data_30134 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 30134 _Entry.Title ; Recognition and targeting mechanisms by chaperones in flagella assembly and operation ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2016-07-07 _Entry.Accession_date 2016-07-07 _Entry.Last_release_date 2016-08-12 _Entry.Original_release_date 2016-08-12 _Entry.Origination author _Entry.NMR_STAR_version 3.1.2.6 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Details . _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 N. Khanra N. K. . . 30134 2 P. Rossi P. . . . 30134 3 A. Economou A. . . . 30134 4 C. Kalodimos C. G. . . 30134 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID CHAPERONE . 30134 Flagella . 30134 'assembly factors' . 30134 chaperones . 30134 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 30134 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 528 30134 '15N chemical shifts' 139 30134 '1H chemical shifts' 766 30134 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 . . 2017-02-23 2016-07-07 update BMRB 'update entry citation' 30134 1 . . 2016-08-11 2016-07-07 original author 'original release' 30134 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 5KRW 'BMRB Entry Tracking System' 30134 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 30134 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI 10.1073/pnas.1607845113 _Citation.PubMed_ID 27528687 _Citation.Full_citation . _Citation.Title ; Recognition and targeting mechanisms by chaperones in flagellum assembly and operation ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Proc. Natl. Acad. Sci. U. S. A.' _Citation.Journal_name_full . _Citation.Journal_volume 113 _Citation.Journal_issue 35 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1091-6490 _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 9798 _Citation.Page_last 9803 _Citation.Year 2016 _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 N. Khanra N. K. . . 30134 1 2 P. Rossi P. . . . 30134 1 3 A. Economou A. . . . 30134 1 4 C. Kalodimos C. G. . . 30134 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 30134 _Assembly.ID 1 _Assembly.Name 'Flagellar protein FliT,Flagellar hook-associated protein 2' _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 . . . . . . 30134 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 30134 _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 ; MTSTVEFINRWQRIALLSQS LLELAQRGEWDLLLQQEVSY LQSIETVMEKQTPPGITRSI QDMVAGYIKQTLDNEQLLKG LLQQRLDELSSLIGQVLFQG PSAGLVPRGSGGIEGSIDET VARYKAQFTQLDTMMSKLNN TSSYLTQQFTAMNKS ; _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 155 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 17387.732 _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 'Filament cap protein' na 30134 1 'Flagellar cap protein' na 30134 1 HAP2 na 30134 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 . 30134 1 2 . THR . 30134 1 3 . SER . 30134 1 4 . THR . 30134 1 5 . VAL . 30134 1 6 . GLU . 30134 1 7 . PHE . 30134 1 8 . ILE . 30134 1 9 . ASN . 30134 1 10 . ARG . 30134 1 11 . TRP . 30134 1 12 . GLN . 30134 1 13 . ARG . 30134 1 14 . ILE . 30134 1 15 . ALA . 30134 1 16 . LEU . 30134 1 17 . LEU . 30134 1 18 . SER . 30134 1 19 . GLN . 30134 1 20 . SER . 30134 1 21 . LEU . 30134 1 22 . LEU . 30134 1 23 . GLU . 30134 1 24 . LEU . 30134 1 25 . ALA . 30134 1 26 . GLN . 30134 1 27 . ARG . 30134 1 28 . GLY . 30134 1 29 . GLU . 30134 1 30 . TRP . 30134 1 31 . ASP . 30134 1 32 . LEU . 30134 1 33 . LEU . 30134 1 34 . LEU . 30134 1 35 . GLN . 30134 1 36 . GLN . 30134 1 37 . GLU . 30134 1 38 . VAL . 30134 1 39 . SER . 30134 1 40 . TYR . 30134 1 41 . LEU . 30134 1 42 . GLN . 30134 1 43 . SER . 30134 1 44 . ILE . 30134 1 45 . GLU . 30134 1 46 . THR . 30134 1 47 . VAL . 30134 1 48 . MET . 30134 1 49 . GLU . 30134 1 50 . LYS . 30134 1 51 . GLN . 30134 1 52 . THR . 30134 1 53 . PRO . 30134 1 54 . PRO . 30134 1 55 . GLY . 30134 1 56 . ILE . 30134 1 57 . THR . 30134 1 58 . ARG . 30134 1 59 . SER . 30134 1 60 . ILE . 30134 1 61 . GLN . 30134 1 62 . ASP . 30134 1 63 . MET . 30134 1 64 . VAL . 30134 1 65 . ALA . 30134 1 66 . GLY . 30134 1 67 . TYR . 30134 1 68 . ILE . 30134 1 69 . LYS . 30134 1 70 . GLN . 30134 1 71 . THR . 30134 1 72 . LEU . 30134 1 73 . ASP . 30134 1 74 . ASN . 30134 1 75 . GLU . 30134 1 76 . GLN . 30134 1 77 . LEU . 30134 1 78 . LEU . 30134 1 79 . LYS . 30134 1 80 . GLY . 30134 1 81 . LEU . 30134 1 82 . LEU . 30134 1 83 . GLN . 30134 1 84 . GLN . 30134 1 85 . ARG . 30134 1 86 . LEU . 30134 1 87 . ASP . 30134 1 88 . GLU . 30134 1 89 . LEU . 30134 1 90 . SER . 30134 1 91 . SER . 30134 1 92 . LEU . 30134 1 93 . ILE . 30134 1 94 . GLY . 30134 1 95 . GLN . 30134 1 96 . VAL . 30134 1 97 . LEU . 30134 1 98 . PHE . 30134 1 99 . GLN . 30134 1 100 . GLY . 30134 1 101 . PRO . 30134 1 102 . SER . 30134 1 103 . ALA . 30134 1 104 . GLY . 30134 1 105 . LEU . 30134 1 106 . VAL . 30134 1 107 . PRO . 30134 1 108 . ARG . 30134 1 109 . GLY . 30134 1 110 . SER . 30134 1 111 . GLY . 30134 1 112 . GLY . 30134 1 113 . ILE . 30134 1 114 . GLU . 30134 1 115 . GLY . 30134 1 116 . SER . 30134 1 117 . ILE . 30134 1 118 . ASP . 30134 1 119 . GLU . 30134 1 120 . THR . 30134 1 121 . VAL . 30134 1 122 . ALA . 30134 1 123 . ARG . 30134 1 124 . TYR . 30134 1 125 . LYS . 30134 1 126 . ALA . 30134 1 127 . GLN . 30134 1 128 . PHE . 30134 1 129 . THR . 30134 1 130 . GLN . 30134 1 131 . LEU . 30134 1 132 . ASP . 30134 1 133 . THR . 30134 1 134 . MET . 30134 1 135 . MET . 30134 1 136 . SER . 30134 1 137 . LYS . 30134 1 138 . LEU . 30134 1 139 . ASN . 30134 1 140 . ASN . 30134 1 141 . THR . 30134 1 142 . SER . 30134 1 143 . SER . 30134 1 144 . TYR . 30134 1 145 . LEU . 30134 1 146 . THR . 30134 1 147 . GLN . 30134 1 148 . GLN . 30134 1 149 . PHE . 30134 1 150 . THR . 30134 1 151 . ALA . 30134 1 152 . MET . 30134 1 153 . ASN . 30134 1 154 . LYS . 30134 1 155 . SER . 30134 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 30134 1 . THR 2 2 30134 1 . SER 3 3 30134 1 . THR 4 4 30134 1 . VAL 5 5 30134 1 . GLU 6 6 30134 1 . PHE 7 7 30134 1 . ILE 8 8 30134 1 . ASN 9 9 30134 1 . ARG 10 10 30134 1 . TRP 11 11 30134 1 . GLN 12 12 30134 1 . ARG 13 13 30134 1 . ILE 14 14 30134 1 . ALA 15 15 30134 1 . LEU 16 16 30134 1 . LEU 17 17 30134 1 . SER 18 18 30134 1 . GLN 19 19 30134 1 . SER 20 20 30134 1 . LEU 21 21 30134 1 . LEU 22 22 30134 1 . GLU 23 23 30134 1 . LEU 24 24 30134 1 . ALA 25 25 30134 1 . GLN 26 26 30134 1 . ARG 27 27 30134 1 . GLY 28 28 30134 1 . GLU 29 29 30134 1 . TRP 30 30 30134 1 . ASP 31 31 30134 1 . LEU 32 32 30134 1 . LEU 33 33 30134 1 . LEU 34 34 30134 1 . GLN 35 35 30134 1 . GLN 36 36 30134 1 . GLU 37 37 30134 1 . VAL 38 38 30134 1 . SER 39 39 30134 1 . TYR 40 40 30134 1 . LEU 41 41 30134 1 . GLN 42 42 30134 1 . SER 43 43 30134 1 . ILE 44 44 30134 1 . GLU 45 45 30134 1 . THR 46 46 30134 1 . VAL 47 47 30134 1 . MET 48 48 30134 1 . GLU 49 49 30134 1 . LYS 50 50 30134 1 . GLN 51 51 30134 1 . THR 52 52 30134 1 . PRO 53 53 30134 1 . PRO 54 54 30134 1 . GLY 55 55 30134 1 . ILE 56 56 30134 1 . THR 57 57 30134 1 . ARG 58 58 30134 1 . SER 59 59 30134 1 . ILE 60 60 30134 1 . GLN 61 61 30134 1 . ASP 62 62 30134 1 . MET 63 63 30134 1 . VAL 64 64 30134 1 . ALA 65 65 30134 1 . GLY 66 66 30134 1 . TYR 67 67 30134 1 . ILE 68 68 30134 1 . LYS 69 69 30134 1 . GLN 70 70 30134 1 . THR 71 71 30134 1 . LEU 72 72 30134 1 . ASP 73 73 30134 1 . ASN 74 74 30134 1 . GLU 75 75 30134 1 . GLN 76 76 30134 1 . LEU 77 77 30134 1 . LEU 78 78 30134 1 . LYS 79 79 30134 1 . GLY 80 80 30134 1 . LEU 81 81 30134 1 . LEU 82 82 30134 1 . GLN 83 83 30134 1 . GLN 84 84 30134 1 . ARG 85 85 30134 1 . LEU 86 86 30134 1 . ASP 87 87 30134 1 . GLU 88 88 30134 1 . LEU 89 89 30134 1 . SER 90 90 30134 1 . SER 91 91 30134 1 . LEU 92 92 30134 1 . ILE 93 93 30134 1 . GLY 94 94 30134 1 . GLN 95 95 30134 1 . VAL 96 96 30134 1 . LEU 97 97 30134 1 . PHE 98 98 30134 1 . GLN 99 99 30134 1 . GLY 100 100 30134 1 . PRO 101 101 30134 1 . SER 102 102 30134 1 . ALA 103 103 30134 1 . GLY 104 104 30134 1 . LEU 105 105 30134 1 . VAL 106 106 30134 1 . PRO 107 107 30134 1 . ARG 108 108 30134 1 . GLY 109 109 30134 1 . SER 110 110 30134 1 . GLY 111 111 30134 1 . GLY 112 112 30134 1 . ILE 113 113 30134 1 . GLU 114 114 30134 1 . GLY 115 115 30134 1 . SER 116 116 30134 1 . ILE 117 117 30134 1 . ASP 118 118 30134 1 . GLU 119 119 30134 1 . THR 120 120 30134 1 . VAL 121 121 30134 1 . ALA 122 122 30134 1 . ARG 123 123 30134 1 . TYR 124 124 30134 1 . LYS 125 125 30134 1 . ALA 126 126 30134 1 . GLN 127 127 30134 1 . PHE 128 128 30134 1 . THR 129 129 30134 1 . GLN 130 130 30134 1 . LEU 131 131 30134 1 . ASP 132 132 30134 1 . THR 133 133 30134 1 . MET 134 134 30134 1 . MET 135 135 30134 1 . SER 136 136 30134 1 . LYS 137 137 30134 1 . LEU 138 138 30134 1 . ASN 139 139 30134 1 . ASN 140 140 30134 1 . THR 141 141 30134 1 . SER 142 142 30134 1 . SER 143 143 30134 1 . TYR 144 144 30134 1 . LEU 145 145 30134 1 . THR 146 146 30134 1 . GLN 147 147 30134 1 . GLN 148 148 30134 1 . PHE 149 149 30134 1 . THR 150 150 30134 1 . ALA 151 151 30134 1 . MET 152 152 30134 1 . ASN 153 153 30134 1 . LYS 154 154 30134 1 . SER 155 155 30134 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 30134 _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 . 99287 organism . 'Salmonella typhimurium (strain LT2 / SGSC1412 / ATCC 700720)' 'Salmonella enterica' . . Bacteria . Salmonella typhimurium 'LT2 / SGSC1412 / ATCC 700720' . . . . . . . . . . 'fliT, STM1962' . 30134 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 30134 _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 BL21(DE3)' . . 469008 . . . . . . . . . . . . 30134 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 30134 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 1 mM [U-99% 13C; U-99% 15N; U-99% 2H] FliT-FliD_fusion, 20 mM potassium phosphate, 100 mM potassium chloride, 0.5 mM EDTA, 5 mM beta-mercaptoethanol, 0.05 % sodium azide, 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 EDTA 'natural abundance' . . . . . . 0.5 . . mM . . . . 30134 1 2 FliT-FliD_fusion '[U-99% 13C; U-99% 15N; U-99% 2H]' . . 1 $entity_1 . . 1 . . mM . . . . 30134 1 3 beta-mercaptoethanol 'natural abundance' . . . . . . 5 . . mM . . . . 30134 1 4 'potassium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 30134 1 5 'potassium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 30134 1 6 'sodium azide' 'natural abundance' . . . . . . 0.05 . . % . . . . 30134 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 30134 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 1 mM U[15N,2H] 1H-13C-ILVMAT-methyl FliT-FliD_fusion, 20 mM potassium phosphate, 100 mM potassium chloride, 0.5 mM EDTA, 5 mM beta-mercaptoethanol, 0.05 % sodium azide, 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 EDTA 'natural abundance' . . . . . . 0.5 . . mM . . . . 30134 2 2 FliT-FliD_fusion 'U[15N,2H] 1H-13C-ILVMAT-methyl' . . 1 $entity_1 . . 1 . . mM . . . . 30134 2 3 beta-mercaptoethanol 'natural abundance' . . . . . . 5 . . mM . . . . 30134 2 4 'potassium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 30134 2 5 'potassium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 30134 2 6 'sodium azide' 'natural abundance' . . . . . . 0.05 . . % . . . . 30134 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 30134 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 1 mM [U-99% 13C; U-99% 15N] FliT-FliD_fusion, 20 mM potassium phosphate, 100 mM potassium chloride, 0.5 mM EDTA, 5 mM beta-mercaptoethanol, 0.05 % sodium azide, 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 EDTA 'natural abundance' . . . . . . 0.5 . . mM . . . . 30134 3 2 FliT-FliD_fusion '[U-99% 13C; U-99% 15N]' . . 1 $entity_1 . . 1 . . mM . . . . 30134 3 3 beta-mercaptoethanol 'natural abundance' . . . . . . 5 . . mM . . . . 30134 3 4 'potassium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 30134 3 5 'potassium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 30134 3 6 'sodium azide' 'natural abundance' . . . . . . 0.05 . . % . . . . 30134 3 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 30134 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 120 . mM 30134 1 pH 7.0 . pH 30134 1 pressure 1 . atm 30134 1 temperature 305 . K 30134 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 30134 _Software.ID 1 _Software.Name CNS _Software.Version 1.3 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Brunger, Adams, Clore, Gros, Nilges and Read' . . 30134 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 30134 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 30134 _Software.ID 2 _Software.Name CYANA _Software.Version 3.97 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 30134 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure calculation' 30134 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 30134 _Software.ID 3 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 30134 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 30134 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 30134 _Software.ID 4 _Software.Name NMRView _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . 30134 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 30134 4 stop_ save_ save_software_5 _Software.Sf_category software _Software.Sf_framecode software_5 _Software.Entry_ID 30134 _Software.ID 5 _Software.Name PINE _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bahrami, Markley, Assadi, and Eghbalnia' . . 30134 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 30134 5 stop_ save_ save_software_6 _Software.Sf_category software _Software.Sf_framecode software_6 _Software.Entry_ID 30134 _Software.ID 6 _Software.Name PSVS _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bhattacharya and Montelione' . . 30134 6 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 30134 6 stop_ save_ save_software_7 _Software.Sf_category software _Software.Sf_framecode software_7 _Software.Entry_ID 30134 _Software.ID 7 _Software.Name SPARKY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 30134 7 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 30134 7 stop_ save_ save_software_8 _Software.Sf_category software _Software.Sf_framecode software_8 _Software.Entry_ID 30134 _Software.ID 8 _Software.Name TALOS _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Cornilescu, Delaglio and Bax' . . 30134 8 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'geometry optimization' 30134 8 stop_ save_ save_software_9 _Software.Sf_category software _Software.Sf_framecode software_9 _Software.Entry_ID 30134 _Software.ID 9 _Software.Name TOPSPIN _Software.Version 3.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 30134 9 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 30134 9 stop_ save_ save_software_10 _Software.Sf_category software _Software.Sf_framecode software_10 _Software.Entry_ID 30134 _Software.ID 10 _Software.Name pdbstat _Software.Version 1.5 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'tejero and montelione' . . 30134 10 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 30134 10 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 30134 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AvanceIII _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 30134 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AvanceIII _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 850 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 30134 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer_1 Bruker AvanceIII . 700 . . . 30134 1 2 NMR_spectrometer_2 Bruker AvanceIII . 850 . . . 30134 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 30134 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30134 1 2 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30134 1 3 '3D 1H-15N NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 30134 1 4 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 30134 1 5 '2D 1H-13C HSQC' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30134 1 6 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30134 1 7 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 30134 1 8 '3D 1H-13C NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 30134 1 9 '2D 1H-15N HSQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 30134 1 10 '3D HCCH-TOCSY' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30134 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 30134 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.25144953 . . . . . 30134 1 H 1 DSS 'methyl protons' . . . . ppm 0.000 internal direct 1.0 . . . . . 30134 1 N 15 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.10132912 . . . . . 30134 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 30134 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $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 HNCO' . . . 30134 1 2 '3D HNCACB' . . . 30134 1 4 '2D 1H-13C HSQC aromatic' . . . 30134 1 9 '2D 1H-15N HSQC' . . . 30134 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 7 $software_7 . . 30134 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 MET HE1 H 1 2.171 0.000 . 1 . . . A 1 MET HE1 . 30134 1 2 . 1 1 1 1 MET HE2 H 1 2.171 0.000 . 1 . . . A 1 MET HE2 . 30134 1 3 . 1 1 1 1 MET HE3 H 1 2.171 0.000 . 1 . . . A 1 MET HE3 . 30134 1 4 . 1 1 1 1 MET CE C 13 17.057 0.000 . 1 . . . A 1 MET CE . 30134 1 5 . 1 1 3 3 SER H H 1 7.925 0.000 . 1 . . . A 3 SER H . 30134 1 6 . 1 1 3 3 SER N N 15 122.937 0.000 . 1 . . . A 3 SER N . 30134 1 7 . 1 1 4 4 THR HA H 1 4.314 0.000 . 1 . . . A 4 THR HA . 30134 1 8 . 1 1 4 4 THR HB H 1 3.894 0.000 . 1 . . . A 4 THR HB . 30134 1 9 . 1 1 4 4 THR HG21 H 1 1.349 0.000 . 1 . . . A 4 THR HG21 . 30134 1 10 . 1 1 4 4 THR HG22 H 1 1.349 0.000 . 1 . . . A 4 THR HG22 . 30134 1 11 . 1 1 4 4 THR HG23 H 1 1.349 0.000 . 1 . . . A 4 THR HG23 . 30134 1 12 . 1 1 4 4 THR C C 13 174.679 0.000 . 1 . . . A 4 THR C . 30134 1 13 . 1 1 4 4 THR CA C 13 67.140 0.045 . 1 . . . A 4 THR CA . 30134 1 14 . 1 1 4 4 THR CB C 13 68.500 0.000 . 1 . . . A 4 THR CB . 30134 1 15 . 1 1 4 4 THR CG2 C 13 22.968 0.000 . 1 . . . A 4 THR CG2 . 30134 1 16 . 1 1 5 5 VAL H H 1 7.829 0.000 . 1 . . . A 5 VAL H . 30134 1 17 . 1 1 5 5 VAL HA H 1 3.660 0.009 . 1 . . . A 5 VAL HA . 30134 1 18 . 1 1 5 5 VAL HB H 1 2.164 0.008 . 1 . . . A 5 VAL HB . 30134 1 19 . 1 1 5 5 VAL HG11 H 1 1.150 0.025 . 2 . . . A 5 VAL HG11 . 30134 1 20 . 1 1 5 5 VAL HG12 H 1 1.150 0.025 . 2 . . . A 5 VAL HG12 . 30134 1 21 . 1 1 5 5 VAL HG13 H 1 1.150 0.025 . 2 . . . A 5 VAL HG13 . 30134 1 22 . 1 1 5 5 VAL HG21 H 1 1.056 0.017 . 2 . . . A 5 VAL HG21 . 30134 1 23 . 1 1 5 5 VAL HG22 H 1 1.056 0.017 . 2 . . . A 5 VAL HG22 . 30134 1 24 . 1 1 5 5 VAL HG23 H 1 1.056 0.017 . 2 . . . A 5 VAL HG23 . 30134 1 25 . 1 1 5 5 VAL C C 13 176.889 0.009 . 1 . . . A 5 VAL C . 30134 1 26 . 1 1 5 5 VAL CA C 13 66.809 0.036 . 1 . . . A 5 VAL CA . 30134 1 27 . 1 1 5 5 VAL CB C 13 31.585 0.083 . 1 . . . A 5 VAL CB . 30134 1 28 . 1 1 5 5 VAL CG1 C 13 23.348 0.250 . 1 . . . A 5 VAL CG1 . 30134 1 29 . 1 1 5 5 VAL CG2 C 13 21.575 0.215 . 1 . . . A 5 VAL CG2 . 30134 1 30 . 1 1 5 5 VAL N N 15 121.364 0.000 . 1 . . . A 5 VAL N . 30134 1 31 . 1 1 6 6 GLU H H 1 8.100 0.000 . 1 . . . A 6 GLU H . 30134 1 32 . 1 1 6 6 GLU HA H 1 3.964 0.000 . 1 . . . A 6 GLU HA . 30134 1 33 . 1 1 6 6 GLU HB2 H 1 2.104 0.000 . 2 . . . A 6 GLU HB2 . 30134 1 34 . 1 1 6 6 GLU HB3 H 1 2.104 0.000 . 2 . . . A 6 GLU HB3 . 30134 1 35 . 1 1 6 6 GLU C C 13 177.356 0.035 . 1 . . . A 6 GLU C . 30134 1 36 . 1 1 6 6 GLU CA C 13 59.793 0.047 . 1 . . . A 6 GLU CA . 30134 1 37 . 1 1 6 6 GLU CB C 13 29.432 0.045 . 1 . . . A 6 GLU CB . 30134 1 38 . 1 1 6 6 GLU N N 15 119.977 0.000 . 1 . . . A 6 GLU N . 30134 1 39 . 1 1 7 7 PHE H H 1 7.870 0.003 . 1 . . . A 7 PHE H . 30134 1 40 . 1 1 7 7 PHE HA H 1 4.384 0.000 . 1 . . . A 7 PHE HA . 30134 1 41 . 1 1 7 7 PHE HB2 H 1 3.438 0.014 . 2 . . . A 7 PHE HB2 . 30134 1 42 . 1 1 7 7 PHE HB3 H 1 3.444 0.021 . 2 . . . A 7 PHE HB3 . 30134 1 43 . 1 1 7 7 PHE HD1 H 1 7.454 0.000 . 1 . . . A 7 PHE HD1 . 30134 1 44 . 1 1 7 7 PHE HE1 H 1 7.590 0.000 . 1 . . . A 7 PHE HE1 . 30134 1 45 . 1 1 7 7 PHE HZ H 1 7.582 0.000 . 1 . . . A 7 PHE HZ . 30134 1 46 . 1 1 7 7 PHE C C 13 175.850 0.009 . 1 . . . A 7 PHE C . 30134 1 47 . 1 1 7 7 PHE CA C 13 61.458 0.043 . 1 . . . A 7 PHE CA . 30134 1 48 . 1 1 7 7 PHE CB C 13 40.120 0.083 . 1 . . . A 7 PHE CB . 30134 1 49 . 1 1 7 7 PHE CD1 C 13 132.595 0.000 . 1 . . . A 7 PHE CD1 . 30134 1 50 . 1 1 7 7 PHE CE1 C 13 131.859 0.000 . 1 . . . A 7 PHE CE1 . 30134 1 51 . 1 1 7 7 PHE CZ C 13 130.536 0.000 . 1 . . . A 7 PHE CZ . 30134 1 52 . 1 1 7 7 PHE N N 15 120.161 0.000 . 1 . . . A 7 PHE N . 30134 1 53 . 1 1 8 8 ILE H H 1 8.195 0.004 . 1 . . . A 8 ILE H . 30134 1 54 . 1 1 8 8 ILE HA H 1 3.614 0.007 . 1 . . . A 8 ILE HA . 30134 1 55 . 1 1 8 8 ILE HB H 1 2.057 0.007 . 1 . . . A 8 ILE HB . 30134 1 56 . 1 1 8 8 ILE HG12 H 1 2.090 0.000 . 2 . . . A 8 ILE HG12 . 30134 1 57 . 1 1 8 8 ILE HG13 H 1 2.106 0.002 . 2 . . . A 8 ILE HG13 . 30134 1 58 . 1 1 8 8 ILE HG21 H 1 1.135 0.002 . 1 . . . A 8 ILE HG21 . 30134 1 59 . 1 1 8 8 ILE HG22 H 1 1.135 0.002 . 1 . . . A 8 ILE HG22 . 30134 1 60 . 1 1 8 8 ILE HG23 H 1 1.135 0.002 . 1 . . . A 8 ILE HG23 . 30134 1 61 . 1 1 8 8 ILE HD11 H 1 1.073 0.003 . 1 . . . A 8 ILE HD11 . 30134 1 62 . 1 1 8 8 ILE HD12 H 1 1.073 0.003 . 1 . . . A 8 ILE HD12 . 30134 1 63 . 1 1 8 8 ILE HD13 H 1 1.073 0.003 . 1 . . . A 8 ILE HD13 . 30134 1 64 . 1 1 8 8 ILE C C 13 176.982 0.020 . 1 . . . A 8 ILE C . 30134 1 65 . 1 1 8 8 ILE CA C 13 65.977 0.144 . 1 . . . A 8 ILE CA . 30134 1 66 . 1 1 8 8 ILE CB C 13 38.627 0.174 . 1 . . . A 8 ILE CB . 30134 1 67 . 1 1 8 8 ILE CG1 C 13 29.027 0.035 . 1 . . . A 8 ILE CG1 . 30134 1 68 . 1 1 8 8 ILE CG2 C 13 18.199 0.041 . 1 . . . A 8 ILE CG2 . 30134 1 69 . 1 1 8 8 ILE CD1 C 13 14.718 0.039 . 1 . . . A 8 ILE CD1 . 30134 1 70 . 1 1 8 8 ILE N N 15 117.877 0.000 . 1 . . . A 8 ILE N . 30134 1 71 . 1 1 9 9 ASN H H 1 8.473 0.000 . 1 . . . A 9 ASN H . 30134 1 72 . 1 1 9 9 ASN HB2 H 1 2.781 0.238 . 1 . . . A 9 ASN HB2 . 30134 1 73 . 1 1 9 9 ASN HB3 H 1 2.781 0.116 . 1 . . . A 9 ASN HB3 . 30134 1 74 . 1 1 9 9 ASN C C 13 177.470 0.044 . 1 . . . A 9 ASN C . 30134 1 75 . 1 1 9 9 ASN CA C 13 56.409 0.093 . 1 . . . A 9 ASN CA . 30134 1 76 . 1 1 9 9 ASN CB C 13 38.365 0.048 . 1 . . . A 9 ASN CB . 30134 1 77 . 1 1 9 9 ASN N N 15 117.531 0.000 . 1 . . . A 9 ASN N . 30134 1 78 . 1 1 10 10 ARG H H 1 8.372 0.000 . 1 . . . A 10 ARG H . 30134 1 79 . 1 1 10 10 ARG HA H 1 3.910 0.000 . 1 . . . A 10 ARG HA . 30134 1 80 . 1 1 10 10 ARG C C 13 178.377 0.000 . 1 . . . A 10 ARG C . 30134 1 81 . 1 1 10 10 ARG CA C 13 59.962 0.124 . 1 . . . A 10 ARG CA . 30134 1 82 . 1 1 10 10 ARG CB C 13 29.414 0.041 . 1 . . . A 10 ARG CB . 30134 1 83 . 1 1 10 10 ARG N N 15 119.787 0.000 . 1 . . . A 10 ARG N . 30134 1 84 . 1 1 11 11 TRP H H 1 7.282 0.000 . 1 . . . A 11 TRP H . 30134 1 85 . 1 1 11 11 TRP HA H 1 4.447 0.000 . 1 . . . A 11 TRP HA . 30134 1 86 . 1 1 11 11 TRP HB2 H 1 3.298 0.238 . 2 . . . A 11 TRP HB2 . 30134 1 87 . 1 1 11 11 TRP HB3 H 1 3.420 0.116 . 2 . . . A 11 TRP HB3 . 30134 1 88 . 1 1 11 11 TRP HD1 H 1 6.140 0.001 . 1 . . . A 11 TRP HD1 . 30134 1 89 . 1 1 11 11 TRP HE1 H 1 9.171 0.008 . 1 . . . A 11 TRP HE1 . 30134 1 90 . 1 1 11 11 TRP HE3 H 1 7.553 0.000 . 1 . . . A 11 TRP HE3 . 30134 1 91 . 1 1 11 11 TRP HZ2 H 1 7.564 0.005 . 1 . . . A 11 TRP HZ2 . 30134 1 92 . 1 1 11 11 TRP HZ3 H 1 6.989 0.000 . 1 . . . A 11 TRP HZ3 . 30134 1 93 . 1 1 11 11 TRP HH2 H 1 7.075 0.000 . 1 . . . A 11 TRP HH2 . 30134 1 94 . 1 1 11 11 TRP C C 13 177.100 0.009 . 1 . . . A 11 TRP C . 30134 1 95 . 1 1 11 11 TRP CA C 13 60.924 0.061 . 1 . . . A 11 TRP CA . 30134 1 96 . 1 1 11 11 TRP CB C 13 29.933 0.139 . 1 . . . A 11 TRP CB . 30134 1 97 . 1 1 11 11 TRP CD1 C 13 126.692 0.000 . 1 . . . A 11 TRP CD1 . 30134 1 98 . 1 1 11 11 TRP CE3 C 13 120.719 0.000 . 1 . . . A 11 TRP CE3 . 30134 1 99 . 1 1 11 11 TRP CZ2 C 13 114.952 0.000 . 1 . . . A 11 TRP CZ2 . 30134 1 100 . 1 1 11 11 TRP CZ3 C 13 121.793 0.000 . 1 . . . A 11 TRP CZ3 . 30134 1 101 . 1 1 11 11 TRP CH2 C 13 123.547 0.000 . 1 . . . A 11 TRP CH2 . 30134 1 102 . 1 1 11 11 TRP N N 15 119.454 0.000 . 1 . . . A 11 TRP N . 30134 1 103 . 1 1 11 11 TRP NE1 N 15 126.003 0.000 . 1 . . . A 11 TRP NE1 . 30134 1 104 . 1 1 12 12 GLN H H 1 8.529 0.000 . 1 . . . A 12 GLN H . 30134 1 105 . 1 1 12 12 GLN C C 13 177.320 0.000 . 1 . . . A 12 GLN C . 30134 1 106 . 1 1 12 12 GLN CA C 13 59.231 0.056 . 1 . . . A 12 GLN CA . 30134 1 107 . 1 1 12 12 GLN CB C 13 28.380 0.093 . 1 . . . A 12 GLN CB . 30134 1 108 . 1 1 12 12 GLN N N 15 121.039 0.000 . 1 . . . A 12 GLN N . 30134 1 109 . 1 1 13 13 ARG H H 1 7.899 0.000 . 1 . . . A 13 ARG H . 30134 1 110 . 1 1 13 13 ARG HA H 1 3.964 0.000 . 1 . . . A 13 ARG HA . 30134 1 111 . 1 1 13 13 ARG C C 13 177.549 0.000 . 1 . . . A 13 ARG C . 30134 1 112 . 1 1 13 13 ARG CA C 13 59.476 0.093 . 1 . . . A 13 ARG CA . 30134 1 113 . 1 1 13 13 ARG CB C 13 29.247 0.033 . 1 . . . A 13 ARG CB . 30134 1 114 . 1 1 13 13 ARG N N 15 118.269 0.000 . 1 . . . A 13 ARG N . 30134 1 115 . 1 1 14 14 ILE H H 1 7.517 0.000 . 1 . . . A 14 ILE H . 30134 1 116 . 1 1 14 14 ILE HA H 1 3.659 0.000 . 1 . . . A 14 ILE HA . 30134 1 117 . 1 1 14 14 ILE HB H 1 1.995 0.012 . 1 . . . A 14 ILE HB . 30134 1 118 . 1 1 14 14 ILE HG12 H 1 0.804 0.006 . 2 . . . A 14 ILE HG12 . 30134 1 119 . 1 1 14 14 ILE HG13 H 1 1.536 0.002 . 2 . . . A 14 ILE HG13 . 30134 1 120 . 1 1 14 14 ILE HG21 H 1 1.209 0.005 . 1 . . . A 14 ILE HG21 . 30134 1 121 . 1 1 14 14 ILE HG22 H 1 1.209 0.005 . 1 . . . A 14 ILE HG22 . 30134 1 122 . 1 1 14 14 ILE HG23 H 1 1.209 0.005 . 1 . . . A 14 ILE HG23 . 30134 1 123 . 1 1 14 14 ILE HD11 H 1 0.112 0.007 . 1 . . . A 14 ILE HD11 . 30134 1 124 . 1 1 14 14 ILE HD12 H 1 0.112 0.007 . 1 . . . A 14 ILE HD12 . 30134 1 125 . 1 1 14 14 ILE HD13 H 1 0.112 0.007 . 1 . . . A 14 ILE HD13 . 30134 1 126 . 1 1 14 14 ILE CA C 13 66.320 0.109 . 1 . . . A 14 ILE CA . 30134 1 127 . 1 1 14 14 ILE CB C 13 38.488 0.117 . 1 . . . A 14 ILE CB . 30134 1 128 . 1 1 14 14 ILE CG1 C 13 30.173 0.057 . 1 . . . A 14 ILE CG1 . 30134 1 129 . 1 1 14 14 ILE CG2 C 13 18.315 0.060 . 1 . . . A 14 ILE CG2 . 30134 1 130 . 1 1 14 14 ILE CD1 C 13 14.210 0.077 . 1 . . . A 14 ILE CD1 . 30134 1 131 . 1 1 14 14 ILE N N 15 120.885 0.000 . 1 . . . A 14 ILE N . 30134 1 132 . 1 1 15 15 ALA H H 1 8.850 0.000 . 1 . . . A 15 ALA H . 30134 1 133 . 1 1 15 15 ALA HB1 H 1 1.606 0.000 . 1 . . . A 15 ALA HB1 . 30134 1 134 . 1 1 15 15 ALA HB2 H 1 1.606 0.000 . 1 . . . A 15 ALA HB2 . 30134 1 135 . 1 1 15 15 ALA HB3 H 1 1.606 0.000 . 1 . . . A 15 ALA HB3 . 30134 1 136 . 1 1 15 15 ALA CB C 13 17.773 0.000 . 1 . . . A 15 ALA CB . 30134 1 137 . 1 1 15 15 ALA N N 15 122.579 0.000 . 1 . . . A 15 ALA N . 30134 1 138 . 1 1 16 16 LEU H H 1 8.259 0.000 . 1 . . . A 16 LEU H . 30134 1 139 . 1 1 16 16 LEU HD11 H 1 0.875 0.000 . 2 . . . A 16 LEU HD11 . 30134 1 140 . 1 1 16 16 LEU HD12 H 1 0.875 0.000 . 2 . . . A 16 LEU HD12 . 30134 1 141 . 1 1 16 16 LEU HD13 H 1 0.875 0.000 . 2 . . . A 16 LEU HD13 . 30134 1 142 . 1 1 16 16 LEU HD21 H 1 0.888 0.000 . 2 . . . A 16 LEU HD21 . 30134 1 143 . 1 1 16 16 LEU HD22 H 1 0.888 0.000 . 2 . . . A 16 LEU HD22 . 30134 1 144 . 1 1 16 16 LEU HD23 H 1 0.888 0.000 . 2 . . . A 16 LEU HD23 . 30134 1 145 . 1 1 16 16 LEU CD1 C 13 25.200 0.000 . 1 . . . A 16 LEU CD1 . 30134 1 146 . 1 1 16 16 LEU CD2 C 13 23.468 0.000 . 1 . . . A 16 LEU CD2 . 30134 1 147 . 1 1 16 16 LEU N N 15 120.667 0.000 . 1 . . . A 16 LEU N . 30134 1 148 . 1 1 18 18 SER H H 1 9.017 0.000 . 1 . . . A 18 SER H . 30134 1 149 . 1 1 18 18 SER HA H 1 4.314 0.000 . 1 . . . A 18 SER HA . 30134 1 150 . 1 1 18 18 SER HB2 H 1 3.840 0.000 . 2 . . . A 18 SER HB2 . 30134 1 151 . 1 1 18 18 SER HB3 H 1 3.840 0.000 . 2 . . . A 18 SER HB3 . 30134 1 152 . 1 1 18 18 SER C C 13 174.943 0.000 . 1 . . . A 18 SER C . 30134 1 153 . 1 1 18 18 SER CA C 13 63.139 0.044 . 1 . . . A 18 SER CA . 30134 1 154 . 1 1 18 18 SER N N 15 116.706 0.000 . 1 . . . A 18 SER N . 30134 1 155 . 1 1 19 19 GLN H H 1 7.532 0.000 . 1 . . . A 19 GLN H . 30134 1 156 . 1 1 19 19 GLN HA H 1 3.886 0.000 . 1 . . . A 19 GLN HA . 30134 1 157 . 1 1 19 19 GLN HB2 H 1 2.174 0.000 . 2 . . . A 19 GLN HB2 . 30134 1 158 . 1 1 19 19 GLN HB3 H 1 2.174 0.000 . 2 . . . A 19 GLN HB3 . 30134 1 159 . 1 1 19 19 GLN C C 13 176.722 0.000 . 1 . . . A 19 GLN C . 30134 1 160 . 1 1 19 19 GLN CA C 13 58.977 0.064 . 1 . . . A 19 GLN CA . 30134 1 161 . 1 1 19 19 GLN CB C 13 28.167 0.087 . 1 . . . A 19 GLN CB . 30134 1 162 . 1 1 19 19 GLN N N 15 123.795 0.000 . 1 . . . A 19 GLN N . 30134 1 163 . 1 1 20 20 SER H H 1 7.989 0.000 . 1 . . . A 20 SER H . 30134 1 164 . 1 1 20 20 SER HA H 1 4.260 0.000 . 1 . . . A 20 SER HA . 30134 1 165 . 1 1 20 20 SER HB2 H 1 4.042 0.000 . 2 . . . A 20 SER HB2 . 30134 1 166 . 1 1 20 20 SER HB3 H 1 4.042 0.000 . 2 . . . A 20 SER HB3 . 30134 1 167 . 1 1 20 20 SER C C 13 175.859 0.000 . 1 . . . A 20 SER C . 30134 1 168 . 1 1 20 20 SER CA C 13 61.704 0.192 . 1 . . . A 20 SER CA . 30134 1 169 . 1 1 20 20 SER CB C 13 62.751 0.021 . 1 . . . A 20 SER CB . 30134 1 170 . 1 1 20 20 SER N N 15 115.841 0.000 . 1 . . . A 20 SER N . 30134 1 171 . 1 1 21 21 LEU H H 1 8.203 0.000 . 1 . . . A 21 LEU H . 30134 1 172 . 1 1 21 21 LEU HA H 1 4.244 0.000 . 1 . . . A 21 LEU HA . 30134 1 173 . 1 1 21 21 LEU HB2 H 1 2.096 0.000 . 2 . . . A 21 LEU HB2 . 30134 1 174 . 1 1 21 21 LEU HB3 H 1 2.096 0.000 . 2 . . . A 21 LEU HB3 . 30134 1 175 . 1 1 21 21 LEU HD11 H 1 0.332 0.000 . 2 . . . A 21 LEU HD11 . 30134 1 176 . 1 1 21 21 LEU HD12 H 1 0.332 0.000 . 2 . . . A 21 LEU HD12 . 30134 1 177 . 1 1 21 21 LEU HD13 H 1 0.332 0.000 . 2 . . . A 21 LEU HD13 . 30134 1 178 . 1 1 21 21 LEU HD21 H 1 0.594 0.000 . 2 . . . A 21 LEU HD21 . 30134 1 179 . 1 1 21 21 LEU HD22 H 1 0.594 0.000 . 2 . . . A 21 LEU HD22 . 30134 1 180 . 1 1 21 21 LEU HD23 H 1 0.594 0.000 . 2 . . . A 21 LEU HD23 . 30134 1 181 . 1 1 21 21 LEU C C 13 177.039 0.000 . 1 . . . A 21 LEU C . 30134 1 182 . 1 1 21 21 LEU CA C 13 58.512 0.099 . 1 . . . A 21 LEU CA . 30134 1 183 . 1 1 21 21 LEU CB C 13 41.374 0.045 . 1 . . . A 21 LEU CB . 30134 1 184 . 1 1 21 21 LEU CD1 C 13 25.045 0.000 . 1 . . . A 21 LEU CD1 . 30134 1 185 . 1 1 21 21 LEU CD2 C 13 23.932 0.000 . 1 . . . A 21 LEU CD2 . 30134 1 186 . 1 1 21 21 LEU N N 15 119.631 0.000 . 1 . . . A 21 LEU N . 30134 1 187 . 1 1 22 22 LEU H H 1 7.543 0.003 . 1 . . . A 22 LEU H . 30134 1 188 . 1 1 22 22 LEU HD11 H 1 0.927 0.000 . 2 . . . A 22 LEU HD11 . 30134 1 189 . 1 1 22 22 LEU HD12 H 1 0.927 0.000 . 2 . . . A 22 LEU HD12 . 30134 1 190 . 1 1 22 22 LEU HD13 H 1 0.927 0.000 . 2 . . . A 22 LEU HD13 . 30134 1 191 . 1 1 22 22 LEU HD21 H 1 0.896 0.000 . 2 . . . A 22 LEU HD21 . 30134 1 192 . 1 1 22 22 LEU HD22 H 1 0.896 0.000 . 2 . . . A 22 LEU HD22 . 30134 1 193 . 1 1 22 22 LEU HD23 H 1 0.896 0.000 . 2 . . . A 22 LEU HD23 . 30134 1 194 . 1 1 22 22 LEU C C 13 177.144 0.000 . 1 . . . A 22 LEU C . 30134 1 195 . 1 1 22 22 LEU CA C 13 58.608 0.062 . 1 . . . A 22 LEU CA . 30134 1 196 . 1 1 22 22 LEU CB C 13 41.329 0.033 . 1 . . . A 22 LEU CB . 30134 1 197 . 1 1 22 22 LEU CD1 C 13 26.397 0.000 . 1 . . . A 22 LEU CD1 . 30134 1 198 . 1 1 22 22 LEU CD2 C 13 23.743 0.000 . 1 . . . A 22 LEU CD2 . 30134 1 199 . 1 1 22 22 LEU N N 15 118.311 0.107 . 1 . . . A 22 LEU N . 30134 1 200 . 1 1 23 23 GLU H H 1 8.159 0.000 . 1 . . . A 23 GLU H . 30134 1 201 . 1 1 23 23 GLU HA H 1 3.987 0.000 . 1 . . . A 23 GLU HA . 30134 1 202 . 1 1 23 23 GLU HB2 H 1 2.011 0.000 . 2 . . . A 23 GLU HB2 . 30134 1 203 . 1 1 23 23 GLU HB3 H 1 2.104 0.000 . 2 . . . A 23 GLU HB3 . 30134 1 204 . 1 1 23 23 GLU C C 13 178.430 0.000 . 1 . . . A 23 GLU C . 30134 1 205 . 1 1 23 23 GLU CA C 13 59.675 0.098 . 1 . . . A 23 GLU CA . 30134 1 206 . 1 1 23 23 GLU CB C 13 29.022 0.278 . 1 . . . A 23 GLU CB . 30134 1 207 . 1 1 23 23 GLU N N 15 118.279 0.000 . 1 . . . A 23 GLU N . 30134 1 208 . 1 1 24 24 LEU H H 1 7.800 0.000 . 1 . . . A 24 LEU H . 30134 1 209 . 1 1 24 24 LEU HD11 H 1 0.784 0.000 . 2 . . . A 24 LEU HD11 . 30134 1 210 . 1 1 24 24 LEU HD12 H 1 0.784 0.000 . 2 . . . A 24 LEU HD12 . 30134 1 211 . 1 1 24 24 LEU HD13 H 1 0.784 0.000 . 2 . . . A 24 LEU HD13 . 30134 1 212 . 1 1 24 24 LEU HD21 H 1 0.683 0.000 . 2 . . . A 24 LEU HD21 . 30134 1 213 . 1 1 24 24 LEU HD22 H 1 0.683 0.000 . 2 . . . A 24 LEU HD22 . 30134 1 214 . 1 1 24 24 LEU HD23 H 1 0.683 0.000 . 2 . . . A 24 LEU HD23 . 30134 1 215 . 1 1 24 24 LEU C C 13 178.130 0.000 . 1 . . . A 24 LEU C . 30134 1 216 . 1 1 24 24 LEU CA C 13 58.265 0.056 . 1 . . . A 24 LEU CA . 30134 1 217 . 1 1 24 24 LEU CB C 13 41.699 0.140 . 1 . . . A 24 LEU CB . 30134 1 218 . 1 1 24 24 LEU CD1 C 13 22.934 0.000 . 1 . . . A 24 LEU CD1 . 30134 1 219 . 1 1 24 24 LEU CD2 C 13 25.566 0.000 . 1 . . . A 24 LEU CD2 . 30134 1 220 . 1 1 24 24 LEU N N 15 118.237 0.000 . 1 . . . A 24 LEU N . 30134 1 221 . 1 1 25 25 ALA H H 1 7.911 0.002 . 1 . . . A 25 ALA H . 30134 1 222 . 1 1 25 25 ALA HA H 1 3.012 0.004 . 1 . . . A 25 ALA HA . 30134 1 223 . 1 1 25 25 ALA HB1 H 1 1.358 0.004 . 1 . . . A 25 ALA HB1 . 30134 1 224 . 1 1 25 25 ALA HB2 H 1 1.358 0.004 . 1 . . . A 25 ALA HB2 . 30134 1 225 . 1 1 25 25 ALA HB3 H 1 1.358 0.004 . 1 . . . A 25 ALA HB3 . 30134 1 226 . 1 1 25 25 ALA C C 13 179.808 0.006 . 1 . . . A 25 ALA C . 30134 1 227 . 1 1 25 25 ALA CA C 13 54.761 0.231 . 1 . . . A 25 ALA CA . 30134 1 228 . 1 1 25 25 ALA CB C 13 19.224 0.157 . 1 . . . A 25 ALA CB . 30134 1 229 . 1 1 25 25 ALA N N 15 121.148 0.000 . 1 . . . A 25 ALA N . 30134 1 230 . 1 1 26 26 GLN H H 1 8.755 0.001 . 1 . . . A 26 GLN H . 30134 1 231 . 1 1 26 26 GLN HA H 1 3.855 0.000 . 1 . . . A 26 GLN HA . 30134 1 232 . 1 1 26 26 GLN HB2 H 1 1.769 0.000 . 2 . . . A 26 GLN HB2 . 30134 1 233 . 1 1 26 26 GLN HB3 H 1 1.769 0.000 . 2 . . . A 26 GLN HB3 . 30134 1 234 . 1 1 26 26 GLN C C 13 177.083 0.018 . 1 . . . A 26 GLN C . 30134 1 235 . 1 1 26 26 GLN CA C 13 59.023 0.097 . 1 . . . A 26 GLN CA . 30134 1 236 . 1 1 26 26 GLN CB C 13 28.252 0.134 . 1 . . . A 26 GLN CB . 30134 1 237 . 1 1 26 26 GLN N N 15 119.366 0.000 . 1 . . . A 26 GLN N . 30134 1 238 . 1 1 27 27 ARG H H 1 7.412 0.000 . 1 . . . A 27 ARG H . 30134 1 239 . 1 1 27 27 ARG HA H 1 4.229 0.000 . 1 . . . A 27 ARG HA . 30134 1 240 . 1 1 27 27 ARG HB2 H 1 1.909 0.094 . 2 . . . A 27 ARG HB2 . 30134 1 241 . 1 1 27 27 ARG HB3 H 1 1.944 0.060 . 2 . . . A 27 ARG HB3 . 30134 1 242 . 1 1 27 27 ARG C C 13 175.216 0.009 . 1 . . . A 27 ARG C . 30134 1 243 . 1 1 27 27 ARG CA C 13 56.576 0.152 . 1 . . . A 27 ARG CA . 30134 1 244 . 1 1 27 27 ARG CB C 13 31.083 0.147 . 1 . . . A 27 ARG CB . 30134 1 245 . 1 1 27 27 ARG N N 15 115.328 0.000 . 1 . . . A 27 ARG N . 30134 1 246 . 1 1 28 28 GLY H H 1 7.450 0.000 . 1 . . . A 28 GLY H . 30134 1 247 . 1 1 28 28 GLY HA2 H 1 3.848 0.008 . 2 . . . A 28 GLY HA2 . 30134 1 248 . 1 1 28 28 GLY HA3 H 1 3.848 0.008 . 2 . . . A 28 GLY HA3 . 30134 1 249 . 1 1 28 28 GLY C C 13 173.796 0.004 . 1 . . . A 28 GLY C . 30134 1 250 . 1 1 28 28 GLY CA C 13 45.972 0.050 . 1 . . . A 28 GLY CA . 30134 1 251 . 1 1 28 28 GLY N N 15 109.204 0.000 . 1 . . . A 28 GLY N . 30134 1 252 . 1 1 29 29 GLU H H 1 7.587 0.000 . 1 . . . A 29 GLU H . 30134 1 253 . 1 1 29 29 GLU HA H 1 4.454 0.000 . 1 . . . A 29 GLU HA . 30134 1 254 . 1 1 29 29 GLU C C 13 175.965 0.000 . 1 . . . A 29 GLU C . 30134 1 255 . 1 1 29 29 GLU CA C 13 53.790 0.056 . 1 . . . A 29 GLU CA . 30134 1 256 . 1 1 29 29 GLU CB C 13 27.031 0.075 . 1 . . . A 29 GLU CB . 30134 1 257 . 1 1 29 29 GLU N N 15 121.281 0.000 . 1 . . . A 29 GLU N . 30134 1 258 . 1 1 30 30 TRP H H 1 6.890 0.000 . 1 . . . A 30 TRP H . 30134 1 259 . 1 1 30 30 TRP HA H 1 4.003 0.000 . 1 . . . A 30 TRP HA . 30134 1 260 . 1 1 30 30 TRP HD1 H 1 7.399 0.000 . 1 . . . A 30 TRP HD1 . 30134 1 261 . 1 1 30 30 TRP HE1 H 1 10.650 0.000 . 1 . . . A 30 TRP HE1 . 30134 1 262 . 1 1 30 30 TRP HE3 H 1 7.409 0.000 . 1 . . . A 30 TRP HE3 . 30134 1 263 . 1 1 30 30 TRP HZ2 H 1 7.635 0.000 . 1 . . . A 30 TRP HZ2 . 30134 1 264 . 1 1 30 30 TRP HZ3 H 1 6.735 0.000 . 1 . . . A 30 TRP HZ3 . 30134 1 265 . 1 1 30 30 TRP HH2 H 1 6.960 0.000 . 1 . . . A 30 TRP HH2 . 30134 1 266 . 1 1 30 30 TRP C C 13 176.625 0.046 . 1 . . . A 30 TRP C . 30134 1 267 . 1 1 30 30 TRP CA C 13 59.821 0.041 . 1 . . . A 30 TRP CA . 30134 1 268 . 1 1 30 30 TRP CB C 13 30.119 0.073 . 1 . . . A 30 TRP CB . 30134 1 269 . 1 1 30 30 TRP CD1 C 13 128.943 0.000 . 1 . . . A 30 TRP CD1 . 30134 1 270 . 1 1 30 30 TRP CE3 C 13 120.576 0.000 . 1 . . . A 30 TRP CE3 . 30134 1 271 . 1 1 30 30 TRP CZ2 C 13 115.086 0.000 . 1 . . . A 30 TRP CZ2 . 30134 1 272 . 1 1 30 30 TRP CZ3 C 13 120.314 0.000 . 1 . . . A 30 TRP CZ3 . 30134 1 273 . 1 1 30 30 TRP CH2 C 13 125.119 0.000 . 1 . . . A 30 TRP CH2 . 30134 1 274 . 1 1 30 30 TRP N N 15 120.165 0.000 . 1 . . . A 30 TRP N . 30134 1 275 . 1 1 30 30 TRP NE1 N 15 129.300 0.000 . 1 . . . A 30 TRP NE1 . 30134 1 276 . 1 1 31 31 ASP H H 1 8.271 0.000 . 1 . . . A 31 ASP H . 30134 1 277 . 1 1 31 31 ASP HA H 1 4.579 0.000 . 1 . . . A 31 ASP HA . 30134 1 278 . 1 1 31 31 ASP HB2 H 1 2.135 0.000 . 2 . . . A 31 ASP HB2 . 30134 1 279 . 1 1 31 31 ASP HB3 H 1 2.625 0.000 . 2 . . . A 31 ASP HB3 . 30134 1 280 . 1 1 31 31 ASP C C 13 178.561 0.009 . 1 . . . A 31 ASP C . 30134 1 281 . 1 1 31 31 ASP CA C 13 58.127 0.114 . 1 . . . A 31 ASP CA . 30134 1 282 . 1 1 31 31 ASP CB C 13 40.461 0.078 . 1 . . . A 31 ASP CB . 30134 1 283 . 1 1 31 31 ASP N N 15 115.936 0.000 . 1 . . . A 31 ASP N . 30134 1 284 . 1 1 32 32 LEU H H 1 7.950 0.000 . 1 . . . A 32 LEU H . 30134 1 285 . 1 1 32 32 LEU HA H 1 4.392 0.000 . 1 . . . A 32 LEU HA . 30134 1 286 . 1 1 32 32 LEU HB2 H 1 1.894 0.000 . 2 . . . A 32 LEU HB2 . 30134 1 287 . 1 1 32 32 LEU HB3 H 1 1.894 0.000 . 2 . . . A 32 LEU HB3 . 30134 1 288 . 1 1 32 32 LEU HD11 H 1 0.877 0.000 . 2 . . . A 32 LEU HD11 . 30134 1 289 . 1 1 32 32 LEU HD12 H 1 0.877 0.000 . 2 . . . A 32 LEU HD12 . 30134 1 290 . 1 1 32 32 LEU HD13 H 1 0.877 0.000 . 2 . . . A 32 LEU HD13 . 30134 1 291 . 1 1 32 32 LEU HD21 H 1 0.843 0.000 . 2 . . . A 32 LEU HD21 . 30134 1 292 . 1 1 32 32 LEU HD22 H 1 0.843 0.000 . 2 . . . A 32 LEU HD22 . 30134 1 293 . 1 1 32 32 LEU HD23 H 1 0.843 0.000 . 2 . . . A 32 LEU HD23 . 30134 1 294 . 1 1 32 32 LEU C C 13 178.655 0.039 . 1 . . . A 32 LEU C . 30134 1 295 . 1 1 32 32 LEU CA C 13 57.897 0.087 . 1 . . . A 32 LEU CA . 30134 1 296 . 1 1 32 32 LEU CB C 13 41.497 0.106 . 1 . . . A 32 LEU CB . 30134 1 297 . 1 1 32 32 LEU CD1 C 13 24.683 0.000 . 1 . . . A 32 LEU CD1 . 30134 1 298 . 1 1 32 32 LEU CD2 C 13 23.159 0.000 . 1 . . . A 32 LEU CD2 . 30134 1 299 . 1 1 32 32 LEU N N 15 121.258 0.000 . 1 . . . A 32 LEU N . 30134 1 300 . 1 1 33 33 LEU H H 1 8.434 0.000 . 1 . . . A 33 LEU H . 30134 1 301 . 1 1 33 33 LEU HD11 H 1 1.069 0.000 . 2 . . . A 33 LEU HD11 . 30134 1 302 . 1 1 33 33 LEU HD12 H 1 1.069 0.000 . 2 . . . A 33 LEU HD12 . 30134 1 303 . 1 1 33 33 LEU HD13 H 1 1.069 0.000 . 2 . . . A 33 LEU HD13 . 30134 1 304 . 1 1 33 33 LEU HD21 H 1 1.000 0.000 . 2 . . . A 33 LEU HD21 . 30134 1 305 . 1 1 33 33 LEU HD22 H 1 1.000 0.000 . 2 . . . A 33 LEU HD22 . 30134 1 306 . 1 1 33 33 LEU HD23 H 1 1.000 0.000 . 2 . . . A 33 LEU HD23 . 30134 1 307 . 1 1 33 33 LEU C C 13 177.324 0.037 . 1 . . . A 33 LEU C . 30134 1 308 . 1 1 33 33 LEU CA C 13 59.076 0.119 . 1 . . . A 33 LEU CA . 30134 1 309 . 1 1 33 33 LEU CB C 13 41.364 0.033 . 1 . . . A 33 LEU CB . 30134 1 310 . 1 1 33 33 LEU CD1 C 13 27.636 0.000 . 1 . . . A 33 LEU CD1 . 30134 1 311 . 1 1 33 33 LEU CD2 C 13 27.261 0.000 . 1 . . . A 33 LEU CD2 . 30134 1 312 . 1 1 33 33 LEU N N 15 121.926 0.000 . 1 . . . A 33 LEU N . 30134 1 313 . 1 1 34 34 LEU H H 1 7.923 0.000 . 1 . . . A 34 LEU H . 30134 1 314 . 1 1 34 34 LEU HA H 1 4.128 0.000 . 1 . . . A 34 LEU HA . 30134 1 315 . 1 1 34 34 LEU HD11 H 1 0.970 0.000 . 2 . . . A 34 LEU HD11 . 30134 1 316 . 1 1 34 34 LEU HD12 H 1 0.970 0.000 . 2 . . . A 34 LEU HD12 . 30134 1 317 . 1 1 34 34 LEU HD13 H 1 0.970 0.000 . 2 . . . A 34 LEU HD13 . 30134 1 318 . 1 1 34 34 LEU HD21 H 1 1.028 0.000 . 2 . . . A 34 LEU HD21 . 30134 1 319 . 1 1 34 34 LEU HD22 H 1 1.028 0.000 . 2 . . . A 34 LEU HD22 . 30134 1 320 . 1 1 34 34 LEU HD23 H 1 1.028 0.000 . 2 . . . A 34 LEU HD23 . 30134 1 321 . 1 1 34 34 LEU C C 13 178.868 0.003 . 1 . . . A 34 LEU C . 30134 1 322 . 1 1 34 34 LEU CA C 13 58.003 0.092 . 1 . . . A 34 LEU CA . 30134 1 323 . 1 1 34 34 LEU CB C 13 41.696 0.052 . 1 . . . A 34 LEU CB . 30134 1 324 . 1 1 34 34 LEU CD1 C 13 24.074 0.000 . 1 . . . A 34 LEU CD1 . 30134 1 325 . 1 1 34 34 LEU CD2 C 13 25.906 0.000 . 1 . . . A 34 LEU CD2 . 30134 1 326 . 1 1 34 34 LEU N N 15 118.172 0.000 . 1 . . . A 34 LEU N . 30134 1 327 . 1 1 35 35 GLN H H 1 7.613 0.000 . 1 . . . A 35 GLN H . 30134 1 328 . 1 1 35 35 GLN C C 13 177.570 0.014 . 1 . . . A 35 GLN C . 30134 1 329 . 1 1 35 35 GLN CA C 13 58.576 0.055 . 1 . . . A 35 GLN CA . 30134 1 330 . 1 1 35 35 GLN CB C 13 28.670 0.050 . 1 . . . A 35 GLN CB . 30134 1 331 . 1 1 35 35 GLN N N 15 118.059 0.000 . 1 . . . A 35 GLN N . 30134 1 332 . 1 1 36 36 GLN H H 1 8.127 0.000 . 1 . . . A 36 GLN H . 30134 1 333 . 1 1 36 36 GLN HA H 1 4.486 0.000 . 1 . . . A 36 GLN HA . 30134 1 334 . 1 1 36 36 GLN HB2 H 1 1.917 0.000 . 2 . . . A 36 GLN HB2 . 30134 1 335 . 1 1 36 36 GLN HB3 H 1 1.917 0.000 . 2 . . . A 36 GLN HB3 . 30134 1 336 . 1 1 36 36 GLN C C 13 176.524 0.050 . 1 . . . A 36 GLN C . 30134 1 337 . 1 1 36 36 GLN CA C 13 57.042 0.080 . 1 . . . A 36 GLN CA . 30134 1 338 . 1 1 36 36 GLN CB C 13 28.986 0.129 . 1 . . . A 36 GLN CB . 30134 1 339 . 1 1 36 36 GLN N N 15 118.630 0.000 . 1 . . . A 36 GLN N . 30134 1 340 . 1 1 37 37 GLU H H 1 8.209 0.000 . 1 . . . A 37 GLU H . 30134 1 341 . 1 1 37 37 GLU HA H 1 3.840 0.000 . 1 . . . A 37 GLU HA . 30134 1 342 . 1 1 37 37 GLU HB2 H 1 2.330 0.000 . 2 . . . A 37 GLU HB2 . 30134 1 343 . 1 1 37 37 GLU HB3 H 1 2.330 0.000 . 2 . . . A 37 GLU HB3 . 30134 1 344 . 1 1 37 37 GLU C C 13 176.240 0.088 . 1 . . . A 37 GLU C . 30134 1 345 . 1 1 37 37 GLU CA C 13 60.542 0.104 . 1 . . . A 37 GLU CA . 30134 1 346 . 1 1 37 37 GLU CB C 13 28.918 0.159 . 1 . . . A 37 GLU CB . 30134 1 347 . 1 1 37 37 GLU N N 15 121.484 0.000 . 1 . . . A 37 GLU N . 30134 1 348 . 1 1 38 38 VAL H H 1 7.525 0.000 . 1 . . . A 38 VAL H . 30134 1 349 . 1 1 38 38 VAL HA H 1 3.675 0.008 . 1 . . . A 38 VAL HA . 30134 1 350 . 1 1 38 38 VAL HB H 1 2.139 0.010 . 1 . . . A 38 VAL HB . 30134 1 351 . 1 1 38 38 VAL HG11 H 1 1.134 0.005 . 2 . . . A 38 VAL HG11 . 30134 1 352 . 1 1 38 38 VAL HG12 H 1 1.134 0.005 . 2 . . . A 38 VAL HG12 . 30134 1 353 . 1 1 38 38 VAL HG13 H 1 1.134 0.005 . 2 . . . A 38 VAL HG13 . 30134 1 354 . 1 1 38 38 VAL HG21 H 1 1.012 0.023 . 2 . . . A 38 VAL HG21 . 30134 1 355 . 1 1 38 38 VAL HG22 H 1 1.012 0.023 . 2 . . . A 38 VAL HG22 . 30134 1 356 . 1 1 38 38 VAL HG23 H 1 1.012 0.023 . 2 . . . A 38 VAL HG23 . 30134 1 357 . 1 1 38 38 VAL C C 13 177.423 0.032 . 1 . . . A 38 VAL C . 30134 1 358 . 1 1 38 38 VAL CA C 13 66.696 0.078 . 1 . . . A 38 VAL CA . 30134 1 359 . 1 1 38 38 VAL CB C 13 31.508 0.143 . 1 . . . A 38 VAL CB . 30134 1 360 . 1 1 38 38 VAL CG1 C 13 22.411 0.022 . 1 . . . A 38 VAL CG1 . 30134 1 361 . 1 1 38 38 VAL CG2 C 13 21.038 0.102 . 1 . . . A 38 VAL CG2 . 30134 1 362 . 1 1 38 38 VAL N N 15 116.785 0.000 . 1 . . . A 38 VAL N . 30134 1 363 . 1 1 39 39 SER H H 1 7.598 0.000 . 1 . . . A 39 SER H . 30134 1 364 . 1 1 39 39 SER C C 13 176.246 0.000 . 1 . . . A 39 SER C . 30134 1 365 . 1 1 39 39 SER CA C 13 61.613 0.095 . 1 . . . A 39 SER CA . 30134 1 366 . 1 1 39 39 SER CB C 13 62.878 0.000 . 1 . . . A 39 SER CB . 30134 1 367 . 1 1 39 39 SER N N 15 114.707 0.000 . 1 . . . A 39 SER N . 30134 1 368 . 1 1 40 40 TYR H H 1 7.976 0.001 . 1 . . . A 40 TYR H . 30134 1 369 . 1 1 40 40 TYR HA H 1 4.257 0.013 . 1 . . . A 40 TYR HA . 30134 1 370 . 1 1 40 40 TYR HB2 H 1 2.997 0.010 . 2 . . . A 40 TYR HB2 . 30134 1 371 . 1 1 40 40 TYR HB3 H 1 3.099 0.022 . 2 . . . A 40 TYR HB3 . 30134 1 372 . 1 1 40 40 TYR HD1 H 1 6.814 0.005 . 1 . . . A 40 TYR HD1 . 30134 1 373 . 1 1 40 40 TYR HE1 H 1 6.744 0.000 . 1 . . . A 40 TYR HE1 . 30134 1 374 . 1 1 40 40 TYR C C 13 175.974 0.057 . 1 . . . A 40 TYR C . 30134 1 375 . 1 1 40 40 TYR CA C 13 61.968 0.147 . 1 . . . A 40 TYR CA . 30134 1 376 . 1 1 40 40 TYR CB C 13 38.978 0.158 . 1 . . . A 40 TYR CB . 30134 1 377 . 1 1 40 40 TYR CD1 C 13 131.908 0.000 . 1 . . . A 40 TYR CD1 . 30134 1 378 . 1 1 40 40 TYR CE1 C 13 118.033 0.000 . 1 . . . A 40 TYR CE1 . 30134 1 379 . 1 1 40 40 TYR N N 15 124.565 0.000 . 1 . . . A 40 TYR N . 30134 1 380 . 1 1 41 41 LEU H H 1 8.555 0.005 . 1 . . . A 41 LEU H . 30134 1 381 . 1 1 41 41 LEU HA H 1 3.746 0.000 . 1 . . . A 41 LEU HA . 30134 1 382 . 1 1 41 41 LEU HB2 H 1 1.557 0.000 . 2 . . . A 41 LEU HB2 . 30134 1 383 . 1 1 41 41 LEU HB3 H 1 1.930 0.000 . 2 . . . A 41 LEU HB3 . 30134 1 384 . 1 1 41 41 LEU HD11 H 1 1.005 0.000 . 2 . . . A 41 LEU HD11 . 30134 1 385 . 1 1 41 41 LEU HD12 H 1 1.005 0.000 . 2 . . . A 41 LEU HD12 . 30134 1 386 . 1 1 41 41 LEU HD13 H 1 1.005 0.000 . 2 . . . A 41 LEU HD13 . 30134 1 387 . 1 1 41 41 LEU HD21 H 1 0.921 0.000 . 2 . . . A 41 LEU HD21 . 30134 1 388 . 1 1 41 41 LEU HD22 H 1 0.921 0.000 . 2 . . . A 41 LEU HD22 . 30134 1 389 . 1 1 41 41 LEU HD23 H 1 0.921 0.000 . 2 . . . A 41 LEU HD23 . 30134 1 390 . 1 1 41 41 LEU C C 13 179.214 0.051 . 1 . . . A 41 LEU C . 30134 1 391 . 1 1 41 41 LEU CA C 13 58.183 0.155 . 1 . . . A 41 LEU CA . 30134 1 392 . 1 1 41 41 LEU CB C 13 40.326 0.202 . 1 . . . A 41 LEU CB . 30134 1 393 . 1 1 41 41 LEU CD1 C 13 26.171 0.000 . 1 . . . A 41 LEU CD1 . 30134 1 394 . 1 1 41 41 LEU CD2 C 13 22.640 0.000 . 1 . . . A 41 LEU CD2 . 30134 1 395 . 1 1 41 41 LEU N N 15 118.759 0.000 . 1 . . . A 41 LEU N . 30134 1 396 . 1 1 42 42 GLN H H 1 8.343 0.002 . 1 . . . A 42 GLN H . 30134 1 397 . 1 1 42 42 GLN HA H 1 4.019 0.000 . 1 . . . A 42 GLN HA . 30134 1 398 . 1 1 42 42 GLN HB2 H 1 2.096 0.000 . 2 . . . A 42 GLN HB2 . 30134 1 399 . 1 1 42 42 GLN HB3 H 1 2.096 0.000 . 2 . . . A 42 GLN HB3 . 30134 1 400 . 1 1 42 42 GLN C C 13 178.092 0.032 . 1 . . . A 42 GLN C . 30134 1 401 . 1 1 42 42 GLN CA C 13 59.164 0.039 . 1 . . . A 42 GLN CA . 30134 1 402 . 1 1 42 42 GLN CB C 13 28.251 0.082 . 1 . . . A 42 GLN CB . 30134 1 403 . 1 1 42 42 GLN N N 15 117.359 0.010 . 1 . . . A 42 GLN N . 30134 1 404 . 1 1 43 43 SER H H 1 7.851 0.000 . 1 . . . A 43 SER H . 30134 1 405 . 1 1 43 43 SER HA H 1 4.314 0.000 . 1 . . . A 43 SER HA . 30134 1 406 . 1 1 43 43 SER HB2 H 1 3.832 0.000 . 2 . . . A 43 SER HB2 . 30134 1 407 . 1 1 43 43 SER HB3 H 1 3.832 0.000 . 2 . . . A 43 SER HB3 . 30134 1 408 . 1 1 43 43 SER C C 13 175.436 0.000 . 1 . . . A 43 SER C . 30134 1 409 . 1 1 43 43 SER CA C 13 63.182 0.185 . 1 . . . A 43 SER CA . 30134 1 410 . 1 1 43 43 SER N N 15 117.617 0.000 . 1 . . . A 43 SER N . 30134 1 411 . 1 1 44 44 ILE H H 1 7.540 0.008 . 1 . . . A 44 ILE H . 30134 1 412 . 1 1 44 44 ILE HA H 1 3.586 0.005 . 1 . . . A 44 ILE HA . 30134 1 413 . 1 1 44 44 ILE HB H 1 1.673 0.004 . 1 . . . A 44 ILE HB . 30134 1 414 . 1 1 44 44 ILE HG12 H 1 0.805 0.005 . 2 . . . A 44 ILE HG12 . 30134 1 415 . 1 1 44 44 ILE HG13 H 1 1.243 0.002 . 2 . . . A 44 ILE HG13 . 30134 1 416 . 1 1 44 44 ILE HG21 H 1 0.764 0.005 . 1 . . . A 44 ILE HG21 . 30134 1 417 . 1 1 44 44 ILE HG22 H 1 0.764 0.005 . 1 . . . A 44 ILE HG22 . 30134 1 418 . 1 1 44 44 ILE HG23 H 1 0.764 0.005 . 1 . . . A 44 ILE HG23 . 30134 1 419 . 1 1 44 44 ILE HD11 H 1 0.581 0.004 . 1 . . . A 44 ILE HD11 . 30134 1 420 . 1 1 44 44 ILE HD12 H 1 0.581 0.004 . 1 . . . A 44 ILE HD12 . 30134 1 421 . 1 1 44 44 ILE HD13 H 1 0.581 0.004 . 1 . . . A 44 ILE HD13 . 30134 1 422 . 1 1 44 44 ILE C C 13 176.118 0.034 . 1 . . . A 44 ILE C . 30134 1 423 . 1 1 44 44 ILE CA C 13 63.768 0.123 . 1 . . . A 44 ILE CA . 30134 1 424 . 1 1 44 44 ILE CB C 13 36.903 0.216 . 1 . . . A 44 ILE CB . 30134 1 425 . 1 1 44 44 ILE CG1 C 13 29.061 0.030 . 1 . . . A 44 ILE CG1 . 30134 1 426 . 1 1 44 44 ILE CG2 C 13 17.278 0.059 . 1 . . . A 44 ILE CG2 . 30134 1 427 . 1 1 44 44 ILE CD1 C 13 11.633 0.012 . 1 . . . A 44 ILE CD1 . 30134 1 428 . 1 1 44 44 ILE N N 15 124.065 0.000 . 1 . . . A 44 ILE N . 30134 1 429 . 1 1 45 45 GLU H H 1 8.237 0.000 . 1 . . . A 45 GLU H . 30134 1 430 . 1 1 45 45 GLU HA H 1 3.793 0.000 . 1 . . . A 45 GLU HA . 30134 1 431 . 1 1 45 45 GLU HB2 H 1 2.018 0.000 . 2 . . . A 45 GLU HB2 . 30134 1 432 . 1 1 45 45 GLU HB3 H 1 2.018 0.000 . 2 . . . A 45 GLU HB3 . 30134 1 433 . 1 1 45 45 GLU HG2 H 1 2.138 0.000 . 2 . . . A 45 GLU HG2 . 30134 1 434 . 1 1 45 45 GLU HG3 H 1 2.367 0.000 . 2 . . . A 45 GLU HG3 . 30134 1 435 . 1 1 45 45 GLU C C 13 178.333 0.009 . 1 . . . A 45 GLU C . 30134 1 436 . 1 1 45 45 GLU CA C 13 60.062 0.163 . 1 . . . A 45 GLU CA . 30134 1 437 . 1 1 45 45 GLU CB C 13 29.023 0.084 . 1 . . . A 45 GLU CB . 30134 1 438 . 1 1 45 45 GLU CG C 13 36.602 0.117 . 1 . . . A 45 GLU CG . 30134 1 439 . 1 1 45 45 GLU N N 15 120.290 0.000 . 1 . . . A 45 GLU N . 30134 1 440 . 1 1 46 46 THR H H 1 7.751 0.000 . 1 . . . A 46 THR H . 30134 1 441 . 1 1 46 46 THR HA H 1 4.096 0.000 . 1 . . . A 46 THR HA . 30134 1 442 . 1 1 46 46 THR HB H 1 3.956 0.000 . 1 . . . A 46 THR HB . 30134 1 443 . 1 1 46 46 THR HG21 H 1 1.148 0.000 . 1 . . . A 46 THR HG21 . 30134 1 444 . 1 1 46 46 THR HG22 H 1 1.148 0.000 . 1 . . . A 46 THR HG22 . 30134 1 445 . 1 1 46 46 THR HG23 H 1 1.148 0.000 . 1 . . . A 46 THR HG23 . 30134 1 446 . 1 1 46 46 THR C C 13 175.278 0.000 . 1 . . . A 46 THR C . 30134 1 447 . 1 1 46 46 THR CA C 13 66.611 0.072 . 1 . . . A 46 THR CA . 30134 1 448 . 1 1 46 46 THR CB C 13 69.161 0.069 . 1 . . . A 46 THR CB . 30134 1 449 . 1 1 46 46 THR CG2 C 13 21.626 0.000 . 1 . . . A 46 THR CG2 . 30134 1 450 . 1 1 46 46 THR N N 15 112.290 0.000 . 1 . . . A 46 THR N . 30134 1 451 . 1 1 47 47 VAL H H 1 7.118 0.001 . 1 . . . A 47 VAL H . 30134 1 452 . 1 1 47 47 VAL HA H 1 3.891 0.002 . 1 . . . A 47 VAL HA . 30134 1 453 . 1 1 47 47 VAL HB H 1 1.838 0.003 . 1 . . . A 47 VAL HB . 30134 1 454 . 1 1 47 47 VAL HG11 H 1 0.484 0.002 . 2 . . . A 47 VAL HG11 . 30134 1 455 . 1 1 47 47 VAL HG12 H 1 0.484 0.002 . 2 . . . A 47 VAL HG12 . 30134 1 456 . 1 1 47 47 VAL HG13 H 1 0.484 0.002 . 2 . . . A 47 VAL HG13 . 30134 1 457 . 1 1 47 47 VAL HG21 H 1 0.454 0.004 . 2 . . . A 47 VAL HG21 . 30134 1 458 . 1 1 47 47 VAL HG22 H 1 0.454 0.004 . 2 . . . A 47 VAL HG22 . 30134 1 459 . 1 1 47 47 VAL HG23 H 1 0.454 0.004 . 2 . . . A 47 VAL HG23 . 30134 1 460 . 1 1 47 47 VAL C C 13 176.924 0.027 . 1 . . . A 47 VAL C . 30134 1 461 . 1 1 47 47 VAL CA C 13 65.081 0.164 . 1 . . . A 47 VAL CA . 30134 1 462 . 1 1 47 47 VAL CB C 13 31.291 0.107 . 1 . . . A 47 VAL CB . 30134 1 463 . 1 1 47 47 VAL CG1 C 13 22.160 0.069 . 1 . . . A 47 VAL CG1 . 30134 1 464 . 1 1 47 47 VAL CG2 C 13 21.248 0.082 . 1 . . . A 47 VAL CG2 . 30134 1 465 . 1 1 47 47 VAL N N 15 118.006 0.000 . 1 . . . A 47 VAL N . 30134 1 466 . 1 1 48 48 MET H H 1 7.754 0.004 . 1 . . . A 48 MET H . 30134 1 467 . 1 1 48 48 MET HA H 1 3.990 0.011 . 1 . . . A 48 MET HA . 30134 1 468 . 1 1 48 48 MET HB2 H 1 1.794 0.033 . 2 . . . A 48 MET HB2 . 30134 1 469 . 1 1 48 48 MET HB3 H 1 1.829 0.003 . 2 . . . A 48 MET HB3 . 30134 1 470 . 1 1 48 48 MET HG3 H 1 2.211 0.000 . 2 . . . A 48 MET HG3 . 30134 1 471 . 1 1 48 48 MET HE1 H 1 1.744 0.000 . 1 . . . A 48 MET HE1 . 30134 1 472 . 1 1 48 48 MET HE2 H 1 1.744 0.000 . 1 . . . A 48 MET HE2 . 30134 1 473 . 1 1 48 48 MET HE3 H 1 1.744 0.000 . 1 . . . A 48 MET HE3 . 30134 1 474 . 1 1 48 48 MET C C 13 176.637 0.030 . 1 . . . A 48 MET C . 30134 1 475 . 1 1 48 48 MET CA C 13 58.809 0.113 . 1 . . . A 48 MET CA . 30134 1 476 . 1 1 48 48 MET CB C 13 32.799 0.174 . 1 . . . A 48 MET CB . 30134 1 477 . 1 1 48 48 MET CG C 13 31.325 0.115 . 1 . . . A 48 MET CG . 30134 1 478 . 1 1 48 48 MET CE C 13 16.436 0.000 . 1 . . . A 48 MET CE . 30134 1 479 . 1 1 48 48 MET N N 15 119.842 0.000 . 1 . . . A 48 MET N . 30134 1 480 . 1 1 49 49 GLU H H 1 7.405 0.001 . 1 . . . A 49 GLU H . 30134 1 481 . 1 1 49 49 GLU HA H 1 4.244 0.000 . 1 . . . A 49 GLU HA . 30134 1 482 . 1 1 49 49 GLU HB2 H 1 2.042 0.000 . 2 . . . A 49 GLU HB2 . 30134 1 483 . 1 1 49 49 GLU HB3 H 1 2.120 0.000 . 2 . . . A 49 GLU HB3 . 30134 1 484 . 1 1 49 49 GLU C C 13 175.880 0.028 . 1 . . . A 49 GLU C . 30134 1 485 . 1 1 49 49 GLU CA C 13 57.244 0.044 . 1 . . . A 49 GLU CA . 30134 1 486 . 1 1 49 49 GLU CB C 13 30.151 0.060 . 1 . . . A 49 GLU CB . 30134 1 487 . 1 1 49 49 GLU N N 15 115.998 0.000 . 1 . . . A 49 GLU N . 30134 1 488 . 1 1 50 50 LYS H H 1 7.554 0.005 . 1 . . . A 50 LYS H . 30134 1 489 . 1 1 50 50 LYS C C 13 175.166 0.000 . 1 . . . A 50 LYS C . 30134 1 490 . 1 1 50 50 LYS CA C 13 55.400 0.016 . 1 . . . A 50 LYS CA . 30134 1 491 . 1 1 50 50 LYS CB C 13 33.192 0.000 . 1 . . . A 50 LYS CB . 30134 1 492 . 1 1 50 50 LYS N N 15 118.930 0.000 . 1 . . . A 50 LYS N . 30134 1 493 . 1 1 51 51 GLN H H 1 8.271 0.000 . 1 . . . A 51 GLN H . 30134 1 494 . 1 1 51 51 GLN CA C 13 55.680 0.000 . 1 . . . A 51 GLN CA . 30134 1 495 . 1 1 51 51 GLN N N 15 119.468 0.000 . 1 . . . A 51 GLN N . 30134 1 496 . 1 1 52 52 THR HG21 H 1 1.115 0.000 . 1 . . . A 52 THR HG21 . 30134 1 497 . 1 1 52 52 THR HG22 H 1 1.115 0.000 . 1 . . . A 52 THR HG22 . 30134 1 498 . 1 1 52 52 THR HG23 H 1 1.115 0.000 . 1 . . . A 52 THR HG23 . 30134 1 499 . 1 1 52 52 THR CG2 C 13 22.010 0.000 . 1 . . . A 52 THR CG2 . 30134 1 500 . 1 1 53 53 PRO HA H 1 4.611 0.000 . 1 . . . A 53 PRO HA . 30134 1 501 . 1 1 53 53 PRO HB2 H 1 1.778 0.004 . 2 . . . A 53 PRO HB2 . 30134 1 502 . 1 1 53 53 PRO HB3 H 1 2.218 0.001 . 2 . . . A 53 PRO HB3 . 30134 1 503 . 1 1 53 53 PRO HD2 H 1 2.555 0.000 . 2 . . . A 53 PRO HD2 . 30134 1 504 . 1 1 53 53 PRO HD3 H 1 3.265 0.000 . 2 . . . A 53 PRO HD3 . 30134 1 505 . 1 1 53 53 PRO CA C 13 61.350 0.028 . 1 . . . A 53 PRO CA . 30134 1 506 . 1 1 53 53 PRO CB C 13 30.802 0.053 . 1 . . . A 53 PRO CB . 30134 1 507 . 1 1 53 53 PRO CG C 13 27.470 0.028 . 1 . . . A 53 PRO CG . 30134 1 508 . 1 1 53 53 PRO CD C 13 50.251 0.027 . 1 . . . A 53 PRO CD . 30134 1 509 . 1 1 54 54 PRO HD2 H 1 3.637 0.000 . 2 . . . A 54 PRO HD2 . 30134 1 510 . 1 1 54 54 PRO HD3 H 1 3.801 0.000 . 2 . . . A 54 PRO HD3 . 30134 1 511 . 1 1 54 54 PRO CD C 13 50.462 0.000 . 1 . . . A 54 PRO CD . 30134 1 512 . 1 1 55 55 GLY CA C 13 46.270 0.038 . 1 . . . A 55 GLY CA . 30134 1 513 . 1 1 56 56 ILE H H 1 7.299 0.000 . 1 . . . A 56 ILE H . 30134 1 514 . 1 1 56 56 ILE HA H 1 4.096 0.003 . 1 . . . A 56 ILE HA . 30134 1 515 . 1 1 56 56 ILE HB H 1 1.896 0.004 . 1 . . . A 56 ILE HB . 30134 1 516 . 1 1 56 56 ILE HG12 H 1 1.329 0.001 . 2 . . . A 56 ILE HG12 . 30134 1 517 . 1 1 56 56 ILE HG13 H 1 1.351 0.001 . 2 . . . A 56 ILE HG13 . 30134 1 518 . 1 1 56 56 ILE HG21 H 1 0.930 0.007 . 1 . . . A 56 ILE HG21 . 30134 1 519 . 1 1 56 56 ILE HG22 H 1 0.930 0.007 . 1 . . . A 56 ILE HG22 . 30134 1 520 . 1 1 56 56 ILE HG23 H 1 0.930 0.007 . 1 . . . A 56 ILE HG23 . 30134 1 521 . 1 1 56 56 ILE HD11 H 1 0.748 0.005 . 1 . . . A 56 ILE HD11 . 30134 1 522 . 1 1 56 56 ILE HD12 H 1 0.748 0.005 . 1 . . . A 56 ILE HD12 . 30134 1 523 . 1 1 56 56 ILE HD13 H 1 0.748 0.005 . 1 . . . A 56 ILE HD13 . 30134 1 524 . 1 1 56 56 ILE CA C 13 61.980 0.117 . 1 . . . A 56 ILE CA . 30134 1 525 . 1 1 56 56 ILE CB C 13 37.601 0.152 . 1 . . . A 56 ILE CB . 30134 1 526 . 1 1 56 56 ILE CG1 C 13 26.972 0.050 . 1 . . . A 56 ILE CG1 . 30134 1 527 . 1 1 56 56 ILE CG2 C 13 17.657 0.028 . 1 . . . A 56 ILE CG2 . 30134 1 528 . 1 1 56 56 ILE CD1 C 13 13.618 0.033 . 1 . . . A 56 ILE CD1 . 30134 1 529 . 1 1 56 56 ILE N N 15 117.676 0.000 . 1 . . . A 56 ILE N . 30134 1 530 . 1 1 57 57 THR H H 1 7.148 0.006 . 1 . . . A 57 THR H . 30134 1 531 . 1 1 57 57 THR HG21 H 1 1.375 0.000 . 1 . . . A 57 THR HG21 . 30134 1 532 . 1 1 57 57 THR HG22 H 1 1.375 0.000 . 1 . . . A 57 THR HG22 . 30134 1 533 . 1 1 57 57 THR HG23 H 1 1.375 0.000 . 1 . . . A 57 THR HG23 . 30134 1 534 . 1 1 57 57 THR CA C 13 60.809 0.062 . 1 . . . A 57 THR CA . 30134 1 535 . 1 1 57 57 THR CB C 13 71.646 0.000 . 1 . . . A 57 THR CB . 30134 1 536 . 1 1 57 57 THR CG2 C 13 21.855 0.099 . 1 . . . A 57 THR CG2 . 30134 1 537 . 1 1 57 57 THR N N 15 115.666 0.000 . 1 . . . A 57 THR N . 30134 1 538 . 1 1 58 58 ARG H H 1 8.200 0.000 . 1 . . . A 58 ARG H . 30134 1 539 . 1 1 58 58 ARG N N 15 123.429 0.000 . 1 . . . A 58 ARG N . 30134 1 540 . 1 1 59 59 SER HA H 1 4.252 0.000 . 1 . . . A 59 SER HA . 30134 1 541 . 1 1 59 59 SER C C 13 176.528 0.000 . 1 . . . A 59 SER C . 30134 1 542 . 1 1 59 59 SER CA C 13 61.737 0.129 . 1 . . . A 59 SER CA . 30134 1 543 . 1 1 59 59 SER CB C 13 62.341 0.000 . 1 . . . A 59 SER CB . 30134 1 544 . 1 1 60 60 ILE H H 1 7.348 0.000 . 1 . . . A 60 ILE H . 30134 1 545 . 1 1 60 60 ILE HA H 1 3.941 0.006 . 1 . . . A 60 ILE HA . 30134 1 546 . 1 1 60 60 ILE HB H 1 2.062 0.008 . 1 . . . A 60 ILE HB . 30134 1 547 . 1 1 60 60 ILE HG12 H 1 1.344 0.002 . 2 . . . A 60 ILE HG12 . 30134 1 548 . 1 1 60 60 ILE HG13 H 1 1.693 0.000 . 2 . . . A 60 ILE HG13 . 30134 1 549 . 1 1 60 60 ILE HG21 H 1 1.103 0.003 . 1 . . . A 60 ILE HG21 . 30134 1 550 . 1 1 60 60 ILE HG22 H 1 1.103 0.003 . 1 . . . A 60 ILE HG22 . 30134 1 551 . 1 1 60 60 ILE HG23 H 1 1.103 0.003 . 1 . . . A 60 ILE HG23 . 30134 1 552 . 1 1 60 60 ILE HD11 H 1 0.984 0.003 . 1 . . . A 60 ILE HD11 . 30134 1 553 . 1 1 60 60 ILE HD12 H 1 0.984 0.003 . 1 . . . A 60 ILE HD12 . 30134 1 554 . 1 1 60 60 ILE HD13 H 1 0.984 0.003 . 1 . . . A 60 ILE HD13 . 30134 1 555 . 1 1 60 60 ILE C C 13 176.823 0.040 . 1 . . . A 60 ILE C . 30134 1 556 . 1 1 60 60 ILE CA C 13 64.316 0.133 . 1 . . . A 60 ILE CA . 30134 1 557 . 1 1 60 60 ILE CB C 13 37.140 0.153 . 1 . . . A 60 ILE CB . 30134 1 558 . 1 1 60 60 ILE CG1 C 13 28.722 0.025 . 1 . . . A 60 ILE CG1 . 30134 1 559 . 1 1 60 60 ILE CG2 C 13 18.232 0.066 . 1 . . . A 60 ILE CG2 . 30134 1 560 . 1 1 60 60 ILE CD1 C 13 12.334 0.038 . 1 . . . A 60 ILE CD1 . 30134 1 561 . 1 1 60 60 ILE N N 15 122.669 0.000 . 1 . . . A 60 ILE N . 30134 1 562 . 1 1 61 61 GLN H H 1 8.579 0.000 . 1 . . . A 61 GLN H . 30134 1 563 . 1 1 61 61 GLN HA H 1 3.902 0.000 . 1 . . . A 61 GLN HA . 30134 1 564 . 1 1 61 61 GLN HB2 H 1 2.267 0.000 . 2 . . . A 61 GLN HB2 . 30134 1 565 . 1 1 61 61 GLN HB3 H 1 2.267 0.000 . 2 . . . A 61 GLN HB3 . 30134 1 566 . 1 1 61 61 GLN C C 13 176.915 0.000 . 1 . . . A 61 GLN C . 30134 1 567 . 1 1 61 61 GLN CA C 13 60.706 0.078 . 1 . . . A 61 GLN CA . 30134 1 568 . 1 1 61 61 GLN CB C 13 28.545 0.051 . 1 . . . A 61 GLN CB . 30134 1 569 . 1 1 61 61 GLN N N 15 121.266 0.000 . 1 . . . A 61 GLN N . 30134 1 570 . 1 1 62 62 ASP H H 1 8.578 0.000 . 1 . . . A 62 ASP H . 30134 1 571 . 1 1 62 62 ASP HA H 1 4.361 0.000 . 1 . . . A 62 ASP HA . 30134 1 572 . 1 1 62 62 ASP HB2 H 1 2.283 0.000 . 2 . . . A 62 ASP HB2 . 30134 1 573 . 1 1 62 62 ASP HB3 H 1 2.283 0.000 . 2 . . . A 62 ASP HB3 . 30134 1 574 . 1 1 62 62 ASP C C 13 178.285 0.049 . 1 . . . A 62 ASP C . 30134 1 575 . 1 1 62 62 ASP CA C 13 57.537 0.034 . 1 . . . A 62 ASP CA . 30134 1 576 . 1 1 62 62 ASP CB C 13 40.357 0.015 . 1 . . . A 62 ASP CB . 30134 1 577 . 1 1 62 62 ASP N N 15 117.776 0.000 . 1 . . . A 62 ASP N . 30134 1 578 . 1 1 63 63 MET H H 1 7.603 0.005 . 1 . . . A 63 MET H . 30134 1 579 . 1 1 63 63 MET HA H 1 3.936 0.003 . 1 . . . A 63 MET HA . 30134 1 580 . 1 1 63 63 MET HB2 H 1 2.218 0.007 . 2 . . . A 63 MET HB2 . 30134 1 581 . 1 1 63 63 MET HB3 H 1 2.277 0.035 . 2 . . . A 63 MET HB3 . 30134 1 582 . 1 1 63 63 MET HG2 H 1 2.349 0.000 . 2 . . . A 63 MET HG2 . 30134 1 583 . 1 1 63 63 MET HG3 H 1 2.585 0.000 . 2 . . . A 63 MET HG3 . 30134 1 584 . 1 1 63 63 MET HE1 H 1 2.123 0.000 . 1 . . . A 63 MET HE1 . 30134 1 585 . 1 1 63 63 MET HE2 H 1 2.123 0.000 . 1 . . . A 63 MET HE2 . 30134 1 586 . 1 1 63 63 MET HE3 H 1 2.123 0.000 . 1 . . . A 63 MET HE3 . 30134 1 587 . 1 1 63 63 MET C C 13 177.786 0.026 . 1 . . . A 63 MET C . 30134 1 588 . 1 1 63 63 MET CA C 13 58.858 0.121 . 1 . . . A 63 MET CA . 30134 1 589 . 1 1 63 63 MET CB C 13 33.324 0.178 . 1 . . . A 63 MET CB . 30134 1 590 . 1 1 63 63 MET CG C 13 31.352 0.025 . 1 . . . A 63 MET CG . 30134 1 591 . 1 1 63 63 MET CE C 13 17.086 0.000 . 1 . . . A 63 MET CE . 30134 1 592 . 1 1 63 63 MET N N 15 121.042 0.000 . 1 . . . A 63 MET N . 30134 1 593 . 1 1 64 64 VAL H H 1 8.565 0.003 . 1 . . . A 64 VAL H . 30134 1 594 . 1 1 64 64 VAL HA H 1 3.605 0.010 . 1 . . . A 64 VAL HA . 30134 1 595 . 1 1 64 64 VAL HB H 1 2.081 0.006 . 1 . . . A 64 VAL HB . 30134 1 596 . 1 1 64 64 VAL HG11 H 1 1.069 0.005 . 2 . . . A 64 VAL HG11 . 30134 1 597 . 1 1 64 64 VAL HG12 H 1 1.069 0.005 . 2 . . . A 64 VAL HG12 . 30134 1 598 . 1 1 64 64 VAL HG13 H 1 1.069 0.005 . 2 . . . A 64 VAL HG13 . 30134 1 599 . 1 1 64 64 VAL HG21 H 1 0.525 0.244 . 2 . . . A 64 VAL HG21 . 30134 1 600 . 1 1 64 64 VAL HG22 H 1 0.525 0.244 . 2 . . . A 64 VAL HG22 . 30134 1 601 . 1 1 64 64 VAL HG23 H 1 0.525 0.244 . 2 . . . A 64 VAL HG23 . 30134 1 602 . 1 1 64 64 VAL C C 13 176.694 0.104 . 1 . . . A 64 VAL C . 30134 1 603 . 1 1 64 64 VAL CA C 13 67.388 0.184 . 1 . . . A 64 VAL CA . 30134 1 604 . 1 1 64 64 VAL CB C 13 31.191 0.115 . 1 . . . A 64 VAL CB . 30134 1 605 . 1 1 64 64 VAL CG1 C 13 23.980 0.037 . 1 . . . A 64 VAL CG1 . 30134 1 606 . 1 1 64 64 VAL CG2 C 13 21.884 0.968 . 1 . . . A 64 VAL CG2 . 30134 1 607 . 1 1 64 64 VAL N N 15 119.684 0.000 . 1 . . . A 64 VAL N . 30134 1 608 . 1 1 65 65 ALA H H 1 8.919 0.005 . 1 . . . A 65 ALA H . 30134 1 609 . 1 1 65 65 ALA HA H 1 3.823 0.005 . 1 . . . A 65 ALA HA . 30134 1 610 . 1 1 65 65 ALA HB1 H 1 1.410 0.001 . 1 . . . A 65 ALA HB1 . 30134 1 611 . 1 1 65 65 ALA HB2 H 1 1.410 0.001 . 1 . . . A 65 ALA HB2 . 30134 1 612 . 1 1 65 65 ALA HB3 H 1 1.410 0.001 . 1 . . . A 65 ALA HB3 . 30134 1 613 . 1 1 65 65 ALA C C 13 178.561 0.009 . 1 . . . A 65 ALA C . 30134 1 614 . 1 1 65 65 ALA CA C 13 56.065 0.077 . 1 . . . A 65 ALA CA . 30134 1 615 . 1 1 65 65 ALA CB C 13 17.326 0.083 . 1 . . . A 65 ALA CB . 30134 1 616 . 1 1 65 65 ALA N N 15 122.157 0.000 . 1 . . . A 65 ALA N . 30134 1 617 . 1 1 66 66 GLY H H 1 7.581 0.000 . 1 . . . A 66 GLY H . 30134 1 618 . 1 1 66 66 GLY HA2 H 1 3.859 0.013 . 2 . . . A 66 GLY HA2 . 30134 1 619 . 1 1 66 66 GLY HA3 H 1 3.859 0.013 . 2 . . . A 66 GLY HA3 . 30134 1 620 . 1 1 66 66 GLY C C 13 176.225 0.032 . 1 . . . A 66 GLY C . 30134 1 621 . 1 1 66 66 GLY CA C 13 47.244 0.178 . 1 . . . A 66 GLY CA . 30134 1 622 . 1 1 66 66 GLY N N 15 103.438 0.000 . 1 . . . A 66 GLY N . 30134 1 623 . 1 1 67 67 TYR H H 1 7.511 0.002 . 1 . . . A 67 TYR H . 30134 1 624 . 1 1 67 67 TYR HA H 1 4.684 0.000 . 1 . . . A 67 TYR HA . 30134 1 625 . 1 1 67 67 TYR HB2 H 1 3.206 0.000 . 2 . . . A 67 TYR HB2 . 30134 1 626 . 1 1 67 67 TYR HB3 H 1 3.389 0.001 . 2 . . . A 67 TYR HB3 . 30134 1 627 . 1 1 67 67 TYR HD1 H 1 7.103 0.007 . 1 . . . A 67 TYR HD1 . 30134 1 628 . 1 1 67 67 TYR HE1 H 1 6.856 0.000 . 1 . . . A 67 TYR HE1 . 30134 1 629 . 1 1 67 67 TYR C C 13 178.561 0.009 . 1 . . . A 67 TYR C . 30134 1 630 . 1 1 67 67 TYR CA C 13 59.978 0.093 . 1 . . . A 67 TYR CA . 30134 1 631 . 1 1 67 67 TYR CB C 13 37.505 0.080 . 1 . . . A 67 TYR CB . 30134 1 632 . 1 1 67 67 TYR CD1 C 13 131.934 0.000 . 1 . . . A 67 TYR CD1 . 30134 1 633 . 1 1 67 67 TYR CE1 C 13 118.485 0.000 . 1 . . . A 67 TYR CE1 . 30134 1 634 . 1 1 67 67 TYR N N 15 122.509 0.000 . 1 . . . A 67 TYR N . 30134 1 635 . 1 1 68 68 ILE H H 1 8.622 0.000 . 1 . . . A 68 ILE H . 30134 1 636 . 1 1 68 68 ILE HA H 1 3.466 0.005 . 1 . . . A 68 ILE HA . 30134 1 637 . 1 1 68 68 ILE HB H 1 1.630 0.160 . 1 . . . A 68 ILE HB . 30134 1 638 . 1 1 68 68 ILE HG12 H 1 0.988 0.003 . 2 . . . A 68 ILE HG12 . 30134 1 639 . 1 1 68 68 ILE HG13 H 1 1.006 0.012 . 2 . . . A 68 ILE HG13 . 30134 1 640 . 1 1 68 68 ILE HG21 H 1 0.864 0.002 . 1 . . . A 68 ILE HG21 . 30134 1 641 . 1 1 68 68 ILE HG22 H 1 0.864 0.002 . 1 . . . A 68 ILE HG22 . 30134 1 642 . 1 1 68 68 ILE HG23 H 1 0.864 0.002 . 1 . . . A 68 ILE HG23 . 30134 1 643 . 1 1 68 68 ILE HD11 H 1 0.007 0.005 . 1 . . . A 68 ILE HD11 . 30134 1 644 . 1 1 68 68 ILE HD12 H 1 0.007 0.005 . 1 . . . A 68 ILE HD12 . 30134 1 645 . 1 1 68 68 ILE HD13 H 1 0.007 0.005 . 1 . . . A 68 ILE HD13 . 30134 1 646 . 1 1 68 68 ILE C C 13 176.471 0.004 . 1 . . . A 68 ILE C . 30134 1 647 . 1 1 68 68 ILE CA C 13 66.804 0.107 . 1 . . . A 68 ILE CA . 30134 1 648 . 1 1 68 68 ILE CB C 13 37.776 0.151 . 1 . . . A 68 ILE CB . 30134 1 649 . 1 1 68 68 ILE CG1 C 13 27.724 0.301 . 1 . . . A 68 ILE CG1 . 30134 1 650 . 1 1 68 68 ILE CG2 C 13 19.073 0.080 . 1 . . . A 68 ILE CG2 . 30134 1 651 . 1 1 68 68 ILE CD1 C 13 14.747 0.039 . 1 . . . A 68 ILE CD1 . 30134 1 652 . 1 1 68 68 ILE N N 15 123.397 0.000 . 1 . . . A 68 ILE N . 30134 1 653 . 1 1 69 69 LYS H H 1 8.651 0.000 . 1 . . . A 69 LYS H . 30134 1 654 . 1 1 69 69 LYS HA H 1 4.159 0.000 . 1 . . . A 69 LYS HA . 30134 1 655 . 1 1 69 69 LYS HB2 H 1 1.567 0.000 . 2 . . . A 69 LYS HB2 . 30134 1 656 . 1 1 69 69 LYS HB3 H 1 2.073 0.000 . 2 . . . A 69 LYS HB3 . 30134 1 657 . 1 1 69 69 LYS C C 13 176.766 0.008 . 1 . . . A 69 LYS C . 30134 1 658 . 1 1 69 69 LYS CA C 13 59.005 0.043 . 1 . . . A 69 LYS CA . 30134 1 659 . 1 1 69 69 LYS CB C 13 31.684 0.079 . 1 . . . A 69 LYS CB . 30134 1 660 . 1 1 69 69 LYS N N 15 120.666 0.000 . 1 . . . A 69 LYS N . 30134 1 661 . 1 1 70 70 GLN H H 1 8.035 0.000 . 1 . . . A 70 GLN H . 30134 1 662 . 1 1 70 70 GLN HA H 1 4.058 0.000 . 1 . . . A 70 GLN HA . 30134 1 663 . 1 1 70 70 GLN HB2 H 1 2.088 0.000 . 2 . . . A 70 GLN HB2 . 30134 1 664 . 1 1 70 70 GLN HB3 H 1 2.182 0.000 . 2 . . . A 70 GLN HB3 . 30134 1 665 . 1 1 70 70 GLN C C 13 177.175 0.004 . 1 . . . A 70 GLN C . 30134 1 666 . 1 1 70 70 GLN CA C 13 59.213 0.047 . 1 . . . A 70 GLN CA . 30134 1 667 . 1 1 70 70 GLN CB C 13 28.775 0.146 . 1 . . . A 70 GLN CB . 30134 1 668 . 1 1 70 70 GLN N N 15 117.457 0.000 . 1 . . . A 70 GLN N . 30134 1 669 . 1 1 71 71 THR H H 1 7.840 0.000 . 1 . . . A 71 THR H . 30134 1 670 . 1 1 71 71 THR HA H 1 4.314 0.000 . 1 . . . A 71 THR HA . 30134 1 671 . 1 1 71 71 THR HG21 H 1 1.530 0.000 . 1 . . . A 71 THR HG21 . 30134 1 672 . 1 1 71 71 THR HG22 H 1 1.530 0.000 . 1 . . . A 71 THR HG22 . 30134 1 673 . 1 1 71 71 THR HG23 H 1 1.530 0.000 . 1 . . . A 71 THR HG23 . 30134 1 674 . 1 1 71 71 THR C C 13 175.788 0.000 . 1 . . . A 71 THR C . 30134 1 675 . 1 1 71 71 THR CA C 13 67.514 0.060 . 1 . . . A 71 THR CA . 30134 1 676 . 1 1 71 71 THR CB C 13 68.774 0.100 . 1 . . . A 71 THR CB . 30134 1 677 . 1 1 71 71 THR CG2 C 13 24.175 0.000 . 1 . . . A 71 THR CG2 . 30134 1 678 . 1 1 71 71 THR N N 15 116.947 0.000 . 1 . . . A 71 THR N . 30134 1 679 . 1 1 72 72 LEU H H 1 8.703 0.005 . 1 . . . A 72 LEU H . 30134 1 680 . 1 1 72 72 LEU HA H 1 3.964 0.000 . 1 . . . A 72 LEU HA . 30134 1 681 . 1 1 72 72 LEU HB2 H 1 1.691 0.000 . 2 . . . A 72 LEU HB2 . 30134 1 682 . 1 1 72 72 LEU HB3 H 1 1.691 0.000 . 2 . . . A 72 LEU HB3 . 30134 1 683 . 1 1 72 72 LEU HD11 H 1 0.727 0.000 . 2 . . . A 72 LEU HD11 . 30134 1 684 . 1 1 72 72 LEU HD12 H 1 0.727 0.000 . 2 . . . A 72 LEU HD12 . 30134 1 685 . 1 1 72 72 LEU HD13 H 1 0.727 0.000 . 2 . . . A 72 LEU HD13 . 30134 1 686 . 1 1 72 72 LEU HD21 H 1 0.866 0.000 . 2 . . . A 72 LEU HD21 . 30134 1 687 . 1 1 72 72 LEU HD22 H 1 0.866 0.000 . 2 . . . A 72 LEU HD22 . 30134 1 688 . 1 1 72 72 LEU HD23 H 1 0.866 0.000 . 2 . . . A 72 LEU HD23 . 30134 1 689 . 1 1 72 72 LEU C C 13 178.856 0.029 . 1 . . . A 72 LEU C . 30134 1 690 . 1 1 72 72 LEU CA C 13 58.700 0.030 . 1 . . . A 72 LEU CA . 30134 1 691 . 1 1 72 72 LEU CB C 13 42.301 0.072 . 1 . . . A 72 LEU CB . 30134 1 692 . 1 1 72 72 LEU CD1 C 13 24.846 0.000 . 1 . . . A 72 LEU CD1 . 30134 1 693 . 1 1 72 72 LEU CD2 C 13 25.210 0.000 . 1 . . . A 72 LEU CD2 . 30134 1 694 . 1 1 72 72 LEU N N 15 123.218 0.000 . 1 . . . A 72 LEU N . 30134 1 695 . 1 1 73 73 ASP H H 1 8.833 0.005 . 1 . . . A 73 ASP H . 30134 1 696 . 1 1 73 73 ASP HA H 1 4.392 0.000 . 1 . . . A 73 ASP HA . 30134 1 697 . 1 1 73 73 ASP HB2 H 1 2.322 0.000 . 2 . . . A 73 ASP HB2 . 30134 1 698 . 1 1 73 73 ASP HB3 H 1 2.322 0.000 . 2 . . . A 73 ASP HB3 . 30134 1 699 . 1 1 73 73 ASP C C 13 178.738 0.044 . 1 . . . A 73 ASP C . 30134 1 700 . 1 1 73 73 ASP CA C 13 57.739 0.103 . 1 . . . A 73 ASP CA . 30134 1 701 . 1 1 73 73 ASP CB C 13 39.589 0.044 . 1 . . . A 73 ASP CB . 30134 1 702 . 1 1 73 73 ASP N N 15 121.365 0.000 . 1 . . . A 73 ASP N . 30134 1 703 . 1 1 74 74 ASN H H 1 8.428 0.000 . 1 . . . A 74 ASN H . 30134 1 704 . 1 1 74 74 ASN C C 13 177.105 0.004 . 1 . . . A 74 ASN C . 30134 1 705 . 1 1 74 74 ASN CA C 13 55.899 0.043 . 1 . . . A 74 ASN CA . 30134 1 706 . 1 1 74 74 ASN CB C 13 36.953 0.055 . 1 . . . A 74 ASN CB . 30134 1 707 . 1 1 74 74 ASN N N 15 120.778 0.000 . 1 . . . A 74 ASN N . 30134 1 708 . 1 1 75 75 GLU H H 1 9.114 0.004 . 1 . . . A 75 GLU H . 30134 1 709 . 1 1 75 75 GLU HA H 1 3.886 0.000 . 1 . . . A 75 GLU HA . 30134 1 710 . 1 1 75 75 GLU HB2 H 1 1.845 0.271 . 2 . . . A 75 GLU HB2 . 30134 1 711 . 1 1 75 75 GLU HB3 H 1 1.956 0.381 . 2 . . . A 75 GLU HB3 . 30134 1 712 . 1 1 75 75 GLU HG2 H 1 1.991 0.000 . 2 . . . A 75 GLU HG2 . 30134 1 713 . 1 1 75 75 GLU HG3 H 1 2.650 0.000 . 2 . . . A 75 GLU HG3 . 30134 1 714 . 1 1 75 75 GLU C C 13 177.999 0.026 . 1 . . . A 75 GLU C . 30134 1 715 . 1 1 75 75 GLU CA C 13 61.541 0.081 . 1 . . . A 75 GLU CA . 30134 1 716 . 1 1 75 75 GLU CB C 13 30.102 0.171 . 1 . . . A 75 GLU CB . 30134 1 717 . 1 1 75 75 GLU CG C 13 37.953 0.043 . 1 . . . A 75 GLU CG . 30134 1 718 . 1 1 75 75 GLU N N 15 121.610 0.000 . 1 . . . A 75 GLU N . 30134 1 719 . 1 1 76 76 GLN H H 1 8.163 0.000 . 1 . . . A 76 GLN H . 30134 1 720 . 1 1 76 76 GLN HA H 1 4.065 0.000 . 1 . . . A 76 GLN HA . 30134 1 721 . 1 1 76 76 GLN HB2 H 1 2.267 0.000 . 2 . . . A 76 GLN HB2 . 30134 1 722 . 1 1 76 76 GLN HB3 H 1 2.267 0.000 . 2 . . . A 76 GLN HB3 . 30134 1 723 . 1 1 76 76 GLN C C 13 178.602 0.049 . 1 . . . A 76 GLN C . 30134 1 724 . 1 1 76 76 GLN CA C 13 59.261 0.072 . 1 . . . A 76 GLN CA . 30134 1 725 . 1 1 76 76 GLN CB C 13 27.831 0.011 . 1 . . . A 76 GLN CB . 30134 1 726 . 1 1 76 76 GLN N N 15 118.364 0.000 . 1 . . . A 76 GLN N . 30134 1 727 . 1 1 77 77 LEU H H 1 7.627 0.000 . 1 . . . A 77 LEU H . 30134 1 728 . 1 1 77 77 LEU HA H 1 4.166 0.000 . 1 . . . A 77 LEU HA . 30134 1 729 . 1 1 77 77 LEU HD11 H 1 0.997 0.000 . 2 . . . A 77 LEU HD11 . 30134 1 730 . 1 1 77 77 LEU HD12 H 1 0.997 0.000 . 2 . . . A 77 LEU HD12 . 30134 1 731 . 1 1 77 77 LEU HD13 H 1 0.997 0.000 . 2 . . . A 77 LEU HD13 . 30134 1 732 . 1 1 77 77 LEU HD21 H 1 0.927 0.000 . 2 . . . A 77 LEU HD21 . 30134 1 733 . 1 1 77 77 LEU HD22 H 1 0.927 0.000 . 2 . . . A 77 LEU HD22 . 30134 1 734 . 1 1 77 77 LEU HD23 H 1 0.927 0.000 . 2 . . . A 77 LEU HD23 . 30134 1 735 . 1 1 77 77 LEU C C 13 179.460 0.026 . 1 . . . A 77 LEU C . 30134 1 736 . 1 1 77 77 LEU CA C 13 58.114 0.094 . 1 . . . A 77 LEU CA . 30134 1 737 . 1 1 77 77 LEU CB C 13 41.818 0.126 . 1 . . . A 77 LEU CB . 30134 1 738 . 1 1 77 77 LEU CD1 C 13 25.517 0.000 . 1 . . . A 77 LEU CD1 . 30134 1 739 . 1 1 77 77 LEU CD2 C 13 22.928 0.000 . 1 . . . A 77 LEU CD2 . 30134 1 740 . 1 1 77 77 LEU N N 15 120.866 0.000 . 1 . . . A 77 LEU N . 30134 1 741 . 1 1 78 78 LEU H H 1 8.856 0.004 . 1 . . . A 78 LEU H . 30134 1 742 . 1 1 78 78 LEU HA H 1 3.917 0.000 . 1 . . . A 78 LEU HA . 30134 1 743 . 1 1 78 78 LEU HB2 H 1 1.544 0.000 . 2 . . . A 78 LEU HB2 . 30134 1 744 . 1 1 78 78 LEU HB3 H 1 2.042 0.000 . 2 . . . A 78 LEU HB3 . 30134 1 745 . 1 1 78 78 LEU HD11 H 1 0.848 0.000 . 2 . . . A 78 LEU HD11 . 30134 1 746 . 1 1 78 78 LEU HD12 H 1 0.848 0.000 . 2 . . . A 78 LEU HD12 . 30134 1 747 . 1 1 78 78 LEU HD13 H 1 0.848 0.000 . 2 . . . A 78 LEU HD13 . 30134 1 748 . 1 1 78 78 LEU HD21 H 1 0.797 0.000 . 2 . . . A 78 LEU HD21 . 30134 1 749 . 1 1 78 78 LEU HD22 H 1 0.797 0.000 . 2 . . . A 78 LEU HD22 . 30134 1 750 . 1 1 78 78 LEU HD23 H 1 0.797 0.000 . 2 . . . A 78 LEU HD23 . 30134 1 751 . 1 1 78 78 LEU C C 13 177.281 0.004 . 1 . . . A 78 LEU C . 30134 1 752 . 1 1 78 78 LEU CA C 13 58.625 0.140 . 1 . . . A 78 LEU CA . 30134 1 753 . 1 1 78 78 LEU CB C 13 42.114 0.086 . 1 . . . A 78 LEU CB . 30134 1 754 . 1 1 78 78 LEU CD1 C 13 24.500 0.000 . 1 . . . A 78 LEU CD1 . 30134 1 755 . 1 1 78 78 LEU CD2 C 13 26.951 0.000 . 1 . . . A 78 LEU CD2 . 30134 1 756 . 1 1 78 78 LEU N N 15 122.639 0.000 . 1 . . . A 78 LEU N . 30134 1 757 . 1 1 79 79 LYS H H 1 8.690 0.005 . 1 . . . A 79 LYS H . 30134 1 758 . 1 1 79 79 LYS HA H 1 3.855 0.000 . 1 . . . A 79 LYS HA . 30134 1 759 . 1 1 79 79 LYS HB2 H 1 1.925 0.000 . 2 . . . A 79 LYS HB2 . 30134 1 760 . 1 1 79 79 LYS HB3 H 1 1.925 0.000 . 2 . . . A 79 LYS HB3 . 30134 1 761 . 1 1 79 79 LYS C C 13 177.892 0.009 . 1 . . . A 79 LYS C . 30134 1 762 . 1 1 79 79 LYS CA C 13 61.202 0.068 . 1 . . . A 79 LYS CA . 30134 1 763 . 1 1 79 79 LYS CB C 13 32.156 0.035 . 1 . . . A 79 LYS CB . 30134 1 764 . 1 1 79 79 LYS N N 15 118.324 0.000 . 1 . . . A 79 LYS N . 30134 1 765 . 1 1 80 80 GLY H H 1 7.555 0.000 . 1 . . . A 80 GLY H . 30134 1 766 . 1 1 80 80 GLY HA2 H 1 3.962 0.002 . 2 . . . A 80 GLY HA2 . 30134 1 767 . 1 1 80 80 GLY HA3 H 1 3.964 0.000 . 2 . . . A 80 GLY HA3 . 30134 1 768 . 1 1 80 80 GLY C C 13 175.943 0.004 . 1 . . . A 80 GLY C . 30134 1 769 . 1 1 80 80 GLY CA C 13 47.443 0.383 . 1 . . . A 80 GLY CA . 30134 1 770 . 1 1 80 80 GLY N N 15 105.384 0.000 . 1 . . . A 80 GLY N . 30134 1 771 . 1 1 81 81 LEU H H 1 7.789 0.000 . 1 . . . A 81 LEU H . 30134 1 772 . 1 1 81 81 LEU HA H 1 4.283 0.000 . 1 . . . A 81 LEU HA . 30134 1 773 . 1 1 81 81 LEU HD11 H 1 0.993 0.000 . 2 . . . A 81 LEU HD11 . 30134 1 774 . 1 1 81 81 LEU HD12 H 1 0.993 0.000 . 2 . . . A 81 LEU HD12 . 30134 1 775 . 1 1 81 81 LEU HD13 H 1 0.993 0.000 . 2 . . . A 81 LEU HD13 . 30134 1 776 . 1 1 81 81 LEU HD21 H 1 0.875 0.000 . 2 . . . A 81 LEU HD21 . 30134 1 777 . 1 1 81 81 LEU HD22 H 1 0.875 0.000 . 2 . . . A 81 LEU HD22 . 30134 1 778 . 1 1 81 81 LEU HD23 H 1 0.875 0.000 . 2 . . . A 81 LEU HD23 . 30134 1 779 . 1 1 81 81 LEU C C 13 179.644 0.036 . 1 . . . A 81 LEU C . 30134 1 780 . 1 1 81 81 LEU CA C 13 58.168 0.084 . 1 . . . A 81 LEU CA . 30134 1 781 . 1 1 81 81 LEU CB C 13 41.819 0.029 . 1 . . . A 81 LEU CB . 30134 1 782 . 1 1 81 81 LEU CD1 C 13 22.560 0.000 . 1 . . . A 81 LEU CD1 . 30134 1 783 . 1 1 81 81 LEU CD2 C 13 27.466 0.000 . 1 . . . A 81 LEU CD2 . 30134 1 784 . 1 1 81 81 LEU N N 15 122.865 0.000 . 1 . . . A 81 LEU N . 30134 1 785 . 1 1 82 82 LEU H H 1 9.028 0.000 . 1 . . . A 82 LEU H . 30134 1 786 . 1 1 82 82 LEU HA H 1 4.089 0.000 . 1 . . . A 82 LEU HA . 30134 1 787 . 1 1 82 82 LEU HD11 H 1 0.915 0.000 . 2 . . . A 82 LEU HD11 . 30134 1 788 . 1 1 82 82 LEU HD12 H 1 0.915 0.000 . 2 . . . A 82 LEU HD12 . 30134 1 789 . 1 1 82 82 LEU HD13 H 1 0.915 0.000 . 2 . . . A 82 LEU HD13 . 30134 1 790 . 1 1 82 82 LEU HD21 H 1 1.025 0.000 . 2 . . . A 82 LEU HD21 . 30134 1 791 . 1 1 82 82 LEU HD22 H 1 1.025 0.000 . 2 . . . A 82 LEU HD22 . 30134 1 792 . 1 1 82 82 LEU HD23 H 1 1.025 0.000 . 2 . . . A 82 LEU HD23 . 30134 1 793 . 1 1 82 82 LEU C C 13 177.471 0.000 . 1 . . . A 82 LEU C . 30134 1 794 . 1 1 82 82 LEU CA C 13 58.919 0.257 . 1 . . . A 82 LEU CA . 30134 1 795 . 1 1 82 82 LEU CB C 13 41.912 0.056 . 1 . . . A 82 LEU CB . 30134 1 796 . 1 1 82 82 LEU CD1 C 13 26.247 0.000 . 1 . . . A 82 LEU CD1 . 30134 1 797 . 1 1 82 82 LEU CD2 C 13 25.284 0.000 . 1 . . . A 82 LEU CD2 . 30134 1 798 . 1 1 82 82 LEU N N 15 121.751 0.000 . 1 . . . A 82 LEU N . 30134 1 799 . 1 1 83 83 GLN H H 1 8.342 0.000 . 1 . . . A 83 GLN H . 30134 1 800 . 1 1 83 83 GLN HA H 1 4.377 0.000 . 1 . . . A 83 GLN HA . 30134 1 801 . 1 1 83 83 GLN HB2 H 1 1.575 0.000 . 2 . . . A 83 GLN HB2 . 30134 1 802 . 1 1 83 83 GLN HB3 H 1 1.575 0.000 . 2 . . . A 83 GLN HB3 . 30134 1 803 . 1 1 83 83 GLN C C 13 176.774 0.089 . 1 . . . A 83 GLN C . 30134 1 804 . 1 1 83 83 GLN CA C 13 58.870 0.065 . 1 . . . A 83 GLN CA . 30134 1 805 . 1 1 83 83 GLN CB C 13 28.235 0.085 . 1 . . . A 83 GLN CB . 30134 1 806 . 1 1 83 83 GLN N N 15 118.548 0.000 . 1 . . . A 83 GLN N . 30134 1 807 . 1 1 84 84 GLN H H 1 7.682 0.000 . 1 . . . A 84 GLN H . 30134 1 808 . 1 1 84 84 GLN HB2 H 1 2.267 0.000 . 2 . . . A 84 GLN HB2 . 30134 1 809 . 1 1 84 84 GLN HB3 H 1 2.267 0.000 . 2 . . . A 84 GLN HB3 . 30134 1 810 . 1 1 84 84 GLN C C 13 177.719 0.001 . 1 . . . A 84 GLN C . 30134 1 811 . 1 1 84 84 GLN CA C 13 59.239 0.075 . 1 . . . A 84 GLN CA . 30134 1 812 . 1 1 84 84 GLN CB C 13 28.395 0.048 . 1 . . . A 84 GLN CB . 30134 1 813 . 1 1 84 84 GLN N N 15 117.216 0.005 . 1 . . . A 84 GLN N . 30134 1 814 . 1 1 85 85 ARG H H 1 7.727 0.003 . 1 . . . A 85 ARG H . 30134 1 815 . 1 1 85 85 ARG HA H 1 4.166 0.000 . 1 . . . A 85 ARG HA . 30134 1 816 . 1 1 85 85 ARG HB2 H 1 1.855 0.000 . 2 . . . A 85 ARG HB2 . 30134 1 817 . 1 1 85 85 ARG HB3 H 1 1.855 0.000 . 2 . . . A 85 ARG HB3 . 30134 1 818 . 1 1 85 85 ARG C C 13 176.904 0.006 . 1 . . . A 85 ARG C . 30134 1 819 . 1 1 85 85 ARG CA C 13 57.289 0.095 . 1 . . . A 85 ARG CA . 30134 1 820 . 1 1 85 85 ARG CB C 13 28.387 0.040 . 1 . . . A 85 ARG CB . 30134 1 821 . 1 1 85 85 ARG N N 15 121.209 0.000 . 1 . . . A 85 ARG N . 30134 1 822 . 1 1 86 86 LEU H H 1 8.615 0.002 . 1 . . . A 86 LEU H . 30134 1 823 . 1 1 86 86 LEU HA H 1 4.345 0.000 . 1 . . . A 86 LEU HA . 30134 1 824 . 1 1 86 86 LEU HB2 H 1 1.622 0.232 . 2 . . . A 86 LEU HB2 . 30134 1 825 . 1 1 86 86 LEU HB3 H 1 1.621 0.000 . 2 . . . A 86 LEU HB3 . 30134 1 826 . 1 1 86 86 LEU HD11 H 1 0.558 0.000 . 2 . . . A 86 LEU HD11 . 30134 1 827 . 1 1 86 86 LEU HD12 H 1 0.558 0.000 . 2 . . . A 86 LEU HD12 . 30134 1 828 . 1 1 86 86 LEU HD13 H 1 0.558 0.000 . 2 . . . A 86 LEU HD13 . 30134 1 829 . 1 1 86 86 LEU HD21 H 1 0.072 0.000 . 2 . . . A 86 LEU HD21 . 30134 1 830 . 1 1 86 86 LEU HD22 H 1 0.072 0.000 . 2 . . . A 86 LEU HD22 . 30134 1 831 . 1 1 86 86 LEU HD23 H 1 0.072 0.000 . 2 . . . A 86 LEU HD23 . 30134 1 832 . 1 1 86 86 LEU C C 13 178.394 0.053 . 1 . . . A 86 LEU C . 30134 1 833 . 1 1 86 86 LEU CA C 13 59.100 0.151 . 1 . . . A 86 LEU CA . 30134 1 834 . 1 1 86 86 LEU CB C 13 40.264 0.164 . 1 . . . A 86 LEU CB . 30134 1 835 . 1 1 86 86 LEU CD1 C 13 25.877 0.000 . 1 . . . A 86 LEU CD1 . 30134 1 836 . 1 1 86 86 LEU CD2 C 13 24.018 0.000 . 1 . . . A 86 LEU CD2 . 30134 1 837 . 1 1 86 86 LEU N N 15 121.650 0.000 . 1 . . . A 86 LEU N . 30134 1 838 . 1 1 87 87 ASP H H 1 8.338 0.004 . 1 . . . A 87 ASP H . 30134 1 839 . 1 1 87 87 ASP HA H 1 4.026 0.000 . 1 . . . A 87 ASP HA . 30134 1 840 . 1 1 87 87 ASP HB2 H 1 2.781 0.000 . 2 . . . A 87 ASP HB2 . 30134 1 841 . 1 1 87 87 ASP HB3 H 1 2.781 0.000 . 2 . . . A 87 ASP HB3 . 30134 1 842 . 1 1 87 87 ASP C C 13 178.546 0.016 . 1 . . . A 87 ASP C . 30134 1 843 . 1 1 87 87 ASP CA C 13 57.886 0.049 . 1 . . . A 87 ASP CA . 30134 1 844 . 1 1 87 87 ASP CB C 13 40.019 0.049 . 1 . . . A 87 ASP CB . 30134 1 845 . 1 1 87 87 ASP N N 15 120.158 0.000 . 1 . . . A 87 ASP N . 30134 1 846 . 1 1 88 88 GLU H H 1 8.140 0.001 . 1 . . . A 88 GLU H . 30134 1 847 . 1 1 88 88 GLU HA H 1 4.042 0.000 . 1 . . . A 88 GLU HA . 30134 1 848 . 1 1 88 88 GLU HB2 H 1 2.221 0.000 . 2 . . . A 88 GLU HB2 . 30134 1 849 . 1 1 88 88 GLU HB3 H 1 2.221 0.000 . 2 . . . A 88 GLU HB3 . 30134 1 850 . 1 1 88 88 GLU C C 13 178.841 0.041 . 1 . . . A 88 GLU C . 30134 1 851 . 1 1 88 88 GLU CA C 13 59.623 0.065 . 1 . . . A 88 GLU CA . 30134 1 852 . 1 1 88 88 GLU CB C 13 29.947 0.007 . 1 . . . A 88 GLU CB . 30134 1 853 . 1 1 88 88 GLU N N 15 123.341 0.000 . 1 . . . A 88 GLU N . 30134 1 854 . 1 1 89 89 LEU H H 1 8.985 0.003 . 1 . . . A 89 LEU H . 30134 1 855 . 1 1 89 89 LEU HA H 1 3.801 0.000 . 1 . . . A 89 LEU HA . 30134 1 856 . 1 1 89 89 LEU HB2 H 1 2.314 0.000 . 2 . . . A 89 LEU HB2 . 30134 1 857 . 1 1 89 89 LEU HB3 H 1 2.314 0.000 . 2 . . . A 89 LEU HB3 . 30134 1 858 . 1 1 89 89 LEU HD11 H 1 0.906 0.000 . 2 . . . A 89 LEU HD11 . 30134 1 859 . 1 1 89 89 LEU HD12 H 1 0.906 0.000 . 2 . . . A 89 LEU HD12 . 30134 1 860 . 1 1 89 89 LEU HD13 H 1 0.906 0.000 . 2 . . . A 89 LEU HD13 . 30134 1 861 . 1 1 89 89 LEU HD21 H 1 0.741 0.000 . 2 . . . A 89 LEU HD21 . 30134 1 862 . 1 1 89 89 LEU HD22 H 1 0.741 0.000 . 2 . . . A 89 LEU HD22 . 30134 1 863 . 1 1 89 89 LEU HD23 H 1 0.741 0.000 . 2 . . . A 89 LEU HD23 . 30134 1 864 . 1 1 89 89 LEU C C 13 178.060 0.000 . 1 . . . A 89 LEU C . 30134 1 865 . 1 1 89 89 LEU CA C 13 58.222 0.055 . 1 . . . A 89 LEU CA . 30134 1 866 . 1 1 89 89 LEU CB C 13 43.209 0.039 . 1 . . . A 89 LEU CB . 30134 1 867 . 1 1 89 89 LEU CD1 C 13 26.206 0.000 . 1 . . . A 89 LEU CD1 . 30134 1 868 . 1 1 89 89 LEU CD2 C 13 22.435 0.000 . 1 . . . A 89 LEU CD2 . 30134 1 869 . 1 1 89 89 LEU N N 15 119.982 0.000 . 1 . . . A 89 LEU N . 30134 1 870 . 1 1 90 90 SER H H 1 8.828 0.009 . 1 . . . A 90 SER H . 30134 1 871 . 1 1 90 90 SER HA H 1 4.104 0.000 . 1 . . . A 90 SER HA . 30134 1 872 . 1 1 90 90 SER HB2 H 1 3.910 0.000 . 2 . . . A 90 SER HB2 . 30134 1 873 . 1 1 90 90 SER HB3 H 1 3.910 0.000 . 2 . . . A 90 SER HB3 . 30134 1 874 . 1 1 90 90 SER C C 13 176.470 0.000 . 1 . . . A 90 SER C . 30134 1 875 . 1 1 90 90 SER CA C 13 62.724 0.073 . 1 . . . A 90 SER CA . 30134 1 876 . 1 1 90 90 SER N N 15 114.410 0.000 . 1 . . . A 90 SER N . 30134 1 877 . 1 1 91 91 SER H H 1 7.627 0.000 . 1 . . . A 91 SER H . 30134 1 878 . 1 1 91 91 SER C C 13 174.609 0.000 . 1 . . . A 91 SER C . 30134 1 879 . 1 1 91 91 SER CA C 13 61.480 0.077 . 1 . . . A 91 SER CA . 30134 1 880 . 1 1 91 91 SER CB C 13 62.910 0.104 . 1 . . . A 91 SER CB . 30134 1 881 . 1 1 91 91 SER N N 15 116.801 0.000 . 1 . . . A 91 SER N . 30134 1 882 . 1 1 92 92 LEU H H 1 7.900 0.000 . 1 . . . A 92 LEU H . 30134 1 883 . 1 1 92 92 LEU HA H 1 3.790 0.028 . 1 . . . A 92 LEU HA . 30134 1 884 . 1 1 92 92 LEU HB2 H 1 1.621 0.000 . 2 . . . A 92 LEU HB2 . 30134 1 885 . 1 1 92 92 LEU HB3 H 1 1.621 0.000 . 2 . . . A 92 LEU HB3 . 30134 1 886 . 1 1 92 92 LEU HD11 H 1 0.486 0.000 . 2 . . . A 92 LEU HD11 . 30134 1 887 . 1 1 92 92 LEU HD12 H 1 0.486 0.000 . 2 . . . A 92 LEU HD12 . 30134 1 888 . 1 1 92 92 LEU HD13 H 1 0.486 0.000 . 2 . . . A 92 LEU HD13 . 30134 1 889 . 1 1 92 92 LEU HD21 H 1 0.770 0.000 . 2 . . . A 92 LEU HD21 . 30134 1 890 . 1 1 92 92 LEU HD22 H 1 0.770 0.000 . 2 . . . A 92 LEU HD22 . 30134 1 891 . 1 1 92 92 LEU HD23 H 1 0.770 0.000 . 2 . . . A 92 LEU HD23 . 30134 1 892 . 1 1 92 92 LEU C C 13 178.518 0.000 . 1 . . . A 92 LEU C . 30134 1 893 . 1 1 92 92 LEU CA C 13 57.971 0.075 . 1 . . . A 92 LEU CA . 30134 1 894 . 1 1 92 92 LEU CB C 13 42.039 0.063 . 1 . . . A 92 LEU CB . 30134 1 895 . 1 1 92 92 LEU CD1 C 13 24.688 0.000 . 1 . . . A 92 LEU CD1 . 30134 1 896 . 1 1 92 92 LEU CD2 C 13 22.787 0.000 . 1 . . . A 92 LEU CD2 . 30134 1 897 . 1 1 92 92 LEU N N 15 123.261 0.000 . 1 . . . A 92 LEU N . 30134 1 898 . 1 1 93 93 ILE H H 1 8.323 0.000 . 1 . . . A 93 ILE H . 30134 1 899 . 1 1 93 93 ILE HA H 1 3.835 0.003 . 1 . . . A 93 ILE HA . 30134 1 900 . 1 1 93 93 ILE HB H 1 1.779 0.008 . 1 . . . A 93 ILE HB . 30134 1 901 . 1 1 93 93 ILE HG12 H 1 1.002 0.001 . 2 . . . A 93 ILE HG12 . 30134 1 902 . 1 1 93 93 ILE HG13 H 1 1.722 0.000 . 2 . . . A 93 ILE HG13 . 30134 1 903 . 1 1 93 93 ILE HG21 H 1 0.864 0.006 . 1 . . . A 93 ILE HG21 . 30134 1 904 . 1 1 93 93 ILE HG22 H 1 0.864 0.006 . 1 . . . A 93 ILE HG22 . 30134 1 905 . 1 1 93 93 ILE HG23 H 1 0.864 0.006 . 1 . . . A 93 ILE HG23 . 30134 1 906 . 1 1 93 93 ILE HD11 H 1 0.601 0.016 . 1 . . . A 93 ILE HD11 . 30134 1 907 . 1 1 93 93 ILE HD12 H 1 0.601 0.016 . 1 . . . A 93 ILE HD12 . 30134 1 908 . 1 1 93 93 ILE HD13 H 1 0.601 0.016 . 1 . . . A 93 ILE HD13 . 30134 1 909 . 1 1 93 93 ILE C C 13 176.349 0.043 . 1 . . . A 93 ILE C . 30134 1 910 . 1 1 93 93 ILE CA C 13 64.605 0.168 . 1 . . . A 93 ILE CA . 30134 1 911 . 1 1 93 93 ILE CB C 13 38.918 0.179 . 1 . . . A 93 ILE CB . 30134 1 912 . 1 1 93 93 ILE CG1 C 13 30.022 0.067 . 1 . . . A 93 ILE CG1 . 30134 1 913 . 1 1 93 93 ILE CG2 C 13 17.861 0.054 . 1 . . . A 93 ILE CG2 . 30134 1 914 . 1 1 93 93 ILE CD1 C 13 13.852 0.074 . 1 . . . A 93 ILE CD1 . 30134 1 915 . 1 1 93 93 ILE N N 15 117.264 0.000 . 1 . . . A 93 ILE N . 30134 1 916 . 1 1 94 94 GLY H H 1 7.708 0.000 . 1 . . . A 94 GLY H . 30134 1 917 . 1 1 94 94 GLY HA2 H 1 3.917 0.000 . 2 . . . A 94 GLY HA2 . 30134 1 918 . 1 1 94 94 GLY HA3 H 1 3.917 0.000 . 2 . . . A 94 GLY HA3 . 30134 1 919 . 1 1 94 94 GLY C C 13 173.485 0.033 . 1 . . . A 94 GLY C . 30134 1 920 . 1 1 94 94 GLY CA C 13 46.134 0.038 . 1 . . . A 94 GLY CA . 30134 1 921 . 1 1 94 94 GLY N N 15 106.132 0.000 . 1 . . . A 94 GLY N . 30134 1 922 . 1 1 95 95 GLN H H 1 7.799 0.000 . 1 . . . A 95 GLN H . 30134 1 923 . 1 1 95 95 GLN HA H 1 4.275 0.000 . 1 . . . A 95 GLN HA . 30134 1 924 . 1 1 95 95 GLN HB2 H 1 2.034 0.000 . 2 . . . A 95 GLN HB2 . 30134 1 925 . 1 1 95 95 GLN HB3 H 1 2.096 0.000 . 2 . . . A 95 GLN HB3 . 30134 1 926 . 1 1 95 95 GLN C C 13 174.917 0.012 . 1 . . . A 95 GLN C . 30134 1 927 . 1 1 95 95 GLN CA C 13 56.572 0.082 . 1 . . . A 95 GLN CA . 30134 1 928 . 1 1 95 95 GLN CB C 13 29.313 0.058 . 1 . . . A 95 GLN CB . 30134 1 929 . 1 1 95 95 GLN N N 15 118.598 0.000 . 1 . . . A 95 GLN N . 30134 1 930 . 1 1 96 96 VAL H H 1 7.816 0.000 . 1 . . . A 96 VAL H . 30134 1 931 . 1 1 96 96 VAL HA H 1 4.106 0.008 . 1 . . . A 96 VAL HA . 30134 1 932 . 1 1 96 96 VAL HB H 1 2.092 0.006 . 1 . . . A 96 VAL HB . 30134 1 933 . 1 1 96 96 VAL HG11 H 1 0.900 0.032 . 2 . . . A 96 VAL HG11 . 30134 1 934 . 1 1 96 96 VAL HG12 H 1 0.900 0.032 . 2 . . . A 96 VAL HG12 . 30134 1 935 . 1 1 96 96 VAL HG13 H 1 0.900 0.032 . 2 . . . A 96 VAL HG13 . 30134 1 936 . 1 1 96 96 VAL HG21 H 1 0.943 0.004 . 2 . . . A 96 VAL HG21 . 30134 1 937 . 1 1 96 96 VAL HG22 H 1 0.943 0.004 . 2 . . . A 96 VAL HG22 . 30134 1 938 . 1 1 96 96 VAL HG23 H 1 0.943 0.004 . 2 . . . A 96 VAL HG23 . 30134 1 939 . 1 1 96 96 VAL C C 13 174.859 0.006 . 1 . . . A 96 VAL C . 30134 1 940 . 1 1 96 96 VAL CA C 13 62.742 0.130 . 1 . . . A 96 VAL CA . 30134 1 941 . 1 1 96 96 VAL CB C 13 32.437 0.164 . 1 . . . A 96 VAL CB . 30134 1 942 . 1 1 96 96 VAL CG1 C 13 21.553 0.240 . 1 . . . A 96 VAL CG1 . 30134 1 943 . 1 1 96 96 VAL CG2 C 13 20.488 0.176 . 1 . . . A 96 VAL CG2 . 30134 1 944 . 1 1 96 96 VAL N N 15 119.058 0.000 . 1 . . . A 96 VAL N . 30134 1 945 . 1 1 97 97 LEU H H 1 7.979 0.000 . 1 . . . A 97 LEU H . 30134 1 946 . 1 1 97 97 LEU HA H 1 4.333 0.011 . 1 . . . A 97 LEU HA . 30134 1 947 . 1 1 97 97 LEU HB2 H 1 1.466 0.000 . 2 . . . A 97 LEU HB2 . 30134 1 948 . 1 1 97 97 LEU HB3 H 1 1.466 0.000 . 2 . . . A 97 LEU HB3 . 30134 1 949 . 1 1 97 97 LEU HD11 H 1 0.818 0.000 . 2 . . . A 97 LEU HD11 . 30134 1 950 . 1 1 97 97 LEU HD12 H 1 0.818 0.000 . 2 . . . A 97 LEU HD12 . 30134 1 951 . 1 1 97 97 LEU HD13 H 1 0.818 0.000 . 2 . . . A 97 LEU HD13 . 30134 1 952 . 1 1 97 97 LEU HD21 H 1 0.793 0.000 . 2 . . . A 97 LEU HD21 . 30134 1 953 . 1 1 97 97 LEU HD22 H 1 0.793 0.000 . 2 . . . A 97 LEU HD22 . 30134 1 954 . 1 1 97 97 LEU HD23 H 1 0.793 0.000 . 2 . . . A 97 LEU HD23 . 30134 1 955 . 1 1 97 97 LEU C C 13 174.791 0.026 . 1 . . . A 97 LEU C . 30134 1 956 . 1 1 97 97 LEU CA C 13 55.133 0.450 . 1 . . . A 97 LEU CA . 30134 1 957 . 1 1 97 97 LEU CB C 13 42.227 0.035 . 1 . . . A 97 LEU CB . 30134 1 958 . 1 1 97 97 LEU CD1 C 13 25.268 0.000 . 1 . . . A 97 LEU CD1 . 30134 1 959 . 1 1 97 97 LEU CD2 C 13 23.330 0.000 . 1 . . . A 97 LEU CD2 . 30134 1 960 . 1 1 97 97 LEU N N 15 124.581 0.000 . 1 . . . A 97 LEU N . 30134 1 961 . 1 1 98 98 PHE H H 1 7.542 0.006 . 1 . . . A 98 PHE H . 30134 1 962 . 1 1 98 98 PHE HB2 H 1 2.980 0.000 . 2 . . . A 98 PHE HB2 . 30134 1 963 . 1 1 98 98 PHE HB3 H 1 3.160 0.000 . 2 . . . A 98 PHE HB3 . 30134 1 964 . 1 1 98 98 PHE HD1 H 1 7.226 0.006 . 1 . . . A 98 PHE HD1 . 30134 1 965 . 1 1 98 98 PHE HE1 H 1 7.301 0.000 . 1 . . . A 98 PHE HE1 . 30134 1 966 . 1 1 98 98 PHE HZ H 1 7.328 0.000 . 1 . . . A 98 PHE HZ . 30134 1 967 . 1 1 98 98 PHE C C 13 179.232 0.000 . 1 . . . A 98 PHE C . 30134 1 968 . 1 1 98 98 PHE CA C 13 59.212 0.032 . 1 . . . A 98 PHE CA . 30134 1 969 . 1 1 98 98 PHE CB C 13 40.343 0.027 . 1 . . . A 98 PHE CB . 30134 1 970 . 1 1 98 98 PHE CD1 C 13 132.130 0.000 . 1 . . . A 98 PHE CD1 . 30134 1 971 . 1 1 98 98 PHE CE1 C 13 131.478 0.000 . 1 . . . A 98 PHE CE1 . 30134 1 972 . 1 1 98 98 PHE CZ C 13 129.876 0.000 . 1 . . . A 98 PHE CZ . 30134 1 973 . 1 1 98 98 PHE N N 15 125.210 0.000 . 1 . . . A 98 PHE N . 30134 1 974 . 1 1 99 99 GLN CA C 13 56.091 0.058 . 1 . . . A 99 GLN CA . 30134 1 975 . 1 1 99 99 GLN CB C 13 29.674 0.105 . 1 . . . A 99 GLN CB . 30134 1 976 . 1 1 99 99 GLN CG C 13 33.760 0.000 . 1 . . . A 99 GLN CG . 30134 1 977 . 1 1 100 100 GLY H H 1 7.878 0.000 . 1 . . . A 100 GLY H . 30134 1 978 . 1 1 100 100 GLY CA C 13 45.006 0.017 . 1 . . . A 100 GLY CA . 30134 1 979 . 1 1 100 100 GLY N N 15 109.626 0.000 . 1 . . . A 100 GLY N . 30134 1 980 . 1 1 103 103 ALA H H 1 8.296 0.000 . 1 . . . A 103 ALA H . 30134 1 981 . 1 1 103 103 ALA HA H 1 4.348 0.003 . 1 . . . A 103 ALA HA . 30134 1 982 . 1 1 103 103 ALA HB1 H 1 1.413 0.002 . 1 . . . A 103 ALA HB1 . 30134 1 983 . 1 1 103 103 ALA HB2 H 1 1.413 0.002 . 1 . . . A 103 ALA HB2 . 30134 1 984 . 1 1 103 103 ALA HB3 H 1 1.413 0.002 . 1 . . . A 103 ALA HB3 . 30134 1 985 . 1 1 103 103 ALA CA C 13 52.756 0.082 . 1 . . . A 103 ALA CA . 30134 1 986 . 1 1 103 103 ALA CB C 13 19.252 0.070 . 1 . . . A 103 ALA CB . 30134 1 987 . 1 1 103 103 ALA N N 15 126.464 0.000 . 1 . . . A 103 ALA N . 30134 1 988 . 1 1 104 104 GLY H H 1 7.910 0.001 . 1 . . . A 104 GLY H . 30134 1 989 . 1 1 104 104 GLY CA C 13 46.286 0.029 . 1 . . . A 104 GLY CA . 30134 1 990 . 1 1 104 104 GLY N N 15 114.400 0.039 . 1 . . . A 104 GLY N . 30134 1 991 . 1 1 105 105 LEU HD11 H 1 0.930 0.000 . 2 . . . A 105 LEU HD11 . 30134 1 992 . 1 1 105 105 LEU HD12 H 1 0.930 0.000 . 2 . . . A 105 LEU HD12 . 30134 1 993 . 1 1 105 105 LEU HD13 H 1 0.930 0.000 . 2 . . . A 105 LEU HD13 . 30134 1 994 . 1 1 105 105 LEU HD21 H 1 0.925 0.000 . 2 . . . A 105 LEU HD21 . 30134 1 995 . 1 1 105 105 LEU HD22 H 1 0.925 0.000 . 2 . . . A 105 LEU HD22 . 30134 1 996 . 1 1 105 105 LEU HD23 H 1 0.925 0.000 . 2 . . . A 105 LEU HD23 . 30134 1 997 . 1 1 105 105 LEU CD1 C 13 23.459 0.000 . 1 . . . A 105 LEU CD1 . 30134 1 998 . 1 1 105 105 LEU CD2 C 13 25.331 0.000 . 1 . . . A 105 LEU CD2 . 30134 1 999 . 1 1 106 106 VAL HG11 H 1 0.969 0.000 . 2 . . . A 106 VAL HG11 . 30134 1 1000 . 1 1 106 106 VAL HG12 H 1 0.969 0.000 . 2 . . . A 106 VAL HG12 . 30134 1 1001 . 1 1 106 106 VAL HG13 H 1 0.969 0.000 . 2 . . . A 106 VAL HG13 . 30134 1 1002 . 1 1 106 106 VAL HG21 H 1 1.098 0.000 . 2 . . . A 106 VAL HG21 . 30134 1 1003 . 1 1 106 106 VAL HG22 H 1 1.098 0.000 . 2 . . . A 106 VAL HG22 . 30134 1 1004 . 1 1 106 106 VAL HG23 H 1 1.098 0.000 . 2 . . . A 106 VAL HG23 . 30134 1 1005 . 1 1 106 106 VAL CG1 C 13 21.922 0.000 . 1 . . . A 106 VAL CG1 . 30134 1 1006 . 1 1 106 106 VAL CG2 C 13 21.823 0.000 . 1 . . . A 106 VAL CG2 . 30134 1 1007 . 1 1 111 111 GLY H H 1 8.271 0.000 . 1 . . . A 111 GLY H . 30134 1 1008 . 1 1 111 111 GLY N N 15 108.906 0.000 . 1 . . . A 111 GLY N . 30134 1 1009 . 1 1 112 112 GLY H H 1 8.255 0.000 . 1 . . . A 112 GLY H . 30134 1 1010 . 1 1 112 112 GLY HA2 H 1 4.003 0.000 . 2 . . . A 112 GLY HA2 . 30134 1 1011 . 1 1 112 112 GLY HA3 H 1 4.003 0.000 . 2 . . . A 112 GLY HA3 . 30134 1 1012 . 1 1 112 112 GLY C C 13 173.213 0.003 . 1 . . . A 112 GLY C . 30134 1 1013 . 1 1 112 112 GLY CA C 13 45.432 0.033 . 1 . . . A 112 GLY CA . 30134 1 1014 . 1 1 112 112 GLY N N 15 108.876 0.000 . 1 . . . A 112 GLY N . 30134 1 1015 . 1 1 113 113 ILE H H 1 8.060 0.000 . 1 . . . A 113 ILE H . 30134 1 1016 . 1 1 113 113 ILE HA H 1 4.200 0.007 . 1 . . . A 113 ILE HA . 30134 1 1017 . 1 1 113 113 ILE HB H 1 1.891 0.008 . 1 . . . A 113 ILE HB . 30134 1 1018 . 1 1 113 113 ILE HG12 H 1 1.196 0.001 . 2 . . . A 113 ILE HG12 . 30134 1 1019 . 1 1 113 113 ILE HG13 H 1 1.462 0.002 . 2 . . . A 113 ILE HG13 . 30134 1 1020 . 1 1 113 113 ILE HG21 H 1 0.919 0.006 . 1 . . . A 113 ILE HG21 . 30134 1 1021 . 1 1 113 113 ILE HG22 H 1 0.919 0.006 . 1 . . . A 113 ILE HG22 . 30134 1 1022 . 1 1 113 113 ILE HG23 H 1 0.919 0.006 . 1 . . . A 113 ILE HG23 . 30134 1 1023 . 1 1 113 113 ILE HD11 H 1 0.880 0.011 . 1 . . . A 113 ILE HD11 . 30134 1 1024 . 1 1 113 113 ILE HD12 H 1 0.880 0.011 . 1 . . . A 113 ILE HD12 . 30134 1 1025 . 1 1 113 113 ILE HD13 H 1 0.880 0.011 . 1 . . . A 113 ILE HD13 . 30134 1 1026 . 1 1 113 113 ILE C C 13 175.565 0.004 . 1 . . . A 113 ILE C . 30134 1 1027 . 1 1 113 113 ILE CA C 13 61.438 0.142 . 1 . . . A 113 ILE CA . 30134 1 1028 . 1 1 113 113 ILE CB C 13 38.688 0.144 . 1 . . . A 113 ILE CB . 30134 1 1029 . 1 1 113 113 ILE CG1 C 13 27.302 0.043 . 1 . . . A 113 ILE CG1 . 30134 1 1030 . 1 1 113 113 ILE CG2 C 13 17.604 0.043 . 1 . . . A 113 ILE CG2 . 30134 1 1031 . 1 1 113 113 ILE CD1 C 13 13.129 0.067 . 1 . . . A 113 ILE CD1 . 30134 1 1032 . 1 1 113 113 ILE N N 15 120.213 0.000 . 1 . . . A 113 ILE N . 30134 1 1033 . 1 1 114 114 GLU H H 1 8.589 0.000 . 1 . . . A 114 GLU H . 30134 1 1034 . 1 1 114 114 GLU HA H 1 4.293 0.000 . 1 . . . A 114 GLU HA . 30134 1 1035 . 1 1 114 114 GLU HB2 H 1 1.956 0.000 . 2 . . . A 114 GLU HB2 . 30134 1 1036 . 1 1 114 114 GLU HB3 H 1 2.054 0.000 . 2 . . . A 114 GLU HB3 . 30134 1 1037 . 1 1 114 114 GLU C C 13 175.930 0.017 . 1 . . . A 114 GLU C . 30134 1 1038 . 1 1 114 114 GLU CA C 13 57.260 0.080 . 1 . . . A 114 GLU CA . 30134 1 1039 . 1 1 114 114 GLU CB C 13 30.045 0.175 . 1 . . . A 114 GLU CB . 30134 1 1040 . 1 1 114 114 GLU N N 15 125.039 0.000 . 1 . . . A 114 GLU N . 30134 1 1041 . 1 1 115 115 GLY H H 1 8.380 0.000 . 1 . . . A 115 GLY H . 30134 1 1042 . 1 1 115 115 GLY HA2 H 1 3.995 0.000 . 2 . . . A 115 GLY HA2 . 30134 1 1043 . 1 1 115 115 GLY HA3 H 1 3.995 0.000 . 2 . . . A 115 GLY HA3 . 30134 1 1044 . 1 1 115 115 GLY C C 13 173.153 0.022 . 1 . . . A 115 GLY C . 30134 1 1045 . 1 1 115 115 GLY CA C 13 45.532 0.062 . 1 . . . A 115 GLY CA . 30134 1 1046 . 1 1 115 115 GLY N N 15 110.256 0.000 . 1 . . . A 115 GLY N . 30134 1 1047 . 1 1 116 116 SER H H 1 8.224 0.000 . 1 . . . A 428 SER H . 30134 1 1048 . 1 1 116 116 SER HA H 1 4.525 0.000 . 1 . . . A 428 SER HA . 30134 1 1049 . 1 1 116 116 SER HB2 H 1 3.917 0.000 . 2 . . . A 428 SER HB2 . 30134 1 1050 . 1 1 116 116 SER HB3 H 1 3.956 0.000 . 2 . . . A 428 SER HB3 . 30134 1 1051 . 1 1 116 116 SER C C 13 174.329 0.000 . 1 . . . A 428 SER C . 30134 1 1052 . 1 1 116 116 SER CA C 13 58.402 0.072 . 1 . . . A 428 SER CA . 30134 1 1053 . 1 1 116 116 SER CB C 13 64.493 0.031 . 1 . . . A 428 SER CB . 30134 1 1054 . 1 1 116 116 SER N N 15 115.712 0.000 . 1 . . . A 428 SER N . 30134 1 1055 . 1 1 117 117 ILE H H 1 8.417 0.000 . 1 . . . A 429 ILE H . 30134 1 1056 . 1 1 117 117 ILE HA H 1 4.137 0.006 . 1 . . . A 429 ILE HA . 30134 1 1057 . 1 1 117 117 ILE HB H 1 1.925 0.007 . 1 . . . A 429 ILE HB . 30134 1 1058 . 1 1 117 117 ILE HG12 H 1 1.261 0.003 . 2 . . . A 429 ILE HG12 . 30134 1 1059 . 1 1 117 117 ILE HG13 H 1 1.525 0.002 . 2 . . . A 429 ILE HG13 . 30134 1 1060 . 1 1 117 117 ILE HG21 H 1 0.941 0.000 . 1 . . . A 429 ILE HG21 . 30134 1 1061 . 1 1 117 117 ILE HG22 H 1 0.941 0.000 . 1 . . . A 429 ILE HG22 . 30134 1 1062 . 1 1 117 117 ILE HG23 H 1 0.941 0.000 . 1 . . . A 429 ILE HG23 . 30134 1 1063 . 1 1 117 117 ILE HD11 H 1 0.903 0.016 . 1 . . . A 429 ILE HD11 . 30134 1 1064 . 1 1 117 117 ILE HD12 H 1 0.903 0.016 . 1 . . . A 429 ILE HD12 . 30134 1 1065 . 1 1 117 117 ILE HD13 H 1 0.903 0.016 . 1 . . . A 429 ILE HD13 . 30134 1 1066 . 1 1 117 117 ILE C C 13 175.419 0.000 . 1 . . . A 429 ILE C . 30134 1 1067 . 1 1 117 117 ILE CA C 13 62.498 0.108 . 1 . . . A 429 ILE CA . 30134 1 1068 . 1 1 117 117 ILE CB C 13 38.440 0.122 . 1 . . . A 429 ILE CB . 30134 1 1069 . 1 1 117 117 ILE CG1 C 13 28.002 0.050 . 1 . . . A 429 ILE CG1 . 30134 1 1070 . 1 1 117 117 ILE CG2 C 13 17.594 0.056 . 1 . . . A 429 ILE CG2 . 30134 1 1071 . 1 1 117 117 ILE CD1 C 13 13.185 0.058 . 1 . . . A 429 ILE CD1 . 30134 1 1072 . 1 1 117 117 ILE N N 15 123.397 0.000 . 1 . . . A 429 ILE N . 30134 1 1073 . 1 1 118 118 ASP H H 1 8.241 0.000 . 1 . . . A 430 ASP H . 30134 1 1074 . 1 1 118 118 ASP HA H 1 4.454 0.000 . 1 . . . A 430 ASP HA . 30134 1 1075 . 1 1 118 118 ASP HB2 H 1 2.640 0.001 . 2 . . . A 430 ASP HB2 . 30134 1 1076 . 1 1 118 118 ASP HB3 H 1 2.692 0.020 . 2 . . . A 430 ASP HB3 . 30134 1 1077 . 1 1 118 118 ASP C C 13 176.819 0.059 . 1 . . . A 430 ASP C . 30134 1 1078 . 1 1 118 118 ASP CA C 13 56.008 0.070 . 1 . . . A 430 ASP CA . 30134 1 1079 . 1 1 118 118 ASP CB C 13 41.179 0.058 . 1 . . . A 430 ASP CB . 30134 1 1080 . 1 1 118 118 ASP N N 15 122.348 0.000 . 1 . . . A 430 ASP N . 30134 1 1081 . 1 1 119 119 GLU H H 1 8.344 0.000 . 1 . . . A 431 GLU H . 30134 1 1082 . 1 1 119 119 GLU C C 13 177.272 0.023 . 1 . . . A 431 GLU C . 30134 1 1083 . 1 1 119 119 GLU CA C 13 58.925 0.065 . 1 . . . A 431 GLU CA . 30134 1 1084 . 1 1 119 119 GLU CB C 13 29.574 0.032 . 1 . . . A 431 GLU CB . 30134 1 1085 . 1 1 119 119 GLU N N 15 122.065 0.000 . 1 . . . A 431 GLU N . 30134 1 1086 . 1 1 120 120 THR H H 1 8.065 0.000 . 1 . . . A 432 THR H . 30134 1 1087 . 1 1 120 120 THR HA H 1 4.307 0.000 . 1 . . . A 432 THR HA . 30134 1 1088 . 1 1 120 120 THR HG21 H 1 1.325 0.000 . 1 . . . A 432 THR HG21 . 30134 1 1089 . 1 1 120 120 THR HG22 H 1 1.325 0.000 . 1 . . . A 432 THR HG22 . 30134 1 1090 . 1 1 120 120 THR HG23 H 1 1.325 0.000 . 1 . . . A 432 THR HG23 . 30134 1 1091 . 1 1 120 120 THR C C 13 174.689 0.000 . 1 . . . A 432 THR C . 30134 1 1092 . 1 1 120 120 THR CA C 13 66.487 0.258 . 1 . . . A 432 THR CA . 30134 1 1093 . 1 1 120 120 THR CB C 13 68.884 0.077 . 1 . . . A 432 THR CB . 30134 1 1094 . 1 1 120 120 THR CG2 C 13 21.867 0.000 . 1 . . . A 432 THR CG2 . 30134 1 1095 . 1 1 120 120 THR N N 15 117.229 0.000 . 1 . . . A 432 THR N . 30134 1 1096 . 1 1 121 121 VAL H H 1 8.143 0.004 . 1 . . . A 433 VAL H . 30134 1 1097 . 1 1 121 121 VAL HA H 1 3.752 0.122 . 1 . . . A 433 VAL HA . 30134 1 1098 . 1 1 121 121 VAL HB H 1 2.077 0.175 . 1 . . . A 433 VAL HB . 30134 1 1099 . 1 1 121 121 VAL HG11 H 1 1.110 0.016 . 2 . . . A 433 VAL HG11 . 30134 1 1100 . 1 1 121 121 VAL HG12 H 1 1.110 0.016 . 2 . . . A 433 VAL HG12 . 30134 1 1101 . 1 1 121 121 VAL HG13 H 1 1.110 0.016 . 2 . . . A 433 VAL HG13 . 30134 1 1102 . 1 1 121 121 VAL HG21 H 1 1.030 0.014 . 2 . . . A 433 VAL HG21 . 30134 1 1103 . 1 1 121 121 VAL HG22 H 1 1.030 0.014 . 2 . . . A 433 VAL HG22 . 30134 1 1104 . 1 1 121 121 VAL HG23 H 1 1.030 0.014 . 2 . . . A 433 VAL HG23 . 30134 1 1105 . 1 1 121 121 VAL C C 13 176.715 0.011 . 1 . . . A 433 VAL C . 30134 1 1106 . 1 1 121 121 VAL CA C 13 66.815 0.176 . 1 . . . A 433 VAL CA . 30134 1 1107 . 1 1 121 121 VAL CB C 13 31.615 0.172 . 1 . . . A 433 VAL CB . 30134 1 1108 . 1 1 121 121 VAL CG1 C 13 23.066 0.391 . 1 . . . A 433 VAL CG1 . 30134 1 1109 . 1 1 121 121 VAL CG2 C 13 21.273 0.258 . 1 . . . A 433 VAL CG2 . 30134 1 1110 . 1 1 121 121 VAL N N 15 120.607 0.000 . 1 . . . A 433 VAL N . 30134 1 1111 . 1 1 122 122 ALA H H 1 7.989 0.009 . 1 . . . A 434 ALA H . 30134 1 1112 . 1 1 122 122 ALA HA H 1 4.063 0.020 . 1 . . . A 434 ALA HA . 30134 1 1113 . 1 1 122 122 ALA HB1 H 1 1.495 0.007 . 1 . . . A 434 ALA HB1 . 30134 1 1114 . 1 1 122 122 ALA HB2 H 1 1.495 0.007 . 1 . . . A 434 ALA HB2 . 30134 1 1115 . 1 1 122 122 ALA HB3 H 1 1.495 0.007 . 1 . . . A 434 ALA HB3 . 30134 1 1116 . 1 1 122 122 ALA C C 13 180.126 0.010 . 1 . . . A 434 ALA C . 30134 1 1117 . 1 1 122 122 ALA CA C 13 55.581 0.080 . 1 . . . A 434 ALA CA . 30134 1 1118 . 1 1 122 122 ALA CB C 13 17.901 0.083 . 1 . . . A 434 ALA CB . 30134 1 1119 . 1 1 122 122 ALA N N 15 121.555 0.000 . 1 . . . A 434 ALA N . 30134 1 1120 . 1 1 123 123 ARG H H 1 7.824 0.000 . 1 . . . A 435 ARG H . 30134 1 1121 . 1 1 123 123 ARG HB2 H 1 1.598 0.000 . 2 . . . A 435 ARG HB2 . 30134 1 1122 . 1 1 123 123 ARG HB3 H 1 1.894 0.000 . 2 . . . A 435 ARG HB3 . 30134 1 1123 . 1 1 123 123 ARG C C 13 179.053 0.024 . 1 . . . A 435 ARG C . 30134 1 1124 . 1 1 123 123 ARG CA C 13 59.569 0.121 . 1 . . . A 435 ARG CA . 30134 1 1125 . 1 1 123 123 ARG CB C 13 29.350 0.129 . 1 . . . A 435 ARG CB . 30134 1 1126 . 1 1 123 123 ARG N N 15 119.603 0.000 . 1 . . . A 435 ARG N . 30134 1 1127 . 1 1 124 124 TYR H H 1 8.042 0.006 . 1 . . . A 436 TYR H . 30134 1 1128 . 1 1 124 124 TYR HA H 1 4.595 0.000 . 1 . . . A 436 TYR HA . 30134 1 1129 . 1 1 124 124 TYR HB2 H 1 3.077 0.000 . 2 . . . A 436 TYR HB2 . 30134 1 1130 . 1 1 124 124 TYR HB3 H 1 3.194 0.000 . 2 . . . A 436 TYR HB3 . 30134 1 1131 . 1 1 124 124 TYR HD1 H 1 6.863 0.000 . 1 . . . A 436 TYR HD1 . 30134 1 1132 . 1 1 124 124 TYR HE1 H 1 6.743 0.000 . 1 . . . A 436 TYR HE1 . 30134 1 1133 . 1 1 124 124 TYR C C 13 177.695 0.023 . 1 . . . A 436 TYR C . 30134 1 1134 . 1 1 124 124 TYR CA C 13 58.762 0.106 . 1 . . . A 436 TYR CA . 30134 1 1135 . 1 1 124 124 TYR CB C 13 37.389 0.021 . 1 . . . A 436 TYR CB . 30134 1 1136 . 1 1 124 124 TYR CD1 C 13 130.897 0.000 . 1 . . . A 436 TYR CD1 . 30134 1 1137 . 1 1 124 124 TYR CE1 C 13 118.677 0.000 . 1 . . . A 436 TYR CE1 . 30134 1 1138 . 1 1 124 124 TYR N N 15 120.081 0.000 . 1 . . . A 436 TYR N . 30134 1 1139 . 1 1 125 125 LYS H H 1 8.824 0.002 . 1 . . . A 437 LYS H . 30134 1 1140 . 1 1 125 125 LYS HA H 1 3.925 0.000 . 1 . . . A 437 LYS HA . 30134 1 1141 . 1 1 125 125 LYS HB2 H 1 1.598 0.000 . 2 . . . A 437 LYS HB2 . 30134 1 1142 . 1 1 125 125 LYS HB3 H 1 1.925 0.000 . 2 . . . A 437 LYS HB3 . 30134 1 1143 . 1 1 125 125 LYS C C 13 177.079 0.594 . 1 . . . A 437 LYS C . 30134 1 1144 . 1 1 125 125 LYS CA C 13 60.635 0.091 . 1 . . . A 437 LYS CA . 30134 1 1145 . 1 1 125 125 LYS CB C 13 31.634 0.019 . 1 . . . A 437 LYS CB . 30134 1 1146 . 1 1 125 125 LYS N N 15 120.058 0.019 . 1 . . . A 437 LYS N . 30134 1 1147 . 1 1 126 126 ALA H H 1 7.996 0.005 . 1 . . . A 438 ALA H . 30134 1 1148 . 1 1 126 126 ALA HA H 1 4.313 0.014 . 1 . . . A 438 ALA HA . 30134 1 1149 . 1 1 126 126 ALA HB1 H 1 1.580 0.007 . 1 . . . A 438 ALA HB1 . 30134 1 1150 . 1 1 126 126 ALA HB2 H 1 1.580 0.007 . 1 . . . A 438 ALA HB2 . 30134 1 1151 . 1 1 126 126 ALA HB3 H 1 1.580 0.007 . 1 . . . A 438 ALA HB3 . 30134 1 1152 . 1 1 126 126 ALA C C 13 179.097 0.021 . 1 . . . A 438 ALA C . 30134 1 1153 . 1 1 126 126 ALA CA C 13 55.302 0.193 . 1 . . . A 438 ALA CA . 30134 1 1154 . 1 1 126 126 ALA CB C 13 17.889 0.100 . 1 . . . A 438 ALA CB . 30134 1 1155 . 1 1 126 126 ALA N N 15 121.758 0.005 . 1 . . . A 438 ALA N . 30134 1 1156 . 1 1 127 127 GLN H H 1 8.159 0.000 . 1 . . . A 439 GLN H . 30134 1 1157 . 1 1 127 127 GLN HA H 1 3.995 0.000 . 1 . . . A 439 GLN HA . 30134 1 1158 . 1 1 127 127 GLN HB2 H 1 1.925 0.000 . 2 . . . A 439 GLN HB2 . 30134 1 1159 . 1 1 127 127 GLN HB3 H 1 2.299 0.000 . 2 . . . A 439 GLN HB3 . 30134 1 1160 . 1 1 127 127 GLN C C 13 176.668 0.018 . 1 . . . A 439 GLN C . 30134 1 1161 . 1 1 127 127 GLN CA C 13 60.219 0.055 . 1 . . . A 439 GLN CA . 30134 1 1162 . 1 1 127 127 GLN CB C 13 30.665 0.019 . 1 . . . A 439 GLN CB . 30134 1 1163 . 1 1 127 127 GLN N N 15 119.187 0.000 . 1 . . . A 439 GLN N . 30134 1 1164 . 1 1 128 128 PHE H H 1 8.852 0.001 . 1 . . . A 440 PHE H . 30134 1 1165 . 1 1 128 128 PHE HA H 1 4.299 0.000 . 1 . . . A 440 PHE HA . 30134 1 1166 . 1 1 128 128 PHE HB2 H 1 3.499 0.040 . 2 . . . A 440 PHE HB2 . 30134 1 1167 . 1 1 128 128 PHE HB3 H 1 3.635 0.096 . 2 . . . A 440 PHE HB3 . 30134 1 1168 . 1 1 128 128 PHE HD1 H 1 7.113 0.000 . 1 . . . A 440 PHE HD1 . 30134 1 1169 . 1 1 128 128 PHE HE1 H 1 7.382 0.000 . 1 . . . A 440 PHE HE1 . 30134 1 1170 . 1 1 128 128 PHE HZ H 1 7.278 0.000 . 1 . . . A 440 PHE HZ . 30134 1 1171 . 1 1 128 128 PHE C C 13 175.653 0.022 . 1 . . . A 440 PHE C . 30134 1 1172 . 1 1 128 128 PHE CA C 13 62.305 0.101 . 1 . . . A 440 PHE CA . 30134 1 1173 . 1 1 128 128 PHE CB C 13 39.124 0.163 . 1 . . . A 440 PHE CB . 30134 1 1174 . 1 1 128 128 PHE CD1 C 13 131.761 0.000 . 1 . . . A 440 PHE CD1 . 30134 1 1175 . 1 1 128 128 PHE CE1 C 13 132.169 0.000 . 1 . . . A 440 PHE CE1 . 30134 1 1176 . 1 1 128 128 PHE CZ C 13 129.939 0.000 . 1 . . . A 440 PHE CZ . 30134 1 1177 . 1 1 128 128 PHE N N 15 120.328 0.000 . 1 . . . A 440 PHE N . 30134 1 1178 . 1 1 129 129 THR H H 1 8.370 0.000 . 1 . . . A 441 THR H . 30134 1 1179 . 1 1 129 129 THR HA H 1 4.314 0.000 . 1 . . . A 441 THR HA . 30134 1 1180 . 1 1 129 129 THR HG21 H 1 1.311 0.000 . 1 . . . A 441 THR HG21 . 30134 1 1181 . 1 1 129 129 THR HG22 H 1 1.311 0.000 . 1 . . . A 441 THR HG22 . 30134 1 1182 . 1 1 129 129 THR HG23 H 1 1.311 0.000 . 1 . . . A 441 THR HG23 . 30134 1 1183 . 1 1 129 129 THR C C 13 174.750 0.000 . 1 . . . A 441 THR C . 30134 1 1184 . 1 1 129 129 THR CA C 13 66.975 0.069 . 1 . . . A 441 THR CA . 30134 1 1185 . 1 1 129 129 THR CB C 13 69.295 0.057 . 1 . . . A 441 THR CB . 30134 1 1186 . 1 1 129 129 THR CG2 C 13 21.746 0.000 . 1 . . . A 441 THR CG2 . 30134 1 1187 . 1 1 129 129 THR N N 15 114.570 0.000 . 1 . . . A 441 THR N . 30134 1 1188 . 1 1 130 130 GLN H H 1 8.108 0.000 . 1 . . . A 442 GLN H . 30134 1 1189 . 1 1 130 130 GLN HA H 1 4.120 0.000 . 1 . . . A 442 GLN HA . 30134 1 1190 . 1 1 130 130 GLN HB2 H 1 2.135 0.000 . 2 . . . A 442 GLN HB2 . 30134 1 1191 . 1 1 130 130 GLN HB3 H 1 2.229 0.000 . 2 . . . A 442 GLN HB3 . 30134 1 1192 . 1 1 130 130 GLN C C 13 178.615 0.012 . 1 . . . A 442 GLN C . 30134 1 1193 . 1 1 130 130 GLN CA C 13 59.833 0.138 . 1 . . . A 442 GLN CA . 30134 1 1194 . 1 1 130 130 GLN CB C 13 29.672 0.031 . 1 . . . A 442 GLN CB . 30134 1 1195 . 1 1 130 130 GLN N N 15 121.147 0.000 . 1 . . . A 442 GLN N . 30134 1 1196 . 1 1 131 131 LEU H H 1 8.785 0.000 . 1 . . . A 443 LEU H . 30134 1 1197 . 1 1 131 131 LEU HA H 1 4.124 0.005 . 1 . . . A 443 LEU HA . 30134 1 1198 . 1 1 131 131 LEU HD11 H 1 0.910 0.000 . 2 . . . A 443 LEU HD11 . 30134 1 1199 . 1 1 131 131 LEU HD12 H 1 0.910 0.000 . 2 . . . A 443 LEU HD12 . 30134 1 1200 . 1 1 131 131 LEU HD13 H 1 0.910 0.000 . 2 . . . A 443 LEU HD13 . 30134 1 1201 . 1 1 131 131 LEU HD21 H 1 0.410 0.000 . 2 . . . A 443 LEU HD21 . 30134 1 1202 . 1 1 131 131 LEU HD22 H 1 0.410 0.000 . 2 . . . A 443 LEU HD22 . 30134 1 1203 . 1 1 131 131 LEU HD23 H 1 0.410 0.000 . 2 . . . A 443 LEU HD23 . 30134 1 1204 . 1 1 131 131 LEU C C 13 177.062 0.016 . 1 . . . A 443 LEU C . 30134 1 1205 . 1 1 131 131 LEU CA C 13 58.009 0.104 . 1 . . . A 443 LEU CA . 30134 1 1206 . 1 1 131 131 LEU CB C 13 40.897 0.058 . 1 . . . A 443 LEU CB . 30134 1 1207 . 1 1 131 131 LEU CD1 C 13 22.613 0.000 . 1 . . . A 443 LEU CD1 . 30134 1 1208 . 1 1 131 131 LEU CD2 C 13 27.433 0.000 . 1 . . . A 443 LEU CD2 . 30134 1 1209 . 1 1 131 131 LEU N N 15 121.793 0.000 . 1 . . . A 443 LEU N . 30134 1 1210 . 1 1 132 132 ASP H H 1 8.731 0.003 . 1 . . . A 444 ASP H . 30134 1 1211 . 1 1 132 132 ASP HA H 1 3.987 0.000 . 1 . . . A 444 ASP HA . 30134 1 1212 . 1 1 132 132 ASP C C 13 178.201 0.000 . 1 . . . A 444 ASP C . 30134 1 1213 . 1 1 132 132 ASP CA C 13 57.984 0.063 . 1 . . . A 444 ASP CA . 30134 1 1214 . 1 1 132 132 ASP CB C 13 42.161 0.101 . 1 . . . A 444 ASP CB . 30134 1 1215 . 1 1 132 132 ASP N N 15 121.716 0.000 . 1 . . . A 444 ASP N . 30134 1 1216 . 1 1 133 133 THR H H 1 8.130 0.000 . 1 . . . A 445 THR H . 30134 1 1217 . 1 1 133 133 THR HA H 1 4.349 0.012 . 1 . . . A 445 THR HA . 30134 1 1218 . 1 1 133 133 THR HG21 H 1 1.388 0.000 . 1 . . . A 445 THR HG21 . 30134 1 1219 . 1 1 133 133 THR HG22 H 1 1.388 0.000 . 1 . . . A 445 THR HG22 . 30134 1 1220 . 1 1 133 133 THR HG23 H 1 1.388 0.000 . 1 . . . A 445 THR HG23 . 30134 1 1221 . 1 1 133 133 THR C C 13 175.518 0.000 . 1 . . . A 445 THR C . 30134 1 1222 . 1 1 133 133 THR CA C 13 67.039 0.221 . 1 . . . A 445 THR CA . 30134 1 1223 . 1 1 133 133 THR CB C 13 68.763 0.004 . 1 . . . A 445 THR CB . 30134 1 1224 . 1 1 133 133 THR CG2 C 13 21.719 0.000 . 1 . . . A 445 THR CG2 . 30134 1 1225 . 1 1 133 133 THR N N 15 115.944 0.000 . 1 . . . A 445 THR N . 30134 1 1226 . 1 1 134 134 MET H H 1 7.949 0.004 . 1 . . . A 446 MET H . 30134 1 1227 . 1 1 134 134 MET HA H 1 4.081 0.006 . 1 . . . A 446 MET HA . 30134 1 1228 . 1 1 134 134 MET HB2 H 1 2.277 0.007 . 2 . . . A 446 MET HB2 . 30134 1 1229 . 1 1 134 134 MET HB3 H 1 2.290 0.007 . 2 . . . A 446 MET HB3 . 30134 1 1230 . 1 1 134 134 MET HE1 H 1 2.039 0.013 . 1 . . . A 446 MET HE1 . 30134 1 1231 . 1 1 134 134 MET HE2 H 1 2.039 0.013 . 1 . . . A 446 MET HE2 . 30134 1 1232 . 1 1 134 134 MET HE3 H 1 2.039 0.013 . 1 . . . A 446 MET HE3 . 30134 1 1233 . 1 1 134 134 MET C C 13 176.611 0.021 . 1 . . . A 446 MET C . 30134 1 1234 . 1 1 134 134 MET CA C 13 60.305 0.193 . 1 . . . A 446 MET CA . 30134 1 1235 . 1 1 134 134 MET CB C 13 31.447 0.219 . 1 . . . A 446 MET CB . 30134 1 1236 . 1 1 134 134 MET CG C 13 30.261 0.076 . 1 . . . A 446 MET CG . 30134 1 1237 . 1 1 134 134 MET CE C 13 18.699 0.000 . 1 . . . A 446 MET CE . 30134 1 1238 . 1 1 134 134 MET N N 15 123.231 0.000 . 1 . . . A 446 MET N . 30134 1 1239 . 1 1 135 135 MET H H 1 8.461 0.008 . 1 . . . A 447 MET H . 30134 1 1240 . 1 1 135 135 MET HA H 1 3.920 0.017 . 1 . . . A 447 MET HA . 30134 1 1241 . 1 1 135 135 MET HB2 H 1 2.497 0.011 . 2 . . . A 447 MET HB2 . 30134 1 1242 . 1 1 135 135 MET HB3 H 1 2.530 0.009 . 2 . . . A 447 MET HB3 . 30134 1 1243 . 1 1 135 135 MET HE1 H 1 2.142 0.000 . 1 . . . A 447 MET HE1 . 30134 1 1244 . 1 1 135 135 MET HE2 H 1 2.142 0.000 . 1 . . . A 447 MET HE2 . 30134 1 1245 . 1 1 135 135 MET HE3 H 1 2.142 0.000 . 1 . . . A 447 MET HE3 . 30134 1 1246 . 1 1 135 135 MET C C 13 177.347 0.052 . 1 . . . A 447 MET C . 30134 1 1247 . 1 1 135 135 MET CA C 13 59.588 0.065 . 1 . . . A 447 MET CA . 30134 1 1248 . 1 1 135 135 MET CB C 13 32.411 0.251 . 1 . . . A 447 MET CB . 30134 1 1249 . 1 1 135 135 MET CG C 13 32.588 0.000 . 1 . . . A 447 MET CG . 30134 1 1250 . 1 1 135 135 MET CE C 13 17.880 0.000 . 1 . . . A 447 MET CE . 30134 1 1251 . 1 1 135 135 MET N N 15 118.815 0.000 . 1 . . . A 447 MET N . 30134 1 1252 . 1 1 136 136 SER H H 1 7.860 0.000 . 1 . . . A 448 SER H . 30134 1 1253 . 1 1 136 136 SER HA H 1 4.353 0.000 . 1 . . . A 448 SER HA . 30134 1 1254 . 1 1 136 136 SER C C 13 176.792 0.000 . 1 . . . A 448 SER C . 30134 1 1255 . 1 1 136 136 SER CA C 13 62.236 0.022 . 1 . . . A 448 SER CA . 30134 1 1256 . 1 1 136 136 SER CB C 13 62.820 0.049 . 1 . . . A 448 SER CB . 30134 1 1257 . 1 1 136 136 SER N N 15 114.266 0.000 . 1 . . . A 448 SER N . 30134 1 1258 . 1 1 137 137 LYS H H 1 8.168 0.006 . 1 . . . A 449 LYS H . 30134 1 1259 . 1 1 137 137 LYS HA H 1 4.377 0.000 . 1 . . . A 449 LYS HA . 30134 1 1260 . 1 1 137 137 LYS HB2 H 1 2.034 0.000 . 2 . . . A 449 LYS HB2 . 30134 1 1261 . 1 1 137 137 LYS HB3 H 1 2.034 0.000 . 2 . . . A 449 LYS HB3 . 30134 1 1262 . 1 1 137 137 LYS C C 13 179.037 0.012 . 1 . . . A 449 LYS C . 30134 1 1263 . 1 1 137 137 LYS CA C 13 59.616 0.110 . 1 . . . A 449 LYS CA . 30134 1 1264 . 1 1 137 137 LYS CB C 13 31.675 0.040 . 1 . . . A 449 LYS CB . 30134 1 1265 . 1 1 137 137 LYS N N 15 122.892 0.000 . 1 . . . A 449 LYS N . 30134 1 1266 . 1 1 138 138 LEU H H 1 8.375 0.005 . 1 . . . A 450 LEU H . 30134 1 1267 . 1 1 138 138 LEU HD11 H 1 0.830 0.000 . 2 . . . A 450 LEU HD11 . 30134 1 1268 . 1 1 138 138 LEU HD12 H 1 0.830 0.000 . 2 . . . A 450 LEU HD12 . 30134 1 1269 . 1 1 138 138 LEU HD13 H 1 0.830 0.000 . 2 . . . A 450 LEU HD13 . 30134 1 1270 . 1 1 138 138 LEU HD21 H 1 0.942 0.000 . 2 . . . A 450 LEU HD21 . 30134 1 1271 . 1 1 138 138 LEU HD22 H 1 0.942 0.000 . 2 . . . A 450 LEU HD22 . 30134 1 1272 . 1 1 138 138 LEU HD23 H 1 0.942 0.000 . 2 . . . A 450 LEU HD23 . 30134 1 1273 . 1 1 138 138 LEU C C 13 178.862 0.038 . 1 . . . A 450 LEU C . 30134 1 1274 . 1 1 138 138 LEU CA C 13 56.338 0.053 . 1 . . . A 450 LEU CA . 30134 1 1275 . 1 1 138 138 LEU CB C 13 41.102 0.021 . 1 . . . A 450 LEU CB . 30134 1 1276 . 1 1 138 138 LEU CD1 C 13 27.081 0.000 . 1 . . . A 450 LEU CD1 . 30134 1 1277 . 1 1 138 138 LEU CD2 C 13 22.778 0.000 . 1 . . . A 450 LEU CD2 . 30134 1 1278 . 1 1 138 138 LEU N N 15 119.773 0.000 . 1 . . . A 450 LEU N . 30134 1 1279 . 1 1 139 139 ASN H H 1 8.007 0.000 . 1 . . . A 451 ASN H . 30134 1 1280 . 1 1 139 139 ASN HA H 1 4.610 0.000 . 1 . . . A 451 ASN HA . 30134 1 1281 . 1 1 139 139 ASN HB2 H 1 2.913 0.008 . 2 . . . A 451 ASN HB2 . 30134 1 1282 . 1 1 139 139 ASN HB3 H 1 3.030 0.024 . 2 . . . A 451 ASN HB3 . 30134 1 1283 . 1 1 139 139 ASN C C 13 177.242 0.038 . 1 . . . A 451 ASN C . 30134 1 1284 . 1 1 139 139 ASN CA C 13 56.403 0.099 . 1 . . . A 451 ASN CA . 30134 1 1285 . 1 1 139 139 ASN CB C 13 37.941 0.093 . 1 . . . A 451 ASN CB . 30134 1 1286 . 1 1 139 139 ASN N N 15 118.254 0.000 . 1 . . . A 451 ASN N . 30134 1 1287 . 1 1 140 140 ASN H H 1 7.709 0.000 . 1 . . . A 452 ASN H . 30134 1 1288 . 1 1 140 140 ASN C C 13 177.363 0.000 . 1 . . . A 452 ASN C . 30134 1 1289 . 1 1 140 140 ASN CA C 13 56.382 0.090 . 1 . . . A 452 ASN CA . 30134 1 1290 . 1 1 140 140 ASN CB C 13 38.743 0.085 . 1 . . . A 452 ASN CB . 30134 1 1291 . 1 1 140 140 ASN N N 15 118.361 0.000 . 1 . . . A 452 ASN N . 30134 1 1292 . 1 1 141 141 THR H H 1 8.510 0.000 . 1 . . . A 453 THR H . 30134 1 1293 . 1 1 141 141 THR HG21 H 1 1.254 0.000 . 1 . . . A 453 THR HG21 . 30134 1 1294 . 1 1 141 141 THR HG22 H 1 1.254 0.000 . 1 . . . A 453 THR HG22 . 30134 1 1295 . 1 1 141 141 THR HG23 H 1 1.254 0.000 . 1 . . . A 453 THR HG23 . 30134 1 1296 . 1 1 141 141 THR CA C 13 66.791 0.022 . 1 . . . A 453 THR CA . 30134 1 1297 . 1 1 141 141 THR CG2 C 13 24.035 0.000 . 1 . . . A 453 THR CG2 . 30134 1 1298 . 1 1 141 141 THR N N 15 115.020 0.000 . 1 . . . A 453 THR N . 30134 1 1299 . 1 1 142 142 SER H H 1 8.609 0.000 . 1 . . . A 454 SER H . 30134 1 1300 . 1 1 142 142 SER CA C 13 63.269 0.041 . 1 . . . A 454 SER CA . 30134 1 1301 . 1 1 142 142 SER N N 15 119.525 0.000 . 1 . . . A 454 SER N . 30134 1 1302 . 1 1 143 143 SER H H 1 7.659 0.000 . 1 . . . A 455 SER H . 30134 1 1303 . 1 1 143 143 SER C C 13 175.771 0.000 . 1 . . . A 455 SER C . 30134 1 1304 . 1 1 143 143 SER CA C 13 62.215 0.016 . 1 . . . A 455 SER CA . 30134 1 1305 . 1 1 143 143 SER N N 15 117.407 0.000 . 1 . . . A 455 SER N . 30134 1 1306 . 1 1 144 144 TYR H H 1 7.715 0.003 . 1 . . . A 456 TYR H . 30134 1 1307 . 1 1 144 144 TYR HA H 1 4.416 0.004 . 1 . . . A 456 TYR HA . 30134 1 1308 . 1 1 144 144 TYR HB2 H 1 3.168 0.009 . 2 . . . A 456 TYR HB2 . 30134 1 1309 . 1 1 144 144 TYR HB3 H 1 3.394 0.001 . 2 . . . A 456 TYR HB3 . 30134 1 1310 . 1 1 144 144 TYR HD1 H 1 7.148 0.003 . 1 . . . A 456 TYR HD1 . 30134 1 1311 . 1 1 144 144 TYR HE1 H 1 6.897 0.000 . 1 . . . A 456 TYR HE1 . 30134 1 1312 . 1 1 144 144 TYR C C 13 176.619 0.048 . 1 . . . A 456 TYR C . 30134 1 1313 . 1 1 144 144 TYR CA C 13 61.632 0.194 . 1 . . . A 456 TYR CA . 30134 1 1314 . 1 1 144 144 TYR CB C 13 38.268 0.154 . 1 . . . A 456 TYR CB . 30134 1 1315 . 1 1 144 144 TYR CD1 C 13 133.270 0.000 . 1 . . . A 456 TYR CD1 . 30134 1 1316 . 1 1 144 144 TYR CE1 C 13 118.426 0.000 . 1 . . . A 456 TYR CE1 . 30134 1 1317 . 1 1 144 144 TYR N N 15 123.473 0.000 . 1 . . . A 456 TYR N . 30134 1 1318 . 1 1 145 145 LEU H H 1 8.932 0.001 . 1 . . . A 457 LEU H . 30134 1 1319 . 1 1 145 145 LEU HD11 H 1 1.049 0.000 . 2 . . . A 457 LEU HD11 . 30134 1 1320 . 1 1 145 145 LEU HD12 H 1 1.049 0.000 . 2 . . . A 457 LEU HD12 . 30134 1 1321 . 1 1 145 145 LEU HD13 H 1 1.049 0.000 . 2 . . . A 457 LEU HD13 . 30134 1 1322 . 1 1 145 145 LEU HD21 H 1 1.322 0.000 . 2 . . . A 457 LEU HD21 . 30134 1 1323 . 1 1 145 145 LEU HD22 H 1 1.322 0.000 . 2 . . . A 457 LEU HD22 . 30134 1 1324 . 1 1 145 145 LEU HD23 H 1 1.322 0.000 . 2 . . . A 457 LEU HD23 . 30134 1 1325 . 1 1 145 145 LEU C C 13 178.113 0.017 . 1 . . . A 457 LEU C . 30134 1 1326 . 1 1 145 145 LEU CA C 13 58.646 0.057 . 1 . . . A 457 LEU CA . 30134 1 1327 . 1 1 145 145 LEU CB C 13 42.475 0.062 . 1 . . . A 457 LEU CB . 30134 1 1328 . 1 1 145 145 LEU CD1 C 13 26.327 0.000 . 1 . . . A 457 LEU CD1 . 30134 1 1329 . 1 1 145 145 LEU CD2 C 13 23.797 0.000 . 1 . . . A 457 LEU CD2 . 30134 1 1330 . 1 1 145 145 LEU N N 15 119.477 0.000 . 1 . . . A 457 LEU N . 30134 1 1331 . 1 1 146 146 THR H H 1 8.455 0.018 . 1 . . . A 458 THR H . 30134 1 1332 . 1 1 146 146 THR HA H 1 3.894 0.003 . 1 . . . A 458 THR HA . 30134 1 1333 . 1 1 146 146 THR HB H 1 4.377 0.008 . 1 . . . A 458 THR HB . 30134 1 1334 . 1 1 146 146 THR HG21 H 1 1.318 0.001 . 1 . . . A 458 THR HG21 . 30134 1 1335 . 1 1 146 146 THR HG22 H 1 1.318 0.001 . 1 . . . A 458 THR HG22 . 30134 1 1336 . 1 1 146 146 THR HG23 H 1 1.318 0.001 . 1 . . . A 458 THR HG23 . 30134 1 1337 . 1 1 146 146 THR C C 13 175.942 0.000 . 1 . . . A 458 THR C . 30134 1 1338 . 1 1 146 146 THR CA C 13 67.735 0.137 . 1 . . . A 458 THR CA . 30134 1 1339 . 1 1 146 146 THR CB C 13 69.154 0.058 . 1 . . . A 458 THR CB . 30134 1 1340 . 1 1 146 146 THR CG2 C 13 21.408 0.000 . 1 . . . A 458 THR CG2 . 30134 1 1341 . 1 1 146 146 THR N N 15 114.886 0.000 . 1 . . . A 458 THR N . 30134 1 1342 . 1 1 147 147 GLN H H 1 7.807 0.000 . 1 . . . A 459 GLN H . 30134 1 1343 . 1 1 147 147 GLN HA H 1 4.163 0.000 . 1 . . . A 459 GLN HA . 30134 1 1344 . 1 1 147 147 GLN C C 13 178.406 0.136 . 1 . . . A 459 GLN C . 30134 1 1345 . 1 1 147 147 GLN CA C 13 59.416 0.063 . 1 . . . A 459 GLN CA . 30134 1 1346 . 1 1 147 147 GLN CB C 13 28.184 0.020 . 1 . . . A 459 GLN CB . 30134 1 1347 . 1 1 147 147 GLN N N 15 122.809 0.000 . 1 . . . A 459 GLN N . 30134 1 1348 . 1 1 148 148 GLN H H 1 8.368 0.000 . 1 . . . A 460 GLN H . 30134 1 1349 . 1 1 148 148 GLN HA H 1 3.984 0.000 . 1 . . . A 460 GLN HA . 30134 1 1350 . 1 1 148 148 GLN HB2 H 1 2.295 0.000 . 2 . . . A 460 GLN HB2 . 30134 1 1351 . 1 1 148 148 GLN HB3 H 1 2.295 0.000 . 2 . . . A 460 GLN HB3 . 30134 1 1352 . 1 1 148 148 GLN C C 13 176.791 0.058 . 1 . . . A 460 GLN C . 30134 1 1353 . 1 1 148 148 GLN CA C 13 57.996 0.103 . 1 . . . A 460 GLN CA . 30134 1 1354 . 1 1 148 148 GLN CB C 13 28.120 0.036 . 1 . . . A 460 GLN CB . 30134 1 1355 . 1 1 148 148 GLN N N 15 118.997 0.000 . 1 . . . A 460 GLN N . 30134 1 1356 . 1 1 149 149 PHE H H 1 8.851 0.001 . 1 . . . A 461 PHE H . 30134 1 1357 . 1 1 149 149 PHE HA H 1 3.870 0.011 . 1 . . . A 461 PHE HA . 30134 1 1358 . 1 1 149 149 PHE HB2 H 1 3.131 0.000 . 2 . . . A 461 PHE HB2 . 30134 1 1359 . 1 1 149 149 PHE HB3 H 1 3.162 0.000 . 2 . . . A 461 PHE HB3 . 30134 1 1360 . 1 1 149 149 PHE HD1 H 1 7.160 0.000 . 1 . . . A 461 PHE HD1 . 30134 1 1361 . 1 1 149 149 PHE HE1 H 1 7.329 0.000 . 1 . . . A 461 PHE HE1 . 30134 1 1362 . 1 1 149 149 PHE HZ H 1 7.262 0.000 . 1 . . . A 461 PHE HZ . 30134 1 1363 . 1 1 149 149 PHE C C 13 176.252 0.022 . 1 . . . A 461 PHE C . 30134 1 1364 . 1 1 149 149 PHE CA C 13 62.513 0.047 . 1 . . . A 461 PHE CA . 30134 1 1365 . 1 1 149 149 PHE CB C 13 38.799 0.063 . 1 . . . A 461 PHE CB . 30134 1 1366 . 1 1 149 149 PHE CD1 C 13 131.330 0.000 . 1 . . . A 461 PHE CD1 . 30134 1 1367 . 1 1 149 149 PHE CE1 C 13 131.651 0.000 . 1 . . . A 461 PHE CE1 . 30134 1 1368 . 1 1 149 149 PHE CZ C 13 129.908 0.000 . 1 . . . A 461 PHE CZ . 30134 1 1369 . 1 1 149 149 PHE N N 15 120.527 0.000 . 1 . . . A 461 PHE N . 30134 1 1370 . 1 1 150 150 THR H H 1 8.104 0.002 . 1 . . . A 462 THR H . 30134 1 1371 . 1 1 150 150 THR HA H 1 4.438 0.016 . 1 . . . A 462 THR HA . 30134 1 1372 . 1 1 150 150 THR HG21 H 1 1.278 0.000 . 1 . . . A 462 THR HG21 . 30134 1 1373 . 1 1 150 150 THR HG22 H 1 1.278 0.000 . 1 . . . A 462 THR HG22 . 30134 1 1374 . 1 1 150 150 THR HG23 H 1 1.278 0.000 . 1 . . . A 462 THR HG23 . 30134 1 1375 . 1 1 150 150 THR C C 13 175.383 0.000 . 1 . . . A 462 THR C . 30134 1 1376 . 1 1 150 150 THR CA C 13 66.444 0.063 . 1 . . . A 462 THR CA . 30134 1 1377 . 1 1 150 150 THR CB C 13 69.116 0.023 . 1 . . . A 462 THR CB . 30134 1 1378 . 1 1 150 150 THR CG2 C 13 21.661 0.000 . 1 . . . A 462 THR CG2 . 30134 1 1379 . 1 1 150 150 THR N N 15 113.735 0.000 . 1 . . . A 462 THR N . 30134 1 1380 . 1 1 151 151 ALA H H 1 7.634 0.007 . 1 . . . A 463 ALA H . 30134 1 1381 . 1 1 151 151 ALA HA H 1 4.097 0.010 . 1 . . . A 463 ALA HA . 30134 1 1382 . 1 1 151 151 ALA HB1 H 1 1.468 0.012 . 1 . . . A 463 ALA HB1 . 30134 1 1383 . 1 1 151 151 ALA HB2 H 1 1.468 0.012 . 1 . . . A 463 ALA HB2 . 30134 1 1384 . 1 1 151 151 ALA HB3 H 1 1.468 0.012 . 1 . . . A 463 ALA HB3 . 30134 1 1385 . 1 1 151 151 ALA C C 13 178.499 0.024 . 1 . . . A 463 ALA C . 30134 1 1386 . 1 1 151 151 ALA CA C 13 54.750 0.115 . 1 . . . A 463 ALA CA . 30134 1 1387 . 1 1 151 151 ALA CB C 13 18.274 0.086 . 1 . . . A 463 ALA CB . 30134 1 1388 . 1 1 151 151 ALA N N 15 122.231 0.032 . 1 . . . A 463 ALA N . 30134 1 1389 . 1 1 152 152 MET H H 1 7.737 0.003 . 1 . . . A 464 MET H . 30134 1 1390 . 1 1 152 152 MET HA H 1 4.330 0.000 . 1 . . . A 464 MET HA . 30134 1 1391 . 1 1 152 152 MET HB2 H 1 2.112 0.000 . 2 . . . A 464 MET HB2 . 30134 1 1392 . 1 1 152 152 MET HB3 H 1 2.112 0.000 . 2 . . . A 464 MET HB3 . 30134 1 1393 . 1 1 152 152 MET HG2 H 1 2.636 0.000 . 2 . . . A 464 MET HG2 . 30134 1 1394 . 1 1 152 152 MET HG3 H 1 2.636 0.000 . 2 . . . A 464 MET HG3 . 30134 1 1395 . 1 1 152 152 MET HE1 H 1 2.110 0.000 . 1 . . . A 464 MET HE1 . 30134 1 1396 . 1 1 152 152 MET HE2 H 1 2.110 0.000 . 1 . . . A 464 MET HE2 . 30134 1 1397 . 1 1 152 152 MET HE3 H 1 2.110 0.000 . 1 . . . A 464 MET HE3 . 30134 1 1398 . 1 1 152 152 MET C C 13 175.210 0.005 . 1 . . . A 464 MET C . 30134 1 1399 . 1 1 152 152 MET CA C 13 55.977 0.166 . 1 . . . A 464 MET CA . 30134 1 1400 . 1 1 152 152 MET CB C 13 33.188 0.128 . 1 . . . A 464 MET CB . 30134 1 1401 . 1 1 152 152 MET CG C 13 32.100 0.007 . 1 . . . A 464 MET CG . 30134 1 1402 . 1 1 152 152 MET CE C 13 18.242 0.000 . 1 . . . A 464 MET CE . 30134 1 1403 . 1 1 152 152 MET N N 15 114.976 0.000 . 1 . . . A 464 MET N . 30134 1 1404 . 1 1 153 153 ASN H H 1 7.693 0.000 . 1 . . . A 465 ASN H . 30134 1 1405 . 1 1 153 153 ASN HA H 1 4.408 0.000 . 1 . . . A 465 ASN HA . 30134 1 1406 . 1 1 153 153 ASN HB2 H 1 1.881 0.017 . 2 . . . A 465 ASN HB2 . 30134 1 1407 . 1 1 153 153 ASN HB3 H 1 2.337 0.007 . 2 . . . A 465 ASN HB3 . 30134 1 1408 . 1 1 153 153 ASN C C 13 173.657 0.017 . 1 . . . A 465 ASN C . 30134 1 1409 . 1 1 153 153 ASN CA C 13 53.720 0.028 . 1 . . . A 465 ASN CA . 30134 1 1410 . 1 1 153 153 ASN CB C 13 39.489 0.050 . 1 . . . A 465 ASN CB . 30134 1 1411 . 1 1 153 153 ASN N N 15 117.198 0.000 . 1 . . . A 465 ASN N . 30134 1 1412 . 1 1 154 154 LYS H H 1 7.658 0.000 . 1 . . . A 466 LYS H . 30134 1 1413 . 1 1 154 154 LYS HA H 1 4.298 0.000 . 1 . . . A 466 LYS HA . 30134 1 1414 . 1 1 154 154 LYS HB2 H 1 1.746 0.000 . 2 . . . A 466 LYS HB2 . 30134 1 1415 . 1 1 154 154 LYS HB3 H 1 1.836 0.013 . 2 . . . A 466 LYS HB3 . 30134 1 1416 . 1 1 154 154 LYS HG2 H 1 1.412 0.000 . 2 . . . A 466 LYS HG2 . 30134 1 1417 . 1 1 154 154 LYS HG3 H 1 1.422 0.000 . 2 . . . A 466 LYS HG3 . 30134 1 1418 . 1 1 154 154 LYS HD2 H 1 1.646 0.000 . 2 . . . A 466 LYS HD2 . 30134 1 1419 . 1 1 154 154 LYS HD3 H 1 1.646 0.000 . 2 . . . A 466 LYS HD3 . 30134 1 1420 . 1 1 154 154 LYS HE2 H 1 2.970 0.000 . 2 . . . A 466 LYS HE2 . 30134 1 1421 . 1 1 154 154 LYS HE3 H 1 2.970 0.000 . 2 . . . A 466 LYS HE3 . 30134 1 1422 . 1 1 154 154 LYS C C 13 174.607 0.027 . 1 . . . A 466 LYS C . 30134 1 1423 . 1 1 154 154 LYS CA C 13 56.505 0.101 . 1 . . . A 466 LYS CA . 30134 1 1424 . 1 1 154 154 LYS CB C 13 32.769 0.206 . 1 . . . A 466 LYS CB . 30134 1 1425 . 1 1 154 154 LYS CG C 13 24.384 0.021 . 1 . . . A 466 LYS CG . 30134 1 1426 . 1 1 154 154 LYS CD C 13 28.980 0.002 . 1 . . . A 466 LYS CD . 30134 1 1427 . 1 1 154 154 LYS CE C 13 42.249 0.005 . 1 . . . A 466 LYS CE . 30134 1 1428 . 1 1 154 154 LYS N N 15 122.029 0.000 . 1 . . . A 466 LYS N . 30134 1 1429 . 1 1 155 155 SER H H 1 7.894 0.000 . 1 . . . A 467 SER H . 30134 1 1430 . 1 1 155 155 SER C C 13 177.849 0.000 . 1 . . . A 467 SER C . 30134 1 1431 . 1 1 155 155 SER CA C 13 60.523 0.101 . 1 . . . A 467 SER CA . 30134 1 1432 . 1 1 155 155 SER CB C 13 64.920 0.000 . 1 . . . A 467 SER CB . 30134 1 1433 . 1 1 155 155 SER N N 15 123.304 0.000 . 1 . . . A 467 SER N . 30134 1 stop_ save_