data_26334 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 26334 _Entry.Title ; NMR chemical shift assignments for melittin in methanol ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2022-08-30 _Entry.Accession_date 2022-09-20 _Entry.Last_release_date 2022-09-20 _Entry.Original_release_date 2022-09-20 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.2.0.16 _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 Yoshinori Miura . . . . 26334 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 26334 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '1H chemical shifts' 196 26334 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 . . 2022-12-06 . original BMRB . 26334 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 26334 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 36266498 _Citation.DOI 10.1007/s10930-022-10075-4 _Citation.Full_citation . _Citation.Title ; alpha-proton Chemical Shift Index and Amide Proton Chemical Shift Temperature Coefficient of Melittin in Methanol: Indicators for a Helix Structure and an Intra-Molecular Hydrogen Bond? ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Protein J.' _Citation.Journal_name_full 'The protein journal' _Citation.Journal_volume 41 _Citation.Journal_issue 6 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1572-3887 _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 625 _Citation.Page_last 635 _Citation.Year 2022 _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 Yoshinori Miura . . . . 26334 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 26334 _Assembly.ID 1 _Assembly.Name melittin _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 melittin 1 $entity_1 . . yes native no no . . . 26334 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 26334 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name melittin _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 ; GIGAVLKVLTTGLPALISWI KRKRQQ ; _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 26 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 1 GLY . 26334 1 2 2 ILE . 26334 1 3 3 GLY . 26334 1 4 4 ALA . 26334 1 5 5 VAL . 26334 1 6 6 LEU . 26334 1 7 7 LYS . 26334 1 8 8 VAL . 26334 1 9 9 LEU . 26334 1 10 10 THR . 26334 1 11 11 THR . 26334 1 12 12 GLY . 26334 1 13 13 LEU . 26334 1 14 14 PRO . 26334 1 15 15 ALA . 26334 1 16 16 LEU . 26334 1 17 17 ILE . 26334 1 18 18 SER . 26334 1 19 19 TRP . 26334 1 20 20 ILE . 26334 1 21 21 LYS . 26334 1 22 22 ARG . 26334 1 23 23 LYS . 26334 1 24 24 ARG . 26334 1 25 25 GLN . 26334 1 26 26 GLN . 26334 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 . GLY 1 1 26334 1 . ILE 2 2 26334 1 . GLY 3 3 26334 1 . ALA 4 4 26334 1 . VAL 5 5 26334 1 . LEU 6 6 26334 1 . LYS 7 7 26334 1 . VAL 8 8 26334 1 . LEU 9 9 26334 1 . THR 10 10 26334 1 . THR 11 11 26334 1 . GLY 12 12 26334 1 . LEU 13 13 26334 1 . PRO 14 14 26334 1 . ALA 15 15 26334 1 . LEU 16 16 26334 1 . ILE 17 17 26334 1 . SER 18 18 26334 1 . TRP 19 19 26334 1 . ILE 20 20 26334 1 . LYS 21 21 26334 1 . ARG 22 22 26334 1 . LYS 23 23 26334 1 . ARG 24 24 26334 1 . GLN 25 25 26334 1 . GLN 26 26 26334 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 26334 _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 . 7460 organism . 'Apis mellifera' 'honey bee' . . Eukaryota Metazoa Apis mellifera . . . . . . . . . . . . . 26334 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 26334 _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 . 'obtained from a vendor' . . . . . . . . . . . . . . . . 26334 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 26334 _Sample.ID 1 _Sample.Name melittin _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system methanol _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 melittin 'natural abundance' 1 $assembly_1 1 $entity_1 . protein 2.6 . . mM . . . . 26334 1 2 methanol 'natural abundance' . . . . . solvent 100 . . % . . . . 26334 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 26334 _Sample_condition_list.ID 1 _Sample_condition_list.Name sample_conditions_1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0 . M 26334 1 pH 6.5 . pH 26334 1 pressure 1 . atm 26334 1 temperature 303 . K 26334 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 26334 _Software.ID 1 _Software.Type . _Software.Name NUTS _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'data analysis' . 26334 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 26334 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name spectrometer_1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 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 26334 _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 '1D 1H' yes . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 26334 1 2 '2D 1H-1H TOCSY' yes . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 26334 1 3 '2D 1H-1H NOESY' yes . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 26334 1 stop_ loop_ _Experiment_file.Experiment_ID _Experiment_file.Experiment_name _Experiment_file.Name _Experiment_file.Type _Experiment_file.Content _Experiment_file.Directory_path _Experiment_file.Details _Experiment_file.Entry_ID _Experiment_file.Experiment_list_ID 1 '1D 1H' wet1D_30C_100 . 'Time-domain (raw spectral data)' . . 26334 1 2 '2D 1H-1H TOCSY' tocsy30C_100.2d . 'Time-domain (raw spectral data)' . . 26334 1 3 '2D 1H-1H NOESY' noe30C_100 . 'Time-domain (raw spectral data)' . . 26334 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 26334 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name TSP _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID H 1 TSP 'methyl protons' . . . . ppm 0 internal direct 1 . . . . . 26334 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 26334 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name assigned_chem_shift_list_1 _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 0.01 _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 '1D 1H' 1 $sample_1 isotropic 26334 1 2 '2D 1H-1H TOCSY' 1 $sample_1 isotropic 26334 1 3 '2D 1H-1H NOESY' 1 $sample_1 isotropic 26334 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 . . 26334 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 GLY HA2 H 1 4.00 0.01 . 2 . . . . . 1 GLY HA2 . 26334 1 2 . 1 . 1 1 1 GLY HA3 H 1 4.11 0.01 . 2 . . . . . 1 GLY HA3 . 26334 1 3 . 1 . 1 2 2 ILE HA H 1 3.98 0.01 . 1 . . . . . 2 ILE HA . 26334 1 4 . 1 . 1 2 2 ILE HB H 1 1.89 0.01 . 1 . . . . . 2 ILE HB . 26334 1 5 . 1 . 1 2 2 ILE HD11 H 1 1.01 0.01 . 1 . . . . . 2 ILE MD . 26334 1 6 . 1 . 1 2 2 ILE HD12 H 1 1.01 0.01 . 1 . . . . . 2 ILE MD . 26334 1 7 . 1 . 1 2 2 ILE HD13 H 1 1.01 0.01 . 1 . . . . . 2 ILE MD . 26334 1 8 . 1 . 1 2 2 ILE HG12 H 1 1.36 0.01 . 2 . . . . . 2 ILE HG12 . 26334 1 9 . 1 . 1 2 2 ILE HG13 H 1 1.61 0.01 . 2 . . . . . 2 ILE HG13 . 26334 1 10 . 1 . 1 2 2 ILE HG21 H 1 0.98 0.01 . 1 . . . . . 2 ILE MG . 26334 1 11 . 1 . 1 2 2 ILE HG22 H 1 0.98 0.01 . 1 . . . . . 2 ILE MG . 26334 1 12 . 1 . 1 2 2 ILE HG23 H 1 0.98 0.01 . 1 . . . . . 2 ILE MG . 26334 1 13 . 1 . 1 3 3 GLY H H 1 8.92 0.01 . 1 . . . . . 3 GLY H . 26334 1 14 . 1 . 1 3 3 GLY HA2 H 1 3.76 0.01 . 2 . . . . . 3 GLY HA2 . 26334 1 15 . 1 . 1 3 3 GLY HA3 H 1 3.82 0.01 . 2 . . . . . 3 GLY HA3 . 26334 1 16 . 1 . 1 4 4 ALA H H 1 7.88 0.01 . 1 . . . . . 4 ALA H . 26334 1 17 . 1 . 1 4 4 ALA HA H 1 4.12 0.01 . 1 . . . . . 4 ALA HA . 26334 1 18 . 1 . 1 4 4 ALA HB1 H 1 1.54 0.01 . 1 . . . . . 4 ALA MB . 26334 1 19 . 1 . 1 4 4 ALA HB2 H 1 1.54 0.01 . 1 . . . . . 4 ALA MB . 26334 1 20 . 1 . 1 4 4 ALA HB3 H 1 1.54 0.01 . 1 . . . . . 4 ALA MB . 26334 1 21 . 1 . 1 5 5 VAL H H 1 7.68 0.01 . 1 . . . . . 5 VAL H . 26334 1 22 . 1 . 1 5 5 VAL HA H 1 3.58 0.01 . 1 . . . . . 5 VAL HA . 26334 1 23 . 1 . 1 5 5 VAL HB H 1 2.31 0.01 . 1 . . . . . 5 VAL HB . 26334 1 24 . 1 . 1 5 5 VAL HG11 H 1 0.98 0.01 . 2 . . . . . 5 VAL MG1 . 26334 1 25 . 1 . 1 5 5 VAL HG12 H 1 0.98 0.01 . 2 . . . . . 5 VAL MG1 . 26334 1 26 . 1 . 1 5 5 VAL HG13 H 1 0.98 0.01 . 2 . . . . . 5 VAL MG1 . 26334 1 27 . 1 . 1 5 5 VAL HG21 H 1 1.09 0.01 . 2 . . . . . 5 VAL MG2 . 26334 1 28 . 1 . 1 5 5 VAL HG22 H 1 1.09 0.01 . 2 . . . . . 5 VAL MG2 . 26334 1 29 . 1 . 1 5 5 VAL HG23 H 1 1.09 0.01 . 2 . . . . . 5 VAL MG2 . 26334 1 30 . 1 . 1 6 6 LEU H H 1 8.27 0.01 . 1 . . . . . 6 LEU H . 26334 1 31 . 1 . 1 6 6 LEU HA H 1 4.09 0.01 . 1 . . . . . 6 LEU HA . 26334 1 32 . 1 . 1 6 6 LEU HB2 H 1 1.91 0.01 . 1 . . . . . 6 LEU HB2 . 26334 1 33 . 1 . 1 6 6 LEU HB3 H 1 1.91 0.01 . 1 . . . . . 6 LEU HB3 . 26334 1 34 . 1 . 1 6 6 LEU HD11 H 1 0.91 0.01 . 2 . . . . . 6 LEU MD1 . 26334 1 35 . 1 . 1 6 6 LEU HD12 H 1 0.91 0.01 . 2 . . . . . 6 LEU MD1 . 26334 1 36 . 1 . 1 6 6 LEU HD13 H 1 0.91 0.01 . 2 . . . . . 6 LEU MD1 . 26334 1 37 . 1 . 1 6 6 LEU HG H 1 1.59 0.01 . 1 . . . . . 6 LEU HG . 26334 1 38 . 1 . 1 7 7 LYS H H 1 8.13 0.01 . 1 . . . . . 7 LYS H . 26334 1 39 . 1 . 1 7 7 LYS HA H 1 4.08 0.01 . 1 . . . . . 7 LYS HA . 26334 1 40 . 1 . 1 7 7 LYS HB2 H 1 2.02 0.01 . 1 . . . . . 7 LYS HB2 . 26334 1 41 . 1 . 1 7 7 LYS HB3 H 1 2.02 0.01 . 1 . . . . . 7 LYS HB3 . 26334 1 42 . 1 . 1 7 7 LYS HD2 H 1 1.64 0.01 . 1 . . . . . 7 LYS HD2 . 26334 1 43 . 1 . 1 7 7 LYS HD3 H 1 1.64 0.01 . 1 . . . . . 7 LYS HD3 . 26334 1 44 . 1 . 1 7 7 LYS HE2 H 1 2.86 0.01 . 1 . . . . . 7 LYS HE2 . 26334 1 45 . 1 . 1 7 7 LYS HE3 H 1 2.86 0.01 . 1 . . . . . 7 LYS HE3 . 26334 1 46 . 1 . 1 7 7 LYS HG2 H 1 1.47 0.01 . 1 . . . . . 7 LYS HG2 . 26334 1 47 . 1 . 1 7 7 LYS HG3 H 1 1.47 0.01 . 1 . . . . . 7 LYS HG3 . 26334 1 48 . 1 . 1 8 8 VAL H H 1 8.14 0.01 . 1 . . . . . 8 VAL H . 26334 1 49 . 1 . 1 8 8 VAL HA H 1 3.69 0.01 . 1 . . . . . 8 VAL HA . 26334 1 50 . 1 . 1 8 8 VAL HB H 1 2.34 0.01 . 1 . . . . . 8 VAL HB . 26334 1 51 . 1 . 1 8 8 VAL HG11 H 1 1.01 0.01 . 2 . . . . . 8 VAL MG1 . 26334 1 52 . 1 . 1 8 8 VAL HG12 H 1 1.01 0.01 . 2 . . . . . 8 VAL MG1 . 26334 1 53 . 1 . 1 8 8 VAL HG13 H 1 1.01 0.01 . 2 . . . . . 8 VAL MG1 . 26334 1 54 . 1 . 1 8 8 VAL HG21 H 1 1.15 0.01 . 2 . . . . . 8 VAL MG2 . 26334 1 55 . 1 . 1 8 8 VAL HG22 H 1 1.15 0.01 . 2 . . . . . 8 VAL MG2 . 26334 1 56 . 1 . 1 8 8 VAL HG23 H 1 1.15 0.01 . 2 . . . . . 8 VAL MG2 . 26334 1 57 . 1 . 1 9 9 LEU H H 1 8.30 0.01 . 1 . . . . . 9 LEU H . 26334 1 58 . 1 . 1 9 9 LEU HA H 1 4.16 0.01 . 1 . . . . . 9 LEU HA . 26334 1 59 . 1 . 1 9 9 LEU HB2 H 1 1.97 0.01 . 1 . . . . . 9 LEU HB2 . 26334 1 60 . 1 . 1 9 9 LEU HB3 H 1 1.97 0.01 . 1 . . . . . 9 LEU HB3 . 26334 1 61 . 1 . 1 9 9 LEU HD11 H 1 0.91 0.01 . 2 . . . . . 9 LEU MD1 . 26334 1 62 . 1 . 1 9 9 LEU HD12 H 1 0.91 0.01 . 2 . . . . . 9 LEU MD1 . 26334 1 63 . 1 . 1 9 9 LEU HD13 H 1 0.91 0.01 . 2 . . . . . 9 LEU MD1 . 26334 1 64 . 1 . 1 9 9 LEU HD21 H 1 0.91 0.01 . 2 . . . . . 9 LEU MD2 . 26334 1 65 . 1 . 1 9 9 LEU HD22 H 1 0.91 0.01 . 2 . . . . . 9 LEU MD2 . 26334 1 66 . 1 . 1 9 9 LEU HD23 H 1 0.91 0.01 . 2 . . . . . 9 LEU MD2 . 26334 1 67 . 1 . 1 9 9 LEU HG H 1 1.61 0.01 . 1 . . . . . 9 LEU HG . 26334 1 68 . 1 . 1 10 10 THR H H 1 8.10 0.01 . 1 . . . . . 10 THR H . 26334 1 69 . 1 . 1 10 10 THR HA H 1 4.15 0.01 . 1 . . . . . 10 THR HA . 26334 1 70 . 1 . 1 10 10 THR HB H 1 4.33 0.01 . 1 . . . . . 10 THR HB . 26334 1 71 . 1 . 1 10 10 THR HG21 H 1 1.32 0.01 . 1 . . . . . 10 THR MG . 26334 1 72 . 1 . 1 10 10 THR HG22 H 1 1.32 0.01 . 1 . . . . . 10 THR MG . 26334 1 73 . 1 . 1 10 10 THR HG23 H 1 1.32 0.01 . 1 . . . . . 10 THR MG . 26334 1 74 . 1 . 1 11 11 THR H H 1 7.85 0.01 . 1 . . . . . 11 THR H . 26334 1 75 . 1 . 1 11 11 THR HA H 1 4.30 0.01 . 1 . . . . . 11 THR HA . 26334 1 76 . 1 . 1 11 11 THR HB H 1 4.30 0.01 . 1 . . . . . 11 THR HB . 26334 1 77 . 1 . 1 11 11 THR HG21 H 1 1.31 0.01 . 1 . . . . . 11 THR MG . 26334 1 78 . 1 . 1 11 11 THR HG22 H 1 1.31 0.01 . 1 . . . . . 11 THR MG . 26334 1 79 . 1 . 1 11 11 THR HG23 H 1 1.31 0.01 . 1 . . . . . 11 THR MG . 26334 1 80 . 1 . 1 12 12 GLY H H 1 8.18 0.01 . 1 . . . . . 12 GLY H . 26334 1 81 . 1 . 1 12 12 GLY HA2 H 1 3.95 0.01 . 2 . . . . . 12 GLY HA2 . 26334 1 82 . 1 . 1 12 12 GLY HA3 H 1 4.10 0.01 . 2 . . . . . 12 GLY HA3 . 26334 1 83 . 1 . 1 13 13 LEU H H 1 8.26 0.01 . 1 . . . . . 13 LEU H . 26334 1 84 . 1 . 1 13 13 LEU HA H 1 4.41 0.01 . 1 . . . . . 13 LEU HA . 26334 1 85 . 1 . 1 13 13 LEU HB2 H 1 1.81 0.01 . 2 . . . . . 13 LEU HB2 . 26334 1 86 . 1 . 1 13 13 LEU HB3 H 1 1.92 0.01 . 2 . . . . . 13 LEU HB3 . 26334 1 87 . 1 . 1 13 13 LEU HD11 H 1 0.99 0.01 . 2 . . . . . 13 LEU MD1 . 26334 1 88 . 1 . 1 13 13 LEU HD12 H 1 0.99 0.01 . 2 . . . . . 13 LEU MD1 . 26334 1 89 . 1 . 1 13 13 LEU HD13 H 1 0.99 0.01 . 2 . . . . . 13 LEU MD1 . 26334 1 90 . 1 . 1 13 13 LEU HD21 H 1 1.05 0.01 . 2 . . . . . 13 LEU MD2 . 26334 1 91 . 1 . 1 13 13 LEU HD22 H 1 1.05 0.01 . 2 . . . . . 13 LEU MD2 . 26334 1 92 . 1 . 1 13 13 LEU HD23 H 1 1.05 0.01 . 2 . . . . . 13 LEU MD2 . 26334 1 93 . 1 . 1 13 13 LEU HG H 1 1.80 0.01 . 1 . . . . . 13 LEU HG . 26334 1 94 . 1 . 1 14 14 PRO HA H 1 4.24 0.01 . 1 . . . . . 14 PRO HA . 26334 1 95 . 1 . 1 14 14 PRO HB2 H 1 1.94 0.01 . 2 . . . . . 14 PRO HB2 . 26334 1 96 . 1 . 1 14 14 PRO HB3 H 1 2.34 0.01 . 2 . . . . . 14 PRO HB3 . 26334 1 97 . 1 . 1 14 14 PRO HD2 H 1 3.77 0.01 . 1 . . . . . 14 PRO HD2 . 26334 1 98 . 1 . 1 14 14 PRO HD3 H 1 3.77 0.01 . 1 . . . . . 14 PRO HD3 . 26334 1 99 . 1 . 1 14 14 PRO HG2 H 1 1.94 0.01 . 2 . . . . . 14 PRO HG2 . 26334 1 100 . 1 . 1 14 14 PRO HG3 H 1 2.25 0.01 . 2 . . . . . 14 PRO HG3 . 26334 1 101 . 1 . 1 15 15 ALA H H 1 7.49 0.01 . 1 . . . . . 15 ALA H . 26334 1 102 . 1 . 1 15 15 ALA HA H 1 4.15 0.01 . 1 . . . . . 15 ALA HA . 26334 1 103 . 1 . 1 15 15 ALA HB1 H 1 1.56 0.01 . 1 . . . . . 15 ALA MB . 26334 1 104 . 1 . 1 15 15 ALA HB2 H 1 1.56 0.01 . 1 . . . . . 15 ALA MB . 26334 1 105 . 1 . 1 15 15 ALA HB3 H 1 1.56 0.01 . 1 . . . . . 15 ALA MB . 26334 1 106 . 1 . 1 16 16 LEU H H 1 8.07 0.01 . 1 . . . . . 16 LEU H . 26334 1 107 . 1 . 1 16 16 LEU HA H 1 4.24 0.01 . 1 . . . . . 16 LEU HA . 26334 1 108 . 1 . 1 16 16 LEU HB2 H 1 1.78 0.01 . 2 . . . . . 16 LEU HB2 . 26334 1 109 . 1 . 1 16 16 LEU HB3 H 1 2.01 0.01 . 2 . . . . . 16 LEU HB3 . 26334 1 110 . 1 . 1 16 16 LEU HD11 H 1 0.94 0.01 . 2 . . . . . 16 LEU MD1 . 26334 1 111 . 1 . 1 16 16 LEU HD12 H 1 0.94 0.01 . 2 . . . . . 16 LEU MD1 . 26334 1 112 . 1 . 1 16 16 LEU HD13 H 1 0.94 0.01 . 2 . . . . . 16 LEU MD1 . 26334 1 113 . 1 . 1 16 16 LEU HD21 H 1 1.02 0.01 . 2 . . . . . 16 LEU MD2 . 26334 1 114 . 1 . 1 16 16 LEU HD22 H 1 1.02 0.01 . 2 . . . . . 16 LEU MD2 . 26334 1 115 . 1 . 1 16 16 LEU HD23 H 1 1.02 0.01 . 2 . . . . . 16 LEU MD2 . 26334 1 116 . 1 . 1 17 17 ILE H H 1 8.49 0.01 . 1 . . . . . 17 ILE H . 26334 1 117 . 1 . 1 17 17 ILE HA H 1 3.73 0.01 . 1 . . . . . 17 ILE HA . 26334 1 118 . 1 . 1 17 17 ILE HB H 1 2.05 0.01 . 1 . . . . . 17 ILE HB . 26334 1 119 . 1 . 1 17 17 ILE HD11 H 1 0.96 0.01 . 1 . . . . . 17 ILE MD . 26334 1 120 . 1 . 1 17 17 ILE HD12 H 1 0.96 0.01 . 1 . . . . . 17 ILE MD . 26334 1 121 . 1 . 1 17 17 ILE HD13 H 1 0.96 0.01 . 1 . . . . . 17 ILE MD . 26334 1 122 . 1 . 1 17 17 ILE HG12 H 1 1.30 0.01 . 2 . . . . . 17 ILE HG12 . 26334 1 123 . 1 . 1 17 17 ILE HG13 H 1 1.76 0.01 . 2 . . . . . 17 ILE HG13 . 26334 1 124 . 1 . 1 17 17 ILE HG21 H 1 0.87 0.01 . 1 . . . . . 17 ILE MG . 26334 1 125 . 1 . 1 17 17 ILE HG22 H 1 0.87 0.01 . 1 . . . . . 17 ILE MG . 26334 1 126 . 1 . 1 17 17 ILE HG23 H 1 0.87 0.01 . 1 . . . . . 17 ILE MG . 26334 1 127 . 1 . 1 18 18 SER H H 1 8.18 0.01 . 1 . . . . . 18 SER H . 26334 1 128 . 1 . 1 18 18 SER HA H 1 4.10 0.01 . 1 . . . . . 18 SER HA . 26334 1 129 . 1 . 1 18 18 SER HB2 H 1 4.00 0.01 . 1 . . . . . 18 SER HB2 . 26334 1 130 . 1 . 1 18 18 SER HB3 H 1 4.00 0.01 . 1 . . . . . 18 SER HB3 . 26334 1 131 . 1 . 1 19 19 TRP H H 1 8.35 0.01 . 1 . . . . . 19 TRP H . 26334 1 132 . 1 . 1 19 19 TRP HA H 1 4.32 0.01 . 1 . . . . . 19 TRP HA . 26334 1 133 . 1 . 1 19 19 TRP HB2 H 1 3.44 0.01 . 2 . . . . . 19 TRP HB2 . 26334 1 134 . 1 . 1 19 19 TRP HB3 H 1 3.57 0.01 . 2 . . . . . 19 TRP HB3 . 26334 1 135 . 1 . 1 19 19 TRP HD1 H 1 7.14 0.01 . 1 . . . . . 19 TRP HD1 . 26334 1 136 . 1 . 1 19 19 TRP HE1 H 1 10.37 0.01 . 1 . . . . . 19 TRP HE1 . 26334 1 137 . 1 . 1 19 19 TRP HE3 H 1 7.56 0.01 . 1 . . . . . 19 TRP HE3 . 26334 1 138 . 1 . 1 19 19 TRP HH2 H 1 7.10 0.01 . 1 . . . . . 19 TRP HH2 . 26334 1 139 . 1 . 1 19 19 TRP HZ2 H 1 7.36 0.01 . 1 . . . . . 19 TRP HZ2 . 26334 1 140 . 1 . 1 19 19 TRP HZ3 H 1 6.98 0.01 . 1 . . . . . 19 TRP HZ3 . 26334 1 141 . 1 . 1 20 20 ILE H H 1 8.52 0.01 . 1 . . . . . 20 ILE H . 26334 1 142 . 1 . 1 20 20 ILE HA H 1 3.50 0.01 . 1 . . . . . 20 ILE HA . 26334 1 143 . 1 . 1 20 20 ILE HB H 1 2.09 0.01 . 1 . . . . . 20 ILE HB . 26334 1 144 . 1 . 1 20 20 ILE HG12 H 1 1.23 0.01 . 2 . . . . . 20 ILE HG12 . 26334 1 145 . 1 . 1 20 20 ILE HG13 H 1 2.10 0.01 . 2 . . . . . 20 ILE HG13 . 26334 1 146 . 1 . 1 20 20 ILE HG21 H 1 0.94 0.01 . 1 . . . . . 20 ILE MG . 26334 1 147 . 1 . 1 20 20 ILE HG22 H 1 0.94 0.01 . 1 . . . . . 20 ILE MG . 26334 1 148 . 1 . 1 20 20 ILE HG23 H 1 0.94 0.01 . 1 . . . . . 20 ILE MG . 26334 1 149 . 1 . 1 21 21 LYS H H 1 8.40 0.01 . 1 . . . . . 21 LYS H . 26334 1 150 . 1 . 1 21 21 LYS HA H 1 3.88 0.01 . 1 . . . . . 21 LYS HA . 26334 1 151 . 1 . 1 21 21 LYS HB2 H 1 1.92 0.01 . 2 . . . . . 21 LYS HB2 . 26334 1 152 . 1 . 1 21 21 LYS HB3 H 1 1.99 0.01 . 2 . . . . . 21 LYS HB3 . 26334 1 153 . 1 . 1 21 21 LYS HD2 H 1 1.63 0.01 . 2 . . . . . 21 LYS HD2 . 26334 1 154 . 1 . 1 21 21 LYS HD3 H 1 1.68 0.01 . 2 . . . . . 21 LYS HD3 . 26334 1 155 . 1 . 1 21 21 LYS HE2 H 1 2.83 0.01 . 1 . . . . . 21 LYS HE2 . 26334 1 156 . 1 . 1 21 21 LYS HE3 H 1 2.83 0.01 . 1 . . . . . 21 LYS HE3 . 26334 1 157 . 1 . 1 21 21 LYS HG2 H 1 1.42 0.01 . 1 . . . . . 21 LYS HG2 . 26334 1 158 . 1 . 1 21 21 LYS HG3 H 1 1.42 0.01 . 1 . . . . . 21 LYS HG3 . 26334 1 159 . 1 . 1 22 22 ARG H H 1 8.22 0.01 . 1 . . . . . 22 ARG H . 26334 1 160 . 1 . 1 22 22 ARG HA H 1 4.05 0.01 . 1 . . . . . 22 ARG HA . 26334 1 161 . 1 . 1 22 22 ARG HB2 H 1 1.87 0.01 . 2 . . . . . 22 ARG HB2 . 26334 1 162 . 1 . 1 22 22 ARG HB3 H 1 1.95 0.01 . 2 . . . . . 22 ARG HB3 . 26334 1 163 . 1 . 1 22 22 ARG HD2 H 1 3.12 0.01 . 1 . . . . . 22 ARG HD2 . 26334 1 164 . 1 . 1 22 22 ARG HD3 H 1 3.12 0.01 . 1 . . . . . 22 ARG HD3 . 26334 1 165 . 1 . 1 22 22 ARG HG2 H 1 1.65 0.01 . 2 . . . . . 22 ARG HG2 . 26334 1 166 . 1 . 1 22 22 ARG HG3 H 1 1.77 0.01 . 2 . . . . . 22 ARG HG3 . 26334 1 167 . 1 . 1 23 23 LYS H H 1 8.30 0.01 . 1 . . . . . 23 LYS H . 26334 1 168 . 1 . 1 23 23 LYS HA H 1 3.94 0.01 . 1 . . . . . 23 LYS HA . 26334 1 169 . 1 . 1 23 23 LYS HB2 H 1 1.64 0.01 . 1 . . . . . 23 LYS HB2 . 26334 1 170 . 1 . 1 23 23 LYS HB3 H 1 1.64 0.01 . 1 . . . . . 23 LYS HB3 . 26334 1 171 . 1 . 1 23 23 LYS HD2 H 1 1.42 0.01 . 2 . . . . . 23 LYS HD2 . 26334 1 172 . 1 . 1 23 23 LYS HD3 H 1 1.63 0.01 . 2 . . . . . 23 LYS HD3 . 26334 1 173 . 1 . 1 23 23 LYS HE2 H 1 2.61 0.01 . 2 . . . . . 23 LYS HE2 . 26334 1 174 . 1 . 1 23 23 LYS HE3 H 1 2.69 0.01 . 2 . . . . . 23 LYS HE3 . 26334 1 175 . 1 . 1 23 23 LYS HG2 H 1 1.14 0.01 . 1 . . . . . 23 LYS HG2 . 26334 1 176 . 1 . 1 23 23 LYS HG3 H 1 1.14 0.01 . 1 . . . . . 23 LYS HG3 . 26334 1 177 . 1 . 1 24 24 ARG H H 1 8.15 0.01 . 1 . . . . . 24 ARG H . 26334 1 178 . 1 . 1 24 24 ARG HA H 1 4.07 0.01 . 1 . . . . . 24 ARG HA . 26334 1 179 . 1 . 1 24 24 ARG HB2 H 1 1.86 0.01 . 2 . . . . . 24 ARG HB2 . 26334 1 180 . 1 . 1 24 24 ARG HB3 H 1 1.96 0.01 . 2 . . . . . 24 ARG HB3 . 26334 1 181 . 1 . 1 24 24 ARG HD2 H 1 3.18 0.01 . 1 . . . . . 24 ARG HD2 . 26334 1 182 . 1 . 1 24 24 ARG HD3 H 1 3.18 0.01 . 1 . . . . . 24 ARG HD3 . 26334 1 183 . 1 . 1 24 24 ARG HG2 H 1 1.68 0.01 . 1 . . . . . 24 ARG HG2 . 26334 1 184 . 1 . 1 24 24 ARG HG3 H 1 1.68 0.01 . 1 . . . . . 24 ARG HG3 . 26334 1 185 . 1 . 1 25 25 GLN H H 1 7.92 0.01 . 1 . . . . . 25 GLN H . 26334 1 186 . 1 . 1 25 25 GLN HA H 1 4.12 0.01 . 1 . . . . . 25 GLN HA . 26334 1 187 . 1 . 1 25 25 GLN HB2 H 1 2.15 0.01 . 1 . . . . . 25 GLN HB2 . 26334 1 188 . 1 . 1 25 25 GLN HB3 H 1 2.15 0.01 . 1 . . . . . 25 GLN HB3 . 26334 1 189 . 1 . 1 25 25 GLN HG2 H 1 2.31 0.01 . 2 . . . . . 25 GLN HG2 . 26334 1 190 . 1 . 1 25 25 GLN HG3 H 1 2.57 0.01 . 2 . . . . . 25 GLN HG3 . 26334 1 191 . 1 . 1 26 26 GLN H H 1 7.75 0.01 . 1 . . . . . 26 GLN H . 26334 1 192 . 1 . 1 26 26 GLN HA H 1 4.20 0.01 . 1 . . . . . 26 GLN HA . 26334 1 193 . 1 . 1 26 26 GLN HB2 H 1 2.15 0.01 . 1 . . . . . 26 GLN HB2 . 26334 1 194 . 1 . 1 26 26 GLN HB3 H 1 2.15 0.01 . 1 . . . . . 26 GLN HB3 . 26334 1 195 . 1 . 1 26 26 GLN HG2 H 1 2.33 0.01 . 2 . . . . . 26 GLN HG2 . 26334 1 196 . 1 . 1 26 26 GLN HG3 H 1 2.54 0.01 . 2 . . . . . 26 GLN HG3 . 26334 1 stop_ save_