################################### # 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 34615 _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' . . . 34615 1 2 '2D 1H-13C HSQC aromatic' . . . 34615 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 THM H1' H 1 5.955 0.002 . 1 . . 232 . A 1 THM H1' . 34615 1 2 . 1 . 1 1 1 THM H2' H 1 1.601 0.003 . 1 . . 234 . A 1 THM H2' . 34615 1 3 . 1 . 1 1 1 THM H2'' H 1 1.987 0.001 . 1 . . 233 . A 1 THM H2'' . 34615 1 4 . 1 . 1 1 1 THM H3' H 1 4.387 0.0 . 1 . . 318 . A 1 THM H3' . 34615 1 5 . 1 . 1 1 1 THM H6 H 1 7.313 0.001 . 1 . . 231 . A 1 THM H6 . 34615 1 6 . 1 . 1 1 1 THM H71 H 1 1.737 0.001 . 1 . . 268 . A 1 THM H71 . 34615 1 7 . 1 . 1 1 1 THM H72 H 1 1.737 0.001 . 1 . . 268 . A 1 THM H72 . 34615 1 8 . 1 . 1 1 1 THM H73 H 1 1.737 0.001 . 1 . . 268 . A 1 THM H73 . 34615 1 9 . 1 . 1 1 1 THM C6 C 13 139.340 . . 1 . . 244 . A 1 THM C6 . 34615 1 10 . 1 . 1 2 2 DG H1' H 1 5.528 0.003 . 1 . . 236 . A 2 DG H1' . 34615 1 11 . 1 . 1 2 2 DG H2' H 1 2.237 0.0 . 2 . . 237 . A 2 DG H2' . 34615 1 12 . 1 . 1 2 2 DG H2'' H 1 2.299 0.0 . 2 . . 238 . A 2 DG H2'' . 34615 1 13 . 1 . 1 2 2 DG H3' H 1 4.666 0.003 . 1 . . 319 . A 2 DG H3' . 34615 1 14 . 1 . 1 2 2 DG H8 H 1 7.439 0.001 . 1 . . 235 . A 2 DG H8 . 34615 1 15 . 1 . 1 2 2 DG C8 C 13 139.073 . . 1 . . 243 . A 2 DG C8 . 34615 1 16 . 1 . 1 3 3 DA H1' H 1 5.873 0.002 . 1 . . 239 . A 3 DA H1' . 34615 1 17 . 1 . 1 3 3 DA H2 H 1 7.742 0.001 . 1 . . 230 . A 3 DA H2 . 34615 1 18 . 1 . 1 3 3 DA H2' H 1 2.364 0.001 . 1 . . 241 . A 3 DA H2' . 34615 1 19 . 1 . 1 3 3 DA H2'' H 1 2.809 0.001 . 1 . . 240 . A 3 DA H2'' . 34615 1 20 . 1 . 1 3 3 DA H3' H 1 4.732 0.003 . 1 . . 321 . A 3 DA H3' . 34615 1 21 . 1 . 1 3 3 DA H8 H 1 8.044 0.001 . 1 . . 155 . A 3 DA H8 . 34615 1 22 . 1 . 1 3 3 DA C2 C 13 154.914 . . 1 . . 245 . A 3 DA C2 . 34615 1 23 . 1 . 1 3 3 DA C8 C 13 141.466 . . 1 . . 242 . A 3 DA C8 . 34615 1 24 . 1 . 1 4 4 DG H1 H 1 11.012 0.001 . 1 . . 152 . A 4 DG H1 . 34615 1 25 . 1 . 1 4 4 DG H1' H 1 5.990 0.004 . 1 . . 159 . A 4 DG H1' . 34615 1 26 . 1 . 1 4 4 DG H2' H 1 2.665 0.002 . 1 . . 181 . A 4 DG H2' . 34615 1 27 . 1 . 1 4 4 DG H2'' H 1 2.997 . . 1 . . 182 . A 4 DG H2'' . 34615 1 28 . 1 . 1 4 4 DG H3' H 1 4.899 0.003 . 1 . . 320 . A 4 DG H3' . 34615 1 29 . 1 . 1 4 4 DG H8 H 1 7.883 0.001 . 1 . . 143 . A 4 DG H8 . 34615 1 30 . 1 . 1 4 4 DG C8 C 13 137.684 . . 1 . . 219 . A 4 DG C8 . 34615 1 31 . 1 . 1 5 5 DG H1 H 1 11.257 0.002 . 1 . . 151 . A 5 DG H1 . 34615 1 32 . 1 . 1 5 5 DG H1' H 1 6.177 0.002 . 1 . . 158 . A 5 DG H1' . 34615 1 33 . 1 . 1 5 5 DG H2' H 1 2.542 . . 1 . . 184 . A 5 DG H2' . 34615 1 34 . 1 . 1 5 5 DG H2'' H 1 2.905 0.002 . 1 . . 183 . A 5 DG H2'' . 34615 1 35 . 1 . 1 5 5 DG H3' H 1 4.798 0.003 . 1 . . 322 . A 5 DG H3' . 34615 1 36 . 1 . 1 5 5 DG H8 H 1 7.588 0.001 . 1 . . 154 . A 5 DG H8 . 34615 1 37 . 1 . 1 5 5 DG C8 C 13 137.200 . . 1 . . 213 . A 5 DG C8 . 34615 1 38 . 1 . 1 6 6 DG H1 H 1 11.102 0.002 . 1 . . 153 . A 6 DG H1 . 34615 1 39 . 1 . 1 6 6 DG H1' H 1 6.418 0.0 . 1 . . 157 . A 6 DG H1' . 34615 1 40 . 1 . 1 6 6 DG H2' H 1 2.670 . . 1 . . 302 . A 6 DG H2' . 34615 1 41 . 1 . 1 6 6 DG H2'' H 1 2.671 0.001 . 1 . . 295 . A 6 DG H2'' . 34615 1 42 . 1 . 1 6 6 DG H3' H 1 4.653 . . 1 . . 323 . A 6 DG H3' . 34615 1 43 . 1 . 1 6 6 DG H8 H 1 7.774 0.002 . 1 . . 156 . A 6 DG H8 . 34615 1 44 . 1 . 1 6 6 DG C8 C 13 138.918 . . 1 . . 214 . A 6 DG C8 . 34615 1 45 . 1 . 1 8 8 DG H1 H 1 11.525 0.001 . 1 . . 167 . A 8 DG H1 . 34615 1 46 . 1 . 1 8 8 DG H1' H 1 6.229 0.002 . 1 . . 174 . A 8 DG H1' . 34615 1 47 . 1 . 1 8 8 DG H2' H 1 2.528 0.003 . 1 . . 176 . A 8 DG H2' . 34615 1 48 . 1 . 1 8 8 DG H2'' H 1 3.051 . . 1 . . 175 . A 8 DG H2'' . 34615 1 49 . 1 . 1 8 8 DG H3' H 1 5.173 0.0 . 1 . . 324 . A 8 DG H3' . 34615 1 50 . 1 . 1 8 8 DG H8 H 1 8.101 0.001 . 1 . . 166 . A 8 DG H8 . 34615 1 51 . 1 . 1 8 8 DG C8 C 13 137.497 . . 1 . . 218 . A 8 DG C8 . 34615 1 52 . 1 . 1 9 9 DG H1 H 1 11.146 0.002 . 1 . . 168 . A 9 DG H1 . 34615 1 53 . 1 . 1 9 9 DG H1' H 1 6.083 0.002 . 1 . . 173 . A 9 DG H1' . 34615 1 54 . 1 . 1 9 9 DG H2' H 1 2.609 0.002 . 1 . . 178 . A 9 DG H2' . 34615 1 55 . 1 . 1 9 9 DG H2'' H 1 2.837 0.002 . 1 . . 177 . A 9 DG H2'' . 34615 1 56 . 1 . 1 9 9 DG H3' H 1 5.061 0.002 . 1 . . 325 . A 9 DG H3' . 34615 1 57 . 1 . 1 9 9 DG H8 H 1 7.813 0.001 . 1 . . 165 . A 9 DG H8 . 34615 1 58 . 1 . 1 9 9 DG C8 C 13 138.028 . . 1 . . 211 . A 9 DG C8 . 34615 1 59 . 1 . 1 10 10 DG H1 H 1 11.085 0.001 . 1 . . 169 . A 10 DG H1 . 34615 1 60 . 1 . 1 10 10 DG H1' H 1 5.660 0.001 . 1 . . 172 . A 10 DG H1' . 34615 1 61 . 1 . 1 10 10 DG H2' H 1 2.366 0.001 . 1 . . 180 . A 10 DG H2' . 34615 1 62 . 1 . 1 10 10 DG H2'' H 1 2.325 . . 1 . . 179 . A 10 DG H2'' . 34615 1 63 . 1 . 1 10 10 DG H3' H 1 4.653 0.002 . 1 . . 327 . A 10 DG H3' . 34615 1 64 . 1 . 1 10 10 DG H8 H 1 7.767 0.002 . 1 . . 164 . A 10 DG H8 . 34615 1 65 . 1 . 1 10 10 DG C8 C 13 138.109 . . 1 . . 215 . A 10 DG C8 . 34615 1 66 . 1 . 1 12 12 DG H1 H 1 11.050 0.004 . 1 . . 162 . A 12 DG H1 . 34615 1 67 . 1 . 1 12 12 DG H1' H 1 5.593 0.002 . 1 . . 188 . A 12 DG H1' . 34615 1 68 . 1 . 1 12 12 DG H2' H 1 2.109 0.002 . 1 . . 189 . A 12 DG H2' . 34615 1 69 . 1 . 1 12 12 DG H2'' H 1 2.710 0.001 . 1 . . 190 . A 12 DG H2'' . 34615 1 70 . 1 . 1 12 12 DG H3' H 1 5.119 . . 1 . . 328 . A 12 DG H3' . 34615 1 71 . 1 . 1 12 12 DG H8 H 1 7.742 0.001 . 1 . . 170 . A 12 DG H8 . 34615 1 72 . 1 . 1 12 12 DG C8 C 13 137.341 . . 1 . . 212 . A 12 DG C8 . 34615 1 73 . 1 . 1 13 13 DG H1 H 1 11.607 0.002 . 1 . . 160 . A 13 DG H1 . 34615 1 74 . 1 . 1 13 13 DG H1' H 1 5.925 0.002 . 1 . . 296 . A 13 DG H1' . 34615 1 75 . 1 . 1 13 13 DG H2' H 1 2.722 . . 2 . . 297 . A 13 DG H2' . 34615 1 76 . 1 . 1 13 13 DG H2'' H 1 2.664 . . 2 . . 303 . A 13 DG H2'' . 34615 1 77 . 1 . 1 13 13 DG H3' H 1 5.067 0.001 . 1 . . 329 . A 13 DG H3' . 34615 1 78 . 1 . 1 13 13 DG H8 H 1 7.888 0.002 . 1 . . 171 . A 13 DG H8 . 34615 1 79 . 1 . 1 14 14 DG H1 H 1 10.675 0.002 . 1 . . 161 . A 14 DG H1 . 34615 1 80 . 1 . 1 14 14 DG H1' H 1 5.844 0.002 . 1 . . 227 . A 14 DG H1' . 34615 1 81 . 1 . 1 14 14 DG H2' H 1 2.697 . . 1 . . 304 . A 14 DG H2' . 34615 1 82 . 1 . 1 14 14 DG H2'' H 1 2.699 0.002 . 1 . . 228 . A 14 DG H2'' . 34615 1 83 . 1 . 1 14 14 DG H3' H 1 5.065 0.001 . 1 . . 330 . A 14 DG H3' . 34615 1 84 . 1 . 1 14 14 DG H8 H 1 7.875 0.002 . 1 . . 221 . A 14 DG H8 . 34615 1 85 . 1 . 1 15 15 DA H1' H 1 6.334 0.002 . 1 . . 131 . A 15 DA H1' . 34615 1 86 . 1 . 1 15 15 DA H2 H 1 7.764 0.002 . 1 . . 147 . A 15 DA H2 . 34615 1 87 . 1 . 1 15 15 DA H2' H 1 2.652 0.003 . 1 . . 225 . A 15 DA H2' . 34615 1 88 . 1 . 1 15 15 DA H2'' H 1 2.875 0.002 . 1 . . 226 . A 15 DA H2'' . 34615 1 89 . 1 . 1 15 15 DA H3' H 1 5.106 0.001 . 1 . . 331 . A 15 DA H3' . 34615 1 90 . 1 . 1 15 15 DA H8 H 1 8.313 0.001 . 1 . . 130 . A 15 DA H8 . 34615 1 91 . 1 . 1 15 15 DA C2 C 13 155.060 . . 1 . . 246 . A 15 DA C2 . 34615 1 92 . 1 . 1 15 15 DA C8 C 13 141.247 . . 1 . . 247 . A 15 DA C8 . 34615 1 93 . 1 . 1 16 16 DC H1' H 1 5.549 0.003 . 1 . . 133 . A 16 DC H1' . 34615 1 94 . 1 . 1 16 16 DC H2' H 1 2.000 0.002 . 1 . . 192 . A 16 DC H2' . 34615 1 95 . 1 . 1 16 16 DC H2'' H 1 2.305 0.001 . 1 . . 191 . A 16 DC H2'' . 34615 1 96 . 1 . 1 16 16 DC H3' H 1 4.839 . . 1 . . 332 . A 16 DC H3' . 34615 1 97 . 1 . 1 16 16 DC H5 H 1 5.213 0.003 . 1 . . 298 . A 16 DC H5 . 34615 1 98 . 1 . 1 16 16 DC H6 H 1 7.230 0.002 . 1 . . 132 . A 16 DC H6 . 34615 1 99 . 1 . 1 16 16 DC H41 H 1 7.920 0.0 . 1 . . 313 . A 16 DC H41 . 34615 1 100 . 1 . 1 16 16 DC H42 H 1 6.275 0.002 . 1 . . 314 . A 16 DC H42 . 34615 1 101 . 1 . 1 16 16 DC C6 C 13 142.512 . . 1 . . 207 . A 16 DC C6 . 34615 1 102 . 1 . 1 17 17 DG H1 H 1 12.755 0.002 . 1 . . 256 . A 17 DG H1 . 34615 1 103 . 1 . 1 17 17 DG H1' H 1 5.815 0.002 . 1 . . 222 . A 17 DG H1' . 34615 1 104 . 1 . 1 17 17 DG H2' H 1 2.386 0.002 . 1 . . 223 . A 17 DG H2' . 34615 1 105 . 1 . 1 17 17 DG H2'' H 1 2.581 0.002 . 1 . . 224 . A 17 DG H2'' . 34615 1 106 . 1 . 1 17 17 DG H3' H 1 4.895 0.0 . 1 . . 333 . A 17 DG H3' . 34615 1 107 . 1 . 1 17 17 DG H8 H 1 7.724 0.002 . 1 . . 134 . A 17 DG H8 . 34615 1 108 . 1 . 1 17 17 DG C8 C 13 138.178 . . 1 . . 217 . A 17 DG C8 . 34615 1 109 . 1 . 1 18 18 DC H1' H 1 5.835 0.004 . 1 . . 149 . A 18 DC H1' . 34615 1 110 . 1 . 1 18 18 DC H2' H 1 1.658 0.003 . 1 . . 200 . A 18 DC H2' . 34615 1 111 . 1 . 1 18 18 DC H2'' H 1 2.281 0.004 . 1 . . 201 . A 18 DC H2'' . 34615 1 112 . 1 . 1 18 18 DC H3' H 1 4.745 . . 1 . . 334 . A 18 DC H3' . 34615 1 113 . 1 . 1 18 18 DC H5 H 1 5.029 0.003 . 1 . . 150 . A 18 DC H5 . 34615 1 114 . 1 . 1 18 18 DC H6 H 1 6.921 0.001 . 1 . . 135 . A 18 DC H6 . 34615 1 115 . 1 . 1 18 18 DC H41 H 1 6.620 0.0 . 1 . . 311 . A 18 DC H41 . 34615 1 116 . 1 . 1 18 18 DC H42 H 1 8.366 0.001 . 1 . . 312 . A 18 DC H42 . 34615 1 117 . 1 . 1 18 18 DC C6 C 13 141.646 . . 1 . . 209 . A 18 DC C6 . 34615 1 118 . 1 . 1 19 19 DG H1' H 1 5.685 0.002 . 1 . . 204 . A 19 DG H1' . 34615 1 119 . 1 . 1 19 19 DG H2' H 1 2.634 . . 1 . . 203 . A 19 DG H2' . 34615 1 120 . 1 . 1 19 19 DG H2'' H 1 2.429 0.001 . 1 . . 202 . A 19 DG H2'' . 34615 1 121 . 1 . 1 19 19 DG H3' H 1 4.827 0.0 . 1 . . 335 . A 19 DG H3' . 34615 1 122 . 1 . 1 19 19 DG H8 H 1 8.076 0.001 . 1 . . 136 . A 19 DG H8 . 34615 1 123 . 1 . 1 19 19 DG C8 C 13 139.140 . . 1 . . 210 . A 19 DG C8 . 34615 1 124 . 1 . 1 20 20 DC H1' H 1 5.756 0.001 . 1 . . 249 . A 20 DC H1' . 34615 1 125 . 1 . 1 20 20 DC H2' H 1 1.575 . . 1 . . 251 . A 20 DC H2' . 34615 1 126 . 1 . 1 20 20 DC H2'' H 1 2.083 0.002 . 1 . . 250 . A 20 DC H2'' . 34615 1 127 . 1 . 1 20 20 DC H3' H 1 4.374 . . 1 . . 336 . A 20 DC H3' . 34615 1 128 . 1 . 1 20 20 DC H6 H 1 7.242 0.002 . 1 . . 199 . A 20 DC H6 . 34615 1 129 . 1 . 1 20 20 DC C6 C 13 143.517 . . 1 . . 220 . A 20 DC C6 . 34615 1 130 . 1 . 1 21 21 DA H1' H 1 5.348 0.003 . 1 . . 307 . A 21 DA H1' . 34615 1 131 . 1 . 1 21 21 DA H2' H 1 2.448 . . 1 . . 309 . A 21 DA H2' . 34615 1 132 . 1 . 1 21 21 DA H2'' H 1 2.366 . . 1 . . 308 . A 21 DA H2'' . 34615 1 133 . 1 . 1 22 22 DG H1 H 1 12.811 0.001 . 1 . . 255 . A 22 DG H1 . 34615 1 134 . 1 . 1 22 22 DG H1' H 1 6.184 0.002 . 1 . . 142 . A 22 DG H1' . 34615 1 135 . 1 . 1 22 22 DG H2' H 1 2.719 0.002 . 1 . . 300 . A 22 DG H2' . 34615 1 136 . 1 . 1 22 22 DG H2'' H 1 2.791 0.001 . 1 . . 299 . A 22 DG H2'' . 34615 1 137 . 1 . 1 22 22 DG H3' H 1 4.771 0.005 . 1 . . 337 . A 22 DG H3' . 34615 1 138 . 1 . 1 22 22 DG H8 H 1 7.876 0.002 . 1 . . 138 . A 22 DG H8 . 34615 1 139 . 1 . 1 23 23 DC H1' H 1 5.570 0.003 . 1 . . 141 . A 23 DC H1' . 34615 1 140 . 1 . 1 23 23 DC H2' H 1 1.851 0.0 . 1 . . 193 . A 23 DC H2' . 34615 1 141 . 1 . 1 23 23 DC H2'' H 1 2.234 0.005 . 1 . . 194 . A 23 DC H2'' . 34615 1 142 . 1 . 1 23 23 DC H3' H 1 4.687 0.002 . 1 . . 338 . A 23 DC H3' . 34615 1 143 . 1 . 1 23 23 DC H5 H 1 5.157 0.002 . 1 . . 315 . A 23 DC H5 . 34615 1 144 . 1 . 1 23 23 DC H6 H 1 7.193 0.002 . 1 . . 137 . A 23 DC H6 . 34615 1 145 . 1 . 1 23 23 DC H41 H 1 6.184 0.0 . 1 . . 316 . A 23 DC H41 . 34615 1 146 . 1 . 1 23 23 DC H42 H 1 8.079 0.0 . 1 . . 317 . A 23 DC H42 . 34615 1 147 . 1 . 1 23 23 DC C6 C 13 142.751 . . 1 . . 208 . A 23 DC C6 . 34615 1 148 . 1 . 1 24 24 DG H1 H 1 12.758 0.002 . 1 . . 148 . A 24 DG H1 . 34615 1 149 . 1 . 1 24 24 DG H1' H 1 5.840 0.002 . 1 . . 140 . A 24 DG H1' . 34615 1 150 . 1 . 1 24 24 DG H2' H 1 2.252 0.002 . 1 . . 198 . A 24 DG H2' . 34615 1 151 . 1 . 1 24 24 DG H2'' H 1 2.518 0.001 . 1 . . 197 . A 24 DG H2'' . 34615 1 152 . 1 . 1 24 24 DG H3' H 1 4.801 0.001 . 1 . . 339 . A 24 DG H3' . 34615 1 153 . 1 . 1 24 24 DG H8 H 1 7.629 0.001 . 1 . . 128 . A 24 DG H8 . 34615 1 154 . 1 . 1 24 24 DG C8 C 13 138.453 . . 1 . . 216 . A 24 DG C8 . 34615 1 155 . 1 . 1 25 25 DT H1' H 1 5.765 0.001 . 1 . . 139 . A 25 DT H1' . 34615 1 156 . 1 . 1 25 25 DT H2' H 1 1.904 0.002 . 1 . . 196 . A 25 DT H2' . 34615 1 157 . 1 . 1 25 25 DT H2'' H 1 2.743 0.003 . 1 . . 195 . A 25 DT H2'' . 34615 1 158 . 1 . 1 25 25 DT H3 H 1 13.447 0.002 . 1 . . 146 . A 25 DT H3 . 34615 1 159 . 1 . 1 25 25 DT H3' H 1 4.734 . . 1 . . 340 . A 25 DT H3' . 34615 1 160 . 1 . 1 25 25 DT H6 H 1 6.851 0.002 . 1 . . 129 . A 25 DT H6 . 34615 1 161 . 1 . 1 25 25 DT H71 H 1 0.996 0.003 . 1 . . 248 . A 25 DT H71 . 34615 1 162 . 1 . 1 25 25 DT H72 H 1 0.996 0.003 . 1 . . 248 . A 25 DT H72 . 34615 1 163 . 1 . 1 25 25 DT H73 H 1 0.996 0.003 . 1 . . 248 . A 25 DT H73 . 34615 1 164 . 1 . 1 25 25 DT C6 C 13 137.923 . . 1 . . 206 . A 25 DT C6 . 34615 1 165 . 1 . 1 26 26 BGM H1 H 1 11.207 0.002 . 1 . . 125 . A 26 BGM H1 . 34615 1 166 . 1 . 1 26 26 BGM H1' H 1 5.910 . . 1 . . 254 . A 26 BGM H1' . 34615 1 167 . 1 . 1 26 26 BGM H2' H 1 3.207 0.001 . 1 . . 253 . A 26 BGM H2' . 34615 1 168 . 1 . 1 26 26 BGM H2'' H 1 2.498 0.003 . 1 . . 252 . A 26 BGM H2'' . 34615 1 169 . 1 . 1 27 27 DG H1 H 1 10.998 0.002 . 1 . . 126 . A 27 DG H1 . 34615 1 170 . 1 . 1 27 27 DG H1' H 1 5.767 0.003 . 1 . . 185 . A 27 DG H1' . 34615 1 171 . 1 . 1 27 27 DG H2' H 1 3.214 0.003 . 1 . . 187 . A 27 DG H2' . 34615 1 172 . 1 . 1 27 27 DG H2'' H 1 3.037 0.001 . 1 . . 186 . A 27 DG H2'' . 34615 1 173 . 1 . 1 27 27 DG H3' H 1 4.878 . . 1 . . 341 . A 27 DG H3' . 34615 1 174 . 1 . 1 27 27 DG H8 H 1 7.053 0.001 . 1 . . 163 . A 27 DG H8 . 34615 1 175 . 1 . 1 27 27 DG C8 C 13 140.253 . . 1 . . 205 . A 27 DG C8 . 34615 1 176 . 1 . 1 28 28 BGM H1 H 1 11.418 0.003 . 1 . . 127 . A 28 BGM H1 . 34615 1 177 . 1 . 1 28 28 BGM H1' H 1 5.793 0.002 . 1 . . 258 . A 28 BGM H1' . 34615 1 178 . 1 . 1 28 28 BGM H2' H 1 2.782 0.001 . 1 . . 264 . A 28 BGM H2' . 34615 1 179 . 1 . 1 28 28 BGM H2'' H 1 2.335 0.0 . 1 . . 263 . A 28 BGM H2'' . 34615 1 180 . 1 . 1 28 28 BGM H3' H 1 4.887 . . 1 . . 343 . A 28 BGM H3' . 34615 1 181 . 1 . 1 29 29 DT H1' H 1 6.036 0.001 . 1 . . 259 . A 29 DT H1' . 34615 1 182 . 1 . 1 29 29 DT H2' H 1 1.409 0.001 . 1 . . 260 . A 29 DT H2' . 34615 1 183 . 1 . 1 29 29 DT H2'' H 1 2.005 0.001 . 1 . . 261 . A 29 DT H2'' . 34615 1 184 . 1 . 1 29 29 DT H3' H 1 4.692 0.007 . 1 . . 342 . A 29 DT H3' . 34615 1 185 . 1 . 1 29 29 DT H6 H 1 7.105 0.001 . 1 . . 257 . A 29 DT H6 . 34615 1 186 . 1 . 1 29 29 DT H71 H 1 1.854 0.003 . 1 . . 265 . A 29 DT H71 . 34615 1 187 . 1 . 1 29 29 DT H72 H 1 1.854 0.003 . 1 . . 265 . A 29 DT H72 . 34615 1 188 . 1 . 1 29 29 DT H73 H 1 1.854 0.003 . 1 . . 265 . A 29 DT H73 . 34615 1 189 . 1 . 1 29 29 DT C6 C 13 139.780 . . 1 . . 266 . A 29 DT C6 . 34615 1 190 . 1 . 1 30 30 DA H1' H 1 5.660 0.001 . 1 . . 301 . A 30 DA H1' . 34615 1 191 . 1 . 1 30 30 DA H2 H 1 7.276 0.001 . 1 . . 229 . A 30 DA H2 . 34615 1 192 . 1 . 1 30 30 DA H2' H 1 3.235 . . 1 . . 305 . A 30 DA H2' . 34615 1 193 . 1 . 1 30 30 DA H2'' H 1 3.235 . . 1 . . 306 . A 30 DA H2'' . 34615 1 194 . 1 . 1 30 30 DA H3' H 1 4.649 0.001 . 1 . . 344 . A 30 DA H3' . 34615 1 195 . 1 . 1 30 30 DA H8 H 1 7.770 0.001 . 1 . . 262 . A 30 DA H8 . 34615 1 196 . 1 . 1 30 30 DA C2 C 13 154.462 . . 1 . . 271 . A 30 DA C2 . 34615 1 197 . 1 . 1 30 30 DA C8 C 13 141.630 . . 1 . . 267 . A 30 DA C8 . 34615 1 198 . 1 . 1 31 31 DA H1' H 1 6.204 0.001 . 1 . . 272 . A 31 DA H1' . 34615 1 199 . 1 . 1 31 31 DA H2' H 1 2.597 0.002 . 2 . . 273 . A 31 DA H2' . 34615 1 200 . 1 . 1 31 31 DA H2'' H 1 2.888 0.0 . 2 . . 274 . A 31 DA H2'' . 34615 1 201 . 1 . 1 31 31 DA H3' H 1 4.601 . . 1 . . 345 . A 31 DA H3' . 34615 1 202 . 1 . 1 31 31 DA H8 H 1 8.001 0.001 . 1 . . 269 . A 31 DA H8 . 34615 1 203 . 1 . 1 31 31 DA C8 C 13 141.059 . . 1 . . 270 . A 31 DA C8 . 34615 1 stop_ save_