################################### # 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 35053 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D NOESY' . . . 35053 1 2 '2D NOESY' . . . 35053 1 3 '2D 1H-13C HSQC' . . . 35053 1 4 '2D 1H-1H TOCSY' . . . 35053 1 5 '2D 1H-13C HSQC' . . . 35053 1 6 '2D 1H-1H COSY' . . . 35053 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 11.897 0.000 . 1 . . . . A 1 G H1 . 35053 1 2 . 1 . 1 1 1 G H1' H 1 5.775 0.003 . 1 . . . . A 1 G H1' . 35053 1 3 . 1 . 1 1 1 G H2' H 1 4.840 0.002 . 1 . . . . A 1 G H2' . 35053 1 4 . 1 . 1 1 1 G H3' H 1 4.580 0.001 . 1 . . . . A 1 G H3' . 35053 1 5 . 1 . 1 1 1 G H4' H 1 4.385 0.002 . 1 . . . . A 1 G H4' . 35053 1 6 . 1 . 1 1 1 G H5' H 1 4.040 0.005 . 1 . . . . A 1 G H5' . 35053 1 7 . 1 . 1 1 1 G H5'' H 1 3.914 0.005 . 1 . . . . A 1 G H5'' . 35053 1 8 . 1 . 1 1 1 G H8 H 1 8.034 0.001 . 1 . . . . A 1 G H8 . 35053 1 9 . 1 . 1 1 1 G C1' C 13 90.086 0.000 . 1 . . . . A 1 G C1' . 35053 1 10 . 1 . 1 1 1 G C2' C 13 72.461 0.000 . 1 . . . . A 1 G C2' . 35053 1 11 . 1 . 1 1 1 G C3' C 13 71.412 0.000 . 1 . . . . A 1 G C3' . 35053 1 12 . 1 . 1 1 1 G C4' C 13 81.960 0.000 . 1 . . . . A 1 G C4' . 35053 1 13 . 1 . 1 1 1 G C5' C 13 60.007 0.008 . 1 . . . . A 1 G C5' . 35053 1 14 . 1 . 1 1 1 G C8 C 13 135.801 0.000 . 1 . . . . A 1 G C8 . 35053 1 15 . 1 . 1 2 2 A H1' H 1 5.924 0.001 . 1 . . . . A 2 A H1' . 35053 1 16 . 1 . 1 2 2 A H2 H 1 7.082 0.001 . 1 . . . . A 2 A H2 . 35053 1 17 . 1 . 1 2 2 A H2' H 1 4.640 0.001 . 1 . . . . A 2 A H2' . 35053 1 18 . 1 . 1 2 2 A H3' H 1 4.718 0.003 . 1 . . . . A 2 A H3' . 35053 1 19 . 1 . 1 2 2 A H4' H 1 4.506 0.011 . 1 . . . . A 2 A H4' . 35053 1 20 . 1 . 1 2 2 A H5' H 1 4.547 0.002 . 1 . . . . A 2 A H5' . 35053 1 21 . 1 . 1 2 2 A H5'' H 1 4.182 0.001 . 1 . . . . A 2 A H5'' . 35053 1 22 . 1 . 1 2 2 A H8 H 1 7.866 0.001 . 1 . . . . A 2 A H8 . 35053 1 23 . 1 . 1 2 2 A C1' C 13 90.350 0.000 . 1 . . . . A 2 A C1' . 35053 1 24 . 1 . 1 2 2 A C2 C 13 150.155 0.000 . 1 . . . . A 2 A C2 . 35053 1 25 . 1 . 1 2 2 A C2' C 13 72.959 0.000 . 1 . . . . A 2 A C2' . 35053 1 26 . 1 . 1 2 2 A C3' C 13 70.046 0.000 . 1 . . . . A 2 A C3' . 35053 1 27 . 1 . 1 2 2 A C4' C 13 79.528 0.000 . 1 . . . . A 2 A C4' . 35053 1 28 . 1 . 1 2 2 A C5' C 13 62.440 0.004 . 1 . . . . A 2 A C5' . 35053 1 29 . 1 . 1 2 2 A C8 C 13 137.085 0.000 . 1 . . . . A 2 A C8 . 35053 1 30 . 1 . 1 3 3 A H1' H 1 5.755 0.002 . 1 . . . . A 3 A H1' . 35053 1 31 . 1 . 1 3 3 A H2 H 1 7.129 0.011 . 1 . . . . A 3 A H2 . 35053 1 32 . 1 . 1 3 3 A H2' H 1 4.399 0.002 . 1 . . . . A 3 A H2' . 35053 1 33 . 1 . 1 3 3 A H3' H 1 4.573 0.004 . 1 . . . . A 3 A H3' . 35053 1 34 . 1 . 1 3 3 A H4' H 1 4.471 0.007 . 1 . . . . A 3 A H4' . 35053 1 35 . 1 . 1 3 3 A H5' H 1 4.498 0.005 . 1 . . . . A 3 A H5' . 35053 1 36 . 1 . 1 3 3 A H5'' H 1 4.083 0.000 . 1 . . . . A 3 A H5'' . 35053 1 37 . 1 . 1 3 3 A H8 H 1 7.585 0.001 . 1 . . . . A 3 A H8 . 35053 1 38 . 1 . 1 3 3 A C1' C 13 90.005 0.000 . 1 . . . . A 3 A C1' . 35053 1 39 . 1 . 1 3 3 A C2 C 13 150.079 0.000 . 1 . . . . A 3 A C2 . 35053 1 40 . 1 . 1 3 3 A C3' C 13 70.124 0.000 . 1 . . . . A 3 A C3' . 35053 1 41 . 1 . 1 3 3 A C4' C 13 79.303 0.000 . 1 . . . . A 3 A C4' . 35053 1 42 . 1 . 1 3 3 A C5' C 13 62.691 0.019 . 1 . . . . A 3 A C5' . 35053 1 43 . 1 . 1 3 3 A C8 C 13 136.343 0.000 . 1 . . . . A 3 A C8 . 35053 1 44 . 1 . 1 4 4 I H1 H 1 15.317 0.008 . 1 . . . . A 4 I H1 . 35053 1 45 . 1 . 1 4 4 I H1' H 1 5.854 0.001 . 1 . . . . A 4 I H1' . 35053 1 46 . 1 . 1 4 4 I H2 H 1 7.422 0.001 . 1 . . . . A 4 I H2 . 35053 1 47 . 1 . 1 4 4 I H2' H 1 4.358 0.001 . 1 . . . . A 4 I H2' . 35053 1 48 . 1 . 1 4 4 I H3' H 1 4.592 0.007 . 1 . . . . A 4 I H3' . 35053 1 49 . 1 . 1 4 4 I H4' H 1 4.407 0.007 . 1 . . . . A 4 I H4' . 35053 1 50 . 1 . 1 4 4 I H5' H 1 4.492 0.002 . 1 . . . . A 4 I H5' . 35053 1 51 . 1 . 1 4 4 I H5'' H 1 4.060 0.003 . 1 . . . . A 4 I H5'' . 35053 1 52 . 1 . 1 4 4 I H8 H 1 7.624 0.001 . 1 . . . . A 4 I H8 . 35053 1 53 . 1 . 1 4 4 I C1' C 13 89.810 0.000 . 1 . . . . A 4 I C1' . 35053 1 54 . 1 . 1 4 4 I C2 C 13 145.046 0.000 . 1 . . . . A 4 I C2 . 35053 1 55 . 1 . 1 4 4 I C3' C 13 69.709 0.201 . 1 . . . . A 4 I C3' . 35053 1 56 . 1 . 1 4 4 I C4' C 13 79.162 0.000 . 1 . . . . A 4 I C4' . 35053 1 57 . 1 . 1 4 4 I C5' C 13 62.122 0.024 . 1 . . . . A 4 I C5' . 35053 1 58 . 1 . 1 4 4 I C8 C 13 136.055 0.000 . 1 . . . . A 4 I C8 . 35053 1 59 . 1 . 1 5 5 G H1 H 1 12.881 0.007 . 1 . . . . A 5 G H1 . 35053 1 60 . 1 . 1 5 5 G H1' H 1 5.623 0.004 . 1 . . . . A 5 G H1' . 35053 1 61 . 1 . 1 5 5 G H2' H 1 4.356 0.000 . 1 . . . . A 5 G H2' . 35053 1 62 . 1 . 1 5 5 G H4' H 1 4.420 0.000 . 1 . . . . A 5 G H4' . 35053 1 63 . 1 . 1 5 5 G H5'' H 1 4.008 0.002 . 1 . . . . A 5 G H5'' . 35053 1 64 . 1 . 1 5 5 G H8 H 1 7.003 0.001 . 1 . . . . A 5 G H8 . 35053 1 65 . 1 . 1 5 5 G C1' C 13 89.808 0.000 . 1 . . . . A 5 G C1' . 35053 1 66 . 1 . 1 5 5 G C8 C 13 132.552 0.000 . 1 . . . . A 5 G C8 . 35053 1 67 . 1 . 1 6 6 G H1 H 1 10.430 0.002 . 1 . . . . A 6 G H1 . 35053 1 68 . 1 . 1 6 6 G H1' H 1 5.662 0.002 . 1 . . . . A 6 G H1' . 35053 1 69 . 1 . 1 6 6 G H2' H 1 4.381 0.003 . 1 . . . . A 6 G H2' . 35053 1 70 . 1 . 1 6 6 G H3' H 1 4.271 0.007 . 1 . . . . A 6 G H3' . 35053 1 71 . 1 . 1 6 6 G H4' H 1 4.489 0.001 . 1 . . . . A 6 G H4' . 35053 1 72 . 1 . 1 6 6 G H5' H 1 4.419 0.000 . 1 . . . . A 6 G H5' . 35053 1 73 . 1 . 1 6 6 G H5'' H 1 4.000 0.000 . 1 . . . . A 6 G H5'' . 35053 1 74 . 1 . 1 6 6 G H8 H 1 7.061 0.004 . 1 . . . . A 6 G H8 . 35053 1 75 . 1 . 1 6 6 G C1' C 13 91.011 0.000 . 1 . . . . A 6 G C1' . 35053 1 76 . 1 . 1 6 6 G C2' C 13 79.721 0.000 . 1 . . . . A 6 G C2' . 35053 1 77 . 1 . 1 6 6 G C3' C 13 72.827 0.000 . 1 . . . . A 6 G C3' . 35053 1 78 . 1 . 1 6 6 G C4' C 13 79.531 0.000 . 1 . . . . A 6 G C4' . 35053 1 79 . 1 . 1 6 6 G C8 C 13 132.993 0.000 . 1 . . . . A 6 G C8 . 35053 1 80 . 1 . 1 7 7 C H1' H 1 3.593 0.000 . 1 . . . . A 7 C H1' . 35053 1 81 . 1 . 1 7 7 C H2' H 1 3.957 0.001 . 1 . . . . A 7 C H2' . 35053 1 82 . 1 . 1 7 7 C H5 H 1 6.012 0.002 . 1 . . . . A 7 C H5 . 35053 1 83 . 1 . 1 7 7 C H5' H 1 4.195 0.004 . 1 . . . . A 7 C H5' . 35053 1 84 . 1 . 1 7 7 C H5'' H 1 4.104 0.000 . 1 . . . . A 7 C H5'' . 35053 1 85 . 1 . 1 7 7 C H6 H 1 7.802 0.003 . 1 . . . . A 7 C H6 . 35053 1 86 . 1 . 1 7 7 C C2' C 13 71.626 0.000 . 1 . . . . A 7 C C2' . 35053 1 87 . 1 . 1 7 7 C C5 C 13 96.677 0.000 . 1 . . . . A 7 C C5 . 35053 1 88 . 1 . 1 7 7 C C5' C 13 66.565 0.018 . 1 . . . . A 7 C C5' . 35053 1 89 . 1 . 1 7 7 C C6 C 13 139.228 0.000 . 1 . . . . A 7 C C6 . 35053 1 90 . 1 . 1 8 8 A H1' H 1 5.980 0.001 . 1 . . . . A 8 A H1' . 35053 1 91 . 1 . 1 8 8 A H2 H 1 8.128 0.001 . 1 . . . . A 8 A H2 . 35053 1 92 . 1 . 1 8 8 A H2' H 1 4.386 0.001 . 1 . . . . A 8 A H2' . 35053 1 93 . 1 . 1 8 8 A H3' H 1 4.921 0.002 . 1 . . . . A 8 A H3' . 35053 1 94 . 1 . 1 8 8 A H4' H 1 4.100 0.004 . 1 . . . . A 8 A H4' . 35053 1 95 . 1 . 1 8 8 A H5' H 1 4.510 0.003 . 1 . . . . A 8 A H5' . 35053 1 96 . 1 . 1 8 8 A H5'' H 1 4.213 0.005 . 1 . . . . A 8 A H5'' . 35053 1 97 . 1 . 1 8 8 A H8 H 1 8.127 0.001 . 1 . . . . A 8 A H8 . 35053 1 98 . 1 . 1 8 8 A C1' C 13 89.155 0.000 . 1 . . . . A 8 A C1' . 35053 1 99 . 1 . 1 8 8 A C2 C 13 152.874 0.000 . 1 . . . . A 8 A C2 . 35053 1 100 . 1 . 1 8 8 A C2' C 13 74.043 0.000 . 1 . . . . A 8 A C2' . 35053 1 101 . 1 . 1 8 8 A C4' C 13 80.106 0.000 . 1 . . . . A 8 A C4' . 35053 1 102 . 1 . 1 8 8 A C5' C 13 62.758 0.018 . 1 . . . . A 8 A C5' . 35053 1 103 . 1 . 1 8 8 A C8 C 13 137.665 0.000 . 1 . . . . A 8 A C8 . 35053 1 104 . 1 . 1 9 9 A H1' H 1 5.626 0.001 . 1 . . . . A 9 A H1' . 35053 1 105 . 1 . 1 9 9 A H2 H 1 7.707 0.001 . 1 . . . . A 9 A H2 . 35053 1 106 . 1 . 1 9 9 A H2' H 1 4.335 0.001 . 1 . . . . A 9 A H2' . 35053 1 107 . 1 . 1 9 9 A H3' H 1 4.582 0.001 . 1 . . . . A 9 A H3' . 35053 1 108 . 1 . 1 9 9 A H4' H 1 4.242 0.000 . 1 . . . . A 9 A H4' . 35053 1 109 . 1 . 1 9 9 A H5'' H 1 3.898 0.001 . 1 . . . . A 9 A H5'' . 35053 1 110 . 1 . 1 9 9 A H8 H 1 8.062 0.001 . 1 . . . . A 9 A H8 . 35053 1 111 . 1 . 1 9 9 A C1' C 13 89.740 0.000 . 1 . . . . A 9 A C1' . 35053 1 112 . 1 . 1 9 9 A C2 C 13 151.828 0.000 . 1 . . . . A 9 A C2 . 35053 1 113 . 1 . 1 9 9 A C2' C 13 73.459 0.000 . 1 . . . . A 9 A C2' . 35053 1 114 . 1 . 1 9 9 A C4' C 13 80.203 0.000 . 1 . . . . A 9 A C4' . 35053 1 115 . 1 . 1 9 9 A C5' C 13 62.484 0.000 . 1 . . . . A 9 A C5' . 35053 1 116 . 1 . 1 9 9 A C8 C 13 137.699 0.000 . 1 . . . . A 9 A C8 . 35053 1 117 . 1 . 1 10 10 C H1' H 1 5.343 0.003 . 1 . . . . A 10 C H1' . 35053 1 118 . 1 . 1 10 10 C H2' H 1 4.353 0.003 . 1 . . . . A 10 C H2' . 35053 1 119 . 1 . 1 10 10 C H3' H 1 4.088 0.002 . 1 . . . . A 10 C H3' . 35053 1 120 . 1 . 1 10 10 C H4' H 1 4.040 0.001 . 1 . . . . A 10 C H4' . 35053 1 121 . 1 . 1 10 10 C H5 H 1 5.445 0.001 . 1 . . . . A 10 C H5 . 35053 1 122 . 1 . 1 10 10 C H5' H 1 4.135 0.000 . 1 . . . . A 10 C H5' . 35053 1 123 . 1 . 1 10 10 C H5'' H 1 3.801 0.001 . 1 . . . . A 10 C H5'' . 35053 1 124 . 1 . 1 10 10 C H6 H 1 7.684 0.001 . 1 . . . . A 10 C H6 . 35053 1 125 . 1 . 1 10 10 C C1' C 13 90.353 0.000 . 1 . . . . A 10 C C1' . 35053 1 126 . 1 . 1 10 10 C C2' C 13 73.159 0.000 . 1 . . . . A 10 C C2' . 35053 1 127 . 1 . 1 10 10 C C3' C 13 70.108 0.000 . 1 . . . . A 10 C C3' . 35053 1 128 . 1 . 1 10 10 C C4' C 13 80.018 0.000 . 1 . . . . A 10 C C4' . 35053 1 129 . 1 . 1 10 10 C C5 C 13 94.532 0.000 . 1 . . . . A 10 C C5 . 35053 1 130 . 1 . 1 10 10 C C5' C 13 61.677 0.006 . 1 . . . . A 10 C C5' . 35053 1 131 . 1 . 1 10 10 C C6 C 13 140.379 0.000 . 1 . . . . A 10 C C6 . 35053 1 132 . 1 . 1 11 11 C H1' H 1 5.448 0.004 . 1 . . . . A 11 C H1' . 35053 1 133 . 1 . 1 11 11 C H2' H 1 4.372 0.006 . 1 . . . . A 11 C H2' . 35053 1 134 . 1 . 1 11 11 C H3' H 1 4.460 0.003 . 1 . . . . A 11 C H3' . 35053 1 135 . 1 . 1 11 11 C H4' H 1 4.304 0.002 . 1 . . . . A 11 C H4' . 35053 1 136 . 1 . 1 11 11 C H5 H 1 5.526 0.001 . 1 . . . . A 11 C H5 . 35053 1 137 . 1 . 1 11 11 C H5' H 1 4.393 0.002 . 1 . . . . A 11 C H5' . 35053 1 138 . 1 . 1 11 11 C H5'' H 1 3.960 0.002 . 1 . . . . A 11 C H5'' . 35053 1 139 . 1 . 1 11 11 C H6 H 1 7.790 0.002 . 1 . . . . A 11 C H6 . 35053 1 140 . 1 . 1 11 11 C C1' C 13 91.410 0.000 . 1 . . . . A 11 C C1' . 35053 1 141 . 1 . 1 11 11 C C2' C 13 72.483 0.000 . 1 . . . . A 11 C C2' . 35053 1 142 . 1 . 1 11 11 C C3' C 13 69.437 0.000 . 1 . . . . A 11 C C3' . 35053 1 143 . 1 . 1 11 11 C C4' C 13 79.153 0.000 . 1 . . . . A 11 C C4' . 35053 1 144 . 1 . 1 11 11 C C5 C 13 94.524 0.000 . 1 . . . . A 11 C C5 . 35053 1 145 . 1 . 1 11 11 C C5' C 13 61.350 0.005 . 1 . . . . A 11 C C5' . 35053 1 146 . 1 . 1 11 11 C C6 C 13 139.329 0.000 . 1 . . . . A 11 C C6 . 35053 1 147 . 1 . 1 12 12 U H1' H 1 5.577 0.001 . 1 . . . . A 12 U H1' . 35053 1 148 . 1 . 1 12 12 U H2' H 1 4.293 0.004 . 1 . . . . A 12 U H2' . 35053 1 149 . 1 . 1 12 12 U H3 H 1 13.744 0.000 . 1 . . . . A 12 U H3 . 35053 1 150 . 1 . 1 12 12 U H3' H 1 4.478 0.002 . 1 . . . . A 12 U H3' . 35053 1 151 . 1 . 1 12 12 U H4' H 1 4.374 0.000 . 1 . . . . A 12 U H4' . 35053 1 152 . 1 . 1 12 12 U H5 H 1 5.487 0.009 . 1 . . . . A 12 U H5 . 35053 1 153 . 1 . 1 12 12 U H5' H 1 4.425 0.000 . 1 . . . . A 12 U H5' . 35053 1 154 . 1 . 1 12 12 U H5'' H 1 4.036 0.003 . 1 . . . . A 12 U H5'' . 35053 1 155 . 1 . 1 12 12 U H6 H 1 7.940 0.002 . 1 . . . . A 12 U H6 . 35053 1 156 . 1 . 1 12 12 U C1' C 13 90.793 0.000 . 1 . . . . A 12 U C1' . 35053 1 157 . 1 . 1 12 12 U C2' C 13 72.776 0.000 . 1 . . . . A 12 U C2' . 35053 1 158 . 1 . 1 12 12 U C3' C 13 69.778 0.000 . 1 . . . . A 12 U C3' . 35053 1 159 . 1 . 1 12 12 U C4' C 13 79.349 0.000 . 1 . . . . A 12 U C4' . 35053 1 160 . 1 . 1 12 12 U C5 C 13 100.540 0.000 . 1 . . . . A 12 U C5 . 35053 1 161 . 1 . 1 12 12 U C5' C 13 62.190 0.019 . 1 . . . . A 12 U C5' . 35053 1 162 . 1 . 1 12 12 U C6 C 13 139.536 0.000 . 1 . . . . A 12 U C6 . 35053 1 163 . 1 . 1 13 13 U H1' H 1 5.512 0.005 . 1 . . . . A 13 U H1' . 35053 1 164 . 1 . 1 13 13 U H2' H 1 4.299 0.004 . 1 . . . . A 13 U H2' . 35053 1 165 . 1 . 1 13 13 U H3 H 1 13.499 0.014 . 1 . . . . A 13 U H3 . 35053 1 166 . 1 . 1 13 13 U H3' H 1 4.473 0.010 . 1 . . . . A 13 U H3' . 35053 1 167 . 1 . 1 13 13 U H4' H 1 4.368 0.007 . 1 . . . . A 13 U H4' . 35053 1 168 . 1 . 1 13 13 U H5 H 1 5.496 0.006 . 1 . . . . A 13 U H5 . 35053 1 169 . 1 . 1 13 13 U H5'' H 1 4.027 0.015 . 1 . . . . A 13 U H5'' . 35053 1 170 . 1 . 1 13 13 U H6 H 1 7.914 0.005 . 1 . . . . A 13 U H6 . 35053 1 171 . 1 . 1 13 13 U C1' C 13 90.893 0.000 . 1 . . . . A 13 U C1' . 35053 1 172 . 1 . 1 13 13 U C2' C 13 72.692 0.000 . 1 . . . . A 13 U C2' . 35053 1 173 . 1 . 1 13 13 U C4' C 13 79.329 0.000 . 1 . . . . A 13 U C4' . 35053 1 174 . 1 . 1 13 13 U C5 C 13 100.705 0.000 . 1 . . . . A 13 U C5 . 35053 1 175 . 1 . 1 13 13 U C5' C 13 61.828 0.000 . 1 . . . . A 13 U C5' . 35053 1 176 . 1 . 1 13 13 U C6 C 13 139.818 0.007 . 1 . . . . A 13 U C6 . 35053 1 177 . 1 . 1 14 14 C H1' H 1 5.428 0.001 . 1 . . . . A 14 C H1' . 35053 1 178 . 1 . 1 14 14 C H2' H 1 4.279 0.000 . 1 . . . . A 14 C H2' . 35053 1 179 . 1 . 1 14 14 C H3' H 1 4.421 0.004 . 1 . . . . A 14 C H3' . 35053 1 180 . 1 . 1 14 14 C H4' H 1 4.310 0.002 . 1 . . . . A 14 C H4' . 35053 1 181 . 1 . 1 14 14 C H5 H 1 5.471 0.004 . 1 . . . . A 14 C H5 . 35053 1 182 . 1 . 1 14 14 C H5' H 1 4.419 0.000 . 1 . . . . A 14 C H5' . 35053 1 183 . 1 . 1 14 14 C H5'' H 1 4.038 0.000 . 1 . . . . A 14 C H5'' . 35053 1 184 . 1 . 1 14 14 C H6 H 1 7.609 0.001 . 1 . . . . A 14 C H6 . 35053 1 185 . 1 . 1 14 14 C C1' C 13 91.103 0.000 . 1 . . . . A 14 C C1' . 35053 1 186 . 1 . 1 14 14 C C3' C 13 69.669 0.000 . 1 . . . . A 14 C C3' . 35053 1 187 . 1 . 1 14 14 C C4' C 13 79.171 0.000 . 1 . . . . A 14 C C4' . 35053 1 188 . 1 . 1 14 14 C C5 C 13 95.014 0.000 . 1 . . . . A 14 C C5 . 35053 1 189 . 1 . 1 14 14 C C5' C 13 61.818 0.000 . 1 . . . . A 14 C C5' . 35053 1 190 . 1 . 1 14 14 C C6 C 13 138.124 0.000 . 1 . . . . A 14 C C6 . 35053 1 191 . 1 . 1 15 15 G H1' H 1 5.608 0.004 . 1 . . . . A 15 G H1' . 35053 1 192 . 1 . 1 15 15 G H2' H 1 3.974 0.002 . 1 . . . . A 15 G H2' . 35053 1 193 . 1 . 1 15 15 G H3' H 1 4.170 0.001 . 1 . . . . A 15 G H3' . 35053 1 194 . 1 . 1 15 15 G H4' H 1 4.109 0.001 . 1 . . . . A 15 G H4' . 35053 1 195 . 1 . 1 15 15 G H5' H 1 4.292 0.002 . 1 . . . . A 15 G H5' . 35053 1 196 . 1 . 1 15 15 G H5'' H 1 3.952 0.000 . 1 . . . . A 15 G H5'' . 35053 1 197 . 1 . 1 15 15 G H8 H 1 7.542 0.001 . 1 . . . . A 15 G H8 . 35053 1 198 . 1 . 1 15 15 G C1' C 13 88.786 0.000 . 1 . . . . A 15 G C1' . 35053 1 199 . 1 . 1 15 15 G C2' C 13 74.934 0.000 . 1 . . . . A 15 G C2' . 35053 1 200 . 1 . 1 15 15 G C3' C 13 67.833 0.000 . 1 . . . . A 15 G C3' . 35053 1 201 . 1 . 1 15 15 G C4' C 13 81.485 0.000 . 1 . . . . A 15 G C4' . 35053 1 202 . 1 . 1 15 15 G C5' C 13 62.885 0.005 . 1 . . . . A 15 G C5' . 35053 1 203 . 1 . 1 15 15 G C8 C 13 134.897 0.000 . 1 . . . . A 15 G C8 . 35053 1 stop_ save_