################################### # 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 34158 _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 $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 1H-1H NOESY' . . . 34158 1 2 '2D 1H-1H NOESY' . . . 34158 1 3 '2D DQF-COSY' . . . 34158 1 4 '2D 1H-1H TOCSY' . . . 34158 1 5 '2D 1H-13C HSQC' . . . 34158 1 6 1H-31PCOSY . . . 34158 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.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 DCZ H1' H 1 5.758 0.000 . . . . . . A 1 DCZ H1' . 34158 1 2 . 1 1 1 1 DCZ H3' H 1 4.704 0.001 . . . . . . A 1 DCZ H3' . 34158 1 3 . 1 1 1 1 DCZ H4' H 1 4.064 0.000 . . . . . . A 1 DCZ H4' . 34158 1 4 . 1 1 1 1 DCZ H5 H 1 5.862 0.000 . . . . . . A 1 DCZ H5 . 34158 1 5 . 1 1 1 1 DCZ H6 H 1 7.585 0.000 . . . . . . A 1 DCZ H6 . 34158 1 6 . 1 1 1 1 DCZ C1' C 13 85.374 0.000 . . . . . . A 1 DCZ C1' . 34158 1 7 . 1 1 1 1 DCZ C3' C 13 75.649 0.000 . . . . . . A 1 DCZ C3' . 34158 1 8 . 1 1 1 1 DCZ C4' C 13 85.759 0.000 . . . . . . A 1 DCZ C4' . 34158 1 9 . 1 1 1 1 DCZ C5 C 13 96.912 0.000 . . . . . . A 1 DCZ C5 . 34158 1 10 . 1 1 1 1 DCZ C6 C 13 140.437 0.000 . . . . . . A 1 DCZ C6 . 34158 1 11 . 1 1 2 2 DG H1' H 1 5.453 0.000 . . . . . . A 2 DG H1' . 34158 1 12 . 1 1 2 2 DG H3' H 1 5.040 0.002 . . . . . . A 2 DG H3' . 34158 1 13 . 1 1 2 2 DG H4' H 1 4.328 0.001 . . . . . . A 2 DG H4' . 34158 1 14 . 1 1 2 2 DG C1' C 13 81.373 0.000 . . . . . . A 2 DG C1' . 34158 1 15 . 1 1 2 2 DG C3' C 13 76.572 0.000 . . . . . . A 2 DG C3' . 34158 1 16 . 1 1 2 2 DG C4' C 13 84.687 0.000 . . . . . . A 2 DG C4' . 34158 1 17 . 1 1 2 2 DG P P 31 -1.090 0.000 . . . . . . A 2 DG P . 34158 1 18 . 1 1 3 3 DA H1' H 1 6.357 0.000 . . . . . . A 3 DA H1' . 34158 1 19 . 1 1 3 3 DA H2 H 1 7.976 0.000 . . . . . . A 3 DA H2 . 34158 1 20 . 1 1 3 3 DA H3' H 1 5.133 0.001 . . . . . . A 3 DA H3' . 34158 1 21 . 1 1 3 3 DA H4' H 1 4.522 0.001 . . . . . . A 3 DA H4' . 34158 1 22 . 1 1 3 3 DA H8 H 1 8.443 0.000 . . . . . . A 3 DA H8 . 34158 1 23 . 1 1 3 3 DA C1' C 13 81.955 0.000 . . . . . . A 3 DA C1' . 34158 1 24 . 1 1 3 3 DA C2 C 13 151.981 0.000 . . . . . . A 3 DA C2 . 34158 1 25 . 1 1 3 3 DA C3' C 13 77.360 0.000 . . . . . . A 3 DA C3' . 34158 1 26 . 1 1 3 3 DA C4' C 13 85.122 0.000 . . . . . . A 3 DA C4' . 34158 1 27 . 1 1 3 3 DA C8 C 13 138.761 0.000 . . . . . . A 3 DA C8 . 34158 1 28 . 1 1 3 3 DA P P 31 -0.869 0.003 . . . . . . A 3 DA P . 34158 1 29 . 1 1 4 4 DT H1' H 1 5.773 0.000 . . . . . . A 4 DT H1' . 34158 1 30 . 1 1 4 4 DT H3' H 1 5.052 0.001 . . . . . . A 4 DT H3' . 34158 1 31 . 1 1 4 4 DT H4' H 1 4.273 0.001 . . . . . . A 4 DT H4' . 34158 1 32 . 1 1 4 4 DT H6 H 1 7.434 0.000 . . . . . . A 4 DT H6 . 34158 1 33 . 1 1 4 4 DT H71 H 1 1.560 0.000 . . . . . . A 4 DT H71 . 34158 1 34 . 1 1 4 4 DT H72 H 1 1.560 0.000 . . . . . . A 4 DT H72 . 34158 1 35 . 1 1 4 4 DT H73 H 1 1.560 0.000 . . . . . . A 4 DT H73 . 34158 1 36 . 1 1 4 4 DT C1' C 13 83.365 0.000 . . . . . . A 4 DT C1' . 34158 1 37 . 1 1 4 4 DT C3' C 13 75.603 0.000 . . . . . . A 4 DT C3' . 34158 1 38 . 1 1 4 4 DT C4' C 13 82.914 0.000 . . . . . . A 4 DT C4' . 34158 1 39 . 1 1 4 4 DT C6 C 13 136.294 0.000 . . . . . . A 4 DT C6 . 34158 1 40 . 1 1 4 4 DT C7 C 13 11.354 0.000 . . . . . . A 4 DT C7 . 34158 1 41 . 1 1 4 4 DT P P 31 -1.460 0.001 . . . . . . A 4 DT P . 34158 1 42 . 1 1 5 5 DG H1' H 1 5.906 0.000 . . . . . . A 5 DG H1' . 34158 1 43 . 1 1 5 5 DG H3' H 1 5.053 0.001 . . . . . . A 5 DG H3' . 34158 1 44 . 1 1 5 5 DG H4' H 1 4.280 0.002 . . . . . . A 5 DG H4' . 34158 1 45 . 1 1 5 5 DG C1' C 13 82.664 0.000 . . . . . . A 5 DG C1' . 34158 1 46 . 1 1 5 5 DG C3' C 13 78.686 0.000 . . . . . . A 5 DG C3' . 34158 1 47 . 1 1 5 5 DG C4' C 13 85.095 0.000 . . . . . . A 5 DG C4' . 34158 1 48 . 1 1 5 5 DG P P 31 -0.418 0.001 . . . . . . A 5 DG P . 34158 1 49 . 1 1 6 6 DT H1' H 1 4.943 0.000 . . . . . . A 6 DT H1' . 34158 1 50 . 1 1 6 6 DT H3' H 1 4.581 0.002 . . . . . . A 6 DT H3' . 34158 1 51 . 1 1 6 6 DT H4' H 1 2.489 0.001 . . . . . . A 6 DT H4' . 34158 1 52 . 1 1 6 6 DT H6 H 1 6.964 0.000 . . . . . . A 6 DT H6 . 34158 1 53 . 1 1 6 6 DT H71 H 1 1.316 0.000 . . . . . . A 6 DT H71 . 34158 1 54 . 1 1 6 6 DT H72 H 1 1.316 0.000 . . . . . . A 6 DT H72 . 34158 1 55 . 1 1 6 6 DT H73 H 1 1.316 0.000 . . . . . . A 6 DT H73 . 34158 1 56 . 1 1 6 6 DT C1' C 13 81.648 0.000 . . . . . . A 6 DT C1' . 34158 1 57 . 1 1 6 6 DT C3' C 13 73.432 0.000 . . . . . . A 6 DT C3' . 34158 1 58 . 1 1 6 6 DT C4' C 13 81.150 0.000 . . . . . . A 6 DT C4' . 34158 1 59 . 1 1 6 6 DT C6 C 13 135.816 0.000 . . . . . . A 6 DT C6 . 34158 1 60 . 1 1 6 6 DT C7 C 13 11.555 0.000 . . . . . . A 6 DT C7 . 34158 1 61 . 1 1 6 6 DT P P 31 -1.032 0.000 . . . . . . A 6 DT P . 34158 1 62 . 1 1 7 7 DA H1' H 1 5.526 0.000 . . . . . . A 7 DA H1' . 34158 1 63 . 1 1 7 7 DA H2 H 1 8.031 0.000 . . . . . . A 7 DA H2 . 34158 1 64 . 1 1 7 7 DA H3' H 1 4.679 0.002 . . . . . . A 7 DA H3' . 34158 1 65 . 1 1 7 7 DA H4' H 1 2.959 0.000 . . . . . . A 7 DA H4' . 34158 1 66 . 1 1 7 7 DA H8 H 1 8.124 0.000 . . . . . . A 7 DA H8 . 34158 1 67 . 1 1 7 7 DA C1' C 13 81.525 0.000 . . . . . . A 7 DA C1' . 34158 1 68 . 1 1 7 7 DA C2 C 13 152.388 0.000 . . . . . . A 7 DA C2 . 34158 1 69 . 1 1 7 7 DA C3' C 13 76.598 0.000 . . . . . . A 7 DA C3' . 34158 1 70 . 1 1 7 7 DA C4' C 13 83.232 0.000 . . . . . . A 7 DA C4' . 34158 1 71 . 1 1 7 7 DA C8 C 13 139.787 0.000 . . . . . . A 7 DA C8 . 34158 1 72 . 1 1 7 7 DA P P 31 -1.887 0.000 . . . . . . A 7 DA P . 34158 1 73 . 1 1 8 8 DC H1' H 1 5.331 0.000 . . . . . . A 8 DC H1' . 34158 1 74 . 1 1 8 8 DC H3' H 1 4.551 0.004 . . . . . . A 8 DC H3' . 34158 1 75 . 1 1 8 8 DC H4' H 1 2.247 0.000 . . . . . . A 8 DC H4' . 34158 1 76 . 1 1 8 8 DC H5 H 1 5.269 0.000 . . . . . . A 8 DC H5 . 34158 1 77 . 1 1 8 8 DC H6 H 1 6.888 0.000 . . . . . . A 8 DC H6 . 34158 1 78 . 1 1 8 8 DC C1' C 13 81.570 0.000 . . . . . . A 8 DC C1' . 34158 1 79 . 1 1 8 8 DC C3' C 13 72.912 0.000 . . . . . . A 8 DC C3' . 34158 1 80 . 1 1 8 8 DC C4' C 13 80.842 0.000 . . . . . . A 8 DC C4' . 34158 1 81 . 1 1 8 8 DC C5 C 13 96.282 0.000 . . . . . . A 8 DC C5 . 34158 1 82 . 1 1 8 8 DC C6 C 13 139.878 0.000 . . . . . . A 8 DC C6 . 34158 1 83 . 1 1 8 8 DC P P 31 -1.891 0.000 . . . . . . A 8 DC P . 34158 1 84 . 1 1 9 9 DA H1' H 1 5.559 0.000 . . . . . . A 9 DA H1' . 34158 1 85 . 1 1 9 9 DA H2 H 1 7.729 0.000 . . . . . . A 9 DA H2 . 34158 1 86 . 1 1 9 9 DA H3' H 1 4.653 0.006 . . . . . . A 9 DA H3' . 34158 1 87 . 1 1 9 9 DA H4' H 1 2.647 0.000 . . . . . . A 9 DA H4' . 34158 1 88 . 1 1 9 9 DA H8 H 1 8.293 0.000 . . . . . . A 9 DA H8 . 34158 1 89 . 1 1 9 9 DA C1' C 13 80.482 0.000 . . . . . . A 9 DA C1' . 34158 1 90 . 1 1 9 9 DA C2 C 13 151.465 0.000 . . . . . . A 9 DA C2 . 34158 1 91 . 1 1 9 9 DA C3' C 13 74.231 0.000 . . . . . . A 9 DA C3' . 34158 1 92 . 1 1 9 9 DA C4' C 13 82.449 0.000 . . . . . . A 9 DA C4' . 34158 1 93 . 1 1 9 9 DA C8 C 13 139.418 0.000 . . . . . . A 9 DA C8 . 34158 1 94 . 1 1 9 9 DA P P 31 -1.940 0.000 . . . . . . A 9 DA P . 34158 1 95 . 1 1 10 10 DT H1' H 1 5.691 0.000 . . . . . . A 10 DT H1' . 34158 1 96 . 1 1 10 10 DT H3' H 1 4.764 0.000 . . . . . . A 10 DT H3' . 34158 1 97 . 1 1 10 10 DT H4' H 1 3.909 0.002 . . . . . . A 10 DT H4' . 34158 1 98 . 1 1 10 10 DT H71 H 1 1.442 0.000 . . . . . . A 10 DT H71 . 34158 1 99 . 1 1 10 10 DT H72 H 1 1.442 0.000 . . . . . . A 10 DT H72 . 34158 1 100 . 1 1 10 10 DT H73 H 1 1.442 0.000 . . . . . . A 10 DT H73 . 34158 1 101 . 1 1 10 10 DT C1' C 13 81.447 0.000 . . . . . . A 10 DT C1' . 34158 1 102 . 1 1 10 10 DT C3' C 13 73.023 0.000 . . . . . . A 10 DT C3' . 34158 1 103 . 1 1 10 10 DT C4' C 13 81.740 0.000 . . . . . . A 10 DT C4' . 34158 1 104 . 1 1 10 10 DT C7 C 13 11.307 0.000 . . . . . . A 10 DT C7 . 34158 1 105 . 1 1 10 10 DT P P 31 -1.837 0.000 . . . . . . A 10 DT P . 34158 1 106 . 1 1 11 11 DC H1' H 1 5.741 0.000 . . . . . . A 11 DC H1' . 34158 1 107 . 1 1 11 11 DC H4' H 1 4.115 0.001 . . . . . . A 11 DC H4' . 34158 1 108 . 1 1 11 11 DC H5 H 1 5.613 0.000 . . . . . . A 11 DC H5 . 34158 1 109 . 1 1 11 11 DC H6 H 1 7.414 0.000 . . . . . . A 11 DC H6 . 34158 1 110 . 1 1 11 11 DC C1' C 13 83.687 0.000 . . . . . . A 11 DC C1' . 34158 1 111 . 1 1 11 11 DC C4' C 13 82.795 0.000 . . . . . . A 11 DC C4' . 34158 1 112 . 1 1 11 11 DC C5 C 13 95.989 0.000 . . . . . . A 11 DC C5 . 34158 1 113 . 1 1 11 11 DC C6 C 13 141.090 0.000 . . . . . . A 11 DC C6 . 34158 1 114 . 1 1 11 11 DC P P 31 -1.189 0.001 . . . . . . A 11 DC P . 34158 1 115 . 1 1 12 12 DG H1' H 1 6.143 0.000 . . . . . . A 12 DG H1' . 34158 1 116 . 1 1 12 12 DG H3' H 1 4.680 0.000 . . . . . . A 12 DG H3' . 34158 1 117 . 1 1 12 12 DG H4' H 1 4.179 0.001 . . . . . . A 12 DG H4' . 34158 1 118 . 1 1 12 12 DG H8 H 1 7.928 0.000 . . . . . . A 12 DG H8 . 34158 1 119 . 1 1 12 12 DG C1' C 13 82.045 0.000 . . . . . . A 12 DG C1' . 34158 1 120 . 1 1 12 12 DG C3' C 13 70.929 0.000 . . . . . . A 12 DG C3' . 34158 1 121 . 1 1 12 12 DG C4' C 13 85.284 0.000 . . . . . . A 12 DG C4' . 34158 1 122 . 1 1 12 12 DG C8 C 13 136.308 0.000 . . . . . . A 12 DG C8 . 34158 1 123 . 1 1 12 12 DG P P 31 -0.964 0.000 . . . . . . A 12 DG P . 34158 1 124 . 2 1 1 1 DCZ H1' H 1 5.746 0.000 . . . . . . B 13 DCZ H1' . 34158 1 125 . 2 1 1 1 DCZ H3' H 1 4.723 0.001 . . . . . . B 13 DCZ H3' . 34158 1 126 . 2 1 1 1 DCZ H5 H 1 5.897 0.000 . . . . . . B 13 DCZ H5 . 34158 1 127 . 2 1 1 1 DCZ H6 H 1 7.639 0.000 . . . . . . B 13 DCZ H6 . 34158 1 128 . 2 1 1 1 DCZ C1' C 13 85.212 0.000 . . . . . . B 13 DCZ C1' . 34158 1 129 . 2 1 1 1 DCZ C3' C 13 75.058 0.000 . . . . . . B 13 DCZ C3' . 34158 1 130 . 2 1 1 1 DCZ C5 C 13 96.814 0.000 . . . . . . B 13 DCZ C5 . 34158 1 131 . 2 1 1 1 DCZ C6 C 13 140.529 0.000 . . . . . . B 13 DCZ C6 . 34158 1 132 . 2 1 2 2 DG H1' H 1 5.666 0.000 . . . . . . B 14 DG H1' . 34158 1 133 . 2 1 2 2 DG H3' H 1 5.046 0.002 . . . . . . B 14 DG H3' . 34158 1 134 . 2 1 2 2 DG H4' H 1 4.370 0.002 . . . . . . B 14 DG H4' . 34158 1 135 . 2 1 2 2 DG C1' C 13 81.435 0.000 . . . . . . B 14 DG C1' . 34158 1 136 . 2 1 2 2 DG C3' C 13 77.235 0.000 . . . . . . B 14 DG C3' . 34158 1 137 . 2 1 2 2 DG C4' C 13 84.706 0.000 . . . . . . B 14 DG C4' . 34158 1 138 . 2 1 2 2 DG P P 31 -1.099 0.002 . . . . . . B 14 DG P . 34158 1 139 . 2 1 3 3 DA H1' H 1 6.329 0.000 . . . . . . B 15 DA H1' . 34158 1 140 . 2 1 3 3 DA H2 H 1 7.892 0.000 . . . . . . B 15 DA H2 . 34158 1 141 . 2 1 3 3 DA H3' H 1 5.106 0.002 . . . . . . B 15 DA H3' . 34158 1 142 . 2 1 3 3 DA H4' H 1 4.508 0.001 . . . . . . B 15 DA H4' . 34158 1 143 . 2 1 3 3 DA H8 H 1 8.321 0.000 . . . . . . B 15 DA H8 . 34158 1 144 . 2 1 3 3 DA C1' C 13 82.207 0.000 . . . . . . B 15 DA C1' . 34158 1 145 . 2 1 3 3 DA C2 C 13 152.264 0.000 . . . . . . B 15 DA C2 . 34158 1 146 . 2 1 3 3 DA C3' C 13 77.082 0.000 . . . . . . B 15 DA C3' . 34158 1 147 . 2 1 3 3 DA C4' C 13 84.889 0.000 . . . . . . B 15 DA C4' . 34158 1 148 . 2 1 3 3 DA C8 C 13 138.514 0.000 . . . . . . B 15 DA C8 . 34158 1 149 . 2 1 3 3 DA P P 31 -1.176 0.001 . . . . . . B 15 DA P . 34158 1 150 . 2 1 4 4 DT H1' H 1 5.621 0.000 . . . . . . B 16 DT H1' . 34158 1 151 . 2 1 4 4 DT H3' H 1 4.928 0.003 . . . . . . B 16 DT H3' . 34158 1 152 . 2 1 4 4 DT H4' H 1 4.141 0.001 . . . . . . B 16 DT H4' . 34158 1 153 . 2 1 4 4 DT H6 H 1 7.279 0.000 . . . . . . B 16 DT H6 . 34158 1 154 . 2 1 4 4 DT H71 H 1 1.524 0.000 . . . . . . B 16 DT H71 . 34158 1 155 . 2 1 4 4 DT H72 H 1 1.524 0.000 . . . . . . B 16 DT H72 . 34158 1 156 . 2 1 4 4 DT H73 H 1 1.524 0.000 . . . . . . B 16 DT H73 . 34158 1 157 . 2 1 4 4 DT C1' C 13 82.388 0.000 . . . . . . B 16 DT C1' . 34158 1 158 . 2 1 4 4 DT C3' C 13 73.211 0.000 . . . . . . B 16 DT C3' . 34158 1 159 . 2 1 4 4 DT C4' C 13 82.200 0.000 . . . . . . B 16 DT C4' . 34158 1 160 . 2 1 4 4 DT C6 C 13 136.129 0.000 . . . . . . B 16 DT C6 . 34158 1 161 . 2 1 4 4 DT C7 C 13 11.383 0.000 . . . . . . B 16 DT C7 . 34158 1 162 . 2 1 4 4 DT P P 31 -1.350 0.000 . . . . . . B 16 DT P . 34158 1 163 . 2 1 5 5 DG H1' H 1 5.786 0.000 . . . . . . B 17 DG H1' . 34158 1 164 . 2 1 5 5 DG H3' H 1 5.000 0.001 . . . . . . B 17 DG H3' . 34158 1 165 . 2 1 5 5 DG H4' H 1 4.267 0.001 . . . . . . B 17 DG H4' . 34158 1 166 . 2 1 5 5 DG C1' C 13 82.651 0.000 . . . . . . B 17 DG C1' . 34158 1 167 . 2 1 5 5 DG C3' C 13 78.245 0.000 . . . . . . B 17 DG C3' . 34158 1 168 . 2 1 5 5 DG C4' C 13 84.880 0.000 . . . . . . B 17 DG C4' . 34158 1 169 . 2 1 5 5 DG P P 31 -0.481 0.004 . . . . . . B 17 DG P . 34158 1 170 . 2 1 6 6 DT H1' H 1 5.210 0.000 . . . . . . B 18 DT H1' . 34158 1 171 . 2 1 6 6 DT H3' H 1 4.626 0.003 . . . . . . B 18 DT H3' . 34158 1 172 . 2 1 6 6 DT H4' H 1 2.051 0.000 . . . . . . B 18 DT H4' . 34158 1 173 . 2 1 6 6 DT H6 H 1 6.979 0.000 . . . . . . B 18 DT H6 . 34158 1 174 . 2 1 6 6 DT H71 H 1 1.446 0.000 . . . . . . B 18 DT H71 . 34158 1 175 . 2 1 6 6 DT H72 H 1 1.446 0.000 . . . . . . B 18 DT H72 . 34158 1 176 . 2 1 6 6 DT H73 H 1 1.446 0.000 . . . . . . B 18 DT H73 . 34158 1 177 . 2 1 6 6 DT C1' C 13 81.941 0.000 . . . . . . B 18 DT C1' . 34158 1 178 . 2 1 6 6 DT C3' C 13 73.881 0.000 . . . . . . B 18 DT C3' . 34158 1 179 . 2 1 6 6 DT C4' C 13 81.463 0.000 . . . . . . B 18 DT C4' . 34158 1 180 . 2 1 6 6 DT C6 C 13 136.439 0.000 . . . . . . B 18 DT C6 . 34158 1 181 . 2 1 6 6 DT C7 C 13 12.156 0.000 . . . . . . B 18 DT C7 . 34158 1 182 . 2 1 6 6 DT P P 31 -1.562 0.000 . . . . . . B 18 DT P . 34158 1 183 . 2 1 7 7 DA H1' H 1 5.506 0.000 . . . . . . B 19 DA H1' . 34158 1 184 . 2 1 7 7 DA H2 H 1 8.050 0.000 . . . . . . B 19 DA H2 . 34158 1 185 . 2 1 7 7 DA H3' H 1 4.671 0.001 . . . . . . B 19 DA H3' . 34158 1 186 . 2 1 7 7 DA H4' H 1 2.642 0.000 . . . . . . B 19 DA H4' . 34158 1 187 . 2 1 7 7 DA H8 H 1 8.143 0.000 . . . . . . B 19 DA H8 . 34158 1 188 . 2 1 7 7 DA C1' C 13 80.861 0.000 . . . . . . B 19 DA C1' . 34158 1 189 . 2 1 7 7 DA C2 C 13 151.930 0.000 . . . . . . B 19 DA C2 . 34158 1 190 . 2 1 7 7 DA C3' C 13 75.491 0.000 . . . . . . B 19 DA C3' . 34158 1 191 . 2 1 7 7 DA C4' C 13 82.696 0.000 . . . . . . B 19 DA C4' . 34158 1 192 . 2 1 7 7 DA C8 C 13 139.555 0.000 . . . . . . B 19 DA C8 . 34158 1 193 . 2 1 7 7 DA P P 31 -1.615 0.000 . . . . . . B 19 DA P . 34158 1 194 . 2 1 8 8 DC H1' H 1 5.349 0.000 . . . . . . B 20 DC H1' . 34158 1 195 . 2 1 8 8 DC H3' H 1 4.561 0.001 . . . . . . B 20 DC H3' . 34158 1 196 . 2 1 8 8 DC H4' H 1 2.347 0.000 . . . . . . B 20 DC H4' . 34158 1 197 . 2 1 8 8 DC H5 H 1 5.287 0.000 . . . . . . B 20 DC H5 . 34158 1 198 . 2 1 8 8 DC H6 H 1 6.899 0.000 . . . . . . B 20 DC H6 . 34158 1 199 . 2 1 8 8 DC C1' C 13 81.570 0.000 . . . . . . B 20 DC C1' . 34158 1 200 . 2 1 8 8 DC C3' C 13 73.055 0.000 . . . . . . B 20 DC C3' . 34158 1 201 . 2 1 8 8 DC C4' C 13 81.030 0.000 . . . . . . B 20 DC C4' . 34158 1 202 . 2 1 8 8 DC C5 C 13 96.235 0.000 . . . . . . B 20 DC C5 . 34158 1 203 . 2 1 8 8 DC C6 C 13 139.707 0.000 . . . . . . B 20 DC C6 . 34158 1 204 . 2 1 8 8 DC P P 31 -2.006 0.000 . . . . . . B 20 DC P . 34158 1 205 . 2 1 9 9 DA H1' H 1 5.456 0.000 . . . . . . B 21 DA H1' . 34158 1 206 . 2 1 9 9 DA H2 H 1 7.738 0.000 . . . . . . B 21 DA H2 . 34158 1 207 . 2 1 9 9 DA H3' H 1 4.639 0.000 . . . . . . B 21 DA H3' . 34158 1 208 . 2 1 9 9 DA H4' H 1 2.783 0.000 . . . . . . B 21 DA H4' . 34158 1 209 . 2 1 9 9 DA C1' C 13 80.566 0.000 . . . . . . B 21 DA C1' . 34158 1 210 . 2 1 9 9 DA C2 C 13 150.877 0.000 . . . . . . B 21 DA C2 . 34158 1 211 . 2 1 9 9 DA C3' C 13 74.060 0.000 . . . . . . B 21 DA C3' . 34158 1 212 . 2 1 9 9 DA C4' C 13 82.519 0.000 . . . . . . B 21 DA C4' . 34158 1 213 . 2 1 9 9 DA P P 31 -1.945 0.000 . . . . . . B 21 DA P . 34158 1 214 . 2 1 10 10 DT H1' H 1 5.729 0.000 . . . . . . B 22 DT H1' . 34158 1 215 . 2 1 10 10 DT H3' H 1 4.771 0.001 . . . . . . B 22 DT H3' . 34158 1 216 . 2 1 10 10 DT H4' H 1 3.754 0.002 . . . . . . B 22 DT H4' . 34158 1 217 . 2 1 10 10 DT H71 H 1 1.354 0.000 . . . . . . B 22 DT H71 . 34158 1 218 . 2 1 10 10 DT H72 H 1 1.354 0.000 . . . . . . B 22 DT H72 . 34158 1 219 . 2 1 10 10 DT H73 H 1 1.354 0.000 . . . . . . B 22 DT H73 . 34158 1 220 . 2 1 10 10 DT C1' C 13 81.428 0.000 . . . . . . B 22 DT C1' . 34158 1 221 . 2 1 10 10 DT C3' C 13 73.568 0.000 . . . . . . B 22 DT C3' . 34158 1 222 . 2 1 10 10 DT C4' C 13 82.054 0.000 . . . . . . B 22 DT C4' . 34158 1 223 . 2 1 10 10 DT C7 C 13 11.216 0.000 . . . . . . B 22 DT C7 . 34158 1 224 . 2 1 10 10 DT P P 31 -2.092 0.000 . . . . . . B 22 DT P . 34158 1 225 . 2 1 11 11 DC H1' H 1 5.495 0.000 . . . . . . B 23 DC H1' . 34158 1 226 . 2 1 11 11 DC H3' H 1 4.829 0.010 . . . . . . B 23 DC H3' . 34158 1 227 . 2 1 11 11 DC H4' H 1 4.120 0.001 . . . . . . B 23 DC H4' . 34158 1 228 . 2 1 11 11 DC H5 H 1 5.647 0.000 . . . . . . B 23 DC H5 . 34158 1 229 . 2 1 11 11 DC H6 H 1 7.463 0.000 . . . . . . B 23 DC H6 . 34158 1 230 . 2 1 11 11 DC C1' C 13 84.063 0.000 . . . . . . B 23 DC C1' . 34158 1 231 . 2 1 11 11 DC C3' C 13 73.938 0.000 . . . . . . B 23 DC C3' . 34158 1 232 . 2 1 11 11 DC C4' C 13 83.447 0.000 . . . . . . B 23 DC C4' . 34158 1 233 . 2 1 11 11 DC C5 C 13 96.165 0.000 . . . . . . B 23 DC C5 . 34158 1 234 . 2 1 11 11 DC C6 C 13 141.160 0.000 . . . . . . B 23 DC C6 . 34158 1 235 . 2 1 11 11 DC P P 31 -1.360 0.002 . . . . . . B 23 DC P . 34158 1 236 . 2 1 12 12 DG H1' H 1 6.171 0.000 . . . . . . B 24 DG H1' . 34158 1 237 . 2 1 12 12 DG H3' H 1 4.675 0.000 . . . . . . B 24 DG H3' . 34158 1 238 . 2 1 12 12 DG H4' H 1 4.167 0.001 . . . . . . B 24 DG H4' . 34158 1 239 . 2 1 12 12 DG H8 H 1 7.943 0.000 . . . . . . B 24 DG H8 . 34158 1 240 . 2 1 12 12 DG C1' C 13 82.207 0.000 . . . . . . B 24 DG C1' . 34158 1 241 . 2 1 12 12 DG C3' C 13 70.669 0.000 . . . . . . B 24 DG C3' . 34158 1 242 . 2 1 12 12 DG C4' C 13 85.167 0.000 . . . . . . B 24 DG C4' . 34158 1 243 . 2 1 12 12 DG C8 C 13 136.480 0.000 . . . . . . B 24 DG C8 . 34158 1 244 . 2 1 12 12 DG P P 31 -0.519 0.001 . . . . . . B 24 DG P . 34158 1 245 . 3 2 1 1 9U2 H83 H 1 8.868 0.000 . . . . . . A 100 9U2 H83 . 34158 1 246 . 3 2 1 1 9U2 H85 H 1 4.143 0.000 . . . . . . A 100 9U2 H85 . 34158 1 247 . 3 2 1 1 9U2 H881 H 1 1.290 0.000 . . . . . . A 100 9U2 H881 . 34158 1 248 . 3 2 1 1 9U2 H991 H 1 1.535 0.000 . . . . . . A 100 9U2 H991 . 34158 1 249 . 3 2 1 1 9U2 C83 C 13 151.886 0.000 . . . . . . A 100 9U2 C83 . 34158 1 250 . 3 2 1 1 9U2 C85 C 13 27.604 0.000 . . . . . . A 100 9U2 C85 . 34158 1 251 . 3 2 1 1 9U2 CM8 C 13 25.154 0.000 . . . . . . A 100 9U2 CM8 . 34158 1 252 . 3 2 1 1 9U2 CM9 C 13 24.496 0.000 . . . . . . A 100 9U2 CM9 . 34158 1 253 . 4 3 1 1 PYB HB1 H 1 5.992 0.000 . . . . . . A 101 PYB HB1 . 34158 1 254 . 4 3 1 1 PYB HB H 1 7.663 0.000 . . . . . . A 101 PYB HB . 34158 1 255 . 4 3 1 1 PYB HD1 H 1 3.929 0.000 . . . . . . A 101 PYB HD1 . 34158 1 256 . 4 3 1 1 PYB CB1 C 13 103.988 0.000 . . . . . . A 101 PYB CB1 . 34158 1 257 . 4 3 1 1 PYB CB C 13 120.992 0.000 . . . . . . A 101 PYB CB . 34158 1 258 . 4 3 1 1 PYB CD C 13 37.633 0.000 . . . . . . A 101 PYB CD . 34158 1 259 . 5 3 1 1 PYB HB1 H 1 6.266 0.000 . . . . . . A 102 PYB HB1 . 34158 1 260 . 5 3 1 1 PYB HB H 1 7.625 0.000 . . . . . . A 102 PYB HB . 34158 1 261 . 5 3 1 1 PYB HD1 H 1 3.784 0.000 . . . . . . A 102 PYB HD1 . 34158 1 262 . 5 3 1 1 PYB CB1 C 13 102.624 0.000 . . . . . . A 102 PYB CB1 . 34158 1 263 . 5 3 1 1 PYB CB C 13 121.756 0.000 . . . . . . A 102 PYB CB . 34158 1 264 . 5 3 1 1 PYB CD C 13 37.252 0.000 . . . . . . A 102 PYB CD . 34158 1 265 . 6 3 1 1 PYB HB1 H 1 6.451 0.000 . . . . . . A 103 PYB HB1 . 34158 1 266 . 6 3 1 1 PYB HB H 1 7.094 0.000 . . . . . . A 103 PYB HB . 34158 1 267 . 6 3 1 1 PYB HD1 H 1 3.576 0.000 . . . . . . A 103 PYB HD1 . 34158 1 268 . 6 3 1 1 PYB CB1 C 13 105.277 0.000 . . . . . . A 103 PYB CB1 . 34158 1 269 . 6 3 1 1 PYB CB C 13 118.964 0.000 . . . . . . A 103 PYB CB . 34158 1 270 . 6 3 1 1 PYB CD C 13 36.267 0.000 . . . . . . A 103 PYB CD . 34158 1 271 . 8 5 1 1 IMT HB H 1 7.467 0.000 . . . . . . A 105 IMT HB . 34158 1 272 . 8 5 1 1 IMT HD1 H 1 3.955 0.000 . . . . . . A 105 IMT HD1 . 34158 1 273 . 8 5 1 1 IMT CB C 13 113.935 0.000 . . . . . . A 105 IMT CB . 34158 1 274 . 8 5 1 1 IMT CD C 13 36.401 0.000 . . . . . . A 105 IMT CD . 34158 1 275 . 9 3 1 1 PYB HB1 H 1 6.178 0.000 . . . . . . A 106 PYB HB1 . 34158 1 276 . 9 3 1 1 PYB HB H 1 7.629 0.000 . . . . . . A 106 PYB HB . 34158 1 277 . 9 3 1 1 PYB HD1 H 1 3.882 0.000 . . . . . . A 106 PYB HD1 . 34158 1 278 . 9 3 1 1 PYB CB1 C 13 104.328 0.000 . . . . . . A 106 PYB CB1 . 34158 1 279 . 9 3 1 1 PYB CB C 13 121.874 0.000 . . . . . . A 106 PYB CB . 34158 1 280 . 9 3 1 1 PYB CD C 13 37.725 0.000 . . . . . . A 106 PYB CD . 34158 1 281 . 10 3 1 1 PYB HB1 H 1 6.414 0.000 . . . . . . A 107 PYB HB1 . 34158 1 282 . 10 3 1 1 PYB HB H 1 7.506 0.000 . . . . . . A 107 PYB HB . 34158 1 283 . 10 3 1 1 PYB HD1 H 1 3.701 0.000 . . . . . . A 107 PYB HD1 . 34158 1 284 . 10 3 1 1 PYB CB1 C 13 102.464 0.000 . . . . . . A 107 PYB CB1 . 34158 1 285 . 10 3 1 1 PYB CB C 13 121.920 0.000 . . . . . . A 107 PYB CB . 34158 1 286 . 10 3 1 1 PYB CD C 13 37.058 0.000 . . . . . . A 107 PYB CD . 34158 1 287 . 11 3 1 1 PYB HB1 H 1 6.318 0.000 . . . . . . A 108 PYB HB1 . 34158 1 288 . 11 3 1 1 PYB HB H 1 7.046 0.000 . . . . . . A 108 PYB HB . 34158 1 289 . 11 3 1 1 PYB HD1 H 1 3.562 0.000 . . . . . . A 108 PYB HD1 . 34158 1 290 . 11 3 1 1 PYB C C 13 36.572 0.000 . . . . . . A 108 PYB C . 34158 1 291 . 11 3 1 1 PYB CB1 C 13 106.578 0.000 . . . . . . A 108 PYB CB1 . 34158 1 292 . 11 3 1 1 PYB CB C 13 119.914 0.000 . . . . . . A 108 PYB CB . 34158 1 293 . 11 3 1 1 PYB CD C 13 36.572 0.000 . . . . . . A 108 PYB CD . 34158 1 stop_ save_ ################################### # 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_2 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_2 _Assigned_chem_shift_list.Entry_ID 34158 _Assigned_chem_shift_list.ID 2 _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 1H-1H NOESY' . . . 34158 2 2 '2D 1H-1H NOESY' . . . 34158 2 3 '2D DQF-COSY' . . . 34158 2 4 '2D 1H-1H TOCSY' . . . 34158 2 5 '2D 1H-13C HSQC' . . . 34158 2 6 1H-31PCOSY . . . 34158 2 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.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 DCZ H1' H 1 5.760 0.001 . . . . . . A 1 DCZ H1' . 34158 2 2 . 1 1 1 1 DCZ H2'1 H 1 1.855 0.001 . . . . . . A 1 DCZ H2'1 . 34158 2 3 . 1 1 1 1 DCZ H2'2 H 1 2.372 0.001 . . . . . . A 1 DCZ H2'2 . 34158 2 4 . 1 1 1 1 DCZ H3' H 1 4.708 0.000 . . . . . . A 1 DCZ H3' . 34158 2 5 . 1 1 1 1 DCZ H4' H 1 4.062 0.001 . . . . . . A 1 DCZ H4' . 34158 2 6 . 1 1 1 1 DCZ H5 H 1 5.872 0.002 . . . . . . A 1 DCZ H5 . 34158 2 7 . 1 1 1 1 DCZ H6 H 1 7.586 0.001 . . . . . . A 1 DCZ H6 . 34158 2 8 . 1 1 2 2 DG H1 H 1 12.892 0.001 . . . . . . A 2 DG H1 . 34158 2 9 . 1 1 2 2 DG H1' H 1 5.440 0.002 . . . . . . A 2 DG H1' . 34158 2 10 . 1 1 2 2 DG H2' H 1 2.767 0.001 . . . . . . A 2 DG H2' . 34158 2 11 . 1 1 2 2 DG H2'' H 1 2.856 0.000 . . . . . . A 2 DG H2'' . 34158 2 12 . 1 1 2 2 DG H3' H 1 5.033 0.000 . . . . . . A 2 DG H3' . 34158 2 13 . 1 1 2 2 DG H4' H 1 4.321 0.001 . . . . . . A 2 DG H4' . 34158 2 14 . 1 1 2 2 DG H8 H 1 8.017 0.000 . . . . . . A 2 DG H8 . 34158 2 15 . 1 1 3 3 DA H1' H 1 6.352 0.001 . . . . . . A 3 DA H1' . 34158 2 16 . 1 1 3 3 DA H2 H 1 7.977 0.001 . . . . . . A 3 DA H2 . 34158 2 17 . 1 1 3 3 DA H2' H 1 2.827 0.000 . . . . . . A 3 DA H2' . 34158 2 18 . 1 1 3 3 DA H2'' H 1 3.009 0.001 . . . . . . A 3 DA H2'' . 34158 2 19 . 1 1 3 3 DA H3' H 1 5.128 0.001 . . . . . . A 3 DA H3' . 34158 2 20 . 1 1 3 3 DA H4' H 1 4.521 0.001 . . . . . . A 3 DA H4' . 34158 2 21 . 1 1 3 3 DA H8 H 1 8.437 0.001 . . . . . . A 3 DA H8 . 34158 2 22 . 1 1 4 4 DT H1' H 1 5.768 0.001 . . . . . . A 4 DT H1' . 34158 2 23 . 1 1 4 4 DT H2' H 1 2.509 0.001 . . . . . . A 4 DT H2' . 34158 2 24 . 1 1 4 4 DT H2'' H 1 2.606 0.000 . . . . . . A 4 DT H2'' . 34158 2 25 . 1 1 4 4 DT H3 H 1 13.721 0.001 . . . . . . A 4 DT H3 . 34158 2 26 . 1 1 4 4 DT H3' H 1 5.044 0.001 . . . . . . A 4 DT H3' . 34158 2 27 . 1 1 4 4 DT H4' H 1 4.267 0.002 . . . . . . A 4 DT H4' . 34158 2 28 . 1 1 4 4 DT H6 H 1 7.425 0.000 . . . . . . A 4 DT H6 . 34158 2 29 . 1 1 4 4 DT H71 H 1 1.556 0.001 . . . . . . A 4 DT H71 . 34158 2 30 . 1 1 4 4 DT H72 H 1 1.556 0.001 . . . . . . A 4 DT H72 . 34158 2 31 . 1 1 4 4 DT H73 H 1 1.556 0.001 . . . . . . A 4 DT H73 . 34158 2 32 . 1 1 5 5 DG H1 H 1 12.468 0.001 . . . . . . A 5 DG H1 . 34158 2 33 . 1 1 5 5 DG H1' H 1 5.897 0.001 . . . . . . A 5 DG H1' . 34158 2 34 . 1 1 5 5 DG H2' H 1 2.639 0.001 . . . . . . A 5 DG H2' . 34158 2 35 . 1 1 5 5 DG H3' H 1 5.046 0.000 . . . . . . A 5 DG H3' . 34158 2 36 . 1 1 5 5 DG H4' H 1 4.275 0.001 . . . . . . A 5 DG H4' . 34158 2 37 . 1 1 5 5 DG H8 H 1 8.018 0.001 . . . . . . A 5 DG H8 . 34158 2 38 . 1 1 5 5 DG H21 H 1 8.273 0.002 . . . . . . A 5 DG H21 . 34158 2 39 . 1 1 5 5 DG H22 H 1 6.593 0.001 . . . . . . A 5 DG H22 . 34158 2 40 . 1 1 6 6 DT H1' H 1 4.934 0.001 . . . . . . A 6 DT H1' . 34158 2 41 . 1 1 6 6 DT H2' H 1 1.724 0.001 . . . . . . A 6 DT H2' . 34158 2 42 . 1 1 6 6 DT H2'' H 1 2.234 0.002 . . . . . . A 6 DT H2'' . 34158 2 43 . 1 1 6 6 DT H3 H 1 12.431 0.001 . . . . . . A 6 DT H3 . 34158 2 44 . 1 1 6 6 DT H3' H 1 4.574 0.001 . . . . . . A 6 DT H3' . 34158 2 45 . 1 1 6 6 DT H4' H 1 2.474 0.001 . . . . . . A 6 DT H4' . 34158 2 46 . 1 1 6 6 DT H6 H 1 6.952 0.001 . . . . . . A 6 DT H6 . 34158 2 47 . 1 1 6 6 DT H71 H 1 1.310 0.001 . . . . . . A 6 DT H71 . 34158 2 48 . 1 1 6 6 DT H72 H 1 1.310 0.001 . . . . . . A 6 DT H72 . 34158 2 49 . 1 1 6 6 DT H73 H 1 1.310 0.001 . . . . . . A 6 DT H73 . 34158 2 50 . 1 1 7 7 DA H1' H 1 5.518 0.001 . . . . . . A 7 DA H1' . 34158 2 51 . 1 1 7 7 DA H2 H 1 8.042 0.002 . . . . . . A 7 DA H2 . 34158 2 52 . 1 1 7 7 DA H2' H 1 2.222 0.001 . . . . . . A 7 DA H2' . 34158 2 53 . 1 1 7 7 DA H2'' H 1 2.684 0.002 . . . . . . A 7 DA H2'' . 34158 2 54 . 1 1 7 7 DA H3' H 1 4.675 0.002 . . . . . . A 7 DA H3' . 34158 2 55 . 1 1 7 7 DA H4' H 1 2.952 0.001 . . . . . . A 7 DA H4' . 34158 2 56 . 1 1 7 7 DA H8 H 1 8.120 0.001 . . . . . . A 7 DA H8 . 34158 2 57 . 1 1 7 7 DA H61 H 1 8.461 0.000 . . . . . . A 7 DA H61 . 34158 2 58 . 1 1 8 8 DC H1' H 1 5.319 0.001 . . . . . . A 8 DC H1' . 34158 2 59 . 1 1 8 8 DC H2' H 1 1.453 0.002 . . . . . . A 8 DC H2' . 34158 2 60 . 1 1 8 8 DC H3' H 1 4.546 0.002 . . . . . . A 8 DC H3' . 34158 2 61 . 1 1 8 8 DC H5 H 1 5.275 0.002 . . . . . . A 8 DC H5 . 34158 2 62 . 1 1 8 8 DC H6 H 1 6.881 0.002 . . . . . . A 8 DC H6 . 34158 2 63 . 1 1 8 8 DC H41 H 1 8.739 0.001 . . . . . . A 8 DC H41 . 34158 2 64 . 1 1 8 8 DC H42 H 1 6.407 0.002 . . . . . . A 8 DC H42 . 34158 2 65 . 1 1 9 9 DA H1' H 1 5.556 0.001 . . . . . . A 9 DA H1' . 34158 2 66 . 1 1 9 9 DA H2 H 1 7.725 0.001 . . . . . . A 9 DA H2 . 34158 2 67 . 1 1 9 9 DA H2' H 1 2.175 0.000 . . . . . . A 9 DA H2' . 34158 2 68 . 1 1 9 9 DA H2'' H 1 2.564 0.000 . . . . . . A 9 DA H2'' . 34158 2 69 . 1 1 9 9 DA H3' H 1 4.649 0.001 . . . . . . A 9 DA H3' . 34158 2 70 . 1 1 9 9 DA H8 H 1 8.289 0.001 . . . . . . A 9 DA H8 . 34158 2 71 . 1 1 9 9 DA H61 H 1 8.698 0.000 . . . . . . A 9 DA H61 . 34158 2 72 . 1 1 10 10 DT H1' H 1 5.684 0.001 . . . . . . A 10 DT H1' . 34158 2 73 . 1 1 10 10 DT H2' H 1 1.860 0.001 . . . . . . A 10 DT H2' . 34158 2 74 . 1 1 10 10 DT H2'' H 1 2.292 0.000 . . . . . . A 10 DT H2'' . 34158 2 75 . 1 1 10 10 DT H3 H 1 13.525 0.002 . . . . . . A 10 DT H3 . 34158 2 76 . 1 1 10 10 DT H3' H 1 4.763 0.001 . . . . . . A 10 DT H3' . 34158 2 77 . 1 1 10 10 DT H4' H 1 3.903 0.001 . . . . . . A 10 DT H4' . 34158 2 78 . 1 1 10 10 DT H6 H 1 6.959 0.001 . . . . . . A 10 DT H6 . 34158 2 79 . 1 1 10 10 DT H71 H 1 1.440 0.001 . . . . . . A 10 DT H71 . 34158 2 80 . 1 1 10 10 DT H72 H 1 1.440 0.001 . . . . . . A 10 DT H72 . 34158 2 81 . 1 1 10 10 DT H73 H 1 1.440 0.001 . . . . . . A 10 DT H73 . 34158 2 82 . 1 1 11 11 DC H1' H 1 5.736 0.001 . . . . . . A 11 DC H1' . 34158 2 83 . 1 1 11 11 DC H2' H 1 1.962 0.001 . . . . . . A 11 DC H2' . 34158 2 84 . 1 1 11 11 DC H2'' H 1 2.354 0.000 . . . . . . A 11 DC H2'' . 34158 2 85 . 1 1 11 11 DC H5 H 1 5.613 0.002 . . . . . . A 11 DC H5 . 34158 2 86 . 1 1 11 11 DC H6 H 1 7.405 0.002 . . . . . . A 11 DC H6 . 34158 2 87 . 1 1 11 11 DC H41 H 1 8.558 0.002 . . . . . . A 11 DC H41 . 34158 2 88 . 1 1 11 11 DC H42 H 1 6.906 0.001 . . . . . . A 11 DC H42 . 34158 2 89 . 1 1 12 12 DG H1' H 1 6.146 0.000 . . . . . . A 12 DG H1' . 34158 2 90 . 1 1 12 12 DG H2' H 1 2.362 0.000 . . . . . . A 12 DG H2' . 34158 2 91 . 1 1 12 12 DG H2'' H 1 2.594 0.000 . . . . . . A 12 DG H2'' . 34158 2 92 . 1 1 12 12 DG H8 H 1 7.926 0.000 . . . . . . A 12 DG H8 . 34158 2 93 . 2 1 1 1 DCZ H1' H 1 5.741 0.002 . . . . . . B 13 DCZ H1' . 34158 2 94 . 2 1 1 1 DCZ H2'1 H 1 1.966 0.001 . . . . . . B 13 DCZ H2'1 . 34158 2 95 . 2 1 1 1 DCZ H2'2 H 1 2.431 0.000 . . . . . . B 13 DCZ H2'2 . 34158 2 96 . 2 1 1 1 DCZ H3' H 1 4.725 0.001 . . . . . . B 13 DCZ H3' . 34158 2 97 . 2 1 1 1 DCZ H4' H 1 4.069 0.001 . . . . . . B 13 DCZ H4' . 34158 2 98 . 2 1 1 1 DCZ H5 H 1 5.904 0.002 . . . . . . B 13 DCZ H5 . 34158 2 99 . 2 1 1 1 DCZ H6 H 1 7.645 0.001 . . . . . . B 13 DCZ H6 . 34158 2 100 . 2 1 2 2 DG H1 H 1 12.816 0.001 . . . . . . B 14 DG H1 . 34158 2 101 . 2 1 2 2 DG H1' H 1 5.667 0.002 . . . . . . B 14 DG H1' . 34158 2 102 . 2 1 2 2 DG H2' H 1 2.764 0.001 . . . . . . B 14 DG H2' . 34158 2 103 . 2 1 2 2 DG H2'' H 1 2.888 0.002 . . . . . . B 14 DG H2'' . 34158 2 104 . 2 1 2 2 DG H3' H 1 5.041 0.000 . . . . . . B 14 DG H3' . 34158 2 105 . 2 1 2 2 DG H4' H 1 4.366 0.001 . . . . . . B 14 DG H4' . 34158 2 106 . 2 1 2 2 DG H8 H 1 8.002 0.002 . . . . . . B 14 DG H8 . 34158 2 107 . 2 1 3 3 DA H1' H 1 6.321 0.001 . . . . . . B 15 DA H1' . 34158 2 108 . 2 1 3 3 DA H2 H 1 7.891 0.001 . . . . . . B 15 DA H2 . 34158 2 109 . 2 1 3 3 DA H2' H 1 2.699 0.000 . . . . . . B 15 DA H2' . 34158 2 110 . 2 1 3 3 DA H2'' H 1 2.976 0.001 . . . . . . B 15 DA H2'' . 34158 2 111 . 2 1 3 3 DA H3' H 1 5.100 0.001 . . . . . . B 15 DA H3' . 34158 2 112 . 2 1 3 3 DA H4' H 1 4.505 0.000 . . . . . . B 15 DA H4' . 34158 2 113 . 2 1 3 3 DA H8 H 1 8.314 0.001 . . . . . . B 15 DA H8 . 34158 2 114 . 2 1 4 4 DT H1' H 1 5.619 0.002 . . . . . . B 16 DT H1' . 34158 2 115 . 2 1 4 4 DT H2' H 1 2.249 0.001 . . . . . . B 16 DT H2' . 34158 2 116 . 2 1 4 4 DT H2'' H 1 2.378 0.000 . . . . . . B 16 DT H2'' . 34158 2 117 . 2 1 4 4 DT H3 H 1 13.513 0.001 . . . . . . B 16 DT H3 . 34158 2 118 . 2 1 4 4 DT H3' H 1 4.924 0.001 . . . . . . B 16 DT H3' . 34158 2 119 . 2 1 4 4 DT H4' H 1 4.138 0.002 . . . . . . B 16 DT H4' . 34158 2 120 . 2 1 4 4 DT H6 H 1 7.272 0.001 . . . . . . B 16 DT H6 . 34158 2 121 . 2 1 4 4 DT H71 H 1 1.517 0.001 . . . . . . B 16 DT H71 . 34158 2 122 . 2 1 4 4 DT H72 H 1 1.517 0.001 . . . . . . B 16 DT H72 . 34158 2 123 . 2 1 4 4 DT H73 H 1 1.517 0.001 . . . . . . B 16 DT H73 . 34158 2 124 . 2 1 5 5 DG H1 H 1 12.750 0.002 . . . . . . B 17 DG H1 . 34158 2 125 . 2 1 5 5 DG H1' H 1 5.782 0.001 . . . . . . B 17 DG H1' . 34158 2 126 . 2 1 5 5 DG H2' H 1 2.639 0.001 . . . . . . B 17 DG H2' . 34158 2 127 . 2 1 5 5 DG H3' H 1 4.993 0.001 . . . . . . B 17 DG H3' . 34158 2 128 . 2 1 5 5 DG H4' H 1 4.265 0.001 . . . . . . B 17 DG H4' . 34158 2 129 . 2 1 5 5 DG H8 H 1 8.005 0.001 . . . . . . B 17 DG H8 . 34158 2 130 . 2 1 5 5 DG H21 H 1 8.540 0.001 . . . . . . B 17 DG H21 . 34158 2 131 . 2 1 5 5 DG H22 H 1 7.259 0.002 . . . . . . B 17 DG H22 . 34158 2 132 . 2 1 6 6 DT H1' H 1 5.201 0.001 . . . . . . B 18 DT H1' . 34158 2 133 . 2 1 6 6 DT H2' H 1 1.702 0.001 . . . . . . B 18 DT H2' . 34158 2 134 . 2 1 6 6 DT H2'' H 1 2.250 0.000 . . . . . . B 18 DT H2'' . 34158 2 135 . 2 1 6 6 DT H3 H 1 12.802 0.001 . . . . . . B 18 DT H3 . 34158 2 136 . 2 1 6 6 DT H3' H 1 4.623 0.001 . . . . . . B 18 DT H3' . 34158 2 137 . 2 1 6 6 DT H4' H 1 2.044 0.001 . . . . . . B 18 DT H4' . 34158 2 138 . 2 1 6 6 DT H6 H 1 6.972 0.001 . . . . . . B 18 DT H6 . 34158 2 139 . 2 1 6 6 DT H71 H 1 1.439 0.001 . . . . . . B 18 DT H71 . 34158 2 140 . 2 1 6 6 DT H72 H 1 1.439 0.001 . . . . . . B 18 DT H72 . 34158 2 141 . 2 1 6 6 DT H73 H 1 1.439 0.001 . . . . . . B 18 DT H73 . 34158 2 142 . 2 1 7 7 DA H1' H 1 5.500 0.002 . . . . . . B 19 DA H1' . 34158 2 143 . 2 1 7 7 DA H2 H 1 8.021 0.003 . . . . . . B 19 DA H2 . 34158 2 144 . 2 1 7 7 DA H2' H 1 2.171 0.000 . . . . . . B 19 DA H2' . 34158 2 145 . 2 1 7 7 DA H2'' H 1 2.708 0.001 . . . . . . B 19 DA H2'' . 34158 2 146 . 2 1 7 7 DA H3' H 1 4.668 0.002 . . . . . . B 19 DA H3' . 34158 2 147 . 2 1 7 7 DA H4' H 1 2.636 0.002 . . . . . . B 19 DA H4' . 34158 2 148 . 2 1 7 7 DA H8 H 1 8.142 0.001 . . . . . . B 19 DA H8 . 34158 2 149 . 2 1 7 7 DA H61 H 1 8.551 0.000 . . . . . . B 19 DA H61 . 34158 2 150 . 2 1 8 8 DC H1' H 1 5.331 0.001 . . . . . . B 20 DC H1' . 34158 2 151 . 2 1 8 8 DC H2' H 1 1.510 0.001 . . . . . . B 20 DC H2' . 34158 2 152 . 2 1 8 8 DC H3' H 1 4.557 0.002 . . . . . . B 20 DC H3' . 34158 2 153 . 2 1 8 8 DC H4' H 1 2.337 0.001 . . . . . . B 20 DC H4' . 34158 2 154 . 2 1 8 8 DC H5 H 1 5.288 0.002 . . . . . . B 20 DC H5 . 34158 2 155 . 2 1 8 8 DC H6 H 1 6.893 0.002 . . . . . . B 20 DC H6 . 34158 2 156 . 2 1 8 8 DC H41 H 1 8.672 0.003 . . . . . . B 20 DC H41 . 34158 2 157 . 2 1 8 8 DC H42 H 1 6.489 0.002 . . . . . . B 20 DC H42 . 34158 2 158 . 2 1 9 9 DA H1' H 1 5.446 0.001 . . . . . . B 21 DA H1' . 34158 2 159 . 2 1 9 9 DA H2 H 1 7.732 0.001 . . . . . . B 21 DA H2 . 34158 2 160 . 2 1 9 9 DA H2' H 1 2.176 0.000 . . . . . . B 21 DA H2' . 34158 2 161 . 2 1 9 9 DA H2'' H 1 2.473 0.002 . . . . . . B 21 DA H2'' . 34158 2 162 . 2 1 9 9 DA H3' H 1 4.634 0.001 . . . . . . B 21 DA H3' . 34158 2 163 . 2 1 9 9 DA H4' H 1 2.780 0.001 . . . . . . B 21 DA H4' . 34158 2 164 . 2 1 9 9 DA H8 H 1 8.285 0.001 . . . . . . B 21 DA H8 . 34158 2 165 . 2 1 9 9 DA H61 H 1 8.636 0.000 . . . . . . B 21 DA H61 . 34158 2 166 . 2 1 10 10 DT H1' H 1 5.729 0.001 . . . . . . B 22 DT H1' . 34158 2 167 . 2 1 10 10 DT H2' H 1 1.838 0.002 . . . . . . B 22 DT H2' . 34158 2 168 . 2 1 10 10 DT H2'' H 1 2.101 0.000 . . . . . . B 22 DT H2'' . 34158 2 169 . 2 1 10 10 DT H3 H 1 13.839 0.000 . . . . . . B 22 DT H3 . 34158 2 170 . 2 1 10 10 DT H3' H 1 4.774 0.000 . . . . . . B 22 DT H3' . 34158 2 171 . 2 1 10 10 DT H4' H 1 3.747 0.000 . . . . . . B 22 DT H4' . 34158 2 172 . 2 1 10 10 DT H6 H 1 6.949 0.001 . . . . . . B 22 DT H6 . 34158 2 173 . 2 1 10 10 DT H71 H 1 1.349 0.001 . . . . . . B 22 DT H71 . 34158 2 174 . 2 1 10 10 DT H72 H 1 1.349 0.001 . . . . . . B 22 DT H72 . 34158 2 175 . 2 1 10 10 DT H73 H 1 1.349 0.001 . . . . . . B 22 DT H73 . 34158 2 176 . 2 1 11 11 DC H1' H 1 5.494 0.001 . . . . . . B 23 DC H1' . 34158 2 177 . 2 1 11 11 DC H2' H 1 2.093 0.001 . . . . . . B 23 DC H2' . 34158 2 178 . 2 1 11 11 DC H2'' H 1 2.306 0.001 . . . . . . B 23 DC H2'' . 34158 2 179 . 2 1 11 11 DC H4' H 1 4.113 0.000 . . . . . . B 23 DC H4' . 34158 2 180 . 2 1 11 11 DC H5 H 1 5.648 0.001 . . . . . . B 23 DC H5 . 34158 2 181 . 2 1 11 11 DC H6 H 1 7.458 0.001 . . . . . . B 23 DC H6 . 34158 2 182 . 2 1 11 11 DC H41 H 1 8.629 0.001 . . . . . . B 23 DC H41 . 34158 2 183 . 2 1 11 11 DC H42 H 1 6.947 0.000 . . . . . . B 23 DC H42 . 34158 2 184 . 2 1 12 12 DG H1' H 1 6.172 0.000 . . . . . . B 24 DG H1' . 34158 2 185 . 2 1 12 12 DG H2' H 1 2.398 0.000 . . . . . . B 24 DG H2' . 34158 2 186 . 2 1 12 12 DG H2'' H 1 2.621 0.000 . . . . . . B 24 DG H2'' . 34158 2 187 . 2 1 12 12 DG H8 H 1 7.938 0.001 . . . . . . B 24 DG H8 . 34158 2 188 . 3 2 1 1 9U2 H83 H 1 8.859 0.001 . . . . . . A 100 9U2 H83 . 34158 2 189 . 3 2 1 1 9U2 H85 H 1 4.138 0.001 . . . . . . A 100 9U2 H85 . 34158 2 190 . 3 2 1 1 9U2 H881 H 1 1.287 0.001 . . . . . . A 100 9U2 H881 . 34158 2 191 . 3 2 1 1 9U2 H991 H 1 1.531 0.001 . . . . . . A 100 9U2 H991 . 34158 2 192 . 4 3 1 1 PYB H H 1 9.618 0.001 . . . . . . A 101 PYB H . 34158 2 193 . 4 3 1 1 PYB HB1 H 1 5.984 0.001 . . . . . . A 101 PYB HB1 . 34158 2 194 . 4 3 1 1 PYB HB H 1 7.654 0.001 . . . . . . A 101 PYB HB . 34158 2 195 . 4 3 1 1 PYB HD1 H 1 3.923 0.001 . . . . . . A 101 PYB HD1 . 34158 2 196 . 5 3 1 1 PYB H H 1 10.538 0.001 . . . . . . A 102 PYB H . 34158 2 197 . 5 3 1 1 PYB HB1 H 1 6.248 0.001 . . . . . . A 102 PYB HB1 . 34158 2 198 . 5 3 1 1 PYB HB H 1 7.615 0.001 . . . . . . A 102 PYB HB . 34158 2 199 . 5 3 1 1 PYB HD1 H 1 3.782 0.002 . . . . . . A 102 PYB HD1 . 34158 2 200 . 6 3 1 1 PYB H H 1 9.135 0.001 . . . . . . A 103 PYB H . 34158 2 201 . 6 3 1 1 PYB HB1 H 1 6.438 0.001 . . . . . . A 103 PYB HB1 . 34158 2 202 . 6 3 1 1 PYB HB H 1 7.088 0.001 . . . . . . A 103 PYB HB . 34158 2 203 . 6 3 1 1 PYB HD1 H 1 3.574 0.001 . . . . . . A 103 PYB HD1 . 34158 2 204 . 7 4 1 1 ABU H H 1 8.229 0.001 . . . . . . A 104 ABU H . 34158 2 205 . 7 4 1 1 ABU HG1 H 1 2.102 0.002 . . . . . . A 104 ABU HG1 . 34158 2 206 . 7 4 1 1 ABU HG2 H 1 2.509 0.000 . . . . . . A 104 ABU HG2 . 34158 2 207 . 7 4 1 1 ABU HB1 H 1 1.592 0.001 . . . . . . A 104 ABU HB1 . 34158 2 208 . 7 4 1 1 ABU HB2 H 1 2.300 0.001 . . . . . . A 104 ABU HB2 . 34158 2 209 . 7 4 1 1 ABU HA2 H 1 2.754 0.001 . . . . . . A 104 ABU HA2 . 34158 2 210 . 7 4 1 1 ABU HA1 H 1 3.445 0.002 . . . . . . A 104 ABU HA1 . 34158 2 211 . 8 5 1 1 IMT H H 1 10.429 0.001 . . . . . . A 105 IMT H . 34158 2 212 . 8 5 1 1 IMT HB H 1 7.459 0.001 . . . . . . A 105 IMT HB . 34158 2 213 . 8 5 1 1 IMT HD1 H 1 3.949 0.001 . . . . . . A 105 IMT HD1 . 34158 2 214 . 9 3 1 1 PYB H H 1 9.803 0.001 . . . . . . A 106 PYB H . 34158 2 215 . 9 3 1 1 PYB HB1 H 1 6.172 0.001 . . . . . . A 106 PYB HB1 . 34158 2 216 . 9 3 1 1 PYB HB H 1 7.619 0.001 . . . . . . A 106 PYB HB . 34158 2 217 . 9 3 1 1 PYB HD1 H 1 3.874 0.000 . . . . . . A 106 PYB HD1 . 34158 2 218 . 10 3 1 1 PYB H H 1 10.731 0.001 . . . . . . A 107 PYB H . 34158 2 219 . 10 3 1 1 PYB HB1 H 1 6.403 0.001 . . . . . . A 107 PYB HB1 . 34158 2 220 . 10 3 1 1 PYB HB H 1 7.497 0.001 . . . . . . A 107 PYB HB . 34158 2 221 . 10 3 1 1 PYB HD1 H 1 3.697 0.001 . . . . . . A 107 PYB HD1 . 34158 2 222 . 11 3 1 1 PYB H H 1 9.364 0.001 . . . . . . A 108 PYB H . 34158 2 223 . 11 3 1 1 PYB HB1 H 1 6.308 0.001 . . . . . . A 108 PYB HB1 . 34158 2 224 . 11 3 1 1 PYB HB H 1 7.035 0.001 . . . . . . A 108 PYB HB . 34158 2 225 . 11 3 1 1 PYB HD1 H 1 3.560 0.001 . . . . . . A 108 PYB HD1 . 34158 2 226 . 12 6 1 1 9T8 H031 H 1 3.134 0.001 . . . . . . A 109 9T8 H031 . 34158 2 227 . 12 6 1 1 9T8 H032 H 1 3.190 0.001 . . . . . . A 109 9T8 H032 . 34158 2 228 . 12 6 1 1 9T8 H041 H 1 1.949 0.001 . . . . . . A 109 9T8 H041 . 34158 2 229 . 12 6 1 1 9T8 H042 H 1 2.139 0.001 . . . . . . A 109 9T8 H042 . 34158 2 230 . 12 6 1 1 9T8 H051 H 1 2.980 0.001 . . . . . . A 109 9T8 H051 . 34158 2 231 . 12 6 1 1 9T8 H052 H 1 3.626 0.001 . . . . . . A 109 9T8 H052 . 34158 2 232 . 12 6 1 1 9T8 H071 H 1 1.617 0.001 . . . . . . A 109 9T8 H071 . 34158 2 233 . 12 6 1 1 9T8 H072 H 1 2.055 0.001 . . . . . . A 109 9T8 H072 . 34158 2 234 . 12 6 1 1 9T8 H081 H 1 2.889 0.002 . . . . . . A 109 9T8 H081 . 34158 2 235 . 12 6 1 1 9T8 H082 H 1 3.794 0.001 . . . . . . A 109 9T8 H082 . 34158 2 236 . 12 6 1 1 9T8 HN02 H 1 8.160 0.001 . . . . . . A 109 9T8 HN02 . 34158 2 237 . 12 6 1 1 9T8 H1 H 1 9.246 0.001 . . . . . . A 109 9T8 H1 . 34158 2 stop_ save_