data_17083 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 17083 _Entry.Title ; Structure of a conserved retroviral RNA packaging element by NMR spectroscopy and cryo-electron tomography ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-07-28 _Entry.Accession_date 2010-07-28 _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 . _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 Michael Summers . F. . 17083 2 Rossitza Irobalieva . N. . 17083 3 Blanton Tolbert . . . 17083 4 Adjoa Smalls-Manty . . . 17083 5 Kilali Iyalla . . . 17083 6 Kelsey Loeliger . . . 17083 7 Victoria D'Souza . . . 17083 8 Htet Khant . . . 17083 9 Michael Schmid . . . 17083 10 Eric Garcia . . . 17083 11 Alice Telesnitsky . . . 17083 12 Wah Chiu . . . 17083 13 Yasuyuki Miyazaki . . . 17083 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 . 'not applicable' 'not applicable' . 17083 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID cryo-ET . 17083 NMR . 17083 packaging . 17083 retrovirus . 17083 RNA . 17083 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 17083 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '1H chemical shifts' 208 17083 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 . . 2010-12-01 2010-07-28 update BMRB 'update entry citation' 17083 1 . . 2010-10-14 2010-07-28 original author 'original release' 17083 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2L1F 'BMRB Entry Tracking System' 17083 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 17083 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 20933521 _Citation.Full_citation . _Citation.Title 'Structure of a conserved retroviral RNA packaging element by NMR spectroscopy and cryo-electron tomography.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Mol. Biol.' _Citation.Journal_name_full 'Journal of molecular biology' _Citation.Journal_volume 404 _Citation.Journal_issue 5 _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 751 _Citation.Page_last 772 _Citation.Year 2010 _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 Yasuyuki Miyazaki . . . 17083 1 2 Rossitza Irobalieva . N. . 17083 1 3 Blanton Tolbert . S. . 17083 1 4 Adjoa Smalls-Mantey . . . 17083 1 5 Kilali Iyalla . . . 17083 1 6 Kelsey Loeliger . . . 17083 1 7 Victoria Khant . . . 17083 1 8 Htet Schmid . . . 17083 1 9 Michael Garcia . F. . 17083 1 10 Eric Telesnitsky . L. . 17083 1 11 Alice Chiu . . . 17083 1 12 Wah Summers . . . 17083 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 17083 _Assembly.ID 1 _Assembly.Name 65-MER _Assembly.BMRB_code . _Assembly.Number_of_components 2 _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 (65-MER)' 1 $RNA_(65-MER) A . no native no no . . . 17083 1 2 'RNA (66-MER)' 2 $RNA_(66-MER) B . yes native no no . . . 17083 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_RNA_(65-MER) _Entity.Sf_category entity _Entity.Sf_framecode RNA_(65-MER) _Entity.Entry_ID 17083 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name RNA_(65-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 ; GGCGGACCCGUGGUGGAACA GACGUGUUCGGAACACCCGG CCGCAACCCUGGGAGACGUC CCAGG ; _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 65 _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 21071.766 _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 . G . 17083 1 2 . G . 17083 1 3 . C . 17083 1 4 . G . 17083 1 5 . G . 17083 1 6 . A . 17083 1 7 . C . 17083 1 8 . C . 17083 1 9 . C . 17083 1 10 . G . 17083 1 11 . U . 17083 1 12 . G . 17083 1 13 . G . 17083 1 14 . U . 17083 1 15 . G . 17083 1 16 . G . 17083 1 17 . A . 17083 1 18 . A . 17083 1 19 . C . 17083 1 20 . A . 17083 1 21 . G . 17083 1 22 . A . 17083 1 23 . C . 17083 1 24 . G . 17083 1 25 . U . 17083 1 26 . G . 17083 1 27 . U . 17083 1 28 . U . 17083 1 29 . C . 17083 1 30 . G . 17083 1 31 . G . 17083 1 32 . A . 17083 1 33 . A . 17083 1 34 . C . 17083 1 35 . A . 17083 1 36 . C . 17083 1 37 . C . 17083 1 38 . C . 17083 1 39 . G . 17083 1 40 . G . 17083 1 41 . C . 17083 1 42 . C . 17083 1 43 . G . 17083 1 44 . C . 17083 1 45 . A . 17083 1 46 . A . 17083 1 47 . C . 17083 1 48 . C . 17083 1 49 . C . 17083 1 50 . U . 17083 1 51 . G . 17083 1 52 . G . 17083 1 53 . G . 17083 1 54 . A . 17083 1 55 . G . 17083 1 56 . A . 17083 1 57 . C . 17083 1 58 . G . 17083 1 59 . U . 17083 1 60 . C . 17083 1 61 . C . 17083 1 62 . C . 17083 1 63 . A . 17083 1 64 . G . 17083 1 65 . G . 17083 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 17083 1 . G 2 2 17083 1 . C 3 3 17083 1 . G 4 4 17083 1 . G 5 5 17083 1 . A 6 6 17083 1 . C 7 7 17083 1 . C 8 8 17083 1 . C 9 9 17083 1 . G 10 10 17083 1 . U 11 11 17083 1 . G 12 12 17083 1 . G 13 13 17083 1 . U 14 14 17083 1 . G 15 15 17083 1 . G 16 16 17083 1 . A 17 17 17083 1 . A 18 18 17083 1 . C 19 19 17083 1 . A 20 20 17083 1 . G 21 21 17083 1 . A 22 22 17083 1 . C 23 23 17083 1 . G 24 24 17083 1 . U 25 25 17083 1 . G 26 26 17083 1 . U 27 27 17083 1 . U 28 28 17083 1 . C 29 29 17083 1 . G 30 30 17083 1 . G 31 31 17083 1 . A 32 32 17083 1 . A 33 33 17083 1 . C 34 34 17083 1 . A 35 35 17083 1 . C 36 36 17083 1 . C 37 37 17083 1 . C 38 38 17083 1 . G 39 39 17083 1 . G 40 40 17083 1 . C 41 41 17083 1 . C 42 42 17083 1 . G 43 43 17083 1 . C 44 44 17083 1 . A 45 45 17083 1 . A 46 46 17083 1 . C 47 47 17083 1 . C 48 48 17083 1 . C 49 49 17083 1 . U 50 50 17083 1 . G 51 51 17083 1 . G 52 52 17083 1 . G 53 53 17083 1 . A 54 54 17083 1 . G 55 55 17083 1 . A 56 56 17083 1 . C 57 57 17083 1 . G 58 58 17083 1 . U 59 59 17083 1 . C 60 60 17083 1 . C 61 61 17083 1 . C 62 62 17083 1 . A 63 63 17083 1 . G 64 64 17083 1 . G 65 65 17083 1 stop_ save_ save_RNA_(66-MER) _Entity.Sf_category entity _Entity.Sf_framecode RNA_(66-MER) _Entity.Entry_ID 17083 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name RNA_(66-MER) _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polyribonucleotide _Entity.Polymer_type_details . _Entity.Polymer_strand_ID B _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GGCGGACCCGUGGUGGAACA GACGUGUUCGGAACACCCGG CCGCAACCCUGGGAGACGUC CCAGGG ; _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 66 _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 21416.973 _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 . G . 17083 2 2 . G . 17083 2 3 . C . 17083 2 4 . G . 17083 2 5 . G . 17083 2 6 . A . 17083 2 7 . C . 17083 2 8 . C . 17083 2 9 . C . 17083 2 10 . G . 17083 2 11 . U . 17083 2 12 . G . 17083 2 13 . G . 17083 2 14 . U . 17083 2 15 . G . 17083 2 16 . G . 17083 2 17 . A . 17083 2 18 . A . 17083 2 19 . C . 17083 2 20 . A . 17083 2 21 . G . 17083 2 22 . A . 17083 2 23 . C . 17083 2 24 . G . 17083 2 25 . U . 17083 2 26 . G . 17083 2 27 . U . 17083 2 28 . U . 17083 2 29 . C . 17083 2 30 . G . 17083 2 31 . G . 17083 2 32 . A . 17083 2 33 . A . 17083 2 34 . C . 17083 2 35 . A . 17083 2 36 . C . 17083 2 37 . C . 17083 2 38 . C . 17083 2 39 . G . 17083 2 40 . G . 17083 2 41 . C . 17083 2 42 . C . 17083 2 43 . G . 17083 2 44 . C . 17083 2 45 . A . 17083 2 46 . A . 17083 2 47 . C . 17083 2 48 . C . 17083 2 49 . C . 17083 2 50 . U . 17083 2 51 . G . 17083 2 52 . G . 17083 2 53 . G . 17083 2 54 . A . 17083 2 55 . G . 17083 2 56 . A . 17083 2 57 . C . 17083 2 58 . G . 17083 2 59 . U . 17083 2 60 . C . 17083 2 61 . C . 17083 2 62 . C . 17083 2 63 . A . 17083 2 64 . G . 17083 2 65 . G . 17083 2 66 . G . 17083 2 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 17083 2 . G 2 2 17083 2 . C 3 3 17083 2 . G 4 4 17083 2 . G 5 5 17083 2 . A 6 6 17083 2 . C 7 7 17083 2 . C 8 8 17083 2 . C 9 9 17083 2 . G 10 10 17083 2 . U 11 11 17083 2 . G 12 12 17083 2 . G 13 13 17083 2 . U 14 14 17083 2 . G 15 15 17083 2 . G 16 16 17083 2 . A 17 17 17083 2 . A 18 18 17083 2 . C 19 19 17083 2 . A 20 20 17083 2 . G 21 21 17083 2 . A 22 22 17083 2 . C 23 23 17083 2 . G 24 24 17083 2 . U 25 25 17083 2 . G 26 26 17083 2 . U 27 27 17083 2 . U 28 28 17083 2 . C 29 29 17083 2 . G 30 30 17083 2 . G 31 31 17083 2 . A 32 32 17083 2 . A 33 33 17083 2 . C 34 34 17083 2 . A 35 35 17083 2 . C 36 36 17083 2 . C 37 37 17083 2 . C 38 38 17083 2 . G 39 39 17083 2 . G 40 40 17083 2 . C 41 41 17083 2 . C 42 42 17083 2 . G 43 43 17083 2 . C 44 44 17083 2 . A 45 45 17083 2 . A 46 46 17083 2 . C 47 47 17083 2 . C 48 48 17083 2 . C 49 49 17083 2 . U 50 50 17083 2 . G 51 51 17083 2 . G 52 52 17083 2 . G 53 53 17083 2 . A 54 54 17083 2 . G 55 55 17083 2 . A 56 56 17083 2 . C 57 57 17083 2 . G 58 58 17083 2 . U 59 59 17083 2 . C 60 60 17083 2 . C 61 61 17083 2 . C 62 62 17083 2 . A 63 63 17083 2 . G 64 64 17083 2 . G 65 65 17083 2 . G 66 66 17083 2 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 17083 _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 $RNA_(65-MER) . 11801 virus . 'Moloney Murine Leukemia Virus' 'Moloney Murine Leukemia Virus' MoMLV 00.061.1.02.014.00.001. Virus . Gammaretrovirus . . . . . . . . . . . . . . . . . . . . . . 17083 1 2 2 $RNA_(66-MER) . 11801 virus . 'Moloney Murine Leukemia Virus' 'Moloney Murine Leukemia Virus' MoMLV 00.061.1.02.014.00.001. Virus . Gammaretrovirus . . . . . . . . . . . . . . . . . . . . . . 17083 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 17083 _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 $RNA_(65-MER) . 'recombinant technology' 'Moloney Murine Leukemia Virus' . . . . . . . . . . . . . . . . . . . . . pMoMuLV-SL-CD-HDV . . . ; pMoMuLV-SL-CD-HDV was generated by PCR on pMoMuLV-SL-BCD-HDV, which contains the proviral DNA of MoMuLV. DNA fragments were amplified with oligonucleotide MoMuLV-309f (5′-CCAGTGAATTCTAATACGACTCACTATAGGCGG-ACCCGTGGTGGAACTGACGAGTTCGGAACAC-3′), carrying an Eco RI site and a T7 RNA polymerase promoter, and oligonucleotide M13r. The amplified product was inserted in the pUC19 plasmid after EcoR I and Hind III digestions (New England Biolabs). ; . . 17083 1 2 2 $RNA_(66-MER) . 'recombinant technology' 'Moloney Murine Leukemia Virus' . . . . . . . . . . . . . . . . . . . . . pMoMuLV-SL-CD-HDV . . . ; pMoMuLV-SL-CD-HDV was generated by PCR on pMoMuLV-SL-BCD-HDV, which contains the proviral DNA of MoMuLV. DNA fragments were amplified with oligonucleotide MoMuLV-309f (5′-CCAGTGAATTCTAATACGACTCACTATAGGCGG-ACCCGTGGTGGAACTGACGAGTTCGGAACAC-3′), carrying an Eco RI site and a T7 RNA polymerase promoter, and oligonucleotide M13r. The amplified product was inserted in the pUC19 plasmid after EcoR I and Hind III digestions (New England Biolabs). ; . . 17083 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 17083 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'A series of RNAs containing different isotopic labelings were used, as described in the associated paper.' _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 (65-MER)' [U-2H] . . 1 $RNA_(65-MER) . . . 400 800 uM 100 . . . 17083 1 2 D2O 'natural abundance' . . . . . . 100 . . % 100 . . . 17083 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 17083 _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' 80 5 mM 17083 1 pH 7.0 0.1 pH 17083 1 pressure 1 . atm 17083 1 temperature 273 . K 17083 1 stop_ save_ ############################ # Computer software used # ############################ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 17083 _Software.ID 1 _Software.Name CYANA _Software.Version 2.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 17083 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 17083 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 17083 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _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 17083 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _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 17083 _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 DRX . 800 . . . 17083 1 2 spectrometer_2 Bruker DRX . 600 . . . 17083 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 17083 _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 NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17083 1 2 '2D NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17083 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 17083 _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 water protons . . . . ppm 4.776 internal direct 1.0 . . . . . . . . . 17083 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 17083 _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 NOESY' . . . 17083 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 . 2 2 1 1 G H1' H 1 6.0231 . . 1 . . . . 1 G H1' . 17083 1 2 . 2 2 1 1 G H2' H 1 4.9414 . . 1 . . . . 1 G H2' . 17083 1 3 . 2 2 1 1 G H3' H 1 4.9116 . . 1 . . . . 1 G H3' . 17083 1 4 . 2 2 1 1 G H8 H 1 8.1912 . . 1 . . . . 1 G H8 . 17083 1 5 . 2 2 2 2 G H1' H 1 5.8502 . . 1 . . . . 2 G H1' . 17083 1 6 . 2 2 2 2 G H3' H 1 4.8124 . . 1 . . . . 2 G H3' . 17083 1 7 . 2 2 2 2 G H8 H 1 7.9551 . . 1 . . . . 2 G H8 . 17083 1 8 . 2 2 3 3 C H1' H 1 5.5538 . . 1 . . . . 3 C H1' . 17083 1 9 . 2 2 3 3 C H2' H 1 4.4825 . . 1 . . . . 3 C H2' . 17083 1 10 . 2 2 3 3 C H3' H 1 4.6814 . . 1 . . . . 3 C H3' . 17083 1 11 . 2 2 3 3 C H5 H 1 5.1824 . . 1 . . . . 3 C H5 . 17083 1 12 . 2 2 3 3 C H6 H 1 7.6468 . . 1 . . . . 3 C H6 . 17083 1 13 . 2 2 4 4 G H1' H 1 5.6486 . . 1 . . . . 4 G H1' . 17083 1 14 . 2 2 4 4 G H8 H 1 7.3760 . . 1 . . . . 4 G H8 . 17083 1 15 . 2 2 5 5 G H1' H 1 5.6382 . . 1 . . . . 5 G H1' . 17083 1 16 . 2 2 5 5 G H2' H 1 4.3107 . . 1 . . . . 5 G H2' . 17083 1 17 . 2 2 5 5 G H8 H 1 7.1580 . . 1 . . . . 5 G H8 . 17083 1 18 . 2 2 6 6 A H1' H 1 5.9570 . . 1 . . . . 6 A H1' . 17083 1 19 . 2 2 6 6 A H2 H 1 8.0468 . . 1 . . . . 6 A H2 . 17083 1 20 . 2 2 6 6 A H2' H 1 4.7277 . . 1 . . . . 6 A H2' . 17083 1 21 . 2 2 6 6 A H3' H 1 4.4414 . . 1 . . . . 6 A H3' . 17083 1 22 . 2 2 6 6 A H8 H 1 7.1580 . . 1 . . . . 6 A H8 . 17083 1 23 . 2 2 7 7 C H1' H 1 5.8656 . . 1 . . . . 7 C H1' . 17083 1 24 . 2 2 7 7 C H2' H 1 4.2733 . . 1 . . . . 7 C H2' . 17083 1 25 . 2 2 7 7 C H5 H 1 5.6983 . . 1 . . . . 7 C H5 . 17083 1 26 . 2 2 7 7 C H6 H 1 7.6091 . . 1 . . . . 7 C H6 . 17083 1 27 . 2 2 8 8 C H1' H 1 5.7701 . . 1 . . . . 8 C H1' . 17083 1 28 . 2 2 8 8 C H2' H 1 4.4673 . . 1 . . . . 8 C H2' . 17083 1 29 . 2 2 8 8 C H5 H 1 5.6435 . . 1 . . . . 8 C H5 . 17083 1 30 . 2 2 8 8 C H6 H 1 7.7130 . . 1 . . . . 8 C H6 . 17083 1 31 . 2 2 10 10 G H1' H 1 5.9007 . . 1 . . . . 10 G H1' . 17083 1 32 . 2 2 10 10 G H2' H 1 4.5028 . . 1 . . . . 10 G H2' . 17083 1 33 . 2 2 10 10 G H3' H 1 4.8045 . . 1 . . . . 10 G H3' . 17083 1 34 . 2 2 10 10 G H8 H 1 7.7319 . . 1 . . . . 10 G H8 . 17083 1 35 . 2 2 11 11 U H1' H 1 6.0063 . . 1 . . . . 11 U H1' . 17083 1 36 . 2 2 11 11 U H2' H 1 4.4860 . . 1 . . . . 11 U H2' . 17083 1 37 . 2 2 11 11 U H3' H 1 4.7524 . . 1 . . . . 11 U H3' . 17083 1 38 . 2 2 11 11 U H5 H 1 5.9584 . . 1 . . . . 11 U H5 . 17083 1 39 . 2 2 11 11 U H6 H 1 7.9006 . . 1 . . . . 11 U H6 . 17083 1 40 . 2 2 12 12 G H1' H 1 5.8119 . . 1 . . . . 12 G H1' . 17083 1 41 . 2 2 12 12 G H2' H 1 4.9194 . . 1 . . . . 12 G H2' . 17083 1 42 . 2 2 12 12 G H3' H 1 4.5887 . . 1 . . . . 12 G H3' . 17083 1 43 . 2 2 12 12 G H8 H 1 7.5578 . . 1 . . . . 12 G H8 . 17083 1 44 . 2 2 13 13 G H1' H 1 5.8183 . . 1 . . . . 13 G H1' . 17083 1 45 . 2 2 13 13 G H3' H 1 4.5966 . . 1 . . . . 13 G H3' . 17083 1 46 . 2 2 13 13 G H8 H 1 7.3563 . . 1 . . . . 13 G H8 . 17083 1 47 . 2 2 14 14 U H1' H 1 5.6207 . . 1 . . . . 14 U H1' . 17083 1 48 . 2 2 14 14 U H5 H 1 5.1128 . . 1 . . . . 14 U H5 . 17083 1 49 . 2 2 14 14 U H6 H 1 7.7193 . . 1 . . . . 14 U H6 . 17083 1 50 . 2 2 15 15 G H1' H 1 6.0378 . . 1 . . . . 15 G H1' . 17083 1 51 . 2 2 15 15 G H3' H 1 4.8244 . . 1 . . . . 15 G H3' . 17083 1 52 . 2 2 15 15 G H8 H 1 7.7928 . . 1 . . . . 15 G H8 . 17083 1 53 . 2 2 16 16 G H1' H 1 5.6982 . . 1 . . . . 16 G H1' . 17083 1 54 . 2 2 16 16 G H2' H 1 4.8186 . . 1 . . . . 16 G H2' . 17083 1 55 . 2 2 16 16 G H8 H 1 7.8280 . . 1 . . . . 16 G H8 . 17083 1 56 . 2 2 17 17 A H1' H 1 5.9266 . . 1 . . . . 17 A H1' . 17083 1 57 . 2 2 17 17 A H2 H 1 7.0798 . . 1 . . . . 17 A H2 . 17083 1 58 . 2 2 17 17 A H2' H 1 4.7164 . . 1 . . . . 17 A H2' . 17083 1 59 . 2 2 17 17 A H3' H 1 4.5964 . . 1 . . . . 17 A H3' . 17083 1 60 . 2 2 17 17 A H8 H 1 7.8387 . . 1 . . . . 17 A H8 . 17083 1 61 . 2 2 18 18 A H1' H 1 5.8729 . . 1 . . . . 18 A H1' . 17083 1 62 . 2 2 18 18 A H2 H 1 7.6377 . . 1 . . . . 18 A H2 . 17083 1 63 . 2 2 18 18 A H2' H 1 4.5930 . . 1 . . . . 18 A H2' . 17083 1 64 . 2 2 18 18 A H8 H 1 7.7719 . . 1 . . . . 18 A H8 . 17083 1 65 . 2 2 19 19 C H1' H 1 5.3127 . . 1 . . . . 19 C H1' . 17083 1 66 . 2 2 19 19 C H2' H 1 4.2981 . . 1 . . . . 19 C H2' . 17083 1 67 . 2 2 19 19 C H3' H 1 4.3757 . . 1 . . . . 19 C H3' . 17083 1 68 . 2 2 19 19 C H5 H 1 5.1615 . . 1 . . . . 19 C H5 . 17083 1 69 . 2 2 19 19 C H6 H 1 7.3348 . . 1 . . . . 19 C H6 . 17083 1 70 . 2 2 20 20 A H1' H 1 6.0144 . . 1 . . . . 20 A H1' . 17083 1 71 . 2 2 20 20 A H2 H 1 7.2762 . . 1 . . . . 20 A H2 . 17083 1 72 . 2 2 20 20 A H2' H 1 4.8181 . . 1 . . . . 20 A H2' . 17083 1 73 . 2 2 20 20 A H8 H 1 7.9490 . . 1 . . . . 20 A H8 . 17083 1 74 . 2 2 21 21 G H1' H 1 5.3104 . . 1 . . . . 21 G H1' . 17083 1 75 . 2 2 21 21 G H2' H 1 4.0939 . . 1 . . . . 21 G H2' . 17083 1 76 . 2 2 21 21 G H3' H 1 4.7084 . . 1 . . . . 21 G H3' . 17083 1 77 . 2 2 21 21 G H8 H 1 7.0151 . . 1 . . . . 21 G H8 . 17083 1 78 . 2 2 22 22 A H1' H 1 5.9014 . . 1 . . . . 22 A H1' . 17083 1 79 . 2 2 22 22 A H2 H 1 8.0472 . . 1 . . . . 22 A H2 . 17083 1 80 . 2 2 22 22 A H3' H 1 4.6141 . . 1 . . . . 22 A H3' . 17083 1 81 . 2 2 22 22 A H8 H 1 8.5937 . . 1 . . . . 22 A H8 . 17083 1 82 . 2 2 23 23 C H1' H 1 5.6367 . . 1 . . . . 23 C H1' . 17083 1 83 . 2 2 23 23 C H5 H 1 5.5574 . . 1 . . . . 23 C H5 . 17083 1 84 . 2 2 23 23 C H6 H 1 8.0954 . . 1 . . . . 23 C H6 . 17083 1 85 . 2 2 24 24 G H1' H 1 5.9499 . . 1 . . . . 24 G H1' . 17083 1 86 . 2 2 24 24 G H2' H 1 4.7732 . . 1 . . . . 24 G H2' . 17083 1 87 . 2 2 24 24 G H3' H 1 4.6575 . . 1 . . . . 24 G H3' . 17083 1 88 . 2 2 24 24 G H8 H 1 7.6802 . . 1 . . . . 24 G H8 . 17083 1 89 . 2 2 25 25 U H1' H 1 3.8665 . . 1 . . . . 25 U H1' . 17083 1 90 . 2 2 25 25 U H2' H 1 4.8520 . . 1 . . . . 25 U H2' . 17083 1 91 . 2 2 25 25 U H3' H 1 4.3357 . . 1 . . . . 25 U H3' . 17083 1 92 . 2 2 25 25 U H5 H 1 5.8894 . . 1 . . . . 25 U H5 . 17083 1 93 . 2 2 25 25 U H6 H 1 8.2432 . . 1 . . . . 25 U H6 . 17083 1 94 . 2 2 26 26 G H1' H 1 5.8218 . . 1 . . . . 26 G H1' . 17083 1 95 . 2 2 26 26 G H2' H 1 4.3088 . . 1 . . . . 26 G H2' . 17083 1 96 . 2 2 26 26 G H3' H 1 4.0656 . . 1 . . . . 26 G H3' . 17083 1 97 . 2 2 26 26 G H4' H 1 2.7904 . . 1 . . . . 26 G H4' . 17083 1 98 . 2 2 26 26 G H8 H 1 7.6096 . . 1 . . . . 26 G H8 . 17083 1 99 . 2 2 27 27 U H1' H 1 5.5093 . . 1 . . . . 27 U H1' . 17083 1 100 . 2 2 27 27 U H6 H 1 7.8127 . . 1 . . . . 27 U H6 . 17083 1 101 . 2 2 28 28 U H1' H 1 5.3607 . . 1 . . . . 28 U H1' . 17083 1 102 . 2 2 28 28 U H5 H 1 5.1092 . . 1 . . . . 28 U H5 . 17083 1 103 . 2 2 28 28 U H6 H 1 7.7123 . . 1 . . . . 28 U H6 . 17083 1 104 . 2 2 29 29 C H1' H 1 5.4070 . . 1 . . . . 29 C H1' . 17083 1 105 . 2 2 29 29 C H5 H 1 5.4948 . . 1 . . . . 29 C H5 . 17083 1 106 . 2 2 29 29 C H6 H 1 7.6322 . . 1 . . . . 29 C H6 . 17083 1 107 . 2 2 30 30 G H1' H 1 5.1808 . . 1 . . . . 30 G H1' . 17083 1 108 . 2 2 30 30 G H2' H 1 3.9167 . . 1 . . . . 30 G H2' . 17083 1 109 . 2 2 30 30 G H3' H 1 4.4457 . . 1 . . . . 30 G H3' . 17083 1 110 . 2 2 30 30 G H8 H 1 7.3182 . . 1 . . . . 30 G H8 . 17083 1 111 . 2 2 31 31 G H1' H 1 5.3854 . . 1 . . . . 31 G H1' . 17083 1 112 . 2 2 31 31 G H2' H 1 4.5363 . . 1 . . . . 31 G H2' . 17083 1 113 . 2 2 31 31 G H3' H 1 4.5838 . . 1 . . . . 31 G H3' . 17083 1 114 . 2 2 31 31 G H8 H 1 7.4980 . . 1 . . . . 31 G H8 . 17083 1 115 . 2 2 32 32 A H1' H 1 5.7731 . . 1 . . . . 32 A H1' . 17083 1 116 . 2 2 32 32 A H2 H 1 7.7568 . . 1 . . . . 32 A H2 . 17083 1 117 . 2 2 32 32 A H2' H 1 4.6570 . . 1 . . . . 32 A H2' . 17083 1 118 . 2 2 32 32 A H8 H 1 8.0874 . . 1 . . . . 32 A H8 . 17083 1 119 . 2 2 33 33 A H1' H 1 5.7731 . . 1 . . . . 33 A H1' . 17083 1 120 . 2 2 33 33 A H2 H 1 8.0456 . . 1 . . . . 33 A H2 . 17083 1 121 . 2 2 33 33 A H8 H 1 8.1253 . . 1 . . . . 33 A H8 . 17083 1 122 . 2 2 34 34 C H1' H 1 5.2386 . . 1 . . . . 34 C H1' . 17083 1 123 . 2 2 34 34 C H2' H 1 4.2931 . . 1 . . . . 34 C H2' . 17083 1 124 . 2 2 34 34 C H3' H 1 4.6072 . . 1 . . . . 34 C H3' . 17083 1 125 . 2 2 34 34 C H5 H 1 5.6418 . . 1 . . . . 34 C H5 . 17083 1 126 . 2 2 34 34 C H6 H 1 7.7740 . . 1 . . . . 34 C H6 . 17083 1 127 . 2 2 35 35 A H1' H 1 5.9626 . . 1 . . . . 35 A H1' . 17083 1 128 . 2 2 35 35 A H2 H 1 7.6545 . . 1 . . . . 35 A H2 . 17083 1 129 . 2 2 35 35 A H2' H 1 4.4905 . . 1 . . . . 35 A H2' . 17083 1 130 . 2 2 35 35 A H3' H 1 4.6866 . . 1 . . . . 35 A H3' . 17083 1 131 . 2 2 35 35 A H8 H 1 8.1495 . . 1 . . . . 35 A H8 . 17083 1 132 . 2 2 36 36 C H1' H 1 5.4477 . . 1 . . . . 36 C H1' . 17083 1 133 . 2 2 36 36 C H5 H 1 5.3041 . . 1 . . . . 36 C H5 . 17083 1 134 . 2 2 36 36 C H6 H 1 7.5497 . . 1 . . . . 36 C H6 . 17083 1 135 . 2 2 37 37 C H1' H 1 5.5044 . . 1 . . . . 37 C H1' . 17083 1 136 . 2 2 37 37 C H5 H 1 5.4419 . . 1 . . . . 37 C H5 . 17083 1 137 . 2 2 37 37 C H6 H 1 7.5848 . . 1 . . . . 37 C H6 . 17083 1 138 . 2 2 38 38 C H1' H 1 5.4600 . . 1 . . . . 38 C H1' . 17083 1 139 . 2 2 38 38 C H5 H 1 5.4616 . . 1 . . . . 38 C H5 . 17083 1 140 . 2 2 38 38 C H6 H 1 7.7496 . . 1 . . . . 38 C H6 . 17083 1 141 . 2 2 39 39 G H1' H 1 5.6538 . . 1 . . . . 39 G H1' . 17083 1 142 . 2 2 39 39 G H2' H 1 4.6818 . . 1 . . . . 39 G H2' . 17083 1 143 . 2 2 39 39 G H8 H 1 7.4752 . . 1 . . . . 39 G H8 . 17083 1 144 . 2 2 40 40 G H1' H 1 5.6932 . . 1 . . . . 40 G H1' . 17083 1 145 . 2 2 40 40 G H8 H 1 7.1151 . . 1 . . . . 40 G H8 . 17083 1 146 . 2 2 41 41 C H5 H 1 5.3205 . . 1 . . . . 41 C H5 . 17083 1 147 . 2 2 41 41 C H6 H 1 7.5315 . . 1 . . . . 41 C H6 . 17083 1 148 . 2 2 42 42 C H1' H 1 5.4056 . . 1 . . . . 42 C H1' . 17083 1 149 . 2 2 43 43 G H1' H 1 5.6118 . . 1 . . . . 43 G H1' . 17083 1 150 . 2 2 43 43 G H8 H 1 7.4220 . . 1 . . . . 43 G H8 . 17083 1 151 . 2 2 44 44 C H1' H 1 5.4419 . . 1 . . . . 44 C H1' . 17083 1 152 . 2 2 44 44 C H5 H 1 5.0401 . . 1 . . . . 44 C H5 . 17083 1 153 . 2 2 44 44 C H6 H 1 6.9160 . . 1 . . . . 44 C H6 . 17083 1 154 . 2 2 45 45 A H1' H 1 5.8225 . . 1 . . . . 45 A H1' . 17083 1 155 . 2 2 45 45 A H2 H 1 7.0680 . . 1 . . . . 45 A H2 . 17083 1 156 . 2 2 45 45 A H8 H 1 7.8454 . . 1 . . . . 45 A H8 . 17083 1 157 . 2 2 46 46 A H1' H 1 5.3569 . . 1 . . . . 46 A H1' . 17083 1 158 . 2 2 46 46 A H2 H 1 7.8959 . . 1 . . . . 46 A H2 . 17083 1 159 . 2 2 46 46 A H2' H 1 4.4504 . . 1 . . . . 46 A H2' . 17083 1 160 . 2 2 46 46 A H8 H 1 7.6511 . . 1 . . . . 46 A H8 . 17083 1 161 . 2 2 51 51 G H1' H 1 5.7745 . . 1 . . . . 51 G H1' . 17083 1 162 . 2 2 51 51 G H2' H 1 4.5832 . . 1 . . . . 51 G H2' . 17083 1 163 . 2 2 51 51 G H3' H 1 4.5974 . . 1 . . . . 51 G H3' . 17083 1 164 . 2 2 51 51 G H8 H 1 7.7134 . . 1 . . . . 51 G H8 . 17083 1 165 . 2 2 52 52 G H1' H 1 5.6524 . . 1 . . . . 52 G H1' . 17083 1 166 . 2 2 52 52 G H2' H 1 4.6761 . . 1 . . . . 52 G H2' . 17083 1 167 . 2 2 52 52 G H8 H 1 7.1528 . . 1 . . . . 52 G H8 . 17083 1 168 . 2 2 53 53 G H1' H 1 5.6902 . . 1 . . . . 53 G H1' . 17083 1 169 . 2 2 53 53 G H8 H 1 7.0561 . . 1 . . . . 53 G H8 . 17083 1 170 . 2 2 54 54 A H1' H 1 6.0389 . . 1 . . . . 54 A H1' . 17083 1 171 . 2 2 54 54 A H2 H 1 7.8688 . . 1 . . . . 54 A H2 . 17083 1 172 . 2 2 54 54 A H8 H 1 7.0732 . . 1 . . . . 54 A H8 . 17083 1 173 . 2 2 55 55 G H1' H 1 5.3442 . . 1 . . . . 55 G H1' . 17083 1 174 . 2 2 55 55 G H2' H 1 4.1123 . . 1 . . . . 55 G H2' . 17083 1 175 . 2 2 55 55 G H3' H 1 4.7077 . . 1 . . . . 55 G H3' . 17083 1 176 . 2 2 55 55 G H8 H 1 7.0180 . . 1 . . . . 55 G H8 . 17083 1 177 . 2 2 56 56 A H1' H 1 5.9079 . . 1 . . . . 56 A H1' . 17083 1 178 . 2 2 56 56 A H2 H 1 7.9908 . . 1 . . . . 56 A H2 . 17083 1 179 . 2 2 56 56 A H8 H 1 8.5838 . . 1 . . . . 56 A H8 . 17083 1 180 . 2 2 57 57 C H1' H 1 5.6634 . . 1 . . . . 57 C H1' . 17083 1 181 . 2 2 57 57 C H5 H 1 5.6113 . . 1 . . . . 57 C H5 . 17083 1 182 . 2 2 57 57 C H6 H 1 8.1494 . . 1 . . . . 57 C H6 . 17083 1 183 . 2 2 58 58 G H1' H 1 5.9506 . . 1 . . . . 58 G H1' . 17083 1 184 . 2 2 58 58 G H2' H 1 4.7732 . . 1 . . . . 58 G H2' . 17083 1 185 . 2 2 58 58 G H3' H 1 4.6700 . . 1 . . . . 58 G H3' . 17083 1 186 . 2 2 58 58 G H8 H 1 7.6511 . . 1 . . . . 58 G H8 . 17083 1 187 . 2 2 59 59 U H3' H 1 4.3375 . . 1 . . . . 59 U H3' . 17083 1 188 . 2 2 59 59 U H5 H 1 5.8894 . . 1 . . . . 59 U H5 . 17083 1 189 . 2 2 59 59 U H6 H 1 8.2717 . . 1 . . . . 59 U H6 . 17083 1 190 . 2 2 60 60 C H1' H 1 5.3090 . . 1 . . . . 60 C H1' . 17083 1 191 . 2 2 60 60 C H4' H 1 2.7614 . . 1 . . . . 60 C H4' . 17083 1 192 . 2 2 60 60 C H5 H 1 5.4980 . . 1 . . . . 60 C H5 . 17083 1 193 . 2 2 60 60 C H6 H 1 7.7670 . . 1 . . . . 60 C H6 . 17083 1 194 . 2 2 62 62 C H1' H 1 5.6570 . . 1 . . . . 62 C H1' . 17083 1 195 . 2 2 63 63 A H1' H 1 5.8692 . . 1 . . . . 63 A H1' . 17083 1 196 . 2 2 63 63 A H2 H 1 6.9221 . . 1 . . . . 63 A H2 . 17083 1 197 . 2 2 63 63 A H2' H 1 4.6194 . . 1 . . . . 63 A H2' . 17083 1 198 . 2 2 63 63 A H3' H 1 4.5553 . . 1 . . . . 63 A H3' . 17083 1 199 . 2 2 63 63 A H8 H 1 7.9498 . . 1 . . . . 63 A H8 . 17083 1 200 . 2 2 64 64 G H1' H 1 5.5785 . . 1 . . . . 64 G H1' . 17083 1 201 . 2 2 64 64 G H2' H 1 4.5232 . . 1 . . . . 64 G H2' . 17083 1 202 . 2 2 64 64 G H3' H 1 4.4106 . . 1 . . . . 64 G H3' . 17083 1 203 . 2 2 64 64 G H8 H 1 7.1018 . . 1 . . . . 64 G H8 . 17083 1 204 . 2 2 65 65 G H1' H 1 5.6613 . . 1 . . . . 65 G H1' . 17083 1 205 . 2 2 65 65 G H8 H 1 7.0881 . . 1 . . . . 65 G H8 . 17083 1 206 . 2 2 66 66 G H1' H 1 6.1145 . . 1 . . . . 66 G H1' . 17083 1 207 . 2 2 66 66 G H3' H 1 4.6467 . . 1 . . . . 66 G H3' . 17083 1 208 . 2 2 66 66 G H8 H 1 7.1880 . . 1 . . . . 66 G H8 . 17083 1 stop_ save_