data_19278 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Structure of d[GCGCGAAGCATTCGCGGGGAGGTGGGGAAGGG] duplex-quadruplex hybrid ; _BMRB_accession_number 19278 _BMRB_flat_file_name bmr19278.str _Entry_type original _Submission_date 2013-05-30 _Accession_date 2013-05-30 _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 Lim 'Kah Wai' . . 2 Phan 'Anh Tuan' . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 266 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2013-10-09 update BMRB 'update entry citation' 2013-07-08 original author 'original release' stop_ loop_ _Related_BMRB_accession_number _Relationship 19276 'd[CGCGAAGCATTCGCG] hairpin' 19277 'd[GGTTGGCGCGAAGCATTCGCGGGTTGG] duplex-quadruplex hybrid' 19279 'd[GGGAAGGGCGCGAAGCATTCGCGAGGTAGG] duplex-quadruplex hybrid' 19280 'd[AGGGTGGGTGCTGGGGCGCGAAGCATTCGCGAGG] duplex-quadruplex hybrid' 19281 'd[TTGGGTGGGCGCGAAGCATTCGCGGGGTGGGT] duplex-quadruplex hybrid' stop_ save_ ############################# # Citation for this entry # ############################# save_Citation_1 _Saveframe_category entry_citation _Citation_full . _Citation_title 'Structural basis of DNA quadruplex-duplex junction formation.' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 23794476 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Lim 'Kah Wai' . . 2 Phan 'Anh Tuan' . . stop_ _Journal_abbreviation 'Angew. Chem. Int. Ed. Engl.' _Journal_name_full 'Angewandte Chemie (International ed. in English)' _Journal_volume 52 _Journal_issue 33 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 8566 _Page_last 8569 _Year 2013 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'd[GCGCGAAGCATTCGCGGGGAGGTGGGGAAGGG] duplex-quadruplex hybrid' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'DNA (32-MER)' $DNA_(32-MER) stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_DNA_(32-MER) _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class DNA _Name_common DNA_(32-MER) _Molecular_mass 10118.558 _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 32 _Mol_residue_sequence ; GCGCGAAGCATTCGCGGGGA GGTGGGGAAGGG ; loop_ _Residue_seq_code _Residue_label 1 DG 2 DC 3 DG 4 DC 5 DG 6 DA 7 DA 8 DG 9 DC 10 DA 11 DT 12 DT 13 DC 14 DG 15 DC 16 DG 17 DG 18 DG 19 DG 20 DA 21 DG 22 DG 23 DT 24 DG 25 DG 26 DG 27 DG 28 DA 29 DA 30 DG 31 DG 32 DG 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_(32-MER) . . . . . . 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_(32-MER) 'chemical synthesis' . . . . . stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_DNA-1 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $DNA_(32-MER) 0.5-2.0 mM 'natural abundance' H2O 90 % 'natural abundance' D2O 10 % 'natural abundance' stop_ save_ save_DNA-2 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $DNA_(32-MER) 0.5-2.0 mM 'natural abundance' D2O 100 % 'natural abundance' stop_ save_ save_DNA-3 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $DNA_(32-MER) 0.5-2.0 mM '[U-2% 15N]' H2O 90 % 'natural abundance' D2O 10 % 'natural abundance' stop_ save_ save_DNA-4 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $DNA_(32-MER) 0.5-2.0 mM '[U-100% 2H]' D2O 100 % 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Saveframe_category software _Name TOPSPIN _Version 2.1 loop_ _Vendor _Address _Electronic_address 'Bruker Biospin' . . stop_ loop_ _Task processing stop_ _Details . save_ save_Felix _Saveframe_category software _Name Felix _Version 2007 loop_ _Vendor _Address _Electronic_address 'Felix NMR, Inc.' . . stop_ loop_ _Task 'peak picking' stop_ _Details . save_ save_X-PLOR_NIH _Saveframe_category software _Name X-PLOR_NIH _Version 2.29 loop_ _Vendor _Address _Electronic_address 'Schwieters, Kuszewski, Tjandra and Clore' . . stop_ loop_ _Task refinement stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 400 _Details . save_ save_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 600 _Details . save_ save_spectrometer_3 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 700 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_1H-1H_NOESY_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-1H NOESY' _Sample_label $DNA-2 save_ save_2D_1H-1H_JR_NOESY_2 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-1H JR NOESY' _Sample_label $DNA-1 save_ save_2D_1H-1H_JR_NOESY_3 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-1H JR NOESY' _Sample_label $DNA-1 save_ save_2D_1H-1H_COSY_4 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-1H COSY' _Sample_label $DNA-2 save_ save_2D_1H-1H_TOCSY_5 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-1H TOCSY' _Sample_label $DNA-2 save_ save_2D_1H-13C_HSQC_6 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-13C HSQC' _Sample_label $DNA-2 save_ save_2D_1H-13C_JR_HMBC_7 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-13C JR HMBC' _Sample_label $DNA-1 save_ save_2D_1H-31P_HSQC_8 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-31P HSQC' _Sample_label $DNA-2 save_ save_H-D_EXCHANGE_9 _Saveframe_category NMR_applied_experiment _Experiment_name 'H-D EXCHANGE' _Sample_label $DNA-2 save_ save_15N-FILTERED_10 _Saveframe_category NMR_applied_experiment _Experiment_name 15N-FILTERED _Sample_label $DNA-3 save_ save_D-LABELED_11 _Saveframe_category NMR_applied_experiment _Experiment_name D-LABELED _Sample_label $DNA-4 save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units temperature 298 . K pH 7 . pH pressure 1 . atm 'ionic strength' 40 . mM stop_ save_ save_sample_conditions_2 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units temperature 278 . K pH 7 . pH pressure 1 . atm 'ionic strength' 40 . mM stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _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 _Indirect_shift_ratio DSS H 1 'methyl protons' ppm 0.00 internal direct . . . 1.000000000 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 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '2D 1H-1H NOESY' '2D 1H-1H JR NOESY' 15N-FILTERED D-LABELED stop_ loop_ _Sample_label $DNA-2 $DNA-1 $DNA-3 $DNA-4 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name 'DNA (32-MER)' _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 1 DG H1 H 11.758 0.010 1 2 1 1 DG H1' H 4.538 0.010 1 3 1 1 DG H2' H 2.220 0.010 1 4 1 1 DG H2'' H 2.467 0.010 1 5 1 1 DG H3' H 4.801 0.010 1 6 1 1 DG H4' H 4.452 0.010 1 7 1 1 DG H5' H 4.483 0.010 2 8 1 1 DG H5'' H 3.867 0.010 2 9 1 1 DG H8 H 6.234 0.010 1 10 2 2 DC H1' H 5.588 0.010 1 11 2 2 DC H2' H 1.676 0.010 1 12 2 2 DC H2'' H 2.283 0.010 1 13 2 2 DC H3' H 4.735 0.010 1 14 2 2 DC H4' H 3.476 0.010 1 15 2 2 DC H5 H 5.206 0.010 1 16 2 2 DC H5' H 4.024 0.010 2 17 2 2 DC H5'' H 3.208 0.010 2 18 2 2 DC H6 H 6.962 0.010 1 19 2 2 DC H41 H 8.444 0.010 1 20 2 2 DC H42 H 6.395 0.010 1 21 3 3 DG H1 H 12.867 0.010 1 22 3 3 DG H1' H 5.868 0.010 1 23 3 3 DG H2' H 2.647 0.010 1 24 3 3 DG H2'' H 2.717 0.010 1 25 3 3 DG H3' H 4.994 0.010 1 26 3 3 DG H4' H 4.419 0.010 1 27 3 3 DG H8 H 7.882 0.010 1 28 4 4 DC H1' H 5.608 0.010 1 29 4 4 DC H2' H 1.836 0.010 1 30 4 4 DC H2'' H 2.273 0.010 1 31 4 4 DC H3' H 4.805 0.010 1 32 4 4 DC H4' H 4.119 0.010 1 33 4 4 DC H5 H 5.347 0.010 1 34 4 4 DC H6 H 7.236 0.010 1 35 4 4 DC H41 H 8.239 0.010 1 36 4 4 DC H42 H 6.341 0.010 1 37 5 5 DG H1 H 12.733 0.010 1 38 5 5 DG H1' H 5.373 0.010 1 39 5 5 DG H2' H 2.605 0.010 1 40 5 5 DG H2'' H 2.685 0.010 1 41 5 5 DG H3' H 4.952 0.010 1 42 5 5 DG H4' H 4.257 0.010 1 43 5 5 DG H8 H 7.834 0.010 1 44 6 6 DA H1' H 5.881 0.010 1 45 6 6 DA H2 H 7.568 0.010 1 46 6 6 DA H2' H 2.287 0.010 1 47 6 6 DA H2'' H 2.601 0.010 1 48 6 6 DA H3' H 4.955 0.010 1 49 6 6 DA H4' H 4.286 0.010 1 50 6 6 DA H8 H 7.897 0.010 1 51 7 7 DA H1' H 5.887 0.010 1 52 7 7 DA H2 H 7.693 0.010 1 53 7 7 DA H2' H 2.057 0.010 1 54 7 7 DA H2'' H 2.432 0.010 1 55 7 7 DA H3' H 4.878 0.010 1 56 7 7 DA H4' H 4.341 0.010 1 57 7 7 DA H8 H 7.450 0.010 1 58 8 8 DG H1' H 5.400 0.010 1 59 8 8 DG H2' H 2.628 0.010 1 60 8 8 DG H2'' H 2.350 0.010 1 61 8 8 DG H3' H 4.809 0.010 1 62 8 8 DG H4' H 4.369 0.010 1 63 8 8 DG H8 H 8.032 0.010 1 64 9 9 DC H1' H 5.708 0.010 1 65 9 9 DC H2' H 1.598 0.010 1 66 9 9 DC H2'' H 2.049 0.010 1 67 9 9 DC H3' H 4.413 0.010 1 68 9 9 DC H4' H 2.122 0.010 1 69 9 9 DC H5 H 5.211 0.010 1 70 9 9 DC H5' H 3.353 0.010 2 71 9 9 DC H5'' H 3.048 0.010 2 72 9 9 DC H6 H 7.193 0.010 1 73 10 10 DA H1' H 6.314 0.010 1 74 10 10 DA H2 H 8.037 0.010 1 75 10 10 DA H2' H 2.994 0.010 1 76 10 10 DA H2'' H 2.946 0.010 1 77 10 10 DA H3' H 4.817 0.010 1 78 10 10 DA H4' H 4.333 0.010 1 79 10 10 DA H5' H 3.977 0.010 2 80 10 10 DA H5'' H 3.836 0.010 2 81 10 10 DA H8 H 8.076 0.010 1 82 11 11 DT H1' H 5.680 0.010 1 83 11 11 DT H2' H 2.092 0.010 1 84 11 11 DT H2'' H 2.493 0.010 1 85 11 11 DT H3 H 13.295 0.010 1 86 11 11 DT H3' H 4.741 0.010 1 87 11 11 DT H4' H 4.284 0.010 1 88 11 11 DT H5' H 4.330 0.010 2 89 11 11 DT H5'' H 4.083 0.010 2 90 11 11 DT H6 H 7.389 0.010 1 91 11 11 DT H71 H 1.830 0.010 2 92 11 11 DT H72 H 1.830 0.010 2 93 11 11 DT H73 H 1.830 0.010 2 94 12 12 DT H1' H 6.026 0.010 1 95 12 12 DT H2' H 2.159 0.010 1 96 12 12 DT H2'' H 2.449 0.010 1 97 12 12 DT H3 H 13.872 0.010 1 98 12 12 DT H3' H 4.842 0.010 1 99 12 12 DT H4' H 4.206 0.010 1 100 12 12 DT H6 H 7.399 0.010 1 101 12 12 DT H71 H 1.612 0.010 2 102 12 12 DT H72 H 1.612 0.010 2 103 12 12 DT H73 H 1.612 0.010 2 104 13 13 DC H1' H 5.558 0.010 1 105 13 13 DC H2' H 2.003 0.010 1 106 13 13 DC H2'' H 2.306 0.010 1 107 13 13 DC H3' H 4.778 0.010 1 108 13 13 DC H4' H 4.100 0.010 1 109 13 13 DC H5 H 5.626 0.010 1 110 13 13 DC H6 H 7.439 0.010 1 111 13 13 DC H41 H 8.483 0.010 1 112 13 13 DC H42 H 6.850 0.010 1 113 14 14 DG H1 H 12.817 0.010 1 114 14 14 DG H1' H 5.711 0.010 1 115 14 14 DG H2' H 2.447 0.010 1 116 14 14 DG H2'' H 2.524 0.010 1 117 14 14 DG H3' H 4.839 0.010 1 118 14 14 DG H4' H 4.247 0.010 1 119 14 14 DG H8 H 7.744 0.010 1 120 15 15 DC H1' H 5.604 0.010 1 121 15 15 DC H2' H 1.545 0.010 1 122 15 15 DC H2'' H 2.110 0.010 1 123 15 15 DC H3' H 4.650 0.010 1 124 15 15 DC H4' H 4.009 0.010 1 125 15 15 DC H5 H 5.169 0.010 1 126 15 15 DC H6 H 6.989 0.010 1 127 15 15 DC H41 H 8.165 0.010 1 128 15 15 DC H42 H 6.308 0.010 1 129 16 16 DG H1 H 13.121 0.010 1 130 16 16 DG H1' H 5.541 0.010 1 131 16 16 DG H2' H 2.485 0.010 1 132 16 16 DG H2'' H 2.647 0.010 1 133 16 16 DG H3' H 4.950 0.010 1 134 16 16 DG H4' H 4.276 0.010 1 135 16 16 DG H8 H 7.595 0.010 1 136 17 17 DG H1 H 11.182 0.010 1 137 17 17 DG H1' H 5.998 0.010 1 138 17 17 DG H2' H 2.649 0.010 1 139 17 17 DG H2'' H 2.915 0.010 1 140 17 17 DG H3' H 5.024 0.010 1 141 17 17 DG H4' H 4.461 0.010 1 142 17 17 DG H8 H 7.918 0.010 1 143 18 18 DG H1 H 11.191 0.010 1 144 18 18 DG H1' H 6.205 0.010 1 145 18 18 DG H2' H 2.720 0.010 1 146 18 18 DG H2'' H 2.846 0.010 1 147 18 18 DG H3' H 5.026 0.010 1 148 18 18 DG H4' H 4.671 0.010 1 149 18 18 DG H8 H 7.730 0.010 1 150 18 18 DG H21 H 9.789 0.010 1 151 18 18 DG H22 H 8.714 0.010 1 152 19 19 DG H1 H 11.350 0.010 1 153 19 19 DG H1' H 6.051 0.010 1 154 19 19 DG H2' H 2.229 0.010 1 155 19 19 DG H2'' H 2.337 0.010 1 156 19 19 DG H3' H 4.685 0.010 1 157 19 19 DG H4' H 2.820 0.010 1 158 19 19 DG H5' H 3.725 0.010 2 159 19 19 DG H5'' H 3.577 0.010 2 160 19 19 DG H8 H 7.498 0.010 1 161 20 20 DA H1' H 6.661 0.010 1 162 20 20 DA H2 H 8.481 0.010 1 163 20 20 DA H2' H 3.197 0.010 1 164 20 20 DA H2'' H 3.303 0.010 1 165 20 20 DA H3' H 5.476 0.010 1 166 20 20 DA H4' H 4.440 0.010 1 167 20 20 DA H5' H 4.248 0.010 2 168 20 20 DA H5'' H 3.836 0.010 2 169 20 20 DA H8 H 8.782 0.010 1 170 21 21 DG H1 H 11.229 0.010 1 171 21 21 DG H1' H 6.258 0.010 1 172 21 21 DG H2' H 2.624 0.010 1 173 21 21 DG H2'' H 2.898 0.010 1 174 21 21 DG H3' H 4.968 0.010 1 175 21 21 DG H4' H 4.471 0.010 1 176 21 21 DG H5' H 4.473 0.010 2 177 21 21 DG H5'' H 4.383 0.010 2 178 21 21 DG H8 H 7.920 0.010 1 179 21 21 DG H21 H 9.226 0.010 1 180 21 21 DG H22 H 6.786 0.010 1 181 22 22 DG H1 H 11.129 0.010 1 182 22 22 DG H1' H 6.509 0.010 1 183 22 22 DG H2' H 2.730 0.010 1 184 22 22 DG H2'' H 2.578 0.010 1 185 22 22 DG H3' H 5.110 0.010 1 186 22 22 DG H4' H 4.691 0.010 1 187 22 22 DG H8 H 8.085 0.010 1 188 23 23 DT H1' H 6.548 0.010 1 189 23 23 DT H2' H 2.472 0.010 1 190 23 23 DT H2'' H 2.692 0.010 1 191 23 23 DT H3' H 5.116 0.010 1 192 23 23 DT H4' H 4.689 0.010 1 193 23 23 DT H5' H 4.366 0.010 2 194 23 23 DT H5'' H 4.261 0.010 2 195 23 23 DT H6 H 7.881 0.010 1 196 23 23 DT H71 H 1.994 0.010 2 197 23 23 DT H72 H 1.994 0.010 2 198 23 23 DT H73 H 1.994 0.010 2 199 24 24 DG H1 H 11.758 0.010 1 200 24 24 DG H1' H 6.184 0.010 1 201 24 24 DG H2' H 2.544 0.010 1 202 24 24 DG H2'' H 2.896 0.010 1 203 24 24 DG H3' H 5.157 0.010 1 204 24 24 DG H4' H 4.489 0.010 1 205 24 24 DG H8 H 8.001 0.010 1 206 25 25 DG H1 H 11.421 0.010 1 207 25 25 DG H1' H 6.147 0.010 1 208 25 25 DG H2' H 2.692 0.010 1 209 25 25 DG H2'' H 2.771 0.010 1 210 25 25 DG H3' H 4.986 0.010 1 211 25 25 DG H4' H 4.541 0.010 1 212 25 25 DG H8 H 7.991 0.010 1 213 26 26 DG H1 H 11.124 0.010 1 214 26 26 DG H1' H 6.219 0.010 1 215 26 26 DG H2' H 2.457 0.010 1 216 26 26 DG H2'' H 2.517 0.010 1 217 26 26 DG H3' H 4.818 0.010 1 218 26 26 DG H4' H 3.969 0.010 1 219 26 26 DG H5' H 3.804 0.010 2 220 26 26 DG H5'' H 3.476 0.010 2 221 26 26 DG H8 H 7.754 0.010 1 222 27 27 DG H1' H 6.287 0.010 1 223 27 27 DG H2' H 2.969 0.010 1 224 27 27 DG H2'' H 2.623 0.010 1 225 27 27 DG H3' H 4.999 0.010 1 226 27 27 DG H4' H 4.267 0.010 1 227 27 27 DG H8 H 7.959 0.010 1 228 28 28 DA H1' H 6.232 0.010 1 229 28 28 DA H2 H 8.120 0.010 1 230 28 28 DA H2' H 2.612 0.010 1 231 28 28 DA H2'' H 2.728 0.010 1 232 28 28 DA H3' H 4.938 0.010 1 233 28 28 DA H4' H 4.366 0.010 1 234 28 28 DA H5' H 4.072 0.010 2 235 28 28 DA H5'' H 4.025 0.010 2 236 28 28 DA H8 H 8.322 0.010 1 237 29 29 DA H1' H 6.454 0.010 1 238 29 29 DA H2 H 8.205 0.010 1 239 29 29 DA H2' H 2.860 0.010 1 240 29 29 DA H2'' H 2.722 0.010 1 241 29 29 DA H3' H 5.092 0.010 1 242 29 29 DA H4' H 4.226 0.010 1 243 29 29 DA H8 H 8.279 0.010 1 244 30 30 DG H1 H 11.538 0.010 1 245 30 30 DG H1' H 6.164 0.010 1 246 30 30 DG H2' H 2.753 0.010 1 247 30 30 DG H2'' H 2.881 0.010 1 248 30 30 DG H3' H 4.944 0.010 1 249 30 30 DG H4' H 4.474 0.010 1 250 30 30 DG H5' H 4.221 0.010 2 251 30 30 DG H5'' H 4.147 0.010 2 252 30 30 DG H8 H 8.109 0.010 1 253 31 31 DG H1 H 11.538 0.010 1 254 31 31 DG H1' H 6.229 0.010 1 255 31 31 DG H2' H 2.740 0.010 1 256 31 31 DG H2'' H 2.930 0.010 1 257 31 31 DG H3' H 5.078 0.010 1 258 31 31 DG H4' H 4.609 0.010 1 259 31 31 DG H8 H 7.927 0.010 1 260 32 32 DG H1 H 11.443 0.010 1 261 32 32 DG H1' H 6.361 0.010 1 262 32 32 DG H2' H 2.608 0.010 1 263 32 32 DG H2'' H 2.437 0.010 1 264 32 32 DG H3' H 4.718 0.010 1 265 32 32 DG H4' H 4.386 0.010 1 266 32 32 DG H8 H 7.853 0.010 1 stop_ save_