data_7362 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 7362 _Entry.Title ; NMR Structure of Protein UPF0165 protein AF_2212 from Archaeoglobus Fulgidus; Northeast Structural Genomics Consortium Target GR83 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2007-01-19 _Entry.Accession_date 2007-01-23 _Entry.Last_release_date 2010-03-04 _Entry.Original_release_date 2010-03-04 _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 K. Singarapu K. K. . 7362 2 D. Sukumaran D. K. . 7362 3 D. Parish D. . . 7362 4 H. Atreya H. S. . 7362 5 G. Liu G. . . 7362 6 A. Eletsky A. . . 7362 7 C. Chen C. X. . 7362 8 M. Jiang M. . . 7362 9 K. Cunningham K. . . 7362 10 R. Xiao R. . . 7362 11 G. Swapna G. V.T. . 7362 12 T. Acton T. B. . 7362 13 B. Rost B. . . 7362 14 G. Montelione G. T. . 7362 15 T. Szyperski T. . . 7362 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 7362 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'GFT NMR' 'GFT NMR' 7362 'Homo Dimer Protein' 'Homo Dimer Protein' 7362 NESG NESG 7362 'Northeast Structural Genomics Consortium' 'Northeast Structural Genomics Consortium' 7362 'Protein Structure Initiative' 'Protein Structure Initiative' 7362 PSI-2 PSI-2 7362 'Structural Genomics' 'Structural Genomics' 7362 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 7362 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 229 7362 '15N chemical shifts' 62 7362 '1H chemical shifts' 477 7362 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 . . 2010-03-04 2007-01-19 original author . 7362 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2NWT 'BMRB Entry Tracking System' 7362 stop_ save_ ############### # Citations # ############### save_citations _Citation.Sf_category citations _Citation.Sf_framecode citations _Citation.Entry_ID 7362 _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 'NMR Structure of Protein Y2212_ARCFU from Archaeoglobus Fulgidus; Northeast Structural Genomics Consortium Target GR83' _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev . _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD 0353 _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 K. Singarapu K. K. . 7362 1 2 D. Sukumaran D. K. . 7362 1 3 D. Parish D. . . 7362 1 4 H. Atreya H. S. . 7362 1 5 G. Liu G. . . 7362 1 6 A. Eletsky A. . . 7362 1 7 C. Chen C. X. . 7362 1 8 M. Jiang M. . . 7362 1 9 K. Cunningham K. . . 7362 1 10 L. Ma L. C. . 7362 1 11 R. Xiao R. . . 7362 1 12 J. Liu J. . . 7362 1 13 M. Baran M. . . 7362 1 14 G. Swapna G. V.T. . 7362 1 15 T. Acton T. B. . 7362 1 16 B. Rost B. . . 7362 1 17 G. Montelione G. T. . 7362 1 18 T. Szyperski T. . . 7362 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 7362 _Assembly.ID 1 _Assembly.Name UPF0165 _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'UPF0165 chain A' 1 $UPF0165_protein_AF_2212 A . yes native no no . . . 7362 1 2 'UPF0165 chain B' 1 $UPF0165_protein_AF_2212 B . yes native no no . . . 7362 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_UPF0165_protein_AF_2212 _Entity.Sf_category entity _Entity.Sf_framecode UPF0165_protein_AF_2212 _Entity.Entry_ID 7362 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name UPF0165_protein_AF_2212 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A,B _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MPKIIEAVYENGVFKPLQKV DLKEGERVKIKLELKVEPID LGEPVSVEEIKKIRDGTWMS SLEHHHHHH ; _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 69 _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 PDB 2NWT . "Nmr Structure Of Protein Upf0165 Protein Af_2212 From Archaeoglobus Fulgidus; Northeast Structural Genomics Consortium Target G" . . . . . 100.00 69 100.00 100.00 9.21e-40 . . . . 7362 1 2 no GB AAB89054 . "conserved hypothetical protein [Archaeoglobus fulgidus DSM 4304]" . . . . . 88.41 61 100.00 100.00 1.87e-33 . . . . 7362 1 3 no GB AIG99201 . "hypothetical protein AFULGI_00024860 [Archaeoglobus fulgidus DSM 8774]" . . . . . 88.41 61 98.36 98.36 4.07e-32 . . . . 7362 1 4 no REF NP_071037 . "hypothetical protein AF2212 [Archaeoglobus fulgidus DSM 4304]" . . . . . 88.41 61 100.00 100.00 1.87e-33 . . . . 7362 1 5 no REF WP_010879701 . "antitoxin [Archaeoglobus fulgidus]" . . . . . 88.41 61 100.00 100.00 1.87e-33 . . . . 7362 1 6 no SP O28071 . "RecName: Full=Putative antitoxin VapB21 [Archaeoglobus fulgidus DSM 4304]" . . . . . 88.41 61 100.00 100.00 1.87e-33 . . . . 7362 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 7362 1 'UPF0165 protein AF_2212' RCSB_NAME 7362 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 . 7362 1 2 . PRO . 7362 1 3 . LYS . 7362 1 4 . ILE . 7362 1 5 . ILE . 7362 1 6 . GLU . 7362 1 7 . ALA . 7362 1 8 . VAL . 7362 1 9 . TYR . 7362 1 10 . GLU . 7362 1 11 . ASN . 7362 1 12 . GLY . 7362 1 13 . VAL . 7362 1 14 . PHE . 7362 1 15 . LYS . 7362 1 16 . PRO . 7362 1 17 . LEU . 7362 1 18 . GLN . 7362 1 19 . LYS . 7362 1 20 . VAL . 7362 1 21 . ASP . 7362 1 22 . LEU . 7362 1 23 . LYS . 7362 1 24 . GLU . 7362 1 25 . GLY . 7362 1 26 . GLU . 7362 1 27 . ARG . 7362 1 28 . VAL . 7362 1 29 . LYS . 7362 1 30 . ILE . 7362 1 31 . LYS . 7362 1 32 . LEU . 7362 1 33 . GLU . 7362 1 34 . LEU . 7362 1 35 . LYS . 7362 1 36 . VAL . 7362 1 37 . GLU . 7362 1 38 . PRO . 7362 1 39 . ILE . 7362 1 40 . ASP . 7362 1 41 . LEU . 7362 1 42 . GLY . 7362 1 43 . GLU . 7362 1 44 . PRO . 7362 1 45 . VAL . 7362 1 46 . SER . 7362 1 47 . VAL . 7362 1 48 . GLU . 7362 1 49 . GLU . 7362 1 50 . ILE . 7362 1 51 . LYS . 7362 1 52 . LYS . 7362 1 53 . ILE . 7362 1 54 . ARG . 7362 1 55 . ASP . 7362 1 56 . GLY . 7362 1 57 . THR . 7362 1 58 . TRP . 7362 1 59 . MET . 7362 1 60 . SER . 7362 1 61 . SER . 7362 1 62 . LEU . 7362 1 63 . GLU . 7362 1 64 . HIS . 7362 1 65 . HIS . 7362 1 66 . HIS . 7362 1 67 . HIS . 7362 1 68 . HIS . 7362 1 69 . HIS . 7362 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 7362 1 . PRO 2 2 7362 1 . LYS 3 3 7362 1 . ILE 4 4 7362 1 . ILE 5 5 7362 1 . GLU 6 6 7362 1 . ALA 7 7 7362 1 . VAL 8 8 7362 1 . TYR 9 9 7362 1 . GLU 10 10 7362 1 . ASN 11 11 7362 1 . GLY 12 12 7362 1 . VAL 13 13 7362 1 . PHE 14 14 7362 1 . LYS 15 15 7362 1 . PRO 16 16 7362 1 . LEU 17 17 7362 1 . GLN 18 18 7362 1 . LYS 19 19 7362 1 . VAL 20 20 7362 1 . ASP 21 21 7362 1 . LEU 22 22 7362 1 . LYS 23 23 7362 1 . GLU 24 24 7362 1 . GLY 25 25 7362 1 . GLU 26 26 7362 1 . ARG 27 27 7362 1 . VAL 28 28 7362 1 . LYS 29 29 7362 1 . ILE 30 30 7362 1 . LYS 31 31 7362 1 . LEU 32 32 7362 1 . GLU 33 33 7362 1 . LEU 34 34 7362 1 . LYS 35 35 7362 1 . VAL 36 36 7362 1 . GLU 37 37 7362 1 . PRO 38 38 7362 1 . ILE 39 39 7362 1 . ASP 40 40 7362 1 . LEU 41 41 7362 1 . GLY 42 42 7362 1 . GLU 43 43 7362 1 . PRO 44 44 7362 1 . VAL 45 45 7362 1 . SER 46 46 7362 1 . VAL 47 47 7362 1 . GLU 48 48 7362 1 . GLU 49 49 7362 1 . ILE 50 50 7362 1 . LYS 51 51 7362 1 . LYS 52 52 7362 1 . ILE 53 53 7362 1 . ARG 54 54 7362 1 . ASP 55 55 7362 1 . GLY 56 56 7362 1 . THR 57 57 7362 1 . TRP 58 58 7362 1 . MET 59 59 7362 1 . SER 60 60 7362 1 . SER 61 61 7362 1 . LEU 62 62 7362 1 . GLU 63 63 7362 1 . HIS 64 64 7362 1 . HIS 65 65 7362 1 . HIS 66 66 7362 1 . HIS 67 67 7362 1 . HIS 68 68 7362 1 . HIS 69 69 7362 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 7362 _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 $UPF0165_protein_AF_2212 . 2234 organism . 'Archaeoglobus fulgidus' 'Archaeoglobus fulgidus' . . Archaea . Archaeoglobus fulgidus XL-10 . . . . . . . . . . . . . . . . . . . . 7362 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 7362 _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 $UPF0165_protein_AF_2212 . 'recombinant technology' . . . . . . . . . . . . . . . . . . . . MS . . . . . . . . 7362 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample _Sample.Sf_category sample _Sample.Sf_framecode sample _Sample.Entry_ID 7362 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details '1.2 mM protein Y2212_ARCFU, U-15N,13C, 5mM CaCl, 100mM NaCl, 20mM NH4OAc, 10mM DTT, 0.02%NaN3, 5% D2O, 95% H2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '5% D2O, 95% H2O' _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 UPF0165 '[U-13C; U-15N]' 1 $assembly . . . . 1.2 . . mM . . . . 7362 1 2 NaCl . . . . . . . 5 . . mM . . . . 7362 1 3 NH4OAc . . . . . . . 20 . . mM . . . . 7362 1 4 DTT . . . . . . . 10 . . mM . . . . 7362 1 5 NaN3 . . . . . . . 0.02 . . % . . . . 7362 1 6 D2O . . . . . . . 5 . . % . . . . 7362 1 7 H2O 'natural abundance' . . . . . . 95 . . % . . . . 7362 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 7362 _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' 100 . mM 7362 1 pH 5.5 . pH 7362 1 pressure 1 . atm 7362 1 temperature 298 . K 7362 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 7362 _Software.ID 1 _Software.Name NMRPipe _Software.Version 2.3 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio et al' . . 7362 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 7362 1 stop_ save_ save_DYANA _Software.Sf_category software _Software.Sf_framecode DYANA _Software.Entry_ID 7362 _Software.ID 2 _Software.Name DYANA _Software.Version 1.5 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert et al' . . 7362 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 7362 2 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 7362 _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 et al' . . 7362 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 7362 3 stop_ save_ save_CNS _Software.Sf_category software _Software.Sf_framecode CNS _Software.Entry_ID 7362 _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 'Brunget et al' . . 7362 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 7362 4 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 7362 _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_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 7362 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_600 _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode 600 _NMR_spectrometer_list.Entry_ID 7362 _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 . . . 7362 1 2 spectrometer_2 Varian INOVA . 600 . . . 7362 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 7362 _Experiment_list.ID 1 _Experiment_list.Details 'This Structure was determined using recently developed High Throughput NMR structure determination protocol.' 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 '4,3D, GFT HNNCABCA' no . . . . . . . . . . 1 $sample isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 7362 1 2 '4,3D, GFT CABCACoNNH' no . . . . . . . . . . 1 $sample isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 7362 1 3 '4,3D, GFT HCCH COSY' no . . . . . . . . . . 1 $sample isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 7362 1 4 '3D, 15N-13C resolved simultanious NOESY' no . . . . . . . . . . 1 $sample isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 7362 1 5 '3D, 15N, 13C resolved X-filtered NOESY' no . . . . . . . . . . 1 $sample isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 7362 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 7362 _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 7362 _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_ _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 3 3 LYS HA H 1 4.47 . . 1 . . . . 3 LYS HA . 7362 1 2 . 1 1 3 3 LYS HB2 H 1 1.79 . . 2 . . . . 3 LYS HB2 . 7362 1 3 . 1 1 3 3 LYS HB3 H 1 1.73 . . 2 . . . . 3 LYS HB3 . 7362 1 4 . 1 1 3 3 LYS HD2 H 1 1.66 . . 2 . . . . 3 LYS HD2 . 7362 1 5 . 1 1 3 3 LYS HD3 H 1 1.64 . . 2 . . . . 3 LYS HD3 . 7362 1 6 . 1 1 3 3 LYS HE2 H 1 2.96 . . 2 . . . . 3 LYS HE2 . 7362 1 7 . 1 1 3 3 LYS HE3 H 1 2.96 . . 2 . . . . 3 LYS HE3 . 7362 1 8 . 1 1 3 3 LYS HG2 H 1 1.38 . . 2 . . . . 3 LYS HG2 . 7362 1 9 . 1 1 3 3 LYS HG3 H 1 1.40 . . 2 . . . . 3 LYS HG3 . 7362 1 10 . 1 1 3 3 LYS CA C 13 56.3 . . 1 . . . . 3 LYS CA . 7362 1 11 . 1 1 3 3 LYS CB C 13 34.1 . . 1 . . . . 3 LYS CB . 7362 1 12 . 1 1 3 3 LYS CD C 13 29.2 . . 1 . . . . 3 LYS CD . 7362 1 13 . 1 1 3 3 LYS CE C 13 42.1 . . 1 . . . . 3 LYS CE . 7362 1 14 . 1 1 3 3 LYS CG C 13 25.1 . . 1 . . . . 3 LYS CG . 7362 1 15 . 1 1 4 4 ILE H H 1 8.24 . . 1 . . . . 4 ILE HN . 7362 1 16 . 1 1 4 4 ILE HA H 1 4.76 . . 1 . . . . 4 ILE HA . 7362 1 17 . 1 1 4 4 ILE HB H 1 1.72 . . 1 . . . . 4 ILE HB . 7362 1 18 . 1 1 4 4 ILE HD11 H 1 0.78 . . 1 . . . . 4 ILE HD1 . 7362 1 19 . 1 1 4 4 ILE HD12 H 1 0.78 . . 1 . . . . 4 ILE HD1 . 7362 1 20 . 1 1 4 4 ILE HD13 H 1 0.78 . . 1 . . . . 4 ILE HD1 . 7362 1 21 . 1 1 4 4 ILE HG12 H 1 0.97 . . 2 . . . . 4 ILE HG12 . 7362 1 22 . 1 1 4 4 ILE HG13 H 1 1.47 . . 2 . . . . 4 ILE HG13 . 7362 1 23 . 1 1 4 4 ILE HG21 H 1 0.73 . . 1 . . . . 4 ILE HG2 . 7362 1 24 . 1 1 4 4 ILE HG22 H 1 0.73 . . 1 . . . . 4 ILE HG2 . 7362 1 25 . 1 1 4 4 ILE HG23 H 1 0.73 . . 1 . . . . 4 ILE HG2 . 7362 1 26 . 1 1 4 4 ILE CA C 13 59.9 . . 1 . . . . 4 ILE CA . 7362 1 27 . 1 1 4 4 ILE CB C 13 39.1 . . 1 . . . . 4 ILE CB . 7362 1 28 . 1 1 4 4 ILE CD1 C 13 13.1 . . 1 . . . . 4 ILE CD1 . 7362 1 29 . 1 1 4 4 ILE CG1 C 13 28.0 . . 1 . . . . 4 ILE CG1 . 7362 1 30 . 1 1 4 4 ILE CG2 C 13 18.1 . . 1 . . . . 4 ILE CG2 . 7362 1 31 . 1 1 4 4 ILE N N 15 123.7 . . 1 . . . . 4 ILE N . 7362 1 32 . 1 1 5 5 ILE H H 1 8.96 . . 1 . . . . 5 ILE HN . 7362 1 33 . 1 1 5 5 ILE HA H 1 4.51 . . 1 . . . . 5 ILE HA . 7362 1 34 . 1 1 5 5 ILE HB H 1 1.75 . . 1 . . . . 5 ILE HB . 7362 1 35 . 1 1 5 5 ILE HD11 H 1 0.79 . . 1 . . . . 5 ILE HD1 . 7362 1 36 . 1 1 5 5 ILE HD12 H 1 0.79 . . 1 . . . . 5 ILE HD1 . 7362 1 37 . 1 1 5 5 ILE HD13 H 1 0.79 . . 1 . . . . 5 ILE HD1 . 7362 1 38 . 1 1 5 5 ILE HG12 H 1 0.96 . . 2 . . . . 5 ILE HG12 . 7362 1 39 . 1 1 5 5 ILE HG13 H 1 1.33 . . 2 . . . . 5 ILE HG13 . 7362 1 40 . 1 1 5 5 ILE HG21 H 1 0.83 . . 1 . . . . 5 ILE HG2 . 7362 1 41 . 1 1 5 5 ILE HG22 H 1 0.83 . . 1 . . . . 5 ILE HG2 . 7362 1 42 . 1 1 5 5 ILE HG23 H 1 0.83 . . 1 . . . . 5 ILE HG2 . 7362 1 43 . 1 1 5 5 ILE CA C 13 58.9 . . 1 . . . . 5 ILE CA . 7362 1 44 . 1 1 5 5 ILE CB C 13 42.0 . . 1 . . . . 5 ILE CB . 7362 1 45 . 1 1 5 5 ILE CD1 C 13 14.7 . . 1 . . . . 5 ILE CD1 . 7362 1 46 . 1 1 5 5 ILE CG1 C 13 27.1 . . 1 . . . . 5 ILE CG1 . 7362 1 47 . 1 1 5 5 ILE CG2 C 13 18.0 . . 1 . . . . 5 ILE CG2 . 7362 1 48 . 1 1 5 5 ILE N N 15 125.1 . . 1 . . . . 5 ILE N . 7362 1 49 . 1 1 6 6 GLU H H 1 8.57 . . 1 . . . . 6 GLU HN . 7362 1 50 . 1 1 6 6 GLU HA H 1 4.91 . . 1 . . . . 6 GLU HA . 7362 1 51 . 1 1 6 6 GLU HB2 H 1 2.06 . . 2 . . . . 6 GLU HB2 . 7362 1 52 . 1 1 6 6 GLU HB3 H 1 1.93 . . 2 . . . . 6 GLU HB3 . 7362 1 53 . 1 1 6 6 GLU HG2 H 1 2.36 . . 2 . . . . 6 GLU HG2 . 7362 1 54 . 1 1 6 6 GLU HG3 H 1 2.17 . . 2 . . . . 6 GLU HG3 . 7362 1 55 . 1 1 6 6 GLU CA C 13 55.9 . . 1 . . . . 6 GLU CA . 7362 1 56 . 1 1 6 6 GLU CB C 13 31.5 . . 1 . . . . 6 GLU CB . 7362 1 57 . 1 1 6 6 GLU CG C 13 37.1 . . 1 . . . . 6 GLU CG . 7362 1 58 . 1 1 6 6 GLU N N 15 124.8 . . 1 . . . . 6 GLU N . 7362 1 59 . 1 1 7 7 ALA H H 1 9.03 . . 1 . . . . 7 ALA HN . 7362 1 60 . 1 1 7 7 ALA HA H 1 5.27 . . 1 . . . . 7 ALA HA . 7362 1 61 . 1 1 7 7 ALA HB1 H 1 1.16 . . 1 . . . . 7 ALA HB . 7362 1 62 . 1 1 7 7 ALA HB2 H 1 1.16 . . 1 . . . . 7 ALA HB . 7362 1 63 . 1 1 7 7 ALA HB3 H 1 1.16 . . 1 . . . . 7 ALA HB . 7362 1 64 . 1 1 7 7 ALA CA C 13 51.0 . . 1 . . . . 7 ALA CA . 7362 1 65 . 1 1 7 7 ALA CB C 13 24.1 . . 1 . . . . 7 ALA CB . 7362 1 66 . 1 1 7 7 ALA N N 15 124.7 . . 1 . . . . 7 ALA N . 7362 1 67 . 1 1 8 8 VAL H H 1 8.55 . . 1 . . . . 8 VAL HN . 7362 1 68 . 1 1 8 8 VAL HA H 1 5.09 . . 1 . . . . 8 VAL HA . 7362 1 69 . 1 1 8 8 VAL HB H 1 1.90 . . 1 . . . . 8 VAL HB . 7362 1 70 . 1 1 8 8 VAL HG11 H 1 0.91 . . 2 . . . . 8 VAL HG1 . 7362 1 71 . 1 1 8 8 VAL HG12 H 1 0.91 . . 2 . . . . 8 VAL HG1 . 7362 1 72 . 1 1 8 8 VAL HG13 H 1 0.91 . . 2 . . . . 8 VAL HG1 . 7362 1 73 . 1 1 8 8 VAL HG21 H 1 0.92 . . 2 . . . . 8 VAL HG2 . 7362 1 74 . 1 1 8 8 VAL HG22 H 1 0.92 . . 2 . . . . 8 VAL HG2 . 7362 1 75 . 1 1 8 8 VAL HG23 H 1 0.92 . . 2 . . . . 8 VAL HG2 . 7362 1 76 . 1 1 8 8 VAL CA C 13 59.8 . . 1 . . . . 8 VAL CA . 7362 1 77 . 1 1 8 8 VAL CB C 13 35.6 . . 1 . . . . 8 VAL CB . 7362 1 78 . 1 1 8 8 VAL CG1 C 13 21.8 . . 1 . . . . 8 VAL CG1 . 7362 1 79 . 1 1 8 8 VAL CG2 C 13 21.0 . . 1 . . . . 8 VAL CG2 . 7362 1 80 . 1 1 8 8 VAL N N 15 118.4 . . 1 . . . . 8 VAL N . 7362 1 81 . 1 1 9 9 TYR H H 1 8.93 . . 1 . . . . 9 TYR HN . 7362 1 82 . 1 1 9 9 TYR HA H 1 5.04 . . 1 . . . . 9 TYR HA . 7362 1 83 . 1 1 9 9 TYR HB2 H 1 3.02 . . 2 . . . . 9 TYR HB2 . 7362 1 84 . 1 1 9 9 TYR HB3 H 1 2.41 . . 2 . . . . 9 TYR HB3 . 7362 1 85 . 1 1 9 9 TYR HD1 H 1 6.01 . . 3 . . . . 9 TYR HD1 . 7362 1 86 . 1 1 9 9 TYR HD2 H 1 6.01 . . 3 . . . . 9 TYR HD2 . 7362 1 87 . 1 1 9 9 TYR HE1 H 1 6.18 . . 3 . . . . 9 TYR HE1 . 7362 1 88 . 1 1 9 9 TYR HE2 H 1 6.18 . . 3 . . . . 9 TYR HE2 . 7362 1 89 . 1 1 9 9 TYR CA C 13 56.3 . . 1 . . . . 9 TYR CA . 7362 1 90 . 1 1 9 9 TYR CB C 13 38.7 . . 1 . . . . 9 TYR CB . 7362 1 91 . 1 1 9 9 TYR CD1 C 13 133.4 . . 1 . . . . 9 TYR CD1 . 7362 1 92 . 1 1 9 9 TYR CE1 C 13 116.8 . . 1 . . . . 9 TYR CE1 . 7362 1 93 . 1 1 9 9 TYR N N 15 129.8 . . 1 . . . . 9 TYR N . 7362 1 94 . 1 1 10 10 GLU H H 1 8.53 . . 1 . . . . 10 GLU HN . 7362 1 95 . 1 1 10 10 GLU HA H 1 4.36 . . 1 . . . . 10 GLU HA . 7362 1 96 . 1 1 10 10 GLU HB2 H 1 1.81 . . 2 . . . . 10 GLU HB2 . 7362 1 97 . 1 1 10 10 GLU HB3 H 1 1.72 . . 2 . . . . 10 GLU HB3 . 7362 1 98 . 1 1 10 10 GLU HG2 H 1 2.03 . . 2 . . . . 10 GLU HG2 . 7362 1 99 . 1 1 10 10 GLU HG3 H 1 2.09 . . 2 . . . . 10 GLU HG3 . 7362 1 100 . 1 1 10 10 GLU CA C 13 55.0 . . 1 . . . . 10 GLU CA . 7362 1 101 . 1 1 10 10 GLU CB C 13 33.2 . . 1 . . . . 10 GLU CB . 7362 1 102 . 1 1 10 10 GLU CG C 13 35.9 . . 1 . . . . 10 GLU CG . 7362 1 103 . 1 1 10 10 GLU N N 15 126.5 . . 1 . . . . 10 GLU N . 7362 1 104 . 1 1 11 11 ASN H H 1 10.40 . . 1 . . . . 11 ASN HN . 7362 1 105 . 1 1 11 11 ASN HA H 1 4.21 . . 1 . . . . 11 ASN HA . 7362 1 106 . 1 1 11 11 ASN HB2 H 1 2.96 . . 2 . . . . 11 ASN HB2 . 7362 1 107 . 1 1 11 11 ASN HB3 H 1 2.67 . . 2 . . . . 11 ASN HB3 . 7362 1 108 . 1 1 11 11 ASN HD21 H 1 7.49 . . 2 . . . . 11 ASN HD21 . 7362 1 109 . 1 1 11 11 ASN HD22 H 1 6.82 . . 2 . . . . 11 ASN HD22 . 7362 1 110 . 1 1 11 11 ASN CA C 13 54.1 . . 1 . . . . 11 ASN CA . 7362 1 111 . 1 1 11 11 ASN CB C 13 38.0 . . 1 . . . . 11 ASN CB . 7362 1 112 . 1 1 11 11 ASN N N 15 123.2 . . 1 . . . . 11 ASN N . 7362 1 113 . 1 1 11 11 ASN ND2 N 15 112.4 . . 1 . . . . 11 ASN ND2 . 7362 1 114 . 1 1 12 12 GLY H H 1 8.16 . . 1 . . . . 12 GLY HN . 7362 1 115 . 1 1 12 12 GLY HA2 H 1 3.45 . . 2 . . . . 12 GLY HA1 . 7362 1 116 . 1 1 12 12 GLY HA3 H 1 3.97 . . 2 . . . . 12 GLY HA2 . 7362 1 117 . 1 1 12 12 GLY CA C 13 45.4 . . 1 . . . . 12 GLY CA . 7362 1 118 . 1 1 12 12 GLY N N 15 102.8 . . 1 . . . . 12 GLY N . 7362 1 119 . 1 1 13 13 VAL H H 1 7.35 . . 1 . . . . 13 VAL HN . 7362 1 120 . 1 1 13 13 VAL HA H 1 4.89 . . 1 . . . . 13 VAL HA . 7362 1 121 . 1 1 13 13 VAL HB H 1 2.08 . . 1 . . . . 13 VAL HB . 7362 1 122 . 1 1 13 13 VAL HG11 H 1 0.94 . . 2 . . . . 13 VAL HG1 . 7362 1 123 . 1 1 13 13 VAL HG12 H 1 0.94 . . 2 . . . . 13 VAL HG1 . 7362 1 124 . 1 1 13 13 VAL HG13 H 1 0.94 . . 2 . . . . 13 VAL HG1 . 7362 1 125 . 1 1 13 13 VAL HG21 H 1 0.81 . . 2 . . . . 13 VAL HG2 . 7362 1 126 . 1 1 13 13 VAL HG22 H 1 0.81 . . 2 . . . . 13 VAL HG2 . 7362 1 127 . 1 1 13 13 VAL HG23 H 1 0.81 . . 2 . . . . 13 VAL HG2 . 7362 1 128 . 1 1 13 13 VAL CA C 13 58.6 . . 1 . . . . 13 VAL CA . 7362 1 129 . 1 1 13 13 VAL CB C 13 35.9 . . 1 . . . . 13 VAL CB . 7362 1 130 . 1 1 13 13 VAL CG1 C 13 22.3 . . 1 . . . . 13 VAL CG1 . 7362 1 131 . 1 1 13 13 VAL CG2 C 13 18.0 . . 1 . . . . 13 VAL CG2 . 7362 1 132 . 1 1 13 13 VAL N N 15 112.0 . . 1 . . . . 13 VAL N . 7362 1 133 . 1 1 14 14 PHE H H 1 8.89 . . 1 . . . . 14 PHE HN . 7362 1 134 . 1 1 14 14 PHE HA H 1 5.31 . . 1 . . . . 14 PHE HA . 7362 1 135 . 1 1 14 14 PHE HB2 H 1 2.58 . . 2 . . . . 14 PHE HB2 . 7362 1 136 . 1 1 14 14 PHE HB3 H 1 3.33 . . 2 . . . . 14 PHE HB3 . 7362 1 137 . 1 1 14 14 PHE HD1 H 1 7.01 . . 3 . . . . 14 PHE HD1 . 7362 1 138 . 1 1 14 14 PHE HD2 H 1 7.01 . . 3 . . . . 14 PHE HD2 . 7362 1 139 . 1 1 14 14 PHE HE1 H 1 6.97 . . 3 . . . . 14 PHE HE1 . 7362 1 140 . 1 1 14 14 PHE HE2 H 1 6.97 . . 3 . . . . 14 PHE HE2 . 7362 1 141 . 1 1 14 14 PHE HZ H 1 6.83 . . 1 . . . . 14 PHE HZ . 7362 1 142 . 1 1 14 14 PHE CA C 13 56.7 . . 1 . . . . 14 PHE CA . 7362 1 143 . 1 1 14 14 PHE CB C 13 40.6 . . 1 . . . . 14 PHE CB . 7362 1 144 . 1 1 14 14 PHE CD1 C 13 131.0 . . 1 . . . . 14 PHE CD1 . 7362 1 145 . 1 1 14 14 PHE CE1 C 13 130.4 . . 1 . . . . 14 PHE CE1 . 7362 1 146 . 1 1 14 14 PHE CZ C 13 129.3 . . 1 . . . . 14 PHE CZ . 7362 1 147 . 1 1 14 14 PHE N N 15 114.2 . . 1 . . . . 14 PHE N . 7362 1 148 . 1 1 15 15 LYS H H 1 9.75 . . 1 . . . . 15 LYS HN . 7362 1 149 . 1 1 15 15 LYS HA H 1 5.06 . . 1 . . . . 15 LYS HA . 7362 1 150 . 1 1 15 15 LYS HB2 H 1 2.01 . . 2 . . . . 15 LYS HB2 . 7362 1 151 . 1 1 15 15 LYS HB3 H 1 1.88 . . 2 . . . . 15 LYS HB3 . 7362 1 152 . 1 1 15 15 LYS HD2 H 1 1.63 . . 2 . . . . 15 LYS HD2 . 7362 1 153 . 1 1 15 15 LYS HD3 H 1 1.63 . . 2 . . . . 15 LYS HD3 . 7362 1 154 . 1 1 15 15 LYS HE2 H 1 2.83 . . 2 . . . . 15 LYS HE2 . 7362 1 155 . 1 1 15 15 LYS HE3 H 1 2.83 . . 2 . . . . 15 LYS HE3 . 7362 1 156 . 1 1 15 15 LYS HG2 H 1 1.52 . . 2 . . . . 15 LYS HG2 . 7362 1 157 . 1 1 15 15 LYS HG3 H 1 1.29 . . 2 . . . . 15 LYS HG3 . 7362 1 158 . 1 1 15 15 LYS CA C 13 53.2 . . 1 . . . . 15 LYS CA . 7362 1 159 . 1 1 15 15 LYS CB C 13 33.1 . . 1 . . . . 15 LYS CB . 7362 1 160 . 1 1 15 15 LYS CD C 13 29.7 . . 1 . . . . 15 LYS CD . 7362 1 161 . 1 1 15 15 LYS CE C 13 42.1 . . 1 . . . . 15 LYS CE . 7362 1 162 . 1 1 15 15 LYS CG C 13 25.2 . . 1 . . . . 15 LYS CG . 7362 1 163 . 1 1 15 15 LYS N N 15 127.7 . . 1 . . . . 15 LYS N . 7362 1 164 . 1 1 16 16 PRO HA H 1 4.79 . . 1 . . . . 16 PRO HA . 7362 1 165 . 1 1 16 16 PRO HB2 H 1 2.23 . . 2 . . . . 16 PRO HB2 . 7362 1 166 . 1 1 16 16 PRO HB3 H 1 2.63 . . 2 . . . . 16 PRO HB3 . 7362 1 167 . 1 1 16 16 PRO HD2 H 1 4.48 . . 2 . . . . 16 PRO HD2 . 7362 1 168 . 1 1 16 16 PRO HD3 H 1 4.33 . . 2 . . . . 16 PRO HD3 . 7362 1 169 . 1 1 16 16 PRO HG2 H 1 2.48 . . 2 . . . . 16 PRO HG2 . 7362 1 170 . 1 1 16 16 PRO HG3 H 1 2.04 . . 2 . . . . 16 PRO HG3 . 7362 1 171 . 1 1 16 16 PRO CA C 13 62.3 . . 1 . . . . 16 PRO CA . 7362 1 172 . 1 1 16 16 PRO CB C 13 33.2 . . 1 . . . . 16 PRO CB . 7362 1 173 . 1 1 16 16 PRO CD C 13 52.1 . . 1 . . . . 16 PRO CD . 7362 1 174 . 1 1 16 16 PRO CG C 13 28.1 . . 1 . . . . 16 PRO CG . 7362 1 175 . 1 1 17 17 LEU H H 1 8.86 . . 1 . . . . 17 LEU HN . 7362 1 176 . 1 1 17 17 LEU HA H 1 4.44 . . 1 . . . . 17 LEU HA . 7362 1 177 . 1 1 17 17 LEU HB2 H 1 1.74 . . 2 . . . . 17 LEU HB2 . 7362 1 178 . 1 1 17 17 LEU HB3 H 1 1.51 . . 2 . . . . 17 LEU HB3 . 7362 1 179 . 1 1 17 17 LEU HD11 H 1 0.82 . . 2 . . . . 17 LEU HD1 . 7362 1 180 . 1 1 17 17 LEU HD12 H 1 0.82 . . 2 . . . . 17 LEU HD1 . 7362 1 181 . 1 1 17 17 LEU HD13 H 1 0.82 . . 2 . . . . 17 LEU HD1 . 7362 1 182 . 1 1 17 17 LEU HD21 H 1 0.84 . . 2 . . . . 17 LEU HD2 . 7362 1 183 . 1 1 17 17 LEU HD22 H 1 0.84 . . 2 . . . . 17 LEU HD2 . 7362 1 184 . 1 1 17 17 LEU HD23 H 1 0.84 . . 2 . . . . 17 LEU HD2 . 7362 1 185 . 1 1 17 17 LEU HG H 1 1.59 . . 1 . . . . 17 LEU HG . 7362 1 186 . 1 1 17 17 LEU CA C 13 55.0 . . 1 . . . . 17 LEU CA . 7362 1 187 . 1 1 17 17 LEU CB C 13 41.5 . . 1 . . . . 17 LEU CB . 7362 1 188 . 1 1 17 17 LEU CD1 C 13 25.4 . . 1 . . . . 17 LEU CD1 . 7362 1 189 . 1 1 17 17 LEU CD2 C 13 22.7 . . 1 . . . . 17 LEU CD2 . 7362 1 190 . 1 1 17 17 LEU CG C 13 27.9 . . 1 . . . . 17 LEU CG . 7362 1 191 . 1 1 17 17 LEU N N 15 122.5 . . 1 . . . . 17 LEU N . 7362 1 192 . 1 1 18 18 GLN H H 1 7.45 . . 1 . . . . 18 GLN HN . 7362 1 193 . 1 1 18 18 GLN HA H 1 4.60 . . 1 . . . . 18 GLN HA . 7362 1 194 . 1 1 18 18 GLN HB2 H 1 2.19 . . 2 . . . . 18 GLN HB2 . 7362 1 195 . 1 1 18 18 GLN HB3 H 1 2.04 . . 2 . . . . 18 GLN HB3 . 7362 1 196 . 1 1 18 18 GLN HE21 H 1 7.70 . . 2 . . . . 18 GLN HE21 . 7362 1 197 . 1 1 18 18 GLN HE22 H 1 6.95 . . 2 . . . . 18 GLN HE22 . 7362 1 198 . 1 1 18 18 GLN HG2 H 1 2.25 . . 2 . . . . 18 GLN HG2 . 7362 1 199 . 1 1 18 18 GLN HG3 H 1 2.34 . . 2 . . . . 18 GLN HG3 . 7362 1 200 . 1 1 18 18 GLN CA C 13 53.7 . . 1 . . . . 18 GLN CA . 7362 1 201 . 1 1 18 18 GLN CB C 13 32.6 . . 1 . . . . 18 GLN CB . 7362 1 202 . 1 1 18 18 GLN CG C 13 34.4 . . 1 . . . . 18 GLN CG . 7362 1 203 . 1 1 18 18 GLN N N 15 115.6 . . 1 . . . . 18 GLN N . 7362 1 204 . 1 1 18 18 GLN NE2 N 15 112.4 . . 1 . . . . 18 GLN NE2 . 7362 1 205 . 1 1 19 19 LYS H H 1 8.30 . . 1 . . . . 19 LYS HN . 7362 1 206 . 1 1 19 19 LYS HA H 1 4.15 . . 1 . . . . 19 LYS HA . 7362 1 207 . 1 1 19 19 LYS HB2 H 1 1.74 . . 2 . . . . 19 LYS HB2 . 7362 1 208 . 1 1 19 19 LYS HB3 H 1 1.76 . . 2 . . . . 19 LYS HB3 . 7362 1 209 . 1 1 19 19 LYS HD2 H 1 1.67 . . 2 . . . . 19 LYS HD2 . 7362 1 210 . 1 1 19 19 LYS HD3 H 1 1.67 . . 2 . . . . 19 LYS HD3 . 7362 1 211 . 1 1 19 19 LYS HG2 H 1 1.46 . . 2 . . . . 19 LYS HG2 . 7362 1 212 . 1 1 19 19 LYS HG3 H 1 1.35 . . 2 . . . . 19 LYS HG3 . 7362 1 213 . 1 1 19 19 LYS CA C 13 57.3 . . 1 . . . . 19 LYS CA . 7362 1 214 . 1 1 19 19 LYS CB C 13 32.9 . . 1 . . . . 19 LYS CB . 7362 1 215 . 1 1 19 19 LYS CD C 13 29.4 . . 1 . . . . 19 LYS CD . 7362 1 216 . 1 1 19 19 LYS CG C 13 24.9 . . 1 . . . . 19 LYS CG . 7362 1 217 . 1 1 19 19 LYS N N 15 120.3 . . 1 . . . . 19 LYS N . 7362 1 218 . 1 1 20 20 VAL H H 1 8.41 . . 1 . . . . 20 VAL HN . 7362 1 219 . 1 1 20 20 VAL HA H 1 4.24 . . 1 . . . . 20 VAL HA . 7362 1 220 . 1 1 20 20 VAL HB H 1 1.89 . . 1 . . . . 20 VAL HB . 7362 1 221 . 1 1 20 20 VAL HG11 H 1 0.65 . . 2 . . . . 20 VAL HG1 . 7362 1 222 . 1 1 20 20 VAL HG12 H 1 0.65 . . 2 . . . . 20 VAL HG1 . 7362 1 223 . 1 1 20 20 VAL HG13 H 1 0.65 . . 2 . . . . 20 VAL HG1 . 7362 1 224 . 1 1 20 20 VAL HG21 H 1 0.80 . . 2 . . . . 20 VAL HG2 . 7362 1 225 . 1 1 20 20 VAL HG22 H 1 0.80 . . 2 . . . . 20 VAL HG2 . 7362 1 226 . 1 1 20 20 VAL HG23 H 1 0.80 . . 2 . . . . 20 VAL HG2 . 7362 1 227 . 1 1 20 20 VAL CA C 13 60.5 . . 1 . . . . 20 VAL CA . 7362 1 228 . 1 1 20 20 VAL CB C 13 34.3 . . 1 . . . . 20 VAL CB . 7362 1 229 . 1 1 20 20 VAL CG1 C 13 22.2 . . 1 . . . . 20 VAL CG1 . 7362 1 230 . 1 1 20 20 VAL CG2 C 13 21.1 . . 1 . . . . 20 VAL CG2 . 7362 1 231 . 1 1 20 20 VAL N N 15 121.7 . . 1 . . . . 20 VAL N . 7362 1 232 . 1 1 21 21 ASP H H 1 8.56 . . 1 . . . . 21 ASP HN . 7362 1 233 . 1 1 21 21 ASP HA H 1 4.76 . . 1 . . . . 21 ASP HA . 7362 1 234 . 1 1 21 21 ASP HB2 H 1 2.48 . . 2 . . . . 21 ASP HB2 . 7362 1 235 . 1 1 21 21 ASP HB3 H 1 2.67 . . 2 . . . . 21 ASP HB3 . 7362 1 236 . 1 1 21 21 ASP CA C 13 53.0 . . 1 . . . . 21 ASP CA . 7362 1 237 . 1 1 21 21 ASP CB C 13 40.4 . . 1 . . . . 21 ASP CB . 7362 1 238 . 1 1 21 21 ASP N N 15 125.8 . . 1 . . . . 21 ASP N . 7362 1 239 . 1 1 22 22 LEU H H 1 6.76 . . 1 . . . . 22 LEU HN . 7362 1 240 . 1 1 22 22 LEU HA H 1 4.41 . . 1 . . . . 22 LEU HA . 7362 1 241 . 1 1 22 22 LEU HB2 H 1 0.69 . . 2 . . . . 22 LEU HB2 . 7362 1 242 . 1 1 22 22 LEU HB3 H 1 1.18 . . 2 . . . . 22 LEU HB3 . 7362 1 243 . 1 1 22 22 LEU HD11 H 1 0.54 . . 2 . . . . 22 LEU HD1 . 7362 1 244 . 1 1 22 22 LEU HD12 H 1 0.54 . . 2 . . . . 22 LEU HD1 . 7362 1 245 . 1 1 22 22 LEU HD13 H 1 0.54 . . 2 . . . . 22 LEU HD1 . 7362 1 246 . 1 1 22 22 LEU HD21 H 1 0.75 . . 2 . . . . 22 LEU HD2 . 7362 1 247 . 1 1 22 22 LEU HD22 H 1 0.75 . . 2 . . . . 22 LEU HD2 . 7362 1 248 . 1 1 22 22 LEU HD23 H 1 0.75 . . 2 . . . . 22 LEU HD2 . 7362 1 249 . 1 1 22 22 LEU HG H 1 1.22 . . 1 . . . . 22 LEU HG . 7362 1 250 . 1 1 22 22 LEU CA C 13 53.4 . . 1 . . . . 22 LEU CA . 7362 1 251 . 1 1 22 22 LEU CB C 13 45.5 . . 1 . . . . 22 LEU CB . 7362 1 252 . 1 1 22 22 LEU CD1 C 13 26.6 . . 1 . . . . 22 LEU CD1 . 7362 1 253 . 1 1 22 22 LEU CD2 C 13 24.0 . . 1 . . . . 22 LEU CD2 . 7362 1 254 . 1 1 22 22 LEU CG C 13 27.2 . . 1 . . . . 22 LEU CG . 7362 1 255 . 1 1 22 22 LEU N N 15 121.2 . . 1 . . . . 22 LEU N . 7362 1 256 . 1 1 23 23 LYS H H 1 8.70 . . 1 . . . . 23 LYS HN . 7362 1 257 . 1 1 23 23 LYS HA H 1 4.34 . . 1 . . . . 23 LYS HA . 7362 1 258 . 1 1 23 23 LYS HB2 H 1 1.78 . . 2 . . . . 23 LYS HB2 . 7362 1 259 . 1 1 23 23 LYS HB3 H 1 1.81 . . 2 . . . . 23 LYS HB3 . 7362 1 260 . 1 1 23 23 LYS HD2 H 1 1.69 . . 2 . . . . 23 LYS HD2 . 7362 1 261 . 1 1 23 23 LYS HD3 H 1 1.69 . . 2 . . . . 23 LYS HD3 . 7362 1 262 . 1 1 23 23 LYS HE2 H 1 3.00 . . 2 . . . . 23 LYS HE2 . 7362 1 263 . 1 1 23 23 LYS HE3 H 1 3.00 . . 2 . . . . 23 LYS HE3 . 7362 1 264 . 1 1 23 23 LYS HG2 H 1 1.53 . . 2 . . . . 23 LYS HG2 . 7362 1 265 . 1 1 23 23 LYS HG3 H 1 1.52 . . 2 . . . . 23 LYS HG3 . 7362 1 266 . 1 1 23 23 LYS CA C 13 55.6 . . 1 . . . . 23 LYS CA . 7362 1 267 . 1 1 23 23 LYS CB C 13 33.5 . . 1 . . . . 23 LYS CB . 7362 1 268 . 1 1 23 23 LYS CD C 13 29.3 . . 1 . . . . 23 LYS CD . 7362 1 269 . 1 1 23 23 LYS CE C 13 42.1 . . 1 . . . . 23 LYS CE . 7362 1 270 . 1 1 23 23 LYS CG C 13 25.0 . . 1 . . . . 23 LYS CG . 7362 1 271 . 1 1 23 23 LYS N N 15 121.3 . . 1 . . . . 23 LYS N . 7362 1 272 . 1 1 24 24 GLU H H 1 8.41 . . 1 . . . . 24 GLU HN . 7362 1 273 . 1 1 24 24 GLU HA H 1 4.03 . . 1 . . . . 24 GLU HA . 7362 1 274 . 1 1 24 24 GLU HB2 H 1 2.02 . . 2 . . . . 24 GLU HB2 . 7362 1 275 . 1 1 24 24 GLU HB3 H 1 1.99 . . 2 . . . . 24 GLU HB3 . 7362 1 276 . 1 1 24 24 GLU HG2 H 1 2.39 . . 2 . . . . 24 GLU HG2 . 7362 1 277 . 1 1 24 24 GLU HG3 H 1 2.29 . . 2 . . . . 24 GLU HG3 . 7362 1 278 . 1 1 24 24 GLU CA C 13 58.3 . . 1 . . . . 24 GLU CA . 7362 1 279 . 1 1 24 24 GLU CB C 13 29.6 . . 1 . . . . 24 GLU CB . 7362 1 280 . 1 1 24 24 GLU CG C 13 35.5 . . 1 . . . . 24 GLU CG . 7362 1 281 . 1 1 24 24 GLU N N 15 122.1 . . 1 . . . . 24 GLU N . 7362 1 282 . 1 1 25 25 GLY H H 1 9.63 . . 1 . . . . 25 GLY HN . 7362 1 283 . 1 1 25 25 GLY HA2 H 1 4.29 . . 2 . . . . 25 GLY HA1 . 7362 1 284 . 1 1 25 25 GLY HA3 H 1 3.55 . . 2 . . . . 25 GLY HA2 . 7362 1 285 . 1 1 25 25 GLY CA C 13 45.5 . . 1 . . . . 25 GLY CA . 7362 1 286 . 1 1 25 25 GLY N N 15 116.0 . . 1 . . . . 25 GLY N . 7362 1 287 . 1 1 26 26 GLU H H 1 8.02 . . 1 . . . . 26 GLU HN . 7362 1 288 . 1 1 26 26 GLU HA H 1 4.16 . . 1 . . . . 26 GLU HA . 7362 1 289 . 1 1 26 26 GLU HB2 H 1 2.37 . . 2 . . . . 26 GLU HB2 . 7362 1 290 . 1 1 26 26 GLU HB3 H 1 2.00 . . 2 . . . . 26 GLU HB3 . 7362 1 291 . 1 1 26 26 GLU HG2 H 1 2.40 . . 2 . . . . 26 GLU HG2 . 7362 1 292 . 1 1 26 26 GLU HG3 H 1 2.26 . . 2 . . . . 26 GLU HG3 . 7362 1 293 . 1 1 26 26 GLU CA C 13 58.0 . . 1 . . . . 26 GLU CA . 7362 1 294 . 1 1 26 26 GLU CB C 13 30.9 . . 1 . . . . 26 GLU CB . 7362 1 295 . 1 1 26 26 GLU CG C 13 36.6 . . 1 . . . . 26 GLU CG . 7362 1 296 . 1 1 26 26 GLU N N 15 122.2 . . 1 . . . . 26 GLU N . 7362 1 297 . 1 1 27 27 ARG H H 1 8.61 . . 1 . . . . 27 ARG HN . 7362 1 298 . 1 1 27 27 ARG HA H 1 5.07 . . 1 . . . . 27 ARG HA . 7362 1 299 . 1 1 27 27 ARG HB2 H 1 1.95 . . 2 . . . . 27 ARG HB2 . 7362 1 300 . 1 1 27 27 ARG HB3 H 1 1.85 . . 2 . . . . 27 ARG HB3 . 7362 1 301 . 1 1 27 27 ARG HD2 H 1 3.22 . . 2 . . . . 27 ARG HD2 . 7362 1 302 . 1 1 27 27 ARG HD3 H 1 3.22 . . 2 . . . . 27 ARG HD3 . 7362 1 303 . 1 1 27 27 ARG HE H 1 7.37 . . 1 . . . . 27 ARG HE . 7362 1 304 . 1 1 27 27 ARG HG2 H 1 1.78 . . 2 . . . . 27 ARG HG2 . 7362 1 305 . 1 1 27 27 ARG HG3 H 1 1.60 . . 2 . . . . 27 ARG HG3 . 7362 1 306 . 1 1 27 27 ARG CA C 13 55.3 . . 1 . . . . 27 ARG CA . 7362 1 307 . 1 1 27 27 ARG CB C 13 31.1 . . 1 . . . . 27 ARG CB . 7362 1 308 . 1 1 27 27 ARG CD C 13 43.4 . . 1 . . . . 27 ARG CD . 7362 1 309 . 1 1 27 27 ARG CG C 13 28.3 . . 1 . . . . 27 ARG CG . 7362 1 310 . 1 1 27 27 ARG N N 15 125.8 . . 1 . . . . 27 ARG N . 7362 1 311 . 1 1 27 27 ARG NE N 15 92.5 . . 1 . . . . 27 ARG NE . 7362 1 312 . 1 1 28 28 VAL H H 1 8.96 . . 1 . . . . 28 VAL HN . 7362 1 313 . 1 1 28 28 VAL HA H 1 4.88 . . 1 . . . . 28 VAL HA . 7362 1 314 . 1 1 28 28 VAL HB H 1 2.05 . . 1 . . . . 28 VAL HB . 7362 1 315 . 1 1 28 28 VAL HG11 H 1 0.88 . . 2 . . . . 28 VAL HG1 . 7362 1 316 . 1 1 28 28 VAL HG12 H 1 0.88 . . 2 . . . . 28 VAL HG1 . 7362 1 317 . 1 1 28 28 VAL HG13 H 1 0.88 . . 2 . . . . 28 VAL HG1 . 7362 1 318 . 1 1 28 28 VAL HG21 H 1 0.69 . . 2 . . . . 28 VAL HG2 . 7362 1 319 . 1 1 28 28 VAL HG22 H 1 0.69 . . 2 . . . . 28 VAL HG2 . 7362 1 320 . 1 1 28 28 VAL HG23 H 1 0.69 . . 2 . . . . 28 VAL HG2 . 7362 1 321 . 1 1 28 28 VAL CA C 13 58.9 . . 1 . . . . 28 VAL CA . 7362 1 322 . 1 1 28 28 VAL CB C 13 36.0 . . 1 . . . . 28 VAL CB . 7362 1 323 . 1 1 28 28 VAL CG1 C 13 22.3 . . 1 . . . . 28 VAL CG1 . 7362 1 324 . 1 1 28 28 VAL CG2 C 13 19.5 . . 1 . . . . 28 VAL CG2 . 7362 1 325 . 1 1 28 28 VAL N N 15 116.9 . . 1 . . . . 28 VAL N . 7362 1 326 . 1 1 29 29 LYS H H 1 8.46 . . 1 . . . . 29 LYS HN . 7362 1 327 . 1 1 29 29 LYS HA H 1 4.84 . . 1 . . . . 29 LYS HA . 7362 1 328 . 1 1 29 29 LYS HB2 H 1 1.66 . . 2 . . . . 29 LYS HB2 . 7362 1 329 . 1 1 29 29 LYS HB3 H 1 1.48 . . 2 . . . . 29 LYS HB3 . 7362 1 330 . 1 1 29 29 LYS HD2 H 1 1.57 . . 2 . . . . 29 LYS HD2 . 7362 1 331 . 1 1 29 29 LYS HD3 H 1 1.57 . . 2 . . . . 29 LYS HD3 . 7362 1 332 . 1 1 29 29 LYS HE2 H 1 2.87 . . 2 . . . . 29 LYS HE2 . 7362 1 333 . 1 1 29 29 LYS HE3 H 1 2.87 . . 2 . . . . 29 LYS HE3 . 7362 1 334 . 1 1 29 29 LYS HG2 H 1 1.40 . . 2 . . . . 29 LYS HG2 . 7362 1 335 . 1 1 29 29 LYS HG3 H 1 1.21 . . 2 . . . . 29 LYS HG3 . 7362 1 336 . 1 1 29 29 LYS CA C 13 55.2 . . 1 . . . . 29 LYS CA . 7362 1 337 . 1 1 29 29 LYS CB C 13 34.3 . . 1 . . . . 29 LYS CB . 7362 1 338 . 1 1 29 29 LYS CD C 13 29.6 . . 1 . . . . 29 LYS CD . 7362 1 339 . 1 1 29 29 LYS CE C 13 42.1 . . 1 . . . . 29 LYS CE . 7362 1 340 . 1 1 29 29 LYS CG C 13 25.7 . . 1 . . . . 29 LYS CG . 7362 1 341 . 1 1 29 29 LYS N N 15 121.3 . . 1 . . . . 29 LYS N . 7362 1 342 . 1 1 30 30 ILE H H 1 9.02 . . 1 . . . . 30 ILE HN . 7362 1 343 . 1 1 30 30 ILE HA H 1 4.46 . . 1 . . . . 30 ILE HA . 7362 1 344 . 1 1 30 30 ILE HB H 1 1.40 . . 1 . . . . 30 ILE HB . 7362 1 345 . 1 1 30 30 ILE HD11 H 1 -0.06 . . 1 . . . . 30 ILE HD1 . 7362 1 346 . 1 1 30 30 ILE HD12 H 1 -0.06 . . 1 . . . . 30 ILE HD1 . 7362 1 347 . 1 1 30 30 ILE HD13 H 1 -0.06 . . 1 . . . . 30 ILE HD1 . 7362 1 348 . 1 1 30 30 ILE HG12 H 1 0.47 . . 2 . . . . 30 ILE HG12 . 7362 1 349 . 1 1 30 30 ILE HG13 H 1 1.17 . . 2 . . . . 30 ILE HG13 . 7362 1 350 . 1 1 30 30 ILE HG21 H 1 0.23 . . 1 . . . . 30 ILE HG2 . 7362 1 351 . 1 1 30 30 ILE HG22 H 1 0.23 . . 1 . . . . 30 ILE HG2 . 7362 1 352 . 1 1 30 30 ILE HG23 H 1 0.23 . . 1 . . . . 30 ILE HG2 . 7362 1 353 . 1 1 30 30 ILE CA C 13 59.6 . . 1 . . . . 30 ILE CA . 7362 1 354 . 1 1 30 30 ILE CB C 13 40.8 . . 1 . . . . 30 ILE CB . 7362 1 355 . 1 1 30 30 ILE CD1 C 13 13.4 . . 1 . . . . 30 ILE CD1 . 7362 1 356 . 1 1 30 30 ILE CG1 C 13 26.8 . . 1 . . . . 30 ILE CG1 . 7362 1 357 . 1 1 30 30 ILE CG2 C 13 17.8 . . 1 . . . . 30 ILE CG2 . 7362 1 358 . 1 1 30 30 ILE N N 15 120.7 . . 1 . . . . 30 ILE N . 7362 1 359 . 1 1 31 31 LYS H H 1 8.52 . . 1 . . . . 31 LYS HN . 7362 1 360 . 1 1 31 31 LYS HA H 1 4.85 . . 1 . . . . 31 LYS HA . 7362 1 361 . 1 1 31 31 LYS HB2 H 1 1.70 . . 2 . . . . 31 LYS HB2 . 7362 1 362 . 1 1 31 31 LYS HB3 H 1 1.56 . . 2 . . . . 31 LYS HB3 . 7362 1 363 . 1 1 31 31 LYS HD2 H 1 1.53 . . 2 . . . . 31 LYS HD2 . 7362 1 364 . 1 1 31 31 LYS HD3 H 1 1.53 . . 2 . . . . 31 LYS HD3 . 7362 1 365 . 1 1 31 31 LYS HE2 H 1 2.79 . . 2 . . . . 31 LYS HE2 . 7362 1 366 . 1 1 31 31 LYS HE3 H 1 2.79 . . 2 . . . . 31 LYS HE3 . 7362 1 367 . 1 1 31 31 LYS HG2 H 1 1.22 . . 2 . . . . 31 LYS HG2 . 7362 1 368 . 1 1 31 31 LYS HG3 H 1 1.18 . . 2 . . . . 31 LYS HG3 . 7362 1 369 . 1 1 31 31 LYS CA C 13 54.6 . . 1 . . . . 31 LYS CA . 7362 1 370 . 1 1 31 31 LYS CB C 13 34.9 . . 1 . . . . 31 LYS CB . 7362 1 371 . 1 1 31 31 LYS CD C 13 29.8 . . 1 . . . . 31 LYS CD . 7362 1 372 . 1 1 31 31 LYS CE C 13 42.0 . . 1 . . . . 31 LYS CE . 7362 1 373 . 1 1 31 31 LYS CG C 13 25.6 . . 1 . . . . 31 LYS CG . 7362 1 374 . 1 1 31 31 LYS N N 15 125.0 . . 1 . . . . 31 LYS N . 7362 1 375 . 1 1 32 32 LEU H H 1 8.81 . . 1 . . . . 32 LEU HN . 7362 1 376 . 1 1 32 32 LEU HA H 1 4.61 . . 1 . . . . 32 LEU HA . 7362 1 377 . 1 1 32 32 LEU HB2 H 1 1.54 . . 2 . . . . 32 LEU HB2 . 7362 1 378 . 1 1 32 32 LEU HB3 H 1 1.30 . . 2 . . . . 32 LEU HB3 . 7362 1 379 . 1 1 32 32 LEU HD11 H 1 0.71 . . 2 . . . . 32 LEU HD1 . 7362 1 380 . 1 1 32 32 LEU HD12 H 1 0.71 . . 2 . . . . 32 LEU HD1 . 7362 1 381 . 1 1 32 32 LEU HD13 H 1 0.71 . . 2 . . . . 32 LEU HD1 . 7362 1 382 . 1 1 32 32 LEU HD21 H 1 0.49 . . 2 . . . . 32 LEU HD2 . 7362 1 383 . 1 1 32 32 LEU HD22 H 1 0.49 . . 2 . . . . 32 LEU HD2 . 7362 1 384 . 1 1 32 32 LEU HD23 H 1 0.49 . . 2 . . . . 32 LEU HD2 . 7362 1 385 . 1 1 32 32 LEU HG H 1 1.44 . . 1 . . . . 32 LEU HG . 7362 1 386 . 1 1 32 32 LEU CA C 13 54.2 . . 1 . . . . 32 LEU CA . 7362 1 387 . 1 1 32 32 LEU CB C 13 43.6 . . 1 . . . . 32 LEU CB . 7362 1 388 . 1 1 32 32 LEU CD1 C 13 25.9 . . 1 . . . . 32 LEU CD1 . 7362 1 389 . 1 1 32 32 LEU CD2 C 13 24.9 . . 1 . . . . 32 LEU CD2 . 7362 1 390 . 1 1 32 32 LEU CG C 13 27.0 . . 1 . . . . 32 LEU CG . 7362 1 391 . 1 1 32 32 LEU N N 15 125.8 . . 1 . . . . 32 LEU N . 7362 1 392 . 1 1 33 33 GLU H H 1 8.61 . . 1 . . . . 33 GLU HN . 7362 1 393 . 1 1 33 33 GLU HA H 1 4.49 . . 1 . . . . 33 GLU HA . 7362 1 394 . 1 1 33 33 GLU HB2 H 1 1.95 . . 2 . . . . 33 GLU HB2 . 7362 1 395 . 1 1 33 33 GLU HB3 H 1 1.77 . . 2 . . . . 33 GLU HB3 . 7362 1 396 . 1 1 33 33 GLU HG2 H 1 2.08 . . 2 . . . . 33 GLU HG2 . 7362 1 397 . 1 1 33 33 GLU HG3 H 1 2.10 . . 2 . . . . 33 GLU HG3 . 7362 1 398 . 1 1 33 33 GLU CA C 13 55.3 . . 1 . . . . 33 GLU CA . 7362 1 399 . 1 1 33 33 GLU CB C 13 31.3 . . 1 . . . . 33 GLU CB . 7362 1 400 . 1 1 33 33 GLU CG C 13 35.8 . . 1 . . . . 33 GLU CG . 7362 1 401 . 1 1 33 33 GLU N N 15 123.8 . . 1 . . . . 33 GLU N . 7362 1 402 . 1 1 34 34 LEU H H 1 8.43 . . 1 . . . . 34 LEU HN . 7362 1 403 . 1 1 34 34 LEU HA H 1 4.45 . . 1 . . . . 34 LEU HA . 7362 1 404 . 1 1 34 34 LEU HB2 H 1 1.59 . . 2 . . . . 34 LEU HB2 . 7362 1 405 . 1 1 34 34 LEU HB3 H 1 1.59 . . 2 . . . . 34 LEU HB3 . 7362 1 406 . 1 1 34 34 LEU HD11 H 1 0.89 . . 2 . . . . 34 LEU HD1 . 7362 1 407 . 1 1 34 34 LEU HD12 H 1 0.89 . . 2 . . . . 34 LEU HD1 . 7362 1 408 . 1 1 34 34 LEU HD13 H 1 0.89 . . 2 . . . . 34 LEU HD1 . 7362 1 409 . 1 1 34 34 LEU HD21 H 1 0.85 . . 2 . . . . 34 LEU HD2 . 7362 1 410 . 1 1 34 34 LEU HD22 H 1 0.85 . . 2 . . . . 34 LEU HD2 . 7362 1 411 . 1 1 34 34 LEU HD23 H 1 0.85 . . 2 . . . . 34 LEU HD2 . 7362 1 412 . 1 1 34 34 LEU HG H 1 1.59 . . 1 . . . . 34 LEU HG . 7362 1 413 . 1 1 34 34 LEU CA C 13 54.8 . . 1 . . . . 34 LEU CA . 7362 1 414 . 1 1 34 34 LEU CB C 13 42.8 . . 1 . . . . 34 LEU CB . 7362 1 415 . 1 1 34 34 LEU CD1 C 13 25.3 . . 1 . . . . 34 LEU CD1 . 7362 1 416 . 1 1 34 34 LEU CD2 C 13 23.9 . . 1 . . . . 34 LEU CD2 . 7362 1 417 . 1 1 34 34 LEU CG C 13 27.5 . . 1 . . . . 34 LEU CG . 7362 1 418 . 1 1 34 34 LEU N N 15 124.4 . . 1 . . . . 34 LEU N . 7362 1 419 . 1 1 35 35 LYS H H 1 8.50 . . 1 . . . . 35 LYS HN . 7362 1 420 . 1 1 35 35 LYS HA H 1 4.27 . . 1 . . . . 35 LYS HA . 7362 1 421 . 1 1 35 35 LYS HB2 H 1 1.70 . . 2 . . . . 35 LYS HB2 . 7362 1 422 . 1 1 35 35 LYS HB3 H 1 1.80 . . 2 . . . . 35 LYS HB3 . 7362 1 423 . 1 1 35 35 LYS HD2 H 1 1.68 . . 2 . . . . 35 LYS HD2 . 7362 1 424 . 1 1 35 35 LYS HD3 H 1 1.67 . . 2 . . . . 35 LYS HD3 . 7362 1 425 . 1 1 35 35 LYS HG2 H 1 1.34 . . 2 . . . . 35 LYS HG2 . 7362 1 426 . 1 1 35 35 LYS HG3 H 1 1.41 . . 2 . . . . 35 LYS HG3 . 7362 1 427 . 1 1 35 35 LYS CA C 13 56.7 . . 1 . . . . 35 LYS CA . 7362 1 428 . 1 1 35 35 LYS CB C 13 33.0 . . 1 . . . . 35 LYS CB . 7362 1 429 . 1 1 35 35 LYS CD C 13 28.8 . . 1 . . . . 35 LYS CD . 7362 1 430 . 1 1 35 35 LYS CG C 13 25.1 . . 1 . . . . 35 LYS CG . 7362 1 431 . 1 1 35 35 LYS N N 15 122.8 . . 1 . . . . 35 LYS N . 7362 1 432 . 1 1 36 36 VAL H H 1 8.16 . . 1 . . . . 36 VAL HN . 7362 1 433 . 1 1 36 36 VAL HA H 1 4.13 . . 1 . . . . 36 VAL HA . 7362 1 434 . 1 1 36 36 VAL HB H 1 2.00 . . 1 . . . . 36 VAL HB . 7362 1 435 . 1 1 36 36 VAL HG11 H 1 0.87 . . 2 . . . . 36 VAL HG1 . 7362 1 436 . 1 1 36 36 VAL HG12 H 1 0.87 . . 2 . . . . 36 VAL HG1 . 7362 1 437 . 1 1 36 36 VAL HG13 H 1 0.87 . . 2 . . . . 36 VAL HG1 . 7362 1 438 . 1 1 36 36 VAL HG21 H 1 0.88 . . 2 . . . . 36 VAL HG2 . 7362 1 439 . 1 1 36 36 VAL HG22 H 1 0.88 . . 2 . . . . 36 VAL HG2 . 7362 1 440 . 1 1 36 36 VAL HG23 H 1 0.88 . . 2 . . . . 36 VAL HG2 . 7362 1 441 . 1 1 36 36 VAL CA C 13 61.9 . . 1 . . . . 36 VAL CA . 7362 1 442 . 1 1 36 36 VAL CB C 13 33.0 . . 1 . . . . 36 VAL CB . 7362 1 443 . 1 1 36 36 VAL CG1 C 13 20.7 . . 1 . . . . 36 VAL CG1 . 7362 1 444 . 1 1 36 36 VAL CG2 C 13 21.2 . . 1 . . . . 36 VAL CG2 . 7362 1 445 . 1 1 36 36 VAL N N 15 121.9 . . 1 . . . . 36 VAL N . 7362 1 446 . 1 1 37 37 GLU H H 1 8.48 . . 1 . . . . 37 GLU HN . 7362 1 447 . 1 1 37 37 GLU HA H 1 4.59 . . 1 . . . . 37 GLU HA . 7362 1 448 . 1 1 37 37 GLU HB2 H 1 1.85 . . 2 . . . . 37 GLU HB2 . 7362 1 449 . 1 1 37 37 GLU HB3 H 1 2.02 . . 2 . . . . 37 GLU HB3 . 7362 1 450 . 1 1 37 37 GLU HG2 H 1 2.28 . . 2 . . . . 37 GLU HG2 . 7362 1 451 . 1 1 37 37 GLU HG3 H 1 2.27 . . 2 . . . . 37 GLU HG3 . 7362 1 452 . 1 1 37 37 GLU CA C 13 54.1 . . 1 . . . . 37 GLU CA . 7362 1 453 . 1 1 37 37 GLU CB C 13 29.9 . . 1 . . . . 37 GLU CB . 7362 1 454 . 1 1 37 37 GLU CG C 13 35.8 . . 1 . . . . 37 GLU CG . 7362 1 455 . 1 1 37 37 GLU N N 15 126.8 . . 1 . . . . 37 GLU N . 7362 1 456 . 1 1 38 38 PRO HA H 1 4.41 . . 1 . . . . 38 PRO HA . 7362 1 457 . 1 1 38 38 PRO HB2 H 1 2.25 . . 2 . . . . 38 PRO HB2 . 7362 1 458 . 1 1 38 38 PRO HB3 H 1 1.90 . . 2 . . . . 38 PRO HB3 . 7362 1 459 . 1 1 38 38 PRO HD2 H 1 3.72 . . 2 . . . . 38 PRO HD2 . 7362 1 460 . 1 1 38 38 PRO HD3 H 1 3.79 . . 2 . . . . 38 PRO HD3 . 7362 1 461 . 1 1 38 38 PRO HG2 H 1 2.03 . . 2 . . . . 38 PRO HG2 . 7362 1 462 . 1 1 38 38 PRO HG3 H 1 1.99 . . 2 . . . . 38 PRO HG3 . 7362 1 463 . 1 1 38 38 PRO CA C 13 63.1 . . 1 . . . . 38 PRO CA . 7362 1 464 . 1 1 38 38 PRO CB C 13 32.1 . . 1 . . . . 38 PRO CB . 7362 1 465 . 1 1 38 38 PRO CD C 13 50.6 . . 1 . . . . 38 PRO CD . 7362 1 466 . 1 1 38 38 PRO CG C 13 27.6 . . 1 . . . . 38 PRO CG . 7362 1 467 . 1 1 39 39 ILE H H 1 8.12 . . 1 . . . . 39 ILE HN . 7362 1 468 . 1 1 39 39 ILE HA H 1 4.11 . . 1 . . . . 39 ILE HA . 7362 1 469 . 1 1 39 39 ILE HB H 1 1.80 . . 1 . . . . 39 ILE HB . 7362 1 470 . 1 1 39 39 ILE HD11 H 1 0.84 . . 1 . . . . 39 ILE HD1 . 7362 1 471 . 1 1 39 39 ILE HD12 H 1 0.84 . . 1 . . . . 39 ILE HD1 . 7362 1 472 . 1 1 39 39 ILE HD13 H 1 0.84 . . 1 . . . . 39 ILE HD1 . 7362 1 473 . 1 1 39 39 ILE HG12 H 1 1.44 . . 2 . . . . 39 ILE HG12 . 7362 1 474 . 1 1 39 39 ILE HG13 H 1 1.15 . . 2 . . . . 39 ILE HG13 . 7362 1 475 . 1 1 39 39 ILE HG21 H 1 0.86 . . 1 . . . . 39 ILE HG2 . 7362 1 476 . 1 1 39 39 ILE HG22 H 1 0.86 . . 1 . . . . 39 ILE HG2 . 7362 1 477 . 1 1 39 39 ILE HG23 H 1 0.86 . . 1 . . . . 39 ILE HG2 . 7362 1 478 . 1 1 39 39 ILE CA C 13 61.3 . . 1 . . . . 39 ILE CA . 7362 1 479 . 1 1 39 39 ILE CB C 13 39.2 . . 1 . . . . 39 ILE CB . 7362 1 480 . 1 1 39 39 ILE CD1 C 13 13.4 . . 1 . . . . 39 ILE CD1 . 7362 1 481 . 1 1 39 39 ILE CG1 C 13 27.5 . . 1 . . . . 39 ILE CG1 . 7362 1 482 . 1 1 39 39 ILE CG2 C 13 17.7 . . 1 . . . . 39 ILE CG2 . 7362 1 483 . 1 1 39 39 ILE N N 15 120.4 . . 1 . . . . 39 ILE N . 7362 1 484 . 1 1 40 40 ASP H H 1 8.37 . . 1 . . . . 40 ASP HN . 7362 1 485 . 1 1 40 40 ASP HA H 1 4.63 . . 1 . . . . 40 ASP HA . 7362 1 486 . 1 1 40 40 ASP HB2 H 1 2.58 . . 2 . . . . 40 ASP HB2 . 7362 1 487 . 1 1 40 40 ASP HB3 H 1 2.72 . . 2 . . . . 40 ASP HB3 . 7362 1 488 . 1 1 40 40 ASP CA C 13 53.7 . . 1 . . . . 40 ASP CA . 7362 1 489 . 1 1 40 40 ASP CB C 13 41.3 . . 1 . . . . 40 ASP CB . 7362 1 490 . 1 1 40 40 ASP N N 15 124.2 . . 1 . . . . 40 ASP N . 7362 1 491 . 1 1 41 41 LEU H H 1 8.31 . . 1 . . . . 41 LEU HN . 7362 1 492 . 1 1 41 41 LEU HA H 1 4.29 . . 1 . . . . 41 LEU HA . 7362 1 493 . 1 1 41 41 LEU HB2 H 1 1.61 . . 2 . . . . 41 LEU HB2 . 7362 1 494 . 1 1 41 41 LEU HB3 H 1 1.64 . . 2 . . . . 41 LEU HB3 . 7362 1 495 . 1 1 41 41 LEU HD11 H 1 0.88 . . 2 . . . . 41 LEU HD1 . 7362 1 496 . 1 1 41 41 LEU HD12 H 1 0.88 . . 2 . . . . 41 LEU HD1 . 7362 1 497 . 1 1 41 41 LEU HD13 H 1 0.88 . . 2 . . . . 41 LEU HD1 . 7362 1 498 . 1 1 41 41 LEU HD21 H 1 0.82 . . 2 . . . . 41 LEU HD2 . 7362 1 499 . 1 1 41 41 LEU HD22 H 1 0.82 . . 2 . . . . 41 LEU HD2 . 7362 1 500 . 1 1 41 41 LEU HD23 H 1 0.82 . . 2 . . . . 41 LEU HD2 . 7362 1 501 . 1 1 41 41 LEU HG H 1 1.61 . . 1 . . . . 41 LEU HG . 7362 1 502 . 1 1 41 41 LEU CA C 13 55.3 . . 1 . . . . 41 LEU CA . 7362 1 503 . 1 1 41 41 LEU CB C 13 42.4 . . 1 . . . . 41 LEU CB . 7362 1 504 . 1 1 41 41 LEU CD1 C 13 25.3 . . 1 . . . . 41 LEU CD1 . 7362 1 505 . 1 1 41 41 LEU CD2 C 13 23.4 . . 1 . . . . 41 LEU CD2 . 7362 1 506 . 1 1 41 41 LEU CG C 13 26.9 . . 1 . . . . 41 LEU CG . 7362 1 507 . 1 1 42 42 GLY H H 1 8.40 . . 1 . . . . 42 GLY HN . 7362 1 508 . 1 1 42 42 GLY HA2 H 1 3.90 . . 2 . . . . 42 GLY HA1 . 7362 1 509 . 1 1 42 42 GLY HA3 H 1 3.90 . . 2 . . . . 42 GLY HA2 . 7362 1 510 . 1 1 42 42 GLY CA C 13 45.2 . . 1 . . . . 42 GLY CA . 7362 1 511 . 1 1 42 42 GLY N N 15 109.0 . . 1 . . . . 42 GLY N . 7362 1 512 . 1 1 43 43 GLU H H 1 8.10 . . 1 . . . . 43 GLU HN . 7362 1 513 . 1 1 43 43 GLU HA H 1 4.58 . . 1 . . . . 43 GLU HA . 7362 1 514 . 1 1 43 43 GLU HB2 H 1 1.85 . . 2 . . . . 43 GLU HB2 . 7362 1 515 . 1 1 43 43 GLU HB3 H 1 2.02 . . 2 . . . . 43 GLU HB3 . 7362 1 516 . 1 1 43 43 GLU HG2 H 1 2.27 . . 2 . . . . 43 GLU HG2 . 7362 1 517 . 1 1 43 43 GLU HG3 H 1 2.27 . . 2 . . . . 43 GLU HG3 . 7362 1 518 . 1 1 43 43 GLU CA C 13 54.2 . . 1 . . . . 43 GLU CA . 7362 1 519 . 1 1 43 43 GLU CB C 13 29.8 . . 1 . . . . 43 GLU CB . 7362 1 520 . 1 1 43 43 GLU CG C 13 35.9 . . 1 . . . . 43 GLU CG . 7362 1 521 . 1 1 43 43 GLU N N 15 121.5 . . 1 . . . . 43 GLU N . 7362 1 522 . 1 1 44 44 PRO HA H 1 4.43 . . 1 . . . . 44 PRO HA . 7362 1 523 . 1 1 44 44 PRO HB2 H 1 1.87 . . 2 . . . . 44 PRO HB2 . 7362 1 524 . 1 1 44 44 PRO HB3 H 1 2.23 . . 2 . . . . 44 PRO HB3 . 7362 1 525 . 1 1 44 44 PRO HD2 H 1 3.65 . . 2 . . . . 44 PRO HD2 . 7362 1 526 . 1 1 44 44 PRO HD3 H 1 3.72 . . 2 . . . . 44 PRO HD3 . 7362 1 527 . 1 1 44 44 PRO HG2 H 1 1.99 . . 2 . . . . 44 PRO HG2 . 7362 1 528 . 1 1 44 44 PRO HG3 H 1 1.99 . . 2 . . . . 44 PRO HG3 . 7362 1 529 . 1 1 44 44 PRO CA C 13 63.0 . . 1 . . . . 44 PRO CA . 7362 1 530 . 1 1 44 44 PRO CB C 13 32.1 . . 1 . . . . 44 PRO CB . 7362 1 531 . 1 1 44 44 PRO CD C 13 50.6 . . 1 . . . . 44 PRO CD . 7362 1 532 . 1 1 44 44 PRO CG C 13 27.5 . . 1 . . . . 44 PRO CG . 7362 1 533 . 1 1 45 45 VAL H H 1 8.23 . . 1 . . . . 45 VAL HN . 7362 1 534 . 1 1 45 45 VAL HA H 1 4.10 . . 1 . . . . 45 VAL HA . 7362 1 535 . 1 1 45 45 VAL HB H 1 2.03 . . 1 . . . . 45 VAL HB . 7362 1 536 . 1 1 45 45 VAL HG11 H 1 0.93 . . 2 . . . . 45 VAL HG1 . 7362 1 537 . 1 1 45 45 VAL HG12 H 1 0.93 . . 2 . . . . 45 VAL HG1 . 7362 1 538 . 1 1 45 45 VAL HG13 H 1 0.93 . . 2 . . . . 45 VAL HG1 . 7362 1 539 . 1 1 45 45 VAL HG21 H 1 0.93 . . 2 . . . . 45 VAL HG2 . 7362 1 540 . 1 1 45 45 VAL HG22 H 1 0.93 . . 2 . . . . 45 VAL HG2 . 7362 1 541 . 1 1 45 45 VAL HG23 H 1 0.93 . . 2 . . . . 45 VAL HG2 . 7362 1 542 . 1 1 45 45 VAL CA C 13 62.3 . . 1 . . . . 45 VAL CA . 7362 1 543 . 1 1 45 45 VAL CB C 13 33.1 . . 1 . . . . 45 VAL CB . 7362 1 544 . 1 1 45 45 VAL CG1 C 13 21.3 . . 1 . . . . 45 VAL CG1 . 7362 1 545 . 1 1 45 45 VAL CG2 C 13 20.8 . . 1 . . . . 45 VAL CG2 . 7362 1 546 . 1 1 45 45 VAL N N 15 120.4 . . 1 . . . . 45 VAL N . 7362 1 547 . 1 1 46 46 SER H H 1 8.39 . . 1 . . . . 46 SER HN . 7362 1 548 . 1 1 46 46 SER HA H 1 4.52 . . 1 . . . . 46 SER HA . 7362 1 549 . 1 1 46 46 SER HB2 H 1 3.86 . . 2 . . . . 46 SER HB2 . 7362 1 550 . 1 1 46 46 SER HB3 H 1 3.97 . . 2 . . . . 46 SER HB3 . 7362 1 551 . 1 1 46 46 SER CA C 13 57.7 . . 1 . . . . 46 SER CA . 7362 1 552 . 1 1 46 46 SER CB C 13 64.1 . . 1 . . . . 46 SER CB . 7362 1 553 . 1 1 46 46 SER N N 15 119.9 . . 1 . . . . 46 SER N . 7362 1 554 . 1 1 47 47 VAL H H 1 8.34 . . 1 . . . . 47 VAL HN . 7362 1 555 . 1 1 47 47 VAL HA H 1 4.00 . . 1 . . . . 47 VAL HA . 7362 1 556 . 1 1 47 47 VAL HB H 1 2.10 . . 1 . . . . 47 VAL HB . 7362 1 557 . 1 1 47 47 VAL HG11 H 1 0.94 . . 2 . . . . 47 VAL HG1 . 7362 1 558 . 1 1 47 47 VAL HG12 H 1 0.94 . . 2 . . . . 47 VAL HG1 . 7362 1 559 . 1 1 47 47 VAL HG13 H 1 0.94 . . 2 . . . . 47 VAL HG1 . 7362 1 560 . 1 1 47 47 VAL HG21 H 1 0.92 . . 2 . . . . 47 VAL HG2 . 7362 1 561 . 1 1 47 47 VAL HG22 H 1 0.92 . . 2 . . . . 47 VAL HG2 . 7362 1 562 . 1 1 47 47 VAL HG23 H 1 0.92 . . 2 . . . . 47 VAL HG2 . 7362 1 563 . 1 1 47 47 VAL CA C 13 63.5 . . 1 . . . . 47 VAL CA . 7362 1 564 . 1 1 47 47 VAL CB C 13 32.4 . . 1 . . . . 47 VAL CB . 7362 1 565 . 1 1 47 47 VAL CG1 C 13 20.9 . . 1 . . . . 47 VAL CG1 . 7362 1 566 . 1 1 47 47 VAL CG2 C 13 21.0 . . 1 . . . . 47 VAL CG2 . 7362 1 567 . 1 1 47 47 VAL N N 15 122.2 . . 1 . . . . 47 VAL N . 7362 1 568 . 1 1 48 48 GLU H H 1 8.39 . . 1 . . . . 48 GLU HN . 7362 1 569 . 1 1 48 48 GLU HA H 1 4.15 . . 1 . . . . 48 GLU HA . 7362 1 570 . 1 1 48 48 GLU HB2 H 1 1.99 . . 2 . . . . 48 GLU HB2 . 7362 1 571 . 1 1 48 48 GLU HB3 H 1 1.93 . . 2 . . . . 48 GLU HB3 . 7362 1 572 . 1 1 48 48 GLU HG2 H 1 2.25 . . 2 . . . . 48 GLU HG2 . 7362 1 573 . 1 1 48 48 GLU HG3 H 1 2.26 . . 2 . . . . 48 GLU HG3 . 7362 1 574 . 1 1 48 48 GLU CA C 13 57.5 . . 1 . . . . 48 GLU CA . 7362 1 575 . 1 1 48 48 GLU CB C 13 30.1 . . 1 . . . . 48 GLU CB . 7362 1 576 . 1 1 48 48 GLU CG C 13 36.4 . . 1 . . . . 48 GLU CG . 7362 1 577 . 1 1 48 48 GLU N N 15 122.5 . . 1 . . . . 48 GLU N . 7362 1 578 . 1 1 49 49 GLU H H 1 8.15 . . 1 . . . . 49 GLU HN . 7362 1 579 . 1 1 49 49 GLU HA H 1 4.13 . . 1 . . . . 49 GLU HA . 7362 1 580 . 1 1 49 49 GLU HB2 H 1 2.00 . . 2 . . . . 49 GLU HB2 . 7362 1 581 . 1 1 49 49 GLU HB3 H 1 2.01 . . 2 . . . . 49 GLU HB3 . 7362 1 582 . 1 1 49 49 GLU HG2 H 1 2.22 . . 2 . . . . 49 GLU HG2 . 7362 1 583 . 1 1 49 49 GLU HG3 H 1 2.21 . . 2 . . . . 49 GLU HG3 . 7362 1 584 . 1 1 49 49 GLU CA C 13 57.6 . . 1 . . . . 49 GLU CA . 7362 1 585 . 1 1 49 49 GLU CB C 13 30.1 . . 1 . . . . 49 GLU CB . 7362 1 586 . 1 1 49 49 GLU CG C 13 36.3 . . 1 . . . . 49 GLU CG . 7362 1 587 . 1 1 49 49 GLU N N 15 121.4 . . 1 . . . . 49 GLU N . 7362 1 588 . 1 1 50 50 ILE H H 1 8.04 . . 1 . . . . 50 ILE HN . 7362 1 589 . 1 1 50 50 ILE HA H 1 3.93 . . 1 . . . . 50 ILE HA . 7362 1 590 . 1 1 50 50 ILE HB H 1 1.85 . . 1 . . . . 50 ILE HB . 7362 1 591 . 1 1 50 50 ILE HD11 H 1 0.80 . . 1 . . . . 50 ILE HD1 . 7362 1 592 . 1 1 50 50 ILE HD12 H 1 0.80 . . 1 . . . . 50 ILE HD1 . 7362 1 593 . 1 1 50 50 ILE HD13 H 1 0.80 . . 1 . . . . 50 ILE HD1 . 7362 1 594 . 1 1 50 50 ILE HG12 H 1 1.15 . . 2 . . . . 50 ILE HG12 . 7362 1 595 . 1 1 50 50 ILE HG13 H 1 1.49 . . 2 . . . . 50 ILE HG13 . 7362 1 596 . 1 1 50 50 ILE HG21 H 1 0.86 . . 1 . . . . 50 ILE HG2 . 7362 1 597 . 1 1 50 50 ILE HG22 H 1 0.86 . . 1 . . . . 50 ILE HG2 . 7362 1 598 . 1 1 50 50 ILE HG23 H 1 0.86 . . 1 . . . . 50 ILE HG2 . 7362 1 599 . 1 1 50 50 ILE CA C 13 62.4 . . 1 . . . . 50 ILE CA . 7362 1 600 . 1 1 50 50 ILE CB C 13 38.4 . . 1 . . . . 50 ILE CB . 7362 1 601 . 1 1 50 50 ILE CD1 C 13 13.0 . . 1 . . . . 50 ILE CD1 . 7362 1 602 . 1 1 50 50 ILE CG1 C 13 28.1 . . 1 . . . . 50 ILE CG1 . 7362 1 603 . 1 1 50 50 ILE CG2 C 13 17.5 . . 1 . . . . 50 ILE CG2 . 7362 1 604 . 1 1 50 50 ILE N N 15 121.4 . . 1 . . . . 50 ILE N . 7362 1 605 . 1 1 51 51 LYS H H 1 8.11 . . 1 . . . . 51 LYS HN . 7362 1 606 . 1 1 51 51 LYS HA H 1 4.14 . . 1 . . . . 51 LYS HA . 7362 1 607 . 1 1 51 51 LYS HB2 H 1 1.75 . . 2 . . . . 51 LYS HB2 . 7362 1 608 . 1 1 51 51 LYS HB3 H 1 1.79 . . 2 . . . . 51 LYS HB3 . 7362 1 609 . 1 1 51 51 LYS HD2 H 1 1.61 . . 2 . . . . 51 LYS HD2 . 7362 1 610 . 1 1 51 51 LYS HD3 H 1 1.61 . . 2 . . . . 51 LYS HD3 . 7362 1 611 . 1 1 51 51 LYS HG2 H 1 1.45 . . 2 . . . . 51 LYS HG2 . 7362 1 612 . 1 1 51 51 LYS HG3 H 1 1.35 . . 2 . . . . 51 LYS HG3 . 7362 1 613 . 1 1 51 51 LYS CA C 13 57.6 . . 1 . . . . 51 LYS CA . 7362 1 614 . 1 1 51 51 LYS CB C 13 33.0 . . 1 . . . . 51 LYS CB . 7362 1 615 . 1 1 51 51 LYS CD C 13 29.3 . . 1 . . . . 51 LYS CD . 7362 1 616 . 1 1 51 51 LYS CG C 13 25.1 . . 1 . . . . 51 LYS CG . 7362 1 617 . 1 1 51 51 LYS N N 15 123.3 . . 1 . . . . 51 LYS N . 7362 1 618 . 1 1 52 52 LYS H H 1 7.94 . . 1 . . . . 52 LYS HN . 7362 1 619 . 1 1 52 52 LYS HA H 1 4.22 . . 1 . . . . 52 LYS HA . 7362 1 620 . 1 1 52 52 LYS HB2 H 1 1.76 . . 2 . . . . 52 LYS HB2 . 7362 1 621 . 1 1 52 52 LYS HB3 H 1 1.76 . . 2 . . . . 52 LYS HB3 . 7362 1 622 . 1 1 52 52 LYS HD2 H 1 1.61 . . 2 . . . . 52 LYS HD2 . 7362 1 623 . 1 1 52 52 LYS HD3 H 1 1.61 . . 2 . . . . 52 LYS HD3 . 7362 1 624 . 1 1 52 52 LYS HG2 H 1 1.45 . . 2 . . . . 52 LYS HG2 . 7362 1 625 . 1 1 52 52 LYS HG3 H 1 1.33 . . 2 . . . . 52 LYS HG3 . 7362 1 626 . 1 1 52 52 LYS CA C 13 57.2 . . 1 . . . . 52 LYS CA . 7362 1 627 . 1 1 52 52 LYS CB C 13 32.9 . . 1 . . . . 52 LYS CB . 7362 1 628 . 1 1 52 52 LYS CD C 13 29.4 . . 1 . . . . 52 LYS CD . 7362 1 629 . 1 1 52 52 LYS CG C 13 24.9 . . 1 . . . . 52 LYS CG . 7362 1 630 . 1 1 52 52 LYS N N 15 120.9 . . 1 . . . . 52 LYS N . 7362 1 631 . 1 1 53 53 ILE H H 1 8.00 . . 1 . . . . 53 ILE HN . 7362 1 632 . 1 1 53 53 ILE HA H 1 4.03 . . 1 . . . . 53 ILE HA . 7362 1 633 . 1 1 53 53 ILE HB H 1 1.83 . . 1 . . . . 53 ILE HB . 7362 1 634 . 1 1 53 53 ILE HD11 H 1 0.76 . . 1 . . . . 53 ILE HD1 . 7362 1 635 . 1 1 53 53 ILE HD12 H 1 0.76 . . 1 . . . . 53 ILE HD1 . 7362 1 636 . 1 1 53 53 ILE HD13 H 1 0.76 . . 1 . . . . 53 ILE HD1 . 7362 1 637 . 1 1 53 53 ILE HG12 H 1 1.08 . . 2 . . . . 53 ILE HG12 . 7362 1 638 . 1 1 53 53 ILE HG13 H 1 1.47 . . 2 . . . . 53 ILE HG13 . 7362 1 639 . 1 1 53 53 ILE HG21 H 1 0.84 . . 1 . . . . 53 ILE HG2 . 7362 1 640 . 1 1 53 53 ILE HG22 H 1 0.84 . . 1 . . . . 53 ILE HG2 . 7362 1 641 . 1 1 53 53 ILE HG23 H 1 0.84 . . 1 . . . . 53 ILE HG2 . 7362 1 642 . 1 1 53 53 ILE CA C 13 62.0 . . 1 . . . . 53 ILE CA . 7362 1 643 . 1 1 53 53 ILE CB C 13 38.4 . . 1 . . . . 53 ILE CB . 7362 1 644 . 1 1 53 53 ILE CD1 C 13 13.1 . . 1 . . . . 53 ILE CD1 . 7362 1 645 . 1 1 53 53 ILE CG1 C 13 27.9 . . 1 . . . . 53 ILE CG1 . 7362 1 646 . 1 1 53 53 ILE CG2 C 13 17.6 . . 1 . . . . 53 ILE CG2 . 7362 1 647 . 1 1 53 53 ILE N N 15 121.4 . . 1 . . . . 53 ILE N . 7362 1 648 . 1 1 54 54 ARG H H 1 8.30 . . 1 . . . . 54 ARG HN . 7362 1 649 . 1 1 54 54 ARG HA H 1 4.23 . . 1 . . . . 54 ARG HA . 7362 1 650 . 1 1 54 54 ARG HB2 H 1 1.82 . . 2 . . . . 54 ARG HB2 . 7362 1 651 . 1 1 54 54 ARG HB3 H 1 1.75 . . 2 . . . . 54 ARG HB3 . 7362 1 652 . 1 1 54 54 ARG HD2 H 1 3.03 . . 2 . . . . 54 ARG HD2 . 7362 1 653 . 1 1 54 54 ARG HD3 H 1 3.05 . . 2 . . . . 54 ARG HD3 . 7362 1 654 . 1 1 54 54 ARG HE H 1 7.14 . . 1 . . . . 54 ARG HE . 7362 1 655 . 1 1 54 54 ARG HG2 H 1 1.60 . . 2 . . . . 54 ARG HG2 . 7362 1 656 . 1 1 54 54 ARG HG3 H 1 1.50 . . 2 . . . . 54 ARG HG3 . 7362 1 657 . 1 1 54 54 ARG CA C 13 57.0 . . 1 . . . . 54 ARG CA . 7362 1 658 . 1 1 54 54 ARG CB C 13 30.8 . . 1 . . . . 54 ARG CB . 7362 1 659 . 1 1 54 54 ARG CD C 13 43.4 . . 1 . . . . 54 ARG CD . 7362 1 660 . 1 1 54 54 ARG CG C 13 27.3 . . 1 . . . . 54 ARG CG . 7362 1 661 . 1 1 54 54 ARG N N 15 124.1 . . 1 . . . . 54 ARG N . 7362 1 662 . 1 1 54 54 ARG NE N 15 92.8 . . 1 . . . . 54 ARG NE . 7362 1 663 . 1 1 55 55 ASP HA H 1 4.60 . . 1 . . . . 55 ASP HA . 7362 1 664 . 1 1 55 55 ASP HB2 H 1 2.71 . . 2 . . . . 55 ASP HB2 . 7362 1 665 . 1 1 55 55 ASP HB3 H 1 2.72 . . 2 . . . . 55 ASP HB3 . 7362 1 666 . 1 1 55 55 ASP CA C 13 54.2 . . 1 . . . . 55 ASP CA . 7362 1 667 . 1 1 55 55 ASP CB C 13 41.2 . . 1 . . . . 55 ASP CB . 7362 1 668 . 1 1 56 56 GLY H H 1 8.25 . . 1 . . . . 56 GLY HN . 7362 1 669 . 1 1 56 56 GLY HA2 H 1 3.96 . . 2 . . . . 56 GLY HA1 . 7362 1 670 . 1 1 56 56 GLY HA3 H 1 3.97 . . 2 . . . . 56 GLY HA2 . 7362 1 671 . 1 1 56 56 GLY CA C 13 45.9 . . 1 . . . . 56 GLY CA . 7362 1 672 . 1 1 56 56 GLY N N 15 108.7 . . 1 . . . . 56 GLY N . 7362 1 673 . 1 1 57 57 THR H H 1 8.18 . . 1 . . . . 57 THR HN . 7362 1 674 . 1 1 57 57 THR HA H 1 4.29 . . 1 . . . . 57 THR HA . 7362 1 675 . 1 1 57 57 THR HB H 1 4.21 . . 1 . . . . 57 THR HB . 7362 1 676 . 1 1 57 57 THR HG21 H 1 1.13 . . 1 . . . . 57 THR HG2 . 7362 1 677 . 1 1 57 57 THR HG22 H 1 1.13 . . 1 . . . . 57 THR HG2 . 7362 1 678 . 1 1 57 57 THR HG23 H 1 1.13 . . 1 . . . . 57 THR HG2 . 7362 1 679 . 1 1 57 57 THR CA C 13 62.5 . . 1 . . . . 57 THR CA . 7362 1 680 . 1 1 57 57 THR CB C 13 69.5 . . 1 . . . . 57 THR CB . 7362 1 681 . 1 1 57 57 THR CG2 C 13 21.8 . . 1 . . . . 57 THR CG2 . 7362 1 682 . 1 1 57 57 THR N N 15 113.7 . . 1 . . . . 57 THR N . 7362 1 683 . 1 1 58 58 TRP H H 1 8.10 . . 1 . . . . 58 TRP HN . 7362 1 684 . 1 1 58 58 TRP HA H 1 4.55 . . 1 . . . . 58 TRP HA . 7362 1 685 . 1 1 58 58 TRP HB2 H 1 3.25 . . 2 . . . . 58 TRP HB2 . 7362 1 686 . 1 1 58 58 TRP HB3 H 1 3.25 . . 2 . . . . 58 TRP HB3 . 7362 1 687 . 1 1 58 58 TRP HD1 H 1 7.24 . . 1 . . . . 58 TRP HD1 . 7362 1 688 . 1 1 58 58 TRP HE1 H 1 10.18 . . 1 . . . . 58 TRP HE1 . 7362 1 689 . 1 1 58 58 TRP HH2 H 1 7.15 . . 1 . . . . 58 TRP HH2 . 7362 1 690 . 1 1 58 58 TRP HZ2 H 1 7.41 . . 1 . . . . 58 TRP HZ2 . 7362 1 691 . 1 1 58 58 TRP HZ3 H 1 7.06 . . 1 . . . . 58 TRP HZ3 . 7362 1 692 . 1 1 58 58 TRP CA C 13 58.0 . . 1 . . . . 58 TRP CA . 7362 1 693 . 1 1 58 58 TRP CB C 13 29.3 . . 1 . . . . 58 TRP CB . 7362 1 694 . 1 1 58 58 TRP CD1 C 13 126.9 . . 1 . . . . 58 TRP CD1 . 7362 1 695 . 1 1 58 58 TRP CH2 C 13 124.5 . . 1 . . . . 58 TRP CH2 . 7362 1 696 . 1 1 58 58 TRP CZ2 C 13 114.8 . . 1 . . . . 58 TRP CZ2 . 7362 1 697 . 1 1 58 58 TRP CZ3 C 13 122.0 . . 1 . . . . 58 TRP CZ3 . 7362 1 698 . 1 1 58 58 TRP N N 15 123.4 . . 1 . . . . 58 TRP N . 7362 1 699 . 1 1 58 58 TRP NE1 N 15 129.8 . . 1 . . . . 58 TRP NE1 . 7362 1 700 . 1 1 59 59 MET H H 1 7.99 . . 1 . . . . 59 MET HN . 7362 1 701 . 1 1 59 59 MET HA H 1 4.20 . . 1 . . . . 59 MET HA . 7362 1 702 . 1 1 59 59 MET HB2 H 1 1.90 . . 2 . . . . 59 MET HB2 . 7362 1 703 . 1 1 59 59 MET HB3 H 1 1.81 . . 2 . . . . 59 MET HB3 . 7362 1 704 . 1 1 59 59 MET HG2 H 1 2.27 . . 2 . . . . 59 MET HG2 . 7362 1 705 . 1 1 59 59 MET HG3 H 1 2.22 . . 2 . . . . 59 MET HG3 . 7362 1 706 . 1 1 59 59 MET CA C 13 55.8 . . 1 . . . . 59 MET CA . 7362 1 707 . 1 1 59 59 MET CB C 13 32.8 . . 1 . . . . 59 MET CB . 7362 1 708 . 1 1 59 59 MET CG C 13 32.1 . . 1 . . . . 59 MET CG . 7362 1 709 . 1 1 59 59 MET N N 15 121.3 . . 1 . . . . 59 MET N . 7362 1 710 . 1 1 60 60 SER H H 1 8.08 . . 1 . . . . 60 SER HN . 7362 1 711 . 1 1 60 60 SER HA H 1 4.29 . . 1 . . . . 60 SER HA . 7362 1 712 . 1 1 60 60 SER HB2 H 1 3.81 . . 2 . . . . 60 SER HB2 . 7362 1 713 . 1 1 60 60 SER HB3 H 1 3.89 . . 2 . . . . 60 SER HB3 . 7362 1 714 . 1 1 60 60 SER CA C 13 58.8 . . 1 . . . . 60 SER CA . 7362 1 715 . 1 1 60 60 SER CB C 13 63.4 . . 1 . . . . 60 SER CB . 7362 1 716 . 1 1 60 60 SER N N 15 116.1 . . 1 . . . . 60 SER N . 7362 1 717 . 1 1 61 61 SER H H 1 8.18 . . 1 . . . . 61 SER HN . 7362 1 718 . 1 1 61 61 SER HA H 1 4.37 . . 1 . . . . 61 SER HA . 7362 1 719 . 1 1 61 61 SER HB2 H 1 3.84 . . 2 . . . . 61 SER HB2 . 7362 1 720 . 1 1 61 61 SER HB3 H 1 3.91 . . 2 . . . . 61 SER HB3 . 7362 1 721 . 1 1 61 61 SER CA C 13 59.0 . . 1 . . . . 61 SER CA . 7362 1 722 . 1 1 61 61 SER CB C 13 63.6 . . 1 . . . . 61 SER CB . 7362 1 723 . 1 1 61 61 SER N N 15 117.4 . . 1 . . . . 61 SER N . 7362 1 724 . 1 1 62 62 LEU H H 1 8.03 . . 1 . . . . 62 LEU HN . 7362 1 725 . 1 1 62 62 LEU HA H 1 4.19 . . 1 . . . . 62 LEU HA . 7362 1 726 . 1 1 62 62 LEU HB2 H 1 1.50 . . 2 . . . . 62 LEU HB2 . 7362 1 727 . 1 1 62 62 LEU HB3 H 1 1.56 . . 2 . . . . 62 LEU HB3 . 7362 1 728 . 1 1 62 62 LEU HD11 H 1 0.79 . . 2 . . . . 62 LEU HD1 . 7362 1 729 . 1 1 62 62 LEU HD12 H 1 0.79 . . 2 . . . . 62 LEU HD1 . 7362 1 730 . 1 1 62 62 LEU HD13 H 1 0.79 . . 2 . . . . 62 LEU HD1 . 7362 1 731 . 1 1 62 62 LEU HD21 H 1 0.83 . . 2 . . . . 62 LEU HD2 . 7362 1 732 . 1 1 62 62 LEU HD22 H 1 0.83 . . 2 . . . . 62 LEU HD2 . 7362 1 733 . 1 1 62 62 LEU HD23 H 1 0.83 . . 2 . . . . 62 LEU HD2 . 7362 1 734 . 1 1 62 62 LEU HG H 1 1.54 . . 1 . . . . 62 LEU HG . 7362 1 735 . 1 1 62 62 LEU CA C 13 55.7 . . 1 . . . . 62 LEU CA . 7362 1 736 . 1 1 62 62 LEU CB C 13 42.3 . . 1 . . . . 62 LEU CB . 7362 1 737 . 1 1 62 62 LEU CD1 C 13 23.5 . . 1 . . . . 62 LEU CD1 . 7362 1 738 . 1 1 62 62 LEU CD2 C 13 25.1 . . 1 . . . . 62 LEU CD2 . 7362 1 739 . 1 1 62 62 LEU CG C 13 27.1 . . 1 . . . . 62 LEU CG . 7362 1 740 . 1 1 62 62 LEU N N 15 123.2 . . 1 . . . . 62 LEU N . 7362 1 741 . 1 1 63 63 GLU H H 1 8.04 . . 1 . . . . 63 GLU HN . 7362 1 742 . 1 1 63 63 GLU HA H 1 4.11 . . 1 . . . . 63 GLU HA . 7362 1 743 . 1 1 63 63 GLU HB2 H 1 1.86 . . 2 . . . . 63 GLU HB2 . 7362 1 744 . 1 1 63 63 GLU HB3 H 1 1.85 . . 2 . . . . 63 GLU HB3 . 7362 1 745 . 1 1 63 63 GLU HG2 H 1 2.18 . . 2 . . . . 63 GLU HG2 . 7362 1 746 . 1 1 63 63 GLU HG3 H 1 2.12 . . 2 . . . . 63 GLU HG3 . 7362 1 747 . 1 1 63 63 GLU CA C 13 56.7 . . 1 . . . . 63 GLU CA . 7362 1 748 . 1 1 63 63 GLU CB C 13 30.1 . . 1 . . . . 63 GLU CB . 7362 1 749 . 1 1 63 63 GLU CG C 13 36.0 . . 1 . . . . 63 GLU CG . 7362 1 750 . 1 1 63 63 GLU N N 15 119.9 . . 1 . . . . 63 GLU N . 7362 1 751 . 1 1 64 64 HIS H H 1 8.25 . . 1 . . . . 64 HIS HN . 7362 1 752 . 1 1 64 64 HIS HA H 1 4.61 . . 1 . . . . 64 HIS HA . 7362 1 753 . 1 1 64 64 HIS HB2 H 1 3.13 . . 2 . . . . 64 HIS HB2 . 7362 1 754 . 1 1 64 64 HIS HB3 H 1 3.05 . . 2 . . . . 64 HIS HB3 . 7362 1 755 . 1 1 64 64 HIS HD2 H 1 7.11 . . 1 . . . . 64 HIS HD2 . 7362 1 756 . 1 1 64 64 HIS CA C 13 55.6 . . 1 . . . . 64 HIS CA . 7362 1 757 . 1 1 64 64 HIS CB C 13 29.7 . . 1 . . . . 64 HIS CB . 7362 1 758 . 1 1 64 64 HIS CD2 C 13 119.8 . . 1 . . . . 64 HIS CD2 . 7362 1 759 . 1 1 64 64 HIS N N 15 118.7 . . 1 . . . . 64 HIS N . 7362 1 760 . 1 1 65 65 HIS H H 1 8.29 . . 1 . . . . 65 HIS HN . 7362 1 761 . 1 1 65 65 HIS HA H 1 4.42 . . 1 . . . . 65 HIS HA . 7362 1 762 . 1 1 65 65 HIS HB2 H 1 3.20 . . 2 . . . . 65 HIS HB2 . 7362 1 763 . 1 1 65 65 HIS HB3 H 1 3.09 . . 2 . . . . 65 HIS HB3 . 7362 1 764 . 1 1 65 65 HIS HD2 H 1 7.08 . . 1 . . . . 65 HIS HD2 . 7362 1 765 . 1 1 65 65 HIS CA C 13 57.1 . . 1 . . . . 65 HIS CA . 7362 1 766 . 1 1 65 65 HIS CB C 13 29.6 . . 1 . . . . 65 HIS CB . 7362 1 767 . 1 1 65 65 HIS CD2 C 13 119.8 . . 1 . . . . 65 HIS CD2 . 7362 1 768 . 1 1 65 65 HIS N N 15 125.5 . . 1 . . . . 65 HIS N . 7362 1 stop_ save_