data_15210 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 15210 _Entry.Title ; NMR Structure of 50S Ribosomal Protein L14e from Sulfolobus Solfataricus; Northeast Structural Genomics Consortium Target SSR105. ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2007-04-10 _Entry.Accession_date 2007-04-10 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version . _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 'Kiran Kumar' Singarapu . . . 15210 2 Yibing Wu . . . 15210 3 Adelinda Yee . . . 15210 4 Anthony semesi . . . 15210 5 cheryl Arrowsmith . . . 15210 6 Thomas Szyperski . . . 15210 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 . 'PSI, Protein Structure Initiative' 'Northeast Structural Genomics Consortium' . 15210 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 15210 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 432 15210 '15N chemical shifts' 95 15210 '1H chemical shifts' 722 15210 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2010-05-26 2007-04-10 update BMRB 'update entity name' 15210 1 . . 2007-06-05 2007-04-10 original author 'original release' 15210 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2JOY 'BMRB Entry Tracking System' 15210 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 15210 _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 50S Ribosomal Protein L14e from Sulfolobus Solfataricus; Northeast Structural Genomics Consortium Target SSR105. ; _Citation.Status published _Citation.Type 'BMRB only' _Citation.Journal_abbrev . _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _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 'Kiran Kumar' Singarapu . . . 15210 1 2 Yibing Wu . . . 15210 1 3 Adelinda Yee . . . 15210 1 4 Anthony semesi . . . 15210 1 5 cheryl Arrowsmith . . . 15210 1 6 Thomas Szyperski . . . 15210 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID '50s ribosomal protein l14e' 15210 1 'protein nmr' 15210 1 PSI-2 15210 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 15210 _Assembly.ID 1 _Assembly.Name '50s ribosomal protein l14e' _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 '50s ribosomal protein l14e' 1 $entity A . yes native no no . . . 15210 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity _Entity.Sf_category entity _Entity.Sf_framecode entity _Entity.Entry_ID 15210 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name '50s ribosomal protein l14e' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MPAIEVGRICVKVKGREAGS KCVIVDIIDDNFVLVTGPKD ITGVKRRRVNILHLEPTDKK IDIQKGASDEEVKKKLEESN LTEYMKEKIKIRMPTL ; _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 96 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 10886.001 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-26 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 16121 . L14e_ribosomal_protein . . . . . 100.00 96 100.00 100.00 1.43e-59 . . . . 15210 1 2 no PDB 2JOY . "Nmr Structure Of 50s Ribosomal Protein L14e From Sulfolobus Solfataricus: Northeast Structural Genomics Consortium Target Ssr10" . . . . . 100.00 96 100.00 100.00 1.43e-59 . . . . 15210 1 3 no PDB 2KDS . "Structure Of Ribosomal Protein L14e From Sulfolobus Solfataricus" . . . . . 98.96 95 100.00 100.00 1.17e-58 . . . . 15210 1 4 no GB AAK40722 . "LSU ribosomal protein L14E (rpl14E) [Sulfolobus solfataricus P2]" . . . . . 100.00 96 100.00 100.00 1.43e-59 . . . . 15210 1 5 no GB ACX91605 . "50S ribosomal protein L14 [Sulfolobus solfataricus 98/2]" . . . . . 100.00 96 100.00 100.00 1.43e-59 . . . . 15210 1 6 no GB AKA73699 . "50S ribosomal protein L14e [Sulfolobus solfataricus]" . . . . . 100.00 96 100.00 100.00 1.43e-59 . . . . 15210 1 7 no GB AKA76396 . "50S ribosomal protein L14e [Sulfolobus solfataricus]" . . . . . 100.00 96 100.00 100.00 1.43e-59 . . . . 15210 1 8 no GB AKA79089 . "50S ribosomal protein L14e [Sulfolobus solfataricus]" . . . . . 100.00 96 100.00 100.00 1.43e-59 . . . . 15210 1 9 no REF WP_009988801 . "50S ribosomal protein L14 [Sulfolobus solfataricus]" . . . . . 100.00 96 100.00 100.00 1.43e-59 . . . . 15210 1 10 no SP Q980C1 . "RecName: Full=50S ribosomal protein L14e" . . . . . 100.00 96 100.00 100.00 1.43e-59 . . . . 15210 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 . 15210 1 2 . PRO . 15210 1 3 . ALA . 15210 1 4 . ILE . 15210 1 5 . GLU . 15210 1 6 . VAL . 15210 1 7 . GLY . 15210 1 8 . ARG . 15210 1 9 . ILE . 15210 1 10 . CYS . 15210 1 11 . VAL . 15210 1 12 . LYS . 15210 1 13 . VAL . 15210 1 14 . LYS . 15210 1 15 . GLY . 15210 1 16 . ARG . 15210 1 17 . GLU . 15210 1 18 . ALA . 15210 1 19 . GLY . 15210 1 20 . SER . 15210 1 21 . LYS . 15210 1 22 . CYS . 15210 1 23 . VAL . 15210 1 24 . ILE . 15210 1 25 . VAL . 15210 1 26 . ASP . 15210 1 27 . ILE . 15210 1 28 . ILE . 15210 1 29 . ASP . 15210 1 30 . ASP . 15210 1 31 . ASN . 15210 1 32 . PHE . 15210 1 33 . VAL . 15210 1 34 . LEU . 15210 1 35 . VAL . 15210 1 36 . THR . 15210 1 37 . GLY . 15210 1 38 . PRO . 15210 1 39 . LYS . 15210 1 40 . ASP . 15210 1 41 . ILE . 15210 1 42 . THR . 15210 1 43 . GLY . 15210 1 44 . VAL . 15210 1 45 . LYS . 15210 1 46 . ARG . 15210 1 47 . ARG . 15210 1 48 . ARG . 15210 1 49 . VAL . 15210 1 50 . ASN . 15210 1 51 . ILE . 15210 1 52 . LEU . 15210 1 53 . HIS . 15210 1 54 . LEU . 15210 1 55 . GLU . 15210 1 56 . PRO . 15210 1 57 . THR . 15210 1 58 . ASP . 15210 1 59 . LYS . 15210 1 60 . LYS . 15210 1 61 . ILE . 15210 1 62 . ASP . 15210 1 63 . ILE . 15210 1 64 . GLN . 15210 1 65 . LYS . 15210 1 66 . GLY . 15210 1 67 . ALA . 15210 1 68 . SER . 15210 1 69 . ASP . 15210 1 70 . GLU . 15210 1 71 . GLU . 15210 1 72 . VAL . 15210 1 73 . LYS . 15210 1 74 . LYS . 15210 1 75 . LYS . 15210 1 76 . LEU . 15210 1 77 . GLU . 15210 1 78 . GLU . 15210 1 79 . SER . 15210 1 80 . ASN . 15210 1 81 . LEU . 15210 1 82 . THR . 15210 1 83 . GLU . 15210 1 84 . TYR . 15210 1 85 . MET . 15210 1 86 . LYS . 15210 1 87 . GLU . 15210 1 88 . LYS . 15210 1 89 . ILE . 15210 1 90 . LYS . 15210 1 91 . ILE . 15210 1 92 . ARG . 15210 1 93 . MET . 15210 1 94 . PRO . 15210 1 95 . THR . 15210 1 96 . LEU . 15210 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 15210 1 . PRO 2 2 15210 1 . ALA 3 3 15210 1 . ILE 4 4 15210 1 . GLU 5 5 15210 1 . VAL 6 6 15210 1 . GLY 7 7 15210 1 . ARG 8 8 15210 1 . ILE 9 9 15210 1 . CYS 10 10 15210 1 . VAL 11 11 15210 1 . LYS 12 12 15210 1 . VAL 13 13 15210 1 . LYS 14 14 15210 1 . GLY 15 15 15210 1 . ARG 16 16 15210 1 . GLU 17 17 15210 1 . ALA 18 18 15210 1 . GLY 19 19 15210 1 . SER 20 20 15210 1 . LYS 21 21 15210 1 . CYS 22 22 15210 1 . VAL 23 23 15210 1 . ILE 24 24 15210 1 . VAL 25 25 15210 1 . ASP 26 26 15210 1 . ILE 27 27 15210 1 . ILE 28 28 15210 1 . ASP 29 29 15210 1 . ASP 30 30 15210 1 . ASN 31 31 15210 1 . PHE 32 32 15210 1 . VAL 33 33 15210 1 . LEU 34 34 15210 1 . VAL 35 35 15210 1 . THR 36 36 15210 1 . GLY 37 37 15210 1 . PRO 38 38 15210 1 . LYS 39 39 15210 1 . ASP 40 40 15210 1 . ILE 41 41 15210 1 . THR 42 42 15210 1 . GLY 43 43 15210 1 . VAL 44 44 15210 1 . LYS 45 45 15210 1 . ARG 46 46 15210 1 . ARG 47 47 15210 1 . ARG 48 48 15210 1 . VAL 49 49 15210 1 . ASN 50 50 15210 1 . ILE 51 51 15210 1 . LEU 52 52 15210 1 . HIS 53 53 15210 1 . LEU 54 54 15210 1 . GLU 55 55 15210 1 . PRO 56 56 15210 1 . THR 57 57 15210 1 . ASP 58 58 15210 1 . LYS 59 59 15210 1 . LYS 60 60 15210 1 . ILE 61 61 15210 1 . ASP 62 62 15210 1 . ILE 63 63 15210 1 . GLN 64 64 15210 1 . LYS 65 65 15210 1 . GLY 66 66 15210 1 . ALA 67 67 15210 1 . SER 68 68 15210 1 . ASP 69 69 15210 1 . GLU 70 70 15210 1 . GLU 71 71 15210 1 . VAL 72 72 15210 1 . LYS 73 73 15210 1 . LYS 74 74 15210 1 . LYS 75 75 15210 1 . LEU 76 76 15210 1 . GLU 77 77 15210 1 . GLU 78 78 15210 1 . SER 79 79 15210 1 . ASN 80 80 15210 1 . LEU 81 81 15210 1 . THR 82 82 15210 1 . GLU 83 83 15210 1 . TYR 84 84 15210 1 . MET 85 85 15210 1 . LYS 86 86 15210 1 . GLU 87 87 15210 1 . LYS 88 88 15210 1 . ILE 89 89 15210 1 . LYS 90 90 15210 1 . ILE 91 91 15210 1 . ARG 92 92 15210 1 . MET 93 93 15210 1 . PRO 94 94 15210 1 . THR 95 95 15210 1 . LEU 96 96 15210 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 15210 _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 $entity . 2287 plasmid . 'Sulfolobus solfataricus' . . . Archaea . Sulfolobus solfataricus . . . . . . . . . . . . . . . . . . . . . 15210 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 15210 _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 $entity . 'recombinant technology' 'E. coli - cell free' . . . . . . . . . . . . . . . . . . . . . p11 . . . . . . 15210 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 15210 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 entity '[U-100% 13C; U-100% 15N]' . . 1 $entity . . 0.5 . . mM . . . . 15210 1 2 H2O . . . . . . . 90 . . % . . . . 15210 1 3 D2O . . . . . . . 10 . . % . . . . 15210 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 15210 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _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 entity '[U-10% 13C; U-99% 15N]' . . 1 $entity . . 0.5 . . mM . . . . 15210 2 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 15210 _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' 320 20 mM 15210 1 pH 7.0 0.1 pH 15210 1 pressure 1 . atm 15210 1 temperature 298 1 K 15210 1 stop_ save_ ############################ # Computer software used # ############################ save_VNMR _Software.Sf_category software _Software.Sf_framecode VNMR _Software.Entry_ID 15210 _Software.ID 1 _Software.Name VNMR _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Varian . . 15210 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 15210 1 stop_ save_ save_AutoAssign _Software.Sf_category software _Software.Sf_framecode AutoAssign _Software.Entry_ID 15210 _Software.ID 2 _Software.Name AutoAssign _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Zimmerman, Moseley, Kulikowski, Montelione' . . 15210 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 15210 2 stop_ save_ save_AutoStructure _Software.Sf_category software _Software.Sf_framecode AutoStructure _Software.Entry_ID 15210 _Software.ID 3 _Software.Name AutoStruct _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Huang, Swapana, Rajan, Ke, Xia, Shukla, Inouye and Montelione' . . 15210 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 15210 3 stop_ save_ save_CNS _Software.Sf_category software _Software.Sf_framecode CNS _Software.Entry_ID 15210 _Software.ID 4 _Software.Name CNS _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Brunger, Adams, Clore, Gros, Nilges and Read' . . 15210 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 15210 4 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 15210 _Software.ID 5 _Software.Name CYANA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 15210 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 15210 5 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 15210 _Software.ID 6 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 15210 6 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 15210 6 stop_ save_ save_Molmol _Software.Sf_category software _Software.Sf_framecode Molmol _Software.Entry_ID 15210 _Software.ID 7 _Software.Name Molmol _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Koradi, Billeter and Wuthrich' . . 15210 7 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure display' 15210 7 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_750 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_750 _NMR_spectrometer.Entry_ID 15210 _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_600 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_600 _NMR_spectrometer.Entry_ID 15210 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 15210 _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 . . . 15210 1 2 spectrometer_2 Varian INOVA . 600 . . . 15210 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 15210 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15210 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15210 1 3 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15210 1 4 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15210 1 5 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15210 1 6 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15210 1 7 '4,3 D GFT HCCH COFY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15210 1 8 '3D HCCH COSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15210 1 9 '3D Simultanious NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15210 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 15210 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.251449530 . . . . . . . . . 15210 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 15210 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.101329118 . . . . . . . . . 15210 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 15210 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 15210 1 2 '2D 1H-13C HSQC' . . . 15210 1 3 '3D CBCA(CO)NH' . . . 15210 1 4 '3D HNCACB' . . . 15210 1 5 '3D HNCO' . . . 15210 1 6 '3D HBHA(CO)NH' . . . 15210 1 7 '4,3 D GFT HCCH COFY' . . . 15210 1 8 '3D HCCH COSY' . . . 15210 1 9 '3D Simultanious NOESY' . . . 15210 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $VNMR . . 15210 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 2 2 PRO HA H 1 4.268 0.000 . 1 . . . . 2 PRO HA . 15210 1 2 . 1 1 2 2 PRO HB2 H 1 1.676 0.000 . 2 . . . . 2 PRO HB2 . 15210 1 3 . 1 1 2 2 PRO HB3 H 1 2.240 0.000 . 2 . . . . 2 PRO HB3 . 15210 1 4 . 1 1 2 2 PRO HD2 H 1 3.552 0.000 . 2 . . . . 2 PRO HD2 . 15210 1 5 . 1 1 2 2 PRO HD3 H 1 3.843 0.000 . 2 . . . . 2 PRO HD3 . 15210 1 6 . 1 1 2 2 PRO HG2 H 1 1.905 0.000 . 2 . . . . 2 PRO HG2 . 15210 1 7 . 1 1 2 2 PRO HG3 H 1 1.867 0.000 . 2 . . . . 2 PRO HG3 . 15210 1 8 . 1 1 2 2 PRO C C 13 175.855 0.000 . 1 . . . . 2 PRO C . 15210 1 9 . 1 1 2 2 PRO CA C 13 63.215 0.000 . 1 . . . . 2 PRO CA . 15210 1 10 . 1 1 2 2 PRO CB C 13 32.177 0.000 . 1 . . . . 2 PRO CB . 15210 1 11 . 1 1 2 2 PRO CD C 13 50.677 0.000 . 1 . . . . 2 PRO CD . 15210 1 12 . 1 1 2 2 PRO CG C 13 27.537 0.000 . 1 . . . . 2 PRO CG . 15210 1 13 . 1 1 3 3 ALA H H 1 7.926 0.000 . 1 . . . . 3 ALA H . 15210 1 14 . 1 1 3 3 ALA HA H 1 4.196 0.000 . 1 . . . . 3 ALA HA . 15210 1 15 . 1 1 3 3 ALA HB1 H 1 1.337 0.000 . 1 . . . . 3 ALA QB . 15210 1 16 . 1 1 3 3 ALA HB2 H 1 1.337 0.000 . 1 . . . . 3 ALA QB . 15210 1 17 . 1 1 3 3 ALA HB3 H 1 1.337 0.000 . 1 . . . . 3 ALA QB . 15210 1 18 . 1 1 3 3 ALA C C 13 178.090 0.000 . 1 . . . . 3 ALA C . 15210 1 19 . 1 1 3 3 ALA CA C 13 52.438 0.000 . 1 . . . . 3 ALA CA . 15210 1 20 . 1 1 3 3 ALA CB C 13 19.453 0.000 . 1 . . . . 3 ALA CB . 15210 1 21 . 1 1 3 3 ALA N N 15 120.780 0.000 . 1 . . . . 3 ALA N . 15210 1 22 . 1 1 4 4 ILE H H 1 8.276 0.000 . 1 . . . . 4 ILE H . 15210 1 23 . 1 1 4 4 ILE HA H 1 3.679 0.000 . 1 . . . . 4 ILE HA . 15210 1 24 . 1 1 4 4 ILE HB H 1 2.170 0.000 . 1 . . . . 4 ILE HB . 15210 1 25 . 1 1 4 4 ILE HD11 H 1 0.727 0.006 . 1 . . . . 4 ILE QD1 . 15210 1 26 . 1 1 4 4 ILE HD12 H 1 0.727 0.006 . 1 . . . . 4 ILE QD1 . 15210 1 27 . 1 1 4 4 ILE HD13 H 1 0.727 0.006 . 1 . . . . 4 ILE QD1 . 15210 1 28 . 1 1 4 4 ILE HG12 H 1 1.516 0.000 . 2 . . . . 4 ILE HG12 . 15210 1 29 . 1 1 4 4 ILE HG13 H 1 1.479 0.004 . 2 . . . . 4 ILE HG13 . 15210 1 30 . 1 1 4 4 ILE HG21 H 1 0.765 0.000 . 1 . . . . 4 ILE QG2 . 15210 1 31 . 1 1 4 4 ILE HG22 H 1 0.765 0.000 . 1 . . . . 4 ILE QG2 . 15210 1 32 . 1 1 4 4 ILE HG23 H 1 0.765 0.000 . 1 . . . . 4 ILE QG2 . 15210 1 33 . 1 1 4 4 ILE C C 13 173.231 0.000 . 1 . . . . 4 ILE C . 15210 1 34 . 1 1 4 4 ILE CA C 13 60.314 0.000 . 1 . . . . 4 ILE CA . 15210 1 35 . 1 1 4 4 ILE CB C 13 34.521 0.000 . 1 . . . . 4 ILE CB . 15210 1 36 . 1 1 4 4 ILE CD1 C 13 9.860 0.000 . 1 . . . . 4 ILE CD1 . 15210 1 37 . 1 1 4 4 ILE CG1 C 13 26.174 0.000 . 1 . . . . 4 ILE CG1 . 15210 1 38 . 1 1 4 4 ILE CG2 C 13 16.941 0.000 . 1 . . . . 4 ILE CG2 . 15210 1 39 . 1 1 4 4 ILE N N 15 120.136 0.000 . 1 . . . . 4 ILE N . 15210 1 40 . 1 1 5 5 GLU H H 1 6.804 0.002 . 1 . . . . 5 GLU H . 15210 1 41 . 1 1 5 5 GLU HA H 1 4.668 0.004 . 1 . . . . 5 GLU HA . 15210 1 42 . 1 1 5 5 GLU HB2 H 1 2.058 0.000 . 2 . . . . 5 GLU HB2 . 15210 1 43 . 1 1 5 5 GLU HB3 H 1 2.074 0.000 . 2 . . . . 5 GLU HB3 . 15210 1 44 . 1 1 5 5 GLU HG2 H 1 2.202 0.000 . 2 . . . . 5 GLU HG2 . 15210 1 45 . 1 1 5 5 GLU HG3 H 1 1.857 0.000 . 2 . . . . 5 GLU HG3 . 15210 1 46 . 1 1 5 5 GLU C C 13 174.397 0.000 . 1 . . . . 5 GLU C . 15210 1 47 . 1 1 5 5 GLU CA C 13 53.578 0.000 . 1 . . . . 5 GLU CA . 15210 1 48 . 1 1 5 5 GLU CB C 13 32.435 0.000 . 1 . . . . 5 GLU CB . 15210 1 49 . 1 1 5 5 GLU CG C 13 34.694 0.000 . 1 . . . . 5 GLU CG . 15210 1 50 . 1 1 5 5 GLU N N 15 123.245 0.000 . 1 . . . . 5 GLU N . 15210 1 51 . 1 1 6 6 VAL H H 1 8.943 0.000 . 1 . . . . 6 VAL H . 15210 1 52 . 1 1 6 6 VAL HA H 1 3.318 0.007 . 1 . . . . 6 VAL HA . 15210 1 53 . 1 1 6 6 VAL HB H 1 2.001 0.000 . 1 . . . . 6 VAL HB . 15210 1 54 . 1 1 6 6 VAL HG11 H 1 0.970 0.003 . 2 . . . . 6 VAL QG1 . 15210 1 55 . 1 1 6 6 VAL HG12 H 1 0.970 0.003 . 2 . . . . 6 VAL QG1 . 15210 1 56 . 1 1 6 6 VAL HG13 H 1 0.970 0.003 . 2 . . . . 6 VAL QG1 . 15210 1 57 . 1 1 6 6 VAL HG21 H 1 0.798 0.004 . 2 . . . . 6 VAL QG2 . 15210 1 58 . 1 1 6 6 VAL HG22 H 1 0.798 0.004 . 2 . . . . 6 VAL QG2 . 15210 1 59 . 1 1 6 6 VAL HG23 H 1 0.798 0.004 . 2 . . . . 6 VAL QG2 . 15210 1 60 . 1 1 6 6 VAL C C 13 177.167 0.000 . 1 . . . . 6 VAL C . 15210 1 61 . 1 1 6 6 VAL CA C 13 65.876 0.000 . 1 . . . . 6 VAL CA . 15210 1 62 . 1 1 6 6 VAL CB C 13 31.221 0.000 . 1 . . . . 6 VAL CB . 15210 1 63 . 1 1 6 6 VAL CG1 C 13 22.850 0.000 . 1 . . . . 6 VAL CG1 . 15210 1 64 . 1 1 6 6 VAL CG2 C 13 20.980 0.009 . 1 . . . . 6 VAL CG2 . 15210 1 65 . 1 1 6 6 VAL N N 15 122.388 0.000 . 1 . . . . 6 VAL N . 15210 1 66 . 1 1 7 7 GLY H H 1 9.535 0.005 . 1 . . . . 7 GLY H . 15210 1 67 . 1 1 7 7 GLY HA2 H 1 3.192 0.006 . 2 . . . . 7 GLY HA2 . 15210 1 68 . 1 1 7 7 GLY HA3 H 1 5.013 0.005 . 2 . . . . 7 GLY HA3 . 15210 1 69 . 1 1 7 7 GLY C C 13 174.009 0.000 . 1 . . . . 7 GLY C . 15210 1 70 . 1 1 7 7 GLY CA C 13 44.811 0.000 . 1 . . . . 7 GLY CA . 15210 1 71 . 1 1 7 7 GLY N N 15 116.126 0.000 . 1 . . . . 7 GLY N . 15210 1 72 . 1 1 8 8 ARG H H 1 8.191 0.000 . 1 . . . . 8 ARG H . 15210 1 73 . 1 1 8 8 ARG HA H 1 4.232 0.000 . 1 . . . . 8 ARG HA . 15210 1 74 . 1 1 8 8 ARG HB2 H 1 2.160 0.000 . 2 . . . . 8 ARG HB2 . 15210 1 75 . 1 1 8 8 ARG HB3 H 1 2.270 0.000 . 2 . . . . 8 ARG HB3 . 15210 1 76 . 1 1 8 8 ARG HD2 H 1 3.133 0.000 . 2 . . . . 8 ARG HD2 . 15210 1 77 . 1 1 8 8 ARG HD3 H 1 3.130 0.000 . 2 . . . . 8 ARG HD3 . 15210 1 78 . 1 1 8 8 ARG HG2 H 1 1.999 0.000 . 2 . . . . 8 ARG HG2 . 15210 1 79 . 1 1 8 8 ARG HG3 H 1 1.884 0.000 . 2 . . . . 8 ARG HG3 . 15210 1 80 . 1 1 8 8 ARG C C 13 175.677 0.000 . 1 . . . . 8 ARG C . 15210 1 81 . 1 1 8 8 ARG CA C 13 55.074 0.000 . 1 . . . . 8 ARG CA . 15210 1 82 . 1 1 8 8 ARG CB C 13 29.284 0.000 . 1 . . . . 8 ARG CB . 15210 1 83 . 1 1 8 8 ARG CD C 13 43.100 0.000 . 1 . . . . 8 ARG CD . 15210 1 84 . 1 1 8 8 ARG CG C 13 24.124 0.000 . 1 . . . . 8 ARG CG . 15210 1 85 . 1 1 8 8 ARG N N 15 120.566 0.000 . 1 . . . . 8 ARG N . 15210 1 86 . 1 1 9 9 ILE H H 1 8.636 0.000 . 1 . . . . 9 ILE H . 15210 1 87 . 1 1 9 9 ILE HA H 1 4.984 0.000 . 1 . . . . 9 ILE HA . 15210 1 88 . 1 1 9 9 ILE HB H 1 1.923 0.003 . 1 . . . . 9 ILE HB . 15210 1 89 . 1 1 9 9 ILE HD11 H 1 0.897 0.002 . 1 . . . . 9 ILE QD1 . 15210 1 90 . 1 1 9 9 ILE HD12 H 1 0.897 0.002 . 1 . . . . 9 ILE QD1 . 15210 1 91 . 1 1 9 9 ILE HD13 H 1 0.897 0.002 . 1 . . . . 9 ILE QD1 . 15210 1 92 . 1 1 9 9 ILE HG12 H 1 1.768 0.000 . 2 . . . . 9 ILE HG12 . 15210 1 93 . 1 1 9 9 ILE HG13 H 1 1.247 0.000 . 2 . . . . 9 ILE HG13 . 15210 1 94 . 1 1 9 9 ILE HG21 H 1 1.232 0.000 . 1 . . . . 9 ILE QG2 . 15210 1 95 . 1 1 9 9 ILE HG22 H 1 1.232 0.000 . 1 . . . . 9 ILE QG2 . 15210 1 96 . 1 1 9 9 ILE HG23 H 1 1.232 0.000 . 1 . . . . 9 ILE QG2 . 15210 1 97 . 1 1 9 9 ILE C C 13 177.555 0.000 . 1 . . . . 9 ILE C . 15210 1 98 . 1 1 9 9 ILE CA C 13 61.489 0.000 . 1 . . . . 9 ILE CA . 15210 1 99 . 1 1 9 9 ILE CB C 13 36.740 0.006 . 1 . . . . 9 ILE CB . 15210 1 100 . 1 1 9 9 ILE CD1 C 13 15.342 0.000 . 1 . . . . 9 ILE CD1 . 15210 1 101 . 1 1 9 9 ILE CG1 C 13 29.969 0.000 . 1 . . . . 9 ILE CG1 . 15210 1 102 . 1 1 9 9 ILE CG2 C 13 18.397 0.000 . 1 . . . . 9 ILE CG2 . 15210 1 103 . 1 1 9 9 ILE N N 15 130.075 0.000 . 1 . . . . 9 ILE N . 15210 1 104 . 1 1 10 10 CYS H H 1 9.628 0.000 . 1 . . . . 10 CYS H . 15210 1 105 . 1 1 10 10 CYS HA H 1 5.468 0.000 . 1 . . . . 10 CYS HA . 15210 1 106 . 1 1 10 10 CYS HB2 H 1 2.413 0.000 . 2 . . . . 10 CYS HB2 . 15210 1 107 . 1 1 10 10 CYS HB3 H 1 2.725 0.000 . 2 . . . . 10 CYS HB3 . 15210 1 108 . 1 1 10 10 CYS C C 13 172.308 0.000 . 1 . . . . 10 CYS C . 15210 1 109 . 1 1 10 10 CYS CA C 13 57.321 0.000 . 1 . . . . 10 CYS CA . 15210 1 110 . 1 1 10 10 CYS CB C 13 33.181 0.000 . 1 . . . . 10 CYS CB . 15210 1 111 . 1 1 10 10 CYS N N 15 126.685 0.000 . 1 . . . . 10 CYS N . 15210 1 112 . 1 1 11 11 VAL H H 1 8.977 0.003 . 1 . . . . 11 VAL H . 15210 1 113 . 1 1 11 11 VAL HA H 1 4.334 0.001 . 1 . . . . 11 VAL HA . 15210 1 114 . 1 1 11 11 VAL HB H 1 1.907 0.001 . 1 . . . . 11 VAL HB . 15210 1 115 . 1 1 11 11 VAL HG11 H 1 0.862 0.004 . 2 . . . . 11 VAL QG1 . 15210 1 116 . 1 1 11 11 VAL HG12 H 1 0.862 0.004 . 2 . . . . 11 VAL QG1 . 15210 1 117 . 1 1 11 11 VAL HG13 H 1 0.862 0.004 . 2 . . . . 11 VAL QG1 . 15210 1 118 . 1 1 11 11 VAL HG21 H 1 0.752 0.000 . 2 . . . . 11 VAL QG2 . 15210 1 119 . 1 1 11 11 VAL HG22 H 1 0.752 0.000 . 2 . . . . 11 VAL QG2 . 15210 1 120 . 1 1 11 11 VAL HG23 H 1 0.752 0.000 . 2 . . . . 11 VAL QG2 . 15210 1 121 . 1 1 11 11 VAL C C 13 175.920 0.000 . 1 . . . . 11 VAL C . 15210 1 122 . 1 1 11 11 VAL CA C 13 61.124 0.000 . 1 . . . . 11 VAL CA . 15210 1 123 . 1 1 11 11 VAL CB C 13 34.197 0.000 . 1 . . . . 11 VAL CB . 15210 1 124 . 1 1 11 11 VAL CG1 C 13 21.756 0.000 . 1 . . . . 11 VAL CG1 . 15210 1 125 . 1 1 11 11 VAL CG2 C 13 20.869 0.000 . 1 . . . . 11 VAL CG2 . 15210 1 126 . 1 1 11 11 VAL N N 15 120.178 0.000 . 1 . . . . 11 VAL N . 15210 1 127 . 1 1 12 12 LYS H H 1 8.981 0.000 . 1 . . . . 12 LYS H . 15210 1 128 . 1 1 12 12 LYS HA H 1 4.802 0.000 . 1 . . . . 12 LYS HA . 15210 1 129 . 1 1 12 12 LYS HB2 H 1 2.152 0.006 . 2 . . . . 12 LYS HB2 . 15210 1 130 . 1 1 12 12 LYS HB3 H 1 1.564 0.000 . 2 . . . . 12 LYS HB3 . 15210 1 131 . 1 1 12 12 LYS HD2 H 1 1.790 0.000 . 2 . . . . 12 LYS HD2 . 15210 1 132 . 1 1 12 12 LYS HD3 H 1 1.791 0.000 . 2 . . . . 12 LYS HD3 . 15210 1 133 . 1 1 12 12 LYS HE2 H 1 3.127 0.000 . 2 . . . . 12 LYS HE2 . 15210 1 134 . 1 1 12 12 LYS HE3 H 1 3.126 0.000 . 2 . . . . 12 LYS HE3 . 15210 1 135 . 1 1 12 12 LYS HG2 H 1 1.593 0.000 . 2 . . . . 12 LYS HG2 . 15210 1 136 . 1 1 12 12 LYS HG3 H 1 1.592 0.000 . 2 . . . . 12 LYS HG3 . 15210 1 137 . 1 1 12 12 LYS C C 13 176.648 0.000 . 1 . . . . 12 LYS C . 15210 1 138 . 1 1 12 12 LYS CA C 13 56.517 0.000 . 1 . . . . 12 LYS CA . 15210 1 139 . 1 1 12 12 LYS CB C 13 33.029 0.000 . 1 . . . . 12 LYS CB . 15210 1 140 . 1 1 12 12 LYS CD C 13 27.477 0.000 . 1 . . . . 12 LYS CD . 15210 1 141 . 1 1 12 12 LYS CE C 13 41.955 0.000 . 1 . . . . 12 LYS CE . 15210 1 142 . 1 1 12 12 LYS CG C 13 26.242 0.000 . 1 . . . . 12 LYS CG . 15210 1 143 . 1 1 12 12 LYS N N 15 128.291 0.000 . 1 . . . . 12 LYS N . 15210 1 144 . 1 1 13 13 VAL H H 1 8.611 0.000 . 1 . . . . 13 VAL H . 15210 1 145 . 1 1 13 13 VAL HA H 1 4.525 0.000 . 1 . . . . 13 VAL HA . 15210 1 146 . 1 1 13 13 VAL HB H 1 2.417 0.000 . 1 . . . . 13 VAL HB . 15210 1 147 . 1 1 13 13 VAL HG11 H 1 0.867 0.000 . 2 . . . . 13 VAL QG1 . 15210 1 148 . 1 1 13 13 VAL HG12 H 1 0.867 0.000 . 2 . . . . 13 VAL QG1 . 15210 1 149 . 1 1 13 13 VAL HG13 H 1 0.867 0.000 . 2 . . . . 13 VAL QG1 . 15210 1 150 . 1 1 13 13 VAL HG21 H 1 0.727 0.000 . 2 . . . . 13 VAL QG2 . 15210 1 151 . 1 1 13 13 VAL HG22 H 1 0.727 0.000 . 2 . . . . 13 VAL QG2 . 15210 1 152 . 1 1 13 13 VAL HG23 H 1 0.727 0.000 . 2 . . . . 13 VAL QG2 . 15210 1 153 . 1 1 13 13 VAL C C 13 174.478 0.000 . 1 . . . . 13 VAL C . 15210 1 154 . 1 1 13 13 VAL CA C 13 61.794 0.000 . 1 . . . . 13 VAL CA . 15210 1 155 . 1 1 13 13 VAL CB C 13 32.165 0.000 . 1 . . . . 13 VAL CB . 15210 1 156 . 1 1 13 13 VAL CG1 C 13 21.922 0.000 . 1 . . . . 13 VAL CG1 . 15210 1 157 . 1 1 13 13 VAL CG2 C 13 18.150 0.000 . 1 . . . . 13 VAL CG2 . 15210 1 158 . 1 1 13 13 VAL N N 15 118.910 0.000 . 1 . . . . 13 VAL N . 15210 1 159 . 1 1 14 14 LYS H H 1 7.290 0.000 . 1 . . . . 14 LYS H . 15210 1 160 . 1 1 14 14 LYS HA H 1 4.592 0.000 . 1 . . . . 14 LYS HA . 15210 1 161 . 1 1 14 14 LYS HB2 H 1 1.415 0.000 . 2 . . . . 14 LYS HB2 . 15210 1 162 . 1 1 14 14 LYS HB3 H 1 1.140 0.000 . 2 . . . . 14 LYS HB3 . 15210 1 163 . 1 1 14 14 LYS HD2 H 1 1.388 0.000 . 2 . . . . 14 LYS HD2 . 15210 1 164 . 1 1 14 14 LYS HD3 H 1 1.390 0.000 . 2 . . . . 14 LYS HD3 . 15210 1 165 . 1 1 14 14 LYS HE2 H 1 2.855 0.000 . 2 . . . . 14 LYS HE2 . 15210 1 166 . 1 1 14 14 LYS HE3 H 1 2.855 0.000 . 2 . . . . 14 LYS HE3 . 15210 1 167 . 1 1 14 14 LYS HG2 H 1 1.130 0.000 . 2 . . . . 14 LYS HG2 . 15210 1 168 . 1 1 14 14 LYS HG3 H 1 1.128 0.000 . 2 . . . . 14 LYS HG3 . 15210 1 169 . 1 1 14 14 LYS C C 13 177.750 0.000 . 1 . . . . 14 LYS C . 15210 1 170 . 1 1 14 14 LYS CA C 13 54.303 0.000 . 1 . . . . 14 LYS CA . 15210 1 171 . 1 1 14 14 LYS CB C 13 36.859 0.000 . 1 . . . . 14 LYS CB . 15210 1 172 . 1 1 14 14 LYS CD C 13 28.780 0.000 . 1 . . . . 14 LYS CD . 15210 1 173 . 1 1 14 14 LYS CE C 13 42.075 0.000 . 1 . . . . 14 LYS CE . 15210 1 174 . 1 1 14 14 LYS CG C 13 25.139 0.000 . 1 . . . . 14 LYS CG . 15210 1 175 . 1 1 14 14 LYS N N 15 118.338 0.000 . 1 . . . . 14 LYS N . 15210 1 176 . 1 1 15 15 GLY H H 1 8.488 0.000 . 1 . . . . 15 GLY H . 15210 1 177 . 1 1 15 15 GLY HA2 H 1 3.985 0.000 . 2 . . . . 15 GLY HA2 . 15210 1 178 . 1 1 15 15 GLY HA3 H 1 4.016 0.000 . 2 . . . . 15 GLY HA3 . 15210 1 179 . 1 1 15 15 GLY C C 13 180.001 0.000 . 1 . . . . 15 GLY C . 15210 1 180 . 1 1 15 15 GLY CA C 13 45.330 0.000 . 1 . . . . 15 GLY CA . 15210 1 181 . 1 1 15 15 GLY N N 15 110.619 0.000 . 1 . . . . 15 GLY N . 15210 1 182 . 1 1 16 16 ARG H H 1 8.250 0.000 . 1 . . . . 16 ARG H . 15210 1 183 . 1 1 16 16 ARG HA H 1 4.086 0.000 . 1 . . . . 16 ARG HA . 15210 1 184 . 1 1 16 16 ARG HB2 H 1 1.875 0.000 . 2 . . . . 16 ARG HB2 . 15210 1 185 . 1 1 16 16 ARG HB3 H 1 1.873 0.000 . 2 . . . . 16 ARG HB3 . 15210 1 186 . 1 1 16 16 ARG HD2 H 1 3.281 0.000 . 2 . . . . 16 ARG HD2 . 15210 1 187 . 1 1 16 16 ARG HD3 H 1 3.280 0.000 . 2 . . . . 16 ARG HD3 . 15210 1 188 . 1 1 16 16 ARG HG2 H 1 1.743 0.000 . 2 . . . . 16 ARG HG2 . 15210 1 189 . 1 1 16 16 ARG HG3 H 1 1.741 0.000 . 2 . . . . 16 ARG HG3 . 15210 1 190 . 1 1 16 16 ARG C C 13 174.980 0.000 . 1 . . . . 16 ARG C . 15210 1 191 . 1 1 16 16 ARG CA C 13 58.297 0.000 . 1 . . . . 16 ARG CA . 15210 1 192 . 1 1 16 16 ARG CB C 13 30.053 0.000 . 1 . . . . 16 ARG CB . 15210 1 193 . 1 1 16 16 ARG CD C 13 43.100 0.000 . 1 . . . . 16 ARG CD . 15210 1 194 . 1 1 16 16 ARG CG C 13 27.310 0.000 . 1 . . . . 16 ARG CG . 15210 1 195 . 1 1 16 16 ARG N N 15 117.073 0.000 . 1 . . . . 16 ARG N . 15210 1 196 . 1 1 17 17 GLU H H 1 8.521 0.000 . 1 . . . . 17 GLU H . 15210 1 197 . 1 1 17 17 GLU HA H 1 4.122 0.000 . 1 . . . . 17 GLU HA . 15210 1 198 . 1 1 17 17 GLU HB2 H 1 3.000 0.000 . 2 . . . . 17 GLU HB2 . 15210 1 199 . 1 1 17 17 GLU HB3 H 1 3.000 0.000 . 2 . . . . 17 GLU HB3 . 15210 1 200 . 1 1 17 17 GLU HG2 H 1 2.324 0.000 . 2 . . . . 17 GLU HG2 . 15210 1 201 . 1 1 17 17 GLU HG3 H 1 2.310 0.000 . 2 . . . . 17 GLU HG3 . 15210 1 202 . 1 1 17 17 GLU C C 13 175.337 0.000 . 1 . . . . 17 GLU C . 15210 1 203 . 1 1 17 17 GLU CA C 13 55.644 0.000 . 1 . . . . 17 GLU CA . 15210 1 204 . 1 1 17 17 GLU CB C 13 27.474 0.000 . 1 . . . . 17 GLU CB . 15210 1 205 . 1 1 17 17 GLU CG C 13 36.405 0.000 . 1 . . . . 17 GLU CG . 15210 1 206 . 1 1 17 17 GLU N N 15 123.293 0.000 . 1 . . . . 17 GLU N . 15210 1 207 . 1 1 18 18 ALA H H 1 7.279 0.000 . 1 . . . . 18 ALA H . 15210 1 208 . 1 1 18 18 ALA HA H 1 3.744 0.001 . 1 . . . . 18 ALA HA . 15210 1 209 . 1 1 18 18 ALA HB1 H 1 1.192 0.000 . 1 . . . . 18 ALA QB . 15210 1 210 . 1 1 18 18 ALA HB2 H 1 1.192 0.000 . 1 . . . . 18 ALA QB . 15210 1 211 . 1 1 18 18 ALA HB3 H 1 1.192 0.000 . 1 . . . . 18 ALA QB . 15210 1 212 . 1 1 18 18 ALA C C 13 178.884 0.000 . 1 . . . . 18 ALA C . 15210 1 213 . 1 1 18 18 ALA CA C 13 53.495 0.000 . 1 . . . . 18 ALA CA . 15210 1 214 . 1 1 18 18 ALA CB C 13 17.501 0.000 . 1 . . . . 18 ALA CB . 15210 1 215 . 1 1 18 18 ALA N N 15 120.634 0.000 . 1 . . . . 18 ALA N . 15210 1 216 . 1 1 19 19 GLY H H 1 9.494 0.002 . 1 . . . . 19 GLY H . 15210 1 217 . 1 1 19 19 GLY HA2 H 1 3.467 0.005 . 2 . . . . 19 GLY HA2 . 15210 1 218 . 1 1 19 19 GLY HA3 H 1 4.686 0.007 . 2 . . . . 19 GLY HA3 . 15210 1 219 . 1 1 19 19 GLY C C 13 173.749 0.000 . 1 . . . . 19 GLY C . 15210 1 220 . 1 1 19 19 GLY CA C 13 45.130 0.000 . 1 . . . . 19 GLY CA . 15210 1 221 . 1 1 19 19 GLY N N 15 112.549 0.000 . 1 . . . . 19 GLY N . 15210 1 222 . 1 1 20 20 SER H H 1 8.201 0.001 . 1 . . . . 20 SER H . 15210 1 223 . 1 1 20 20 SER HA H 1 4.882 0.000 . 1 . . . . 20 SER HA . 15210 1 224 . 1 1 20 20 SER HB2 H 1 3.944 0.001 . 2 . . . . 20 SER HB2 . 15210 1 225 . 1 1 20 20 SER HB3 H 1 3.942 0.000 . 2 . . . . 20 SER HB3 . 15210 1 226 . 1 1 20 20 SER C C 13 173.102 0.000 . 1 . . . . 20 SER C . 15210 1 227 . 1 1 20 20 SER CA C 13 58.531 0.000 . 1 . . . . 20 SER CA . 15210 1 228 . 1 1 20 20 SER CB C 13 64.702 0.000 . 1 . . . . 20 SER CB . 15210 1 229 . 1 1 20 20 SER N N 15 115.606 0.000 . 1 . . . . 20 SER N . 15210 1 230 . 1 1 21 21 LYS H H 1 8.858 0.000 . 1 . . . . 21 LYS H . 15210 1 231 . 1 1 21 21 LYS HA H 1 5.377 0.000 . 1 . . . . 21 LYS HA . 15210 1 232 . 1 1 21 21 LYS HB2 H 1 1.879 0.005 . 2 . . . . 21 LYS HB2 . 15210 1 233 . 1 1 21 21 LYS HB3 H 1 2.112 0.000 . 2 . . . . 21 LYS HB3 . 15210 1 234 . 1 1 21 21 LYS HD2 H 1 1.602 0.000 . 2 . . . . 21 LYS HD2 . 15210 1 235 . 1 1 21 21 LYS HD3 H 1 1.451 0.002 . 2 . . . . 21 LYS HD3 . 15210 1 236 . 1 1 21 21 LYS HE2 H 1 2.617 0.002 . 2 . . . . 21 LYS HE2 . 15210 1 237 . 1 1 21 21 LYS HE3 H 1 2.616 0.001 . 2 . . . . 21 LYS HE3 . 15210 1 238 . 1 1 21 21 LYS HG2 H 1 1.265 0.004 . 2 . . . . 21 LYS HG2 . 15210 1 239 . 1 1 21 21 LYS HG3 H 1 1.608 0.002 . 2 . . . . 21 LYS HG3 . 15210 1 240 . 1 1 21 21 LYS C C 13 174.478 0.000 . 1 . . . . 21 LYS C . 15210 1 241 . 1 1 21 21 LYS CA C 13 55.661 0.000 . 1 . . . . 21 LYS CA . 15210 1 242 . 1 1 21 21 LYS CB C 13 35.039 0.000 . 1 . . . . 21 LYS CB . 15210 1 243 . 1 1 21 21 LYS CD C 13 30.398 0.000 . 1 . . . . 21 LYS CD . 15210 1 244 . 1 1 21 21 LYS CE C 13 42.552 0.000 . 1 . . . . 21 LYS CE . 15210 1 245 . 1 1 21 21 LYS CG C 13 27.412 0.000 . 1 . . . . 21 LYS CG . 15210 1 246 . 1 1 21 21 LYS N N 15 121.361 0.000 . 1 . . . . 21 LYS N . 15210 1 247 . 1 1 22 22 CYS H H 1 8.945 0.000 . 1 . . . . 22 CYS H . 15210 1 248 . 1 1 22 22 CYS HA H 1 5.542 0.006 . 1 . . . . 22 CYS HA . 15210 1 249 . 1 1 22 22 CYS HB2 H 1 3.127 0.007 . 2 . . . . 22 CYS HB2 . 15210 1 250 . 1 1 22 22 CYS HB3 H 1 2.307 0.005 . 2 . . . . 22 CYS HB3 . 15210 1 251 . 1 1 22 22 CYS C C 13 171.498 0.000 . 1 . . . . 22 CYS C . 15210 1 252 . 1 1 22 22 CYS CA C 13 55.786 0.000 . 1 . . . . 22 CYS CA . 15210 1 253 . 1 1 22 22 CYS CB C 13 31.232 0.000 . 1 . . . . 22 CYS CB . 15210 1 254 . 1 1 22 22 CYS N N 15 110.209 0.000 . 1 . . . . 22 CYS N . 15210 1 255 . 1 1 23 23 VAL H H 1 9.355 0.004 . 1 . . . . 23 VAL H . 15210 1 256 . 1 1 23 23 VAL HA H 1 4.753 0.005 . 1 . . . . 23 VAL HA . 15210 1 257 . 1 1 23 23 VAL HB H 1 1.794 0.003 . 1 . . . . 23 VAL HB . 15210 1 258 . 1 1 23 23 VAL HG11 H 1 0.922 0.001 . 2 . . . . 23 VAL QG1 . 15210 1 259 . 1 1 23 23 VAL HG12 H 1 0.922 0.001 . 2 . . . . 23 VAL QG1 . 15210 1 260 . 1 1 23 23 VAL HG13 H 1 0.922 0.001 . 2 . . . . 23 VAL QG1 . 15210 1 261 . 1 1 23 23 VAL HG21 H 1 0.783 0.002 . 2 . . . . 23 VAL QG2 . 15210 1 262 . 1 1 23 23 VAL HG22 H 1 0.783 0.002 . 2 . . . . 23 VAL QG2 . 15210 1 263 . 1 1 23 23 VAL HG23 H 1 0.783 0.002 . 2 . . . . 23 VAL QG2 . 15210 1 264 . 1 1 23 23 VAL C C 13 176.146 0.000 . 1 . . . . 23 VAL C . 15210 1 265 . 1 1 23 23 VAL CA C 13 60.752 0.000 . 1 . . . . 23 VAL CA . 15210 1 266 . 1 1 23 23 VAL CB C 13 35.376 0.000 . 1 . . . . 23 VAL CB . 15210 1 267 . 1 1 23 23 VAL CG1 C 13 21.217 0.000 . 1 . . . . 23 VAL CG1 . 15210 1 268 . 1 1 23 23 VAL CG2 C 13 20.947 0.000 . 1 . . . . 23 VAL CG2 . 15210 1 269 . 1 1 23 23 VAL N N 15 119.172 0.000 . 1 . . . . 23 VAL N . 15210 1 270 . 1 1 24 24 ILE H H 1 8.278 0.000 . 1 . . . . 24 ILE H . 15210 1 271 . 1 1 24 24 ILE HA H 1 4.252 0.003 . 1 . . . . 24 ILE HA . 15210 1 272 . 1 1 24 24 ILE HB H 1 2.274 0.002 . 1 . . . . 24 ILE HB . 15210 1 273 . 1 1 24 24 ILE HD11 H 1 0.919 0.001 . 1 . . . . 24 ILE QD1 . 15210 1 274 . 1 1 24 24 ILE HD12 H 1 0.919 0.001 . 1 . . . . 24 ILE QD1 . 15210 1 275 . 1 1 24 24 ILE HD13 H 1 0.919 0.001 . 1 . . . . 24 ILE QD1 . 15210 1 276 . 1 1 24 24 ILE HG12 H 1 0.999 0.000 . 2 . . . . 24 ILE HG12 . 15210 1 277 . 1 1 24 24 ILE HG13 H 1 1.909 0.008 . 2 . . . . 24 ILE HG13 . 15210 1 278 . 1 1 24 24 ILE HG21 H 1 0.762 0.000 . 1 . . . . 24 ILE QG2 . 15210 1 279 . 1 1 24 24 ILE HG22 H 1 0.762 0.000 . 1 . . . . 24 ILE QG2 . 15210 1 280 . 1 1 24 24 ILE HG23 H 1 0.762 0.000 . 1 . . . . 24 ILE QG2 . 15210 1 281 . 1 1 24 24 ILE C C 13 176.033 0.000 . 1 . . . . 24 ILE C . 15210 1 282 . 1 1 24 24 ILE CA C 13 62.930 0.000 . 1 . . . . 24 ILE CA . 15210 1 283 . 1 1 24 24 ILE CB C 13 37.040 0.000 . 1 . . . . 24 ILE CB . 15210 1 284 . 1 1 24 24 ILE CD1 C 13 14.606 0.000 . 1 . . . . 24 ILE CD1 . 15210 1 285 . 1 1 24 24 ILE CG1 C 13 28.120 0.000 . 1 . . . . 24 ILE CG1 . 15210 1 286 . 1 1 24 24 ILE CG2 C 13 17.889 0.000 . 1 . . . . 24 ILE CG2 . 15210 1 287 . 1 1 24 24 ILE N N 15 124.598 0.000 . 1 . . . . 24 ILE N . 15210 1 288 . 1 1 25 25 VAL H H 1 9.250 0.003 . 1 . . . . 25 VAL H . 15210 1 289 . 1 1 25 25 VAL HA H 1 4.691 0.005 . 1 . . . . 25 VAL HA . 15210 1 290 . 1 1 25 25 VAL HB H 1 2.257 0.003 . 1 . . . . 25 VAL HB . 15210 1 291 . 1 1 25 25 VAL HG11 H 1 0.828 0.000 . 2 . . . . 25 VAL QG1 . 15210 1 292 . 1 1 25 25 VAL HG12 H 1 0.828 0.000 . 2 . . . . 25 VAL QG1 . 15210 1 293 . 1 1 25 25 VAL HG13 H 1 0.828 0.000 . 2 . . . . 25 VAL QG1 . 15210 1 294 . 1 1 25 25 VAL HG21 H 1 0.652 0.001 . 2 . . . . 25 VAL QG2 . 15210 1 295 . 1 1 25 25 VAL HG22 H 1 0.652 0.001 . 2 . . . . 25 VAL QG2 . 15210 1 296 . 1 1 25 25 VAL HG23 H 1 0.652 0.001 . 2 . . . . 25 VAL QG2 . 15210 1 297 . 1 1 25 25 VAL C C 13 179.272 0.000 . 1 . . . . 25 VAL C . 15210 1 298 . 1 1 25 25 VAL CA C 13 61.183 0.000 . 1 . . . . 25 VAL CA . 15210 1 299 . 1 1 25 25 VAL CB C 13 33.235 0.000 . 1 . . . . 25 VAL CB . 15210 1 300 . 1 1 25 25 VAL CG1 C 13 22.953 0.000 . 1 . . . . 25 VAL CG1 . 15210 1 301 . 1 1 25 25 VAL CG2 C 13 19.184 0.000 . 1 . . . . 25 VAL CG2 . 15210 1 302 . 1 1 25 25 VAL N N 15 122.048 0.000 . 1 . . . . 25 VAL N . 15210 1 303 . 1 1 26 26 ASP H H 1 8.133 0.004 . 1 . . . . 26 ASP H . 15210 1 304 . 1 1 26 26 ASP HA H 1 4.766 0.001 . 1 . . . . 26 ASP HA . 15210 1 305 . 1 1 26 26 ASP HB2 H 1 2.410 0.003 . 2 . . . . 26 ASP HB2 . 15210 1 306 . 1 1 26 26 ASP HB3 H 1 2.571 0.007 . 2 . . . . 26 ASP HB3 . 15210 1 307 . 1 1 26 26 ASP C C 13 174.284 0.000 . 1 . . . . 26 ASP C . 15210 1 308 . 1 1 26 26 ASP CA C 13 53.672 0.000 . 1 . . . . 26 ASP CA . 15210 1 309 . 1 1 26 26 ASP CB C 13 43.821 0.000 . 1 . . . . 26 ASP CB . 15210 1 310 . 1 1 26 26 ASP N N 15 118.692 0.000 . 1 . . . . 26 ASP N . 15210 1 311 . 1 1 27 27 ILE H H 1 9.117 0.000 . 1 . . . . 27 ILE H . 15210 1 312 . 1 1 27 27 ILE HA H 1 4.282 0.006 . 1 . . . . 27 ILE HA . 15210 1 313 . 1 1 27 27 ILE HB H 1 1.964 0.000 . 1 . . . . 27 ILE HB . 15210 1 314 . 1 1 27 27 ILE HD11 H 1 0.745 0.000 . 1 . . . . 27 ILE QD1 . 15210 1 315 . 1 1 27 27 ILE HD12 H 1 0.745 0.000 . 1 . . . . 27 ILE QD1 . 15210 1 316 . 1 1 27 27 ILE HD13 H 1 0.745 0.000 . 1 . . . . 27 ILE QD1 . 15210 1 317 . 1 1 27 27 ILE HG12 H 1 1.461 0.003 . 2 . . . . 27 ILE HG12 . 15210 1 318 . 1 1 27 27 ILE HG13 H 1 1.244 0.000 . 2 . . . . 27 ILE HG13 . 15210 1 319 . 1 1 27 27 ILE HG21 H 1 0.884 0.005 . 1 . . . . 27 ILE QG2 . 15210 1 320 . 1 1 27 27 ILE HG22 H 1 0.884 0.005 . 1 . . . . 27 ILE QG2 . 15210 1 321 . 1 1 27 27 ILE HG23 H 1 0.884 0.005 . 1 . . . . 27 ILE QG2 . 15210 1 322 . 1 1 27 27 ILE C C 13 175.158 0.000 . 1 . . . . 27 ILE C . 15210 1 323 . 1 1 27 27 ILE CA C 13 60.480 0.000 . 1 . . . . 27 ILE CA . 15210 1 324 . 1 1 27 27 ILE CB C 13 38.474 0.000 . 1 . . . . 27 ILE CB . 15210 1 325 . 1 1 27 27 ILE CD1 C 13 12.091 0.000 . 1 . . . . 27 ILE CD1 . 15210 1 326 . 1 1 27 27 ILE CG1 C 13 27.063 0.000 . 1 . . . . 27 ILE CG1 . 15210 1 327 . 1 1 27 27 ILE CG2 C 13 17.510 0.000 . 1 . . . . 27 ILE CG2 . 15210 1 328 . 1 1 27 27 ILE N N 15 124.464 0.000 . 1 . . . . 27 ILE N . 15210 1 329 . 1 1 28 28 ILE H H 1 8.079 0.003 . 1 . . . . 28 ILE H . 15210 1 330 . 1 1 28 28 ILE HA H 1 3.991 0.000 . 1 . . . . 28 ILE HA . 15210 1 331 . 1 1 28 28 ILE HB H 1 1.735 0.005 . 1 . . . . 28 ILE HB . 15210 1 332 . 1 1 28 28 ILE HD11 H 1 0.691 0.007 . 1 . . . . 28 ILE QD1 . 15210 1 333 . 1 1 28 28 ILE HD12 H 1 0.691 0.007 . 1 . . . . 28 ILE QD1 . 15210 1 334 . 1 1 28 28 ILE HD13 H 1 0.691 0.007 . 1 . . . . 28 ILE QD1 . 15210 1 335 . 1 1 28 28 ILE HG12 H 1 1.226 0.000 . 2 . . . . 28 ILE HG12 . 15210 1 336 . 1 1 28 28 ILE HG13 H 1 1.146 0.000 . 2 . . . . 28 ILE HG13 . 15210 1 337 . 1 1 28 28 ILE HG21 H 1 0.847 0.003 . 1 . . . . 28 ILE QG2 . 15210 1 338 . 1 1 28 28 ILE HG22 H 1 0.847 0.003 . 1 . . . . 28 ILE QG2 . 15210 1 339 . 1 1 28 28 ILE HG23 H 1 0.847 0.003 . 1 . . . . 28 ILE QG2 . 15210 1 340 . 1 1 28 28 ILE C C 13 175.677 0.000 . 1 . . . . 28 ILE C . 15210 1 341 . 1 1 28 28 ILE CA C 13 63.106 0.000 . 1 . . . . 28 ILE CA . 15210 1 342 . 1 1 28 28 ILE CB C 13 37.715 0.000 . 1 . . . . 28 ILE CB . 15210 1 343 . 1 1 28 28 ILE CD1 C 13 12.355 0.000 . 1 . . . . 28 ILE CD1 . 15210 1 344 . 1 1 28 28 ILE CG1 C 13 27.788 0.000 . 1 . . . . 28 ILE CG1 . 15210 1 345 . 1 1 28 28 ILE CG2 C 13 16.930 0.000 . 1 . . . . 28 ILE CG2 . 15210 1 346 . 1 1 28 28 ILE N N 15 127.741 0.000 . 1 . . . . 28 ILE N . 15210 1 347 . 1 1 29 29 ASP H H 1 8.474 0.000 . 1 . . . . 29 ASP H . 15210 1 348 . 1 1 29 29 ASP HA H 1 4.533 0.001 . 1 . . . . 29 ASP HA . 15210 1 349 . 1 1 29 29 ASP HB2 H 1 3.219 0.000 . 2 . . . . 29 ASP HB2 . 15210 1 350 . 1 1 29 29 ASP HB3 H 1 3.133 0.000 . 2 . . . . 29 ASP HB3 . 15210 1 351 . 1 1 29 29 ASP C C 13 174.705 0.000 . 1 . . . . 29 ASP C . 15210 1 352 . 1 1 29 29 ASP CA C 13 53.593 0.000 . 1 . . . . 29 ASP CA . 15210 1 353 . 1 1 29 29 ASP CB C 13 39.675 0.000 . 1 . . . . 29 ASP CB . 15210 1 354 . 1 1 29 29 ASP N N 15 119.361 0.000 . 1 . . . . 29 ASP N . 15210 1 355 . 1 1 30 30 ASP H H 1 8.157 0.000 . 1 . . . . 30 ASP H . 15210 1 356 . 1 1 30 30 ASP HA H 1 4.369 0.000 . 1 . . . . 30 ASP HA . 15210 1 357 . 1 1 30 30 ASP HB2 H 1 2.701 0.000 . 2 . . . . 30 ASP HB2 . 15210 1 358 . 1 1 30 30 ASP HB3 H 1 2.512 0.000 . 2 . . . . 30 ASP HB3 . 15210 1 359 . 1 1 30 30 ASP C C 13 176.308 0.000 . 1 . . . . 30 ASP C . 15210 1 360 . 1 1 30 30 ASP CA C 13 56.432 0.000 . 1 . . . . 30 ASP CA . 15210 1 361 . 1 1 30 30 ASP CB C 13 40.732 0.000 . 1 . . . . 30 ASP CB . 15210 1 362 . 1 1 30 30 ASP N N 15 112.593 0.000 . 1 . . . . 30 ASP N . 15210 1 363 . 1 1 31 31 ASN H H 1 8.905 0.000 . 1 . . . . 31 ASN H . 15210 1 364 . 1 1 31 31 ASN HA H 1 4.793 0.003 . 1 . . . . 31 ASN HA . 15210 1 365 . 1 1 31 31 ASN HB2 H 1 2.621 0.000 . 2 . . . . 31 ASN HB2 . 15210 1 366 . 1 1 31 31 ASN HB3 H 1 2.190 0.005 . 2 . . . . 31 ASN HB3 . 15210 1 367 . 1 1 31 31 ASN HD21 H 1 7.801 0.000 . 2 . . . . 31 ASN HD21 . 15210 1 368 . 1 1 31 31 ASN HD22 H 1 6.926 0.000 . 2 . . . . 31 ASN HD22 . 15210 1 369 . 1 1 31 31 ASN C C 13 173.733 0.000 . 1 . . . . 31 ASN C . 15210 1 370 . 1 1 31 31 ASN CA C 13 54.224 0.000 . 1 . . . . 31 ASN CA . 15210 1 371 . 1 1 31 31 ASN CB C 13 42.686 0.000 . 1 . . . . 31 ASN CB . 15210 1 372 . 1 1 31 31 ASN N N 15 114.825 0.000 . 1 . . . . 31 ASN N . 15210 1 373 . 1 1 31 31 ASN ND2 N 15 114.164 0.000 . 1 . . . . 31 ASN ND2 . 15210 1 374 . 1 1 32 32 PHE H H 1 8.494 0.000 . 1 . . . . 32 PHE H . 15210 1 375 . 1 1 32 32 PHE HA H 1 5.282 0.006 . 1 . . . . 32 PHE HA . 15210 1 376 . 1 1 32 32 PHE HB2 H 1 2.825 0.002 . 2 . . . . 32 PHE HB2 . 15210 1 377 . 1 1 32 32 PHE HB3 H 1 2.613 0.006 . 2 . . . . 32 PHE HB3 . 15210 1 378 . 1 1 32 32 PHE HD1 H 1 7.334 0.004 . 1 . . . . 32 PHE HD1 . 15210 1 379 . 1 1 32 32 PHE HD2 H 1 7.334 0.004 . 1 . . . . 32 PHE HD2 . 15210 1 380 . 1 1 32 32 PHE HE1 H 1 7.358 0.000 . 1 . . . . 32 PHE HE1 . 15210 1 381 . 1 1 32 32 PHE HE2 H 1 7.358 0.000 . 1 . . . . 32 PHE HE2 . 15210 1 382 . 1 1 32 32 PHE HZ H 1 7.353 0.000 . 1 . . . . 32 PHE HZ . 15210 1 383 . 1 1 32 32 PHE C C 13 174.867 0.000 . 1 . . . . 32 PHE C . 15210 1 384 . 1 1 32 32 PHE CA C 13 57.837 0.000 . 1 . . . . 32 PHE CA . 15210 1 385 . 1 1 32 32 PHE CB C 13 42.699 0.000 . 1 . . . . 32 PHE CB . 15210 1 386 . 1 1 32 32 PHE CD1 C 13 132.242 0.000 . 1 . . . . 32 PHE CD1 . 15210 1 387 . 1 1 32 32 PHE CE1 C 13 131.114 0.000 . 1 . . . . 32 PHE CE1 . 15210 1 388 . 1 1 32 32 PHE CZ C 13 129.987 0.000 . 1 . . . . 32 PHE CZ . 15210 1 389 . 1 1 32 32 PHE N N 15 117.799 0.000 . 1 . . . . 32 PHE N . 15210 1 390 . 1 1 33 33 VAL H H 1 8.708 0.003 . 1 . . . . 33 VAL H . 15210 1 391 . 1 1 33 33 VAL HA H 1 4.726 0.000 . 1 . . . . 33 VAL HA . 15210 1 392 . 1 1 33 33 VAL HB H 1 2.499 0.004 . 1 . . . . 33 VAL HB . 15210 1 393 . 1 1 33 33 VAL HG11 H 1 0.956 0.000 . 2 . . . . 33 VAL QG1 . 15210 1 394 . 1 1 33 33 VAL HG12 H 1 0.956 0.000 . 2 . . . . 33 VAL QG1 . 15210 1 395 . 1 1 33 33 VAL HG13 H 1 0.956 0.000 . 2 . . . . 33 VAL QG1 . 15210 1 396 . 1 1 33 33 VAL HG21 H 1 0.707 0.003 . 2 . . . . 33 VAL QG2 . 15210 1 397 . 1 1 33 33 VAL HG22 H 1 0.707 0.003 . 2 . . . . 33 VAL QG2 . 15210 1 398 . 1 1 33 33 VAL HG23 H 1 0.707 0.003 . 2 . . . . 33 VAL QG2 . 15210 1 399 . 1 1 33 33 VAL C C 13 173.021 0.000 . 1 . . . . 33 VAL C . 15210 1 400 . 1 1 33 33 VAL CA C 13 58.504 0.000 . 1 . . . . 33 VAL CA . 15210 1 401 . 1 1 33 33 VAL CB C 13 34.547 0.000 . 1 . . . . 33 VAL CB . 15210 1 402 . 1 1 33 33 VAL CG1 C 13 23.344 0.000 . 1 . . . . 33 VAL CG1 . 15210 1 403 . 1 1 33 33 VAL CG2 C 13 19.159 0.000 . 1 . . . . 33 VAL CG2 . 15210 1 404 . 1 1 33 33 VAL N N 15 110.984 0.000 . 1 . . . . 33 VAL N . 15210 1 405 . 1 1 34 34 LEU H H 1 8.713 0.005 . 1 . . . . 34 LEU H . 15210 1 406 . 1 1 34 34 LEU HA H 1 4.875 0.004 . 1 . . . . 34 LEU HA . 15210 1 407 . 1 1 34 34 LEU HB2 H 1 1.754 0.004 . 2 . . . . 34 LEU HB2 . 15210 1 408 . 1 1 34 34 LEU HB3 H 1 1.145 0.005 . 2 . . . . 34 LEU HB3 . 15210 1 409 . 1 1 34 34 LEU HD11 H 1 0.818 0.003 . 2 . . . . 34 LEU QD1 . 15210 1 410 . 1 1 34 34 LEU HD12 H 1 0.818 0.003 . 2 . . . . 34 LEU QD1 . 15210 1 411 . 1 1 34 34 LEU HD13 H 1 0.818 0.003 . 2 . . . . 34 LEU QD1 . 15210 1 412 . 1 1 34 34 LEU HD21 H 1 0.815 0.003 . 2 . . . . 34 LEU QD2 . 15210 1 413 . 1 1 34 34 LEU HD22 H 1 0.815 0.003 . 2 . . . . 34 LEU QD2 . 15210 1 414 . 1 1 34 34 LEU HD23 H 1 0.815 0.003 . 2 . . . . 34 LEU QD2 . 15210 1 415 . 1 1 34 34 LEU HG H 1 1.252 0.004 . 1 . . . . 34 LEU HG . 15210 1 416 . 1 1 34 34 LEU C C 13 176.357 0.000 . 1 . . . . 34 LEU C . 15210 1 417 . 1 1 34 34 LEU CA C 13 54.000 0.000 . 1 . . . . 34 LEU CA . 15210 1 418 . 1 1 34 34 LEU CB C 13 44.800 0.000 . 1 . . . . 34 LEU CB . 15210 1 419 . 1 1 34 34 LEU CD1 C 13 25.556 0.000 . 1 . . . . 34 LEU CD1 . 15210 1 420 . 1 1 34 34 LEU CD2 C 13 23.085 0.000 . 1 . . . . 34 LEU CD2 . 15210 1 421 . 1 1 34 34 LEU CG C 13 27.201 0.000 . 1 . . . . 34 LEU CG . 15210 1 422 . 1 1 34 34 LEU N N 15 123.344 0.000 . 1 . . . . 34 LEU N . 15210 1 423 . 1 1 35 35 VAL H H 1 8.478 0.000 . 1 . . . . 35 VAL H . 15210 1 424 . 1 1 35 35 VAL HA H 1 5.682 0.002 . 1 . . . . 35 VAL HA . 15210 1 425 . 1 1 35 35 VAL HB H 1 1.831 0.007 . 1 . . . . 35 VAL HB . 15210 1 426 . 1 1 35 35 VAL HG11 H 1 0.860 0.004 . 2 . . . . 35 VAL QG1 . 15210 1 427 . 1 1 35 35 VAL HG12 H 1 0.860 0.004 . 2 . . . . 35 VAL QG1 . 15210 1 428 . 1 1 35 35 VAL HG13 H 1 0.860 0.004 . 2 . . . . 35 VAL QG1 . 15210 1 429 . 1 1 35 35 VAL HG21 H 1 0.888 0.003 . 2 . . . . 35 VAL QG2 . 15210 1 430 . 1 1 35 35 VAL HG22 H 1 0.888 0.003 . 2 . . . . 35 VAL QG2 . 15210 1 431 . 1 1 35 35 VAL HG23 H 1 0.888 0.003 . 2 . . . . 35 VAL QG2 . 15210 1 432 . 1 1 35 35 VAL C C 13 173.830 0.000 . 1 . . . . 35 VAL C . 15210 1 433 . 1 1 35 35 VAL CA C 13 57.695 0.000 . 1 . . . . 35 VAL CA . 15210 1 434 . 1 1 35 35 VAL CB C 13 35.738 0.000 . 1 . . . . 35 VAL CB . 15210 1 435 . 1 1 35 35 VAL CG1 C 13 18.497 0.000 . 1 . . . . 35 VAL CG1 . 15210 1 436 . 1 1 35 35 VAL CG2 C 13 22.642 0.000 . 1 . . . . 35 VAL CG2 . 15210 1 437 . 1 1 35 35 VAL N N 15 119.446 0.000 . 1 . . . . 35 VAL N . 15210 1 438 . 1 1 36 36 THR H H 1 8.385 0.001 . 1 . . . . 36 THR H . 15210 1 439 . 1 1 36 36 THR HA H 1 4.549 0.000 . 1 . . . . 36 THR HA . 15210 1 440 . 1 1 36 36 THR HB H 1 3.921 0.000 . 1 . . . . 36 THR HB . 15210 1 441 . 1 1 36 36 THR HG21 H 1 0.962 0.006 . 1 . . . . 36 THR QG2 . 15210 1 442 . 1 1 36 36 THR HG22 H 1 0.962 0.006 . 1 . . . . 36 THR QG2 . 15210 1 443 . 1 1 36 36 THR HG23 H 1 0.962 0.006 . 1 . . . . 36 THR QG2 . 15210 1 444 . 1 1 36 36 THR C C 13 172.826 0.000 . 1 . . . . 36 THR C . 15210 1 445 . 1 1 36 36 THR CA C 13 59.785 0.000 . 1 . . . . 36 THR CA . 15210 1 446 . 1 1 36 36 THR CB C 13 70.620 0.000 . 1 . . . . 36 THR CB . 15210 1 447 . 1 1 36 36 THR CG2 C 13 20.830 0.000 . 1 . . . . 36 THR CG2 . 15210 1 448 . 1 1 36 36 THR N N 15 109.285 0.000 . 1 . . . . 36 THR N . 15210 1 449 . 1 1 37 37 GLY H H 1 7.595 0.000 . 1 . . . . 37 GLY H . 15210 1 450 . 1 1 37 37 GLY HA2 H 1 3.785 0.002 . 2 . . . . 37 GLY HA2 . 15210 1 451 . 1 1 37 37 GLY HA3 H 1 3.949 0.008 . 2 . . . . 37 GLY HA3 . 15210 1 452 . 1 1 37 37 GLY CA C 13 51.603 0.000 . 1 . . . . 37 GLY CA . 15210 1 453 . 1 1 37 37 GLY N N 15 115.742 0.000 . 1 . . . . 37 GLY N . 15210 1 454 . 1 1 38 38 PRO HA H 1 5.259 0.001 . 1 . . . . 38 PRO HA . 15210 1 455 . 1 1 38 38 PRO HB2 H 1 2.097 0.000 . 2 . . . . 38 PRO HB2 . 15210 1 456 . 1 1 38 38 PRO HB3 H 1 2.394 0.000 . 2 . . . . 38 PRO HB3 . 15210 1 457 . 1 1 38 38 PRO HD2 H 1 3.168 0.000 . 2 . . . . 38 PRO HD2 . 15210 1 458 . 1 1 38 38 PRO HD3 H 1 3.409 0.000 . 2 . . . . 38 PRO HD3 . 15210 1 459 . 1 1 38 38 PRO HG2 H 1 1.588 0.000 . 2 . . . . 38 PRO HG2 . 15210 1 460 . 1 1 38 38 PRO HG3 H 1 1.798 0.000 . 2 . . . . 38 PRO HG3 . 15210 1 461 . 1 1 38 38 PRO C C 13 179.386 0.000 . 1 . . . . 38 PRO C . 15210 1 462 . 1 1 38 38 PRO CA C 13 60.704 0.000 . 1 . . . . 38 PRO CA . 15210 1 463 . 1 1 38 38 PRO CB C 13 35.734 0.000 . 1 . . . . 38 PRO CB . 15210 1 464 . 1 1 38 38 PRO CD C 13 50.205 0.000 . 1 . . . . 38 PRO CD . 15210 1 465 . 1 1 38 38 PRO CG C 13 26.231 0.000 . 1 . . . . 38 PRO CG . 15210 1 466 . 1 1 39 39 LYS H H 1 9.534 0.000 . 1 . . . . 39 LYS H . 15210 1 467 . 1 1 39 39 LYS HA H 1 3.556 0.000 . 1 . . . . 39 LYS HA . 15210 1 468 . 1 1 39 39 LYS HB2 H 1 1.805 0.000 . 2 . . . . 39 LYS HB2 . 15210 1 469 . 1 1 39 39 LYS HB3 H 1 1.903 0.000 . 2 . . . . 39 LYS HB3 . 15210 1 470 . 1 1 39 39 LYS HD2 H 1 1.689 0.000 . 2 . . . . 39 LYS HD2 . 15210 1 471 . 1 1 39 39 LYS HD3 H 1 1.690 0.000 . 2 . . . . 39 LYS HD3 . 15210 1 472 . 1 1 39 39 LYS HE2 H 1 2.999 0.000 . 2 . . . . 39 LYS HE2 . 15210 1 473 . 1 1 39 39 LYS HE3 H 1 2.999 0.000 . 2 . . . . 39 LYS HE3 . 15210 1 474 . 1 1 39 39 LYS HG2 H 1 1.272 0.000 . 2 . . . . 39 LYS HG2 . 15210 1 475 . 1 1 39 39 LYS HG3 H 1 1.409 0.000 . 2 . . . . 39 LYS HG3 . 15210 1 476 . 1 1 39 39 LYS C C 13 178.074 0.000 . 1 . . . . 39 LYS C . 15210 1 477 . 1 1 39 39 LYS CA C 13 60.665 0.000 . 1 . . . . 39 LYS CA . 15210 1 478 . 1 1 39 39 LYS CB C 13 32.139 0.000 . 1 . . . . 39 LYS CB . 15210 1 479 . 1 1 39 39 LYS CD C 13 29.433 0.000 . 1 . . . . 39 LYS CD . 15210 1 480 . 1 1 39 39 LYS CE C 13 42.069 0.000 . 1 . . . . 39 LYS CE . 15210 1 481 . 1 1 39 39 LYS CG C 13 23.973 0.000 . 1 . . . . 39 LYS CG . 15210 1 482 . 1 1 39 39 LYS N N 15 128.351 0.000 . 1 . . . . 39 LYS N . 15210 1 483 . 1 1 40 40 ASP H H 1 9.083 0.000 . 1 . . . . 40 ASP H . 15210 1 484 . 1 1 40 40 ASP HA H 1 4.377 0.000 . 1 . . . . 40 ASP HA . 15210 1 485 . 1 1 40 40 ASP HB2 H 1 2.580 0.000 . 2 . . . . 40 ASP HB2 . 15210 1 486 . 1 1 40 40 ASP HB3 H 1 2.756 0.000 . 2 . . . . 40 ASP HB3 . 15210 1 487 . 1 1 40 40 ASP C C 13 175.239 0.000 . 1 . . . . 40 ASP C . 15210 1 488 . 1 1 40 40 ASP CA C 13 55.269 0.000 . 1 . . . . 40 ASP CA . 15210 1 489 . 1 1 40 40 ASP CB C 13 39.376 0.000 . 1 . . . . 40 ASP CB . 15210 1 490 . 1 1 40 40 ASP N N 15 115.818 0.000 . 1 . . . . 40 ASP N . 15210 1 491 . 1 1 41 41 ILE H H 1 7.772 0.000 . 1 . . . . 41 ILE H . 15210 1 492 . 1 1 41 41 ILE HA H 1 4.226 0.000 . 1 . . . . 41 ILE HA . 15210 1 493 . 1 1 41 41 ILE HB H 1 1.861 0.000 . 1 . . . . 41 ILE HB . 15210 1 494 . 1 1 41 41 ILE HD11 H 1 0.765 0.007 . 1 . . . . 41 ILE QD1 . 15210 1 495 . 1 1 41 41 ILE HD12 H 1 0.765 0.007 . 1 . . . . 41 ILE QD1 . 15210 1 496 . 1 1 41 41 ILE HD13 H 1 0.765 0.007 . 1 . . . . 41 ILE QD1 . 15210 1 497 . 1 1 41 41 ILE HG12 H 1 1.322 0.005 . 2 . . . . 41 ILE HG12 . 15210 1 498 . 1 1 41 41 ILE HG13 H 1 1.270 0.000 . 2 . . . . 41 ILE HG13 . 15210 1 499 . 1 1 41 41 ILE HG21 H 1 0.814 0.001 . 1 . . . . 41 ILE QG2 . 15210 1 500 . 1 1 41 41 ILE HG22 H 1 0.814 0.001 . 1 . . . . 41 ILE QG2 . 15210 1 501 . 1 1 41 41 ILE HG23 H 1 0.814 0.001 . 1 . . . . 41 ILE QG2 . 15210 1 502 . 1 1 41 41 ILE C C 13 176.227 0.000 . 1 . . . . 41 ILE C . 15210 1 503 . 1 1 41 41 ILE CA C 13 61.833 0.000 . 1 . . . . 41 ILE CA . 15210 1 504 . 1 1 41 41 ILE CB C 13 37.678 0.000 . 1 . . . . 41 ILE CB . 15210 1 505 . 1 1 41 41 ILE CD1 C 13 10.821 0.000 . 1 . . . . 41 ILE CD1 . 15210 1 506 . 1 1 41 41 ILE CG1 C 13 27.201 0.000 . 1 . . . . 41 ILE CG1 . 15210 1 507 . 1 1 41 41 ILE CG2 C 13 18.074 0.000 . 1 . . . . 41 ILE CG2 . 15210 1 508 . 1 1 41 41 ILE N N 15 116.782 0.000 . 1 . . . . 41 ILE N . 15210 1 509 . 1 1 42 42 THR H H 1 7.826 0.000 . 1 . . . . 42 THR H . 15210 1 510 . 1 1 42 42 THR HA H 1 4.737 0.001 . 1 . . . . 42 THR HA . 15210 1 511 . 1 1 42 42 THR HB H 1 4.263 0.003 . 1 . . . . 42 THR HB . 15210 1 512 . 1 1 42 42 THR HG21 H 1 1.034 0.000 . 1 . . . . 42 THR QG2 . 15210 1 513 . 1 1 42 42 THR HG22 H 1 1.034 0.000 . 1 . . . . 42 THR QG2 . 15210 1 514 . 1 1 42 42 THR HG23 H 1 1.034 0.000 . 1 . . . . 42 THR QG2 . 15210 1 515 . 1 1 42 42 THR C C 13 175.531 0.000 . 1 . . . . 42 THR C . 15210 1 516 . 1 1 42 42 THR CA C 13 60.338 0.000 . 1 . . . . 42 THR CA . 15210 1 517 . 1 1 42 42 THR CB C 13 71.918 0.000 . 1 . . . . 42 THR CB . 15210 1 518 . 1 1 42 42 THR CG2 C 13 23.455 0.000 . 1 . . . . 42 THR CG2 . 15210 1 519 . 1 1 42 42 THR N N 15 104.372 0.000 . 1 . . . . 42 THR N . 15210 1 520 . 1 1 43 43 GLY H H 1 7.881 0.000 . 1 . . . . 43 GLY H . 15210 1 521 . 1 1 43 43 GLY HA2 H 1 4.477 0.000 . 2 . . . . 43 GLY HA2 . 15210 1 522 . 1 1 43 43 GLY HA3 H 1 3.832 0.000 . 2 . . . . 43 GLY HA3 . 15210 1 523 . 1 1 43 43 GLY C C 13 173.490 0.000 . 1 . . . . 43 GLY C . 15210 1 524 . 1 1 43 43 GLY CA C 13 45.046 0.000 . 1 . . . . 43 GLY CA . 15210 1 525 . 1 1 43 43 GLY N N 15 109.226 0.000 . 1 . . . . 43 GLY N . 15210 1 526 . 1 1 44 44 VAL H H 1 7.324 0.002 . 1 . . . . 44 VAL H . 15210 1 527 . 1 1 44 44 VAL HA H 1 3.982 0.000 . 1 . . . . 44 VAL HA . 15210 1 528 . 1 1 44 44 VAL HB H 1 1.488 0.002 . 1 . . . . 44 VAL HB . 15210 1 529 . 1 1 44 44 VAL HG11 H 1 0.921 0.006 . 2 . . . . 44 VAL QG1 . 15210 1 530 . 1 1 44 44 VAL HG12 H 1 0.921 0.006 . 2 . . . . 44 VAL QG1 . 15210 1 531 . 1 1 44 44 VAL HG13 H 1 0.921 0.006 . 2 . . . . 44 VAL QG1 . 15210 1 532 . 1 1 44 44 VAL HG21 H 1 0.807 0.000 . 2 . . . . 44 VAL QG2 . 15210 1 533 . 1 1 44 44 VAL HG22 H 1 0.807 0.000 . 2 . . . . 44 VAL QG2 . 15210 1 534 . 1 1 44 44 VAL HG23 H 1 0.807 0.000 . 2 . . . . 44 VAL QG2 . 15210 1 535 . 1 1 44 44 VAL C C 13 175.499 0.000 . 1 . . . . 44 VAL C . 15210 1 536 . 1 1 44 44 VAL CA C 13 63.106 0.000 . 1 . . . . 44 VAL CA . 15210 1 537 . 1 1 44 44 VAL CB C 13 31.919 0.000 . 1 . . . . 44 VAL CB . 15210 1 538 . 1 1 44 44 VAL CG1 C 13 20.740 0.000 . 1 . . . . 44 VAL CG1 . 15210 1 539 . 1 1 44 44 VAL CG2 C 13 22.288 0.000 . 1 . . . . 44 VAL CG2 . 15210 1 540 . 1 1 44 44 VAL N N 15 121.191 0.000 . 1 . . . . 44 VAL N . 15210 1 541 . 1 1 45 45 LYS H H 1 8.374 0.000 . 1 . . . . 45 LYS H . 15210 1 542 . 1 1 45 45 LYS HA H 1 4.201 0.000 . 1 . . . . 45 LYS HA . 15210 1 543 . 1 1 45 45 LYS HB2 H 1 1.688 0.000 . 2 . . . . 45 LYS HB2 . 15210 1 544 . 1 1 45 45 LYS HB3 H 1 1.893 0.000 . 2 . . . . 45 LYS HB3 . 15210 1 545 . 1 1 45 45 LYS HD2 H 1 1.700 0.000 . 2 . . . . 45 LYS HD2 . 15210 1 546 . 1 1 45 45 LYS HD3 H 1 1.648 0.000 . 2 . . . . 45 LYS HD3 . 15210 1 547 . 1 1 45 45 LYS HE2 H 1 3.008 0.000 . 2 . . . . 45 LYS HE2 . 15210 1 548 . 1 1 45 45 LYS HE3 H 1 3.009 0.000 . 2 . . . . 45 LYS HE3 . 15210 1 549 . 1 1 45 45 LYS HG2 H 1 1.611 0.000 . 2 . . . . 45 LYS HG2 . 15210 1 550 . 1 1 45 45 LYS HG3 H 1 1.426 0.000 . 2 . . . . 45 LYS HG3 . 15210 1 551 . 1 1 45 45 LYS C C 13 174.138 0.000 . 1 . . . . 45 LYS C . 15210 1 552 . 1 1 45 45 LYS CA C 13 56.637 0.000 . 1 . . . . 45 LYS CA . 15210 1 553 . 1 1 45 45 LYS CB C 13 33.710 0.000 . 1 . . . . 45 LYS CB . 15210 1 554 . 1 1 45 45 LYS CD C 13 28.780 0.000 . 1 . . . . 45 LYS CD . 15210 1 555 . 1 1 45 45 LYS CE C 13 42.270 0.000 . 1 . . . . 45 LYS CE . 15210 1 556 . 1 1 45 45 LYS CG C 13 26.054 0.000 . 1 . . . . 45 LYS CG . 15210 1 557 . 1 1 45 45 LYS N N 15 128.615 0.000 . 1 . . . . 45 LYS N . 15210 1 558 . 1 1 46 46 ARG H H 1 8.141 0.000 . 1 . . . . 46 ARG H . 15210 1 559 . 1 1 46 46 ARG HA H 1 5.740 0.000 . 1 . . . . 46 ARG HA . 15210 1 560 . 1 1 46 46 ARG HB2 H 1 1.934 0.000 . 2 . . . . 46 ARG HB2 . 15210 1 561 . 1 1 46 46 ARG HB3 H 1 1.932 0.000 . 2 . . . . 46 ARG HB3 . 15210 1 562 . 1 1 46 46 ARG HD2 H 1 3.231 0.000 . 2 . . . . 46 ARG HD2 . 15210 1 563 . 1 1 46 46 ARG HD3 H 1 3.384 0.000 . 2 . . . . 46 ARG HD3 . 15210 1 564 . 1 1 46 46 ARG HG2 H 1 1.460 0.000 . 2 . . . . 46 ARG HG2 . 15210 1 565 . 1 1 46 46 ARG HG3 H 1 1.465 0.000 . 2 . . . . 46 ARG HG3 . 15210 1 566 . 1 1 46 46 ARG C C 13 176.470 0.000 . 1 . . . . 46 ARG C . 15210 1 567 . 1 1 46 46 ARG CA C 13 55.143 0.000 . 1 . . . . 46 ARG CA . 15210 1 568 . 1 1 46 46 ARG CB C 13 29.911 0.000 . 1 . . . . 46 ARG CB . 15210 1 569 . 1 1 46 46 ARG CD C 13 43.406 0.000 . 1 . . . . 46 ARG CD . 15210 1 570 . 1 1 46 46 ARG CG C 13 27.310 0.000 . 1 . . . . 46 ARG CG . 15210 1 571 . 1 1 46 46 ARG N N 15 120.407 0.000 . 1 . . . . 46 ARG N . 15210 1 572 . 1 1 47 47 ARG H H 1 8.479 0.000 . 1 . . . . 47 ARG H . 15210 1 573 . 1 1 47 47 ARG HA H 1 4.755 0.000 . 1 . . . . 47 ARG HA . 15210 1 574 . 1 1 47 47 ARG HB2 H 1 1.813 0.000 . 2 . . . . 47 ARG HB2 . 15210 1 575 . 1 1 47 47 ARG HB3 H 1 1.906 0.003 . 2 . . . . 47 ARG HB3 . 15210 1 576 . 1 1 47 47 ARG HD2 H 1 3.225 0.000 . 2 . . . . 47 ARG HD2 . 15210 1 577 . 1 1 47 47 ARG HD3 H 1 3.145 0.000 . 2 . . . . 47 ARG HD3 . 15210 1 578 . 1 1 47 47 ARG HG2 H 1 1.396 0.000 . 2 . . . . 47 ARG HG2 . 15210 1 579 . 1 1 47 47 ARG HG3 H 1 1.632 0.000 . 2 . . . . 47 ARG HG3 . 15210 1 580 . 1 1 47 47 ARG C C 13 174.689 0.000 . 1 . . . . 47 ARG C . 15210 1 581 . 1 1 47 47 ARG CA C 13 54.720 0.000 . 1 . . . . 47 ARG CA . 15210 1 582 . 1 1 47 47 ARG CB C 13 33.946 0.000 . 1 . . . . 47 ARG CB . 15210 1 583 . 1 1 47 47 ARG CD C 13 43.896 0.000 . 1 . . . . 47 ARG CD . 15210 1 584 . 1 1 47 47 ARG CG C 13 25.875 0.000 . 1 . . . . 47 ARG CG . 15210 1 585 . 1 1 47 47 ARG N N 15 126.997 0.000 . 1 . . . . 47 ARG N . 15210 1 586 . 1 1 48 48 ARG H H 1 8.590 0.000 . 1 . . . . 48 ARG H . 15210 1 587 . 1 1 48 48 ARG HA H 1 5.109 0.001 . 1 . . . . 48 ARG HA . 15210 1 588 . 1 1 48 48 ARG HB2 H 1 1.657 0.000 . 2 . . . . 48 ARG HB2 . 15210 1 589 . 1 1 48 48 ARG HB3 H 1 1.734 0.000 . 2 . . . . 48 ARG HB3 . 15210 1 590 . 1 1 48 48 ARG HD2 H 1 2.873 0.000 . 2 . . . . 48 ARG HD2 . 15210 1 591 . 1 1 48 48 ARG HD3 H 1 2.846 0.002 . 2 . . . . 48 ARG HD3 . 15210 1 592 . 1 1 48 48 ARG HG2 H 1 1.580 0.000 . 2 . . . . 48 ARG HG2 . 15210 1 593 . 1 1 48 48 ARG HG3 H 1 1.432 0.002 . 2 . . . . 48 ARG HG3 . 15210 1 594 . 1 1 48 48 ARG C C 13 176.470 0.000 . 1 . . . . 48 ARG C . 15210 1 595 . 1 1 48 48 ARG CA C 13 55.731 0.000 . 1 . . . . 48 ARG CA . 15210 1 596 . 1 1 48 48 ARG CB C 13 31.356 0.000 . 1 . . . . 48 ARG CB . 15210 1 597 . 1 1 48 48 ARG CD C 13 43.592 0.000 . 1 . . . . 48 ARG CD . 15210 1 598 . 1 1 48 48 ARG CG C 13 27.576 0.000 . 1 . . . . 48 ARG CG . 15210 1 599 . 1 1 48 48 ARG N N 15 122.139 0.000 . 1 . . . . 48 ARG N . 15210 1 600 . 1 1 49 49 VAL H H 1 9.511 0.001 . 1 . . . . 49 VAL H . 15210 1 601 . 1 1 49 49 VAL HA H 1 4.682 0.000 . 1 . . . . 49 VAL HA . 15210 1 602 . 1 1 49 49 VAL HB H 1 1.909 0.000 . 1 . . . . 49 VAL HB . 15210 1 603 . 1 1 49 49 VAL HG11 H 1 1.047 0.004 . 2 . . . . 49 VAL QG1 . 15210 1 604 . 1 1 49 49 VAL HG12 H 1 1.047 0.004 . 2 . . . . 49 VAL QG1 . 15210 1 605 . 1 1 49 49 VAL HG13 H 1 1.047 0.004 . 2 . . . . 49 VAL QG1 . 15210 1 606 . 1 1 49 49 VAL HG21 H 1 0.970 0.000 . 2 . . . . 49 VAL QG2 . 15210 1 607 . 1 1 49 49 VAL HG22 H 1 0.970 0.000 . 2 . . . . 49 VAL QG2 . 15210 1 608 . 1 1 49 49 VAL HG23 H 1 0.970 0.000 . 2 . . . . 49 VAL QG2 . 15210 1 609 . 1 1 49 49 VAL C C 13 173.604 0.000 . 1 . . . . 49 VAL C . 15210 1 610 . 1 1 49 49 VAL CA C 13 60.217 0.000 . 1 . . . . 49 VAL CA . 15210 1 611 . 1 1 49 49 VAL CB C 13 36.723 0.000 . 1 . . . . 49 VAL CB . 15210 1 612 . 1 1 49 49 VAL CG1 C 13 22.214 0.000 . 1 . . . . 49 VAL CG1 . 15210 1 613 . 1 1 49 49 VAL CG2 C 13 23.040 0.000 . 1 . . . . 49 VAL CG2 . 15210 1 614 . 1 1 49 49 VAL N N 15 123.046 0.000 . 1 . . . . 49 VAL N . 15210 1 615 . 1 1 50 50 ASN H H 1 8.608 0.000 . 1 . . . . 50 ASN H . 15210 1 616 . 1 1 50 50 ASN HA H 1 4.176 0.002 . 1 . . . . 50 ASN HA . 15210 1 617 . 1 1 50 50 ASN HB2 H 1 1.707 0.007 . 2 . . . . 50 ASN HB2 . 15210 1 618 . 1 1 50 50 ASN HB3 H 1 2.178 0.000 . 2 . . . . 50 ASN HB3 . 15210 1 619 . 1 1 50 50 ASN HD21 H 1 6.653 0.001 . 2 . . . . 50 ASN HD21 . 15210 1 620 . 1 1 50 50 ASN HD22 H 1 6.888 0.000 . 2 . . . . 50 ASN HD22 . 15210 1 621 . 1 1 50 50 ASN C C 13 177.151 0.000 . 1 . . . . 50 ASN C . 15210 1 622 . 1 1 50 50 ASN CA C 13 52.970 0.000 . 1 . . . . 50 ASN CA . 15210 1 623 . 1 1 50 50 ASN CB C 13 38.322 0.000 . 1 . . . . 50 ASN CB . 15210 1 624 . 1 1 50 50 ASN N N 15 126.157 0.000 . 1 . . . . 50 ASN N . 15210 1 625 . 1 1 50 50 ASN ND2 N 15 112.368 0.000 . 1 . . . . 50 ASN ND2 . 15210 1 626 . 1 1 51 51 ILE H H 1 8.632 0.000 . 1 . . . . 51 ILE H . 15210 1 627 . 1 1 51 51 ILE HA H 1 3.629 0.001 . 1 . . . . 51 ILE HA . 15210 1 628 . 1 1 51 51 ILE HB H 1 1.707 0.001 . 1 . . . . 51 ILE HB . 15210 1 629 . 1 1 51 51 ILE HD11 H 1 0.881 0.000 . 1 . . . . 51 ILE QD1 . 15210 1 630 . 1 1 51 51 ILE HD12 H 1 0.881 0.000 . 1 . . . . 51 ILE QD1 . 15210 1 631 . 1 1 51 51 ILE HD13 H 1 0.881 0.000 . 1 . . . . 51 ILE QD1 . 15210 1 632 . 1 1 51 51 ILE HG12 H 1 1.416 0.000 . 2 . . . . 51 ILE HG12 . 15210 1 633 . 1 1 51 51 ILE HG13 H 1 1.154 0.002 . 2 . . . . 51 ILE HG13 . 15210 1 634 . 1 1 51 51 ILE HG21 H 1 0.936 0.003 . 1 . . . . 51 ILE QG2 . 15210 1 635 . 1 1 51 51 ILE HG22 H 1 0.936 0.003 . 1 . . . . 51 ILE QG2 . 15210 1 636 . 1 1 51 51 ILE HG23 H 1 0.936 0.003 . 1 . . . . 51 ILE QG2 . 15210 1 637 . 1 1 51 51 ILE C C 13 177.086 0.000 . 1 . . . . 51 ILE C . 15210 1 638 . 1 1 51 51 ILE CA C 13 65.219 0.000 . 1 . . . . 51 ILE CA . 15210 1 639 . 1 1 51 51 ILE CB C 13 38.708 0.000 . 1 . . . . 51 ILE CB . 15210 1 640 . 1 1 51 51 ILE CD1 C 13 14.069 0.000 . 1 . . . . 51 ILE CD1 . 15210 1 641 . 1 1 51 51 ILE CG1 C 13 28.537 0.000 . 1 . . . . 51 ILE CG1 . 15210 1 642 . 1 1 51 51 ILE CG2 C 13 18.788 0.000 . 1 . . . . 51 ILE CG2 . 15210 1 643 . 1 1 51 51 ILE N N 15 126.956 0.000 . 1 . . . . 51 ILE N . 15210 1 644 . 1 1 52 52 LEU H H 1 8.485 0.000 . 1 . . . . 52 LEU H . 15210 1 645 . 1 1 52 52 LEU HA H 1 4.278 0.000 . 1 . . . . 52 LEU HA . 15210 1 646 . 1 1 52 52 LEU HB2 H 1 1.499 0.000 . 2 . . . . 52 LEU HB2 . 15210 1 647 . 1 1 52 52 LEU HB3 H 1 1.406 0.000 . 2 . . . . 52 LEU HB3 . 15210 1 648 . 1 1 52 52 LEU HD11 H 1 0.915 0.000 . 2 . . . . 52 LEU QD1 . 15210 1 649 . 1 1 52 52 LEU HD12 H 1 0.915 0.000 . 2 . . . . 52 LEU QD1 . 15210 1 650 . 1 1 52 52 LEU HD13 H 1 0.915 0.000 . 2 . . . . 52 LEU QD1 . 15210 1 651 . 1 1 52 52 LEU HD21 H 1 0.906 0.000 . 2 . . . . 52 LEU QD2 . 15210 1 652 . 1 1 52 52 LEU HD22 H 1 0.906 0.000 . 2 . . . . 52 LEU QD2 . 15210 1 653 . 1 1 52 52 LEU HD23 H 1 0.906 0.000 . 2 . . . . 52 LEU QD2 . 15210 1 654 . 1 1 52 52 LEU HG H 1 1.663 0.000 . 1 . . . . 52 LEU HG . 15210 1 655 . 1 1 52 52 LEU C C 13 178.430 0.000 . 1 . . . . 52 LEU C . 15210 1 656 . 1 1 52 52 LEU CA C 13 56.126 0.000 . 1 . . . . 52 LEU CA . 15210 1 657 . 1 1 52 52 LEU CB C 13 41.154 0.000 . 1 . . . . 52 LEU CB . 15210 1 658 . 1 1 52 52 LEU CD1 C 13 25.105 0.000 . 1 . . . . 52 LEU CD1 . 15210 1 659 . 1 1 52 52 LEU CD2 C 13 22.613 0.000 . 1 . . . . 52 LEU CD2 . 15210 1 660 . 1 1 52 52 LEU CG C 13 27.091 0.000 . 1 . . . . 52 LEU CG . 15210 1 661 . 1 1 52 52 LEU N N 15 118.365 0.000 . 1 . . . . 52 LEU N . 15210 1 662 . 1 1 53 53 HIS H H 1 8.384 0.000 . 1 . . . . 53 HIS H . 15210 1 663 . 1 1 53 53 HIS HA H 1 4.628 0.002 . 1 . . . . 53 HIS HA . 15210 1 664 . 1 1 53 53 HIS HB2 H 1 3.292 0.004 . 2 . . . . 53 HIS HB2 . 15210 1 665 . 1 1 53 53 HIS HB3 H 1 3.408 0.004 . 2 . . . . 53 HIS HB3 . 15210 1 666 . 1 1 53 53 HIS HD2 H 1 6.532 0.000 . 1 . . . . 53 HIS HD2 . 15210 1 667 . 1 1 53 53 HIS HE1 H 1 8.080 0.000 . 1 . . . . 53 HIS HE1 . 15210 1 668 . 1 1 53 53 HIS C C 13 174.170 0.000 . 1 . . . . 53 HIS C . 15210 1 669 . 1 1 53 53 HIS CA C 13 54.225 0.000 . 1 . . . . 53 HIS CA . 15210 1 670 . 1 1 53 53 HIS CB C 13 30.756 0.000 . 1 . . . . 53 HIS CB . 15210 1 671 . 1 1 53 53 HIS CD2 C 13 115.869 0.000 . 1 . . . . 53 HIS CD2 . 15210 1 672 . 1 1 53 53 HIS N N 15 117.625 0.000 . 1 . . . . 53 HIS N . 15210 1 673 . 1 1 54 54 LEU H H 1 7.692 0.000 . 1 . . . . 54 LEU H . 15210 1 674 . 1 1 54 54 LEU HA H 1 5.233 0.003 . 1 . . . . 54 LEU HA . 15210 1 675 . 1 1 54 54 LEU HB2 H 1 1.932 0.000 . 2 . . . . 54 LEU HB2 . 15210 1 676 . 1 1 54 54 LEU HB3 H 1 1.033 0.004 . 2 . . . . 54 LEU HB3 . 15210 1 677 . 1 1 54 54 LEU HD11 H 1 0.723 0.004 . 2 . . . . 54 LEU QD1 . 15210 1 678 . 1 1 54 54 LEU HD12 H 1 0.723 0.004 . 2 . . . . 54 LEU QD1 . 15210 1 679 . 1 1 54 54 LEU HD13 H 1 0.723 0.004 . 2 . . . . 54 LEU QD1 . 15210 1 680 . 1 1 54 54 LEU HD21 H 1 0.693 0.002 . 2 . . . . 54 LEU QD2 . 15210 1 681 . 1 1 54 54 LEU HD22 H 1 0.693 0.002 . 2 . . . . 54 LEU QD2 . 15210 1 682 . 1 1 54 54 LEU HD23 H 1 0.693 0.002 . 2 . . . . 54 LEU QD2 . 15210 1 683 . 1 1 54 54 LEU HG H 1 1.581 0.000 . 1 . . . . 54 LEU HG . 15210 1 684 . 1 1 54 54 LEU C C 13 175.580 0.000 . 1 . . . . 54 LEU C . 15210 1 685 . 1 1 54 54 LEU CA C 13 53.147 0.000 . 1 . . . . 54 LEU CA . 15210 1 686 . 1 1 54 54 LEU CB C 13 46.198 0.000 . 1 . . . . 54 LEU CB . 15210 1 687 . 1 1 54 54 LEU CD1 C 13 26.488 0.000 . 1 . . . . 54 LEU CD1 . 15210 1 688 . 1 1 54 54 LEU CD2 C 13 23.595 0.000 . 1 . . . . 54 LEU CD2 . 15210 1 689 . 1 1 54 54 LEU CG C 13 26.182 0.000 . 1 . . . . 54 LEU CG . 15210 1 690 . 1 1 54 54 LEU N N 15 119.437 0.000 . 1 . . . . 54 LEU N . 15210 1 691 . 1 1 55 55 GLU H H 1 9.107 0.001 . 1 . . . . 55 GLU H . 15210 1 692 . 1 1 55 55 GLU HA H 1 5.085 0.003 . 1 . . . . 55 GLU HA . 15210 1 693 . 1 1 55 55 GLU HB2 H 1 1.983 0.000 . 2 . . . . 55 GLU HB2 . 15210 1 694 . 1 1 55 55 GLU HB3 H 1 1.874 0.004 . 2 . . . . 55 GLU HB3 . 15210 1 695 . 1 1 55 55 GLU HG2 H 1 2.163 0.009 . 2 . . . . 55 GLU HG2 . 15210 1 696 . 1 1 55 55 GLU HG3 H 1 2.205 0.000 . 2 . . . . 55 GLU HG3 . 15210 1 697 . 1 1 55 55 GLU CA C 13 52.512 0.000 . 1 . . . . 55 GLU CA . 15210 1 698 . 1 1 55 55 GLU CB C 13 32.582 0.000 . 1 . . . . 55 GLU CB . 15210 1 699 . 1 1 55 55 GLU CG C 13 36.226 0.000 . 1 . . . . 55 GLU CG . 15210 1 700 . 1 1 55 55 GLU N N 15 120.652 0.000 . 1 . . . . 55 GLU N . 15210 1 701 . 1 1 56 56 PRO HA H 1 4.892 0.002 . 1 . . . . 56 PRO HA . 15210 1 702 . 1 1 56 56 PRO HB2 H 1 1.933 0.000 . 2 . . . . 56 PRO HB2 . 15210 1 703 . 1 1 56 56 PRO HB3 H 1 1.952 0.000 . 2 . . . . 56 PRO HB3 . 15210 1 704 . 1 1 56 56 PRO HD2 H 1 3.957 0.005 . 2 . . . . 56 PRO HD2 . 15210 1 705 . 1 1 56 56 PRO HD3 H 1 3.654 0.005 . 2 . . . . 56 PRO HD3 . 15210 1 706 . 1 1 56 56 PRO HG2 H 1 2.212 0.000 . 2 . . . . 56 PRO HG2 . 15210 1 707 . 1 1 56 56 PRO HG3 H 1 1.929 0.003 . 2 . . . . 56 PRO HG3 . 15210 1 708 . 1 1 56 56 PRO C C 13 176.065 0.000 . 1 . . . . 56 PRO C . 15210 1 709 . 1 1 56 56 PRO CA C 13 63.300 0.000 . 1 . . . . 56 PRO CA . 15210 1 710 . 1 1 56 56 PRO CB C 13 32.645 0.000 . 1 . . . . 56 PRO CB . 15210 1 711 . 1 1 56 56 PRO CD C 13 51.116 0.000 . 1 . . . . 56 PRO CD . 15210 1 712 . 1 1 56 56 PRO CG C 13 27.517 0.000 . 1 . . . . 56 PRO CG . 15210 1 713 . 1 1 57 57 THR H H 1 8.540 0.002 . 1 . . . . 57 THR H . 15210 1 714 . 1 1 57 57 THR HA H 1 4.937 0.000 . 1 . . . . 57 THR HA . 15210 1 715 . 1 1 57 57 THR HB H 1 4.602 0.000 . 1 . . . . 57 THR HB . 15210 1 716 . 1 1 57 57 THR HG21 H 1 1.362 0.000 . 1 . . . . 57 THR QG2 . 15210 1 717 . 1 1 57 57 THR HG22 H 1 1.362 0.000 . 1 . . . . 57 THR QG2 . 15210 1 718 . 1 1 57 57 THR HG23 H 1 1.362 0.000 . 1 . . . . 57 THR QG2 . 15210 1 719 . 1 1 57 57 THR C C 13 173.928 0.000 . 1 . . . . 57 THR C . 15210 1 720 . 1 1 57 57 THR CA C 13 60.643 0.000 . 1 . . . . 57 THR CA . 15210 1 721 . 1 1 57 57 THR CB C 13 72.087 0.000 . 1 . . . . 57 THR CB . 15210 1 722 . 1 1 57 57 THR CG2 C 13 20.895 0.000 . 1 . . . . 57 THR CG2 . 15210 1 723 . 1 1 57 57 THR N N 15 113.127 0.000 . 1 . . . . 57 THR N . 15210 1 724 . 1 1 58 58 ASP H H 1 8.629 0.000 . 1 . . . . 58 ASP H . 15210 1 725 . 1 1 58 58 ASP HA H 1 4.420 0.000 . 1 . . . . 58 ASP HA . 15210 1 726 . 1 1 58 58 ASP HB2 H 1 2.691 0.000 . 2 . . . . 58 ASP HB2 . 15210 1 727 . 1 1 58 58 ASP HB3 H 1 2.951 0.000 . 2 . . . . 58 ASP HB3 . 15210 1 728 . 1 1 58 58 ASP C C 13 175.288 0.000 . 1 . . . . 58 ASP C . 15210 1 729 . 1 1 58 58 ASP CA C 13 54.025 0.000 . 1 . . . . 58 ASP CA . 15210 1 730 . 1 1 58 58 ASP CB C 13 39.848 0.000 . 1 . . . . 58 ASP CB . 15210 1 731 . 1 1 58 58 ASP N N 15 115.600 0.000 . 1 . . . . 58 ASP N . 15210 1 732 . 1 1 59 59 LYS H H 1 8.569 0.000 . 1 . . . . 59 LYS H . 15210 1 733 . 1 1 59 59 LYS HA H 1 4.652 0.000 . 1 . . . . 59 LYS HA . 15210 1 734 . 1 1 59 59 LYS HB2 H 1 1.439 0.000 . 2 . . . . 59 LYS HB2 . 15210 1 735 . 1 1 59 59 LYS HB3 H 1 1.813 0.004 . 2 . . . . 59 LYS HB3 . 15210 1 736 . 1 1 59 59 LYS HD2 H 1 1.109 0.000 . 2 . . . . 59 LYS HD2 . 15210 1 737 . 1 1 59 59 LYS HD3 H 1 1.283 0.000 . 2 . . . . 59 LYS HD3 . 15210 1 738 . 1 1 59 59 LYS HE2 H 1 2.341 0.002 . 2 . . . . 59 LYS HE2 . 15210 1 739 . 1 1 59 59 LYS HE3 H 1 2.394 0.012 . 2 . . . . 59 LYS HE3 . 15210 1 740 . 1 1 59 59 LYS HG2 H 1 0.860 0.000 . 2 . . . . 59 LYS HG2 . 15210 1 741 . 1 1 59 59 LYS HG3 H 1 1.253 0.000 . 2 . . . . 59 LYS HG3 . 15210 1 742 . 1 1 59 59 LYS C C 13 174.462 0.000 . 1 . . . . 59 LYS C . 15210 1 743 . 1 1 59 59 LYS CA C 13 54.522 0.000 . 1 . . . . 59 LYS CA . 15210 1 744 . 1 1 59 59 LYS CB C 13 34.898 0.000 . 1 . . . . 59 LYS CB . 15210 1 745 . 1 1 59 59 LYS CD C 13 28.392 0.000 . 1 . . . . 59 LYS CD . 15210 1 746 . 1 1 59 59 LYS CE C 13 42.105 0.000 . 1 . . . . 59 LYS CE . 15210 1 747 . 1 1 59 59 LYS CG C 13 24.338 0.000 . 1 . . . . 59 LYS CG . 15210 1 748 . 1 1 59 59 LYS N N 15 119.877 0.000 . 1 . . . . 59 LYS N . 15210 1 749 . 1 1 60 60 LYS H H 1 8.228 0.000 . 1 . . . . 60 LYS H . 15210 1 750 . 1 1 60 60 LYS HA H 1 5.007 0.000 . 1 . . . . 60 LYS HA . 15210 1 751 . 1 1 60 60 LYS HB2 H 1 1.555 0.003 . 2 . . . . 60 LYS HB2 . 15210 1 752 . 1 1 60 60 LYS HB3 H 1 1.567 0.000 . 2 . . . . 60 LYS HB3 . 15210 1 753 . 1 1 60 60 LYS HD2 H 1 1.522 0.000 . 2 . . . . 60 LYS HD2 . 15210 1 754 . 1 1 60 60 LYS HD3 H 1 1.436 0.000 . 2 . . . . 60 LYS HD3 . 15210 1 755 . 1 1 60 60 LYS HE2 H 1 2.865 0.000 . 2 . . . . 60 LYS HE2 . 15210 1 756 . 1 1 60 60 LYS HE3 H 1 2.940 0.000 . 2 . . . . 60 LYS HE3 . 15210 1 757 . 1 1 60 60 LYS HG2 H 1 1.029 0.001 . 2 . . . . 60 LYS HG2 . 15210 1 758 . 1 1 60 60 LYS HG3 H 1 1.249 0.000 . 2 . . . . 60 LYS HG3 . 15210 1 759 . 1 1 60 60 LYS C C 13 174.770 0.000 . 1 . . . . 60 LYS C . 15210 1 760 . 1 1 60 60 LYS CA C 13 54.670 0.000 . 1 . . . . 60 LYS CA . 15210 1 761 . 1 1 60 60 LYS CB C 13 36.536 0.000 . 1 . . . . 60 LYS CB . 15210 1 762 . 1 1 60 60 LYS CD C 13 29.695 0.000 . 1 . . . . 60 LYS CD . 15210 1 763 . 1 1 60 60 LYS CE C 13 42.075 0.000 . 1 . . . . 60 LYS CE . 15210 1 764 . 1 1 60 60 LYS CG C 13 24.037 0.000 . 1 . . . . 60 LYS CG . 15210 1 765 . 1 1 60 60 LYS N N 15 121.307 0.000 . 1 . . . . 60 LYS N . 15210 1 766 . 1 1 61 61 ILE H H 1 8.572 0.000 . 1 . . . . 61 ILE H . 15210 1 767 . 1 1 61 61 ILE HA H 1 4.755 0.000 . 1 . . . . 61 ILE HA . 15210 1 768 . 1 1 61 61 ILE HB H 1 1.671 0.000 . 1 . . . . 61 ILE HB . 15210 1 769 . 1 1 61 61 ILE HD11 H 1 0.854 0.000 . 1 . . . . 61 ILE QD1 . 15210 1 770 . 1 1 61 61 ILE HD12 H 1 0.854 0.000 . 1 . . . . 61 ILE QD1 . 15210 1 771 . 1 1 61 61 ILE HD13 H 1 0.854 0.000 . 1 . . . . 61 ILE QD1 . 15210 1 772 . 1 1 61 61 ILE HG12 H 1 1.438 0.001 . 2 . . . . 61 ILE HG12 . 15210 1 773 . 1 1 61 61 ILE HG13 H 1 1.237 0.004 . 2 . . . . 61 ILE HG13 . 15210 1 774 . 1 1 61 61 ILE HG21 H 1 0.825 0.002 . 1 . . . . 61 ILE QG2 . 15210 1 775 . 1 1 61 61 ILE HG22 H 1 0.825 0.002 . 1 . . . . 61 ILE QG2 . 15210 1 776 . 1 1 61 61 ILE HG23 H 1 0.825 0.002 . 1 . . . . 61 ILE QG2 . 15210 1 777 . 1 1 61 61 ILE C C 13 174.608 0.000 . 1 . . . . 61 ILE C . 15210 1 778 . 1 1 61 61 ILE CA C 13 59.054 0.000 . 1 . . . . 61 ILE CA . 15210 1 779 . 1 1 61 61 ILE CB C 13 41.629 0.000 . 1 . . . . 61 ILE CB . 15210 1 780 . 1 1 61 61 ILE CD1 C 13 15.587 0.000 . 1 . . . . 61 ILE CD1 . 15210 1 781 . 1 1 61 61 ILE CG1 C 13 24.741 0.000 . 1 . . . . 61 ILE CG1 . 15210 1 782 . 1 1 61 61 ILE CG2 C 13 18.593 0.000 . 1 . . . . 61 ILE CG2 . 15210 1 783 . 1 1 61 61 ILE N N 15 116.518 0.000 . 1 . . . . 61 ILE N . 15210 1 784 . 1 1 62 62 ASP H H 1 8.553 0.000 . 1 . . . . 62 ASP H . 15210 1 785 . 1 1 62 62 ASP HA H 1 4.732 0.000 . 1 . . . . 62 ASP HA . 15210 1 786 . 1 1 62 62 ASP HB2 H 1 2.509 0.000 . 2 . . . . 62 ASP HB2 . 15210 1 787 . 1 1 62 62 ASP HB3 H 1 2.699 0.007 . 2 . . . . 62 ASP HB3 . 15210 1 788 . 1 1 62 62 ASP C C 13 174.867 0.000 . 1 . . . . 62 ASP C . 15210 1 789 . 1 1 62 62 ASP CA C 13 53.425 0.000 . 1 . . . . 62 ASP CA . 15210 1 790 . 1 1 62 62 ASP CB C 13 40.049 0.000 . 1 . . . . 62 ASP CB . 15210 1 791 . 1 1 62 62 ASP N N 15 121.962 0.000 . 1 . . . . 62 ASP N . 15210 1 792 . 1 1 63 63 ILE H H 1 7.410 0.000 . 1 . . . . 63 ILE H . 15210 1 793 . 1 1 63 63 ILE HA H 1 4.663 0.000 . 1 . . . . 63 ILE HA . 15210 1 794 . 1 1 63 63 ILE HB H 1 1.935 0.002 . 1 . . . . 63 ILE HB . 15210 1 795 . 1 1 63 63 ILE HD11 H 1 0.853 0.003 . 1 . . . . 63 ILE QD1 . 15210 1 796 . 1 1 63 63 ILE HD12 H 1 0.853 0.003 . 1 . . . . 63 ILE QD1 . 15210 1 797 . 1 1 63 63 ILE HD13 H 1 0.853 0.003 . 1 . . . . 63 ILE QD1 . 15210 1 798 . 1 1 63 63 ILE HG12 H 1 1.308 0.001 . 2 . . . . 63 ILE HG12 . 15210 1 799 . 1 1 63 63 ILE HG13 H 1 0.762 0.000 . 2 . . . . 63 ILE HG13 . 15210 1 800 . 1 1 63 63 ILE HG21 H 1 0.796 0.000 . 1 . . . . 63 ILE QG2 . 15210 1 801 . 1 1 63 63 ILE HG22 H 1 0.796 0.000 . 1 . . . . 63 ILE QG2 . 15210 1 802 . 1 1 63 63 ILE HG23 H 1 0.796 0.000 . 1 . . . . 63 ILE QG2 . 15210 1 803 . 1 1 63 63 ILE C C 13 174.818 0.000 . 1 . . . . 63 ILE C . 15210 1 804 . 1 1 63 63 ILE CA C 13 58.459 0.000 . 1 . . . . 63 ILE CA . 15210 1 805 . 1 1 63 63 ILE CB C 13 42.039 0.000 . 1 . . . . 63 ILE CB . 15210 1 806 . 1 1 63 63 ILE CD1 C 13 14.951 0.000 . 1 . . . . 63 ILE CD1 . 15210 1 807 . 1 1 63 63 ILE CG1 C 13 24.798 0.000 . 1 . . . . 63 ILE CG1 . 15210 1 808 . 1 1 63 63 ILE CG2 C 13 19.241 0.000 . 1 . . . . 63 ILE CG2 . 15210 1 809 . 1 1 63 63 ILE N N 15 114.715 0.000 . 1 . . . . 63 ILE N . 15210 1 810 . 1 1 64 64 GLN H H 1 8.598 0.002 . 1 . . . . 64 GLN H . 15210 1 811 . 1 1 64 64 GLN HA H 1 4.407 0.000 . 1 . . . . 64 GLN HA . 15210 1 812 . 1 1 64 64 GLN HB2 H 1 2.039 0.000 . 2 . . . . 64 GLN HB2 . 15210 1 813 . 1 1 64 64 GLN HB3 H 1 2.093 0.000 . 2 . . . . 64 GLN HB3 . 15210 1 814 . 1 1 64 64 GLN HE21 H 1 7.975 0.000 . 2 . . . . 64 GLN HE21 . 15210 1 815 . 1 1 64 64 GLN HE22 H 1 6.878 0.000 . 2 . . . . 64 GLN HE22 . 15210 1 816 . 1 1 64 64 GLN HG2 H 1 2.368 0.004 . 2 . . . . 64 GLN HG2 . 15210 1 817 . 1 1 64 64 GLN HG3 H 1 2.487 0.001 . 2 . . . . 64 GLN HG3 . 15210 1 818 . 1 1 64 64 GLN C C 13 175.304 0.000 . 1 . . . . 64 GLN C . 15210 1 819 . 1 1 64 64 GLN CA C 13 54.082 0.017 . 1 . . . . 64 GLN CA . 15210 1 820 . 1 1 64 64 GLN CB C 13 30.347 0.000 . 1 . . . . 64 GLN CB . 15210 1 821 . 1 1 64 64 GLN CG C 13 33.720 0.000 . 1 . . . . 64 GLN CG . 15210 1 822 . 1 1 64 64 GLN N N 15 119.359 0.000 . 1 . . . . 64 GLN N . 15210 1 823 . 1 1 64 64 GLN NE2 N 15 113.908 0.000 . 1 . . . . 64 GLN NE2 . 15210 1 824 . 1 1 65 65 LYS H H 1 8.370 0.002 . 1 . . . . 65 LYS H . 15210 1 825 . 1 1 65 65 LYS HA H 1 4.139 0.001 . 1 . . . . 65 LYS HA . 15210 1 826 . 1 1 65 65 LYS HB2 H 1 1.926 0.002 . 2 . . . . 65 LYS HB2 . 15210 1 827 . 1 1 65 65 LYS HB3 H 1 1.805 0.003 . 2 . . . . 65 LYS HB3 . 15210 1 828 . 1 1 65 65 LYS HD2 H 1 1.613 0.000 . 2 . . . . 65 LYS HD2 . 15210 1 829 . 1 1 65 65 LYS HD3 H 1 1.753 0.000 . 2 . . . . 65 LYS HD3 . 15210 1 830 . 1 1 65 65 LYS HE2 H 1 3.086 0.001 . 2 . . . . 65 LYS HE2 . 15210 1 831 . 1 1 65 65 LYS HE3 H 1 3.086 0.000 . 2 . . . . 65 LYS HE3 . 15210 1 832 . 1 1 65 65 LYS HG2 H 1 1.563 0.000 . 2 . . . . 65 LYS HG2 . 15210 1 833 . 1 1 65 65 LYS HG3 H 1 1.426 0.000 . 2 . . . . 65 LYS HG3 . 15210 1 834 . 1 1 65 65 LYS C C 13 178.317 0.000 . 1 . . . . 65 LYS C . 15210 1 835 . 1 1 65 65 LYS CA C 13 57.867 0.000 . 1 . . . . 65 LYS CA . 15210 1 836 . 1 1 65 65 LYS CB C 13 32.506 0.000 . 1 . . . . 65 LYS CB . 15210 1 837 . 1 1 65 65 LYS CD C 13 30.087 0.000 . 1 . . . . 65 LYS CD . 15210 1 838 . 1 1 65 65 LYS CE C 13 42.818 0.000 . 1 . . . . 65 LYS CE . 15210 1 839 . 1 1 65 65 LYS CG C 13 24.671 0.000 . 1 . . . . 65 LYS CG . 15210 1 840 . 1 1 65 65 LYS N N 15 119.999 0.000 . 1 . . . . 65 LYS N . 15210 1 841 . 1 1 66 66 GLY H H 1 9.372 0.001 . 1 . . . . 66 GLY H . 15210 1 842 . 1 1 66 66 GLY HA2 H 1 4.103 0.000 . 2 . . . . 66 GLY HA2 . 15210 1 843 . 1 1 66 66 GLY HA3 H 1 3.315 0.000 . 2 . . . . 66 GLY HA3 . 15210 1 844 . 1 1 66 66 GLY C C 13 173.847 0.000 . 1 . . . . 66 GLY C . 15210 1 845 . 1 1 66 66 GLY CA C 13 45.197 0.000 . 1 . . . . 66 GLY CA . 15210 1 846 . 1 1 66 66 GLY N N 15 112.771 0.000 . 1 . . . . 66 GLY N . 15210 1 847 . 1 1 67 67 ALA H H 1 7.581 0.006 . 1 . . . . 67 ALA H . 15210 1 848 . 1 1 67 67 ALA HA H 1 4.079 0.000 . 1 . . . . 67 ALA HA . 15210 1 849 . 1 1 67 67 ALA HB1 H 1 1.506 0.002 . 1 . . . . 67 ALA QB . 15210 1 850 . 1 1 67 67 ALA HB2 H 1 1.506 0.002 . 1 . . . . 67 ALA QB . 15210 1 851 . 1 1 67 67 ALA HB3 H 1 1.506 0.002 . 1 . . . . 67 ALA QB . 15210 1 852 . 1 1 67 67 ALA C C 13 177.377 0.000 . 1 . . . . 67 ALA C . 15210 1 853 . 1 1 67 67 ALA CA C 13 52.998 0.000 . 1 . . . . 67 ALA CA . 15210 1 854 . 1 1 67 67 ALA CB C 13 20.597 0.000 . 1 . . . . 67 ALA CB . 15210 1 855 . 1 1 67 67 ALA N N 15 121.771 0.000 . 1 . . . . 67 ALA N . 15210 1 856 . 1 1 68 68 SER H H 1 8.981 0.000 . 1 . . . . 68 SER H . 15210 1 857 . 1 1 68 68 SER HA H 1 4.282 0.000 . 1 . . . . 68 SER HA . 15210 1 858 . 1 1 68 68 SER HB2 H 1 4.478 0.006 . 2 . . . . 68 SER HB2 . 15210 1 859 . 1 1 68 68 SER HB3 H 1 4.185 0.001 . 2 . . . . 68 SER HB3 . 15210 1 860 . 1 1 68 68 SER C C 13 174.154 0.000 . 1 . . . . 68 SER C . 15210 1 861 . 1 1 68 68 SER CA C 13 57.510 0.000 . 1 . . . . 68 SER CA . 15210 1 862 . 1 1 68 68 SER CB C 13 65.373 0.000 . 1 . . . . 68 SER CB . 15210 1 863 . 1 1 68 68 SER N N 15 119.801 0.000 . 1 . . . . 68 SER N . 15210 1 864 . 1 1 69 69 ASP H H 1 9.429 0.000 . 1 . . . . 69 ASP H . 15210 1 865 . 1 1 69 69 ASP HA H 1 4.195 0.005 . 1 . . . . 69 ASP HA . 15210 1 866 . 1 1 69 69 ASP HB2 H 1 2.852 0.000 . 2 . . . . 69 ASP HB2 . 15210 1 867 . 1 1 69 69 ASP HB3 H 1 2.675 0.000 . 2 . . . . 69 ASP HB3 . 15210 1 868 . 1 1 69 69 ASP C C 13 178.414 0.000 . 1 . . . . 69 ASP C . 15210 1 869 . 1 1 69 69 ASP CA C 13 58.041 0.000 . 1 . . . . 69 ASP CA . 15210 1 870 . 1 1 69 69 ASP CB C 13 39.618 0.000 . 1 . . . . 69 ASP CB . 15210 1 871 . 1 1 69 69 ASP N N 15 122.524 0.000 . 1 . . . . 69 ASP N . 15210 1 872 . 1 1 70 70 GLU H H 1 8.468 0.000 . 1 . . . . 70 GLU H . 15210 1 873 . 1 1 70 70 GLU HA H 1 3.966 0.002 . 1 . . . . 70 GLU HA . 15210 1 874 . 1 1 70 70 GLU HB2 H 1 2.004 0.000 . 2 . . . . 70 GLU HB2 . 15210 1 875 . 1 1 70 70 GLU HB3 H 1 2.104 0.000 . 2 . . . . 70 GLU HB3 . 15210 1 876 . 1 1 70 70 GLU HG2 H 1 2.343 0.000 . 2 . . . . 70 GLU HG2 . 15210 1 877 . 1 1 70 70 GLU HG3 H 1 2.410 0.000 . 2 . . . . 70 GLU HG3 . 15210 1 878 . 1 1 70 70 GLU C C 13 178.965 0.000 . 1 . . . . 70 GLU C . 15210 1 879 . 1 1 70 70 GLU CA C 13 60.273 0.000 . 1 . . . . 70 GLU CA . 15210 1 880 . 1 1 70 70 GLU CB C 13 29.133 0.000 . 1 . . . . 70 GLU CB . 15210 1 881 . 1 1 70 70 GLU CG C 13 36.588 0.000 . 1 . . . . 70 GLU CG . 15210 1 882 . 1 1 70 70 GLU N N 15 118.755 0.000 . 1 . . . . 70 GLU N . 15210 1 883 . 1 1 71 71 GLU H H 1 7.868 0.000 . 1 . . . . 71 GLU H . 15210 1 884 . 1 1 71 71 GLU HA H 1 4.057 0.003 . 1 . . . . 71 GLU HA . 15210 1 885 . 1 1 71 71 GLU HB2 H 1 2.290 0.000 . 2 . . . . 71 GLU HB2 . 15210 1 886 . 1 1 71 71 GLU HB3 H 1 2.109 0.005 . 2 . . . . 71 GLU HB3 . 15210 1 887 . 1 1 71 71 GLU HG2 H 1 2.269 0.002 . 2 . . . . 71 GLU HG2 . 15210 1 888 . 1 1 71 71 GLU HG3 H 1 2.363 0.009 . 2 . . . . 71 GLU HG3 . 15210 1 889 . 1 1 71 71 GLU C C 13 179.094 0.000 . 1 . . . . 71 GLU C . 15210 1 890 . 1 1 71 71 GLU CA C 13 59.253 0.000 . 1 . . . . 71 GLU CA . 15210 1 891 . 1 1 71 71 GLU CB C 13 29.344 0.000 . 1 . . . . 71 GLU CB . 15210 1 892 . 1 1 71 71 GLU CG C 13 36.697 0.000 . 1 . . . . 71 GLU CG . 15210 1 893 . 1 1 71 71 GLU N N 15 122.391 0.000 . 1 . . . . 71 GLU N . 15210 1 894 . 1 1 72 72 VAL H H 1 8.428 0.000 . 1 . . . . 72 VAL H . 15210 1 895 . 1 1 72 72 VAL HA H 1 3.306 0.000 . 1 . . . . 72 VAL HA . 15210 1 896 . 1 1 72 72 VAL HB H 1 2.151 0.001 . 1 . . . . 72 VAL HB . 15210 1 897 . 1 1 72 72 VAL HG11 H 1 0.907 0.005 . 2 . . . . 72 VAL QG1 . 15210 1 898 . 1 1 72 72 VAL HG12 H 1 0.907 0.005 . 2 . . . . 72 VAL QG1 . 15210 1 899 . 1 1 72 72 VAL HG13 H 1 0.907 0.005 . 2 . . . . 72 VAL QG1 . 15210 1 900 . 1 1 72 72 VAL HG21 H 1 0.755 0.000 . 2 . . . . 72 VAL QG2 . 15210 1 901 . 1 1 72 72 VAL HG22 H 1 0.755 0.000 . 2 . . . . 72 VAL QG2 . 15210 1 902 . 1 1 72 72 VAL HG23 H 1 0.755 0.000 . 2 . . . . 72 VAL QG2 . 15210 1 903 . 1 1 72 72 VAL C C 13 177.555 0.000 . 1 . . . . 72 VAL C . 15210 1 904 . 1 1 72 72 VAL CA C 13 67.287 0.000 . 1 . . . . 72 VAL CA . 15210 1 905 . 1 1 72 72 VAL CB C 13 31.495 0.000 . 1 . . . . 72 VAL CB . 15210 1 906 . 1 1 72 72 VAL CG1 C 13 23.773 0.000 . 1 . . . . 72 VAL CG1 . 15210 1 907 . 1 1 72 72 VAL CG2 C 13 22.765 0.000 . 1 . . . . 72 VAL CG2 . 15210 1 908 . 1 1 72 72 VAL N N 15 119.128 0.000 . 1 . . . . 72 VAL N . 15210 1 909 . 1 1 73 73 LYS H H 1 8.671 0.000 . 1 . . . . 73 LYS H . 15210 1 910 . 1 1 73 73 LYS HA H 1 3.748 0.002 . 1 . . . . 73 LYS HA . 15210 1 911 . 1 1 73 73 LYS HB2 H 1 1.946 0.001 . 2 . . . . 73 LYS HB2 . 15210 1 912 . 1 1 73 73 LYS HB3 H 1 1.942 0.002 . 2 . . . . 73 LYS HB3 . 15210 1 913 . 1 1 73 73 LYS HD2 H 1 1.786 0.002 . 2 . . . . 73 LYS HD2 . 15210 1 914 . 1 1 73 73 LYS HD3 H 1 1.787 0.000 . 2 . . . . 73 LYS HD3 . 15210 1 915 . 1 1 73 73 LYS HE2 H 1 2.882 0.003 . 2 . . . . 73 LYS HE2 . 15210 1 916 . 1 1 73 73 LYS HE3 H 1 2.883 0.000 . 2 . . . . 73 LYS HE3 . 15210 1 917 . 1 1 73 73 LYS HG2 H 1 1.634 0.000 . 2 . . . . 73 LYS HG2 . 15210 1 918 . 1 1 73 73 LYS HG3 H 1 1.340 0.000 . 2 . . . . 73 LYS HG3 . 15210 1 919 . 1 1 73 73 LYS C C 13 178.835 0.000 . 1 . . . . 73 LYS C . 15210 1 920 . 1 1 73 73 LYS CA C 13 60.878 0.000 . 1 . . . . 73 LYS CA . 15210 1 921 . 1 1 73 73 LYS CB C 13 32.561 0.018 . 1 . . . . 73 LYS CB . 15210 1 922 . 1 1 73 73 LYS CD C 13 29.731 0.000 . 1 . . . . 73 LYS CD . 15210 1 923 . 1 1 73 73 LYS CE C 13 41.700 0.000 . 1 . . . . 73 LYS CE . 15210 1 924 . 1 1 73 73 LYS CG C 13 26.314 0.000 . 1 . . . . 73 LYS CG . 15210 1 925 . 1 1 73 73 LYS N N 15 118.527 0.000 . 1 . . . . 73 LYS N . 15210 1 926 . 1 1 74 74 LYS H H 1 7.923 0.000 . 1 . . . . 74 LYS H . 15210 1 927 . 1 1 74 74 LYS HA H 1 4.151 0.004 . 1 . . . . 74 LYS HA . 15210 1 928 . 1 1 74 74 LYS HB2 H 1 1.944 0.000 . 2 . . . . 74 LYS HB2 . 15210 1 929 . 1 1 74 74 LYS HB3 H 1 1.998 0.004 . 2 . . . . 74 LYS HB3 . 15210 1 930 . 1 1 74 74 LYS HD2 H 1 1.734 0.001 . 2 . . . . 74 LYS HD2 . 15210 1 931 . 1 1 74 74 LYS HD3 H 1 1.733 0.000 . 2 . . . . 74 LYS HD3 . 15210 1 932 . 1 1 74 74 LYS HE2 H 1 3.012 0.000 . 2 . . . . 74 LYS HE2 . 15210 1 933 . 1 1 74 74 LYS HE3 H 1 3.015 0.000 . 2 . . . . 74 LYS HE3 . 15210 1 934 . 1 1 74 74 LYS HG2 H 1 1.591 0.000 . 2 . . . . 74 LYS HG2 . 15210 1 935 . 1 1 74 74 LYS HG3 H 1 1.440 0.000 . 2 . . . . 74 LYS HG3 . 15210 1 936 . 1 1 74 74 LYS C C 13 174.656 0.000 . 1 . . . . 74 LYS C . 15210 1 937 . 1 1 74 74 LYS CA C 13 59.227 0.000 . 1 . . . . 74 LYS CA . 15210 1 938 . 1 1 74 74 LYS CB C 13 32.384 0.000 . 1 . . . . 74 LYS CB . 15210 1 939 . 1 1 74 74 LYS CD C 13 29.216 0.000 . 1 . . . . 74 LYS CD . 15210 1 940 . 1 1 74 74 LYS CE C 13 42.053 0.000 . 1 . . . . 74 LYS CE . 15210 1 941 . 1 1 74 74 LYS CG C 13 24.715 0.000 . 1 . . . . 74 LYS CG . 15210 1 942 . 1 1 74 74 LYS N N 15 119.181 0.000 . 1 . . . . 74 LYS N . 15210 1 943 . 1 1 75 75 LYS H H 1 8.141 0.000 . 1 . . . . 75 LYS H . 15210 1 944 . 1 1 75 75 LYS HA H 1 4.240 0.000 . 1 . . . . 75 LYS HA . 15210 1 945 . 1 1 75 75 LYS HB2 H 1 1.970 0.003 . 2 . . . . 75 LYS HB2 . 15210 1 946 . 1 1 75 75 LYS HB3 H 1 1.738 0.004 . 2 . . . . 75 LYS HB3 . 15210 1 947 . 1 1 75 75 LYS HD2 H 1 1.425 0.000 . 2 . . . . 75 LYS HD2 . 15210 1 948 . 1 1 75 75 LYS HD3 H 1 1.426 0.000 . 2 . . . . 75 LYS HD3 . 15210 1 949 . 1 1 75 75 LYS HE2 H 1 2.867 0.000 . 2 . . . . 75 LYS HE2 . 15210 1 950 . 1 1 75 75 LYS HE3 H 1 2.873 0.000 . 2 . . . . 75 LYS HE3 . 15210 1 951 . 1 1 75 75 LYS HG2 H 1 1.597 0.000 . 2 . . . . 75 LYS HG2 . 15210 1 952 . 1 1 75 75 LYS HG3 H 1 1.597 0.000 . 2 . . . . 75 LYS HG3 . 15210 1 953 . 1 1 75 75 LYS C C 13 180.698 0.000 . 1 . . . . 75 LYS C . 15210 1 954 . 1 1 75 75 LYS CA C 13 57.370 0.000 . 1 . . . . 75 LYS CA . 15210 1 955 . 1 1 75 75 LYS CB C 13 31.435 0.000 . 1 . . . . 75 LYS CB . 15210 1 956 . 1 1 75 75 LYS CD C 13 28.780 0.000 . 1 . . . . 75 LYS CD . 15210 1 957 . 1 1 75 75 LYS CE C 13 41.780 0.000 . 1 . . . . 75 LYS CE . 15210 1 958 . 1 1 75 75 LYS CG C 13 24.709 0.000 . 1 . . . . 75 LYS CG . 15210 1 959 . 1 1 75 75 LYS N N 15 118.734 0.000 . 1 . . . . 75 LYS N . 15210 1 960 . 1 1 76 76 LEU H H 1 8.834 0.002 . 1 . . . . 76 LEU H . 15210 1 961 . 1 1 76 76 LEU HA H 1 3.936 0.008 . 1 . . . . 76 LEU HA . 15210 1 962 . 1 1 76 76 LEU HB2 H 1 2.172 0.002 . 2 . . . . 76 LEU HB2 . 15210 1 963 . 1 1 76 76 LEU HB3 H 1 1.064 0.002 . 2 . . . . 76 LEU HB3 . 15210 1 964 . 1 1 76 76 LEU HD11 H 1 0.856 0.000 . 2 . . . . 76 LEU QD1 . 15210 1 965 . 1 1 76 76 LEU HD12 H 1 0.856 0.000 . 2 . . . . 76 LEU QD1 . 15210 1 966 . 1 1 76 76 LEU HD13 H 1 0.856 0.000 . 2 . . . . 76 LEU QD1 . 15210 1 967 . 1 1 76 76 LEU HD21 H 1 0.825 0.007 . 2 . . . . 76 LEU QD2 . 15210 1 968 . 1 1 76 76 LEU HD22 H 1 0.825 0.007 . 2 . . . . 76 LEU QD2 . 15210 1 969 . 1 1 76 76 LEU HD23 H 1 0.825 0.007 . 2 . . . . 76 LEU QD2 . 15210 1 970 . 1 1 76 76 LEU HG H 1 1.966 0.002 . 1 . . . . 76 LEU HG . 15210 1 971 . 1 1 76 76 LEU C C 13 178.803 0.000 . 1 . . . . 76 LEU C . 15210 1 972 . 1 1 76 76 LEU CA C 13 58.434 0.000 . 1 . . . . 76 LEU CA . 15210 1 973 . 1 1 76 76 LEU CB C 13 42.223 0.000 . 1 . . . . 76 LEU CB . 15210 1 974 . 1 1 76 76 LEU CD1 C 13 23.718 0.000 . 1 . . . . 76 LEU CD1 . 15210 1 975 . 1 1 76 76 LEU CD2 C 13 27.546 0.000 . 1 . . . . 76 LEU CD2 . 15210 1 976 . 1 1 76 76 LEU CG C 13 26.319 0.000 . 1 . . . . 76 LEU CG . 15210 1 977 . 1 1 76 76 LEU N N 15 121.554 0.000 . 1 . . . . 76 LEU N . 15210 1 978 . 1 1 77 77 GLU H H 1 7.950 0.000 . 1 . . . . 77 GLU H . 15210 1 979 . 1 1 77 77 GLU HA H 1 4.251 0.002 . 1 . . . . 77 GLU HA . 15210 1 980 . 1 1 77 77 GLU HB2 H 1 2.180 0.003 . 2 . . . . 77 GLU HB2 . 15210 1 981 . 1 1 77 77 GLU HB3 H 1 2.272 0.001 . 2 . . . . 77 GLU HB3 . 15210 1 982 . 1 1 77 77 GLU HG2 H 1 2.408 0.000 . 2 . . . . 77 GLU HG2 . 15210 1 983 . 1 1 77 77 GLU HG3 H 1 2.308 0.000 . 2 . . . . 77 GLU HG3 . 15210 1 984 . 1 1 77 77 GLU C C 13 181.021 0.000 . 1 . . . . 77 GLU C . 15210 1 985 . 1 1 77 77 GLU CA C 13 59.149 0.000 . 1 . . . . 77 GLU CA . 15210 1 986 . 1 1 77 77 GLU CB C 13 29.315 0.000 . 1 . . . . 77 GLU CB . 15210 1 987 . 1 1 77 77 GLU CG C 13 35.980 0.000 . 1 . . . . 77 GLU CG . 15210 1 988 . 1 1 77 77 GLU N N 15 119.631 0.000 . 1 . . . . 77 GLU N . 15210 1 989 . 1 1 78 78 GLU H H 1 8.610 0.000 . 1 . . . . 78 GLU H . 15210 1 990 . 1 1 78 78 GLU HA H 1 4.105 0.000 . 1 . . . . 78 GLU HA . 15210 1 991 . 1 1 78 78 GLU HB2 H 1 2.198 0.000 . 2 . . . . 78 GLU HB2 . 15210 1 992 . 1 1 78 78 GLU HB3 H 1 2.194 0.000 . 2 . . . . 78 GLU HB3 . 15210 1 993 . 1 1 78 78 GLU HG2 H 1 2.348 0.000 . 2 . . . . 78 GLU HG2 . 15210 1 994 . 1 1 78 78 GLU HG3 H 1 2.582 0.000 . 2 . . . . 78 GLU HG3 . 15210 1 995 . 1 1 78 78 GLU C C 13 178.268 0.000 . 1 . . . . 78 GLU C . 15210 1 996 . 1 1 78 78 GLU CA C 13 59.190 0.000 . 1 . . . . 78 GLU CA . 15210 1 997 . 1 1 78 78 GLU CB C 13 30.187 0.000 . 1 . . . . 78 GLU CB . 15210 1 998 . 1 1 78 78 GLU CG C 13 36.635 0.000 . 1 . . . . 78 GLU CG . 15210 1 999 . 1 1 78 78 GLU N N 15 121.211 0.000 . 1 . . . . 78 GLU N . 15210 1 1000 . 1 1 79 79 SER H H 1 7.545 0.000 . 1 . . . . 79 SER H . 15210 1 1001 . 1 1 79 79 SER HA H 1 4.596 0.000 . 1 . . . . 79 SER HA . 15210 1 1002 . 1 1 79 79 SER HB2 H 1 3.803 0.004 . 2 . . . . 79 SER HB2 . 15210 1 1003 . 1 1 79 79 SER HB3 H 1 4.132 0.003 . 2 . . . . 79 SER HB3 . 15210 1 1004 . 1 1 79 79 SER C C 13 172.891 0.000 . 1 . . . . 79 SER C . 15210 1 1005 . 1 1 79 79 SER CA C 13 58.593 0.000 . 1 . . . . 79 SER CA . 15210 1 1006 . 1 1 79 79 SER CB C 13 64.050 0.000 . 1 . . . . 79 SER CB . 15210 1 1007 . 1 1 79 79 SER N N 15 111.066 0.000 . 1 . . . . 79 SER N . 15210 1 1008 . 1 1 80 80 ASN H H 1 8.170 0.003 . 1 . . . . 80 ASN H . 15210 1 1009 . 1 1 80 80 ASN HA H 1 4.728 0.015 . 1 . . . . 80 ASN HA . 15210 1 1010 . 1 1 80 80 ASN HB2 H 1 2.834 0.000 . 2 . . . . 80 ASN HB2 . 15210 1 1011 . 1 1 80 80 ASN HB3 H 1 3.208 0.003 . 2 . . . . 80 ASN HB3 . 15210 1 1012 . 1 1 80 80 ASN HD21 H 1 7.568 0.003 . 2 . . . . 80 ASN HD21 . 15210 1 1013 . 1 1 80 80 ASN HD22 H 1 6.884 0.000 . 2 . . . . 80 ASN HD22 . 15210 1 1014 . 1 1 80 80 ASN C C 13 176.130 0.000 . 1 . . . . 80 ASN C . 15210 1 1015 . 1 1 80 80 ASN CA C 13 54.290 0.000 . 1 . . . . 80 ASN CA . 15210 1 1016 . 1 1 80 80 ASN CB C 13 36.981 0.000 . 1 . . . . 80 ASN CB . 15210 1 1017 . 1 1 80 80 ASN N N 15 117.297 0.000 . 1 . . . . 80 ASN N . 15210 1 1018 . 1 1 80 80 ASN ND2 N 15 112.368 0.000 . 1 . . . . 80 ASN ND2 . 15210 1 1019 . 1 1 81 81 LEU H H 1 8.582 0.003 . 1 . . . . 81 LEU H . 15210 1 1020 . 1 1 81 81 LEU HA H 1 4.782 0.000 . 1 . . . . 81 LEU HA . 15210 1 1021 . 1 1 81 81 LEU HB2 H 1 1.672 0.006 . 2 . . . . 81 LEU HB2 . 15210 1 1022 . 1 1 81 81 LEU HB3 H 1 1.539 0.005 . 2 . . . . 81 LEU HB3 . 15210 1 1023 . 1 1 81 81 LEU HD11 H 1 0.605 0.005 . 2 . . . . 81 LEU QD1 . 15210 1 1024 . 1 1 81 81 LEU HD12 H 1 0.605 0.005 . 2 . . . . 81 LEU QD1 . 15210 1 1025 . 1 1 81 81 LEU HD13 H 1 0.605 0.005 . 2 . . . . 81 LEU QD1 . 15210 1 1026 . 1 1 81 81 LEU HD21 H 1 0.719 0.005 . 2 . . . . 81 LEU QD2 . 15210 1 1027 . 1 1 81 81 LEU HD22 H 1 0.719 0.005 . 2 . . . . 81 LEU QD2 . 15210 1 1028 . 1 1 81 81 LEU HD23 H 1 0.719 0.005 . 2 . . . . 81 LEU QD2 . 15210 1 1029 . 1 1 81 81 LEU HG H 1 1.531 0.000 . 1 . . . . 81 LEU HG . 15210 1 1030 . 1 1 81 81 LEU C C 13 176.989 0.000 . 1 . . . . 81 LEU C . 15210 1 1031 . 1 1 81 81 LEU CA C 13 54.201 0.000 . 1 . . . . 81 LEU CA . 15210 1 1032 . 1 1 81 81 LEU CB C 13 45.284 0.000 . 1 . . . . 81 LEU CB . 15210 1 1033 . 1 1 81 81 LEU CD1 C 13 22.567 0.000 . 1 . . . . 81 LEU CD1 . 15210 1 1034 . 1 1 81 81 LEU CD2 C 13 25.881 0.000 . 1 . . . . 81 LEU CD2 . 15210 1 1035 . 1 1 81 81 LEU CG C 13 26.042 0.000 . 1 . . . . 81 LEU CG . 15210 1 1036 . 1 1 81 81 LEU N N 15 115.114 0.000 . 1 . . . . 81 LEU N . 15210 1 1037 . 1 1 82 82 THR H H 1 7.895 0.000 . 1 . . . . 82 THR H . 15210 1 1038 . 1 1 82 82 THR HA H 1 4.126 0.000 . 1 . . . . 82 THR HA . 15210 1 1039 . 1 1 82 82 THR HB H 1 3.444 0.004 . 1 . . . . 82 THR HB . 15210 1 1040 . 1 1 82 82 THR HG21 H 1 1.192 0.003 . 1 . . . . 82 THR QG2 . 15210 1 1041 . 1 1 82 82 THR HG22 H 1 1.192 0.003 . 1 . . . . 82 THR QG2 . 15210 1 1042 . 1 1 82 82 THR HG23 H 1 1.192 0.003 . 1 . . . . 82 THR QG2 . 15210 1 1043 . 1 1 82 82 THR C C 13 175.499 0.000 . 1 . . . . 82 THR C . 15210 1 1044 . 1 1 82 82 THR CA C 13 67.800 0.000 . 1 . . . . 82 THR CA . 15210 1 1045 . 1 1 82 82 THR CB C 13 68.585 0.000 . 1 . . . . 82 THR CB . 15210 1 1046 . 1 1 82 82 THR CG2 C 13 22.766 0.000 . 1 . . . . 82 THR CG2 . 15210 1 1047 . 1 1 82 82 THR N N 15 118.410 0.000 . 1 . . . . 82 THR N . 15210 1 1048 . 1 1 83 83 GLU H H 1 8.385 0.000 . 1 . . . . 83 GLU H . 15210 1 1049 . 1 1 83 83 GLU HA H 1 3.904 0.000 . 1 . . . . 83 GLU HA . 15210 1 1050 . 1 1 83 83 GLU HB2 H 1 2.054 0.000 . 2 . . . . 83 GLU HB2 . 15210 1 1051 . 1 1 83 83 GLU HB3 H 1 2.056 0.000 . 2 . . . . 83 GLU HB3 . 15210 1 1052 . 1 1 83 83 GLU HG2 H 1 2.333 0.000 . 2 . . . . 83 GLU HG2 . 15210 1 1053 . 1 1 83 83 GLU HG3 H 1 2.332 0.000 . 2 . . . . 83 GLU HG3 . 15210 1 1054 . 1 1 83 83 GLU C C 13 179.742 0.000 . 1 . . . . 83 GLU C . 15210 1 1055 . 1 1 83 83 GLU CA C 13 59.903 0.000 . 1 . . . . 83 GLU CA . 15210 1 1056 . 1 1 83 83 GLU CB C 13 28.238 0.000 . 1 . . . . 83 GLU CB . 15210 1 1057 . 1 1 83 83 GLU CG C 13 36.644 0.000 . 1 . . . . 83 GLU CG . 15210 1 1058 . 1 1 83 83 GLU N N 15 118.292 0.000 . 1 . . . . 83 GLU N . 15210 1 1059 . 1 1 84 84 TYR H H 1 8.101 0.000 . 1 . . . . 84 TYR H . 15210 1 1060 . 1 1 84 84 TYR HA H 1 4.145 0.000 . 1 . . . . 84 TYR HA . 15210 1 1061 . 1 1 84 84 TYR HB2 H 1 3.315 0.004 . 2 . . . . 84 TYR HB2 . 15210 1 1062 . 1 1 84 84 TYR HB3 H 1 3.041 0.002 . 2 . . . . 84 TYR HB3 . 15210 1 1063 . 1 1 84 84 TYR HD1 H 1 7.074 0.003 . 1 . . . . 84 TYR HD1 . 15210 1 1064 . 1 1 84 84 TYR HD2 H 1 7.074 0.003 . 1 . . . . 84 TYR HD2 . 15210 1 1065 . 1 1 84 84 TYR HE1 H 1 6.831 0.000 . 1 . . . . 84 TYR HE1 . 15210 1 1066 . 1 1 84 84 TYR HE2 H 1 6.831 0.000 . 1 . . . . 84 TYR HE2 . 15210 1 1067 . 1 1 84 84 TYR C C 13 178.997 0.000 . 1 . . . . 84 TYR C . 15210 1 1068 . 1 1 84 84 TYR CA C 13 60.985 0.000 . 1 . . . . 84 TYR CA . 15210 1 1069 . 1 1 84 84 TYR CB C 13 37.981 0.000 . 1 . . . . 84 TYR CB . 15210 1 1070 . 1 1 84 84 TYR CD1 C 13 133.454 0.000 . 1 . . . . 84 TYR CD1 . 15210 1 1071 . 1 1 84 84 TYR CE1 C 13 118.562 0.000 . 1 . . . . 84 TYR CE1 . 15210 1 1072 . 1 1 84 84 TYR N N 15 122.098 0.000 . 1 . . . . 84 TYR N . 15210 1 1073 . 1 1 85 85 MET H H 1 8.126 0.000 . 1 . . . . 85 MET H . 15210 1 1074 . 1 1 85 85 MET HA H 1 4.266 0.000 . 1 . . . . 85 MET HA . 15210 1 1075 . 1 1 85 85 MET HB2 H 1 1.759 0.000 . 2 . . . . 85 MET HB2 . 15210 1 1076 . 1 1 85 85 MET HB3 H 1 2.323 0.000 . 2 . . . . 85 MET HB3 . 15210 1 1077 . 1 1 85 85 MET HE1 H 1 2.015 0.001 . 1 . . . . 85 MET QE . 15210 1 1078 . 1 1 85 85 MET HE2 H 1 2.015 0.001 . 1 . . . . 85 MET QE . 15210 1 1079 . 1 1 85 85 MET HE3 H 1 2.015 0.001 . 1 . . . . 85 MET QE . 15210 1 1080 . 1 1 85 85 MET HG2 H 1 2.492 0.000 . 2 . . . . 85 MET HG2 . 15210 1 1081 . 1 1 85 85 MET HG3 H 1 3.082 0.003 . 2 . . . . 85 MET HG3 . 15210 1 1082 . 1 1 85 85 MET C C 13 176.308 0.000 . 1 . . . . 85 MET C . 15210 1 1083 . 1 1 85 85 MET CA C 13 55.446 0.000 . 1 . . . . 85 MET CA . 15210 1 1084 . 1 1 85 85 MET CB C 13 29.853 0.000 . 1 . . . . 85 MET CB . 15210 1 1085 . 1 1 85 85 MET CE C 13 17.500 0.000 . 1 . . . . 85 MET CE . 15210 1 1086 . 1 1 85 85 MET CG C 13 33.603 0.000 . 1 . . . . 85 MET CG . 15210 1 1087 . 1 1 85 85 MET N N 15 117.059 0.000 . 1 . . . . 85 MET N . 15210 1 1088 . 1 1 86 86 LYS H H 1 7.317 0.000 . 1 . . . . 86 LYS H . 15210 1 1089 . 1 1 86 86 LYS HA H 1 3.940 0.000 . 1 . . . . 86 LYS HA . 15210 1 1090 . 1 1 86 86 LYS HB2 H 1 2.009 0.000 . 2 . . . . 86 LYS HB2 . 15210 1 1091 . 1 1 86 86 LYS HB3 H 1 1.791 0.001 . 2 . . . . 86 LYS HB3 . 15210 1 1092 . 1 1 86 86 LYS HD2 H 1 1.688 0.001 . 2 . . . . 86 LYS HD2 . 15210 1 1093 . 1 1 86 86 LYS HD3 H 1 1.690 0.000 . 2 . . . . 86 LYS HD3 . 15210 1 1094 . 1 1 86 86 LYS HE2 H 1 3.000 0.000 . 2 . . . . 86 LYS HE2 . 15210 1 1095 . 1 1 86 86 LYS HE3 H 1 3.003 0.000 . 2 . . . . 86 LYS HE3 . 15210 1 1096 . 1 1 86 86 LYS HG2 H 1 1.471 0.002 . 2 . . . . 86 LYS HG2 . 15210 1 1097 . 1 1 86 86 LYS HG3 H 1 1.683 0.000 . 2 . . . . 86 LYS HG3 . 15210 1 1098 . 1 1 86 86 LYS C C 13 176.584 0.000 . 1 . . . . 86 LYS C . 15210 1 1099 . 1 1 86 86 LYS CA C 13 57.504 0.000 . 1 . . . . 86 LYS CA . 15210 1 1100 . 1 1 86 86 LYS CB C 13 33.219 0.000 . 1 . . . . 86 LYS CB . 15210 1 1101 . 1 1 86 86 LYS CD C 13 29.727 0.000 . 1 . . . . 86 LYS CD . 15210 1 1102 . 1 1 86 86 LYS CE C 13 41.780 0.000 . 1 . . . . 86 LYS CE . 15210 1 1103 . 1 1 86 86 LYS CG C 13 25.923 0.000 . 1 . . . . 86 LYS CG . 15210 1 1104 . 1 1 86 86 LYS N N 15 115.087 0.000 . 1 . . . . 86 LYS N . 15210 1 1105 . 1 1 87 87 GLU H H 1 7.049 0.000 . 1 . . . . 87 GLU H . 15210 1 1106 . 1 1 87 87 GLU HA H 1 4.188 0.000 . 1 . . . . 87 GLU HA . 15210 1 1107 . 1 1 87 87 GLU HB2 H 1 1.783 0.000 . 2 . . . . 87 GLU HB2 . 15210 1 1108 . 1 1 87 87 GLU HB3 H 1 1.798 0.000 . 2 . . . . 87 GLU HB3 . 15210 1 1109 . 1 1 87 87 GLU HG2 H 1 2.356 0.003 . 2 . . . . 87 GLU HG2 . 15210 1 1110 . 1 1 87 87 GLU HG3 H 1 2.107 0.000 . 2 . . . . 87 GLU HG3 . 15210 1 1111 . 1 1 87 87 GLU C C 13 175.952 0.000 . 1 . . . . 87 GLU C . 15210 1 1112 . 1 1 87 87 GLU CA C 13 56.032 0.000 . 1 . . . . 87 GLU CA . 15210 1 1113 . 1 1 87 87 GLU CB C 13 29.880 0.000 . 1 . . . . 87 GLU CB . 15210 1 1114 . 1 1 87 87 GLU CG C 13 35.811 0.000 . 1 . . . . 87 GLU CG . 15210 1 1115 . 1 1 87 87 GLU N N 15 119.689 0.000 . 1 . . . . 87 GLU N . 15210 1 1116 . 1 1 88 88 LYS H H 1 8.538 0.000 . 1 . . . . 88 LYS H . 15210 1 1117 . 1 1 88 88 LYS HA H 1 4.589 0.000 . 1 . . . . 88 LYS HA . 15210 1 1118 . 1 1 88 88 LYS HB2 H 1 1.686 0.000 . 2 . . . . 88 LYS HB2 . 15210 1 1119 . 1 1 88 88 LYS HB3 H 1 1.685 0.000 . 2 . . . . 88 LYS HB3 . 15210 1 1120 . 1 1 88 88 LYS HD2 H 1 1.651 0.000 . 2 . . . . 88 LYS HD2 . 15210 1 1121 . 1 1 88 88 LYS HD3 H 1 1.651 0.000 . 2 . . . . 88 LYS HD3 . 15210 1 1122 . 1 1 88 88 LYS HE2 H 1 3.020 0.000 . 2 . . . . 88 LYS HE2 . 15210 1 1123 . 1 1 88 88 LYS HE3 H 1 3.020 0.000 . 2 . . . . 88 LYS HE3 . 15210 1 1124 . 1 1 88 88 LYS HG2 H 1 1.410 0.000 . 2 . . . . 88 LYS HG2 . 15210 1 1125 . 1 1 88 88 LYS HG3 H 1 1.476 0.000 . 2 . . . . 88 LYS HG3 . 15210 1 1126 . 1 1 88 88 LYS C C 13 176.794 0.000 . 1 . . . . 88 LYS C . 15210 1 1127 . 1 1 88 88 LYS CA C 13 55.492 0.000 . 1 . . . . 88 LYS CA . 15210 1 1128 . 1 1 88 88 LYS CB C 13 33.733 0.000 . 1 . . . . 88 LYS CB . 15210 1 1129 . 1 1 88 88 LYS CD C 13 29.023 0.000 . 1 . . . . 88 LYS CD . 15210 1 1130 . 1 1 88 88 LYS CE C 13 41.780 0.000 . 1 . . . . 88 LYS CE . 15210 1 1131 . 1 1 88 88 LYS CG C 13 25.232 0.000 . 1 . . . . 88 LYS CG . 15210 1 1132 . 1 1 88 88 LYS N N 15 127.877 0.000 . 1 . . . . 88 LYS N . 15210 1 1133 . 1 1 89 89 ILE H H 1 8.837 0.000 . 1 . . . . 89 ILE H . 15210 1 1134 . 1 1 89 89 ILE HA H 1 4.265 0.000 . 1 . . . . 89 ILE HA . 15210 1 1135 . 1 1 89 89 ILE HB H 1 1.849 0.001 . 1 . . . . 89 ILE HB . 15210 1 1136 . 1 1 89 89 ILE HD11 H 1 0.773 0.000 . 1 . . . . 89 ILE QD1 . 15210 1 1137 . 1 1 89 89 ILE HD12 H 1 0.773 0.000 . 1 . . . . 89 ILE QD1 . 15210 1 1138 . 1 1 89 89 ILE HD13 H 1 0.773 0.000 . 1 . . . . 89 ILE QD1 . 15210 1 1139 . 1 1 89 89 ILE HG12 H 1 1.385 0.000 . 2 . . . . 89 ILE HG12 . 15210 1 1140 . 1 1 89 89 ILE HG13 H 1 1.240 0.000 . 2 . . . . 89 ILE HG13 . 15210 1 1141 . 1 1 89 89 ILE HG21 H 1 0.884 0.000 . 1 . . . . 89 ILE QG2 . 15210 1 1142 . 1 1 89 89 ILE HG22 H 1 0.884 0.000 . 1 . . . . 89 ILE QG2 . 15210 1 1143 . 1 1 89 89 ILE HG23 H 1 0.884 0.000 . 1 . . . . 89 ILE QG2 . 15210 1 1144 . 1 1 89 89 ILE C C 13 175.644 0.000 . 1 . . . . 89 ILE C . 15210 1 1145 . 1 1 89 89 ILE CA C 13 59.237 0.000 . 1 . . . . 89 ILE CA . 15210 1 1146 . 1 1 89 89 ILE CB C 13 38.574 0.000 . 1 . . . . 89 ILE CB . 15210 1 1147 . 1 1 89 89 ILE CD1 C 13 11.732 0.000 . 1 . . . . 89 ILE CD1 . 15210 1 1148 . 1 1 89 89 ILE CG1 C 13 27.340 0.000 . 1 . . . . 89 ILE CG1 . 15210 1 1149 . 1 1 89 89 ILE CG2 C 13 17.360 0.000 . 1 . . . . 89 ILE CG2 . 15210 1 1150 . 1 1 89 89 ILE N N 15 123.506 0.000 . 1 . . . . 89 ILE N . 15210 1 1151 . 1 1 90 90 LYS H H 1 8.434 0.000 . 1 . . . . 90 LYS H . 15210 1 1152 . 1 1 90 90 LYS HA H 1 4.299 0.000 . 1 . . . . 90 LYS HA . 15210 1 1153 . 1 1 90 90 LYS HB2 H 1 1.778 0.000 . 2 . . . . 90 LYS HB2 . 15210 1 1154 . 1 1 90 90 LYS HB3 H 1 1.779 0.000 . 2 . . . . 90 LYS HB3 . 15210 1 1155 . 1 1 90 90 LYS HD2 H 1 1.696 0.000 . 2 . . . . 90 LYS HD2 . 15210 1 1156 . 1 1 90 90 LYS HD3 H 1 1.695 0.000 . 2 . . . . 90 LYS HD3 . 15210 1 1157 . 1 1 90 90 LYS HE2 H 1 2.999 0.000 . 2 . . . . 90 LYS HE2 . 15210 1 1158 . 1 1 90 90 LYS HE3 H 1 3.005 0.000 . 2 . . . . 90 LYS HE3 . 15210 1 1159 . 1 1 90 90 LYS HG2 H 1 1.447 0.000 . 2 . . . . 90 LYS HG2 . 15210 1 1160 . 1 1 90 90 LYS HG3 H 1 1.366 0.000 . 2 . . . . 90 LYS HG3 . 15210 1 1161 . 1 1 90 90 LYS C C 13 175.936 0.000 . 1 . . . . 90 LYS C . 15210 1 1162 . 1 1 90 90 LYS CA C 13 56.012 0.000 . 1 . . . . 90 LYS CA . 15210 1 1163 . 1 1 90 90 LYS CB C 13 32.148 0.000 . 1 . . . . 90 LYS CB . 15210 1 1164 . 1 1 90 90 LYS CD C 13 29.017 0.000 . 1 . . . . 90 LYS CD . 15210 1 1165 . 1 1 90 90 LYS CE C 13 42.005 0.000 . 1 . . . . 90 LYS CE . 15210 1 1166 . 1 1 90 90 LYS CG C 13 24.840 0.000 . 1 . . . . 90 LYS CG . 15210 1 1167 . 1 1 90 90 LYS N N 15 126.249 0.000 . 1 . . . . 90 LYS N . 15210 1 1168 . 1 1 91 91 ILE H H 1 8.204 0.000 . 1 . . . . 91 ILE H . 15210 1 1169 . 1 1 91 91 ILE HA H 1 4.166 0.000 . 1 . . . . 91 ILE HA . 15210 1 1170 . 1 1 91 91 ILE HB H 1 1.859 0.001 . 1 . . . . 91 ILE HB . 15210 1 1171 . 1 1 91 91 ILE HD11 H 1 0.797 0.000 . 1 . . . . 91 ILE QD1 . 15210 1 1172 . 1 1 91 91 ILE HD12 H 1 0.797 0.000 . 1 . . . . 91 ILE QD1 . 15210 1 1173 . 1 1 91 91 ILE HD13 H 1 0.797 0.000 . 1 . . . . 91 ILE QD1 . 15210 1 1174 . 1 1 91 91 ILE HG12 H 1 1.336 0.000 . 2 . . . . 91 ILE HG12 . 15210 1 1175 . 1 1 91 91 ILE HG13 H 1 1.320 0.000 . 2 . . . . 91 ILE HG13 . 15210 1 1176 . 1 1 91 91 ILE HG21 H 1 0.894 0.000 . 1 . . . . 91 ILE QG2 . 15210 1 1177 . 1 1 91 91 ILE HG22 H 1 0.894 0.000 . 1 . . . . 91 ILE QG2 . 15210 1 1178 . 1 1 91 91 ILE HG23 H 1 0.894 0.000 . 1 . . . . 91 ILE QG2 . 15210 1 1179 . 1 1 91 91 ILE C C 13 175.920 0.000 . 1 . . . . 91 ILE C . 15210 1 1180 . 1 1 91 91 ILE CA C 13 59.834 0.000 . 1 . . . . 91 ILE CA . 15210 1 1181 . 1 1 91 91 ILE CB C 13 38.121 0.000 . 1 . . . . 91 ILE CB . 15210 1 1182 . 1 1 91 91 ILE CD1 C 13 11.971 0.000 . 1 . . . . 91 ILE CD1 . 15210 1 1183 . 1 1 91 91 ILE CG1 C 13 27.045 0.000 . 1 . . . . 91 ILE CG1 . 15210 1 1184 . 1 1 91 91 ILE CG2 C 13 17.445 0.000 . 1 . . . . 91 ILE CG2 . 15210 1 1185 . 1 1 91 91 ILE N N 15 125.179 0.000 . 1 . . . . 91 ILE N . 15210 1 1186 . 1 1 92 92 ARG H H 1 8.528 0.000 . 1 . . . . 92 ARG H . 15210 1 1187 . 1 1 92 92 ARG HA H 1 4.344 0.000 . 1 . . . . 92 ARG HA . 15210 1 1188 . 1 1 92 92 ARG HB2 H 1 1.764 0.000 . 2 . . . . 92 ARG HB2 . 15210 1 1189 . 1 1 92 92 ARG HB3 H 1 1.836 0.000 . 2 . . . . 92 ARG HB3 . 15210 1 1190 . 1 1 92 92 ARG HD2 H 1 3.211 0.000 . 2 . . . . 92 ARG HD2 . 15210 1 1191 . 1 1 92 92 ARG HD3 H 1 3.211 0.000 . 2 . . . . 92 ARG HD3 . 15210 1 1192 . 1 1 92 92 ARG HG2 H 1 1.639 0.000 . 2 . . . . 92 ARG HG2 . 15210 1 1193 . 1 1 92 92 ARG HG3 H 1 1.584 0.000 . 2 . . . . 92 ARG HG3 . 15210 1 1194 . 1 1 92 92 ARG C C 13 175.742 0.000 . 1 . . . . 92 ARG C . 15210 1 1195 . 1 1 92 92 ARG CA C 13 55.784 0.000 . 1 . . . . 92 ARG CA . 15210 1 1196 . 1 1 92 92 ARG CB C 13 30.616 0.000 . 1 . . . . 92 ARG CB . 15210 1 1197 . 1 1 92 92 ARG CD C 13 43.346 0.000 . 1 . . . . 92 ARG CD . 15210 1 1198 . 1 1 92 92 ARG CG C 13 27.310 0.000 . 1 . . . . 92 ARG CG . 15210 1 1199 . 1 1 92 92 ARG N N 15 126.147 0.000 . 1 . . . . 92 ARG N . 15210 1 1200 . 1 1 93 93 MET H H 1 8.453 0.000 . 1 . . . . 93 MET H . 15210 1 1201 . 1 1 93 93 MET HA H 1 4.822 0.000 . 1 . . . . 93 MET HA . 15210 1 1202 . 1 1 93 93 MET HB2 H 1 2.109 0.000 . 2 . . . . 93 MET HB2 . 15210 1 1203 . 1 1 93 93 MET HB3 H 1 1.974 0.000 . 2 . . . . 93 MET HB3 . 15210 1 1204 . 1 1 93 93 MET HG2 H 1 2.685 0.000 . 2 . . . . 93 MET HG2 . 15210 1 1205 . 1 1 93 93 MET HG3 H 1 2.571 0.000 . 2 . . . . 93 MET HG3 . 15210 1 1206 . 1 1 93 93 MET CA C 13 53.181 0.000 . 1 . . . . 93 MET CA . 15210 1 1207 . 1 1 93 93 MET CB C 13 32.300 0.000 . 1 . . . . 93 MET CB . 15210 1 1208 . 1 1 93 93 MET CG C 13 32.070 0.000 . 1 . . . . 93 MET CG . 15210 1 1209 . 1 1 93 93 MET N N 15 123.756 0.000 . 1 . . . . 93 MET N . 15210 1 1210 . 1 1 94 94 PRO HA H 1 4.503 0.000 . 1 . . . . 94 PRO HA . 15210 1 1211 . 1 1 94 94 PRO HB2 H 1 2.326 0.000 . 2 . . . . 94 PRO HB2 . 15210 1 1212 . 1 1 94 94 PRO HB3 H 1 1.942 0.000 . 2 . . . . 94 PRO HB3 . 15210 1 1213 . 1 1 94 94 PRO HD2 H 1 3.847 0.000 . 2 . . . . 94 PRO HD2 . 15210 1 1214 . 1 1 94 94 PRO HD3 H 1 3.728 0.000 . 2 . . . . 94 PRO HD3 . 15210 1 1215 . 1 1 94 94 PRO HG2 H 1 2.049 0.000 . 2 . . . . 94 PRO HG2 . 15210 1 1216 . 1 1 94 94 PRO HG3 H 1 2.050 0.000 . 2 . . . . 94 PRO HG3 . 15210 1 1217 . 1 1 94 94 PRO C C 13 176.989 0.000 . 1 . . . . 94 PRO C . 15210 1 1218 . 1 1 94 94 PRO CA C 13 63.098 0.000 . 1 . . . . 94 PRO CA . 15210 1 1219 . 1 1 94 94 PRO CB C 13 32.076 0.000 . 1 . . . . 94 PRO CB . 15210 1 1220 . 1 1 94 94 PRO CD C 13 50.682 0.000 . 1 . . . . 94 PRO CD . 15210 1 1221 . 1 1 94 94 PRO CG C 13 27.336 0.000 . 1 . . . . 94 PRO CG . 15210 1 1222 . 1 1 95 95 THR H H 1 8.272 0.000 . 1 . . . . 95 THR H . 15210 1 1223 . 1 1 95 95 THR HA H 1 4.331 0.000 . 1 . . . . 95 THR HA . 15210 1 1224 . 1 1 95 95 THR HB H 1 4.218 0.000 . 1 . . . . 95 THR HB . 15210 1 1225 . 1 1 95 95 THR HG21 H 1 1.240 0.000 . 1 . . . . 95 THR QG2 . 15210 1 1226 . 1 1 95 95 THR HG22 H 1 1.240 0.000 . 1 . . . . 95 THR QG2 . 15210 1 1227 . 1 1 95 95 THR HG23 H 1 1.240 0.000 . 1 . . . . 95 THR QG2 . 15210 1 1228 . 1 1 95 95 THR C C 13 174.656 0.000 . 1 . . . . 95 THR C . 15210 1 1229 . 1 1 95 95 THR CA C 13 61.699 0.000 . 1 . . . . 95 THR CA . 15210 1 1230 . 1 1 95 95 THR CB C 13 69.656 0.000 . 1 . . . . 95 THR CB . 15210 1 1231 . 1 1 95 95 THR CG2 C 13 21.723 0.000 . 1 . . . . 95 THR CG2 . 15210 1 1232 . 1 1 95 95 THR N N 15 114.835 0.000 . 1 . . . . 95 THR N . 15210 1 1233 . 1 1 96 96 LEU H H 1 8.342 0.000 . 1 . . . . 96 LEU H . 15210 1 1234 . 1 1 96 96 LEU HA H 1 4.421 0.000 . 1 . . . . 96 LEU HA . 15210 1 1235 . 1 1 96 96 LEU HB2 H 1 1.713 0.000 . 2 . . . . 96 LEU HB2 . 15210 1 1236 . 1 1 96 96 LEU HB3 H 1 1.650 0.000 . 2 . . . . 96 LEU HB3 . 15210 1 1237 . 1 1 96 96 LEU HD11 H 1 0.961 0.000 . 2 . . . . 96 LEU QD1 . 15210 1 1238 . 1 1 96 96 LEU HD12 H 1 0.961 0.000 . 2 . . . . 96 LEU QD1 . 15210 1 1239 . 1 1 96 96 LEU HD13 H 1 0.961 0.000 . 2 . . . . 96 LEU QD1 . 15210 1 1240 . 1 1 96 96 LEU HD21 H 1 0.932 0.006 . 2 . . . . 96 LEU QD2 . 15210 1 1241 . 1 1 96 96 LEU HD22 H 1 0.932 0.006 . 2 . . . . 96 LEU QD2 . 15210 1 1242 . 1 1 96 96 LEU HD23 H 1 0.932 0.006 . 2 . . . . 96 LEU QD2 . 15210 1 1243 . 1 1 96 96 LEU HG H 1 1.623 0.000 . 1 . . . . 96 LEU HG . 15210 1 1244 . 1 1 96 96 LEU CA C 13 55.290 0.000 . 1 . . . . 96 LEU CA . 15210 1 1245 . 1 1 96 96 LEU CB C 13 42.304 0.000 . 1 . . . . 96 LEU CB . 15210 1 1246 . 1 1 96 96 LEU CD1 C 13 24.730 0.000 . 1 . . . . 96 LEU CD1 . 15210 1 1247 . 1 1 96 96 LEU CD2 C 13 23.366 0.000 . 1 . . . . 96 LEU CD2 . 15210 1 1248 . 1 1 96 96 LEU CG C 13 26.770 0.000 . 1 . . . . 96 LEU CG . 15210 1 1249 . 1 1 96 96 LEU N N 15 125.057 0.000 . 1 . . . . 96 LEU N . 15210 1 stop_ save_