data_26783 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 26783 _Entry.Title ; APC11 binding Ubiquitin Variant ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2016-04-21 _Entry.Accession_date 2016-04-21 _Entry.Last_release_date 2016-04-22 _Entry.Original_release_date 2016-04-22 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.0.16 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details 'Ubiquitin Variant' _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.ORCID _Entry_author.Entry_ID 1 Nicholas Brown . G. . . 26783 2 Christy Grace . R. . . 26783 3 Brenda Schulman . A. . . 26783 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 26783 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 231 26783 '15N chemical shifts' 75 26783 '1H chemical shifts' 75 26783 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2018-06-19 . original BMRB . 26783 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 26784 UBv-APC11 26783 BMRB 26785 APC11-UBv 26783 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 26783 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI 10.1016/j.cell.2016.05.037 _Citation.PubMed_ID 27259151 _Citation.Full_citation . _Citation.Title ; Dual RING E3 Architectures Regulate Multiubiquitination and Ubiquitin Chain Elongation by APC/C. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Cell _Citation.Journal_name_full Cell _Citation.Journal_volume 165 _Citation.Journal_issue 6 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1097-4172 _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 1440 _Citation.Page_last 1453 _Citation.Year 2016 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Nicholas Brown N. G. . . 26783 1 2 Ryan VanderLinden R. . . . 26783 1 3 Edmond Watson E. R. . . 26783 1 4 Florian Weissmann F. . . . 26783 1 5 Alban Ordureau A. . . . 26783 1 6 Kuen-Phon Wu K. P. . . 26783 1 7 Wei Zhang W. . . . 26783 1 8 Shanshan Yu S. . . . 26783 1 9 Peter Mercredi P. Y. . . 26783 1 10 Joseph Harrison J. S. . . 26783 1 11 Iain Davidson I. F. . . 26783 1 12 Renping Qiao R. . . . 26783 1 13 Ying Lu Y. . . . 26783 1 14 Prakash Dube P. . . . 26783 1 15 Michael Brunner M. R. . . 26783 1 16 Christy Grace . . . . 26783 1 17 Darcie Miller D. J. . . 26783 1 18 David Haselbach D. . . . 26783 1 19 Marc Jarvis M. A. . . 26783 1 20 Masaya Yamaguchi M. . . . 26783 1 21 David Yanishevski D. . . . 26783 1 22 Georg Petzold G. . . . 26783 1 23 Sachdev Sidhu S. S. . . 26783 1 24 Brian Kuhlman B. . . . 26783 1 25 Marc Kirschner M. W. . . 26783 1 26 'J Wade' Harper J. W. . . 26783 1 27 Jan-Michael Peters J. M. . . 26783 1 28 Holger Stark H. . . . 26783 1 29 Brenda Schulman B. A. . . 26783 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID APC/C 26783 1 RING 26783 1 Ubiquitination 26783 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 26783 _Assembly.ID 1 _Assembly.Name UBv _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 UBv 1 $UBv A . yes native no no . . . 26783 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_UBv _Entity.Sf_category entity _Entity.Sf_framecode UBv _Entity.Entry_ID 26783 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name UBv _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 ; GSGGSGMQILVKTPRGKTIT LEVEPSDTIENVKAKIQDKE GIPPDQQILFFAVKRLEDGR TLSDYNIQKKSSLLLAMRVP GKMK ; _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 84 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 -5 GLY . 26783 1 2 -4 SER . 26783 1 3 -3 GLY . 26783 1 4 -2 GLY . 26783 1 5 -1 SER . 26783 1 6 0 GLY . 26783 1 7 1 MET . 26783 1 8 2 GLN . 26783 1 9 3 ILE . 26783 1 10 4 LEU . 26783 1 11 5 VAL . 26783 1 12 6 LYS . 26783 1 13 7 THR . 26783 1 14 8 PRO . 26783 1 15 9 ARG . 26783 1 16 10 GLY . 26783 1 17 11 LYS . 26783 1 18 12 THR . 26783 1 19 13 ILE . 26783 1 20 14 THR . 26783 1 21 15 LEU . 26783 1 22 16 GLU . 26783 1 23 17 VAL . 26783 1 24 18 GLU . 26783 1 25 19 PRO . 26783 1 26 20 SER . 26783 1 27 21 ASP . 26783 1 28 22 THR . 26783 1 29 23 ILE . 26783 1 30 24 GLU . 26783 1 31 25 ASN . 26783 1 32 26 VAL . 26783 1 33 27 LYS . 26783 1 34 28 ALA . 26783 1 35 29 LYS . 26783 1 36 30 ILE . 26783 1 37 31 GLN . 26783 1 38 32 ASP . 26783 1 39 33 LYS . 26783 1 40 34 GLU . 26783 1 41 35 GLY . 26783 1 42 36 ILE . 26783 1 43 37 PRO . 26783 1 44 38 PRO . 26783 1 45 39 ASP . 26783 1 46 40 GLN . 26783 1 47 41 GLN . 26783 1 48 42 ILE . 26783 1 49 43 LEU . 26783 1 50 44 PHE . 26783 1 51 45 PHE . 26783 1 52 46 ALA . 26783 1 53 47 VAL . 26783 1 54 48 LYS . 26783 1 55 49 ARG . 26783 1 56 50 LEU . 26783 1 57 51 GLU . 26783 1 58 52 ASP . 26783 1 59 53 GLY . 26783 1 60 54 ARG . 26783 1 61 55 THR . 26783 1 62 56 LEU . 26783 1 63 57 SER . 26783 1 64 58 ASP . 26783 1 65 59 TYR . 26783 1 66 60 ASN . 26783 1 67 61 ILE . 26783 1 68 62 GLN . 26783 1 69 63 LYS . 26783 1 70 64 LYS . 26783 1 71 65 SER . 26783 1 72 66 SER . 26783 1 73 67 LEU . 26783 1 74 68 LEU . 26783 1 75 69 LEU . 26783 1 76 70 ALA . 26783 1 77 71 MET . 26783 1 78 72 ARG . 26783 1 79 73 VAL . 26783 1 80 74 PRO . 26783 1 81 75 GLY . 26783 1 82 76 LYS . 26783 1 83 77 MET . 26783 1 84 78 LYS . 26783 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 . GLY 1 1 26783 1 . SER 2 2 26783 1 . GLY 3 3 26783 1 . GLY 4 4 26783 1 . SER 5 5 26783 1 . GLY 6 6 26783 1 . MET 7 7 26783 1 . GLN 8 8 26783 1 . ILE 9 9 26783 1 . LEU 10 10 26783 1 . VAL 11 11 26783 1 . LYS 12 12 26783 1 . THR 13 13 26783 1 . PRO 14 14 26783 1 . ARG 15 15 26783 1 . GLY 16 16 26783 1 . LYS 17 17 26783 1 . THR 18 18 26783 1 . ILE 19 19 26783 1 . THR 20 20 26783 1 . LEU 21 21 26783 1 . GLU 22 22 26783 1 . VAL 23 23 26783 1 . GLU 24 24 26783 1 . PRO 25 25 26783 1 . SER 26 26 26783 1 . ASP 27 27 26783 1 . THR 28 28 26783 1 . ILE 29 29 26783 1 . GLU 30 30 26783 1 . ASN 31 31 26783 1 . VAL 32 32 26783 1 . LYS 33 33 26783 1 . ALA 34 34 26783 1 . LYS 35 35 26783 1 . ILE 36 36 26783 1 . GLN 37 37 26783 1 . ASP 38 38 26783 1 . LYS 39 39 26783 1 . GLU 40 40 26783 1 . GLY 41 41 26783 1 . ILE 42 42 26783 1 . PRO 43 43 26783 1 . PRO 44 44 26783 1 . ASP 45 45 26783 1 . GLN 46 46 26783 1 . GLN 47 47 26783 1 . ILE 48 48 26783 1 . LEU 49 49 26783 1 . PHE 50 50 26783 1 . PHE 51 51 26783 1 . ALA 52 52 26783 1 . VAL 53 53 26783 1 . LYS 54 54 26783 1 . ARG 55 55 26783 1 . LEU 56 56 26783 1 . GLU 57 57 26783 1 . ASP 58 58 26783 1 . GLY 59 59 26783 1 . ARG 60 60 26783 1 . THR 61 61 26783 1 . LEU 62 62 26783 1 . SER 63 63 26783 1 . ASP 64 64 26783 1 . TYR 65 65 26783 1 . ASN 66 66 26783 1 . ILE 67 67 26783 1 . GLN 68 68 26783 1 . LYS 69 69 26783 1 . LYS 70 70 26783 1 . SER 71 71 26783 1 . SER 72 72 26783 1 . LEU 73 73 26783 1 . LEU 74 74 26783 1 . LEU 75 75 26783 1 . ALA 76 76 26783 1 . MET 77 77 26783 1 . ARG 78 78 26783 1 . VAL 79 79 26783 1 . PRO 80 80 26783 1 . GLY 81 81 26783 1 . LYS 82 82 26783 1 . MET 83 83 26783 1 . LYS 84 84 26783 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 26783 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $UBv . . 'no natural source' . . . . . . . . . . . . . . . . . . . . . . 26783 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 26783 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $UBv . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . BL21 . . 'BL21(DE3) Codon Plus (RIL)' 26783 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 26783 _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 UBv '[U-100% 13C; U-100% 15N]' . . 1 $UBv . . 1.0 . . mM . . . . 26783 1 2 H2O 'natural abundance' . . . . . . 90 . . % . . . . 26783 1 3 D2O 'natural abundance' . . . . . . 10 . . % . . . . 26783 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 26783 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 100 . mM 26783 1 pH 7.0 . pH 26783 1 pressure 1 . atm 26783 1 temperature 298 . K 26783 1 stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 26783 _Software.ID 1 _Software.Type . _Software.Name TOPSPIN _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 26783 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 26783 1 stop_ save_ save_CARA _Software.Sf_category software _Software.Sf_framecode CARA _Software.Entry_ID 26783 _Software.ID 2 _Software.Type . _Software.Name CARA _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Keller and Wuthrich' . . 26783 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 26783 2 'data analysis' 26783 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 26783 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _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 26783 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 600 . . . 26783 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 26783 _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 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26783 1 2 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26783 1 3 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26783 1 4 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26783 1 5 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26783 1 6 '3D HN(CA)CO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26783 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 26783 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 'separate tube (no insert) similar to the experimental sample tube' . . . . 26783 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 'separate tube (no insert) similar to the experimental sample tube' . . . . 26783 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 'separate tube (no insert) similar to the experimental sample tube' . . . . 26783 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 26783 _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 2 '3D HNCA' . . . 26783 1 3 '3D HNCACB' . . . 26783 1 4 '3D HNCO' . . . 26783 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 4 4 GLY H H 1 8.252 0.020 . 1 . . . . . -2 GLY H . 26783 1 2 . 1 1 4 4 GLY C C 13 174.482 0.3 . 1 . . . . . -2 GLY C . 26783 1 3 . 1 1 4 4 GLY CA C 13 45.220 0.3 . 1 . . . . . -2 GLY CA . 26783 1 4 . 1 1 4 4 GLY N N 15 108.985 0.3 . 1 . . . . . -2 GLY N . 26783 1 5 . 1 1 5 5 SER H H 1 8.559 0.020 . 1 . . . . . -1 SER H . 26783 1 6 . 1 1 5 5 SER C C 13 175.180 0.3 . 1 . . . . . -1 SER C . 26783 1 7 . 1 1 5 5 SER CA C 13 58.520 0.3 . 1 . . . . . -1 SER CA . 26783 1 8 . 1 1 5 5 SER CB C 13 64.089 0.3 . 1 . . . . . -1 SER CB . 26783 1 9 . 1 1 5 5 SER N N 15 116.196 0.3 . 1 . . . . . -1 SER N . 26783 1 10 . 1 1 6 6 GLY H H 1 8.408 0.020 . 1 . . . . . 0 GLY H . 26783 1 11 . 1 1 6 6 GLY C C 13 173.423 0.3 . 1 . . . . . 0 GLY C . 26783 1 12 . 1 1 6 6 GLY CA C 13 45.525 0.3 . 1 . . . . . 0 GLY CA . 26783 1 13 . 1 1 6 6 GLY N N 15 110.579 0.3 . 1 . . . . . 0 GLY N . 26783 1 14 . 1 1 7 7 MET H H 1 8.712 0.020 . 1 . . . . . 1 MET H . 26783 1 15 . 1 1 7 7 MET C C 13 173.265 0.3 . 1 . . . . . 1 MET C . 26783 1 16 . 1 1 7 7 MET CA C 13 55.574 0.3 . 1 . . . . . 1 MET CA . 26783 1 17 . 1 1 7 7 MET CB C 13 34.321 0.3 . 1 . . . . . 1 MET CB . 26783 1 18 . 1 1 7 7 MET N N 15 120.242 0.3 . 1 . . . . . 1 MET N . 26783 1 19 . 1 1 8 8 GLN H H 1 7.763 0.020 . 1 . . . . . 2 GLN H . 26783 1 20 . 1 1 8 8 GLN C C 13 176.239 0.3 . 1 . . . . . 2 GLN C . 26783 1 21 . 1 1 8 8 GLN CA C 13 54.248 0.3 . 1 . . . . . 2 GLN CA . 26783 1 22 . 1 1 8 8 GLN CB C 13 31.496 0.3 . 1 . . . . . 2 GLN CB . 26783 1 23 . 1 1 8 8 GLN N N 15 121.565 0.3 . 1 . . . . . 2 GLN N . 26783 1 24 . 1 1 9 9 ILE H H 1 8.527 0.020 . 1 . . . . . 3 ILE H . 26783 1 25 . 1 1 9 9 ILE C C 13 172.747 0.3 . 1 . . . . . 3 ILE C . 26783 1 26 . 1 1 9 9 ILE CA C 13 59.814 0.3 . 1 . . . . . 3 ILE CA . 26783 1 27 . 1 1 9 9 ILE CB C 13 41.692 0.3 . 1 . . . . . 3 ILE CB . 26783 1 28 . 1 1 9 9 ILE N N 15 115.062 0.3 . 1 . . . . . 3 ILE N . 26783 1 29 . 1 1 10 10 LEU H H 1 8.508 0.020 . 1 . . . . . 4 LEU H . 26783 1 30 . 1 1 10 10 LEU C C 13 176.352 0.3 . 1 . . . . . 4 LEU C . 26783 1 31 . 1 1 10 10 LEU CA C 13 53.432 0.3 . 1 . . . . . 4 LEU CA . 26783 1 32 . 1 1 10 10 LEU CB C 13 43.429 0.3 . 1 . . . . . 4 LEU CB . 26783 1 33 . 1 1 10 10 LEU N N 15 121.880 0.3 . 1 . . . . . 4 LEU N . 26783 1 34 . 1 1 11 11 VAL H H 1 9.028 0.020 . 1 . . . . . 5 VAL H . 26783 1 35 . 1 1 11 11 VAL C C 13 174.750 0.3 . 1 . . . . . 5 VAL C . 26783 1 36 . 1 1 11 11 VAL CA C 13 60.742 0.3 . 1 . . . . . 5 VAL CA . 26783 1 37 . 1 1 11 11 VAL CB C 13 34.434 0.3 . 1 . . . . . 5 VAL CB . 26783 1 38 . 1 1 11 11 VAL N N 15 120.167 0.3 . 1 . . . . . 5 VAL N . 26783 1 39 . 1 1 12 12 LYS H H 1 8.746 0.020 . 1 . . . . . 6 LYS H . 26783 1 40 . 1 1 12 12 LYS C C 13 175.969 0.3 . 1 . . . . . 6 LYS C . 26783 1 41 . 1 1 12 12 LYS CA C 13 55.347 0.3 . 1 . . . . . 6 LYS CA . 26783 1 42 . 1 1 12 12 LYS CB C 13 32.958 0.3 . 1 . . . . . 6 LYS CB . 26783 1 43 . 1 1 12 12 LYS N N 15 128.530 0.3 . 1 . . . . . 6 LYS N . 26783 1 44 . 1 1 13 13 THR H H 1 8.492 0.020 . 1 . . . . . 7 THR H . 26783 1 45 . 1 1 13 13 THR C C 13 175.338 0.3 . 1 . . . . . 7 THR C . 26783 1 46 . 1 1 13 13 THR CA C 13 60.090 0.3 . 1 . . . . . 7 THR CA . 26783 1 47 . 1 1 13 13 THR CB C 13 68.515 0.3 . 1 . . . . . 7 THR CB . 26783 1 48 . 1 1 13 13 THR N N 15 115.316 0.3 . 1 . . . . . 7 THR N . 26783 1 49 . 1 1 14 14 PRO C C 13 177.749 0.3 . 1 . . . . . 8 PRO C . 26783 1 50 . 1 1 14 14 PRO CA C 13 65.358 0.3 . 1 . . . . . 8 PRO CA . 26783 1 51 . 1 1 14 14 PRO CB C 13 31.915 0.3 . 1 . . . . . 8 PRO CB . 26783 1 52 . 1 1 15 15 ARG H H 1 7.665 0.020 . 1 . . . . . 9 ARG H . 26783 1 53 . 1 1 15 15 ARG C C 13 176.713 0.3 . 1 . . . . . 9 ARG C . 26783 1 54 . 1 1 15 15 ARG CA C 13 56.161 0.3 . 1 . . . . . 9 ARG CA . 26783 1 55 . 1 1 15 15 ARG CB C 13 29.635 0.3 . 1 . . . . . 9 ARG CB . 26783 1 56 . 1 1 15 15 ARG N N 15 113.026 0.3 . 1 . . . . . 9 ARG N . 26783 1 57 . 1 1 16 16 GLY H H 1 8.104 0.020 . 1 . . . . . 10 GLY H . 26783 1 58 . 1 1 16 16 GLY C C 13 174.032 0.3 . 1 . . . . . 10 GLY C . 26783 1 59 . 1 1 16 16 GLY CA C 13 45.360 0.3 . 1 . . . . . 10 GLY CA . 26783 1 60 . 1 1 16 16 GLY N N 15 107.903 0.3 . 1 . . . . . 10 GLY N . 26783 1 61 . 1 1 17 17 LYS H H 1 6.790 0.020 . 1 . . . . . 11 LYS H . 26783 1 62 . 1 1 17 17 LYS C C 13 176.014 0.3 . 1 . . . . . 11 LYS C . 26783 1 63 . 1 1 17 17 LYS CA C 13 55.047 0.3 . 1 . . . . . 11 LYS CA . 26783 1 64 . 1 1 17 17 LYS CB C 13 33.944 0.3 . 1 . . . . . 11 LYS CB . 26783 1 65 . 1 1 17 17 LYS N N 15 119.851 0.3 . 1 . . . . . 11 LYS N . 26783 1 66 . 1 1 18 18 THR H H 1 8.760 0.020 . 1 . . . . . 12 THR H . 26783 1 67 . 1 1 18 18 THR C C 13 174.549 0.3 . 1 . . . . . 12 THR C . 26783 1 68 . 1 1 18 18 THR CA C 13 62.222 0.3 . 1 . . . . . 12 THR CA . 26783 1 69 . 1 1 18 18 THR CB C 13 69.550 0.3 . 1 . . . . . 12 THR CB . 26783 1 70 . 1 1 18 18 THR N N 15 121.552 0.3 . 1 . . . . . 12 THR N . 26783 1 71 . 1 1 19 19 ILE H H 1 9.172 0.020 . 1 . . . . . 13 ILE H . 26783 1 72 . 1 1 19 19 ILE C C 13 174.472 0.3 . 1 . . . . . 13 ILE C . 26783 1 73 . 1 1 19 19 ILE CA C 13 59.535 0.3 . 1 . . . . . 13 ILE CA . 26783 1 74 . 1 1 19 19 ILE CB C 13 40.612 0.3 . 1 . . . . . 13 ILE CB . 26783 1 75 . 1 1 19 19 ILE N N 15 124.723 0.3 . 1 . . . . . 13 ILE N . 26783 1 76 . 1 1 20 20 THR H H 1 8.437 0.020 . 1 . . . . . 14 THR H . 26783 1 77 . 1 1 20 20 THR C C 13 173.844 0.3 . 1 . . . . . 14 THR C . 26783 1 78 . 1 1 20 20 THR CA C 13 61.566 0.3 . 1 . . . . . 14 THR CA . 26783 1 79 . 1 1 20 20 THR CB C 13 69.804 0.3 . 1 . . . . . 14 THR CB . 26783 1 80 . 1 1 20 20 THR N N 15 118.604 0.3 . 1 . . . . . 14 THR N . 26783 1 81 . 1 1 21 21 LEU H H 1 8.855 0.020 . 1 . . . . . 15 LEU H . 26783 1 82 . 1 1 21 21 LEU C C 13 175.201 0.3 . 1 . . . . . 15 LEU C . 26783 1 83 . 1 1 21 21 LEU CA C 13 52.770 0.3 . 1 . . . . . 15 LEU CA . 26783 1 84 . 1 1 21 21 LEU CB C 13 46.303 0.3 . 1 . . . . . 15 LEU CB . 26783 1 85 . 1 1 21 21 LEU N N 15 124.723 0.3 . 1 . . . . . 15 LEU N . 26783 1 86 . 1 1 22 22 GLU H H 1 8.234 0.020 . 1 . . . . . 16 GLU H . 26783 1 87 . 1 1 22 22 GLU C C 13 175.820 0.3 . 1 . . . . . 16 GLU C . 26783 1 88 . 1 1 22 22 GLU CA C 13 55.801 0.3 . 1 . . . . . 16 GLU CA . 26783 1 89 . 1 1 22 22 GLU CB C 13 29.435 0.3 . 1 . . . . . 16 GLU CB . 26783 1 90 . 1 1 22 22 GLU N N 15 122.787 0.3 . 1 . . . . . 16 GLU N . 26783 1 91 . 1 1 23 23 VAL H H 1 8.434 0.020 . 1 . . . . . 17 VAL H . 26783 1 92 . 1 1 23 23 VAL C C 13 173.632 0.3 . 1 . . . . . 17 VAL C . 26783 1 93 . 1 1 23 23 VAL CA C 13 58.651 0.3 . 1 . . . . . 17 VAL CA . 26783 1 94 . 1 1 23 23 VAL CB C 13 36.360 0.3 . 1 . . . . . 17 VAL CB . 26783 1 95 . 1 1 23 23 VAL N N 15 116.389 0.3 . 1 . . . . . 17 VAL N . 26783 1 96 . 1 1 24 24 GLU H H 1 8.407 0.020 . 1 . . . . . 18 GLU H . 26783 1 97 . 1 1 24 24 GLU C C 13 176.004 0.3 . 1 . . . . . 18 GLU C . 26783 1 98 . 1 1 24 24 GLU CA C 13 53.226 0.3 . 1 . . . . . 18 GLU CA . 26783 1 99 . 1 1 24 24 GLU CB C 13 31.110 0.3 . 1 . . . . . 18 GLU CB . 26783 1 100 . 1 1 24 24 GLU N N 15 117.864 0.3 . 1 . . . . . 18 GLU N . 26783 1 101 . 1 1 25 25 PRO C C 13 175.358 0.3 . 1 . . . . . 19 PRO C . 26783 1 102 . 1 1 25 25 PRO CA C 13 65.419 0.3 . 1 . . . . . 19 PRO CA . 26783 1 103 . 1 1 25 25 PRO CB C 13 31.692 0.3 . 1 . . . . . 19 PRO CB . 26783 1 104 . 1 1 26 26 SER H H 1 7.004 0.020 . 1 . . . . . 20 SER H . 26783 1 105 . 1 1 26 26 SER C C 13 174.560 0.3 . 1 . . . . . 20 SER C . 26783 1 106 . 1 1 26 26 SER CA C 13 57.292 0.3 . 1 . . . . . 20 SER CA . 26783 1 107 . 1 1 26 26 SER CB C 13 63.360 0.3 . 1 . . . . . 20 SER CB . 26783 1 108 . 1 1 26 26 SER N N 15 103.625 0.3 . 1 . . . . . 20 SER N . 26783 1 109 . 1 1 27 27 ASP H H 1 7.969 0.020 . 1 . . . . . 21 ASP H . 26783 1 110 . 1 1 27 27 ASP C C 13 176.309 0.3 . 1 . . . . . 21 ASP C . 26783 1 111 . 1 1 27 27 ASP CA C 13 56.012 0.3 . 1 . . . . . 21 ASP CA . 26783 1 112 . 1 1 27 27 ASP CB C 13 40.810 0.3 . 1 . . . . . 21 ASP CB . 26783 1 113 . 1 1 27 27 ASP N N 15 123.893 0.3 . 1 . . . . . 21 ASP N . 26783 1 114 . 1 1 28 28 THR H H 1 7.762 0.020 . 1 . . . . . 22 THR H . 26783 1 115 . 1 1 28 28 THR C C 13 176.734 0.3 . 1 . . . . . 22 THR C . 26783 1 116 . 1 1 28 28 THR CA C 13 59.700 0.3 . 1 . . . . . 22 THR CA . 26783 1 117 . 1 1 28 28 THR CB C 13 71.200 0.3 . 1 . . . . . 22 THR CB . 26783 1 118 . 1 1 28 28 THR N N 15 109.190 0.3 . 1 . . . . . 22 THR N . 26783 1 119 . 1 1 29 29 ILE H H 1 8.406 0.020 . 1 . . . . . 23 ILE H . 26783 1 120 . 1 1 29 29 ILE C C 13 178.790 0.3 . 1 . . . . . 23 ILE C . 26783 1 121 . 1 1 29 29 ILE CA C 13 62.330 0.3 . 1 . . . . . 23 ILE CA . 26783 1 122 . 1 1 29 29 ILE CB C 13 34.480 0.3 . 1 . . . . . 23 ILE CB . 26783 1 123 . 1 1 29 29 ILE N N 15 121.010 0.3 . 1 . . . . . 23 ILE N . 26783 1 124 . 1 1 30 30 GLU H H 1 10.168 0.020 . 1 . . . . . 24 GLU H . 26783 1 125 . 1 1 30 30 GLU C C 13 179.079 0.3 . 1 . . . . . 24 GLU C . 26783 1 126 . 1 1 30 30 GLU CA C 13 60.925 0.3 . 1 . . . . . 24 GLU CA . 26783 1 127 . 1 1 30 30 GLU CB C 13 28.490 0.3 . 1 . . . . . 24 GLU CB . 26783 1 128 . 1 1 30 30 GLU N N 15 121.319 0.3 . 1 . . . . . 24 GLU N . 26783 1 129 . 1 1 31 31 ASN H H 1 7.854 0.020 . 1 . . . . . 25 ASN H . 26783 1 130 . 1 1 31 31 ASN C C 13 178.350 0.3 . 1 . . . . . 25 ASN C . 26783 1 131 . 1 1 31 31 ASN CA C 13 56.050 0.3 . 1 . . . . . 25 ASN CA . 26783 1 132 . 1 1 31 31 ASN CB C 13 38.148 0.3 . 1 . . . . . 25 ASN CB . 26783 1 133 . 1 1 31 31 ASN N N 15 121.552 0.3 . 1 . . . . . 25 ASN N . 26783 1 134 . 1 1 32 32 VAL H H 1 8.037 0.020 . 1 . . . . . 26 VAL H . 26783 1 135 . 1 1 32 32 VAL C C 13 177.850 0.3 . 1 . . . . . 26 VAL C . 26783 1 136 . 1 1 32 32 VAL CA C 13 67.630 0.3 . 1 . . . . . 26 VAL CA . 26783 1 137 . 1 1 32 32 VAL CB C 13 30.790 0.3 . 1 . . . . . 26 VAL CB . 26783 1 138 . 1 1 32 32 VAL N N 15 122.165 0.3 . 1 . . . . . 26 VAL N . 26783 1 139 . 1 1 33 33 LYS H H 1 8.500 0.020 . 1 . . . . . 27 LYS H . 26783 1 140 . 1 1 33 33 LYS C C 13 180.450 0.3 . 1 . . . . . 27 LYS C . 26783 1 141 . 1 1 33 33 LYS CA C 13 59.210 0.3 . 1 . . . . . 27 LYS CA . 26783 1 142 . 1 1 33 33 LYS CB C 13 33.670 0.3 . 1 . . . . . 27 LYS CB . 26783 1 143 . 1 1 33 33 LYS N N 15 119.190 0.3 . 1 . . . . . 27 LYS N . 26783 1 144 . 1 1 34 34 ALA H H 1 7.881 0.020 . 1 . . . . . 28 ALA H . 26783 1 145 . 1 1 34 34 ALA C C 13 180.190 0.3 . 1 . . . . . 28 ALA C . 26783 1 146 . 1 1 34 34 ALA CA C 13 55.400 0.3 . 1 . . . . . 28 ALA CA . 26783 1 147 . 1 1 34 34 ALA CB C 13 17.720 0.3 . 1 . . . . . 28 ALA CB . 26783 1 148 . 1 1 34 34 ALA N N 15 123.527 0.3 . 1 . . . . . 28 ALA N . 26783 1 149 . 1 1 35 35 LYS H H 1 7.770 0.020 . 1 . . . . . 29 LYS H . 26783 1 150 . 1 1 35 35 LYS C C 13 180.250 0.3 . 1 . . . . . 29 LYS C . 26783 1 151 . 1 1 35 35 LYS CA C 13 59.760 0.3 . 1 . . . . . 29 LYS CA . 26783 1 152 . 1 1 35 35 LYS CB C 13 33.330 0.3 . 1 . . . . . 29 LYS CB . 26783 1 153 . 1 1 35 35 LYS N N 15 120.289 0.3 . 1 . . . . . 29 LYS N . 26783 1 154 . 1 1 36 36 ILE H H 1 8.295 0.020 . 1 . . . . . 30 ILE H . 26783 1 155 . 1 1 36 36 ILE C C 13 178.160 0.3 . 1 . . . . . 30 ILE C . 26783 1 156 . 1 1 36 36 ILE CA C 13 66.100 0.3 . 1 . . . . . 30 ILE CA . 26783 1 157 . 1 1 36 36 ILE CB C 13 36.760 0.3 . 1 . . . . . 30 ILE CB . 26783 1 158 . 1 1 36 36 ILE N N 15 121.268 0.3 . 1 . . . . . 30 ILE N . 26783 1 159 . 1 1 37 37 GLN H H 1 8.485 0.020 . 1 . . . . . 31 GLN H . 26783 1 160 . 1 1 37 37 GLN C C 13 178.800 0.3 . 1 . . . . . 31 GLN C . 26783 1 161 . 1 1 37 37 GLN CA C 13 60.020 0.3 . 1 . . . . . 31 GLN CA . 26783 1 162 . 1 1 37 37 GLN CB C 13 27.690 0.3 . 1 . . . . . 31 GLN CB . 26783 1 163 . 1 1 37 37 GLN N N 15 123.657 0.3 . 1 . . . . . 31 GLN N . 26783 1 164 . 1 1 38 38 ASP H H 1 7.826 0.020 . 1 . . . . . 32 ASP H . 26783 1 165 . 1 1 38 38 ASP C C 13 177.240 0.3 . 1 . . . . . 32 ASP C . 26783 1 166 . 1 1 38 38 ASP CA C 13 57.360 0.3 . 1 . . . . . 32 ASP CA . 26783 1 167 . 1 1 38 38 ASP CB C 13 40.880 0.3 . 1 . . . . . 32 ASP CB . 26783 1 168 . 1 1 38 38 ASP N N 15 119.513 0.3 . 1 . . . . . 32 ASP N . 26783 1 169 . 1 1 39 39 LYS H H 1 7.312 0.020 . 1 . . . . . 33 LYS H . 26783 1 170 . 1 1 39 39 LYS C C 13 177.790 0.3 . 1 . . . . . 33 LYS C . 26783 1 171 . 1 1 39 39 LYS CA C 13 57.968 0.3 . 1 . . . . . 33 LYS CA . 26783 1 172 . 1 1 39 39 LYS CB C 13 33.902 0.3 . 1 . . . . . 33 LYS CB . 26783 1 173 . 1 1 39 39 LYS N N 15 115.315 0.3 . 1 . . . . . 33 LYS N . 26783 1 174 . 1 1 40 40 GLU H H 1 8.718 0.020 . 1 . . . . . 34 GLU H . 26783 1 175 . 1 1 40 40 GLU C C 13 177.820 0.3 . 1 . . . . . 34 GLU C . 26783 1 176 . 1 1 40 40 GLU CA C 13 55.443 0.3 . 1 . . . . . 34 GLU CA . 26783 1 177 . 1 1 40 40 GLU CB C 13 33.352 0.3 . 1 . . . . . 34 GLU CB . 26783 1 178 . 1 1 40 40 GLU N N 15 114.642 0.3 . 1 . . . . . 34 GLU N . 26783 1 179 . 1 1 41 41 GLY H H 1 8.425 0.020 . 1 . . . . . 35 GLY H . 26783 1 180 . 1 1 41 41 GLY C C 13 173.870 0.3 . 1 . . . . . 35 GLY C . 26783 1 181 . 1 1 41 41 GLY CA C 13 46.050 0.3 . 1 . . . . . 35 GLY CA . 26783 1 182 . 1 1 41 41 GLY N N 15 108.844 0.3 . 1 . . . . . 35 GLY N . 26783 1 183 . 1 1 42 42 ILE H H 1 6.062 0.020 . 1 . . . . . 36 ILE H . 26783 1 184 . 1 1 42 42 ILE C C 13 173.335 0.3 . 1 . . . . . 36 ILE C . 26783 1 185 . 1 1 42 42 ILE CA C 13 57.750 0.3 . 1 . . . . . 36 ILE CA . 26783 1 186 . 1 1 42 42 ILE CB C 13 40.500 0.3 . 1 . . . . . 36 ILE CB . 26783 1 187 . 1 1 42 42 ILE N N 15 119.975 0.3 . 1 . . . . . 36 ILE N . 26783 1 188 . 1 1 44 44 PRO C C 13 178.008 0.3 . 1 . . . . . 38 PRO C . 26783 1 189 . 1 1 44 44 PRO CA C 13 66.140 0.3 . 1 . . . . . 38 PRO CA . 26783 1 190 . 1 1 44 44 PRO CB C 13 32.830 0.3 . 1 . . . . . 38 PRO CB . 26783 1 191 . 1 1 45 45 ASP H H 1 8.438 0.020 . 1 . . . . . 39 ASP H . 26783 1 192 . 1 1 45 45 ASP C C 13 176.894 0.3 . 1 . . . . . 39 ASP C . 26783 1 193 . 1 1 45 45 ASP CA C 13 55.506 0.3 . 1 . . . . . 39 ASP CA . 26783 1 194 . 1 1 45 45 ASP CB C 13 39.700 0.3 . 1 . . . . . 39 ASP CB . 26783 1 195 . 1 1 45 45 ASP N N 15 113.285 0.3 . 1 . . . . . 39 ASP N . 26783 1 196 . 1 1 46 46 GLN H H 1 7.818 0.020 . 1 . . . . . 40 GLN H . 26783 1 197 . 1 1 46 46 GLN C C 13 174.778 0.3 . 1 . . . . . 40 GLN C . 26783 1 198 . 1 1 46 46 GLN CA C 13 55.244 0.3 . 1 . . . . . 40 GLN CA . 26783 1 199 . 1 1 46 46 GLN CB C 13 30.080 0.3 . 1 . . . . . 40 GLN CB . 26783 1 200 . 1 1 46 46 GLN N N 15 117.075 0.3 . 1 . . . . . 40 GLN N . 26783 1 201 . 1 1 47 47 GLN H H 1 7.272 0.020 . 1 . . . . . 41 GLN H . 26783 1 202 . 1 1 47 47 GLN C C 13 176.160 0.3 . 1 . . . . . 41 GLN C . 26783 1 203 . 1 1 47 47 GLN CA C 13 56.630 0.3 . 1 . . . . . 41 GLN CA . 26783 1 204 . 1 1 47 47 GLN CB C 13 31.560 0.3 . 1 . . . . . 41 GLN CB . 26783 1 205 . 1 1 47 47 GLN N N 15 117.929 0.3 . 1 . . . . . 41 GLN N . 26783 1 206 . 1 1 48 48 ILE H H 1 8.670 0.020 . 1 . . . . . 42 ILE H . 26783 1 207 . 1 1 48 48 ILE C C 13 174.106 0.3 . 1 . . . . . 42 ILE C . 26783 1 208 . 1 1 48 48 ILE CA C 13 61.236 0.3 . 1 . . . . . 42 ILE CA . 26783 1 209 . 1 1 48 48 ILE CB C 13 39.893 0.3 . 1 . . . . . 42 ILE CB . 26783 1 210 . 1 1 48 48 ILE N N 15 123.249 0.3 . 1 . . . . . 42 ILE N . 26783 1 211 . 1 1 49 49 LEU H H 1 8.469 0.020 . 1 . . . . . 43 LEU H . 26783 1 212 . 1 1 49 49 LEU C C 13 175.060 0.3 . 1 . . . . . 43 LEU C . 26783 1 213 . 1 1 49 49 LEU CA C 13 53.020 0.3 . 1 . . . . . 43 LEU CA . 26783 1 214 . 1 1 49 49 LEU CB C 13 46.650 0.3 . 1 . . . . . 43 LEU CB . 26783 1 215 . 1 1 49 49 LEU N N 15 125.498 0.3 . 1 . . . . . 43 LEU N . 26783 1 216 . 1 1 50 50 PHE H H 1 9.070 0.020 . 1 . . . . . 44 PHE H . 26783 1 217 . 1 1 50 50 PHE C C 13 175.920 0.3 . 1 . . . . . 44 PHE C . 26783 1 218 . 1 1 50 50 PHE CA C 13 56.314 0.3 . 1 . . . . . 44 PHE CA . 26783 1 219 . 1 1 50 50 PHE CB C 13 43.429 0.3 . 1 . . . . . 44 PHE CB . 26783 1 220 . 1 1 50 50 PHE N N 15 117.671 0.3 . 1 . . . . . 44 PHE N . 26783 1 221 . 1 1 51 51 PHE H H 1 8.812 0.020 . 1 . . . . . 45 PHE H . 26783 1 222 . 1 1 51 51 PHE C C 13 175.011 0.3 . 1 . . . . . 45 PHE C . 26783 1 223 . 1 1 51 51 PHE CA C 13 55.168 0.3 . 1 . . . . . 45 PHE CA . 26783 1 224 . 1 1 51 51 PHE CB C 13 41.599 0.3 . 1 . . . . . 45 PHE CB . 26783 1 225 . 1 1 51 51 PHE N N 15 120.479 0.3 . 1 . . . . . 45 PHE N . 26783 1 226 . 1 1 52 52 ALA H H 1 9.243 0.020 . 1 . . . . . 46 ALA H . 26783 1 227 . 1 1 52 52 ALA C C 13 176.136 0.3 . 1 . . . . . 46 ALA C . 26783 1 228 . 1 1 52 52 ALA CA C 13 54.315 0.3 . 1 . . . . . 46 ALA CA . 26783 1 229 . 1 1 52 52 ALA CB C 13 16.360 0.3 . 1 . . . . . 46 ALA CB . 26783 1 230 . 1 1 52 52 ALA N N 15 131.843 0.3 . 1 . . . . . 46 ALA N . 26783 1 231 . 1 1 53 53 VAL H H 1 7.351 0.020 . 1 . . . . . 47 VAL H . 26783 1 232 . 1 1 53 53 VAL C C 13 175.818 0.3 . 1 . . . . . 47 VAL C . 26783 1 233 . 1 1 53 53 VAL CA C 13 62.016 0.3 . 1 . . . . . 47 VAL CA . 26783 1 234 . 1 1 53 53 VAL CB C 13 31.359 0.3 . 1 . . . . . 47 VAL CB . 26783 1 235 . 1 1 53 53 VAL N N 15 113.173 0.3 . 1 . . . . . 47 VAL N . 26783 1 236 . 1 1 54 54 LYS H H 1 8.018 0.020 . 1 . . . . . 48 LYS H . 26783 1 237 . 1 1 54 54 LYS C C 13 174.705 0.3 . 1 . . . . . 48 LYS C . 26783 1 238 . 1 1 54 54 LYS CA C 13 55.528 0.3 . 1 . . . . . 48 LYS CA . 26783 1 239 . 1 1 54 54 LYS CB C 13 33.808 0.3 . 1 . . . . . 48 LYS CB . 26783 1 240 . 1 1 54 54 LYS N N 15 122.880 0.3 . 1 . . . . . 48 LYS N . 26783 1 241 . 1 1 55 55 ARG H H 1 8.496 0.020 . 1 . . . . . 49 ARG H . 26783 1 242 . 1 1 55 55 ARG C C 13 175.659 0.3 . 1 . . . . . 49 ARG C . 26783 1 243 . 1 1 55 55 ARG CA C 13 56.037 0.3 . 1 . . . . . 49 ARG CA . 26783 1 244 . 1 1 55 55 ARG CB C 13 30.474 0.3 . 1 . . . . . 49 ARG CB . 26783 1 245 . 1 1 55 55 ARG N N 15 127.084 0.3 . 1 . . . . . 49 ARG N . 26783 1 246 . 1 1 56 56 LEU H H 1 8.372 0.020 . 1 . . . . . 50 LEU H . 26783 1 247 . 1 1 56 56 LEU C C 13 176.246 0.3 . 1 . . . . . 50 LEU C . 26783 1 248 . 1 1 56 56 LEU CA C 13 54.250 0.3 . 1 . . . . . 50 LEU CA . 26783 1 249 . 1 1 56 56 LEU CB C 13 40.801 0.3 . 1 . . . . . 50 LEU CB . 26783 1 250 . 1 1 56 56 LEU N N 15 126.342 0.3 . 1 . . . . . 50 LEU N . 26783 1 251 . 1 1 57 57 GLU H H 1 8.179 0.020 . 1 . . . . . 51 GLU H . 26783 1 252 . 1 1 57 57 GLU C C 13 175.121 0.3 . 1 . . . . . 51 GLU C . 26783 1 253 . 1 1 57 57 GLU CA C 13 55.960 0.3 . 1 . . . . . 51 GLU CA . 26783 1 254 . 1 1 57 57 GLU CB C 13 31.770 0.3 . 1 . . . . . 51 GLU CB . 26783 1 255 . 1 1 57 57 GLU N N 15 122.727 0.3 . 1 . . . . . 51 GLU N . 26783 1 256 . 1 1 58 58 ASP H H 1 8.025 0.020 . 1 . . . . . 52 ASP H . 26783 1 257 . 1 1 58 58 ASP C C 13 177.347 0.3 . 1 . . . . . 52 ASP C . 26783 1 258 . 1 1 58 58 ASP CA C 13 56.710 0.3 . 1 . . . . . 52 ASP CA . 26783 1 259 . 1 1 58 58 ASP CB C 13 40.490 0.3 . 1 . . . . . 52 ASP CB . 26783 1 260 . 1 1 58 58 ASP N N 15 120.285 0.3 . 1 . . . . . 52 ASP N . 26783 1 261 . 1 1 59 59 GLY C C 13 174.740 0.3 . 1 . . . . . 53 GLY C . 26783 1 262 . 1 1 59 59 GLY CA C 13 45.023 0.3 . 1 . . . . . 53 GLY CA . 26783 1 263 . 1 1 60 60 ARG H H 1 7.369 0.020 . 1 . . . . . 54 ARG H . 26783 1 264 . 1 1 60 60 ARG C C 13 175.270 0.3 . 1 . . . . . 54 ARG C . 26783 1 265 . 1 1 60 60 ARG CA C 13 54.290 0.3 . 1 . . . . . 54 ARG CA . 26783 1 266 . 1 1 60 60 ARG CB C 13 32.690 0.3 . 1 . . . . . 54 ARG CB . 26783 1 267 . 1 1 60 60 ARG N N 15 119.343 0.3 . 1 . . . . . 54 ARG N . 26783 1 268 . 1 1 61 61 THR H H 1 8.765 0.020 . 1 . . . . . 55 THR H . 26783 1 269 . 1 1 61 61 THR C C 13 176.460 0.3 . 1 . . . . . 55 THR C . 26783 1 270 . 1 1 61 61 THR CA C 13 59.700 0.3 . 1 . . . . . 55 THR CA . 26783 1 271 . 1 1 61 61 THR CB C 13 72.280 0.3 . 1 . . . . . 55 THR CB . 26783 1 272 . 1 1 61 61 THR N N 15 108.868 0.3 . 1 . . . . . 55 THR N . 26783 1 273 . 1 1 62 62 LEU H H 1 8.115 0.020 . 1 . . . . . 56 LEU H . 26783 1 274 . 1 1 62 62 LEU C C 13 180.740 0.3 . 1 . . . . . 56 LEU C . 26783 1 275 . 1 1 62 62 LEU CA C 13 58.680 0.3 . 1 . . . . . 56 LEU CA . 26783 1 276 . 1 1 62 62 LEU CB C 13 40.250 0.3 . 1 . . . . . 56 LEU CB . 26783 1 277 . 1 1 62 62 LEU N N 15 117.703 0.3 . 1 . . . . . 56 LEU N . 26783 1 278 . 1 1 63 63 SER H H 1 8.356 0.020 . 1 . . . . . 57 SER H . 26783 1 279 . 1 1 63 63 SER C C 13 178.142 0.3 . 1 . . . . . 57 SER C . 26783 1 280 . 1 1 63 63 SER CA C 13 61.120 0.3 . 1 . . . . . 57 SER CA . 26783 1 281 . 1 1 63 63 SER CB C 13 62.450 0.3 . 1 . . . . . 57 SER CB . 26783 1 282 . 1 1 63 63 SER N N 15 113.383 0.3 . 1 . . . . . 57 SER N . 26783 1 283 . 1 1 64 64 ASP H H 1 7.830 0.020 . 1 . . . . . 58 ASP H . 26783 1 284 . 1 1 64 64 ASP C C 13 177.360 0.3 . 1 . . . . . 58 ASP C . 26783 1 285 . 1 1 64 64 ASP CA C 13 57.350 0.3 . 1 . . . . . 58 ASP CA . 26783 1 286 . 1 1 64 64 ASP CB C 13 40.250 0.3 . 1 . . . . . 58 ASP CB . 26783 1 287 . 1 1 64 64 ASP N N 15 124.353 0.3 . 1 . . . . . 58 ASP N . 26783 1 288 . 1 1 65 65 TYR H H 1 7.198 0.020 . 1 . . . . . 59 TYR H . 26783 1 289 . 1 1 65 65 TYR C C 13 174.754 0.3 . 1 . . . . . 59 TYR C . 26783 1 290 . 1 1 65 65 TYR CA C 13 58.260 0.3 . 1 . . . . . 59 TYR CA . 26783 1 291 . 1 1 65 65 TYR CB C 13 39.980 0.3 . 1 . . . . . 59 TYR CB . 26783 1 292 . 1 1 65 65 TYR N N 15 115.566 0.3 . 1 . . . . . 59 TYR N . 26783 1 293 . 1 1 66 66 ASN H H 1 8.073 0.020 . 1 . . . . . 60 ASN H . 26783 1 294 . 1 1 66 66 ASN C C 13 174.240 0.3 . 1 . . . . . 60 ASN C . 26783 1 295 . 1 1 66 66 ASN CA C 13 54.140 0.3 . 1 . . . . . 60 ASN CA . 26783 1 296 . 1 1 66 66 ASN CB C 13 37.390 0.3 . 1 . . . . . 60 ASN CB . 26783 1 297 . 1 1 66 66 ASN N N 15 115.752 0.3 . 1 . . . . . 60 ASN N . 26783 1 298 . 1 1 67 67 ILE H H 1 7.119 0.020 . 1 . . . . . 61 ILE H . 26783 1 299 . 1 1 67 67 ILE C C 13 174.387 0.3 . 1 . . . . . 61 ILE C . 26783 1 300 . 1 1 67 67 ILE CA C 13 62.420 0.3 . 1 . . . . . 61 ILE CA . 26783 1 301 . 1 1 67 67 ILE CB C 13 36.660 0.3 . 1 . . . . . 61 ILE CB . 26783 1 302 . 1 1 67 67 ILE N N 15 119.189 0.3 . 1 . . . . . 61 ILE N . 26783 1 303 . 1 1 68 68 GLN H H 1 7.783 0.020 . 1 . . . . . 62 GLN H . 26783 1 304 . 1 1 68 68 GLN C C 13 175.476 0.3 . 1 . . . . . 62 GLN C . 26783 1 305 . 1 1 68 68 GLN CA C 13 53.620 0.3 . 1 . . . . . 62 GLN CA . 26783 1 306 . 1 1 68 68 GLN CB C 13 31.610 0.3 . 1 . . . . . 62 GLN CB . 26783 1 307 . 1 1 68 68 GLN N N 15 124.768 0.3 . 1 . . . . . 62 GLN N . 26783 1 308 . 1 1 69 69 LYS H H 1 8.311 0.020 . 1 . . . . . 63 LYS H . 26783 1 309 . 1 1 69 69 LYS C C 13 176.687 0.3 . 1 . . . . . 63 LYS C . 26783 1 310 . 1 1 69 69 LYS CA C 13 58.610 0.3 . 1 . . . . . 63 LYS CA . 26783 1 311 . 1 1 69 69 LYS CB C 13 32.590 0.3 . 1 . . . . . 63 LYS CB . 26783 1 312 . 1 1 69 69 LYS N N 15 119.424 0.3 . 1 . . . . . 63 LYS N . 26783 1 313 . 1 1 70 70 LYS H H 1 9.227 0.020 . 1 . . . . . 64 LYS H . 26783 1 314 . 1 1 70 70 LYS C C 13 175.512 0.3 . 1 . . . . . 64 LYS C . 26783 1 315 . 1 1 70 70 LYS CA C 13 58.453 0.3 . 1 . . . . . 64 LYS CA . 26783 1 316 . 1 1 70 70 LYS CB C 13 29.635 0.3 . 1 . . . . . 64 LYS CB . 26783 1 317 . 1 1 70 70 LYS N N 15 116.895 0.3 . 1 . . . . . 64 LYS N . 26783 1 318 . 1 1 71 71 SER H H 1 7.948 0.020 . 1 . . . . . 65 SER H . 26783 1 319 . 1 1 71 71 SER C C 13 171.782 0.3 . 1 . . . . . 65 SER C . 26783 1 320 . 1 1 71 71 SER CA C 13 61.239 0.3 . 1 . . . . . 65 SER CA . 26783 1 321 . 1 1 71 71 SER CB C 13 64.769 0.3 . 1 . . . . . 65 SER CB . 26783 1 322 . 1 1 71 71 SER N N 15 116.220 0.3 . 1 . . . . . 65 SER N . 26783 1 323 . 1 1 72 72 SER H H 1 8.508 0.020 . 1 . . . . . 66 SER H . 26783 1 324 . 1 1 72 72 SER C C 13 173.873 0.3 . 1 . . . . . 66 SER C . 26783 1 325 . 1 1 72 72 SER CA C 13 56.980 0.3 . 1 . . . . . 66 SER CA . 26783 1 326 . 1 1 72 72 SER CB C 13 64.769 0.3 . 1 . . . . . 66 SER CB . 26783 1 327 . 1 1 72 72 SER N N 15 115.758 0.3 . 1 . . . . . 66 SER N . 26783 1 328 . 1 1 73 73 LEU H H 1 9.306 0.020 . 1 . . . . . 67 LEU H . 26783 1 329 . 1 1 73 73 LEU C C 13 175.540 0.3 . 1 . . . . . 67 LEU C . 26783 1 330 . 1 1 73 73 LEU CA C 13 53.541 0.3 . 1 . . . . . 67 LEU CA . 26783 1 331 . 1 1 73 73 LEU CB C 13 44.524 0.3 . 1 . . . . . 67 LEU CB . 26783 1 332 . 1 1 73 73 LEU N N 15 125.696 0.3 . 1 . . . . . 67 LEU N . 26783 1 333 . 1 1 74 74 LEU H H 1 8.962 0.020 . 1 . . . . . 68 LEU H . 26783 1 334 . 1 1 74 74 LEU C C 13 174.314 0.3 . 1 . . . . . 68 LEU C . 26783 1 335 . 1 1 74 74 LEU CA C 13 54.389 0.3 . 1 . . . . . 68 LEU CA . 26783 1 336 . 1 1 74 74 LEU CB C 13 44.984 0.3 . 1 . . . . . 68 LEU CB . 26783 1 337 . 1 1 74 74 LEU N N 15 123.349 0.3 . 1 . . . . . 68 LEU N . 26783 1 338 . 1 1 75 75 LEU H H 1 8.309 0.020 . 1 . . . . . 69 LEU H . 26783 1 339 . 1 1 75 75 LEU C C 13 173.983 0.3 . 1 . . . . . 69 LEU C . 26783 1 340 . 1 1 75 75 LEU CA C 13 53.442 0.3 . 1 . . . . . 69 LEU CA . 26783 1 341 . 1 1 75 75 LEU CB C 13 44.270 0.3 . 1 . . . . . 69 LEU CB . 26783 1 342 . 1 1 75 75 LEU N N 15 125.834 0.3 . 1 . . . . . 69 LEU N . 26783 1 343 . 1 1 76 76 ALA H H 1 9.587 0.020 . 1 . . . . . 70 ALA H . 26783 1 344 . 1 1 76 76 ALA C C 13 175.121 0.3 . 1 . . . . . 70 ALA C . 26783 1 345 . 1 1 76 76 ALA CA C 13 49.872 0.3 . 1 . . . . . 70 ALA CA . 26783 1 346 . 1 1 76 76 ALA CB C 13 22.621 0.3 . 1 . . . . . 70 ALA CB . 26783 1 347 . 1 1 76 76 ALA N N 15 129.612 0.3 . 1 . . . . . 70 ALA N . 26783 1 348 . 1 1 77 77 MET H H 1 8.270 0.020 . 1 . . . . . 71 MET H . 26783 1 349 . 1 1 77 77 MET C C 13 176.943 0.3 . 1 . . . . . 71 MET C . 26783 1 350 . 1 1 77 77 MET CA C 13 53.147 0.3 . 1 . . . . . 71 MET CA . 26783 1 351 . 1 1 77 77 MET CB C 13 33.729 0.3 . 1 . . . . . 71 MET CB . 26783 1 352 . 1 1 77 77 MET N N 15 116.250 0.3 . 1 . . . . . 71 MET N . 26783 1 353 . 1 1 78 78 ARG H H 1 8.558 0.020 . 1 . . . . . 72 ARG H . 26783 1 354 . 1 1 78 78 ARG C C 13 175.573 0.3 . 1 . . . . . 72 ARG C . 26783 1 355 . 1 1 78 78 ARG CA C 13 56.388 0.3 . 1 . . . . . 72 ARG CA . 26783 1 356 . 1 1 78 78 ARG CB C 13 31.340 0.3 . 1 . . . . . 72 ARG CB . 26783 1 357 . 1 1 78 78 ARG N N 15 123.753 0.3 . 1 . . . . . 72 ARG N . 26783 1 358 . 1 1 79 79 VAL H H 1 8.251 0.020 . 1 . . . . . 73 VAL H . 26783 1 359 . 1 1 79 79 VAL C C 13 174.387 0.3 . 1 . . . . . 73 VAL C . 26783 1 360 . 1 1 79 79 VAL CA C 13 59.720 0.3 . 1 . . . . . 73 VAL CA . 26783 1 361 . 1 1 79 79 VAL CB C 13 32.618 0.3 . 1 . . . . . 73 VAL CB . 26783 1 362 . 1 1 79 79 VAL N N 15 124.090 0.3 . 1 . . . . . 73 VAL N . 26783 1 363 . 1 1 81 81 GLY H H 1 8.327 0.020 . 1 . . . . . 75 GLY H . 26783 1 364 . 1 1 81 81 GLY C C 13 173.812 0.3 . 1 . . . . . 75 GLY C . 26783 1 365 . 1 1 81 81 GLY CA C 13 44.991 0.3 . 1 . . . . . 75 GLY CA . 26783 1 366 . 1 1 81 81 GLY N N 15 109.165 0.3 . 1 . . . . . 75 GLY N . 26783 1 367 . 1 1 82 82 LYS H H 1 8.061 0.020 . 1 . . . . . 76 LYS H . 26783 1 368 . 1 1 82 82 LYS C C 13 176.528 0.3 . 1 . . . . . 76 LYS C . 26783 1 369 . 1 1 82 82 LYS CA C 13 56.030 0.3 . 1 . . . . . 76 LYS CA . 26783 1 370 . 1 1 82 82 LYS CB C 13 33.211 0.3 . 1 . . . . . 76 LYS CB . 26783 1 371 . 1 1 82 82 LYS N N 15 120.701 0.3 . 1 . . . . . 76 LYS N . 26783 1 372 . 1 1 83 83 MET H H 1 8.381 0.020 . 1 . . . . . 77 MET H . 26783 1 373 . 1 1 83 83 MET C C 13 175.182 0.3 . 1 . . . . . 77 MET C . 26783 1 374 . 1 1 83 83 MET CA C 13 55.657 0.3 . 1 . . . . . 77 MET CA . 26783 1 375 . 1 1 83 83 MET CB C 13 33.062 0.3 . 1 . . . . . 77 MET CB . 26783 1 376 . 1 1 83 83 MET N N 15 122.250 0.3 . 1 . . . . . 77 MET N . 26783 1 377 . 1 1 84 84 LYS H H 1 7.825 0.020 . 1 . . . . . 78 LYS H . 26783 1 378 . 1 1 84 84 LYS C C 13 181.041 0.3 . 1 . . . . . 78 LYS C . 26783 1 379 . 1 1 84 84 LYS CA C 13 57.832 0.3 . 1 . . . . . 78 LYS CA . 26783 1 380 . 1 1 84 84 LYS CB C 13 33.561 0.3 . 1 . . . . . 78 LYS CB . 26783 1 381 . 1 1 84 84 LYS N N 15 127.127 0.3 . 1 . . . . . 78 LYS N . 26783 1 stop_ save_