################################### # 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_chemical_shift_set_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_set_1 _Assigned_chem_shift_list.Entry_ID 5135 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_cond_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_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 . 5135 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 DG H8 H 1 7.986 0.002 . 1 . . . . . . . . 5135 1 2 . 1 1 1 1 DG H1' H 1 6.012 0.002 . 1 . . . . . . . . 5135 1 3 . 1 1 1 1 DG H2' H 1 2.651 0.002 . 1 . . . . . . . . 5135 1 4 . 1 1 1 1 DG H2'' H 1 2.825 0.002 . 1 . . . . . . . . 5135 1 5 . 1 1 1 1 DG H3' H 1 4.881 0.002 . 1 . . . . . . . . 5135 1 6 . 1 1 1 1 DG H4' H 1 4.268 0.002 . 1 . . . . . . . . 5135 1 7 . 1 1 1 1 DG H5' H 1 3.751 0.002 . 1 . . . . . . . . 5135 1 8 . 1 1 1 1 DG H1 H 1 12.82 0.002 . 1 . . . . . . . . 5135 1 9 . 1 1 1 1 DG P P 31 0.741 0.002 . 1 . . . . . . . . 5135 1 10 . 1 1 2 2 DC H6 H 1 7.525 0.002 . 1 . . . . . . . . 5135 1 11 . 1 1 2 2 DC H5 H 1 5.487 0.002 . 1 . . . . . . . . 5135 1 12 . 1 1 2 2 DC H1' H 1 5.715 0.002 . 1 . . . . . . . . 5135 1 13 . 1 1 2 2 DC H2' H 1 2.227 0.002 . 1 . . . . . . . . 5135 1 14 . 1 1 2 2 DC H2'' H 1 2.534 0.002 . 1 . . . . . . . . 5135 1 15 . 1 1 2 2 DC H3' H 1 4.938 0.002 . 1 . . . . . . . . 5135 1 16 . 1 1 2 2 DC H4' H 1 4.256 0.002 . 1 . . . . . . . . 5135 1 17 . 1 1 2 2 DC P P 31 0.372 0.002 . 1 . . . . . . . . 5135 1 18 . 1 1 3 3 DA H8 H 1 8.416 0.002 . 1 . . . . . . . . 5135 1 19 . 1 1 3 3 DA H2 H 1 7.785 0.002 . 1 . . . . . . . . 5135 1 20 . 1 1 3 3 DA H1' H 1 6.357 0.002 . 1 . . . . . . . . 5135 1 21 . 1 1 3 3 DA H2' H 1 2.783 0.002 . 1 . . . . . . . . 5135 1 22 . 1 1 3 3 DA H2'' H 1 3.024 0.002 . 1 . . . . . . . . 5135 1 23 . 1 1 3 3 DA H3' H 1 5.090 0.002 . 1 . . . . . . . . 5135 1 24 . 1 1 3 3 DA H4' H 1 4.488 0.002 . 1 . . . . . . . . 5135 1 25 . 1 1 3 3 DA H5' H 1 4.157 0.002 . 1 . . . . . . . . 5135 1 26 . 1 1 3 3 DA H5'' H 1 4.240 0.002 . 1 . . . . . . . . 5135 1 27 . 1 1 3 3 DA P P 31 0.901 0.002 . 1 . . . . . . . . 5135 1 28 . 1 1 4 4 DT H6 H 1 7.228 0.002 . 1 . . . . . . . . 5135 1 29 . 1 1 4 4 DT H71 H 1 1.514 0.002 . 1 . . . . . . . . 5135 1 30 . 1 1 4 4 DT H72 H 1 1.514 0.002 . 1 . . . . . . . . 5135 1 31 . 1 1 4 4 DT H73 H 1 1.514 0.002 . 1 . . . . . . . . 5135 1 32 . 1 1 4 4 DT H1' H 1 5.952 0.002 . 1 . . . . . . . . 5135 1 33 . 1 1 4 4 DT H2' H 1 2.039 0.002 . 1 . . . . . . . . 5135 1 34 . 1 1 4 4 DT H2'' H 1 2.453 0.002 . 1 . . . . . . . . 5135 1 35 . 1 1 4 4 DT H3' H 1 4.886 0.002 . 1 . . . . . . . . 5135 1 36 . 1 1 4 4 DT H4' H 1 4.202 0.002 . 1 . . . . . . . . 5135 1 37 . 1 1 4 4 DT H5' H 1 4.344 0.002 . 1 . . . . . . . . 5135 1 38 . 1 1 4 4 DT H5'' H 1 4.199 0.002 . 1 . . . . . . . . 5135 1 39 . 1 1 4 4 DT H3 H 1 13.64 0.002 . 1 . . . . . . . . 5135 1 40 . 1 1 4 4 DT P P 31 0.663 0.002 . 1 . . . . . . . . 5135 1 41 . 1 1 5 5 DC H6 H 1 7.486 0.002 . 1 . . . . . . . . 5135 1 42 . 1 1 5 5 DC H5 H 1 5.705 0.002 . 1 . . . . . . . . 5135 1 43 . 1 1 5 5 DC H1' H 1 5.487 0.002 . 1 . . . . . . . . 5135 1 44 . 1 1 5 5 DC H2' H 1 2.003 0.002 . 1 . . . . . . . . 5135 1 45 . 1 1 5 5 DC H2'' H 1 2.315 0.002 . 1 . . . . . . . . 5135 1 46 . 1 1 5 5 DC H3' H 1 4.830 0.002 . 1 . . . . . . . . 5135 1 47 . 1 1 5 5 DC H4' H 1 4.098 0.002 . 1 . . . . . . . . 5135 1 48 . 1 1 5 5 DC P P 31 0.329 0.002 . 1 . . . . . . . . 5135 1 49 . 1 1 6 6 DG H8 H 1 7.813 0.002 . 1 . . . . . . . . 5135 1 50 . 1 1 6 6 DG H1' H 1 5.658 0.002 . 1 . . . . . . . . 5135 1 51 . 1 1 6 6 DG H2' H 1 2.542 0.002 . 1 . . . . . . . . 5135 1 52 . 1 1 6 6 DG H2'' H 1 2.668 0.002 . 1 . . . . . . . . 5135 1 53 . 1 1 6 6 DG H3' H 1 4.960 0.002 . 1 . . . . . . . . 5135 1 54 . 1 1 6 6 DG H4' H 1 4.321 0.002 . 1 . . . . . . . . 5135 1 55 . 1 1 6 6 DG H5' H 1 4.013 0.002 . 1 . . . . . . . . 5135 1 56 . 1 1 6 6 DG H1 H 1 12.77 0.002 . 1 . . . . . . . . 5135 1 57 . 1 1 6 6 DG P P 31 0.846 0.002 . 1 . . . . . . . . 5135 1 58 . 1 1 7 7 DA H8 H 1 7.816 0.002 . 1 . . . . . . . . 5135 1 59 . 1 1 7 7 DA H2 H 1 7.535 0.002 . 1 . . . . . . . . 5135 1 60 . 1 1 7 7 DA H1' H 1 5.862 0.002 . 1 . . . . . . . . 5135 1 61 . 1 1 7 7 DA H2' H 1 2.236 0.002 . 1 . . . . . . . . 5135 1 62 . 1 1 7 7 DA H2'' H 1 2.525 0.002 . 1 . . . . . . . . 5135 1 63 . 1 1 7 7 DA H3' H 1 4.883 0.002 . 1 . . . . . . . . 5135 1 64 . 1 1 7 7 DA H4' H 1 4.275 0.002 . 1 . . . . . . . . 5135 1 65 . 1 1 8 8 DA H8 H 1 8.071 0.002 . 1 . . . . . . . . 5135 1 66 . 1 1 8 8 DA H2 H 1 7.678 0.002 . 1 . . . . . . . . 5135 1 67 . 1 1 8 8 DA H1' H 1 5.983 0.002 . 1 . . . . . . . . 5135 1 68 . 1 1 8 8 DA H2' H 1 2.517 0.002 . 1 . . . . . . . . 5135 1 69 . 1 1 8 8 DA H2'' H 1 2.516 0.002 . 1 . . . . . . . . 5135 1 70 . 1 1 8 8 DA H3' H 1 4.869 0.002 . 1 . . . . . . . . 5135 1 71 . 1 1 8 8 DA H4' H 1 4.256 0.002 . 1 . . . . . . . . 5135 1 72 . 1 1 8 8 DA H5' H 1 4.065 0.002 . 1 . . . . . . . . 5135 1 73 . 1 1 8 8 DA H5'' H 1 4.122 0.002 . 1 . . . . . . . . 5135 1 74 . 1 1 8 8 DA P P 31 0.760 0.002 . 1 . . . . . . . . 5135 1 75 . 1 1 9 9 DT H6 H 1 6.976 0.002 . 1 . . . . . . . . 5135 1 76 . 1 1 9 9 DT H71 H 1 1.500 0.002 . 1 . . . . . . . . 5135 1 77 . 1 1 9 9 DT H72 H 1 1.500 0.002 . 1 . . . . . . . . 5135 1 78 . 1 1 9 9 DT H73 H 1 1.500 0.002 . 1 . . . . . . . . 5135 1 79 . 1 1 9 9 DT H1' H 1 5.688 0.002 . 1 . . . . . . . . 5135 1 80 . 1 1 9 9 DT H2' H 1 1.603 0.002 . 1 . . . . . . . . 5135 1 81 . 1 1 9 9 DT H2'' H 1 1.956 0.002 . 1 . . . . . . . . 5135 1 82 . 1 1 9 9 DT H3' H 1 4.532 0.002 . 1 . . . . . . . . 5135 1 83 . 1 1 9 9 DT H4' H 1 3.747 0.002 . 1 . . . . . . . . 5135 1 84 . 1 1 9 9 DT H5' H 1 3.833 0.002 . 1 . . . . . . . . 5135 1 85 . 1 1 9 9 DT H5'' H 1 3.711 0.002 . 1 . . . . . . . . 5135 1 86 . 1 1 9 9 DT P P 31 0.671 0.002 . 1 . . . . . . . . 5135 1 87 . 1 1 10 10 DA H8 H 1 7.906 0.002 . 1 . . . . . . . . 5135 1 88 . 1 1 10 10 DA H2 H 1 7.785 0.002 . 1 . . . . . . . . 5135 1 89 . 1 1 10 10 DA H1' H 1 5.786 0.002 . 1 . . . . . . . . 5135 1 90 . 1 1 10 10 DA H2' H 1 2.370 0.002 . 1 . . . . . . . . 5135 1 91 . 1 1 10 10 DA H2'' H 1 2.471 0.002 . 1 . . . . . . . . 5135 1 92 . 1 1 10 10 DA H3' H 1 4.777 0.002 . 1 . . . . . . . . 5135 1 93 . 1 1 10 10 DA H4' H 1 4.047 0.002 . 1 . . . . . . . . 5135 1 94 . 1 1 10 10 DA H5' H 1 3.782 0.002 . 1 . . . . . . . . 5135 1 95 . 1 1 10 10 DA H5'' H 1 3.699 0.002 . 1 . . . . . . . . 5135 1 96 . 1 1 10 10 DA P P 31 0.944 0.002 . 1 . . . . . . . . 5135 1 97 . 1 1 11 11 DA H8 H 1 8.048 0.002 . 1 . . . . . . . . 5135 1 98 . 1 1 11 11 DA H2 H 1 7.611 0.002 . 1 . . . . . . . . 5135 1 99 . 1 1 11 11 DA H1' H 1 5.338 0.002 . 1 . . . . . . . . 5135 1 100 . 1 1 11 11 DA H2' H 1 2.501 0.002 . 1 . . . . . . . . 5135 1 101 . 1 1 11 11 DA H2'' H 1 2.522 0.002 . 1 . . . . . . . . 5135 1 102 . 1 1 11 11 DA H3' H 1 4.875 0.002 . 1 . . . . . . . . 5135 1 103 . 1 1 11 11 DA H4' H 1 4.263 0.002 . 1 . . . . . . . . 5135 1 104 . 1 1 11 11 DA P P 31 0.083 0.002 . 1 . . . . . . . . 5135 1 105 . 1 1 12 12 DG H8 H 1 7.918 0.002 . 1 . . . . . . . . 5135 1 106 . 1 1 12 12 DG H1' H 1 5.843 0.002 . 1 . . . . . . . . 5135 1 107 . 1 1 12 12 DG H2' H 1 2.722 0.002 . 1 . . . . . . . . 5135 1 108 . 1 1 12 12 DG H2'' H 1 2.722 0.002 . 1 . . . . . . . . 5135 1 109 . 1 1 12 12 DG H3' H 1 5.005 0.002 . 1 . . . . . . . . 5135 1 110 . 1 1 12 12 DG H4' H 1 4.398 0.002 . 1 . . . . . . . . 5135 1 111 . 1 1 12 12 DG H1 H 1 12.51 0.002 . 1 . . . . . . . . 5135 1 112 . 1 1 12 12 DG P P 31 0.627 0.002 . 1 . . . . . . . . 5135 1 113 . 1 1 13 13 DC H6 H 1 7.447 0.002 . 1 . . . . . . . . 5135 1 114 . 1 1 13 13 DC H5 H 1 5.364 0.002 . 1 . . . . . . . . 5135 1 115 . 1 1 13 13 DC H1' H 1 5.986 0.002 . 1 . . . . . . . . 5135 1 116 . 1 1 13 13 DC H2' H 1 2.093 0.002 . 1 . . . . . . . . 5135 1 117 . 1 1 13 13 DC H2'' H 1 2.510 0.002 . 1 . . . . . . . . 5135 1 118 . 1 1 13 13 DC H3' H 1 4.777 0.002 . 1 . . . . . . . . 5135 1 119 . 1 1 13 13 DC H4' H 1 4.264 0.002 . 1 . . . . . . . . 5135 1 120 . 1 1 13 13 DC P P 31 0.863 0.002 . 1 . . . . . . . . 5135 1 121 . 1 1 14 14 DT H6 H 1 7.436 0.002 . 1 . . . . . . . . 5135 1 122 . 1 1 14 14 DT H71 H 1 1.706 0.002 . 1 . . . . . . . . 5135 1 123 . 1 1 14 14 DT H72 H 1 1.706 0.002 . 1 . . . . . . . . 5135 1 124 . 1 1 14 14 DT H73 H 1 1.706 0.002 . 1 . . . . . . . . 5135 1 125 . 1 1 14 14 DT H1' H 1 5.684 0.002 . 1 . . . . . . . . 5135 1 126 . 1 1 14 14 DT H2' H 1 2.164 0.002 . 1 . . . . . . . . 5135 1 127 . 1 1 14 14 DT H2'' H 1 2.482 0.002 . 1 . . . . . . . . 5135 1 128 . 1 1 14 14 DT H3' H 1 4.919 0.002 . 1 . . . . . . . . 5135 1 129 . 1 1 14 14 DT H4' H 1 4.197 0.002 . 1 . . . . . . . . 5135 1 130 . 1 1 14 14 DT H3 H 1 13.85 0.002 . 1 . . . . . . . . 5135 1 131 . 1 1 14 14 DT P P 31 0.638 0.002 . 1 . . . . . . . . 5135 1 132 . 1 1 15 15 DA H8 H 1 8.360 0.002 . 1 . . . . . . . . 5135 1 133 . 1 1 15 15 DA H2 H 1 7.585 0.002 . 1 . . . . . . . . 5135 1 134 . 1 1 15 15 DA H1' H 1 6.243 0.002 . 1 . . . . . . . . 5135 1 135 . 1 1 15 15 DA H2' H 1 2.759 0.002 . 1 . . . . . . . . 5135 1 136 . 1 1 15 15 DA H2'' H 1 2.892 0.002 . 1 . . . . . . . . 5135 1 137 . 1 1 15 15 DA H3' H 1 5.077 0.002 . 1 . . . . . . . . 5135 1 138 . 1 1 15 15 DA H4' H 1 4.476 0.002 . 1 . . . . . . . . 5135 1 139 . 1 1 15 15 DA H5' H 1 4.134 0.002 . 1 . . . . . . . . 5135 1 140 . 1 1 15 15 DA H5'' H 1 4.205 0.002 . 1 . . . . . . . . 5135 1 141 . 1 1 15 15 DA P P 31 0.639 0.002 . 1 . . . . . . . . 5135 1 142 . 1 1 16 16 DC H6 H 1 7.320 0.002 . 1 . . . . . . . . 5135 1 143 . 1 1 16 16 DC H5 H 1 5.414 0.002 . 1 . . . . . . . . 5135 1 144 . 1 1 16 16 DC H1' H 1 5.687 0.002 . 1 . . . . . . . . 5135 1 145 . 1 1 16 16 DC H2' H 1 1.883 0.002 . 1 . . . . . . . . 5135 1 146 . 1 1 16 16 DC H2'' H 1 2.314 0.002 . 1 . . . . . . . . 5135 1 147 . 1 1 16 16 DC H3' H 1 4.807 0.002 . 1 . . . . . . . . 5135 1 148 . 1 1 16 16 DC H4' H 1 4.188 0.002 . 1 . . . . . . . . 5135 1 149 . 1 1 16 16 DC H5' H 1 4.296 0.002 . 1 . . . . . . . . 5135 1 150 . 1 1 16 16 DC P P 31 0.405 0.002 . 1 . . . . . . . . 5135 1 151 . 1 1 17 17 DG H8 H 1 7.918 0.002 . 1 . . . . . . . . 5135 1 152 . 1 1 17 17 DG H1' H 1 6.156 0.002 . 1 . . . . . . . . 5135 1 153 . 1 1 17 17 DG H2' H 1 2.606 0.002 . 1 . . . . . . . . 5135 1 154 . 1 1 17 17 DG H2'' H 1 2.384 0.002 . 1 . . . . . . . . 5135 1 155 . 1 1 17 17 DG H3' H 1 4.680 0.002 . 1 . . . . . . . . 5135 1 156 . 1 1 17 17 DG H4' H 1 4.188 0.002 . 1 . . . . . . . . 5135 1 157 . 1 1 17 17 DG H5' H 1 4.102 0.002 . 1 . . . . . . . . 5135 1 158 . 1 1 17 17 DG H5'' H 1 4.079 0.002 . 1 . . . . . . . . 5135 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_chemical_shift_set_2 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_set_2 _Assigned_chem_shift_list.Entry_ID 5135 _Assigned_chem_shift_list.ID 2 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_cond_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_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 . 5135 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.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 . 2 2 1 1 DC H6 H 1 7.673 0.002 . 1 . . . . . . . . 5135 2 2 . 2 2 1 1 DC H5 H 1 5.937 0.002 . 1 . . . . . . . . 5135 2 3 . 2 2 1 1 DC H1' H 1 5.808 0.002 . 1 . . . . . . . . 5135 2 4 . 2 2 1 1 DC H2' H 1 2.061 0.002 . 1 . . . . . . . . 5135 2 5 . 2 2 1 1 DC H2'' H 1 2.462 0.002 . 1 . . . . . . . . 5135 2 6 . 2 2 1 1 DC H3' H 1 4.729 0.002 . 1 . . . . . . . . 5135 2 7 . 2 2 1 1 DC H4' H 1 4.096 0.002 . 1 . . . . . . . . 5135 2 8 . 2 2 1 1 DC H5' H 1 3.747 0.002 . 1 . . . . . . . . 5135 2 9 . 2 2 1 1 DC P P 31 0.535 0.002 . 1 . . . . . . . . 5135 2 10 . 2 2 2 2 DG H8 H 1 8.010 0.002 . 1 . . . . . . . . 5135 2 11 . 2 2 2 2 DG H1' H 1 6.005 0.002 . 1 . . . . . . . . 5135 2 12 . 2 2 2 2 DG H2' H 1 2.705 0.002 . 1 . . . . . . . . 5135 2 13 . 2 2 2 2 DG H2'' H 1 2.815 0.002 . 1 . . . . . . . . 5135 2 14 . 2 2 2 2 DG H3' H 1 4.998 0.002 . 1 . . . . . . . . 5135 2 15 . 2 2 2 2 DG H4' H 1 4.386 0.002 . 1 . . . . . . . . 5135 2 16 . 2 2 2 2 DG H1 H 1 12.84 0.002 . 1 . . . . . . . . 5135 2 17 . 2 2 2 2 DG P P 31 0.978 0.002 . 1 . . . . . . . . 5135 2 18 . 2 2 3 3 DT H6 H 1 7.288 0.002 . 1 . . . . . . . . 5135 2 19 . 2 2 3 3 DT H71 H 1 1.526 0.002 . 1 . . . . . . . . 5135 2 20 . 2 2 3 3 DT H72 H 1 1.526 0.002 . 1 . . . . . . . . 5135 2 21 . 2 2 3 3 DT H73 H 1 1.526 0.002 . 1 . . . . . . . . 5135 2 22 . 2 2 3 3 DT H1' H 1 5.650 0.002 . 1 . . . . . . . . 5135 2 23 . 2 2 3 3 DT H2' H 1 2.116 0.002 . 1 . . . . . . . . 5135 2 24 . 2 2 3 3 DT H2'' H 1 2.432 0.002 . 1 . . . . . . . . 5135 2 25 . 2 2 3 3 DT H3' H 1 4.895 0.002 . 1 . . . . . . . . 5135 2 26 . 2 2 3 3 DT H4' H 1 4.207 0.002 . 1 . . . . . . . . 5135 2 27 . 2 2 3 3 DT H3 H 1 13.63 0.002 . 1 . . . . . . . . 5135 2 28 . 2 2 3 3 DT P P 31 0.594 0.002 . 1 . . . . . . . . 5135 2 29 . 2 2 4 4 DA H8 H 1 8.223 0.002 . 1 . . . . . . . . 5135 2 30 . 2 2 4 4 DA H2 H 1 7.486 0.002 . 1 . . . . . . . . 5135 2 31 . 2 2 4 4 DA H1' H 1 6.081 0.002 . 1 . . . . . . . . 5135 2 32 . 2 2 4 4 DA H2' H 1 2.760 0.002 . 1 . . . . . . . . 5135 2 33 . 2 2 4 4 DA H2'' H 1 2.927 0.002 . 1 . . . . . . . . 5135 2 34 . 2 2 4 4 DA H3' H 1 5.087 0.002 . 1 . . . . . . . . 5135 2 35 . 2 2 4 4 DA H4' H 1 4.442 0.002 . 1 . . . . . . . . 5135 2 36 . 2 2 4 4 DA H5' H 1 4.194 0.002 . 1 . . . . . . . . 5135 2 37 . 2 2 4 4 DA H5'' H 1 4.072 0.002 . 1 . . . . . . . . 5135 2 38 . 2 2 4 4 DA P P 31 0.646 0.002 . 1 . . . . . . . . 5135 2 39 . 2 2 5 5 DG H8 H 1 7.702 0.002 . 1 . . . . . . . . 5135 2 40 . 2 2 5 5 DG H1' H 1 5.806 0.002 . 1 . . . . . . . . 5135 2 41 . 2 2 5 5 DG H2' H 1 2.517 0.002 . 1 . . . . . . . . 5135 2 42 . 2 2 5 5 DG H2'' H 1 2.685 0.002 . 1 . . . . . . . . 5135 2 43 . 2 2 5 5 DG H3' H 1 5.040 0.002 . 1 . . . . . . . . 5135 2 44 . 2 2 5 5 DG H4' H 1 4.421 0.002 . 1 . . . . . . . . 5135 2 45 . 2 2 5 5 DG H1 H 1 12.72 0.002 . 1 . . . . . . . . 5135 2 46 . 2 2 5 5 DG P P 31 0.645 0.002 . 1 . . . . . . . . 5135 2 47 . 2 2 6 6 DC H6 H 1 7.494 0.002 . 1 . . . . . . . . 5135 2 48 . 2 2 6 6 DC H5 H 1 5.436 0.002 . 1 . . . . . . . . 5135 2 49 . 2 2 6 6 DC H1' H 1 6.288 0.002 . 1 . . . . . . . . 5135 2 50 . 2 2 6 6 DC H2' H 1 2.291 0.002 . 1 . . . . . . . . 5135 2 51 . 2 2 6 6 DC H2'' H 1 2.319 0.002 . 1 . . . . . . . . 5135 2 52 . 2 2 6 6 DC H3' H 1 4.819 0.002 . 1 . . . . . . . . 5135 2 53 . 2 2 6 6 DC H4' H 1 4.345 0.002 . 1 . . . . . . . . 5135 2 54 . 2 2 6 6 DC P P 31 0.271 0.002 . 1 . . . . . . . . 5135 2 55 . 2 2 7 7 DC H6 H 1 7.822 0.002 . 1 . . . . . . . . 5135 2 56 . 2 2 7 7 DC H5 H 1 6.139 0.002 . 1 . . . . . . . . 5135 2 57 . 2 2 7 7 DC H1' H 1 5.989 0.002 . 1 . . . . . . . . 5135 2 58 . 2 2 7 7 DC H2' H 1 2.188 0.002 . 1 . . . . . . . . 5135 2 59 . 2 2 7 7 DC H2'' H 1 2.570 0.002 . 1 . . . . . . . . 5135 2 60 . 2 2 7 7 DC H3' H 1 4.976 0.002 . 1 . . . . . . . . 5135 2 61 . 2 2 7 7 DC H4' H 1 4.333 0.002 . 1 . . . . . . . . 5135 2 62 . 2 2 7 7 DC P P 31 0.708 0.002 . 1 . . . . . . . . 5135 2 63 . 2 2 8 8 DG H8 H 1 7.995 0.002 . 1 . . . . . . . . 5135 2 64 . 2 2 8 8 DG H1' H 1 5.541 0.002 . 1 . . . . . . . . 5135 2 65 . 2 2 8 8 DG H2' H 1 2.748 0.002 . 1 . . . . . . . . 5135 2 66 . 2 2 8 8 DG H2'' H 1 2.813 0.002 . 1 . . . . . . . . 5135 2 67 . 2 2 8 8 DG H3' H 1 5.034 0.002 . 1 . . . . . . . . 5135 2 68 . 2 2 8 8 DG H4' H 1 4.342 0.002 . 1 . . . . . . . . 5135 2 69 . 2 2 8 8 DG H5' H 1 4.072 0.002 . 1 . . . . . . . . 5135 2 70 . 2 2 8 8 DG H5'' H 1 4.143 0.002 . 1 . . . . . . . . 5135 2 71 . 2 2 8 8 DG H1 H 1 12.82 0.002 . 1 . . . . . . . . 5135 2 72 . 2 2 8 8 DG P P 31 0.462 0.002 . 1 . . . . . . . . 5135 2 73 . 2 2 9 9 DA H8 H 1 8.265 0.002 . 1 . . . . . . . . 5135 2 74 . 2 2 9 9 DA H2 H 1 7.857 0.002 . 1 . . . . . . . . 5135 2 75 . 2 2 9 9 DA H1' H 1 6.285 0.002 . 1 . . . . . . . . 5135 2 76 . 2 2 9 9 DA H2' H 1 2.679 0.002 . 1 . . . . . . . . 5135 2 77 . 2 2 9 9 DA H2'' H 1 2.955 0.002 . 1 . . . . . . . . 5135 2 78 . 2 2 9 9 DA H3' H 1 5.047 0.002 . 1 . . . . . . . . 5135 2 79 . 2 2 9 9 DA H4' H 1 4.482 0.002 . 1 . . . . . . . . 5135 2 80 . 2 2 9 9 DA H5' H 1 4.234 0.002 . 1 . . . . . . . . 5135 2 81 . 2 2 9 9 DA P P 31 0.888 0.002 . 1 . . . . . . . . 5135 2 82 . 2 2 10 10 DT H6 H 1 7.110 0.002 . 1 . . . . . . . . 5135 2 83 . 2 2 10 10 DT H71 H 1 1.435 0.002 . 1 . . . . . . . . 5135 2 84 . 2 2 10 10 DT H72 H 1 1.435 0.002 . 1 . . . . . . . . 5135 2 85 . 2 2 10 10 DT H73 H 1 1.435 0.002 . 1 . . . . . . . . 5135 2 86 . 2 2 10 10 DT H1' H 1 5.775 0.002 . 1 . . . . . . . . 5135 2 87 . 2 2 10 10 DT H2' H 1 1.968 0.002 . 1 . . . . . . . . 5135 2 88 . 2 2 10 10 DT H2'' H 1 2.372 0.002 . 1 . . . . . . . . 5135 2 89 . 2 2 10 10 DT H3' H 1 4.877 0.002 . 1 . . . . . . . . 5135 2 90 . 2 2 10 10 DT H4' H 1 4.158 0.002 . 1 . . . . . . . . 5135 2 91 . 2 2 10 10 DT H5' H 1 4.282 0.002 . 1 . . . . . . . . 5135 2 92 . 2 2 10 10 DT H3 H 1 13.65 0.002 . 1 . . . . . . . . 5135 2 93 . 2 2 10 10 DT P P 31 0.666 0.002 . 1 . . . . . . . . 5135 2 94 . 2 2 11 11 DG H8 H 1 7.885 0.002 . 1 . . . . . . . . 5135 2 95 . 2 2 11 11 DG H1' H 1 5.951 0.002 . 1 . . . . . . . . 5135 2 96 . 2 2 11 11 DG H2' H 1 2.623 0.002 . 1 . . . . . . . . 5135 2 97 . 2 2 11 11 DG H2'' H 1 2.720 0.002 . 1 . . . . . . . . 5135 2 98 . 2 2 11 11 DG H3' H 1 4.987 0.002 . 1 . . . . . . . . 5135 2 99 . 2 2 11 11 DG H4' H 1 4.377 0.002 . 1 . . . . . . . . 5135 2 100 . 2 2 11 11 DG H1 H 1 12.82 0.002 . 1 . . . . . . . . 5135 2 101 . 2 2 11 11 DG P P 31 0.429 0.002 . 1 . . . . . . . . 5135 2 102 . 2 2 12 12 DC H6 H 1 7.481 0.002 . 1 . . . . . . . . 5135 2 103 . 2 2 12 12 DC H5 H 1 5.465 0.002 . 1 . . . . . . . . 5135 2 104 . 2 2 12 12 DC H1' H 1 6.219 0.002 . 1 . . . . . . . . 5135 2 105 . 2 2 12 12 DC H2' H 1 2.192 0.002 . 1 . . . . . . . . 5135 2 106 . 2 2 12 12 DC H2'' H 1 2.231 0.002 . 1 . . . . . . . . 5135 2 107 . 2 2 12 12 DC H3' H 1 4.515 0.002 . 1 . . . . . . . . 5135 2 108 . 2 2 12 12 DC H4' H 1 4.084 0.002 . 1 . . . . . . . . 5135 2 109 . 2 2 12 12 DC H5' H 1 4.262 0.002 . 1 . . . . . . . . 5135 2 stop_ save_