data_27233 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 27233 _Entry.Title ; Backbone 1H, 13C, and 15N Chemical Shift Assignments for MazF from M. tuberculosis ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2017-08-24 _Entry.Accession_date 2017-08-24 _Entry.Last_release_date 2017-08-24 _Entry.Original_release_date 2017-08-24 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_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 Do-Hwan Ahn . . . . 27233 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 27233 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 201 27233 '15N chemical shifts' 76 27233 '1H chemical shifts' 76 27233 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 . . 2021-07-22 . original BMRB . 27233 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 27233 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 28972145 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Structural analyses of the MazEF4 toxin-antitoxin pair in Mycobacterium tuberculosis provide evidence for a unique extracellular death factor ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biol. Chem.' _Citation.Journal_name_full 'The Journal of biological chemistry' _Citation.Journal_volume 292 _Citation.Journal_issue 46 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1083-351X _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 18832 _Citation.Page_last 18847 _Citation.Year 2017 _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 Do-Hwan Ahn D. H. . . 27233 1 2 Ki-Young Lee K. Y. . . 27233 1 3 'Sang Jae' Lee S. J. . . 27233 1 4 'Sung Jean' Park S. J. . . 27233 1 5 Hye-Jin Yoon H. J. . . 27233 1 6 Soon-Jong Kim S. J. . . 27233 1 7 Bong-Jin Lee B. J. . . 27233 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 27233 _Assembly.ID 1 _Assembly.Name 'MazF dimer' _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 'MazF4, Subunit 1' 1 $MazF4 A . yes native no no . . . 27233 1 2 'MazF4, Subunit 2' 1 $MazF4 B . yes native no no . . . 27233 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_MazF4 _Entity.Sf_category entity _Entity.Sf_framecode MazF4 _Entity.Entry_ID 27233 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name MazF4 _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 ; EFMNAPLRGQVYACDLGAGA KPWLIVSNNARNRHTADVVA VRLTTTRRTIPTWVAMGPSD PLTGYVNADNIETLGKDELG DYLGEVTPATMNKINTALAT ALGLPWP ; _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 107 _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 . GLU . 27233 1 2 . PHE . 27233 1 3 . MET . 27233 1 4 . ASN . 27233 1 5 . ALA . 27233 1 6 . PRO . 27233 1 7 . LEU . 27233 1 8 . ARG . 27233 1 9 . GLY . 27233 1 10 . GLN . 27233 1 11 . VAL . 27233 1 12 . TYR . 27233 1 13 . ALA . 27233 1 14 . CYS . 27233 1 15 . ASP . 27233 1 16 . LEU . 27233 1 17 . GLY . 27233 1 18 . ALA . 27233 1 19 . GLY . 27233 1 20 . ALA . 27233 1 21 . LYS . 27233 1 22 . PRO . 27233 1 23 . TRP . 27233 1 24 . LEU . 27233 1 25 . ILE . 27233 1 26 . VAL . 27233 1 27 . SER . 27233 1 28 . ASN . 27233 1 29 . ASN . 27233 1 30 . ALA . 27233 1 31 . ARG . 27233 1 32 . ASN . 27233 1 33 . ARG . 27233 1 34 . HIS . 27233 1 35 . THR . 27233 1 36 . ALA . 27233 1 37 . ASP . 27233 1 38 . VAL . 27233 1 39 . VAL . 27233 1 40 . ALA . 27233 1 41 . VAL . 27233 1 42 . ARG . 27233 1 43 . LEU . 27233 1 44 . THR . 27233 1 45 . THR . 27233 1 46 . THR . 27233 1 47 . ARG . 27233 1 48 . ARG . 27233 1 49 . THR . 27233 1 50 . ILE . 27233 1 51 . PRO . 27233 1 52 . THR . 27233 1 53 . TRP . 27233 1 54 . VAL . 27233 1 55 . ALA . 27233 1 56 . MET . 27233 1 57 . GLY . 27233 1 58 . PRO . 27233 1 59 . SER . 27233 1 60 . ASP . 27233 1 61 . PRO . 27233 1 62 . LEU . 27233 1 63 . THR . 27233 1 64 . GLY . 27233 1 65 . TYR . 27233 1 66 . VAL . 27233 1 67 . ASN . 27233 1 68 . ALA . 27233 1 69 . ASP . 27233 1 70 . ASN . 27233 1 71 . ILE . 27233 1 72 . GLU . 27233 1 73 . THR . 27233 1 74 . LEU . 27233 1 75 . GLY . 27233 1 76 . LYS . 27233 1 77 . ASP . 27233 1 78 . GLU . 27233 1 79 . LEU . 27233 1 80 . GLY . 27233 1 81 . ASP . 27233 1 82 . TYR . 27233 1 83 . LEU . 27233 1 84 . GLY . 27233 1 85 . GLU . 27233 1 86 . VAL . 27233 1 87 . THR . 27233 1 88 . PRO . 27233 1 89 . ALA . 27233 1 90 . THR . 27233 1 91 . MET . 27233 1 92 . ASN . 27233 1 93 . LYS . 27233 1 94 . ILE . 27233 1 95 . ASN . 27233 1 96 . THR . 27233 1 97 . ALA . 27233 1 98 . LEU . 27233 1 99 . ALA . 27233 1 100 . THR . 27233 1 101 . ALA . 27233 1 102 . LEU . 27233 1 103 . GLY . 27233 1 104 . LEU . 27233 1 105 . PRO . 27233 1 106 . TRP . 27233 1 107 . PRO . 27233 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 . GLU 1 1 27233 1 . PHE 2 2 27233 1 . MET 3 3 27233 1 . ASN 4 4 27233 1 . ALA 5 5 27233 1 . PRO 6 6 27233 1 . LEU 7 7 27233 1 . ARG 8 8 27233 1 . GLY 9 9 27233 1 . GLN 10 10 27233 1 . VAL 11 11 27233 1 . TYR 12 12 27233 1 . ALA 13 13 27233 1 . CYS 14 14 27233 1 . ASP 15 15 27233 1 . LEU 16 16 27233 1 . GLY 17 17 27233 1 . ALA 18 18 27233 1 . GLY 19 19 27233 1 . ALA 20 20 27233 1 . LYS 21 21 27233 1 . PRO 22 22 27233 1 . TRP 23 23 27233 1 . LEU 24 24 27233 1 . ILE 25 25 27233 1 . VAL 26 26 27233 1 . SER 27 27 27233 1 . ASN 28 28 27233 1 . ASN 29 29 27233 1 . ALA 30 30 27233 1 . ARG 31 31 27233 1 . ASN 32 32 27233 1 . ARG 33 33 27233 1 . HIS 34 34 27233 1 . THR 35 35 27233 1 . ALA 36 36 27233 1 . ASP 37 37 27233 1 . VAL 38 38 27233 1 . VAL 39 39 27233 1 . ALA 40 40 27233 1 . VAL 41 41 27233 1 . ARG 42 42 27233 1 . LEU 43 43 27233 1 . THR 44 44 27233 1 . THR 45 45 27233 1 . THR 46 46 27233 1 . ARG 47 47 27233 1 . ARG 48 48 27233 1 . THR 49 49 27233 1 . ILE 50 50 27233 1 . PRO 51 51 27233 1 . THR 52 52 27233 1 . TRP 53 53 27233 1 . VAL 54 54 27233 1 . ALA 55 55 27233 1 . MET 56 56 27233 1 . GLY 57 57 27233 1 . PRO 58 58 27233 1 . SER 59 59 27233 1 . ASP 60 60 27233 1 . PRO 61 61 27233 1 . LEU 62 62 27233 1 . THR 63 63 27233 1 . GLY 64 64 27233 1 . TYR 65 65 27233 1 . VAL 66 66 27233 1 . ASN 67 67 27233 1 . ALA 68 68 27233 1 . ASP 69 69 27233 1 . ASN 70 70 27233 1 . ILE 71 71 27233 1 . GLU 72 72 27233 1 . THR 73 73 27233 1 . LEU 74 74 27233 1 . GLY 75 75 27233 1 . LYS 76 76 27233 1 . ASP 77 77 27233 1 . GLU 78 78 27233 1 . LEU 79 79 27233 1 . GLY 80 80 27233 1 . ASP 81 81 27233 1 . TYR 82 82 27233 1 . LEU 83 83 27233 1 . GLY 84 84 27233 1 . GLU 85 85 27233 1 . VAL 86 86 27233 1 . THR 87 87 27233 1 . PRO 88 88 27233 1 . ALA 89 89 27233 1 . THR 90 90 27233 1 . MET 91 91 27233 1 . ASN 92 92 27233 1 . LYS 93 93 27233 1 . ILE 94 94 27233 1 . ASN 95 95 27233 1 . THR 96 96 27233 1 . ALA 97 97 27233 1 . LEU 98 98 27233 1 . ALA 99 99 27233 1 . THR 100 100 27233 1 . ALA 101 101 27233 1 . LEU 102 102 27233 1 . GLY 103 103 27233 1 . LEU 104 104 27233 1 . PRO 105 105 27233 1 . TRP 106 106 27233 1 . PRO 107 107 27233 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 27233 _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 $MazF4 . 1773 organism . 'Mycobacterium tuberculosis' 'Mycobacterium tuberculosis' . . Bacteria . Mycobacterium tuberculosis . . . . . . . . . . . . . 27233 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 27233 _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 $MazF4 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . 'pET 28a' . . . 27233 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 27233 _Sample.ID 1 _Sample.Name . _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 MazF4 '[U-99% 13C; U-99% 15N]' . . 1 $MazF4 . . 0.3 . . mM . . . . 27233 1 2 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 27233 1 3 NaCl 'natural abundance' . . . . . . 200 . . mM . . . . 27233 1 4 MES 'natural abundance' . . . . . . 20 . . mM . . . . 27233 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 27233 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _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' 0.2 . M 27233 1 pH 6.5 . pH 27233 1 pressure 1 . atm 27233 1 temperature 308 . K 27233 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 27233 _Software.ID 1 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 27233 1 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 27233 1 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 27233 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 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 27233 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . 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 . 800 . . . 27233 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 27233 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_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.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 27233 1 2 '3D HNCO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 27233 1 3 '3D HNCA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 27233 1 4 '3D HN(CO)CA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 27233 1 5 '3D CBCA(CO)NH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 27233 1 6 '3D HNCACB' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 27233 1 7 3D-HN(CA)CO no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 27233 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 27233 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _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 n/a indirect 0.251449530 . . . . . 27233 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 27233 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 n/a indirect 0.101329118 . . . . . 27233 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 27233 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _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' . . . 27233 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 1 1 GLU C C 13 175.3761 . . 1 . . 488335 . . 1 GLU C . 27233 1 2 . 1 . 1 1 1 GLU CA C 13 53.8858 . . 1 . . 488338 . . 1 GLU CA . 27233 1 3 . 1 . 1 1 1 GLU CB C 13 26.9088 . . 1 . . 488353 . . 1 GLU CB . 27233 1 4 . 1 . 1 2 2 PHE H H 1 8.3779 . . 1 . . 488319 . . 2 PHE H . 27233 1 5 . 1 . 1 2 2 PHE C C 13 175.0562 . . 1 . . 488326 . . 2 PHE C . 27233 1 6 . 1 . 1 2 2 PHE CA C 13 54.9332 . . 1 . . 485155 . . 2 PHE CA . 27233 1 7 . 1 . 1 2 2 PHE CB C 13 35.7644 . . 1 . . 488332 . . 2 PHE CB . 27233 1 8 . 1 . 1 2 2 PHE N N 15 121.0456 . . 1 . . 488321 . . 2 PHE N . 27233 1 9 . 1 . 1 3 3 MET H H 1 8.2512 . . 1 . . 485172 . . 3 MET H . 27233 1 10 . 1 . 1 3 3 MET C C 13 174.7664 . . 1 . . 486862 . . 3 MET C . 27233 1 11 . 1 . 1 3 3 MET CA C 13 52.8390 . . 1 . . 485893 . . 3 MET CA . 27233 1 12 . 1 . 1 3 3 MET CB C 13 28.8556 . . 1 . . 484663 . . 3 MET CB . 27233 1 13 . 1 . 1 3 3 MET N N 15 122.2607 . . 1 . . 485174 . . 3 MET N . 27233 1 14 . 1 . 1 4 4 ASN H H 1 8.1727 . . 1 . . 484656 . . 4 ASN H . 27233 1 15 . 1 . 1 4 4 ASN C C 13 173.6326 . . 1 . . 489748 . . 4 ASN C . 27233 1 16 . 1 . 1 4 4 ASN CA C 13 50.7164 . . 1 . . 489746 . . 4 ASN CA . 27233 1 17 . 1 . 1 4 4 ASN CB C 13 35.3841 . . 1 . . 489882 . . 4 ASN CB . 27233 1 18 . 1 . 1 4 4 ASN N N 15 119.5660 . . 1 . . 484658 . . 4 ASN N . 27233 1 19 . 1 . 1 5 5 ALA H H 1 8.0351 . . 1 . . 489860 . . 5 ALA H . 27233 1 20 . 1 . 1 5 5 ALA C C 13 172.9442 . . 1 . . 489864 . . 5 ALA C . 27233 1 21 . 1 . 1 5 5 ALA CB C 13 15.0749 . . 1 . . 489870 . . 5 ALA CB . 27233 1 22 . 1 . 1 5 5 ALA N N 15 124.1035 . . 1 . . 489862 . . 5 ALA N . 27233 1 23 . 1 . 1 6 6 PRO C C 13 174.1846 . . 1 . . 487624 . . 6 PRO C . 27233 1 24 . 1 . 1 6 6 PRO CA C 13 59.9911 . . 1 . . 486478 . . 6 PRO CA . 27233 1 25 . 1 . 1 6 6 PRO CB C 13 28.6406 . . 1 . . 485341 . . 6 PRO CB . 27233 1 26 . 1 . 1 7 7 LEU H H 1 7.7699 . . 1 . . 486045 . . 7 LEU H . 27233 1 27 . 1 . 1 7 7 LEU C C 13 175.7649 . . 1 . . 488200 . . 7 LEU C . 27233 1 28 . 1 . 1 7 7 LEU CA C 13 49.1744 . . 1 . . 486433 . . 7 LEU CA . 27233 1 29 . 1 . 1 7 7 LEU CB C 13 41.3881 . . 1 . . 488467 . . 7 LEU CB . 27233 1 30 . 1 . 1 7 7 LEU N N 15 119.7509 . . 1 . . 486047 . . 7 LEU N . 27233 1 31 . 1 . 1 8 8 ARG H H 1 9.6253 . . 1 . . 486846 . . 8 ARG H . 27233 1 32 . 1 . 1 8 8 ARG C C 13 177.8677 . . 1 . . 486847 . . 8 ARG C . 27233 1 33 . 1 . 1 8 8 ARG CA C 13 55.7163 . . 1 . . 486199 . . 8 ARG CA . 27233 1 34 . 1 . 1 8 8 ARG CB C 13 25.8778 . . 1 . . 488209 . . 8 ARG CB . 27233 1 35 . 1 . 1 8 8 ARG N N 15 122.5361 . . 1 . . 486848 . . 8 ARG N . 27233 1 36 . 1 . 1 9 9 GLY H H 1 9.1367 . . 1 . . 486198 . . 9 GLY H . 27233 1 37 . 1 . 1 9 9 GLY C C 13 172.4646 . . 1 . . 489675 . . 9 GLY C . 27233 1 38 . 1 . 1 9 9 GLY CA C 13 42.9596 . . 1 . . 486187 . . 9 GLY CA . 27233 1 39 . 1 . 1 9 9 GLY N N 15 115.0897 . . 1 . . 486200 . . 9 GLY N . 27233 1 40 . 1 . 1 10 10 GLN H H 1 8.0938 . . 1 . . 486147 . . 10 GLN H . 27233 1 41 . 1 . 1 10 10 GLN C C 13 174.0528 . . 1 . . 487069 . . 10 GLN C . 27233 1 42 . 1 . 1 10 10 GLN CA C 13 53.3788 . . 1 . . 486136 . . 10 GLN CA . 27233 1 43 . 1 . 1 10 10 GLN CB C 13 27.8791 . . 1 . . 488668 . . 10 GLN CB . 27233 1 44 . 1 . 1 10 10 GLN N N 15 116.9444 . . 1 . . 486149 . . 10 GLN N . 27233 1 45 . 1 . 1 11 11 VAL H H 1 8.6742 . . 1 . . 485982 . . 11 VAL H . 27233 1 46 . 1 . 1 11 11 VAL C C 13 174.1030 . . 1 . . 486952 . . 11 VAL C . 27233 1 47 . 1 . 1 11 11 VAL CA C 13 57.5683 . . 1 . . 485725 . . 11 VAL CA . 27233 1 48 . 1 . 1 11 11 VAL N N 15 120.2432 . . 1 . . 485984 . . 11 VAL N . 27233 1 49 . 1 . 1 12 12 TYR H H 1 9.2320 . . 1 . . 487533 . . 12 TYR H . 27233 1 50 . 1 . 1 12 12 TYR CA C 13 53.7102 . . 1 . . 485734 . . 12 TYR CA . 27233 1 51 . 1 . 1 12 12 TYR CB C 13 39.9082 . . 1 . . 488035 . . 12 TYR CB . 27233 1 52 . 1 . 1 12 12 TYR N N 15 124.3749 . . 1 . . 487535 . . 12 TYR N . 27233 1 53 . 1 . 1 13 13 ALA H H 1 9.1701 . . 1 . . 485760 . . 13 ALA H . 27233 1 54 . 1 . 1 13 13 ALA C C 13 177.2263 . . 1 . . 486763 . . 13 ALA C . 27233 1 55 . 1 . 1 13 13 ALA CA C 13 48.7277 . . 1 . . 486496 . . 13 ALA CA . 27233 1 56 . 1 . 1 13 13 ALA CB C 13 16.0788 . . 1 . . 487891 . . 13 ALA CB . 27233 1 57 . 1 . 1 13 13 ALA N N 15 124.9746 . . 1 . . 485762 . . 13 ALA N . 27233 1 58 . 1 . 1 14 14 CYS H H 1 9.2577 . . 1 . . 485349 . . 14 CYS H . 27233 1 59 . 1 . 1 14 14 CYS C C 13 173.3431 . . 1 . . 486973 . . 14 CYS C . 27233 1 60 . 1 . 1 14 14 CYS CA C 13 55.5885 . . 1 . . 486337 . . 14 CYS CA . 27233 1 61 . 1 . 1 14 14 CYS CB C 13 26.3992 . . 1 . . 487807 . . 14 CYS CB . 27233 1 62 . 1 . 1 14 14 CYS N N 15 119.7518 . . 1 . . 485351 . . 14 CYS N . 27233 1 63 . 1 . 1 15 15 ASP H H 1 9.3114 . . 1 . . 486693 . . 15 ASP H . 27233 1 64 . 1 . 1 15 15 ASP C C 13 174.7536 . . 1 . . 486694 . . 15 ASP C . 27233 1 65 . 1 . 1 15 15 ASP CA C 13 50.6955 . . 1 . . 486343 . . 15 ASP CA . 27233 1 66 . 1 . 1 15 15 ASP N N 15 128.3938 . . 1 . . 486695 . . 15 ASP N . 27233 1 67 . 1 . 1 16 16 LEU H H 1 8.8288 . . 1 . . 486342 . . 16 LEU H . 27233 1 68 . 1 . 1 16 16 LEU C C 13 176.8825 . . 1 . . 489660 . . 16 LEU C . 27233 1 69 . 1 . 1 16 16 LEU CA C 13 51.6502 . . 1 . . 485686 . . 16 LEU CA . 27233 1 70 . 1 . 1 16 16 LEU N N 15 127.5367 . . 1 . . 486344 . . 16 LEU N . 27233 1 71 . 1 . 1 17 17 GLY H H 1 8.7693 . . 1 . . 489650 . . 17 GLY H . 27233 1 72 . 1 . 1 17 17 GLY C C 13 173.8768 . . 1 . . 489657 . . 17 GLY C . 27233 1 73 . 1 . 1 17 17 GLY CA C 13 42.8831 . . 1 . . 489654 . . 17 GLY CA . 27233 1 74 . 1 . 1 17 17 GLY N N 15 109.2689 . . 1 . . 489652 . . 17 GLY N . 27233 1 75 . 1 . 1 18 18 ALA C C 13 176.5749 . . 1 . . 489330 . . 18 ALA C . 27233 1 76 . 1 . 1 18 18 ALA CA C 13 48.3664 . . 1 . . 489333 . . 18 ALA CA . 27233 1 77 . 1 . 1 18 18 ALA CB C 13 15.4033 . . 1 . . . . . 18 ALA CB . 27233 1 78 . 1 . 1 19 19 GLY H H 1 8.2909 . . 1 . . 489311 . . 19 GLY H . 27233 1 79 . 1 . 1 19 19 GLY C C 13 173.3280 . . 1 . . 489321 . . 19 GLY C . 27233 1 80 . 1 . 1 19 19 GLY CA C 13 41.2468 . . 1 . . 485833 . . 19 GLY CA . 27233 1 81 . 1 . 1 19 19 GLY N N 15 110.3896 . . 1 . . 489313 . . 19 GLY N . 27233 1 82 . 1 . 1 20 20 ALA H H 1 8.4774 . . 1 . . 484560 . . 20 ALA H . 27233 1 83 . 1 . 1 20 20 ALA C C 13 176.9092 . . 1 . . 486817 . . 20 ALA C . 27233 1 84 . 1 . 1 20 20 ALA CA C 13 50.4201 . . 1 . . 485824 . . 20 ALA CA . 27233 1 85 . 1 . 1 20 20 ALA N N 15 123.7484 . . 1 . . 484562 . . 20 ALA N . 27233 1 86 . 1 . 1 21 21 LYS H H 1 8.3851 . . 1 . . 489066 . . 21 LYS H . 27233 1 87 . 1 . 1 21 21 LYS C C 13 173.3275 . . 1 . . 489073 . . 21 LYS C . 27233 1 88 . 1 . 1 21 21 LYS CA C 13 50.2017 . . 1 . . 489067 . . 21 LYS CA . 27233 1 89 . 1 . 1 21 21 LYS CB C 13 30.4019 . . 1 . . 489079 . . 21 LYS CB . 27233 1 90 . 1 . 1 21 21 LYS N N 15 124.3609 . . 1 . . 489068 . . 21 LYS N . 27233 1 91 . 1 . 1 22 22 PRO C C 13 174.9435 . . 1 . . 487570 . . 22 PRO C . 27233 1 92 . 1 . 1 22 22 PRO CA C 13 59.7216 . . 1 . . 486418 . . 22 PRO CA . 27233 1 93 . 1 . 1 22 22 PRO CB C 13 28.3794 . . 1 . . 488215 . . 22 PRO CB . 27233 1 94 . 1 . 1 23 23 TRP H H 1 9.2284 . . 1 . . 487569 . . 23 TRP H . 27233 1 95 . 1 . 1 23 23 TRP C C 13 173.1187 . . 1 . . 489806 . . 23 TRP C . 27233 1 96 . 1 . 1 23 23 TRP CA C 13 54.1528 . . 1 . . 489805 . . 23 TRP CA . 27233 1 97 . 1 . 1 23 23 TRP N N 15 123.0779 . . 1 . . 487571 . . 23 TRP N . 27233 1 98 . 1 . 1 24 24 LEU H H 1 9.4574 . . 1 . . 487554 . . 24 LEU H . 27233 1 99 . 1 . 1 24 24 LEU C C 13 175.3924 . . 1 . . 487504 . . 24 LEU C . 27233 1 100 . 1 . 1 24 24 LEU CA C 13 50.4970 . . 1 . . 485821 . . 24 LEU CA . 27233 1 101 . 1 . 1 24 24 LEU CB C 13 41.9095 . . 1 . . 488149 . . 24 LEU CB . 27233 1 102 . 1 . 1 24 24 LEU N N 15 123.5906 . . 1 . . 487556 . . 24 LEU N . 27233 1 103 . 1 . 1 25 25 ILE H H 1 9.2228 . . 1 . . 485694 . . 25 ILE H . 27233 1 104 . 1 . 1 25 25 ILE C C 13 176.2761 . . 1 . . 486733 . . 25 ILE C . 27233 1 105 . 1 . 1 25 25 ILE CA C 13 58.8998 . . 1 . . 485695 . . 25 ILE CA . 27233 1 106 . 1 . 1 25 25 ILE CB C 13 32.1319 . . 1 . . 487879 . . 25 ILE CB . 27233 1 107 . 1 . 1 25 25 ILE N N 15 126.3628 . . 1 . . 485696 . . 25 ILE N . 27233 1 108 . 1 . 1 26 26 VAL H H 1 9.3206 . . 1 . . 487038 . . 26 VAL H . 27233 1 109 . 1 . 1 26 26 VAL C C 13 174.6877 . . 1 . . 489540 . . 26 VAL C . 27233 1 110 . 1 . 1 26 26 VAL N N 15 117.7807 . . 1 . . 487040 . . 26 VAL N . 27233 1 111 . 1 . 1 27 27 SER H H 1 7.9491 . . 1 . . 486219 . . 27 SER H . 27233 1 112 . 1 . 1 27 27 SER CA C 13 54.3968 . . 1 . . 486220 . . 27 SER CA . 27233 1 113 . 1 . 1 27 27 SER N N 15 113.2053 . . 1 . . 486221 . . 27 SER N . 27233 1 114 . 1 . 1 28 28 ASN H H 1 7.1607 . . 1 . . 487128 . . 28 ASN H . 27233 1 115 . 1 . 1 28 28 ASN C C 13 173.7578 . . 1 . . 487129 . . 28 ASN C . 27233 1 116 . 1 . 1 28 28 ASN CA C 13 51.2305 . . 1 . . 486226 . . 28 ASN CA . 27233 1 117 . 1 . 1 28 28 ASN CB C 13 36.4059 . . 1 . . 488782 . . 28 ASN CB . 27233 1 118 . 1 . 1 28 28 ASN N N 15 113.9045 . . 1 . . 487130 . . 28 ASN N . 27233 1 119 . 1 . 1 29 29 ASN H H 1 8.7206 . . 1 . . 486120 . . 29 ASN H . 27233 1 120 . 1 . 1 29 29 ASN C C 13 177.1805 . . 1 . . 486730 . . 29 ASN C . 27233 1 121 . 1 . 1 29 29 ASN CA C 13 53.4482 . . 1 . . 486109 . . 29 ASN CA . 27233 1 122 . 1 . 1 29 29 ASN N N 15 117.1574 . . 1 . . 486122 . . 29 ASN N . 27233 1 123 . 1 . 1 30 30 ALA H H 1 8.4650 . . 1 . . 485013 . . 30 ALA H . 27233 1 124 . 1 . 1 30 30 ALA C C 13 179.1488 . . 1 . . 488173 . . 30 ALA C . 27233 1 125 . 1 . 1 30 30 ALA CA C 13 53.0400 . . 1 . . 485698 . . 30 ALA CA . 27233 1 126 . 1 . 1 30 30 ALA N N 15 126.3375 . . 1 . . 485015 . . 30 ALA N . 27233 1 127 . 1 . 1 31 31 ARG H H 1 8.2029 . . 1 . . 488157 . . 31 ARG H . 27233 1 128 . 1 . 1 31 31 ARG C C 13 179.7037 . . 1 . . 487636 . . 31 ARG C . 27233 1 129 . 1 . 1 31 31 ARG CA C 13 56.9012 . . 1 . . 486070 . . 31 ARG CA . 27233 1 130 . 1 . 1 31 31 ARG N N 15 122.3678 . . 1 . . 488159 . . 31 ARG N . 27233 1 131 . 1 . 1 32 32 ASN H H 1 8.1699 . . 1 . . 484683 . . 32 ASN H . 27233 1 132 . 1 . 1 32 32 ASN C C 13 175.6719 . . 1 . . 487681 . . 32 ASN C . 27233 1 133 . 1 . 1 32 32 ASN CA C 13 52.8581 . . 1 . . 486139 . . 32 ASN CA . 27233 1 134 . 1 . 1 32 32 ASN N N 15 118.1537 . . 1 . . 484685 . . 32 ASN N . 27233 1 135 . 1 . 1 33 33 ARG H H 1 7.6845 . . 1 . . 485439 . . 33 ARG H . 27233 1 136 . 1 . 1 33 33 ARG C C 13 177.0485 . . 1 . . 487060 . . 33 ARG C . 27233 1 137 . 1 . 1 33 33 ARG CA C 13 55.7587 . . 1 . . 486133 . . 33 ARG CA . 27233 1 138 . 1 . 1 33 33 ARG CB C 13 27.2367 . . 1 . . 484708 . . 33 ARG CB . 27233 1 139 . 1 . 1 33 33 ARG N N 15 116.4752 . . 1 . . 485441 . . 33 ARG N . 27233 1 140 . 1 . 1 34 34 HIS H H 1 7.7905 . . 1 . . 487116 . . 34 HIS H . 27233 1 141 . 1 . 1 34 34 HIS C C 13 174.8688 . . 1 . . 487735 . . 34 HIS C . 27233 1 142 . 1 . 1 34 34 HIS CA C 13 54.9874 . . 1 . . 486205 . . 34 HIS CA . 27233 1 143 . 1 . 1 34 34 HIS CB C 13 28.1504 . . 1 . . 488815 . . 34 HIS CB . 27233 1 144 . 1 . 1 34 34 HIS N N 15 114.7504 . . 1 . . 487118 . . 34 HIS N . 27233 1 145 . 1 . 1 35 35 THR H H 1 7.8634 . . 1 . . 486246 . . 35 THR H . 27233 1 146 . 1 . 1 35 35 THR C C 13 172.4621 . . 1 . . 488596 . . 35 THR C . 27233 1 147 . 1 . 1 35 35 THR CA C 13 58.7173 . . 1 . . 488581 . . 35 THR CA . 27233 1 148 . 1 . 1 35 35 THR N N 15 112.0206 . . 1 . . 486248 . . 35 THR N . 27233 1 149 . 1 . 1 36 36 ALA H H 1 8.2594 . . 1 . . 488580 . . 36 ALA H . 27233 1 150 . 1 . 1 36 36 ALA C C 13 175.9819 . . 1 . . 487645 . . 36 ALA C . 27233 1 151 . 1 . 1 36 36 ALA CA C 13 49.9195 . . 1 . . 488584 . . 36 ALA CA . 27233 1 152 . 1 . 1 36 36 ALA CB C 13 15.7830 . . 1 . . 488593 . . 36 ALA CB . 27233 1 153 . 1 . 1 36 36 ALA N N 15 119.0935 . . 1 . . 488582 . . 36 ALA N . 27233 1 154 . 1 . 1 37 37 ASP H H 1 8.0566 . . 1 . . 487002 . . 37 ASP H . 27233 1 155 . 1 . 1 37 37 ASP C C 13 172.2269 . . 1 . . 487018 . . 37 ASP C . 27233 1 156 . 1 . 1 37 37 ASP CA C 13 49.5843 . . 1 . . 486625 . . 37 ASP CA . 27233 1 157 . 1 . 1 37 37 ASP N N 15 118.3032 . . 1 . . 487004 . . 37 ASP N . 27233 1 158 . 1 . 1 38 38 VAL H H 1 8.7441 . . 1 . . 485562 . . 38 VAL H . 27233 1 159 . 1 . 1 38 38 VAL C C 13 173.0551 . . 1 . . 487171 . . 38 VAL C . 27233 1 160 . 1 . 1 38 38 VAL CA C 13 56.1060 . . 1 . . 489264 . . 38 VAL CA . 27233 1 161 . 1 . 1 38 38 VAL CB C 13 32.6323 . . 1 . . 488914 . . 38 VAL CB . 27233 1 162 . 1 . 1 38 38 VAL N N 15 107.7211 . . 1 . . 485564 . . 38 VAL N . 27233 1 163 . 1 . 1 39 39 VAL H H 1 8.5836 . . 1 . . 489260 . . 39 VAL H . 27233 1 164 . 1 . 1 39 39 VAL C C 13 174.1065 . . 1 . . 489267 . . 39 VAL C . 27233 1 165 . 1 . 1 39 39 VAL CA C 13 58.1493 . . 1 . . 487783 . . 39 VAL CA . 27233 1 166 . 1 . 1 39 39 VAL CB C 13 30.1306 . . 1 . . 489273 . . 39 VAL CB . 27233 1 167 . 1 . 1 39 39 VAL N N 15 118.4027 . . 1 . . 489262 . . 39 VAL N . 27233 1 168 . 1 . 1 40 40 ALA H H 1 9.4837 . . 1 . . 485649 . . 40 ALA H . 27233 1 169 . 1 . 1 40 40 ALA C C 13 174.0505 . . 1 . . 488872 . . 40 ALA C . 27233 1 170 . 1 . 1 40 40 ALA CA C 13 48.1875 . . 1 . . 485650 . . 40 ALA CA . 27233 1 171 . 1 . 1 40 40 ALA CB C 13 22.6446 . . 1 . . 487789 . . 40 ALA CB . 27233 1 172 . 1 . 1 40 40 ALA N N 15 130.4717 . . 1 . . 485651 . . 40 ALA N . 27233 1 173 . 1 . 1 41 41 VAL H H 1 8.8619 . . 1 . . 488856 . . 41 VAL H . 27233 1 174 . 1 . 1 41 41 VAL C C 13 174.5826 . . 1 . . 488863 . . 41 VAL C . 27233 1 175 . 1 . 1 41 41 VAL CA C 13 55.7077 . . 1 . . 488857 . . 41 VAL CA . 27233 1 176 . 1 . 1 41 41 VAL N N 15 109.6027 . . 1 . . 488858 . . 41 VAL N . 27233 1 177 . 1 . 1 42 42 ARG C C 13 174.4930 . . 1 . . 487540 . . 42 ARG C . 27233 1 178 . 1 . 1 42 42 ARG CA C 13 53.2211 . . 1 . . 486400 . . 42 ARG CA . 27233 1 179 . 1 . 1 42 42 ARG CB C 13 28.3794 . . 1 . . 488059 . . 42 ARG CB . 27233 1 180 . 1 . 1 43 43 LEU H H 1 7.3963 . . 1 . . 486828 . . 43 LEU H . 27233 1 181 . 1 . 1 43 43 LEU C C 13 175.8151 . . 1 . . 487678 . . 43 LEU C . 27233 1 182 . 1 . 1 43 43 LEU CA C 13 51.7214 . . 1 . . 486172 . . 43 LEU CA . 27233 1 183 . 1 . 1 43 43 LEU CB C 13 39.3868 . . 1 . . 488065 . . 43 LEU CB . 27233 1 184 . 1 . 1 43 43 LEU N N 15 123.3725 . . 1 . . 486830 . . 43 LEU N . 27233 1 185 . 1 . 1 44 44 THR H H 1 9.1845 . . 1 . . 486171 . . 44 THR H . 27233 1 186 . 1 . 1 44 44 THR C C 13 172.4124 . . 1 . . 488659 . . 44 THR C . 27233 1 187 . 1 . 1 44 44 THR CA C 13 56.5644 . . 1 . . 486163 . . 44 THR CA . 27233 1 188 . 1 . 1 44 44 THR CB C 13 66.6760 . . 1 . . 488653 . . 44 THR CB . 27233 1 189 . 1 . 1 44 44 THR N N 15 116.0145 . . 1 . . 486173 . . 44 THR N . 27233 1 190 . 1 . 1 53 53 TRP CA C 13 51.3766 . . 1 . . 491282 . . 53 TRP CA . 27233 1 191 . 1 . 1 53 53 TRP C C 13 177.2263 . . 1 . . 491279 . . 53 TRP C . 27233 1 192 . 1 . 1 54 54 VAL N N 15 121.7423 . . 1 . . 491280 . . 54 VAL N . 27233 1 193 . 1 . 1 54 54 VAL H H 1 8.4427 . . 1 . . 491278 . . 54 VAL H . 27233 1 194 . 1 . 1 54 54 VAL CA C 13 60.3357 . . 1 . . 491288 . . 54 VAL CA . 27233 1 195 . 1 . 1 55 55 ALA N N 15 124.1532 . . 1 . . 490221 . . 55 ALA N . 27233 1 196 . 1 . 1 55 55 ALA H H 1 8.0059 . . 1 . . 490219 . . 55 ALA H . 27233 1 197 . 1 . 1 55 55 ALA CA C 13 52.1453 . . 1 . . 490223 . . 55 ALA CA . 27233 1 198 . 1 . 1 56 56 MET N N 15 119.9992 . . 1 . . 490482 . . 56 MET N . 27233 1 199 . 1 . 1 56 56 MET H H 1 18.1680 . . 1 . . 490480 . . 56 MET H . 27233 1 200 . 1 . 1 56 56 MET CA C 13 50.3941 . . 1 . . 490295 . . 56 MET CA . 27233 1 201 . 1 . 1 56 56 MET CB C 13 35.6343 . . 1 . . 490511 . . 56 MET CB . 27233 1 202 . 1 . 1 56 56 MET C C 13 173.6158 . . 1 . . 490484 . . 56 MET C . 27233 1 203 . 1 . 1 57 57 GLY N N 15 124.3776 . . 1 . . 490275 . . 57 GLY N . 27233 1 204 . 1 . 1 57 57 GLY H H 1 8.0327 . . 1 . . 490273 . . 57 GLY H . 27233 1 205 . 1 . 1 57 57 GLY CA C 13 47.3791 . . 1 . . 490292 . . 57 GLY CA . 27233 1 206 . 1 . 1 57 57 GLY C C 13 172.9281 . . 1 . . 490283 . . 57 GLY C . 27233 1 207 . 1 . 1 61 61 PRO C C 13 174.3536 . . 1 . . 487684 . . 61 PRO C . 27233 1 208 . 1 . 1 61 61 PRO CA C 13 62.2181 . . 1 . . 486544 . . 61 PRO CA . 27233 1 209 . 1 . 1 61 61 PRO CB C 13 27.9009 . . 1 . . 488008 . . 61 PRO CB . 27233 1 210 . 1 . 1 62 62 LEU H H 1 6.7803 . . 1 . . 485424 . . 62 LEU H . 27233 1 211 . 1 . 1 62 62 LEU C C 13 174.7472 . . 1 . . 487066 . . 62 LEU C . 27233 1 212 . 1 . 1 62 62 LEU CA C 13 50.7444 . . 1 . . 486259 . . 62 LEU CA . 27233 1 213 . 1 . 1 62 62 LEU CB C 13 41.6594 . . 1 . . 489589 . . 62 LEU CB . 27233 1 214 . 1 . 1 62 62 LEU N N 15 116.3652 . . 1 . . 485426 . . 62 LEU N . 27233 1 215 . 1 . 1 63 63 THR H H 1 7.7936 . . 1 . . 487140 . . 63 THR H . 27233 1 216 . 1 . 1 63 63 THR C C 13 172.8422 . . 1 . . 487144 . . 63 THR C . 27233 1 217 . 1 . 1 63 63 THR CA C 13 58.1946 . . 1 . . 486250 . . 63 THR CA . 27233 1 218 . 1 . 1 63 63 THR N N 15 111.6424 . . 1 . . 487142 . . 63 THR N . 27233 1 219 . 1 . 1 64 64 GLY H H 1 7.8672 . . 1 . . 485556 . . 64 GLY H . 27233 1 220 . 1 . 1 64 64 GLY C C 13 171.3808 . . 1 . . 488476 . . 64 GLY C . 27233 1 221 . 1 . 1 64 64 GLY CA C 13 41.1515 . . 1 . . 488929 . . 64 GLY CA . 27233 1 222 . 1 . 1 64 64 GLY N N 15 107.2196 . . 1 . . 485558 . . 64 GLY N . 27233 1 223 . 1 . 1 65 65 TYR H H 1 8.9629 . . 1 . . 485331 . . 65 TYR H . 27233 1 224 . 1 . 1 65 65 TYR C C 13 173.8694 . . 1 . . 489838 . . 65 TYR C . 27233 1 225 . 1 . 1 65 65 TYR CA C 13 53.7728 . . 1 . . 485944 . . 65 TYR CA . 27233 1 226 . 1 . 1 65 65 TYR N N 15 119.7728 . . 1 . . 485333 . . 65 TYR N . 27233 1 227 . 1 . 1 66 66 VAL H H 1 9.4790 . . 1 . . 486912 . . 66 VAL H . 27233 1 228 . 1 . 1 66 66 VAL C C 13 173.6418 . . 1 . . 486913 . . 66 VAL C . 27233 1 229 . 1 . 1 66 66 VAL CA C 13 58.8720 . . 1 . . 485935 . . 66 VAL CA . 27233 1 230 . 1 . 1 66 66 VAL N N 15 121.4881 . . 1 . . 486914 . . 66 VAL N . 27233 1 231 . 1 . 1 67 67 ASN H H 1 8.1244 . . 1 . . 489810 . . 67 ASN H . 27233 1 232 . 1 . 1 67 67 ASN CA C 13 47.7495 . . 1 . . 489814 . . 67 ASN CA . 27233 1 233 . 1 . 1 67 67 ASN N N 15 124.4992 . . 1 . . 489812 . . 67 ASN N . 27233 1 234 . 1 . 1 68 68 ALA H H 1 7.9607 . . 1 . . 486786 . . 68 ALA H . 27233 1 235 . 1 . 1 68 68 ALA C C 13 172.8313 . . 1 . . 489736 . . 68 ALA C . 27233 1 236 . 1 . 1 68 68 ALA CA C 13 50.1543 . . 1 . . 486289 . . 68 ALA CA . 27233 1 237 . 1 . 1 68 68 ALA CB C 13 14.1721 . . 1 . . 489735 . . 68 ALA CB . 27233 1 238 . 1 . 1 68 68 ALA N N 15 124.0668 . . 1 . . 486788 . . 68 ALA N . 27233 1 239 . 1 . 1 69 69 ASP H H 1 7.5707 . . 1 . . 485547 . . 69 ASP H . 27233 1 240 . 1 . 1 69 69 ASP C C 13 177.3412 . . 1 . . 487168 . . 69 ASP C . 27233 1 241 . 1 . 1 69 69 ASP CA C 13 53.1529 . . 1 . . 486460 . . 69 ASP CA . 27233 1 242 . 1 . 1 69 69 ASP N N 15 108.6082 . . 1 . . 485549 . . 69 ASP N . 27233 1 243 . 1 . 1 70 70 ASN H H 1 7.0407 . . 1 . . 486954 . . 70 ASN H . 27233 1 244 . 1 . 1 70 70 ASN C C 13 170.6931 . . 1 . . 487930 . . 70 ASN C . 27233 1 245 . 1 . 1 70 70 ASN CA C 13 49.1048 . . 1 . . 485758 . . 70 ASN CA . 27233 1 246 . 1 . 1 70 70 ASN CB C 13 35.1550 . . 1 . . 488434 . . 70 ASN CB . 27233 1 247 . 1 . 1 70 70 ASN N N 15 120.1126 . . 1 . . 486956 . . 70 ASN N . 27233 1 248 . 1 . 1 71 71 ILE H H 1 6.3948 . . 1 . . 485721 . . 71 ILE H . 27233 1 249 . 1 . 1 71 71 ILE C C 13 174.6887 . . 1 . . 486778 . . 71 ILE C . 27233 1 250 . 1 . 1 71 71 ILE CA C 13 58.0690 . . 1 . . 485722 . . 71 ILE CA . 27233 1 251 . 1 . 1 71 71 ILE CB C 13 37.1353 . . 1 . . 487939 . . 71 ILE CB . 27233 1 252 . 1 . 1 71 71 ILE N N 15 124.6174 . . 1 . . 485723 . . 71 ILE N . 27233 1 253 . 1 . 1 72 72 GLU H H 1 8.9565 . . 1 . . 486780 . . 72 GLU H . 27233 1 254 . 1 . 1 72 72 GLU C C 13 174.4689 . . 1 . . 486781 . . 72 GLU C . 27233 1 255 . 1 . 1 72 72 GLU CA C 13 52.2924 . . 1 . . 485737 . . 72 GLU CA . 27233 1 256 . 1 . 1 72 72 GLU CB C 13 31.1313 . . 1 . . 488017 . . 72 GLU CB . 27233 1 257 . 1 . 1 72 72 GLU N N 15 124.2750 . . 1 . . 486782 . . 72 GLU N . 27233 1 258 . 1 . 1 73 73 THR H H 1 8.0303 . . 1 . . 486099 . . 73 THR H . 27233 1 259 . 1 . 1 73 73 THR C C 13 173.5413 . . 1 . . 489738 . . 73 THR C . 27233 1 260 . 1 . 1 73 73 THR CA C 13 59.8225 . . 1 . . 485662 . . 73 THR CA . 27233 1 261 . 1 . 1 73 73 THR N N 15 117.2577 . . 1 . . 486101 . . 73 THR N . 27233 1 262 . 1 . 1 74 74 LEU H H 1 9.0018 . . 1 . . 485661 . . 74 LEU H . 27233 1 263 . 1 . 1 74 74 LEU C C 13 175.8066 . . 1 . . 487825 . . 74 LEU C . 27233 1 264 . 1 . 1 74 74 LEU CA C 13 50.1439 . . 1 . . 489587 . . 74 LEU CA . 27233 1 265 . 1 . 1 74 74 LEU CB C 13 41.1379 . . 1 . . 487822 . . 74 LEU CB . 27233 1 266 . 1 . 1 74 74 LEU N N 15 128.3773 . . 1 . . 485663 . . 74 LEU N . 27233 1 267 . 1 . 1 75 75 GLY H H 1 9.1207 . . 1 . . 489568 . . 75 GLY H . 27233 1 268 . 1 . 1 75 75 GLY C C 13 175.5070 . . 1 . . 489575 . . 75 GLY C . 27233 1 269 . 1 . 1 75 75 GLY CA C 13 42.9665 . . 1 . . 485830 . . 75 GLY CA . 27233 1 270 . 1 . 1 75 75 GLY N N 15 109.3580 . . 1 . . 489570 . . 75 GLY N . 27233 1 271 . 1 . 1 76 76 LYS H H 1 8.5132 . . 1 . . 487524 . . 76 LYS H . 27233 1 272 . 1 . 1 76 76 LYS C C 13 177.7076 . . 1 . . 487081 . . 76 LYS C . 27233 1 273 . 1 . 1 76 76 LYS CA C 13 57.8654 . . 1 . . 486556 . . 76 LYS CA . 27233 1 274 . 1 . 1 76 76 LYS N N 15 123.5080 . . 1 . . 487526 . . 76 LYS N . 27233 1 275 . 1 . 1 77 77 ASP H H 1 8.7027 . . 1 . . 487080 . . 77 ASP H . 27233 1 276 . 1 . 1 77 77 ASP C C 13 175.9392 . . 1 . . 487036 . . 77 ASP C . 27233 1 277 . 1 . 1 77 77 ASP CA C 13 52.5831 . . 1 . . 486532 . . 77 ASP CA . 27233 1 278 . 1 . 1 77 77 ASP CB C 13 35.6554 . . 1 . . 484723 . . 77 ASP CB . 27233 1 279 . 1 . 1 77 77 ASP N N 15 115.4823 . . 1 . . 487082 . . 77 ASP N . 27233 1 280 . 1 . 1 78 78 GLU H H 1 7.5887 . . 1 . . 484692 . . 78 GLU H . 27233 1 281 . 1 . 1 78 78 GLU CA C 13 53.6183 . . 1 . . 486112 . . 78 GLU CA . 27233 1 282 . 1 . 1 78 78 GLU CB C 13 26.1490 . . 1 . . 484693 . . 78 GLU CB . 27233 1 283 . 1 . 1 78 78 GLU N N 15 117.7485 . . 1 . . 484694 . . 78 GLU N . 27233 1 284 . 1 . 1 79 79 LEU H H 1 6.9020 . . 1 . . 485367 . . 79 LEU H . 27233 1 285 . 1 . 1 79 79 LEU C C 13 176.6577 . . 1 . . 487009 . . 79 LEU C . 27233 1 286 . 1 . 1 79 79 LEU CA C 13 53.0689 . . 1 . . 486079 . . 79 LEU CA . 27233 1 287 . 1 . 1 79 79 LEU CB C 13 37.6356 . . 1 . . 488515 . . 79 LEU CB . 27233 1 288 . 1 . 1 79 79 LEU N N 15 118.6967 . . 1 . . 485369 . . 79 LEU N . 27233 1 289 . 1 . 1 80 80 GLY H H 1 8.1783 . . 1 . . 485472 . . 80 GLY H . 27233 1 290 . 1 . 1 80 80 GLY CA C 13 41.8576 . . 1 . . 486412 . . 80 GLY CA . 27233 1 291 . 1 . 1 80 80 GLY N N 15 114.2986 . . 1 . . 485474 . . 80 GLY N . 27233 1 292 . 1 . 1 81 81 ASP H H 1 8.2789 . . 1 . . 485112 . . 81 ASP H . 27233 1 293 . 1 . 1 81 81 ASP C C 13 175.0327 . . 1 . . 488227 . . 81 ASP C . 27233 1 294 . 1 . 1 81 81 ASP CA C 13 52.8757 . . 1 . . 488233 . . 81 ASP CA . 27233 1 295 . 1 . 1 81 81 ASP CB C 13 37.6567 . . 1 . . 484537 . . 81 ASP CB . 27233 1 296 . 1 . 1 81 81 ASP N N 15 123.3575 . . 1 . . 485114 . . 81 ASP N . 27233 1 297 . 1 . 1 82 82 TYR H H 1 8.4597 . . 1 . . 486903 . . 82 TYR H . 27233 1 298 . 1 . 1 82 82 TYR CA C 13 54.8971 . . 1 . . 487831 . . 82 TYR CA . 27233 1 299 . 1 . 1 82 82 TYR CB C 13 34.9049 . . 1 . . 488248 . . 82 TYR CB . 27233 1 300 . 1 . 1 82 82 TYR N N 15 121.7656 . . 1 . . 486905 . . 82 TYR N . 27233 1 301 . 1 . 1 83 83 LEU H H 1 8.6375 . . 1 . . 485688 . . 83 LEU H . 27233 1 302 . 1 . 1 83 83 LEU C C 13 175.4253 . . 1 . . 486715 . . 83 LEU C . 27233 1 303 . 1 . 1 83 83 LEU CA C 13 51.6265 . . 1 . . 485689 . . 83 LEU CA . 27233 1 304 . 1 . 1 83 83 LEU N N 15 127.2096 . . 1 . . 485690 . . 83 LEU N . 27233 1 305 . 1 . 1 84 84 GLY H H 1 5.5553 . . 1 . . 486312 . . 84 GLY H . 27233 1 306 . 1 . 1 84 84 GLY C C 13 169.0965 . . 1 . . 487180 . . 84 GLY C . 27233 1 307 . 1 . 1 84 84 GLY N N 15 103.9014 . . 1 . . 486314 . . 84 GLY N . 27233 1 308 . 1 . 1 90 90 THR C C 13 176.2899 . . 1 . . 487561 . . 90 THR C . 27233 1 309 . 1 . 1 90 90 THR CA C 13 63.6699 . . 1 . . 486415 . . 90 THR CA . 27233 1 310 . 1 . 1 91 91 MET H H 1 8.8570 . . 1 . . 487560 . . 91 MET H . 27233 1 311 . 1 . 1 91 91 MET C C 13 177.6378 . . 1 . . 486850 . . 91 MET C . 27233 1 312 . 1 . 1 91 91 MET CA C 13 54.2185 . . 1 . . 485887 . . 91 MET CA . 27233 1 313 . 1 . 1 91 91 MET CB C 13 26.6494 . . 1 . . 488188 . . 91 MET CB . 27233 1 314 . 1 . 1 91 91 MET N N 15 122.7740 . . 1 . . 487562 . . 91 MET N . 27233 1 315 . 1 . 1 92 92 ASN H H 1 8.3035 . . 1 . . 486105 . . 92 ASN H . 27233 1 316 . 1 . 1 92 92 ASN C C 13 177.8800 . . 1 . . 487000 . . 92 ASN C . 27233 1 317 . 1 . 1 92 92 ASN CA C 13 54.0076 . . 1 . . 486511 . . 92 ASN CA . 27233 1 318 . 1 . 1 92 92 ASN CB C 13 34.6396 . . 1 . . 484690 . . 92 ASN CB . 27233 1 319 . 1 . 1 92 92 ASN N N 15 117.3949 . . 1 . . 486107 . . 92 ASN N . 27233 1 320 . 1 . 1 93 93 LYS H H 1 7.3330 . . 1 . . 485382 . . 93 LYS H . 27233 1 321 . 1 . 1 93 93 LYS C C 13 179.7193 . . 1 . . 486991 . . 93 LYS C . 27233 1 322 . 1 . 1 93 93 LYS CA C 13 56.6605 . . 1 . . 485095 . . 93 LYS CA . 27233 1 323 . 1 . 1 93 93 LYS CB C 13 29.6303 . . 1 . . 488512 . . 93 LYS CB . 27233 1 324 . 1 . 1 93 93 LYS N N 15 118.9765 . . 1 . . 485384 . . 93 LYS N . 27233 1 325 . 1 . 1 94 94 ILE H H 1 8.3573 . . 1 . . 486819 . . 94 ILE H . 27233 1 326 . 1 . 1 94 94 ILE C C 13 176.3603 . . 1 . . 486928 . . 94 ILE C . 27233 1 327 . 1 . 1 94 94 ILE CA C 13 62.5740 . . 1 . . 485962 . . 94 ILE CA . 27233 1 328 . 1 . 1 94 94 ILE CB C 13 33.1326 . . 1 . . 487978 . . 94 ILE CB . 27233 1 329 . 1 . 1 94 94 ILE N N 15 123.4692 . . 1 . . 486821 . . 94 ILE N . 27233 1 330 . 1 . 1 95 95 ASN H H 1 8.9176 . . 1 . . 487593 . . 95 ASN H . 27233 1 331 . 1 . 1 95 95 ASN C C 13 176.9354 . . 1 . . 486925 . . 95 ASN C . 27233 1 332 . 1 . 1 95 95 ASN CA C 13 53.8020 . . 1 . . 489303 . . 95 ASN CA . 27233 1 333 . 1 . 1 95 95 ASN CB C 13 33.8831 . . 1 . . 488281 . . 95 ASN CB . 27233 1 334 . 1 . 1 95 95 ASN N N 15 120.5800 . . 1 . . 487595 . . 95 ASN N . 27233 1 335 . 1 . 1 96 96 THR H H 1 7.4589 . . 1 . . 489287 . . 96 THR H . 27233 1 336 . 1 . 1 96 96 THR C C 13 175.5930 . . 1 . . 487843 . . 96 THR C . 27233 1 337 . 1 . 1 96 96 THR CA C 13 64.4034 . . 1 . . 487846 . . 96 THR CA . 27233 1 338 . 1 . 1 96 96 THR N N 15 114.5287 . . 1 . . 489289 . . 96 THR N . 27233 1 339 . 1 . 1 97 97 ALA H H 1 8.0462 . . 1 . . 485691 . . 97 ALA H . 27233 1 340 . 1 . 1 97 97 ALA C C 13 179.0257 . . 1 . . 489724 . . 97 ALA C . 27233 1 341 . 1 . 1 97 97 ALA CA C 13 53.1656 . . 1 . . 486487 . . 97 ALA CA . 27233 1 342 . 1 . 1 97 97 ALA N N 15 126.9176 . . 1 . . 485693 . . 97 ALA N . 27233 1 343 . 1 . 1 98 98 LEU H H 1 9.0851 . . 1 . . 487605 . . 98 LEU H . 27233 1 344 . 1 . 1 98 98 LEU C C 13 177.8366 . . 1 . . 488401 . . 98 LEU C . 27233 1 345 . 1 . 1 98 98 LEU CA C 13 55.1473 . . 1 . . 488407 . . 98 LEU CA . 27233 1 346 . 1 . 1 98 98 LEU N N 15 119.4485 . . 1 . . 487607 . . 98 LEU N . 27233 1 347 . 1 . 1 99 99 ALA H H 1 7.8768 . . 1 . . 487608 . . 99 ALA H . 27233 1 348 . 1 . 1 99 99 ALA C C 13 178.9456 . . 1 . . 488728 . . 99 ALA C . 27233 1 349 . 1 . 1 99 99 ALA CA C 13 53.1926 . . 1 . . 489721 . . 99 ALA CA . 27233 1 350 . 1 . 1 99 99 ALA N N 15 119.9875 . . 1 . . 487610 . . 99 ALA N . 27233 1 351 . 1 . 1 100 100 THR H H 1 8.2409 . . 1 . . 487707 . . 100 THR H . 27233 1 352 . 1 . 1 100 100 THR CA C 13 63.5458 . . 1 . . 486334 . . 100 THR CA . 27233 1 353 . 1 . 1 100 100 THR N N 15 114.3701 . . 1 . . 487709 . . 100 THR N . 27233 1 354 . 1 . 1 101 101 ALA H H 1 9.0949 . . 1 . . 485667 . . 101 ALA H . 27233 1 355 . 1 . 1 101 101 ALA C C 13 179.9420 . . 1 . . 489594 . . 101 ALA C . 27233 1 356 . 1 . 1 101 101 ALA CA C 13 53.4111 . . 1 . . 486562 . . 101 ALA CA . 27233 1 357 . 1 . 1 101 101 ALA N N 15 128.4623 . . 1 . . 485669 . . 101 ALA N . 27233 1 358 . 1 . 1 102 102 LEU H H 1 7.8265 . . 1 . . 485451 . . 102 LEU H . 27233 1 359 . 1 . 1 102 102 LEU C C 13 173.8440 . . 1 . . 487765 . . 102 LEU C . 27233 1 360 . 1 . 1 102 102 LEU CA C 13 51.0177 . . 1 . . 486628 . . 102 LEU CA . 27233 1 361 . 1 . 1 102 102 LEU CB C 13 38.1359 . . 1 . . 489596 . . 102 LEU CB . 27233 1 362 . 1 . 1 102 102 LEU N N 15 115.3253 . . 1 . . 485453 . . 102 LEU N . 27233 1 363 . 1 . 1 103 103 GLY H H 1 7.6933 . . 1 . . 487764 . . 103 GLY H . 27233 1 364 . 1 . 1 103 103 GLY C C 13 173.5573 . . 1 . . 489601 . . 103 GLY C . 27233 1 365 . 1 . 1 103 103 GLY CA C 13 44.3865 . . 1 . . 489618 . . 103 GLY CA . 27233 1 366 . 1 . 1 103 103 GLY N N 15 104.6221 . . 1 . . 487766 . . 103 GLY N . 27233 1 367 . 1 . 1 104 104 LEU H H 1 8.3912 . . 1 . . 489605 . . 104 LEU H . 27233 1 368 . 1 . 1 104 104 LEU C C 13 175.4864 . . 1 . . 489612 . . 104 LEU C . 27233 1 369 . 1 . 1 104 104 LEU CA C 13 49.7909 . . 1 . . 489606 . . 104 LEU CA . 27233 1 370 . 1 . 1 104 104 LEU N N 15 115.7350 . . 1 . . 489607 . . 104 LEU N . 27233 1 stop_ save_