################################### # 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_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 30052 _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 $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D NOESY' . . . 30052 1 5 '2D 1H-31P hetcor' . . . 30052 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 30052 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 1 1 DC H1' H 1 5.754 . . . . . . A 1 DC H1' . 30052 1 2 . 1 1 1 1 DC H2'' H 1 1.773 . . . . . . A 1 DC H2'' . 30052 1 3 . 1 1 1 1 DC H3' H 1 4.665 . . . . . . A 1 DC H3' . 30052 1 4 . 1 1 1 1 DC H4' H 1 4.027 . . . . . . A 1 DC H4' . 30052 1 5 . 1 1 1 1 DC H5 H 1 5.878 . . . . . . A 1 DC H5 . 30052 1 6 . 1 1 1 1 DC H5'' H 1 3.654 . . . . . . A 1 DC H5'' . 30052 1 7 . 1 1 1 1 DC H6 H 1 7.54 . . . . . . A 1 DC H6 . 30052 1 8 . 1 1 1 1 DC H42 H 1 8.201 . . . . . . A 1 DC H42 . 30052 1 9 . 1 1 2 2 DG H1 H 1 13.082 . . . . . . A 2 DG H1 . 30052 1 10 . 1 1 2 2 DG H1' H 1 5.394 . . . . . . A 2 DG H1' . 30052 1 11 . 1 1 2 2 DG H2'' H 1 2.65 . . . . . . A 2 DG H2'' . 30052 1 12 . 1 1 2 2 DG H3' H 1 5.063 . . . . . . A 2 DG H3' . 30052 1 13 . 1 1 2 2 DG H4' H 1 4.287 . . . . . . A 2 DG H4' . 30052 1 14 . 1 1 2 2 DG H5'' H 1 3.973 . . . . . . A 2 DG H5'' . 30052 1 15 . 1 1 2 2 DG H8 H 1 7.929 . . . . . . A 2 DG H8 . 30052 1 16 . 1 1 2 2 DG P P 31 4.03 . . . . . . A 2 DG P . 30052 1 17 . 1 1 3 3 GS H1' H 1 5.828 . . . . . . A 3 GS H1' . 30052 1 18 . 1 1 3 3 GS H2' H 1 2.599 . . . . . . A 3 GS H2' . 30052 1 19 . 1 1 3 3 GS H3' H 1 4.999 . . . . . . A 3 GS H3' . 30052 1 20 . 1 1 3 3 GS H4' H 1 4.436 . . . . . . A 3 GS H4' . 30052 1 21 . 1 1 3 3 GS H5' H 1 4.252 . . . . . . A 3 GS H5' . 30052 1 22 . 1 1 3 3 GS H8 H 1 8.017 . . . . . . A 3 GS H8 . 30052 1 23 . 1 1 3 3 GS P P 31 4.658 . . . . . . A 3 GS P . 30052 1 24 . 1 1 3 3 GS HN1 H 1 13.263 . . . . . . A 3 GS HN1 . 30052 1 25 . 1 1 4 4 DC H1' H 1 5.97 . . . . . . A 4 DC H1' . 30052 1 26 . 1 1 4 4 DC H2'' H 1 2.016 . . . . . . A 4 DC H2'' . 30052 1 27 . 1 1 4 4 DC H3' H 1 4.808 . . . . . . A 4 DC H3' . 30052 1 28 . 1 1 4 4 DC H4' H 1 4.198 . . . . . . A 4 DC H4' . 30052 1 29 . 1 1 4 4 DC H5 H 1 5.408 . . . . . . A 4 DC H5 . 30052 1 30 . 1 1 4 4 DC H6 H 1 7.357 . . . . . . A 4 DC H6 . 30052 1 31 . 1 1 4 4 DC H41 H 1 6.38 . . . . . . A 4 DC H41 . 30052 1 32 . 1 1 4 4 DC H42 H 1 8.332 . . . . . . A 4 DC H42 . 30052 1 33 . 1 1 4 4 DC P P 31 3.485 . . . . . . A 4 DC P . 30052 1 34 . 1 1 5 5 DC H1' H 1 5.528 . . . . . . A 5 DC H1' . 30052 1 35 . 1 1 5 5 DC H2'' H 1 2.055 . . . . . . A 5 DC H2'' . 30052 1 36 . 1 1 5 5 DC H3' H 1 4.824 . . . . . . A 5 DC H3' . 30052 1 37 . 1 1 5 5 DC H4' H 1 4.08 . . . . . . A 5 DC H4' . 30052 1 38 . 1 1 5 5 DC H5 H 1 5.682 . . . . . . A 5 DC H5 . 30052 1 39 . 1 1 5 5 DC H6 H 1 7.46 . . . . . . A 5 DC H6 . 30052 1 40 . 1 1 5 5 DC H41 H 1 6.83 . . . . . . A 5 DC H41 . 30052 1 41 . 1 1 5 5 DC H42 H 1 8.55 . . . . . . A 5 DC H42 . 30052 1 42 . 1 1 5 5 DC P P 31 3.659 . . . . . . A 5 DC P . 30052 1 43 . 1 1 6 6 DG H1 H 1 12.996 . . . . . . A 6 DG H1 . 30052 1 44 . 1 1 6 6 DG H1' H 1 5.954 . . . . . . A 6 DG H1' . 30052 1 45 . 1 1 6 6 DG H2'' H 1 2.702 . . . . . . A 6 DG H2'' . 30052 1 46 . 1 1 6 6 DG H3' H 1 4.984 . . . . . . A 6 DG H3' . 30052 1 47 . 1 1 6 6 DG H4' H 1 4.375 . . . . . . A 6 DG H4' . 30052 1 48 . 1 1 6 6 DG H5'' H 1 4.019 . . . . . . A 6 DG H5'' . 30052 1 49 . 1 1 6 6 DG H8 H 1 7.924 . . . . . . A 6 DG H8 . 30052 1 50 . 1 1 6 6 DG P P 31 3.958 . . . . . . A 6 DG P . 30052 1 51 . 1 1 7 7 DC H1' H 1 5.994 . . . . . . A 7 DC H1' . 30052 1 52 . 1 1 7 7 DC H2'' H 1 2.01 . . . . . . A 7 DC H2'' . 30052 1 53 . 1 1 7 7 DC H3' H 1 4.806 . . . . . . A 7 DC H3' . 30052 1 54 . 1 1 7 7 DC H4' H 1 4.178 . . . . . . A 7 DC H4' . 30052 1 55 . 1 1 7 7 DC H5 H 1 5.436 . . . . . . A 7 DC H5 . 30052 1 56 . 1 1 7 7 DC H6 H 1 7.357 . . . . . . A 7 DC H6 . 30052 1 57 . 1 1 7 7 DC H41 H 1 6.441 . . . . . . A 7 DC H41 . 30052 1 58 . 1 1 7 7 DC H42 H 1 8.237 . . . . . . A 7 DC H42 . 30052 1 59 . 1 1 7 7 DC P P 31 3.602 . . . . . . A 7 DC P . 30052 1 60 . 1 1 8 8 DC H1' H 1 5.466 . . . . . . A 8 DC H1' . 30052 1 61 . 1 1 8 8 DC H2'' H 1 1.844 . . . . . . A 8 DC H2'' . 30052 1 62 . 1 1 8 8 DC H3' H 1 4.764 . . . . . . A 8 DC H3' . 30052 1 63 . 1 1 8 8 DC H4' H 1 4.018 . . . . . . A 8 DC H4' . 30052 1 64 . 1 1 8 8 DC H5 H 1 5.68 . . . . . . A 8 DC H5 . 30052 1 65 . 1 1 8 8 DC H5'' H 1 4.009 . . . . . . A 8 DC H5'' . 30052 1 66 . 1 1 8 8 DC H6 H 1 7.389 . . . . . . A 8 DC H6 . 30052 1 67 . 1 1 8 8 DC H41 H 1 6.938 . . . . . . A 8 DC H41 . 30052 1 68 . 1 1 8 8 DC H42 H 1 8.674 . . . . . . A 8 DC H42 . 30052 1 69 . 1 1 8 8 DC P P 31 4.094 . . . . . . A 8 DC P . 30052 1 70 . 1 1 9 9 DG H1 H 1 12.994 . . . . . . A 9 DG H1 . 30052 1 71 . 1 1 9 9 DG H1' H 1 5.651 . . . . . . A 9 DG H1' . 30052 1 72 . 1 1 9 9 DG H2'' H 1 2.589 . . . . . . A 9 DG H2'' . 30052 1 73 . 1 1 9 9 DG H3' H 1 4.931 . . . . . . A 9 DG H3' . 30052 1 74 . 1 1 9 9 DG H4' H 1 4.258 . . . . . . A 9 DG H4' . 30052 1 75 . 1 1 9 9 DG H5'' H 1 4.073 . . . . . . A 9 DG H5'' . 30052 1 76 . 1 1 9 9 DG H8 H 1 7.838 . . . . . . A 9 DG H8 . 30052 1 77 . 1 1 9 9 DG P P 31 3.89 . . . . . . A 9 DG P . 30052 1 78 . 1 1 10 10 DA H1' H 1 6.333 . . . . . . A 10 DA H1' . 30052 1 79 . 1 1 10 10 DA H2 H 1 7.95 . . . . . . A 10 DA H2 . 30052 1 80 . 1 1 10 10 DA H2'' H 1 2.425 . . . . . . A 10 DA H2'' . 30052 1 81 . 1 1 10 10 DA H3' H 1 4.671 . . . . . . A 10 DA H3' . 30052 1 82 . 1 1 10 10 DA H5'' H 1 4.197 . . . . . . A 10 DA H5'' . 30052 1 83 . 1 1 10 10 DA H8 H 1 8.167 . . . . . . A 10 DA H8 . 30052 1 84 . 1 1 10 10 DA P P 31 3.794 . . . . . . A 10 DA P . 30052 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_chemical_shifts_2 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_2 _Assigned_chem_shift_list.Entry_ID 30052 _Assigned_chem_shift_list.ID 2 _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 $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D NOESY' . . . 30052 2 5 '2D 1H-31P hetcor' . . . 30052 2 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 30052 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 . 2 2 1 1 DT H1' H 1 6.061 . . . . . . B 11 DT H1' . 30052 2 2 . 2 2 1 1 DT H2'' H 1 2.086 . . . . . . B 11 DT H2'' . 30052 2 3 . 2 2 1 1 DT H3 H 1 12.997 . . . . . . B 11 DT H3 . 30052 2 4 . 2 2 1 1 DT H3' H 1 4.681 . . . . . . B 11 DT H3' . 30052 2 5 . 2 2 1 1 DT H4' H 1 4.071 . . . . . . B 11 DT H4' . 30052 2 6 . 2 2 1 1 DT H5'' H 1 3.686 . . . . . . B 11 DT H5'' . 30052 2 7 . 2 2 1 1 DT H6 H 1 7.516 . . . . . . B 11 DT H6 . 30052 2 8 . 2 2 2 2 DC H1' H 1 5.559 . . . . . . B 12 DC H1' . 30052 2 9 . 2 2 2 2 DC H2'' H 1 2.114 . . . . . . B 12 DC H2'' . 30052 2 10 . 2 2 2 2 DC H3' H 1 4.825 . . . . . . B 12 DC H3' . 30052 2 11 . 2 2 2 2 DC H4' H 1 4.105 . . . . . . B 12 DC H4' . 30052 2 12 . 2 2 2 2 DC H5 H 1 5.843 . . . . . . B 12 DC H5 . 30052 2 13 . 2 2 2 2 DC H5'' H 1 4.008 . . . . . . B 12 DC H5'' . 30052 2 14 . 2 2 2 2 DC H6 H 1 7.563 . . . . . . B 12 DC H6 . 30052 2 15 . 2 2 2 2 DC H41 H 1 7.052 . . . . . . B 12 DC H41 . 30052 2 16 . 2 2 2 2 DC H42 H 1 8.646 . . . . . . B 12 DC H42 . 30052 2 17 . 2 2 2 2 DC P P 31 3.625 . . . . . . B 12 DC P . 30052 2 18 . 2 2 3 3 DG H1 H 1 13.18 . . . . . . B 13 DG H1 . 30052 2 19 . 2 2 3 3 DG H1' H 1 5.614 . . . . . . B 13 DG H1' . 30052 2 20 . 2 2 3 3 DG H2'' H 1 2.672 . . . . . . B 13 DG H2'' . 30052 2 21 . 2 2 3 3 DG H3' H 1 4.984 . . . . . . B 13 DG H3' . 30052 2 22 . 2 2 3 3 DG H4' H 1 4.314 . . . . . . B 13 DG H4' . 30052 2 23 . 2 2 3 3 DG H8 H 1 7.897 . . . . . . B 13 DG H8 . 30052 2 24 . 2 2 3 3 DG P P 31 4.038 . . . . . . B 13 DG P . 30052 2 25 . 2 2 4 4 DG H1 H 1 12.993 . . . . . . B 14 DG H1 . 30052 2 26 . 2 2 4 4 DG H1' H 1 5.905 . . . . . . B 14 DG H1' . 30052 2 27 . 2 2 4 4 DG H2'' H 1 2.555 . . . . . . B 14 DG H2'' . 30052 2 28 . 2 2 4 4 DG H3' H 1 4.978 . . . . . . B 14 DG H3' . 30052 2 29 . 2 2 4 4 DG H4' H 1 4.384 . . . . . . B 14 DG H4' . 30052 2 30 . 2 2 4 4 DG H5'' H 1 4.126 . . . . . . B 14 DG H5'' . 30052 2 31 . 2 2 4 4 DG H8 H 1 7.792 . . . . . . B 14 DG H8 . 30052 2 32 . 2 2 4 4 DG P P 31 3.82 . . . . . . B 14 DG P . 30052 2 33 . 2 2 5 5 DC H1' H 1 5.707 . . . . . . B 15 DC H1' . 30052 2 34 . 2 2 5 5 DC H2'' H 1 1.807 . . . . . . B 15 DC H2'' . 30052 2 35 . 2 2 5 5 DC H3' H 1 4.805 . . . . . . B 15 DC H3' . 30052 2 36 . 2 2 5 5 DC H4' H 1 4.062 . . . . . . B 15 DC H4' . 30052 2 37 . 2 2 5 5 DC H5 H 1 5.379 . . . . . . B 15 DC H5 . 30052 2 38 . 2 2 5 5 DC H6 H 1 7.204 . . . . . . B 15 DC H6 . 30052 2 39 . 2 2 5 5 DC H41 H 1 6.346 . . . . . . B 15 DC H41 . 30052 2 40 . 2 2 5 5 DC H42 H 1 8.104 . . . . . . B 15 DC H42 . 30052 2 41 . 2 2 5 5 DC P P 31 3.571 . . . . . . B 15 DC P . 30052 2 42 . 2 2 6 6 DG H1 H 1 13.15 . . . . . . B 16 DG H1 . 30052 2 43 . 2 2 6 6 DG H1' H 1 5.463 . . . . . . B 16 DG H1' . 30052 2 44 . 2 2 6 6 DG H2'' H 1 2.614 . . . . . . B 16 DG H2'' . 30052 2 45 . 2 2 6 6 DG H3' H 1 5.064 . . . . . . B 16 DG H3' . 30052 2 46 . 2 2 6 6 DG H4' H 1 4.295 . . . . . . B 16 DG H4' . 30052 2 47 . 2 2 6 6 DG H5'' H 1 4.07 . . . . . . B 16 DG H5'' . 30052 2 48 . 2 2 6 6 DG H8 H 1 7.851 . . . . . . B 16 DG H8 . 30052 2 49 . 2 2 6 6 DG P P 31 3.664 . . . . . . B 16 DG P . 30052 2 50 . 2 2 7 7 GS H1' H 1 5.966 . . . . . . B 17 GS H1' . 30052 2 51 . 2 2 7 7 GS H2' H 1 2.557 . . . . . . B 17 GS H2' . 30052 2 52 . 2 2 7 7 GS H3' H 1 4.943 . . . . . . B 17 GS H3' . 30052 2 53 . 2 2 7 7 GS H4' H 1 4.405 . . . . . . B 17 GS H4' . 30052 2 54 . 2 2 7 7 GS H5' H 1 4.236 . . . . . . B 17 GS H5' . 30052 2 55 . 2 2 7 7 GS H8 H 1 7.943 . . . . . . B 17 GS H8 . 30052 2 56 . 2 2 7 7 GS P P 31 4.508 . . . . . . B 17 GS P . 30052 2 57 . 2 2 7 7 GS HN1 H 1 13.02 . . . . . . B 17 GS HN1 . 30052 2 58 . 2 2 8 8 DC H1' H 1 6.036 . . . . . . B 18 DC H1' . 30052 2 59 . 2 2 8 8 DC H2'' H 1 2.056 . . . . . . B 18 DC H2'' . 30052 2 60 . 2 2 8 8 DC H3' H 1 4.809 . . . . . . B 18 DC H3' . 30052 2 61 . 2 2 8 8 DC H5 H 1 5.518 . . . . . . B 18 DC H5 . 30052 2 62 . 2 2 8 8 DC H41 H 1 6.841 . . . . . . B 18 DC H41 . 30052 2 63 . 2 2 8 8 DC H42 H 1 8.689 . . . . . . B 18 DC H42 . 30052 2 64 . 2 2 8 8 DC P P 31 3.587 . . . . . . B 18 DC P . 30052 2 65 . 2 2 9 9 DC H1' H 1 5.678 . . . . . . B 19 DC H1' . 30052 2 66 . 2 2 9 9 DC H2'' H 1 1.958 . . . . . . B 19 DC H2'' . 30052 2 67 . 2 2 9 9 DC H3' H 1 4.807 . . . . . . B 19 DC H3' . 30052 2 68 . 2 2 9 9 DC H5 H 1 5.896 . . . . . . B 19 DC H5 . 30052 2 69 . 2 2 9 9 DC H6 H 1 7.58 . . . . . . B 19 DC H6 . 30052 2 70 . 2 2 9 9 DC H42 H 1 8.674 . . . . . . B 19 DC H42 . 30052 2 71 . 2 2 9 9 DC P P 31 3.663 . . . . . . B 19 DC P . 30052 2 72 . 2 2 10 10 DG H1' H 1 6.179 . . . . . . B 20 DG H1' . 30052 2 73 . 2 2 10 10 DG H2'' H 1 2.365 . . . . . . B 20 DG H2'' . 30052 2 74 . 2 2 10 10 DG H3' H 1 4.66 . . . . . . B 20 DG H3' . 30052 2 75 . 2 2 10 10 DG H4' H 1 4.18 . . . . . . B 20 DG H4' . 30052 2 76 . 2 2 10 10 DG H5'' H 1 4.165 . . . . . . B 20 DG H5'' . 30052 2 77 . 2 2 10 10 DG H8 H 1 7.945 . . . . . . B 20 DG H8 . 30052 2 78 . 2 2 10 10 DG P P 31 4.095 . . . . . . B 20 DG P . 30052 2 stop_ save_