data_25998 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 25998 _Entry.Title ; Solution structure of the K domain of EMCV IRES ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2016-03-16 _Entry.Accession_date 2016-03-23 _Entry.Last_release_date 2016-08-08 _Entry.Original_release_date 2016-08-08 _Entry.Origination author _Entry.NMR_STAR_version 3.1.2.6 _Entry.Original_NMR_STAR_version 3.1.1.99 _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.ORCID _Entry_author.Entry_ID 1 Shunsuke Imai . . . . 25998 2 Victoria D'Souza . . . . 25998 3 Gerhard Wagner . . . . 25998 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 'not applicable' 'not applicable' . 25998 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID IRES . 25998 'Viral RNA' . 25998 'translation initiation' . 25998 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 25998 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 167 25998 '1H chemical shifts' 176 25998 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 . . 2016-10-12 2016-03-16 update BMRB 'update entry citation' 25998 1 . . 2016-08-08 2016-03-16 original author 'original release' 25998 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 25996 'Solution structure of the J-K region of EMCV IRES' 25998 BMRB 25999 'Solution structure of the St domain of EMCV IRES' 25998 BMRB 26000 'Solution structure of the delta-J-delta-K domain of EMCV IRES' 25998 BMRB 26997 'Solution structure of the J domain of EMCV IRES' 25998 PDB 2NBZ 'BMRB Entry Tracking System' 25998 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 25998 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 27525590 _Citation.Full_citation . _Citation.Title ; An accurately preorganized IRES RNA structure enables eIF4G capture for initiation of viral translation ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Nat. Struct. Mol. Biol.' _Citation.Journal_name_full . _Citation.Journal_volume 23 _Citation.Journal_issue 9 _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 859 _Citation.Page_last 864 _Citation.Year 2016 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Shunsuke Imai . . . . 25998 1 2 Christopher Hellen . . . . 25998 1 3 Victoria D'Souza . . . . 25998 1 4 Gerhard Wagner . . . . 25998 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 25998 _Assembly.ID 1 _Assembly.Name 'K domain of EMCV IRES' _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 'RNA (40-MER)' 1 $RNA_(40-MER) A . yes native no no . . . 25998 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_RNA_(40-MER) _Entity.Sf_category entity _Entity.Sf_framecode RNA_(40-MER) _Entity.Entry_ID 25998 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name RNA_(40-MER) _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polyribonucleotide _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GGGCUCGGUGCACAUGCUUU ACAUGUGUUUAGUCGAGCCC ; _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 40 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method syn _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 12798.640 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 730 G . 25998 1 2 731 G . 25998 1 3 732 G . 25998 1 4 733 C . 25998 1 5 734 U . 25998 1 6 735 C . 25998 1 7 736 G . 25998 1 8 737 G . 25998 1 9 738 U . 25998 1 10 739 G . 25998 1 11 740 C . 25998 1 12 741 A . 25998 1 13 742 C . 25998 1 14 743 A . 25998 1 15 744 U . 25998 1 16 745 G . 25998 1 17 746 C . 25998 1 18 747 U . 25998 1 19 748 U . 25998 1 20 749 U . 25998 1 21 750 A . 25998 1 22 751 C . 25998 1 23 752 A . 25998 1 24 753 U . 25998 1 25 754 G . 25998 1 26 755 U . 25998 1 27 756 G . 25998 1 28 757 U . 25998 1 29 758 U . 25998 1 30 759 U . 25998 1 31 760 A . 25998 1 32 761 G . 25998 1 33 762 U . 25998 1 34 763 C . 25998 1 35 764 G . 25998 1 36 765 A . 25998 1 37 766 G . 25998 1 38 767 C . 25998 1 39 768 C . 25998 1 40 769 C . 25998 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 . G 1 1 25998 1 . G 2 2 25998 1 . G 3 3 25998 1 . C 4 4 25998 1 . U 5 5 25998 1 . C 6 6 25998 1 . G 7 7 25998 1 . G 8 8 25998 1 . U 9 9 25998 1 . G 10 10 25998 1 . C 11 11 25998 1 . A 12 12 25998 1 . C 13 13 25998 1 . A 14 14 25998 1 . U 15 15 25998 1 . G 16 16 25998 1 . C 17 17 25998 1 . U 18 18 25998 1 . U 19 19 25998 1 . U 20 20 25998 1 . A 21 21 25998 1 . C 22 22 25998 1 . A 23 23 25998 1 . U 24 24 25998 1 . G 25 25 25998 1 . U 26 26 25998 1 . G 27 27 25998 1 . U 28 28 25998 1 . U 29 29 25998 1 . U 30 30 25998 1 . A 31 31 25998 1 . G 32 32 25998 1 . U 33 33 25998 1 . C 34 34 25998 1 . G 35 35 25998 1 . A 36 36 25998 1 . G 37 37 25998 1 . C 38 38 25998 1 . C 39 39 25998 1 . C 40 40 25998 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 25998 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $RNA_(40-MER) . 12104 virus . 'Encephalomyocarditis virus' 'Encephalomyocarditis virus' . . Viruses . Cardiovirus . . . . . . . . . . . . . . 25998 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 25998 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $RNA_(40-MER) . 'enzymatic semisynthesis' . . . . . . . . . . . . . . . . 25998 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 25998 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% 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 'RNA (40-MER)' 'natural abundance' . . 1 $RNA_(40-MER) . RNA 0.5 . . mM . . . . 25998 1 2 'potassium phosphate' 'natural abundance' . . . . . buffer 10 . . mM . . . . 25998 1 3 'sodium chloride' 'natural abundance' . . . . . salt 10 . . mM . . . . 25998 1 4 D2O [U-2H] . . . . . solvent 100 . . % . . . . 25998 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 25998 _Sample.ID 2 _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 'RNA (40-MER)' 'natural abundance' . . 1 $RNA_(40-MER) . RNA 0.5 . . mM . . . . 25998 2 2 'potassium phosphate' 'natural abundance' . . . . . buffer 10 . . mM . . . . 25998 2 3 'sodium chloride' 'natural abundance' . . . . . salt 10 . . mM . . . . 25998 2 4 H2O 'natural abundance' . . . . . solvent 90 . . % . . . . 25998 2 5 D2O [U-2H] . . . . . solvent 10 . . % . . . . 25998 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 25998 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% 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 'RNA (40-MER)' '[U-13C; U-15N]-Ade, [U-13C; U-15N]-Cyt' . . 1 $RNA_(40-MER) . RNA 0.5 . . mM . . . . 25998 3 2 'potassium phosphate' 'natural abundance' . . . . . buffer 10 . . mM . . . . 25998 3 3 'sodium chloride' 'natural abundance' . . . . . salt 10 . . mM . . . . 25998 3 4 D2O [U-2H] . . . . . solvent 100 . . % . . . . 25998 3 stop_ save_ save_sample_4 _Sample.Sf_category sample _Sample.Sf_framecode sample_4 _Sample.Entry_ID 25998 _Sample.ID 4 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% 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 'RNA (40-MER)' '[U-13C; U-15N]-Gua, [U-13C; U-15N]-Ura' . . 1 $RNA_(40-MER) . RNA 0.5 . . mM . . . . 25998 4 2 'potassium phosphate' 'natural abundance' . . . . . buffer 10 . . mM . . . . 25998 4 3 'sodium chloride' 'natural abundance' . . . . . salt 10 . . mM . . . . 25998 4 4 D2O [U-2H] . . . . . solvent 100 . . % . . . . 25998 4 stop_ save_ save_sample_5 _Sample.Sf_category sample _Sample.Sf_framecode sample_5 _Sample.Entry_ID 25998 _Sample.ID 5 _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 'RNA (40-MER)' '[U-13C; U-15N]-Ade, [U-13C; U-15N]-Cyt' . . 1 $RNA_(40-MER) . RNA 0.5 . . mM . . . . 25998 5 2 'potassium phosphate' 'natural abundance' . . . . . buffer 10 . . mM . . . . 25998 5 3 'sodium chloride' 'natural abundance' . . . . . salt 10 . . mM . . . . 25998 5 4 H2O 'natural abundance' . . . . . solvent 90 . . % . . . . 25998 5 5 D2O [U-2H] . . . . . solvent 10 . . % . . . . 25998 5 stop_ save_ save_sample_6 _Sample.Sf_category sample _Sample.Sf_framecode sample_6 _Sample.Entry_ID 25998 _Sample.ID 6 _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 'RNA (40-MER)' '[U-13C; U-15N]-Gua, [U-13C; U-15N]-Ura' . . 1 $RNA_(40-MER) . RNA 0.5 . . mM . . . . 25998 6 2 'potassium phosphate' 'natural abundance' . . . . . buffer 10 . . mM . . . . 25998 6 3 'sodium chloride' 'natural abundance' . . . . . salt 10 . . mM . . . . 25998 6 4 H2O 'natural abundance' . . . . . solvent 90 . . % . . . . 25998 6 5 D2O [U-2H] . . . . . solvent 10 . . % . . . . 25998 6 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 25998 _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' 20 . mM 25998 1 pH 6.5 . pH 25998 1 pressure 1 . atm 25998 1 temperature 308 . K 25998 1 stop_ save_ save_sample_conditions_2 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_2 _Sample_condition_list.Entry_ID 25998 _Sample_condition_list.ID 2 _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' 20 . mM 25998 2 pH 6.5 . pH 25998 2 pressure 1 . atm 25998 2 temperature 283 . K 25998 2 stop_ save_ save_sample_conditions_3 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_3 _Sample_condition_list.Entry_ID 25998 _Sample_condition_list.ID 3 _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' 20 . mM 25998 3 pH 5.5 . pH 25998 3 pressure 1 . atm 25998 3 temperature 283 . K 25998 3 stop_ save_ ############################ # Computer software used # ############################ save_CARA _Software.Sf_category software _Software.Sf_framecode CARA _Software.Entry_ID 25998 _Software.ID 1 _Software.Name CARA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Keller and Wuthrich' . . 25998 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 25998 1 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 25998 _Software.ID 2 _Software.Name CYANA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 25998 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 25998 2 stop_ save_ save_X-PLOR_NIH _Software.Sf_category software _Software.Sf_framecode X-PLOR_NIH _Software.Entry_ID 25998 _Software.ID 3 _Software.Name X-PLOR_NIH _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Schwieters, Kuszewski, Tjandra and Clore' . . 25998 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 25998 3 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 25998 _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_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 25998 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 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 25998 _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 . . . 25998 1 2 spectrometer_2 Bruker Avance . 700 . . . 25998 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 25998 _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 1H-1H NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25998 1 2 '2D 1H-1H NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25998 1 3 '2D 1H-1H NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 3 $sample_conditions_3 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25998 1 4 '2D 1H-13C HSQC' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25998 1 5 '3D 1H-13C NOESY' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25998 1 6 '2D 1H-13C HSQC' no . . . . . . . . . . 4 $sample_4 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25998 1 7 '3D 1H-13C NOESY' no . . . . . . . . . . 4 $sample_4 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25998 1 8 '2D 1H-15N HSQC' no . . . . . . . . . . 5 $sample_5 isotropic . . 2 $sample_conditions_2 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25998 1 9 '2D 1H-15N HSQC' no . . . . . . . . . . 5 $sample_5 isotropic . . 3 $sample_conditions_3 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25998 1 10 '2D 1H-15N HSQC' no . . . . . . . . . . 6 $sample_6 isotropic . . 2 $sample_conditions_2 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25998 1 11 '2D 1H-15N HSQC' no . . . . . . . . . . 6 $sample_6 isotropic . . 3 $sample_conditions_3 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25998 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 25998 _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.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 25998 1 H 1 DSS 'methyl protons' . . . . ppm 0 external direct 1 . . . . . 25998 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 25998 _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 0.03 _Assigned_chem_shift_list.Chem_shift_13C_err 0.1 _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-1H NOESY' 1 $sample_1 isotropic 25998 1 4 '2D 1H-13C HSQC' 3 $sample_3 isotropic 25998 1 6 '2D 1H-13C HSQC' 4 $sample_4 isotropic 25998 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 G H1' H 1 5.83 0.03 . 1 . . . A 730 G H1' . 25998 1 2 . 1 1 1 1 G H2' H 1 4.92 0.03 . 1 . . . A 730 G H2' . 25998 1 3 . 1 1 1 1 G H8 H 1 8.14 0.03 . 1 . . . A 730 G H8 . 25998 1 4 . 1 1 1 1 G C1' C 13 88.64 0.1 . 1 . . . A 730 G C1' . 25998 1 5 . 1 1 1 1 G C2' C 13 72.43 0.1 . 1 . . . A 730 G C2' . 25998 1 6 . 1 1 1 1 G C8 C 13 136.43 0.1 . 1 . . . A 730 G C8 . 25998 1 7 . 1 1 2 2 G H1' H 1 5.94 0.03 . 1 . . . A 731 G H1' . 25998 1 8 . 1 1 2 2 G H2' H 1 4.71 0.03 . 1 . . . A 731 G H2' . 25998 1 9 . 1 1 2 2 G H8 H 1 7.59 0.03 . 1 . . . A 731 G H8 . 25998 1 10 . 1 1 2 2 G C1' C 13 90.07 0.1 . 1 . . . A 731 G C1' . 25998 1 11 . 1 1 2 2 G C2' C 13 72.95 0.1 . 1 . . . A 731 G C2' . 25998 1 12 . 1 1 2 2 G C8 C 13 134.23 0.1 . 1 . . . A 731 G C8 . 25998 1 13 . 1 1 3 3 G H1' H 1 5.80 0.03 . 1 . . . A 732 G H1' . 25998 1 14 . 1 1 3 3 G H2' H 1 4.54 0.03 . 1 . . . A 732 G H2' . 25998 1 15 . 1 1 3 3 G H8 H 1 7.29 0.03 . 1 . . . A 732 G H8 . 25998 1 16 . 1 1 3 3 G C1' C 13 90.34 0.1 . 1 . . . A 732 G C1' . 25998 1 17 . 1 1 3 3 G C2' C 13 72.66 0.1 . 1 . . . A 732 G C2' . 25998 1 18 . 1 1 3 3 G C8 C 13 133.33 0.1 . 1 . . . A 732 G C8 . 25998 1 19 . 1 1 4 4 C H1' H 1 5.53 0.03 . 1 . . . A 733 C H1' . 25998 1 20 . 1 1 4 4 C H2' H 1 4.46 0.03 . 1 . . . A 733 C H2' . 25998 1 21 . 1 1 4 4 C H5 H 1 5.26 0.03 . 1 . . . A 733 C H5 . 25998 1 22 . 1 1 4 4 C H6 H 1 7.59 0.03 . 1 . . . A 733 C H6 . 25998 1 23 . 1 1 4 4 C C1' C 13 91.43 0.1 . 1 . . . A 733 C C1' . 25998 1 24 . 1 1 4 4 C C2' C 13 72.74 0.1 . 1 . . . A 733 C C2' . 25998 1 25 . 1 1 4 4 C C5 C 13 94.57 0.1 . 1 . . . A 733 C C5 . 25998 1 26 . 1 1 4 4 C C6 C 13 138.28 0.1 . 1 . . . A 733 C C6 . 25998 1 27 . 1 1 5 5 U H1' H 1 5.57 0.03 . 1 . . . A 734 U H1' . 25998 1 28 . 1 1 5 5 U H2' H 1 4.53 0.03 . 1 . . . A 734 U H2' . 25998 1 29 . 1 1 5 5 U H5 H 1 5.44 0.03 . 1 . . . A 734 U H5 . 25998 1 30 . 1 1 5 5 U H6 H 1 7.87 0.03 . 1 . . . A 734 U H6 . 25998 1 31 . 1 1 5 5 U C1' C 13 91.24 0.1 . 1 . . . A 734 U C1' . 25998 1 32 . 1 1 5 5 U C2' C 13 72.63 0.1 . 1 . . . A 734 U C2' . 25998 1 33 . 1 1 5 5 U C5 C 13 100.77 0.1 . 1 . . . A 734 U C5 . 25998 1 34 . 1 1 5 5 U C6 C 13 139.29 0.1 . 1 . . . A 734 U C6 . 25998 1 35 . 1 1 6 6 C H1' H 1 5.54 0.03 . 1 . . . A 735 C H1' . 25998 1 36 . 1 1 6 6 C H2' H 1 4.51 0.03 . 1 . . . A 735 C H2' . 25998 1 37 . 1 1 6 6 C H5 H 1 5.64 0.03 . 1 . . . A 735 C H5 . 25998 1 38 . 1 1 6 6 C H6 H 1 7.82 0.03 . 1 . . . A 735 C H6 . 25998 1 39 . 1 1 6 6 C C1' C 13 91.07 0.1 . 1 . . . A 735 C C1' . 25998 1 40 . 1 1 6 6 C C2' C 13 70.05 0.1 . 1 . . . A 735 C C2' . 25998 1 41 . 1 1 6 6 C C5 C 13 95.23 0.1 . 1 . . . A 735 C C5 . 25998 1 42 . 1 1 6 6 C C6 C 13 138.59 0.1 . 1 . . . A 735 C C6 . 25998 1 43 . 1 1 7 7 G H1' H 1 5.65 0.03 . 1 . . . A 736 G H1' . 25998 1 44 . 1 1 7 7 G H2' H 1 4.51 0.03 . 1 . . . A 736 G H2' . 25998 1 45 . 1 1 7 7 G H8 H 1 7.52 0.03 . 1 . . . A 736 G H8 . 25998 1 46 . 1 1 7 7 G C1' C 13 90.14 0.1 . 1 . . . A 736 G C1' . 25998 1 47 . 1 1 7 7 G C2' C 13 72.78 0.1 . 1 . . . A 736 G C2' . 25998 1 48 . 1 1 7 7 G C8 C 13 133.70 0.1 . 1 . . . A 736 G C8 . 25998 1 49 . 1 1 8 8 G H1' H 1 5.75 0.03 . 1 . . . A 737 G H1' . 25998 1 50 . 1 1 8 8 G H2' H 1 4.46 0.03 . 1 . . . A 737 G H2' . 25998 1 51 . 1 1 8 8 G H3' H 1 4.42 0.03 . 1 . . . A 737 G H3' . 25998 1 52 . 1 1 8 8 G H4' H 1 4.45 0.03 . 1 . . . A 737 G H4' . 25998 1 53 . 1 1 8 8 G H8 H 1 7.22 0.03 . 1 . . . A 737 G H8 . 25998 1 54 . 1 1 8 8 G C1' C 13 90.16 0.1 . 1 . . . A 737 G C1' . 25998 1 55 . 1 1 8 8 G C2' C 13 72.86 0.1 . 1 . . . A 737 G C2' . 25998 1 56 . 1 1 8 8 G C3' C 13 71.03 0.1 . 1 . . . A 737 G C3' . 25998 1 57 . 1 1 8 8 G C4' C 13 80.31 0.1 . 1 . . . A 737 G C4' . 25998 1 58 . 1 1 8 8 G C8 C 13 134.75 0.1 . 1 . . . A 737 G C8 . 25998 1 59 . 1 1 9 9 U H1' H 1 5.65 0.03 . 1 . . . A 738 U H1' . 25998 1 60 . 1 1 9 9 U H2' H 1 4.47 0.03 . 1 . . . A 738 U H2' . 25998 1 61 . 1 1 9 9 U H3' H 1 4.59 0.03 . 1 . . . A 738 U H3' . 25998 1 62 . 1 1 9 9 U H5 H 1 5.45 0.03 . 1 . . . A 738 U H5 . 25998 1 63 . 1 1 9 9 U H5' H 1 4.09 0.03 . 2 . . . A 738 U H5' . 25998 1 64 . 1 1 9 9 U H5'' H 1 4.46 0.03 . 2 . . . A 738 U H5'' . 25998 1 65 . 1 1 9 9 U H6 H 1 7.69 0.03 . 1 . . . A 738 U H6 . 25998 1 66 . 1 1 9 9 U C1' C 13 90.06 0.1 . 1 . . . A 738 U C1' . 25998 1 67 . 1 1 9 9 U C2' C 13 73.11 0.1 . 1 . . . A 738 U C2' . 25998 1 68 . 1 1 9 9 U C3' C 13 70.85 0.1 . 1 . . . A 738 U C3' . 25998 1 69 . 1 1 9 9 U C5 C 13 101.61 0.1 . 1 . . . A 738 U C5 . 25998 1 70 . 1 1 9 9 U C5' C 13 62.98 0.1 . 1 . . . A 738 U C5' . 25998 1 71 . 1 1 9 9 U C6 C 13 138.57 0.1 . 1 . . . A 738 U C6 . 25998 1 72 . 1 1 10 10 G H1' H 1 5.69 0.03 . 1 . . . A 739 G H1' . 25998 1 73 . 1 1 10 10 G H2' H 1 4.67 0.03 . 1 . . . A 739 G H2' . 25998 1 74 . 1 1 10 10 G H3' H 1 4.41 0.03 . 1 . . . A 739 G H3' . 25998 1 75 . 1 1 10 10 G H4' H 1 4.50 0.03 . 1 . . . A 739 G H4' . 25998 1 76 . 1 1 10 10 G H8 H 1 7.82 0.03 . 1 . . . A 739 G H8 . 25998 1 77 . 1 1 10 10 G C1' C 13 90.48 0.1 . 1 . . . A 739 G C1' . 25998 1 78 . 1 1 10 10 G C2' C 13 72.36 0.1 . 1 . . . A 739 G C2' . 25998 1 79 . 1 1 10 10 G C3' C 13 71.02 0.1 . 1 . . . A 739 G C3' . 25998 1 80 . 1 1 10 10 G C4' C 13 80.10 0.1 . 1 . . . A 739 G C4' . 25998 1 81 . 1 1 10 10 G C8 C 13 134.93 0.1 . 1 . . . A 739 G C8 . 25998 1 82 . 1 1 11 11 C H1' H 1 5.40 0.03 . 1 . . . A 740 C H1' . 25998 1 83 . 1 1 11 11 C H2' H 1 4.39 0.03 . 1 . . . A 740 C H2' . 25998 1 84 . 1 1 11 11 C H5 H 1 5.45 0.03 . 1 . . . A 740 C H5 . 25998 1 85 . 1 1 11 11 C H6 H 1 7.71 0.03 . 1 . . . A 740 C H6 . 25998 1 86 . 1 1 11 11 C C1' C 13 91.06 0.1 . 1 . . . A 740 C C1' . 25998 1 87 . 1 1 11 11 C C2' C 13 72.64 0.1 . 1 . . . A 740 C C2' . 25998 1 88 . 1 1 11 11 C C5 C 13 95.05 0.1 . 1 . . . A 740 C C5 . 25998 1 89 . 1 1 11 11 C C6 C 13 138.02 0.1 . 1 . . . A 740 C C6 . 25998 1 90 . 1 1 12 12 A H1' H 1 5.95 0.03 . 1 . . . A 741 A H1' . 25998 1 91 . 1 1 12 12 A H2 H 1 7.37 0.03 . 1 . . . A 741 A H2 . 25998 1 92 . 1 1 12 12 A H2' H 1 4.55 0.03 . 1 . . . A 741 A H2' . 25998 1 93 . 1 1 12 12 A H8 H 1 8.05 0.03 . 1 . . . A 741 A H8 . 25998 1 94 . 1 1 12 12 A C1' C 13 90.24 0.1 . 1 . . . A 741 A C1' . 25998 1 95 . 1 1 12 12 A C2 C 13 150.63 0.1 . 1 . . . A 741 A C2 . 25998 1 96 . 1 1 12 12 A C2' C 13 72.93 0.1 . 1 . . . A 741 A C2' . 25998 1 97 . 1 1 12 12 A C8 C 13 136.74 0.1 . 1 . . . A 741 A C8 . 25998 1 98 . 1 1 13 13 C H1' H 1 5.37 0.03 . 1 . . . A 742 C H1' . 25998 1 99 . 1 1 13 13 C H2' H 1 4.39 0.03 . 1 . . . A 742 C H2' . 25998 1 100 . 1 1 13 13 C H5 H 1 5.25 0.03 . 1 . . . A 742 C H5 . 25998 1 101 . 1 1 13 13 C H6 H 1 7.52 0.03 . 1 . . . A 742 C H6 . 25998 1 102 . 1 1 13 13 C C1' C 13 90.84 0.1 . 1 . . . A 742 C C1' . 25998 1 103 . 1 1 13 13 C C2' C 13 72.64 0.1 . 1 . . . A 742 C C2' . 25998 1 104 . 1 1 13 13 C C5 C 13 94.61 0.1 . 1 . . . A 742 C C5 . 25998 1 105 . 1 1 13 13 C C6 C 13 137.81 0.1 . 1 . . . A 742 C C6 . 25998 1 106 . 1 1 14 14 A H1' H 1 5.92 0.03 . 1 . . . A 743 A H1' . 25998 1 107 . 1 1 14 14 A H2 H 1 7.30 0.03 . 1 . . . A 743 A H2 . 25998 1 108 . 1 1 14 14 A H2' H 1 4.48 0.03 . 1 . . . A 743 A H2' . 25998 1 109 . 1 1 14 14 A H8 H 1 8.00 0.03 . 1 . . . A 743 A H8 . 25998 1 110 . 1 1 14 14 A C1' C 13 90.41 0.1 . 1 . . . A 743 A C1' . 25998 1 111 . 1 1 14 14 A C2 C 13 150.51 0.1 . 1 . . . A 743 A C2 . 25998 1 112 . 1 1 14 14 A C2' C 13 72.82 0.1 . 1 . . . A 743 A C2' . 25998 1 113 . 1 1 14 14 A C8 C 13 136.94 0.1 . 1 . . . A 743 A C8 . 25998 1 114 . 1 1 15 15 U H1' H 1 5.43 0.03 . 1 . . . A 744 U H1' . 25998 1 115 . 1 1 15 15 U H2' H 1 4.39 0.03 . 1 . . . A 744 U H2' . 25998 1 116 . 1 1 15 15 U H5 H 1 5.00 0.03 . 1 . . . A 744 U H5 . 25998 1 117 . 1 1 15 15 U H6 H 1 7.52 0.03 . 1 . . . A 744 U H6 . 25998 1 118 . 1 1 15 15 U C1' C 13 90.52 0.1 . 1 . . . A 744 U C1' . 25998 1 119 . 1 1 15 15 U C2' C 13 72.63 0.1 . 1 . . . A 744 U C2' . 25998 1 120 . 1 1 15 15 U C5 C 13 100.44 0.1 . 1 . . . A 744 U C5 . 25998 1 121 . 1 1 15 15 U C6 C 13 138.13 0.1 . 1 . . . A 744 U C6 . 25998 1 122 . 1 1 16 16 G H1' H 1 5.75 0.03 . 1 . . . A 745 G H1' . 25998 1 123 . 1 1 16 16 G H2' H 1 4.43 0.03 . 1 . . . A 745 G H2' . 25998 1 124 . 1 1 16 16 G H3' H 1 4.43 0.03 . 1 . . . A 745 G H3' . 25998 1 125 . 1 1 16 16 G H8 H 1 7.57 0.03 . 1 . . . A 745 G H8 . 25998 1 126 . 1 1 16 16 G C1' C 13 89.62 0.1 . 1 . . . A 745 G C1' . 25998 1 127 . 1 1 16 16 G C2' C 13 71.04 0.1 . 1 . . . A 745 G C2' . 25998 1 128 . 1 1 16 16 G C3' C 13 80.31 0.1 . 1 . . . A 745 G C3' . 25998 1 129 . 1 1 16 16 G C8 C 13 133.70 0.1 . 1 . . . A 745 G C8 . 25998 1 130 . 1 1 17 17 C H1' H 1 5.62 0.03 . 1 . . . A 746 C H1' . 25998 1 131 . 1 1 17 17 C H2' H 1 4.18 0.03 . 1 . . . A 746 C H2' . 25998 1 132 . 1 1 17 17 C H5 H 1 5.62 0.03 . 1 . . . A 746 C H5 . 25998 1 133 . 1 1 17 17 C H6 H 1 7.71 0.03 . 1 . . . A 746 C H6 . 25998 1 134 . 1 1 17 17 C C1' C 13 89.57 0.1 . 1 . . . A 746 C C1' . 25998 1 135 . 1 1 17 17 C C2' C 13 73.78 0.1 . 1 . . . A 746 C C2' . 25998 1 136 . 1 1 17 17 C C5 C 13 95.67 0.1 . 1 . . . A 746 C C5 . 25998 1 137 . 1 1 17 17 C C6 C 13 139.29 0.1 . 1 . . . A 746 C C6 . 25998 1 138 . 1 1 18 18 U H1' H 1 5.82 0.03 . 1 . . . A 747 U H1' . 25998 1 139 . 1 1 18 18 U H2' H 1 4.38 0.03 . 1 . . . A 747 U H2' . 25998 1 140 . 1 1 18 18 U H3' H 1 4.45 0.03 . 1 . . . A 747 U H3' . 25998 1 141 . 1 1 18 18 U H4' H 1 4.31 0.03 . 1 . . . A 747 U H4' . 25998 1 142 . 1 1 18 18 U H5 H 1 5.81 0.03 . 1 . . . A 747 U H5 . 25998 1 143 . 1 1 18 18 U H5' H 1 4.15 0.03 . 2 . . . A 747 U H5' . 25998 1 144 . 1 1 18 18 U H5'' H 1 4.03 0.03 . 2 . . . A 747 U H5'' . 25998 1 145 . 1 1 18 18 U H6 H 1 7.84 0.03 . 1 . . . A 747 U H6 . 25998 1 146 . 1 1 18 18 U C1' C 13 87.86 0.1 . 1 . . . A 747 U C1' . 25998 1 147 . 1 1 18 18 U C2' C 13 72.83 0.1 . 1 . . . A 747 U C2' . 25998 1 148 . 1 1 18 18 U C3' C 13 74.48 0.1 . 1 . . . A 747 U C3' . 25998 1 149 . 1 1 18 18 U C4' C 13 82.70 0.1 . 1 . . . A 747 U C4' . 25998 1 150 . 1 1 18 18 U C5 C 13 102.47 0.1 . 1 . . . A 747 U C5 . 25998 1 151 . 1 1 18 18 U C5' C 13 64.74 0.1 . 1 . . . A 747 U C5' . 25998 1 152 . 1 1 18 18 U C6 C 13 140.97 0.1 . 1 . . . A 747 U C6 . 25998 1 153 . 1 1 19 19 U H1' H 1 5.53 0.03 . 1 . . . A 748 U H1' . 25998 1 154 . 1 1 19 19 U H2' H 1 4.11 0.03 . 1 . . . A 748 U H2' . 25998 1 155 . 1 1 19 19 U H3' H 1 4.43 0.03 . 1 . . . A 748 U H3' . 25998 1 156 . 1 1 19 19 U H4' H 1 3.80 0.03 . 1 . . . A 748 U H4' . 25998 1 157 . 1 1 19 19 U H5 H 1 5.67 0.03 . 1 . . . A 748 U H5 . 25998 1 158 . 1 1 19 19 U H6 H 1 7.59 0.03 . 1 . . . A 748 U H6 . 25998 1 159 . 1 1 19 19 U C1' C 13 87.18 0.1 . 1 . . . A 748 U C1' . 25998 1 160 . 1 1 19 19 U C2' C 13 73.36 0.1 . 1 . . . A 748 U C2' . 25998 1 161 . 1 1 19 19 U C3' C 13 74.71 0.1 . 1 . . . A 748 U C3' . 25998 1 162 . 1 1 19 19 U C4' C 13 83.11 0.1 . 1 . . . A 748 U C4' . 25998 1 163 . 1 1 19 19 U C5 C 13 102.54 0.1 . 1 . . . A 748 U C5 . 25998 1 164 . 1 1 19 19 U C6 C 13 140.84 0.1 . 1 . . . A 748 U C6 . 25998 1 165 . 1 1 20 20 U H1' H 1 5.87 0.03 . 1 . . . A 749 U H1' . 25998 1 166 . 1 1 20 20 U H2' H 1 4.30 0.03 . 1 . . . A 749 U H2' . 25998 1 167 . 1 1 20 20 U H3' H 1 4.72 0.03 . 1 . . . A 749 U H3' . 25998 1 168 . 1 1 20 20 U H4' H 1 4.39 0.03 . 1 . . . A 749 U H4' . 25998 1 169 . 1 1 20 20 U H5 H 1 5.83 0.03 . 1 . . . A 749 U H5 . 25998 1 170 . 1 1 20 20 U H5' H 1 3.94 0.03 . 2 . . . A 749 U H5' . 25998 1 171 . 1 1 20 20 U H5'' H 1 3.92 0.03 . 2 . . . A 749 U H5'' . 25998 1 172 . 1 1 20 20 U H6 H 1 7.71 0.03 . 1 . . . A 749 U H6 . 25998 1 173 . 1 1 20 20 U C1' C 13 87.38 0.1 . 1 . . . A 749 U C1' . 25998 1 174 . 1 1 20 20 U C2' C 13 73.04 0.1 . 1 . . . A 749 U C2' . 25998 1 175 . 1 1 20 20 U C3' C 13 74.55 0.1 . 1 . . . A 749 U C3' . 25998 1 176 . 1 1 20 20 U C4' C 13 82.44 0.1 . 1 . . . A 749 U C4' . 25998 1 177 . 1 1 20 20 U C5 C 13 102.86 0.1 . 1 . . . A 749 U C5 . 25998 1 178 . 1 1 20 20 U C5' C 13 65.46 0.1 . 1 . . . A 749 U C5' . 25998 1 179 . 1 1 20 20 U C6 C 13 141.21 0.1 . 1 . . . A 749 U C6 . 25998 1 180 . 1 1 21 21 A H1' H 1 6.08 0.03 . 1 . . . A 750 A H1' . 25998 1 181 . 1 1 21 21 A H2 H 1 8.16 0.03 . 1 . . . A 750 A H2 . 25998 1 182 . 1 1 21 21 A H2' H 1 4.88 0.03 . 1 . . . A 750 A H2' . 25998 1 183 . 1 1 21 21 A H4' H 1 4.62 0.03 . 1 . . . A 750 A H4' . 25998 1 184 . 1 1 21 21 A H8 H 1 8.54 0.03 . 1 . . . A 750 A H8 . 25998 1 185 . 1 1 21 21 A C1' C 13 88.85 0.1 . 1 . . . A 750 A C1' . 25998 1 186 . 1 1 21 21 A C2 C 13 148.17 0.1 . 1 . . . A 750 A C2 . 25998 1 187 . 1 1 21 21 A C2' C 13 72.83 0.1 . 1 . . . A 750 A C2' . 25998 1 188 . 1 1 21 21 A C4' C 13 81.36 0.1 . 1 . . . A 750 A C4' . 25998 1 189 . 1 1 21 21 A C8 C 13 140.18 0.1 . 1 . . . A 750 A C8 . 25998 1 190 . 1 1 22 22 C H1' H 1 5.51 0.03 . 1 . . . A 751 C H1' . 25998 1 191 . 1 1 22 22 C H2' H 1 4.51 0.03 . 1 . . . A 751 C H2' . 25998 1 192 . 1 1 22 22 C H5 H 1 5.61 0.03 . 1 . . . A 751 C H5 . 25998 1 193 . 1 1 22 22 C H6 H 1 7.70 0.03 . 1 . . . A 751 C H6 . 25998 1 194 . 1 1 22 22 C C1' C 13 90.82 0.1 . 1 . . . A 751 C C1' . 25998 1 195 . 1 1 22 22 C C2' C 13 70.72 0.1 . 1 . . . A 751 C C2' . 25998 1 196 . 1 1 22 22 C C5 C 13 95.36 0.1 . 1 . . . A 751 C C5 . 25998 1 197 . 1 1 22 22 C C6 C 13 138.84 0.1 . 1 . . . A 751 C C6 . 25998 1 198 . 1 1 23 23 A H1' H 1 5.99 0.03 . 1 . . . A 752 A H1' . 25998 1 199 . 1 1 23 23 A H2 H 1 7.36 0.03 . 1 . . . A 752 A H2 . 25998 1 200 . 1 1 23 23 A H2' H 1 4.53 0.03 . 1 . . . A 752 A H2' . 25998 1 201 . 1 1 23 23 A H8 H 1 8.08 0.03 . 1 . . . A 752 A H8 . 25998 1 202 . 1 1 23 23 A C1' C 13 90.50 0.1 . 1 . . . A 752 A C1' . 25998 1 203 . 1 1 23 23 A C2 C 13 150.52 0.1 . 1 . . . A 752 A C2 . 25998 1 204 . 1 1 23 23 A C2' C 13 72.86 0.1 . 1 . . . A 752 A C2' . 25998 1 205 . 1 1 23 23 A C8 C 13 137.16 0.1 . 1 . . . A 752 A C8 . 25998 1 206 . 1 1 24 24 U H1' H 1 5.46 0.03 . 1 . . . A 753 U H1' . 25998 1 207 . 1 1 24 24 U H2' H 1 4.50 0.03 . 1 . . . A 753 U H2' . 25998 1 208 . 1 1 24 24 U H5 H 1 5.04 0.03 . 1 . . . A 753 U H5 . 25998 1 209 . 1 1 24 24 U H6 H 1 7.55 0.03 . 1 . . . A 753 U H6 . 25998 1 210 . 1 1 24 24 U C1' C 13 90.36 0.1 . 1 . . . A 753 U C1' . 25998 1 211 . 1 1 24 24 U C2' C 13 72.69 0.1 . 1 . . . A 753 U C2' . 25998 1 212 . 1 1 24 24 U C5 C 13 100.32 0.1 . 1 . . . A 753 U C5 . 25998 1 213 . 1 1 24 24 U C6 C 13 138.28 0.1 . 1 . . . A 753 U C6 . 25998 1 214 . 1 1 25 25 G H1' H 1 5.75 0.03 . 1 . . . A 754 G H1' . 25998 1 215 . 1 1 25 25 G H2' H 1 4.46 0.03 . 1 . . . A 754 G H2' . 25998 1 216 . 1 1 25 25 G H8 H 1 7.63 0.03 . 1 . . . A 754 G H8 . 25998 1 217 . 1 1 25 25 G C1' C 13 90.07 0.1 . 1 . . . A 754 G C1' . 25998 1 218 . 1 1 25 25 G C2' C 13 72.66 0.1 . 1 . . . A 754 G C2' . 25998 1 219 . 1 1 25 25 G C8 C 13 133.70 0.1 . 1 . . . A 754 G C8 . 25998 1 220 . 1 1 26 26 U H1' H 1 5.48 0.03 . 1 . . . A 755 U H1' . 25998 1 221 . 1 1 26 26 U H2' H 1 4.59 0.03 . 1 . . . A 755 U H2' . 25998 1 222 . 1 1 26 26 U H5 H 1 5.04 0.03 . 1 . . . A 755 U H5 . 25998 1 223 . 1 1 26 26 U H6 H 1 7.67 0.03 . 1 . . . A 755 U H6 . 25998 1 224 . 1 1 26 26 U C1' C 13 90.72 0.1 . 1 . . . A 755 U C1' . 25998 1 225 . 1 1 26 26 U C2' C 13 72.56 0.1 . 1 . . . A 755 U C2' . 25998 1 226 . 1 1 26 26 U C5 C 13 100.34 0.1 . 1 . . . A 755 U C5 . 25998 1 227 . 1 1 26 26 U C6 C 13 138.56 0.1 . 1 . . . A 755 U C6 . 25998 1 228 . 1 1 27 27 G H1' H 1 5.76 0.03 . 1 . . . A 756 G H1' . 25998 1 229 . 1 1 27 27 G H2' H 1 4.51 0.03 . 1 . . . A 756 G H2' . 25998 1 230 . 1 1 27 27 G H8 H 1 7.57 0.03 . 1 . . . A 756 G H8 . 25998 1 231 . 1 1 27 27 G C1' C 13 90.21 0.1 . 1 . . . A 756 G C1' . 25998 1 232 . 1 1 27 27 G C2' C 13 72.63 0.1 . 1 . . . A 756 G C2' . 25998 1 233 . 1 1 27 27 G C8 C 13 133.40 0.1 . 1 . . . A 756 G C8 . 25998 1 234 . 1 1 28 28 U H1' H 1 5.52 0.03 . 1 . . . A 757 U H1' . 25998 1 235 . 1 1 28 28 U H2' H 1 4.22 0.03 . 1 . . . A 757 U H2' . 25998 1 236 . 1 1 28 28 U H4' H 1 4.35 0.03 . 1 . . . A 757 U H4' . 25998 1 237 . 1 1 28 28 U H5 H 1 5.39 0.03 . 1 . . . A 757 U H5 . 25998 1 238 . 1 1 28 28 U H6 H 1 7.61 0.03 . 1 . . . A 757 U H6 . 25998 1 239 . 1 1 28 28 U C1' C 13 90.08 0.1 . 1 . . . A 757 U C1' . 25998 1 240 . 1 1 28 28 U C2' C 13 73.34 0.1 . 1 . . . A 757 U C2' . 25998 1 241 . 1 1 28 28 U C4' C 13 80.45 0.1 . 1 . . . A 757 U C4' . 25998 1 242 . 1 1 28 28 U C5 C 13 101.63 0.1 . 1 . . . A 757 U C5 . 25998 1 243 . 1 1 28 28 U C6 C 13 138.18 0.1 . 1 . . . A 757 U C6 . 25998 1 244 . 1 1 29 29 U H1' H 1 5.71 0.03 . 1 . . . A 758 U H1' . 25998 1 245 . 1 1 29 29 U H2' H 1 4.19 0.03 . 1 . . . A 758 U H2' . 25998 1 246 . 1 1 29 29 U H3' H 1 4.53 0.03 . 1 . . . A 758 U H3' . 25998 1 247 . 1 1 29 29 U H4' H 1 4.32 0.03 . 1 . . . A 758 U H4' . 25998 1 248 . 1 1 29 29 U H5 H 1 5.62 0.03 . 1 . . . A 758 U H5 . 25998 1 249 . 1 1 29 29 U H6 H 1 7.70 0.03 . 1 . . . A 758 U H6 . 25998 1 250 . 1 1 29 29 U C1' C 13 88.54 0.1 . 1 . . . A 758 U C1' . 25998 1 251 . 1 1 29 29 U C2' C 13 72.85 0.1 . 1 . . . A 758 U C2' . 25998 1 252 . 1 1 29 29 U C3' C 13 73.37 0.1 . 1 . . . A 758 U C3' . 25998 1 253 . 1 1 29 29 U C4' C 13 81.91 0.1 . 1 . . . A 758 U C4' . 25998 1 254 . 1 1 29 29 U C5 C 13 102.16 0.1 . 1 . . . A 758 U C5 . 25998 1 255 . 1 1 29 29 U C6 C 13 140.79 0.1 . 1 . . . A 758 U C6 . 25998 1 256 . 1 1 30 30 U H1' H 1 5.68 0.03 . 1 . . . A 759 U H1' . 25998 1 257 . 1 1 30 30 U H2' H 1 4.19 0.03 . 1 . . . A 759 U H2' . 25998 1 258 . 1 1 30 30 U H3' H 1 4.54 0.03 . 1 . . . A 759 U H3' . 25998 1 259 . 1 1 30 30 U H4' H 1 4.28 0.03 . 1 . . . A 759 U H4' . 25998 1 260 . 1 1 30 30 U H5 H 1 5.66 0.03 . 1 . . . A 759 U H5 . 25998 1 261 . 1 1 30 30 U H6 H 1 7.60 0.03 . 1 . . . A 759 U H6 . 25998 1 262 . 1 1 30 30 U C1' C 13 88.15 0.1 . 1 . . . A 759 U C1' . 25998 1 263 . 1 1 30 30 U C2' C 13 72.99 0.1 . 1 . . . A 759 U C2' . 25998 1 264 . 1 1 30 30 U C3' C 13 73.93 0.1 . 1 . . . A 759 U C3' . 25998 1 265 . 1 1 30 30 U C4' C 13 82.12 0.1 . 1 . . . A 759 U C4' . 25998 1 266 . 1 1 30 30 U C5 C 13 102.30 0.1 . 1 . . . A 759 U C5 . 25998 1 267 . 1 1 30 30 U C6 C 13 140.86 0.1 . 1 . . . A 759 U C6 . 25998 1 268 . 1 1 31 31 A H1' H 1 5.93 0.03 . 1 . . . A 760 A H1' . 25998 1 269 . 1 1 31 31 A H2 H 1 7.93 0.03 . 1 . . . A 760 A H2 . 25998 1 270 . 1 1 31 31 A H2' H 1 4.72 0.03 . 1 . . . A 760 A H2' . 25998 1 271 . 1 1 31 31 A H3' H 1 4.44 0.03 . 1 . . . A 760 A H3' . 25998 1 272 . 1 1 31 31 A H4' H 1 4.46 0.03 . 1 . . . A 760 A H4' . 25998 1 273 . 1 1 31 31 A H5' H 1 4.09 0.03 . 2 . . . A 760 A H5' . 25998 1 274 . 1 1 31 31 A H5'' H 1 4.07 0.03 . 2 . . . A 760 A H5'' . 25998 1 275 . 1 1 31 31 A H8 H 1 8.24 0.03 . 1 . . . A 760 A H8 . 25998 1 276 . 1 1 31 31 A C1' C 13 87.27 0.1 . 1 . . . A 760 A C1' . 25998 1 277 . 1 1 31 31 A C2 C 13 152.28 0.1 . 1 . . . A 760 A C2 . 25998 1 278 . 1 1 31 31 A C2' C 13 74.07 0.1 . 1 . . . A 760 A C2' . 25998 1 279 . 1 1 31 31 A C4' C 13 82.21 0.1 . 1 . . . A 760 A C4' . 25998 1 280 . 1 1 31 31 A C8 C 13 139.10 0.1 . 1 . . . A 760 A C8 . 25998 1 281 . 1 1 32 32 G H1' H 1 5.75 0.03 . 1 . . . A 761 G H1' . 25998 1 282 . 1 1 32 32 G H2' H 1 4.79 0.03 . 1 . . . A 761 G H2' . 25998 1 283 . 1 1 32 32 G H3' H 1 4.59 0.03 . 1 . . . A 761 G H3' . 25998 1 284 . 1 1 32 32 G H4' H 1 4.54 0.03 . 1 . . . A 761 G H4' . 25998 1 285 . 1 1 32 32 G H5' H 1 4.38 0.03 . 2 . . . A 761 G H5' . 25998 1 286 . 1 1 32 32 G H5'' H 1 4.21 0.03 . 2 . . . A 761 G H5'' . 25998 1 287 . 1 1 32 32 G H8 H 1 7.82 0.03 . 1 . . . A 761 G H8 . 25998 1 288 . 1 1 32 32 G C1' C 13 89.10 0.1 . 1 . . . A 761 G C1' . 25998 1 289 . 1 1 32 32 G C2' C 13 72.60 0.1 . 1 . . . A 761 G C2' . 25998 1 290 . 1 1 32 32 G C3' C 13 72.73 0.1 . 1 . . . A 761 G C3' . 25998 1 291 . 1 1 32 32 G C4' C 13 81.22 0.1 . 1 . . . A 761 G C4' . 25998 1 292 . 1 1 32 32 G C5' C 13 64.90 0.1 . 1 . . . A 761 G C5' . 25998 1 293 . 1 1 32 32 G C8 C 13 136.53 0.1 . 1 . . . A 761 G C8 . 25998 1 294 . 1 1 33 33 U H1' H 1 5.64 0.03 . 1 . . . A 762 U H1' . 25998 1 295 . 1 1 33 33 U H2' H 1 4.63 0.03 . 1 . . . A 762 U H2' . 25998 1 296 . 1 1 33 33 U H3' H 1 4.29 0.03 . 1 . . . A 762 U H3' . 25998 1 297 . 1 1 33 33 U H4' H 1 4.49 0.03 . 1 . . . A 762 U H4' . 25998 1 298 . 1 1 33 33 U H5 H 1 5.61 0.03 . 1 . . . A 762 U H5 . 25998 1 299 . 1 1 33 33 U H5' H 1 4.17 0.03 . 2 . . . A 762 U H5' . 25998 1 300 . 1 1 33 33 U H5'' H 1 4.43 0.03 . 2 . . . A 762 U H5'' . 25998 1 301 . 1 1 33 33 U H6 H 1 7.79 0.03 . 1 . . . A 762 U H6 . 25998 1 302 . 1 1 33 33 U C1' C 13 90.26 0.1 . 1 . . . A 762 U C1' . 25998 1 303 . 1 1 33 33 U C2' C 13 71.31 0.1 . 1 . . . A 762 U C2' . 25998 1 304 . 1 1 33 33 U C3' C 13 72.98 0.1 . 1 . . . A 762 U C3' . 25998 1 305 . 1 1 33 33 U C4' C 13 81.03 0.1 . 1 . . . A 762 U C4' . 25998 1 306 . 1 1 33 33 U C5 C 13 101.94 0.1 . 1 . . . A 762 U C5 . 25998 1 307 . 1 1 33 33 U C5' C 13 63.11 0.1 . 1 . . . A 762 U C5' . 25998 1 308 . 1 1 33 33 U C6 C 13 139.47 0.1 . 1 . . . A 762 U C6 . 25998 1 309 . 1 1 34 34 C H1' H 1 5.59 0.03 . 1 . . . A 763 C H1' . 25998 1 310 . 1 1 34 34 C H2' H 1 4.59 0.03 . 1 . . . A 763 C H2' . 25998 1 311 . 1 1 34 34 C H5 H 1 5.77 0.03 . 1 . . . A 763 C H5 . 25998 1 312 . 1 1 34 34 C H6 H 1 7.93 0.03 . 1 . . . A 763 C H6 . 25998 1 313 . 1 1 34 34 C C1' C 13 90.82 0.1 . 1 . . . A 763 C C1' . 25998 1 314 . 1 1 34 34 C C2' C 13 72.76 0.1 . 1 . . . A 763 C C2' . 25998 1 315 . 1 1 34 34 C C5 C 13 95.45 0.1 . 1 . . . A 763 C C5 . 25998 1 316 . 1 1 34 34 C C6 C 13 139.46 0.1 . 1 . . . A 763 C C6 . 25998 1 317 . 1 1 35 35 G H1' H 1 5.67 0.03 . 1 . . . A 764 G H1' . 25998 1 318 . 1 1 35 35 G H2' H 1 4.59 0.03 . 1 . . . A 764 G H2' . 25998 1 319 . 1 1 35 35 G H8 H 1 7.53 0.03 . 1 . . . A 764 G H8 . 25998 1 320 . 1 1 35 35 G C1' C 13 90.24 0.1 . 1 . . . A 764 G C1' . 25998 1 321 . 1 1 35 35 G C2' C 13 70.60 0.1 . 1 . . . A 764 G C2' . 25998 1 322 . 1 1 35 35 G C8 C 13 133.75 0.1 . 1 . . . A 764 G C8 . 25998 1 323 . 1 1 36 36 A H1' H 1 5.92 0.03 . 1 . . . A 765 A H1' . 25998 1 324 . 1 1 36 36 A H2 H 1 7.38 0.03 . 1 . . . A 765 A H2 . 25998 1 325 . 1 1 36 36 A H2' H 1 4.67 0.03 . 1 . . . A 765 A H2' . 25998 1 326 . 1 1 36 36 A H8 H 1 7.77 0.03 . 1 . . . A 765 A H8 . 25998 1 327 . 1 1 36 36 A C1' C 13 90.16 0.1 . 1 . . . A 765 A C1' . 25998 1 328 . 1 1 36 36 A C2 C 13 150.59 0.1 . 1 . . . A 765 A C2 . 25998 1 329 . 1 1 36 36 A C2' C 13 70.09 0.1 . 1 . . . A 765 A C2' . 25998 1 330 . 1 1 36 36 A C8 C 13 136.63 0.1 . 1 . . . A 765 A C8 . 25998 1 331 . 1 1 37 37 G H1' H 1 5.65 0.03 . 1 . . . A 766 G H1' . 25998 1 332 . 1 1 37 37 G H8 H 1 7.23 0.03 . 1 . . . A 766 G H8 . 25998 1 333 . 1 1 37 37 G C1' C 13 89.96 0.1 . 1 . . . A 766 G C1' . 25998 1 334 . 1 1 37 37 G C8 C 13 133.01 0.1 . 1 . . . A 766 G C8 . 25998 1 335 . 1 1 38 38 C H1' H 1 5.52 0.03 . 1 . . . A 767 C H1' . 25998 1 336 . 1 1 38 38 C H5 H 1 5.18 0.03 . 1 . . . A 767 C H5 . 25998 1 337 . 1 1 38 38 C H6 H 1 7.61 0.03 . 1 . . . A 767 C H6 . 25998 1 338 . 1 1 38 38 C C1' C 13 91.26 0.1 . 1 . . . A 767 C C1' . 25998 1 339 . 1 1 38 38 C C5 C 13 94.40 0.1 . 1 . . . A 767 C C5 . 25998 1 340 . 1 1 38 38 C C6 C 13 138.27 0.1 . 1 . . . A 767 C C6 . 25998 1 341 . 1 1 39 39 C H5 H 1 5.50 0.03 . 1 . . . A 768 C H5 . 25998 1 342 . 1 1 39 39 C H6 H 1 7.78 0.03 . 1 . . . A 768 C H6 . 25998 1 343 . 1 1 39 39 C C6 C 13 138.69 0.1 . 1 . . . A 768 C C6 . 25998 1 stop_ save_