data_5134 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Solution Structure of dAAUAA DNA Bulge ; _BMRB_accession_number 5134 _BMRB_flat_file_name bmr5134.str _Entry_type original _Submission_date 2001-09-06 _Accession_date 2001-09-06 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details . loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Gollmick F. A. . 2 Lorenz M. . . 3 Dornberger U. . . 4 'von Langen' J. . . 5 Diekmann S. . . 6 Fritzsche H. . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 2 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 248 "31P chemical shifts" 27 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2010-07-15 update BMRB 'update DNA residue label to two-letter code' 2002-08-23 original author 'original release' stop_ loop_ _Related_BMRB_accession_number _Relationship 5135 "dAATAA DNA Bulge: 5'-D(*GP*CP*AP*TP*CP*GP*AP*AP*TP*AP*AP*GP*CP*TP*AP*CP*G)-3'" stop_ _Original_release_date 2015-08-05 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; Solution Structure of dAATAA and dAAUAA DNA Bulges ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code 22055466 _PubMed_ID 12060684 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Gollmick F. A. . 2 Lorenz M. . . 3 Dornberger U. . . 4 'von Langen' J. . . 5 Diekmann S. . . 6 Fritzsche H. . . stop_ _Journal_abbreviation 'Nucleic Acids Res.' _Journal_volume 30 _Journal_issue 12 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 2669 _Page_last 2677 _Year 2002 _Details . loop_ _Keyword 'DNA bulge' 'deoxyribonucleic acid' 'five-nucleotide bulge loop' stop_ save_ ################################## # Molecular system description # ################################## save_system_DNA_bulge _Saveframe_category molecular_system _Mol_system_name "dAAUAA DNA Bulge: 5'-D(*GP*CP*AP*TP*CP*GP*AP*AP*UP*AP*AP*GP*CP*TP*AP*CP*G)-3'" _Abbreviation_common 'dAAUAA DNA bulge' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 5'-D(*GP*CP*AP*TP*CP*GP*AP*AP*UP*AP*AP*GP*CP*TP*AP*CP*G)-3' $DNA_bulge_chain_A 5'-D(*CP*GP*TP*AP*GP*CP*CP*GP*AP*TP*GP*C)-3' $DNA_bulge_chain_B stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state dimeric _System_paramagnetic no _System_thiol_state 'not present' _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_DNA_bulge_chain_A _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class DNA _Name_common 5'-D(*GP*CP*AP*TP*CP*GP*AP*AP*UP*AP*AP*GP*CP*TP*AP*CP*G)-3' _Abbreviation_common 'dAAUAA DNA Bulge' _Molecular_mass . _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 17 _Mol_residue_sequence ; GCATCGAAUAAGCTACG ; loop_ _Residue_seq_code _Residue_label 1 DG 2 DC 3 DA 4 DT 5 DC 6 DG 7 DA 8 DA 9 DU 10 DA 11 DA 12 DG 13 DC 14 DT 15 DA 16 DC 17 DG stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date . save_ save_DNA_bulge_chain_B _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class DNA _Name_common 5'-D(*CP*GP*TP*AP*GP*CP*CP*GP*AP*TP*GP*C)-3' _Abbreviation_common 'dAAUAA DNA Bulge' _Molecular_mass . _Mol_thiol_state 'not present' _Details . _Residue_count 12 _Mol_residue_sequence ; CGTAGCCGATGC ; loop_ _Residue_seq_code _Residue_label 1 DC 2 DG 3 DT 4 DA 5 DG 6 DC 7 DC 8 DG 9 DA 10 DT 11 DG 12 DC stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date . save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $DNA_bulge_chain_A . . . . . . $DNA_bulge_chain_B . . . . . . stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_name $DNA_bulge_chain_A 'chemical synthesis' . . . . . $DNA_bulge_chain_B 'chemical synthesis' . . . . . stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $DNA_bulge_chain_A 3.8 mM . $DNA_bulge_chain_B 3.8 mM . 'phosphate buffer' 10 mM . NaCl 100 mM . EDTA 0.05 mM . D2O 100 % . stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Saveframe_category software _Name NMRPipe _Version 3 loop_ _Task processing stop_ _Details 'Delaglio et al.' save_ save_MARDIGRAS _Saveframe_category software _Name MARDIGRAS _Version 3.2 loop_ _Task 'iterative matrix relaxation' stop_ _Details 'Borgias, B.A., James, T.L.' save_ save_DYANA _Saveframe_category software _Name DYANA _Version 1.5 loop_ _Task 'structure solution' stop_ _Details 'Guentert, P., Mumenthaler, C., Wuetrich, K.' save_ save_AMBER _Saveframe_category software _Name AMBER _Version 5.0 loop_ _Task 'data analysis' refinement stop_ _Details 'Weiner, S.J., Kollman, P.A., Nguyen, D.T., Case, D.A.' save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _Field_strength 500 _Details . save_ save_NMR_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _Field_strength 600 _Details . save_ save_NMR_spectrometer_3 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _Field_strength 750 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_NOESY_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D NOESY' _Sample_label $sample_1 save_ save_E-COSY_2 _Saveframe_category NMR_applied_experiment _Experiment_name E-COSY _Sample_label $sample_1 save_ save_31P-1H_heteronuclear_correlated_3 _Saveframe_category NMR_applied_experiment _Experiment_name '31P-1H heteronuclear correlated' _Sample_label $sample_1 save_ save_NMR_spec_expt__0_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D NOESY' _BMRB_pulse_sequence_accession_number . _Details . save_ save_NMR_spec_expt__0_2 _Saveframe_category NMR_applied_experiment _Experiment_name E-COSY _BMRB_pulse_sequence_accession_number . _Details . save_ save_NMR_spec_expt__0_3 _Saveframe_category NMR_applied_experiment _Experiment_name '31P-1H heteronuclear correlated' _BMRB_pulse_sequence_accession_number . _Details . save_ ####################### # Sample conditions # ####################### save_sample_cond_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 100 . mM pH 7 . n/a pressure 1 . atm temperature 300 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis TMS H 1 'methyl protons' ppm 0.000 internal direct . . . H3PO4 P 31 PO4 ppm 0.000 external direct cylindrical external . stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_chemical_shift_set_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $sample_cond_1 _Chem_shift_reference_set_label $chemical_shift_reference _Mol_system_component_name 5'-D(*GP*CP*AP*TP*CP*GP*AP*AP*UP*AP*AP*GP*CP*TP*AP*CP*G)-3' _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 . 1 DG H8 H 7.928 0.002 1 2 . 1 DG H1' H 5.948 0.002 1 3 . 1 DG H2' H 2.610 0.002 1 4 . 1 DG H2'' H 2.782 0.002 1 5 . 1 DG H3' H 4.848 0.002 1 6 . 1 DG H4' H 4.257 0.002 1 7 . 1 DG H5' H 3.725 0.002 1 8 . 1 DG H1 H 12.81 0.002 1 9 . 1 DG P P 0.748 0.002 1 10 . 2 DC H6 H 7.477 0.002 1 11 . 2 DC H5 H 5.422 0.002 1 12 . 2 DC H1' H 5.673 0.002 1 13 . 2 DC H2' H 2.182 0.002 1 14 . 2 DC H2'' H 2.493 0.002 1 15 . 2 DC H3' H 4.907 0.002 1 16 . 2 DC H4' H 4.212 0.002 1 17 . 2 DC P P 0.430 0.002 1 18 . 3 DA H8 H 8.386 0.002 1 19 . 3 DA H2 H 7.744 0.002 1 20 . 3 DA H1' H 6.321 0.002 1 21 . 3 DA H2' H 2.756 0.002 1 22 . 3 DA H2'' H 2.994 0.002 1 23 . 3 DA H3' H 5.062 0.002 1 24 . 3 DA H4' H 4.458 0.002 1 25 . 3 DA H5' H 4.116 0.002 1 26 . 3 DA H5'' H 4.210 0.002 1 27 . 3 DA P P 0.930 0.002 1 28 . 4 DT H6 H 7.198 0.002 1 29 . 4 DT H71 H 1.488 0.002 1 30 . 4 DT H72 H 1.488 0.002 1 31 . 4 DT H73 H 1.488 0.002 1 32 . 4 DT H1' H 5.920 0.002 1 33 . 4 DT H2' H 2.003 0.002 1 34 . 4 DT H2'' H 2.419 0.002 1 35 . 4 DT H3' H 4.858 0.002 1 36 . 4 DT H4' H 4.172 0.002 1 37 . 4 DT H5' H 4.315 0.002 1 38 . 4 DT H5'' H 4.457 0.002 1 39 . 4 DT H3 H 13.62 0.002 1 40 . 4 DT P P 0.660 0.002 1 41 . 5 DC H6 H 7.461 0.002 1 42 . 5 DC H5 H 5.681 0.002 1 43 . 5 DC H1' H 5.442 0.002 1 44 . 5 DC H2' H 1.978 0.002 1 45 . 5 DC H2'' H 2.284 0.002 1 46 . 5 DC H3' H 4.805 0.002 1 47 . 5 DC H4' H 4.072 0.002 1 48 . 5 DC P P 0.317 0.002 1 49 . 6 DG H8 H 7.789 0.002 1 50 . 6 DG H1' H 5.641 0.002 1 51 . 6 DG H2' H 2.524 0.002 1 52 . 6 DG H2'' H 2.654 0.002 1 53 . 6 DG H3' H 4.939 0.002 1 54 . 6 DG H4' H 4.301 0.002 1 55 . 6 DG H5' H 3.980 0.002 1 56 . 6 DG H1 H 12.77 0.002 1 57 . 6 DG P P 0.906 0.002 1 58 . 7 DA H8 H 7.786 0.002 1 59 . 7 DA H2 H 7.514 0.002 1 60 . 7 DA H1' H 5.835 0.002 1 61 . 7 DA H2' H 2.187 0.002 1 62 . 7 DA H2'' H 2.497 0.002 1 63 . 7 DA H3' H 4.858 0.002 1 64 . 7 DA H4' H 4.249 0.002 1 65 . 7 DA P P 0.612 0.002 1 66 . 8 DA H8 H 8.040 0.002 1 67 . 8 DA H2 H 7.650 0.002 1 68 . 8 DA H1' H 5.959 0.002 1 69 . 8 DA H2' H 2.466 0.002 1 70 . 8 DA H2'' H 2.493 0.002 1 71 . 8 DA H3' H 4.857 0.002 1 72 . 8 DA H4' H 4.235 0.002 1 73 . 8 DA H5' H 4.040 0.002 1 74 . 8 DA H5'' H 4.100 0.002 1 75 . 8 DA P P 0.681 0.002 1 76 . 9 DU H6 H 7.183 0.002 1 77 . 9 DU H5 H 5.341 0.002 1 78 . 9 DU H1' H 5.662 0.002 1 79 . 9 DU H2' H 1.565 0.002 1 80 . 9 DU H2'' H 1.954 0.002 1 81 . 9 DU H3' H 4.488 0.002 1 82 . 9 DU H4' H 3.758 0.002 1 83 . 9 DU H5' H 3.722 0.002 1 84 . 9 DU H5'' H 3.797 0.002 1 85 . 9 DU P P 0.513 0.002 1 86 . 10 DA H8 H 7.887 0.002 1 87 . 10 DA H2 H 7.776 0.002 1 88 . 10 DA H1' H 5.761 0.002 1 89 . 10 DA H2' H 2.330 0.002 1 90 . 10 DA H2'' H 2.435 0.002 1 91 . 10 DA H3' H 4.737 0.002 1 92 . 10 DA H4' H 4.014 0.002 1 93 . 10 DA H5' H 3.637 0.002 1 94 . 10 DA H5'' H 3.744 0.002 1 95 . 10 DA P P 0.945 0.002 1 96 . 11 DA H8 H 8.024 0.002 1 97 . 11 DA H2 H 7.586 0.002 1 98 . 11 DA H1' H 5.309 0.002 1 99 . 11 DA H2' H 2.474 0.002 1 100 . 11 DA H2'' H 2.494 0.002 1 101 . 11 DA H3' H 4.845 0.002 1 102 . 11 DA H4' H 4.237 0.002 1 103 . 11 DA H5' H 3.973 0.002 1 104 . 11 DA H5'' H 4.012 0.002 1 105 . 11 DA P P 0.403 0.002 1 106 . 12 DG H8 H 7.894 0.002 1 107 . 12 DG H1' H 5.815 0.002 1 108 . 12 DG H2' H 2.696 0.002 1 109 . 12 DG H2'' H 2.696 0.002 1 110 . 12 DG H3' H 4.981 0.002 1 111 . 12 DG H4' H 4.373 0.002 1 112 . 12 DG H1 H 12.50 0.002 1 113 . 12 DG P P 0.665 0.002 1 114 . 13 DC H6 H 7.425 0.002 1 115 . 13 DC H5 H 5.342 0.002 1 116 . 13 DC H1' H 5.963 0.002 1 117 . 13 DC H2' H 2.068 0.002 1 118 . 13 DC H2'' H 2.484 0.002 1 119 . 13 DC H3' H 4.758 0.002 1 120 . 13 DC H4' H 4.239 0.002 1 121 . 13 DC P P 0.866 0.002 1 122 . 14 DT H6 H 7.408 0.002 1 123 . 14 DT H71 H 1.678 0.002 1 124 . 14 DT H72 H 1.678 0.002 1 125 . 14 DT H73 H 1.678 0.002 1 126 . 14 DT H1' H 5.647 0.002 1 127 . 14 DT H2' H 2.140 0.002 1 128 . 14 DT H2'' H 2.450 0.002 1 129 . 14 DT H3' H 4.893 0.002 1 130 . 14 DT H4' H 4.173 0.002 1 131 . 14 DT H3 H 13.84 0.002 1 132 . 14 DT P P 0.636 0.002 1 133 . 15 DA H8 H 8.336 0.002 1 134 . 15 DA H2 H 7.557 0.002 1 135 . 15 DA H1' H 6.216 0.002 1 136 . 15 DA H2' H 2.739 0.002 1 137 . 15 DA H2'' H 2.869 0.002 1 138 . 15 DA H3' H 5.054 0.002 1 139 . 15 DA H4' H 4.452 0.002 1 140 . 15 DA H5' H 4.107 0.002 1 141 . 15 DA H5'' H 4.180 0.002 1 142 . 15 DA P P 0.651 0.002 1 143 . 16 DC H6 H 7.284 0.002 1 144 . 16 DC H5 H 5.381 0.002 1 145 . 16 DC H1' H 5.652 0.002 1 146 . 16 DC H2' H 1.848 0.002 1 147 . 16 DC H2'' H 2.277 0.002 1 148 . 16 DC H3' H 4.781 0.002 1 149 . 16 DC H4' H 4.168 0.002 1 150 . 16 DC H5' H 4.141 0.002 1 151 . 16 DC H5'' H 4.272 0.002 1 152 . 16 DC P P 0.402 0.002 1 153 . 17 DG H8 H 7.871 0.002 1 154 . 17 DG H1' H 6.113 0.002 1 155 . 17 DG H2' H 2.582 0.002 1 156 . 17 DG H2'' H 2.365 0.002 1 157 . 17 DG H3' H 4.655 0.002 1 158 . 17 DG H4' H 4.162 0.002 1 159 . 17 DG H1 H 12.82 0.002 1 stop_ save_ save_chemical_shift_set_2 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $sample_cond_1 _Chem_shift_reference_set_label $chemical_shift_reference _Mol_system_component_name 5'-D(*CP*GP*TP*AP*GP*CP*CP*GP*AP*TP*GP*C)-3' _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 . 1 DC H6 H 7.620 0.002 1 2 . 1 DC H5 H 5.867 0.002 1 3 . 1 DC H1' H 5.747 0.002 1 4 . 1 DC H2' H 2.014 0.002 1 5 . 1 DC H2'' H 2.417 0.002 1 6 . 1 DC H3' H 4.692 0.002 1 7 . 1 DC H4' H 4.065 0.002 1 8 . 1 DC H5' H 3.719 0.002 1 9 . 1 DC H5'' H 4.007 0.002 1 10 . 1 DC P P 0.540 0.002 1 11 . 2 DG H8 H 7.975 0.002 1 12 . 2 DG H1' H 5.972 0.002 1 13 . 2 DG H2' H 2.675 0.002 1 14 . 2 DG H2'' H 2.784 0.002 1 15 . 2 DG H3' H 4.971 0.002 1 16 . 2 DG H4' H 4.360 0.002 1 17 . 2 DG H1 H 12.71 0.002 1 18 . 2 DG P P 0.969 0.002 1 19 . 3 DT H6 H 7.262 0.002 1 20 . 3 DT H71 H 1.500 0.002 1 21 . 3 DT H72 H 1.500 0.002 1 22 . 3 DT H73 H 1.500 0.002 1 23 . 3 DT H1' H 5.608 0.002 1 24 . 3 DT H2' H 2.086 0.002 1 25 . 3 DT H2'' H 2.396 0.002 1 26 . 3 DT H3' H 4.870 0.002 1 27 . 3 DT H4' H 4.179 0.002 1 28 . 3 DT H5' H 4.044 0.002 1 29 . 3 DT H5'' H 4.123 0.002 1 30 . 3 DT H3 H 13.63 0.002 1 31 . 3 DT P P 0.594 0.002 1 32 . 4 DA H8 H 8.200 0.002 1 33 . 4 DA H2 H 7.460 0.002 1 34 . 4 DA H1' H 6.055 0.002 1 35 . 4 DA H2' H 2.741 0.002 1 36 . 4 DA H2'' H 2.909 0.002 1 37 . 4 DA H3' H 5.064 0.002 1 38 . 4 DA H4' H 4.419 0.002 1 39 . 4 DA H5' H 4.043 0.002 1 40 . 4 DA H5'' H 4.169 0.002 1 41 . 4 DA P P 0.661 0.002 1 42 . 5 DG H8 H 7.678 0.002 1 43 . 5 DG H1' H 5.784 0.002 1 44 . 5 DG H2' H 2.492 0.002 1 45 . 5 DG H2'' H 2.665 0.002 1 46 . 5 DG H3' H 5.021 0.002 1 47 . 5 DG H4' H 4.401 0.002 1 48 . 5 DG H5' H 4.242 0.002 1 49 . 5 DG H1 H 12.82 0.002 1 50 . 5 DG P P 0.722 0.002 1 51 . 6 DC H6 H 7.463 0.002 1 52 . 6 DC H5 H 5.408 0.002 1 53 . 6 DC H1' H 6.252 0.002 1 54 . 6 DC H2' H 2.262 0.002 1 55 . 6 DC H2'' H 2.289 0.002 1 56 . 6 DC H3' H 4.776 0.002 1 57 . 6 DC H4' H 4.320 0.002 1 58 . 6 DC P P 0.306 0.002 1 59 . 7 DC H6 H 7.808 0.002 1 60 . 7 DC H5 H 6.121 0.002 1 61 . 7 DC H1' H 5.972 0.002 1 62 . 7 DC H2' H 2.172 0.002 1 63 . 7 DC H2'' H 2.547 0.002 1 64 . 7 DC H3' H 4.953 0.002 1 65 . 7 DC H4' H 4.313 0.002 1 66 . 7 DC P P 0.720 0.002 1 67 . 8 DG H8 H 7.969 0.002 1 68 . 8 DG H1' H 5.503 0.002 1 69 . 8 DG H2' H 2.721 0.002 1 70 . 8 DG H2'' H 2.787 0.002 1 71 . 8 DG H3' H 5.008 0.002 1 72 . 8 DG H4' H 4.315 0.002 1 73 . 8 DG H5' H 4.039 0.002 1 74 . 8 DG H5'' H 4.119 0.002 1 75 . 8 DG H1 H 12.82 0.002 1 76 . 8 DG P P 0.499 0.002 1 77 . 9 DA H8 H 8.242 0.002 1 78 . 9 DA H2 H 7.821 0.002 1 79 . 9 DA H1' H 6.257 0.002 1 80 . 9 DA H2' H 2.653 0.002 1 81 . 9 DA H2'' H 2.926 0.002 1 82 . 9 DA H3' H 5.024 0.002 1 83 . 9 DA H4' H 4.458 0.002 1 84 . 9 DA H5' H 4.202 0.002 1 85 . 9 DA H5'' H 4.252 0.002 1 86 . 9 DA P P 0.933 0.002 1 87 . 10 DT H6 H 7.075 0.002 1 88 . 10 DT H71 H 1.398 0.002 1 89 . 10 DT H72 H 1.398 0.002 1 90 . 10 DT H73 H 1.398 0.002 1 91 . 10 DT H1' H 5.732 0.002 1 92 . 10 DT H2' H 1.930 0.002 1 93 . 10 DT H2'' H 2.332 0.002 1 94 . 10 DT H3' H 4.845 0.002 1 95 . 10 DT H4' H 4.128 0.002 1 96 . 10 DT H5' H 4.253 0.002 1 97 . 10 DT H5'' H 4.069 0.002 1 98 . 10 DT H3 H 13.63 0.002 1 99 . 10 DT P P 0.685 0.002 1 100 . 11 DG H8 H 7.829 0.002 1 101 . 11 DG H1' H 5.909 0.002 1 102 . 11 DG H2' H 2.574 0.002 1 103 . 11 DG H2'' H 2.671 0.002 1 104 . 11 DG H3' H 4.959 0.002 1 105 . 11 DG H4' H 4.349 0.002 1 106 . 11 DG H1 H 12.77 0.002 1 107 . 11 DG P P 0.372 0.002 1 108 . 12 DC H6 H 7.360 0.002 1 109 . 12 DC H5 H 5.249 0.002 1 110 . 12 DC H1' H 6.141 0.002 1 111 . 12 DC H2' H 2.176 0.002 1 112 . 12 DC H2'' H 2.206 0.002 1 113 . 12 DC H3' H 4.475 0.002 1 114 . 12 DC H4' H 4.040 0.002 1 115 . 12 DC H5' H 4.236 0.002 1 116 . 12 DC H5'' H 4.257 0.002 1 stop_ save_