data_4547 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Solution structure of a DNA.RNA hybrid containing an alpha-anomeric thymidine and polarity reversals: d(ATGG-3'-3'-(alpha-T)-5'-5'-GCTC).r(gagcaccau) ; _BMRB_accession_number 4547 _BMRB_flat_file_name bmr4547.str _Entry_type original _Submission_date 1999-08-20 _Accession_date 1999-12-06 _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 Germann M. W. . 2 Aramini J. M. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 2 coupling_constants 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 168 "31P chemical shifts" 16 "coupling constants" 36 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2010-07-16 update BMRB 'update DNA residue label to two-letter code' 2000-12-06 original author 'original release' stop_ save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; Solution structure of a DNA.RNA hybrid containing an alpha-anomeric thymidine and polarity reversals: d(ATGG-3'-3'-(alpha-T)-5'-5'-GCTC).r(gagcaccau) ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code 20039868 _PubMed_ID 10569927 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Germann M. W. . 2 Aramini J. M. . stop_ _Journal_abbreviation Biochemistry _Journal_volume 38 _Journal_issue 47 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 15448 _Page_last 15458 _Year 1999 _Details . loop_ _Keyword 'DNA/RNA HYBRID' 'ALPHAT-ANOMERIC THYMIDINE' "3'-3',5'-5' PHOSPHODIESTER LINKAGES" stop_ save_ ################################## # Molecular system description # ################################## save_DNA_RNA _Saveframe_category molecular_system _Mol_system_name DNA/RNA _Abbreviation_common DNA/RNA _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label DNA $DNA RNA $RNA stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state monomer _System_paramagnetic no _System_thiol_state 'not present' _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_DNA _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class DNA _Name_common 5'-D(ATGG-3'-3'-(ALPHA-T)-5'-5'-GCTC)-3' _Molecular_mass . _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 9 _Mol_residue_sequence ATGGXGCTC loop_ _Residue_seq_code _Residue_label 1 DA 2 DT 3 DG 4 DG 5 T3P 6 DG 7 DC 8 DT 9 DC stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date . save_ save_RNA _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class RNA _Name_common RNA _Molecular_mass . _Mol_thiol_state 'not present' _Details . _Residue_count 9 _Mol_residue_sequence GAGCACCAU loop_ _Residue_seq_code _Residue_label 1 G 2 A 3 G 4 C 5 A 6 C 7 C 8 A 9 U stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date . save_ ###################### # Polymer residues # ###################### save_chem_comp_T3P _Saveframe_category polymer_residue _Mol_type 'DNA LINKING' _Name_common THYMIDINE-3'-PHOSPHATE _BMRB_code . _PDB_code T3P _Standard_residue_derivative . _Molecular_mass 322.208 _Mol_paramagnetic . _Details ; Information obtained from PDB's Chemical Component Dictionary at http://wwpdb-remediation.rutgers.edu/downloads.html Downloaded on Fri Jul 15 13:45:00 2011 ; loop_ _Atom_name _PDB_atom_name _Atom_type _Atom_chirality _Atom_charge _Atom_oxidation_number _Atom_unpaired_electrons P P P . 0 . ? OP1 OP1 O . 0 . ? OP2 OP2 O . 0 . ? OP3 OP3 O . 0 . ? O5' O5' O . 0 . ? C5' C5' C . 0 . ? C4' C4' C . 0 . ? O4' O4' O . 0 . ? C3' C3' C . 0 . ? O3' O3' O . 0 . ? C2' C2' C . 0 . ? C1' C1' C . 0 . ? N1 N1 N . 0 . ? C2 C2 C . 0 . ? O2 O2 O . 0 . ? N3 N3 N . 0 . ? C4 C4 C . 0 . ? O4 O4 O . 0 . ? C5 C5 C . 0 . ? C5M C5M C . 0 . ? C6 C6 C . 0 . ? HOP2 HOP2 H . 0 . ? HOP3 HOP3 H . 0 . ? H5' H5' H . 0 . ? H5'1 H5'1 H . 0 . ? H5'' H5'' H . 0 . ? H4' H4' H . 0 . ? H3' H3' H . 0 . ? H2' H2' H . 0 . ? H2'' H2'' H . 0 . ? H1' H1' H . 0 . ? H3 H3 H . 0 . ? H51 H51 H . 0 . ? H52 H52 H . 0 . ? H53 H53 H . 0 . ? H6 H6 H . 0 . ? stop_ loop_ _Bond_order _Bond_atom_one_atom_name _Bond_atom_two_atom_name _PDB_bond_atom_one_atom_name _PDB_bond_atom_two_atom_name DOUB P OP1 ? ? SING P OP2 ? ? SING P OP3 ? ? SING P O3' ? ? SING OP2 HOP2 ? ? SING OP3 HOP3 ? ? SING O5' C5' ? ? SING O5' H5' ? ? SING C5' C4' ? ? SING C5' H5'1 ? ? SING C5' H5'' ? ? SING C4' O4' ? ? SING C4' C3' ? ? SING C4' H4' ? ? SING O4' C1' ? ? SING C3' O3' ? ? SING C3' C2' ? ? SING C3' H3' ? ? SING C2' C1' ? ? SING C2' H2' ? ? SING C2' H2'' ? ? SING C1' N1 ? ? SING C1' H1' ? ? SING N1 C2 ? ? SING N1 C6 ? ? DOUB C2 O2 ? ? SING C2 N3 ? ? SING N3 C4 ? ? SING N3 H3 ? ? DOUB C4 O4 ? ? SING C4 C5 ? ? SING C5 C5M ? ? DOUB C5 C6 ? ? SING C5M H51 ? ? SING C5M H52 ? ? SING C5M H53 ? ? SING C6 H6 ? ? stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $DNA . . . . . . $RNA . . . . . . 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 . . . . . . $RNA . . . . . . 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 0.89 mM . $RNA 0.89 mM . NaCl 50 mM . NaPhosphate 10 mM . EDTA 0.5 mM . D2O . % . stop_ save_ save_sample_2 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $DNA 0.89 mM . $RNA 0.89 mM . NaCl 50 mM . NaPhosphate 10 mM . EDTA 0.5 mM . D2O 10 % . H2O 90 % . stop_ save_ ############################ # Computer software used # ############################ save_UXNMR _Saveframe_category software _Name UXNMR _Version 2.1 loop_ _Task 'data collection' stop_ _Details BRUKER save_ save_MARDIGRAS _Saveframe_category software _Name MARDIGRAS _Version 3.2 loop_ _Task 'iterative matrix relaxation' stop_ _Details 'BORGIAS & JAMES, 1989' save_ save_CORMA _Saveframe_category software _Name CORMA _Version 5.2 loop_ _Task 'data analysis' stop_ _Details 'BORGIAS & JAMES, 1988' save_ save_SPARKY _Saveframe_category software _Name SPARKY _Version 3.33 loop_ _Task 'data analysis' stop_ _Details UCSF save_ save_AMBER _Saveframe_category software _Name AMBER _Version 4.1 loop_ _Task refinement 'structure solution' stop_ _Details 'PEARLMAN ET AL., 1995' save_ save_SPHINX_LINSHA _Saveframe_category software _Name SPHINX/LINSHA _Version N/A loop_ _Task 'data analysis' stop_ _Details 'WIDMER & WUTHRICH, 1987' save_ save_CURVES _Saveframe_category software _Name CURVES _Version 5.1 loop_ _Task 'data analysis' stop_ _Details 'LAVERY & SKLENAR, 1996' save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model AMX _Field_strength 600 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_NOESY_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D NOESY' _Sample_label . save_ save_DQF-COSY_2 _Saveframe_category NMR_applied_experiment _Experiment_name DQF-COSY _Sample_label . save_ save_31P-1H_CORRELATION_SPECTROSCOPY_3 _Saveframe_category NMR_applied_experiment _Experiment_name '31P-1H CORRELATION SPECTROSCOPY' _Sample_label . 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 DQF-COSY _BMRB_pulse_sequence_accession_number . _Details . save_ save_NMR_spec_expt__0_3 _Saveframe_category NMR_applied_experiment _Experiment_name '31P-1H CORRELATION SPECTROSCOPY' _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 pH 6.6 . n/a temperature 298 . K stop_ save_ save_sample_cond_2 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 6.7 . n/a temperature 298 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_one _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_citation_label _Correction_value_citation_label . H 1 . ppm . . . . . . $entry_citation $entry_citation . P 31 . ppm . . . . . . $entry_citation $entry_citation 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_one _Mol_system_component_name DNA _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 DA H2 H 8.037 . 1 2 . 1 DA H8 H 8.234 . 1 3 . 1 DA H1' H 6.252 . 1 4 . 1 DA H2' H 2.720 . 1 5 . 1 DA H2'' H 2.838 . 1 6 . 1 DA H3' H 4.867 . 1 7 . 1 DA H4' H 4.268 . 1 8 . 1 DA H5' H 3.842 . 2 9 . 1 DA H5'' H 3.842 . 2 10 . 2 DT H6 H 7.480 . 1 11 . 2 DT H71 H 1.487 . 1 12 . 2 DT H72 H 1.487 . 1 13 . 2 DT H73 H 1.487 . 1 14 . 2 DT H1' H 6.090 . 1 15 . 2 DT H2' H 2.356 . 1 16 . 2 DT H2'' H 2.627 . 1 17 . 2 DT H3' H 4.916 . 1 18 . 2 DT H4' H 4.326 . 1 19 . 2 DT H5' H 4.196 . 2 20 . 2 DT H5'' H 4.146 . 2 21 . 2 DT P P -0.53 . 1 22 . 3 DG H1 H 12.45 . 1 23 . 3 DG H8 H 7.776 . 1 24 . 3 DG H1' H 5.948 . 1 25 . 3 DG H2' H 2.625 . 1 26 . 3 DG H2'' H 2.768 . 1 27 . 3 DG H3' H 4.961 . 1 28 . 3 DG H4' H 4.416 . 1 29 . 3 DG H5' H 4.203 . 2 30 . 3 DG H5'' H 4.203 . 2 31 . 3 DG P P -0.44 . 1 32 . 4 DG H1 H 12.90 . 1 33 . 4 DG H8 H 7.519 . 1 34 . 4 DG H1' H 5.974 . 1 35 . 4 DG H2' H 2.619 . 1 36 . 4 DG H2'' H 2.706 . 1 37 . 4 DG H3' H 4.982 . 1 38 . 4 DG H4' H 4.434 . 1 39 . 4 DG H5' H 4.225 . 2 40 . 4 DG H5'' H 4.225 . 2 41 . 4 DG P P -0.42 . 1 42 . 5 T3P H3 H 13.29 . 1 43 . 5 T3P H6 H 7.403 . 1 44 . 5 T3P H51 H 1.295 . 1 45 . 5 T3P H52 H 1.295 . 1 46 . 5 T3P H53 H 1.295 . 1 47 . 5 T3P H1' H 6.342 . 1 48 . 5 T3P H2' H 3.090 . 1 49 . 5 T3P H2'' H 2.094 . 1 50 . 5 T3P H3' H 5.096 . 1 51 . 5 T3P H4' H 4.821 . 1 52 . 5 T3P H5' H 4.100 . 1 53 . 5 T3P H5'' H 3.945 . 1 54 . 5 T3P P P -1.92 . 1 55 . 6 DG H1 H 12.38 . 1 56 . 6 DG H8 H 7.622 . 1 57 . 6 DG H1' H 6.025 . 1 58 . 6 DG H2' H 2.779 . 1 59 . 6 DG H2'' H 2.701 . 1 60 . 6 DG H3' H 4.619 . 1 61 . 6 DG H4' H 4.384 . 1 62 . 6 DG H5' H 4.175 . 2 63 . 6 DG H5'' H 4.175 . 2 64 . 6 DG P P 0.52 . 1 65 . 7 DC H41 H 8.39 . 1 66 . 7 DC H42 H 6.58 . 1 67 . 7 DC H5 H 5.117 . 1 68 . 7 DC H6 H 7.444 . 1 69 . 7 DC H1' H 5.846 . 1 70 . 7 DC H2' H 2.331 . 1 71 . 7 DC H2'' H 2.570 . 1 72 . 7 DC H3' H 4.601 . 1 73 . 7 DC H4' H 4.245 . 1 74 . 7 DC H5' H 4.187 . 2 75 . 7 DC H5'' H 4.126 . 2 76 . 7 DC P P -0.47 . 1 77 . 8 DT H3 H 13.85 . 1 78 . 8 DT H6 H 7.657 . 1 79 . 8 DT H71 H 1.492 . 1 80 . 8 DT H72 H 1.492 . 1 81 . 8 DT H73 H 1.492 . 1 82 . 8 DT H1' H 6.092 . 1 83 . 8 DT H2' H 2.323 . 1 84 . 8 DT H2'' H 2.614 . 1 85 . 8 DT H3' H 4.838 . 1 86 . 8 DT H4' H 4.224 . 1 87 . 8 DT H5' H 4.186 . 2 88 . 8 DT H5'' H 4.119 . 2 89 . 8 DT P P -0.96 . 1 90 . 9 DC H41 H 8.22 . 1 91 . 9 DC H42 H 6.85 . 1 92 . 9 DC H5 H 5.630 . 1 93 . 9 DC H6 H 7.623 . 1 94 . 9 DC H1' H 6.264 . 1 95 . 9 DC H2' H 2.171 . 1 96 . 9 DC H2'' H 2.258 . 1 97 . 9 DC H3' H 4.524 . 1 98 . 9 DC H4' H 4.040 . 1 99 . 9 DC H5' H 4.195 . 2 100 . 9 DC H5'' H 4.093 . 2 101 . 9 DC P P -0.45 . 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_one _Mol_system_component_name RNA _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 G H8 H 7.970 . 1 2 . 1 G H1' H 5.631 . 1 3 . 1 G H2' H 4.814 . 1 4 . 1 G H3' H 4.621 . 1 5 . 1 G H4' H 4.338 . 1 6 . 1 G H5' H 3.988 . 1 7 . 1 G H5'' H 3.889 . 1 8 . 2 A H2 H 7.742 . 1 9 . 2 A H8 H 8.057 . 1 10 . 2 A H1' H 6.034 . 1 11 . 2 A H2' H 4.805 . 1 12 . 2 A H3' H 4.743 . 1 13 . 2 A H4' H 4.542 . 1 14 . 2 A H5' H 4.272 . 2 15 . 2 A H5'' H 4.272 . 2 16 . 2 A P P -0.11 . 1 17 . 3 G H1 H 13.22 . 1 18 . 3 G H8 H 7.255 . 1 19 . 3 G H1' H 5.564 . 1 20 . 3 G H2' H 4.448 . 1 21 . 3 G H3' H 4.392 . 1 22 . 3 G H4' H 4.471 . 1 23 . 3 G H5' H 4.113 . 2 24 . 3 G H5'' H 4.113 . 2 25 . 3 G P P -0.22 . 1 26 . 4 C H41 H 8.34 . 1 27 . 4 C H42 H 6.76 . 1 28 . 4 C H5 H 5.194 . 1 29 . 4 C H6 H 7.549 . 1 30 . 4 C H1' H 5.409 . 1 31 . 4 C H2' H 4.563 . 1 32 . 4 C H3' H 4.468 . 1 33 . 4 C H4' H 4.414 . 1 34 . 4 C H5' H 4.084 . 2 35 . 4 C H5'' H 4.084 . 2 36 . 4 C P P -0.66 . 1 37 . 5 A H2 H 7.338 . 1 38 . 5 A H8 H 8.037 . 1 39 . 5 A H1' H 5.888 . 1 40 . 5 A H2' H 4.598 . 1 41 . 5 A H3' H 4.637 . 1 42 . 5 A H4' H 4.471 . 1 43 . 5 A H5' H 4.132 . 2 44 . 5 A H5'' H 4.132 . 2 45 . 5 A P P -0.39 . 1 46 . 6 C H41 H 8.31 . 1 47 . 6 C H42 H 6.89 . 1 48 . 6 C H5 H 5.238 . 1 49 . 6 C H6 H 7.515 . 1 50 . 6 C H1' H 5.303 . 1 51 . 6 C H2' H 4.273 . 1 52 . 6 C H3' H 4.350 . 1 53 . 6 C H4' H 4.335 . 1 54 . 6 C H5' H 4.051 . 2 55 . 6 C H5'' H 4.051 . 2 56 . 6 C P P -0.65 . 1 57 . 7 C H41 H 8.44 . 1 58 . 7 C H42 H 6.99 . 1 59 . 7 C H5 H 5.526 . 1 60 . 7 C H6 H 7.753 . 1 61 . 7 C H1' H 5.427 . 1 62 . 7 C H2' H 4.361 . 1 63 . 7 C H3' H 4.531 . 1 64 . 7 C H4' H 4.527 . 1 65 . 7 C H5' H 4.075 . 2 66 . 7 C H5'' H 4.075 . 2 67 . 7 C P P -0.72 . 1 68 . 8 A H2 H 7.640 . 1 69 . 8 A H8 H 8.201 . 1 70 . 8 A H1' H 5.991 . 1 71 . 8 A H2' H 4.382 . 1 72 . 8 A H3' H 4.711 . 1 73 . 8 A H4' H 4.466 . 1 74 . 8 A H5' H 4.133 . 2 75 . 8 A H5'' H 4.133 . 2 76 . 8 A P P -0.49 . 1 77 . 9 U H5 H 5.358 . 1 78 . 9 U H6 H 7.577 . 1 79 . 9 U H1' H 5.750 . 1 80 . 9 U H2' H 4.042 . 1 81 . 9 U H3' H 4.173 . 1 82 . 9 U H4' H 4.382 . 1 83 . 9 U P P -0.43 . 1 stop_ save_ ######################## # Coupling constants # ######################## save_coupling_constants _Saveframe_category coupling_constants _Details . loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $sample_cond_1 _Spectrometer_frequency_1H 600 _Mol_system_component_name DNA _Text_data_format . _Text_data . loop_ _Coupling_constant_ID _Coupling_constant_code _Atom_one_residue_seq_code _Atom_one_residue_label _Atom_one_name _Atom_two_residue_seq_code _Atom_two_residue_label _Atom_two_name _Coupling_constant_value _Coupling_constant_min_value _Coupling_constant_max_value _Coupling_constant_value_error 1 3JHH 1 DA H1' 1 DA H2' 6.8 . . 0.5 2 3JHH 1 DA H1' 1 DA H2'' 6.1 . . 0.4 3 3JHH 1 DA H2' 1 DA H3' 6.0 . . 0.4 4 3JHH 1 DA H2'' 1 DA H3' 4.5 . . 0.7 5 3JHH 2 DT H1' 2 DT H2' 9.2 . . 0.7 6 3JHH 2 DT H1' 2 DT H2'' 5.8 . . 0.7 7 3JHH 2 DT H2' 2 DT H3' 6.2 . . 0.5 8 3JHH 2 DT H2'' 2 DT H3' . . 2.5 . 9 3JHH 3 DG H1' 3 DG H2' 9.4 . . 0.5 10 3JHH 3 DG H1' 3 DG H2'' 5.7 . . 0.4 11 3JHH 3 DG H2' 3 DG H3' 5.7 . . 0.4 12 3JHH 3 DG H2'' 3 DG H3' . . 2.5 . 13 3JHH 4 DG H1' 4 DG H2' 9.8 . . 0.5 14 3JHH 4 DG H1' 4 DG H2'' 5.7 . . 0.4 15 3JHH 4 DG H2' 4 DG H3' 5.7 . . 0.4 16 3JHH 4 DG H2'' 4 DG H3' . . 2.5 . 17 3JHH 5 T3P H1' 5 T3P H2' 8.3 . . 0.5 18 3JHH 5 T3P H1' 5 T3P H2'' 3.0 . . 0.7 19 3JHH 5 T3P H2' 5 T3P H3' 6.0 . . 0.5 20 3JHH 5 T3P H2'' 5 T3P H3' . . 2.5 . 21 3JHH 6 DG H1' 6 DG H2' 3.5 . . 0.7 22 3JHH 6 DG H1' 6 DG H2'' 7.1 . . 0.5 23 3JHH 6 DG H2' 6 DG H3' 6.2 . . 0.5 24 3JHH 6 DG H2'' 6 DG H3' 6.7 . . 0.7 25 3JHH 7 DC H1' 7 DC H2' 3.0 . . 0.7 26 3JHH 7 DC H1' 7 DC H2'' 7.2 . . 0.5 27 3JHH 7 DC H2' 7 DC H3' 6.6 . . 0.5 28 3JHH 7 DC H2'' 7 DC H3' 8.5 . . 0.7 29 3JHH 8 DT H1' 8 DT H2' 6.4 . . 0.7 30 3JHH 8 DT H1' 8 DT H2'' 6.4 . . 0.7 31 3JHH 8 DT H2' 8 DT H3' 6.4 . . 0.5 32 3JHH 8 DT H2'' 8 DT H3' 5.5 . . 0.7 33 3JHH 9 DC H1' 9 DC H2' 6.5 . . 0.5 34 3JHH 9 DC H1' 9 DC H2'' 6.8 . . 0.4 35 3JHH 9 DC H2' 9 DC H3' 6.7 . . 0.4 36 3JHH 9 DC H2'' 9 DC H3' 5.5 . . 0.7 stop_ save_