################################### # 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 34611 _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' . . . 34611 1 2 '2D 1H-13C HSQC' . . . 34611 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 UTB H1' H 1 5.905 0.001 . 1 . . . . A 1 UTB H1' . 34611 1 2 . 1 . 1 1 1 UTB H2' H 1 2.621 0.001 . 1 . . . . A 1 UTB H2' . 34611 1 3 . 1 . 1 1 1 UTB H2'' H 1 2.091 0.002 . 1 . . . . A 1 UTB H2'' . 34611 1 4 . 1 . 1 1 1 UTB H3' H 1 4.697 0.000 . 1 . . . . A 1 UTB H3' . 34611 1 5 . 1 . 1 1 1 UTB H6 H 1 7.990 0.000 . 1 . . . . A 1 UTB H6 . 34611 1 6 . 1 . 1 1 1 UTB H12 H 1 8.348 0.001 . 1 . . . . A 1 UTB H12 . 34611 1 7 . 1 . 1 1 1 UTB H13 H 1 7.797 0.001 . 1 . . . . A 1 UTB H13 . 34611 1 8 . 1 . 1 1 1 UTB H14 H 1 7.670 0.001 . 1 . . . . A 1 UTB H14 . 34611 1 9 . 1 . 1 1 1 UTB H15 H 1 7.597 0.002 . 1 . . . . A 1 UTB H15 . 34611 1 10 . 1 . 1 1 1 UTB H16 H 1 7.846 0.000 . 1 . . . . A 1 UTB H16 . 34611 1 11 . 1 . 1 1 1 UTB H17 H 1 7.751 0.002 . 1 . . . . A 1 UTB H17 . 34611 1 12 . 1 . 1 1 1 UTB H18 H 1 7.566 0.000 . 1 . . . . A 1 UTB H18 . 34611 1 13 . 1 . 1 1 1 UTB H19 H 1 7.536 0.000 . 1 . . . . A 1 UTB H19 . 34611 1 14 . 1 . 1 1 1 UTB H20 H 1 7.656 0.000 . 1 . . . . A 1 UTB H20 . 34611 1 15 . 1 . 1 1 1 UTB C6 C 13 142.604 0.000 . 1 . . . . A 1 UTB C6 . 34611 1 16 . 1 . 1 1 1 UTB C14 C 13 124.020 0.000 . 1 . . . . A 1 UTB C14 . 34611 1 17 . 1 . 1 1 1 UTB C15 C 13 128.142 0.000 . 1 . . . . A 1 UTB C15 . 34611 1 18 . 1 . 1 1 1 UTB C18 C 13 124.994 0.000 . 1 . . . . A 1 UTB C18 . 34611 1 19 . 1 . 1 1 1 UTB C19 C 13 128.297 0.000 . 1 . . . . A 1 UTB C19 . 34611 1 20 . 1 . 1 1 1 UTB C22 C 13 125.098 0.000 . 1 . . . . A 1 UTB C22 . 34611 1 21 . 1 . 1 1 1 UTB C23 C 13 125.956 0.000 . 1 . . . . A 1 UTB C23 . 34611 1 22 . 1 . 1 1 1 UTB C25 C 13 125.287 0.000 . 1 . . . . A 1 UTB C25 . 34611 1 23 . 1 . 1 1 1 UTB C26 C 13 127.810 0.000 . 1 . . . . A 1 UTB C26 . 34611 1 24 . 1 . 1 1 1 UTB C27 C 13 126.663 0.000 . 1 . . . . A 1 UTB C27 . 34611 1 25 . 1 . 1 2 2 DG H1 H 1 11.889 0.001 . 1 . . . . A 2 DG H1 . 34611 1 26 . 1 . 1 2 2 DG H1' H 1 6.166 0.002 . 1 . . . . A 2 DG H1' . 34611 1 27 . 1 . 1 2 2 DG H2' H 1 3.081 0.001 . 1 . . . . A 2 DG H2' . 34611 1 28 . 1 . 1 2 2 DG H2'' H 1 2.826 0.002 . 1 . . . . A 2 DG H2'' . 34611 1 29 . 1 . 1 2 2 DG H3' H 1 4.992 0.000 . 1 . . . . A 2 DG H3' . 34611 1 30 . 1 . 1 2 2 DG H8 H 1 8.158 0.001 . 1 . . . . A 2 DG H8 . 34611 1 31 . 1 . 1 2 2 DG C8 C 13 135.35 0.000 . 1 . . . . A 2 DG C8 . 34611 1 32 . 1 . 1 3 3 DG H1 H 1 11.168 0.000 . 1 . . . . A 3 DG H1 . 34611 1 33 . 1 . 1 3 3 DG H1' H 1 6.198 0.002 . 1 . . . . A 3 DG H1' . 34611 1 34 . 1 . 1 3 3 DG H2' H 1 2.934 0.002 . 1 . . . . A 3 DG H2' . 34611 1 35 . 1 . 1 3 3 DG H2'' H 1 2.660 0.000 . 1 . . . . A 3 DG H2'' . 34611 1 36 . 1 . 1 3 3 DG H3' H 1 5.003 0.000 . 1 . . . . A 3 DG H3' . 34611 1 37 . 1 . 1 3 3 DG H8 H 1 7.757 0.001 . 1 . . . . A 3 DG H8 . 34611 1 38 . 1 . 1 3 3 DG C8 C 13 134.606 0.000 . 1 . . . . A 3 DG C8 . 34611 1 39 . 1 . 1 4 4 DG H1 H 1 11.096 0.001 . 1 . . . . A 4 DG H1 . 34611 1 40 . 1 . 1 4 4 DG H1' H 1 6.391 0.000 . 1 . . . . A 4 DG H1' . 34611 1 41 . 1 . 1 4 4 DG H2' H 1 2.527 0.001 . 1 . . . . A 4 DG H2' . 34611 1 42 . 1 . 1 4 4 DG H2'' H 1 2.635 0.002 . 1 . . . . A 4 DG H2'' . 34611 1 43 . 1 . 1 4 4 DG H3' H 1 5.075 0.001 . 1 . . . . A 4 DG H3' . 34611 1 44 . 1 . 1 4 4 DG H8 H 1 7.719 0.000 . 1 . . . . A 4 DG H8 . 34611 1 45 . 1 . 1 4 4 DG C8 C 13 135.306 0.000 . 1 . . . . A 4 DG C8 . 34611 1 46 . 1 . 1 5 5 DC H1' H 1 6.489 0.000 . 1 . . . . A 5 DC H1' . 34611 1 47 . 1 . 1 5 5 DC H2' H 1 2.743 0.001 . 1 . . . . A 5 DC H2' . 34611 1 48 . 1 . 1 5 5 DC H2'' H 1 2.406 0.000 . 1 . . . . A 5 DC H2'' . 34611 1 49 . 1 . 1 5 5 DC H3' H 1 5.092 0.000 . 1 . . . . A 5 DC H3' . 34611 1 50 . 1 . 1 5 5 DC H5 H 1 6.177 0.000 . 1 . . . . A 5 DC H5 . 34611 1 51 . 1 . 1 5 5 DC H6 H 1 8.017 0.000 . 1 . . . . A 5 DC H6 . 34611 1 52 . 1 . 1 5 5 DC C6 C 13 141.509 0.000 . 1 . . . . A 5 DC C6 . 34611 1 53 . 1 . 1 6 6 DG H1 H 1 10.666 0.003 . 1 . . . . A 6 DG H1 . 34611 1 54 . 1 . 1 6 6 DG H1' H 1 6.133 0.001 . 1 . . . . A 6 DG H1' . 34611 1 55 . 1 . 1 6 6 DG H2' H 1 2.850 0.001 . 1 . . . . A 6 DG H2' . 34611 1 56 . 1 . 1 6 6 DG H2'' H 1 2.422 0.002 . 1 . . . . A 6 DG H2'' . 34611 1 57 . 1 . 1 6 6 DG H3' H 1 5.117 0.000 . 1 . . . . A 6 DG H3' . 34611 1 58 . 1 . 1 6 6 DG H8 H 1 7.970 0.003 . 1 . . . . A 6 DG H8 . 34611 1 59 . 1 . 1 6 6 DG C8 C 13 134.479 0.000 . 1 . . . . A 6 DG C8 . 34611 1 60 . 1 . 1 7 7 DG H1 H 1 11.292 0.001 . 1 . . . . A 7 DG H1 . 34611 1 61 . 1 . 1 7 7 DG H1' H 1 5.984 0.001 . 1 . . . . A 7 DG H1' . 34611 1 62 . 1 . 1 7 7 DG H2' H 1 2.703 0.002 . 1 . . . . A 7 DG H2' . 34611 1 63 . 1 . 1 7 7 DG H2'' H 1 2.631 0.002 . 1 . . . . A 7 DG H2'' . 34611 1 64 . 1 . 1 7 7 DG H3' H 1 4.983 0.000 . 1 . . . . A 7 DG H3' . 34611 1 65 . 1 . 1 7 7 DG H8 H 1 7.863 0.000 . 1 . . . . A 7 DG H8 . 34611 1 66 . 1 . 1 7 7 DG C8 C 13 135.398 0.000 . 1 . . . . A 7 DG C8 . 34611 1 67 . 1 . 1 8 8 DG H1 H 1 11.197 0.003 . 1 . . . . A 8 DG H1 . 34611 1 68 . 1 . 1 8 8 DG H1' H 1 6.259 0.000 . 1 . . . . A 8 DG H1' . 34611 1 69 . 1 . 1 8 8 DG H2' H 1 2.287 0.000 . 1 . . . . A 8 DG H2' . 34611 1 70 . 1 . 1 8 8 DG H2'' H 1 2.441 0.002 . 1 . . . . A 8 DG H2'' . 34611 1 71 . 1 . 1 8 8 DG H8 H 1 7.700 0.001 . 1 . . . . A 8 DG H8 . 34611 1 72 . 1 . 1 8 8 DG C8 C 13 135.213 0.000 . 1 . . . . A 8 DG C8 . 34611 1 73 . 1 . 1 9 9 DC H1' H 1 6.059 0.000 . 1 . . . . A 9 DC H1' . 34611 1 74 . 1 . 1 9 9 DC H2' H 1 2.303 0.000 . 1 . . . . A 9 DC H2' . 34611 1 75 . 1 . 1 9 9 DC H2'' H 1 1.769 0.001 . 1 . . . . A 9 DC H2'' . 34611 1 76 . 1 . 1 9 9 DC H3' H 1 4.618 0.000 . 1 . . . . A 9 DC H3' . 34611 1 77 . 1 . 1 9 9 DC H5 H 1 5.986 0.000 . 1 . . . . A 9 DC H5 . 34611 1 78 . 1 . 1 9 9 DC H6 H 1 7.526 0.000 . 1 . . . . A 9 DC H6 . 34611 1 79 . 1 . 1 9 9 DC C6 C 13 141.432 0.000 . 1 . . . . A 9 DC C6 . 34611 1 80 . 1 . 1 10 10 DG H1' H 1 6.055 0.001 . 1 . . . . A 10 DG H1' . 34611 1 81 . 1 . 1 10 10 DG H2' H 1 2.702 0.002 . 1 . . . . A 10 DG H2' . 34611 1 82 . 1 . 1 10 10 DG H2'' H 1 2.875 0.001 . 1 . . . . A 10 DG H2'' . 34611 1 83 . 1 . 1 10 10 DG H3' H 1 5.047 0.002 . 1 . . . . A 10 DG H3' . 34611 1 84 . 1 . 1 10 10 DG H8 H 1 7.965 0.001 . 1 . . . . A 10 DG H8 . 34611 1 85 . 1 . 1 10 10 DG C8 C 13 137.005 0.000 . 1 . . . . A 10 DG C8 . 34611 1 86 . 1 . 1 11 11 DC H1' H 1 6.314 0.001 . 1 . . . . A 11 DC H1' . 34611 1 87 . 1 . 1 11 11 DC H2' H 1 2.678 0.003 . 1 . . . . A 11 DC H2' . 34611 1 88 . 1 . 1 11 11 DC H2'' H 1 2.317 0.001 . 1 . . . . A 11 DC H2'' . 34611 1 89 . 1 . 1 11 11 DC H3' H 1 4.887 0.000 . 1 . . . . A 11 DC H3' . 34611 1 90 . 1 . 1 11 11 DC H5 H 1 6.103 0.000 . 1 . . . . A 11 DC H5 . 34611 1 91 . 1 . 1 11 11 DC H6 H 1 7.948 0.003 . 1 . . . . A 11 DC H6 . 34611 1 92 . 1 . 1 11 11 DC C6 C 13 141.906 0.000 . 1 . . . . A 11 DC C6 . 34611 1 93 . 1 . 1 12 12 DT H1' H 1 6.034 0.005 . 1 . . . . A 12 DT H1' . 34611 1 94 . 1 . 1 12 12 DT H2' H 1 2.177 0.000 . 1 . . . . A 12 DT H2' . 34611 1 95 . 1 . 1 12 12 DT H2'' H 1 1.694 0.001 . 1 . . . . A 12 DT H2'' . 34611 1 96 . 1 . 1 12 12 DT H6 H 1 7.491 0.000 . 1 . . . . A 12 DT H6 . 34611 1 97 . 1 . 1 12 12 DT H71 H 1 1.894 0.001 . 3 . . . . A 12 DT H71 . 34611 1 98 . 1 . 1 12 12 DT H72 H 1 1.894 0.001 . 3 . . . . A 12 DT H72 . 34611 1 99 . 1 . 1 12 12 DT H73 H 1 1.894 0.001 . 3 . . . . A 12 DT H73 . 34611 1 100 . 1 . 1 12 12 DT C6 C 13 136.733 0.000 . 1 . . . . A 12 DT C6 . 34611 1 101 . 1 . 1 13 13 DA H1' H 1 6.282 0.002 . 1 . . . . A 13 DA H1' . 34611 1 102 . 1 . 1 13 13 DA H2 H 1 7.882 0.000 . 1 . . . . A 13 DA H2 . 34611 1 103 . 1 . 1 13 13 DA H2' H 1 2.838 0.002 . 1 . . . . A 13 DA H2' . 34611 1 104 . 1 . 1 13 13 DA H2'' H 1 2.971 0.001 . 1 . . . . A 13 DA H2'' . 34611 1 105 . 1 . 1 13 13 DA H3' H 1 5.127 0.000 . 1 . . . . A 13 DA H3' . 34611 1 106 . 1 . 1 13 13 DA H8 H 1 8.243 0.001 . 1 . . . . A 13 DA H8 . 34611 1 107 . 1 . 1 13 13 DA C2 C 13 152.032 0.000 . 1 . . . . A 13 DA C2 . 34611 1 108 . 1 . 1 13 13 DA C8 C 13 139.183 0.000 . 1 . . . . A 13 DA C8 . 34611 1 109 . 1 . 1 14 14 DG H1 H 1 10.912 0.001 . 1 . . . . A 14 DG H1 . 34611 1 110 . 1 . 1 14 14 DG H1' H 1 6.173 0.002 . 1 . . . . A 14 DG H1' . 34611 1 111 . 1 . 1 14 14 DG H2' H 1 3.024 0.001 . 1 . . . . A 14 DG H2' . 34611 1 112 . 1 . 1 14 14 DG H2'' H 1 2.756 0.003 . 1 . . . . A 14 DG H2'' . 34611 1 113 . 1 . 1 14 14 DG H3' H 1 5.031 0.000 . 1 . . . . A 14 DG H3' . 34611 1 114 . 1 . 1 14 14 DG H8 H 1 7.993 0.001 . 1 . . . . A 14 DG H8 . 34611 1 115 . 1 . 1 14 14 DG C8 C 13 134.529 0.000 . 1 . . . . A 14 DG C8 . 34611 1 116 . 1 . 1 15 15 DG H1 H 1 11.095 0.001 . 1 . . . . A 15 DG H1 . 34611 1 117 . 1 . 1 15 15 DG H1' H 1 6.141 0.004 . 1 . . . . A 15 DG H1' . 34611 1 118 . 1 . 1 15 15 DG H2' H 1 2.41 0.000 . 1 . . . . A 15 DG H2' . 34611 1 119 . 1 . 1 15 15 DG H2'' H 1 2.903 0.003 . 1 . . . . A 15 DG H2'' . 34611 1 120 . 1 . 1 15 15 DG H3' H 1 5.027 0.000 . 1 . . . . A 15 DG H3' . 34611 1 121 . 1 . 1 15 15 DG H8 H 1 7.697 0.000 . 1 . . . . A 15 DG H8 . 34611 1 122 . 1 . 1 15 15 DG C8 C 13 134.694 0.000 . 1 . . . . A 15 DG C8 . 34611 1 123 . 1 . 1 16 16 DG H1 H 1 11.000 0.001 . 1 . . . . A 16 DG H1 . 34611 1 124 . 1 . 1 16 16 DG H1' H 1 6.402 0.000 . 1 . . . . A 16 DG H1' . 34611 1 125 . 1 . 1 16 16 DG H2' H 1 2.529 0.000 . 1 . . . . A 16 DG H2' . 34611 1 126 . 1 . 1 16 16 DG H2'' H 1 2.635 0.002 . 1 . . . . A 16 DG H2'' . 34611 1 127 . 1 . 1 16 16 DG H3' H 1 5.074 0.001 . 1 . . . . A 16 DG H3' . 34611 1 128 . 1 . 1 16 16 DG H8 H 1 7.719 0.000 . 1 . . . . A 16 DG H8 . 34611 1 129 . 1 . 1 16 16 DG C8 C 13 135.307 0.000 . 1 . . . . A 16 DG C8 . 34611 1 130 . 1 . 1 17 17 DA H1' H 1 6.676 0.000 . 1 . . . . A 17 DA H1' . 34611 1 131 . 1 . 1 17 17 DA H2 H 1 8.313 0.000 . 1 . . . . A 17 DA H2 . 34611 1 132 . 1 . 1 17 17 DA H2' H 1 2.917 0.001 . 2 . . . . A 17 DA H2' . 34611 1 133 . 1 . 1 17 17 DA H2'' H 1 2.917 0.001 . 2 . . . . A 17 DA H2'' . 34611 1 134 . 1 . 1 17 17 DA H3' H 1 5.217 0.002 . 1 . . . . A 17 DA H3' . 34611 1 135 . 1 . 1 17 17 DA H8 H 1 8.522 0.000 . 1 . . . . A 17 DA H8 . 34611 1 136 . 1 . 1 17 17 DA C2 C 13 152.69 0.000 . 1 . . . . A 17 DA C2 . 34611 1 137 . 1 . 1 17 17 DA C8 C 13 139.81 0.000 . 1 . . . . A 17 DA C8 . 34611 1 138 . 1 . 1 18 18 DG H1 H 1 11.663 0.001 . 1 . . . . A 18 DG H1 . 34611 1 139 . 1 . 1 18 18 DG H1' H 1 6.124 0.004 . 1 . . . . A 18 DG H1' . 34611 1 140 . 1 . 1 18 18 DG H2' H 1 2.855 0.000 . 1 . . . . A 18 DG H2' . 34611 1 141 . 1 . 1 18 18 DG H2'' H 1 2.399 0.001 . 1 . . . . A 18 DG H2'' . 34611 1 142 . 1 . 1 18 18 DG H3' H 1 5.149 0.001 . 1 . . . . A 18 DG H3' . 34611 1 143 . 1 . 1 18 18 DG H8 H 1 7.823 0.001 . 1 . . . . A 18 DG H8 . 34611 1 144 . 1 . 1 18 18 DG C8 C 13 134.323 0.000 . 1 . . . . A 18 DG C8 . 34611 1 145 . 1 . 1 19 19 DG H1 H 1 11.490 0.001 . 1 . . . . A 19 DG H1 . 34611 1 146 . 1 . 1 19 19 DG H1' H 1 6.054 0.002 . 1 . . . . A 19 DG H1' . 34611 1 147 . 1 . 1 19 19 DG H2' H 1 2.697 0.000 . 1 . . . . A 19 DG H2' . 34611 1 148 . 1 . 1 19 19 DG H3' H 1 5.063 0.000 . 1 . . . . A 19 DG H3' . 34611 1 149 . 1 . 1 19 19 DG H8 H 1 7.915 0.000 . 1 . . . . A 19 DG H8 . 34611 1 150 . 1 . 1 19 19 DG C8 C 13 135.369 0.000 . 1 . . . . A 19 DG C8 . 34611 1 151 . 1 . 1 20 20 DG H1 H 1 11.222 0.001 . 1 . . . . A 20 DG H1 . 34611 1 152 . 1 . 1 20 20 DG H1' H 1 6.22 0.000 . 1 . . . . A 20 DG H1' . 34611 1 153 . 1 . 1 20 20 DG H2' H 1 2.767 0.001 . 1 . . . . A 20 DG H2' . 34611 1 154 . 1 . 1 20 20 DG H2'' H 1 2.583 0.001 . 1 . . . . A 20 DG H2'' . 34611 1 155 . 1 . 1 20 20 DG H3' H 1 4.870 0.002 . 1 . . . . A 20 DG H3' . 34611 1 156 . 1 . 1 20 20 DG H8 H 1 7.660 0.000 . 1 . . . . A 20 DG H8 . 34611 1 157 . 1 . 1 20 20 DG C8 C 13 134.427 0.000 . 1 . . . . A 20 DG C8 . 34611 1 158 . 1 . 1 21 21 DT H1' H 1 5.892 0.000 . 1 . . . . A 21 DT H1' . 34611 1 159 . 1 . 1 21 21 DT H2' H 1 2.047 0.003 . 2 . . . . A 21 DT H2' . 34611 1 160 . 1 . 1 21 21 DT H2'' H 1 2.047 0.003 . 2 . . . . A 21 DT H2'' . 34611 1 161 . 1 . 1 21 21 DT H3' H 1 4.411 0.000 . 1 . . . . A 21 DT H3' . 34611 1 162 . 1 . 1 21 21 DT H6 H 1 7.128 0.000 . 1 . . . . A 21 DT H6 . 34611 1 163 . 1 . 1 21 21 DT H71 H 1 1.471 0.000 . 3 . . . . A 21 DT H71 . 34611 1 164 . 1 . 1 21 21 DT H72 H 1 1.471 0.000 . 3 . . . . A 21 DT H72 . 34611 1 165 . 1 . 1 21 21 DT H73 H 1 1.471 0.000 . 3 . . . . A 21 DT H73 . 34611 1 166 . 1 . 1 21 21 DT C6 C 13 135.757 0.000 . 1 . . . . A 21 DT C6 . 34611 1 stop_ save_