################################### # 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 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts _Assigned_chem_shift_list.Entry_ID 6537 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $normal_condition _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $normal_reference _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 $sample_1 isotropic 6537 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 DC H1' H 1 5.466 0.001 . 1 . . . . 1 CYT H1' . 6537 1 2 . 1 1 1 1 DC H2' H 1 1.788 0.002 . 1 . . . . 1 CYT H2' . 6537 1 3 . 1 1 1 1 DC H2'' H 1 2.165 0.001 . 1 . . . . 1 CYT H2'' . 6537 1 4 . 1 1 1 1 DC H3' H 1 4.29 0.001 . 1 . . . . 1 CYT H3' . 6537 1 5 . 1 1 1 1 DC H41 H 1 7.578 0.003 . 1 . . . . 1 CYT H41 . 6537 1 6 . 1 1 1 1 DC H42 H 1 6.807 0.001 . 1 . . . . 1 CYT H42 . 6537 1 7 . 1 1 1 1 DC H5 H 1 5.575 0.001 . 1 . . . . 1 CYT H5 . 6537 1 8 . 1 1 1 1 DC H6 H 1 7.511 0.001 . 1 . . . . 1 CYT H6 . 6537 1 9 . 1 1 2 2 DT H1' H 1 5.136 0.001 . 1 . . . . 2 THY H1' . 6537 1 10 . 1 1 2 2 DT H2' H 1 1.811 0.002 . 1 . . . . 2 THY H2' . 6537 1 11 . 1 1 2 2 DT H2'' H 1 2.056 0.002 . 1 . . . . 2 THY H2'' . 6537 1 12 . 1 1 2 2 DT H3 H 1 13.315 0.002 . 1 . . . . 2 THY H3 . 6537 1 13 . 1 1 2 2 DT H3' H 1 4.503 0.000 . 1 . . . . 2 THY H3' . 6537 1 14 . 1 1 2 2 DT H6 H 1 7.184 0.002 . 1 . . . . 2 THY H6 . 6537 1 15 . 1 1 2 2 DT H71 H 1 1.323 0.001 . 1 . . . . 2 THY H71 . 6537 1 16 . 1 1 2 2 DT H72 H 1 1.323 0.001 . 1 . . . . 2 THY H71 . 6537 1 17 . 1 1 2 2 DT H73 H 1 1.323 0.001 . 1 . . . . 2 THY H71 . 6537 1 18 . 1 1 3 3 DA H1' H 1 5.471 0.001 . 1 . . . . 3 ADE H1' . 6537 1 19 . 1 1 3 3 DA H2 H 1 6.567 0.001 . 1 . . . . 3 ADE H2 . 6537 1 20 . 1 1 3 3 DA H2' H 1 2.261 0.001 . 1 . . . . 3 ADE H2' . 6537 1 21 . 1 1 3 3 DA H3' H 1 4.665 0.000 . 1 . . . . 3 ADE H3' . 6537 1 22 . 1 1 3 3 DA H8 H 1 7.747 0.001 . 1 . . . . 3 ADE H8 . 6537 1 23 . 1 1 4 4 DA H1' H 1 4.951 0.001 . 1 . . . . 4 ADE H1' . 6537 1 24 . 1 1 4 4 DA H2 H 1 7.089 0.001 . 1 . . . . 4 ADE H2 . 6537 1 25 . 1 1 4 4 DA H2' H 1 1.445 0.001 . 1 . . . . 4 ADE H2' . 6537 1 26 . 1 1 4 4 DA H2'' H 1 1.113 0.001 . 1 . . . . 4 ADE H2'' . 6537 1 27 . 1 1 4 4 DA H3' H 1 4.542 0.000 . 1 . . . . 4 ADE H3' . 6537 1 28 . 1 1 4 4 DA H61 H 1 6.77 0.000 . 1 . . . . 4 ADE H61 . 6537 1 29 . 1 1 4 4 DA H62 H 1 5.615 0.002 . 1 . . . . 4 ADE H62 . 6537 1 30 . 1 1 4 4 DA H8 H 1 6.365 0.001 . 1 . . . . 4 ADE H8 . 6537 1 31 . 1 1 5 5 DC H1' H 1 6.313 0.001 . 1 . . . . 5 CYT H1' . 6537 1 32 . 1 1 5 5 DC H2' H 1 2.17 0.002 . 1 . . . . 5 CYT H2' . 6537 1 33 . 1 1 5 5 DC H2'' H 1 2.215 0.001 . 1 . . . . 5 CYT H2'' . 6537 1 34 . 1 1 5 5 DC H3' H 1 4.757 0.002 . 1 . . . . 5 CYT H3' . 6537 1 35 . 1 1 5 5 DC H41 H 1 7.784 0.001 . 1 . . . . 5 CYT H41 . 6537 1 36 . 1 1 5 5 DC H42 H 1 6.733 0.001 . 1 . . . . 5 CYT H42 . 6537 1 37 . 1 1 5 5 DC H5 H 1 6.061 0.001 . 1 . . . . 5 CYT H5 . 6537 1 38 . 1 1 5 5 DC H6 H 1 7.655 0.001 . 1 . . . . 5 CYT H6 . 6537 1 39 . 1 1 6 6 DA H1' H 1 4.19 0.001 . 1 . . . . 6 ADE H1' . 6537 1 40 . 1 1 6 6 DA H2 H 1 7.072 0.001 . 1 . . . . 6 ADE H2 . 6537 1 41 . 1 1 6 6 DA H2' H 1 2.114 0.001 . 1 . . . . 6 ADE H2' . 6537 1 42 . 1 1 6 6 DA H2'' H 1 2.45 0.003 . 1 . . . . 6 ADE H2'' . 6537 1 43 . 1 1 6 6 DA H3' H 1 4.583 0.000 . 1 . . . . 6 ADE H3' . 6537 1 44 . 1 1 6 6 DA H61 H 1 7.833 0.002 . 1 . . . . 6 ADE H61 . 6537 1 45 . 1 1 6 6 DA H62 H 1 6.624 0.001 . 1 . . . . 6 ADE H62 . 6537 1 46 . 1 1 6 6 DA H8 H 1 7.782 0.000 . 1 . . . . 6 ADE H8 . 6537 1 47 . 1 1 7 7 DG H1 H 1 11.159 0.001 . 1 . . . . 7 GUA H1 . 6537 1 48 . 1 1 7 7 DG H1' H 1 5.37 0.001 . 1 . . . . 7 GUA H1' . 6537 1 49 . 1 1 7 7 DG H2' H 1 2.548 0.002 . 1 . . . . 7 GUA H2' . 6537 1 50 . 1 1 7 7 DG H2'' H 1 2.591 0.001 . 1 . . . . 7 GUA H2'' . 6537 1 51 . 1 1 7 7 DG H21 H 1 6.991 0.001 . 1 . . . . 7 GUA H21 . 6537 1 52 . 1 1 7 7 DG H3' H 1 4.786 0.001 . 1 . . . . 7 GUA H3' . 6537 1 53 . 1 1 7 7 DG H8 H 1 7.693 0.001 . 1 . . . . 7 GUA H8 . 6537 1 54 . 1 1 8 8 DA H1' H 1 5.479 0.001 . 1 . . . . 8 ADE H1' . 6537 1 55 . 1 1 8 8 DA H2 H 1 6.806 0.001 . 1 . . . . 8 ADE H2 . 6537 1 56 . 1 1 8 8 DA H2' H 1 2.403 0.001 . 1 . . . . 8 ADE H2' . 6537 1 57 . 1 1 8 8 DA H2'' H 1 2.446 0.001 . 1 . . . . 8 ADE H2'' . 6537 1 58 . 1 1 8 8 DA H3' H 1 4.756 0.003 . 1 . . . . 8 ADE H3' . 6537 1 59 . 1 1 8 8 DA H8 H 1 7.834 0.001 . 1 . . . . 8 ADE H8 . 6537 1 60 . 1 1 9 9 DA H1' H 1 5.885 0.001 . 1 . . . . 9 ADE H1' . 6537 1 61 . 1 1 9 9 DA H2 H 1 7.195 0.002 . 1 . . . . 9 ADE H2 . 6537 1 62 . 1 1 9 9 DA H2' H 1 2.268 0.002 . 1 . . . . 9 ADE H2' . 6537 1 63 . 1 1 9 9 DA H2'' H 1 2.563 0.003 . 1 . . . . 9 ADE H2'' . 6537 1 64 . 1 1 9 9 DA H3' H 1 4.713 0.002 . 1 . . . . 9 ADE H3' . 6537 1 65 . 1 1 9 9 DA H62 H 1 5.525 0.001 . 1 . . . . 9 ADE H62 . 6537 1 66 . 1 1 9 9 DA H8 H 1 7.94 0.001 . 1 . . . . 9 ADE H8 . 6537 1 67 . 1 1 10 10 DT H1' H 1 5.362 0.001 . 1 . . . . 10 THY H1' . 6537 1 68 . 1 1 10 10 DT H2' H 1 1.502 0.002 . 1 . . . . 10 THY H2' . 6537 1 69 . 1 1 10 10 DT H2'' H 1 1.961 0.002 . 1 . . . . 10 THY H2'' . 6537 1 70 . 1 1 10 10 DT H3 H 1 13.228 0.002 . 1 . . . . 10 THY H3 . 6537 1 71 . 1 1 10 10 DT H3' H 1 4.491 0.001 . 1 . . . . 10 THY H3' . 6537 1 72 . 1 1 10 10 DT H6 H 1 6.706 0.001 . 1 . . . . 10 THY H6 . 6537 1 73 . 1 1 10 10 DT H71 H 1 1.081 0.001 . 1 . . . . 10 THY H71 . 6537 1 74 . 1 1 10 10 DT H72 H 1 1.081 0.001 . 1 . . . . 10 THY H71 . 6537 1 75 . 1 1 10 10 DT H73 H 1 1.081 0.001 . 1 . . . . 10 THY H71 . 6537 1 76 . 1 1 11 11 DG H1' H 1 5.735 0.000 . 1 . . . . 11 GUA H1' . 6537 1 77 . 1 1 11 11 DG H2' H 1 2.197 0.001 . 1 . . . . 11 GUA H2' . 6537 1 78 . 1 1 11 11 DG H2'' H 1 1.966 0.001 . 1 . . . . 11 GUA H2'' . 6537 1 79 . 1 1 11 11 DG H3' H 1 4.31 0.001 . 1 . . . . 11 GUA H3' . 6537 1 80 . 1 1 11 11 DG H8 H 1 7.483 0.001 . 1 . . . . 11 GUA H8 . 6537 1 81 . 2 2 1 1 DC H1' H 1 5.301 0.002 . 1 . . . . 12 CYT H1' . 6537 1 82 . 2 2 1 1 DC H2' H 1 1.726 0.002 . 1 . . . . 12 CYT H2' . 6537 1 83 . 2 2 1 1 DC H2'' H 1 2.119 0.002 . 1 . . . . 12 CYT H2'' . 6537 1 84 . 2 2 1 1 DC H3' H 1 4.373 0.001 . 1 . . . . 12 CYT H3' . 6537 1 85 . 2 2 1 1 DC H41 H 1 7.727 0.000 . 1 . . . . 12 CYT H41 . 6537 1 86 . 2 2 1 1 DC H42 H 1 6.678 0.001 . 1 . . . . 12 CYT H42 . 6537 1 87 . 2 2 1 1 DC H5 H 1 5.595 0.001 . 1 . . . . 12 CYT H5 . 6537 1 88 . 2 2 1 1 DC H6 H 1 7.383 0.001 . 1 . . . . 12 CYT H6 . 6537 1 89 . 2 2 2 2 DA H1' H 1 5.936 0.001 . 1 . . . . 13 ADE H1' . 6537 1 90 . 2 2 2 2 DA H2 H 1 7.343 0.001 . 1 . . . . 13 ADE H2 . 6537 1 91 . 2 2 2 2 DA H2' H 1 2.397 0.002 . 1 . . . . 13 ADE H2' . 6537 1 92 . 2 2 2 2 DA H2'' H 1 2.591 0.002 . 1 . . . . 13 ADE H2'' . 6537 1 93 . 2 2 2 2 DA H3' H 1 4.674 0.003 . 1 . . . . 13 ADE H3' . 6537 1 94 . 2 2 2 2 DA H8 H 1 8.045 0.001 . 1 . . . . 13 ADE H8 . 6537 1 95 . 2 2 3 3 DT H1' H 1 5.515 0.001 . 1 . . . . 14 THY H1' . 6537 1 96 . 2 2 3 3 DT H2' H 1 1.51 0.001 . 1 . . . . 14 THY H2' . 6537 1 97 . 2 2 3 3 DT H2'' H 1 1.884 0.001 . 1 . . . . 14 THY H2'' . 6537 1 98 . 2 2 3 3 DT H3 H 1 13.166 0.002 . 1 . . . . 14 THY H3 . 6537 1 99 . 2 2 3 3 DT H3' H 1 4.501 0.001 . 1 . . . . 14 THY H3' . 6537 1 100 . 2 2 3 3 DT H6 H 1 6.778 0.001 . 1 . . . . 14 THY H6 . 6537 1 101 . 2 2 3 3 DT H71 H 1 0.886 0.001 . 1 . . . . 14 THY H71 . 6537 1 102 . 2 2 3 3 DT H72 H 1 0.886 0.001 . 1 . . . . 14 THY H71 . 6537 1 103 . 2 2 3 3 DT H73 H 1 0.886 0.001 . 1 . . . . 14 THY H71 . 6537 1 104 . 2 2 4 4 DT H1' H 1 5.101 0.002 . 1 . . . . 15 THY H1' . 6537 1 105 . 2 2 4 4 DT H2' H 1 0.729 0.002 . 1 . . . . 15 THY H2' . 6537 1 106 . 2 2 4 4 DT H2'' H 1 1.307 0.002 . 1 . . . . 15 THY H2'' . 6537 1 107 . 2 2 4 4 DT H3 H 1 13.308 0.001 . 1 . . . . 15 THY H3 . 6537 1 108 . 2 2 4 4 DT H3' H 1 4.391 0.001 . 1 . . . . 15 THY H3' . 6537 1 109 . 2 2 4 4 DT H6 H 1 5.609 0.001 . 1 . . . . 15 THY H6 . 6537 1 110 . 2 2 4 4 DT H71 H 1 0.793 0.001 . 1 . . . . 15 THY H71 . 6537 1 111 . 2 2 4 4 DT H72 H 1 0.793 0.001 . 1 . . . . 15 THY H71 . 6537 1 112 . 2 2 4 4 DT H73 H 1 0.793 0.001 . 1 . . . . 15 THY H71 . 6537 1 113 . 2 2 5 5 DC H1' H 1 6.31 0.001 . 1 . . . . 16 CYT H1' . 6537 1 114 . 2 2 5 5 DC H2' H 1 2.162 0.002 . 1 . . . . 16 CYT H2' . 6537 1 115 . 2 2 5 5 DC H2'' H 1 2.221 0.001 . 1 . . . . 16 CYT H2'' . 6537 1 116 . 2 2 5 5 DC H3' H 1 4.779 0.002 . 1 . . . . 16 CYT H3' . 6537 1 117 . 2 2 5 5 DC H41 H 1 7.693 0.001 . 1 . . . . 16 CYT H41 . 6537 1 118 . 2 2 5 5 DC H42 H 1 6.71 0.001 . 1 . . . . 16 CYT H42 . 6537 1 119 . 2 2 5 5 DC H5 H 1 6.104 0.001 . 1 . . . . 16 CYT H5 . 6537 1 120 . 2 2 5 5 DC H6 H 1 7.724 0.001 . 1 . . . . 16 CYT H6 . 6537 1 121 . 2 2 6 6 DA H1' H 1 4.247 0.001 . 1 . . . . 17 ADE H1' . 6537 1 122 . 2 2 6 6 DA H2 H 1 6.991 0.001 . 1 . . . . 17 ADE H2 . 6537 1 123 . 2 2 6 6 DA H2' H 1 2.255 0.001 . 1 . . . . 17 ADE H2' . 6537 1 124 . 2 2 6 6 DA H2'' H 1 2.501 0.001 . 1 . . . . 17 ADE H2'' . 6537 1 125 . 2 2 6 6 DA H3' H 1 4.637 0.001 . 1 . . . . 17 ADE H3' . 6537 1 126 . 2 2 6 6 DA H61 H 1 7.725 0.002 . 1 . . . . 17 ADE H61 . 6537 1 127 . 2 2 6 6 DA H62 H 1 6.591 0.001 . 1 . . . . 17 ADE H62 . 6537 1 128 . 2 2 6 6 DA H8 H 1 7.806 0.002 . 1 . . . . 17 ADE H8 . 6537 1 129 . 2 2 7 7 DG H1 H 1 11.293 0.001 . 1 . . . . 18 GUA H1 . 6537 1 130 . 2 2 7 7 DG H1' H 1 5.763 0.001 . 1 . . . . 18 GUA H1' . 6537 1 131 . 2 2 7 7 DG H2' H 1 2.526 0.002 . 1 . . . . 18 GUA H2' . 6537 1 132 . 2 2 7 7 DG H2'' H 1 2.618 0.001 . 1 . . . . 18 GUA H2'' . 6537 1 133 . 2 2 7 7 DG H21 H 1 7.072 0.003 . 1 . . . . 18 GUA H21 . 6537 1 134 . 2 2 7 7 DG H3' H 1 4.82 0.001 . 1 . . . . 18 GUA H3' . 6537 1 135 . 2 2 7 7 DG H8 H 1 7.787 0.001 . 1 . . . . 18 GUA H8 . 6537 1 136 . 2 2 8 8 DT H1' H 1 5.756 0.001 . 1 . . . . 19 THY H1' . 6537 1 137 . 2 2 8 8 DT H2' H 1 1.816 0.002 . 1 . . . . 19 THY H2' . 6537 1 138 . 2 2 8 8 DT H2'' H 1 2.162 0.001 . 1 . . . . 19 THY H2'' . 6537 1 139 . 2 2 8 8 DT H3 H 1 13.757 0.001 . 1 . . . . 19 THY H3 . 6537 1 140 . 2 2 8 8 DT H3' H 1 4.515 0.001 . 1 . . . . 19 THY H3' . 6537 1 141 . 2 2 8 8 DT H6 H 1 7.066 0.001 . 1 . . . . 19 THY H6 . 6537 1 142 . 2 2 8 8 DT H71 H 1 1.005 0.001 . 1 . . . . 19 THY H71 . 6537 1 143 . 2 2 8 8 DT H72 H 1 1.005 0.001 . 1 . . . . 19 THY H71 . 6537 1 144 . 2 2 8 8 DT H73 H 1 1.005 0.001 . 1 . . . . 19 THY H71 . 6537 1 145 . 2 2 9 9 DT H1' H 1 5.24 0.001 . 1 . . . . 20 THY H1' . 6537 1 146 . 2 2 9 9 DT H2' H 1 1.766 0.001 . 1 . . . . 20 THY H2' . 6537 1 147 . 2 2 9 9 DT H2'' H 1 2.007 0.002 . 1 . . . . 20 THY H2'' . 6537 1 148 . 2 2 9 9 DT H3 H 1 13.459 0.001 . 1 . . . . 20 THY H3 . 6537 1 149 . 2 2 9 9 DT H3' H 1 4.543 0.001 . 1 . . . . 20 THY H3' . 6537 1 150 . 2 2 9 9 DT H6 H 1 7.119 0.001 . 1 . . . . 20 THY H6 . 6537 1 151 . 2 2 9 9 DT H71 H 1 1.357 0.001 . 1 . . . . 20 THY H71 . 6537 1 152 . 2 2 9 9 DT H72 H 1 1.357 0.001 . 1 . . . . 20 THY H71 . 6537 1 153 . 2 2 9 9 DT H73 H 1 1.357 0.001 . 1 . . . . 20 THY H71 . 6537 1 154 . 2 2 10 10 DA H1' H 1 5.658 0.001 . 1 . . . . 21 ADE H1' . 6537 1 155 . 2 2 10 10 DA H2 H 1 6.958 0.001 . 1 . . . . 21 ADE H2 . 6537 1 156 . 2 2 10 10 DA H2' H 1 2.353 0.001 . 1 . . . . 21 ADE H2' . 6537 1 157 . 2 2 10 10 DA H2'' H 1 2.528 0.001 . 1 . . . . 21 ADE H2'' . 6537 1 158 . 2 2 10 10 DA H3' H 1 4.683 0.001 . 1 . . . . 21 ADE H3' . 6537 1 159 . 2 2 10 10 DA H8 H 1 7.891 0.001 . 1 . . . . 21 ADE H8 . 6537 1 160 . 2 2 11 11 DG H1' H 1 5.604 0.002 . 1 . . . . 22 GUA H1' . 6537 1 161 . 2 2 11 11 DG H2' H 1 2.053 0.001 . 1 . . . . 22 GUA H2' . 6537 1 162 . 2 2 11 11 DG H2'' H 1 1.89 0.002 . 1 . . . . 22 GUA H2'' . 6537 1 163 . 2 2 11 11 DG H3' H 1 4.266 0.001 . 1 . . . . 22 GUA H3' . 6537 1 164 . 2 2 11 11 DG H8 H 1 7.333 0.001 . 1 . . . . 22 GUA H8 . 6537 1 165 . 3 3 1 1 NAZ H35 H 1 12.709 0.001 . 1 . . . . 24 NA1 H35 . 6537 1 166 . 3 3 1 1 NAZ H36 H 1 3.706 0.002 . 1 . . . . 24 NA1 H36 . 6537 1 167 . 3 3 1 1 NAZ H37 H 1 4.113 0.001 . 1 . . . . 24 NA1 H37 . 6537 1 168 . 3 3 1 1 NAZ H38 H 1 3.329 0.001 . 1 . . . . 24 NA1 H38 . 6537 1 169 . 3 3 1 1 NAZ H39 H 1 3.454 0.002 . 1 . . . . 24 NA1 H39 . 6537 1 170 . 3 3 1 1 NAZ H40 H 1 8.793 0.002 . 1 . . . . 24 NA1 H40 . 6537 1 171 . 3 3 1 1 NAZ H41 H 1 3.298 0.003 . 1 . . . . 24 NA1 H41 . 6537 1 172 . 3 3 1 1 NAZ H42 H 1 3.197 0.002 . 1 . . . . 24 NA1 H42 . 6537 1 173 . 3 3 1 1 NAZ H43 H 1 2.589 0.003 . 1 . . . . 24 NA1 H43 . 6537 1 174 . 3 3 1 1 NAZ H44 H 1 2.409 0.002 . 1 . . . . 24 NA1 H44 . 6537 1 175 . 3 3 1 1 NAZ H45 H 1 7.63 0.001 . 1 . . . . 24 NA1 H45 . 6537 1 176 . 3 3 1 1 NAZ H46 H 1 6.493 0.001 . 1 . . . . 24 NA1 H46 . 6537 1 177 . 3 3 1 1 NAZ H47 H 1 5.978 0.001 . 1 . . . . 24 NA1 H47 . 6537 1 178 . 3 3 1 1 NAZ H48 H 1 6.18 0.001 . 1 . . . . 24 NA1 H48 . 6537 1 179 . 3 3 1 1 NAZ H49 H 1 10.664 0.001 . 1 . . . . 24 NA1 H49 . 6537 1 180 . 3 3 1 1 NAZ H50 H 1 1.71 0.001 . 1 . . . . 24 NA1 H50 . 6537 1 181 . 3 3 1 1 NAZ H53 H 1 2.788 0.002 . 1 . . . . 24 NA1 H53 . 6537 1 182 . 3 3 1 1 NAZ H55 H 1 8.466 0.001 . 1 . . . . 24 NA1 H55 . 6537 1 183 . 3 3 1 1 NAZ H56 H 1 5.903 0.001 . 1 . . . . 24 NA1 H56 . 6537 1 184 . 3 3 1 1 NAZ H57 H 1 6.997 0.001 . 1 . . . . 24 NA1 H57 . 6537 1 185 . 3 3 1 1 NAZ H58 H 1 6.377 0.002 . 1 . . . . 24 NA1 H58 . 6537 1 186 . 3 3 1 1 NAZ H59 H 1 6.787 0.001 . 1 . . . . 24 NA1 H59 . 6537 1 187 . 4 3 1 1 NAZ H35 H 1 12.595 0.001 . 1 . . . . 25 NA2 H35 . 6537 1 188 . 4 3 1 1 NAZ H36 H 1 3.669 0.001 . 1 . . . . 25 NA2 H36 . 6537 1 189 . 4 3 1 1 NAZ H37 H 1 4.105 0.001 . 1 . . . . 25 NA2 H37 . 6537 1 190 . 4 3 1 1 NAZ H38 H 1 3.341 0.002 . 1 . . . . 25 NA2 H38 . 6537 1 191 . 4 3 1 1 NAZ H39 H 1 3.397 0.001 . 1 . . . . 25 NA2 H39 . 6537 1 192 . 4 3 1 1 NAZ H40 H 1 8.748 0.001 . 1 . . . . 25 NA2 H40 . 6537 1 193 . 4 3 1 1 NAZ H41 H 1 3.27 0.001 . 1 . . . . 25 NA2 H41 . 6537 1 194 . 4 3 1 1 NAZ H42 H 1 3.168 0.002 . 1 . . . . 25 NA2 H42 . 6537 1 195 . 4 3 1 1 NAZ H43 H 1 2.631 0.002 . 1 . . . . 25 NA2 H43 . 6537 1 196 . 4 3 1 1 NAZ H44 H 1 2.483 0.001 . 1 . . . . 25 NA2 H44 . 6537 1 197 . 4 3 1 1 NAZ H45 H 1 7.766 0.001 . 1 . . . . 25 NA2 H45 . 6537 1 198 . 4 3 1 1 NAZ H46 H 1 6.664 0.002 . 1 . . . . 25 NA2 H46 . 6537 1 199 . 4 3 1 1 NAZ H47 H 1 6.159 0.002 . 1 . . . . 25 NA2 H47 . 6537 1 200 . 4 3 1 1 NAZ H48 H 1 6.465 0.002 . 1 . . . . 25 NA2 H48 . 6537 1 201 . 4 3 1 1 NAZ H49 H 1 10.914 0.001 . 1 . . . . 25 NA2 H49 . 6537 1 202 . 4 3 1 1 NAZ H50 H 1 1.815 0.001 . 1 . . . . 25 NA2 H50 . 6537 1 203 . 4 3 1 1 NAZ H53 H 1 2.767 0.001 . 1 . . . . 25 NA2 H53 . 6537 1 204 . 4 3 1 1 NAZ H55 H 1 8.438 0.001 . 1 . . . . 25 NA2 H55 . 6537 1 205 . 4 3 1 1 NAZ H56 H 1 5.845 0.001 . 1 . . . . 25 NA2 H56 . 6537 1 206 . 4 3 1 1 NAZ H57 H 1 6.899 0.001 . 1 . . . . 25 NA2 H57 . 6537 1 207 . 4 3 1 1 NAZ H58 H 1 6.283 0.001 . 1 . . . . 25 NA2 H58 . 6537 1 208 . 4 3 1 1 NAZ H59 H 1 6.673 0.001 . 1 . . . . 25 NA2 H59 . 6537 1 stop_ save_