################################### # 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 18532 _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 '2D 1H-13C HSQC' . . . 18532 1 2 '3D 1H-13C NOESY' . . . 18532 1 3 '2D 1H-15N HSQC' . . . 18532 1 9 '2D 1H-31P HetCor' . . . 18532 1 12 '2D 1H-13C CCH-COSY' . . . 18532 1 13 '2D 1H-13C HCNC' . . . 18532 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 G H1' H 1 5.81 0.03 . 1 . . . A 1 G H1' . 18532 1 2 . 1 1 1 1 G H2' H 1 4.87 0.03 . 1 . . . A 1 G H2' . 18532 1 3 . 1 1 1 1 G H3' H 1 4.56 0.03 . 1 . . . A 1 G H3' . 18532 1 4 . 1 1 1 1 G H4' H 1 4.36 0.03 . 1 . . . A 1 G H4' . 18532 1 5 . 1 1 1 1 G H5' H 1 4.02 0.03 . 1 . . . A 1 G H5' . 18532 1 6 . 1 1 1 1 G H5'' H 1 3.90 0.03 . 1 . . . A 1 G H5'' . 18532 1 7 . 1 1 1 1 G H8 H 1 8.05 0.03 . 1 . . . A 1 G H8 . 18532 1 8 . 1 1 1 1 G C2' C 13 74.11 0.03 . 1 . . . A 1 G C2' . 18532 1 9 . 1 1 1 1 G C8 C 13 138.97 0.03 . 1 . . . A 1 G C8 . 18532 1 10 . 1 1 2 2 G H1 H 1 12.78 0.03 . 1 . . . A 2 G H1 . 18532 1 11 . 1 1 2 2 G H1' H 1 5.89 0.03 . 1 . . . A 2 G H1' . 18532 1 12 . 1 1 2 2 G H2' H 1 4.78 0.03 . 1 . . . A 2 G H2' . 18532 1 13 . 1 1 2 2 G H3' H 1 4.47 0.03 . 1 . . . A 2 G H3' . 18532 1 14 . 1 1 2 2 G H4' H 1 4.52 0.03 . 1 . . . A 2 G H4' . 18532 1 15 . 1 1 2 2 G H5' H 1 4.42 0.03 . 1 . . . A 2 G H5' . 18532 1 16 . 1 1 2 2 G H5'' H 1 4.17 0.03 . 1 . . . A 2 G H5'' . 18532 1 17 . 1 1 2 2 G H8 H 1 7.50 0.03 . 1 . . . A 2 G H8 . 18532 1 18 . 1 1 2 2 G C1' C 13 92.12 0.03 . 1 . . . A 2 G C1' . 18532 1 19 . 1 1 2 2 G C2' C 13 74.74 0.03 . 1 . . . A 2 G C2' . 18532 1 20 . 1 1 2 2 G C3' C 13 73.08 0.03 . 1 . . . A 2 G C3' . 18532 1 21 . 1 1 2 2 G C4' C 13 81.78 0.03 . 1 . . . A 2 G C4' . 18532 1 22 . 1 1 2 2 G C5' C 13 65.79 0.03 . 1 . . . A 2 G C5' . 18532 1 23 . 1 1 2 2 G C8 C 13 136.91 0.03 . 1 . . . A 2 G C8 . 18532 1 24 . 1 1 2 2 G N1 N 15 148.23 0.06 . 1 . . . A 2 G N1 . 18532 1 25 . 1 1 2 2 G N9 N 15 169.52 0.06 . 1 . . . A 2 G N9 . 18532 1 26 . 1 1 3 3 G H1 H 1 13.17 0.03 . 1 . . . A 3 G H1 . 18532 1 27 . 1 1 3 3 G H1' H 1 5.72 0.03 . 1 . . . A 3 G H1' . 18532 1 28 . 1 1 3 3 G H2' H 1 4.48 0.03 . 1 . . . A 3 G H2' . 18532 1 29 . 1 1 3 3 G H3' H 1 4.44 0.03 . 1 . . . A 3 G H3' . 18532 1 30 . 1 1 3 3 G H4' H 1 4.43 0.03 . 1 . . . A 3 G H4' . 18532 1 31 . 1 1 3 3 G H5' H 1 4.49 0.03 . 1 . . . A 3 G H5' . 18532 1 32 . 1 1 3 3 G H5'' H 1 4.04 0.03 . 1 . . . A 3 G H5'' . 18532 1 33 . 1 1 3 3 G H8 H 1 7.15 0.03 . 1 . . . A 3 G H8 . 18532 1 34 . 1 1 3 3 G C1' C 13 92.53 0.03 . 1 . . . A 3 G C1' . 18532 1 35 . 1 1 3 3 G C2' C 13 74.59 0.03 . 1 . . . A 3 G C2' . 18532 1 36 . 1 1 3 3 G C3' C 13 72.36 0.03 . 1 . . . A 3 G C3' . 18532 1 37 . 1 1 3 3 G C4' C 13 81.51 0.03 . 1 . . . A 3 G C4' . 18532 1 38 . 1 1 3 3 G C5' C 13 64.33 0.03 . 1 . . . A 3 G C5' . 18532 1 39 . 1 1 3 3 G C8 C 13 136.12 0.03 . 1 . . . A 3 G C8 . 18532 1 40 . 1 1 3 3 G N7 N 15 234.08 0.06 . 1 . . . A 3 G N7 . 18532 1 41 . 1 1 3 3 G N9 N 15 168.78 0.06 . 1 . . . A 3 G N9 . 18532 1 42 . 1 1 4 4 C H1' H 1 5.40 0.03 . 1 . . . A 4 C H1' . 18532 1 43 . 1 1 4 4 C H2' H 1 4.37 0.03 . 1 . . . A 4 C H2' . 18532 1 44 . 1 1 4 4 C H3' H 1 4.48 0.03 . 1 . . . A 4 C H3' . 18532 1 45 . 1 1 4 4 C H4' H 1 4.34 0.03 . 1 . . . A 4 C H4' . 18532 1 46 . 1 1 4 4 C H5 H 1 5.14 0.03 . 1 . . . A 4 C H5 . 18532 1 47 . 1 1 4 4 C H5' H 1 4.49 0.03 . 1 . . . A 4 C H5' . 18532 1 48 . 1 1 4 4 C H5'' H 1 4.04 0.03 . 1 . . . A 4 C H5'' . 18532 1 49 . 1 1 4 4 C H6 H 1 7.44 0.03 . 1 . . . A 4 C H6 . 18532 1 50 . 1 1 4 4 C C1' C 13 93.39 0.03 . 1 . . . A 4 C C1' . 18532 1 51 . 1 1 4 4 C C2 C 13 159.54 0.03 . 1 . . . A 4 C C2 . 18532 1 52 . 1 1 4 4 C C2' C 13 74.90 0.03 . 1 . . . A 4 C C2' . 18532 1 53 . 1 1 4 4 C C3' C 13 72.27 0.03 . 1 . . . A 4 C C3' . 18532 1 54 . 1 1 4 4 C C4 C 13 169.19 0.03 . 1 . . . A 4 C C4 . 18532 1 55 . 1 1 4 4 C C4' C 13 81.42 0.03 . 1 . . . A 4 C C4' . 18532 1 56 . 1 1 4 4 C C5 C 13 96.96 0.03 . 1 . . . A 4 C C5 . 18532 1 57 . 1 1 4 4 C C5' C 13 63.82 0.03 . 1 . . . A 4 C C5' . 18532 1 58 . 1 1 4 4 C C6 C 13 140.81 0.03 . 1 . . . A 4 C C6 . 18532 1 59 . 1 1 4 4 C N4 N 15 97.75 0.06 . 1 . . . A 4 C N4 . 18532 1 60 . 1 1 5 5 A H1' H 1 5.99 0.03 . 1 . . . A 5 A H1' . 18532 1 61 . 1 1 5 5 A H2 H 1 7.82 0.03 . 1 . . . A 5 A H2 . 18532 1 62 . 1 1 5 5 A H2' H 1 4.64 0.03 . 1 . . . A 5 A H2' . 18532 1 63 . 1 1 5 5 A H3' H 1 4.60 0.03 . 1 . . . A 5 A H3' . 18532 1 64 . 1 1 5 5 A H4' H 1 4.44 0.03 . 1 . . . A 5 A H4' . 18532 1 65 . 1 1 5 5 A H5' H 1 4.45 0.03 . 1 . . . A 5 A H5' . 18532 1 66 . 1 1 5 5 A H5'' H 1 4.13 0.03 . 1 . . . A 5 A H5'' . 18532 1 67 . 1 1 5 5 A H8 H 1 8.10 0.03 . 1 . . . A 5 A H8 . 18532 1 68 . 1 1 5 5 A C1' C 13 91.29 0.03 . 1 . . . A 5 A C1' . 18532 1 69 . 1 1 5 5 A C2' C 13 75.71 0.03 . 1 . . . A 5 A C2' . 18532 1 70 . 1 1 5 5 A C3' C 13 73.70 0.03 . 1 . . . A 5 A C3' . 18532 1 71 . 1 1 5 5 A C4' C 13 81.69 0.03 . 1 . . . A 5 A C4' . 18532 1 72 . 1 1 5 5 A C5' C 13 65.07 0.03 . 1 . . . A 5 A C5' . 18532 1 73 . 1 1 5 5 A C8 C 13 139.81 0.03 . 1 . . . A 5 A C8 . 18532 1 74 . 1 1 5 5 A N1 N 15 229.26 0.06 . 1 . . . A 5 A N1 . 18532 1 75 . 1 1 5 5 A N3 N 15 214.81 0.06 . 1 . . . A 5 A N3 . 18532 1 76 . 1 1 5 5 A N6 N 15 82.33 0.06 . 1 . . . A 5 A N6 . 18532 1 77 . 1 1 5 5 A N7 N 15 230.52 0.06 . 1 . . . A 5 A N7 . 18532 1 78 . 1 1 5 5 A N9 N 15 169.75 0.06 . 1 . . . A 5 A N9 . 18532 1 79 . 1 1 6 6 G H1' H 1 5.39 0.03 . 1 . . . A 6 G H1' . 18532 1 80 . 1 1 6 6 G H2' H 1 4.53 0.03 . 1 . . . A 6 G H2' . 18532 1 81 . 1 1 6 6 G H3' H 1 4.52 0.03 . 1 . . . A 6 G H3' . 18532 1 82 . 1 1 6 6 G H4' H 1 4.39 0.03 . 1 . . . A 6 G H4' . 18532 1 83 . 1 1 6 6 G H5' H 1 4.24 0.03 . 1 . . . A 6 G H5' . 18532 1 84 . 1 1 6 6 G H5'' H 1 3.96 0.03 . 1 . . . A 6 G H5'' . 18532 1 85 . 1 1 6 6 G H8 H 1 6.96 0.03 . 1 . . . A 6 G H8 . 18532 1 86 . 1 1 6 6 G C1' C 13 92.43 0.03 . 1 . . . A 6 G C1' . 18532 1 87 . 1 1 6 6 G C2' C 13 74.52 0.03 . 1 . . . A 6 G C2' . 18532 1 88 . 1 1 6 6 G C3' C 13 74.06 0.03 . 1 . . . A 6 G C3' . 18532 1 89 . 1 1 6 6 G C4' C 13 82.14 0.03 . 1 . . . A 6 G C4' . 18532 1 90 . 1 1 6 6 G C5' C 13 67.31 0.03 . 1 . . . A 6 G C5' . 18532 1 91 . 1 1 6 6 G C8 C 13 136.52 0.03 . 1 . . . A 6 G C8 . 18532 1 92 . 1 1 6 6 G N7 N 15 235.42 0.06 . 1 . . . A 6 G N7 . 18532 1 93 . 1 1 6 6 G N9 N 15 168.34 0.06 . 1 . . . A 6 G N9 . 18532 1 94 . 1 1 7 7 U H1' H 1 5.38 0.03 . 1 . . . A 7 U H1' . 18532 1 95 . 1 1 7 7 U H2' H 1 4.06 0.03 . 1 . . . A 7 U H2' . 18532 1 96 . 1 1 7 7 U H3 H 1 11.08 0.03 . 1 . . . A 7 U H3 . 18532 1 97 . 1 1 7 7 U H3' H 1 4.39 0.03 . 1 . . . A 7 U H3' . 18532 1 98 . 1 1 7 7 U H4' H 1 4.23 0.03 . 1 . . . A 7 U H4' . 18532 1 99 . 1 1 7 7 U H5 H 1 5.07 0.03 . 1 . . . A 7 U H5 . 18532 1 100 . 1 1 7 7 U H5' H 1 4.27 0.03 . 1 . . . A 7 U H5' . 18532 1 101 . 1 1 7 7 U H5'' H 1 4.00 0.03 . 1 . . . A 7 U H5'' . 18532 1 102 . 1 1 7 7 U H6 H 1 7.40 0.03 . 1 . . . A 7 U H6 . 18532 1 103 . 1 1 7 7 U C1' C 13 92.79 0.03 . 1 . . . A 7 U C1' . 18532 1 104 . 1 1 7 7 U C2 C 13 154.73 0.03 . 1 . . . A 7 U C2 . 18532 1 105 . 1 1 7 7 U C2' C 13 75.11 0.03 . 1 . . . A 7 U C2' . 18532 1 106 . 1 1 7 7 U C3' C 13 72.63 0.03 . 1 . . . A 7 U C3' . 18532 1 107 . 1 1 7 7 U C4 C 13 167.31 0.03 . 1 . . . A 7 U C4 . 18532 1 108 . 1 1 7 7 U C4' C 13 82.49 0.03 . 1 . . . A 7 U C4' . 18532 1 109 . 1 1 7 7 U C5' C 13 64.18 0.03 . 1 . . . A 7 U C5' . 18532 1 110 . 1 1 7 7 U N1 N 15 145.07 0.06 . 1 . . . A 7 U N1 . 18532 1 111 . 1 1 7 7 U N3 N 15 158.44 0.06 . 1 . . . A 7 U N3 . 18532 1 112 . 1 1 8 8 G H1' H 1 5.56 0.03 . 1 . . . A 8 G H1' . 18532 1 113 . 1 1 8 8 G H2' H 1 4.66 0.03 . 1 . . . A 8 G H2' . 18532 1 114 . 1 1 8 8 G H3' H 1 4.71 0.03 . 1 . . . A 8 G H3' . 18532 1 115 . 1 1 8 8 G H4' H 1 4.48 0.03 . 1 . . . A 8 G H4' . 18532 1 116 . 1 1 8 8 G H5' H 1 4.20 0.03 . 1 . . . A 8 G H5' . 18532 1 117 . 1 1 8 8 G H5'' H 1 4.09 0.03 . 1 . . . A 8 G H5'' . 18532 1 118 . 1 1 8 8 G H8 H 1 7.82 0.03 . 1 . . . A 8 G H8 . 18532 1 119 . 1 1 8 8 G C1' C 13 88.70 0.03 . 1 . . . A 8 G C1' . 18532 1 120 . 1 1 8 8 G C2 C 13 154.36 0.03 . 1 . . . A 8 G C2 . 18532 1 121 . 1 1 8 8 G C2' C 13 74.51 0.03 . 1 . . . A 8 G C2' . 18532 1 122 . 1 1 8 8 G C3' C 13 76.83 0.03 . 1 . . . A 8 G C3' . 18532 1 123 . 1 1 8 8 G C4' C 13 84.46 0.03 . 1 . . . A 8 G C4' . 18532 1 124 . 1 1 8 8 G C5' C 13 66.68 0.03 . 1 . . . A 8 G C5' . 18532 1 125 . 1 1 8 8 G C8 C 13 139.62 0.03 . 1 . . . A 8 G C8 . 18532 1 126 . 1 1 8 8 G N7 N 15 236.76 0.06 . 1 . . . A 8 G N7 . 18532 1 127 . 1 1 8 8 G N9 N 15 166.93 0.06 . 1 . . . A 8 G N9 . 18532 1 128 . 1 1 9 9 A H1' H 1 5.78 0.03 . 1 . . . A 9 A H1' . 18532 1 129 . 1 1 9 9 A H2 H 1 7.69 0.03 . 1 . . . A 9 A H2 . 18532 1 130 . 1 1 9 9 A H2' H 1 4.77 0.03 . 1 . . . A 9 A H2' . 18532 1 131 . 1 1 9 9 A H3' H 1 4.58 0.03 . 1 . . . A 9 A H3' . 18532 1 132 . 1 1 9 9 A H4' H 1 4.50 0.03 . 1 . . . A 9 A H4' . 18532 1 133 . 1 1 9 9 A H5' H 1 4.35 0.03 . 1 . . . A 9 A H5' . 18532 1 134 . 1 1 9 9 A H5'' H 1 4.23 0.03 . 1 . . . A 9 A H5'' . 18532 1 135 . 1 1 9 9 A H8 H 1 8.19 0.03 . 1 . . . A 9 A H8 . 18532 1 136 . 1 1 9 9 A C1' C 13 88.70 0.03 . 1 . . . A 9 A C1' . 18532 1 137 . 1 1 9 9 A C2 C 13 154.36 0.03 . 1 . . . A 9 A C2 . 18532 1 138 . 1 1 9 9 A C2' C 13 74.51 0.03 . 1 . . . A 9 A C2' . 18532 1 139 . 1 1 9 9 A C3' C 13 76.83 0.03 . 1 . . . A 9 A C3' . 18532 1 140 . 1 1 9 9 A C4' C 13 84.46 0.03 . 1 . . . A 9 A C4' . 18532 1 141 . 1 1 9 9 A C5' C 13 66.68 0.03 . 1 . . . A 9 A C5' . 18532 1 142 . 1 1 9 9 A C8 C 13 139.62 0.03 . 1 . . . A 9 A C8 . 18532 1 143 . 1 1 9 9 A N1 N 15 223.17 0.06 . 1 . . . A 9 A N1 . 18532 1 144 . 1 1 9 9 A N3 N 15 214.46 0.06 . 1 . . . A 9 A N3 . 18532 1 145 . 1 1 9 9 A N6 N 15 82.12 0.06 . 1 . . . A 9 A N6 . 18532 1 146 . 1 1 9 9 A N7 N 15 230.75 0.06 . 1 . . . A 9 A N7 . 18532 1 147 . 1 1 9 9 A N9 N 15 168.93 0.06 . 1 . . . A 9 A N9 . 18532 1 148 . 1 1 10 10 U H3 H 1 13.15 0.03 . 1 . . . A 10 U H3 . 18532 1 149 . 1 1 10 10 U H5 H 1 5.10 0.03 . 1 . . . A 10 U H5 . 18532 1 150 . 1 1 10 10 U H5'' H 1 4.15 0.03 . 1 . . . A 10 U H5'' . 18532 1 151 . 1 1 10 10 U H6 H 1 7.49 0.03 . 1 . . . A 10 U H6 . 18532 1 152 . 1 1 10 10 U C2 C 13 153.30 0.03 . 1 . . . A 10 U C2 . 18532 1 153 . 1 1 10 10 U C3' C 13 72.10 0.03 . 1 . . . A 10 U C3' . 18532 1 154 . 1 1 10 10 U C4 C 13 169.58 0.03 . 1 . . . A 10 U C4 . 18532 1 155 . 1 1 10 10 U C5 C 13 103.49 0.03 . 1 . . . A 10 U C5 . 18532 1 156 . 1 1 10 10 U C6 C 13 141.88 0.03 . 1 . . . A 10 U C6 . 18532 1 157 . 1 1 10 10 U N3 N 15 162.55 0.06 . 1 . . . A 10 U N3 . 18532 1 158 . 1 1 11 11 G H1 H 1 12.60 0.03 . 1 . . . A 11 G H1 . 18532 1 159 . 1 1 11 11 G H1' H 1 5.79 0.03 . 1 . . . A 11 G H1' . 18532 1 160 . 1 1 11 11 G H2' H 1 4.44 0.03 . 1 . . . A 11 G H2' . 18532 1 161 . 1 1 11 11 G H3' H 1 4.28 0.03 . 1 . . . A 11 G H3' . 18532 1 162 . 1 1 11 11 G H4' H 1 4.41 0.03 . 1 . . . A 11 G H4' . 18532 1 163 . 1 1 11 11 G H5' H 1 4.30 0.03 . 1 . . . A 11 G H5' . 18532 1 164 . 1 1 11 11 G H5'' H 1 4.12 0.03 . 1 . . . A 11 G H5'' . 18532 1 165 . 1 1 11 11 G H8 H 1 7.70 0.03 . 1 . . . A 11 G H8 . 18532 1 166 . 1 1 11 11 G C1' C 13 91.83 0.03 . 1 . . . A 11 G C1' . 18532 1 167 . 1 1 11 11 G C2' C 13 74.59 0.03 . 1 . . . A 11 G C2' . 18532 1 168 . 1 1 11 11 G C3' C 13 73.17 0.03 . 1 . . . A 11 G C3' . 18532 1 169 . 1 1 11 11 G C4' C 13 81.69 0.03 . 1 . . . A 11 G C4' . 18532 1 170 . 1 1 11 11 G C5' C 13 66.33 0.03 . 1 . . . A 11 G C5' . 18532 1 171 . 1 1 11 11 G C8 C 13 136.66 0.03 . 1 . . . A 11 G C8 . 18532 1 172 . 1 1 11 11 G N1 N 15 148.10 0.06 . 1 . . . A 11 G N1 . 18532 1 173 . 1 1 11 11 G N7 N 15 234.83 0.06 . 1 . . . A 11 G N7 . 18532 1 174 . 1 1 11 11 G N9 N 15 169.82 0.06 . 1 . . . A 11 G N9 . 18532 1 175 . 1 1 12 12 C H1' H 1 5.39 0.03 . 1 . . . A 12 C H1' . 18532 1 176 . 1 1 12 12 C H2' H 1 4.45 0.03 . 1 . . . A 12 C H2' . 18532 1 177 . 1 1 12 12 C H3' H 1 4.19 0.03 . 1 . . . A 12 C H3' . 18532 1 178 . 1 1 12 12 C H4' H 1 4.36 0.03 . 1 . . . A 12 C H4' . 18532 1 179 . 1 1 12 12 C H5 H 1 5.15 0.03 . 1 . . . A 12 C H5 . 18532 1 180 . 1 1 12 12 C H5' H 1 4.43 0.03 . 1 . . . A 12 C H5' . 18532 1 181 . 1 1 12 12 C H5'' H 1 3.98 0.03 . 1 . . . A 12 C H5'' . 18532 1 182 . 1 1 12 12 C H6 H 1 7.38 0.03 . 1 . . . A 12 C H6 . 18532 1 183 . 1 1 12 12 C C1' C 13 93.14 0.03 . 1 . . . A 12 C C1' . 18532 1 184 . 1 1 12 12 C C2 C 13 159.42 0.03 . 1 . . . A 12 C C2 . 18532 1 185 . 1 1 12 12 C C2' C 13 74.82 0.03 . 1 . . . A 12 C C2' . 18532 1 186 . 1 1 12 12 C C3' C 13 71.74 0.03 . 1 . . . A 12 C C3' . 18532 1 187 . 1 1 12 12 C C4 C 13 169.24 0.03 . 1 . . . A 12 C C4 . 18532 1 188 . 1 1 12 12 C C4' C 13 81.24 0.03 . 1 . . . A 12 C C4' . 18532 1 189 . 1 1 12 12 C C5 C 13 96.71 0.03 . 1 . . . A 12 C C5 . 18532 1 190 . 1 1 12 12 C C5' C 13 63.91 0.03 . 1 . . . A 12 C C5' . 18532 1 191 . 1 1 12 12 C C6 C 13 140.78 0.03 . 1 . . . A 12 C C6 . 18532 1 192 . 1 1 12 12 C N1 N 15 151.61 0.06 . 1 . . . A 12 C N1 . 18532 1 193 . 1 1 12 12 C N4 N 15 99.29 0.06 . 1 . . . A 12 C N4 . 18532 1 194 . 1 1 13 13 U H1' H 1 5.59 0.03 . 1 . . . A 13 U H1' . 18532 1 195 . 1 1 13 13 U H2' H 1 3.75 0.03 . 1 . . . A 13 U H2' . 18532 1 196 . 1 1 13 13 U H3' H 1 4.49 0.03 . 1 . . . A 13 U H3' . 18532 1 197 . 1 1 13 13 U H4' H 1 4.31 0.03 . 1 . . . A 13 U H4' . 18532 1 198 . 1 1 13 13 U H5 H 1 5.66 0.03 . 1 . . . A 13 U H5 . 18532 1 199 . 1 1 13 13 U H5' H 1 4.44 0.03 . 1 . . . A 13 U H5' . 18532 1 200 . 1 1 13 13 U H5'' H 1 4.04 0.03 . 1 . . . A 13 U H5'' . 18532 1 201 . 1 1 13 13 U H6 H 1 7.72 0.03 . 1 . . . A 13 U H6 . 18532 1 202 . 1 1 13 13 U C1' C 13 93.89 0.03 . 1 . . . A 13 U C1' . 18532 1 203 . 1 1 13 13 U C2 C 13 153.78 0.03 . 1 . . . A 13 U C2 . 18532 1 204 . 1 1 13 13 U C2' C 13 75.41 0.03 . 1 . . . A 13 U C2' . 18532 1 205 . 1 1 13 13 U C3' C 13 73.08 0.03 . 1 . . . A 13 U C3' . 18532 1 206 . 1 1 13 13 U C4 C 13 168.48 0.03 . 1 . . . A 13 U C4 . 18532 1 207 . 1 1 13 13 U C4' C 13 81.87 0.03 . 1 . . . A 13 U C4' . 18532 1 208 . 1 1 13 13 U C5 C 13 104.91 0.03 . 1 . . . A 13 U C5 . 18532 1 209 . 1 1 13 13 U C5' C 13 63.38 0.03 . 1 . . . A 13 U C5' . 18532 1 210 . 1 1 13 13 U C6 C 13 140.90 0.03 . 1 . . . A 13 U C6 . 18532 1 211 . 1 1 13 13 U N3 N 15 160.44 0.06 . 1 . . . A 13 U N3 . 18532 1 212 . 1 1 14 14 U H1' H 1 6.05 0.03 . 1 . . . A 14 U H1' . 18532 1 213 . 1 1 14 14 U H2' H 1 4.64 0.03 . 1 . . . A 14 U H2' . 18532 1 214 . 1 1 14 14 U H3' H 1 3.97 0.03 . 1 . . . A 14 U H3' . 18532 1 215 . 1 1 14 14 U H4' H 1 4.42 0.03 . 1 . . . A 14 U H4' . 18532 1 216 . 1 1 14 14 U H5 H 1 5.80 0.03 . 1 . . . A 14 U H5 . 18532 1 217 . 1 1 14 14 U H5' H 1 4.19 0.03 . 1 . . . A 14 U H5' . 18532 1 218 . 1 1 14 14 U H5'' H 1 3.98 0.03 . 1 . . . A 14 U H5'' . 18532 1 219 . 1 1 14 14 U H6 H 1 7.98 0.03 . 1 . . . A 14 U H6 . 18532 1 220 . 1 1 14 14 U C1' C 13 88.39 0.03 . 1 . . . A 14 U C1' . 18532 1 221 . 1 1 14 14 U C2 C 13 155.84 0.03 . 1 . . . A 14 U C2 . 18532 1 222 . 1 1 14 14 U C2' C 13 73.80 0.03 . 1 . . . A 14 U C2' . 18532 1 223 . 1 1 14 14 U C3' C 13 77.72 0.03 . 1 . . . A 14 U C3' . 18532 1 224 . 1 1 14 14 U C4 C 13 169.55 0.03 . 1 . . . A 14 U C4 . 18532 1 225 . 1 1 14 14 U C4' C 13 86.33 0.03 . 1 . . . A 14 U C4' . 18532 1 226 . 1 1 14 14 U C5 C 13 105.32 0.03 . 1 . . . A 14 U C5 . 18532 1 227 . 1 1 14 14 U C5' C 13 67.31 0.03 . 1 . . . A 14 U C5' . 18532 1 228 . 1 1 14 14 U C6 C 13 144.94 0.03 . 1 . . . A 14 U C6 . 18532 1 229 . 1 1 14 14 U N1 N 15 144.02 0.06 . 1 . . . A 14 U N1 . 18532 1 230 . 1 1 15 15 C H1' H 1 5.91 0.03 . 1 . . . A 15 C H1' . 18532 1 231 . 1 1 15 15 C H2' H 1 4.05 0.03 . 1 . . . A 15 C H2' . 18532 1 232 . 1 1 15 15 C H3' H 1 4.43 0.03 . 1 . . . A 15 C H3' . 18532 1 233 . 1 1 15 15 C H4' H 1 3.74 0.03 . 1 . . . A 15 C H4' . 18532 1 234 . 1 1 15 15 C H5 H 1 6.08 0.03 . 1 . . . A 15 C H5 . 18532 1 235 . 1 1 15 15 C H5' H 1 3.52 0.03 . 1 . . . A 15 C H5' . 18532 1 236 . 1 1 15 15 C H5'' H 1 2.65 0.03 . 1 . . . A 15 C H5'' . 18532 1 237 . 1 1 15 15 C H6 H 1 7.64 0.03 . 1 . . . A 15 C H6 . 18532 1 238 . 1 1 15 15 C C1' C 13 88.24 0.03 . 1 . . . A 15 C C1' . 18532 1 239 . 1 1 15 15 C C2 C 13 160.81 0.03 . 1 . . . A 15 C C2 . 18532 1 240 . 1 1 15 15 C C2' C 13 77.05 0.03 . 1 . . . A 15 C C2' . 18532 1 241 . 1 1 15 15 C C3' C 13 80.22 0.03 . 1 . . . A 15 C C3' . 18532 1 242 . 1 1 15 15 C C4 C 13 168.74 0.03 . 1 . . . A 15 C C4 . 18532 1 243 . 1 1 15 15 C C4' C 13 83.83 0.03 . 1 . . . A 15 C C4' . 18532 1 244 . 1 1 15 15 C C5 C 13 98.09 0.03 . 1 . . . A 15 C C5 . 18532 1 245 . 1 1 15 15 C C5' C 13 66.72 0.03 . 1 . . . A 15 C C5' . 18532 1 246 . 1 1 15 15 C C6 C 13 143.07 0.03 . 1 . . . A 15 C C6 . 18532 1 247 . 1 1 15 15 C N1 N 15 150.77 0.06 . 1 . . . A 15 C N1 . 18532 1 248 . 1 1 15 15 C N4 N 15 93.63 0.06 . 1 . . . A 15 C N4 . 18532 1 249 . 1 1 16 16 G H1' H 1 5.91 0.03 . 1 . . . A 16 G H1' . 18532 1 250 . 1 1 16 16 G H2' H 1 4.79 0.03 . 1 . . . A 16 G H2' . 18532 1 251 . 1 1 16 16 G H3' H 1 5.58 0.03 . 1 . . . A 16 G H3' . 18532 1 252 . 1 1 16 16 G H4' H 1 4.35 0.03 . 1 . . . A 16 G H4' . 18532 1 253 . 1 1 16 16 G H5' H 1 4.34 0.03 . 1 . . . A 16 G H5' . 18532 1 254 . 1 1 16 16 G H5'' H 1 4.13 0.03 . 1 . . . A 16 G H5'' . 18532 1 255 . 1 1 16 16 G H8 H 1 7.81 0.03 . 1 . . . A 16 G H8 . 18532 1 256 . 1 1 16 16 G C1' C 13 93.95 0.03 . 1 . . . A 16 G C1' . 18532 1 257 . 1 1 16 16 G C2 C 13 156.38 0.03 . 1 . . . A 16 G C2 . 18532 1 258 . 1 1 16 16 G C2' C 13 76.95 0.03 . 1 . . . A 16 G C2' . 18532 1 259 . 1 1 16 16 G C3' C 13 75.76 0.03 . 1 . . . A 16 G C3' . 18532 1 260 . 1 1 16 16 G C4' C 13 82.58 0.03 . 1 . . . A 16 G C4' . 18532 1 261 . 1 1 16 16 G C5' C 13 68.47 0.03 . 1 . . . A 16 G C5' . 18532 1 262 . 1 1 16 16 G C6 C 13 162.35 0.03 . 1 . . . A 16 G C6 . 18532 1 263 . 1 1 16 16 G C8 C 13 143.16 0.03 . 1 . . . A 16 G C8 . 18532 1 264 . 1 1 16 16 G N7 N 15 231.71 0.06 . 1 . . . A 16 G N7 . 18532 1 265 . 1 1 16 16 G N9 N 15 171.75 0.06 . 1 . . . A 16 G N9 . 18532 1 266 . 1 1 17 17 G H1 H 1 13.29 0.03 . 1 . . . A 17 G H1 . 18532 1 267 . 1 1 17 17 G H1' H 1 4.39 0.03 . 1 . . . A 17 G H1' . 18532 1 268 . 1 1 17 17 G H2' H 1 4.40 0.03 . 1 . . . A 17 G H2' . 18532 1 269 . 1 1 17 17 G H3' H 1 4.22 0.03 . 1 . . . A 17 G H3' . 18532 1 270 . 1 1 17 17 G H4' H 1 4.33 0.03 . 1 . . . A 17 G H4' . 18532 1 271 . 1 1 17 17 G H5' H 1 4.43 0.03 . 1 . . . A 17 G H5' . 18532 1 272 . 1 1 17 17 G H5'' H 1 4.21 0.03 . 1 . . . A 17 G H5'' . 18532 1 273 . 1 1 17 17 G H8 H 1 8.24 0.03 . 1 . . . A 17 G H8 . 18532 1 274 . 1 1 17 17 G C1' C 13 92.57 0.03 . 1 . . . A 17 G C1' . 18532 1 275 . 1 1 17 17 G C2' C 13 75.11 0.03 . 1 . . . A 17 G C2' . 18532 1 276 . 1 1 17 17 G C3' C 13 74.44 0.03 . 1 . . . A 17 G C3' . 18532 1 277 . 1 1 17 17 G C4' C 13 82.49 0.03 . 1 . . . A 17 G C4' . 18532 1 278 . 1 1 17 17 G C5' C 13 69.13 0.03 . 1 . . . A 17 G C5' . 18532 1 279 . 1 1 17 17 G C8 C 13 138.11 0.03 . 1 . . . A 17 G C8 . 18532 1 280 . 1 1 17 17 G N7 N 15 233.12 0.06 . 1 . . . A 17 G N7 . 18532 1 281 . 1 1 17 17 G N9 N 15 170.41 0.06 . 1 . . . A 17 G N9 . 18532 1 282 . 1 1 18 18 C H1' H 1 5.43 0.03 . 1 . . . A 18 C H1' . 18532 1 283 . 1 1 18 18 C H2' H 1 4.43 0.03 . 1 . . . A 18 C H2' . 18532 1 284 . 1 1 18 18 C H3' H 1 4.36 0.03 . 1 . . . A 18 C H3' . 18532 1 285 . 1 1 18 18 C H4' H 1 4.28 0.03 . 1 . . . A 18 C H4' . 18532 1 286 . 1 1 18 18 C H5 H 1 5.22 0.03 . 1 . . . A 18 C H5 . 18532 1 287 . 1 1 18 18 C H5' H 1 4.43 0.03 . 1 . . . A 18 C H5' . 18532 1 288 . 1 1 18 18 C H5'' H 1 3.96 0.03 . 1 . . . A 18 C H5'' . 18532 1 289 . 1 1 18 18 C H6 H 1 7.61 0.03 . 1 . . . A 18 C H6 . 18532 1 290 . 1 1 18 18 C H41 H 1 8.55 0.03 . 1 . . . A 18 C H41 . 18532 1 291 . 1 1 18 18 C H42 H 1 6.75 0.03 . 1 . . . A 18 C H42 . 18532 1 292 . 1 1 18 18 C C1' C 13 92.47 0.03 . 1 . . . A 18 C C1' . 18532 1 293 . 1 1 18 18 C C2 C 13 159.56 0.03 . 1 . . . A 18 C C2 . 18532 1 294 . 1 1 18 18 C C2' C 13 74.82 0.03 . 1 . . . A 18 C C2' . 18532 1 295 . 1 1 18 18 C C3' C 13 71.92 0.03 . 1 . . . A 18 C C3' . 18532 1 296 . 1 1 18 18 C C4 C 13 169.27 0.03 . 1 . . . A 18 C C4 . 18532 1 297 . 1 1 18 18 C C4' C 13 81.60 0.03 . 1 . . . A 18 C C4' . 18532 1 298 . 1 1 18 18 C C5 C 13 96.69 0.03 . 1 . . . A 18 C C5 . 18532 1 299 . 1 1 18 18 C C5' C 13 63.64 0.03 . 1 . . . A 18 C C5' . 18532 1 300 . 1 1 18 18 C C6 C 13 141.30 0.03 . 1 . . . A 18 C C6 . 18532 1 301 . 1 1 18 18 C N1 N 15 152.02 0.06 . 1 . . . A 18 C N1 . 18532 1 302 . 1 1 18 18 C N4 N 15 97.49 0.06 . 1 . . . A 18 C N4 . 18532 1 303 . 1 1 19 19 A H2 H 1 7.40 0.03 . 1 . . . A 19 A H2 . 18532 1 304 . 1 1 19 19 A H4' H 1 4.43 0.03 . 1 . . . A 19 A H4' . 18532 1 305 . 1 1 19 19 A H8 H 1 8.00 0.03 . 1 . . . A 19 A H8 . 18532 1 306 . 1 1 19 19 A C1' C 13 92.36 0.03 . 1 . . . A 19 A C1' . 18532 1 307 . 1 1 19 19 A C2 C 13 153.75 0.03 . 1 . . . A 19 A C2 . 18532 1 308 . 1 1 19 19 A C8 C 13 139.78 0.03 . 1 . . . A 19 A C8 . 18532 1 309 . 1 1 19 19 A N1 N 15 222.20 0.06 . 1 . . . A 19 A N1 . 18532 1 310 . 1 1 19 19 A N3 N 15 213.82 0.06 . 1 . . . A 19 A N3 . 18532 1 311 . 1 1 19 19 A N6 N 15 83.56 0.06 . 1 . . . A 19 A N6 . 18532 1 312 . 1 1 19 19 A N7 N 15 231.19 0.06 . 1 . . . A 19 A N7 . 18532 1 313 . 1 1 19 19 A N9 N 15 170.93 0.06 . 1 . . . A 19 A N9 . 18532 1 314 . 1 1 20 20 U H1' H 1 5.44 0.03 . 1 . . . A 20 U H1' . 18532 1 315 . 1 1 20 20 U H2' H 1 4.26 0.03 . 1 . . . A 20 U H2' . 18532 1 316 . 1 1 20 20 U H4' H 1 4.43 0.03 . 1 . . . A 20 U H4' . 18532 1 317 . 1 1 20 20 U H5 H 1 5.20 0.03 . 1 . . . A 20 U H5 . 18532 1 318 . 1 1 20 20 U H6 H 1 7.46 0.03 . 1 . . . A 20 U H6 . 18532 1 319 . 1 1 20 20 U C1' C 13 91.76 0.03 . 1 . . . A 20 U C1' . 18532 1 320 . 1 1 20 20 U C2 C 13 153.70 0.03 . 1 . . . A 20 U C2 . 18532 1 321 . 1 1 20 20 U C2' C 13 76.83 0.03 . 1 . . . A 20 U C2' . 18532 1 322 . 1 1 20 20 U C3' C 13 70.40 0.03 . 1 . . . A 20 U C3' . 18532 1 323 . 1 1 20 20 U C4 C 13 168.97 0.03 . 1 . . . A 20 U C4 . 18532 1 324 . 1 1 20 20 U C5 C 13 103.46 0.03 . 1 . . . A 20 U C5 . 18532 1 325 . 1 1 20 20 U C6 C 13 141.48 0.03 . 1 . . . A 20 U C6 . 18532 1 326 . 1 1 20 20 U N1 N 15 146.55 0.06 . 1 . . . A 20 U N1 . 18532 1 327 . 1 1 21 21 A H1' H 1 5.76 0.03 . 1 . . . A 21 A H1' . 18532 1 328 . 1 1 21 21 A H2 H 1 7.41 0.03 . 1 . . . A 21 A H2 . 18532 1 329 . 1 1 21 21 A H2' H 1 4.53 0.03 . 1 . . . A 21 A H2' . 18532 1 330 . 1 1 21 21 A H3' H 1 4.27 0.03 . 1 . . . A 21 A H3' . 18532 1 331 . 1 1 21 21 A H4' H 1 4.49 0.03 . 1 . . . A 21 A H4' . 18532 1 332 . 1 1 21 21 A H5' H 1 4.37 0.03 . 1 . . . A 21 A H5' . 18532 1 333 . 1 1 21 21 A H5'' H 1 4.10 0.03 . 1 . . . A 21 A H5'' . 18532 1 334 . 1 1 21 21 A H8 H 1 7.97 0.03 . 1 . . . A 21 A H8 . 18532 1 335 . 1 1 21 21 A C1' C 13 91.70 0.03 . 1 . . . A 21 A C1' . 18532 1 336 . 1 1 21 21 A C2 C 13 154.31 0.03 . 1 . . . A 21 A C2 . 18532 1 337 . 1 1 21 21 A C2' C 13 74.90 0.03 . 1 . . . A 21 A C2' . 18532 1 338 . 1 1 21 21 A C3' C 13 73.97 0.03 . 1 . . . A 21 A C3' . 18532 1 339 . 1 1 21 21 A C4' C 13 82.67 0.03 . 1 . . . A 21 A C4' . 18532 1 340 . 1 1 21 21 A C5' C 13 66.32 0.03 . 1 . . . A 21 A C5' . 18532 1 341 . 1 1 21 21 A C8 C 13 140.74 0.03 . 1 . . . A 21 A C8 . 18532 1 342 . 1 1 21 21 A N1 N 15 225.47 0.06 . 1 . . . A 21 A N1 . 18532 1 343 . 1 1 21 21 A N3 N 15 215.74 0.06 . 1 . . . A 21 A N3 . 18532 1 344 . 1 1 21 21 A N6 N 15 80.84 0.06 . 1 . . . A 21 A N6 . 18532 1 345 . 1 1 21 21 A N7 N 15 231.41 0.06 . 1 . . . A 21 A N7 . 18532 1 346 . 1 1 21 21 A N9 N 15 169.23 0.06 . 1 . . . A 21 A N9 . 18532 1 347 . 1 1 22 22 U H1' H 1 5.09 0.03 . 1 . . . A 22 U H1' . 18532 1 348 . 1 1 22 22 U H2' H 1 4.18 0.03 . 1 . . . A 22 U H2' . 18532 1 349 . 1 1 22 22 U H3 H 1 10.53 0.03 . 1 . . . A 22 U H3 . 18532 1 350 . 1 1 22 22 U H3' H 1 4.25 0.03 . 1 . . . A 22 U H3' . 18532 1 351 . 1 1 22 22 U H4' H 1 4.28 0.03 . 1 . . . A 22 U H4' . 18532 1 352 . 1 1 22 22 U H5 H 1 5.22 0.03 . 1 . . . A 22 U H5 . 18532 1 353 . 1 1 22 22 U H5' H 1 4.30 0.03 . 1 . . . A 22 U H5' . 18532 1 354 . 1 1 22 22 U H5'' H 1 4.00 0.03 . 1 . . . A 22 U H5'' . 18532 1 355 . 1 1 22 22 U H6 H 1 7.42 0.03 . 1 . . . A 22 U H6 . 18532 1 356 . 1 1 22 22 U C1' C 13 92.84 0.03 . 1 . . . A 22 U C1' . 18532 1 357 . 1 1 22 22 U C2 C 13 152.98 0.03 . 1 . . . A 22 U C2 . 18532 1 358 . 1 1 22 22 U C2' C 13 74.29 0.03 . 1 . . . A 22 U C2' . 18532 1 359 . 1 1 22 22 U C3' C 13 72.63 0.03 . 1 . . . A 22 U C3' . 18532 1 360 . 1 1 22 22 U C4 C 13 168.67 0.03 . 1 . . . A 22 U C4 . 18532 1 361 . 1 1 22 22 U C4' C 13 81.96 0.03 . 1 . . . A 22 U C4' . 18532 1 362 . 1 1 22 22 U C5 C 13 102.99 0.03 . 1 . . . A 22 U C5 . 18532 1 363 . 1 1 22 22 U C5' C 13 64.45 0.03 . 1 . . . A 22 U C5' . 18532 1 364 . 1 1 22 22 U C6 C 13 142.32 0.03 . 1 . . . A 22 U C6 . 18532 1 365 . 1 1 22 22 U N1 N 15 146.35 0.06 . 1 . . . A 22 U N1 . 18532 1 366 . 1 1 22 22 U N3 N 15 157.20 0.06 . 1 . . . A 22 U N3 . 18532 1 367 . 1 1 23 23 C H1' H 1 5.49 0.03 . 1 . . . A 23 C H1' . 18532 1 368 . 1 1 23 23 C H2' H 1 4.33 0.03 . 1 . . . A 23 C H2' . 18532 1 369 . 1 1 23 23 C H3' H 1 4.52 0.03 . 1 . . . A 23 C H3' . 18532 1 370 . 1 1 23 23 C H4' H 1 4.30 0.03 . 1 . . . A 23 C H4' . 18532 1 371 . 1 1 23 23 C H5 H 1 5.66 0.03 . 1 . . . A 23 C H5 . 18532 1 372 . 1 1 23 23 C H5' H 1 4.37 0.03 . 1 . . . A 23 C H5' . 18532 1 373 . 1 1 23 23 C H5'' H 1 4.03 0.03 . 1 . . . A 23 C H5'' . 18532 1 374 . 1 1 23 23 C H6 H 1 7.78 0.03 . 1 . . . A 23 C H6 . 18532 1 375 . 1 1 23 23 C H41 H 1 8.01 0.03 . 1 . . . A 23 C H41 . 18532 1 376 . 1 1 23 23 C H42 H 1 7.04 0.03 . 1 . . . A 23 C H42 . 18532 1 377 . 1 1 23 23 C C1' C 13 92.65 0.03 . 1 . . . A 23 C C1' . 18532 1 378 . 1 1 23 23 C C2 C 13 159.74 0.03 . 1 . . . A 23 C C2 . 18532 1 379 . 1 1 23 23 C C2' C 13 75.04 0.03 . 1 . . . A 23 C C2' . 18532 1 380 . 1 1 23 23 C C3' C 13 72.99 0.03 . 1 . . . A 23 C C3' . 18532 1 381 . 1 1 23 23 C C4 C 13 168.94 0.03 . 1 . . . A 23 C C4 . 18532 1 382 . 1 1 23 23 C C4' C 13 81.15 0.03 . 1 . . . A 23 C C4' . 18532 1 383 . 1 1 23 23 C C5 C 13 97.68 0.03 . 1 . . . A 23 C C5 . 18532 1 384 . 1 1 23 23 C C5' C 13 64.36 0.03 . 1 . . . A 23 C C5' . 18532 1 385 . 1 1 23 23 C C6 C 13 142.07 0.03 . 1 . . . A 23 C C6 . 18532 1 386 . 1 1 23 23 C N1 N 15 151.68 0.06 . 1 . . . A 23 C N1 . 18532 1 387 . 1 1 23 23 C N4 N 15 98.16 0.06 . 1 . . . A 23 C N4 . 18532 1 388 . 1 1 24 24 A H1' H 1 6.04 0.03 . 1 . . . A 24 A H1' . 18532 1 389 . 1 1 24 24 A H2 H 1 7.94 0.03 . 1 . . . A 24 A H2 . 18532 1 390 . 1 1 24 24 A H2' H 1 4.65 0.03 . 1 . . . A 24 A H2' . 18532 1 391 . 1 1 24 24 A H3' H 1 4.61 0.03 . 1 . . . A 24 A H3' . 18532 1 392 . 1 1 24 24 A H4' H 1 4.50 0.03 . 1 . . . A 24 A H4' . 18532 1 393 . 1 1 24 24 A H5' H 1 4.43 0.03 . 1 . . . A 24 A H5' . 18532 1 394 . 1 1 24 24 A H5'' H 1 4.16 0.03 . 1 . . . A 24 A H5'' . 18532 1 395 . 1 1 24 24 A H8 H 1 8.16 0.03 . 1 . . . A 24 A H8 . 18532 1 396 . 1 1 24 24 A C1' C 13 90.92 0.03 . 1 . . . A 24 A C1' . 18532 1 397 . 1 1 24 24 A C2 C 13 155.08 0.03 . 1 . . . A 24 A C2 . 18532 1 398 . 1 1 24 24 A C2' C 13 75.34 0.03 . 1 . . . A 24 A C2' . 18532 1 399 . 1 1 24 24 A C3' C 13 74.42 0.03 . 1 . . . A 24 A C3' . 18532 1 400 . 1 1 24 24 A C4' C 13 82.23 0.03 . 1 . . . A 24 A C4' . 18532 1 401 . 1 1 24 24 A C5' C 13 65.79 0.03 . 1 . . . A 24 A C5' . 18532 1 402 . 1 1 24 24 A C8 C 13 140.06 0.03 . 1 . . . A 24 A C8 . 18532 1 403 . 1 1 24 24 A N1 N 15 229.70 0.06 . 1 . . . A 24 A N1 . 18532 1 404 . 1 1 24 24 A N3 N 15 213.90 0.06 . 1 . . . A 24 A N3 . 18532 1 405 . 1 1 24 24 A N6 N 15 81.70 0.06 . 1 . . . A 24 A N6 . 18532 1 406 . 1 1 24 24 A N7 N 15 231.04 0.06 . 1 . . . A 24 A N7 . 18532 1 407 . 1 1 24 24 A N9 N 15 169.08 0.06 . 1 . . . A 24 A N9 . 18532 1 408 . 1 1 25 25 G H1 H 1 12.47 0.03 . 1 . . . A 25 G H1 . 18532 1 409 . 1 1 25 25 G H1' H 1 5.57 0.03 . 1 . . . A 25 G H1' . 18532 1 410 . 1 1 25 25 G H2' H 1 4.50 0.03 . 1 . . . A 25 G H2' . 18532 1 411 . 1 1 25 25 G H3' H 1 4.25 0.03 . 1 . . . A 25 G H3' . 18532 1 412 . 1 1 25 25 G H4' H 1 4.45 0.03 . 1 . . . A 25 G H4' . 18532 1 413 . 1 1 25 25 G H5' H 1 4.29 0.03 . 1 . . . A 25 G H5' . 18532 1 414 . 1 1 25 25 G H5'' H 1 4.05 0.03 . 1 . . . A 25 G H5'' . 18532 1 415 . 1 1 25 25 G H8 H 1 7.21 0.03 . 1 . . . A 25 G H8 . 18532 1 416 . 1 1 25 25 G C1' C 13 92.69 0.03 . 1 . . . A 25 G C1' . 18532 1 417 . 1 1 25 25 G C2' C 13 74.37 0.03 . 1 . . . A 25 G C2' . 18532 1 418 . 1 1 25 25 G C3' C 13 73.70 0.03 . 1 . . . A 25 G C3' . 18532 1 419 . 1 1 25 25 G C4' C 13 82.14 0.03 . 1 . . . A 25 G C4' . 18532 1 420 . 1 1 25 25 G C5' C 13 66.85 0.03 . 1 . . . A 25 G C5' . 18532 1 421 . 1 1 25 25 G C8 C 13 136.80 0.03 . 1 . . . A 25 G C8 . 18532 1 422 . 1 1 25 25 G N1 N 15 148.98 0.06 . 1 . . . A 25 G N1 . 18532 1 423 . 1 1 25 25 G N7 N 15 233.56 0.06 . 1 . . . A 25 G N7 . 18532 1 424 . 1 1 25 25 G N9 N 15 168.34 0.06 . 1 . . . A 25 G N9 . 18532 1 425 . 1 1 26 26 C H1' H 1 5.42 0.03 . 1 . . . A 26 C H1' . 18532 1 426 . 1 1 26 26 C H2' H 1 4.51 0.03 . 1 . . . A 26 C H2' . 18532 1 427 . 1 1 26 26 C H3' H 1 4.29 0.03 . 1 . . . A 26 C H3' . 18532 1 428 . 1 1 26 26 C H4' H 1 4.37 0.03 . 1 . . . A 26 C H4' . 18532 1 429 . 1 1 26 26 C H5 H 1 5.08 0.03 . 1 . . . A 26 C H5 . 18532 1 430 . 1 1 26 26 C H5' H 1 4.46 0.03 . 1 . . . A 26 C H5' . 18532 1 431 . 1 1 26 26 C H5'' H 1 4.01 0.03 . 1 . . . A 26 C H5'' . 18532 1 432 . 1 1 26 26 C H6 H 1 7.72 0.03 . 1 . . . A 26 C H6 . 18532 1 433 . 1 1 26 26 C H41 H 1 8.49 0.03 . 1 . . . A 26 C H41 . 18532 1 434 . 1 1 26 26 C H42 H 1 6.70 0.03 . 1 . . . A 26 C H42 . 18532 1 435 . 1 1 26 26 C C1' C 13 93.27 0.03 . 1 . . . A 26 C C1' . 18532 1 436 . 1 1 26 26 C C2 C 13 159.60 0.03 . 1 . . . A 26 C C2 . 18532 1 437 . 1 1 26 26 C C2' C 13 74.67 0.03 . 1 . . . A 26 C C2' . 18532 1 438 . 1 1 26 26 C C3' C 13 71.74 0.03 . 1 . . . A 26 C C3' . 18532 1 439 . 1 1 26 26 C C4 C 13 168.93 0.03 . 1 . . . A 26 C C4 . 18532 1 440 . 1 1 26 26 C C4' C 13 81.33 0.03 . 1 . . . A 26 C C4' . 18532 1 441 . 1 1 26 26 C C5 C 13 96.07 0.03 . 1 . . . A 26 C C5 . 18532 1 442 . 1 1 26 26 C C5' C 13 63.73 0.03 . 1 . . . A 26 C C5' . 18532 1 443 . 1 1 26 26 C C6 C 13 141.65 0.03 . 1 . . . A 26 C C6 . 18532 1 444 . 1 1 26 26 C N1 N 15 152.10 0.06 . 1 . . . A 26 C N1 . 18532 1 445 . 1 1 26 26 C N4 N 15 98.62 0.06 . 1 . . . A 26 C N4 . 18532 1 446 . 1 1 27 27 C H1' H 1 5.44 0.03 . 1 . . . A 27 C H1' . 18532 1 447 . 1 1 27 27 C H2' H 1 4.42 0.03 . 1 . . . A 27 C H2' . 18532 1 448 . 1 1 27 27 C H3' H 1 4.48 0.03 . 1 . . . A 27 C H3' . 18532 1 449 . 1 1 27 27 C H4' H 1 4.38 0.03 . 1 . . . A 27 C H4' . 18532 1 450 . 1 1 27 27 C H5 H 1 5.41 0.03 . 1 . . . A 27 C H5 . 18532 1 451 . 1 1 27 27 C H5' H 1 4.42 0.03 . 1 . . . A 27 C H5' . 18532 1 452 . 1 1 27 27 C H5'' H 1 4.06 0.03 . 1 . . . A 27 C H5'' . 18532 1 453 . 1 1 27 27 C H6 H 1 7.74 0.03 . 1 . . . A 27 C H6 . 18532 1 454 . 1 1 27 27 C H41 H 1 8.41 0.03 . 1 . . . A 27 C H41 . 18532 1 455 . 1 1 27 27 C H42 H 1 6.97 0.03 . 1 . . . A 27 C H42 . 18532 1 456 . 1 1 27 27 C C1' C 13 93.76 0.03 . 1 . . . A 27 C C1' . 18532 1 457 . 1 1 27 27 C C2 C 13 155.72 0.03 . 1 . . . A 27 C C2 . 18532 1 458 . 1 1 27 27 C C2' C 13 75.34 0.03 . 1 . . . A 27 C C2' . 18532 1 459 . 1 1 27 27 C C3' C 13 73.34 0.03 . 1 . . . A 27 C C3' . 18532 1 460 . 1 1 27 27 C C4 C 13 169.32 0.03 . 1 . . . A 27 C C4 . 18532 1 461 . 1 1 27 27 C C4' C 13 81.87 0.03 . 1 . . . A 27 C C4' . 18532 1 462 . 1 1 27 27 C C5 C 13 97.12 0.03 . 1 . . . A 27 C C5 . 18532 1 463 . 1 1 27 27 C C5' C 13 64.92 0.03 . 1 . . . A 27 C C5' . 18532 1 464 . 1 1 27 27 C C6 C 13 141.70 0.03 . 1 . . . A 27 C C6 . 18532 1 465 . 1 1 27 27 C N4 N 15 98.31 0.06 . 1 . . . A 27 C N4 . 18532 1 466 . 1 1 28 28 C H1' H 1 5.71 0.03 . 1 . . . A 28 C H1' . 18532 1 467 . 1 1 28 28 C H2' H 1 3.95 0.03 . 1 . . . A 28 C H2' . 18532 1 468 . 1 1 28 28 C H3' H 1 4.17 0.03 . 1 . . . A 28 C H3' . 18532 1 469 . 1 1 28 28 C H4' H 1 4.07 0.03 . 1 . . . A 28 C H4' . 18532 1 470 . 1 1 28 28 C H5 H 1 5.45 0.03 . 1 . . . A 28 C H5 . 18532 1 471 . 1 1 28 28 C H5' H 1 4.45 0.03 . 1 . . . A 28 C H5' . 18532 1 472 . 1 1 28 28 C H5'' H 1 3.97 0.03 . 1 . . . A 28 C H5'' . 18532 1 473 . 1 1 28 28 C H6 H 1 7.64 0.03 . 1 . . . A 28 C H6 . 18532 1 474 . 1 1 28 28 C H41 H 1 8.22 0.03 . 1 . . . A 28 C H41 . 18532 1 475 . 1 1 28 28 C H42 H 1 6.92 0.03 . 1 . . . A 28 C H42 . 18532 1 476 . 1 1 28 28 C C1' C 13 92.16 0.03 . 1 . . . A 28 C C1' . 18532 1 477 . 1 1 28 28 C C2 C 13 160.66 0.03 . 1 . . . A 28 C C2 . 18532 1 478 . 1 1 28 28 C C2' C 13 76.90 0.03 . 1 . . . A 28 C C2' . 18532 1 479 . 1 1 28 28 C C3' C 13 69.86 0.03 . 1 . . . A 28 C C3' . 18532 1 480 . 1 1 28 28 C C4 C 13 169.52 0.03 . 1 . . . A 28 C C4 . 18532 1 481 . 1 1 28 28 C C4' C 13 82.85 0.03 . 1 . . . A 28 C C4' . 18532 1 482 . 1 1 28 28 C C5 C 13 97.66 0.03 . 1 . . . A 28 C C5 . 18532 1 483 . 1 1 28 28 C C5' C 13 64.90 0.03 . 1 . . . A 28 C C5' . 18532 1 484 . 1 1 28 28 C C6 C 13 142.14 0.03 . 1 . . . A 28 C C6 . 18532 1 485 . 1 1 28 28 C N1 N 15 153.64 0.06 . 1 . . . A 28 C N1 . 18532 1 486 . 1 1 28 28 C N4 N 15 97.18 0.06 . 1 . . . A 28 C N4 . 18532 1 stop_ save_