################################### # 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 34398 _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' . . . 34398 1 2 '2D 1H-1H NOESY' . . . 34398 1 3 '2D 1H-1H TOCSY' . . . 34398 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.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 DC H1' H 1 5.741 0.002 . 1 . . . . A 1 DC H1' . 34398 1 2 . 1 1 1 1 DC H2' H 1 1.980 0.003 . 1 . . . . A 1 DC H2' . 34398 1 3 . 1 1 1 1 DC H2'' H 1 2.395 0.002 . 1 . . . . A 1 DC H2'' . 34398 1 4 . 1 1 1 1 DC H3' H 1 4.645 0.001 . 1 . . . . A 1 DC H3' . 34398 1 5 . 1 1 1 1 DC H4' H 1 4.022 0.001 . 1 . . . . A 1 DC H4' . 34398 1 6 . 1 1 1 1 DC H5 H 1 5.851 0.002 . 1 . . . . A 1 DC H5 . 34398 1 7 . 1 1 1 1 DC H5' H 1 3.678 0.002 . 1 . . . . A 1 DC H5' . 34398 1 8 . 1 1 1 1 DC H5'' H 1 3.678 0.002 . 1 . . . . A 1 DC H5'' . 34398 1 9 . 1 1 1 1 DC H6 H 1 7.601 0.003 . 1 . . . . A 1 DC H6 . 34398 1 10 . 1 1 1 1 DC H41 H 1 8.094 0.001 . 1 . . . . A 1 DC H41 . 34398 1 11 . 1 1 1 1 DC H42 H 1 7.040 0.003 . 1 . . . . A 1 DC H42 . 34398 1 12 . 1 1 2 2 DG H1 H 1 12.879 0.003 . 1 . . . . A 2 DG H1 . 34398 1 13 . 1 1 2 2 DG H1' H 1 5.981 0.003 . 1 . . . . A 2 DG H1' . 34398 1 14 . 1 1 2 2 DG H2' H 1 2.625 0.003 . 1 . . . . A 2 DG H2' . 34398 1 15 . 1 1 2 2 DG H2'' H 1 2.770 0.002 . 1 . . . . A 2 DG H2'' . 34398 1 16 . 1 1 2 2 DG H3' H 1 4.916 0.001 . 1 . . . . A 2 DG H3' . 34398 1 17 . 1 1 2 2 DG H4' H 1 4.331 0.001 . 1 . . . . A 2 DG H4' . 34398 1 18 . 1 1 2 2 DG H5' H 1 4.057 0.003 . 1 . . . . A 2 DG H5' . 34398 1 19 . 1 1 2 2 DG H5'' H 1 3.987 0.003 . 1 . . . . A 2 DG H5'' . 34398 1 20 . 1 1 2 2 DG H8 H 1 7.918 0.001 . 1 . . . . A 2 DG H8 . 34398 1 21 . 1 1 3 3 DT H1' H 1 6.022 0.003 . 1 . . . . A 3 DT H1' . 34398 1 22 . 1 1 3 3 DT H2' H 1 2.136 0.002 . 1 . . . . A 3 DT H2' . 34398 1 23 . 1 1 3 3 DT H2'' H 1 2.467 0.003 . 1 . . . . A 3 DT H2'' . 34398 1 24 . 1 1 3 3 DT H3 H 1 13.870 0.004 . 1 . . . . A 3 DT H3 . 34398 1 25 . 1 1 3 3 DT H3' H 1 4.820 0.001 . 1 . . . . A 3 DT H3' . 34398 1 26 . 1 1 3 3 DT H4' H 1 4.237 0.002 . 1 . . . . A 3 DT H4' . 34398 1 27 . 1 1 3 3 DT H5' H 1 4.198 0.002 . 1 . . . . A 3 DT H5' . 34398 1 28 . 1 1 3 3 DT H5'' H 1 4.095 0.003 . 1 . . . . A 3 DT H5'' . 34398 1 29 . 1 1 3 3 DT H6 H 1 7.212 0.002 . 1 . . . . A 3 DT H6 . 34398 1 30 . 1 1 3 3 DT H71 H 1 1.380 0.002 . 1 . . . . A 3 DT H71 . 34398 1 31 . 1 1 3 3 DT H72 H 1 1.380 0.002 . 1 . . . . A 3 DT H72 . 34398 1 32 . 1 1 3 3 DT H73 H 1 1.380 0.002 . 1 . . . . A 3 DT H73 . 34398 1 33 . 1 1 4 4 DC H1' H 1 6.139 0.001 . 1 . . . . A 4 DC H1' . 34398 1 34 . 1 1 4 4 DC H2' H 1 1.881 0.003 . 1 . . . . A 4 DC H2' . 34398 1 35 . 1 1 4 4 DC H2'' H 1 2.457 0.003 . 1 . . . . A 4 DC H2'' . 34398 1 36 . 1 1 4 4 DC H3' H 1 4.775 0.001 . 1 . . . . A 4 DC H3' . 34398 1 37 . 1 1 4 4 DC H4' H 1 4.085 0.003 . 1 . . . . A 4 DC H4' . 34398 1 38 . 1 1 4 4 DC H5 H 1 5.419 0.002 . 1 . . . . A 4 DC H5 . 34398 1 39 . 1 1 4 4 DC H5' H 1 4.108 0.001 . 1 . . . . A 4 DC H5' . 34398 1 40 . 1 1 4 4 DC H5'' H 1 4.056 0.001 . 1 . . . . A 4 DC H5'' . 34398 1 41 . 1 1 4 4 DC H6 H 1 7.395 0.002 . 1 . . . . A 4 DC H6 . 34398 1 42 . 1 1 4 4 DC H41 H 1 7.784 0.006 . 1 . . . . A 4 DC H41 . 34398 1 43 . 1 1 4 4 DC H42 H 1 6.685 0.004 . 1 . . . . A 4 DC H42 . 34398 1 44 . 1 1 5 5 DT H1' H 1 5.756 0.002 . 1 . . . . A 5 DT H1' . 34398 1 45 . 1 1 5 5 DT H2' H 1 2.349 0.000 . 1 . . . . A 5 DT H2' . 34398 1 46 . 1 1 5 5 DT H2'' H 1 2.347 0.000 . 1 . . . . A 5 DT H2'' . 34398 1 47 . 1 1 5 5 DT H3 H 1 14.499 0.003 . 1 . . . . A 5 DT H3 . 34398 1 48 . 1 1 5 5 DT H3' H 1 4.858 0.002 . 1 . . . . A 5 DT H3' . 34398 1 49 . 1 1 5 5 DT H4' H 1 4.207 0.001 . 1 . . . . A 5 DT H4' . 34398 1 50 . 1 1 5 5 DT H5' H 1 4.026 0.001 . 1 . . . . A 5 DT H5' . 34398 1 51 . 1 1 5 5 DT H5'' H 1 4.026 0.001 . 1 . . . . A 5 DT H5'' . 34398 1 52 . 1 1 5 5 DT H6 H 1 7.506 0.002 . 1 . . . . A 5 DT H6 . 34398 1 53 . 1 1 5 5 DT H71 H 1 1.694 0.002 . 1 . . . . A 5 DT H71 . 34398 1 54 . 1 1 5 5 DT H72 H 1 1.694 0.002 . 1 . . . . A 5 DT H72 . 34398 1 55 . 1 1 5 5 DT H73 H 1 1.694 0.002 . 1 . . . . A 5 DT H73 . 34398 1 56 . 1 1 6 6 DC H1' H 1 5.629 0.002 . 1 . . . . A 6 DC H1' . 34398 1 57 . 1 1 6 6 DC H2' H 1 2.047 0.002 . 1 . . . . A 6 DC H2' . 34398 1 58 . 1 1 6 6 DC H2'' H 1 2.391 0.002 . 1 . . . . A 6 DC H2'' . 34398 1 59 . 1 1 6 6 DC H3' H 1 4.759 0.002 . 1 . . . . A 6 DC H3' . 34398 1 60 . 1 1 6 6 DC H4' H 1 4.101 0.003 . 1 . . . . A 6 DC H4' . 34398 1 61 . 1 1 6 6 DC H5 H 1 5.671 0.002 . 1 . . . . A 6 DC H5 . 34398 1 62 . 1 1 6 6 DC H6 H 1 7.515 0.003 . 1 . . . . A 6 DC H6 . 34398 1 63 . 1 1 6 6 DC H41 H 1 8.301 0.003 . 1 . . . . A 6 DC H41 . 34398 1 64 . 1 1 6 6 DC H42 H 1 6.922 0.005 . 1 . . . . A 6 DC H42 . 34398 1 65 . 1 1 7 7 DA H1' H 1 6.139 0.002 . 1 . . . . A 7 DA H1' . 34398 1 66 . 1 1 7 7 DA H2 H 1 7.502 0.002 . 1 . . . . A 7 DA H2 . 34398 1 67 . 1 1 7 7 DA H2' H 1 2.590 0.002 . 1 . . . . A 7 DA H2' . 34398 1 68 . 1 1 7 7 DA H2'' H 1 2.840 0.002 . 1 . . . . A 7 DA H2'' . 34398 1 69 . 1 1 7 7 DA H3' H 1 4.944 0.001 . 1 . . . . A 7 DA H3' . 34398 1 70 . 1 1 7 7 DA H4' H 1 4.340 0.003 . 1 . . . . A 7 DA H4' . 34398 1 71 . 1 1 7 7 DA H5' H 1 4.104 0.003 . 1 . . . . A 7 DA H5' . 34398 1 72 . 1 1 7 7 DA H5'' H 1 4.008 0.003 . 1 . . . . A 7 DA H5'' . 34398 1 73 . 1 1 7 7 DA H8 H 1 8.230 0.002 . 1 . . . . A 7 DA H8 . 34398 1 74 . 1 1 7 7 DA H61 H 1 7.654 0.004 . 1 . . . . A 7 DA H61 . 34398 1 75 . 1 1 7 7 DA H62 H 1 6.251 0.001 . 1 . . . . A 7 DA H62 . 34398 1 76 . 1 1 8 8 DT H1' H 1 5.583 0.002 . 1 . . . . A 8 DT H1' . 34398 1 77 . 1 1 8 8 DT H2' H 1 1.867 0.002 . 1 . . . . A 8 DT H2' . 34398 1 78 . 1 1 8 8 DT H2'' H 1 2.272 0.003 . 1 . . . . A 8 DT H2'' . 34398 1 79 . 1 1 8 8 DT H3 H 1 13.411 0.002 . 1 . . . . A 8 DT H3 . 34398 1 80 . 1 1 8 8 DT H3' H 1 4.773 0.001 . 1 . . . . A 8 DT H3' . 34398 1 81 . 1 1 8 8 DT H4' H 1 4.048 0.004 . 1 . . . . A 8 DT H4' . 34398 1 82 . 1 1 8 8 DT H5' H 1 4.168 0.004 . 1 . . . . A 8 DT H5' . 34398 1 83 . 1 1 8 8 DT H5'' H 1 3.992 0.004 . 1 . . . . A 8 DT H5'' . 34398 1 84 . 1 1 8 8 DT H6 H 1 7.001 0.001 . 1 . . . . A 8 DT H6 . 34398 1 85 . 1 1 8 8 DT H71 H 1 1.339 0.003 . 1 . . . . A 8 DT H71 . 34398 1 86 . 1 1 8 8 DT H72 H 1 1.339 0.003 . 1 . . . . A 8 DT H72 . 34398 1 87 . 1 1 8 8 DT H73 H 1 1.339 0.003 . 1 . . . . A 8 DT H73 . 34398 1 88 . 1 1 9 9 DG H1 H 1 12.184 0.002 . 1 . . . . A 9 DG H1 . 34398 1 89 . 1 1 9 9 DG H1' H 1 5.458 0.001 . 1 . . . . A 9 DG H1' . 34398 1 90 . 1 1 9 9 DG H2' H 1 2.533 0.003 . 1 . . . . A 9 DG H2' . 34398 1 91 . 1 1 9 9 DG H2'' H 1 2.646 0.003 . 1 . . . . A 9 DG H2'' . 34398 1 92 . 1 1 9 9 DG H3' H 1 4.901 0.002 . 1 . . . . A 9 DG H3' . 34398 1 93 . 1 1 9 9 DG H4' H 1 4.260 0.001 . 1 . . . . A 9 DG H4' . 34398 1 94 . 1 1 9 9 DG H5' H 1 4.036 0.004 . 1 . . . . A 9 DG H5' . 34398 1 95 . 1 1 9 9 DG H5'' H 1 3.982 0.003 . 1 . . . . A 9 DG H5'' . 34398 1 96 . 1 1 9 9 DG H8 H 1 7.703 0.001 . 1 . . . . A 9 DG H8 . 34398 1 97 . 1 1 9 9 DG H21 H 1 7.090 0.000 . 1 . . . . A 9 DG H21 . 34398 1 98 . 1 1 9 9 DG H22 H 1 5.060 0.000 . 1 . . . . A 9 DG H22 . 34398 1 99 . 1 1 10 10 DA H1' H 1 6.080 0.001 . 1 . . . . A 10 DA H1' . 34398 1 100 . 1 1 10 10 DA H2 H 1 7.700 0.002 . 1 . . . . A 10 DA H2 . 34398 1 101 . 1 1 10 10 DA H2' H 1 2.510 0.003 . 1 . . . . A 10 DA H2' . 34398 1 102 . 1 1 10 10 DA H2'' H 1 2.763 0.005 . 1 . . . . A 10 DA H2'' . 34398 1 103 . 1 1 10 10 DA H3' H 1 4.910 0.002 . 1 . . . . A 10 DA H3' . 34398 1 104 . 1 1 10 10 DA H4' H 1 4.374 0.001 . 1 . . . . A 10 DA H4' . 34398 1 105 . 1 1 10 10 DA H5' H 1 4.140 0.003 . 1 . . . . A 10 DA H5' . 34398 1 106 . 1 1 10 10 DA H5'' H 1 4.140 0.003 . 1 . . . . A 10 DA H5'' . 34398 1 107 . 1 1 10 10 DA H8 H 1 8.072 0.001 . 1 . . . . A 10 DA H8 . 34398 1 108 . 1 1 10 10 DA H61 H 1 7.170 0.009 . 1 . . . . A 10 DA H61 . 34398 1 109 . 1 1 10 10 DA H62 H 1 5.856 0.001 . 1 . . . . A 10 DA H62 . 34398 1 110 . 1 1 11 11 DT H1' H 1 5.642 0.003 . 1 . . . . A 11 DT H1' . 34398 1 111 . 1 1 11 11 DT H2' H 1 1.330 0.003 . 1 . . . . A 11 DT H2' . 34398 1 112 . 1 1 11 11 DT H2'' H 1 1.966 0.002 . 1 . . . . A 11 DT H2'' . 34398 1 113 . 1 1 11 11 DT H3 H 1 11.065 0.003 . 1 . . . . A 11 DT H3 . 34398 1 114 . 1 1 11 11 DT H3' H 1 4.712 0.002 . 1 . . . . A 11 DT H3' . 34398 1 115 . 1 1 11 11 DT H4' H 1 3.940 0.002 . 1 . . . . A 11 DT H4' . 34398 1 116 . 1 1 11 11 DT H5' H 1 4.013 0.005 . 1 . . . . A 11 DT H5' . 34398 1 117 . 1 1 11 11 DT H5'' H 1 4.152 0.008 . 1 . . . . A 11 DT H5'' . 34398 1 118 . 1 1 11 11 DT H6 H 1 6.770 0.001 . 1 . . . . A 11 DT H6 . 34398 1 119 . 1 1 11 11 DT H71 H 1 1.140 0.002 . 1 . . . . A 11 DT H71 . 34398 1 120 . 1 1 11 11 DT H72 H 1 1.140 0.002 . 1 . . . . A 11 DT H72 . 34398 1 121 . 1 1 11 11 DT H73 H 1 1.140 0.002 . 1 . . . . A 11 DT H73 . 34398 1 122 . 1 1 12 12 DA H1' H 1 6.037 0.002 . 1 . . . . A 12 DA H1' . 34398 1 123 . 1 1 12 12 DA H2 H 1 7.867 0.002 . 1 . . . . A 12 DA H2 . 34398 1 124 . 1 1 12 12 DA H2' H 1 2.748 0.004 . 1 . . . . A 12 DA H2' . 34398 1 125 . 1 1 12 12 DA H2'' H 1 2.726 0.002 . 1 . . . . A 12 DA H2'' . 34398 1 126 . 1 1 12 12 DA H3' H 1 4.941 0.002 . 1 . . . . A 12 DA H3' . 34398 1 127 . 1 1 12 12 DA H4' H 1 4.330 0.001 . 1 . . . . A 12 DA H4' . 34398 1 128 . 1 1 12 12 DA H5' H 1 4.024 0.003 . 1 . . . . A 12 DA H5' . 34398 1 129 . 1 1 12 12 DA H5'' H 1 3.939 0.002 . 1 . . . . A 12 DA H5'' . 34398 1 130 . 1 1 12 12 DA H8 H 1 8.221 0.003 . 1 . . . . A 12 DA H8 . 34398 1 131 . 1 1 12 12 DA H61 H 1 7.538 0.000 . 1 . . . . A 12 DA H61 . 34398 1 132 . 1 1 13 13 DC H1' H 1 5.592 0.002 . 1 . . . . A 13 DC H1' . 34398 1 133 . 1 1 13 13 DC H2' H 1 1.812 0.003 . 1 . . . . A 13 DC H2' . 34398 1 134 . 1 1 13 13 DC H2'' H 1 2.234 0.002 . 1 . . . . A 13 DC H2'' . 34398 1 135 . 1 1 13 13 DC H3' H 1 4.656 0.001 . 1 . . . . A 13 DC H3' . 34398 1 136 . 1 1 13 13 DC H4' H 1 4.089 0.003 . 1 . . . . A 13 DC H4' . 34398 1 137 . 1 1 13 13 DC H5 H 1 5.318 0.001 . 1 . . . . A 13 DC H5 . 34398 1 138 . 1 1 13 13 DC H5' H 1 4.160 0.003 . 1 . . . . A 13 DC H5' . 34398 1 139 . 1 1 13 13 DC H5'' H 1 4.042 0.004 . 1 . . . . A 13 DC H5'' . 34398 1 140 . 1 1 13 13 DC H6 H 1 7.234 0.002 . 1 . . . . A 13 DC H6 . 34398 1 141 . 1 1 13 13 DC H41 H 1 8.146 0.000 . 1 . . . . A 13 DC H41 . 34398 1 142 . 1 1 13 13 DC H42 H 1 6.742 0.003 . 1 . . . . A 13 DC H42 . 34398 1 143 . 1 1 14 14 DG H1 H 1 13.014 0.006 . 1 . . . . A 14 DG H1 . 34398 1 144 . 1 1 14 14 DG H1' H 1 6.102 0.002 . 1 . . . . A 14 DG H1' . 34398 1 145 . 1 1 14 14 DG H2' H 1 2.527 0.001 . 1 . . . . A 14 DG H2' . 34398 1 146 . 1 1 14 14 DG H2'' H 1 2.306 0.001 . 1 . . . . A 14 DG H2'' . 34398 1 147 . 1 1 14 14 DG H3' H 1 4.593 0.001 . 1 . . . . A 14 DG H3' . 34398 1 148 . 1 1 14 14 DG H4' H 1 4.113 0.001 . 1 . . . . A 14 DG H4' . 34398 1 149 . 1 1 14 14 DG H5' H 1 4.008 0.001 . 1 . . . . A 14 DG H5' . 34398 1 150 . 1 1 14 14 DG H5'' H 1 4.008 0.001 . 1 . . . . A 14 DG H5'' . 34398 1 151 . 1 1 14 14 DG H8 H 1 7.827 0.001 . 1 . . . . A 14 DG H8 . 34398 1 152 . 1 1 14 14 DG H22 H 1 4.960 0.000 . 1 . . . . A 14 DG H22 . 34398 1 153 . 2 1 1 1 DC H1' H 1 5.741 0.002 . 1 . . . . B 15 DC H1' . 34398 1 154 . 2 1 1 1 DC H2' H 1 1.980 0.003 . 1 . . . . B 15 DC H2' . 34398 1 155 . 2 1 1 1 DC H2'' H 1 2.395 0.002 . 1 . . . . B 15 DC H2'' . 34398 1 156 . 2 1 1 1 DC H3' H 1 4.645 0.001 . 1 . . . . B 15 DC H3' . 34398 1 157 . 2 1 1 1 DC H4' H 1 4.022 0.001 . 1 . . . . B 15 DC H4' . 34398 1 158 . 2 1 1 1 DC H5 H 1 5.851 0.002 . 1 . . . . B 15 DC H5 . 34398 1 159 . 2 1 1 1 DC H5' H 1 3.678 0.002 . 1 . . . . B 15 DC H5' . 34398 1 160 . 2 1 1 1 DC H5'' H 1 3.678 0.002 . 1 . . . . B 15 DC H5'' . 34398 1 161 . 2 1 1 1 DC H6 H 1 7.601 0.003 . 1 . . . . B 15 DC H6 . 34398 1 162 . 2 1 1 1 DC H41 H 1 8.094 0.001 . 1 . . . . B 15 DC H41 . 34398 1 163 . 2 1 1 1 DC H42 H 1 7.040 0.003 . 1 . . . . B 15 DC H42 . 34398 1 164 . 2 1 2 2 DG H1 H 1 12.879 0.003 . 1 . . . . B 16 DG H1 . 34398 1 165 . 2 1 2 2 DG H1' H 1 5.981 0.003 . 1 . . . . B 16 DG H1' . 34398 1 166 . 2 1 2 2 DG H2' H 1 2.625 0.003 . 1 . . . . B 16 DG H2' . 34398 1 167 . 2 1 2 2 DG H2'' H 1 2.770 0.002 . 1 . . . . B 16 DG H2'' . 34398 1 168 . 2 1 2 2 DG H3' H 1 4.916 0.001 . 1 . . . . B 16 DG H3' . 34398 1 169 . 2 1 2 2 DG H4' H 1 4.331 0.001 . 1 . . . . B 16 DG H4' . 34398 1 170 . 2 1 2 2 DG H5' H 1 4.057 0.003 . 1 . . . . B 16 DG H5' . 34398 1 171 . 2 1 2 2 DG H5'' H 1 3.987 0.003 . 1 . . . . B 16 DG H5'' . 34398 1 172 . 2 1 2 2 DG H8 H 1 7.918 0.001 . 1 . . . . B 16 DG H8 . 34398 1 173 . 2 1 3 3 DT H1' H 1 6.022 0.003 . 1 . . . . B 17 DT H1' . 34398 1 174 . 2 1 3 3 DT H2' H 1 2.136 0.002 . 1 . . . . B 17 DT H2' . 34398 1 175 . 2 1 3 3 DT H2'' H 1 2.467 0.003 . 1 . . . . B 17 DT H2'' . 34398 1 176 . 2 1 3 3 DT H3 H 1 13.870 0.004 . 1 . . . . B 17 DT H3 . 34398 1 177 . 2 1 3 3 DT H3' H 1 4.820 0.001 . 1 . . . . B 17 DT H3' . 34398 1 178 . 2 1 3 3 DT H4' H 1 4.237 0.002 . 1 . . . . B 17 DT H4' . 34398 1 179 . 2 1 3 3 DT H5' H 1 4.198 0.002 . 1 . . . . B 17 DT H5' . 34398 1 180 . 2 1 3 3 DT H5'' H 1 4.095 0.003 . 1 . . . . B 17 DT H5'' . 34398 1 181 . 2 1 3 3 DT H6 H 1 7.212 0.002 . 1 . . . . B 17 DT H6 . 34398 1 182 . 2 1 3 3 DT H71 H 1 1.380 0.002 . 1 . . . . B 17 DT H71 . 34398 1 183 . 2 1 3 3 DT H72 H 1 1.380 0.002 . 1 . . . . B 17 DT H72 . 34398 1 184 . 2 1 3 3 DT H73 H 1 1.380 0.002 . 1 . . . . B 17 DT H73 . 34398 1 185 . 2 1 4 4 DC H1' H 1 6.139 0.001 . 1 . . . . B 18 DC H1' . 34398 1 186 . 2 1 4 4 DC H2' H 1 1.881 0.003 . 1 . . . . B 18 DC H2' . 34398 1 187 . 2 1 4 4 DC H2'' H 1 2.457 0.003 . 1 . . . . B 18 DC H2'' . 34398 1 188 . 2 1 4 4 DC H3' H 1 4.775 0.001 . 1 . . . . B 18 DC H3' . 34398 1 189 . 2 1 4 4 DC H4' H 1 4.085 0.003 . 1 . . . . B 18 DC H4' . 34398 1 190 . 2 1 4 4 DC H5 H 1 5.419 0.002 . 1 . . . . B 18 DC H5 . 34398 1 191 . 2 1 4 4 DC H5' H 1 4.108 0.001 . 1 . . . . B 18 DC H5' . 34398 1 192 . 2 1 4 4 DC H5'' H 1 4.056 0.001 . 1 . . . . B 18 DC H5'' . 34398 1 193 . 2 1 4 4 DC H6 H 1 7.395 0.002 . 1 . . . . B 18 DC H6 . 34398 1 194 . 2 1 4 4 DC H41 H 1 7.784 0.006 . 1 . . . . B 18 DC H41 . 34398 1 195 . 2 1 4 4 DC H42 H 1 6.685 0.004 . 1 . . . . B 18 DC H42 . 34398 1 196 . 2 1 5 5 DT H1' H 1 5.756 0.002 . 1 . . . . B 19 DT H1' . 34398 1 197 . 2 1 5 5 DT H2' H 1 2.349 0.000 . 1 . . . . B 19 DT H2' . 34398 1 198 . 2 1 5 5 DT H2'' H 1 2.347 0.000 . 1 . . . . B 19 DT H2'' . 34398 1 199 . 2 1 5 5 DT H3 H 1 14.499 0.003 . 1 . . . . B 19 DT H3 . 34398 1 200 . 2 1 5 5 DT H3' H 1 4.858 0.002 . 1 . . . . B 19 DT H3' . 34398 1 201 . 2 1 5 5 DT H4' H 1 4.207 0.001 . 1 . . . . B 19 DT H4' . 34398 1 202 . 2 1 5 5 DT H5' H 1 4.026 0.001 . 1 . . . . B 19 DT H5' . 34398 1 203 . 2 1 5 5 DT H5'' H 1 4.026 0.001 . 1 . . . . B 19 DT H5'' . 34398 1 204 . 2 1 5 5 DT H6 H 1 7.506 0.002 . 1 . . . . B 19 DT H6 . 34398 1 205 . 2 1 5 5 DT H71 H 1 1.694 0.002 . 1 . . . . B 19 DT H71 . 34398 1 206 . 2 1 5 5 DT H72 H 1 1.694 0.002 . 1 . . . . B 19 DT H72 . 34398 1 207 . 2 1 5 5 DT H73 H 1 1.694 0.002 . 1 . . . . B 19 DT H73 . 34398 1 208 . 2 1 6 6 DC H1' H 1 5.629 0.002 . 1 . . . . B 20 DC H1' . 34398 1 209 . 2 1 6 6 DC H2' H 1 2.047 0.002 . 1 . . . . B 20 DC H2' . 34398 1 210 . 2 1 6 6 DC H2'' H 1 2.391 0.002 . 1 . . . . B 20 DC H2'' . 34398 1 211 . 2 1 6 6 DC H3' H 1 4.759 0.002 . 1 . . . . B 20 DC H3' . 34398 1 212 . 2 1 6 6 DC H4' H 1 4.101 0.003 . 1 . . . . B 20 DC H4' . 34398 1 213 . 2 1 6 6 DC H5 H 1 5.671 0.002 . 1 . . . . B 20 DC H5 . 34398 1 214 . 2 1 6 6 DC H6 H 1 7.515 0.003 . 1 . . . . B 20 DC H6 . 34398 1 215 . 2 1 6 6 DC H41 H 1 8.301 0.003 . 1 . . . . B 20 DC H41 . 34398 1 216 . 2 1 6 6 DC H42 H 1 6.922 0.005 . 1 . . . . B 20 DC H42 . 34398 1 217 . 2 1 7 7 DA H1' H 1 6.139 0.002 . 1 . . . . B 21 DA H1' . 34398 1 218 . 2 1 7 7 DA H2 H 1 7.502 0.002 . 1 . . . . B 21 DA H2 . 34398 1 219 . 2 1 7 7 DA H2' H 1 2.590 0.002 . 1 . . . . B 21 DA H2' . 34398 1 220 . 2 1 7 7 DA H2'' H 1 2.840 0.002 . 1 . . . . B 21 DA H2'' . 34398 1 221 . 2 1 7 7 DA H3' H 1 4.944 0.001 . 1 . . . . B 21 DA H3' . 34398 1 222 . 2 1 7 7 DA H4' H 1 4.340 0.003 . 1 . . . . B 21 DA H4' . 34398 1 223 . 2 1 7 7 DA H5' H 1 4.104 0.003 . 1 . . . . B 21 DA H5' . 34398 1 224 . 2 1 7 7 DA H5'' H 1 4.008 0.003 . 1 . . . . B 21 DA H5'' . 34398 1 225 . 2 1 7 7 DA H8 H 1 8.230 0.002 . 1 . . . . B 21 DA H8 . 34398 1 226 . 2 1 7 7 DA H61 H 1 7.654 0.004 . 1 . . . . B 21 DA H61 . 34398 1 227 . 2 1 7 7 DA H62 H 1 6.251 0.001 . 1 . . . . B 21 DA H62 . 34398 1 228 . 2 1 8 8 DT H1' H 1 5.583 0.002 . 1 . . . . B 22 DT H1' . 34398 1 229 . 2 1 8 8 DT H2' H 1 1.867 0.002 . 1 . . . . B 22 DT H2' . 34398 1 230 . 2 1 8 8 DT H2'' H 1 2.272 0.003 . 1 . . . . B 22 DT H2'' . 34398 1 231 . 2 1 8 8 DT H3 H 1 13.411 0.002 . 1 . . . . B 22 DT H3 . 34398 1 232 . 2 1 8 8 DT H3' H 1 4.773 0.001 . 1 . . . . B 22 DT H3' . 34398 1 233 . 2 1 8 8 DT H4' H 1 4.048 0.004 . 1 . . . . B 22 DT H4' . 34398 1 234 . 2 1 8 8 DT H5' H 1 4.168 0.004 . 1 . . . . B 22 DT H5' . 34398 1 235 . 2 1 8 8 DT H5'' H 1 3.992 0.004 . 1 . . . . B 22 DT H5'' . 34398 1 236 . 2 1 8 8 DT H6 H 1 7.001 0.001 . 1 . . . . B 22 DT H6 . 34398 1 237 . 2 1 8 8 DT H71 H 1 1.339 0.003 . 1 . . . . B 22 DT H71 . 34398 1 238 . 2 1 8 8 DT H72 H 1 1.339 0.003 . 1 . . . . B 22 DT H72 . 34398 1 239 . 2 1 8 8 DT H73 H 1 1.339 0.003 . 1 . . . . B 22 DT H73 . 34398 1 240 . 2 1 9 9 DG H1 H 1 12.184 0.002 . 1 . . . . B 23 DG H1 . 34398 1 241 . 2 1 9 9 DG H1' H 1 5.458 0.001 . 1 . . . . B 23 DG H1' . 34398 1 242 . 2 1 9 9 DG H2' H 1 2.533 0.003 . 1 . . . . B 23 DG H2' . 34398 1 243 . 2 1 9 9 DG H2'' H 1 2.646 0.003 . 1 . . . . B 23 DG H2'' . 34398 1 244 . 2 1 9 9 DG H3' H 1 4.901 0.002 . 1 . . . . B 23 DG H3' . 34398 1 245 . 2 1 9 9 DG H4' H 1 4.260 0.001 . 1 . . . . B 23 DG H4' . 34398 1 246 . 2 1 9 9 DG H5' H 1 4.036 0.004 . 1 . . . . B 23 DG H5' . 34398 1 247 . 2 1 9 9 DG H5'' H 1 3.982 0.003 . 1 . . . . B 23 DG H5'' . 34398 1 248 . 2 1 9 9 DG H8 H 1 7.703 0.001 . 1 . . . . B 23 DG H8 . 34398 1 249 . 2 1 9 9 DG H21 H 1 7.090 0.000 . 1 . . . . B 23 DG H21 . 34398 1 250 . 2 1 9 9 DG H22 H 1 5.060 0.000 . 1 . . . . B 23 DG H22 . 34398 1 251 . 2 1 10 10 DA H1' H 1 6.080 0.001 . 1 . . . . B 24 DA H1' . 34398 1 252 . 2 1 10 10 DA H2 H 1 7.700 0.002 . 1 . . . . B 24 DA H2 . 34398 1 253 . 2 1 10 10 DA H2' H 1 2.510 0.003 . 1 . . . . B 24 DA H2' . 34398 1 254 . 2 1 10 10 DA H2'' H 1 2.763 0.005 . 1 . . . . B 24 DA H2'' . 34398 1 255 . 2 1 10 10 DA H3' H 1 4.910 0.002 . 1 . . . . B 24 DA H3' . 34398 1 256 . 2 1 10 10 DA H4' H 1 4.374 0.001 . 1 . . . . B 24 DA H4' . 34398 1 257 . 2 1 10 10 DA H5' H 1 4.140 0.003 . 1 . . . . B 24 DA H5' . 34398 1 258 . 2 1 10 10 DA H5'' H 1 4.140 0.003 . 1 . . . . B 24 DA H5'' . 34398 1 259 . 2 1 10 10 DA H8 H 1 8.072 0.001 . 1 . . . . B 24 DA H8 . 34398 1 260 . 2 1 10 10 DA H61 H 1 7.170 0.009 . 1 . . . . B 24 DA H61 . 34398 1 261 . 2 1 10 10 DA H62 H 1 5.856 0.001 . 1 . . . . B 24 DA H62 . 34398 1 262 . 2 1 11 11 DT H1' H 1 5.642 0.003 . 1 . . . . B 25 DT H1' . 34398 1 263 . 2 1 11 11 DT H2' H 1 1.330 0.003 . 1 . . . . B 25 DT H2' . 34398 1 264 . 2 1 11 11 DT H2'' H 1 1.966 0.002 . 1 . . . . B 25 DT H2'' . 34398 1 265 . 2 1 11 11 DT H3 H 1 11.065 0.003 . 1 . . . . B 25 DT H3 . 34398 1 266 . 2 1 11 11 DT H3' H 1 4.712 0.002 . 1 . . . . B 25 DT H3' . 34398 1 267 . 2 1 11 11 DT H4' H 1 3.940 0.002 . 1 . . . . B 25 DT H4' . 34398 1 268 . 2 1 11 11 DT H5' H 1 4.013 0.005 . 1 . . . . B 25 DT H5' . 34398 1 269 . 2 1 11 11 DT H5'' H 1 4.152 0.008 . 1 . . . . B 25 DT H5'' . 34398 1 270 . 2 1 11 11 DT H6 H 1 6.770 0.001 . 1 . . . . B 25 DT H6 . 34398 1 271 . 2 1 11 11 DT H71 H 1 1.140 0.002 . 1 . . . . B 25 DT H71 . 34398 1 272 . 2 1 11 11 DT H72 H 1 1.140 0.002 . 1 . . . . B 25 DT H72 . 34398 1 273 . 2 1 11 11 DT H73 H 1 1.140 0.002 . 1 . . . . B 25 DT H73 . 34398 1 274 . 2 1 12 12 DA H1' H 1 6.037 0.002 . 1 . . . . B 26 DA H1' . 34398 1 275 . 2 1 12 12 DA H2 H 1 7.867 0.002 . 1 . . . . B 26 DA H2 . 34398 1 276 . 2 1 12 12 DA H2' H 1 2.748 0.004 . 1 . . . . B 26 DA H2' . 34398 1 277 . 2 1 12 12 DA H2'' H 1 2.726 0.002 . 1 . . . . B 26 DA H2'' . 34398 1 278 . 2 1 12 12 DA H3' H 1 4.941 0.002 . 1 . . . . B 26 DA H3' . 34398 1 279 . 2 1 12 12 DA H4' H 1 4.330 0.001 . 1 . . . . B 26 DA H4' . 34398 1 280 . 2 1 12 12 DA H5' H 1 4.024 0.003 . 1 . . . . B 26 DA H5' . 34398 1 281 . 2 1 12 12 DA H5'' H 1 3.939 0.002 . 1 . . . . B 26 DA H5'' . 34398 1 282 . 2 1 12 12 DA H8 H 1 8.221 0.003 . 1 . . . . B 26 DA H8 . 34398 1 283 . 2 1 12 12 DA H61 H 1 7.538 0.000 . 1 . . . . B 26 DA H61 . 34398 1 284 . 2 1 13 13 DC H1' H 1 5.592 0.002 . 1 . . . . B 27 DC H1' . 34398 1 285 . 2 1 13 13 DC H2' H 1 1.812 0.003 . 1 . . . . B 27 DC H2' . 34398 1 286 . 2 1 13 13 DC H2'' H 1 2.234 0.002 . 1 . . . . B 27 DC H2'' . 34398 1 287 . 2 1 13 13 DC H3' H 1 4.656 0.001 . 1 . . . . B 27 DC H3' . 34398 1 288 . 2 1 13 13 DC H4' H 1 4.089 0.003 . 1 . . . . B 27 DC H4' . 34398 1 289 . 2 1 13 13 DC H5 H 1 5.318 0.001 . 1 . . . . B 27 DC H5 . 34398 1 290 . 2 1 13 13 DC H5' H 1 4.160 0.003 . 1 . . . . B 27 DC H5' . 34398 1 291 . 2 1 13 13 DC H5'' H 1 4.042 0.004 . 1 . . . . B 27 DC H5'' . 34398 1 292 . 2 1 13 13 DC H6 H 1 7.234 0.002 . 1 . . . . B 27 DC H6 . 34398 1 293 . 2 1 13 13 DC H41 H 1 8.146 0.000 . 1 . . . . B 27 DC H41 . 34398 1 294 . 2 1 13 13 DC H42 H 1 6.742 0.003 . 1 . . . . B 27 DC H42 . 34398 1 295 . 2 1 14 14 DG H1 H 1 13.014 0.006 . 1 . . . . B 28 DG H1 . 34398 1 296 . 2 1 14 14 DG H1' H 1 6.102 0.002 . 1 . . . . B 28 DG H1' . 34398 1 297 . 2 1 14 14 DG H2' H 1 2.527 0.001 . 1 . . . . B 28 DG H2' . 34398 1 298 . 2 1 14 14 DG H2'' H 1 2.306 0.001 . 1 . . . . B 28 DG H2'' . 34398 1 299 . 2 1 14 14 DG H3' H 1 4.593 0.001 . 1 . . . . B 28 DG H3' . 34398 1 300 . 2 1 14 14 DG H4' H 1 4.113 0.001 . 1 . . . . B 28 DG H4' . 34398 1 301 . 2 1 14 14 DG H5' H 1 4.008 0.001 . 1 . . . . B 28 DG H5' . 34398 1 302 . 2 1 14 14 DG H5'' H 1 4.008 0.001 . 1 . . . . B 28 DG H5'' . 34398 1 303 . 2 1 14 14 DG H8 H 1 7.827 0.001 . 1 . . . . B 28 DG H8 . 34398 1 304 . 2 1 14 14 DG H22 H 1 4.960 0.000 . 1 . . . . B 28 DG H22 . 34398 1 stop_ save_