data_51865 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 51865 _Entry.Title ; Assignments for fibrillar Human Islet Amyloid Polypeptide (hIAPP) ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2023-03-02 _Entry.Accession_date 2023-03-02 _Entry.Last_release_date 2023-03-02 _Entry.Original_release_date 2023-03-02 _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 'Backbone 1H, 13C, and 15 N Chemical Shift Assignments for hIAPP fibrils' _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 Saba Suladze . . . 0000-0001-6226-1570 51865 2 Riddhiman Sankar . . . 0000-0001-9055-7897 51865 3 Diana 'Rodriguez Camargo' . . . 0000-0003-3522-4859 51865 4 Bernd Reif . . . 0000-0001-7368-7198 51865 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'The Bavarian NMR Center (BNMRZ)' . 51865 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 51865 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 101 51865 '15N chemical shifts' 34 51865 '1H chemical shifts' 34 51865 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 . . 2024-10-23 . original BMRB . 51865 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 51866 'Assignments for fibrillar Cysteine to Serine Double Mutant of Human Islet Amyloid Polypeptide (hIAPP_C2S/C7S)' 51865 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 51865 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 38723619 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Structural Insights into Seeding Mechanisms of hIAPP Fibril Formation ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Am. Chem. Soc.' _Citation.Journal_name_full 'Journal of the American Chemical Society' _Citation.Journal_volume 146 _Citation.Journal_issue 20 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1520-5126 _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 13783 _Citation.Page_last 13796 _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 Saba Suladze S. . . . 51865 1 2 Christian 'Sustay Martinez' C. . . . 51865 1 3 Diana 'Rodriguez Camargo' D. C. . . 51865 1 4 Jonas Engler J. . . . 51865 1 5 Natalia Rodina N. . . . 51865 1 6 Riddhiman Sarkar R. . . . 51865 1 7 Martin Zacharias M. . . . 51865 1 8 Bernd Reif B. . . . 51865 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'hIAPP, IAPP, Proton-Detection, Solid-State NMR, Amyloid' 51865 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 51865 _Assembly.ID 1 _Assembly.Name hIAPP _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 hIAPP 1 $entity_1 . . yes native no no . . . 51865 1 stop_ loop_ _Bond.ID _Bond.Type _Bond.Value_order _Bond.Assembly_atom_ID_1 _Bond.Entity_assembly_ID_1 _Bond.Entity_assembly_name_1 _Bond.Entity_ID_1 _Bond.Comp_ID_1 _Bond.Comp_index_ID_1 _Bond.Seq_ID_1 _Bond.Atom_ID_1 _Bond.Assembly_atom_ID_2 _Bond.Entity_assembly_ID_2 _Bond.Entity_assembly_name_2 _Bond.Entity_ID_2 _Bond.Comp_ID_2 _Bond.Comp_index_ID_2 _Bond.Seq_ID_2 _Bond.Atom_ID_2 _Bond.Auth_entity_assembly_ID_1 _Bond.Auth_entity_assembly_name_1 _Bond.Auth_asym_ID_1 _Bond.Auth_seq_ID_1 _Bond.Auth_comp_ID_1 _Bond.Auth_atom_ID_1 _Bond.Auth_entity_assembly_ID_2 _Bond.Auth_entity_assembly_name_2 _Bond.Auth_asym_ID_2 _Bond.Auth_seq_ID_2 _Bond.Auth_comp_ID_2 _Bond.Auth_atom_ID_2 _Bond.Entry_ID _Bond.Assembly_ID 1 disulfide single . 1 . 1 CYS 2 2 SG . 1 . 1 CYS 7 7 SG . . . . . . . . . . . . 51865 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 51865 _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 ; KCNTATCATQRLANFLVHSS NNFGAILSSTNVGSNTY ; _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 37 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all disulfide bound' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 3908.319 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 yes BMRB 34069 . 'human IAPP' . . . . . . . . . . . . . . 51865 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 . LYS . 51865 1 2 . CYS . 51865 1 3 . ASN . 51865 1 4 . THR . 51865 1 5 . ALA . 51865 1 6 . THR . 51865 1 7 . CYS . 51865 1 8 . ALA . 51865 1 9 . THR . 51865 1 10 . GLN . 51865 1 11 . ARG . 51865 1 12 . LEU . 51865 1 13 . ALA . 51865 1 14 . ASN . 51865 1 15 . PHE . 51865 1 16 . LEU . 51865 1 17 . VAL . 51865 1 18 . HIS . 51865 1 19 . SER . 51865 1 20 . SER . 51865 1 21 . ASN . 51865 1 22 . ASN . 51865 1 23 . PHE . 51865 1 24 . GLY . 51865 1 25 . ALA . 51865 1 26 . ILE . 51865 1 27 . LEU . 51865 1 28 . SER . 51865 1 29 . SER . 51865 1 30 . THR . 51865 1 31 . ASN . 51865 1 32 . VAL . 51865 1 33 . GLY . 51865 1 34 . SER . 51865 1 35 . ASN . 51865 1 36 . THR . 51865 1 37 . TYR . 51865 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 . LYS 1 1 51865 1 . CYS 2 2 51865 1 . ASN 3 3 51865 1 . THR 4 4 51865 1 . ALA 5 5 51865 1 . THR 6 6 51865 1 . CYS 7 7 51865 1 . ALA 8 8 51865 1 . THR 9 9 51865 1 . GLN 10 10 51865 1 . ARG 11 11 51865 1 . LEU 12 12 51865 1 . ALA 13 13 51865 1 . ASN 14 14 51865 1 . PHE 15 15 51865 1 . LEU 16 16 51865 1 . VAL 17 17 51865 1 . HIS 18 18 51865 1 . SER 19 19 51865 1 . SER 20 20 51865 1 . ASN 21 21 51865 1 . ASN 22 22 51865 1 . PHE 23 23 51865 1 . GLY 24 24 51865 1 . ALA 25 25 51865 1 . ILE 26 26 51865 1 . LEU 27 27 51865 1 . SER 28 28 51865 1 . SER 29 29 51865 1 . THR 30 30 51865 1 . ASN 31 31 51865 1 . VAL 32 32 51865 1 . GLY 33 33 51865 1 . SER 34 34 51865 1 . ASN 35 35 51865 1 . THR 36 36 51865 1 . TYR 37 37 51865 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 51865 _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 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 51865 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 51865 _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 . . pTXB1EEI . . . 51865 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 51865 _Sample.ID 1 _Sample.Name hIAPP _Sample.Type 'gel solution' _Sample.Sub_type . _Sample.Details 'Deuterated and 100% amide back-exchanged sample in H2O' _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '100 % H2O' _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 'recombinant fibrillar hIAPP' '[U-100% 15N]' . . 1 $entity_1 . . 92.5 85 100 mM . . . . 51865 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 51865 _Sample_condition_list.ID 1 _Sample_condition_list.Name 'Standard for deuterated protein sample' _Sample_condition_list.Details 'Deuterated protein sample with full protonation of the amide sites at the MAS rate of 55 kHz.' 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' 0.030 . M 51865 1 pH 5.3 . pH 51865 1 pressure 1 . atm 51865 1 temperature 273 . K 51865 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 51865 _Software.ID 1 _Software.Type . _Software.Name CcpNMR _Software.Version 2.4.2 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 51865 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 51865 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name 'Bruker Avance 850 MHz' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 850 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 51865 _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 15N-1H "CP-HSQC"' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51865 1 2 (H)CANH no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51865 1 3 (H)(CO)CA(CO)NH no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51865 1 4 (H)(CA)CB(CA)NH no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51865 1 5 (H)CONH no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51865 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 51865 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name 'recombinant fibrillar hIAPP' _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 external indirect 0.25 . . . . . 51865 1 H 1 DSS 'methyl protons' . . . . ppm 0 external direct 1 . . . . . 51865 1 N 15 DSS 'methyl protons' . . . . ppm 0 external indirect 0.1 . . . . . 51865 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 51865 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 'recombinant fibrillar hIAPP' _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 (H)CANH . . . 51865 1 3 (H)(CO)CA(CO)NH . . . 51865 1 4 (H)(CA)CB(CA)NH . . . 51865 1 5 (H)CONH . . . 51865 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 . . 51865 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 LYS C C 13 179.300 . . . . . . . . 1 K C . 51865 1 2 . 1 . 1 1 1 LYS CA C 13 55.222 . . . . . . . . 1 K CA . 51865 1 3 . 1 . 1 2 2 CYS H H 1 8.666 . . . . . . . . 2 C HN . 51865 1 4 . 1 . 1 2 2 CYS C C 13 173.682 . . . . . . . . 2 C C . 51865 1 5 . 1 . 1 2 2 CYS CA C 13 59.051 . . . . . . . . 2 C CA . 51865 1 6 . 1 . 1 2 2 CYS N N 15 115.243 . . . . . . . . 2 C N . 51865 1 7 . 1 . 1 3 3 ASN H H 1 8.504 . . . . . . . . 3 N HN . 51865 1 8 . 1 . 1 3 3 ASN C C 13 177.150 . . . . . . . . 3 N C . 51865 1 9 . 1 . 1 3 3 ASN CA C 13 52.437 . . . . . . . . 3 N CA . 51865 1 10 . 1 . 1 3 3 ASN CB C 13 37.874 . . . . . . . . 3 N CB . 51865 1 11 . 1 . 1 3 3 ASN N N 15 114.409 . . . . . . . . 3 N N . 51865 1 12 . 1 . 1 4 4 THR H H 1 9.438 . . . . . . . . 4 T HN . 51865 1 13 . 1 . 1 4 4 THR C C 13 174.690 . . . . . . . . 4 T C . 51865 1 14 . 1 . 1 4 4 THR CA C 13 61.500 . . . . . . . . 4 T CA . 51865 1 15 . 1 . 1 4 4 THR CB C 13 66.594 . . . . . . . . 4 T CB . 51865 1 16 . 1 . 1 4 4 THR N N 15 118.808 . . . . . . . . 4 T N . 51865 1 17 . 1 . 1 5 5 ALA H H 1 6.529 . . . . . . . . 5 A HN . 51865 1 18 . 1 . 1 5 5 ALA C C 13 176.286 . . . . . . . . 5 A C . 51865 1 19 . 1 . 1 5 5 ALA CA C 13 50.620 . . . . . . . . 5 A CA . 51865 1 20 . 1 . 1 5 5 ALA CB C 13 26.422 . . . . . . . . 5 A CB . 51865 1 21 . 1 . 1 5 5 ALA N N 15 119.193 . . . . . . . . 5 A N . 51865 1 22 . 1 . 1 6 6 THR H H 1 8.838 . . . . . . . . 6 T HN . 51865 1 23 . 1 . 1 6 6 THR C C 13 173.583 . . . . . . . . 6 T C . 51865 1 24 . 1 . 1 6 6 THR CA C 13 62.110 . . . . . . . . 6 T CA . 51865 1 25 . 1 . 1 6 6 THR CB C 13 70.110 . . . . . . . . 6 T CB . 51865 1 26 . 1 . 1 6 6 THR N N 15 117.274 . . . . . . . . 6 T N . 51865 1 27 . 1 . 1 7 7 CYS H H 1 9.624 . . . . . . . . 7 C HN . 51865 1 28 . 1 . 1 7 7 CYS C C 13 174.198 . . . . . . . . 7 C C . 51865 1 29 . 1 . 1 7 7 CYS CA C 13 53.360 . . . . . . . . 7 C CA . 51865 1 30 . 1 . 1 7 7 CYS CB C 13 48.672 . . . . . . . . 7 C CB . 51865 1 31 . 1 . 1 7 7 CYS N N 15 121.987 . . . . . . . . 7 C N . 51865 1 32 . 1 . 1 8 8 ALA H H 1 7.838 . . . . . . . . 8 A HN . 51865 1 33 . 1 . 1 8 8 ALA CA C 13 51.196 . . . . . . . . 8 A CA . 51865 1 34 . 1 . 1 8 8 ALA CB C 13 22.991 . . . . . . . . 8 A CB . 51865 1 35 . 1 . 1 8 8 ALA N N 15 123.620 . . . . . . . . 8 A N . 51865 1 36 . 1 . 1 9 9 THR C C 13 171.461 . . . . . . . . 9 T C . 51865 1 37 . 1 . 1 9 9 THR CA C 13 61.094 . . . . . . . . 9 T CA . 51865 1 38 . 1 . 1 10 10 GLN H H 1 9.042 . . . . . . . . 10 Q HN . 51865 1 39 . 1 . 1 10 10 GLN C C 13 173.371 . . . . . . . . 10 Q C . 51865 1 40 . 1 . 1 10 10 GLN CA C 13 53.882 . . . . . . . . 10 Q CA . 51865 1 41 . 1 . 1 10 10 GLN CB C 13 34.460 . . . . . . . . 10 Q CB . 51865 1 42 . 1 . 1 10 10 GLN N N 15 126.978 . . . . . . . . 10 Q N . 51865 1 43 . 1 . 1 11 11 ARG H H 1 9.101 . . . . . . . . 11 R HN . 51865 1 44 . 1 . 1 11 11 ARG C C 13 173.390 . . . . . . . . 11 R C . 51865 1 45 . 1 . 1 11 11 ARG CA C 13 54.094 . . . . . . . . 11 R CA . 51865 1 46 . 1 . 1 11 11 ARG CB C 13 32.958 . . . . . . . . 11 R CB . 51865 1 47 . 1 . 1 11 11 ARG N N 15 130.105 . . . . . . . . 11 R N . 51865 1 48 . 1 . 1 12 12 LEU H H 1 8.838 . . . . . . . . 12 L HN . 51865 1 49 . 1 . 1 12 12 LEU C C 13 175.380 . . . . . . . . 12 L C . 51865 1 50 . 1 . 1 12 12 LEU CA C 13 54.572 . . . . . . . . 12 L CA . 51865 1 51 . 1 . 1 12 12 LEU CB C 13 43.043 . . . . . . . . 12 L CB . 51865 1 52 . 1 . 1 12 12 LEU N N 15 123.486 . . . . . . . . 12 L N . 51865 1 53 . 1 . 1 13 13 ALA H H 1 9.236 . . . . . . . . 13 A HN . 51865 1 54 . 1 . 1 13 13 ALA C C 13 175.102 . . . . . . . . 13 A C . 51865 1 55 . 1 . 1 13 13 ALA CA C 13 52.192 . . . . . . . . 13 A CA . 51865 1 56 . 1 . 1 13 13 ALA CB C 13 16.339 . . . . . . . . 13 A CB . 51865 1 57 . 1 . 1 13 13 ALA N N 15 122.577 . . . . . . . . 13 A N . 51865 1 58 . 1 . 1 14 14 ASN H H 1 8.102 . . . . . . . . 14 N HN . 51865 1 59 . 1 . 1 14 14 ASN C C 13 173.309 . . . . . . . . 14 N C . 51865 1 60 . 1 . 1 14 14 ASN CA C 13 52.154 . . . . . . . . 14 N CA . 51865 1 61 . 1 . 1 14 14 ASN CB C 13 40.767 . . . . . . . . 14 N CB . 51865 1 62 . 1 . 1 14 14 ASN N N 15 115.358 . . . . . . . . 14 N N . 51865 1 63 . 1 . 1 15 15 PHE H H 1 9.026 . . . . . . . . 15 F HN . 51865 1 64 . 1 . 1 15 15 PHE C C 13 173.314 . . . . . . . . 15 F C . 51865 1 65 . 1 . 1 15 15 PHE CA C 13 57.066 . . . . . . . . 15 F CA . 51865 1 66 . 1 . 1 15 15 PHE CB C 13 41.381 . . . . . . . . 15 F CB . 51865 1 67 . 1 . 1 15 15 PHE N N 15 122.493 . . . . . . . . 15 F N . 51865 1 68 . 1 . 1 16 16 LEU H H 1 9.174 . . . . . . . . 16 L HN . 51865 1 69 . 1 . 1 16 16 LEU C C 13 174.659 . . . . . . . . 16 L C . 51865 1 70 . 1 . 1 16 16 LEU CA C 13 53.413 . . . . . . . . 16 L CA . 51865 1 71 . 1 . 1 16 16 LEU CB C 13 44.963 . . . . . . . . 16 L CB . 51865 1 72 . 1 . 1 16 16 LEU N N 15 130.174 . . . . . . . . 16 L N . 51865 1 73 . 1 . 1 17 17 VAL H H 1 8.340 . . . . . . . . 17 V HN . 51865 1 74 . 1 . 1 17 17 VAL C C 13 171.385 . . . . . . . . 17 V C . 51865 1 75 . 1 . 1 17 17 VAL CA C 13 61.461 . . . . . . . . 17 V CA . 51865 1 76 . 1 . 1 17 17 VAL CB C 13 33.477 . . . . . . . . 17 V CB . 51865 1 77 . 1 . 1 17 17 VAL N N 15 123.662 . . . . . . . . 17 V N . 51865 1 78 . 1 . 1 18 18 HIS H H 1 8.984 . . . . . . . . 18 H HN . 51865 1 79 . 1 . 1 18 18 HIS C C 13 175.790 . . . . . . . . 18 H C . 51865 1 80 . 1 . 1 18 18 HIS CA C 13 55.354 . . . . . . . . 18 H CA . 51865 1 81 . 1 . 1 18 18 HIS CB C 13 39.595 . . . . . . . . 18 H CB . 51865 1 82 . 1 . 1 18 18 HIS N N 15 127.027 . . . . . . . . 18 H N . 51865 1 83 . 1 . 1 19 19 SER H H 1 7.823 . . . . . . . . 19 S HN . 51865 1 84 . 1 . 1 19 19 SER C C 13 173.130 . . . . . . . . 19 S C . 51865 1 85 . 1 . 1 19 19 SER CA C 13 58.988 . . . . . . . . 19 S CA . 51865 1 86 . 1 . 1 19 19 SER CB C 13 66.678 . . . . . . . . 19 S CB . 51865 1 87 . 1 . 1 19 19 SER N N 15 113.781 . . . . . . . . 19 S N . 51865 1 88 . 1 . 1 20 20 SER H H 1 8.079 . . . . . . . . 20 S HN . 51865 1 89 . 1 . 1 20 20 SER C C 13 172.078 . . . . . . . . 20 S C . 51865 1 90 . 1 . 1 20 20 SER CA C 13 57.948 . . . . . . . . 20 S CA . 51865 1 91 . 1 . 1 20 20 SER CB C 13 67.386 . . . . . . . . 20 S CB . 51865 1 92 . 1 . 1 20 20 SER N N 15 111.746 . . . . . . . . 20 S N . 51865 1 93 . 1 . 1 21 21 ASN H H 1 8.551 . . . . . . . . 21 N HN . 51865 1 94 . 1 . 1 21 21 ASN C C 13 173.134 . . . . . . . . 21 N C . 51865 1 95 . 1 . 1 21 21 ASN CA C 13 52.276 . . . . . . . . 21 N CA . 51865 1 96 . 1 . 1 21 21 ASN CB C 13 36.626 . . . . . . . . 21 N CB . 51865 1 97 . 1 . 1 21 21 ASN N N 15 117.406 . . . . . . . . 21 N N . 51865 1 98 . 1 . 1 22 22 ASN H H 1 8.840 . . . . . . . . 22 N HN . 51865 1 99 . 1 . 1 22 22 ASN C C 13 174.130 . . . . . . . . 22 N C . 51865 1 100 . 1 . 1 22 22 ASN CA C 13 52.286 . . . . . . . . 22 N CA . 51865 1 101 . 1 . 1 22 22 ASN CB C 13 42.273 . . . . . . . . 22 N CB . 51865 1 102 . 1 . 1 22 22 ASN N N 15 111.054 . . . . . . . . 22 N N . 51865 1 103 . 1 . 1 23 23 PHE H H 1 9.270 . . . . . . . . 23 F HN . 51865 1 104 . 1 . 1 23 23 PHE C C 13 174.478 . . . . . . . . 23 F C . 51865 1 105 . 1 . 1 23 23 PHE CA C 13 55.738 . . . . . . . . 23 F CA . 51865 1 106 . 1 . 1 23 23 PHE CB C 13 41.345 . . . . . . . . 23 F CB . 51865 1 107 . 1 . 1 23 23 PHE N N 15 121.091 . . . . . . . . 23 F N . 51865 1 108 . 1 . 1 24 24 GLY H H 1 9.080 . . . . . . . . 24 G HN . 51865 1 109 . 1 . 1 24 24 GLY C C 13 171.266 . . . . . . . . 24 G C . 51865 1 110 . 1 . 1 24 24 GLY CA C 13 43.551 . . . . . . . . 24 G CA . 51865 1 111 . 1 . 1 24 24 GLY N N 15 118.065 . . . . . . . . 24 G N . 51865 1 112 . 1 . 1 25 25 ALA H H 1 7.923 . . . . . . . . 25 A HN . 51865 1 113 . 1 . 1 25 25 ALA C C 13 173.877 . . . . . . . . 25 A C . 51865 1 114 . 1 . 1 25 25 ALA CA C 13 50.002 . . . . . . . . 25 A CA . 51865 1 115 . 1 . 1 25 25 ALA CB C 13 23.029 . . . . . . . . 25 A CB . 51865 1 116 . 1 . 1 25 25 ALA N N 15 123.698 . . . . . . . . 25 A N . 51865 1 117 . 1 . 1 26 26 ILE H H 1 8.653 . . . . . . . . 26 I HN . 51865 1 118 . 1 . 1 26 26 ILE C C 13 174.109 . . . . . . . . 26 I C . 51865 1 119 . 1 . 1 26 26 ILE CA C 13 58.343 . . . . . . . . 26 I CA . 51865 1 120 . 1 . 1 26 26 ILE CB C 13 36.611 . . . . . . . . 26 I CB . 51865 1 121 . 1 . 1 26 26 ILE N N 15 122.824 . . . . . . . . 26 I N . 51865 1 122 . 1 . 1 27 27 LEU H H 1 9.590 . . . . . . . . 27 L HN . 51865 1 123 . 1 . 1 27 27 LEU C C 13 177.420 . . . . . . . . 27 L C . 51865 1 124 . 1 . 1 27 27 LEU CA C 13 54.313 . . . . . . . . 27 L CA . 51865 1 125 . 1 . 1 27 27 LEU CB C 13 44.737 . . . . . . . . 27 L CB . 51865 1 126 . 1 . 1 27 27 LEU N N 15 124.680 . . . . . . . . 27 L N . 51865 1 127 . 1 . 1 28 28 SER H H 1 8.658 . . . . . . . . 28 S HN . 51865 1 128 . 1 . 1 28 28 SER C C 13 173.827 . . . . . . . . 28 S C . 51865 1 129 . 1 . 1 28 28 SER CA C 13 57.161 . . . . . . . . 28 S CA . 51865 1 130 . 1 . 1 28 28 SER CB C 13 61.097 . . . . . . . . 28 S CB . 51865 1 131 . 1 . 1 28 28 SER N N 15 120.130 . . . . . . . . 28 S N . 51865 1 132 . 1 . 1 29 29 SER H H 1 8.364 . . . . . . . . 29 S HN . 51865 1 133 . 1 . 1 29 29 SER C C 13 172.414 . . . . . . . . 29 S C . 51865 1 134 . 1 . 1 29 29 SER CA C 13 58.467 . . . . . . . . 29 S CA . 51865 1 135 . 1 . 1 29 29 SER CB C 13 67.710 . . . . . . . . 29 S CB . 51865 1 136 . 1 . 1 29 29 SER N N 15 112.099 . . . . . . . . 29 S N . 51865 1 137 . 1 . 1 30 30 THR H H 1 8.479 . . . . . . . . 30 T HN . 51865 1 138 . 1 . 1 30 30 THR C C 13 172.069 . . . . . . . . 30 T C . 51865 1 139 . 1 . 1 30 30 THR CA C 13 62.784 . . . . . . . . 30 T CA . 51865 1 140 . 1 . 1 30 30 THR CB C 13 68.874 . . . . . . . . 30 T CB . 51865 1 141 . 1 . 1 30 30 THR N N 15 119.940 . . . . . . . . 30 T N . 51865 1 142 . 1 . 1 31 31 ASN H H 1 9.597 . . . . . . . . 31 N HN . 51865 1 143 . 1 . 1 31 31 ASN C C 13 174.180 . . . . . . . . 31 N C . 51865 1 144 . 1 . 1 31 31 ASN CA C 13 52.336 . . . . . . . . 31 N CA . 51865 1 145 . 1 . 1 31 31 ASN CB C 13 40.901 . . . . . . . . 31 N CB . 51865 1 146 . 1 . 1 31 31 ASN N N 15 130.434 . . . . . . . . 31 N N . 51865 1 147 . 1 . 1 32 32 VAL H H 1 8.475 . . . . . . . . 32 V HN . 51865 1 148 . 1 . 1 32 32 VAL C C 13 176.181 . . . . . . . . 32 V C . 51865 1 149 . 1 . 1 32 32 VAL CA C 13 60.082 . . . . . . . . 32 V CA . 51865 1 150 . 1 . 1 32 32 VAL CB C 13 34.404 . . . . . . . . 32 V CB . 51865 1 151 . 1 . 1 32 32 VAL N N 15 126.728 . . . . . . . . 32 V N . 51865 1 152 . 1 . 1 33 33 GLY H H 1 8.980 . . . . . . . . 33 G HN . 51865 1 153 . 1 . 1 33 33 GLY C C 13 174.823 . . . . . . . . 33 G C . 51865 1 154 . 1 . 1 33 33 GLY CA C 13 46.801 . . . . . . . . 33 G CA . 51865 1 155 . 1 . 1 33 33 GLY N N 15 117.886 . . . . . . . . 33 G N . 51865 1 156 . 1 . 1 34 34 SER H H 1 7.905 . . . . . . . . 34 S HN . 51865 1 157 . 1 . 1 34 34 SER C C 13 173.273 . . . . . . . . 34 S C . 51865 1 158 . 1 . 1 34 34 SER CA C 13 58.123 . . . . . . . . 34 S CA . 51865 1 159 . 1 . 1 34 34 SER CB C 13 66.736 . . . . . . . . 34 S CB . 51865 1 160 . 1 . 1 34 34 SER N N 15 114.759 . . . . . . . . 34 S N . 51865 1 161 . 1 . 1 35 35 ASN H H 1 8.185 . . . . . . . . 35 N HN . 51865 1 162 . 1 . 1 35 35 ASN C C 13 174.423 . . . . . . . . 35 N C . 51865 1 163 . 1 . 1 35 35 ASN CA C 13 51.625 . . . . . . . . 35 N CA . 51865 1 164 . 1 . 1 35 35 ASN CB C 13 40.229 . . . . . . . . 35 N CB . 51865 1 165 . 1 . 1 35 35 ASN N N 15 123.004 . . . . . . . . 35 N N . 51865 1 166 . 1 . 1 36 36 THR H H 1 8.777 . . . . . . . . 36 T HN . 51865 1 167 . 1 . 1 36 36 THR CA C 13 60.995 . . . . . . . . 36 T CA . 51865 1 168 . 1 . 1 36 36 THR CB C 13 70.315 . . . . . . . . 36 T CB . 51865 1 169 . 1 . 1 36 36 THR N N 15 121.226 . . . . . . . . 36 T N . 51865 1 stop_ save_