################################### # 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 34542 _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' . . . 34542 1 2 '2D 1H-1H TOCSY' . . . 34542 1 3 '2D 1H-13C HSQC aromatic' . . . 34542 1 4 '2D DQF-COSY' . . . 34542 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 DC H1' H 1 5.77 0.0036 . 1 . . . . A 1 DC H1' . 34542 1 2 . 1 . 1 1 1 DC H2' H 1 1.65 0.0047 . 1 . . . . A 1 DC H2' . 34542 1 3 . 1 . 1 1 1 DC H2'' H 1 2.46 0.0001 . 1 . . . . A 1 DC H2'' . 34542 1 4 . 1 . 1 1 1 DC H3' H 1 4.61 0.0010 . 1 . . . . A 1 DC H3' . 34542 1 5 . 1 . 1 1 1 DC H5 H 1 5.68 0.0036 . 1 . . . . A 1 DC H5 . 34542 1 6 . 1 . 1 1 1 DC H6 H 1 7.73 0.0060 . 1 . . . . A 1 DC H6 . 34542 1 7 . 1 . 1 1 1 DC C6 C 13 143.57 0.0000 . 1 . . . . A 1 DC C6 . 34542 1 8 . 1 . 1 2 2 DG H1 H 1 11.81 0.0006 . 1 . . . . A 2 DG H1 . 34542 1 9 . 1 . 1 2 2 DG H1' H 1 5.95 0.0007 . 1 . . . . A 2 DG H1' . 34542 1 10 . 1 . 1 2 2 DG H2' H 1 3.50 0.0009 . 1 . . . . A 2 DG H2' . 34542 1 11 . 1 . 1 2 2 DG H2'' H 1 2.76 0.0013 . 3 . . . . A 2 DG H2'' . 34542 1 12 . 1 . 1 2 2 DG H3' H 1 4.82 0.0006 . 1 . . . . A 2 DG H3' . 34542 1 13 . 1 . 1 2 2 DG H8 H 1 7.29 0.0009 . 1 . . . . A 2 DG H8 . 34542 1 14 . 1 . 1 2 2 DG C8 C 13 142.11 0.0000 . 1 . . . . A 2 DG C8 . 34542 1 15 . 1 . 1 3 3 DG H1 H 1 11.75 0.0006 . 1 . . . . A 3 DG H1 . 34542 1 16 . 1 . 1 3 3 DG H1' H 1 5.89 0.0010 . 1 . . . . A 3 DG H1' . 34542 1 17 . 1 . 1 3 3 DG H2' H 1 2.61 0.0017 . 1 . . . . A 3 DG H2' . 34542 1 18 . 1 . 1 3 3 DG H2'' H 1 2.80 0.0029 . 1 . . . . A 3 DG H2'' . 34542 1 19 . 1 . 1 3 3 DG H3' H 1 5.03 0.0016 . 1 . . . . A 3 DG H3' . 34542 1 20 . 1 . 1 3 3 DG H8 H 1 8.04 0.0006 . 1 . . . . A 3 DG H8 . 34542 1 21 . 1 . 1 3 3 DG C8 C 13 138.97 0.0000 . 1 . . . . A 3 DG C8 . 34542 1 22 . 1 . 1 4 4 DG H1 H 1 10.57 0.0031 . 1 . . . . A 4 DG H1 . 34542 1 23 . 1 . 1 4 4 DG H1' H 1 5.92 0.0021 . 1 . . . . A 4 DG H1' . 34542 1 24 . 1 . 1 4 4 DG H2' H 1 3.20 0.0004 . 1 . . . . A 4 DG H2' . 34542 1 25 . 1 . 1 4 4 DG H2'' H 1 2.20 0.0019 . 1 . . . . A 4 DG H2'' . 34542 1 26 . 1 . 1 4 4 DG H3' H 1 5.01 0.0004 . 1 . . . . A 4 DG H3' . 34542 1 27 . 1 . 1 4 4 DG H8 H 1 7.52 0.0018 . 1 . . . . A 4 DG H8 . 34542 1 28 . 1 . 1 4 4 DG C8 C 13 142.78 0.0000 . 1 . . . . A 4 DG C8 . 34542 1 29 . 1 . 1 5 5 DC H1' H 1 6.43 0.0027 . 1 . . . . A 5 DC H1' . 34542 1 30 . 1 . 1 5 5 DC H2' H 1 2.32 0.0024 . 1 . . . . A 5 DC H2' . 34542 1 31 . 1 . 1 5 5 DC H2'' H 1 2.64 0.0022 . 1 . . . . A 5 DC H2'' . 34542 1 32 . 1 . 1 5 5 DC H3' H 1 4.83 0.0005 . 1 . . . . A 5 DC H3' . 34542 1 33 . 1 . 1 5 5 DC H5 H 1 6.13 0.0066 . 1 . . . . A 5 DC H5 . 34542 1 34 . 1 . 1 5 5 DC H6 H 1 7.99 0.0047 . 1 . . . . A 5 DC H6 . 34542 1 35 . 1 . 1 5 5 DC C6 C 13 144.33 0.0000 . 1 . . . . A 5 DC C6 . 34542 1 36 . 1 . 1 6 6 DG H1 H 1 11.52 0.0008 . 1 . . . . A 6 DG H1 . 34542 1 37 . 1 . 1 6 6 DG H1' H 1 5.34 0.0029 . 1 . . . . A 6 DG H1' . 34542 1 38 . 1 . 1 6 6 DG H2' H 1 2.06 0.0004 . 1 . . . . A 6 DG H2' . 34542 1 39 . 1 . 1 6 6 DG H2'' H 1 2.22 0.0006 . 1 . . . . A 6 DG H2'' . 34542 1 40 . 1 . 1 6 6 DG H3' H 1 4.64 0.0005 . 1 . . . . A 6 DG H3' . 34542 1 41 . 1 . 1 6 6 DG H8 H 1 7.70 0.0021 . 1 . . . . A 6 DG H8 . 34542 1 42 . 1 . 1 6 6 DG H21 H 1 5.70 0.0018 . 1 . . . . A 6 DG H21 . 34542 1 43 . 1 . 1 6 6 DG H22 H 1 5.80 0.0017 . 1 . . . . A 6 DG H22 . 34542 1 44 . 1 . 1 6 6 DG C8 C 13 138.62 0.0000 . 1 . . . . A 6 DG C8 . 34542 1 45 . 1 . 1 7 7 DC H1' H 1 5.80 0.0050 . 1 . . . . A 7 DC H1' . 34542 1 46 . 1 . 1 7 7 DC H2' H 1 2.10 0.0021 . 1 . . . . A 7 DC H2' . 34542 1 47 . 1 . 1 7 7 DC H2'' H 1 2.17 0.0019 . 1 . . . . A 7 DC H2'' . 34542 1 48 . 1 . 1 7 7 DC H3' H 1 4.63 0.0010 . 1 . . . . A 7 DC H3' . 34542 1 49 . 1 . 1 7 7 DC H5 H 1 5.23 0.0009 . 1 . . . . A 7 DC H5 . 34542 1 50 . 1 . 1 7 7 DC H6 H 1 7.48 0.0025 . 1 . . . . A 7 DC H6 . 34542 1 51 . 1 . 1 7 7 DC H41 H 1 6.18 0.0009 . 1 . . . . A 7 DC H41 . 34542 1 52 . 1 . 1 7 7 DC H42 H 1 7.87 0.0023 . 1 . . . . A 7 DC H42 . 34542 1 53 . 1 . 1 7 7 DC C6 C 13 144.57 0.0000 . 1 . . . . A 7 DC C6 . 34542 1 54 . 1 . 1 8 8 DG H1 H 1 11.49 0.0012 . 1 . . . . A 8 DG H1 . 34542 1 55 . 1 . 1 8 8 DG H1' H 1 6.44 0.0012 . 1 . . . . A 8 DG H1' . 34542 1 56 . 1 . 1 8 8 DG H2' H 1 2.75 0.0012 . 1 . . . . A 8 DG H2' . 34542 1 57 . 1 . 1 8 8 DG H2'' H 1 3.27 0.0007 . 1 . . . . A 8 DG H2'' . 34542 1 58 . 1 . 1 8 8 DG H3' H 1 4.96 0.0003 . 1 . . . . A 8 DG H3' . 34542 1 59 . 1 . 1 8 8 DG H8 H 1 8.13 0.0008 . 1 . . . . A 8 DG H8 . 34542 1 60 . 1 . 1 8 8 DG C8 C 13 137.84 0.0000 . 1 . . . . A 8 DG C8 . 34542 1 61 . 1 . 1 9 9 DG H1 H 1 10.88 0.0005 . 1 . . . . A 9 DG H1 . 34542 1 62 . 1 . 1 9 9 DG H1' H 1 5.90 0.0021 . 1 . . . . A 9 DG H1' . 34542 1 63 . 1 . 1 9 9 DG H2' H 1 3.10 0.0002 . 1 . . . . A 9 DG H2' . 34542 1 64 . 1 . 1 9 9 DG H2'' H 1 2.65 0.0008 . 1 . . . . A 9 DG H2'' . 34542 1 65 . 1 . 1 9 9 DG H3' H 1 4.95 0.0013 . 1 . . . . A 9 DG H3' . 34542 1 66 . 1 . 1 9 9 DG H8 H 1 7.21 0.0005 . 1 . . . . A 9 DG H8 . 34542 1 67 . 1 . 1 9 9 DG C8 C 13 141.26 0.0000 . 1 . . . . A 9 DG C8 . 34542 1 68 . 1 . 1 10 10 DG H1 H 1 11.90 0.0008 . 1 . . . . A 10 DG H1 . 34542 1 69 . 1 . 1 10 10 DG H1' H 1 5.69 0.0018 . 1 . . . . A 10 DG H1' . 34542 1 70 . 1 . 1 10 10 DG H2' H 1 1.76 0.0015 . 1 . . . . A 10 DG H2' . 34542 1 71 . 1 . 1 10 10 DG H2'' H 1 2.09 0.0028 . 1 . . . . A 10 DG H2'' . 34542 1 72 . 1 . 1 10 10 DG H3' H 1 4.88 0.0008 . 1 . . . . A 10 DG H3' . 34542 1 73 . 1 . 1 10 10 DG H8 H 1 7.25 0.0007 . 1 . . . . A 10 DG H8 . 34542 1 74 . 1 . 1 10 10 DG C8 C 13 136.73 0.0000 . 1 . . . . A 10 DG C8 . 34542 1 75 . 1 . 1 11 11 DA H1' H 1 5.67 0.0013 . 1 . . . . A 11 DA H1' . 34542 1 76 . 1 . 1 11 11 DA H2 H 1 8.44 0.0008 . 1 . . . . A 11 DA H2 . 34542 1 77 . 1 . 1 11 11 DA H2' H 1 2.32 0.0009 . 1 . . . . A 11 DA H2' . 34542 1 78 . 1 . 1 11 11 DA H2'' H 1 2.42 0.0005 . 1 . . . . A 11 DA H2'' . 34542 1 79 . 1 . 1 11 11 DA H3' H 1 4.81 0.0012 . 1 . . . . A 11 DA H3' . 34542 1 80 . 1 . 1 11 11 DA H8 H 1 7.89 0.0031 . 1 . . . . A 11 DA H8 . 34542 1 81 . 1 . 1 11 11 DA C2 C 13 156.79 0.0000 . 1 . . . . A 11 DA C2 . 34542 1 82 . 1 . 1 11 11 DA C8 C 13 140.56 0.0000 . 1 . . . . A 11 DA C8 . 34542 1 83 . 1 . 1 12 12 DG H1' H 1 5.19 0.0013 . 1 . . . . A 12 DG H1' . 34542 1 84 . 1 . 1 12 12 DG H2' H 1 1.99 0.0015 . 1 . . . . A 12 DG H2' . 34542 1 85 . 1 . 1 12 12 DG H2'' H 1 1.76 0.0005 . 1 . . . . A 12 DG H2'' . 34542 1 86 . 1 . 1 12 12 DG H3' H 1 4.55 0.0015 . 1 . . . . A 12 DG H3' . 34542 1 87 . 1 . 1 12 12 DG H8 H 1 7.54 0.0002 . 1 . . . . A 12 DG H8 . 34542 1 88 . 1 . 1 12 12 DG C8 C 13 137.69 0.0000 . 1 . . . . A 12 DG C8 . 34542 1 89 . 1 . 1 13 13 DG H1' H 1 5.52 0.0010 . 1 . . . . A 13 DG H1' . 34542 1 90 . 1 . 1 13 13 DG H2' H 1 2.31 0.0005 . 1 . . . . A 13 DG H2' . 34542 1 91 . 1 . 1 13 13 DG H2'' H 1 2.05 0.0001 . 1 . . . . A 13 DG H2'' . 34542 1 92 . 1 . 1 13 13 DG H8 H 1 7.63 0.0003 . 1 . . . . A 13 DG H8 . 34542 1 93 . 1 . 1 13 13 DG C8 C 13 138.89 0.0000 . 1 . . . . A 13 DG C8 . 34542 1 94 . 1 . 1 14 14 DA H1' H 1 5.95 0.0007 . 1 . . . . A 14 DA H1' . 34542 1 95 . 1 . 1 14 14 DA H2 H 1 7.46 0.0003 . 1 . . . . A 14 DA H2 . 34542 1 96 . 1 . 1 14 14 DA H2' H 1 2.51 0.0016 . 1 . . . . A 14 DA H2' . 34542 1 97 . 1 . 1 14 14 DA H2'' H 1 2.76 0.0013 . 3 . . . . A 14 DA H2'' . 34542 1 98 . 1 . 1 14 14 DA H3' H 1 4.75 0.0005 . 1 . . . . A 14 DA H3' . 34542 1 99 . 1 . 1 14 14 DA H8 H 1 7.97 0.0030 . 1 . . . . A 14 DA H8 . 34542 1 100 . 1 . 1 14 14 DA C2 C 13 155.48 0.0000 . 1 . . . . A 14 DA C2 . 34542 1 101 . 1 . 1 14 14 DA C8 C 13 140.55 0.0000 . 1 . . . . A 14 DA C8 . 34542 1 102 . 1 . 1 15 15 DA H1' H 1 5.95 0.0009 . 1 . . . . A 15 DA H1' . 34542 1 103 . 1 . 1 15 15 DA H2 H 1 7.82 0.0016 . 1 . . . . A 15 DA H2 . 34542 1 104 . 1 . 1 15 15 DA H2' H 1 2.67 0.0009 . 1 . . . . A 15 DA H2' . 34542 1 105 . 1 . 1 15 15 DA H2'' H 1 2.76 0.0038 . 3 . . . . A 15 DA H2'' . 34542 1 106 . 1 . 1 15 15 DA H3' H 1 5.02 0.0001 . 1 . . . . A 15 DA H3' . 34542 1 107 . 1 . 1 15 15 DA H8 H 1 8.25 0.0007 . 1 . . . . A 15 DA H8 . 34542 1 108 . 1 . 1 15 15 DA C2 C 13 155.62 0.0000 . 1 . . . . A 15 DA C2 . 34542 1 109 . 1 . 1 15 15 DA C8 C 13 140.05 0.0000 . 1 . . . . A 15 DA C8 . 34542 1 110 . 1 . 1 16 16 DG H1 H 1 11.26 0.0006 . 1 . . . . A 16 DG H1 . 34542 1 111 . 1 . 1 16 16 DG H1' H 1 6.07 0.0012 . 1 . . . . A 16 DG H1' . 34542 1 112 . 1 . 1 16 16 DG H2' H 1 3.55 0.0005 . 1 . . . . A 16 DG H2' . 34542 1 113 . 1 . 1 16 16 DG H2'' H 1 3.01 0.0034 . 1 . . . . A 16 DG H2'' . 34542 1 114 . 1 . 1 16 16 DG H3' H 1 5.04 0.0016 . 1 . . . . A 16 DG H3' . 34542 1 115 . 1 . 1 16 16 DG H8 H 1 7.30 0.0023 . 1 . . . . A 16 DG H8 . 34542 1 116 . 1 . 1 16 16 DG C8 C 13 142.11 0.0000 . 1 . . . . A 16 DG C8 . 34542 1 117 . 1 . 1 17 17 DG H1 H 1 11.46 0.0007 . 2 . . . . A 17 DG H1 . 34542 1 118 . 1 . 1 17 17 DG H1' H 1 6.19 0.0020 . 1 . . . . A 17 DG H1' . 34542 1 119 . 1 . 1 17 17 DG H2' H 1 2.41 0.0009 . 1 . . . . A 17 DG H2' . 34542 1 120 . 1 . 1 17 17 DG H2'' H 1 2.72 0.0003 . 1 . . . . A 17 DG H2'' . 34542 1 121 . 1 . 1 17 17 DG H3' H 1 5.02 0.0005 . 1 . . . . A 17 DG H3' . 34542 1 122 . 1 . 1 17 17 DG H8 H 1 7.78 0.0016 . 1 . . . . A 17 DG H8 . 34542 1 123 . 1 . 1 17 17 DG C8 C 13 137.43 0.0000 . 1 . . . . A 17 DG C8 . 34542 1 124 . 1 . 1 18 18 DG H1 H 1 11.58 0.0009 . 1 . . . . A 18 DG H1 . 34542 1 125 . 1 . 1 18 18 DG H1' H 1 6.06 0.0027 . 1 . . . . A 18 DG H1' . 34542 1 126 . 1 . 1 18 18 DG H2' H 1 3.00 0.0042 . 1 . . . . A 18 DG H2' . 34542 1 127 . 1 . 1 18 18 DG H2'' H 1 2.36 0.0027 . 1 . . . . A 18 DG H2'' . 34542 1 128 . 1 . 1 18 18 DG H8 H 1 7.49 0.0026 . 1 . . . . A 18 DG H8 . 34542 1 129 . 1 . 1 18 18 DG C8 C 13 140.34 0.0000 . 1 . . . . A 18 DG C8 . 34542 1 130 . 1 . 1 19 19 8OG H1 H 1 12.94 0.0008 . 1 . . . . A 19 8OG H1 . 34542 1 131 . 1 . 1 19 19 8OG H1' H 1 6.16 0.0035 . 1 . . . . A 19 8OG H1' . 34542 1 132 . 1 . 1 19 19 8OG H2' H 1 2.98 0.0011 . 1 . . . . A 19 8OG H2' . 34542 1 133 . 1 . 1 19 19 8OG H2'' H 1 2.68 0.0016 . 1 . . . . A 19 8OG H2'' . 34542 1 134 . 1 . 1 19 19 8OG H3' H 1 5.04 0.0004 . 1 . . . . A 19 8OG H3' . 34542 1 135 . 1 . 1 19 19 8OG H7 H 1 11.12 0.0005 . 1 . . . . A 19 8OG H7 . 34542 1 136 . 1 . 1 19 19 8OG H21 H 1 6.81 0.0018 . 1 . . . . A 19 8OG H21 . 34542 1 137 . 1 . 1 20 20 DG H1 H 1 13.07 0.0029 . 1 . . . . A 20 DG H1 . 34542 1 138 . 1 . 1 20 20 DG H1' H 1 5.99 0.0008 . 1 . . . . A 20 DG H1' . 34542 1 139 . 1 . 1 20 20 DG H2' H 1 2.09 0.0004 . 1 . . . . A 20 DG H2' . 34542 1 140 . 1 . 1 20 20 DG H2'' H 1 2.80 0.0011 . 1 . . . . A 20 DG H2'' . 34542 1 141 . 1 . 1 20 20 DG H3' H 1 4.93 0.0009 . 1 . . . . A 20 DG H3' . 34542 1 142 . 1 . 1 20 20 DG H8 H 1 7.94 0.0001 . 1 . . . . A 20 DG H8 . 34542 1 143 . 1 . 1 20 20 DG C8 C 13 138.25 0.0000 . 1 . . . . A 20 DG C8 . 34542 1 144 . 1 . 1 21 21 DC H1' H 1 5.52 0.0027 . 1 . . . . A 21 DC H1' . 34542 1 145 . 1 . 1 21 21 DC H2' H 1 3.15 0.0009 . 1 . . . . A 21 DC H2' . 34542 1 146 . 1 . 1 21 21 DC H2'' H 1 2.89 0.0011 . 1 . . . . A 21 DC H2'' . 34542 1 147 . 1 . 1 21 21 DC H3' H 1 4.38 0.0052 . 1 . . . . A 21 DC H3' . 34542 1 148 . 1 . 1 21 21 DC H5 H 1 5.06 0.0019 . 1 . . . . A 21 DC H5 . 34542 1 149 . 1 . 1 21 21 DC H6 H 1 7.08 0.0017 . 1 . . . . A 21 DC H6 . 34542 1 150 . 1 . 1 21 21 DC H41 H 1 8.24 0.0012 . 1 . . . . A 21 DC H41 . 34542 1 151 . 1 . 1 21 21 DC H42 H 1 7.03 0.0011 . 1 . . . . A 21 DC H42 . 34542 1 152 . 1 . 1 21 21 DC C6 C 13 148.81 0.0000 . 1 . . . . A 21 DC C6 . 34542 1 153 . 1 . 1 22 22 DG H1 H 1 11.32 0.0005 . 1 . . . . A 22 DG H1 . 34542 1 154 . 1 . 1 22 22 DG H1' H 1 6.14 0.0023 . 1 . . . . A 22 DG H1' . 34542 1 155 . 1 . 1 22 22 DG H2' H 1 2.45 0.0003 . 1 . . . . A 22 DG H2' . 34542 1 156 . 1 . 1 22 22 DG H2'' H 1 2.74 0.0009 . 1 . . . . A 22 DG H2'' . 34542 1 157 . 1 . 1 22 22 DG H3' H 1 5.05 0.0004 . 1 . . . . A 22 DG H3' . 34542 1 158 . 1 . 1 22 22 DG H8 H 1 7.81 0.0022 . 1 . . . . A 22 DG H8 . 34542 1 159 . 1 . 1 22 22 DG C8 C 13 137.09 0.0000 . 1 . . . . A 22 DG C8 . 34542 1 160 . 1 . 1 23 23 DG H1 H 1 11.36 0.0006 . 1 . . . . A 23 DG H1 . 34542 1 161 . 1 . 1 23 23 DG H1' H 1 5.81 0.0020 . 1 . . . . A 23 DG H1' . 34542 1 162 . 1 . 1 23 23 DG H2' H 1 3.08 0.0009 . 1 . . . . A 23 DG H2' . 34542 1 163 . 1 . 1 23 23 DG H2'' H 1 2.55 0.0019 . 1 . . . . A 23 DG H2'' . 34542 1 164 . 1 . 1 23 23 DG H8 H 1 7.19 0.0006 . 1 . . . . A 23 DG H8 . 34542 1 165 . 1 . 1 23 23 DG C8 C 13 140.91 0.0000 . 1 . . . . A 23 DG C8 . 34542 1 166 . 1 . 1 24 24 DG H1 H 1 11.46 0.0005 . 2 . . . . A 24 DG H1 . 34542 1 167 . 1 . 1 24 24 DG H1' H 1 6.02 0.0016 . 1 . . . . A 24 DG H1' . 34542 1 168 . 1 . 1 24 24 DG H2' H 1 2.42 0.0031 . 1 . . . . A 24 DG H2' . 34542 1 169 . 1 . 1 24 24 DG H2'' H 1 2.56 0.0032 . 1 . . . . A 24 DG H2'' . 34542 1 170 . 1 . 1 24 24 DG H3' H 1 5.01 0.0008 . 1 . . . . A 24 DG H3' . 34542 1 171 . 1 . 1 24 24 DG H8 H 1 7.05 0.0013 . 1 . . . . A 24 DG H8 . 34542 1 172 . 1 . 1 24 24 DG C8 C 13 136.13 0.0000 . 1 . . . . A 24 DG C8 . 34542 1 173 . 1 . 1 25 25 DA H1' H 1 6.58 0.0009 . 1 . . . . A 25 DA H1' . 34542 1 174 . 1 . 1 25 25 DA H2 H 1 8.27 0.0002 . 1 . . . . A 25 DA H2 . 34542 1 175 . 1 . 1 25 25 DA H2' H 1 2.96 0.0011 . 1 . . . . A 25 DA H2' . 34542 1 176 . 1 . 1 25 25 DA H2'' H 1 2.69 0.0004 . 1 . . . . A 25 DA H2'' . 34542 1 177 . 1 . 1 25 25 DA H3' H 1 4.82 0.0002 . 1 . . . . A 25 DA H3' . 34542 1 178 . 1 . 1 25 25 DA H8 H 1 8.53 0.0003 . 1 . . . . A 25 DA H8 . 34542 1 179 . 1 . 1 25 25 DA C2 C 13 155.75 0.0000 . 1 . . . . A 25 DA C2 . 34542 1 180 . 1 . 1 25 25 DA C8 C 13 142.60 0.0000 . 1 . . . . A 25 DA C8 . 34542 1 stop_ save_