data_19222 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 19222 _Entry.Title ; NMR Studies of DNA Support the Role of Pre-Existing Minor Groove Variations in Nucleosome Indirect Readout ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2013-05-03 _Entry.Accession_date 2013-05-03 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details "Using NMR to examine the properties of four dodecamers that together cover 39 bp of the 5' half of the strong nucleosome positioning sequence 601." _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 Xiaoqian Xu . . . 19222 2 Akli 'Ben Imeddourene' . . . 19222 3 Loussine Zargarian . . . 19222 4 Nicolas Foloppe . . . 19222 5 Olivier Mauffret . . . 19222 6 Brigitte Hartmann . . . 19222 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 3 19222 RDCs 1 19222 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '31P chemical shifts' 264 19222 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 . . 2015-03-30 2013-05-03 update author 'update entry citation, and data, etc.' 19222 1 . . 2013-06-06 2013-05-03 original author 'original release' 19222 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 19222 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 25102280 _Citation.Full_citation . _Citation.Title 'NMR Studies of DNA Support the Role of Pre-Existing Minor Groove Variations in Nucleosome Indirect Readout' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Biochemistry _Citation.Journal_name_full Biochemistry _Citation.Journal_volume 53 _Citation.Journal_issue 35 _Citation.Journal_ASTM . _Citation.Journal_ISSN 0006-2960 _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 5601 _Citation.Page_last 5612 _Citation.Year 2014 _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 Xiaoqian Xu . . . 19222 1 2 Akli 'Ben Imeddourene' . . . 19222 1 3 Loussine Zargarian . . . 19222 1 4 Nicolas Foloppe . . . 19222 1 5 Olivier Mauffret . . . 19222 1 6 Brigitte Hartmann . . . 19222 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 19222 _Assembly.ID 1 _Assembly.Name "Four dodecamers that together cover 39 bp of the 5' half of the strong nucleosome positioning sequence 601" _Assembly.BMRB_code . _Assembly.Number_of_components 8 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'DNA dodecamer 1-1' 1 $DNA_dodecamer_1-1 A . yes native no no . . . 19222 1 2 'DNA dodecamer 1-2' 2 $DNA_dodecamer_1-2 B . yes native no no . . . 19222 1 3 'DNA dodecamer 2-1' 3 $DNA_dodecamer_2-1 C . yes native no no . . . 19222 1 4 'DNA dodecamer 2-2' 4 $DNA_dodecamer_2-2 D . yes native no no . . . 19222 1 5 'DNA dodecamer 3-1' 5 $DNA_dodecamer_3-1 E . yes native no no . . . 19222 1 6 'DNA dodecamer 3-2' 6 $DNA_dodecamer_3-2 F . yes native no no . . . 19222 1 7 'DNA dodecamer 4-1' 7 $DNA_dodecamer_4-1 G . yes native no no . . . 19222 1 8 'DNA dodecamer 4-2' 8 $DNA_dodecamer_4-2 H . yes native no no . . . 19222 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_DNA_dodecamer_1-1 _Entity.Sf_category entity _Entity.Sf_framecode DNA_dodecamer_1-1 _Entity.Entry_ID 19222 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name DNA_dodecamer_1-1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polydeoxyribonucleotide _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code TCGTAGCAAGCT _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 12 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment "Four dodecamers that together cover 39 bp of the 5' half of the strong nucleosome positioning sequence 601" _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . DT . 19222 1 2 . DC . 19222 1 3 . DG . 19222 1 4 . DT . 19222 1 5 . DA . 19222 1 6 . DG . 19222 1 7 . DC . 19222 1 8 . DA . 19222 1 9 . DA . 19222 1 10 . DG . 19222 1 11 . DC . 19222 1 12 . DT . 19222 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 . DT 1 1 19222 1 . DC 2 2 19222 1 . DG 3 3 19222 1 . DT 4 4 19222 1 . DA 5 5 19222 1 . DG 6 6 19222 1 . DC 7 7 19222 1 . DA 8 8 19222 1 . DA 9 9 19222 1 . DG 10 10 19222 1 . DC 11 11 19222 1 . DT 12 12 19222 1 stop_ save_ save_DNA_dodecamer_1-2 _Entity.Sf_category entity _Entity.Sf_framecode DNA_dodecamer_1-2 _Entity.Entry_ID 19222 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name DNA_dodecamer_1-2 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polydeoxyribonucleotide _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code AGCTTGCTACGA _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 12 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment "Four dodecamers that together cover 39 bp of the 5' half of the strong nucleosome positioning sequence 601" _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . DA . 19222 2 2 . DG . 19222 2 3 . DC . 19222 2 4 . DT . 19222 2 5 . DT . 19222 2 6 . DG . 19222 2 7 . DC . 19222 2 8 . DT . 19222 2 9 . DA . 19222 2 10 . DC . 19222 2 11 . DG . 19222 2 12 . DA . 19222 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 . DA 1 1 19222 2 . DG 2 2 19222 2 . DC 3 3 19222 2 . DT 4 4 19222 2 . DT 5 5 19222 2 . DG 6 6 19222 2 . DC 7 7 19222 2 . DT 8 8 19222 2 . DA 9 9 19222 2 . DC 10 10 19222 2 . DG 11 11 19222 2 . DA 12 12 19222 2 stop_ save_ save_DNA_dodecamer_2-1 _Entity.Sf_category entity _Entity.Sf_framecode DNA_dodecamer_2-1 _Entity.Entry_ID 19222 _Entity.ID 3 _Entity.BMRB_code . _Entity.Name DNA_dodecamer_2-1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polydeoxyribonucleotide _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code GCTCTAGCACCG _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 12 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment "Four dodecamers that together cover 39 bp of the 5' half of the strong nucleosome positioning sequence 601" _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . DG . 19222 3 2 . DC . 19222 3 3 . DT . 19222 3 4 . DC . 19222 3 5 . DT . 19222 3 6 . DA . 19222 3 7 . DG . 19222 3 8 . DC . 19222 3 9 . DA . 19222 3 10 . DC . 19222 3 11 . DC . 19222 3 12 . DG . 19222 3 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 . DG 1 1 19222 3 . DC 2 2 19222 3 . DT 3 3 19222 3 . DC 4 4 19222 3 . DT 5 5 19222 3 . DA 6 6 19222 3 . DG 7 7 19222 3 . DC 8 8 19222 3 . DA 9 9 19222 3 . DC 10 10 19222 3 . DC 11 11 19222 3 . DG 12 12 19222 3 stop_ save_ save_DNA_dodecamer_2-2 _Entity.Sf_category entity _Entity.Sf_framecode DNA_dodecamer_2-2 _Entity.Entry_ID 19222 _Entity.ID 4 _Entity.BMRB_code . _Entity.Name DNA_dodecamer_2-2 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polydeoxyribonucleotide _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code CGGTGCTAGAGC _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 12 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment "Four dodecamers that together cover 39 bp of the 5' half of the strong nucleosome positioning sequence 601" _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . DC . 19222 4 2 . DG . 19222 4 3 . DG . 19222 4 4 . DT . 19222 4 5 . DG . 19222 4 6 . DC . 19222 4 7 . DT . 19222 4 8 . DA . 19222 4 9 . DG . 19222 4 10 . DA . 19222 4 11 . DG . 19222 4 12 . DC . 19222 4 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 . DC 1 1 19222 4 . DG 2 2 19222 4 . DG 3 3 19222 4 . DT 4 4 19222 4 . DG 5 5 19222 4 . DC 6 6 19222 4 . DT 7 7 19222 4 . DA 8 8 19222 4 . DG 9 9 19222 4 . DA 10 10 19222 4 . DG 11 11 19222 4 . DC 12 12 19222 4 stop_ save_ save_DNA_dodecamer_3-1 _Entity.Sf_category entity _Entity.Sf_framecode DNA_dodecamer_3-1 _Entity.Entry_ID 19222 _Entity.ID 5 _Entity.BMRB_code . _Entity.Name DNA_dodecamer_3-1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polydeoxyribonucleotide _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code CCGCTTAAACGC _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 12 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment "Four dodecamers that together cover 39 bp of the 5' half of the strong nucleosome positioning sequence 601" _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . DC . 19222 5 2 . DC . 19222 5 3 . DG . 19222 5 4 . DC . 19222 5 5 . DT . 19222 5 6 . DT . 19222 5 7 . DA . 19222 5 8 . DA . 19222 5 9 . DA . 19222 5 10 . DC . 19222 5 11 . DG . 19222 5 12 . DC . 19222 5 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 . DC 1 1 19222 5 . DC 2 2 19222 5 . DG 3 3 19222 5 . DC 4 4 19222 5 . DT 5 5 19222 5 . DT 6 6 19222 5 . DA 7 7 19222 5 . DA 8 8 19222 5 . DA 9 9 19222 5 . DC 10 10 19222 5 . DG 11 11 19222 5 . DC 12 12 19222 5 stop_ save_ save_DNA_dodecamer_3-2 _Entity.Sf_category entity _Entity.Sf_framecode DNA_dodecamer_3-2 _Entity.Entry_ID 19222 _Entity.ID 6 _Entity.BMRB_code . _Entity.Name DNA_dodecamer_3-2 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polydeoxyribonucleotide _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code GCGTTTAAGCGG _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 12 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment "Four dodecamers that together cover 39 bp of the 5' half of the strong nucleosome positioning sequence 601" _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . DG . 19222 6 2 . DC . 19222 6 3 . DG . 19222 6 4 . DT . 19222 6 5 . DT . 19222 6 6 . DT . 19222 6 7 . DA . 19222 6 8 . DA . 19222 6 9 . DG . 19222 6 10 . DC . 19222 6 11 . DG . 19222 6 12 . DG . 19222 6 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 . DG 1 1 19222 6 . DC 2 2 19222 6 . DG 3 3 19222 6 . DT 4 4 19222 6 . DT 5 5 19222 6 . DT 6 6 19222 6 . DA 7 7 19222 6 . DA 8 8 19222 6 . DG 9 9 19222 6 . DC 10 10 19222 6 . DG 11 11 19222 6 . DG 12 12 19222 6 stop_ save_ save_DNA_dodecamer_4-1 _Entity.Sf_category entity _Entity.Sf_framecode DNA_dodecamer_4-1 _Entity.Entry_ID 19222 _Entity.ID 7 _Entity.BMRB_code . _Entity.Name DNA_dodecamer_4-1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polydeoxyribonucleotide _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code CGCACGTACGCG _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 12 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment "Four dodecamers that together cover 39 bp of the 5' half of the strong nucleosome positioning sequence 601" _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . DC . 19222 7 2 . DG . 19222 7 3 . DC . 19222 7 4 . DA . 19222 7 5 . DC . 19222 7 6 . DG . 19222 7 7 . DT . 19222 7 8 . DA . 19222 7 9 . DC . 19222 7 10 . DG . 19222 7 11 . DC . 19222 7 12 . DG . 19222 7 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 . DC 1 1 19222 7 . DG 2 2 19222 7 . DC 3 3 19222 7 . DA 4 4 19222 7 . DC 5 5 19222 7 . DG 6 6 19222 7 . DT 7 7 19222 7 . DA 8 8 19222 7 . DC 9 9 19222 7 . DG 10 10 19222 7 . DC 11 11 19222 7 . DG 12 12 19222 7 stop_ save_ save_DNA_dodecamer_4-2 _Entity.Sf_category entity _Entity.Sf_framecode DNA_dodecamer_4-2 _Entity.Entry_ID 19222 _Entity.ID 8 _Entity.BMRB_code . _Entity.Name DNA_dodecamer_4-2 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polydeoxyribonucleotide _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code CGCGTACGTGCG _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 12 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment "Four dodecamers that together cover 39 bp of the 5' half of the strong nucleosome positioning sequence 601" _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . DC . 19222 8 2 . DG . 19222 8 3 . DC . 19222 8 4 . DG . 19222 8 5 . DT . 19222 8 6 . DA . 19222 8 7 . DC . 19222 8 8 . DG . 19222 8 9 . DT . 19222 8 10 . DG . 19222 8 11 . DC . 19222 8 12 . DG . 19222 8 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 . DC 1 1 19222 8 . DG 2 2 19222 8 . DC 3 3 19222 8 . DG 4 4 19222 8 . DT 5 5 19222 8 . DA 6 6 19222 8 . DC 7 7 19222 8 . DG 8 8 19222 8 . DT 9 9 19222 8 . DG 10 10 19222 8 . DC 11 11 19222 8 . DG 12 12 19222 8 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 19222 _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 $DNA_dodecamer_1-1 . . 'no natural source' . . . . . . . . . . . . . . . . . . . . . . . . . . . "Four dodecamers that together cover 39 bp of the 5' half of the strong nucleosome positioning sequence 601" . . 19222 1 2 2 $DNA_dodecamer_1-2 . . 'no natural source' . . . . . . . . . . . . . . . . . . . . . . . . . . . "Four dodecamers that together cover 39 bp of the 5' half of the strong nucleosome positioning sequence 601" . . 19222 1 3 3 $DNA_dodecamer_2-1 . . 'no natural source' . . . . . . . . . . . . . . . . . . . . . . . . . . . "Four dodecamers that together cover 39 bp of the 5' half of the strong nucleosome positioning sequence 601" . . 19222 1 4 4 $DNA_dodecamer_2-2 . . 'no natural source' . . . . . . . . . . . . . . . . . . . . . . . . . . . "Four dodecamers that together cover 39 bp of the 5' half of the strong nucleosome positioning sequence 601" . . 19222 1 5 5 $DNA_dodecamer_3-1 . . 'no natural source' . . . . . . . . . . . . . . . . . . . . . . . . . . . "Four dodecamers that together cover 39 bp of the 5' half of the strong nucleosome positioning sequence 601" . . 19222 1 6 6 $DNA_dodecamer_3-2 . . 'no natural source' . . . . . . . . . . . . . . . . . . . . . . . . . . . "Four dodecamers that together cover 39 bp of the 5' half of the strong nucleosome positioning sequence 601" . . 19222 1 7 7 $DNA_dodecamer_4-1 . . 'no natural source' . . . . . . . . . . . . . . . . . . . . . . . . . . . "Four dodecamers that together cover 39 bp of the 5' half of the strong nucleosome positioning sequence 601" . . 19222 1 8 8 $DNA_dodecamer_4-2 . . 'no natural source' . . . . . . . . . . . . . . . . . . . . . . . . . . . "Four dodecamers that together cover 39 bp of the 5' half of the strong nucleosome positioning sequence 601" . . 19222 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 19222 _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 $DNA_dodecamer_1-1 . 'chemical synthesis' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 19222 1 2 2 $DNA_dodecamer_1-2 . 'chemical synthesis' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 19222 1 3 3 $DNA_dodecamer_2-1 . 'chemical synthesis' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 19222 1 4 4 $DNA_dodecamer_2-2 . 'chemical synthesis' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 19222 1 5 5 $DNA_dodecamer_3-1 . 'chemical synthesis' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 19222 1 6 6 $DNA_dodecamer_3-2 . 'chemical synthesis' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 19222 1 7 7 $DNA_dodecamer_4-1 . 'chemical synthesis' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 19222 1 8 8 $DNA_dodecamer_4-2 . 'chemical synthesis' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 19222 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 19222 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; DNA Dodecamers Sequences: 5'-TCGTAGCAAGCT-3' 5'-GCTCTAGCACCG-3' 5'-CCGCTTAAACGC-3' 5'-CGCACGTACGCG-3' ; _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 'DNA dodecamer 1-1' 'natural abundance' . . 1 $DNA_dodecamer_1-1 . . 1.5 . . mM 0.05 . . . 19222 1 2 'DNA dodecamer 1-2' 'natural abundance' . . 2 $DNA_dodecamer_1-2 . . 1.5 . . mM 0.05 . . . 19222 1 3 'DNA dodecamer 2-1' 'natural abundance' . . 3 $DNA_dodecamer_2-1 . . 1.5 . . mM 0.05 . . . 19222 1 4 'DNA dodecamer 2-2' 'natural abundance' . . 4 $DNA_dodecamer_2-2 . . 1.5 . . mM 0.05 . . . 19222 1 5 'DNA dodecamer 3-1' 'natural abundance' . . 5 $DNA_dodecamer_3-1 . . 1.5 . . mM 0.05 . . . 19222 1 6 'DNA dodecamer 3-2' 'natural abundance' . . 6 $DNA_dodecamer_3-2 . . 1.5 . . mM 0.05 . . . 19222 1 7 'DNA dodecamer 4-1' 'natural abundance' . . 7 $DNA_dodecamer_4-1 . . 1.5 . . mM 0.05 . . . 19222 1 8 'DNA dodecamer 4-2' 'natural abundance' . . 8 $DNA_dodecamer_4-2 . . 1.5 . . mM 0.05 . . . 19222 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 19222 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.1 . M 19222 1 pH 6.5 . pH 19222 1 pressure 1 . atm 19222 1 temperature 293 . K 19222 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 19222 _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' 0.1 . M 19222 2 pH 6.5 . pH 19222 2 pressure 1 . atm 19222 2 temperature 303 . K 19222 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 19222 _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' 0.1 . M 19222 3 pH 6.5 . pH 19222 3 pressure 1 . atm 19222 3 temperature 313 . K 19222 3 stop_ save_ save_sample_conditions_4 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_4 _Sample_condition_list.Entry_ID 19222 _Sample_condition_list.ID 4 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.1 . M 19222 4 pH 6.5 . pH 19222 4 pressure 1 . atm 19222 4 temperature 298 . K 19222 4 stop_ save_ ############################ # Computer software used # ############################ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 19222 _Software.ID 1 _Software.Name SPARKY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'T. D. Goddard and D. G. Kneller, SPARKY 3, University of California, San Francisco' . . 19222 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 19222 1 stop_ save_ save_NMRPIPE _Software.Sf_category software _Software.Sf_framecode NMRPIPE _Software.Entry_ID 19222 _Software.ID 2 _Software.Name NMRPIPE _Software.Version 8.2 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'F. Delaglio, S. Grzesiek, G. W. Vuister, G. Zhu, J. Pfeifer and A. Bax: NMRPipe: a multidimensional spectral processing system based on UNIX pipes. J. Biomol. NMR. 6, 277-293 (1995).' . . 19222 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 19222 2 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 19222 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 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 19222 _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 . 500 . . . 19222 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 19222 _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 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . 2 . . . . . . . . . . . 19222 1 2 '2D 1H-1H TOCSY' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . 2 . . . . . . . . . . . 19222 1 3 '2D 1H-13C HSQC' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_4 . . . 1 $spectrometer_1 . . . . 2 . . . . . . . . . . . 19222 1 4 '2D 1H-13C TROSY' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 anisotropic . . 1 $sample_conditions_4 . . . 1 $spectrometer_1 . . . . 2 . . . . . . . . . . . 19222 1 5 '2D 1H-13C HSQC' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 anisotropic . . 1 $sample_conditions_4 . . . 1 $spectrometer_1 . . . . 2 . . . . . . . . . . . 19222 1 6 '2D 1H-31P Hetero - Correlation' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . 2 . . . . . . . . . . . 19222 1 stop_ save_ save_NMR_spectrometer_expt _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt _NMR_spec_expt.Entry_ID 19222 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name . _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $SPARKY _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . 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 19222 _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 C 13 TSP 'methyl carbon' . . . . ppm 0 internal direct 1.0 . . . . . . . . . 19222 1 H 1 TSP 'methyl protons' . . . . ppm 0 internal direct 1.0 . . . . . . . . . 19222 1 P 31 TMP phosphorus . . . . ppm 0 internal direct 1.0 . . . . . . . . . 19222 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 19222 _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 0.02 _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 5 '2D 1H-31P Hetero - Correlation' . . . 19222 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 2 2 DC P P 31 -4.24 0.02 . . . . . . 2 C P . 19222 1 2 . 1 1 3 3 DG P P 31 -3.80 0.02 . . . . . . 3 G P . 19222 1 3 . 1 1 4 4 DT P P 31 -4.45 0.02 . . . . . . 4 T P . 19222 1 4 . 1 1 5 5 DA P P 31 -4.29 0.02 . . . . . . 5 A P . 19222 1 5 . 1 1 6 6 DG P P 31 -4.20 0.02 . . . . . . 6 G P . 19222 1 6 . 1 1 7 7 DC P P 31 -4.17 0.02 . . . . . . 7 C P . 19222 1 7 . 1 1 8 8 DA P P 31 -4.24 0.02 . . . . . . 8 A P . 19222 1 8 . 1 1 9 9 DA P P 31 -4.27 0.02 . . . . . . 9 A P . 19222 1 9 . 1 1 10 10 DG P P 31 -4.20 0.02 . . . . . . 10 G P . 19222 1 10 . 1 1 11 11 DC P P 31 -4.07 0.02 . . . . . . 11 C P . 19222 1 11 . 1 1 12 12 DT P P 31 -4.18 0.02 . . . . . . 12 T P . 19222 1 12 . 2 2 2 2 DG P P 31 -4.20 0.02 . . . . . . 14 G P . 19222 1 13 . 2 2 3 3 DC P P 31 -4.18 0.02 . . . . . . 15 C P . 19222 1 14 . 2 2 4 4 DT P P 31 -4.39 0.02 . . . . . . 16 T P . 19222 1 15 . 2 2 5 5 DT P P 31 -4.46 0.02 . . . . . . 17 T P . 19222 1 16 . 2 2 6 6 DG P P 31 -4.17 0.02 . . . . . . 18 G P . 19222 1 17 . 2 2 7 7 DC P P 31 -4.05 0.02 . . . . . . 19 C P . 19222 1 18 . 2 2 8 8 DT P P 31 -4.50 0.02 . . . . . . 20 T P . 19222 1 19 . 2 2 9 9 DA P P 31 -4.18 0.02 . . . . . . 21 A P . 19222 1 20 . 2 2 10 10 DC P P 31 -4.20 0.02 . . . . . . 22 C P . 19222 1 21 . 2 2 11 11 DG P P 31 -4.06 0.02 . . . . . . 23 G P . 19222 1 22 . 2 2 12 12 DA P P 31 -4.11 0.02 . . . . . . 24 A P . 19222 1 23 . 3 3 2 2 DC P P 31 -4.19 0.02 . . . . . . 2 C P . 19222 1 24 . 3 3 3 3 DT P P 31 -4.45 0.02 . . . . . . 3 T P . 19222 1 25 . 3 3 4 4 DC P P 31 -4.25 0.02 . . . . . . 4 C P . 19222 1 26 . 3 3 5 5 DT P P 31 -4.37 0.02 . . . . . . 5 T P . 19222 1 27 . 3 3 6 6 DA P P 31 -4.25 0.02 . . . . . . 6 A P . 19222 1 28 . 3 3 7 7 DG P P 31 -4.27 0.02 . . . . . . 7 G P . 19222 1 29 . 3 3 8 8 DC P P 31 -4.1 0.02 . . . . . . 8 C P . 19222 1 30 . 3 3 9 9 DA P P 31 -4.25 0.02 . . . . . . 9 A P . 19222 1 31 . 3 3 10 10 DC P P 31 -4.33 0.02 . . . . . . 10 C P . 19222 1 32 . 3 3 11 11 DC P P 31 -4.12 0.02 . . . . . . 11 C P . 19222 1 33 . 3 3 12 12 DG P P 31 -3.83 0.02 . . . . . . 12 G P . 19222 1 34 . 4 4 2 2 DG P P 31 -4.07 0.02 . . . . . . 14 G P . 19222 1 35 . 4 4 3 3 DG P P 31 -3.85 0.02 . . . . . . 15 G P . 19222 1 36 . 4 4 4 4 DT P P 31 -4.45 0.02 . . . . . . 16 T P . 19222 1 37 . 4 4 5 5 DG P P 31 -4.31 0.02 . . . . . . 17 G P . 19222 1 38 . 4 4 6 6 DC P P 31 -4.09 0.02 . . . . . . 18 C P . 19222 1 39 . 4 4 7 7 DT P P 31 -4.5 0.02 . . . . . . 19 T P . 19222 1 40 . 4 4 8 8 DA P P 31 -4.25 0.02 . . . . . . 20 A P . 19222 1 41 . 4 4 9 9 DG P P 31 -4.24 0.02 . . . . . . 21 G P . 19222 1 42 . 4 4 10 10 DA P P 31 -4.02 0.02 . . . . . . 22 A P . 19222 1 43 . 4 4 11 11 DG P P 31 -4.24 0.02 . . . . . . 23 G P . 19222 1 44 . 4 4 12 12 DC P P 31 -4.05 0.02 . . . . . . 24 C P . 19222 1 45 . 5 5 2 2 DC P P 31 -4.11 0.02 . . . . . . 2 C P . 19222 1 46 . 5 5 3 3 DG P P 31 -3.92 0.02 . . . . . . 3 G P . 19222 1 47 . 5 5 4 4 DC P P 31 -4.12 0.02 . . . . . . 4 C P . 19222 1 48 . 5 5 5 5 DT P P 31 -4.35 0.02 . . . . . . 5 T P . 19222 1 49 . 5 5 6 6 DT P P 31 -4.46 0.02 . . . . . . 6 T P . 19222 1 50 . 5 5 7 7 DA P P 31 -4.23 0.02 . . . . . . 7 A P . 19222 1 51 . 5 5 8 8 DA P P 31 -4.34 0.02 . . . . . . 8 A P . 19222 1 52 . 5 5 9 9 DA P P 31 -4.18 0.02 . . . . . . 9 A P . 19222 1 53 . 5 5 10 10 DC P P 31 -4.27 0.02 . . . . . . 10 C P . 19222 1 54 . 5 5 11 11 DG P P 31 -4.22 0.02 . . . . . . 11 G P . 19222 1 55 . 5 5 12 12 DC P P 31 -4.07 0.02 . . . . . . 12 C P . 19222 1 56 . 6 6 2 2 DC P P 31 -4.29 0.02 . . . . . . 14 C P . 19222 1 57 . 6 6 3 3 DG P P 31 -3.87 0.02 . . . . . . 15 G P . 19222 1 58 . 6 6 4 4 DT P P 31 -4.41 0.02 . . . . . . 16 T P . 19222 1 59 . 6 6 5 5 DT P P 31 -4.51 0.02 . . . . . . 17 T P . 19222 1 60 . 6 6 6 6 DT P P 31 -4.41 0.02 . . . . . . 18 T P . 19222 1 61 . 6 6 7 7 DA P P 31 -4.29 0.02 . . . . . . 19 A P . 19222 1 62 . 6 6 8 8 DA P P 31 -4.18 0.02 . . . . . . 20 A P . 19222 1 63 . 6 6 9 9 DG P P 31 -4.19 0.02 . . . . . . 21 G P . 19222 1 64 . 6 6 10 10 DC P P 31 -4.17 0.02 . . . . . . 22 C P . 19222 1 65 . 6 6 11 11 DG P P 31 -4.12 0.02 . . . . . . 23 G P . 19222 1 66 . 6 6 12 12 DG P P 31 -3.93 0.02 . . . . . . 24 G P . 19222 1 67 . 7 7 2 2 DG P P 31 -4.14 0.02 . . . . . . 2 G P . 19222 1 68 . 7 7 3 3 DC P P 31 -4.25 0.02 . . . . . . 3 C P . 19222 1 69 . 7 7 4 4 DA P P 31 -4.03 0.02 . . . . . . 4 A P . 19222 1 70 . 7 7 5 5 DC P P 31 -4.33 0.02 . . . . . . 5 C P . 19222 1 71 . 7 7 6 6 DG P P 31 -4.01 0.02 . . . . . . 6 G P . 19222 1 72 . 7 7 7 7 DT P P 31 -4.47 0.02 . . . . . . 7 T P . 19222 1 73 . 7 7 8 8 DA P P 31 -4.26 0.02 . . . . . . 8 A P . 19222 1 74 . 7 7 9 9 DC P P 31 -4.26 0.02 . . . . . . 9 C P . 19222 1 75 . 7 7 10 10 DG P P 31 -4.09 0.02 . . . . . . 10 G P . 19222 1 76 . 7 7 11 11 DC P P 31 -4.17 0.02 . . . . . . 11 C P . 19222 1 77 . 7 7 12 12 DG P P 31 -3.98 0.02 . . . . . . 12 G P . 19222 1 78 . 8 8 2 2 DG P P 31 -4.14 0.02 . . . . . . 14 G P . 19222 1 79 . 8 8 3 3 DC P P 31 -4.25 0.02 . . . . . . 15 C P . 19222 1 80 . 8 8 4 4 DG P P 31 -3.99 0.02 . . . . . . 16 G P . 19222 1 81 . 8 8 5 5 DT P P 31 -4.43 0.02 . . . . . . 17 T P . 19222 1 82 . 8 8 6 6 DA P P 31 -4.26 0.02 . . . . . . 18 A P . 19222 1 83 . 8 8 7 7 DC P P 31 -4.26 0.02 . . . . . . 19 C P . 19222 1 84 . 8 8 8 8 DG P P 31 -4.09 0.02 . . . . . . 20 G P . 19222 1 85 . 8 8 9 9 DT P P 31 -4.47 0.02 . . . . . . 21 T P . 19222 1 86 . 8 8 10 10 DG P P 31 -4.26 0.02 . . . . . . 22 G P . 19222 1 87 . 8 8 11 11 DC P P 31 -4.04 0.02 . . . . . . 23 C P . 19222 1 88 . 8 8 12 12 DG P P 31 -3.87 0.02 . . . . . . 24 G P . 19222 1 stop_ save_ save_assigned_chem_shift_list_2 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_2 _Assigned_chem_shift_list.Entry_ID 19222 _Assigned_chem_shift_list.ID 2 _Assigned_chem_shift_list.Sample_condition_list_ID 2 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_2 _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 0.02 _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 5 '2D 1H-31P Hetero - Correlation' . . . 19222 2 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 2 2 DC P P 31 -4.17 0.02 . . . . . . 2 C P . 19222 2 2 . 1 1 3 3 DG P P 31 -3.78 0.02 . . . . . . 3 G P . 19222 2 3 . 1 1 4 4 DT P P 31 -4.42 0.02 . . . . . . 4 T P . 19222 2 4 . 1 1 5 5 DA P P 31 -4.27 0.02 . . . . . . 5 A P . 19222 2 5 . 1 1 6 6 DG P P 31 -4.16 0.02 . . . . . . 6 G P . 19222 2 6 . 1 1 7 7 DC P P 31 -4.15 0.02 . . . . . . 7 C P . 19222 2 7 . 1 1 8 8 DA P P 31 -4.22 0.02 . . . . . . 8 A P . 19222 2 8 . 1 1 9 9 DA P P 31 -4.24 0.02 . . . . . . 9 A P . 19222 2 9 . 1 1 10 10 DG P P 31 -4.16 0.02 . . . . . . 10 G P . 19222 2 10 . 1 1 11 11 DC P P 31 -4.04 0.02 . . . . . . 11 C P . 19222 2 11 . 1 1 12 12 DT P P 31 -4.11 0.02 . . . . . . 12 T P . 19222 2 12 . 2 2 2 2 DG P P 31 -4.15 0.02 . . . . . . 14 G P . 19222 2 13 . 2 2 3 3 DC P P 31 -4.16 0.02 . . . . . . 15 C P . 19222 2 14 . 2 2 4 4 DT P P 31 -4.35 0.02 . . . . . . 16 T P . 19222 2 15 . 2 2 5 5 DT P P 31 -4.42 0.02 . . . . . . 17 T P . 19222 2 16 . 2 2 6 6 DG P P 31 -4.15 0.02 . . . . . . 18 G P . 19222 2 17 . 2 2 7 7 DC P P 31 -4.02 0.02 . . . . . . 19 C P . 19222 2 18 . 2 2 8 8 DT P P 31 -4.46 0.02 . . . . . . 20 T P . 19222 2 19 . 2 2 9 9 DA P P 31 -4.16 0.02 . . . . . . 21 A P . 19222 2 20 . 2 2 10 10 DC P P 31 -4.16 0.02 . . . . . . 22 C P . 19222 2 21 . 2 2 11 11 DG P P 31 -4.04 0.02 . . . . . . 23 G P . 19222 2 22 . 2 2 12 12 DA P P 31 -4.07 0.02 . . . . . . 24 A P . 19222 2 23 . 3 3 2 2 DC P P 31 -4.25 0.02 . . . . . . 2 C P . 19222 2 24 . 3 3 3 3 DT P P 31 -4.41 0.02 . . . . . . 3 T P . 19222 2 25 . 3 3 4 4 DC P P 31 -4.22 0.02 . . . . . . 4 C P . 19222 2 26 . 3 3 5 5 DT P P 31 -4.34 0.02 . . . . . . 5 T P . 19222 2 27 . 3 3 6 6 DA P P 31 -4.23 0.02 . . . . . . 6 A P . 19222 2 28 . 3 3 7 7 DG P P 31 -4.24 0.02 . . . . . . 7 G P . 19222 2 29 . 3 3 8 8 DC P P 31 -4.07 0.02 . . . . . . 8 C P . 19222 2 30 . 3 3 9 9 DA P P 31 -4.23 0.02 . . . . . . 9 A P . 19222 2 31 . 3 3 10 10 DC P P 31 -4.3 0.02 . . . . . . 10 C P . 19222 2 32 . 3 3 11 11 DC P P 31 -4.09 0.02 . . . . . . 11 C P . 19222 2 33 . 3 3 12 12 DG P P 31 -3.91 0.02 . . . . . . 12 G P . 19222 2 34 . 4 4 2 2 DG P P 31 -4.11 0.02 . . . . . . 14 G P . 19222 2 35 . 4 4 3 3 DG P P 31 -3.85 0.02 . . . . . . 15 G P . 19222 2 36 . 4 4 4 4 DT P P 31 -4.42 0.02 . . . . . . 16 T P . 19222 2 37 . 4 4 5 5 DG P P 31 -4.29 0.02 . . . . . . 17 G P . 19222 2 38 . 4 4 6 6 DC P P 31 -4.09 0.02 . . . . . . 18 C P . 19222 2 39 . 4 4 7 7 DT P P 31 -4.46 0.02 . . . . . . 19 T P . 19222 2 40 . 4 4 8 8 DA P P 31 -4.24 0.02 . . . . . . 20 A P . 19222 2 41 . 4 4 9 9 DG P P 31 -4.23 0.02 . . . . . . 21 G P . 19222 2 42 . 4 4 10 10 DA P P 31 -3.99 0.02 . . . . . . 22 A P . 19222 2 43 . 4 4 11 11 DG P P 31 -4.23 0.02 . . . . . . 23 G P . 19222 2 44 . 4 4 12 12 DC P P 31 -4.15 0.02 . . . . . . 24 C P . 19222 2 45 . 5 5 2 2 DC P P 31 -4.08 0.02 . . . . . . 2 C P . 19222 2 46 . 5 5 3 3 DG P P 31 -3.91 0.02 . . . . . . 3 G P . 19222 2 47 . 5 5 4 4 DC P P 31 -4.11 0.02 . . . . . . 4 C P . 19222 2 48 . 5 5 5 5 DT P P 31 -4.33 0.02 . . . . . . 5 T P . 19222 2 49 . 5 5 6 6 DT P P 31 -4.43 0.02 . . . . . . 6 T P . 19222 2 50 . 5 5 7 7 DA P P 31 -4.23 0.02 . . . . . . 7 A P . 19222 2 51 . 5 5 8 8 DA P P 31 -4.29 0.02 . . . . . . 8 A P . 19222 2 52 . 5 5 9 9 DA P P 31 -4.17 0.02 . . . . . . 9 A P . 19222 2 53 . 5 5 10 10 DC P P 31 -4.23 0.02 . . . . . . 10 C P . 19222 2 54 . 5 5 11 11 DG P P 31 -4.18 0.02 . . . . . . 11 G P . 19222 2 55 . 5 5 12 12 DC P P 31 -4.05 0.02 . . . . . . 12 C P . 19222 2 56 . 6 6 2 2 DC P P 31 -4.25 0.02 . . . . . . 14 C P . 19222 2 57 . 6 6 3 3 DG P P 31 -3.91 0.02 . . . . . . 15 G P . 19222 2 58 . 6 6 4 4 DT P P 31 -4.38 0.02 . . . . . . 16 T P . 19222 2 59 . 6 6 5 5 DT P P 31 -4.47 0.02 . . . . . . 17 T P . 19222 2 60 . 6 6 6 6 DT P P 31 -4.38 0.02 . . . . . . 18 T P . 19222 2 61 . 6 6 7 7 DA P P 31 -4.26 0.02 . . . . . . 19 A P . 19222 2 62 . 6 6 8 8 DA P P 31 -4.17 0.02 . . . . . . 20 A P . 19222 2 63 . 6 6 9 9 DG P P 31 -4.17 0.02 . . . . . . 21 G P . 19222 2 64 . 6 6 10 10 DC P P 31 -4.15 0.02 . . . . . . 22 C P . 19222 2 65 . 6 6 11 11 DG P P 31 -4.11 0.02 . . . . . . 23 G P . 19222 2 66 . 6 6 12 12 DG P P 31 -3.92 0.02 . . . . . . 24 G P . 19222 2 67 . 7 7 2 2 DG P P 31 -4.1 0.02 . . . . . . 2 G P . 19222 2 68 . 7 7 3 3 DC P P 31 -4.23 0.02 . . . . . . 3 C P . 19222 2 69 . 7 7 4 4 DA P P 31 -4.03 0.02 . . . . . . 4 A P . 19222 2 70 . 7 7 5 5 DC P P 31 -4.31 0.02 . . . . . . 5 C P . 19222 2 71 . 7 7 6 6 DG P P 31 -3.99 0.02 . . . . . . 6 G P . 19222 2 72 . 7 7 7 7 DT P P 31 -4.44 0.02 . . . . . . 7 T P . 19222 2 73 . 7 7 8 8 DA P P 31 -4.24 0.02 . . . . . . 8 A P . 19222 2 74 . 7 7 9 9 DC P P 31 -4.24 0.02 . . . . . . 9 C P . 19222 2 75 . 7 7 10 10 DG P P 31 -4.07 0.02 . . . . . . 10 G P . 19222 2 76 . 7 7 11 11 DC P P 31 -4.14 0.02 . . . . . . 11 C P . 19222 2 77 . 7 7 12 12 DG P P 31 -3.96 0.02 . . . . . . 12 G P . 19222 2 78 . 8 8 2 2 DG P P 31 -4.1 0.02 . . . . . . 14 G P . 19222 2 79 . 8 8 3 3 DC P P 31 -4.23 0.02 . . . . . . 15 C P . 19222 2 80 . 8 8 4 4 DG P P 31 -3.98 0.02 . . . . . . 16 G P . 19222 2 81 . 8 8 5 5 DT P P 31 -4.4 0.02 . . . . . . 17 T P . 19222 2 82 . 8 8 6 6 DA P P 31 -4.24 0.02 . . . . . . 18 A P . 19222 2 83 . 8 8 7 7 DC P P 31 -4.24 0.02 . . . . . . 19 C P . 19222 2 84 . 8 8 8 8 DG P P 31 -4.07 0.02 . . . . . . 20 G P . 19222 2 85 . 8 8 9 9 DT P P 31 -4.44 0.02 . . . . . . 21 T P . 19222 2 86 . 8 8 10 10 DG P P 31 -4.24 0.02 . . . . . . 22 G P . 19222 2 87 . 8 8 11 11 DC P P 31 -4.02 0.02 . . . . . . 23 C P . 19222 2 88 . 8 8 12 12 DG P P 31 -3.91 0.02 . . . . . . 24 G P . 19222 2 stop_ save_ save_assigned_chem_shift_list_3 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_3 _Assigned_chem_shift_list.Entry_ID 19222 _Assigned_chem_shift_list.ID 3 _Assigned_chem_shift_list.Sample_condition_list_ID 3 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_3 _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 0.02 _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 5 '2D 1H-31P Hetero - Correlation' . . . 19222 3 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 2 2 DC P P 31 -4.11 0.02 . . . . . . 2 C P . 19222 3 2 . 1 1 3 3 DG P P 31 -3.80 0.02 . . . . . . 3 G P . 19222 3 3 . 1 1 4 4 DT P P 31 -4.38 0.02 . . . . . . 4 T P . 19222 3 4 . 1 1 5 5 DA P P 31 -4.24 0.02 . . . . . . 5 A P . 19222 3 5 . 1 1 6 6 DG P P 31 -4.13 0.02 . . . . . . 6 G P . 19222 3 6 . 1 1 7 7 DC P P 31 -4.16 0.02 . . . . . . 7 C P . 19222 3 7 . 1 1 8 8 DA P P 31 -4.21 0.02 . . . . . . 8 A P . 19222 3 8 . 1 1 9 9 DA P P 31 -4.22 0.02 . . . . . . 9 A P . 19222 3 9 . 1 1 10 10 DG P P 31 -4.13 0.02 . . . . . . 10 G P . 19222 3 10 . 1 1 11 11 DC P P 31 -4.02 0.02 . . . . . . 11 C P . 19222 3 11 . 1 1 12 12 DT P P 31 -4.06 0.02 . . . . . . 12 T P . 19222 3 12 . 2 2 2 2 DG P P 31 -4.12 0.02 . . . . . . 14 G P . 19222 3 13 . 2 2 3 3 DC P P 31 -4.16 0.02 . . . . . . 15 C P . 19222 3 14 . 2 2 4 4 DT P P 31 -4.32 0.02 . . . . . . 16 T P . 19222 3 15 . 2 2 5 5 DT P P 31 -4.39 0.02 . . . . . . 17 T P . 19222 3 16 . 2 2 6 6 DG P P 31 -4.16 0.02 . . . . . . 18 G P . 19222 3 17 . 2 2 7 7 DC P P 31 -4.03 0.02 . . . . . . 19 C P . 19222 3 18 . 2 2 8 8 DT P P 31 -4.42 0.02 . . . . . . 20 T P . 19222 3 19 . 2 2 9 9 DA P P 31 -4.16 0.02 . . . . . . 21 A P . 19222 3 20 . 2 2 10 10 DC P P 31 -4.13 0.02 . . . . . . 22 C P . 19222 3 21 . 2 2 11 11 DG P P 31 -4.03 0.02 . . . . . . 23 G P . 19222 3 22 . 2 2 12 12 DA P P 31 -4.04 0.02 . . . . . . 24 A P . 19222 3 23 . 3 3 2 2 DC P P 31 -4.21 0.02 . . . . . . 2 C P . 19222 3 24 . 3 3 3 3 DT P P 31 -4.38 0.02 . . . . . . 3 T P . 19222 3 25 . 3 3 4 4 DC P P 31 -4.21 0.02 . . . . . . 4 C P . 19222 3 26 . 3 3 5 5 DT P P 31 -4.32 0.02 . . . . . . 5 T P . 19222 3 27 . 3 3 6 6 DA P P 31 -4.23 0.02 . . . . . . 6 A P . 19222 3 28 . 3 3 7 7 DG P P 31 -4.23 0.02 . . . . . . 7 G P . 19222 3 29 . 3 3 8 8 DC P P 31 -4.07 0.02 . . . . . . 8 C P . 19222 3 30 . 3 3 9 9 DA P P 31 -4.23 0.02 . . . . . . 9 A P . 19222 3 31 . 3 3 10 10 DC P P 31 -4.29 0.02 . . . . . . 10 C P . 19222 3 32 . 3 3 11 11 DC P P 31 -4.08 0.02 . . . . . . 11 C P . 19222 3 33 . 3 3 12 12 DG P P 31 -3.88 0.02 . . . . . . 12 G P . 19222 3 34 . 4 4 2 2 DG P P 31 -4.09 0.02 . . . . . . 14 G P . 19222 3 35 . 4 4 3 3 DG P P 31 -3.87 0.02 . . . . . . 15 G P . 19222 3 36 . 4 4 4 4 DT P P 31 -4.49 0.02 . . . . . . 16 T P . 19222 3 37 . 4 4 5 5 DG P P 31 -4.27 0.02 . . . . . . 17 G P . 19222 3 38 . 4 4 6 6 DC P P 31 -4.09 0.02 . . . . . . 18 C P . 19222 3 39 . 4 4 7 7 DT P P 31 -4.43 0.02 . . . . . . 19 T P . 19222 3 40 . 4 4 8 8 DA P P 31 -4.23 0.02 . . . . . . 20 A P . 19222 3 41 . 4 4 9 9 DG P P 31 -4.22 0.02 . . . . . . 21 G P . 19222 3 42 . 4 4 10 10 DA P P 31 -3.99 0.02 . . . . . . 22 A P . 19222 3 43 . 4 4 11 11 DG P P 31 -4.22 0.02 . . . . . . 23 G P . 19222 3 44 . 4 4 12 12 DC P P 31 -4.16 0.02 . . . . . . 24 C P . 19222 3 45 . 5 5 2 2 DC P P 31 -4.04 0.02 . . . . . . 2 C P . 19222 3 46 . 5 5 3 3 DG P P 31 -3.9 0.02 . . . . . . 3 G P . 19222 3 47 . 5 5 4 4 DC P P 31 -4.09 0.02 . . . . . . 4 C P . 19222 3 48 . 5 5 5 5 DT P P 31 -4.3 0.02 . . . . . . 5 T P . 19222 3 49 . 5 5 6 6 DT P P 31 -4.39 0.02 . . . . . . 6 T P . 19222 3 50 . 5 5 7 7 DA P P 31 -4.21 0.02 . . . . . . 7 A P . 19222 3 51 . 5 5 8 8 DA P P 31 -4.22 0.02 . . . . . . 8 A P . 19222 3 52 . 5 5 9 9 DA P P 31 -4.16 0.02 . . . . . . 9 A P . 19222 3 53 . 5 5 10 10 DC P P 31 -4.2 0.02 . . . . . . 10 C P . 19222 3 54 . 5 5 11 11 DG P P 31 -4.15 0.02 . . . . . . 11 G P . 19222 3 55 . 5 5 12 12 DC P P 31 -4.03 0.02 . . . . . . 12 C P . 19222 3 56 . 6 6 2 2 DC P P 31 -4.21 0.02 . . . . . . 14 C P . 19222 3 57 . 6 6 3 3 DG P P 31 -3.9 0.02 . . . . . . 15 G P . 19222 3 58 . 6 6 4 4 DT P P 31 -4.34 0.02 . . . . . . 16 T P . 19222 3 59 . 6 6 5 5 DT P P 31 -4.42 0.02 . . . . . . 17 T P . 19222 3 60 . 6 6 6 6 DT P P 31 -4.34 0.02 . . . . . . 18 T P . 19222 3 61 . 6 6 7 7 DA P P 31 -4.23 0.02 . . . . . . 19 A P . 19222 3 62 . 6 6 8 8 DA P P 31 -4.16 0.02 . . . . . . 20 A P . 19222 3 63 . 6 6 9 9 DG P P 31 -4.15 0.02 . . . . . . 21 G P . 19222 3 64 . 6 6 10 10 DC P P 31 -4.12 0.02 . . . . . . 22 C P . 19222 3 65 . 6 6 11 11 DG P P 31 -4.09 0.02 . . . . . . 23 G P . 19222 3 66 . 6 6 12 12 DG P P 31 -3.91 0.02 . . . . . . 24 G P . 19222 3 67 . 7 7 2 2 DG P P 31 -4.05 0.02 . . . . . . 2 G P . 19222 3 68 . 7 7 3 3 DC P P 31 -4.21 0.02 . . . . . . 3 C P . 19222 3 69 . 7 7 4 4 DA P P 31 -4.02 0.02 . . . . . . 4 A P . 19222 3 70 . 7 7 5 5 DC P P 31 -4.27 0.02 . . . . . . 5 C P . 19222 3 71 . 7 7 6 6 DG P P 31 -3.98 0.02 . . . . . . 6 G P . 19222 3 72 . 7 7 7 7 DT P P 31 -4.4 0.02 . . . . . . 7 T P . 19222 3 73 . 7 7 8 8 DA P P 31 -4.22 0.02 . . . . . . 8 A P . 19222 3 74 . 7 7 9 9 DC P P 31 -4.21 0.02 . . . . . . 9 C P . 19222 3 75 . 7 7 10 10 DG P P 31 -4.05 0.02 . . . . . . 10 G P . 19222 3 76 . 7 7 11 11 DC P P 31 -4.11 0.02 . . . . . . 11 C P . 19222 3 77 . 7 7 12 12 DG P P 31 -3.95 0.02 . . . . . . 12 G P . 19222 3 78 . 8 8 2 2 DG P P 31 -4.05 0.02 . . . . . . 14 G P . 19222 3 79 . 8 8 3 3 DC P P 31 -4.21 0.02 . . . . . . 15 C P . 19222 3 80 . 8 8 4 4 DG P P 31 -3.98 0.02 . . . . . . 16 G P . 19222 3 81 . 8 8 5 5 DT P P 31 -4.36 0.02 . . . . . . 17 T P . 19222 3 82 . 8 8 6 6 DA P P 31 -4.22 0.02 . . . . . . 18 A P . 19222 3 83 . 8 8 7 7 DC P P 31 -4.21 0.02 . . . . . . 19 C P . 19222 3 84 . 8 8 8 8 DG P P 31 -4.04 0.02 . . . . . . 20 G P . 19222 3 85 . 8 8 9 9 DT P P 31 -4.4 0.02 . . . . . . 21 T P . 19222 3 86 . 8 8 10 10 DG P P 31 -4.22 0.02 . . . . . . 22 G P . 19222 3 87 . 8 8 11 11 DC P P 31 -4.00 0.02 . . . . . . 23 C P . 19222 3 88 . 8 8 12 12 DG P P 31 -3.9 0.02 . . . . . . 24 G P . 19222 3 stop_ save_ ################################ # Residual dipolar couplings # ################################ save_RDC_list_1 _RDC_list.Sf_category RDCs _RDC_list.Sf_framecode RDC_list_1 _RDC_list.Entry_ID 19222 _RDC_list.ID 1 _RDC_list.Sample_condition_list_ID 4 _RDC_list.Sample_condition_list_label $sample_conditions_4 _RDC_list.Spectrometer_frequency_1H 500 _RDC_list.Bond_length_usage_flag . _RDC_list.Dipolar_constraint_calib_method . _RDC_list.Mol_align_tensor_axial_sym_mol . _RDC_list.Mol_align_tensor_rhombic_mol . _RDC_list.General_order_param_int_motions . _RDC_list.Assumed_H_N_bond_length . _RDC_list.Assumed_H_C_bond_length . _RDC_list.Assumed_C_N_bond_length . _RDC_list.Details 'residual dipolar coupling error : 2 Hz' _RDC_list.Text_data_format . _RDC_list.Text_data . loop_ _RDC_experiment.Experiment_ID _RDC_experiment.Experiment_name _RDC_experiment.Sample_ID _RDC_experiment.Sample_label _RDC_experiment.Sample_state _RDC_experiment.Entry_ID _RDC_experiment.RDC_list_ID 3 '2D 1H-13C HSQC' . . . 19222 1 4 '2D 1H-13C TROSY' . . . 19222 1 stop_ loop_ _RDC.ID _RDC.RDC_code _RDC.Assembly_atom_ID_1 _RDC.Entity_assembly_ID_1 _RDC.Entity_ID_1 _RDC.Comp_index_ID_1 _RDC.Seq_ID_1 _RDC.Comp_ID_1 _RDC.Atom_ID_1 _RDC.Atom_type_1 _RDC.Atom_isotope_number_1 _RDC.Ambiguity_code_1 _RDC.Assembly_atom_ID_2 _RDC.Entity_assembly_ID_2 _RDC.Entity_ID_2 _RDC.Comp_index_ID_2 _RDC.Seq_ID_2 _RDC.Comp_ID_2 _RDC.Atom_ID_2 _RDC.Atom_type_2 _RDC.Atom_isotope_number_2 _RDC.Ambiguity_code_2 _RDC.Val _RDC.Val_min _RDC.Val_max _RDC.Val_err _RDC.Val_bond_length _RDC.Resonance_ID_1 _RDC.Resonance_ID_2 _RDC.Auth_entity_assembly_ID_1 _RDC.Auth_seq_ID_1 _RDC.Auth_comp_ID_1 _RDC.Auth_atom_ID_1 _RDC.Auth_entity_assembly_ID_2 _RDC.Auth_seq_ID_2 _RDC.Auth_comp_ID_2 _RDC.Auth_atom_ID_2 _RDC.Entry_ID _RDC.RDC_list_ID 1 DCH . 1 1 1 1 DT C6 C 13 . . 1 1 1 1 DT H6 H 1 . 12 . . 2 . . . . . . . . . . . 19222 1 2 DCH . 1 1 1 1 DT C7 C 13 . . 1 1 1 1 DT H71 H 1 . 11 . . 2 . . . . . . . . . . . 19222 1 3 DCH . 1 1 2 2 DC C6 C 13 . . 1 1 2 2 DC H6 H 1 . 14 . . 2 . . . . . . . . . . . 19222 1 4 DCH . 1 1 2 2 DC C5 C 13 . . 1 1 2 2 DC H5 H 1 . 9 . . 2 . . . . . . . . . . . 19222 1 5 DCH . 1 1 3 3 DG C8 C 13 . . 1 1 3 3 DG H8 H 1 . 10 . . 2 . . . . . . . . . . . 19222 1 6 DCH . 1 1 4 4 DT C6 C 13 . . 1 1 4 4 DT H6 H 1 . 12 . . 2 . . . . . . . . . . . 19222 1 7 DCH . 1 1 5 5 DA C8 C 13 . . 1 1 5 5 DA H8 H 1 . 11 . . 2 . . . . . . . . . . . 19222 1 8 DCH . 1 1 5 5 DA C2 C 13 . . 1 1 5 5 DA H2 H 1 . 10 . . 2 . . . . . . . . . . . 19222 1 9 DCH . 1 1 6 6 DG C8 C 13 . . 1 1 6 6 DG H8 H 1 . 10 . . 2 . . . . . . . . . . . 19222 1 10 DCH . 1 1 7 7 DC C6 C 13 . . 1 1 7 7 DC H6 H 1 . 7 . . 2 . . . . . . . . . . . 19222 1 11 DCH . 1 1 7 7 DC C6 C 13 . . 1 1 7 7 DC H6 H 1 . 7 . . 2 . . . . . . . . . . . 19222 1 12 DCH . 1 1 8 8 DA C8 C 13 . . 1 1 8 8 DA H8 H 1 . 7 . . 2 . . . . . . . . . . . 19222 1 13 DCH . 1 1 8 8 DA C2 C 13 . . 1 1 8 8 DA H2 H 1 . 7 . . 2 . . . . . . . . . . . 19222 1 14 DCH . 1 1 9 9 DA C8 C 13 . . 1 1 9 9 DA H8 H 1 . 7 . . 2 . . . . . . . . . . . 19222 1 15 DCH . 1 1 9 9 DA C2 C 13 . . 1 1 9 9 DA H2 H 1 . 7 . . 2 . . . . . . . . . . . 19222 1 16 DCH . 1 1 10 10 DG C8 C 13 . . 1 1 10 10 DG H8 H 1 . 4 . . 2 . . . . . . . . . . . 19222 1 17 DCH . 1 1 11 11 DC C6 C 13 . . 1 1 11 11 DC H6 H 1 . 1 . . 2 . . . . . . . . . . . 19222 1 18 DCH . 1 1 12 12 DT C7 C 13 . . 1 1 12 12 DT H71 H 1 . 7 . . 2 . . . . . . . . . . . 19222 1 19 DCH . 2 2 1 1 DA C8 C 13 . . 2 2 1 1 DA H8 H 1 . 5 . . 2 . . . . . . . . . . . 19222 1 20 DCH . 2 2 2 2 DG C8 C 13 . . 2 2 2 2 DG H8 H 1 . 10 . . 2 . . . . . . . . . . . 19222 1 21 DCH . 2 2 3 3 DC C6 C 13 . . 2 2 3 3 DC H6 H 1 . 11 . . 2 . . . . . . . . . . . 19222 1 22 DCH . 2 2 3 3 DC C6 C 13 . . 2 2 3 3 DC H6 H 1 . 10 . . 2 . . . . . . . . . . . 19222 1 23 DCH . 2 2 4 4 DT C6 C 13 . . 2 2 4 4 DT H6 H 1 . 13 . . 2 . . . . . . . . . . . 19222 1 24 DCH . 2 2 4 4 DT C7 C 13 . . 2 2 4 4 DT H71 H 1 . 4 . . 2 . . . . . . . . . . . 19222 1 25 DCH . 2 2 5 5 DT C6 C 13 . . 2 2 5 5 DT H6 H 1 . 17 . . 2 . . . . . . . . . . . 19222 1 26 DCH . 2 2 5 5 DT C7 C 13 . . 2 2 5 5 DT H71 H 1 . 16 . . 2 . . . . . . . . . . . 19222 1 27 DCH . 2 2 7 7 DC C6 C 13 . . 2 2 7 7 DC H6 H 1 . 9 . . 2 . . . . . . . . . . . 19222 1 28 DCH . 2 2 7 7 DC C6 C 13 . . 2 2 7 7 DC H6 H 1 . 9 . . 2 . . . . . . . . . . . 19222 1 29 DCH . 2 2 8 8 DT C6 C 13 . . 2 2 8 8 DT H6 H 1 . 11 . . 2 . . . . . . . . . . . 19222 1 30 DCH . 2 2 9 9 DA C8 C 13 . . 2 2 9 9 DA H8 H 1 . 7 . . 2 . . . . . . . . . . . 19222 1 31 DCH . 2 2 9 9 DA C2 C 13 . . 2 2 9 9 DA H2 H 1 . 9 . . 2 . . . . . . . . . . . 19222 1 32 DCH . 2 2 10 10 DC C6 C 13 . . 2 2 10 10 DC H6 H 1 . 8 . . 2 . . . . . . . . . . . 19222 1 33 DCH . 2 2 10 10 DC C6 C 13 . . 2 2 10 10 DC H6 H 1 . 9 . . 2 . . . . . . . . . . . 19222 1 34 DCH . 2 2 11 11 DG C8 C 13 . . 2 2 11 11 DG H8 H 1 . 4 . . 2 . . . . . . . . . . . 19222 1 35 DCH . 2 2 12 12 DA C2 C 13 . . 2 2 12 12 DA H2 H 1 . 8 . . 2 . . . . . . . . . . . 19222 1 36 DCH . 1 1 1 1 DT C1' C 13 . . 1 1 1 1 DT H1' H 1 . 6 . . 2 . . . . . . . . . . . 19222 1 37 DCH . 1 1 2 2 DC C1' C 13 . . 1 1 2 2 DC H1' H 1 . 6 . . 2 . . . . . . . . . . . 19222 1 38 DCH . 1 1 3 3 DG C1' C 13 . . 1 1 3 3 DG H1' H 1 . 6 . . 2 . . . . . . . . . . . 19222 1 39 DCH . 1 1 4 4 DT C1' C 13 . . 1 1 4 4 DT H1' H 1 . 6 . . 2 . . . . . . . . . . . 19222 1 40 DCH . 1 1 5 5 DA C1' C 13 . . 1 1 5 5 DA H1' H 1 . 13 . . 2 . . . . . . . . . . . 19222 1 41 DCH . 1 1 6 6 DG C1' C 13 . . 1 1 6 6 DG H1' H 1 . 7 . . 2 . . . . . . . . . . . 19222 1 42 DCH . 1 1 7 7 DC C1' C 13 . . 1 1 7 7 DC H1' H 1 . 10 . . 2 . . . . . . . . . . . 19222 1 43 DCH . 1 1 8 8 DA C1' C 13 . . 1 1 8 8 DA H1' H 1 . -1 . . 2 . . . . . . . . . . . 19222 1 44 DCH . 1 1 9 9 DA C1' C 13 . . 1 1 9 9 DA H1' H 1 . -1 . . 2 . . . . . . . . . . . 19222 1 45 DCH . 1 1 10 10 DG C1' C 13 . . 1 1 10 10 DG H1' H 1 . 9 . . 2 . . . . . . . . . . . 19222 1 46 DCH . 1 1 11 11 DC C1' C 13 . . 1 1 11 11 DC H1' H 1 . 0 . . 2 . . . . . . . . . . . 19222 1 47 DCH . 1 1 12 12 DT C1' C 13 . . 1 1 12 12 DT H1' H 1 . 3 . . 2 . . . . . . . . . . . 19222 1 48 DCH . 2 2 1 1 DA C1' C 13 . . 2 2 1 1 DA H1' H 1 . 1 . . 2 . . . . . . . . . . . 19222 1 49 DCH . 2 2 2 2 DG C1' C 13 . . 2 2 2 2 DG H1' H 1 . 12 . . 2 . . . . . . . . . . . 19222 1 50 DCH . 2 2 3 3 DC C1' C 13 . . 2 2 3 3 DC H1' H 1 . 2 . . 2 . . . . . . . . . . . 19222 1 51 DCH . 2 2 4 4 DT C1' C 13 . . 2 2 4 4 DT H1' H 1 . 7 . . 2 . . . . . . . . . . . 19222 1 52 DCH . 2 2 5 5 DT C1' C 13 . . 2 2 5 5 DT H1' H 1 . 2 . . 2 . . . . . . . . . . . 19222 1 53 DCH . 2 2 6 6 DG C1' C 13 . . 2 2 6 6 DG H1' H 1 . 7 . . 2 . . . . . . . . . . . 19222 1 54 DCH . 2 2 7 7 DC C1' C 13 . . 2 2 7 7 DC H1' H 1 . 12 . . 2 . . . . . . . . . . . 19222 1 55 DCH . 2 2 8 8 DT C1' C 13 . . 2 2 8 8 DT H1' H 1 . 1 . . 2 . . . . . . . . . . . 19222 1 56 DCH . 2 2 9 9 DA C1' C 13 . . 2 2 9 9 DA H1' H 1 . 6 . . 2 . . . . . . . . . . . 19222 1 57 DCH . 2 2 10 10 DC C1' C 13 . . 2 2 10 10 DC H1' H 1 . 11 . . 2 . . . . . . . . . . . 19222 1 58 DCH . 2 2 11 11 DG C1' C 13 . . 2 2 11 11 DG H1' H 1 . 4 . . 2 . . . . . . . . . . . 19222 1 59 DCH . 2 2 12 12 DA C1' C 13 . . 2 2 12 12 DA H1' H 1 . 4 . . 2 . . . . . . . . . . . 19222 1 60 DCH . 1 1 1 1 DT C3' C 13 . . 1 1 1 1 DT H3' H 1 . 5 . . 2 . . . . . . . . . . . 19222 1 61 DCH . 1 1 2 2 DC C3' C 13 . . 1 1 2 2 DC H3' H 1 . -3 . . 2 . . . . . . . . . . . 19222 1 62 DCH . 1 1 3 3 DG C3' C 13 . . 1 1 3 3 DG H3' H 1 . 10 . . 2 . . . . . . . . . . . 19222 1 63 DCH . 1 1 4 4 DT C3' C 13 . . 1 1 4 4 DT H3' H 1 . 1 . . 2 . . . . . . . . . . . 19222 1 64 DCH . 1 1 5 5 DA C3' C 13 . . 1 1 5 5 DA H3' H 1 . -1 . . 2 . . . . . . . . . . . 19222 1 65 DCH . 1 1 6 6 DG C3' C 13 . . 1 1 6 6 DG H3' H 1 . -6 . . 2 . . . . . . . . . . . 19222 1 66 DCH . 1 1 7 7 DC C3' C 13 . . 1 1 7 7 DC H3' H 1 . 0 . . 2 . . . . . . . . . . . 19222 1 67 DCH . 1 1 9 9 DA C3' C 13 . . 1 1 9 9 DA H3' H 1 . 12 . . 2 . . . . . . . . . . . 19222 1 68 DCH . 1 1 10 10 DG C3' C 13 . . 1 1 10 10 DG H3' H 1 . 9 . . 2 . . . . . . . . . . . 19222 1 69 DCH . 2 2 2 2 DG C3' C 13 . . 2 2 2 2 DG H3' H 1 . -5 . . 2 . . . . . . . . . . . 19222 1 70 DCH . 2 2 3 3 DC C3' C 13 . . 2 2 3 3 DC H3' H 1 . 3 . . 2 . . . . . . . . . . . 19222 1 71 DCH . 2 2 4 4 DT C3' C 13 . . 2 2 4 4 DT H3' H 1 . 0 . . 2 . . . . . . . . . . . 19222 1 72 DCH . 2 2 5 5 DT C3' C 13 . . 2 2 5 5 DT H3' H 1 . 5 . . 2 . . . . . . . . . . . 19222 1 73 DCH . 2 2 6 6 DG C3' C 13 . . 2 2 6 6 DG H3' H 1 . 10 . . 2 . . . . . . . . . . . 19222 1 74 DCH . 2 2 7 7 DC C3' C 13 . . 2 2 7 7 DC H3' H 1 . 18 . . 2 . . . . . . . . . . . 19222 1 75 DCH . 2 2 8 8 DT C3' C 13 . . 2 2 8 8 DT H3' H 1 . 8 . . 2 . . . . . . . . . . . 19222 1 76 DCH . 2 2 10 10 DC C3' C 13 . . 2 2 10 10 DC H3' H 1 . 0 . . 2 . . . . . . . . . . . 19222 1 77 DCH . 2 2 11 11 DG C3' C 13 . . 2 2 11 11 DG H3' H 1 . 12 . . 2 . . . . . . . . . . . 19222 1 78 DCH . 1 1 1 1 DT C4' C 13 . . 1 1 1 1 DT H4' H 1 . 10 . . 2 . . . . . . . . . . . 19222 1 79 DCH . 1 1 2 2 DC C4' C 13 . . 1 1 2 2 DC H4' H 1 . 8 . . 2 . . . . . . . . . . . 19222 1 80 DCH . 1 1 3 3 DG C4' C 13 . . 1 1 3 3 DG H4' H 1 . -2 . . 2 . . . . . . . . . . . 19222 1 81 DCH . 1 1 5 5 DA C4' C 13 . . 1 1 5 5 DA H4' H 1 . 4 . . 2 . . . . . . . . . . . 19222 1 82 DCH . 1 1 7 7 DC C4' C 13 . . 1 1 7 7 DC H4' H 1 . 8 . . 2 . . . . . . . . . . . 19222 1 83 DCH . 1 1 8 8 DA C4' C 13 . . 1 1 8 8 DA H4' H 1 . 7 . . 2 . . . . . . . . . . . 19222 1 84 DCH . 1 1 9 9 DA C4' C 13 . . 1 1 9 9 DA H4' H 1 . 16 . . 2 . . . . . . . . . . . 19222 1 85 DCH . 1 1 10 10 DG C4' C 13 . . 1 1 10 10 DG H4' H 1 . 12 . . 2 . . . . . . . . . . . 19222 1 86 DCH . 1 1 11 11 DC C4' C 13 . . 1 1 11 11 DC H4' H 1 . 6 . . 2 . . . . . . . . . . . 19222 1 87 DCH . 1 1 12 12 DT C4' C 13 . . 1 1 12 12 DT H4' H 1 . 4 . . 2 . . . . . . . . . . . 19222 1 88 DCH . 2 2 1 1 DA C4' C 13 . . 2 2 1 1 DA H4' H 1 . 12 . . 2 . . . . . . . . . . . 19222 1 89 DCH . 2 2 2 2 DG C4' C 13 . . 2 2 2 2 DG H4' H 1 . 12 . . 2 . . . . . . . . . . . 19222 1 90 DCH . 2 2 3 3 DC C4' C 13 . . 2 2 3 3 DC H4' H 1 . 12 . . 2 . . . . . . . . . . . 19222 1 91 DCH . 2 2 5 5 DT C4' C 13 . . 2 2 5 5 DT H4' H 1 . 2 . . 2 . . . . . . . . . . . 19222 1 92 DCH . 2 2 6 6 DG C4' C 13 . . 2 2 6 6 DG H4' H 1 . 4 . . 2 . . . . . . . . . . . 19222 1 93 DCH . 2 2 7 7 DC C4' C 13 . . 2 2 7 7 DC H4' H 1 . 13 . . 2 . . . . . . . . . . . 19222 1 94 DCH . 2 2 9 9 DA C4' C 13 . . 2 2 9 9 DA H4' H 1 . -3 . . 2 . . . . . . . . . . . 19222 1 95 DCH . 2 2 11 11 DG C4' C 13 . . 2 2 11 11 DG H4' H 1 . 10 . . 2 . . . . . . . . . . . 19222 1 96 DCH . 2 2 12 12 DA C4' C 13 . . 2 2 12 12 DA H4' H 1 . 8 . . 2 . . . . . . . . . . . 19222 1 97 DCH . 3 3 1 1 DG C8 C 13 . . 3 3 1 1 DG H8 H 1 . 12 . . 2 . . . . . . . . . . . 19222 1 98 DCH . 3 3 2 2 DC C6 C 13 . . 3 3 2 2 DC H6 H 1 . 8 . . 2 . . . . . . . . . . . 19222 1 99 DCH . 3 3 2 2 DC C5 C 13 . . 3 3 2 2 DC H5 H 1 . 6 . . 2 . . . . . . . . . . . 19222 1 100 DCH . 3 3 3 3 DT C6 C 13 . . 3 3 3 3 DT H6 H 1 . 9 . . 2 . . . . . . . . . . . 19222 1 101 DCH . 3 3 3 3 DT C7 C 13 . . 3 3 3 3 DT H71 H 1 . 9 . . 2 . . . . . . . . . . . 19222 1 102 DCH . 3 3 4 4 DC C6 C 13 . . 3 3 4 4 DC H6 H 1 . 11 . . 2 . . . . . . . . . . . 19222 1 103 DCH . 3 3 4 4 DC C5 C 13 . . 3 3 4 4 DC H5 H 1 . 6 . . 2 . . . . . . . . . . . 19222 1 104 DCH . 3 3 5 5 DT C6 C 13 . . 3 3 5 5 DT H6 H 1 . 8 . . 2 . . . . . . . . . . . 19222 1 105 DCH . 3 3 6 6 DA C8 C 13 . . 3 3 6 6 DA H8 H 1 . 18 . . 2 . . . . . . . . . . . 19222 1 106 DCH . 3 3 6 6 DA C2 C 13 . . 3 3 6 6 DA H2 H 1 . 16 . . 2 . . . . . . . . . . . 19222 1 107 DCH . 3 3 7 7 DG C8 C 13 . . 3 3 7 7 DG H8 H 1 . 10 . . 2 . . . . . . . . . . . 19222 1 108 DCH . 3 3 8 8 DC C6 C 13 . . 3 3 8 8 DC H6 H 1 . 7 . . 2 . . . . . . . . . . . 19222 1 109 DCH . 3 3 9 9 DA C8 C 13 . . 3 3 9 9 DA H8 H 1 . 13 . . 2 . . . . . . . . . . . 19222 1 110 DCH . 3 3 9 9 DA C2 C 13 . . 3 3 9 9 DA H2 H 1 . 16 . . 2 . . . . . . . . . . . 19222 1 111 DCH . 3 3 10 10 DC C6 C 13 . . 3 3 10 10 DC H6 H 1 . 9 . . 2 . . . . . . . . . . . 19222 1 112 DCH . 3 3 10 10 DC C5 C 13 . . 3 3 10 10 DC H5 H 1 . 9 . . 2 . . . . . . . . . . . 19222 1 113 DCH . 3 3 11 11 DC C6 C 13 . . 3 3 11 11 DC H6 H 1 . 3 . . 2 . . . . . . . . . . . 19222 1 114 DCH . 3 3 11 11 DC C5 C 13 . . 3 3 11 11 DC H5 H 1 . 2 . . 2 . . . . . . . . . . . 19222 1 115 DCH . 3 3 12 12 DG C8 C 13 . . 3 3 12 12 DG H8 H 1 . 7 . . 2 . . . . . . . . . . . 19222 1 116 DCH . 4 4 1 1 DC C6 C 13 . . 4 4 1 1 DC H6 H 1 . 7 . . 2 . . . . . . . . . . . 19222 1 117 DCH . 4 4 2 2 DG C8 C 13 . . 4 4 2 2 DG H8 H 1 . 12 . . 2 . . . . . . . . . . . 19222 1 118 DCH . 4 4 3 3 DG C8 C 13 . . 4 4 3 3 DG H8 H 1 . 2 . . 2 . . . . . . . . . . . 19222 1 119 DCH . 4 4 4 4 DT C6 C 13 . . 4 4 4 4 DT H6 H 1 . 0 . . 2 . . . . . . . . . . . 19222 1 120 DCH . 4 4 4 4 DT C7 C 13 . . 4 4 4 4 DT H71 H 1 . 2 . . 2 . . . . . . . . . . . 19222 1 121 DCH . 4 4 5 5 DG C8 C 13 . . 4 4 5 5 DG H8 H 1 . 5 . . 2 . . . . . . . . . . . 19222 1 122 DCH . 4 4 6 6 DC C6 C 13 . . 4 4 6 6 DC H6 H 1 . 0 . . 2 . . . . . . . . . . . 19222 1 123 DCH . 4 4 6 6 DC C5 C 13 . . 4 4 6 6 DC H5 H 1 . 1 . . 2 . . . . . . . . . . . 19222 1 124 DCH . 4 4 7 7 DT C6 C 13 . . 4 4 7 7 DT H6 H 1 . 1 . . 2 . . . . . . . . . . . 19222 1 125 DCH . 4 4 8 8 DA C8 C 13 . . 4 4 8 8 DA H8 H 1 . 3 . . 2 . . . . . . . . . . . 19222 1 126 DCH . 4 4 8 8 DA C2 C 13 . . 4 4 8 8 DA H2 H 1 . 4 . . 2 . . . . . . . . . . . 19222 1 127 DCH . 4 4 9 9 DG C8 C 13 . . 4 4 9 9 DG H8 H 1 . -6 . . 2 . . . . . . . . . . . 19222 1 128 DCH . 4 4 10 10 DA C8 C 13 . . 4 4 10 10 DA H8 H 1 . -5 . . 2 . . . . . . . . . . . 19222 1 129 DCH . 4 4 10 10 DA C2 C 13 . . 4 4 10 10 DA H2 H 1 . -1 . . 2 . . . . . . . . . . . 19222 1 130 DCH . 4 4 11 11 DG C8 C 13 . . 4 4 11 11 DG H8 H 1 . 0 . . 2 . . . . . . . . . . . 19222 1 131 DCH . 4 4 12 12 DC C6 C 13 . . 4 4 12 12 DC H6 H 1 . 3 . . 2 . . . . . . . . . . . 19222 1 132 DCH . 4 4 12 12 DC C5 C 13 . . 4 4 12 12 DC H5 H 1 . 1 . . 2 . . . . . . . . . . . 19222 1 133 DCH . 3 3 1 1 DG C1' C 13 . . 3 3 1 1 DG H1' H 1 . 0 . . 2 . . . . . . . . . . . 19222 1 134 DCH . 3 3 2 2 DC C1' C 13 . . 3 3 2 2 DC H1' H 1 . 4 . . 2 . . . . . . . . . . . 19222 1 135 DCH . 3 3 3 3 DT C1' C 13 . . 3 3 3 3 DT H1' H 1 . 6 . . 2 . . . . . . . . . . . 19222 1 136 DCH . 3 3 4 4 DC C1' C 13 . . 3 3 4 4 DC H1' H 1 . 3 . . 2 . . . . . . . . . . . 19222 1 137 DCH . 3 3 5 5 DT C1' C 13 . . 3 3 5 5 DT H1' H 1 . 7 . . 2 . . . . . . . . . . . 19222 1 138 DCH . 3 3 6 6 DA C1' C 13 . . 3 3 6 6 DA H1' H 1 . 4 . . 2 . . . . . . . . . . . 19222 1 139 DCH . 3 3 7 7 DG C1' C 13 . . 3 3 7 7 DG H1' H 1 . -7 . . 2 . . . . . . . . . . . 19222 1 140 DCH . 3 3 8 8 DC C1' C 13 . . 3 3 8 8 DC H1' H 1 . 4 . . 2 . . . . . . . . . . . 19222 1 141 DCH . 3 3 9 9 DA C1' C 13 . . 3 3 9 9 DA H1' H 1 . 0 . . 2 . . . . . . . . . . . 19222 1 142 DCH . 3 3 10 10 DC C1' C 13 . . 3 3 10 10 DC H1' H 1 . 13 . . 2 . . . . . . . . . . . 19222 1 143 DCH . 3 3 11 11 DC C1' C 13 . . 3 3 11 11 DC H1' H 1 . 6 . . 2 . . . . . . . . . . . 19222 1 144 DCH . 3 3 12 12 DG C1' C 13 . . 3 3 12 12 DG H1' H 1 . 6 . . 2 . . . . . . . . . . . 19222 1 145 DCH . 4 4 1 1 DC C1' C 13 . . 4 4 1 1 DC H1' H 1 . 4 . . 2 . . . . . . . . . . . 19222 1 146 DCH . 4 4 2 2 DG C1' C 13 . . 4 4 2 2 DG H1' H 1 . 5 . . 2 . . . . . . . . . . . 19222 1 147 DCH . 4 4 3 3 DG C1' C 13 . . 4 4 3 3 DG H1' H 1 . 4 . . 2 . . . . . . . . . . . 19222 1 148 DCH . 4 4 4 4 DT C1' C 13 . . 4 4 4 4 DT H1' H 1 . 7 . . 2 . . . . . . . . . . . 19222 1 149 DCH . 4 4 5 5 DG C1' C 13 . . 4 4 5 5 DG H1' H 1 . 4 . . 2 . . . . . . . . . . . 19222 1 150 DCH . 4 4 6 6 DC C1' C 13 . . 4 4 6 6 DC H1' H 1 . 2 . . 2 . . . . . . . . . . . 19222 1 151 DCH . 4 4 7 7 DT C1' C 13 . . 4 4 7 7 DT H1' H 1 . 4 . . 2 . . . . . . . . . . . 19222 1 152 DCH . 4 4 8 8 DA C1' C 13 . . 4 4 8 8 DA H1' H 1 . 5 . . 2 . . . . . . . . . . . 19222 1 153 DCH . 4 4 9 9 DG C1' C 13 . . 4 4 9 9 DG H1' H 1 . 14 . . 2 . . . . . . . . . . . 19222 1 154 DCH . 4 4 10 10 DA C1' C 13 . . 4 4 10 10 DA H1' H 1 . 8 . . 2 . . . . . . . . . . . 19222 1 155 DCH . 4 4 11 11 DG C1' C 13 . . 4 4 11 11 DG H1' H 1 . 5 . . 2 . . . . . . . . . . . 19222 1 156 DCH . 4 4 12 12 DC C1' C 13 . . 4 4 12 12 DC H1' H 1 . 5 . . 2 . . . . . . . . . . . 19222 1 157 DCH . 3 3 2 2 DC C3' C 13 . . 3 3 2 2 DC H3' H 1 . -2 . . 2 . . . . . . . . . . . 19222 1 158 DCH . 3 3 3 3 DT C3' C 13 . . 3 3 3 3 DT H3' H 1 . 3 . . 2 . . . . . . . . . . . 19222 1 159 DCH . 3 3 4 4 DC C3' C 13 . . 3 3 4 4 DC H3' H 1 . -2 . . 2 . . . . . . . . . . . 19222 1 160 DCH . 3 3 5 5 DT C3' C 13 . . 3 3 5 5 DT H3' H 1 . -10 . . 2 . . . . . . . . . . . 19222 1 161 DCH . 3 3 7 7 DG C3' C 13 . . 3 3 7 7 DG H3' H 1 . 3 . . 2 . . . . . . . . . . . 19222 1 162 DCH . 3 3 8 8 DC C3' C 13 . . 3 3 8 8 DC H3' H 1 . 3 . . 2 . . . . . . . . . . . 19222 1 163 DCH . 3 3 9 9 DA C3' C 13 . . 3 3 9 9 DA H3' H 1 . -1 . . 2 . . . . . . . . . . . 19222 1 164 DCH . 3 3 10 10 DC C3' C 13 . . 3 3 10 10 DC H3' H 1 . -3 . . 2 . . . . . . . . . . . 19222 1 165 DCH . 4 4 2 2 DG C3' C 13 . . 4 4 2 2 DG H3' H 1 . 2 . . 2 . . . . . . . . . . . 19222 1 166 DCH . 4 4 3 3 DG C3' C 13 . . 4 4 3 3 DG H3' H 1 . 8 . . 2 . . . . . . . . . . . 19222 1 167 DCH . 4 4 4 4 DT C3' C 13 . . 4 4 4 4 DT H3' H 1 . 6 . . 2 . . . . . . . . . . . 19222 1 168 DCH . 4 4 5 5 DG C3' C 13 . . 4 4 5 5 DG H3' H 1 . 11 . . 2 . . . . . . . . . . . 19222 1 169 DCH . 4 4 6 6 DC C3' C 13 . . 4 4 6 6 DC H3' H 1 . 10 . . 2 . . . . . . . . . . . 19222 1 170 DCH . 4 4 8 8 DA C3' C 13 . . 4 4 8 8 DA H3' H 1 . 10 . . 2 . . . . . . . . . . . 19222 1 171 DCH . 4 4 9 9 DG C3' C 13 . . 4 4 9 9 DG H3' H 1 . 11 . . 2 . . . . . . . . . . . 19222 1 172 DCH . 3 3 1 1 DG C4' C 13 . . 3 3 1 1 DG H4' H 1 . 10 . . 2 . . . . . . . . . . . 19222 1 173 DCH . 3 3 2 2 DC C4' C 13 . . 3 3 2 2 DC H4' H 1 . 6 . . 2 . . . . . . . . . . . 19222 1 174 DCH . 3 3 4 4 DC C4' C 13 . . 3 3 4 4 DC H4' H 1 . 4 . . 2 . . . . . . . . . . . 19222 1 175 DCH . 3 3 5 5 DT C4' C 13 . . 3 3 5 5 DT H4' H 1 . 1 . . 2 . . . . . . . . . . . 19222 1 176 DCH . 3 3 6 6 DA C4' C 13 . . 3 3 6 6 DA H4' H 1 . -1 . . 2 . . . . . . . . . . . 19222 1 177 DCH . 3 3 7 7 DG C4' C 13 . . 3 3 7 7 DG H4' H 1 . 5 . . 2 . . . . . . . . . . . 19222 1 178 DCH . 3 3 8 8 DC C4' C 13 . . 3 3 8 8 DC H4' H 1 . -1 . . 2 . . . . . . . . . . . 19222 1 179 DCH . 3 3 9 9 DA C4' C 13 . . 3 3 9 9 DA H4' H 1 . -4 . . 2 . . . . . . . . . . . 19222 1 180 DCH . 3 3 12 12 DG C4' C 13 . . 3 3 12 12 DG H4' H 1 . 8 . . 2 . . . . . . . . . . . 19222 1 181 DCH . 4 4 3 3 DG C4' C 13 . . 4 4 3 3 DG H4' H 1 . 2 . . 2 . . . . . . . . . . . 19222 1 182 DCH . 4 4 4 4 DT C4' C 13 . . 4 4 4 4 DT H4' H 1 . 5 . . 2 . . . . . . . . . . . 19222 1 183 DCH . 4 4 5 5 DG C4' C 13 . . 4 4 5 5 DG H4' H 1 . 3 . . 2 . . . . . . . . . . . 19222 1 184 DCH . 4 4 6 6 DC C4' C 13 . . 4 4 6 6 DC H4' H 1 . 8 . . 2 . . . . . . . . . . . 19222 1 185 DCH . 4 4 7 7 DT C4' C 13 . . 4 4 7 7 DT H4' H 1 . 14 . . 2 . . . . . . . . . . . 19222 1 186 DCH . 4 4 10 10 DA C4' C 13 . . 4 4 10 10 DA H4' H 1 . 3 . . 2 . . . . . . . . . . . 19222 1 187 DCH . 4 4 11 11 DG C4' C 13 . . 4 4 11 11 DG H4' H 1 . -2 . . 2 . . . . . . . . . . . 19222 1 188 DCH . 5 5 1 1 DC C6 C 13 . . 5 5 1 1 DC H6 H 1 . 9 . . 2 . . . . . . . . . . . 19222 1 189 DCH . 5 5 1 1 DC C5 C 13 . . 5 5 1 1 DC H5 H 1 . 11 . . 2 . . . . . . . . . . . 19222 1 190 DCH . 5 5 2 2 DC C6 C 13 . . 5 5 2 2 DC H6 H 1 . 14 . . 2 . . . . . . . . . . . 19222 1 191 DCH . 5 5 2 2 DC C5 C 13 . . 5 5 2 2 DC H5 H 1 . 15 . . 2 . . . . . . . . . . . 19222 1 192 DCH . 5 5 3 3 DG C8 C 13 . . 5 5 3 3 DG H8 H 1 . 6 . . 2 . . . . . . . . . . . 19222 1 193 DCH . 5 5 4 4 DC C6 C 13 . . 5 5 4 4 DC H6 H 1 . -1 . . 2 . . . . . . . . . . . 19222 1 194 DCH . 5 5 5 5 DT C6 C 13 . . 5 5 5 5 DT H6 H 1 . 3 . . 2 . . . . . . . . . . . 19222 1 195 DCH . 5 5 5 5 DT C7 C 13 . . 5 5 5 5 DT H6 H 1 . 3 . . 2 . . . . . . . . . . . 19222 1 196 DCH . 5 5 6 6 DT C6 C 13 . . 5 5 6 6 DT H6 H 1 . 8 . . 2 . . . . . . . . . . . 19222 1 197 DCH . 5 5 7 7 DA C8 C 13 . . 5 5 7 7 DA H8 H 1 . 12 . . 2 . . . . . . . . . . . 19222 1 198 DCH . 5 5 7 7 DA C2 C 13 . . 5 5 7 7 DA H2 H 1 . 12 . . 2 . . . . . . . . . . . 19222 1 199 DCH . 5 5 8 8 DA C8 C 13 . . 5 5 8 8 DA H8 H 1 . 6 . . 2 . . . . . . . . . . . 19222 1 200 DCH . 5 5 8 8 DA C2 C 13 . . 5 5 8 8 DA H2 H 1 . 8 . . 2 . . . . . . . . . . . 19222 1 201 DCH . 5 5 9 9 DA C8 C 13 . . 5 5 9 9 DA H8 H 1 . 4 . . 2 . . . . . . . . . . . 19222 1 202 DCH . 5 5 9 9 DA C2 C 13 . . 5 5 9 9 DA H2 H 1 . 3 . . 2 . . . . . . . . . . . 19222 1 203 DCH . 5 5 10 10 DC C6 C 13 . . 5 5 10 10 DC H6 H 1 . -3 . . 2 . . . . . . . . . . . 19222 1 204 DCH . 5 5 11 11 DG C8 C 13 . . 5 5 11 11 DG H8 H 1 . -3 . . 2 . . . . . . . . . . . 19222 1 205 DCH . 5 5 12 12 DC C6 C 13 . . 5 5 12 12 DC H6 H 1 . 6 . . 2 . . . . . . . . . . . 19222 1 206 DCH . 5 5 12 12 DC C5 C 13 . . 5 5 12 12 DC H5 H 1 . 7 . . 2 . . . . . . . . . . . 19222 1 207 DCH . 6 6 1 1 DG C8 C 13 . . 6 6 1 1 DG H8 H 1 . 12 . . 2 . . . . . . . . . . . 19222 1 208 DCH . 6 6 2 2 DC C6 C 13 . . 6 6 2 2 DC H6 H 1 . 14 . . 2 . . . . . . . . . . . 19222 1 209 DCH . 6 6 2 2 DC C5 C 13 . . 6 6 2 2 DC H5 H 1 . 9 . . 2 . . . . . . . . . . . 19222 1 210 DCH . 6 6 3 3 DG C8 C 13 . . 6 6 3 3 DG H8 H 1 . 7 . . 2 . . . . . . . . . . . 19222 1 211 DCH . 6 6 4 4 DT C6 C 13 . . 6 6 4 4 DT H6 H 1 . 2 . . 2 . . . . . . . . . . . 19222 1 212 DCH . 6 6 4 4 DT C7 C 13 . . 6 6 4 4 DT H71 H 1 . 0 . . 2 . . . . . . . . . . . 19222 1 213 DCH . 6 6 5 5 DT C6 C 13 . . 6 6 5 5 DT H6 H 1 . 7 . . 2 . . . . . . . . . . . 19222 1 214 DCH . 6 6 5 5 DT C7 C 13 . . 6 6 5 5 DT H71 H 1 . 2 . . 2 . . . . . . . . . . . 19222 1 215 DCH . 6 6 6 6 DT C6 C 13 . . 6 6 6 6 DT H6 H 1 . 11 . . 2 . . . . . . . . . . . 19222 1 216 DCH . 6 6 7 7 DA C8 C 13 . . 6 6 7 7 DA H8 H 1 . 13 . . 2 . . . . . . . . . . . 19222 1 217 DCH . 6 6 7 7 DA C2 C 13 . . 6 6 7 7 DA H2 H 1 . 14 . . 2 . . . . . . . . . . . 19222 1 218 DCH . 6 6 8 8 DA C8 C 13 . . 6 6 8 8 DA H8 H 1 . 5 . . 2 . . . . . . . . . . . 19222 1 219 DCH . 6 6 8 8 DA C2 C 13 . . 6 6 8 8 DA H2 H 1 . 4 . . 2 . . . . . . . . . . . 19222 1 220 DCH . 6 6 9 9 DG C8 C 13 . . 6 6 9 9 DG H8 H 1 . 0 . . 2 . . . . . . . . . . . 19222 1 221 DCH . 6 6 10 10 DC C6 C 13 . . 6 6 10 10 DC H6 H 1 . -7 . . 2 . . . . . . . . . . . 19222 1 222 DCH . 6 6 11 11 DG C8 C 13 . . 6 6 11 11 DG H8 H 1 . -6 . . 2 . . . . . . . . . . . 19222 1 223 DCH . 6 6 12 12 DG C8 C 13 . . 6 6 12 12 DG H8 H 1 . 8 . . 2 . . . . . . . . . . . 19222 1 224 DCH . 5 5 1 1 DC C1' C 13 . . 5 5 1 1 DC H1' H 1 . 8 . . 2 . . . . . . . . . . . 19222 1 225 DCH . 5 5 2 2 DC C1' C 13 . . 5 5 2 2 DC H1' H 1 . 0 . . 2 . . . . . . . . . . . 19222 1 226 DCH . 5 5 3 3 DG C1' C 13 . . 5 5 3 3 DG H1' H 1 . 11 . . 2 . . . . . . . . . . . 19222 1 227 DCH . 5 5 4 4 DC C1' C 13 . . 5 5 4 4 DC H1' H 1 . 4 . . 2 . . . . . . . . . . . 19222 1 228 DCH . 5 5 5 5 DT C1' C 13 . . 5 5 5 5 DT H1' H 1 . 12 . . 2 . . . . . . . . . . . 19222 1 229 DCH . 5 5 6 6 DT C1' C 13 . . 5 5 6 6 DT H1' H 1 . 4 . . 2 . . . . . . . . . . . 19222 1 230 DCH . 5 5 7 7 DA C1' C 13 . . 5 5 7 7 DA H1' H 1 . 0 . . 2 . . . . . . . . . . . 19222 1 231 DCH . 5 5 8 8 DA C1' C 13 . . 5 5 8 8 DA H1' H 1 . 0 . . 2 . . . . . . . . . . . 19222 1 232 DCH . 5 5 9 9 DA C1' C 13 . . 5 5 9 9 DA H1' H 1 . 8 . . 2 . . . . . . . . . . . 19222 1 233 DCH . 5 5 10 10 DC C1' C 13 . . 5 5 10 10 DC H1' H 1 . 11 . . 2 . . . . . . . . . . . 19222 1 234 DCH . 5 5 11 11 DG C1' C 13 . . 5 5 11 11 DG H1' H 1 . 6 . . 2 . . . . . . . . . . . 19222 1 235 DCH . 5 5 12 12 DC C1' C 13 . . 5 5 12 12 DC H1' H 1 . 0 . . 2 . . . . . . . . . . . 19222 1 236 DCH . 6 6 1 1 DG C1' C 13 . . 6 6 1 1 DG H1' H 1 . 4 . . 2 . . . . . . . . . . . 19222 1 237 DCH . 6 6 2 2 DC C1' C 13 . . 6 6 2 2 DC H1' H 1 . -10 . . 2 . . . . . . . . . . . 19222 1 238 DCH . 6 6 3 3 DG C1' C 13 . . 6 6 3 3 DG H1' H 1 . 1 . . 2 . . . . . . . . . . . 19222 1 239 DCH . 6 6 4 4 DT C1' C 13 . . 6 6 4 4 DT H1' H 1 . 0 . . 2 . . . . . . . . . . . 19222 1 240 DCH . 6 6 5 5 DT C1' C 13 . . 6 6 5 5 DT H1' H 1 . 0 . . 2 . . . . . . . . . . . 19222 1 241 DCH . 6 6 6 6 DT C1' C 13 . . 6 6 6 6 DT H1' H 1 . 0 . . 2 . . . . . . . . . . . 19222 1 242 DCH . 6 6 7 7 DA C1' C 13 . . 6 6 7 7 DA H1' H 1 . 11 . . 2 . . . . . . . . . . . 19222 1 243 DCH . 6 6 8 8 DA C1' C 13 . . 6 6 8 8 DA H1' H 1 . 12 . . 2 . . . . . . . . . . . 19222 1 244 DCH . 6 6 9 9 DG C1' C 13 . . 6 6 9 9 DG H1' H 1 . 1 . . 2 . . . . . . . . . . . 19222 1 245 DCH . 6 6 10 10 DC C1' C 13 . . 6 6 10 10 DC H1' H 1 . 8 . . 2 . . . . . . . . . . . 19222 1 246 DCH . 6 6 11 11 DG C1' C 13 . . 6 6 11 11 DG H1' H 1 . 7 . . 2 . . . . . . . . . . . 19222 1 247 DCH . 6 6 12 12 DG C1' C 13 . . 6 6 12 12 DG H1' H 1 . 2 . . 2 . . . . . . . . . . . 19222 1 248 DCH . 5 5 3 3 DG C3' C 13 . . 5 5 3 3 DG H3' H 1 . -3 . . 2 . . . . . . . . . . . 19222 1 249 DCH . 5 5 4 4 DC C3' C 13 . . 5 5 4 4 DC H3' H 1 . 10 . . 2 . . . . . . . . . . . 19222 1 250 DCH . 5 5 5 5 DT C3' C 13 . . 5 5 5 5 DT H3' H 1 . 5 . . 2 . . . . . . . . . . . 19222 1 251 DCH . 5 5 6 6 DT C3' C 13 . . 5 5 6 6 DT H3' H 1 . -2 . . 2 . . . . . . . . . . . 19222 1 252 DCH . 5 5 7 7 DA C3' C 13 . . 5 5 7 7 DA H3' H 1 . 3 . . 2 . . . . . . . . . . . 19222 1 253 DCH . 5 5 8 8 DA C3' C 13 . . 5 5 8 8 DA H3' H 1 . 0 . . 2 . . . . . . . . . . . 19222 1 254 DCH . 5 5 9 9 DA C3' C 13 . . 5 5 9 9 DA H3' H 1 . 3 . . 2 . . . . . . . . . . . 19222 1 255 DCH . 5 5 10 10 DC C3' C 13 . . 5 5 10 10 DC H3' H 1 . 4 . . 2 . . . . . . . . . . . 19222 1 256 DCH . 6 6 5 5 DT C3' C 13 . . 6 6 5 5 DT H3' H 1 . 2 . . 2 . . . . . . . . . . . 19222 1 257 DCH . 6 6 6 6 DT C3' C 13 . . 6 6 6 6 DT H3' H 1 . -5 . . 2 . . . . . . . . . . . 19222 1 258 DCH . 6 6 7 7 DA C3' C 13 . . 6 6 7 7 DA H3' H 1 . -5 . . 2 . . . . . . . . . . . 19222 1 259 DCH . 6 6 8 8 DA C3' C 13 . . 6 6 8 8 DA H3' H 1 . 1 . . 2 . . . . . . . . . . . 19222 1 260 DCH . 6 6 9 9 DG C3' C 13 . . 6 6 9 9 DG H3' H 1 . 11 . . 2 . . . . . . . . . . . 19222 1 261 DCH . 6 6 12 12 DG C3' C 13 . . 6 6 12 12 DG H3' H 1 . 2 . . 2 . . . . . . . . . . . 19222 1 262 DCH . 5 5 3 3 DG C4' C 13 . . 5 5 3 3 DG H4' H 1 . 4 . . 2 . . . . . . . . . . . 19222 1 263 DCH . 5 5 4 4 DC C4' C 13 . . 5 5 4 4 DC H4' H 1 . 2 . . 2 . . . . . . . . . . . 19222 1 264 DCH . 5 5 5 5 DT C4' C 13 . . 5 5 5 5 DT H4' H 1 . 0 . . 2 . . . . . . . . . . . 19222 1 265 DCH . 5 5 6 6 DT C4' C 13 . . 5 5 6 6 DT H4' H 1 . 4 . . 2 . . . . . . . . . . . 19222 1 266 DCH . 5 5 7 7 DA C4' C 13 . . 5 5 7 7 DA H4' H 1 . 6 . . 2 . . . . . . . . . . . 19222 1 267 DCH . 5 5 8 8 DA C4' C 13 . . 5 5 8 8 DA H4' H 1 . 8 . . 2 . . . . . . . . . . . 19222 1 268 DCH . 5 5 9 9 DA C4' C 13 . . 5 5 9 9 DA H4' H 1 . 2 . . 2 . . . . . . . . . . . 19222 1 269 DCH . 6 6 2 2 DC C4' C 13 . . 6 6 2 2 DC H4' H 1 . 12 . . 2 . . . . . . . . . . . 19222 1 270 DCH . 6 6 3 3 DG C4' C 13 . . 6 6 3 3 DG H4' H 1 . -5 . . 2 . . . . . . . . . . . 19222 1 271 DCH . 6 6 4 4 DT C4' C 13 . . 6 6 4 4 DT H4' H 1 . 6 . . 2 . . . . . . . . . . . 19222 1 272 DCH . 6 6 5 5 DT C4' C 13 . . 6 6 5 5 DT H4' H 1 . 3 . . 2 . . . . . . . . . . . 19222 1 273 DCH . 6 6 8 8 DA C4' C 13 . . 6 6 8 8 DA H4' H 1 . 2 . . 2 . . . . . . . . . . . 19222 1 274 DCH . 6 6 9 9 DG C4' C 13 . . 6 6 9 9 DG H4' H 1 . 5 . . 2 . . . . . . . . . . . 19222 1 275 DCH . 6 6 10 10 DC C4' C 13 . . 6 6 10 10 DC H4' H 1 . 2 . . 2 . . . . . . . . . . . 19222 1 276 DCH . 6 6 11 11 DG C4' C 13 . . 6 6 11 11 DG H4' H 1 . 0 . . 2 . . . . . . . . . . . 19222 1 277 DCH . 7 7 1 1 DC C6 C 13 . . 7 7 1 1 DC H6 H 1 . 6 . . 2 . . . . . . . . . . . 19222 1 278 DCH . 7 7 3 3 DC C6 C 13 . . 7 7 3 3 DC H6 H 1 . -2 . . 2 . . . . . . . . . . . 19222 1 279 DCH . 7 7 6 6 DG C8 C 13 . . 7 7 6 6 DG H8 H 1 . 7 . . 2 . . . . . . . . . . . 19222 1 280 DCH . 7 7 7 7 DT C6 C 13 . . 7 7 7 7 DT H6 H 1 . 11 . . 2 . . . . . . . . . . . 19222 1 281 DCH . 7 7 8 8 DA C8 C 13 . . 7 7 8 8 DA H8 H 1 . 9 . . 2 . . . . . . . . . . . 19222 1 282 DCH . 7 7 9 9 DC C6 C 13 . . 7 7 9 9 DC H6 H 1 . 7 . . 2 . . . . . . . . . . . 19222 1 283 DCH . 7 7 10 10 DG C8 C 13 . . 7 7 10 10 DG H8 H 1 . -1 . . 2 . . . . . . . . . . . 19222 1 284 DCH . 7 7 12 12 DG C8 C 13 . . 7 7 12 12 DG H8 H 1 . 7 . . 2 . . . . . . . . . . . 19222 1 285 DCH . 8 8 1 1 DC C6 C 13 . . 8 8 1 1 DC H6 H 1 . 6 . . 2 . . . . . . . . . . . 19222 1 286 DCH . 8 8 4 4 DG C8 C 13 . . 8 8 4 4 DG H8 H 1 . 11 . . 2 . . . . . . . . . . . 19222 1 287 DCH . 8 8 5 5 DT C6 C 13 . . 8 8 5 5 DT H6 H 1 . 12 . . 2 . . . . . . . . . . . 19222 1 288 DCH . 8 8 6 6 DA C8 C 13 . . 8 8 6 6 DA H8 H 1 . 9 . . 2 . . . . . . . . . . . 19222 1 289 DCH . 8 8 7 7 DC C6 C 13 . . 8 8 7 7 DC H6 H 1 . 4 . . 2 . . . . . . . . . . . 19222 1 290 DCH . 8 8 8 8 DG C8 C 13 . . 8 8 8 8 DG H8 H 1 . 7 . . 2 . . . . . . . . . . . 19222 1 291 DCH . 8 8 9 9 DT C6 C 13 . . 8 8 9 9 DT H6 H 1 . 10 . . 2 . . . . . . . . . . . 19222 1 292 DCH . 8 8 11 11 DC C6 C 13 . . 8 8 11 11 DC H6 H 1 . 7 . . 2 . . . . . . . . . . . 19222 1 293 DCH . 8 8 12 12 DG C8 C 13 . . 8 8 12 12 DG H8 H 1 . 7 . . 2 . . . . . . . . . . . 19222 1 294 DCH . 7 7 1 1 DC C3' C 13 . . 7 7 1 1 DC H3' H 1 . -1 . . 2 . . . . . . . . . . . 19222 1 295 DCH . 7 7 4 4 DA C3' C 13 . . 7 7 4 4 DA H3' H 1 . -3 . . 2 . . . . . . . . . . . 19222 1 296 DCH . 7 7 5 5 DC C3' C 13 . . 7 7 5 5 DC H3' H 1 . 3 . . 2 . . . . . . . . . . . 19222 1 297 DCH . 7 7 7 7 DT C3' C 13 . . 7 7 7 7 DT H3' H 1 . 3 . . 2 . . . . . . . . . . . 19222 1 298 DCH . 7 7 9 9 DC C3' C 13 . . 7 7 9 9 DC H3' H 1 . 5 . . 2 . . . . . . . . . . . 19222 1 299 DCH . 7 7 11 11 DC C3' C 13 . . 7 7 11 11 DC H3' H 1 . 0 . . 2 . . . . . . . . . . . 19222 1 300 DCH . 8 8 1 1 DC C3' C 13 . . 8 8 1 1 DC H3' H 1 . -1 . . 2 . . . . . . . . . . . 19222 1 301 DCH . 8 8 2 2 DG C3' C 13 . . 8 8 2 2 DG H3' H 1 . -1 . . 2 . . . . . . . . . . . 19222 1 302 DCH . 8 8 5 5 DT C3' C 13 . . 8 8 5 5 DT H3' H 1 . 3 . . 2 . . . . . . . . . . . 19222 1 303 DCH . 8 8 6 6 DA C3' C 13 . . 8 8 6 6 DA H3' H 1 . 7 . . 2 . . . . . . . . . . . 19222 1 304 DCH . 8 8 7 7 DC C3' C 13 . . 8 8 7 7 DC H3' H 1 . 5 . . 2 . . . . . . . . . . . 19222 1 305 DCH . 8 8 9 9 DT C3' C 13 . . 8 8 9 9 DT H3' H 1 . 4 . . 2 . . . . . . . . . . . 19222 1 306 DCH . 8 8 11 11 DC C3' C 13 . . 8 8 11 11 DC H3' H 1 . 0 . . 2 . . . . . . . . . . . 19222 1 307 DCH . 7 7 1 1 DC C4' C 13 . . 7 7 1 1 DC H4' H 1 . 4 . . 2 . . . . . . . . . . . 19222 1 308 DCH . 7 7 2 2 DG C4' C 13 . . 7 7 2 2 DG H4' H 1 . 6 . . 2 . . . . . . . . . . . 19222 1 309 DCH . 7 7 3 3 DC C4' C 13 . . 7 7 3 3 DC H4' H 1 . -7 . . 2 . . . . . . . . . . . 19222 1 310 DCH . 7 7 7 7 DT C4' C 13 . . 7 7 7 7 DT H4' H 1 . 3 . . 2 . . . . . . . . . . . 19222 1 311 DCH . 7 7 8 8 DA C4' C 13 . . 7 7 8 8 DA H4' H 1 . 2 . . 2 . . . . . . . . . . . 19222 1 312 DCH . 7 7 12 12 DG C4' C 13 . . 7 7 12 12 DG H4' H 1 . 5 . . 2 . . . . . . . . . . . 19222 1 313 DCH . 8 8 2 2 DG C4' C 13 . . 8 8 2 2 DG H4' H 1 . 3 . . 2 . . . . . . . . . . . 19222 1 314 DCH . 8 8 3 3 DC C4' C 13 . . 8 8 3 3 DC H4' H 1 . 0 . . 2 . . . . . . . . . . . 19222 1 315 DCH . 8 8 6 6 DA C4' C 13 . . 8 8 6 6 DA H4' H 1 . 2 . . 2 . . . . . . . . . . . 19222 1 316 DCH . 8 8 9 9 DT C4' C 13 . . 8 8 9 9 DT H4' H 1 . 3 . . 2 . . . . . . . . . . . 19222 1 317 DCH . 8 8 12 12 DG C4' C 13 . . 8 8 12 12 DG H4' H 1 . 5 . . 2 . . . . . . . . . . . 19222 1 stop_ save_ ######################### # Other kinds of data # ######################### save_other_data_types _Other_data_type_list.Sf_category 'other_data_types' _Other_data_type_list.Sf_framecode 'other_data_types' _Other_data_type_list.Entry_ID 19222 _Other_data_type_list.ID 1 _Other_data_type_list.Name . _Other_data_type_list.Definition . _Other_data_type_list.Sample_condition_list_ID . _Other_data_type_list.Sample_condition_list_label . _Other_data_type_list.Details '1H -1H interatomic distance error : 10%' _Other_data_type_list.Text_data_format text _Other_data_type_list.Text_data ; #1H-1H Inter-atomic distance #RN: residue number #RM: residue name #AN: atome name #DI: interdinucleotide distance (Angstrom) #Distance error : +/- 10% of the measured distances #Oligomer 1 ; DNA sequence : 5'-d(TCGTAGCAAGCT)-3' . 5'-d(AGCTTGCTACGA)-3' RN RM AN RN RM AN DI 1 THY H6 2 CYT H6 --- 2 CYT H6 3 GUA H8 5.7 3 GUA H8 4 THY H6 --- 3 GUA H8 4 THY H71 3.0 4 THY H6 5 ADE H8 4.4 5 ADE H8 6 GUA H8 4.5 6 GUA H8 7 CYT H6 --- 7 CYT H6 8 ADE H8 --- 8 ADE H8 9 ADE H8 --- 9 ADE H8 10 GUA H8 4.2 10 GUA H8 11 CYT H6 5.3 11 CYT H6 12 THY H6 --- 13 GUA H8 14 GUA H8 --- 14 GUA H8 15 CYT H6 --- 15 CYT H6 16 THY H6 --- 16 THY H6 17 THY H6 --- 16 THY H6 17 THY H71 3.2 17 THY H6 18 GUA H8 --- 18 GUA H8 19 CYT H6 --- 19 CYT H6 20 THY H6 --- 20 THY H6 21 ADE H8 4.2 21 ADE H8 22 CYT H6 5.0 22 CYT H6 23 GUA H8 4.4 23 GUA H8 24 ADE H8 --- 1 THY H1' 2 CYT H6 --- 2 CYT H1' 3 GUA H8 4.0 3 GUA H1' 4 THY H6 3.4 4 THY H1' 5 ADE H8 4.3 5 ADE H1' 6 GUA H8 4.9 6 GUA H1' 7 CYT H6 3.6 7 CYT H1' 8 ADE H8 4.0 8 ADE H1' 9 ADE H8 3.2 9 ADE H1' 10 GUA H8 3.9 10 GUA H1' 11 CYT H6 3.5 11 CYT H1' 12 THY H6 --- 13 GUA H1' 14 GUA H8 --- 14 GUA H1' 15 CYT H6 3.2 15 CYT H1' 16 THY H6 --- 16 THY H1' 17 THY H6 3.6 17 THY H1' 18 GUA H8 --- 18 GUA H1' 19 CYT H6 --- 19 CYT H1' 20 THY H6 --- 20 THY H1' 21 ADE H8 4.1 21 ADE H1' 22 CYT H6 3.6 22 CYT H1' 23 GUA H8 4.0 23 GUA H1' 24 ADE H8 --- 1 THY H2' 2 CYT H6 --- 2 CYT H2' 3 GUA H8 4.0 3 GUA H2' 4 THY H6 3.4 4 THY H2' 5 ADE H8 3.5 5 ADE H2' 6 GUA H8 3.6 6 GUA H2' 7 CYT H6 3.6 7 CYT H2' 8 ADE H8 3.5 8 ADE H2' 9 ADE H8 3.7 9 ADE H2' 10 GUA H8 --- 10 GUA H2' 11 CYT H6 --- 11 CYT H2' 12 THY H6 --- 13 GUA H2' 14 GUA H8 --- 14 GUA H2' 15 CYT H6 --- 15 CYT H2' 16 THY H6 --- 16 THY H2' 17 THY H6 --- 17 THY H2' 18 GUA H8 3.8 18 GUA H2' 19 CYT H6 --- 19 CYT H2' 20 THY H6 --- 20 THY H2' 21 ADE H8 --- 21 ADE H2' 22 CYT H6 3.7 22 CYT H2' 23 GUA H8 3.8 23 GUA H2' 24 ADE H8 --- 1 THY H2'' 2 CYT H6 --- 2 CYT H2'' 3 GUA H8 3.4 3 GUA H2'' 4 THY H6 2.8 4 THY H2'' 5 ADE H8 --- 5 ADE H2'' 6 GUA H8 3.3 6 GUA H2'' 7 CYT H6 3.1 7 CYT H2'' 8 ADE H8 3.0 8 ADE H2'' 9 ADE H8 3.2 9 ADE H2'' 10 GUA H8 3.3 10 GUA H2'' 11 CYT H6 3.2 11 CYT H2'' 12 THY H6 --- 13 GUA H2'' 14 GUA H8 --- 14 GUA H2'' 15 CYT H6 --- 15 CYT H2'' 16 THY H6 --- 16 THY H2'' 17 THY H6 2.8 17 THY H2'' 18 GUA H8 --- 18 GUA H2'' 19 CYT H6 --- 19 CYT H2'' 20 THY H6 --- 20 THY H2'' 21 ADE H8 3.0 21 ADE H2'' 22 CYT H6 --- 22 CYT H2'' 23 GUA H8 3.3 23 GUA H2'' 24 ADE H8 --- #Oligomer 2 ; DNA sequence : 5'-d(GCTCTAGCACCG)-3' . 5'-d(CGGTGCTAGAGC)-3' RN RM AN RN RM AN DI 1 GUA H8 2 CYT H6 --- 2 CYT H6 3 THY H6 --- 2 CYT H6 3 THY H71 3.0 3 THY H6 4 CYT H6 --- 3 THY H6 4 CYT H5 3.2 4 CYT H6 5 THY H6 4.5 5 THY H6 6 ADE H8 --- 6 ADE H8 7 GUA H8 4.0 7 GUA H8 8 CYT H6 4.9 7 GUA H8 8 CYT H5 4.0 8 CYT H6 9 ADE H8 --- 9 ADE H8 10 CYT H6 --- 9 ADE H8 10 CYT H5 3.5 10 CYT H6 11 CYT H5 3.8 10 CYT H6 11 CYT H6 --- 11 CYT H6 12 GUA H8 --- 13 CYT H6 14 GUA H8 --- 14 GUA H8 15 GUA H8 --- 15 GUA H8 16 THY H6 --- 15 GUA H8 16 THY H71 2.8 16 THY H6 17 GUA H8 4.2 17 GUA H8 18 CYT H5 3.6 17 GUA H8 18 CYT H6 4.9 18 CYT H6 19 THY H6 --- 19 THY H6 20 ADE H8 --- 20 ADE H8 21 GUA H8 4.2 21 GUA H8 22 ADE H8 4.7 22 ADE H8 23 GUA H8 --- 23 GUA H8 24 CYT H6 --- 1 GUA H1' 2 CYT H6 --- 2 CYT H1' 3 THY H6 --- 3 THY H1' 4 CYT H6 3.5 4 CYT H1' 5 THY H6 4.1 5 THY H1' 6 ADE H8 4.0 6 ADE H1' 7 GUA H8 3.6 7 GUA H1' 8 CYT H6 3.5 8 CYT H1' 9 ADE H8 3.8 9 ADE H1' 10 CYT H6 3.5 10 CYT H1' 11 CYT H6 4.3 11 CYT H1' 12 GUA H8 --- 13 CYT H1' 14 GUA H8 --- 14 GUA H1' 15 GUA H8 --- 15 GUA H1' 16 THY H6 3.4 16 THY H1' 17 GUA H8 --- 17 GUA H1' 18 CYT H6 2.8 18 CYT H1' 19 THY H6 --- 19 THY H1' 20 ADE H8 3.9 20 ADE H1' 21 GUA H8 3.5 21 GUA H1' 22 ADE H8 3.1 22 ADE H1' 23 GUA H8 3.7 23 GUA H1' 24 CYT H6 --- 1 GUA H2' 2 CYT H6 --- 2 CYT H2' 3 THY H6 3.1 3 THY H2' 4 CYT H6 3.3 4 CYT H2' 5 THY H6 --- 5 THY H2' 6 ADE H8 --- 6 ADE H2' 7 GUA H8 3.4 7 GUA H2' 8 CYT H6 3.8 8 CYT H2' 9 ADE H8 3.3 9 ADE H2' 10 CYT H6 3.5 10 CYT H2' 11 CYT H6 --- 11 CYT H2' 12 GUA H8 --- 13 CYT H2' 14 GUA H8 --- 14 GUA H2' 15 GUA H8 --- 15 GUA H2' 16 THY H6 --- 16 THY H2' 17 GUA H8 3.3 17 GUA H2' 18 CYT H6 --- 18 CYT H2' 19 THY H6 --- 19 THY H2' 20 ADE H8 --- 20 ADE H2' 21 GUA H8 --- 21 GUA H2' 22 ADE H8 --- 22 ADE H2' 23 GUA H8 --- 23 GUA H2' 24 CYT H6 --- 1 GUA H2'' 2 CYT H6 --- 2 CYT H2'' 3 THY H6 --- 3 THY H2'' 4 CYT H6 --- 4 CYT H2'' 5 THY H6 --- 5 THY H2'' 6 ADE H8 3.1 6 ADE H2'' 7 GUA H8 2.9 7 GUA H2'' 8 CYT H6 3.0 8 CYT H2'' 9 ADE H8 3.1 9 ADE H2'' 10 CYT H6 --- 10 CYT H2'' 11 CYT H6 --- 11 CYT H2'' 12 GUA H8 --- 13 CYT H2'' 14 GUA H8 --- 14 GUA H2'' 15 GUA H8 --- 15 GUA H2'' 16 THY H6 2.8 16 THY H2'' 17 GUA H8 3.0 17 GUA H2'' 18 CYT H6 --- 18 CYT H2'' 19 THY H6 --- 19 THY H2'' 20 ADE H8 --- 20 ADE H2'' 21 GUA H8 3.0 21 GUA H2'' 22 ADE H8 3.1 22 ADE H2'' 23 GUA H8 2.8 23 GUA H2'' 24 CYT H6 --- #Oligomer 3 ; DNA sequence : 5'-d(CCGCTTAAACGC)-3' . 5'-d(GCGTTTAAGCGG)-3' RN RM AN RN RM AN DI 1 CYT H6 2 CYT H6 --- 2 CYT H6 3 GUA H8 5.3 3 GUA H8 4 CYT H6 --- 3 GUA H8 4 CYT H5 3.9 4 CYT H6 5 THY H6 --- 5 THY H6 6 THY H6 --- 5 THY H6 6 THY H71 4.2 6 THY H6 7 ADE H8 4.7 7 ADE H8 8 ADE H8 --- 8 ADE H8 9 ADE H8 --- 9 ADE H8 10 CYT H6 4.0 9 ADE H8 10 CYT H5 4.2 10 CYT H6 11 GUA H8 5.1 11 GUA H8 12 CYT H6 --- 13 GUA H8 14 CYT H6 --- 14 CYT H6 15 GUA H8 --- 15 GUA H8 16 THY H6 4.5 15 GUA H8 16 THY H71 2.9 16 THY H6 17 THY H6 --- 16 THY H6 17 THY H71 2.9 17 THY H6 18 THY H6 --- 17 THY H6 18 THY H71 2.8 18 THY H6 19 ADE H8 --- 19 ADE H8 20 ADE H8 --- 20 ADE H8 21 GUA H8 --- 21 GUA H8 22 CYT H6 --- 21 GUA H8 22 CYT H5 4.1 22 CYT H6 23 GUA H8 4.8 23 GUA H8 24 GUA H8 --- 1 CYT H1' 2 CYT H6 --- 2 CYT H1' 3 GUA H8 4.6 3 GUA H1' 4 CYT H6 --- 4 CYT H1' 5 THY H6 --- 5 THY H1' 6 THY H6 4.2 6 THY H1' 7 ADE H8 3.8 7 ADE H1' 8 ADE H8 3.4 8 ADE H1' 9 ADE H8 --- 9 ADE H1' 10 CYT H6 --- 10 CYT H1' 11 GUA H8 3.5 11 GUA H1' 12 CYT H6 4.4 13 GUA H1' 14 CYT H6 --- 14 CYT H1' 15 GUA H8 3.6 15 GUA H1' 16 THY H6 --- 16 THY H1' 17 THY H6 4.1 17 THY H1' 18 THY H6 3.8 18 THY H1' 19 ADE H8 4.9 19 ADE H1' 20 ADE H8 --- 20 ADE H1' 21 GUA H8 4.2 21 GUA H1' 22 CYT H6 3.5 22 CYT H1' 23 GUA H8 --- 23 GUA H1' 24 GUA H8 --- 1 CYT H2' 2 CYT H6 --- 2 CYT H2' 3 GUA H8 4.0 3 GUA H2' 4 CYT H6 --- 4 CYT H2' 5 THY H6 --- 5 THY H2' 6 THY H6 --- 6 THY H2' 7 ADE H8 --- 7 ADE H2' 8 ADE H8 3.5 8 ADE H2' 9 ADE H8 --- 9 ADE H2' 10 CYT H6 3.5 10 CYT H2' 11 GUA H8 3.3 11 GUA H2' 12 CYT H6 --- 13 GUA H2' 14 CYT H6 --- 14 CYT H2' 15 GUA H8 4.2 15 GUA H2' 16 THY H6 3.3 16 THY H2' 17 THY H6 --- 17 THY H2' 18 THY H6 --- 18 THY H2' 19 ADE H8 3.2 19 ADE H2' 20 ADE H8 --- 20 ADE H2' 21 GUA H8 --- 21 GUA H2' 22 CYT H6 3.5 22 CYT H2' 23 GUA H8 3.6 23 GUA H2' 24 GUA H8 --- 1 CYT H2'' 2 CYT H6 --- 2 CYT H2'' 3 GUA H8 3.4 3 GUA H2'' 4 CYT H6 --- 4 CYT H2'' 5 THY H6 --- 5 THY H2'' 6 THY H6 2.8 6 THY H2'' 7 ADE H8 3.3 7 ADE H2'' 8 ADE H8 --- 8 ADE H2'' 9 ADE H8 2.9 9 ADE H2'' 10 CYT H6 3.0 10 CYT H2'' 11 GUA H8 3.2 11 GUA H2'' 12 CYT H6 --- 13 GUA H2'' 14 CYT H6 --- 14 CYT H2'' 15 GUA H8 3.4 15 GUA H2'' 16 THY H6 3.0 16 THY H2'' 17 THY H6 --- 17 THY H2'' 18 THY H6 3.1 18 THY H2'' 19 ADE H8 3.1 19 ADE H2'' 20 ADE H8 3.1 20 ADE H2'' 21 GUA H8 3.1 21 GUA H2'' 22 CYT H6 3.1 22 CYT H2'' 23 GUA H8 3.3 23 GUA H2'' 24 GUA H8 --- #Oligomer 4 ; DNA sequence : Oligo 4: 5'-d(CGCACGTACGCG)-3' . 5'-d(CGCGTACGTGCG)-3' RN RM AN RN RM AN DI 1 CYT H6 2 GUA H8 --- 2 GUA H8 3 CYT H6 --- 3 CYT H6 4 ADE H8 --- 4 ADE H8 5 CYT H6 4.8 5 CYT H6 6 GUA H8 3.7 6 GUA H8 7 THY H6 4.1 6 GUA H8 7 THY H71 2.8 7 THY H6 8 ADE H8 --- 8 ADE H8 9 CYT H6 --- 9 CYT H6 10 GUA H8 --- 10 GUA H8 11 CYT H5 4.0 10 GUA H8 11 CYT H6 4.8 11 CYT H6 12 GUA H8 --- 13 CYT H6 14 GUA H8 --- 14 GUA H8 15 CYT H5 4.7 14 GUA H8 15 CYT H6 4.3 15 CYT H6 16 GUA H8 --- 16 GUA H8 17 THY H6 4.1 16 GUA H8 17 THY H71 2.7 17 THY H6 18 ADE H8 --- 18 ADE H8 19 CYT H6 --- 19 CYT H6 20 GUA H8 --- 20 GUA H8 21 THY H71 2.8 20 GUA H8 21 THY H6 4.4 21 THY H6 22 GUA H8 4.1 22 GUA H8 23 CYT H6 5.0 23 CYT H6 24 GUA H8 --- 1 CYT H1' 2 GUA H8 --- 2 GUA H1' 3 CYT H6 3.6 3 CYT H1' 4 ADE H8 4.0 4 ADE H1' 5 CYT H6 3.8 5 CYT H1' 6 GUA H8 --- 6 GUA H1' 7 THY H6 4.6 7 THY H1' 8 ADE H8 --- 8 ADE H1' 9 CYT H6 --- 9 CYT H1' 10 GUA H8 4.1 10 GUA H1' 11 CYT H6 3.8 11 CYT H1' 12 GUA H8 --- 13 CYT H1' 14 GUA H8 --- 14 GUA H1' 15 CYT H6 3.8 15 CYT H1' 16 GUA H8 3.5 16 GUA H1' 17 THY H6 3.9 17 THY H1' 18 ADE H8 --- 18 ADE H1' 19 CYT H6 --- 19 CYT H1' 20 GUA H8 --- 20 GUA H1' 21 THY H6 3.4 21 THY H1' 22 GUA H8 5.2 22 GUA H1' 23 CYT H6 3.8 23 CYT H1' 24 GUA H8 --- 1 CYT H2' 2 GUA H8 --- 2 GUA H2' 3 CYT H6 --- 3 CYT H2' 4 ADE H8 --- 4 ADE H2' 5 CYT H6 --- 5 CYT H2' 6 GUA H8 3.6 6 GUA H2' 7 THY H6 3.5 7 THY H2' 8 ADE H8 --- 8 ADE H2' 9 CYT H6 --- 9 CYT H2' 10 GUA H8 3.4 10 GUA H2' 11 CYT H6 --- 11 CYT H2' 12 GUA H8 --- 13 CYT H2' 14 GUA H8 --- 14 GUA H2' 15 CYT H6 --- 15 CYT H2' 16 GUA H8 --- 16 GUA H2' 17 THY H6 3.4 17 THY H2' 18 ADE H8 --- 18 ADE H2' 19 CYT H6 --- 19 CYT H2' 20 GUA H8 3.5 20 GUA H2' 21 THY H6 3.2 21 THY H2' 22 GUA H8 3.6 22 GUA H2' 23 CYT H6 --- 23 CYT H2' 24 GUA H8 --- 1 CYT H2'' 2 GUA H8 --- 2 GUA H2'' 3 CYT H6 --- 3 CYT H2'' 4 ADE H8 3.3 4 ADE H2'' 5 CYT H6 3.0 5 CYT H2'' 6 GUA H8 --- 6 GUA H2'' 7 THY H6 2.9 7 THY H2'' 8 ADE H8 --- 8 ADE H2'' 9 CYT H6 --- 9 CYT H2'' 10 GUA H8 3.2 10 GUA H2'' 11 CYT H6 --- 11 CYT H2'' 12 GUA H8 --- 13 CYT H2'' 14 GUA H8 --- 14 GUA H2'' 15 CYT H6 3.0 15 CYT H2'' 16 GUA H8 3.0 16 GUA H2'' 17 THY H6 2.9 17 THY H2'' 18 ADE H8 --- 18 ADE H2'' 19 CYT H6 --- 19 CYT H2'' 20 GUA H8 --- 20 GUA H2'' 21 THY H6 2.9 21 THY H2'' 22 GUA H8 3.2 22 GUA H2'' 23 CYT H6 --- 23 CYT H2'' 24 GUA H8 --- ; save_