################################### # 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 18838 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 2 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_2 _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' . . . 18838 1 11 '2D 1H-1H NOESY' . . . 18838 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 5.888 0.01 . 1 . . . A 1 G H1' . 18838 1 2 . 1 1 1 1 G H3' H 1 4.532 0.01 . 1 . . . A 1 G H3' . 18838 1 3 . 1 1 1 1 G H5' H 1 4.188 0.01 . 2 . . . A 1 G H5' . 18838 1 4 . 1 1 1 1 G H5'' H 1 4.326 0.01 . 2 . . . A 1 G H5'' . 18838 1 5 . 1 1 1 1 G H8 H 1 8.121 0.01 . 1 . . . A 1 G H8 . 18838 1 6 . 1 1 1 1 G H2' H 1 4.950 0.01 . 1 . . . A 1 G H2' . 18838 1 7 . 1 1 2 2 G H1 H 1 12.893 0.01 . 1 . . . A 2 G H1 . 18838 1 8 . 1 1 2 2 G H3' H 1 4.560 0.01 . 1 . . . A 2 G H3' . 18838 1 9 . 1 1 2 2 G H5'' H 1 4.261 0.01 . 1 . . . A 2 G H5'' . 18838 1 10 . 1 1 2 2 G H8 H 1 7.556 0.01 . 1 . . . A 2 G H8 . 18838 1 11 . 1 1 2 2 G H21 H 1 8.450 0.01 . 1 . . . A 2 G H21 . 18838 1 12 . 1 1 2 2 G H22 H 1 6.017 0.01 . 1 . . . A 2 G H22 . 18838 1 13 . 1 1 2 2 G H2' H 1 4.772 0.01 . 1 . . . A 2 G H2' . 18838 1 14 . 1 1 3 3 G H1 H 1 13.256 0.01 . 1 . . . A 3 G H1 . 18838 1 15 . 1 1 3 3 G H1' H 1 5.812 0.01 . 1 . . . A 3 G H1' . 18838 1 16 . 1 1 3 3 G H3' H 1 4.444 0.01 . 1 . . . A 3 G H3' . 18838 1 17 . 1 1 3 3 G H5' H 1 4.501 0.01 . 1 . . . A 3 G H5' . 18838 1 18 . 1 1 3 3 G H5'' H 1 4.101 0.01 . 1 . . . A 3 G H5'' . 18838 1 19 . 1 1 3 3 G H8 H 1 7.141 0.01 . 1 . . . A 3 G H8 . 18838 1 20 . 1 1 3 3 G H21 H 1 8.518 0.01 . 1 . . . A 3 G H21 . 18838 1 21 . 1 1 3 3 G H22 H 1 6.098 0.01 . 1 . . . A 3 G H22 . 18838 1 22 . 1 1 3 3 G H2' H 1 4.518 0.01 . 1 . . . A 3 G H2' . 18838 1 23 . 1 1 4 4 U H1' H 1 5.591 0.01 . 1 . . . A 4 U H1' . 18838 1 24 . 1 1 4 4 U H3 H 1 13.732 0.01 . 1 . . . A 4 U H3 . 18838 1 25 . 1 1 4 4 U H3' H 1 4.525 0.01 . 1 . . . A 4 U H3' . 18838 1 26 . 1 1 4 4 U H4' H 1 4.450 0.01 . 1 . . . A 4 U H4' . 18838 1 27 . 1 1 4 4 U H5 H 1 5.135 0.01 . 1 . . . A 4 U H5 . 18838 1 28 . 1 1 4 4 U H6 H 1 7.695 0.01 . 1 . . . A 4 U H6 . 18838 1 29 . 1 1 4 4 U H2' H 1 4.761 0.01 . 1 . . . A 4 U H2' . 18838 1 30 . 1 1 5 5 G H1 H 1 12.750 0.01 . 1 . . . A 5 G H1 . 18838 1 31 . 1 1 5 5 G H1' H 1 5.812 0.01 . 1 . . . A 5 G H1' . 18838 1 32 . 1 1 5 5 G H3' H 1 4.443 0.01 . 1 . . . A 5 G H3' . 18838 1 33 . 1 1 5 5 G H5' H 1 4.496 0.01 . 1 . . . A 5 G H5' . 18838 1 34 . 1 1 5 5 G H5'' H 1 4.144 0.01 . 1 . . . A 5 G H5'' . 18838 1 35 . 1 1 5 5 G H8 H 1 7.673 0.01 . 1 . . . A 5 G H8 . 18838 1 36 . 1 1 5 5 G H21 H 1 7.911 0.01 . 1 . . . A 5 G H21 . 18838 1 37 . 1 1 5 5 G H22 H 1 5.957 0.01 . 1 . . . A 5 G H22 . 18838 1 38 . 1 1 5 5 G H2' H 1 4.587 0.01 . 1 . . . A 5 G H2' . 18838 1 39 . 1 1 6 6 U H1' H 1 5.550 0.01 . 1 . . . A 6 U H1' . 18838 1 40 . 1 1 6 6 U H3 H 1 12.023 0.01 . 1 . . . A 6 U H3 . 18838 1 41 . 1 1 6 6 U H3' H 1 4.545 0.01 . 1 . . . A 6 U H3' . 18838 1 42 . 1 1 6 6 U H4' H 1 4.399 0.01 . 1 . . . A 6 U H4' . 18838 1 43 . 1 1 6 6 U H5 H 1 5.451 0.01 . 1 . . . A 6 U H5 . 18838 1 44 . 1 1 6 6 U H6 H 1 7.637 0.01 . 1 . . . A 6 U H6 . 18838 1 45 . 1 1 6 6 U H2' H 1 4.250 0.01 . 1 . . . A 6 U H2' . 18838 1 46 . 1 1 7 7 A H1' H 1 5.958 0.01 . 1 . . . A 7 A H1' . 18838 1 47 . 1 1 7 7 A H2 H 1 7.763 0.01 . 1 . . . A 7 A H2 . 18838 1 48 . 1 1 7 7 A H3' H 1 4.550 0.01 . 1 . . . A 7 A H3' . 18838 1 49 . 1 1 7 7 A H4' H 1 4.509 0.01 . 1 . . . A 7 A H4' . 18838 1 50 . 1 1 7 7 A H5' H 1 4.346 0.01 . 1 . . . A 7 A H5' . 18838 1 51 . 1 1 7 7 A H5'' H 1 4.146 0.01 . 1 . . . A 7 A H5'' . 18838 1 52 . 1 1 7 7 A H8 H 1 8.247 0.01 . 1 . . . A 7 A H8 . 18838 1 53 . 1 1 7 7 A H2' H 1 4.621 0.01 . 1 . . . A 7 A H2' . 18838 1 54 . 1 1 8 8 U H1' H 1 5.621 0.01 . 1 . . . A 8 U H1' . 18838 1 55 . 1 1 8 8 U H3' H 1 4.492 0.01 . 1 . . . A 8 U H3' . 18838 1 56 . 1 1 8 8 U H4' H 1 4.368 0.01 . 1 . . . A 8 U H4' . 18838 1 57 . 1 1 8 8 U H5 H 1 5.473 0.01 . 1 . . . A 8 U H5 . 18838 1 58 . 1 1 8 8 U H5' H 1 4.094 0.01 . 1 . . . A 8 U H5' . 18838 1 59 . 1 1 8 8 U H6 H 1 7.626 0.01 . 1 . . . A 8 U H6 . 18838 1 60 . 1 1 8 8 U H2' H 1 4.286 0.01 . 1 . . . A 8 U H2' . 18838 1 61 . 1 1 9 9 U H1' H 1 5.711 0.01 . 1 . . . A 9 U H1' . 18838 1 62 . 1 1 9 9 U H3' H 1 4.400 0.01 . 1 . . . A 9 U H3' . 18838 1 63 . 1 1 9 9 U H5 H 1 5.668 0.01 . 1 . . . A 9 U H5 . 18838 1 64 . 1 1 9 9 U H5'' H 1 4.067 0.01 . 1 . . . A 9 U H5'' . 18838 1 65 . 1 1 9 9 U H6 H 1 7.662 0.01 . 1 . . . A 9 U H6 . 18838 1 66 . 1 1 9 9 U H2' H 1 4.250 0.01 . 1 . . . A 9 U H2' . 18838 1 67 . 1 1 10 10 G H1' H 1 5.606 0.01 . 1 . . . A 10 G H1' . 18838 1 68 . 1 1 10 10 G H4' H 1 4.314 0.01 . 1 . . . A 10 G H4' . 18838 1 69 . 1 1 10 10 G H8 H 1 7.848 0.01 . 1 . . . A 10 G H8 . 18838 1 70 . 1 1 10 10 G H2' H 1 4.644 0.01 . 1 . . . A 10 G H2' . 18838 1 71 . 1 1 11 11 G H1' H 1 5.614 0.01 . 1 . . . A 11 G H1' . 18838 1 72 . 1 1 11 11 G H4' H 1 4.367 0.01 . 1 . . . A 11 G H4' . 18838 1 73 . 1 1 11 11 G H5'' H 1 4.099 0.01 . 1 . . . A 11 G H5'' . 18838 1 74 . 1 1 11 11 G H8 H 1 7.859 0.01 . 1 . . . A 11 G H8 . 18838 1 75 . 1 1 11 11 G H2' H 1 4.729 0.01 . 1 . . . A 11 G H2' . 18838 1 76 . 1 1 12 12 A H1' H 1 5.826 0.01 . 1 . . . A 12 A H1' . 18838 1 77 . 1 1 12 12 A H2 H 1 7.955 0.01 . 1 . . . A 12 A H2 . 18838 1 78 . 1 1 12 12 A H4' H 1 4.378 0.01 . 1 . . . A 12 A H4' . 18838 1 79 . 1 1 12 12 A H5' H 1 4.109 0.01 . 2 . . . A 12 A H5' . 18838 1 80 . 1 1 12 12 A H5'' H 1 4.137 0.01 . 2 . . . A 12 A H5'' . 18838 1 81 . 1 1 12 12 A H8 H 1 8.208 0.01 . 1 . . . A 12 A H8 . 18838 1 82 . 1 1 12 12 A H2' H 1 4.645 0.01 . 1 . . . A 12 A H2' . 18838 1 83 . 1 1 13 13 A H1' H 1 5.830 0.01 . 1 . . . A 13 A H1' . 18838 1 84 . 1 1 13 13 A H2 H 1 7.928 0.01 . 1 . . . A 13 A H2 . 18838 1 85 . 1 1 13 13 A H4' H 1 4.431 0.01 . 1 . . . A 13 A H4' . 18838 1 86 . 1 1 13 13 A H8 H 1 8.175 0.01 . 1 . . . A 13 A H8 . 18838 1 87 . 1 1 13 13 A H2' H 1 4.775 0.01 . 1 . . . A 13 A H2' . 18838 1 88 . 1 1 14 14 A H1' H 1 5.832 0.01 . 1 . . . A 14 A H1' . 18838 1 89 . 1 1 14 14 A H2 H 1 8.005 0.01 . 1 . . . A 14 A H2 . 18838 1 90 . 1 1 14 14 A H4' H 1 4.484 0.01 . 1 . . . A 14 A H4' . 18838 1 91 . 1 1 14 14 A H5' H 1 4.147 0.01 . 1 . . . A 14 A H5' . 18838 1 92 . 1 1 14 14 A H5'' H 1 4.184 0.01 . 1 . . . A 14 A H5'' . 18838 1 93 . 1 1 14 14 A H8 H 1 8.175 0.01 . 1 . . . A 14 A H8 . 18838 1 94 . 1 1 14 14 A H2' H 1 4.589 0.01 . 1 . . . A 14 A H2' . 18838 1 95 . 1 1 15 15 U H1' H 1 5.739 0.01 . 1 . . . A 15 U H1' . 18838 1 96 . 1 1 15 15 U H4' H 1 4.367 0.01 . 1 . . . A 15 U H4' . 18838 1 97 . 1 1 15 15 U H5'' H 1 4.143 0.01 . 1 . . . A 15 U H5'' . 18838 1 98 . 1 1 15 15 U H6 H 1 7.666 0.01 . 1 . . . A 15 U H6 . 18838 1 99 . 1 1 15 15 U H2' H 1 4.300 0.01 . 1 . . . A 15 U H2' . 18838 1 100 . 1 1 16 16 G H1' H 1 5.544 0.01 . 1 . . . A 16 G H1' . 18838 1 101 . 1 1 16 16 G H4' H 1 4.403 0.01 . 1 . . . A 16 G H4' . 18838 1 102 . 1 1 16 16 G H5' H 1 4.141 0.01 . 1 . . . A 16 G H5' . 18838 1 103 . 1 1 16 16 G H5'' H 1 4.225 0.01 . 1 . . . A 16 G H5'' . 18838 1 104 . 1 1 16 16 G H8 H 1 7.810 0.01 . 1 . . . A 16 G H8 . 18838 1 105 . 1 1 16 16 G H2' H 1 4.643 0.01 . 1 . . . A 16 G H2' . 18838 1 106 . 1 1 17 17 A H1' H 1 6.006 0.01 . 1 . . . A 17 A H1' . 18838 1 107 . 1 1 17 17 A H2 H 1 8.013 0.01 . 1 . . . A 17 A H2 . 18838 1 108 . 1 1 17 17 A H5' H 1 4.248 0.01 . 1 . . . A 17 A H5' . 18838 1 109 . 1 1 17 17 A H5'' H 1 4.395 0.01 . 1 . . . A 17 A H5'' . 18838 1 110 . 1 1 17 17 A H8 H 1 8.197 0.01 . 1 . . . A 17 A H8 . 18838 1 111 . 1 1 17 17 A H2' H 1 4.837 0.01 . 1 . . . A 17 A H2' . 18838 1 112 . 1 1 18 18 G H1 H 1 10.973 0.01 . 1 . . . A 18 G H1 . 18838 1 113 . 1 1 18 18 G H1' H 1 5.593 0.01 . 1 . . . A 18 G H1' . 18838 1 114 . 1 1 18 18 G H3' H 1 4.441 0.01 . 1 . . . A 18 G H3' . 18838 1 115 . 1 1 18 18 G H8 H 1 7.788 0.01 . 1 . . . A 18 G H8 . 18838 1 116 . 1 1 18 18 G H22 H 1 6.329 0.01 . 1 . . . A 18 G H22 . 18838 1 117 . 1 1 18 18 G H2' H 1 4.641 0.01 . 1 . . . A 18 G H2' . 18838 1 118 . 1 1 19 19 C H1' H 1 5.408 0.01 . 1 . . . A 19 C H1' . 18838 1 119 . 1 1 19 19 C H5 H 1 5.451 0.01 . 1 . . . A 19 C H5 . 18838 1 120 . 1 1 19 19 C H6 H 1 7.706 0.01 . 1 . . . A 19 C H6 . 18838 1 121 . 1 1 19 19 C H41 H 1 8.404 0.01 . 1 . . . A 19 C H41 . 18838 1 122 . 1 1 19 19 C H42 H 1 7.008 0.01 . 1 . . . A 19 C H42 . 18838 1 123 . 1 1 19 19 C H2' H 1 4.353 0.01 . 1 . . . A 19 C H2' . 18838 1 124 . 1 1 20 20 A H1' H 1 5.956 0.01 . 1 . . . A 20 A H1' . 18838 1 125 . 1 1 20 20 A H2 H 1 7.488 0.01 . 1 . . . A 20 A H2 . 18838 1 126 . 1 1 20 20 A H4' H 1 4.498 0.01 . 1 . . . A 20 A H4' . 18838 1 127 . 1 1 20 20 A H5' H 1 4.565 0.01 . 1 . . . A 20 A H5' . 18838 1 128 . 1 1 20 20 A H5'' H 1 4.149 0.01 . 1 . . . A 20 A H5'' . 18838 1 129 . 1 1 20 20 A H8 H 1 8.092 0.01 . 1 . . . A 20 A H8 . 18838 1 130 . 1 1 20 20 A H61 H 1 8.146 0.01 . 1 . . . A 20 A H61 . 18838 1 131 . 1 1 20 20 A H62 H 1 6.364 0.01 . 1 . . . A 20 A H62 . 18838 1 132 . 1 1 20 20 A H2' H 1 4.560 0.01 . 1 . . . A 20 A H2' . 18838 1 133 . 1 1 21 21 C H1' H 1 5.431 0.01 . 1 . . . A 21 C H1' . 18838 1 134 . 1 1 21 21 C H3' H 1 4.375 0.01 . 1 . . . A 21 C H3' . 18838 1 135 . 1 1 21 21 C H4' H 1 4.397 0.01 . 1 . . . A 21 C H4' . 18838 1 136 . 1 1 21 21 C H5 H 1 5.261 0.01 . 1 . . . A 21 C H5 . 18838 1 137 . 1 1 21 21 C H5' H 1 4.509 0.01 . 1 . . . A 21 C H5' . 18838 1 138 . 1 1 21 21 C H5'' H 1 4.068 0.01 . 1 . . . A 21 C H5'' . 18838 1 139 . 1 1 21 21 C H6 H 1 7.568 0.01 . 1 . . . A 21 C H6 . 18838 1 140 . 1 1 21 21 C H41 H 1 8.426 0.01 . 1 . . . A 21 C H41 . 18838 1 141 . 1 1 21 21 C H42 H 1 7.054 0.01 . 1 . . . A 21 C H42 . 18838 1 142 . 1 1 21 21 C H2' H 1 4.228 0.01 . 1 . . . A 21 C H2' . 18838 1 143 . 1 1 22 22 C H1' H 1 5.526 0.01 . 1 . . . A 22 C H1' . 18838 1 144 . 1 1 22 22 C H3' H 1 4.474 0.01 . 1 . . . A 22 C H3' . 18838 1 145 . 1 1 22 22 C H4' H 1 4.370 0.01 . 1 . . . A 22 C H4' . 18838 1 146 . 1 1 22 22 C H5 H 1 5.453 0.01 . 1 . . . A 22 C H5 . 18838 1 147 . 1 1 22 22 C H5' H 1 4.388 0.01 . 1 . . . A 22 C H5' . 18838 1 148 . 1 1 22 22 C H5'' H 1 4.042 0.01 . 1 . . . A 22 C H5'' . 18838 1 149 . 1 1 22 22 C H6 H 1 7.778 0.01 . 1 . . . A 22 C H6 . 18838 1 150 . 1 1 22 22 C H41 H 1 8.546 0.01 . 1 . . . A 22 C H41 . 18838 1 151 . 1 1 22 22 C H42 H 1 6.942 0.01 . 1 . . . A 22 C H42 . 18838 1 152 . 1 1 22 22 C H2' H 1 4.253 0.01 . 1 . . . A 22 C H2' . 18838 1 153 . 1 1 23 23 C H1' H 1 5.783 0.01 . 1 . . . A 23 C H1' . 18838 1 154 . 1 1 23 23 C H3' H 1 4.185 0.01 . 1 . . . A 23 C H3' . 18838 1 155 . 1 1 23 23 C H4' H 1 4.197 0.01 . 1 . . . A 23 C H4' . 18838 1 156 . 1 1 23 23 C H5 H 1 5.516 0.01 . 1 . . . A 23 C H5 . 18838 1 157 . 1 1 23 23 C H6 H 1 7.689 0.01 . 1 . . . A 23 C H6 . 18838 1 158 . 1 1 23 23 C H2' H 1 4.014 0.01 . 1 . . . A 23 C H2' . 18838 1 159 . 1 1 2 2 G C1' C 13 92.75 0.1 . 1 . . . A 2 G C1' . 18838 1 160 . 1 1 2 2 G C2' C 13 74.79 0.1 . 1 . . . A 2 G C2' . 18838 1 161 . 1 1 2 2 G C3' C 13 75.22 0.1 . 1 . . . A 2 G C3' . 18838 1 162 . 1 1 2 2 G C4' C 13 81.80 0.1 . 1 . . . A 2 G C4' . 18838 1 163 . 1 1 2 2 G C5' C 13 65.37 0.1 . 1 . . . A 2 G C5' . 18838 1 164 . 1 1 2 2 G C8 C 13 136.57 0.1 . 1 . . . A 2 G C8 . 18838 1 165 . 1 1 3 3 G C1' C 13 93.21 0.1 . 1 . . . A 3 G C1' . 18838 1 166 . 1 1 3 3 G C2' C 13 75.22 0.1 . 1 . . . A 3 G C2' . 18838 1 167 . 1 1 3 3 G C3' C 13 72.31 0.1 . 1 . . . A 3 G C3' . 18838 1 168 . 1 1 3 3 G C4' C 13 84.50 0.1 . 1 . . . A 3 G C4' . 18838 1 169 . 1 1 3 3 G C5' C 13 65.70 0.1 . 1 . . . A 3 G C5' . 18838 1 170 . 1 1 3 3 G C8 C 13 136.23 0.1 . 1 . . . A 3 G C8 . 18838 1 171 . 1 1 4 4 U C1' C 13 93.46 0.1 . 1 . . . A 4 U C1' . 18838 1 172 . 1 1 4 4 U C2' C 13 74.71 0.1 . 1 . . . A 4 U C2' . 18838 1 173 . 1 1 4 4 U C3' C 13 73.04 0.1 . 1 . . . A 4 U C3' . 18838 1 174 . 1 1 4 4 U C4' C 13 84.26 0.1 . 1 . . . A 4 U C4' . 18838 1 175 . 1 1 4 4 U C5' C 13 65.39 0.1 . 1 . . . A 4 U C5' . 18838 1 176 . 1 1 4 4 U C5 C 13 103.01 0.1 . 1 . . . A 4 U C5 . 18838 1 177 . 1 1 4 4 U C6 C 13 140.41 0.1 . 1 . . . A 4 U C6 . 18838 1 178 . 1 1 5 5 G C1' C 13 93.01 0.1 . 1 . . . A 5 G C1' . 18838 1 179 . 1 1 5 5 G C2' C 13 73.00 0.1 . 1 . . . A 5 G C2' . 18838 1 180 . 1 1 5 5 G C4' C 13 81.33 0.1 . 1 . . . A 5 G C4' . 18838 1 181 . 1 1 5 5 G C5' C 13 67.23 0.1 . 1 . . . A 5 G C5' . 18838 1 182 . 1 1 5 5 G C8 C 13 136.08 0.1 . 1 . . . A 5 G C8 . 18838 1 183 . 1 1 6 6 U C1' C 13 92.18 0.1 . 1 . . . A 6 U C1' . 18838 1 184 . 1 1 6 6 U C2' C 13 75.50 0.1 . 1 . . . A 6 U C2' . 18838 1 185 . 1 1 6 6 U C3' C 13 74.20 0.1 . 1 . . . A 6 U C3' . 18838 1 186 . 1 1 6 6 U C4' C 13 83.00 0.1 . 1 . . . A 6 U C4' . 18838 1 187 . 1 1 6 6 U C5' C 13 64.93 0.1 . 1 . . . A 6 U C5' . 18838 1 188 . 1 1 6 6 U C5 C 13 104.35 0.1 . 1 . . . A 6 U C5 . 18838 1 189 . 1 1 6 6 U C6 C 13 140.81 0.1 . 1 . . . A 6 U C6 . 18838 1 190 . 1 1 7 7 A C1' C 13 92.75 0.1 . 1 . . . A 7 A C1' . 18838 1 191 . 1 1 7 7 A C2' C 13 77.63 0.1 . 1 . . . A 7 A C2' . 18838 1 192 . 1 1 7 7 A C3' C 13 71.51 0.1 . 1 . . . A 7 A C3' . 18838 1 193 . 1 1 7 7 A C4' C 13 84.27 0.1 . 1 . . . A 7 A C4' . 18838 1 194 . 1 1 7 7 A C5' C 13 66.91 0.1 . 1 . . . A 7 A C5' . 18838 1 195 . 1 1 7 7 A C2 C 13 154.67 0.1 . 1 . . . A 7 A C2 . 18838 1 196 . 1 1 7 7 A C8 C 13 141.40 0.1 . 1 . . . A 7 A C8 . 18838 1 197 . 1 1 8 8 U C1' C 13 90.40 0.1 . 1 . . . A 8 U C1' . 18838 1 198 . 1 1 8 8 U C2' C 13 74.20 0.1 . 1 . . . A 8 U C2' . 18838 1 199 . 1 1 8 8 U C3' C 13 73.50 0.1 . 1 . . . A 8 U C3' . 18838 1 200 . 1 1 8 8 U C4' C 13 81.80 0.1 . 1 . . . A 8 U C4' . 18838 1 201 . 1 1 8 8 U C5' C 13 67.23 0.1 . 1 . . . A 8 U C5' . 18838 1 202 . 1 1 8 8 U C5 C 13 104.21 0.1 . 1 . . . A 8 U C5 . 18838 1 203 . 1 1 9 9 U C1' C 13 89.95 0.1 . 1 . . . A 9 U C1' . 18838 1 204 . 1 1 9 9 U C2' C 13 75.22 0.1 . 1 . . . A 9 U C2' . 18838 1 205 . 1 1 9 9 U C3' C 13 75.22 0.1 . 1 . . . A 9 U C3' . 18838 1 206 . 1 1 9 9 U C4' C 13 83.80 0.1 . 1 . . . A 9 U C4' . 18838 1 207 . 1 1 9 9 U C5' C 13 67.74 0.1 . 1 . . . A 9 U C5' . 18838 1 208 . 1 1 9 9 U C5 C 13 104.89 0.1 . 1 . . . A 9 U C5 . 18838 1 209 . 1 1 9 9 U C6 C 13 142.67 0.1 . 1 . . . A 9 U C6 . 18838 1 210 . 1 1 10 10 G C1' C 13 91.08 0.1 . 1 . . . A 10 G C1' . 18838 1 211 . 1 1 10 10 G C2' C 13 73.33 0.1 . 1 . . . A 10 G C2' . 18838 1 212 . 1 1 10 10 G C3' C 13 71.99 0.1 . 1 . . . A 10 G C3' . 18838 1 213 . 1 1 10 10 G C5' C 13 63.91 0.1 . 1 . . . A 10 G C5' . 18838 1 214 . 1 1 10 10 G C8 C 13 139.02 0.1 . 1 . . . A 10 G C8 . 18838 1 215 . 1 1 11 11 G C1' C 13 90.40 0.1 . 1 . . . A 11 G C1' . 18838 1 216 . 1 1 11 11 G C2' C 13 75.72 0.1 . 1 . . . A 11 G C2' . 18838 1 217 . 1 1 11 11 G C3' C 13 71.80 0.1 . 1 . . . A 11 G C3' . 18838 1 218 . 1 1 11 11 G C4' C 13 85.00 0.1 . 1 . . . A 11 G C4' . 18838 1 219 . 1 1 11 11 G C5' C 13 66.45 0.1 . 1 . . . A 11 G C5' . 18838 1 220 . 1 1 11 11 G C8 C 13 139.69 0.1 . 1 . . . A 11 G C8 . 18838 1 221 . 1 1 12 12 A C1' C 13 90.35 0.1 . 1 . . . A 12 A C1' . 18838 1 222 . 1 1 12 12 A C4' C 13 83.95 0.1 . 1 . . . A 12 A C4' . 18838 1 223 . 1 1 12 12 A C5' C 13 64.69 0.1 . 1 . . . A 12 A C5' . 18838 1 224 . 1 1 12 12 A C2 C 13 154.69 0.1 . 1 . . . A 12 A C2 . 18838 1 225 . 1 1 12 12 A C8 C 13 141.84 0.1 . 1 . . . A 12 A C8 . 18838 1 226 . 1 1 13 13 A C1' C 13 90.77 0.1 . 1 . . . A 13 A C1' . 18838 1 227 . 1 1 13 13 A C4' C 13 81.79 0.1 . 1 . . . A 13 A C4' . 18838 1 228 . 1 1 13 13 A C5' C 13 65.71 0.1 . 1 . . . A 13 A C5' . 18838 1 229 . 1 1 13 13 A C2 C 13 154.69 0.1 . 1 . . . A 13 A C2 . 18838 1 230 . 1 1 13 13 A C8 C 13 141.41 0.1 . 1 . . . A 13 A C8 . 18838 1 231 . 1 1 14 14 A C1' C 13 90.73 0.1 . 1 . . . A 14 A C1' . 18838 1 232 . 1 1 14 14 A C2' C 13 74.71 0.1 . 1 . . . A 14 A C2' . 18838 1 233 . 1 1 14 14 A C3' C 13 73.00 0.1 . 1 . . . A 14 A C3' . 18838 1 234 . 1 1 14 14 A C4' C 13 85.00 0.1 . 1 . . . A 14 A C4' . 18838 1 235 . 1 1 14 14 A C5' C 13 64.00 0.1 . 1 . . . A 14 A C5' . 18838 1 236 . 1 1 14 14 A C2 C 13 154.69 0.1 . 1 . . . A 14 A C2 . 18838 1 237 . 1 1 14 14 A C8 C 13 141.41 0.1 . 1 . . . A 14 A C8 . 18838 1 238 . 1 1 15 15 U C1' C 13 90.07 0.1 . 1 . . . A 15 U C1' . 18838 1 239 . 1 1 15 15 U C2' C 13 75.72 0.1 . 1 . . . A 15 U C2' . 18838 1 240 . 1 1 15 15 U C3' C 13 75.22 0.1 . 1 . . . A 15 U C3' . 18838 1 241 . 1 1 15 15 U C4' C 13 84.30 0.1 . 1 . . . A 15 U C4' . 18838 1 242 . 1 1 15 15 U C5' C 13 66.72 0.1 . 1 . . . A 15 U C5' . 18838 1 243 . 1 1 15 15 U C5 C 13 105.01 0.1 . 1 . . . A 15 U C5 . 18838 1 244 . 1 1 15 15 U C6 C 13 142.67 0.1 . 1 . . . A 15 U C6 . 18838 1 245 . 1 1 16 16 G C1' C 13 90.82 0.1 . 1 . . . A 16 G C1' . 18838 1 246 . 1 1 16 16 G C3' C 13 75.22 0.1 . 1 . . . A 16 G C3' . 18838 1 247 . 1 1 16 16 G C4' C 13 83.99 0.1 . 1 . . . A 16 G C4' . 18838 1 248 . 1 1 17 17 A C3' C 13 74.71 0.1 . 1 . . . A 17 A C3' . 18838 1 249 . 1 1 17 17 A C4' C 13 83.45 0.1 . 1 . . . A 17 A C4' . 18838 1 250 . 1 1 17 17 A C5' C 13 65.89 0.1 . 1 . . . A 17 A C5' . 18838 1 251 . 1 1 17 17 A C2 C 13 154.85 0.1 . 1 . . . A 17 A C2 . 18838 1 252 . 1 1 17 17 A C8 C 13 140.78 0.1 . 1 . . . A 17 A C8 . 18838 1 253 . 1 1 18 18 G C1' C 13 92.57 0.1 . 1 . . . A 18 G C1' . 18838 1 254 . 1 1 18 18 G C3' C 13 74.00 0.1 . 1 . . . A 18 G C3' . 18838 1 255 . 1 1 18 18 G C4' C 13 82.35 0.1 . 1 . . . A 18 G C4' . 18838 1 256 . 1 1 19 19 C C1' C 13 93.60 0.1 . 1 . . . A 19 C C1' . 18838 1 257 . 1 1 19 19 C C2' C 13 75.54 0.1 . 1 . . . A 19 C C2' . 18838 1 258 . 1 1 19 19 C C3' C 13 71.75 0.1 . 1 . . . A 19 C C3' . 18838 1 259 . 1 1 19 19 C C4' C 13 81.82 0.1 . 1 . . . A 19 C C4' . 18838 1 260 . 1 1 19 19 C C5' C 13 63.62 0.1 . 1 . . . A 19 C C5' . 18838 1 261 . 1 1 19 19 C C5 C 13 97.59 0.1 . 1 . . . A 19 C C5 . 18838 1 262 . 1 1 19 19 C C6 C 13 141.21 0.1 . 1 . . . A 19 C C6 . 18838 1 263 . 1 1 20 20 A C1' C 13 92.76 0.1 . 1 . . . A 20 A C1' . 18838 1 264 . 1 1 20 20 A C2' C 13 75.33 0.1 . 1 . . . A 20 A C2' . 18838 1 265 . 1 1 20 20 A C3' C 13 72.16 0.1 . 1 . . . A 20 A C3' . 18838 1 266 . 1 1 20 20 A C4' C 13 82.04 0.1 . 1 . . . A 20 A C4' . 18838 1 267 . 1 1 20 20 A C5' C 13 64.88 0.1 . 1 . . . A 20 A C5' . 18838 1 268 . 1 1 20 20 A C2 C 13 153.57 0.1 . 1 . . . A 20 A C2 . 18838 1 269 . 1 1 20 20 A C8 C 13 139.41 0.1 . 1 . . . A 20 A C8 . 18838 1 270 . 1 1 21 21 C C1' C 13 93.58 0.1 . 1 . . . A 21 C C1' . 18838 1 271 . 1 1 21 21 C C2' C 13 75.42 0.1 . 1 . . . A 21 C C2' . 18838 1 272 . 1 1 21 21 C C3' C 13 71.91 0.1 . 1 . . . A 21 C C3' . 18838 1 273 . 1 1 21 21 C C4' C 13 81.76 0.1 . 1 . . . A 21 C C4' . 18838 1 274 . 1 1 21 21 C C5' C 13 64.49 0.1 . 1 . . . A 21 C C5' . 18838 1 275 . 1 1 21 21 C C5 C 13 97.02 0.1 . 1 . . . A 21 C C5 . 18838 1 276 . 1 1 21 21 C C6 C 13 140.72 0.1 . 1 . . . A 21 C C6 . 18838 1 277 . 1 1 22 22 C C1' C 13 94.23 0.1 . 1 . . . A 22 C C1' . 18838 1 278 . 1 1 22 22 C C2' C 13 75.52 0.1 . 1 . . . A 22 C C2' . 18838 1 279 . 1 1 22 22 C C3' C 13 71.96 0.1 . 1 . . . A 22 C C3' . 18838 1 280 . 1 1 22 22 C C4' C 13 81.83 0.1 . 1 . . . A 22 C C4' . 18838 1 281 . 1 1 22 22 C C5' C 13 65.05 0.1 . 1 . . . A 22 C C5' . 18838 1 282 . 1 1 22 22 C C5 C 13 97.59 0.1 . 1 . . . A 22 C C5 . 18838 1 283 . 1 1 22 22 C C6 C 13 141.41 0.1 . 1 . . . A 22 C C6 . 18838 1 284 . 1 1 23 23 C C1' C 13 92.81 0.1 . 1 . . . A 23 C C1' . 18838 1 285 . 1 1 23 23 C C2' C 13 77.45 0.1 . 1 . . . A 23 C C2' . 18838 1 286 . 1 1 23 23 C C3' C 13 69.62 0.1 . 1 . . . A 23 C C3' . 18838 1 287 . 1 1 23 23 C C4' C 13 83.42 0.1 . 1 . . . A 23 C C4' . 18838 1 288 . 1 1 23 23 C C5' C 13 64.82 0.1 . 1 . . . A 23 C C5' . 18838 1 289 . 1 1 23 23 C C5 C 13 97.99 0.1 . 1 . . . A 23 C C5 . 18838 1 290 . 1 1 23 23 C C6 C 13 141.82 0.1 . 1 . . . A 23 C C6 . 18838 1 stop_ save_