################################### # 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 36612 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _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 1H-1H NOESY' 1 $sample_1 isotropic 36612 1 2 '2D 1H-1H COSY' 1 $sample_1 isotropic 36612 1 3 '2D 1H-1H TOCSY' 1 $sample_1 isotropic 36612 1 4 '2D 1H-13C HMBC' 1 $sample_1 isotropic 36612 1 5 '2D 1H-15N HSQC' 1 $sample_1 isotropic 36612 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_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.Ambiguity_set_ID _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 DA H1' H 1 5.971 0.002 . 1 . . . . A 1 DA H1' . 36612 1 2 . 1 . 1 1 1 DA H2 H 1 7.674 0.002 . 1 . . . . A 1 DA H2 . 36612 1 3 . 1 . 1 1 1 DA H2' H 1 2.254 0.002 . 1 . . . . A 1 DA H2' . 36612 1 4 . 1 . 1 1 1 DA H2'' H 1 2.404 0.002 . 1 . . . . A 1 DA H2'' . 36612 1 5 . 1 . 1 1 1 DA H3' H 1 4.686 0.002 . 1 . . . . A 1 DA H3' . 36612 1 6 . 1 . 1 1 1 DA H4' H 1 3.985 0.002 . 1 . . . . A 1 DA H4' . 36612 1 7 . 1 . 1 1 1 DA H5' H 1 3.445 0.002 . 1 . . . . A 1 DA H5' . 36612 1 8 . 1 . 1 1 1 DA H5'' H 1 3.445 0.002 . 1 . . . . A 1 DA H5'' . 36612 1 9 . 1 . 1 1 1 DA H8 H 1 7.702 0.002 . 1 . . . . A 1 DA H8 . 36612 1 10 . 1 . 1 2 2 DA H1' H 1 5.778 0.002 . 1 . . . . A 2 DA H1' . 36612 1 11 . 1 . 1 2 2 DA H2 H 1 7.721 0.002 . 1 . . . . A 2 DA H2 . 36612 1 12 . 1 . 1 2 2 DA H2' H 1 2.692 0.002 . 1 . . . . A 2 DA H2' . 36612 1 13 . 1 . 1 2 2 DA H2'' H 1 2.692 0.002 . 1 . . . . A 2 DA H2'' . 36612 1 14 . 1 . 1 2 2 DA H3' H 1 4.925 0.002 . 1 . . . . A 2 DA H3' . 36612 1 15 . 1 . 1 2 2 DA H8 H 1 7.960 0.002 . 1 . . . . A 2 DA H8 . 36612 1 16 . 1 . 1 3 3 DG H1 H 1 11.679 0.002 . 1 . . . . A 3 DG H1 . 36612 1 17 . 1 . 1 3 3 DG H1' H 1 6.104 0.002 . 1 . . . . A 3 DG H1' . 36612 1 18 . 1 . 1 3 3 DG H2' H 1 2.767 0.002 . 1 . . . . A 3 DG H2' . 36612 1 19 . 1 . 1 3 3 DG H2'' H 1 2.986 0.002 . 1 . . . . A 3 DG H2'' . 36612 1 20 . 1 . 1 3 3 DG H3' H 1 5.038 0.002 . 1 . . . . A 3 DG H3' . 36612 1 21 . 1 . 1 3 3 DG H4' H 1 4.511 0.002 . 1 . . . . A 3 DG H4' . 36612 1 22 . 1 . 1 3 3 DG H5' H 1 4.172 0.002 . 1 . . . . A 3 DG H5' . 36612 1 23 . 1 . 1 3 3 DG H5'' H 1 4.172 0.002 . 1 . . . . A 3 DG H5'' . 36612 1 24 . 1 . 1 3 3 DG H8 H 1 8.002 0.002 . 1 . . . . A 3 DG H8 . 36612 1 25 . 1 . 1 4 4 DG H1 H 1 11.342 0.002 . 1 . . . . A 4 DG H1 . 36612 1 26 . 1 . 1 4 4 DG H1' H 1 6.045 0.002 . 1 . . . . A 4 DG H1' . 36612 1 27 . 1 . 1 4 4 DG H2' H 1 2.547 0.002 . 1 . . . . A 4 DG H2' . 36612 1 28 . 1 . 1 4 4 DG H2'' H 1 2.676 0.002 . 1 . . . . A 4 DG H2'' . 36612 1 29 . 1 . 1 4 4 DG H3' H 1 4.904 0.002 . 1 . . . . A 4 DG H3' . 36612 1 30 . 1 . 1 4 4 DG H4' H 1 4.460 0.002 . 1 . . . . A 4 DG H4' . 36612 1 31 . 1 . 1 4 4 DG H5' H 1 4.254 0.002 . 1 . . . . A 4 DG H5' . 36612 1 32 . 1 . 1 4 4 DG H5'' H 1 4.309 0.002 . 1 . . . . A 4 DG H5'' . 36612 1 33 . 1 . 1 4 4 DG H8 H 1 7.570 0.002 . 1 . . . . A 4 DG H8 . 36612 1 34 . 1 . 1 5 5 DG H1 H 1 11.176 0.002 . 1 . . . . A 5 DG H1 . 36612 1 35 . 1 . 1 5 5 DG H1' H 1 6.326 0.002 . 1 . . . . A 5 DG H1' . 36612 1 36 . 1 . 1 5 5 DG H2' H 1 2.608 0.002 . 1 . . . . A 5 DG H2' . 36612 1 37 . 1 . 1 5 5 DG H2'' H 1 2.542 0.002 . 1 . . . . A 5 DG H2'' . 36612 1 38 . 1 . 1 5 5 DG H3' H 1 4.979 0.002 . 1 . . . . A 5 DG H3' . 36612 1 39 . 1 . 1 5 5 DG H8 H 1 7.682 0.002 . 1 . . . . A 5 DG H8 . 36612 1 40 . 1 . 1 6 6 DA H1' H 1 6.386 0.002 . 1 . . . . A 6 DA H1' . 36612 1 41 . 1 . 1 6 6 DA H2 H 1 8.307 0.002 . 1 . . . . A 6 DA H2 . 36612 1 42 . 1 . 1 6 6 DA H2' H 1 2.781 0.002 . 1 . . . . A 6 DA H2' . 36612 1 43 . 1 . 1 6 6 DA H2'' H 1 2.781 0.002 . 1 . . . . A 6 DA H2'' . 36612 1 44 . 1 . 1 6 6 DA H3' H 1 4.965 0.002 . 1 . . . . A 6 DA H3' . 36612 1 45 . 1 . 1 6 6 DA H4' H 1 4.261 0.002 . 1 . . . . A 6 DA H4' . 36612 1 46 . 1 . 1 6 6 DA H8 H 1 8.466 0.002 . 1 . . . . A 6 DA H8 . 36612 1 47 . 1 . 1 7 7 DA H1' H 1 6.601 0.002 . 1 . . . . A 7 DA H1' . 36612 1 48 . 1 . 1 7 7 DA H2 H 1 8.246 0.002 . 1 . . . . A 7 DA H2 . 36612 1 49 . 1 . 1 7 7 DA H2' H 1 2.941 0.002 . 1 . . . . A 7 DA H2' . 36612 1 50 . 1 . 1 7 7 DA H2'' H 1 2.941 0.002 . 1 . . . . A 7 DA H2'' . 36612 1 51 . 1 . 1 7 7 DA H3' H 1 5.189 0.002 . 1 . . . . A 7 DA H3' . 36612 1 52 . 1 . 1 7 7 DA H4' H 1 4.622 0.002 . 1 . . . . A 7 DA H4' . 36612 1 53 . 1 . 1 7 7 DA H5' H 1 4.329 0.002 . 1 . . . . A 7 DA H5' . 36612 1 54 . 1 . 1 7 7 DA H5'' H 1 4.329 0.002 . 1 . . . . A 7 DA H5'' . 36612 1 55 . 1 . 1 7 7 DA H8 H 1 8.504 0.002 . 1 . . . . A 7 DA H8 . 36612 1 56 . 1 . 1 8 8 DG H1 H 1 11.324 0.002 . 1 . . . . A 8 DG H1 . 36612 1 57 . 1 . 1 8 8 DG H1' H 1 6.010 0.002 . 1 . . . . A 8 DG H1' . 36612 1 58 . 1 . 1 8 8 DG H2' H 1 2.397 0.002 . 1 . . . . A 8 DG H2' . 36612 1 59 . 1 . 1 8 8 DG H2'' H 1 2.868 0.002 . 1 . . . . A 8 DG H2'' . 36612 1 60 . 1 . 1 8 8 DG H3' H 1 4.912 0.002 . 1 . . . . A 8 DG H3' . 36612 1 61 . 1 . 1 8 8 DG H4' H 1 4.447 0.002 . 1 . . . . A 8 DG H4' . 36612 1 62 . 1 . 1 8 8 DG H5' H 1 3.801 0.002 . 1 . . . . A 8 DG H5' . 36612 1 63 . 1 . 1 8 8 DG H5'' H 1 4.136 0.002 . 1 . . . . A 8 DG H5'' . 36612 1 64 . 1 . 1 8 8 DG H8 H 1 7.853 0.002 . 1 . . . . A 8 DG H8 . 36612 1 65 . 1 . 1 9 9 DG H1 H 1 11.299 0.002 . 1 . . . . A 9 DG H1 . 36612 1 66 . 1 . 1 9 9 DG H1' H 1 5.970 0.002 . 1 . . . . A 9 DG H1' . 36612 1 67 . 1 . 1 9 9 DG H2' H 1 2.741 0.002 . 1 . . . . A 9 DG H2' . 36612 1 68 . 1 . 1 9 9 DG H2'' H 1 2.741 0.002 . 1 . . . . A 9 DG H2'' . 36612 1 69 . 1 . 1 9 9 DG H3' H 1 5.056 0.002 . 1 . . . . A 9 DG H3' . 36612 1 70 . 1 . 1 9 9 DG H4' H 1 4.519 0.002 . 1 . . . . A 9 DG H4' . 36612 1 71 . 1 . 1 9 9 DG H5' H 1 4.238 0.002 . 1 . . . . A 9 DG H5' . 36612 1 72 . 1 . 1 9 9 DG H5'' H 1 4.238 0.002 . 1 . . . . A 9 DG H5'' . 36612 1 73 . 1 . 1 9 9 DG H8 H 1 7.896 0.002 . 1 . . . . A 9 DG H8 . 36612 1 74 . 1 . 1 10 10 DG H1 H 1 10.801 0.002 . 1 . . . . A 10 DG H1 . 36612 1 75 . 1 . 1 10 10 DG H1' H 1 5.884 0.002 . 1 . . . . A 10 DG H1' . 36612 1 76 . 1 . 1 10 10 DG H2' H 1 2.408 0.002 . 1 . . . . A 10 DG H2' . 36612 1 77 . 1 . 1 10 10 DG H2'' H 1 2.629 0.002 . 1 . . . . A 10 DG H2'' . 36612 1 78 . 1 . 1 10 10 DG H3' H 1 4.957 0.002 . 1 . . . . A 10 DG H3' . 36612 1 79 . 1 . 1 10 10 DG H4' H 1 4.454 0.002 . 1 . . . . A 10 DG H4' . 36612 1 80 . 1 . 1 10 10 DG H8 H 1 7.590 0.002 . 1 . . . . A 10 DG H8 . 36612 1 81 . 1 . 1 11 11 DA H1' H 1 5.916 0.002 . 1 . . . . A 11 DA H1' . 36612 1 82 . 1 . 1 11 11 DA H2 H 1 7.308 0.002 . 1 . . . . A 11 DA H2 . 36612 1 83 . 1 . 1 11 11 DA H2' H 1 2.296 0.002 . 1 . . . . A 11 DA H2' . 36612 1 84 . 1 . 1 11 11 DA H2'' H 1 2.442 0.002 . 1 . . . . A 11 DA H2'' . 36612 1 85 . 1 . 1 11 11 DA H3' H 1 4.852 0.002 . 1 . . . . A 11 DA H3' . 36612 1 86 . 1 . 1 11 11 DA H4' H 1 4.280 0.002 . 1 . . . . A 11 DA H4' . 36612 1 87 . 1 . 1 11 11 DA H5' H 1 4.118 0.002 . 1 . . . . A 11 DA H5' . 36612 1 88 . 1 . 1 11 11 DA H5'' H 1 4.118 0.002 . 1 . . . . A 11 DA H5'' . 36612 1 89 . 1 . 1 11 11 DA H8 H 1 7.847 0.002 . 1 . . . . A 11 DA H8 . 36612 1 90 . 1 . 1 12 12 DA H1' H 1 5.996 0.002 . 1 . . . . A 12 DA H1' . 36612 1 91 . 1 . 1 12 12 DA H2 H 1 7.488 0.002 . 1 . . . . A 12 DA H2 . 36612 1 92 . 1 . 1 12 12 DA H2' H 1 2.447 0.002 . 1 . . . . A 12 DA H2' . 36612 1 93 . 1 . 1 12 12 DA H2'' H 1 2.299 0.002 . 1 . . . . A 12 DA H2'' . 36612 1 94 . 1 . 1 12 12 DA H3' H 1 4.556 0.002 . 1 . . . . A 12 DA H3' . 36612 1 95 . 1 . 1 12 12 DA H4' H 1 4.081 0.002 . 1 . . . . A 12 DA H4' . 36612 1 96 . 1 . 1 12 12 DA H5' H 1 4.006 0.002 . 1 . . . . A 12 DA H5' . 36612 1 97 . 1 . 1 12 12 DA H5'' H 1 4.006 0.002 . 1 . . . . A 12 DA H5'' . 36612 1 98 . 1 . 1 12 12 DA H8 H 1 8.021 0.002 . 1 . . . . A 12 DA H8 . 36612 1 99 . 2 . 1 1 1 DA H1' H 1 5.971 0.002 . 1 . . . . B 13 DA H1' . 36612 1 100 . 2 . 1 1 1 DA H2 H 1 7.674 0.002 . 1 . . . . B 13 DA H2 . 36612 1 101 . 2 . 1 1 1 DA H2' H 1 2.254 0.002 . 1 . . . . B 13 DA H2' . 36612 1 102 . 2 . 1 1 1 DA H2'' H 1 2.404 0.002 . 1 . . . . B 13 DA H2'' . 36612 1 103 . 2 . 1 1 1 DA H3' H 1 4.686 0.002 . 1 . . . . B 13 DA H3' . 36612 1 104 . 2 . 1 1 1 DA H4' H 1 3.985 0.002 . 1 . . . . B 13 DA H4' . 36612 1 105 . 2 . 1 1 1 DA H5' H 1 3.445 0.002 . 1 . . . . B 13 DA H5' . 36612 1 106 . 2 . 1 1 1 DA H5'' H 1 3.445 0.002 . 1 . . . . B 13 DA H5'' . 36612 1 107 . 2 . 1 1 1 DA H8 H 1 7.702 0.002 . 1 . . . . B 13 DA H8 . 36612 1 108 . 2 . 1 2 2 DA H1' H 1 5.778 0.002 . 1 . . . . B 14 DA H1' . 36612 1 109 . 2 . 1 2 2 DA H2 H 1 7.721 0.002 . 1 . . . . B 14 DA H2 . 36612 1 110 . 2 . 1 2 2 DA H2' H 1 2.692 0.002 . 1 . . . . B 14 DA H2' . 36612 1 111 . 2 . 1 2 2 DA H2'' H 1 2.692 0.002 . 1 . . . . B 14 DA H2'' . 36612 1 112 . 2 . 1 2 2 DA H3' H 1 4.925 0.002 . 1 . . . . B 14 DA H3' . 36612 1 113 . 2 . 1 2 2 DA H8 H 1 7.960 0.002 . 1 . . . . B 14 DA H8 . 36612 1 114 . 2 . 1 3 3 DG H1 H 1 11.679 0.002 . 1 . . . . B 15 DG H1 . 36612 1 115 . 2 . 1 3 3 DG H1' H 1 6.104 0.002 . 1 . . . . B 15 DG H1' . 36612 1 116 . 2 . 1 3 3 DG H2' H 1 2.767 0.002 . 1 . . . . B 15 DG H2' . 36612 1 117 . 2 . 1 3 3 DG H2'' H 1 2.986 0.002 . 1 . . . . B 15 DG H2'' . 36612 1 118 . 2 . 1 3 3 DG H3' H 1 5.038 0.002 . 1 . . . . B 15 DG H3' . 36612 1 119 . 2 . 1 3 3 DG H4' H 1 4.511 0.002 . 1 . . . . B 15 DG H4' . 36612 1 120 . 2 . 1 3 3 DG H5' H 1 4.172 0.002 . 1 . . . . B 15 DG H5' . 36612 1 121 . 2 . 1 3 3 DG H5'' H 1 4.172 0.002 . 1 . . . . B 15 DG H5'' . 36612 1 122 . 2 . 1 3 3 DG H8 H 1 8.002 0.002 . 1 . . . . B 15 DG H8 . 36612 1 123 . 2 . 1 4 4 DG H1 H 1 11.342 0.002 . 1 . . . . B 16 DG H1 . 36612 1 124 . 2 . 1 4 4 DG H1' H 1 6.045 0.002 . 1 . . . . B 16 DG H1' . 36612 1 125 . 2 . 1 4 4 DG H2' H 1 2.547 0.002 . 1 . . . . B 16 DG H2' . 36612 1 126 . 2 . 1 4 4 DG H2'' H 1 2.676 0.002 . 1 . . . . B 16 DG H2'' . 36612 1 127 . 2 . 1 4 4 DG H3' H 1 4.904 0.002 . 1 . . . . B 16 DG H3' . 36612 1 128 . 2 . 1 4 4 DG H4' H 1 4.460 0.002 . 1 . . . . B 16 DG H4' . 36612 1 129 . 2 . 1 4 4 DG H5' H 1 4.254 0.002 . 1 . . . . B 16 DG H5' . 36612 1 130 . 2 . 1 4 4 DG H5'' H 1 4.309 0.002 . 1 . . . . B 16 DG H5'' . 36612 1 131 . 2 . 1 4 4 DG H8 H 1 7.570 0.002 . 1 . . . . B 16 DG H8 . 36612 1 132 . 2 . 1 5 5 DG H1 H 1 11.176 0.002 . 1 . . . . B 17 DG H1 . 36612 1 133 . 2 . 1 5 5 DG H1' H 1 6.326 0.002 . 1 . . . . B 17 DG H1' . 36612 1 134 . 2 . 1 5 5 DG H2' H 1 2.608 0.002 . 1 . . . . B 17 DG H2' . 36612 1 135 . 2 . 1 5 5 DG H2'' H 1 2.542 0.002 . 1 . . . . B 17 DG H2'' . 36612 1 136 . 2 . 1 5 5 DG H3' H 1 4.979 0.002 . 1 . . . . B 17 DG H3' . 36612 1 137 . 2 . 1 5 5 DG H8 H 1 7.682 0.002 . 1 . . . . B 17 DG H8 . 36612 1 138 . 2 . 1 6 6 DA H1' H 1 6.386 0.002 . 1 . . . . B 18 DA H1' . 36612 1 139 . 2 . 1 6 6 DA H2 H 1 8.307 0.002 . 1 . . . . B 18 DA H2 . 36612 1 140 . 2 . 1 6 6 DA H2' H 1 2.781 0.002 . 1 . . . . B 18 DA H2' . 36612 1 141 . 2 . 1 6 6 DA H2'' H 1 2.781 0.002 . 1 . . . . B 18 DA H2'' . 36612 1 142 . 2 . 1 6 6 DA H3' H 1 4.965 0.002 . 1 . . . . B 18 DA H3' . 36612 1 143 . 2 . 1 6 6 DA H4' H 1 4.261 0.002 . 1 . . . . B 18 DA H4' . 36612 1 144 . 2 . 1 6 6 DA H8 H 1 8.466 0.002 . 1 . . . . B 18 DA H8 . 36612 1 145 . 2 . 1 7 7 DA H1' H 1 6.601 0.002 . 1 . . . . B 19 DA H1' . 36612 1 146 . 2 . 1 7 7 DA H2 H 1 8.246 0.002 . 1 . . . . B 19 DA H2 . 36612 1 147 . 2 . 1 7 7 DA H2' H 1 2.941 0.002 . 1 . . . . B 19 DA H2' . 36612 1 148 . 2 . 1 7 7 DA H2'' H 1 2.941 0.002 . 1 . . . . B 19 DA H2'' . 36612 1 149 . 2 . 1 7 7 DA H3' H 1 5.189 0.002 . 1 . . . . B 19 DA H3' . 36612 1 150 . 2 . 1 7 7 DA H4' H 1 4.622 0.002 . 1 . . . . B 19 DA H4' . 36612 1 151 . 2 . 1 7 7 DA H5' H 1 4.329 0.002 . 1 . . . . B 19 DA H5' . 36612 1 152 . 2 . 1 7 7 DA H5'' H 1 4.329 0.002 . 1 . . . . B 19 DA H5'' . 36612 1 153 . 2 . 1 7 7 DA H8 H 1 8.504 0.002 . 1 . . . . B 19 DA H8 . 36612 1 154 . 2 . 1 8 8 DG H1 H 1 11.324 0.002 . 1 . . . . B 20 DG H1 . 36612 1 155 . 2 . 1 8 8 DG H1' H 1 6.010 0.002 . 1 . . . . B 20 DG H1' . 36612 1 156 . 2 . 1 8 8 DG H2' H 1 2.397 0.002 . 1 . . . . B 20 DG H2' . 36612 1 157 . 2 . 1 8 8 DG H2'' H 1 2.868 0.002 . 1 . . . . B 20 DG H2'' . 36612 1 158 . 2 . 1 8 8 DG H3' H 1 4.912 0.002 . 1 . . . . B 20 DG H3' . 36612 1 159 . 2 . 1 8 8 DG H4' H 1 4.447 0.002 . 1 . . . . B 20 DG H4' . 36612 1 160 . 2 . 1 8 8 DG H5' H 1 3.801 0.002 . 1 . . . . B 20 DG H5' . 36612 1 161 . 2 . 1 8 8 DG H5'' H 1 4.136 0.002 . 1 . . . . B 20 DG H5'' . 36612 1 162 . 2 . 1 8 8 DG H8 H 1 7.853 0.002 . 1 . . . . B 20 DG H8 . 36612 1 163 . 2 . 1 9 9 DG H1 H 1 11.299 0.002 . 1 . . . . B 21 DG H1 . 36612 1 164 . 2 . 1 9 9 DG H1' H 1 5.970 0.002 . 1 . . . . B 21 DG H1' . 36612 1 165 . 2 . 1 9 9 DG H2' H 1 2.741 0.002 . 1 . . . . B 21 DG H2' . 36612 1 166 . 2 . 1 9 9 DG H2'' H 1 2.741 0.002 . 1 . . . . B 21 DG H2'' . 36612 1 167 . 2 . 1 9 9 DG H3' H 1 5.056 0.002 . 1 . . . . B 21 DG H3' . 36612 1 168 . 2 . 1 9 9 DG H4' H 1 4.519 0.002 . 1 . . . . B 21 DG H4' . 36612 1 169 . 2 . 1 9 9 DG H5' H 1 4.238 0.002 . 1 . . . . B 21 DG H5' . 36612 1 170 . 2 . 1 9 9 DG H5'' H 1 4.238 0.002 . 1 . . . . B 21 DG H5'' . 36612 1 171 . 2 . 1 9 9 DG H8 H 1 7.896 0.002 . 1 . . . . B 21 DG H8 . 36612 1 172 . 2 . 1 10 10 DG H1 H 1 10.801 0.002 . 1 . . . . B 22 DG H1 . 36612 1 173 . 2 . 1 10 10 DG H1' H 1 5.884 0.002 . 1 . . . . B 22 DG H1' . 36612 1 174 . 2 . 1 10 10 DG H2' H 1 2.408 0.002 . 1 . . . . B 22 DG H2' . 36612 1 175 . 2 . 1 10 10 DG H2'' H 1 2.629 0.002 . 1 . . . . B 22 DG H2'' . 36612 1 176 . 2 . 1 10 10 DG H3' H 1 4.957 0.002 . 1 . . . . B 22 DG H3' . 36612 1 177 . 2 . 1 10 10 DG H4' H 1 4.454 0.002 . 1 . . . . B 22 DG H4' . 36612 1 178 . 2 . 1 10 10 DG H8 H 1 7.590 0.002 . 1 . . . . B 22 DG H8 . 36612 1 179 . 2 . 1 11 11 DA H1' H 1 5.916 0.002 . 1 . . . . B 23 DA H1' . 36612 1 180 . 2 . 1 11 11 DA H2 H 1 7.308 0.002 . 1 . . . . B 23 DA H2 . 36612 1 181 . 2 . 1 11 11 DA H2' H 1 2.296 0.002 . 1 . . . . B 23 DA H2' . 36612 1 182 . 2 . 1 11 11 DA H2'' H 1 2.442 0.002 . 1 . . . . B 23 DA H2'' . 36612 1 183 . 2 . 1 11 11 DA H3' H 1 4.852 0.002 . 1 . . . . B 23 DA H3' . 36612 1 184 . 2 . 1 11 11 DA H4' H 1 4.280 0.002 . 1 . . . . B 23 DA H4' . 36612 1 185 . 2 . 1 11 11 DA H5' H 1 4.118 0.002 . 1 . . . . B 23 DA H5' . 36612 1 186 . 2 . 1 11 11 DA H5'' H 1 4.118 0.002 . 1 . . . . B 23 DA H5'' . 36612 1 187 . 2 . 1 11 11 DA H8 H 1 7.847 0.002 . 1 . . . . B 23 DA H8 . 36612 1 188 . 2 . 1 12 12 DA H1' H 1 5.996 0.002 . 1 . . . . B 24 DA H1' . 36612 1 189 . 2 . 1 12 12 DA H2 H 1 7.488 0.002 . 1 . . . . B 24 DA H2 . 36612 1 190 . 2 . 1 12 12 DA H2' H 1 2.447 0.002 . 1 . . . . B 24 DA H2' . 36612 1 191 . 2 . 1 12 12 DA H2'' H 1 2.299 0.002 . 1 . . . . B 24 DA H2'' . 36612 1 192 . 2 . 1 12 12 DA H3' H 1 4.556 0.002 . 1 . . . . B 24 DA H3' . 36612 1 193 . 2 . 1 12 12 DA H4' H 1 4.081 0.002 . 1 . . . . B 24 DA H4' . 36612 1 194 . 2 . 1 12 12 DA H5' H 1 4.006 0.002 . 1 . . . . B 24 DA H5' . 36612 1 195 . 2 . 1 12 12 DA H5'' H 1 4.006 0.002 . 1 . . . . B 24 DA H5'' . 36612 1 196 . 2 . 1 12 12 DA H8 H 1 8.021 0.002 . 1 . . . . B 24 DA H8 . 36612 1 stop_ save_