################################### # 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 52888 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name exchangeables _Assigned_chem_shift_list.Sample_condition_list_ID 3 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_3 _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 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err 0.1 _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-15N SOFAST-HMQC' . . . 52888 1 2 '2D NOESY with watergate and flip-back pulse' . . . 52888 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 52888 1 2 $software_2 . . 52888 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 3 3 U H3 H 1 13.315 0.02 . 1 . . . . . 3 U H3 . 52888 1 2 . 1 . 1 3 3 U N3 N 15 161.786 0.1 . 1 . . . . . 3 U N3 . 52888 1 3 . 1 . 1 4 4 G H1 H 1 11.691 0.02 . 1 . . . . . 4 G H1 . 52888 1 4 . 1 . 1 4 4 G N1 N 15 146.337 0.1 . 1 . . . . . 4 G N1 . 52888 1 5 . 1 . 1 5 5 G H1 H 1 12.175 0.02 . 1 . . . . . 5 G H1 . 52888 1 6 . 1 . 1 5 5 G N1 N 15 146.987 0.1 . 1 . . . . . 5 G N1 . 52888 1 7 . 1 . 1 11 11 U H3 H 1 12.990 0.02 . 1 . . . . . 11 U H3 . 52888 1 8 . 1 . 1 11 11 U N3 N 15 161.179 0.1 . 1 . . . . . 11 U N3 . 52888 1 9 . 1 . 1 14 14 U H3 H 1 13.819 0.02 . 1 . . . . . 14 U H3 . 52888 1 10 . 1 . 1 14 14 U N3 N 15 162.297 0.1 . 1 . . . . . 14 U N3 . 52888 1 11 . 1 . 1 17 17 G H1 H 1 11.662 0.02 . 1 . . . . . 17 G H1 . 52888 1 12 . 1 . 1 17 17 G N1 N 15 145.902 0.1 . 1 . . . . . 17 G N1 . 52888 1 13 . 1 . 1 19 19 G H1 H 1 12.942 0.02 . 1 . . . . . 19 G H1 . 52888 1 14 . 1 . 1 19 19 G N1 N 15 147.214 0.1 . 1 . . . . . 19 G N1 . 52888 1 15 . 2 . 2 3 3 U H3 H 1 13.859 0.02 . 1 . . . . . 23 U H3 . 52888 1 16 . 2 . 2 3 3 U N3 N 15 162.383 0.1 . 1 . . . . . 23 U N3 . 52888 1 17 . 2 . 2 5 5 G H1 H 1 11.914 0.02 . 1 . . . . . 25 G H1 . 52888 1 18 . 2 . 2 5 5 G N1 N 15 146.504 0.1 . 1 . . . . . 25 G N1 . 52888 1 19 . 2 . 2 6 6 G H1 H 1 11.997 0.02 . 1 . . . . . 26 G H1 . 52888 1 20 . 2 . 2 6 6 G N1 N 15 146.889 0.1 . 1 . . . . . 26 G N1 . 52888 1 21 . 2 . 2 8 8 G H1 H 1 13.089 0.02 . 1 . . . . . 28 G H1 . 52888 1 22 . 2 . 2 8 8 G N1 N 15 147.935 0.1 . 1 . . . . . 28 G N1 . 52888 1 23 . 2 . 2 9 9 U H3 H 1 13.254 0.02 . 1 . . . . . 29 U H3 . 52888 1 24 . 2 . 2 9 9 U N3 N 15 161.609 0.1 . 1 . . . . . 29 U N3 . 52888 1 25 . 2 . 2 11 11 U H3 H 1 13.733 0.02 . 1 . . . . . 31 U H3 . 52888 1 26 . 2 . 2 11 11 U N3 N 15 161.923 0.1 . 1 . . . . . 31 U N3 . 52888 1 27 . 2 . 2 12 12 U H3 H 1 13.573 0.02 . 1 . . . . . 32 U H3 . 52888 1 28 . 2 . 2 12 12 U N3 N 15 162.382 0.1 . 1 . . . . . 32 U N3 . 52888 1 29 . 2 . 2 13 13 U H3 H 1 12.889 0.02 . 1 . . . . . 33 U H3 . 52888 1 30 . 2 . 2 13 13 U N3 N 15 162.007 0.1 . 1 . . . . . 33 U N3 . 52888 1 31 . 2 . 2 14 14 G H1 H 1 12.250 0.02 . 1 . . . . . 34 G H1 . 52888 1 32 . 2 . 2 14 14 G N1 N 15 147.176 0.1 . 1 . . . . . 34 G N1 . 52888 1 33 . 2 . 2 15 15 U H3 H 1 14.008 0.02 . 1 . . . . . 35 U H3 . 52888 1 34 . 2 . 2 15 15 U N3 N 15 162.426 0.1 . 1 . . . . . 35 U N3 . 52888 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_assigned_chemical_shifts_2 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_2 _Assigned_chem_shift_list.Entry_ID 52888 _Assigned_chem_shift_list.ID 2 _Assigned_chem_shift_list.Name non-exchangeables _Assigned_chem_shift_list.Sample_condition_list_ID 2 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_2 _Assigned_chem_shift_list.Chem_shift_reference_ID 2 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_2 _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _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 3 '2D 1H-1H NOESY with excitation sculpting using gradients' . . . 52888 2 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 52888 2 2 $software_2 . . 52888 2 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 A H1' H 1 5.896 0.02 . 1 . . . . . 1 A H1' . 52888 2 2 . 1 . 1 1 1 A H2 H 1 8.032 0.02 . 1 . . . . . 1 A H2 . 52888 2 3 . 1 . 1 1 1 A H2' H 1 4.776 0.02 . 1 . . . . . 1 A H2' . 52888 2 4 . 1 . 1 1 1 A H8 H 1 8.372 0.02 . 1 . . . . . 1 A H8 . 52888 2 5 . 1 . 1 2 2 C H1' H 1 5.399 0.02 . 1 . . . . . 2 C H1' . 52888 2 6 . 1 . 1 2 2 C H5 H 1 5.268 0.02 . 1 . . . . . 2 C H5 . 52888 2 7 . 1 . 1 2 2 C H6 H 1 7.623 0.02 . 1 . . . . . 2 C H6 . 52888 2 8 . 1 . 1 3 3 U H1' H 1 5.504 0.02 . 1 . . . . . 3 U H1' . 52888 2 9 . 1 . 1 3 3 U H5 H 1 5.316 0.02 . 1 . . . . . 3 U H5 . 52888 2 10 . 1 . 1 3 3 U H6 H 1 7.795 0.02 . 1 . . . . . 3 U H6 . 52888 2 11 . 1 . 1 4 4 G H1' H 1 5.706 0.02 . 1 . . . . . 4 G H1' . 52888 2 12 . 1 . 1 4 4 G H8 H 1 7.583 0.02 . 1 . . . . . 4 G H8 . 52888 2 13 . 1 . 1 5 5 G H1' H 1 5.512 0.02 . 1 . . . . . 5 G H1' . 52888 2 14 . 1 . 1 5 5 G H8 H 1 7.092 0.02 . 1 . . . . . 5 G H8 . 52888 2 15 . 1 . 1 6 6 A H1' H 1 5.831 0.02 . 1 . . . . . 6 A H1' . 52888 2 16 . 1 . 1 6 6 A H2 H 1 7.585 0.02 . 1 . . . . . 6 A H2 . 52888 2 17 . 1 . 1 6 6 A H8 H 1 7.659 0.02 . 1 . . . . . 6 A H8 . 52888 2 18 . 1 . 1 7 7 C H1' H 1 5.213 0.02 . 1 . . . . . 7 C H1' . 52888 2 19 . 1 . 1 7 7 C H5 H 1 5.075 0.02 . 1 . . . . . 7 C H5 . 52888 2 20 . 1 . 1 7 7 C H6 H 1 7.259 0.02 . 1 . . . . . 7 C H6 . 52888 2 21 . 1 . 1 8 8 A H1' H 1 5.757 0.02 . 1 . . . . . 8 A H1' . 52888 2 22 . 1 . 1 8 8 A H2 H 1 6.560 0.02 . 1 . . . . . 8 A H2 . 52888 2 23 . 1 . 1 8 8 A H8 H 1 7.829 0.02 . 1 . . . . . 8 A H8 . 52888 2 24 . 1 . 1 9 9 A H1' H 1 5.689 0.02 . 1 . . . . . 9 A H1' . 52888 2 25 . 1 . 1 9 9 A H2 H 1 7.018 0.02 . 1 . . . . . 9 A H2 . 52888 2 26 . 1 . 1 9 9 A H8 H 1 7.613 0.02 . 1 . . . . . 9 A H8 . 52888 2 27 . 1 . 1 10 10 A H1' H 1 5.764 0.02 . 1 . . . . . 10 A H1' . 52888 2 28 . 1 . 1 10 10 A H2 H 1 7.557 0.02 . 1 . . . . . 10 A H2 . 52888 2 29 . 1 . 1 10 10 A H8 H 1 7.660 0.02 . 1 . . . . . 10 A H8 . 52888 2 30 . 1 . 1 11 11 U H1' H 1 5.325 0.02 . 1 . . . . . 11 U H1' . 52888 2 31 . 1 . 1 11 11 U H5 H 1 4.937 0.02 . 1 . . . . . 11 U H5 . 52888 2 32 . 1 . 1 11 11 U H6 H 1 7.470 0.02 . 1 . . . . . 11 U H6 . 52888 2 33 . 1 . 1 12 12 A H1' H 1 5.915 0.02 . 1 . . . . . 12 A H1' . 52888 2 34 . 1 . 1 12 12 A H2 H 1 7.066 0.02 . 1 . . . . . 12 A H2 . 52888 2 35 . 1 . 1 12 12 A H8 H 1 8.028 0.02 . 1 . . . . . 12 A H8 . 52888 2 36 . 1 . 1 13 13 C H1' H 1 5.279 0.02 . 1 . . . . . 13 C H1' . 52888 2 37 . 1 . 1 13 13 C H5 H 1 5.106 0.02 . 1 . . . . . 13 C H5 . 52888 2 38 . 1 . 1 13 13 C H6 H 1 7.442 0.02 . 1 . . . . . 13 C H6 . 52888 2 39 . 1 . 1 14 14 U H1' H 1 5.444 0.02 . 1 . . . . . 14 U H1' . 52888 2 40 . 1 . 1 14 14 U H5 H 1 5.225 0.02 . 1 . . . . . 14 U H5 . 52888 2 41 . 1 . 1 14 14 U H6 H 1 7.797 0.02 . 1 . . . . . 14 U H6 . 52888 2 42 . 1 . 1 15 15 C H1' H 1 5.465 0.02 . 1 . . . . . 15 C H1' . 52888 2 43 . 1 . 1 15 15 C H5 H 1 5.532 0.02 . 1 . . . . . 15 C H5 . 52888 2 44 . 1 . 1 15 15 C H6 H 1 7.782 0.02 . 1 . . . . . 15 C H6 . 52888 2 45 . 1 . 1 16 16 C H1' H 1 5.334 0.02 . 1 . . . . . 16 C H1' . 52888 2 46 . 1 . 1 16 16 C H5 H 1 5.360 0.02 . 1 . . . . . 16 C H5 . 52888 2 47 . 1 . 1 16 16 C H6 H 1 7.619 0.02 . 1 . . . . . 16 C H6 . 52888 2 48 . 1 . 1 17 17 G H1' H 1 5.555 0.02 . 1 . . . . . 17 G H1' . 52888 2 49 . 1 . 1 17 17 G H8 H 1 7.453 0.02 . 1 . . . . . 17 G H8 . 52888 2 50 . 1 . 1 18 18 A H1' H 1 5.846 0.02 . 1 . . . . . 18 A H1' . 52888 2 51 . 1 . 1 18 18 A H2 H 1 7.369 0.02 . 1 . . . . . 18 A H2 . 52888 2 52 . 1 . 1 18 18 A H8 H 1 7.730 0.02 . 1 . . . . . 18 A H8 . 52888 2 53 . 1 . 1 19 19 G H1' H 1 5.448 0.02 . 1 . . . . . 19 G H1' . 52888 2 54 . 1 . 1 19 19 G H8 H 1 6.946 0.02 . 1 . . . . . 19 G H8 . 52888 2 55 . 1 . 1 20 20 G H1' H 1 5.765 0.02 . 1 . . . . . 20 G H1' . 52888 2 56 . 1 . 1 20 20 G H8 H 1 7.181 0.02 . 1 . . . . . 20 G H8 . 52888 2 57 . 2 . 2 1 1 C H1' H 1 5.523 0.02 . 1 . . . . . 21 C H1' . 52888 2 58 . 2 . 2 1 1 C H5 H 1 5.982 0.02 . 1 . . . . . 21 C H5 . 52888 2 59 . 2 . 2 1 1 C H6 H 1 8.097 0.02 . 1 . . . . . 21 C H6 . 52888 2 60 . 2 . 2 2 2 C H1' H 1 5.550 0.02 . 1 . . . . . 22 C H1' . 52888 2 61 . 2 . 2 2 2 C H5 H 1 5.572 0.02 . 1 . . . . . 22 C H5 . 52888 2 62 . 2 . 2 2 2 C H6 H 1 7.961 0.02 . 1 . . . . . 22 C H6 . 52888 2 63 . 2 . 2 3 3 U H1' H 1 5.473 0.02 . 1 . . . . . 23 U H1' . 52888 2 64 . 2 . 2 3 3 U H5 H 1 5.373 0.02 . 1 . . . . . 23 U H5 . 52888 2 65 . 2 . 2 3 3 U H6 H 1 7.862 0.02 . 1 . . . . . 23 U H6 . 52888 2 66 . 2 . 2 4 4 C H1' H 1 5.507 0.02 . 1 . . . . . 24 C H1' . 52888 2 67 . 2 . 2 4 4 C H5 H 1 5.567 0.02 . 1 . . . . . 24 C H5 . 52888 2 68 . 2 . 2 4 4 C H6 H 1 7.757 0.02 . 1 . . . . . 24 C H6 . 52888 2 69 . 2 . 2 5 5 G H1' H 1 5.557 0.02 . 1 . . . . . 25 G H1' . 52888 2 70 . 2 . 2 5 5 G H8 H 1 7.397 0.02 . 1 . . . . . 25 G H8 . 52888 2 71 . 2 . 2 6 6 G H1' H 1 5.587 0.02 . 1 . . . . . 26 G H1' . 52888 2 72 . 2 . 2 6 6 G H8 H 1 7.070 0.02 . 1 . . . . . 26 G H8 . 52888 2 73 . 2 . 2 7 7 A H1' H 1 5.846 0.02 . 1 . . . . . 27 A H1' . 52888 2 74 . 2 . 2 7 7 A H2 H 1 7.376 0.02 . 1 . . . . . 27 A H2 . 52888 2 75 . 2 . 2 7 7 A H8 H 1 7.549 0.02 . 1 . . . . . 27 A H8 . 52888 2 76 . 2 . 2 8 8 G H1' H 1 5.491 0.02 . 1 . . . . . 28 G H1' . 52888 2 77 . 2 . 2 8 8 G H8 H 1 7.009 0.02 . 1 . . . . . 28 G H8 . 52888 2 78 . 2 . 2 9 9 U H1' H 1 5.443 0.02 . 1 . . . . . 29 U H1' . 52888 2 79 . 2 . 2 9 9 U H5 H 1 4.993 0.02 . 1 . . . . . 29 U H5 . 52888 2 80 . 2 . 2 9 9 U H6 H 1 7.618 0.02 . 1 . . . . . 29 U H6 . 52888 2 81 . 2 . 2 10 10 A H1' H 1 5.912 0.02 . 1 . . . . . 30 A H1' . 52888 2 82 . 2 . 2 10 10 A H2 H 1 6.988 0.02 . 1 . . . . . 30 A H2 . 52888 2 83 . 2 . 2 10 10 A H8 H 1 8.048 0.02 . 1 . . . . . 30 A H8 . 52888 2 84 . 2 . 2 11 11 U H1' H 1 5.339 0.02 . 1 . . . . . 31 U H1' . 52888 2 85 . 2 . 2 11 11 U H5 H 1 4.930 0.02 . 1 . . . . . 31 U H5 . 52888 2 86 . 2 . 2 11 11 U H6 H 1 7.533 0.02 . 1 . . . . . 31 U H6 . 52888 2 87 . 2 . 2 12 12 U H1' H 1 5.528 0.02 . 1 . . . . . 32 U H1' . 52888 2 88 . 2 . 2 12 12 U H5 H 1 5.404 0.02 . 1 . . . . . 32 U H5 . 52888 2 89 . 2 . 2 12 12 U H6 H 1 7.855 0.02 . 1 . . . . . 32 U H6 . 52888 2 90 . 2 . 2 13 13 U H1' H 1 5.505 0.02 . 1 . . . . . 33 U H1' . 52888 2 91 . 2 . 2 13 13 U H5 H 1 5.465 0.02 . 1 . . . . . 33 U H5 . 52888 2 92 . 2 . 2 13 13 U H6 H 1 7.847 0.02 . 1 . . . . . 33 U H6 . 52888 2 93 . 2 . 2 14 14 G H1' H 1 5.643 0.02 . 1 . . . . . 34 G H1' . 52888 2 94 . 2 . 2 14 14 G H8 H 1 7.660 0.02 . 1 . . . . . 34 G H8 . 52888 2 95 . 2 . 2 15 15 U H1' H 1 5.404 0.02 . 1 . . . . . 35 U H1' . 52888 2 96 . 2 . 2 15 15 U H5 H 1 4.966 0.02 . 1 . . . . . 35 U H5 . 52888 2 97 . 2 . 2 15 15 U H6 H 1 7.708 0.02 . 1 . . . . . 35 U H6 . 52888 2 98 . 2 . 2 16 16 C H1' H 1 5.443 0.02 . 1 . . . . . 36 C H1' . 52888 2 99 . 2 . 2 16 16 C H5 H 1 5.523 0.02 . 1 . . . . . 36 C H5 . 52888 2 100 . 2 . 2 16 16 C H6 H 1 7.775 0.02 . 1 . . . . . 36 C H6 . 52888 2 101 . 2 . 2 17 17 C H1' H 1 5.290 0.02 . 1 . . . . . 37 C H1' . 52888 2 102 . 2 . 2 17 17 C H5 H 1 5.411 0.02 . 1 . . . . . 37 C H5 . 52888 2 103 . 2 . 2 17 17 C H6 H 1 7.647 0.02 . 1 . . . . . 37 C H6 . 52888 2 104 . 2 . 2 18 18 A H1' H 1 5.787 0.02 . 1 . . . . . 38 A H1' . 52888 2 105 . 2 . 2 18 18 A H2 H 1 6.991 0.02 . 1 . . . . . 38 A H2 . 52888 2 106 . 2 . 2 18 18 A H8 H 1 7.923 0.02 . 1 . . . . . 38 A H8 . 52888 2 107 . 2 . 2 19 19 G H1' H 1 5.508 0.02 . 1 . . . . . 39 G H1' . 52888 2 108 . 2 . 2 19 19 G H8 H 1 7.118 0.02 . 1 . . . . . 39 G H8 . 52888 2 109 . 2 . 2 20 20 U H1' H 1 5.703 0.02 . 1 . . . . . 40 U H1' . 52888 2 110 . 2 . 2 20 20 U H5 H 1 5.079 0.02 . 1 . . . . . 40 U H5 . 52888 2 111 . 2 . 2 20 20 U H6 H 1 7.492 0.02 . 1 . . . . . 40 U H6 . 52888 2 stop_ save_