################################### # 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_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 19278 _Assigned_chem_shift_list.ID 1 _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 $chemical_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' . . . 19278 1 2 '2D 1H-1H JR NOESY' . . . 19278 1 10 15N-FILTERED . . . 19278 1 11 D-LABELED . . . 19278 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_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.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 11.758 0.010 . 1 . . . A 1 DG H1 . 19278 1 2 . 1 1 1 1 DG H1' H 1 4.538 0.010 . 1 . . . A 1 DG H1' . 19278 1 3 . 1 1 1 1 DG H2' H 1 2.220 0.010 . 1 . . . A 1 DG H2' . 19278 1 4 . 1 1 1 1 DG H2'' H 1 2.467 0.010 . 1 . . . A 1 DG H2'' . 19278 1 5 . 1 1 1 1 DG H3' H 1 4.801 0.010 . 1 . . . A 1 DG H3' . 19278 1 6 . 1 1 1 1 DG H4' H 1 4.452 0.010 . 1 . . . A 1 DG H4' . 19278 1 7 . 1 1 1 1 DG H5' H 1 4.483 0.010 . 2 . . . A 1 DG H5' . 19278 1 8 . 1 1 1 1 DG H5'' H 1 3.867 0.010 . 2 . . . A 1 DG H5'' . 19278 1 9 . 1 1 1 1 DG H8 H 1 6.234 0.010 . 1 . . . A 1 DG H8 . 19278 1 10 . 1 1 2 2 DC H1' H 1 5.588 0.010 . 1 . . . A 2 DC H1' . 19278 1 11 . 1 1 2 2 DC H2' H 1 1.676 0.010 . 1 . . . A 2 DC H2' . 19278 1 12 . 1 1 2 2 DC H2'' H 1 2.283 0.010 . 1 . . . A 2 DC H2'' . 19278 1 13 . 1 1 2 2 DC H3' H 1 4.735 0.010 . 1 . . . A 2 DC H3' . 19278 1 14 . 1 1 2 2 DC H4' H 1 3.476 0.010 . 1 . . . A 2 DC H4' . 19278 1 15 . 1 1 2 2 DC H5 H 1 5.206 0.010 . 1 . . . A 2 DC H5 . 19278 1 16 . 1 1 2 2 DC H5' H 1 4.024 0.010 . 2 . . . A 2 DC H5' . 19278 1 17 . 1 1 2 2 DC H5'' H 1 3.208 0.010 . 2 . . . A 2 DC H5'' . 19278 1 18 . 1 1 2 2 DC H6 H 1 6.962 0.010 . 1 . . . A 2 DC H6 . 19278 1 19 . 1 1 2 2 DC H41 H 1 8.444 0.010 . 1 . . . A 2 DC H41 . 19278 1 20 . 1 1 2 2 DC H42 H 1 6.395 0.010 . 1 . . . A 2 DC H42 . 19278 1 21 . 1 1 3 3 DG H1 H 1 12.867 0.010 . 1 . . . A 3 DG H1 . 19278 1 22 . 1 1 3 3 DG H1' H 1 5.868 0.010 . 1 . . . A 3 DG H1' . 19278 1 23 . 1 1 3 3 DG H2' H 1 2.647 0.010 . 1 . . . A 3 DG H2' . 19278 1 24 . 1 1 3 3 DG H2'' H 1 2.717 0.010 . 1 . . . A 3 DG H2'' . 19278 1 25 . 1 1 3 3 DG H3' H 1 4.994 0.010 . 1 . . . A 3 DG H3' . 19278 1 26 . 1 1 3 3 DG H4' H 1 4.419 0.010 . 1 . . . A 3 DG H4' . 19278 1 27 . 1 1 3 3 DG H8 H 1 7.882 0.010 . 1 . . . A 3 DG H8 . 19278 1 28 . 1 1 4 4 DC H1' H 1 5.608 0.010 . 1 . . . A 4 DC H1' . 19278 1 29 . 1 1 4 4 DC H2' H 1 1.836 0.010 . 1 . . . A 4 DC H2' . 19278 1 30 . 1 1 4 4 DC H2'' H 1 2.273 0.010 . 1 . . . A 4 DC H2'' . 19278 1 31 . 1 1 4 4 DC H3' H 1 4.805 0.010 . 1 . . . A 4 DC H3' . 19278 1 32 . 1 1 4 4 DC H4' H 1 4.119 0.010 . 1 . . . A 4 DC H4' . 19278 1 33 . 1 1 4 4 DC H5 H 1 5.347 0.010 . 1 . . . A 4 DC H5 . 19278 1 34 . 1 1 4 4 DC H6 H 1 7.236 0.010 . 1 . . . A 4 DC H6 . 19278 1 35 . 1 1 4 4 DC H41 H 1 8.239 0.010 . 1 . . . A 4 DC H41 . 19278 1 36 . 1 1 4 4 DC H42 H 1 6.341 0.010 . 1 . . . A 4 DC H42 . 19278 1 37 . 1 1 5 5 DG H1 H 1 12.733 0.010 . 1 . . . A 5 DG H1 . 19278 1 38 . 1 1 5 5 DG H1' H 1 5.373 0.010 . 1 . . . A 5 DG H1' . 19278 1 39 . 1 1 5 5 DG H2' H 1 2.605 0.010 . 1 . . . A 5 DG H2' . 19278 1 40 . 1 1 5 5 DG H2'' H 1 2.685 0.010 . 1 . . . A 5 DG H2'' . 19278 1 41 . 1 1 5 5 DG H3' H 1 4.952 0.010 . 1 . . . A 5 DG H3' . 19278 1 42 . 1 1 5 5 DG H4' H 1 4.257 0.010 . 1 . . . A 5 DG H4' . 19278 1 43 . 1 1 5 5 DG H8 H 1 7.834 0.010 . 1 . . . A 5 DG H8 . 19278 1 44 . 1 1 6 6 DA H1' H 1 5.881 0.010 . 1 . . . A 6 DA H1' . 19278 1 45 . 1 1 6 6 DA H2 H 1 7.568 0.010 . 1 . . . A 6 DA H2 . 19278 1 46 . 1 1 6 6 DA H2' H 1 2.287 0.010 . 1 . . . A 6 DA H2' . 19278 1 47 . 1 1 6 6 DA H2'' H 1 2.601 0.010 . 1 . . . A 6 DA H2'' . 19278 1 48 . 1 1 6 6 DA H3' H 1 4.955 0.010 . 1 . . . A 6 DA H3' . 19278 1 49 . 1 1 6 6 DA H4' H 1 4.286 0.010 . 1 . . . A 6 DA H4' . 19278 1 50 . 1 1 6 6 DA H8 H 1 7.897 0.010 . 1 . . . A 6 DA H8 . 19278 1 51 . 1 1 7 7 DA H1' H 1 5.887 0.010 . 1 . . . A 7 DA H1' . 19278 1 52 . 1 1 7 7 DA H2 H 1 7.693 0.010 . 1 . . . A 7 DA H2 . 19278 1 53 . 1 1 7 7 DA H2' H 1 2.057 0.010 . 1 . . . A 7 DA H2' . 19278 1 54 . 1 1 7 7 DA H2'' H 1 2.432 0.010 . 1 . . . A 7 DA H2'' . 19278 1 55 . 1 1 7 7 DA H3' H 1 4.878 0.010 . 1 . . . A 7 DA H3' . 19278 1 56 . 1 1 7 7 DA H4' H 1 4.341 0.010 . 1 . . . A 7 DA H4' . 19278 1 57 . 1 1 7 7 DA H8 H 1 7.450 0.010 . 1 . . . A 7 DA H8 . 19278 1 58 . 1 1 8 8 DG H1' H 1 5.400 0.010 . 1 . . . A 8 DG H1' . 19278 1 59 . 1 1 8 8 DG H2' H 1 2.628 0.010 . 1 . . . A 8 DG H2' . 19278 1 60 . 1 1 8 8 DG H2'' H 1 2.350 0.010 . 1 . . . A 8 DG H2'' . 19278 1 61 . 1 1 8 8 DG H3' H 1 4.809 0.010 . 1 . . . A 8 DG H3' . 19278 1 62 . 1 1 8 8 DG H4' H 1 4.369 0.010 . 1 . . . A 8 DG H4' . 19278 1 63 . 1 1 8 8 DG H8 H 1 8.032 0.010 . 1 . . . A 8 DG H8 . 19278 1 64 . 1 1 9 9 DC H1' H 1 5.708 0.010 . 1 . . . A 9 DC H1' . 19278 1 65 . 1 1 9 9 DC H2' H 1 1.598 0.010 . 1 . . . A 9 DC H2' . 19278 1 66 . 1 1 9 9 DC H2'' H 1 2.049 0.010 . 1 . . . A 9 DC H2'' . 19278 1 67 . 1 1 9 9 DC H3' H 1 4.413 0.010 . 1 . . . A 9 DC H3' . 19278 1 68 . 1 1 9 9 DC H4' H 1 2.122 0.010 . 1 . . . A 9 DC H4' . 19278 1 69 . 1 1 9 9 DC H5 H 1 5.211 0.010 . 1 . . . A 9 DC H5 . 19278 1 70 . 1 1 9 9 DC H5' H 1 3.353 0.010 . 2 . . . A 9 DC H5' . 19278 1 71 . 1 1 9 9 DC H5'' H 1 3.048 0.010 . 2 . . . A 9 DC H5'' . 19278 1 72 . 1 1 9 9 DC H6 H 1 7.193 0.010 . 1 . . . A 9 DC H6 . 19278 1 73 . 1 1 10 10 DA H1' H 1 6.314 0.010 . 1 . . . A 10 DA H1' . 19278 1 74 . 1 1 10 10 DA H2 H 1 8.037 0.010 . 1 . . . A 10 DA H2 . 19278 1 75 . 1 1 10 10 DA H2' H 1 2.994 0.010 . 1 . . . A 10 DA H2' . 19278 1 76 . 1 1 10 10 DA H2'' H 1 2.946 0.010 . 1 . . . A 10 DA H2'' . 19278 1 77 . 1 1 10 10 DA H3' H 1 4.817 0.010 . 1 . . . A 10 DA H3' . 19278 1 78 . 1 1 10 10 DA H4' H 1 4.333 0.010 . 1 . . . A 10 DA H4' . 19278 1 79 . 1 1 10 10 DA H5' H 1 3.977 0.010 . 2 . . . A 10 DA H5' . 19278 1 80 . 1 1 10 10 DA H5'' H 1 3.836 0.010 . 2 . . . A 10 DA H5'' . 19278 1 81 . 1 1 10 10 DA H8 H 1 8.076 0.010 . 1 . . . A 10 DA H8 . 19278 1 82 . 1 1 11 11 DT H1' H 1 5.680 0.010 . 1 . . . A 11 DT H1' . 19278 1 83 . 1 1 11 11 DT H2' H 1 2.092 0.010 . 1 . . . A 11 DT H2' . 19278 1 84 . 1 1 11 11 DT H2'' H 1 2.493 0.010 . 1 . . . A 11 DT H2'' . 19278 1 85 . 1 1 11 11 DT H3 H 1 13.295 0.010 . 1 . . . A 11 DT H3 . 19278 1 86 . 1 1 11 11 DT H3' H 1 4.741 0.010 . 1 . . . A 11 DT H3' . 19278 1 87 . 1 1 11 11 DT H4' H 1 4.284 0.010 . 1 . . . A 11 DT H4' . 19278 1 88 . 1 1 11 11 DT H5' H 1 4.330 0.010 . 2 . . . A 11 DT H5' . 19278 1 89 . 1 1 11 11 DT H5'' H 1 4.083 0.010 . 2 . . . A 11 DT H5'' . 19278 1 90 . 1 1 11 11 DT H6 H 1 7.389 0.010 . 1 . . . A 11 DT H6 . 19278 1 91 . 1 1 11 11 DT H71 H 1 1.830 0.010 . 2 . . . A 11 DT H71 . 19278 1 92 . 1 1 11 11 DT H72 H 1 1.830 0.010 . 2 . . . A 11 DT H72 . 19278 1 93 . 1 1 11 11 DT H73 H 1 1.830 0.010 . 2 . . . A 11 DT H73 . 19278 1 94 . 1 1 12 12 DT H1' H 1 6.026 0.010 . 1 . . . A 12 DT H1' . 19278 1 95 . 1 1 12 12 DT H2' H 1 2.159 0.010 . 1 . . . A 12 DT H2' . 19278 1 96 . 1 1 12 12 DT H2'' H 1 2.449 0.010 . 1 . . . A 12 DT H2'' . 19278 1 97 . 1 1 12 12 DT H3 H 1 13.872 0.010 . 1 . . . A 12 DT H3 . 19278 1 98 . 1 1 12 12 DT H3' H 1 4.842 0.010 . 1 . . . A 12 DT H3' . 19278 1 99 . 1 1 12 12 DT H4' H 1 4.206 0.010 . 1 . . . A 12 DT H4' . 19278 1 100 . 1 1 12 12 DT H6 H 1 7.399 0.010 . 1 . . . A 12 DT H6 . 19278 1 101 . 1 1 12 12 DT H71 H 1 1.612 0.010 . 2 . . . A 12 DT H71 . 19278 1 102 . 1 1 12 12 DT H72 H 1 1.612 0.010 . 2 . . . A 12 DT H72 . 19278 1 103 . 1 1 12 12 DT H73 H 1 1.612 0.010 . 2 . . . A 12 DT H73 . 19278 1 104 . 1 1 13 13 DC H1' H 1 5.558 0.010 . 1 . . . A 13 DC H1' . 19278 1 105 . 1 1 13 13 DC H2' H 1 2.003 0.010 . 1 . . . A 13 DC H2' . 19278 1 106 . 1 1 13 13 DC H2'' H 1 2.306 0.010 . 1 . . . A 13 DC H2'' . 19278 1 107 . 1 1 13 13 DC H3' H 1 4.778 0.010 . 1 . . . A 13 DC H3' . 19278 1 108 . 1 1 13 13 DC H4' H 1 4.100 0.010 . 1 . . . A 13 DC H4' . 19278 1 109 . 1 1 13 13 DC H5 H 1 5.626 0.010 . 1 . . . A 13 DC H5 . 19278 1 110 . 1 1 13 13 DC H6 H 1 7.439 0.010 . 1 . . . A 13 DC H6 . 19278 1 111 . 1 1 13 13 DC H41 H 1 8.483 0.010 . 1 . . . A 13 DC H41 . 19278 1 112 . 1 1 13 13 DC H42 H 1 6.850 0.010 . 1 . . . A 13 DC H42 . 19278 1 113 . 1 1 14 14 DG H1 H 1 12.817 0.010 . 1 . . . A 14 DG H1 . 19278 1 114 . 1 1 14 14 DG H1' H 1 5.711 0.010 . 1 . . . A 14 DG H1' . 19278 1 115 . 1 1 14 14 DG H2' H 1 2.447 0.010 . 1 . . . A 14 DG H2' . 19278 1 116 . 1 1 14 14 DG H2'' H 1 2.524 0.010 . 1 . . . A 14 DG H2'' . 19278 1 117 . 1 1 14 14 DG H3' H 1 4.839 0.010 . 1 . . . A 14 DG H3' . 19278 1 118 . 1 1 14 14 DG H4' H 1 4.247 0.010 . 1 . . . A 14 DG H4' . 19278 1 119 . 1 1 14 14 DG H8 H 1 7.744 0.010 . 1 . . . A 14 DG H8 . 19278 1 120 . 1 1 15 15 DC H1' H 1 5.604 0.010 . 1 . . . A 15 DC H1' . 19278 1 121 . 1 1 15 15 DC H2' H 1 1.545 0.010 . 1 . . . A 15 DC H2' . 19278 1 122 . 1 1 15 15 DC H2'' H 1 2.110 0.010 . 1 . . . A 15 DC H2'' . 19278 1 123 . 1 1 15 15 DC H3' H 1 4.650 0.010 . 1 . . . A 15 DC H3' . 19278 1 124 . 1 1 15 15 DC H4' H 1 4.009 0.010 . 1 . . . A 15 DC H4' . 19278 1 125 . 1 1 15 15 DC H5 H 1 5.169 0.010 . 1 . . . A 15 DC H5 . 19278 1 126 . 1 1 15 15 DC H6 H 1 6.989 0.010 . 1 . . . A 15 DC H6 . 19278 1 127 . 1 1 15 15 DC H41 H 1 8.165 0.010 . 1 . . . A 15 DC H41 . 19278 1 128 . 1 1 15 15 DC H42 H 1 6.308 0.010 . 1 . . . A 15 DC H42 . 19278 1 129 . 1 1 16 16 DG H1 H 1 13.121 0.010 . 1 . . . A 16 DG H1 . 19278 1 130 . 1 1 16 16 DG H1' H 1 5.541 0.010 . 1 . . . A 16 DG H1' . 19278 1 131 . 1 1 16 16 DG H2' H 1 2.485 0.010 . 1 . . . A 16 DG H2' . 19278 1 132 . 1 1 16 16 DG H2'' H 1 2.647 0.010 . 1 . . . A 16 DG H2'' . 19278 1 133 . 1 1 16 16 DG H3' H 1 4.950 0.010 . 1 . . . A 16 DG H3' . 19278 1 134 . 1 1 16 16 DG H4' H 1 4.276 0.010 . 1 . . . A 16 DG H4' . 19278 1 135 . 1 1 16 16 DG H8 H 1 7.595 0.010 . 1 . . . A 16 DG H8 . 19278 1 136 . 1 1 17 17 DG H1 H 1 11.182 0.010 . 1 . . . A 17 DG H1 . 19278 1 137 . 1 1 17 17 DG H1' H 1 5.998 0.010 . 1 . . . A 17 DG H1' . 19278 1 138 . 1 1 17 17 DG H2' H 1 2.649 0.010 . 1 . . . A 17 DG H2' . 19278 1 139 . 1 1 17 17 DG H2'' H 1 2.915 0.010 . 1 . . . A 17 DG H2'' . 19278 1 140 . 1 1 17 17 DG H3' H 1 5.024 0.010 . 1 . . . A 17 DG H3' . 19278 1 141 . 1 1 17 17 DG H4' H 1 4.461 0.010 . 1 . . . A 17 DG H4' . 19278 1 142 . 1 1 17 17 DG H8 H 1 7.918 0.010 . 1 . . . A 17 DG H8 . 19278 1 143 . 1 1 18 18 DG H1 H 1 11.191 0.010 . 1 . . . A 18 DG H1 . 19278 1 144 . 1 1 18 18 DG H1' H 1 6.205 0.010 . 1 . . . A 18 DG H1' . 19278 1 145 . 1 1 18 18 DG H2' H 1 2.720 0.010 . 1 . . . A 18 DG H2' . 19278 1 146 . 1 1 18 18 DG H2'' H 1 2.846 0.010 . 1 . . . A 18 DG H2'' . 19278 1 147 . 1 1 18 18 DG H3' H 1 5.026 0.010 . 1 . . . A 18 DG H3' . 19278 1 148 . 1 1 18 18 DG H4' H 1 4.671 0.010 . 1 . . . A 18 DG H4' . 19278 1 149 . 1 1 18 18 DG H8 H 1 7.730 0.010 . 1 . . . A 18 DG H8 . 19278 1 150 . 1 1 18 18 DG H21 H 1 9.789 0.010 . 1 . . . A 18 DG H21 . 19278 1 151 . 1 1 18 18 DG H22 H 1 8.714 0.010 . 1 . . . A 18 DG H22 . 19278 1 152 . 1 1 19 19 DG H1 H 1 11.350 0.010 . 1 . . . A 19 DG H1 . 19278 1 153 . 1 1 19 19 DG H1' H 1 6.051 0.010 . 1 . . . A 19 DG H1' . 19278 1 154 . 1 1 19 19 DG H2' H 1 2.229 0.010 . 1 . . . A 19 DG H2' . 19278 1 155 . 1 1 19 19 DG H2'' H 1 2.337 0.010 . 1 . . . A 19 DG H2'' . 19278 1 156 . 1 1 19 19 DG H3' H 1 4.685 0.010 . 1 . . . A 19 DG H3' . 19278 1 157 . 1 1 19 19 DG H4' H 1 2.820 0.010 . 1 . . . A 19 DG H4' . 19278 1 158 . 1 1 19 19 DG H5' H 1 3.725 0.010 . 2 . . . A 19 DG H5' . 19278 1 159 . 1 1 19 19 DG H5'' H 1 3.577 0.010 . 2 . . . A 19 DG H5'' . 19278 1 160 . 1 1 19 19 DG H8 H 1 7.498 0.010 . 1 . . . A 19 DG H8 . 19278 1 161 . 1 1 20 20 DA H1' H 1 6.661 0.010 . 1 . . . A 20 DA H1' . 19278 1 162 . 1 1 20 20 DA H2 H 1 8.481 0.010 . 1 . . . A 20 DA H2 . 19278 1 163 . 1 1 20 20 DA H2' H 1 3.197 0.010 . 1 . . . A 20 DA H2' . 19278 1 164 . 1 1 20 20 DA H2'' H 1 3.303 0.010 . 1 . . . A 20 DA H2'' . 19278 1 165 . 1 1 20 20 DA H3' H 1 5.476 0.010 . 1 . . . A 20 DA H3' . 19278 1 166 . 1 1 20 20 DA H4' H 1 4.440 0.010 . 1 . . . A 20 DA H4' . 19278 1 167 . 1 1 20 20 DA H5' H 1 4.248 0.010 . 2 . . . A 20 DA H5' . 19278 1 168 . 1 1 20 20 DA H5'' H 1 3.836 0.010 . 2 . . . A 20 DA H5'' . 19278 1 169 . 1 1 20 20 DA H8 H 1 8.782 0.010 . 1 . . . A 20 DA H8 . 19278 1 170 . 1 1 21 21 DG H1 H 1 11.229 0.010 . 1 . . . A 21 DG H1 . 19278 1 171 . 1 1 21 21 DG H1' H 1 6.258 0.010 . 1 . . . A 21 DG H1' . 19278 1 172 . 1 1 21 21 DG H2' H 1 2.624 0.010 . 1 . . . A 21 DG H2' . 19278 1 173 . 1 1 21 21 DG H2'' H 1 2.898 0.010 . 1 . . . A 21 DG H2'' . 19278 1 174 . 1 1 21 21 DG H3' H 1 4.968 0.010 . 1 . . . A 21 DG H3' . 19278 1 175 . 1 1 21 21 DG H4' H 1 4.471 0.010 . 1 . . . A 21 DG H4' . 19278 1 176 . 1 1 21 21 DG H5' H 1 4.473 0.010 . 2 . . . A 21 DG H5' . 19278 1 177 . 1 1 21 21 DG H5'' H 1 4.383 0.010 . 2 . . . A 21 DG H5'' . 19278 1 178 . 1 1 21 21 DG H8 H 1 7.920 0.010 . 1 . . . A 21 DG H8 . 19278 1 179 . 1 1 21 21 DG H21 H 1 9.226 0.010 . 1 . . . A 21 DG H21 . 19278 1 180 . 1 1 21 21 DG H22 H 1 6.786 0.010 . 1 . . . A 21 DG H22 . 19278 1 181 . 1 1 22 22 DG H1 H 1 11.129 0.010 . 1 . . . A 22 DG H1 . 19278 1 182 . 1 1 22 22 DG H1' H 1 6.509 0.010 . 1 . . . A 22 DG H1' . 19278 1 183 . 1 1 22 22 DG H2' H 1 2.730 0.010 . 1 . . . A 22 DG H2' . 19278 1 184 . 1 1 22 22 DG H2'' H 1 2.578 0.010 . 1 . . . A 22 DG H2'' . 19278 1 185 . 1 1 22 22 DG H3' H 1 5.110 0.010 . 1 . . . A 22 DG H3' . 19278 1 186 . 1 1 22 22 DG H4' H 1 4.691 0.010 . 1 . . . A 22 DG H4' . 19278 1 187 . 1 1 22 22 DG H8 H 1 8.085 0.010 . 1 . . . A 22 DG H8 . 19278 1 188 . 1 1 23 23 DT H1' H 1 6.548 0.010 . 1 . . . A 23 DT H1' . 19278 1 189 . 1 1 23 23 DT H2' H 1 2.472 0.010 . 1 . . . A 23 DT H2' . 19278 1 190 . 1 1 23 23 DT H2'' H 1 2.692 0.010 . 1 . . . A 23 DT H2'' . 19278 1 191 . 1 1 23 23 DT H3' H 1 5.116 0.010 . 1 . . . A 23 DT H3' . 19278 1 192 . 1 1 23 23 DT H4' H 1 4.689 0.010 . 1 . . . A 23 DT H4' . 19278 1 193 . 1 1 23 23 DT H5' H 1 4.366 0.010 . 2 . . . A 23 DT H5' . 19278 1 194 . 1 1 23 23 DT H5'' H 1 4.261 0.010 . 2 . . . A 23 DT H5'' . 19278 1 195 . 1 1 23 23 DT H6 H 1 7.881 0.010 . 1 . . . A 23 DT H6 . 19278 1 196 . 1 1 23 23 DT H71 H 1 1.994 0.010 . 2 . . . A 23 DT H71 . 19278 1 197 . 1 1 23 23 DT H72 H 1 1.994 0.010 . 2 . . . A 23 DT H72 . 19278 1 198 . 1 1 23 23 DT H73 H 1 1.994 0.010 . 2 . . . A 23 DT H73 . 19278 1 199 . 1 1 24 24 DG H1 H 1 11.758 0.010 . 1 . . . A 24 DG H1 . 19278 1 200 . 1 1 24 24 DG H1' H 1 6.184 0.010 . 1 . . . A 24 DG H1' . 19278 1 201 . 1 1 24 24 DG H2' H 1 2.544 0.010 . 1 . . . A 24 DG H2' . 19278 1 202 . 1 1 24 24 DG H2'' H 1 2.896 0.010 . 1 . . . A 24 DG H2'' . 19278 1 203 . 1 1 24 24 DG H3' H 1 5.157 0.010 . 1 . . . A 24 DG H3' . 19278 1 204 . 1 1 24 24 DG H4' H 1 4.489 0.010 . 1 . . . A 24 DG H4' . 19278 1 205 . 1 1 24 24 DG H8 H 1 8.001 0.010 . 1 . . . A 24 DG H8 . 19278 1 206 . 1 1 25 25 DG H1 H 1 11.421 0.010 . 1 . . . A 25 DG H1 . 19278 1 207 . 1 1 25 25 DG H1' H 1 6.147 0.010 . 1 . . . A 25 DG H1' . 19278 1 208 . 1 1 25 25 DG H2' H 1 2.692 0.010 . 1 . . . A 25 DG H2' . 19278 1 209 . 1 1 25 25 DG H2'' H 1 2.771 0.010 . 1 . . . A 25 DG H2'' . 19278 1 210 . 1 1 25 25 DG H3' H 1 4.986 0.010 . 1 . . . A 25 DG H3' . 19278 1 211 . 1 1 25 25 DG H4' H 1 4.541 0.010 . 1 . . . A 25 DG H4' . 19278 1 212 . 1 1 25 25 DG H8 H 1 7.991 0.010 . 1 . . . A 25 DG H8 . 19278 1 213 . 1 1 26 26 DG H1 H 1 11.124 0.010 . 1 . . . A 26 DG H1 . 19278 1 214 . 1 1 26 26 DG H1' H 1 6.219 0.010 . 1 . . . A 26 DG H1' . 19278 1 215 . 1 1 26 26 DG H2' H 1 2.457 0.010 . 1 . . . A 26 DG H2' . 19278 1 216 . 1 1 26 26 DG H2'' H 1 2.517 0.010 . 1 . . . A 26 DG H2'' . 19278 1 217 . 1 1 26 26 DG H3' H 1 4.818 0.010 . 1 . . . A 26 DG H3' . 19278 1 218 . 1 1 26 26 DG H4' H 1 3.969 0.010 . 1 . . . A 26 DG H4' . 19278 1 219 . 1 1 26 26 DG H5' H 1 3.804 0.010 . 2 . . . A 26 DG H5' . 19278 1 220 . 1 1 26 26 DG H5'' H 1 3.476 0.010 . 2 . . . A 26 DG H5'' . 19278 1 221 . 1 1 26 26 DG H8 H 1 7.754 0.010 . 1 . . . A 26 DG H8 . 19278 1 222 . 1 1 27 27 DG H1' H 1 6.287 0.010 . 1 . . . A 27 DG H1' . 19278 1 223 . 1 1 27 27 DG H2' H 1 2.969 0.010 . 1 . . . A 27 DG H2' . 19278 1 224 . 1 1 27 27 DG H2'' H 1 2.623 0.010 . 1 . . . A 27 DG H2'' . 19278 1 225 . 1 1 27 27 DG H3' H 1 4.999 0.010 . 1 . . . A 27 DG H3' . 19278 1 226 . 1 1 27 27 DG H4' H 1 4.267 0.010 . 1 . . . A 27 DG H4' . 19278 1 227 . 1 1 27 27 DG H8 H 1 7.959 0.010 . 1 . . . A 27 DG H8 . 19278 1 228 . 1 1 28 28 DA H1' H 1 6.232 0.010 . 1 . . . A 28 DA H1' . 19278 1 229 . 1 1 28 28 DA H2 H 1 8.120 0.010 . 1 . . . A 28 DA H2 . 19278 1 230 . 1 1 28 28 DA H2' H 1 2.612 0.010 . 1 . . . A 28 DA H2' . 19278 1 231 . 1 1 28 28 DA H2'' H 1 2.728 0.010 . 1 . . . A 28 DA H2'' . 19278 1 232 . 1 1 28 28 DA H3' H 1 4.938 0.010 . 1 . . . A 28 DA H3' . 19278 1 233 . 1 1 28 28 DA H4' H 1 4.366 0.010 . 1 . . . A 28 DA H4' . 19278 1 234 . 1 1 28 28 DA H5' H 1 4.072 0.010 . 2 . . . A 28 DA H5' . 19278 1 235 . 1 1 28 28 DA H5'' H 1 4.025 0.010 . 2 . . . A 28 DA H5'' . 19278 1 236 . 1 1 28 28 DA H8 H 1 8.322 0.010 . 1 . . . A 28 DA H8 . 19278 1 237 . 1 1 29 29 DA H1' H 1 6.454 0.010 . 1 . . . A 29 DA H1' . 19278 1 238 . 1 1 29 29 DA H2 H 1 8.205 0.010 . 1 . . . A 29 DA H2 . 19278 1 239 . 1 1 29 29 DA H2' H 1 2.860 0.010 . 1 . . . A 29 DA H2' . 19278 1 240 . 1 1 29 29 DA H2'' H 1 2.722 0.010 . 1 . . . A 29 DA H2'' . 19278 1 241 . 1 1 29 29 DA H3' H 1 5.092 0.010 . 1 . . . A 29 DA H3' . 19278 1 242 . 1 1 29 29 DA H4' H 1 4.226 0.010 . 1 . . . A 29 DA H4' . 19278 1 243 . 1 1 29 29 DA H8 H 1 8.279 0.010 . 1 . . . A 29 DA H8 . 19278 1 244 . 1 1 30 30 DG H1 H 1 11.538 0.010 . 1 . . . A 30 DG H1 . 19278 1 245 . 1 1 30 30 DG H1' H 1 6.164 0.010 . 1 . . . A 30 DG H1' . 19278 1 246 . 1 1 30 30 DG H2' H 1 2.753 0.010 . 1 . . . A 30 DG H2' . 19278 1 247 . 1 1 30 30 DG H2'' H 1 2.881 0.010 . 1 . . . A 30 DG H2'' . 19278 1 248 . 1 1 30 30 DG H3' H 1 4.944 0.010 . 1 . . . A 30 DG H3' . 19278 1 249 . 1 1 30 30 DG H4' H 1 4.474 0.010 . 1 . . . A 30 DG H4' . 19278 1 250 . 1 1 30 30 DG H5' H 1 4.221 0.010 . 2 . . . A 30 DG H5' . 19278 1 251 . 1 1 30 30 DG H5'' H 1 4.147 0.010 . 2 . . . A 30 DG H5'' . 19278 1 252 . 1 1 30 30 DG H8 H 1 8.109 0.010 . 1 . . . A 30 DG H8 . 19278 1 253 . 1 1 31 31 DG H1 H 1 11.538 0.010 . 1 . . . A 31 DG H1 . 19278 1 254 . 1 1 31 31 DG H1' H 1 6.229 0.010 . 1 . . . A 31 DG H1' . 19278 1 255 . 1 1 31 31 DG H2' H 1 2.740 0.010 . 1 . . . A 31 DG H2' . 19278 1 256 . 1 1 31 31 DG H2'' H 1 2.930 0.010 . 1 . . . A 31 DG H2'' . 19278 1 257 . 1 1 31 31 DG H3' H 1 5.078 0.010 . 1 . . . A 31 DG H3' . 19278 1 258 . 1 1 31 31 DG H4' H 1 4.609 0.010 . 1 . . . A 31 DG H4' . 19278 1 259 . 1 1 31 31 DG H8 H 1 7.927 0.010 . 1 . . . A 31 DG H8 . 19278 1 260 . 1 1 32 32 DG H1 H 1 11.443 0.010 . 1 . . . A 32 DG H1 . 19278 1 261 . 1 1 32 32 DG H1' H 1 6.361 0.010 . 1 . . . A 32 DG H1' . 19278 1 262 . 1 1 32 32 DG H2' H 1 2.608 0.010 . 1 . . . A 32 DG H2' . 19278 1 263 . 1 1 32 32 DG H2'' H 1 2.437 0.010 . 1 . . . A 32 DG H2'' . 19278 1 264 . 1 1 32 32 DG H3' H 1 4.718 0.010 . 1 . . . A 32 DG H3' . 19278 1 265 . 1 1 32 32 DG H4' H 1 4.386 0.010 . 1 . . . A 32 DG H4' . 19278 1 266 . 1 1 32 32 DG H8 H 1 7.853 0.010 . 1 . . . A 32 DG H8 . 19278 1 stop_ save_