data_34231 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 34231 _Entry.Title ; Solution Structure of p300Taz2-p63TA ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2018-01-11 _Entry.Accession_date 2018-01-11 _Entry.Last_release_date 2018-05-21 _Entry.Original_release_date 2018-05-21 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.0.16 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_experimental_methods.ID _Entry_experimental_methods.Method _Entry_experimental_methods.Subtype _Entry_experimental_methods.Entry_ID 1 'SOLUTION NMR' 'SOLUTION NMR' 34231 stop_ loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 J. Gebel J. . . . 34231 2 S. Kazemi S. . . . 34231 3 F. Lohr F. . . . 34231 4 P. Guntert P. . . . 34231 5 V. Dotsch V. . . . 34231 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'ANTITUMOR PROTEIN' . 34231 'CREB Binding protein' . 34231 p300 . 34231 'p53 family' . 34231 p63 . 34231 p73 . 34231 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 34231 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 528 34231 '15N chemical shifts' 126 34231 '1H chemical shifts' 817 34231 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2018-05-24 . original BMRB . 34231 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 6FGN . 34231 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 34231 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title ; The regulation of the transcriptional activity in the p53 protein family depends on the organization of the transactivation domain ; _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev Structure _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM STRUE6 _Citation.Journal_ISSN 0969-2126 _Citation.Journal_CSD 2005 _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year 2018 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 K. Krauskopf K. . . . 34231 1 2 J. Gebel J. . . . 34231 1 3 S. Kazemi S. . . . 34231 1 4 M. Tuppi M. . . . 34231 1 5 F. Lohr F. . . . 34231 1 6 B. Schafer B. . . . 34231 1 7 J. Koch J. . . . 34231 1 8 P. Guntert P. . . . 34231 1 9 V. Dotsch V. . . . 34231 1 10 S. Kehrloesser S. . . . 34231 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 34231 _Assembly.ID 1 _Assembly.Name 'Histone acetyltransferase p300,Tumor protein 63 (E.C.2.3.1.48,2.3.1.-)' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 entity_1 1 $entity_1 A A yes . . . . . . 34231 1 2 'entity_2, 1' 2 $entity_ZN B A no . . . . . . 34231 1 3 'entity_2, 2' 2 $entity_ZN C A no . . . . . . 34231 1 4 'entity_2, 3' 2 $entity_ZN D A no . . . . . . 34231 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 34231 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; ATQSPGDSRRLSIQRAIQSL VHAAQCRNANCSLPSCQKMK RVVQHTKGCKRKTNGGCPIC KQLIALAAYHAKHCQENKCP VPFCLNIKQKGTIEGRGNEF LSPEVFQHIWDFLEQPISSV QPID ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer no _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 124 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state . _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment 'Taz2,transactivation domain' _Entity.Mutation . _Entity.EC_number 2.3.1.48,2.3.1.- _Entity.Calc_isoelectric_point . _Entity.Formula_weight 13834.022 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID CUSP na 34231 1 'Chronic ulcerative stomatitis protein' na 34231 1 'E1A-associated protein p300' na 34231 1 'Histone butyryltransferase p300' na 34231 1 'Histone crotonyltransferase p300' na 34231 1 'Keratinocyte transcription factor KET' na 34231 1 'Protein propionyltransferase p300' na 34231 1 TP63 na 34231 1 'Transformation-related protein 63' na 34231 1 'Tumor protein p73-like' na 34231 1 'p300 HAT' na 34231 1 p40 na 34231 1 p51 na 34231 1 p63 na 34231 1 p73L na 34231 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . ALA . 34231 1 2 . THR . 34231 1 3 . GLN . 34231 1 4 . SER . 34231 1 5 . PRO . 34231 1 6 . GLY . 34231 1 7 . ASP . 34231 1 8 . SER . 34231 1 9 . ARG . 34231 1 10 . ARG . 34231 1 11 . LEU . 34231 1 12 . SER . 34231 1 13 . ILE . 34231 1 14 . GLN . 34231 1 15 . ARG . 34231 1 16 . ALA . 34231 1 17 . ILE . 34231 1 18 . GLN . 34231 1 19 . SER . 34231 1 20 . LEU . 34231 1 21 . VAL . 34231 1 22 . HIS . 34231 1 23 . ALA . 34231 1 24 . ALA . 34231 1 25 . GLN . 34231 1 26 . CYS . 34231 1 27 . ARG . 34231 1 28 . ASN . 34231 1 29 . ALA . 34231 1 30 . ASN . 34231 1 31 . CYS . 34231 1 32 . SER . 34231 1 33 . LEU . 34231 1 34 . PRO . 34231 1 35 . SER . 34231 1 36 . CYS . 34231 1 37 . GLN . 34231 1 38 . LYS . 34231 1 39 . MET . 34231 1 40 . LYS . 34231 1 41 . ARG . 34231 1 42 . VAL . 34231 1 43 . VAL . 34231 1 44 . GLN . 34231 1 45 . HIS . 34231 1 46 . THR . 34231 1 47 . LYS . 34231 1 48 . GLY . 34231 1 49 . CYS . 34231 1 50 . LYS . 34231 1 51 . ARG . 34231 1 52 . LYS . 34231 1 53 . THR . 34231 1 54 . ASN . 34231 1 55 . GLY . 34231 1 56 . GLY . 34231 1 57 . CYS . 34231 1 58 . PRO . 34231 1 59 . ILE . 34231 1 60 . CYS . 34231 1 61 . LYS . 34231 1 62 . GLN . 34231 1 63 . LEU . 34231 1 64 . ILE . 34231 1 65 . ALA . 34231 1 66 . LEU . 34231 1 67 . ALA . 34231 1 68 . ALA . 34231 1 69 . TYR . 34231 1 70 . HIS . 34231 1 71 . ALA . 34231 1 72 . LYS . 34231 1 73 . HIS . 34231 1 74 . CYS . 34231 1 75 . GLN . 34231 1 76 . GLU . 34231 1 77 . ASN . 34231 1 78 . LYS . 34231 1 79 . CYS . 34231 1 80 . PRO . 34231 1 81 . VAL . 34231 1 82 . PRO . 34231 1 83 . PHE . 34231 1 84 . CYS . 34231 1 85 . LEU . 34231 1 86 . ASN . 34231 1 87 . ILE . 34231 1 88 . LYS . 34231 1 89 . GLN . 34231 1 90 . LYS . 34231 1 91 . GLY . 34231 1 92 . THR . 34231 1 93 . ILE . 34231 1 94 . GLU . 34231 1 95 . GLY . 34231 1 96 . ARG . 34231 1 97 . GLY . 34231 1 98 . ASN . 34231 1 99 . GLU . 34231 1 100 . PHE . 34231 1 101 . LEU . 34231 1 102 . SER . 34231 1 103 . PRO . 34231 1 104 . GLU . 34231 1 105 . VAL . 34231 1 106 . PHE . 34231 1 107 . GLN . 34231 1 108 . HIS . 34231 1 109 . ILE . 34231 1 110 . TRP . 34231 1 111 . ASP . 34231 1 112 . PHE . 34231 1 113 . LEU . 34231 1 114 . GLU . 34231 1 115 . GLN . 34231 1 116 . PRO . 34231 1 117 . ILE . 34231 1 118 . SER . 34231 1 119 . SER . 34231 1 120 . VAL . 34231 1 121 . GLN . 34231 1 122 . PRO . 34231 1 123 . ILE . 34231 1 124 . ASP . 34231 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 34231 1 . THR 2 2 34231 1 . GLN 3 3 34231 1 . SER 4 4 34231 1 . PRO 5 5 34231 1 . GLY 6 6 34231 1 . ASP 7 7 34231 1 . SER 8 8 34231 1 . ARG 9 9 34231 1 . ARG 10 10 34231 1 . LEU 11 11 34231 1 . SER 12 12 34231 1 . ILE 13 13 34231 1 . GLN 14 14 34231 1 . ARG 15 15 34231 1 . ALA 16 16 34231 1 . ILE 17 17 34231 1 . GLN 18 18 34231 1 . SER 19 19 34231 1 . LEU 20 20 34231 1 . VAL 21 21 34231 1 . HIS 22 22 34231 1 . ALA 23 23 34231 1 . ALA 24 24 34231 1 . GLN 25 25 34231 1 . CYS 26 26 34231 1 . ARG 27 27 34231 1 . ASN 28 28 34231 1 . ALA 29 29 34231 1 . ASN 30 30 34231 1 . CYS 31 31 34231 1 . SER 32 32 34231 1 . LEU 33 33 34231 1 . PRO 34 34 34231 1 . SER 35 35 34231 1 . CYS 36 36 34231 1 . GLN 37 37 34231 1 . LYS 38 38 34231 1 . MET 39 39 34231 1 . LYS 40 40 34231 1 . ARG 41 41 34231 1 . VAL 42 42 34231 1 . VAL 43 43 34231 1 . GLN 44 44 34231 1 . HIS 45 45 34231 1 . THR 46 46 34231 1 . LYS 47 47 34231 1 . GLY 48 48 34231 1 . CYS 49 49 34231 1 . LYS 50 50 34231 1 . ARG 51 51 34231 1 . LYS 52 52 34231 1 . THR 53 53 34231 1 . ASN 54 54 34231 1 . GLY 55 55 34231 1 . GLY 56 56 34231 1 . CYS 57 57 34231 1 . PRO 58 58 34231 1 . ILE 59 59 34231 1 . CYS 60 60 34231 1 . LYS 61 61 34231 1 . GLN 62 62 34231 1 . LEU 63 63 34231 1 . ILE 64 64 34231 1 . ALA 65 65 34231 1 . LEU 66 66 34231 1 . ALA 67 67 34231 1 . ALA 68 68 34231 1 . TYR 69 69 34231 1 . HIS 70 70 34231 1 . ALA 71 71 34231 1 . LYS 72 72 34231 1 . HIS 73 73 34231 1 . CYS 74 74 34231 1 . GLN 75 75 34231 1 . GLU 76 76 34231 1 . ASN 77 77 34231 1 . LYS 78 78 34231 1 . CYS 79 79 34231 1 . PRO 80 80 34231 1 . VAL 81 81 34231 1 . PRO 82 82 34231 1 . PHE 83 83 34231 1 . CYS 84 84 34231 1 . LEU 85 85 34231 1 . ASN 86 86 34231 1 . ILE 87 87 34231 1 . LYS 88 88 34231 1 . GLN 89 89 34231 1 . LYS 90 90 34231 1 . GLY 91 91 34231 1 . THR 92 92 34231 1 . ILE 93 93 34231 1 . GLU 94 94 34231 1 . GLY 95 95 34231 1 . ARG 96 96 34231 1 . GLY 97 97 34231 1 . ASN 98 98 34231 1 . GLU 99 99 34231 1 . PHE 100 100 34231 1 . LEU 101 101 34231 1 . SER 102 102 34231 1 . PRO 103 103 34231 1 . GLU 104 104 34231 1 . VAL 105 105 34231 1 . PHE 106 106 34231 1 . GLN 107 107 34231 1 . HIS 108 108 34231 1 . ILE 109 109 34231 1 . TRP 110 110 34231 1 . ASP 111 111 34231 1 . PHE 112 112 34231 1 . LEU 113 113 34231 1 . GLU 114 114 34231 1 . GLN 115 115 34231 1 . PRO 116 116 34231 1 . ILE 117 117 34231 1 . SER 118 118 34231 1 . SER 119 119 34231 1 . VAL 120 120 34231 1 . GLN 121 121 34231 1 . PRO 122 122 34231 1 . ILE 123 123 34231 1 . ASP 124 124 34231 1 stop_ save_ save_entity_ZN _Entity.Sf_category entity _Entity.Sf_framecode entity_ZN _Entity.Entry_ID 34231 _Entity.ID 2 _Entity.BMRB_code ZN _Entity.Name entity_ZN _Entity.Type non-polymer _Entity.Polymer_common_type . _Entity.Polymer_type . _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code . _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID ZN _Entity.Nonpolymer_comp_label $chem_comp_ZN _Entity.Number_of_monomers . _Entity.Number_of_nonpolymer_components 1 _Entity.Paramagnetic . _Entity.Thiol_state . _Entity.Src_method . _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 65.409 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'ZINC ION' BMRB 34231 2 stop_ loop_ _Entity_systematic_name.Name _Entity_systematic_name.Naming_system _Entity_systematic_name.Entry_ID _Entity_systematic_name.Entity_ID 'ZINC ION' BMRB 34231 2 ZN 'Three letter code' 34231 2 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 1 ZN $chem_comp_ZN 34231 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 34231 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . 'EP300, P300, TP63, KET, P63, P73H, P73L, TP73L' . 34231 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 34231 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli BL21(DE3)' . . 469008 . . . . . . . . . . . . 34231 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_ZN _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_ZN _Chem_comp.Entry_ID 34231 _Chem_comp.ID ZN _Chem_comp.Provenance PDB _Chem_comp.Name 'ZINC ION' _Chem_comp.Type NON-POLYMER _Chem_comp.BMRB_code ZN _Chem_comp.PDB_code ZN _Chem_comp.Ambiguous_flag no _Chem_comp.Initial_date 2012-11-20 _Chem_comp.Modified_date 2012-11-20 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code ZN _Chem_comp.Number_atoms_all 1 _Chem_comp.Number_atoms_nh 1 _Chem_comp.Atom_nomenclature_source . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code InChI=1S/Zn/q+2 _Chem_comp.Mon_nstd_flag . _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 2 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula Zn _Chem_comp.Formula_weight 65.409 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag no _Chem_comp.Ideal_coordinates_details . _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code . _Chem_comp.Processing_site RCSB _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details . _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID InChI=1S/Zn/q+2 InChI InChI 1.03 34231 ZN PTFCDOFLOPIGGS-UHFFFAOYSA-N InChIKey InChI 1.03 34231 ZN [Zn++] SMILES CACTVS 3.341 34231 ZN [Zn++] SMILES_CANONICAL CACTVS 3.341 34231 ZN [Zn+2] SMILES ACDLabs 10.04 34231 ZN [Zn+2] SMILES 'OpenEye OEToolkits' 1.5.0 34231 ZN [Zn+2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 34231 ZN stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID zinc 'SYSTEMATIC NAME' ACDLabs 10.04 34231 ZN 'zinc(+2) cation' 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 34231 ZN stop_ loop_ _Chem_comp_atom.Atom_ID _Chem_comp_atom.BMRB_code _Chem_comp_atom.PDB_atom_ID _Chem_comp_atom.Alt_atom_ID _Chem_comp_atom.Auth_atom_ID _Chem_comp_atom.Type_symbol _Chem_comp_atom.Isotope_number _Chem_comp_atom.Chirality _Chem_comp_atom.Stereo_config _Chem_comp_atom.Charge _Chem_comp_atom.Partial_charge _Chem_comp_atom.Oxidation_number _Chem_comp_atom.Unpaired_electron_number _Chem_comp_atom.Align _Chem_comp_atom.Aromatic_flag _Chem_comp_atom.Leaving_atom_flag _Chem_comp_atom.Substruct_code _Chem_comp_atom.Ionizable _Chem_comp_atom.Drawing_2D_coord_x _Chem_comp_atom.Drawing_2D_coord_y _Chem_comp_atom.Model_Cartn_x _Chem_comp_atom.Model_Cartn_x_esd _Chem_comp_atom.Model_Cartn_y _Chem_comp_atom.Model_Cartn_y_esd _Chem_comp_atom.Model_Cartn_z _Chem_comp_atom.Model_Cartn_z_esd _Chem_comp_atom.Model_Cartn_x_ideal _Chem_comp_atom.Model_Cartn_y_ideal _Chem_comp_atom.Model_Cartn_z_ideal _Chem_comp_atom.PDBX_ordinal _Chem_comp_atom.Details _Chem_comp_atom.Entry_ID _Chem_comp_atom.Comp_ID ZN ZN ZN ZN . ZN . . N 2 . . . 0 no no . . . . 0.000 . 0.000 . 0.000 . 0.000 0.000 0.000 1 . 34231 ZN stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 34231 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 1200 uM [U-13C; U-15N] Fusion construct of p300 Taz2 and the transactivation domain of p63, 25 mM MES, 200 mM NaCl, 0.5 mM TCEP, 95% H2O/5% D2O ; _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Fusion construct of p300 Taz2 and the transactivation domain of p63' '[U-13C; U-15N]' . . 1 $entity_1 . . 1200 . . uM . . . . 34231 1 2 MES 'natural abundance' . . . . . . 25 . . mM . . . . 34231 1 3 NaCl 'natural abundance' . . . . . . 200 . . mM . . . . 34231 1 4 TCEP 'natural abundance' . . . . . . 0.5 . . mM . . . . 34231 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 34231 _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 34231 1 pH 6.3 . pH 34231 1 pressure 1 . mbar 34231 1 temperature 303 . K 34231 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 34231 _Software.ID 1 _Software.Type . _Software.Name OPAL _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Luginbuhl, Guntert, Billeter and Wuthrich' . . 34231 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 34231 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 34231 _Software.ID 2 _Software.Type . _Software.Name CYANA _Software.Version 3.9 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 34231 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure calculation' 34231 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 34231 _Software.ID 3 _Software.Type . _Software.Name Sparky _Software.Version 3.13 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'T. D. Goddard and D. G. Kneller, SPARKY 3, University of California, San Francisco' . . 34231 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 34231 3 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 34231 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'Avance III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 34231 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'Avance III HD' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_NMR_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_3 _NMR_spectrometer.Entry_ID 34231 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'Avance III HD' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_4 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_4 _NMR_spectrometer.Entry_ID 34231 _NMR_spectrometer.ID 4 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 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 34231 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer_1 Bruker 'Avance III' . 600 . . . 34231 1 2 NMR_spectrometer_2 Bruker 'Avance III HD' . 700 . . . 34231 1 3 NMR_spectrometer_3 Bruker 'Avance III HD' . 800 . . . 34231 1 4 NMR_spectrometer_4 Bruker Avance . 900 . . . 34231 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 34231 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 4 $NMR_spectrometer_4 . . . . . . . . . . . . . . . . 34231 1 2 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34231 1 3 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 4 $NMR_spectrometer_4 . . . . . . . . . . . . . . . . 34231 1 4 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34231 1 5 '2D 1H-13C HSQC aliphatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 4 $NMR_spectrometer_4 . . . . . . . . . . . . . . . . 34231 1 6 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34231 1 7 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34231 1 8 '3D HN(COCA)CB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34231 1 9 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34231 1 10 '3D H(CCO)NH TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34231 1 11 '3D C(CO)NH TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34231 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 34231 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID H 1 DSS 'methyl protons' . . . . ppm 0.000 internal direct 1.0 . . . . . 34231 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 34231 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D 1H-13C NOESY aliphatic' . . . 34231 1 2 '3D 1H-13C NOESY aromatic' . . . 34231 1 3 '3D 1H-15N NOESY' . . . 34231 1 4 '2D 1H-13C HSQC aromatic' . . . 34231 1 5 '2D 1H-13C HSQC aliphatic' . . . 34231 1 6 '2D 1H-15N HSQC' . . . 34231 1 7 '3D HNCACB' . . . 34231 1 8 '3D HN(COCA)CB' . . . 34231 1 9 '3D HNCO' . . . 34231 1 10 '3D H(CCO)NH TOCSY' . . . 34231 1 11 '3D C(CO)NH TOCSY' . . . 34231 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 ALA H H 1 8.535 0.020 . 1 . . . . A 1 ALA H1 . 34231 1 2 . 1 1 1 1 ALA HA H 1 4.431 0.020 . 1 . . . . A 1 ALA HA . 34231 1 3 . 1 1 1 1 ALA HB1 H 1 1.439 0.020 . 1 . . . . A 1 ALA HB1 . 34231 1 4 . 1 1 1 1 ALA HB2 H 1 1.439 0.020 . 1 . . . . A 1 ALA HB2 . 34231 1 5 . 1 1 1 1 ALA HB3 H 1 1.439 0.020 . 1 . . . . A 1 ALA HB3 . 34231 1 6 . 1 1 1 1 ALA C C 13 177.995 0.400 . 1 . . . . A 1 ALA C . 34231 1 7 . 1 1 1 1 ALA CA C 13 52.815 0.400 . 1 . . . . A 1 ALA CA . 34231 1 8 . 1 1 1 1 ALA CB C 13 19.315 0.400 . 1 . . . . A 1 ALA CB . 34231 1 9 . 1 1 1 1 ALA N N 15 126.195 0.400 . 1 . . . . A 1 ALA N . 34231 1 10 . 1 1 2 2 THR H H 1 8.099 0.020 . 1 . . . . A 2 THR H . 34231 1 11 . 1 1 2 2 THR HA H 1 4.330 0.020 . 1 . . . . A 2 THR HA . 34231 1 12 . 1 1 2 2 THR HB H 1 3.975 0.020 . 1 . . . . A 2 THR HB . 34231 1 13 . 1 1 2 2 THR HG21 H 1 1.208 0.020 . 1 . . . . A 2 THR HG21 . 34231 1 14 . 1 1 2 2 THR HG22 H 1 1.208 0.020 . 1 . . . . A 2 THR HG22 . 34231 1 15 . 1 1 2 2 THR HG23 H 1 1.208 0.020 . 1 . . . . A 2 THR HG23 . 34231 1 16 . 1 1 2 2 THR C C 13 174.467 0.400 . 1 . . . . A 2 THR C . 34231 1 17 . 1 1 2 2 THR CA C 13 61.868 0.400 . 1 . . . . A 2 THR CA . 34231 1 18 . 1 1 2 2 THR CB C 13 69.802 0.400 . 1 . . . . A 2 THR CB . 34231 1 19 . 1 1 2 2 THR CG2 C 13 21.700 0.400 . 1 . . . . A 2 THR CG2 . 34231 1 20 . 1 1 2 2 THR N N 15 113.169 0.400 . 1 . . . . A 2 THR N . 34231 1 21 . 1 1 3 3 GLN H H 1 8.312 0.020 . 1 . . . . A 3 GLN H . 34231 1 22 . 1 1 3 3 GLN HA H 1 4.435 0.020 . 1 . . . . A 3 GLN HA . 34231 1 23 . 1 1 3 3 GLN HB2 H 1 2.110 0.020 . 2 . . . . A 3 GLN HB2 . 34231 1 24 . 1 1 3 3 GLN HB3 H 1 1.998 0.020 . 2 . . . . A 3 GLN HB3 . 34231 1 25 . 1 1 3 3 GLN HG2 H 1 2.400 0.020 . 2 . . . . A 3 GLN HG2 . 34231 1 26 . 1 1 3 3 GLN HG3 H 1 2.400 0.020 . 2 . . . . A 3 GLN HG3 . 34231 1 27 . 1 1 3 3 GLN C C 13 175.682 0.400 . 1 . . . . A 3 GLN C . 34231 1 28 . 1 1 3 3 GLN CA C 13 55.686 0.400 . 1 . . . . A 3 GLN CA . 34231 1 29 . 1 1 3 3 GLN CB C 13 29.853 0.400 . 1 . . . . A 3 GLN CB . 34231 1 30 . 1 1 3 3 GLN CG C 13 33.926 0.400 . 1 . . . . A 3 GLN CG . 34231 1 31 . 1 1 3 3 GLN N N 15 122.762 0.400 . 1 . . . . A 3 GLN N . 34231 1 32 . 1 1 4 4 SER H H 1 8.561 0.020 . 1 . . . . A 4 SER H . 34231 1 33 . 1 1 4 4 SER CA C 13 56.372 0.400 . 1 . . . . A 4 SER CA . 34231 1 34 . 1 1 4 4 SER CB C 13 63.405 0.400 . 1 . . . . A 4 SER CB . 34231 1 35 . 1 1 4 4 SER N N 15 119.202 0.400 . 1 . . . . A 4 SER N . 34231 1 36 . 1 1 5 5 PRO HA H 1 4.449 0.020 . 1 . . . . A 5 PRO HA . 34231 1 37 . 1 1 5 5 PRO HB2 H 1 2.333 0.020 . 2 . . . . A 5 PRO HB2 . 34231 1 38 . 1 1 5 5 PRO HB3 H 1 2.333 0.020 . 2 . . . . A 5 PRO HB3 . 34231 1 39 . 1 1 5 5 PRO HG2 H 1 2.064 0.020 . 2 . . . . A 5 PRO HG2 . 34231 1 40 . 1 1 5 5 PRO HG3 H 1 1.984 0.020 . 2 . . . . A 5 PRO HG3 . 34231 1 41 . 1 1 5 5 PRO HD2 H 1 3.835 0.020 . 2 . . . . A 5 PRO HD2 . 34231 1 42 . 1 1 5 5 PRO HD3 H 1 3.807 0.020 . 2 . . . . A 5 PRO HD3 . 34231 1 43 . 1 1 5 5 PRO C C 13 177.978 0.400 . 1 . . . . A 5 PRO C . 34231 1 44 . 1 1 5 5 PRO CA C 13 64.110 0.400 . 1 . . . . A 5 PRO CA . 34231 1 45 . 1 1 5 5 PRO CB C 13 32.060 0.400 . 1 . . . . A 5 PRO CB . 34231 1 46 . 1 1 5 5 PRO CG C 13 27.581 0.400 . 1 . . . . A 5 PRO CG . 34231 1 47 . 1 1 5 5 PRO CD C 13 50.847 0.400 . 1 . . . . A 5 PRO CD . 34231 1 48 . 1 1 6 6 GLY H H 1 8.430 0.020 . 1 . . . . A 6 GLY H . 34231 1 49 . 1 1 6 6 GLY HA2 H 1 3.947 0.020 . 2 . . . . A 6 GLY HA2 . 34231 1 50 . 1 1 6 6 GLY HA3 H 1 3.947 0.020 . 2 . . . . A 6 GLY HA3 . 34231 1 51 . 1 1 6 6 GLY C C 13 174.585 0.400 . 1 . . . . A 6 GLY C . 34231 1 52 . 1 1 6 6 GLY CA C 13 45.732 0.400 . 1 . . . . A 6 GLY CA . 34231 1 53 . 1 1 6 6 GLY N N 15 108.287 0.400 . 1 . . . . A 6 GLY N . 34231 1 54 . 1 1 7 7 ASP H H 1 8.087 0.020 . 1 . . . . A 7 ASP H . 34231 1 55 . 1 1 7 7 ASP HA H 1 4.627 0.020 . 1 . . . . A 7 ASP HA . 34231 1 56 . 1 1 7 7 ASP HB2 H 1 2.745 0.020 . 2 . . . . A 7 ASP HB2 . 34231 1 57 . 1 1 7 7 ASP HB3 H 1 2.745 0.020 . 2 . . . . A 7 ASP HB3 . 34231 1 58 . 1 1 7 7 ASP C C 13 177.292 0.400 . 1 . . . . A 7 ASP C . 34231 1 59 . 1 1 7 7 ASP CA C 13 55.167 0.400 . 1 . . . . A 7 ASP CA . 34231 1 60 . 1 1 7 7 ASP CB C 13 41.367 0.400 . 1 . . . . A 7 ASP CB . 34231 1 61 . 1 1 7 7 ASP N N 15 121.170 0.400 . 1 . . . . A 7 ASP N . 34231 1 62 . 1 1 8 8 SER H H 1 8.376 0.020 . 1 . . . . A 8 SER H . 34231 1 63 . 1 1 8 8 SER HA H 1 4.325 0.020 . 1 . . . . A 8 SER HA . 34231 1 64 . 1 1 8 8 SER HB2 H 1 3.971 0.020 . 2 . . . . A 8 SER HB2 . 34231 1 65 . 1 1 8 8 SER HB3 H 1 3.971 0.020 . 2 . . . . A 8 SER HB3 . 34231 1 66 . 1 1 8 8 SER C C 13 176.177 0.400 . 1 . . . . A 8 SER C . 34231 1 67 . 1 1 8 8 SER CA C 13 60.305 0.400 . 1 . . . . A 8 SER CA . 34231 1 68 . 1 1 8 8 SER CB C 13 63.229 0.400 . 1 . . . . A 8 SER CB . 34231 1 69 . 1 1 8 8 SER N N 15 116.886 0.400 . 1 . . . . A 8 SER N . 34231 1 70 . 1 1 9 9 ARG H H 1 8.283 0.020 . 1 . . . . A 9 ARG H . 34231 1 71 . 1 1 9 9 ARG HA H 1 4.174 0.020 . 1 . . . . A 9 ARG HA . 34231 1 72 . 1 1 9 9 ARG HB2 H 1 1.863 0.020 . 2 . . . . A 9 ARG HB2 . 34231 1 73 . 1 1 9 9 ARG HB3 H 1 1.863 0.020 . 2 . . . . A 9 ARG HB3 . 34231 1 74 . 1 1 9 9 ARG HG2 H 1 1.640 0.020 . 2 . . . . A 9 ARG HG2 . 34231 1 75 . 1 1 9 9 ARG HG3 H 1 1.542 0.020 . 2 . . . . A 9 ARG HG3 . 34231 1 76 . 1 1 9 9 ARG HD2 H 1 3.222 0.020 . 2 . . . . A 9 ARG HD2 . 34231 1 77 . 1 1 9 9 ARG HD3 H 1 3.109 0.020 . 2 . . . . A 9 ARG HD3 . 34231 1 78 . 1 1 9 9 ARG C C 13 177.504 0.400 . 1 . . . . A 9 ARG C . 34231 1 79 . 1 1 9 9 ARG CA C 13 58.388 0.400 . 1 . . . . A 9 ARG CA . 34231 1 80 . 1 1 9 9 ARG CB C 13 30.005 0.400 . 1 . . . . A 9 ARG CB . 34231 1 81 . 1 1 9 9 ARG CG C 13 27.619 0.400 . 1 . . . . A 9 ARG CG . 34231 1 82 . 1 1 9 9 ARG CD C 13 43.464 0.400 . 1 . . . . A 9 ARG CD . 34231 1 83 . 1 1 9 9 ARG N N 15 122.868 0.400 . 1 . . . . A 9 ARG N . 34231 1 84 . 1 1 10 10 ARG H H 1 7.997 0.020 . 1 . . . . A 10 ARG H . 34231 1 85 . 1 1 10 10 ARG HA H 1 4.058 0.020 . 1 . . . . A 10 ARG HA . 34231 1 86 . 1 1 10 10 ARG HB2 H 1 1.884 0.020 . 2 . . . . A 10 ARG HB2 . 34231 1 87 . 1 1 10 10 ARG HB3 H 1 1.884 0.020 . 2 . . . . A 10 ARG HB3 . 34231 1 88 . 1 1 10 10 ARG HG2 H 1 1.708 0.020 . 2 . . . . A 10 ARG HG2 . 34231 1 89 . 1 1 10 10 ARG HG3 H 1 1.573 0.020 . 2 . . . . A 10 ARG HG3 . 34231 1 90 . 1 1 10 10 ARG HD2 H 1 3.225 0.020 . 2 . . . . A 10 ARG HD2 . 34231 1 91 . 1 1 10 10 ARG HD3 H 1 3.225 0.020 . 2 . . . . A 10 ARG HD3 . 34231 1 92 . 1 1 10 10 ARG C C 13 177.981 0.400 . 1 . . . . A 10 ARG C . 34231 1 93 . 1 1 10 10 ARG CA C 13 58.577 0.400 . 1 . . . . A 10 ARG CA . 34231 1 94 . 1 1 10 10 ARG CB C 13 30.273 0.400 . 1 . . . . A 10 ARG CB . 34231 1 95 . 1 1 10 10 ARG CG C 13 27.622 0.400 . 1 . . . . A 10 ARG CG . 34231 1 96 . 1 1 10 10 ARG CD C 13 43.418 0.400 . 1 . . . . A 10 ARG CD . 34231 1 97 . 1 1 10 10 ARG N N 15 119.584 0.400 . 1 . . . . A 10 ARG N . 34231 1 98 . 1 1 11 11 LEU H H 1 8.100 0.020 . 1 . . . . A 11 LEU H . 34231 1 99 . 1 1 11 11 LEU HA H 1 4.197 0.020 . 1 . . . . A 11 LEU HA . 34231 1 100 . 1 1 11 11 LEU HB2 H 1 1.697 0.020 . 2 . . . . A 11 LEU HB2 . 34231 1 101 . 1 1 11 11 LEU HB3 H 1 1.697 0.020 . 2 . . . . A 11 LEU HB3 . 34231 1 102 . 1 1 11 11 LEU HG H 1 1.627 0.020 . 1 . . . . A 11 LEU HG . 34231 1 103 . 1 1 11 11 LEU HD11 H 1 0.885 0.020 . 2 . . . . A 11 LEU HD11 . 34231 1 104 . 1 1 11 11 LEU HD12 H 1 0.885 0.020 . 2 . . . . A 11 LEU HD12 . 34231 1 105 . 1 1 11 11 LEU HD13 H 1 0.885 0.020 . 2 . . . . A 11 LEU HD13 . 34231 1 106 . 1 1 11 11 LEU HD21 H 1 0.841 0.020 . 2 . . . . A 11 LEU HD21 . 34231 1 107 . 1 1 11 11 LEU HD22 H 1 0.841 0.020 . 2 . . . . A 11 LEU HD22 . 34231 1 108 . 1 1 11 11 LEU HD23 H 1 0.841 0.020 . 2 . . . . A 11 LEU HD23 . 34231 1 109 . 1 1 11 11 LEU C C 13 178.544 0.400 . 1 . . . . A 11 LEU C . 34231 1 110 . 1 1 11 11 LEU CA C 13 57.076 0.400 . 1 . . . . A 11 LEU CA . 34231 1 111 . 1 1 11 11 LEU CB C 13 41.903 0.400 . 1 . . . . A 11 LEU CB . 34231 1 112 . 1 1 11 11 LEU CG C 13 27.185 0.400 . 1 . . . . A 11 LEU CG . 34231 1 113 . 1 1 11 11 LEU CD1 C 13 24.670 0.400 . 2 . . . . A 11 LEU CD1 . 34231 1 114 . 1 1 11 11 LEU CD2 C 13 23.901 0.400 . 2 . . . . A 11 LEU CD2 . 34231 1 115 . 1 1 11 11 LEU N N 15 120.774 0.400 . 1 . . . . A 11 LEU N . 34231 1 116 . 1 1 12 12 SER H H 1 8.032 0.020 . 1 . . . . A 12 SER H . 34231 1 117 . 1 1 12 12 SER HA H 1 4.299 0.020 . 1 . . . . A 12 SER HA . 34231 1 118 . 1 1 12 12 SER HB2 H 1 4.065 0.020 . 2 . . . . A 12 SER HB2 . 34231 1 119 . 1 1 12 12 SER HB3 H 1 3.931 0.020 . 2 . . . . A 12 SER HB3 . 34231 1 120 . 1 1 12 12 SER C C 13 176.833 0.400 . 1 . . . . A 12 SER C . 34231 1 121 . 1 1 12 12 SER CA C 13 60.879 0.400 . 1 . . . . A 12 SER CA . 34231 1 122 . 1 1 12 12 SER CB C 13 63.228 0.400 . 1 . . . . A 12 SER CB . 34231 1 123 . 1 1 12 12 SER N N 15 116.006 0.400 . 1 . . . . A 12 SER N . 34231 1 124 . 1 1 13 13 ILE H H 1 8.128 0.020 . 1 . . . . A 13 ILE H . 34231 1 125 . 1 1 13 13 ILE HA H 1 3.594 0.020 . 1 . . . . A 13 ILE HA . 34231 1 126 . 1 1 13 13 ILE HB H 1 1.759 0.020 . 1 . . . . A 13 ILE HB . 34231 1 127 . 1 1 13 13 ILE HG12 H 1 1.494 0.020 . 2 . . . . A 13 ILE HG12 . 34231 1 128 . 1 1 13 13 ILE HG13 H 1 1.494 0.020 . 2 . . . . A 13 ILE HG13 . 34231 1 129 . 1 1 13 13 ILE HG21 H 1 0.536 0.020 . 1 . . . . A 13 ILE HG21 . 34231 1 130 . 1 1 13 13 ILE HG22 H 1 0.536 0.020 . 1 . . . . A 13 ILE HG22 . 34231 1 131 . 1 1 13 13 ILE HG23 H 1 0.536 0.020 . 1 . . . . A 13 ILE HG23 . 34231 1 132 . 1 1 13 13 ILE HD11 H 1 0.530 0.020 . 1 . . . . A 13 ILE HD11 . 34231 1 133 . 1 1 13 13 ILE HD12 H 1 0.530 0.020 . 1 . . . . A 13 ILE HD12 . 34231 1 134 . 1 1 13 13 ILE HD13 H 1 0.530 0.020 . 1 . . . . A 13 ILE HD13 . 34231 1 135 . 1 1 13 13 ILE C C 13 177.185 0.400 . 1 . . . . A 13 ILE C . 34231 1 136 . 1 1 13 13 ILE CA C 13 64.967 0.400 . 1 . . . . A 13 ILE CA . 34231 1 137 . 1 1 13 13 ILE CB C 13 37.719 0.400 . 1 . . . . A 13 ILE CB . 34231 1 138 . 1 1 13 13 ILE CG1 C 13 29.224 0.400 . 1 . . . . A 13 ILE CG1 . 34231 1 139 . 1 1 13 13 ILE CG2 C 13 17.174 0.400 . 1 . . . . A 13 ILE CG2 . 34231 1 140 . 1 1 13 13 ILE CD1 C 13 13.215 0.400 . 1 . . . . A 13 ILE CD1 . 34231 1 141 . 1 1 13 13 ILE N N 15 123.239 0.400 . 1 . . . . A 13 ILE N . 34231 1 142 . 1 1 14 14 GLN H H 1 8.130 0.020 . 1 . . . . A 14 GLN H . 34231 1 143 . 1 1 14 14 GLN HA H 1 4.009 0.020 . 1 . . . . A 14 GLN HA . 34231 1 144 . 1 1 14 14 GLN HB2 H 1 2.171 0.020 . 2 . . . . A 14 GLN HB2 . 34231 1 145 . 1 1 14 14 GLN HB3 H 1 2.171 0.020 . 2 . . . . A 14 GLN HB3 . 34231 1 146 . 1 1 14 14 GLN HG2 H 1 2.516 0.020 . 2 . . . . A 14 GLN HG2 . 34231 1 147 . 1 1 14 14 GLN HG3 H 1 2.452 0.020 . 2 . . . . A 14 GLN HG3 . 34231 1 148 . 1 1 14 14 GLN C C 13 179.080 0.400 . 1 . . . . A 14 GLN C . 34231 1 149 . 1 1 14 14 GLN CA C 13 59.464 0.400 . 1 . . . . A 14 GLN CA . 34231 1 150 . 1 1 14 14 GLN CB C 13 28.260 0.400 . 1 . . . . A 14 GLN CB . 34231 1 151 . 1 1 14 14 GLN CG C 13 33.930 0.400 . 1 . . . . A 14 GLN CG . 34231 1 152 . 1 1 14 14 GLN N N 15 118.972 0.400 . 1 . . . . A 14 GLN N . 34231 1 153 . 1 1 15 15 ARG H H 1 8.213 0.020 . 1 . . . . A 15 ARG H . 34231 1 154 . 1 1 15 15 ARG HA H 1 4.133 0.020 . 1 . . . . A 15 ARG HA . 34231 1 155 . 1 1 15 15 ARG HB2 H 1 1.957 0.020 . 2 . . . . A 15 ARG HB2 . 34231 1 156 . 1 1 15 15 ARG HB3 H 1 1.860 0.020 . 2 . . . . A 15 ARG HB3 . 34231 1 157 . 1 1 15 15 ARG HG2 H 1 1.688 0.020 . 2 . . . . A 15 ARG HG2 . 34231 1 158 . 1 1 15 15 ARG HG3 H 1 1.688 0.020 . 2 . . . . A 15 ARG HG3 . 34231 1 159 . 1 1 15 15 ARG HD2 H 1 3.233 0.020 . 2 . . . . A 15 ARG HD2 . 34231 1 160 . 1 1 15 15 ARG HD3 H 1 3.233 0.020 . 2 . . . . A 15 ARG HD3 . 34231 1 161 . 1 1 15 15 ARG C C 13 179.166 0.400 . 1 . . . . A 15 ARG C . 34231 1 162 . 1 1 15 15 ARG CA C 13 59.257 0.400 . 1 . . . . A 15 ARG CA . 34231 1 163 . 1 1 15 15 ARG CB C 13 30.179 0.400 . 1 . . . . A 15 ARG CB . 34231 1 164 . 1 1 15 15 ARG CG C 13 27.629 0.400 . 1 . . . . A 15 ARG CG . 34231 1 165 . 1 1 15 15 ARG CD C 13 43.464 0.400 . 1 . . . . A 15 ARG CD . 34231 1 166 . 1 1 15 15 ARG N N 15 118.886 0.400 . 1 . . . . A 15 ARG N . 34231 1 167 . 1 1 16 16 ALA H H 1 7.995 0.020 . 1 . . . . A 16 ALA H . 34231 1 168 . 1 1 16 16 ALA HA H 1 4.152 0.020 . 1 . . . . A 16 ALA HA . 34231 1 169 . 1 1 16 16 ALA HB1 H 1 1.434 0.020 . 1 . . . . A 16 ALA HB1 . 34231 1 170 . 1 1 16 16 ALA HB2 H 1 1.434 0.020 . 1 . . . . A 16 ALA HB2 . 34231 1 171 . 1 1 16 16 ALA HB3 H 1 1.434 0.020 . 1 . . . . A 16 ALA HB3 . 34231 1 172 . 1 1 16 16 ALA C C 13 179.943 0.400 . 1 . . . . A 16 ALA C . 34231 1 173 . 1 1 16 16 ALA CA C 13 55.463 0.400 . 1 . . . . A 16 ALA CA . 34231 1 174 . 1 1 16 16 ALA CB C 13 18.487 0.400 . 1 . . . . A 16 ALA CB . 34231 1 175 . 1 1 16 16 ALA N N 15 123.749 0.400 . 1 . . . . A 16 ALA N . 34231 1 176 . 1 1 17 17 ILE H H 1 8.502 0.020 . 1 . . . . A 17 ILE H . 34231 1 177 . 1 1 17 17 ILE HA H 1 3.689 0.020 . 1 . . . . A 17 ILE HA . 34231 1 178 . 1 1 17 17 ILE HB H 1 2.132 0.020 . 1 . . . . A 17 ILE HB . 34231 1 179 . 1 1 17 17 ILE HG12 H 1 1.262 0.020 . 2 . . . . A 17 ILE HG12 . 34231 1 180 . 1 1 17 17 ILE HG13 H 1 1.262 0.020 . 2 . . . . A 17 ILE HG13 . 34231 1 181 . 1 1 17 17 ILE HG21 H 1 1.063 0.020 . 1 . . . . A 17 ILE HG21 . 34231 1 182 . 1 1 17 17 ILE HG22 H 1 1.063 0.020 . 1 . . . . A 17 ILE HG22 . 34231 1 183 . 1 1 17 17 ILE HG23 H 1 1.063 0.020 . 1 . . . . A 17 ILE HG23 . 34231 1 184 . 1 1 17 17 ILE HD11 H 1 0.923 0.020 . 1 . . . . A 17 ILE HD11 . 34231 1 185 . 1 1 17 17 ILE HD12 H 1 0.923 0.020 . 1 . . . . A 17 ILE HD12 . 34231 1 186 . 1 1 17 17 ILE HD13 H 1 0.923 0.020 . 1 . . . . A 17 ILE HD13 . 34231 1 187 . 1 1 17 17 ILE C C 13 177.806 0.400 . 1 . . . . A 17 ILE C . 34231 1 188 . 1 1 17 17 ILE CA C 13 64.962 0.400 . 1 . . . . A 17 ILE CA . 34231 1 189 . 1 1 17 17 ILE CB C 13 37.301 0.400 . 1 . . . . A 17 ILE CB . 34231 1 190 . 1 1 17 17 ILE CG1 C 13 29.367 0.400 . 1 . . . . A 17 ILE CG1 . 34231 1 191 . 1 1 17 17 ILE CG2 C 13 18.388 0.400 . 1 . . . . A 17 ILE CG2 . 34231 1 192 . 1 1 17 17 ILE CD1 C 13 13.986 0.400 . 1 . . . . A 17 ILE CD1 . 34231 1 193 . 1 1 17 17 ILE N N 15 118.122 0.400 . 1 . . . . A 17 ILE N . 34231 1 194 . 1 1 18 18 GLN H H 1 8.246 0.020 . 1 . . . . A 18 GLN H . 34231 1 195 . 1 1 18 18 GLN HA H 1 4.083 0.020 . 1 . . . . A 18 GLN HA . 34231 1 196 . 1 1 18 18 GLN HB2 H 1 2.296 0.020 . 2 . . . . A 18 GLN HB2 . 34231 1 197 . 1 1 18 18 GLN HB3 H 1 2.190 0.020 . 2 . . . . A 18 GLN HB3 . 34231 1 198 . 1 1 18 18 GLN HG2 H 1 2.626 0.020 . 2 . . . . A 18 GLN HG2 . 34231 1 199 . 1 1 18 18 GLN HG3 H 1 2.510 0.020 . 2 . . . . A 18 GLN HG3 . 34231 1 200 . 1 1 18 18 GLN C C 13 179.634 0.400 . 1 . . . . A 18 GLN C . 34231 1 201 . 1 1 18 18 GLN CA C 13 59.337 0.400 . 1 . . . . A 18 GLN CA . 34231 1 202 . 1 1 18 18 GLN CB C 13 28.132 0.400 . 1 . . . . A 18 GLN CB . 34231 1 203 . 1 1 18 18 GLN CG C 13 34.199 0.400 . 1 . . . . A 18 GLN CG . 34231 1 204 . 1 1 18 18 GLN N N 15 118.875 0.400 . 1 . . . . A 18 GLN N . 34231 1 205 . 1 1 19 19 SER H H 1 8.162 0.020 . 1 . . . . A 19 SER H . 34231 1 206 . 1 1 19 19 SER HA H 1 4.397 0.020 . 1 . . . . A 19 SER HA . 34231 1 207 . 1 1 19 19 SER HB2 H 1 4.112 0.020 . 2 . . . . A 19 SER HB2 . 34231 1 208 . 1 1 19 19 SER HB3 H 1 3.936 0.020 . 2 . . . . A 19 SER HB3 . 34231 1 209 . 1 1 19 19 SER C C 13 176.170 0.400 . 1 . . . . A 19 SER C . 34231 1 210 . 1 1 19 19 SER CA C 13 61.884 0.400 . 1 . . . . A 19 SER CA . 34231 1 211 . 1 1 19 19 SER CB C 13 62.941 0.400 . 1 . . . . A 19 SER CB . 34231 1 212 . 1 1 19 19 SER N N 15 115.992 0.400 . 1 . . . . A 19 SER N . 34231 1 213 . 1 1 20 20 LEU H H 1 8.163 0.020 . 1 . . . . A 20 LEU H . 34231 1 214 . 1 1 20 20 LEU HA H 1 4.055 0.020 . 1 . . . . A 20 LEU HA . 34231 1 215 . 1 1 20 20 LEU HB2 H 1 2.074 0.020 . 2 . . . . A 20 LEU HB2 . 34231 1 216 . 1 1 20 20 LEU HB3 H 1 1.691 0.020 . 2 . . . . A 20 LEU HB3 . 34231 1 217 . 1 1 20 20 LEU HG H 1 1.534 0.020 . 1 . . . . A 20 LEU HG . 34231 1 218 . 1 1 20 20 LEU HD11 H 1 0.847 0.020 . 2 . . . . A 20 LEU HD11 . 34231 1 219 . 1 1 20 20 LEU HD12 H 1 0.847 0.020 . 2 . . . . A 20 LEU HD12 . 34231 1 220 . 1 1 20 20 LEU HD13 H 1 0.847 0.020 . 2 . . . . A 20 LEU HD13 . 34231 1 221 . 1 1 20 20 LEU HD21 H 1 0.907 0.020 . 2 . . . . A 20 LEU HD21 . 34231 1 222 . 1 1 20 20 LEU HD22 H 1 0.907 0.020 . 2 . . . . A 20 LEU HD22 . 34231 1 223 . 1 1 20 20 LEU HD23 H 1 0.907 0.020 . 2 . . . . A 20 LEU HD23 . 34231 1 224 . 1 1 20 20 LEU C C 13 177.117 0.400 . 1 . . . . A 20 LEU C . 34231 1 225 . 1 1 20 20 LEU CA C 13 58.706 0.400 . 1 . . . . A 20 LEU CA . 34231 1 226 . 1 1 20 20 LEU CB C 13 42.306 0.400 . 1 . . . . A 20 LEU CB . 34231 1 227 . 1 1 20 20 LEU CG C 13 27.430 0.400 . 1 . . . . A 20 LEU CG . 34231 1 228 . 1 1 20 20 LEU CD1 C 13 25.919 0.400 . 2 . . . . A 20 LEU CD1 . 34231 1 229 . 1 1 20 20 LEU CD2 C 13 23.639 0.400 . 2 . . . . A 20 LEU CD2 . 34231 1 230 . 1 1 20 20 LEU N N 15 125.380 0.400 . 1 . . . . A 20 LEU N . 34231 1 231 . 1 1 21 21 VAL H H 1 8.502 0.020 . 1 . . . . A 21 VAL H . 34231 1 232 . 1 1 21 21 VAL HA H 1 3.281 0.020 . 1 . . . . A 21 VAL HA . 34231 1 233 . 1 1 21 21 VAL HB H 1 2.100 0.020 . 1 . . . . A 21 VAL HB . 34231 1 234 . 1 1 21 21 VAL HG11 H 1 0.926 0.020 . 2 . . . . A 21 VAL HG11 . 34231 1 235 . 1 1 21 21 VAL HG12 H 1 0.926 0.020 . 2 . . . . A 21 VAL HG12 . 34231 1 236 . 1 1 21 21 VAL HG13 H 1 0.926 0.020 . 2 . . . . A 21 VAL HG13 . 34231 1 237 . 1 1 21 21 VAL HG21 H 1 0.926 0.020 . 2 . . . . A 21 VAL HG21 . 34231 1 238 . 1 1 21 21 VAL HG22 H 1 0.926 0.020 . 2 . . . . A 21 VAL HG22 . 34231 1 239 . 1 1 21 21 VAL HG23 H 1 0.926 0.020 . 2 . . . . A 21 VAL HG23 . 34231 1 240 . 1 1 21 21 VAL C C 13 178.381 0.400 . 1 . . . . A 21 VAL C . 34231 1 241 . 1 1 21 21 VAL CA C 13 66.977 0.400 . 1 . . . . A 21 VAL CA . 34231 1 242 . 1 1 21 21 VAL CB C 13 31.778 0.400 . 1 . . . . A 21 VAL CB . 34231 1 243 . 1 1 21 21 VAL CG1 C 13 21.262 0.400 . 2 . . . . A 21 VAL CG1 . 34231 1 244 . 1 1 21 21 VAL CG2 C 13 23.398 0.400 . 2 . . . . A 21 VAL CG2 . 34231 1 245 . 1 1 21 21 VAL N N 15 118.615 0.400 . 1 . . . . A 21 VAL N . 34231 1 246 . 1 1 22 22 HIS H H 1 7.993 0.020 . 1 . . . . A 22 HIS H . 34231 1 247 . 1 1 22 22 HIS HA H 1 4.192 0.020 . 1 . . . . A 22 HIS HA . 34231 1 248 . 1 1 22 22 HIS HB2 H 1 3.288 0.020 . 2 . . . . A 22 HIS HB2 . 34231 1 249 . 1 1 22 22 HIS HB3 H 1 3.288 0.020 . 2 . . . . A 22 HIS HB3 . 34231 1 250 . 1 1 22 22 HIS HD2 H 1 7.281 0.020 . 1 . . . . A 22 HIS HD2 . 34231 1 251 . 1 1 22 22 HIS HE1 H 1 7.949 0.020 . 1 . . . . A 22 HIS HE1 . 34231 1 252 . 1 1 22 22 HIS C C 13 178.028 0.400 . 1 . . . . A 22 HIS C . 34231 1 253 . 1 1 22 22 HIS CA C 13 60.232 0.400 . 1 . . . . A 22 HIS CA . 34231 1 254 . 1 1 22 22 HIS CB C 13 27.856 0.400 . 1 . . . . A 22 HIS CB . 34231 1 255 . 1 1 22 22 HIS CD2 C 13 129.185 0.400 . 1 . . . . A 22 HIS CD2 . 34231 1 256 . 1 1 22 22 HIS CE1 C 13 139.377 0.400 . 1 . . . . A 22 HIS CE1 . 34231 1 257 . 1 1 22 22 HIS N N 15 115.749 0.400 . 1 . . . . A 22 HIS N . 34231 1 258 . 1 1 22 22 HIS ND1 N 15 172.704 0.400 . 1 . . . . A 22 HIS ND1 . 34231 1 259 . 1 1 22 22 HIS NE2 N 15 218.464 0.400 . 1 . . . . A 22 HIS NE2 . 34231 1 260 . 1 1 23 23 ALA H H 1 8.518 0.020 . 1 . . . . A 23 ALA H . 34231 1 261 . 1 1 23 23 ALA HA H 1 4.144 0.020 . 1 . . . . A 23 ALA HA . 34231 1 262 . 1 1 23 23 ALA HB1 H 1 1.567 0.020 . 1 . . . . A 23 ALA HB1 . 34231 1 263 . 1 1 23 23 ALA HB2 H 1 1.567 0.020 . 1 . . . . A 23 ALA HB2 . 34231 1 264 . 1 1 23 23 ALA HB3 H 1 1.567 0.020 . 1 . . . . A 23 ALA HB3 . 34231 1 265 . 1 1 23 23 ALA C C 13 179.120 0.400 . 1 . . . . A 23 ALA C . 34231 1 266 . 1 1 23 23 ALA CA C 13 55.169 0.400 . 1 . . . . A 23 ALA CA . 34231 1 267 . 1 1 23 23 ALA CB C 13 19.759 0.400 . 1 . . . . A 23 ALA CB . 34231 1 268 . 1 1 23 23 ALA N N 15 121.090 0.400 . 1 . . . . A 23 ALA N . 34231 1 269 . 1 1 24 24 ALA H H 1 8.196 0.020 . 1 . . . . A 24 ALA H . 34231 1 270 . 1 1 24 24 ALA HA H 1 4.054 0.020 . 1 . . . . A 24 ALA HA . 34231 1 271 . 1 1 24 24 ALA HB1 H 1 1.385 0.020 . 1 . . . . A 24 ALA HB1 . 34231 1 272 . 1 1 24 24 ALA HB2 H 1 1.385 0.020 . 1 . . . . A 24 ALA HB2 . 34231 1 273 . 1 1 24 24 ALA HB3 H 1 1.385 0.020 . 1 . . . . A 24 ALA HB3 . 34231 1 274 . 1 1 24 24 ALA C C 13 177.551 0.400 . 1 . . . . A 24 ALA C . 34231 1 275 . 1 1 24 24 ALA CA C 13 54.024 0.400 . 1 . . . . A 24 ALA CA . 34231 1 276 . 1 1 24 24 ALA CB C 13 18.561 0.400 . 1 . . . . A 24 ALA CB . 34231 1 277 . 1 1 24 24 ALA N N 15 116.425 0.400 . 1 . . . . A 24 ALA N . 34231 1 278 . 1 1 25 25 GLN H H 1 7.225 0.020 . 1 . . . . A 25 GLN H . 34231 1 279 . 1 1 25 25 GLN HA H 1 4.474 0.020 . 1 . . . . A 25 GLN HA . 34231 1 280 . 1 1 25 25 GLN HB2 H 1 2.153 0.020 . 2 . . . . A 25 GLN HB2 . 34231 1 281 . 1 1 25 25 GLN HB3 H 1 1.988 0.020 . 2 . . . . A 25 GLN HB3 . 34231 1 282 . 1 1 25 25 GLN HG2 H 1 2.464 0.020 . 2 . . . . A 25 GLN HG2 . 34231 1 283 . 1 1 25 25 GLN HG3 H 1 2.278 0.020 . 2 . . . . A 25 GLN HG3 . 34231 1 284 . 1 1 25 25 GLN C C 13 174.424 0.400 . 1 . . . . A 25 GLN C . 34231 1 285 . 1 1 25 25 GLN CA C 13 54.673 0.400 . 1 . . . . A 25 GLN CA . 34231 1 286 . 1 1 25 25 GLN CB C 13 30.752 0.400 . 1 . . . . A 25 GLN CB . 34231 1 287 . 1 1 25 25 GLN CG C 13 33.559 0.400 . 1 . . . . A 25 GLN CG . 34231 1 288 . 1 1 25 25 GLN N N 15 111.956 0.400 . 1 . . . . A 25 GLN N . 34231 1 289 . 1 1 26 26 CYS H H 1 7.293 0.020 . 1 . . . . A 26 CYS H . 34231 1 290 . 1 1 26 26 CYS HA H 1 3.881 0.020 . 1 . . . . A 26 CYS HA . 34231 1 291 . 1 1 26 26 CYS HB2 H 1 2.524 0.020 . 2 . . . . A 26 CYS HB2 . 34231 1 292 . 1 1 26 26 CYS HB3 H 1 2.055 0.020 . 2 . . . . A 26 CYS HB3 . 34231 1 293 . 1 1 26 26 CYS C C 13 176.185 0.400 . 1 . . . . A 26 CYS C . 34231 1 294 . 1 1 26 26 CYS CA C 13 60.910 0.400 . 1 . . . . A 26 CYS CA . 34231 1 295 . 1 1 26 26 CYS CB C 13 29.251 0.400 . 1 . . . . A 26 CYS CB . 34231 1 296 . 1 1 26 26 CYS N N 15 124.261 0.400 . 1 . . . . A 26 CYS N . 34231 1 297 . 1 1 27 27 ARG H H 1 8.864 0.020 . 1 . . . . A 27 ARG H . 34231 1 298 . 1 1 27 27 ARG HA H 1 4.607 0.020 . 1 . . . . A 27 ARG HA . 34231 1 299 . 1 1 27 27 ARG HB2 H 1 2.141 0.020 . 2 . . . . A 27 ARG HB2 . 34231 1 300 . 1 1 27 27 ARG HB3 H 1 2.141 0.020 . 2 . . . . A 27 ARG HB3 . 34231 1 301 . 1 1 27 27 ARG HG2 H 1 1.682 0.020 . 2 . . . . A 27 ARG HG2 . 34231 1 302 . 1 1 27 27 ARG HG3 H 1 1.630 0.020 . 2 . . . . A 27 ARG HG3 . 34231 1 303 . 1 1 27 27 ARG HD2 H 1 3.179 0.020 . 2 . . . . A 27 ARG HD2 . 34231 1 304 . 1 1 27 27 ARG HD3 H 1 3.179 0.020 . 2 . . . . A 27 ARG HD3 . 34231 1 305 . 1 1 27 27 ARG C C 13 175.181 0.400 . 1 . . . . A 27 ARG C . 34231 1 306 . 1 1 27 27 ARG CA C 13 54.636 0.400 . 1 . . . . A 27 ARG CA . 34231 1 307 . 1 1 27 27 ARG CB C 13 30.114 0.400 . 1 . . . . A 27 ARG CB . 34231 1 308 . 1 1 27 27 ARG CG C 13 26.906 0.400 . 1 . . . . A 27 ARG CG . 34231 1 309 . 1 1 27 27 ARG CD C 13 43.254 0.400 . 1 . . . . A 27 ARG CD . 34231 1 310 . 1 1 27 27 ARG N N 15 129.514 0.400 . 1 . . . . A 27 ARG N . 34231 1 311 . 1 1 28 28 ASN H H 1 7.925 0.020 . 1 . . . . A 28 ASN H . 34231 1 312 . 1 1 28 28 ASN HA H 1 4.837 0.020 . 1 . . . . A 28 ASN HA . 34231 1 313 . 1 1 28 28 ASN HB2 H 1 2.976 0.020 . 2 . . . . A 28 ASN HB2 . 34231 1 314 . 1 1 28 28 ASN HB3 H 1 2.850 0.020 . 2 . . . . A 28 ASN HB3 . 34231 1 315 . 1 1 28 28 ASN C C 13 175.691 0.400 . 1 . . . . A 28 ASN C . 34231 1 316 . 1 1 28 28 ASN CA C 13 51.880 0.400 . 1 . . . . A 28 ASN CA . 34231 1 317 . 1 1 28 28 ASN CB C 13 39.107 0.400 . 1 . . . . A 28 ASN CB . 34231 1 318 . 1 1 28 28 ASN N N 15 120.477 0.400 . 1 . . . . A 28 ASN N . 34231 1 319 . 1 1 29 29 ALA H H 1 9.125 0.020 . 1 . . . . A 29 ALA H . 34231 1 320 . 1 1 29 29 ALA HA H 1 4.091 0.020 . 1 . . . . A 29 ALA HA . 34231 1 321 . 1 1 29 29 ALA HB1 H 1 1.433 0.020 . 1 . . . . A 29 ALA HB1 . 34231 1 322 . 1 1 29 29 ALA HB2 H 1 1.433 0.020 . 1 . . . . A 29 ALA HB2 . 34231 1 323 . 1 1 29 29 ALA HB3 H 1 1.433 0.020 . 1 . . . . A 29 ALA HB3 . 34231 1 324 . 1 1 29 29 ALA C C 13 178.031 0.400 . 1 . . . . A 29 ALA C . 34231 1 325 . 1 1 29 29 ALA CA C 13 54.382 0.400 . 1 . . . . A 29 ALA CA . 34231 1 326 . 1 1 29 29 ALA CB C 13 18.471 0.400 . 1 . . . . A 29 ALA CB . 34231 1 327 . 1 1 29 29 ALA N N 15 130.246 0.400 . 1 . . . . A 29 ALA N . 34231 1 328 . 1 1 30 30 ASN H H 1 8.068 0.020 . 1 . . . . A 30 ASN H . 34231 1 329 . 1 1 30 30 ASN HA H 1 4.848 0.020 . 1 . . . . A 30 ASN HA . 34231 1 330 . 1 1 30 30 ASN HB2 H 1 2.947 0.020 . 2 . . . . A 30 ASN HB2 . 34231 1 331 . 1 1 30 30 ASN HB3 H 1 2.601 0.020 . 2 . . . . A 30 ASN HB3 . 34231 1 332 . 1 1 30 30 ASN C C 13 174.061 0.400 . 1 . . . . A 30 ASN C . 34231 1 333 . 1 1 30 30 ASN CA C 13 51.925 0.400 . 1 . . . . A 30 ASN CA . 34231 1 334 . 1 1 30 30 ASN CB C 13 38.869 0.400 . 1 . . . . A 30 ASN CB . 34231 1 335 . 1 1 30 30 ASN N N 15 114.142 0.400 . 1 . . . . A 30 ASN N . 34231 1 336 . 1 1 31 31 CYS H H 1 7.156 0.020 . 1 . . . . A 31 CYS H . 34231 1 337 . 1 1 31 31 CYS HA H 1 4.022 0.020 . 1 . . . . A 31 CYS HA . 34231 1 338 . 1 1 31 31 CYS HB2 H 1 3.017 0.020 . 2 . . . . A 31 CYS HB2 . 34231 1 339 . 1 1 31 31 CYS HB3 H 1 2.974 0.020 . 2 . . . . A 31 CYS HB3 . 34231 1 340 . 1 1 31 31 CYS C C 13 176.806 0.400 . 1 . . . . A 31 CYS C . 34231 1 341 . 1 1 31 31 CYS CA C 13 61.765 0.400 . 1 . . . . A 31 CYS CA . 34231 1 342 . 1 1 31 31 CYS CB C 13 30.032 0.400 . 1 . . . . A 31 CYS CB . 34231 1 343 . 1 1 31 31 CYS N N 15 123.049 0.400 . 1 . . . . A 31 CYS N . 34231 1 344 . 1 1 32 32 SER H H 1 8.774 0.020 . 1 . . . . A 32 SER H . 34231 1 345 . 1 1 32 32 SER HA H 1 4.585 0.020 . 1 . . . . A 32 SER HA . 34231 1 346 . 1 1 32 32 SER HB2 H 1 4.112 0.020 . 2 . . . . A 32 SER HB2 . 34231 1 347 . 1 1 32 32 SER HB3 H 1 3.871 0.020 . 2 . . . . A 32 SER HB3 . 34231 1 348 . 1 1 32 32 SER C C 13 174.803 0.400 . 1 . . . . A 32 SER C . 34231 1 349 . 1 1 32 32 SER CA C 13 57.984 0.400 . 1 . . . . A 32 SER CA . 34231 1 350 . 1 1 32 32 SER CB C 13 64.168 0.400 . 1 . . . . A 32 SER CB . 34231 1 351 . 1 1 32 32 SER N N 15 124.208 0.400 . 1 . . . . A 32 SER N . 34231 1 352 . 1 1 33 33 LEU H H 1 8.536 0.020 . 1 . . . . A 33 LEU H . 34231 1 353 . 1 1 33 33 LEU HA H 1 4.481 0.020 . 1 . . . . A 33 LEU HA . 34231 1 354 . 1 1 33 33 LEU HB2 H 1 1.433 0.020 . 2 . . . . A 33 LEU HB2 . 34231 1 355 . 1 1 33 33 LEU HB3 H 1 1.595 0.020 . 2 . . . . A 33 LEU HB3 . 34231 1 356 . 1 1 33 33 LEU HD11 H 1 0.554 0.020 . 2 . . . . A 33 LEU HD11 . 34231 1 357 . 1 1 33 33 LEU HD12 H 1 0.554 0.020 . 2 . . . . A 33 LEU HD12 . 34231 1 358 . 1 1 33 33 LEU HD13 H 1 0.554 0.020 . 2 . . . . A 33 LEU HD13 . 34231 1 359 . 1 1 33 33 LEU HD21 H 1 0.598 0.020 . 2 . . . . A 33 LEU HD21 . 34231 1 360 . 1 1 33 33 LEU HD22 H 1 0.598 0.020 . 2 . . . . A 33 LEU HD22 . 34231 1 361 . 1 1 33 33 LEU HD23 H 1 0.598 0.020 . 2 . . . . A 33 LEU HD23 . 34231 1 362 . 1 1 33 33 LEU CA C 13 54.340 0.400 . 1 . . . . A 33 LEU CA . 34231 1 363 . 1 1 33 33 LEU CB C 13 40.815 0.400 . 1 . . . . A 33 LEU CB . 34231 1 364 . 1 1 33 33 LEU N N 15 128.845 0.400 . 1 . . . . A 33 LEU N . 34231 1 365 . 1 1 34 34 PRO HA H 1 4.298 0.020 . 1 . . . . A 34 PRO HA . 34231 1 366 . 1 1 34 34 PRO HB2 H 1 2.381 0.020 . 2 . . . . A 34 PRO HB2 . 34231 1 367 . 1 1 34 34 PRO HB3 H 1 1.987 0.020 . 2 . . . . A 34 PRO HB3 . 34231 1 368 . 1 1 34 34 PRO HG2 H 1 2.180 0.020 . 2 . . . . A 34 PRO HG2 . 34231 1 369 . 1 1 34 34 PRO HG3 H 1 2.180 0.020 . 2 . . . . A 34 PRO HG3 . 34231 1 370 . 1 1 34 34 PRO HD2 H 1 3.768 0.020 . 2 . . . . A 34 PRO HD2 . 34231 1 371 . 1 1 34 34 PRO HD3 H 1 3.768 0.020 . 2 . . . . A 34 PRO HD3 . 34231 1 372 . 1 1 34 34 PRO C C 13 178.284 0.400 . 1 . . . . A 34 PRO C . 34231 1 373 . 1 1 34 34 PRO CA C 13 65.427 0.400 . 1 . . . . A 34 PRO CA . 34231 1 374 . 1 1 34 34 PRO CB C 13 31.977 0.400 . 1 . . . . A 34 PRO CB . 34231 1 375 . 1 1 34 34 PRO CG C 13 27.768 0.400 . 1 . . . . A 34 PRO CG . 34231 1 376 . 1 1 34 34 PRO CD C 13 51.029 0.400 . 1 . . . . A 34 PRO CD . 34231 1 377 . 1 1 35 35 SER H H 1 8.335 0.020 . 1 . . . . A 35 SER H . 34231 1 378 . 1 1 35 35 SER HA H 1 4.223 0.020 . 1 . . . . A 35 SER HA . 34231 1 379 . 1 1 35 35 SER HB2 H 1 4.079 0.020 . 2 . . . . A 35 SER HB2 . 34231 1 380 . 1 1 35 35 SER HB3 H 1 3.981 0.020 . 2 . . . . A 35 SER HB3 . 34231 1 381 . 1 1 35 35 SER C C 13 174.212 0.400 . 1 . . . . A 35 SER C . 34231 1 382 . 1 1 35 35 SER CA C 13 60.445 0.400 . 1 . . . . A 35 SER CA . 34231 1 383 . 1 1 35 35 SER CB C 13 63.022 0.400 . 1 . . . . A 35 SER CB . 34231 1 384 . 1 1 35 35 SER N N 15 111.830 0.400 . 1 . . . . A 35 SER N . 34231 1 385 . 1 1 36 36 CYS H H 1 7.500 0.020 . 1 . . . . A 36 CYS H . 34231 1 386 . 1 1 36 36 CYS HA H 1 4.207 0.020 . 1 . . . . A 36 CYS HA . 34231 1 387 . 1 1 36 36 CYS HB2 H 1 3.190 0.020 . 2 . . . . A 36 CYS HB2 . 34231 1 388 . 1 1 36 36 CYS HB3 H 1 2.760 0.020 . 2 . . . . A 36 CYS HB3 . 34231 1 389 . 1 1 36 36 CYS C C 13 176.612 0.400 . 1 . . . . A 36 CYS C . 34231 1 390 . 1 1 36 36 CYS CA C 13 64.050 0.400 . 1 . . . . A 36 CYS CA . 34231 1 391 . 1 1 36 36 CYS CB C 13 29.702 0.400 . 1 . . . . A 36 CYS CB . 34231 1 392 . 1 1 36 36 CYS N N 15 125.550 0.400 . 1 . . . . A 36 CYS N . 34231 1 393 . 1 1 37 37 GLN H H 1 8.197 0.020 . 1 . . . . A 37 GLN H . 34231 1 394 . 1 1 37 37 GLN HA H 1 3.962 0.020 . 1 . . . . A 37 GLN HA . 34231 1 395 . 1 1 37 37 GLN HB2 H 1 2.160 0.020 . 2 . . . . A 37 GLN HB2 . 34231 1 396 . 1 1 37 37 GLN HB3 H 1 2.105 0.020 . 2 . . . . A 37 GLN HB3 . 34231 1 397 . 1 1 37 37 GLN HG2 H 1 2.528 0.020 . 2 . . . . A 37 GLN HG2 . 34231 1 398 . 1 1 37 37 GLN HG3 H 1 2.459 0.020 . 2 . . . . A 37 GLN HG3 . 34231 1 399 . 1 1 37 37 GLN C C 13 179.370 0.400 . 1 . . . . A 37 GLN C . 34231 1 400 . 1 1 37 37 GLN CA C 13 59.931 0.400 . 1 . . . . A 37 GLN CA . 34231 1 401 . 1 1 37 37 GLN CB C 13 28.205 0.400 . 1 . . . . A 37 GLN CB . 34231 1 402 . 1 1 37 37 GLN CG C 13 34.166 0.400 . 1 . . . . A 37 GLN CG . 34231 1 403 . 1 1 37 37 GLN N N 15 115.839 0.400 . 1 . . . . A 37 GLN N . 34231 1 404 . 1 1 38 38 LYS H H 1 7.833 0.020 . 1 . . . . A 38 LYS H . 34231 1 405 . 1 1 38 38 LYS HA H 1 4.019 0.020 . 1 . . . . A 38 LYS HA . 34231 1 406 . 1 1 38 38 LYS HB2 H 1 1.631 0.020 . 2 . . . . A 38 LYS HB2 . 34231 1 407 . 1 1 38 38 LYS HB3 H 1 1.631 0.020 . 2 . . . . A 38 LYS HB3 . 34231 1 408 . 1 1 38 38 LYS HG2 H 1 1.451 0.020 . 2 . . . . A 38 LYS HG2 . 34231 1 409 . 1 1 38 38 LYS HG3 H 1 1.451 0.020 . 2 . . . . A 38 LYS HG3 . 34231 1 410 . 1 1 38 38 LYS HD2 H 1 1.271 0.020 . 2 . . . . A 38 LYS HD2 . 34231 1 411 . 1 1 38 38 LYS HD3 H 1 1.271 0.020 . 2 . . . . A 38 LYS HD3 . 34231 1 412 . 1 1 38 38 LYS HE2 H 1 2.781 0.020 . 2 . . . . A 38 LYS HE2 . 34231 1 413 . 1 1 38 38 LYS HE3 H 1 2.781 0.020 . 2 . . . . A 38 LYS HE3 . 34231 1 414 . 1 1 38 38 LYS C C 13 179.034 0.400 . 1 . . . . A 38 LYS C . 34231 1 415 . 1 1 38 38 LYS CA C 13 59.568 0.400 . 1 . . . . A 38 LYS CA . 34231 1 416 . 1 1 38 38 LYS CB C 13 32.662 0.400 . 1 . . . . A 38 LYS CB . 34231 1 417 . 1 1 38 38 LYS CG C 13 25.427 0.400 . 1 . . . . A 38 LYS CG . 34231 1 418 . 1 1 38 38 LYS CD C 13 29.415 0.400 . 1 . . . . A 38 LYS CD . 34231 1 419 . 1 1 38 38 LYS CE C 13 42.077 0.400 . 1 . . . . A 38 LYS CE . 34231 1 420 . 1 1 38 38 LYS N N 15 116.942 0.400 . 1 . . . . A 38 LYS N . 34231 1 421 . 1 1 39 39 MET H H 1 8.308 0.020 . 1 . . . . A 39 MET H . 34231 1 422 . 1 1 39 39 MET HA H 1 4.558 0.020 . 1 . . . . A 39 MET HA . 34231 1 423 . 1 1 39 39 MET HB2 H 1 2.341 0.020 . 2 . . . . A 39 MET HB2 . 34231 1 424 . 1 1 39 39 MET HB3 H 1 1.897 0.020 . 2 . . . . A 39 MET HB3 . 34231 1 425 . 1 1 39 39 MET HG2 H 1 2.713 0.020 . 2 . . . . A 39 MET HG2 . 34231 1 426 . 1 1 39 39 MET HG3 H 1 2.566 0.020 . 2 . . . . A 39 MET HG3 . 34231 1 427 . 1 1 39 39 MET C C 13 179.387 0.400 . 1 . . . . A 39 MET C . 34231 1 428 . 1 1 39 39 MET CA C 13 56.813 0.400 . 1 . . . . A 39 MET CA . 34231 1 429 . 1 1 39 39 MET CB C 13 31.971 0.400 . 1 . . . . A 39 MET CB . 34231 1 430 . 1 1 39 39 MET CG C 13 33.522 0.400 . 1 . . . . A 39 MET CG . 34231 1 431 . 1 1 39 39 MET N N 15 117.978 0.400 . 1 . . . . A 39 MET N . 34231 1 432 . 1 1 40 40 LYS H H 1 9.519 0.020 . 1 . . . . A 40 LYS H . 34231 1 433 . 1 1 40 40 LYS HA H 1 3.807 0.020 . 1 . . . . A 40 LYS HA . 34231 1 434 . 1 1 40 40 LYS HB2 H 1 2.127 0.020 . 2 . . . . A 40 LYS HB2 . 34231 1 435 . 1 1 40 40 LYS HB3 H 1 1.971 0.020 . 2 . . . . A 40 LYS HB3 . 34231 1 436 . 1 1 40 40 LYS HG2 H 1 1.391 0.020 . 2 . . . . A 40 LYS HG2 . 34231 1 437 . 1 1 40 40 LYS HG3 H 1 1.391 0.020 . 2 . . . . A 40 LYS HG3 . 34231 1 438 . 1 1 40 40 LYS HD2 H 1 1.842 0.020 . 2 . . . . A 40 LYS HD2 . 34231 1 439 . 1 1 40 40 LYS HD3 H 1 1.669 0.020 . 2 . . . . A 40 LYS HD3 . 34231 1 440 . 1 1 40 40 LYS HE2 H 1 3.256 0.020 . 2 . . . . A 40 LYS HE2 . 34231 1 441 . 1 1 40 40 LYS HE3 H 1 3.120 0.020 . 2 . . . . A 40 LYS HE3 . 34231 1 442 . 1 1 40 40 LYS C C 13 179.660 0.400 . 1 . . . . A 40 LYS C . 34231 1 443 . 1 1 40 40 LYS CA C 13 61.460 0.400 . 1 . . . . A 40 LYS CA . 34231 1 444 . 1 1 40 40 LYS CB C 13 32.743 0.400 . 1 . . . . A 40 LYS CB . 34231 1 445 . 1 1 40 40 LYS CG C 13 27.434 0.400 . 1 . . . . A 40 LYS CG . 34231 1 446 . 1 1 40 40 LYS CD C 13 30.165 0.400 . 1 . . . . A 40 LYS CD . 34231 1 447 . 1 1 40 40 LYS CE C 13 42.911 0.400 . 1 . . . . A 40 LYS CE . 34231 1 448 . 1 1 40 40 LYS N N 15 121.989 0.400 . 1 . . . . A 40 LYS N . 34231 1 449 . 1 1 41 41 ARG H H 1 7.541 0.020 . 1 . . . . A 41 ARG H . 34231 1 450 . 1 1 41 41 ARG HA H 1 4.183 0.020 . 1 . . . . A 41 ARG HA . 34231 1 451 . 1 1 41 41 ARG HB2 H 1 2.154 0.020 . 2 . . . . A 41 ARG HB2 . 34231 1 452 . 1 1 41 41 ARG HB3 H 1 2.001 0.020 . 2 . . . . A 41 ARG HB3 . 34231 1 453 . 1 1 41 41 ARG HG2 H 1 1.776 0.020 . 2 . . . . A 41 ARG HG2 . 34231 1 454 . 1 1 41 41 ARG HG3 H 1 1.776 0.020 . 2 . . . . A 41 ARG HG3 . 34231 1 455 . 1 1 41 41 ARG HD2 H 1 3.279 0.020 . 2 . . . . A 41 ARG HD2 . 34231 1 456 . 1 1 41 41 ARG HD3 H 1 3.279 0.020 . 2 . . . . A 41 ARG HD3 . 34231 1 457 . 1 1 41 41 ARG C C 13 179.762 0.400 . 1 . . . . A 41 ARG C . 34231 1 458 . 1 1 41 41 ARG CA C 13 59.488 0.400 . 1 . . . . A 41 ARG CA . 34231 1 459 . 1 1 41 41 ARG CB C 13 30.016 0.400 . 1 . . . . A 41 ARG CB . 34231 1 460 . 1 1 41 41 ARG CG C 13 27.787 0.400 . 1 . . . . A 41 ARG CG . 34231 1 461 . 1 1 41 41 ARG CD C 13 43.713 0.400 . 1 . . . . A 41 ARG CD . 34231 1 462 . 1 1 41 41 ARG N N 15 117.775 0.400 . 1 . . . . A 41 ARG N . 34231 1 463 . 1 1 42 42 VAL H H 1 7.592 0.020 . 1 . . . . A 42 VAL H . 34231 1 464 . 1 1 42 42 VAL HA H 1 3.725 0.020 . 1 . . . . A 42 VAL HA . 34231 1 465 . 1 1 42 42 VAL HB H 1 2.490 0.020 . 1 . . . . A 42 VAL HB . 34231 1 466 . 1 1 42 42 VAL HG11 H 1 1.125 0.020 . 2 . . . . A 42 VAL HG11 . 34231 1 467 . 1 1 42 42 VAL HG12 H 1 1.125 0.020 . 2 . . . . A 42 VAL HG12 . 34231 1 468 . 1 1 42 42 VAL HG13 H 1 1.125 0.020 . 2 . . . . A 42 VAL HG13 . 34231 1 469 . 1 1 42 42 VAL HG21 H 1 0.964 0.020 . 2 . . . . A 42 VAL HG21 . 34231 1 470 . 1 1 42 42 VAL HG22 H 1 0.964 0.020 . 2 . . . . A 42 VAL HG22 . 34231 1 471 . 1 1 42 42 VAL HG23 H 1 0.964 0.020 . 2 . . . . A 42 VAL HG23 . 34231 1 472 . 1 1 42 42 VAL C C 13 177.521 0.400 . 1 . . . . A 42 VAL C . 34231 1 473 . 1 1 42 42 VAL CA C 13 66.649 0.400 . 1 . . . . A 42 VAL CA . 34231 1 474 . 1 1 42 42 VAL CB C 13 31.514 0.400 . 1 . . . . A 42 VAL CB . 34231 1 475 . 1 1 42 42 VAL CG1 C 13 22.981 0.400 . 2 . . . . A 42 VAL CG1 . 34231 1 476 . 1 1 42 42 VAL N N 15 121.191 0.400 . 1 . . . . A 42 VAL N . 34231 1 477 . 1 1 43 43 VAL H H 1 8.396 0.020 . 1 . . . . A 43 VAL H . 34231 1 478 . 1 1 43 43 VAL HA H 1 3.493 0.020 . 1 . . . . A 43 VAL HA . 34231 1 479 . 1 1 43 43 VAL HB H 1 2.223 0.020 . 1 . . . . A 43 VAL HB . 34231 1 480 . 1 1 43 43 VAL HG11 H 1 0.948 0.020 . 2 . . . . A 43 VAL HG11 . 34231 1 481 . 1 1 43 43 VAL HG12 H 1 0.948 0.020 . 2 . . . . A 43 VAL HG12 . 34231 1 482 . 1 1 43 43 VAL HG13 H 1 0.948 0.020 . 2 . . . . A 43 VAL HG13 . 34231 1 483 . 1 1 43 43 VAL HG21 H 1 0.858 0.020 . 2 . . . . A 43 VAL HG21 . 34231 1 484 . 1 1 43 43 VAL HG22 H 1 0.858 0.020 . 2 . . . . A 43 VAL HG22 . 34231 1 485 . 1 1 43 43 VAL HG23 H 1 0.858 0.020 . 2 . . . . A 43 VAL HG23 . 34231 1 486 . 1 1 43 43 VAL C C 13 179.025 0.400 . 1 . . . . A 43 VAL C . 34231 1 487 . 1 1 43 43 VAL CA C 13 67.389 0.400 . 1 . . . . A 43 VAL CA . 34231 1 488 . 1 1 43 43 VAL CB C 13 31.520 0.400 . 1 . . . . A 43 VAL CB . 34231 1 489 . 1 1 43 43 VAL CG1 C 13 23.151 0.400 . 2 . . . . A 43 VAL CG1 . 34231 1 490 . 1 1 43 43 VAL CG2 C 13 21.522 0.400 . 2 . . . . A 43 VAL CG2 . 34231 1 491 . 1 1 43 43 VAL N N 15 120.436 0.400 . 1 . . . . A 43 VAL N . 34231 1 492 . 1 1 44 44 GLN H H 1 8.459 0.020 . 1 . . . . A 44 GLN H . 34231 1 493 . 1 1 44 44 GLN HA H 1 3.968 0.020 . 1 . . . . A 44 GLN HA . 34231 1 494 . 1 1 44 44 GLN HB2 H 1 2.154 0.020 . 2 . . . . A 44 GLN HB2 . 34231 1 495 . 1 1 44 44 GLN HB3 H 1 2.154 0.020 . 2 . . . . A 44 GLN HB3 . 34231 1 496 . 1 1 44 44 GLN HG2 H 1 2.504 0.020 . 2 . . . . A 44 GLN HG2 . 34231 1 497 . 1 1 44 44 GLN HG3 H 1 2.504 0.020 . 2 . . . . A 44 GLN HG3 . 34231 1 498 . 1 1 44 44 GLN C C 13 178.896 0.400 . 1 . . . . A 44 GLN C . 34231 1 499 . 1 1 44 44 GLN CA C 13 58.955 0.400 . 1 . . . . A 44 GLN CA . 34231 1 500 . 1 1 44 44 GLN CB C 13 28.122 0.400 . 1 . . . . A 44 GLN CB . 34231 1 501 . 1 1 44 44 GLN CG C 13 33.811 0.400 . 1 . . . . A 44 GLN CG . 34231 1 502 . 1 1 44 44 GLN N N 15 119.210 0.400 . 1 . . . . A 44 GLN N . 34231 1 503 . 1 1 45 45 HIS H H 1 8.079 0.020 . 1 . . . . A 45 HIS H . 34231 1 504 . 1 1 45 45 HIS HA H 1 4.269 0.020 . 1 . . . . A 45 HIS HA . 34231 1 505 . 1 1 45 45 HIS HB2 H 1 3.876 0.020 . 2 . . . . A 45 HIS HB2 . 34231 1 506 . 1 1 45 45 HIS HB3 H 1 3.356 0.020 . 2 . . . . A 45 HIS HB3 . 34231 1 507 . 1 1 45 45 HIS HD2 H 1 6.905 0.020 . 1 . . . . A 45 HIS HD2 . 34231 1 508 . 1 1 45 45 HIS HE1 H 1 8.093 0.020 . 1 . . . . A 45 HIS HE1 . 34231 1 509 . 1 1 45 45 HIS C C 13 177.855 0.400 . 1 . . . . A 45 HIS C . 34231 1 510 . 1 1 45 45 HIS CA C 13 59.947 0.400 . 1 . . . . A 45 HIS CA . 34231 1 511 . 1 1 45 45 HIS CB C 13 27.256 0.400 . 1 . . . . A 45 HIS CB . 34231 1 512 . 1 1 45 45 HIS CD2 C 13 128.834 0.400 . 1 . . . . A 45 HIS CD2 . 34231 1 513 . 1 1 45 45 HIS CE1 C 13 140.154 0.400 . 1 . . . . A 45 HIS CE1 . 34231 1 514 . 1 1 45 45 HIS N N 15 118.854 0.400 . 1 . . . . A 45 HIS N . 34231 1 515 . 1 1 45 45 HIS ND1 N 15 173.161 0.400 . 1 . . . . A 45 HIS ND1 . 34231 1 516 . 1 1 45 45 HIS NE2 N 15 220.450 0.400 . 1 . . . . A 45 HIS NE2 . 34231 1 517 . 1 1 46 46 THR H H 1 7.798 0.020 . 1 . . . . A 46 THR H . 34231 1 518 . 1 1 46 46 THR HA H 1 3.828 0.020 . 1 . . . . A 46 THR HA . 34231 1 519 . 1 1 46 46 THR HB H 1 4.185 0.020 . 1 . . . . A 46 THR HB . 34231 1 520 . 1 1 46 46 THR HG21 H 1 1.648 0.020 . 1 . . . . A 46 THR HG21 . 34231 1 521 . 1 1 46 46 THR HG22 H 1 1.648 0.020 . 1 . . . . A 46 THR HG22 . 34231 1 522 . 1 1 46 46 THR HG23 H 1 1.648 0.020 . 1 . . . . A 46 THR HG23 . 34231 1 523 . 1 1 46 46 THR C C 13 175.849 0.400 . 1 . . . . A 46 THR C . 34231 1 524 . 1 1 46 46 THR CA C 13 65.670 0.400 . 1 . . . . A 46 THR CA . 34231 1 525 . 1 1 46 46 THR CB C 13 69.552 0.400 . 1 . . . . A 46 THR CB . 34231 1 526 . 1 1 46 46 THR CG2 C 13 22.306 0.400 . 1 . . . . A 46 THR CG2 . 34231 1 527 . 1 1 46 46 THR N N 15 109.889 0.400 . 1 . . . . A 46 THR N . 34231 1 528 . 1 1 47 47 LYS H H 1 7.320 0.020 . 1 . . . . A 47 LYS H . 34231 1 529 . 1 1 47 47 LYS HA H 1 4.067 0.020 . 1 . . . . A 47 LYS HA . 34231 1 530 . 1 1 47 47 LYS HB2 H 1 1.866 0.020 . 2 . . . . A 47 LYS HB2 . 34231 1 531 . 1 1 47 47 LYS HB3 H 1 1.866 0.020 . 2 . . . . A 47 LYS HB3 . 34231 1 532 . 1 1 47 47 LYS HG2 H 1 1.423 0.020 . 2 . . . . A 47 LYS HG2 . 34231 1 533 . 1 1 47 47 LYS HG3 H 1 1.423 0.020 . 2 . . . . A 47 LYS HG3 . 34231 1 534 . 1 1 47 47 LYS HD2 H 1 1.624 0.020 . 2 . . . . A 47 LYS HD2 . 34231 1 535 . 1 1 47 47 LYS HD3 H 1 1.570 0.020 . 2 . . . . A 47 LYS HD3 . 34231 1 536 . 1 1 47 47 LYS HE2 H 1 2.883 0.020 . 2 . . . . A 47 LYS HE2 . 34231 1 537 . 1 1 47 47 LYS HE3 H 1 2.883 0.020 . 2 . . . . A 47 LYS HE3 . 34231 1 538 . 1 1 47 47 LYS C C 13 177.801 0.400 . 1 . . . . A 47 LYS C . 34231 1 539 . 1 1 47 47 LYS CA C 13 58.656 0.400 . 1 . . . . A 47 LYS CA . 34231 1 540 . 1 1 47 47 LYS CB C 13 32.131 0.400 . 1 . . . . A 47 LYS CB . 34231 1 541 . 1 1 47 47 LYS CG C 13 25.370 0.400 . 1 . . . . A 47 LYS CG . 34231 1 542 . 1 1 47 47 LYS CD C 13 29.167 0.400 . 1 . . . . A 47 LYS CD . 34231 1 543 . 1 1 47 47 LYS CE C 13 42.236 0.400 . 1 . . . . A 47 LYS CE . 34231 1 544 . 1 1 47 47 LYS N N 15 120.281 0.400 . 1 . . . . A 47 LYS N . 34231 1 545 . 1 1 48 48 GLY H H 1 7.152 0.020 . 1 . . . . A 48 GLY H . 34231 1 546 . 1 1 48 48 GLY HA2 H 1 4.368 0.020 . 2 . . . . A 48 GLY HA2 . 34231 1 547 . 1 1 48 48 GLY HA3 H 1 3.634 0.020 . 2 . . . . A 48 GLY HA3 . 34231 1 548 . 1 1 48 48 GLY C C 13 173.798 0.400 . 1 . . . . A 48 GLY C . 34231 1 549 . 1 1 48 48 GLY CA C 13 44.723 0.400 . 1 . . . . A 48 GLY CA . 34231 1 550 . 1 1 48 48 GLY N N 15 103.951 0.400 . 1 . . . . A 48 GLY N . 34231 1 551 . 1 1 49 49 CYS H H 1 6.921 0.020 . 1 . . . . A 49 CYS H . 34231 1 552 . 1 1 49 49 CYS HA H 1 3.968 0.020 . 1 . . . . A 49 CYS HA . 34231 1 553 . 1 1 49 49 CYS HB2 H 1 2.694 0.020 . 2 . . . . A 49 CYS HB2 . 34231 1 554 . 1 1 49 49 CYS HB3 H 1 2.047 0.020 . 2 . . . . A 49 CYS HB3 . 34231 1 555 . 1 1 49 49 CYS C C 13 176.789 0.400 . 1 . . . . A 49 CYS C . 34231 1 556 . 1 1 49 49 CYS CA C 13 61.186 0.400 . 1 . . . . A 49 CYS CA . 34231 1 557 . 1 1 49 49 CYS CB C 13 29.761 0.400 . 1 . . . . A 49 CYS CB . 34231 1 558 . 1 1 49 49 CYS N N 15 123.218 0.400 . 1 . . . . A 49 CYS N . 34231 1 559 . 1 1 50 50 LYS H H 1 8.985 0.020 . 1 . . . . A 50 LYS H . 34231 1 560 . 1 1 50 50 LYS HA H 1 4.504 0.020 . 1 . . . . A 50 LYS HA . 34231 1 561 . 1 1 50 50 LYS HB2 H 1 2.061 0.020 . 2 . . . . A 50 LYS HB2 . 34231 1 562 . 1 1 50 50 LYS HB3 H 1 1.838 0.020 . 2 . . . . A 50 LYS HB3 . 34231 1 563 . 1 1 50 50 LYS HG2 H 1 1.571 0.020 . 2 . . . . A 50 LYS HG2 . 34231 1 564 . 1 1 50 50 LYS HG3 H 1 1.540 0.020 . 2 . . . . A 50 LYS HG3 . 34231 1 565 . 1 1 50 50 LYS HD2 H 1 1.724 0.020 . 2 . . . . A 50 LYS HD2 . 34231 1 566 . 1 1 50 50 LYS HD3 H 1 1.616 0.020 . 2 . . . . A 50 LYS HD3 . 34231 1 567 . 1 1 50 50 LYS HE2 H 1 3.057 0.020 . 2 . . . . A 50 LYS HE2 . 34231 1 568 . 1 1 50 50 LYS HE3 H 1 3.057 0.020 . 2 . . . . A 50 LYS HE3 . 34231 1 569 . 1 1 50 50 LYS C C 13 177.585 0.400 . 1 . . . . A 50 LYS C . 34231 1 570 . 1 1 50 50 LYS CA C 13 56.662 0.400 . 1 . . . . A 50 LYS CA . 34231 1 571 . 1 1 50 50 LYS CB C 13 32.876 0.400 . 1 . . . . A 50 LYS CB . 34231 1 572 . 1 1 50 50 LYS CG C 13 25.085 0.400 . 1 . . . . A 50 LYS CG . 34231 1 573 . 1 1 50 50 LYS CD C 13 28.886 0.400 . 1 . . . . A 50 LYS CD . 34231 1 574 . 1 1 50 50 LYS CE C 13 42.294 0.400 . 1 . . . . A 50 LYS CE . 34231 1 575 . 1 1 50 50 LYS N N 15 128.198 0.400 . 1 . . . . A 50 LYS N . 34231 1 576 . 1 1 51 51 ARG H H 1 8.500 0.020 . 1 . . . . A 51 ARG H . 34231 1 577 . 1 1 51 51 ARG HA H 1 4.400 0.020 . 1 . . . . A 51 ARG HA . 34231 1 578 . 1 1 51 51 ARG HB2 H 1 1.843 0.020 . 2 . . . . A 51 ARG HB2 . 34231 1 579 . 1 1 51 51 ARG HB3 H 1 1.843 0.020 . 2 . . . . A 51 ARG HB3 . 34231 1 580 . 1 1 51 51 ARG HG2 H 1 1.706 0.020 . 2 . . . . A 51 ARG HG2 . 34231 1 581 . 1 1 51 51 ARG HG3 H 1 1.706 0.020 . 2 . . . . A 51 ARG HG3 . 34231 1 582 . 1 1 51 51 ARG HD2 H 1 3.285 0.020 . 2 . . . . A 51 ARG HD2 . 34231 1 583 . 1 1 51 51 ARG HD3 H 1 3.285 0.020 . 2 . . . . A 51 ARG HD3 . 34231 1 584 . 1 1 51 51 ARG C C 13 176.884 0.400 . 1 . . . . A 51 ARG C . 34231 1 585 . 1 1 51 51 ARG CA C 13 57.639 0.400 . 1 . . . . A 51 ARG CA . 34231 1 586 . 1 1 51 51 ARG CB C 13 31.638 0.400 . 1 . . . . A 51 ARG CB . 34231 1 587 . 1 1 51 51 ARG CG C 13 27.736 0.400 . 1 . . . . A 51 ARG CG . 34231 1 588 . 1 1 51 51 ARG CD C 13 43.746 0.400 . 1 . . . . A 51 ARG CD . 34231 1 589 . 1 1 51 51 ARG N N 15 122.262 0.400 . 1 . . . . A 51 ARG N . 34231 1 590 . 1 1 52 52 LYS H H 1 8.436 0.020 . 1 . . . . A 52 LYS H . 34231 1 591 . 1 1 52 52 LYS HA H 1 4.496 0.020 . 1 . . . . A 52 LYS HA . 34231 1 592 . 1 1 52 52 LYS HB2 H 1 2.297 0.020 . 2 . . . . A 52 LYS HB2 . 34231 1 593 . 1 1 52 52 LYS HB3 H 1 2.053 0.020 . 2 . . . . A 52 LYS HB3 . 34231 1 594 . 1 1 52 52 LYS HG2 H 1 1.378 0.020 . 2 . . . . A 52 LYS HG2 . 34231 1 595 . 1 1 52 52 LYS HG3 H 1 1.378 0.020 . 2 . . . . A 52 LYS HG3 . 34231 1 596 . 1 1 52 52 LYS HD2 H 1 1.775 0.020 . 2 . . . . A 52 LYS HD2 . 34231 1 597 . 1 1 52 52 LYS HD3 H 1 1.610 0.020 . 2 . . . . A 52 LYS HD3 . 34231 1 598 . 1 1 52 52 LYS HE2 H 1 3.154 0.020 . 2 . . . . A 52 LYS HE2 . 34231 1 599 . 1 1 52 52 LYS HE3 H 1 3.154 0.020 . 2 . . . . A 52 LYS HE3 . 34231 1 600 . 1 1 52 52 LYS C C 13 177.238 0.400 . 1 . . . . A 52 LYS C . 34231 1 601 . 1 1 52 52 LYS CA C 13 57.811 0.400 . 1 . . . . A 52 LYS CA . 34231 1 602 . 1 1 52 52 LYS CB C 13 32.249 0.400 . 1 . . . . A 52 LYS CB . 34231 1 603 . 1 1 52 52 LYS CG C 13 24.873 0.400 . 1 . . . . A 52 LYS CG . 34231 1 604 . 1 1 52 52 LYS CD C 13 29.749 0.400 . 1 . . . . A 52 LYS CD . 34231 1 605 . 1 1 52 52 LYS CE C 13 42.714 0.400 . 1 . . . . A 52 LYS CE . 34231 1 606 . 1 1 52 52 LYS N N 15 118.845 0.400 . 1 . . . . A 52 LYS N . 34231 1 607 . 1 1 53 53 THR H H 1 7.742 0.020 . 1 . . . . A 53 THR H . 34231 1 608 . 1 1 53 53 THR HA H 1 4.130 0.020 . 1 . . . . A 53 THR HA . 34231 1 609 . 1 1 53 53 THR HB H 1 4.221 0.020 . 1 . . . . A 53 THR HB . 34231 1 610 . 1 1 53 53 THR HG21 H 1 1.181 0.020 . 1 . . . . A 53 THR HG21 . 34231 1 611 . 1 1 53 53 THR HG22 H 1 1.181 0.020 . 1 . . . . A 53 THR HG22 . 34231 1 612 . 1 1 53 53 THR HG23 H 1 1.181 0.020 . 1 . . . . A 53 THR HG23 . 34231 1 613 . 1 1 53 53 THR CA C 13 63.867 0.400 . 1 . . . . A 53 THR CA . 34231 1 614 . 1 1 53 53 THR CB C 13 68.818 0.400 . 1 . . . . A 53 THR CB . 34231 1 615 . 1 1 53 53 THR CG2 C 13 22.195 0.400 . 1 . . . . A 53 THR CG2 . 34231 1 616 . 1 1 53 53 THR N N 15 112.914 0.400 . 1 . . . . A 53 THR N . 34231 1 617 . 1 1 54 54 ASN HA H 1 4.725 0.020 . 1 . . . . A 54 ASN HA . 34231 1 618 . 1 1 54 54 ASN HB2 H 1 2.871 0.020 . 2 . . . . A 54 ASN HB2 . 34231 1 619 . 1 1 54 54 ASN HB3 H 1 2.871 0.020 . 2 . . . . A 54 ASN HB3 . 34231 1 620 . 1 1 54 54 ASN C C 13 175.971 0.400 . 1 . . . . A 54 ASN C . 34231 1 621 . 1 1 54 54 ASN CA C 13 53.767 0.400 . 1 . . . . A 54 ASN CA . 34231 1 622 . 1 1 54 54 ASN CB C 13 38.353 0.400 . 1 . . . . A 54 ASN CB . 34231 1 623 . 1 1 55 55 GLY H H 1 7.959 0.020 . 1 . . . . A 55 GLY H . 34231 1 624 . 1 1 55 55 GLY HA2 H 1 3.976 0.020 . 2 . . . . A 55 GLY HA2 . 34231 1 625 . 1 1 55 55 GLY HA3 H 1 3.976 0.020 . 2 . . . . A 55 GLY HA3 . 34231 1 626 . 1 1 55 55 GLY C C 13 175.183 0.400 . 1 . . . . A 55 GLY C . 34231 1 627 . 1 1 55 55 GLY CA C 13 45.849 0.400 . 1 . . . . A 55 GLY CA . 34231 1 628 . 1 1 55 55 GLY N N 15 107.368 0.400 . 1 . . . . A 55 GLY N . 34231 1 629 . 1 1 56 56 GLY H H 1 7.783 0.020 . 1 . . . . A 56 GLY H . 34231 1 630 . 1 1 56 56 GLY HA2 H 1 3.979 0.020 . 2 . . . . A 56 GLY HA2 . 34231 1 631 . 1 1 56 56 GLY HA3 H 1 3.879 0.020 . 2 . . . . A 56 GLY HA3 . 34231 1 632 . 1 1 56 56 GLY C C 13 173.235 0.400 . 1 . . . . A 56 GLY C . 34231 1 633 . 1 1 56 56 GLY CA C 13 45.549 0.400 . 1 . . . . A 56 GLY CA . 34231 1 634 . 1 1 56 56 GLY N N 15 107.009 0.400 . 1 . . . . A 56 GLY N . 34231 1 635 . 1 1 57 57 CYS H H 1 8.011 0.020 . 1 . . . . A 57 CYS H . 34231 1 636 . 1 1 57 57 CYS HB2 H 1 2.944 0.020 . 2 . . . . A 57 CYS HB2 . 34231 1 637 . 1 1 57 57 CYS HB3 H 1 2.660 0.020 . 2 . . . . A 57 CYS HB3 . 34231 1 638 . 1 1 57 57 CYS CA C 13 55.578 0.400 . 1 . . . . A 57 CYS CA . 34231 1 639 . 1 1 57 57 CYS CB C 13 30.748 0.400 . 1 . . . . A 57 CYS CB . 34231 1 640 . 1 1 57 57 CYS N N 15 122.544 0.400 . 1 . . . . A 57 CYS N . 34231 1 641 . 1 1 58 58 PRO HA H 1 4.263 0.020 . 1 . . . . A 58 PRO HA . 34231 1 642 . 1 1 58 58 PRO HB2 H 1 2.279 0.020 . 2 . . . . A 58 PRO HB2 . 34231 1 643 . 1 1 58 58 PRO HB3 H 1 1.804 0.020 . 2 . . . . A 58 PRO HB3 . 34231 1 644 . 1 1 58 58 PRO HG2 H 1 2.059 0.020 . 2 . . . . A 58 PRO HG2 . 34231 1 645 . 1 1 58 58 PRO HD2 H 1 4.017 0.020 . 2 . . . . A 58 PRO HD2 . 34231 1 646 . 1 1 58 58 PRO HD3 H 1 4.017 0.020 . 2 . . . . A 58 PRO HD3 . 34231 1 647 . 1 1 58 58 PRO C C 13 178.527 0.400 . 1 . . . . A 58 PRO C . 34231 1 648 . 1 1 58 58 PRO CA C 13 65.063 0.400 . 1 . . . . A 58 PRO CA . 34231 1 649 . 1 1 58 58 PRO CB C 13 32.526 0.400 . 1 . . . . A 58 PRO CB . 34231 1 650 . 1 1 58 58 PRO CG C 13 27.381 0.400 . 1 . . . . A 58 PRO CG . 34231 1 651 . 1 1 58 58 PRO CD C 13 51.530 0.400 . 1 . . . . A 58 PRO CD . 34231 1 652 . 1 1 59 59 ILE H H 1 7.802 0.020 . 1 . . . . A 59 ILE H . 34231 1 653 . 1 1 59 59 ILE HA H 1 3.686 0.020 . 1 . . . . A 59 ILE HA . 34231 1 654 . 1 1 59 59 ILE HB H 1 1.521 0.020 . 1 . . . . A 59 ILE HB . 34231 1 655 . 1 1 59 59 ILE HG12 H 1 1.379 0.020 . 2 . . . . A 59 ILE HG12 . 34231 1 656 . 1 1 59 59 ILE HG13 H 1 1.379 0.020 . 2 . . . . A 59 ILE HG13 . 34231 1 657 . 1 1 59 59 ILE HG21 H 1 0.681 0.020 . 1 . . . . A 59 ILE HG21 . 34231 1 658 . 1 1 59 59 ILE HG22 H 1 0.681 0.020 . 1 . . . . A 59 ILE HG22 . 34231 1 659 . 1 1 59 59 ILE HG23 H 1 0.681 0.020 . 1 . . . . A 59 ILE HG23 . 34231 1 660 . 1 1 59 59 ILE HD11 H 1 0.437 0.020 . 1 . . . . A 59 ILE HD11 . 34231 1 661 . 1 1 59 59 ILE HD12 H 1 0.437 0.020 . 1 . . . . A 59 ILE HD12 . 34231 1 662 . 1 1 59 59 ILE HD13 H 1 0.437 0.020 . 1 . . . . A 59 ILE HD13 . 34231 1 663 . 1 1 59 59 ILE C C 13 178.195 0.400 . 1 . . . . A 59 ILE C . 34231 1 664 . 1 1 59 59 ILE CA C 13 64.745 0.400 . 1 . . . . A 59 ILE CA . 34231 1 665 . 1 1 59 59 ILE CB C 13 38.922 0.400 . 1 . . . . A 59 ILE CB . 34231 1 666 . 1 1 59 59 ILE CG1 C 13 28.227 0.400 . 1 . . . . A 59 ILE CG1 . 34231 1 667 . 1 1 59 59 ILE CG2 C 13 18.260 0.400 . 1 . . . . A 59 ILE CG2 . 34231 1 668 . 1 1 59 59 ILE CD1 C 13 12.893 0.400 . 1 . . . . A 59 ILE CD1 . 34231 1 669 . 1 1 59 59 ILE N N 15 120.519 0.400 . 1 . . . . A 59 ILE N . 34231 1 670 . 1 1 60 60 CYS H H 1 8.914 0.020 . 1 . . . . A 60 CYS H . 34231 1 671 . 1 1 60 60 CYS HA H 1 4.081 0.020 . 1 . . . . A 60 CYS HA . 34231 1 672 . 1 1 60 60 CYS HB2 H 1 2.963 0.020 . 2 . . . . A 60 CYS HB2 . 34231 1 673 . 1 1 60 60 CYS HB3 H 1 2.763 0.020 . 2 . . . . A 60 CYS HB3 . 34231 1 674 . 1 1 60 60 CYS C C 13 177.474 0.400 . 1 . . . . A 60 CYS C . 34231 1 675 . 1 1 60 60 CYS CA C 13 66.506 0.400 . 1 . . . . A 60 CYS CA . 34231 1 676 . 1 1 60 60 CYS CB C 13 29.203 0.400 . 1 . . . . A 60 CYS CB . 34231 1 677 . 1 1 60 60 CYS N N 15 123.780 0.400 . 1 . . . . A 60 CYS N . 34231 1 678 . 1 1 61 61 LYS H H 1 7.979 0.020 . 1 . . . . A 61 LYS H . 34231 1 679 . 1 1 61 61 LYS HA H 1 3.832 0.020 . 1 . . . . A 61 LYS HA . 34231 1 680 . 1 1 61 61 LYS HB2 H 1 1.812 0.020 . 2 . . . . A 61 LYS HB2 . 34231 1 681 . 1 1 61 61 LYS HB3 H 1 1.684 0.020 . 2 . . . . A 61 LYS HB3 . 34231 1 682 . 1 1 61 61 LYS HG2 H 1 1.305 0.020 . 2 . . . . A 61 LYS HG2 . 34231 1 683 . 1 1 61 61 LYS HG3 H 1 1.305 0.020 . 2 . . . . A 61 LYS HG3 . 34231 1 684 . 1 1 61 61 LYS HD2 H 1 1.584 0.020 . 2 . . . . A 61 LYS HD2 . 34231 1 685 . 1 1 61 61 LYS HD3 H 1 1.479 0.020 . 2 . . . . A 61 LYS HD3 . 34231 1 686 . 1 1 61 61 LYS HE2 H 1 2.858 0.020 . 2 . . . . A 61 LYS HE2 . 34231 1 687 . 1 1 61 61 LYS HE3 H 1 2.858 0.020 . 2 . . . . A 61 LYS HE3 . 34231 1 688 . 1 1 61 61 LYS C C 13 178.990 0.400 . 1 . . . . A 61 LYS C . 34231 1 689 . 1 1 61 61 LYS CA C 13 60.073 0.400 . 1 . . . . A 61 LYS CA . 34231 1 690 . 1 1 61 61 LYS CB C 13 32.605 0.400 . 1 . . . . A 61 LYS CB . 34231 1 691 . 1 1 61 61 LYS CG C 13 25.474 0.400 . 1 . . . . A 61 LYS CG . 34231 1 692 . 1 1 61 61 LYS CD C 13 29.483 0.400 . 1 . . . . A 61 LYS CD . 34231 1 693 . 1 1 61 61 LYS CE C 13 41.941 0.400 . 1 . . . . A 61 LYS CE . 34231 1 694 . 1 1 61 61 LYS N N 15 116.676 0.400 . 1 . . . . A 61 LYS N . 34231 1 695 . 1 1 62 62 GLN H H 1 7.232 0.020 . 1 . . . . A 62 GLN H . 34231 1 696 . 1 1 62 62 GLN HA H 1 4.124 0.020 . 1 . . . . A 62 GLN HA . 34231 1 697 . 1 1 62 62 GLN HG2 H 1 2.315 0.020 . 2 . . . . A 62 GLN HG2 . 34231 1 698 . 1 1 62 62 GLN HG3 H 1 2.315 0.020 . 2 . . . . A 62 GLN HG3 . 34231 1 699 . 1 1 62 62 GLN C C 13 177.948 0.400 . 1 . . . . A 62 GLN C . 34231 1 700 . 1 1 62 62 GLN CA C 13 58.404 0.400 . 1 . . . . A 62 GLN CA . 34231 1 701 . 1 1 62 62 GLN CB C 13 28.431 0.400 . 1 . . . . A 62 GLN CB . 34231 1 702 . 1 1 62 62 GLN CG C 13 33.849 0.400 . 1 . . . . A 62 GLN CG . 34231 1 703 . 1 1 62 62 GLN N N 15 117.187 0.400 . 1 . . . . A 62 GLN N . 34231 1 704 . 1 1 63 63 LEU H H 1 8.081 0.020 . 1 . . . . A 63 LEU H . 34231 1 705 . 1 1 63 63 LEU HA H 1 4.133 0.020 . 1 . . . . A 63 LEU HA . 34231 1 706 . 1 1 63 63 LEU HB2 H 1 1.902 0.020 . 2 . . . . A 63 LEU HB2 . 34231 1 707 . 1 1 63 63 LEU HB3 H 1 1.923 0.020 . 2 . . . . A 63 LEU HB3 . 34231 1 708 . 1 1 63 63 LEU HD11 H 1 1.005 0.020 . 2 . . . . A 63 LEU HD11 . 34231 1 709 . 1 1 63 63 LEU HD12 H 1 1.005 0.020 . 2 . . . . A 63 LEU HD12 . 34231 1 710 . 1 1 63 63 LEU HD13 H 1 1.005 0.020 . 2 . . . . A 63 LEU HD13 . 34231 1 711 . 1 1 63 63 LEU HD21 H 1 1.005 0.020 . 2 . . . . A 63 LEU HD21 . 34231 1 712 . 1 1 63 63 LEU HD22 H 1 1.005 0.020 . 2 . . . . A 63 LEU HD22 . 34231 1 713 . 1 1 63 63 LEU HD23 H 1 1.005 0.020 . 2 . . . . A 63 LEU HD23 . 34231 1 714 . 1 1 63 63 LEU C C 13 179.129 0.400 . 1 . . . . A 63 LEU C . 34231 1 715 . 1 1 63 63 LEU CA C 13 57.792 0.400 . 1 . . . . A 63 LEU CA . 34231 1 716 . 1 1 63 63 LEU CB C 13 41.747 0.400 . 1 . . . . A 63 LEU CB . 34231 1 717 . 1 1 63 63 LEU CG C 13 27.579 0.400 . 1 . . . . A 63 LEU CG . 34231 1 718 . 1 1 63 63 LEU CD1 C 13 25.097 0.400 . 2 . . . . A 63 LEU CD1 . 34231 1 719 . 1 1 63 63 LEU N N 15 119.816 0.400 . 1 . . . . A 63 LEU N . 34231 1 720 . 1 1 64 64 ILE H H 1 8.434 0.020 . 1 . . . . A 64 ILE H . 34231 1 721 . 1 1 64 64 ILE HA H 1 3.509 0.020 . 1 . . . . A 64 ILE HA . 34231 1 722 . 1 1 64 64 ILE HB H 1 1.405 0.020 . 1 . . . . A 64 ILE HB . 34231 1 723 . 1 1 64 64 ILE HG12 H 1 0.256 0.020 . 2 . . . . A 64 ILE HG12 . 34231 1 724 . 1 1 64 64 ILE HG13 H 1 1.042 0.020 . 2 . . . . A 64 ILE HG13 . 34231 1 725 . 1 1 64 64 ILE HG21 H 1 0.738 0.020 . 1 . . . . A 64 ILE HG21 . 34231 1 726 . 1 1 64 64 ILE HG22 H 1 0.738 0.020 . 1 . . . . A 64 ILE HG22 . 34231 1 727 . 1 1 64 64 ILE HG23 H 1 0.738 0.020 . 1 . . . . A 64 ILE HG23 . 34231 1 728 . 1 1 64 64 ILE HD11 H 1 0.365 0.020 . 1 . . . . A 64 ILE HD11 . 34231 1 729 . 1 1 64 64 ILE HD12 H 1 0.365 0.020 . 1 . . . . A 64 ILE HD12 . 34231 1 730 . 1 1 64 64 ILE HD13 H 1 0.365 0.020 . 1 . . . . A 64 ILE HD13 . 34231 1 731 . 1 1 64 64 ILE C C 13 176.806 0.400 . 1 . . . . A 64 ILE C . 34231 1 732 . 1 1 64 64 ILE CA C 13 65.581 0.400 . 1 . . . . A 64 ILE CA . 34231 1 733 . 1 1 64 64 ILE CB C 13 37.394 0.400 . 1 . . . . A 64 ILE CB . 34231 1 734 . 1 1 64 64 ILE CG1 C 13 29.956 0.400 . 1 . . . . A 64 ILE CG1 . 34231 1 735 . 1 1 64 64 ILE CG2 C 13 17.183 0.400 . 1 . . . . A 64 ILE CG2 . 34231 1 736 . 1 1 64 64 ILE CD1 C 13 13.502 0.400 . 1 . . . . A 64 ILE CD1 . 34231 1 737 . 1 1 64 64 ILE N N 15 120.346 0.400 . 1 . . . . A 64 ILE N . 34231 1 738 . 1 1 65 65 ALA H H 1 7.224 0.020 . 1 . . . . A 65 ALA H . 34231 1 739 . 1 1 65 65 ALA HA H 1 4.095 0.020 . 1 . . . . A 65 ALA HA . 34231 1 740 . 1 1 65 65 ALA HB1 H 1 1.503 0.020 . 1 . . . . A 65 ALA HB1 . 34231 1 741 . 1 1 65 65 ALA HB2 H 1 1.503 0.020 . 1 . . . . A 65 ALA HB2 . 34231 1 742 . 1 1 65 65 ALA HB3 H 1 1.503 0.020 . 1 . . . . A 65 ALA HB3 . 34231 1 743 . 1 1 65 65 ALA C C 13 180.254 0.400 . 1 . . . . A 65 ALA C . 34231 1 744 . 1 1 65 65 ALA CA C 13 55.237 0.400 . 1 . . . . A 65 ALA CA . 34231 1 745 . 1 1 65 65 ALA CB C 13 18.368 0.400 . 1 . . . . A 65 ALA CB . 34231 1 746 . 1 1 65 65 ALA N N 15 122.118 0.400 . 1 . . . . A 65 ALA N . 34231 1 747 . 1 1 66 66 LEU H H 1 7.826 0.020 . 1 . . . . A 66 LEU H . 34231 1 748 . 1 1 66 66 LEU HA H 1 4.095 0.020 . 1 . . . . A 66 LEU HA . 34231 1 749 . 1 1 66 66 LEU HB2 H 1 1.770 0.020 . 2 . . . . A 66 LEU HB2 . 34231 1 750 . 1 1 66 66 LEU HB3 H 1 1.645 0.020 . 2 . . . . A 66 LEU HB3 . 34231 1 751 . 1 1 66 66 LEU HD11 H 1 0.746 0.020 . 2 . . . . A 66 LEU HD11 . 34231 1 752 . 1 1 66 66 LEU HD12 H 1 0.746 0.020 . 2 . . . . A 66 LEU HD12 . 34231 1 753 . 1 1 66 66 LEU HD13 H 1 0.746 0.020 . 2 . . . . A 66 LEU HD13 . 34231 1 754 . 1 1 66 66 LEU HD21 H 1 0.746 0.020 . 2 . . . . A 66 LEU HD21 . 34231 1 755 . 1 1 66 66 LEU HD22 H 1 0.746 0.020 . 2 . . . . A 66 LEU HD22 . 34231 1 756 . 1 1 66 66 LEU HD23 H 1 0.746 0.020 . 2 . . . . A 66 LEU HD23 . 34231 1 757 . 1 1 66 66 LEU C C 13 178.900 0.400 . 1 . . . . A 66 LEU C . 34231 1 758 . 1 1 66 66 LEU CA C 13 57.965 0.400 . 1 . . . . A 66 LEU CA . 34231 1 759 . 1 1 66 66 LEU CB C 13 42.422 0.400 . 1 . . . . A 66 LEU CB . 34231 1 760 . 1 1 66 66 LEU CG C 13 26.864 0.400 . 1 . . . . A 66 LEU CG . 34231 1 761 . 1 1 66 66 LEU CD1 C 13 24.946 0.400 . 2 . . . . A 66 LEU CD1 . 34231 1 762 . 1 1 66 66 LEU N N 15 117.910 0.400 . 1 . . . . A 66 LEU N . 34231 1 763 . 1 1 67 67 ALA H H 1 8.863 0.020 . 1 . . . . A 67 ALA H . 34231 1 764 . 1 1 67 67 ALA HA H 1 3.919 0.020 . 1 . . . . A 67 ALA HA . 34231 1 765 . 1 1 67 67 ALA HB1 H 1 1.675 0.020 . 1 . . . . A 67 ALA HB1 . 34231 1 766 . 1 1 67 67 ALA HB2 H 1 1.675 0.020 . 1 . . . . A 67 ALA HB2 . 34231 1 767 . 1 1 67 67 ALA HB3 H 1 1.675 0.020 . 1 . . . . A 67 ALA HB3 . 34231 1 768 . 1 1 67 67 ALA C C 13 179.445 0.400 . 1 . . . . A 67 ALA C . 34231 1 769 . 1 1 67 67 ALA CA C 13 55.808 0.400 . 1 . . . . A 67 ALA CA . 34231 1 770 . 1 1 67 67 ALA CB C 13 19.076 0.400 . 1 . . . . A 67 ALA CB . 34231 1 771 . 1 1 67 67 ALA N N 15 121.392 0.400 . 1 . . . . A 67 ALA N . 34231 1 772 . 1 1 68 68 ALA H H 1 8.585 0.020 . 1 . . . . A 68 ALA H . 34231 1 773 . 1 1 68 68 ALA HA H 1 4.087 0.020 . 1 . . . . A 68 ALA HA . 34231 1 774 . 1 1 68 68 ALA HB1 H 1 1.497 0.020 . 1 . . . . A 68 ALA HB1 . 34231 1 775 . 1 1 68 68 ALA HB2 H 1 1.497 0.020 . 1 . . . . A 68 ALA HB2 . 34231 1 776 . 1 1 68 68 ALA HB3 H 1 1.497 0.020 . 1 . . . . A 68 ALA HB3 . 34231 1 777 . 1 1 68 68 ALA C C 13 179.685 0.400 . 1 . . . . A 68 ALA C . 34231 1 778 . 1 1 68 68 ALA CA C 13 55.559 0.400 . 1 . . . . A 68 ALA CA . 34231 1 779 . 1 1 68 68 ALA CB C 13 18.049 0.400 . 1 . . . . A 68 ALA CB . 34231 1 780 . 1 1 68 68 ALA N N 15 120.019 0.400 . 1 . . . . A 68 ALA N . 34231 1 781 . 1 1 69 69 TYR H H 1 7.697 0.020 . 1 . . . . A 69 TYR H . 34231 1 782 . 1 1 69 69 TYR HA H 1 4.170 0.020 . 1 . . . . A 69 TYR HA . 34231 1 783 . 1 1 69 69 TYR HB2 H 1 3.237 0.020 . 2 . . . . A 69 TYR HB2 . 34231 1 784 . 1 1 69 69 TYR HB3 H 1 3.157 0.020 . 2 . . . . A 69 TYR HB3 . 34231 1 785 . 1 1 69 69 TYR HD1 H 1 7.167 0.020 . 1 . . . . A 69 TYR HD1 . 34231 1 786 . 1 1 69 69 TYR HD2 H 1 7.167 0.020 . 1 . . . . A 69 TYR HD2 . 34231 1 787 . 1 1 69 69 TYR HE1 H 1 6.839 0.020 . 1 . . . . A 69 TYR HE1 . 34231 1 788 . 1 1 69 69 TYR HE2 H 1 6.839 0.020 . 1 . . . . A 69 TYR HE2 . 34231 1 789 . 1 1 69 69 TYR C C 13 178.620 0.400 . 1 . . . . A 69 TYR C . 34231 1 790 . 1 1 69 69 TYR CA C 13 61.533 0.400 . 1 . . . . A 69 TYR CA . 34231 1 791 . 1 1 69 69 TYR CB C 13 38.566 0.400 . 1 . . . . A 69 TYR CB . 34231 1 792 . 1 1 69 69 TYR CD1 C 13 133.148 0.400 . 3 . . . . A 69 TYR CD1 . 34231 1 793 . 1 1 69 69 TYR CD2 C 13 133.148 0.400 . 3 . . . . A 69 TYR CD2 . 34231 1 794 . 1 1 69 69 TYR CE1 C 13 118.217 0.400 . 3 . . . . A 69 TYR CE1 . 34231 1 795 . 1 1 69 69 TYR CE2 C 13 118.217 0.400 . 3 . . . . A 69 TYR CE2 . 34231 1 796 . 1 1 69 69 TYR N N 15 118.291 0.400 . 1 . . . . A 69 TYR N . 34231 1 797 . 1 1 70 70 HIS H H 1 8.063 0.020 . 1 . . . . A 70 HIS H . 34231 1 798 . 1 1 70 70 HIS HA H 1 4.396 0.020 . 1 . . . . A 70 HIS HA . 34231 1 799 . 1 1 70 70 HIS HB2 H 1 3.548 0.020 . 2 . . . . A 70 HIS HB2 . 34231 1 800 . 1 1 70 70 HIS HB3 H 1 3.224 0.020 . 2 . . . . A 70 HIS HB3 . 34231 1 801 . 1 1 70 70 HIS HD2 H 1 7.183 0.020 . 1 . . . . A 70 HIS HD2 . 34231 1 802 . 1 1 70 70 HIS HE1 H 1 8.044 0.020 . 1 . . . . A 70 HIS HE1 . 34231 1 803 . 1 1 70 70 HIS C C 13 176.785 0.400 . 1 . . . . A 70 HIS C . 34231 1 804 . 1 1 70 70 HIS CA C 13 58.763 0.400 . 1 . . . . A 70 HIS CA . 34231 1 805 . 1 1 70 70 HIS CB C 13 27.849 0.400 . 1 . . . . A 70 HIS CB . 34231 1 806 . 1 1 70 70 HIS CD2 C 13 129.582 0.400 . 1 . . . . A 70 HIS CD2 . 34231 1 807 . 1 1 70 70 HIS CE1 C 13 140.121 0.400 . 1 . . . . A 70 HIS CE1 . 34231 1 808 . 1 1 70 70 HIS N N 15 118.808 0.400 . 1 . . . . A 70 HIS N . 34231 1 809 . 1 1 70 70 HIS ND1 N 15 172.386 0.400 . 1 . . . . A 70 HIS ND1 . 34231 1 810 . 1 1 70 70 HIS NE2 N 15 221.464 0.400 . 1 . . . . A 70 HIS NE2 . 34231 1 811 . 1 1 71 71 ALA H H 1 9.249 0.020 . 1 . . . . A 71 ALA H . 34231 1 812 . 1 1 71 71 ALA HA H 1 3.907 0.020 . 1 . . . . A 71 ALA HA . 34231 1 813 . 1 1 71 71 ALA HB1 H 1 1.581 0.020 . 1 . . . . A 71 ALA HB1 . 34231 1 814 . 1 1 71 71 ALA HB2 H 1 1.581 0.020 . 1 . . . . A 71 ALA HB2 . 34231 1 815 . 1 1 71 71 ALA HB3 H 1 1.581 0.020 . 1 . . . . A 71 ALA HB3 . 34231 1 816 . 1 1 71 71 ALA C C 13 178.867 0.400 . 1 . . . . A 71 ALA C . 34231 1 817 . 1 1 71 71 ALA CA C 13 54.824 0.400 . 1 . . . . A 71 ALA CA . 34231 1 818 . 1 1 71 71 ALA CB C 13 19.787 0.400 . 1 . . . . A 71 ALA CB . 34231 1 819 . 1 1 71 71 ALA N N 15 122.325 0.400 . 1 . . . . A 71 ALA N . 34231 1 820 . 1 1 72 72 LYS H H 1 6.937 0.020 . 1 . . . . A 72 LYS H . 34231 1 821 . 1 1 72 72 LYS HA H 1 3.817 0.020 . 1 . . . . A 72 LYS HA . 34231 1 822 . 1 1 72 72 LYS HB2 H 1 1.420 0.020 . 2 . . . . A 72 LYS HB2 . 34231 1 823 . 1 1 72 72 LYS HB3 H 1 1.420 0.020 . 2 . . . . A 72 LYS HB3 . 34231 1 824 . 1 1 72 72 LYS HG2 H 1 1.255 0.020 . 2 . . . . A 72 LYS HG2 . 34231 1 825 . 1 1 72 72 LYS HG3 H 1 1.151 0.020 . 2 . . . . A 72 LYS HG3 . 34231 1 826 . 1 1 72 72 LYS HD2 H 1 1.558 0.020 . 2 . . . . A 72 LYS HD2 . 34231 1 827 . 1 1 72 72 LYS HD3 H 1 1.558 0.020 . 2 . . . . A 72 LYS HD3 . 34231 1 828 . 1 1 72 72 LYS HE2 H 1 2.870 0.020 . 2 . . . . A 72 LYS HE2 . 34231 1 829 . 1 1 72 72 LYS HE3 H 1 2.870 0.020 . 2 . . . . A 72 LYS HE3 . 34231 1 830 . 1 1 72 72 LYS C C 13 176.562 0.400 . 1 . . . . A 72 LYS C . 34231 1 831 . 1 1 72 72 LYS CA C 13 58.296 0.400 . 1 . . . . A 72 LYS CA . 34231 1 832 . 1 1 72 72 LYS CB C 13 32.514 0.400 . 1 . . . . A 72 LYS CB . 34231 1 833 . 1 1 72 72 LYS CG C 13 24.484 0.400 . 1 . . . . A 72 LYS CG . 34231 1 834 . 1 1 72 72 LYS CD C 13 29.029 0.400 . 1 . . . . A 72 LYS CD . 34231 1 835 . 1 1 72 72 LYS CE C 13 42.097 0.400 . 1 . . . . A 72 LYS CE . 34231 1 836 . 1 1 72 72 LYS N N 15 114.337 0.400 . 1 . . . . A 72 LYS N . 34231 1 837 . 1 1 73 73 HIS H H 1 7.072 0.020 . 1 . . . . A 73 HIS H . 34231 1 838 . 1 1 73 73 HIS HA H 1 4.812 0.020 . 1 . . . . A 73 HIS HA . 34231 1 839 . 1 1 73 73 HIS HB2 H 1 3.410 0.020 . 2 . . . . A 73 HIS HB2 . 34231 1 840 . 1 1 73 73 HIS HB3 H 1 2.904 0.020 . 2 . . . . A 73 HIS HB3 . 34231 1 841 . 1 1 73 73 HIS HD2 H 1 7.089 0.020 . 1 . . . . A 73 HIS HD2 . 34231 1 842 . 1 1 73 73 HIS HE1 H 1 8.033 0.020 . 1 . . . . A 73 HIS HE1 . 34231 1 843 . 1 1 73 73 HIS C C 13 173.605 0.400 . 1 . . . . A 73 HIS C . 34231 1 844 . 1 1 73 73 HIS CA C 13 54.355 0.400 . 1 . . . . A 73 HIS CA . 34231 1 845 . 1 1 73 73 HIS CB C 13 30.327 0.400 . 1 . . . . A 73 HIS CB . 34231 1 846 . 1 1 73 73 HIS CD2 C 13 121.024 0.400 . 1 . . . . A 73 HIS CD2 . 34231 1 847 . 1 1 73 73 HIS CE1 C 13 137.439 0.400 . 1 . . . . A 73 HIS CE1 . 34231 1 848 . 1 1 73 73 HIS N N 15 112.753 0.400 . 1 . . . . A 73 HIS N . 34231 1 849 . 1 1 73 73 HIS ND1 N 15 196.679 0.400 . 1 . . . . A 73 HIS ND1 . 34231 1 850 . 1 1 73 73 HIS NE2 N 15 183.298 0.400 . 1 . . . . A 73 HIS NE2 . 34231 1 851 . 1 1 74 74 CYS H H 1 6.988 0.020 . 1 . . . . A 74 CYS H . 34231 1 852 . 1 1 74 74 CYS HA H 1 4.115 0.020 . 1 . . . . A 74 CYS HA . 34231 1 853 . 1 1 74 74 CYS HB2 H 1 2.453 0.020 . 2 . . . . A 74 CYS HB2 . 34231 1 854 . 1 1 74 74 CYS HB3 H 1 1.755 0.020 . 2 . . . . A 74 CYS HB3 . 34231 1 855 . 1 1 74 74 CYS C C 13 176.135 0.400 . 1 . . . . A 74 CYS C . 34231 1 856 . 1 1 74 74 CYS CA C 13 60.113 0.400 . 1 . . . . A 74 CYS CA . 34231 1 857 . 1 1 74 74 CYS CB C 13 30.116 0.400 . 1 . . . . A 74 CYS CB . 34231 1 858 . 1 1 74 74 CYS N N 15 123.360 0.400 . 1 . . . . A 74 CYS N . 34231 1 859 . 1 1 75 75 GLN H H 1 9.115 0.020 . 1 . . . . A 75 GLN H . 34231 1 860 . 1 1 75 75 GLN HA H 1 4.665 0.020 . 1 . . . . A 75 GLN HA . 34231 1 861 . 1 1 75 75 GLN HB2 H 1 1.837 0.020 . 2 . . . . A 75 GLN HB2 . 34231 1 862 . 1 1 75 75 GLN HB3 H 1 1.837 0.020 . 2 . . . . A 75 GLN HB3 . 34231 1 863 . 1 1 75 75 GLN HG2 H 1 2.324 0.020 . 2 . . . . A 75 GLN HG2 . 34231 1 864 . 1 1 75 75 GLN HG3 H 1 2.324 0.020 . 2 . . . . A 75 GLN HG3 . 34231 1 865 . 1 1 75 75 GLN C C 13 175.548 0.400 . 1 . . . . A 75 GLN C . 34231 1 866 . 1 1 75 75 GLN CA C 13 54.654 0.400 . 1 . . . . A 75 GLN CA . 34231 1 867 . 1 1 75 75 GLN CB C 13 29.362 0.400 . 1 . . . . A 75 GLN CB . 34231 1 868 . 1 1 75 75 GLN CG C 13 33.918 0.400 . 1 . . . . A 75 GLN CG . 34231 1 869 . 1 1 75 75 GLN N N 15 128.642 0.400 . 1 . . . . A 75 GLN N . 34231 1 870 . 1 1 76 76 GLU H H 1 8.219 0.020 . 1 . . . . A 76 GLU H . 34231 1 871 . 1 1 76 76 GLU HA H 1 4.391 0.020 . 1 . . . . A 76 GLU HA . 34231 1 872 . 1 1 76 76 GLU HB2 H 1 2.024 0.020 . 2 . . . . A 76 GLU HB2 . 34231 1 873 . 1 1 76 76 GLU HB3 H 1 1.996 0.020 . 2 . . . . A 76 GLU HB3 . 34231 1 874 . 1 1 76 76 GLU HG2 H 1 2.389 0.020 . 2 . . . . A 76 GLU HG2 . 34231 1 875 . 1 1 76 76 GLU HG3 H 1 2.333 0.020 . 2 . . . . A 76 GLU HG3 . 34231 1 876 . 1 1 76 76 GLU C C 13 176.623 0.400 . 1 . . . . A 76 GLU C . 34231 1 877 . 1 1 76 76 GLU CA C 13 55.826 0.400 . 1 . . . . A 76 GLU CA . 34231 1 878 . 1 1 76 76 GLU CB C 13 30.449 0.400 . 1 . . . . A 76 GLU CB . 34231 1 879 . 1 1 76 76 GLU CG C 13 35.848 0.400 . 1 . . . . A 76 GLU CG . 34231 1 880 . 1 1 76 76 GLU N N 15 122.785 0.400 . 1 . . . . A 76 GLU N . 34231 1 881 . 1 1 77 77 ASN H H 1 8.876 0.020 . 1 . . . . A 77 ASN H . 34231 1 882 . 1 1 77 77 ASN HA H 1 4.502 0.020 . 1 . . . . A 77 ASN HA . 34231 1 883 . 1 1 77 77 ASN HB2 H 1 2.825 0.020 . 2 . . . . A 77 ASN HB2 . 34231 1 884 . 1 1 77 77 ASN HB3 H 1 2.825 0.020 . 2 . . . . A 77 ASN HB3 . 34231 1 885 . 1 1 77 77 ASN C C 13 175.821 0.400 . 1 . . . . A 77 ASN C . 34231 1 886 . 1 1 77 77 ASN CA C 13 55.168 0.400 . 1 . . . . A 77 ASN CA . 34231 1 887 . 1 1 77 77 ASN CB C 13 38.535 0.400 . 1 . . . . A 77 ASN CB . 34231 1 888 . 1 1 77 77 ASN N N 15 125.473 0.400 . 1 . . . . A 77 ASN N . 34231 1 889 . 1 1 78 78 LYS H H 1 8.732 0.020 . 1 . . . . A 78 LYS H . 34231 1 890 . 1 1 78 78 LYS HA H 1 4.423 0.020 . 1 . . . . A 78 LYS HA . 34231 1 891 . 1 1 78 78 LYS HB2 H 1 1.913 0.020 . 2 . . . . A 78 LYS HB2 . 34231 1 892 . 1 1 78 78 LYS HB3 H 1 1.913 0.020 . 2 . . . . A 78 LYS HB3 . 34231 1 893 . 1 1 78 78 LYS HG2 H 1 1.336 0.020 . 2 . . . . A 78 LYS HG2 . 34231 1 894 . 1 1 78 78 LYS HG3 H 1 1.336 0.020 . 2 . . . . A 78 LYS HG3 . 34231 1 895 . 1 1 78 78 LYS HD2 H 1 1.653 0.020 . 2 . . . . A 78 LYS HD2 . 34231 1 896 . 1 1 78 78 LYS HD3 H 1 1.653 0.020 . 2 . . . . A 78 LYS HD3 . 34231 1 897 . 1 1 78 78 LYS HE2 H 1 2.981 0.020 . 2 . . . . A 78 LYS HE2 . 34231 1 898 . 1 1 78 78 LYS HE3 H 1 2.981 0.020 . 2 . . . . A 78 LYS HE3 . 34231 1 899 . 1 1 78 78 LYS C C 13 174.893 0.400 . 1 . . . . A 78 LYS C . 34231 1 900 . 1 1 78 78 LYS CA C 13 54.617 0.400 . 1 . . . . A 78 LYS CA . 34231 1 901 . 1 1 78 78 LYS CB C 13 31.006 0.400 . 1 . . . . A 78 LYS CB . 34231 1 902 . 1 1 78 78 LYS CG C 13 24.740 0.400 . 1 . . . . A 78 LYS CG . 34231 1 903 . 1 1 78 78 LYS CD C 13 29.171 0.400 . 1 . . . . A 78 LYS CD . 34231 1 904 . 1 1 78 78 LYS CE C 13 42.204 0.400 . 1 . . . . A 78 LYS CE . 34231 1 905 . 1 1 78 78 LYS N N 15 120.776 0.400 . 1 . . . . A 78 LYS N . 34231 1 906 . 1 1 79 79 CYS H H 1 6.950 0.020 . 1 . . . . A 79 CYS H . 34231 1 907 . 1 1 79 79 CYS HA H 1 4.303 0.020 . 1 . . . . A 79 CYS HA . 34231 1 908 . 1 1 79 79 CYS HB2 H 1 2.949 0.020 . 2 . . . . A 79 CYS HB2 . 34231 1 909 . 1 1 79 79 CYS HB3 H 1 2.837 0.020 . 2 . . . . A 79 CYS HB3 . 34231 1 910 . 1 1 79 79 CYS CA C 13 57.782 0.400 . 1 . . . . A 79 CYS CA . 34231 1 911 . 1 1 79 79 CYS CB C 13 30.687 0.400 . 1 . . . . A 79 CYS CB . 34231 1 912 . 1 1 79 79 CYS N N 15 123.860 0.400 . 1 . . . . A 79 CYS N . 34231 1 913 . 1 1 80 80 PRO HA H 1 4.678 0.020 . 1 . . . . A 80 PRO HA . 34231 1 914 . 1 1 80 80 PRO HB2 H 1 2.094 0.020 . 2 . . . . A 80 PRO HB2 . 34231 1 915 . 1 1 80 80 PRO HB3 H 1 2.038 0.020 . 2 . . . . A 80 PRO HB3 . 34231 1 916 . 1 1 80 80 PRO HG2 H 1 1.663 0.020 . 2 . . . . A 80 PRO HG2 . 34231 1 917 . 1 1 80 80 PRO HG3 H 1 1.663 0.020 . 2 . . . . A 80 PRO HG3 . 34231 1 918 . 1 1 80 80 PRO HD2 H 1 4.144 0.020 . 2 . . . . A 80 PRO HD2 . 34231 1 919 . 1 1 80 80 PRO HD3 H 1 3.855 0.020 . 2 . . . . A 80 PRO HD3 . 34231 1 920 . 1 1 80 80 PRO C C 13 176.818 0.400 . 1 . . . . A 80 PRO C . 34231 1 921 . 1 1 80 80 PRO CA C 13 62.950 0.400 . 1 . . . . A 80 PRO CA . 34231 1 922 . 1 1 80 80 PRO CB C 13 32.106 0.400 . 1 . . . . A 80 PRO CB . 34231 1 923 . 1 1 80 80 PRO CG C 13 26.590 0.400 . 1 . . . . A 80 PRO CG . 34231 1 924 . 1 1 80 80 PRO CD C 13 51.367 0.400 . 1 . . . . A 80 PRO CD . 34231 1 925 . 1 1 81 81 VAL H H 1 9.023 0.020 . 1 . . . . A 81 VAL H . 34231 1 926 . 1 1 81 81 VAL HA H 1 3.525 0.020 . 1 . . . . A 81 VAL HA . 34231 1 927 . 1 1 81 81 VAL HB H 1 2.192 0.020 . 1 . . . . A 81 VAL HB . 34231 1 928 . 1 1 81 81 VAL HG11 H 1 0.681 0.020 . 2 . . . . A 81 VAL HG11 . 34231 1 929 . 1 1 81 81 VAL HG12 H 1 0.681 0.020 . 2 . . . . A 81 VAL HG12 . 34231 1 930 . 1 1 81 81 VAL HG13 H 1 0.681 0.020 . 2 . . . . A 81 VAL HG13 . 34231 1 931 . 1 1 81 81 VAL HG21 H 1 0.407 0.020 . 2 . . . . A 81 VAL HG21 . 34231 1 932 . 1 1 81 81 VAL HG22 H 1 0.407 0.020 . 2 . . . . A 81 VAL HG22 . 34231 1 933 . 1 1 81 81 VAL HG23 H 1 0.407 0.020 . 2 . . . . A 81 VAL HG23 . 34231 1 934 . 1 1 81 81 VAL CA C 13 62.488 0.400 . 1 . . . . A 81 VAL CA . 34231 1 935 . 1 1 81 81 VAL CB C 13 31.554 0.400 . 1 . . . . A 81 VAL CB . 34231 1 936 . 1 1 81 81 VAL CG1 C 13 18.302 0.400 . 2 . . . . A 81 VAL CG1 . 34231 1 937 . 1 1 81 81 VAL CG2 C 13 24.119 0.400 . 2 . . . . A 81 VAL CG2 . 34231 1 938 . 1 1 81 81 VAL N N 15 127.712 0.400 . 1 . . . . A 81 VAL N . 34231 1 939 . 1 1 82 82 PRO HA H 1 3.980 0.020 . 1 . . . . A 82 PRO HA . 34231 1 940 . 1 1 82 82 PRO HB2 H 1 1.901 0.020 . 2 . . . . A 82 PRO HB2 . 34231 1 941 . 1 1 82 82 PRO HB3 H 1 1.901 0.020 . 2 . . . . A 82 PRO HB3 . 34231 1 942 . 1 1 82 82 PRO C C 13 174.654 0.400 . 1 . . . . A 82 PRO C . 34231 1 943 . 1 1 82 82 PRO CA C 13 64.198 0.400 . 1 . . . . A 82 PRO CA . 34231 1 944 . 1 1 82 82 PRO CB C 13 31.644 0.400 . 1 . . . . A 82 PRO CB . 34231 1 945 . 1 1 82 82 PRO CG C 13 28.338 0.400 . 1 . . . . A 82 PRO CG . 34231 1 946 . 1 1 82 82 PRO CD C 13 50.506 0.400 . 1 . . . . A 82 PRO CD . 34231 1 947 . 1 1 83 83 PHE H H 1 7.977 0.020 . 1 . . . . A 83 PHE H . 34231 1 948 . 1 1 83 83 PHE HA H 1 4.219 0.020 . 1 . . . . A 83 PHE HA . 34231 1 949 . 1 1 83 83 PHE HB2 H 1 3.546 0.020 . 2 . . . . A 83 PHE HB2 . 34231 1 950 . 1 1 83 83 PHE HB3 H 1 3.220 0.020 . 2 . . . . A 83 PHE HB3 . 34231 1 951 . 1 1 83 83 PHE HD1 H 1 7.077 0.020 . 1 . . . . A 83 PHE HD1 . 34231 1 952 . 1 1 83 83 PHE HD2 H 1 7.077 0.020 . 1 . . . . A 83 PHE HD2 . 34231 1 953 . 1 1 83 83 PHE HE1 H 1 7.339 0.020 . 1 . . . . A 83 PHE HE1 . 34231 1 954 . 1 1 83 83 PHE HE2 H 1 7.339 0.020 . 1 . . . . A 83 PHE HE2 . 34231 1 955 . 1 1 83 83 PHE HZ H 1 7.403 0.020 . 1 . . . . A 83 PHE HZ . 34231 1 956 . 1 1 83 83 PHE C C 13 175.242 0.400 . 1 . . . . A 83 PHE C . 34231 1 957 . 1 1 83 83 PHE CA C 13 60.939 0.400 . 1 . . . . A 83 PHE CA . 34231 1 958 . 1 1 83 83 PHE CB C 13 37.328 0.400 . 1 . . . . A 83 PHE CB . 34231 1 959 . 1 1 83 83 PHE CD1 C 13 131.802 0.400 . 3 . . . . A 83 PHE CD1 . 34231 1 960 . 1 1 83 83 PHE CD2 C 13 131.802 0.400 . 3 . . . . A 83 PHE CD2 . 34231 1 961 . 1 1 83 83 PHE CE1 C 13 131.001 0.400 . 3 . . . . A 83 PHE CE1 . 34231 1 962 . 1 1 83 83 PHE CE2 C 13 131.001 0.400 . 3 . . . . A 83 PHE CE2 . 34231 1 963 . 1 1 83 83 PHE CZ C 13 129.093 0.400 . 1 . . . . A 83 PHE CZ . 34231 1 964 . 1 1 83 83 PHE N N 15 111.431 0.400 . 1 . . . . A 83 PHE N . 34231 1 965 . 1 1 84 84 CYS H H 1 7.768 0.020 . 1 . . . . A 84 CYS H . 34231 1 966 . 1 1 84 84 CYS HA H 1 3.978 0.020 . 1 . . . . A 84 CYS HA . 34231 1 967 . 1 1 84 84 CYS HB2 H 1 3.235 0.020 . 2 . . . . A 84 CYS HB2 . 34231 1 968 . 1 1 84 84 CYS HB3 H 1 2.762 0.020 . 2 . . . . A 84 CYS HB3 . 34231 1 969 . 1 1 84 84 CYS C C 13 176.906 0.400 . 1 . . . . A 84 CYS C . 34231 1 970 . 1 1 84 84 CYS CA C 13 65.021 0.400 . 1 . . . . A 84 CYS CA . 34231 1 971 . 1 1 84 84 CYS CB C 13 29.871 0.400 . 1 . . . . A 84 CYS CB . 34231 1 972 . 1 1 84 84 CYS N N 15 124.129 0.400 . 1 . . . . A 84 CYS N . 34231 1 973 . 1 1 85 85 LEU H H 1 8.215 0.020 . 1 . . . . A 85 LEU H . 34231 1 974 . 1 1 85 85 LEU HA H 1 4.023 0.020 . 1 . . . . A 85 LEU HA . 34231 1 975 . 1 1 85 85 LEU HB2 H 1 1.762 0.020 . 2 . . . . A 85 LEU HB2 . 34231 1 976 . 1 1 85 85 LEU HB3 H 1 1.762 0.020 . 2 . . . . A 85 LEU HB3 . 34231 1 977 . 1 1 85 85 LEU HG H 1 1.552 0.020 . 1 . . . . A 85 LEU HG . 34231 1 978 . 1 1 85 85 LEU HD11 H 1 0.952 0.020 . 2 . . . . A 85 LEU HD11 . 34231 1 979 . 1 1 85 85 LEU HD12 H 1 0.952 0.020 . 2 . . . . A 85 LEU HD12 . 34231 1 980 . 1 1 85 85 LEU HD13 H 1 0.952 0.020 . 2 . . . . A 85 LEU HD13 . 34231 1 981 . 1 1 85 85 LEU HD21 H 1 0.952 0.020 . 2 . . . . A 85 LEU HD21 . 34231 1 982 . 1 1 85 85 LEU HD22 H 1 0.952 0.020 . 2 . . . . A 85 LEU HD22 . 34231 1 983 . 1 1 85 85 LEU HD23 H 1 0.952 0.020 . 2 . . . . A 85 LEU HD23 . 34231 1 984 . 1 1 85 85 LEU C C 13 179.341 0.400 . 1 . . . . A 85 LEU C . 34231 1 985 . 1 1 85 85 LEU CA C 13 58.397 0.400 . 1 . . . . A 85 LEU CA . 34231 1 986 . 1 1 85 85 LEU CB C 13 41.098 0.400 . 1 . . . . A 85 LEU CB . 34231 1 987 . 1 1 85 85 LEU CG C 13 27.220 0.400 . 1 . . . . A 85 LEU CG . 34231 1 988 . 1 1 85 85 LEU CD1 C 13 24.776 0.400 . 2 . . . . A 85 LEU CD1 . 34231 1 989 . 1 1 85 85 LEU N N 15 114.523 0.400 . 1 . . . . A 85 LEU N . 34231 1 990 . 1 1 86 86 ASN H H 1 7.756 0.020 . 1 . . . . A 86 ASN H . 34231 1 991 . 1 1 86 86 ASN HA H 1 4.394 0.020 . 1 . . . . A 86 ASN HA . 34231 1 992 . 1 1 86 86 ASN HB2 H 1 2.881 0.020 . 2 . . . . A 86 ASN HB2 . 34231 1 993 . 1 1 86 86 ASN HB3 H 1 2.881 0.020 . 2 . . . . A 86 ASN HB3 . 34231 1 994 . 1 1 86 86 ASN C C 13 177.698 0.400 . 1 . . . . A 86 ASN C . 34231 1 995 . 1 1 86 86 ASN CA C 13 56.672 0.400 . 1 . . . . A 86 ASN CA . 34231 1 996 . 1 1 86 86 ASN CB C 13 38.861 0.400 . 1 . . . . A 86 ASN CB . 34231 1 997 . 1 1 86 86 ASN N N 15 115.678 0.400 . 1 . . . . A 86 ASN N . 34231 1 998 . 1 1 87 87 ILE H H 1 8.457 0.020 . 1 . . . . A 87 ILE H . 34231 1 999 . 1 1 87 87 ILE HA H 1 3.700 0.020 . 1 . . . . A 87 ILE HA . 34231 1 1000 . 1 1 87 87 ILE HB H 1 2.018 0.020 . 1 . . . . A 87 ILE HB . 34231 1 1001 . 1 1 87 87 ILE HG12 H 1 1.678 0.020 . 2 . . . . A 87 ILE HG12 . 34231 1 1002 . 1 1 87 87 ILE HG13 H 1 1.678 0.020 . 2 . . . . A 87 ILE HG13 . 34231 1 1003 . 1 1 87 87 ILE HG21 H 1 0.851 0.020 . 1 . . . . A 87 ILE HG21 . 34231 1 1004 . 1 1 87 87 ILE HG22 H 1 0.851 0.020 . 1 . . . . A 87 ILE HG22 . 34231 1 1005 . 1 1 87 87 ILE HG23 H 1 0.851 0.020 . 1 . . . . A 87 ILE HG23 . 34231 1 1006 . 1 1 87 87 ILE HD11 H 1 0.782 0.020 . 1 . . . . A 87 ILE HD11 . 34231 1 1007 . 1 1 87 87 ILE HD12 H 1 0.782 0.020 . 1 . . . . A 87 ILE HD12 . 34231 1 1008 . 1 1 87 87 ILE HD13 H 1 0.782 0.020 . 1 . . . . A 87 ILE HD13 . 34231 1 1009 . 1 1 87 87 ILE C C 13 179.352 0.400 . 1 . . . . A 87 ILE C . 34231 1 1010 . 1 1 87 87 ILE CA C 13 64.583 0.400 . 1 . . . . A 87 ILE CA . 34231 1 1011 . 1 1 87 87 ILE CB C 13 37.823 0.400 . 1 . . . . A 87 ILE CB . 34231 1 1012 . 1 1 87 87 ILE CG1 C 13 28.994 0.400 . 1 . . . . A 87 ILE CG1 . 34231 1 1013 . 1 1 87 87 ILE CG2 C 13 17.864 0.400 . 1 . . . . A 87 ILE CG2 . 34231 1 1014 . 1 1 87 87 ILE CD1 C 13 13.528 0.400 . 1 . . . . A 87 ILE CD1 . 34231 1 1015 . 1 1 87 87 ILE N N 15 121.044 0.400 . 1 . . . . A 87 ILE N . 34231 1 1016 . 1 1 88 88 LYS H H 1 8.589 0.020 . 1 . . . . A 88 LYS H . 34231 1 1017 . 1 1 88 88 LYS HA H 1 3.991 0.020 . 1 . . . . A 88 LYS HA . 34231 1 1018 . 1 1 88 88 LYS HB2 H 1 2.007 0.020 . 2 . . . . A 88 LYS HB2 . 34231 1 1019 . 1 1 88 88 LYS HB3 H 1 1.950 0.020 . 2 . . . . A 88 LYS HB3 . 34231 1 1020 . 1 1 88 88 LYS HG2 H 1 1.426 0.020 . 2 . . . . A 88 LYS HG2 . 34231 1 1021 . 1 1 88 88 LYS HG3 H 1 1.426 0.020 . 2 . . . . A 88 LYS HG3 . 34231 1 1022 . 1 1 88 88 LYS HD2 H 1 1.815 0.020 . 2 . . . . A 88 LYS HD2 . 34231 1 1023 . 1 1 88 88 LYS HD3 H 1 1.689 0.020 . 2 . . . . A 88 LYS HD3 . 34231 1 1024 . 1 1 88 88 LYS C C 13 179.078 0.400 . 1 . . . . A 88 LYS C . 34231 1 1025 . 1 1 88 88 LYS CA C 13 60.327 0.400 . 1 . . . . A 88 LYS CA . 34231 1 1026 . 1 1 88 88 LYS CB C 13 32.593 0.400 . 1 . . . . A 88 LYS CB . 34231 1 1027 . 1 1 88 88 LYS CG C 13 26.176 0.400 . 1 . . . . A 88 LYS CG . 34231 1 1028 . 1 1 88 88 LYS CD C 13 30.629 0.400 . 1 . . . . A 88 LYS CD . 34231 1 1029 . 1 1 88 88 LYS CE C 13 41.939 0.400 . 1 . . . . A 88 LYS CE . 34231 1 1030 . 1 1 88 88 LYS N N 15 120.209 0.400 . 1 . . . . A 88 LYS N . 34231 1 1031 . 1 1 89 89 GLN H H 1 8.024 0.020 . 1 . . . . A 89 GLN H . 34231 1 1032 . 1 1 89 89 GLN HA H 1 4.196 0.020 . 1 . . . . A 89 GLN HA . 34231 1 1033 . 1 1 89 89 GLN HB2 H 1 2.171 0.020 . 2 . . . . A 89 GLN HB2 . 34231 1 1034 . 1 1 89 89 GLN HB3 H 1 2.171 0.020 . 2 . . . . A 89 GLN HB3 . 34231 1 1035 . 1 1 89 89 GLN HG2 H 1 2.605 0.020 . 2 . . . . A 89 GLN HG2 . 34231 1 1036 . 1 1 89 89 GLN HG3 H 1 2.433 0.020 . 2 . . . . A 89 GLN HG3 . 34231 1 1037 . 1 1 89 89 GLN C C 13 177.339 0.400 . 1 . . . . A 89 GLN C . 34231 1 1038 . 1 1 89 89 GLN CA C 13 57.607 0.400 . 1 . . . . A 89 GLN CA . 34231 1 1039 . 1 1 89 89 GLN CB C 13 28.950 0.400 . 1 . . . . A 89 GLN CB . 34231 1 1040 . 1 1 89 89 GLN CG C 13 34.275 0.400 . 1 . . . . A 89 GLN CG . 34231 1 1041 . 1 1 89 89 GLN N N 15 116.446 0.400 . 1 . . . . A 89 GLN N . 34231 1 1042 . 1 1 90 90 LYS H H 1 7.871 0.020 . 1 . . . . A 90 LYS H . 34231 1 1043 . 1 1 90 90 LYS HA H 1 4.298 0.020 . 1 . . . . A 90 LYS HA . 34231 1 1044 . 1 1 90 90 LYS HB2 H 1 1.954 0.020 . 2 . . . . A 90 LYS HB2 . 34231 1 1045 . 1 1 90 90 LYS HB3 H 1 1.954 0.020 . 2 . . . . A 90 LYS HB3 . 34231 1 1046 . 1 1 90 90 LYS HG2 H 1 1.556 0.020 . 2 . . . . A 90 LYS HG2 . 34231 1 1047 . 1 1 90 90 LYS HG3 H 1 1.505 0.020 . 2 . . . . A 90 LYS HG3 . 34231 1 1048 . 1 1 90 90 LYS HD2 H 1 1.694 0.020 . 2 . . . . A 90 LYS HD2 . 34231 1 1049 . 1 1 90 90 LYS HD3 H 1 1.694 0.020 . 2 . . . . A 90 LYS HD3 . 34231 1 1050 . 1 1 90 90 LYS HE2 H 1 3.003 0.020 . 2 . . . . A 90 LYS HE2 . 34231 1 1051 . 1 1 90 90 LYS HE3 H 1 3.003 0.020 . 2 . . . . A 90 LYS HE3 . 34231 1 1052 . 1 1 90 90 LYS C C 13 177.568 0.400 . 1 . . . . A 90 LYS C . 34231 1 1053 . 1 1 90 90 LYS CA C 13 57.128 0.400 . 1 . . . . A 90 LYS CA . 34231 1 1054 . 1 1 90 90 LYS CB C 13 32.914 0.400 . 1 . . . . A 90 LYS CB . 34231 1 1055 . 1 1 90 90 LYS CG C 13 25.078 0.400 . 1 . . . . A 90 LYS CG . 34231 1 1056 . 1 1 90 90 LYS CD C 13 29.074 0.400 . 1 . . . . A 90 LYS CD . 34231 1 1057 . 1 1 90 90 LYS CE C 13 42.234 0.400 . 1 . . . . A 90 LYS CE . 34231 1 1058 . 1 1 90 90 LYS N N 15 118.180 0.400 . 1 . . . . A 90 LYS N . 34231 1 1059 . 1 1 91 91 GLY H H 1 8.116 0.020 . 1 . . . . A 91 GLY H . 34231 1 1060 . 1 1 91 91 GLY HA2 H 1 4.116 0.020 . 2 . . . . A 91 GLY HA2 . 34231 1 1061 . 1 1 91 91 GLY HA3 H 1 3.945 0.020 . 2 . . . . A 91 GLY HA3 . 34231 1 1062 . 1 1 91 91 GLY C C 13 174.202 0.400 . 1 . . . . A 91 GLY C . 34231 1 1063 . 1 1 91 91 GLY CA C 13 45.615 0.400 . 1 . . . . A 91 GLY CA . 34231 1 1064 . 1 1 91 91 GLY N N 15 107.979 0.400 . 1 . . . . A 91 GLY N . 34231 1 1065 . 1 1 92 92 THR H H 1 7.947 0.020 . 1 . . . . A 92 THR H . 34231 1 1066 . 1 1 92 92 THR HA H 1 4.351 0.020 . 1 . . . . A 92 THR HA . 34231 1 1067 . 1 1 92 92 THR HG21 H 1 1.153 0.020 . 1 . . . . A 92 THR HG21 . 34231 1 1068 . 1 1 92 92 THR HG22 H 1 1.153 0.020 . 1 . . . . A 92 THR HG22 . 34231 1 1069 . 1 1 92 92 THR HG23 H 1 1.153 0.020 . 1 . . . . A 92 THR HG23 . 34231 1 1070 . 1 1 92 92 THR C C 13 174.544 0.400 . 1 . . . . A 92 THR C . 34231 1 1071 . 1 1 92 92 THR CA C 13 61.775 0.400 . 1 . . . . A 92 THR CA . 34231 1 1072 . 1 1 92 92 THR CB C 13 69.752 0.400 . 1 . . . . A 92 THR CB . 34231 1 1073 . 1 1 92 92 THR CG2 C 13 21.623 0.400 . 1 . . . . A 92 THR CG2 . 34231 1 1074 . 1 1 92 92 THR N N 15 113.274 0.400 . 1 . . . . A 92 THR N . 34231 1 1075 . 1 1 93 93 ILE H H 1 8.144 0.020 . 1 . . . . A 93 ILE H . 34231 1 1076 . 1 1 93 93 ILE HA H 1 4.157 0.020 . 1 . . . . A 93 ILE HA . 34231 1 1077 . 1 1 93 93 ILE HB H 1 1.839 0.020 . 1 . . . . A 93 ILE HB . 34231 1 1078 . 1 1 93 93 ILE HG12 H 1 1.444 0.020 . 2 . . . . A 93 ILE HG12 . 34231 1 1079 . 1 1 93 93 ILE HG13 H 1 1.145 0.020 . 2 . . . . A 93 ILE HG13 . 34231 1 1080 . 1 1 93 93 ILE HG21 H 1 0.852 0.020 . 1 . . . . A 93 ILE HG21 . 34231 1 1081 . 1 1 93 93 ILE HG22 H 1 0.852 0.020 . 1 . . . . A 93 ILE HG22 . 34231 1 1082 . 1 1 93 93 ILE HG23 H 1 0.852 0.020 . 1 . . . . A 93 ILE HG23 . 34231 1 1083 . 1 1 93 93 ILE HD11 H 1 0.821 0.020 . 1 . . . . A 93 ILE HD11 . 34231 1 1084 . 1 1 93 93 ILE HD12 H 1 0.821 0.020 . 1 . . . . A 93 ILE HD12 . 34231 1 1085 . 1 1 93 93 ILE HD13 H 1 0.821 0.020 . 1 . . . . A 93 ILE HD13 . 34231 1 1086 . 1 1 93 93 ILE C C 13 176.246 0.400 . 1 . . . . A 93 ILE C . 34231 1 1087 . 1 1 93 93 ILE CA C 13 61.396 0.400 . 1 . . . . A 93 ILE CA . 34231 1 1088 . 1 1 93 93 ILE CB C 13 38.840 0.400 . 1 . . . . A 93 ILE CB . 34231 1 1089 . 1 1 93 93 ILE CG1 C 13 27.444 0.400 . 1 . . . . A 93 ILE CG1 . 34231 1 1090 . 1 1 93 93 ILE CG2 C 13 17.797 0.400 . 1 . . . . A 93 ILE CG2 . 34231 1 1091 . 1 1 93 93 ILE CD1 C 13 13.271 0.400 . 1 . . . . A 93 ILE CD1 . 34231 1 1092 . 1 1 93 93 ILE N N 15 122.326 0.400 . 1 . . . . A 93 ILE N . 34231 1 1093 . 1 1 94 94 GLU H H 1 8.469 0.020 . 1 . . . . A 94 GLU H . 34231 1 1094 . 1 1 94 94 GLU HA H 1 4.239 0.020 . 1 . . . . A 94 GLU HA . 34231 1 1095 . 1 1 94 94 GLU HB2 H 1 2.028 0.020 . 2 . . . . A 94 GLU HB2 . 34231 1 1096 . 1 1 94 94 GLU HB3 H 1 1.939 0.020 . 2 . . . . A 94 GLU HB3 . 34231 1 1097 . 1 1 94 94 GLU HG2 H 1 2.251 0.020 . 2 . . . . A 94 GLU HG2 . 34231 1 1098 . 1 1 94 94 GLU HG3 H 1 2.251 0.020 . 2 . . . . A 94 GLU HG3 . 34231 1 1099 . 1 1 94 94 GLU C C 13 176.929 0.400 . 1 . . . . A 94 GLU C . 34231 1 1100 . 1 1 94 94 GLU CA C 13 57.047 0.400 . 1 . . . . A 94 GLU CA . 34231 1 1101 . 1 1 94 94 GLU CB C 13 30.147 0.400 . 1 . . . . A 94 GLU CB . 34231 1 1102 . 1 1 94 94 GLU CG C 13 36.354 0.400 . 1 . . . . A 94 GLU CG . 34231 1 1103 . 1 1 94 94 GLU N N 15 124.282 0.400 . 1 . . . . A 94 GLU N . 34231 1 1104 . 1 1 95 95 GLY H H 1 8.359 0.020 . 1 . . . . A 95 GLY H . 34231 1 1105 . 1 1 95 95 GLY HA2 H 1 3.941 0.020 . 2 . . . . A 95 GLY HA2 . 34231 1 1106 . 1 1 95 95 GLY HA3 H 1 3.941 0.020 . 2 . . . . A 95 GLY HA3 . 34231 1 1107 . 1 1 95 95 GLY C C 13 174.377 0.400 . 1 . . . . A 95 GLY C . 34231 1 1108 . 1 1 95 95 GLY CA C 13 45.539 0.400 . 1 . . . . A 95 GLY CA . 34231 1 1109 . 1 1 95 95 GLY N N 15 109.877 0.400 . 1 . . . . A 95 GLY N . 34231 1 1110 . 1 1 96 96 ARG H H 1 8.156 0.020 . 1 . . . . A 96 ARG H . 34231 1 1111 . 1 1 96 96 ARG HA H 1 4.360 0.020 . 1 . . . . A 96 ARG HA . 34231 1 1112 . 1 1 96 96 ARG HB2 H 1 1.899 0.020 . 2 . . . . A 96 ARG HB2 . 34231 1 1113 . 1 1 96 96 ARG HB3 H 1 1.758 0.020 . 2 . . . . A 96 ARG HB3 . 34231 1 1114 . 1 1 96 96 ARG HG2 H 1 1.620 0.020 . 2 . . . . A 96 ARG HG2 . 34231 1 1115 . 1 1 96 96 ARG HG3 H 1 1.620 0.020 . 2 . . . . A 96 ARG HG3 . 34231 1 1116 . 1 1 96 96 ARG HD2 H 1 3.161 0.020 . 2 . . . . A 96 ARG HD2 . 34231 1 1117 . 1 1 96 96 ARG HD3 H 1 3.161 0.020 . 2 . . . . A 96 ARG HD3 . 34231 1 1118 . 1 1 96 96 ARG C C 13 176.920 0.400 . 1 . . . . A 96 ARG C . 34231 1 1119 . 1 1 96 96 ARG CA C 13 56.255 0.400 . 1 . . . . A 96 ARG CA . 34231 1 1120 . 1 1 96 96 ARG CB C 13 30.789 0.400 . 1 . . . . A 96 ARG CB . 34231 1 1121 . 1 1 96 96 ARG CG C 13 27.151 0.400 . 1 . . . . A 96 ARG CG . 34231 1 1122 . 1 1 96 96 ARG CD C 13 43.460 0.400 . 1 . . . . A 96 ARG CD . 34231 1 1123 . 1 1 96 96 ARG N N 15 120.181 0.400 . 1 . . . . A 96 ARG N . 34231 1 1124 . 1 1 97 97 GLY H H 1 8.535 0.020 . 1 . . . . A 97 GLY H . 34231 1 1125 . 1 1 97 97 GLY HA2 H 1 3.967 0.020 . 2 . . . . A 97 GLY HA2 . 34231 1 1126 . 1 1 97 97 GLY HA3 H 1 3.967 0.020 . 2 . . . . A 97 GLY HA3 . 34231 1 1127 . 1 1 97 97 GLY C C 13 174.156 0.400 . 1 . . . . A 97 GLY C . 34231 1 1128 . 1 1 97 97 GLY CA C 13 45.582 0.400 . 1 . . . . A 97 GLY CA . 34231 1 1129 . 1 1 97 97 GLY N N 15 109.645 0.400 . 1 . . . . A 97 GLY N . 34231 1 1130 . 1 1 98 98 ASN H H 1 8.280 0.020 . 1 . . . . A 98 ASN H . 34231 1 1131 . 1 1 98 98 ASN HA H 1 4.670 0.020 . 1 . . . . A 98 ASN HA . 34231 1 1132 . 1 1 98 98 ASN HB2 H 1 2.753 0.020 . 2 . . . . A 98 ASN HB2 . 34231 1 1133 . 1 1 98 98 ASN HB3 H 1 2.753 0.020 . 2 . . . . A 98 ASN HB3 . 34231 1 1134 . 1 1 98 98 ASN C C 13 175.472 0.400 . 1 . . . . A 98 ASN C . 34231 1 1135 . 1 1 98 98 ASN CA C 13 53.512 0.400 . 1 . . . . A 98 ASN CA . 34231 1 1136 . 1 1 98 98 ASN CB C 13 38.899 0.400 . 1 . . . . A 98 ASN CB . 34231 1 1137 . 1 1 98 98 ASN N N 15 118.472 0.400 . 1 . . . . A 98 ASN N . 34231 1 1138 . 1 1 99 99 GLU H H 1 8.568 0.020 . 1 . . . . A 99 GLU H . 34231 1 1139 . 1 1 99 99 GLU HA H 1 4.184 0.020 . 1 . . . . A 99 GLU HA . 34231 1 1140 . 1 1 99 99 GLU HB2 H 1 1.902 0.020 . 2 . . . . A 99 GLU HB2 . 34231 1 1141 . 1 1 99 99 GLU HB3 H 1 1.850 0.020 . 2 . . . . A 99 GLU HB3 . 34231 1 1142 . 1 1 99 99 GLU HG2 H 1 2.119 0.020 . 2 . . . . A 99 GLU HG2 . 34231 1 1143 . 1 1 99 99 GLU HG3 H 1 2.078 0.020 . 2 . . . . A 99 GLU HG3 . 34231 1 1144 . 1 1 99 99 GLU C C 13 176.174 0.400 . 1 . . . . A 99 GLU C . 34231 1 1145 . 1 1 99 99 GLU CA C 13 57.275 0.400 . 1 . . . . A 99 GLU CA . 34231 1 1146 . 1 1 99 99 GLU CB C 13 29.883 0.400 . 1 . . . . A 99 GLU CB . 34231 1 1147 . 1 1 99 99 GLU CG C 13 36.203 0.400 . 1 . . . . A 99 GLU CG . 34231 1 1148 . 1 1 99 99 GLU N N 15 120.852 0.400 . 1 . . . . A 99 GLU N . 34231 1 1149 . 1 1 100 100 PHE H H 1 8.102 0.020 . 1 . . . . A 100 PHE H . 34231 1 1150 . 1 1 100 100 PHE HA H 1 4.613 0.020 . 1 . . . . A 100 PHE HA . 34231 1 1151 . 1 1 100 100 PHE HB2 H 1 3.120 0.020 . 2 . . . . A 100 PHE HB2 . 34231 1 1152 . 1 1 100 100 PHE HB3 H 1 3.001 0.020 . 2 . . . . A 100 PHE HB3 . 34231 1 1153 . 1 1 100 100 PHE HD1 H 1 7.208 0.020 . 1 . . . . A 100 PHE HD1 . 34231 1 1154 . 1 1 100 100 PHE HD2 H 1 7.208 0.020 . 1 . . . . A 100 PHE HD2 . 34231 1 1155 . 1 1 100 100 PHE HE1 H 1 7.281 0.020 . 1 . . . . A 100 PHE HE1 . 34231 1 1156 . 1 1 100 100 PHE HE2 H 1 7.281 0.020 . 1 . . . . A 100 PHE HE2 . 34231 1 1157 . 1 1 100 100 PHE HZ H 1 7.226 0.020 . 1 . . . . A 100 PHE HZ . 34231 1 1158 . 1 1 100 100 PHE C C 13 175.156 0.400 . 1 . . . . A 100 PHE C . 34231 1 1159 . 1 1 100 100 PHE CA C 13 57.660 0.400 . 1 . . . . A 100 PHE CA . 34231 1 1160 . 1 1 100 100 PHE CB C 13 39.570 0.400 . 1 . . . . A 100 PHE CB . 34231 1 1161 . 1 1 100 100 PHE CD1 C 13 131.911 0.400 . 3 . . . . A 100 PHE CD1 . 34231 1 1162 . 1 1 100 100 PHE CD2 C 13 131.837 0.400 . 3 . . . . A 100 PHE CD2 . 34231 1 1163 . 1 1 100 100 PHE CE1 C 13 131.257 0.400 . 3 . . . . A 100 PHE CE1 . 34231 1 1164 . 1 1 100 100 PHE CE2 C 13 131.257 0.400 . 3 . . . . A 100 PHE CE2 . 34231 1 1165 . 1 1 100 100 PHE CZ C 13 129.620 0.400 . 1 . . . . A 100 PHE CZ . 34231 1 1166 . 1 1 100 100 PHE N N 15 119.890 0.400 . 1 . . . . A 100 PHE N . 34231 1 1167 . 1 1 101 101 LEU H H 1 7.869 0.020 . 1 . . . . A 101 LEU H . 34231 1 1168 . 1 1 101 101 LEU HA H 1 4.348 0.020 . 1 . . . . A 101 LEU HA . 34231 1 1169 . 1 1 101 101 LEU HB2 H 1 1.466 0.020 . 2 . . . . A 101 LEU HB2 . 34231 1 1170 . 1 1 101 101 LEU HB3 H 1 1.466 0.020 . 2 . . . . A 101 LEU HB3 . 34231 1 1171 . 1 1 101 101 LEU HG H 1 1.505 0.020 . 1 . . . . A 101 LEU HG . 34231 1 1172 . 1 1 101 101 LEU HD11 H 1 0.796 0.020 . 2 . . . . A 101 LEU HD11 . 34231 1 1173 . 1 1 101 101 LEU HD12 H 1 0.796 0.020 . 2 . . . . A 101 LEU HD12 . 34231 1 1174 . 1 1 101 101 LEU HD13 H 1 0.796 0.020 . 2 . . . . A 101 LEU HD13 . 34231 1 1175 . 1 1 101 101 LEU HD21 H 1 0.796 0.020 . 2 . . . . A 101 LEU HD21 . 34231 1 1176 . 1 1 101 101 LEU HD22 H 1 0.796 0.020 . 2 . . . . A 101 LEU HD22 . 34231 1 1177 . 1 1 101 101 LEU HD23 H 1 0.796 0.020 . 2 . . . . A 101 LEU HD23 . 34231 1 1178 . 1 1 101 101 LEU C C 13 175.949 0.400 . 1 . . . . A 101 LEU C . 34231 1 1179 . 1 1 101 101 LEU CA C 13 54.573 0.400 . 1 . . . . A 101 LEU CA . 34231 1 1180 . 1 1 101 101 LEU CB C 13 42.752 0.400 . 1 . . . . A 101 LEU CB . 34231 1 1181 . 1 1 101 101 LEU CG C 13 26.926 0.400 . 1 . . . . A 101 LEU CG . 34231 1 1182 . 1 1 101 101 LEU CD1 C 13 25.272 0.400 . 2 . . . . A 101 LEU CD1 . 34231 1 1183 . 1 1 101 101 LEU CD2 C 13 24.174 0.400 . 2 . . . . A 101 LEU CD2 . 34231 1 1184 . 1 1 101 101 LEU N N 15 122.919 0.400 . 1 . . . . A 101 LEU N . 34231 1 1185 . 1 1 102 102 SER H H 1 8.101 0.020 . 1 . . . . A 102 SER H . 34231 1 1186 . 1 1 102 102 SER HB2 H 1 3.893 0.020 . 2 . . . . A 102 SER HB2 . 34231 1 1187 . 1 1 102 102 SER HB3 H 1 4.053 0.020 . 2 . . . . A 102 SER HB3 . 34231 1 1188 . 1 1 102 102 SER CA C 13 55.863 0.400 . 1 . . . . A 102 SER CA . 34231 1 1189 . 1 1 102 102 SER CB C 13 63.611 0.400 . 1 . . . . A 102 SER CB . 34231 1 1190 . 1 1 102 102 SER N N 15 118.019 0.400 . 1 . . . . A 102 SER N . 34231 1 1191 . 1 1 103 103 PRO HA H 1 4.168 0.020 . 1 . . . . A 103 PRO HA . 34231 1 1192 . 1 1 103 103 PRO HB2 H 1 2.278 0.020 . 2 . . . . A 103 PRO HB2 . 34231 1 1193 . 1 1 103 103 PRO HB3 H 1 2.122 0.020 . 2 . . . . A 103 PRO HB3 . 34231 1 1194 . 1 1 103 103 PRO HG2 H 1 1.971 0.020 . 2 . . . . A 103 PRO HG2 . 34231 1 1195 . 1 1 103 103 PRO HG3 H 1 1.971 0.020 . 2 . . . . A 103 PRO HG3 . 34231 1 1196 . 1 1 103 103 PRO HD2 H 1 3.904 0.020 . 2 . . . . A 103 PRO HD2 . 34231 1 1197 . 1 1 103 103 PRO HD3 H 1 3.859 0.020 . 2 . . . . A 103 PRO HD3 . 34231 1 1198 . 1 1 103 103 PRO C C 13 177.860 0.400 . 1 . . . . A 103 PRO C . 34231 1 1199 . 1 1 103 103 PRO CA C 13 64.978 0.400 . 1 . . . . A 103 PRO CA . 34231 1 1200 . 1 1 103 103 PRO CB C 13 32.014 0.400 . 1 . . . . A 103 PRO CB . 34231 1 1201 . 1 1 103 103 PRO CG C 13 27.764 0.400 . 1 . . . . A 103 PRO CG . 34231 1 1202 . 1 1 103 103 PRO CD C 13 50.793 0.400 . 1 . . . . A 103 PRO CD . 34231 1 1203 . 1 1 104 104 GLU H H 1 8.610 0.020 . 1 . . . . A 104 GLU H . 34231 1 1204 . 1 1 104 104 GLU HA H 1 4.116 0.020 . 1 . . . . A 104 GLU HA . 34231 1 1205 . 1 1 104 104 GLU HB2 H 1 1.978 0.020 . 2 . . . . A 104 GLU HB2 . 34231 1 1206 . 1 1 104 104 GLU HB3 H 1 1.978 0.020 . 2 . . . . A 104 GLU HB3 . 34231 1 1207 . 1 1 104 104 GLU HG2 H 1 2.276 0.020 . 2 . . . . A 104 GLU HG2 . 34231 1 1208 . 1 1 104 104 GLU HG3 H 1 2.276 0.020 . 2 . . . . A 104 GLU HG3 . 34231 1 1209 . 1 1 104 104 GLU C C 13 177.835 0.400 . 1 . . . . A 104 GLU C . 34231 1 1210 . 1 1 104 104 GLU CA C 13 58.735 0.400 . 1 . . . . A 104 GLU CA . 34231 1 1211 . 1 1 104 104 GLU CB C 13 29.185 0.400 . 1 . . . . A 104 GLU CB . 34231 1 1212 . 1 1 104 104 GLU CG C 13 36.563 0.400 . 1 . . . . A 104 GLU CG . 34231 1 1213 . 1 1 104 104 GLU N N 15 117.800 0.400 . 1 . . . . A 104 GLU N . 34231 1 1214 . 1 1 105 105 VAL H H 1 7.539 0.020 . 1 . . . . A 105 VAL H . 34231 1 1215 . 1 1 105 105 VAL HA H 1 3.824 0.020 . 1 . . . . A 105 VAL HA . 34231 1 1216 . 1 1 105 105 VAL HB H 1 2.017 0.020 . 1 . . . . A 105 VAL HB . 34231 1 1217 . 1 1 105 105 VAL HG11 H 1 0.877 0.020 . 2 . . . . A 105 VAL HG11 . 34231 1 1218 . 1 1 105 105 VAL HG12 H 1 0.877 0.020 . 2 . . . . A 105 VAL HG12 . 34231 1 1219 . 1 1 105 105 VAL HG13 H 1 0.877 0.020 . 2 . . . . A 105 VAL HG13 . 34231 1 1220 . 1 1 105 105 VAL HG21 H 1 0.728 0.020 . 2 . . . . A 105 VAL HG21 . 34231 1 1221 . 1 1 105 105 VAL HG22 H 1 0.728 0.020 . 2 . . . . A 105 VAL HG22 . 34231 1 1222 . 1 1 105 105 VAL HG23 H 1 0.728 0.020 . 2 . . . . A 105 VAL HG23 . 34231 1 1223 . 1 1 105 105 VAL C C 13 177.235 0.400 . 1 . . . . A 105 VAL C . 34231 1 1224 . 1 1 105 105 VAL CA C 13 64.562 0.400 . 1 . . . . A 105 VAL CA . 34231 1 1225 . 1 1 105 105 VAL CB C 13 31.971 0.400 . 1 . . . . A 105 VAL CB . 34231 1 1226 . 1 1 105 105 VAL CG1 C 13 21.774 0.400 . 2 . . . . A 105 VAL CG1 . 34231 1 1227 . 1 1 105 105 VAL CG2 C 13 21.077 0.400 . 2 . . . . A 105 VAL CG2 . 34231 1 1228 . 1 1 105 105 VAL N N 15 118.580 0.400 . 1 . . . . A 105 VAL N . 34231 1 1229 . 1 1 106 106 PHE H H 1 7.785 0.020 . 1 . . . . A 106 PHE H . 34231 1 1230 . 1 1 106 106 PHE HA H 1 4.245 0.020 . 1 . . . . A 106 PHE HA . 34231 1 1231 . 1 1 106 106 PHE HB2 H 1 2.911 0.020 . 2 . . . . A 106 PHE HB2 . 34231 1 1232 . 1 1 106 106 PHE HB3 H 1 2.966 0.020 . 2 . . . . A 106 PHE HB3 . 34231 1 1233 . 1 1 106 106 PHE HD1 H 1 7.105 0.020 . 1 . . . . A 106 PHE HD1 . 34231 1 1234 . 1 1 106 106 PHE HD2 H 1 7.105 0.020 . 1 . . . . A 106 PHE HD2 . 34231 1 1235 . 1 1 106 106 PHE HE1 H 1 7.149 0.020 . 1 . . . . A 106 PHE HE1 . 34231 1 1236 . 1 1 106 106 PHE HE2 H 1 7.149 0.020 . 1 . . . . A 106 PHE HE2 . 34231 1 1237 . 1 1 106 106 PHE HZ H 1 7.064 0.020 . 1 . . . . A 106 PHE HZ . 34231 1 1238 . 1 1 106 106 PHE C C 13 176.516 0.400 . 1 . . . . A 106 PHE C . 34231 1 1239 . 1 1 106 106 PHE CA C 13 59.737 0.400 . 1 . . . . A 106 PHE CA . 34231 1 1240 . 1 1 106 106 PHE CB C 13 38.720 0.400 . 1 . . . . A 106 PHE CB . 34231 1 1241 . 1 1 106 106 PHE CD1 C 13 131.659 0.400 . 3 . . . . A 106 PHE CD1 . 34231 1 1242 . 1 1 106 106 PHE CD2 C 13 131.659 0.400 . 3 . . . . A 106 PHE CD2 . 34231 1 1243 . 1 1 106 106 PHE CE1 C 13 131.044 0.400 . 3 . . . . A 106 PHE CE1 . 34231 1 1244 . 1 1 106 106 PHE CE2 C 13 131.044 0.400 . 3 . . . . A 106 PHE CE2 . 34231 1 1245 . 1 1 106 106 PHE CZ C 13 129.382 0.400 . 1 . . . . A 106 PHE CZ . 34231 1 1246 . 1 1 106 106 PHE N N 15 118.407 0.400 . 1 . . . . A 106 PHE N . 34231 1 1247 . 1 1 107 107 GLN H H 1 7.867 0.020 . 1 . . . . A 107 GLN H . 34231 1 1248 . 1 1 107 107 GLN HA H 1 4.006 0.020 . 1 . . . . A 107 GLN HA . 34231 1 1249 . 1 1 107 107 GLN HB2 H 1 2.061 0.020 . 2 . . . . A 107 GLN HB2 . 34231 1 1250 . 1 1 107 107 GLN HB3 H 1 2.061 0.020 . 2 . . . . A 107 GLN HB3 . 34231 1 1251 . 1 1 107 107 GLN HG2 H 1 2.307 0.020 . 2 . . . . A 107 GLN HG2 . 34231 1 1252 . 1 1 107 107 GLN HG3 H 1 2.307 0.020 . 2 . . . . A 107 GLN HG3 . 34231 1 1253 . 1 1 107 107 GLN C C 13 176.746 0.400 . 1 . . . . A 107 GLN C . 34231 1 1254 . 1 1 107 107 GLN CA C 13 57.897 0.400 . 1 . . . . A 107 GLN CA . 34231 1 1255 . 1 1 107 107 GLN CB C 13 28.661 0.400 . 1 . . . . A 107 GLN CB . 34231 1 1256 . 1 1 107 107 GLN CG C 13 34.166 0.400 . 1 . . . . A 107 GLN CG . 34231 1 1257 . 1 1 107 107 GLN N N 15 117.837 0.400 . 1 . . . . A 107 GLN N . 34231 1 1258 . 1 1 108 108 HIS H H 1 7.829 0.020 . 1 . . . . A 108 HIS H . 34231 1 1259 . 1 1 108 108 HIS HA H 1 4.525 0.020 . 1 . . . . A 108 HIS HA . 34231 1 1260 . 1 1 108 108 HIS HB2 H 1 3.170 0.020 . 2 . . . . A 108 HIS HB2 . 34231 1 1261 . 1 1 108 108 HIS HB3 H 1 3.060 0.020 . 2 . . . . A 108 HIS HB3 . 34231 1 1262 . 1 1 108 108 HIS HD2 H 1 7.166 0.020 . 1 . . . . A 108 HIS HD2 . 34231 1 1263 . 1 1 108 108 HIS HE1 H 1 8.237 0.020 . 1 . . . . A 108 HIS HE1 . 34231 1 1264 . 1 1 108 108 HIS C C 13 176.631 0.400 . 1 . . . . A 108 HIS C . 34231 1 1265 . 1 1 108 108 HIS CA C 13 56.786 0.400 . 1 . . . . A 108 HIS CA . 34231 1 1266 . 1 1 108 108 HIS CB C 13 29.168 0.400 . 1 . . . . A 108 HIS CB . 34231 1 1267 . 1 1 108 108 HIS CD2 C 13 120.342 0.400 . 1 . . . . A 108 HIS CD2 . 34231 1 1268 . 1 1 108 108 HIS CE1 C 13 137.362 0.400 . 1 . . . . A 108 HIS CE1 . 34231 1 1269 . 1 1 108 108 HIS N N 15 115.629 0.400 . 1 . . . . A 108 HIS N . 34231 1 1270 . 1 1 108 108 HIS ND1 N 15 195.801 0.400 . 1 . . . . A 108 HIS ND1 . 34231 1 1271 . 1 1 108 108 HIS NE2 N 15 178.197 0.400 . 1 . . . . A 108 HIS NE2 . 34231 1 1272 . 1 1 109 109 ILE H H 1 7.549 0.020 . 1 . . . . A 109 ILE H . 34231 1 1273 . 1 1 109 109 ILE HA H 1 3.802 0.020 . 1 . . . . A 109 ILE HA . 34231 1 1274 . 1 1 109 109 ILE HB H 1 1.679 0.020 . 1 . . . . A 109 ILE HB . 34231 1 1275 . 1 1 109 109 ILE HG12 H 1 0.949 0.020 . 2 . . . . A 109 ILE HG12 . 34231 1 1276 . 1 1 109 109 ILE HG13 H 1 0.949 0.020 . 2 . . . . A 109 ILE HG13 . 34231 1 1277 . 1 1 109 109 ILE HG21 H 1 0.560 0.020 . 1 . . . . A 109 ILE HG21 . 34231 1 1278 . 1 1 109 109 ILE HG22 H 1 0.560 0.020 . 1 . . . . A 109 ILE HG22 . 34231 1 1279 . 1 1 109 109 ILE HG23 H 1 0.560 0.020 . 1 . . . . A 109 ILE HG23 . 34231 1 1280 . 1 1 109 109 ILE HD11 H 1 0.653 0.020 . 1 . . . . A 109 ILE HD11 . 34231 1 1281 . 1 1 109 109 ILE HD12 H 1 0.653 0.020 . 1 . . . . A 109 ILE HD12 . 34231 1 1282 . 1 1 109 109 ILE HD13 H 1 0.653 0.020 . 1 . . . . A 109 ILE HD13 . 34231 1 1283 . 1 1 109 109 ILE C C 13 176.187 0.400 . 1 . . . . A 109 ILE C . 34231 1 1284 . 1 1 109 109 ILE CA C 13 63.871 0.400 . 1 . . . . A 109 ILE CA . 34231 1 1285 . 1 1 109 109 ILE CB C 13 37.988 0.400 . 1 . . . . A 109 ILE CB . 34231 1 1286 . 1 1 109 109 ILE CG1 C 13 28.294 0.400 . 1 . . . . A 109 ILE CG1 . 34231 1 1287 . 1 1 109 109 ILE CG2 C 13 17.363 0.400 . 1 . . . . A 109 ILE CG2 . 34231 1 1288 . 1 1 109 109 ILE CD1 C 13 13.823 0.400 . 1 . . . . A 109 ILE CD1 . 34231 1 1289 . 1 1 109 109 ILE N N 15 119.705 0.400 . 1 . . . . A 109 ILE N . 34231 1 1290 . 1 1 110 110 TRP H H 1 7.685 0.020 . 1 . . . . A 110 TRP H . 34231 1 1291 . 1 1 110 110 TRP HA H 1 4.504 0.020 . 1 . . . . A 110 TRP HA . 34231 1 1292 . 1 1 110 110 TRP HB2 H 1 3.288 0.020 . 2 . . . . A 110 TRP HB2 . 34231 1 1293 . 1 1 110 110 TRP HB3 H 1 3.132 0.020 . 2 . . . . A 110 TRP HB3 . 34231 1 1294 . 1 1 110 110 TRP HD1 H 1 7.150 0.020 . 1 . . . . A 110 TRP HD1 . 34231 1 1295 . 1 1 110 110 TRP HE1 H 1 9.991 0.020 . 1 . . . . A 110 TRP HE1 . 34231 1 1296 . 1 1 110 110 TRP HE3 H 1 7.482 0.020 . 1 . . . . A 110 TRP HE3 . 34231 1 1297 . 1 1 110 110 TRP HZ2 H 1 7.342 0.020 . 1 . . . . A 110 TRP HZ2 . 34231 1 1298 . 1 1 110 110 TRP HZ3 H 1 7.028 0.020 . 1 . . . . A 110 TRP HZ3 . 34231 1 1299 . 1 1 110 110 TRP HH2 H 1 7.083 0.020 . 1 . . . . A 110 TRP HH2 . 34231 1 1300 . 1 1 110 110 TRP C C 13 177.709 0.400 . 1 . . . . A 110 TRP C . 34231 1 1301 . 1 1 110 110 TRP CA C 13 58.474 0.400 . 1 . . . . A 110 TRP CA . 34231 1 1302 . 1 1 110 110 TRP CB C 13 28.877 0.400 . 1 . . . . A 110 TRP CB . 34231 1 1303 . 1 1 110 110 TRP CD1 C 13 127.410 0.400 . 1 . . . . A 110 TRP CD1 . 34231 1 1304 . 1 1 110 110 TRP CE3 C 13 120.693 0.400 . 1 . . . . A 110 TRP CE3 . 34231 1 1305 . 1 1 110 110 TRP CZ2 C 13 114.390 0.400 . 1 . . . . A 110 TRP CZ2 . 34231 1 1306 . 1 1 110 110 TRP CZ3 C 13 121.684 0.400 . 1 . . . . A 110 TRP CZ3 . 34231 1 1307 . 1 1 110 110 TRP CH2 C 13 124.204 0.400 . 1 . . . . A 110 TRP CH2 . 34231 1 1308 . 1 1 110 110 TRP N N 15 119.139 0.400 . 1 . . . . A 110 TRP N . 34231 1 1309 . 1 1 110 110 TRP NE1 N 15 129.025 0.400 . 1 . . . . A 110 TRP NE1 . 34231 1 1310 . 1 1 111 111 ASP H H 1 8.053 0.020 . 1 . . . . A 111 ASP H . 34231 1 1311 . 1 1 111 111 ASP HA H 1 4.445 0.020 . 1 . . . . A 111 ASP HA . 34231 1 1312 . 1 1 111 111 ASP HB2 H 1 2.661 0.020 . 2 . . . . A 111 ASP HB2 . 34231 1 1313 . 1 1 111 111 ASP HB3 H 1 2.614 0.020 . 2 . . . . A 111 ASP HB3 . 34231 1 1314 . 1 1 111 111 ASP C C 13 177.891 0.400 . 1 . . . . A 111 ASP C . 34231 1 1315 . 1 1 111 111 ASP CA C 13 56.537 0.400 . 1 . . . . A 111 ASP CA . 34231 1 1316 . 1 1 111 111 ASP CB C 13 40.321 0.400 . 1 . . . . A 111 ASP CB . 34231 1 1317 . 1 1 111 111 ASP N N 15 119.509 0.400 . 1 . . . . A 111 ASP N . 34231 1 1318 . 1 1 112 112 PHE H H 1 7.769 0.020 . 1 . . . . A 112 PHE H . 34231 1 1319 . 1 1 112 112 PHE HA H 1 4.416 0.020 . 1 . . . . A 112 PHE HA . 34231 1 1320 . 1 1 112 112 PHE HB2 H 1 3.196 0.020 . 2 . . . . A 112 PHE HB2 . 34231 1 1321 . 1 1 112 112 PHE HB3 H 1 3.096 0.020 . 2 . . . . A 112 PHE HB3 . 34231 1 1322 . 1 1 112 112 PHE HD1 H 1 7.215 0.020 . 1 . . . . A 112 PHE HD1 . 34231 1 1323 . 1 1 112 112 PHE HD2 H 1 7.215 0.020 . 1 . . . . A 112 PHE HD2 . 34231 1 1324 . 1 1 112 112 PHE HE1 H 1 7.229 0.020 . 1 . . . . A 112 PHE HE1 . 34231 1 1325 . 1 1 112 112 PHE HE2 H 1 7.229 0.020 . 1 . . . . A 112 PHE HE2 . 34231 1 1326 . 1 1 112 112 PHE HZ H 1 7.224 0.020 . 1 . . . . A 112 PHE HZ . 34231 1 1327 . 1 1 112 112 PHE C C 13 176.554 0.400 . 1 . . . . A 112 PHE C . 34231 1 1328 . 1 1 112 112 PHE CA C 13 59.333 0.400 . 1 . . . . A 112 PHE CA . 34231 1 1329 . 1 1 112 112 PHE CB C 13 39.041 0.400 . 1 . . . . A 112 PHE CB . 34231 1 1330 . 1 1 112 112 PHE CD1 C 13 131.834 0.400 . 3 . . . . A 112 PHE CD1 . 34231 1 1331 . 1 1 112 112 PHE CD2 C 13 131.841 0.400 . 3 . . . . A 112 PHE CD2 . 34231 1 1332 . 1 1 112 112 PHE CE1 C 13 131.150 0.400 . 3 . . . . A 112 PHE CE1 . 34231 1 1333 . 1 1 112 112 PHE CE2 C 13 131.150 0.400 . 3 . . . . A 112 PHE CE2 . 34231 1 1334 . 1 1 112 112 PHE CZ C 13 129.604 0.400 . 1 . . . . A 112 PHE CZ . 34231 1 1335 . 1 1 112 112 PHE N N 15 118.507 0.400 . 1 . . . . A 112 PHE N . 34231 1 1336 . 1 1 113 113 LEU H H 1 7.768 0.020 . 1 . . . . A 113 LEU H . 34231 1 1337 . 1 1 113 113 LEU HA H 1 4.087 0.020 . 1 . . . . A 113 LEU HA . 34231 1 1338 . 1 1 113 113 LEU HB2 H 1 1.750 0.020 . 2 . . . . A 113 LEU HB2 . 34231 1 1339 . 1 1 113 113 LEU HB3 H 1 1.687 0.020 . 2 . . . . A 113 LEU HB3 . 34231 1 1340 . 1 1 113 113 LEU HG H 1 1.521 0.020 . 1 . . . . A 113 LEU HG . 34231 1 1341 . 1 1 113 113 LEU HD11 H 1 0.832 0.020 . 2 . . . . A 113 LEU HD11 . 34231 1 1342 . 1 1 113 113 LEU HD12 H 1 0.832 0.020 . 2 . . . . A 113 LEU HD12 . 34231 1 1343 . 1 1 113 113 LEU HD13 H 1 0.832 0.020 . 2 . . . . A 113 LEU HD13 . 34231 1 1344 . 1 1 113 113 LEU HD21 H 1 0.832 0.020 . 2 . . . . A 113 LEU HD21 . 34231 1 1345 . 1 1 113 113 LEU HD22 H 1 0.832 0.020 . 2 . . . . A 113 LEU HD22 . 34231 1 1346 . 1 1 113 113 LEU HD23 H 1 0.832 0.020 . 2 . . . . A 113 LEU HD23 . 34231 1 1347 . 1 1 113 113 LEU C C 13 177.359 0.400 . 1 . . . . A 113 LEU C . 34231 1 1348 . 1 1 113 113 LEU CA C 13 55.968 0.400 . 1 . . . . A 113 LEU CA . 34231 1 1349 . 1 1 113 113 LEU CB C 13 42.318 0.400 . 1 . . . . A 113 LEU CB . 34231 1 1350 . 1 1 113 113 LEU CG C 13 23.583 0.400 . 1 . . . . A 113 LEU CG . 34231 1 1351 . 1 1 113 113 LEU CD1 C 13 25.953 0.400 . 2 . . . . A 113 LEU CD1 . 34231 1 1352 . 1 1 113 113 LEU N N 15 118.879 0.400 . 1 . . . . A 113 LEU N . 34231 1 1353 . 1 1 114 114 GLU H H 1 7.880 0.020 . 1 . . . . A 114 GLU H . 34231 1 1354 . 1 1 114 114 GLU HA H 1 4.232 0.020 . 1 . . . . A 114 GLU HA . 34231 1 1355 . 1 1 114 114 GLU HB2 H 1 2.091 0.020 . 2 . . . . A 114 GLU HB2 . 34231 1 1356 . 1 1 114 114 GLU HB3 H 1 1.923 0.020 . 2 . . . . A 114 GLU HB3 . 34231 1 1357 . 1 1 114 114 GLU HG2 H 1 2.253 0.020 . 2 . . . . A 114 GLU HG2 . 34231 1 1358 . 1 1 114 114 GLU HG3 H 1 2.179 0.020 . 2 . . . . A 114 GLU HG3 . 34231 1 1359 . 1 1 114 114 GLU C C 13 176.380 0.400 . 1 . . . . A 114 GLU C . 34231 1 1360 . 1 1 114 114 GLU CA C 13 56.551 0.400 . 1 . . . . A 114 GLU CA . 34231 1 1361 . 1 1 114 114 GLU CB C 13 30.274 0.400 . 1 . . . . A 114 GLU CB . 34231 1 1362 . 1 1 114 114 GLU CG C 13 36.331 0.400 . 1 . . . . A 114 GLU CG . 34231 1 1363 . 1 1 114 114 GLU N N 15 118.186 0.400 . 1 . . . . A 114 GLU N . 34231 1 1364 . 1 1 115 115 GLN H H 1 7.838 0.020 . 1 . . . . A 115 GLN H . 34231 1 1365 . 1 1 115 115 GLN HA H 1 4.572 0.020 . 1 . . . . A 115 GLN HA . 34231 1 1366 . 1 1 115 115 GLN HB2 H 1 2.072 0.020 . 2 . . . . A 115 GLN HB2 . 34231 1 1367 . 1 1 115 115 GLN HB3 H 1 1.951 0.020 . 2 . . . . A 115 GLN HB3 . 34231 1 1368 . 1 1 115 115 GLN CA C 13 53.820 0.400 . 1 . . . . A 115 GLN CA . 34231 1 1369 . 1 1 115 115 GLN CB C 13 28.900 0.400 . 1 . . . . A 115 GLN CB . 34231 1 1370 . 1 1 115 115 GLN N N 15 120.591 0.400 . 1 . . . . A 115 GLN N . 34231 1 1371 . 1 1 116 116 PRO HA H 1 4.454 0.020 . 1 . . . . A 116 PRO HA . 34231 1 1372 . 1 1 116 116 PRO HB2 H 1 2.259 0.020 . 2 . . . . A 116 PRO HB2 . 34231 1 1373 . 1 1 116 116 PRO HB3 H 1 2.259 0.020 . 2 . . . . A 116 PRO HB3 . 34231 1 1374 . 1 1 116 116 PRO HG2 H 1 2.009 0.020 . 2 . . . . A 116 PRO HG2 . 34231 1 1375 . 1 1 116 116 PRO HG3 H 1 1.900 0.020 . 2 . . . . A 116 PRO HG3 . 34231 1 1376 . 1 1 116 116 PRO HD2 H 1 3.647 0.020 . 2 . . . . A 116 PRO HD2 . 34231 1 1377 . 1 1 116 116 PRO HD3 H 1 3.771 0.020 . 2 . . . . A 116 PRO HD3 . 34231 1 1378 . 1 1 116 116 PRO C C 13 177.149 0.400 . 1 . . . . A 116 PRO C . 34231 1 1379 . 1 1 116 116 PRO CA C 13 63.212 0.400 . 1 . . . . A 116 PRO CA . 34231 1 1380 . 1 1 116 116 PRO CB C 13 32.011 0.400 . 1 . . . . A 116 PRO CB . 34231 1 1381 . 1 1 116 116 PRO CG C 13 27.499 0.400 . 1 . . . . A 116 PRO CG . 34231 1 1382 . 1 1 116 116 PRO CD C 13 50.589 0.400 . 1 . . . . A 116 PRO CD . 34231 1 1383 . 1 1 117 117 ILE H H 1 8.244 0.020 . 1 . . . . A 117 ILE H . 34231 1 1384 . 1 1 117 117 ILE HA H 1 4.152 0.020 . 1 . . . . A 117 ILE HA . 34231 1 1385 . 1 1 117 117 ILE HB H 1 1.861 0.020 . 1 . . . . A 117 ILE HB . 34231 1 1386 . 1 1 117 117 ILE HG12 H 1 1.504 0.020 . 2 . . . . A 117 ILE HG12 . 34231 1 1387 . 1 1 117 117 ILE HG13 H 1 1.198 0.020 . 2 . . . . A 117 ILE HG13 . 34231 1 1388 . 1 1 117 117 ILE HG21 H 1 0.917 0.020 . 1 . . . . A 117 ILE HG21 . 34231 1 1389 . 1 1 117 117 ILE HG22 H 1 0.917 0.020 . 1 . . . . A 117 ILE HG22 . 34231 1 1390 . 1 1 117 117 ILE HG23 H 1 0.917 0.020 . 1 . . . . A 117 ILE HG23 . 34231 1 1391 . 1 1 117 117 ILE HD11 H 1 0.861 0.020 . 1 . . . . A 117 ILE HD11 . 34231 1 1392 . 1 1 117 117 ILE HD12 H 1 0.861 0.020 . 1 . . . . A 117 ILE HD12 . 34231 1 1393 . 1 1 117 117 ILE HD13 H 1 0.861 0.020 . 1 . . . . A 117 ILE HD13 . 34231 1 1394 . 1 1 117 117 ILE C C 13 176.355 0.400 . 1 . . . . A 117 ILE C . 34231 1 1395 . 1 1 117 117 ILE CA C 13 61.479 0.400 . 1 . . . . A 117 ILE CA . 34231 1 1396 . 1 1 117 117 ILE CB C 13 38.825 0.400 . 1 . . . . A 117 ILE CB . 34231 1 1397 . 1 1 117 117 ILE CG1 C 13 27.598 0.400 . 1 . . . . A 117 ILE CG1 . 34231 1 1398 . 1 1 117 117 ILE CG2 C 13 17.706 0.400 . 1 . . . . A 117 ILE CG2 . 34231 1 1399 . 1 1 117 117 ILE CD1 C 13 13.298 0.400 . 1 . . . . A 117 ILE CD1 . 34231 1 1400 . 1 1 117 117 ILE N N 15 121.002 0.400 . 1 . . . . A 117 ILE N . 34231 1 1401 . 1 1 118 118 SER H H 1 8.274 0.020 . 1 . . . . A 118 SER H . 34231 1 1402 . 1 1 118 118 SER HA H 1 4.491 0.020 . 1 . . . . A 118 SER HA . 34231 1 1403 . 1 1 118 118 SER HB2 H 1 3.894 0.020 . 2 . . . . A 118 SER HB2 . 34231 1 1404 . 1 1 118 118 SER HB3 H 1 3.855 0.020 . 2 . . . . A 118 SER HB3 . 34231 1 1405 . 1 1 118 118 SER C C 13 174.608 0.400 . 1 . . . . A 118 SER C . 34231 1 1406 . 1 1 118 118 SER CA C 13 58.310 0.400 . 1 . . . . A 118 SER CA . 34231 1 1407 . 1 1 118 118 SER CB C 13 63.868 0.400 . 1 . . . . A 118 SER CB . 34231 1 1408 . 1 1 118 118 SER N N 15 118.852 0.400 . 1 . . . . A 118 SER N . 34231 1 1409 . 1 1 119 119 SER H H 1 8.276 0.020 . 1 . . . . A 119 SER H . 34231 1 1410 . 1 1 119 119 SER HA H 1 4.510 0.020 . 1 . . . . A 119 SER HA . 34231 1 1411 . 1 1 119 119 SER HB2 H 1 3.893 0.020 . 2 . . . . A 119 SER HB2 . 34231 1 1412 . 1 1 119 119 SER HB3 H 1 3.893 0.020 . 2 . . . . A 119 SER HB3 . 34231 1 1413 . 1 1 119 119 SER C C 13 174.336 0.400 . 1 . . . . A 119 SER C . 34231 1 1414 . 1 1 119 119 SER CA C 13 58.471 0.400 . 1 . . . . A 119 SER CA . 34231 1 1415 . 1 1 119 119 SER CB C 13 63.989 0.400 . 1 . . . . A 119 SER CB . 34231 1 1416 . 1 1 119 119 SER N N 15 117.808 0.400 . 1 . . . . A 119 SER N . 34231 1 1417 . 1 1 120 120 VAL H H 1 8.026 0.020 . 1 . . . . A 120 VAL H . 34231 1 1418 . 1 1 120 120 VAL HA H 1 4.161 0.020 . 1 . . . . A 120 VAL HA . 34231 1 1419 . 1 1 120 120 VAL HB H 1 2.086 0.020 . 1 . . . . A 120 VAL HB . 34231 1 1420 . 1 1 120 120 VAL HG11 H 1 0.917 0.020 . 2 . . . . A 120 VAL HG11 . 34231 1 1421 . 1 1 120 120 VAL HG12 H 1 0.917 0.020 . 2 . . . . A 120 VAL HG12 . 34231 1 1422 . 1 1 120 120 VAL HG13 H 1 0.917 0.020 . 2 . . . . A 120 VAL HG13 . 34231 1 1423 . 1 1 120 120 VAL HG21 H 1 0.917 0.020 . 2 . . . . A 120 VAL HG21 . 34231 1 1424 . 1 1 120 120 VAL HG22 H 1 0.917 0.020 . 2 . . . . A 120 VAL HG22 . 34231 1 1425 . 1 1 120 120 VAL HG23 H 1 0.917 0.020 . 2 . . . . A 120 VAL HG23 . 34231 1 1426 . 1 1 120 120 VAL C C 13 175.803 0.400 . 1 . . . . A 120 VAL C . 34231 1 1427 . 1 1 120 120 VAL CA C 13 62.240 0.400 . 1 . . . . A 120 VAL CA . 34231 1 1428 . 1 1 120 120 VAL CB C 13 32.684 0.400 . 1 . . . . A 120 VAL CB . 34231 1 1429 . 1 1 120 120 VAL CG1 C 13 20.961 0.400 . 2 . . . . A 120 VAL CG1 . 34231 1 1430 . 1 1 120 120 VAL N N 15 121.017 0.400 . 1 . . . . A 120 VAL N . 34231 1 1431 . 1 1 121 121 GLN H H 1 8.312 0.020 . 1 . . . . A 121 GLN H . 34231 1 1432 . 1 1 121 121 GLN HA H 1 4.653 0.020 . 1 . . . . A 121 GLN HA . 34231 1 1433 . 1 1 121 121 GLN HB2 H 1 2.092 0.020 . 2 . . . . A 121 GLN HB2 . 34231 1 1434 . 1 1 121 121 GLN HB3 H 1 1.954 0.020 . 2 . . . . A 121 GLN HB3 . 34231 1 1435 . 1 1 121 121 GLN CA C 13 53.498 0.400 . 1 . . . . A 121 GLN CA . 34231 1 1436 . 1 1 121 121 GLN CB C 13 29.126 0.400 . 1 . . . . A 121 GLN CB . 34231 1 1437 . 1 1 121 121 GLN N N 15 125.089 0.400 . 1 . . . . A 121 GLN N . 34231 1 1438 . 1 1 122 122 PRO HA H 1 4.481 0.020 . 1 . . . . A 122 PRO HA . 34231 1 1439 . 1 1 122 122 PRO HB2 H 1 2.295 0.020 . 2 . . . . A 122 PRO HB2 . 34231 1 1440 . 1 1 122 122 PRO HB3 H 1 1.996 0.020 . 2 . . . . A 122 PRO HB3 . 34231 1 1441 . 1 1 122 122 PRO HG2 H 1 1.984 0.020 . 2 . . . . A 122 PRO HG2 . 34231 1 1442 . 1 1 122 122 PRO HG3 H 1 1.984 0.020 . 2 . . . . A 122 PRO HG3 . 34231 1 1443 . 1 1 122 122 PRO HD2 H 1 3.809 0.020 . 2 . . . . A 122 PRO HD2 . 34231 1 1444 . 1 1 122 122 PRO HD3 H 1 3.685 0.020 . 2 . . . . A 122 PRO HD3 . 34231 1 1445 . 1 1 122 122 PRO C C 13 176.726 0.400 . 1 . . . . A 122 PRO C . 34231 1 1446 . 1 1 122 122 PRO CA C 13 63.136 0.400 . 1 . . . . A 122 PRO CA . 34231 1 1447 . 1 1 122 122 PRO CB C 13 32.210 0.400 . 1 . . . . A 122 PRO CB . 34231 1 1448 . 1 1 122 122 PRO CG C 13 27.481 0.400 . 1 . . . . A 122 PRO CG . 34231 1 1449 . 1 1 122 122 PRO CD C 13 50.787 0.400 . 1 . . . . A 122 PRO CD . 34231 1 1450 . 1 1 123 123 ILE H H 1 8.178 0.020 . 1 . . . . A 123 ILE H . 34231 1 1451 . 1 1 123 123 ILE HA H 1 4.213 0.020 . 1 . . . . A 123 ILE HA . 34231 1 1452 . 1 1 123 123 ILE HB H 1 1.896 0.020 . 1 . . . . A 123 ILE HB . 34231 1 1453 . 1 1 123 123 ILE HG12 H 1 1.479 0.020 . 2 . . . . A 123 ILE HG12 . 34231 1 1454 . 1 1 123 123 ILE HG13 H 1 1.175 0.020 . 2 . . . . A 123 ILE HG13 . 34231 1 1455 . 1 1 123 123 ILE HG21 H 1 0.930 0.020 . 1 . . . . A 123 ILE HG21 . 34231 1 1456 . 1 1 123 123 ILE HG22 H 1 0.930 0.020 . 1 . . . . A 123 ILE HG22 . 34231 1 1457 . 1 1 123 123 ILE HG23 H 1 0.930 0.020 . 1 . . . . A 123 ILE HG23 . 34231 1 1458 . 1 1 123 123 ILE HD11 H 1 0.863 0.020 . 1 . . . . A 123 ILE HD11 . 34231 1 1459 . 1 1 123 123 ILE HD12 H 1 0.863 0.020 . 1 . . . . A 123 ILE HD12 . 34231 1 1460 . 1 1 123 123 ILE HD13 H 1 0.863 0.020 . 1 . . . . A 123 ILE HD13 . 34231 1 1461 . 1 1 123 123 ILE C C 13 175.103 0.400 . 1 . . . . A 123 ILE C . 34231 1 1462 . 1 1 123 123 ILE CA C 13 61.231 0.400 . 1 . . . . A 123 ILE CA . 34231 1 1463 . 1 1 123 123 ILE CB C 13 39.229 0.400 . 1 . . . . A 123 ILE CB . 34231 1 1464 . 1 1 123 123 ILE CG1 C 13 27.127 0.400 . 1 . . . . A 123 ILE CG1 . 34231 1 1465 . 1 1 123 123 ILE CG2 C 13 17.812 0.400 . 1 . . . . A 123 ILE CG2 . 34231 1 1466 . 1 1 123 123 ILE CD1 C 13 13.433 0.400 . 1 . . . . A 123 ILE CD1 . 34231 1 1467 . 1 1 123 123 ILE N N 15 120.218 0.400 . 1 . . . . A 123 ILE N . 34231 1 1468 . 1 1 124 124 ASP H H 1 7.888 0.020 . 1 . . . . A 124 ASP H . 34231 1 1469 . 1 1 124 124 ASP CA C 13 55.764 0.400 . 1 . . . . A 124 ASP CA . 34231 1 1470 . 1 1 124 124 ASP CB C 13 42.422 0.400 . 1 . . . . A 124 ASP CB . 34231 1 1471 . 1 1 124 124 ASP N N 15 128.969 0.400 . 1 . . . . A 124 ASP N . 34231 1 stop_ save_