################################### # 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 36268 _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 $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 NOESY' 1 $sample_1 anisotropic 36268 1 2 '2D TOCSY' 1 $sample_1 anisotropic 36268 1 3 '2D COSY' 1 $sample_1 anisotropic 36268 1 4 '2D NOESY' 1 $sample_1 anisotropic 36268 1 5 '2D TOCSY' 1 $sample_1 anisotropic 36268 1 6 '2D COSY' 1 $sample_1 anisotropic 36268 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 DT H1' H 1 5.850 . . 1 . . . . A 1 DT H1' . 36268 1 2 . 1 . 1 1 1 DT H2' H 1 1.930 . . . . . . . A 1 DT H2' . 36268 1 3 . 1 . 1 1 1 DT H2'' H 1 2.168 . . . . . . . A 1 DT H2'' . 36268 1 4 . 1 . 1 1 1 DT H3' H 1 4.450 . . 1 . . . . A 1 DT H3' . 36268 1 5 . 1 . 1 1 1 DT H4' H 1 3.958 . . 1 . . . . A 1 DT H4' . 36268 1 6 . 1 . 1 1 1 DT H5' H 1 3.791 . . . . . . . A 1 DT H5' . 36268 1 7 . 1 . 1 1 1 DT H5'' H 1 3.455 . . . . . . . A 1 DT H5'' . 36268 1 8 . 1 . 1 1 1 DT H6 H 1 7.214 . . 1 . . . . A 1 DT H6 . 36268 1 9 . 1 . 1 1 1 DT H71 H 1 1.491 . . 1 . . . . A 1 DT H71 . 36268 1 10 . 1 . 1 1 1 DT H72 H 1 1.491 . . 1 . . . . A 1 DT H72 . 36268 1 11 . 1 . 1 1 1 DT H73 H 1 1.491 . . 1 . . . . A 1 DT H73 . 36268 1 12 . 1 . 1 2 2 DT H1' H 1 5.688 . . 1 . . . . A 2 DT H1' . 36268 1 13 . 1 . 1 2 2 DT H2' H 1 1.755 . . . . . . . A 2 DT H2' . 36268 1 14 . 1 . 1 2 2 DT H2'' H 1 1.973 . . . . . . . A 2 DT H2'' . 36268 1 15 . 1 . 1 2 2 DT H3' H 1 4.481 . . 1 . . . . A 2 DT H3' . 36268 1 16 . 1 . 1 2 2 DT H4' H 1 3.930 . . 1 . . . . A 2 DT H4' . 36268 1 17 . 1 . 1 2 2 DT H5' H 1 3.772 . . . . . . . A 2 DT H5' . 36268 1 18 . 1 . 1 2 2 DT H5'' H 1 3.632 . . . . . . . A 2 DT H5'' . 36268 1 19 . 1 . 1 2 2 DT H6 H 1 7.221 . . 1 . . . . A 2 DT H6 . 36268 1 20 . 1 . 1 2 2 DT H71 H 1 1.515 . . 1 . . . . A 2 DT H71 . 36268 1 21 . 1 . 1 2 2 DT H72 H 1 1.515 . . 1 . . . . A 2 DT H72 . 36268 1 22 . 1 . 1 2 2 DT H73 H 1 1.515 . . 1 . . . . A 2 DT H73 . 36268 1 23 . 1 . 1 3 3 DA H1' H 1 6.151 . . 1 . . . . A 3 DA H1' . 36268 1 24 . 1 . 1 3 3 DA H2 H 1 7.740 . . 1 . . . . A 3 DA H2 . 36268 1 25 . 1 . 1 3 3 DA H2' H 1 2.808 . . . . . . . A 3 DA H2' . 36268 1 26 . 1 . 1 3 3 DA H2'' H 1 2.643 . . . . . . . A 3 DA H2'' . 36268 1 27 . 1 . 1 3 3 DA H3' H 1 5.031 . . 1 . . . . A 3 DA H3' . 36268 1 28 . 1 . 1 3 3 DA H4' H 1 4.830 . . 1 . . . . A 3 DA H4' . 36268 1 29 . 1 . 1 3 3 DA H5' H 1 4.489 . . . . . . . A 3 DA H5' . 36268 1 30 . 1 . 1 3 3 DA H5'' H 1 4.233 . . . . . . . A 3 DA H5'' . 36268 1 31 . 1 . 1 3 3 DA H8 H 1 8.083 . . 1 . . . . A 3 DA H8 . 36268 1 32 . 1 . 1 4 4 DG H1 H 1 11.64 . . 1 . . . . A 4 DG H1 . 36268 1 33 . 1 . 1 4 4 DG H1' H 1 5.841 . . 1 . . . . A 4 DG H1' . 36268 1 34 . 1 . 1 4 4 DG H2' H 1 2.859 . . . . . . . A 4 DG H2' . 36268 1 35 . 1 . 1 4 4 DG H2'' H 1 3.414 . . . . . . . A 4 DG H2'' . 36268 1 36 . 1 . 1 4 4 DG H3' H 1 4.893 . . 1 . . . . A 4 DG H3' . 36268 1 37 . 1 . 1 4 4 DG H4' H 1 4.376 . . 1 . . . . A 4 DG H4' . 36268 1 38 . 1 . 1 4 4 DG H5' H 1 4.262 . . . . . . . A 4 DG H5' . 36268 1 39 . 1 . 1 4 4 DG H5'' H 1 4.201 . . . . . . . A 4 DG H5'' . 36268 1 40 . 1 . 1 4 4 DG H8 H 1 7.313 . . 1 . . . . A 4 DG H8 . 36268 1 41 . 1 . 1 5 5 DG H1 H 1 11.75 . . 1 . . . . A 5 DG H1 . 36268 1 42 . 1 . 1 5 5 DG H1' H 1 5.580 . . 1 . . . . A 5 DG H1' . 36268 1 43 . 1 . 1 5 5 DG H2' H 1 2.483 . . . . . . . A 5 DG H2' . 36268 1 44 . 1 . 1 5 5 DG H2'' H 1 2.562 . . . . . . . A 5 DG H2'' . 36268 1 45 . 1 . 1 5 5 DG H3' H 1 4.953 . . 1 . . . . A 5 DG H3' . 36268 1 46 . 1 . 1 5 5 DG H4' H 1 4.331 . . 1 . . . . A 5 DG H4' . 36268 1 47 . 1 . 1 5 5 DG H5' H 1 4.194 . . . . . . . A 5 DG H5' . 36268 1 48 . 1 . 1 5 5 DG H5'' H 1 4.194 . . . . . . . A 5 DG H5'' . 36268 1 49 . 1 . 1 5 5 DG H8 H 1 7.875 . . 1 . . . . A 5 DG H8 . 36268 1 50 . 1 . 1 6 6 DG H1 H 1 10.86 . . 1 . . . . A 6 DG H1 . 36268 1 51 . 1 . 1 6 6 DG H1' H 1 5.970 . . 1 . . . . A 6 DG H1' . 36268 1 52 . 1 . 1 6 6 DG H2' H 1 2.513 . . . . . . . A 6 DG H2' . 36268 1 53 . 1 . 1 6 6 DG H2'' H 1 2.270 . . . . . . . A 6 DG H2'' . 36268 1 54 . 1 . 1 6 6 DG H3' H 1 4.976 . . 1 . . . . A 6 DG H3' . 36268 1 55 . 1 . 1 6 6 DG H4' H 1 4.382 . . 1 . . . . A 6 DG H4' . 36268 1 56 . 1 . 1 6 6 DG H5' H 1 4.185 . . . . . . . A 6 DG H5' . 36268 1 57 . 1 . 1 6 6 DG H5'' H 1 4.185 . . . . . . . A 6 DG H5'' . 36268 1 58 . 1 . 1 6 6 DG H8 H 1 7.731 . . 1 . . . . A 6 DG H8 . 36268 1 59 . 1 . 1 7 7 DT H1' H 1 6.277 . . 1 . . . . A 7 DT H1' . 36268 1 60 . 1 . 1 7 7 DT H2' H 1 2.206 . . . . . . . A 7 DT H2' . 36268 1 61 . 1 . 1 7 7 DT H2'' H 1 2.504 . . . . . . . A 7 DT H2'' . 36268 1 62 . 1 . 1 7 7 DT H3' H 1 4.741 . . 1 . . . . A 7 DT H3' . 36268 1 63 . 1 . 1 7 7 DT H4' H 1 4.349 . . 1 . . . . A 7 DT H4' . 36268 1 64 . 1 . 1 7 7 DT H5' H 1 4.217 . . . . . . . A 7 DT H5' . 36268 1 65 . 1 . 1 7 7 DT H5'' H 1 4.063 . . . . . . . A 7 DT H5'' . 36268 1 66 . 1 . 1 7 7 DT H6 H 1 7.740 . . 1 . . . . A 7 DT H6 . 36268 1 67 . 1 . 1 7 7 DT H71 H 1 1.873 . . 1 . . . . A 7 DT H71 . 36268 1 68 . 1 . 1 7 7 DT H72 H 1 1.873 . . 1 . . . . A 7 DT H72 . 36268 1 69 . 1 . 1 7 7 DT H73 H 1 1.873 . . 1 . . . . A 7 DT H73 . 36268 1 70 . 1 . 1 8 8 DT H1' H 1 5.751 . . 1 . . . . A 8 DT H1' . 36268 1 71 . 1 . 1 8 8 DT H2' H 1 1.955 . . . . . . . A 8 DT H2' . 36268 1 72 . 1 . 1 8 8 DT H2'' H 1 2.160 . . . . . . . A 8 DT H2'' . 36268 1 73 . 1 . 1 8 8 DT H3' H 1 4.581 . . 1 . . . . A 8 DT H3' . 36268 1 74 . 1 . 1 8 8 DT H4' H 1 3.962 . . 1 . . . . A 8 DT H4' . 36268 1 75 . 1 . 1 8 8 DT H5' H 1 3.910 . . . . . . . A 8 DT H5' . 36268 1 76 . 1 . 1 8 8 DT H5'' H 1 3.910 . . . . . . . A 8 DT H5'' . 36268 1 77 . 1 . 1 8 8 DT H6 H 1 7.436 . . 1 . . . . A 8 DT H6 . 36268 1 78 . 1 . 1 8 8 DT H71 H 1 1.755 . . 1 . . . . A 8 DT H71 . 36268 1 79 . 1 . 1 8 8 DT H72 H 1 1.755 . . 1 . . . . A 8 DT H72 . 36268 1 80 . 1 . 1 8 8 DT H73 H 1 1.755 . . 1 . . . . A 8 DT H73 . 36268 1 81 . 1 . 1 9 9 DA H1' H 1 5.681 . . 1 . . . . A 9 DA H1' . 36268 1 82 . 1 . 1 9 9 DA H2 H 1 7.450 . . 1 . . . . A 9 DA H2 . 36268 1 83 . 1 . 1 9 9 DA H2' H 1 1.923 . . . . . . . A 9 DA H2' . 36268 1 84 . 1 . 1 9 9 DA H2'' H 1 2.413 . . . . . . . A 9 DA H2'' . 36268 1 85 . 1 . 1 9 9 DA H3' H 1 4.592 . . 1 . . . . A 9 DA H3' . 36268 1 86 . 1 . 1 9 9 DA H4' H 1 4.240 . . 1 . . . . A 9 DA H4' . 36268 1 87 . 1 . 1 9 9 DA H5' H 1 3.979 . . . . . . . A 9 DA H5' . 36268 1 88 . 1 . 1 9 9 DA H5'' H 1 3.544 . . . . . . . A 9 DA H5'' . 36268 1 89 . 1 . 1 9 9 DA H8 H 1 7.652 . . 1 . . . . A 9 DA H8 . 36268 1 90 . 1 . 1 10 10 DG H1 H 1 11.07 . . 1 . . . . A 10 DG H1 . 36268 1 91 . 1 . 1 10 10 DG H1' H 1 5.970 . . 1 . . . . A 10 DG H1' . 36268 1 92 . 1 . 1 10 10 DG H2' H 1 3.609 . . . . . . . A 10 DG H2' . 36268 1 93 . 1 . 1 10 10 DG H2'' H 1 3.013 . . . . . . . A 10 DG H2'' . 36268 1 94 . 1 . 1 10 10 DG H3' H 1 4.813 . . 1 . . . . A 10 DG H3' . 36268 1 95 . 1 . 1 10 10 DG H4' H 1 4.260 . . 1 . . . . A 10 DG H4' . 36268 1 96 . 1 . 1 10 10 DG H5' H 1 4.232 . . . . . . . A 10 DG H5' . 36268 1 97 . 1 . 1 10 10 DG H5'' H 1 4.144 . . . . . . . A 10 DG H5'' . 36268 1 98 . 1 . 1 10 10 DG H8 H 1 7.215 . . 1 . . . . A 10 DG H8 . 36268 1 99 . 1 . 1 11 11 DG H1 H 1 10.89 . . 1 . . . . A 11 DG H1 . 36268 1 100 . 1 . 1 11 11 DG H1' H 1 5.731 . . 1 . . . . A 11 DG H1' . 36268 1 101 . 1 . 1 11 11 DG H2' H 1 2.367 . . . . . . . A 11 DG H2' . 36268 1 102 . 1 . 1 11 11 DG H2'' H 1 2.563 . . . . . . . A 11 DG H2'' . 36268 1 103 . 1 . 1 11 11 DG H3' H 1 4.941 . . 1 . . . . A 11 DG H3' . 36268 1 104 . 1 . 1 11 11 DG H4' H 1 4.150 . . 1 . . . . A 11 DG H4' . 36268 1 105 . 1 . 1 11 11 DG H5' H 1 4.103 . . . . . . . A 11 DG H5' . 36268 1 106 . 1 . 1 11 11 DG H5'' H 1 4.103 . . . . . . . A 11 DG H5'' . 36268 1 107 . 1 . 1 11 11 DG H8 H 1 7.385 . . 1 . . . . A 11 DG H8 . 36268 1 108 . 1 . 1 12 12 DG H1 H 1 11.74 . . 1 . . . . A 12 DG H1 . 36268 1 109 . 1 . 1 12 12 DG H1' H 1 6.070 . . 1 . . . . A 12 DG H1' . 36268 1 110 . 1 . 1 12 12 DG H2' H 1 2.691 . . . . . . . A 12 DG H2' . 36268 1 111 . 1 . 1 12 12 DG H2'' H 1 2.772 . . . . . . . A 12 DG H2'' . 36268 1 112 . 1 . 1 12 12 DG H3' H 1 5.112 . . 1 . . . . A 12 DG H3' . 36268 1 113 . 1 . 1 12 12 DG H4' H 1 4.417 . . 1 . . . . A 12 DG H4' . 36268 1 114 . 1 . 1 12 12 DG H5' H 1 4.283 . . . . . . . A 12 DG H5' . 36268 1 115 . 1 . 1 12 12 DG H5'' H 1 4.208 . . . . . . . A 12 DG H5'' . 36268 1 116 . 1 . 1 12 12 DG H8 H 1 7.526 . . 1 . . . . A 12 DG H8 . 36268 1 117 . 1 . 1 13 13 DT H1' H 1 6.333 . . 1 . . . . A 13 DT H1' . 36268 1 118 . 1 . 1 13 13 DT H2' H 1 2.392 . . . . . . . A 13 DT H2' . 36268 1 119 . 1 . 1 13 13 DT H2'' H 1 2.499 . . . . . . . A 13 DT H2'' . 36268 1 120 . 1 . 1 13 13 DT H3' H 1 4.912 . . 1 . . . . A 13 DT H3' . 36268 1 121 . 1 . 1 13 13 DT H4' H 1 4.390 . . 1 . . . . A 13 DT H4' . 36268 1 122 . 1 . 1 13 13 DT H5' H 1 4.282 . . . . . . . A 13 DT H5' . 36268 1 123 . 1 . 1 13 13 DT H5'' H 1 4.111 . . . . . . . A 13 DT H5'' . 36268 1 124 . 1 . 1 13 13 DT H6 H 1 7.761 . . 1 . . . . A 13 DT H6 . 36268 1 125 . 1 . 1 13 13 DT H71 H 1 1.913 . . 1 . . . . A 13 DT H71 . 36268 1 126 . 1 . 1 13 13 DT H72 H 1 1.913 . . 1 . . . . A 13 DT H72 . 36268 1 127 . 1 . 1 13 13 DT H73 H 1 1.913 . . 1 . . . . A 13 DT H73 . 36268 1 128 . 1 . 1 14 14 DT H1' H 1 5.864 . . 1 . . . . A 14 DT H1' . 36268 1 129 . 1 . 1 14 14 DT H2' H 1 0.565 . . . . . . . A 14 DT H2' . 36268 1 130 . 1 . 1 14 14 DT H2'' H 1 1.523 . . . . . . . A 14 DT H2'' . 36268 1 131 . 1 . 1 14 14 DT H3' H 1 4.621 . . 1 . . . . A 14 DT H3' . 36268 1 132 . 1 . 1 14 14 DT H4' H 1 4.055 . . 1 . . . . A 14 DT H4' . 36268 1 133 . 1 . 1 14 14 DT H5' H 1 3.912 . . . . . . . A 14 DT H5' . 36268 1 134 . 1 . 1 14 14 DT H5'' H 1 3.803 . . . . . . . A 14 DT H5'' . 36268 1 135 . 1 . 1 14 14 DT H6 H 1 6.676 . . 1 . . . . A 14 DT H6 . 36268 1 136 . 1 . 1 14 14 DT H71 H 1 0.993 . . 1 . . . . A 14 DT H71 . 36268 1 137 . 1 . 1 14 14 DT H72 H 1 0.993 . . 1 . . . . A 14 DT H72 . 36268 1 138 . 1 . 1 14 14 DT H73 H 1 0.993 . . 1 . . . . A 14 DT H73 . 36268 1 139 . 1 . 1 15 15 DA H1' H 1 6.361 . . 1 . . . . A 15 DA H1' . 36268 1 140 . 1 . 1 15 15 DA H2 H 1 7.574 . . 1 . . . . A 15 DA H2 . 36268 1 141 . 1 . 1 15 15 DA H2' H 1 3.098 . . . . . . . A 15 DA H2' . 36268 1 142 . 1 . 1 15 15 DA H2'' H 1 2.782 . . . . . . . A 15 DA H2'' . 36268 1 143 . 1 . 1 15 15 DA H3' H 1 5.100 . . 1 . . . . A 15 DA H3' . 36268 1 144 . 1 . 1 15 15 DA H4' H 1 4.477 . . 1 . . . . A 15 DA H4' . 36268 1 145 . 1 . 1 15 15 DA H5' H 1 4.328 . . . . . . . A 15 DA H5' . 36268 1 146 . 1 . 1 15 15 DA H5'' H 1 4.220 . . . . . . . A 15 DA H5'' . 36268 1 147 . 1 . 1 15 15 DA H8 H 1 8.272 . . 1 . . . . A 15 DA H8 . 36268 1 148 . 1 . 1 16 16 DG H1 H 1 10.81 . . 1 . . . . A 16 DG H1 . 36268 1 149 . 1 . 1 16 16 DG H1' H 1 5.641 . . 1 . . . . A 16 DG H1' . 36268 1 150 . 1 . 1 16 16 DG H2' H 1 3.007 . . . . . . . A 16 DG H2' . 36268 1 151 . 1 . 1 16 16 DG H2'' H 1 2.806 . . . . . . . A 16 DG H2'' . 36268 1 152 . 1 . 1 16 16 DG H3' H 1 4.792 . . 1 . . . . A 16 DG H3' . 36268 1 153 . 1 . 1 16 16 DG H4' H 1 4.324 . . 1 . . . . A 16 DG H4' . 36268 1 154 . 1 . 1 16 16 DG H5' H 1 4.209 . . . . . . . A 16 DG H5' . 36268 1 155 . 1 . 1 16 16 DG H5'' H 1 4.209 . . . . . . . A 16 DG H5'' . 36268 1 156 . 1 . 1 16 16 DG H8 H 1 7.026 . . 1 . . . . A 16 DG H8 . 36268 1 157 . 1 . 1 17 17 DG H1 H 1 11.36 . . 1 . . . . A 17 DG H1 . 36268 1 158 . 1 . 1 17 17 DG H1' H 1 5.867 . . 1 . . . . A 17 DG H1' . 36268 1 159 . 1 . 1 17 17 DG H2' H 1 2.436 . . . . . . . A 17 DG H2' . 36268 1 160 . 1 . 1 17 17 DG H2'' H 1 2.763 . . . . . . . A 17 DG H2'' . 36268 1 161 . 1 . 1 17 17 DG H3' H 1 4.931 . . 1 . . . . A 17 DG H3' . 36268 1 162 . 1 . 1 17 17 DG H4' H 1 4.201 . . 1 . . . . A 17 DG H4' . 36268 1 163 . 1 . 1 17 17 DG H5' H 1 4.054 . . . . . . . A 17 DG H5' . 36268 1 164 . 1 . 1 17 17 DG H5'' H 1 3.926 . . . . . . . A 17 DG H5'' . 36268 1 165 . 1 . 1 17 17 DG H8 H 1 7.693 . . 1 . . . . A 17 DG H8 . 36268 1 166 . 1 . 1 18 18 DG H1 H 1 10.52 . . 1 . . . . A 18 DG H1 . 36268 1 167 . 1 . 1 18 18 DG H1' H 1 6.271 . . 1 . . . . A 18 DG H1' . 36268 1 168 . 1 . 1 18 18 DG H2' H 1 2.534 . . . . . . . A 18 DG H2' . 36268 1 169 . 1 . 1 18 18 DG H2'' H 1 2.598 . . . . . . . A 18 DG H2'' . 36268 1 170 . 1 . 1 18 18 DG H3' H 1 5.056 . . 1 . . . . A 18 DG H3' . 36268 1 171 . 1 . 1 18 18 DG H4' H 1 4.268 . . 1 . . . . A 18 DG H4' . 36268 1 172 . 1 . 1 18 18 DG H5' H 1 4.075 . . . . . . . A 18 DG H5' . 36268 1 173 . 1 . 1 18 18 DG H5'' H 1 3.952 . . . . . . . A 18 DG H5'' . 36268 1 174 . 1 . 1 18 18 DG H8 H 1 7.551 . . 1 . . . . A 18 DG H8 . 36268 1 175 . 1 . 1 19 19 DT H1' H 1 6.260 . . 1 . . . . A 19 DT H1' . 36268 1 176 . 1 . 1 19 19 DT H2' H 1 2.303 . . . . . . . A 19 DT H2' . 36268 1 177 . 1 . 1 19 19 DT H2'' H 1 2.607 . . . . . . . A 19 DT H2'' . 36268 1 178 . 1 . 1 19 19 DT H3' H 1 4.853 . . 1 . . . . A 19 DT H3' . 36268 1 179 . 1 . 1 19 19 DT H4' H 1 4.383 . . 1 . . . . A 19 DT H4' . 36268 1 180 . 1 . 1 19 19 DT H5' H 1 4.220 . . . . . . . A 19 DT H5' . 36268 1 181 . 1 . 1 19 19 DT H5'' H 1 4.102 . . . . . . . A 19 DT H5'' . 36268 1 182 . 1 . 1 19 19 DT H6 H 1 7.743 . . 1 . . . . A 19 DT H6 . 36268 1 183 . 1 . 1 19 19 DT H71 H 1 1.921 . . 1 . . . . A 19 DT H71 . 36268 1 184 . 1 . 1 19 19 DT H72 H 1 1.921 . . 1 . . . . A 19 DT H72 . 36268 1 185 . 1 . 1 19 19 DT H73 H 1 1.921 . . 1 . . . . A 19 DT H73 . 36268 1 186 . 1 . 1 20 20 DT H1' H 1 6.470 . . 1 . . . . A 20 DT H1' . 36268 1 187 . 1 . 1 20 20 DT H2' H 1 2.277 . . . . . . . A 20 DT H2' . 36268 1 188 . 1 . 1 20 20 DT H2'' H 1 2.570 . . . . . . . A 20 DT H2'' . 36268 1 189 . 1 . 1 20 20 DT H3' H 1 5.063 . . 1 . . . . A 20 DT H3' . 36268 1 190 . 1 . 1 20 20 DT H4' H 1 4.470 . . 1 . . . . A 20 DT H4' . 36268 1 191 . 1 . 1 20 20 DT H5' H 1 4.220 . . . . . . . A 20 DT H5' . 36268 1 192 . 1 . 1 20 20 DT H5'' H 1 4.153 . . . . . . . A 20 DT H5'' . 36268 1 193 . 1 . 1 20 20 DT H6 H 1 7.872 . . 1 . . . . A 20 DT H6 . 36268 1 194 . 1 . 1 20 20 DT H71 H 1 1.916 . . 1 . . . . A 20 DT H71 . 36268 1 195 . 1 . 1 20 20 DT H72 H 1 1.916 . . 1 . . . . A 20 DT H72 . 36268 1 196 . 1 . 1 20 20 DT H73 H 1 1.916 . . 1 . . . . A 20 DT H73 . 36268 1 197 . 1 . 1 21 21 DA H1' H 1 6.262 . . 1 . . . . A 21 DA H1' . 36268 1 198 . 1 . 1 21 21 DA H2 H 1 7.652 . . 1 . . . . A 21 DA H2 . 36268 1 199 . 1 . 1 21 21 DA H2' H 1 2.428 . . . . . . . A 21 DA H2' . 36268 1 200 . 1 . 1 21 21 DA H2'' H 1 2.244 . . . . . . . A 21 DA H2'' . 36268 1 201 . 1 . 1 21 21 DA H3' H 1 4.861 . . 1 . . . . A 21 DA H3' . 36268 1 202 . 1 . 1 21 21 DA H4' H 1 4.437 . . 1 . . . . A 21 DA H4' . 36268 1 203 . 1 . 1 21 21 DA H5' H 1 4.212 . . . . . . . A 21 DA H5' . 36268 1 204 . 1 . 1 21 21 DA H5'' H 1 4.212 . . . . . . . A 21 DA H5'' . 36268 1 205 . 1 . 1 21 21 DA H8 H 1 7.963 . . 1 . . . . A 21 DA H8 . 36268 1 206 . 1 . 1 22 22 DG H1 H 1 11.44 . . 1 . . . . A 22 DG H1 . 36268 1 207 . 1 . 1 22 22 DG H1' H 1 5.367 . . 1 . . . . A 22 DG H1' . 36268 1 208 . 1 . 1 22 22 DG H2' H 1 2.653 . . . . . . . A 22 DG H2' . 36268 1 209 . 1 . 1 22 22 DG H2'' H 1 3.322 . . . . . . . A 22 DG H2'' . 36268 1 210 . 1 . 1 22 22 DG H3' H 1 4.681 . . 1 . . . . A 22 DG H3' . 36268 1 211 . 1 . 1 22 22 DG H4' H 1 4.362 . . 1 . . . . A 22 DG H4' . 36268 1 212 . 1 . 1 22 22 DG H5' H 1 4.123 . . . . . . . A 22 DG H5' . 36268 1 213 . 1 . 1 22 22 DG H5'' H 1 3.935 . . . . . . . A 22 DG H5'' . 36268 1 214 . 1 . 1 22 22 DG H8 H 1 7.135 . . 1 . . . . A 22 DG H8 . 36268 1 215 . 1 . 1 23 23 DG H1 H 1 11.32 . . 1 . . . . A 23 DG H1 . 36268 1 216 . 1 . 1 23 23 DG H1' H 1 5.681 . . 1 . . . . A 23 DG H1' . 36268 1 217 . 1 . 1 23 23 DG H2' H 1 2.643 . . . . . . . A 23 DG H2' . 36268 1 218 . 1 . 1 23 23 DG H2'' H 1 2.572 . . . . . . . A 23 DG H2'' . 36268 1 219 . 1 . 1 23 23 DG H3' H 1 4.975 . . 1 . . . . A 23 DG H3' . 36268 1 220 . 1 . 1 23 23 DG H4' H 1 4.232 . . 1 . . . . A 23 DG H4' . 36268 1 221 . 1 . 1 23 23 DG H5' H 1 4.124 . . . . . . . A 23 DG H5' . 36268 1 222 . 1 . 1 23 23 DG H5'' H 1 4.124 . . . . . . . A 23 DG H5'' . 36268 1 223 . 1 . 1 23 23 DG H8 H 1 7.971 . . 1 . . . . A 23 DG H8 . 36268 1 224 . 1 . 1 24 24 DG H1 H 1 11.17 . . 1 . . . . A 24 DG H1 . 36268 1 225 . 1 . 1 24 24 DG H1' H 1 6.166 . . 1 . . . . A 24 DG H1' . 36268 1 226 . 1 . 1 24 24 DG H2' H 1 2.430 . . . . . . . A 24 DG H2' . 36268 1 227 . 1 . 1 24 24 DG H2'' H 1 2.723 . . . . . . . A 24 DG H2'' . 36268 1 228 . 1 . 1 24 24 DG H3' H 1 4.809 . . 1 . . . . A 24 DG H3' . 36268 1 229 . 1 . 1 24 24 DG H4' H 1 4.420 . . 1 . . . . A 24 DG H4' . 36268 1 230 . 1 . 1 24 24 DG H5' H 1 4.181 . . . . . . . A 24 DG H5' . 36268 1 231 . 1 . 1 24 24 DG H5'' H 1 4.065 . . . . . . . A 24 DG H5'' . 36268 1 232 . 1 . 1 24 24 DG H8 H 1 7.653 . . 1 . . . . A 24 DG H8 . 36268 1 233 . 1 . 1 25 25 DT H1' H 1 6.040 . . 1 . . . . A 25 DT H1' . 36268 1 234 . 1 . 1 25 25 DT H2' H 1 2.063 . . . . . . . A 25 DT H2' . 36268 1 235 . 1 . 1 25 25 DT H2'' H 1 2.381 . . . . . . . A 25 DT H2'' . 36268 1 236 . 1 . 1 25 25 DT H3' H 1 4.719 . . 1 . . . . A 25 DT H3' . 36268 1 237 . 1 . 1 25 25 DT H4' H 1 4.201 . . 1 . . . . A 25 DT H4' . 36268 1 238 . 1 . 1 25 25 DT H5' H 1 4.062 . . . . . . . A 25 DT H5' . 36268 1 239 . 1 . 1 25 25 DT H5'' H 1 3.922 . . . . . . . A 25 DT H5'' . 36268 1 240 . 1 . 1 25 25 DT H6 H 1 7.272 . . 1 . . . . A 25 DT H6 . 36268 1 241 . 1 . 1 25 25 DT H71 H 1 1.331 . . 1 . . . . A 25 DT H71 . 36268 1 242 . 1 . 1 25 25 DT H72 H 1 1.331 . . 1 . . . . A 25 DT H72 . 36268 1 243 . 1 . 1 25 25 DT H73 H 1 1.331 . . 1 . . . . A 25 DT H73 . 36268 1 244 . 1 . 1 26 26 DT H1' H 1 5.657 . . 1 . . . . A 26 DT H1' . 36268 1 245 . 1 . 1 26 26 DT H2' H 1 1.978 . . . . . . . A 26 DT H2' . 36268 1 246 . 1 . 1 26 26 DT H2'' H 1 1.978 . . . . . . . A 26 DT H2'' . 36268 1 247 . 1 . 1 26 26 DT H3' H 1 4.352 . . 1 . . . . A 26 DT H3' . 36268 1 248 . 1 . 1 26 26 DT H4' H 1 4.034 . . 1 . . . . A 26 DT H4' . 36268 1 249 . 1 . 1 26 26 DT H5' H 1 3.927 . . . . . . . A 26 DT H5' . 36268 1 250 . 1 . 1 26 26 DT H5'' H 1 3.782 . . . . . . . A 26 DT H5'' . 36268 1 251 . 1 . 1 26 26 DT H6 H 1 7.233 . . 1 . . . . A 26 DT H6 . 36268 1 252 . 1 . 1 26 26 DT H71 H 1 1.488 . . 1 . . . . A 26 DT H71 . 36268 1 253 . 1 . 1 26 26 DT H72 H 1 1.488 . . 1 . . . . A 26 DT H72 . 36268 1 254 . 1 . 1 26 26 DT H73 H 1 1.488 . . 1 . . . . A 26 DT H73 . 36268 1 stop_ save_