################################### # 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 25997 _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-1H NOESY' 1 $sample_1 isotropic 25997 1 4 '2D 1H-13C HSQC' 3 $sample_3 isotropic 25997 1 6 '2D 1H-13C HSQC' 4 $sample_4 isotropic 25997 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 5.88 0 . 1 . . . A 693 G H1' . 25997 1 2 . 1 1 1 1 G H2' H 1 4.96 0 . 1 . . . A 693 G H2' . 25997 1 3 . 1 1 1 1 G H8 H 1 8.17 0 . 1 . . . A 693 G H8 . 25997 1 4 . 1 1 1 1 G C1' C 13 91.33 0 . 1 . . . A 693 G C1' . 25997 1 5 . 1 1 1 1 G C2' C 13 75.23 0 . 1 . . . A 693 G C2' . 25997 1 6 . 1 1 1 1 G C8 C 13 139.07 0 . 1 . . . A 693 G C8 . 25997 1 7 . 1 1 2 2 G H1' H 1 5.97 0 . 1 . . . A 694 G H1' . 25997 1 8 . 1 1 2 2 G H2' H 1 4.75 0 . 1 . . . A 694 G H2' . 25997 1 9 . 1 1 2 2 G H8 H 1 7.60 0 . 1 . . . A 694 G H8 . 25997 1 10 . 1 1 2 2 G C1' C 13 92.83 0 . 1 . . . A 694 G C1' . 25997 1 11 . 1 1 2 2 G C2' C 13 75.60 0 . 1 . . . A 694 G C2' . 25997 1 12 . 1 1 2 2 G C8 C 13 136.89 0 . 1 . . . A 694 G C8 . 25997 1 13 . 1 1 3 3 G H1' H 1 5.81 0 . 1 . . . A 695 G H1' . 25997 1 14 . 1 1 3 3 G H2' H 1 4.55 0 . 1 . . . A 695 G H2' . 25997 1 15 . 1 1 3 3 G H8 H 1 7.29 0 . 1 . . . A 695 G H8 . 25997 1 16 . 1 1 3 3 G C1' C 13 93.10 0 . 1 . . . A 695 G C1' . 25997 1 17 . 1 1 3 3 G C2' C 13 75.39 0 . 1 . . . A 695 G C2' . 25997 1 18 . 1 1 3 3 G C8 C 13 135.99 0 . 1 . . . A 695 G C8 . 25997 1 19 . 1 1 4 4 C H1' H 1 5.52 0 . 1 . . . A 696 C H1' . 25997 1 20 . 1 1 4 4 C H2' H 1 4.60 0 . 1 . . . A 696 C H2' . 25997 1 21 . 1 1 4 4 C H5 H 1 5.23 0 . 1 . . . A 696 C H5 . 25997 1 22 . 1 1 4 4 C H6 H 1 7.59 0 . 1 . . . A 696 C H6 . 25997 1 23 . 1 1 4 4 C C1' C 13 93.82 0 . 1 . . . A 696 C C1' . 25997 1 24 . 1 1 4 4 C C2' C 13 75.41 0 . 1 . . . A 696 C C2' . 25997 1 25 . 1 1 4 4 C C5 C 13 97.42 0 . 1 . . . A 696 C C5 . 25997 1 26 . 1 1 4 4 C C6 C 13 140.65 0 . 1 . . . A 696 C C6 . 25997 1 27 . 1 1 5 5 A H1' H 1 5.95 0 . 1 . . . A 697 A H1' . 25997 1 28 . 1 1 5 5 A H2 H 1 6.98 0 . 1 . . . A 697 A H2 . 25997 1 29 . 1 1 5 5 A H2' H 1 4.67 0 . 1 . . . A 697 A H2' . 25997 1 30 . 1 1 5 5 A H8 H 1 7.94 0 . 1 . . . A 697 A H8 . 25997 1 31 . 1 1 5 5 A C1' C 13 93.10 0 . 1 . . . A 697 A C1' . 25997 1 32 . 1 1 5 5 A C2 C 13 152.32 0 . 1 . . . A 697 A C2 . 25997 1 33 . 1 1 5 5 A C2' C 13 75.79 0 . 1 . . . A 697 A C2' . 25997 1 34 . 1 1 5 5 A C8 C 13 139.35 0 . 1 . . . A 697 A C8 . 25997 1 35 . 1 1 6 6 G H1' H 1 5.54 0 . 1 . . . A 698 G H1' . 25997 1 36 . 1 1 6 6 G H2' H 1 4.46 0 . 1 . . . A 698 G H2' . 25997 1 37 . 1 1 6 6 G H8 H 1 7.13 0 . 1 . . . A 698 G H8 . 25997 1 38 . 1 1 6 6 G C1' C 13 92.55 0 . 1 . . . A 698 G C1' . 25997 1 39 . 1 1 6 6 G C2' C 13 75.55 0 . 1 . . . A 698 G C2' . 25997 1 40 . 1 1 6 6 G C8 C 13 135.86 0 . 1 . . . A 698 G C8 . 25997 1 41 . 1 1 7 7 A H1' H 1 5.88 0 . 1 . . . A 699 A H1' . 25997 1 42 . 1 1 7 7 A H2 H 1 7.57 0 . 1 . . . A 699 A H2 . 25997 1 43 . 1 1 7 7 A H2' H 1 4.55 0 . 1 . . . A 699 A H2' . 25997 1 44 . 1 1 7 7 A H8 H 1 7.70 0 . 1 . . . A 699 A H8 . 25997 1 45 . 1 1 7 7 A C1' C 13 92.18 0 . 1 . . . A 699 A C1' . 25997 1 46 . 1 1 7 7 A C2 C 13 154.03 0 . 1 . . . A 699 A C2 . 25997 1 47 . 1 1 7 7 A C2' C 13 75.91 0 . 1 . . . A 699 A C2' . 25997 1 48 . 1 1 7 7 A C8 C 13 139.42 0 . 1 . . . A 699 A C8 . 25997 1 49 . 1 1 8 8 A H1' H 1 5.67 0 . 1 . . . A 700 A H1' . 25997 1 50 . 1 1 8 8 A H2 H 1 7.84 0 . 1 . . . A 700 A H2 . 25997 1 51 . 1 1 8 8 A H2' H 1 4.50 0 . 1 . . . A 700 A H2' . 25997 1 52 . 1 1 8 8 A H8 H 1 7.75 0 . 1 . . . A 700 A H8 . 25997 1 53 . 1 1 8 8 A C1' C 13 92.05 0 . 1 . . . A 700 A C1' . 25997 1 54 . 1 1 8 8 A C2 C 13 154.76 0 . 1 . . . A 700 A C2 . 25997 1 55 . 1 1 8 8 A C2' C 13 74.15 0 . 1 . . . A 700 A C2' . 25997 1 56 . 1 1 8 8 A C8 C 13 139.85 0 . 1 . . . A 700 A C8 . 25997 1 57 . 1 1 9 9 G H1' H 1 5.14 0 . 1 . . . A 701 G H1' . 25997 1 58 . 1 1 9 9 G H2' H 1 4.46 0 . 1 . . . A 701 G H2' . 25997 1 59 . 1 1 9 9 G H3' H 1 4.27 0 . 1 . . . A 701 G H3' . 25997 1 60 . 1 1 9 9 G H8 H 1 7.49 0 . 1 . . . A 701 G H8 . 25997 1 61 . 1 1 9 9 G C1' C 13 90.94 0 . 1 . . . A 701 G C1' . 25997 1 62 . 1 1 9 9 G C2' C 13 75.31 0 . 1 . . . A 701 G C2' . 25997 1 63 . 1 1 9 9 G C8 C 13 137.64 0 . 1 . . . A 701 G C8 . 25997 1 64 . 1 1 10 10 G H1' H 1 5.75 0 . 1 . . . A 702 G H1' . 25997 1 65 . 1 1 10 10 G H2' H 1 4.65 0 . 1 . . . A 702 G H2' . 25997 1 66 . 1 1 10 10 G H8 H 1 7.61 0 . 1 . . . A 702 G H8 . 25997 1 67 . 1 1 10 10 G C1' C 13 90.36 0 . 1 . . . A 702 G C1' . 25997 1 68 . 1 1 10 10 G C2' C 13 75.67 0 . 1 . . . A 702 G C2' . 25997 1 69 . 1 1 11 11 U H1' H 1 5.89 0 . 1 . . . A 703 U H1' . 25997 1 70 . 1 1 11 11 U H2' H 1 4.49 0 . 1 . . . A 703 U H2' . 25997 1 71 . 1 1 11 11 U H5 H 1 5.79 0 . 1 . . . A 703 U H5 . 25997 1 72 . 1 1 11 11 U H6 H 1 7.80 0 . 1 . . . A 703 U H6 . 25997 1 73 . 1 1 11 11 U C1' C 13 92.46 0 . 1 . . . A 703 U C1' . 25997 1 74 . 1 1 11 11 U C2' C 13 75.93 0 . 1 . . . A 703 U C2' . 25997 1 75 . 1 1 11 11 U C5 C 13 105.21 0 . 1 . . . A 703 U C5 . 25997 1 76 . 1 1 11 11 U C6 C 13 143.18 0 . 1 . . . A 703 U C6 . 25997 1 77 . 1 1 12 12 A H1' H 1 5.93 0 . 1 . . . A 704 A H1' . 25997 1 78 . 1 1 12 12 A H2 H 1 7.89 0 . 1 . . . A 704 A H2 . 25997 1 79 . 1 1 12 12 A H2' H 1 4.88 0 . 1 . . . A 704 A H2' . 25997 1 80 . 1 1 12 12 A H5' H 1 4.25 0 . 2 . . . A 704 A H5' . 25997 1 81 . 1 1 12 12 A H5'' H 1 4.48 0 . 2 . . . A 704 A H5'' . 25997 1 82 . 1 1 12 12 A H8 H 1 8.16 0 . 1 . . . A 704 A H8 . 25997 1 83 . 1 1 12 12 A C1' C 13 93.13 0 . 1 . . . A 704 A C1' . 25997 1 84 . 1 1 12 12 A C2 C 13 154.16 0 . 1 . . . A 704 A C2 . 25997 1 85 . 1 1 12 12 A C2' C 13 75.46 0 . 1 . . . A 704 A C2' . 25997 1 86 . 1 1 12 12 A C5' C 13 66.65 0 . 1 . . . A 704 A C5' . 25997 1 87 . 1 1 12 12 A C8 C 13 141.39 0 . 1 . . . A 704 A C8 . 25997 1 88 . 1 1 13 13 C H1' H 1 5.51 0 . 1 . . . A 705 C H1' . 25997 1 89 . 1 1 13 13 C H2' H 1 4.25 0 . 1 . . . A 705 C H2' . 25997 1 90 . 1 1 13 13 C H5 H 1 5.60 0 . 1 . . . A 705 C H5 . 25997 1 91 . 1 1 13 13 C H6 H 1 7.77 0 . 1 . . . A 705 C H6 . 25997 1 92 . 1 1 13 13 C C1' C 13 93.34 0 . 1 . . . A 705 C C1' . 25997 1 93 . 1 1 13 13 C C2' C 13 75.78 0 . 1 . . . A 705 C C2' . 25997 1 94 . 1 1 13 13 C C5 C 13 97.67 0 . 1 . . . A 705 C C5 . 25997 1 95 . 1 1 13 13 C C6 C 13 141.62 0 . 1 . . . A 705 C C6 . 25997 1 96 . 1 1 14 14 C H1' H 1 5.65 0 . 1 . . . A 706 C H1' . 25997 1 97 . 1 1 14 14 C H2' H 1 4.39 0 . 1 . . . A 706 C H2' . 25997 1 98 . 1 1 14 14 C H5 H 1 5.69 0 . 1 . . . A 706 C H5 . 25997 1 99 . 1 1 14 14 C H6 H 1 7.81 0 . 1 . . . A 706 C H6 . 25997 1 100 . 1 1 14 14 C C1' C 13 93.69 0 . 1 . . . A 706 C C1' . 25997 1 101 . 1 1 14 14 C C2' C 13 75.63 0 . 1 . . . A 706 C C2' . 25997 1 102 . 1 1 14 14 C C5 C 13 98.40 0 . 1 . . . A 706 C C5 . 25997 1 103 . 1 1 14 14 C C6 C 13 141.93 0 . 1 . . . A 706 C C6 . 25997 1 104 . 1 1 15 15 C H1' H 1 5.46 0 . 1 . . . A 707 C H1' . 25997 1 105 . 1 1 15 15 C H2' H 1 4.04 0 . 1 . . . A 707 C H2' . 25997 1 106 . 1 1 15 15 C H5 H 1 5.53 0 . 1 . . . A 707 C H5 . 25997 1 107 . 1 1 15 15 C H6 H 1 7.83 0 . 1 . . . A 707 C H6 . 25997 1 108 . 1 1 15 15 C C1' C 13 94.32 0 . 1 . . . A 707 C C1' . 25997 1 109 . 1 1 15 15 C C2' C 13 67.58 0 . 1 . . . A 707 C C2' . 25997 1 110 . 1 1 15 15 C C5 C 13 98.11 0 . 1 . . . A 707 C C5 . 25997 1 111 . 1 1 15 15 C C6 C 13 141.72 0 . 1 . . . A 707 C C6 . 25997 1 112 . 1 1 16 16 C H1' H 1 5.45 0 . 1 . . . A 708 C H1' . 25997 1 113 . 1 1 16 16 C H2' H 1 4.46 0 . 1 . . . A 708 C H2' . 25997 1 114 . 1 1 16 16 C H5 H 1 5.52 0 . 1 . . . A 708 C H5 . 25997 1 115 . 1 1 16 16 C H6 H 1 7.77 0 . 1 . . . A 708 C H6 . 25997 1 116 . 1 1 16 16 C C1' C 13 94.15 0 . 1 . . . A 708 C C1' . 25997 1 117 . 1 1 16 16 C C2' C 13 75.24 0 . 1 . . . A 708 C C2' . 25997 1 118 . 1 1 16 16 C C5 C 13 97.49 0 . 1 . . . A 708 C C5 . 25997 1 119 . 1 1 16 16 C C6 C 13 141.37 0 . 1 . . . A 708 C C6 . 25997 1 120 . 1 1 17 17 A H1' H 1 5.96 0 . 1 . . . A 709 A H1' . 25997 1 121 . 1 1 17 17 A H2 H 1 7.48 0 . 1 . . . A 709 A H2 . 25997 1 122 . 1 1 17 17 A H2' H 1 4.39 0 . 1 . . . A 709 A H2' . 25997 1 123 . 1 1 17 17 A H8 H 1 8.06 0 . 1 . . . A 709 A H8 . 25997 1 124 . 1 1 17 17 A C1' C 13 93.15 0 . 1 . . . A 709 A C1' . 25997 1 125 . 1 1 17 17 A C2 C 13 153.84 0 . 1 . . . A 709 A C2 . 25997 1 126 . 1 1 17 17 A C2' C 13 75.86 0 . 1 . . . A 709 A C2' . 25997 1 127 . 1 1 17 17 A C8 C 13 139.64 0 . 1 . . . A 709 A C8 . 25997 1 128 . 1 1 18 18 U H1' H 1 5.67 0 . 1 . . . A 710 U H1' . 25997 1 129 . 1 1 18 18 U H2' H 1 4.26 0 . 1 . . . A 710 U H2' . 25997 1 130 . 1 1 18 18 U H5 H 1 5.21 0 . 1 . . . A 710 U H5 . 25997 1 131 . 1 1 18 18 U H6 H 1 7.39 0 . 1 . . . A 710 U H6 . 25997 1 132 . 1 1 18 18 U C1' C 13 90.47 0 . 1 . . . A 710 U C1' . 25997 1 133 . 1 1 18 18 U C2' C 13 75.75 0 . 1 . . . A 710 U C2' . 25997 1 134 . 1 1 18 18 U C5 C 13 104.45 0 . 1 . . . A 710 U C5 . 25997 1 135 . 1 1 18 18 U C6 C 13 141.63 0 . 1 . . . A 710 U C6 . 25997 1 136 . 1 1 19 19 U H1' H 1 5.87 0 . 1 . . . A 711 U H1' . 25997 1 137 . 1 1 19 19 U H2' H 1 4.36 0 . 1 . . . A 711 U H2' . 25997 1 138 . 1 1 19 19 U H5 H 1 5.86 0 . 1 . . . A 711 U H5 . 25997 1 139 . 1 1 19 19 U H6 H 1 7.86 0 . 1 . . . A 711 U H6 . 25997 1 140 . 1 1 19 19 U C1' C 13 90.89 0 . 1 . . . A 711 U C1' . 25997 1 141 . 1 1 19 19 U C2' C 13 76.19 0 . 1 . . . A 711 U C2' . 25997 1 142 . 1 1 19 19 U C5 C 13 105.05 0 . 1 . . . A 711 U C5 . 25997 1 143 . 1 1 19 19 U C6 C 13 143.53 0 . 1 . . . A 711 U C6 . 25997 1 144 . 1 1 20 20 G H1' H 1 5.40 0 . 1 . . . A 712 G H1' . 25997 1 145 . 1 1 20 20 G H2' H 1 4.42 0 . 1 . . . A 712 G H2' . 25997 1 146 . 1 1 20 20 G H3' H 1 4.59 0 . 1 . . . A 712 G H3' . 25997 1 147 . 1 1 20 20 G H4' H 1 3.87 0 . 1 . . . A 712 G H4' . 25997 1 148 . 1 1 20 20 G H5' H 1 3.99 0 . 2 . . . A 712 G H5' . 25997 1 149 . 1 1 20 20 G H5'' H 1 4.13 0 . 2 . . . A 712 G H5'' . 25997 1 150 . 1 1 20 20 G H8 H 1 7.84 0 . 1 . . . A 712 G H8 . 25997 1 151 . 1 1 20 20 G C1' C 13 89.20 0 . 1 . . . A 712 G C1' . 25997 1 152 . 1 1 20 20 G C2' C 13 77.00 0 . 1 . . . A 712 G C2' . 25997 1 153 . 1 1 20 20 G C4' C 13 86.08 0 . 1 . . . A 712 G C4' . 25997 1 154 . 1 1 20 20 G C5' C 13 68.06 0 . 1 . . . A 712 G C5' . 25997 1 155 . 1 1 20 20 G C8 C 13 140.06 0 . 1 . . . A 712 G C8 . 25997 1 156 . 1 1 21 21 U H1' H 1 5.88 0 . 1 . . . A 713 U H1' . 25997 1 157 . 1 1 21 21 U H2' H 1 4.33 0 . 1 . . . A 713 U H2' . 25997 1 158 . 1 1 21 21 U H3' H 1 4.70 0 . 1 . . . A 713 U H3' . 25997 1 159 . 1 1 21 21 U H4' H 1 4.43 0 . 1 . . . A 713 U H4' . 25997 1 160 . 1 1 21 21 U H5 H 1 5.86 0 . 1 . . . A 713 U H5 . 25997 1 161 . 1 1 21 21 U H5' H 1 3.98 0 . 2 . . . A 713 U H5' . 25997 1 162 . 1 1 21 21 U H5'' H 1 3.92 0 . 2 . . . A 713 U H5'' . 25997 1 163 . 1 1 21 21 U H6 H 1 7.74 0 . 1 . . . A 713 U H6 . 25997 1 164 . 1 1 21 21 U C1' C 13 90.05 0 . 1 . . . A 713 U C1' . 25997 1 165 . 1 1 21 21 U C2' C 13 75.70 0 . 1 . . . A 713 U C2' . 25997 1 166 . 1 1 21 21 U C3' C 13 77.58 0 . 1 . . . A 713 U C3' . 25997 1 167 . 1 1 21 21 U C5 C 13 105.52 0 . 1 . . . A 713 U C5 . 25997 1 168 . 1 1 21 21 U C5' C 13 68.08 0 . 1 . . . A 713 U C5' . 25997 1 169 . 1 1 21 21 U C6 C 13 143.94 0 . 1 . . . A 713 U C6 . 25997 1 170 . 1 1 22 22 A H1' H 1 5.92 0 . 1 . . . A 714 A H1' . 25997 1 171 . 1 1 22 22 A H2 H 1 7.94 0 . 1 . . . A 714 A H2 . 25997 1 172 . 1 1 22 22 A H2' H 1 4.87 0 . 1 . . . A 714 A H2' . 25997 1 173 . 1 1 22 22 A H3' H 1 4.76 0 . 1 . . . A 714 A H3' . 25997 1 174 . 1 1 22 22 A H4' H 1 4.61 0 . 1 . . . A 714 A H4' . 25997 1 175 . 1 1 22 22 A H5' H 1 4.27 0 . 2 . . . A 714 A H5' . 25997 1 176 . 1 1 22 22 A H5'' H 1 4.30 0 . 2 . . . A 714 A H5'' . 25997 1 177 . 1 1 22 22 A H8 H 1 8.45 0 . 1 . . . A 714 A H8 . 25997 1 178 . 1 1 22 22 A C1' C 13 89.65 0 . 1 . . . A 714 A C1' . 25997 1 179 . 1 1 22 22 A C2 C 13 154.83 0 . 1 . . . A 714 A C2 . 25997 1 180 . 1 1 22 22 A C2' C 13 75.08 0 . 1 . . . A 714 A C2' . 25997 1 181 . 1 1 22 22 A C3' C 13 76.43 0 . 1 . . . A 714 A C3' . 25997 1 182 . 1 1 22 22 A C4' C 13 84.65 0 . 1 . . . A 714 A C4' . 25997 1 183 . 1 1 22 22 A C5' C 13 68.32 0 . 1 . . . A 714 A C5' . 25997 1 184 . 1 1 22 22 A C8 C 13 141.39 0 . 1 . . . A 714 A C8 . 25997 1 185 . 1 1 23 23 U H1' H 1 5.85 0 . 1 . . . A 715 U H1' . 25997 1 186 . 1 1 23 23 U H2' H 1 4.68 0 . 1 . . . A 715 U H2' . 25997 1 187 . 1 1 23 23 U H5 H 1 5.20 0 . 1 . . . A 715 U H5 . 25997 1 188 . 1 1 23 23 U H6 H 1 7.74 0 . 1 . . . A 715 U H6 . 25997 1 189 . 1 1 23 23 U C1' C 13 93.26 0 . 1 . . . A 715 U C1' . 25997 1 190 . 1 1 23 23 U C2' C 13 75.20 0 . 1 . . . A 715 U C2' . 25997 1 191 . 1 1 23 23 U C5 C 13 103.62 0 . 1 . . . A 715 U C5 . 25997 1 192 . 1 1 23 23 U C6 C 13 142.52 0 . 1 . . . A 715 U C6 . 25997 1 193 . 1 1 24 24 G H1' H 1 5.93 0 . 1 . . . A 716 G H1' . 25997 1 194 . 1 1 24 24 G H2' H 1 4.66 0 . 1 . . . A 716 G H2' . 25997 1 195 . 1 1 24 24 G H8 H 1 7.76 0 . 1 . . . A 716 G H8 . 25997 1 196 . 1 1 24 24 G C1' C 13 92.47 0 . 1 . . . A 716 G C1' . 25997 1 197 . 1 1 24 24 G C2' C 13 75.60 0 . 1 . . . A 716 G C2' . 25997 1 198 . 1 1 24 24 G C8 C 13 136.48 0 . 1 . . . A 716 G C8 . 25997 1 199 . 1 1 25 25 G H1' H 1 5.72 0 . 1 . . . A 717 G H1' . 25997 1 200 . 1 1 25 25 G H2' H 1 4.47 0 . 1 . . . A 717 G H2' . 25997 1 201 . 1 1 25 25 G H8 H 1 7.20 0 . 1 . . . A 717 G H8 . 25997 1 202 . 1 1 25 25 G C1' C 13 92.71 0 . 1 . . . A 717 G C1' . 25997 1 203 . 1 1 25 25 G C2' C 13 72.99 0 . 1 . . . A 717 G C2' . 25997 1 204 . 1 1 25 25 G C8 C 13 135.89 0 . 1 . . . A 717 G C8 . 25997 1 205 . 1 1 26 26 G H1' H 1 5.74 0 . 1 . . . A 718 G H1' . 25997 1 206 . 1 1 26 26 G H2' H 1 4.61 0 . 1 . . . A 718 G H2' . 25997 1 207 . 1 1 26 26 G H8 H 1 7.11 0 . 1 . . . A 718 G H8 . 25997 1 208 . 1 1 26 26 G C1' C 13 92.98 0 . 1 . . . A 718 G C1' . 25997 1 209 . 1 1 26 26 G C2' C 13 75.55 0 . 1 . . . A 718 G C2' . 25997 1 210 . 1 1 26 26 G C8 C 13 136.27 0 . 1 . . . A 718 G C8 . 25997 1 211 . 1 1 27 27 A H1' H 1 6.05 0 . 1 . . . A 719 A H1' . 25997 1 212 . 1 1 27 27 A H2 H 1 8.16 0 . 1 . . . A 719 A H2 . 25997 1 213 . 1 1 27 27 A H2' H 1 4.62 0 . 1 . . . A 719 A H2' . 25997 1 214 . 1 1 27 27 A H8 H 1 7.85 0 . 1 . . . A 719 A H8 . 25997 1 215 . 1 1 27 27 A C1' C 13 93.27 0 . 1 . . . A 719 A C1' . 25997 1 216 . 1 1 27 27 A C2' C 13 75.80 0 . 1 . . . A 719 A C2' . 25997 1 217 . 1 1 27 27 A C8 C 13 140.76 0 . 1 . . . A 719 A C8 . 25997 1 218 . 1 1 28 28 U H1' H 1 5.40 0 . 1 . . . A 720 U H1' . 25997 1 219 . 1 1 28 28 U H2' H 1 4.32 0 . 1 . . . A 720 U H2' . 25997 1 220 . 1 1 28 28 U H5 H 1 5.33 0 . 1 . . . A 720 U H5 . 25997 1 221 . 1 1 28 28 U H6 H 1 7.58 0 . 1 . . . A 720 U H6 . 25997 1 222 . 1 1 28 28 U C1' C 13 93.40 0 . 1 . . . A 720 U C1' . 25997 1 223 . 1 1 28 28 U C2' C 13 75.48 0 . 1 . . . A 720 U C2' . 25997 1 224 . 1 1 28 28 U C5 C 13 103.43 0 . 1 . . . A 720 U C5 . 25997 1 225 . 1 1 28 28 U C6 C 13 141.20 0 . 1 . . . A 720 U C6 . 25997 1 226 . 1 1 29 29 C H1' H 1 5.59 0 . 1 . . . A 721 C H1' . 25997 1 227 . 1 1 29 29 C H2' H 1 4.42 0 . 1 . . . A 721 C H2' . 25997 1 228 . 1 1 29 29 C H5 H 1 5.63 0 . 1 . . . A 721 C H5 . 25997 1 229 . 1 1 29 29 C H6 H 1 7.79 0 . 1 . . . A 721 C H6 . 25997 1 230 . 1 1 29 29 C C1' C 13 93.40 0 . 1 . . . A 721 C C1' . 25997 1 231 . 1 1 29 29 C C2' C 13 75.61 0 . 1 . . . A 721 C C2' . 25997 1 232 . 1 1 29 29 C C5 C 13 97.97 0 . 1 . . . A 721 C C5 . 25997 1 233 . 1 1 29 29 C C6 C 13 141.82 0 . 1 . . . A 721 C C6 . 25997 1 234 . 1 1 30 30 U H1' H 1 5.52 0 . 1 . . . A 722 U H1' . 25997 1 235 . 1 1 30 30 U H2' H 1 4.14 0 . 1 . . . A 722 U H2' . 25997 1 236 . 1 1 30 30 U H5 H 1 5.57 0 . 1 . . . A 722 U H5 . 25997 1 237 . 1 1 30 30 U H6 H 1 7.65 0 . 1 . . . A 722 U H6 . 25997 1 238 . 1 1 30 30 U C1' C 13 93.51 0 . 1 . . . A 722 U C1' . 25997 1 239 . 1 1 30 30 U C2' C 13 75.51 0 . 1 . . . A 722 U C2' . 25997 1 240 . 1 1 30 30 U C5 C 13 104.70 0 . 1 . . . A 722 U C5 . 25997 1 241 . 1 1 30 30 U C6 C 13 141.47 0 . 1 . . . A 722 U C6 . 25997 1 242 . 1 1 31 31 G H1' H 1 5.56 0 . 1 . . . A 723 G H1' . 25997 1 243 . 1 1 31 31 G H2' H 1 4.54 0 . 1 . . . A 723 G H2' . 25997 1 244 . 1 1 31 31 G H3' H 1 4.79 0 . 1 . . . A 723 G H3' . 25997 1 245 . 1 1 31 31 G H8 H 1 7.83 0 . 1 . . . A 723 G H8 . 25997 1 246 . 1 1 31 31 G C1' C 13 90.02 0 . 1 . . . A 723 G C1' . 25997 1 247 . 1 1 31 31 G C2' C 13 75.97 0 . 1 . . . A 723 G C2' . 25997 1 248 . 1 1 31 31 G C3' C 13 75.64 0 . 1 . . . A 723 G C3' . 25997 1 249 . 1 1 31 31 G C8 C 13 138.67 0 . 1 . . . A 723 G C8 . 25997 1 250 . 1 1 32 32 A H1' H 1 5.97 0 . 1 . . . A 724 A H1' . 25997 1 251 . 1 1 32 32 A H2 H 1 7.87 0 . 1 . . . A 724 A H2 . 25997 1 252 . 1 1 32 32 A H2' H 1 4.75 0 . 1 . . . A 724 A H2' . 25997 1 253 . 1 1 32 32 A H8 H 1 8.29 0 . 1 . . . A 724 A H8 . 25997 1 254 . 1 1 32 32 A C1' C 13 90.11 0 . 1 . . . A 724 A C1' . 25997 1 255 . 1 1 32 32 A C2 C 13 154.91 0 . 1 . . . A 724 A C2 . 25997 1 256 . 1 1 32 32 A C2' C 13 76.16 0 . 1 . . . A 724 A C2' . 25997 1 257 . 1 1 32 32 A C8 C 13 141.55 0 . 1 . . . A 724 A C8 . 25997 1 258 . 1 1 33 33 U H1' H 1 5.61 0 . 1 . . . A 725 U H1' . 25997 1 259 . 1 1 33 33 U H2' H 1 4.59 0 . 1 . . . A 725 U H2' . 25997 1 260 . 1 1 33 33 U H5 H 1 5.80 0 . 1 . . . A 725 U H5 . 25997 1 261 . 1 1 33 33 U H6 H 1 7.91 0 . 1 . . . A 725 U H6 . 25997 1 262 . 1 1 33 33 U C1' C 13 92.21 0 . 1 . . . A 725 U C1' . 25997 1 263 . 1 1 33 33 U C2' C 13 75.13 0 . 1 . . . A 725 U C2' . 25997 1 264 . 1 1 33 33 U C5 C 13 104.55 0 . 1 . . . A 725 U C5 . 25997 1 265 . 1 1 33 33 U C6 C 13 143.11 0 . 1 . . . A 725 U C6 . 25997 1 266 . 1 1 34 34 C H1' H 1 5.53 0 . 1 . . . A 726 C H1' . 25997 1 267 . 1 1 34 34 C H2' H 1 4.42 0 . 1 . . . A 726 C H2' . 25997 1 268 . 1 1 34 34 C H5 H 1 5.78 0 . 1 . . . A 726 C H5 . 25997 1 269 . 1 1 34 34 C H6 H 1 7.85 0 . 1 . . . A 726 C H6 . 25997 1 270 . 1 1 34 34 C C1' C 13 94.42 0 . 1 . . . A 726 C C1' . 25997 1 271 . 1 1 34 34 C C2' C 13 75.36 0 . 1 . . . A 726 C C2' . 25997 1 272 . 1 1 34 34 C C5 C 13 97.92 0 . 1 . . . A 726 C C5 . 25997 1 273 . 1 1 34 34 C C6 C 13 142.12 0 . 1 . . . A 726 C C6 . 25997 1 274 . 1 1 35 35 U H1' H 1 5.50 0 . 1 . . . A 727 U H1' . 25997 1 275 . 1 1 35 35 U H2' H 1 4.60 0 . 1 . . . A 727 U H2' . 25997 1 276 . 1 1 35 35 U H5 H 1 5.44 0 . 1 . . . A 727 U H5 . 25997 1 277 . 1 1 35 35 U H6 H 1 7.90 0 . 1 . . . A 727 U H6 . 25997 1 278 . 1 1 35 35 U C1' C 13 93.51 0 . 1 . . . A 727 U C1' . 25997 1 279 . 1 1 35 35 U C2' C 13 75.27 0 . 1 . . . A 727 U C2' . 25997 1 280 . 1 1 35 35 U C5 C 13 103.63 0 . 1 . . . A 727 U C5 . 25997 1 281 . 1 1 35 35 U C6 C 13 141.84 0 . 1 . . . A 727 U C6 . 25997 1 282 . 1 1 36 36 G H1' H 1 5.82 0 . 1 . . . A 728 G H1' . 25997 1 283 . 1 1 36 36 G H2' H 1 4.73 0 . 1 . . . A 728 G H2' . 25997 1 284 . 1 1 36 36 G H8 H 1 7.81 0 . 1 . . . A 728 G H8 . 25997 1 285 . 1 1 36 36 G C1' C 13 92.58 0 . 1 . . . A 728 G C1' . 25997 1 286 . 1 1 36 36 G C8 C 13 136.42 0 . 1 . . . A 728 G C8 . 25997 1 287 . 1 1 37 37 C H1' H 1 5.49 0 . 1 . . . A 729 C H1' . 25997 1 288 . 1 1 37 37 C H2' H 1 4.36 0 . 1 . . . A 729 C H2' . 25997 1 289 . 1 1 37 37 C H5 H 1 5.25 0 . 1 . . . A 729 C H5 . 25997 1 290 . 1 1 37 37 C H6 H 1 7.71 0 . 1 . . . A 729 C H6 . 25997 1 291 . 1 1 37 37 C C1' C 13 93.82 0 . 1 . . . A 729 C C1' . 25997 1 292 . 1 1 37 37 C C5 C 13 96.97 0 . 1 . . . A 729 C C5 . 25997 1 293 . 1 1 37 37 C C6 C 13 141.11 0 . 1 . . . A 729 C C6 . 25997 1 294 . 1 1 38 38 C H5 H 1 5.50 0 . 1 . . . A 730 C H5 . 25997 1 295 . 1 1 38 38 C H6 H 1 7.79 0 . 1 . . . A 730 C H6 . 25997 1 296 . 1 1 38 38 C C5 C 13 97.70 0 . 1 . . . A 730 C C5 . 25997 1 297 . 1 1 38 38 C C6 C 13 141.40 0 . 1 . . . A 730 C C6 . 25997 1 stop_ save_