data_51843 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 51843 _Entry.Title ; 1H, 13C and 15N resonance assignments of four MEF2D b-domain peptide constructs (var8) ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2023-02-18 _Entry.Accession_date 2023-02-18 _Entry.Last_release_date 2023-02-20 _Entry.Original_release_date 2023-02-20 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 'Tamas Milan' Nagy . . . 0000-0003-4766-1992 51843 2 Krisztina Feher . . . 0000-0003-0951-2507 51843 3 Katalin Kover . E. . 0000-0001-5020-4456 51843 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 51843 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 72 51843 '15N chemical shifts' 6 51843 '1H chemical shifts' 226 51843 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 2 . . 2023-05-07 2023-02-18 update BMRB 'update entry citation' 51843 1 . . 2023-02-21 2023-02-18 original author 'original release' 51843 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 51840 'MEF2D b-domain peptide constructs (wild type)' 51843 BMRB 51841 'MEF2D b-domain peptide constructs (var3)' 51843 BMRB 51842 'MEF2D b-domain peptide constructs (var4)' 51843 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 51843 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 36898987 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Alternatively spliced exon regulates context-dependent MEF2D higher-order assembly during myogenesis ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Nat. Commun.' _Citation.Journal_name_full 'Nature communications' _Citation.Journal_volume 14 _Citation.Journal_issue 1 _Citation.Journal_ASTM . _Citation.Journal_ISSN 2041-1723 _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 1329 _Citation.Page_last 1329 _Citation.Year 2023 _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 Monika Gonczi . . . . 51843 1 2 Joao Teixeira . M.C. . . 51843 1 3 Susana Barrera-Vilarmau . . . . 51843 1 4 Laura Mediani . . . . 51843 1 5 Francesco Antoniani . . . . 51843 1 6 'Tamas Milan' Nagy . . . . 51843 1 7 Krisztina Feher . . . . 51843 1 8 Zsolt Raduly . . . . 51843 1 9 Viktor Ambrus . . . . 51843 1 10 Jozsef Tozser . . . . 51843 1 11 Endre Barta . . . . 51843 1 12 Katalin Kover . E. . . 51843 1 13 Laszlo Csernoch . . . . 51843 1 14 Serena Carra . . . . 51843 1 15 Monika Fuxreiter . . . . 51843 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 51843 _Assembly.ID 1 _Assembly.Name 'MEF2D construct var8' _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 'MEF2D var8' 1 $entity_1 . . yes native no no . . . 51843 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 51843 _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 ; SRKPDLRVITSQAGKGLMHH LTEDHLDLDNWQRLGVS ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states yes _Entity.Ambiguous_chem_comp_sites yes _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 '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 . SER . 51843 1 2 . ARG . 51843 1 3 . LYS . 51843 1 4 . PRO . 51843 1 5 . ASP . 51843 1 6 . LEU . 51843 1 7 . ARG . 51843 1 8 . VAL . 51843 1 9 . ILE . 51843 1 10 . THR . 51843 1 11 . SER . 51843 1 12 . GLN . 51843 1 13 . ALA . 51843 1 14 . GLY . 51843 1 15 . LYS . 51843 1 16 . GLY . 51843 1 17 . LEU . 51843 1 18 . MET . 51843 1 19 . HIS . 51843 1 20 . HIS . 51843 1 21 . LEU . 51843 1 22 . THR . 51843 1 23 . GLU . 51843 1 24 . ASP . 51843 1 25 . HIS . 51843 1 26 . LEU . 51843 1 27 . ASP . 51843 1 28 . LEU . 51843 1 29 . ASP . 51843 1 30 . ASN . 51843 1 31 . TRP . 51843 1 32 . GLN . 51843 1 33 . ARG . 51843 1 34 . LEU . 51843 1 35 . GLY . 51843 1 36 . VAL . 51843 1 37 . SER . 51843 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 . SER 1 1 51843 1 . ARG 2 2 51843 1 . LYS 3 3 51843 1 . PRO 4 4 51843 1 . ASP 5 5 51843 1 . LEU 6 6 51843 1 . ARG 7 7 51843 1 . VAL 8 8 51843 1 . ILE 9 9 51843 1 . THR 10 10 51843 1 . SER 11 11 51843 1 . GLN 12 12 51843 1 . ALA 13 13 51843 1 . GLY 14 14 51843 1 . LYS 15 15 51843 1 . GLY 16 16 51843 1 . LEU 17 17 51843 1 . MET 18 18 51843 1 . HIS 19 19 51843 1 . HIS 20 20 51843 1 . LEU 21 21 51843 1 . THR 22 22 51843 1 . GLU 23 23 51843 1 . ASP 24 24 51843 1 . HIS 25 25 51843 1 . LEU 26 26 51843 1 . ASP 27 27 51843 1 . LEU 28 28 51843 1 . ASP 29 29 51843 1 . ASN 30 30 51843 1 . TRP 31 31 51843 1 . GLN 32 32 51843 1 . ARG 33 33 51843 1 . LEU 34 34 51843 1 . GLY 35 35 51843 1 . VAL 36 36 51843 1 . SER 37 37 51843 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 51843 _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 . . 'not applicable' . . . . . . . . . . . . . . . . . . . . . . 51843 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 51843 _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 . 'chemical synthesis' . . . . . . . . . . . . . . . . 51843 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 51843 _Sample.ID 1 _Sample.Name 'MEF2D var8' _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '95% H2O/5% 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 'MEF2D construct var8' [U-15N]-Leu . . 1 $entity_1 . . 1 . . mM . . . . 51843 1 2 DSS 'natural abundance' . . . . . . 8 . . ug . . . . 51843 1 3 Na2HPO4/NaH2PO4 'natural abundance' . . . . . . 20 . . mM . . . . 51843 1 4 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 51843 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 51843 _Sample_condition_list.ID 1 _Sample_condition_list.Name 'MEF2D solution' _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 . pH 51843 1 pressure 1 . atm 51843 1 temperature 298 . K 51843 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 51843 _Software.ID 1 _Software.Type . _Software.Name TOPSPIN _Software.Version 4.0.5 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'data collection and analysis' . 51843 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 51843 _Software.ID 2 _Software.Type . _Software.Name CARA _Software.Version 1.9 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 51843 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 51843 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name 'Bruker Avance Neo 700 MHz' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE NEO' _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 51843 _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-1H TOCSY' no no . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51843 1 2 '2D 1H-1H ROESY' no no . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51843 1 3 '2D 1H-13C HSQC' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51843 1 4 '2D 1H-13C HSQC-TOCSY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51843 1 5 '2D 1H-15N HSQC' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51843 1 6 '2D 1H-15N HSQC-TOCSY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51843 1 7 '2D 1H-15N HSQC-ROESY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51843 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 51843 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name 'MEF2D references' _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 carbons' . . . . ppm 0 internal indirect 0.251449530 . . . . . 51843 1 H 1 DSS 'methyl protons' . . . . ppm 0 internal direct 1 . . . . . 51843 1 N 15 'liquid anhydrous ammonia' nitrogen . . . . ppm 0 external indirect 0.101329118 . . . . . 51843 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 51843 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 'MEF2D var8' _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-1H TOCSY' . . . 51843 1 2 '2D 1H-1H ROESY' . . . 51843 1 3 '2D 1H-13C HSQC' . . . 51843 1 4 '2D 1H-13C HSQC-TOCSY' . . . 51843 1 5 '2D 1H-15N HSQC' . . . 51843 1 6 '2D 1H-15N HSQC-TOCSY' . . . 51843 1 7 '2D 1H-15N HSQC-ROESY' . . . 51843 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 . . 51843 1 2 $software_2 . . 51843 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 SER H H 1 7.983 0.020 . 1 . . . . . 1 SER H . 51843 1 2 . 1 . 1 1 1 SER HA H 1 4.188 0.020 . 1 . . . . . 1 SER HA . 51843 1 3 . 1 . 1 1 1 SER HB2 H 1 3.150 0.020 . 1 . . . . . 1 SER HB2 . 51843 1 4 . 1 . 1 1 1 SER HB3 H 1 3.150 0.020 . 1 . . . . . 1 SER HB3 . 51843 1 5 . 1 . 1 1 1 SER CA C 13 54.711 0.3 . 1 . . . . . 1 SER CA . 51843 1 6 . 1 . 1 1 1 SER CB C 13 60.515 0.3 . 1 . . . . . 1 SER CB . 51843 1 7 . 1 . 1 2 2 ARG H H 1 8.728 0.020 . 1 . . . . . 2 ARG H . 51843 1 8 . 1 . 1 2 2 ARG HA H 1 4.389 0.020 . 1 . . . . . 2 ARG HA . 51843 1 9 . 1 . 1 2 2 ARG HB2 H 1 1.811 0.020 . 2 . . . . . 2 ARG HB2 . 51843 1 10 . 1 . 1 2 2 ARG HB3 H 1 1.754 0.020 . 2 . . . . . 2 ARG HB3 . 51843 1 11 . 1 . 1 2 2 ARG HG2 H 1 1.617 0.020 . 1 . . . . . 2 ARG HG2 . 51843 1 12 . 1 . 1 2 2 ARG HG3 H 1 1.617 0.020 . 1 . . . . . 2 ARG HG3 . 51843 1 13 . 1 . 1 2 2 ARG CA C 13 53.575 0.3 . 1 . . . . . 2 ARG CA . 51843 1 14 . 1 . 1 2 2 ARG CB C 13 28.425 0.3 . 1 . . . . . 2 ARG CB . 51843 1 15 . 1 . 1 3 3 LYS H H 1 8.543 0.020 . 1 . . . . . 3 LYS H . 51843 1 16 . 1 . 1 3 3 LYS HA H 1 4.555 0.020 . 1 . . . . . 3 LYS HA . 51843 1 17 . 1 . 1 3 3 LYS HB2 H 1 1.833 0.020 . 2 . . . . . 3 LYS HB2 . 51843 1 18 . 1 . 1 3 3 LYS HB3 H 1 1.709 0.020 . 2 . . . . . 3 LYS HB3 . 51843 1 19 . 1 . 1 3 3 LYS HG2 H 1 1.476 0.020 . 1 . . . . . 3 LYS HG2 . 51843 1 20 . 1 . 1 3 3 LYS HG3 H 1 1.476 0.020 . 1 . . . . . 3 LYS HG3 . 51843 1 21 . 1 . 1 3 3 LYS CA C 13 51.892 0.3 . 1 . . . . . 3 LYS CA . 51843 1 22 . 1 . 1 3 3 LYS CB C 13 29.777 0.3 . 1 . . . . . 3 LYS CB . 51843 1 23 . 1 . 1 4 4 PRO HA H 1 4.390 0.020 . 1 . . . . . 4 PRO HA . 51843 1 24 . 1 . 1 4 4 PRO HD2 H 1 3.837 0.020 . 1 . . . . . 4 PRO HD2 . 51843 1 25 . 1 . 1 4 4 PRO CA C 13 60.542 0.3 . 1 . . . . . 4 PRO CA . 51843 1 26 . 1 . 1 4 4 PRO CB C 13 29.518 0.3 . 1 . . . . . 4 PRO CB . 51843 1 27 . 1 . 1 4 4 PRO CG C 13 24.695 0.3 . 1 . . . . . 4 PRO CG . 51843 1 28 . 1 . 1 4 4 PRO CD C 13 48.030 0.3 . 1 . . . . . 4 PRO CD . 51843 1 29 . 1 . 1 5 5 ASP H H 1 8.418 0.020 . 1 . . . . . 5 ASP H . 51843 1 30 . 1 . 1 5 5 ASP HA H 1 4.580 0.020 . 1 . . . . . 5 ASP HA . 51843 1 31 . 1 . 1 5 5 ASP HB2 H 1 2.740 0.020 . 2 . . . . . 5 ASP HB2 . 51843 1 32 . 1 . 1 5 5 ASP HB3 H 1 2.586 0.020 . 2 . . . . . 5 ASP HB3 . 51843 1 33 . 1 . 1 5 5 ASP CA C 13 51.340 0.3 . 1 . . . . . 5 ASP CA . 51843 1 34 . 1 . 1 5 5 ASP CB C 13 38.289 0.3 . 1 . . . . . 5 ASP CB . 51843 1 35 . 1 . 1 6 6 LEU H H 1 8.255 0.020 . 1 . . . . . 6 LEU H . 51843 1 36 . 1 . 1 6 6 LEU HA H 1 4.310 0.020 . 1 . . . . . 6 LEU HA . 51843 1 37 . 1 . 1 6 6 LEU HB2 H 1 1.605 0.020 . 1 . . . . . 6 LEU HB2 . 51843 1 38 . 1 . 1 6 6 LEU HB3 H 1 1.605 0.020 . 1 . . . . . 6 LEU HB3 . 51843 1 39 . 1 . 1 6 6 LEU HD11 H 1 0.909 0.020 . 2 . . . . . 6 LEU HD1 . 51843 1 40 . 1 . 1 6 6 LEU HD12 H 1 0.909 0.020 . 2 . . . . . 6 LEU HD1 . 51843 1 41 . 1 . 1 6 6 LEU HD13 H 1 0.909 0.020 . 2 . . . . . 6 LEU HD1 . 51843 1 42 . 1 . 1 6 6 LEU HD21 H 1 0.847 0.020 . 2 . . . . . 6 LEU HD2 . 51843 1 43 . 1 . 1 6 6 LEU HD22 H 1 0.847 0.020 . 2 . . . . . 6 LEU HD2 . 51843 1 44 . 1 . 1 6 6 LEU HD23 H 1 0.847 0.020 . 2 . . . . . 6 LEU HD2 . 51843 1 45 . 1 . 1 6 6 LEU CA C 13 52.762 0.3 . 1 . . . . . 6 LEU CA . 51843 1 46 . 1 . 1 6 6 LEU CB C 13 39.582 0.3 . 1 . . . . . 6 LEU CB . 51843 1 47 . 1 . 1 6 6 LEU N N 15 123.757 0.3 . 1 . . . . . 6 LEU N . 51843 1 48 . 1 . 1 7 7 ARG H H 1 8.320 0.020 . 1 . . . . . 7 ARG H . 51843 1 49 . 1 . 1 7 7 ARG HA H 1 4.266 0.020 . 1 . . . . . 7 ARG HA . 51843 1 50 . 1 . 1 7 7 ARG HB2 H 1 1.789 0.020 . 1 . . . . . 7 ARG HB2 . 51843 1 51 . 1 . 1 7 7 ARG HB3 H 1 1.789 0.020 . 1 . . . . . 7 ARG HB3 . 51843 1 52 . 1 . 1 7 7 ARG HG2 H 1 1.629 0.020 . 2 . . . . . 7 ARG HG2 . 51843 1 53 . 1 . 1 7 7 ARG HG3 H 1 1.570 0.020 . 2 . . . . . 7 ARG HG3 . 51843 1 54 . 1 . 1 7 7 ARG HD2 H 1 3.178 0.020 . 1 . . . . . 7 ARG HD2 . 51843 1 55 . 1 . 1 7 7 ARG HD3 H 1 3.178 0.020 . 1 . . . . . 7 ARG HD3 . 51843 1 56 . 1 . 1 7 7 ARG CA C 13 53.876 0.3 . 1 . . . . . 7 ARG CA . 51843 1 57 . 1 . 1 7 7 ARG CB C 13 28.002 0.3 . 1 . . . . . 7 ARG CB . 51843 1 58 . 1 . 1 8 8 VAL H H 1 8.081 0.020 . 1 . . . . . 8 VAL H . 51843 1 59 . 1 . 1 8 8 VAL HA H 1 4.065 0.020 . 1 . . . . . 8 VAL HA . 51843 1 60 . 1 . 1 8 8 VAL HB H 1 2.036 0.020 . 1 . . . . . 8 VAL HB . 51843 1 61 . 1 . 1 8 8 VAL HG11 H 1 0.900 0.020 . 1 . . . . . 8 VAL HG1 . 51843 1 62 . 1 . 1 8 8 VAL HG12 H 1 0.900 0.020 . 1 . . . . . 8 VAL HG1 . 51843 1 63 . 1 . 1 8 8 VAL HG13 H 1 0.900 0.020 . 1 . . . . . 8 VAL HG1 . 51843 1 64 . 1 . 1 8 8 VAL HG21 H 1 0.900 0.020 . 1 . . . . . 8 VAL HG2 . 51843 1 65 . 1 . 1 8 8 VAL HG22 H 1 0.900 0.020 . 1 . . . . . 8 VAL HG2 . 51843 1 66 . 1 . 1 8 8 VAL HG23 H 1 0.900 0.020 . 1 . . . . . 8 VAL HG2 . 51843 1 67 . 1 . 1 8 8 VAL CA C 13 59.952 0.3 . 1 . . . . . 8 VAL CA . 51843 1 68 . 1 . 1 8 8 VAL CB C 13 30.070 0.3 . 1 . . . . . 8 VAL CB . 51843 1 69 . 1 . 1 9 9 ILE H H 1 8.291 0.020 . 1 . . . . . 9 ILE H . 51843 1 70 . 1 . 1 9 9 ILE HA H 1 4.223 0.020 . 1 . . . . . 9 ILE HA . 51843 1 71 . 1 . 1 9 9 ILE HB H 1 1.870 0.020 . 1 . . . . . 9 ILE HB . 51843 1 72 . 1 . 1 9 9 ILE HD11 H 1 0.889 0.020 . 1 . . . . . 9 ILE HD1 . 51843 1 73 . 1 . 1 9 9 ILE HD12 H 1 0.889 0.020 . 1 . . . . . 9 ILE HD1 . 51843 1 74 . 1 . 1 9 9 ILE HD13 H 1 0.889 0.020 . 1 . . . . . 9 ILE HD1 . 51843 1 75 . 1 . 1 9 9 ILE CA C 13 58.554 0.3 . 1 . . . . . 9 ILE CA . 51843 1 76 . 1 . 1 9 9 ILE CB C 13 35.863 0.3 . 1 . . . . . 9 ILE CB . 51843 1 77 . 1 . 1 10 10 THR H H 1 8.229 0.020 . 1 . . . . . 10 THR H . 51843 1 78 . 1 . 1 10 10 THR HA H 1 4.361 0.020 . 1 . . . . . 10 THR HA . 51843 1 79 . 1 . 1 10 10 THR HB H 1 4.237 0.020 . 1 . . . . . 10 THR HB . 51843 1 80 . 1 . 1 10 10 THR HG21 H 1 1.191 0.020 . 1 . . . . . 10 THR HG2 . 51843 1 81 . 1 . 1 10 10 THR HG22 H 1 1.191 0.020 . 1 . . . . . 10 THR HG2 . 51843 1 82 . 1 . 1 10 10 THR HG23 H 1 1.191 0.020 . 1 . . . . . 10 THR HG2 . 51843 1 83 . 1 . 1 10 10 THR CA C 13 59.334 0.3 . 1 . . . . . 10 THR CA . 51843 1 84 . 1 . 1 10 10 THR CB C 13 67.157 0.3 . 1 . . . . . 10 THR CB . 51843 1 85 . 1 . 1 11 11 SER H H 1 8.293 0.020 . 1 . . . . . 11 SER H . 51843 1 86 . 1 . 1 11 11 SER HA H 1 4.443 0.020 . 1 . . . . . 11 SER HA . 51843 1 87 . 1 . 1 11 11 SER HB2 H 1 3.913 0.020 . 2 . . . . . 11 SER HB2 . 51843 1 88 . 1 . 1 11 11 SER HB3 H 1 3.848 0.020 . 2 . . . . . 11 SER HB3 . 51843 1 89 . 1 . 1 11 11 SER CA C 13 55.860 0.3 . 1 . . . . . 11 SER CA . 51843 1 90 . 1 . 1 11 11 SER CB C 13 61.189 0.3 . 1 . . . . . 11 SER CB . 51843 1 91 . 1 . 1 12 12 GLN H H 1 8.432 0.020 . 1 . . . . . 12 GLN H . 51843 1 92 . 1 . 1 12 12 GLN HA H 1 4.315 0.020 . 1 . . . . . 12 GLN HA . 51843 1 93 . 1 . 1 12 12 GLN HB2 H 1 2.131 0.020 . 2 . . . . . 12 GLN HB2 . 51843 1 94 . 1 . 1 12 12 GLN HB3 H 1 1.954 0.020 . 2 . . . . . 12 GLN HB3 . 51843 1 95 . 1 . 1 12 12 GLN HG2 H 1 2.358 0.020 . 1 . . . . . 12 GLN HG2 . 51843 1 96 . 1 . 1 12 12 GLN HG3 H 1 2.358 0.020 . 1 . . . . . 12 GLN HG3 . 51843 1 97 . 1 . 1 12 12 GLN CA C 13 53.369 0.3 . 1 . . . . . 12 GLN CA . 51843 1 98 . 1 . 1 12 12 GLN CB C 13 26.641 0.3 . 1 . . . . . 12 GLN CB . 51843 1 99 . 1 . 1 13 13 ALA H H 1 8.265 0.020 . 1 . . . . . 13 ALA H . 51843 1 100 . 1 . 1 13 13 ALA HA H 1 4.284 0.020 . 1 . . . . . 13 ALA HA . 51843 1 101 . 1 . 1 13 13 ALA HB1 H 1 1.381 0.020 . 1 . . . . . 13 ALA HB . 51843 1 102 . 1 . 1 13 13 ALA HB2 H 1 1.381 0.020 . 1 . . . . . 13 ALA HB . 51843 1 103 . 1 . 1 13 13 ALA HB3 H 1 1.381 0.020 . 1 . . . . . 13 ALA HB . 51843 1 104 . 1 . 1 13 13 ALA CA C 13 50.353 0.3 . 1 . . . . . 13 ALA CA . 51843 1 105 . 1 . 1 13 13 ALA CB C 13 16.476 0.3 . 1 . . . . . 13 ALA CB . 51843 1 106 . 1 . 1 14 14 GLY H H 1 8.377 0.020 . 1 . . . . . 14 GLY H . 51843 1 107 . 1 . 1 14 14 GLY HA2 H 1 3.938 0.020 . 1 . . . . . 14 GLY HA2 . 51843 1 108 . 1 . 1 14 14 GLY HA3 H 1 3.938 0.020 . 1 . . . . . 14 GLY HA3 . 51843 1 109 . 1 . 1 14 14 GLY CA C 13 42.877 0.3 . 1 . . . . . 14 GLY CA . 51843 1 110 . 1 . 1 15 15 LYS H H 1 8.141 0.020 . 1 . . . . . 15 LYS H . 51843 1 111 . 1 . 1 15 15 LYS HA H 1 4.308 0.020 . 1 . . . . . 15 LYS HA . 51843 1 112 . 1 . 1 15 15 LYS HB2 H 1 1.860 0.020 . 2 . . . . . 15 LYS HB2 . 51843 1 113 . 1 . 1 15 15 LYS HB3 H 1 1.758 0.020 . 2 . . . . . 15 LYS HB3 . 51843 1 114 . 1 . 1 15 15 LYS HG2 H 1 1.446 0.020 . 2 . . . . . 15 LYS HG2 . 51843 1 115 . 1 . 1 15 15 LYS HG3 H 1 1.377 0.020 . 2 . . . . . 15 LYS HG3 . 51843 1 116 . 1 . 1 15 15 LYS HD2 H 1 1.655 0.020 . 1 . . . . . 15 LYS HD2 . 51843 1 117 . 1 . 1 15 15 LYS HD3 H 1 1.655 0.020 . 1 . . . . . 15 LYS HD3 . 51843 1 118 . 1 . 1 15 15 LYS CA C 13 53.963 0.3 . 1 . . . . . 15 LYS CA . 51843 1 119 . 1 . 1 15 15 LYS CB C 13 30.317 0.3 . 1 . . . . . 15 LYS CB . 51843 1 120 . 1 . 1 16 16 GLY H H 1 8.450 0.020 . 1 . . . . . 16 GLY H . 51843 1 121 . 1 . 1 16 16 GLY HA2 H 1 3.922 0.020 . 1 . . . . . 16 GLY HA2 . 51843 1 122 . 1 . 1 16 16 GLY HA3 H 1 3.922 0.020 . 1 . . . . . 16 GLY HA3 . 51843 1 123 . 1 . 1 16 16 GLY CA C 13 42.841 0.3 . 1 . . . . . 16 GLY CA . 51843 1 124 . 1 . 1 17 17 LEU H H 1 8.038 0.020 . 1 . . . . . 17 LEU H . 51843 1 125 . 1 . 1 17 17 LEU HA H 1 4.035 0.020 . 1 . . . . . 17 LEU HA . 51843 1 126 . 1 . 1 17 17 LEU HB2 H 1 1.529 0.020 . 1 . . . . . 17 LEU HB2 . 51843 1 127 . 1 . 1 17 17 LEU HB3 H 1 1.529 0.020 . 1 . . . . . 17 LEU HB3 . 51843 1 128 . 1 . 1 17 17 LEU HG H 1 1.573 0.020 . 1 . . . . . 17 LEU HG . 51843 1 129 . 1 . 1 17 17 LEU HD11 H 1 0.880 0.020 . 2 . . . . . 17 LEU HD1 . 51843 1 130 . 1 . 1 17 17 LEU HD12 H 1 0.880 0.020 . 2 . . . . . 17 LEU HD1 . 51843 1 131 . 1 . 1 17 17 LEU HD13 H 1 0.880 0.020 . 2 . . . . . 17 LEU HD1 . 51843 1 132 . 1 . 1 17 17 LEU HD21 H 1 0.826 0.020 . 2 . . . . . 17 LEU HD2 . 51843 1 133 . 1 . 1 17 17 LEU HD22 H 1 0.826 0.020 . 2 . . . . . 17 LEU HD2 . 51843 1 134 . 1 . 1 17 17 LEU HD23 H 1 0.826 0.020 . 2 . . . . . 17 LEU HD2 . 51843 1 135 . 1 . 1 17 17 LEU CA C 13 52.686 0.3 . 1 . . . . . 17 LEU CA . 51843 1 136 . 1 . 1 17 17 LEU CB C 13 39.781 0.3 . 1 . . . . . 17 LEU CB . 51843 1 137 . 1 . 1 17 17 LEU N N 15 121.380 0.3 . 1 . . . . . 17 LEU N . 51843 1 138 . 1 . 1 18 18 MET H H 1 8.284 0.020 . 1 . . . . . 18 MET H . 51843 1 139 . 1 . 1 18 18 MET HA H 1 4.368 0.020 . 1 . . . . . 18 MET HA . 51843 1 140 . 1 . 1 18 18 MET HB2 H 1 1.938 0.020 . 1 . . . . . 18 MET HB2 . 51843 1 141 . 1 . 1 18 18 MET HB3 H 1 1.938 0.020 . 1 . . . . . 18 MET HB3 . 51843 1 142 . 1 . 1 18 18 MET HG2 H 1 2.513 0.020 . 2 . . . . . 18 MET HG2 . 51843 1 143 . 1 . 1 18 18 MET HG3 H 1 2.426 0.020 . 2 . . . . . 18 MET HG3 . 51843 1 144 . 1 . 1 18 18 MET CA C 13 52.858 0.3 . 1 . . . . . 18 MET CA . 51843 1 145 . 1 . 1 18 18 MET CB C 13 30.025 0.3 . 1 . . . . . 18 MET CB . 51843 1 146 . 1 . 1 19 19 HIS H H 1 8.427 0.020 . 1 . . . . . 19 HIS H . 51843 1 147 . 1 . 1 19 19 HIS HA H 1 4.618 0.020 . 1 . . . . . 19 HIS HA . 51843 1 148 . 1 . 1 19 19 HIS HB2 H 1 3.200 0.020 . 2 . . . . . 19 HIS HB2 . 51843 1 149 . 1 . 1 19 19 HIS HB3 H 1 3.099 0.020 . 2 . . . . . 19 HIS HB3 . 51843 1 150 . 1 . 1 19 19 HIS CA C 13 52.594 0.3 . 1 . . . . . 19 HIS CA . 51843 1 151 . 1 . 1 19 19 HIS CB C 13 26.431 0.3 . 1 . . . . . 19 HIS CB . 51843 1 152 . 1 . 1 20 20 HIS H H 1 8.595 0.020 . 1 . . . . . 20 HIS H . 51843 1 153 . 1 . 1 20 20 HIS HA H 1 4.680 0.020 . 1 . . . . . 20 HIS HA . 51843 1 154 . 1 . 1 20 20 HIS HB2 H 1 3.249 0.020 . 2 . . . . . 20 HIS HB2 . 51843 1 155 . 1 . 1 20 20 HIS HB3 H 1 3.125 0.020 . 2 . . . . . 20 HIS HB3 . 51843 1 156 . 1 . 1 20 20 HIS CA C 13 53.874 0.3 . 1 . . . . . 20 HIS CA . 51843 1 157 . 1 . 1 20 20 HIS CB C 13 26.517 0.3 . 1 . . . . . 20 HIS CB . 51843 1 158 . 1 . 1 21 21 LEU H H 1 8.482 0.020 . 1 . . . . . 21 LEU H . 51843 1 159 . 1 . 1 21 21 LEU HA H 1 4.385 0.020 . 1 . . . . . 21 LEU HA . 51843 1 160 . 1 . 1 21 21 LEU HB2 H 1 1.576 0.020 . 2 . . . . . 21 LEU HB2 . 51843 1 161 . 1 . 1 21 21 LEU HB3 H 1 1.640 0.020 . 2 . . . . . 21 LEU HB3 . 51843 1 162 . 1 . 1 21 21 LEU HD11 H 1 0.893 0.020 . 2 . . . . . 21 LEU HD1 . 51843 1 163 . 1 . 1 21 21 LEU HD12 H 1 0.893 0.020 . 2 . . . . . 21 LEU HD1 . 51843 1 164 . 1 . 1 21 21 LEU HD13 H 1 0.893 0.020 . 2 . . . . . 21 LEU HD1 . 51843 1 165 . 1 . 1 21 21 LEU HD21 H 1 0.840 0.020 . 2 . . . . . 21 LEU HD2 . 51843 1 166 . 1 . 1 21 21 LEU HD22 H 1 0.840 0.020 . 2 . . . . . 21 LEU HD2 . 51843 1 167 . 1 . 1 21 21 LEU HD23 H 1 0.840 0.020 . 2 . . . . . 21 LEU HD2 . 51843 1 168 . 1 . 1 21 21 LEU CA C 13 52.939 0.3 . 1 . . . . . 21 LEU CA . 51843 1 169 . 1 . 1 21 21 LEU CB C 13 39.824 0.3 . 1 . . . . . 21 LEU CB . 51843 1 170 . 1 . 1 21 21 LEU N N 15 124.057 0.3 . 1 . . . . . 21 LEU N . 51843 1 171 . 1 . 1 22 22 THR H H 1 8.157 0.020 . 1 . . . . . 22 THR H . 51843 1 172 . 1 . 1 22 22 THR HA H 1 4.307 0.020 . 1 . . . . . 22 THR HA . 51843 1 173 . 1 . 1 22 22 THR HB H 1 4.225 0.020 . 1 . . . . . 22 THR HB . 51843 1 174 . 1 . 1 22 22 THR HG21 H 1 1.180 0.020 . 1 . . . . . 22 THR HG2 . 51843 1 175 . 1 . 1 22 22 THR HG22 H 1 1.180 0.020 . 1 . . . . . 22 THR HG2 . 51843 1 176 . 1 . 1 22 22 THR HG23 H 1 1.180 0.020 . 1 . . . . . 22 THR HG2 . 51843 1 177 . 1 . 1 22 22 THR CA C 13 59.300 0.3 . 1 . . . . . 22 THR CA . 51843 1 178 . 1 . 1 22 22 THR CB C 13 67.197 0.3 . 1 . . . . . 22 THR CB . 51843 1 179 . 1 . 1 23 23 GLU H H 1 8.421 0.020 . 1 . . . . . 23 GLU H . 51843 1 180 . 1 . 1 23 23 GLU HA H 1 4.280 0.020 . 1 . . . . . 23 GLU HA . 51843 1 181 . 1 . 1 23 23 GLU HB2 H 1 2.031 0.020 . 2 . . . . . 23 GLU HB2 . 51843 1 182 . 1 . 1 23 23 GLU HB3 H 1 1.902 0.020 . 2 . . . . . 23 GLU HB3 . 51843 1 183 . 1 . 1 23 23 GLU HG2 H 1 2.281 0.020 . 1 . . . . . 23 GLU HG2 . 51843 1 184 . 1 . 1 23 23 GLU HG3 H 1 2.281 0.020 . 1 . . . . . 23 GLU HG3 . 51843 1 185 . 1 . 1 23 23 GLU CA C 13 53.791 0.3 . 1 . . . . . 23 GLU CA . 51843 1 186 . 1 . 1 23 23 GLU CB C 13 27.141 0.3 . 1 . . . . . 23 GLU CB . 51843 1 187 . 1 . 1 24 24 ASP H H 1 8.292 0.020 . 1 . . . . . 24 ASP H . 51843 1 188 . 1 . 1 24 24 ASP HA H 1 4.532 0.020 . 1 . . . . . 24 ASP HA . 51843 1 189 . 1 . 1 24 24 ASP HB2 H 1 2.627 0.020 . 1 . . . . . 24 ASP HB2 . 51843 1 190 . 1 . 1 24 24 ASP HB3 H 1 2.627 0.020 . 1 . . . . . 24 ASP HB3 . 51843 1 191 . 1 . 1 24 24 ASP CA C 13 51.482 0.3 . 1 . . . . . 24 ASP CA . 51843 1 192 . 1 . 1 24 24 ASP CB C 13 38.031 0.3 . 1 . . . . . 24 ASP CB . 51843 1 193 . 1 . 1 25 25 HIS H H 1 8.406 0.020 . 1 . . . . . 25 HIS H . 51843 1 194 . 1 . 1 25 25 HIS HA H 1 4.593 0.020 . 1 . . . . . 25 HIS HA . 51843 1 195 . 1 . 1 25 25 HIS HB2 H 1 3.248 0.020 . 2 . . . . . 25 HIS HB2 . 51843 1 196 . 1 . 1 25 25 HIS HB3 H 1 3.148 0.020 . 2 . . . . . 25 HIS HB3 . 51843 1 197 . 1 . 1 25 25 HIS CA C 13 52.888 0.3 . 1 . . . . . 25 HIS CA . 51843 1 198 . 1 . 1 25 25 HIS CB C 13 25.949 0.3 . 1 . . . . . 25 HIS CB . 51843 1 199 . 1 . 1 26 26 LEU H H 1 8.151 0.020 . 1 . . . . . 26 LEU H . 51843 1 200 . 1 . 1 26 26 LEU HA H 1 4.315 0.020 . 1 . . . . . 26 LEU HA . 51843 1 201 . 1 . 1 26 26 LEU HB2 H 1 1.618 0.020 . 2 . . . . . 26 LEU HB2 . 51843 1 202 . 1 . 1 26 26 LEU HB3 H 1 1.573 0.020 . 2 . . . . . 26 LEU HB3 . 51843 1 203 . 1 . 1 26 26 LEU HD11 H 1 0.868 0.020 . 2 . . . . . 26 LEU HD1 . 51843 1 204 . 1 . 1 26 26 LEU HD12 H 1 0.868 0.020 . 2 . . . . . 26 LEU HD1 . 51843 1 205 . 1 . 1 26 26 LEU HD13 H 1 0.868 0.020 . 2 . . . . . 26 LEU HD1 . 51843 1 206 . 1 . 1 26 26 LEU HD21 H 1 0.804 0.020 . 2 . . . . . 26 LEU HD2 . 51843 1 207 . 1 . 1 26 26 LEU HD22 H 1 0.804 0.020 . 2 . . . . . 26 LEU HD2 . 51843 1 208 . 1 . 1 26 26 LEU HD23 H 1 0.804 0.020 . 2 . . . . . 26 LEU HD2 . 51843 1 209 . 1 . 1 26 26 LEU CA C 13 53.133 0.3 . 1 . . . . . 26 LEU CA . 51843 1 210 . 1 . 1 26 26 LEU CB C 13 39.694 0.3 . 1 . . . . . 26 LEU CB . 51843 1 211 . 1 . 1 26 26 LEU N N 15 122.375 0.3 . 1 . . . . . 26 LEU N . 51843 1 212 . 1 . 1 27 27 ASP H H 1 8.430 0.020 . 1 . . . . . 27 ASP H . 51843 1 213 . 1 . 1 27 27 ASP HA H 1 4.610 0.020 . 1 . . . . . 27 ASP HA . 51843 1 214 . 1 . 1 27 27 ASP HB2 H 1 2.783 0.020 . 2 . . . . . 27 ASP HB2 . 51843 1 215 . 1 . 1 27 27 ASP HB3 H 1 2.624 0.020 . 2 . . . . . 27 ASP HB3 . 51843 1 216 . 1 . 1 27 27 ASP CA C 13 51.315 0.3 . 1 . . . . . 27 ASP CA . 51843 1 217 . 1 . 1 27 27 ASP CB C 13 37.545 0.3 . 1 . . . . . 27 ASP CB . 51843 1 218 . 1 . 1 28 28 LEU H H 1 8.263 0.020 . 1 . . . . . 28 LEU H . 51843 1 219 . 1 . 1 28 28 LEU HA H 1 4.293 0.020 . 1 . . . . . 28 LEU HA . 51843 1 220 . 1 . 1 28 28 LEU HB2 H 1 1.501 0.020 . 1 . . . . . 28 LEU HB2 . 51843 1 221 . 1 . 1 28 28 LEU HB3 H 1 1.501 0.020 . 1 . . . . . 28 LEU HB3 . 51843 1 222 . 1 . 1 28 28 LEU HD11 H 1 0.865 0.020 . 2 . . . . . 28 LEU HD1 . 51843 1 223 . 1 . 1 28 28 LEU HD12 H 1 0.865 0.020 . 2 . . . . . 28 LEU HD1 . 51843 1 224 . 1 . 1 28 28 LEU HD13 H 1 0.865 0.020 . 2 . . . . . 28 LEU HD1 . 51843 1 225 . 1 . 1 28 28 LEU HD21 H 1 0.809 0.020 . 2 . . . . . 28 LEU HD2 . 51843 1 226 . 1 . 1 28 28 LEU HD22 H 1 0.809 0.020 . 2 . . . . . 28 LEU HD2 . 51843 1 227 . 1 . 1 28 28 LEU HD23 H 1 0.809 0.020 . 2 . . . . . 28 LEU HD2 . 51843 1 228 . 1 . 1 28 28 LEU CA C 13 52.806 0.3 . 1 . . . . . 28 LEU CA . 51843 1 229 . 1 . 1 28 28 LEU CB C 13 39.677 0.3 . 1 . . . . . 28 LEU CB . 51843 1 230 . 1 . 1 28 28 LEU N N 15 122.698 0.3 . 1 . . . . . 28 LEU N . 51843 1 231 . 1 . 1 29 29 ASP H H 1 8.319 0.020 . 1 . . . . . 29 ASP H . 51843 1 232 . 1 . 1 29 29 ASP HA H 1 4.542 0.020 . 1 . . . . . 29 ASP HA . 51843 1 233 . 1 . 1 29 29 ASP HB2 H 1 2.646 0.020 . 1 . . . . . 29 ASP HB2 . 51843 1 234 . 1 . 1 29 29 ASP HB3 H 1 2.646 0.020 . 1 . . . . . 29 ASP HB3 . 51843 1 235 . 1 . 1 29 29 ASP CA C 13 51.928 0.3 . 1 . . . . . 29 ASP CA . 51843 1 236 . 1 . 1 29 29 ASP CB C 13 37.630 0.3 . 1 . . . . . 29 ASP CB . 51843 1 237 . 1 . 1 30 30 ASN H H 1 8.187 0.020 . 1 . . . . . 30 ASN H . 51843 1 238 . 1 . 1 30 30 ASN HA H 1 4.596 0.020 . 1 . . . . . 30 ASN HA . 51843 1 239 . 1 . 1 30 30 ASN HB2 H 1 2.734 0.020 . 2 . . . . . 30 ASN HB2 . 51843 1 240 . 1 . 1 30 30 ASN HB3 H 1 2.694 0.020 . 2 . . . . . 30 ASN HB3 . 51843 1 241 . 1 . 1 30 30 ASN CA C 13 51.172 0.3 . 1 . . . . . 30 ASN CA . 51843 1 242 . 1 . 1 30 30 ASN CB C 13 35.918 0.3 . 1 . . . . . 30 ASN CB . 51843 1 243 . 1 . 1 31 31 TRP H H 1 7.978 0.020 . 1 . . . . . 31 TRP H . 51843 1 244 . 1 . 1 31 31 TRP HA H 1 4.518 0.020 . 1 . . . . . 31 TRP HA . 51843 1 245 . 1 . 1 31 31 TRP HB2 H 1 3.298 0.020 . 1 . . . . . 31 TRP HB2 . 51843 1 246 . 1 . 1 31 31 TRP HB3 H 1 3.298 0.020 . 1 . . . . . 31 TRP HB3 . 51843 1 247 . 1 . 1 31 31 TRP HD1 H 1 7.284 0.020 . 1 . . . . . 31 TRP HD1 . 51843 1 248 . 1 . 1 31 31 TRP HE1 H 1 10.153 0.020 . 1 . . . . . 31 TRP HE1 . 51843 1 249 . 1 . 1 31 31 TRP HE3 H 1 7.546 0.020 . 1 . . . . . 31 TRP HE3 . 51843 1 250 . 1 . 1 31 31 TRP HZ2 H 1 7.470 0.020 . 1 . . . . . 31 TRP HZ2 . 51843 1 251 . 1 . 1 31 31 TRP HZ3 H 1 7.212 0.020 . 1 . . . . . 31 TRP HZ3 . 51843 1 252 . 1 . 1 31 31 TRP HH2 H 1 7.107 0.020 . 1 . . . . . 31 TRP HH2 . 51843 1 253 . 1 . 1 31 31 TRP CA C 13 55.557 0.3 . 1 . . . . . 31 TRP CA . 51843 1 254 . 1 . 1 31 31 TRP CB C 13 26.410 0.3 . 1 . . . . . 31 TRP CB . 51843 1 255 . 1 . 1 32 32 GLN H H 1 8.038 0.020 . 1 . . . . . 32 GLN H . 51843 1 256 . 1 . 1 32 32 GLN HA H 1 4.289 0.020 . 1 . . . . . 32 GLN HA . 51843 1 257 . 1 . 1 32 32 GLN HB2 H 1 1.987 0.020 . 2 . . . . . 32 GLN HB2 . 51843 1 258 . 1 . 1 32 32 GLN HB3 H 1 1.906 0.020 . 2 . . . . . 32 GLN HB3 . 51843 1 259 . 1 . 1 32 32 GLN HG2 H 1 1.760 0.020 . 1 . . . . . 32 GLN HG2 . 51843 1 260 . 1 . 1 32 32 GLN HG3 H 1 1.760 0.020 . 1 . . . . . 32 GLN HG3 . 51843 1 261 . 1 . 1 32 32 GLN CA C 13 54.000 0.3 . 1 . . . . . 32 GLN CA . 51843 1 262 . 1 . 1 33 33 ARG H H 1 7.984 0.020 . 1 . . . . . 33 ARG H . 51843 1 263 . 1 . 1 33 33 ARG HA H 1 4.188 0.020 . 1 . . . . . 33 ARG HA . 51843 1 264 . 1 . 1 33 33 ARG HB2 H 1 1.812 0.020 . 2 . . . . . 33 ARG HB2 . 51843 1 265 . 1 . 1 33 33 ARG HB3 H 1 1.723 0.020 . 2 . . . . . 33 ARG HB3 . 51843 1 266 . 1 . 1 33 33 ARG HG2 H 1 1.558 0.020 . 1 . . . . . 33 ARG HG2 . 51843 1 267 . 1 . 1 33 33 ARG HG3 H 1 1.558 0.020 . 1 . . . . . 33 ARG HG3 . 51843 1 268 . 1 . 1 33 33 ARG CA C 13 53.800 0.3 . 1 . . . . . 33 ARG CA . 51843 1 269 . 1 . 1 33 33 ARG CB C 13 27.893 0.3 . 1 . . . . . 33 ARG CB . 51843 1 270 . 1 . 1 34 34 LEU H H 1 8.103 0.020 . 1 . . . . . 34 LEU H . 51843 1 271 . 1 . 1 34 34 LEU HA H 1 4.318 0.020 . 1 . . . . . 34 LEU HA . 51843 1 272 . 1 . 1 34 34 LEU HB2 H 1 1.578 0.020 . 1 . . . . . 34 LEU HB2 . 51843 1 273 . 1 . 1 34 34 LEU HB3 H 1 1.578 0.020 . 1 . . . . . 34 LEU HB3 . 51843 1 274 . 1 . 1 34 34 LEU HG H 1 1.673 0.020 . 1 . . . . . 34 LEU HG . 51843 1 275 . 1 . 1 34 34 LEU HD11 H 1 0.888 0.020 . 2 . . . . . 34 LEU HD1 . 51843 1 276 . 1 . 1 34 34 LEU HD12 H 1 0.888 0.020 . 2 . . . . . 34 LEU HD1 . 51843 1 277 . 1 . 1 34 34 LEU HD13 H 1 0.888 0.020 . 2 . . . . . 34 LEU HD1 . 51843 1 278 . 1 . 1 34 34 LEU HD21 H 1 0.839 0.020 . 2 . . . . . 34 LEU HD2 . 51843 1 279 . 1 . 1 34 34 LEU HD22 H 1 0.839 0.020 . 2 . . . . . 34 LEU HD2 . 51843 1 280 . 1 . 1 34 34 LEU HD23 H 1 0.839 0.020 . 2 . . . . . 34 LEU HD2 . 51843 1 281 . 1 . 1 34 34 LEU CA C 13 52.754 0.3 . 1 . . . . . 34 LEU CA . 51843 1 282 . 1 . 1 34 34 LEU CB C 13 39.880 0.3 . 1 . . . . . 34 LEU CB . 51843 1 283 . 1 . 1 34 34 LEU N N 15 122.250 0.3 . 1 . . . . . 34 LEU N . 51843 1 284 . 1 . 1 35 35 GLY H H 1 8.335 0.020 . 1 . . . . . 35 GLY H . 51843 1 285 . 1 . 1 35 35 GLY HA2 H 1 3.933 0.020 . 1 . . . . . 35 GLY HA2 . 51843 1 286 . 1 . 1 35 35 GLY HA3 H 1 3.933 0.020 . 1 . . . . . 35 GLY HA3 . 51843 1 287 . 1 . 1 35 35 GLY CA C 13 42.828 0.3 . 1 . . . . . 35 GLY CA . 51843 1 288 . 1 . 1 36 36 VAL H H 1 7.880 0.020 . 1 . . . . . 36 VAL H . 51843 1 289 . 1 . 1 36 36 VAL HA H 1 4.224 0.020 . 1 . . . . . 36 VAL HA . 51843 1 290 . 1 . 1 36 36 VAL HB H 1 2.104 0.020 . 1 . . . . . 36 VAL HB . 51843 1 291 . 1 . 1 36 36 VAL HG11 H 1 0.888 0.020 . 1 . . . . . 36 VAL HG1 . 51843 1 292 . 1 . 1 36 36 VAL HG12 H 1 0.888 0.020 . 1 . . . . . 36 VAL HG1 . 51843 1 293 . 1 . 1 36 36 VAL HG13 H 1 0.888 0.020 . 1 . . . . . 36 VAL HG1 . 51843 1 294 . 1 . 1 36 36 VAL HG21 H 1 0.888 0.020 . 1 . . . . . 36 VAL HG2 . 51843 1 295 . 1 . 1 36 36 VAL HG22 H 1 0.888 0.020 . 1 . . . . . 36 VAL HG2 . 51843 1 296 . 1 . 1 36 36 VAL HG23 H 1 0.888 0.020 . 1 . . . . . 36 VAL HG2 . 51843 1 297 . 1 . 1 36 36 VAL CA C 13 59.445 0.3 . 1 . . . . . 36 VAL CA . 51843 1 298 . 1 . 1 36 36 VAL CB C 13 30.342 0.3 . 1 . . . . . 36 VAL CB . 51843 1 299 . 1 . 1 37 37 SER H H 1 8.022 0.020 . 1 . . . . . 37 SER H . 51843 1 300 . 1 . 1 37 37 SER HA H 1 4.291 0.020 . 1 . . . . . 37 SER HA . 51843 1 301 . 1 . 1 37 37 SER HB2 H 1 3.829 0.020 . 1 . . . . . 37 SER HB2 . 51843 1 302 . 1 . 1 37 37 SER HB3 H 1 3.829 0.020 . 1 . . . . . 37 SER HB3 . 51843 1 303 . 1 . 1 37 37 SER CA C 13 57.159 0.3 . 1 . . . . . 37 SER CA . 51843 1 304 . 1 . 1 37 37 SER CB C 13 62.275 0.3 . 1 . . . . . 37 SER CB . 51843 1 stop_ save_