################################### # 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 17316 _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 0.03 _Assigned_chem_shift_list.Chem_shift_13C_err 0.08 _Assigned_chem_shift_list.Chem_shift_15N_err 0.08 _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 'observed variation among multiple spectra/multiple samples.' _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' . . . 17316 1 2 '3D HCCH-TOCSY' . . . 17316 1 5 '2D 1H-15N HSQC' . . . 17316 1 9 '3D HCN' . . . 17316 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 5.79 0.03 . 1 . . . . 1 G H1' . 17316 1 2 . 1 1 1 1 G H8 H 1 8.11 0.03 . 1 . . . . 1 G H8 . 17316 1 3 . 1 1 1 1 G C8 C 13 138.97 0.03 . 1 . . . . 1 G C8 . 17316 1 4 . 1 1 2 2 G H1 H 1 12.63 0.03 . 1 . . . . 2 G H1 . 17316 1 5 . 1 1 2 2 G H1' H 1 5.89 0.03 . 1 . . . . 2 G H1' . 17316 1 6 . 1 1 2 2 G H2' H 1 4.65 0.03 . 1 . . . . 2 G H2' . 17316 1 7 . 1 1 2 2 G H3' H 1 4.54 0.03 . 1 . . . . 2 G H3' . 17316 1 8 . 1 1 2 2 G H4' H 1 4.51 0.03 . 1 . . . . 2 G H4' . 17316 1 9 . 1 1 2 2 G H5' H 1 4.48 0.03 . . . . . . 2 G H5' . 17316 1 10 . 1 1 2 2 G H5'' H 1 4.19 0.03 . . . . . . 2 G H5'' . 17316 1 11 . 1 1 2 2 G H8 H 1 7.46 0.03 . 1 . . . . 2 G H8 . 17316 1 12 . 1 1 2 2 G C1' C 13 92.67 0.03 . 1 . . . . 2 G C1' . 17316 1 13 . 1 1 2 2 G C2' C 13 75.42 0.03 . 1 . . . . 2 G C2' . 17316 1 14 . 1 1 2 2 G C3' C 13 72.83 0.03 . 1 . . . . 2 G C3' . 17316 1 15 . 1 1 2 2 G C4' C 13 82.09 0.03 . 1 . . . . 2 G C4' . 17316 1 16 . 1 1 2 2 G C5' C 13 65.68 0.03 . 1 . . . . 2 G C5' . 17316 1 17 . 1 1 2 2 G C8 C 13 136.51 0.03 . 1 . . . . 2 G C8 . 17316 1 18 . 1 1 2 2 G N1 N 15 147.30 0.06 . 1 . . . . 2 G N1 . 17316 1 19 . 1 1 3 3 G H1 H 1 12.20 0.03 . 1 . . . . 3 G H1 . 17316 1 20 . 1 1 3 3 G H1' H 1 5.74 0.03 . 1 . . . . 3 G H1' . 17316 1 21 . 1 1 3 3 G H2' H 1 4.65 0.03 . 1 . . . . 3 G H2' . 17316 1 22 . 1 1 3 3 G H3' H 1 4.54 0.03 . 1 . . . . 3 G H3' . 17316 1 23 . 1 1 3 3 G H4' H 1 4.51 0.03 . 1 . . . . 3 G H4' . 17316 1 24 . 1 1 3 3 G H5' H 1 4.20 0.03 . . . . . . 3 G H5' . 17316 1 25 . 1 1 3 3 G H5'' H 1 4.13 0.03 . . . . . . 3 G H5'' . 17316 1 26 . 1 1 3 3 G H8 H 1 7.13 0.03 . 1 . . . . 3 G H8 . 17316 1 27 . 1 1 3 3 G C1' C 13 92.67 0.03 . 1 . . . . 3 G C1' . 17316 1 28 . 1 1 3 3 G C2' C 13 75.42 0.03 . 1 . . . . 3 G C2' . 17316 1 29 . 1 1 3 3 G C3' C 13 72.82 0.03 . 1 . . . . 3 G C3' . 17316 1 30 . 1 1 3 3 G C4' C 13 82.09 0.03 . 1 . . . . 3 G C4' . 17316 1 31 . 1 1 3 3 G C5' C 13 65.68 0.03 . 1 . . . . 3 G C5' . 17316 1 32 . 1 1 3 3 G C8 C 13 135.97 0.03 . 1 . . . . 3 G C8 . 17316 1 33 . 1 1 3 3 G N1 N 15 147.06 0.06 . 1 . . . . 3 G N1 . 17316 1 34 . 1 1 4 4 A H1' H 1 5.91 0.03 . 1 . . . . 4 A H1' . 17316 1 35 . 1 1 4 4 A H2 H 1 7.45 0.03 . 1 . . . . 4 A H2 . 17316 1 36 . 1 1 4 4 A H2' H 1 4.65 0.03 . 1 . . . . 4 A H2' . 17316 1 37 . 1 1 4 4 A H3' H 1 4.53 0.03 . 1 . . . . 4 A H3' . 17316 1 38 . 1 1 4 4 A H4' H 1 4.46 0.03 . 1 . . . . 4 A H4' . 17316 1 39 . 1 1 4 4 A H5' H 1 4.49 0.03 . . . . . . 4 A H5' . 17316 1 40 . 1 1 4 4 A H5'' H 1 4.08 0.03 . . . . . . 4 A H5'' . 17316 1 41 . 1 1 4 4 A H8 H 1 7.61 0.03 . 1 . . . . 4 A H8 . 17316 1 42 . 1 1 4 4 A C1' C 13 92.84 0.03 . 1 . . . . 4 A C1' . 17316 1 43 . 1 1 4 4 A C2 C 13 153.04 0.03 . 1 . . . . 4 A C2 . 17316 1 44 . 1 1 4 4 A C2' C 13 75.48 0.03 . 1 . . . . 4 A C2' . 17316 1 45 . 1 1 4 4 A C3' C 13 72.77 0.03 . 1 . . . . 4 A C3' . 17316 1 46 . 1 1 4 4 A C4' C 13 72.77 0.03 . 1 . . . . 4 A C4' . 17316 1 47 . 1 1 4 4 A C5' C 13 81.80 0.03 . 1 . . . . 4 A C5' . 17316 1 48 . 1 1 4 4 A C8 C 13 139.10 0.03 . 1 . . . . 4 A C8 . 17316 1 49 . 1 1 5 5 G H1 H 1 13.28 0.03 . 1 . . . . 5 G H1 . 17316 1 50 . 1 1 5 5 G H1' H 1 5.53 0.03 . 1 . . . . 5 G H1' . 17316 1 51 . 1 1 5 5 G H2' H 1 4.32 0.03 . 1 . . . . 5 G H2' . 17316 1 52 . 1 1 5 5 G H3' H 1 4.39 0.03 . 1 . . . . 5 G H3' . 17316 1 53 . 1 1 5 5 G H4' H 1 4.36 0.03 . 1 . . . . 5 G H4' . 17316 1 54 . 1 1 5 5 G H5' H 1 4.37 0.03 . . . . . . 5 G H5' . 17316 1 55 . 1 1 5 5 G H5'' H 1 3.97 0.03 . . . . . . 5 G H5'' . 17316 1 56 . 1 1 5 5 G H8 H 1 7.02 0.03 . 1 . . . . 5 G H8 . 17316 1 57 . 1 1 5 5 G C1' C 13 92.67 0.03 . 1 . . . . 5 G C1' . 17316 1 58 . 1 1 5 5 G C2' C 13 75.20 0.03 . 1 . . . . 5 G C2' . 17316 1 59 . 1 1 5 5 G C3' C 13 73.00 0.03 . 1 . . . . 5 G C3' . 17316 1 60 . 1 1 5 5 G C4' C 13 81.90 0.03 . 1 . . . . 5 G C4' . 17316 1 61 . 1 1 5 5 G C5' C 13 65.82 0.03 . 1 . . . . 5 G C5' . 17316 1 62 . 1 1 5 5 G C6 C 13 162.32 0.03 . 1 . . . . 5 G C6 . 17316 1 63 . 1 1 5 5 G C8 C 13 135.73 0.03 . 1 . . . . 5 G C8 . 17316 1 64 . 1 1 5 5 G N1 N 15 147.77 0.06 . 1 . . . . 5 G N1 . 17316 1 65 . 1 1 6 6 U H1' H 1 5.49 0.03 . 1 . . . . 6 U H1' . 17316 1 66 . 1 1 6 6 U H2' H 1 4.40 0.03 . 1 . . . . 6 U H2' . 17316 1 67 . 1 1 6 6 U H3 H 1 12.47 0.03 . 1 . . . . 6 U H3 . 17316 1 68 . 1 1 6 6 U H3' H 1 4.36 0.03 . 1 . . . . 6 U H3' . 17316 1 69 . 1 1 6 6 U H4' H 1 4.33 0.03 . 1 . . . . 6 U H4' . 17316 1 70 . 1 1 6 6 U H5 H 1 4.98 0.03 . 1 . . . . 6 U H5 . 17316 1 71 . 1 1 6 6 U H5' H 1 4.41 0.03 . . . . . . 6 U H5' . 17316 1 72 . 1 1 6 6 U H5'' H 1 4.01 0.03 . . . . . . 6 U H5'' . 17316 1 73 . 1 1 6 6 U H6 H 1 7.42 0.03 . 1 . . . . 6 U H6 . 17316 1 74 . 1 1 6 6 U C1' C 13 92.98 0.03 . 1 . . . . 6 U C1' . 17316 1 75 . 1 1 6 6 U C2' C 13 75.45 0.03 . 1 . . . . 6 U C2' . 17316 1 76 . 1 1 6 6 U C3' C 13 72.72 0.03 . 1 . . . . 6 U C3' . 17316 1 77 . 1 1 6 6 U C4' C 13 82.23 0.03 . 1 . . . . 6 U C4' . 17316 1 78 . 1 1 6 6 U C5 C 13 103.06 0.03 . 1 . . . . 6 U C5 . 17316 1 79 . 1 1 6 6 U C5' C 13 64.75 0.03 . 1 . . . . 6 U C5' . 17316 1 80 . 1 1 6 6 U C6 C 13 140.81 0.03 . 1 . . . . 6 U C6 . 17316 1 81 . 1 1 6 6 U N3 N 15 157.35 0.06 . 1 . . . . 6 U N3 . 17316 1 82 . 1 1 7 7 A H1' H 1 5.64 0.03 . 1 . . . . 7 A H1' . 17316 1 83 . 1 1 7 7 A H2 H 1 6.92 0.03 . 1 . . . . 7 A H2 . 17316 1 84 . 1 1 7 7 A H2' H 1 4.24 0.03 . 1 . . . . 7 A H2' . 17316 1 85 . 1 1 7 7 A H3' H 1 4.44 0.03 . 1 . . . . 7 A H3' . 17316 1 86 . 1 1 7 7 A H4' H 1 4.42 0.03 . 1 . . . . 7 A H4' . 17316 1 87 . 1 1 7 7 A H5' H 1 4.32 0.03 . . . . . . 7 A H5' . 17316 1 88 . 1 1 7 7 A H5'' H 1 4.05 0.03 . . . . . . 7 A H5'' . 17316 1 89 . 1 1 7 7 A H8 H 1 7.89 0.03 . 1 . . . . 7 A H8 . 17316 1 90 . 1 1 7 7 A C1' C 13 92.47 0.03 . 1 . . . . 7 A C1' . 17316 1 91 . 1 1 7 7 A C2 C 13 153.61 0.03 . 1 . . . . 7 A C2 . 17316 1 92 . 1 1 7 7 A C2' C 13 75.48 0.03 . 1 . . . . 7 A C2' . 17316 1 93 . 1 1 7 7 A C3' C 13 74.12 0.03 . 1 . . . . 7 A C3' . 17316 1 94 . 1 1 7 7 A C4' C 13 82.84 0.03 . 1 . . . . 7 A C4' . 17316 1 95 . 1 1 7 7 A C5' C 13 66.06 0.03 . 1 . . . . 7 A C5' . 17316 1 96 . 1 1 7 7 A C8 C 13 139.81 0.03 . 1 . . . . 7 A C8 . 17316 1 97 . 1 1 8 8 A H1' H 1 5.24 0.03 . 1 . . . . 8 A H1' . 17316 1 98 . 1 1 8 8 A H2 H 1 7.40 0.03 . 1 . . . . 8 A H2 . 17316 1 99 . 1 1 8 8 A H2' H 1 4.16 0.03 . 1 . . . . 8 A H2' . 17316 1 100 . 1 1 8 8 A H3' H 1 4.45 0.03 . 1 . . . . 8 A H3' . 17316 1 101 . 1 1 8 8 A H4' H 1 4.07 0.03 . 1 . . . . 8 A H4' . 17316 1 102 . 1 1 8 8 A H5' H 1 4.17 0.03 . . . . . . 8 A H5' . 17316 1 103 . 1 1 8 8 A H5'' H 1 3.97 0.03 . . . . . . 8 A H5'' . 17316 1 104 . 1 1 8 8 A H8 H 1 7.63 0.03 . 1 . . . . 8 A H8 . 17316 1 105 . 1 1 8 8 A C1' C 13 90.80 0.03 . 1 . . . . 8 A C1' . 17316 1 106 . 1 1 8 8 A C2 C 13 154.36 0.03 . 1 . . . . 8 A C2 . 17316 1 107 . 1 1 8 8 A C2' C 13 75.25 0.03 . 1 . . . . 8 A C2' . 17316 1 108 . 1 1 8 8 A C3' C 13 75.14 0.03 . 1 . . . . 8 A C3' . 17316 1 109 . 1 1 8 8 A C4' C 13 83.72 0.03 . 1 . . . . 8 A C4' . 17316 1 110 . 1 1 8 8 A C5' C 13 66.15 0.03 . 1 . . . . 8 A C5' . 17316 1 111 . 1 1 8 8 A C8 C 13 140.54 0.03 . 1 . . . . 8 A C8 . 17316 1 112 . 1 1 9 9 A H1' H 1 5.64 0.03 . 1 . . . . 9 A H1' . 17316 1 113 . 1 1 9 9 A H2 H 1 7.65 0.03 . 1 . . . . 9 A H2 . 17316 1 114 . 1 1 9 9 A H2' H 1 4.35 0.03 . 1 . . . . 9 A H2' . 17316 1 115 . 1 1 9 9 A H3' H 1 4.45 0.03 . 1 . . . . 9 A H3' . 17316 1 116 . 1 1 9 9 A H4' H 1 4.37 0.03 . 1 . . . . 9 A H4' . 17316 1 117 . 1 1 9 9 A H5' H 1 4.07 0.03 . . . . . . 9 A H5' . 17316 1 118 . 1 1 9 9 A H5'' H 1 3.95 0.03 . . . . . . 9 A H5'' . 17316 1 119 . 1 1 9 9 A H8 H 1 7.88 0.03 . 1 . . . . 9 A H8 . 17316 1 120 . 1 1 9 9 A C1' C 13 89.78 0.03 . 1 . . . . 9 A C1' . 17316 1 121 . 1 1 9 9 A C2 C 13 154.73 0.03 . 1 . . . . 9 A C2 . 17316 1 122 . 1 1 9 9 A C2' C 13 75.40 0.03 . 1 . . . . 9 A C2' . 17316 1 123 . 1 1 9 9 A C3' C 13 72.50 0.03 . 1 . . . . 9 A C3' . 17316 1 124 . 1 1 9 9 A C4' C 13 84.47 0.03 . 1 . . . . 9 A C4' . 17316 1 125 . 1 1 9 9 A C5' C 13 67.13 0.03 . 1 . . . . 9 A C5' . 17316 1 126 . 1 1 9 9 A C8 C 13 141.10 0.03 . 1 . . . . 9 A C8 . 17316 1 127 . 1 1 10 10 G H1' H 1 5.70 0.03 . 1 . . . . 10 G H1' . 17316 1 128 . 1 1 10 10 G H2' H 1 4.88 0.03 . 1 . . . . 10 G H2' . 17316 1 129 . 1 1 10 10 G H3' H 1 4.89 0.03 . 1 . . . . 10 G H3' . 17316 1 130 . 1 1 10 10 G H4' H 1 4.64 0.03 . 1 . . . . 10 G H4' . 17316 1 131 . 1 1 10 10 G H5' H 1 4.20 0.03 . . . . . . 10 G H5' . 17316 1 132 . 1 1 10 10 G H5'' H 1 4.13 0.03 . . . . . . 10 G H5'' . 17316 1 133 . 1 1 10 10 G H8 H 1 7.96 0.03 . 1 . . . . 10 G H8 . 17316 1 134 . 1 1 10 10 G C1' C 13 87.90 0.03 . 1 . . . . 10 G C1' . 17316 1 135 . 1 1 10 10 G C2' C 13 77.59 0.03 . 1 . . . . 10 G C2' . 17316 1 136 . 1 1 10 10 G C3' C 13 75.19 0.03 . 1 . . . . 10 G C3' . 17316 1 137 . 1 1 10 10 G C4' C 13 86.00 0.03 . 1 . . . . 10 G C4' . 17316 1 138 . 1 1 10 10 G C5' C 13 67.97 0.03 . 1 . . . . 10 G C5' . 17316 1 139 . 1 1 10 10 G C8 C 13 139.13 0.03 . 1 . . . . 10 G C8 . 17316 1 140 . 1 1 11 11 A H1' H 1 5.54 0.03 . 1 . . . . 11 A H1' . 17316 1 141 . 1 1 11 11 A H2 H 1 8.05 0.03 . 1 . . . . 11 A H2 . 17316 1 142 . 1 1 11 11 A H2' H 1 4.71 0.03 . 1 . . . . 11 A H2' . 17316 1 143 . 1 1 11 11 A H3' H 1 4.38 0.03 . 1 . . . . 11 A H3' . 17316 1 144 . 1 1 11 11 A H4' H 1 4.51 0.03 . 1 . . . . 11 A H4' . 17316 1 145 . 1 1 11 11 A H5' H 1 4.44 0.03 . . . . . . 11 A H5' . 17316 1 146 . 1 1 11 11 A H5'' H 1 4.21 0.03 . . . . . . 11 A H5'' . 17316 1 147 . 1 1 11 11 A H8 H 1 8.06 0.03 . 1 . . . . 11 A H8 . 17316 1 148 . 1 1 11 11 A C1' C 13 92.45 0.03 . 1 . . . . 11 A C1' . 17316 1 149 . 1 1 11 11 A C2 C 13 155.02 0.03 . 1 . . . . 11 A C2 . 17316 1 150 . 1 1 11 11 A C2' C 13 75.48 0.03 . 1 . . . . 11 A C2' . 17316 1 151 . 1 1 11 11 A C3' C 13 73.19 0.03 . 1 . . . . 11 A C3' . 17316 1 152 . 1 1 11 11 A C4' C 13 82.75 0.03 . 1 . . . . 11 A C4' . 17316 1 153 . 1 1 11 11 A C5' C 13 66.29 0.03 . 1 . . . . 11 A C5' . 17316 1 154 . 1 1 11 11 A C8 C 13 140.34 0.03 . 1 . . . . 11 A C8 . 17316 1 155 . 1 1 12 12 U H1' H 1 4.61 0.03 . 1 . . . . 12 U H1' . 17316 1 156 . 1 1 12 12 U H2' H 1 4.22 0.03 . 1 . . . . 12 U H2' . 17316 1 157 . 1 1 12 12 U H3 H 1 10.85 0.03 . 1 . . . . 12 U H3 . 17316 1 158 . 1 1 12 12 U H3' H 1 4.23 0.03 . 1 . . . . 12 U H3' . 17316 1 159 . 1 1 12 12 U H4' H 1 4.59 0.03 . 1 . . . . 12 U H4' . 17316 1 160 . 1 1 12 12 U H5 H 1 5.50 0.03 . 1 . . . . 12 U H5 . 17316 1 161 . 1 1 12 12 U H5' H 1 4.30 0.03 . . . . . . 12 U H5' . 17316 1 162 . 1 1 12 12 U H5'' H 1 4.05 0.03 . . . . . . 12 U H5'' . 17316 1 163 . 1 1 12 12 U H6 H 1 7.36 0.03 . 1 . . . . 12 U H6 . 17316 1 164 . 1 1 12 12 U C1' C 13 93.80 0.03 . 1 . . . . 12 U C1' . 17316 1 165 . 1 1 12 12 U C2' C 13 74.71 0.03 . 1 . . . . 12 U C2' . 17316 1 166 . 1 1 12 12 U C3' C 13 72.35 0.03 . 1 . . . . 12 U C3' . 17316 1 167 . 1 1 12 12 U C4' C 13 83.23 0.03 . 1 . . . . 12 U C4' . 17316 1 168 . 1 1 12 12 U C5 C 13 103.74 0.03 . 1 . . . . 12 U C5 . 17316 1 169 . 1 1 12 12 U C5' C 13 64.89 0.03 . 1 . . . . 12 U C5' . 17316 1 170 . 1 1 12 12 U C6 C 13 141.41 0.03 . 1 . . . . 12 U C6 . 17316 1 171 . 1 1 12 12 U N3 N 15 156.90 0.06 . 1 . . . . 12 U N3 . 17316 1 172 . 1 1 13 13 U H1' H 1 5.63 0.03 . 1 . . . . 13 U H1' . 17316 1 173 . 1 1 13 13 U H2' H 1 4.54 0.03 . 1 . . . . 13 U H2' . 17316 1 174 . 1 1 13 13 U H3 H 1 14.09 0.03 . 1 . . . . 13 U H3 . 17316 1 175 . 1 1 13 13 U H3' H 1 4.62 0.03 . 1 . . . . 13 U H3' . 17316 1 176 . 1 1 13 13 U H4' H 1 4.37 0.03 . 1 . . . . 13 U H4' . 17316 1 177 . 1 1 13 13 U H5 H 1 5.63 0.03 . 1 . . . . 13 U H5 . 17316 1 178 . 1 1 13 13 U H5' H 1 4.44 0.03 . . . . . . 13 U H5' . 17316 1 179 . 1 1 13 13 U H5'' H 1 4.07 0.03 . . . . . . 13 U H5'' . 17316 1 180 . 1 1 13 13 U H6 H 1 7.93 0.03 . 1 . . . . 13 U H6 . 17316 1 181 . 1 1 13 13 U C1' C 13 92.31 0.03 . 1 . . . . 13 U C1' . 17316 1 182 . 1 1 13 13 U C2' C 13 75.57 0.03 . 1 . . . . 13 U C2' . 17316 1 183 . 1 1 13 13 U C3' C 13 73.47 0.03 . 1 . . . . 13 U C3' . 17316 1 184 . 1 1 13 13 U C4' C 13 82.47 0.03 . 1 . . . . 13 U C4' . 17316 1 185 . 1 1 13 13 U C5 C 13 153.74 0.03 . 1 . . . . 13 U C5 . 17316 1 186 . 1 1 13 13 U C5' C 13 64.61 0.03 . 1 . . . . 13 U C5' . 17316 1 187 . 1 1 13 13 U C6 C 13 169.95 0.03 . 1 . . . . 13 U C6 . 17316 1 188 . 1 1 13 13 U N3 N 15 162.74 0.06 . 1 . . . . 13 U N3 . 17316 1 189 . 1 1 14 14 G H1 H 1 11.30 0.03 . 1 . . . . 14 G H1 . 17316 1 190 . 1 1 14 14 G H1' H 1 5.74 0.03 . 1 . . . . 14 G H1' . 17316 1 191 . 1 1 14 14 G H2' H 1 4.58 0.03 . 1 . . . . 14 G H2' . 17316 1 192 . 1 1 14 14 G H3' H 1 4.55 0.03 . 1 . . . . 14 G H3' . 17316 1 193 . 1 1 14 14 G H4' H 1 4.51 0.03 . 1 . . . . 14 G H4' . 17316 1 194 . 1 1 14 14 G H5' H 1 4.44 0.03 . . . . . . 14 G H5' . 17316 1 195 . 1 1 14 14 G H5'' H 1 4.21 0.03 . . . . . . 14 G H5'' . 17316 1 196 . 1 1 14 14 G H8 H 1 7.72 0.03 . 1 . . . . 14 G H8 . 17316 1 197 . 1 1 14 14 G C1' C 13 92.61 0.03 . 1 . . . . 14 G C1' . 17316 1 198 . 1 1 14 14 G C2' C 13 75.25 0.03 . 1 . . . . 14 G C2' . 17316 1 199 . 1 1 14 14 G C3' C 13 73.38 0.03 . 1 . . . . 14 G C3' . 17316 1 200 . 1 1 14 14 G C4' C 13 82.23 0.03 . 1 . . . . 14 G C4' . 17316 1 201 . 1 1 14 14 G C5' C 13 66.76 0.03 . 1 . . . . 14 G C5' . 17316 1 202 . 1 1 14 14 G C8 C 13 137.00 0.03 . 1 . . . . 14 G C8 . 17316 1 203 . 1 1 14 14 G N1 N 15 145.20 0.06 . 1 . . . . 14 G N1 . 17316 1 204 . 1 1 15 15 A H1' H 1 5.83 0.03 . 1 . . . . 15 A H1' . 17316 1 205 . 1 1 15 15 A H2 H 1 7.31 0.03 . 1 . . . . 15 A H2 . 17316 1 206 . 1 1 15 15 A H2' H 1 4.53 0.03 . 1 . . . . 15 A H2' . 17316 1 207 . 1 1 15 15 A H3' H 1 4.60 0.03 . 1 . . . . 15 A H3' . 17316 1 208 . 1 1 15 15 A H4' H 1 4.44 0.03 . 1 . . . . 15 A H4' . 17316 1 209 . 1 1 15 15 A H8 H 1 7.67 0.03 . 1 . . . . 15 A H8 . 17316 1 210 . 1 1 15 15 A C1' C 13 92.71 0.03 . 1 . . . . 15 A C1' . 17316 1 211 . 1 1 15 15 A C2 C 13 153.05 0.03 . 1 . . . . 15 A C2 . 17316 1 212 . 1 1 15 15 A C2' C 13 76.01 0.03 . 1 . . . . 15 A C2' . 17316 1 213 . 1 1 15 15 A C3' C 13 76.15 0.03 . 1 . . . . 15 A C3' . 17316 1 214 . 1 1 15 15 A C4' C 13 76.15 0.03 . 1 . . . . 15 A C4' . 17316 1 215 . 1 1 15 15 A C8 C 13 139.17 0.03 . 1 . . . . 15 A C8 . 17316 1 216 . 1 1 16 16 G H1 H 1 12.69 0.03 . 1 . . . . 16 G H1 . 17316 1 217 . 1 1 16 16 G H1' H 1 5.37 0.03 . 1 . . . . 16 G H1' . 17316 1 218 . 1 1 16 16 G H2' H 1 4.37 0.03 . 1 . . . . 16 G H2' . 17316 1 219 . 1 1 16 16 G H4' H 1 4.16 0.03 . 1 . . . . 16 G H4' . 17316 1 220 . 1 1 16 16 G H8 H 1 6.88 0.03 . 1 . . . . 16 G H8 . 17316 1 221 . 1 1 16 16 G C1' C 13 93.05 0.03 . 1 . . . . 16 G C1' . 17316 1 222 . 1 1 16 16 G C2' C 13 74.68 0.03 . 1 . . . . 16 G C2' . 17316 1 223 . 1 1 16 16 G C3' C 13 71.97 0.03 . 1 . . . . 16 G C3' . 17316 1 224 . 1 1 16 16 G C4' C 13 81.15 0.03 . 1 . . . . 16 G C4' . 17316 1 225 . 1 1 16 16 G C8 C 13 141.26 0.03 . 1 . . . . 16 G C8 . 17316 1 226 . 1 1 16 16 G N1 N 15 147.38 0.06 . 1 . . . . 16 G N1 . 17316 1 227 . 1 1 17 17 A H1' H 1 5.76 0.03 . 1 . . . . 17 A H1' . 17316 1 228 . 1 1 17 17 A H2 H 1 8.06 0.03 . 1 . . . . 17 A H2 . 17316 1 229 . 1 1 17 17 A H2' H 1 4.44 0.03 . 1 . . . . 17 A H2' . 17316 1 230 . 1 1 17 17 A H3' H 1 4.28 0.03 . 1 . . . . 17 A H3' . 17316 1 231 . 1 1 17 17 A H8 H 1 7.71 0.03 . 1 . . . . 17 A H8 . 17316 1 232 . 1 1 17 17 A C1' C 13 91.96 0.03 . 1 . . . . 17 A C1' . 17316 1 233 . 1 1 17 17 A C2 C 13 154.66 0.03 . 1 . . . . 17 A C2 . 17316 1 234 . 1 1 17 17 A C2' C 13 76.76 0.03 . 1 . . . . 17 A C2' . 17316 1 235 . 1 1 17 17 A C3' C 13 75.92 0.03 . 1 . . . . 17 A C3' . 17316 1 236 . 1 1 17 17 A C8 C 13 139.85 0.03 . 1 . . . . 17 A C8 . 17316 1 237 . 1 1 18 18 C H1' H 1 5.33 0.03 . 1 . . . . 18 C H1' . 17316 1 238 . 1 1 18 18 C H2' H 1 4.29 0.03 . 1 . . . . 18 C H2' . 17316 1 239 . 1 1 18 18 C H3' H 1 4.16 0.03 . 1 . . . . 18 C H3' . 17316 1 240 . 1 1 18 18 C H5 H 1 5.03 0.03 . 1 . . . . 18 C H5 . 17316 1 241 . 1 1 18 18 C H6 H 1 7.18 0.03 . 1 . . . . 18 C H6 . 17316 1 242 . 1 1 18 18 C C1' C 13 91.96 0.03 . 1 . . . . 18 C C1' . 17316 1 243 . 1 1 18 18 C C2' C 13 76.76 0.03 . 1 . . . . 18 C C2' . 17316 1 244 . 1 1 18 18 C C3' C 13 75.92 0.03 . 1 . . . . 18 C C3' . 17316 1 245 . 1 1 18 18 C C5 C 13 96.40 0.03 . 1 . . . . 18 C C5 . 17316 1 246 . 1 1 18 18 C C6 C 13 141.75 0.03 . 1 . . . . 18 C C6 . 17316 1 247 . 1 1 19 19 A H1' H 1 5.75 0.03 . 1 . . . . 19 A H1' . 17316 1 248 . 1 1 19 19 A H2 H 1 7.50 0.03 . 1 . . . . 19 A H2 . 17316 1 249 . 1 1 19 19 A H3' H 1 4.58 0.03 . 1 . . . . 19 A H3' . 17316 1 250 . 1 1 19 19 A H4' H 1 4.47 0.03 . 1 . . . . 19 A H4' . 17316 1 251 . 1 1 19 19 A H8 H 1 7.92 0.03 . 1 . . . . 19 A H8 . 17316 1 252 . 1 1 19 19 A C1' C 13 89.26 0.03 . 1 . . . . 19 A C1' . 17316 1 253 . 1 1 19 19 A C2 C 13 154.88 0.03 . 1 . . . . 19 A C2 . 17316 1 254 . 1 1 19 19 A C3' C 13 76.11 0.03 . 1 . . . . 19 A C3' . 17316 1 255 . 1 1 19 19 A C4' C 13 85.06 0.03 . 1 . . . . 19 A C4' . 17316 1 256 . 1 1 19 19 A C8 C 13 141.90 0.03 . 1 . . . . 19 A C8 . 17316 1 257 . 1 1 20 20 A H1' H 1 5.68 0.03 . 1 . . . . 20 A H1' . 17316 1 258 . 1 1 20 20 A H2 H 1 7.76 0.03 . 1 . . . . 20 A H2 . 17316 1 259 . 1 1 20 20 A H2' H 1 4.19 0.03 . 1 . . . . 20 A H2' . 17316 1 260 . 1 1 20 20 A H3' H 1 4.64 0.03 . 1 . . . . 20 A H3' . 17316 1 261 . 1 1 20 20 A H4' H 1 4.58 0.03 . 1 . . . . 20 A H4' . 17316 1 262 . 1 1 20 20 A H5' H 1 4.18 0.03 . . . . . . 20 A H5' . 17316 1 263 . 1 1 20 20 A H5'' H 1 4.15 0.03 . . . . . . 20 A H5'' . 17316 1 264 . 1 1 20 20 A H8 H 1 7.91 0.03 . 1 . . . . 20 A H8 . 17316 1 265 . 1 1 20 20 A C1' C 13 88.48 0.03 . 1 . . . . 20 A C1' . 17316 1 266 . 1 1 20 20 A C2 C 13 155.25 0.03 . 1 . . . . 20 A C2 . 17316 1 267 . 1 1 20 20 A C2' C 13 74.95 0.03 . 1 . . . . 20 A C2' . 17316 1 268 . 1 1 20 20 A C4' C 13 85.08 0.03 . 1 . . . . 20 A C4' . 17316 1 269 . 1 1 20 20 A C5' C 13 66.57 0.03 . 1 . . . . 20 A C5' . 17316 1 270 . 1 1 20 20 A C8 C 13 140.33 0.03 . 1 . . . . 20 A C8 . 17316 1 271 . 1 1 21 21 G H1' H 1 5.85 0.03 . 1 . . . . 21 G H1' . 17316 1 272 . 1 1 21 21 G H2' H 1 4.80 0.03 . 1 . . . . 21 G H2' . 17316 1 273 . 1 1 21 21 G H3' H 1 4.78 0.03 . 1 . . . . 21 G H3' . 17316 1 274 . 1 1 21 21 G H4' H 1 4.52 0.03 . 1 . . . . 21 G H4' . 17316 1 275 . 1 1 21 21 G H5' H 1 4.27 0.03 . . . . . . 21 G H5' . 17316 1 276 . 1 1 21 21 G H5'' H 1 4.06 0.03 . . . . . . 21 G H5'' . 17316 1 277 . 1 1 21 21 G H8 H 1 8.00 0.03 . 1 . . . . 21 G H8 . 17316 1 278 . 1 1 21 21 G C1' C 13 84.94 0.03 . 1 . . . . 21 G C1' . 17316 1 279 . 1 1 21 21 G C2' C 13 78.43 0.03 . 1 . . . . 21 G C2' . 17316 1 280 . 1 1 21 21 G C3' C 13 73.35 0.03 . 1 . . . . 21 G C3' . 17316 1 281 . 1 1 21 21 G C4' C 13 83.71 0.03 . 1 . . . . 21 G C4' . 17316 1 282 . 1 1 21 21 G C5' C 13 68.00 0.03 . 1 . . . . 21 G C5' . 17316 1 283 . 1 1 21 21 G C8 C 13 138.60 0.03 . 1 . . . . 21 G C8 . 17316 1 284 . 1 1 22 22 U H1' H 1 5.40 0.03 . 1 . . . . 22 U H1' . 17316 1 285 . 1 1 22 22 U H2' H 1 4.60 0.03 . 1 . . . . 22 U H2' . 17316 1 286 . 1 1 22 22 U H3' H 1 4.74 0.03 . 1 . . . . 22 U H3' . 17316 1 287 . 1 1 22 22 U H4' H 1 4.45 0.03 . 1 . . . . 22 U H4' . 17316 1 288 . 1 1 22 22 U H5 H 1 5.81 0.03 . 1 . . . . 22 U H5 . 17316 1 289 . 1 1 22 22 U H5' H 1 4.51 0.03 . . . . . . 22 U H5' . 17316 1 290 . 1 1 22 22 U H5'' H 1 4.08 0.03 . . . . . . 22 U H5'' . 17316 1 291 . 1 1 22 22 U H6 H 1 7.92 0.03 . 1 . . . . 22 U H6 . 17316 1 292 . 1 1 22 22 U C1' C 13 94.01 0.03 . 1 . . . . 22 U C1' . 17316 1 293 . 1 1 22 22 U C2' C 13 74.68 0.03 . 1 . . . . 22 U C2' . 17316 1 294 . 1 1 22 22 U C3' C 13 74.35 0.03 . 1 . . . . 22 U C3' . 17316 1 295 . 1 1 22 22 U C4' C 13 82.90 0.03 . 1 . . . . 22 U C4' . 17316 1 296 . 1 1 22 22 U C5 C 13 102.84 0.03 . 1 . . . . 22 U C5 . 17316 1 297 . 1 1 22 22 U C5' C 13 63.13 0.03 . 1 . . . . 22 U C5' . 17316 1 298 . 1 1 22 22 U C6 C 13 142.99 0.03 . 1 . . . . 22 U C6 . 17316 1 299 . 1 1 23 23 A H1' H 1 5.83 0.03 . 1 . . . . 23 A H1' . 17316 1 300 . 1 1 23 23 A H2 H 1 7.00 0.03 . 1 . . . . 23 A H2 . 17316 1 301 . 1 1 23 23 A H2' H 1 4.72 0.03 . 1 . . . . 23 A H2' . 17316 1 302 . 1 1 23 23 A H3' H 1 4.55 0.03 . 1 . . . . 23 A H3' . 17316 1 303 . 1 1 23 23 A H4' H 1 4.48 0.03 . 1 . . . . 23 A H4' . 17316 1 304 . 1 1 23 23 A H5' H 1 4.17 0.03 . . . . . . 23 A H5' . 17316 1 305 . 1 1 23 23 A H5'' H 1 4.03 0.03 . . . . . . 23 A H5'' . 17316 1 306 . 1 1 23 23 A H8 H 1 7.56 0.03 . 1 . . . . 23 A H8 . 17316 1 307 . 1 1 23 23 A C1' C 13 91.54 0.03 . 1 . . . . 23 A C1' . 17316 1 308 . 1 1 23 23 A C2 C 13 153.74 0.03 . 1 . . . . 23 A C2 . 17316 1 309 . 1 1 23 23 A C2' C 13 74.73 0.03 . 1 . . . . 23 A C2' . 17316 1 310 . 1 1 23 23 A C3' C 13 74.52 0.03 . 1 . . . . 23 A C3' . 17316 1 311 . 1 1 23 23 A C4' C 13 81.41 0.03 . 1 . . . . 23 A C4' . 17316 1 312 . 1 1 23 23 A C5' C 13 65.42 0.03 . 1 . . . . 23 A C5' . 17316 1 313 . 1 1 23 23 A C8 C 13 139.34 0.03 . 1 . . . . 23 A C8 . 17316 1 314 . 1 1 24 24 G H1 H 1 12.56 0.03 . 1 . . . . 24 G H1 . 17316 1 315 . 1 1 24 24 G H1' H 1 4.19 0.03 . 1 . . . . 24 G H1' . 17316 1 316 . 1 1 24 24 G H3' H 1 4.46 0.03 . 1 . . . . 24 G H3' . 17316 1 317 . 1 1 24 24 G H4' H 1 4.23 0.03 . 1 . . . . 24 G H4' . 17316 1 318 . 1 1 24 24 G H8 H 1 7.37 0.03 . 1 . . . . 24 G H8 . 17316 1 319 . 1 1 24 24 G C1' C 13 91.25 0.03 . 1 . . . . 24 G C1' . 17316 1 320 . 1 1 24 24 G C3' C 13 71.82 0.03 . 1 . . . . 24 G C3' . 17316 1 321 . 1 1 24 24 G C4' C 13 80.94 0.03 . 1 . . . . 24 G C4' . 17316 1 322 . 1 1 24 24 G C8 C 13 136.15 0.03 . 1 . . . . 24 G C8 . 17316 1 323 . 1 1 24 24 G N1 N 15 147.88 0.06 . 1 . . . . 24 G N1 . 17316 1 324 . 1 1 25 25 G H1 H 1 12.18 0.03 . 1 . . . . 25 G H1 . 17316 1 325 . 1 1 25 25 G H1' H 1 5.61 0.03 . 1 . . . . 25 G H1' . 17316 1 326 . 1 1 25 25 G H2' H 1 4.48 0.03 . 1 . . . . 25 G H2' . 17316 1 327 . 1 1 25 25 G H3' H 1 4.33 0.03 . 1 . . . . 25 G H3' . 17316 1 328 . 1 1 25 25 G H4' H 1 4.40 0.03 . 1 . . . . 25 G H4' . 17316 1 329 . 1 1 25 25 G H5' H 1 4.39 0.03 . . . . . . 25 G H5' . 17316 1 330 . 1 1 25 25 G H5'' H 1 3.96 0.03 . . . . . . 25 G H5'' . 17316 1 331 . 1 1 25 25 G H8 H 1 6.97 0.03 . 1 . . . . 25 G H8 . 17316 1 332 . 1 1 25 25 G C1' C 13 92.16 0.03 . 1 . . . . 25 G C1' . 17316 1 333 . 1 1 25 25 G C2' C 13 74.60 0.03 . 1 . . . . 25 G C2' . 17316 1 334 . 1 1 25 25 G C3' C 13 71.70 0.03 . 1 . . . . 25 G C3' . 17316 1 335 . 1 1 25 25 G C4' C 13 81.10 0.03 . 1 . . . . 25 G C4' . 17316 1 336 . 1 1 25 25 G C5' C 13 64.02 0.03 . 1 . . . . 25 G C5' . 17316 1 337 . 1 1 25 25 G C8 C 13 136.20 0.03 . 1 . . . . 25 G C8 . 17316 1 338 . 1 1 25 25 G N1 N 15 147.28 0.06 . 1 . . . . 25 G N1 . 17316 1 339 . 1 1 26 26 A H1' H 1 5.96 0.03 . 1 . . . . 26 A H1' . 17316 1 340 . 1 1 26 26 A H2 H 1 7.91 0.03 . 1 . . . . 26 A H2 . 17316 1 341 . 1 1 26 26 A H2' H 1 4.56 0.03 . 1 . . . . 26 A H2' . 17316 1 342 . 1 1 26 26 A H4' H 1 4.43 0.03 . 1 . . . . 26 A H4' . 17316 1 343 . 1 1 26 26 A H5' H 1 4.53 0.03 . . . . . . 26 A H5' . 17316 1 344 . 1 1 26 26 A H5'' H 1 4.07 0.03 . . . . . . 26 A H5'' . 17316 1 345 . 1 1 26 26 A H8 H 1 7.75 0.03 . 1 . . . . 26 A H8 . 17316 1 346 . 1 1 26 26 A C1' C 13 91.96 0.03 . 1 . . . . 26 A C1' . 17316 1 347 . 1 1 26 26 A C2 C 13 155.42 0.03 . 1 . . . . 26 A C2 . 17316 1 348 . 1 1 26 26 A C2' C 13 74.76 0.03 . 1 . . . . 26 A C2' . 17316 1 349 . 1 1 26 26 A C4' C 13 81.40 0.03 . 1 . . . . 26 A C4' . 17316 1 350 . 1 1 26 26 A C5' C 13 63.96 0.03 . 1 . . . . 26 A C5' . 17316 1 351 . 1 1 26 26 A C8 C 13 139.63 0.03 . 1 . . . . 26 A C8 . 17316 1 352 . 1 1 27 27 C H1' H 1 5.30 0.03 . 1 . . . . 27 C H1' . 17316 1 353 . 1 1 27 27 C H2' H 1 4.34 0.03 . 1 . . . . 27 C H2' . 17316 1 354 . 1 1 27 27 C H3' H 1 4.09 0.03 . 1 . . . . 27 C H3' . 17316 1 355 . 1 1 27 27 C H4' H 1 4.38 0.03 . 1 . . . . 27 C H4' . 17316 1 356 . 1 1 27 27 C H5 H 1 5.12 0.03 . 1 . . . . 27 C H5 . 17316 1 357 . 1 1 27 27 C H5' H 1 4.38 0.03 . . . . . . 27 C H5' . 17316 1 358 . 1 1 27 27 C H5'' H 1 3.97 0.03 . . . . . . 27 C H5'' . 17316 1 359 . 1 1 27 27 C H6 H 1 7.14 0.03 . 1 . . . . 27 C H6 . 17316 1 360 . 1 1 27 27 C C1' C 13 92.97 0.03 . 1 . . . . 27 C C1' . 17316 1 361 . 1 1 27 27 C C2' C 13 74.68 0.03 . 1 . . . . 27 C C2' . 17316 1 362 . 1 1 27 27 C C3' C 13 71.36 0.03 . 1 . . . . 27 C C3' . 17316 1 363 . 1 1 27 27 C C4' C 13 81.06 0.03 . 1 . . . . 27 C C4' . 17316 1 364 . 1 1 27 27 C C5 C 13 96.57 0.03 . 1 . . . . 27 C C5 . 17316 1 365 . 1 1 27 27 C C5' C 13 64.18 0.03 . 1 . . . . 27 C C5' . 17316 1 366 . 1 1 27 27 C C6 C 13 140.48 0.03 . 1 . . . . 27 C C6 . 17316 1 367 . 1 1 28 28 U H1' H 1 5.63 0.03 . 1 . . . . 28 U H1' . 17316 1 368 . 1 1 28 28 U H2' H 1 3.76 0.03 . 1 . . . . 28 U H2' . 17316 1 369 . 1 1 28 28 U H3 H 1 11.72 0.03 . 1 . . . . 28 U H3 . 17316 1 370 . 1 1 28 28 U H3' H 1 4.49 0.03 . 1 . . . . 28 U H3' . 17316 1 371 . 1 1 28 28 U H4' H 1 4.33 0.03 . 1 . . . . 28 U H4' . 17316 1 372 . 1 1 28 28 U H5 H 1 5.58 0.03 . 1 . . . . 28 U H5 . 17316 1 373 . 1 1 28 28 U H5' H 1 4.46 0.03 . . . . . . 28 U H5' . 17316 1 374 . 1 1 28 28 U H5'' H 1 4.04 0.03 . . . . . . 28 U H5'' . 17316 1 375 . 1 1 28 28 U H6 H 1 7.70 0.03 . 1 . . . . 28 U H6 . 17316 1 376 . 1 1 28 28 U C1' C 13 93.60 0.03 . 1 . . . . 28 U C1' . 17316 1 377 . 1 1 28 28 U C2' C 13 76.06 0.03 . 1 . . . . 28 U C2' . 17316 1 378 . 1 1 28 28 U C3' C 13 72.24 0.03 . 1 . . . . 28 U C3' . 17316 1 379 . 1 1 28 28 U C4' C 13 81.58 0.03 . 1 . . . . 28 U C4' . 17316 1 380 . 1 1 28 28 U C5 C 13 104.09 0.03 . 1 . . . . 28 U C5 . 17316 1 381 . 1 1 28 28 U C5' C 13 63.06 0.03 . 1 . . . . 28 U C5' . 17316 1 382 . 1 1 28 28 U C6 C 13 141.03 0.03 . 1 . . . . 28 U C6 . 17316 1 383 . 1 1 28 28 U N3 N 15 156.68 0.06 . 1 . . . . 28 U N3 . 17316 1 384 . 1 1 29 29 U H1' H 1 6.07 0.03 . 1 . . . . 29 U H1' . 17316 1 385 . 1 1 29 29 U H2' H 1 4.63 0.03 . 1 . . . . 29 U H2' . 17316 1 386 . 1 1 29 29 U H3' H 1 4.00 0.03 . 1 . . . . 29 U H3' . 17316 1 387 . 1 1 29 29 U H4' H 1 4.46 0.03 . 1 . . . . 29 U H4' . 17316 1 388 . 1 1 29 29 U H5 H 1 5.83 0.03 . 1 . . . . 29 U H5 . 17316 1 389 . 1 1 29 29 U H5' H 1 4.21 0.03 . . . . . . 29 U H5' . 17316 1 390 . 1 1 29 29 U H5'' H 1 4.02 0.03 . . . . . . 29 U H5'' . 17316 1 391 . 1 1 29 29 U H6 H 1 8.00 0.03 . 1 . . . . 29 U H6 . 17316 1 392 . 1 1 29 29 U C1' C 13 88.38 0.03 . 1 . . . . 29 U C1' . 17316 1 393 . 1 1 29 29 U C2' C 13 73.72 0.03 . 1 . . . . 29 U C2' . 17316 1 394 . 1 1 29 29 U C3' C 13 76.96 0.03 . 1 . . . . 29 U C3' . 17316 1 395 . 1 1 29 29 U C4' C 13 86.13 0.03 . 1 . . . . 29 U C4' . 17316 1 396 . 1 1 29 29 U C5 C 13 104.63 0.03 . 1 . . . . 29 U C5 . 17316 1 397 . 1 1 29 29 U C5' C 13 66.91 0.03 . 1 . . . . 29 U C5' . 17316 1 398 . 1 1 29 29 U C6 C 13 144.94 0.03 . 1 . . . . 29 U C6 . 17316 1 399 . 1 1 30 30 C H1' H 1 5.94 0.03 . 1 . . . . 30 C H1' . 17316 1 400 . 1 1 30 30 C H2' H 1 4.07 0.03 . 1 . . . . 30 C H2' . 17316 1 401 . 1 1 30 30 C H3' H 1 4.46 0.03 . 1 . . . . 30 C H3' . 17316 1 402 . 1 1 30 30 C H4' H 1 3.78 0.03 . 1 . . . . 30 C H4' . 17316 1 403 . 1 1 30 30 C H5 H 1 6.08 0.03 . 1 . . . . 30 C H5 . 17316 1 404 . 1 1 30 30 C H5' H 1 3.58 0.03 . . . . . . 30 C H5' . 17316 1 405 . 1 1 30 30 C H5'' H 1 2.70 0.03 . . . . . . 30 C H5'' . 17316 1 406 . 1 1 30 30 C H6 H 1 7.67 0.03 . 1 . . . . 30 C H6 . 17316 1 407 . 1 1 30 30 C C1' C 13 88.25 0.03 . 1 . . . . 30 C C1' . 17316 1 408 . 1 1 30 30 C C2' C 13 76.78 0.03 . 1 . . . . 30 C C2' . 17316 1 409 . 1 1 30 30 C C3' C 13 79.40 0.03 . 1 . . . . 30 C C3' . 17316 1 410 . 1 1 30 30 C C4' C 13 83.68 0.03 . 1 . . . . 30 C C4' . 17316 1 411 . 1 1 30 30 C C5 C 13 97.64 0.03 . 1 . . . . 30 C C5 . 17316 1 412 . 1 1 30 30 C C5' C 13 66.47 0.03 . 1 . . . . 30 C C5' . 17316 1 413 . 1 1 30 30 C C6 C 13 143.10 0.03 . 1 . . . . 30 C C6 . 17316 1 414 . 1 1 31 31 G H1 H 1 9.84 0.03 . 1 . . . . 31 G H1 . 17316 1 415 . 1 1 31 31 G H1' H 1 5.94 0.03 . 1 . . . . 31 G H1' . 17316 1 416 . 1 1 31 31 G H2' H 1 4.82 0.03 . 1 . . . . 31 G H2' . 17316 1 417 . 1 1 31 31 G H3' H 1 5.61 0.03 . 1 . . . . 31 G H3' . 17316 1 418 . 1 1 31 31 G H4' H 1 4.39 0.03 . 1 . . . . 31 G H4' . 17316 1 419 . 1 1 31 31 G H5' H 1 4.40 0.03 . . . . . . 31 G H5' . 17316 1 420 . 1 1 31 31 G H5'' H 1 4.18 0.03 . . . . . . 31 G H5'' . 17316 1 421 . 1 1 31 31 G H8 H 1 7.82 0.03 . 1 . . . . 31 G H8 . 17316 1 422 . 1 1 31 31 G C1' C 13 93.67 0.03 . 1 . . . . 31 G C1' . 17316 1 423 . 1 1 31 31 G C2' C 13 76.43 0.03 . 1 . . . . 31 G C2' . 17316 1 424 . 1 1 31 31 G C3' C 13 75.03 0.03 . 1 . . . . 31 G C3' . 17316 1 425 . 1 1 31 31 G C4' C 13 82.37 0.03 . 1 . . . . 31 G C4' . 17316 1 426 . 1 1 31 31 G C5' C 13 68.13 0.03 . 1 . . . . 31 G C5' . 17316 1 427 . 1 1 31 31 G C8 C 13 143.17 0.03 . 1 . . . . 31 G C8 . 17316 1 428 . 1 1 31 31 G N1 N 15 143.00 0.06 . 1 . . . . 31 G N1 . 17316 1 429 . 1 1 32 32 G H1 H 1 13.45 0.03 . 1 . . . . 32 G H1 . 17316 1 430 . 1 1 32 32 G H1' H 1 4.40 0.03 . 1 . . . . 32 G H1' . 17316 1 431 . 1 1 32 32 G H3' H 1 4.21 0.03 . 1 . . . . 32 G H3' . 17316 1 432 . 1 1 32 32 G H8 H 1 8.30 0.03 . 1 . . . . 32 G H8 . 17316 1 433 . 1 1 32 32 G C1' C 13 92.35 0.03 . 1 . . . . 32 G C1' . 17316 1 434 . 1 1 32 32 G C3' C 13 75.17 0.03 . 1 . . . . 32 G C3' . 17316 1 435 . 1 1 32 32 G C8 C 13 139.26 0.03 . 1 . . . . 32 G C8 . 17316 1 436 . 1 1 32 32 G N1 N 15 147.99 0.06 . 1 . . . . 32 G N1 . 17316 1 437 . 1 1 33 33 U H1' H 1 5.52 0.03 . 1 . . . . 33 U H1' . 17316 1 438 . 1 1 33 33 U H2' H 1 4.49 0.03 . 1 . . . . 33 U H2' . 17316 1 439 . 1 1 33 33 U H3 H 1 14.37 0.03 . 1 . . . . 33 U H3 . 17316 1 440 . 1 1 33 33 U H3' H 1 4.44 0.03 . 1 . . . . 33 U H3' . 17316 1 441 . 1 1 33 33 U H4' H 1 4.50 0.03 . 1 . . . . 33 U H4' . 17316 1 442 . 1 1 33 33 U H5 H 1 5.08 0.03 . 1 . . . . 33 U H5 . 17316 1 443 . 1 1 33 33 U H5' H 1 4.35 0.03 . . . . . . 33 U H5' . 17316 1 444 . 1 1 33 33 U H5'' H 1 4.19 0.03 . . . . . . 33 U H5'' . 17316 1 445 . 1 1 33 33 U H6 H 1 7.76 0.03 . 1 . . . . 33 U H6 . 17316 1 446 . 1 1 33 33 U C1' C 13 92.99 0.03 . 1 . . . . 33 U C1' . 17316 1 447 . 1 1 33 33 U C2' C 13 74.50 0.03 . 1 . . . . 33 U C2' . 17316 1 448 . 1 1 33 33 U C3' C 13 71.05 0.03 . 1 . . . . 33 U C3' . 17316 1 449 . 1 1 33 33 U C4' C 13 82.08 0.03 . 1 . . . . 33 U C4' . 17316 1 450 . 1 1 33 33 U C5 C 13 101.40 0.03 . 1 . . . . 33 U C5 . 17316 1 451 . 1 1 33 33 U C5' C 13 66.56 0.03 . 1 . . . . 33 U C5' . 17316 1 452 . 1 1 33 33 U C6 C 13 142.34 0.03 . 1 . . . . 33 U C6 . 17316 1 453 . 1 1 33 33 U N3 N 15 162.74 0.06 . 1 . . . . 33 U N3 . 17316 1 454 . 1 1 34 34 C H1' H 1 5.51 0.03 . 1 . . . . 34 C H1' . 17316 1 455 . 1 1 34 34 C H2' H 1 4.35 0.03 . 1 . . . . 34 C H2' . 17316 1 456 . 1 1 34 34 C H3' H 1 4.34 0.03 . 1 . . . . 34 C H3' . 17316 1 457 . 1 1 34 34 C H4' H 1 4.35 0.03 . 1 . . . . 34 C H4' . 17316 1 458 . 1 1 34 34 C H5 H 1 5.59 0.03 . 1 . . . . 34 C H5 . 17316 1 459 . 1 1 34 34 C H5' H 1 4.45 0.03 . . . . . . 34 C H5' . 17316 1 460 . 1 1 34 34 C H5'' H 1 4.03 0.03 . . . . . . 34 C H5'' . 17316 1 461 . 1 1 34 34 C H6 H 1 7.72 0.03 . 1 . . . . 34 C H6 . 17316 1 462 . 1 1 34 34 C C1' C 13 93.06 0.03 . 1 . . . . 34 C C1' . 17316 1 463 . 1 1 34 34 C C2' C 13 74.76 0.03 . 1 . . . . 34 C C2' . 17316 1 464 . 1 1 34 34 C C3' C 13 71.74 0.03 . 1 . . . . 34 C C3' . 17316 1 465 . 1 1 34 34 C C4' C 13 81.14 0.03 . 1 . . . . 34 C C4' . 17316 1 466 . 1 1 34 34 C C5 C 13 96.86 0.03 . 1 . . . . 34 C C5 . 17316 1 467 . 1 1 34 34 C C5' C 13 63.98 0.03 . 1 . . . . 34 C C5' . 17316 1 468 . 1 1 34 34 C C6 C 13 141.64 0.03 . 1 . . . . 34 C C6 . 17316 1 469 . 1 1 35 35 C H1' H 1 5.27 0.03 . 1 . . . . 35 C H1' . 17316 1 470 . 1 1 35 35 C H2' H 1 4.53 0.03 . 1 . . . . 35 C H2' . 17316 1 471 . 1 1 35 35 C H3' H 1 4.15 0.03 . 1 . . . . 35 C H3' . 17316 1 472 . 1 1 35 35 C H4' H 1 4.35 0.03 . 1 . . . . 35 C H4' . 17316 1 473 . 1 1 35 35 C H5 H 1 5.14 0.03 . 1 . . . . 35 C H5 . 17316 1 474 . 1 1 35 35 C H5' H 1 4.38 0.03 . . . . . . 35 C H5' . 17316 1 475 . 1 1 35 35 C H5'' H 1 4.04 0.03 . . . . . . 35 C H5'' . 17316 1 476 . 1 1 35 35 C H6 H 1 7.27 0.03 . 1 . . . . 35 C H6 . 17316 1 477 . 1 1 35 35 C C1' C 13 93.64 0.03 . 1 . . . . 35 C C1' . 17316 1 478 . 1 1 35 35 C C2' C 13 74.42 0.03 . 1 . . . . 35 C C2' . 17316 1 479 . 1 1 35 35 C C3' C 13 71.97 0.03 . 1 . . . . 35 C C3' . 17316 1 480 . 1 1 35 35 C C4' C 13 81.23 0.03 . 1 . . . . 35 C C4' . 17316 1 481 . 1 1 35 35 C C5 C 13 96.70 0.03 . 1 . . . . 35 C C5 . 17316 1 482 . 1 1 35 35 C C5' C 13 64.98 0.03 . 1 . . . . 35 C C5' . 17316 1 483 . 1 1 35 35 C C6 C 13 140.79 0.03 . 1 . . . . 35 C C6 . 17316 1 484 . 1 1 36 36 G H1' H 1 5.51 0.03 . 1 . . . . 36 G H1' . 17316 1 485 . 1 1 36 36 G H2' H 1 4.22 0.03 . 1 . . . . 36 G H2' . 17316 1 486 . 1 1 36 36 G H3' H 1 4.78 0.03 . 1 . . . . 36 G H3' . 17316 1 487 . 1 1 36 36 G H4' H 1 4.37 0.03 . 1 . . . . 36 G H4' . 17316 1 488 . 1 1 36 36 G H5' H 1 4.38 0.03 . . . . . . 36 G H5' . 17316 1 489 . 1 1 36 36 G H5'' H 1 4.12 0.03 . . . . . . 36 G H5'' . 17316 1 490 . 1 1 36 36 G H8 H 1 7.72 0.03 . 1 . . . . 36 G H8 . 17316 1 491 . 1 1 36 36 G C1' C 13 89.65 0.03 . 1 . . . . 36 G C1' . 17316 1 492 . 1 1 36 36 G C2' C 13 75.21 0.03 . 1 . . . . 36 G C2' . 17316 1 493 . 1 1 36 36 G C3' C 13 72.76 0.03 . 1 . . . . 36 G C3' . 17316 1 494 . 1 1 36 36 G C4' C 13 81.32 0.03 . 1 . . . . 36 G C4' . 17316 1 495 . 1 1 36 36 G C5' C 13 63.72 0.03 . 1 . . . . 36 G C5' . 17316 1 496 . 1 1 36 36 G C8 C 13 136.88 0.03 . 1 . . . . 36 G C8 . 17316 1 497 . 1 1 37 37 A H1' H 1 5.75 0.03 . 1 . . . . 37 A H1' . 17316 1 498 . 1 1 37 37 A H2 H 1 7.73 0.03 . 1 . . . . 37 A H2 . 17316 1 499 . 1 1 37 37 A H2' H 1 4.82 0.03 . 1 . . . . 37 A H2' . 17316 1 500 . 1 1 37 37 A H3' H 1 4.25 0.03 . 1 . . . . 37 A H3' . 17316 1 501 . 1 1 37 37 A H4' H 1 4.64 0.03 . 1 . . . . 37 A H4' . 17316 1 502 . 1 1 37 37 A H5' H 1 4.61 0.03 . . . . . . 37 A H5' . 17316 1 503 . 1 1 37 37 A H5'' H 1 4.00 0.03 . . . . . . 37 A H5'' . 17316 1 504 . 1 1 37 37 A H8 H 1 7.43 0.03 . 1 . . . . 37 A H8 . 17316 1 505 . 1 1 37 37 A C1' C 13 92.88 0.03 . 1 . . . . 37 A C1' . 17316 1 506 . 1 1 37 37 A C2 C 13 154.57 0.03 . 1 . . . . 37 A C2 . 17316 1 507 . 1 1 37 37 A C2' C 13 74.09 0.03 . 1 . . . . 37 A C2' . 17316 1 508 . 1 1 37 37 A C3' C 13 74.66 0.03 . 1 . . . . 37 A C3' . 17316 1 509 . 1 1 37 37 A C4' C 13 82.60 0.03 . 1 . . . . 37 A C4' . 17316 1 510 . 1 1 37 37 A C5' C 13 69.18 0.03 . 1 . . . . 37 A C5' . 17316 1 511 . 1 1 37 37 A C8 C 13 139.95 0.03 . 1 . . . . 37 A C8 . 17316 1 512 . 1 1 38 38 A H1' H 1 5.67 0.03 . 1 . . . . 38 A H1' . 17316 1 513 . 1 1 38 38 A H2 H 1 7.78 0.03 . 1 . . . . 38 A H2 . 17316 1 514 . 1 1 38 38 A H2' H 1 4.32 0.03 . 1 . . . . 38 A H2' . 17316 1 515 . 1 1 38 38 A H3' H 1 4.58 0.03 . 1 . . . . 38 A H3' . 17316 1 516 . 1 1 38 38 A H4' H 1 4.40 0.03 . 1 . . . . 38 A H4' . 17316 1 517 . 1 1 38 38 A H5' H 1 4.37 0.03 . . . . . . 38 A H5' . 17316 1 518 . 1 1 38 38 A H5'' H 1 4.12 0.03 . . . . . . 38 A H5'' . 17316 1 519 . 1 1 38 38 A H8 H 1 7.80 0.03 . 1 . . . . 38 A H8 . 17316 1 520 . 1 1 38 38 A C1' C 13 90.71 0.03 . 1 . . . . 38 A C1' . 17316 1 521 . 1 1 38 38 A C2 C 13 155.42 0.03 . 1 . . . . 38 A C2 . 17316 1 522 . 1 1 38 38 A C2' C 13 75.57 0.03 . 1 . . . . 38 A C2' . 17316 1 523 . 1 1 38 38 A C3' C 13 72.66 0.03 . 1 . . . . 38 A C3' . 17316 1 524 . 1 1 38 38 A C4' C 13 82.06 0.03 . 1 . . . . 38 A C4' . 17316 1 525 . 1 1 38 38 A C5' C 13 64.33 0.03 . 1 . . . . 38 A C5' . 17316 1 526 . 1 1 38 38 A C8 C 13 139.32 0.03 . 1 . . . . 38 A C8 . 17316 1 527 . 1 1 39 39 U H1' H 1 5.27 0.03 . 1 . . . . 39 U H1' . 17316 1 528 . 1 1 39 39 U H2' H 1 4.15 0.03 . 1 . . . . 39 U H2' . 17316 1 529 . 1 1 39 39 U H3' H 1 4.42 0.03 . 1 . . . . 39 U H3' . 17316 1 530 . 1 1 39 39 U H4' H 1 4.26 0.03 . 1 . . . . 39 U H4' . 17316 1 531 . 1 1 39 39 U H5 H 1 5.26 0.03 . 1 . . . . 39 U H5 . 17316 1 532 . 1 1 39 39 U H5' H 1 4.20 0.03 . . . . . . 39 U H5' . 17316 1 533 . 1 1 39 39 U H5'' H 1 4.03 0.03 . . . . . . 39 U H5'' . 17316 1 534 . 1 1 39 39 U H6 H 1 7.38 0.03 . 1 . . . . 39 U H6 . 17316 1 535 . 1 1 39 39 U C1' C 13 91.04 0.03 . 1 . . . . 39 U C1' . 17316 1 536 . 1 1 39 39 U C2' C 13 74.68 0.03 . 1 . . . . 39 U C2' . 17316 1 537 . 1 1 39 39 U C3' C 13 74.60 0.03 . 1 . . . . 39 U C3' . 17316 1 538 . 1 1 39 39 U C4' C 13 83.93 0.03 . 1 . . . . 39 U C4' . 17316 1 539 . 1 1 39 39 U C5 C 13 103.74 0.03 . 1 . . . . 39 U C5 . 17316 1 540 . 1 1 39 39 U C5' C 13 65.59 0.03 . 1 . . . . 39 U C5' . 17316 1 541 . 1 1 39 39 U C6 C 13 142.32 0.03 . 1 . . . . 39 U C6 . 17316 1 542 . 1 1 40 40 A H1' H 1 5.76 0.03 . 1 . . . . 40 A H1' . 17316 1 543 . 1 1 40 40 A H2 H 1 7.73 0.03 . 1 . . . . 40 A H2 . 17316 1 544 . 1 1 40 40 A H2' H 1 4.54 0.03 . 1 . . . . 40 A H2' . 17316 1 545 . 1 1 40 40 A H3' H 1 4.46 0.03 . 1 . . . . 40 A H3' . 17316 1 546 . 1 1 40 40 A H4' H 1 4.42 0.03 . 1 . . . . 40 A H4' . 17316 1 547 . 1 1 40 40 A H5' H 1 4.25 0.03 . . . . . . 40 A H5' . 17316 1 548 . 1 1 40 40 A H5'' H 1 4.10 0.03 . . . . . . 40 A H5'' . 17316 1 549 . 1 1 40 40 A H8 H 1 8.06 0.03 . 1 . . . . 40 A H8 . 17316 1 550 . 1 1 40 40 A C1' C 13 89.99 0.03 . 1 . . . . 40 A C1' . 17316 1 551 . 1 1 40 40 A C2 C 13 154.81 0.03 . 1 . . . . 40 A C2 . 17316 1 552 . 1 1 40 40 A C2' C 13 74.58 0.03 . 1 . . . . 40 A C2' . 17316 1 553 . 1 1 40 40 A C3' C 13 72.59 0.03 . 1 . . . . 40 A C3' . 17316 1 554 . 1 1 40 40 A C4' C 13 83.25 0.03 . 1 . . . . 40 A C4' . 17316 1 555 . 1 1 40 40 A C5' C 13 66.52 0.03 . 1 . . . . 40 A C5' . 17316 1 556 . 1 1 40 40 A C8 C 13 141.33 0.03 . 1 . . . . 40 A C8 . 17316 1 557 . 1 1 41 41 C H1' H 1 5.60 0.03 . 1 . . . . 41 C H1' . 17316 1 558 . 1 1 41 41 C H2' H 1 3.86 0.03 . 1 . . . . 41 C H2' . 17316 1 559 . 1 1 41 41 C H3' H 1 4.08 0.03 . 1 . . . . 41 C H3' . 17316 1 560 . 1 1 41 41 C H4' H 1 4.37 0.03 . 1 . . . . 41 C H4' . 17316 1 561 . 1 1 41 41 C H5 H 1 5.49 0.03 . 1 . . . . 41 C H5 . 17316 1 562 . 1 1 41 41 C H6 H 1 7.55 0.03 . 1 . . . . 41 C H6 . 17316 1 563 . 1 1 41 41 C C1' C 13 92.66 0.03 . 1 . . . . 41 C C1' . 17316 1 564 . 1 1 41 41 C C2' C 13 76.99 0.03 . 1 . . . . 41 C C2' . 17316 1 565 . 1 1 41 41 C C3' C 13 70.33 0.03 . 1 . . . . 41 C C3' . 17316 1 566 . 1 1 41 41 C C4' C 13 83.75 0.03 . 1 . . . . 41 C C4' . 17316 1 567 . 1 1 41 41 C C5 C 13 97.11 0.03 . 1 . . . . 41 C C5 . 17316 1 568 . 1 1 41 41 C C6 C 13 142.49 0.03 . 1 . . . . 41 C C6 . 17316 1 569 . 1 1 42 42 A H1' H 1 5.90 0.03 . 1 . . . . 42 A H1' . 17316 1 570 . 1 1 42 42 A H2 H 1 8.01 0.03 . 1 . . . . 42 A H2 . 17316 1 571 . 1 1 42 42 A H2' H 1 4.65 0.03 . 1 . . . . 42 A H2' . 17316 1 572 . 1 1 42 42 A H3' H 1 4.58 0.03 . 1 . . . . 42 A H3' . 17316 1 573 . 1 1 42 42 A H4' H 1 4.53 0.03 . 1 . . . . 42 A H4' . 17316 1 574 . 1 1 42 42 A H8 H 1 8.19 0.03 . 1 . . . . 42 A H8 . 17316 1 575 . 1 1 42 42 A C1' C 13 92.66 0.03 . 1 . . . . 42 A C1' . 17316 1 576 . 1 1 42 42 A C2 C 13 97.11 0.03 . 1 . . . . 42 A C2 . 17316 1 577 . 1 1 42 42 A C2' C 13 76.99 0.03 . 1 . . . . 42 A C2' . 17316 1 578 . 1 1 42 42 A C3' C 13 70.33 0.03 . 1 . . . . 42 A C3' . 17316 1 579 . 1 1 42 42 A C4' C 13 83.75 0.03 . 1 . . . . 42 A C4' . 17316 1 580 . 1 1 42 42 A C8 C 13 142.49 0.03 . 1 . . . . 42 A C8 . 17316 1 581 . 1 1 43 43 C H1' H 1 5.26 0.03 . 1 . . . . 43 C H1' . 17316 1 582 . 1 1 43 43 C H2' H 1 4.53 0.03 . 1 . . . . 43 C H2' . 17316 1 583 . 1 1 43 43 C H3' H 1 4.13 0.03 . 1 . . . . 43 C H3' . 17316 1 584 . 1 1 43 43 C H4' H 1 4.34 0.03 . 1 . . . . 43 C H4' . 17316 1 585 . 1 1 43 43 C H5 H 1 5.57 0.03 . 1 . . . . 43 C H5 . 17316 1 586 . 1 1 43 43 C H6 H 1 7.58 0.03 . 1 . . . . 43 C H6 . 17316 1 587 . 1 1 43 43 C C1' C 13 94.30 0.03 . 1 . . . . 43 C C1' . 17316 1 588 . 1 1 43 43 C C2' C 13 74.94 0.03 . 1 . . . . 43 C C2' . 17316 1 589 . 1 1 43 43 C C3' C 13 72.84 0.03 . 1 . . . . 43 C C3' . 17316 1 590 . 1 1 43 43 C C4' C 13 72.66 0.03 . 1 . . . . 43 C C4' . 17316 1 591 . 1 1 43 43 C C5 C 13 97.91 0.03 . 1 . . . . 43 C C5 . 17316 1 592 . 1 1 43 43 C C6 C 13 138.12 0.03 . 1 . . . . 43 C C6 . 17316 1 593 . 1 1 44 44 U H1' H 1 5.51 0.03 . 1 . . . . 44 U H1' . 17316 1 594 . 1 1 44 44 U H2' H 1 4.28 0.03 . 1 . . . . 44 U H2' . 17316 1 595 . 1 1 44 44 U H3 H 1 13.95 0.03 . 1 . . . . 44 U H3 . 17316 1 596 . 1 1 44 44 U H4' H 1 4.39 0.03 . 1 . . . . 44 U H4' . 17316 1 597 . 1 1 44 44 U H5 H 1 5.33 0.03 . 1 . . . . 44 U H5 . 17316 1 598 . 1 1 44 44 U H6 H 1 7.89 0.03 . 1 . . . . 44 U H6 . 17316 1 599 . 1 1 44 44 U C1' C 13 93.64 0.03 . 1 . . . . 44 U C1' . 17316 1 600 . 1 1 44 44 U C2' C 13 76.11 0.03 . 1 . . . . 44 U C2' . 17316 1 601 . 1 1 44 44 U C4' C 13 81.65 0.03 . 1 . . . . 44 U C4' . 17316 1 602 . 1 1 44 44 U C5 C 13 154.13 0.03 . 1 . . . . 44 U C5 . 17316 1 603 . 1 1 44 44 U C6 C 13 140.18 0.03 . 1 . . . . 44 U C6 . 17316 1 604 . 1 1 44 44 U N3 N 15 162.52 0.06 . 1 . . . . 44 U N3 . 17316 1 605 . 1 1 45 45 C H1' H 1 5.48 0.03 . 1 . . . . 45 C H1' . 17316 1 606 . 1 1 45 45 C H2' H 1 4.62 0.03 . 1 . . . . 45 C H2' . 17316 1 607 . 1 1 45 45 C H3' H 1 4.49 0.03 . 1 . . . . 45 C H3' . 17316 1 608 . 1 1 45 45 C H4' H 1 4.41 0.03 . 1 . . . . 45 C H4' . 17316 1 609 . 1 1 45 45 C H5 H 1 5.56 0.03 . 1 . . . . 45 C H5 . 17316 1 610 . 1 1 45 45 C H5' H 1 4.50 0.03 . . . . . . 45 C H5' . 17316 1 611 . 1 1 45 45 C H5'' H 1 4.07 0.03 . . . . . . 45 C H5'' . 17316 1 612 . 1 1 45 45 C H6 H 1 7.74 0.03 . 1 . . . . 45 C H6 . 17316 1 613 . 1 1 45 45 C C1' C 13 93.58 0.03 . 1 . . . . 45 C C1' . 17316 1 614 . 1 1 45 45 C C2' C 13 75.32 0.03 . 1 . . . . 45 C C2' . 17316 1 615 . 1 1 45 45 C C3' C 13 72.35 0.03 . 1 . . . . 45 C C3' . 17316 1 616 . 1 1 45 45 C C4' C 13 81.63 0.03 . 1 . . . . 45 C C4' . 17316 1 617 . 1 1 45 45 C C5 C 13 97.84 0.03 . 1 . . . . 45 C C5 . 17316 1 618 . 1 1 45 45 C C5' C 13 64.56 0.03 . 1 . . . . 45 C C5' . 17316 1 619 . 1 1 45 45 C C6 C 13 141.12 0.03 . 1 . . . . 45 C C6 . 17316 1 620 . 1 1 46 46 A H1' H 1 5.76 0.03 . 1 . . . . 46 A H1' . 17316 1 621 . 1 1 46 46 A H2 H 1 7.25 0.03 . 1 . . . . 46 A H2 . 17316 1 622 . 1 1 46 46 A H2' H 1 4.44 0.03 . 1 . . . . 46 A H2' . 17316 1 623 . 1 1 46 46 A H3' H 1 4.22 0.03 . 1 . . . . 46 A H3' . 17316 1 624 . 1 1 46 46 A H4' H 1 4.45 0.03 . 1 . . . . 46 A H4' . 17316 1 625 . 1 1 46 46 A H5' H 1 4.43 0.03 . . . . . . 46 A H5' . 17316 1 626 . 1 1 46 46 A H5'' H 1 4.06 0.03 . . . . . . 46 A H5'' . 17316 1 627 . 1 1 46 46 A H8 H 1 7.72 0.03 . 1 . . . . 46 A H8 . 17316 1 628 . 1 1 46 46 A C1' C 13 93.31 0.03 . 1 . . . . 46 A C1' . 17316 1 629 . 1 1 46 46 A C2 C 13 152.60 0.03 . 1 . . . . 46 A C2 . 17316 1 630 . 1 1 46 46 A C2' C 13 75.38 0.03 . 1 . . . . 46 A C2' . 17316 1 631 . 1 1 46 46 A C3' C 13 72.77 0.03 . 1 . . . . 46 A C3' . 17316 1 632 . 1 1 46 46 A C4' C 13 82.14 0.03 . 1 . . . . 46 A C4' . 17316 1 633 . 1 1 46 46 A C5' C 13 65.78 0.03 . 1 . . . . 46 A C5' . 17316 1 634 . 1 1 46 46 A C8 C 13 138.99 0.03 . 1 . . . . 46 A C8 . 17316 1 635 . 1 1 47 47 U H1' H 1 5.02 0.03 . 1 . . . . 47 U H1' . 17316 1 636 . 1 1 47 47 U H2' H 1 3.71 0.03 . 1 . . . . 47 U H2' . 17316 1 637 . 1 1 47 47 U H3 H 1 10.92 0.03 . 1 . . . . 47 U H3 . 17316 1 638 . 1 1 47 47 U H3' H 1 4.12 0.03 . 1 . . . . 47 U H3' . 17316 1 639 . 1 1 47 47 U H4' H 1 4.18 0.03 . 1 . . . . 47 U H4' . 17316 1 640 . 1 1 47 47 U H5 H 1 4.95 0.03 . 1 . . . . 47 U H5 . 17316 1 641 . 1 1 47 47 U H5' H 1 4.33 0.03 . . . . . . 47 U H5' . 17316 1 642 . 1 1 47 47 U H5'' H 1 3.97 0.03 . . . . . . 47 U H5'' . 17316 1 643 . 1 1 47 47 U H6 H 1 6.88 0.03 . 1 . . . . 47 U H6 . 17316 1 644 . 1 1 47 47 U C1' C 13 94.06 0.03 . 1 . . . . 47 U C1' . 17316 1 645 . 1 1 47 47 U C2' C 13 75.45 0.03 . 1 . . . . 47 U C2' . 17316 1 646 . 1 1 47 47 U C3' C 13 71.74 0.03 . 1 . . . . 47 U C3' . 17316 1 647 . 1 1 47 47 U C4' C 13 82.84 0.03 . 1 . . . . 47 U C4' . 17316 1 648 . 1 1 47 47 U C5 C 13 104.10 0.03 . 1 . . . . 47 U C5 . 17316 1 649 . 1 1 47 47 U C5' C 13 63.96 0.03 . 1 . . . . 47 U C5' . 17316 1 650 . 1 1 47 47 U C6 C 13 138.61 0.03 . 1 . . . . 47 U C6 . 17316 1 651 . 1 1 47 47 U N3 N 15 156.46 0.06 . 1 . . . . 47 U N3 . 17316 1 652 . 1 1 48 48 G H1 H 1 10.09 0.03 . 1 . . . . 48 G H1 . 17316 1 653 . 1 1 48 48 G H1' H 1 5.66 0.03 . 1 . . . . 48 G H1' . 17316 1 654 . 1 1 48 48 G H2' H 1 4.82 0.03 . 1 . . . . 48 G H2' . 17316 1 655 . 1 1 48 48 G H3' H 1 4.90 0.03 . 1 . . . . 48 G H3' . 17316 1 656 . 1 1 48 48 G H4' H 1 4.67 0.03 . 1 . . . . 48 G H4' . 17316 1 657 . 1 1 48 48 G H5' H 1 4.23 0.03 . . . . . . 48 G H5' . 17316 1 658 . 1 1 48 48 G H5'' H 1 4.03 0.03 . . . . . . 48 G H5'' . 17316 1 659 . 1 1 48 48 G H8 H 1 7.98 0.03 . 1 . . . . 48 G H8 . 17316 1 660 . 1 1 48 48 G C1' C 13 87.95 0.03 . 1 . . . . 48 G C1' . 17316 1 661 . 1 1 48 48 G C2' C 13 75.21 0.03 . 1 . . . . 48 G C2' . 17316 1 662 . 1 1 48 48 G C3' C 13 75.52 0.03 . 1 . . . . 48 G C3' . 17316 1 663 . 1 1 48 48 G C4' C 13 86.66 0.03 . 1 . . . . 48 G C4' . 17316 1 664 . 1 1 48 48 G C5' C 13 67.18 0.03 . 1 . . . . 48 G C5' . 17316 1 665 . 1 1 48 48 G C8 C 13 138.72 0.03 . 1 . . . . 48 G C8 . 17316 1 666 . 1 1 48 48 G N1 N 15 145.75 0.03 . 1 . . . . 48 G N1 . 17316 1 667 . 1 1 49 49 A H1' H 1 5.84 0.03 . 1 . . . . 49 A H1' . 17316 1 668 . 1 1 49 49 A H2 H 1 7.98 0.03 . 1 . . . . 49 A H2 . 17316 1 669 . 1 1 49 49 A H2' H 1 4.60 0.03 . 1 . . . . 49 A H2' . 17316 1 670 . 1 1 49 49 A H3' H 1 4.80 0.03 . 1 . . . . 49 A H3' . 17316 1 671 . 1 1 49 49 A H4' H 1 4.50 0.03 . 1 . . . . 49 A H4' . 17316 1 672 . 1 1 49 49 A H5' H 1 4.18 0.03 . . . . . . 49 A H5' . 17316 1 673 . 1 1 49 49 A H5'' H 1 4.08 0.03 . . . . . . 49 A H5'' . 17316 1 674 . 1 1 49 49 A H8 H 1 7.89 0.03 . 1 . . . . 49 A H8 . 17316 1 675 . 1 1 49 49 A C1' C 13 89.86 0.03 . 1 . . . . 49 A C1' . 17316 1 676 . 1 1 49 49 A C2 C 13 155.00 0.03 . 1 . . . . 49 A C2 . 17316 1 677 . 1 1 49 49 A C2' C 13 75.40 0.03 . 1 . . . . 49 A C2' . 17316 1 678 . 1 1 49 49 A C3' C 13 77.56 0.03 . 1 . . . . 49 A C3' . 17316 1 679 . 1 1 49 49 A C4' C 13 85.40 0.03 . 1 . . . . 49 A C4' . 17316 1 680 . 1 1 49 49 A C5' C 13 67.97 0.03 . 1 . . . . 49 A C5' . 17316 1 681 . 1 1 49 49 A C8 C 13 140.74 0.03 . 1 . . . . 49 A C8 . 17316 1 682 . 1 1 50 50 A H1' H 1 5.87 0.03 . 1 . . . . 50 A H1' . 17316 1 683 . 1 1 50 50 A H2 H 1 7.57 0.03 . 1 . . . . 50 A H2 . 17316 1 684 . 1 1 50 50 A H2' H 1 3.99 0.03 . 1 . . . . 50 A H2' . 17316 1 685 . 1 1 50 50 A H3' H 1 4.25 0.03 . 1 . . . . 50 A H3' . 17316 1 686 . 1 1 50 50 A H4' H 1 4.60 0.03 . 1 . . . . 50 A H4' . 17316 1 687 . 1 1 50 50 A H5' H 1 4.50 0.03 . . . . . . 50 A H5' . 17316 1 688 . 1 1 50 50 A H5'' H 1 4.28 0.03 . . . . . . 50 A H5'' . 17316 1 689 . 1 1 50 50 A H8 H 1 8.32 0.03 . 1 . . . . 50 A H8 . 17316 1 690 . 1 1 50 50 A C1' C 13 91.71 0.03 . 1 . . . . 50 A C1' . 17316 1 691 . 1 1 50 50 A C2 C 13 153.42 0.03 . 1 . . . . 50 A C2 . 17316 1 692 . 1 1 50 50 A C2' C 13 77.62 0.03 . 1 . . . . 50 A C2' . 17316 1 693 . 1 1 50 50 A C3' C 13 69.97 0.03 . 1 . . . . 50 A C3' . 17316 1 694 . 1 1 50 50 A C4' C 13 83.21 0.03 . 1 . . . . 50 A C4' . 17316 1 695 . 1 1 50 50 A C5' C 13 66.99 0.03 . 1 . . . . 50 A C5' . 17316 1 696 . 1 1 50 50 A C8 C 13 141.10 0.03 . 1 . . . . 50 A C8 . 17316 1 697 . 1 1 51 51 C H1' H 1 5.42 0.03 . 1 . . . . 51 C H1' . 17316 1 698 . 1 1 51 51 C H2' H 1 4.23 0.03 . 1 . . . . 51 C H2' . 17316 1 699 . 1 1 51 51 C H3' H 1 4.31 0.03 . 1 . . . . 51 C H3' . 17316 1 700 . 1 1 51 51 C H4' H 1 4.41 0.03 . 1 . . . . 51 C H4' . 17316 1 701 . 1 1 51 51 C H5 H 1 5.18 0.03 . 1 . . . . 51 C H5 . 17316 1 702 . 1 1 51 51 C H5' H 1 4.44 0.03 . . . . . . 51 C H5' . 17316 1 703 . 1 1 51 51 C H5'' H 1 4.13 0.03 . . . . . . 51 C H5'' . 17316 1 704 . 1 1 51 51 C H6 H 1 7.53 0.03 . 1 . . . . 51 C H6 . 17316 1 705 . 1 1 51 51 C C1' C 13 93.98 0.03 . 1 . . . . 51 C C1' . 17316 1 706 . 1 1 51 51 C C2' C 13 75.39 0.03 . 1 . . . . 51 C C2' . 17316 1 707 . 1 1 51 51 C C3' C 13 72.54 0.03 . 1 . . . . 51 C C3' . 17316 1 708 . 1 1 51 51 C C4' C 13 82.00 0.03 . 1 . . . . 51 C C4' . 17316 1 709 . 1 1 51 51 C C5 C 13 97.07 0.03 . 1 . . . . 51 C C5 . 17316 1 710 . 1 1 51 51 C C5' C 13 65.54 0.03 . 1 . . . . 51 C C5' . 17316 1 711 . 1 1 51 51 C C6 C 13 141.19 0.03 . 1 . . . . 51 C C6 . 17316 1 712 . 1 1 52 52 U H1' H 1 5.50 0.03 . 1 . . . . 52 U H1' . 17316 1 713 . 1 1 52 52 U H2' H 1 4.48 0.03 . 1 . . . . 52 U H2' . 17316 1 714 . 1 1 52 52 U H3 H 1 14.01 0.03 . 1 . . . . 52 U H3 . 17316 1 715 . 1 1 52 52 U H3' H 1 4.50 0.03 . 1 . . . . 52 U H3' . 17316 1 716 . 1 1 52 52 U H4' H 1 4.40 0.03 . 1 . . . . 52 U H4' . 17316 1 717 . 1 1 52 52 U H5 H 1 5.30 0.03 . 1 . . . . 52 U H5 . 17316 1 718 . 1 1 52 52 U H5' H 1 4.52 0.03 . . . . . . 52 U H5' . 17316 1 719 . 1 1 52 52 U H5'' H 1 4.05 0.03 . . . . . . 52 U H5'' . 17316 1 720 . 1 1 52 52 U H6 H 1 7.91 0.03 . 1 . . . . 52 U H6 . 17316 1 721 . 1 1 52 52 U C1' C 13 93.59 0.03 . 1 . . . . 52 U C1' . 17316 1 722 . 1 1 52 52 U C2' C 13 75.01 0.03 . 1 . . . . 52 U C2' . 17316 1 723 . 1 1 52 52 U C3' C 13 72.35 0.03 . 1 . . . . 52 U C3' . 17316 1 724 . 1 1 52 52 U C4' C 13 81.81 0.03 . 1 . . . . 52 U C4' . 17316 1 725 . 1 1 52 52 U C5 C 13 103.03 0.03 . 1 . . . . 52 U C5 . 17316 1 726 . 1 1 52 52 U C5' C 13 64.33 0.03 . 1 . . . . 52 U C5' . 17316 1 727 . 1 1 52 52 U C6 C 13 142.19 0.03 . 1 . . . . 52 U C6 . 17316 1 728 . 1 1 52 52 U N3 N 15 162.46 0.06 . 1 . . . . 52 U N3 . 17316 1 729 . 1 1 53 53 C H1' H 1 5.42 0.03 . 1 . . . . 53 C H1' . 17316 1 730 . 1 1 53 53 C H2' H 1 4.28 0.03 . 1 . . . . 53 C H2' . 17316 1 731 . 1 1 53 53 C H3' H 1 4.45 0.03 . 1 . . . . 53 C H3' . 17316 1 732 . 1 1 53 53 C H4' H 1 4.39 0.03 . 1 . . . . 53 C H4' . 17316 1 733 . 1 1 53 53 C H5 H 1 5.61 0.03 . 1 . . . . 53 C H5 . 17316 1 734 . 1 1 53 53 C H5' H 1 4.49 0.03 . . . . . . 53 C H5' . 17316 1 735 . 1 1 53 53 C H5'' H 1 4.05 0.03 . . . . . . 53 C H5'' . 17316 1 736 . 1 1 53 53 C H6 H 1 7.88 0.03 . 1 . . . . 53 C H6 . 17316 1 737 . 1 1 53 53 C C1' C 13 93.91 0.03 . 1 . . . . 53 C C1' . 17316 1 738 . 1 1 53 53 C C2' C 13 75.25 0.03 . 1 . . . . 53 C C2' . 17316 1 739 . 1 1 53 53 C C3' C 13 72.21 0.03 . 1 . . . . 53 C C3' . 17316 1 740 . 1 1 53 53 C C4' C 13 82.09 0.03 . 1 . . . . 53 C C4' . 17316 1 741 . 1 1 53 53 C C5 C 13 97.22 0.03 . 1 . . . . 53 C C5 . 17316 1 742 . 1 1 53 53 C C5' C 13 64.70 0.03 . 1 . . . . 53 C C5' . 17316 1 743 . 1 1 53 53 C C6 C 13 141.76 0.03 . 1 . . . . 53 C C6 . 17316 1 744 . 1 1 54 54 C H1' H 1 5.41 0.03 . 1 . . . . 54 C H1' . 17316 1 745 . 1 1 54 54 C H2' H 1 4.19 0.03 . 1 . . . . 54 C H2' . 17316 1 746 . 1 1 54 54 C H3' H 1 4.44 0.03 . 1 . . . . 54 C H3' . 17316 1 747 . 1 1 54 54 C H4' H 1 4.32 0.03 . 1 . . . . 54 C H4' . 17316 1 748 . 1 1 54 54 C H5 H 1 5.41 0.03 . 1 . . . . 54 C H5 . 17316 1 749 . 1 1 54 54 C H5' H 1 4.52 0.03 . . . . . . 54 C H5' . 17316 1 750 . 1 1 54 54 C H5'' H 1 4.01 0.03 . . . . . . 54 C H5'' . 17316 1 751 . 1 1 54 54 C H6 H 1 7.77 0.03 . 1 . . . . 54 C H6 . 17316 1 752 . 1 1 54 54 C C1' C 13 94.19 0.03 . 1 . . . . 54 C C1' . 17316 1 753 . 1 1 54 54 C C2' C 13 75.29 0.03 . 1 . . . . 54 C C2' . 17316 1 754 . 1 1 54 54 C C3' C 13 71.84 0.03 . 1 . . . . 54 C C3' . 17316 1 755 . 1 1 54 54 C C4' C 13 81.72 0.03 . 1 . . . . 54 C C4' . 17316 1 756 . 1 1 54 54 C C5 C 13 97.28 0.03 . 1 . . . . 54 C C5 . 17316 1 757 . 1 1 54 54 C C5' C 13 64.19 0.03 . 1 . . . . 54 C C5' . 17316 1 758 . 1 1 54 54 C C6 C 13 141.44 0.03 . 1 . . . . 54 C C6 . 17316 1 759 . 1 1 55 55 C H1' H 1 5.70 0.03 . 1 . . . . 55 C H1' . 17316 1 760 . 1 1 55 55 C H2' H 1 3.94 0.03 . 1 . . . . 55 C H2' . 17316 1 761 . 1 1 55 55 C H3' H 1 4.13 0.03 . 1 . . . . 55 C H3' . 17316 1 762 . 1 1 55 55 C H4' H 1 4.12 0.03 . 1 . . . . 55 C H4' . 17316 1 763 . 1 1 55 55 C H5 H 1 5.43 0.03 . 1 . . . . 55 C H5 . 17316 1 764 . 1 1 55 55 C H5' H 1 4.43 0.03 . . . . . . 55 C H5' . 17316 1 765 . 1 1 55 55 C H5'' H 1 3.98 0.03 . . . . . . 55 C H5'' . 17316 1 766 . 1 1 55 55 C H6 H 1 7.63 0.03 . 1 . . . . 55 C H6 . 17316 1 767 . 1 1 55 55 C C1' C 13 92.69 0.03 . 1 . . . . 55 C C1' . 17316 1 768 . 1 1 55 55 C C2' C 13 77.34 0.03 . 1 . . . . 55 C C2' . 17316 1 769 . 1 1 55 55 C C3' C 13 69.51 0.03 . 1 . . . . 55 C C3' . 17316 1 770 . 1 1 55 55 C C4' C 13 83.49 0.03 . 1 . . . . 55 C C4' . 17316 1 771 . 1 1 55 55 C C5 C 13 97.88 0.03 . 1 . . . . 55 C C5 . 17316 1 772 . 1 1 55 55 C C5' C 13 65.08 0.03 . 1 . . . . 55 C C5' . 17316 1 773 . 1 1 55 55 C C6 C 13 141.75 0.03 . 1 . . . . 55 C C6 . 17316 1 stop_ save_