data_16323 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 16323 _Entry.Title ; SLBP RBD 30-mer peptide ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2009-05-28 _Entry.Accession_date 2009-05-28 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.13 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details '30 residue peptide from the SLBP RNA binding domain sequence' _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 Roopa Thapar . . . 16323 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 16323 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '1H chemical shifts' 169 16323 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2014-05-16 2009-05-28 update BMRB 'update entry citation' 16323 1 . . 2012-08-03 2009-05-28 original author 'original release' 16323 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 16323 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 22907757 _Citation.Full_citation . _Citation.Title 'The prolyl isomerase Pin1 targets stem-loop binding protein (SLBP) to dissociate the SLBP-histone mRNA complex linking histone mRNA decay with SLBP ubiquitination.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Mol. Cell. Biol.' _Citation.Journal_name_full 'Molecular and cellular biology' _Citation.Journal_volume 32 _Citation.Journal_issue 21 _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 4306 _Citation.Page_last 4322 _Citation.Year 2012 _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 Nithya Krishnan . . . 16323 1 2 Tukiet Lam . T. . 16323 1 3 Andrew Fritz . . . 16323 1 4 Donald Rempinski . . . 16323 1 5 Kieran Minderman . . . 16323 1 6 Hans Berezney . . . 16323 1 7 Ronald Marzluff . . . 16323 1 8 William Thapar . F. . 16323 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 16323 _Assembly.ID 1 _Assembly.Name SLBP30mer _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _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 SLBP30mer 1 $SLBP30mer A . yes native no no . . . 16323 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID 'Binds histone mRNAs' 16323 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_SLBP30mer _Entity.Sf_category entity _Entity.Sf_framecode SLBP30mer _Entity.Entry_ID 16323 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name SLBP30mer _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 ; ETDESVLMRRQKQINYGKNT IAYDRYIKEV ; _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 30 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 2KJM . "Solution Structure Of Slbp Rna Binding Domain Fragment" . . . . . 100.00 30 100.00 100.00 1.75e-11 . . . . 16323 1 2 no PDB 4L8R . "Structure Of Mrna Stem-loop, Human Stem-loop Binding Protein And 3'hexo Ternary Complex" . . . . . 100.00 120 100.00 100.00 2.34e-11 . . . . 16323 1 3 no PDB 4QOZ . "Crystal Structure Of The Histone Mrna Stem-loop, Stem-loop Binding Protein (phosphorylated), And 3'hexo Ternary Complex" . . . . . 100.00 120 100.00 100.00 2.34e-11 . . . . 16323 1 4 no DBJ BAE20786 . "unnamed protein product [Mus musculus]" . . . . . 100.00 250 100.00 100.00 4.68e-09 . . . . 16323 1 5 no DBJ BAE22851 . "unnamed protein product [Mus musculus]" . . . . . 93.33 195 100.00 100.00 3.82e-10 . . . . 16323 1 6 no DBJ BAE32343 . "unnamed protein product [Mus musculus]" . . . . . 100.00 275 100.00 100.00 3.04e-09 . . . . 16323 1 7 no DBJ BAE36737 . "unnamed protein product [Mus musculus]" . . . . . 100.00 275 100.00 100.00 3.04e-09 . . . . 16323 1 8 no DBJ BAG38003 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 270 100.00 100.00 1.39e-09 . . . . 16323 1 9 no EMBL CAA94918 . "histone RNA hairpin-binding protein [Homo sapiens]" . . . . . 100.00 270 100.00 100.00 1.39e-09 . . . . 16323 1 10 no GB AAB97091 . "histone stem-loop binding protein [Homo sapiens]" . . . . . 100.00 270 100.00 100.00 1.39e-09 . . . . 16323 1 11 no GB AAC53530 . "histone stem-loop binding protein [Mus musculus]" . . . . . 100.00 275 100.00 100.00 3.04e-09 . . . . 16323 1 12 no GB AAH14908 . "Stem-loop binding protein [Homo sapiens]" . . . . . 100.00 270 100.00 100.00 1.39e-09 . . . . 16323 1 13 no GB AAH15703 . "Stem-loop binding protein [Homo sapiens]" . . . . . 100.00 270 100.00 100.00 1.39e-09 . . . . 16323 1 14 no GB AAH29631 . "Slbp protein [Mus musculus]" . . . . . 100.00 255 100.00 100.00 1.14e-09 . . . . 16323 1 15 no REF NP_001039345 . "histone RNA hairpin-binding protein [Bos taurus]" . . . . . 100.00 271 100.00 100.00 8.52e-10 . . . . 16323 1 16 no REF NP_001231786 . "histone RNA hairpin-binding protein [Sus scrofa]" . . . . . 100.00 275 100.00 100.00 8.30e-11 . . . . 16323 1 17 no REF NP_001233401 . "histone RNA hairpin-binding protein [Pan troglodytes]" . . . . . 100.00 270 100.00 100.00 2.47e-09 . . . . 16323 1 18 no REF NP_001276653 . "histone RNA hairpin-binding protein isoform 2 [Mus musculus]" . . . . . 100.00 255 100.00 100.00 1.14e-09 . . . . 16323 1 19 no REF NP_001276654 . "histone RNA hairpin-binding protein isoform 3 [Mus musculus]" . . . . . 100.00 240 100.00 100.00 1.92e-09 . . . . 16323 1 20 no SP P97440 . "RecName: Full=Histone RNA hairpin-binding protein; AltName: Full=Histone stem-loop-binding protein" . . . . . 100.00 275 100.00 100.00 3.04e-09 . . . . 16323 1 21 no SP Q14493 . "RecName: Full=Histone RNA hairpin-binding protein; AltName: Full=Histone stem-loop-binding protein" . . . . . 100.00 270 100.00 100.00 1.39e-09 . . . . 16323 1 22 no TPG DAA28416 . "TPA: histone stem loop binding protein [Bos taurus]" . . . . . 100.00 272 100.00 100.00 8.19e-10 . . . . 16323 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'RNA binding protein' 16323 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 . GLU . 16323 1 2 . THR . 16323 1 3 . ASP . 16323 1 4 . GLU . 16323 1 5 . SER . 16323 1 6 . VAL . 16323 1 7 . LEU . 16323 1 8 . MET . 16323 1 9 . ARG . 16323 1 10 . ARG . 16323 1 11 . GLN . 16323 1 12 . LYS . 16323 1 13 . GLN . 16323 1 14 . ILE . 16323 1 15 . ASN . 16323 1 16 . TYR . 16323 1 17 . GLY . 16323 1 18 . LYS . 16323 1 19 . ASN . 16323 1 20 . THR . 16323 1 21 . ILE . 16323 1 22 . ALA . 16323 1 23 . TYR . 16323 1 24 . ASP . 16323 1 25 . ARG . 16323 1 26 . TYR . 16323 1 27 . ILE . 16323 1 28 . LYS . 16323 1 29 . GLU . 16323 1 30 . VAL . 16323 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 . GLU 1 1 16323 1 . THR 2 2 16323 1 . ASP 3 3 16323 1 . GLU 4 4 16323 1 . SER 5 5 16323 1 . VAL 6 6 16323 1 . LEU 7 7 16323 1 . MET 8 8 16323 1 . ARG 9 9 16323 1 . ARG 10 10 16323 1 . GLN 11 11 16323 1 . LYS 12 12 16323 1 . GLN 13 13 16323 1 . ILE 14 14 16323 1 . ASN 15 15 16323 1 . TYR 16 16 16323 1 . GLY 17 17 16323 1 . LYS 18 18 16323 1 . ASN 19 19 16323 1 . THR 20 20 16323 1 . ILE 21 21 16323 1 . ALA 22 22 16323 1 . TYR 23 23 16323 1 . ASP 24 24 16323 1 . ARG 25 25 16323 1 . TYR 26 26 16323 1 . ILE 27 27 16323 1 . LYS 28 28 16323 1 . GLU 29 29 16323 1 . VAL 30 30 16323 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 16323 _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 $SLBP30mer . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 16323 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 16323 _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 $SLBP30mer . 'chemical synthesis' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 16323 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 16323 _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 SLBP30mer 'natural abundance' . . 1 $SLBP30mer . . . 1 7 mM . . . . 16323 1 2 H2O 'natural abundance' . . . . . . 90 . . % . . . . 16323 1 3 D2O 'natural abundance' . . . . . . 10 . . % . . . . 16323 1 4 NaCl 'natural abundance' . . . . . . 50 . . mM . . . . 16323 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 16323 _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' 0.050 . M 16323 1 pH 5 . pH 16323 1 pressure 1 . atm 16323 1 temperature 278 . K 16323 1 stop_ save_ ############################ # Computer software used # ############################ save_Felix _Software.Sf_category software _Software.Sf_framecode Felix _Software.Entry_ID 16323 _Software.ID 1 _Software.Name FELIX _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Accelrys Software Inc.' . . 16323 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 16323 1 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 16323 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 16323 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 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 16323 _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 Varian INOVA . 700 . . . 16323 1 2 spectrometer_2 Varian INOVA . 600 . . . 16323 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 16323 _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 '2D DQF-COSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16323 1 2 '2D 1H-1H NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16323 1 3 '2D 1H-1H TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16323 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 16323 _Chem_shift_reference.ID 1 _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.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 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 16323 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_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 16323 _Assigned_chem_shift_list.ID 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 $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D DQF-COSY' . . . 16323 1 2 '2D 1H-1H NOESY' . . . 16323 1 3 '2D 1H-1H TOCSY' . . . 16323 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 1 1 GLU H H 1 8.55 0.02 . 1 . . . . 1 GLU H . 16323 1 2 . 1 1 1 1 GLU HA H 1 4.48 0.02 . 1 . . . . 1 GLU HA . 16323 1 3 . 1 1 1 1 GLU HB2 H 1 2.64 0.02 . 1 . . . . 1 GLU HB2 . 16323 1 4 . 1 1 1 1 GLU HB3 H 1 2.64 0.02 . 1 . . . . 1 GLU HB3 . 16323 1 5 . 1 1 1 1 GLU HG2 H 1 2.69 0.02 . 1 . . . . 1 GLU HG2 . 16323 1 6 . 1 1 1 1 GLU HG3 H 1 2.69 0.02 . 1 . . . . 1 GLU HG3 . 16323 1 7 . 1 1 2 2 THR H H 1 8.71 0.02 . 1 . . . . 2 THR H . 16323 1 8 . 1 1 2 2 THR HA H 1 4.18 0.02 . 1 . . . . 2 THR HA . 16323 1 9 . 1 1 2 2 THR HB H 1 4.01 0.02 . 1 . . . . 2 THR HB . 16323 1 10 . 1 1 2 2 THR HG21 H 1 1.04 0.02 . 1 . . . . 2 THR HG1 . 16323 1 11 . 1 1 2 2 THR HG22 H 1 1.04 0.02 . 1 . . . . 2 THR HG1 . 16323 1 12 . 1 1 2 2 THR HG23 H 1 1.04 0.02 . 1 . . . . 2 THR HG1 . 16323 1 13 . 1 1 3 3 ASP H H 1 8.62 0.02 . 1 . . . . 3 ASP H . 16323 1 14 . 1 1 3 3 ASP HA H 1 4.48 0.02 . 1 . . . . 3 ASP HA . 16323 1 15 . 1 1 3 3 ASP HB2 H 1 2.69 0.02 . 1 . . . . 3 ASP HB2 . 16323 1 16 . 1 1 3 3 ASP HB3 H 1 2.64 0.02 . 1 . . . . 3 ASP HB3 . 16323 1 17 . 1 1 4 4 GLU H H 1 8.47 0.02 . 1 . . . . 4 GLU H . 16323 1 18 . 1 1 4 4 GLU HA H 1 4.11 0.02 . 1 . . . . 4 GLU HA . 16323 1 19 . 1 1 4 4 GLU HB2 H 1 1.92 0.02 . 1 . . . . 4 GLU HB2 . 16323 1 20 . 1 1 4 4 GLU HB3 H 1 1.82 0.02 . 1 . . . . 4 GLU HB3 . 16323 1 21 . 1 1 4 4 GLU HG2 H 1 2.30 0.02 . 1 . . . . 4 GLU HG2 . 16323 1 22 . 1 1 4 4 GLU HG3 H 1 2.30 0.02 . 1 . . . . 4 GLU HG3 . 16323 1 23 . 1 1 5 5 SER H H 1 8.27 0.02 . 1 . . . . 5 SER H . 16323 1 24 . 1 1 5 5 SER HA H 1 4.14 0.02 . 1 . . . . 5 SER HA . 16323 1 25 . 1 1 5 5 SER HB2 H 1 3.80 0.02 . 1 . . . . 5 SER HB2 . 16323 1 26 . 1 1 5 5 SER HB3 H 1 3.74 0.02 . 1 . . . . 5 SER HB3 . 16323 1 27 . 1 1 6 6 VAL H H 1 7.95 0.02 . 1 . . . . 6 VAL H . 16323 1 28 . 1 1 6 6 VAL HA H 1 3.95 0.02 . 1 . . . . 6 VAL HA . 16323 1 29 . 1 1 6 6 VAL HB H 1 1.94 0.02 . 1 . . . . 6 VAL HB . 16323 1 30 . 1 1 6 6 VAL HG11 H 1 0.72 0.02 . 1 . . . . 6 VAL MG1 . 16323 1 31 . 1 1 6 6 VAL HG12 H 1 0.72 0.02 . 1 . . . . 6 VAL MG1 . 16323 1 32 . 1 1 6 6 VAL HG13 H 1 0.72 0.02 . 1 . . . . 6 VAL MG1 . 16323 1 33 . 1 1 6 6 VAL HG21 H 1 0.72 0.02 . 1 . . . . 6 VAL MG2 . 16323 1 34 . 1 1 6 6 VAL HG22 H 1 0.72 0.02 . 1 . . . . 6 VAL MG2 . 16323 1 35 . 1 1 6 6 VAL HG23 H 1 0.72 0.02 . 1 . . . . 6 VAL MG2 . 16323 1 36 . 1 1 7 7 LEU H H 1 7.93 0.02 . 1 . . . . 7 LEU H . 16323 1 37 . 1 1 7 7 LEU HA H 1 4.00 0.02 . 1 . . . . 7 LEU HA . 16323 1 38 . 1 1 7 7 LEU HB2 H 1 1.68 0.02 . 1 . . . . 7 LEU HB2 . 16323 1 39 . 1 1 7 7 LEU HB3 H 1 1.68 0.02 . 1 . . . . 7 LEU HB3 . 16323 1 40 . 1 1 7 7 LEU HG H 1 0.98 0.02 . 1 . . . . 7 LEU HG . 16323 1 41 . 1 1 8 8 MET H H 1 8.17 0.02 . 1 . . . . 8 MET H . 16323 1 42 . 1 1 8 8 MET HA H 1 4.34 0.02 . 1 . . . . 8 MET HA . 16323 1 43 . 1 1 8 8 MET HB2 H 1 2.58 0.02 . 1 . . . . 8 MET HB2 . 16323 1 44 . 1 1 8 8 MET HB3 H 1 2.56 0.02 . 1 . . . . 8 MET HB3 . 16323 1 45 . 1 1 8 8 MET HG2 H 1 2.65 0.02 . 1 . . . . 8 MET HG2 . 16323 1 46 . 1 1 8 8 MET HG3 H 1 2.63 0.02 . 1 . . . . 8 MET HG3 . 16323 1 47 . 1 1 9 9 ARG H H 1 7.91 0.02 . 1 . . . . 9 ARG H . 16323 1 48 . 1 1 9 9 ARG HA H 1 3.95 0.02 . 1 . . . . 9 ARG HA . 16323 1 49 . 1 1 9 9 ARG HB2 H 1 1.49 0.02 . 1 . . . . 9 ARG HB2 . 16323 1 50 . 1 1 9 9 ARG HB3 H 1 1.49 0.02 . 1 . . . . 9 ARG HB3 . 16323 1 51 . 1 1 9 9 ARG HG2 H 1 1.22 0.02 . 1 . . . . 9 ARG HG2 . 16323 1 52 . 1 1 9 9 ARG HG3 H 1 1.22 0.02 . 1 . . . . 9 ARG HG3 . 16323 1 53 . 1 1 10 10 ARG H H 1 8.04 0.02 . 1 . . . . 10 ARG H . 16323 1 54 . 1 1 10 10 ARG HA H 1 4.17 0.02 . 1 . . . . 10 ARG HA . 16323 1 55 . 1 1 10 10 ARG HB2 H 1 1.69 0.02 . 1 . . . . 10 ARG HB2 . 16323 1 56 . 1 1 10 10 ARG HB3 H 1 1.55 0.02 . 1 . . . . 10 ARG HB3 . 16323 1 57 . 1 1 10 10 ARG HG2 H 1 1.46 0.02 . 1 . . . . 10 ARG HG2 . 16323 1 58 . 1 1 11 11 GLN H H 1 8.33 0.02 . 1 . . . . 11 GLN H . 16323 1 59 . 1 1 11 11 GLN HA H 1 4.58 0.02 . 1 . . . . 11 GLN HA . 16323 1 60 . 1 1 11 11 GLN HB2 H 1 2.60 0.02 . 1 . . . . 11 GLN HB2 . 16323 1 61 . 1 1 11 11 GLN HB3 H 1 2.58 0.02 . 1 . . . . 11 GLN HB3 . 16323 1 62 . 1 1 11 11 GLN HE21 H 1 7.52 0.02 . 1 . . . . 11 GLN HE21 . 16323 1 63 . 1 1 11 11 GLN HE22 H 1 6.81 0.02 . 1 . . . . 11 GLN HE22 . 16323 1 64 . 1 1 11 11 GLN HG2 H 1 2.70 0.02 . 1 . . . . 11 GLN HG2 . 16323 1 65 . 1 1 11 11 GLN HG3 H 1 2.67 0.02 . 1 . . . . 11 GLN HG3 . 16323 1 66 . 1 1 12 12 LYS H H 1 7.93 0.02 . 1 . . . . 12 LYS H . 16323 1 67 . 1 1 12 12 LYS HA H 1 4.31 0.02 . 1 . . . . 12 LYS HA . 16323 1 68 . 1 1 12 12 LYS HB2 H 1 1.68 0.02 . 1 . . . . 12 LYS HB2 . 16323 1 69 . 1 1 12 12 LYS HB3 H 1 1.53 0.02 . 1 . . . . 12 LYS HB3 . 16323 1 70 . 1 1 12 12 LYS HE2 H 1 3.02 0.02 . 1 . . . . 12 LYS HE2 . 16323 1 71 . 1 1 12 12 LYS HG2 H 1 1.43 0.02 . 1 . . . . 12 LYS HG2 . 16323 1 72 . 1 1 13 13 GLN H H 1 8.23 0.02 . 1 . . . . 13 GLN H . 16323 1 73 . 1 1 13 13 GLN HA H 1 4.20 0.02 . 1 . . . . 13 GLN HA . 16323 1 74 . 1 1 13 13 GLN HB2 H 1 1.90 0.02 . 1 . . . . 13 GLN HB2 . 16323 1 75 . 1 1 13 13 GLN HB3 H 1 1.78 0.02 . 1 . . . . 13 GLN HB3 . 16323 1 76 . 1 1 13 13 GLN HE21 H 1 7.48 0.02 . 1 . . . . 13 GLN HE21 . 16323 1 77 . 1 1 13 13 GLN HE22 H 1 6.82 0.02 . 1 . . . . 13 GLN HE22 . 16323 1 78 . 1 1 13 13 GLN HG2 H 1 2.28 0.02 . 1 . . . . 13 GLN HG2 . 16323 1 79 . 1 1 13 13 GLN HG3 H 1 2.28 0.02 . 1 . . . . 13 GLN HG3 . 16323 1 80 . 1 1 14 14 ILE H H 1 8.09 0.02 . 1 . . . . 14 ILE H . 16323 1 81 . 1 1 14 14 ILE HA H 1 3.81 0.02 . 1 . . . . 14 ILE HA . 16323 1 82 . 1 1 14 14 ILE HB H 1 1.60 0.02 . 1 . . . . 14 ILE HB . 16323 1 83 . 1 1 14 14 ILE HG12 H 1 1.49 0.02 . 1 . . . . 14 ILE HG12 . 16323 1 84 . 1 1 14 14 ILE HG13 H 1 1.24 0.02 . 1 . . . . 14 ILE HG13 . 16323 1 85 . 1 1 15 15 ASN H H 1 8.29 0.02 . 1 . . . . 15 ASN H . 16323 1 86 . 1 1 15 15 ASN HA H 1 4.51 0.02 . 1 . . . . 15 ASN HA . 16323 1 87 . 1 1 15 15 ASN HB2 H 1 2.60 0.02 . 1 . . . . 15 ASN HB2 . 16323 1 88 . 1 1 15 15 ASN HB3 H 1 2.50 0.02 . 1 . . . . 15 ASN HB3 . 16323 1 89 . 1 1 15 15 ASN HD21 H 1 7.38 0.02 . 1 . . . . 15 ASN HD21 . 16323 1 90 . 1 1 15 15 ASN HD22 H 1 6.80 0.02 . 1 . . . . 15 ASN HD22 . 16323 1 91 . 1 1 16 16 TYR H H 1 8.15 0.02 . 1 . . . . 16 TYR H . 16323 1 92 . 1 1 16 16 TYR HA H 1 4.28 0.02 . 1 . . . . 16 TYR HA . 16323 1 93 . 1 1 16 16 TYR HB2 H 1 2.93 0.02 . 1 . . . . 16 TYR HB2 . 16323 1 94 . 1 1 16 16 TYR HB3 H 1 2.74 0.02 . 1 . . . . 16 TYR HB3 . 16323 1 95 . 1 1 17 17 GLY H H 1 8.24 0.02 . 1 . . . . 17 GLY H . 16323 1 96 . 1 1 17 17 GLY HA2 H 1 3.68 0.02 . 1 . . . . 17 GLY HA2 . 16323 1 97 . 1 1 17 17 GLY HA3 H 1 3.66 0.02 . 1 . . . . 17 GLY HA3 . 16323 1 98 . 1 1 18 18 LYS H H 1 8.10 0.02 . 1 . . . . 18 LYS H . 16323 1 99 . 1 1 18 18 LYS HA H 1 4.00 0.02 . 1 . . . . 18 LYS HA . 16323 1 100 . 1 1 18 18 LYS HB2 H 1 1.63 0.02 . 1 . . . . 18 LYS HB2 . 16323 1 101 . 1 1 18 18 LYS HB3 H 1 1.61 0.02 . 1 . . . . 18 LYS HB3 . 16323 1 102 . 1 1 18 18 LYS HD2 H 1 1.54 0.02 . 1 . . . . 18 LYS HD2 . 16323 1 103 . 1 1 18 18 LYS HG2 H 1 1.29 0.02 . 1 . . . . 18 LYS HG2 . 16323 1 104 . 1 1 19 19 ASN H H 1 8.34 0.02 . 1 . . . . 19 ASN H . 16323 1 105 . 1 1 19 19 ASN HA H 1 4.60 0.02 . 1 . . . . 19 ASN HA . 16323 1 106 . 1 1 19 19 ASN HB2 H 1 2.69 0.02 . 1 . . . . 19 ASN HB2 . 16323 1 107 . 1 1 19 19 ASN HB3 H 1 2.60 0.02 . 1 . . . . 19 ASN HB3 . 16323 1 108 . 1 1 19 19 ASN HD21 H 1 7.43 0.02 . 1 . . . . 19 ASN HD21 . 16323 1 109 . 1 1 19 19 ASN HD22 H 1 6.77 0.02 . 1 . . . . 19 ASN HD22 . 16323 1 110 . 1 1 20 20 THR H H 1 7.93 0.02 . 1 . . . . 20 THR H . 16323 1 111 . 1 1 20 20 THR HA H 1 4.11 0.02 . 1 . . . . 20 THR HA . 16323 1 112 . 1 1 20 20 THR HB H 1 4.05 0.02 . 1 . . . . 20 THR HB . 16323 1 113 . 1 1 20 20 THR HG21 H 1 1.00 0.02 . 1 . . . . 20 THR HG1 . 16323 1 114 . 1 1 20 20 THR HG22 H 1 1.00 0.02 . 1 . . . . 20 THR HG1 . 16323 1 115 . 1 1 20 20 THR HG23 H 1 1.00 0.02 . 1 . . . . 20 THR HG1 . 16323 1 116 . 1 1 21 21 ILE H H 1 8.09 0.02 . 1 . . . . 21 ILE H . 16323 1 117 . 1 1 21 21 ILE HA H 1 3.85 0.02 . 1 . . . . 21 ILE HA . 16323 1 118 . 1 1 21 21 ILE HB H 1 1.63 0.02 . 1 . . . . 21 ILE HB . 16323 1 119 . 1 1 21 21 ILE HG12 H 1 1.54 0.02 . 1 . . . . 21 ILE HG12 . 16323 1 120 . 1 1 21 21 ILE HG13 H 1 1.54 0.02 . 1 . . . . 21 ILE HG13 . 16323 1 121 . 1 1 22 22 ALA H H 1 8.16 0.02 . 1 . . . . 22 ALA H . 16323 1 122 . 1 1 22 22 ALA HA H 1 4.03 0.02 . 1 . . . . 22 ALA HA . 16323 1 123 . 1 1 22 22 ALA HB1 H 1 1.12 0.02 . 1 . . . . 22 ALA MB . 16323 1 124 . 1 1 22 22 ALA HB2 H 1 1.12 0.02 . 1 . . . . 22 ALA MB . 16323 1 125 . 1 1 22 22 ALA HB3 H 1 1.12 0.02 . 1 . . . . 22 ALA MB . 16323 1 126 . 1 1 23 23 TYR H H 1 8.24 0.02 . 1 . . . . 23 TYR H . 16323 1 127 . 1 1 23 23 TYR HA H 1 4.35 0.02 . 1 . . . . 23 TYR HA . 16323 1 128 . 1 1 23 23 TYR HB2 H 1 2.62 0.02 . 1 . . . . 23 TYR HB2 . 16323 1 129 . 1 1 23 23 TYR HB3 H 1 2.58 0.02 . 1 . . . . 23 TYR HB3 . 16323 1 130 . 1 1 24 24 ASP H H 1 7.93 0.02 . 1 . . . . 24 ASP H . 16323 1 131 . 1 1 24 24 ASP HA H 1 4.33 0.02 . 1 . . . . 24 ASP HA . 16323 1 132 . 1 1 24 24 ASP HB2 H 1 2.80 0.02 . 1 . . . . 24 ASP HB2 . 16323 1 133 . 1 1 24 24 ASP HB3 H 1 2.69 0.02 . 1 . . . . 24 ASP HB3 . 16323 1 134 . 1 1 25 25 ARG H H 1 8.00 0.02 . 1 . . . . 25 ARG H . 16323 1 135 . 1 1 25 25 ARG HA H 1 4.02 0.02 . 1 . . . . 25 ARG HA . 16323 1 136 . 1 1 25 25 ARG HB2 H 1 1.70 0.02 . 1 . . . . 25 ARG HB2 . 16323 1 137 . 1 1 25 25 ARG HB3 H 1 1.62 0.02 . 1 . . . . 25 ARG HB3 . 16323 1 138 . 1 1 25 25 ARG HG2 H 1 1.55 0.02 . 1 . . . . 25 ARG HG2 . 16323 1 139 . 1 1 25 25 ARG HG3 H 1 1.46 0.02 . 1 . . . . 25 ARG HG3 . 16323 1 140 . 1 1 26 26 TYR H H 1 7.93 0.02 . 1 . . . . 26 TYR H . 16323 1 141 . 1 1 26 26 TYR HA H 1 4.32 0.02 . 1 . . . . 26 TYR HA . 16323 1 142 . 1 1 26 26 TYR HB2 H 1 2.85 0.02 . 1 . . . . 26 TYR HB2 . 16323 1 143 . 1 1 26 26 TYR HB3 H 1 2.75 0.02 . 1 . . . . 26 TYR HB3 . 16323 1 144 . 1 1 27 27 ILE H H 1 7.72 0.02 . 1 . . . . 27 ILE H . 16323 1 145 . 1 1 27 27 ILE HA H 1 3.82 0.02 . 1 . . . . 27 ILE HA . 16323 1 146 . 1 1 27 27 ILE HB H 1 1.56 0.02 . 1 . . . . 27 ILE HB . 16323 1 147 . 1 1 27 27 ILE HG12 H 1 1.19 0.02 . 1 . . . . 27 ILE HG12 . 16323 1 148 . 1 1 27 27 ILE HG13 H 1 0.92 0.02 . 1 . . . . 27 ILE HG13 . 16323 1 149 . 1 1 28 28 LYS H H 1 8.02 0.02 . 1 . . . . 28 LYS H . 16323 1 150 . 1 1 28 28 LYS HA H 1 3.81 0.02 . 1 . . . . 28 LYS HA . 16323 1 151 . 1 1 28 28 LYS HB2 H 1 1.88 0.02 . 1 . . . . 28 LYS HB2 . 16323 1 152 . 1 1 28 28 LYS HB3 H 1 1.90 0.02 . 1 . . . . 28 LYS HB3 . 16323 1 153 . 1 1 28 28 LYS HE2 H 1 3.02 0.02 . 1 . . . . 28 LYS HE2 . 16323 1 154 . 1 1 28 28 LYS HE3 H 1 3.02 0.02 . 1 . . . . 28 LYS HE3 . 16323 1 155 . 1 1 29 29 GLU H H 1 8.02 0.02 . 1 . . . . 29 GLU H . 16323 1 156 . 1 1 29 29 GLU HA H 1 4.17 0.02 . 1 . . . . 29 GLU HA . 16323 1 157 . 1 1 29 29 GLU HB2 H 1 1.88 0.02 . 1 . . . . 29 GLU HB2 . 16323 1 158 . 1 1 29 29 GLU HB3 H 1 1.90 0.02 . 1 . . . . 29 GLU HB3 . 16323 1 159 . 1 1 29 29 GLU HG2 H 1 2.36 0.02 . 1 . . . . 29 GLU HG2 . 16323 1 160 . 1 1 29 29 GLU HG3 H 1 2.46 0.02 . 1 . . . . 29 GLU HG3 . 16323 1 161 . 1 1 30 30 VAL H H 1 6.96 0.02 . 1 . . . . 30 VAL H . 16323 1 162 . 1 1 30 30 VAL HA H 1 3.96 0.02 . 1 . . . . 30 VAL HA . 16323 1 163 . 1 1 30 30 VAL HB H 1 2.91 0.02 . 1 . . . . 30 VAL HB . 16323 1 164 . 1 1 30 30 VAL HG11 H 1 1.49 0.02 . 1 . . . . 30 VAL MG1 . 16323 1 165 . 1 1 30 30 VAL HG12 H 1 1.49 0.02 . 1 . . . . 30 VAL MG1 . 16323 1 166 . 1 1 30 30 VAL HG13 H 1 1.49 0.02 . 1 . . . . 30 VAL MG1 . 16323 1 167 . 1 1 30 30 VAL HG21 H 1 1.22 0.02 . 1 . . . . 30 VAL MG2 . 16323 1 168 . 1 1 30 30 VAL HG22 H 1 1.22 0.02 . 1 . . . . 30 VAL MG2 . 16323 1 169 . 1 1 30 30 VAL HG23 H 1 1.22 0.02 . 1 . . . . 30 VAL MG2 . 16323 1 stop_ save_