data_50425 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 50425 _Entry.Title ; Influenza A matrix protein 1 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2020-08-05 _Entry.Accession_date 2020-08-05 _Entry.Last_release_date 2020-08-05 _Entry.Original_release_date 2020-08-05 _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 'N-terminal domain residues 1-164 of influenza A matrix protein 1' _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Faiz Mohd-Kipli . . . . 50425 2 Jolyon Claridge . K. . 0000-0003-2244-8642 50425 3 Jason Schnell . R. . 0000-0002-8204-7608 50425 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Oxford University' . 50425 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 50425 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 394 50425 '15N chemical shifts' 142 50425 '1H chemical shifts' 142 50425 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 . . 2021-04-13 2020-08-05 update BMRB 'update entry citation' 50425 1 . . 2021-01-26 2020-08-05 original author 'original release' 50425 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 50425 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 33516724 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Conformational triggers associated with influenza matrix protein 1 polymerization ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biol. Chem.' _Citation.Journal_name_full . _Citation.Journal_volume 296 _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 100316 _Citation.Page_last 100316 _Citation.Year 2021 _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 Faiz Mohd-Kipli . . . . 50425 1 2 Jolyon Claridge . K. . . 50425 1 3 Jelena Habjanic . . . . 50425 1 4 Alex Jiang . . . . 50425 1 5 Jason Schnell . R. . . 50425 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'allosteric regulation, conformational change' 50425 1 'influenza virus, matrix protein 1' 50425 1 'nuclear magnetic resonance (NMR)' 50425 1 'structure-function, sterol, cholesterol, membrane' 50425 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 50425 _Assembly.ID 1 _Assembly.Name 'Influenza A virus matrix 1 protein' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass 20272 _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 'Influenza A virus matrix 2 protein' 1 $entity_1 . . yes native no no . . . 50425 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 50425 _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 . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MSLLTEVETYVLSIIPSGPL KAEIAQRLESVFAGKNTDLE ALMEWLKTRPILSPLTKGIL GFVFTLTVPSERGLQRRRFV QNALNGNGDPNNMDRAVKLY KKLKREITFHGAKEVSLSYS TGALASCMGLIYNRMGTVTT EAAFGLVCATCEQIADSQHR SHRQLEVLFQGPGSHHHHHH HH ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq 1-182 _Entity.Polymer_author_seq_details ; Residues 1-164 of matrix protein 1 derived from influenza strain A/England/250/2009(H1N1). C-terminal tag includes 3C protease cut site, linker, and 8-histidine affinity tag. ; _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 182 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment M1NT _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 yes Uniprot J9UXB0 . 'Matrix protein 1' . . . . . . . . . . . . . . 50425 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'Several roles in the life cycle of Influenza A virus' 50425 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 . 50425 1 2 . SER . 50425 1 3 . LEU . 50425 1 4 . LEU . 50425 1 5 . THR . 50425 1 6 . GLU . 50425 1 7 . VAL . 50425 1 8 . GLU . 50425 1 9 . THR . 50425 1 10 . TYR . 50425 1 11 . VAL . 50425 1 12 . LEU . 50425 1 13 . SER . 50425 1 14 . ILE . 50425 1 15 . ILE . 50425 1 16 . PRO . 50425 1 17 . SER . 50425 1 18 . GLY . 50425 1 19 . PRO . 50425 1 20 . LEU . 50425 1 21 . LYS . 50425 1 22 . ALA . 50425 1 23 . GLU . 50425 1 24 . ILE . 50425 1 25 . ALA . 50425 1 26 . GLN . 50425 1 27 . ARG . 50425 1 28 . LEU . 50425 1 29 . GLU . 50425 1 30 . SER . 50425 1 31 . VAL . 50425 1 32 . PHE . 50425 1 33 . ALA . 50425 1 34 . GLY . 50425 1 35 . LYS . 50425 1 36 . ASN . 50425 1 37 . THR . 50425 1 38 . ASP . 50425 1 39 . LEU . 50425 1 40 . GLU . 50425 1 41 . ALA . 50425 1 42 . LEU . 50425 1 43 . MET . 50425 1 44 . GLU . 50425 1 45 . TRP . 50425 1 46 . LEU . 50425 1 47 . LYS . 50425 1 48 . THR . 50425 1 49 . ARG . 50425 1 50 . PRO . 50425 1 51 . ILE . 50425 1 52 . LEU . 50425 1 53 . SER . 50425 1 54 . PRO . 50425 1 55 . LEU . 50425 1 56 . THR . 50425 1 57 . LYS . 50425 1 58 . GLY . 50425 1 59 . ILE . 50425 1 60 . LEU . 50425 1 61 . GLY . 50425 1 62 . PHE . 50425 1 63 . VAL . 50425 1 64 . PHE . 50425 1 65 . THR . 50425 1 66 . LEU . 50425 1 67 . THR . 50425 1 68 . VAL . 50425 1 69 . PRO . 50425 1 70 . SER . 50425 1 71 . GLU . 50425 1 72 . ARG . 50425 1 73 . GLY . 50425 1 74 . LEU . 50425 1 75 . GLN . 50425 1 76 . ARG . 50425 1 77 . ARG . 50425 1 78 . ARG . 50425 1 79 . PHE . 50425 1 80 . VAL . 50425 1 81 . GLN . 50425 1 82 . ASN . 50425 1 83 . ALA . 50425 1 84 . LEU . 50425 1 85 . ASN . 50425 1 86 . GLY . 50425 1 87 . ASN . 50425 1 88 . GLY . 50425 1 89 . ASP . 50425 1 90 . PRO . 50425 1 91 . ASN . 50425 1 92 . ASN . 50425 1 93 . MET . 50425 1 94 . ASP . 50425 1 95 . ARG . 50425 1 96 . ALA . 50425 1 97 . VAL . 50425 1 98 . LYS . 50425 1 99 . LEU . 50425 1 100 . TYR . 50425 1 101 . LYS . 50425 1 102 . LYS . 50425 1 103 . LEU . 50425 1 104 . LYS . 50425 1 105 . ARG . 50425 1 106 . GLU . 50425 1 107 . ILE . 50425 1 108 . THR . 50425 1 109 . PHE . 50425 1 110 . HIS . 50425 1 111 . GLY . 50425 1 112 . ALA . 50425 1 113 . LYS . 50425 1 114 . GLU . 50425 1 115 . VAL . 50425 1 116 . SER . 50425 1 117 . LEU . 50425 1 118 . SER . 50425 1 119 . TYR . 50425 1 120 . SER . 50425 1 121 . THR . 50425 1 122 . GLY . 50425 1 123 . ALA . 50425 1 124 . LEU . 50425 1 125 . ALA . 50425 1 126 . SER . 50425 1 127 . CYS . 50425 1 128 . MET . 50425 1 129 . GLY . 50425 1 130 . LEU . 50425 1 131 . ILE . 50425 1 132 . TYR . 50425 1 133 . ASN . 50425 1 134 . ARG . 50425 1 135 . MET . 50425 1 136 . GLY . 50425 1 137 . THR . 50425 1 138 . VAL . 50425 1 139 . THR . 50425 1 140 . THR . 50425 1 141 . GLU . 50425 1 142 . ALA . 50425 1 143 . ALA . 50425 1 144 . PHE . 50425 1 145 . GLY . 50425 1 146 . LEU . 50425 1 147 . VAL . 50425 1 148 . CYS . 50425 1 149 . ALA . 50425 1 150 . THR . 50425 1 151 . CYS . 50425 1 152 . GLU . 50425 1 153 . GLN . 50425 1 154 . ILE . 50425 1 155 . ALA . 50425 1 156 . ASP . 50425 1 157 . SER . 50425 1 158 . GLN . 50425 1 159 . HIS . 50425 1 160 . ARG . 50425 1 161 . SER . 50425 1 162 . HIS . 50425 1 163 . ARG . 50425 1 164 . GLN . 50425 1 165 . LEU . 50425 1 166 . GLU . 50425 1 167 . VAL . 50425 1 168 . LEU . 50425 1 169 . PHE . 50425 1 170 . GLN . 50425 1 171 . GLY . 50425 1 172 . PRO . 50425 1 173 . GLY . 50425 1 174 . SER . 50425 1 175 . HIS . 50425 1 176 . HIS . 50425 1 177 . HIS . 50425 1 178 . HIS . 50425 1 179 . HIS . 50425 1 180 . HIS . 50425 1 181 . HIS . 50425 1 182 . HIS . 50425 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 50425 1 . SER 2 2 50425 1 . LEU 3 3 50425 1 . LEU 4 4 50425 1 . THR 5 5 50425 1 . GLU 6 6 50425 1 . VAL 7 7 50425 1 . GLU 8 8 50425 1 . THR 9 9 50425 1 . TYR 10 10 50425 1 . VAL 11 11 50425 1 . LEU 12 12 50425 1 . SER 13 13 50425 1 . ILE 14 14 50425 1 . ILE 15 15 50425 1 . PRO 16 16 50425 1 . SER 17 17 50425 1 . GLY 18 18 50425 1 . PRO 19 19 50425 1 . LEU 20 20 50425 1 . LYS 21 21 50425 1 . ALA 22 22 50425 1 . GLU 23 23 50425 1 . ILE 24 24 50425 1 . ALA 25 25 50425 1 . GLN 26 26 50425 1 . ARG 27 27 50425 1 . LEU 28 28 50425 1 . GLU 29 29 50425 1 . SER 30 30 50425 1 . VAL 31 31 50425 1 . PHE 32 32 50425 1 . ALA 33 33 50425 1 . GLY 34 34 50425 1 . LYS 35 35 50425 1 . ASN 36 36 50425 1 . THR 37 37 50425 1 . ASP 38 38 50425 1 . LEU 39 39 50425 1 . GLU 40 40 50425 1 . ALA 41 41 50425 1 . LEU 42 42 50425 1 . MET 43 43 50425 1 . GLU 44 44 50425 1 . TRP 45 45 50425 1 . LEU 46 46 50425 1 . LYS 47 47 50425 1 . THR 48 48 50425 1 . ARG 49 49 50425 1 . PRO 50 50 50425 1 . ILE 51 51 50425 1 . LEU 52 52 50425 1 . SER 53 53 50425 1 . PRO 54 54 50425 1 . LEU 55 55 50425 1 . THR 56 56 50425 1 . LYS 57 57 50425 1 . GLY 58 58 50425 1 . ILE 59 59 50425 1 . LEU 60 60 50425 1 . GLY 61 61 50425 1 . PHE 62 62 50425 1 . VAL 63 63 50425 1 . PHE 64 64 50425 1 . THR 65 65 50425 1 . LEU 66 66 50425 1 . THR 67 67 50425 1 . VAL 68 68 50425 1 . PRO 69 69 50425 1 . SER 70 70 50425 1 . GLU 71 71 50425 1 . ARG 72 72 50425 1 . GLY 73 73 50425 1 . LEU 74 74 50425 1 . GLN 75 75 50425 1 . ARG 76 76 50425 1 . ARG 77 77 50425 1 . ARG 78 78 50425 1 . PHE 79 79 50425 1 . VAL 80 80 50425 1 . GLN 81 81 50425 1 . ASN 82 82 50425 1 . ALA 83 83 50425 1 . LEU 84 84 50425 1 . ASN 85 85 50425 1 . GLY 86 86 50425 1 . ASN 87 87 50425 1 . GLY 88 88 50425 1 . ASP 89 89 50425 1 . PRO 90 90 50425 1 . ASN 91 91 50425 1 . ASN 92 92 50425 1 . MET 93 93 50425 1 . ASP 94 94 50425 1 . ARG 95 95 50425 1 . ALA 96 96 50425 1 . VAL 97 97 50425 1 . LYS 98 98 50425 1 . LEU 99 99 50425 1 . TYR 100 100 50425 1 . LYS 101 101 50425 1 . LYS 102 102 50425 1 . LEU 103 103 50425 1 . LYS 104 104 50425 1 . ARG 105 105 50425 1 . GLU 106 106 50425 1 . ILE 107 107 50425 1 . THR 108 108 50425 1 . PHE 109 109 50425 1 . HIS 110 110 50425 1 . GLY 111 111 50425 1 . ALA 112 112 50425 1 . LYS 113 113 50425 1 . GLU 114 114 50425 1 . VAL 115 115 50425 1 . SER 116 116 50425 1 . LEU 117 117 50425 1 . SER 118 118 50425 1 . TYR 119 119 50425 1 . SER 120 120 50425 1 . THR 121 121 50425 1 . GLY 122 122 50425 1 . ALA 123 123 50425 1 . LEU 124 124 50425 1 . ALA 125 125 50425 1 . SER 126 126 50425 1 . CYS 127 127 50425 1 . MET 128 128 50425 1 . GLY 129 129 50425 1 . LEU 130 130 50425 1 . ILE 131 131 50425 1 . TYR 132 132 50425 1 . ASN 133 133 50425 1 . ARG 134 134 50425 1 . MET 135 135 50425 1 . GLY 136 136 50425 1 . THR 137 137 50425 1 . VAL 138 138 50425 1 . THR 139 139 50425 1 . THR 140 140 50425 1 . GLU 141 141 50425 1 . ALA 142 142 50425 1 . ALA 143 143 50425 1 . PHE 144 144 50425 1 . GLY 145 145 50425 1 . LEU 146 146 50425 1 . VAL 147 147 50425 1 . CYS 148 148 50425 1 . ALA 149 149 50425 1 . THR 150 150 50425 1 . CYS 151 151 50425 1 . GLU 152 152 50425 1 . GLN 153 153 50425 1 . ILE 154 154 50425 1 . ALA 155 155 50425 1 . ASP 156 156 50425 1 . SER 157 157 50425 1 . GLN 158 158 50425 1 . HIS 159 159 50425 1 . ARG 160 160 50425 1 . SER 161 161 50425 1 . HIS 162 162 50425 1 . ARG 163 163 50425 1 . GLN 164 164 50425 1 . LEU 165 165 50425 1 . GLU 166 166 50425 1 . VAL 167 167 50425 1 . LEU 168 168 50425 1 . PHE 169 169 50425 1 . GLN 170 170 50425 1 . GLY 171 171 50425 1 . PRO 172 172 50425 1 . GLY 173 173 50425 1 . SER 174 174 50425 1 . HIS 175 175 50425 1 . HIS 176 176 50425 1 . HIS 177 177 50425 1 . HIS 178 178 50425 1 . HIS 179 179 50425 1 . HIS 180 180 50425 1 . HIS 181 181 50425 1 . HIS 182 182 50425 1 stop_ save_ #################### # Natural source # #################### save_natural_source_1 _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source_1 _Entity_natural_src_list.Entry_ID 50425 _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 . 11320 organism . 'Influenza A' 'Influenza A virus' . . Viruses . Alphainfluenzavirus 'Influenza A' A/England/250/2009(H1N1) . . . . . . . . . . 'matrix protein 1' . 50425 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source_1 _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source_1 _Entity_experimental_src_list.Entry_ID 50425 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21(DE3) . . plasmid . . 'pCOLD II' . . . 50425 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 50425 _Sample.ID 1 _Sample.Name M1NT _Sample.Type solution _Sample.Sub_type . _Sample.Details 'M1NT in 20 mM Tris, 50 mM NaCl, 1 mM EDTA, 2 mM beta-mercaptoethanol, and pH 5.5' _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '95% H2O/5% 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 'Influenza A virus matrix protein 1' '[U-99% 13C; U-99% 15N]' . . 1 $entity_1 . . 0.175 0.15 0.2 mM . . . . 50425 1 2 TRIS 'natural abundance' . . . . . . 20 . . mM . . . . 50425 1 3 NaCl 'natural abundance' . . . . . . 50 . . mM . . . . 50425 1 4 EDTA 'natural abundance' . . . . . . 1 . . mM . . . . 50425 1 5 beta-mercaptoethanol 'natural abundance' . . . . . . 2 . . mM . . . . 50425 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 50425 _Sample_condition_list.ID 1 _Sample_condition_list.Name 'pH 5.5' _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' 0.120 . M 50425 1 pH 5.5 . pH 50425 1 pressure 1 . atm 50425 1 temperature 303 . K 50425 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 50425 _Software.ID 1 _Software.Type . _Software.Name NMRPipe _Software.Version 8.7 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 50425 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 50425 _Software.ID 2 _Software.Type . _Software.Name CARA _Software.Version 1.9.1.7 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 50425 2 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 50425 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name 750 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'Avance III HD' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 750 save_ ############################# # NMR applied experiments # ############################# save_experiment_list_1 _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list_1 _Experiment_list.Entry_ID 50425 _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 '3D HNCA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50425 1 2 '3D HNCACB' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50425 1 3 '3D HNCO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50425 1 4 '3D HNCOCA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50425 1 5 '3D HNCOCACB' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50425 1 6 '3D HNCACO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50425 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 50425 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name DSS _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 internal indirect 0.251449530 . . . . . 50425 1 H 1 DSS 'methyl protons' . . . . ppm 0 internal direct 1 . . . . . 50425 1 N 15 DSS 'methyl protons' . . . . ppm 0 internal indirect 0.101329118 . . . . . 50425 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 50425 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 'M1NT pH 5.5' _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 '3D HNCA' . . . 50425 1 2 '3D HNCACB' . . . 50425 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 2 $software_2 . . 50425 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 3 3 LEU C C 13 177.552 . . 1 . . . . . 3 LEU C . 50425 1 2 . 1 . 1 3 3 LEU CA C 13 57.439 . . 1 . . . . . 3 LEU CA . 50425 1 3 . 1 . 1 3 3 LEU CB C 13 42.167 . . 1 . . . . . 3 LEU CB . 50425 1 4 . 1 . 1 4 4 LEU H H 1 7.865 . . 1 . . . . . 4 LEU H . 50425 1 5 . 1 . 1 4 4 LEU C C 13 178.271 . . 1 . . . . . 4 LEU C . 50425 1 6 . 1 . 1 4 4 LEU CA C 13 58.051 . . 1 . . . . . 4 LEU CA . 50425 1 7 . 1 . 1 4 4 LEU CB C 13 39.928 . . 1 . . . . . 4 LEU CB . 50425 1 8 . 1 . 1 4 4 LEU N N 15 118.120 . . 1 . . . . . 4 LEU N . 50425 1 9 . 1 . 1 5 5 THR H H 1 7.828 . . 1 . . . . . 5 THR H . 50425 1 10 . 1 . 1 5 5 THR C C 13 176.796 . . 1 . . . . . 5 THR C . 50425 1 11 . 1 . 1 5 5 THR CA C 13 66.828 . . 1 . . . . . 5 THR CA . 50425 1 12 . 1 . 1 5 5 THR CB C 13 68.788 . . 1 . . . . . 5 THR CB . 50425 1 13 . 1 . 1 5 5 THR N N 15 113.919 . . 1 . . . . . 5 THR N . 50425 1 14 . 1 . 1 6 6 GLU H H 1 7.618 . . 1 . . . . . 6 GLU H . 50425 1 15 . 1 . 1 6 6 GLU C C 13 178.559 . . 1 . . . . . 6 GLU C . 50425 1 16 . 1 . 1 6 6 GLU CA C 13 60.123 . . 1 . . . . . 6 GLU CA . 50425 1 17 . 1 . 1 6 6 GLU CB C 13 29.331 . . 1 . . . . . 6 GLU CB . 50425 1 18 . 1 . 1 6 6 GLU N N 15 123.517 . . 1 . . . . . 6 GLU N . 50425 1 19 . 1 . 1 7 7 VAL H H 1 8.251 . . 1 . . . . . 7 VAL H . 50425 1 20 . 1 . 1 7 7 VAL C C 13 177.809 . . 1 . . . . . 7 VAL C . 50425 1 21 . 1 . 1 7 7 VAL CA C 13 67.051 . . 1 . . . . . 7 VAL CA . 50425 1 22 . 1 . 1 7 7 VAL CB C 13 31.095 . . 1 . . . . . 7 VAL CB . 50425 1 23 . 1 . 1 7 7 VAL N N 15 118.905 . . 1 . . . . . 7 VAL N . 50425 1 24 . 1 . 1 8 8 GLU H H 1 8.789 . . 1 . . . . . 8 GLU H . 50425 1 25 . 1 . 1 8 8 GLU C C 13 176.948 . . 1 . . . . . 8 GLU C . 50425 1 26 . 1 . 1 8 8 GLU CA C 13 60.688 . . 1 . . . . . 8 GLU CA . 50425 1 27 . 1 . 1 8 8 GLU CB C 13 32.185 . . 1 . . . . . 8 GLU CB . 50425 1 28 . 1 . 1 8 8 GLU N N 15 118.904 . . 1 . . . . . 8 GLU N . 50425 1 29 . 1 . 1 9 9 THR H H 1 7.904 . . 1 . . . . . 9 THR H . 50425 1 30 . 1 . 1 9 9 THR C C 13 177.470 . . 1 . . . . . 9 THR C . 50425 1 31 . 1 . 1 9 9 THR CA C 13 67.003 . . 1 . . . . . 9 THR CA . 50425 1 32 . 1 . 1 9 9 THR CB C 13 68.978 . . 1 . . . . . 9 THR CB . 50425 1 33 . 1 . 1 9 9 THR N N 15 113.774 . . 1 . . . . . 9 THR N . 50425 1 34 . 1 . 1 10 10 TYR H H 1 8.087 . . 1 . . . . . 10 TYR H . 50425 1 35 . 1 . 1 10 10 TYR C C 13 179.520 . . 1 . . . . . 10 TYR C . 50425 1 36 . 1 . 1 10 10 TYR CA C 13 63.528 . . 1 . . . . . 10 TYR CA . 50425 1 37 . 1 . 1 10 10 TYR N N 15 120.277 . . 1 . . . . . 10 TYR N . 50425 1 38 . 1 . 1 11 11 VAL H H 1 8.968 . . 1 . . . . . 11 VAL H . 50425 1 39 . 1 . 1 11 11 VAL C C 13 177.074 . . 1 . . . . . 11 VAL C . 50425 1 40 . 1 . 1 11 11 VAL CA C 13 66.385 . . 1 . . . . . 11 VAL CA . 50425 1 41 . 1 . 1 11 11 VAL CB C 13 31.675 . . 1 . . . . . 11 VAL CB . 50425 1 42 . 1 . 1 11 11 VAL N N 15 120.946 . . 1 . . . . . 11 VAL N . 50425 1 43 . 1 . 1 12 12 LEU H H 1 8.437 . . 1 . . . . . 12 LEU H . 50425 1 44 . 1 . 1 12 12 LEU C C 13 179.718 . . 1 . . . . . 12 LEU C . 50425 1 45 . 1 . 1 12 12 LEU CA C 13 57.565 . . 1 . . . . . 12 LEU CA . 50425 1 46 . 1 . 1 12 12 LEU CB C 13 41.075 . . 1 . . . . . 12 LEU CB . 50425 1 47 . 1 . 1 12 12 LEU N N 15 114.860 . . 1 . . . . . 12 LEU N . 50425 1 48 . 1 . 1 13 13 SER H H 1 7.493 . . 1 . . . . . 13 SER H . 50425 1 49 . 1 . 1 13 13 SER C C 13 175.563 . . 1 . . . . . 13 SER C . 50425 1 50 . 1 . 1 13 13 SER CA C 13 61.758 . . 1 . . . . . 13 SER CA . 50425 1 51 . 1 . 1 13 13 SER CB C 13 63.292 . . 1 . . . . . 13 SER CB . 50425 1 52 . 1 . 1 13 13 SER N N 15 113.103 . . 1 . . . . . 13 SER N . 50425 1 53 . 1 . 1 14 14 ILE H H 1 7.086 . . 1 . . . . . 14 ILE H . 50425 1 54 . 1 . 1 14 14 ILE C C 13 175.078 . . 1 . . . . . 14 ILE C . 50425 1 55 . 1 . 1 14 14 ILE CA C 13 61.356 . . 1 . . . . . 14 ILE CA . 50425 1 56 . 1 . 1 14 14 ILE CB C 13 38.321 . . 1 . . . . . 14 ILE CB . 50425 1 57 . 1 . 1 14 14 ILE N N 15 112.431 . . 1 . . . . . 14 ILE N . 50425 1 58 . 1 . 1 15 15 ILE H H 1 7.580 . . 1 . . . . . 15 ILE H . 50425 1 59 . 1 . 1 15 15 ILE C C 13 173.837 . . 1 . . . . . 15 ILE C . 50425 1 60 . 1 . 1 15 15 ILE CA C 13 56.787 . . 1 . . . . . 15 ILE CA . 50425 1 61 . 1 . 1 15 15 ILE CB C 13 38.593 . . 1 . . . . . 15 ILE CB . 50425 1 62 . 1 . 1 15 15 ILE N N 15 125.050 . . 1 . . . . . 15 ILE N . 50425 1 63 . 1 . 1 17 17 SER H H 1 8.241 . . 1 . . . . . 17 SER H . 50425 1 64 . 1 . 1 17 17 SER C C 13 173.873 . . 1 . . . . . 17 SER C . 50425 1 65 . 1 . 1 17 17 SER CA C 13 59.891 . . 1 . . . . . 17 SER CA . 50425 1 66 . 1 . 1 17 17 SER CB C 13 63.716 . . 1 . . . . . 17 SER CB . 50425 1 67 . 1 . 1 17 17 SER N N 15 115.425 . . 1 . . . . . 17 SER N . 50425 1 68 . 1 . 1 18 18 GLY H H 1 8.278 . . 1 . . . . . 18 GLY H . 50425 1 69 . 1 . 1 18 18 GLY C C 13 172.992 . . 1 . . . . . 18 GLY C . 50425 1 70 . 1 . 1 18 18 GLY CA C 13 45.091 . . 1 . . . . . 18 GLY CA . 50425 1 71 . 1 . 1 18 18 GLY N N 15 112.614 . . 1 . . . . . 18 GLY N . 50425 1 72 . 1 . 1 20 20 LEU H H 1 8.236 . . 1 . . . . . 20 LEU H . 50425 1 73 . 1 . 1 20 20 LEU C C 13 178.631 . . 1 . . . . . 20 LEU C . 50425 1 74 . 1 . 1 20 20 LEU CA C 13 57.664 . . 1 . . . . . 20 LEU CA . 50425 1 75 . 1 . 1 20 20 LEU CB C 13 41.074 . . 1 . . . . . 20 LEU CB . 50425 1 76 . 1 . 1 20 20 LEU N N 15 118.637 . . 1 . . . . . 20 LEU N . 50425 1 77 . 1 . 1 21 21 LYS H H 1 7.777 . . 1 . . . . . 21 LYS H . 50425 1 78 . 1 . 1 21 21 LYS C C 13 177.880 . . 1 . . . . . 21 LYS C . 50425 1 79 . 1 . 1 21 21 LYS CA C 13 61.333 . . 1 . . . . . 21 LYS CA . 50425 1 80 . 1 . 1 21 21 LYS CB C 13 32.218 . . 1 . . . . . 21 LYS CB . 50425 1 81 . 1 . 1 21 21 LYS N N 15 120.488 . . 1 . . . . . 21 LYS N . 50425 1 82 . 1 . 1 22 22 ALA H H 1 7.442 . . 1 . . . . . 22 ALA H . 50425 1 83 . 1 . 1 22 22 ALA C C 13 180.694 . . 1 . . . . . 22 ALA C . 50425 1 84 . 1 . 1 22 22 ALA CA C 13 55.089 . . 1 . . . . . 22 ALA CA . 50425 1 85 . 1 . 1 22 22 ALA CB C 13 18.318 . . 1 . . . . . 22 ALA CB . 50425 1 86 . 1 . 1 22 22 ALA N N 15 119.163 . . 1 . . . . . 22 ALA N . 50425 1 87 . 1 . 1 23 23 GLU H H 1 7.831 . . 1 . . . . . 23 GLU H . 50425 1 88 . 1 . 1 23 23 GLU C C 13 179.853 . . 1 . . . . . 23 GLU C . 50425 1 89 . 1 . 1 23 23 GLU CA C 13 59.773 . . 1 . . . . . 23 GLU CA . 50425 1 90 . 1 . 1 23 23 GLU CB C 13 30.314 . . 1 . . . . . 23 GLU CB . 50425 1 91 . 1 . 1 23 23 GLU N N 15 118.846 . . 1 . . . . . 23 GLU N . 50425 1 92 . 1 . 1 24 24 ILE H H 1 8.745 . . 1 . . . . . 24 ILE H . 50425 1 93 . 1 . 1 24 24 ILE C C 13 177.350 . . 1 . . . . . 24 ILE C . 50425 1 94 . 1 . 1 24 24 ILE CA C 13 65.648 . . 1 . . . . . 24 ILE CA . 50425 1 95 . 1 . 1 24 24 ILE CB C 13 37.202 . . 1 . . . . . 24 ILE CB . 50425 1 96 . 1 . 1 24 24 ILE N N 15 120.385 . . 1 . . . . . 24 ILE N . 50425 1 97 . 1 . 1 25 25 ALA H H 1 8.582 . . 1 . . . . . 25 ALA H . 50425 1 98 . 1 . 1 25 25 ALA C C 13 178.829 . . 1 . . . . . 25 ALA C . 50425 1 99 . 1 . 1 25 25 ALA CA C 13 56.337 . . 1 . . . . . 25 ALA CA . 50425 1 100 . 1 . 1 25 25 ALA CB C 13 18.493 . . 1 . . . . . 25 ALA CB . 50425 1 101 . 1 . 1 25 25 ALA N N 15 122.794 . . 1 . . . . . 25 ALA N . 50425 1 102 . 1 . 1 26 26 GLN H H 1 7.783 . . 1 . . . . . 26 GLN H . 50425 1 103 . 1 . 1 26 26 GLN C C 13 179.494 . . 1 . . . . . 26 GLN C . 50425 1 104 . 1 . 1 26 26 GLN CA C 13 59.305 . . 1 . . . . . 26 GLN CA . 50425 1 105 . 1 . 1 26 26 GLN CB C 13 28.666 . . 1 . . . . . 26 GLN CB . 50425 1 106 . 1 . 1 26 26 GLN N N 15 115.201 . . 1 . . . . . 26 GLN N . 50425 1 107 . 1 . 1 27 27 ARG H H 1 7.809 . . 1 . . . . . 27 ARG H . 50425 1 108 . 1 . 1 27 27 ARG C C 13 178.889 . . 1 . . . . . 27 ARG C . 50425 1 109 . 1 . 1 27 27 ARG CA C 13 59.100 . . 1 . . . . . 27 ARG CA . 50425 1 110 . 1 . 1 27 27 ARG CB C 13 29.807 . . 1 . . . . . 27 ARG CB . 50425 1 111 . 1 . 1 27 27 ARG N N 15 119.381 . . 1 . . . . . 27 ARG N . 50425 1 112 . 1 . 1 28 28 LEU H H 1 8.853 . . 1 . . . . . 28 LEU H . 50425 1 113 . 1 . 1 28 28 LEU C C 13 177.480 . . 1 . . . . . 28 LEU C . 50425 1 114 . 1 . 1 28 28 LEU CA C 13 58.437 . . 1 . . . . . 28 LEU CA . 50425 1 115 . 1 . 1 28 28 LEU CB C 13 42.262 . . 1 . . . . . 28 LEU CB . 50425 1 116 . 1 . 1 28 28 LEU N N 15 120.118 . . 1 . . . . . 28 LEU N . 50425 1 117 . 1 . 1 29 29 GLU H H 1 8.343 . . 1 . . . . . 29 GLU H . 50425 1 118 . 1 . 1 29 29 GLU C C 13 179.494 . . 1 . . . . . 29 GLU C . 50425 1 119 . 1 . 1 29 29 GLU CA C 13 60.131 . . 1 . . . . . 29 GLU CA . 50425 1 120 . 1 . 1 29 29 GLU CB C 13 28.666 . . 1 . . . . . 29 GLU CB . 50425 1 121 . 1 . 1 29 29 GLU N N 15 116.461 . . 1 . . . . . 29 GLU N . 50425 1 122 . 1 . 1 30 30 SER H H 1 7.874 . . 1 . . . . . 30 SER H . 50425 1 123 . 1 . 1 30 30 SER C C 13 176.617 . . 1 . . . . . 30 SER C . 50425 1 124 . 1 . 1 30 30 SER CA C 13 62.132 . . 1 . . . . . 30 SER CA . 50425 1 125 . 1 . 1 30 30 SER CB C 13 62.988 . . 1 . . . . . 30 SER CB . 50425 1 126 . 1 . 1 30 30 SER N N 15 114.788 . . 1 . . . . . 30 SER N . 50425 1 127 . 1 . 1 31 31 VAL H H 1 7.920 . . 1 . . . . . 31 VAL H . 50425 1 128 . 1 . 1 31 31 VAL C C 13 180.807 . . 1 . . . . . 31 VAL C . 50425 1 129 . 1 . 1 31 31 VAL CA C 13 66.091 . . 1 . . . . . 31 VAL CA . 50425 1 130 . 1 . 1 31 31 VAL CB C 13 31.865 . . 1 . . . . . 31 VAL CB . 50425 1 131 . 1 . 1 31 31 VAL N N 15 121.527 . . 1 . . . . . 31 VAL N . 50425 1 132 . 1 . 1 32 32 PHE H H 1 8.864 . . 1 . . . . . 32 PHE H . 50425 1 133 . 1 . 1 32 32 PHE C C 13 176.886 . . 1 . . . . . 32 PHE C . 50425 1 134 . 1 . 1 32 32 PHE CA C 13 58.473 . . 1 . . . . . 32 PHE CA . 50425 1 135 . 1 . 1 32 32 PHE CB C 13 37.698 . . 1 . . . . . 32 PHE CB . 50425 1 136 . 1 . 1 32 32 PHE N N 15 122.010 . . 1 . . . . . 32 PHE N . 50425 1 137 . 1 . 1 33 33 ALA H H 1 7.695 . . 1 . . . . . 33 ALA H . 50425 1 138 . 1 . 1 33 33 ALA C C 13 178.127 . . 1 . . . . . 33 ALA C . 50425 1 139 . 1 . 1 33 33 ALA CA C 13 52.504 . . 1 . . . . . 33 ALA CA . 50425 1 140 . 1 . 1 33 33 ALA CB C 13 19.634 . . 1 . . . . . 33 ALA CB . 50425 1 141 . 1 . 1 33 33 ALA N N 15 118.011 . . 1 . . . . . 33 ALA N . 50425 1 142 . 1 . 1 34 34 GLY H H 1 7.920 . . 1 . . . . . 34 GLY H . 50425 1 143 . 1 . 1 34 34 GLY C C 13 174.884 . . 1 . . . . . 34 GLY C . 50425 1 144 . 1 . 1 34 34 GLY CA C 13 46.046 . . 1 . . . . . 34 GLY CA . 50425 1 145 . 1 . 1 34 34 GLY N N 15 106.740 . . 1 . . . . . 34 GLY N . 50425 1 146 . 1 . 1 35 35 LYS H H 1 7.906 . . 1 . . . . . 35 LYS H . 50425 1 147 . 1 . 1 35 35 LYS C C 13 176.299 . . 1 . . . . . 35 LYS C . 50425 1 148 . 1 . 1 35 35 LYS CA C 13 56.340 . . 1 . . . . . 35 LYS CA . 50425 1 149 . 1 . 1 35 35 LYS CB C 13 32.849 . . 1 . . . . . 35 LYS CB . 50425 1 150 . 1 . 1 35 35 LYS N N 15 118.221 . . 1 . . . . . 35 LYS N . 50425 1 151 . 1 . 1 36 36 ASN H H 1 7.916 . . 1 . . . . . 36 ASN H . 50425 1 152 . 1 . 1 36 36 ASN C C 13 175.106 . . 1 . . . . . 36 ASN C . 50425 1 153 . 1 . 1 36 36 ASN CA C 13 53.724 . . 1 . . . . . 36 ASN CA . 50425 1 154 . 1 . 1 36 36 ASN CB C 13 39.409 . . 1 . . . . . 36 ASN CB . 50425 1 155 . 1 . 1 36 36 ASN N N 15 119.874 . . 1 . . . . . 36 ASN N . 50425 1 156 . 1 . 1 37 37 THR H H 1 8.450 . . 1 . . . . . 37 THR H . 50425 1 157 . 1 . 1 37 37 THR C C 13 173.146 . . 1 . . . . . 37 THR C . 50425 1 158 . 1 . 1 37 37 THR CA C 13 61.565 . . 1 . . . . . 37 THR CA . 50425 1 159 . 1 . 1 37 37 THR CB C 13 70.214 . . 1 . . . . . 37 THR CB . 50425 1 160 . 1 . 1 37 37 THR N N 15 116.428 . . 1 . . . . . 37 THR N . 50425 1 161 . 1 . 1 38 38 ASP H H 1 8.076 . . 1 . . . . . 38 ASP H . 50425 1 162 . 1 . 1 38 38 ASP C C 13 176.113 . . 1 . . . . . 38 ASP C . 50425 1 163 . 1 . 1 38 38 ASP CA C 13 52.948 . . 1 . . . . . 38 ASP CA . 50425 1 164 . 1 . 1 38 38 ASP CB C 13 40.740 . . 1 . . . . . 38 ASP CB . 50425 1 165 . 1 . 1 38 38 ASP N N 15 123.475 . . 1 . . . . . 38 ASP N . 50425 1 166 . 1 . 1 39 39 LEU H H 1 8.533 . . 1 . . . . . 39 LEU H . 50425 1 167 . 1 . 1 39 39 LEU C C 13 178.253 . . 1 . . . . . 39 LEU C . 50425 1 168 . 1 . 1 39 39 LEU CA C 13 57.563 . . 1 . . . . . 39 LEU CA . 50425 1 169 . 1 . 1 39 39 LEU N N 15 127.574 . . 1 . . . . . 39 LEU N . 50425 1 170 . 1 . 1 40 40 GLU H H 1 8.310 . . 1 . . . . . 40 GLU H . 50425 1 171 . 1 . 1 40 40 GLU C C 13 179.080 . . 1 . . . . . 40 GLU C . 50425 1 172 . 1 . 1 40 40 GLU CA C 13 59.768 . . 1 . . . . . 40 GLU CA . 50425 1 173 . 1 . 1 40 40 GLU CB C 13 28.856 . . 1 . . . . . 40 GLU CB . 50425 1 174 . 1 . 1 40 40 GLU N N 15 118.726 . . 1 . . . . . 40 GLU N . 50425 1 175 . 1 . 1 41 41 ALA H H 1 7.729 . . 1 . . . . . 41 ALA H . 50425 1 176 . 1 . 1 41 41 ALA C C 13 181.544 . . 1 . . . . . 41 ALA C . 50425 1 177 . 1 . 1 41 41 ALA CA C 13 54.786 . . 1 . . . . . 41 ALA CA . 50425 1 178 . 1 . 1 41 41 ALA CB C 13 18.493 . . 1 . . . . . 41 ALA CB . 50425 1 179 . 1 . 1 41 41 ALA N N 15 121.388 . . 1 . . . . . 41 ALA N . 50425 1 180 . 1 . 1 42 42 LEU H H 1 7.748 . . 1 . . . . . 42 LEU H . 50425 1 181 . 1 . 1 42 42 LEU C C 13 178.811 . . 1 . . . . . 42 LEU C . 50425 1 182 . 1 . 1 42 42 LEU CA C 13 58.287 . . 1 . . . . . 42 LEU CA . 50425 1 183 . 1 . 1 42 42 LEU CB C 13 42.166 . . 1 . . . . . 42 LEU CB . 50425 1 184 . 1 . 1 42 42 LEU N N 15 121.228 . . 1 . . . . . 42 LEU N . 50425 1 185 . 1 . 1 43 43 MET H H 1 8.597 . . 1 . . . . . 43 MET H . 50425 1 186 . 1 . 1 43 43 MET C C 13 178.648 . . 1 . . . . . 43 MET C . 50425 1 187 . 1 . 1 43 43 MET CA C 13 57.629 . . 1 . . . . . 43 MET CA . 50425 1 188 . 1 . 1 43 43 MET CB C 13 32.023 . . 1 . . . . . 43 MET CB . 50425 1 189 . 1 . 1 43 43 MET N N 15 117.922 . . 1 . . . . . 43 MET N . 50425 1 190 . 1 . 1 44 44 GLU H H 1 8.112 . . 1 . . . . . 44 GLU H . 50425 1 191 . 1 . 1 44 44 GLU C C 13 178.919 . . 1 . . . . . 44 GLU C . 50425 1 192 . 1 . 1 44 44 GLU CA C 13 59.061 . . 1 . . . . . 44 GLU CA . 50425 1 193 . 1 . 1 44 44 GLU CB C 13 32.288 . . 1 . . . . . 44 GLU CB . 50425 1 194 . 1 . 1 44 44 GLU N N 15 120.142 . . 1 . . . . . 44 GLU N . 50425 1 195 . 1 . 1 45 45 TRP H H 1 8.061 . . 1 . . . . . 45 TRP H . 50425 1 196 . 1 . 1 45 45 TRP C C 13 178.739 . . 1 . . . . . 45 TRP C . 50425 1 197 . 1 . 1 45 45 TRP CA C 13 61.788 . . 1 . . . . . 45 TRP CA . 50425 1 198 . 1 . 1 45 45 TRP CB C 13 28.229 . . 1 . . . . . 45 TRP CB . 50425 1 199 . 1 . 1 45 45 TRP N N 15 121.497 . . 1 . . . . . 45 TRP N . 50425 1 200 . 1 . 1 46 46 LEU H H 1 8.914 . . 1 . . . . . 46 LEU H . 50425 1 201 . 1 . 1 46 46 LEU C C 13 178.091 . . 1 . . . . . 46 LEU C . 50425 1 202 . 1 . 1 46 46 LEU CA C 13 58.211 . . 1 . . . . . 46 LEU CA . 50425 1 203 . 1 . 1 46 46 LEU CB C 13 43.195 . . 1 . . . . . 46 LEU CB . 50425 1 204 . 1 . 1 46 46 LEU N N 15 121.665 . . 1 . . . . . 46 LEU N . 50425 1 205 . 1 . 1 47 47 LYS H H 1 8.111 . . 1 . . . . . 47 LYS H . 50425 1 206 . 1 . 1 47 47 LYS C C 13 178.541 . . 1 . . . . . 47 LYS C . 50425 1 207 . 1 . 1 47 47 LYS CA C 13 59.812 . . 1 . . . . . 47 LYS CA . 50425 1 208 . 1 . 1 47 47 LYS CB C 13 37.318 . . 1 . . . . . 47 LYS CB . 50425 1 209 . 1 . 1 47 47 LYS N N 15 117.031 . . 1 . . . . . 47 LYS N . 50425 1 210 . 1 . 1 48 48 THR H H 1 7.117 . . 1 . . . . . 48 THR H . 50425 1 211 . 1 . 1 48 48 THR C C 13 175.030 . . 1 . . . . . 48 THR C . 50425 1 212 . 1 . 1 48 48 THR CA C 13 61.029 . . 1 . . . . . 48 THR CA . 50425 1 213 . 1 . 1 48 48 THR N N 15 104.353 . . 1 . . . . . 48 THR N . 50425 1 214 . 1 . 1 49 49 ARG H H 1 7.120 . . 1 . . . . . 49 ARG H . 50425 1 215 . 1 . 1 49 49 ARG CA C 13 53.422 . . 1 . . . . . 49 ARG CA . 50425 1 216 . 1 . 1 49 49 ARG N N 15 121.372 . . 1 . . . . . 49 ARG N . 50425 1 217 . 1 . 1 55 55 LEU H H 1 8.278 . . 1 . . . . . 55 LEU H . 50425 1 218 . 1 . 1 55 55 LEU C C 13 177.889 . . 1 . . . . . 55 LEU C . 50425 1 219 . 1 . 1 55 55 LEU CA C 13 58.639 . . 1 . . . . . 55 LEU CA . 50425 1 220 . 1 . 1 55 55 LEU CB C 13 41.267 . . 1 . . . . . 55 LEU CB . 50425 1 221 . 1 . 1 55 55 LEU N N 15 117.425 . . 1 . . . . . 55 LEU N . 50425 1 222 . 1 . 1 56 56 THR H H 1 7.629 . . 1 . . . . . 56 THR H . 50425 1 223 . 1 . 1 56 56 THR C C 13 176.437 . . 1 . . . . . 56 THR C . 50425 1 224 . 1 . 1 56 56 THR CA C 13 67.706 . . 1 . . . . . 56 THR CA . 50425 1 225 . 1 . 1 56 56 THR CB C 13 65.821 . . 1 . . . . . 56 THR CB . 50425 1 226 . 1 . 1 56 56 THR N N 15 116.156 . . 1 . . . . . 56 THR N . 50425 1 227 . 1 . 1 57 57 LYS H H 1 8.275 . . 1 . . . . . 57 LYS H . 50425 1 228 . 1 . 1 57 57 LYS C C 13 178.595 . . 1 . . . . . 57 LYS C . 50425 1 229 . 1 . 1 57 57 LYS CA C 13 61.647 . . 1 . . . . . 57 LYS CA . 50425 1 230 . 1 . 1 57 57 LYS CB C 13 32.962 . . 1 . . . . . 57 LYS CB . 50425 1 231 . 1 . 1 57 57 LYS N N 15 119.998 . . 1 . . . . . 57 LYS N . 50425 1 232 . 1 . 1 58 58 GLY H H 1 8.623 . . 1 . . . . . 58 GLY H . 50425 1 233 . 1 . 1 58 58 GLY C C 13 174.387 . . 1 . . . . . 58 GLY C . 50425 1 234 . 1 . 1 58 58 GLY CA C 13 47.720 . . 1 . . . . . 58 GLY CA . 50425 1 235 . 1 . 1 58 58 GLY N N 15 106.986 . . 1 . . . . . 58 GLY N . 50425 1 236 . 1 . 1 59 59 ILE H H 1 8.616 . . 1 . . . . . 59 ILE H . 50425 1 237 . 1 . 1 59 59 ILE C C 13 178.109 . . 1 . . . . . 59 ILE C . 50425 1 238 . 1 . 1 59 59 ILE CA C 13 66.303 . . 1 . . . . . 59 ILE CA . 50425 1 239 . 1 . 1 59 59 ILE CB C 13 38.649 . . 1 . . . . . 59 ILE CB . 50425 1 240 . 1 . 1 59 59 ILE N N 15 122.678 . . 1 . . . . . 59 ILE N . 50425 1 241 . 1 . 1 60 60 LEU H H 1 8.342 . . 1 . . . . . 60 LEU H . 50425 1 242 . 1 . 1 60 60 LEU C C 13 177.786 . . 1 . . . . . 60 LEU C . 50425 1 243 . 1 . 1 60 60 LEU CA C 13 58.218 . . 1 . . . . . 60 LEU CA . 50425 1 244 . 1 . 1 60 60 LEU CB C 13 42.167 . . 1 . . . . . 60 LEU CB . 50425 1 245 . 1 . 1 60 60 LEU N N 15 118.642 . . 1 . . . . . 60 LEU N . 50425 1 246 . 1 . 1 61 61 GLY H H 1 8.901 . . 1 . . . . . 61 GLY H . 50425 1 247 . 1 . 1 61 61 GLY C C 13 175.813 . . 1 . . . . . 61 GLY C . 50425 1 248 . 1 . 1 61 61 GLY CA C 13 47.514 . . 1 . . . . . 61 GLY CA . 50425 1 249 . 1 . 1 61 61 GLY N N 15 106.906 . . 1 . . . . . 61 GLY N . 50425 1 250 . 1 . 1 62 62 PHE H H 1 8.647 . . 1 . . . . . 62 PHE H . 50425 1 251 . 1 . 1 62 62 PHE C C 13 176.273 . . 1 . . . . . 62 PHE C . 50425 1 252 . 1 . 1 62 62 PHE CA C 13 62.546 . . 1 . . . . . 62 PHE CA . 50425 1 253 . 1 . 1 62 62 PHE CB C 13 39.816 . . 1 . . . . . 62 PHE CB . 50425 1 254 . 1 . 1 62 62 PHE N N 15 126.302 . . 1 . . . . . 62 PHE N . 50425 1 255 . 1 . 1 63 63 VAL H H 1 8.623 . . 1 . . . . . 63 VAL H . 50425 1 256 . 1 . 1 63 63 VAL C C 13 178.718 . . 1 . . . . . 63 VAL C . 50425 1 257 . 1 . 1 63 63 VAL CA C 13 67.651 . . 1 . . . . . 63 VAL CA . 50425 1 258 . 1 . 1 63 63 VAL CB C 13 31.553 . . 1 . . . . . 63 VAL CB . 50425 1 259 . 1 . 1 63 63 VAL N N 15 118.979 . . 1 . . . . . 63 VAL N . 50425 1 260 . 1 . 1 64 64 PHE H H 1 8.878 . . 1 . . . . . 64 PHE H . 50425 1 261 . 1 . 1 64 64 PHE C C 13 177.297 . . 1 . . . . . 64 PHE C . 50425 1 262 . 1 . 1 64 64 PHE CA C 13 60.228 . . 1 . . . . . 64 PHE CA . 50425 1 263 . 1 . 1 64 64 PHE CB C 13 38.364 . . 1 . . . . . 64 PHE CB . 50425 1 264 . 1 . 1 64 64 PHE N N 15 117.747 . . 1 . . . . . 64 PHE N . 50425 1 265 . 1 . 1 65 65 THR H H 1 7.866 . . 1 . . . . . 65 THR H . 50425 1 266 . 1 . 1 65 65 THR CA C 13 67.242 . . 1 . . . . . 65 THR CA . 50425 1 267 . 1 . 1 65 65 THR CB C 13 68.978 . . 1 . . . . . 65 THR CB . 50425 1 268 . 1 . 1 65 65 THR N N 15 114.895 . . 1 . . . . . 65 THR N . 50425 1 269 . 1 . 1 66 66 LEU H H 1 7.751 . . 1 . . . . . 66 LEU H . 50425 1 270 . 1 . 1 66 66 LEU C C 13 178.034 . . 1 . . . . . 66 LEU C . 50425 1 271 . 1 . 1 66 66 LEU CA C 13 57.073 . . 1 . . . . . 66 LEU CA . 50425 1 272 . 1 . 1 66 66 LEU CB C 13 43.688 . . 1 . . . . . 66 LEU CB . 50425 1 273 . 1 . 1 66 66 LEU N N 15 119.616 . . 1 . . . . . 66 LEU N . 50425 1 274 . 1 . 1 67 67 THR H H 1 7.454 . . 1 . . . . . 67 THR H . 50425 1 275 . 1 . 1 67 67 THR C C 13 174.383 . . 1 . . . . . 67 THR C . 50425 1 276 . 1 . 1 67 67 THR CA C 13 63.519 . . 1 . . . . . 67 THR CA . 50425 1 277 . 1 . 1 67 67 THR CB C 13 70.404 . . 1 . . . . . 67 THR CB . 50425 1 278 . 1 . 1 67 67 THR N N 15 106.501 . . 1 . . . . . 67 THR N . 50425 1 279 . 1 . 1 68 68 VAL H H 1 7.490 . . 1 . . . . . 68 VAL H . 50425 1 280 . 1 . 1 68 68 VAL C C 13 173.829 . . 1 . . . . . 68 VAL C . 50425 1 281 . 1 . 1 68 68 VAL CA C 13 60.177 . . 1 . . . . . 68 VAL CA . 50425 1 282 . 1 . 1 68 68 VAL CB C 13 32.659 . . 1 . . . . . 68 VAL CB . 50425 1 283 . 1 . 1 68 68 VAL N N 15 121.858 . . 1 . . . . . 68 VAL N . 50425 1 284 . 1 . 1 70 70 SER H H 1 8.352 . . 1 . . . . . 70 SER H . 50425 1 285 . 1 . 1 70 70 SER C C 13 175.489 . . 1 . . . . . 70 SER C . 50425 1 286 . 1 . 1 70 70 SER CA C 13 59.183 . . 1 . . . . . 70 SER CA . 50425 1 287 . 1 . 1 70 70 SER CB C 13 63.941 . . 1 . . . . . 70 SER CB . 50425 1 288 . 1 . 1 70 70 SER N N 15 115.909 . . 1 . . . . . 70 SER N . 50425 1 289 . 1 . 1 71 71 GLU H H 1 8.697 . . 1 . . . . . 71 GLU H . 50425 1 290 . 1 . 1 71 71 GLU C C 13 176.967 . . 1 . . . . . 71 GLU C . 50425 1 291 . 1 . 1 71 71 GLU CA C 13 57.685 . . 1 . . . . . 71 GLU CA . 50425 1 292 . 1 . 1 71 71 GLU CB C 13 29.712 . . 1 . . . . . 71 GLU CB . 50425 1 293 . 1 . 1 71 71 GLU N N 15 123.145 . . 1 . . . . . 71 GLU N . 50425 1 294 . 1 . 1 72 72 ARG H H 1 8.109 . . 1 . . . . . 72 ARG H . 50425 1 295 . 1 . 1 72 72 ARG C C 13 176.904 . . 1 . . . . . 72 ARG C . 50425 1 296 . 1 . 1 72 72 ARG CA C 13 56.827 . . 1 . . . . . 72 ARG CA . 50425 1 297 . 1 . 1 72 72 ARG CB C 13 30.663 . . 1 . . . . . 72 ARG CB . 50425 1 298 . 1 . 1 72 72 ARG N N 15 119.793 . . 1 . . . . . 72 ARG N . 50425 1 299 . 1 . 1 73 73 GLY H H 1 8.133 . . 1 . . . . . 73 GLY H . 50425 1 300 . 1 . 1 73 73 GLY C C 13 174.025 . . 1 . . . . . 73 GLY C . 50425 1 301 . 1 . 1 73 73 GLY CA C 13 45.760 . . 1 . . . . . 73 GLY CA . 50425 1 302 . 1 . 1 73 73 GLY N N 15 108.165 . . 1 . . . . . 73 GLY N . 50425 1 303 . 1 . 1 74 74 LEU H H 1 7.908 . . 1 . . . . . 74 LEU H . 50425 1 304 . 1 . 1 74 74 LEU C C 13 177.277 . . 1 . . . . . 74 LEU C . 50425 1 305 . 1 . 1 74 74 LEU CA C 13 55.276 . . 1 . . . . . 74 LEU CA . 50425 1 306 . 1 . 1 74 74 LEU CB C 13 43.022 . . 1 . . . . . 74 LEU CB . 50425 1 307 . 1 . 1 74 74 LEU N N 15 121.522 . . 1 . . . . . 74 LEU N . 50425 1 308 . 1 . 1 75 75 GLN H H 1 8.576 . . 1 . . . . . 75 GLN H . 50425 1 309 . 1 . 1 75 75 GLN C C 13 176.236 . . 1 . . . . . 75 GLN C . 50425 1 310 . 1 . 1 75 75 GLN CA C 13 56.041 . . 1 . . . . . 75 GLN CA . 50425 1 311 . 1 . 1 75 75 GLN CB C 13 29.484 . . 1 . . . . . 75 GLN CB . 50425 1 312 . 1 . 1 75 75 GLN N N 15 122.793 . . 1 . . . . . 75 GLN N . 50425 1 313 . 1 . 1 76 76 ARG H H 1 8.566 . . 1 . . . . . 76 ARG H . 50425 1 314 . 1 . 1 76 76 ARG C C 13 176.280 . . 1 . . . . . 76 ARG C . 50425 1 315 . 1 . 1 76 76 ARG CA C 13 56.265 . . 1 . . . . . 76 ARG CA . 50425 1 316 . 1 . 1 76 76 ARG CB C 13 30.733 . . 1 . . . . . 76 ARG CB . 50425 1 317 . 1 . 1 76 76 ARG N N 15 123.338 . . 1 . . . . . 76 ARG N . 50425 1 318 . 1 . 1 77 77 ARG H H 1 8.529 . . 1 . . . . . 77 ARG H . 50425 1 319 . 1 . 1 77 77 ARG C C 13 177.149 . . 1 . . . . . 77 ARG C . 50425 1 320 . 1 . 1 77 77 ARG CA C 13 53.588 . . 1 . . . . . 77 ARG CA . 50425 1 321 . 1 . 1 77 77 ARG CB C 13 31.068 . . 1 . . . . . 77 ARG CB . 50425 1 322 . 1 . 1 77 77 ARG N N 15 121.084 . . 1 . . . . . 77 ARG N . 50425 1 323 . 1 . 1 81 81 GLN H H 1 7.541 . . 1 . . . . . 81 GLN H . 50425 1 324 . 1 . 1 81 81 GLN C C 13 178.541 . . 1 . . . . . 81 GLN C . 50425 1 325 . 1 . 1 81 81 GLN CA C 13 59.369 . . 1 . . . . . 81 GLN CA . 50425 1 326 . 1 . 1 81 81 GLN CB C 13 29.838 . . 1 . . . . . 81 GLN CB . 50425 1 327 . 1 . 1 81 81 GLN N N 15 117.729 . . 1 . . . . . 81 GLN N . 50425 1 328 . 1 . 1 82 82 ASN H H 1 8.891 . . 1 . . . . . 82 ASN H . 50425 1 329 . 1 . 1 82 82 ASN C C 13 177.252 . . 1 . . . . . 82 ASN C . 50425 1 330 . 1 . 1 82 82 ASN CA C 13 55.335 . . 1 . . . . . 82 ASN CA . 50425 1 331 . 1 . 1 82 82 ASN CB C 13 38.086 . . 1 . . . . . 82 ASN CB . 50425 1 332 . 1 . 1 82 82 ASN N N 15 114.794 . . 1 . . . . . 82 ASN N . 50425 1 333 . 1 . 1 83 83 ALA H H 1 7.102 . . 1 . . . . . 83 ALA H . 50425 1 334 . 1 . 1 83 83 ALA C C 13 178.703 . . 1 . . . . . 83 ALA C . 50425 1 335 . 1 . 1 83 83 ALA CA C 13 54.214 . . 1 . . . . . 83 ALA CA . 50425 1 336 . 1 . 1 83 83 ALA CB C 13 20.109 . . 1 . . . . . 83 ALA CB . 50425 1 337 . 1 . 1 83 83 ALA N N 15 120.762 . . 1 . . . . . 83 ALA N . 50425 1 338 . 1 . 1 84 84 LEU H H 1 7.408 . . 1 . . . . . 84 LEU H . 50425 1 339 . 1 . 1 84 84 LEU C C 13 175.925 . . 1 . . . . . 84 LEU C . 50425 1 340 . 1 . 1 84 84 LEU CA C 13 55.276 . . 1 . . . . . 84 LEU CA . 50425 1 341 . 1 . 1 84 84 LEU CB C 13 39.980 . . 1 . . . . . 84 LEU CB . 50425 1 342 . 1 . 1 84 84 LEU N N 15 115.742 . . 1 . . . . . 84 LEU N . 50425 1 343 . 1 . 1 85 85 ASN H H 1 7.480 . . 1 . . . . . 85 ASN H . 50425 1 344 . 1 . 1 85 85 ASN C C 13 176.811 . . 1 . . . . . 85 ASN C . 50425 1 345 . 1 . 1 85 85 ASN CA C 13 53.642 . . 1 . . . . . 85 ASN CA . 50425 1 346 . 1 . 1 85 85 ASN CB C 13 39.695 . . 1 . . . . . 85 ASN CB . 50425 1 347 . 1 . 1 85 85 ASN N N 15 114.757 . . 1 . . . . . 85 ASN N . 50425 1 348 . 1 . 1 86 86 GLY H H 1 7.903 . . 1 . . . . . 86 GLY H . 50425 1 349 . 1 . 1 86 86 GLY C C 13 174.818 . . 1 . . . . . 86 GLY C . 50425 1 350 . 1 . 1 86 86 GLY CA C 13 46.781 . . 1 . . . . . 86 GLY CA . 50425 1 351 . 1 . 1 86 86 GLY N N 15 108.272 . . 1 . . . . . 86 GLY N . 50425 1 352 . 1 . 1 87 87 ASN H H 1 8.467 . . 1 . . . . . 87 ASN H . 50425 1 353 . 1 . 1 87 87 ASN C C 13 176.035 . . 1 . . . . . 87 ASN C . 50425 1 354 . 1 . 1 87 87 ASN CA C 13 53.601 . . 1 . . . . . 87 ASN CA . 50425 1 355 . 1 . 1 87 87 ASN CB C 13 38.649 . . 1 . . . . . 87 ASN CB . 50425 1 356 . 1 . 1 87 87 ASN N N 15 119.898 . . 1 . . . . . 87 ASN N . 50425 1 357 . 1 . 1 88 88 GLY H H 1 8.320 . . 1 . . . . . 88 GLY H . 50425 1 358 . 1 . 1 88 88 GLY C C 13 173.991 . . 1 . . . . . 88 GLY C . 50425 1 359 . 1 . 1 88 88 GLY CA C 13 46.209 . . 1 . . . . . 88 GLY CA . 50425 1 360 . 1 . 1 88 88 GLY N N 15 108.736 . . 1 . . . . . 88 GLY N . 50425 1 361 . 1 . 1 89 89 ASP H H 1 7.674 . . 1 . . . . . 89 ASP H . 50425 1 362 . 1 . 1 89 89 ASP C C 13 176.005 . . 1 . . . . . 89 ASP C . 50425 1 363 . 1 . 1 89 89 ASP CA C 13 52.090 . . 1 . . . . . 89 ASP CA . 50425 1 364 . 1 . 1 89 89 ASP CB C 13 42.357 . . 1 . . . . . 89 ASP CB . 50425 1 365 . 1 . 1 89 89 ASP N N 15 121.314 . . 1 . . . . . 89 ASP N . 50425 1 366 . 1 . 1 91 91 ASN H H 1 8.501 . . 1 . . . . . 91 ASN H . 50425 1 367 . 1 . 1 91 91 ASN C C 13 177.594 . . 1 . . . . . 91 ASN C . 50425 1 368 . 1 . 1 91 91 ASN CA C 13 56.100 . . 1 . . . . . 91 ASN CA . 50425 1 369 . 1 . 1 91 91 ASN CB C 13 38.649 . . 1 . . . . . 91 ASN CB . 50425 1 370 . 1 . 1 91 91 ASN N N 15 117.435 . . 1 . . . . . 91 ASN N . 50425 1 371 . 1 . 1 92 92 ASN H H 1 8.008 . . 1 . . . . . 92 ASN H . 50425 1 372 . 1 . 1 92 92 ASN C C 13 177.246 . . 1 . . . . . 92 ASN C . 50425 1 373 . 1 . 1 92 92 ASN CA C 13 56.100 . . 1 . . . . . 92 ASN CA . 50425 1 374 . 1 . 1 92 92 ASN CB C 13 38.269 . . 1 . . . . . 92 ASN CB . 50425 1 375 . 1 . 1 92 92 ASN N N 15 118.661 . . 1 . . . . . 92 ASN N . 50425 1 376 . 1 . 1 93 93 MET H H 1 7.808 . . 1 . . . . . 93 MET H . 50425 1 377 . 1 . 1 93 93 MET C C 13 177.405 . . 1 . . . . . 93 MET C . 50425 1 378 . 1 . 1 93 93 MET CA C 13 57.645 . . 1 . . . . . 93 MET CA . 50425 1 379 . 1 . 1 93 93 MET CB C 13 31.075 . . 1 . . . . . 93 MET CB . 50425 1 380 . 1 . 1 93 93 MET N N 15 119.206 . . 1 . . . . . 93 MET N . 50425 1 381 . 1 . 1 94 94 ASP H H 1 7.987 . . 1 . . . . . 94 ASP H . 50425 1 382 . 1 . 1 94 94 ASP C C 13 179.196 . . 1 . . . . . 94 ASP C . 50425 1 383 . 1 . 1 94 94 ASP CA C 13 57.826 . . 1 . . . . . 94 ASP CA . 50425 1 384 . 1 . 1 94 94 ASP CB C 13 41.976 . . 1 . . . . . 94 ASP CB . 50425 1 385 . 1 . 1 94 94 ASP N N 15 119.228 . . 1 . . . . . 94 ASP N . 50425 1 386 . 1 . 1 95 95 ARG H H 1 7.721 . . 1 . . . . . 95 ARG H . 50425 1 387 . 1 . 1 95 95 ARG C C 13 177.314 . . 1 . . . . . 95 ARG C . 50425 1 388 . 1 . 1 95 95 ARG CA C 13 59.319 . . 1 . . . . . 95 ARG CA . 50425 1 389 . 1 . 1 95 95 ARG CB C 13 30.853 . . 1 . . . . . 95 ARG CB . 50425 1 390 . 1 . 1 95 95 ARG N N 15 117.207 . . 1 . . . . . 95 ARG N . 50425 1 391 . 1 . 1 96 96 ALA H H 1 8.372 . . 1 . . . . . 96 ALA H . 50425 1 392 . 1 . 1 96 96 ALA C C 13 179.360 . . 1 . . . . . 96 ALA C . 50425 1 393 . 1 . 1 96 96 ALA CA C 13 55.848 . . 1 . . . . . 96 ALA CA . 50425 1 394 . 1 . 1 96 96 ALA CB C 13 19.681 . . 1 . . . . . 96 ALA CB . 50425 1 395 . 1 . 1 96 96 ALA N N 15 121.519 . . 1 . . . . . 96 ALA N . 50425 1 396 . 1 . 1 97 97 VAL H H 1 8.192 . . 1 . . . . . 97 VAL H . 50425 1 397 . 1 . 1 97 97 VAL C C 13 178.019 . . 1 . . . . . 97 VAL C . 50425 1 398 . 1 . 1 97 97 VAL CA C 13 66.859 . . 1 . . . . . 97 VAL CA . 50425 1 399 . 1 . 1 97 97 VAL CB C 13 32.086 . . 1 . . . . . 97 VAL CB . 50425 1 400 . 1 . 1 97 97 VAL N N 15 117.777 . . 1 . . . . . 97 VAL N . 50425 1 401 . 1 . 1 98 98 LYS H H 1 7.388 . . 1 . . . . . 98 LYS H . 50425 1 402 . 1 . 1 98 98 LYS C C 13 179.746 . . 1 . . . . . 98 LYS C . 50425 1 403 . 1 . 1 98 98 LYS CA C 13 60.258 . . 1 . . . . . 98 LYS CA . 50425 1 404 . 1 . 1 98 98 LYS CB C 13 32.564 . . 1 . . . . . 98 LYS CB . 50425 1 405 . 1 . 1 98 98 LYS N N 15 120.403 . . 1 . . . . . 98 LYS N . 50425 1 406 . 1 . 1 99 99 LEU H H 1 8.159 . . 1 . . . . . 99 LEU H . 50425 1 407 . 1 . 1 99 99 LEU C C 13 177.858 . . 1 . . . . . 99 LEU C . 50425 1 408 . 1 . 1 99 99 LEU CA C 13 57.919 . . 1 . . . . . 99 LEU CA . 50425 1 409 . 1 . 1 99 99 LEU CB C 13 39.567 . . 1 . . . . . 99 LEU CB . 50425 1 410 . 1 . 1 99 99 LEU N N 15 121.514 . . 1 . . . . . 99 LEU N . 50425 1 411 . 1 . 1 100 100 TYR H H 1 8.885 . . 1 . . . . . 100 TYR H . 50425 1 412 . 1 . 1 100 100 TYR C C 13 176.309 . . 1 . . . . . 100 TYR C . 50425 1 413 . 1 . 1 100 100 TYR CA C 13 61.030 . . 1 . . . . . 100 TYR CA . 50425 1 414 . 1 . 1 100 100 TYR N N 15 121.810 . . 1 . . . . . 100 TYR N . 50425 1 415 . 1 . 1 101 101 LYS H H 1 7.881 . . 1 . . . . . 101 LYS H . 50425 1 416 . 1 . 1 101 101 LYS C C 13 179.835 . . 1 . . . . . 101 LYS C . 50425 1 417 . 1 . 1 101 101 LYS CA C 13 60.391 . . 1 . . . . . 101 LYS CA . 50425 1 418 . 1 . 1 101 101 LYS N N 15 115.406 . . 1 . . . . . 101 LYS N . 50425 1 419 . 1 . 1 102 102 LYS H H 1 7.450 . . 1 . . . . . 102 LYS H . 50425 1 420 . 1 . 1 102 102 LYS C C 13 180.237 . . 1 . . . . . 102 LYS C . 50425 1 421 . 1 . 1 102 102 LYS CA C 13 59.596 . . 1 . . . . . 102 LYS CA . 50425 1 422 . 1 . 1 102 102 LYS N N 15 118.584 . . 1 . . . . . 102 LYS N . 50425 1 423 . 1 . 1 110 110 HIS H H 1 8.217 . . 1 . . . . . 110 HIS H . 50425 1 424 . 1 . 1 110 110 HIS C C 13 175.574 . . 1 . . . . . 110 HIS C . 50425 1 425 . 1 . 1 110 110 HIS CA C 13 55.792 . . 1 . . . . . 110 HIS CA . 50425 1 426 . 1 . 1 110 110 HIS CB C 13 29.669 . . 1 . . . . . 110 HIS CB . 50425 1 427 . 1 . 1 110 110 HIS N N 15 122.515 . . 1 . . . . . 110 HIS N . 50425 1 428 . 1 . 1 111 111 GLY H H 1 7.665 . . 1 . . . . . 111 GLY H . 50425 1 429 . 1 . 1 111 111 GLY C C 13 171.915 . . 1 . . . . . 111 GLY C . 50425 1 430 . 1 . 1 111 111 GLY CA C 13 44.559 . . 1 . . . . . 111 GLY CA . 50425 1 431 . 1 . 1 111 111 GLY N N 15 109.415 . . 1 . . . . . 111 GLY N . 50425 1 432 . 1 . 1 114 114 GLU H H 1 7.729 . . 1 . . . . . 114 GLU H . 50425 1 433 . 1 . 1 114 114 GLU C C 13 179.800 . . 1 . . . . . 114 GLU C . 50425 1 434 . 1 . 1 114 114 GLU CA C 13 59.810 . . 1 . . . . . 114 GLU CA . 50425 1 435 . 1 . 1 114 114 GLU CB C 13 29.654 . . 1 . . . . . 114 GLU CB . 50425 1 436 . 1 . 1 114 114 GLU N N 15 116.186 . . 1 . . . . . 114 GLU N . 50425 1 437 . 1 . 1 115 115 VAL H H 1 7.886 . . 1 . . . . . 115 VAL H . 50425 1 438 . 1 . 1 115 115 VAL C C 13 178.577 . . 1 . . . . . 115 VAL C . 50425 1 439 . 1 . 1 115 115 VAL CA C 13 65.349 . . 1 . . . . . 115 VAL CA . 50425 1 440 . 1 . 1 115 115 VAL N N 15 116.901 . . 1 . . . . . 115 VAL N . 50425 1 441 . 1 . 1 116 116 SER H H 1 7.542 . . 1 . . . . . 116 SER H . 50425 1 442 . 1 . 1 116 116 SER C C 13 174.584 . . 1 . . . . . 116 SER C . 50425 1 443 . 1 . 1 116 116 SER CA C 13 63.258 . . 1 . . . . . 116 SER CA . 50425 1 444 . 1 . 1 116 116 SER N N 15 117.479 . . 1 . . . . . 116 SER N . 50425 1 445 . 1 . 1 117 117 LEU H H 1 7.525 . . 1 . . . . . 117 LEU H . 50425 1 446 . 1 . 1 117 117 LEU C C 13 177.076 . . 1 . . . . . 117 LEU C . 50425 1 447 . 1 . 1 117 117 LEU CA C 13 57.214 . . 1 . . . . . 117 LEU CA . 50425 1 448 . 1 . 1 117 117 LEU CB C 13 42.603 . . 1 . . . . . 117 LEU CB . 50425 1 449 . 1 . 1 117 117 LEU N N 15 117.872 . . 1 . . . . . 117 LEU N . 50425 1 450 . 1 . 1 118 118 SER H H 1 7.327 . . 1 . . . . . 118 SER H . 50425 1 451 . 1 . 1 118 118 SER C C 13 173.415 . . 1 . . . . . 118 SER C . 50425 1 452 . 1 . 1 118 118 SER CA C 13 59.660 . . 1 . . . . . 118 SER CA . 50425 1 453 . 1 . 1 118 118 SER CB C 13 63.991 . . 1 . . . . . 118 SER CB . 50425 1 454 . 1 . 1 118 118 SER N N 15 111.616 . . 1 . . . . . 118 SER N . 50425 1 455 . 1 . 1 119 119 TYR H H 1 7.967 . . 1 . . . . . 119 TYR H . 50425 1 456 . 1 . 1 119 119 TYR C C 13 173.952 . . 1 . . . . . 119 TYR C . 50425 1 457 . 1 . 1 119 119 TYR CA C 13 58.233 . . 1 . . . . . 119 TYR CA . 50425 1 458 . 1 . 1 119 119 TYR CB C 13 40.715 . . 1 . . . . . 119 TYR CB . 50425 1 459 . 1 . 1 119 119 TYR N N 15 122.468 . . 1 . . . . . 119 TYR N . 50425 1 460 . 1 . 1 120 120 SER H H 1 8.416 . . 1 . . . . . 120 SER H . 50425 1 461 . 1 . 1 120 120 SER C C 13 175.363 . . 1 . . . . . 120 SER C . 50425 1 462 . 1 . 1 120 120 SER CA C 13 57.571 . . 1 . . . . . 120 SER CA . 50425 1 463 . 1 . 1 120 120 SER CB C 13 65.175 . . 1 . . . . . 120 SER CB . 50425 1 464 . 1 . 1 120 120 SER N N 15 114.788 . . 1 . . . . . 120 SER N . 50425 1 465 . 1 . 1 121 121 THR H H 1 8.520 . . 1 . . . . . 121 THR H . 50425 1 466 . 1 . 1 121 121 THR C C 13 176.257 . . 1 . . . . . 121 THR C . 50425 1 467 . 1 . 1 121 121 THR CA C 13 67.120 . . 1 . . . . . 121 THR CA . 50425 1 468 . 1 . 1 121 121 THR CB C 13 68.883 . . 1 . . . . . 121 THR CB . 50425 1 469 . 1 . 1 121 121 THR N N 15 116.476 . . 1 . . . . . 121 THR N . 50425 1 470 . 1 . 1 122 122 GLY H H 1 8.669 . . 1 . . . . . 122 GLY H . 50425 1 471 . 1 . 1 122 122 GLY C C 13 176.601 . . 1 . . . . . 122 GLY C . 50425 1 472 . 1 . 1 122 122 GLY CA C 13 47.312 . . 1 . . . . . 122 GLY CA . 50425 1 473 . 1 . 1 122 122 GLY N N 15 106.897 . . 1 . . . . . 122 GLY N . 50425 1 474 . 1 . 1 123 123 ALA H H 1 7.579 . . 1 . . . . . 123 ALA H . 50425 1 475 . 1 . 1 123 123 ALA C C 13 179.214 . . 1 . . . . . 123 ALA C . 50425 1 476 . 1 . 1 123 123 ALA CA C 13 55.251 . . 1 . . . . . 123 ALA CA . 50425 1 477 . 1 . 1 123 123 ALA CB C 13 19.634 . . 1 . . . . . 123 ALA CB . 50425 1 478 . 1 . 1 123 123 ALA N N 15 125.773 . . 1 . . . . . 123 ALA N . 50425 1 479 . 1 . 1 124 124 LEU H H 1 8.285 . . 1 . . . . . 124 LEU H . 50425 1 480 . 1 . 1 124 124 LEU C C 13 179.525 . . 1 . . . . . 124 LEU C . 50425 1 481 . 1 . 1 124 124 LEU CA C 13 58.706 . . 1 . . . . . 124 LEU CA . 50425 1 482 . 1 . 1 124 124 LEU N N 15 120.192 . . 1 . . . . . 124 LEU N . 50425 1 483 . 1 . 1 125 125 ALA H H 1 8.598 . . 1 . . . . . 125 ALA H . 50425 1 484 . 1 . 1 125 125 ALA C C 13 179.196 . . 1 . . . . . 125 ALA C . 50425 1 485 . 1 . 1 125 125 ALA CA C 13 55.601 . . 1 . . . . . 125 ALA CA . 50425 1 486 . 1 . 1 125 125 ALA CB C 13 18.493 . . 1 . . . . . 125 ALA CB . 50425 1 487 . 1 . 1 125 125 ALA N N 15 121.118 . . 1 . . . . . 125 ALA N . 50425 1 488 . 1 . 1 126 126 SER H H 1 7.621 . . 1 . . . . . 126 SER H . 50425 1 489 . 1 . 1 126 126 SER C C 13 176.724 . . 1 . . . . . 126 SER C . 50425 1 490 . 1 . 1 126 126 SER CA C 13 62.709 . . 1 . . . . . 126 SER CA . 50425 1 491 . 1 . 1 126 126 SER N N 15 112.203 . . 1 . . . . . 126 SER N . 50425 1 492 . 1 . 1 127 127 CYS H H 1 8.652 . . 1 . . . . . 127 CYS H . 50425 1 493 . 1 . 1 127 127 CYS C C 13 176.163 . . 1 . . . . . 127 CYS C . 50425 1 494 . 1 . 1 127 127 CYS CA C 13 63.384 . . 1 . . . . . 127 CYS CA . 50425 1 495 . 1 . 1 127 127 CYS CB C 13 26.632 . . 1 . . . . . 127 CYS CB . 50425 1 496 . 1 . 1 127 127 CYS N N 15 124.557 . . 1 . . . . . 127 CYS N . 50425 1 497 . 1 . 1 128 128 MET H H 1 8.412 . . 1 . . . . . 128 MET H . 50425 1 498 . 1 . 1 128 128 MET C C 13 177.734 . . 1 . . . . . 128 MET C . 50425 1 499 . 1 . 1 128 128 MET CA C 13 60.628 . . 1 . . . . . 128 MET CA . 50425 1 500 . 1 . 1 128 128 MET CB C 13 30.346 . . 1 . . . . . 128 MET CB . 50425 1 501 . 1 . 1 128 128 MET N N 15 120.095 . . 1 . . . . . 128 MET N . 50425 1 502 . 1 . 1 129 129 GLY H H 1 8.122 . . 1 . . . . . 129 GLY H . 50425 1 503 . 1 . 1 129 129 GLY C C 13 175.843 . . 1 . . . . . 129 GLY C . 50425 1 504 . 1 . 1 129 129 GLY CA C 13 48.019 . . 1 . . . . . 129 GLY CA . 50425 1 505 . 1 . 1 129 129 GLY N N 15 106.584 . . 1 . . . . . 129 GLY N . 50425 1 506 . 1 . 1 130 130 LEU H H 1 7.750 . . 1 . . . . . 130 LEU H . 50425 1 507 . 1 . 1 130 130 LEU C C 13 179.844 . . 1 . . . . . 130 LEU C . 50425 1 508 . 1 . 1 130 130 LEU CA C 13 57.991 . . 1 . . . . . 130 LEU CA . 50425 1 509 . 1 . 1 130 130 LEU N N 15 123.074 . . 1 . . . . . 130 LEU N . 50425 1 510 . 1 . 1 131 131 ILE H H 1 7.839 . . 1 . . . . . 131 ILE H . 50425 1 511 . 1 . 1 131 131 ILE C C 13 177.578 . . 1 . . . . . 131 ILE C . 50425 1 512 . 1 . 1 131 131 ILE CA C 13 65.470 . . 1 . . . . . 131 ILE CA . 50425 1 513 . 1 . 1 131 131 ILE N N 15 119.214 . . 1 . . . . . 131 ILE N . 50425 1 514 . 1 . 1 136 136 GLY H H 1 8.635 . . 1 . . . . . 136 GLY H . 50425 1 515 . 1 . 1 136 136 GLY C C 13 173.824 . . 1 . . . . . 136 GLY C . 50425 1 516 . 1 . 1 136 136 GLY CA C 13 45.493 . . 1 . . . . . 136 GLY CA . 50425 1 517 . 1 . 1 136 136 GLY N N 15 110.371 . . 1 . . . . . 136 GLY N . 50425 1 518 . 1 . 1 137 137 THR H H 1 8.296 . . 1 . . . . . 137 THR H . 50425 1 519 . 1 . 1 137 137 THR C C 13 174.512 . . 1 . . . . . 137 THR C . 50425 1 520 . 1 . 1 137 137 THR CA C 13 58.289 . . 1 . . . . . 137 THR CA . 50425 1 521 . 1 . 1 137 137 THR CB C 13 64.198 . . 1 . . . . . 137 THR CB . 50425 1 522 . 1 . 1 137 137 THR N N 15 115.163 . . 1 . . . . . 137 THR N . 50425 1 523 . 1 . 1 141 141 GLU H H 1 9.075 . . 1 . . . . . 141 GLU H . 50425 1 524 . 1 . 1 141 141 GLU C C 13 178.253 . . 1 . . . . . 141 GLU C . 50425 1 525 . 1 . 1 141 141 GLU CA C 13 62.637 . . 1 . . . . . 141 GLU CA . 50425 1 526 . 1 . 1 141 141 GLU CB C 13 29.745 . . 1 . . . . . 141 GLU CB . 50425 1 527 . 1 . 1 141 141 GLU N N 15 118.574 . . 1 . . . . . 141 GLU N . 50425 1 528 . 1 . 1 142 142 ALA H H 1 7.559 . . 1 . . . . . 142 ALA H . 50425 1 529 . 1 . 1 142 142 ALA C C 13 179.671 . . 1 . . . . . 142 ALA C . 50425 1 530 . 1 . 1 142 142 ALA CA C 13 54.581 . . 1 . . . . . 142 ALA CA . 50425 1 531 . 1 . 1 142 142 ALA CB C 13 18.778 . . 1 . . . . . 142 ALA CB . 50425 1 532 . 1 . 1 142 142 ALA N N 15 121.260 . . 1 . . . . . 142 ALA N . 50425 1 533 . 1 . 1 143 143 ALA H H 1 8.442 . . 1 . . . . . 143 ALA H . 50425 1 534 . 1 . 1 143 143 ALA C C 13 180.438 . . 1 . . . . . 143 ALA C . 50425 1 535 . 1 . 1 143 143 ALA CA C 13 55.602 . . 1 . . . . . 143 ALA CA . 50425 1 536 . 1 . 1 143 143 ALA CB C 13 18.588 . . 1 . . . . . 143 ALA CB . 50425 1 537 . 1 . 1 143 143 ALA N N 15 120.268 . . 1 . . . . . 143 ALA N . 50425 1 538 . 1 . 1 144 144 PHE H H 1 8.775 . . 1 . . . . . 144 PHE H . 50425 1 539 . 1 . 1 144 144 PHE C C 13 179.204 . . 1 . . . . . 144 PHE C . 50425 1 540 . 1 . 1 144 144 PHE CA C 13 60.618 . . 1 . . . . . 144 PHE CA . 50425 1 541 . 1 . 1 144 144 PHE N N 15 115.704 . . 1 . . . . . 144 PHE N . 50425 1 542 . 1 . 1 145 145 GLY H H 1 8.778 . . 1 . . . . . 145 GLY H . 50425 1 543 . 1 . 1 145 145 GLY C C 13 174.646 . . 1 . . . . . 145 GLY C . 50425 1 544 . 1 . 1 145 145 GLY CA C 13 48.455 . . 1 . . . . . 145 GLY CA . 50425 1 545 . 1 . 1 145 145 GLY N N 15 113.664 . . 1 . . . . . 145 GLY N . 50425 1 546 . 1 . 1 146 146 LEU H H 1 7.841 . . 1 . . . . . 146 LEU H . 50425 1 547 . 1 . 1 146 146 LEU C C 13 179.780 . . 1 . . . . . 146 LEU C . 50425 1 548 . 1 . 1 146 146 LEU CA C 13 58.380 . . 1 . . . . . 146 LEU CA . 50425 1 549 . 1 . 1 146 146 LEU N N 15 123.825 . . 1 . . . . . 146 LEU N . 50425 1 550 . 1 . 1 147 147 VAL H H 1 8.412 . . 1 . . . . . 147 VAL H . 50425 1 551 . 1 . 1 147 147 VAL C C 13 178.319 . . 1 . . . . . 147 VAL C . 50425 1 552 . 1 . 1 147 147 VAL CA C 13 67.319 . . 1 . . . . . 147 VAL CA . 50425 1 553 . 1 . 1 147 147 VAL CB C 13 32.600 . . 1 . . . . . 147 VAL CB . 50425 1 554 . 1 . 1 147 147 VAL N N 15 121.506 . . 1 . . . . . 147 VAL N . 50425 1 555 . 1 . 1 148 148 CYS H H 1 8.493 . . 1 . . . . . 148 CYS H . 50425 1 556 . 1 . 1 148 148 CYS C C 13 175.480 . . 1 . . . . . 148 CYS C . 50425 1 557 . 1 . 1 148 148 CYS CA C 13 65.810 . . 1 . . . . . 148 CYS CA . 50425 1 558 . 1 . 1 148 148 CYS CB C 13 26.955 . . 1 . . . . . 148 CYS CB . 50425 1 559 . 1 . 1 148 148 CYS N N 15 118.207 . . 1 . . . . . 148 CYS N . 50425 1 560 . 1 . 1 149 149 ALA H H 1 8.160 . . 1 . . . . . 149 ALA H . 50425 1 561 . 1 . 1 149 149 ALA C C 13 178.163 . . 1 . . . . . 149 ALA C . 50425 1 562 . 1 . 1 149 149 ALA CA C 13 55.524 . . 1 . . . . . 149 ALA CA . 50425 1 563 . 1 . 1 149 149 ALA N N 15 121.803 . . 1 . . . . . 149 ALA N . 50425 1 564 . 1 . 1 150 150 THR H H 1 7.847 . . 1 . . . . . 150 THR H . 50425 1 565 . 1 . 1 150 150 THR C C 13 176.652 . . 1 . . . . . 150 THR C . 50425 1 566 . 1 . 1 150 150 THR CA C 13 68.005 . . 1 . . . . . 150 THR CA . 50425 1 567 . 1 . 1 150 150 THR N N 15 114.118 . . 1 . . . . . 150 THR N . 50425 1 568 . 1 . 1 151 151 CYS H H 1 8.146 . . 1 . . . . . 151 CYS H . 50425 1 569 . 1 . 1 151 151 CYS C C 13 175.825 . . 1 . . . . . 151 CYS C . 50425 1 570 . 1 . 1 151 151 CYS CA C 13 64.547 . . 1 . . . . . 151 CYS CA . 50425 1 571 . 1 . 1 151 151 CYS CB C 13 27.810 . . 1 . . . . . 151 CYS CB . 50425 1 572 . 1 . 1 151 151 CYS N N 15 118.009 . . 1 . . . . . 151 CYS N . 50425 1 573 . 1 . 1 152 152 GLU H H 1 8.479 . . 1 . . . . . 152 GLU H . 50425 1 574 . 1 . 1 152 152 GLU C C 13 178.685 . . 1 . . . . . 152 GLU C . 50425 1 575 . 1 . 1 152 152 GLU CA C 13 60.013 . . 1 . . . . . 152 GLU CA . 50425 1 576 . 1 . 1 152 152 GLU CB C 13 29.712 . . 1 . . . . . 152 GLU CB . 50425 1 577 . 1 . 1 152 152 GLU N N 15 120.900 . . 1 . . . . . 152 GLU N . 50425 1 578 . 1 . 1 153 153 GLN H H 1 7.792 . . 1 . . . . . 153 GLN H . 50425 1 579 . 1 . 1 153 153 GLN C C 13 180.150 . . 1 . . . . . 153 GLN C . 50425 1 580 . 1 . 1 153 153 GLN CA C 13 59.156 . . 1 . . . . . 153 GLN CA . 50425 1 581 . 1 . 1 153 153 GLN CB C 13 29.331 . . 1 . . . . . 153 GLN CB . 50425 1 582 . 1 . 1 153 153 GLN N N 15 117.049 . . 1 . . . . . 153 GLN N . 50425 1 583 . 1 . 1 154 154 ILE H H 1 8.272 . . 1 . . . . . 154 ILE H . 50425 1 584 . 1 . 1 154 154 ILE C C 13 178.776 . . 1 . . . . . 154 ILE C . 50425 1 585 . 1 . 1 154 154 ILE CA C 13 65.609 . . 1 . . . . . 154 ILE CA . 50425 1 586 . 1 . 1 154 154 ILE N N 15 121.662 . . 1 . . . . . 154 ILE N . 50425 1 587 . 1 . 1 155 155 ALA H H 1 8.734 . . 1 . . . . . 155 ALA H . 50425 1 588 . 1 . 1 155 155 ALA C C 13 180.091 . . 1 . . . . . 155 ALA C . 50425 1 589 . 1 . 1 155 155 ALA CA C 13 55.276 . . 1 . . . . . 155 ALA CA . 50425 1 590 . 1 . 1 155 155 ALA CB C 13 18.018 . . 1 . . . . . 155 ALA CB . 50425 1 591 . 1 . 1 155 155 ALA N N 15 123.526 . . 1 . . . . . 155 ALA N . 50425 1 592 . 1 . 1 156 156 ASP H H 1 8.207 . . 1 . . . . . 156 ASP H . 50425 1 593 . 1 . 1 156 156 ASP C C 13 178.337 . . 1 . . . . . 156 ASP C . 50425 1 594 . 1 . 1 156 156 ASP CA C 13 56.909 . . 1 . . . . . 156 ASP CA . 50425 1 595 . 1 . 1 156 156 ASP CB C 13 41.216 . . 1 . . . . . 156 ASP CB . 50425 1 596 . 1 . 1 156 156 ASP N N 15 118.154 . . 1 . . . . . 156 ASP N . 50425 1 597 . 1 . 1 157 157 SER H H 1 8.043 . . 1 . . . . . 157 SER H . 50425 1 598 . 1 . 1 157 157 SER C C 13 176.281 . . 1 . . . . . 157 SER C . 50425 1 599 . 1 . 1 157 157 SER CA C 13 61.243 . . 1 . . . . . 157 SER CA . 50425 1 600 . 1 . 1 157 157 SER CB C 13 64.040 . . 1 . . . . . 157 SER CB . 50425 1 601 . 1 . 1 157 157 SER N N 15 115.247 . . 1 . . . . . 157 SER N . 50425 1 602 . 1 . 1 158 158 GLN H H 1 8.087 . . 1 . . . . . 158 GLN H . 50425 1 603 . 1 . 1 158 158 GLN C C 13 177.296 . . 1 . . . . . 158 GLN C . 50425 1 604 . 1 . 1 158 158 GLN CA C 13 57.527 . . 1 . . . . . 158 GLN CA . 50425 1 605 . 1 . 1 158 158 GLN CB C 13 28.732 . . 1 . . . . . 158 GLN CB . 50425 1 606 . 1 . 1 158 158 GLN N N 15 120.546 . . 1 . . . . . 158 GLN N . 50425 1 607 . 1 . 1 159 159 HIS H H 1 8.096 . . 1 . . . . . 159 HIS H . 50425 1 608 . 1 . 1 159 159 HIS C C 13 175.412 . . 1 . . . . . 159 HIS C . 50425 1 609 . 1 . 1 159 159 HIS CA C 13 56.664 . . 1 . . . . . 159 HIS CA . 50425 1 610 . 1 . 1 159 159 HIS CB C 13 28.951 . . 1 . . . . . 159 HIS CB . 50425 1 611 . 1 . 1 159 159 HIS N N 15 117.244 . . 1 . . . . . 159 HIS N . 50425 1 612 . 1 . 1 160 160 ARG H H 1 8.163 . . 1 . . . . . 160 ARG H . 50425 1 613 . 1 . 1 160 160 ARG C C 13 176.802 . . 1 . . . . . 160 ARG C . 50425 1 614 . 1 . 1 160 160 ARG CA C 13 57.256 . . 1 . . . . . 160 ARG CA . 50425 1 615 . 1 . 1 160 160 ARG CB C 13 30.758 . . 1 . . . . . 160 ARG CB . 50425 1 616 . 1 . 1 160 160 ARG N N 15 120.073 . . 1 . . . . . 160 ARG N . 50425 1 617 . 1 . 1 161 161 SER H H 1 8.226 . . 1 . . . . . 161 SER H . 50425 1 618 . 1 . 1 161 161 SER C C 13 174.665 . . 1 . . . . . 161 SER C . 50425 1 619 . 1 . 1 161 161 SER CA C 13 59.042 . . 1 . . . . . 161 SER CA . 50425 1 620 . 1 . 1 161 161 SER N N 15 115.610 . . 1 . . . . . 161 SER N . 50425 1 621 . 1 . 1 162 162 HIS H H 1 8.380 . . 1 . . . . . 162 HIS H . 50425 1 622 . 1 . 1 162 162 HIS C C 13 174.761 . . 1 . . . . . 162 HIS C . 50425 1 623 . 1 . 1 162 162 HIS CA C 13 56.203 . . 1 . . . . . 162 HIS CA . 50425 1 624 . 1 . 1 162 162 HIS CB C 13 29.331 . . 1 . . . . . 162 HIS CB . 50425 1 625 . 1 . 1 162 162 HIS N N 15 120.344 . . 1 . . . . . 162 HIS N . 50425 1 626 . 1 . 1 163 163 ARG H H 1 8.261 . . 1 . . . . . 163 ARG H . 50425 1 627 . 1 . 1 163 163 ARG C C 13 176.291 . . 1 . . . . . 163 ARG C . 50425 1 628 . 1 . 1 163 163 ARG CA C 13 56.746 . . 1 . . . . . 163 ARG CA . 50425 1 629 . 1 . 1 163 163 ARG CB C 13 31.043 . . 1 . . . . . 163 ARG CB . 50425 1 630 . 1 . 1 163 163 ARG N N 15 121.551 . . 1 . . . . . 163 ARG N . 50425 1 631 . 1 . 1 164 164 GLN H H 1 8.396 . . 1 . . . . . 164 GLN H . 50425 1 632 . 1 . 1 164 164 GLN C C 13 176.017 . . 1 . . . . . 164 GLN C . 50425 1 633 . 1 . 1 164 164 GLN CA C 13 56.460 . . 1 . . . . . 164 GLN CA . 50425 1 634 . 1 . 1 164 164 GLN CB C 13 29.522 . . 1 . . . . . 164 GLN CB . 50425 1 635 . 1 . 1 164 164 GLN N N 15 121.222 . . 1 . . . . . 164 GLN N . 50425 1 636 . 1 . 1 165 165 LEU H H 1 8.201 . . 1 . . . . . 165 LEU H . 50425 1 637 . 1 . 1 165 165 LEU C C 13 177.314 . . 1 . . . . . 165 LEU C . 50425 1 638 . 1 . 1 165 165 LEU CA C 13 55.766 . . 1 . . . . . 165 LEU CA . 50425 1 639 . 1 . 1 165 165 LEU CB C 13 42.547 . . 1 . . . . . 165 LEU CB . 50425 1 640 . 1 . 1 165 165 LEU N N 15 122.960 . . 1 . . . . . 165 LEU N . 50425 1 641 . 1 . 1 166 166 GLU H H 1 8.293 . . 1 . . . . . 166 GLU H . 50425 1 642 . 1 . 1 166 166 GLU C C 13 176.509 . . 1 . . . . . 166 GLU C . 50425 1 643 . 1 . 1 166 166 GLU CA C 13 57.073 . . 1 . . . . . 166 GLU CA . 50425 1 644 . 1 . 1 166 166 GLU CB C 13 30.472 . . 1 . . . . . 166 GLU CB . 50425 1 645 . 1 . 1 166 166 GLU N N 15 121.513 . . 1 . . . . . 166 GLU N . 50425 1 646 . 1 . 1 167 167 VAL H H 1 8.012 . . 1 . . . . . 167 VAL H . 50425 1 647 . 1 . 1 167 167 VAL C C 13 176.005 . . 1 . . . . . 167 VAL C . 50425 1 648 . 1 . 1 167 167 VAL CA C 13 62.791 . . 1 . . . . . 167 VAL CA . 50425 1 649 . 1 . 1 167 167 VAL CB C 13 32.754 . . 1 . . . . . 167 VAL CB . 50425 1 650 . 1 . 1 167 167 VAL N N 15 120.606 . . 1 . . . . . 167 VAL N . 50425 1 651 . 1 . 1 168 168 LEU H H 1 8.087 . . 1 . . . . . 168 LEU H . 50425 1 652 . 1 . 1 168 168 LEU C C 13 176.922 . . 1 . . . . . 168 LEU C . 50425 1 653 . 1 . 1 168 168 LEU CA C 13 55.395 . . 1 . . . . . 168 LEU CA . 50425 1 654 . 1 . 1 168 168 LEU CB C 13 42.737 . . 1 . . . . . 168 LEU CB . 50425 1 655 . 1 . 1 168 168 LEU N N 15 124.782 . . 1 . . . . . 168 LEU N . 50425 1 656 . 1 . 1 169 169 PHE H H 1 8.130 . . 1 . . . . . 169 PHE H . 50425 1 657 . 1 . 1 169 169 PHE C C 13 175.393 . . 1 . . . . . 169 PHE C . 50425 1 658 . 1 . 1 169 169 PHE CA C 13 57.890 . . 1 . . . . . 169 PHE CA . 50425 1 659 . 1 . 1 169 169 PHE CB C 13 39.695 . . 1 . . . . . 169 PHE CB . 50425 1 660 . 1 . 1 169 169 PHE N N 15 120.695 . . 1 . . . . . 169 PHE N . 50425 1 661 . 1 . 1 170 170 GLN H H 1 8.171 . . 1 . . . . . 170 GLN H . 50425 1 662 . 1 . 1 170 170 GLN C C 13 175.699 . . 1 . . . . . 170 GLN C . 50425 1 663 . 1 . 1 170 170 GLN CA C 13 55.643 . . 1 . . . . . 170 GLN CA . 50425 1 664 . 1 . 1 170 170 GLN CB C 13 30.092 . . 1 . . . . . 170 GLN CB . 50425 1 665 . 1 . 1 170 170 GLN N N 15 122.013 . . 1 . . . . . 170 GLN N . 50425 1 666 . 1 . 1 171 171 GLY H H 1 7.883 . . 1 . . . . . 171 GLY H . 50425 1 667 . 1 . 1 171 171 GLY C C 13 171.994 . . 1 . . . . . 171 GLY C . 50425 1 668 . 1 . 1 171 171 GLY CA C 13 44.901 . . 1 . . . . . 171 GLY CA . 50425 1 669 . 1 . 1 171 171 GLY N N 15 109.556 . . 1 . . . . . 171 GLY N . 50425 1 670 . 1 . 1 173 173 GLY H H 1 8.568 . . 1 . . . . . 173 GLY H . 50425 1 671 . 1 . 1 173 173 GLY C C 13 174.350 . . 1 . . . . . 173 GLY C . 50425 1 672 . 1 . 1 173 173 GLY CA C 13 45.480 . . 1 . . . . . 173 GLY CA . 50425 1 673 . 1 . 1 173 173 GLY N N 15 109.415 . . 1 . . . . . 173 GLY N . 50425 1 674 . 1 . 1 174 174 SER H H 1 8.038 . . 1 . . . . . 174 SER H . 50425 1 675 . 1 . 1 174 174 SER C C 13 174.512 . . 1 . . . . . 174 SER C . 50425 1 676 . 1 . 1 174 174 SER CA C 13 58.710 . . 1 . . . . . 174 SER CA . 50425 1 677 . 1 . 1 174 174 SER CB C 13 63.999 . . 1 . . . . . 174 SER CB . 50425 1 678 . 1 . 1 174 174 SER N N 15 115.094 . . 1 . . . . . 174 SER N . 50425 1 stop_ save_