################################### # 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 30730 _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 0.015 _Assigned_chem_shift_list.Chem_shift_13C_err 0.04 _Assigned_chem_shift_list.Chem_shift_15N_err 0.03 _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 'values measured in multiple spectra' _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' . . . 30730 1 2 '3D 1H-13C NOESY' . . . 30730 1 3 '3D HCCH-COSY' . . . 30730 1 4 '3D HCCH-TOCSY' . . . 30730 1 5 '2D 1H-13C ct-HSQC' . . . 30730 1 6 '2D 1H-15N HSQC' . . . 30730 1 7 '2D 1H-13C ctep-HSQC' . . . 30730 1 8 '2d H(CN)C' . . . 30730 1 9 '2D H(N)CO' . . . 30730 1 10 '2D 1H-1H NOESY' . . . 30730 1 11 '3D 1H-15N NOESY' . . . 30730 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 G H1' H 1 5.74 0.015 . 1 . . . . A 1 G H1' . 30730 1 2 . 1 . 1 1 1 G H2' H 1 4.81 0.015 . 1 . . . . A 1 G H2' . 30730 1 3 . 1 . 1 1 1 G H3' H 1 4.42 0.015 . 1 . . . . A 1 G H3' . 30730 1 4 . 1 . 1 1 1 G H5' H 1 4.17 0.015 . 2 . . . . A 1 G H5' . 30730 1 5 . 1 . 1 1 1 G H5'' H 1 4.02 0.015 . 2 . . . . A 1 G H5'' . 30730 1 6 . 1 . 1 1 1 G H8 H 1 8.05 0.015 . 1 . . . . A 1 G H8 . 30730 1 7 . 1 . 1 1 1 G C8 C 13 139.20 0.015 . 1 . . . . A 1 G C8 . 30730 1 8 . 1 . 1 2 2 G H1 H 1 12.79 0.015 . 1 . . . . A 2 G H1 . 30730 1 9 . 1 . 1 2 2 G H1' H 1 5.84 0.015 . 1 . . . . A 2 G H1' . 30730 1 10 . 1 . 1 2 2 G H2' H 1 4.57 0.015 . 1 . . . . A 2 G H2' . 30730 1 11 . 1 . 1 2 2 G H3' H 1 4.52 0.015 . 1 . . . . A 2 G H3' . 30730 1 12 . 1 . 1 2 2 G H4' H 1 4.46 0.015 . 1 . . . . A 2 G H4' . 30730 1 13 . 1 . 1 2 2 G H5' H 1 4.43 0.015 . 2 . . . . A 2 G H5' . 30730 1 14 . 1 . 1 2 2 G H5'' H 1 4.17 0.015 . 2 . . . . A 2 G H5'' . 30730 1 15 . 1 . 1 2 2 G H8 H 1 7.47 0.015 . 1 . . . . A 2 G H8 . 30730 1 16 . 1 . 1 2 2 G C1' C 13 91.90 0.075 . 1 . . . . A 2 G C1' . 30730 1 17 . 1 . 1 2 2 G C2 C 13 156.67 0.075 . 1 . . . . A 2 G C2 . 30730 1 18 . 1 . 1 2 2 G C2' C 13 74.85 0.075 . 1 . . . . A 2 G C2' . 30730 1 19 . 1 . 1 2 2 G C3' C 13 72.20 0.075 . 1 . . . . A 2 G C3' . 30730 1 20 . 1 . 1 2 2 G C4' C 13 81.70 0.075 . 1 . . . . A 2 G C4' . 30730 1 21 . 1 . 1 2 2 G C5' C 13 65.18 0.075 . 1 . . . . A 2 G C5' . 30730 1 22 . 1 . 1 2 2 G C6 C 13 161.79 0.075 . 1 . . . . A 2 G C6 . 30730 1 23 . 1 . 1 2 2 G C8 C 13 136.94 0.075 . 1 . . . . A 2 G C8 . 30730 1 24 . 1 . 1 2 2 G N1 N 15 147.84 0.055 . 1 . . . . A 2 G N1 . 30730 1 25 . 1 . 1 2 2 G N7 N 15 234.48 0.055 . 1 . . . . A 2 G N7 . 30730 1 26 . 1 . 1 2 2 G N9 N 15 170.41 0.055 . 1 . . . . A 2 G N9 . 30730 1 27 . 1 . 1 3 3 G H1 H 1 13.19 0.015 . 1 . . . . A 3 G H1 . 30730 1 28 . 1 . 1 3 3 G H1' H 1 5.69 0.015 . 1 . . . . A 3 G H1' . 30730 1 29 . 1 . 1 3 3 G H2' H 1 4.46 0.015 . 1 . . . . A 3 G H2' . 30730 1 30 . 1 . 1 3 3 G H3' H 1 4.36 0.015 . 1 . . . . A 3 G H3' . 30730 1 31 . 1 . 1 3 3 G H4' H 1 4.44 0.015 . 1 . . . . A 3 G H4' . 30730 1 32 . 1 . 1 3 3 G H5' H 1 4.41 0.015 . 2 . . . . A 3 G H5' . 30730 1 33 . 1 . 1 3 3 G H5'' H 1 4.01 0.015 . 2 . . . . A 3 G H5'' . 30730 1 34 . 1 . 1 3 3 G H8 H 1 7.15 0.015 . 1 . . . . A 3 G H8 . 30730 1 35 . 1 . 1 3 3 G C1' C 13 92.22 0.075 . 1 . . . . A 3 G C1' . 30730 1 36 . 1 . 1 3 3 G C2 C 13 157.12 0.075 . 1 . . . . A 3 G C2 . 30730 1 37 . 1 . 1 3 3 G C2' C 13 74.45 0.075 . 1 . . . . A 3 G C2' . 30730 1 38 . 1 . 1 3 3 G C3' C 13 72.27 0.075 . 1 . . . . A 3 G C3' . 30730 1 39 . 1 . 1 3 3 G C4' C 13 81.70 0.075 . 1 . . . . A 3 G C4' . 30730 1 40 . 1 . 1 3 3 G C5' C 13 64.85 0.075 . 1 . . . . A 3 G C5' . 30730 1 41 . 1 . 1 3 3 G C6 C 13 161.90 0.075 . 1 . . . . A 3 G C6 . 30730 1 42 . 1 . 1 3 3 G C8 C 13 136.11 0.075 . 1 . . . . A 3 G C8 . 30730 1 43 . 1 . 1 3 3 G N1 N 15 147.84 0.055 . 1 . . . . A 3 G N1 . 30730 1 44 . 1 . 1 3 3 G N7 N 15 234.78 0.055 . 1 . . . . A 3 G N7 . 30730 1 45 . 1 . 1 3 3 G N9 N 15 169.54 0.055 . 1 . . . . A 3 G N9 . 30730 1 46 . 1 . 1 4 4 C H1' H 1 5.43 0.015 . 1 . . . . A 4 C H1' . 30730 1 47 . 1 . 1 4 4 C H2' H 1 4.19 0.015 . 1 . . . . A 4 C H2' . 30730 1 48 . 1 . 1 4 4 C H3' H 1 4.39 0.015 . 1 . . . . A 4 C H3' . 30730 1 49 . 1 . 1 4 4 C H4' H 1 4.30 0.015 . 1 . . . . A 4 C H4' . 30730 1 50 . 1 . 1 4 4 C H5 H 1 5.11 0.015 . 1 . . . . A 4 C H5 . 30730 1 51 . 1 . 1 4 4 C H5' H 1 4.45 0.015 . 2 . . . . A 4 C H5' . 30730 1 52 . 1 . 1 4 4 C H5'' H 1 4.01 0.015 . 2 . . . . A 4 C H5'' . 30730 1 53 . 1 . 1 4 4 C H6 H 1 7.50 0.015 . 1 . . . . A 4 C H6 . 30730 1 54 . 1 . 1 4 4 C H41 H 1 6.82 0.015 . 2 . . . . A 4 C H41 . 30730 1 55 . 1 . 1 4 4 C H42 H 1 8.22 0.015 . 2 . . . . A 4 C H42 . 30730 1 56 . 1 . 1 4 4 C C1' C 13 93.45 0.075 . 1 . . . . A 4 C C1' . 30730 1 57 . 1 . 1 4 4 C C2 C 13 159.29 0.075 . 1 . . . . A 4 C C2 . 30730 1 58 . 1 . 1 4 4 C C2' C 13 74.68 0.075 . 1 . . . . A 4 C C2' . 30730 1 59 . 1 . 1 4 4 C C3' C 13 71.28 0.075 . 1 . . . . A 4 C C3' . 30730 1 60 . 1 . 1 4 4 C C4 C 13 161.90 0.075 . 1 . . . . A 4 C C4 . 30730 1 61 . 1 . 1 4 4 C C4' C 13 81.05 0.075 . 1 . . . . A 4 C C4' . 30730 1 62 . 1 . 1 4 4 C C5 C 13 96.37 0.075 . 1 . . . . A 4 C C5 . 30730 1 63 . 1 . 1 4 4 C C5' C 13 63.69 0.075 . 1 . . . . A 4 C C5' . 30730 1 64 . 1 . 1 4 4 C C6 C 13 141.19 0.075 . 1 . . . . A 4 C C6 . 30730 1 65 . 1 . 1 4 4 C N4 N 15 97.52 0.055 . 1 . . . . A 4 C N4 . 30730 1 66 . 1 . 1 5 5 U H1' H 1 5.46 0.015 . 1 . . . . A 5 U H1' . 30730 1 67 . 1 . 1 5 5 U H2' H 1 4.62 0.015 . 1 . . . . A 5 U H2' . 30730 1 68 . 1 . 1 5 5 U H3 H 1 13.15 0.015 . 1 . . . . A 5 U H3 . 30730 1 69 . 1 . 1 5 5 U H3' H 1 4.48 0.015 . 1 . . . . A 5 U H3' . 30730 1 70 . 1 . 1 5 5 U H4' H 1 4.33 0.015 . 1 . . . . A 5 U H4' . 30730 1 71 . 1 . 1 5 5 U H5 H 1 5.36 0.015 . 1 . . . . A 5 U H5 . 30730 1 72 . 1 . 1 5 5 U H5' H 1 4.46 0.015 . 2 . . . . A 5 U H5' . 30730 1 73 . 1 . 1 5 5 U H5'' H 1 4.02 0.015 . 2 . . . . A 5 U H5'' . 30730 1 74 . 1 . 1 5 5 U H6 H 1 7.74 0.015 . 1 . . . . A 5 U H6 . 30730 1 75 . 1 . 1 5 5 U C1' C 13 92.74 0.075 . 1 . . . . A 5 U C1' . 30730 1 76 . 1 . 1 5 5 U C2 C 13 152.92 0.075 . 1 . . . . A 5 U C2 . 30730 1 77 . 1 . 1 5 5 U C2' C 13 74.78 0.075 . 1 . . . . A 5 U C2' . 30730 1 78 . 1 . 1 5 5 U C3' C 13 71.81 0.075 . 1 . . . . A 5 U C3' . 30730 1 79 . 1 . 1 5 5 U C4 C 13 169.70 0.075 . 1 . . . . A 5 U C4 . 30730 1 80 . 1 . 1 5 5 U C4' C 13 81.11 0.075 . 1 . . . . A 5 U C4' . 30730 1 81 . 1 . 1 5 5 U C5 C 13 103.10 0.075 . 1 . . . . A 5 U C5 . 30730 1 82 . 1 . 1 5 5 U C5' C 13 63.94 0.075 . 1 . . . . A 5 U C5' . 30730 1 83 . 1 . 1 5 5 U C6 C 13 141.83 0.075 . 1 . . . . A 5 U C6 . 30730 1 84 . 1 . 1 5 5 U N3 N 15 161.67 0.055 . 1 . . . . A 5 U N3 . 30730 1 85 . 1 . 1 6 6 G H1 H 1 12.62 0.015 . 1 . . . . A 6 G H1 . 30730 1 86 . 1 . 1 6 6 G H1' H 1 5.65 0.015 . 1 . . . . A 6 G H1' . 30730 1 87 . 1 . 1 6 6 G H2' H 1 4.43 0.015 . 1 . . . . A 6 G H2' . 30730 1 88 . 1 . 1 6 6 G H3' H 1 4.18 0.015 . 1 . . . . A 6 G H3' . 30730 1 89 . 1 . 1 6 6 G H4' H 1 4.42 0.015 . 1 . . . . A 6 G H4' . 30730 1 90 . 1 . 1 6 6 G H5' H 1 4.36 0.015 . 2 . . . . A 6 G H5' . 30730 1 91 . 1 . 1 6 6 G H5'' H 1 4.40 0.015 . 2 . . . . A 6 G H5'' . 30730 1 92 . 1 . 1 6 6 G H8 H 1 7.48 0.015 . 1 . . . . A 6 G H8 . 30730 1 93 . 1 . 1 6 6 G C1' C 13 92.09 0.075 . 1 . . . . A 6 G C1' . 30730 1 94 . 1 . 1 6 6 G C2 C 13 156.21 0.075 . 1 . . . . A 6 G C2 . 30730 1 95 . 1 . 1 6 6 G C2' C 13 74.58 0.075 . 1 . . . . A 6 G C2' . 30730 1 96 . 1 . 1 6 6 G C3' C 13 72.27 0.075 . 1 . . . . A 6 G C3' . 30730 1 97 . 1 . 1 6 6 G C4' C 13 81.31 0.075 . 1 . . . . A 6 G C4' . 30730 1 98 . 1 . 1 6 6 G C5' C 13 65.50 0.075 . 1 . . . . A 6 G C5' . 30730 1 99 . 1 . 1 6 6 G C6 C 13 161.67 0.075 . 1 . . . . A 6 G C6 . 30730 1 100 . 1 . 1 6 6 G C8 C 13 136.12 0.075 . 1 . . . . A 6 G C8 . 30730 1 101 . 1 . 1 6 6 G N1 N 15 147.50 0.015 . 1 . . . . A 6 G N1 . 30730 1 102 . 1 . 1 6 6 G N7 N 15 237.00 0.055 . 1 . . . . A 6 G N7 . 30730 1 103 . 1 . 1 6 6 G N9 N 15 170.51 0.055 . 1 . . . . A 6 G N9 . 30730 1 104 . 1 . 1 7 7 U H1' H 1 5.27 0.015 . 1 . . . . A 7 U H1' . 30730 1 105 . 1 . 1 7 7 U H2' H 1 4.07 0.015 . 1 . . . . A 7 U H2' . 30730 1 106 . 1 . 1 7 7 U H3 H 1 11.06 0.015 . 1 . . . . A 7 U H3 . 30730 1 107 . 1 . 1 7 7 U H3' H 1 4.35 0.015 . 1 . . . . A 7 U H3' . 30730 1 108 . 1 . 1 7 7 U H4' H 1 4.19 0.015 . 1 . . . . A 7 U H4' . 30730 1 109 . 1 . 1 7 7 U H5 H 1 5.14 0.015 . 1 . . . . A 7 U H5 . 30730 1 110 . 1 . 1 7 7 U H5' H 1 4.97 0.015 . 2 . . . . A 7 U H5' . 30730 1 111 . 1 . 1 7 7 U H5'' H 1 4.32 0.015 . 2 . . . . A 7 U H5'' . 30730 1 112 . 1 . 1 7 7 U H6 H 1 7.32 0.015 . 1 . . . . A 7 U H6 . 30730 1 113 . 1 . 1 7 7 U C1' C 13 92.89 0.075 . 1 . . . . A 7 U C1' . 30730 1 114 . 1 . 1 7 7 U C2 C 13 154.27 0.075 . 1 . . . . A 7 U C2 . 30730 1 115 . 1 . 1 7 7 U C2' C 13 74.71 0.075 . 1 . . . . A 7 U C2' . 30730 1 116 . 1 . 1 7 7 U C3' C 13 71.41 0.075 . 1 . . . . A 7 U C3' . 30730 1 117 . 1 . 1 7 7 U C4 C 13 166.87 0.075 . 1 . . . . A 7 U C4 . 30730 1 118 . 1 . 1 7 7 U C4' C 13 82.03 0.075 . 1 . . . . A 7 U C4' . 30730 1 119 . 1 . 1 7 7 U C5 C 13 102.97 0.075 . 1 . . . . A 7 U C5 . 30730 1 120 . 1 . 1 7 7 U C5' C 13 63.52 0.075 . 1 . . . . A 7 U C5' . 30730 1 121 . 1 . 1 7 7 U C6 C 13 140.33 0.075 . 1 . . . . A 7 U C6 . 30730 1 122 . 1 . 1 7 7 U N3 N 15 158.30 0.055 . 1 . . . . A 7 U N3 . 30730 1 123 . 1 . 1 8 8 G H1' H 1 5.45 0.015 . 1 . . . . A 8 G H1' . 30730 1 124 . 1 . 1 8 8 G H2' H 1 4.60 0.015 . 1 . . . . A 8 G H2' . 30730 1 125 . 1 . 1 8 8 G H3' H 1 4.48 0.015 . 1 . . . . A 8 G H3' . 30730 1 126 . 1 . 1 8 8 G H4' H 1 4.37 0.015 . 1 . . . . A 8 G H4' . 30730 1 127 . 1 . 1 8 8 G H5' H 1 4.16 0.015 . 2 . . . . A 8 G H5' . 30730 1 128 . 1 . 1 8 8 G H5'' H 1 4.06 0.015 . 2 . . . . A 8 G H5'' . 30730 1 129 . 1 . 1 8 8 G H8 H 1 7.76 0.015 . 1 . . . . A 8 G H8 . 30730 1 130 . 1 . 1 8 8 G C1' C 13 88.40 0.075 . 1 . . . . A 8 G C1' . 30730 1 131 . 1 . 1 8 8 G C2 C 13 160.20 0.075 . 1 . . . . A 8 G C2 . 30730 1 132 . 1 . 1 8 8 G C2' C 13 74.78 0.075 . 1 . . . . A 8 G C2' . 30730 1 133 . 1 . 1 8 8 G C3' C 13 71.81 0.075 . 1 . . . . A 8 G C3' . 30730 1 134 . 1 . 1 8 8 G C4' C 13 81.18 0.075 . 1 . . . . A 8 G C4' . 30730 1 135 . 1 . 1 8 8 G C5' C 13 66.18 0.075 . 1 . . . . A 8 G C5' . 30730 1 136 . 1 . 1 8 8 G C8 C 13 139.42 0.075 . 1 . . . . A 8 G C8 . 30730 1 137 . 1 . 1 8 8 G N7 N 15 231.41 0.055 . 1 . . . . A 8 G N7 . 30730 1 138 . 1 . 1 8 8 G N9 N 15 172.44 0.055 . 1 . . . . A 8 G N9 . 30730 1 139 . 1 . 1 9 9 A H1' H 1 5.70 0.015 . 1 . . . . A 9 A H1' . 30730 1 140 . 1 . 1 9 9 A H2 H 1 7.65 0.015 . 1 . . . . A 9 A H2 . 30730 1 141 . 1 . 1 9 9 A H2' H 1 4.54 0.015 . 1 . . . . A 9 A H2' . 30730 1 142 . 1 . 1 9 9 A H3' H 1 4.62 0.015 . 1 . . . . A 9 A H3' . 30730 1 143 . 1 . 1 9 9 A H4' H 1 4.44 0.015 . 1 . . . . A 9 A H4' . 30730 1 144 . 1 . 1 9 9 A H5' H 1 4.29 0.015 . 2 . . . . A 9 A H5' . 30730 1 145 . 1 . 1 9 9 A H5'' H 1 4.17 0.015 . 2 . . . . A 9 A H5'' . 30730 1 146 . 1 . 1 9 9 A H8 H 1 8.15 0.015 . 1 . . . . A 9 A H8 . 30730 1 147 . 1 . 1 9 9 A C1' C 13 89.83 0.075 . 1 . . . . A 9 A C1' . 30730 1 148 . 1 . 1 9 9 A C2 C 13 154.11 0.075 . 1 . . . . A 9 A C2 . 30730 1 149 . 1 . 1 9 9 A C2' C 13 74.45 0.075 . 1 . . . . A 9 A C2' . 30730 1 150 . 1 . 1 9 9 A C3' C 13 73.99 0.075 . 1 . . . . A 9 A C3' . 30730 1 151 . 1 . 1 9 9 A C4' C 13 82.83 0.075 . 1 . . . . A 9 A C4' . 30730 1 152 . 1 . 1 9 9 A C5' C 13 66.17 0.075 . 1 . . . . A 9 A C5' . 30730 1 153 . 1 . 1 9 9 A C8 C 13 141.55 0.075 . 1 . . . . A 9 A C8 . 30730 1 154 . 1 . 1 9 9 A N1 N 15 223.94 0.055 . 1 . . . . A 9 A N1 . 30730 1 155 . 1 . 1 9 9 A N3 N 15 215.04 0.055 . 1 . . . . A 9 A N3 . 30730 1 156 . 1 . 1 9 9 A N7 N 15 231.37 0.055 . 1 . . . . A 9 A N7 . 30730 1 157 . 1 . 1 9 9 A N9 N 15 169.47 0.055 . 1 . . . . A 9 A N9 . 30730 1 158 . 1 . 1 10 10 U H1' H 1 5.34 0.015 . 1 . . . . A 10 U H1' . 30730 1 159 . 1 . 1 10 10 U H2' H 1 4.43 0.015 . 1 . . . . A 10 U H2' . 30730 1 160 . 1 . 1 10 10 U H3 H 1 13.19 0.015 . 1 . . . . A 10 U H3 . 30730 1 161 . 1 . 1 10 10 U H3' H 1 4.35 0.015 . 1 . . . . A 10 U H3' . 30730 1 162 . 1 . 1 10 10 U H4' H 1 4.39 0.015 . 1 . . . . A 10 U H4' . 30730 1 163 . 1 . 1 10 10 U H5 H 1 5.02 0.015 . 1 . . . . A 10 U H5 . 30730 1 164 . 1 . 1 10 10 U H5' H 1 4.31 0.015 . 2 . . . . A 10 U H5' . 30730 1 165 . 1 . 1 10 10 U H5'' H 1 4.17 0.015 . 2 . . . . A 10 U H5'' . 30730 1 166 . 1 . 1 10 10 U H6 H 1 7.45 0.015 . 1 . . . . A 10 U H6 . 30730 1 167 . 1 . 1 10 10 U C1' C 13 92.35 0.075 . 1 . . . . A 10 U C1' . 30730 1 168 . 1 . 1 10 10 U C2 C 13 152.87 0.075 . 1 . . . . A 10 U C2 . 30730 1 169 . 1 . 1 10 10 U C2' C 13 74.19 0.075 . 1 . . . . A 10 U C2' . 30730 1 170 . 1 . 1 10 10 U C3' C 13 72.80 0.075 . 1 . . . . A 10 U C3' . 30730 1 171 . 1 . 1 10 10 U C4' C 13 81.97 0.075 . 1 . . . . A 10 U C4' . 30730 1 172 . 1 . 1 10 10 U C5 C 13 102.84 0.075 . 1 . . . . A 10 U C5 . 30730 1 173 . 1 . 1 10 10 U C5' C 13 65.67 0.075 . 1 . . . . A 10 U C5' . 30730 1 174 . 1 . 1 10 10 U C6 C 13 141.96 0.075 . 1 . . . . A 10 U C6 . 30730 1 175 . 1 . 1 10 10 U N3 N 15 162.11 0.055 . 1 . . . . A 10 U N3 . 30730 1 176 . 1 . 1 11 11 G H1 H 1 12.60 0.015 . 1 . . . . A 11 G H1 . 30730 1 177 . 1 . 1 11 11 G H1' H 1 5.74 0.015 . 1 . . . . A 11 G H1' . 30730 1 178 . 1 . 1 11 11 G H2' H 1 4.43 0.015 . 1 . . . . A 11 G H2' . 30730 1 179 . 1 . 1 11 11 G H3' H 1 4.47 0.015 . 1 . . . . A 11 G H3' . 30730 1 180 . 1 . 1 11 11 G H4' H 1 4.39 0.015 . 1 . . . . A 11 G H4' . 30730 1 181 . 1 . 1 11 11 G H5' H 1 4.41 0.015 . 2 . . . . A 11 G H5' . 30730 1 182 . 1 . 1 11 11 G H5'' H 1 4.08 0.015 . 2 . . . . A 11 G H5'' . 30730 1 183 . 1 . 1 11 11 G H8 H 1 7.66 0.015 . 1 . . . . A 11 G H8 . 30730 1 184 . 1 . 1 11 11 G C1' C 13 91.71 0.075 . 1 . . . . A 11 G C1' . 30730 1 185 . 1 . 1 11 11 G C2 C 13 156.69 0.075 . 1 . . . . A 11 G C2 . 30730 1 186 . 1 . 1 11 11 G C2' C 13 74.58 0.075 . 1 . . . . A 11 G C2' . 30730 1 187 . 1 . 1 11 11 G C3' C 13 72.00 0.075 . 1 . . . . A 11 G C3' . 30730 1 188 . 1 . 1 11 11 G C4' C 13 81.20 0.075 . 1 . . . . A 11 G C4' . 30730 1 189 . 1 . 1 11 11 G C5' C 13 64.77 0.075 . 1 . . . . A 11 G C5' . 30730 1 190 . 1 . 1 11 11 G C6 C 13 161.54 0.075 . 1 . . . . A 11 G C6 . 30730 1 191 . 1 . 1 11 11 G C8 C 13 136.66 0.075 . 1 . . . . A 11 G C8 . 30730 1 192 . 1 . 1 11 11 G N1 N 15 147.79 0.055 . 1 . . . . A 11 G N1 . 30730 1 193 . 1 . 1 11 11 G N7 N 15 235.30 0.055 . 1 . . . . A 11 G N7 . 30730 1 194 . 1 . 1 11 11 G N9 N 15 170.58 0.055 . 1 . . . . A 11 G N9 . 30730 1 195 . 1 . 1 12 12 C H1' H 1 5.34 0.015 . 1 . . . . A 12 C H1' . 30730 1 196 . 1 . 1 12 12 C H2' H 1 4.35 0.015 . 1 . . . . A 12 C H2' . 30730 1 197 . 1 . 1 12 12 C H3' H 1 4.13 0.015 . 1 . . . . A 12 C H3' . 30730 1 198 . 1 . 1 12 12 C H4' H 1 4.34 0.015 . 1 . . . . A 12 C H4' . 30730 1 199 . 1 . 1 12 12 C H5 H 1 5.09 0.015 . 1 . . . . A 12 C H5 . 30730 1 200 . 1 . 1 12 12 C H5' H 1 4.40 0.015 . 2 . . . . A 12 C H5' . 30730 1 201 . 1 . 1 12 12 C H5'' H 1 3.97 0.015 . 2 . . . . A 12 C H5'' . 30730 1 202 . 1 . 1 12 12 C H6 H 1 7.36 0.015 . 1 . . . . A 12 C H6 . 30730 1 203 . 1 . 1 12 12 C H41 H 1 6.76 0.015 . 2 . . . . A 12 C H41 . 30730 1 204 . 1 . 1 12 12 C H42 H 1 8.46 0.015 . 2 . . . . A 12 C H42 . 30730 1 205 . 1 . 1 12 12 C C1' C 13 93.00 0.075 . 1 . . . . A 12 C C1' . 30730 1 206 . 1 . 1 12 12 C C2 C 13 158.90 0.075 . 1 . . . . A 12 C C2 . 30730 1 207 . 1 . 1 12 12 C C2' C 13 74.52 0.075 . 1 . . . . A 12 C C2' . 30730 1 208 . 1 . 1 12 12 C C3' C 13 71.02 0.075 . 1 . . . . A 12 C C3' . 30730 1 209 . 1 . 1 12 12 C C4' C 13 81.05 0.075 . 1 . . . . A 12 C C4' . 30730 1 210 . 1 . 1 12 12 C C5 C 13 96.41 0.075 . 1 . . . . A 12 C C5 . 30730 1 211 . 1 . 1 12 12 C C5' C 13 63.77 0.075 . 1 . . . . A 12 C C5' . 30730 1 212 . 1 . 1 12 12 C C6 C 13 140.69 0.075 . 1 . . . . A 12 C C6 . 30730 1 213 . 1 . 1 12 12 C N4 N 15 99.25 0.055 . 1 . . . . A 12 C N4 . 30730 1 214 . 1 . 1 13 13 U H1' H 1 5.56 0.015 . 1 . . . . A 13 U H1' . 30730 1 215 . 1 . 1 13 13 U H2' H 1 3.67 0.015 . 1 . . . . A 13 U H2' . 30730 1 216 . 1 . 1 13 13 U H3 H 1 11.66 0.015 . 1 . . . . A 13 U H3 . 30730 1 217 . 1 . 1 13 13 U H3' H 1 4.44 0.015 . 1 . . . . A 13 U H3' . 30730 1 218 . 1 . 1 13 13 U H4' H 1 4.26 0.015 . 1 . . . . A 13 U H4' . 30730 1 219 . 1 . 1 13 13 U H5 H 1 5.63 0.015 . 1 . . . . A 13 U H5 . 30730 1 220 . 1 . 1 13 13 U H5' H 1 4.40 0.015 . 2 . . . . A 13 U H5' . 30730 1 221 . 1 . 1 13 13 U H5'' H 1 4.00 0.015 . 2 . . . . A 13 U H5'' . 30730 1 222 . 1 . 1 13 13 U H6 H 1 7.66 0.015 . 1 . . . . A 13 U H6 . 30730 1 223 . 1 . 1 13 13 U C1' C 13 93.65 0.075 . 1 . . . . A 13 U C1' . 30730 1 224 . 1 . 1 13 13 U C2 C 13 153.31 0.075 . 1 . . . . A 13 U C2 . 30730 1 225 . 1 . 1 13 13 U C2' C 13 75.04 0.075 . 1 . . . . A 13 U C2' . 30730 1 226 . 1 . 1 13 13 U C3' C 13 72.30 0.075 . 1 . . . . A 13 U C3' . 30730 1 227 . 1 . 1 13 13 U C4' C 13 81.64 0.075 . 1 . . . . A 13 U C4' . 30730 1 228 . 1 . 1 13 13 U C5 C 13 104.27 0.075 . 1 . . . . A 13 U C5 . 30730 1 229 . 1 . 1 13 13 U C5' C 13 63.11 0.075 . 1 . . . . A 13 U C5' . 30730 1 230 . 1 . 1 13 13 U C6 C 13 140.88 0.075 . 1 . . . . A 13 U C6 . 30730 1 231 . 1 . 1 13 13 U N3 N 15 159.94 0.055 . 1 . . . . A 13 U N3 . 30730 1 232 . 1 . 1 14 14 U H1' H 1 6.01 0.015 . 1 . . . . A 14 U H1' . 30730 1 233 . 1 . 1 14 14 U H2' H 1 4.56 0.015 . 1 . . . . A 14 U H2' . 30730 1 234 . 1 . 1 14 14 U H3' H 1 3.92 0.015 . 1 . . . . A 14 U H3' . 30730 1 235 . 1 . 1 14 14 U H4' H 1 4.39 0.015 . 1 . . . . A 14 U H4' . 30730 1 236 . 1 . 1 14 14 U H5 H 1 5.77 0.015 . 1 . . . . A 14 U H5 . 30730 1 237 . 1 . 1 14 14 U H5' H 1 4.15 0.015 . 2 . . . . A 14 U H5' . 30730 1 238 . 1 . 1 14 14 U H5'' H 1 3.96 0.015 . 2 . . . . A 14 U H5'' . 30730 1 239 . 1 . 1 14 14 U H6 H 1 7.93 0.015 . 1 . . . . A 14 U H6 . 30730 1 240 . 1 . 1 14 14 U C1' C 13 88.34 0.075 . 1 . . . . A 14 U C1' . 30730 1 241 . 1 . 1 14 14 U C2 C 13 155.30 0.075 . 1 . . . . A 14 U C2 . 30730 1 242 . 1 . 1 14 14 U C2' C 13 73.66 0.075 . 1 . . . . A 14 U C2' . 30730 1 243 . 1 . 1 14 14 U C3' C 13 76.89 0.075 . 1 . . . . A 14 U C3' . 30730 1 244 . 1 . 1 14 14 U C4' C 13 86.13 0.075 . 1 . . . . A 14 U C4' . 30730 1 245 . 1 . 1 14 14 U C5 C 13 104.65 0.075 . 1 . . . . A 14 U C5 . 30730 1 246 . 1 . 1 14 14 U C5' C 13 66.92 0.075 . 1 . . . . A 14 U C5' . 30730 1 247 . 1 . 1 14 14 U C6 C 13 144.91 0.075 . 1 . . . . A 14 U C6 . 30730 1 248 . 1 . 1 15 15 C H1' H 1 5.85 0.015 . 1 . . . . A 15 C H1' . 30730 1 249 . 1 . 1 15 15 C H2' H 1 4.00 0.015 . 1 . . . . A 15 C H2' . 30730 1 250 . 1 . 1 15 15 C H3' H 1 4.37 0.015 . 1 . . . . A 15 C H3' . 30730 1 251 . 1 . 1 15 15 C H4' H 1 3.70 0.015 . 1 . . . . A 15 C H4' . 30730 1 252 . 1 . 1 15 15 C H5 H 1 6.03 0.015 . 1 . . . . A 15 C H5 . 30730 1 253 . 1 . 1 15 15 C H5' H 1 3.52 0.015 . 2 . . . . A 15 C H5' . 30730 1 254 . 1 . 1 15 15 C H5'' H 1 2.65 0.015 . 2 . . . . A 15 C H5'' . 30730 1 255 . 1 . 1 15 15 C H6 H 1 7.60 0.015 . 1 . . . . A 15 C H6 . 30730 1 256 . 1 . 1 15 15 C C1' C 13 88.15 0.075 . 1 . . . . A 15 C C1' . 30730 1 257 . 1 . 1 15 15 C C2 C 13 160.30 0.075 . 1 . . . . A 15 C C2 . 30730 1 258 . 1 . 1 15 15 C C2' C 13 76.76 0.075 . 1 . . . . A 15 C C2' . 30730 1 259 . 1 . 1 15 15 C C3' C 13 79.46 0.075 . 1 . . . . A 15 C C3' . 30730 1 260 . 1 . 1 15 15 C C4' C 13 83.62 0.075 . 1 . . . . A 15 C C4' . 30730 1 261 . 1 . 1 15 15 C C5 C 13 97.66 0.075 . 1 . . . . A 15 C C5 . 30730 1 262 . 1 . 1 15 15 C C5' C 13 66.42 0.075 . 1 . . . . A 15 C C5' . 30730 1 263 . 1 . 1 15 15 C C6 C 13 143.05 0.075 . 1 . . . . A 15 C C6 . 30730 1 264 . 1 . 1 16 16 G H1 H 1 9.86 0.015 . 1 . . . . A 16 G H1 . 30730 1 265 . 1 . 1 16 16 G H1' H 1 5.86 0.015 . 1 . . . . A 16 G H1' . 30730 1 266 . 1 . 1 16 16 G H2' H 1 4.73 0.015 . 1 . . . . A 16 G H2' . 30730 1 267 . 1 . 1 16 16 G H3' H 1 5.52 0.015 . 1 . . . . A 16 G H3' . 30730 1 268 . 1 . 1 16 16 G H4' H 1 4.32 0.015 . 1 . . . . A 16 G H4' . 30730 1 269 . 1 . 1 16 16 G H5' H 1 4.33 0.015 . 2 . . . . A 16 G H5' . 30730 1 270 . 1 . 1 16 16 G H5'' H 1 4.10 0.015 . 2 . . . . A 16 G H5'' . 30730 1 271 . 1 . 1 16 16 G H8 H 1 7.77 0.015 . 1 . . . . A 16 G H8 . 30730 1 272 . 1 . 1 16 16 G C1' C 13 93.71 0.075 . 1 . . . . A 16 G C1' . 30730 1 273 . 1 . 1 16 16 G C2 C 13 155.86 0.075 . 1 . . . . A 16 G C2 . 30730 1 274 . 1 . 1 16 16 G C2' C 13 76.30 0.075 . 1 . . . . A 16 G C2' . 30730 1 275 . 1 . 1 16 16 G C3' C 13 75.41 0.075 . 1 . . . . A 16 G C3' . 30730 1 276 . 1 . 1 16 16 G C4' C 13 82.37 0.075 . 1 . . . . A 16 G C4' . 30730 1 277 . 1 . 1 16 16 G C5' C 13 68.10 0.075 . 1 . . . . A 16 G C5' . 30730 1 278 . 1 . 1 16 16 G C6 C 13 161.77 0.075 . 1 . . . . A 16 G C6 . 30730 1 279 . 1 . 1 16 16 G C8 C 13 143.14 0.075 . 1 . . . . A 16 G C8 . 30730 1 280 . 1 . 1 16 16 G N1 N 15 143.86 0.055 . 1 . . . . A 16 G N1 . 30730 1 281 . 1 . 1 16 16 G N7 N 15 237.68 0.055 . 1 . . . . A 16 G N7 . 30730 1 282 . 1 . 1 16 16 G N9 N 15 167.46 0.055 . 1 . . . . A 16 G N9 . 30730 1 283 . 1 . 1 17 17 G H1 H 1 13.28 0.015 . 1 . . . . A 17 G H1 . 30730 1 284 . 1 . 1 17 17 G H1' H 1 4.37 0.015 . 1 . . . . A 17 G H1' . 30730 1 285 . 1 . 1 17 17 G H2' H 1 4.42 0.015 . 1 . . . . A 17 G H2' . 30730 1 286 . 1 . 1 17 17 G H3' H 1 4.19 0.015 . 1 . . . . A 17 G H3' . 30730 1 287 . 1 . 1 17 17 G H4' H 1 4.34 0.015 . 1 . . . . A 17 G H4' . 30730 1 288 . 1 . 1 17 17 G H5' H 1 4.40 0.015 . 2 . . . . A 17 G H5' . 30730 1 289 . 1 . 1 17 17 G H5'' H 1 4.16 0.015 . 2 . . . . A 17 G H5'' . 30730 1 290 . 1 . 1 17 17 G H8 H 1 8.20 0.015 . 1 . . . . A 17 G H8 . 30730 1 291 . 1 . 1 17 17 G C1' C 13 92.35 0.075 . 1 . . . . A 17 G C1' . 30730 1 292 . 1 . 1 17 17 G C2 C 13 155.86 0.075 . 1 . . . . A 17 G C2 . 30730 1 293 . 1 . 1 17 17 G C2' C 13 74.89 0.075 . 1 . . . . A 17 G C2' . 30730 1 294 . 1 . 1 17 17 G C3' C 13 74.37 0.075 . 1 . . . . A 17 G C3' . 30730 1 295 . 1 . 1 17 17 G C4' C 13 83.62 0.075 . 1 . . . . A 17 G C4' . 30730 1 296 . 1 . 1 17 17 G C5' C 13 68.22 0.075 . 1 . . . . A 17 G C5' . 30730 1 297 . 1 . 1 17 17 G C6 C 13 162.60 0.075 . 1 . . . . A 17 G C6 . 30730 1 298 . 1 . 1 17 17 G C8 C 13 139.06 0.075 . 1 . . . . A 17 G C8 . 30730 1 299 . 1 . 1 17 17 G N1 N 15 148.32 0.055 . 1 . . . . A 17 G N1 . 30730 1 300 . 1 . 1 17 17 G N7 N 15 233.81 0.055 . 1 . . . . A 17 G N7 . 30730 1 301 . 1 . 1 17 17 G N9 N 15 171.10 0.055 . 1 . . . . A 17 G N9 . 30730 1 302 . 1 . 1 18 18 C H1' H 1 5.37 0.015 . 1 . . . . A 18 C H1' . 30730 1 303 . 1 . 1 18 18 C H2' H 1 4.42 0.015 . 1 . . . . A 18 C H2' . 30730 1 304 . 1 . 1 18 18 C H3' H 1 4.43 0.015 . 1 . . . . A 18 C H3' . 30730 1 305 . 1 . 1 18 18 C H4' H 1 4.32 0.015 . 1 . . . . A 18 C H4' . 30730 1 306 . 1 . 1 18 18 C H5 H 1 5.15 0.015 . 1 . . . . A 18 C H5 . 30730 1 307 . 1 . 1 18 18 C H5' H 1 4.40 0.015 . 2 . . . . A 18 C H5' . 30730 1 308 . 1 . 1 18 18 C H5'' H 1 3.96 0.015 . 2 . . . . A 18 C H5'' . 30730 1 309 . 1 . 1 18 18 C H6 H 1 7.55 0.015 . 1 . . . . A 18 C H6 . 30730 1 310 . 1 . 1 18 18 C H41 H 1 6.75 0.015 . 2 . . . . A 18 C H41 . 30730 1 311 . 1 . 1 18 18 C H42 H 1 8.53 0.015 . 2 . . . . A 18 C H42 . 30730 1 312 . 1 . 1 18 18 C C1' C 13 93.07 0.075 . 1 . . . . A 18 C C1' . 30730 1 313 . 1 . 1 18 18 C C2 C 13 159.11 0.075 . 1 . . . . A 18 C C2 . 30730 1 314 . 1 . 1 18 18 C C2' C 13 74.32 0.075 . 1 . . . . A 18 C C2' . 30730 1 315 . 1 . 1 18 18 C C3' C 13 71.15 0.075 . 1 . . . . A 18 C C3' . 30730 1 316 . 1 . 1 18 18 C C4' C 13 80.98 0.075 . 1 . . . . A 18 C C4' . 30730 1 317 . 1 . 1 18 18 C C5 C 13 96.37 0.075 . 1 . . . . A 18 C C5 . 30730 1 318 . 1 . 1 18 18 C C5' C 13 63.35 0.075 . 1 . . . . A 18 C C5' . 30730 1 319 . 1 . 1 18 18 C C6 C 13 141.19 0.075 . 1 . . . . A 18 C C6 . 30730 1 320 . 1 . 1 18 18 C N4 N 15 97.45 0.055 . 1 . . . . A 18 C N4 . 30730 1 321 . 1 . 1 19 19 A H1' H 1 5.89 0.015 . 1 . . . . A 19 A H1' . 30730 1 322 . 1 . 1 19 19 A H2 H 1 7.36 0.015 . 1 . . . . A 19 A H2 . 30730 1 323 . 1 . 1 19 19 A H2' H 1 4.36 0.015 . 1 . . . . A 19 A H2' . 30730 1 324 . 1 . 1 19 19 A H3' H 1 4.56 0.015 . 1 . . . . A 19 A H3' . 30730 1 325 . 1 . 1 19 19 A H4' H 1 4.39 0.015 . 1 . . . . A 19 A H4' . 30730 1 326 . 1 . 1 19 19 A H5' H 1 4.49 0.015 . 2 . . . . A 19 A H5' . 30730 1 327 . 1 . 1 19 19 A H5'' H 1 4.06 0.015 . 2 . . . . A 19 A H5'' . 30730 1 328 . 1 . 1 19 19 A H8 H 1 7.91 0.015 . 1 . . . . A 19 A H8 . 30730 1 329 . 1 . 1 19 19 A C1' C 13 92.16 0.075 . 1 . . . . A 19 A C1' . 30730 1 330 . 1 . 1 19 19 A C2 C 13 153.65 0.075 . 1 . . . . A 19 A C2 . 30730 1 331 . 1 . 1 19 19 A C2' C 13 74.98 0.075 . 1 . . . . A 19 A C2' . 30730 1 332 . 1 . 1 19 19 A C3' C 13 71.94 0.075 . 1 . . . . A 19 A C3' . 30730 1 333 . 1 . 1 19 19 A C4' C 13 81.25 0.075 . 1 . . . . A 19 A C4' . 30730 1 334 . 1 . 1 19 19 A C5' C 13 64.06 0.075 . 1 . . . . A 19 A C5' . 30730 1 335 . 1 . 1 19 19 A C8 C 13 139.83 0.075 . 1 . . . . A 19 A C8 . 30730 1 336 . 1 . 1 19 19 A N1 N 15 223.83 0.055 . 1 . . . . A 19 A N1 . 30730 1 337 . 1 . 1 19 19 A N3 N 15 214.37 0.055 . 1 . . . . A 19 A N3 . 30730 1 338 . 1 . 1 19 19 A N7 N 15 231.81 0.055 . 1 . . . . A 19 A N7 . 30730 1 339 . 1 . 1 19 19 A N9 N 15 171.55 0.055 . 1 . . . . A 19 A N9 . 30730 1 340 . 1 . 1 20 20 U H1' H 1 5.41 0.015 . 1 . . . . A 20 U H1' . 30730 1 341 . 1 . 1 20 20 U H2' H 1 4.21 0.015 . 1 . . . . A 20 U H2' . 30730 1 342 . 1 . 1 20 20 U H3' H 1 4.40 0.015 . 1 . . . . A 20 U H3' . 30730 1 343 . 1 . 1 20 20 U H4' H 1 4.28 0.015 . 1 . . . . A 20 U H4' . 30730 1 344 . 1 . 1 20 20 U H5 H 1 5.16 0.015 . 1 . . . . A 20 U H5 . 30730 1 345 . 1 . 1 20 20 U H5' H 1 4.37 0.015 . 2 . . . . A 20 U H5' . 30730 1 346 . 1 . 1 20 20 U H5'' H 1 3.99 0.015 . 2 . . . . A 20 U H5'' . 30730 1 347 . 1 . 1 20 20 U H6 H 1 7.44 0.015 . 1 . . . . A 20 U H6 . 30730 1 348 . 1 . 1 20 20 U C1' C 13 91.64 0.075 . 1 . . . . A 20 U C1' . 30730 1 349 . 1 . 1 20 20 U C2 C 13 153.36 0.075 . 1 . . . . A 20 U C2 . 30730 1 350 . 1 . 1 20 20 U C2' C 13 74.91 0.075 . 1 . . . . A 20 U C2' . 30730 1 351 . 1 . 1 20 20 U C3' C 13 72.60 0.075 . 1 . . . . A 20 U C3' . 30730 1 352 . 1 . 1 20 20 U C4' C 13 81.05 0.075 . 1 . . . . A 20 U C4' . 30730 1 353 . 1 . 1 20 20 U C5 C 13 102.97 0.075 . 1 . . . . A 20 U C5 . 30730 1 354 . 1 . 1 20 20 U C5' C 13 64.35 0.075 . 1 . . . . A 20 U C5' . 30730 1 355 . 1 . 1 20 20 U C6 C 13 141.46 0.075 . 1 . . . . A 20 U C6 . 30730 1 356 . 1 . 1 21 21 A H1' H 1 5.71 0.015 . 1 . . . . A 21 A H1' . 30730 1 357 . 1 . 1 21 21 A H2 H 1 7.37 0.015 . 1 . . . . A 21 A H2 . 30730 1 358 . 1 . 1 21 21 A H2' H 1 4.47 0.015 . 1 . . . . A 21 A H2' . 30730 1 359 . 1 . 1 21 21 A H3' H 1 4.26 0.015 . 1 . . . . A 21 A H3' . 30730 1 360 . 1 . 1 21 21 A H4' H 1 4.46 0.015 . 1 . . . . A 21 A H4' . 30730 1 361 . 1 . 1 21 21 A H5' H 1 4.28 0.015 . 2 . . . . A 21 A H5' . 30730 1 362 . 1 . 1 21 21 A H5'' H 1 4.05 0.015 . 2 . . . . A 21 A H5'' . 30730 1 363 . 1 . 1 21 21 A H8 H 1 7.92 0.015 . 1 . . . . A 21 A H8 . 30730 1 364 . 1 . 1 21 21 A C1' C 13 91.51 0.075 . 1 . . . . A 21 A C1' . 30730 1 365 . 1 . 1 21 21 A C2 C 13 154.06 0.075 . 1 . . . . A 21 A C2 . 30730 1 366 . 1 . 1 21 21 A C2' C 13 74.58 0.075 . 1 . . . . A 21 A C2' . 30730 1 367 . 1 . 1 21 21 A C3' C 13 73.66 0.075 . 1 . . . . A 21 A C3' . 30730 1 368 . 1 . 1 21 21 A C4' C 13 83.02 0.075 . 1 . . . . A 21 A C4' . 30730 1 369 . 1 . 1 21 21 A C5' C 13 66.18 0.075 . 1 . . . . A 21 A C5' . 30730 1 370 . 1 . 1 21 21 A C8 C 13 140.79 0.075 . 1 . . . . A 21 A C8 . 30730 1 371 . 1 . 1 21 21 A N1 N 15 226.24 0.055 . 1 . . . . A 21 A N1 . 30730 1 372 . 1 . 1 21 21 A N3 N 15 216.30 0.055 . 1 . . . . A 21 A N3 . 30730 1 373 . 1 . 1 21 21 A N7 N 15 231.89 0.055 . 1 . . . . A 21 A N7 . 30730 1 374 . 1 . 1 21 21 A N9 N 15 169.69 0.055 . 1 . . . . A 21 A N9 . 30730 1 375 . 1 . 1 22 22 U H1' H 1 5.07 0.015 . 1 . . . . A 22 U H1' . 30730 1 376 . 1 . 1 22 22 U H2' H 1 4.13 0.015 . 1 . . . . A 22 U H2' . 30730 1 377 . 1 . 1 22 22 U H3 H 1 10.33 0.015 . 1 . . . . A 22 U H3 . 30730 1 378 . 1 . 1 22 22 U H3' H 1 4.22 0.015 . 1 . . . . A 22 U H3' . 30730 1 379 . 1 . 1 22 22 U H4' H 1 4.29 0.015 . 1 . . . . A 22 U H4' . 30730 1 380 . 1 . 1 22 22 U H5 H 1 5.12 0.015 . 1 . . . . A 22 U H5 . 30730 1 381 . 1 . 1 22 22 U H5' H 1 4.28 0.015 . 2 . . . . A 22 U H5' . 30730 1 382 . 1 . 1 22 22 U H5'' H 1 4.00 0.015 . 2 . . . . A 22 U H5'' . 30730 1 383 . 1 . 1 22 22 U H6 H 1 7.37 0.015 . 1 . . . . A 22 U H6 . 30730 1 384 . 1 . 1 22 22 U C1' C 13 92.68 0.075 . 1 . . . . A 22 U C1' . 30730 1 385 . 1 . 1 22 22 U C2 C 13 152.25 0.075 . 1 . . . . A 22 U C2 . 30730 1 386 . 1 . 1 22 22 U C2' C 13 74.00 0.075 . 1 . . . . A 22 U C2' . 30730 1 387 . 1 . 1 22 22 U C3' C 13 71.94 0.075 . 1 . . . . A 22 U C3' . 30730 1 388 . 1 . 1 22 22 U C4 C 13 168.23 0.075 . 1 . . . . A 22 U C4 . 30730 1 389 . 1 . 1 22 22 U C4' C 13 81.01 0.075 . 1 . . . . A 22 U C4' . 30730 1 390 . 1 . 1 22 22 U C5 C 13 102.57 0.075 . 1 . . . . A 22 U C5 . 30730 1 391 . 1 . 1 22 22 U C5' C 13 64.27 0.075 . 1 . . . . A 22 U C5' . 30730 1 392 . 1 . 1 22 22 U C6 C 13 142.33 0.075 . 1 . . . . A 22 U C6 . 30730 1 393 . 1 . 1 22 22 U N3 N 15 156.71 0.055 . 1 . . . . A 22 U N3 . 30730 1 394 . 1 . 1 23 23 C H1' H 1 5.49 0.015 . 1 . . . . A 23 C H1' . 30730 1 395 . 1 . 1 23 23 C H2' H 1 4.41 0.015 . 1 . . . . A 23 C H2' . 30730 1 396 . 1 . 1 23 23 C H3' H 1 4.50 0.015 . 1 . . . . A 23 C H3' . 30730 1 397 . 1 . 1 23 23 C H4' H 1 4.26 0.015 . 1 . . . . A 23 C H4' . 30730 1 398 . 1 . 1 23 23 C H5 H 1 5.68 0.015 . 1 . . . . A 23 C H5 . 30730 1 399 . 1 . 1 23 23 C H5' H 1 4.34 0.015 . 2 . . . . A 23 C H5' . 30730 1 400 . 1 . 1 23 23 C H5'' H 1 4.03 0.015 . 2 . . . . A 23 C H5'' . 30730 1 401 . 1 . 1 23 23 C H6 H 1 7.85 0.015 . 1 . . . . A 23 C H6 . 30730 1 402 . 1 . 1 23 23 C H41 H 1 6.90 0.015 . 2 . . . . A 23 C H41 . 30730 1 403 . 1 . 1 23 23 C H42 H 1 8.19 0.015 . 2 . . . . A 23 C H42 . 30730 1 404 . 1 . 1 23 23 C C1' C 13 92.03 0.075 . 1 . . . . A 23 C C1' . 30730 1 405 . 1 . 1 23 23 C C2 C 13 159.35 0.075 . 1 . . . . A 23 C C2 . 30730 1 406 . 1 . 1 23 23 C C2' C 13 74.71 0.075 . 1 . . . . A 23 C C2' . 30730 1 407 . 1 . 1 23 23 C C3' C 13 72.33 0.075 . 1 . . . . A 23 C C3' . 30730 1 408 . 1 . 1 23 23 C C4' C 13 81.97 0.075 . 1 . . . . A 23 C C4' . 30730 1 409 . 1 . 1 23 23 C C5 C 13 97.47 0.075 . 1 . . . . A 23 C C5 . 30730 1 410 . 1 . 1 23 23 C C5' C 13 64.22 0.075 . 1 . . . . A 23 C C5' . 30730 1 411 . 1 . 1 23 23 C C6 C 13 142.19 0.075 . 1 . . . . A 23 C C6 . 30730 1 412 . 1 . 1 23 23 C N4 N 15 97.81 0.055 . 1 . . . . A 23 C N4 . 30730 1 413 . 1 . 1 24 24 A H1' H 1 5.83 0.015 . 1 . . . . A 24 A H1' . 30730 1 414 . 1 . 1 24 24 A H2 H 1 6.99 0.015 . 1 . . . . A 24 A H2 . 30730 1 415 . 1 . 1 24 24 A H2' H 1 4.61 0.015 . 1 . . . . A 24 A H2' . 30730 1 416 . 1 . 1 24 24 A H3' H 1 4.58 0.015 . 1 . . . . A 24 A H3' . 30730 1 417 . 1 . 1 24 24 A H4' H 1 4.47 0.015 . 1 . . . . A 24 A H4' . 30730 1 418 . 1 . 1 24 24 A H5' H 1 4.45 0.015 . 2 . . . . A 24 A H5' . 30730 1 419 . 1 . 1 24 24 A H5'' H 1 4.12 0.015 . 2 . . . . A 24 A H5'' . 30730 1 420 . 1 . 1 24 24 A H8 H 1 7.98 0.015 . 1 . . . . A 24 A H8 . 30730 1 421 . 1 . 1 24 24 A C1' C 13 92.16 0.075 . 1 . . . . A 24 A C1' . 30730 1 422 . 1 . 1 24 24 A C2 C 13 152.93 0.075 . 1 . . . . A 24 A C2 . 30730 1 423 . 1 . 1 24 24 A C2' C 13 74.68 0.075 . 1 . . . . A 24 A C2' . 30730 1 424 . 1 . 1 24 24 A C3' C 13 72.80 0.075 . 1 . . . . A 24 A C3' . 30730 1 425 . 1 . 1 24 24 A C4' C 13 81.57 0.075 . 1 . . . . A 24 A C4' . 30730 1 426 . 1 . 1 24 24 A C5' C 13 65.43 0.075 . 1 . . . . A 24 A C5' . 30730 1 427 . 1 . 1 24 24 A C8 C 13 140.06 0.075 . 1 . . . . A 24 A C8 . 30730 1 428 . 1 . 1 24 24 A N1 N 15 220.75 0.055 . 1 . . . . A 24 A N1 . 30730 1 429 . 1 . 1 24 24 A N3 N 15 213.85 0.055 . 1 . . . . A 24 A N3 . 30730 1 430 . 1 . 1 24 24 A N7 N 15 231.22 0.055 . 1 . . . . A 24 A N7 . 30730 1 431 . 1 . 1 24 24 A N9 N 15 170.80 0.055 . 1 . . . . A 24 A N9 . 30730 1 432 . 1 . 1 25 25 G H1 H 1 13.37 0.015 . 1 . . . . A 25 G H1 . 30730 1 433 . 1 . 1 25 25 G H1' H 1 5.59 0.015 . 1 . . . . A 25 G H1' . 30730 1 434 . 1 . 1 25 25 G H2' H 1 4.32 0.015 . 1 . . . . A 25 G H2' . 30730 1 435 . 1 . 1 25 25 G H3' H 1 4.40 0.015 . 1 . . . . A 25 G H3' . 30730 1 436 . 1 . 1 25 25 G H4' H 1 4.38 0.015 . 1 . . . . A 25 G H4' . 30730 1 437 . 1 . 1 25 25 G H5' H 1 4.42 0.015 . 2 . . . . A 25 G H5' . 30730 1 438 . 1 . 1 25 25 G H5'' H 1 4.01 0.015 . 2 . . . . A 25 G H5'' . 30730 1 439 . 1 . 1 25 25 G H8 H 1 7.27 0.015 . 1 . . . . A 25 G H8 . 30730 1 440 . 1 . 1 25 25 G C1' C 13 91.77 0.075 . 1 . . . . A 25 G C1' . 30730 1 441 . 1 . 1 25 25 G C2 C 13 157.27 0.075 . 1 . . . . A 25 G C2 . 30730 1 442 . 1 . 1 25 25 G C2' C 13 74.45 0.075 . 1 . . . . A 25 G C2' . 30730 1 443 . 1 . 1 25 25 G C3' C 13 71.82 0.075 . 1 . . . . A 25 G C3' . 30730 1 444 . 1 . 1 25 25 G C4' C 13 81.11 0.075 . 1 . . . . A 25 G C4' . 30730 1 445 . 1 . 1 25 25 G C5' C 13 64.52 0.075 . 1 . . . . A 25 G C5' . 30730 1 446 . 1 . 1 25 25 G C6 C 13 161.67 0.075 . 1 . . . . A 25 G C6 . 30730 1 447 . 1 . 1 25 25 G C8 C 13 136.03 0.075 . 1 . . . . A 25 G C8 . 30730 1 448 . 1 . 1 25 25 G N1 N 15 148.51 0.055 . 1 . . . . A 25 G N1 . 30730 1 449 . 1 . 1 25 25 G N7 N 15 234.63 0.055 . 1 . . . . A 25 G N7 . 30730 1 450 . 1 . 1 25 25 G N9 N 15 169.76 0.055 . 1 . . . . A 25 G N9 . 30730 1 451 . 1 . 1 26 26 C H1' H 1 5.40 0.015 . 1 . . . . A 26 C H1' . 30730 1 452 . 1 . 1 26 26 C H2' H 1 4.26 0.015 . 1 . . . . A 26 C H2' . 30730 1 453 . 1 . 1 26 26 C H3' H 1 4.42 0.015 . 1 . . . . A 26 C H3' . 30730 1 454 . 1 . 1 26 26 C H4' H 1 4.31 0.015 . 1 . . . . A 26 C H4' . 30730 1 455 . 1 . 1 26 26 C H5 H 1 5.08 0.015 . 1 . . . . A 26 C H5 . 30730 1 456 . 1 . 1 26 26 C H5' H 1 4.46 0.015 . 2 . . . . A 26 C H5' . 30730 1 457 . 1 . 1 26 26 C H5'' H 1 3.98 0.015 . 2 . . . . A 26 C H5'' . 30730 1 458 . 1 . 1 26 26 C H6 H 1 7.55 0.015 . 1 . . . . A 26 C H6 . 30730 1 459 . 1 . 1 26 26 C H41 H 1 6.76 0.015 . 2 . . . . A 26 C H41 . 30730 1 460 . 1 . 1 26 26 C H42 H 1 8.42 0.015 . 2 . . . . A 26 C H42 . 30730 1 461 . 1 . 1 26 26 C C1' C 13 93.13 0.075 . 1 . . . . A 26 C C1' . 30730 1 462 . 1 . 1 26 26 C C2 C 13 159.11 0.075 . 1 . . . . A 26 C C2 . 30730 1 463 . 1 . 1 26 26 C C2' C 13 74.65 0.075 . 1 . . . . A 26 C C2' . 30730 1 464 . 1 . 1 26 26 C C3' C 13 72.47 0.075 . 1 . . . . A 26 C C3' . 30730 1 465 . 1 . 1 26 26 C C4' C 13 81.71 0.075 . 1 . . . . A 26 C C4' . 30730 1 466 . 1 . 1 26 26 C C5 C 13 96.24 0.075 . 1 . . . . A 26 C C5 . 30730 1 467 . 1 . 1 26 26 C C5' C 13 64.72 0.075 . 1 . . . . A 26 C C5' . 30730 1 468 . 1 . 1 26 26 C C6 C 13 141.19 0.075 . 1 . . . . A 26 C C6 . 30730 1 469 . 1 . 1 26 26 C N4 N 15 98.49 0.055 . 1 . . . . A 26 C N4 . 30730 1 470 . 1 . 1 27 27 C H1' H 1 5.43 0.015 . 1 . . . . A 27 C H1' . 30730 1 471 . 1 . 1 27 27 C H2' H 1 4.34 0.015 . 1 . . . . A 27 C H2' . 30730 1 472 . 1 . 1 27 27 C H4' H 1 4.39 0.015 . 1 . . . . A 27 C H4' . 30730 1 473 . 1 . 1 27 27 C H5 H 1 5.40 0.015 . 1 . . . . A 27 C H5 . 30730 1 474 . 1 . 1 27 27 C H5' H 1 4.37 0.015 . 2 . . . . A 27 C H5' . 30730 1 475 . 1 . 1 27 27 C H5'' H 1 3.97 0.015 . 2 . . . . A 27 C H5'' . 30730 1 476 . 1 . 1 27 27 C H6 H 1 7.70 0.015 . 1 . . . . A 27 C H6 . 30730 1 477 . 1 . 1 27 27 C H41 H 1 6.76 0.015 . 2 . . . . A 27 C H41 . 30730 1 478 . 1 . 1 27 27 C H42 H 1 8.45 0.015 . 2 . . . . A 27 C H42 . 30730 1 479 . 1 . 1 27 27 C C1' C 13 93.22 0.075 . 1 . . . . A 27 C C1' . 30730 1 480 . 1 . 1 27 27 C C2 C 13 159.29 0.075 . 1 . . . . A 27 C C2 . 30730 1 481 . 1 . 1 27 27 C C2' C 13 74.71 0.075 . 1 . . . . A 27 C C2' . 30730 1 482 . 1 . 1 27 27 C C4' C 13 81.01 0.075 . 1 . . . . A 27 C C4' . 30730 1 483 . 1 . 1 27 27 C C5 C 13 96.95 0.075 . 1 . . . . A 27 C C5 . 30730 1 484 . 1 . 1 27 27 C C5' C 13 63.61 0.075 . 1 . . . . A 27 C C5' . 30730 1 485 . 1 . 1 27 27 C C6 C 13 141.65 0.075 . 1 . . . . A 27 C C6 . 30730 1 486 . 1 . 1 27 27 C N4 N 15 98.29 0.055 . 1 . . . . A 27 C N4 . 30730 1 487 . 1 . 1 28 28 C H1' H 1 5.67 0.015 . 1 . . . . A 28 C H1' . 30730 1 488 . 1 . 1 28 28 C H2' H 1 3.92 0.015 . 1 . . . . A 28 C H2' . 30730 1 489 . 1 . 1 28 28 C H3' H 1 4.12 0.015 . 1 . . . . A 28 C H3' . 30730 1 490 . 1 . 1 28 28 C H4' H 1 4.09 0.015 . 1 . . . . A 28 C H4' . 30730 1 491 . 1 . 1 28 28 C H5 H 1 5.43 0.015 . 1 . . . . A 28 C H5 . 30730 1 492 . 1 . 1 28 28 C H5' H 1 4.40 0.015 . 2 . . . . A 28 C H5' . 30730 1 493 . 1 . 1 28 28 C H5'' H 1 3.94 0.015 . 2 . . . . A 28 C H5'' . 30730 1 494 . 1 . 1 28 28 C H6 H 1 7.61 0.015 . 1 . . . . A 28 C H6 . 30730 1 495 . 1 . 1 28 28 C H41 H 1 7.01 0.015 . 2 . . . . A 28 C H41 . 30730 1 496 . 1 . 1 28 28 C H42 H 1 8.17 0.015 . 2 . . . . A 28 C H42 . 30730 1 497 . 1 . 1 28 28 C C1' C 13 91.90 0.075 . 1 . . . . A 28 C C1' . 30730 1 498 . 1 . 1 28 28 C C2 C 13 160.22 0.075 . 1 . . . . A 28 C C2 . 30730 1 499 . 1 . 1 28 28 C C2' C 13 76.70 0.075 . 1 . . . . A 28 C C2' . 30730 1 500 . 1 . 1 28 28 C C3' C 13 68.84 0.075 . 1 . . . . A 28 C C3' . 30730 1 501 . 1 . 1 28 28 C C4' C 13 82.63 0.075 . 1 . . . . A 28 C C4' . 30730 1 502 . 1 . 1 28 28 C C5 C 13 97.28 0.075 . 1 . . . . A 28 C C5 . 30730 1 503 . 1 . 1 28 28 C C5' C 13 64.35 0.075 . 1 . . . . A 28 C C5' . 30730 1 504 . 1 . 1 28 28 C C6 C 13 142.10 0.075 . 1 . . . . A 28 C C6 . 30730 1 505 . 1 . 1 28 28 C N4 N 15 96.92 0.055 . 1 . . . . A 28 C N4 . 30730 1 stop_ save_