data_7366 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 7366 _Entry.Title ; Solution Structure of Putative periplasmic protein: Northest Structural Genomics Target StR106 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2007-01-19 _Entry.Accession_date 2007-01-23 _Entry.Last_release_date 2009-10-09 _Entry.Original_release_date 2009-10-09 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.8.59 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Q. Zhang Q. . . 7366 2 G. Liu G. . . 7366 3 H. Wang H. . . 7366 4 C. Nwosu C. . . 7366 5 K. Cunningham K. . . 7366 6 L. Ma L. C. . 7366 7 R. Xiao R. . . 7366 8 J. Liu J. . . 7366 9 M. Baran M. C. . 7366 10 G. Swapna G. V.T. . 7366 11 B. Thomas B. A. . 7366 12 B. Rost B. . . 7366 13 G. Montelione G. T. . 7366 14 T. Szypersk T. . . 7366 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'PSI, Protein Structure Initiative' 'Northeast Structural Genomics Consortium' NESG 7366 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'GFT NMR' 'GFT NMR' 7366 NESG NESG 7366 'Northeast Structural Genomics Consortium' 'Northeast Structural Genomics Consortium' 7366 'Protein Structure Initiative' 'Protein Structure Initiative' 7366 PSI-2 PSI-2 7366 StR106 StR106 7366 'Structural Genomics' 'Structural Genomics' 7366 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 7366 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 261 7366 '15N chemical shifts' 77 7366 '1H chemical shifts' 536 7366 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 . . 2009-10-09 2007-01-19 original author . 7366 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2NOC 'BMRB Entry Tracking System' 7366 stop_ save_ ############### # Citations # ############### save_citations _Citation.Sf_category citations _Citation.Sf_framecode citations _Citation.Entry_ID 7366 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title 'Solution Structure of Putative periplasmic protein: Northest Structural Genomics Target StR106' _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev 'To be Published' _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD 0353 _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Q. Zhang Q. . . 7366 1 2 G. Liu G. . . 7366 1 3 H. Wang H. . . 7366 1 4 C. Nwosu C. . . 7366 1 5 K. Cunningham K. . . 7366 1 6 L. Ma L. C. . 7366 1 7 R. Xiao R. . . 7366 1 8 J. Liu J. . . 7366 1 9 M. Baran M. C. . 7366 1 10 G. Swapna G. V.T. . 7366 1 11 B. Thomas B. A. . 7366 1 12 G. Montelione G. T. . 7366 1 13 T. Szypersk T. . . 7366 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 7366 _Assembly.ID 1 _Assembly.Name 'Periplasmic protein' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _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 'Periplasmic protein' 1 $Putative_periplasmic_protein A . yes native no no . . . 7366 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Putative_periplasmic_protein _Entity.Sf_category entity _Entity.Sf_framecode Putative_periplasmic_protein _Entity.Entry_ID 7366 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Putative_periplasmic_protein _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 ; MKTGYKVMLGALAFVVTNVY AAEIMKKTDFDKVASEYTKI GTISTTGEMSPLDAREDLIK KADEKGADVVVLTSGQTENK IHGTADIYKKKLEHHHHHH ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 99 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-28 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 19327 . StR106 . . . . . 78.79 78 100.00 100.00 4.76e-47 . . . . 7366 1 2 no PDB 2MA4 . "Solution Nmr Structure Of Yaho Protein From Salmonella Typhimurium, Northeast Structural Genomics Consortium (nesg) Target Str1" . . . . . 78.79 78 100.00 100.00 4.76e-47 . . . . 7366 1 3 no PDB 2NOC . "Solution Structure Of Putative Periplasmic Protein: Northest Structural Genomics Target Str106" . . . . . 100.00 99 100.00 100.00 2.68e-63 . . . . 7366 1 4 no DBJ BAJ35371 . "hypothetical protein STMDT12_C04280 [Salmonella enterica subsp. enterica serovar Typhimurium str. T000240]" . . . . . 91.92 91 100.00 100.00 1.41e-56 . . . . 7366 1 5 no DBJ BAP06126 . "probable secreted protein [Salmonella enterica subsp. enterica serovar Typhimurium str. L-3553]" . . . . . 91.92 91 100.00 100.00 1.41e-56 . . . . 7366 1 6 no EMBL CAC12674 . "yahO [Salmonella typhimurium]" . . . . . 67.68 67 100.00 100.00 1.12e-38 . . . . 7366 1 7 no EMBL CAD08821 . "probable secreted protein [Salmonella enterica subsp. enterica serovar Typhi str. CT18]" . . . . . 91.92 91 100.00 100.00 1.41e-56 . . . . 7366 1 8 no EMBL CAR31935 . "probable secreted protein [Salmonella enterica subsp. enterica serovar Enteritidis str. P125109]" . . . . . 91.92 91 100.00 100.00 1.41e-56 . . . . 7366 1 9 no EMBL CAR36277 . "probable secreted protein [Salmonella enterica subsp. enterica serovar Gallinarum str. 287/91]" . . . . . 91.92 91 100.00 100.00 1.41e-56 . . . . 7366 1 10 no EMBL CAR60410 . "probable secreted protein [Salmonella enterica subsp. enterica serovar Paratyphi A str. AKU_12601]" . . . . . 91.92 91 100.00 100.00 1.41e-56 . . . . 7366 1 11 no GB AAL19320 . "putative periplasmic protein [Salmonella enterica subsp. enterica serovar Typhimurium str. LT2]" . . . . . 91.92 91 100.00 100.00 1.41e-56 . . . . 7366 1 12 no GB AAO70086 . "probable secreted protein [Salmonella enterica subsp. enterica serovar Typhi str. Ty2]" . . . . . 91.92 91 100.00 100.00 1.41e-56 . . . . 7366 1 13 no GB AAV78241 . "probable secreted protein [Salmonella enterica subsp. enterica serovar Paratyphi A str. ATCC 9150]" . . . . . 91.92 91 100.00 100.00 1.41e-56 . . . . 7366 1 14 no GB AAX64313 . "putative periplasmic protein [Salmonella enterica subsp. enterica serovar Choleraesuis str. SC-B67]" . . . . . 91.92 91 100.00 100.00 1.41e-56 . . . . 7366 1 15 no GB ABX68592 . "hypothetical protein SPAB_03231 [Salmonella enterica subsp. enterica serovar Paratyphi B str. SPB7]" . . . . . 91.92 91 100.00 100.00 1.41e-56 . . . . 7366 1 16 no PIR AE0547 . "probable secreted protein [imported] - Salmonella enterica subsp. enterica serovar Typhi (strain CT18)" . . . . . 91.92 91 100.00 100.00 1.41e-56 . . . . 7366 1 17 no REF NP_454961 . "hypothetical protein STY0398 [Salmonella enterica subsp. enterica serovar Typhi str. CT18]" . . . . . 91.92 91 100.00 100.00 1.41e-56 . . . . 7366 1 18 no REF NP_459361 . "periplasmic protein [Salmonella enterica subsp. enterica serovar Typhimurium str. LT2]" . . . . . 91.92 91 100.00 100.00 1.41e-56 . . . . 7366 1 19 no REF NP_806226 . "hypothetical protein t2498 [Salmonella enterica subsp. enterica serovar Typhi str. Ty2]" . . . . . 91.92 91 100.00 100.00 1.41e-56 . . . . 7366 1 20 no REF WP_000848022 . "hypothetical protein [Salmonella enterica]" . . . . . 91.92 91 97.80 100.00 6.16e-56 . . . . 7366 1 21 no REF WP_000848024 . "hypothetical protein [Salmonella enterica]" . . . . . 91.92 91 97.80 98.90 1.73e-55 . . . . 7366 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'Complete proteome' SWS-KEYWORD 7366 1 'Putative periplasmic protein' RCSB_NAME 7366 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 7366 1 2 . LYS . 7366 1 3 . THR . 7366 1 4 . GLY . 7366 1 5 . TYR . 7366 1 6 . LYS . 7366 1 7 . VAL . 7366 1 8 . MET . 7366 1 9 . LEU . 7366 1 10 . GLY . 7366 1 11 . ALA . 7366 1 12 . LEU . 7366 1 13 . ALA . 7366 1 14 . PHE . 7366 1 15 . VAL . 7366 1 16 . VAL . 7366 1 17 . THR . 7366 1 18 . ASN . 7366 1 19 . VAL . 7366 1 20 . TYR . 7366 1 21 . ALA . 7366 1 22 . ALA . 7366 1 23 . GLU . 7366 1 24 . ILE . 7366 1 25 . MET . 7366 1 26 . LYS . 7366 1 27 . LYS . 7366 1 28 . THR . 7366 1 29 . ASP . 7366 1 30 . PHE . 7366 1 31 . ASP . 7366 1 32 . LYS . 7366 1 33 . VAL . 7366 1 34 . ALA . 7366 1 35 . SER . 7366 1 36 . GLU . 7366 1 37 . TYR . 7366 1 38 . THR . 7366 1 39 . LYS . 7366 1 40 . ILE . 7366 1 41 . GLY . 7366 1 42 . THR . 7366 1 43 . ILE . 7366 1 44 . SER . 7366 1 45 . THR . 7366 1 46 . THR . 7366 1 47 . GLY . 7366 1 48 . GLU . 7366 1 49 . MET . 7366 1 50 . SER . 7366 1 51 . PRO . 7366 1 52 . LEU . 7366 1 53 . ASP . 7366 1 54 . ALA . 7366 1 55 . ARG . 7366 1 56 . GLU . 7366 1 57 . ASP . 7366 1 58 . LEU . 7366 1 59 . ILE . 7366 1 60 . LYS . 7366 1 61 . LYS . 7366 1 62 . ALA . 7366 1 63 . ASP . 7366 1 64 . GLU . 7366 1 65 . LYS . 7366 1 66 . GLY . 7366 1 67 . ALA . 7366 1 68 . ASP . 7366 1 69 . VAL . 7366 1 70 . VAL . 7366 1 71 . VAL . 7366 1 72 . LEU . 7366 1 73 . THR . 7366 1 74 . SER . 7366 1 75 . GLY . 7366 1 76 . GLN . 7366 1 77 . THR . 7366 1 78 . GLU . 7366 1 79 . ASN . 7366 1 80 . LYS . 7366 1 81 . ILE . 7366 1 82 . HIS . 7366 1 83 . GLY . 7366 1 84 . THR . 7366 1 85 . ALA . 7366 1 86 . ASP . 7366 1 87 . ILE . 7366 1 88 . TYR . 7366 1 89 . LYS . 7366 1 90 . LYS . 7366 1 91 . LYS . 7366 1 92 . LEU . 7366 1 93 . GLU . 7366 1 94 . HIS . 7366 1 95 . HIS . 7366 1 96 . HIS . 7366 1 97 . HIS . 7366 1 98 . HIS . 7366 1 99 . HIS . 7366 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 7366 1 . LYS 2 2 7366 1 . THR 3 3 7366 1 . GLY 4 4 7366 1 . TYR 5 5 7366 1 . LYS 6 6 7366 1 . VAL 7 7 7366 1 . MET 8 8 7366 1 . LEU 9 9 7366 1 . GLY 10 10 7366 1 . ALA 11 11 7366 1 . LEU 12 12 7366 1 . ALA 13 13 7366 1 . PHE 14 14 7366 1 . VAL 15 15 7366 1 . VAL 16 16 7366 1 . THR 17 17 7366 1 . ASN 18 18 7366 1 . VAL 19 19 7366 1 . TYR 20 20 7366 1 . ALA 21 21 7366 1 . ALA 22 22 7366 1 . GLU 23 23 7366 1 . ILE 24 24 7366 1 . MET 25 25 7366 1 . LYS 26 26 7366 1 . LYS 27 27 7366 1 . THR 28 28 7366 1 . ASP 29 29 7366 1 . PHE 30 30 7366 1 . ASP 31 31 7366 1 . LYS 32 32 7366 1 . VAL 33 33 7366 1 . ALA 34 34 7366 1 . SER 35 35 7366 1 . GLU 36 36 7366 1 . TYR 37 37 7366 1 . THR 38 38 7366 1 . LYS 39 39 7366 1 . ILE 40 40 7366 1 . GLY 41 41 7366 1 . THR 42 42 7366 1 . ILE 43 43 7366 1 . SER 44 44 7366 1 . THR 45 45 7366 1 . THR 46 46 7366 1 . GLY 47 47 7366 1 . GLU 48 48 7366 1 . MET 49 49 7366 1 . SER 50 50 7366 1 . PRO 51 51 7366 1 . LEU 52 52 7366 1 . ASP 53 53 7366 1 . ALA 54 54 7366 1 . ARG 55 55 7366 1 . GLU 56 56 7366 1 . ASP 57 57 7366 1 . LEU 58 58 7366 1 . ILE 59 59 7366 1 . LYS 60 60 7366 1 . LYS 61 61 7366 1 . ALA 62 62 7366 1 . ASP 63 63 7366 1 . GLU 64 64 7366 1 . LYS 65 65 7366 1 . GLY 66 66 7366 1 . ALA 67 67 7366 1 . ASP 68 68 7366 1 . VAL 69 69 7366 1 . VAL 70 70 7366 1 . VAL 71 71 7366 1 . LEU 72 72 7366 1 . THR 73 73 7366 1 . SER 74 74 7366 1 . GLY 75 75 7366 1 . GLN 76 76 7366 1 . THR 77 77 7366 1 . GLU 78 78 7366 1 . ASN 79 79 7366 1 . LYS 80 80 7366 1 . ILE 81 81 7366 1 . HIS 82 82 7366 1 . GLY 83 83 7366 1 . THR 84 84 7366 1 . ALA 85 85 7366 1 . ASP 86 86 7366 1 . ILE 87 87 7366 1 . TYR 88 88 7366 1 . LYS 89 89 7366 1 . LYS 90 90 7366 1 . LYS 91 91 7366 1 . LEU 92 92 7366 1 . GLU 93 93 7366 1 . HIS 94 94 7366 1 . HIS 95 95 7366 1 . HIS 96 96 7366 1 . HIS 97 97 7366 1 . HIS 98 98 7366 1 . HIS 99 99 7366 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 7366 _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.Subvariant _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.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $Putative_periplasmic_protein . 591 organism . 'Salmonella choleraesuis' 'Salmonella choleraesuis' . . . Bacteria Salmonella Salmonella choleraesuis . . . . . . . . . . . . . . . yahO . . . . 7366 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 7366 _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_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _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.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $Putative_periplasmic_protein . 'recombinant technology' . . . . . . . . . . . . . . . . . . . . GG . . . . . . . . 7366 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample _Sample.Sf_category sample _Sample.Sf_framecode sample _Sample.Entry_ID 7366 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details '1.1 mM protein, 10mM Tris, 100mM NaCl, 0.02% NaN3, 90% H2O, 10% D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O, 10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Periplasmic protein' . . . 1 $Putative_periplasmic_protein . . 1.1 . . mM . . . . 7366 1 2 Tris . . . . . . . 10 . . mM . . . . 7366 1 3 NaCl . . . . . . . 100 . . mM . . . . 7366 1 4 NaN3 . . . . . . . 0.02 . . % . . . . 7366 1 5 D2O . . . . . . . 10 . . % . . . . 7366 1 6 H2O 'natural abundance' . . . . . . 90 . . % . . . . 7366 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 7366 _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 pH 4.5 . pH 7366 1 pressure 1 . atm 7366 1 temperature 298 . K 7366 1 stop_ save_ ############################ # Computer software used # ############################ save_DYANA _Software.Sf_category software _Software.Sf_framecode DYANA _Software.Entry_ID 7366 _Software.ID 1 _Software.Name DYANA _Software.Version 1.5 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, P. et al.' . . 7366 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 7366 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 7366 _Software.ID 2 _Software.Name NMRPipe _Software.Version 2.3 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, F. et al.' . . 7366 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 7366 2 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 7366 _Software.ID 3 _Software.Name CYANA _Software.Version 2.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, P. et al.' . . 7366 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 7366 3 stop_ save_ save_CNS _Software.Sf_category software _Software.Sf_framecode CNS _Software.Entry_ID 7366 _Software.ID 4 _Software.Name CNS _Software.Version 1.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Brunger, A.T. et al.' . . 7366 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 7366 4 stop_ save_ save_Xeasy _Software.Sf_category software _Software.Sf_framecode Xeasy _Software.Entry_ID 7366 _Software.ID 5 _Software.Name XEASY _Software.Version 1.3 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bartels, C., Xia, T.H.' . . 7366 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 7366 5 stop_ save_ save_Autostructure _Software.Sf_category software _Software.Sf_framecode Autostructure _Software.Entry_ID 7366 _Software.ID 6 _Software.Name AutoStruct _Software.Version 2.0.0 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Huang, Y.J.' . . 7366 6 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 7366 6 stop_ save_ save_UBNMR _Software.Sf_category software _Software.Sf_framecode UBNMR _Software.Entry_ID 7366 _Software.ID 7 _Software.Name UBNMR _Software.Version 1.0 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Shen, Y.' . . 7366 7 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 7366 7 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 7366 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 750 save_ save_750 _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode 750 _NMR_spectrometer_list.Entry_ID 7366 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Varian INOVA . 750 . . . 7366 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 7366 _Experiment_list.ID 1 _Experiment_list.Details 'This structure was determined using GFT techniques' 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 'GFT (4,3)D HNNCABCA' no . . . . . . . . . . 1 $sample isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 7366 1 2 'GFT (4,3)D CABCA(CO)NHN' no . . . . . . . . . . 1 $sample isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 7366 1 3 'GFT (4,3)D HABCAB(CO)NHN' no . . . . . . . . . . 1 $sample isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 7366 1 4 'GFT (4,3)D HCCH' no . . . . . . . . . . 1 $sample isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 7366 1 5 'SIMULTANEOUS HETERONUCLEAR RESOLVED [1H,1H]-NOESY' no . . . . . . . . . . 1 $sample isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 7366 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 7366 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 7366 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 'GFT (4,3)D HNNCABCA' . . . 7366 1 2 'GFT (4,3)D CABCA(CO)NHN' . . . 7366 1 3 'GFT (4,3)D HABCAB(CO)NHN' . . . 7366 1 4 'GFT (4,3)D HCCH' . . . 7366 1 5 'SIMULTANEOUS HETERONUCLEAR RESOLVED [1H,1H]-NOESY' . . . 7366 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 22 22 ALA HA H 1 4.13 . . 1 . . . . 22 ALA HA . 7366 1 2 . 1 1 22 22 ALA HB1 H 1 1.18 . . 1 . . . . 22 ALA HB . 7366 1 3 . 1 1 22 22 ALA HB2 H 1 1.18 . . 1 . . . . 22 ALA HB . 7366 1 4 . 1 1 22 22 ALA HB3 H 1 1.18 . . 1 . . . . 22 ALA HB . 7366 1 5 . 1 1 22 22 ALA CA C 13 50.9 . . 1 . . . . 22 ALA CA . 7366 1 6 . 1 1 22 22 ALA CB C 13 20.2 . . 1 . . . . 22 ALA CB . 7366 1 7 . 1 1 23 23 GLU H H 1 7.92 . . 1 . . . . 23 GLU H . 7366 1 8 . 1 1 23 23 GLU HA H 1 4.71 . . 1 . . . . 23 GLU HA . 7366 1 9 . 1 1 23 23 GLU HB2 H 1 1.98 . . 2 . . . . 23 GLU HB2 . 7366 1 10 . 1 1 23 23 GLU HB3 H 1 2.05 . . 2 . . . . 23 GLU HB3 . 7366 1 11 . 1 1 23 23 GLU HG2 H 1 2.26 . . 2 . . . . 23 GLU HG2 . 7366 1 12 . 1 1 23 23 GLU HG3 H 1 2.26 . . 2 . . . . 23 GLU HG3 . 7366 1 13 . 1 1 23 23 GLU CA C 13 54.3 . . 1 . . . . 23 GLU CA . 7366 1 14 . 1 1 23 23 GLU CB C 13 32.5 . . 1 . . . . 23 GLU CB . 7366 1 15 . 1 1 23 23 GLU CG C 13 35.0 . . 1 . . . . 23 GLU CG . 7366 1 16 . 1 1 23 23 GLU N N 15 117.6 . . 1 . . . . 23 GLU N . 7366 1 17 . 1 1 24 24 ILE H H 1 8.87 . . 1 . . . . 24 ILE H . 7366 1 18 . 1 1 24 24 ILE HA H 1 4.87 . . 1 . . . . 24 ILE HA . 7366 1 19 . 1 1 24 24 ILE HB H 1 1.68 . . 1 . . . . 24 ILE HB . 7366 1 20 . 1 1 24 24 ILE HD11 H 1 0.78 . . 1 . . . . 24 ILE HD1 . 7366 1 21 . 1 1 24 24 ILE HD12 H 1 0.78 . . 1 . . . . 24 ILE HD1 . 7366 1 22 . 1 1 24 24 ILE HD13 H 1 0.78 . . 1 . . . . 24 ILE HD1 . 7366 1 23 . 1 1 24 24 ILE HG12 H 1 1.52 . . 2 . . . . 24 ILE HG12 . 7366 1 24 . 1 1 24 24 ILE HG13 H 1 0.77 . . 2 . . . . 24 ILE HG13 . 7366 1 25 . 1 1 24 24 ILE HG21 H 1 0.85 . . 1 . . . . 24 ILE HG2 . 7366 1 26 . 1 1 24 24 ILE HG22 H 1 0.85 . . 1 . . . . 24 ILE HG2 . 7366 1 27 . 1 1 24 24 ILE HG23 H 1 0.85 . . 1 . . . . 24 ILE HG2 . 7366 1 28 . 1 1 24 24 ILE CA C 13 60.2 . . 1 . . . . 24 ILE CA . 7366 1 29 . 1 1 24 24 ILE CB C 13 38.1 . . 1 . . . . 24 ILE CB . 7366 1 30 . 1 1 24 24 ILE CD1 C 13 17.3 . . 1 . . . . 24 ILE CD1 . 7366 1 31 . 1 1 24 24 ILE CG1 C 13 28.0 . . 1 . . . . 24 ILE CG1 . 7366 1 32 . 1 1 24 24 ILE CG2 C 13 13.2 . . 1 . . . . 24 ILE CG2 . 7366 1 33 . 1 1 24 24 ILE N N 15 123.8 . . 1 . . . . 24 ILE N . 7366 1 34 . 1 1 25 25 MET H H 1 8.72 . . 1 . . . . 25 MET H . 7366 1 35 . 1 1 25 25 MET HA H 1 4.76 . . 1 . . . . 25 MET HA . 7366 1 36 . 1 1 25 25 MET HB2 H 1 1.91 . . 2 . . . . 25 MET HB2 . 7366 1 37 . 1 1 25 25 MET HB3 H 1 1.56 . . 2 . . . . 25 MET HB3 . 7366 1 38 . 1 1 25 25 MET HG2 H 1 2.62 . . 2 . . . . 25 MET HG2 . 7366 1 39 . 1 1 25 25 MET HG3 H 1 2.43 . . 2 . . . . 25 MET HG3 . 7366 1 40 . 1 1 25 25 MET CA C 13 54.3 . . 1 . . . . 25 MET CA . 7366 1 41 . 1 1 25 25 MET CB C 13 37.1 . . 1 . . . . 25 MET CB . 7366 1 42 . 1 1 25 25 MET CG C 13 32.5 . . 1 . . . . 25 MET CG . 7366 1 43 . 1 1 25 25 MET N N 15 127.1 . . 1 . . . . 25 MET N . 7366 1 44 . 1 1 26 26 LYS H H 1 9.19 . . 1 . . . . 26 LYS H . 7366 1 45 . 1 1 26 26 LYS HA H 1 4.32 . . 1 . . . . 26 LYS HA . 7366 1 46 . 1 1 26 26 LYS HB2 H 1 2.02 . . 2 . . . . 26 LYS HB2 . 7366 1 47 . 1 1 26 26 LYS HB3 H 1 1.82 . . 2 . . . . 26 LYS HB3 . 7366 1 48 . 1 1 26 26 LYS HD2 H 1 1.75 . . 2 . . . . 26 LYS HD2 . 7366 1 49 . 1 1 26 26 LYS HD3 H 1 1.75 . . 2 . . . . 26 LYS HD3 . 7366 1 50 . 1 1 26 26 LYS HE2 H 1 3.01 . . 2 . . . . 26 LYS HE2 . 7366 1 51 . 1 1 26 26 LYS HE3 H 1 3.01 . . 2 . . . . 26 LYS HE3 . 7366 1 52 . 1 1 26 26 LYS HG2 H 1 1.59 . . 2 . . . . 26 LYS HG2 . 7366 1 53 . 1 1 26 26 LYS HG3 H 1 1.64 . . 2 . . . . 26 LYS HG3 . 7366 1 54 . 1 1 26 26 LYS CA C 13 56.6 . . 1 . . . . 26 LYS CA . 7366 1 55 . 1 1 26 26 LYS CB C 13 32.9 . . 1 . . . . 26 LYS CB . 7366 1 56 . 1 1 26 26 LYS CD C 13 29.3 . . 1 . . . . 26 LYS CD . 7366 1 57 . 1 1 26 26 LYS CE C 13 41.9 . . 1 . . . . 26 LYS CE . 7366 1 58 . 1 1 26 26 LYS CG C 13 25.3 . . 1 . . . . 26 LYS CG . 7366 1 59 . 1 1 26 26 LYS N N 15 123.5 . . 1 . . . . 26 LYS N . 7366 1 60 . 1 1 27 27 LYS H H 1 8.87 . . 1 . . . . 27 LYS H . 7366 1 61 . 1 1 27 27 LYS HA H 1 3.86 . . 1 . . . . 27 LYS HA . 7366 1 62 . 1 1 27 27 LYS HB2 H 1 1.97 . . 2 . . . . 27 LYS HB2 . 7366 1 63 . 1 1 27 27 LYS HB3 H 1 1.97 . . 2 . . . . 27 LYS HB3 . 7366 1 64 . 1 1 27 27 LYS HD2 H 1 1.63 . . 2 . . . . 27 LYS HD2 . 7366 1 65 . 1 1 27 27 LYS HD3 H 1 1.63 . . 2 . . . . 27 LYS HD3 . 7366 1 66 . 1 1 27 27 LYS HE2 H 1 3.08 . . 2 . . . . 27 LYS HE2 . 7366 1 67 . 1 1 27 27 LYS HE3 H 1 3.08 . . 2 . . . . 27 LYS HE3 . 7366 1 68 . 1 1 27 27 LYS HG2 H 1 1.52 . . 2 . . . . 27 LYS HG2 . 7366 1 69 . 1 1 27 27 LYS HG3 H 1 1.48 . . 2 . . . . 27 LYS HG3 . 7366 1 70 . 1 1 27 27 LYS CA C 13 60.5 . . 1 . . . . 27 LYS CA . 7366 1 71 . 1 1 27 27 LYS CB C 13 32.4 . . 1 . . . . 27 LYS CB . 7366 1 72 . 1 1 27 27 LYS CD C 13 28.8 . . 1 . . . . 27 LYS CD . 7366 1 73 . 1 1 27 27 LYS CE C 13 42.0 . . 1 . . . . 27 LYS CE . 7366 1 74 . 1 1 27 27 LYS CG C 13 24.8 . . 1 . . . . 27 LYS CG . 7366 1 75 . 1 1 27 27 LYS N N 15 126.2 . . 1 . . . . 27 LYS N . 7366 1 76 . 1 1 28 28 THR H H 1 8.11 . . 1 . . . . 28 THR H . 7366 1 77 . 1 1 28 28 THR HA H 1 4.13 . . 1 . . . . 28 THR HA . 7366 1 78 . 1 1 28 28 THR HB H 1 4.17 . . 1 . . . . 28 THR HB . 7366 1 79 . 1 1 28 28 THR HG21 H 1 1.30 . . 1 . . . . 28 THR HG2 . 7366 1 80 . 1 1 28 28 THR HG22 H 1 1.30 . . 1 . . . . 28 THR HG2 . 7366 1 81 . 1 1 28 28 THR HG23 H 1 1.30 . . 1 . . . . 28 THR HG2 . 7366 1 82 . 1 1 28 28 THR CA C 13 64.6 . . 1 . . . . 28 THR CA . 7366 1 83 . 1 1 28 28 THR CB C 13 68.0 . . 1 . . . . 28 THR CB . 7366 1 84 . 1 1 28 28 THR CG2 C 13 22.1 . . 1 . . . . 28 THR CG2 . 7366 1 85 . 1 1 28 28 THR N N 15 107.1 . . 1 . . . . 28 THR N . 7366 1 86 . 1 1 29 29 ASP H H 1 6.77 . . 1 . . . . 29 ASP H . 7366 1 87 . 1 1 29 29 ASP HA H 1 4.58 . . 1 . . . . 29 ASP HA . 7366 1 88 . 1 1 29 29 ASP HB2 H 1 2.72 . . 2 . . . . 29 ASP HB2 . 7366 1 89 . 1 1 29 29 ASP HB3 H 1 2.72 . . 2 . . . . 29 ASP HB3 . 7366 1 90 . 1 1 29 29 ASP CA C 13 56.6 . . 1 . . . . 29 ASP CA . 7366 1 91 . 1 1 29 29 ASP CB C 13 40.6 . . 1 . . . . 29 ASP CB . 7366 1 92 . 1 1 29 29 ASP N N 15 119.5 . . 1 . . . . 29 ASP N . 7366 1 93 . 1 1 30 30 PHE H H 1 8.63 . . 1 . . . . 30 PHE H . 7366 1 94 . 1 1 30 30 PHE HA H 1 3.93 . . 1 . . . . 30 PHE HA . 7366 1 95 . 1 1 30 30 PHE HB2 H 1 2.66 . . 2 . . . . 30 PHE HB2 . 7366 1 96 . 1 1 30 30 PHE HB3 H 1 2.77 . . 2 . . . . 30 PHE HB3 . 7366 1 97 . 1 1 30 30 PHE HD1 H 1 6.73 . . 3 . . . . 30 PHE HD1 . 7366 1 98 . 1 1 30 30 PHE HD2 H 1 6.73 . . 3 . . . . 30 PHE HD2 . 7366 1 99 . 1 1 30 30 PHE HE1 H 1 6.73 . . 3 . . . . 30 PHE HE1 . 7366 1 100 . 1 1 30 30 PHE HE2 H 1 6.73 . . 3 . . . . 30 PHE HE2 . 7366 1 101 . 1 1 30 30 PHE HZ H 1 6.81 . . 1 . . . . 30 PHE HZ . 7366 1 102 . 1 1 30 30 PHE CA C 13 60.8 . . 1 . . . . 30 PHE CA . 7366 1 103 . 1 1 30 30 PHE CB C 13 38.9 . . 1 . . . . 30 PHE CB . 7366 1 104 . 1 1 30 30 PHE CD1 C 13 130.1 . . 1 . . . . 30 PHE CD1 . 7366 1 105 . 1 1 30 30 PHE CE1 C 13 130.1 . . 1 . . . . 30 PHE CE1 . 7366 1 106 . 1 1 30 30 PHE CZ C 13 128.2 . . 1 . . . . 30 PHE CZ . 7366 1 107 . 1 1 30 30 PHE N N 15 123.3 . . 1 . . . . 30 PHE N . 7366 1 108 . 1 1 31 31 ASP H H 1 8.65 . . 1 . . . . 31 ASP H . 7366 1 109 . 1 1 31 31 ASP HA H 1 4.15 . . 1 . . . . 31 ASP HA . 7366 1 110 . 1 1 31 31 ASP HB2 H 1 2.59 . . 2 . . . . 31 ASP HB2 . 7366 1 111 . 1 1 31 31 ASP HB3 H 1 2.59 . . 2 . . . . 31 ASP HB3 . 7366 1 112 . 1 1 31 31 ASP CA C 13 57.0 . . 1 . . . . 31 ASP CA . 7366 1 113 . 1 1 31 31 ASP CB C 13 39.8 . . 1 . . . . 31 ASP CB . 7366 1 114 . 1 1 31 31 ASP N N 15 117.0 . . 1 . . . . 31 ASP N . 7366 1 115 . 1 1 32 32 LYS H H 1 6.93 . . 1 . . . . 32 LYS H . 7366 1 116 . 1 1 32 32 LYS HA H 1 4.11 . . 1 . . . . 32 LYS HA . 7366 1 117 . 1 1 32 32 LYS HB2 H 1 1.91 . . 2 . . . . 32 LYS HB2 . 7366 1 118 . 1 1 32 32 LYS HB3 H 1 1.98 . . 2 . . . . 32 LYS HB3 . 7366 1 119 . 1 1 32 32 LYS HD2 H 1 1.75 . . 2 . . . . 32 LYS HD2 . 7366 1 120 . 1 1 32 32 LYS HD3 H 1 1.73 . . 2 . . . . 32 LYS HD3 . 7366 1 121 . 1 1 32 32 LYS HE2 H 1 3.03 . . 2 . . . . 32 LYS HE2 . 7366 1 122 . 1 1 32 32 LYS HE3 H 1 3.03 . . 2 . . . . 32 LYS HE3 . 7366 1 123 . 1 1 32 32 LYS HG2 H 1 1.51 . . 2 . . . . 32 LYS HG2 . 7366 1 124 . 1 1 32 32 LYS HG3 H 1 1.51 . . 2 . . . . 32 LYS HG3 . 7366 1 125 . 1 1 32 32 LYS CA C 13 58.3 . . 1 . . . . 32 LYS CA . 7366 1 126 . 1 1 32 32 LYS CB C 13 33.1 . . 1 . . . . 32 LYS CB . 7366 1 127 . 1 1 32 32 LYS CD C 13 29.3 . . 1 . . . . 32 LYS CD . 7366 1 128 . 1 1 32 32 LYS CE C 13 41.8 . . 1 . . . . 32 LYS CE . 7366 1 129 . 1 1 32 32 LYS CG C 13 25.2 . . 1 . . . . 32 LYS CG . 7366 1 130 . 1 1 32 32 LYS N N 15 114.8 . . 1 . . . . 32 LYS N . 7366 1 131 . 1 1 33 33 VAL H H 1 7.40 . . 1 . . . . 33 VAL H . 7366 1 132 . 1 1 33 33 VAL HA H 1 4.62 . . 1 . . . . 33 VAL HA . 7366 1 133 . 1 1 33 33 VAL HB H 1 2.64 . . 1 . . . . 33 VAL HB . 7366 1 134 . 1 1 33 33 VAL HG11 H 1 0.82 . . 2 . . . . 33 VAL HG1 . 7366 1 135 . 1 1 33 33 VAL HG12 H 1 0.82 . . 2 . . . . 33 VAL HG1 . 7366 1 136 . 1 1 33 33 VAL HG13 H 1 0.82 . . 2 . . . . 33 VAL HG1 . 7366 1 137 . 1 1 33 33 VAL HG21 H 1 0.68 . . 2 . . . . 33 VAL HG2 . 7366 1 138 . 1 1 33 33 VAL HG22 H 1 0.68 . . 2 . . . . 33 VAL HG2 . 7366 1 139 . 1 1 33 33 VAL HG23 H 1 0.68 . . 2 . . . . 33 VAL HG2 . 7366 1 140 . 1 1 33 33 VAL CA C 13 60.1 . . 1 . . . . 33 VAL CA . 7366 1 141 . 1 1 33 33 VAL CB C 13 32.3 . . 1 . . . . 33 VAL CB . 7366 1 142 . 1 1 33 33 VAL CG1 C 13 21.0 . . 1 . . . . 33 VAL CG1 . 7366 1 143 . 1 1 33 33 VAL CG2 C 13 19.0 . . 1 . . . . 33 VAL CG2 . 7366 1 144 . 1 1 33 33 VAL N N 15 109.1 . . 1 . . . . 33 VAL N . 7366 1 145 . 1 1 34 34 ALA H H 1 6.71 . . 1 . . . . 34 ALA H . 7366 1 146 . 1 1 34 34 ALA HA H 1 3.01 . . 1 . . . . 34 ALA HA . 7366 1 147 . 1 1 34 34 ALA HB1 H 1 1.04 . . 1 . . . . 34 ALA HB . 7366 1 148 . 1 1 34 34 ALA HB2 H 1 1.04 . . 1 . . . . 34 ALA HB . 7366 1 149 . 1 1 34 34 ALA HB3 H 1 1.04 . . 1 . . . . 34 ALA HB . 7366 1 150 . 1 1 34 34 ALA CA C 13 55.1 . . 1 . . . . 34 ALA CA . 7366 1 151 . 1 1 34 34 ALA CB C 13 19.2 . . 1 . . . . 34 ALA CB . 7366 1 152 . 1 1 34 34 ALA N N 15 124.3 . . 1 . . . . 34 ALA N . 7366 1 153 . 1 1 35 35 SER H H 1 8.12 . . 1 . . . . 35 SER H . 7366 1 154 . 1 1 35 35 SER HA H 1 4.32 . . 1 . . . . 35 SER HA . 7366 1 155 . 1 1 35 35 SER HB2 H 1 4.00 . . 2 . . . . 35 SER HB2 . 7366 1 156 . 1 1 35 35 SER HB3 H 1 3.88 . . 2 . . . . 35 SER HB3 . 7366 1 157 . 1 1 35 35 SER CA C 13 60.4 . . 1 . . . . 35 SER CA . 7366 1 158 . 1 1 35 35 SER CB C 13 62.4 . . 1 . . . . 35 SER CB . 7366 1 159 . 1 1 35 35 SER N N 15 110.4 . . 1 . . . . 35 SER N . 7366 1 160 . 1 1 36 36 GLU H H 1 8.30 . . 1 . . . . 36 GLU H . 7366 1 161 . 1 1 36 36 GLU HA H 1 4.27 . . 1 . . . . 36 GLU HA . 7366 1 162 . 1 1 36 36 GLU HB2 H 1 1.97 . . 2 . . . . 36 GLU HB2 . 7366 1 163 . 1 1 36 36 GLU HB3 H 1 2.02 . . 2 . . . . 36 GLU HB3 . 7366 1 164 . 1 1 36 36 GLU HG2 H 1 2.27 . . 2 . . . . 36 GLU HG2 . 7366 1 165 . 1 1 36 36 GLU HG3 H 1 2.17 . . 2 . . . . 36 GLU HG3 . 7366 1 166 . 1 1 36 36 GLU CA C 13 55.7 . . 1 . . . . 36 GLU CA . 7366 1 167 . 1 1 36 36 GLU CB C 13 28.9 . . 1 . . . . 36 GLU CB . 7366 1 168 . 1 1 36 36 GLU CG C 13 35.1 . . 1 . . . . 36 GLU CG . 7366 1 169 . 1 1 36 36 GLU N N 15 119.2 . . 1 . . . . 36 GLU N . 7366 1 170 . 1 1 37 37 TYR H H 1 7.92 . . 1 . . . . 37 TYR H . 7366 1 171 . 1 1 37 37 TYR HA H 1 5.15 . . 1 . . . . 37 TYR HA . 7366 1 172 . 1 1 37 37 TYR HB2 H 1 2.88 . . 2 . . . . 37 TYR HB2 . 7366 1 173 . 1 1 37 37 TYR HB3 H 1 3.14 . . 2 . . . . 37 TYR HB3 . 7366 1 174 . 1 1 37 37 TYR HD1 H 1 6.90 . . 3 . . . . 37 TYR HD1 . 7366 1 175 . 1 1 37 37 TYR HD2 H 1 6.90 . . 3 . . . . 37 TYR HD2 . 7366 1 176 . 1 1 37 37 TYR HE1 H 1 6.62 . . 3 . . . . 37 TYR HE1 . 7366 1 177 . 1 1 37 37 TYR HE2 H 1 6.62 . . 3 . . . . 37 TYR HE2 . 7366 1 178 . 1 1 37 37 TYR CA C 13 57.9 . . 1 . . . . 37 TYR CA . 7366 1 179 . 1 1 37 37 TYR CB C 13 44.1 . . 1 . . . . 37 TYR CB . 7366 1 180 . 1 1 37 37 TYR CD1 C 13 132.3 . . 1 . . . . 37 TYR CD1 . 7366 1 181 . 1 1 37 37 TYR CE1 C 13 117.7 . . 1 . . . . 37 TYR CE1 . 7366 1 182 . 1 1 37 37 TYR N N 15 117.2 . . 1 . . . . 37 TYR N . 7366 1 183 . 1 1 38 38 THR H H 1 9.48 . . 1 . . . . 38 THR H . 7366 1 184 . 1 1 38 38 THR HA H 1 4.84 . . 1 . . . . 38 THR HA . 7366 1 185 . 1 1 38 38 THR HB H 1 3.96 . . 1 . . . . 38 THR HB . 7366 1 186 . 1 1 38 38 THR HG21 H 1 1.26 . . 1 . . . . 38 THR HG2 . 7366 1 187 . 1 1 38 38 THR HG22 H 1 1.26 . . 1 . . . . 38 THR HG2 . 7366 1 188 . 1 1 38 38 THR HG23 H 1 1.26 . . 1 . . . . 38 THR HG2 . 7366 1 189 . 1 1 38 38 THR CA C 13 60.4 . . 1 . . . . 38 THR CA . 7366 1 190 . 1 1 38 38 THR CB C 13 71.2 . . 1 . . . . 38 THR CB . 7366 1 191 . 1 1 38 38 THR CG2 C 13 21.0 . . 1 . . . . 38 THR CG2 . 7366 1 192 . 1 1 38 38 THR N N 15 115.4 . . 1 . . . . 38 THR N . 7366 1 193 . 1 1 39 39 LYS H H 1 9.29 . . 1 . . . . 39 LYS H . 7366 1 194 . 1 1 39 39 LYS HA H 1 3.88 . . 1 . . . . 39 LYS HA . 7366 1 195 . 1 1 39 39 LYS HB2 H 1 1.69 . . 2 . . . . 39 LYS HB2 . 7366 1 196 . 1 1 39 39 LYS HB3 H 1 1.84 . . 2 . . . . 39 LYS HB3 . 7366 1 197 . 1 1 39 39 LYS HD2 H 1 1.50 . . 2 . . . . 39 LYS HD2 . 7366 1 198 . 1 1 39 39 LYS HD3 H 1 1.50 . . 2 . . . . 39 LYS HD3 . 7366 1 199 . 1 1 39 39 LYS HE2 H 1 2.69 . . 2 . . . . 39 LYS HE2 . 7366 1 200 . 1 1 39 39 LYS HE3 H 1 2.69 . . 2 . . . . 39 LYS HE3 . 7366 1 201 . 1 1 39 39 LYS HG2 H 1 1.06 . . 2 . . . . 39 LYS HG2 . 7366 1 202 . 1 1 39 39 LYS HG3 H 1 0.79 . . 2 . . . . 39 LYS HG3 . 7366 1 203 . 1 1 39 39 LYS CA C 13 57.5 . . 1 . . . . 39 LYS CA . 7366 1 204 . 1 1 39 39 LYS CB C 13 32.3 . . 1 . . . . 39 LYS CB . 7366 1 205 . 1 1 39 39 LYS CD C 13 29.5 . . 1 . . . . 39 LYS CD . 7366 1 206 . 1 1 39 39 LYS CE C 13 41.8 . . 1 . . . . 39 LYS CE . 7366 1 207 . 1 1 39 39 LYS CG C 13 25.4 . . 1 . . . . 39 LYS CG . 7366 1 208 . 1 1 39 39 LYS N N 15 130.4 . . 1 . . . . 39 LYS N . 7366 1 209 . 1 1 40 40 ILE H H 1 8.82 . . 1 . . . . 40 ILE H . 7366 1 210 . 1 1 40 40 ILE HA H 1 4.55 . . 1 . . . . 40 ILE HA . 7366 1 211 . 1 1 40 40 ILE HB H 1 1.95 . . 1 . . . . 40 ILE HB . 7366 1 212 . 1 1 40 40 ILE HD11 H 1 0.75 . . 1 . . . . 40 ILE HD1 . 7366 1 213 . 1 1 40 40 ILE HD12 H 1 0.75 . . 1 . . . . 40 ILE HD1 . 7366 1 214 . 1 1 40 40 ILE HD13 H 1 0.75 . . 1 . . . . 40 ILE HD1 . 7366 1 215 . 1 1 40 40 ILE HG12 H 1 0.77 . . 2 . . . . 40 ILE HG12 . 7366 1 216 . 1 1 40 40 ILE HG13 H 1 1.14 . . 2 . . . . 40 ILE HG13 . 7366 1 217 . 1 1 40 40 ILE HG21 H 1 0.92 . . 1 . . . . 40 ILE HG2 . 7366 1 218 . 1 1 40 40 ILE HG22 H 1 0.92 . . 1 . . . . 40 ILE HG2 . 7366 1 219 . 1 1 40 40 ILE HG23 H 1 0.92 . . 1 . . . . 40 ILE HG2 . 7366 1 220 . 1 1 40 40 ILE CA C 13 60.9 . . 1 . . . . 40 ILE CA . 7366 1 221 . 1 1 40 40 ILE CB C 13 39.2 . . 1 . . . . 40 ILE CB . 7366 1 222 . 1 1 40 40 ILE CD1 C 13 14.5 . . 1 . . . . 40 ILE CD1 . 7366 1 223 . 1 1 40 40 ILE CG1 C 13 26.6 . . 1 . . . . 40 ILE CG1 . 7366 1 224 . 1 1 40 40 ILE CG2 C 13 17.8 . . 1 . . . . 40 ILE CG2 . 7366 1 225 . 1 1 40 40 ILE N N 15 121.9 . . 1 . . . . 40 ILE N . 7366 1 226 . 1 1 41 41 GLY H H 1 7.13 . . 1 . . . . 41 GLY H . 7366 1 227 . 1 1 41 41 GLY HA2 H 1 3.95 . . 2 . . . . 41 GLY HA2 . 7366 1 228 . 1 1 41 41 GLY HA3 H 1 4.26 . . 2 . . . . 41 GLY HA3 . 7366 1 229 . 1 1 41 41 GLY CA C 13 45.1 . . 1 . . . . 41 GLY CA . 7366 1 230 . 1 1 41 41 GLY N N 15 107.4 . . 1 . . . . 41 GLY N . 7366 1 231 . 1 1 42 42 THR H H 1 8.21 . . 1 . . . . 42 THR H . 7366 1 232 . 1 1 42 42 THR HA H 1 5.23 . . 1 . . . . 42 THR HA . 7366 1 233 . 1 1 42 42 THR HB H 1 3.90 . . 1 . . . . 42 THR HB . 7366 1 234 . 1 1 42 42 THR HG21 H 1 1.21 . . 1 . . . . 42 THR HG2 . 7366 1 235 . 1 1 42 42 THR HG22 H 1 1.21 . . 1 . . . . 42 THR HG2 . 7366 1 236 . 1 1 42 42 THR HG23 H 1 1.21 . . 1 . . . . 42 THR HG2 . 7366 1 237 . 1 1 42 42 THR CA C 13 60.9 . . 1 . . . . 42 THR CA . 7366 1 238 . 1 1 42 42 THR CB C 13 72.3 . . 1 . . . . 42 THR CB . 7366 1 239 . 1 1 42 42 THR CG2 C 13 21.0 . . 1 . . . . 42 THR CG2 . 7366 1 240 . 1 1 42 42 THR N N 15 115.1 . . 1 . . . . 42 THR N . 7366 1 241 . 1 1 43 43 ILE H H 1 9.13 . . 1 . . . . 43 ILE H . 7366 1 242 . 1 1 43 43 ILE HA H 1 4.79 . . 1 . . . . 43 ILE HA . 7366 1 243 . 1 1 43 43 ILE HB H 1 1.77 . . 1 . . . . 43 ILE HB . 7366 1 244 . 1 1 43 43 ILE HD11 H 1 0.70 . . 1 . . . . 43 ILE HD1 . 7366 1 245 . 1 1 43 43 ILE HD12 H 1 0.70 . . 1 . . . . 43 ILE HD1 . 7366 1 246 . 1 1 43 43 ILE HD13 H 1 0.70 . . 1 . . . . 43 ILE HD1 . 7366 1 247 . 1 1 43 43 ILE HG12 H 1 1.25 . . 2 . . . . 43 ILE HG12 . 7366 1 248 . 1 1 43 43 ILE HG13 H 1 0.85 . . 2 . . . . 43 ILE HG13 . 7366 1 249 . 1 1 43 43 ILE HG21 H 1 0.76 . . 1 . . . . 43 ILE HG2 . 7366 1 250 . 1 1 43 43 ILE HG22 H 1 0.76 . . 1 . . . . 43 ILE HG2 . 7366 1 251 . 1 1 43 43 ILE HG23 H 1 0.76 . . 1 . . . . 43 ILE HG2 . 7366 1 252 . 1 1 43 43 ILE CA C 13 59.4 . . 1 . . . . 43 ILE CA . 7366 1 253 . 1 1 43 43 ILE CB C 13 42.6 . . 1 . . . . 43 ILE CB . 7366 1 254 . 1 1 43 43 ILE CD1 C 13 16.4 . . 1 . . . . 43 ILE CD1 . 7366 1 255 . 1 1 43 43 ILE CG1 C 13 25.2 . . 1 . . . . 43 ILE CG1 . 7366 1 256 . 1 1 43 43 ILE CG2 C 13 18.0 . . 1 . . . . 43 ILE CG2 . 7366 1 257 . 1 1 43 43 ILE N N 15 118.0 . . 1 . . . . 43 ILE N . 7366 1 258 . 1 1 44 44 SER H H 1 8.33 . . 1 . . . . 44 SER H . 7366 1 259 . 1 1 44 44 SER HA H 1 5.25 . . 1 . . . . 44 SER HA . 7366 1 260 . 1 1 44 44 SER HB2 H 1 3.75 . . 2 . . . . 44 SER HB2 . 7366 1 261 . 1 1 44 44 SER HB3 H 1 3.68 . . 2 . . . . 44 SER HB3 . 7366 1 262 . 1 1 44 44 SER CA C 13 56.7 . . 1 . . . . 44 SER CA . 7366 1 263 . 1 1 44 44 SER CB C 13 66.0 . . 1 . . . . 44 SER CB . 7366 1 264 . 1 1 44 44 SER N N 15 113.3 . . 1 . . . . 44 SER N . 7366 1 265 . 1 1 45 45 THR H H 1 8.38 . . 1 . . . . 45 THR H . 7366 1 266 . 1 1 45 45 THR HA H 1 4.55 . . 1 . . . . 45 THR HA . 7366 1 267 . 1 1 45 45 THR HB H 1 4.30 . . 1 . . . . 45 THR HB . 7366 1 268 . 1 1 45 45 THR HG21 H 1 1.23 . . 1 . . . . 45 THR HG2 . 7366 1 269 . 1 1 45 45 THR HG22 H 1 1.23 . . 1 . . . . 45 THR HG2 . 7366 1 270 . 1 1 45 45 THR HG23 H 1 1.23 . . 1 . . . . 45 THR HG2 . 7366 1 271 . 1 1 45 45 THR CA C 13 60.9 . . 1 . . . . 45 THR CA . 7366 1 272 . 1 1 45 45 THR CB C 13 70.0 . . 1 . . . . 45 THR CB . 7366 1 273 . 1 1 45 45 THR CG2 C 13 21.6 . . 1 . . . . 45 THR CG2 . 7366 1 274 . 1 1 45 45 THR N N 15 113.3 . . 1 . . . . 45 THR N . 7366 1 275 . 1 1 46 46 THR H H 1 8.54 . . 1 . . . . 46 THR H . 7366 1 276 . 1 1 46 46 THR HA H 1 4.40 . . 1 . . . . 46 THR HA . 7366 1 277 . 1 1 46 46 THR HB H 1 4.16 . . 1 . . . . 46 THR HB . 7366 1 278 . 1 1 46 46 THR HG21 H 1 1.19 . . 1 . . . . 46 THR HG2 . 7366 1 279 . 1 1 46 46 THR HG22 H 1 1.19 . . 1 . . . . 46 THR HG2 . 7366 1 280 . 1 1 46 46 THR HG23 H 1 1.19 . . 1 . . . . 46 THR HG2 . 7366 1 281 . 1 1 46 46 THR CA C 13 62.0 . . 1 . . . . 46 THR CA . 7366 1 282 . 1 1 46 46 THR CB C 13 69.3 . . 1 . . . . 46 THR CB . 7366 1 283 . 1 1 46 46 THR CG2 C 13 21.1 . . 1 . . . . 46 THR CG2 . 7366 1 284 . 1 1 46 46 THR N N 15 117.7 . . 1 . . . . 46 THR N . 7366 1 285 . 1 1 47 47 GLY H H 1 8.32 . . 1 . . . . 47 GLY H . 7366 1 286 . 1 1 47 47 GLY HA2 H 1 3.89 . . 2 . . . . 47 GLY HA2 . 7366 1 287 . 1 1 47 47 GLY HA3 H 1 3.98 . . 2 . . . . 47 GLY HA3 . 7366 1 288 . 1 1 47 47 GLY CA C 13 44.8 . . 1 . . . . 47 GLY CA . 7366 1 289 . 1 1 47 47 GLY N N 15 111.7 . . 1 . . . . 47 GLY N . 7366 1 290 . 1 1 48 48 GLU H H 1 8.43 . . 1 . . . . 48 GLU H . 7366 1 291 . 1 1 48 48 GLU HA H 1 4.39 . . 1 . . . . 48 GLU HA . 7366 1 292 . 1 1 48 48 GLU HB2 H 1 1.86 . . 2 . . . . 48 GLU HB2 . 7366 1 293 . 1 1 48 48 GLU HB3 H 1 1.86 . . 2 . . . . 48 GLU HB3 . 7366 1 294 . 1 1 48 48 GLU HG2 H 1 2.12 . . 2 . . . . 48 GLU HG2 . 7366 1 295 . 1 1 48 48 GLU HG3 H 1 2.18 . . 2 . . . . 48 GLU HG3 . 7366 1 296 . 1 1 48 48 GLU CA C 13 55.6 . . 1 . . . . 48 GLU CA . 7366 1 297 . 1 1 48 48 GLU CB C 13 29.4 . . 1 . . . . 48 GLU CB . 7366 1 298 . 1 1 48 48 GLU CG C 13 35.3 . . 1 . . . . 48 GLU CG . 7366 1 299 . 1 1 48 48 GLU N N 15 120.1 . . 1 . . . . 48 GLU N . 7366 1 300 . 1 1 49 49 MET H H 1 8.39 . . 1 . . . . 49 MET H . 7366 1 301 . 1 1 49 49 MET HA H 1 4.70 . . 1 . . . . 49 MET HA . 7366 1 302 . 1 1 49 49 MET HB2 H 1 2.26 . . 2 . . . . 49 MET HB2 . 7366 1 303 . 1 1 49 49 MET HB3 H 1 1.91 . . 2 . . . . 49 MET HB3 . 7366 1 304 . 1 1 49 49 MET HG2 H 1 2.52 . . 2 . . . . 49 MET HG2 . 7366 1 305 . 1 1 49 49 MET HG3 H 1 2.52 . . 2 . . . . 49 MET HG3 . 7366 1 306 . 1 1 49 49 MET CA C 13 55.0 . . 1 . . . . 49 MET CA . 7366 1 307 . 1 1 49 49 MET CB C 13 35.9 . . 1 . . . . 49 MET CB . 7366 1 308 . 1 1 49 49 MET CG C 13 32.0 . . 1 . . . . 49 MET CG . 7366 1 309 . 1 1 49 49 MET N N 15 120.0 . . 1 . . . . 49 MET N . 7366 1 310 . 1 1 50 50 SER H H 1 9.02 . . 1 . . . . 50 SER H . 7366 1 311 . 1 1 50 50 SER HA H 1 4.78 . . 1 . . . . 50 SER HA . 7366 1 312 . 1 1 50 50 SER HB2 H 1 4.26 . . 2 . . . . 50 SER HB2 . 7366 1 313 . 1 1 50 50 SER HB3 H 1 4.05 . . 2 . . . . 50 SER HB3 . 7366 1 314 . 1 1 50 50 SER CA C 13 57.7 . . 1 . . . . 50 SER CA . 7366 1 315 . 1 1 50 50 SER CB C 13 62.6 . . 1 . . . . 50 SER CB . 7366 1 316 . 1 1 50 50 SER N N 15 117.9 . . 1 . . . . 50 SER N . 7366 1 317 . 1 1 51 51 PRO HA H 1 4.24 . . 1 . . . . 51 PRO HA . 7366 1 318 . 1 1 51 51 PRO HB2 H 1 1.98 . . 2 . . . . 51 PRO HB2 . 7366 1 319 . 1 1 51 51 PRO HB3 H 1 2.40 . . 2 . . . . 51 PRO HB3 . 7366 1 320 . 1 1 51 51 PRO HD2 H 1 3.91 . . 2 . . . . 51 PRO HD2 . 7366 1 321 . 1 1 51 51 PRO HD3 H 1 3.87 . . 2 . . . . 51 PRO HD3 . 7366 1 322 . 1 1 51 51 PRO HG2 H 1 2.20 . . 2 . . . . 51 PRO HG2 . 7366 1 323 . 1 1 51 51 PRO HG3 H 1 2.01 . . 2 . . . . 51 PRO HG3 . 7366 1 324 . 1 1 51 51 PRO CA C 13 66.0 . . 1 . . . . 51 PRO CA . 7366 1 325 . 1 1 51 51 PRO CB C 13 31.8 . . 1 . . . . 51 PRO CB . 7366 1 326 . 1 1 51 51 PRO CD C 13 49.7 . . 1 . . . . 51 PRO CD . 7366 1 327 . 1 1 51 51 PRO CG C 13 28.0 . . 1 . . . . 51 PRO CG . 7366 1 328 . 1 1 52 52 LEU H H 1 8.16 . . 1 . . . . 52 LEU H . 7366 1 329 . 1 1 52 52 LEU HA H 1 4.11 . . 1 . . . . 52 LEU HA . 7366 1 330 . 1 1 52 52 LEU HB2 H 1 1.67 . . 2 . . . . 52 LEU HB2 . 7366 1 331 . 1 1 52 52 LEU HB3 H 1 1.57 . . 2 . . . . 52 LEU HB3 . 7366 1 332 . 1 1 52 52 LEU HD11 H 1 0.94 . . 2 . . . . 52 LEU HD1 . 7366 1 333 . 1 1 52 52 LEU HD12 H 1 0.94 . . 2 . . . . 52 LEU HD1 . 7366 1 334 . 1 1 52 52 LEU HD13 H 1 0.94 . . 2 . . . . 52 LEU HD1 . 7366 1 335 . 1 1 52 52 LEU HD21 H 1 0.88 . . 2 . . . . 52 LEU HD2 . 7366 1 336 . 1 1 52 52 LEU HD22 H 1 0.88 . . 2 . . . . 52 LEU HD2 . 7366 1 337 . 1 1 52 52 LEU HD23 H 1 0.88 . . 2 . . . . 52 LEU HD2 . 7366 1 338 . 1 1 52 52 LEU HG H 1 1.66 . . 1 . . . . 52 LEU HG . 7366 1 339 . 1 1 52 52 LEU CA C 13 57.9 . . 1 . . . . 52 LEU CA . 7366 1 340 . 1 1 52 52 LEU CB C 13 41.4 . . 1 . . . . 52 LEU CB . 7366 1 341 . 1 1 52 52 LEU CD1 C 13 24.4 . . 1 . . . . 52 LEU CD1 . 7366 1 342 . 1 1 52 52 LEU CD2 C 13 24.0 . . 1 . . . . 52 LEU CD2 . 7366 1 343 . 1 1 52 52 LEU CG C 13 27.1 . . 1 . . . . 52 LEU CG . 7366 1 344 . 1 1 52 52 LEU N N 15 117.6 . . 1 . . . . 52 LEU N . 7366 1 345 . 1 1 53 53 ASP H H 1 7.51 . . 1 . . . . 53 ASP H . 7366 1 346 . 1 1 53 53 ASP HA H 1 4.42 . . 1 . . . . 53 ASP HA . 7366 1 347 . 1 1 53 53 ASP HB2 H 1 2.77 . . 2 . . . . 53 ASP HB2 . 7366 1 348 . 1 1 53 53 ASP HB3 H 1 2.77 . . 2 . . . . 53 ASP HB3 . 7366 1 349 . 1 1 53 53 ASP CA C 13 56.6 . . 1 . . . . 53 ASP CA . 7366 1 350 . 1 1 53 53 ASP CB C 13 39.8 . . 1 . . . . 53 ASP CB . 7366 1 351 . 1 1 53 53 ASP N N 15 119.9 . . 1 . . . . 53 ASP N . 7366 1 352 . 1 1 54 54 ALA H H 1 8.80 . . 1 . . . . 54 ALA H . 7366 1 353 . 1 1 54 54 ALA HA H 1 4.21 . . 1 . . . . 54 ALA HA . 7366 1 354 . 1 1 54 54 ALA HB1 H 1 1.38 . . 1 . . . . 54 ALA HB . 7366 1 355 . 1 1 54 54 ALA HB2 H 1 1.38 . . 1 . . . . 54 ALA HB . 7366 1 356 . 1 1 54 54 ALA HB3 H 1 1.38 . . 1 . . . . 54 ALA HB . 7366 1 357 . 1 1 54 54 ALA CA C 13 54.7 . . 1 . . . . 54 ALA CA . 7366 1 358 . 1 1 54 54 ALA CB C 13 18.2 . . 1 . . . . 54 ALA CB . 7366 1 359 . 1 1 54 54 ALA N N 15 123.4 . . 1 . . . . 54 ALA N . 7366 1 360 . 1 1 55 55 ARG H H 1 7.86 . . 1 . . . . 55 ARG H . 7366 1 361 . 1 1 55 55 ARG HA H 1 3.73 . . 1 . . . . 55 ARG HA . 7366 1 362 . 1 1 55 55 ARG HB2 H 1 1.92 . . 2 . . . . 55 ARG HB2 . 7366 1 363 . 1 1 55 55 ARG HB3 H 1 1.97 . . 2 . . . . 55 ARG HB3 . 7366 1 364 . 1 1 55 55 ARG HD2 H 1 3.25 . . 2 . . . . 55 ARG HD2 . 7366 1 365 . 1 1 55 55 ARG HD3 H 1 3.20 . . 2 . . . . 55 ARG HD3 . 7366 1 366 . 1 1 55 55 ARG HG2 H 1 1.80 . . 2 . . . . 55 ARG HG2 . 7366 1 367 . 1 1 55 55 ARG HG3 H 1 1.46 . . 2 . . . . 55 ARG HG3 . 7366 1 368 . 1 1 55 55 ARG CA C 13 60.2 . . 1 . . . . 55 ARG CA . 7366 1 369 . 1 1 55 55 ARG CB C 13 30.1 . . 1 . . . . 55 ARG CB . 7366 1 370 . 1 1 55 55 ARG CD C 13 43.6 . . 1 . . . . 55 ARG CD . 7366 1 371 . 1 1 55 55 ARG CG C 13 28.3 . . 1 . . . . 55 ARG CG . 7366 1 372 . 1 1 55 55 ARG N N 15 117.1 . . 1 . . . . 55 ARG N . 7366 1 373 . 1 1 56 56 GLU H H 1 7.63 . . 1 . . . . 56 GLU H . 7366 1 374 . 1 1 56 56 GLU HA H 1 4.00 . . 1 . . . . 56 GLU HA . 7366 1 375 . 1 1 56 56 GLU HB2 H 1 2.14 . . 2 . . . . 56 GLU HB2 . 7366 1 376 . 1 1 56 56 GLU HB3 H 1 2.14 . . 2 . . . . 56 GLU HB3 . 7366 1 377 . 1 1 56 56 GLU HG2 H 1 2.53 . . 2 . . . . 56 GLU HG2 . 7366 1 378 . 1 1 56 56 GLU HG3 H 1 2.42 . . 2 . . . . 56 GLU HG3 . 7366 1 379 . 1 1 56 56 GLU CA C 13 58.8 . . 1 . . . . 56 GLU CA . 7366 1 380 . 1 1 56 56 GLU CB C 13 28.3 . . 1 . . . . 56 GLU CB . 7366 1 381 . 1 1 56 56 GLU CG C 13 34.9 . . 1 . . . . 56 GLU CG . 7366 1 382 . 1 1 56 56 GLU N N 15 115.9 . . 1 . . . . 56 GLU N . 7366 1 383 . 1 1 57 57 ASP H H 1 8.12 . . 1 . . . . 57 ASP H . 7366 1 384 . 1 1 57 57 ASP HA H 1 4.38 . . 1 . . . . 57 ASP HA . 7366 1 385 . 1 1 57 57 ASP HB2 H 1 2.78 . . 2 . . . . 57 ASP HB2 . 7366 1 386 . 1 1 57 57 ASP HB3 H 1 2.69 . . 2 . . . . 57 ASP HB3 . 7366 1 387 . 1 1 57 57 ASP CA C 13 57.4 . . 1 . . . . 57 ASP CA . 7366 1 388 . 1 1 57 57 ASP CB C 13 42.5 . . 1 . . . . 57 ASP CB . 7366 1 389 . 1 1 57 57 ASP N N 15 120.2 . . 1 . . . . 57 ASP N . 7366 1 390 . 1 1 58 58 LEU H H 1 8.16 . . 1 . . . . 58 LEU H . 7366 1 391 . 1 1 58 58 LEU HA H 1 3.86 . . 1 . . . . 58 LEU HA . 7366 1 392 . 1 1 58 58 LEU HB2 H 1 1.91 . . 2 . . . . 58 LEU HB2 . 7366 1 393 . 1 1 58 58 LEU HB3 H 1 1.08 . . 2 . . . . 58 LEU HB3 . 7366 1 394 . 1 1 58 58 LEU HD11 H 1 0.58 . . 2 . . . . 58 LEU HD1 . 7366 1 395 . 1 1 58 58 LEU HD12 H 1 0.58 . . 2 . . . . 58 LEU HD1 . 7366 1 396 . 1 1 58 58 LEU HD13 H 1 0.58 . . 2 . . . . 58 LEU HD1 . 7366 1 397 . 1 1 58 58 LEU HD21 H 1 0.53 . . 2 . . . . 58 LEU HD2 . 7366 1 398 . 1 1 58 58 LEU HD22 H 1 0.53 . . 2 . . . . 58 LEU HD2 . 7366 1 399 . 1 1 58 58 LEU HD23 H 1 0.53 . . 2 . . . . 58 LEU HD2 . 7366 1 400 . 1 1 58 58 LEU HG H 1 1.80 . . 1 . . . . 58 LEU HG . 7366 1 401 . 1 1 58 58 LEU CA C 13 57.5 . . 1 . . . . 58 LEU CA . 7366 1 402 . 1 1 58 58 LEU CB C 13 41.4 . . 1 . . . . 58 LEU CB . 7366 1 403 . 1 1 58 58 LEU CD1 C 13 25.9 . . 1 . . . . 58 LEU CD1 . 7366 1 404 . 1 1 58 58 LEU CD2 C 13 22.4 . . 1 . . . . 58 LEU CD2 . 7366 1 405 . 1 1 58 58 LEU CG C 13 26.2 . . 1 . . . . 58 LEU CG . 7366 1 406 . 1 1 58 58 LEU N N 15 117.3 . . 1 . . . . 58 LEU N . 7366 1 407 . 1 1 59 59 ILE H H 1 8.02 . . 1 . . . . 59 ILE H . 7366 1 408 . 1 1 59 59 ILE HA H 1 3.30 . . 1 . . . . 59 ILE HA . 7366 1 409 . 1 1 59 59 ILE HB H 1 1.87 . . 1 . . . . 59 ILE HB . 7366 1 410 . 1 1 59 59 ILE HD11 H 1 0.81 . . 1 . . . . 59 ILE HD1 . 7366 1 411 . 1 1 59 59 ILE HD12 H 1 0.81 . . 1 . . . . 59 ILE HD1 . 7366 1 412 . 1 1 59 59 ILE HD13 H 1 0.81 . . 1 . . . . 59 ILE HD1 . 7366 1 413 . 1 1 59 59 ILE HG12 H 1 0.85 . . 2 . . . . 59 ILE HG12 . 7366 1 414 . 1 1 59 59 ILE HG13 H 1 1.70 . . 2 . . . . 59 ILE HG13 . 7366 1 415 . 1 1 59 59 ILE HG21 H 1 0.88 . . 1 . . . . 59 ILE HG2 . 7366 1 416 . 1 1 59 59 ILE HG22 H 1 0.88 . . 1 . . . . 59 ILE HG2 . 7366 1 417 . 1 1 59 59 ILE HG23 H 1 0.88 . . 1 . . . . 59 ILE HG2 . 7366 1 418 . 1 1 59 59 ILE CA C 13 65.7 . . 1 . . . . 59 ILE CA . 7366 1 419 . 1 1 59 59 ILE CB C 13 37.5 . . 1 . . . . 59 ILE CB . 7366 1 420 . 1 1 59 59 ILE CD1 C 13 12.8 . . 1 . . . . 59 ILE CD1 . 7366 1 421 . 1 1 59 59 ILE CG1 C 13 29.6 . . 1 . . . . 59 ILE CG1 . 7366 1 422 . 1 1 59 59 ILE CG2 C 13 17.6 . . 1 . . . . 59 ILE CG2 . 7366 1 423 . 1 1 59 59 ILE N N 15 118.6 . . 1 . . . . 59 ILE N . 7366 1 424 . 1 1 60 60 LYS H H 1 7.89 . . 1 . . . . 60 LYS H . 7366 1 425 . 1 1 60 60 LYS HA H 1 4.09 . . 1 . . . . 60 LYS HA . 7366 1 426 . 1 1 60 60 LYS HB2 H 1 1.98 . . 2 . . . . 60 LYS HB2 . 7366 1 427 . 1 1 60 60 LYS HB3 H 1 1.98 . . 2 . . . . 60 LYS HB3 . 7366 1 428 . 1 1 60 60 LYS HD2 H 1 1.73 . . 2 . . . . 60 LYS HD2 . 7366 1 429 . 1 1 60 60 LYS HD3 H 1 1.73 . . 2 . . . . 60 LYS HD3 . 7366 1 430 . 1 1 60 60 LYS HE2 H 1 3.00 . . 2 . . . . 60 LYS HE2 . 7366 1 431 . 1 1 60 60 LYS HE3 H 1 3.00 . . 2 . . . . 60 LYS HE3 . 7366 1 432 . 1 1 60 60 LYS HG2 H 1 1.62 . . 2 . . . . 60 LYS HG2 . 7366 1 433 . 1 1 60 60 LYS HG3 H 1 1.42 . . 2 . . . . 60 LYS HG3 . 7366 1 434 . 1 1 60 60 LYS CA C 13 59.8 . . 1 . . . . 60 LYS CA . 7366 1 435 . 1 1 60 60 LYS CB C 13 31.9 . . 1 . . . . 60 LYS CB . 7366 1 436 . 1 1 60 60 LYS CD C 13 29.3 . . 1 . . . . 60 LYS CD . 7366 1 437 . 1 1 60 60 LYS CE C 13 41.9 . . 1 . . . . 60 LYS CE . 7366 1 438 . 1 1 60 60 LYS CG C 13 25.0 . . 1 . . . . 60 LYS CG . 7366 1 439 . 1 1 60 60 LYS N N 15 119.4 . . 1 . . . . 60 LYS N . 7366 1 440 . 1 1 61 61 LYS H H 1 8.08 . . 1 . . . . 61 LYS H . 7366 1 441 . 1 1 61 61 LYS HA H 1 3.98 . . 1 . . . . 61 LYS HA . 7366 1 442 . 1 1 61 61 LYS HB2 H 1 1.82 . . 2 . . . . 61 LYS HB2 . 7366 1 443 . 1 1 61 61 LYS HB3 H 1 1.69 . . 2 . . . . 61 LYS HB3 . 7366 1 444 . 1 1 61 61 LYS HD2 H 1 1.62 . . 2 . . . . 61 LYS HD2 . 7366 1 445 . 1 1 61 61 LYS HD3 H 1 1.47 . . 2 . . . . 61 LYS HD3 . 7366 1 446 . 1 1 61 61 LYS HE2 H 1 3.08 . . 2 . . . . 61 LYS HE2 . 7366 1 447 . 1 1 61 61 LYS HE3 H 1 3.01 . . 2 . . . . 61 LYS HE3 . 7366 1 448 . 1 1 61 61 LYS HG2 H 1 1.41 . . 2 . . . . 61 LYS HG2 . 7366 1 449 . 1 1 61 61 LYS HG3 H 1 1.64 . . 2 . . . . 61 LYS HG3 . 7366 1 450 . 1 1 61 61 LYS CA C 13 59.2 . . 1 . . . . 61 LYS CA . 7366 1 451 . 1 1 61 61 LYS CB C 13 33.5 . . 1 . . . . 61 LYS CB . 7366 1 452 . 1 1 61 61 LYS CD C 13 29.3 . . 1 . . . . 61 LYS CD . 7366 1 453 . 1 1 61 61 LYS CE C 13 42.1 . . 1 . . . . 61 LYS CE . 7366 1 454 . 1 1 61 61 LYS CG C 13 26.6 . . 1 . . . . 61 LYS CG . 7366 1 455 . 1 1 61 61 LYS N N 15 119.2 . . 1 . . . . 61 LYS N . 7366 1 456 . 1 1 62 62 ALA H H 1 8.49 . . 1 . . . . 62 ALA H . 7366 1 457 . 1 1 62 62 ALA HA H 1 3.77 . . 1 . . . . 62 ALA HA . 7366 1 458 . 1 1 62 62 ALA HB1 H 1 1.19 . . 1 . . . . 62 ALA HB . 7366 1 459 . 1 1 62 62 ALA HB2 H 1 1.19 . . 1 . . . . 62 ALA HB . 7366 1 460 . 1 1 62 62 ALA HB3 H 1 1.19 . . 1 . . . . 62 ALA HB . 7366 1 461 . 1 1 62 62 ALA CA C 13 54.9 . . 1 . . . . 62 ALA CA . 7366 1 462 . 1 1 62 62 ALA CB C 13 19.1 . . 1 . . . . 62 ALA CB . 7366 1 463 . 1 1 62 62 ALA N N 15 122.2 . . 1 . . . . 62 ALA N . 7366 1 464 . 1 1 63 63 ASP H H 1 8.85 . . 1 . . . . 63 ASP H . 7366 1 465 . 1 1 63 63 ASP HA H 1 4.59 . . 1 . . . . 63 ASP HA . 7366 1 466 . 1 1 63 63 ASP HB2 H 1 2.88 . . 2 . . . . 63 ASP HB2 . 7366 1 467 . 1 1 63 63 ASP HB3 H 1 2.70 . . 2 . . . . 63 ASP HB3 . 7366 1 468 . 1 1 63 63 ASP CA C 13 56.9 . . 1 . . . . 63 ASP CA . 7366 1 469 . 1 1 63 63 ASP CB C 13 39.0 . . 1 . . . . 63 ASP CB . 7366 1 470 . 1 1 63 63 ASP N N 15 120.2 . . 1 . . . . 63 ASP N . 7366 1 471 . 1 1 64 64 GLU H H 1 8.05 . . 1 . . . . 64 GLU H . 7366 1 472 . 1 1 64 64 GLU HA H 1 4.07 . . 1 . . . . 64 GLU HA . 7366 1 473 . 1 1 64 64 GLU HB2 H 1 2.23 . . 2 . . . . 64 GLU HB2 . 7366 1 474 . 1 1 64 64 GLU HB3 H 1 2.13 . . 2 . . . . 64 GLU HB3 . 7366 1 475 . 1 1 64 64 GLU HG2 H 1 2.36 . . 2 . . . . 64 GLU HG2 . 7366 1 476 . 1 1 64 64 GLU HG3 H 1 2.56 . . 2 . . . . 64 GLU HG3 . 7366 1 477 . 1 1 64 64 GLU CA C 13 58.8 . . 1 . . . . 64 GLU CA . 7366 1 478 . 1 1 64 64 GLU CB C 13 29.0 . . 1 . . . . 64 GLU CB . 7366 1 479 . 1 1 64 64 GLU CG C 13 35.7 . . 1 . . . . 64 GLU CG . 7366 1 480 . 1 1 64 64 GLU N N 15 121.3 . . 1 . . . . 64 GLU N . 7366 1 481 . 1 1 65 65 LYS H H 1 7.18 . . 1 . . . . 65 LYS H . 7366 1 482 . 1 1 65 65 LYS HA H 1 4.31 . . 1 . . . . 65 LYS HA . 7366 1 483 . 1 1 65 65 LYS HB2 H 1 1.95 . . 2 . . . . 65 LYS HB2 . 7366 1 484 . 1 1 65 65 LYS HB3 H 1 1.66 . . 2 . . . . 65 LYS HB3 . 7366 1 485 . 1 1 65 65 LYS HD2 H 1 1.53 . . 2 . . . . 65 LYS HD2 . 7366 1 486 . 1 1 65 65 LYS HD3 H 1 1.53 . . 2 . . . . 65 LYS HD3 . 7366 1 487 . 1 1 65 65 LYS HE2 H 1 2.97 . . 2 . . . . 65 LYS HE2 . 7366 1 488 . 1 1 65 65 LYS HE3 H 1 2.97 . . 2 . . . . 65 LYS HE3 . 7366 1 489 . 1 1 65 65 LYS HG2 H 1 1.38 . . 2 . . . . 65 LYS HG2 . 7366 1 490 . 1 1 65 65 LYS HG3 H 1 1.38 . . 2 . . . . 65 LYS HG3 . 7366 1 491 . 1 1 65 65 LYS CA C 13 54.8 . . 1 . . . . 65 LYS CA . 7366 1 492 . 1 1 65 65 LYS CB C 13 33.0 . . 1 . . . . 65 LYS CB . 7366 1 493 . 1 1 65 65 LYS CD C 13 24.8 . . 1 . . . . 65 LYS CD . 7366 1 494 . 1 1 65 65 LYS CE C 13 42.0 . . 1 . . . . 65 LYS CE . 7366 1 495 . 1 1 65 65 LYS CG C 13 24.9 . . 1 . . . . 65 LYS CG . 7366 1 496 . 1 1 65 65 LYS N N 15 115.6 . . 1 . . . . 65 LYS N . 7366 1 497 . 1 1 66 66 GLY H H 1 7.87 . . 1 . . . . 66 GLY H . 7366 1 498 . 1 1 66 66 GLY HA2 H 1 3.86 . . 2 . . . . 66 GLY HA2 . 7366 1 499 . 1 1 66 66 GLY HA3 H 1 3.98 . . 2 . . . . 66 GLY HA3 . 7366 1 500 . 1 1 66 66 GLY CA C 13 45.7 . . 1 . . . . 66 GLY CA . 7366 1 501 . 1 1 66 66 GLY N N 15 107.5 . . 1 . . . . 66 GLY N . 7366 1 502 . 1 1 67 67 ALA H H 1 7.92 . . 1 . . . . 67 ALA H . 7366 1 503 . 1 1 67 67 ALA HA H 1 4.02 . . 1 . . . . 67 ALA HA . 7366 1 504 . 1 1 67 67 ALA HB1 H 1 1.26 . . 1 . . . . 67 ALA HB . 7366 1 505 . 1 1 67 67 ALA HB2 H 1 1.26 . . 1 . . . . 67 ALA HB . 7366 1 506 . 1 1 67 67 ALA HB3 H 1 1.26 . . 1 . . . . 67 ALA HB . 7366 1 507 . 1 1 67 67 ALA CA C 13 51.7 . . 1 . . . . 67 ALA CA . 7366 1 508 . 1 1 67 67 ALA CB C 13 21.1 . . 1 . . . . 67 ALA CB . 7366 1 509 . 1 1 67 67 ALA N N 15 118.9 . . 1 . . . . 67 ALA N . 7366 1 510 . 1 1 68 68 ASP H H 1 8.79 . . 1 . . . . 68 ASP H . 7366 1 511 . 1 1 68 68 ASP HA H 1 5.07 . . 1 . . . . 68 ASP HA . 7366 1 512 . 1 1 68 68 ASP HB2 H 1 3.24 . . 2 . . . . 68 ASP HB2 . 7366 1 513 . 1 1 68 68 ASP HB3 H 1 2.67 . . 2 . . . . 68 ASP HB3 . 7366 1 514 . 1 1 68 68 ASP CA C 13 56.5 . . 1 . . . . 68 ASP CA . 7366 1 515 . 1 1 68 68 ASP CB C 13 44.9 . . 1 . . . . 68 ASP CB . 7366 1 516 . 1 1 68 68 ASP N N 15 116.5 . . 1 . . . . 68 ASP N . 7366 1 517 . 1 1 69 69 VAL H H 1 8.07 . . 1 . . . . 69 VAL H . 7366 1 518 . 1 1 69 69 VAL HA H 1 5.13 . . 1 . . . . 69 VAL HA . 7366 1 519 . 1 1 69 69 VAL HB H 1 1.43 . . 1 . . . . 69 VAL HB . 7366 1 520 . 1 1 69 69 VAL HG11 H 1 0.71 . . 2 . . . . 69 VAL HG1 . 7366 1 521 . 1 1 69 69 VAL HG12 H 1 0.71 . . 2 . . . . 69 VAL HG1 . 7366 1 522 . 1 1 69 69 VAL HG13 H 1 0.71 . . 2 . . . . 69 VAL HG1 . 7366 1 523 . 1 1 69 69 VAL HG21 H 1 0.57 . . 2 . . . . 69 VAL HG2 . 7366 1 524 . 1 1 69 69 VAL HG22 H 1 0.57 . . 2 . . . . 69 VAL HG2 . 7366 1 525 . 1 1 69 69 VAL HG23 H 1 0.57 . . 2 . . . . 69 VAL HG2 . 7366 1 526 . 1 1 69 69 VAL CA C 13 60.3 . . 1 . . . . 69 VAL CA . 7366 1 527 . 1 1 69 69 VAL CB C 13 37.4 . . 1 . . . . 69 VAL CB . 7366 1 528 . 1 1 69 69 VAL CG1 C 13 23.4 . . 1 . . . . 69 VAL CG1 . 7366 1 529 . 1 1 69 69 VAL CG2 C 13 22.4 . . 1 . . . . 69 VAL CG2 . 7366 1 530 . 1 1 69 69 VAL N N 15 118.4 . . 1 . . . . 69 VAL N . 7366 1 531 . 1 1 70 70 VAL H H 1 8.72 . . 1 . . . . 70 VAL H . 7366 1 532 . 1 1 70 70 VAL HA H 1 4.55 . . 1 . . . . 70 VAL HA . 7366 1 533 . 1 1 70 70 VAL HB H 1 1.74 . . 1 . . . . 70 VAL HB . 7366 1 534 . 1 1 70 70 VAL HG11 H 1 0.75 . . 2 . . . . 70 VAL HG1 . 7366 1 535 . 1 1 70 70 VAL HG12 H 1 0.75 . . 2 . . . . 70 VAL HG1 . 7366 1 536 . 1 1 70 70 VAL HG13 H 1 0.75 . . 2 . . . . 70 VAL HG1 . 7366 1 537 . 1 1 70 70 VAL HG21 H 1 0.55 . . 2 . . . . 70 VAL HG2 . 7366 1 538 . 1 1 70 70 VAL HG22 H 1 0.55 . . 2 . . . . 70 VAL HG2 . 7366 1 539 . 1 1 70 70 VAL HG23 H 1 0.55 . . 2 . . . . 70 VAL HG2 . 7366 1 540 . 1 1 70 70 VAL CA C 13 59.8 . . 1 . . . . 70 VAL CA . 7366 1 541 . 1 1 70 70 VAL CB C 13 34.2 . . 1 . . . . 70 VAL CB . 7366 1 542 . 1 1 70 70 VAL CG1 C 13 20.0 . . 1 . . . . 70 VAL CG1 . 7366 1 543 . 1 1 70 70 VAL CG2 C 13 22.1 . . 1 . . . . 70 VAL CG2 . 7366 1 544 . 1 1 70 70 VAL N N 15 127.3 . . 1 . . . . 70 VAL N . 7366 1 545 . 1 1 71 71 VAL H H 1 8.89 . . 1 . . . . 71 VAL H . 7366 1 546 . 1 1 71 71 VAL HA H 1 4.55 . . 1 . . . . 71 VAL HA . 7366 1 547 . 1 1 71 71 VAL HB H 1 1.79 . . 1 . . . . 71 VAL HB . 7366 1 548 . 1 1 71 71 VAL HG11 H 1 0.02 . . 2 . . . . 71 VAL HG1 . 7366 1 549 . 1 1 71 71 VAL HG12 H 1 0.02 . . 2 . . . . 71 VAL HG1 . 7366 1 550 . 1 1 71 71 VAL HG13 H 1 0.02 . . 2 . . . . 71 VAL HG1 . 7366 1 551 . 1 1 71 71 VAL HG21 H 1 0.76 . . 2 . . . . 71 VAL HG2 . 7366 1 552 . 1 1 71 71 VAL HG22 H 1 0.76 . . 2 . . . . 71 VAL HG2 . 7366 1 553 . 1 1 71 71 VAL HG23 H 1 0.76 . . 2 . . . . 71 VAL HG2 . 7366 1 554 . 1 1 71 71 VAL CA C 13 60.8 . . 1 . . . . 71 VAL CA . 7366 1 555 . 1 1 71 71 VAL CB C 13 34.0 . . 1 . . . . 71 VAL CB . 7366 1 556 . 1 1 71 71 VAL CG1 C 13 20.6 . . 1 . . . . 71 VAL CG1 . 7366 1 557 . 1 1 71 71 VAL CG2 C 13 20.1 . . 1 . . . . 71 VAL CG2 . 7366 1 558 . 1 1 71 71 VAL N N 15 126.7 . . 1 . . . . 71 VAL N . 7366 1 559 . 1 1 72 72 LEU H H 1 8.80 . . 1 . . . . 72 LEU H . 7366 1 560 . 1 1 72 72 LEU HA H 1 4.44 . . 1 . . . . 72 LEU HA . 7366 1 561 . 1 1 72 72 LEU HB2 H 1 1.73 . . 2 . . . . 72 LEU HB2 . 7366 1 562 . 1 1 72 72 LEU HB3 H 1 1.63 . . 2 . . . . 72 LEU HB3 . 7366 1 563 . 1 1 72 72 LEU HD11 H 1 0.85 . . 2 . . . . 72 LEU HD1 . 7366 1 564 . 1 1 72 72 LEU HD12 H 1 0.85 . . 2 . . . . 72 LEU HD1 . 7366 1 565 . 1 1 72 72 LEU HD13 H 1 0.85 . . 2 . . . . 72 LEU HD1 . 7366 1 566 . 1 1 72 72 LEU HD21 H 1 0.77 . . 2 . . . . 72 LEU HD2 . 7366 1 567 . 1 1 72 72 LEU HD22 H 1 0.77 . . 2 . . . . 72 LEU HD2 . 7366 1 568 . 1 1 72 72 LEU HD23 H 1 0.77 . . 2 . . . . 72 LEU HD2 . 7366 1 569 . 1 1 72 72 LEU HG H 1 1.68 . . 1 . . . . 72 LEU HG . 7366 1 570 . 1 1 72 72 LEU CA C 13 55.7 . . 1 . . . . 72 LEU CA . 7366 1 571 . 1 1 72 72 LEU CB C 13 41.5 . . 1 . . . . 72 LEU CB . 7366 1 572 . 1 1 72 72 LEU CD1 C 13 25.3 . . 1 . . . . 72 LEU CD1 . 7366 1 573 . 1 1 72 72 LEU CD2 C 13 23.5 . . 1 . . . . 72 LEU CD2 . 7366 1 574 . 1 1 72 72 LEU CG C 13 27.6 . . 1 . . . . 72 LEU CG . 7366 1 575 . 1 1 72 72 LEU N N 15 127.4 . . 1 . . . . 72 LEU N . 7366 1 576 . 1 1 73 73 THR H H 1 8.63 . . 1 . . . . 73 THR H . 7366 1 577 . 1 1 73 73 THR HA H 1 4.43 . . 1 . . . . 73 THR HA . 7366 1 578 . 1 1 73 73 THR HB H 1 4.34 . . 1 . . . . 73 THR HB . 7366 1 579 . 1 1 73 73 THR HG21 H 1 1.18 . . 1 . . . . 73 THR HG2 . 7366 1 580 . 1 1 73 73 THR HG22 H 1 1.18 . . 1 . . . . 73 THR HG2 . 7366 1 581 . 1 1 73 73 THR HG23 H 1 1.18 . . 1 . . . . 73 THR HG2 . 7366 1 582 . 1 1 73 73 THR CA C 13 61.5 . . 1 . . . . 73 THR CA . 7366 1 583 . 1 1 73 73 THR CB C 13 69.4 . . 1 . . . . 73 THR CB . 7366 1 584 . 1 1 73 73 THR CG2 C 13 20.9 . . 1 . . . . 73 THR CG2 . 7366 1 585 . 1 1 73 73 THR N N 15 114.0 . . 1 . . . . 73 THR N . 7366 1 586 . 1 1 74 74 SER H H 1 8.13 . . 1 . . . . 74 SER H . 7366 1 587 . 1 1 74 74 SER HA H 1 4.54 . . 1 . . . . 74 SER HA . 7366 1 588 . 1 1 74 74 SER HB2 H 1 4.01 . . 2 . . . . 74 SER HB2 . 7366 1 589 . 1 1 74 74 SER HB3 H 1 4.01 . . 2 . . . . 74 SER HB3 . 7366 1 590 . 1 1 74 74 SER CA C 13 58.0 . . 1 . . . . 74 SER CA . 7366 1 591 . 1 1 74 74 SER CB C 13 63.8 . . 1 . . . . 74 SER CB . 7366 1 592 . 1 1 74 74 SER N N 15 116.0 . . 1 . . . . 74 SER N . 7366 1 593 . 1 1 75 75 GLY H H 1 8.57 . . 1 . . . . 75 GLY H . 7366 1 594 . 1 1 75 75 GLY HA2 H 1 4.04 . . 2 . . . . 75 GLY HA2 . 7366 1 595 . 1 1 75 75 GLY HA3 H 1 4.04 . . 2 . . . . 75 GLY HA3 . 7366 1 596 . 1 1 75 75 GLY CA C 13 45.1 . . 1 . . . . 75 GLY CA . 7366 1 597 . 1 1 75 75 GLY N N 15 109.8 . . 1 . . . . 75 GLY N . 7366 1 598 . 1 1 76 76 GLN H H 1 8.39 . . 1 . . . . 76 GLN H . 7366 1 599 . 1 1 76 76 GLN HA H 1 4.49 . . 1 . . . . 76 GLN HA . 7366 1 600 . 1 1 76 76 GLN HB2 H 1 2.19 . . 2 . . . . 76 GLN HB2 . 7366 1 601 . 1 1 76 76 GLN HB3 H 1 2.02 . . 2 . . . . 76 GLN HB3 . 7366 1 602 . 1 1 76 76 GLN HE21 H 1 7.51 . . 2 . . . . 76 GLN HE21 . 7366 1 603 . 1 1 76 76 GLN HE22 H 1 6.84 . . 2 . . . . 76 GLN HE22 . 7366 1 604 . 1 1 76 76 GLN HG2 H 1 2.35 . . 2 . . . . 76 GLN HG2 . 7366 1 605 . 1 1 76 76 GLN HG3 H 1 2.35 . . 2 . . . . 76 GLN HG3 . 7366 1 606 . 1 1 76 76 GLN CA C 13 55.9 . . 1 . . . . 76 GLN CA . 7366 1 607 . 1 1 76 76 GLN CB C 13 29.6 . . 1 . . . . 76 GLN CB . 7366 1 608 . 1 1 76 76 GLN CG C 13 33.9 . . 1 . . . . 76 GLN CG . 7366 1 609 . 1 1 76 76 GLN N N 15 119.2 . . 1 . . . . 76 GLN N . 7366 1 610 . 1 1 76 76 GLN NE2 N 15 111.9 . . 1 . . . . 76 GLN NE2 . 7366 1 611 . 1 1 77 77 THR H H 1 8.10 . . 1 . . . . 77 THR H . 7366 1 612 . 1 1 77 77 THR HA H 1 4.42 . . 1 . . . . 77 THR HA . 7366 1 613 . 1 1 77 77 THR HB H 1 4.34 . . 1 . . . . 77 THR HB . 7366 1 614 . 1 1 77 77 THR HG21 H 1 1.18 . . 1 . . . . 77 THR HG2 . 7366 1 615 . 1 1 77 77 THR HG22 H 1 1.18 . . 1 . . . . 77 THR HG2 . 7366 1 616 . 1 1 77 77 THR HG23 H 1 1.18 . . 1 . . . . 77 THR HG2 . 7366 1 617 . 1 1 77 77 THR CA C 13 61.3 . . 1 . . . . 77 THR CA . 7366 1 618 . 1 1 77 77 THR CB C 13 69.7 . . 1 . . . . 77 THR CB . 7366 1 619 . 1 1 77 77 THR CG2 C 13 21.6 . . 1 . . . . 77 THR CG2 . 7366 1 620 . 1 1 77 77 THR N N 15 113.0 . . 1 . . . . 77 THR N . 7366 1 621 . 1 1 78 78 GLU H H 1 8.45 . . 1 . . . . 78 GLU H . 7366 1 622 . 1 1 78 78 GLU HA H 1 4.25 . . 1 . . . . 78 GLU HA . 7366 1 623 . 1 1 78 78 GLU HB2 H 1 2.12 . . 2 . . . . 78 GLU HB2 . 7366 1 624 . 1 1 78 78 GLU HB3 H 1 1.96 . . 2 . . . . 78 GLU HB3 . 7366 1 625 . 1 1 78 78 GLU HG2 H 1 2.31 . . 2 . . . . 78 GLU HG2 . 7366 1 626 . 1 1 78 78 GLU HG3 H 1 2.31 . . 2 . . . . 78 GLU HG3 . 7366 1 627 . 1 1 78 78 GLU CA C 13 56.9 . . 1 . . . . 78 GLU CA . 7366 1 628 . 1 1 78 78 GLU CB C 13 29.5 . . 1 . . . . 78 GLU CB . 7366 1 629 . 1 1 78 78 GLU CG C 13 35.8 . . 1 . . . . 78 GLU CG . 7366 1 630 . 1 1 78 78 GLU N N 15 120.7 . . 1 . . . . 78 GLU N . 7366 1 631 . 1 1 79 79 ASN H H 1 8.32 . . 1 . . . . 79 ASN H . 7366 1 632 . 1 1 79 79 ASN HA H 1 4.60 . . 1 . . . . 79 ASN HA . 7366 1 633 . 1 1 79 79 ASN HB2 H 1 2.85 . . 2 . . . . 79 ASN HB2 . 7366 1 634 . 1 1 79 79 ASN HB3 H 1 2.78 . . 2 . . . . 79 ASN HB3 . 7366 1 635 . 1 1 79 79 ASN HD21 H 1 7.61 . . 2 . . . . 79 ASN HD21 . 7366 1 636 . 1 1 79 79 ASN HD22 H 1 6.96 . . 2 . . . . 79 ASN HD22 . 7366 1 637 . 1 1 79 79 ASN CA C 13 53.7 . . 1 . . . . 79 ASN CA . 7366 1 638 . 1 1 79 79 ASN CB C 13 38.6 . . 1 . . . . 79 ASN CB . 7366 1 639 . 1 1 79 79 ASN N N 15 117.0 . . 1 . . . . 79 ASN N . 7366 1 640 . 1 1 79 79 ASN ND2 N 15 112.8 . . 1 . . . . 79 ASN ND2 . 7366 1 641 . 1 1 80 80 LYS H H 1 7.91 . . 1 . . . . 80 LYS H . 7366 1 642 . 1 1 80 80 LYS HA H 1 4.30 . . 1 . . . . 80 LYS HA . 7366 1 643 . 1 1 80 80 LYS HB2 H 1 1.68 . . 2 . . . . 80 LYS HB2 . 7366 1 644 . 1 1 80 80 LYS HB3 H 1 1.68 . . 2 . . . . 80 LYS HB3 . 7366 1 645 . 1 1 80 80 LYS HD2 H 1 1.61 . . 2 . . . . 80 LYS HD2 . 7366 1 646 . 1 1 80 80 LYS HD3 H 1 1.61 . . 2 . . . . 80 LYS HD3 . 7366 1 647 . 1 1 80 80 LYS HE2 H 1 2.96 . . 2 . . . . 80 LYS HE2 . 7366 1 648 . 1 1 80 80 LYS HE3 H 1 2.96 . . 2 . . . . 80 LYS HE3 . 7366 1 649 . 1 1 80 80 LYS HG2 H 1 1.38 . . 2 . . . . 80 LYS HG2 . 7366 1 650 . 1 1 80 80 LYS HG3 H 1 1.27 . . 2 . . . . 80 LYS HG3 . 7366 1 651 . 1 1 80 80 LYS CA C 13 56.0 . . 1 . . . . 80 LYS CA . 7366 1 652 . 1 1 80 80 LYS CB C 13 33.3 . . 1 . . . . 80 LYS CB . 7366 1 653 . 1 1 80 80 LYS CD C 13 28.2 . . 1 . . . . 80 LYS CD . 7366 1 654 . 1 1 80 80 LYS CE C 13 42.0 . . 1 . . . . 80 LYS CE . 7366 1 655 . 1 1 80 80 LYS CG C 13 24.9 . . 1 . . . . 80 LYS CG . 7366 1 656 . 1 1 80 80 LYS N N 15 118.8 . . 1 . . . . 80 LYS N . 7366 1 657 . 1 1 81 81 ILE H H 1 8.34 . . 1 . . . . 81 ILE H . 7366 1 658 . 1 1 81 81 ILE HA H 1 4.30 . . 1 . . . . 81 ILE HA . 7366 1 659 . 1 1 81 81 ILE HB H 1 1.75 . . 1 . . . . 81 ILE HB . 7366 1 660 . 1 1 81 81 ILE HD11 H 1 0.81 . . 1 . . . . 81 ILE HD1 . 7366 1 661 . 1 1 81 81 ILE HD12 H 1 0.81 . . 1 . . . . 81 ILE HD1 . 7366 1 662 . 1 1 81 81 ILE HD13 H 1 0.81 . . 1 . . . . 81 ILE HD1 . 7366 1 663 . 1 1 81 81 ILE HG12 H 1 1.37 . . 2 . . . . 81 ILE HG12 . 7366 1 664 . 1 1 81 81 ILE HG13 H 1 1.05 . . 2 . . . . 81 ILE HG13 . 7366 1 665 . 1 1 81 81 ILE HG21 H 1 0.77 . . 1 . . . . 81 ILE HG2 . 7366 1 666 . 1 1 81 81 ILE HG22 H 1 0.77 . . 1 . . . . 81 ILE HG2 . 7366 1 667 . 1 1 81 81 ILE HG23 H 1 0.77 . . 1 . . . . 81 ILE HG2 . 7366 1 668 . 1 1 81 81 ILE CA C 13 60.5 . . 1 . . . . 81 ILE CA . 7366 1 669 . 1 1 81 81 ILE CB C 13 39.8 . . 1 . . . . 81 ILE CB . 7366 1 670 . 1 1 81 81 ILE CD1 C 13 13.4 . . 1 . . . . 81 ILE CD1 . 7366 1 671 . 1 1 81 81 ILE CG1 C 13 27.1 . . 1 . . . . 81 ILE CG1 . 7366 1 672 . 1 1 81 81 ILE CG2 C 13 17.6 . . 1 . . . . 81 ILE CG2 . 7366 1 673 . 1 1 81 81 ILE N N 15 119.6 . . 1 . . . . 81 ILE N . 7366 1 674 . 1 1 82 82 HIS H H 1 8.47 . . 1 . . . . 82 HIS H . 7366 1 675 . 1 1 82 82 HIS HA H 1 4.78 . . 1 . . . . 82 HIS HA . 7366 1 676 . 1 1 82 82 HIS HB2 H 1 3.27 . . 2 . . . . 82 HIS HB2 . 7366 1 677 . 1 1 82 82 HIS HB3 H 1 3.12 . . 2 . . . . 82 HIS HB3 . 7366 1 678 . 1 1 82 82 HIS HD2 H 1 7.27 . . 1 . . . . 82 HIS HD2 . 7366 1 679 . 1 1 82 82 HIS HE1 H 1 8.09 . . 1 . . . . 82 HIS HE1 . 7366 1 680 . 1 1 82 82 HIS CA C 13 54.7 . . 1 . . . . 82 HIS CA . 7366 1 681 . 1 1 82 82 HIS CB C 13 28.9 . . 1 . . . . 82 HIS CB . 7366 1 682 . 1 1 82 82 HIS CD2 C 13 119.4 . . 1 . . . . 82 HIS CD2 . 7366 1 683 . 1 1 82 82 HIS CE1 C 13 135.2 . . 1 . . . . 82 HIS CE1 . 7366 1 684 . 1 1 82 82 HIS N N 15 121.6 . . 1 . . . . 82 HIS N . 7366 1 685 . 1 1 83 83 GLY H H 1 8.34 . . 1 . . . . 83 GLY H . 7366 1 686 . 1 1 83 83 GLY HA2 H 1 3.69 . . 2 . . . . 83 GLY HA2 . 7366 1 687 . 1 1 83 83 GLY HA3 H 1 4.19 . . 2 . . . . 83 GLY HA3 . 7366 1 688 . 1 1 83 83 GLY CA C 13 45.0 . . 1 . . . . 83 GLY CA . 7366 1 689 . 1 1 83 83 GLY N N 15 111.6 . . 1 . . . . 83 GLY N . 7366 1 690 . 1 1 84 84 THR H H 1 8.12 . . 1 . . . . 84 THR H . 7366 1 691 . 1 1 84 84 THR HA H 1 5.03 . . 1 . . . . 84 THR HA . 7366 1 692 . 1 1 84 84 THR HB H 1 4.07 . . 1 . . . . 84 THR HB . 7366 1 693 . 1 1 84 84 THR HG21 H 1 1.07 . . 1 . . . . 84 THR HG2 . 7366 1 694 . 1 1 84 84 THR HG22 H 1 1.07 . . 1 . . . . 84 THR HG2 . 7366 1 695 . 1 1 84 84 THR HG23 H 1 1.07 . . 1 . . . . 84 THR HG2 . 7366 1 696 . 1 1 84 84 THR CA C 13 60.1 . . 1 . . . . 84 THR CA . 7366 1 697 . 1 1 84 84 THR CB C 13 72.0 . . 1 . . . . 84 THR CB . 7366 1 698 . 1 1 84 84 THR CG2 C 13 21.0 . . 1 . . . . 84 THR CG2 . 7366 1 699 . 1 1 84 84 THR N N 15 112.3 . . 1 . . . . 84 THR N . 7366 1 700 . 1 1 85 85 ALA H H 1 8.84 . . 1 . . . . 85 ALA H . 7366 1 701 . 1 1 85 85 ALA HA H 1 4.95 . . 1 . . . . 85 ALA HA . 7366 1 702 . 1 1 85 85 ALA HB1 H 1 1.10 . . 1 . . . . 85 ALA HB . 7366 1 703 . 1 1 85 85 ALA HB2 H 1 1.10 . . 1 . . . . 85 ALA HB . 7366 1 704 . 1 1 85 85 ALA HB3 H 1 1.10 . . 1 . . . . 85 ALA HB . 7366 1 705 . 1 1 85 85 ALA CA C 13 51.2 . . 1 . . . . 85 ALA CA . 7366 1 706 . 1 1 85 85 ALA CB C 13 23.8 . . 1 . . . . 85 ALA CB . 7366 1 707 . 1 1 85 85 ALA N N 15 122.5 . . 1 . . . . 85 ALA N . 7366 1 708 . 1 1 86 86 ASP H H 1 8.51 . . 1 . . . . 86 ASP H . 7366 1 709 . 1 1 86 86 ASP HA H 1 5.20 . . 1 . . . . 86 ASP HA . 7366 1 710 . 1 1 86 86 ASP HB2 H 1 2.54 . . 2 . . . . 86 ASP HB2 . 7366 1 711 . 1 1 86 86 ASP HB3 H 1 2.14 . . 2 . . . . 86 ASP HB3 . 7366 1 712 . 1 1 86 86 ASP CA C 13 53.4 . . 1 . . . . 86 ASP CA . 7366 1 713 . 1 1 86 86 ASP CB C 13 43.1 . . 1 . . . . 86 ASP CB . 7366 1 714 . 1 1 86 86 ASP N N 15 121.4 . . 1 . . . . 86 ASP N . 7366 1 715 . 1 1 87 87 ILE H H 1 7.97 . . 1 . . . . 87 ILE H . 7366 1 716 . 1 1 87 87 ILE HA H 1 5.37 . . 1 . . . . 87 ILE HA . 7366 1 717 . 1 1 87 87 ILE HB H 1 1.53 . . 1 . . . . 87 ILE HB . 7366 1 718 . 1 1 87 87 ILE HD11 H 1 0.63 . . 1 . . . . 87 ILE HD1 . 7366 1 719 . 1 1 87 87 ILE HD12 H 1 0.63 . . 1 . . . . 87 ILE HD1 . 7366 1 720 . 1 1 87 87 ILE HD13 H 1 0.63 . . 1 . . . . 87 ILE HD1 . 7366 1 721 . 1 1 87 87 ILE HG12 H 1 0.55 . . 2 . . . . 87 ILE HG12 . 7366 1 722 . 1 1 87 87 ILE HG13 H 1 1.38 . . 2 . . . . 87 ILE HG13 . 7366 1 723 . 1 1 87 87 ILE HG21 H 1 0.76 . . 1 . . . . 87 ILE HG2 . 7366 1 724 . 1 1 87 87 ILE HG22 H 1 0.76 . . 1 . . . . 87 ILE HG2 . 7366 1 725 . 1 1 87 87 ILE HG23 H 1 0.76 . . 1 . . . . 87 ILE HG2 . 7366 1 726 . 1 1 87 87 ILE CA C 13 58.2 . . 1 . . . . 87 ILE CA . 7366 1 727 . 1 1 87 87 ILE CB C 13 41.2 . . 1 . . . . 87 ILE CB . 7366 1 728 . 1 1 87 87 ILE CD1 C 13 14.7 . . 1 . . . . 87 ILE CD1 . 7366 1 729 . 1 1 87 87 ILE CG1 C 13 25.9 . . 1 . . . . 87 ILE CG1 . 7366 1 730 . 1 1 87 87 ILE CG2 C 13 19.8 . . 1 . . . . 87 ILE CG2 . 7366 1 731 . 1 1 87 87 ILE N N 15 111.2 . . 1 . . . . 87 ILE N . 7366 1 732 . 1 1 88 88 TYR H H 1 8.75 . . 1 . . . . 88 TYR H . 7366 1 733 . 1 1 88 88 TYR HA H 1 5.44 . . 1 . . . . 88 TYR HA . 7366 1 734 . 1 1 88 88 TYR HB2 H 1 3.06 . . 2 . . . . 88 TYR HB2 . 7366 1 735 . 1 1 88 88 TYR HB3 H 1 2.46 . . 2 . . . . 88 TYR HB3 . 7366 1 736 . 1 1 88 88 TYR HD1 H 1 6.90 . . 3 . . . . 88 TYR HD1 . 7366 1 737 . 1 1 88 88 TYR HD2 H 1 6.90 . . 3 . . . . 88 TYR HD2 . 7366 1 738 . 1 1 88 88 TYR HE1 H 1 6.63 . . 3 . . . . 88 TYR HE1 . 7366 1 739 . 1 1 88 88 TYR HE2 H 1 6.63 . . 3 . . . . 88 TYR HE2 . 7366 1 740 . 1 1 88 88 TYR CA C 13 56.9 . . 1 . . . . 88 TYR CA . 7366 1 741 . 1 1 88 88 TYR CB C 13 44.0 . . 1 . . . . 88 TYR CB . 7366 1 742 . 1 1 88 88 TYR CD1 C 13 132.4 . . 1 . . . . 88 TYR CD1 . 7366 1 743 . 1 1 88 88 TYR CE1 C 13 117.6 . . 1 . . . . 88 TYR CE1 . 7366 1 744 . 1 1 88 88 TYR N N 15 118.0 . . 1 . . . . 88 TYR N . 7366 1 745 . 1 1 89 89 LYS H H 1 9.59 . . 1 . . . . 89 LYS H . 7366 1 746 . 1 1 89 89 LYS HA H 1 5.17 . . 1 . . . . 89 LYS HA . 7366 1 747 . 1 1 89 89 LYS HB2 H 1 2.01 . . 2 . . . . 89 LYS HB2 . 7366 1 748 . 1 1 89 89 LYS HB3 H 1 1.75 . . 2 . . . . 89 LYS HB3 . 7366 1 749 . 1 1 89 89 LYS HD2 H 1 1.84 . . 2 . . . . 89 LYS HD2 . 7366 1 750 . 1 1 89 89 LYS HD3 H 1 1.77 . . 2 . . . . 89 LYS HD3 . 7366 1 751 . 1 1 89 89 LYS HE2 H 1 3.08 . . 2 . . . . 89 LYS HE2 . 7366 1 752 . 1 1 89 89 LYS HE3 H 1 3.08 . . 2 . . . . 89 LYS HE3 . 7366 1 753 . 1 1 89 89 LYS HG2 H 1 1.62 . . 2 . . . . 89 LYS HG2 . 7366 1 754 . 1 1 89 89 LYS HG3 H 1 1.62 . . 2 . . . . 89 LYS HG3 . 7366 1 755 . 1 1 89 89 LYS CA C 13 54.4 . . 1 . . . . 89 LYS CA . 7366 1 756 . 1 1 89 89 LYS CB C 13 36.8 . . 1 . . . . 89 LYS CB . 7366 1 757 . 1 1 89 89 LYS CD C 13 29.3 . . 1 . . . . 89 LYS CD . 7366 1 758 . 1 1 89 89 LYS CE C 13 42.2 . . 1 . . . . 89 LYS CE . 7366 1 759 . 1 1 89 89 LYS CG C 13 24.8 . . 1 . . . . 89 LYS CG . 7366 1 760 . 1 1 89 89 LYS N N 15 123.5 . . 1 . . . . 89 LYS N . 7366 1 761 . 1 1 90 90 LYS H H 1 10.19 . . 1 . . . . 90 LYS H . 7366 1 762 . 1 1 90 90 LYS HA H 1 3.81 . . 1 . . . . 90 LYS HA . 7366 1 763 . 1 1 90 90 LYS HB2 H 1 1.74 . . 2 . . . . 90 LYS HB2 . 7366 1 764 . 1 1 90 90 LYS HB3 H 1 1.57 . . 2 . . . . 90 LYS HB3 . 7366 1 765 . 1 1 90 90 LYS HD2 H 1 1.50 . . 2 . . . . 90 LYS HD2 . 7366 1 766 . 1 1 90 90 LYS HD3 H 1 1.50 . . 2 . . . . 90 LYS HD3 . 7366 1 767 . 1 1 90 90 LYS HE2 H 1 2.89 . . 2 . . . . 90 LYS HE2 . 7366 1 768 . 1 1 90 90 LYS HE3 H 1 2.89 . . 2 . . . . 90 LYS HE3 . 7366 1 769 . 1 1 90 90 LYS HG2 H 1 1.01 . . 2 . . . . 90 LYS HG2 . 7366 1 770 . 1 1 90 90 LYS HG3 H 1 1.35 . . 2 . . . . 90 LYS HG3 . 7366 1 771 . 1 1 90 90 LYS CA C 13 57.5 . . 1 . . . . 90 LYS CA . 7366 1 772 . 1 1 90 90 LYS CB C 13 32.7 . . 1 . . . . 90 LYS CB . 7366 1 773 . 1 1 90 90 LYS CD C 13 28.9 . . 1 . . . . 90 LYS CD . 7366 1 774 . 1 1 90 90 LYS CE C 13 42.2 . . 1 . . . . 90 LYS CE . 7366 1 775 . 1 1 90 90 LYS CG C 13 25.5 . . 1 . . . . 90 LYS CG . 7366 1 776 . 1 1 90 90 LYS N N 15 129.2 . . 1 . . . . 90 LYS N . 7366 1 777 . 1 1 91 91 LYS H H 1 8.45 . . 1 . . . . 91 LYS H . 7366 1 778 . 1 1 91 91 LYS HA H 1 4.10 . . 1 . . . . 91 LYS HA . 7366 1 779 . 1 1 91 91 LYS HB2 H 1 1.69 . . 2 . . . . 91 LYS HB2 . 7366 1 780 . 1 1 91 91 LYS HB3 H 1 1.46 . . 2 . . . . 91 LYS HB3 . 7366 1 781 . 1 1 91 91 LYS HD2 H 1 1.61 . . 2 . . . . 91 LYS HD2 . 7366 1 782 . 1 1 91 91 LYS HD3 H 1 1.57 . . 2 . . . . 91 LYS HD3 . 7366 1 783 . 1 1 91 91 LYS HE2 H 1 2.86 . . 2 . . . . 91 LYS HE2 . 7366 1 784 . 1 1 91 91 LYS HE3 H 1 2.86 . . 2 . . . . 91 LYS HE3 . 7366 1 785 . 1 1 91 91 LYS HG2 H 1 1.34 . . 2 . . . . 91 LYS HG2 . 7366 1 786 . 1 1 91 91 LYS HG3 H 1 1.15 . . 2 . . . . 91 LYS HG3 . 7366 1 787 . 1 1 91 91 LYS CA C 13 57.3 . . 1 . . . . 91 LYS CA . 7366 1 788 . 1 1 91 91 LYS CB C 13 33.1 . . 1 . . . . 91 LYS CB . 7366 1 789 . 1 1 91 91 LYS CD C 13 29.2 . . 1 . . . . 91 LYS CD . 7366 1 790 . 1 1 91 91 LYS CE C 13 42.0 . . 1 . . . . 91 LYS CE . 7366 1 791 . 1 1 91 91 LYS CG C 13 25.9 . . 1 . . . . 91 LYS CG . 7366 1 792 . 1 1 91 91 LYS N N 15 125.9 . . 1 . . . . 91 LYS N . 7366 1 793 . 1 1 92 92 LEU H H 1 8.27 . . 1 . . . . 92 LEU H . 7366 1 794 . 1 1 92 92 LEU HA H 1 4.28 . . 1 . . . . 92 LEU HA . 7366 1 795 . 1 1 92 92 LEU HB2 H 1 1.55 . . 2 . . . . 92 LEU HB2 . 7366 1 796 . 1 1 92 92 LEU HB3 H 1 1.47 . . 2 . . . . 92 LEU HB3 . 7366 1 797 . 1 1 92 92 LEU HD11 H 1 0.83 . . 2 . . . . 92 LEU HD1 . 7366 1 798 . 1 1 92 92 LEU HD12 H 1 0.83 . . 2 . . . . 92 LEU HD1 . 7366 1 799 . 1 1 92 92 LEU HD13 H 1 0.83 . . 2 . . . . 92 LEU HD1 . 7366 1 800 . 1 1 92 92 LEU HD21 H 1 0.90 . . 2 . . . . 92 LEU HD2 . 7366 1 801 . 1 1 92 92 LEU HD22 H 1 0.90 . . 2 . . . . 92 LEU HD2 . 7366 1 802 . 1 1 92 92 LEU HD23 H 1 0.90 . . 2 . . . . 92 LEU HD2 . 7366 1 803 . 1 1 92 92 LEU HG H 1 1.55 . . 1 . . . . 92 LEU HG . 7366 1 804 . 1 1 92 92 LEU CA C 13 54.6 . . 1 . . . . 92 LEU CA . 7366 1 805 . 1 1 92 92 LEU CB C 13 42.1 . . 1 . . . . 92 LEU CB . 7366 1 806 . 1 1 92 92 LEU CD1 C 13 23.6 . . 1 . . . . 92 LEU CD1 . 7366 1 807 . 1 1 92 92 LEU CD2 C 13 24.7 . . 1 . . . . 92 LEU CD2 . 7366 1 808 . 1 1 92 92 LEU CG C 13 26.8 . . 1 . . . . 92 LEU CG . 7366 1 809 . 1 1 92 92 LEU N N 15 123.2 . . 1 . . . . 92 LEU N . 7366 1 810 . 1 1 93 93 GLU H H 1 8.31 . . 1 . . . . 93 GLU H . 7366 1 811 . 1 1 93 93 GLU HA H 1 4.22 . . 1 . . . . 93 GLU HA . 7366 1 812 . 1 1 93 93 GLU HB2 H 1 1.86 . . 2 . . . . 93 GLU HB2 . 7366 1 813 . 1 1 93 93 GLU HB3 H 1 1.83 . . 2 . . . . 93 GLU HB3 . 7366 1 814 . 1 1 93 93 GLU HG2 H 1 2.16 . . 2 . . . . 93 GLU HG2 . 7366 1 815 . 1 1 93 93 GLU HG3 H 1 2.16 . . 2 . . . . 93 GLU HG3 . 7366 1 816 . 1 1 93 93 GLU CA C 13 55.7 . . 1 . . . . 93 GLU CA . 7366 1 817 . 1 1 93 93 GLU CB C 13 30.2 . . 1 . . . . 93 GLU CB . 7366 1 818 . 1 1 93 93 GLU CG C 13 35.5 . . 1 . . . . 93 GLU CG . 7366 1 819 . 1 1 93 93 GLU N N 15 122.0 . . 1 . . . . 93 GLU N . 7366 1 820 . 1 1 94 94 HIS H H 1 8.57 . . 1 . . . . 94 HIS H . 7366 1 821 . 1 1 94 94 HIS HA H 1 4.63 . . 1 . . . . 94 HIS HA . 7366 1 822 . 1 1 94 94 HIS HB2 H 1 3.06 . . 2 . . . . 94 HIS HB2 . 7366 1 823 . 1 1 94 94 HIS HB3 H 1 3.15 . . 2 . . . . 94 HIS HB3 . 7366 1 824 . 1 1 94 94 HIS HD2 H 1 7.08 . . 1 . . . . 94 HIS HD2 . 7366 1 825 . 1 1 94 94 HIS HE1 H 1 8.08 . . 1 . . . . 94 HIS HE1 . 7366 1 826 . 1 1 94 94 HIS CA C 13 55.0 . . 1 . . . . 94 HIS CA . 7366 1 827 . 1 1 94 94 HIS CB C 13 28.9 . . 1 . . . . 94 HIS CB . 7366 1 828 . 1 1 94 94 HIS CD2 C 13 119.0 . . 1 . . . . 94 HIS CD2 . 7366 1 829 . 1 1 94 94 HIS CE1 C 13 135.2 . . 1 . . . . 94 HIS CE1 . 7366 1 830 . 1 1 94 94 HIS N N 15 119.7 . . 1 . . . . 94 HIS N . 7366 1 831 . 1 1 95 95 HIS H H 1 8.61 . . 1 . . . . 95 HIS H . 7366 1 832 . 1 1 95 95 HIS HA H 1 4.65 . . 1 . . . . 95 HIS HA . 7366 1 833 . 1 1 95 95 HIS HB2 H 1 3.14 . . 2 . . . . 95 HIS HB2 . 7366 1 834 . 1 1 95 95 HIS HB3 H 1 3.14 . . 2 . . . . 95 HIS HB3 . 7366 1 835 . 1 1 95 95 HIS HD2 H 1 7.08 . . 1 . . . . 95 HIS HD2 . 7366 1 836 . 1 1 95 95 HIS HE1 H 1 8.08 . . 1 . . . . 95 HIS HE1 . 7366 1 837 . 1 1 95 95 HIS CA C 13 55.2 . . 1 . . . . 95 HIS CA . 7366 1 838 . 1 1 95 95 HIS CB C 13 28.9 . . 1 . . . . 95 HIS CB . 7366 1 839 . 1 1 95 95 HIS CD2 C 13 119.0 . . 1 . . . . 95 HIS CD2 . 7366 1 840 . 1 1 95 95 HIS CE1 C 13 135.2 . . 1 . . . . 95 HIS CE1 . 7366 1 841 . 1 1 95 95 HIS N N 15 119.3 . . 1 . . . . 95 HIS N . 7366 1 842 . 1 1 96 96 HIS H H 1 8.68 . . 1 . . . . 96 HIS H . 7366 1 843 . 1 1 96 96 HIS HA H 1 4.66 . . 1 . . . . 96 HIS HA . 7366 1 844 . 1 1 96 96 HIS HB2 H 1 3.17 . . 2 . . . . 96 HIS HB2 . 7366 1 845 . 1 1 96 96 HIS HB3 H 1 3.17 . . 2 . . . . 96 HIS HB3 . 7366 1 846 . 1 1 96 96 HIS HD2 H 1 7.08 . . 1 . . . . 96 HIS HD2 . 7366 1 847 . 1 1 96 96 HIS HE1 H 1 8.08 . . 1 . . . . 96 HIS HE1 . 7366 1 848 . 1 1 96 96 HIS CA C 13 55.2 . . 1 . . . . 96 HIS CA . 7366 1 849 . 1 1 96 96 HIS CB C 13 29.1 . . 1 . . . . 96 HIS CB . 7366 1 850 . 1 1 96 96 HIS CD2 C 13 119.0 . . 1 . . . . 96 HIS CD2 . 7366 1 851 . 1 1 96 96 HIS CE1 C 13 135.2 . . 1 . . . . 96 HIS CE1 . 7366 1 852 . 1 1 96 96 HIS N N 15 120.1 . . 1 . . . . 96 HIS N . 7366 1 853 . 1 1 97 97 HIS H H 1 8.58 . . 1 . . . . 97 HIS H . 7366 1 854 . 1 1 97 97 HIS HA H 1 4.66 . . 1 . . . . 97 HIS HA . 7366 1 855 . 1 1 97 97 HIS HB2 H 1 3.27 . . 2 . . . . 97 HIS HB2 . 7366 1 856 . 1 1 97 97 HIS HB3 H 1 3.27 . . 2 . . . . 97 HIS HB3 . 7366 1 857 . 1 1 97 97 HIS HD2 H 1 7.08 . . 1 . . . . 97 HIS HD2 . 7366 1 858 . 1 1 97 97 HIS HE1 H 1 8.08 . . 1 . . . . 97 HIS HE1 . 7366 1 859 . 1 1 97 97 HIS CA C 13 55.4 . . 1 . . . . 97 HIS CA . 7366 1 860 . 1 1 97 97 HIS CB C 13 29.2 . . 1 . . . . 97 HIS CB . 7366 1 861 . 1 1 97 97 HIS CD2 C 13 119.0 . . 1 . . . . 97 HIS CD2 . 7366 1 862 . 1 1 97 97 HIS CE1 C 13 135.2 . . 1 . . . . 97 HIS CE1 . 7366 1 863 . 1 1 97 97 HIS N N 15 120.4 . . 1 . . . . 97 HIS N . 7366 1 864 . 1 1 98 98 HIS H H 1 8.39 . . 1 . . . . 98 HIS H . 7366 1 865 . 1 1 98 98 HIS HA H 1 4.62 . . 1 . . . . 98 HIS HA . 7366 1 866 . 1 1 98 98 HIS HB2 H 1 3.12 . . 2 . . . . 98 HIS HB2 . 7366 1 867 . 1 1 98 98 HIS HB3 H 1 3.12 . . 2 . . . . 98 HIS HB3 . 7366 1 868 . 1 1 98 98 HIS HD2 H 1 7.08 . . 1 . . . . 98 HIS HD2 . 7366 1 869 . 1 1 98 98 HIS HE1 H 1 8.08 . . 1 . . . . 98 HIS HE1 . 7366 1 870 . 1 1 98 98 HIS CA C 13 55.5 . . 1 . . . . 98 HIS CA . 7366 1 871 . 1 1 98 98 HIS CB C 13 29.1 . . 1 . . . . 98 HIS CB . 7366 1 872 . 1 1 98 98 HIS CD2 C 13 119.0 . . 1 . . . . 98 HIS CD2 . 7366 1 873 . 1 1 98 98 HIS CE1 C 13 135.2 . . 1 . . . . 98 HIS CE1 . 7366 1 874 . 1 1 98 98 HIS N N 15 125.3 . . 1 . . . . 98 HIS N . 7366 1 stop_ save_