB3 H 1 2.804 0.020 . 2 . . . . A 144 ASP HB3 . 30458 1 1866 . 1 . 1 144 144 ASP C C 13 179.500 0.3 . 1 . . . . A 144 ASP C . 30458 1 1867 . 1 . 1 144 144 ASP CA C 13 57.616 0.3 . 1 . . . . A 144 ASP CA . 30458 1 1868 . 1 . 1 144 144 ASP CB C 13 41.294 0.3 . 1 . . . . A 144 ASP CB . 30458 1 1869 . 1 . 1 144 144 ASP N N 15 120.963 0.3 . 1 . . . . A 144 ASP N . 30458 1 1870 . 1 . 1 145 145 ARG H H 1 8.507 0.020 . 1 . . . . A 145 ARG H . 30458 1 1871 . 1 . 1 145 145 ARG HA H 1 4.123 0.020 . 1 . . . . A 145 ARG HA . 30458 1 1872 . 1 . 1 145 145 ARG HB2 H 1 2.040 0.020 . 1 . . . . A 145 ARG HB2 . 30458 1 1873 . 1 . 1 145 145 ARG HB3 H 1 2.040 0.020 . 1 . . . . A 145 ARG HB3 . 30458 1 1874 . 1 . 1 145 145 ARG HG2 H 1 1.724 0.020 . 1 . . . . A 145 ARG HG2 . 30458 1 1875 . 1 . 1 145 145 ARG HG3 H 1 1.724 0.020 . 1 . . . . A 145 ARG HG3 . 30458 1 1876 . 1 . 1 145 145 ARG HD2 H 1 3.194 0.020 . 1 . . . . A 145 ARG HD2 . 30458 1 1877 . 1 . 1 145 145 ARG HD3 H 1 3.194 0.020 . 1 . . . . A 145 ARG HD3 . 30458 1 1878 . 1 . 1 145 145 ARG C C 13 178.700 0.3 . 1 . . . . A 145 ARG C . 30458 1 1879 . 1 . 1 145 145 ARG CA C 13 59.580 0.3 . 1 . . . . A 145 ARG CA . 30458 1 1880 . 1 . 1 145 145 ARG CB C 13 29.698 0.3 . 1 . . . . A 145 ARG CB . 30458 1 1881 . 1 . 1 145 145 ARG CG C 13 27.262 0.3 . 1 . . . . A 145 ARG CG . 30458 1 1882 . 1 . 1 145 145 ARG CD C 13 44.012 0.3 . 1 . . . . A 145 ARG CD . 30458 1 1883 . 1 . 1 145 145 ARG N N 15 121.496 0.3 . 1 . . . . A 145 ARG N . 30458 1 1884 . 1 . 1 146 146 ARG H H 1 7.673 0.020 . 1 . . . . A 146 ARG H . 30458 1 1885 . 1 . 1 146 146 ARG HA H 1 4.110 0.020 . 1 . . . . A 146 ARG HA . 30458 1 1886 . 1 . 1 146 146 ARG HB2 H 1 1.913 0.020 . 1 . . . . A 146 ARG HB2 . 30458 1 1887 . 1 . 1 146 146 ARG HB3 H 1 1.913 0.020 . 1 . . . . A 146 ARG HB3 . 30458 1 1888 . 1 . 1 146 146 ARG HG2 H 1 1.608 0.020 . 2 . . . . A 146 ARG HG2 . 30458 1 1889 . 1 . 1 146 146 ARG HG3 H 1 1.829 0.020 . 2 . . . . A 146 ARG HG3 . 30458 1 1890 . 1 . 1 146 146 ARG HD2 H 1 3.217 0.020 . 1 . . . . A 146 ARG HD2 . 30458 1 1891 . 1 . 1 146 146 ARG HD3 H 1 3.217 0.020 . 1 . . . . A 146 ARG HD3 . 30458 1 1892 . 1 . 1 146 146 ARG C C 13 178.400 0.3 . 1 . . . . A 146 ARG C . 30458 1 1893 . 1 . 1 146 146 ARG CA C 13 59.405 0.3 . 1 . . . . A 146 ARG CA . 30458 1 1894 . 1 . 1 146 146 ARG CB C 13 30.307 0.3 . 1 . . . . A 146 ARG CB . 30458 1 1895 . 1 . 1 146 146 ARG CG C 13 28.675 0.3 . 1 . . . . A 146 ARG CG . 30458 1 1896 . 1 . 1 146 146 ARG CD C 13 43.654 0.3 . 1 . . . . A 146 ARG CD . 30458 1 1897 . 1 . 1 146 146 ARG N N 15 119.361 0.3 . 1 . . . . A 146 ARG N . 30458 1 1898 . 1 . 1 147 147 ALA H H 1 7.849 0.020 . 1 . . . . A 147 ALA H . 30458 1 1899 . 1 . 1 147 147 ALA HA H 1 4.267 0.020 . 1 . . . . A 147 ALA HA . 30458 1 1900 . 1 . 1 147 147 ALA HB1 H 1 1.621 0.020 . 1 . . . . A 147 ALA HB1 . 30458 1 1901 . 1 . 1 147 147 ALA HB2 H 1 1.621 0.020 . 1 . . . . A 147 ALA HB2 . 30458 1 1902 . 1 . 1 147 147 ALA HB3 H 1 1.621 0.020 . 1 . . . . A 147 ALA HB3 . 30458 1 1903 . 1 . 1 147 147 ALA C C 13 179.620 0.3 . 1 . . . . A 147 ALA C . 30458 1 1904 . 1 . 1 147 147 ALA CA C 13 54.333 0.3 . 1 . . . . A 147 ALA CA . 30458 1 1905 . 1 . 1 147 147 ALA CB C 13 19.073 0.3 . 1 . . . . A 147 ALA CB . 30458 1 1906 . 1 . 1 147 147 ALA N N 15 120.151 0.3 . 1 . . . . A 147 ALA N . 30458 1 1907 . 1 . 1 148 148 PHE H H 1 8.223 0.020 . 1 . . . . A 148 PHE H . 30458 1 1908 . 1 . 1 148 148 PHE HA H 1 4.318 0.020 . 1 . . . . A 148 PHE HA . 30458 1 1909 . 1 . 1 148 148 PHE HB2 H 1 3.064 0.020 . 2 . . . . A 148 PHE HB2 . 30458 1 1910 . 1 . 1 148 148 PHE HB3 H 1 3.297 0.020 . 2 . . . . A 148 PHE HB3 . 30458 1 1911 . 1 . 1 148 148 PHE HD1 H 1 7.220 0.020 . 1 . . . . A 148 PHE HD1 . 30458 1 1912 . 1 . 1 148 148 PHE HD2 H 1 7.220 0.020 . 1 . . . . A 148 PHE HD2 . 30458 1 1913 . 1 . 1 148 148 PHE HE1 H 1 7.038 0.020 . 1 . . . . A 148 PHE HE1 . 30458 1 1914 . 1 . 1 148 148 PHE HE2 H 1 7.038 0.020 . 1 . . . . A 148 PHE HE2 . 30458 1 1915 . 1 . 1 148 148 PHE HZ H 1 7.139 0.020 . 1 . . . . A 148 PHE HZ . 30458 1 1916 . 1 . 1 148 148 PHE C C 13 176.900 0.3 . 1 . . . . A 148 PHE C . 30458 1 1917 . 1 . 1 148 148 PHE CA C 13 60.782 0.3 . 1 . . . . A 148 PHE CA . 30458 1 1918 . 1 . 1 148 148 PHE CB C 13 39.849 0.3 . 1 . . . . A 148 PHE CB . 30458 1 1919 . 1 . 1 148 148 PHE CD1 C 13 132.144 0.3 . 1 . . . . A 148 PHE CD1 . 30458 1 1920 . 1 . 1 148 148 PHE CE1 C 13 131.013 0.3 . 1 . . . . A 148 PHE CE1 . 30458 1 1921 . 1 . 1 148 148 PHE CZ C 13 129.509 0.3 . 1 . . . . A 148 PHE CZ . 30458 1 1922 . 1 . 1 148 148 PHE N N 15 119.894 0.3 . 1 . . . . A 148 PHE N . 30458 1 1923 . 1 . 1 149 149 GLN H H 1 7.963 0.020 . 1 . . . . A 149 GLN H . 30458 1 1924 . 1 . 1 149 149 GLN HA H 1 4.082 0.020 . 1 . . . . A 149 GLN HA . 30458 1 1925 . 1 . 1 149 149 GLN HB2 H 1 2.105 0.020 . 1 . . . . A 149 GLN HB2 . 30458 1 1926 . 1 . 1 149 149 GLN HB3 H 1 2.105 0.020 . 1 . . . . A 149 GLN HB3 . 30458 1 1927 . 1 . 1 149 149 GLN HG2 H 1 2.437 0.020 . 2 . . . . A 149 GLN HG2 . 30458 1 1928 . 1 . 1 149 149 GLN HG3 H 1 2.517 0.020 . 2 . . . . A 149 GLN HG3 . 30458 1 1929 . 1 . 1 149 149 GLN HE21 H 1 7.512 0.020 . 1 . . . . A 149 GLN HE21 . 30458 1 1930 . 1 . 1 149 149 GLN HE22 H 1 6.785 0.020 . 1 . . . . A 149 GLN HE22 . 30458 1 1931 . 1 . 1 149 149 GLN C C 13 176.579 0.3 . 1 . . . . A 149 GLN C . 30458 1 1932 . 1 . 1 149 149 GLN CA C 13 57.007 0.3 . 1 . . . . A 149 GLN CA . 30458 1 1933 . 1 . 1 149 149 GLN CB C 13 28.945 0.3 . 1 . . . . A 149 GLN CB . 30458 1 1934 . 1 . 1 149 149 GLN CG C 13 34.100 0.3 . 1 . . . . A 149 GLN CG . 30458 1 1935 . 1 . 1 149 149 GLN N N 15 118.416 0.3 . 1 . . . . A 149 GLN N . 30458 1 1936 . 1 . 1 149 149 GLN NE2 N 15 111.501 0.3 . 1 . . . . A 149 GLN NE2 . 30458 1 1937 . 1 . 1 150 150 MET H H 1 7.707 0.020 . 1 . . . . A 150 MET H . 30458 1 1938 . 1 . 1 150 150 MET HA H 1 4.308 0.020 . 1 . . . . A 150 MET HA . 30458 1 1939 . 1 . 1 150 150 MET HB2 H 1 2.056 0.020 . 2 . . . . A 150 MET HB2 . 30458 1 1940 . 1 . 1 150 150 MET HB3 H 1 2.153 0.020 . 2 . . . . A 150 MET HB3 . 30458 1 1941 . 1 . 1 150 150 MET HG2 H 1 2.504 0.020 . 2 . . . . A 150 MET HG2 . 30458 1 1942 . 1 . 1 150 150 MET HG3 H 1 2.656 0.020 . 2 . . . . A 150 MET HG3 . 30458 1 1943 . 1 . 1 150 150 MET HE1 H 1 2.010 0.020 . 1 . . . . A 150 MET HE1 . 30458 1 1944 . 1 . 1 150 150 MET HE2 H 1 2.010 0.020 . 1 . . . . A 150 MET HE2 . 30458 1 1945 . 1 . 1 150 150 MET HE3 H 1 2.010 0.020 . 1 . . . . A 150 MET HE3 . 30458 1 1946 . 1 . 1 150 150 MET C C 13 176.413 0.3 . 1 . . . . A 150 MET C . 30458 1 1947 . 1 . 1 150 150 MET CA C 13 56.207 0.3 . 1 . . . . A 150 MET CA . 30458 1 1948 . 1 . 1 150 150 MET CB C 13 32.792 0.3 . 1 . . . . A 150 MET CB . 30458 1 1949 . 1 . 1 150 150 MET CG C 13 32.396 0.3 . 1 . . . . A 150 MET CG . 30458 1 1950 . 1 . 1 150 150 MET CE C 13 17.743 0.3 . 1 . . . . A 150 MET CE . 30458 1 1951 . 1 . 1 150 150 MET N N 15 117.791 0.3 . 1 . . . . A 150 MET N . 30458 1 1952 . 1 . 1 151 151 LEU H H 1 7.642 0.020 . 1 . . . . A 151 LEU H . 30458 1 1953 . 1 . 1 151 151 LEU HA H 1 4.225 0.020 . 1 . . . . A 151 LEU HA . 30458 1 1954 . 1 . 1 151 151 LEU HB2 H 1 1.561 0.020 . 2 . . . . A 151 LEU HB2 . 30458 1 1955 . 1 . 1 151 151 LEU HB3 H 1 1.466 0.020 . 2 . . . . A 151 LEU HB3 . 30458 1 1956 . 1 . 1 151 151 LEU HG H 1 1.650 0.020 . 1 . . . . A 151 LEU HG . 30458 1 1957 . 1 . 1 151 151 LEU HD11 H 1 0.848 0.020 . 1 . . . . A 151 LEU HD11 . 30458 1 1958 . 1 . 1 151 151 LEU HD12 H 1 0.848 0.020 . 1 . . . . A 151 LEU HD12 . 30458 1 1959 . 1 . 1 151 151 LEU HD13 H 1 0.848 0.020 . 1 . . . . A 151 LEU HD13 . 30458 1 1960 . 1 . 1 151 151 LEU HD21 H 1 0.825 0.020 . 1 . . . . A 151 LEU HD21 . 30458 1 1961 . 1 . 1 151 151 LEU HD22 H 1 0.825 0.020 . 1 . . . . A 151 LEU HD22 . 30458 1 1962 . 1 . 1 151 151 LEU HD23 H 1 0.825 0.020 . 1 . . . . A 151 LEU HD23 . 30458 1 1963 . 1 . 1 151 151 LEU C C 13 177.100 0.3 . 1 . . . . A 151 LEU C . 30458 1 1964 . 1 . 1 151 151 LEU CA C 13 55.523 0.3 . 1 . . . . A 151 LEU CA . 30458 1 1965 . 1 . 1 151 151 LEU CB C 13 42.326 0.3 . 1 . . . . A 151 LEU CB . 30458 1 1966 . 1 . 1 151 151 LEU CG C 13 26.748 0.3 . 1 . . . . A 151 LEU CG . 30458 1 1967 . 1 . 1 151 151 LEU CD1 C 13 25.397 0.3 . 1 . . . . A 151 LEU CD1 . 30458 1 1968 . 1 . 1 151 151 LEU CD2 C 13 23.582 0.3 . 1 . . . . A 151 LEU CD2 . 30458 1 1969 . 1 . 1 151 151 LEU N N 15 120.987 0.3 . 1 . . . . A 151 LEU N . 30458 1 1970 . 1 . 1 152 152 ARG H H 1 8.086 0.020 . 1 . . . . A 152 ARG H . 30458 1 1971 . 1 . 1 152 152 ARG HA H 1 4.224 0.020 . 1 . . . . A 152 ARG HA . 30458 1 1972 . 1 . 1 152 152 ARG HB2 H 1 1.745 0.020 . 2 . . . . A 152 ARG HB2 . 30458 1 1973 . 1 . 1 152 152 ARG HB3 H 1 1.884 0.020 . 2 . . . . A 152 ARG HB3 . 30458 1 1974 . 1 . 1 152 152 ARG HG2 H 1 1.573 0.020 . 1 . . . . A 152 ARG HG2 . 30458 1 1975 . 1 . 1 152 152 ARG HG3 H 1 1.573 0.020 . 1 . . . . A 152 ARG HG3 . 30458 1 1976 . 1 . 1 152 152 ARG HD2 H 1 3.116 0.020 . 1 . . . . A 152 ARG HD2 . 30458 1 1977 . 1 . 1 152 152 ARG HD3 H 1 3.116 0.020 . 1 . . . . A 152 ARG HD3 . 30458 1 1978 . 1 . 1 152 152 ARG C C 13 176.340 0.3 . 1 . . . . A 152 ARG C . 30458 1 1979 . 1 . 1 152 152 ARG CA C 13 56.273 0.3 . 1 . . . . A 152 ARG CA . 30458 1 1980 . 1 . 1 152 152 ARG CB C 13 31.267 0.3 . 1 . . . . A 152 ARG CB . 30458 1 1981 . 1 . 1 152 152 ARG CG C 13 27.341 0.3 . 1 . . . . A 152 ARG CG . 30458 1 1982 . 1 . 1 152 152 ARG CD C 13 43.575 0.3 . 1 . . . . A 152 ARG CD . 30458 1 1983 . 1 . 1 152 152 ARG N N 15 121.736 0.3 . 1 . . . . A 152 ARG N . 30458 1 1984 . 1 . 1 153 153 ARG H H 1 8.449 0.020 . 1 . . . . A 153 ARG H . 30458 1 1985 . 1 . 1 153 153 ARG HA H 1 4.083 0.020 . 1 . . . . A 153 ARG HA . 30458 1 1986 . 1 . 1 153 153 ARG HB2 H 1 1.682 0.020 . 2 . . . . A 153 ARG HB2 . 30458 1 1987 . 1 . 1 153 153 ARG HB3 H 1 1.748 0.020 . 2 . . . . A 153 ARG HB3 . 30458 1 1988 . 1 . 1 153 153 ARG HG2 H 1 1.602 0.020 . 1 . . . . A 153 ARG HG2 . 30458 1 1989 . 1 . 1 153 153 ARG HG3 H 1 1.602 0.020 . 1 . . . . A 153 ARG HG3 . 30458 1 1990 . 1 . 1 153 153 ARG HD2 H 1 3.126 0.020 . 1 . . . . A 153 ARG HD2 . 30458 1 1991 . 1 . 1 153 153 ARG HD3 H 1 3.126 0.020 . 1 . . . . A 153 ARG HD3 . 30458 1 1992 . 1 . 1 153 153 ARG C C 13 176.155 0.3 . 1 . . . . A 153 ARG C . 30458 1 1993 . 1 . 1 153 153 ARG CA C 13 56.045 0.3 . 1 . . . . A 153 ARG CA . 30458 1 1994 . 1 . 1 153 153 ARG CB C 13 30.968 0.3 . 1 . . . . A 153 ARG CB . 30458 1 1995 . 1 . 1 153 153 ARG CG C 13 26.929 0.3 . 1 . . . . A 153 ARG CG . 30458 1 1996 . 1 . 1 153 153 ARG CD C 13 43.258 0.3 . 1 . . . . A 153 ARG CD . 30458 1 1997 . 1 . 1 153 153 ARG N N 15 122.473 0.3 . 1 . . . . A 153 ARG N . 30458 1 1998 . 1 . 1 154 154 ASP H H 1 8.324 0.020 . 1 . . . . A 154 ASP H . 30458 1 1999 . 1 . 1 154 154 ASP HA H 1 4.483 0.020 . 1 . . . . A 154 ASP HA . 30458 1 2000 . 1 . 1 154 154 ASP HB2 H 1 2.578 0.020 . 2 . . . . A 154 ASP HB2 . 30458 1 2001 . 1 . 1 154 154 ASP HB3 H 1 2.640 0.020 . 2 . . . . A 154 ASP HB3 . 30458 1 2002 . 1 . 1 154 154 ASP C C 13 175.934 0.3 . 1 . . . . A 154 ASP C . 30458 1 2003 . 1 . 1 154 154 ASP CA C 13 55.075 0.3 . 1 . . . . A 154 ASP CA . 30458 1 2004 . 1 . 1 154 154 ASP CB C 13 41.221 0.3 . 1 . . . . A 154 ASP CB . 30458 1 2005 . 1 . 1 154 154 ASP N N 15 120.222 0.3 . 1 . . . . A 154 ASP N . 30458 1 2006 . 1 . 1 155 155 ASN H H 1 8.288 0.020 . 1 . . . . A 155 ASN H . 30458 1 2007 . 1 . 1 155 155 ASN HA H 1 4.638 0.020 . 1 . . . . A 155 ASN HA . 30458 1 2008 . 1 . 1 155 155 ASN HB2 H 1 2.726 0.020 . 2 . . . . A 155 ASN HB2 . 30458 1 2009 . 1 . 1 155 155 ASN HB3 H 1 2.780 0.020 . 2 . . . . A 155 ASN HB3 . 30458 1 2010 . 1 . 1 155 155 ASN HD21 H 1 7.565 0.020 . 1 . . . . A 155 ASN HD21 . 30458 1 2011 . 1 . 1 155 155 ASN HD22 H 1 6.828 0.020 . 1 . . . . A 155 ASN HD22 . 30458 1 2012 . 1 . 1 155 155 ASN C C 13 174.114 0.3 . 1 . . . . A 155 ASN C . 30458 1 2013 . 1 . 1 155 155 ASN CA C 13 53.535 0.3 . 1 . . . . A 155 ASN CA . 30458 1 2014 . 1 . 1 155 155 ASN CB C 13 39.109 0.3 . 1 . . . . A 155 ASN CB . 30458 1 2015 . 1 . 1 155 155 ASN N N 15 117.219 0.3 . 1 . . . . A 155 ASN N . 30458 1 2016 . 1 . 1 155 155 ASN ND2 N 15 112.861 0.3 . 1 . . . . A 155 ASN ND2 . 30458 1 2017 . 1 . 1 156 156 GLU H H 1 7.789 0.020 . 1 . . . . A 156 GLU H . 30458 1 2018 . 1 . 1 156 156 GLU HA H 1 4.067 0.020 . 1 . . . . A 156 GLU HA . 30458 1 2019 . 1 . 1 156 156 GLU HB2 H 1 1.854 0.020 . 1 . . . . A 156 GLU HB2 . 30458 1 2020 . 1 . 1 156 156 GLU HB3 H 1 1.854 0.020 . 1 . . . . A 156 GLU HB3 . 30458 1 2021 . 1 . 1 156 156 GLU HG2 H 1 2.169 0.020 . 1 . . . . A 156 GLU HG2 . 30458 1 2022 . 1 . 1 156 156 GLU HG3 H 1 2.169 0.020 . 1 . . . . A 156 GLU HG3 . 30458 1 2023 . 1 . 1 156 156 GLU C C 13 181.062 0.3 . 1 . . . . A 156 GLU C . 30458 1 2024 . 1 . 1 156 156 GLU CA C 13 58.154 0.3 . 1 . . . . A 156 GLU CA . 30458 1 2025 . 1 . 1 156 156 GLU CB C 13 31.143 0.3 . 1 . . . . A 156 GLU CB . 30458 1 2026 . 1 . 1 156 156 GLU N N 15 125.348 0.3 . 1 . . . . A 156 GLU N . 30458 1 stop_ save_