################################### # 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 16222 _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 '1H-1H NOESY' . . . 16222 1 2 '1H-1H COSY' . . . 16222 1 3 '1H-1H NOESY' . . . 16222 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 DC H1' H 1 5.813 0.012 . 1 . . . . 1 C H1' . 16222 1 2 . 1 1 1 1 DC H2' H 1 2.191 0.014 . 1 . . . . 1 C H2' . 16222 1 3 . 1 1 1 1 DC H2'' H 1 2.520 0.007 . 1 . . . . 1 C H2'' . 16222 1 4 . 1 1 1 1 DC H3' H 1 4.615 0.002 . 1 . . . . 1 C H3' . 16222 1 5 . 1 1 1 1 DC H4' H 1 4.053 0.005 . 1 . . . . 1 C H4' . 16222 1 6 . 1 1 1 1 DC H5 H 1 5.863 0.006 . 1 . . . . 1 C H5 . 16222 1 7 . 1 1 1 1 DC H5' H 1 3.736 0.008 . 1 . . . . 1 C H5' . 16222 1 8 . 1 1 1 1 DC H5'' H 1 3.775 0.008 . 1 . . . . 1 C H5'' . 16222 1 9 . 1 1 1 1 DC H6 H 1 7.819 0.007 . 1 . . . . 1 C H6 . 16222 1 10 . 1 1 1 1 DC H42 H 1 7.775 0.000 . 1 . . . . 1 C H42 . 16222 1 11 . 1 1 2 2 DT H1' H 1 5.787 0.007 . 1 . . . . 2 T H1' . 16222 1 12 . 1 1 2 2 DT H2' H 1 2.245 0.010 . 1 . . . . 2 T H2' . 16222 1 13 . 1 1 2 2 DT H2'' H 1 2.540 0.010 . 1 . . . . 2 T H2'' . 16222 1 14 . 1 1 2 2 DT H3 H 1 13.508 0.000 . 1 . . . . 2 T H3 . 16222 1 15 . 1 1 2 2 DT H3' H 1 4.870 0.010 . 1 . . . . 2 T H3' . 16222 1 16 . 1 1 2 2 DT H4' H 1 4.178 0.007 . 1 . . . . 2 T H4' . 16222 1 17 . 1 1 2 2 DT H5' H 1 4.037 0.007 . 1 . . . . 2 T H5' . 16222 1 18 . 1 1 2 2 DT H5'' H 1 4.011 0.008 . 1 . . . . 2 T H5'' . 16222 1 19 . 1 1 2 2 DT H6 H 1 7.557 0.014 . 1 . . . . 2 T H6 . 16222 1 20 . 1 1 2 2 DT H71 H 1 1.647 0.003 . 1 . . . . 2 T H7 . 16222 1 21 . 1 1 2 2 DT H72 H 1 1.647 0.003 . 1 . . . . 2 T H7 . 16222 1 22 . 1 1 2 2 DT H73 H 1 1.647 0.003 . 1 . . . . 2 T H7 . 16222 1 23 . 1 1 3 3 DA H1' H 1 6.243 0.005 . 1 . . . . 3 A H1' . 16222 1 24 . 1 1 3 3 DA H2 H 1 7.436 0.000 . 1 . . . . 3 A H2 . 16222 1 25 . 1 1 3 3 DA H2' H 1 2.567 0.004 . 1 . . . . 3 A H2' . 16222 1 26 . 1 1 3 3 DA H2'' H 1 2.888 0.007 . 1 . . . . 3 A H2'' . 16222 1 27 . 1 1 3 3 DA H3' H 1 4.977 0.006 . 1 . . . . 3 A H3' . 16222 1 28 . 1 1 3 3 DA H4' H 1 4.392 0.008 . 1 . . . . 3 A H4' . 16222 1 29 . 1 1 3 3 DA H5' H 1 4.229 0.006 . 1 . . . . 3 A H5' . 16222 1 30 . 1 1 3 3 DA H5'' H 1 4.123 0.008 . 1 . . . . 3 A H5'' . 16222 1 31 . 1 1 3 3 DA H8 H 1 8.316 0.011 . 1 . . . . 3 A H8 . 16222 1 32 . 1 1 3 3 DA H61 H 1 6.447 0.000 . 1 . . . . 3 A H61 . 16222 1 33 . 1 1 4 4 DT H1' H 1 5.979 0.007 . 1 . . . . 4 T H1' . 16222 1 34 . 1 1 4 4 DT H2' H 1 2.232 0.006 . 1 . . . . 4 T H2' . 16222 1 35 . 1 1 4 4 DT H2'' H 1 2.361 0.004 . 1 . . . . 4 T H2'' . 16222 1 36 . 1 1 4 4 DT H3 H 1 13.374 0.008 . 1 . . . . 4 T H3 . 16222 1 37 . 1 1 4 4 DT H3' H 1 4.913 0.009 . 1 . . . . 4 T H3' . 16222 1 38 . 1 1 4 4 DT H4' H 1 4.228 0.009 . 1 . . . . 4 T H4' . 16222 1 39 . 1 1 4 4 DT H5' H 1 3.929 0.004 . 1 . . . . 4 T H5' . 16222 1 40 . 1 1 4 4 DT H5'' H 1 4.102 0.010 . 1 . . . . 4 T H5'' . 16222 1 41 . 1 1 4 4 DT H6 H 1 7.407 0.014 . 1 . . . . 4 T H6 . 16222 1 42 . 1 1 4 4 DT H71 H 1 1.498 0.006 . 1 . . . . 4 T H7 . 16222 1 43 . 1 1 4 4 DT H72 H 1 1.498 0.006 . 1 . . . . 4 T H7 . 16222 1 44 . 1 1 4 4 DT H73 H 1 1.498 0.006 . 1 . . . . 4 T H7 . 16222 1 45 . 1 1 5 5 FAG H1' H 1 6.332 0.009 . 1 . . . . 5 FAG H1' . 16222 1 46 . 1 1 5 5 FAG H2' H 1 2.931 0.009 . 1 . . . . 5 FAG H2' . 16222 1 47 . 1 1 5 5 FAG H2'' H 1 2.795 0.014 . 1 . . . . 5 FAG H2'' . 16222 1 48 . 1 1 5 5 FAG H3 H 1 11.81 0.004 . 1 . . . . 5 FAG H3 . 16222 1 49 . 1 1 5 5 FAG H3' H 1 5.032 0.010 . 1 . . . . 5 FAG H3' . 16222 1 50 . 1 1 5 5 FAG H4' H 1 4.645 0.154 . 1 . . . . 5 FAG H4' . 16222 1 51 . 1 1 5 5 FAG H5' H 1 4.216 0.068 . 1 . . . . 5 FAG H5' . 16222 1 52 . 1 1 5 5 FAG H5'' H 1 4.451 0.009 . 1 . . . . 5 FAG H5'' . 16222 1 53 . 1 1 5 5 FAG H8 H 1 8.328 0.015 . 1 . . . . 5 FAG H8 . 16222 1 54 . 1 1 5 5 FAG HN21 H 1 6.319 0.000 . 1 . . . . 5 FAG HN21 . 16222 1 55 . 1 1 5 5 FAG HN22 H 1 6.777 0.000 . 1 . . . . 5 FAG HN22 . 16222 1 56 . 1 1 5 5 FAG H2A1 H 1 0.975 0.005 . 1 . . . . 5 FAG H2A1 . 16222 1 57 . 1 1 5 5 FAG H2A2 H 1 1.650 0.013 . 1 . . . . 5 FAG H2A2 . 16222 1 58 . 1 1 5 5 FAG H31 H 1 1.845 0.005 . 1 . . . . 5 FAG H31 . 16222 1 59 . 1 1 5 5 FAG H32 H 1 2.283 0.007 . 1 . . . . 5 FAG H32 . 16222 1 60 . 1 1 5 5 FAG H5B H 1 5.730 0.003 . 1 . . . . 5 FAG H5B . 16222 1 61 . 1 1 5 5 FAG H6a H 1 6.138 0.005 . 1 . . . . 5 FAG H6a . 16222 1 62 . 1 1 5 5 FAG H8A H 1 5.775 0.006 . 1 . . . . 5 FAG H8A . 16222 1 63 . 1 1 5 5 FAG H9 H 1 6.103 0.000 . 1 . . . . 5 FAG H9 . 16222 1 64 . 1 1 5 5 FAG H9a H 1 3.467 0.014 . 1 . . . . 5 FAG H9a . 16222 1 65 . 1 1 5 5 FAG HM H 1 3.510 0.004 . 1 . . . . 5 FAG HM . 16222 1 66 . 1 1 6 6 DA H1' H 1 6.280 0.005 . 1 . . . . 6 A H1' . 16222 1 67 . 1 1 6 6 DA H2 H 1 7.728 0.001 . 1 . . . . 6 A H2 . 16222 1 68 . 1 1 6 6 DA H2' H 1 2.738 0.010 . 1 . . . . 6 A H2' . 16222 1 69 . 1 1 6 6 DA H2'' H 1 2.880 0.006 . 1 . . . . 6 A H2'' . 16222 1 70 . 1 1 6 6 DA H3' H 1 5.010 0.008 . 1 . . . . 6 A H3' . 16222 1 71 . 1 1 6 6 DA H4' H 1 4.439 0.009 . 1 . . . . 6 A H4' . 16222 1 72 . 1 1 6 6 DA H5' H 1 3.997 0.003 . 1 . . . . 6 A H5' . 16222 1 73 . 1 1 6 6 DA H5'' H 1 4.116 0.008 . 1 . . . . 6 A H5'' . 16222 1 74 . 1 1 6 6 DA H8 H 1 8.302 0.008 . 1 . . . . 6 A H8 . 16222 1 75 . 1 1 6 6 DA H61 H 1 7.329 0.000 . 1 . . . . 6 A H61 . 16222 1 76 . 1 1 6 6 DA H62 H 1 6.113 0.000 . 1 . . . . 6 A H62 . 16222 1 77 . 1 1 7 7 DT H1' H 1 5.993 0.008 . 1 . . . . 7 T H1' . 16222 1 78 . 1 1 7 7 DT H2' H 1 2.026 0.008 . 1 . . . . 7 T H2' . 16222 1 79 . 1 1 7 7 DT H2'' H 1 2.525 0.008 . 1 . . . . 7 T H2'' . 16222 1 80 . 1 1 7 7 DT H3 H 1 13.877 0.006 . 1 . . . . 7 T H3 . 16222 1 81 . 1 1 7 7 DT H3' H 1 4.824 0.006 . 1 . . . . 7 T H3' . 16222 1 82 . 1 1 7 7 DT H4' H 1 4.248 0.010 . 1 . . . . 7 T H4' . 16222 1 83 . 1 1 7 7 DT H5' H 1 4.178 0.009 . 1 . . . . 7 T H5' . 16222 1 84 . 1 1 7 7 DT H6 H 1 7.232 0.014 . 1 . . . . 7 T H6 . 16222 1 85 . 1 1 7 7 DT H71 H 1 1.256 0.003 . 1 . . . . 7 T H7 . 16222 1 86 . 1 1 7 7 DT H72 H 1 1.256 0.003 . 1 . . . . 7 T H7 . 16222 1 87 . 1 1 7 7 DT H73 H 1 1.256 0.003 . 1 . . . . 7 T H7 . 16222 1 88 . 1 1 8 8 DT H1' H 1 6.031 0.005 . 1 . . . . 8 T H1' . 16222 1 89 . 1 1 8 8 DT H2' H 1 2.007 0.009 . 1 . . . . 8 T H2' . 16222 1 90 . 1 1 8 8 DT H2'' H 1 2.388 0.007 . 1 . . . . 8 T H2'' . 16222 1 91 . 1 1 8 8 DT H3 H 1 13.921 0.002 . 1 . . . . 8 T H3 . 16222 1 92 . 1 1 8 8 DT H3' H 1 4.824 0.005 . 1 . . . . 8 T H3' . 16222 1 93 . 1 1 8 8 DT H4' H 1 4.175 0.012 . 1 . . . . 8 T H4' . 16222 1 94 . 1 1 8 8 DT H5' H 1 4.040 0.003 . 1 . . . . 8 T H5' . 16222 1 95 . 1 1 8 8 DT H5'' H 1 4.082 0.009 . 1 . . . . 8 T H5'' . 16222 1 96 . 1 1 8 8 DT H6 H 1 7.356 0.010 . 1 . . . . 8 T H6 . 16222 1 97 . 1 1 8 8 DT H71 H 1 1.563 0.002 . 1 . . . . 8 T H7 . 16222 1 98 . 1 1 8 8 DT H72 H 1 1.563 0.002 . 1 . . . . 8 T H7 . 16222 1 99 . 1 1 8 8 DT H73 H 1 1.563 0.002 . 1 . . . . 8 T H7 . 16222 1 100 . 1 1 9 9 DC H1' H 1 5.684 0.027 . 1 . . . . 9 C H1' . 16222 1 101 . 1 1 9 9 DC H2' H 1 1.991 0.004 . 1 . . . . 9 C H2' . 16222 1 102 . 1 1 9 9 DC H2'' H 1 2.259 0.002 . 1 . . . . 9 C H2'' . 16222 1 103 . 1 1 9 9 DC H3' H 1 4.771 0.006 . 1 . . . . 9 C H3' . 16222 1 104 . 1 1 9 9 DC H4' H 1 4.030 0.006 . 1 . . . . 9 C H4' . 16222 1 105 . 1 1 9 9 DC H5 H 1 5.696 0.006 . 1 . . . . 9 C H5 . 16222 1 106 . 1 1 9 9 DC H5' H 1 3.997 0.013 . 1 . . . . 9 C H5' . 16222 1 107 . 1 1 9 9 DC H6 H 1 7.461 0.008 . 1 . . . . 9 C H6 . 16222 1 108 . 1 1 9 9 DC H41 H 1 7.152 0.000 . 1 . . . . 9 C H41 . 16222 1 109 . 1 1 9 9 DC H42 H 1 8.509 0.003 . 1 . . . . 9 C H42 . 16222 1 110 . 1 1 10 10 DA H1' H 1 6.283 0.004 . 1 . . . . 10 A H1' . 16222 1 111 . 1 1 10 10 DA H2' H 1 2.657 0.010 . 1 . . . . 10 A H2' . 16222 1 112 . 1 1 10 10 DA H2'' H 1 2.409 0.004 . 1 . . . . 10 A H2'' . 16222 1 113 . 1 1 10 10 DA H3' H 1 4.662 0.006 . 1 . . . . 10 A H3' . 16222 1 114 . 1 1 10 10 DA H4' H 1 4.148 0.007 . 1 . . . . 10 A H4' . 16222 1 115 . 1 1 10 10 DA H5' H 1 4.045 0.007 . 1 . . . . 10 A H5' . 16222 1 116 . 1 1 10 10 DA H5'' H 1 4.041 0.007 . 1 . . . . 10 A H5'' . 16222 1 117 . 1 1 10 10 DA H8 H 1 8.223 0.006 . 1 . . . . 10 A H8 . 16222 1 118 . 2 2 1 1 DT H1' H 1 5.733 0.008 . 1 . . . . 11 T H1' . 16222 1 119 . 2 2 1 1 DT H2' H 1 1.699 0.016 . 1 . . . . 11 T H2' . 16222 1 120 . 2 2 1 1 DT H2'' H 1 2.137 0.011 . 1 . . . . 11 T H2'' . 16222 1 121 . 2 2 1 1 DT H3' H 1 4.552 0.009 . 1 . . . . 11 T H3' . 16222 1 122 . 2 2 1 1 DT H4' H 1 3.958 0.007 . 1 . . . . 11 T H4' . 16222 1 123 . 2 2 1 1 DT H5' H 1 3.575 0.008 . 1 . . . . 11 T H5' . 16222 1 124 . 2 2 1 1 DT H5'' H 1 3.578 0.004 . 1 . . . . 11 T H5'' . 16222 1 125 . 2 2 1 1 DT H6 H 1 7.303 0.014 . 1 . . . . 11 T H6 . 16222 1 126 . 2 2 1 1 DT H71 H 1 1.573 0.009 . 1 . . . . 11 T H7 . 16222 1 127 . 2 2 1 1 DT H72 H 1 1.573 0.009 . 1 . . . . 11 T H7 . 16222 1 128 . 2 2 1 1 DT H73 H 1 1.573 0.009 . 1 . . . . 11 T H7 . 16222 1 129 . 2 2 2 2 DG H1 H 1 12.666 0.001 . 1 . . . . 12 G H1 . 16222 1 130 . 2 2 2 2 DG H1' H 1 5.326 0.002 . 1 . . . . 12 G H1' . 16222 1 131 . 2 2 2 2 DG H2' H 1 2.674 0.010 . 1 . . . . 12 G H2' . 16222 1 132 . 2 2 2 2 DG H2'' H 1 2.724 0.004 . 1 . . . . 12 G H2'' . 16222 1 133 . 2 2 2 2 DG H3' H 1 4.911 0.008 . 1 . . . . 12 G H3' . 16222 1 134 . 2 2 2 2 DG H4' H 1 4.244 0.005 . 1 . . . . 12 G H4' . 16222 1 135 . 2 2 2 2 DG H5' H 1 3.968 0.007 . 1 . . . . 12 G H5' . 16222 1 136 . 2 2 2 2 DG H5'' H 1 3.881 0.007 . 1 . . . . 12 G H5'' . 16222 1 137 . 2 2 2 2 DG H8 H 1 7.913 0.008 . 1 . . . . 12 G H8 . 16222 1 138 . 2 2 3 3 DA H1' H 1 5.935 0.007 . 1 . . . . 13 A H1' . 16222 1 139 . 2 2 3 3 DA H2 H 1 7.698 0.012 . 1 . . . . 13 A H2 . 16222 1 140 . 2 2 3 3 DA H2' H 1 2.716 0.010 . 1 . . . . 13 A H2' . 16222 1 141 . 2 2 3 3 DA H2'' H 1 2.822 0.011 . 1 . . . . 13 A H2'' . 16222 1 142 . 2 2 3 3 DA H3' H 1 5.014 0.007 . 1 . . . . 13 A H3' . 16222 1 143 . 2 2 3 3 DA H4' H 1 4.406 0.008 . 1 . . . . 13 A H4' . 16222 1 144 . 2 2 3 3 DA H5' H 1 4.212 0.007 . 1 . . . . 13 A H5' . 16222 1 145 . 2 2 3 3 DA H5'' H 1 4.092 0.005 . 1 . . . . 13 A H5'' . 16222 1 146 . 2 2 3 3 DA H8 H 1 8.141 0.009 . 1 . . . . 13 A H8 . 16222 1 147 . 2 2 3 3 DA H61 H 1 7.320 0.011 . 1 . . . . 13 A H61 . 16222 1 148 . 2 2 3 3 DA H62 H 1 6.042 0.000 . 1 . . . . 13 A H62 . 16222 1 149 . 2 2 4 4 DA H1' H 1 6.113 0.004 . 1 . . . . 14 A H1' . 16222 1 150 . 2 2 4 4 DA H2 H 1 7.693 0.003 . 1 . . . . 14 A H2 . 16222 1 151 . 2 2 4 4 DA H2' H 1 2.502 0.008 . 1 . . . . 14 A H2' . 16222 1 152 . 2 2 4 4 DA H2'' H 1 2.795 0.009 . 1 . . . . 14 A H2'' . 16222 1 153 . 2 2 4 4 DA H3' H 1 4.862 0.009 . 1 . . . . 14 A H3' . 16222 1 154 . 2 2 4 4 DA H4' H 1 4.402 0.007 . 1 . . . . 14 A H4' . 16222 1 155 . 2 2 4 4 DA H5' H 1 4.207 0.010 . 1 . . . . 14 A H5' . 16222 1 156 . 2 2 4 4 DA H5'' H 1 4.191 0.008 . 1 . . . . 14 A H5'' . 16222 1 157 . 2 2 4 4 DA H8 H 1 8.031 0.015 . 1 . . . . 14 A H8 . 16222 1 158 . 2 2 4 4 DA H61 H 1 7.340 0.002 . 1 . . . . 14 A H61 . 16222 1 159 . 2 2 4 4 DA H62 H 1 6.031 0.002 . 1 . . . . 14 A H62 . 16222 1 160 . 2 2 5 5 DT H1' H 1 5.727 0.003 . 1 . . . . 15 T H1' . 16222 1 161 . 2 2 5 5 DT H2' H 1 2.072 0.012 . 1 . . . . 15 T H2' . 16222 1 162 . 2 2 5 5 DT H2'' H 1 2.381 0.006 . 1 . . . . 15 T H2'' . 16222 1 163 . 2 2 5 5 DT H3 H 1 13.691 0.002 . 1 . . . . 15 T H3 . 16222 1 164 . 2 2 5 5 DT H3' H 1 4.692 0.008 . 1 . . . . 15 T H3' . 16222 1 165 . 2 2 5 5 DT H4' H 1 4.189 0.007 . 1 . . . . 15 T H4' . 16222 1 166 . 2 2 5 5 DT H5' H 1 4.081 0.004 . 1 . . . . 15 T H5' . 16222 1 167 . 2 2 5 5 DT H5'' H 1 4.156 0.024 . 1 . . . . 15 T H5'' . 16222 1 168 . 2 2 5 5 DT H6 H 1 6.952 0.006 . 1 . . . . 15 T H6 . 16222 1 169 . 2 2 5 5 DT H71 H 1 1.163 0.004 . 1 . . . . 15 T H7 . 16222 1 170 . 2 2 5 5 DT H72 H 1 1.163 0.004 . 1 . . . . 15 T H7 . 16222 1 171 . 2 2 5 5 DT H73 H 1 1.163 0.004 . 1 . . . . 15 T H7 . 16222 1 172 . 2 2 6 6 DC H1' H 1 5.806 0.006 . 1 . . . . 16 C H1' . 16222 1 173 . 2 2 6 6 DC H2' H 1 1.850 0.004 . 1 . . . . 16 C H2' . 16222 1 174 . 2 2 6 6 DC H2'' H 1 2.420 0.014 . 1 . . . . 16 C H2'' . 16222 1 175 . 2 2 6 6 DC H3' H 1 4.709 0.006 . 1 . . . . 16 C H3' . 16222 1 176 . 2 2 6 6 DC H4' H 1 4.198 0.006 . 1 . . . . 16 C H4' . 16222 1 177 . 2 2 6 6 DC H5 H 1 5.245 0.003 . 1 . . . . 16 C H5 . 16222 1 178 . 2 2 6 6 DC H5' H 1 4.041 0.012 . 1 . . . . 16 C H5' . 16222 1 179 . 2 2 6 6 DC H6 H 1 7.284 0.003 . 1 . . . . 16 C H6 . 16222 1 180 . 2 2 6 6 DC H41 H 1 5.584 0.000 . 1 . . . . 16 C H41 . 16222 1 181 . 2 2 6 6 DC H42 H 1 8.379 0.002 . 1 . . . . 16 C H42 . 16222 1 182 . 2 2 7 7 DA H1' H 1 5.905 0.005 . 1 . . . . 17 A H1' . 16222 1 183 . 2 2 7 7 DA H2 H 1 7.723 0.003 . 1 . . . . 17 A H2 . 16222 1 184 . 2 2 7 7 DA H2' H 1 2.690 0.006 . 1 . . . . 17 A H2' . 16222 1 185 . 2 2 7 7 DA H2'' H 1 2.793 0.006 . 1 . . . . 17 A H2'' . 16222 1 186 . 2 2 7 7 DA H3' H 1 4.840 0.004 . 1 . . . . 17 A H3' . 16222 1 187 . 2 2 7 7 DA H4' H 1 4.195 0.008 . 1 . . . . 17 A H4' . 16222 1 188 . 2 2 7 7 DA H5' H 1 3.862 0.006 . 1 . . . . 17 A H5' . 16222 1 189 . 2 2 7 7 DA H8 H 1 8.328 0.011 . 1 . . . . 17 A H8 . 16222 1 190 . 2 2 7 7 DA H61 H 1 7.123 0.003 . 1 . . . . 17 A H61 . 16222 1 191 . 2 2 7 7 DA H62 H 1 6.890 0.000 . 1 . . . . 17 A H62 . 16222 1 192 . 2 2 8 8 DT H1' H 1 5.584 0.002 . 1 . . . . 18 T H1' . 16222 1 193 . 2 2 8 8 DT H2' H 1 1.939 0.013 . 1 . . . . 18 T H2' . 16222 1 194 . 2 2 8 8 DT H2'' H 1 2.337 0.016 . 1 . . . . 18 T H2'' . 16222 1 195 . 2 2 8 8 DT H3 H 1 13.352 0.002 . 1 . . . . 18 T H3 . 16222 1 196 . 2 2 8 8 DT H3' H 1 4.707 0.005 . 1 . . . . 18 T H3' . 16222 1 197 . 2 2 8 8 DT H4' H 1 4.211 0.014 . 1 . . . . 18 T H4' . 16222 1 198 . 2 2 8 8 DT H5' H 1 4.016 0.011 . 1 . . . . 18 T H5' . 16222 1 199 . 2 2 8 8 DT H5'' H 1 4.106 0.005 . 1 . . . . 18 T H5'' . 16222 1 200 . 2 2 8 8 DT H6 H 1 7.262 0.012 . 1 . . . . 18 T H6 . 16222 1 201 . 2 2 8 8 DT H71 H 1 1.347 0.006 . 1 . . . . 18 T H7 . 16222 1 202 . 2 2 8 8 DT H72 H 1 1.347 0.006 . 1 . . . . 18 T H7 . 16222 1 203 . 2 2 8 8 DT H73 H 1 1.347 0.006 . 1 . . . . 18 T H7 . 16222 1 204 . 2 2 9 9 DA H1' H 1 6.045 0.008 . 1 . . . . 19 A H1' . 16222 1 205 . 2 2 9 9 DA H2' H 1 2.631 0.007 . 1 . . . . 19 A H2' . 16222 1 206 . 2 2 9 9 DA H2'' H 1 2.831 0.010 . 1 . . . . 19 A H2'' . 16222 1 207 . 2 2 9 9 DA H3' H 1 4.981 0.007 . 1 . . . . 19 A H3' . 16222 1 208 . 2 2 9 9 DA H4' H 1 4.369 0.009 . 1 . . . . 19 A H4' . 16222 1 209 . 2 2 9 9 DA H5' H 1 4.024 0.009 . 1 . . . . 19 A H5' . 16222 1 210 . 2 2 9 9 DA H5'' H 1 4.212 0.010 . 1 . . . . 19 A H5'' . 16222 1 211 . 2 2 9 9 DA H8 H 1 8.142 0.008 . 1 . . . . 19 A H8 . 16222 1 212 . 2 2 10 10 DG H1 H 1 12.664 0.000 . 1 . . . . 20 G H1 . 16222 1 213 . 2 2 10 10 DG H1' H 1 5.952 0.003 . 1 . . . . 20 G H1' . 16222 1 214 . 2 2 10 10 DG H2' H 1 2.378 0.005 . 1 . . . . 20 G H2' . 16222 1 215 . 2 2 10 10 DG H2'' H 1 2.203 0.004 . 1 . . . . 20 G H2'' . 16222 1 216 . 2 2 10 10 DG H3' H 1 4.584 0.005 . 1 . . . . 20 G H3' . 16222 1 217 . 2 2 10 10 DG H4' H 1 4.126 0.008 . 1 . . . . 20 G H4' . 16222 1 218 . 2 2 10 10 DG H5' H 1 4.085 0.006 . 1 . . . . 20 G H5' . 16222 1 219 . 2 2 10 10 DG H5'' H 1 4.211 0.007 . 1 . . . . 20 G H5'' . 16222 1 220 . 2 2 10 10 DG H8 H 1 7.662 0.004 . 1 . . . . 20 G H8 . 16222 1 stop_ save_