data_25484 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 25484 _Entry.Title ; Characterization of the p300 Taz2-p53 TAD2 Complex and Comparison with the p300 Taz2-p53 TAD1 Complex ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2015-02-11 _Entry.Accession_date 2015-02-11 _Entry.Last_release_date 2016-01-20 _Entry.Original_release_date 2016-01-20 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.81 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Lisa 'Miller Jenkins' . M. . 25484 2 Hanqiao Feng . . . 25484 3 Stewart Durell . R. . 25484 4 Harichandra Tagad . D. . 25484 5 Sharlyn Mazur . J. . 25484 6 Joseph Tropea . E. . 25484 7 Yawen Bai . . . 25484 8 Ettore Appella . . . 25484 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 'not applicable' 'not applicable' . 25484 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'Protein/Peptide complex' . 25484 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 2 25484 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 442 25484 '15N chemical shifts' 99 25484 '1H chemical shifts' 729 25484 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2016-01-20 2015-02-11 update BMRB 'update entry citation' 25484 1 . . 2015-03-23 2015-02-11 original author 'original release' 25484 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2K8F 'Structural Basis for p300 Taz2-p53 TAD1 Binding and Modulation by Phosphorylation.' 25484 PDB 2MZD 'BMRB Entry Tracking System' 25484 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 25484 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 25753752 _Citation.Full_citation . _Citation.Title ; Characterization of the p300 Taz2-p53 TAD2 Complex and Comparison with the p300 Taz2-p53 TAD1 Complex ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Biochemistry _Citation.Journal_name_full . _Citation.Journal_volume 54 _Citation.Journal_issue 11 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 2001 _Citation.Page_last 2010 _Citation.Year 2015 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Lisa 'Miller Jenkins' . M. . 25484 1 2 Hanqiao Feng . . . 25484 1 3 Stewart Durell . R. . 25484 1 4 Harichandra Tagad . D. . 25484 1 5 Sharlyn Mazur . J. . 25484 1 6 Joseph Tropea . E. . 25484 1 7 Yawen Bai . . . 25484 1 8 Ettore Appella . . . 25484 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 25484 _Assembly.ID 1 _Assembly.Name 'p300 Taz2-p53 TAD2 Complex' _Assembly.BMRB_code . _Assembly.Number_of_components 2 _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 $Taz2_domain_of_Histone_Acetyltransferase_p300 A . yes native no no . . . 25484 1 2 entity_2 2 $TAD2_sub-domain_of_Cellular_Tumor_Antigen_p53 B . yes native no no . . . 25484 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Taz2_domain_of_Histone_Acetyltransferase_p300 _Entity.Sf_category entity _Entity.Sf_framecode Taz2_domain_of_Histone_Acetyltransferase_p300 _Entity.Entry_ID 25484 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Taz2_domain_of_Histone_Acetyltransferase_p300 _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 ; ATQSPGDSRRLSIQRAIQSL VHAAQCRNANCSLPSCQKMK RVVQHTKGCKRKTNGGCPIC KQLIALAAYHAKHCQENKCP VPFCLNIKQK ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 90 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state . _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment 'Taz2 p300(1723-1812)' _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 9963.838 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 . ALA . 25484 1 2 . THR . 25484 1 3 . GLN . 25484 1 4 . SER . 25484 1 5 . PRO . 25484 1 6 . GLY . 25484 1 7 . ASP . 25484 1 8 . SER . 25484 1 9 . ARG . 25484 1 10 . ARG . 25484 1 11 . LEU . 25484 1 12 . SER . 25484 1 13 . ILE . 25484 1 14 . GLN . 25484 1 15 . ARG . 25484 1 16 . ALA . 25484 1 17 . ILE . 25484 1 18 . GLN . 25484 1 19 . SER . 25484 1 20 . LEU . 25484 1 21 . VAL . 25484 1 22 . HIS . 25484 1 23 . ALA . 25484 1 24 . ALA . 25484 1 25 . GLN . 25484 1 26 . CYS . 25484 1 27 . ARG . 25484 1 28 . ASN . 25484 1 29 . ALA . 25484 1 30 . ASN . 25484 1 31 . CYS . 25484 1 32 . SER . 25484 1 33 . LEU . 25484 1 34 . PRO . 25484 1 35 . SER . 25484 1 36 . CYS . 25484 1 37 . GLN . 25484 1 38 . LYS . 25484 1 39 . MET . 25484 1 40 . LYS . 25484 1 41 . ARG . 25484 1 42 . VAL . 25484 1 43 . VAL . 25484 1 44 . GLN . 25484 1 45 . HIS . 25484 1 46 . THR . 25484 1 47 . LYS . 25484 1 48 . GLY . 25484 1 49 . CYS . 25484 1 50 . LYS . 25484 1 51 . ARG . 25484 1 52 . LYS . 25484 1 53 . THR . 25484 1 54 . ASN . 25484 1 55 . GLY . 25484 1 56 . GLY . 25484 1 57 . CYS . 25484 1 58 . PRO . 25484 1 59 . ILE . 25484 1 60 . CYS . 25484 1 61 . LYS . 25484 1 62 . GLN . 25484 1 63 . LEU . 25484 1 64 . ILE . 25484 1 65 . ALA . 25484 1 66 . LEU . 25484 1 67 . ALA . 25484 1 68 . ALA . 25484 1 69 . TYR . 25484 1 70 . HIS . 25484 1 71 . ALA . 25484 1 72 . LYS . 25484 1 73 . HIS . 25484 1 74 . CYS . 25484 1 75 . GLN . 25484 1 76 . GLU . 25484 1 77 . ASN . 25484 1 78 . LYS . 25484 1 79 . CYS . 25484 1 80 . PRO . 25484 1 81 . VAL . 25484 1 82 . PRO . 25484 1 83 . PHE . 25484 1 84 . CYS . 25484 1 85 . LEU . 25484 1 86 . ASN . 25484 1 87 . ILE . 25484 1 88 . LYS . 25484 1 89 . GLN . 25484 1 90 . LYS . 25484 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 . ALA 1 1 25484 1 . THR 2 2 25484 1 . GLN 3 3 25484 1 . SER 4 4 25484 1 . PRO 5 5 25484 1 . GLY 6 6 25484 1 . ASP 7 7 25484 1 . SER 8 8 25484 1 . ARG 9 9 25484 1 . ARG 10 10 25484 1 . LEU 11 11 25484 1 . SER 12 12 25484 1 . ILE 13 13 25484 1 . GLN 14 14 25484 1 . ARG 15 15 25484 1 . ALA 16 16 25484 1 . ILE 17 17 25484 1 . GLN 18 18 25484 1 . SER 19 19 25484 1 . LEU 20 20 25484 1 . VAL 21 21 25484 1 . HIS 22 22 25484 1 . ALA 23 23 25484 1 . ALA 24 24 25484 1 . GLN 25 25 25484 1 . CYS 26 26 25484 1 . ARG 27 27 25484 1 . ASN 28 28 25484 1 . ALA 29 29 25484 1 . ASN 30 30 25484 1 . CYS 31 31 25484 1 . SER 32 32 25484 1 . LEU 33 33 25484 1 . PRO 34 34 25484 1 . SER 35 35 25484 1 . CYS 36 36 25484 1 . GLN 37 37 25484 1 . LYS 38 38 25484 1 . MET 39 39 25484 1 . LYS 40 40 25484 1 . ARG 41 41 25484 1 . VAL 42 42 25484 1 . VAL 43 43 25484 1 . GLN 44 44 25484 1 . HIS 45 45 25484 1 . THR 46 46 25484 1 . LYS 47 47 25484 1 . GLY 48 48 25484 1 . CYS 49 49 25484 1 . LYS 50 50 25484 1 . ARG 51 51 25484 1 . LYS 52 52 25484 1 . THR 53 53 25484 1 . ASN 54 54 25484 1 . GLY 55 55 25484 1 . GLY 56 56 25484 1 . CYS 57 57 25484 1 . PRO 58 58 25484 1 . ILE 59 59 25484 1 . CYS 60 60 25484 1 . LYS 61 61 25484 1 . GLN 62 62 25484 1 . LEU 63 63 25484 1 . ILE 64 64 25484 1 . ALA 65 65 25484 1 . LEU 66 66 25484 1 . ALA 67 67 25484 1 . ALA 68 68 25484 1 . TYR 69 69 25484 1 . HIS 70 70 25484 1 . ALA 71 71 25484 1 . LYS 72 72 25484 1 . HIS 73 73 25484 1 . CYS 74 74 25484 1 . GLN 75 75 25484 1 . GLU 76 76 25484 1 . ASN 77 77 25484 1 . LYS 78 78 25484 1 . CYS 79 79 25484 1 . PRO 80 80 25484 1 . VAL 81 81 25484 1 . PRO 82 82 25484 1 . PHE 83 83 25484 1 . CYS 84 84 25484 1 . LEU 85 85 25484 1 . ASN 86 86 25484 1 . ILE 87 87 25484 1 . LYS 88 88 25484 1 . GLN 89 89 25484 1 . LYS 90 90 25484 1 stop_ save_ save_TAD2_sub-domain_of_Cellular_Tumor_Antigen_p53 _Entity.Sf_category entity _Entity.Sf_framecode TAD2_sub-domain_of_Cellular_Tumor_Antigen_p53 _Entity.Entry_ID 25484 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name TAD2_sub-domain_of_Cellular_Tumor_Antigen_p53 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID B _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; LPSQAMDDLMLSPDDIEQWF TEDPG ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 25 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment 'TAD2 p53(35-59)' _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 2851.098 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 . LEU . 25484 2 2 . PRO . 25484 2 3 . SER . 25484 2 4 . GLN . 25484 2 5 . ALA . 25484 2 6 . MET . 25484 2 7 . ASP . 25484 2 8 . ASP . 25484 2 9 . LEU . 25484 2 10 . MET . 25484 2 11 . LEU . 25484 2 12 . SER . 25484 2 13 . PRO . 25484 2 14 . ASP . 25484 2 15 . ASP . 25484 2 16 . ILE . 25484 2 17 . GLU . 25484 2 18 . GLN . 25484 2 19 . TRP . 25484 2 20 . PHE . 25484 2 21 . THR . 25484 2 22 . GLU . 25484 2 23 . ASP . 25484 2 24 . PRO . 25484 2 25 . GLY . 25484 2 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 . LEU 1 1 25484 2 . PRO 2 2 25484 2 . SER 3 3 25484 2 . GLN 4 4 25484 2 . ALA 5 5 25484 2 . MET 6 6 25484 2 . ASP 7 7 25484 2 . ASP 8 8 25484 2 . LEU 9 9 25484 2 . MET 10 10 25484 2 . LEU 11 11 25484 2 . SER 12 12 25484 2 . PRO 13 13 25484 2 . ASP 14 14 25484 2 . ASP 15 15 25484 2 . ILE 16 16 25484 2 . GLU 17 17 25484 2 . GLN 18 18 25484 2 . TRP 19 19 25484 2 . PHE 20 20 25484 2 . THR 21 21 25484 2 . GLU 22 22 25484 2 . ASP 23 23 25484 2 . PRO 24 24 25484 2 . GLY 25 25 25484 2 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 25484 _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 $Taz2_domain_of_Histone_Acetyltransferase_p300 . . organism . 'Homo sapiens' . . . . . Homo sapiens . . . . . . . . . . . . . 25484 1 2 2 $TAD2_sub-domain_of_Cellular_Tumor_Antigen_p53 . . organism . 'Homo sapiens' . . . . . Homo sapiens . . . . . . . . . . . . . 25484 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 25484 _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 $Taz2_domain_of_Histone_Acetyltransferase_p300 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pJT57 . . . 25484 1 2 2 $TAD2_sub-domain_of_Cellular_Tumor_Antigen_p53 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pGEX4T-1 . . . 25484 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 25484 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Taz2 domain of Histone Acetyltransferase p300' 'natural abundance' . . 1 $Taz2_domain_of_Histone_Acetyltransferase_p300 . . 1.1 . . mM . . . . 25484 1 2 'TAD2 sub-domain of Cellular Tumor Antigen p53' '[U-100% 13C; U-100% 15N]' . . 2 $TAD2_sub-domain_of_Cellular_Tumor_Antigen_p53 . . 1.0 . . mM . . . . 25484 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 25484 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Taz2 domain of Histone Acetyltransferase p300' '[U-100% 15N]' . . 1 $Taz2_domain_of_Histone_Acetyltransferase_p300 . . 1.0 . . mM . . . . 25484 2 2 'TAD2 sub-domain of Cellular Tumor Antigen p53' 'natural abundance' . . 2 $TAD2_sub-domain_of_Cellular_Tumor_Antigen_p53 . . 1.1 . . mM . . . . 25484 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 25484 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Taz2 domain of Histone Acetyltransferase p300' '[U-100% 13C; U-100% 15N]' . . 1 $Taz2_domain_of_Histone_Acetyltransferase_p300 . . 1.0 . . mM . . . . 25484 3 2 'TAD2 sub-domain of Cellular Tumor Antigen p53' 'natural abundance' . . 2 $TAD2_sub-domain_of_Cellular_Tumor_Antigen_p53 . . 1.1 . . mM . . . . 25484 3 stop_ save_ save_sample_4 _Sample.Sf_category sample _Sample.Sf_framecode sample_4 _Sample.Entry_ID 25484 _Sample.ID 4 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Taz2 domain of Histone Acetyltransferase p300' 'natural abundance' . . 1 $Taz2_domain_of_Histone_Acetyltransferase_p300 . . 1.0 . . mM . . . . 25484 4 2 'TAD2 sub-domain of Cellular Tumor Antigen p53' 'natural abundance' . . 2 $TAD2_sub-domain_of_Cellular_Tumor_Antigen_p53 . . 1.1 . . mM . . . . 25484 4 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 25484 _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' 200 . mM 25484 1 pH 6.3 . pH 25484 1 pressure 1 . atm 25484 1 temperature 273 . K 25484 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 25484 _Software.ID 1 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 25484 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 25484 1 stop_ save_ save_NMRDraw _Software.Sf_category software _Software.Sf_framecode NMRDraw _Software.Entry_ID 25484 _Software.ID 2 _Software.Name NMRDraw _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 25484 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 25484 2 stop_ save_ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 25484 _Software.ID 3 _Software.Name NMRView _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . 25484 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 25484 3 stop_ save_ save_TALOS _Software.Sf_category software _Software.Sf_framecode TALOS _Software.Entry_ID 25484 _Software.ID 4 _Software.Name TALOS _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Cornilescu, Delaglio and Bax' . . 25484 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 25484 4 stop_ save_ save_CNS _Software.Sf_category software _Software.Sf_framecode CNS _Software.Entry_ID 25484 _Software.ID 5 _Software.Name CNS _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Brunger, Adams, Clore, Gros, Nilges and Read' . . 25484 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 25484 5 stop_ save_ save_ProcheckNMR _Software.Sf_category software _Software.Sf_framecode ProcheckNMR _Software.Entry_ID 25484 _Software.ID 6 _Software.Name ProcheckNMR _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Laskowski and MacArthur' . . 25484 6 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 25484 6 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 25484 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details 'Equipped with pulsed-field gradient units and triple resonance probes.' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 25484 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 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 25484 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 500 'Equipped with pulsed-field gradient units and triple resonance probes.' . . 25484 1 2 spectrometer_2 Bruker DRX . 700 . . . 25484 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 25484 _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 . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 25484 1 2 '2D 1H-1H NOESY' no . . . . . . . . . . 4 $sample_4 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 25484 1 3 '3D CBCA(CO)NH' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 25484 1 4 '3D HNCACB' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 25484 1 5 '3D HNCO' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 25484 1 6 '3D HN(CA)CO' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 25484 1 7 '3D HNCA' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 25484 1 8 '3D H(CCO)NH' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 25484 1 9 '3D HCCH-TOCSY' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 25484 1 10 '3D HNHA' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 25484 1 11 '3D 1H-15N NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 25484 1 12 '3D 1H-13C NOESY' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 25484 1 13 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 25484 1 14 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 25484 1 15 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 25484 1 16 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 25484 1 17 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 25484 1 18 '3D HN(CA)CO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 25484 1 19 '3D H(CCO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 25484 1 20 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 25484 1 21 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 25484 1 22 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 25484 1 23 '3D HBHA(CO)NH' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 25484 1 24 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 25484 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 25484 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . . . . . 25484 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 25484 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 25484 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 25484 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 25484 1 3 '3D CBCA(CO)NH' . . . 25484 1 4 '3D HNCACB' . . . 25484 1 5 '3D HNCO' . . . 25484 1 6 '3D HN(CA)CO' . . . 25484 1 7 '3D HNCA' . . . 25484 1 8 '3D H(CCO)NH' . . . 25484 1 9 '3D HCCH-TOCSY' . . . 25484 1 10 '3D HNHA' . . . 25484 1 23 '3D HBHA(CO)NH' . . . 25484 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 2 2 THR HA H 1 4.415 0.04 . 1 . . . A 2 THR HA . 25484 1 2 . 1 1 2 2 THR HB H 1 4.220 0.04 . 1 . . . A 2 THR HB . 25484 1 3 . 1 1 2 2 THR HG21 H 1 1.269 0.04 . 1 . . . A 2 THR HG21 . 25484 1 4 . 1 1 2 2 THR HG22 H 1 1.269 0.04 . 1 . . . A 2 THR HG22 . 25484 1 5 . 1 1 2 2 THR HG23 H 1 1.269 0.04 . 1 . . . A 2 THR HG23 . 25484 1 6 . 1 1 2 2 THR C C 13 174.580 0.04 . 1 . . . A 2 THR C . 25484 1 7 . 1 1 2 2 THR CA C 13 62.450 0.04 . 1 . . . A 2 THR CA . 25484 1 8 . 1 1 2 2 THR CB C 13 70.050 0.04 . 1 . . . A 2 THR CB . 25484 1 9 . 1 1 2 2 THR CG2 C 13 21.250 0.04 . 1 . . . A 2 THR CG2 . 25484 1 10 . 1 1 3 3 GLN H H 1 8.536 0.04 . 1 . . . A 3 GLN H . 25484 1 11 . 1 1 3 3 GLN HA H 1 4.480 0.04 . 1 . . . A 3 GLN HA . 25484 1 12 . 1 1 3 3 GLN HB2 H 1 2.035 0.04 . 1 . . . A 3 GLN HB2 . 25484 1 13 . 1 1 3 3 GLN HB3 H 1 2.135 0.04 . 1 . . . A 3 GLN HB3 . 25484 1 14 . 1 1 3 3 GLN HG2 H 1 2.405 0.04 . 2 . . . A 3 GLN HG2 . 25484 1 15 . 1 1 3 3 GLN HG3 H 1 2.405 0.04 . 2 . . . A 3 GLN HG3 . 25484 1 16 . 1 1 3 3 GLN C C 13 176.040 0.04 . 1 . . . A 3 GLN C . 25484 1 17 . 1 1 3 3 GLN CA C 13 55.950 0.04 . 1 . . . A 3 GLN CA . 25484 1 18 . 1 1 3 3 GLN CB C 13 30.550 0.04 . 1 . . . A 3 GLN CB . 25484 1 19 . 1 1 3 3 GLN CG C 13 34.350 0.04 . 1 . . . A 3 GLN CG . 25484 1 20 . 1 1 3 3 GLN N N 15 123.423 0.04 . 1 . . . A 3 GLN N . 25484 1 21 . 1 1 4 4 SER H H 1 8.150 0.04 . 1 . . . A 4 SER H . 25484 1 22 . 1 1 4 4 SER HA H 1 4.834 0.04 . 1 . . . A 4 SER HA . 25484 1 23 . 1 1 4 4 SER HB2 H 1 3.937 0.04 . 2 . . . A 4 SER HB2 . 25484 1 24 . 1 1 4 4 SER HB3 H 1 3.937 0.04 . 2 . . . A 4 SER HB3 . 25484 1 25 . 1 1 4 4 SER C C 13 173.640 0.04 . 1 . . . A 4 SER C . 25484 1 26 . 1 1 4 4 SER CA C 13 56.250 0.04 . 1 . . . A 4 SER CA . 25484 1 27 . 1 1 4 4 SER CB C 13 63.400 0.04 . 1 . . . A 4 SER CB . 25484 1 28 . 1 1 4 4 SER N N 15 119.390 0.04 . 1 . . . A 4 SER N . 25484 1 29 . 1 1 5 5 PRO HA H 1 4.480 0.04 . 1 . . . A 5 PRO HA . 25484 1 30 . 1 1 5 5 PRO HB2 H 1 2.020 0.04 . 1 . . . A 5 PRO HB2 . 25484 1 31 . 1 1 5 5 PRO HB3 H 1 2.370 0.04 . 1 . . . A 5 PRO HB3 . 25484 1 32 . 1 1 5 5 PRO HG2 H 1 2.070 0.04 . 1 . . . A 5 PRO HG2 . 25484 1 33 . 1 1 5 5 PRO HG3 H 1 2.120 0.04 . 1 . . . A 5 PRO HG3 . 25484 1 34 . 1 1 5 5 PRO HD2 H 1 3.830 0.04 . 1 . . . A 5 PRO HD2 . 25484 1 35 . 1 1 5 5 PRO HD3 H 1 3.890 0.04 . 1 . . . A 5 PRO HD3 . 25484 1 36 . 1 1 5 5 PRO C C 13 178.180 0.04 . 1 . . . A 5 PRO C . 25484 1 37 . 1 1 5 5 PRO CA C 13 64.040 0.04 . 1 . . . A 5 PRO CA . 25484 1 38 . 1 1 5 5 PRO CB C 13 32.120 0.04 . 1 . . . A 5 PRO CB . 25484 1 39 . 1 1 5 5 PRO CG C 13 27.350 0.04 . 1 . . . A 5 PRO CG . 25484 1 40 . 1 1 5 5 PRO CD C 13 50.950 0.04 . 1 . . . A 5 PRO CD . 25484 1 41 . 1 1 6 6 GLY H H 1 8.470 0.04 . 1 . . . A 6 GLY H . 25484 1 42 . 1 1 6 6 GLY HA2 H 1 4.010 0.04 . 2 . . . A 6 GLY HA2 . 25484 1 43 . 1 1 6 6 GLY HA3 H 1 4.010 0.04 . 2 . . . A 6 GLY HA3 . 25484 1 44 . 1 1 6 6 GLY C C 13 174.930 0.04 . 1 . . . A 6 GLY C . 25484 1 45 . 1 1 6 6 GLY CA C 13 45.750 0.04 . 1 . . . A 6 GLY CA . 25484 1 46 . 1 1 6 6 GLY N N 15 108.600 0.04 . 1 . . . A 6 GLY N . 25484 1 47 . 1 1 7 7 ASP H H 1 8.130 0.04 . 1 . . . A 7 ASP H . 25484 1 48 . 1 1 7 7 ASP HA H 1 4.660 0.04 . 1 . . . A 7 ASP HA . 25484 1 49 . 1 1 7 7 ASP HB2 H 1 2.772 0.04 . 2 . . . A 7 ASP HB2 . 25484 1 50 . 1 1 7 7 ASP HB3 H 1 2.772 0.04 . 2 . . . A 7 ASP HB3 . 25484 1 51 . 1 1 7 7 ASP C C 13 177.580 0.04 . 1 . . . A 7 ASP C . 25484 1 52 . 1 1 7 7 ASP CA C 13 55.200 0.04 . 1 . . . A 7 ASP CA . 25484 1 53 . 1 1 7 7 ASP CB C 13 41.400 0.04 . 1 . . . A 7 ASP CB . 25484 1 54 . 1 1 7 7 ASP N N 15 121.260 0.04 . 1 . . . A 7 ASP N . 25484 1 55 . 1 1 8 8 SER H H 1 8.372 0.04 . 1 . . . A 8 SER H . 25484 1 56 . 1 1 8 8 SER HA H 1 4.340 0.04 . 1 . . . A 8 SER HA . 25484 1 57 . 1 1 8 8 SER HB2 H 1 4.010 0.04 . 2 . . . A 8 SER HB2 . 25484 1 58 . 1 1 8 8 SER HB3 H 1 4.010 0.04 . 2 . . . A 8 SER HB3 . 25484 1 59 . 1 1 8 8 SER C C 13 176.310 0.04 . 1 . . . A 8 SER C . 25484 1 60 . 1 1 8 8 SER CA C 13 60.050 0.04 . 1 . . . A 8 SER CA . 25484 1 61 . 1 1 8 8 SER CB C 13 63.190 0.04 . 1 . . . A 8 SER CB . 25484 1 62 . 1 1 8 8 SER N N 15 116.818 0.04 . 1 . . . A 8 SER N . 25484 1 63 . 1 1 9 9 ARG H H 1 8.308 0.04 . 1 . . . A 9 ARG H . 25484 1 64 . 1 1 9 9 ARG HA H 1 4.260 0.04 . 1 . . . A 9 ARG HA . 25484 1 65 . 1 1 9 9 ARG HB2 H 1 1.915 0.04 . 2 . . . A 9 ARG HB2 . 25484 1 66 . 1 1 9 9 ARG HB3 H 1 1.915 0.04 . 2 . . . A 9 ARG HB3 . 25484 1 67 . 1 1 9 9 ARG HG2 H 1 1.692 0.04 . 1 . . . A 9 ARG HG2 . 25484 1 68 . 1 1 9 9 ARG HG3 H 1 1.692 0.04 . 1 . . . A 9 ARG HG3 . 25484 1 69 . 1 1 9 9 ARG HD2 H 1 3.222 0.04 . 1 . . . A 9 ARG HD2 . 25484 1 70 . 1 1 9 9 ARG HD3 H 1 3.222 0.04 . 1 . . . A 9 ARG HD3 . 25484 1 71 . 1 1 9 9 ARG C C 13 177.710 0.04 . 1 . . . A 9 ARG C . 25484 1 72 . 1 1 9 9 ARG CA C 13 58.050 0.04 . 1 . . . A 9 ARG CA . 25484 1 73 . 1 1 9 9 ARG CB C 13 30.350 0.04 . 1 . . . A 9 ARG CB . 25484 1 74 . 1 1 9 9 ARG CG C 13 27.350 0.04 . 1 . . . A 9 ARG CG . 25484 1 75 . 1 1 9 9 ARG CD C 13 43.350 0.04 . 1 . . . A 9 ARG CD . 25484 1 76 . 1 1 9 9 ARG N N 15 123.150 0.04 . 1 . . . A 9 ARG N . 25484 1 77 . 1 1 10 10 ARG H H 1 8.075 0.04 . 1 . . . A 10 ARG H . 25484 1 78 . 1 1 10 10 ARG HA H 1 4.110 0.04 . 1 . . . A 10 ARG HA . 25484 1 79 . 1 1 10 10 ARG HB2 H 1 1.908 0.04 . 1 . . . A 10 ARG HB2 . 25484 1 80 . 1 1 10 10 ARG HB3 H 1 1.908 0.04 . 1 . . . A 10 ARG HB3 . 25484 1 81 . 1 1 10 10 ARG HG2 H 1 1.647 0.04 . 1 . . . A 10 ARG HG2 . 25484 1 82 . 1 1 10 10 ARG HG3 H 1 1.647 0.04 . 1 . . . A 10 ARG HG3 . 25484 1 83 . 1 1 10 10 ARG HD2 H 1 3.260 0.04 . 1 . . . A 10 ARG HD2 . 25484 1 84 . 1 1 10 10 ARG HD3 H 1 3.260 0.04 . 1 . . . A 10 ARG HD3 . 25484 1 85 . 1 1 10 10 ARG C C 13 178.180 0.04 . 1 . . . A 10 ARG C . 25484 1 86 . 1 1 10 10 ARG CA C 13 58.420 0.04 . 1 . . . A 10 ARG CA . 25484 1 87 . 1 1 10 10 ARG CB C 13 30.260 0.04 . 1 . . . A 10 ARG CB . 25484 1 88 . 1 1 10 10 ARG CG C 13 27.350 0.04 . 1 . . . A 10 ARG CG . 25484 1 89 . 1 1 10 10 ARG CD C 13 43.150 0.04 . 1 . . . A 10 ARG CD . 25484 1 90 . 1 1 10 10 ARG N N 15 119.940 0.04 . 1 . . . A 10 ARG N . 25484 1 91 . 1 1 11 11 LEU H H 1 8.160 0.04 . 1 . . . A 11 LEU H . 25484 1 92 . 1 1 11 11 LEU HA H 1 4.225 0.04 . 1 . . . A 11 LEU HA . 25484 1 93 . 1 1 11 11 LEU HB2 H 1 1.652 0.04 . 1 . . . A 11 LEU HB2 . 25484 1 94 . 1 1 11 11 LEU HB3 H 1 1.770 0.04 . 1 . . . A 11 LEU HB3 . 25484 1 95 . 1 1 11 11 LEU HG H 1 1.690 0.04 . 1 . . . A 11 LEU HG . 25484 1 96 . 1 1 11 11 LEU HD11 H 1 0.940 0.04 . 1 . . . A 11 LEU HD11 . 25484 1 97 . 1 1 11 11 LEU HD12 H 1 0.940 0.04 . 1 . . . A 11 LEU HD12 . 25484 1 98 . 1 1 11 11 LEU HD13 H 1 0.940 0.04 . 1 . . . A 11 LEU HD13 . 25484 1 99 . 1 1 11 11 LEU HD21 H 1 0.915 0.04 . 1 . . . A 11 LEU HD21 . 25484 1 100 . 1 1 11 11 LEU HD22 H 1 0.915 0.04 . 1 . . . A 11 LEU HD22 . 25484 1 101 . 1 1 11 11 LEU HD23 H 1 0.915 0.04 . 1 . . . A 11 LEU HD23 . 25484 1 102 . 1 1 11 11 LEU C C 13 179.950 0.04 . 1 . . . A 11 LEU C . 25484 1 103 . 1 1 11 11 LEU CA C 13 57.450 0.04 . 1 . . . A 11 LEU CA . 25484 1 104 . 1 1 11 11 LEU CB C 13 41.910 0.04 . 1 . . . A 11 LEU CB . 25484 1 105 . 1 1 11 11 LEU CG C 13 27.150 0.04 . 1 . . . A 11 LEU CG . 25484 1 106 . 1 1 11 11 LEU CD1 C 13 24.850 0.04 . 1 . . . A 11 LEU CD1 . 25484 1 107 . 1 1 11 11 LEU CD2 C 13 25.050 0.04 . 1 . . . A 11 LEU CD2 . 25484 1 108 . 1 1 11 11 LEU N N 15 121.060 0.04 . 1 . . . A 11 LEU N . 25484 1 109 . 1 1 12 12 SER H H 1 8.179 0.04 . 1 . . . A 12 SER H . 25484 1 110 . 1 1 12 12 SER HA H 1 4.317 0.04 . 1 . . . A 12 SER HA . 25484 1 111 . 1 1 12 12 SER HB2 H 1 3.980 0.04 . 1 . . . A 12 SER HB2 . 25484 1 112 . 1 1 12 12 SER HB3 H 1 4.080 0.04 . 1 . . . A 12 SER HB3 . 25484 1 113 . 1 1 12 12 SER C C 13 176.960 0.04 . 1 . . . A 12 SER C . 25484 1 114 . 1 1 12 12 SER CA C 13 60.760 0.04 . 1 . . . A 12 SER CA . 25484 1 115 . 1 1 12 12 SER CB C 13 63.350 0.04 . 1 . . . A 12 SER CB . 25484 1 116 . 1 1 12 12 SER N N 15 116.470 0.04 . 1 . . . A 12 SER N . 25484 1 117 . 1 1 13 13 ILE H H 1 8.130 0.04 . 1 . . . A 13 ILE H . 25484 1 118 . 1 1 13 13 ILE HA H 1 3.690 0.04 . 1 . . . A 13 ILE HA . 25484 1 119 . 1 1 13 13 ILE HB H 1 1.785 0.04 . 1 . . . A 13 ILE HB . 25484 1 120 . 1 1 13 13 ILE HG12 H 1 0.910 0.04 . 1 . . . A 13 ILE HG12 . 25484 1 121 . 1 1 13 13 ILE HG13 H 1 1.507 0.04 . 1 . . . A 13 ILE HG13 . 25484 1 122 . 1 1 13 13 ILE HG21 H 1 0.615 0.04 . 1 . . . A 13 ILE HG21 . 25484 1 123 . 1 1 13 13 ILE HG22 H 1 0.615 0.04 . 1 . . . A 13 ILE HG22 . 25484 1 124 . 1 1 13 13 ILE HG23 H 1 0.615 0.04 . 1 . . . A 13 ILE HG23 . 25484 1 125 . 1 1 13 13 ILE HD11 H 1 0.608 0.04 . 1 . . . A 13 ILE HD11 . 25484 1 126 . 1 1 13 13 ILE HD12 H 1 0.608 0.04 . 1 . . . A 13 ILE HD12 . 25484 1 127 . 1 1 13 13 ILE HD13 H 1 0.608 0.04 . 1 . . . A 13 ILE HD13 . 25484 1 128 . 1 1 13 13 ILE C C 13 177.660 0.04 . 1 . . . A 13 ILE C . 25484 1 129 . 1 1 13 13 ILE CA C 13 64.930 0.04 . 1 . . . A 13 ILE CA . 25484 1 130 . 1 1 13 13 ILE CB C 13 37.650 0.04 . 1 . . . A 13 ILE CB . 25484 1 131 . 1 1 13 13 ILE CG1 C 13 29.100 0.04 . 1 . . . A 13 ILE CG1 . 25484 1 132 . 1 1 13 13 ILE CG2 C 13 17.450 0.04 . 1 . . . A 13 ILE CG2 . 25484 1 133 . 1 1 13 13 ILE CD1 C 13 13.150 0.04 . 1 . . . A 13 ILE CD1 . 25484 1 134 . 1 1 13 13 ILE N N 15 123.740 0.04 . 1 . . . A 13 ILE N . 25484 1 135 . 1 1 14 14 GLN H H 1 8.113 0.04 . 1 . . . A 14 GLN H . 25484 1 136 . 1 1 14 14 GLN HA H 1 4.040 0.04 . 1 . . . A 14 GLN HA . 25484 1 137 . 1 1 14 14 GLN HB2 H 1 2.208 0.04 . 2 . . . A 14 GLN HB2 . 25484 1 138 . 1 1 14 14 GLN HB3 H 1 2.208 0.04 . 2 . . . A 14 GLN HB3 . 25484 1 139 . 1 1 14 14 GLN HG2 H 1 2.527 0.04 . 2 . . . A 14 GLN HG2 . 25484 1 140 . 1 1 14 14 GLN HG3 H 1 2.527 0.04 . 2 . . . A 14 GLN HG3 . 25484 1 141 . 1 1 14 14 GLN C C 13 179.490 0.04 . 1 . . . A 14 GLN C . 25484 1 142 . 1 1 14 14 GLN CA C 13 59.750 0.04 . 1 . . . A 14 GLN CA . 25484 1 143 . 1 1 14 14 GLN CB C 13 27.730 0.04 . 1 . . . A 14 GLN CB . 25484 1 144 . 1 1 14 14 GLN CG C 13 33.850 0.04 . 1 . . . A 14 GLN CG . 25484 1 145 . 1 1 14 14 GLN N N 15 119.220 0.04 . 1 . . . A 14 GLN N . 25484 1 146 . 1 1 15 15 ARG H H 1 8.200 0.04 . 1 . . . A 15 ARG H . 25484 1 147 . 1 1 15 15 ARG HA H 1 4.150 0.04 . 1 . . . A 15 ARG HA . 25484 1 148 . 1 1 15 15 ARG HB2 H 1 1.924 0.04 . 2 . . . A 15 ARG HB2 . 25484 1 149 . 1 1 15 15 ARG HB3 H 1 1.924 0.04 . 2 . . . A 15 ARG HB3 . 25484 1 150 . 1 1 15 15 ARG HG2 H 1 1.677 0.04 . 1 . . . A 15 ARG HG2 . 25484 1 151 . 1 1 15 15 ARG HG3 H 1 1.677 0.04 . 1 . . . A 15 ARG HG3 . 25484 1 152 . 1 1 15 15 ARG HD2 H 1 3.260 0.04 . 1 . . . A 15 ARG HD2 . 25484 1 153 . 1 1 15 15 ARG HD3 H 1 3.260 0.04 . 1 . . . A 15 ARG HD3 . 25484 1 154 . 1 1 15 15 ARG C C 13 179.460 0.04 . 1 . . . A 15 ARG C . 25484 1 155 . 1 1 15 15 ARG CA C 13 59.150 0.04 . 1 . . . A 15 ARG CA . 25484 1 156 . 1 1 15 15 ARG CB C 13 30.090 0.04 . 1 . . . A 15 ARG CB . 25484 1 157 . 1 1 15 15 ARG CG C 13 27.650 0.04 . 1 . . . A 15 ARG CG . 25484 1 158 . 1 1 15 15 ARG CD C 13 43.650 0.04 . 1 . . . A 15 ARG CD . 25484 1 159 . 1 1 15 15 ARG N N 15 119.160 0.04 . 1 . . . A 15 ARG N . 25484 1 160 . 1 1 16 16 ALA H H 1 8.071 0.04 . 1 . . . A 16 ALA H . 25484 1 161 . 1 1 16 16 ALA HA H 1 3.990 0.04 . 1 . . . A 16 ALA HA . 25484 1 162 . 1 1 16 16 ALA HB1 H 1 1.438 0.04 . 1 . . . A 16 ALA HB1 . 25484 1 163 . 1 1 16 16 ALA HB2 H 1 1.438 0.04 . 1 . . . A 16 ALA HB2 . 25484 1 164 . 1 1 16 16 ALA HB3 H 1 1.438 0.04 . 1 . . . A 16 ALA HB3 . 25484 1 165 . 1 1 16 16 ALA C C 13 180.230 0.04 . 1 . . . A 16 ALA C . 25484 1 166 . 1 1 16 16 ALA CA C 13 55.550 0.04 . 1 . . . A 16 ALA CA . 25484 1 167 . 1 1 16 16 ALA CB C 13 18.750 0.04 . 1 . . . A 16 ALA CB . 25484 1 168 . 1 1 16 16 ALA N N 15 124.140 0.04 . 1 . . . A 16 ALA N . 25484 1 169 . 1 1 17 17 ILE H H 1 8.534 0.04 . 1 . . . A 17 ILE H . 25484 1 170 . 1 1 17 17 ILE HA H 1 3.712 0.04 . 1 . . . A 17 ILE HA . 25484 1 171 . 1 1 17 17 ILE HB H 1 2.125 0.04 . 1 . . . A 17 ILE HB . 25484 1 172 . 1 1 17 17 ILE HG12 H 1 1.283 0.04 . 1 . . . A 17 ILE HG12 . 25484 1 173 . 1 1 17 17 ILE HG13 H 1 1.918 0.04 . 1 . . . A 17 ILE HG13 . 25484 1 174 . 1 1 17 17 ILE HG21 H 1 1.095 0.04 . 1 . . . A 17 ILE HG21 . 25484 1 175 . 1 1 17 17 ILE HG22 H 1 1.095 0.04 . 1 . . . A 17 ILE HG22 . 25484 1 176 . 1 1 17 17 ILE HG23 H 1 1.095 0.04 . 1 . . . A 17 ILE HG23 . 25484 1 177 . 1 1 17 17 ILE HD11 H 1 0.975 0.04 . 1 . . . A 17 ILE HD11 . 25484 1 178 . 1 1 17 17 ILE HD12 H 1 0.975 0.04 . 1 . . . A 17 ILE HD12 . 25484 1 179 . 1 1 17 17 ILE HD13 H 1 0.975 0.04 . 1 . . . A 17 ILE HD13 . 25484 1 180 . 1 1 17 17 ILE C C 13 178.210 0.04 . 1 . . . A 17 ILE C . 25484 1 181 . 1 1 17 17 ILE CA C 13 64.870 0.04 . 1 . . . A 17 ILE CA . 25484 1 182 . 1 1 17 17 ILE CB C 13 37.640 0.04 . 1 . . . A 17 ILE CB . 25484 1 183 . 1 1 17 17 ILE CG1 C 13 29.550 0.04 . 1 . . . A 17 ILE CG1 . 25484 1 184 . 1 1 17 17 ILE CG2 C 13 18.650 0.04 . 1 . . . A 17 ILE CG2 . 25484 1 185 . 1 1 17 17 ILE CD1 C 13 14.450 0.04 . 1 . . . A 17 ILE CD1 . 25484 1 186 . 1 1 17 17 ILE N N 15 118.180 0.04 . 1 . . . A 17 ILE N . 25484 1 187 . 1 1 18 18 GLN H H 1 8.200 0.04 . 1 . . . A 18 GLN H . 25484 1 188 . 1 1 18 18 GLN HA H 1 4.134 0.04 . 1 . . . A 18 GLN HA . 25484 1 189 . 1 1 18 18 GLN HB2 H 1 1.927 0.04 . 1 . . . A 18 GLN HB2 . 25484 1 190 . 1 1 18 18 GLN HB3 H 1 2.230 0.04 . 1 . . . A 18 GLN HB3 . 25484 1 191 . 1 1 18 18 GLN HG2 H 1 2.560 0.04 . 1 . . . A 18 GLN HG2 . 25484 1 192 . 1 1 18 18 GLN HG3 H 1 2.550 0.04 . 1 . . . A 18 GLN HG3 . 25484 1 193 . 1 1 18 18 GLN C C 13 180.050 0.04 . 1 . . . A 18 GLN C . 25484 1 194 . 1 1 18 18 GLN CA C 13 59.340 0.04 . 1 . . . A 18 GLN CA . 25484 1 195 . 1 1 18 18 GLN CB C 13 28.030 0.04 . 1 . . . A 18 GLN CB . 25484 1 196 . 1 1 18 18 GLN CG C 13 33.950 0.04 . 1 . . . A 18 GLN CG . 25484 1 197 . 1 1 18 18 GLN N N 15 118.960 0.04 . 1 . . . A 18 GLN N . 25484 1 198 . 1 1 19 19 SER H H 1 8.190 0.04 . 1 . . . A 19 SER H . 25484 1 199 . 1 1 19 19 SER HA H 1 4.388 0.04 . 1 . . . A 19 SER HA . 25484 1 200 . 1 1 19 19 SER HB2 H 1 3.937 0.04 . 1 . . . A 19 SER HB2 . 25484 1 201 . 1 1 19 19 SER HB3 H 1 4.120 0.04 . 1 . . . A 19 SER HB3 . 25484 1 202 . 1 1 19 19 SER C C 13 176.460 0.04 . 1 . . . A 19 SER C . 25484 1 203 . 1 1 19 19 SER CA C 13 62.250 0.04 . 1 . . . A 19 SER CA . 25484 1 204 . 1 1 19 19 SER CB C 13 63.270 0.04 . 1 . . . A 19 SER CB . 25484 1 205 . 1 1 19 19 SER N N 15 116.320 0.04 . 1 . . . A 19 SER N . 25484 1 206 . 1 1 20 20 LEU H H 1 8.290 0.04 . 1 . . . A 20 LEU H . 25484 1 207 . 1 1 20 20 LEU HA H 1 4.075 0.04 . 1 . . . A 20 LEU HA . 25484 1 208 . 1 1 20 20 LEU HB2 H 1 1.735 0.04 . 1 . . . A 20 LEU HB2 . 25484 1 209 . 1 1 20 20 LEU HB3 H 1 2.095 0.04 . 1 . . . A 20 LEU HB3 . 25484 1 210 . 1 1 20 20 LEU HG H 1 1.547 0.04 . 1 . . . A 20 LEU HG . 25484 1 211 . 1 1 20 20 LEU HD11 H 1 0.930 0.04 . 1 . . . A 20 LEU HD11 . 25484 1 212 . 1 1 20 20 LEU HD12 H 1 0.930 0.04 . 1 . . . A 20 LEU HD12 . 25484 1 213 . 1 1 20 20 LEU HD13 H 1 0.930 0.04 . 1 . . . A 20 LEU HD13 . 25484 1 214 . 1 1 20 20 LEU HD21 H 1 0.883 0.04 . 1 . . . A 20 LEU HD21 . 25484 1 215 . 1 1 20 20 LEU HD22 H 1 0.883 0.04 . 1 . . . A 20 LEU HD22 . 25484 1 216 . 1 1 20 20 LEU HD23 H 1 0.883 0.04 . 1 . . . A 20 LEU HD23 . 25484 1 217 . 1 1 20 20 LEU C C 13 177.640 0.04 . 1 . . . A 20 LEU C . 25484 1 218 . 1 1 20 20 LEU CA C 13 58.750 0.04 . 1 . . . A 20 LEU CA . 25484 1 219 . 1 1 20 20 LEU CB C 13 42.390 0.04 . 1 . . . A 20 LEU CB . 25484 1 220 . 1 1 20 20 LEU CG C 13 27.350 0.04 . 1 . . . A 20 LEU CG . 25484 1 221 . 1 1 20 20 LEU CD1 C 13 25.550 0.04 . 1 . . . A 20 LEU CD1 . 25484 1 222 . 1 1 20 20 LEU CD2 C 13 26.050 0.04 . 1 . . . A 20 LEU CD2 . 25484 1 223 . 1 1 20 20 LEU N N 15 125.540 0.04 . 1 . . . A 20 LEU N . 25484 1 224 . 1 1 21 21 VAL H H 1 8.532 0.04 . 1 . . . A 21 VAL H . 25484 1 225 . 1 1 21 21 VAL HA H 1 3.356 0.04 . 1 . . . A 21 VAL HA . 25484 1 226 . 1 1 21 21 VAL HB H 1 2.128 0.04 . 1 . . . A 21 VAL HB . 25484 1 227 . 1 1 21 21 VAL HG11 H 1 0.965 0.04 . 1 . . . A 21 VAL HG11 . 25484 1 228 . 1 1 21 21 VAL HG12 H 1 0.965 0.04 . 1 . . . A 21 VAL HG12 . 25484 1 229 . 1 1 21 21 VAL HG13 H 1 0.965 0.04 . 1 . . . A 21 VAL HG13 . 25484 1 230 . 1 1 21 21 VAL HG21 H 1 0.942 0.04 . 1 . . . A 21 VAL HG21 . 25484 1 231 . 1 1 21 21 VAL HG22 H 1 0.942 0.04 . 1 . . . A 21 VAL HG22 . 25484 1 232 . 1 1 21 21 VAL HG23 H 1 0.942 0.04 . 1 . . . A 21 VAL HG23 . 25484 1 233 . 1 1 21 21 VAL C C 13 178.770 0.04 . 1 . . . A 21 VAL C . 25484 1 234 . 1 1 21 21 VAL CA C 13 66.850 0.04 . 1 . . . A 21 VAL CA . 25484 1 235 . 1 1 21 21 VAL CB C 13 31.450 0.04 . 1 . . . A 21 VAL CB . 25484 1 236 . 1 1 21 21 VAL CG1 C 13 23.580 0.04 . 1 . . . A 21 VAL CG1 . 25484 1 237 . 1 1 21 21 VAL CG2 C 13 23.250 0.04 . 1 . . . A 21 VAL CG2 . 25484 1 238 . 1 1 21 21 VAL N N 15 118.690 0.04 . 1 . . . A 21 VAL N . 25484 1 239 . 1 1 22 22 HIS H H 1 7.980 0.04 . 1 . . . A 22 HIS H . 25484 1 240 . 1 1 22 22 HIS HA H 1 4.230 0.04 . 1 . . . A 22 HIS HA . 25484 1 241 . 1 1 22 22 HIS HB2 H 1 3.340 0.04 . 2 . . . A 22 HIS HB2 . 25484 1 242 . 1 1 22 22 HIS HB3 H 1 3.340 0.04 . 2 . . . A 22 HIS HB3 . 25484 1 243 . 1 1 22 22 HIS C C 13 178.420 0.04 . 1 . . . A 22 HIS C . 25484 1 244 . 1 1 22 22 HIS CA C 13 59.980 0.04 . 1 . . . A 22 HIS CA . 25484 1 245 . 1 1 22 22 HIS CB C 13 27.830 0.04 . 1 . . . A 22 HIS CB . 25484 1 246 . 1 1 22 22 HIS N N 15 116.230 0.04 . 1 . . . A 22 HIS N . 25484 1 247 . 1 1 23 23 ALA H H 1 8.640 0.04 . 1 . . . A 23 ALA H . 25484 1 248 . 1 1 23 23 ALA HA H 1 4.225 0.04 . 1 . . . A 23 ALA HA . 25484 1 249 . 1 1 23 23 ALA HB1 H 1 1.580 0.04 . 1 . . . A 23 ALA HB1 . 25484 1 250 . 1 1 23 23 ALA HB2 H 1 1.580 0.04 . 1 . . . A 23 ALA HB2 . 25484 1 251 . 1 1 23 23 ALA HB3 H 1 1.580 0.04 . 1 . . . A 23 ALA HB3 . 25484 1 252 . 1 1 23 23 ALA C C 13 179.540 0.04 . 1 . . . A 23 ALA C . 25484 1 253 . 1 1 23 23 ALA CA C 13 55.250 0.04 . 1 . . . A 23 ALA CA . 25484 1 254 . 1 1 23 23 ALA CB C 13 19.550 0.04 . 1 . . . A 23 ALA CB . 25484 1 255 . 1 1 23 23 ALA N N 15 121.520 0.04 . 1 . . . A 23 ALA N . 25484 1 256 . 1 1 24 24 ALA H H 1 8.260 0.04 . 1 . . . A 24 ALA H . 25484 1 257 . 1 1 24 24 ALA HA H 1 4.100 0.04 . 1 . . . A 24 ALA HA . 25484 1 258 . 1 1 24 24 ALA HB1 H 1 1.430 0.04 . 1 . . . A 24 ALA HB1 . 25484 1 259 . 1 1 24 24 ALA HB2 H 1 1.430 0.04 . 1 . . . A 24 ALA HB2 . 25484 1 260 . 1 1 24 24 ALA HB3 H 1 1.430 0.04 . 1 . . . A 24 ALA HB3 . 25484 1 261 . 1 1 24 24 ALA C C 13 178.130 0.04 . 1 . . . A 24 ALA C . 25484 1 262 . 1 1 24 24 ALA CA C 13 54.090 0.04 . 1 . . . A 24 ALA CA . 25484 1 263 . 1 1 24 24 ALA CB C 13 18.750 0.04 . 1 . . . A 24 ALA CB . 25484 1 264 . 1 1 24 24 ALA N N 15 116.860 0.04 . 1 . . . A 24 ALA N . 25484 1 265 . 1 1 25 25 GLN H H 1 7.260 0.04 . 1 . . . A 25 GLN H . 25484 1 266 . 1 1 25 25 GLN HA H 1 4.495 0.04 . 1 . . . A 25 GLN HA . 25484 1 267 . 1 1 25 25 GLN HB2 H 1 2.030 0.04 . 1 . . . A 25 GLN HB2 . 25484 1 268 . 1 1 25 25 GLN HB3 H 1 2.152 0.04 . 1 . . . A 25 GLN HB3 . 25484 1 269 . 1 1 25 25 GLN HG2 H 1 2.303 0.04 . 1 . . . A 25 GLN HG2 . 25484 1 270 . 1 1 25 25 GLN HG3 H 1 2.485 0.04 . 1 . . . A 25 GLN HG3 . 25484 1 271 . 1 1 25 25 GLN C C 13 174.940 0.04 . 1 . . . A 25 GLN C . 25484 1 272 . 1 1 25 25 GLN CA C 13 54.650 0.04 . 1 . . . A 25 GLN CA . 25484 1 273 . 1 1 25 25 GLN CB C 13 30.650 0.04 . 1 . . . A 25 GLN CB . 25484 1 274 . 1 1 25 25 GLN CG C 13 33.450 0.04 . 1 . . . A 25 GLN CG . 25484 1 275 . 1 1 25 25 GLN N N 15 112.450 0.04 . 1 . . . A 25 GLN N . 25484 1 276 . 1 1 26 26 CYS H H 1 7.365 0.04 . 1 . . . A 26 CYS H . 25484 1 277 . 1 1 26 26 CYS HA H 1 3.915 0.04 . 1 . . . A 26 CYS HA . 25484 1 278 . 1 1 26 26 CYS HB2 H 1 2.090 0.04 . 1 . . . A 26 CYS HB2 . 25484 1 279 . 1 1 26 26 CYS HB3 H 1 2.560 0.04 . 1 . . . A 26 CYS HB3 . 25484 1 280 . 1 1 26 26 CYS C C 13 176.690 0.04 . 1 . . . A 26 CYS C . 25484 1 281 . 1 1 26 26 CYS CA C 13 60.980 0.04 . 1 . . . A 26 CYS CA . 25484 1 282 . 1 1 26 26 CYS CB C 13 29.350 0.04 . 1 . . . A 26 CYS CB . 25484 1 283 . 1 1 26 26 CYS N N 15 124.510 0.04 . 1 . . . A 26 CYS N . 25484 1 284 . 1 1 27 27 ARG H H 1 8.880 0.04 . 1 . . . A 27 ARG H . 25484 1 285 . 1 1 27 27 ARG HA H 1 4.635 0.04 . 1 . . . A 27 ARG HA . 25484 1 286 . 1 1 27 27 ARG HB2 H 1 1.690 0.04 . 1 . . . A 27 ARG HB2 . 25484 1 287 . 1 1 27 27 ARG HB3 H 1 2.158 0.04 . 1 . . . A 27 ARG HB3 . 25484 1 288 . 1 1 27 27 ARG HG2 H 1 1.625 0.04 . 1 . . . A 27 ARG HG2 . 25484 1 289 . 1 1 27 27 ARG HG3 H 1 1.680 0.04 . 1 . . . A 27 ARG HG3 . 25484 1 290 . 1 1 27 27 ARG HD2 H 1 3.206 0.04 . 1 . . . A 27 ARG HD2 . 25484 1 291 . 1 1 27 27 ARG HD3 H 1 3.206 0.04 . 1 . . . A 27 ARG HD3 . 25484 1 292 . 1 1 27 27 ARG C C 13 175.660 0.04 . 1 . . . A 27 ARG C . 25484 1 293 . 1 1 27 27 ARG CA C 13 54.550 0.04 . 1 . . . A 27 ARG CA . 25484 1 294 . 1 1 27 27 ARG CB C 13 30.350 0.04 . 1 . . . A 27 ARG CB . 25484 1 295 . 1 1 27 27 ARG CG C 13 26.550 0.04 . 1 . . . A 27 ARG CG . 25484 1 296 . 1 1 27 27 ARG CD C 13 43.350 0.04 . 1 . . . A 27 ARG CD . 25484 1 297 . 1 1 27 27 ARG N N 15 129.870 0.04 . 1 . . . A 27 ARG N . 25484 1 298 . 1 1 28 28 ASN H H 1 7.980 0.04 . 1 . . . A 28 ASN H . 25484 1 299 . 1 1 28 28 ASN HA H 1 4.870 0.04 . 1 . . . A 28 ASN HA . 25484 1 300 . 1 1 28 28 ASN HB2 H 1 2.895 0.04 . 1 . . . A 28 ASN HB2 . 25484 1 301 . 1 1 28 28 ASN HB3 H 1 2.985 0.04 . 1 . . . A 28 ASN HB3 . 25484 1 302 . 1 1 28 28 ASN C C 13 176.120 0.04 . 1 . . . A 28 ASN C . 25484 1 303 . 1 1 28 28 ASN CA C 13 51.930 0.04 . 1 . . . A 28 ASN CA . 25484 1 304 . 1 1 28 28 ASN CB C 13 39.060 0.04 . 1 . . . A 28 ASN CB . 25484 1 305 . 1 1 28 28 ASN N N 15 120.810 0.04 . 1 . . . A 28 ASN N . 25484 1 306 . 1 1 29 29 ALA H H 1 9.134 0.04 . 1 . . . A 29 ALA H . 25484 1 307 . 1 1 29 29 ALA HA H 1 4.133 0.04 . 1 . . . A 29 ALA HA . 25484 1 308 . 1 1 29 29 ALA HB1 H 1 1.459 0.04 . 1 . . . A 29 ALA HB1 . 25484 1 309 . 1 1 29 29 ALA HB2 H 1 1.459 0.04 . 1 . . . A 29 ALA HB2 . 25484 1 310 . 1 1 29 29 ALA HB3 H 1 1.459 0.04 . 1 . . . A 29 ALA HB3 . 25484 1 311 . 1 1 29 29 ALA C C 13 178.380 0.04 . 1 . . . A 29 ALA C . 25484 1 312 . 1 1 29 29 ALA CA C 13 54.290 0.04 . 1 . . . A 29 ALA CA . 25484 1 313 . 1 1 29 29 ALA CB C 13 18.370 0.04 . 1 . . . A 29 ALA CB . 25484 1 314 . 1 1 29 29 ALA N N 15 130.470 0.04 . 1 . . . A 29 ALA N . 25484 1 315 . 1 1 30 30 ASN H H 1 8.114 0.04 . 1 . . . A 30 ASN H . 25484 1 316 . 1 1 30 30 ASN HA H 1 4.875 0.04 . 1 . . . A 30 ASN HA . 25484 1 317 . 1 1 30 30 ASN HB2 H 1 2.630 0.04 . 1 . . . A 30 ASN HB2 . 25484 1 318 . 1 1 30 30 ASN HB3 H 1 2.975 0.04 . 1 . . . A 30 ASN HB3 . 25484 1 319 . 1 1 30 30 ASN C C 13 174.530 0.04 . 1 . . . A 30 ASN C . 25484 1 320 . 1 1 30 30 ASN CA C 13 51.930 0.04 . 1 . . . A 30 ASN CA . 25484 1 321 . 1 1 30 30 ASN CB C 13 38.910 0.04 . 1 . . . A 30 ASN CB . 25484 1 322 . 1 1 30 30 ASN N N 15 114.590 0.04 . 1 . . . A 30 ASN N . 25484 1 323 . 1 1 31 31 CYS H H 1 7.210 0.04 . 1 . . . A 31 CYS H . 25484 1 324 . 1 1 31 31 CYS HA H 1 4.050 0.04 . 1 . . . A 31 CYS HA . 25484 1 325 . 1 1 31 31 CYS HB2 H 1 2.950 0.04 . 1 . . . A 31 CYS HB2 . 25484 1 326 . 1 1 31 31 CYS HB3 H 1 3.045 0.04 . 1 . . . A 31 CYS HB3 . 25484 1 327 . 1 1 31 31 CYS C C 13 177.170 0.04 . 1 . . . A 31 CYS C . 25484 1 328 . 1 1 31 31 CYS CA C 13 61.880 0.04 . 1 . . . A 31 CYS CA . 25484 1 329 . 1 1 31 31 CYS CB C 13 30.010 0.04 . 1 . . . A 31 CYS CB . 25484 1 330 . 1 1 31 31 CYS N N 15 123.270 0.04 . 1 . . . A 31 CYS N . 25484 1 331 . 1 1 32 32 SER H H 1 8.767 0.04 . 1 . . . A 32 SER H . 25484 1 332 . 1 1 32 32 SER HA H 1 4.609 0.04 . 1 . . . A 32 SER HA . 25484 1 333 . 1 1 32 32 SER HB2 H 1 3.900 0.04 . 1 . . . A 32 SER HB2 . 25484 1 334 . 1 1 32 32 SER HB3 H 1 4.137 0.04 . 1 . . . A 32 SER HB3 . 25484 1 335 . 1 1 32 32 SER C C 13 175.020 0.04 . 1 . . . A 32 SER C . 25484 1 336 . 1 1 32 32 SER CA C 13 58.010 0.04 . 1 . . . A 32 SER CA . 25484 1 337 . 1 1 32 32 SER CB C 13 64.120 0.04 . 1 . . . A 32 SER CB . 25484 1 338 . 1 1 32 32 SER N N 15 124.300 0.04 . 1 . . . A 32 SER N . 25484 1 339 . 1 1 33 33 LEU H H 1 8.546 0.04 . 1 . . . A 33 LEU H . 25484 1 340 . 1 1 33 33 LEU HA H 1 4.538 0.04 . 1 . . . A 33 LEU HA . 25484 1 341 . 1 1 33 33 LEU HB2 H 1 1.457 0.04 . 1 . . . A 33 LEU HB2 . 25484 1 342 . 1 1 33 33 LEU HB3 H 1 1.627 0.04 . 1 . . . A 33 LEU HB3 . 25484 1 343 . 1 1 33 33 LEU HG H 1 1.626 0.04 . 1 . . . A 33 LEU HG . 25484 1 344 . 1 1 33 33 LEU HD11 H 1 0.580 0.04 . 1 . . . A 33 LEU HD11 . 25484 1 345 . 1 1 33 33 LEU HD12 H 1 0.580 0.04 . 1 . . . A 33 LEU HD12 . 25484 1 346 . 1 1 33 33 LEU HD13 H 1 0.580 0.04 . 1 . . . A 33 LEU HD13 . 25484 1 347 . 1 1 33 33 LEU HD21 H 1 0.620 0.04 . 1 . . . A 33 LEU HD21 . 25484 1 348 . 1 1 33 33 LEU HD22 H 1 0.620 0.04 . 1 . . . A 33 LEU HD22 . 25484 1 349 . 1 1 33 33 LEU HD23 H 1 0.620 0.04 . 1 . . . A 33 LEU HD23 . 25484 1 350 . 1 1 33 33 LEU C C 13 177.230 0.04 . 1 . . . A 33 LEU C . 25484 1 351 . 1 1 33 33 LEU CA C 13 54.450 0.04 . 1 . . . A 33 LEU CA . 25484 1 352 . 1 1 33 33 LEU CB C 13 40.970 0.04 . 1 . . . A 33 LEU CB . 25484 1 353 . 1 1 33 33 LEU CG C 13 27.350 0.04 . 1 . . . A 33 LEU CG . 25484 1 354 . 1 1 33 33 LEU CD1 C 13 24.350 0.04 . 1 . . . A 33 LEU CD1 . 25484 1 355 . 1 1 33 33 LEU CD2 C 13 23.350 0.04 . 1 . . . A 33 LEU CD2 . 25484 1 356 . 1 1 33 33 LEU N N 15 128.860 0.04 . 1 . . . A 33 LEU N . 25484 1 357 . 1 1 34 34 PRO HA H 1 4.370 0.04 . 1 . . . A 34 PRO HA . 25484 1 358 . 1 1 34 34 PRO HB2 H 1 2.059 0.04 . 1 . . . A 34 PRO HB2 . 25484 1 359 . 1 1 34 34 PRO HB3 H 1 2.467 0.04 . 1 . . . A 34 PRO HB3 . 25484 1 360 . 1 1 34 34 PRO HG2 H 1 2.140 0.04 . 2 . . . A 34 PRO HG2 . 25484 1 361 . 1 1 34 34 PRO HG3 H 1 2.140 0.04 . 2 . . . A 34 PRO HG3 . 25484 1 362 . 1 1 34 34 PRO HD2 H 1 3.850 0.04 . 1 . . . A 34 PRO HD2 . 25484 1 363 . 1 1 34 34 PRO HD3 H 1 3.850 0.04 . 1 . . . A 34 PRO HD3 . 25484 1 364 . 1 1 34 34 PRO C C 13 178.640 0.04 . 1 . . . A 34 PRO C . 25484 1 365 . 1 1 34 34 PRO CA C 13 65.530 0.04 . 1 . . . A 34 PRO CA . 25484 1 366 . 1 1 34 34 PRO CB C 13 31.970 0.04 . 1 . . . A 34 PRO CB . 25484 1 367 . 1 1 34 34 PRO CG C 13 27.950 0.04 . 1 . . . A 34 PRO CG . 25484 1 368 . 1 1 34 34 PRO CD C 13 50.950 0.04 . 1 . . . A 34 PRO CD . 25484 1 369 . 1 1 35 35 SER H H 1 8.350 0.04 . 1 . . . A 35 SER H . 25484 1 370 . 1 1 35 35 SER HA H 1 4.127 0.04 . 1 . . . A 35 SER HA . 25484 1 371 . 1 1 35 35 SER HB2 H 1 3.945 0.04 . 1 . . . A 35 SER HB2 . 25484 1 372 . 1 1 35 35 SER HB3 H 1 3.945 0.04 . 1 . . . A 35 SER HB3 . 25484 1 373 . 1 1 35 35 SER C C 13 174.750 0.04 . 1 . . . A 35 SER C . 25484 1 374 . 1 1 35 35 SER CA C 13 60.100 0.04 . 1 . . . A 35 SER CA . 25484 1 375 . 1 1 35 35 SER CB C 13 62.910 0.04 . 1 . . . A 35 SER CB . 25484 1 376 . 1 1 35 35 SER N N 15 111.940 0.04 . 1 . . . A 35 SER N . 25484 1 377 . 1 1 36 36 CYS H H 1 7.490 0.04 . 1 . . . A 36 CYS H . 25484 1 378 . 1 1 36 36 CYS HA H 1 4.215 0.04 . 1 . . . A 36 CYS HA . 25484 1 379 . 1 1 36 36 CYS HB2 H 1 2.795 0.04 . 1 . . . A 36 CYS HB2 . 25484 1 380 . 1 1 36 36 CYS HB3 H 1 3.228 0.04 . 1 . . . A 36 CYS HB3 . 25484 1 381 . 1 1 36 36 CYS C C 13 177.070 0.04 . 1 . . . A 36 CYS C . 25484 1 382 . 1 1 36 36 CYS CA C 13 63.900 0.04 . 1 . . . A 36 CYS CA . 25484 1 383 . 1 1 36 36 CYS CB C 13 29.650 0.04 . 1 . . . A 36 CYS CB . 25484 1 384 . 1 1 36 36 CYS N N 15 125.790 0.04 . 1 . . . A 36 CYS N . 25484 1 385 . 1 1 37 37 GLN H H 1 8.170 0.04 . 1 . . . A 37 GLN H . 25484 1 386 . 1 1 37 37 GLN HA H 1 4.010 0.04 . 1 . . . A 37 GLN HA . 25484 1 387 . 1 1 37 37 GLN HB2 H 1 2.185 0.04 . 2 . . . A 37 GLN HB2 . 25484 1 388 . 1 1 37 37 GLN HB3 H 1 2.185 0.04 . 2 . . . A 37 GLN HB3 . 25484 1 389 . 1 1 37 37 GLN HG2 H 1 2.490 0.04 . 1 . . . A 37 GLN HG2 . 25484 1 390 . 1 1 37 37 GLN HG3 H 1 2.550 0.04 . 1 . . . A 37 GLN HG3 . 25484 1 391 . 1 1 37 37 GLN C C 13 179.690 0.04 . 1 . . . A 37 GLN C . 25484 1 392 . 1 1 37 37 GLN CA C 13 59.980 0.04 . 1 . . . A 37 GLN CA . 25484 1 393 . 1 1 37 37 GLN CB C 13 27.820 0.04 . 1 . . . A 37 GLN CB . 25484 1 394 . 1 1 37 37 GLN CG C 13 34.050 0.04 . 1 . . . A 37 GLN CG . 25484 1 395 . 1 1 37 37 GLN N N 15 115.860 0.04 . 1 . . . A 37 GLN N . 25484 1 396 . 1 1 38 38 LYS H H 1 7.920 0.04 . 1 . . . A 38 LYS H . 25484 1 397 . 1 1 38 38 LYS HA H 1 4.060 0.04 . 1 . . . A 38 LYS HA . 25484 1 398 . 1 1 38 38 LYS HB2 H 1 1.740 0.04 . 1 . . . A 38 LYS HB2 . 25484 1 399 . 1 1 38 38 LYS HB3 H 1 1.830 0.04 . 1 . . . A 38 LYS HB3 . 25484 1 400 . 1 1 38 38 LYS HG2 H 1 1.380 0.04 . 1 . . . A 38 LYS HG2 . 25484 1 401 . 1 1 38 38 LYS HG3 H 1 1.520 0.04 . 1 . . . A 38 LYS HG3 . 25484 1 402 . 1 1 38 38 LYS HD2 H 1 1.590 0.04 . 2 . . . A 38 LYS HD2 . 25484 1 403 . 1 1 38 38 LYS HD3 H 1 1.590 0.04 . 2 . . . A 38 LYS HD3 . 25484 1 404 . 1 1 38 38 LYS HE2 H 1 2.880 0.04 . 2 . . . A 38 LYS HE2 . 25484 1 405 . 1 1 38 38 LYS HE3 H 1 2.880 0.04 . 2 . . . A 38 LYS HE3 . 25484 1 406 . 1 1 38 38 LYS C C 13 179.230 0.04 . 1 . . . A 38 LYS C . 25484 1 407 . 1 1 38 38 LYS CA C 13 59.450 0.04 . 1 . . . A 38 LYS CA . 25484 1 408 . 1 1 38 38 LYS CB C 13 32.650 0.04 . 1 . . . A 38 LYS CB . 25484 1 409 . 1 1 38 38 LYS CG C 13 25.350 0.04 . 1 . . . A 38 LYS CG . 25484 1 410 . 1 1 38 38 LYS CD C 13 29.350 0.04 . 1 . . . A 38 LYS CD . 25484 1 411 . 1 1 38 38 LYS CE C 13 41.910 0.04 . 1 . . . A 38 LYS CE . 25484 1 412 . 1 1 38 38 LYS N N 15 117.470 0.04 . 1 . . . A 38 LYS N . 25484 1 413 . 1 1 39 39 MET H H 1 8.370 0.04 . 1 . . . A 39 MET H . 25484 1 414 . 1 1 39 39 MET HA H 1 4.559 0.04 . 1 . . . A 39 MET HA . 25484 1 415 . 1 1 39 39 MET HB2 H 1 1.928 0.04 . 1 . . . A 39 MET HB2 . 25484 1 416 . 1 1 39 39 MET HB3 H 1 2.354 0.04 . 1 . . . A 39 MET HB3 . 25484 1 417 . 1 1 39 39 MET HG2 H 1 2.590 0.04 . 1 . . . A 39 MET HG2 . 25484 1 418 . 1 1 39 39 MET HG3 H 1 2.754 0.04 . 1 . . . A 39 MET HG3 . 25484 1 419 . 1 1 39 39 MET C C 13 179.720 0.04 . 1 . . . A 39 MET C . 25484 1 420 . 1 1 39 39 MET CA C 13 57.250 0.04 . 1 . . . A 39 MET CA . 25484 1 421 . 1 1 39 39 MET CB C 13 32.550 0.04 . 1 . . . A 39 MET CB . 25484 1 422 . 1 1 39 39 MET CG C 13 33.650 0.04 . 1 . . . A 39 MET CG . 25484 1 423 . 1 1 39 39 MET N N 15 118.050 0.04 . 1 . . . A 39 MET N . 25484 1 424 . 1 1 40 40 LYS H H 1 9.490 0.04 . 1 . . . A 40 LYS H . 25484 1 425 . 1 1 40 40 LYS HA H 1 3.840 0.04 . 1 . . . A 40 LYS HA . 25484 1 426 . 1 1 40 40 LYS HB2 H 1 1.999 0.04 . 1 . . . A 40 LYS HB2 . 25484 1 427 . 1 1 40 40 LYS HB3 H 1 2.153 0.04 . 1 . . . A 40 LYS HB3 . 25484 1 428 . 1 1 40 40 LYS HG2 H 1 1.418 0.04 . 2 . . . A 40 LYS HG2 . 25484 1 429 . 1 1 40 40 LYS HG3 H 1 1.418 0.04 . 2 . . . A 40 LYS HG3 . 25484 1 430 . 1 1 40 40 LYS HD2 H 1 1.702 0.04 . 2 . . . A 40 LYS HD2 . 25484 1 431 . 1 1 40 40 LYS HD3 H 1 1.702 0.04 . 2 . . . A 40 LYS HD3 . 25484 1 432 . 1 1 40 40 LYS HE2 H 1 3.150 0.04 . 1 . . . A 40 LYS HE2 . 25484 1 433 . 1 1 40 40 LYS HE3 H 1 3.284 0.04 . 1 . . . A 40 LYS HE3 . 25484 1 434 . 1 1 40 40 LYS C C 13 180.150 0.04 . 1 . . . A 40 LYS C . 25484 1 435 . 1 1 40 40 LYS CA C 13 61.520 0.04 . 1 . . . A 40 LYS CA . 25484 1 436 . 1 1 40 40 LYS CB C 13 32.620 0.04 . 1 . . . A 40 LYS CB . 25484 1 437 . 1 1 40 40 LYS CG C 13 27.350 0.04 . 1 . . . A 40 LYS CG . 25484 1 438 . 1 1 40 40 LYS CD C 13 30.150 0.04 . 1 . . . A 40 LYS CD . 25484 1 439 . 1 1 40 40 LYS CE C 13 43.350 0.04 . 1 . . . A 40 LYS CE . 25484 1 440 . 1 1 40 40 LYS N N 15 121.630 0.04 . 1 . . . A 40 LYS N . 25484 1 441 . 1 1 41 41 ARG H H 1 7.610 0.04 . 1 . . . A 41 ARG H . 25484 1 442 . 1 1 41 41 ARG HA H 1 4.180 0.04 . 1 . . . A 41 ARG HA . 25484 1 443 . 1 1 41 41 ARG HB2 H 1 2.040 0.04 . 1 . . . A 41 ARG HB2 . 25484 1 444 . 1 1 41 41 ARG HB3 H 1 2.210 0.04 . 1 . . . A 41 ARG HB3 . 25484 1 445 . 1 1 41 41 ARG HG2 H 1 1.780 0.04 . 1 . . . A 41 ARG HG2 . 25484 1 446 . 1 1 41 41 ARG HG3 H 1 1.990 0.04 . 1 . . . A 41 ARG HG3 . 25484 1 447 . 1 1 41 41 ARG HD2 H 1 3.294 0.04 . 1 . . . A 41 ARG HD2 . 25484 1 448 . 1 1 41 41 ARG HD3 H 1 3.294 0.04 . 1 . . . A 41 ARG HD3 . 25484 1 449 . 1 1 41 41 ARG C C 13 180.080 0.04 . 1 . . . A 41 ARG C . 25484 1 450 . 1 1 41 41 ARG CA C 13 59.750 0.04 . 1 . . . A 41 ARG CA . 25484 1 451 . 1 1 41 41 ARG CB C 13 30.010 0.04 . 1 . . . A 41 ARG CB . 25484 1 452 . 1 1 41 41 ARG CG C 13 27.650 0.04 . 1 . . . A 41 ARG CG . 25484 1 453 . 1 1 41 41 ARG CD C 13 43.550 0.04 . 1 . . . A 41 ARG CD . 25484 1 454 . 1 1 41 41 ARG N N 15 118.300 0.04 . 1 . . . A 41 ARG N . 25484 1 455 . 1 1 42 42 VAL H H 1 7.760 0.04 . 1 . . . A 42 VAL H . 25484 1 456 . 1 1 42 42 VAL HA H 1 3.745 0.04 . 1 . . . A 42 VAL HA . 25484 1 457 . 1 1 42 42 VAL HB H 1 2.454 0.04 . 1 . . . A 42 VAL HB . 25484 1 458 . 1 1 42 42 VAL HG11 H 1 1.116 0.04 . 1 . . . A 42 VAL HG11 . 25484 1 459 . 1 1 42 42 VAL HG12 H 1 1.116 0.04 . 1 . . . A 42 VAL HG12 . 25484 1 460 . 1 1 42 42 VAL HG13 H 1 1.116 0.04 . 1 . . . A 42 VAL HG13 . 25484 1 461 . 1 1 42 42 VAL HG21 H 1 0.960 0.04 . 1 . . . A 42 VAL HG21 . 25484 1 462 . 1 1 42 42 VAL HG22 H 1 0.960 0.04 . 1 . . . A 42 VAL HG22 . 25484 1 463 . 1 1 42 42 VAL HG23 H 1 0.960 0.04 . 1 . . . A 42 VAL HG23 . 25484 1 464 . 1 1 42 42 VAL C C 13 178.130 0.04 . 1 . . . A 42 VAL C . 25484 1 465 . 1 1 42 42 VAL CA C 13 66.760 0.04 . 1 . . . A 42 VAL CA . 25484 1 466 . 1 1 42 42 VAL CB C 13 31.520 0.04 . 1 . . . A 42 VAL CB . 25484 1 467 . 1 1 42 42 VAL CG1 C 13 22.860 0.04 . 1 . . . A 42 VAL CG1 . 25484 1 468 . 1 1 42 42 VAL CG2 C 13 22.750 0.04 . 1 . . . A 42 VAL CG2 . 25484 1 469 . 1 1 42 42 VAL N N 15 121.750 0.04 . 1 . . . A 42 VAL N . 25484 1 470 . 1 1 43 43 VAL H H 1 8.500 0.04 . 1 . . . A 43 VAL H . 25484 1 471 . 1 1 43 43 VAL HA H 1 3.531 0.04 . 1 . . . A 43 VAL HA . 25484 1 472 . 1 1 43 43 VAL HB H 1 2.221 0.04 . 1 . . . A 43 VAL HB . 25484 1 473 . 1 1 43 43 VAL HG11 H 1 0.958 0.04 . 1 . . . A 43 VAL HG11 . 25484 1 474 . 1 1 43 43 VAL HG12 H 1 0.958 0.04 . 1 . . . A 43 VAL HG12 . 25484 1 475 . 1 1 43 43 VAL HG13 H 1 0.958 0.04 . 1 . . . A 43 VAL HG13 . 25484 1 476 . 1 1 43 43 VAL HG21 H 1 0.975 0.04 . 1 . . . A 43 VAL HG21 . 25484 1 477 . 1 1 43 43 VAL HG22 H 1 0.975 0.04 . 1 . . . A 43 VAL HG22 . 25484 1 478 . 1 1 43 43 VAL HG23 H 1 0.975 0.04 . 1 . . . A 43 VAL HG23 . 25484 1 479 . 1 1 43 43 VAL C C 13 179.310 0.04 . 1 . . . A 43 VAL C . 25484 1 480 . 1 1 43 43 VAL CA C 13 67.120 0.04 . 1 . . . A 43 VAL CA . 25484 1 481 . 1 1 43 43 VAL CB C 13 31.510 0.04 . 1 . . . A 43 VAL CB . 25484 1 482 . 1 1 43 43 VAL CG1 C 13 21.750 0.04 . 1 . . . A 43 VAL CG1 . 25484 1 483 . 1 1 43 43 VAL CG2 C 13 21.980 0.04 . 1 . . . A 43 VAL CG2 . 25484 1 484 . 1 1 43 43 VAL N N 15 120.580 0.04 . 1 . . . A 43 VAL N . 25484 1 485 . 1 1 44 44 GLN H H 1 8.400 0.04 . 1 . . . A 44 GLN H . 25484 1 486 . 1 1 44 44 GLN HA H 1 4.010 0.04 . 1 . . . A 44 GLN HA . 25484 1 487 . 1 1 44 44 GLN HB2 H 1 2.253 0.04 . 2 . . . A 44 GLN HB2 . 25484 1 488 . 1 1 44 44 GLN HB3 H 1 2.253 0.04 . 2 . . . A 44 GLN HB3 . 25484 1 489 . 1 1 44 44 GLN HG2 H 1 2.530 0.04 . 2 . . . A 44 GLN HG2 . 25484 1 490 . 1 1 44 44 GLN HG3 H 1 2.530 0.04 . 2 . . . A 44 GLN HG3 . 25484 1 491 . 1 1 44 44 GLN C C 13 179.330 0.04 . 1 . . . A 44 GLN C . 25484 1 492 . 1 1 44 44 GLN CA C 13 59.060 0.04 . 1 . . . A 44 GLN CA . 25484 1 493 . 1 1 44 44 GLN CB C 13 28.030 0.04 . 1 . . . A 44 GLN CB . 25484 1 494 . 1 1 44 44 GLN CG C 13 34.250 0.04 . 1 . . . A 44 GLN CG . 25484 1 495 . 1 1 44 44 GLN N N 15 119.280 0.04 . 1 . . . A 44 GLN N . 25484 1 496 . 1 1 45 45 HIS H H 1 8.1900 0.04 . 1 . . . A 45 HIS H . 25484 1 497 . 1 1 45 45 HIS HA H 1 4.283 0.04 . 1 . . . A 45 HIS HA . 25484 1 498 . 1 1 45 45 HIS HB2 H 1 3.380 0.04 . 2 . . . A 45 HIS HB2 . 25484 1 499 . 1 1 45 45 HIS HB3 H 1 3.380 0.04 . 2 . . . A 45 HIS HB3 . 25484 1 500 . 1 1 45 45 HIS C C 13 178.250 0.04 . 1 . . . A 45 HIS C . 25484 1 501 . 1 1 45 45 HIS CA C 13 59.950 0.04 . 1 . . . A 45 HIS CA . 25484 1 502 . 1 1 45 45 HIS CB C 13 27.150 0.04 . 1 . . . A 45 HIS CB . 25484 1 503 . 1 1 45 45 HIS N N 15 119.160 0.04 . 1 . . . A 45 HIS N . 25484 1 504 . 1 1 46 46 THR H H 1 7.980 0.04 . 1 . . . A 46 THR H . 25484 1 505 . 1 1 46 46 THR HA H 1 3.859 0.04 . 1 . . . A 46 THR HA . 25484 1 506 . 1 1 46 46 THR HB H 1 4.225 0.04 . 1 . . . A 46 THR HB . 25484 1 507 . 1 1 46 46 THR HG21 H 1 1.669 0.04 . 1 . . . A 46 THR HG21 . 25484 1 508 . 1 1 46 46 THR HG22 H 1 1.669 0.04 . 1 . . . A 46 THR HG22 . 25484 1 509 . 1 1 46 46 THR HG23 H 1 1.669 0.04 . 1 . . . A 46 THR HG23 . 25484 1 510 . 1 1 46 46 THR C C 13 176.350 0.04 . 1 . . . A 46 THR C . 25484 1 511 . 1 1 46 46 THR CA C 13 65.670 0.04 . 1 . . . A 46 THR CA . 25484 1 512 . 1 1 46 46 THR CB C 13 69.190 0.04 . 1 . . . A 46 THR CB . 25484 1 513 . 1 1 46 46 THR CG2 C 13 22.250 0.04 . 1 . . . A 46 THR CG2 . 25484 1 514 . 1 1 46 46 THR N N 15 111.110 0.04 . 1 . . . A 46 THR N . 25484 1 515 . 1 1 47 47 LYS H H 1 7.410 0.04 . 1 . . . A 47 LYS H . 25484 1 516 . 1 1 47 47 LYS HA H 1 4.090 0.04 . 1 . . . A 47 LYS HA . 25484 1 517 . 1 1 47 47 LYS HB2 H 1 1.899 0.04 . 2 . . . A 47 LYS HB2 . 25484 1 518 . 1 1 47 47 LYS HB3 H 1 1.899 0.04 . 2 . . . A 47 LYS HB3 . 25484 1 519 . 1 1 47 47 LYS HG2 H 1 1.490 0.04 . 2 . . . A 47 LYS HG2 . 25484 1 520 . 1 1 47 47 LYS HG3 H 1 1.490 0.04 . 2 . . . A 47 LYS HG3 . 25484 1 521 . 1 1 47 47 LYS HD2 H 1 1.660 0.04 . 1 . . . A 47 LYS HD2 . 25484 1 522 . 1 1 47 47 LYS HD3 H 1 1.660 0.04 . 1 . . . A 47 LYS HD3 . 25484 1 523 . 1 1 47 47 LYS HE2 H 1 2.920 0.04 . 1 . . . A 47 LYS HE2 . 25484 1 524 . 1 1 47 47 LYS HE3 H 1 2.920 0.04 . 1 . . . A 47 LYS HE3 . 25484 1 525 . 1 1 47 47 LYS C C 13 178.150 0.04 . 1 . . . A 47 LYS C . 25484 1 526 . 1 1 47 47 LYS CA C 13 58.750 0.04 . 1 . . . A 47 LYS CA . 25484 1 527 . 1 1 47 47 LYS CB C 13 32.360 0.04 . 1 . . . A 47 LYS CB . 25484 1 528 . 1 1 47 47 LYS CG C 13 25.500 0.04 . 1 . . . A 47 LYS CG . 25484 1 529 . 1 1 47 47 LYS CD C 13 29.250 0.04 . 1 . . . A 47 LYS CD . 25484 1 530 . 1 1 47 47 LYS CE C 13 42.250 0.04 . 1 . . . A 47 LYS CE . 25484 1 531 . 1 1 47 47 LYS N N 15 120.510 0.04 . 1 . . . A 47 LYS N . 25484 1 532 . 1 1 48 48 GLY H H 1 7.180 0.04 . 1 . . . A 48 GLY H . 25484 1 533 . 1 1 48 48 GLY HA2 H 1 3.656 0.04 . 1 . . . A 48 GLY HA2 . 25484 1 534 . 1 1 48 48 GLY HA3 H 1 4.409 0.04 . 1 . . . A 48 GLY HA3 . 25484 1 535 . 1 1 48 48 GLY C C 13 174.220 0.04 . 1 . . . A 48 GLY C . 25484 1 536 . 1 1 48 48 GLY CA C 13 44.753 0.04 . 1 . . . A 48 GLY CA . 25484 1 537 . 1 1 48 48 GLY N N 15 104.210 0.04 . 1 . . . A 48 GLY N . 25484 1 538 . 1 1 49 49 CYS H H 1 6.981 0.04 . 1 . . . A 49 CYS H . 25484 1 539 . 1 1 49 49 CYS HA H 1 4.010 0.04 . 1 . . . A 49 CYS HA . 25484 1 540 . 1 1 49 49 CYS HB2 H 1 2.085 0.04 . 1 . . . A 49 CYS HB2 . 25484 1 541 . 1 1 49 49 CYS HB3 H 1 2.730 0.04 . 1 . . . A 49 CYS HB3 . 25484 1 542 . 1 1 49 49 CYS C C 13 177.230 0.04 . 1 . . . A 49 CYS C . 25484 1 543 . 1 1 49 49 CYS CA C 13 61.230 0.04 . 1 . . . A 49 CYS CA . 25484 1 544 . 1 1 49 49 CYS CB C 13 29.850 0.04 . 1 . . . A 49 CYS CB . 25484 1 545 . 1 1 49 49 CYS N N 15 123.560 0.04 . 1 . . . A 49 CYS N . 25484 1 546 . 1 1 50 50 LYS H H 1 8.999 0.04 . 1 . . . A 50 LYS H . 25484 1 547 . 1 1 50 50 LYS HA H 1 4.524 0.04 . 1 . . . A 50 LYS HA . 25484 1 548 . 1 1 50 50 LYS HB2 H 1 1.877 0.04 . 1 . . . A 50 LYS HB2 . 25484 1 549 . 1 1 50 50 LYS HB3 H 1 2.090 0.04 . 1 . . . A 50 LYS HB3 . 25484 1 550 . 1 1 50 50 LYS HG2 H 1 1.650 0.04 . 1 . . . A 50 LYS HG2 . 25484 1 551 . 1 1 50 50 LYS HG3 H 1 1.570 0.04 . 1 . . . A 50 LYS HG3 . 25484 1 552 . 1 1 50 50 LYS HD2 H 1 1.775 0.04 . 1 . . . A 50 LYS HD2 . 25484 1 553 . 1 1 50 50 LYS HD3 H 1 1.775 0.04 . 1 . . . A 50 LYS HD3 . 25484 1 554 . 1 1 50 50 LYS HE2 H 1 3.090 0.04 . 1 . . . A 50 LYS HE2 . 25484 1 555 . 1 1 50 50 LYS HE3 H 1 3.090 0.04 . 1 . . . A 50 LYS HE3 . 25484 1 556 . 1 1 50 50 LYS C C 13 178.040 0.04 . 1 . . . A 50 LYS C . 25484 1 557 . 1 1 50 50 LYS CA C 13 56.750 0.04 . 1 . . . A 50 LYS CA . 25484 1 558 . 1 1 50 50 LYS CB C 13 32.950 0.04 . 1 . . . A 50 LYS CB . 25484 1 559 . 1 1 50 50 LYS CG C 13 25.050 0.04 . 1 . . . A 50 LYS CG . 25484 1 560 . 1 1 50 50 LYS CD C 13 28.850 0.04 . 1 . . . A 50 LYS CD . 25484 1 561 . 1 1 50 50 LYS CE C 13 42.410 0.04 . 1 . . . A 50 LYS CE . 25484 1 562 . 1 1 50 50 LYS N N 15 128.350 0.04 . 1 . . . A 50 LYS N . 25484 1 563 . 1 1 51 51 ARG H H 1 8.558 0.04 . 1 . . . A 51 ARG H . 25484 1 564 . 1 1 51 51 ARG HA H 1 4.428 0.04 . 1 . . . A 51 ARG HA . 25484 1 565 . 1 1 51 51 ARG HB2 H 1 1.837 0.04 . 1 . . . A 51 ARG HB2 . 25484 1 566 . 1 1 51 51 ARG HB3 H 1 1.890 0.04 . 1 . . . A 51 ARG HB3 . 25484 1 567 . 1 1 51 51 ARG HG2 H 1 1.760 0.04 . 1 . . . A 51 ARG HG2 . 25484 1 568 . 1 1 51 51 ARG HG3 H 1 1.810 0.04 . 1 . . . A 51 ARG HG3 . 25484 1 569 . 1 1 51 51 ARG HD2 H 1 3.330 0.04 . 1 . . . A 51 ARG HD2 . 25484 1 570 . 1 1 51 51 ARG HD3 H 1 3.330 0.04 . 1 . . . A 51 ARG HD3 . 25484 1 571 . 1 1 51 51 ARG C C 13 177.410 0.04 . 1 . . . A 51 ARG C . 25484 1 572 . 1 1 51 51 ARG CA C 13 57.750 0.04 . 1 . . . A 51 ARG CA . 25484 1 573 . 1 1 51 51 ARG CB C 13 31.860 0.04 . 1 . . . A 51 ARG CB . 25484 1 574 . 1 1 51 51 ARG CG C 13 27.550 0.04 . 1 . . . A 51 ARG CG . 25484 1 575 . 1 1 51 51 ARG CD C 13 43.650 0.04 . 1 . . . A 51 ARG CD . 25484 1 576 . 1 1 51 51 ARG N N 15 122.550 0.04 . 1 . . . A 51 ARG N . 25484 1 577 . 1 1 52 52 LYS H H 1 8.490 0.04 . 1 . . . A 52 LYS H . 25484 1 578 . 1 1 52 52 LYS HA H 1 4.534 0.04 . 1 . . . A 52 LYS HA . 25484 1 579 . 1 1 52 52 LYS HB2 H 1 2.140 0.04 . 1 . . . A 52 LYS HB2 . 25484 1 580 . 1 1 52 52 LYS HB3 H 1 2.330 0.04 . 1 . . . A 52 LYS HB3 . 25484 1 581 . 1 1 52 52 LYS HG2 H 1 1.650 0.04 . 1 . . . A 52 LYS HG2 . 25484 1 582 . 1 1 52 52 LYS HG3 H 1 1.420 0.04 . 1 . . . A 52 LYS HG3 . 25484 1 583 . 1 1 52 52 LYS HD2 H 1 2.080 0.04 . 1 . . . A 52 LYS HD2 . 25484 1 584 . 1 1 52 52 LYS HD3 H 1 1.820 0.04 . 1 . . . A 52 LYS HD3 . 25484 1 585 . 1 1 52 52 LYS HE2 H 1 3.210 0.04 . 1 . . . A 52 LYS HE2 . 25484 1 586 . 1 1 52 52 LYS HE3 H 1 3.210 0.04 . 1 . . . A 52 LYS HE3 . 25484 1 587 . 1 1 52 52 LYS C C 13 177.610 0.04 . 1 . . . A 52 LYS C . 25484 1 588 . 1 1 52 52 LYS CA C 13 57.970 0.04 . 1 . . . A 52 LYS CA . 25484 1 589 . 1 1 52 52 LYS CB C 13 32.350 0.04 . 1 . . . A 52 LYS CB . 25484 1 590 . 1 1 52 52 LYS CG C 13 25.050 0.04 . 1 . . . A 52 LYS CG . 25484 1 591 . 1 1 52 52 LYS CD C 13 29.350 0.04 . 1 . . . A 52 LYS CD . 25484 1 592 . 1 1 52 52 LYS CE C 13 42.650 0.04 . 1 . . . A 52 LYS CE . 25484 1 593 . 1 1 52 52 LYS N N 15 119.040 0.04 . 1 . . . A 52 LYS N . 25484 1 594 . 1 1 53 53 THR H H 1 7.760 0.04 . 1 . . . A 53 THR H . 25484 1 595 . 1 1 53 53 THR HA H 1 4.160 0.04 . 1 . . . A 53 THR HA . 25484 1 596 . 1 1 53 53 THR HB H 1 4.256 0.04 . 1 . . . A 53 THR HB . 25484 1 597 . 1 1 53 53 THR HG21 H 1 1.213 0.04 . 1 . . . A 53 THR HG21 . 25484 1 598 . 1 1 53 53 THR HG22 H 1 1.213 0.04 . 1 . . . A 53 THR HG22 . 25484 1 599 . 1 1 53 53 THR HG23 H 1 1.213 0.04 . 1 . . . A 53 THR HG23 . 25484 1 600 . 1 1 53 53 THR C C 13 175.610 0.04 . 1 . . . A 53 THR C . 25484 1 601 . 1 1 53 53 THR CA C 13 64.050 0.04 . 1 . . . A 53 THR CA . 25484 1 602 . 1 1 53 53 THR CB C 13 69.120 0.04 . 1 . . . A 53 THR CB . 25484 1 603 . 1 1 53 53 THR CG2 C 13 22.450 0.04 . 1 . . . A 53 THR CG2 . 25484 1 604 . 1 1 53 53 THR N N 15 113.034 0.04 . 1 . . . A 53 THR N . 25484 1 605 . 1 1 54 54 ASN H H 1 8.290 0.04 . 1 . . . A 54 ASN H . 25484 1 606 . 1 1 54 54 ASN HA H 1 4.920 0.04 . 1 . . . A 54 ASN HA . 25484 1 607 . 1 1 54 54 ASN HB2 H 1 2.930 0.04 . 2 . . . A 54 ASN HB2 . 25484 1 608 . 1 1 54 54 ASN HB3 H 1 2.930 0.04 . 2 . . . A 54 ASN HB3 . 25484 1 609 . 1 1 54 54 ASN C C 13 176.330 0.04 . 1 . . . A 54 ASN C . 25484 1 610 . 1 1 54 54 ASN CA C 13 53.720 0.04 . 1 . . . A 54 ASN CA . 25484 1 611 . 1 1 54 54 ASN CB C 13 38.350 0.04 . 1 . . . A 54 ASN CB . 25484 1 612 . 1 1 54 54 ASN N N 15 119.860 0.04 . 1 . . . A 54 ASN N . 25484 1 613 . 1 1 55 55 GLY H H 1 8.006 0.04 . 1 . . . A 55 GLY H . 25484 1 614 . 1 1 55 55 GLY HA2 H 1 4.030 0.04 . 1 . . . A 55 GLY HA2 . 25484 1 615 . 1 1 55 55 GLY HA3 H 1 4.030 0.04 . 1 . . . A 55 GLY HA3 . 25484 1 616 . 1 1 55 55 GLY C C 13 175.660 0.04 . 1 . . . A 55 GLY C . 25484 1 617 . 1 1 55 55 GLY CA C 13 45.938 0.04 . 1 . . . A 55 GLY CA . 25484 1 618 . 1 1 55 55 GLY N N 15 107.570 0.04 . 1 . . . A 55 GLY N . 25484 1 619 . 1 1 56 56 GLY H H 1 7.840 0.04 . 1 . . . A 56 GLY H . 25484 1 620 . 1 1 56 56 GLY HA2 H 1 4.015 0.04 . 1 . . . A 56 GLY HA2 . 25484 1 621 . 1 1 56 56 GLY HA3 H 1 4.015 0.04 . 1 . . . A 56 GLY HA3 . 25484 1 622 . 1 1 56 56 GLY C C 13 173.710 0.04 . 1 . . . A 56 GLY C . 25484 1 623 . 1 1 56 56 GLY CA C 13 45.570 0.04 . 1 . . . A 56 GLY CA . 25484 1 624 . 1 1 56 56 GLY N N 15 107.290 0.04 . 1 . . . A 56 GLY N . 25484 1 625 . 1 1 57 57 CYS H H 1 8.048 0.04 . 1 . . . A 57 CYS H . 25484 1 626 . 1 1 57 57 CYS HA H 1 4.505 0.04 . 1 . . . A 57 CYS HA . 25484 1 627 . 1 1 57 57 CYS HB2 H 1 2.901 0.04 . 1 . . . A 57 CYS HB2 . 25484 1 628 . 1 1 57 57 CYS HB3 H 1 2.978 0.04 . 1 . . . A 57 CYS HB3 . 25484 1 629 . 1 1 57 57 CYS C C 13 175.090 0.04 . 1 . . . A 57 CYS C . 25484 1 630 . 1 1 57 57 CYS CA C 13 55.950 0.04 . 1 . . . A 57 CYS CA . 25484 1 631 . 1 1 57 57 CYS CB C 13 30.760 0.04 . 1 . . . A 57 CYS CB . 25484 1 632 . 1 1 57 57 CYS N N 15 122.730 0.04 . 1 . . . A 57 CYS N . 25484 1 633 . 1 1 58 58 PRO HA H 1 4.338 0.04 . 1 . . . A 58 PRO HA . 25484 1 634 . 1 1 58 58 PRO HB2 H 1 2.020 0.04 . 1 . . . A 58 PRO HB2 . 25484 1 635 . 1 1 58 58 PRO HB3 H 1 2.420 0.04 . 1 . . . A 58 PRO HB3 . 25484 1 636 . 1 1 58 58 PRO HG2 H 1 2.107 0.04 . 1 . . . A 58 PRO HG2 . 25484 1 637 . 1 1 58 58 PRO HG3 H 1 2.215 0.04 . 1 . . . A 58 PRO HG3 . 25484 1 638 . 1 1 58 58 PRO HD2 H 1 3.815 0.04 . 1 . . . A 58 PRO HD2 . 25484 1 639 . 1 1 58 58 PRO HD3 H 1 4.085 0.04 . 1 . . . A 58 PRO HD3 . 25484 1 640 . 1 1 58 58 PRO CA C 13 65.050 0.04 . 1 . . . A 58 PRO CA . 25484 1 641 . 1 1 58 58 PRO CB C 13 32.620 0.04 . 1 . . . A 58 PRO CB . 25484 1 642 . 1 1 58 58 PRO CG C 13 27.855 0.04 . 1 . . . A 58 PRO CG . 25484 1 643 . 1 1 58 58 PRO CD C 13 51.150 0.04 . 1 . . . A 58 PRO CD . 25484 1 644 . 1 1 59 59 ILE H H 1 7.900 0.04 . 1 . . . A 59 ILE H . 25484 1 645 . 1 1 59 59 ILE HA H 1 3.818 0.04 . 1 . . . A 59 ILE HA . 25484 1 646 . 1 1 59 59 ILE HB H 1 1.547 0.04 . 1 . . . A 59 ILE HB . 25484 1 647 . 1 1 59 59 ILE HG12 H 1 0.935 0.04 . 1 . . . A 59 ILE HG12 . 25484 1 648 . 1 1 59 59 ILE HG13 H 1 1.435 0.04 . 1 . . . A 59 ILE HG13 . 25484 1 649 . 1 1 59 59 ILE HG21 H 1 0.725 0.04 . 1 . . . A 59 ILE HG21 . 25484 1 650 . 1 1 59 59 ILE HG22 H 1 0.725 0.04 . 1 . . . A 59 ILE HG22 . 25484 1 651 . 1 1 59 59 ILE HG23 H 1 0.725 0.04 . 1 . . . A 59 ILE HG23 . 25484 1 652 . 1 1 59 59 ILE HD11 H 1 0.480 0.04 . 1 . . . A 59 ILE HD11 . 25484 1 653 . 1 1 59 59 ILE HD12 H 1 0.480 0.04 . 1 . . . A 59 ILE HD12 . 25484 1 654 . 1 1 59 59 ILE HD13 H 1 0.480 0.04 . 1 . . . A 59 ILE HD13 . 25484 1 655 . 1 1 59 59 ILE C C 13 178.820 0.04 . 1 . . . A 59 ILE C . 25484 1 656 . 1 1 59 59 ILE CA C 13 64.590 0.04 . 1 . . . A 59 ILE CA . 25484 1 657 . 1 1 59 59 ILE CB C 13 38.890 0.04 . 1 . . . A 59 ILE CB . 25484 1 658 . 1 1 59 59 ILE CG1 C 13 28.100 0.04 . 1 . . . A 59 ILE CG1 . 25484 1 659 . 1 1 59 59 ILE CG2 C 13 18.650 0.04 . 1 . . . A 59 ILE CG2 . 25484 1 660 . 1 1 59 59 ILE CD1 C 13 12.850 0.04 . 1 . . . A 59 ILE CD1 . 25484 1 661 . 1 1 59 59 ILE N N 15 121.256 0.04 . 1 . . . A 59 ILE N . 25484 1 662 . 1 1 60 60 CYS H H 1 8.914 0.04 . 1 . . . A 60 CYS H . 25484 1 663 . 1 1 60 60 CYS HA H 1 4.117 0.04 . 1 . . . A 60 CYS HA . 25484 1 664 . 1 1 60 60 CYS HB2 H 1 2.806 0.04 . 1 . . . A 60 CYS HB2 . 25484 1 665 . 1 1 60 60 CYS HB3 H 1 3.005 0.04 . 1 . . . A 60 CYS HB3 . 25484 1 666 . 1 1 60 60 CYS C C 13 178.110 0.04 . 1 . . . A 60 CYS C . 25484 1 667 . 1 1 60 60 CYS CA C 13 66.090 0.04 . 1 . . . A 60 CYS CA . 25484 1 668 . 1 1 60 60 CYS CB C 13 29.150 0.04 . 1 . . . A 60 CYS CB . 25484 1 669 . 1 1 60 60 CYS N N 15 123.970 0.04 . 1 . . . A 60 CYS N . 25484 1 670 . 1 1 61 61 LYS H H 1 8.090 0.04 . 1 . . . A 61 LYS H . 25484 1 671 . 1 1 61 61 LYS HA H 1 3.910 0.04 . 1 . . . A 61 LYS HA . 25484 1 672 . 1 1 61 61 LYS HB2 H 1 1.780 0.04 . 1 . . . A 61 LYS HB2 . 25484 1 673 . 1 1 61 61 LYS HB3 H 1 1.890 0.04 . 1 . . . A 61 LYS HB3 . 25484 1 674 . 1 1 61 61 LYS HG2 H 1 1.400 0.04 . 1 . . . A 61 LYS HG2 . 25484 1 675 . 1 1 61 61 LYS HG3 H 1 1.550 0.04 . 1 . . . A 61 LYS HG3 . 25484 1 676 . 1 1 61 61 LYS HD2 H 1 1.640 0.04 . 2 . . . A 61 LYS HD2 . 25484 1 677 . 1 1 61 61 LYS HD3 H 1 1.640 0.04 . 2 . . . A 61 LYS HD3 . 25484 1 678 . 1 1 61 61 LYS HE2 H 1 2.950 0.04 . 2 . . . A 61 LYS HE2 . 25484 1 679 . 1 1 61 61 LYS HE3 H 1 2.950 0.04 . 2 . . . A 61 LYS HE3 . 25484 1 680 . 1 1 61 61 LYS C C 13 179.460 0.04 . 1 . . . A 61 LYS C . 25484 1 681 . 1 1 61 61 LYS CA C 13 59.970 0.04 . 1 . . . A 61 LYS CA . 25484 1 682 . 1 1 61 61 LYS CB C 13 32.650 0.04 . 1 . . . A 61 LYS CB . 25484 1 683 . 1 1 61 61 LYS CG C 13 25.350 0.04 . 1 . . . A 61 LYS CG . 25484 1 684 . 1 1 61 61 LYS CD C 13 29.550 0.04 . 1 . . . A 61 LYS CD . 25484 1 685 . 1 1 61 61 LYS CE C 13 42.150 0.04 . 1 . . . A 61 LYS CE . 25484 1 686 . 1 1 61 61 LYS N N 15 117.210 0.04 . 1 . . . A 61 LYS N . 25484 1 687 . 1 1 62 62 GLN H H 1 7.360 0.04 . 1 . . . A 62 GLN H . 25484 1 688 . 1 1 62 62 GLN HA H 1 4.203 0.04 . 1 . . . A 62 GLN HA . 25484 1 689 . 1 1 62 62 GLN HB2 H 1 2.000 0.04 . 1 . . . A 62 GLN HB2 . 25484 1 690 . 1 1 62 62 GLN HB3 H 1 2.000 0.04 . 1 . . . A 62 GLN HB3 . 25484 1 691 . 1 1 62 62 GLN HG2 H 1 2.270 0.04 . 1 . . . A 62 GLN HG2 . 25484 1 692 . 1 1 62 62 GLN HG3 H 1 2.480 0.04 . 1 . . . A 62 GLN HG3 . 25484 1 693 . 1 1 62 62 GLN C C 13 178.564 0.04 . 1 . . . A 62 GLN C . 25484 1 694 . 1 1 62 62 GLN CA C 13 58.450 0.04 . 1 . . . A 62 GLN CA . 25484 1 695 . 1 1 62 62 GLN CB C 13 29.140 0.04 . 1 . . . A 62 GLN CB . 25484 1 696 . 1 1 62 62 GLN CG C 13 34.350 0.04 . 1 . . . A 62 GLN CG . 25484 1 697 . 1 1 62 62 GLN N N 15 117.780 0.04 . 1 . . . A 62 GLN N . 25484 1 698 . 1 1 63 63 LEU H H 1 8.075 0.04 . 1 . . . A 63 LEU H . 25484 1 699 . 1 1 63 63 LEU HA H 1 4.218 0.04 . 1 . . . A 63 LEU HA . 25484 1 700 . 1 1 63 63 LEU HB2 H 1 1.960 0.04 . 2 . . . A 63 LEU HB2 . 25484 1 701 . 1 1 63 63 LEU HB3 H 1 1.960 0.04 . 2 . . . A 63 LEU HB3 . 25484 1 702 . 1 1 63 63 LEU HG H 1 1.925 0.04 . 1 . . . A 63 LEU HG . 25484 1 703 . 1 1 63 63 LEU HD11 H 1 1.054 0.04 . 1 . . . A 63 LEU HD11 . 25484 1 704 . 1 1 63 63 LEU HD12 H 1 1.054 0.04 . 1 . . . A 63 LEU HD12 . 25484 1 705 . 1 1 63 63 LEU HD13 H 1 1.054 0.04 . 1 . . . A 63 LEU HD13 . 25484 1 706 . 1 1 63 63 LEU HD21 H 1 1.025 0.04 . 1 . . . A 63 LEU HD21 . 25484 1 707 . 1 1 63 63 LEU HD22 H 1 1.025 0.04 . 1 . . . A 63 LEU HD22 . 25484 1 708 . 1 1 63 63 LEU HD23 H 1 1.025 0.04 . 1 . . . A 63 LEU HD23 . 25484 1 709 . 1 1 63 63 LEU C C 13 179.440 0.04 . 1 . . . A 63 LEU C . 25484 1 710 . 1 1 63 63 LEU CA C 13 58.550 0.04 . 1 . . . A 63 LEU CA . 25484 1 711 . 1 1 63 63 LEU CB C 13 41.910 0.04 . 1 . . . A 63 LEU CB . 25484 1 712 . 1 1 63 63 LEU CG C 13 27.750 0.04 . 1 . . . A 63 LEU CG . 25484 1 713 . 1 1 63 63 LEU CD1 C 13 25.350 0.04 . 1 . . . A 63 LEU CD1 . 25484 1 714 . 1 1 63 63 LEU CD2 C 13 24.850 0.04 . 1 . . . A 63 LEU CD2 . 25484 1 715 . 1 1 63 63 LEU N N 15 119.930 0.04 . 1 . . . A 63 LEU N . 25484 1 716 . 1 1 64 64 ILE H H 1 8.466 0.04 . 1 . . . A 64 ILE H . 25484 1 717 . 1 1 64 64 ILE HA H 1 3.600 0.04 . 1 . . . A 64 ILE HA . 25484 1 718 . 1 1 64 64 ILE HB H 1 1.489 0.04 . 1 . . . A 64 ILE HB . 25484 1 719 . 1 1 64 64 ILE HG12 H 1 0.445 0.04 . 1 . . . A 64 ILE HG12 . 25484 1 720 . 1 1 64 64 ILE HG13 H 1 1.115 0.04 . 1 . . . A 64 ILE HG13 . 25484 1 721 . 1 1 64 64 ILE HG21 H 1 0.827 0.04 . 1 . . . A 64 ILE HG21 . 25484 1 722 . 1 1 64 64 ILE HG22 H 1 0.827 0.04 . 1 . . . A 64 ILE HG22 . 25484 1 723 . 1 1 64 64 ILE HG23 H 1 0.827 0.04 . 1 . . . A 64 ILE HG23 . 25484 1 724 . 1 1 64 64 ILE HD11 H 1 0.449 0.04 . 1 . . . A 64 ILE HD11 . 25484 1 725 . 1 1 64 64 ILE HD12 H 1 0.449 0.04 . 1 . . . A 64 ILE HD12 . 25484 1 726 . 1 1 64 64 ILE HD13 H 1 0.449 0.04 . 1 . . . A 64 ILE HD13 . 25484 1 727 . 1 1 64 64 ILE C C 13 177.950 0.04 . 1 . . . A 64 ILE C . 25484 1 728 . 1 1 64 64 ILE CA C 13 65.250 0.04 . 1 . . . A 64 ILE CA . 25484 1 729 . 1 1 64 64 ILE CB C 13 37.320 0.04 . 1 . . . A 64 ILE CB . 25484 1 730 . 1 1 64 64 ILE CG1 C 13 29.850 0.04 . 1 . . . A 64 ILE CG1 . 25484 1 731 . 1 1 64 64 ILE CG2 C 13 17.200 0.04 . 1 . . . A 64 ILE CG2 . 25484 1 732 . 1 1 64 64 ILE CD1 C 13 13.450 0.04 . 1 . . . A 64 ILE CD1 . 25484 1 733 . 1 1 64 64 ILE N N 15 120.280 0.04 . 1 . . . A 64 ILE N . 25484 1 734 . 1 1 65 65 ALA H H 1 7.496 0.04 . 1 . . . A 65 ALA H . 25484 1 735 . 1 1 65 65 ALA HA H 1 4.185 0.04 . 1 . . . A 65 ALA HA . 25484 1 736 . 1 1 65 65 ALA HB1 H 1 1.550 0.04 . 1 . . . A 65 ALA HB1 . 25484 1 737 . 1 1 65 65 ALA HB2 H 1 1.550 0.04 . 1 . . . A 65 ALA HB2 . 25484 1 738 . 1 1 65 65 ALA HB3 H 1 1.550 0.04 . 1 . . . A 65 ALA HB3 . 25484 1 739 . 1 1 65 65 ALA C C 13 181.010 0.04 . 1 . . . A 65 ALA C . 25484 1 740 . 1 1 65 65 ALA CA C 13 55.220 0.04 . 1 . . . A 65 ALA CA . 25484 1 741 . 1 1 65 65 ALA CB C 13 18.450 0.04 . 1 . . . A 65 ALA CB . 25484 1 742 . 1 1 65 65 ALA N N 15 122.590 0.04 . 1 . . . A 65 ALA N . 25484 1 743 . 1 1 66 66 LEU H H 1 8.139 0.04 . 1 . . . A 66 LEU H . 25484 1 744 . 1 1 66 66 LEU HA H 1 4.100 0.04 . 1 . . . A 66 LEU HA . 25484 1 745 . 1 1 66 66 LEU HB2 H 1 1.598 0.04 . 1 . . . A 66 LEU HB2 . 25484 1 746 . 1 1 66 66 LEU HB3 H 1 1.766 0.04 . 1 . . . A 66 LEU HB3 . 25484 1 747 . 1 1 66 66 LEU HG H 1 1.804 0.04 . 1 . . . A 66 LEU HG . 25484 1 748 . 1 1 66 66 LEU HD11 H 1 0.973 0.04 . 1 . . . A 66 LEU HD11 . 25484 1 749 . 1 1 66 66 LEU HD12 H 1 0.973 0.04 . 1 . . . A 66 LEU HD12 . 25484 1 750 . 1 1 66 66 LEU HD13 H 1 0.973 0.04 . 1 . . . A 66 LEU HD13 . 25484 1 751 . 1 1 66 66 LEU HD21 H 1 0.970 0.04 . 1 . . . A 66 LEU HD21 . 25484 1 752 . 1 1 66 66 LEU HD22 H 1 0.970 0.04 . 1 . . . A 66 LEU HD22 . 25484 1 753 . 1 1 66 66 LEU HD23 H 1 0.970 0.04 . 1 . . . A 66 LEU HD23 . 25484 1 754 . 1 1 66 66 LEU C C 13 179.380 0.04 . 1 . . . A 66 LEU C . 25484 1 755 . 1 1 66 66 LEU CA C 13 57.930 0.04 . 1 . . . A 66 LEU CA . 25484 1 756 . 1 1 66 66 LEU CB C 13 41.410 0.04 . 1 . . . A 66 LEU CB . 25484 1 757 . 1 1 66 66 LEU CG C 13 27.550 0.04 . 1 . . . A 66 LEU CG . 25484 1 758 . 1 1 66 66 LEU CD1 C 13 25.150 0.04 . 1 . . . A 66 LEU CD1 . 25484 1 759 . 1 1 66 66 LEU CD2 C 13 24.050 0.04 . 1 . . . A 66 LEU CD2 . 25484 1 760 . 1 1 66 66 LEU N N 15 115.599 0.04 . 1 . . . A 66 LEU N . 25484 1 761 . 1 1 67 67 ALA H H 1 8.770 0.04 . 1 . . . A 67 ALA H . 25484 1 762 . 1 1 67 67 ALA HA H 1 3.958 0.04 . 1 . . . A 67 ALA HA . 25484 1 763 . 1 1 67 67 ALA HB1 H 1 1.695 0.04 . 1 . . . A 67 ALA HB1 . 25484 1 764 . 1 1 67 67 ALA HB2 H 1 1.695 0.04 . 1 . . . A 67 ALA HB2 . 25484 1 765 . 1 1 67 67 ALA HB3 H 1 1.695 0.04 . 1 . . . A 67 ALA HB3 . 25484 1 766 . 1 1 67 67 ALA C C 13 180.060 0.04 . 1 . . . A 67 ALA C . 25484 1 767 . 1 1 67 67 ALA CA C 13 55.750 0.04 . 1 . . . A 67 ALA CA . 25484 1 768 . 1 1 67 67 ALA CB C 13 19.220 0.04 . 1 . . . A 67 ALA CB . 25484 1 769 . 1 1 67 67 ALA N N 15 122.670 0.04 . 1 . . . A 67 ALA N . 25484 1 770 . 1 1 68 68 ALA H H 1 8.604 0.04 . 1 . . . A 68 ALA H . 25484 1 771 . 1 1 68 68 ALA HA H 1 4.142 0.04 . 1 . . . A 68 ALA HA . 25484 1 772 . 1 1 68 68 ALA HB1 H 1 1.542 0.04 . 1 . . . A 68 ALA HB1 . 25484 1 773 . 1 1 68 68 ALA HB2 H 1 1.542 0.04 . 1 . . . A 68 ALA HB2 . 25484 1 774 . 1 1 68 68 ALA HB3 H 1 1.542 0.04 . 1 . . . A 68 ALA HB3 . 25484 1 775 . 1 1 68 68 ALA C C 13 179.540 0.04 . 1 . . . A 68 ALA C . 25484 1 776 . 1 1 68 68 ALA CA C 13 55.450 0.04 . 1 . . . A 68 ALA CA . 25484 1 777 . 1 1 68 68 ALA CB C 13 18.220 0.04 . 1 . . . A 68 ALA CB . 25484 1 778 . 1 1 68 68 ALA N N 15 120.580 0.04 . 1 . . . A 68 ALA N . 25484 1 779 . 1 1 69 69 TYR HA H 1 4.345 0.04 . 1 . . . A 69 TYR HA . 25484 1 780 . 1 1 69 69 TYR HB2 H 1 2.850 0.04 . 1 . . . A 69 TYR HB2 . 25484 1 781 . 1 1 69 69 TYR HB3 H 1 2.968 0.04 . 1 . . . A 69 TYR HB3 . 25484 1 782 . 1 1 69 69 TYR CA C 13 57.750 0.04 . 1 . . . A 69 TYR CA . 25484 1 783 . 1 1 69 69 TYR CB C 13 38.580 0.04 . 1 . . . A 69 TYR CB . 25484 1 784 . 1 1 71 71 ALA HA H 1 4.000 0.04 . 1 . . . A 71 ALA HA . 25484 1 785 . 1 1 71 71 ALA HB1 H 1 1.625 0.04 . 1 . . . A 71 ALA HB1 . 25484 1 786 . 1 1 71 71 ALA HB2 H 1 1.625 0.04 . 1 . . . A 71 ALA HB2 . 25484 1 787 . 1 1 71 71 ALA HB3 H 1 1.625 0.04 . 1 . . . A 71 ALA HB3 . 25484 1 788 . 1 1 71 71 ALA C C 13 179.540 0.04 . 1 . . . A 71 ALA C . 25484 1 789 . 1 1 71 71 ALA CA C 13 54.850 0.04 . 1 . . . A 71 ALA CA . 25484 1 790 . 1 1 71 71 ALA CB C 13 19.650 0.04 . 1 . . . A 71 ALA CB . 25484 1 791 . 1 1 72 72 LYS H H 1 7.080 0.04 . 1 . . . A 72 LYS H . 25484 1 792 . 1 1 72 72 LYS HA H 1 3.904 0.04 . 1 . . . A 72 LYS HA . 25484 1 793 . 1 1 72 72 LYS HB2 H 1 1.495 0.04 . 1 . . . A 72 LYS HB2 . 25484 1 794 . 1 1 72 72 LYS HB3 H 1 1.622 0.04 . 1 . . . A 72 LYS HB3 . 25484 1 795 . 1 1 72 72 LYS HG2 H 1 1.260 0.04 . 1 . . . A 72 LYS HG2 . 25484 1 796 . 1 1 72 72 LYS HG3 H 1 1.370 0.04 . 1 . . . A 72 LYS HG3 . 25484 1 797 . 1 1 72 72 LYS HD2 H 1 1.380 0.04 . 1 . . . A 72 LYS HD2 . 25484 1 798 . 1 1 72 72 LYS HD3 H 1 1.380 0.04 . 1 . . . A 72 LYS HD3 . 25484 1 799 . 1 1 72 72 LYS HE2 H 1 2.946 0.04 . 1 . . . A 72 LYS HE2 . 25484 1 800 . 1 1 72 72 LYS HE3 H 1 2.946 0.04 . 1 . . . A 72 LYS HE3 . 25484 1 801 . 1 1 72 72 LYS C C 13 177.120 0.04 . 1 . . . A 72 LYS C . 25484 1 802 . 1 1 72 72 LYS CA C 13 58.230 0.04 . 1 . . . A 72 LYS CA . 25484 1 803 . 1 1 72 72 LYS CB C 13 32.340 0.04 . 1 . . . A 72 LYS CB . 25484 1 804 . 1 1 72 72 LYS CG C 13 24.540 0.04 . 1 . . . A 72 LYS CG . 25484 1 805 . 1 1 72 72 LYS CD C 13 25.360 0.04 . 1 . . . A 72 LYS CD . 25484 1 806 . 1 1 72 72 LYS CE C 13 42.050 0.04 . 1 . . . A 72 LYS CE . 25484 1 807 . 1 1 72 72 LYS N N 15 114.680 0.04 . 1 . . . A 72 LYS N . 25484 1 808 . 1 1 73 73 HIS H H 1 7.250 0.04 . 1 . . . A 73 HIS H . 25484 1 809 . 1 1 73 73 HIS HA H 1 4.826 0.04 . 1 . . . A 73 HIS HA . 25484 1 810 . 1 1 73 73 HIS HB2 H 1 2.940 0.04 . 1 . . . A 73 HIS HB2 . 25484 1 811 . 1 1 73 73 HIS HB3 H 1 3.445 0.04 . 1 . . . A 73 HIS HB3 . 25484 1 812 . 1 1 73 73 HIS C C 13 173.660 0.04 . 1 . . . A 73 HIS C . 25484 1 813 . 1 1 73 73 HIS CA C 13 54.380 0.04 . 1 . . . A 73 HIS CA . 25484 1 814 . 1 1 73 73 HIS CB C 13 30.350 0.04 . 1 . . . A 73 HIS CB . 25484 1 815 . 1 1 73 73 HIS N N 15 113.498 0.04 . 1 . . . A 73 HIS N . 25484 1 816 . 1 1 74 74 CYS H H 1 7.140 0.04 . 1 . . . A 74 CYS H . 25484 1 817 . 1 1 74 74 CYS HA H 1 4.150 0.04 . 1 . . . A 74 CYS HA . 25484 1 818 . 1 1 74 74 CYS HB2 H 1 1.820 0.04 . 1 . . . A 74 CYS HB2 . 25484 1 819 . 1 1 74 74 CYS HB3 H 1 2.480 0.04 . 1 . . . A 74 CYS HB3 . 25484 1 820 . 1 1 74 74 CYS C C 13 176.480 0.04 . 1 . . . A 74 CYS C . 25484 1 821 . 1 1 74 74 CYS CA C 13 60.250 0.04 . 1 . . . A 74 CYS CA . 25484 1 822 . 1 1 74 74 CYS CB C 13 29.930 0.04 . 1 . . . A 74 CYS CB . 25484 1 823 . 1 1 74 74 CYS N N 15 123.830 0.04 . 1 . . . A 74 CYS N . 25484 1 824 . 1 1 75 75 GLN H H 1 9.088 0.04 . 1 . . . A 75 GLN H . 25484 1 825 . 1 1 75 75 GLN HA H 1 4.685 0.04 . 1 . . . A 75 GLN HA . 25484 1 826 . 1 1 75 75 GLN HB2 H 1 2.347 0.04 . 2 . . . A 75 GLN HB2 . 25484 1 827 . 1 1 75 75 GLN HB3 H 1 2.347 0.04 . 2 . . . A 75 GLN HB3 . 25484 1 828 . 1 1 75 75 GLN HG2 H 1 2.370 0.04 . 1 . . . A 75 GLN HG2 . 25484 1 829 . 1 1 75 75 GLN HG3 H 1 2.370 0.04 . 1 . . . A 75 GLN HG3 . 25484 1 830 . 1 1 75 75 GLN C C 13 176.090 0.04 . 1 . . . A 75 GLN C . 25484 1 831 . 1 1 75 75 GLN CA C 13 54.900 0.04 . 1 . . . A 75 GLN CA . 25484 1 832 . 1 1 75 75 GLN CB C 13 29.840 0.04 . 1 . . . A 75 GLN CB . 25484 1 833 . 1 1 75 75 GLN CG C 13 33.850 0.04 . 1 . . . A 75 GLN CG . 25484 1 834 . 1 1 75 75 GLN N N 15 128.740 0.04 . 1 . . . A 75 GLN N . 25484 1 835 . 1 1 76 76 GLU H H 1 8.390 0.04 . 1 . . . A 76 GLU H . 25484 1 836 . 1 1 76 76 GLU HA H 1 4.480 0.04 . 1 . . . A 76 GLU HA . 25484 1 837 . 1 1 76 76 GLU HB2 H 1 2.150 0.04 . 1 . . . A 76 GLU HB2 . 25484 1 838 . 1 1 76 76 GLU HB3 H 1 2.080 0.04 . 1 . . . A 76 GLU HB3 . 25484 1 839 . 1 1 76 76 GLU HG2 H 1 2.480 0.04 . 1 . . . A 76 GLU HG2 . 25484 1 840 . 1 1 76 76 GLU HG3 H 1 2.480 0.04 . 1 . . . A 76 GLU HG3 . 25484 1 841 . 1 1 76 76 GLU C C 13 177.030 0.04 . 1 . . . A 76 GLU C . 25484 1 842 . 1 1 76 76 GLU CA C 13 56.210 0.04 . 1 . . . A 76 GLU CA . 25484 1 843 . 1 1 76 76 GLU CB C 13 30.660 0.04 . 1 . . . A 76 GLU CB . 25484 1 844 . 1 1 76 76 GLU CG C 13 34.350 0.04 . 1 . . . A 76 GLU CG . 25484 1 845 . 1 1 76 76 GLU N N 15 123.190 0.04 . 1 . . . A 76 GLU N . 25484 1 846 . 1 1 77 77 ASN H H 1 8.848 0.04 . 1 . . . A 77 ASN H . 25484 1 847 . 1 1 77 77 ASN HA H 1 4.549 0.04 . 1 . . . A 77 ASN HA . 25484 1 848 . 1 1 77 77 ASN HB2 H 1 2.855 0.04 . 2 . . . A 77 ASN HB2 . 25484 1 849 . 1 1 77 77 ASN HB3 H 1 2.855 0.04 . 2 . . . A 77 ASN HB3 . 25484 1 850 . 1 1 77 77 ASN C C 13 176.070 0.04 . 1 . . . A 77 ASN C . 25484 1 851 . 1 1 77 77 ASN CA C 13 55.100 0.04 . 1 . . . A 77 ASN CA . 25484 1 852 . 1 1 77 77 ASN CB C 13 38.650 0.04 . 1 . . . A 77 ASN CB . 25484 1 853 . 1 1 77 77 ASN N N 15 124.760 0.04 . 1 . . . A 77 ASN N . 25484 1 854 . 1 1 78 78 LYS H H 1 8.636 0.04 . 1 . . . A 78 LYS H . 25484 1 855 . 1 1 78 78 LYS HA H 1 4.460 0.04 . 1 . . . A 78 LYS HA . 25484 1 856 . 1 1 78 78 LYS HB2 H 1 1.690 0.04 . 1 . . . A 78 LYS HB2 . 25484 1 857 . 1 1 78 78 LYS HB3 H 1 1.960 0.04 . 1 . . . A 78 LYS HB3 . 25484 1 858 . 1 1 78 78 LYS HG2 H 1 1.380 0.04 . 1 . . . A 78 LYS HG2 . 25484 1 859 . 1 1 78 78 LYS HG3 H 1 1.441 0.04 . 1 . . . A 78 LYS HG3 . 25484 1 860 . 1 1 78 78 LYS HD2 H 1 1.740 0.04 . 1 . . . A 78 LYS HD2 . 25484 1 861 . 1 1 78 78 LYS HD3 H 1 1.740 0.04 . 1 . . . A 78 LYS HD3 . 25484 1 862 . 1 1 78 78 LYS HE2 H 1 3.044 0.04 . 1 . . . A 78 LYS HE2 . 25484 1 863 . 1 1 78 78 LYS HE3 H 1 3.044 0.04 . 1 . . . A 78 LYS HE3 . 25484 1 864 . 1 1 78 78 LYS C C 13 175.230 0.04 . 1 . . . A 78 LYS C . 25484 1 865 . 1 1 78 78 LYS CA C 13 54.920 0.04 . 1 . . . A 78 LYS CA . 25484 1 866 . 1 1 78 78 LYS CB C 13 31.020 0.04 . 1 . . . A 78 LYS CB . 25484 1 867 . 1 1 78 78 LYS CG C 13 24.250 0.04 . 1 . . . A 78 LYS CG . 25484 1 868 . 1 1 78 78 LYS CD C 13 28.950 0.04 . 1 . . . A 78 LYS CD . 25484 1 869 . 1 1 78 78 LYS CE C 13 42.050 0.04 . 1 . . . A 78 LYS CE . 25484 1 870 . 1 1 78 78 LYS N N 15 120.810 0.04 . 1 . . . A 78 LYS N . 25484 1 871 . 1 1 80 80 PRO HA H 1 4.710 0.04 . 1 . . . A 80 PRO HA . 25484 1 872 . 1 1 80 80 PRO HB2 H 1 2.080 0.04 . 1 . . . A 80 PRO HB2 . 25484 1 873 . 1 1 80 80 PRO HB3 H 1 2.170 0.04 . 1 . . . A 80 PRO HB3 . 25484 1 874 . 1 1 80 80 PRO HG2 H 1 1.690 0.04 . 1 . . . A 80 PRO HG2 . 25484 1 875 . 1 1 80 80 PRO HG3 H 1 2.080 0.04 . 1 . . . A 80 PRO HG3 . 25484 1 876 . 1 1 80 80 PRO HD2 H 1 3.880 0.04 . 1 . . . A 80 PRO HD2 . 25484 1 877 . 1 1 80 80 PRO HD3 H 1 4.214 0.04 . 1 . . . A 80 PRO HD3 . 25484 1 878 . 1 1 80 80 PRO CA C 13 62.850 0.04 . 1 . . . A 80 PRO CA . 25484 1 879 . 1 1 80 80 PRO CB C 13 32.150 0.04 . 1 . . . A 80 PRO CB . 25484 1 880 . 1 1 80 80 PRO CG C 13 26.950 0.04 . 1 . . . A 80 PRO CG . 25484 1 881 . 1 1 80 80 PRO CD C 13 51.450 0.04 . 1 . . . A 80 PRO CD . 25484 1 882 . 1 1 81 81 VAL HA H 1 3.578 0.04 . 1 . . . A 81 VAL HA . 25484 1 883 . 1 1 81 81 VAL HB H 1 2.230 0.04 . 1 . . . A 81 VAL HB . 25484 1 884 . 1 1 81 81 VAL HG11 H 1 0.691 0.04 . 1 . . . A 81 VAL HG11 . 25484 1 885 . 1 1 81 81 VAL HG12 H 1 0.691 0.04 . 1 . . . A 81 VAL HG12 . 25484 1 886 . 1 1 81 81 VAL HG13 H 1 0.691 0.04 . 1 . . . A 81 VAL HG13 . 25484 1 887 . 1 1 81 81 VAL HG21 H 1 0.441 0.04 . 1 . . . A 81 VAL HG21 . 25484 1 888 . 1 1 81 81 VAL HG22 H 1 0.441 0.04 . 1 . . . A 81 VAL HG22 . 25484 1 889 . 1 1 81 81 VAL HG23 H 1 0.441 0.04 . 1 . . . A 81 VAL HG23 . 25484 1 890 . 1 1 81 81 VAL CA C 13 62.350 0.04 . 1 . . . A 81 VAL CA . 25484 1 891 . 1 1 81 81 VAL CB C 13 31.616 0.04 . 1 . . . A 81 VAL CB . 25484 1 892 . 1 1 81 81 VAL CG1 C 13 19.980 0.04 . 1 . . . A 81 VAL CG1 . 25484 1 893 . 1 1 81 81 VAL CG2 C 13 24.080 0.04 . 1 . . . A 81 VAL CG2 . 25484 1 894 . 1 1 82 82 PRO HA H 1 4.850 0.04 . 1 . . . A 82 PRO HA . 25484 1 895 . 1 1 82 82 PRO HB2 H 1 2.000 0.04 . 1 . . . A 82 PRO HB2 . 25484 1 896 . 1 1 82 82 PRO HB3 H 1 2.403 0.04 . 1 . . . A 82 PRO HB3 . 25484 1 897 . 1 1 82 82 PRO HG2 H 1 1.910 0.04 . 1 . . . A 82 PRO HG2 . 25484 1 898 . 1 1 82 82 PRO HG3 H 1 2.240 0.04 . 1 . . . A 82 PRO HG3 . 25484 1 899 . 1 1 82 82 PRO HD2 H 1 3.580 0.04 . 1 . . . A 82 PRO HD2 . 25484 1 900 . 1 1 82 82 PRO HD3 H 1 3.690 0.04 . 1 . . . A 82 PRO HD3 . 25484 1 901 . 1 1 82 82 PRO CA C 13 63.350 0.04 . 1 . . . A 82 PRO CA . 25484 1 902 . 1 1 82 82 PRO CB C 13 32.050 0.04 . 1 . . . A 82 PRO CB . 25484 1 903 . 1 1 82 82 PRO CG C 13 27.250 0.04 . 1 . . . A 82 PRO CG . 25484 1 904 . 1 1 82 82 PRO CD C 13 49.950 0.04 . 1 . . . A 82 PRO CD . 25484 1 905 . 1 1 83 83 PHE HA H 1 4.160 0.04 . 1 . . . A 83 PHE HA . 25484 1 906 . 1 1 83 83 PHE HB2 H 1 3.290 0.04 . 2 . . . A 83 PHE HB2 . 25484 1 907 . 1 1 83 83 PHE HB3 H 1 3.290 0.04 . 2 . . . A 83 PHE HB3 . 25484 1 908 . 1 1 83 83 PHE CA C 13 58.950 0.04 . 1 . . . A 83 PHE CA . 25484 1 909 . 1 1 83 83 PHE CB C 13 38.250 0.04 . 1 . . . A 83 PHE CB . 25484 1 910 . 1 1 84 84 CYS HA H 1 4.597 0.04 . 1 . . . A 84 CYS HA . 25484 1 911 . 1 1 84 84 CYS HB2 H 1 2.600 0.04 . 1 . . . A 84 CYS HB2 . 25484 1 912 . 1 1 84 84 CYS HB3 H 1 2.740 0.04 . 1 . . . A 84 CYS HB3 . 25484 1 913 . 1 1 84 84 CYS CA C 13 56.750 0.04 . 1 . . . A 84 CYS CA . 25484 1 914 . 1 1 84 84 CYS CB C 13 30.150 0.04 . 1 . . . A 84 CYS CB . 25484 1 915 . 1 1 85 85 LEU H H 1 8.220 0.04 . 1 . . . A 85 LEU H . 25484 1 916 . 1 1 85 85 LEU HA H 1 3.958 0.04 . 1 . . . A 85 LEU HA . 25484 1 917 . 1 1 85 85 LEU HB2 H 1 1.577 0.04 . 1 . . . A 85 LEU HB2 . 25484 1 918 . 1 1 85 85 LEU HB3 H 1 1.928 0.04 . 1 . . . A 85 LEU HB3 . 25484 1 919 . 1 1 85 85 LEU HG H 1 1.203 0.04 . 1 . . . A 85 LEU HG . 25484 1 920 . 1 1 85 85 LEU HD11 H 1 0.875 0.04 . 1 . . . A 85 LEU HD11 . 25484 1 921 . 1 1 85 85 LEU HD12 H 1 0.875 0.04 . 1 . . . A 85 LEU HD12 . 25484 1 922 . 1 1 85 85 LEU HD13 H 1 0.875 0.04 . 1 . . . A 85 LEU HD13 . 25484 1 923 . 1 1 85 85 LEU HD21 H 1 0.875 0.04 . 1 . . . A 85 LEU HD21 . 25484 1 924 . 1 1 85 85 LEU HD22 H 1 0.875 0.04 . 1 . . . A 85 LEU HD22 . 25484 1 925 . 1 1 85 85 LEU HD23 H 1 0.875 0.04 . 1 . . . A 85 LEU HD23 . 25484 1 926 . 1 1 85 85 LEU CA C 13 59.350 0.04 . 1 . . . A 85 LEU CA . 25484 1 927 . 1 1 85 85 LEU CB C 13 38.180 0.04 . 1 . . . A 85 LEU CB . 25484 1 928 . 1 1 85 85 LEU CG C 13 28.270 0.04 . 1 . . . A 85 LEU CG . 25484 1 929 . 1 1 85 85 LEU CD1 C 13 25.350 0.04 . 1 . . . A 85 LEU CD1 . 25484 1 930 . 1 1 85 85 LEU CD2 C 13 24.550 0.04 . 1 . . . A 85 LEU CD2 . 25484 1 931 . 1 1 85 85 LEU N N 15 119.930 0.04 . 1 . . . A 85 LEU N . 25484 1 932 . 1 1 86 86 ASN H H 1 7.789 0.04 . 1 . . . A 86 ASN H . 25484 1 933 . 1 1 86 86 ASN HA H 1 4.580 0.04 . 1 . . . A 86 ASN HA . 25484 1 934 . 1 1 86 86 ASN HB2 H 1 2.855 0.04 . 1 . . . A 86 ASN HB2 . 25484 1 935 . 1 1 86 86 ASN HB3 H 1 3.035 0.04 . 1 . . . A 86 ASN HB3 . 25484 1 936 . 1 1 86 86 ASN CA C 13 51.860 0.04 . 1 . . . A 86 ASN CA . 25484 1 937 . 1 1 86 86 ASN CB C 13 38.610 0.04 . 1 . . . A 86 ASN CB . 25484 1 938 . 1 1 86 86 ASN N N 15 115.750 0.04 . 1 . . . A 86 ASN N . 25484 1 939 . 1 1 87 87 ILE H H 1 7.160 0.04 . 1 . . . A 87 ILE H . 25484 1 940 . 1 1 87 87 ILE HA H 1 4.220 0.04 . 1 . . . A 87 ILE HA . 25484 1 941 . 1 1 87 87 ILE HB H 1 1.830 0.04 . 1 . . . A 87 ILE HB . 25484 1 942 . 1 1 87 87 ILE HG12 H 1 1.520 0.04 . 1 . . . A 87 ILE HG12 . 25484 1 943 . 1 1 87 87 ILE HG13 H 1 1.520 0.04 . 1 . . . A 87 ILE HG13 . 25484 1 944 . 1 1 87 87 ILE HG21 H 1 0.996 0.04 . 1 . . . A 87 ILE HG21 . 25484 1 945 . 1 1 87 87 ILE HG22 H 1 0.996 0.04 . 1 . . . A 87 ILE HG22 . 25484 1 946 . 1 1 87 87 ILE HG23 H 1 0.996 0.04 . 1 . . . A 87 ILE HG23 . 25484 1 947 . 1 1 87 87 ILE HD11 H 1 0.670 0.04 . 1 . . . A 87 ILE HD11 . 25484 1 948 . 1 1 87 87 ILE HD12 H 1 0.670 0.04 . 1 . . . A 87 ILE HD12 . 25484 1 949 . 1 1 87 87 ILE HD13 H 1 0.670 0.04 . 1 . . . A 87 ILE HD13 . 25484 1 950 . 1 1 87 87 ILE CA C 13 61.850 0.04 . 1 . . . A 87 ILE CA . 25484 1 951 . 1 1 87 87 ILE CB C 13 41.330 0.04 . 1 . . . A 87 ILE CB . 25484 1 952 . 1 1 87 87 ILE N N 15 123.260 0.04 . 1 . . . A 87 ILE N . 25484 1 953 . 1 1 88 88 LYS HA H 1 4.450 0.04 . 1 . . . A 88 LYS HA . 25484 1 954 . 1 1 88 88 LYS HB2 H 1 1.960 0.04 . 1 . . . A 88 LYS HB2 . 25484 1 955 . 1 1 88 88 LYS HB3 H 1 1.960 0.04 . 1 . . . A 88 LYS HB3 . 25484 1 956 . 1 1 88 88 LYS HG2 H 1 1.384 0.04 . 1 . . . A 88 LYS HG2 . 25484 1 957 . 1 1 88 88 LYS HG3 H 1 1.446 0.04 . 1 . . . A 88 LYS HG3 . 25484 1 958 . 1 1 88 88 LYS HD2 H 1 1.750 0.04 . 1 . . . A 88 LYS HD2 . 25484 1 959 . 1 1 88 88 LYS HD3 H 1 1.750 0.04 . 1 . . . A 88 LYS HD3 . 25484 1 960 . 1 1 88 88 LYS HE2 H 1 3.040 0.04 . 1 . . . A 88 LYS HE2 . 25484 1 961 . 1 1 88 88 LYS HE3 H 1 3.040 0.04 . 1 . . . A 88 LYS HE3 . 25484 1 962 . 1 1 88 88 LYS CA C 13 54.530 0.04 . 1 . . . A 88 LYS CA . 25484 1 963 . 1 1 88 88 LYS CB C 13 31.450 0.04 . 1 . . . A 88 LYS CB . 25484 1 964 . 1 1 88 88 LYS CG C 13 24.380 0.04 . 1 . . . A 88 LYS CG . 25484 1 965 . 1 1 88 88 LYS CD C 13 28.950 0.04 . 1 . . . A 88 LYS CD . 25484 1 966 . 1 1 88 88 LYS CE C 13 42.050 0.04 . 1 . . . A 88 LYS CE . 25484 1 967 . 1 1 89 89 GLN HA H 1 4.450 0.04 . 1 . . . A 89 GLN HA . 25484 1 968 . 1 1 89 89 GLN HB2 H 1 2.040 0.04 . 1 . . . A 89 GLN HB2 . 25484 1 969 . 1 1 89 89 GLN HB3 H 1 2.140 0.04 . 1 . . . A 89 GLN HB3 . 25484 1 970 . 1 1 89 89 GLN HG2 H 1 2.410 0.04 . 2 . . . A 89 GLN HG2 . 25484 1 971 . 1 1 89 89 GLN HG3 H 1 2.410 0.04 . 2 . . . A 89 GLN HG3 . 25484 1 972 . 1 1 89 89 GLN CA C 13 56.210 0.04 . 1 . . . A 89 GLN CA . 25484 1 973 . 1 1 89 89 GLN CB C 13 29.250 0.04 . 1 . . . A 89 GLN CB . 25484 1 974 . 1 1 89 89 GLN CG C 13 33.950 0.04 . 1 . . . A 89 GLN CG . 25484 1 975 . 1 1 90 90 LYS H H 1 7.750 0.04 . 1 . . . A 90 LYS H . 25484 1 976 . 1 1 90 90 LYS HA H 1 4.180 0.04 . 1 . . . A 90 LYS HA . 25484 1 977 . 1 1 90 90 LYS HB2 H 1 1.784 0.04 . 1 . . . A 90 LYS HB2 . 25484 1 978 . 1 1 90 90 LYS HB3 H 1 1.884 0.04 . 1 . . . A 90 LYS HB3 . 25484 1 979 . 1 1 90 90 LYS HG2 H 1 1.480 0.04 . 1 . . . A 90 LYS HG2 . 25484 1 980 . 1 1 90 90 LYS HG3 H 1 1.480 0.04 . 1 . . . A 90 LYS HG3 . 25484 1 981 . 1 1 90 90 LYS HD2 H 1 1.720 0.04 . 1 . . . A 90 LYS HD2 . 25484 1 982 . 1 1 90 90 LYS HD3 H 1 1.720 0.04 . 1 . . . A 90 LYS HD3 . 25484 1 983 . 1 1 90 90 LYS HE2 H 1 3.050 0.04 . 1 . . . A 90 LYS HE2 . 25484 1 984 . 1 1 90 90 LYS HE3 H 1 3.050 0.04 . 1 . . . A 90 LYS HE3 . 25484 1 985 . 1 1 90 90 LYS CA C 13 58.040 0.04 . 1 . . . A 90 LYS CA . 25484 1 986 . 1 1 90 90 LYS CB C 13 33.370 0.04 . 1 . . . A 90 LYS CB . 25484 1 987 . 1 1 90 90 LYS CG C 13 25.350 0.04 . 1 . . . A 90 LYS CG . 25484 1 988 . 1 1 90 90 LYS CD C 13 29.150 0.04 . 1 . . . A 90 LYS CD . 25484 1 989 . 1 1 90 90 LYS CE C 13 42.150 0.04 . 1 . . . A 90 LYS CE . 25484 1 990 . 1 1 90 90 LYS N N 15 127.480 0.04 . 1 . . . A 90 LYS N . 25484 1 stop_ save_ save_assigned_chem_shift_list_2 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_2 _Assigned_chem_shift_list.Entry_ID 25484 _Assigned_chem_shift_list.ID 2 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 13 '2D 1H-15N HSQC' . . . 25484 2 14 '3D CBCA(CO)NH' . . . 25484 2 15 '3D HNCACB' . . . 25484 2 16 '3D HNCA' . . . 25484 2 17 '3D HNCO' . . . 25484 2 18 '3D HN(CA)CO' . . . 25484 2 19 '3D H(CCO)NH' . . . 25484 2 20 '3D HCCH-TOCSY' . . . 25484 2 24 '3D HBHA(CO)NH' . . . 25484 2 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 2 2 1 1 LEU H H 1 7.752 . . . . . . B 1 LEU H1 . 25484 2 2 . 2 2 1 1 LEU HA H 1 4.713 . . . . . . B 1 LEU HA . 25484 2 3 . 2 2 1 1 LEU HB2 H 1 1.645 . . . . . . B 1 LEU HB2 . 25484 2 4 . 2 2 1 1 LEU HB3 H 1 1.645 . . . . . . B 1 LEU HB3 . 25484 2 5 . 2 2 1 1 LEU HG H 1 1.746 . . . . . . B 1 LEU HG . 25484 2 6 . 2 2 1 1 LEU HD11 H 1 0.995 . . . . . . B 1 LEU HD11 . 25484 2 7 . 2 2 1 1 LEU HD12 H 1 0.995 . . . . . . B 1 LEU HD12 . 25484 2 8 . 2 2 1 1 LEU HD13 H 1 0.995 . . . . . . B 1 LEU HD13 . 25484 2 9 . 2 2 1 1 LEU HD21 H 1 0.983 . . . . . . B 1 LEU HD21 . 25484 2 10 . 2 2 1 1 LEU HD22 H 1 0.983 . . . . . . B 1 LEU HD22 . 25484 2 11 . 2 2 1 1 LEU HD23 H 1 0.983 . . . . . . B 1 LEU HD23 . 25484 2 12 . 2 2 1 1 LEU CA C 13 53.010 . . . . . . B 1 LEU CA . 25484 2 13 . 2 2 1 1 LEU CB C 13 41.880 . . . . . . B 1 LEU CB . 25484 2 14 . 2 2 1 1 LEU CG C 13 27.150 . . . . . . B 1 LEU CG . 25484 2 15 . 2 2 1 1 LEU CD1 C 13 24.950 . . . . . . B 1 LEU CD1 . 25484 2 16 . 2 2 1 1 LEU CD2 C 13 23.350 . . . . . . B 1 LEU CD2 . 25484 2 17 . 2 2 1 1 LEU N N 15 120.830 . . . . . . B 1 LEU N . 25484 2 18 . 2 2 2 2 PRO HA H 1 4.520 . . . . . . B 2 PRO HA . 25484 2 19 . 2 2 2 2 PRO HB2 H 1 2.250 . . . . . . B 2 PRO HB2 . 25484 2 20 . 2 2 2 2 PRO HB3 H 1 2.385 . . . . . . B 2 PRO HB3 . 25484 2 21 . 2 2 2 2 PRO HG2 H 1 2.050 . . . . . . B 2 PRO HG2 . 25484 2 22 . 2 2 2 2 PRO HG3 H 1 2.120 . . . . . . B 2 PRO HG3 . 25484 2 23 . 2 2 2 2 PRO HD2 H 1 3.725 . . . . . . B 2 PRO HD2 . 25484 2 24 . 2 2 2 2 PRO HD3 H 1 3.924 . . . . . . B 2 PRO HD3 . 25484 2 25 . 2 2 2 2 PRO C C 13 176.940 . . . . . . B 2 PRO C . 25484 2 26 . 2 2 2 2 PRO CA C 13 63.580 . . . . . . B 2 PRO CA . 25484 2 27 . 2 2 2 2 PRO CB C 13 31.850 . . . . . . B 2 PRO CB . 25484 2 28 . 2 2 2 2 PRO CG C 13 27.150 . . . . . . B 2 PRO CG . 25484 2 29 . 2 2 2 2 PRO CD C 13 50.350 . . . . . . B 2 PRO CD . 25484 2 30 . 2 2 3 3 SER H H 1 8.310 . . . . . . B 3 SER H . 25484 2 31 . 2 2 3 3 SER HA H 1 4.440 . . . . . . B 3 SER HA . 25484 2 32 . 2 2 3 3 SER HB2 H 1 3.959 . . . . . . B 3 SER HB2 . 25484 2 33 . 2 2 3 3 SER HB3 H 1 3.959 . . . . . . B 3 SER HB3 . 25484 2 34 . 2 2 3 3 SER C C 13 174.990 . . . . . . B 3 SER C . 25484 2 35 . 2 2 3 3 SER CA C 13 58.490 . . . . . . B 3 SER CA . 25484 2 36 . 2 2 3 3 SER CB C 13 63.590 . . . . . . B 3 SER CB . 25484 2 37 . 2 2 3 3 SER N N 15 115.350 . . . . . . B 3 SER N . 25484 2 38 . 2 2 4 4 GLN H H 1 8.356 . . . . . . B 4 GLN H . 25484 2 39 . 2 2 4 4 GLN HA H 1 4.440 . . . . . . B 4 GLN HA . 25484 2 40 . 2 2 4 4 GLN HB2 H 1 2.058 . . . . . . B 4 GLN HB2 . 25484 2 41 . 2 2 4 4 GLN HB3 H 1 2.153 . . . . . . B 4 GLN HB3 . 25484 2 42 . 2 2 4 4 GLN HG2 H 1 2.434 . . . . . . B 4 GLN HG2 . 25484 2 43 . 2 2 4 4 GLN HG3 H 1 2.434 . . . . . . B 4 GLN HG3 . 25484 2 44 . 2 2 4 4 GLN HE21 H 1 7.579 . . . . . . B 4 GLN HE21 . 25484 2 45 . 2 2 4 4 GLN HE22 H 1 6.860 . . . . . . B 4 GLN HE22 . 25484 2 46 . 2 2 4 4 GLN C C 13 175.950 . . . . . . B 4 GLN C . 25484 2 47 . 2 2 4 4 GLN CA C 13 55.850 . . . . . . B 4 GLN CA . 25484 2 48 . 2 2 4 4 GLN CB C 13 29.010 . . . . . . B 4 GLN CB . 25484 2 49 . 2 2 4 4 GLN CG C 13 34.350 . . . . . . B 4 GLN CG . 25484 2 50 . 2 2 4 4 GLN N N 15 121.810 . . . . . . B 4 GLN N . 25484 2 51 . 2 2 4 4 GLN NE2 N 15 112.200 . . . . . . B 4 GLN NE2 . 25484 2 52 . 2 2 5 5 ALA H H 1 8.240 . . . . . . B 5 ALA H . 25484 2 53 . 2 2 5 5 ALA HA H 1 4.239 . . . . . . B 5 ALA HA . 25484 2 54 . 2 2 5 5 ALA HB1 H 1 1.465 . . . . . . B 5 ALA HB1 . 25484 2 55 . 2 2 5 5 ALA HB2 H 1 1.465 . . . . . . B 5 ALA HB2 . 25484 2 56 . 2 2 5 5 ALA HB3 H 1 1.465 . . . . . . B 5 ALA HB3 . 25484 2 57 . 2 2 5 5 ALA C C 13 178.140 . . . . . . B 5 ALA C . 25484 2 58 . 2 2 5 5 ALA CA C 13 52.880 . . . . . . B 5 ALA CA . 25484 2 59 . 2 2 5 5 ALA CB C 13 18.850 . . . . . . B 5 ALA CB . 25484 2 60 . 2 2 5 5 ALA N N 15 124.430 . . . . . . B 5 ALA N . 25484 2 61 . 2 2 6 6 MET H H 1 8.268 . . . . . . B 6 MET H . 25484 2 62 . 2 2 6 6 MET HA H 1 4.483 . . . . . . B 6 MET HA . 25484 2 63 . 2 2 6 6 MET HB2 H 1 2.087 . . . . . . B 6 MET HB2 . 25484 2 64 . 2 2 6 6 MET HB3 H 1 2.087 . . . . . . B 6 MET HB3 . 25484 2 65 . 2 2 6 6 MET HG2 H 1 2.615 . . . . . . B 6 MET HG2 . 25484 2 66 . 2 2 6 6 MET HG3 H 1 2.615 . . . . . . B 6 MET HG3 . 25484 2 67 . 2 2 6 6 MET C C 13 176.480 . . . . . . B 6 MET C . 25484 2 68 . 2 2 6 6 MET CA C 13 55.650 . . . . . . B 6 MET CA . 25484 2 69 . 2 2 6 6 MET CB C 13 32.580 . . . . . . B 6 MET CB . 25484 2 70 . 2 2 6 6 MET CG C 13 32.160 . . . . . . B 6 MET CG . 25484 2 71 . 2 2 6 6 MET N N 15 118.630 . . . . . . B 6 MET N . 25484 2 72 . 2 2 7 7 ASP H H 1 8.205 . . . . . . B 7 ASP H . 25484 2 73 . 2 2 7 7 ASP HA H 1 4.505 . . . . . . B 7 ASP HA . 25484 2 74 . 2 2 7 7 ASP HB2 H 1 2.695 . . . . . . B 7 ASP HB2 . 25484 2 75 . 2 2 7 7 ASP HB3 H 1 2.695 . . . . . . B 7 ASP HB3 . 25484 2 76 . 2 2 7 7 ASP C C 13 176.550 . . . . . . B 7 ASP C . 25484 2 77 . 2 2 7 7 ASP CA C 13 55.230 . . . . . . B 7 ASP CA . 25484 2 78 . 2 2 7 7 ASP CB C 13 41.150 . . . . . . B 7 ASP CB . 25484 2 79 . 2 2 7 7 ASP N N 15 120.450 . . . . . . B 7 ASP N . 25484 2 80 . 2 2 8 8 ASP H H 1 8.210 . . . . . . B 8 ASP H . 25484 2 81 . 2 2 8 8 ASP HA H 1 4.590 . . . . . . B 8 ASP HA . 25484 2 82 . 2 2 8 8 ASP HB2 H 1 2.719 . . . . . . B 8 ASP HB2 . 25484 2 83 . 2 2 8 8 ASP HB3 H 1 2.719 . . . . . . B 8 ASP HB3 . 25484 2 84 . 2 2 8 8 ASP C C 13 176.580 . . . . . . B 8 ASP C . 25484 2 85 . 2 2 8 8 ASP CA C 13 54.650 . . . . . . B 8 ASP CA . 25484 2 86 . 2 2 8 8 ASP CB C 13 40.950 . . . . . . B 8 ASP CB . 25484 2 87 . 2 2 8 8 ASP N N 15 119.550 . . . . . . B 8 ASP N . 25484 2 88 . 2 2 9 9 LEU H H 1 8.001 . . . . . . B 9 LEU H . 25484 2 89 . 2 2 9 9 LEU HA H 1 4.305 . . . . . . B 9 LEU HA . 25484 2 90 . 2 2 9 9 LEU HB2 H 1 1.688 . . . . . . B 9 LEU HB2 . 25484 2 91 . 2 2 9 9 LEU HB3 H 1 1.688 . . . . . . B 9 LEU HB3 . 25484 2 92 . 2 2 9 9 LEU HG H 1 1.665 . . . . . . B 9 LEU HG . 25484 2 93 . 2 2 9 9 LEU HD11 H 1 0.934 . . . . . . B 9 LEU HD11 . 25484 2 94 . 2 2 9 9 LEU HD12 H 1 0.934 . . . . . . B 9 LEU HD12 . 25484 2 95 . 2 2 9 9 LEU HD13 H 1 0.934 . . . . . . B 9 LEU HD13 . 25484 2 96 . 2 2 9 9 LEU HD21 H 1 0.875 . . . . . . B 9 LEU HD21 . 25484 2 97 . 2 2 9 9 LEU HD22 H 1 0.875 . . . . . . B 9 LEU HD22 . 25484 2 98 . 2 2 9 9 LEU HD23 H 1 0.875 . . . . . . B 9 LEU HD23 . 25484 2 99 . 2 2 9 9 LEU C C 13 176.950 . . . . . . B 9 LEU C . 25484 2 100 . 2 2 9 9 LEU CA C 13 55.390 . . . . . . B 9 LEU CA . 25484 2 101 . 2 2 9 9 LEU CB C 13 42.390 . . . . . . B 9 LEU CB . 25484 2 102 . 2 2 9 9 LEU CG C 13 27.550 . . . . . . B 9 LEU CG . 25484 2 103 . 2 2 9 9 LEU CD1 C 13 25.520 . . . . . . B 9 LEU CD1 . 25484 2 104 . 2 2 9 9 LEU N N 15 120.800 . . . . . . B 9 LEU N . 25484 2 105 . 2 2 10 10 MET H H 1 8.088 . . . . . . B 10 MET H . 25484 2 106 . 2 2 10 10 MET HA H 1 4.485 . . . . . . B 10 MET HA . 25484 2 107 . 2 2 10 10 MET HB2 H 1 2.095 . . . . . . B 10 MET HB2 . 25484 2 108 . 2 2 10 10 MET HB3 H 1 2.095 . . . . . . B 10 MET HB3 . 25484 2 109 . 2 2 10 10 MET HG2 H 1 2.575 . . . . . . B 10 MET HG2 . 25484 2 110 . 2 2 10 10 MET HG3 H 1 2.615 . . . . . . B 10 MET HG3 . 25484 2 111 . 2 2 10 10 MET C C 13 176.050 . . . . . . B 10 MET C . 25484 2 112 . 2 2 10 10 MET CA C 13 55.400 . . . . . . B 10 MET CA . 25484 2 113 . 2 2 10 10 MET CB C 13 32.140 . . . . . . B 10 MET CB . 25484 2 114 . 2 2 10 10 MET CG C 13 32.140 . . . . . . B 10 MET CG . 25484 2 115 . 2 2 10 10 MET N N 15 118.720 . . . . . . B 10 MET N . 25484 2 116 . 2 2 11 11 LEU H H 1 7.950 . . . . . . B 11 LEU H . 25484 2 117 . 2 2 11 11 LEU HA H 1 4.453 . . . . . . B 11 LEU HA . 25484 2 118 . 2 2 11 11 LEU HB2 H 1 1.575 . . . . . . B 11 LEU HB2 . 25484 2 119 . 2 2 11 11 LEU HB3 H 1 1.625 . . . . . . B 11 LEU HB3 . 25484 2 120 . 2 2 11 11 LEU HG H 1 1.626 . . . . . . B 11 LEU HG . 25484 2 121 . 2 2 11 11 LEU HD11 H 1 0.881 . . . . . . B 11 LEU HD11 . 25484 2 122 . 2 2 11 11 LEU HD12 H 1 0.881 . . . . . . B 11 LEU HD12 . 25484 2 123 . 2 2 11 11 LEU HD13 H 1 0.881 . . . . . . B 11 LEU HD13 . 25484 2 124 . 2 2 11 11 LEU HD21 H 1 0.883 . . . . . . B 11 LEU HD21 . 25484 2 125 . 2 2 11 11 LEU HD22 H 1 0.883 . . . . . . B 11 LEU HD22 . 25484 2 126 . 2 2 11 11 LEU HD23 H 1 0.883 . . . . . . B 11 LEU HD23 . 25484 2 127 . 2 2 11 11 LEU C C 13 177.570 . . . . . . B 11 LEU C . 25484 2 128 . 2 2 11 11 LEU CA C 13 54.680 . . . . . . B 11 LEU CA . 25484 2 129 . 2 2 11 11 LEU CB C 13 42.880 . . . . . . B 11 LEU CB . 25484 2 130 . 2 2 11 11 LEU CG C 13 27.450 . . . . . . B 11 LEU CG . 25484 2 131 . 2 2 11 11 LEU CD1 C 13 25.250 . . . . . . B 11 LEU CD1 . 25484 2 132 . 2 2 11 11 LEU CD2 C 13 23.650 . . . . . . B 11 LEU CD2 . 25484 2 133 . 2 2 11 11 LEU N N 15 121.830 . . . . . . B 11 LEU N . 25484 2 134 . 2 2 12 12 SER H H 1 8.590 . . . . . . B 12 SER H . 25484 2 135 . 2 2 12 12 SER HA H 1 4.875 . . . . . . B 12 SER HA . 25484 2 136 . 2 2 12 12 SER HB2 H 1 3.915 . . . . . . B 12 SER HB2 . 25484 2 137 . 2 2 12 12 SER HB3 H 1 4.035 . . . . . . B 12 SER HB3 . 25484 2 138 . 2 2 12 12 SER CA C 13 55.550 . . . . . . B 12 SER CA . 25484 2 139 . 2 2 12 12 SER CB C 13 63.680 . . . . . . B 12 SER CB . 25484 2 140 . 2 2 12 12 SER N N 15 117.880 . . . . . . B 12 SER N . 25484 2 141 . 2 2 13 13 PRO HA H 1 4.345 . . . . . . B 13 PRO HA . 25484 2 142 . 2 2 13 13 PRO HB2 H 1 2.024 . . . . . . B 13 PRO HB2 . 25484 2 143 . 2 2 13 13 PRO HB3 H 1 2.297 . . . . . . B 13 PRO HB3 . 25484 2 144 . 2 2 13 13 PRO HG2 H 1 1.994 . . . . . . B 13 PRO HG2 . 25484 2 145 . 2 2 13 13 PRO HG3 H 1 2.108 . . . . . . B 13 PRO HG3 . 25484 2 146 . 2 2 13 13 PRO HD2 H 1 3.870 . . . . . . B 13 PRO HD2 . 25484 2 147 . 2 2 13 13 PRO HD3 H 1 3.870 . . . . . . B 13 PRO HD3 . 25484 2 148 . 2 2 13 13 PRO C C 13 177.390 . . . . . . B 13 PRO C . 25484 2 149 . 2 2 13 13 PRO CA C 13 64.450 . . . . . . B 13 PRO CA . 25484 2 150 . 2 2 13 13 PRO CB C 13 31.760 . . . . . . B 13 PRO CB . 25484 2 151 . 2 2 13 13 PRO CG C 13 27.450 . . . . . . B 13 PRO CG . 25484 2 152 . 2 2 13 13 PRO CD C 13 50.250 . . . . . . B 13 PRO CD . 25484 2 153 . 2 2 14 14 ASP H H 1 8.101 . . . . . . B 14 ASP H . 25484 2 154 . 2 2 14 14 ASP HA H 1 4.480 . . . . . . B 14 ASP HA . 25484 2 155 . 2 2 14 14 ASP HB2 H 1 2.550 . . . . . . B 14 ASP HB2 . 25484 2 156 . 2 2 14 14 ASP HB3 H 1 2.700 . . . . . . B 14 ASP HB3 . 25484 2 157 . 2 2 14 14 ASP C C 13 177.110 . . . . . . B 14 ASP C . 25484 2 158 . 2 2 14 14 ASP CA C 13 55.390 . . . . . . B 14 ASP CA . 25484 2 159 . 2 2 14 14 ASP CB C 13 40.950 . . . . . . B 14 ASP CB . 25484 2 160 . 2 2 14 14 ASP N N 15 117.110 . . . . . . B 14 ASP N . 25484 2 161 . 2 2 15 15 ASP H H 1 7.862 . . . . . . B 15 ASP H . 25484 2 162 . 2 2 15 15 ASP HA H 1 4.502 . . . . . . B 15 ASP HA . 25484 2 163 . 2 2 15 15 ASP HB2 H 1 2.700 . . . . . . B 15 ASP HB2 . 25484 2 164 . 2 2 15 15 ASP HB3 H 1 2.700 . . . . . . B 15 ASP HB3 . 25484 2 165 . 2 2 15 15 ASP C C 13 177.230 . . . . . . B 15 ASP C . 25484 2 166 . 2 2 15 15 ASP CA C 13 55.390 . . . . . . B 15 ASP CA . 25484 2 167 . 2 2 15 15 ASP CB C 13 41.120 . . . . . . B 15 ASP CB . 25484 2 168 . 2 2 15 15 ASP N N 15 119.620 . . . . . . B 15 ASP N . 25484 2 169 . 2 2 16 16 ILE H H 1 7.620 . . . . . . B 16 ILE H . 25484 2 170 . 2 2 16 16 ILE HA H 1 3.380 . . . . . . B 16 ILE HA . 25484 2 171 . 2 2 16 16 ILE HB H 1 1.739 . . . . . . B 16 ILE HB . 25484 2 172 . 2 2 16 16 ILE HG12 H 1 1.349 . . . . . . B 16 ILE HG12 . 25484 2 173 . 2 2 16 16 ILE HG13 H 1 0.970 . . . . . . B 16 ILE HG13 . 25484 2 174 . 2 2 16 16 ILE HG21 H 1 0.760 . . . . . . B 16 ILE HG21 . 25484 2 175 . 2 2 16 16 ILE HG22 H 1 0.760 . . . . . . B 16 ILE HG22 . 25484 2 176 . 2 2 16 16 ILE HG23 H 1 0.760 . . . . . . B 16 ILE HG23 . 25484 2 177 . 2 2 16 16 ILE HD11 H 1 0.748 . . . . . . B 16 ILE HD11 . 25484 2 178 . 2 2 16 16 ILE HD12 H 1 0.748 . . . . . . B 16 ILE HD12 . 25484 2 179 . 2 2 16 16 ILE HD13 H 1 0.748 . . . . . . B 16 ILE HD13 . 25484 2 180 . 2 2 16 16 ILE C C 13 176.950 . . . . . . B 16 ILE C . 25484 2 181 . 2 2 16 16 ILE CA C 13 62.740 . . . . . . B 16 ILE CA . 25484 2 182 . 2 2 16 16 ILE CB C 13 37.880 . . . . . . B 16 ILE CB . 25484 2 183 . 2 2 16 16 ILE CG1 C 13 28.390 . . . . . . B 16 ILE CG1 . 25484 2 184 . 2 2 16 16 ILE CG2 C 13 17.570 . . . . . . B 16 ILE CG2 . 25484 2 185 . 2 2 16 16 ILE CD1 C 13 13.810 . . . . . . B 16 ILE CD1 . 25484 2 186 . 2 2 16 16 ILE N N 15 119.210 . . . . . . B 16 ILE N . 25484 2 187 . 2 2 17 17 GLU H H 1 8.065 . . . . . . B 17 GLU H . 25484 2 188 . 2 2 17 17 GLU HA H 1 4.049 . . . . . . B 17 GLU HA . 25484 2 189 . 2 2 17 17 GLU HB2 H 1 2.038 . . . . . . B 17 GLU HB2 . 25484 2 190 . 2 2 17 17 GLU HB3 H 1 2.038 . . . . . . B 17 GLU HB3 . 25484 2 191 . 2 2 17 17 GLU HG2 H 1 2.287 . . . . . . B 17 GLU HG2 . 25484 2 192 . 2 2 17 17 GLU HG3 H 1 2.320 . . . . . . B 17 GLU HG3 . 25484 2 193 . 2 2 17 17 GLU C C 13 178.190 . . . . . . B 17 GLU C . 25484 2 194 . 2 2 17 17 GLU CA C 13 58.450 . . . . . . B 17 GLU CA . 25484 2 195 . 2 2 17 17 GLU CB C 13 29.480 . . . . . . B 17 GLU CB . 25484 2 196 . 2 2 17 17 GLU CG C 13 36.550 . . . . . . B 17 GLU CG . 25484 2 197 . 2 2 17 17 GLU N N 15 119.710 . . . . . . B 17 GLU N . 25484 2 198 . 2 2 18 18 GLN H H 1 7.801 . . . . . . B 18 GLN H . 25484 2 199 . 2 2 18 18 GLN HA H 1 4.232 . . . . . . B 18 GLN HA . 25484 2 200 . 2 2 18 18 GLN HB2 H 1 2.150 . . . . . . B 18 GLN HB2 . 25484 2 201 . 2 2 18 18 GLN HB3 H 1 2.150 . . . . . . B 18 GLN HB3 . 25484 2 202 . 2 2 18 18 GLN HG2 H 1 2.320 . . . . . . B 18 GLN HG2 . 25484 2 203 . 2 2 18 18 GLN HG3 H 1 2.320 . . . . . . B 18 GLN HG3 . 25484 2 204 . 2 2 18 18 GLN HE21 H 1 7.470 . . . . . . B 18 GLN HE21 . 25484 2 205 . 2 2 18 18 GLN HE22 H 1 6.770 . . . . . . B 18 GLN HE22 . 25484 2 206 . 2 2 18 18 GLN C C 13 177.110 . . . . . . B 18 GLN C . 25484 2 207 . 2 2 18 18 GLN CA C 13 56.920 . . . . . . B 18 GLN CA . 25484 2 208 . 2 2 18 18 GLN CB C 13 28.640 . . . . . . B 18 GLN CB . 25484 2 209 . 2 2 18 18 GLN CG C 13 34.050 . . . . . . B 18 GLN CG . 25484 2 210 . 2 2 18 18 GLN N N 15 116.780 . . . . . . B 18 GLN N . 25484 2 211 . 2 2 18 18 GLN NE2 N 15 111.960 . . . . . . B 18 GLN NE2 . 25484 2 212 . 2 2 19 19 TRP H H 1 7.865 . . . . . . B 19 TRP H . 25484 2 213 . 2 2 19 19 TRP HA H 1 4.526 . . . . . . B 19 TRP HA . 25484 2 214 . 2 2 19 19 TRP HB2 H 1 2.874 . . . . . . B 19 TRP HB2 . 25484 2 215 . 2 2 19 19 TRP HB3 H 1 3.051 . . . . . . B 19 TRP HB3 . 25484 2 216 . 2 2 19 19 TRP HD1 H 1 7.370 . . . . . . B 19 TRP HD1 . 25484 2 217 . 2 2 19 19 TRP HE1 H 1 10.020 . . . . . . B 19 TRP HE1 . 25484 2 218 . 2 2 19 19 TRP C C 13 176.820 . . . . . . B 19 TRP C . 25484 2 219 . 2 2 19 19 TRP CA C 13 57.750 . . . . . . B 19 TRP CA . 25484 2 220 . 2 2 19 19 TRP CB C 13 29.280 . . . . . . B 19 TRP CB . 25484 2 221 . 2 2 19 19 TRP N N 15 119.620 . . . . . . B 19 TRP N . 25484 2 222 . 2 2 19 19 TRP NE1 N 15 128.220 . . . . . . B 19 TRP NE1 . 25484 2 223 . 2 2 20 20 PHE H H 1 7.943 . . . . . . B 20 PHE H . 25484 2 224 . 2 2 20 20 PHE HA H 1 4.726 . . . . . . B 20 PHE HA . 25484 2 225 . 2 2 20 20 PHE HB2 H 1 3.032 . . . . . . B 20 PHE HB2 . 25484 2 226 . 2 2 20 20 PHE HB3 H 1 3.295 . . . . . . B 20 PHE HB3 . 25484 2 227 . 2 2 20 20 PHE HD1 H 1 7.320 . . . . . . B 20 PHE HD1 . 25484 2 228 . 2 2 20 20 PHE HD2 H 1 7.320 . . . . . . B 20 PHE HD2 . 25484 2 229 . 2 2 20 20 PHE HE1 H 1 7.039 . . . . . . B 20 PHE HE1 . 25484 2 230 . 2 2 20 20 PHE HE2 H 1 7.039 . . . . . . B 20 PHE HE2 . 25484 2 231 . 2 2 20 20 PHE C C 13 175.820 . . . . . . B 20 PHE C . 25484 2 232 . 2 2 20 20 PHE CA C 13 57.620 . . . . . . B 20 PHE CA . 25484 2 233 . 2 2 20 20 PHE CB C 13 39.040 . . . . . . B 20 PHE CB . 25484 2 234 . 2 2 20 20 PHE N N 15 116.350 . . . . . . B 20 PHE N . 25484 2 235 . 2 2 21 21 THR H H 1 7.770 . . . . . . B 21 THR H . 25484 2 236 . 2 2 21 21 THR HA H 1 4.404 . . . . . . B 21 THR HA . 25484 2 237 . 2 2 21 21 THR HB H 1 4.299 . . . . . . B 21 THR HB . 25484 2 238 . 2 2 21 21 THR HG21 H 1 1.264 . . . . . . B 21 THR HG21 . 25484 2 239 . 2 2 21 21 THR HG22 H 1 1.264 . . . . . . B 21 THR HG22 . 25484 2 240 . 2 2 21 21 THR HG23 H 1 1.264 . . . . . . B 21 THR HG23 . 25484 2 241 . 2 2 21 21 THR C C 13 174.460 . . . . . . B 21 THR C . 25484 2 242 . 2 2 21 21 THR CA C 13 61.980 . . . . . . B 21 THR CA . 25484 2 243 . 2 2 21 21 THR CB C 13 66.990 . . . . . . B 21 THR CB . 25484 2 244 . 2 2 21 21 THR CG2 C 13 21.950 . . . . . . B 21 THR CG2 . 25484 2 245 . 2 2 21 21 THR N N 15 115.610 . . . . . . B 21 THR N . 25484 2 246 . 2 2 22 22 GLU H H 1 8.278 . . . . . . B 22 GLU H . 25484 2 247 . 2 2 22 22 GLU HA H 1 4.380 . . . . . . B 22 GLU HA . 25484 2 248 . 2 2 22 22 GLU HB2 H 1 1.970 . . . . . . B 22 GLU HB2 . 25484 2 249 . 2 2 22 22 GLU HB3 H 1 2.090 . . . . . . B 22 GLU HB3 . 25484 2 250 . 2 2 22 22 GLU HG2 H 1 2.315 . . . . . . B 22 GLU HG2 . 25484 2 251 . 2 2 22 22 GLU HG3 H 1 2.315 . . . . . . B 22 GLU HG3 . 25484 2 252 . 2 2 22 22 GLU C C 13 175.840 . . . . . . B 22 GLU C . 25484 2 253 . 2 2 22 22 GLU CA C 13 56.150 . . . . . . B 22 GLU CA . 25484 2 254 . 2 2 22 22 GLU CB C 13 30.400 . . . . . . B 22 GLU CB . 25484 2 255 . 2 2 22 22 GLU CG C 13 36.250 . . . . . . B 22 GLU CG . 25484 2 256 . 2 2 22 22 GLU N N 15 122.470 . . . . . . B 22 GLU N . 25484 2 257 . 2 2 23 23 ASP H H 1 8.362 . . . . . . B 23 ASP H . 25484 2 258 . 2 2 23 23 ASP HA H 1 4.920 . . . . . . B 23 ASP HA . 25484 2 259 . 2 2 23 23 ASP HB2 H 1 2.600 . . . . . . B 23 ASP HB2 . 25484 2 260 . 2 2 23 23 ASP HB3 H 1 2.795 . . . . . . B 23 ASP HB3 . 25484 2 261 . 2 2 23 23 ASP CA C 13 52.170 . . . . . . B 23 ASP CA . 25484 2 262 . 2 2 23 23 ASP CB C 13 41.190 . . . . . . B 23 ASP CB . 25484 2 263 . 2 2 23 23 ASP N N 15 122.810 . . . . . . B 23 ASP N . 25484 2 264 . 2 2 24 24 PRO HA H 1 4.490 . . . . . . B 24 PRO HA . 25484 2 265 . 2 2 24 24 PRO HB2 H 1 2.100 . . . . . . B 24 PRO HB2 . 25484 2 266 . 2 2 24 24 PRO HB3 H 1 2.250 . . . . . . B 24 PRO HB3 . 25484 2 267 . 2 2 24 24 PRO HG2 H 1 2.047 . . . . . . B 24 PRO HG2 . 25484 2 268 . 2 2 24 24 PRO HG3 H 1 2.047 . . . . . . B 24 PRO HG3 . 25484 2 269 . 2 2 24 24 PRO HD2 H 1 3.880 . . . . . . B 24 PRO HD2 . 25484 2 270 . 2 2 24 24 PRO HD3 H 1 3.880 . . . . . . B 24 PRO HD3 . 25484 2 271 . 2 2 24 24 PRO C C 13 176.640 . . . . . . B 24 PRO C . 25484 2 272 . 2 2 24 24 PRO CA C 13 63.430 . . . . . . B 24 PRO CA . 25484 2 273 . 2 2 24 24 PRO CB C 13 31.950 . . . . . . B 24 PRO CB . 25484 2 274 . 2 2 24 24 PRO CG C 13 27.450 . . . . . . B 24 PRO CG . 25484 2 275 . 2 2 24 24 PRO CD C 13 50.750 . . . . . . B 24 PRO CD . 25484 2 276 . 2 2 25 25 GLY H H 1 8.064 . . . . . . B 25 GLY H . 25484 2 277 . 2 2 25 25 GLY HA2 H 1 3.765 . . . . . . B 25 GLY HA2 . 25484 2 278 . 2 2 25 25 GLY HA3 H 1 3.825 . . . . . . B 25 GLY HA3 . 25484 2 279 . 2 2 25 25 GLY CA C 13 46.150 . . . . . . B 25 GLY CA . 25484 2 280 . 2 2 25 25 GLY N N 15 115.030 . . . . . . B 25 GLY N . 25484 2 stop_ save_