data_52368 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 52368 _Entry.Title ; The backbone assignment of FtsZ C-terminal disordered tail ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2024-03-26 _Entry.Accession_date 2024-03-26 _Entry.Last_release_date 2024-03-27 _Entry.Original_release_date 2024-03-27 _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 1 _Entry.Generated_software_label $software_1 _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 Xiaozhan Qu . . . . 52368 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 52368 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 117 52368 '15N chemical shifts' 58 52368 '1H chemical shifts' 58 52368 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 . . 2024-07-22 . original BMRB . 52368 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 52364 'The methyl assignment of E coli Hsp90 N domain' 52368 BMRB 52366 'The methyl assignment of E coli Hsp90 C domain' 52368 BMRB 52367 'The backbone assignment of disordered protein D131D' 52368 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 52368 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 38890550 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Structural basis for the dynamic chaperoning of disordered clients by Hsp90 ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Nat. Struct. Mol. Biol.' _Citation.Journal_name_full 'Nature structural & molecular biology' _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN 1545-9985 _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year 2024 _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 Xiaozhan Qu X. . . . 52368 1 2 Shuo Zhao S. . . . 52368 1 3 Chanjuan Wan C. . . . 52368 1 4 Lei Zhu L. . . . 52368 1 5 Tuo Ji T. . . . 52368 1 6 Paolo Rossi P. . . . 52368 1 7 Junfeng Wang J. . . . 52368 1 8 Charalampos Kalodimos C. G. . . 52368 1 9 Chao Wang C. . . . 52368 1 10 Weiya Xu W. . . . 52368 1 11 Chengdong Huang C. . . . 52368 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 52368 _Assembly.ID 1 _Assembly.Name 'FtsZ C-terminal disordered tail' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange no _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 'FtsZ C-terminal disordered tail' 1 $entity_1 . . yes native no no . . . 52368 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 52368 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _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 ; TGIGMDKRPEITLVTNKQVQ QPVMDRYQQHGMAPLTQEQK PVAKVVNDNAPQTAKEPDYL DIPAFLRKQAD ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 71 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 . THR . 52368 1 2 . GLY . 52368 1 3 . ILE . 52368 1 4 . GLY . 52368 1 5 . MET . 52368 1 6 . ASP . 52368 1 7 . LYS . 52368 1 8 . ARG . 52368 1 9 . PRO . 52368 1 10 . GLU . 52368 1 11 . ILE . 52368 1 12 . THR . 52368 1 13 . LEU . 52368 1 14 . VAL . 52368 1 15 . THR . 52368 1 16 . ASN . 52368 1 17 . LYS . 52368 1 18 . GLN . 52368 1 19 . VAL . 52368 1 20 . GLN . 52368 1 21 . GLN . 52368 1 22 . PRO . 52368 1 23 . VAL . 52368 1 24 . MET . 52368 1 25 . ASP . 52368 1 26 . ARG . 52368 1 27 . TYR . 52368 1 28 . GLN . 52368 1 29 . GLN . 52368 1 30 . HIS . 52368 1 31 . GLY . 52368 1 32 . MET . 52368 1 33 . ALA . 52368 1 34 . PRO . 52368 1 35 . LEU . 52368 1 36 . THR . 52368 1 37 . GLN . 52368 1 38 . GLU . 52368 1 39 . GLN . 52368 1 40 . LYS . 52368 1 41 . PRO . 52368 1 42 . VAL . 52368 1 43 . ALA . 52368 1 44 . LYS . 52368 1 45 . VAL . 52368 1 46 . VAL . 52368 1 47 . ASN . 52368 1 48 . ASP . 52368 1 49 . ASN . 52368 1 50 . ALA . 52368 1 51 . PRO . 52368 1 52 . GLN . 52368 1 53 . THR . 52368 1 54 . ALA . 52368 1 55 . LYS . 52368 1 56 . GLU . 52368 1 57 . PRO . 52368 1 58 . ASP . 52368 1 59 . TYR . 52368 1 60 . LEU . 52368 1 61 . ASP . 52368 1 62 . ILE . 52368 1 63 . PRO . 52368 1 64 . ALA . 52368 1 65 . PHE . 52368 1 66 . LEU . 52368 1 67 . ARG . 52368 1 68 . LYS . 52368 1 69 . GLN . 52368 1 70 . ALA . 52368 1 71 . ASP . 52368 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 . THR 1 1 52368 1 . GLY 2 2 52368 1 . ILE 3 3 52368 1 . GLY 4 4 52368 1 . MET 5 5 52368 1 . ASP 6 6 52368 1 . LYS 7 7 52368 1 . ARG 8 8 52368 1 . PRO 9 9 52368 1 . GLU 10 10 52368 1 . ILE 11 11 52368 1 . THR 12 12 52368 1 . LEU 13 13 52368 1 . VAL 14 14 52368 1 . THR 15 15 52368 1 . ASN 16 16 52368 1 . LYS 17 17 52368 1 . GLN 18 18 52368 1 . VAL 19 19 52368 1 . GLN 20 20 52368 1 . GLN 21 21 52368 1 . PRO 22 22 52368 1 . VAL 23 23 52368 1 . MET 24 24 52368 1 . ASP 25 25 52368 1 . ARG 26 26 52368 1 . TYR 27 27 52368 1 . GLN 28 28 52368 1 . GLN 29 29 52368 1 . HIS 30 30 52368 1 . GLY 31 31 52368 1 . MET 32 32 52368 1 . ALA 33 33 52368 1 . PRO 34 34 52368 1 . LEU 35 35 52368 1 . THR 36 36 52368 1 . GLN 37 37 52368 1 . GLU 38 38 52368 1 . GLN 39 39 52368 1 . LYS 40 40 52368 1 . PRO 41 41 52368 1 . VAL 42 42 52368 1 . ALA 43 43 52368 1 . LYS 44 44 52368 1 . VAL 45 45 52368 1 . VAL 46 46 52368 1 . ASN 47 47 52368 1 . ASP 48 48 52368 1 . ASN 49 49 52368 1 . ALA 50 50 52368 1 . PRO 51 51 52368 1 . GLN 52 52 52368 1 . THR 53 53 52368 1 . ALA 54 54 52368 1 . LYS 55 55 52368 1 . GLU 56 56 52368 1 . PRO 57 57 52368 1 . ASP 58 58 52368 1 . TYR 59 59 52368 1 . LEU 60 60 52368 1 . ASP 61 61 52368 1 . ILE 62 62 52368 1 . PRO 63 63 52368 1 . ALA 64 64 52368 1 . PHE 65 65 52368 1 . LEU 66 66 52368 1 . ARG 67 67 52368 1 . LYS 68 68 52368 1 . GLN 69 69 52368 1 . ALA 70 70 52368 1 . ASP 71 71 52368 1 stop_ save_ #################### # Natural source # #################### save_natural_source_1 _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source_1 _Entity_natural_src_list.Entry_ID 52368 _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 $entity_1 . 562 organism . 'Escherichia coli' 'E. coli' . . Bacteria . Escherichia coli . . . . . . . . . . . . . 52368 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source_1 _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source_1 _Entity_experimental_src_list.Entry_ID 52368 _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 $entity_1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . plasmid . . pET28a . . . 52368 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 52368 _Sample.ID 1 _Sample.Name 'FtsZ C-terminal disordered tail' _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '93% H2O/7% 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 'FtsZ C-terminal disordered tail' '[U-99% 13C; U-99% 15N]' . . 1 $entity_1 . . 500 . . uM . . . . 52368 1 2 Phosphate 'natural abundance' . . . . . . 50 . . mM . . . . 52368 1 3 NaCl 'natural abundance' . . . . . . 100 . . mM . . . . 52368 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 52368 _Sample_condition_list.ID 1 _Sample_condition_list.Name 'FtsZ C-terminal disordered tail' _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 7.0 . pH 52368 1 pressure 1 . atm 52368 1 temperature 283 . K 52368 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 52368 _Software.ID 1 _Software.Type . _Software.Name SPARKY _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'data analysis' . 52368 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 52368 _Software.ID 2 _Software.Type . _Software.Name NMRViewJ _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 52368 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 52368 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name 'Bruker 600 AVANCE III' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ ############################# # NMR applied experiments # ############################# save_experiment_list_1 _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list_1 _Experiment_list.Entry_ID 52368 _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 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52368 1 2 '3D CBCANH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52368 1 3 '3D CBCA(CO)NH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52368 1 stop_ loop_ _Experiment_file.Experiment_ID _Experiment_file.Experiment_name _Experiment_file.Name _Experiment_file.Type _Experiment_file.Content _Experiment_file.Directory_path _Experiment_file.Details _Experiment_file.Entry_ID _Experiment_file.Experiment_list_ID 1 '2D 1H-15N HSQC' ser . 'Time-domain (raw spectral data)' . . 52368 1 2 '3D CBCANH' serhncacb . 'Time-domain (raw spectral data)' . . 52368 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 52368 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name "FtsZ C-terminal disordered tail'" _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 H 1 water protons . . . . ppm 0 external direct 1 . . . . . 52368 1 N 15 water nitrogen . . . . ppm 0 external direct 1 . . . . . 52368 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_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 52368 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 'The backbone assignment of FtsZ C-terminal disordered tail' _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 $chem_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' . . . 52368 1 2 '3D CBCANH' . . . 52368 1 3 '3D CBCA(CO)NH' . . . 52368 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 52368 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 THR CA C 13 62.0192 0.0000 . 1 . . . . . 1 THR CA . 52368 1 2 . 1 . 1 1 1 THR CB C 13 69.8623 0.0000 . 1 . . . . . 1 THR CB . 52368 1 3 . 1 . 1 2 2 GLY H H 1 8.5472 0.0000 . 1 . . . . . 2 GLY H . 52368 1 4 . 1 . 1 2 2 GLY CA C 13 45.1337 0.0000 . 1 . . . . . 2 GLY CA . 52368 1 5 . 1 . 1 2 2 GLY N N 15 111.8388 0.0000 . 1 . . . . . 2 GLY N . 52368 1 6 . 1 . 1 3 3 ILE H H 1 8.1880 0.0000 . 1 . . . . . 3 ILE H . 52368 1 7 . 1 . 1 3 3 ILE CA C 13 61.2805 0.0000 . 1 . . . . . 3 ILE CA . 52368 1 8 . 1 . 1 3 3 ILE CB C 13 38.6865 0.0000 . 1 . . . . . 3 ILE CB . 52368 1 9 . 1 . 1 3 3 ILE N N 15 120.2768 0.0000 . 1 . . . . . 3 ILE N . 52368 1 10 . 1 . 1 4 4 GLY H H 1 8.6824 0.0000 . 1 . . . . . 4 GLY H . 52368 1 11 . 1 . 1 4 4 GLY CA C 13 45.3592 0.0000 . 1 . . . . . 4 GLY CA . 52368 1 12 . 1 . 1 4 4 GLY N N 15 113.4540 0.0000 . 1 . . . . . 4 GLY N . 52368 1 13 . 1 . 1 5 5 MET H H 1 8.3017 0.0000 . 1 . . . . . 5 MET H . 52368 1 14 . 1 . 1 5 5 MET CA C 13 55.5136 0.0000 . 1 . . . . . 5 MET CA . 52368 1 15 . 1 . 1 5 5 MET CB C 13 32.6986 0.0000 . 1 . . . . . 5 MET CB . 52368 1 16 . 1 . 1 5 5 MET N N 15 119.9909 0.0000 . 1 . . . . . 5 MET N . 52368 1 17 . 1 . 1 6 6 ASP H H 1 8.4804 0.0000 . 1 . . . . . 6 ASP H . 52368 1 18 . 1 . 1 6 6 ASP CA C 13 47.5799 0.0000 . 1 . . . . . 6 ASP CA . 52368 1 19 . 1 . 1 6 6 ASP CB C 13 47.3787 0.0000 . 1 . . . . . 6 ASP CB . 52368 1 20 . 1 . 1 6 6 ASP N N 15 121.4931 0.0000 . 1 . . . . . 6 ASP N . 52368 1 21 . 1 . 1 7 7 LYS H H 1 8.2081 0.0000 . 1 . . . . . 7 LYS H . 52368 1 22 . 1 . 1 7 7 LYS CA C 13 55.8263 0.0000 . 1 . . . . . 7 LYS CA . 52368 1 23 . 1 . 1 7 7 LYS CB C 13 32.6519 0.0000 . 1 . . . . . 7 LYS CB . 52368 1 24 . 1 . 1 7 7 LYS N N 15 121.4265 0.0000 . 1 . . . . . 7 LYS N . 52368 1 25 . 1 . 1 8 8 ARG H H 1 8.4319 0.0000 . 1 . . . . . 8 ARG H . 52368 1 26 . 1 . 1 8 8 ARG CA C 13 54.0139 0.0000 . 1 . . . . . 8 ARG CA . 52368 1 27 . 1 . 1 8 8 ARG CB C 13 29.8017 0.0000 . 1 . . . . . 8 ARG CB . 52368 1 28 . 1 . 1 8 8 ARG N N 15 124.2377 0.0000 . 1 . . . . . 8 ARG N . 52368 1 29 . 1 . 1 10 10 GLU H H 1 8.6568 0.0000 . 1 . . . . . 10 GLU H . 52368 1 30 . 1 . 1 10 10 GLU CA C 13 56.3880 0.0000 . 1 . . . . . 10 GLU CA . 52368 1 31 . 1 . 1 10 10 GLU CB C 13 29.8859 0.0000 . 1 . . . . . 10 GLU CB . 52368 1 32 . 1 . 1 10 10 GLU N N 15 121.4594 0.0000 . 1 . . . . . 10 GLU N . 52368 1 33 . 1 . 1 11 11 ILE H H 1 8.3062 0.0000 . 1 . . . . . 11 ILE H . 52368 1 34 . 1 . 1 11 11 ILE CA C 13 60.9522 0.0000 . 1 . . . . . 11 ILE CA . 52368 1 35 . 1 . 1 11 11 ILE CB C 13 38.5544 0.0000 . 1 . . . . . 11 ILE CB . 52368 1 36 . 1 . 1 11 11 ILE N N 15 122.7599 0.0000 . 1 . . . . . 11 ILE N . 52368 1 37 . 1 . 1 12 12 THR H H 1 8.3351 0.0000 . 1 . . . . . 12 THR H . 52368 1 38 . 1 . 1 12 12 THR CA C 13 62.0488 0.0000 . 1 . . . . . 12 THR CA . 52368 1 39 . 1 . 1 12 12 THR CB C 13 69.6715 0.0000 . 1 . . . . . 12 THR CB . 52368 1 40 . 1 . 1 12 12 THR N N 15 120.1174 0.0000 . 1 . . . . . 12 THR N . 52368 1 41 . 1 . 1 13 13 LEU H H 1 8.3801 0.0000 . 1 . . . . . 13 LEU H . 52368 1 42 . 1 . 1 13 13 LEU CA C 13 55.1227 0.0000 . 1 . . . . . 13 LEU CA . 52368 1 43 . 1 . 1 13 13 LEU CB C 13 42.3368 0.0000 . 1 . . . . . 13 LEU CB . 52368 1 44 . 1 . 1 13 13 LEU N N 15 126.0118 0.0000 . 1 . . . . . 13 LEU N . 52368 1 45 . 1 . 1 14 14 VAL H H 1 8.2972 0.0000 . 1 . . . . . 14 VAL H . 52368 1 46 . 1 . 1 14 14 VAL CA C 13 62.3946 0.0000 . 1 . . . . . 14 VAL CA . 52368 1 47 . 1 . 1 14 14 VAL CB C 13 32.7694 0.0000 . 1 . . . . . 14 VAL CB . 52368 1 48 . 1 . 1 14 14 VAL N N 15 122.6429 0.0000 . 1 . . . . . 14 VAL N . 52368 1 49 . 1 . 1 15 15 THR H H 1 8.3049 0.0000 . 1 . . . . . 15 THR H . 52368 1 50 . 1 . 1 15 15 THR CA C 13 61.6420 0.0000 . 1 . . . . . 15 THR CA . 52368 1 51 . 1 . 1 15 15 THR CB C 13 69.8425 0.0000 . 1 . . . . . 15 THR CB . 52368 1 52 . 1 . 1 15 15 THR N N 15 118.4127 0.0000 . 1 . . . . . 15 THR N . 52368 1 53 . 1 . 1 16 16 ASN H H 1 8.4756 0.0000 . 1 . . . . . 16 ASN H . 52368 1 54 . 1 . 1 16 16 ASN CA C 13 45.7824 0.0000 . 1 . . . . . 16 ASN CA . 52368 1 55 . 1 . 1 16 16 ASN CB C 13 45.4915 0.0000 . 1 . . . . . 16 ASN CB . 52368 1 56 . 1 . 1 16 16 ASN N N 15 121.5584 0.0000 . 1 . . . . . 16 ASN N . 52368 1 57 . 1 . 1 17 17 LYS H H 1 8.3687 0.0000 . 1 . . . . . 17 LYS H . 52368 1 58 . 1 . 1 17 17 LYS CA C 13 55.6972 0.0000 . 1 . . . . . 17 LYS CA . 52368 1 59 . 1 . 1 17 17 LYS CB C 13 32.8705 0.0000 . 1 . . . . . 17 LYS CB . 52368 1 60 . 1 . 1 17 17 LYS N N 15 121.9548 0.0000 . 1 . . . . . 17 LYS N . 52368 1 61 . 1 . 1 18 18 GLN H H 1 8.5769 0.0000 . 1 . . . . . 18 GLN H . 52368 1 62 . 1 . 1 18 18 GLN CA C 13 55.5812 0.0000 . 1 . . . . . 18 GLN CA . 52368 1 63 . 1 . 1 18 18 GLN CB C 13 29.3411 0.0000 . 1 . . . . . 18 GLN CB . 52368 1 64 . 1 . 1 18 18 GLN N N 15 124.6009 0.0000 . 1 . . . . . 18 GLN N . 52368 1 65 . 1 . 1 19 19 VAL H H 1 8.2601 0.0000 . 1 . . . . . 19 VAL H . 52368 1 66 . 1 . 1 19 19 VAL CA C 13 62.3376 0.0000 . 1 . . . . . 19 VAL CA . 52368 1 67 . 1 . 1 19 19 VAL CB C 13 32.7422 0.0000 . 1 . . . . . 19 VAL CB . 52368 1 68 . 1 . 1 19 19 VAL N N 15 122.3045 0.0000 . 1 . . . . . 19 VAL N . 52368 1 69 . 1 . 1 20 20 GLN H H 1 8.5538 0.0000 . 1 . . . . . 20 GLN H . 52368 1 70 . 1 . 1 20 20 GLN CA C 13 55.4720 0.0000 . 1 . . . . . 20 GLN CA . 52368 1 71 . 1 . 1 20 20 GLN CB C 13 29.4002 0.0000 . 1 . . . . . 20 GLN CB . 52368 1 72 . 1 . 1 20 20 GLN N N 15 124.7809 0.0000 . 1 . . . . . 20 GLN N . 52368 1 73 . 1 . 1 21 21 GLN H H 1 8.5708 0.0000 . 1 . . . . . 21 GLN H . 52368 1 74 . 1 . 1 21 21 GLN CA C 13 53.6507 0.0000 . 1 . . . . . 21 GLN CA . 52368 1 75 . 1 . 1 21 21 GLN CB C 13 28.7777 0.0000 . 1 . . . . . 21 GLN CB . 52368 1 76 . 1 . 1 21 21 GLN N N 15 123.7805 0.0000 . 1 . . . . . 21 GLN N . 52368 1 77 . 1 . 1 23 23 VAL H H 1 8.3516 0.0000 . 1 . . . . . 23 VAL H . 52368 1 78 . 1 . 1 23 23 VAL CA C 13 62.4167 0.0000 . 1 . . . . . 23 VAL CA . 52368 1 79 . 1 . 1 23 23 VAL CB C 13 32.8705 0.0000 . 1 . . . . . 23 VAL CB . 52368 1 80 . 1 . 1 23 23 VAL N N 15 121.5664 0.0000 . 1 . . . . . 23 VAL N . 52368 1 81 . 1 . 1 24 24 MET H H 1 8.5899 0.0000 . 1 . . . . . 24 MET H . 52368 1 82 . 1 . 1 24 24 MET CA C 13 55.4015 0.0000 . 1 . . . . . 24 MET CA . 52368 1 83 . 1 . 1 24 24 MET CB C 13 32.6685 0.0000 . 1 . . . . . 24 MET CB . 52368 1 84 . 1 . 1 24 24 MET N N 15 124.7971 0.0000 . 1 . . . . . 24 MET N . 52368 1 85 . 1 . 1 26 26 ARG H H 1 8.2048 0.0000 . 1 . . . . . 26 ARG H . 52368 1 86 . 1 . 1 26 26 ARG CA C 13 56.3010 0.0000 . 1 . . . . . 26 ARG CA . 52368 1 87 . 1 . 1 26 26 ARG CB C 13 30.4617 0.0000 . 1 . . . . . 26 ARG CB . 52368 1 88 . 1 . 1 26 26 ARG N N 15 120.6100 0.0000 . 1 . . . . . 26 ARG N . 52368 1 89 . 1 . 1 27 27 TYR H H 1 8.3194 0.0000 . 1 . . . . . 27 TYR H . 52368 1 90 . 1 . 1 27 27 TYR CA C 13 56.0684 0.0000 . 1 . . . . . 27 TYR CA . 52368 1 91 . 1 . 1 27 27 TYR CB C 13 32.9533 0.0000 . 1 . . . . . 27 TYR CB . 52368 1 92 . 1 . 1 27 27 TYR N N 15 122.9361 0.0000 . 1 . . . . . 27 TYR N . 52368 1 93 . 1 . 1 28 28 GLN H H 1 8.4321 0.0000 . 1 . . . . . 28 GLN H . 52368 1 94 . 1 . 1 28 28 GLN CA C 13 56.2270 0.0000 . 1 . . . . . 28 GLN CA . 52368 1 95 . 1 . 1 28 28 GLN CB C 13 29.6996 0.0000 . 1 . . . . . 28 GLN CB . 52368 1 96 . 1 . 1 28 28 GLN N N 15 121.8401 0.0000 . 1 . . . . . 28 GLN N . 52368 1 97 . 1 . 1 29 29 GLN H H 1 8.5319 0.0000 . 1 . . . . . 29 GLN H . 52368 1 98 . 1 . 1 29 29 GLN CA C 13 56.3230 0.0000 . 1 . . . . . 29 GLN CA . 52368 1 99 . 1 . 1 29 29 GLN CB C 13 29.6919 0.0000 . 1 . . . . . 29 GLN CB . 52368 1 100 . 1 . 1 29 29 GLN N N 15 122.6179 0.0000 . 1 . . . . . 29 GLN N . 52368 1 101 . 1 . 1 30 30 HIS H H 1 8.4961 0.0000 . 1 . . . . . 30 HIS H . 52368 1 102 . 1 . 1 30 30 HIS CA C 13 56.0660 0.0000 . 1 . . . . . 30 HIS CA . 52368 1 103 . 1 . 1 30 30 HIS CB C 13 30.2634 0.0000 . 1 . . . . . 30 HIS CB . 52368 1 104 . 1 . 1 30 30 HIS N N 15 120.7100 0.0000 . 1 . . . . . 30 HIS N . 52368 1 105 . 1 . 1 31 31 GLY H H 1 8.5146 0.0000 . 1 . . . . . 31 GLY H . 52368 1 106 . 1 . 1 31 31 GLY CA C 13 45.2018 0.0000 . 1 . . . . . 31 GLY CA . 52368 1 107 . 1 . 1 31 31 GLY N N 15 110.5553 0.0000 . 1 . . . . . 31 GLY N . 52368 1 108 . 1 . 1 32 32 MET H H 1 8.2484 0.0000 . 1 . . . . . 32 MET H . 52368 1 109 . 1 . 1 32 32 MET CA C 13 55.0419 0.0000 . 1 . . . . . 32 MET CA . 52368 1 110 . 1 . 1 32 32 MET CB C 13 33.0494 0.0000 . 1 . . . . . 32 MET CB . 52368 1 111 . 1 . 1 32 32 MET N N 15 119.7792 0.0000 . 1 . . . . . 32 MET N . 52368 1 112 . 1 . 1 33 33 ALA H H 1 8.4026 0.0000 . 1 . . . . . 33 ALA H . 52368 1 113 . 1 . 1 33 33 ALA CA C 13 50.4991 0.0000 . 1 . . . . . 33 ALA CA . 52368 1 114 . 1 . 1 33 33 ALA CB C 13 17.8990 0.0000 . 1 . . . . . 33 ALA CB . 52368 1 115 . 1 . 1 33 33 ALA N N 15 127.0650 0.0000 . 1 . . . . . 33 ALA N . 52368 1 116 . 1 . 1 35 35 LEU H H 1 8.4879 0.0000 . 1 . . . . . 35 LEU H . 52368 1 117 . 1 . 1 35 35 LEU CA C 13 55.4356 0.0000 . 1 . . . . . 35 LEU CA . 52368 1 118 . 1 . 1 35 35 LEU CB C 13 42.1738 0.0000 . 1 . . . . . 35 LEU CB . 52368 1 119 . 1 . 1 35 35 LEU N N 15 122.5895 0.0000 . 1 . . . . . 35 LEU N . 52368 1 120 . 1 . 1 36 36 THR H H 1 8.1822 0.0000 . 1 . . . . . 36 THR H . 52368 1 121 . 1 . 1 36 36 THR CA C 13 61.5650 0.0000 . 1 . . . . . 36 THR CA . 52368 1 122 . 1 . 1 36 36 THR CB C 13 69.8936 0.0000 . 1 . . . . . 36 THR CB . 52368 1 123 . 1 . 1 36 36 THR N N 15 115.0098 0.0000 . 1 . . . . . 36 THR N . 52368 1 124 . 1 . 1 37 37 GLN H H 1 8.4947 0.0000 . 1 . . . . . 37 GLN H . 52368 1 125 . 1 . 1 37 37 GLN CA C 13 55.5579 0.0000 . 1 . . . . . 37 GLN CA . 52368 1 126 . 1 . 1 37 37 GLN CB C 13 29.5669 0.0000 . 1 . . . . . 37 GLN CB . 52368 1 127 . 1 . 1 37 37 GLN N N 15 122.3854 0.0000 . 1 . . . . . 37 GLN N . 52368 1 128 . 1 . 1 42 42 VAL CA C 13 62.0326 0.0000 . 1 . . . . . 42 VAL CA . 52368 1 129 . 1 . 1 42 42 VAL CB C 13 32.9664 0.0000 . 1 . . . . . 42 VAL CB . 52368 1 130 . 1 . 1 43 43 ALA H H 1 8.4524 0.0000 . 1 . . . . . 43 ALA H . 52368 1 131 . 1 . 1 43 43 ALA CA C 13 52.1512 0.0000 . 1 . . . . . 43 ALA CA . 52368 1 132 . 1 . 1 43 43 ALA CB C 13 19.2524 0.0000 . 1 . . . . . 43 ALA CB . 52368 1 133 . 1 . 1 43 43 ALA N N 15 128.8052 0.0000 . 1 . . . . . 43 ALA N . 52368 1 134 . 1 . 1 44 44 LYS H H 1 8.3886 0.0000 . 1 . . . . . 44 LYS H . 52368 1 135 . 1 . 1 44 44 LYS CA C 13 56.1316 0.0000 . 1 . . . . . 44 LYS CA . 52368 1 136 . 1 . 1 44 44 LYS CB C 13 32.9664 0.0000 . 1 . . . . . 44 LYS CB . 52368 1 137 . 1 . 1 44 44 LYS N N 15 121.9991 0.0000 . 1 . . . . . 44 LYS N . 52368 1 138 . 1 . 1 45 45 VAL H H 1 8.3541 0.0000 . 1 . . . . . 45 VAL H . 52368 1 139 . 1 . 1 45 45 VAL CA C 13 62.2995 0.0000 . 1 . . . . . 45 VAL CA . 52368 1 140 . 1 . 1 45 45 VAL CB C 13 32.8456 0.0000 . 1 . . . . . 45 VAL CB . 52368 1 141 . 1 . 1 45 45 VAL N N 15 123.6364 0.0000 . 1 . . . . . 45 VAL N . 52368 1 142 . 1 . 1 46 46 VAL H H 1 8.4128 0.0000 . 1 . . . . . 46 VAL H . 52368 1 143 . 1 . 1 46 46 VAL CA C 13 62.1642 0.0000 . 1 . . . . . 46 VAL CA . 52368 1 144 . 1 . 1 46 46 VAL CB C 13 32.8529 0.0000 . 1 . . . . . 46 VAL CB . 52368 1 145 . 1 . 1 46 46 VAL N N 15 125.5460 0.0000 . 1 . . . . . 46 VAL N . 52368 1 146 . 1 . 1 47 47 ASN H H 1 8.6275 0.0000 . 1 . . . . . 47 ASN H . 52368 1 147 . 1 . 1 47 47 ASN CA C 13 52.9589 0.0000 . 1 . . . . . 47 ASN CA . 52368 1 148 . 1 . 1 47 47 ASN CB C 13 38.9310 0.0000 . 1 . . . . . 47 ASN CB . 52368 1 149 . 1 . 1 47 47 ASN N N 15 123.4642 0.0000 . 1 . . . . . 47 ASN N . 52368 1 150 . 1 . 1 48 48 ASP H H 1 8.4572 0.0000 . 1 . . . . . 48 ASP H . 52368 1 151 . 1 . 1 48 48 ASP CA C 13 54.2851 0.0000 . 1 . . . . . 48 ASP CA . 52368 1 152 . 1 . 1 48 48 ASP CB C 13 40.8428 0.0000 . 1 . . . . . 48 ASP CB . 52368 1 153 . 1 . 1 48 48 ASP N N 15 121.8820 0.0000 . 1 . . . . . 48 ASP N . 52368 1 154 . 1 . 1 49 49 ASN H H 1 8.3865 0.0000 . 1 . . . . . 49 ASN H . 52368 1 155 . 1 . 1 49 49 ASN CA C 13 52.9525 0.0000 . 1 . . . . . 49 ASN CA . 52368 1 156 . 1 . 1 49 49 ASN CB C 13 38.7788 0.0000 . 1 . . . . . 49 ASN CB . 52368 1 157 . 1 . 1 49 49 ASN N N 15 118.6275 0.0000 . 1 . . . . . 49 ASN N . 52368 1 158 . 1 . 1 50 50 ALA H H 1 8.1434 0.0000 . 1 . . . . . 50 ALA H . 52368 1 159 . 1 . 1 50 50 ALA CA C 13 50.7181 0.0000 . 1 . . . . . 50 ALA CA . 52368 1 160 . 1 . 1 50 50 ALA CB C 13 17.9449 0.0000 . 1 . . . . . 50 ALA CB . 52368 1 161 . 1 . 1 50 50 ALA N N 15 125.2805 0.0000 . 1 . . . . . 50 ALA N . 52368 1 162 . 1 . 1 52 52 GLN H H 1 8.6553 0.0000 . 1 . . . . . 52 GLN H . 52368 1 163 . 1 . 1 52 52 GLN CA C 13 55.6970 0.0000 . 1 . . . . . 52 GLN CA . 52368 1 164 . 1 . 1 52 52 GLN CB C 13 29.4941 0.0000 . 1 . . . . . 52 GLN CB . 52368 1 165 . 1 . 1 52 52 GLN N N 15 121.1609 0.0000 . 1 . . . . . 52 GLN N . 52368 1 166 . 1 . 1 53 53 THR H H 1 8.2468 0.0000 . 1 . . . . . 53 THR H . 52368 1 167 . 1 . 1 53 53 THR CA C 13 61.7390 0.0000 . 1 . . . . . 53 THR CA . 52368 1 168 . 1 . 1 53 53 THR CB C 13 69.8678 0.0000 . 1 . . . . . 53 THR CB . 52368 1 169 . 1 . 1 53 53 THR N N 15 116.2293 0.0000 . 1 . . . . . 53 THR N . 52368 1 170 . 1 . 1 54 54 ALA H H 1 8.4283 0.0000 . 1 . . . . . 54 ALA H . 52368 1 171 . 1 . 1 54 54 ALA CA C 13 52.2567 0.0000 . 1 . . . . . 54 ALA CA . 52368 1 172 . 1 . 1 54 54 ALA CB C 13 19.2466 0.0000 . 1 . . . . . 54 ALA CB . 52368 1 173 . 1 . 1 54 54 ALA N N 15 127.1680 0.0000 . 1 . . . . . 54 ALA N . 52368 1 174 . 1 . 1 55 55 LYS H H 1 8.3518 0.0000 . 1 . . . . . 55 LYS H . 52368 1 175 . 1 . 1 55 55 LYS CA C 13 55.8746 0.0000 . 1 . . . . . 55 LYS CA . 52368 1 176 . 1 . 1 55 55 LYS CB C 13 33.0015 0.0000 . 1 . . . . . 55 LYS CB . 52368 1 177 . 1 . 1 55 55 LYS N N 15 121.6081 0.0000 . 1 . . . . . 55 LYS N . 52368 1 178 . 1 . 1 56 56 GLU H H 1 8.4715 0.0000 . 1 . . . . . 56 GLU H . 52368 1 179 . 1 . 1 56 56 GLU CA C 13 55.7439 0.0000 . 1 . . . . . 56 GLU CA . 52368 1 180 . 1 . 1 56 56 GLU CB C 13 29.5078 0.0000 . 1 . . . . . 56 GLU CB . 52368 1 181 . 1 . 1 56 56 GLU N N 15 122.6705 0.0000 . 1 . . . . . 56 GLU N . 52368 1 182 . 1 . 1 58 58 ASP H H 1 8.3845 0.0000 . 1 . . . . . 58 ASP H . 52368 1 183 . 1 . 1 58 58 ASP CA C 13 54.0783 0.0000 . 1 . . . . . 58 ASP CA . 52368 1 184 . 1 . 1 58 58 ASP CB C 13 41.0759 0.0000 . 1 . . . . . 58 ASP CB . 52368 1 185 . 1 . 1 58 58 ASP N N 15 120.1947 0.0000 . 1 . . . . . 58 ASP N . 52368 1 186 . 1 . 1 59 59 TYR H H 1 8.0744 0.0000 . 1 . . . . . 59 TYR H . 52368 1 187 . 1 . 1 59 59 TYR CA C 13 58.1207 0.0000 . 1 . . . . . 59 TYR CA . 52368 1 188 . 1 . 1 59 59 TYR CB C 13 38.3567 0.0000 . 1 . . . . . 59 TYR CB . 52368 1 189 . 1 . 1 59 59 TYR N N 15 120.3744 0.0000 . 1 . . . . . 59 TYR N . 52368 1 190 . 1 . 1 60 60 LEU H H 1 8.0325 0.0000 . 1 . . . . . 60 LEU H . 52368 1 191 . 1 . 1 60 60 LEU CA C 13 55.0388 0.0000 . 1 . . . . . 60 LEU CA . 52368 1 192 . 1 . 1 60 60 LEU CB C 13 42.3243 0.0000 . 1 . . . . . 60 LEU CB . 52368 1 193 . 1 . 1 60 60 LEU N N 15 123.1757 0.0000 . 1 . . . . . 60 LEU N . 52368 1 194 . 1 . 1 61 61 ASP H H 1 8.1845 0.0000 . 1 . . . . . 61 ASP H . 52368 1 195 . 1 . 1 61 61 ASP CA C 13 54.2584 0.0000 . 1 . . . . . 61 ASP CA . 52368 1 196 . 1 . 1 61 61 ASP CB C 13 40.9225 0.0000 . 1 . . . . . 61 ASP CB . 52368 1 197 . 1 . 1 61 61 ASP N N 15 121.1765 0.0000 . 1 . . . . . 61 ASP N . 52368 1 198 . 1 . 1 62 62 ILE H H 1 7.9710 0.0000 . 1 . . . . . 62 ILE H . 52368 1 199 . 1 . 1 62 62 ILE CA C 13 59.2010 0.0000 . 1 . . . . . 62 ILE CA . 52368 1 200 . 1 . 1 62 62 ILE CB C 13 38.4219 0.0000 . 1 . . . . . 62 ILE CB . 52368 1 201 . 1 . 1 62 62 ILE N N 15 122.9386 0.0000 . 1 . . . . . 62 ILE N . 52368 1 202 . 1 . 1 64 64 ALA H H 1 8.4308 0.0000 . 1 . . . . . 64 ALA H . 52368 1 203 . 1 . 1 64 64 ALA CA C 13 53.7078 0.0000 . 1 . . . . . 64 ALA CA . 52368 1 204 . 1 . 1 64 64 ALA CB C 13 18.7659 0.0000 . 1 . . . . . 64 ALA CB . 52368 1 205 . 1 . 1 64 64 ALA N N 15 123.6887 0.0000 . 1 . . . . . 64 ALA N . 52368 1 206 . 1 . 1 65 65 PHE H H 1 8.0220 0.0000 . 1 . . . . . 65 PHE H . 52368 1 207 . 1 . 1 65 65 PHE CA C 13 57.9910 0.0000 . 1 . . . . . 65 PHE CA . 52368 1 208 . 1 . 1 65 65 PHE CB C 13 38.8368 0.0000 . 1 . . . . . 65 PHE CB . 52368 1 209 . 1 . 1 65 65 PHE N N 15 117.1156 0.0000 . 1 . . . . . 65 PHE N . 52368 1 210 . 1 . 1 66 66 LEU H H 1 7.8878 0.0000 . 1 . . . . . 66 LEU H . 52368 1 211 . 1 . 1 66 66 LEU CA C 13 50.7132 0.0000 . 1 . . . . . 66 LEU CA . 52368 1 212 . 1 . 1 66 66 LEU CB C 13 42.4050 0.0000 . 1 . . . . . 66 LEU CB . 52368 1 213 . 1 . 1 66 66 LEU N N 15 122.6858 0.0000 . 1 . . . . . 66 LEU N . 52368 1 214 . 1 . 1 67 67 ARG H H 1 7.9625 0.0000 . 1 . . . . . 67 ARG H . 52368 1 215 . 1 . 1 67 67 ARG CA C 13 56.3283 0.0000 . 1 . . . . . 67 ARG CA . 52368 1 216 . 1 . 1 67 67 ARG CB C 13 30.6910 0.0000 . 1 . . . . . 67 ARG CB . 52368 1 217 . 1 . 1 67 67 ARG N N 15 121.9494 0.0000 . 1 . . . . . 67 ARG N . 52368 1 218 . 1 . 1 68 68 LYS H H 1 8.3575 0.0000 . 1 . . . . . 68 LYS H . 52368 1 219 . 1 . 1 68 68 LYS CA C 13 57.7955 0.0000 . 1 . . . . . 68 LYS CA . 52368 1 220 . 1 . 1 68 68 LYS CB C 13 38.4562 0.0000 . 1 . . . . . 68 LYS CB . 52368 1 221 . 1 . 1 68 68 LYS N N 15 121.1228 0.0000 . 1 . . . . . 68 LYS N . 52368 1 222 . 1 . 1 69 69 GLN H H 1 8.2131 0.0000 . 1 . . . . . 69 GLN H . 52368 1 223 . 1 . 1 69 69 GLN CA C 13 55.7713 0.0000 . 1 . . . . . 69 GLN CA . 52368 1 224 . 1 . 1 69 69 GLN CB C 13 29.5092 0.0000 . 1 . . . . . 69 GLN CB . 52368 1 225 . 1 . 1 69 69 GLN N N 15 122.3876 0.0000 . 1 . . . . . 69 GLN N . 52368 1 226 . 1 . 1 70 70 ALA H H 1 8.4029 0.0000 . 1 . . . . . 70 ALA H . 52368 1 227 . 1 . 1 70 70 ALA CA C 13 52.2495 0.0000 . 1 . . . . . 70 ALA CA . 52368 1 228 . 1 . 1 70 70 ALA CB C 13 19.4450 0.0000 . 1 . . . . . 70 ALA CB . 52368 1 229 . 1 . 1 70 70 ALA N N 15 126.3247 0.0000 . 1 . . . . . 70 ALA N . 52368 1 230 . 1 . 1 71 71 ASP H H 1 8.0108 0.0000 . 1 . . . . . 71 ASP H . 52368 1 231 . 1 . 1 71 71 ASP CA C 13 55.8860 0.0000 . 1 . . . . . 71 ASP CA . 52368 1 232 . 1 . 1 71 71 ASP CB C 13 41.9997 0.0000 . 1 . . . . . 71 ASP CB . 52368 1 233 . 1 . 1 71 71 ASP N N 15 125.7442 0.0000 . 1 . . . . . 71 ASP N . 52368 1 stop_ save_