################################### # 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 36411 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-1H NOESY 500ms' 1 $sample_1 isotropic 36411 1 2 '2D 1H-1H NOESY 50ms' 1 $sample_1 isotropic 36411 1 3 '2D 1H-1H TOCSY 120ms' 1 $sample_1 isotropic 36411 1 4 '2D DQF-COSY' 1 $sample_1 isotropic 36411 1 5 '2D 1H-13C HSQC' 1 $sample_1 isotropic 36411 1 6 '2D 1H-1H NOESY 50ms' 2 $sample_2 isotropic 36411 1 7 '2D 1H-1H NOESY 250ms' 2 $sample_2 isotropic 36411 1 8 '2D JR-HMBC' 2 $sample_2 isotropic 36411 1 9 '2D 1H-15N HSQC' 2 $sample_2 isotropic 36411 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 1 1 DG H1 H 1 11.4 0.1 . 1 . . . . A 1 DG H1 . 36411 1 2 . 1 . 1 1 1 DG H1' H 1 6.017 0.2 . 1 . . . . A 1 DG H1' . 36411 1 3 . 1 . 1 1 1 DG H2' H 1 2.35 0.2 . 2 . . . . A 1 DG H2' . 36411 1 4 . 1 . 1 1 1 DG H2'' H 1 2.777 0.2 . 2 . . . . A 1 DG H2'' . 36411 1 5 . 1 . 1 1 1 DG H3' H 1 4.864 0.2 . 1 . . . . A 1 DG H3' . 36411 1 6 . 1 . 1 1 1 DG H4' H 1 4.324 0.1 . 1 . . . . A 1 DG H4' . 36411 1 7 . 1 . 1 1 1 DG H5' H 1 3.961 0.1 . 2 . . . . A 1 DG H5' . 36411 1 8 . 1 . 1 1 1 DG H5'' H 1 3.994 0.3 . 2 . . . . A 1 DG H5'' . 36411 1 9 . 1 . 1 1 1 DG H8 H 1 7.894 0.2 . 1 . . . . A 1 DG H8 . 36411 1 10 . 1 . 1 1 1 DG H21 H 1 5.575 0.5 . 2 . . . . A 1 DG H21 . 36411 1 11 . 1 . 1 1 1 DG H22 H 1 9.837 0.3 . 2 . . . . A 1 DG H22 . 36411 1 12 . 1 . 1 1 1 DG C2' C 13 43.28 1.3 . 1 . . . . A 1 DG C2' . 36411 1 13 . 1 . 1 1 1 DG C4' C 13 88.76 0.8 . 1 . . . . A 1 DG C4' . 36411 1 14 . 1 . 1 1 1 DG C5' C 13 64.49 1.1 . 1 . . . . A 1 DG C5' . 36411 1 15 . 1 . 1 1 1 DG C8 C 13 138.84 1.3 . 1 . . . . A 1 DG C8 . 36411 1 16 . 1 . 1 2 2 DG H1 H 1 11.12 0.1 . 1 . . . . A 2 DG H1 . 36411 1 17 . 1 . 1 2 2 DG H1' H 1 6.139 0.2 . 1 . . . . A 2 DG H1' . 36411 1 18 . 1 . 1 2 2 DG H2' H 1 2.648 0.2 . 2 . . . . A 2 DG H2' . 36411 1 19 . 1 . 1 2 2 DG H2'' H 1 2.938 0.2 . 2 . . . . A 2 DG H2'' . 36411 1 20 . 1 . 1 2 2 DG H3' H 1 5.013 0.2 . 1 . . . . A 2 DG H3' . 36411 1 21 . 1 . 1 2 2 DG H4' H 1 4.569 0.1 . 1 . . . . A 2 DG H4' . 36411 1 22 . 1 . 1 2 2 DG H5' H 1 4.272 0.1 . 2 . . . . A 2 DG H5' . 36411 1 23 . 1 . 1 2 2 DG H5'' H 1 4.323 0.3 . 2 . . . . A 2 DG H5'' . 36411 1 24 . 1 . 1 2 2 DG H8 H 1 7.783 0.2 . 1 . . . . A 2 DG H8 . 36411 1 25 . 1 . 1 2 2 DG H21 H 1 6.687 0.5 . 2 . . . . A 2 DG H21 . 36411 1 26 . 1 . 1 2 2 DG H22 H 1 9.142 0.3 . 2 . . . . A 2 DG H22 . 36411 1 27 . 1 . 1 2 2 DG C2' C 13 42.14 1.3 . 1 . . . . A 2 DG C2' . 36411 1 28 . 1 . 1 2 2 DG C4' C 13 87.36 0.8 . 1 . . . . A 2 DG C4' . 36411 1 29 . 1 . 1 2 2 DG C5' C 13 67.81 1.1 . 1 . . . . A 2 DG C5' . 36411 1 30 . 1 . 1 2 2 DG C8 C 13 138.27 1.3 . 1 . . . . A 2 DG C8 . 36411 1 31 . 1 . 1 3 3 DG H1 H 1 10.95 0.1 . 1 . . . . A 3 DG H1 . 36411 1 32 . 1 . 1 3 3 DG H1' H 1 6.364 0.2 . 1 . . . . A 3 DG H1' . 36411 1 33 . 1 . 1 3 3 DG H2' H 1 2.669 0.2 . 2 . . . . A 3 DG H2' . 36411 1 34 . 1 . 1 3 3 DG H2'' H 1 2.472 0.2 . 2 . . . . A 3 DG H2'' . 36411 1 35 . 1 . 1 3 3 DG H3' H 1 5.096 0.2 . 1 . . . . A 3 DG H3' . 36411 1 36 . 1 . 1 3 3 DG H4' H 1 4.602 0.1 . 1 . . . . A 3 DG H4' . 36411 1 37 . 1 . 1 3 3 DG H5' H 1 4.277 0.1 . 2 . . . . A 3 DG H5' . 36411 1 38 . 1 . 1 3 3 DG H5'' H 1 4.325 0.3 . 2 . . . . A 3 DG H5'' . 36411 1 39 . 1 . 1 3 3 DG H8 H 1 7.766 0.2 . 1 . . . . A 3 DG H8 . 36411 1 40 . 1 . 1 3 3 DG C2' C 13 41.05 1.3 . 1 . . . . A 3 DG C2' . 36411 1 41 . 1 . 1 3 3 DG C4' C 13 85.52 0.8 . 1 . . . . A 3 DG C4' . 36411 1 42 . 1 . 1 3 3 DG C5' C 13 68.75 1.1 . 1 . . . . A 3 DG C5' . 36411 1 43 . 1 . 1 3 3 DG C8 C 13 138.11 1.3 . 1 . . . . A 3 DG C8 . 36411 1 44 . 1 . 1 4 4 DT H1' H 1 6.524 0.2 . 1 . . . . A 4 DT H1' . 36411 1 45 . 1 . 1 4 4 DT H2' H 1 2.496 0.2 . 2 . . . . A 4 DT H2' . 36411 1 46 . 1 . 1 4 4 DT H2'' H 1 2.733 0.2 . 2 . . . . A 4 DT H2'' . 36411 1 47 . 1 . 1 4 4 DT H3' H 1 5.093 0.2 . 1 . . . . A 4 DT H3' . 36411 1 48 . 1 . 1 4 4 DT H4' H 1 4.588 0.1 . 1 . . . . A 4 DT H4' . 36411 1 49 . 1 . 1 4 4 DT H5' H 1 4.263 0.1 . 2 . . . . A 4 DT H5' . 36411 1 50 . 1 . 1 4 4 DT H5'' H 1 4.324 0.3 . 2 . . . . A 4 DT H5'' . 36411 1 51 . 1 . 1 4 4 DT H6 H 1 7.8387 0 . 1 . . . . A 4 DT H6 . 36411 1 52 . 1 . 1 4 4 DT C2' C 13 41.46 1.3 . 1 . . . . A 4 DT C2' . 36411 1 53 . 1 . 1 4 4 DT C4' C 13 87.32 0.8 . 1 . . . . A 4 DT C4' . 36411 1 54 . 1 . 1 4 4 DT C5 C 13 14.42 0 . 1 . . . . A 4 DT C5 . 36411 1 55 . 1 . 1 4 4 DT C5' C 13 68.24 1.1 . 1 . . . . A 4 DT C5' . 36411 1 56 . 1 . 1 4 4 DT C6 C 13 139.95 0 . 1 . . . . A 4 DT C6 . 36411 1 57 . 1 . 1 5 5 DG H1 H 1 11.21 0.1 . 1 . . . . A 5 DG H1 . 36411 1 58 . 1 . 1 5 5 DG H1' H 1 6.173 0.2 . 1 . . . . A 5 DG H1' . 36411 1 59 . 1 . 1 5 5 DG H2' H 1 2.155 0.2 . 2 . . . . A 5 DG H2' . 36411 1 60 . 1 . 1 5 5 DG H2'' H 1 2.754 0.2 . 2 . . . . A 5 DG H2'' . 36411 1 61 . 1 . 1 5 5 DG H3' H 1 5.171 0.2 . 1 . . . . A 5 DG H3' . 36411 1 62 . 1 . 1 5 5 DG H4' H 1 4.521 0.1 . 1 . . . . A 5 DG H4' . 36411 1 63 . 1 . 1 5 5 DG H5' H 1 4.324 0.1 . 2 . . . . A 5 DG H5' . 36411 1 64 . 1 . 1 5 5 DG H5'' H 1 4.372 0.3 . 2 . . . . A 5 DG H5'' . 36411 1 65 . 1 . 1 5 5 DG H8 H 1 7.85 0.2 . 1 . . . . A 5 DG H8 . 36411 1 66 . 1 . 1 5 5 DG H21 H 1 5.663 0.5 . 2 . . . . A 5 DG H21 . 36411 1 67 . 1 . 1 5 5 DG H22 H 1 9.934 0.3 . 2 . . . . A 5 DG H22 . 36411 1 68 . 1 . 1 5 5 DG C2' C 13 44.77 1.3 . 1 . . . . A 5 DG C2' . 36411 1 69 . 1 . 1 5 5 DG C4' C 13 87.58 0.8 . 1 . . . . A 5 DG C4' . 36411 1 70 . 1 . 1 5 5 DG C5' C 13 68.53 1.1 . 1 . . . . A 5 DG C5' . 36411 1 71 . 1 . 1 5 5 DG C8 C 13 138.33 1.3 . 1 . . . . A 5 DG C8 . 36411 1 72 . 1 . 1 6 6 DG H1 H 1 11.22 0.1 . 1 . . . . A 6 DG H1 . 36411 1 73 . 1 . 1 6 6 DG H1' H 1 6.08 0.2 . 1 . . . . A 6 DG H1' . 36411 1 74 . 1 . 1 6 6 DG H2' H 1 2.608 0.2 . 2 . . . . A 6 DG H2' . 36411 1 75 . 1 . 1 6 6 DG H2'' H 1 2.775 0.2 . 2 . . . . A 6 DG H2'' . 36411 1 76 . 1 . 1 6 6 DG H3' H 1 5.025 0.2 . 1 . . . . A 6 DG H3' . 36411 1 77 . 1 . 1 6 6 DG H4' H 1 4.496 0.1 . 1 . . . . A 6 DG H4' . 36411 1 78 . 1 . 1 6 6 DG H5' H 1 4.218 0.1 . 2 . . . . A 6 DG H5' . 36411 1 79 . 1 . 1 6 6 DG H5'' H 1 4.27 0.3 . 2 . . . . A 6 DG H5'' . 36411 1 80 . 1 . 1 6 6 DG H8 H 1 7.826 0.2 . 1 . . . . A 6 DG H8 . 36411 1 81 . 1 . 1 6 6 DG H21 H 1 6.301 0.5 . 2 . . . . A 6 DG H21 . 36411 1 82 . 1 . 1 6 6 DG H22 H 1 9.339 0.3 . 2 . . . . A 6 DG H22 . 36411 1 83 . 1 . 1 6 6 DG C2' C 13 42.3 1.3 . 1 . . . . A 6 DG C2' . 36411 1 84 . 1 . 1 6 6 DG C4' C 13 87.11 0.8 . 1 . . . . A 6 DG C4' . 36411 1 85 . 1 . 1 6 6 DG C5' C 13 68.66 1.1 . 1 . . . . A 6 DG C5' . 36411 1 86 . 1 . 1 6 6 DG C8 C 13 138.43 1.3 . 1 . . . . A 6 DG C8 . 36411 1 87 . 1 . 1 7 7 DG H1 H 1 11.14 0.1 . 1 . . . . A 7 DG H1 . 36411 1 88 . 1 . 1 7 7 DG H1' H 1 6.155 0.2 . 1 . . . . A 7 DG H1' . 36411 1 89 . 1 . 1 7 7 DG H2' H 1 2.654 0.2 . 2 . . . . A 7 DG H2' . 36411 1 90 . 1 . 1 7 7 DG H2'' H 1 2.424 0.2 . 2 . . . . A 7 DG H2'' . 36411 1 91 . 1 . 1 7 7 DG H3' H 1 4.941 0.2 . 1 . . . . A 7 DG H3' . 36411 1 92 . 1 . 1 7 7 DG H4' H 1 4.296 0.1 . 1 . . . . A 7 DG H4' . 36411 1 93 . 1 . 1 7 7 DG H5' H 1 4.19 0.1 . 2 . . . . A 7 DG H5' . 36411 1 94 . 1 . 1 7 7 DG H5'' H 1 4.289 0.3 . 2 . . . . A 7 DG H5'' . 36411 1 95 . 1 . 1 7 7 DG H8 H 1 7.758 0.2 . 1 . . . . A 7 DG H8 . 36411 1 96 . 1 . 1 7 7 DG C2' C 13 42.75 1.3 . 1 . . . . A 7 DG C2' . 36411 1 97 . 1 . 1 7 7 DG C4' C 13 87.59 0.8 . 1 . . . . A 7 DG C4' . 36411 1 98 . 1 . 1 7 7 DG C5' C 13 69.11 1.1 . 1 . . . . A 7 DG C5' . 36411 1 99 . 1 . 1 7 7 DG C8 C 13 138.04 1.3 . 1 . . . . A 7 DG C8 . 36411 1 100 . 1 . 1 8 8 DT H1' H 1 6.436 0.2 . 1 . . . . A 8 DT H1' . 36411 1 101 . 1 . 1 8 8 DT H2' H 1 2.374 0.2 . 2 . . . . A 8 DT H2' . 36411 1 102 . 1 . 1 8 8 DT H2'' H 1 2.585 0.2 . 2 . . . . A 8 DT H2'' . 36411 1 103 . 1 . 1 8 8 DT H3' H 1 4.699 0.2 . 1 . . . . A 8 DT H3' . 36411 1 104 . 1 . 1 8 8 DT H4' H 1 4.413 0.1 . 1 . . . . A 8 DT H4' . 36411 1 105 . 1 . 1 8 8 DT H5' H 1 4.038 0.1 . 2 . . . . A 8 DT H5' . 36411 1 106 . 1 . 1 8 8 DT H5'' H 1 4.018 0.3 . 2 . . . . A 8 DT H5'' . 36411 1 107 . 1 . 1 8 8 DT H6 H 1 7.775 0 . 1 . . . . A 8 DT H6 . 36411 1 108 . 1 . 1 8 8 DT C2' C 13 41.22 1.3 . 1 . . . . A 8 DT C2' . 36411 1 109 . 1 . 1 8 8 DT C4' C 13 87.04 0.8 . 1 . . . . A 8 DT C4' . 36411 1 110 . 1 . 1 8 8 DT C5 C 13 14.36 0 . 1 . . . . A 8 DT C5 . 36411 1 111 . 1 . 1 8 8 DT C5' C 13 68.44 1.1 . 1 . . . . A 8 DT C5' . 36411 1 112 . 1 . 1 8 8 DT C6 C 13 139.98 0 . 1 . . . . A 8 DT C6 . 36411 1 113 . 1 . 1 9 9 DT H1' H 1 6.548 0.2 . 1 . . . . A 9 DT H1' . 36411 1 114 . 1 . 1 9 9 DT H2' H 1 2.641 0.2 . 2 . . . . A 9 DT H2' . 36411 1 115 . 1 . 1 9 9 DT H2'' H 1 2.705 0.2 . 2 . . . . A 9 DT H2'' . 36411 1 116 . 1 . 1 9 9 DT H3' H 1 5.01 0.2 . 1 . . . . A 9 DT H3' . 36411 1 117 . 1 . 1 9 9 DT H4' H 1 4.471 0.1 . 1 . . . . A 9 DT H4' . 36411 1 118 . 1 . 1 9 9 DT H5' H 1 4.166 0.1 . 2 . . . . A 9 DT H5' . 36411 1 119 . 1 . 1 9 9 DT H5'' H 1 4.2 0.3 . 2 . . . . A 9 DT H5'' . 36411 1 120 . 1 . 1 9 9 DT H6 H 1 7.826 0 . 1 . . . . A 9 DT H6 . 36411 1 121 . 1 . 1 9 9 DT C2' C 13 39.66 1.3 . 1 . . . . A 9 DT C2' . 36411 1 122 . 1 . 1 9 9 DT C4' C 13 86.94 0.8 . 1 . . . . A 9 DT C4' . 36411 1 123 . 1 . 1 9 9 DT C5 C 13 14.36 0 . 1 . . . . A 9 DT C5 . 36411 1 124 . 1 . 1 9 9 DT C5' C 13 68.77 1.1 . 1 . . . . A 9 DT C5' . 36411 1 125 . 1 . 1 9 9 DT C6 C 13 140.7 0 . 1 . . . . A 9 DT C6 . 36411 1 126 . 1 . 1 10 10 DG H1 H 1 11.33 0.1 . 1 . . . . A 10 DG H1 . 36411 1 127 . 1 . 1 10 10 DG H1' H 1 6.139 0.2 . 1 . . . . A 10 DG H1' . 36411 1 128 . 1 . 1 10 10 DG H2' H 1 2.221 0.2 . 2 . . . . A 10 DG H2' . 36411 1 129 . 1 . 1 10 10 DG H2'' H 1 2.763 0.2 . 2 . . . . A 10 DG H2'' . 36411 1 130 . 1 . 1 10 10 DG H3' H 1 5.04 0.2 . 1 . . . . A 10 DG H3' . 36411 1 131 . 1 . 1 10 10 DG H4' H 1 4.472 0.1 . 1 . . . . A 10 DG H4' . 36411 1 132 . 1 . 1 10 10 DG H5' H 1 4.13 0.1 . 2 . . . . A 10 DG H5' . 36411 1 133 . 1 . 1 10 10 DG H5'' H 1 4.352 0.3 . 2 . . . . A 10 DG H5'' . 36411 1 134 . 1 . 1 10 10 DG H8 H 1 7.892 0.2 . 1 . . . . A 10 DG H8 . 36411 1 135 . 1 . 1 10 10 DG H21 H 1 5.504 0.5 . 2 . . . . A 10 DG H21 . 36411 1 136 . 1 . 1 10 10 DG H22 H 1 9.804 0.3 . 2 . . . . A 10 DG H22 . 36411 1 137 . 1 . 1 10 10 DG C2' C 13 43.21 1.3 . 1 . . . . A 10 DG C2' . 36411 1 138 . 1 . 1 10 10 DG C4' C 13 86.93 0.8 . 1 . . . . A 10 DG C4' . 36411 1 139 . 1 . 1 10 10 DG C5' C 13 67.62 1.1 . 1 . . . . A 10 DG C5' . 36411 1 140 . 1 . 1 10 10 DG C8 C 13 138.43 1.3 . 1 . . . . A 10 DG C8 . 36411 1 141 . 1 . 1 11 11 DG H1 H 1 11.12 0.1 . 1 . . . . A 11 DG H1 . 36411 1 142 . 1 . 1 11 11 DG H1' H 1 6.136 0.2 . 1 . . . . A 11 DG H1' . 36411 1 143 . 1 . 1 11 11 DG H2' H 1 2.623 0.2 . 2 . . . . A 11 DG H2' . 36411 1 144 . 1 . 1 11 11 DG H2'' H 1 2.944 0.2 . 2 . . . . A 11 DG H2'' . 36411 1 145 . 1 . 1 11 11 DG H3' H 1 5.025 0.2 . 1 . . . . A 11 DG H3' . 36411 1 146 . 1 . 1 11 11 DG H4' H 1 4.549 0.1 . 1 . . . . A 11 DG H4' . 36411 1 147 . 1 . 1 11 11 DG H5' H 1 4.218 0.1 . 2 . . . . A 11 DG H5' . 36411 1 148 . 1 . 1 11 11 DG H5'' H 1 4.283 0.3 . 2 . . . . A 11 DG H5'' . 36411 1 149 . 1 . 1 11 11 DG H8 H 1 7.672 0.2 . 1 . . . . A 11 DG H8 . 36411 1 150 . 1 . 1 11 11 DG H21 H 1 6.625 0.5 . 2 . . . . A 11 DG H21 . 36411 1 151 . 1 . 1 11 11 DG H22 H 1 9.181 0.3 . 2 . . . . A 11 DG H22 . 36411 1 152 . 1 . 1 11 11 DG C2' C 13 42.35 1.3 . 1 . . . . A 11 DG C2' . 36411 1 153 . 1 . 1 11 11 DG C4' C 13 87.35 0.8 . 1 . . . . A 11 DG C4' . 36411 1 154 . 1 . 1 11 11 DG C5' C 13 68.66 1.1 . 1 . . . . A 11 DG C5' . 36411 1 155 . 1 . 1 11 11 DG C8 C 13 138.04 1.3 . 1 . . . . A 11 DG C8 . 36411 1 156 . 1 . 1 12 12 DG H1 H 1 11.04 0.1 . 1 . . . . A 12 DG H1 . 36411 1 157 . 1 . 1 12 12 DG H1' H 1 6.346 0.2 . 1 . . . . A 12 DG H1' . 36411 1 158 . 1 . 1 12 12 DG H2' H 1 2.688 0.2 . 2 . . . . A 12 DG H2' . 36411 1 159 . 1 . 1 12 12 DG H2'' H 1 2.458 0.2 . 2 . . . . A 12 DG H2'' . 36411 1 160 . 1 . 1 12 12 DG H3' H 1 5.098 0.2 . 1 . . . . A 12 DG H3' . 36411 1 161 . 1 . 1 12 12 DG H4' H 1 4.608 0.1 . 1 . . . . A 12 DG H4' . 36411 1 162 . 1 . 1 12 12 DG H5' H 1 4.28 0.1 . 2 . . . . A 12 DG H5' . 36411 1 163 . 1 . 1 12 12 DG H5'' H 1 4.325 0.3 . 2 . . . . A 12 DG H5'' . 36411 1 164 . 1 . 1 12 12 DG H8 H 1 7.775 0.2 . 1 . . . . A 12 DG H8 . 36411 1 165 . 1 . 1 12 12 DG C2' C 13 41.07 1.3 . 1 . . . . A 12 DG C2' . 36411 1 166 . 1 . 1 12 12 DG C4' C 13 85.55 0.8 . 1 . . . . A 12 DG C4' . 36411 1 167 . 1 . 1 12 12 DG C5' C 13 68.63 1.1 . 1 . . . . A 12 DG C5' . 36411 1 168 . 1 . 1 12 12 DG C8 C 13 138.18 1.3 . 1 . . . . A 12 DG C8 . 36411 1 169 . 1 . 1 13 13 DA H1' H 1 6.669 0.2 . 1 . . . . A 13 DA H1' . 36411 1 170 . 1 . 1 13 13 DA H2' H 1 2.961 0.2 . 2 . . . . A 13 DA H2' . 36411 1 171 . 1 . 1 13 13 DA H3' H 1 5.206 0.2 . 1 . . . . A 13 DA H3' . 36411 1 172 . 1 . 1 13 13 DA H4' H 1 4.645 0.1 . 1 . . . . A 13 DA H4' . 36411 1 173 . 1 . 1 13 13 DA H5' H 1 4.283 0.1 . 2 . . . . A 13 DA H5' . 36411 1 174 . 1 . 1 13 13 DA H5'' H 1 4.613 0.3 . 2 . . . . A 13 DA H5'' . 36411 1 175 . 1 . 1 13 13 DA C2' C 13 42.05 1.3 . 1 . . . . A 13 DA C2' . 36411 1 176 . 1 . 1 13 13 DA C4' C 13 87.39 0.8 . 1 . . . . A 13 DA C4' . 36411 1 177 . 1 . 1 13 13 DA C5' C 13 67.2 1.1 . 1 . . . . A 13 DA C5' . 36411 1 178 . 1 . 1 13 13 DA C8 C 13 142.7 1.3 . 1 . . . . A 13 DA C8 . 36411 1 179 . 1 . 1 14 14 DG H1 H 1 11.09 0.1 . 1 . . . . A 14 DG H1 . 36411 1 180 . 1 . 1 14 14 DG H1' H 1 6.236 0.2 . 1 . . . . A 14 DG H1' . 36411 1 181 . 1 . 1 14 14 DG H2' H 1 2.214 0.2 . 2 . . . . A 14 DG H2' . 36411 1 182 . 1 . 1 14 14 DG H2'' H 1 2.767 0.2 . 2 . . . . A 14 DG H2'' . 36411 1 183 . 1 . 1 14 14 DG H3' H 1 5.232 0.2 . 1 . . . . A 14 DG H3' . 36411 1 184 . 1 . 1 14 14 DG H4' H 1 4.559 0.1 . 1 . . . . A 14 DG H4' . 36411 1 185 . 1 . 1 14 14 DG H5' H 1 4.339 0.1 . 2 . . . . A 14 DG H5' . 36411 1 186 . 1 . 1 14 14 DG H5'' H 1 4.412 0.3 . 2 . . . . A 14 DG H5'' . 36411 1 187 . 1 . 1 14 14 DG H8 H 1 7.876 0.2 . 1 . . . . A 14 DG H8 . 36411 1 188 . 1 . 1 14 14 DG H21 H 1 5.648 0.5 . 2 . . . . A 14 DG H21 . 36411 1 189 . 1 . 1 14 14 DG H22 H 1 9.778 0.3 . 2 . . . . A 14 DG H22 . 36411 1 190 . 1 . 1 14 14 DG C2' C 13 44.71 1.3 . 1 . . . . A 14 DG C2' . 36411 1 191 . 1 . 1 14 14 DG C4' C 13 87.53 0.8 . 1 . . . . A 14 DG C4' . 36411 1 192 . 1 . 1 14 14 DG C5' C 13 68.66 1.1 . 1 . . . . A 14 DG C5' . 36411 1 193 . 1 . 1 14 14 DG C8 C 13 138.4 1.3 . 1 . . . . A 14 DG C8 . 36411 1 194 . 1 . 1 15 15 DG H1 H 1 11.14 0.1 . 1 . . . . A 15 DG H1 . 36411 1 195 . 1 . 1 15 15 DG H1' H 1 6.054 0.2 . 1 . . . . A 15 DG H1' . 36411 1 196 . 1 . 1 15 15 DG H2' H 1 2.657 0.2 . 2 . . . . A 15 DG H2' . 36411 1 197 . 1 . 1 15 15 DG H2'' H 1 2.882 0.2 . 2 . . . . A 15 DG H2'' . 36411 1 198 . 1 . 1 15 15 DG H3' H 1 5.059 0.2 . 1 . . . . A 15 DG H3' . 36411 1 199 . 1 . 1 15 15 DG H4' H 1 4.549 0.1 . 1 . . . . A 15 DG H4' . 36411 1 200 . 1 . 1 15 15 DG H5' H 1 4.209 0.1 . 2 . . . . A 15 DG H5' . 36411 1 201 . 1 . 1 15 15 DG H5'' H 1 4.332 0.3 . 2 . . . . A 15 DG H5'' . 36411 1 202 . 1 . 1 15 15 DG H8 H 1 7.822 0.2 . 1 . . . . A 15 DG H8 . 36411 1 203 . 1 . 1 15 15 DG H21 H 1 6.051 0.5 . 2 . . . . A 15 DG H21 . 36411 1 204 . 1 . 1 15 15 DG H22 H 1 9.348 0.3 . 2 . . . . A 15 DG H22 . 36411 1 205 . 1 . 1 15 15 DG C2' C 13 41.91 1.3 . 1 . . . . A 15 DG C2' . 36411 1 206 . 1 . 1 15 15 DG C4' C 13 87.34 0.8 . 1 . . . . A 15 DG C4' . 36411 1 207 . 1 . 1 15 15 DG C5' C 13 68.72 1.1 . 1 . . . . A 15 DG C5' . 36411 1 208 . 1 . 1 15 15 DG C8 C 13 138.32 1.3 . 1 . . . . A 15 DG C8 . 36411 1 209 . 1 . 1 16 16 DG H1 H 1 11.12 0.1 . 1 . . . . A 16 DG H1 . 36411 1 210 . 1 . 1 16 16 DG H1' H 1 6.268 0.2 . 1 . . . . A 16 DG H1' . 36411 1 211 . 1 . 1 16 16 DG H2' H 1 2.525 0.2 . 2 . . . . A 16 DG H2' . 36411 1 212 . 1 . 1 16 16 DG H2'' H 1 2.324 0.2 . 2 . . . . A 16 DG H2'' . 36411 1 213 . 1 . 1 16 16 DG H3' H 1 4.673 0.2 . 1 . . . . A 16 DG H3' . 36411 1 214 . 1 . 1 16 16 DG H4' H 1 4.325 0.1 . 1 . . . . A 16 DG H4' . 36411 1 215 . 1 . 1 16 16 DG H5' H 1 4.244 0.1 . 2 . . . . A 16 DG H5' . 36411 1 216 . 1 . 1 16 16 DG H8 H 1 7.687 0.2 . 1 . . . . A 16 DG H8 . 36411 1 217 . 1 . 1 16 16 DG C2' C 13 42.72 1.3 . 1 . . . . A 16 DG C2' . 36411 1 218 . 1 . 1 16 16 DG C4' C 13 88.33 0.8 . 1 . . . . A 16 DG C4' . 36411 1 219 . 1 . 1 16 16 DG C5' C 13 68.68 1.1 . 1 . . . . A 16 DG C5' . 36411 1 220 . 1 . 1 16 16 DG C8 C 13 138.05 1.3 . 1 . . . . A 16 DG C8 . 36411 1 stop_ save_