data_10283 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 10283 _Entry.Title ; Solution structure of the first homeobox domain of AT-binding transcription factor 1 (ATBF1) ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2008-12-17 _Entry.Accession_date 2008-12-18 _Entry.Last_release_date 2009-12-17 _Entry.Original_release_date 2009-12-17 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.8.120 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _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.Entry_ID 1 S. Ohnishi . . . 10283 2 T. Kigawa . . . 10283 3 T. Tomizawa . . . 10283 4 S. Koshiba . . . 10283 5 M. Inoue . . . 10283 6 S. Yokoyama . . . 10283 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'Protein 3000 Project' 'Protein Research Group, RIKEN Genomic Sciences Center' 'RIKEN GSC' 10283 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 10283 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 294 10283 '15N chemical shifts' 66 10283 '1H chemical shifts' 434 10283 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 . . 2009-12-17 2008-12-17 original author . 10283 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2DA1 'BMRB Entry Tracking System' 10283 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 10283 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title ; Solution structure of the first homeobox domain of AT-binding transcription factor 1 (ATBF1) ; _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev . _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _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.Entry_ID _Citation_author.Citation_ID 1 S. Ohnishi . . . 10283 1 2 T. Kigawa . . . 10283 1 3 T. Tomizawa . . . 10283 1 4 S. Koshiba . . . 10283 1 5 M. Inoue . . . 10283 1 6 S. Yokoyama . . . 10283 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 10283 _Assembly.ID 1 _Assembly.Name 'Alpha-fetoprotein enhancer binding protein' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _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 'The first homeobox domain' 1 $entity_1 . . yes native no no . . . 10283 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID . PDB 2DA1 . . . . . . 10283 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 10283 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'The first homeobox domain' _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 ; GSSGSSGKRPRTRITDDQLR VLRQYFDINNSPSEEQIKEM ADKSGLPQKVIKHWFRNTLF KERQSGPSSG ; _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 70 _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 2014-05-12 loop_ _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 no PDB 2DA1 . "Solution Structure Of The First Homeobox Domain Of At- Binding Transcription Factor 1 (Atbf1)" . . . . . 100.00 70 100.00 100.00 9.91e-43 . . . . 10283 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'The first homeobox domain' . 10283 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 . GLY . 10283 1 2 . SER . 10283 1 3 . SER . 10283 1 4 . GLY . 10283 1 5 . SER . 10283 1 6 . SER . 10283 1 7 . GLY . 10283 1 8 . LYS . 10283 1 9 . ARG . 10283 1 10 . PRO . 10283 1 11 . ARG . 10283 1 12 . THR . 10283 1 13 . ARG . 10283 1 14 . ILE . 10283 1 15 . THR . 10283 1 16 . ASP . 10283 1 17 . ASP . 10283 1 18 . GLN . 10283 1 19 . LEU . 10283 1 20 . ARG . 10283 1 21 . VAL . 10283 1 22 . LEU . 10283 1 23 . ARG . 10283 1 24 . GLN . 10283 1 25 . TYR . 10283 1 26 . PHE . 10283 1 27 . ASP . 10283 1 28 . ILE . 10283 1 29 . ASN . 10283 1 30 . ASN . 10283 1 31 . SER . 10283 1 32 . PRO . 10283 1 33 . SER . 10283 1 34 . GLU . 10283 1 35 . GLU . 10283 1 36 . GLN . 10283 1 37 . ILE . 10283 1 38 . LYS . 10283 1 39 . GLU . 10283 1 40 . MET . 10283 1 41 . ALA . 10283 1 42 . ASP . 10283 1 43 . LYS . 10283 1 44 . SER . 10283 1 45 . GLY . 10283 1 46 . LEU . 10283 1 47 . PRO . 10283 1 48 . GLN . 10283 1 49 . LYS . 10283 1 50 . VAL . 10283 1 51 . ILE . 10283 1 52 . LYS . 10283 1 53 . HIS . 10283 1 54 . TRP . 10283 1 55 . PHE . 10283 1 56 . ARG . 10283 1 57 . ASN . 10283 1 58 . THR . 10283 1 59 . LEU . 10283 1 60 . PHE . 10283 1 61 . LYS . 10283 1 62 . GLU . 10283 1 63 . ARG . 10283 1 64 . GLN . 10283 1 65 . SER . 10283 1 66 . GLY . 10283 1 67 . PRO . 10283 1 68 . SER . 10283 1 69 . SER . 10283 1 70 . GLY . 10283 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 10283 1 . SER 2 2 10283 1 . SER 3 3 10283 1 . GLY 4 4 10283 1 . SER 5 5 10283 1 . SER 6 6 10283 1 . GLY 7 7 10283 1 . LYS 8 8 10283 1 . ARG 9 9 10283 1 . PRO 10 10 10283 1 . ARG 11 11 10283 1 . THR 12 12 10283 1 . ARG 13 13 10283 1 . ILE 14 14 10283 1 . THR 15 15 10283 1 . ASP 16 16 10283 1 . ASP 17 17 10283 1 . GLN 18 18 10283 1 . LEU 19 19 10283 1 . ARG 20 20 10283 1 . VAL 21 21 10283 1 . LEU 22 22 10283 1 . ARG 23 23 10283 1 . GLN 24 24 10283 1 . TYR 25 25 10283 1 . PHE 26 26 10283 1 . ASP 27 27 10283 1 . ILE 28 28 10283 1 . ASN 29 29 10283 1 . ASN 30 30 10283 1 . SER 31 31 10283 1 . PRO 32 32 10283 1 . SER 33 33 10283 1 . GLU 34 34 10283 1 . GLU 35 35 10283 1 . GLN 36 36 10283 1 . ILE 37 37 10283 1 . LYS 38 38 10283 1 . GLU 39 39 10283 1 . MET 40 40 10283 1 . ALA 41 41 10283 1 . ASP 42 42 10283 1 . LYS 43 43 10283 1 . SER 44 44 10283 1 . GLY 45 45 10283 1 . LEU 46 46 10283 1 . PRO 47 47 10283 1 . GLN 48 48 10283 1 . LYS 49 49 10283 1 . VAL 50 50 10283 1 . ILE 51 51 10283 1 . LYS 52 52 10283 1 . HIS 53 53 10283 1 . TRP 54 54 10283 1 . PHE 55 55 10283 1 . ARG 56 56 10283 1 . ASN 57 57 10283 1 . THR 58 58 10283 1 . LEU 59 59 10283 1 . PHE 60 60 10283 1 . LYS 61 61 10283 1 . GLU 62 62 10283 1 . ARG 63 63 10283 1 . GLN 64 64 10283 1 . SER 65 65 10283 1 . GLY 66 66 10283 1 . PRO 67 67 10283 1 . SER 68 68 10283 1 . SER 69 69 10283 1 . GLY 70 70 10283 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 10283 _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.Subvariant _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.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _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 . . . . . . . . . . . . . . . . . . . . . 10283 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 10283 _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_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _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.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'cell free synthesis' . . . . . . . . . . . . . . . . . . . plasmid . . P050322-08 . . . . . . 10283 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 10283 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% 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 'The first homeobox domain' '[U-13C; U-15N]' . . 1 $entity_1 . protein 1.2 . . mM . . . . 10283 1 2 d-TrisHCl . . . . . . buffer 20 . . mM . . . . 10283 1 3 NaCl . . . . . . salt 100 . . mM . . . . 10283 1 4 d-DTT . . . . . . salt 1 . . mM . . . . 10283 1 5 NaN3 . . . . . . salt 0.02 . . % . . . . 10283 1 6 H2O . . . . . . solvent 90 . . % . . . . 10283 1 7 D2O . . . . . . solvent 10 . . % . . . . 10283 1 stop_ save_ ####################### # Sample conditions # ####################### save_condition_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode condition_1 _Sample_condition_list.Entry_ID 10283 _Sample_condition_list.ID 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' 120 0.1 mM 10283 1 pH 7.0 0.05 pH 10283 1 pressure 1 0.001 atm 10283 1 temperature 296 0.1 K 10283 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 10283 _Software.ID 1 _Software.Name xwinnmr _Software.Version 3.5 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Bruker . . 10283 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 10283 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 10283 _Software.ID 2 _Software.Name NMRPipe _Software.Version 20030801 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, F.' . . 10283 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 10283 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 10283 _Software.ID 3 _Software.Name NMRView _Software.Version 5.0.4 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, B.A.' . . 10283 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 10283 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 10283 _Software.ID 4 _Software.Name Kujira _Software.Version 0.932 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Kobayashi, N.' . . 10283 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 10283 4 stop_ save_ save_software_5 _Software.Sf_category software _Software.Sf_framecode software_5 _Software.Entry_ID 10283 _Software.ID 5 _Software.Name CYANA _Software.Version 2.0.17 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, P.' . . 10283 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 10283 5 'structure solution' 10283 5 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 10283 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AVANCE _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 10283 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker AVANCE . 800 . . . 10283 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 10283 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_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.Entry_ID _Experiment.Experiment_list_ID 1 '3D 13C-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10283 1 2 '3D 15N-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10283 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode reference_1 _Chem_shift_reference.Entry_ID 10283 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details ; Chemical shift reference of 1H was based on the proton of water (4.784ppm at 298K) and then those of 15N and 13C were calculated based on their gyromagnetic ratios. ; 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.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.251449530 . . . . . . . . . 10283 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 . indirect 1.0 . . . . . . . . . 10283 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 10283 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_chemical_shift_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_1 _Assigned_chem_shift_list.Entry_ID 10283 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $condition_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $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 '3D 13C-separated NOESY' 1 $sample_1 isotropic 10283 1 2 '3D 15N-separated NOESY' 1 $sample_1 isotropic 10283 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_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.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 7 7 GLY H H 1 8.499 0.030 . 1 . . . . 7 GLY H . 10283 1 2 . 1 1 7 7 GLY HA2 H 1 3.948 0.030 . 1 . . . . 7 GLY HA2 . 10283 1 3 . 1 1 7 7 GLY HA3 H 1 3.948 0.030 . 1 . . . . 7 GLY HA3 . 10283 1 4 . 1 1 7 7 GLY C C 13 173.949 0.300 . 1 . . . . 7 GLY C . 10283 1 5 . 1 1 7 7 GLY CA C 13 45.325 0.300 . 1 . . . . 7 GLY CA . 10283 1 6 . 1 1 8 8 LYS H H 1 8.116 0.030 . 1 . . . . 8 LYS H . 10283 1 7 . 1 1 8 8 LYS HA H 1 4.308 0.030 . 1 . . . . 8 LYS HA . 10283 1 8 . 1 1 8 8 LYS HB2 H 1 1.786 0.030 . 2 . . . . 8 LYS HB2 . 10283 1 9 . 1 1 8 8 LYS HB3 H 1 1.706 0.030 . 2 . . . . 8 LYS HB3 . 10283 1 10 . 1 1 8 8 LYS HD2 H 1 1.647 0.030 . 2 . . . . 8 LYS HD2 . 10283 1 11 . 1 1 8 8 LYS HE2 H 1 2.969 0.030 . 2 . . . . 8 LYS HE2 . 10283 1 12 . 1 1 8 8 LYS HG2 H 1 1.358 0.030 . 2 . . . . 8 LYS HG2 . 10283 1 13 . 1 1 8 8 LYS HG3 H 1 1.420 0.030 . 2 . . . . 8 LYS HG3 . 10283 1 14 . 1 1 8 8 LYS C C 13 176.504 0.300 . 1 . . . . 8 LYS C . 10283 1 15 . 1 1 8 8 LYS CA C 13 56.113 0.300 . 1 . . . . 8 LYS CA . 10283 1 16 . 1 1 8 8 LYS CB C 13 33.151 0.300 . 1 . . . . 8 LYS CB . 10283 1 17 . 1 1 8 8 LYS CD C 13 29.031 0.300 . 1 . . . . 8 LYS CD . 10283 1 18 . 1 1 8 8 LYS CE C 13 42.214 0.300 . 1 . . . . 8 LYS CE . 10283 1 19 . 1 1 8 8 LYS CG C 13 24.830 0.300 . 1 . . . . 8 LYS CG . 10283 1 20 . 1 1 8 8 LYS N N 15 120.734 0.300 . 1 . . . . 8 LYS N . 10283 1 21 . 1 1 9 9 ARG H H 1 8.362 0.030 . 1 . . . . 9 ARG H . 10283 1 22 . 1 1 9 9 ARG HA H 1 4.590 0.030 . 1 . . . . 9 ARG HA . 10283 1 23 . 1 1 9 9 ARG HB2 H 1 1.814 0.030 . 2 . . . . 9 ARG HB2 . 10283 1 24 . 1 1 9 9 ARG HB3 H 1 1.718 0.030 . 2 . . . . 9 ARG HB3 . 10283 1 25 . 1 1 9 9 ARG HD2 H 1 3.177 0.030 . 2 . . . . 9 ARG HD2 . 10283 1 26 . 1 1 9 9 ARG HG2 H 1 1.646 0.030 . 2 . . . . 9 ARG HG2 . 10283 1 27 . 1 1 9 9 ARG C C 13 176.479 0.300 . 1 . . . . 9 ARG C . 10283 1 28 . 1 1 9 9 ARG CA C 13 53.962 0.300 . 1 . . . . 9 ARG CA . 10283 1 29 . 1 1 9 9 ARG CB C 13 30.103 0.300 . 1 . . . . 9 ARG CB . 10283 1 30 . 1 1 9 9 ARG CD C 13 43.361 0.300 . 1 . . . . 9 ARG CD . 10283 1 31 . 1 1 9 9 ARG CG C 13 26.751 0.300 . 1 . . . . 9 ARG CG . 10283 1 32 . 1 1 9 9 ARG N N 15 123.609 0.300 . 1 . . . . 9 ARG N . 10283 1 33 . 1 1 10 10 PRO HA H 1 4.419 0.030 . 1 . . . . 10 PRO HA . 10283 1 34 . 1 1 10 10 PRO HB2 H 1 1.871 0.030 . 2 . . . . 10 PRO HB2 . 10283 1 35 . 1 1 10 10 PRO HB3 H 1 2.285 0.030 . 2 . . . . 10 PRO HB3 . 10283 1 36 . 1 1 10 10 PRO HD2 H 1 3.597 0.030 . 2 . . . . 10 PRO HD2 . 10283 1 37 . 1 1 10 10 PRO HD3 H 1 3.777 0.030 . 2 . . . . 10 PRO HD3 . 10283 1 38 . 1 1 10 10 PRO HG2 H 1 1.988 0.030 . 2 . . . . 10 PRO HG2 . 10283 1 39 . 1 1 10 10 PRO C C 13 176.796 0.300 . 1 . . . . 10 PRO C . 10283 1 40 . 1 1 10 10 PRO CA C 13 62.987 0.300 . 1 . . . . 10 PRO CA . 10283 1 41 . 1 1 10 10 PRO CB C 13 32.080 0.300 . 1 . . . . 10 PRO CB . 10283 1 42 . 1 1 10 10 PRO CD C 13 50.700 0.300 . 1 . . . . 10 PRO CD . 10283 1 43 . 1 1 10 10 PRO CG C 13 27.384 0.300 . 1 . . . . 10 PRO CG . 10283 1 44 . 1 1 11 11 ARG H H 1 8.517 0.030 . 1 . . . . 11 ARG H . 10283 1 45 . 1 1 11 11 ARG C C 13 176.551 0.300 . 1 . . . . 11 ARG C . 10283 1 46 . 1 1 11 11 ARG CA C 13 56.077 0.300 . 1 . . . . 11 ARG CA . 10283 1 47 . 1 1 11 11 ARG CB C 13 30.762 0.300 . 1 . . . . 11 ARG CB . 10283 1 48 . 1 1 11 11 ARG N N 15 121.931 0.300 . 1 . . . . 11 ARG N . 10283 1 49 . 1 1 12 12 THR HA H 1 4.260 0.030 . 1 . . . . 12 THR HA . 10283 1 50 . 1 1 12 12 THR HB H 1 4.093 0.030 . 1 . . . . 12 THR HB . 10283 1 51 . 1 1 12 12 THR HG21 H 1 1.180 0.030 . 1 . . . . 12 THR HG2 . 10283 1 52 . 1 1 12 12 THR HG22 H 1 1.180 0.030 . 1 . . . . 12 THR HG2 . 10283 1 53 . 1 1 12 12 THR HG23 H 1 1.180 0.030 . 1 . . . . 12 THR HG2 . 10283 1 54 . 1 1 12 12 THR C C 13 173.904 0.300 . 1 . . . . 12 THR C . 10283 1 55 . 1 1 12 12 THR CA C 13 62.218 0.300 . 1 . . . . 12 THR CA . 10283 1 56 . 1 1 12 12 THR CB C 13 69.843 0.300 . 1 . . . . 12 THR CB . 10283 1 57 . 1 1 12 12 THR CG2 C 13 21.699 0.300 . 1 . . . . 12 THR CG2 . 10283 1 58 . 1 1 13 13 ARG H H 1 8.434 0.030 . 1 . . . . 13 ARG H . 10283 1 59 . 1 1 13 13 ARG HA H 1 4.381 0.030 . 1 . . . . 13 ARG HA . 10283 1 60 . 1 1 13 13 ARG HB2 H 1 1.762 0.030 . 2 . . . . 13 ARG HB2 . 10283 1 61 . 1 1 13 13 ARG HB3 H 1 1.825 0.030 . 2 . . . . 13 ARG HB3 . 10283 1 62 . 1 1 13 13 ARG HD2 H 1 3.185 0.030 . 2 . . . . 13 ARG HD2 . 10283 1 63 . 1 1 13 13 ARG HG2 H 1 1.592 0.030 . 2 . . . . 13 ARG HG2 . 10283 1 64 . 1 1 13 13 ARG HG3 H 1 1.553 0.030 . 2 . . . . 13 ARG HG3 . 10283 1 65 . 1 1 13 13 ARG C C 13 175.336 0.300 . 1 . . . . 13 ARG C . 10283 1 66 . 1 1 13 13 ARG CA C 13 55.972 0.300 . 1 . . . . 13 ARG CA . 10283 1 67 . 1 1 13 13 ARG CB C 13 31.059 0.300 . 1 . . . . 13 ARG CB . 10283 1 68 . 1 1 13 13 ARG CD C 13 43.367 0.300 . 1 . . . . 13 ARG CD . 10283 1 69 . 1 1 13 13 ARG CG C 13 27.054 0.300 . 1 . . . . 13 ARG CG . 10283 1 70 . 1 1 13 13 ARG N N 15 125.368 0.300 . 1 . . . . 13 ARG N . 10283 1 71 . 1 1 14 14 ILE H H 1 8.179 0.030 . 1 . . . . 14 ILE H . 10283 1 72 . 1 1 14 14 ILE HA H 1 4.268 0.030 . 1 . . . . 14 ILE HA . 10283 1 73 . 1 1 14 14 ILE HB H 1 1.703 0.030 . 1 . . . . 14 ILE HB . 10283 1 74 . 1 1 14 14 ILE HD11 H 1 0.661 0.030 . 1 . . . . 14 ILE HD1 . 10283 1 75 . 1 1 14 14 ILE HD12 H 1 0.661 0.030 . 1 . . . . 14 ILE HD1 . 10283 1 76 . 1 1 14 14 ILE HD13 H 1 0.661 0.030 . 1 . . . . 14 ILE HD1 . 10283 1 77 . 1 1 14 14 ILE HG12 H 1 1.562 0.030 . 2 . . . . 14 ILE HG12 . 10283 1 78 . 1 1 14 14 ILE HG13 H 1 0.870 0.030 . 2 . . . . 14 ILE HG13 . 10283 1 79 . 1 1 14 14 ILE HG21 H 1 0.810 0.030 . 1 . . . . 14 ILE HG2 . 10283 1 80 . 1 1 14 14 ILE HG22 H 1 0.810 0.030 . 1 . . . . 14 ILE HG2 . 10283 1 81 . 1 1 14 14 ILE HG23 H 1 0.810 0.030 . 1 . . . . 14 ILE HG2 . 10283 1 82 . 1 1 14 14 ILE C C 13 176.844 0.300 . 1 . . . . 14 ILE C . 10283 1 83 . 1 1 14 14 ILE CA C 13 61.647 0.300 . 1 . . . . 14 ILE CA . 10283 1 84 . 1 1 14 14 ILE CB C 13 39.248 0.300 . 1 . . . . 14 ILE CB . 10283 1 85 . 1 1 14 14 ILE CD1 C 13 13.212 0.300 . 1 . . . . 14 ILE CD1 . 10283 1 86 . 1 1 14 14 ILE CG1 C 13 27.466 0.300 . 1 . . . . 14 ILE CG1 . 10283 1 87 . 1 1 14 14 ILE CG2 C 13 18.073 0.300 . 1 . . . . 14 ILE CG2 . 10283 1 88 . 1 1 14 14 ILE N N 15 123.951 0.300 . 1 . . . . 14 ILE N . 10283 1 89 . 1 1 15 15 THR H H 1 8.922 0.030 . 1 . . . . 15 THR H . 10283 1 90 . 1 1 15 15 THR HA H 1 4.386 0.030 . 1 . . . . 15 THR HA . 10283 1 91 . 1 1 15 15 THR HB H 1 4.706 0.030 . 1 . . . . 15 THR HB . 10283 1 92 . 1 1 15 15 THR HG21 H 1 1.250 0.030 . 1 . . . . 15 THR HG2 . 10283 1 93 . 1 1 15 15 THR HG22 H 1 1.250 0.030 . 1 . . . . 15 THR HG2 . 10283 1 94 . 1 1 15 15 THR HG23 H 1 1.250 0.030 . 1 . . . . 15 THR HG2 . 10283 1 95 . 1 1 15 15 THR C C 13 175.263 0.300 . 1 . . . . 15 THR C . 10283 1 96 . 1 1 15 15 THR CA C 13 61.402 0.300 . 1 . . . . 15 THR CA . 10283 1 97 . 1 1 15 15 THR CB C 13 70.796 0.300 . 1 . . . . 15 THR CB . 10283 1 98 . 1 1 15 15 THR CG2 C 13 21.534 0.300 . 1 . . . . 15 THR CG2 . 10283 1 99 . 1 1 15 15 THR N N 15 119.222 0.300 . 1 . . . . 15 THR N . 10283 1 100 . 1 1 16 16 ASP H H 1 8.951 0.030 . 1 . . . . 16 ASP H . 10283 1 101 . 1 1 16 16 ASP HA H 1 4.353 0.030 . 1 . . . . 16 ASP HA . 10283 1 102 . 1 1 16 16 ASP HB2 H 1 2.658 0.030 . 1 . . . . 16 ASP HB2 . 10283 1 103 . 1 1 16 16 ASP HB3 H 1 2.658 0.030 . 1 . . . . 16 ASP HB3 . 10283 1 104 . 1 1 16 16 ASP C C 13 178.888 0.300 . 1 . . . . 16 ASP C . 10283 1 105 . 1 1 16 16 ASP CA C 13 58.016 0.300 . 1 . . . . 16 ASP CA . 10283 1 106 . 1 1 16 16 ASP CB C 13 40.154 0.300 . 1 . . . . 16 ASP CB . 10283 1 107 . 1 1 16 16 ASP N N 15 120.852 0.300 . 1 . . . . 16 ASP N . 10283 1 108 . 1 1 17 17 ASP H H 1 8.387 0.030 . 1 . . . . 17 ASP H . 10283 1 109 . 1 1 17 17 ASP HA H 1 4.361 0.030 . 1 . . . . 17 ASP HA . 10283 1 110 . 1 1 17 17 ASP HB2 H 1 2.510 0.030 . 2 . . . . 17 ASP HB2 . 10283 1 111 . 1 1 17 17 ASP HB3 H 1 2.602 0.030 . 2 . . . . 17 ASP HB3 . 10283 1 112 . 1 1 17 17 ASP C C 13 178.815 0.300 . 1 . . . . 17 ASP C . 10283 1 113 . 1 1 17 17 ASP CA C 13 57.311 0.300 . 1 . . . . 17 ASP CA . 10283 1 114 . 1 1 17 17 ASP CB C 13 40.649 0.300 . 1 . . . . 17 ASP CB . 10283 1 115 . 1 1 17 17 ASP N N 15 118.488 0.300 . 1 . . . . 17 ASP N . 10283 1 116 . 1 1 18 18 GLN H H 1 7.561 0.030 . 1 . . . . 18 GLN H . 10283 1 117 . 1 1 18 18 GLN HA H 1 3.844 0.030 . 1 . . . . 18 GLN HA . 10283 1 118 . 1 1 18 18 GLN HB2 H 1 2.468 0.030 . 2 . . . . 18 GLN HB2 . 10283 1 119 . 1 1 18 18 GLN HB3 H 1 1.519 0.030 . 2 . . . . 18 GLN HB3 . 10283 1 120 . 1 1 18 18 GLN HE21 H 1 6.633 0.030 . 2 . . . . 18 GLN HE21 . 10283 1 121 . 1 1 18 18 GLN HE22 H 1 7.426 0.030 . 2 . . . . 18 GLN HE22 . 10283 1 122 . 1 1 18 18 GLN HG2 H 1 2.497 0.030 . 2 . . . . 18 GLN HG2 . 10283 1 123 . 1 1 18 18 GLN HG3 H 1 2.552 0.030 . 2 . . . . 18 GLN HG3 . 10283 1 124 . 1 1 18 18 GLN C C 13 177.988 0.300 . 1 . . . . 18 GLN C . 10283 1 125 . 1 1 18 18 GLN CA C 13 58.933 0.300 . 1 . . . . 18 GLN CA . 10283 1 126 . 1 1 18 18 GLN CB C 13 28.702 0.300 . 1 . . . . 18 GLN CB . 10283 1 127 . 1 1 18 18 GLN CG C 13 34.634 0.300 . 1 . . . . 18 GLN CG . 10283 1 128 . 1 1 18 18 GLN N N 15 119.852 0.300 . 1 . . . . 18 GLN N . 10283 1 129 . 1 1 18 18 GLN NE2 N 15 109.816 0.300 . 1 . . . . 18 GLN NE2 . 10283 1 130 . 1 1 19 19 LEU H H 1 8.538 0.030 . 1 . . . . 19 LEU H . 10283 1 131 . 1 1 19 19 LEU HA H 1 3.549 0.030 . 1 . . . . 19 LEU HA . 10283 1 132 . 1 1 19 19 LEU HB2 H 1 1.617 0.030 . 1 . . . . 19 LEU HB2 . 10283 1 133 . 1 1 19 19 LEU HB3 H 1 1.617 0.030 . 1 . . . . 19 LEU HB3 . 10283 1 134 . 1 1 19 19 LEU HD11 H 1 0.879 0.030 . 1 . . . . 19 LEU HD1 . 10283 1 135 . 1 1 19 19 LEU HD12 H 1 0.879 0.030 . 1 . . . . 19 LEU HD1 . 10283 1 136 . 1 1 19 19 LEU HD13 H 1 0.879 0.030 . 1 . . . . 19 LEU HD1 . 10283 1 137 . 1 1 19 19 LEU HD21 H 1 0.807 0.030 . 1 . . . . 19 LEU HD2 . 10283 1 138 . 1 1 19 19 LEU HD22 H 1 0.807 0.030 . 1 . . . . 19 LEU HD2 . 10283 1 139 . 1 1 19 19 LEU HD23 H 1 0.807 0.030 . 1 . . . . 19 LEU HD2 . 10283 1 140 . 1 1 19 19 LEU HG H 1 1.519 0.030 . 1 . . . . 19 LEU HG . 10283 1 141 . 1 1 19 19 LEU C C 13 178.202 0.300 . 1 . . . . 19 LEU C . 10283 1 142 . 1 1 19 19 LEU CA C 13 57.593 0.300 . 1 . . . . 19 LEU CA . 10283 1 143 . 1 1 19 19 LEU CB C 13 41.720 0.300 . 1 . . . . 19 LEU CB . 10283 1 144 . 1 1 19 19 LEU CD1 C 13 24.542 0.300 . 2 . . . . 19 LEU CD1 . 10283 1 145 . 1 1 19 19 LEU CD2 C 13 24.521 0.300 . 2 . . . . 19 LEU CD2 . 10283 1 146 . 1 1 19 19 LEU CG C 13 26.437 0.300 . 1 . . . . 19 LEU CG . 10283 1 147 . 1 1 19 19 LEU N N 15 120.203 0.300 . 1 . . . . 19 LEU N . 10283 1 148 . 1 1 20 20 ARG H H 1 7.644 0.030 . 1 . . . . 20 ARG H . 10283 1 149 . 1 1 20 20 ARG HA H 1 3.893 0.030 . 1 . . . . 20 ARG HA . 10283 1 150 . 1 1 20 20 ARG HB2 H 1 1.925 0.030 . 1 . . . . 20 ARG HB2 . 10283 1 151 . 1 1 20 20 ARG HB3 H 1 1.925 0.030 . 1 . . . . 20 ARG HB3 . 10283 1 152 . 1 1 20 20 ARG HD2 H 1 3.227 0.030 . 2 . . . . 20 ARG HD2 . 10283 1 153 . 1 1 20 20 ARG HG2 H 1 1.550 0.030 . 2 . . . . 20 ARG HG2 . 10283 1 154 . 1 1 20 20 ARG HG3 H 1 1.768 0.030 . 2 . . . . 20 ARG HG3 . 10283 1 155 . 1 1 20 20 ARG C C 13 179.148 0.300 . 1 . . . . 20 ARG C . 10283 1 156 . 1 1 20 20 ARG CA C 13 59.744 0.300 . 1 . . . . 20 ARG CA . 10283 1 157 . 1 1 20 20 ARG CB C 13 29.855 0.300 . 1 . . . . 20 ARG CB . 10283 1 158 . 1 1 20 20 ARG CD C 13 43.367 0.300 . 1 . . . . 20 ARG CD . 10283 1 159 . 1 1 20 20 ARG CG C 13 27.833 0.300 . 1 . . . . 20 ARG CG . 10283 1 160 . 1 1 20 20 ARG N N 15 117.442 0.300 . 1 . . . . 20 ARG N . 10283 1 161 . 1 1 21 21 VAL H H 1 7.074 0.030 . 1 . . . . 21 VAL H . 10283 1 162 . 1 1 21 21 VAL HA H 1 3.726 0.030 . 1 . . . . 21 VAL HA . 10283 1 163 . 1 1 21 21 VAL HB H 1 2.189 0.030 . 1 . . . . 21 VAL HB . 10283 1 164 . 1 1 21 21 VAL HG11 H 1 0.951 0.030 . 1 . . . . 21 VAL HG1 . 10283 1 165 . 1 1 21 21 VAL HG12 H 1 0.951 0.030 . 1 . . . . 21 VAL HG1 . 10283 1 166 . 1 1 21 21 VAL HG13 H 1 0.951 0.030 . 1 . . . . 21 VAL HG1 . 10283 1 167 . 1 1 21 21 VAL HG21 H 1 1.030 0.030 . 1 . . . . 21 VAL HG2 . 10283 1 168 . 1 1 21 21 VAL HG22 H 1 1.030 0.030 . 1 . . . . 21 VAL HG2 . 10283 1 169 . 1 1 21 21 VAL HG23 H 1 1.030 0.030 . 1 . . . . 21 VAL HG2 . 10283 1 170 . 1 1 21 21 VAL C C 13 177.643 0.300 . 1 . . . . 21 VAL C . 10283 1 171 . 1 1 21 21 VAL CA C 13 66.098 0.300 . 1 . . . . 21 VAL CA . 10283 1 172 . 1 1 21 21 VAL CB C 13 31.750 0.300 . 1 . . . . 21 VAL CB . 10283 1 173 . 1 1 21 21 VAL CG1 C 13 21.398 0.300 . 2 . . . . 21 VAL CG1 . 10283 1 174 . 1 1 21 21 VAL CG2 C 13 22.393 0.300 . 2 . . . . 21 VAL CG2 . 10283 1 175 . 1 1 21 21 VAL N N 15 118.796 0.300 . 1 . . . . 21 VAL N . 10283 1 176 . 1 1 22 22 LEU H H 1 7.620 0.030 . 1 . . . . 22 LEU H . 10283 1 177 . 1 1 22 22 LEU HA H 1 3.947 0.030 . 1 . . . . 22 LEU HA . 10283 1 178 . 1 1 22 22 LEU HB2 H 1 0.184 0.030 . 2 . . . . 22 LEU HB2 . 10283 1 179 . 1 1 22 22 LEU HB3 H 1 0.789 0.030 . 2 . . . . 22 LEU HB3 . 10283 1 180 . 1 1 22 22 LEU HD11 H 1 -0.024 0.030 . 1 . . . . 22 LEU HD1 . 10283 1 181 . 1 1 22 22 LEU HD12 H 1 -0.024 0.030 . 1 . . . . 22 LEU HD1 . 10283 1 182 . 1 1 22 22 LEU HD13 H 1 -0.024 0.030 . 1 . . . . 22 LEU HD1 . 10283 1 183 . 1 1 22 22 LEU HD21 H 1 0.581 0.030 . 1 . . . . 22 LEU HD2 . 10283 1 184 . 1 1 22 22 LEU HD22 H 1 0.581 0.030 . 1 . . . . 22 LEU HD2 . 10283 1 185 . 1 1 22 22 LEU HD23 H 1 0.581 0.030 . 1 . . . . 22 LEU HD2 . 10283 1 186 . 1 1 22 22 LEU HG H 1 1.486 0.030 . 1 . . . . 22 LEU HG . 10283 1 187 . 1 1 22 22 LEU C C 13 178.979 0.300 . 1 . . . . 22 LEU C . 10283 1 188 . 1 1 22 22 LEU CA C 13 58.369 0.300 . 1 . . . . 22 LEU CA . 10283 1 189 . 1 1 22 22 LEU CB C 13 38.869 0.300 . 1 . . . . 22 LEU CB . 10283 1 190 . 1 1 22 22 LEU CD1 C 13 24.066 0.300 . 2 . . . . 22 LEU CD1 . 10283 1 191 . 1 1 22 22 LEU CD2 C 13 23.055 0.300 . 2 . . . . 22 LEU CD2 . 10283 1 192 . 1 1 22 22 LEU CG C 13 26.676 0.300 . 1 . . . . 22 LEU CG . 10283 1 193 . 1 1 22 22 LEU N N 15 119.184 0.300 . 1 . . . . 22 LEU N . 10283 1 194 . 1 1 23 23 ARG H H 1 8.451 0.030 . 1 . . . . 23 ARG H . 10283 1 195 . 1 1 23 23 ARG HA H 1 4.054 0.030 . 1 . . . . 23 ARG HA . 10283 1 196 . 1 1 23 23 ARG HB2 H 1 1.875 0.030 . 2 . . . . 23 ARG HB2 . 10283 1 197 . 1 1 23 23 ARG HB3 H 1 1.970 0.030 . 2 . . . . 23 ARG HB3 . 10283 1 198 . 1 1 23 23 ARG HD2 H 1 3.180 0.030 . 2 . . . . 23 ARG HD2 . 10283 1 199 . 1 1 23 23 ARG HD3 H 1 3.232 0.030 . 2 . . . . 23 ARG HD3 . 10283 1 200 . 1 1 23 23 ARG HG2 H 1 1.764 0.030 . 2 . . . . 23 ARG HG2 . 10283 1 201 . 1 1 23 23 ARG HG3 H 1 1.844 0.030 . 2 . . . . 23 ARG HG3 . 10283 1 202 . 1 1 23 23 ARG C C 13 178.177 0.300 . 1 . . . . 23 ARG C . 10283 1 203 . 1 1 23 23 ARG CA C 13 59.157 0.300 . 1 . . . . 23 ARG CA . 10283 1 204 . 1 1 23 23 ARG CB C 13 29.772 0.300 . 1 . . . . 23 ARG CB . 10283 1 205 . 1 1 23 23 ARG CD C 13 43.111 0.300 . 1 . . . . 23 ARG CD . 10283 1 206 . 1 1 23 23 ARG CG C 13 27.301 0.300 . 1 . . . . 23 ARG CG . 10283 1 207 . 1 1 23 23 ARG N N 15 116.571 0.300 . 1 . . . . 23 ARG N . 10283 1 208 . 1 1 24 24 GLN H H 1 7.749 0.030 . 1 . . . . 24 GLN H . 10283 1 209 . 1 1 24 24 GLN HA H 1 4.129 0.030 . 1 . . . . 24 GLN HA . 10283 1 210 . 1 1 24 24 GLN HB2 H 1 2.265 0.030 . 2 . . . . 24 GLN HB2 . 10283 1 211 . 1 1 24 24 GLN HB3 H 1 2.146 0.030 . 2 . . . . 24 GLN HB3 . 10283 1 212 . 1 1 24 24 GLN HE21 H 1 6.728 0.030 . 2 . . . . 24 GLN HE21 . 10283 1 213 . 1 1 24 24 GLN HE22 H 1 7.279 0.030 . 2 . . . . 24 GLN HE22 . 10283 1 214 . 1 1 24 24 GLN HG2 H 1 2.508 0.030 . 2 . . . . 24 GLN HG2 . 10283 1 215 . 1 1 24 24 GLN HG3 H 1 2.242 0.030 . 2 . . . . 24 GLN HG3 . 10283 1 216 . 1 1 24 24 GLN C C 13 179.100 0.300 . 1 . . . . 24 GLN C . 10283 1 217 . 1 1 24 24 GLN CA C 13 58.827 0.300 . 1 . . . . 24 GLN CA . 10283 1 218 . 1 1 24 24 GLN CB C 13 28.290 0.300 . 1 . . . . 24 GLN CB . 10283 1 219 . 1 1 24 24 GLN CG C 13 34.063 0.300 . 1 . . . . 24 GLN CG . 10283 1 220 . 1 1 24 24 GLN N N 15 118.256 0.300 . 1 . . . . 24 GLN N . 10283 1 221 . 1 1 24 24 GLN NE2 N 15 110.739 0.300 . 1 . . . . 24 GLN NE2 . 10283 1 222 . 1 1 25 25 TYR H H 1 7.902 0.030 . 1 . . . . 25 TYR H . 10283 1 223 . 1 1 25 25 TYR HA H 1 4.295 0.030 . 1 . . . . 25 TYR HA . 10283 1 224 . 1 1 25 25 TYR HB2 H 1 3.517 0.030 . 2 . . . . 25 TYR HB2 . 10283 1 225 . 1 1 25 25 TYR HB3 H 1 3.304 0.030 . 2 . . . . 25 TYR HB3 . 10283 1 226 . 1 1 25 25 TYR HD1 H 1 7.372 0.030 . 1 . . . . 25 TYR HD1 . 10283 1 227 . 1 1 25 25 TYR HD2 H 1 7.372 0.030 . 1 . . . . 25 TYR HD2 . 10283 1 228 . 1 1 25 25 TYR HE1 H 1 6.721 0.030 . 1 . . . . 25 TYR HE1 . 10283 1 229 . 1 1 25 25 TYR HE2 H 1 6.721 0.030 . 1 . . . . 25 TYR HE2 . 10283 1 230 . 1 1 25 25 TYR C C 13 178.080 0.300 . 1 . . . . 25 TYR C . 10283 1 231 . 1 1 25 25 TYR CA C 13 61.506 0.300 . 1 . . . . 25 TYR CA . 10283 1 232 . 1 1 25 25 TYR CB C 13 39.001 0.300 . 1 . . . . 25 TYR CB . 10283 1 233 . 1 1 25 25 TYR CD1 C 13 133.291 0.300 . 1 . . . . 25 TYR CD1 . 10283 1 234 . 1 1 25 25 TYR CD2 C 13 133.291 0.300 . 1 . . . . 25 TYR CD2 . 10283 1 235 . 1 1 25 25 TYR CE1 C 13 117.574 0.300 . 1 . . . . 25 TYR CE1 . 10283 1 236 . 1 1 25 25 TYR CE2 C 13 117.574 0.300 . 1 . . . . 25 TYR CE2 . 10283 1 237 . 1 1 25 25 TYR N N 15 117.374 0.300 . 1 . . . . 25 TYR N . 10283 1 238 . 1 1 26 26 PHE H H 1 8.935 0.030 . 1 . . . . 26 PHE H . 10283 1 239 . 1 1 26 26 PHE HA H 1 4.366 0.030 . 1 . . . . 26 PHE HA . 10283 1 240 . 1 1 26 26 PHE HB2 H 1 3.305 0.030 . 2 . . . . 26 PHE HB2 . 10283 1 241 . 1 1 26 26 PHE HB3 H 1 3.202 0.030 . 2 . . . . 26 PHE HB3 . 10283 1 242 . 1 1 26 26 PHE HD1 H 1 7.131 0.030 . 1 . . . . 26 PHE HD1 . 10283 1 243 . 1 1 26 26 PHE HD2 H 1 7.131 0.030 . 1 . . . . 26 PHE HD2 . 10283 1 244 . 1 1 26 26 PHE HE1 H 1 7.235 0.030 . 1 . . . . 26 PHE HE1 . 10283 1 245 . 1 1 26 26 PHE HE2 H 1 7.235 0.030 . 1 . . . . 26 PHE HE2 . 10283 1 246 . 1 1 26 26 PHE HZ H 1 6.978 0.030 . 1 . . . . 26 PHE HZ . 10283 1 247 . 1 1 26 26 PHE C C 13 175.847 0.300 . 1 . . . . 26 PHE C . 10283 1 248 . 1 1 26 26 PHE CA C 13 61.452 0.300 . 1 . . . . 26 PHE CA . 10283 1 249 . 1 1 26 26 PHE CB C 13 39.538 0.300 . 1 . . . . 26 PHE CB . 10283 1 250 . 1 1 26 26 PHE CD1 C 13 132.197 0.300 . 1 . . . . 26 PHE CD1 . 10283 1 251 . 1 1 26 26 PHE CD2 C 13 132.197 0.300 . 1 . . . . 26 PHE CD2 . 10283 1 252 . 1 1 26 26 PHE CE1 C 13 131.160 0.300 . 1 . . . . 26 PHE CE1 . 10283 1 253 . 1 1 26 26 PHE CE2 C 13 131.160 0.300 . 1 . . . . 26 PHE CE2 . 10283 1 254 . 1 1 26 26 PHE CZ C 13 129.421 0.300 . 1 . . . . 26 PHE CZ . 10283 1 255 . 1 1 27 27 ASP H H 1 8.138 0.030 . 1 . . . . 27 ASP H . 10283 1 256 . 1 1 27 27 ASP HA H 1 4.407 0.030 . 1 . . . . 27 ASP HA . 10283 1 257 . 1 1 27 27 ASP HB2 H 1 2.711 0.030 . 1 . . . . 27 ASP HB2 . 10283 1 258 . 1 1 27 27 ASP HB3 H 1 2.711 0.030 . 1 . . . . 27 ASP HB3 . 10283 1 259 . 1 1 27 27 ASP C C 13 177.546 0.300 . 1 . . . . 27 ASP C . 10283 1 260 . 1 1 27 27 ASP CA C 13 56.007 0.300 . 1 . . . . 27 ASP CA . 10283 1 261 . 1 1 27 27 ASP CB C 13 40.813 0.300 . 1 . . . . 27 ASP CB . 10283 1 262 . 1 1 27 27 ASP N N 15 116.760 0.300 . 1 . . . . 27 ASP N . 10283 1 263 . 1 1 28 28 ILE H H 1 7.463 0.030 . 1 . . . . 28 ILE H . 10283 1 264 . 1 1 28 28 ILE HA H 1 3.945 0.030 . 1 . . . . 28 ILE HA . 10283 1 265 . 1 1 28 28 ILE HB H 1 1.945 0.030 . 1 . . . . 28 ILE HB . 10283 1 266 . 1 1 28 28 ILE HD11 H 1 0.762 0.030 . 1 . . . . 28 ILE HD1 . 10283 1 267 . 1 1 28 28 ILE HD12 H 1 0.762 0.030 . 1 . . . . 28 ILE HD1 . 10283 1 268 . 1 1 28 28 ILE HD13 H 1 0.762 0.030 . 1 . . . . 28 ILE HD1 . 10283 1 269 . 1 1 28 28 ILE HG12 H 1 1.159 0.030 . 2 . . . . 28 ILE HG12 . 10283 1 270 . 1 1 28 28 ILE HG13 H 1 1.589 0.030 . 2 . . . . 28 ILE HG13 . 10283 1 271 . 1 1 28 28 ILE HG21 H 1 0.888 0.030 . 1 . . . . 28 ILE HG2 . 10283 1 272 . 1 1 28 28 ILE HG22 H 1 0.888 0.030 . 1 . . . . 28 ILE HG2 . 10283 1 273 . 1 1 28 28 ILE HG23 H 1 0.888 0.030 . 1 . . . . 28 ILE HG2 . 10283 1 274 . 1 1 28 28 ILE C C 13 176.260 0.300 . 1 . . . . 28 ILE C . 10283 1 275 . 1 1 28 28 ILE CA C 13 62.881 0.300 . 1 . . . . 28 ILE CA . 10283 1 276 . 1 1 28 28 ILE CB C 13 38.836 0.300 . 1 . . . . 28 ILE CB . 10283 1 277 . 1 1 28 28 ILE CD1 C 13 13.221 0.300 . 1 . . . . 28 ILE CD1 . 10283 1 278 . 1 1 28 28 ILE CG1 C 13 28.058 0.300 . 1 . . . . 28 ILE CG1 . 10283 1 279 . 1 1 28 28 ILE CG2 C 13 17.420 0.300 . 1 . . . . 28 ILE CG2 . 10283 1 280 . 1 1 28 28 ILE N N 15 119.169 0.300 . 1 . . . . 28 ILE N . 10283 1 281 . 1 1 29 29 ASN H H 1 8.214 0.030 . 1 . . . . 29 ASN H . 10283 1 282 . 1 1 29 29 ASN HA H 1 4.620 0.030 . 1 . . . . 29 ASN HA . 10283 1 283 . 1 1 29 29 ASN HB2 H 1 2.788 0.030 . 1 . . . . 29 ASN HB2 . 10283 1 284 . 1 1 29 29 ASN HB3 H 1 2.788 0.030 . 1 . . . . 29 ASN HB3 . 10283 1 285 . 1 1 29 29 ASN HD21 H 1 7.580 0.030 . 2 . . . . 29 ASN HD21 . 10283 1 286 . 1 1 29 29 ASN HD22 H 1 6.567 0.030 . 2 . . . . 29 ASN HD22 . 10283 1 287 . 1 1 29 29 ASN C C 13 173.633 0.300 . 1 . . . . 29 ASN C . 10283 1 288 . 1 1 29 29 ASN CA C 13 53.081 0.300 . 1 . . . . 29 ASN CA . 10283 1 289 . 1 1 29 29 ASN CB C 13 39.330 0.300 . 1 . . . . 29 ASN CB . 10283 1 290 . 1 1 29 29 ASN N N 15 117.989 0.300 . 1 . . . . 29 ASN N . 10283 1 291 . 1 1 29 29 ASN ND2 N 15 111.646 0.300 . 1 . . . . 29 ASN ND2 . 10283 1 292 . 1 1 30 30 ASN H H 1 8.383 0.030 . 1 . . . . 30 ASN H . 10283 1 293 . 1 1 30 30 ASN HA H 1 4.231 0.030 . 1 . . . . 30 ASN HA . 10283 1 294 . 1 1 30 30 ASN HB2 H 1 2.611 0.030 . 2 . . . . 30 ASN HB2 . 10283 1 295 . 1 1 30 30 ASN HB3 H 1 2.219 0.030 . 2 . . . . 30 ASN HB3 . 10283 1 296 . 1 1 30 30 ASN HD21 H 1 7.233 0.030 . 2 . . . . 30 ASN HD21 . 10283 1 297 . 1 1 30 30 ASN HD22 H 1 6.733 0.030 . 2 . . . . 30 ASN HD22 . 10283 1 298 . 1 1 30 30 ASN C C 13 174.338 0.300 . 1 . . . . 30 ASN C . 10283 1 299 . 1 1 30 30 ASN CA C 13 53.610 0.300 . 1 . . . . 30 ASN CA . 10283 1 300 . 1 1 30 30 ASN CB C 13 38.836 0.300 . 1 . . . . 30 ASN CB . 10283 1 301 . 1 1 30 30 ASN N N 15 120.522 0.300 . 1 . . . . 30 ASN N . 10283 1 302 . 1 1 30 30 ASN ND2 N 15 113.572 0.300 . 1 . . . . 30 ASN ND2 . 10283 1 303 . 1 1 31 31 SER H H 1 7.941 0.030 . 1 . . . . 31 SER H . 10283 1 304 . 1 1 31 31 SER HA H 1 4.795 0.030 . 1 . . . . 31 SER HA . 10283 1 305 . 1 1 31 31 SER HB2 H 1 3.666 0.030 . 2 . . . . 31 SER HB2 . 10283 1 306 . 1 1 31 31 SER HB3 H 1 3.828 0.030 . 2 . . . . 31 SER HB3 . 10283 1 307 . 1 1 31 31 SER C C 13 174.387 0.300 . 1 . . . . 31 SER C . 10283 1 308 . 1 1 31 31 SER CA C 13 54.843 0.300 . 1 . . . . 31 SER CA . 10283 1 309 . 1 1 31 31 SER CB C 13 63.553 0.300 . 1 . . . . 31 SER CB . 10283 1 310 . 1 1 31 31 SER N N 15 112.907 0.300 . 1 . . . . 31 SER N . 10283 1 311 . 1 1 32 32 PRO HA H 1 4.437 0.030 . 1 . . . . 32 PRO HA . 10283 1 312 . 1 1 32 32 PRO HB2 H 1 1.592 0.030 . 2 . . . . 32 PRO HB2 . 10283 1 313 . 1 1 32 32 PRO HB3 H 1 1.826 0.030 . 2 . . . . 32 PRO HB3 . 10283 1 314 . 1 1 32 32 PRO HD2 H 1 3.252 0.030 . 2 . . . . 32 PRO HD2 . 10283 1 315 . 1 1 32 32 PRO HD3 H 1 3.317 0.030 . 2 . . . . 32 PRO HD3 . 10283 1 316 . 1 1 32 32 PRO HG2 H 1 1.129 0.030 . 2 . . . . 32 PRO HG2 . 10283 1 317 . 1 1 32 32 PRO HG3 H 1 0.496 0.030 . 2 . . . . 32 PRO HG3 . 10283 1 318 . 1 1 32 32 PRO C C 13 176.844 0.300 . 1 . . . . 32 PRO C . 10283 1 319 . 1 1 32 32 PRO CA C 13 62.180 0.300 . 1 . . . . 32 PRO CA . 10283 1 320 . 1 1 32 32 PRO CB C 13 32.380 0.300 . 1 . . . . 32 PRO CB . 10283 1 321 . 1 1 32 32 PRO CD C 13 50.947 0.300 . 1 . . . . 32 PRO CD . 10283 1 322 . 1 1 32 32 PRO CG C 13 26.052 0.300 . 1 . . . . 32 PRO CG . 10283 1 323 . 1 1 33 33 SER H H 1 8.658 0.030 . 1 . . . . 33 SER H . 10283 1 324 . 1 1 33 33 SER HA H 1 4.462 0.030 . 1 . . . . 33 SER HA . 10283 1 325 . 1 1 33 33 SER HB2 H 1 3.986 0.030 . 2 . . . . 33 SER HB2 . 10283 1 326 . 1 1 33 33 SER HB3 H 1 4.409 0.030 . 2 . . . . 33 SER HB3 . 10283 1 327 . 1 1 33 33 SER C C 13 175.068 0.300 . 1 . . . . 33 SER C . 10283 1 328 . 1 1 33 33 SER CA C 13 56.539 0.300 . 1 . . . . 33 SER CA . 10283 1 329 . 1 1 33 33 SER CB C 13 65.613 0.300 . 1 . . . . 33 SER CB . 10283 1 330 . 1 1 33 33 SER N N 15 117.201 0.300 . 1 . . . . 33 SER N . 10283 1 331 . 1 1 34 34 GLU H H 1 8.983 0.030 . 1 . . . . 34 GLU H . 10283 1 332 . 1 1 34 34 GLU HA H 1 3.885 0.030 . 1 . . . . 34 GLU HA . 10283 1 333 . 1 1 34 34 GLU HB2 H 1 2.008 0.030 . 1 . . . . 34 GLU HB2 . 10283 1 334 . 1 1 34 34 GLU HB3 H 1 2.008 0.030 . 1 . . . . 34 GLU HB3 . 10283 1 335 . 1 1 34 34 GLU HG2 H 1 2.361 0.030 . 2 . . . . 34 GLU HG2 . 10283 1 336 . 1 1 34 34 GLU HG3 H 1 2.304 0.030 . 2 . . . . 34 GLU HG3 . 10283 1 337 . 1 1 34 34 GLU C C 13 179.464 0.300 . 1 . . . . 34 GLU C . 10283 1 338 . 1 1 34 34 GLU CA C 13 59.990 0.300 . 1 . . . . 34 GLU CA . 10283 1 339 . 1 1 34 34 GLU CB C 13 29.031 0.300 . 1 . . . . 34 GLU CB . 10283 1 340 . 1 1 34 34 GLU CG C 13 36.199 0.300 . 1 . . . . 34 GLU CG . 10283 1 341 . 1 1 34 34 GLU N N 15 120.557 0.300 . 1 . . . . 34 GLU N . 10283 1 342 . 1 1 35 35 GLU H H 1 8.672 0.030 . 1 . . . . 35 GLU H . 10283 1 343 . 1 1 35 35 GLU HA H 1 3.989 0.030 . 1 . . . . 35 GLU HA . 10283 1 344 . 1 1 35 35 GLU HB2 H 1 1.951 0.030 . 2 . . . . 35 GLU HB2 . 10283 1 345 . 1 1 35 35 GLU HB3 H 1 2.009 0.030 . 2 . . . . 35 GLU HB3 . 10283 1 346 . 1 1 35 35 GLU HG2 H 1 2.372 0.030 . 2 . . . . 35 GLU HG2 . 10283 1 347 . 1 1 35 35 GLU HG3 H 1 2.283 0.030 . 2 . . . . 35 GLU HG3 . 10283 1 348 . 1 1 35 35 GLU C C 13 179.440 0.300 . 1 . . . . 35 GLU C . 10283 1 349 . 1 1 35 35 GLU CA C 13 60.096 0.300 . 1 . . . . 35 GLU CA . 10283 1 350 . 1 1 35 35 GLU CB C 13 28.949 0.300 . 1 . . . . 35 GLU CB . 10283 1 351 . 1 1 35 35 GLU CG C 13 36.859 0.300 . 1 . . . . 35 GLU CG . 10283 1 352 . 1 1 35 35 GLU N N 15 119.112 0.300 . 1 . . . . 35 GLU N . 10283 1 353 . 1 1 36 36 GLN H H 1 7.705 0.030 . 1 . . . . 36 GLN H . 10283 1 354 . 1 1 36 36 GLN HA H 1 4.012 0.030 . 1 . . . . 36 GLN HA . 10283 1 355 . 1 1 36 36 GLN HB2 H 1 1.756 0.030 . 2 . . . . 36 GLN HB2 . 10283 1 356 . 1 1 36 36 GLN HB3 H 1 2.309 0.030 . 2 . . . . 36 GLN HB3 . 10283 1 357 . 1 1 36 36 GLN HE21 H 1 6.857 0.030 . 2 . . . . 36 GLN HE21 . 10283 1 358 . 1 1 36 36 GLN HE22 H 1 7.633 0.030 . 2 . . . . 36 GLN HE22 . 10283 1 359 . 1 1 36 36 GLN HG2 H 1 2.453 0.030 . 2 . . . . 36 GLN HG2 . 10283 1 360 . 1 1 36 36 GLN C C 13 178.372 0.300 . 1 . . . . 36 GLN C . 10283 1 361 . 1 1 36 36 GLN CA C 13 58.968 0.300 . 1 . . . . 36 GLN CA . 10283 1 362 . 1 1 36 36 GLN CB C 13 28.290 0.300 . 1 . . . . 36 GLN CB . 10283 1 363 . 1 1 36 36 GLN CG C 13 35.211 0.300 . 1 . . . . 36 GLN CG . 10283 1 364 . 1 1 36 36 GLN N N 15 120.638 0.300 . 1 . . . . 36 GLN N . 10283 1 365 . 1 1 36 36 GLN NE2 N 15 111.502 0.300 . 1 . . . . 36 GLN NE2 . 10283 1 366 . 1 1 37 37 ILE H H 1 8.308 0.030 . 1 . . . . 37 ILE H . 10283 1 367 . 1 1 37 37 ILE HA H 1 3.474 0.030 . 1 . . . . 37 ILE HA . 10283 1 368 . 1 1 37 37 ILE HB H 1 1.991 0.030 . 1 . . . . 37 ILE HB . 10283 1 369 . 1 1 37 37 ILE HD11 H 1 0.554 0.030 . 1 . . . . 37 ILE HD1 . 10283 1 370 . 1 1 37 37 ILE HD12 H 1 0.554 0.030 . 1 . . . . 37 ILE HD1 . 10283 1 371 . 1 1 37 37 ILE HD13 H 1 0.554 0.030 . 1 . . . . 37 ILE HD1 . 10283 1 372 . 1 1 37 37 ILE HG12 H 1 1.429 0.030 . 2 . . . . 37 ILE HG12 . 10283 1 373 . 1 1 37 37 ILE HG13 H 1 0.820 0.030 . 2 . . . . 37 ILE HG13 . 10283 1 374 . 1 1 37 37 ILE HG21 H 1 0.813 0.030 . 1 . . . . 37 ILE HG2 . 10283 1 375 . 1 1 37 37 ILE HG22 H 1 0.813 0.030 . 1 . . . . 37 ILE HG2 . 10283 1 376 . 1 1 37 37 ILE HG23 H 1 0.813 0.030 . 1 . . . . 37 ILE HG2 . 10283 1 377 . 1 1 37 37 ILE C C 13 177.400 0.300 . 1 . . . . 37 ILE C . 10283 1 378 . 1 1 37 37 ILE CA C 13 65.173 0.300 . 1 . . . . 37 ILE CA . 10283 1 379 . 1 1 37 37 ILE CB C 13 36.447 0.300 . 1 . . . . 37 ILE CB . 10283 1 380 . 1 1 37 37 ILE CD1 C 13 12.274 0.300 . 1 . . . . 37 ILE CD1 . 10283 1 381 . 1 1 37 37 ILE CG1 C 13 28.867 0.300 . 1 . . . . 37 ILE CG1 . 10283 1 382 . 1 1 37 37 ILE CG2 C 13 17.431 0.300 . 1 . . . . 37 ILE CG2 . 10283 1 383 . 1 1 37 37 ILE N N 15 121.515 0.300 . 1 . . . . 37 ILE N . 10283 1 384 . 1 1 38 38 LYS H H 1 7.808 0.030 . 1 . . . . 38 LYS H . 10283 1 385 . 1 1 38 38 LYS HA H 1 3.803 0.030 . 1 . . . . 38 LYS HA . 10283 1 386 . 1 1 38 38 LYS HB2 H 1 1.983 0.030 . 2 . . . . 38 LYS HB2 . 10283 1 387 . 1 1 38 38 LYS HB3 H 1 1.862 0.030 . 2 . . . . 38 LYS HB3 . 10283 1 388 . 1 1 38 38 LYS HD2 H 1 1.605 0.030 . 2 . . . . 38 LYS HD2 . 10283 1 389 . 1 1 38 38 LYS HD3 H 1 1.719 0.030 . 2 . . . . 38 LYS HD3 . 10283 1 390 . 1 1 38 38 LYS HE2 H 1 2.968 0.030 . 2 . . . . 38 LYS HE2 . 10283 1 391 . 1 1 38 38 LYS HG2 H 1 1.463 0.030 . 2 . . . . 38 LYS HG2 . 10283 1 392 . 1 1 38 38 LYS HG3 H 1 1.371 0.030 . 2 . . . . 38 LYS HG3 . 10283 1 393 . 1 1 38 38 LYS C C 13 178.153 0.300 . 1 . . . . 38 LYS C . 10283 1 394 . 1 1 38 38 LYS CA C 13 60.096 0.300 . 1 . . . . 38 LYS CA . 10283 1 395 . 1 1 38 38 LYS CB C 13 31.833 0.300 . 1 . . . . 38 LYS CB . 10283 1 396 . 1 1 38 38 LYS CD C 13 28.819 0.300 . 1 . . . . 38 LYS CD . 10283 1 397 . 1 1 38 38 LYS CE C 13 42.379 0.300 . 1 . . . . 38 LYS CE . 10283 1 398 . 1 1 38 38 LYS CG C 13 25.196 0.300 . 1 . . . . 38 LYS CG . 10283 1 399 . 1 1 38 38 LYS N N 15 120.672 0.300 . 1 . . . . 38 LYS N . 10283 1 400 . 1 1 39 39 GLU H H 1 7.719 0.030 . 1 . . . . 39 GLU H . 10283 1 401 . 1 1 39 39 GLU HA H 1 4.089 0.030 . 1 . . . . 39 GLU HA . 10283 1 402 . 1 1 39 39 GLU HB2 H 1 2.192 0.030 . 2 . . . . 39 GLU HB2 . 10283 1 403 . 1 1 39 39 GLU HB3 H 1 2.106 0.030 . 2 . . . . 39 GLU HB3 . 10283 1 404 . 1 1 39 39 GLU HG2 H 1 2.461 0.030 . 2 . . . . 39 GLU HG2 . 10283 1 405 . 1 1 39 39 GLU HG3 H 1 2.194 0.030 . 2 . . . . 39 GLU HG3 . 10283 1 406 . 1 1 39 39 GLU C C 13 179.278 0.300 . 1 . . . . 39 GLU C . 10283 1 407 . 1 1 39 39 GLU CA C 13 59.522 0.300 . 1 . . . . 39 GLU CA . 10283 1 408 . 1 1 39 39 GLU CB C 13 29.773 0.300 . 1 . . . . 39 GLU CB . 10283 1 409 . 1 1 39 39 GLU CG C 13 36.246 0.300 . 1 . . . . 39 GLU CG . 10283 1 410 . 1 1 39 39 GLU N N 15 119.510 0.300 . 1 . . . . 39 GLU N . 10283 1 411 . 1 1 40 40 MET H H 1 8.167 0.030 . 1 . . . . 40 MET H . 10283 1 412 . 1 1 40 40 MET HA H 1 3.599 0.030 . 1 . . . . 40 MET HA . 10283 1 413 . 1 1 40 40 MET HB2 H 1 1.500 0.030 . 2 . . . . 40 MET HB2 . 10283 1 414 . 1 1 40 40 MET HB3 H 1 2.163 0.030 . 2 . . . . 40 MET HB3 . 10283 1 415 . 1 1 40 40 MET HE1 H 1 1.495 0.030 . 1 . . . . 40 MET HE . 10283 1 416 . 1 1 40 40 MET HE2 H 1 1.495 0.030 . 1 . . . . 40 MET HE . 10283 1 417 . 1 1 40 40 MET HE3 H 1 1.495 0.030 . 1 . . . . 40 MET HE . 10283 1 418 . 1 1 40 40 MET HG2 H 1 1.866 0.030 . 2 . . . . 40 MET HG2 . 10283 1 419 . 1 1 40 40 MET HG3 H 1 1.521 0.030 . 2 . . . . 40 MET HG3 . 10283 1 420 . 1 1 40 40 MET C C 13 179.813 0.300 . 1 . . . . 40 MET C . 10283 1 421 . 1 1 40 40 MET CA C 13 59.533 0.300 . 1 . . . . 40 MET CA . 10283 1 422 . 1 1 40 40 MET CB C 13 35.410 0.300 . 1 . . . . 40 MET CB . 10283 1 423 . 1 1 40 40 MET CE C 13 18.305 0.300 . 1 . . . . 40 MET CE . 10283 1 424 . 1 1 40 40 MET CG C 13 32.657 0.300 . 1 . . . . 40 MET CG . 10283 1 425 . 1 1 40 40 MET N N 15 117.312 0.300 . 1 . . . . 40 MET N . 10283 1 426 . 1 1 41 41 ALA H H 1 8.689 0.030 . 1 . . . . 41 ALA H . 10283 1 427 . 1 1 41 41 ALA HA H 1 4.102 0.030 . 1 . . . . 41 ALA HA . 10283 1 428 . 1 1 41 41 ALA HB1 H 1 1.536 0.030 . 1 . . . . 41 ALA HB . 10283 1 429 . 1 1 41 41 ALA HB2 H 1 1.536 0.030 . 1 . . . . 41 ALA HB . 10283 1 430 . 1 1 41 41 ALA HB3 H 1 1.536 0.030 . 1 . . . . 41 ALA HB . 10283 1 431 . 1 1 41 41 ALA C C 13 179.610 0.300 . 1 . . . . 41 ALA C . 10283 1 432 . 1 1 41 41 ALA CA C 13 55.866 0.300 . 1 . . . . 41 ALA CA . 10283 1 433 . 1 1 41 41 ALA CB C 13 18.609 0.300 . 1 . . . . 41 ALA CB . 10283 1 434 . 1 1 41 41 ALA N N 15 128.620 0.300 . 1 . . . . 41 ALA N . 10283 1 435 . 1 1 42 42 ASP H H 1 8.324 0.030 . 1 . . . . 42 ASP H . 10283 1 436 . 1 1 42 42 ASP HA H 1 4.306 0.030 . 1 . . . . 42 ASP HA . 10283 1 437 . 1 1 42 42 ASP HB2 H 1 2.676 0.030 . 2 . . . . 42 ASP HB2 . 10283 1 438 . 1 1 42 42 ASP HB3 H 1 2.842 0.030 . 2 . . . . 42 ASP HB3 . 10283 1 439 . 1 1 42 42 ASP C C 13 179.003 0.300 . 1 . . . . 42 ASP C . 10283 1 440 . 1 1 42 42 ASP CA C 13 57.241 0.300 . 1 . . . . 42 ASP CA . 10283 1 441 . 1 1 42 42 ASP CB C 13 40.319 0.300 . 1 . . . . 42 ASP CB . 10283 1 442 . 1 1 42 42 ASP N N 15 120.159 0.300 . 1 . . . . 42 ASP N . 10283 1 443 . 1 1 43 43 LYS H H 1 8.036 0.030 . 1 . . . . 43 LYS H . 10283 1 444 . 1 1 43 43 LYS HA H 1 4.155 0.030 . 1 . . . . 43 LYS HA . 10283 1 445 . 1 1 43 43 LYS HB2 H 1 1.874 0.030 . 2 . . . . 43 LYS HB2 . 10283 1 446 . 1 1 43 43 LYS HB3 H 1 1.826 0.030 . 2 . . . . 43 LYS HB3 . 10283 1 447 . 1 1 43 43 LYS HD2 H 1 1.676 0.030 . 2 . . . . 43 LYS HD2 . 10283 1 448 . 1 1 43 43 LYS HD3 H 1 1.739 0.030 . 2 . . . . 43 LYS HD3 . 10283 1 449 . 1 1 43 43 LYS HE2 H 1 2.994 0.030 . 2 . . . . 43 LYS HE2 . 10283 1 450 . 1 1 43 43 LYS HG2 H 1 1.521 0.030 . 2 . . . . 43 LYS HG2 . 10283 1 451 . 1 1 43 43 LYS HG3 H 1 1.664 0.030 . 2 . . . . 43 LYS HG3 . 10283 1 452 . 1 1 43 43 LYS C C 13 178.105 0.300 . 1 . . . . 43 LYS C . 10283 1 453 . 1 1 43 43 LYS CA C 13 58.580 0.300 . 1 . . . . 43 LYS CA . 10283 1 454 . 1 1 43 43 LYS CB C 13 33.893 0.300 . 1 . . . . 43 LYS CB . 10283 1 455 . 1 1 43 43 LYS CD C 13 29.279 0.300 . 1 . . . . 43 LYS CD . 10283 1 456 . 1 1 43 43 LYS CE C 13 42.296 0.300 . 1 . . . . 43 LYS CE . 10283 1 457 . 1 1 43 43 LYS CG C 13 25.693 0.300 . 1 . . . . 43 LYS CG . 10283 1 458 . 1 1 43 43 LYS N N 15 116.586 0.300 . 1 . . . . 43 LYS N . 10283 1 459 . 1 1 44 44 SER H H 1 8.314 0.030 . 1 . . . . 44 SER H . 10283 1 460 . 1 1 44 44 SER HA H 1 4.486 0.030 . 1 . . . . 44 SER HA . 10283 1 461 . 1 1 44 44 SER HB2 H 1 3.790 0.030 . 1 . . . . 44 SER HB2 . 10283 1 462 . 1 1 44 44 SER HB3 H 1 3.790 0.030 . 1 . . . . 44 SER HB3 . 10283 1 463 . 1 1 44 44 SER C C 13 175.458 0.300 . 1 . . . . 44 SER C . 10283 1 464 . 1 1 44 44 SER CA C 13 59.955 0.300 . 1 . . . . 44 SER CA . 10283 1 465 . 1 1 44 44 SER CB C 13 66.025 0.300 . 1 . . . . 44 SER CB . 10283 1 466 . 1 1 44 44 SER N N 15 111.140 0.300 . 1 . . . . 44 SER N . 10283 1 467 . 1 1 45 45 GLY H H 1 8.249 0.030 . 1 . . . . 45 GLY H . 10283 1 468 . 1 1 45 45 GLY HA2 H 1 3.872 0.030 . 2 . . . . 45 GLY HA2 . 10283 1 469 . 1 1 45 45 GLY HA3 H 1 4.233 0.030 . 2 . . . . 45 GLY HA3 . 10283 1 470 . 1 1 45 45 GLY C C 13 174.317 0.300 . 1 . . . . 45 GLY C . 10283 1 471 . 1 1 45 45 GLY CA C 13 45.889 0.300 . 1 . . . . 45 GLY CA . 10283 1 472 . 1 1 45 45 GLY N N 15 112.770 0.300 . 1 . . . . 45 GLY N . 10283 1 473 . 1 1 46 46 LEU H H 1 7.800 0.030 . 1 . . . . 46 LEU H . 10283 1 474 . 1 1 46 46 LEU HA H 1 4.685 0.030 . 1 . . . . 46 LEU HA . 10283 1 475 . 1 1 46 46 LEU HB2 H 1 1.087 0.030 . 2 . . . . 46 LEU HB2 . 10283 1 476 . 1 1 46 46 LEU HB3 H 1 1.631 0.030 . 2 . . . . 46 LEU HB3 . 10283 1 477 . 1 1 46 46 LEU HD11 H 1 0.685 0.030 . 1 . . . . 46 LEU HD1 . 10283 1 478 . 1 1 46 46 LEU HD12 H 1 0.685 0.030 . 1 . . . . 46 LEU HD1 . 10283 1 479 . 1 1 46 46 LEU HD13 H 1 0.685 0.030 . 1 . . . . 46 LEU HD1 . 10283 1 480 . 1 1 46 46 LEU HD21 H 1 0.911 0.030 . 1 . . . . 46 LEU HD2 . 10283 1 481 . 1 1 46 46 LEU HD22 H 1 0.911 0.030 . 1 . . . . 46 LEU HD2 . 10283 1 482 . 1 1 46 46 LEU HD23 H 1 0.911 0.030 . 1 . . . . 46 LEU HD2 . 10283 1 483 . 1 1 46 46 LEU HG H 1 1.423 0.030 . 1 . . . . 46 LEU HG . 10283 1 484 . 1 1 46 46 LEU C C 13 174.366 0.300 . 1 . . . . 46 LEU C . 10283 1 485 . 1 1 46 46 LEU CA C 13 52.235 0.300 . 1 . . . . 46 LEU CA . 10283 1 486 . 1 1 46 46 LEU CB C 13 43.285 0.300 . 1 . . . . 46 LEU CB . 10283 1 487 . 1 1 46 46 LEU CD1 C 13 26.235 0.300 . 2 . . . . 46 LEU CD1 . 10283 1 488 . 1 1 46 46 LEU CD2 C 13 23.672 0.300 . 2 . . . . 46 LEU CD2 . 10283 1 489 . 1 1 46 46 LEU CG C 13 26.914 0.300 . 1 . . . . 46 LEU CG . 10283 1 490 . 1 1 46 46 LEU N N 15 121.722 0.300 . 1 . . . . 46 LEU N . 10283 1 491 . 1 1 47 47 PRO HA H 1 4.542 0.030 . 1 . . . . 47 PRO HA . 10283 1 492 . 1 1 47 47 PRO HB2 H 1 2.600 0.030 . 2 . . . . 47 PRO HB2 . 10283 1 493 . 1 1 47 47 PRO HB3 H 1 1.759 0.030 . 2 . . . . 47 PRO HB3 . 10283 1 494 . 1 1 47 47 PRO HD2 H 1 3.322 0.030 . 2 . . . . 47 PRO HD2 . 10283 1 495 . 1 1 47 47 PRO HD3 H 1 4.074 0.030 . 2 . . . . 47 PRO HD3 . 10283 1 496 . 1 1 47 47 PRO HG2 H 1 2.145 0.030 . 2 . . . . 47 PRO HG2 . 10283 1 497 . 1 1 47 47 PRO C C 13 178.542 0.300 . 1 . . . . 47 PRO C . 10283 1 498 . 1 1 47 47 PRO CA C 13 62.000 0.300 . 1 . . . . 47 PRO CA . 10283 1 499 . 1 1 47 47 PRO CB C 13 32.731 0.300 . 1 . . . . 47 PRO CB . 10283 1 500 . 1 1 47 47 PRO CD C 13 50.482 0.300 . 1 . . . . 47 PRO CD . 10283 1 501 . 1 1 47 47 PRO CG C 13 28.043 0.300 . 1 . . . . 47 PRO CG . 10283 1 502 . 1 1 48 48 GLN H H 1 9.124 0.030 . 1 . . . . 48 GLN H . 10283 1 503 . 1 1 48 48 GLN HA H 1 3.629 0.030 . 1 . . . . 48 GLN HA . 10283 1 504 . 1 1 48 48 GLN HB2 H 1 2.030 0.030 . 2 . . . . 48 GLN HB2 . 10283 1 505 . 1 1 48 48 GLN HB3 H 1 1.970 0.030 . 2 . . . . 48 GLN HB3 . 10283 1 506 . 1 1 48 48 GLN HE21 H 1 6.989 0.030 . 2 . . . . 48 GLN HE21 . 10283 1 507 . 1 1 48 48 GLN HE22 H 1 7.674 0.030 . 2 . . . . 48 GLN HE22 . 10283 1 508 . 1 1 48 48 GLN HG2 H 1 2.497 0.030 . 2 . . . . 48 GLN HG2 . 10283 1 509 . 1 1 48 48 GLN HG3 H 1 2.101 0.030 . 2 . . . . 48 GLN HG3 . 10283 1 510 . 1 1 48 48 GLN C C 13 178.080 0.300 . 1 . . . . 48 GLN C . 10283 1 511 . 1 1 48 48 GLN CA C 13 60.872 0.300 . 1 . . . . 48 GLN CA . 10283 1 512 . 1 1 48 48 GLN CB C 13 28.455 0.300 . 1 . . . . 48 GLN CB . 10283 1 513 . 1 1 48 48 GLN CG C 13 35.128 0.300 . 1 . . . . 48 GLN CG . 10283 1 514 . 1 1 48 48 GLN N N 15 123.862 0.300 . 1 . . . . 48 GLN N . 10283 1 515 . 1 1 48 48 GLN NE2 N 15 111.582 0.300 . 1 . . . . 48 GLN NE2 . 10283 1 516 . 1 1 49 49 LYS H H 1 8.912 0.030 . 1 . . . . 49 LYS H . 10283 1 517 . 1 1 49 49 LYS HA H 1 3.969 0.030 . 1 . . . . 49 LYS HA . 10283 1 518 . 1 1 49 49 LYS HB2 H 1 1.753 0.030 . 2 . . . . 49 LYS HB2 . 10283 1 519 . 1 1 49 49 LYS HB3 H 1 1.889 0.030 . 2 . . . . 49 LYS HB3 . 10283 1 520 . 1 1 49 49 LYS HD2 H 1 1.690 0.030 . 2 . . . . 49 LYS HD2 . 10283 1 521 . 1 1 49 49 LYS HE2 H 1 2.957 0.030 . 2 . . . . 49 LYS HE2 . 10283 1 522 . 1 1 49 49 LYS HG2 H 1 1.466 0.030 . 2 . . . . 49 LYS HG2 . 10283 1 523 . 1 1 49 49 LYS HG3 H 1 1.379 0.030 . 2 . . . . 49 LYS HG3 . 10283 1 524 . 1 1 49 49 LYS C C 13 178.954 0.300 . 1 . . . . 49 LYS C . 10283 1 525 . 1 1 49 49 LYS CA C 13 59.955 0.300 . 1 . . . . 49 LYS CA . 10283 1 526 . 1 1 49 49 LYS CB C 13 32.327 0.300 . 1 . . . . 49 LYS CB . 10283 1 527 . 1 1 49 49 LYS CD C 13 29.534 0.300 . 1 . . . . 49 LYS CD . 10283 1 528 . 1 1 49 49 LYS CE C 13 42.049 0.300 . 1 . . . . 49 LYS CE . 10283 1 529 . 1 1 49 49 LYS CG C 13 25.241 0.300 . 1 . . . . 49 LYS CG . 10283 1 530 . 1 1 49 49 LYS N N 15 116.406 0.300 . 1 . . . . 49 LYS N . 10283 1 531 . 1 1 50 50 VAL H H 1 6.874 0.030 . 1 . . . . 50 VAL H . 10283 1 532 . 1 1 50 50 VAL HA H 1 3.835 0.030 . 1 . . . . 50 VAL HA . 10283 1 533 . 1 1 50 50 VAL HB H 1 2.211 0.030 . 1 . . . . 50 VAL HB . 10283 1 534 . 1 1 50 50 VAL HG11 H 1 1.012 0.030 . 1 . . . . 50 VAL HG1 . 10283 1 535 . 1 1 50 50 VAL HG12 H 1 1.012 0.030 . 1 . . . . 50 VAL HG1 . 10283 1 536 . 1 1 50 50 VAL HG13 H 1 1.012 0.030 . 1 . . . . 50 VAL HG1 . 10283 1 537 . 1 1 50 50 VAL HG21 H 1 1.101 0.030 . 1 . . . . 50 VAL HG2 . 10283 1 538 . 1 1 50 50 VAL HG22 H 1 1.101 0.030 . 1 . . . . 50 VAL HG2 . 10283 1 539 . 1 1 50 50 VAL HG23 H 1 1.101 0.030 . 1 . . . . 50 VAL HG2 . 10283 1 540 . 1 1 50 50 VAL C C 13 178.299 0.300 . 1 . . . . 50 VAL C . 10283 1 541 . 1 1 50 50 VAL CA C 13 65.560 0.300 . 1 . . . . 50 VAL CA . 10283 1 542 . 1 1 50 50 VAL CB C 13 32.080 0.300 . 1 . . . . 50 VAL CB . 10283 1 543 . 1 1 50 50 VAL CG1 C 13 21.253 0.300 . 2 . . . . 50 VAL CG1 . 10283 1 544 . 1 1 50 50 VAL CG2 C 13 22.873 0.300 . 2 . . . . 50 VAL CG2 . 10283 1 545 . 1 1 50 50 VAL N N 15 119.065 0.300 . 1 . . . . 50 VAL N . 10283 1 546 . 1 1 51 51 ILE H H 1 7.503 0.030 . 1 . . . . 51 ILE H . 10283 1 547 . 1 1 51 51 ILE HA H 1 3.672 0.030 . 1 . . . . 51 ILE HA . 10283 1 548 . 1 1 51 51 ILE HB H 1 1.959 0.030 . 1 . . . . 51 ILE HB . 10283 1 549 . 1 1 51 51 ILE HD11 H 1 0.694 0.030 . 1 . . . . 51 ILE HD1 . 10283 1 550 . 1 1 51 51 ILE HD12 H 1 0.694 0.030 . 1 . . . . 51 ILE HD1 . 10283 1 551 . 1 1 51 51 ILE HD13 H 1 0.694 0.030 . 1 . . . . 51 ILE HD1 . 10283 1 552 . 1 1 51 51 ILE HG12 H 1 0.847 0.030 . 2 . . . . 51 ILE HG12 . 10283 1 553 . 1 1 51 51 ILE HG13 H 1 1.636 0.030 . 2 . . . . 51 ILE HG13 . 10283 1 554 . 1 1 51 51 ILE HG21 H 1 1.102 0.030 . 1 . . . . 51 ILE HG2 . 10283 1 555 . 1 1 51 51 ILE HG22 H 1 1.102 0.030 . 1 . . . . 51 ILE HG2 . 10283 1 556 . 1 1 51 51 ILE HG23 H 1 1.102 0.030 . 1 . . . . 51 ILE HG2 . 10283 1 557 . 1 1 51 51 ILE C C 13 178.007 0.300 . 1 . . . . 51 ILE C . 10283 1 558 . 1 1 51 51 ILE CA C 13 66.019 0.300 . 1 . . . . 51 ILE CA . 10283 1 559 . 1 1 51 51 ILE CB C 13 38.081 0.300 . 1 . . . . 51 ILE CB . 10283 1 560 . 1 1 51 51 ILE CD1 C 13 13.437 0.300 . 1 . . . . 51 ILE CD1 . 10283 1 561 . 1 1 51 51 ILE CG1 C 13 29.031 0.300 . 1 . . . . 51 ILE CG1 . 10283 1 562 . 1 1 51 51 ILE CG2 C 13 19.227 0.300 . 1 . . . . 51 ILE CG2 . 10283 1 563 . 1 1 51 51 ILE N N 15 121.254 0.300 . 1 . . . . 51 ILE N . 10283 1 564 . 1 1 52 52 LYS H H 1 8.596 0.030 . 1 . . . . 52 LYS H . 10283 1 565 . 1 1 52 52 LYS HA H 1 3.984 0.030 . 1 . . . . 52 LYS HA . 10283 1 566 . 1 1 52 52 LYS HB2 H 1 1.937 0.030 . 2 . . . . 52 LYS HB2 . 10283 1 567 . 1 1 52 52 LYS HB3 H 1 1.869 0.030 . 2 . . . . 52 LYS HB3 . 10283 1 568 . 1 1 52 52 LYS HD2 H 1 1.679 0.030 . 2 . . . . 52 LYS HD2 . 10283 1 569 . 1 1 52 52 LYS HE2 H 1 2.901 0.030 . 2 . . . . 52 LYS HE2 . 10283 1 570 . 1 1 52 52 LYS HG2 H 1 1.403 0.030 . 2 . . . . 52 LYS HG2 . 10283 1 571 . 1 1 52 52 LYS HG3 H 1 1.587 0.030 . 2 . . . . 52 LYS HG3 . 10283 1 572 . 1 1 52 52 LYS C C 13 179.302 0.300 . 1 . . . . 52 LYS C . 10283 1 573 . 1 1 52 52 LYS CA C 13 60.978 0.300 . 1 . . . . 52 LYS CA . 10283 1 574 . 1 1 52 52 LYS CB C 13 32.574 0.300 . 1 . . . . 52 LYS CB . 10283 1 575 . 1 1 52 52 LYS CD C 13 29.728 0.300 . 1 . . . . 52 LYS CD . 10283 1 576 . 1 1 52 52 LYS CE C 13 42.049 0.300 . 1 . . . . 52 LYS CE . 10283 1 577 . 1 1 52 52 LYS CG C 13 26.455 0.300 . 1 . . . . 52 LYS CG . 10283 1 578 . 1 1 52 52 LYS N N 15 118.531 0.300 . 1 . . . . 52 LYS N . 10283 1 579 . 1 1 53 53 HIS H H 1 7.952 0.030 . 1 . . . . 53 HIS H . 10283 1 580 . 1 1 53 53 HIS HA H 1 4.324 0.030 . 1 . . . . 53 HIS HA . 10283 1 581 . 1 1 53 53 HIS HB2 H 1 3.285 0.030 . 1 . . . . 53 HIS HB2 . 10283 1 582 . 1 1 53 53 HIS HB3 H 1 3.285 0.030 . 1 . . . . 53 HIS HB3 . 10283 1 583 . 1 1 53 53 HIS HD2 H 1 7.027 0.030 . 1 . . . . 53 HIS HD2 . 10283 1 584 . 1 1 53 53 HIS HE1 H 1 7.702 0.030 . 1 . . . . 53 HIS HE1 . 10283 1 585 . 1 1 53 53 HIS C C 13 177.085 0.300 . 1 . . . . 53 HIS C . 10283 1 586 . 1 1 53 53 HIS CA C 13 60.026 0.300 . 1 . . . . 53 HIS CA . 10283 1 587 . 1 1 53 53 HIS CB C 13 30.867 0.300 . 1 . . . . 53 HIS CB . 10283 1 588 . 1 1 53 53 HIS CD2 C 13 119.335 0.300 . 1 . . . . 53 HIS CD2 . 10283 1 589 . 1 1 53 53 HIS CE1 C 13 138.458 0.300 . 1 . . . . 53 HIS CE1 . 10283 1 590 . 1 1 53 53 HIS N N 15 118.728 0.300 . 1 . . . . 53 HIS N . 10283 1 591 . 1 1 54 54 TRP H H 1 8.614 0.030 . 1 . . . . 54 TRP H . 10283 1 592 . 1 1 54 54 TRP HA H 1 4.048 0.030 . 1 . . . . 54 TRP HA . 10283 1 593 . 1 1 54 54 TRP HB2 H 1 3.556 0.030 . 2 . . . . 54 TRP HB2 . 10283 1 594 . 1 1 54 54 TRP HB3 H 1 3.267 0.030 . 2 . . . . 54 TRP HB3 . 10283 1 595 . 1 1 54 54 TRP HD1 H 1 7.099 0.030 . 1 . . . . 54 TRP HD1 . 10283 1 596 . 1 1 54 54 TRP HE1 H 1 9.600 0.030 . 1 . . . . 54 TRP HE1 . 10283 1 597 . 1 1 54 54 TRP HE3 H 1 6.860 0.030 . 1 . . . . 54 TRP HE3 . 10283 1 598 . 1 1 54 54 TRP HH2 H 1 6.318 0.030 . 1 . . . . 54 TRP HH2 . 10283 1 599 . 1 1 54 54 TRP HZ2 H 1 7.042 0.030 . 1 . . . . 54 TRP HZ2 . 10283 1 600 . 1 1 54 54 TRP HZ3 H 1 5.867 0.030 . 1 . . . . 54 TRP HZ3 . 10283 1 601 . 1 1 54 54 TRP C C 13 180.144 0.300 . 1 . . . . 54 TRP C . 10283 1 602 . 1 1 54 54 TRP CA C 13 62.916 0.300 . 1 . . . . 54 TRP CA . 10283 1 603 . 1 1 54 54 TRP CB C 13 28.766 0.300 . 1 . . . . 54 TRP CB . 10283 1 604 . 1 1 54 54 TRP CD1 C 13 126.682 0.300 . 1 . . . . 54 TRP CD1 . 10283 1 605 . 1 1 54 54 TRP CE3 C 13 120.280 0.300 . 1 . . . . 54 TRP CE3 . 10283 1 606 . 1 1 54 54 TRP CH2 C 13 122.570 0.300 . 1 . . . . 54 TRP CH2 . 10283 1 607 . 1 1 54 54 TRP CZ2 C 13 114.295 0.300 . 1 . . . . 54 TRP CZ2 . 10283 1 608 . 1 1 54 54 TRP CZ3 C 13 120.967 0.300 . 1 . . . . 54 TRP CZ3 . 10283 1 609 . 1 1 54 54 TRP N N 15 121.845 0.300 . 1 . . . . 54 TRP N . 10283 1 610 . 1 1 54 54 TRP NE1 N 15 128.914 0.300 . 1 . . . . 54 TRP NE1 . 10283 1 611 . 1 1 55 55 PHE H H 1 9.035 0.030 . 1 . . . . 55 PHE H . 10283 1 612 . 1 1 55 55 PHE HA H 1 3.786 0.030 . 1 . . . . 55 PHE HA . 10283 1 613 . 1 1 55 55 PHE HB2 H 1 3.313 0.030 . 2 . . . . 55 PHE HB2 . 10283 1 614 . 1 1 55 55 PHE HB3 H 1 3.362 0.030 . 2 . . . . 55 PHE HB3 . 10283 1 615 . 1 1 55 55 PHE HD1 H 1 7.823 0.030 . 1 . . . . 55 PHE HD1 . 10283 1 616 . 1 1 55 55 PHE HD2 H 1 7.823 0.030 . 1 . . . . 55 PHE HD2 . 10283 1 617 . 1 1 55 55 PHE HE1 H 1 7.630 0.030 . 1 . . . . 55 PHE HE1 . 10283 1 618 . 1 1 55 55 PHE HE2 H 1 7.630 0.030 . 1 . . . . 55 PHE HE2 . 10283 1 619 . 1 1 55 55 PHE HZ H 1 7.525 0.030 . 1 . . . . 55 PHE HZ . 10283 1 620 . 1 1 55 55 PHE C C 13 178.129 0.300 . 1 . . . . 55 PHE C . 10283 1 621 . 1 1 55 55 PHE CA C 13 63.617 0.300 . 1 . . . . 55 PHE CA . 10283 1 622 . 1 1 55 55 PHE CB C 13 39.260 0.300 . 1 . . . . 55 PHE CB . 10283 1 623 . 1 1 55 55 PHE CD1 C 13 132.128 0.300 . 1 . . . . 55 PHE CD1 . 10283 1 624 . 1 1 55 55 PHE CD2 C 13 132.128 0.300 . 1 . . . . 55 PHE CD2 . 10283 1 625 . 1 1 55 55 PHE CE1 C 13 132.128 0.300 . 1 . . . . 55 PHE CE1 . 10283 1 626 . 1 1 55 55 PHE CE2 C 13 132.128 0.300 . 1 . . . . 55 PHE CE2 . 10283 1 627 . 1 1 55 55 PHE CZ C 13 130.249 0.300 . 1 . . . . 55 PHE CZ . 10283 1 628 . 1 1 55 55 PHE N N 15 120.180 0.300 . 1 . . . . 55 PHE N . 10283 1 629 . 1 1 56 56 ARG H H 1 7.962 0.030 . 1 . . . . 56 ARG H . 10283 1 630 . 1 1 56 56 ARG HA H 1 4.095 0.030 . 1 . . . . 56 ARG HA . 10283 1 631 . 1 1 56 56 ARG HB2 H 1 1.957 0.030 . 2 . . . . 56 ARG HB2 . 10283 1 632 . 1 1 56 56 ARG HB3 H 1 1.909 0.030 . 2 . . . . 56 ARG HB3 . 10283 1 633 . 1 1 56 56 ARG HD2 H 1 3.182 0.030 . 2 . . . . 56 ARG HD2 . 10283 1 634 . 1 1 56 56 ARG HG2 H 1 1.768 0.030 . 2 . . . . 56 ARG HG2 . 10283 1 635 . 1 1 56 56 ARG HG3 H 1 1.592 0.030 . 2 . . . . 56 ARG HG3 . 10283 1 636 . 1 1 56 56 ARG C C 13 178.444 0.300 . 1 . . . . 56 ARG C . 10283 1 637 . 1 1 56 56 ARG CA C 13 59.356 0.300 . 1 . . . . 56 ARG CA . 10283 1 638 . 1 1 56 56 ARG CB C 13 30.087 0.300 . 1 . . . . 56 ARG CB . 10283 1 639 . 1 1 56 56 ARG CD C 13 43.437 0.300 . 1 . . . . 56 ARG CD . 10283 1 640 . 1 1 56 56 ARG CG C 13 27.209 0.300 . 1 . . . . 56 ARG CG . 10283 1 641 . 1 1 56 56 ARG N N 15 118.370 0.300 . 1 . . . . 56 ARG N . 10283 1 642 . 1 1 57 57 ASN H H 1 8.194 0.030 . 1 . . . . 57 ASN H . 10283 1 643 . 1 1 57 57 ASN HA H 1 4.401 0.030 . 1 . . . . 57 ASN HA . 10283 1 644 . 1 1 57 57 ASN HB2 H 1 2.503 0.030 . 2 . . . . 57 ASN HB2 . 10283 1 645 . 1 1 57 57 ASN HB3 H 1 2.465 0.030 . 2 . . . . 57 ASN HB3 . 10283 1 646 . 1 1 57 57 ASN HD21 H 1 7.357 0.030 . 2 . . . . 57 ASN HD21 . 10283 1 647 . 1 1 57 57 ASN HD22 H 1 6.633 0.030 . 2 . . . . 57 ASN HD22 . 10283 1 648 . 1 1 57 57 ASN C C 13 176.866 0.300 . 1 . . . . 57 ASN C . 10283 1 649 . 1 1 57 57 ASN CA C 13 55.497 0.300 . 1 . . . . 57 ASN CA . 10283 1 650 . 1 1 57 57 ASN CB C 13 38.640 0.300 . 1 . . . . 57 ASN CB . 10283 1 651 . 1 1 57 57 ASN N N 15 117.190 0.300 . 1 . . . . 57 ASN N . 10283 1 652 . 1 1 57 57 ASN ND2 N 15 112.666 0.300 . 1 . . . . 57 ASN ND2 . 10283 1 653 . 1 1 58 58 THR H H 1 7.999 0.030 . 1 . . . . 58 THR H . 10283 1 654 . 1 1 58 58 THR HA H 1 3.426 0.030 . 1 . . . . 58 THR HA . 10283 1 655 . 1 1 58 58 THR HB H 1 2.984 0.030 . 1 . . . . 58 THR HB . 10283 1 656 . 1 1 58 58 THR HG21 H 1 0.040 0.030 . 1 . . . . 58 THR HG2 . 10283 1 657 . 1 1 58 58 THR HG22 H 1 0.040 0.030 . 1 . . . . 58 THR HG2 . 10283 1 658 . 1 1 58 58 THR HG23 H 1 0.040 0.030 . 1 . . . . 58 THR HG2 . 10283 1 659 . 1 1 58 58 THR C C 13 175.361 0.300 . 1 . . . . 58 THR C . 10283 1 660 . 1 1 58 58 THR CA C 13 65.801 0.300 . 1 . . . . 58 THR CA . 10283 1 661 . 1 1 58 58 THR CB C 13 68.064 0.300 . 1 . . . . 58 THR CB . 10283 1 662 . 1 1 58 58 THR CG2 C 13 20.428 0.300 . 1 . . . . 58 THR CG2 . 10283 1 663 . 1 1 58 58 THR N N 15 117.859 0.300 . 1 . . . . 58 THR N . 10283 1 664 . 1 1 59 59 LEU H H 1 7.950 0.030 . 1 . . . . 59 LEU H . 10283 1 665 . 1 1 59 59 LEU HA H 1 4.127 0.030 . 1 . . . . 59 LEU HA . 10283 1 666 . 1 1 59 59 LEU HB2 H 1 1.689 0.030 . 1 . . . . 59 LEU HB2 . 10283 1 667 . 1 1 59 59 LEU HD11 H 1 0.943 0.030 . 1 . . . . 59 LEU HD1 . 10283 1 668 . 1 1 59 59 LEU HD12 H 1 0.943 0.030 . 1 . . . . 59 LEU HD1 . 10283 1 669 . 1 1 59 59 LEU HD13 H 1 0.943 0.030 . 1 . . . . 59 LEU HD1 . 10283 1 670 . 1 1 59 59 LEU HD21 H 1 0.866 0.030 . 1 . . . . 59 LEU HD2 . 10283 1 671 . 1 1 59 59 LEU HD22 H 1 0.866 0.030 . 1 . . . . 59 LEU HD2 . 10283 1 672 . 1 1 59 59 LEU HD23 H 1 0.866 0.030 . 1 . . . . 59 LEU HD2 . 10283 1 673 . 1 1 59 59 LEU HG H 1 1.553 0.030 . 1 . . . . 59 LEU HG . 10283 1 674 . 1 1 59 59 LEU C C 13 177.886 0.300 . 1 . . . . 59 LEU C . 10283 1 675 . 1 1 59 59 LEU CA C 13 57.628 0.300 . 1 . . . . 59 LEU CA . 10283 1 676 . 1 1 59 59 LEU CB C 13 42.296 0.300 . 1 . . . . 59 LEU CB . 10283 1 677 . 1 1 59 59 LEU CD1 C 13 24.461 0.300 . 2 . . . . 59 LEU CD1 . 10283 1 678 . 1 1 59 59 LEU CD2 C 13 24.791 0.300 . 2 . . . . 59 LEU CD2 . 10283 1 679 . 1 1 59 59 LEU CG C 13 27.136 0.300 . 1 . . . . 59 LEU CG . 10283 1 680 . 1 1 59 59 LEU N N 15 122.280 0.300 . 1 . . . . 59 LEU N . 10283 1 681 . 1 1 60 60 PHE H H 1 7.797 0.030 . 1 . . . . 60 PHE H . 10283 1 682 . 1 1 60 60 PHE HA H 1 4.309 0.030 . 1 . . . . 60 PHE HA . 10283 1 683 . 1 1 60 60 PHE HB2 H 1 3.122 0.030 . 1 . . . . 60 PHE HB2 . 10283 1 684 . 1 1 60 60 PHE HB3 H 1 3.122 0.030 . 1 . . . . 60 PHE HB3 . 10283 1 685 . 1 1 60 60 PHE HD1 H 1 7.200 0.030 . 1 . . . . 60 PHE HD1 . 10283 1 686 . 1 1 60 60 PHE HD2 H 1 7.200 0.030 . 1 . . . . 60 PHE HD2 . 10283 1 687 . 1 1 60 60 PHE HE1 H 1 7.279 0.030 . 1 . . . . 60 PHE HE1 . 10283 1 688 . 1 1 60 60 PHE HE2 H 1 7.279 0.030 . 1 . . . . 60 PHE HE2 . 10283 1 689 . 1 1 60 60 PHE HZ H 1 7.225 0.030 . 1 . . . . 60 PHE HZ . 10283 1 690 . 1 1 60 60 PHE C C 13 177.085 0.300 . 1 . . . . 60 PHE C . 10283 1 691 . 1 1 60 60 PHE CA C 13 59.920 0.300 . 1 . . . . 60 PHE CA . 10283 1 692 . 1 1 60 60 PHE CB C 13 38.918 0.300 . 1 . . . . 60 PHE CB . 10283 1 693 . 1 1 60 60 PHE CD1 C 13 131.616 0.300 . 1 . . . . 60 PHE CD1 . 10283 1 694 . 1 1 60 60 PHE CD2 C 13 131.616 0.300 . 1 . . . . 60 PHE CD2 . 10283 1 695 . 1 1 60 60 PHE CE1 C 13 131.419 0.300 . 1 . . . . 60 PHE CE1 . 10283 1 696 . 1 1 60 60 PHE CE2 C 13 131.419 0.300 . 1 . . . . 60 PHE CE2 . 10283 1 697 . 1 1 60 60 PHE CZ C 13 129.804 0.300 . 1 . . . . 60 PHE CZ . 10283 1 698 . 1 1 60 60 PHE N N 15 118.008 0.300 . 1 . . . . 60 PHE N . 10283 1 699 . 1 1 61 61 LYS H H 1 7.839 0.030 . 1 . . . . 61 LYS H . 10283 1 700 . 1 1 61 61 LYS HA H 1 4.007 0.030 . 1 . . . . 61 LYS HA . 10283 1 701 . 1 1 61 61 LYS HB2 H 1 1.796 0.030 . 1 . . . . 61 LYS HB2 . 10283 1 702 . 1 1 61 61 LYS HB3 H 1 1.796 0.030 . 1 . . . . 61 LYS HB3 . 10283 1 703 . 1 1 61 61 LYS HD2 H 1 1.605 0.030 . 2 . . . . 61 LYS HD2 . 10283 1 704 . 1 1 61 61 LYS HE2 H 1 2.905 0.030 . 2 . . . . 61 LYS HE2 . 10283 1 705 . 1 1 61 61 LYS HG2 H 1 1.468 0.030 . 2 . . . . 61 LYS HG2 . 10283 1 706 . 1 1 61 61 LYS HG3 H 1 1.388 0.030 . 2 . . . . 61 LYS HG3 . 10283 1 707 . 1 1 61 61 LYS C C 13 178.032 0.300 . 1 . . . . 61 LYS C . 10283 1 708 . 1 1 61 61 LYS CA C 13 58.016 0.300 . 1 . . . . 61 LYS CA . 10283 1 709 . 1 1 61 61 LYS CB C 13 32.657 0.300 . 1 . . . . 61 LYS CB . 10283 1 710 . 1 1 61 61 LYS CD C 13 29.031 0.300 . 1 . . . . 61 LYS CD . 10283 1 711 . 1 1 61 61 LYS CE C 13 42.049 0.300 . 1 . . . . 61 LYS CE . 10283 1 712 . 1 1 61 61 LYS CG C 13 24.912 0.300 . 1 . . . . 61 LYS CG . 10283 1 713 . 1 1 61 61 LYS N N 15 119.447 0.300 . 1 . . . . 61 LYS N . 10283 1 714 . 1 1 62 62 GLU H H 1 8.139 0.030 . 1 . . . . 62 GLU H . 10283 1 715 . 1 1 62 62 GLU HA H 1 4.146 0.030 . 1 . . . . 62 GLU HA . 10283 1 716 . 1 1 62 62 GLU HB2 H 1 2.128 0.030 . 2 . . . . 62 GLU HB2 . 10283 1 717 . 1 1 62 62 GLU HB3 H 1 1.987 0.030 . 2 . . . . 62 GLU HB3 . 10283 1 718 . 1 1 62 62 GLU HG2 H 1 2.224 0.030 . 2 . . . . 62 GLU HG2 . 10283 1 719 . 1 1 62 62 GLU HG3 H 1 2.336 0.030 . 2 . . . . 62 GLU HG3 . 10283 1 720 . 1 1 62 62 GLU C C 13 177.595 0.300 . 1 . . . . 62 GLU C . 10283 1 721 . 1 1 62 62 GLU CA C 13 57.699 0.300 . 1 . . . . 62 GLU CA . 10283 1 722 . 1 1 62 62 GLU CB C 13 29.608 0.300 . 1 . . . . 62 GLU CB . 10283 1 723 . 1 1 62 62 GLU CG C 13 36.529 0.300 . 1 . . . . 62 GLU CG . 10283 1 724 . 1 1 62 62 GLU N N 15 119.302 0.300 . 1 . . . . 62 GLU N . 10283 1 725 . 1 1 63 63 ARG H H 1 8.015 0.030 . 1 . . . . 63 ARG H . 10283 1 726 . 1 1 63 63 ARG HA H 1 4.258 0.030 . 1 . . . . 63 ARG HA . 10283 1 727 . 1 1 63 63 ARG HB2 H 1 1.856 0.030 . 2 . . . . 63 ARG HB2 . 10283 1 728 . 1 1 63 63 ARG HB3 H 1 1.789 0.030 . 2 . . . . 63 ARG HB3 . 10283 1 729 . 1 1 63 63 ARG HD2 H 1 3.118 0.030 . 2 . . . . 63 ARG HD2 . 10283 1 730 . 1 1 63 63 ARG HG2 H 1 1.675 0.030 . 2 . . . . 63 ARG HG2 . 10283 1 731 . 1 1 63 63 ARG HG3 H 1 1.610 0.030 . 2 . . . . 63 ARG HG3 . 10283 1 732 . 1 1 63 63 ARG C C 13 176.769 0.300 . 1 . . . . 63 ARG C . 10283 1 733 . 1 1 63 63 ARG CA C 13 56.677 0.300 . 1 . . . . 63 ARG CA . 10283 1 734 . 1 1 63 63 ARG CB C 13 30.514 0.300 . 1 . . . . 63 ARG CB . 10283 1 735 . 1 1 63 63 ARG CD C 13 43.450 0.300 . 1 . . . . 63 ARG CD . 10283 1 736 . 1 1 63 63 ARG CG C 13 27.301 0.300 . 1 . . . . 63 ARG CG . 10283 1 737 . 1 1 63 63 ARG N N 15 119.598 0.300 . 1 . . . . 63 ARG N . 10283 1 738 . 1 1 64 64 GLN H H 1 8.058 0.030 . 1 . . . . 64 GLN H . 10283 1 739 . 1 1 64 64 GLN HA H 1 4.242 0.030 . 1 . . . . 64 GLN HA . 10283 1 740 . 1 1 64 64 GLN HB2 H 1 2.070 0.030 . 2 . . . . 64 GLN HB2 . 10283 1 741 . 1 1 64 64 GLN HB3 H 1 1.931 0.030 . 2 . . . . 64 GLN HB3 . 10283 1 742 . 1 1 64 64 GLN HE21 H 1 6.775 0.030 . 2 . . . . 64 GLN HE21 . 10283 1 743 . 1 1 64 64 GLN HE22 H 1 7.342 0.030 . 2 . . . . 64 GLN HE22 . 10283 1 744 . 1 1 64 64 GLN HG2 H 1 2.259 0.030 . 2 . . . . 64 GLN HG2 . 10283 1 745 . 1 1 64 64 GLN C C 13 176.114 0.300 . 1 . . . . 64 GLN C . 10283 1 746 . 1 1 64 64 GLN CA C 13 56.148 0.300 . 1 . . . . 64 GLN CA . 10283 1 747 . 1 1 64 64 GLN CB C 13 29.258 0.300 . 1 . . . . 64 GLN CB . 10283 1 748 . 1 1 64 64 GLN CG C 13 33.810 0.300 . 1 . . . . 64 GLN CG . 10283 1 749 . 1 1 64 64 GLN N N 15 120.027 0.300 . 1 . . . . 64 GLN N . 10283 1 750 . 1 1 64 64 GLN NE2 N 15 112.666 0.300 . 1 . . . . 64 GLN NE2 . 10283 1 751 . 1 1 65 65 SER H H 1 8.172 0.030 . 1 . . . . 65 SER H . 10283 1 752 . 1 1 65 65 SER HA H 1 4.457 0.030 . 1 . . . . 65 SER HA . 10283 1 753 . 1 1 65 65 SER HB2 H 1 3.846 0.030 . 1 . . . . 65 SER HB2 . 10283 1 754 . 1 1 65 65 SER HB3 H 1 3.846 0.030 . 1 . . . . 65 SER HB3 . 10283 1 755 . 1 1 65 65 SER C C 13 174.487 0.300 . 1 . . . . 65 SER C . 10283 1 756 . 1 1 65 65 SER CA C 13 58.404 0.300 . 1 . . . . 65 SER CA . 10283 1 757 . 1 1 65 65 SER CB C 13 63.965 0.300 . 1 . . . . 65 SER CB . 10283 1 758 . 1 1 65 65 SER N N 15 116.070 0.300 . 1 . . . . 65 SER N . 10283 1 759 . 1 1 66 66 GLY H H 1 8.170 0.030 . 1 . . . . 66 GLY H . 10283 1 760 . 1 1 66 66 GLY HA2 H 1 4.141 0.030 . 2 . . . . 66 GLY HA2 . 10283 1 761 . 1 1 66 66 GLY HA3 H 1 4.082 0.030 . 2 . . . . 66 GLY HA3 . 10283 1 762 . 1 1 66 66 GLY C C 13 171.768 0.300 . 1 . . . . 66 GLY C . 10283 1 763 . 1 1 66 66 GLY CA C 13 44.620 0.300 . 1 . . . . 66 GLY CA . 10283 1 764 . 1 1 66 66 GLY N N 15 110.579 0.300 . 1 . . . . 66 GLY N . 10283 1 765 . 1 1 67 67 PRO HA H 1 4.453 0.030 . 1 . . . . 67 PRO HA . 10283 1 766 . 1 1 67 67 PRO HB2 H 1 1.957 0.030 . 2 . . . . 67 PRO HB2 . 10283 1 767 . 1 1 67 67 PRO HB3 H 1 2.279 0.030 . 2 . . . . 67 PRO HB3 . 10283 1 768 . 1 1 67 67 PRO HD2 H 1 3.607 0.030 . 2 . . . . 67 PRO HD2 . 10283 1 769 . 1 1 67 67 PRO HG2 H 1 1.992 0.030 . 2 . . . . 67 PRO HG2 . 10283 1 770 . 1 1 67 67 PRO C C 13 177.400 0.300 . 1 . . . . 67 PRO C . 10283 1 771 . 1 1 67 67 PRO CA C 13 63.198 0.300 . 1 . . . . 67 PRO CA . 10283 1 772 . 1 1 67 67 PRO CB C 13 32.171 0.300 . 1 . . . . 67 PRO CB . 10283 1 773 . 1 1 67 67 PRO CD C 13 49.768 0.300 . 1 . . . . 67 PRO CD . 10283 1 774 . 1 1 67 67 PRO CG C 13 27.196 0.300 . 1 . . . . 67 PRO CG . 10283 1 775 . 1 1 68 68 SER H H 1 8.525 0.030 . 1 . . . . 68 SER H . 10283 1 776 . 1 1 68 68 SER HA H 1 4.490 0.030 . 1 . . . . 68 SER HA . 10283 1 777 . 1 1 68 68 SER HB2 H 1 3.879 0.030 . 1 . . . . 68 SER HB2 . 10283 1 778 . 1 1 68 68 SER HB3 H 1 3.879 0.030 . 1 . . . . 68 SER HB3 . 10283 1 779 . 1 1 68 68 SER C C 13 174.657 0.300 . 1 . . . . 68 SER C . 10283 1 780 . 1 1 68 68 SER CA C 13 58.589 0.300 . 1 . . . . 68 SER CA . 10283 1 781 . 1 1 68 68 SER CB C 13 63.800 0.300 . 1 . . . . 68 SER CB . 10283 1 782 . 1 1 68 68 SER N N 15 116.415 0.300 . 1 . . . . 68 SER N . 10283 1 783 . 1 1 69 69 SER H H 1 8.316 0.030 . 1 . . . . 69 SER H . 10283 1 784 . 1 1 69 69 SER HA H 1 4.467 0.030 . 1 . . . . 69 SER HA . 10283 1 785 . 1 1 69 69 SER HB2 H 1 3.867 0.030 . 1 . . . . 69 SER HB2 . 10283 1 786 . 1 1 69 69 SER HB3 H 1 3.867 0.030 . 1 . . . . 69 SER HB3 . 10283 1 787 . 1 1 69 69 SER C C 13 173.953 0.300 . 1 . . . . 69 SER C . 10283 1 788 . 1 1 69 69 SER CA C 13 58.369 0.300 . 1 . . . . 69 SER CA . 10283 1 789 . 1 1 69 69 SER CB C 13 64.047 0.300 . 1 . . . . 69 SER CB . 10283 1 790 . 1 1 69 69 SER N N 15 117.832 0.300 . 1 . . . . 69 SER N . 10283 1 791 . 1 1 70 70 GLY H H 1 8.045 0.030 . 1 . . . . 70 GLY H . 10283 1 792 . 1 1 70 70 GLY C C 13 179.003 0.300 . 1 . . . . 70 GLY C . 10283 1 793 . 1 1 70 70 GLY CA C 13 46.171 0.300 . 1 . . . . 70 GLY CA . 10283 1 794 . 1 1 70 70 GLY N N 15 116.844 0.300 . 1 . . . . 70 GLY N . 10283 1 stop_ save_