################################### # 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 34403 _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 2 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_2 _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' . . . 34403 1 2 '2D 1H-1H NOESY' . . . 34403 1 3 '2D 1H-13C HSQC aromatic' . . . 34403 1 4 '2D 1H-13C HSQC aromatic' . . . 34403 1 5 '2D DQF-COSY' . . . 34403 1 6 '2D 1H-13C HMBC' . . . 34403 1 7 '2D 1H-13C HMBC' . . . 34403 1 8 '2D 1H-1H NOESY' . . . 34403 1 9 '1D 1H-15N HMBC' . . . 34403 1 10 '1D 1H-15N HMBC' . . . 34403 1 11 '1D 1H-15N HMBC' . . . 34403 1 12 '1D 1H-15N HMBC' . . . 34403 1 13 '1D 1H-15N HMBC' . . . 34403 1 14 '1D 1H-15N HMBC' . . . 34403 1 15 '1D 1H-15N HMBC' . . . 34403 1 16 '1D 1H-15N HMBC' . . . 34403 1 17 '1D 1H-15N HMBC' . . . 34403 1 18 '1D 1H-15N HMBC' . . . 34403 1 19 '1D 1H-15N HMBC' . . . 34403 1 20 '1D 1H-15N HMBC' . . . 34403 1 21 '1D 1H-15N HMBC' . . . 34403 1 22 '1D 1H-15N HMBC' . . . 34403 1 23 '1D 1H-15N HMBC' . . . 34403 1 24 '1D 1H-15N HMBC' . . . 34403 1 25 '2D 1H-13C HSQC aromatic' . . . 34403 1 26 '2D 1H-13C HSQC aromatic' . . . 34403 1 27 '2D 1H-13C HSQC aromatic' . . . 34403 1 28 '2D 1H-13C HSQC aromatic' . . . 34403 1 29 '2D DQF-COSY' . . . 34403 1 30 '2D DQF-COSY' . . . 34403 1 31 '2D DQF-COSY' . . . 34403 1 32 '2D DQF-COSY' . . . 34403 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 DG H1 H 1 11.775 0.003 . 1 . . 152 . A 1 DG H1 . 34403 1 2 . 1 . 1 1 1 DG H1' H 1 5.788 0.002 . 1 . . 7 . A 1 DG H1' . 34403 1 3 . 1 . 1 1 1 DG H2' H 1 2.508 0.001 . 1 . . 8 . A 1 DG H2' . 34403 1 4 . 1 . 1 1 1 DG H2'' H 1 2.649 0.006 . 1 . . 9 . A 1 DG H2'' . 34403 1 5 . 1 . 1 1 1 DG H3' H 1 4.905 0.003 . 1 . . 67 . A 1 DG H3' . 34403 1 6 . 1 . 1 1 1 DG H8 H 1 7.244 0.003 . 1 . . 6 . A 1 DG H8 . 34403 1 7 . 1 . 1 1 1 DG C8 C 13 140.950 . . 1 . . 85 . A 1 DG C8 . 34403 1 8 . 1 . 1 2 2 DG H1 H 1 11.682 0.003 . 1 . . 154 . A 2 DG H1 . 34403 1 9 . 1 . 1 2 2 DG H1' H 1 5.867 0.003 . 1 . . 11 . A 2 DG H1' . 34403 1 10 . 1 . 1 2 2 DG H2' H 1 2.424 0.003 . 1 . . 12 . A 2 DG H2' . 34403 1 11 . 1 . 1 2 2 DG H2'' H 1 2.573 0.003 . 1 . . 13 . A 2 DG H2'' . 34403 1 12 . 1 . 1 2 2 DG H3' H 1 4.989 0.005 . 1 . . 68 . A 2 DG H3' . 34403 1 13 . 1 . 1 2 2 DG H8 H 1 7.508 0.004 . 1 . . 10 . A 2 DG H8 . 34403 1 14 . 1 . 1 2 2 DG C8 C 13 137.352 . . 1 . . 92 . A 2 DG C8 . 34403 1 15 . 1 . 1 3 3 DG H1' H 1 5.868 0.005 . 1 . . 16 . A 3 DG H1' . 34403 1 16 . 1 . 1 3 3 DG H2' H 1 2.571 0.001 . 2 . . 17 . A 3 DG H2' . 34403 1 17 . 1 . 1 3 3 DG H2'' H 1 2.510 0.001 . 2 . . 18 . A 3 DG H2'' . 34403 1 18 . 1 . 1 3 3 DG H3' H 1 4.831 0.004 . 1 . . 69 . A 3 DG H3' . 34403 1 19 . 1 . 1 3 3 DG H8 H 1 7.931 0.004 . 1 . . 14 . A 3 DG H8 . 34403 1 20 . 1 . 1 3 3 DG C8 C 13 139.519 . . 1 . . 96 . A 3 DG C8 . 34403 1 21 . 1 . 1 4 4 DA H1' H 1 6.034 0.002 . 1 . . 19 . A 4 DA H1' . 34403 1 22 . 1 . 1 4 4 DA H2 H 1 7.815 0.003 . 1 . . 103 . A 4 DA H2 . 34403 1 23 . 1 . 1 4 4 DA H2' H 1 2.368 0.001 . 1 . . 21 . A 4 DA H2' . 34403 1 24 . 1 . 1 4 4 DA H2'' H 1 2.407 0.003 . 1 . . 20 . A 4 DA H2'' . 34403 1 25 . 1 . 1 4 4 DA H3' H 1 4.751 0.001 . 1 . . 70 . A 4 DA H3' . 34403 1 26 . 1 . 1 4 4 DA H8 H 1 7.986 0.003 . 1 . . 15 . A 4 DA H8 . 34403 1 27 . 1 . 1 4 4 DA C2 C 13 155.113 . . 1 . . 104 . A 4 DA C2 . 34403 1 28 . 1 . 1 4 4 DA C8 C 13 141.796 . . 1 . . 99 . A 4 DA C8 . 34403 1 29 . 1 . 1 5 5 DT H1' H 1 5.863 0.003 . 1 . . 3 . A 5 DT H1' . 34403 1 30 . 1 . 1 5 5 DT H2' H 1 1.903 0.0 . 1 . . 4 . A 5 DT H2' . 34403 1 31 . 1 . 1 5 5 DT H2'' H 1 2.309 0.0 . 1 . . 5 . A 5 DT H2'' . 34403 1 32 . 1 . 1 5 5 DT H6 H 1 7.246 0.003 . 1 . . 1 . A 5 DT H6 . 34403 1 33 . 1 . 1 5 5 DT H71 H 1 1.532 0.003 . 1 . . 2 . A 5 DT H71 . 34403 1 34 . 1 . 1 5 5 DT H72 H 1 1.532 0.003 . 1 . . 2 . A 5 DT H72 . 34403 1 35 . 1 . 1 5 5 DT H73 H 1 1.532 0.003 . 1 . . 2 . A 5 DT H73 . 34403 1 36 . 1 . 1 5 5 DT C6 C 13 139.184 . . 1 . . 87 . A 5 DT C6 . 34403 1 37 . 1 . 1 6 6 DG H1 H 1 11.617 0.002 . 1 . . 153 . A 6 DG H1 . 34403 1 38 . 1 . 1 6 6 DG H1' H 1 5.970 0.002 . 1 . . 23 . A 6 DG H1' . 34403 1 39 . 1 . 1 6 6 DG H2' H 1 3.432 0.004 . 1 . . 25 . A 6 DG H2' . 34403 1 40 . 1 . 1 6 6 DG H2'' H 1 2.893 0.002 . 1 . . 24 . A 6 DG H2'' . 34403 1 41 . 1 . 1 6 6 DG H3' H 1 4.859 0.003 . 1 . . 71 . A 6 DG H3' . 34403 1 42 . 1 . 1 6 6 DG H8 H 1 7.298 0.001 . 1 . . 22 . A 6 DG H8 . 34403 1 43 . 1 . 1 6 6 DG C8 C 13 142.096 . . 1 . . 88 . A 6 DG C8 . 34403 1 44 . 1 . 1 7 7 DG H1 H 1 11.772 0.005 . 1 . . 162 . A 7 DG H1 . 34403 1 45 . 1 . 1 7 7 DG H1' H 1 5.939 0.001 . 1 . . 27 . A 7 DG H1' . 34403 1 46 . 1 . 1 7 7 DG H2' H 1 2.614 0.004 . 1 . . 29 . A 7 DG H2' . 34403 1 47 . 1 . 1 7 7 DG H2'' H 1 2.835 0.001 . 1 . . 28 . A 7 DG H2'' . 34403 1 48 . 1 . 1 7 7 DG H3' H 1 5.037 0.003 . 1 . . 72 . A 7 DG H3' . 34403 1 49 . 1 . 1 7 7 DG H8 H 1 8.023 0.003 . 1 . . 26 . A 7 DG H8 . 34403 1 50 . 1 . 1 7 7 DG C8 C 13 138.492 . . 1 . . 97 . A 7 DG C8 . 34403 1 51 . 1 . 1 8 8 DG H1 H 1 11.333 0.002 . 1 . . 156 . A 8 DG H1 . 34403 1 52 . 1 . 1 8 8 DG H1' H 1 5.973 0.006 . 1 . . 33 . A 8 DG H1' . 34403 1 53 . 1 . 1 8 8 DG H2' H 1 2.058 0.002 . 1 . . 32 . A 8 DG H2' . 34403 1 54 . 1 . 1 8 8 DG H2'' H 1 2.467 0.002 . 1 . . 31 . A 8 DG H2'' . 34403 1 55 . 1 . 1 8 8 DG H3' H 1 4.901 0.002 . 1 . . 73 . A 8 DG H3' . 34403 1 56 . 1 . 1 8 8 DG H8 H 1 7.444 0.002 . 1 . . 30 . A 8 DG H8 . 34403 1 57 . 1 . 1 8 8 DG C8 C 13 137.614 . . 1 . . 91 . A 8 DG C8 . 34403 1 58 . 1 . 1 9 9 DA H1' H 1 6.188 0.004 . 1 . . 147 . A 9 DA H1' . 34403 1 59 . 1 . 1 9 9 DA H2' H 1 2.718 0.002 . 2 . . 148 . A 9 DA H2' . 34403 1 60 . 1 . 1 9 9 DA H2'' H 1 2.469 . . 2 . . 378 . A 9 DA H2'' . 34403 1 61 . 1 . 1 9 9 DA H3' H 1 4.969 0.003 . 1 . . 150 . A 9 DA H3' . 34403 1 62 . 1 . 1 9 9 DA H8 H 1 8.155 0.002 . 1 . . 34 . A 9 DA H8 . 34403 1 63 . 1 . 1 10 10 DC H1' H 1 6.078 0.006 . 1 . . 137 . A 10 DC H1' . 34403 1 64 . 1 . 1 10 10 DC H2' H 1 1.870 0.001 . 1 . . 138 . A 10 DC H2' . 34403 1 65 . 1 . 1 10 10 DC H2'' H 1 2.245 0.0 . 1 . . 139 . A 10 DC H2'' . 34403 1 66 . 1 . 1 10 10 DC H3' H 1 4.894 0.003 . 1 . . 376 . A 10 DC H3' . 34403 1 67 . 1 . 1 10 10 DC H5 H 1 5.993 . . 1 . . 136 . A 10 DC H5 . 34403 1 68 . 1 . 1 10 10 DC H6 H 1 7.669 0.002 . 1 . . 135 . A 10 DC H6 . 34403 1 69 . 1 . 1 10 10 DC C6 C 13 143.805 . . 1 . . 375 . A 10 DC C6 . 34403 1 70 . 1 . 1 12 12 DC H1' H 1 5.725 0.007 . 1 . . 132 . A 12 DC H1' . 34403 1 71 . 1 . 1 12 12 DC H2' H 1 1.871 0.006 . 1 . . 133 . A 12 DC H2' . 34403 1 72 . 1 . 1 12 12 DC H2'' H 1 2.137 0.005 . 1 . . 134 . A 12 DC H2'' . 34403 1 73 . 1 . 1 12 12 DC H3' H 1 4.526 . . 1 . . 377 . A 12 DC H3' . 34403 1 74 . 1 . 1 12 12 DC H5 H 1 5.667 . . 1 . . 131 . A 12 DC H5 . 34403 1 75 . 1 . 1 12 12 DC H6 H 1 7.428 0.002 . 1 . . 130 . A 12 DC H6 . 34403 1 76 . 1 . 1 12 12 DC C6 C 13 143.671 . . 1 . . 463 . A 12 DC C6 . 34403 1 77 . 1 . 1 13 13 DA H1' H 1 5.854 0.003 . 1 . . 140 . A 13 DA H1' . 34403 1 78 . 1 . 1 13 13 DA H2 H 1 7.564 0.006 . 1 . . 374 . A 13 DA H2 . 34403 1 79 . 1 . 1 13 13 DA H2' H 1 2.172 . . 2 . . 141 . A 13 DA H2' . 34403 1 80 . 1 . 1 13 13 DA H2'' H 1 2.407 0.005 . 2 . . 142 . A 13 DA H2'' . 34403 1 81 . 1 . 1 13 13 DA H3' H 1 4.808 . . 1 . . 145 . A 13 DA H3' . 34403 1 82 . 1 . 1 13 13 DA H8 H 1 7.892 0.002 . 1 . . 101 . A 13 DA H8 . 34403 1 83 . 1 . 1 13 13 DA C8 C 13 141.602 . . 1 . . 102 . A 13 DA C8 . 34403 1 84 . 1 . 1 14 14 GF2 H1' H 1 6.054 0.003 . 1 . . 65 . A 14 GF2 H1' . 34403 1 85 . 1 . 1 14 14 GF2 H2' H 1 5.381 0.004 . 1 . . 66 . A 14 GF2 H2' . 34403 1 86 . 1 . 1 14 14 GF2 H3' H 1 6.091 . . 1 . . 380 . A 14 GF2 H3' . 34403 1 87 . 1 . 1 14 14 GF2 H4' H 1 4.385 0.0 . 1 . . 461 . A 14 GF2 H4' . 34403 1 88 . 1 . 1 14 14 GF2 H8 H 1 7.246 0.003 . 1 . . 64 . A 14 GF2 H8 . 34403 1 89 . 1 . 1 14 14 GF2 C8 C 13 140.330 . . 1 . . 86 . A 14 GF2 C8 . 34403 1 90 . 1 . 1 14 14 GF2 F F 19 -117.671 0.003 . 1 . . 459 . A 14 GF2 F . 34403 1 91 . 1 . 1 14 14 GF2 HN1 H 1 10.841 0.007 . 1 . . 161 . A 14 GF2 HN1 . 34403 1 92 . 1 . 1 15 15 GF2 H1' H 1 6.045 0.007 . 1 . . 37 . A 15 GF2 H1' . 34403 1 93 . 1 . 1 15 15 GF2 H2' H 1 5.849 0.003 . 1 . . 36 . A 15 GF2 H2' . 34403 1 94 . 1 . 1 15 15 GF2 H3' H 1 4.821 0.004 . 1 . . 75 . A 15 GF2 H3' . 34403 1 95 . 1 . 1 15 15 GF2 H4' H 1 4.380 0.002 . 1 . . 326 . A 15 GF2 H4' . 34403 1 96 . 1 . 1 15 15 GF2 H8 H 1 7.347 0.003 . 1 . . 35 . A 15 GF2 H8 . 34403 1 97 . 1 . 1 15 15 GF2 C8 C 13 136.447 . . 1 . . 90 . A 15 GF2 C8 . 34403 1 98 . 1 . 1 15 15 GF2 F F 19 -117.436 0.007 . 1 . . 458 . A 15 GF2 F . 34403 1 99 . 1 . 1 15 15 GF2 HN1 H 1 11.346 0.002 . 1 . . 155 . A 15 GF2 HN1 . 34403 1 100 . 1 . 1 16 16 DG H1 H 1 11.637 0.004 . 1 . . 159 . A 16 DG H1 . 34403 1 101 . 1 . 1 16 16 DG H1' H 1 6.065 0.004 . 1 . . 39 . A 16 DG H1' . 34403 1 102 . 1 . 1 16 16 DG H2' H 1 2.917 0.002 . 1 . . 40 . A 16 DG H2' . 34403 1 103 . 1 . 1 16 16 DG H2'' H 1 2.495 0.003 . 1 . . 41 . A 16 DG H2'' . 34403 1 104 . 1 . 1 16 16 DG H3' H 1 4.783 0.002 . 1 . . 76 . A 16 DG H3' . 34403 1 105 . 1 . 1 16 16 DG H8 H 1 7.682 0.002 . 1 . . 38 . A 16 DG H8 . 34403 1 106 . 1 . 1 16 16 DG C8 C 13 138.478 . . 1 . . 379 . A 16 DG C8 . 34403 1 107 . 1 . 1 17 17 DG H1 H 1 11.108 0.004 . 1 . . 158 . A 17 DG H1 . 34403 1 108 . 1 . 1 17 17 DG H1' H 1 6.365 0.002 . 1 . . 43 . A 17 DG H1' . 34403 1 109 . 1 . 1 17 17 DG H2' H 1 2.622 0.0 . 2 . . 44 . A 17 DG H2' . 34403 1 110 . 1 . 1 17 17 DG H2'' H 1 2.621 0.002 . 2 . . 45 . A 17 DG H2'' . 34403 1 111 . 1 . 1 17 17 DG H3' H 1 5.041 0.003 . 1 . . 77 . A 17 DG H3' . 34403 1 112 . 1 . 1 17 17 DG H8 H 1 7.831 0.003 . 1 . . 42 . A 17 DG H8 . 34403 1 113 . 1 . 1 17 17 DG C8 C 13 138.158 . . 1 . . 95 . A 17 DG C8 . 34403 1 114 . 1 . 1 18 18 DA H1' H 1 6.540 0.004 . 1 . . 47 . A 18 DA H1' . 34403 1 115 . 1 . 1 18 18 DA H2 H 1 8.307 0.001 . 1 . . 50 . A 18 DA H2 . 34403 1 116 . 1 . 1 18 18 DA H2' H 1 3.044 0.01 . 1 . . 49 . A 18 DA H2' . 34403 1 117 . 1 . 1 18 18 DA H2'' H 1 2.880 0.002 . 1 . . 48 . A 18 DA H2'' . 34403 1 118 . 1 . 1 18 18 DA H3' H 1 5.014 0.0 . 1 . . 82 . A 18 DA H3' . 34403 1 119 . 1 . 1 18 18 DA H8 H 1 8.533 0.001 . 1 . . 46 . A 18 DA H8 . 34403 1 120 . 1 . 1 18 18 DA C2 C 13 155.549 . . 1 . . 143 . A 18 DA C2 . 34403 1 121 . 1 . 1 18 18 DA C8 C 13 143.135 . . 1 . . 100 . A 18 DA C8 . 34403 1 122 . 1 . 1 19 19 DC H1' H 1 6.375 0.002 . 1 . . 80 . A 19 DC H1' . 34403 1 123 . 1 . 1 19 19 DC H2' H 1 2.458 0.002 . 2 . . 372 . A 19 DC H2' . 34403 1 124 . 1 . 1 19 19 DC H2'' H 1 2.648 0.001 . 2 . . 373 . A 19 DC H2'' . 34403 1 125 . 1 . 1 19 19 DC H3' H 1 4.931 0.003 . 1 . . 81 . A 19 DC H3' . 34403 1 126 . 1 . 1 19 19 DC H5 H 1 6.070 0.006 . 1 . . 79 . A 19 DC H5 . 34403 1 127 . 1 . 1 19 19 DC H6 H 1 7.927 0.002 . 1 . . 78 . A 19 DC H6 . 34403 1 128 . 1 . 1 19 19 DC C6 C 13 145.104 . . 1 . . 462 . A 19 DC C6 . 34403 1 129 . 1 . 1 20 20 DG H1 H 1 11.828 0.002 . 1 . . 157 . A 20 DG H1 . 34403 1 130 . 1 . 1 20 20 DG H1' H 1 5.989 0.004 . 1 . . 52 . A 20 DG H1' . 34403 1 131 . 1 . 1 20 20 DG H2' H 1 3.065 0.006 . 1 . . 54 . A 20 DG H2' . 34403 1 132 . 1 . 1 20 20 DG H2'' H 1 3.018 0.003 . 1 . . 53 . A 20 DG H2'' . 34403 1 133 . 1 . 1 20 20 DG H3' H 1 4.977 0.001 . 1 . . 74 . A 20 DG H3' . 34403 1 134 . 1 . 1 20 20 DG H8 H 1 7.350 0.002 . 1 . . 51 . A 20 DG H8 . 34403 1 135 . 1 . 1 20 20 DG C8 C 13 142.022 . . 1 . . 89 . A 20 DG C8 . 34403 1 136 . 1 . 1 21 21 DG H1 H 1 11.627 0.004 . 1 . . 160 . A 21 DG H1 . 34403 1 137 . 1 . 1 21 21 DG H1' H 1 6.053 0.003 . 1 . . 144 . A 21 DG H1' . 34403 1 138 . 1 . 1 21 21 DG H2' H 1 2.798 0.002 . 1 . . 62 . A 21 DG H2' . 34403 1 139 . 1 . 1 21 21 DG H2'' H 1 2.852 0.005 . 1 . . 63 . A 21 DG H2'' . 34403 1 140 . 1 . 1 21 21 DG H3' H 1 5.098 0.001 . 1 . . 84 . A 21 DG H3' . 34403 1 141 . 1 . 1 21 21 DG H8 H 1 8.148 0.003 . 1 . . 55 . A 21 DG H8 . 34403 1 142 . 1 . 1 21 21 DG C8 C 13 138.928 . . 1 . . 98 . A 21 DG C8 . 34403 1 143 . 1 . 1 22 22 DG H1 H 1 11.407 0.008 . 1 . . 163 . A 22 DG H1 . 34403 1 144 . 1 . 1 22 22 DG H1' H 1 6.432 0.001 . 1 . . 58 . A 22 DG H1' . 34403 1 145 . 1 . 1 22 22 DG H2' H 1 2.612 0.005 . 1 . . 59 . A 22 DG H2' . 34403 1 146 . 1 . 1 22 22 DG H2'' H 1 2.527 0.003 . 1 . . 60 . A 22 DG H2'' . 34403 1 147 . 1 . 1 22 22 DG H3' H 1 4.731 0.003 . 1 . . 83 . A 22 DG H3' . 34403 1 148 . 1 . 1 22 22 DG H8 H 1 7.777 0.002 . 1 . . 56 . A 22 DG H8 . 34403 1 149 . 1 . 1 22 22 DG C8 C 13 138.043 . . 1 . . 94 . A 22 DG C8 . 34403 1 stop_ save_