################################### # 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 34587 _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 NOESY' . . . 34587 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 DA H1' H 1 5.941 0.020 . . . . . . A 1 DA H1' . 34587 1 2 . 1 . 1 1 1 DA H2' H 1 2.469 0.020 . . . . . . A 1 DA H2' . 34587 1 3 . 1 . 1 1 1 DA H2'' H 1 2.602 0.020 . . . . . . A 1 DA H2'' . 34587 1 4 . 1 . 1 1 1 DA H3' H 1 4.821 0.020 . . . . . . A 1 DA H3' . 34587 1 5 . 1 . 1 1 1 DA H4' H 1 4.182 0.020 . . . . . . A 1 DA H4' . 34587 1 6 . 1 . 1 1 1 DA H5' H 1 3.680 0.020 . . . . . . A 1 DA H5' . 34587 1 7 . 1 . 1 1 1 DA H5'' H 1 3.663 0.020 . . . . . . A 1 DA H5'' . 34587 1 8 . 1 . 1 1 1 DA H8 H 1 8.000 0.020 . . . . . . A 1 DA H8 . 34587 1 9 . 1 . 1 1 1 DA C1' C 13 84.217 0.300 . . . . . . A 1 DA C1' . 34587 1 10 . 1 . 1 1 1 DA C4' C 13 86.686 0.300 . . . . . . A 1 DA C4' . 34587 1 11 . 1 . 1 1 1 DA C5' C 13 61.500 0.300 . . . . . . A 1 DA C5' . 34587 1 12 . 1 . 1 1 1 DA C8 C 13 139.509 0.300 . . . . . . A 1 DA C8 . 34587 1 13 . 1 . 1 2 2 DG H1' H 1 5.779 0.020 . . . . . . A 2 DG H1' . 34587 1 14 . 1 . 1 2 2 DG H2' H 1 2.641 0.020 . . . . . . A 2 DG H2' . 34587 1 15 . 1 . 1 2 2 DG H2'' H 1 2.682 0.020 . . . . . . A 2 DG H2'' . 34587 1 16 . 1 . 1 2 2 DG H3' H 1 4.953 0.020 . . . . . . A 2 DG H3' . 34587 1 17 . 1 . 1 2 2 DG H4' H 1 4.355 0.020 . . . . . . A 2 DG H4' . 34587 1 18 . 1 . 1 2 2 DG H5' H 1 4.364 0.020 . . . . . . A 2 DG H5' . 34587 1 19 . 1 . 1 2 2 DG H5'' H 1 4.172 0.020 . . . . . . A 2 DG H5'' . 34587 1 20 . 1 . 1 2 2 DG H8 H 1 7.858 0.020 . . . . . . A 2 DG H8 . 34587 1 21 . 1 . 1 2 2 DG C1' C 13 81.402 0.300 . . . . . . A 2 DG C1' . 34587 1 22 . 1 . 1 2 2 DG C2' C 13 36.546 0.300 . . . . . . A 2 DG C2' . 34587 1 23 . 1 . 1 2 2 DG C3' C 13 76.366 0.300 . . . . . . A 2 DG C3' . 34587 1 24 . 1 . 1 2 2 DG C4' C 13 84.450 0.300 . . . . . . A 2 DG C4' . 34587 1 25 . 1 . 1 2 2 DG C8 C 13 135.048 0.300 . . . . . . A 2 DG C8 . 34587 1 26 . 1 . 1 3 3 DC H1' H 1 5.505 0.020 . . . . . . A 3 DC H1' . 34587 1 27 . 1 . 1 3 3 DC H2' H 1 1.977 0.020 . . . . . . A 3 DC H2' . 34587 1 28 . 1 . 1 3 3 DC H2'' H 1 2.352 0.020 . . . . . . A 3 DC H2'' . 34587 1 29 . 1 . 1 3 3 DC H3' H 1 4.815 0.020 . . . . . . A 3 DC H3' . 34587 1 30 . 1 . 1 3 3 DC H4' H 1 4.167 0.020 . . . . . . A 3 DC H4' . 34587 1 31 . 1 . 1 3 3 DC H5 H 1 5.355 0.020 . . . . . . A 3 DC H5 . 34587 1 32 . 1 . 1 3 3 DC H6 H 1 7.341 0.020 . . . . . . A 3 DC H6 . 34587 1 33 . 1 . 1 3 3 DC C1' C 13 83.393 0.300 . . . . . . A 3 DC C1' . 34587 1 34 . 1 . 1 3 3 DC C2' C 13 38.625 0.300 . . . . . . A 3 DC C2' . 34587 1 35 . 1 . 1 3 3 DC C3' C 13 76.947 0.300 . . . . . . A 3 DC C3' . 34587 1 36 . 1 . 1 3 3 DC C4' C 13 82.927 0.300 . . . . . . A 3 DC C4' . 34587 1 37 . 1 . 1 3 3 DC C5 C 13 95.465 0.300 . . . . . . A 3 DC C5 . 34587 1 38 . 1 . 1 3 3 DC C6 C 13 139.516 0.300 . . . . . . A 3 DC C6 . 34587 1 39 . 1 . 1 4 4 DA H1' H 1 5.965 0.020 . . . . . . A 4 DA H1' . 34587 1 40 . 1 . 1 4 4 DA H2' H 1 2.790 0.020 . . . . . . A 4 DA H2' . 34587 1 41 . 1 . 1 4 4 DA H2'' H 1 2.939 0.020 . . . . . . A 4 DA H2'' . 34587 1 42 . 1 . 1 4 4 DA H3' H 1 5.061 0.020 . . . . . . A 4 DA H3' . 34587 1 43 . 1 . 1 4 4 DA H4' H 1 4.416 0.020 . . . . . . A 4 DA H4' . 34587 1 44 . 1 . 1 4 4 DA H5' H 1 4.142 0.020 . . . . . . A 4 DA H5' . 34587 1 45 . 1 . 1 4 4 DA H5'' H 1 4.038 0.020 . . . . . . A 4 DA H5'' . 34587 1 46 . 1 . 1 4 4 DA H8 H 1 8.252 0.020 . . . . . . A 4 DA H8 . 34587 1 47 . 1 . 1 4 4 DA C1' C 13 81.734 0.300 . . . . . . A 4 DA C1' . 34587 1 48 . 1 . 1 4 4 DA C2' C 13 37.804 0.300 . . . . . . A 4 DA C2' . 34587 1 49 . 1 . 1 4 4 DA C3' C 13 76.957 0.300 . . . . . . A 4 DA C3' . 34587 1 50 . 1 . 1 4 4 DA C4' C 13 84.683 0.300 . . . . . . A 4 DA C4' . 34587 1 51 . 1 . 1 5 5 DA H1' H 1 6.181 0.020 . . . . . . A 5 DA H1' . 34587 1 52 . 1 . 1 5 5 DA H2' H 1 2.576 0.020 . . . . . . A 5 DA H2' . 34587 1 53 . 1 . 1 5 5 DA H2'' H 1 2.918 0.020 . . . . . . A 5 DA H2'' . 34587 1 54 . 1 . 1 5 5 DA H3' H 1 4.992 0.020 . . . . . . A 5 DA H3' . 34587 1 55 . 1 . 1 5 5 DA H4' H 1 4.475 0.020 . . . . . . A 5 DA H4' . 34587 1 56 . 1 . 1 5 5 DA H5'' H 1 4.259 0.020 . . . . . . A 5 DA H5'' . 34587 1 57 . 1 . 1 5 5 DA H8 H 1 8.194 0.020 . . . . . . A 5 DA H8 . 34587 1 58 . 1 . 1 5 5 DA C1' C 13 81.870 0.300 . . . . . . A 5 DA C1' . 34587 1 59 . 1 . 1 5 5 DA C2' C 13 38.390 0.300 . . . . . . A 5 DA C2' . 34587 1 60 . 1 . 1 5 5 DA C3' C 13 75.545 0.300 . . . . . . A 5 DA C3' . 34587 1 61 . 1 . 1 5 5 DA C4' C 13 84.097 0.300 . . . . . . A 5 DA C4' . 34587 1 62 . 1 . 1 5 5 DA C8 C 13 138.265 0.300 . . . . . . A 5 DA C8 . 34587 1 63 . 1 . 1 6 6 DT H1' H 1 5.881 0.020 . . . . . . A 6 DT H1' . 34587 1 64 . 1 . 1 6 6 DT H2' H 1 2.011 0.020 . . . . . . A 6 DT H2' . 34587 1 65 . 1 . 1 6 6 DT H2'' H 1 2.442 0.020 . . . . . . A 6 DT H2'' . 34587 1 66 . 1 . 1 6 6 DT H3' H 1 4.831 0.020 . . . . . . A 6 DT H3' . 34587 1 67 . 1 . 1 6 6 DT H4' H 1 4.173 0.020 . . . . . . A 6 DT H4' . 34587 1 68 . 1 . 1 6 6 DT H6 H 1 7.127 0.020 . . . . . . A 6 DT H6 . 34587 1 69 . 1 . 1 6 6 DT H71 H 1 1.325 0.020 . . . . . . A 6 DT H7 . 34587 1 70 . 1 . 1 6 6 DT H72 H 1 1.325 0.020 . . . . . . A 6 DT H7 . 34587 1 71 . 1 . 1 6 6 DT H73 H 1 1.325 0.020 . . . . . . A 6 DT H7 . 34587 1 72 . 1 . 1 6 6 DT C1' C 13 82.107 0.300 . . . . . . A 6 DT C1' . 34587 1 73 . 1 . 1 6 6 DT C2' C 13 38.743 0.300 . . . . . . A 6 DT C2' . 34587 1 74 . 1 . 1 6 6 DT C4' C 13 82.217 0.300 . . . . . . A 6 DT C4' . 34587 1 75 . 1 . 1 6 6 DT C6 C 13 135.454 0.300 . . . . . . A 6 DT C6 . 34587 1 76 . 1 . 1 7 7 DC H1' H 1 6.032 0.020 . . . . . . A 7 DC H1' . 34587 1 77 . 1 . 1 7 7 DC H2' H 1 2.118 0.020 . . . . . . A 7 DC H2' . 34587 1 78 . 1 . 1 7 7 DC H2'' H 1 2.333 0.020 . . . . . . A 7 DC H2'' . 34587 1 79 . 1 . 1 7 7 DC H3' H 1 4.811 0.020 . . . . . . A 7 DC H3' . 34587 1 80 . 1 . 1 7 7 DC H4' H 1 4.147 0.020 . . . . . . A 7 DC H4' . 34587 1 81 . 1 . 1 7 7 DC H5 H 1 5.608 0.020 . . . . . . A 7 DC H5 . 34587 1 82 . 1 . 1 7 7 DC H5'' H 1 4.078 0.020 . . . . . . A 7 DC H5'' . 34587 1 83 . 1 . 1 7 7 DC H6 H 1 7.525 0.020 . . . . . . A 7 DC H6 . 34587 1 84 . 1 . 1 7 7 DC C1' C 13 83.535 0.300 . . . . . . A 7 DC C1' . 34587 1 85 . 1 . 1 7 7 DC C2' C 13 36.986 0.300 . . . . . . A 7 DC C2' . 34587 1 86 . 1 . 1 7 7 DC C3' C 13 73.315 0.300 . . . . . . A 7 DC C3' . 34587 1 87 . 1 . 1 7 7 DC C4' C 13 82.691 0.300 . . . . . . A 7 DC C4' . 34587 1 88 . 1 . 1 7 7 DC C5 C 13 95.934 0.300 . . . . . . A 7 DC C5 . 34587 1 89 . 1 . 1 7 7 DC C6 C 13 140.914 0.300 . . . . . . A 7 DC C6 . 34587 1 90 . 1 . 1 8 8 DC H1' H 1 6.127 0.020 . . . . . . A 8 DC H1' . 34587 1 91 . 1 . 1 8 8 DC H2' H 1 2.449 0.020 . . . . . . A 8 DC H2' . 34587 1 92 . 1 . 1 8 8 DC H2'' H 1 2.338 0.020 . . . . . . A 8 DC H2'' . 34587 1 93 . 1 . 1 8 8 DC H3' H 1 4.853 0.020 . . . . . . A 8 DC H3' . 34587 1 94 . 1 . 1 8 8 DC H4' H 1 4.271 0.020 . . . . . . A 8 DC H4' . 34587 1 95 . 1 . 1 8 8 DC H5 H 1 5.834 0.020 . . . . . . A 8 DC H5 . 34587 1 96 . 1 . 1 8 8 DC H5' H 1 4.152 0.020 . . . . . . A 8 DC H5' . 34587 1 97 . 1 . 1 8 8 DC H5'' H 1 4.076 0.020 . . . . . . A 8 DC H5'' . 34587 1 98 . 1 . 1 8 8 DC H6 H 1 7.746 0.020 . . . . . . A 8 DC H6 . 34587 1 99 . 1 . 1 8 8 DC C1' C 13 84.449 0.300 . . . . . . A 8 DC C1' . 34587 1 100 . 1 . 1 8 8 DC C3' C 13 74.268 0.300 . . . . . . A 8 DC C3' . 34587 1 101 . 1 . 1 8 8 DC C4' C 13 83.160 0.300 . . . . . . A 8 DC C4' . 34587 1 102 . 1 . 1 8 8 DC C5 C 13 95.815 0.300 . . . . . . A 8 DC C5 . 34587 1 103 . 1 . 1 8 8 DC C6 C 13 141.234 0.300 . . . . . . A 8 DC C6 . 34587 1 104 . 1 . 1 9 9 XC H1' H 1 5.952 0.020 . . . . . . A 9 XC H1' . 34587 1 105 . 1 . 1 9 9 XC H2' H 1 2.590 0.020 . . . . . . A 9 XC H2' . 34587 1 106 . 1 . 1 9 9 XC H2'' H 1 2.282 0.020 . . . . . . A 9 XC H2'' . 34587 1 107 . 1 . 1 9 9 XC H3' H 1 4.764 0.020 . . . . . . A 9 XC H3' . 34587 1 108 . 1 . 1 9 9 XC H4' H 1 4.354 0.020 . . . . . . A 9 XC H4' . 34587 1 109 . 1 . 1 9 9 XC H5 H 1 5.836 0.020 . . . . . . A 9 XC H5 . 34587 1 110 . 1 . 1 9 9 XC H6 H 1 7.809 0.020 . . . . . . A 9 XC H6 . 34587 1 111 . 1 . 1 9 9 XC C1' C 13 86.677 0.300 . . . . . . A 9 XC C1' . 34587 1 112 . 1 . 1 9 9 XC C4' C 13 83.516 0.300 . . . . . . A 9 XC C4' . 34587 1 113 . 1 . 1 10 10 XC H1' H 1 5.988 0.020 . . . . . . A 10 XC H1' . 34587 1 114 . 1 . 1 10 10 XC H2' H 1 2.138 0.020 . . . . . . A 10 XC H2' . 34587 1 115 . 1 . 1 10 10 XC H2'' H 1 2.568 0.020 . . . . . . A 10 XC H2'' . 34587 1 116 . 1 . 1 10 10 XC H3' H 1 4.643 0.020 . . . . . . A 10 XC H3' . 34587 1 117 . 1 . 1 10 10 XC H4' H 1 3.995 0.020 . . . . . . A 10 XC H4' . 34587 1 118 . 1 . 1 10 10 XC H5 H 1 5.862 0.020 . . . . . . A 10 XC H5 . 34587 1 119 . 1 . 1 10 10 XC H5' H 1 4.005 0.020 . . . . . . A 10 XC H5' . 34587 1 120 . 1 . 1 10 10 XC H5'' H 1 3.829 0.020 . . . . . . A 10 XC H5'' . 34587 1 121 . 1 . 1 10 10 XC H6 H 1 7.613 0.020 . . . . . . A 10 XC H6 . 34587 1 122 . 1 . 1 10 10 XC C1' C 13 85.151 0.300 . . . . . . A 10 XC C1' . 34587 1 123 . 1 . 1 10 10 XC C4' C 13 82.221 0.300 . . . . . . A 10 XC C4' . 34587 1 124 . 1 . 1 10 10 XC C5' C 13 63.700 0.300 . . . . . . A 10 XC C5' . 34587 1 125 . 1 . 1 11 11 XC H1' H 1 5.817 0.020 . . . . . . A 11 XC H1' . 34587 1 126 . 1 . 1 11 11 XC H2' H 1 2.440 0.020 . . . . . . A 11 XC H2' . 34587 1 127 . 1 . 1 11 11 XC H2'' H 1 2.156 0.020 . . . . . . A 11 XC H2'' . 34587 1 128 . 1 . 1 11 11 XC H3' H 1 4.650 0.020 . . . . . . A 11 XC H3' . 34587 1 129 . 1 . 1 11 11 XC H4' H 1 4.109 0.020 . . . . . . A 11 XC H4' . 34587 1 130 . 1 . 1 11 11 XC H5 H 1 5.990 0.020 . . . . . . A 11 XC H5 . 34587 1 131 . 1 . 1 11 11 XC H5' H 1 4.000 0.020 . . . . . . A 11 XC H5' . 34587 1 132 . 1 . 1 11 11 XC H6 H 1 7.622 0.020 . . . . . . A 11 XC H6 . 34587 1 133 . 1 . 1 11 11 XC C1' C 13 86.444 0.300 . . . . . . A 11 XC C1' . 34587 1 134 . 1 . 1 11 11 XC C4' C 13 83.282 0.300 . . . . . . A 11 XC C4' . 34587 1 135 . 1 . 1 12 12 XC H1' H 1 5.990 0.020 . . . . . . A 12 XC H1' . 34587 1 136 . 1 . 1 12 12 XC H2' H 1 2.362 0.020 . . . . . . A 12 XC H2' . 34587 1 137 . 1 . 1 12 12 XC H2'' H 1 2.584 0.020 . . . . . . A 12 XC H2'' . 34587 1 138 . 1 . 1 12 12 XC H3' H 1 4.629 0.020 . . . . . . A 12 XC H3' . 34587 1 139 . 1 . 1 12 12 XC H4' H 1 4.031 0.020 . . . . . . A 12 XC H4' . 34587 1 140 . 1 . 1 12 12 XC H5 H 1 5.878 0.020 . . . . . . A 12 XC H5 . 34587 1 141 . 1 . 1 12 12 XC H5' H 1 3.927 0.020 . . . . . . A 12 XC H5' . 34587 1 142 . 1 . 1 12 12 XC H5'' H 1 3.630 0.020 . . . . . . A 12 XC H5'' . 34587 1 143 . 1 . 1 12 12 XC H6 H 1 7.667 0.020 . . . . . . A 12 XC H6 . 34587 1 144 . 1 . 1 12 12 XC C1' C 13 85.607 0.300 . . . . . . A 12 XC C1' . 34587 1 145 . 1 . 1 12 12 XC C4' C 13 82.458 0.300 . . . . . . A 12 XC C4' . 34587 1 146 . 1 . 1 12 12 XC C5' C 13 64.220 0.300 . . . . . . A 12 XC C5' . 34587 1 147 . 1 . 1 13 13 DG H1' H 1 5.430 0.020 . . . . . . A 13 DG H1' . 34587 1 148 . 1 . 1 13 13 DG H2' H 1 2.592 0.020 . . . . . . A 13 DG H2' . 34587 1 149 . 1 . 1 13 13 DG H2'' H 1 2.714 0.020 . . . . . . A 13 DG H2'' . 34587 1 150 . 1 . 1 13 13 DG H3' H 1 4.831 0.020 . . . . . . A 13 DG H3' . 34587 1 151 . 1 . 1 13 13 DG H4' H 1 4.129 0.020 . . . . . . A 13 DG H4' . 34587 1 152 . 1 . 1 13 13 DG H5' H 1 3.854 0.020 . . . . . . A 13 DG H5' . 34587 1 153 . 1 . 1 13 13 DG H5'' H 1 3.707 0.020 . . . . . . A 13 DG H5'' . 34587 1 154 . 1 . 1 13 13 DG H8 H 1 7.887 0.020 . . . . . . A 13 DG H8 . 34587 1 155 . 1 . 1 13 13 DG C1' C 13 81.874 0.300 . . . . . . A 13 DG C1' . 34587 1 156 . 1 . 1 13 13 DG C4' C 13 84.572 0.300 . . . . . . A 13 DG C4' . 34587 1 157 . 1 . 1 13 13 DG C5' C 13 65.292 0.300 . . . . . . A 13 DG C5' . 34587 1 158 . 1 . 1 14 14 DG H1' H 1 5.678 0.020 . . . . . . A 14 DG H1' . 34587 1 159 . 1 . 1 14 14 DG H2' H 1 2.729 0.020 . . . . . . A 14 DG H2' . 34587 1 160 . 1 . 1 14 14 DG H2'' H 1 2.827 0.020 . . . . . . A 14 DG H2'' . 34587 1 161 . 1 . 1 14 14 DG H3' H 1 5.038 0.020 . . . . . . A 14 DG H3' . 34587 1 162 . 1 . 1 14 14 DG H4' H 1 4.435 0.020 . . . . . . A 14 DG H4' . 34587 1 163 . 1 . 1 14 14 DG H5' H 1 4.442 0.020 . . . . . . A 14 DG H5' . 34587 1 164 . 1 . 1 14 14 DG H5'' H 1 4.098 0.020 . . . . . . A 14 DG H5'' . 34587 1 165 . 1 . 1 14 14 DG H8 H 1 7.868 0.020 . . . . . . A 14 DG H8 . 34587 1 166 . 1 . 1 14 14 DG C1' C 13 81.098 0.300 . . . . . . A 14 DG C1' . 34587 1 167 . 1 . 1 14 14 DG C2' C 13 37.455 0.300 . . . . . . A 14 DG C2' . 34587 1 168 . 1 . 1 14 14 DG C4' C 13 84.492 0.300 . . . . . . A 14 DG C4' . 34587 1 169 . 1 . 1 15 15 DA H1' H 1 6.300 0.020 . . . . . . A 15 DA H1' . 34587 1 170 . 1 . 1 15 15 DA H2' H 1 2.705 0.020 . . . . . . A 15 DA H2' . 34587 1 171 . 1 . 1 15 15 DA H2'' H 1 2.976 0.020 . . . . . . A 15 DA H2'' . 34587 1 172 . 1 . 1 15 15 DA H3' H 1 5.041 0.020 . . . . . . A 15 DA H3' . 34587 1 173 . 1 . 1 15 15 DA H4' H 1 4.510 0.020 . . . . . . A 15 DA H4' . 34587 1 174 . 1 . 1 15 15 DA H5' H 1 4.516 0.020 . . . . . . A 15 DA H5' . 34587 1 175 . 1 . 1 15 15 DA H5'' H 1 4.251 0.020 . . . . . . A 15 DA H5'' . 34587 1 176 . 1 . 1 15 15 DA H8 H 1 8.259 0.020 . . . . . . A 15 DA H8 . 34587 1 177 . 1 . 1 15 15 DA C1' C 13 82.106 0.300 . . . . . . A 15 DA C1' . 34587 1 178 . 1 . 1 15 15 DA C2' C 13 38.509 0.300 . . . . . . A 15 DA C2' . 34587 1 179 . 1 . 1 15 15 DA C4' C 13 84.713 0.300 . . . . . . A 15 DA C4' . 34587 1 180 . 1 . 1 15 15 DA C8 C 13 138.578 0.300 . . . . . . A 15 DA C8 . 34587 1 181 . 1 . 1 16 16 DT H1' H 1 5.950 0.020 . . . . . . A 16 DT H1' . 34587 1 182 . 1 . 1 16 16 DT H2' H 1 2.000 0.020 . . . . . . A 16 DT H2' . 34587 1 183 . 1 . 1 16 16 DT H2'' H 1 2.559 0.020 . . . . . . A 16 DT H2'' . 34587 1 184 . 1 . 1 16 16 DT H3' H 1 4.840 0.020 . . . . . . A 16 DT H3' . 34587 1 185 . 1 . 1 16 16 DT H4' H 1 4.212 0.020 . . . . . . A 16 DT H4' . 34587 1 186 . 1 . 1 16 16 DT H5' H 1 4.180 0.020 . . . . . . A 16 DT H5' . 34587 1 187 . 1 . 1 16 16 DT H5'' H 1 4.154 0.020 . . . . . . A 16 DT H5'' . 34587 1 188 . 1 . 1 16 16 DT H6 H 1 7.195 0.020 . . . . . . A 16 DT H6 . 34587 1 189 . 1 . 1 16 16 DT H71 H 1 1.321 0.020 . . . . . . A 16 DT H7 . 34587 1 190 . 1 . 1 16 16 DT H72 H 1 1.321 0.020 . . . . . . A 16 DT H7 . 34587 1 191 . 1 . 1 16 16 DT H73 H 1 1.321 0.020 . . . . . . A 16 DT H7 . 34587 1 192 . 1 . 1 16 16 DT C1' C 13 82.213 0.300 . . . . . . A 16 DT C1' . 34587 1 193 . 1 . 1 16 16 DT C2' C 13 36.166 0.300 . . . . . . A 16 DT C2' . 34587 1 194 . 1 . 1 16 16 DT C3' C 13 76.243 0.300 . . . . . . A 16 DT C3' . 34587 1 195 . 1 . 1 16 16 DT C4' C 13 82.840 0.300 . . . . . . A 16 DT C4' . 34587 1 196 . 1 . 1 16 16 DT C6 C 13 135.600 0.300 . . . . . . A 16 DT C6 . 34587 1 197 . 1 . 1 17 17 DT H1' H 1 5.872 0.020 . . . . . . A 17 DT H1' . 34587 1 198 . 1 . 1 17 17 DT H2' H 1 2.110 0.020 . . . . . . A 17 DT H2' . 34587 1 199 . 1 . 1 17 17 DT H2'' H 1 2.468 0.020 . . . . . . A 17 DT H2'' . 34587 1 200 . 1 . 1 17 17 DT H3' H 1 4.892 0.020 . . . . . . A 17 DT H3' . 34587 1 201 . 1 . 1 17 17 DT H4' H 1 4.152 0.020 . . . . . . A 17 DT H4' . 34587 1 202 . 1 . 1 17 17 DT H6 H 1 7.302 0.020 . . . . . . A 17 DT H6 . 34587 1 203 . 1 . 1 17 17 DT H71 H 1 1.590 0.020 . . . . . . A 17 DT H7 . 34587 1 204 . 1 . 1 17 17 DT H72 H 1 1.590 0.020 . . . . . . A 17 DT H7 . 34587 1 205 . 1 . 1 17 17 DT H73 H 1 1.590 0.020 . . . . . . A 17 DT H7 . 34587 1 206 . 1 . 1 17 17 DT C1' C 13 82.329 0.300 . . . . . . A 17 DT C1' . 34587 1 207 . 1 . 1 17 17 DT C2' C 13 36.280 0.300 . . . . . . A 17 DT C2' . 34587 1 208 . 1 . 1 17 17 DT C3' C 13 74.724 0.300 . . . . . . A 17 DT C3' . 34587 1 209 . 1 . 1 17 17 DT C4' C 13 82.608 0.300 . . . . . . A 17 DT C4' . 34587 1 210 . 1 . 1 17 17 DT C6 C 13 136.702 0.300 . . . . . . A 17 DT C6 . 34587 1 211 . 1 . 1 18 18 DG H1' H 1 5.838 0.020 . . . . . . A 18 DG H1' . 34587 1 212 . 1 . 1 18 18 DG H2' H 1 2.642 0.020 . . . . . . A 18 DG H2' . 34587 1 213 . 1 . 1 18 18 DG H2'' H 1 2.677 0.020 . . . . . . A 18 DG H2'' . 34587 1 214 . 1 . 1 18 18 DG H3' H 1 4.982 0.020 . . . . . . A 18 DG H3' . 34587 1 215 . 1 . 1 18 18 DG H4' H 1 4.381 0.020 . . . . . . A 18 DG H4' . 34587 1 216 . 1 . 1 18 18 DG H5' H 1 4.387 0.020 . . . . . . A 18 DG H5' . 34587 1 217 . 1 . 1 18 18 DG H5'' H 1 4.110 0.020 . . . . . . A 18 DG H5'' . 34587 1 218 . 1 . 1 18 18 DG H8 H 1 7.895 0.020 . . . . . . A 18 DG H8 . 34587 1 219 . 1 . 1 18 18 DG C1' C 13 81.380 0.300 . . . . . . A 18 DG C1' . 34587 1 220 . 1 . 1 18 18 DG C2' C 13 37.572 0.300 . . . . . . A 18 DG C2' . 34587 1 221 . 1 . 1 18 18 DG C3' C 13 75.952 0.300 . . . . . . A 18 DG C3' . 34587 1 222 . 1 . 1 18 18 DG C4' C 13 84.073 0.300 . . . . . . A 18 DG C4' . 34587 1 223 . 1 . 1 18 18 DG C8 C 13 135.298 0.300 . . . . . . A 18 DG C8 . 34587 1 224 . 1 . 1 19 19 DC H1' H 1 6.083 0.020 . . . . . . A 19 DC H1' . 34587 1 225 . 1 . 1 19 19 DC H2' H 1 2.241 0.020 . . . . . . A 19 DC H2' . 34587 1 226 . 1 . 1 19 19 DC H2'' H 1 2.472 0.020 . . . . . . A 19 DC H2'' . 34587 1 227 . 1 . 1 19 19 DC H3' H 1 4.751 0.020 . . . . . . A 19 DC H3' . 34587 1 228 . 1 . 1 19 19 DC H4' H 1 4.219 0.020 . . . . . . A 19 DC H4' . 34587 1 229 . 1 . 1 19 19 DC H5 H 1 5.433 0.020 . . . . . . A 19 DC H5 . 34587 1 230 . 1 . 1 19 19 DC H6 H 1 7.497 0.020 . . . . . . A 19 DC H6 . 34587 1 231 . 1 . 1 19 19 DC C1' C 13 83.745 0.300 . . . . . . A 19 DC C1' . 34587 1 232 . 1 . 1 19 19 DC C2' C 13 37.455 0.300 . . . . . . A 19 DC C2' . 34587 1 233 . 1 . 1 19 19 DC C3' C 13 72.964 0.300 . . . . . . A 19 DC C3' . 34587 1 234 . 1 . 1 19 19 DC C4' C 13 82.501 0.300 . . . . . . A 19 DC C4' . 34587 1 235 . 1 . 1 19 19 DC C5 C 13 95.464 0.300 . . . . . . A 19 DC C5 . 34587 1 236 . 1 . 1 19 19 DC C6 C 13 139.828 0.300 . . . . . . A 19 DC C6 . 34587 1 237 . 1 . 1 20 20 DT H1' H 1 6.239 0.020 . . . . . . A 20 DT H1' . 34587 1 238 . 1 . 1 20 20 DT H2' H 1 2.268 0.020 . . . . . . A 20 DT H2' . 34587 1 239 . 1 . 1 20 20 DT H2'' H 1 2.470 0.020 . . . . . . A 20 DT H2'' . 34587 1 240 . 1 . 1 20 20 DT H3' H 1 4.550 0.020 . . . . . . A 20 DT H3' . 34587 1 241 . 1 . 1 20 20 DT H4' H 1 4.054 0.020 . . . . . . A 20 DT H4' . 34587 1 242 . 1 . 1 20 20 DT H5' H 1 4.152 0.020 . . . . . . A 20 DT H5' . 34587 1 243 . 1 . 1 20 20 DT H5'' H 1 4.061 0.020 . . . . . . A 20 DT H5'' . 34587 1 244 . 1 . 1 20 20 DT H6 H 1 7.579 0.020 . . . . . . A 20 DT H6 . 34587 1 245 . 1 . 1 20 20 DT H71 H 1 1.727 0.020 . . . . . . A 20 DT H7 . 34587 1 246 . 1 . 1 20 20 DT H72 H 1 1.727 0.020 . . . . . . A 20 DT H7 . 34587 1 247 . 1 . 1 20 20 DT H73 H 1 1.727 0.020 . . . . . . A 20 DT H7 . 34587 1 248 . 1 . 1 20 20 DT C1' C 13 83.745 0.300 . . . . . . A 20 DT C1' . 34587 1 249 . 1 . 1 20 20 DT C2' C 13 38.447 0.300 . . . . . . A 20 DT C2' . 34587 1 250 . 1 . 1 20 20 DT C3' C 13 69.437 0.300 . . . . . . A 20 DT C3' . 34587 1 251 . 1 . 1 20 20 DT C4' C 13 84.274 0.300 . . . . . . A 20 DT C4' . 34587 1 252 . 1 . 1 20 20 DT C6 C 13 137.327 0.300 . . . . . . A 20 DT C6 . 34587 1 stop_ save_