################################### # 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_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 16225 _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 $chemical_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' . . . 16225 1 2 '2D 1H-1H COSY' . . . 16225 1 3 '2D 1H-1H NOESY' . . . 16225 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 H1' H 1 5.865 0.003 . 1 . . . . 1 G H1' . 16225 1 2 . 1 1 1 1 DG H2' H 1 2.472 0.003 . 1 . . . . 1 G H2' . 16225 1 3 . 1 1 1 1 DG H2'' H 1 2.640 0.003 . 1 . . . . 1 G H2'' . 16225 1 4 . 1 1 1 1 DG H3' H 1 4.668 0.003 . 1 . . . . 1 G H3' . 16225 1 5 . 1 1 1 1 DG H4' H 1 4.073 0.003 . 1 . . . . 1 G H4' . 16225 1 6 . 1 1 1 1 DG H5' H 1 3.617 0.003 . 1 . . . . 1 G H5' . 16225 1 7 . 1 1 1 1 DG H5'' H 1 3.601 0.003 . 1 . . . . 1 G H5'' . 16225 1 8 . 1 1 1 1 DG H8 H 1 7.794 0.003 . 1 . . . . 1 G H8 . 16225 1 9 . 1 1 1 1 DG P P 31 1.358 0.000 . 1 . . . . 1 G P . 16225 1 10 . 1 1 2 2 DT H1' H 1 5.761 0.003 . 1 . . . . 2 T H1' . 16225 1 11 . 1 1 2 2 DT H2' H 1 2.040 0.003 . 1 . . . . 2 T H2' . 16225 1 12 . 1 1 2 2 DT H2'' H 1 2.382 0.002 . 1 . . . . 2 T H2'' . 16225 1 13 . 1 1 2 2 DT H3 H 1 13.670 0.011 . 1 . . . . 2 T H3 . 16225 1 14 . 1 1 2 2 DT H3' H 1 4.751 0.003 . 1 . . . . 2 T H3' . 16225 1 15 . 1 1 2 2 DT H4' H 1 4.092 0.003 . 1 . . . . 2 T H4' . 16225 1 16 . 1 1 2 2 DT H5' H 1 3.977 0.004 . 1 . . . . 2 T H5' . 16225 1 17 . 1 1 2 2 DT H6 H 1 7.201 0.003 . 1 . . . . 2 T H6 . 16225 1 18 . 1 1 2 2 DT H71 H 1 1.244 0.002 . 1 . . . . 2 T H7 . 16225 1 19 . 1 1 2 2 DT H72 H 1 1.244 0.002 . 1 . . . . 2 T H7 . 16225 1 20 . 1 1 2 2 DT H73 H 1 1.244 0.002 . 1 . . . . 2 T H7 . 16225 1 21 . 1 1 2 2 DT P P 31 1.453 0.000 . 1 . . . . 2 T P . 16225 1 22 . 1 1 3 3 DG H1 H 1 12.616 0.007 . 1 . . . . 3 G H1 . 16225 1 23 . 1 1 3 3 DG H1' H 1 5.754 0.003 . 1 . . . . 3 G H1' . 16225 1 24 . 1 1 3 3 DG H2' H 1 2.464 0.002 . 1 . . . . 3 G H2' . 16225 1 25 . 1 1 3 3 DG H2'' H 1 2.565 0.003 . 1 . . . . 3 G H2'' . 16225 1 26 . 1 1 3 3 DG H3' H 1 4.830 0.004 . 1 . . . . 3 G H3' . 16225 1 27 . 1 1 3 3 DG H4' H 1 4.221 0.003 . 1 . . . . 3 G H4' . 16225 1 28 . 1 1 3 3 DG H5' H 1 3.932 0.004 . 1 . . . . 3 G H5' . 16225 1 29 . 1 1 3 3 DG H5'' H 1 4.004 0.003 . 1 . . . . 3 G H5'' . 16225 1 30 . 1 1 3 3 DG H8 H 1 7.710 0.003 . 1 . . . . 3 G H8 . 16225 1 31 . 1 1 3 3 DG H22 H 1 6.353 0.007 . 1 . . . . 3 G H22 . 16225 1 32 . 1 1 3 3 DG P P 31 1.407 0.000 . 1 . . . . 3 G P . 16225 1 33 . 1 1 4 4 DC H1' H 1 5.607 0.003 . 1 . . . . 4 C H1' . 16225 1 34 . 1 1 4 4 DC H2' H 1 1.850 0.002 . 1 . . . . 4 C H2' . 16225 1 35 . 1 1 4 4 DC H2'' H 1 2.247 0.003 . 1 . . . . 4 C H2'' . 16225 1 36 . 1 1 4 4 DC H3' H 1 4.641 0.003 . 1 . . . . 4 C H3' . 16225 1 37 . 1 1 4 4 DC H4' H 1 4.036 0.003 . 1 . . . . 4 C H4' . 16225 1 38 . 1 1 4 4 DC H5 H 1 5.144 0.003 . 1 . . . . 4 C H5 . 16225 1 39 . 1 1 4 4 DC H5' H 1 3.999 0.003 . 1 . . . . 4 C H5' . 16225 1 40 . 1 1 4 4 DC H5'' H 1 4.075 0.004 . 1 . . . . 4 C H5'' . 16225 1 41 . 1 1 4 4 DC H6 H 1 7.107 0.003 . 1 . . . . 4 C H6 . 16225 1 42 . 1 1 4 4 DC H42 H 1 8.119 0.007 . 1 . . . . 4 C H42 . 16225 1 43 . 1 1 4 4 DC P P 31 1.289 0.000 . 1 . . . . 4 C P . 16225 1 44 . 1 1 5 5 DG H1 H 1 12.905 0.000 . 1 . . . . 5 G H1 . 16225 1 45 . 1 1 5 5 DG H1' H 1 5.875 0.003 . 1 . . . . 5 G H1' . 16225 1 46 . 1 1 5 5 DG H2' H 1 2.310 0.002 . 1 . . . . 5 G H2' . 16225 1 47 . 1 1 5 5 DG H2'' H 1 2.483 0.003 . 1 . . . . 5 G H2'' . 16225 1 48 . 1 1 5 5 DG H3' H 1 4.725 0.003 . 1 . . . . 5 G H3' . 16225 1 49 . 1 1 5 5 DG H4' H 1 4.151 0.002 . 1 . . . . 5 G H4' . 16225 1 50 . 1 1 5 5 DG H5' H 1 3.947 0.002 . 1 . . . . 5 G H5' . 16225 1 51 . 1 1 5 5 DG H8 H 1 7.639 0.003 . 1 . . . . 5 G H8 . 16225 1 52 . 1 1 5 5 DG P P 31 0.841 0.000 . 1 . . . . 5 G P . 16225 1 53 . 1 1 6 6 CTG H1' H 1 5.630 0.003 . 1 . . . . 6 TG H1' . 16225 1 54 . 1 1 6 6 CTG H2' H 1 2.065 0.003 . 1 . . . . 6 TG H2' . 16225 1 55 . 1 1 6 6 CTG H2'' H 1 2.281 0.003 . 1 . . . . 6 TG H2'' . 16225 1 56 . 1 1 6 6 CTG H3' H 1 4.574 0.003 . 1 . . . . 6 TG H3' . 16225 1 57 . 1 1 6 6 CTG H4' H 1 4.042 0.003 . 1 . . . . 6 TG H4' . 16225 1 58 . 1 1 6 6 CTG H5' H 1 3.785 0.003 . 1 . . . . 6 TG H5' . 16225 1 59 . 1 1 6 6 CTG H5'' H 1 3.967 0.005 . 1 . . . . 6 TG H5'' . 16225 1 60 . 1 1 6 6 CTG H6 H 1 4.577 0.004 . 1 . . . . 6 TG H6 . 16225 1 61 . 1 1 6 6 CTG H6x H 1 4.910 0.003 . 1 . . . . 6 TG H6x . 16225 1 62 . 1 1 6 6 CTG P P 31 1.765 0.000 . 1 . . . . 6 TG P . 16225 1 63 . 1 1 6 6 CTG M7 H 1 0.488 0.004 . 1 . . . . 6 TG M7 . 16225 1 64 . 1 1 6 6 CTG M7x H 1 1.240 0.002 . 1 . . . . 6 TG M7x . 16225 1 65 . 1 1 7 7 DG H1 H 1 12.277 0.008 . 1 . . . . 7 G H1 . 16225 1 66 . 1 1 7 7 DG H1' H 1 5.914 0.003 . 1 . . . . 7 G H1' . 16225 1 67 . 1 1 7 7 DG H2' H 1 2.501 0.006 . 1 . . . . 7 G H2' . 16225 1 68 . 1 1 7 7 DG H2'' H 1 2.719 0.002 . 1 . . . . 7 G H2'' . 16225 1 69 . 1 1 7 7 DG H3' H 1 4.782 0.003 . 1 . . . . 7 G H3' . 16225 1 70 . 1 1 7 7 DG H4' H 1 4.267 0.003 . 1 . . . . 7 G H4' . 16225 1 71 . 1 1 7 7 DG H5' H 1 3.937 0.003 . 1 . . . . 7 G H5' . 16225 1 72 . 1 1 7 7 DG H5'' H 1 4.023 0.004 . 1 . . . . 7 G H5'' . 16225 1 73 . 1 1 7 7 DG H8 H 1 7.746 0.003 . 1 . . . . 7 G H8 . 16225 1 74 . 1 1 7 7 DG H22 H 1 6.511 0.011 . 1 . . . . 7 G H22 . 16225 1 75 . 1 1 7 7 DG P P 31 1.436 0.000 . 1 . . . . 7 G P . 16225 1 76 . 1 1 8 8 DT H1' H 1 5.906 0.003 . 1 . . . . 8 T H1' . 16225 1 77 . 1 1 8 8 DT H2' H 1 1.991 0.004 . 1 . . . . 8 T H2' . 16225 1 78 . 1 1 8 8 DT H2'' H 1 2.446 0.005 . 1 . . . . 8 T H2'' . 16225 1 79 . 1 1 8 8 DT H3 H 1 13.777 0.019 . 1 . . . . 8 T H3 . 16225 1 80 . 1 1 8 8 DT H3' H 1 4.732 0.003 . 1 . . . . 8 T H3' . 16225 1 81 . 1 1 8 8 DT H4' H 1 4.094 0.004 . 1 . . . . 8 T H4' . 16225 1 82 . 1 1 8 8 DT H5' H 1 4.017 0.004 . 1 . . . . 8 T H5' . 16225 1 83 . 1 1 8 8 DT H6 H 1 7.122 0.003 . 1 . . . . 8 T H6 . 16225 1 84 . 1 1 8 8 DT H71 H 1 1.174 0.002 . 1 . . . . 8 T H7 . 16225 1 85 . 1 1 8 8 DT H72 H 1 1.174 0.002 . 1 . . . . 8 T H7 . 16225 1 86 . 1 1 8 8 DT H73 H 1 1.174 0.002 . 1 . . . . 8 T H7 . 16225 1 87 . 1 1 8 8 DT P P 31 1.377 0.000 . 1 . . . . 8 T P . 16225 1 88 . 1 1 9 9 DT H1' H 1 5.953 0.003 . 1 . . . . 9 T H1' . 16225 1 89 . 1 1 9 9 DT H2' H 1 1.986 0.003 . 1 . . . . 9 T H2' . 16225 1 90 . 1 1 9 9 DT H2'' H 1 2.430 0.003 . 1 . . . . 9 T H2'' . 16225 1 91 . 1 1 9 9 DT H3 H 1 13.849 0.015 . 1 . . . . 9 T H3 . 16225 1 92 . 1 1 9 9 DT H3' H 1 4.732 0.003 . 1 . . . . 9 T H3' . 16225 1 93 . 1 1 9 9 DT H4' H 1 4.015 0.003 . 1 . . . . 9 T H4' . 16225 1 94 . 1 1 9 9 DT H6 H 1 7.290 0.003 . 1 . . . . 9 T H6 . 16225 1 95 . 1 1 9 9 DT H71 H 1 1.467 0.002 . 1 . . . . 9 T H7 . 16225 1 96 . 1 1 9 9 DT H72 H 1 1.467 0.002 . 1 . . . . 9 T H7 . 16225 1 97 . 1 1 9 9 DT H73 H 1 1.467 0.002 . 1 . . . . 9 T H7 . 16225 1 98 . 1 1 10 10 DT H1' H 1 5.670 0.003 . 1 . . . . 10 T H1' . 16225 1 99 . 1 1 10 10 DT H2' H 1 1.818 0.003 . 1 . . . . 10 T H2' . 16225 1 100 . 1 1 10 10 DT H2'' H 1 2.201 0.003 . 1 . . . . 10 T H2'' . 16225 1 101 . 1 1 10 10 DT H3 H 1 13.801 0.006 . 1 . . . . 10 T H3 . 16225 1 102 . 1 1 10 10 DT H3' H 1 4.732 0.003 . 1 . . . . 10 T H3' . 16225 1 103 . 1 1 10 10 DT H4' H 1 3.962 0.005 . 1 . . . . 10 T H4' . 16225 1 104 . 1 1 10 10 DT H5' H 1 4.049 0.003 . 1 . . . . 10 T H5' . 16225 1 105 . 1 1 10 10 DT H6 H 1 7.151 0.003 . 1 . . . . 10 T H6 . 16225 1 106 . 1 1 10 10 DT H71 H 1 1.569 0.002 . 1 . . . . 10 T H7 . 16225 1 107 . 1 1 10 10 DT H72 H 1 1.569 0.002 . 1 . . . . 10 T H7 . 16225 1 108 . 1 1 10 10 DT H73 H 1 1.569 0.002 . 1 . . . . 10 T H7 . 16225 1 109 . 1 1 11 11 DG H1 H 1 12.524 0.011 . 1 . . . . 11 G H1 . 16225 1 110 . 1 1 11 11 DG H1' H 1 5.925 0.003 . 1 . . . . 11 G H1' . 16225 1 111 . 1 1 11 11 DG H2'' H 1 2.552 0.002 . 1 . . . . 11 G H2'' . 16225 1 112 . 1 1 11 11 DG H3' H 1 4.840 0.003 . 1 . . . . 11 G H3' . 16225 1 113 . 1 1 11 11 DG H4' H 1 4.235 0.003 . 1 . . . . 11 G H4' . 16225 1 114 . 1 1 11 11 DG H5' H 1 3.971 0.003 . 1 . . . . 11 G H5' . 16225 1 115 . 1 1 11 11 DG H8 H 1 7.805 0.003 . 1 . . . . 11 G H8 . 16225 1 116 . 1 1 11 11 DG H22 H 1 6.522 0.012 . 1 . . . . 11 G H22 . 16225 1 117 . 1 1 11 11 DG P P 31 1.355 0.000 . 1 . . . . 11 G P . 16225 1 118 . 1 1 12 12 DT H1' H 1 6.087 0.003 . 1 . . . . 12 T H1' . 16225 1 119 . 1 1 12 12 DT H2'' H 1 2.101 0.003 . 1 . . . . 12 T H2'' . 16225 1 120 . 1 1 12 12 DT H3' H 1 4.387 0.003 . 1 . . . . 12 T H3' . 16225 1 121 . 1 1 12 12 DT H4' H 1 3.933 0.002 . 1 . . . . 12 T H4' . 16225 1 122 . 1 1 12 12 DT H5' H 1 3.962 0.002 . 1 . . . . 12 T H5' . 16225 1 123 . 1 1 12 12 DT H6 H 1 7.292 0.003 . 1 . . . . 12 T H6 . 16225 1 124 . 1 1 12 12 DT H71 H 1 1.502 0.002 . 1 . . . . 12 T H7 . 16225 1 125 . 1 1 12 12 DT H72 H 1 1.502 0.002 . 1 . . . . 12 T H7 . 16225 1 126 . 1 1 12 12 DT H73 H 1 1.502 0.002 . 1 . . . . 12 T H7 . 16225 1 127 . 2 2 1 1 DA H1' H 1 6.016 0.002 . 1 . . . . 13 A H1' . 16225 1 128 . 2 2 1 1 DA H2' H 1 2.423 0.004 . 1 . . . . 13 A H2' . 16225 1 129 . 2 2 1 1 DA H2'' H 1 2.575 0.003 . 1 . . . . 13 A H2'' . 16225 1 130 . 2 2 1 1 DA H3' H 1 4.663 0.003 . 1 . . . . 13 A H3' . 16225 1 131 . 2 2 1 1 DA H4' H 1 4.072 0.003 . 1 . . . . 13 A H4' . 16225 1 132 . 2 2 1 1 DA H5' H 1 3.550 0.003 . 1 . . . . 13 A H5' . 16225 1 133 . 2 2 1 1 DA H5'' H 1 3.588 0.000 . 1 . . . . 13 A H5'' . 16225 1 134 . 2 2 1 1 DA H8 H 1 8.007 0.003 . 1 . . . . 13 A H8 . 16225 1 135 . 2 2 1 1 DA P P 31 1.503 0.000 . 1 . . . . 13 A P . 16225 1 136 . 2 2 2 2 DC H1' H 1 5.036 0.003 . 1 . . . . 14 C H1' . 16225 1 137 . 2 2 2 2 DC H2' H 1 1.844 0.002 . 1 . . . . 14 C H2' . 16225 1 138 . 2 2 2 2 DC H2'' H 1 2.085 0.002 . 1 . . . . 14 C H2'' . 16225 1 139 . 2 2 2 2 DC H3' H 1 4.619 0.003 . 1 . . . . 14 C H3' . 16225 1 140 . 2 2 2 2 DC H4' H 1 3.934 0.004 . 1 . . . . 14 C H4' . 16225 1 141 . 2 2 2 2 DC H5 H 1 5.368 0.003 . 1 . . . . 14 C H5 . 16225 1 142 . 2 2 2 2 DC H5' H 1 3.922 0.006 . 1 . . . . 14 C H5' . 16225 1 143 . 2 2 2 2 DC H6 H 1 7.254 0.003 . 1 . . . . 14 C H6 . 16225 1 144 . 2 2 2 2 DC H42 H 1 8.190 0.009 . 1 . . . . 14 C H42 . 16225 1 145 . 2 2 2 2 DC P P 31 1.012 0.000 . 1 . . . . 14 C P . 16225 1 146 . 2 2 3 3 DA H1' H 1 5.605 0.003 . 1 . . . . 15 A H1' . 16225 1 147 . 2 2 3 3 DA H2 H 1 7.138 0.011 . 1 . . . . 15 A H2 . 16225 1 148 . 2 2 3 3 DA H2' H 1 2.566 0.003 . 1 . . . . 15 A H2' . 16225 1 149 . 2 2 3 3 DA H2'' H 1 2.667 0.003 . 1 . . . . 15 A H2'' . 16225 1 150 . 2 2 3 3 DA H3' H 1 4.877 0.003 . 1 . . . . 15 A H3' . 16225 1 151 . 2 2 3 3 DA H4' H 1 4.195 0.003 . 1 . . . . 15 A H4' . 16225 1 152 . 2 2 3 3 DA H5' H 1 3.838 0.002 . 1 . . . . 15 A H5' . 16225 1 153 . 2 2 3 3 DA H5'' H 1 3.947 0.004 . 1 . . . . 15 A H5'' . 16225 1 154 . 2 2 3 3 DA H8 H 1 8.047 0.003 . 1 . . . . 15 A H8 . 16225 1 155 . 2 2 3 3 DA H62 H 1 6.042 0.000 . 1 . . . . 15 A H62 . 16225 1 156 . 2 2 3 3 DA P P 31 1.495 0.000 . 1 . . . . 15 A P . 16225 1 157 . 2 2 4 4 DA H1' H 1 5.706 0.003 . 1 . . . . 16 A H1' . 16225 1 158 . 2 2 4 4 DA H2 H 1 7.061 0.007 . 1 . . . . 16 A H2 . 16225 1 159 . 2 2 4 4 DA H2' H 1 2.460 0.003 . 1 . . . . 16 A H2' . 16225 1 160 . 2 2 4 4 DA H2'' H 1 2.652 0.004 . 1 . . . . 16 A H2'' . 16225 1 161 . 2 2 4 4 DA H3' H 1 4.889 0.003 . 1 . . . . 16 A H3' . 16225 1 162 . 2 2 4 4 DA H4' H 1 4.259 0.003 . 1 . . . . 16 A H4' . 16225 1 163 . 2 2 4 4 DA H5' H 1 4.029 0.000 . 1 . . . . 16 A H5' . 16225 1 164 . 2 2 4 4 DA H5'' H 1 4.050 0.000 . 1 . . . . 16 A H5'' . 16225 1 165 . 2 2 4 4 DA H8 H 1 7.939 0.003 . 1 . . . . 16 A H8 . 16225 1 166 . 2 2 4 4 DA H61 H 1 7.303 0.003 . 1 . . . . 16 A H61 . 16225 1 167 . 2 2 4 4 DA H62 H 1 5.864 0.005 . 1 . . . . 16 A H62 . 16225 1 168 . 2 2 4 4 DA P P 31 1.434 0.000 . 1 . . . . 16 A P . 16225 1 169 . 2 2 5 5 DA H1' H 1 5.862 0.002 . 1 . . . . 17 A H1' . 16225 1 170 . 2 2 5 5 DA H2 H 1 7.444 0.010 . 1 . . . . 17 A H2 . 16225 1 171 . 2 2 5 5 DA H2' H 1 2.363 0.002 . 1 . . . . 17 A H2' . 16225 1 172 . 2 2 5 5 DA H2'' H 1 2.625 0.005 . 1 . . . . 17 A H2'' . 16225 1 173 . 2 2 5 5 DA H3' H 1 4.811 0.003 . 1 . . . . 17 A H3' . 16225 1 174 . 2 2 5 5 DA H4' H 1 4.247 0.003 . 1 . . . . 17 A H4' . 16225 1 175 . 2 2 5 5 DA H5' H 1 4.068 0.003 . 1 . . . . 17 A H5' . 16225 1 176 . 2 2 5 5 DA H8 H 1 7.862 0.003 . 1 . . . . 17 A H8 . 16225 1 177 . 2 2 5 5 DA H62 H 1 5.702 0.000 . 1 . . . . 17 A H62 . 16225 1 178 . 2 2 5 5 DA P P 31 1.358 0.000 . 1 . . . . 17 A P . 16225 1 179 . 2 2 6 6 DC H1' H 1 5.533 0.003 . 1 . . . . 18 C H1' . 16225 1 180 . 2 2 6 6 DC H2' H 1 1.706 0.002 . 1 . . . . 18 C H2' . 16225 1 181 . 2 2 6 6 DC H2'' H 1 2.194 0.004 . 1 . . . . 18 C H2'' . 16225 1 182 . 2 2 6 6 DC H3' H 1 4.571 0.003 . 1 . . . . 18 C H3' . 16225 1 183 . 2 2 6 6 DC H4' H 1 3.998 0.004 . 1 . . . . 18 C H4' . 16225 1 184 . 2 2 6 6 DC H5 H 1 5.016 0.003 . 1 . . . . 18 C H5 . 16225 1 185 . 2 2 6 6 DC H5' H 1 3.949 0.005 . 1 . . . . 18 C H5' . 16225 1 186 . 2 2 6 6 DC H5'' H 1 4.067 0.003 . 1 . . . . 18 C H5'' . 16225 1 187 . 2 2 6 6 DC H6 H 1 6.986 0.003 . 1 . . . . 18 C H6 . 16225 1 188 . 2 2 6 6 DC H41 H 1 7.029 0.000 . 1 . . . . 18 C H41 . 16225 1 189 . 2 2 6 6 DC H42 H 1 7.833 0.008 . 1 . . . . 18 C H42 . 16225 1 190 . 2 2 6 6 DC P P 31 1.543 0.000 . 1 . . . . 18 C P . 16225 1 191 . 2 2 7 7 DA H1' H 1 5.865 0.003 . 1 . . . . 19 A H1' . 16225 1 192 . 2 2 7 7 DA H2 H 1 7.455 0.002 . 1 . . . . 19 A H2 . 16225 1 193 . 2 2 7 7 DA H2' H 1 2.262 0.002 . 1 . . . . 19 A H2' . 16225 1 194 . 2 2 7 7 DA H2'' H 1 2.514 0.003 . 1 . . . . 19 A H2'' . 16225 1 195 . 2 2 7 7 DA H3' H 1 4.736 0.003 . 1 . . . . 19 A H3' . 16225 1 196 . 2 2 7 7 DA H4' H 1 4.105 0.004 . 1 . . . . 19 A H4' . 16225 1 197 . 2 2 7 7 DA H5' H 1 3.892 0.006 . 1 . . . . 19 A H5' . 16225 1 198 . 2 2 7 7 DA H5'' H 1 3.943 0.000 . 1 . . . . 19 A H5'' . 16225 1 199 . 2 2 7 7 DA H8 H 1 7.833 0.003 . 1 . . . . 19 A H8 . 16225 1 200 . 2 2 7 7 DA H62 H 1 6.146 0.000 . 1 . . . . 19 A H62 . 16225 1 201 . 2 2 7 7 DA P P 31 1.415 0.000 . 1 . . . . 19 A P . 16225 1 202 . 2 2 8 8 DC H1' H 1 5.380 0.003 . 1 . . . . 20 C H1' . 16225 1 203 . 2 2 8 8 DC H2' H 1 1.862 0.004 . 1 . . . . 20 C H2' . 16225 1 204 . 2 2 8 8 DC H2'' H 1 2.156 0.003 . 1 . . . . 20 C H2'' . 16225 1 205 . 2 2 8 8 DC H3' H 1 4.640 0.003 . 1 . . . . 20 C H3' . 16225 1 206 . 2 2 8 8 DC H4' H 1 3.974 0.003 . 1 . . . . 20 C H4' . 16225 1 207 . 2 2 8 8 DC H5 H 1 5.096 0.003 . 1 . . . . 20 C H5 . 16225 1 208 . 2 2 8 8 DC H5' H 1 3.916 0.003 . 1 . . . . 20 C H5' . 16225 1 209 . 2 2 8 8 DC H6 H 1 7.124 0.003 . 1 . . . . 20 C H6 . 16225 1 210 . 2 2 8 8 DC P P 31 1.209 0.000 . 1 . . . . 20 C P . 16225 1 211 . 2 2 9 9 DG H1 H 1 12.680 0.030 . 1 . . . . 21 G H1 . 16225 1 212 . 2 2 9 9 DG H1' H 1 5.718 0.003 . 1 . . . . 21 G H1' . 16225 1 213 . 2 2 9 9 DG H2' H 1 2.433 0.003 . 1 . . . . 21 G H2' . 16225 1 214 . 2 2 9 9 DG H2'' H 1 2.542 0.003 . 1 . . . . 21 G H2'' . 16225 1 215 . 2 2 9 9 DG H3' H 1 4.799 0.003 . 1 . . . . 21 G H3' . 16225 1 216 . 2 2 9 9 DG H4' H 1 4.180 0.006 . 1 . . . . 21 G H4' . 16225 1 217 . 2 2 9 9 DG H5' H 1 3.860 0.002 . 1 . . . . 21 G H5' . 16225 1 218 . 2 2 9 9 DG H5'' H 1 3.950 0.002 . 1 . . . . 21 G H5'' . 16225 1 219 . 2 2 9 9 DG H8 H 1 7.654 0.003 . 1 . . . . 21 G H8 . 16225 1 220 . 2 2 9 9 DG H22 H 1 6.300 0.008 . 1 . . . . 21 G H22 . 16225 1 221 . 2 2 9 9 DG P P 31 1.241 0.000 . 1 . . . . 21 G P . 16225 1 222 . 2 2 10 10 DC H1' H 1 5.501 0.003 . 1 . . . . 22 C H1' . 16225 1 223 . 2 2 10 10 DC H2' H 1 1.854 0.002 . 1 . . . . 22 C H2' . 16225 1 224 . 2 2 10 10 DC H2'' H 1 2.216 0.003 . 1 . . . . 22 C H2'' . 16225 1 225 . 2 2 10 10 DC H3' H 1 4.667 0.003 . 1 . . . . 22 C H3' . 16225 1 226 . 2 2 10 10 DC H4' H 1 4.004 0.003 . 1 . . . . 22 C H4' . 16225 1 227 . 2 2 10 10 DC H5 H 1 5.235 0.004 . 1 . . . . 22 C H5 . 16225 1 228 . 2 2 10 10 DC H5' H 1 4.033 0.003 . 1 . . . . 22 C H5' . 16225 1 229 . 2 2 10 10 DC H6 H 1 7.189 0.003 . 1 . . . . 22 C H6 . 16225 1 230 . 2 2 10 10 DC H42 H 1 8.245 0.008 . 1 . . . . 22 C H42 . 16225 1 231 . 2 2 10 10 DC P P 31 1.635 0.000 . 1 . . . . 22 C P . 16225 1 232 . 2 2 11 11 DA H1' H 1 6.106 0.003 . 1 . . . . 23 A H1' . 16225 1 233 . 2 2 11 11 DA H2 H 1 7.718 0.008 . 1 . . . . 23 A H2 . 16225 1 234 . 2 2 11 11 DA H2' H 1 2.527 0.004 . 1 . . . . 23 A H2' . 16225 1 235 . 2 2 11 11 DA H2'' H 1 2.709 0.003 . 1 . . . . 23 A H2'' . 16225 1 236 . 2 2 11 11 DA H3' H 1 4.849 0.003 . 1 . . . . 23 A H3' . 16225 1 237 . 2 2 11 11 DA H4' H 1 4.232 0.003 . 1 . . . . 23 A H4' . 16225 1 238 . 2 2 11 11 DA H5' H 1 3.952 0.002 . 1 . . . . 23 A H5' . 16225 1 239 . 2 2 11 11 DA H5'' H 1 3.994 0.002 . 1 . . . . 23 A H5'' . 16225 1 240 . 2 2 11 11 DA H8 H 1 8.104 0.003 . 1 . . . . 23 A H8 . 16225 1 241 . 2 2 11 11 DA H61 H 1 8.014 0.000 . 1 . . . . 23 A H61 . 16225 1 242 . 2 2 11 11 DA P P 31 1.412 0.000 . 1 . . . . 23 A P . 16225 1 243 . 2 2 12 12 DC H1' H 1 5.945 0.003 . 1 . . . . 24 C H1' . 16225 1 244 . 2 2 12 12 DC H2' H 1 1.941 0.004 . 1 . . . . 24 C H2' . 16225 1 245 . 2 2 12 12 DC H2'' H 1 1.988 0.003 . 1 . . . . 24 C H2'' . 16225 1 246 . 2 2 12 12 DC H3' H 1 4.315 0.003 . 1 . . . . 24 C H3' . 16225 1 247 . 2 2 12 12 DC H4' H 1 3.869 0.003 . 1 . . . . 24 C H4' . 16225 1 248 . 2 2 12 12 DC H5 H 1 5.307 0.002 . 1 . . . . 24 C H5 . 16225 1 249 . 2 2 12 12 DC H5' H 1 4.096 0.003 . 1 . . . . 24 C H5' . 16225 1 250 . 2 2 12 12 DC H5'' H 1 3.906 0.002 . 1 . . . . 24 C H5'' . 16225 1 251 . 2 2 12 12 DC H6 H 1 7.248 0.003 . 1 . . . . 24 C H6 . 16225 1 stop_ save_