################################### # 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 34798 _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 TOCSY' . . . 34798 1 2 '2D 1H-1H TOCSY' . . . 34798 1 3 '2D 1H-1H TOCSY' . . . 34798 1 4 '2D 1H-1H NOESY' . . . 34798 1 5 '2D 1H-1H NOESY' . . . 34798 1 6 '2D 1H-1H NOESY' . . . 34798 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 DC H1' H 1 6.259 0.002 . . . . . . . DC 1 H1' . 34798 1 2 . 1 . 1 1 1 DC H2' H 1 2.510 0.003 . . . . . . . DC 1 H2' . 34798 1 3 . 1 . 1 1 1 DC H2'' H 1 2.801 0.002 . . . . . . . DC 1 H2'' . 34798 1 4 . 1 . 1 1 1 DC H3' H 1 4.951 0.002 . . . . . . . DC 1 H3' . 34798 1 5 . 1 . 1 1 1 DC H5 H 1 6.039 0.000 . . . . . . . DC 1 H5 . 34798 1 6 . 1 . 1 1 1 DC H6 H 1 7.850 0.003 . . . . . . . DC 1 H6 . 34798 1 7 . 1 . 1 1 1 DC H41 H 1 7.302 0.000 . . . . . . . DC 1 H41 . 34798 1 8 . 1 . 1 1 1 DC H42 H 1 8.381 0.000 . . . . . . . DC 1 H42 . 34798 1 9 . 1 . 1 2 2 YCO H1' H 1 6.044 0.000 . . . . . . . YCO 2 H1' . 34798 1 10 . 1 . 1 2 2 YCO H2' H 1 1.204 0.001 . . . . . . . YCO 2 H2' . 34798 1 11 . 1 . 1 2 2 YCO H2'' H 1 1.835 0.003 . . . . . . . YCO 2 H2'' . 34798 1 12 . 1 . 1 2 2 YCO H3' H 1 4.794 0.002 . . . . . . . YCO 2 H3' . 34798 1 13 . 1 . 1 2 2 YCO H4 H 1 7.177 0.001 . . . . . . . YCO 2 H4 . 34798 1 14 . 1 . 1 2 2 YCO H6 H 1 6.072 0.004 . . . . . . . YCO 2 H6 . 34798 1 15 . 1 . 1 2 2 YCO H7 H 1 6.393 0.001 . . . . . . . YCO 2 H7 . 34798 1 16 . 1 . 1 2 2 YCO H8 H 1 6.662 0.003 . . . . . . . YCO 2 H8 . 34798 1 17 . 1 . 1 2 2 YCO H9 H 1 5.919 0.002 . . . . . . . YCO 2 H9 . 34798 1 18 . 1 . 1 2 2 YCO H10 H 1 9.823 0.001 . . . . . . . YCO 2 H10 . 34798 1 19 . 1 . 1 3 3 DG H1 H 1 13.934 0.007 . . . . . . . DG 3 H1 . 34798 1 20 . 1 . 1 3 3 DG H1' H 1 6.066 0.002 . . . . . . . DG 3 H1' . 34798 1 21 . 1 . 1 3 3 DG H2' H 1 2.772 0.003 . . . . . . . DG 3 H2' . 34798 1 22 . 1 . 1 3 3 DG H2'' H 1 3.056 0.003 . . . . . . . DG 3 H2'' . 34798 1 23 . 1 . 1 3 3 DG H3' H 1 5.019 0.004 . . . . . . . DG 3 H3' . 34798 1 24 . 1 . 1 3 3 DG H8 H 1 8.108 0.001 . . . . . . . DG 3 H8 . 34798 1 25 . 1 . 1 3 3 DG H21 H 1 7.040 0.006 . . . . . . . DG 3 H21 . 34798 1 26 . 1 . 1 3 3 DG H22 H 1 8.793 0.005 . . . . . . . DG 3 H22 . 34798 1 27 . 1 . 1 4 4 DT H1' H 1 6.206 0.002 . . . . . . . DT 4 H1' . 34798 1 28 . 1 . 1 4 4 DT H2' H 1 2.071 0.001 . . . . . . . DT 4 H2' . 34798 1 29 . 1 . 1 4 4 DT H2'' H 1 2.327 0.002 . . . . . . . DT 4 H2'' . 34798 1 30 . 1 . 1 4 4 DT H3' H 1 3.829 0.000 . . . . . . . DT 4 H3' . 34798 1 31 . 1 . 1 4 4 DT H6 H 1 7.648 0.002 . . . . . . . DT 4 H6 . 34798 1 32 . 1 . 1 4 4 DT H71 H 1 1.779 0.003 . . . . . . . DT 4 Me . 34798 1 33 . 1 . 1 4 4 DT H72 H 1 1.779 0.003 . . . . . . . DT 4 Me . 34798 1 34 . 1 . 1 4 4 DT H73 H 1 1.779 0.003 . . . . . . . DT 4 Me . 34798 1 35 . 1 . 1 5 5 DT H1' H 1 6.497 0.002 . . . . . . . DT 5 H1' . 34798 1 36 . 1 . 1 5 5 DT H2' H 1 2.324 0.000 . . . . . . . DT 5 H2' . 34798 1 37 . 1 . 1 5 5 DT H2'' H 1 2.558 0.003 . . . . . . . DT 5 H2'' . 34798 1 38 . 1 . 1 5 5 DT H3' H 1 4.631 0.000 . . . . . . . DT 5 H3' . 34798 1 39 . 1 . 1 5 5 DT H6 H 1 7.860 0.000 . . . . . . . DT 5 H6 . 34798 1 40 . 1 . 1 5 5 DT H71 H 1 1.936 0.000 . . . . . . . DT 5 Me . 34798 1 41 . 1 . 1 5 5 DT H72 H 1 1.936 0.000 . . . . . . . DT 5 Me . 34798 1 42 . 1 . 1 5 5 DT H73 H 1 1.936 0.000 . . . . . . . DT 5 Me . 34798 1 43 . 1 . 1 6 6 DC H1' H 1 6.373 0.003 . . . . . . . DC 6 H1' . 34798 1 44 . 1 . 1 6 6 DC H2' H 1 2.462 0.002 . . . . . . . DC 6 H2' . 34798 1 45 . 1 . 1 6 6 DC H2'' H 1 2.621 0.008 . . . . . . . DC 6 H2'' . 34798 1 46 . 1 . 1 6 6 DC H3' H 1 4.927 0.002 . . . . . . . DC 6 H3' . 34798 1 47 . 1 . 1 6 6 DC H5 H 1 6.231 0.001 . . . . . . . DC 6 H5 . 34798 1 48 . 1 . 1 6 6 DC H6 H 1 8.024 0.002 . . . . . . . DC 6 H6 . 34798 1 49 . 1 . 1 6 6 DC H41 H 1 7.662 0.003 . . . . . . . DC 6 H41 . 34798 1 50 . 1 . 1 6 6 DC H42 H 1 8.754 0.001 . . . . . . . DC 6 H42 . 34798 1 51 . 1 . 1 7 7 DNR H1' H 1 6.176 0.007 . . . . . . . DNR 7 H1' . 34798 1 52 . 1 . 1 7 7 DNR H2' H 1 1.236 0.001 . . . . . . . DNR 7 H2' . 34798 1 53 . 1 . 1 7 7 DNR H2'' H 1 2.042 0.002 . . . . . . . DNR 7 H2'' . 34798 1 54 . 1 . 1 7 7 DNR H3+ H 1 15.574 0.005 . . . . . . . DNR 7 H3+ . 34798 1 55 . 1 . 1 7 7 DNR H3' H 1 4.792 0.002 . . . . . . . DNR 7 H3' . 34798 1 56 . 1 . 1 7 7 DNR H5 H 1 5.737 0.006 . . . . . . . DNR 7 H5 . 34798 1 57 . 1 . 1 7 7 DNR H6 H 1 7.644 0.009 . . . . . . . DNR 7 H6 . 34798 1 58 . 1 . 1 7 7 DNR H41 H 1 8.058 0.000 . . . . . . . DNR 7 H41 . 34798 1 59 . 1 . 1 7 7 DNR H42 H 1 8.671 0.002 . . . . . . . DNR 7 H42 . 34798 1 60 . 1 . 1 8 8 DG H1 H 1 13.441 0.003 . . . . . . . DG 8 H1 . 34798 1 61 . 1 . 1 8 8 DG H1' H 1 5.997 0.005 . . . . . . . DG 8 H1' . 34798 1 62 . 1 . 1 8 8 DG H2' H 1 3.030 0.002 . . . . . . . DG 8 H2' . 34798 1 63 . 1 . 1 8 8 DG H2'' H 1 2.685 0.002 . . . . . . . DG 8 H2'' . 34798 1 64 . 1 . 1 8 8 DG H3' H 1 5.047 0.003 . . . . . . . DG 8 H3' . 34798 1 65 . 1 . 1 8 8 DG H8 H 1 8.153 0.002 . . . . . . . DG 8 H8 . 34798 1 66 . 1 . 1 8 8 DG H21 H 1 7.188 0.001 . . . . . . . DG 8 H21 . 34798 1 67 . 1 . 1 8 8 DG H22 H 1 8.220 0.000 . . . . . . . DG 8 H22 . 34798 1 68 . 1 . 1 9 9 DT H1' H 1 6.008 0.004 . . . . . . . DT 9 H1' . 34798 1 69 . 1 . 1 9 9 DT H2' H 1 2.006 0.003 . . . . . . . DT 9 H2' . 34798 1 70 . 1 . 1 9 9 DT H2'' H 1 2.303 0.001 . . . . . . . DT 9 H2'' . 34798 1 71 . 1 . 1 9 9 DT H3' H 1 4.781 0.001 . . . . . . . DT 9 H3' . 34798 1 72 . 1 . 1 9 9 DT H6 H 1 7.637 0.002 . . . . . . . DT 9 H6 . 34798 1 73 . 1 . 1 9 9 DT H71 H 1 1.740 0.002 . . . . . . . DT 9 Me . 34798 1 74 . 1 . 1 9 9 DT H72 H 1 1.740 0.002 . . . . . . . DT 9 Me . 34798 1 75 . 1 . 1 9 9 DT H73 H 1 1.740 0.002 . . . . . . . DT 9 Me . 34798 1 76 . 1 . 1 10 10 DT H1' H 1 6.136 0.002 . . . . . . . DT 10 H1' . 34798 1 77 . 1 . 1 10 10 DT H2' H 1 2.317 0.003 . . . . . . . DT 10 H2' . 34798 1 78 . 1 . 1 10 10 DT H2'' H 1 2.583 0.003 . . . . . . . DT 10 H2'' . 34798 1 79 . 1 . 1 10 10 DT H3' H 1 4.910 0.000 . . . . . . . DT 10 H3' . 34798 1 80 . 1 . 1 10 10 DT H6 H 1 7.608 0.001 . . . . . . . DT 10 H6 . 34798 1 81 . 1 . 1 10 10 DT H71 H 1 1.803 0.000 . . . . . . . DT 10 Me . 34798 1 82 . 1 . 1 10 10 DT H72 H 1 1.803 0.000 . . . . . . . DT 10 Me . 34798 1 83 . 1 . 1 10 10 DT H73 H 1 1.803 0.000 . . . . . . . DT 10 Me . 34798 1 84 . 1 . 1 11 11 DT H1' H 1 6.414 0.002 . . . . . . . DT 11 H1' . 34798 1 85 . 1 . 1 11 11 DT H2' H 1 2.427 0.001 . . . . . . . DT 11 H2' . 34798 1 86 . 1 . 1 11 11 DT H2'' H 1 2.568 0.000 . . . . . . . DT 11 H2'' . 34798 1 87 . 1 . 1 11 11 DT H3' H 1 4.932 0.000 . . . . . . . DT 11 H3' . 34798 1 88 . 1 . 1 11 11 DT H6 H 1 7.761 0.002 . . . . . . . DT 11 H6 . 34798 1 89 . 1 . 1 11 11 DT H71 H 1 1.938 0.000 . . . . . . . DT 11 Me . 34798 1 90 . 1 . 1 11 11 DT H72 H 1 1.938 0.000 . . . . . . . DT 11 Me . 34798 1 91 . 1 . 1 11 11 DT H73 H 1 1.938 0.000 . . . . . . . DT 11 Me . 34798 1 92 . 1 . 1 12 12 DT H1' H 1 6.352 0.001 . . . . . . . DT 12 H1' . 34798 1 93 . 1 . 1 12 12 DT H2' H 1 2.381 0.003 . . . . . . . DT 12 H2' . 34798 1 94 . 1 . 1 12 12 DT H2'' H 1 2.622 0.000 . . . . . . . DT 12 H2'' . 34798 1 95 . 1 . 1 12 12 DT H3' H 1 4.953 0.000 . . . . . . . DT 12 H3' . 34798 1 96 . 1 . 1 12 12 DT H6 H 1 7.784 0.006 . . . . . . . DT 12 H6 . 34798 1 97 . 1 . 1 12 12 DT H71 H 1 1.936 0.000 . . . . . . . DT 12 Me . 34798 1 98 . 1 . 1 12 12 DT H72 H 1 1.936 0.000 . . . . . . . DT 12 Me . 34798 1 99 . 1 . 1 12 12 DT H73 H 1 1.936 0.000 . . . . . . . DT 12 Me . 34798 1 100 . 1 . 1 13 13 DT H1' H 1 6.449 0.002 . . . . . . . DT 13 H1' . 34798 1 101 . 1 . 1 13 13 DT H2' H 1 2.415 0.004 . . . . . . . DT 13 H2' . 34798 1 102 . 1 . 1 13 13 DT H2'' H 1 2.536 0.003 . . . . . . . DT 13 H2'' . 34798 1 103 . 1 . 1 13 13 DT H3' H 1 5.057 0.001 . . . . . . . DT 13 H3' . 34798 1 104 . 1 . 1 13 13 DT H6 H 1 7.814 0.002 . . . . . . . DT 13 H6 . 34798 1 105 . 1 . 1 13 13 DT H71 H 1 2.004 0.003 . . . . . . . DT 13 Me . 34798 1 106 . 1 . 1 13 13 DT H72 H 1 2.004 0.003 . . . . . . . DT 13 Me . 34798 1 107 . 1 . 1 13 13 DT H73 H 1 2.004 0.003 . . . . . . . DT 13 Me . 34798 1 108 . 1 . 1 14 14 DC H1' H 1 6.327 0.002 . . . . . . . DC 14 H1' . 34798 1 109 . 1 . 1 14 14 DC H2' H 1 2.263 0.004 . . . . . . . DC 14 H2' . 34798 1 110 . 1 . 1 14 14 DC H2'' H 1 2.671 0.004 . . . . . . . DC 14 H2'' . 34798 1 111 . 1 . 1 14 14 DC H3' H 1 4.934 0.002 . . . . . . . DC 14 H3' . 34798 1 112 . 1 . 1 14 14 DC H5 H 1 5.539 0.003 . . . . . . . DC 14 H5 . 34798 1 113 . 1 . 1 14 14 DC H6 H 1 7.748 0.002 . . . . . . . DC 14 H6 . 34798 1 114 . 1 . 1 14 14 DC H41 H 1 6.371 0.002 . . . . . . . DC 14 H41 . 34798 1 115 . 1 . 1 14 14 DC H42 H 1 8.623 0.002 . . . . . . . DC 14 H42 . 34798 1 116 . 1 . 1 15 15 DC H1' H 1 6.025 0.006 . . . . . . . DC 15 H1' . 34798 1 117 . 1 . 1 15 15 DC H2' H 1 0.876 0.002 . . . . . . . DC 15 H2' . 34798 1 118 . 1 . 1 15 15 DC H2'' H 1 2.410 0.003 . . . . . . . DC 15 H2'' . 34798 1 119 . 1 . 1 15 15 DC H3' H 1 4.437 0.001 . . . . . . . DC 15 H3' . 34798 1 120 . 1 . 1 15 15 DC H5 H 1 5.311 0.000 . . . . . . . DC 15 H5 . 34798 1 121 . 1 . 1 15 15 DC H6 H 1 7.526 0.004 . . . . . . . DC 15 H6 . 34798 1 122 . 1 . 1 15 15 DC H42 H 1 10.830 0.000 . . . . . . . DC 15 H42 . 34798 1 123 . 1 . 1 16 16 DG H1 H 1 12.819 0.003 . . . . . . . DG 16 H1 . 34798 1 124 . 1 . 1 16 16 DG H1' H 1 6.110 0.000 . . . . . . . DG 16 H1' . 34798 1 125 . 1 . 1 16 16 DG H2' H 1 2.968 0.000 . . . . . . . DG 16 H2' . 34798 1 126 . 1 . 1 16 16 DG H2'' H 1 2.648 0.000 . . . . . . . DG 16 H2'' . 34798 1 127 . 1 . 1 16 16 DG H3' H 1 5.039 0.000 . . . . . . . DG 16 H3' . 34798 1 128 . 1 . 1 16 16 DG H8 H 1 8.210 0.002 . . . . . . . DG 16 H8 . 34798 1 129 . 1 . 1 17 17 DT H1' H 1 6.114 0.007 . . . . . . . DT 17 H1' . 34798 1 130 . 1 . 1 17 17 DT H2' H 1 1.996 0.001 . . . . . . . DT 17 H2' . 34798 1 131 . 1 . 1 17 17 DT H2'' H 1 2.391 0.001 . . . . . . . DT 17 H2'' . 34798 1 132 . 1 . 1 17 17 DT H3' H 1 4.772 0.003 . . . . . . . DT 17 H3' . 34798 1 133 . 1 . 1 17 17 DT H6 H 1 7.533 0.001 . . . . . . . DT 17 H6 . 34798 1 134 . 1 . 1 17 17 DT H71 H 1 1.744 0.007 . . . . . . . DT 17 Me . 34798 1 135 . 1 . 1 17 17 DT H72 H 1 1.744 0.007 . . . . . . . DT 17 Me . 34798 1 136 . 1 . 1 17 17 DT H73 H 1 1.744 0.007 . . . . . . . DT 17 Me . 34798 1 137 . 1 . 1 18 18 DT H1' H 1 6.429 0.002 . . . . . . . DT 18 H1' . 34798 1 138 . 1 . 1 18 18 DT H2' H 1 2.113 0.001 . . . . . . . DT 18 H2' . 34798 1 139 . 1 . 1 18 18 DT H2'' H 1 2.555 0.001 . . . . . . . DT 18 H2'' . 34798 1 140 . 1 . 1 18 18 DT H3' H 1 4.702 0.001 . . . . . . . DT 18 H3' . 34798 1 141 . 1 . 1 18 18 DT H6 H 1 7.815 0.001 . . . . . . . DT 18 H6 . 34798 1 142 . 1 . 1 18 18 DT H71 H 1 1.928 0.000 . . . . . . . DT 18 Me . 34798 1 143 . 1 . 1 18 18 DT H72 H 1 1.928 0.000 . . . . . . . DT 18 Me . 34798 1 144 . 1 . 1 18 18 DT H73 H 1 1.928 0.000 . . . . . . . DT 18 Me . 34798 1 145 . 1 . 1 19 19 DC H1' H 1 6.436 0.002 . . . . . . . DC 19 H1' . 34798 1 146 . 1 . 1 19 19 DC H2' H 1 2.329 0.002 . . . . . . . DC 19 H2' . 34798 1 147 . 1 . 1 19 19 DC H2'' H 1 2.607 0.006 . . . . . . . DC 19 H2'' . 34798 1 148 . 1 . 1 19 19 DC H3' H 1 4.881 0.000 . . . . . . . DC 19 H3' . 34798 1 149 . 1 . 1 19 19 DC H5 H 1 6.028 0.002 . . . . . . . DC 19 H5 . 34798 1 150 . 1 . 1 19 19 DC H6 H 1 7.850 0.004 . . . . . . . DC 19 H6 . 34798 1 151 . 1 . 1 19 19 DC H41 H 1 7.219 0.002 . . . . . . . DC 19 H41 . 34798 1 152 . 1 . 1 19 19 DC H42 H 1 8.742 0.007 . . . . . . . DC 19 H42 . 34798 1 153 . 1 . 1 20 20 DNR H1' H 1 6.230 0.001 . . . . . . . DNR 20 H1' . 34798 1 154 . 1 . 1 20 20 DNR H2' H 1 0.955 0.004 . . . . . . . DNR 20 H2' . 34798 1 155 . 1 . 1 20 20 DNR H2'' H 1 2.538 0.001 . . . . . . . DNR 20 H2'' . 34798 1 156 . 1 . 1 20 20 DNR H3+ H 1 15.014 0.007 . . . . . . . DNR 20 H3+ . 34798 1 157 . 1 . 1 20 20 DNR H3' H 1 4.346 0.001 . . . . . . . DNR 20 H3' . 34798 1 158 . 1 . 1 20 20 DNR H5 H 1 6.024 0.001 . . . . . . . DNR 20 H5 . 34798 1 159 . 1 . 1 20 20 DNR H6 H 1 7.530 0.002 . . . . . . . DNR 20 H6 . 34798 1 160 . 1 . 1 20 20 DNR H41 H 1 8.855 0.005 . . . . . . . DNR 20 H41 . 34798 1 161 . 1 . 1 20 20 DNR H42 H 1 11.344 0.007 . . . . . . . DNR 20 H42 . 34798 1 162 . 1 . 1 21 21 DG H1 H 1 13.366 0.008 . . . . . . . DG 21 H1 . 34798 1 163 . 1 . 1 21 21 DG H1' H 1 6.116 0.001 . . . . . . . DG 21 H1' . 34798 1 164 . 1 . 1 21 21 DG H2' H 1 2.976 0.006 . . . . . . . DG 21 H2' . 34798 1 165 . 1 . 1 21 21 DG H2'' H 1 2.638 0.000 . . . . . . . DG 21 H2'' . 34798 1 166 . 1 . 1 21 21 DG H3' H 1 5.029 0.001 . . . . . . . DG 21 H3' . 34798 1 167 . 1 . 1 21 21 DG H8 H 1 8.271 0.001 . . . . . . . DG 21 H8 . 34798 1 168 . 1 . 1 21 21 DG H21 H 1 7.194 0.001 . . . . . . . DG 21 H21 . 34798 1 169 . 1 . 1 21 21 DG H22 H 1 8.218 0.000 . . . . . . . DG 21 H22 . 34798 1 170 . 1 . 1 22 22 DT H1' H 1 5.766 0.001 . . . . . . . DT 22 H1' . 34798 1 171 . 1 . 1 22 22 DT H2' H 1 1.900 0.000 . . . . . . . DT 22 H2' . 34798 1 172 . 1 . 1 22 22 DT H2'' H 1 2.103 0.001 . . . . . . . DT 22 H2'' . 34798 1 173 . 1 . 1 22 22 DT H3' H 1 4.361 0.001 . . . . . . . DT 22 H3' . 34798 1 174 . 1 . 1 22 22 DT H6 H 1 7.566 0.003 . . . . . . . DT 22 H6 . 34798 1 175 . 1 . 1 22 22 DT H71 H 1 1.742 0.003 . . . . . . . DT 22 Me . 34798 1 176 . 1 . 1 22 22 DT H72 H 1 1.742 0.003 . . . . . . . DT 22 Me . 34798 1 177 . 1 . 1 22 22 DT H73 H 1 1.742 0.003 . . . . . . . DT 22 Me . 34798 1 stop_ save_