data_52090 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 52090 _Entry.Title ; Chemical shifts of Ost4 protein assigned by solid state NMR ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2023-08-21 _Entry.Accession_date 2023-08-21 _Entry.Last_release_date 2023-08-22 _Entry.Original_release_date 2023-08-22 _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 solid-state _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 Bharat Chaudhary . P. . . 52090 2 Jochem Struppe . . . . 52090 3 Hem Moktan . . . . 52090 4 David Zoetewey . . . . 52090 5 Donghua Zhou . . . . 52090 6 Smita Mohanty . . . . 52090 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 52090 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 148 52090 '15N chemical shifts' 36 52090 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 . . 2024-03-11 . original BMRB . 52090 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 52090 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 38421550 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Reconstitution and resonance assignments of yeast OST subunit Ost4 and its critical mutant Ost4V23D in liposomes by solid-state NMR ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full 'Journal of Biomolecular NMR' _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year 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 Bharat Chaudhary . P. . . 52090 1 2 Jochem Struppe . . . . 52090 1 3 Hem Moktan . . . . 52090 1 4 David Zoetewey . . . . 52090 1 5 Donghua Zhou . . . . 52090 1 6 Smita Mohanty . . . . 52090 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 52090 _Assembly.ID 1 _Assembly.Name Ost4 _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 1 _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 Ost4 1 $entity_1 . . yes native no no . . . 52090 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 52090 _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 ; MISDEQLNSLAITFGIVMMT LIVIYHAVDSTMSPKNRLE ; _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 39 _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_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'Bridges neighboring sub units and maintains stability of the functional sub complex in yeast oligosacchharyltransferase' 52090 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 52090 1 2 . ILE . 52090 1 3 . SER . 52090 1 4 . ASP . 52090 1 5 . GLU . 52090 1 6 . GLN . 52090 1 7 . LEU . 52090 1 8 . ASN . 52090 1 9 . SER . 52090 1 10 . LEU . 52090 1 11 . ALA . 52090 1 12 . ILE . 52090 1 13 . THR . 52090 1 14 . PHE . 52090 1 15 . GLY . 52090 1 16 . ILE . 52090 1 17 . VAL . 52090 1 18 . MET . 52090 1 19 . MET . 52090 1 20 . THR . 52090 1 21 . LEU . 52090 1 22 . ILE . 52090 1 23 . VAL . 52090 1 24 . ILE . 52090 1 25 . TYR . 52090 1 26 . HIS . 52090 1 27 . ALA . 52090 1 28 . VAL . 52090 1 29 . ASP . 52090 1 30 . SER . 52090 1 31 . THR . 52090 1 32 . MET . 52090 1 33 . SER . 52090 1 34 . PRO . 52090 1 35 . LYS . 52090 1 36 . ASN . 52090 1 37 . ARG . 52090 1 38 . LEU . 52090 1 39 . GLU . 52090 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 52090 1 . ILE 2 2 52090 1 . SER 3 3 52090 1 . ASP 4 4 52090 1 . GLU 5 5 52090 1 . GLN 6 6 52090 1 . LEU 7 7 52090 1 . ASN 8 8 52090 1 . SER 9 9 52090 1 . LEU 10 10 52090 1 . ALA 11 11 52090 1 . ILE 12 12 52090 1 . THR 13 13 52090 1 . PHE 14 14 52090 1 . GLY 15 15 52090 1 . ILE 16 16 52090 1 . VAL 17 17 52090 1 . MET 18 18 52090 1 . MET 19 19 52090 1 . THR 20 20 52090 1 . LEU 21 21 52090 1 . ILE 22 22 52090 1 . VAL 23 23 52090 1 . ILE 24 24 52090 1 . TYR 25 25 52090 1 . HIS 26 26 52090 1 . ALA 27 27 52090 1 . VAL 28 28 52090 1 . ASP 29 29 52090 1 . SER 30 30 52090 1 . THR 31 31 52090 1 . MET 32 32 52090 1 . SER 33 33 52090 1 . PRO 34 34 52090 1 . LYS 35 35 52090 1 . ASN 36 36 52090 1 . ARG 37 37 52090 1 . LEU 38 38 52090 1 . GLU 39 39 52090 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 52090 _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 . 4932 organism . 'Saccharomyces cerevisiae' "baker's yeast" . . Eukaryota Fungi Saccharomyces cerevisiae . . . . . . . . . . . . . 52090 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 52090 _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 . . GEV2 . . . 52090 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 52090 _Sample.ID 1 _Sample.Name 'Ost4 reconstituted in POPC and POPE' _Sample.Type solid _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '30% Water (W/W)' _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 Ost4 '[U-100% 13C; U-100% 15N]' . . 1 $entity_1 . . 15 10 20 mg . . . . 52090 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 52090 _Sample_condition_list.ID 1 _Sample_condition_list.Name 'SSNMR Data collection on Ost4' _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 6.5 . pH 52090 1 temperature 283 . K 52090 1 stop_ save_ save_sample_conditions_2 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_2 _Sample_condition_list.Entry_ID 52090 _Sample_condition_list.ID 2 _Sample_condition_list.Name 'SSNMR Data collection on Ost4' _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 6.5 . pH 52090 2 temperature 230 . K 52090 2 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 52090 _Software.ID 1 _Software.Type . _Software.Name CcpNMR _Software.Version 2.1 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 52090 1 'data analysis' . 52090 1 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 52090 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name 'Bruker BioSpin corporation Billerica' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AVANCE _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 52090 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name 'Bruker BioSpin corporation Billerica' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AVANCE _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 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 52090 _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 13C-13C DARR' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52090 1 2 '3D NCACX' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52090 1 3 '3D NCOCX' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52090 1 4 '3D CANcoCX' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52090 1 5 '2D CHHC' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52090 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 52090 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name '13C, 15N' _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 52090 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 52090 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 52090 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 52090 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 'Solid State NMR Chemical shifts of Ost4 protein' _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 2 '3D NCACX' . . . 52090 1 3 '3D NCOCX' . . . 52090 1 4 '3D CANcoCX' . . . 52090 1 5 '2D CHHC' . . . 52090 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 . . 52090 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 3 3 SER C C 13 178.0408 . . . . . . . . 3 SER C . 52090 1 2 . 1 . 1 3 3 SER CA C 13 57.9382 . . . . . . . . 3 SER CA . 52090 1 3 . 1 . 1 3 3 SER CB C 13 66.0148 . . . . . . . . 3 SER CB . 52090 1 4 . 1 . 1 4 4 ASP C C 13 178.0722 . . . . . . . . 4 ASP C . 52090 1 5 . 1 . 1 4 4 ASP CA C 13 58.0396 . . . . . . . . 4 ASP CA . 52090 1 6 . 1 . 1 4 4 ASP CB C 13 40.9901 . . . . . . . . 4 ASP CB . 52090 1 7 . 1 . 1 4 4 ASP N N 15 121.3861 . . . . . . . . 4 ASP N . 52090 1 8 . 1 . 1 5 5 GLU C C 13 177.5246 . . . . . . . . 5 GLU C . 52090 1 9 . 1 . 1 5 5 GLU CA C 13 59.5248 . . . . . . . . 5 GLU CA . 52090 1 10 . 1 . 1 5 5 GLU CB C 13 29.0362 . . . . . . . . 5 GLU CB . 52090 1 11 . 1 . 1 5 5 GLU CG C 13 33.9037 . . . . . . . . 5 GLU CG . 52090 1 12 . 1 . 1 5 5 GLU N N 15 119.3001 . . . . . . . . 5 GLU N . 52090 1 13 . 1 . 1 6 6 GLN C C 13 177.4170 . . . . . . . . 6 GLN C . 52090 1 14 . 1 . 1 6 6 GLN CA C 13 58.8593 . . . . . . . . 6 GLN CA . 52090 1 15 . 1 . 1 6 6 GLN CB C 13 31.6513 . . . . . . . . 6 GLN CB . 52090 1 16 . 1 . 1 6 6 GLN CG C 13 33.6427 . . . . . . . . 6 GLN CG . 52090 1 17 . 1 . 1 6 6 GLN N N 15 119.5794 . . . . . . . . 6 GLN N . 52090 1 18 . 1 . 1 7 7 LEU C C 13 178.0489 . . . . . . . . 7 LEU C . 52090 1 19 . 1 . 1 7 7 LEU CA C 13 58.0903 . . . . . . . . 7 LEU CA . 52090 1 20 . 1 . 1 7 7 LEU CB C 13 41.8435 . . . . . . . . 7 LEU CB . 52090 1 21 . 1 . 1 7 7 LEU CG C 13 26.4109 . . . . . . . . 7 LEU CG . 52090 1 22 . 1 . 1 7 7 LEU CD1 C 13 23.8812 . . . . . . . . 7 LEU CD1 . 52090 1 23 . 1 . 1 7 7 LEU CD2 C 13 23.8812 . . . . . . . . 7 LEU CD2 . 52090 1 24 . 1 . 1 7 7 LEU N N 15 122.0913 . . . . . . . . 7 LEU N . 52090 1 25 . 1 . 1 8 8 ASN C C 13 177.6796 . . . . . . . . 8 ASN C . 52090 1 26 . 1 . 1 8 8 ASN CA C 13 56.2193 . . . . . . . . 8 ASN CA . 52090 1 27 . 1 . 1 8 8 ASN CB C 13 34.0448 . . . . . . . . 8 ASN CB . 52090 1 28 . 1 . 1 8 8 ASN N N 15 117.7040 . . . . . . . . 8 ASN N . 52090 1 29 . 1 . 1 9 9 SER C C 13 176.9813 . . . . . . . . 9 SER C . 52090 1 30 . 1 . 1 9 9 SER CA C 13 60.8829 . . . . . . . . 9 SER CA . 52090 1 31 . 1 . 1 9 9 SER CB C 13 63.3092 . . . . . . . . 9 SER CB . 52090 1 32 . 1 . 1 9 9 SER N N 15 114.2763 . . . . . . . . 9 SER N . 52090 1 33 . 1 . 1 10 10 LEU C C 13 178.2149 . . . . . . . . 10 LEU C . 52090 1 34 . 1 . 1 10 10 LEU CA C 13 57.9885 . . . . . . . . 10 LEU CA . 52090 1 35 . 1 . 1 10 10 LEU CB C 13 41.8548 . . . . . . . . 10 LEU CB . 52090 1 36 . 1 . 1 10 10 LEU CG C 13 26.8053 . . . . . . . . 10 LEU CG . 52090 1 37 . 1 . 1 10 10 LEU CD1 C 13 21.5562 . . . . . . . . 10 LEU CD1 . 52090 1 38 . 1 . 1 10 10 LEU CD2 C 13 21.5562 . . . . . . . . 10 LEU CD2 . 52090 1 39 . 1 . 1 10 10 LEU N N 15 122.5710 . . . . . . . . 10 LEU N . 52090 1 40 . 1 . 1 11 11 ALA C C 13 174.5921 . . . . . . . . 11 ALA C . 52090 1 41 . 1 . 1 11 11 ALA CA C 13 55.3421 . . . . . . . . 11 ALA CA . 52090 1 42 . 1 . 1 11 11 ALA CB C 13 18.7352 . . . . . . . . 11 ALA CB . 52090 1 43 . 1 . 1 11 11 ALA N N 15 125.5982 . . . . . . . . 11 ALA N . 52090 1 44 . 1 . 1 12 12 ILE C C 13 176.7203 . . . . . . . . 12 ILE C . 52090 1 45 . 1 . 1 12 12 ILE CA C 13 66.1696 . . . . . . . . 12 ILE CA . 52090 1 46 . 1 . 1 12 12 ILE CB C 13 38.0336 . . . . . . . . 12 ILE CB . 52090 1 47 . 1 . 1 12 12 ILE CG1 C 13 30.7179 . . . . . . . . 12 ILE CG1 . 52090 1 48 . 1 . 1 12 12 ILE CG2 C 13 17.3673 . . . . . . . . 12 ILE CG2 . 52090 1 49 . 1 . 1 12 12 ILE CD1 C 13 14.1413 . . . . . . . . 12 ILE CD1 . 52090 1 50 . 1 . 1 12 12 ILE N N 15 120.2232 . . . . . . . . 12 ILE N . 52090 1 51 . 1 . 1 13 13 THR C C 13 175.4989 . . . . . . . . 13 THR C . 52090 1 52 . 1 . 1 13 13 THR CA C 13 67.5074 . . . . . . . . 13 THR CA . 52090 1 53 . 1 . 1 13 13 THR CB C 13 68.1884 . . . . . . . . 13 THR CB . 52090 1 54 . 1 . 1 13 13 THR CG2 C 13 22.0410 . . . . . . . . 13 THR CG2 . 52090 1 55 . 1 . 1 13 13 THR N N 15 119.1084 . . . . . . . . 13 THR N . 52090 1 56 . 1 . 1 14 14 PHE C C 13 176.2976 . . . . . . . . 14 PHE C . 52090 1 57 . 1 . 1 14 14 PHE CA C 13 61.9062 . . . . . . . . 14 PHE CA . 52090 1 58 . 1 . 1 14 14 PHE CB C 13 39.5129 . . . . . . . . 14 PHE CB . 52090 1 59 . 1 . 1 14 14 PHE N N 15 121.5520 . . . . . . . . 14 PHE N . 52090 1 60 . 1 . 1 15 15 GLY C C 13 174.3042 . . . . . . . . 15 GLY C . 52090 1 61 . 1 . 1 15 15 GLY CA C 13 47.6237 . . . . . . . . 15 GLY CA . 52090 1 62 . 1 . 1 15 15 GLY N N 15 106.3050 . . . . . . . . 15 GLY N . 52090 1 63 . 1 . 1 16 16 ILE C C 13 177.0869 . . . . . . . . 16 ILE C . 52090 1 64 . 1 . 1 16 16 ILE CA C 13 66.0933 . . . . . . . . 16 ILE CA . 52090 1 65 . 1 . 1 16 16 ILE CB C 13 38.0125 . . . . . . . . 16 ILE CB . 52090 1 66 . 1 . 1 16 16 ILE CG1 C 13 29.4179 . . . . . . . . 16 ILE CG1 . 52090 1 67 . 1 . 1 16 16 ILE CG2 C 13 17.5568 . . . . . . . . 16 ILE CG2 . 52090 1 68 . 1 . 1 16 16 ILE CD1 C 13 14.5939 . . . . . . . . 16 ILE CD1 . 52090 1 69 . 1 . 1 16 16 ILE N N 15 121.5500 . . . . . . . . 16 ILE N . 52090 1 70 . 1 . 1 17 17 VAL C C 13 177.9011 . . . . . . . . 17 VAL C . 52090 1 71 . 1 . 1 17 17 VAL CA C 13 66.9606 . . . . . . . . 17 VAL CA . 52090 1 72 . 1 . 1 17 17 VAL CB C 13 31.2102 . . . . . . . . 17 VAL CB . 52090 1 73 . 1 . 1 17 17 VAL CG1 C 13 21.0861 . . . . . . . . 17 VAL CG1 . 52090 1 74 . 1 . 1 17 17 VAL CG2 C 13 21.0861 . . . . . . . . 17 VAL CG2 . 52090 1 75 . 1 . 1 17 17 VAL N N 15 122.4618 . . . . . . . . 17 VAL N . 52090 1 76 . 1 . 1 18 18 MET C C 13 177.1421 . . . . . . . . 18 MET C . 52090 1 77 . 1 . 1 18 18 MET CA C 13 57.1867 . . . . . . . . 18 MET CA . 52090 1 78 . 1 . 1 18 18 MET CB C 13 31.3183 . . . . . . . . 18 MET CB . 52090 1 79 . 1 . 1 18 18 MET N N 15 119.3744 . . . . . . . . 18 MET N . 52090 1 80 . 1 . 1 19 19 MET C C 13 176.6258 . . . . . . . . 19 MET C . 52090 1 81 . 1 . 1 19 19 MET CA C 13 56.2685 . . . . . . . . 19 MET CA . 52090 1 82 . 1 . 1 19 19 MET CB C 13 31.3036 . . . . . . . . 19 MET CB . 52090 1 83 . 1 . 1 19 19 MET N N 15 118.1239 . . . . . . . . 19 MET N . 52090 1 84 . 1 . 1 20 20 THR C C 13 175.9349 . . . . . . . . 20 THR C . 52090 1 85 . 1 . 1 20 20 THR CA C 13 67.3107 . . . . . . . . 20 THR CA . 52090 1 86 . 1 . 1 20 20 THR CB C 13 68.7885 . . . . . . . . 20 THR CB . 52090 1 87 . 1 . 1 20 20 THR CG2 C 13 21.4878 . . . . . . . . 20 THR CG2 . 52090 1 88 . 1 . 1 20 20 THR N N 15 117.2125 . . . . . . . . 20 THR N . 52090 1 89 . 1 . 1 21 21 LEU C C 13 174.4015 . . . . . . . . 21 LEU C . 52090 1 90 . 1 . 1 21 21 LEU CA C 13 55.5684 . . . . . . . . 21 LEU CA . 52090 1 91 . 1 . 1 21 21 LEU CB C 13 37.0646 . . . . . . . . 21 LEU CB . 52090 1 92 . 1 . 1 21 21 LEU CD1 C 13 22.9601 . . . . . . . . 21 LEU CD1 . 52090 1 93 . 1 . 1 21 21 LEU CD2 C 13 22.9601 . . . . . . . . 21 LEU CD2 . 52090 1 94 . 1 . 1 21 21 LEU N N 15 119.0530 . . . . . . . . 21 LEU N . 52090 1 95 . 1 . 1 22 22 ILE C C 13 176.5929 . . . . . . . . 22 ILE C . 52090 1 96 . 1 . 1 22 22 ILE CA C 13 65.3625 . . . . . . . . 22 ILE CA . 52090 1 97 . 1 . 1 22 22 ILE CB C 13 38.2197 . . . . . . . . 22 ILE CB . 52090 1 98 . 1 . 1 22 22 ILE CG2 C 13 17.4935 . . . . . . . . 22 ILE CG2 . 52090 1 99 . 1 . 1 22 22 ILE CD1 C 13 14.0842 . . . . . . . . 22 ILE CD1 . 52090 1 100 . 1 . 1 22 22 ILE N N 15 121.8748 . . . . . . . . 22 ILE N . 52090 1 101 . 1 . 1 23 23 VAL C C 13 175.5147 . . . . . . . . 23 VAL C . 52090 1 102 . 1 . 1 23 23 VAL CA C 13 67.6022 . . . . . . . . 23 VAL CA . 52090 1 103 . 1 . 1 23 23 VAL CB C 13 31.3074 . . . . . . . . 23 VAL CB . 52090 1 104 . 1 . 1 23 23 VAL CG1 C 13 21.0338 . . . . . . . . 23 VAL CG1 . 52090 1 105 . 1 . 1 23 23 VAL CG2 C 13 21.0338 . . . . . . . . 23 VAL CG2 . 52090 1 106 . 1 . 1 23 23 VAL N N 15 118.7491 . . . . . . . . 23 VAL N . 52090 1 107 . 1 . 1 24 24 ILE C C 13 177.2527 . . . . . . . . 24 ILE C . 52090 1 108 . 1 . 1 24 24 ILE CA C 13 65.4997 . . . . . . . . 24 ILE CA . 52090 1 109 . 1 . 1 24 24 ILE CB C 13 38.2228 . . . . . . . . 24 ILE CB . 52090 1 110 . 1 . 1 24 24 ILE CG2 C 13 17.8141 . . . . . . . . 24 ILE CG2 . 52090 1 111 . 1 . 1 24 24 ILE CD1 C 13 14.5171 . . . . . . . . 24 ILE CD1 . 52090 1 112 . 1 . 1 24 24 ILE N N 15 119.6868 . . . . . . . . 24 ILE N . 52090 1 113 . 1 . 1 25 25 TYR C C 13 176.8860 . . . . . . . . 25 TYR C . 52090 1 114 . 1 . 1 25 25 TYR CA C 13 56.6113 . . . . . . . . 25 TYR CA . 52090 1 115 . 1 . 1 25 25 TYR CB C 13 39.7009 . . . . . . . . 25 TYR CB . 52090 1 116 . 1 . 1 25 25 TYR N N 15 119.6868 . . . . . . . . 25 TYR N . 52090 1 117 . 1 . 1 26 26 HIS C C 13 175.2388 . . . . . . . . 26 HIS C . 52090 1 118 . 1 . 1 26 26 HIS CA C 13 55.9122 . . . . . . . . 26 HIS CA . 52090 1 119 . 1 . 1 26 26 HIS CB C 13 30.0973 . . . . . . . . 26 HIS CB . 52090 1 120 . 1 . 1 26 26 HIS N N 15 115.1099 . . . . . . . . 26 HIS N . 52090 1 121 . 1 . 1 27 27 ALA C C 13 179.0660 . . . . . . . . 27 ALA C . 52090 1 122 . 1 . 1 27 27 ALA CA C 13 55.4011 . . . . . . . . 27 ALA CA . 52090 1 123 . 1 . 1 27 27 ALA CB C 13 18.4894 . . . . . . . . 27 ALA CB . 52090 1 124 . 1 . 1 27 27 ALA N N 15 123.1582 . . . . . . . . 27 ALA N . 52090 1 125 . 1 . 1 28 28 VAL C C 13 175.9761 . . . . . . . . 28 VAL C . 52090 1 126 . 1 . 1 28 28 VAL CA C 13 67.9244 . . . . . . . . 28 VAL CA . 52090 1 127 . 1 . 1 28 28 VAL CB C 13 34.8208 . . . . . . . . 28 VAL CB . 52090 1 128 . 1 . 1 28 28 VAL CG1 C 13 21.1457 . . . . . . . . 28 VAL CG1 . 52090 1 129 . 1 . 1 28 28 VAL CG2 C 13 21.1457 . . . . . . . . 28 VAL CG2 . 52090 1 130 . 1 . 1 28 28 VAL N N 15 117.4865 . . . . . . . . 28 VAL N . 52090 1 131 . 1 . 1 29 29 ASP C C 13 177.3527 . . . . . . . . 29 ASP C . 52090 1 132 . 1 . 1 29 29 ASP CA C 13 56.4405 . . . . . . . . 29 ASP CA . 52090 1 133 . 1 . 1 29 29 ASP CB C 13 41.5700 . . . . . . . . 29 ASP CB . 52090 1 134 . 1 . 1 29 29 ASP N N 15 121.2659 . . . . . . . . 29 ASP N . 52090 1 135 . 1 . 1 30 30 SER C C 13 176.6008 . . . . . . . . 30 SER C . 52090 1 136 . 1 . 1 30 30 SER CA C 13 60.6452 . . . . . . . . 30 SER CA . 52090 1 137 . 1 . 1 30 30 SER CB C 13 62.8578 . . . . . . . . 30 SER CB . 52090 1 138 . 1 . 1 30 30 SER N N 15 113.4943 . . . . . . . . 30 SER N . 52090 1 139 . 1 . 1 31 31 THR C C 13 176.5561 . . . . . . . . 31 THR C . 52090 1 140 . 1 . 1 31 31 THR CA C 13 67.9327 . . . . . . . . 31 THR CA . 52090 1 141 . 1 . 1 31 31 THR CB C 13 68.5613 . . . . . . . . 31 THR CB . 52090 1 142 . 1 . 1 31 31 THR CG2 C 13 21.6560 . . . . . . . . 31 THR CG2 . 52090 1 143 . 1 . 1 31 31 THR N N 15 116.3332 . . . . . . . . 31 THR N . 52090 1 144 . 1 . 1 32 32 MET C C 13 176.5828 . . . . . . . . 32 MET C . 52090 1 145 . 1 . 1 32 32 MET CA C 13 56.7772 . . . . . . . . 32 MET CA . 52090 1 146 . 1 . 1 32 32 MET CB C 13 32.5973 . . . . . . . . 32 MET CB . 52090 1 147 . 1 . 1 32 32 MET CG C 13 30.0302 . . . . . . . . 32 MET CG . 52090 1 148 . 1 . 1 32 32 MET N N 15 119.7487 . . . . . . . . 32 MET N . 52090 1 149 . 1 . 1 33 33 SER C C 13 177.1997 . . . . . . . . 33 SER C . 52090 1 150 . 1 . 1 33 33 SER CA C 13 59.3044 . . . . . . . . 33 SER CA . 52090 1 151 . 1 . 1 33 33 SER CB C 13 60.2591 . . . . . . . . 33 SER CB . 52090 1 152 . 1 . 1 33 33 SER N N 15 118.1891 . . . . . . . . 33 SER N . 52090 1 153 . 1 . 1 34 34 PRO C C 13 177.1870 . . . . . . . . 34 PRO C . 52090 1 154 . 1 . 1 34 34 PRO CA C 13 67.1139 . . . . . . . . 34 PRO CA . 52090 1 155 . 1 . 1 34 34 PRO CB C 13 31.3717 . . . . . . . . 34 PRO CB . 52090 1 156 . 1 . 1 34 34 PRO CG C 13 22.2193 . . . . . . . . 34 PRO CG . 52090 1 157 . 1 . 1 34 34 PRO CD C 13 51.2348 . . . . . . . . 34 PRO CD . 52090 1 158 . 1 . 1 34 34 PRO N N 15 119.9994 . . . . . . . . 34 PRO N . 52090 1 159 . 1 . 1 35 35 LYS C C 13 178.1330 . . . . . . . . 35 LYS C . 52090 1 160 . 1 . 1 35 35 LYS CA C 13 57.5323 . . . . . . . . 35 LYS CA . 52090 1 161 . 1 . 1 35 35 LYS CB C 13 35.7159 . . . . . . . . 35 LYS CB . 52090 1 162 . 1 . 1 35 35 LYS CG C 13 26.4711 . . . . . . . . 35 LYS CG . 52090 1 163 . 1 . 1 35 35 LYS CD C 13 28.6807 . . . . . . . . 35 LYS CD . 52090 1 164 . 1 . 1 35 35 LYS CE C 13 41.7115 . . . . . . . . 35 LYS CE . 52090 1 165 . 1 . 1 35 35 LYS N N 15 120.3120 . . . . . . . . 35 LYS N . 52090 1 166 . 1 . 1 36 36 ASN C C 13 177.5552 . . . . . . . . 36 ASN C . 52090 1 167 . 1 . 1 36 36 ASN CA C 13 56.1277 . . . . . . . . 36 ASN CA . 52090 1 168 . 1 . 1 36 36 ASN CB C 13 34.1484 . . . . . . . . 36 ASN CB . 52090 1 169 . 1 . 1 36 36 ASN N N 15 117.8114 . . . . . . . . 36 ASN N . 52090 1 170 . 1 . 1 37 37 ARG C C 13 174.1724 . . . . . . . . 37 ARG C . 52090 1 171 . 1 . 1 37 37 ARG CA C 13 59.9079 . . . . . . . . 37 ARG CA . 52090 1 172 . 1 . 1 37 37 ARG CB C 13 34.9677 . . . . . . . . 37 ARG CB . 52090 1 173 . 1 . 1 37 37 ARG CG C 13 27.3882 . . . . . . . . 37 ARG CG . 52090 1 174 . 1 . 1 37 37 ARG CD C 13 42.4122 . . . . . . . . 37 ARG CD . 52090 1 175 . 1 . 1 37 37 ARG N N 15 127.2079 . . . . . . . . 37 ARG N . 52090 1 176 . 1 . 1 38 38 LEU C C 13 177.2734 . . . . . . . . 38 LEU C . 52090 1 177 . 1 . 1 38 38 LEU CA C 13 58.2807 . . . . . . . . 38 LEU CA . 52090 1 178 . 1 . 1 38 38 LEU CB C 13 41.5265 . . . . . . . . 38 LEU CB . 52090 1 179 . 1 . 1 38 38 LEU N N 15 126.8761 . . . . . . . . 38 LEU N . 52090 1 180 . 1 . 1 39 39 GLU C C 13 174.2743 . . . . . . . . 39 GLU C . 52090 1 181 . 1 . 1 39 39 GLU CA C 13 53.8517 . . . . . . . . 39 GLU CA . 52090 1 182 . 1 . 1 39 39 GLU CB C 13 32.2892 . . . . . . . . 39 GLU CB . 52090 1 183 . 1 . 1 39 39 GLU CG C 13 33.2018 . . . . . . . . 39 GLU CG . 52090 1 184 . 1 . 1 39 39 GLU N N 15 125.6258 . . . . . . . . 39 GLU N . 52090 1 stop_ save_