data_30421 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 30421 _Entry.Title ; Solution structure of the Burkholderia thailandensis transcription antitermination protein NusB (BTH_I1529) - Seattle Structural Genomics Center for Infectious Disease target ButhA.17903.a ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2018-02-28 _Entry.Accession_date 2018-02-28 _Entry.Last_release_date 2018-03-27 _Entry.Original_release_date 2018-03-27 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.0.16 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_experimental_methods.ID _Entry_experimental_methods.Method _Entry_experimental_methods.Subtype _Entry_experimental_methods.Entry_ID 1 'SOLUTION NMR' 'SOLUTION NMR' 30421 stop_ loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 G. Buchko G. W. . . 30421 2 SSGCID 'Seattle Structural Genomics Center for Infectious Disease' . . . . 30421 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'NIAID, National Institute of Allergy and Infectious Diseases' 'Seattle Structural Genomics Center for Infectious Disease' SSGCID 30421 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID NusA . 30421 SSGCID . 30421 'Seattle Structural Genomics Center for Infectious Disease' . 30421 'Structural Genomics' . 30421 TRANSCRIPTION . 30421 'infectious disease model' . 30421 'transcription antitermnation' . 30421 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 30421 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 543 30421 '15N chemical shifts' 147 30421 '1H chemical shifts' 825 30421 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 1 . . 2018-03-29 . original BMRB . 30421 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 6CKQ . 30421 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 30421 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title ; Solution structure of the Burkholderia thailandensis transcription antitermination protein NusB (BTH_I1529). ; _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev . _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD 0353 _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _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 G. Buchko G. W. . . 30421 1 2 SSGCID SSGCID . . . . 30421 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 30421 _Assembly.ID 1 _Assembly.Name 'Transcription antitermination protein NusB' _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 . . . . . . 30421 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 30421 _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 ; GPGSMKKSARRQSRELATQG LYQWLLSNAAPGEIDAQLRG ALGYDKADKTLLDTILHGVI REHATLAEAISPSLDRPIDQ LSPVERAVLLIATYELTHQI ETPYRVIINEAVELAKTFGG SDGYKYVNGVLDKLAVKLRP AETQARRGA ; _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 149 _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 16301.551 _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 'Antitermination factor NusB' na 30421 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 . GLY . 30421 1 2 . PRO . 30421 1 3 . GLY . 30421 1 4 . SER . 30421 1 5 . MET . 30421 1 6 . LYS . 30421 1 7 . LYS . 30421 1 8 . SER . 30421 1 9 . ALA . 30421 1 10 . ARG . 30421 1 11 . ARG . 30421 1 12 . GLN . 30421 1 13 . SER . 30421 1 14 . ARG . 30421 1 15 . GLU . 30421 1 16 . LEU . 30421 1 17 . ALA . 30421 1 18 . THR . 30421 1 19 . GLN . 30421 1 20 . GLY . 30421 1 21 . LEU . 30421 1 22 . TYR . 30421 1 23 . GLN . 30421 1 24 . TRP . 30421 1 25 . LEU . 30421 1 26 . LEU . 30421 1 27 . SER . 30421 1 28 . ASN . 30421 1 29 . ALA . 30421 1 30 . ALA . 30421 1 31 . PRO . 30421 1 32 . GLY . 30421 1 33 . GLU . 30421 1 34 . ILE . 30421 1 35 . ASP . 30421 1 36 . ALA . 30421 1 37 . GLN . 30421 1 38 . LEU . 30421 1 39 . ARG . 30421 1 40 . GLY . 30421 1 41 . ALA . 30421 1 42 . LEU . 30421 1 43 . GLY . 30421 1 44 . TYR . 30421 1 45 . ASP . 30421 1 46 . LYS . 30421 1 47 . ALA . 30421 1 48 . ASP . 30421 1 49 . LYS . 30421 1 50 . THR . 30421 1 51 . LEU . 30421 1 52 . LEU . 30421 1 53 . ASP . 30421 1 54 . THR . 30421 1 55 . ILE . 30421 1 56 . LEU . 30421 1 57 . HIS . 30421 1 58 . GLY . 30421 1 59 . VAL . 30421 1 60 . ILE . 30421 1 61 . ARG . 30421 1 62 . GLU . 30421 1 63 . HIS . 30421 1 64 . ALA . 30421 1 65 . THR . 30421 1 66 . LEU . 30421 1 67 . ALA . 30421 1 68 . GLU . 30421 1 69 . ALA . 30421 1 70 . ILE . 30421 1 71 . SER . 30421 1 72 . PRO . 30421 1 73 . SER . 30421 1 74 . LEU . 30421 1 75 . ASP . 30421 1 76 . ARG . 30421 1 77 . PRO . 30421 1 78 . ILE . 30421 1 79 . ASP . 30421 1 80 . GLN . 30421 1 81 . LEU . 30421 1 82 . SER . 30421 1 83 . PRO . 30421 1 84 . VAL . 30421 1 85 . GLU . 30421 1 86 . ARG . 30421 1 87 . ALA . 30421 1 88 . VAL . 30421 1 89 . LEU . 30421 1 90 . LEU . 30421 1 91 . ILE . 30421 1 92 . ALA . 30421 1 93 . THR . 30421 1 94 . TYR . 30421 1 95 . GLU . 30421 1 96 . LEU . 30421 1 97 . THR . 30421 1 98 . HIS . 30421 1 99 . GLN . 30421 1 100 . ILE . 30421 1 101 . GLU . 30421 1 102 . THR . 30421 1 103 . PRO . 30421 1 104 . TYR . 30421 1 105 . ARG . 30421 1 106 . VAL . 30421 1 107 . ILE . 30421 1 108 . ILE . 30421 1 109 . ASN . 30421 1 110 . GLU . 30421 1 111 . ALA . 30421 1 112 . VAL . 30421 1 113 . GLU . 30421 1 114 . LEU . 30421 1 115 . ALA . 30421 1 116 . LYS . 30421 1 117 . THR . 30421 1 118 . PHE . 30421 1 119 . GLY . 30421 1 120 . GLY . 30421 1 121 . SER . 30421 1 122 . ASP . 30421 1 123 . GLY . 30421 1 124 . TYR . 30421 1 125 . LYS . 30421 1 126 . TYR . 30421 1 127 . VAL . 30421 1 128 . ASN . 30421 1 129 . GLY . 30421 1 130 . VAL . 30421 1 131 . LEU . 30421 1 132 . ASP . 30421 1 133 . LYS . 30421 1 134 . LEU . 30421 1 135 . ALA . 30421 1 136 . VAL . 30421 1 137 . LYS . 30421 1 138 . LEU . 30421 1 139 . ARG . 30421 1 140 . PRO . 30421 1 141 . ALA . 30421 1 142 . GLU . 30421 1 143 . THR . 30421 1 144 . GLN . 30421 1 145 . ALA . 30421 1 146 . ARG . 30421 1 147 . ARG . 30421 1 148 . GLY . 30421 1 149 . ALA . 30421 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 30421 1 . PRO 2 2 30421 1 . GLY 3 3 30421 1 . SER 4 4 30421 1 . MET 5 5 30421 1 . LYS 6 6 30421 1 . LYS 7 7 30421 1 . SER 8 8 30421 1 . ALA 9 9 30421 1 . ARG 10 10 30421 1 . ARG 11 11 30421 1 . GLN 12 12 30421 1 . SER 13 13 30421 1 . ARG 14 14 30421 1 . GLU 15 15 30421 1 . LEU 16 16 30421 1 . ALA 17 17 30421 1 . THR 18 18 30421 1 . GLN 19 19 30421 1 . GLY 20 20 30421 1 . LEU 21 21 30421 1 . TYR 22 22 30421 1 . GLN 23 23 30421 1 . TRP 24 24 30421 1 . LEU 25 25 30421 1 . LEU 26 26 30421 1 . SER 27 27 30421 1 . ASN 28 28 30421 1 . ALA 29 29 30421 1 . ALA 30 30 30421 1 . PRO 31 31 30421 1 . GLY 32 32 30421 1 . GLU 33 33 30421 1 . ILE 34 34 30421 1 . ASP 35 35 30421 1 . ALA 36 36 30421 1 . GLN 37 37 30421 1 . LEU 38 38 30421 1 . ARG 39 39 30421 1 . GLY 40 40 30421 1 . ALA 41 41 30421 1 . LEU 42 42 30421 1 . GLY 43 43 30421 1 . TYR 44 44 30421 1 . ASP 45 45 30421 1 . LYS 46 46 30421 1 . ALA 47 47 30421 1 . ASP 48 48 30421 1 . LYS 49 49 30421 1 . THR 50 50 30421 1 . LEU 51 51 30421 1 . LEU 52 52 30421 1 . ASP 53 53 30421 1 . THR 54 54 30421 1 . ILE 55 55 30421 1 . LEU 56 56 30421 1 . HIS 57 57 30421 1 . GLY 58 58 30421 1 . VAL 59 59 30421 1 . ILE 60 60 30421 1 . ARG 61 61 30421 1 . GLU 62 62 30421 1 . HIS 63 63 30421 1 . ALA 64 64 30421 1 . THR 65 65 30421 1 . LEU 66 66 30421 1 . ALA 67 67 30421 1 . GLU 68 68 30421 1 . ALA 69 69 30421 1 . ILE 70 70 30421 1 . SER 71 71 30421 1 . PRO 72 72 30421 1 . SER 73 73 30421 1 . LEU 74 74 30421 1 . ASP 75 75 30421 1 . ARG 76 76 30421 1 . PRO 77 77 30421 1 . ILE 78 78 30421 1 . ASP 79 79 30421 1 . GLN 80 80 30421 1 . LEU 81 81 30421 1 . SER 82 82 30421 1 . PRO 83 83 30421 1 . VAL 84 84 30421 1 . GLU 85 85 30421 1 . ARG 86 86 30421 1 . ALA 87 87 30421 1 . VAL 88 88 30421 1 . LEU 89 89 30421 1 . LEU 90 90 30421 1 . ILE 91 91 30421 1 . ALA 92 92 30421 1 . THR 93 93 30421 1 . TYR 94 94 30421 1 . GLU 95 95 30421 1 . LEU 96 96 30421 1 . THR 97 97 30421 1 . HIS 98 98 30421 1 . GLN 99 99 30421 1 . ILE 100 100 30421 1 . GLU 101 101 30421 1 . THR 102 102 30421 1 . PRO 103 103 30421 1 . TYR 104 104 30421 1 . ARG 105 105 30421 1 . VAL 106 106 30421 1 . ILE 107 107 30421 1 . ILE 108 108 30421 1 . ASN 109 109 30421 1 . GLU 110 110 30421 1 . ALA 111 111 30421 1 . VAL 112 112 30421 1 . GLU 113 113 30421 1 . LEU 114 114 30421 1 . ALA 115 115 30421 1 . LYS 116 116 30421 1 . THR 117 117 30421 1 . PHE 118 118 30421 1 . GLY 119 119 30421 1 . GLY 120 120 30421 1 . SER 121 121 30421 1 . ASP 122 122 30421 1 . GLY 123 123 30421 1 . TYR 124 124 30421 1 . LYS 125 125 30421 1 . TYR 126 126 30421 1 . VAL 127 127 30421 1 . ASN 128 128 30421 1 . GLY 129 129 30421 1 . VAL 130 130 30421 1 . LEU 131 131 30421 1 . ASP 132 132 30421 1 . LYS 133 133 30421 1 . LEU 134 134 30421 1 . ALA 135 135 30421 1 . VAL 136 136 30421 1 . LYS 137 137 30421 1 . LEU 138 138 30421 1 . ARG 139 139 30421 1 . PRO 140 140 30421 1 . ALA 141 141 30421 1 . GLU 142 142 30421 1 . THR 143 143 30421 1 . GLN 144 144 30421 1 . ALA 145 145 30421 1 . ARG 146 146 30421 1 . ARG 147 147 30421 1 . GLY 148 148 30421 1 . ALA 149 149 30421 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 30421 _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 . 271848 organism . 'Burkholderia thailandensis (strain ATCC 700388 / DSM 13276 / CIP 106301 / E264)' 'Burkholderia thailandensis' . . Bacteria . Burkholderia thailandensis 'ATCC 700388 / DSM 13276 / CIP 106301 / E264' . . . . . . . . . . 'nusB, BTH_I1529' . 30421 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 30421 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . 562 Escherichia coli . . . . . . . . . . 30421 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 30421 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details '1 mM [U-99% 13C; U-99% 15N] NusB, 100 mM sodium chloride, 20 mM TRIS, 1 mM DTT, 93% H2O/7% D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '93% H2O/7% 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 NusB '[U-99% 13C; U-99% 15N]' . . 1 $entity_1 . . 1 . . mM 0.3 . . . 30421 1 2 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM 0.05 . . . 30421 1 3 TRIS 'natural abundance' . . . . . . 20 . . mM 0.05 . . . 30421 1 4 DTT 'natural abundance' . . . . . . 1 . . mM 0.02 . . . 30421 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 30421 _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' 0.12 . M 30421 1 pH 7 0.1 pH 30421 1 pressure 1 . atm 30421 1 temperature 293 0.4 K 30421 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 30421 _Software.ID 1 _Software.Type . _Software.Name SPARKY _Software.Version 3.13 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 30421 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 30421 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 30421 _Software.ID 2 _Software.Type . _Software.Name CYANA _Software.Version 2.1 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 30421 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure calculation' 30421 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 30421 _Software.ID 3 _Software.Type . _Software.Name CNS _Software.Version 1.1 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Brunger, Adams, Clore, Gros, Nilges and Read' . . 30421 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 30421 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 30421 _Software.ID 4 _Software.Type . _Software.Name PSVS _Software.Version 1.5 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bhattacharya and Montelione' . . 30421 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'peak picking' 30421 4 stop_ save_ save_software_5 _Software.Sf_category software _Software.Sf_framecode software_5 _Software.Entry_ID 30421 _Software.ID 5 _Software.Type . _Software.Name Felix _Software.Version 2007 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Accelrys Software Inc.' . . 30421 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 30421 5 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 30421 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model VXRS _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 30421 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Agilent _NMR_spectrometer.Model VXRS _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 750 save_ save_NMR_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_3 _NMR_spectrometer.Entry_ID 30421 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Agilent _NMR_spectrometer.Model VXRS _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 30421 _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 Varian VXRS . 600 . . . 30421 1 2 NMR_spectrometer_2 Agilent VXRS . 750 . . . 30421 1 3 NMR_spectrometer_3 Agilent VXRS . 800 . . . 30421 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 30421 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 30421 1 2 '2D 1H-13C HSQC aliphatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30421 1 3 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30421 1 4 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30421 1 5 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30421 1 6 '2D Deltas' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30421 1 7 'deuterium exchange' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30421 1 8 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30421 1 9 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30421 1 10 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $NMR_spectrometer_3 . . . . . . . . . . . . . . . . 30421 1 11 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30421 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 30421 _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 . . . . . 30421 1 H 1 DSS 'methyl protons' . . . . ppm 0.000 internal direct 1.0 . . . . . 30421 1 N 15 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.10132912 . . . . . 30421 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 30421 _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 '2D 1H-15N HSQC' . . . 30421 1 2 '2D 1H-13C HSQC aliphatic' . . . 30421 1 3 '2D 1H-13C HSQC aromatic' . . . 30421 1 4 '3D HNCO' . . . 30421 1 5 '3D HNCACB' . . . 30421 1 6 '2D Deltas' . . . 30421 1 7 'deuterium exchange' . . . 30421 1 8 '3D 1H-13C NOESY aromatic' . . . 30421 1 9 '3D 1H-13C NOESY aliphatic' . . . 30421 1 10 '3D 1H-15N NOESY' . . . 30421 1 11 '3D C(CO)NH' . . . 30421 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.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 2 2 PRO C C 13 177.5 0.2 . 1 . . . . A 2 PRO C . 30421 1 2 . 1 1 2 2 PRO CA C 13 64.6 0.2 . 1 . . . . A 2 PRO CA . 30421 1 3 . 1 1 2 2 PRO CB C 13 33.2 0.2 . 1 . . . . A 2 PRO CB . 30421 1 4 . 1 1 2 2 PRO CG C 13 28.1 0.2 . 1 . . . . A 2 PRO CG . 30421 1 5 . 1 1 2 2 PRO CD C 13 50.6 0.2 . 1 . . . . A 2 PRO CD . 30421 1 6 . 1 1 3 3 GLY H H 1 8.66 0.2 . 1 . . . . A 3 GLY H . 30421 1 7 . 1 1 3 3 GLY C C 13 174.3 0.2 . 1 . . . . A 3 GLY C . 30421 1 8 . 1 1 3 3 GLY CA C 13 46.3 0.2 . 1 . . . . A 3 GLY CA . 30421 1 9 . 1 1 3 3 GLY N N 15 109.7 0.2 . 1 . . . . A 3 GLY N . 30421 1 10 . 1 1 4 4 SER H H 1 8.20 0.2 . 1 . . . . A 4 SER H . 30421 1 11 . 1 1 4 4 SER C C 13 174.7 0.2 . 1 . . . . A 4 SER C . 30421 1 12 . 1 1 4 4 SER CA C 13 59.5 0.2 . 1 . . . . A 4 SER CA . 30421 1 13 . 1 1 4 4 SER CB C 13 64.6 0.2 . 1 . . . . A 4 SER CB . 30421 1 14 . 1 1 4 4 SER N N 15 115.4 0.2 . 1 . . . . A 4 SER N . 30421 1 15 . 1 1 5 5 MET H H 1 8.43 0.2 . 1 . . . . A 5 MET H . 30421 1 16 . 1 1 5 5 MET C C 13 176.2 0.2 . 1 . . . . A 5 MET C . 30421 1 17 . 1 1 5 5 MET CA C 13 56.7 0.2 . 1 . . . . A 5 MET CA . 30421 1 18 . 1 1 5 5 MET CB C 13 33.8 0.2 . 1 . . . . A 5 MET CB . 30421 1 19 . 1 1 5 5 MET CG C 13 32.9 0.2 . 1 . . . . A 5 MET CG . 30421 1 20 . 1 1 5 5 MET N N 15 122.3 0.2 . 1 . . . . A 5 MET N . 30421 1 21 . 1 1 6 6 LYS H H 1 8.31 0.2 . 1 . . . . A 6 LYS H . 30421 1 22 . 1 1 6 6 LYS C C 13 176.4 0.2 . 1 . . . . A 6 LYS C . 30421 1 23 . 1 1 6 6 LYS CA C 13 57.6 0.2 . 1 . . . . A 6 LYS CA . 30421 1 24 . 1 1 6 6 LYS CB C 13 33.9 0.2 . 1 . . . . A 6 LYS CB . 30421 1 25 . 1 1 6 6 LYS CG C 13 30.0 0.2 . 1 . . . . A 6 LYS CG . 30421 1 26 . 1 1 6 6 LYS CD C 13 25.8 0.2 . 1 . . . . A 6 LYS CD . 30421 1 27 . 1 1 6 6 LYS CE C 13 43.1 0.2 . 1 . . . . A 6 LYS CE . 30421 1 28 . 1 1 6 6 LYS N N 15 122.9 0.2 . 1 . . . . A 6 LYS N . 30421 1 29 . 1 1 7 7 LYS H H 1 8.36 0.02 . 1 . . . . A 7 LYS H . 30421 1 30 . 1 1 7 7 LYS HA H 1 4.28 0.02 . 1 . . . . A 7 LYS HA . 30421 1 31 . 1 1 7 7 LYS HB2 H 1 1.74 0.02 . 2 . . . . A 7 LYS HB2 . 30421 1 32 . 1 1 7 7 LYS HB3 H 1 1.68 0.02 . 2 . . . . A 7 LYS HB3 . 30421 1 33 . 1 1 7 7 LYS C C 13 176.9 0.2 . 1 . . . . A 7 LYS C . 30421 1 34 . 1 1 7 7 LYS CA C 13 56.5 0.2 . 1 . . . . A 7 LYS CA . 30421 1 35 . 1 1 7 7 LYS CB C 13 33.5 0.2 . 1 . . . . A 7 LYS CB . 30421 1 36 . 1 1 7 7 LYS CG C 13 30.2 0.2 . 1 . . . . A 7 LYS CG . 30421 1 37 . 1 1 7 7 LYS CD C 13 26.2 0.2 . 1 . . . . A 7 LYS CD . 30421 1 38 . 1 1 7 7 LYS CE C 13 43.2 0.2 . 1 . . . . A 7 LYS CE . 30421 1 39 . 1 1 7 7 LYS N N 15 123.4 0.2 . 1 . . . . A 7 LYS N . 30421 1 40 . 1 1 8 8 SER H H 1 8.84 0.02 . 1 . . . . A 8 SER H . 30421 1 41 . 1 1 8 8 SER HB2 H 1 4.35 0.02 . 2 . . . . A 8 SER HB2 . 30421 1 42 . 1 1 8 8 SER HB3 H 1 4.06 0.02 . 2 . . . . A 8 SER HB3 . 30421 1 43 . 1 1 8 8 SER C C 13 174.8 0.2 . 1 . . . . A 8 SER C . 30421 1 44 . 1 1 8 8 SER CA C 13 59.2 0.2 . 1 . . . . A 8 SER CA . 30421 1 45 . 1 1 8 8 SER CB C 13 64.3 0.2 . 1 . . . . A 8 SER CB . 30421 1 46 . 1 1 8 8 SER N N 15 120.9 0.2 . 1 . . . . A 8 SER N . 30421 1 47 . 1 1 9 9 ALA H H 1 8.78 0.02 . 1 . . . . A 9 ALA H . 30421 1 48 . 1 1 9 9 ALA HB1 H 1 1.53 0.02 . 1 . . . . A 9 ALA HB1 . 30421 1 49 . 1 1 9 9 ALA HB2 H 1 1.53 0.02 . 1 . . . . A 9 ALA HB2 . 30421 1 50 . 1 1 9 9 ALA HB3 H 1 1.53 0.02 . 1 . . . . A 9 ALA HB3 . 30421 1 51 . 1 1 9 9 ALA C C 13 180.9 0.2 . 1 . . . . A 9 ALA C . 30421 1 52 . 1 1 9 9 ALA CA C 13 56.5 0.2 . 1 . . . . A 9 ALA CA . 30421 1 53 . 1 1 9 9 ALA CB C 13 18.7 0.2 . 1 . . . . A 9 ALA CB . 30421 1 54 . 1 1 9 9 ALA N N 15 125.7 0.2 . 1 . . . . A 9 ALA N . 30421 1 55 . 1 1 10 10 ARG H H 1 8.24 0.02 . 1 . . . . A 10 ARG H . 30421 1 56 . 1 1 10 10 ARG C C 13 178.1 0.2 . 1 . . . . A 10 ARG C . 30421 1 57 . 1 1 10 10 ARG CA C 13 60.9 0.2 . 1 . . . . A 10 ARG CA . 30421 1 58 . 1 1 10 10 ARG CB C 13 31.1 0.2 . 1 . . . . A 10 ARG CB . 30421 1 59 . 1 1 10 10 ARG CD C 13 42.2 0.2 . 1 . . . . A 10 ARG CD . 30421 1 60 . 1 1 10 10 ARG N N 15 117.0 0.2 . 1 . . . . A 10 ARG N . 30421 1 61 . 1 1 11 11 ARG H H 1 8.12 0.02 . 1 . . . . A 11 ARG H . 30421 1 62 . 1 1 11 11 ARG C C 13 179.0 0.2 . 1 . . . . A 11 ARG C . 30421 1 63 . 1 1 11 11 ARG N N 15 121.7 0.2 . 1 . . . . A 11 ARG N . 30421 1 64 . 1 1 12 12 GLN H H 1 8.37 0.02 . 1 . . . . A 12 GLN H . 30421 1 65 . 1 1 12 12 GLN HA H 1 4.11 0.02 . 1 . . . . A 12 GLN HA . 30421 1 66 . 1 1 12 12 GLN HB2 H 1 2.26 0.02 . 2 . . . . A 12 GLN HB2 . 30421 1 67 . 1 1 12 12 GLN HB3 H 1 2.13 0.02 . 2 . . . . A 12 GLN HB3 . 30421 1 68 . 1 1 12 12 GLN HG2 H 1 2.36 0.02 . 2 . . . . A 12 GLN HG2 . 30421 1 69 . 1 1 12 12 GLN HG3 H 1 2.12 0.02 . 2 . . . . A 12 GLN HG3 . 30421 1 70 . 1 1 12 12 GLN HE21 H 1 7.21 0.02 . 2 . . . . A 12 GLN HE21 . 30421 1 71 . 1 1 12 12 GLN HE22 H 1 6.78 0.02 . 2 . . . . A 12 GLN HE22 . 30421 1 72 . 1 1 12 12 GLN C C 13 179.4 0.2 . 1 . . . . A 12 GLN C . 30421 1 73 . 1 1 12 12 GLN CA C 13 59.0 0.2 . 1 . . . . A 12 GLN CA . 30421 1 74 . 1 1 12 12 GLN CB C 13 28.2 0.2 . 1 . . . . A 12 GLN CB . 30421 1 75 . 1 1 12 12 GLN CG C 13 34.4 0.2 . 1 . . . . A 12 GLN CG . 30421 1 76 . 1 1 12 12 GLN N N 15 118.3 0.2 . 1 . . . . A 12 GLN N . 30421 1 77 . 1 1 12 12 GLN NE2 N 15 112.1 0.2 . 1 . . . . A 12 GLN NE2 . 30421 1 78 . 1 1 13 13 SER H H 1 8.61 0.02 . 1 . . . . A 13 SER H . 30421 1 79 . 1 1 13 13 SER C C 13 175.2 0.2 . 1 . . . . A 13 SER C . 30421 1 80 . 1 1 13 13 SER CA C 13 62.3 0.2 . 1 . . . . A 13 SER CA . 30421 1 81 . 1 1 13 13 SER CB C 13 65.1 0.2 . 1 . . . . A 13 SER CB . 30421 1 82 . 1 1 13 13 SER N N 15 115.9 0.2 . 1 . . . . A 13 SER N . 30421 1 83 . 1 1 14 14 ARG H H 1 8.18 0.02 . 1 . . . . A 14 ARG H . 30421 1 84 . 1 1 14 14 ARG C C 13 174.7 0.2 . 1 . . . . A 14 ARG C . 30421 1 85 . 1 1 14 14 ARG CA C 13 62.0 0.2 . 1 . . . . A 14 ARG CA . 30421 1 86 . 1 1 14 14 ARG CB C 13 31.7 0.2 . 1 . . . . A 14 ARG CB . 30421 1 87 . 1 1 14 14 ARG N N 15 121.1 0.2 . 1 . . . . A 14 ARG N . 30421 1 88 . 1 1 15 15 GLU H H 1 8.82 0.02 . 1 . . . . A 15 GLU H . 30421 1 89 . 1 1 15 15 GLU HA H 1 4.03 0.02 . 1 . . . . A 15 GLU HA . 30421 1 90 . 1 1 15 15 GLU C C 13 179.2 0.2 . 1 . . . . A 15 GLU C . 30421 1 91 . 1 1 15 15 GLU CA C 13 60.8 0.2 . 1 . . . . A 15 GLU CA . 30421 1 92 . 1 1 15 15 GLU N N 15 121.9 0.2 . 1 . . . . A 15 GLU N . 30421 1 93 . 1 1 16 16 LEU H H 1 8.35 0.02 . 1 . . . . A 16 LEU H . 30421 1 94 . 1 1 16 16 LEU HA H 1 3.96 0.02 . 1 . . . . A 16 LEU HA . 30421 1 95 . 1 1 16 16 LEU HB2 H 1 3.44 0.02 . 2 . . . . A 16 LEU HB2 . 30421 1 96 . 1 1 16 16 LEU HB3 H 1 3.44 0.02 . 2 . . . . A 16 LEU HB3 . 30421 1 97 . 1 1 16 16 LEU C C 13 178.4 0.2 . 1 . . . . A 16 LEU C . 30421 1 98 . 1 1 16 16 LEU CA C 13 57.9 0.2 . 1 . . . . A 16 LEU CA . 30421 1 99 . 1 1 16 16 LEU CB C 13 42.5 0.2 . 1 . . . . A 16 LEU CB . 30421 1 100 . 1 1 16 16 LEU CG C 13 28.4 0.2 . 1 . . . . A 16 LEU CG . 30421 1 101 . 1 1 16 16 LEU N N 15 120.1 0.2 . 1 . . . . A 16 LEU N . 30421 1 102 . 1 1 17 17 ALA H H 1 8.77 0.02 . 1 . . . . A 17 ALA H . 30421 1 103 . 1 1 17 17 ALA HA H 1 3.83 0.02 . 1 . . . . A 17 ALA HA . 30421 1 104 . 1 1 17 17 ALA HB1 H 1 1.34 0.02 . 1 . . . . A 17 ALA HB1 . 30421 1 105 . 1 1 17 17 ALA HB2 H 1 1.34 0.02 . 1 . . . . A 17 ALA HB2 . 30421 1 106 . 1 1 17 17 ALA HB3 H 1 1.34 0.02 . 1 . . . . A 17 ALA HB3 . 30421 1 107 . 1 1 17 17 ALA C C 13 178.7 0.2 . 1 . . . . A 17 ALA C . 30421 1 108 . 1 1 17 17 ALA CA C 13 55.3 0.2 . 1 . . . . A 17 ALA CA . 30421 1 109 . 1 1 17 17 ALA CB C 13 17.3 0.2 . 1 . . . . A 17 ALA CB . 30421 1 110 . 1 1 17 17 ALA N N 15 121.1 0.2 . 1 . . . . A 17 ALA N . 30421 1 111 . 1 1 18 18 THR H H 1 7.90 0.02 . 1 . . . . A 18 THR H . 30421 1 112 . 1 1 18 18 THR HA H 1 3.52 0.02 . 1 . . . . A 18 THR HA . 30421 1 113 . 1 1 18 18 THR HB H 1 4.11 0.02 . 1 . . . . A 18 THR HB . 30421 1 114 . 1 1 18 18 THR HG21 H 1 0.67 0.02 . 1 . . . . A 18 THR HG21 . 30421 1 115 . 1 1 18 18 THR HG22 H 1 0.67 0.02 . 1 . . . . A 18 THR HG22 . 30421 1 116 . 1 1 18 18 THR HG23 H 1 0.67 0.02 . 1 . . . . A 18 THR HG23 . 30421 1 117 . 1 1 18 18 THR C C 13 175.3 0.2 . 1 . . . . A 18 THR C . 30421 1 118 . 1 1 18 18 THR CA C 13 68.4 0.2 . 1 . . . . A 18 THR CA . 30421 1 119 . 1 1 18 18 THR CB C 13 67.4 0.2 . 1 . . . . A 18 THR CB . 30421 1 120 . 1 1 18 18 THR CG2 C 13 20.7 0.2 . 1 . . . . A 18 THR CG2 . 30421 1 121 . 1 1 18 18 THR N N 15 115.7 0.2 . 1 . . . . A 18 THR N . 30421 1 122 . 1 1 19 19 GLN H H 1 7.64 0.02 . 1 . . . . A 19 GLN H . 30421 1 123 . 1 1 19 19 GLN HA H 1 3.81 0.02 . 1 . . . . A 19 GLN HA . 30421 1 124 . 1 1 19 19 GLN HG2 H 1 2.35 0.02 . 2 . . . . A 19 GLN HG2 . 30421 1 125 . 1 1 19 19 GLN HG3 H 1 2.22 0.02 . 2 . . . . A 19 GLN HG3 . 30421 1 126 . 1 1 19 19 GLN C C 13 179.0 0.2 . 1 . . . . A 19 GLN C . 30421 1 127 . 1 1 19 19 GLN CA C 13 59.2 0.2 . 1 . . . . A 19 GLN CA . 30421 1 128 . 1 1 19 19 GLN CB C 13 29.5 0.2 . 1 . . . . A 19 GLN CB . 30421 1 129 . 1 1 19 19 GLN CG C 13 34.3 0.2 . 1 . . . . A 19 GLN CG . 30421 1 130 . 1 1 19 19 GLN N N 15 120.3 0.2 . 1 . . . . A 19 GLN N . 30421 1 131 . 1 1 20 20 GLY H H 1 8.99 0.02 . 1 . . . . A 20 GLY H . 30421 1 132 . 1 1 20 20 GLY HA2 H 1 3.92 0.02 . 2 . . . . A 20 GLY HA2 . 30421 1 133 . 1 1 20 20 GLY HA3 H 1 3.45 0.02 . 2 . . . . A 20 GLY HA3 . 30421 1 134 . 1 1 20 20 GLY C C 13 179.2 0.2 . 1 . . . . A 20 GLY C . 30421 1 135 . 1 1 20 20 GLY CA C 13 47.6 0.2 . 1 . . . . A 20 GLY CA . 30421 1 136 . 1 1 20 20 GLY N N 15 107.2 0.2 . 1 . . . . A 20 GLY N . 30421 1 137 . 1 1 21 21 LEU H H 1 8.83 0.02 . 1 . . . . A 21 LEU H . 30421 1 138 . 1 1 21 21 LEU HA H 1 4.37 0.02 . 1 . . . . A 21 LEU HA . 30421 1 139 . 1 1 21 21 LEU HD21 H 1 0.71 0.02 . 2 . . . . A 21 LEU HD21 . 30421 1 140 . 1 1 21 21 LEU HD22 H 1 0.71 0.02 . 2 . . . . A 21 LEU HD22 . 30421 1 141 . 1 1 21 21 LEU HD23 H 1 0.71 0.02 . 2 . . . . A 21 LEU HD23 . 30421 1 142 . 1 1 21 21 LEU C C 13 178.4 0.2 . 1 . . . . A 21 LEU C . 30421 1 143 . 1 1 21 21 LEU CA C 13 57.5 0.2 . 1 . . . . A 21 LEU CA . 30421 1 144 . 1 1 21 21 LEU CB C 13 43.3 0.2 . 1 . . . . A 21 LEU CB . 30421 1 145 . 1 1 21 21 LEU CG C 13 28.4 0.2 . 1 . . . . A 21 LEU CG . 30421 1 146 . 1 1 21 21 LEU CD1 C 13 27.0 0.2 . 2 . . . . A 21 LEU CD1 . 30421 1 147 . 1 1 21 21 LEU CD2 C 13 23.6 0.2 . 2 . . . . A 21 LEU CD2 . 30421 1 148 . 1 1 21 21 LEU N N 15 122.0 0.2 . 1 . . . . A 21 LEU N . 30421 1 149 . 1 1 22 22 TYR H H 1 8.78 0.02 . 1 . . . . A 22 TYR H . 30421 1 150 . 1 1 22 22 TYR HA H 1 4.07 0.02 . 1 . . . . A 22 TYR HA . 30421 1 151 . 1 1 22 22 TYR HB2 H 1 3.35 0.02 . 2 . . . . A 22 TYR HB2 . 30421 1 152 . 1 1 22 22 TYR HB3 H 1 2.93 0.02 . 2 . . . . A 22 TYR HB3 . 30421 1 153 . 1 1 22 22 TYR HD1 H 1 6.91 0.02 . 3 . . . . A 22 TYR HD1 . 30421 1 154 . 1 1 22 22 TYR HD2 H 1 6.91 0.02 . 3 . . . . A 22 TYR HD2 . 30421 1 155 . 1 1 22 22 TYR HE1 H 1 6.81 0.02 . 3 . . . . A 22 TYR HE1 . 30421 1 156 . 1 1 22 22 TYR HE2 H 1 6.81 0.02 . 3 . . . . A 22 TYR HE2 . 30421 1 157 . 1 1 22 22 TYR C C 13 176.2 0.2 . 1 . . . . A 22 TYR C . 30421 1 158 . 1 1 22 22 TYR CA C 13 61.7 0.2 . 1 . . . . A 22 TYR CA . 30421 1 159 . 1 1 22 22 TYR CB C 13 38.2 0.2 . 1 . . . . A 22 TYR CB . 30421 1 160 . 1 1 22 22 TYR CD1 C 13 133.2 0.2 . 3 . . . . A 22 TYR CD1 . 30421 1 161 . 1 1 22 22 TYR CD2 C 13 133.2 0.2 . 3 . . . . A 22 TYR CD2 . 30421 1 162 . 1 1 22 22 TYR CE1 C 13 118.7 0.2 . 3 . . . . A 22 TYR CE1 . 30421 1 163 . 1 1 22 22 TYR CE2 C 13 118.7 0.2 . 3 . . . . A 22 TYR CE2 . 30421 1 164 . 1 1 22 22 TYR N N 15 120.8 0.2 . 1 . . . . A 22 TYR N . 30421 1 165 . 1 1 23 23 GLN H H 1 7.68 0.02 . 1 . . . . A 23 GLN H . 30421 1 166 . 1 1 23 23 GLN HA H 1 3.96 0.02 . 1 . . . . A 23 GLN HA . 30421 1 167 . 1 1 23 23 GLN HB2 H 1 2.29 0.02 . 2 . . . . A 23 GLN HB2 . 30421 1 168 . 1 1 23 23 GLN HB3 H 1 2.23 0.02 . 2 . . . . A 23 GLN HB3 . 30421 1 169 . 1 1 23 23 GLN HG2 H 1 2.54 0.02 . 2 . . . . A 23 GLN HG2 . 30421 1 170 . 1 1 23 23 GLN HG3 H 1 2.49 0.02 . 2 . . . . A 23 GLN HG3 . 30421 1 171 . 1 1 23 23 GLN HE21 H 1 7.40 0.02 . 2 . . . . A 23 GLN HE21 . 30421 1 172 . 1 1 23 23 GLN HE22 H 1 6.78 0.02 . 2 . . . . A 23 GLN HE22 . 30421 1 173 . 1 1 23 23 GLN C C 13 179.6 0.2 . 1 . . . . A 23 GLN C . 30421 1 174 . 1 1 23 23 GLN CA C 13 58.5 0.2 . 1 . . . . A 23 GLN CA . 30421 1 175 . 1 1 23 23 GLN CB C 13 28.1 0.2 . 1 . . . . A 23 GLN CB . 30421 1 176 . 1 1 23 23 GLN CG C 13 33.5 0.2 . 1 . . . . A 23 GLN CG . 30421 1 177 . 1 1 23 23 GLN N N 15 116.3 0.2 . 1 . . . . A 23 GLN N . 30421 1 178 . 1 1 23 23 GLN NE2 N 15 110.2 0.2 . 1 . . . . A 23 GLN NE2 . 30421 1 179 . 1 1 24 24 TRP H H 1 8.78 0.02 . 1 . . . . A 24 TRP H . 30421 1 180 . 1 1 24 24 TRP HA H 1 4.10 0.02 . 1 . . . . A 24 TRP HA . 30421 1 181 . 1 1 24 24 TRP HB2 H 1 3.68 0.02 . 2 . . . . A 24 TRP HB2 . 30421 1 182 . 1 1 24 24 TRP HB3 H 1 3.19 0.02 . 2 . . . . A 24 TRP HB3 . 30421 1 183 . 1 1 24 24 TRP HD1 H 1 7.59 0.02 . 1 . . . . A 24 TRP HD1 . 30421 1 184 . 1 1 24 24 TRP HE1 H 1 10.19 0.02 . 1 . . . . A 24 TRP HE1 . 30421 1 185 . 1 1 24 24 TRP HE3 H 1 7.38 0.02 . 1 . . . . A 24 TRP HE3 . 30421 1 186 . 1 1 24 24 TRP HZ2 H 1 7.27 0.02 . 1 . . . . A 24 TRP HZ2 . 30421 1 187 . 1 1 24 24 TRP HZ3 H 1 6.42 0.02 . 1 . . . . A 24 TRP HZ3 . 30421 1 188 . 1 1 24 24 TRP HH2 H 1 6.50 0.02 . 1 . . . . A 24 TRP HH2 . 30421 1 189 . 1 1 24 24 TRP CA C 13 62.5 0.2 . 1 . . . . A 24 TRP CA . 30421 1 190 . 1 1 24 24 TRP CB C 13 28.2 0.2 . 1 . . . . A 24 TRP CB . 30421 1 191 . 1 1 24 24 TRP CD1 C 13 127.1 0.2 . 1 . . . . A 24 TRP CD1 . 30421 1 192 . 1 1 24 24 TRP CE3 C 13 120.3 0.2 . 1 . . . . A 24 TRP CE3 . 30421 1 193 . 1 1 24 24 TRP CZ2 C 13 114.8 0.2 . 1 . . . . A 24 TRP CZ2 . 30421 1 194 . 1 1 24 24 TRP CZ3 C 13 120.4 0.2 . 1 . . . . A 24 TRP CZ3 . 30421 1 195 . 1 1 24 24 TRP CH2 C 13 123.4 0.2 . 1 . . . . A 24 TRP CH2 . 30421 1 196 . 1 1 24 24 TRP N N 15 123.6 0.2 . 1 . . . . A 24 TRP N . 30421 1 197 . 1 1 24 24 TRP NE1 N 15 130.7 0.2 . 1 . . . . A 24 TRP NE1 . 30421 1 198 . 1 1 25 25 LEU H H 1 9.05 0.02 . 1 . . . . A 25 LEU H . 30421 1 199 . 1 1 25 25 LEU HA H 1 3.46 0.02 . 1 . . . . A 25 LEU HA . 30421 1 200 . 1 1 25 25 LEU HB2 H 1 1.98 0.02 . 2 . . . . A 25 LEU HB2 . 30421 1 201 . 1 1 25 25 LEU HB3 H 1 1.12 0.02 . 2 . . . . A 25 LEU HB3 . 30421 1 202 . 1 1 25 25 LEU HG H 1 0.91 0.02 . 1 . . . . A 25 LEU HG . 30421 1 203 . 1 1 25 25 LEU HD11 H 1 0.62 0.02 . 2 . . . . A 25 LEU HD11 . 30421 1 204 . 1 1 25 25 LEU HD12 H 1 0.62 0.02 . 2 . . . . A 25 LEU HD12 . 30421 1 205 . 1 1 25 25 LEU HD13 H 1 0.62 0.02 . 2 . . . . A 25 LEU HD13 . 30421 1 206 . 1 1 25 25 LEU HD21 H 1 0.62 0.02 . 2 . . . . A 25 LEU HD21 . 30421 1 207 . 1 1 25 25 LEU HD22 H 1 0.62 0.02 . 2 . . . . A 25 LEU HD22 . 30421 1 208 . 1 1 25 25 LEU HD23 H 1 0.62 0.02 . 2 . . . . A 25 LEU HD23 . 30421 1 209 . 1 1 25 25 LEU C C 13 177.8 0.2 . 1 . . . . A 25 LEU C . 30421 1 210 . 1 1 25 25 LEU CA C 13 57.3 0.2 . 1 . . . . A 25 LEU CA . 30421 1 211 . 1 1 25 25 LEU CB C 13 42.0 0.2 . 1 . . . . A 25 LEU CB . 30421 1 212 . 1 1 25 25 LEU CG C 13 27.2 0.2 . 1 . . . . A 25 LEU CG . 30421 1 213 . 1 1 25 25 LEU CD1 C 13 22.8 0.2 . 2 . . . . A 25 LEU CD1 . 30421 1 214 . 1 1 25 25 LEU CD2 C 13 22.8 0.2 . 2 . . . . A 25 LEU CD2 . 30421 1 215 . 1 1 25 25 LEU N N 15 120.1 0.2 . 1 . . . . A 25 LEU N . 30421 1 216 . 1 1 26 26 LEU H H 1 7.58 0.02 . 1 . . . . A 26 LEU H . 30421 1 217 . 1 1 26 26 LEU HA H 1 4.10 0.02 . 1 . . . . A 26 LEU HA . 30421 1 218 . 1 1 26 26 LEU HB2 H 1 1.53 0.02 . 2 . . . . A 26 LEU HB2 . 30421 1 219 . 1 1 26 26 LEU HB3 H 1 1.42 0.02 . 2 . . . . A 26 LEU HB3 . 30421 1 220 . 1 1 26 26 LEU HG H 1 1.46 0.02 . 1 . . . . A 26 LEU HG . 30421 1 221 . 1 1 26 26 LEU HD11 H 1 0.55 0.02 . 2 . . . . A 26 LEU HD11 . 30421 1 222 . 1 1 26 26 LEU HD12 H 1 0.55 0.02 . 2 . . . . A 26 LEU HD12 . 30421 1 223 . 1 1 26 26 LEU HD13 H 1 0.55 0.02 . 2 . . . . A 26 LEU HD13 . 30421 1 224 . 1 1 26 26 LEU HD21 H 1 0.69 0.02 . 2 . . . . A 26 LEU HD21 . 30421 1 225 . 1 1 26 26 LEU HD22 H 1 0.69 0.02 . 2 . . . . A 26 LEU HD22 . 30421 1 226 . 1 1 26 26 LEU HD23 H 1 0.69 0.02 . 2 . . . . A 26 LEU HD23 . 30421 1 227 . 1 1 26 26 LEU C C 13 178.4 0.2 . 1 . . . . A 26 LEU C . 30421 1 228 . 1 1 26 26 LEU CA C 13 56.5 0.2 . 1 . . . . A 26 LEU CA . 30421 1 229 . 1 1 26 26 LEU CB C 13 42.6 0.2 . 1 . . . . A 26 LEU CB . 30421 1 230 . 1 1 26 26 LEU CG C 13 27.0 0.2 . 1 . . . . A 26 LEU CG . 30421 1 231 . 1 1 26 26 LEU CD1 C 13 24.5 0.2 . 2 . . . . A 26 LEU CD1 . 30421 1 232 . 1 1 26 26 LEU CD2 C 13 23.3 0.2 . 2 . . . . A 26 LEU CD2 . 30421 1 233 . 1 1 26 26 LEU N N 15 117.4 0.2 . 1 . . . . A 26 LEU N . 30421 1 234 . 1 1 27 27 SER H H 1 8.02 0.02 . 1 . . . . A 27 SER H . 30421 1 235 . 1 1 27 27 SER HA H 1 4.54 0.02 . 1 . . . . A 27 SER HA . 30421 1 236 . 1 1 27 27 SER HB2 H 1 3.95 0.02 . 2 . . . . A 27 SER HB2 . 30421 1 237 . 1 1 27 27 SER HB3 H 1 3.80 0.02 . 2 . . . . A 27 SER HB3 . 30421 1 238 . 1 1 27 27 SER C C 13 174.8 0.2 . 1 . . . . A 27 SER C . 30421 1 239 . 1 1 27 27 SER CA C 13 58.5 0.2 . 1 . . . . A 27 SER CA . 30421 1 240 . 1 1 27 27 SER CB C 13 65.9 0.2 . 1 . . . . A 27 SER CB . 30421 1 241 . 1 1 27 27 SER N N 15 111.5 0.2 . 1 . . . . A 27 SER N . 30421 1 242 . 1 1 28 28 ASN H H 1 8.68 0.02 . 1 . . . . A 28 ASN H . 30421 1 243 . 1 1 28 28 ASN HA H 1 4.02 0.02 . 1 . . . . A 28 ASN HA . 30421 1 244 . 1 1 28 28 ASN HB2 H 1 3.01 0.02 . 2 . . . . A 28 ASN HB2 . 30421 1 245 . 1 1 28 28 ASN HB3 H 1 2.49 0.02 . 2 . . . . A 28 ASN HB3 . 30421 1 246 . 1 1 28 28 ASN HD21 H 1 7.36 0.02 . 2 . . . . A 28 ASN HD21 . 30421 1 247 . 1 1 28 28 ASN HD22 H 1 6.66 0.0 . 2 . . . . A 28 ASN HD22 . 30421 1 248 . 1 1 28 28 ASN C C 13 174.3 0.2 . 1 . . . . A 28 ASN C . 30421 1 249 . 1 1 28 28 ASN CA C 13 54.1 0.2 . 1 . . . . A 28 ASN CA . 30421 1 250 . 1 1 28 28 ASN CB C 13 38.0 0.2 . 1 . . . . A 28 ASN CB . 30421 1 251 . 1 1 28 28 ASN N N 15 120.9 0.2 . 1 . . . . A 28 ASN N . 30421 1 252 . 1 1 28 28 ASN ND2 N 15 111.7 0.2 . 1 . . . . A 28 ASN ND2 . 30421 1 253 . 1 1 29 29 ALA H H 1 7.13 0.02 . 1 . . . . A 29 ALA H . 30421 1 254 . 1 1 29 29 ALA HA H 1 4.20 0.02 . 1 . . . . A 29 ALA HA . 30421 1 255 . 1 1 29 29 ALA HB1 H 1 1.32 0.02 . 1 . . . . A 29 ALA HB1 . 30421 1 256 . 1 1 29 29 ALA HB2 H 1 1.32 0.02 . 1 . . . . A 29 ALA HB2 . 30421 1 257 . 1 1 29 29 ALA HB3 H 1 1.32 0.02 . 1 . . . . A 29 ALA HB3 . 30421 1 258 . 1 1 29 29 ALA C C 13 175.9 0.2 . 1 . . . . A 29 ALA C . 30421 1 259 . 1 1 29 29 ALA CA C 13 52.2 0.2 . 1 . . . . A 29 ALA CA . 30421 1 260 . 1 1 29 29 ALA CB C 13 19.8 0.2 . 1 . . . . A 29 ALA CB . 30421 1 261 . 1 1 29 29 ALA N N 15 119.4 0.2 . 1 . . . . A 29 ALA N . 30421 1 262 . 1 1 30 30 ALA H H 1 8.47 0.02 . 1 . . . . A 30 ALA H . 30421 1 263 . 1 1 30 30 ALA HA H 1 4.66 0.02 . 1 . . . . A 30 ALA HA . 30421 1 264 . 1 1 30 30 ALA HB1 H 1 1.52 0.02 . 1 . . . . A 30 ALA HB1 . 30421 1 265 . 1 1 30 30 ALA HB2 H 1 1.52 0.02 . 1 . . . . A 30 ALA HB2 . 30421 1 266 . 1 1 30 30 ALA HB3 H 1 1.52 0.02 . 1 . . . . A 30 ALA HB3 . 30421 1 267 . 1 1 30 30 ALA CA C 13 50.4 0.2 . 1 . . . . A 30 ALA CA . 30421 1 268 . 1 1 30 30 ALA CB C 13 17.7 0.2 . 1 . . . . A 30 ALA CB . 30421 1 269 . 1 1 30 30 ALA N N 15 122.4 0.2 . 1 . . . . A 30 ALA N . 30421 1 270 . 1 1 31 31 PRO C C 13 178.0 0.2 . 1 . . . . A 31 PRO C . 30421 1 271 . 1 1 31 31 PRO CA C 13 67.1 0.2 . 1 . . . . A 31 PRO CA . 30421 1 272 . 1 1 31 31 PRO CB C 13 32.7 0.2 . 1 . . . . A 31 PRO CB . 30421 1 273 . 1 1 31 31 PRO CG C 13 29.2 0.2 . 1 . . . . A 31 PRO CG . 30421 1 274 . 1 1 32 32 GLY H H 1 8.84 0.02 . 1 . . . . A 32 GLY H . 30421 1 275 . 1 1 32 32 GLY HA2 H 1 3.94 0.02 . 2 . . . . A 32 GLY HA2 . 30421 1 276 . 1 1 32 32 GLY HA3 H 1 3.94 0.02 . 2 . . . . A 32 GLY HA3 . 30421 1 277 . 1 1 32 32 GLY C C 13 177.2 0.2 . 1 . . . . A 32 GLY C . 30421 1 278 . 1 1 32 32 GLY CA C 13 46.8 0.2 . 1 . . . . A 32 GLY CA . 30421 1 279 . 1 1 32 32 GLY N N 15 102.9 0.2 . 1 . . . . A 32 GLY N . 30421 1 280 . 1 1 33 33 GLU H H 1 7.50 0.02 . 1 . . . . A 33 GLU H . 30421 1 281 . 1 1 33 33 GLU HA H 1 4.24 0.02 . 1 . . . . A 33 GLU HA . 30421 1 282 . 1 1 33 33 GLU HB2 H 1 2.35 0.02 . 2 . . . . A 33 GLU HB2 . 30421 1 283 . 1 1 33 33 GLU HB3 H 1 2.14 0.02 . 2 . . . . A 33 GLU HB3 . 30421 1 284 . 1 1 33 33 GLU HG2 H 1 2.31 0.02 . 2 . . . . A 33 GLU HG2 . 30421 1 285 . 1 1 33 33 GLU HG3 H 1 2.31 0.02 . 2 . . . . A 33 GLU HG3 . 30421 1 286 . 1 1 33 33 GLU C C 13 179.1 0.2 . 1 . . . . A 33 GLU C . 30421 1 287 . 1 1 33 33 GLU CA C 13 58.4 0.2 . 1 . . . . A 33 GLU CA . 30421 1 288 . 1 1 33 33 GLU CB C 13 29.5 0.2 . 1 . . . . A 33 GLU CB . 30421 1 289 . 1 1 33 33 GLU CG C 13 36.5 0.2 . 1 . . . . A 33 GLU CG . 30421 1 290 . 1 1 33 33 GLU N N 15 122.0 0.2 . 1 . . . . A 33 GLU N . 30421 1 291 . 1 1 34 34 ILE H H 1 7.65 0.02 . 1 . . . . A 34 ILE H . 30421 1 292 . 1 1 34 34 ILE HA H 1 3.69 0.02 . 1 . . . . A 34 ILE HA . 30421 1 293 . 1 1 34 34 ILE HB H 1 2.04 0.02 . 1 . . . . A 34 ILE HB . 30421 1 294 . 1 1 34 34 ILE HG12 H 1 1.49 0.02 . 2 . . . . A 34 ILE HG12 . 30421 1 295 . 1 1 34 34 ILE HG13 H 1 1.27 0.02 . 2 . . . . A 34 ILE HG13 . 30421 1 296 . 1 1 34 34 ILE HG21 H 1 1.51 0.02 . 1 . . . . A 34 ILE HG21 . 30421 1 297 . 1 1 34 34 ILE HG22 H 1 1.51 0.02 . 1 . . . . A 34 ILE HG22 . 30421 1 298 . 1 1 34 34 ILE HG23 H 1 1.51 0.02 . 1 . . . . A 34 ILE HG23 . 30421 1 299 . 1 1 34 34 ILE HD11 H 1 0.83 0.02 . 1 . . . . A 34 ILE HD11 . 30421 1 300 . 1 1 34 34 ILE HD12 H 1 0.83 0.02 . 1 . . . . A 34 ILE HD12 . 30421 1 301 . 1 1 34 34 ILE HD13 H 1 0.83 0.02 . 1 . . . . A 34 ILE HD13 . 30421 1 302 . 1 1 34 34 ILE C C 13 178.2 0.2 . 1 . . . . A 34 ILE C . 30421 1 303 . 1 1 34 34 ILE CA C 13 63.6 0.2 . 1 . . . . A 34 ILE CA . 30421 1 304 . 1 1 34 34 ILE CB C 13 36.7 0.2 . 1 . . . . A 34 ILE CB . 30421 1 305 . 1 1 34 34 ILE CG1 C 13 27.7 0.2 . 1 . . . . A 34 ILE CG1 . 30421 1 306 . 1 1 34 34 ILE CG2 C 13 18.1 0.2 . 1 . . . . A 34 ILE CG2 . 30421 1 307 . 1 1 34 34 ILE CD1 C 13 11.7 0.2 . 1 . . . . A 34 ILE CD1 . 30421 1 308 . 1 1 34 34 ILE N N 15 121.3 0.2 . 1 . . . . A 34 ILE N . 30421 1 309 . 1 1 35 35 ASP H H 1 8.43 0.02 . 1 . . . . A 35 ASP H . 30421 1 310 . 1 1 35 35 ASP HA H 1 4.15 0.02 . 1 . . . . A 35 ASP HA . 30421 1 311 . 1 1 35 35 ASP HB2 H 1 2.72 0.02 . 2 . . . . A 35 ASP HB2 . 30421 1 312 . 1 1 35 35 ASP HB3 H 1 2.72 0.02 . 2 . . . . A 35 ASP HB3 . 30421 1 313 . 1 1 35 35 ASP C C 13 178.2 0.2 . 1 . . . . A 35 ASP C . 30421 1 314 . 1 1 35 35 ASP CA C 13 57.7 0.2 . 1 . . . . A 35 ASP CA . 30421 1 315 . 1 1 35 35 ASP CB C 13 41.1 0.2 . 1 . . . . A 35 ASP CB . 30421 1 316 . 1 1 35 35 ASP N N 15 118.7 0.2 . 1 . . . . A 35 ASP N . 30421 1 317 . 1 1 36 36 ALA H H 1 7.41 0.02 . 1 . . . . A 36 ALA H . 30421 1 318 . 1 1 36 36 ALA HA H 1 3.89 0.02 . 1 . . . . A 36 ALA HA . 30421 1 319 . 1 1 36 36 ALA HB1 H 1 0.90 0.02 . 1 . . . . A 36 ALA HB1 . 30421 1 320 . 1 1 36 36 ALA HB2 H 1 0.90 0.02 . 1 . . . . A 36 ALA HB2 . 30421 1 321 . 1 1 36 36 ALA HB3 H 1 0.90 0.02 . 1 . . . . A 36 ALA HB3 . 30421 1 322 . 1 1 36 36 ALA C C 13 180.4 0.2 . 1 . . . . A 36 ALA C . 30421 1 323 . 1 1 36 36 ALA CA C 13 55.1 0.2 . 1 . . . . A 36 ALA CA . 30421 1 324 . 1 1 36 36 ALA CB C 13 18.7 0.2 . 1 . . . . A 36 ALA CB . 30421 1 325 . 1 1 36 36 ALA N N 15 118.8 0.2 . 1 . . . . A 36 ALA N . 30421 1 326 . 1 1 37 37 GLN H H 1 7.81 0.02 . 1 . . . . A 37 GLN H . 30421 1 327 . 1 1 37 37 GLN HA H 1 3.99 0.02 . 1 . . . . A 37 GLN HA . 30421 1 328 . 1 1 37 37 GLN HB2 H 1 2.25 0.02 . 2 . . . . A 37 GLN HB2 . 30421 1 329 . 1 1 37 37 GLN HB3 H 1 2.25 0.02 . 2 . . . . A 37 GLN HB3 . 30421 1 330 . 1 1 37 37 GLN HG2 H 1 2.54 0.02 . 2 . . . . A 37 GLN HG2 . 30421 1 331 . 1 1 37 37 GLN HG3 H 1 2.38 0.02 . 2 . . . . A 37 GLN HG3 . 30421 1 332 . 1 1 37 37 GLN HE21 H 1 7.40 0.02 . 2 . . . . A 37 GLN HE21 . 30421 1 333 . 1 1 37 37 GLN HE22 H 1 6.67 0.02 . 2 . . . . A 37 GLN HE22 . 30421 1 334 . 1 1 37 37 GLN C C 13 179.7 0.2 . 1 . . . . A 37 GLN C . 30421 1 335 . 1 1 37 37 GLN CA C 13 58.3 0.2 . 1 . . . . A 37 GLN CA . 30421 1 336 . 1 1 37 37 GLN CB C 13 28.3 0.2 . 1 . . . . A 37 GLN CB . 30421 1 337 . 1 1 37 37 GLN CG C 13 33.7 0.2 . 1 . . . . A 37 GLN CG . 30421 1 338 . 1 1 37 37 GLN N N 15 118.3 0.2 . 1 . . . . A 37 GLN N . 30421 1 339 . 1 1 37 37 GLN NE2 N 15 109.9 0.2 . 1 . . . . A 37 GLN NE2 . 30421 1 340 . 1 1 38 38 LEU H H 1 8.18 0.02 . 1 . . . . A 38 LEU H . 30421 1 341 . 1 1 38 38 LEU HA H 1 4.02 0.02 . 1 . . . . A 38 LEU HA . 30421 1 342 . 1 1 38 38 LEU HB2 H 1 2.00 0.02 . 2 . . . . A 38 LEU HB2 . 30421 1 343 . 1 1 38 38 LEU HB3 H 1 2.00 0.02 . 2 . . . . A 38 LEU HB3 . 30421 1 344 . 1 1 38 38 LEU HD11 H 1 0.83 0.02 . 2 . . . . A 38 LEU HD11 . 30421 1 345 . 1 1 38 38 LEU HD12 H 1 0.83 0.02 . 2 . . . . A 38 LEU HD12 . 30421 1 346 . 1 1 38 38 LEU HD13 H 1 0.83 0.02 . 2 . . . . A 38 LEU HD13 . 30421 1 347 . 1 1 38 38 LEU HD21 H 1 0.83 0.02 . 2 . . . . A 38 LEU HD21 . 30421 1 348 . 1 1 38 38 LEU HD22 H 1 0.83 0.02 . 2 . . . . A 38 LEU HD22 . 30421 1 349 . 1 1 38 38 LEU HD23 H 1 0.83 0.02 . 2 . . . . A 38 LEU HD23 . 30421 1 350 . 1 1 38 38 LEU C C 13 177.8 0.2 . 1 . . . . A 38 LEU C . 30421 1 351 . 1 1 38 38 LEU CA C 13 57.3 0.2 . 1 . . . . A 38 LEU CA . 30421 1 352 . 1 1 38 38 LEU CB C 13 41.5 0.2 . 1 . . . . A 38 LEU CB . 30421 1 353 . 1 1 38 38 LEU CD1 C 13 22.4 0.2 . 2 . . . . A 38 LEU CD1 . 30421 1 354 . 1 1 38 38 LEU CD2 C 13 22.4 0.2 . 2 . . . . A 38 LEU CD2 . 30421 1 355 . 1 1 38 38 LEU N N 15 119.7 0.2 . 1 . . . . A 38 LEU N . 30421 1 356 . 1 1 39 39 ARG H H 1 7.25 0.02 . 1 . . . . A 39 ARG H . 30421 1 357 . 1 1 39 39 ARG HA H 1 2.33 0.02 . 1 . . . . A 39 ARG HA . 30421 1 358 . 1 1 39 39 ARG HB2 H 1 1.49 0.02 . 2 . . . . A 39 ARG HB2 . 30421 1 359 . 1 1 39 39 ARG HB3 H 1 1.39 0.02 . 2 . . . . A 39 ARG HB3 . 30421 1 360 . 1 1 39 39 ARG HG2 H 1 1.56 0.02 . 2 . . . . A 39 ARG HG2 . 30421 1 361 . 1 1 39 39 ARG HG3 H 1 1.11 0.02 . 2 . . . . A 39 ARG HG3 . 30421 1 362 . 1 1 39 39 ARG HD2 H 1 3.08 0.02 . 2 . . . . A 39 ARG HD2 . 30421 1 363 . 1 1 39 39 ARG HD3 H 1 2.97 0.02 . 2 . . . . A 39 ARG HD3 . 30421 1 364 . 1 1 39 39 ARG C C 13 177.6 0.2 . 1 . . . . A 39 ARG C . 30421 1 365 . 1 1 39 39 ARG CA C 13 57.8 0.2 . 1 . . . . A 39 ARG CA . 30421 1 366 . 1 1 39 39 ARG CB C 13 29.7 0.2 . 1 . . . . A 39 ARG CB . 30421 1 367 . 1 1 39 39 ARG CG C 13 28.2 0.2 . 1 . . . . A 39 ARG CG . 30421 1 368 . 1 1 39 39 ARG CD C 13 43.6 0.2 . 1 . . . . A 39 ARG CD . 30421 1 369 . 1 1 39 39 ARG N N 15 114.8 0.2 . 1 . . . . A 39 ARG N . 30421 1 370 . 1 1 40 40 GLY H H 1 7.20 0.02 . 1 . . . . A 40 GLY H . 30421 1 371 . 1 1 40 40 GLY HA2 H 1 4.25 0.02 . 2 . . . . A 40 GLY HA2 . 30421 1 372 . 1 1 40 40 GLY HA3 H 1 3.64 0.02 . 2 . . . . A 40 GLY HA3 . 30421 1 373 . 1 1 40 40 GLY C C 13 173.8 0.2 . 1 . . . . A 40 GLY C . 30421 1 374 . 1 1 40 40 GLY CA C 13 44.4 0.2 . 1 . . . . A 40 GLY CA . 30421 1 375 . 1 1 40 40 GLY N N 15 104.0 0.2 . 1 . . . . A 40 GLY N . 30421 1 376 . 1 1 41 41 ALA H H 1 7.74 0.02 . 1 . . . . A 41 ALA H . 30421 1 377 . 1 1 41 41 ALA HA H 1 4.42 0.02 . 1 . . . . A 41 ALA HA . 30421 1 378 . 1 1 41 41 ALA HB1 H 1 1.57 0.02 . 1 . . . . A 41 ALA HB1 . 30421 1 379 . 1 1 41 41 ALA HB2 H 1 1.57 0.02 . 1 . . . . A 41 ALA HB2 . 30421 1 380 . 1 1 41 41 ALA HB3 H 1 1.57 0.02 . 1 . . . . A 41 ALA HB3 . 30421 1 381 . 1 1 41 41 ALA C C 13 178.8 0.2 . 1 . . . . A 41 ALA C . 30421 1 382 . 1 1 41 41 ALA CA C 13 51.7 0.2 . 1 . . . . A 41 ALA CA . 30421 1 383 . 1 1 41 41 ALA CB C 13 20.1 0.2 . 1 . . . . A 41 ALA CB . 30421 1 384 . 1 1 41 41 ALA N N 15 124.4 0.2 . 1 . . . . A 41 ALA N . 30421 1 385 . 1 1 42 42 LEU H H 1 8.74 0.02 . 1 . . . . A 42 LEU H . 30421 1 386 . 1 1 42 42 LEU HG H 1 1.58 0.2 . 1 . . . . A 42 LEU HG . 30421 1 387 . 1 1 42 42 LEU HD11 H 1 0.77 0.02 . 2 . . . . A 42 LEU HD11 . 30421 1 388 . 1 1 42 42 LEU HD12 H 1 0.77 0.02 . 2 . . . . A 42 LEU HD12 . 30421 1 389 . 1 1 42 42 LEU HD13 H 1 0.77 0.02 . 2 . . . . A 42 LEU HD13 . 30421 1 390 . 1 1 42 42 LEU HD21 H 1 0.77 0.02 . 2 . . . . A 42 LEU HD21 . 30421 1 391 . 1 1 42 42 LEU HD22 H 1 0.77 0.02 . 2 . . . . A 42 LEU HD22 . 30421 1 392 . 1 1 42 42 LEU HD23 H 1 0.77 0.02 . 2 . . . . A 42 LEU HD23 . 30421 1 393 . 1 1 42 42 LEU C C 13 178.1 0.2 . 1 . . . . A 42 LEU C . 30421 1 394 . 1 1 42 42 LEU CA C 13 57.9 0.2 . 1 . . . . A 42 LEU CA . 30421 1 395 . 1 1 42 42 LEU CB C 13 42.6 0.2 . 1 . . . . A 42 LEU CB . 30421 1 396 . 1 1 42 42 LEU CD1 C 13 24.3 0.02 . 2 . . . . A 42 LEU CD1 . 30421 1 397 . 1 1 42 42 LEU CD2 C 13 24.3 0.02 . 2 . . . . A 42 LEU CD2 . 30421 1 398 . 1 1 42 42 LEU N N 15 124.9 0.2 . 1 . . . . A 42 LEU N . 30421 1 399 . 1 1 43 43 GLY H H 1 8.96 0.02 . 1 . . . . A 43 GLY H . 30421 1 400 . 1 1 43 43 GLY HA2 H 1 4.21 0.02 . 2 . . . . A 43 GLY HA2 . 30421 1 401 . 1 1 43 43 GLY HA3 H 1 3.69 0.02 . 2 . . . . A 43 GLY HA3 . 30421 1 402 . 1 1 43 43 GLY C C 13 175.2 0.2 . 1 . . . . A 43 GLY C . 30421 1 403 . 1 1 43 43 GLY CA C 13 45.1 0.2 . 1 . . . . A 43 GLY CA . 30421 1 404 . 1 1 43 43 GLY N N 15 110.4 0.2 . 1 . . . . A 43 GLY N . 30421 1 405 . 1 1 44 44 TYR H H 1 7.89 0.02 . 1 . . . . A 44 TYR H . 30421 1 406 . 1 1 44 44 TYR HA H 1 3.78 0.02 . 1 . . . . A 44 TYR HA . 30421 1 407 . 1 1 44 44 TYR HB2 H 1 3.42 0.02 . 2 . . . . A 44 TYR HB2 . 30421 1 408 . 1 1 44 44 TYR HB3 H 1 2.93 0.02 . 2 . . . . A 44 TYR HB3 . 30421 1 409 . 1 1 44 44 TYR HD1 H 1 6.88 0.02 . 3 . . . . A 44 TYR HD1 . 30421 1 410 . 1 1 44 44 TYR HD2 H 1 6.88 0.02 . 3 . . . . A 44 TYR HD2 . 30421 1 411 . 1 1 44 44 TYR HE1 H 1 6.77 0.02 . 3 . . . . A 44 TYR HE1 . 30421 1 412 . 1 1 44 44 TYR HE2 H 1 6.77 0.02 . 3 . . . . A 44 TYR HE2 . 30421 1 413 . 1 1 44 44 TYR C C 13 177.1 0.2 . 1 . . . . A 44 TYR C . 30421 1 414 . 1 1 44 44 TYR CA C 13 62.8 0.2 . 1 . . . . A 44 TYR CA . 30421 1 415 . 1 1 44 44 TYR CB C 13 38.7 0.2 . 1 . . . . A 44 TYR CB . 30421 1 416 . 1 1 44 44 TYR CD1 C 13 134.0 0.2 . 3 . . . . A 44 TYR CD1 . 30421 1 417 . 1 1 44 44 TYR CD2 C 13 134.0 0.2 . 3 . . . . A 44 TYR CD2 . 30421 1 418 . 1 1 44 44 TYR CE1 C 13 118.7 0.2 . 3 . . . . A 44 TYR CE1 . 30421 1 419 . 1 1 44 44 TYR CE2 C 13 118.7 0.2 . 3 . . . . A 44 TYR CE2 . 30421 1 420 . 1 1 44 44 TYR N N 15 121.7 0.2 . 1 . . . . A 44 TYR N . 30421 1 421 . 1 1 45 45 ASP H H 1 8.72 0.02 . 1 . . . . A 45 ASP H . 30421 1 422 . 1 1 45 45 ASP HA H 1 4.25 0.02 . 1 . . . . A 45 ASP HA . 30421 1 423 . 1 1 45 45 ASP HB2 H 1 2.82 0.02 . 2 . . . . A 45 ASP HB2 . 30421 1 424 . 1 1 45 45 ASP HB3 H 1 2.78 0.02 . 2 . . . . A 45 ASP HB3 . 30421 1 425 . 1 1 45 45 ASP C C 13 177.0 0.2 . 1 . . . . A 45 ASP C . 30421 1 426 . 1 1 45 45 ASP CA C 13 56.0 0.2 . 1 . . . . A 45 ASP CA . 30421 1 427 . 1 1 45 45 ASP CB C 13 39.7 0.2 . 1 . . . . A 45 ASP CB . 30421 1 428 . 1 1 45 45 ASP N N 15 113.6 0.2 . 1 . . . . A 45 ASP N . 30421 1 429 . 1 1 46 46 LYS H H 1 7.48 0.02 . 1 . . . . A 46 LYS H . 30421 1 430 . 1 1 46 46 LYS HA H 1 4.31 0.02 . 1 . . . . A 46 LYS HA . 30421 1 431 . 1 1 46 46 LYS HB2 H 1 2.02 0.02 . 2 . . . . A 46 LYS HB2 . 30421 1 432 . 1 1 46 46 LYS HB3 H 1 1.79 0.02 . 2 . . . . A 46 LYS HB3 . 30421 1 433 . 1 1 46 46 LYS HG2 H 1 1.67 0.02 . 2 . . . . A 46 LYS HG2 . 30421 1 434 . 1 1 46 46 LYS HG3 H 1 1.63 0.02 . 2 . . . . A 46 LYS HG3 . 30421 1 435 . 1 1 46 46 LYS HD2 H 1 1.47 0.02 . 2 . . . . A 46 LYS HD2 . 30421 1 436 . 1 1 46 46 LYS HD3 H 1 1.41 0.02 . 2 . . . . A 46 LYS HD3 . 30421 1 437 . 1 1 46 46 LYS HE2 H 1 3.01 0.02 . 2 . . . . A 46 LYS HE2 . 30421 1 438 . 1 1 46 46 LYS HE3 H 1 3.01 0.02 . 2 . . . . A 46 LYS HE3 . 30421 1 439 . 1 1 46 46 LYS C C 13 176.2 0.2 . 1 . . . . A 46 LYS C . 30421 1 440 . 1 1 46 46 LYS CA C 13 55.2 0.2 . 1 . . . . A 46 LYS CA . 30421 1 441 . 1 1 46 46 LYS CB C 13 33.1 0.2 . 1 . . . . A 46 LYS CB . 30421 1 442 . 1 1 46 46 LYS CG C 13 28.6 0.2 . 1 . . . . A 46 LYS CG . 30421 1 443 . 1 1 46 46 LYS CD C 13 24.8 0.2 . 1 . . . . A 46 LYS CD . 30421 1 444 . 1 1 46 46 LYS CE C 13 42.2 0.2 . 1 . . . . A 46 LYS CE . 30421 1 445 . 1 1 46 46 LYS N N 15 118.0 0.2 . 1 . . . . A 46 LYS N . 30421 1 446 . 1 1 47 47 ALA H H 1 7.19 0.02 . 1 . . . . A 47 ALA H . 30421 1 447 . 1 1 47 47 ALA HA H 1 4.32 0.02 . 1 . . . . A 47 ALA HA . 30421 1 448 . 1 1 47 47 ALA HB1 H 1 1.14 0.02 . 1 . . . . A 47 ALA HB1 . 30421 1 449 . 1 1 47 47 ALA HB2 H 1 1.14 0.02 . 1 . . . . A 47 ALA HB2 . 30421 1 450 . 1 1 47 47 ALA HB3 H 1 1.14 0.02 . 1 . . . . A 47 ALA HB3 . 30421 1 451 . 1 1 47 47 ALA C C 13 176.8 0.2 . 1 . . . . A 47 ALA C . 30421 1 452 . 1 1 47 47 ALA CA C 13 51.6 0.2 . 1 . . . . A 47 ALA CA . 30421 1 453 . 1 1 47 47 ALA CB C 13 18.7 0.2 . 1 . . . . A 47 ALA CB . 30421 1 454 . 1 1 47 47 ALA N N 15 120.4 0.2 . 1 . . . . A 47 ALA N . 30421 1 455 . 1 1 48 48 ASP H H 1 7.04 0.02 . 1 . . . . A 48 ASP H . 30421 1 456 . 1 1 48 48 ASP HB2 H 1 2.84 0.02 . 2 . . . . A 48 ASP HB2 . 30421 1 457 . 1 1 48 48 ASP HB3 H 1 2.33 0.02 . 2 . . . . A 48 ASP HB3 . 30421 1 458 . 1 1 48 48 ASP CA C 13 54.3 0.2 . 1 . . . . A 48 ASP CA . 30421 1 459 . 1 1 48 48 ASP CB C 13 40.5 0.2 . 1 . . . . A 48 ASP CB . 30421 1 460 . 1 1 48 48 ASP N N 15 119.2 0.2 . 1 . . . . A 48 ASP N . 30421 1 461 . 1 1 49 49 LYS HA H 1 3.71 0.02 . 1 . . . . A 49 LYS HA . 30421 1 462 . 1 1 49 49 LYS HB2 H 1 1.91 0.02 . 2 . . . . A 49 LYS HB2 . 30421 1 463 . 1 1 49 49 LYS HB3 H 1 1.80 0.02 . 2 . . . . A 49 LYS HB3 . 30421 1 464 . 1 1 49 49 LYS HG2 H 1 1.40 0.02 . 2 . . . . A 49 LYS HG2 . 30421 1 465 . 1 1 49 49 LYS HG3 H 1 1.29 0.02 . 2 . . . . A 49 LYS HG3 . 30421 1 466 . 1 1 49 49 LYS HD2 H 1 1.50 0.02 . 2 . . . . A 49 LYS HD2 . 30421 1 467 . 1 1 49 49 LYS HD3 H 1 1.41 0.02 . 2 . . . . A 49 LYS HD3 . 30421 1 468 . 1 1 49 49 LYS HE2 H 1 2.85 0.02 . 2 . . . . A 49 LYS HE2 . 30421 1 469 . 1 1 49 49 LYS HE3 H 1 2.71 0.02 . 2 . . . . A 49 LYS HE3 . 30421 1 470 . 1 1 49 49 LYS C C 13 177.7 0.2 . 1 . . . . A 49 LYS C . 30421 1 471 . 1 1 49 49 LYS CA C 13 60.9 0.2 . 1 . . . . A 49 LYS CA . 30421 1 472 . 1 1 49 49 LYS CB C 13 32.5 0.2 . 1 . . . . A 49 LYS CB . 30421 1 473 . 1 1 49 49 LYS CG C 13 25.3 0.2 . 1 . . . . A 49 LYS CG . 30421 1 474 . 1 1 49 49 LYS CD C 13 28.0 0.2 . 1 . . . . A 49 LYS CD . 30421 1 475 . 1 1 50 50 THR H H 1 7.97 0.02 . 1 . . . . A 50 THR H . 30421 1 476 . 1 1 50 50 THR HA H 1 4.07 0.02 . 1 . . . . A 50 THR HA . 30421 1 477 . 1 1 50 50 THR HB H 1 4.26 0.02 . 1 . . . . A 50 THR HB . 30421 1 478 . 1 1 50 50 THR HG21 H 1 1.21 0.02 . 1 . . . . A 50 THR HG21 . 30421 1 479 . 1 1 50 50 THR HG22 H 1 1.21 0.02 . 1 . . . . A 50 THR HG22 . 30421 1 480 . 1 1 50 50 THR HG23 H 1 1.21 0.02 . 1 . . . . A 50 THR HG23 . 30421 1 481 . 1 1 50 50 THR C C 13 177.0 0.2 . 1 . . . . A 50 THR C . 30421 1 482 . 1 1 50 50 THR CA C 13 66.0 0.2 . 1 . . . . A 50 THR CA . 30421 1 483 . 1 1 50 50 THR CB C 13 68.1 0.2 . 1 . . . . A 50 THR CB . 30421 1 484 . 1 1 50 50 THR CG2 C 13 21.8 0.2 . 1 . . . . A 50 THR CG2 . 30421 1 485 . 1 1 50 50 THR N N 15 116.1 0.02 . 1 . . . . A 50 THR N . 30421 1 486 . 1 1 51 51 LEU H H 1 8.15 0.02 . 1 . . . . A 51 LEU H . 30421 1 487 . 1 1 51 51 LEU C C 13 177.8 0.2 . 1 . . . . A 51 LEU C . 30421 1 488 . 1 1 51 51 LEU CA C 13 58.8 0.2 . 1 . . . . A 51 LEU CA . 30421 1 489 . 1 1 51 51 LEU CB C 13 42.6 0.2 . 1 . . . . A 51 LEU CB . 30421 1 490 . 1 1 51 51 LEU N N 15 125.1 0.2 . 1 . . . . A 51 LEU N . 30421 1 491 . 1 1 52 52 LEU H H 1 7.55 0.02 . 1 . . . . A 52 LEU H . 30421 1 492 . 1 1 52 52 LEU HG H 1 0.97 0.02 . 1 . . . . A 52 LEU HG . 30421 1 493 . 1 1 52 52 LEU C C 13 176.1 0.2 . 1 . . . . A 52 LEU C . 30421 1 494 . 1 1 52 52 LEU CA C 13 59.8 0.2 . 1 . . . . A 52 LEU CA . 30421 1 495 . 1 1 52 52 LEU CB C 13 43.5 0.2 . 1 . . . . A 52 LEU CB . 30421 1 496 . 1 1 52 52 LEU CG C 13 26.4 0.2 . 1 . . . . A 52 LEU CG . 30421 1 497 . 1 1 52 52 LEU N N 15 116.8 0.2 . 1 . . . . A 52 LEU N . 30421 1 498 . 1 1 53 53 ASP H H 1 7.88 0.02 . 1 . . . . A 53 ASP H . 30421 1 499 . 1 1 53 53 ASP HB2 H 1 2.75 0.02 . 2 . . . . A 53 ASP HB2 . 30421 1 500 . 1 1 53 53 ASP HB3 H 1 2.54 0.02 . 2 . . . . A 53 ASP HB3 . 30421 1 501 . 1 1 53 53 ASP C C 13 178.3 0.2 . 1 . . . . A 53 ASP C . 30421 1 502 . 1 1 53 53 ASP CA C 13 58.7 0.2 . 1 . . . . A 53 ASP CA . 30421 1 503 . 1 1 53 53 ASP CB C 13 40.8 0.2 . 1 . . . . A 53 ASP CB . 30421 1 504 . 1 1 53 53 ASP N N 15 117.0 0.2 . 1 . . . . A 53 ASP N . 30421 1 505 . 1 1 54 54 THR H H 1 8.11 0.02 . 1 . . . . A 54 THR H . 30421 1 506 . 1 1 54 54 THR HA H 1 3.78 0.02 . 1 . . . . A 54 THR HA . 30421 1 507 . 1 1 54 54 THR HB H 1 4.30 0.02 . 1 . . . . A 54 THR HB . 30421 1 508 . 1 1 54 54 THR HG21 H 1 1.26 0.02 . 1 . . . . A 54 THR HG21 . 30421 1 509 . 1 1 54 54 THR HG22 H 1 1.26 0.02 . 1 . . . . A 54 THR HG22 . 30421 1 510 . 1 1 54 54 THR HG23 H 1 1.26 0.02 . 1 . . . . A 54 THR HG23 . 30421 1 511 . 1 1 54 54 THR C C 13 176.8 0.2 . 1 . . . . A 54 THR C . 30421 1 512 . 1 1 54 54 THR CA C 13 66.6 0.2 . 1 . . . . A 54 THR CA . 30421 1 513 . 1 1 54 54 THR CB C 13 69.0 0.2 . 1 . . . . A 54 THR CB . 30421 1 514 . 1 1 54 54 THR CG2 C 13 21.2 0.2 . 1 . . . . A 54 THR CG2 . 30421 1 515 . 1 1 54 54 THR N N 15 114.4 0.2 . 1 . . . . A 54 THR N . 30421 1 516 . 1 1 55 55 ILE H H 1 8.04 0.02 . 1 . . . . A 55 ILE H . 30421 1 517 . 1 1 55 55 ILE HA H 1 3.10 0.02 . 1 . . . . A 55 ILE HA . 30421 1 518 . 1 1 55 55 ILE HB H 1 1.52 0.02 . 1 . . . . A 55 ILE HB . 30421 1 519 . 1 1 55 55 ILE HG12 H 1 1.71 0.02 . 2 . . . . A 55 ILE HG12 . 30421 1 520 . 1 1 55 55 ILE HG13 H 1 0.96 0.02 . 2 . . . . A 55 ILE HG13 . 30421 1 521 . 1 1 55 55 ILE HG21 H 1 0.67 0.02 . 1 . . . . A 55 ILE HG21 . 30421 1 522 . 1 1 55 55 ILE HG22 H 1 0.67 0.02 . 1 . . . . A 55 ILE HG22 . 30421 1 523 . 1 1 55 55 ILE HG23 H 1 0.67 0.02 . 1 . . . . A 55 ILE HG23 . 30421 1 524 . 1 1 55 55 ILE HD11 H 1 0.71 0.02 . 1 . . . . A 55 ILE HD11 . 30421 1 525 . 1 1 55 55 ILE HD12 H 1 0.71 0.02 . 1 . . . . A 55 ILE HD12 . 30421 1 526 . 1 1 55 55 ILE HD13 H 1 0.71 0.02 . 1 . . . . A 55 ILE HD13 . 30421 1 527 . 1 1 55 55 ILE C C 13 176.2 0.2 . 1 . . . . A 55 ILE C . 30421 1 528 . 1 1 55 55 ILE CA C 13 65.0 0.2 . 1 . . . . A 55 ILE CA . 30421 1 529 . 1 1 55 55 ILE CB C 13 38.4 0.2 . 1 . . . . A 55 ILE CB . 30421 1 530 . 1 1 55 55 ILE CG1 C 13 28.3 0.2 . 1 . . . . A 55 ILE CG1 . 30421 1 531 . 1 1 55 55 ILE CG2 C 13 19.2 0.2 . 1 . . . . A 55 ILE CG2 . 30421 1 532 . 1 1 55 55 ILE CD1 C 13 13.4 0.2 . 1 . . . . A 55 ILE CD1 . 30421 1 533 . 1 1 55 55 ILE N N 15 117.8 0.2 . 1 . . . . A 55 ILE N . 30421 1 534 . 1 1 56 56 LEU H H 1 8.37 0.02 . 1 . . . . A 56 LEU H . 30421 1 535 . 1 1 56 56 LEU HA H 1 3.66 0.02 . 1 . . . . A 56 LEU HA . 30421 1 536 . 1 1 56 56 LEU HG H 1 0.69 0.02 . 1 . . . . A 56 LEU HG . 30421 1 537 . 1 1 56 56 LEU C C 13 177.0 0.2 . 1 . . . . A 56 LEU C . 30421 1 538 . 1 1 56 56 LEU CA C 13 58.8 0.2 . 1 . . . . A 56 LEU CA . 30421 1 539 . 1 1 56 56 LEU CG C 13 26.4 0.2 . 1 . . . . A 56 LEU CG . 30421 1 540 . 1 1 56 56 LEU CD1 C 13 24.7 0.2 . 1 . . . . A 56 LEU CD1 . 30421 1 541 . 1 1 56 56 LEU CD2 C 13 24.7 0.2 . 1 . . . . A 56 LEU CD2 . 30421 1 542 . 1 1 56 56 LEU N N 15 118.6 0.2 . 1 . . . . A 56 LEU N . 30421 1 543 . 1 1 57 57 HIS H H 1 7.76 0.02 . 1 . . . . A 57 HIS H . 30421 1 544 . 1 1 57 57 HIS HA H 1 4.11 0.02 . 1 . . . . A 57 HIS HA . 30421 1 545 . 1 1 57 57 HIS HB2 H 1 3.21 0.02 . 2 . . . . A 57 HIS HB2 . 30421 1 546 . 1 1 57 57 HIS HB3 H 1 3.01 0.02 . 2 . . . . A 57 HIS HB3 . 30421 1 547 . 1 1 57 57 HIS HD2 H 1 6.95 0.02 . 1 . . . . A 57 HIS HD2 . 30421 1 548 . 1 1 57 57 HIS C C 13 178.1 0.2 . 1 . . . . A 57 HIS C . 30421 1 549 . 1 1 57 57 HIS CA C 13 57.7 0.2 . 1 . . . . A 57 HIS CA . 30421 1 550 . 1 1 57 57 HIS CB C 13 28.6 0.2 . 1 . . . . A 57 HIS CB . 30421 1 551 . 1 1 57 57 HIS CD2 C 13 117.9 0.2 . 1 . . . . A 57 HIS CD2 . 30421 1 552 . 1 1 57 57 HIS N N 15 111.3 0.2 . 1 . . . . A 57 HIS N . 30421 1 553 . 1 1 58 58 GLY H H 1 7.49 0.02 . 1 . . . . A 58 GLY H . 30421 1 554 . 1 1 58 58 GLY HA2 H 1 3.71 0.02 . 2 . . . . A 58 GLY HA2 . 30421 1 555 . 1 1 58 58 GLY HA3 H 1 3.51 0.02 . 2 . . . . A 58 GLY HA3 . 30421 1 556 . 1 1 58 58 GLY C C 13 175.0 0.2 . 1 . . . . A 58 GLY C . 30421 1 557 . 1 1 58 58 GLY CA C 13 47.5 0.2 . 1 . . . . A 58 GLY CA . 30421 1 558 . 1 1 58 58 GLY N N 15 109.7 0.2 . 1 . . . . A 58 GLY N . 30421 1 559 . 1 1 59 59 VAL H H 1 8.00 0.02 . 1 . . . . A 59 VAL H . 30421 1 560 . 1 1 59 59 VAL HA H 1 3.40 0.02 . 1 . . . . A 59 VAL HA . 30421 1 561 . 1 1 59 59 VAL HB H 1 1.86 0.02 . 1 . . . . A 59 VAL HB . 30421 1 562 . 1 1 59 59 VAL HG11 H 1 0.83 0.02 . 2 . . . . A 59 VAL HG11 . 30421 1 563 . 1 1 59 59 VAL HG12 H 1 0.83 0.02 . 2 . . . . A 59 VAL HG12 . 30421 1 564 . 1 1 59 59 VAL HG13 H 1 0.83 0.02 . 2 . . . . A 59 VAL HG13 . 30421 1 565 . 1 1 59 59 VAL HG21 H 1 0.75 0.02 . 2 . . . . A 59 VAL HG21 . 30421 1 566 . 1 1 59 59 VAL HG22 H 1 0.75 0.02 . 2 . . . . A 59 VAL HG22 . 30421 1 567 . 1 1 59 59 VAL HG23 H 1 0.75 0.02 . 2 . . . . A 59 VAL HG23 . 30421 1 568 . 1 1 59 59 VAL C C 13 176.9 0.2 . 1 . . . . A 59 VAL C . 30421 1 569 . 1 1 59 59 VAL CA C 13 66.3 0.2 . 1 . . . . A 59 VAL CA . 30421 1 570 . 1 1 59 59 VAL CB C 13 30.5 0.2 . 1 . . . . A 59 VAL CB . 30421 1 571 . 1 1 59 59 VAL CG1 C 13 24.8 0.2 . 2 . . . . A 59 VAL CG1 . 30421 1 572 . 1 1 59 59 VAL CG2 C 13 23.5 0.2 . 2 . . . . A 59 VAL CG2 . 30421 1 573 . 1 1 59 59 VAL N N 15 120.8 0.2 . 1 . . . . A 59 VAL N . 30421 1 574 . 1 1 60 60 ILE H H 1 6.88 0.02 . 1 . . . . A 60 ILE H . 30421 1 575 . 1 1 60 60 ILE HA H 1 2.81 0.02 . 1 . . . . A 60 ILE HA . 30421 1 576 . 1 1 60 60 ILE HB H 1 1.29 0.02 . 1 . . . . A 60 ILE HB . 30421 1 577 . 1 1 60 60 ILE HG21 H 1 0.47 0.02 . 1 . . . . A 60 ILE HG21 . 30421 1 578 . 1 1 60 60 ILE HG22 H 1 0.47 0.02 . 1 . . . . A 60 ILE HG22 . 30421 1 579 . 1 1 60 60 ILE HG23 H 1 0.47 0.02 . 1 . . . . A 60 ILE HG23 . 30421 1 580 . 1 1 60 60 ILE HD11 H 1 -0.01 0.02 . 1 . . . . A 60 ILE HD11 . 30421 1 581 . 1 1 60 60 ILE HD12 H 1 -0.01 0.02 . 1 . . . . A 60 ILE HD12 . 30421 1 582 . 1 1 60 60 ILE HD13 H 1 -0.01 0.02 . 1 . . . . A 60 ILE HD13 . 30421 1 583 . 1 1 60 60 ILE C C 13 178.7 0.2 . 1 . . . . A 60 ILE C . 30421 1 584 . 1 1 60 60 ILE CA C 13 65.7 0.2 . 1 . . . . A 60 ILE CA . 30421 1 585 . 1 1 60 60 ILE CB C 13 37.6 0.2 . 1 . . . . A 60 ILE CB . 30421 1 586 . 1 1 60 60 ILE CG1 C 13 27.4 0.2 . 1 . . . . A 60 ILE CG1 . 30421 1 587 . 1 1 60 60 ILE CG2 C 13 15.6 0.2 . 1 . . . . A 60 ILE CG2 . 30421 1 588 . 1 1 60 60 ILE CD1 C 13 12.5 0.2 . 1 . . . . A 60 ILE CD1 . 30421 1 589 . 1 1 60 60 ILE N N 15 116.4 0.2 . 1 . . . . A 60 ILE N . 30421 1 590 . 1 1 61 61 ARG H H 1 7.93 0.02 . 1 . . . . A 61 ARG H . 30421 1 591 . 1 1 61 61 ARG HA H 1 4.16 0.02 . 1 . . . . A 61 ARG HA . 30421 1 592 . 1 1 61 61 ARG HB2 H 1 2.04 0.02 . 2 . . . . A 61 ARG HB2 . 30421 1 593 . 1 1 61 61 ARG HB3 H 1 2.04 0.02 . 2 . . . . A 61 ARG HB3 . 30421 1 594 . 1 1 61 61 ARG HG2 H 1 1.83 0.02 . 2 . . . . A 61 ARG HG2 . 30421 1 595 . 1 1 61 61 ARG HG3 H 1 1.63 0.02 . 2 . . . . A 61 ARG HG3 . 30421 1 596 . 1 1 61 61 ARG HD2 H 1 3.35 0.02 . 2 . . . . A 61 ARG HD2 . 30421 1 597 . 1 1 61 61 ARG HD3 H 1 3.35 0.02 . 2 . . . . A 61 ARG HD3 . 30421 1 598 . 1 1 61 61 ARG C C 13 179.2 0.2 . 1 . . . . A 61 ARG C . 30421 1 599 . 1 1 61 61 ARG CA C 13 59.6 0.2 . 1 . . . . A 61 ARG CA . 30421 1 600 . 1 1 61 61 ARG CB C 13 31.0 0.2 . 1 . . . . A 61 ARG CB . 30421 1 601 . 1 1 61 61 ARG CG C 13 28.1 0.2 . 1 . . . . A 61 ARG CG . 30421 1 602 . 1 1 61 61 ARG CD C 13 43.4 0.2 . 1 . . . . A 61 ARG CD . 30421 1 603 . 1 1 61 61 ARG N N 15 118.3 0.2 . 1 . . . . A 61 ARG N . 30421 1 604 . 1 1 62 62 GLU H H 1 8.18 0.02 . 1 . . . . A 62 GLU H . 30421 1 605 . 1 1 62 62 GLU HA H 1 4.77 0.02 . 1 . . . . A 62 GLU HA . 30421 1 606 . 1 1 62 62 GLU HB2 H 1 2.69 0.02 . 2 . . . . A 62 GLU HB2 . 30421 1 607 . 1 1 62 62 GLU HB3 H 1 2.04 0.02 . 2 . . . . A 62 GLU HB3 . 30421 1 608 . 1 1 62 62 GLU HG2 H 1 2.60 0.02 . 2 . . . . A 62 GLU HG2 . 30421 1 609 . 1 1 62 62 GLU HG3 H 1 2.45 0.02 . 2 . . . . A 62 GLU HG3 . 30421 1 610 . 1 1 62 62 GLU C C 13 177.1 0.2 . 1 . . . . A 62 GLU C . 30421 1 611 . 1 1 62 62 GLU CA C 13 57.0 0.2 . 1 . . . . A 62 GLU CA . 30421 1 612 . 1 1 62 62 GLU CB C 13 29.1 0.2 . 1 . . . . A 62 GLU CB . 30421 1 613 . 1 1 62 62 GLU CG C 13 36.9 0.2 . 1 . . . . A 62 GLU CG . 30421 1 614 . 1 1 62 62 GLU N N 15 115.5 0.2 . 1 . . . . A 62 GLU N . 30421 1 615 . 1 1 63 63 HIS H H 1 7.70 0.02 . 1 . . . . A 63 HIS H . 30421 1 616 . 1 1 63 63 HIS HA H 1 4.16 0.02 . 1 . . . . A 63 HIS HA . 30421 1 617 . 1 1 63 63 HIS HB2 H 1 3.71 0.02 . 2 . . . . A 63 HIS HB2 . 30421 1 618 . 1 1 63 63 HIS HB3 H 1 3.48 0.02 . 2 . . . . A 63 HIS HB3 . 30421 1 619 . 1 1 63 63 HIS HD2 H 1 6.51 0.02 . 1 . . . . A 63 HIS HD2 . 30421 1 620 . 1 1 63 63 HIS C C 13 175.8 0.2 . 1 . . . . A 63 HIS C . 30421 1 621 . 1 1 63 63 HIS CA C 13 61.9 0.2 . 1 . . . . A 63 HIS CA . 30421 1 622 . 1 1 63 63 HIS CB C 13 30.2 0.2 . 1 . . . . A 63 HIS CB . 30421 1 623 . 1 1 63 63 HIS CD2 C 13 123.7 0.2 . 1 . . . . A 63 HIS CD2 . 30421 1 624 . 1 1 63 63 HIS N N 15 120.9 0.2 . 1 . . . . A 63 HIS N . 30421 1 625 . 1 1 64 64 ALA H H 1 8.49 0.02 . 1 . . . . A 64 ALA H . 30421 1 626 . 1 1 64 64 ALA HA H 1 4.06 0.02 . 1 . . . . A 64 ALA HA . 30421 1 627 . 1 1 64 64 ALA HB1 H 1 1.42 0.02 . 1 . . . . A 64 ALA HB1 . 30421 1 628 . 1 1 64 64 ALA HB2 H 1 1.42 0.02 . 1 . . . . A 64 ALA HB2 . 30421 1 629 . 1 1 64 64 ALA HB3 H 1 1.42 0.02 . 1 . . . . A 64 ALA HB3 . 30421 1 630 . 1 1 64 64 ALA C C 13 180.9 0.2 . 1 . . . . A 64 ALA C . 30421 1 631 . 1 1 64 64 ALA CA C 13 55.6 0.2 . 1 . . . . A 64 ALA CA . 30421 1 632 . 1 1 64 64 ALA CB C 13 18.0 0.2 . 1 . . . . A 64 ALA CB . 30421 1 633 . 1 1 64 64 ALA N N 15 120.0 0.2 . 1 . . . . A 64 ALA N . 30421 1 634 . 1 1 65 65 THR H H 1 7.61 0.02 . 1 . . . . A 65 THR H . 30421 1 635 . 1 1 65 65 THR HA H 1 4.13 0.02 . 1 . . . . A 65 THR HA . 30421 1 636 . 1 1 65 65 THR HB H 1 4.33 0.02 . 1 . . . . A 65 THR HB . 30421 1 637 . 1 1 65 65 THR HG21 H 1 1.33 0.02 . 1 . . . . A 65 THR HG21 . 30421 1 638 . 1 1 65 65 THR HG22 H 1 1.33 0.02 . 1 . . . . A 65 THR HG22 . 30421 1 639 . 1 1 65 65 THR HG23 H 1 1.33 0.02 . 1 . . . . A 65 THR HG23 . 30421 1 640 . 1 1 65 65 THR C C 13 178.1 0.2 . 1 . . . . A 65 THR C . 30421 1 641 . 1 1 65 65 THR CA C 13 65.3 0.2 . 1 . . . . A 65 THR CA . 30421 1 642 . 1 1 65 65 THR CB C 13 68.6 0.2 . 1 . . . . A 65 THR CB . 30421 1 643 . 1 1 65 65 THR CG2 C 13 22.6 0.2 . 1 . . . . A 65 THR CG2 . 30421 1 644 . 1 1 65 65 THR N N 15 113.2 0.2 . 1 . . . . A 65 THR N . 30421 1 645 . 1 1 66 66 LEU H H 1 8.64 0.02 . 1 . . . . A 66 LEU H . 30421 1 646 . 1 1 66 66 LEU HA H 1 4.17 0.02 . 1 . . . . A 66 LEU HA . 30421 1 647 . 1 1 66 66 LEU HG H 1 1.25 0.02 . 1 . . . . A 66 LEU HG . 30421 1 648 . 1 1 66 66 LEU HD11 H 1 0.92 0.02 . 2 . . . . A 66 LEU HD11 . 30421 1 649 . 1 1 66 66 LEU HD12 H 1 0.92 0.02 . 2 . . . . A 66 LEU HD12 . 30421 1 650 . 1 1 66 66 LEU HD13 H 1 0.92 0.02 . 2 . . . . A 66 LEU HD13 . 30421 1 651 . 1 1 66 66 LEU HD21 H 1 0.92 0.02 . 2 . . . . A 66 LEU HD21 . 30421 1 652 . 1 1 66 66 LEU HD22 H 1 0.92 0.02 . 2 . . . . A 66 LEU HD22 . 30421 1 653 . 1 1 66 66 LEU HD23 H 1 0.92 0.02 . 2 . . . . A 66 LEU HD23 . 30421 1 654 . 1 1 66 66 LEU C C 13 178.9 0.2 . 1 . . . . A 66 LEU C . 30421 1 655 . 1 1 66 66 LEU CA C 13 57.8 0.2 . 1 . . . . A 66 LEU CA . 30421 1 656 . 1 1 66 66 LEU CB C 13 43.1 0.2 . 1 . . . . A 66 LEU CB . 30421 1 657 . 1 1 66 66 LEU CG C 13 29.0 0.2 . 1 . . . . A 66 LEU CG . 30421 1 658 . 1 1 66 66 LEU CD1 C 13 21.7 0.2 . 2 . . . . A 66 LEU CD1 . 30421 1 659 . 1 1 66 66 LEU CD2 C 13 21.7 0.2 . 2 . . . . A 66 LEU CD2 . 30421 1 660 . 1 1 66 66 LEU N N 15 124.0 0.2 . 1 . . . . A 66 LEU N . 30421 1 661 . 1 1 67 67 ALA H H 1 8.68 0.02 . 1 . . . . A 67 ALA H . 30421 1 662 . 1 1 67 67 ALA HA H 1 3.93 0.02 . 1 . . . . A 67 ALA HA . 30421 1 663 . 1 1 67 67 ALA HB1 H 1 1.44 0.02 . 1 . . . . A 67 ALA HB1 . 30421 1 664 . 1 1 67 67 ALA HB2 H 1 1.44 0.02 . 1 . . . . A 67 ALA HB2 . 30421 1 665 . 1 1 67 67 ALA HB3 H 1 1.44 0.02 . 1 . . . . A 67 ALA HB3 . 30421 1 666 . 1 1 67 67 ALA C C 13 178.7 0.2 . 1 . . . . A 67 ALA C . 30421 1 667 . 1 1 67 67 ALA CA C 13 55.7 0.2 . 1 . . . . A 67 ALA CA . 30421 1 668 . 1 1 67 67 ALA CB C 13 17.8 0.2 . 1 . . . . A 67 ALA CB . 30421 1 669 . 1 1 67 67 ALA N N 15 119.9 0.2 . 1 . . . . A 67 ALA N . 30421 1 670 . 1 1 68 68 GLU H H 1 7.59 0.02 . 1 . . . . A 68 GLU H . 30421 1 671 . 1 1 68 68 GLU HA H 1 4.11 0.02 . 1 . . . . A 68 GLU HA . 30421 1 672 . 1 1 68 68 GLU HB2 H 1 2.12 0.02 . 2 . . . . A 68 GLU HB2 . 30421 1 673 . 1 1 68 68 GLU HB3 H 1 2.12 0.02 . 2 . . . . A 68 GLU HB3 . 30421 1 674 . 1 1 68 68 GLU HG2 H 1 2.48 0.02 . 2 . . . . A 68 GLU HG2 . 30421 1 675 . 1 1 68 68 GLU HG3 H 1 2.31 0.02 . 2 . . . . A 68 GLU HG3 . 30421 1 676 . 1 1 68 68 GLU C C 13 178.3 0.2 . 1 . . . . A 68 GLU C . 30421 1 677 . 1 1 68 68 GLU CA C 13 58.9 0.2 . 1 . . . . A 68 GLU CA . 30421 1 678 . 1 1 68 68 GLU CB C 13 29.7 0.2 . 1 . . . . A 68 GLU CB . 30421 1 679 . 1 1 68 68 GLU CG C 13 36.4 0.2 . 1 . . . . A 68 GLU CG . 30421 1 680 . 1 1 68 68 GLU N N 15 117.8 0.2 . 1 . . . . A 68 GLU N . 30421 1 681 . 1 1 69 69 ALA H H 1 7.62 0.02 . 1 . . . . A 69 ALA H . 30421 1 682 . 1 1 69 69 ALA HA H 1 4.20 0.02 . 1 . . . . A 69 ALA HA . 30421 1 683 . 1 1 69 69 ALA HB1 H 1 1.50 0.02 . 1 . . . . A 69 ALA HB1 . 30421 1 684 . 1 1 69 69 ALA HB2 H 1 1.50 0.02 . 1 . . . . A 69 ALA HB2 . 30421 1 685 . 1 1 69 69 ALA HB3 H 1 1.50 0.02 . 1 . . . . A 69 ALA HB3 . 30421 1 686 . 1 1 69 69 ALA C C 13 178.7 0.2 . 1 . . . . A 69 ALA C . 30421 1 687 . 1 1 69 69 ALA CA C 13 54.2 0.2 . 1 . . . . A 69 ALA CA . 30421 1 688 . 1 1 69 69 ALA CB C 13 18.2 0.2 . 1 . . . . A 69 ALA CB . 30421 1 689 . 1 1 69 69 ALA N N 15 120.7 0.2 . 1 . . . . A 69 ALA N . 30421 1 690 . 1 1 70 70 ILE H H 1 7.84 0.02 . 1 . . . . A 70 ILE H . 30421 1 691 . 1 1 70 70 ILE HA H 1 3.82 0.02 . 1 . . . . A 70 ILE HA . 30421 1 692 . 1 1 70 70 ILE HB H 1 1.73 0.02 . 1 . . . . A 70 ILE HB . 30421 1 693 . 1 1 70 70 ILE HG21 H 1 0.89 0.02 . 1 . . . . A 70 ILE HG21 . 30421 1 694 . 1 1 70 70 ILE HG22 H 1 0.89 0.02 . 1 . . . . A 70 ILE HG22 . 30421 1 695 . 1 1 70 70 ILE HG23 H 1 0.89 0.02 . 1 . . . . A 70 ILE HG23 . 30421 1 696 . 1 1 70 70 ILE HD11 H 1 0.72 0.02 . 1 . . . . A 70 ILE HD11 . 30421 1 697 . 1 1 70 70 ILE HD12 H 1 0.72 0.02 . 1 . . . . A 70 ILE HD12 . 30421 1 698 . 1 1 70 70 ILE HD13 H 1 0.72 0.02 . 1 . . . . A 70 ILE HD13 . 30421 1 699 . 1 1 70 70 ILE C C 13 177.2 0.2 . 1 . . . . A 70 ILE C . 30421 1 700 . 1 1 70 70 ILE CA C 13 64.1 0.2 . 1 . . . . A 70 ILE CA . 30421 1 701 . 1 1 70 70 ILE CB C 13 39.9 0.2 . 1 . . . . A 70 ILE CB . 30421 1 702 . 1 1 70 70 ILE CG1 C 13 30.7 0.2 . 1 . . . . A 70 ILE CG1 . 30421 1 703 . 1 1 70 70 ILE CG2 C 13 18.1 0.2 . 1 . . . . A 70 ILE CG2 . 30421 1 704 . 1 1 70 70 ILE CD1 C 13 14.8 0.2 . 1 . . . . A 70 ILE CD1 . 30421 1 705 . 1 1 70 70 ILE N N 15 115.7 0.2 . 1 . . . . A 70 ILE N . 30421 1 706 . 1 1 71 71 SER H H 1 8.01 0.02 . 1 . . . . A 71 SER H . 30421 1 707 . 1 1 71 71 SER HA H 1 4.00 0.02 . 1 . . . . A 71 SER HA . 30421 1 708 . 1 1 71 71 SER HB2 H 1 4.17 0.02 . 2 . . . . A 71 SER HB2 . 30421 1 709 . 1 1 71 71 SER HB3 H 1 41.7 0.02 . 2 . . . . A 71 SER HB3 . 30421 1 710 . 1 1 71 71 SER C C 13 177.8 0.2 . 1 . . . . A 71 SER C . 30421 1 711 . 1 1 71 71 SER CA C 13 61.9 0.2 . 1 . . . . A 71 SER CA . 30421 1 712 . 1 1 71 71 SER CB C 13 65.2 0.2 . 1 . . . . A 71 SER CB . 30421 1 713 . 1 1 71 71 SER N N 15 113.4 0.2 . 1 . . . . A 71 SER N . 30421 1 714 . 1 1 72 72 PRO HA H 1 4.54 0.02 . 1 . . . . A 72 PRO HA . 30421 1 715 . 1 1 72 72 PRO HB2 H 1 2.42 0.02 . 2 . . . . A 72 PRO HB2 . 30421 1 716 . 1 1 72 72 PRO HB3 H 1 1.91 0.02 . 2 . . . . A 72 PRO HB3 . 30421 1 717 . 1 1 72 72 PRO HG2 H 1 2.04 0.02 . 2 . . . . A 72 PRO HG2 . 30421 1 718 . 1 1 72 72 PRO HG3 H 1 1.94 0.02 . 2 . . . . A 72 PRO HG3 . 30421 1 719 . 1 1 72 72 PRO HD2 H 1 3.86 0.02 . 2 . . . . A 72 PRO HD2 . 30421 1 720 . 1 1 72 72 PRO HD3 H 1 3.43 0.02 . 2 . . . . A 72 PRO HD3 . 30421 1 721 . 1 1 72 72 PRO CA C 13 65.4 0.2 . 1 . . . . A 72 PRO CA . 30421 1 722 . 1 1 72 72 PRO CB C 13 31.1 0.2 . 1 . . . . A 72 PRO CB . 30421 1 723 . 1 1 72 72 PRO CG C 13 28.1 0.2 . 1 . . . . A 72 PRO CG . 30421 1 724 . 1 1 72 72 PRO CD C 13 51.1 0.2 . 1 . . . . A 72 PRO CD . 30421 1 725 . 1 1 73 73 SER H H 1 8.13 0.02 . 1 . . . . A 73 SER H . 30421 1 726 . 1 1 73 73 SER HA H 1 4.56 0.02 . 1 . . . . A 73 SER HA . 30421 1 727 . 1 1 73 73 SER HB2 H 1 4.11 0.02 . 2 . . . . A 73 SER HB2 . 30421 1 728 . 1 1 73 73 SER HB3 H 1 3.82 0.02 . 2 . . . . A 73 SER HB3 . 30421 1 729 . 1 1 73 73 SER C C 13 172.8 0.2 . 1 . . . . A 73 SER C . 30421 1 730 . 1 1 73 73 SER CA C 13 59.6 0.2 . 1 . . . . A 73 SER CA . 30421 1 731 . 1 1 73 73 SER CB C 13 64.3 0.2 . 1 . . . . A 73 SER CB . 30421 1 732 . 1 1 73 73 SER N N 15 111.8 0.2 . 1 . . . . A 73 SER N . 30421 1 733 . 1 1 74 74 LEU H H 1 7.60 0.02 . 1 . . . . A 74 LEU H . 30421 1 734 . 1 1 74 74 LEU HA H 1 4.52 0.02 . 1 . . . . A 74 LEU HA . 30421 1 735 . 1 1 74 74 LEU HB2 H 1 2.23 0.02 . 2 . . . . A 74 LEU HB2 . 30421 1 736 . 1 1 74 74 LEU HB3 H 1 1.83 0.02 . 2 . . . . A 74 LEU HB3 . 30421 1 737 . 1 1 74 74 LEU HG H 1 1.00 0.02 . 1 . . . . A 74 LEU HG . 30421 1 738 . 1 1 74 74 LEU C C 13 176.6 0.2 . 1 . . . . A 74 LEU C . 30421 1 739 . 1 1 74 74 LEU CA C 13 53.8 0.2 . 1 . . . . A 74 LEU CA . 30421 1 740 . 1 1 74 74 LEU CB C 13 45.2 0.2 . 1 . . . . A 74 LEU CB . 30421 1 741 . 1 1 74 74 LEU CG C 13 26.0 0.2 . 1 . . . . A 74 LEU CG . 30421 1 742 . 1 1 74 74 LEU CD1 C 13 20.2 0.2 . 2 . . . . A 74 LEU CD1 . 30421 1 743 . 1 1 74 74 LEU N N 15 118.4 0.2 . 1 . . . . A 74 LEU N . 30421 1 744 . 1 1 75 75 ASP H H 1 7.95 0.02 . 1 . . . . A 75 ASP H . 30421 1 745 . 1 1 75 75 ASP HA H 1 4.63 0.02 . 1 . . . . A 75 ASP HA . 30421 1 746 . 1 1 75 75 ASP HB2 H 1 3.05 0.02 . 2 . . . . A 75 ASP HB2 . 30421 1 747 . 1 1 75 75 ASP HB3 H 1 2.74 0.02 . 2 . . . . A 75 ASP HB3 . 30421 1 748 . 1 1 75 75 ASP C C 13 174.6 0.2 . 1 . . . . A 75 ASP C . 30421 1 749 . 1 1 75 75 ASP CA C 13 53.2 0.2 . 1 . . . . A 75 ASP CA . 30421 1 750 . 1 1 75 75 ASP CB C 13 40.6 0.2 . 1 . . . . A 75 ASP CB . 30421 1 751 . 1 1 75 75 ASP N N 15 118.1 0.2 . 1 . . . . A 75 ASP N . 30421 1 752 . 1 1 76 76 ARG H H 1 7.53 0.02 . 1 . . . . A 76 ARG H . 30421 1 753 . 1 1 76 76 ARG CA C 13 54.3 0.2 . 1 . . . . A 76 ARG CA . 30421 1 754 . 1 1 76 76 ARG CB C 13 30.5 0.2 . 1 . . . . A 76 ARG CB . 30421 1 755 . 1 1 76 76 ARG N N 15 117.2 0.2 . 1 . . . . A 76 ARG N . 30421 1 756 . 1 1 77 77 PRO HA H 1 4.39 0.02 . 1 . . . . A 77 PRO HA . 30421 1 757 . 1 1 77 77 PRO HB2 H 1 2.45 0.02 . 2 . . . . A 77 PRO HB2 . 30421 1 758 . 1 1 77 77 PRO HB3 H 1 1.84 0.02 . 2 . . . . A 77 PRO HB3 . 30421 1 759 . 1 1 77 77 PRO C C 13 178.3 0.2 . 1 . . . . A 77 PRO C . 30421 1 760 . 1 1 77 77 PRO CA C 13 62.8 0.2 . 1 . . . . A 77 PRO CA . 30421 1 761 . 1 1 77 77 PRO CB C 13 32.6 0.2 . 1 . . . . A 77 PRO CB . 30421 1 762 . 1 1 77 77 PRO CG C 13 29.2 0.2 . 1 . . . . A 77 PRO CG . 30421 1 763 . 1 1 78 78 ILE H H 1 8.84 0.02 . 1 . . . . A 78 ILE H . 30421 1 764 . 1 1 78 78 ILE HA H 1 3.80 0.02 . 1 . . . . A 78 ILE HA . 30421 1 765 . 1 1 78 78 ILE HB H 1 1.80 0.02 . 1 . . . . A 78 ILE HB . 30421 1 766 . 1 1 78 78 ILE HG12 H 1 1.59 0.02 . 2 . . . . A 78 ILE HG12 . 30421 1 767 . 1 1 78 78 ILE HG13 H 1 1.29 0.02 . 2 . . . . A 78 ILE HG13 . 30421 1 768 . 1 1 78 78 ILE HG21 H 1 0.97 0.02 . 1 . . . . A 78 ILE HG21 . 30421 1 769 . 1 1 78 78 ILE HG22 H 1 0.97 0.02 . 1 . . . . A 78 ILE HG22 . 30421 1 770 . 1 1 78 78 ILE HG23 H 1 0.97 0.02 . 1 . . . . A 78 ILE HG23 . 30421 1 771 . 1 1 78 78 ILE HD11 H 1 0.95 0.02 . 1 . . . . A 78 ILE HD11 . 30421 1 772 . 1 1 78 78 ILE HD12 H 1 0.95 0.02 . 1 . . . . A 78 ILE HD12 . 30421 1 773 . 1 1 78 78 ILE HD13 H 1 0.95 0.02 . 1 . . . . A 78 ILE HD13 . 30421 1 774 . 1 1 78 78 ILE C C 13 175.4 0.2 . 1 . . . . A 78 ILE C . 30421 1 775 . 1 1 78 78 ILE CA C 13 64.8 0.2 . 1 . . . . A 78 ILE CA . 30421 1 776 . 1 1 78 78 ILE CB C 13 37.7 0.2 . 1 . . . . A 78 ILE CB . 30421 1 777 . 1 1 78 78 ILE CG1 C 13 30.1 0.2 . 1 . . . . A 78 ILE CG1 . 30421 1 778 . 1 1 78 78 ILE CG2 C 13 16.0 0.2 . 1 . . . . A 78 ILE CG2 . 30421 1 779 . 1 1 78 78 ILE CD1 C 13 14.2 0.2 . 1 . . . . A 78 ILE CD1 . 30421 1 780 . 1 1 78 78 ILE N N 15 124.2 0.2 . 1 . . . . A 78 ILE N . 30421 1 781 . 1 1 79 79 ASP H H 1 7.98 0.02 . 1 . . . . A 79 ASP H . 30421 1 782 . 1 1 79 79 ASP HA H 1 4.32 0.02 . 1 . . . . A 79 ASP HA . 30421 1 783 . 1 1 79 79 ASP HB2 H 1 2.75 0.02 . 2 . . . . A 79 ASP HB2 . 30421 1 784 . 1 1 79 79 ASP HB3 H 1 2.60 0.02 . 2 . . . . A 79 ASP HB3 . 30421 1 785 . 1 1 79 79 ASP C C 13 176.6 0.2 . 1 . . . . A 79 ASP C . 30421 1 786 . 1 1 79 79 ASP CA C 13 54.8 0.2 . 1 . . . . A 79 ASP CA . 30421 1 787 . 1 1 79 79 ASP CB C 13 39.8 0.2 . 1 . . . . A 79 ASP CB . 30421 1 788 . 1 1 79 79 ASP N N 15 116.3 0.2 . 1 . . . . A 79 ASP N . 30421 1 789 . 1 1 80 80 GLN H H 1 8.01 0.02 . 1 . . . . A 80 GLN H . 30421 1 790 . 1 1 80 80 GLN HA H 1 4.27 0.02 . 1 . . . . A 80 GLN HA . 30421 1 791 . 1 1 80 80 GLN HB2 H 1 2.30 0.02 . 2 . . . . A 80 GLN HB2 . 30421 1 792 . 1 1 80 80 GLN HB3 H 1 1.84 0.02 . 2 . . . . A 80 GLN HB3 . 30421 1 793 . 1 1 80 80 GLN HG2 H 1 2.39 0.02 . 2 . . . . A 80 GLN HG2 . 30421 1 794 . 1 1 80 80 GLN HG3 H 1 2.39 0.02 . 2 . . . . A 80 GLN HG3 . 30421 1 795 . 1 1 80 80 GLN HE21 H 1 7.76 0.02 . 2 . . . . A 80 GLN HE21 . 30421 1 796 . 1 1 80 80 GLN HE22 H 1 6.86 0.02 . 2 . . . . A 80 GLN HE22 . 30421 1 797 . 1 1 80 80 GLN CA C 13 55.5 0.2 . 1 . . . . A 80 GLN CA . 30421 1 798 . 1 1 80 80 GLN CB C 13 28.4 0.2 . 1 . . . . A 80 GLN CB . 30421 1 799 . 1 1 80 80 GLN CG C 13 34.3 0.2 . 1 . . . . A 80 GLN CG . 30421 1 800 . 1 1 80 80 GLN N N 15 116.1 0.2 . 1 . . . . A 80 GLN N . 30421 1 801 . 1 1 80 80 GLN NE2 N 15 112.2 0.2 . 1 . . . . A 80 GLN NE2 . 30421 1 802 . 1 1 81 81 LEU H H 1 7.39 0.2 . 1 . . . . A 81 LEU H . 30421 1 803 . 1 1 81 81 LEU HA H 1 4.39 0.02 . 1 . . . . A 81 LEU HA . 30421 1 804 . 1 1 81 81 LEU HB2 H 1 1.85 0.02 . 2 . . . . A 81 LEU HB2 . 30421 1 805 . 1 1 81 81 LEU HB3 H 1 1.72 0.02 . 2 . . . . A 81 LEU HB3 . 30421 1 806 . 1 1 81 81 LEU HG H 1 1.84 0.02 . 1 . . . . A 81 LEU HG . 30421 1 807 . 1 1 81 81 LEU HD11 H 1 0.95 0.02 . 2 . . . . A 81 LEU HD11 . 30421 1 808 . 1 1 81 81 LEU HD12 H 1 0.95 0.02 . 2 . . . . A 81 LEU HD12 . 30421 1 809 . 1 1 81 81 LEU HD13 H 1 0.95 0.02 . 2 . . . . A 81 LEU HD13 . 30421 1 810 . 1 1 81 81 LEU HD21 H 1 0.84 0.02 . 2 . . . . A 81 LEU HD21 . 30421 1 811 . 1 1 81 81 LEU HD22 H 1 0.84 0.02 . 2 . . . . A 81 LEU HD22 . 30421 1 812 . 1 1 81 81 LEU HD23 H 1 0.84 0.02 . 2 . . . . A 81 LEU HD23 . 30421 1 813 . 1 1 81 81 LEU CA C 13 54.6 0.2 . 1 . . . . A 81 LEU CA . 30421 1 814 . 1 1 81 81 LEU CB C 13 42.8 0.2 . 1 . . . . A 81 LEU CB . 30421 1 815 . 1 1 81 81 LEU CG C 13 27.9 0.2 . 1 . . . . A 81 LEU CG . 30421 1 816 . 1 1 81 81 LEU CD1 C 13 26.0 0.2 . 2 . . . . A 81 LEU CD1 . 30421 1 817 . 1 1 81 81 LEU CD2 C 13 23.7 0.2 . 2 . . . . A 81 LEU CD2 . 30421 1 818 . 1 1 81 81 LEU N N 15 121.1 0.2 . 1 . . . . A 81 LEU N . 30421 1 819 . 1 1 82 82 SER H H 1 9.05 0.02 . 1 . . . . A 82 SER H . 30421 1 820 . 1 1 82 82 SER HA H 1 4.72 0.02 . 1 . . . . A 82 SER HA . 30421 1 821 . 1 1 82 82 SER HB2 H 1 4.43 0.02 . 2 . . . . A 82 SER HB2 . 30421 1 822 . 1 1 82 82 SER HB3 H 1 4.09 0.02 . 2 . . . . A 82 SER HB3 . 30421 1 823 . 1 1 82 82 SER CA C 13 57.1 0.2 . 1 . . . . A 82 SER CA . 30421 1 824 . 1 1 82 82 SER CB C 13 62.7 0.2 . 1 . . . . A 82 SER CB . 30421 1 825 . 1 1 82 82 SER N N 15 120.1 0.2 . 1 . . . . A 82 SER N . 30421 1 826 . 1 1 83 83 PRO CA C 13 67.1 0.2 . 1 . . . . A 83 PRO CA . 30421 1 827 . 1 1 83 83 PRO CB C 13 32.7 0.2 . 1 . . . . A 83 PRO CB . 30421 1 828 . 1 1 83 83 PRO CG C 13 29.1 0.2 . 1 . . . . A 83 PRO CG . 30421 1 829 . 1 1 84 84 VAL H H 1 7.99 0.02 . 1 . . . . A 84 VAL H . 30421 1 830 . 1 1 84 84 VAL HA H 1 3.62 0.02 . 1 . . . . A 84 VAL HA . 30421 1 831 . 1 1 84 84 VAL HB H 1 1.97 0.02 . 1 . . . . A 84 VAL HB . 30421 1 832 . 1 1 84 84 VAL HG11 H 1 0.88 0.02 . 2 . . . . A 84 VAL HG11 . 30421 1 833 . 1 1 84 84 VAL HG12 H 1 0.88 0.02 . 2 . . . . A 84 VAL HG12 . 30421 1 834 . 1 1 84 84 VAL HG13 H 1 0.88 0.02 . 2 . . . . A 84 VAL HG13 . 30421 1 835 . 1 1 84 84 VAL HG21 H 1 0.76 0.02 . 2 . . . . A 84 VAL HG21 . 30421 1 836 . 1 1 84 84 VAL HG22 H 1 0.76 0.02 . 2 . . . . A 84 VAL HG22 . 30421 1 837 . 1 1 84 84 VAL HG23 H 1 0.76 0.02 . 2 . . . . A 84 VAL HG23 . 30421 1 838 . 1 1 84 84 VAL CA C 13 67.3 0.2 . 1 . . . . A 84 VAL CA . 30421 1 839 . 1 1 84 84 VAL CB C 13 31.6 0.2 . 1 . . . . A 84 VAL CB . 30421 1 840 . 1 1 84 84 VAL CG1 C 13 23.7 0.2 . 2 . . . . A 84 VAL CG1 . 30421 1 841 . 1 1 84 84 VAL CG2 C 13 21.2 0.2 . 2 . . . . A 84 VAL CG2 . 30421 1 842 . 1 1 84 84 VAL N N 15 115.2 0.2 . 1 . . . . A 84 VAL N . 30421 1 843 . 1 1 85 85 GLU H H 1 7.83 0.02 . 1 . . . . A 85 GLU H . 30421 1 844 . 1 1 85 85 GLU HA H 1 3.70 0.02 . 1 . . . . A 85 GLU HA . 30421 1 845 . 1 1 85 85 GLU HG2 H 1 2.28 0.02 . 2 . . . . A 85 GLU HG2 . 30421 1 846 . 1 1 85 85 GLU HG3 H 1 2.28 0.02 . 2 . . . . A 85 GLU HG3 . 30421 1 847 . 1 1 85 85 GLU CA C 13 60.9 0.2 . 1 . . . . A 85 GLU CA . 30421 1 848 . 1 1 85 85 GLU CB C 13 31.1 0.2 . 1 . . . . A 85 GLU CB . 30421 1 849 . 1 1 85 85 GLU CG C 13 38.3 0.2 . 1 . . . . A 85 GLU CG . 30421 1 850 . 1 1 85 85 GLU N N 15 119.6 0.2 . 1 . . . . A 85 GLU N . 30421 1 851 . 1 1 86 86 ARG H H 1 8.50 0.02 . 1 . . . . A 86 ARG H . 30421 1 852 . 1 1 86 86 ARG HA H 1 3.76 0.02 . 1 . . . . A 86 ARG HA . 30421 1 853 . 1 1 86 86 ARG HB2 H 1 1.90 0.02 . 2 . . . . A 86 ARG HB2 . 30421 1 854 . 1 1 86 86 ARG HB3 H 1 1.90 0.02 . 2 . . . . A 86 ARG HB3 . 30421 1 855 . 1 1 86 86 ARG HD2 H 1 3.27 0.02 . 2 . . . . A 86 ARG HD2 . 30421 1 856 . 1 1 86 86 ARG HD3 H 1 3.20 0.02 . 2 . . . . A 86 ARG HD3 . 30421 1 857 . 1 1 86 86 ARG CA C 13 60.6 0.2 . 1 . . . . A 86 ARG CA . 30421 1 858 . 1 1 86 86 ARG CB C 13 31.7 0.2 . 1 . . . . A 86 ARG CB . 30421 1 859 . 1 1 86 86 ARG CG C 13 29.0 0.2 . 1 . . . . A 86 ARG CG . 30421 1 860 . 1 1 86 86 ARG CD C 13 44.6 0.2 . 1 . . . . A 86 ARG CD . 30421 1 861 . 1 1 86 86 ARG N N 15 116.6 0.2 . 1 . . . . A 86 ARG N . 30421 1 862 . 1 1 87 87 ALA H H 1 8.44 0.02 . 1 . . . . A 87 ALA H . 30421 1 863 . 1 1 87 87 ALA HA H 1 4.00 0.02 . 1 . . . . A 87 ALA HA . 30421 1 864 . 1 1 87 87 ALA HB1 H 1 1.61 0.02 . 1 . . . . A 87 ALA HB1 . 30421 1 865 . 1 1 87 87 ALA HB2 H 1 1.61 0.02 . 1 . . . . A 87 ALA HB2 . 30421 1 866 . 1 1 87 87 ALA HB3 H 1 1.61 0.02 . 1 . . . . A 87 ALA HB3 . 30421 1 867 . 1 1 87 87 ALA CA C 13 56.2 0.2 . 1 . . . . A 87 ALA CA . 30421 1 868 . 1 1 87 87 ALA CB C 13 18.7 0.2 . 1 . . . . A 87 ALA CB . 30421 1 869 . 1 1 87 87 ALA N N 15 119.9 0.2 . 1 . . . . A 87 ALA N . 30421 1 870 . 1 1 88 88 VAL H H 1 8.39 0.02 . 1 . . . . A 88 VAL H . 30421 1 871 . 1 1 88 88 VAL HA H 1 3.62 0.02 . 1 . . . . A 88 VAL HA . 30421 1 872 . 1 1 88 88 VAL HB H 1 2.18 0.02 . 1 . . . . A 88 VAL HB . 30421 1 873 . 1 1 88 88 VAL HG11 H 1 1.10 0.02 . 2 . . . . A 88 VAL HG11 . 30421 1 874 . 1 1 88 88 VAL HG12 H 1 1.10 0.02 . 2 . . . . A 88 VAL HG12 . 30421 1 875 . 1 1 88 88 VAL HG13 H 1 1.10 0.02 . 2 . . . . A 88 VAL HG13 . 30421 1 876 . 1 1 88 88 VAL HG21 H 1 1.10 0.02 . 2 . . . . A 88 VAL HG21 . 30421 1 877 . 1 1 88 88 VAL HG22 H 1 1.10 0.02 . 2 . . . . A 88 VAL HG22 . 30421 1 878 . 1 1 88 88 VAL HG23 H 1 1.10 0.02 . 2 . . . . A 88 VAL HG23 . 30421 1 879 . 1 1 88 88 VAL CA C 13 67.2 0.2 . 1 . . . . A 88 VAL CA . 30421 1 880 . 1 1 88 88 VAL CB C 13 31.8 0.2 . 1 . . . . A 88 VAL CB . 30421 1 881 . 1 1 88 88 VAL CG1 C 13 23.3 0.2 . 2 . . . . A 88 VAL CG1 . 30421 1 882 . 1 1 88 88 VAL CG2 C 13 23.3 0.2 . 2 . . . . A 88 VAL CG2 . 30421 1 883 . 1 1 88 88 VAL N N 15 114.9 0.2 . 1 . . . . A 88 VAL N . 30421 1 884 . 1 1 89 89 LEU H H 1 8.32 0.02 . 1 . . . . A 89 LEU H . 30421 1 885 . 1 1 89 89 LEU HG H 1 0.89 0.02 . 1 . . . . A 89 LEU HG . 30421 1 886 . 1 1 89 89 LEU HD11 H 1 0.86 0.02 . 2 . . . . A 89 LEU HD11 . 30421 1 887 . 1 1 89 89 LEU HD12 H 1 0.86 0.02 . 2 . . . . A 89 LEU HD12 . 30421 1 888 . 1 1 89 89 LEU HD13 H 1 0.86 0.02 . 2 . . . . A 89 LEU HD13 . 30421 1 889 . 1 1 89 89 LEU HD21 H 1 0.86 0.02 . 2 . . . . A 89 LEU HD21 . 30421 1 890 . 1 1 89 89 LEU HD22 H 1 0.86 0.02 . 2 . . . . A 89 LEU HD22 . 30421 1 891 . 1 1 89 89 LEU HD23 H 1 0.86 0.02 . 2 . . . . A 89 LEU HD23 . 30421 1 892 . 1 1 89 89 LEU CA C 13 59.4 0.2 . 1 . . . . A 89 LEU CA . 30421 1 893 . 1 1 89 89 LEU CB C 13 43.0 0.2 . 1 . . . . A 89 LEU CB . 30421 1 894 . 1 1 89 89 LEU CG C 13 26.6 0.2 . 1 . . . . A 89 LEU CG . 30421 1 895 . 1 1 89 89 LEU CD1 C 13 23.9 0.2 . 2 . . . . A 89 LEU CD1 . 30421 1 896 . 1 1 89 89 LEU CD2 C 13 23.9 0.2 . 2 . . . . A 89 LEU CD2 . 30421 1 897 . 1 1 89 89 LEU N N 15 117.7 0.2 . 1 . . . . A 89 LEU N . 30421 1 898 . 1 1 90 90 LEU H H 1 8.90 0.02 . 1 . . . . A 90 LEU H . 30421 1 899 . 1 1 90 90 LEU HA H 1 3.99 0.02 . 1 . . . . A 90 LEU HA . 30421 1 900 . 1 1 90 90 LEU HG H 1 1.08 0.02 . 1 . . . . A 90 LEU HG . 30421 1 901 . 1 1 90 90 LEU CA C 13 59.2 0.2 . 1 . . . . A 90 LEU CA . 30421 1 902 . 1 1 90 90 LEU CB C 13 43.0 0.2 . 1 . . . . A 90 LEU CB . 30421 1 903 . 1 1 90 90 LEU CG C 13 25.9 0.2 . 1 . . . . A 90 LEU CG . 30421 1 904 . 1 1 90 90 LEU CD1 C 13 20.1 0.2 . 2 . . . . A 90 LEU CD1 . 30421 1 905 . 1 1 90 90 LEU CD2 C 13 20.1 0.2 . 2 . . . . A 90 LEU CD2 . 30421 1 906 . 1 1 90 90 LEU N N 15 123.3 0.2 . 1 . . . . A 90 LEU N . 30421 1 907 . 1 1 91 91 ILE H H 1 8.32 0.02 . 1 . . . . A 91 ILE H . 30421 1 908 . 1 1 91 91 ILE HB H 1 1.95 0.02 . 1 . . . . A 91 ILE HB . 30421 1 909 . 1 1 91 91 ILE HG12 H 1 1.03 0.02 . 2 . . . . A 91 ILE HG12 . 30421 1 910 . 1 1 91 91 ILE HG13 H 1 0.57 0.02 . 2 . . . . A 91 ILE HG13 . 30421 1 911 . 1 1 91 91 ILE HG21 H 1 0.88 0.02 . 1 . . . . A 91 ILE HG21 . 30421 1 912 . 1 1 91 91 ILE HG22 H 1 0.88 0.02 . 1 . . . . A 91 ILE HG22 . 30421 1 913 . 1 1 91 91 ILE HG23 H 1 0.88 0.02 . 1 . . . . A 91 ILE HG23 . 30421 1 914 . 1 1 91 91 ILE HD11 H 1 0.74 0.02 . 1 . . . . A 91 ILE HD11 . 30421 1 915 . 1 1 91 91 ILE HD12 H 1 0.74 0.02 . 1 . . . . A 91 ILE HD12 . 30421 1 916 . 1 1 91 91 ILE HD13 H 1 0.74 0.02 . 1 . . . . A 91 ILE HD13 . 30421 1 917 . 1 1 91 91 ILE CB C 13 38.6 0.2 . 1 . . . . A 91 ILE CB . 30421 1 918 . 1 1 91 91 ILE CG1 C 13 29.8 0.2 . 1 . . . . A 91 ILE CG1 . 30421 1 919 . 1 1 91 91 ILE CG2 C 13 16.0 0.2 . 1 . . . . A 91 ILE CG2 . 30421 1 920 . 1 1 91 91 ILE CD1 C 13 15.0 0.2 . 1 . . . . A 91 ILE CD1 . 30421 1 921 . 1 1 91 91 ILE N N 15 120.1 0.2 . 1 . . . . A 91 ILE N . 30421 1 922 . 1 1 92 92 ALA H H 1 8.47 0.02 . 1 . . . . A 92 ALA H . 30421 1 923 . 1 1 92 92 ALA HA H 1 4.20 0.02 . 1 . . . . A 92 ALA HA . 30421 1 924 . 1 1 92 92 ALA HB1 H 1 1.41 0.02 . 1 . . . . A 92 ALA HB1 . 30421 1 925 . 1 1 92 92 ALA HB2 H 1 1.41 0.02 . 1 . . . . A 92 ALA HB2 . 30421 1 926 . 1 1 92 92 ALA HB3 H 1 1.41 0.02 . 1 . . . . A 92 ALA HB3 . 30421 1 927 . 1 1 92 92 ALA CA C 13 54.9 0.2 . 1 . . . . A 92 ALA CA . 30421 1 928 . 1 1 92 92 ALA CB C 13 20.1 0.2 . 1 . . . . A 92 ALA CB . 30421 1 929 . 1 1 92 92 ALA N N 15 119.5 0.2 . 1 . . . . A 92 ALA N . 30421 1 930 . 1 1 93 93 THR H H 1 8.52 0.02 . 1 . . . . A 93 THR H . 30421 1 931 . 1 1 93 93 THR HB H 1 4.21 0.02 . 1 . . . . A 93 THR HB . 30421 1 932 . 1 1 93 93 THR HG21 H 1 1.16 0.02 . 1 . . . . A 93 THR HG21 . 30421 1 933 . 1 1 93 93 THR HG22 H 1 1.16 0.02 . 1 . . . . A 93 THR HG22 . 30421 1 934 . 1 1 93 93 THR HG23 H 1 1.16 0.02 . 1 . . . . A 93 THR HG23 . 30421 1 935 . 1 1 93 93 THR CA C 13 69.5 0.2 . 1 . . . . A 93 THR CA . 30421 1 936 . 1 1 93 93 THR CB C 13 67.4 0.2 . 1 . . . . A 93 THR CB . 30421 1 937 . 1 1 93 93 THR CG2 C 13 21.4 0.2 . 1 . . . . A 93 THR CG2 . 30421 1 938 . 1 1 93 93 THR N N 15 115.4 0.2 . 1 . . . . A 93 THR N . 30421 1 939 . 1 1 94 94 TYR H H 1 8.99 0.02 . 1 . . . . A 94 TYR H . 30421 1 940 . 1 1 94 94 TYR HA H 1 3.74 0.02 . 1 . . . . A 94 TYR HA . 30421 1 941 . 1 1 94 94 TYR HB2 H 1 3.44 0.02 . 2 . . . . A 94 TYR HB2 . 30421 1 942 . 1 1 94 94 TYR HB3 H 1 3.09 0.02 . 2 . . . . A 94 TYR HB3 . 30421 1 943 . 1 1 94 94 TYR HD1 H 1 6.79 0.02 . 3 . . . . A 94 TYR HD1 . 30421 1 944 . 1 1 94 94 TYR HD2 H 1 6.79 0.02 . 3 . . . . A 94 TYR HD2 . 30421 1 945 . 1 1 94 94 TYR HE1 H 1 6.38 0.02 . 3 . . . . A 94 TYR HE1 . 30421 1 946 . 1 1 94 94 TYR HE2 H 1 6.38 0.02 . 3 . . . . A 94 TYR HE2 . 30421 1 947 . 1 1 94 94 TYR CA C 13 63.8 0.2 . 1 . . . . A 94 TYR CA . 30421 1 948 . 1 1 94 94 TYR CB C 13 38.2 0.2 . 1 . . . . A 94 TYR CB . 30421 1 949 . 1 1 94 94 TYR CD1 C 13 132.5 0.2 . 3 . . . . A 94 TYR CD1 . 30421 1 950 . 1 1 94 94 TYR CD2 C 13 132.5 0.2 . 3 . . . . A 94 TYR CD2 . 30421 1 951 . 1 1 94 94 TYR CE1 C 13 118.9 0.2 . 3 . . . . A 94 TYR CE1 . 30421 1 952 . 1 1 94 94 TYR CE2 C 13 118.9 0.2 . 3 . . . . A 94 TYR CE2 . 30421 1 953 . 1 1 94 94 TYR N N 15 127.9 0.2 . 1 . . . . A 94 TYR N . 30421 1 954 . 1 1 95 95 GLU H H 1 8.96 0.02 . 1 . . . . A 95 GLU H . 30421 1 955 . 1 1 95 95 GLU HA H 1 3.91 0.02 . 1 . . . . A 95 GLU HA . 30421 1 956 . 1 1 95 95 GLU HG2 H 1 2.87 0.02 . 2 . . . . A 95 GLU HG2 . 30421 1 957 . 1 1 95 95 GLU HG3 H 1 1.90 0.02 . 2 . . . . A 95 GLU HG3 . 30421 1 958 . 1 1 95 95 GLU CA C 13 61.8 0.2 . 1 . . . . A 95 GLU CA . 30421 1 959 . 1 1 95 95 GLU CB C 13 32.2 0.2 . 1 . . . . A 95 GLU CB . 30421 1 960 . 1 1 95 95 GLU CG C 13 39.5 0.2 . 1 . . . . A 95 GLU CG . 30421 1 961 . 1 1 95 95 GLU N N 15 119.4 0.2 . 1 . . . . A 95 GLU N . 30421 1 962 . 1 1 96 96 LEU H H 1 9.44 0.02 . 1 . . . . A 96 LEU H . 30421 1 963 . 1 1 96 96 LEU HD11 H 1 0.74 0.02 . 2 . . . . A 96 LEU HD11 . 30421 1 964 . 1 1 96 96 LEU HD12 H 1 0.74 0.02 . 2 . . . . A 96 LEU HD12 . 30421 1 965 . 1 1 96 96 LEU HD13 H 1 0.74 0.02 . 2 . . . . A 96 LEU HD13 . 30421 1 966 . 1 1 96 96 LEU HD21 H 1 0.74 0.02 . 2 . . . . A 96 LEU HD21 . 30421 1 967 . 1 1 96 96 LEU HD22 H 1 0.74 0.02 . 2 . . . . A 96 LEU HD22 . 30421 1 968 . 1 1 96 96 LEU HD23 H 1 0.74 0.02 . 2 . . . . A 96 LEU HD23 . 30421 1 969 . 1 1 96 96 LEU CA C 13 58.7 0.2 . 1 . . . . A 96 LEU CA . 30421 1 970 . 1 1 96 96 LEU CB C 13 44.3 0.2 . 1 . . . . A 96 LEU CB . 30421 1 971 . 1 1 96 96 LEU CD1 C 13 25.8 0.2 . 2 . . . . A 96 LEU CD1 . 30421 1 972 . 1 1 96 96 LEU CD2 C 13 25.8 0.2 . 2 . . . . A 96 LEU CD2 . 30421 1 973 . 1 1 96 96 LEU N N 15 119.6 0.2 . 1 . . . . A 96 LEU N . 30421 1 974 . 1 1 97 97 THR H H 1 7.84 0.02 . 1 . . . . A 97 THR H . 30421 1 975 . 1 1 97 97 THR HA H 1 3.82 0.02 . 1 . . . . A 97 THR HA . 30421 1 976 . 1 1 97 97 THR HB H 1 3.76 0.02 . 1 . . . . A 97 THR HB . 30421 1 977 . 1 1 97 97 THR HG21 H 1 0.58 0.02 . 1 . . . . A 97 THR HG21 . 30421 1 978 . 1 1 97 97 THR HG22 H 1 0.58 0.02 . 1 . . . . A 97 THR HG22 . 30421 1 979 . 1 1 97 97 THR HG23 H 1 0.58 0.02 . 1 . . . . A 97 THR HG23 . 30421 1 980 . 1 1 97 97 THR CA C 13 66.2 0.2 . 1 . . . . A 97 THR CA . 30421 1 981 . 1 1 97 97 THR CB C 13 69.7 0.2 . 1 . . . . A 97 THR CB . 30421 1 982 . 1 1 97 97 THR CG2 C 13 20.2 0.2 . 1 . . . . A 97 THR CG2 . 30421 1 983 . 1 1 97 97 THR N N 15 112.5 0.2 . 1 . . . . A 97 THR N . 30421 1 984 . 1 1 98 98 HIS H H 1 7.95 0.02 . 1 . . . . A 98 HIS H . 30421 1 985 . 1 1 98 98 HIS HA H 1 4.72 0.02 . 1 . . . . A 98 HIS HA . 30421 1 986 . 1 1 98 98 HIS HB2 H 1 3.14 0.02 . 2 . . . . A 98 HIS HB2 . 30421 1 987 . 1 1 98 98 HIS HB3 H 1 2.40 0.02 . 2 . . . . A 98 HIS HB3 . 30421 1 988 . 1 1 98 98 HIS HD2 H 1 5.75 0.02 . 1 . . . . A 98 HIS HD2 . 30421 1 989 . 1 1 98 98 HIS CA C 13 57.4 0.2 . 1 . . . . A 98 HIS CA . 30421 1 990 . 1 1 98 98 HIS CB C 13 31.4 0.2 . 1 . . . . A 98 HIS CB . 30421 1 991 . 1 1 98 98 HIS CD2 C 13 121.2 0.2 . 1 . . . . A 98 HIS CD2 . 30421 1 992 . 1 1 98 98 HIS N N 15 113.4 0.2 . 1 . . . . A 98 HIS N . 30421 1 993 . 1 1 99 99 GLN H H 1 8.66 0.02 . 1 . . . . A 99 GLN H . 30421 1 994 . 1 1 99 99 GLN HB2 H 1 2.36 0.02 . 2 . . . . A 99 GLN HB2 . 30421 1 995 . 1 1 99 99 GLN HB3 H 1 2.28 0.02 . 2 . . . . A 99 GLN HB3 . 30421 1 996 . 1 1 99 99 GLN HG2 H 1 2.53 0.02 . 2 . . . . A 99 GLN HG2 . 30421 1 997 . 1 1 99 99 GLN HG3 H 1 2.19 0.02 . 2 . . . . A 99 GLN HG3 . 30421 1 998 . 1 1 99 99 GLN HE21 H 1 7.82 0.02 . 2 . . . . A 99 GLN HE21 . 30421 1 999 . 1 1 99 99 GLN HE22 H 1 6.97 0.02 . 2 . . . . A 99 GLN HE22 . 30421 1 1000 . 1 1 99 99 GLN CA C 13 54.9 0.2 . 1 . . . . A 99 GLN CA . 30421 1 1001 . 1 1 99 99 GLN CB C 13 26.8 0.2 . 1 . . . . A 99 GLN CB . 30421 1 1002 . 1 1 99 99 GLN CG C 13 34.4 0.2 . 1 . . . . A 99 GLN CG . 30421 1 1003 . 1 1 99 99 GLN N N 15 122.8 0.2 . 1 . . . . A 99 GLN N . 30421 1 1004 . 1 1 99 99 GLN NE2 N 15 110.8 0.2 . 1 . . . . A 99 GLN NE2 . 30421 1 1005 . 1 1 100 100 ILE H H 1 7.41 0.02 . 1 . . . . A 100 ILE H . 30421 1 1006 . 1 1 100 100 ILE HA H 1 3.75 0.02 . 1 . . . . A 100 ILE HA . 30421 1 1007 . 1 1 100 100 ILE HB H 1 2.01 0.02 . 1 . . . . A 100 ILE HB . 30421 1 1008 . 1 1 100 100 ILE HG12 H 1 1.37 0.02 . 2 . . . . A 100 ILE HG12 . 30421 1 1009 . 1 1 100 100 ILE HG13 H 1 1.28 0.02 . 2 . . . . A 100 ILE HG13 . 30421 1 1010 . 1 1 100 100 ILE HG21 H 1 0.90 0.02 . 1 . . . . A 100 ILE HG21 . 30421 1 1011 . 1 1 100 100 ILE HG22 H 1 0.90 0.02 . 1 . . . . A 100 ILE HG22 . 30421 1 1012 . 1 1 100 100 ILE HG23 H 1 0.90 0.02 . 1 . . . . A 100 ILE HG23 . 30421 1 1013 . 1 1 100 100 ILE HD11 H 1 0.87 0.02 . 1 . . . . A 100 ILE HD11 . 30421 1 1014 . 1 1 100 100 ILE HD12 H 1 0.87 0.02 . 1 . . . . A 100 ILE HD12 . 30421 1 1015 . 1 1 100 100 ILE HD13 H 1 0.87 0.02 . 1 . . . . A 100 ILE HD13 . 30421 1 1016 . 1 1 100 100 ILE CA C 13 63.4 0.2 . 1 . . . . A 100 ILE CA . 30421 1 1017 . 1 1 100 100 ILE CB C 13 37.6 0.2 . 1 . . . . A 100 ILE CB . 30421 1 1018 . 1 1 100 100 ILE CG1 C 13 27.1 0.2 . 1 . . . . A 100 ILE CG1 . 30421 1 1019 . 1 1 100 100 ILE CG2 C 13 18.7 0.2 . 1 . . . . A 100 ILE CG2 . 30421 1 1020 . 1 1 100 100 ILE CD1 C 13 12.9 0.2 . 1 . . . . A 100 ILE CD1 . 30421 1 1021 . 1 1 100 100 ILE N N 15 116.8 0.2 . 1 . . . . A 100 ILE N . 30421 1 1022 . 1 1 101 101 GLU H H 1 9.20 0.02 . 1 . . . . A 101 GLU H . 30421 1 1023 . 1 1 101 101 GLU HA H 1 4.29 0.02 . 1 . . . . A 101 GLU HA . 30421 1 1024 . 1 1 101 101 GLU HB2 H 1 2.17 0.02 . 2 . . . . A 101 GLU HB2 . 30421 1 1025 . 1 1 101 101 GLU HB3 H 1 2.02 0.02 . 2 . . . . A 101 GLU HB3 . 30421 1 1026 . 1 1 101 101 GLU HG2 H 1 2.31 0.02 . 2 . . . . A 101 GLU HG2 . 30421 1 1027 . 1 1 101 101 GLU HG3 H 1 2.28 0.02 . 2 . . . . A 101 GLU HG3 . 30421 1 1028 . 1 1 101 101 GLU C C 13 176.6 0.2 . 1 . . . . A 101 GLU C . 30421 1 1029 . 1 1 101 101 GLU CA C 13 57.1 0.2 . 1 . . . . A 101 GLU CA . 30421 1 1030 . 1 1 101 101 GLU CB C 13 28.7 0.2 . 1 . . . . A 101 GLU CB . 30421 1 1031 . 1 1 101 101 GLU CG C 13 36.4 0.2 . 1 . . . . A 101 GLU CG . 30421 1 1032 . 1 1 101 101 GLU N N 15 119.6 0.2 . 1 . . . . A 101 GLU N . 30421 1 1033 . 1 1 102 102 THR H H 1 8.14 0.02 . 1 . . . . A 102 THR H . 30421 1 1034 . 1 1 102 102 THR HA H 1 4.68 0.02 . 1 . . . . A 102 THR HA . 30421 1 1035 . 1 1 102 102 THR HB H 1 4.27 0.02 . 1 . . . . A 102 THR HB . 30421 1 1036 . 1 1 102 102 THR HG21 H 1 1.29 0.02 . 1 . . . . A 102 THR HG21 . 30421 1 1037 . 1 1 102 102 THR HG22 H 1 1.29 0.02 . 1 . . . . A 102 THR HG22 . 30421 1 1038 . 1 1 102 102 THR HG23 H 1 1.29 0.02 . 1 . . . . A 102 THR HG23 . 30421 1 1039 . 1 1 102 102 THR CA C 13 60.0 0.2 . 1 . . . . A 102 THR CA . 30421 1 1040 . 1 1 102 102 THR CB C 13 69.9 0.2 . 1 . . . . A 102 THR CB . 30421 1 1041 . 1 1 102 102 THR CG2 C 13 22.4 0.2 . 1 . . . . A 102 THR CG2 . 30421 1 1042 . 1 1 102 102 THR N N 15 121.6 0.2 . 1 . . . . A 102 THR N . 30421 1 1043 . 1 1 103 103 PRO HA H 1 4.65 0.02 . 1 . . . . A 103 PRO HA . 30421 1 1044 . 1 1 103 103 PRO HB2 H 1 2.56 0.02 . 2 . . . . A 103 PRO HB2 . 30421 1 1045 . 1 1 103 103 PRO HB3 H 1 1.88 0.02 . 2 . . . . A 103 PRO HB3 . 30421 1 1046 . 1 1 103 103 PRO HG2 H 1 2.14 0.02 . 2 . . . . A 103 PRO HG2 . 30421 1 1047 . 1 1 103 103 PRO HG3 H 1 2.07 0.02 . 2 . . . . A 103 PRO HG3 . 30421 1 1048 . 1 1 103 103 PRO CA C 13 62.7 0.2 . 1 . . . . A 103 PRO CA . 30421 1 1049 . 1 1 103 103 PRO CB C 13 33.4 0.2 . 1 . . . . A 103 PRO CB . 30421 1 1050 . 1 1 103 103 PRO CG C 13 27.7 0.2 . 1 . . . . A 103 PRO CG . 30421 1 1051 . 1 1 104 104 TYR H H 1 9.39 0.02 . 1 . . . . A 104 TYR H . 30421 1 1052 . 1 1 104 104 TYR HA H 1 4.10 0.02 . 1 . . . . A 104 TYR HA . 30421 1 1053 . 1 1 104 104 TYR HB2 H 1 3.00 0.02 . 2 . . . . A 104 TYR HB2 . 30421 1 1054 . 1 1 104 104 TYR HB3 H 1 2.81 0.02 . 2 . . . . A 104 TYR HB3 . 30421 1 1055 . 1 1 104 104 TYR HD1 H 1 7.05 0.02 . 3 . . . . A 104 TYR HD1 . 30421 1 1056 . 1 1 104 104 TYR HD2 H 1 7.05 0.02 . 3 . . . . A 104 TYR HD2 . 30421 1 1057 . 1 1 104 104 TYR HE1 H 1 6.80 0.02 . 3 . . . . A 104 TYR HE1 . 30421 1 1058 . 1 1 104 104 TYR HE2 H 1 6.80 0.02 . 3 . . . . A 104 TYR HE2 . 30421 1 1059 . 1 1 104 104 TYR CA C 13 61.3 0.2 . 1 . . . . A 104 TYR CA . 30421 1 1060 . 1 1 104 104 TYR CB C 13 37.4 0.2 . 1 . . . . A 104 TYR CB . 30421 1 1061 . 1 1 104 104 TYR CD1 C 13 133.6 0.2 . 3 . . . . A 104 TYR CD1 . 30421 1 1062 . 1 1 104 104 TYR CD2 C 13 133.6 0.2 . 3 . . . . A 104 TYR CD2 . 30421 1 1063 . 1 1 104 104 TYR CE1 C 13 118.7 0.2 . 3 . . . . A 104 TYR CE1 . 30421 1 1064 . 1 1 104 104 TYR CE2 C 13 118.7 0.2 . 3 . . . . A 104 TYR CE2 . 30421 1 1065 . 1 1 104 104 TYR N N 15 123.3 0.2 . 1 . . . . A 104 TYR N . 30421 1 1066 . 1 1 105 105 ARG H H 1 7.55 0.02 . 1 . . . . A 105 ARG H . 30421 1 1067 . 1 1 105 105 ARG HA H 1 3.45 0.02 . 1 . . . . A 105 ARG HA . 30421 1 1068 . 1 1 105 105 ARG HB2 H 1 1.50 0.02 . 2 . . . . A 105 ARG HB2 . 30421 1 1069 . 1 1 105 105 ARG HB3 H 1 1.29 0.02 . 2 . . . . A 105 ARG HB3 . 30421 1 1070 . 1 1 105 105 ARG HG2 H 1 1.17 0.02 . 2 . . . . A 105 ARG HG2 . 30421 1 1071 . 1 1 105 105 ARG HG3 H 1 1.22 0.02 . 2 . . . . A 105 ARG HG3 . 30421 1 1072 . 1 1 105 105 ARG HD2 H 1 3.09 0.02 . 2 . . . . A 105 ARG HD2 . 30421 1 1073 . 1 1 105 105 ARG HD3 H 1 2.96 0.02 . 2 . . . . A 105 ARG HD3 . 30421 1 1074 . 1 1 105 105 ARG CA C 13 58.4 0.2 . 1 . . . . A 105 ARG CA . 30421 1 1075 . 1 1 105 105 ARG CB C 13 29.0 0.2 . 1 . . . . A 105 ARG CB . 30421 1 1076 . 1 1 105 105 ARG CG C 13 27.0 0.2 . 1 . . . . A 105 ARG CG . 30421 1 1077 . 1 1 105 105 ARG CD C 13 42.4 0.2 . 1 . . . . A 105 ARG CD . 30421 1 1078 . 1 1 105 105 ARG N N 15 119.7 0.2 . 1 . . . . A 105 ARG N . 30421 1 1079 . 1 1 106 106 VAL H H 1 6.93 0.02 . 1 . . . . A 106 VAL H . 30421 1 1080 . 1 1 106 106 VAL HA H 1 3.66 0.02 . 1 . . . . A 106 VAL HA . 30421 1 1081 . 1 1 106 106 VAL HB H 1 2.17 0.02 . 1 . . . . A 106 VAL HB . 30421 1 1082 . 1 1 106 106 VAL HG11 H 1 1.02 0.02 . 2 . . . . A 106 VAL HG11 . 30421 1 1083 . 1 1 106 106 VAL HG12 H 1 1.02 0.02 . 2 . . . . A 106 VAL HG12 . 30421 1 1084 . 1 1 106 106 VAL HG13 H 1 1.02 0.02 . 2 . . . . A 106 VAL HG13 . 30421 1 1085 . 1 1 106 106 VAL HG21 H 1 0.89 0.02 . 2 . . . . A 106 VAL HG21 . 30421 1 1086 . 1 1 106 106 VAL HG22 H 1 0.89 0.02 . 2 . . . . A 106 VAL HG22 . 30421 1 1087 . 1 1 106 106 VAL HG23 H 1 0.89 0.02 . 2 . . . . A 106 VAL HG23 . 30421 1 1088 . 1 1 106 106 VAL CA C 13 65.7 0.2 . 1 . . . . A 106 VAL CA . 30421 1 1089 . 1 1 106 106 VAL CB C 13 31.6 0.2 . 1 . . . . A 106 VAL CB . 30421 1 1090 . 1 1 106 106 VAL CG1 C 13 22.2 0.2 . 2 . . . . A 106 VAL CG1 . 30421 1 1091 . 1 1 106 106 VAL CG2 C 13 20.4 0.2 . 2 . . . . A 106 VAL CG2 . 30421 1 1092 . 1 1 106 106 VAL N N 15 118.6 0.2 . 1 . . . . A 106 VAL N . 30421 1 1093 . 1 1 107 107 ILE H H 1 6.81 0.02 . 1 . . . . A 107 ILE H . 30421 1 1094 . 1 1 107 107 ILE HA H 1 3.48 0.02 . 1 . . . . A 107 ILE HA . 30421 1 1095 . 1 1 107 107 ILE HB H 1 1.90 0.02 . 1 . . . . A 107 ILE HB . 30421 1 1096 . 1 1 107 107 ILE HG21 H 1 1.00 0.02 . 1 . . . . A 107 ILE HG21 . 30421 1 1097 . 1 1 107 107 ILE HG22 H 1 1.00 0.02 . 1 . . . . A 107 ILE HG22 . 30421 1 1098 . 1 1 107 107 ILE HG23 H 1 1.00 0.02 . 1 . . . . A 107 ILE HG23 . 30421 1 1099 . 1 1 107 107 ILE HD11 H 1 0.74 0.02 . 1 . . . . A 107 ILE HD11 . 30421 1 1100 . 1 1 107 107 ILE HD12 H 1 0.74 0.02 . 1 . . . . A 107 ILE HD12 . 30421 1 1101 . 1 1 107 107 ILE HD13 H 1 0.74 0.02 . 1 . . . . A 107 ILE HD13 . 30421 1 1102 . 1 1 107 107 ILE CA C 13 65.4 0.2 . 1 . . . . A 107 ILE CA . 30421 1 1103 . 1 1 107 107 ILE CB C 13 38.6 0.2 . 1 . . . . A 107 ILE CB . 30421 1 1104 . 1 1 107 107 ILE CG1 C 13 22.2 0.2 . 1 . . . . A 107 ILE CG1 . 30421 1 1105 . 1 1 107 107 ILE CG2 C 13 18.0 0.2 . 1 . . . . A 107 ILE CG2 . 30421 1 1106 . 1 1 107 107 ILE CD1 C 13 15.6 0.2 . 1 . . . . A 107 ILE CD1 . 30421 1 1107 . 1 1 107 107 ILE N N 15 118.8 0.2 . 1 . . . . A 107 ILE N . 30421 1 1108 . 1 1 108 108 ILE H H 1 8.06 0.02 . 1 . . . . A 108 ILE H . 30421 1 1109 . 1 1 108 108 ILE HA H 1 3.61 0.02 . 1 . . . . A 108 ILE HA . 30421 1 1110 . 1 1 108 108 ILE HB H 1 1.81 0.02 . 1 . . . . A 108 ILE HB . 30421 1 1111 . 1 1 108 108 ILE HG21 H 1 0.96 0.02 . 1 . . . . A 108 ILE HG21 . 30421 1 1112 . 1 1 108 108 ILE HG22 H 1 0.96 0.02 . 1 . . . . A 108 ILE HG22 . 30421 1 1113 . 1 1 108 108 ILE HG23 H 1 0.96 0.02 . 1 . . . . A 108 ILE HG23 . 30421 1 1114 . 1 1 108 108 ILE HD11 H 1 1.00 0.02 . 1 . . . . A 108 ILE HD11 . 30421 1 1115 . 1 1 108 108 ILE HD12 H 1 1.00 0.02 . 1 . . . . A 108 ILE HD12 . 30421 1 1116 . 1 1 108 108 ILE HD13 H 1 1.00 0.02 . 1 . . . . A 108 ILE HD13 . 30421 1 1117 . 1 1 108 108 ILE C C 13 176.8 0.2 . 1 . . . . A 108 ILE C . 30421 1 1118 . 1 1 108 108 ILE CA C 13 66.2 0.2 . 1 . . . . A 108 ILE CA . 30421 1 1119 . 1 1 108 108 ILE CB C 13 37.8 0.2 . 1 . . . . A 108 ILE CB . 30421 1 1120 . 1 1 108 108 ILE CG2 C 13 17.2 0.2 . 1 . . . . A 108 ILE CG2 . 30421 1 1121 . 1 1 108 108 ILE CD1 C 13 13.8 0.2 . 1 . . . . A 108 ILE CD1 . 30421 1 1122 . 1 1 108 108 ILE N N 15 117.3 0.2 . 1 . . . . A 108 ILE N . 30421 1 1123 . 1 1 109 109 ASN H H 1 8.30 0.02 . 1 . . . . A 109 ASN H . 30421 1 1124 . 1 1 109 109 ASN HA H 1 4.37 0.02 . 1 . . . . A 109 ASN HA . 30421 1 1125 . 1 1 109 109 ASN HB2 H 1 2.95 0.02 . 2 . . . . A 109 ASN HB2 . 30421 1 1126 . 1 1 109 109 ASN HB3 H 1 2.82 0.02 . 2 . . . . A 109 ASN HB3 . 30421 1 1127 . 1 1 109 109 ASN HD21 H 1 7.69 0.02 . 2 . . . . A 109 ASN HD21 . 30421 1 1128 . 1 1 109 109 ASN HD22 H 1 6.90 0.02 . 2 . . . . A 109 ASN HD22 . 30421 1 1129 . 1 1 109 109 ASN C C 13 179.0 0.2 . 1 . . . . A 109 ASN C . 30421 1 1130 . 1 1 109 109 ASN CA C 13 56.7 0.2 . 1 . . . . A 109 ASN CA . 30421 1 1131 . 1 1 109 109 ASN CB C 13 38.0 0.2 . 1 . . . . A 109 ASN CB . 30421 1 1132 . 1 1 109 109 ASN N N 15 118.2 0.2 . 1 . . . . A 109 ASN N . 30421 1 1133 . 1 1 109 109 ASN ND2 N 15 111.8 0.2 . 1 . . . . A 109 ASN ND2 . 30421 1 1134 . 1 1 110 110 GLU H H 1 8.48 0.02 . 1 . . . . A 110 GLU H . 30421 1 1135 . 1 1 110 110 GLU HA H 1 3.92 0.02 . 1 . . . . A 110 GLU HA . 30421 1 1136 . 1 1 110 110 GLU CA C 13 59.4 0.2 . 1 . . . . A 110 GLU CA . 30421 1 1137 . 1 1 110 110 GLU CB C 13 30.8 0.2 . 1 . . . . A 110 GLU CB . 30421 1 1138 . 1 1 110 110 GLU CG C 13 34.9 0.2 . 1 . . . . A 110 GLU CG . 30421 1 1139 . 1 1 110 110 GLU N N 15 118.3 0.2 . 1 . . . . A 110 GLU N . 30421 1 1140 . 1 1 111 111 ALA H H 1 8.01 0.02 . 1 . . . . A 111 ALA H . 30421 1 1141 . 1 1 111 111 ALA HB1 H 1 1.48 0.02 . 1 . . . . A 111 ALA HB1 . 30421 1 1142 . 1 1 111 111 ALA HB2 H 1 1.48 0.02 . 1 . . . . A 111 ALA HB2 . 30421 1 1143 . 1 1 111 111 ALA HB3 H 1 1.48 0.02 . 1 . . . . A 111 ALA HB3 . 30421 1 1144 . 1 1 111 111 ALA CA C 13 56.5 0.2 . 1 . . . . A 111 ALA CA . 30421 1 1145 . 1 1 111 111 ALA CB C 13 19.5 0.2 . 1 . . . . A 111 ALA CB . 30421 1 1146 . 1 1 111 111 ALA N N 15 122.7 0.2 . 1 . . . . A 111 ALA N . 30421 1 1147 . 1 1 112 112 VAL H H 1 8.65 0.02 . 1 . . . . A 112 VAL H . 30421 1 1148 . 1 1 112 112 VAL HA H 1 3.50 0.02 . 1 . . . . A 112 VAL HA . 30421 1 1149 . 1 1 112 112 VAL HB H 1 2.28 0.02 . 1 . . . . A 112 VAL HB . 30421 1 1150 . 1 1 112 112 VAL HG11 H 1 1.10 0.02 . 2 . . . . A 112 VAL HG11 . 30421 1 1151 . 1 1 112 112 VAL HG12 H 1 1.10 0.02 . 2 . . . . A 112 VAL HG12 . 30421 1 1152 . 1 1 112 112 VAL HG13 H 1 1.10 0.02 . 2 . . . . A 112 VAL HG13 . 30421 1 1153 . 1 1 112 112 VAL HG21 H 1 0.96 0.02 . 2 . . . . A 112 VAL HG21 . 30421 1 1154 . 1 1 112 112 VAL HG22 H 1 0.96 0.02 . 2 . . . . A 112 VAL HG22 . 30421 1 1155 . 1 1 112 112 VAL HG23 H 1 0.96 0.02 . 2 . . . . A 112 VAL HG23 . 30421 1 1156 . 1 1 112 112 VAL C C 13 178.2 0.2 . 1 . . . . A 112 VAL C . 30421 1 1157 . 1 1 112 112 VAL CA C 13 67.5 0.2 . 1 . . . . A 112 VAL CA . 30421 1 1158 . 1 1 112 112 VAL CB C 13 31.5 0.2 . 1 . . . . A 112 VAL CB . 30421 1 1159 . 1 1 112 112 VAL CG1 C 13 23.5 0.2 . 2 . . . . A 112 VAL CG1 . 30421 1 1160 . 1 1 112 112 VAL CG2 C 13 21.7 0.2 . 2 . . . . A 112 VAL CG2 . 30421 1 1161 . 1 1 112 112 VAL N N 15 118.3 0.2 . 1 . . . . A 112 VAL N . 30421 1 1162 . 1 1 113 113 GLU H H 1 7.89 0.02 . 1 . . . . A 113 GLU H . 30421 1 1163 . 1 1 113 113 GLU HA H 1 3.95 0.02 . 1 . . . . A 113 GLU HA . 30421 1 1164 . 1 1 113 113 GLU HB2 H 1 2.06 0.02 . 2 . . . . A 113 GLU HB2 . 30421 1 1165 . 1 1 113 113 GLU HB3 H 1 2.06 0.02 . 2 . . . . A 113 GLU HB3 . 30421 1 1166 . 1 1 113 113 GLU HG2 H 1 2.33 0.02 . 2 . . . . A 113 GLU HG2 . 30421 1 1167 . 1 1 113 113 GLU HG3 H 1 2.33 0.02 . 2 . . . . A 113 GLU HG3 . 30421 1 1168 . 1 1 113 113 GLU CA C 13 59.4 0.2 . 1 . . . . A 113 GLU CA . 30421 1 1169 . 1 1 113 113 GLU CB C 13 28.6 0.2 . 1 . . . . A 113 GLU CB . 30421 1 1170 . 1 1 113 113 GLU CG C 13 36.2 0.2 . 1 . . . . A 113 GLU CG . 30421 1 1171 . 1 1 113 113 GLU N N 15 118.6 0.2 . 1 . . . . A 113 GLU N . 30421 1 1172 . 1 1 114 114 LEU H H 1 8.36 0.02 . 1 . . . . A 114 LEU H . 30421 1 1173 . 1 1 114 114 LEU HA H 1 4.17 0.02 . 1 . . . . A 114 LEU HA . 30421 1 1174 . 1 1 114 114 LEU HB2 H 1 2.36 0.02 . 2 . . . . A 114 LEU HB2 . 30421 1 1175 . 1 1 114 114 LEU HB3 H 1 2.36 0.02 . 2 . . . . A 114 LEU HB3 . 30421 1 1176 . 1 1 114 114 LEU HG H 1 1.01 0.02 . 1 . . . . A 114 LEU HG . 30421 1 1177 . 1 1 114 114 LEU HD11 H 1 0.99 0.02 . 2 . . . . A 114 LEU HD11 . 30421 1 1178 . 1 1 114 114 LEU HD12 H 1 0.99 0.02 . 2 . . . . A 114 LEU HD12 . 30421 1 1179 . 1 1 114 114 LEU HD13 H 1 0.99 0.02 . 2 . . . . A 114 LEU HD13 . 30421 1 1180 . 1 1 114 114 LEU CA C 13 58.3 0.2 . 1 . . . . A 114 LEU CA . 30421 1 1181 . 1 1 114 114 LEU CB C 13 42.9 0.2 . 1 . . . . A 114 LEU CB . 30421 1 1182 . 1 1 114 114 LEU CG C 13 25.2 0.2 . 1 . . . . A 114 LEU CG . 30421 1 1183 . 1 1 114 114 LEU CD1 C 13 23.5 0.2 . 2 . . . . A 114 LEU CD1 . 30421 1 1184 . 1 1 114 114 LEU N N 15 121.9 0.2 . 1 . . . . A 114 LEU N . 30421 1 1185 . 1 1 115 115 ALA H H 1 8.59 0.02 . 1 . . . . A 115 ALA H . 30421 1 1186 . 1 1 115 115 ALA HA H 1 4.01 0.02 . 1 . . . . A 115 ALA HA . 30421 1 1187 . 1 1 115 115 ALA HB1 H 1 1.59 0.02 . 1 . . . . A 115 ALA HB1 . 30421 1 1188 . 1 1 115 115 ALA HB2 H 1 1.59 0.02 . 1 . . . . A 115 ALA HB2 . 30421 1 1189 . 1 1 115 115 ALA HB3 H 1 1.59 0.02 . 1 . . . . A 115 ALA HB3 . 30421 1 1190 . 1 1 115 115 ALA CA C 13 55.3 0.2 . 1 . . . . A 115 ALA CA . 30421 1 1191 . 1 1 115 115 ALA CB C 13 17.5 0.2 . 1 . . . . A 115 ALA CB . 30421 1 1192 . 1 1 115 115 ALA N N 15 121.1 0.2 . 1 . . . . A 115 ALA N . 30421 1 1193 . 1 1 116 116 LYS CA C 13 60.6 0.2 . 1 . . . . A 116 LYS CA . 30421 1 1194 . 1 1 117 117 THR H H 1 8.11 0.02 . 1 . . . . A 117 THR H . 30421 1 1195 . 1 1 117 117 THR HA H 1 3.73 0.02 . 1 . . . . A 117 THR HA . 30421 1 1196 . 1 1 117 117 THR HB H 1 3.92 0.02 . 1 . . . . A 117 THR HB . 30421 1 1197 . 1 1 117 117 THR HG21 H 1 0.36 0.02 . 1 . . . . A 117 THR HG21 . 30421 1 1198 . 1 1 117 117 THR HG22 H 1 0.36 0.02 . 1 . . . . A 117 THR HG22 . 30421 1 1199 . 1 1 117 117 THR HG23 H 1 0.36 0.02 . 1 . . . . A 117 THR HG23 . 30421 1 1200 . 1 1 117 117 THR CA C 13 66.5 0.2 . 1 . . . . A 117 THR CA . 30421 1 1201 . 1 1 117 117 THR CB C 13 69.1 0.2 . 1 . . . . A 117 THR CB . 30421 1 1202 . 1 1 117 117 THR CG2 C 13 20.5 0.2 . 1 . . . . A 117 THR CG2 . 30421 1 1203 . 1 1 117 117 THR N N 15 116.4 0.2 . 1 . . . . A 117 THR N . 30421 1 1204 . 1 1 118 118 PHE H H 1 8.10 0.02 . 1 . . . . A 118 PHE H . 30421 1 1205 . 1 1 118 118 PHE HA H 1 4.71 0.02 . 1 . . . . A 118 PHE HA . 30421 1 1206 . 1 1 118 118 PHE HB2 H 1 3.22 0.02 . 2 . . . . A 118 PHE HB2 . 30421 1 1207 . 1 1 118 118 PHE HB3 H 1 2.58 0.02 . 2 . . . . A 118 PHE HB3 . 30421 1 1208 . 1 1 118 118 PHE HD1 H 1 7.38 0.02 . 3 . . . . A 118 PHE HD1 . 30421 1 1209 . 1 1 118 118 PHE HD2 H 1 7.38 0.02 . 3 . . . . A 118 PHE HD2 . 30421 1 1210 . 1 1 118 118 PHE HE1 H 1 7.27 0.02 . 3 . . . . A 118 PHE HE1 . 30421 1 1211 . 1 1 118 118 PHE HE2 H 1 7.27 0.02 . 3 . . . . A 118 PHE HE2 . 30421 1 1212 . 1 1 118 118 PHE CA C 13 59.1 0.2 . 1 . . . . A 118 PHE CA . 30421 1 1213 . 1 1 118 118 PHE CB C 13 41.2 0.2 . 1 . . . . A 118 PHE CB . 30421 1 1214 . 1 1 118 118 PHE CD1 C 13 132.1 0.2 . 3 . . . . A 118 PHE CD1 . 30421 1 1215 . 1 1 118 118 PHE CD2 C 13 132.1 0.2 . 3 . . . . A 118 PHE CD2 . 30421 1 1216 . 1 1 118 118 PHE CE1 C 13 131.2 0.2 . 3 . . . . A 118 PHE CE1 . 30421 1 1217 . 1 1 118 118 PHE CE2 C 13 131.2 0.2 . 3 . . . . A 118 PHE CE2 . 30421 1 1218 . 1 1 118 118 PHE N N 15 115.2 0.2 . 1 . . . . A 118 PHE N . 30421 1 1219 . 1 1 119 119 GLY H H 1 8.19 0.02 . 1 . . . . A 119 GLY H . 30421 1 1220 . 1 1 119 119 GLY HA2 H 1 4.43 0.02 . 2 . . . . A 119 GLY HA2 . 30421 1 1221 . 1 1 119 119 GLY HA3 H 1 3.99 0.02 . 2 . . . . A 119 GLY HA3 . 30421 1 1222 . 1 1 119 119 GLY CA C 13 45.1 0.2 . 1 . . . . A 119 GLY CA . 30421 1 1223 . 1 1 119 119 GLY N N 15 108.6 0.2 . 1 . . . . A 119 GLY N . 30421 1 1224 . 1 1 120 120 GLY H H 1 8.39 0.02 . 1 . . . . A 120 GLY H . 30421 1 1225 . 1 1 120 120 GLY HA2 H 1 4.24 0.02 . 2 . . . . A 120 GLY HA2 . 30421 1 1226 . 1 1 120 120 GLY HA3 H 1 4.16 0.02 . 2 . . . . A 120 GLY HA3 . 30421 1 1227 . 1 1 120 120 GLY CA C 13 44.9 0.2 . 1 . . . . A 120 GLY CA . 30421 1 1228 . 1 1 120 120 GLY N N 15 107.3 0.2 . 1 . . . . A 120 GLY N . 30421 1 1229 . 1 1 121 121 SER H H 1 8.80 0.02 . 1 . . . . A 121 SER H . 30421 1 1230 . 1 1 121 121 SER HA H 1 4.31 0.02 . 1 . . . . A 121 SER HA . 30421 1 1231 . 1 1 121 121 SER HB2 H 1 3.97 0.02 . 2 . . . . A 121 SER HB2 . 30421 1 1232 . 1 1 121 121 SER HB3 H 1 3.97 0.02 . 2 . . . . A 121 SER HB3 . 30421 1 1233 . 1 1 121 121 SER CA C 13 60.8 0.2 . 1 . . . . A 121 SER CA . 30421 1 1234 . 1 1 121 121 SER CB C 13 63.1 0.2 . 1 . . . . A 121 SER CB . 30421 1 1235 . 1 1 121 121 SER N N 15 116.5 0.2 . 1 . . . . A 121 SER N . 30421 1 1236 . 1 1 122 122 ASP H H 1 8.72 0.02 . 1 . . . . A 122 ASP H . 30421 1 1237 . 1 1 122 122 ASP HA H 1 4.77 0.02 . 1 . . . . A 122 ASP HA . 30421 1 1238 . 1 1 122 122 ASP HB2 H 1 2.75 0.02 . 2 . . . . A 122 ASP HB2 . 30421 1 1239 . 1 1 122 122 ASP HB3 H 1 2.68 0.02 . 2 . . . . A 122 ASP HB3 . 30421 1 1240 . 1 1 122 122 ASP CA C 13 56.0 0.2 . 1 . . . . A 122 ASP CA . 30421 1 1241 . 1 1 122 122 ASP CB C 13 41.0 0.2 . 1 . . . . A 122 ASP CB . 30421 1 1242 . 1 1 122 122 ASP N N 15 119.3 0.2 . 1 . . . . A 122 ASP N . 30421 1 1243 . 1 1 123 123 GLY H H 1 8.18 0.02 . 1 . . . . A 123 GLY H . 30421 1 1244 . 1 1 123 123 GLY HA2 H 1 4.07 0.02 . 2 . . . . A 123 GLY HA2 . 30421 1 1245 . 1 1 123 123 GLY HA3 H 1 4.07 0.02 . 2 . . . . A 123 GLY HA3 . 30421 1 1246 . 1 1 123 123 GLY CA C 13 47.3 0.2 . 1 . . . . A 123 GLY CA . 30421 1 1247 . 1 1 123 123 GLY N N 15 110.1 0.2 . 1 . . . . A 123 GLY N . 30421 1 1248 . 1 1 124 124 TYR H H 1 8.37 0.02 . 1 . . . . A 124 TYR H . 30421 1 1249 . 1 1 124 124 TYR HA H 1 4.33 0.02 . 1 . . . . A 124 TYR HA . 30421 1 1250 . 1 1 124 124 TYR HB2 H 1 3.23 0.02 . 2 . . . . A 124 TYR HB2 . 30421 1 1251 . 1 1 124 124 TYR HB3 H 1 2.82 0.02 . 2 . . . . A 124 TYR HB3 . 30421 1 1252 . 1 1 124 124 TYR HE1 H 1 6.96 0.02 . 3 . . . . A 124 TYR HE1 . 30421 1 1253 . 1 1 124 124 TYR HE2 H 1 6.96 0.02 . 3 . . . . A 124 TYR HE2 . 30421 1 1254 . 1 1 124 124 TYR CA C 13 59.2 0.2 . 1 . . . . A 124 TYR CA . 30421 1 1255 . 1 1 124 124 TYR CB C 13 38.1 0.2 . 1 . . . . A 124 TYR CB . 30421 1 1256 . 1 1 124 124 TYR CE1 C 13 118.9 0.2 . 3 . . . . A 124 TYR CE1 . 30421 1 1257 . 1 1 124 124 TYR CE2 C 13 118.9 0.2 . 3 . . . . A 124 TYR CE2 . 30421 1 1258 . 1 1 124 124 TYR N N 15 117.7 0.2 . 1 . . . . A 124 TYR N . 30421 1 1259 . 1 1 125 125 LYS HA H 1 3.82 0.02 . 1 . . . . A 125 LYS HA . 30421 1 1260 . 1 1 125 125 LYS HB2 H 1 1.73 0.02 . 2 . . . . A 125 LYS HB2 . 30421 1 1261 . 1 1 125 125 LYS HB3 H 1 1.63 0.02 . 2 . . . . A 125 LYS HB3 . 30421 1 1262 . 1 1 125 125 LYS HG2 H 1 1.61 0.02 . 2 . . . . A 125 LYS HG2 . 30421 1 1263 . 1 1 125 125 LYS HG3 H 1 1.54 0.02 . 2 . . . . A 125 LYS HG3 . 30421 1 1264 . 1 1 125 125 LYS HD2 H 1 1.07 0.02 . 2 . . . . A 125 LYS HD2 . 30421 1 1265 . 1 1 125 125 LYS HD3 H 1 0.76 0.02 . 2 . . . . A 125 LYS HD3 . 30421 1 1266 . 1 1 125 125 LYS C C 13 179.1 0.2 . 1 . . . . A 125 LYS C . 30421 1 1267 . 1 1 125 125 LYS CA C 13 59.2 0.2 . 1 . . . . A 125 LYS CA . 30421 1 1268 . 1 1 125 125 LYS CB C 13 32.2 0.2 . 1 . . . . A 125 LYS CB . 30421 1 1269 . 1 1 125 125 LYS CG C 13 25.5 0.2 . 1 . . . . A 125 LYS CG . 30421 1 1270 . 1 1 125 125 LYS CD C 13 29.4 0.2 . 1 . . . . A 125 LYS CD . 30421 1 1271 . 1 1 126 126 TYR H H 1 7.82 0.02 . 1 . . . . A 126 TYR H . 30421 1 1272 . 1 1 126 126 TYR HA H 1 4.21 0.02 . 1 . . . . A 126 TYR HA . 30421 1 1273 . 1 1 126 126 TYR HB2 H 1 3.19 0.02 . 2 . . . . A 126 TYR HB2 . 30421 1 1274 . 1 1 126 126 TYR HB3 H 1 3.19 0.02 . 2 . . . . A 126 TYR HB3 . 30421 1 1275 . 1 1 126 126 TYR HD1 H 1 6.98 0.02 . 3 . . . . A 126 TYR HD1 . 30421 1 1276 . 1 1 126 126 TYR HD2 H 1 6.98 0.02 . 3 . . . . A 126 TYR HD2 . 30421 1 1277 . 1 1 126 126 TYR HE1 H 1 6.77 0.02 . 3 . . . . A 126 TYR HE1 . 30421 1 1278 . 1 1 126 126 TYR HE2 H 1 6.77 0.02 . 3 . . . . A 126 TYR HE2 . 30421 1 1279 . 1 1 126 126 TYR CA C 13 61.4 0.2 . 1 . . . . A 126 TYR CA . 30421 1 1280 . 1 1 126 126 TYR CB C 13 38.2 0.2 . 1 . . . . A 126 TYR CB . 30421 1 1281 . 1 1 126 126 TYR CD1 C 13 133.0 0.2 . 3 . . . . A 126 TYR CD1 . 30421 1 1282 . 1 1 126 126 TYR CD2 C 13 133.0 0.2 . 3 . . . . A 126 TYR CD2 . 30421 1 1283 . 1 1 126 126 TYR CE1 C 13 118.7 0.2 . 3 . . . . A 126 TYR CE1 . 30421 1 1284 . 1 1 126 126 TYR CE2 C 13 128.7 0.2 . 3 . . . . A 126 TYR CE2 . 30421 1 1285 . 1 1 126 126 TYR N N 15 121.7 0.2 . 1 . . . . A 126 TYR N . 30421 1 1286 . 1 1 127 127 VAL H H 1 8.32 0.02 . 1 . . . . A 127 VAL H . 30421 1 1287 . 1 1 127 127 VAL HA H 1 3.45 0.02 . 1 . . . . A 127 VAL HA . 30421 1 1288 . 1 1 127 127 VAL HB H 1 2.19 0.02 . 1 . . . . A 127 VAL HB . 30421 1 1289 . 1 1 127 127 VAL HG11 H 1 1.13 0.02 . 2 . . . . A 127 VAL HG11 . 30421 1 1290 . 1 1 127 127 VAL HG12 H 1 1.13 0.02 . 2 . . . . A 127 VAL HG12 . 30421 1 1291 . 1 1 127 127 VAL HG13 H 1 1.13 0.02 . 2 . . . . A 127 VAL HG13 . 30421 1 1292 . 1 1 127 127 VAL HG21 H 1 0.92 0.02 . 2 . . . . A 127 VAL HG21 . 30421 1 1293 . 1 1 127 127 VAL HG22 H 1 0.92 0.02 . 2 . . . . A 127 VAL HG22 . 30421 1 1294 . 1 1 127 127 VAL HG23 H 1 0.92 0.02 . 2 . . . . A 127 VAL HG23 . 30421 1 1295 . 1 1 127 127 VAL CA C 13 66.5 0.2 . 1 . . . . A 127 VAL CA . 30421 1 1296 . 1 1 127 127 VAL CB C 13 32.9 0.2 . 1 . . . . A 127 VAL CB . 30421 1 1297 . 1 1 127 127 VAL CG1 C 13 22.5 0.2 . 2 . . . . A 127 VAL CG1 . 30421 1 1298 . 1 1 127 127 VAL CG2 C 13 21.2 0.2 . 2 . . . . A 127 VAL CG2 . 30421 1 1299 . 1 1 127 127 VAL N N 15 117.3 0.2 . 1 . . . . A 127 VAL N . 30421 1 1300 . 1 1 128 128 ASN H H 1 8.38 0.02 . 1 . . . . A 128 ASN H . 30421 1 1301 . 1 1 128 128 ASN HA H 1 4.06 0.02 . 1 . . . . A 128 ASN HA . 30421 1 1302 . 1 1 128 128 ASN HB2 H 1 3.03 0.02 . 2 . . . . A 128 ASN HB2 . 30421 1 1303 . 1 1 128 128 ASN HB3 H 1 2.90 0.02 . 2 . . . . A 128 ASN HB3 . 30421 1 1304 . 1 1 128 128 ASN HD21 H 1 7.47 0.02 . 2 . . . . A 128 ASN HD21 . 30421 1 1305 . 1 1 128 128 ASN HD22 H 1 7.10 0.02 . 2 . . . . A 128 ASN HD22 . 30421 1 1306 . 1 1 128 128 ASN CA C 13 56.5 0.2 . 1 . . . . A 128 ASN CA . 30421 1 1307 . 1 1 128 128 ASN CB C 13 39.5 0.2 . 1 . . . . A 128 ASN CB . 30421 1 1308 . 1 1 128 128 ASN N N 15 117.3 0.2 . 1 . . . . A 128 ASN N . 30421 1 1309 . 1 1 128 128 ASN ND2 N 15 113.4 0.2 . 1 . . . . A 128 ASN ND2 . 30421 1 1310 . 1 1 129 129 GLY H H 1 7.87 0.02 . 1 . . . . A 129 GLY H . 30421 1 1311 . 1 1 129 129 GLY HA2 H 1 4.02 0.02 . 2 . . . . A 129 GLY HA2 . 30421 1 1312 . 1 1 129 129 GLY HA3 H 1 3.93 0.02 . 2 . . . . A 129 GLY HA3 . 30421 1 1313 . 1 1 129 129 GLY CA C 13 47.2 0.2 . 1 . . . . A 129 GLY CA . 30421 1 1314 . 1 1 129 129 GLY N N 15 105.6 0.2 . 1 . . . . A 129 GLY N . 30421 1 1315 . 1 1 130 130 VAL H H 1 7.57 0.02 . 1 . . . . A 130 VAL H . 30421 1 1316 . 1 1 130 130 VAL HA H 1 3.57 0.02 . 1 . . . . A 130 VAL HA . 30421 1 1317 . 1 1 130 130 VAL HB H 1 1.88 0.02 . 1 . . . . A 130 VAL HB . 30421 1 1318 . 1 1 130 130 VAL HG11 H 1 0.65 0.02 . 2 . . . . A 130 VAL HG11 . 30421 1 1319 . 1 1 130 130 VAL HG12 H 1 0.65 0.02 . 2 . . . . A 130 VAL HG12 . 30421 1 1320 . 1 1 130 130 VAL HG13 H 1 0.65 0.02 . 2 . . . . A 130 VAL HG13 . 30421 1 1321 . 1 1 130 130 VAL C C 13 178.3 0.2 . 1 . . . . A 130 VAL C . 30421 1 1322 . 1 1 130 130 VAL CA C 13 66.2 0.2 . 1 . . . . A 130 VAL CA . 30421 1 1323 . 1 1 130 130 VAL CB C 13 32.2 0.2 . 1 . . . . A 130 VAL CB . 30421 1 1324 . 1 1 130 130 VAL CG1 C 13 22.4 0.2 . 2 . . . . A 130 VAL CG1 . 30421 1 1325 . 1 1 130 130 VAL CG2 C 13 21.9 0.2 . 2 . . . . A 130 VAL CG2 . 30421 1 1326 . 1 1 130 130 VAL N N 15 121.1 0.2 . 1 . . . . A 130 VAL N . 30421 1 1327 . 1 1 131 131 LEU H H 1 8.34 0.02 . 1 . . . . A 131 LEU H . 30421 1 1328 . 1 1 131 131 LEU HG H 1 0.80 0.02 . 1 . . . . A 131 LEU HG . 30421 1 1329 . 1 1 131 131 LEU HD11 H 1 0.78 0.02 . 2 . . . . A 131 LEU HD11 . 30421 1 1330 . 1 1 131 131 LEU HD12 H 1 0.78 0.02 . 2 . . . . A 131 LEU HD12 . 30421 1 1331 . 1 1 131 131 LEU HD13 H 1 0.78 0.02 . 2 . . . . A 131 LEU HD13 . 30421 1 1332 . 1 1 131 131 LEU HD21 H 1 0.78 0.02 . 2 . . . . A 131 LEU HD21 . 30421 1 1333 . 1 1 131 131 LEU HD22 H 1 0.78 0.02 . 2 . . . . A 131 LEU HD22 . 30421 1 1334 . 1 1 131 131 LEU HD23 H 1 0.78 0.02 . 2 . . . . A 131 LEU HD23 . 30421 1 1335 . 1 1 131 131 LEU CA C 13 59.0 0.2 . 1 . . . . A 131 LEU CA . 30421 1 1336 . 1 1 131 131 LEU CB C 13 43.0 0.2 . 1 . . . . A 131 LEU CB . 30421 1 1337 . 1 1 131 131 LEU CG C 13 28.3 0.2 . 1 . . . . A 131 LEU CG . 30421 1 1338 . 1 1 131 131 LEU CD1 C 13 23.7 0.2 . 2 . . . . A 131 LEU CD1 . 30421 1 1339 . 1 1 131 131 LEU CD2 C 13 23.7 0.2 . 2 . . . . A 131 LEU CD2 . 30421 1 1340 . 1 1 131 131 LEU N N 15 118.2 0.2 . 1 . . . . A 131 LEU N . 30421 1 1341 . 1 1 132 132 ASP H H 1 8.02 0.02 . 1 . . . . A 132 ASP H . 30421 1 1342 . 1 1 132 132 ASP HA H 1 4.44 0.02 . 1 . . . . A 132 ASP HA . 30421 1 1343 . 1 1 132 132 ASP HB2 H 1 2.79 0.02 . 2 . . . . A 132 ASP HB2 . 30421 1 1344 . 1 1 132 132 ASP HB3 H 1 2.63 0.02 . 2 . . . . A 132 ASP HB3 . 30421 1 1345 . 1 1 132 132 ASP CA C 13 57.8 0.2 . 1 . . . . A 132 ASP CA . 30421 1 1346 . 1 1 132 132 ASP CB C 13 40.5 0.2 . 1 . . . . A 132 ASP CB . 30421 1 1347 . 1 1 132 132 ASP N N 15 119.0 0.2 . 1 . . . . A 132 ASP N . 30421 1 1348 . 1 1 133 133 LYS H H 1 7.10 0.02 . 1 . . . . A 133 LYS H . 30421 1 1349 . 1 1 133 133 LYS HA H 1 4.10 0.02 . 1 . . . . A 133 LYS HA . 30421 1 1350 . 1 1 133 133 LYS HB2 H 1 2.16 0.02 . 2 . . . . A 133 LYS HB2 . 30421 1 1351 . 1 1 133 133 LYS HB3 H 1 1.92 0.02 . 2 . . . . A 133 LYS HB3 . 30421 1 1352 . 1 1 133 133 LYS HG2 H 1 1.75 0.02 . 2 . . . . A 133 LYS HG2 . 30421 1 1353 . 1 1 133 133 LYS HG3 H 1 1.47 0.02 . 2 . . . . A 133 LYS HG3 . 30421 1 1354 . 1 1 133 133 LYS CA C 13 59.2 0.2 . 1 . . . . A 133 LYS CA . 30421 1 1355 . 1 1 133 133 LYS CB C 13 32.5 0.2 . 1 . . . . A 133 LYS CB . 30421 1 1356 . 1 1 133 133 LYS CG C 13 25.6 0.2 . 1 . . . . A 133 LYS CG . 30421 1 1357 . 1 1 133 133 LYS N N 15 117.7 0.2 . 1 . . . . A 133 LYS N . 30421 1 1358 . 1 1 134 134 LEU C C 13 178.9 0.2 . 1 . . . . A 134 LEU C . 30421 1 1359 . 1 1 134 134 LEU CB C 13 43.6 0.2 . 1 . . . . A 134 LEU CB . 30421 1 1360 . 1 1 135 135 ALA H H 1 8.78 0.02 . 1 . . . . A 135 ALA H . 30421 1 1361 . 1 1 135 135 ALA HA H 1 3.68 0.02 . 1 . . . . A 135 ALA HA . 30421 1 1362 . 1 1 135 135 ALA HB1 H 1 1.25 0.02 . 1 . . . . A 135 ALA HB1 . 30421 1 1363 . 1 1 135 135 ALA HB2 H 1 1.25 0.02 . 1 . . . . A 135 ALA HB2 . 30421 1 1364 . 1 1 135 135 ALA HB3 H 1 1.25 0.02 . 1 . . . . A 135 ALA HB3 . 30421 1 1365 . 1 1 135 135 ALA CA C 13 56.2 0.2 . 1 . . . . A 135 ALA CA . 30421 1 1366 . 1 1 135 135 ALA CB C 13 18.3 0.2 . 1 . . . . A 135 ALA CB . 30421 1 1367 . 1 1 135 135 ALA N N 15 120.6 0.2 . 1 . . . . A 135 ALA N . 30421 1 1368 . 1 1 136 136 VAL H H 1 6.73 0.02 . 1 . . . . A 136 VAL H . 30421 1 1369 . 1 1 136 136 VAL HA H 1 3.68 0.02 . 1 . . . . A 136 VAL HA . 30421 1 1370 . 1 1 136 136 VAL HB H 1 2.02 0.02 . 1 . . . . A 136 VAL HB . 30421 1 1371 . 1 1 136 136 VAL HG11 H 1 1.01 0.02 . 2 . . . . A 136 VAL HG11 . 30421 1 1372 . 1 1 136 136 VAL HG12 H 1 1.01 0.02 . 2 . . . . A 136 VAL HG12 . 30421 1 1373 . 1 1 136 136 VAL HG13 H 1 1.01 0.02 . 2 . . . . A 136 VAL HG13 . 30421 1 1374 . 1 1 136 136 VAL HG21 H 1 0.88 0.02 . 2 . . . . A 136 VAL HG21 . 30421 1 1375 . 1 1 136 136 VAL HG22 H 1 0.88 0.02 . 2 . . . . A 136 VAL HG22 . 30421 1 1376 . 1 1 136 136 VAL HG23 H 1 0.88 0.02 . 2 . . . . A 136 VAL HG23 . 30421 1 1377 . 1 1 136 136 VAL CA C 13 56.1 0.2 . 1 . . . . A 136 VAL CA . 30421 1 1378 . 1 1 136 136 VAL CB C 13 31.8 0.2 . 1 . . . . A 136 VAL CB . 30421 1 1379 . 1 1 136 136 VAL CG1 C 13 22.1 0.2 . 2 . . . . A 136 VAL CG1 . 30421 1 1380 . 1 1 136 136 VAL CG2 C 13 21.1 0.2 . 2 . . . . A 136 VAL CG2 . 30421 1 1381 . 1 1 136 136 VAL N N 15 113.8 0.2 . 1 . . . . A 136 VAL N . 30421 1 1382 . 1 1 137 137 LYS H H 1 6.97 0.02 . 1 . . . . A 137 LYS H . 30421 1 1383 . 1 1 137 137 LYS HA H 1 4.08 0.02 . 1 . . . . A 137 LYS HA . 30421 1 1384 . 1 1 137 137 LYS HB2 H 1 1.87 0.02 . 2 . . . . A 137 LYS HB2 . 30421 1 1385 . 1 1 137 137 LYS HB3 H 1 1.87 0.02 . 2 . . . . A 137 LYS HB3 . 30421 1 1386 . 1 1 137 137 LYS HG2 H 1 1.49 0.02 . 2 . . . . A 137 LYS HG2 . 30421 1 1387 . 1 1 137 137 LYS HG3 H 1 1.38 0.02 . 2 . . . . A 137 LYS HG3 . 30421 1 1388 . 1 1 137 137 LYS HD2 H 1 1.68 0.02 . 2 . . . . A 137 LYS HD2 . 30421 1 1389 . 1 1 137 137 LYS HD3 H 1 1.68 0.02 . 2 . . . . A 137 LYS HD3 . 30421 1 1390 . 1 1 137 137 LYS HE2 H 1 4.07 0.02 . 2 . . . . A 137 LYS HE2 . 30421 1 1391 . 1 1 137 137 LYS HE3 H 1 4.07 0.02 . 2 . . . . A 137 LYS HE3 . 30421 1 1392 . 1 1 137 137 LYS CA C 13 57.9 0.2 . 1 . . . . A 137 LYS CA . 30421 1 1393 . 1 1 137 137 LYS CB C 13 33.0 0.2 . 1 . . . . A 137 LYS CB . 30421 1 1394 . 1 1 137 137 LYS CG C 13 24.6 0.2 . 1 . . . . A 137 LYS CG . 30421 1 1395 . 1 1 137 137 LYS CD C 13 29.0 0.2 . 1 . . . . A 137 LYS CD . 30421 1 1396 . 1 1 137 137 LYS N N 15 116.6 0.2 . 1 . . . . A 137 LYS N . 30421 1 1397 . 1 1 138 138 LEU H H 1 8.28 0.02 . 1 . . . . A 138 LEU H . 30421 1 1398 . 1 1 138 138 LEU HG H 1 0.82 0.02 . 1 . . . . A 138 LEU HG . 30421 1 1399 . 1 1 138 138 LEU HD11 H 1 0.80 0.02 . 2 . . . . A 138 LEU HD11 . 30421 1 1400 . 1 1 138 138 LEU HD12 H 1 0.80 0.02 . 2 . . . . A 138 LEU HD12 . 30421 1 1401 . 1 1 138 138 LEU HD13 H 1 0.80 0.02 . 2 . . . . A 138 LEU HD13 . 30421 1 1402 . 1 1 138 138 LEU HD21 H 1 0.80 0.02 . 2 . . . . A 138 LEU HD21 . 30421 1 1403 . 1 1 138 138 LEU HD22 H 1 0.80 0.02 . 2 . . . . A 138 LEU HD22 . 30421 1 1404 . 1 1 138 138 LEU HD23 H 1 0.80 0.02 . 2 . . . . A 138 LEU HD23 . 30421 1 1405 . 1 1 138 138 LEU CA C 13 56.8 0.2 . 1 . . . . A 138 LEU CA . 30421 1 1406 . 1 1 138 138 LEU CB C 13 44.4 0.2 . 1 . . . . A 138 LEU CB . 30421 1 1407 . 1 1 138 138 LEU CG C 13 27.0 0.2 . 1 . . . . A 138 LEU CG . 30421 1 1408 . 1 1 138 138 LEU CD1 C 13 22.3 0.2 . 2 . . . . A 138 LEU CD1 . 30421 1 1409 . 1 1 138 138 LEU CD2 C 13 22.3 0.2 . 2 . . . . A 138 LEU CD2 . 30421 1 1410 . 1 1 138 138 LEU N N 15 115.4 0.2 . 1 . . . . A 138 LEU N . 30421 1 1411 . 1 1 139 139 ARG H H 1 8.14 0.02 . 1 . . . . A 139 ARG H . 30421 1 1412 . 1 1 139 139 ARG CA C 13 53.2 0.2 . 1 . . . . A 139 ARG CA . 30421 1 1413 . 1 1 139 139 ARG CB C 13 31.2 0.2 . 1 . . . . A 139 ARG CB . 30421 1 1414 . 1 1 139 139 ARG N N 15 117.5 0.2 . 1 . . . . A 139 ARG N . 30421 1 1415 . 1 1 140 140 PRO HA H 1 4.33 0.02 . 1 . . . . A 140 PRO HA . 30421 1 1416 . 1 1 140 140 PRO HB2 H 1 2.35 0.02 . 2 . . . . A 140 PRO HB2 . 30421 1 1417 . 1 1 140 140 PRO HB3 H 1 1.95 0.02 . 2 . . . . A 140 PRO HB3 . 30421 1 1418 . 1 1 140 140 PRO HG2 H 1 2.02 0.02 . 2 . . . . A 140 PRO HG2 . 30421 1 1419 . 1 1 140 140 PRO HG3 H 1 1.47 0.02 . 2 . . . . A 140 PRO HG3 . 30421 1 1420 . 1 1 140 140 PRO HD2 H 1 3.55 0.02 . 2 . . . . A 140 PRO HD2 . 30421 1 1421 . 1 1 140 140 PRO HD3 H 1 3.23 0.02 . 2 . . . . A 140 PRO HD3 . 30421 1 1422 . 1 1 140 140 PRO CA C 13 65.2 0.2 . 1 . . . . A 140 PRO CA . 30421 1 1423 . 1 1 140 140 PRO CB C 13 31.0 0.2 . 1 . . . . A 140 PRO CB . 30421 1 1424 . 1 1 140 140 PRO CG C 13 27.5 0.2 . 1 . . . . A 140 PRO CG . 30421 1 1425 . 1 1 140 140 PRO CD C 13 50.2 0.2 . 1 . . . . A 140 PRO CD . 30421 1 1426 . 1 1 141 141 ALA H H 1 8.11 0.02 . 1 . . . . A 141 ALA H . 30421 1 1427 . 1 1 141 141 ALA HA H 1 4.23 0.02 . 1 . . . . A 141 ALA HA . 30421 1 1428 . 1 1 141 141 ALA HB1 H 1 1.45 0.02 . 1 . . . . A 141 ALA HB1 . 30421 1 1429 . 1 1 141 141 ALA HB2 H 1 1.45 0.02 . 1 . . . . A 141 ALA HB2 . 30421 1 1430 . 1 1 141 141 ALA HB3 H 1 1.45 0.02 . 1 . . . . A 141 ALA HB3 . 30421 1 1431 . 1 1 141 141 ALA C C 13 180.1 0.2 . 1 . . . . A 141 ALA C . 30421 1 1432 . 1 1 141 141 ALA CA C 13 54.4 0.2 . 1 . . . . A 141 ALA CA . 30421 1 1433 . 1 1 141 141 ALA CB C 13 18.2 0.2 . 1 . . . . A 141 ALA CB . 30421 1 1434 . 1 1 141 141 ALA N N 15 118.8 0.2 . 1 . . . . A 141 ALA N . 30421 1 1435 . 1 1 142 142 GLU H H 1 7.87 0.02 . 1 . . . . A 142 GLU H . 30421 1 1436 . 1 1 142 142 GLU HA H 1 4.27 0.02 . 1 . . . . A 142 GLU HA . 30421 1 1437 . 1 1 142 142 GLU HB2 H 1 2.32 0.02 . 2 . . . . A 142 GLU HB2 . 30421 1 1438 . 1 1 142 142 GLU HB3 H 1 2.05 0.02 . 2 . . . . A 142 GLU HB3 . 30421 1 1439 . 1 1 142 142 GLU HG2 H 1 2.46 0.02 . 2 . . . . A 142 GLU HG2 . 30421 1 1440 . 1 1 142 142 GLU HG3 H 1 2.46 0.02 . 2 . . . . A 142 GLU HG3 . 30421 1 1441 . 1 1 142 142 GLU CA C 13 57.9 0.2 . 1 . . . . A 142 GLU CA . 30421 1 1442 . 1 1 142 142 GLU CB C 13 32.1 0.2 . 1 . . . . A 142 GLU CB . 30421 1 1443 . 1 1 142 142 GLU CG C 13 37.1 0.2 . 1 . . . . A 142 GLU CG . 30421 1 1444 . 1 1 142 142 GLU N N 15 117.2 0.2 . 1 . . . . A 142 GLU N . 30421 1 1445 . 1 1 143 143 THR H H 1 7.59 0.02 . 1 . . . . A 143 THR H . 30421 1 1446 . 1 1 143 143 THR HB H 1 4.11 0.02 . 1 . . . . A 143 THR HB . 30421 1 1447 . 1 1 143 143 THR HG1 H 1 4.10 0.02 . 1 . . . . A 143 THR HG1 . 30421 1 1448 . 1 1 143 143 THR HG21 H 1 0.39 0.02 . 1 . . . . A 143 THR HG21 . 30421 1 1449 . 1 1 143 143 THR HG22 H 1 0.39 0.02 . 1 . . . . A 143 THR HG22 . 30421 1 1450 . 1 1 143 143 THR HG23 H 1 0.39 0.02 . 1 . . . . A 143 THR HG23 . 30421 1 1451 . 1 1 143 143 THR C C 13 175.6 0.2 . 1 . . . . A 143 THR C . 30421 1 1452 . 1 1 143 143 THR CA C 13 62.6 0.2 . 1 . . . . A 143 THR CA . 30421 1 1453 . 1 1 143 143 THR CB C 13 69.5 0.2 . 1 . . . . A 143 THR CB . 30421 1 1454 . 1 1 143 143 THR CG2 C 13 20.8 0.2 . 1 . . . . A 143 THR CG2 . 30421 1 1455 . 1 1 143 143 THR N N 15 107.7 0.2 . 1 . . . . A 143 THR N . 30421 1 1456 . 1 1 144 144 GLN H H 1 7.72 0.02 . 1 . . . . A 144 GLN H . 30421 1 1457 . 1 1 144 144 GLN HA H 1 4.27 0.02 . 1 . . . . A 144 GLN HA . 30421 1 1458 . 1 1 144 144 GLN HB2 H 1 2.13 0.02 . 2 . . . . A 144 GLN HB2 . 30421 1 1459 . 1 1 144 144 GLN HB3 H 1 2.13 0.02 . 2 . . . . A 144 GLN HB3 . 30421 1 1460 . 1 1 144 144 GLN HG2 H 1 2.43 0.02 . 2 . . . . A 144 GLN HG2 . 30421 1 1461 . 1 1 144 144 GLN HG3 H 1 2.43 0.02 . 2 . . . . A 144 GLN HG3 . 30421 1 1462 . 1 1 144 144 GLN HE21 H 1 7.49 0.02 . 2 . . . . A 144 GLN HE21 . 30421 1 1463 . 1 1 144 144 GLN HE22 H 1 6.86 0.02 . 2 . . . . A 144 GLN HE22 . 30421 1 1464 . 1 1 144 144 GLN CA C 13 56.4 0.2 . 1 . . . . A 144 GLN CA . 30421 1 1465 . 1 1 144 144 GLN CB C 13 29.0 0.2 . 1 . . . . A 144 GLN CB . 30421 1 1466 . 1 1 144 144 GLN CG C 13 33.9 0.2 . 1 . . . . A 144 GLN CG . 30421 1 1467 . 1 1 144 144 GLN N N 15 120.8 0.2 . 1 . . . . A 144 GLN N . 30421 1 1468 . 1 1 144 144 GLN NE2 N 15 112.3 0.2 . 1 . . . . A 144 GLN NE2 . 30421 1 1469 . 1 1 145 145 ALA H H 1 8.03 0.02 . 1 . . . . A 145 ALA H . 30421 1 1470 . 1 1 145 145 ALA HA H 1 4.28 0.02 . 1 . . . . A 145 ALA HA . 30421 1 1471 . 1 1 145 145 ALA HB1 H 1 1.43 0.02 . 1 . . . . A 145 ALA HB1 . 30421 1 1472 . 1 1 145 145 ALA HB2 H 1 1.43 0.02 . 1 . . . . A 145 ALA HB2 . 30421 1 1473 . 1 1 145 145 ALA HB3 H 1 1.43 0.02 . 1 . . . . A 145 ALA HB3 . 30421 1 1474 . 1 1 145 145 ALA CA C 13 52.9 0.2 . 1 . . . . A 145 ALA CA . 30421 1 1475 . 1 1 145 145 ALA CB C 13 19.0 0.2 . 1 . . . . A 145 ALA CB . 30421 1 1476 . 1 1 145 145 ALA N N 15 123.6 0.2 . 1 . . . . A 145 ALA N . 30421 1 1477 . 1 1 146 146 ARG H H 1 8.23 0.02 . 1 . . . . A 146 ARG H . 30421 1 1478 . 1 1 146 146 ARG HA H 1 4.35 0.02 . 1 . . . . A 146 ARG HA . 30421 1 1479 . 1 1 146 146 ARG HB2 H 1 1.90 0.02 . 2 . . . . A 146 ARG HB2 . 30421 1 1480 . 1 1 146 146 ARG HB3 H 1 1.81 0.02 . 2 . . . . A 146 ARG HB3 . 30421 1 1481 . 1 1 146 146 ARG HG2 H 1 1.68 0.02 . 2 . . . . A 146 ARG HG2 . 30421 1 1482 . 1 1 146 146 ARG HG3 H 1 1.68 0.02 . 2 . . . . A 146 ARG HG3 . 30421 1 1483 . 1 1 146 146 ARG HD2 H 1 3.21 0.02 . 2 . . . . A 146 ARG HD2 . 30421 1 1484 . 1 1 146 146 ARG HD3 H 1 3.21 0.02 . 2 . . . . A 146 ARG HD3 . 30421 1 1485 . 1 1 146 146 ARG CA C 13 55.9 0.2 . 1 . . . . A 146 ARG CA . 30421 1 1486 . 1 1 146 146 ARG CB C 13 30.5 0.2 . 1 . . . . A 146 ARG CB . 30421 1 1487 . 1 1 146 146 ARG CG C 13 27.1 0.2 . 1 . . . . A 146 ARG CG . 30421 1 1488 . 1 1 146 146 ARG CD C 13 43.2 0.2 . 1 . . . . A 146 ARG CD . 30421 1 1489 . 1 1 146 146 ARG N N 15 119.8 0.2 . 1 . . . . A 146 ARG N . 30421 1 1490 . 1 1 147 147 ARG H H 1 8.41 0.02 . 1 . . . . A 147 ARG H . 30421 1 1491 . 1 1 147 147 ARG HA H 1 4.36 0.02 . 1 . . . . A 147 ARG HA . 30421 1 1492 . 1 1 147 147 ARG HB2 H 1 1.90 0.02 . 2 . . . . A 147 ARG HB2 . 30421 1 1493 . 1 1 147 147 ARG HB3 H 1 1.82 0.02 . 2 . . . . A 147 ARG HB3 . 30421 1 1494 . 1 1 147 147 ARG HG2 H 1 1.67 0.02 . 2 . . . . A 147 ARG HG2 . 30421 1 1495 . 1 1 147 147 ARG HG3 H 1 1.67 0.02 . 2 . . . . A 147 ARG HG3 . 30421 1 1496 . 1 1 147 147 ARG HD2 H 1 3.21 0.02 . 2 . . . . A 147 ARG HD2 . 30421 1 1497 . 1 1 147 147 ARG HD3 H 1 3.21 0.02 . 2 . . . . A 147 ARG HD3 . 30421 1 1498 . 1 1 147 147 ARG CA C 13 56.2 0.2 . 1 . . . . A 147 ARG CA . 30421 1 1499 . 1 1 147 147 ARG CB C 13 30.7 0.2 . 1 . . . . A 147 ARG CB . 30421 1 1500 . 1 1 147 147 ARG CG C 13 26.9 0.2 . 1 . . . . A 147 ARG CG . 30421 1 1501 . 1 1 147 147 ARG CD C 13 43.1 0.2 . 1 . . . . A 147 ARG CD . 30421 1 1502 . 1 1 147 147 ARG N N 15 122.7 0.2 . 1 . . . . A 147 ARG N . 30421 1 1503 . 1 1 148 148 GLY H H 1 8.47 0.02 . 1 . . . . A 148 GLY H . 30421 1 1504 . 1 1 148 148 GLY HA2 H 1 3.95 0.02 . 2 . . . . A 148 GLY HA2 . 30421 1 1505 . 1 1 148 148 GLY HA3 H 1 3.95 0.02 . 2 . . . . A 148 GLY HA3 . 30421 1 1506 . 1 1 148 148 GLY CA C 13 45.2 0.2 . 1 . . . . A 148 GLY CA . 30421 1 1507 . 1 1 148 148 GLY N N 15 122.4 0.2 . 1 . . . . A 148 GLY N . 30421 1 1508 . 1 1 149 149 ALA H H 1 7.90 0.02 . 1 . . . . A 149 ALA H . 30421 1 1509 . 1 1 149 149 ALA HA H 1 4.11 0.02 . 1 . . . . A 149 ALA HA . 30421 1 1510 . 1 1 149 149 ALA HB1 H 1 1.34 0.02 . 1 . . . . A 149 ALA HB1 . 30421 1 1511 . 1 1 149 149 ALA HB2 H 1 1.34 0.02 . 1 . . . . A 149 ALA HB2 . 30421 1 1512 . 1 1 149 149 ALA HB3 H 1 1.34 0.02 . 1 . . . . A 149 ALA HB3 . 30421 1 1513 . 1 1 149 149 ALA CA C 13 53.8 0.2 . 1 . . . . A 149 ALA CA . 30421 1 1514 . 1 1 149 149 ALA CB C 13 20.1 0.2 . 1 . . . . A 149 ALA CB . 30421 1 1515 . 1 1 149 149 ALA N N 15 129.2 0.2 . 1 . . . . A 149 ALA N . 30421 1 stop_ save_