###################################
# 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 34312
_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 TOCSY' . . . 34312 1
2 '2D 1H-1H NOESY' . . . 34312 1
3 '2D 1H-13C HSQC aliphatic' . . . 34312 1
4 '2D 1H-13C HSQC aromatic' . . . 34312 1
5 '3D 1H-13C NOESY aliphatic' . . . 34312 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 A H1' H 1 5.806 0.020 . 1 . . . . A 1 A H1' . 34312 1
2 . 1 . 1 1 1 A H2 H 1 7.976 0.020 . 1 . . . . A 1 A H2 . 34312 1
3 . 1 . 1 1 1 A H2' H 1 4.644 0.020 . 1 . . . . A 1 A H2' . 34312 1
4 . 1 . 1 1 1 A H3' H 1 4.676 0.020 . 1 . . . . A 1 A H3' . 34312 1
5 . 1 . 1 1 1 A H4' H 1 4.254 0.020 . 1 . . . . A 1 A H4' . 34312 1
6 . 1 . 1 1 1 A H5' H 1 3.857 0.020 . 2 . . . . A 1 A H5' . 34312 1
7 . 1 . 1 1 1 A H5'' H 1 3.792 0.020 . 2 . . . . A 1 A H5'' . 34312 1
8 . 1 . 1 1 1 A H8 H 1 8.105 0.020 . 1 . . . . A 1 A H8 . 34312 1
9 . 1 . 1 1 1 A C1' C 13 90.942 0.3 . 1 . . . . A 1 A C1' . 34312 1
10 . 1 . 1 1 1 A C2 C 13 153.152 0.3 . 1 . . . . A 1 A C2 . 34312 1
11 . 1 . 1 1 1 A C2' C 13 76.118 0.3 . 1 . . . . A 1 A C2' . 34312 1
12 . 1 . 1 1 1 A C3' C 13 77.222 0.3 . 1 . . . . A 1 A C3' . 34312 1
13 . 1 . 1 1 1 A C4' C 13 87.066 0.3 . 1 . . . . A 1 A C4' . 34312 1
14 . 1 . 1 1 1 A C5' C 13 63.435 0.3 . 1 . . . . A 1 A C5' . 34312 1
15 . 1 . 1 1 1 A C8 C 13 143.117 0.3 . 1 . . . . A 1 A C8 . 34312 1
16 . 1 . 1 2 2 U H1' H 1 5.932 0.020 . 1 . . . . A 2 U H1' . 34312 1
17 . 1 . 1 2 2 U H2' H 1 4.482 0.020 . 1 . . . . A 2 U H2' . 34312 1
18 . 1 . 1 2 2 U H3' H 1 4.619 0.020 . 1 . . . . A 2 U H3' . 34312 1
19 . 1 . 1 2 2 U H4' H 1 4.477 0.020 . 1 . . . . A 2 U H4' . 34312 1
20 . 1 . 1 2 2 U H5 H 1 5.813 0.020 . 1 . . . . A 2 U H5 . 34312 1
21 . 1 . 1 2 2 U H5' H 1 4.297 0.020 . 2 . . . . A 2 U H5' . 34312 1
22 . 1 . 1 2 2 U H5'' H 1 4.208 0.020 . 2 . . . . A 2 U H5'' . 34312 1
23 . 1 . 1 2 2 U H6 H 1 7.884 0.020 . 1 . . . . A 2 U H6 . 34312 1
24 . 1 . 1 2 2 U C1' C 13 90.469 0.3 . 1 . . . . A 2 U C1' . 34312 1
25 . 1 . 1 2 2 U C2' C 13 75.298 0.3 . 1 . . . . A 2 U C2' . 34312 1
26 . 1 . 1 2 2 U C3' C 13 75.452 0.3 . 1 . . . . A 2 U C3' . 34312 1
27 . 1 . 1 2 2 U C4' C 13 81.798 0.3 . 1 . . . . A 2 U C4' . 34312 1
28 . 1 . 1 2 2 U C5 C 13 104.932 0.3 . 1 . . . . A 2 U C5 . 34312 1
29 . 1 . 1 2 2 U C5' C 13 67.294 0.3 . 1 . . . . A 2 U C5' . 34312 1
30 . 1 . 1 2 2 U C6 C 13 143.359 0.3 . 1 . . . . A 2 U C6 . 34312 1
31 . 1 . 1 3 3 A H1' H 1 5.750 0.020 . 1 . . . . A 3 A H1' . 34312 1
32 . 1 . 1 3 3 A H2 H 1 7.829 0.020 . 1 . . . . A 3 A H2 . 34312 1
33 . 1 . 1 3 3 A H2' H 1 4.671 0.020 . 1 . . . . A 3 A H2' . 34312 1
34 . 1 . 1 3 3 A H3' H 1 4.611 0.020 . 1 . . . . A 3 A H3' . 34312 1
35 . 1 . 1 3 3 A H4' H 1 4.529 0.020 . 1 . . . . A 3 A H4' . 34312 1
36 . 1 . 1 3 3 A H5' H 1 4.213 0.020 . 2 . . . . A 3 A H5' . 34312 1
37 . 1 . 1 3 3 A H5'' H 1 4.449 0.020 . 2 . . . . A 3 A H5'' . 34312 1
38 . 1 . 1 3 3 A H8 H 1 8.272 0.020 . 1 . . . . A 3 A H8 . 34312 1
39 . 1 . 1 3 3 A C1' C 13 92.464 0.3 . 1 . . . . A 3 A C1' . 34312 1
40 . 1 . 1 3 3 A C2 C 13 153.529 0.3 . 1 . . . . A 3 A C2 . 34312 1
41 . 1 . 1 3 3 A C2' C 13 75.240 0.3 . 1 . . . . A 3 A C2' . 34312 1
42 . 1 . 1 3 3 A C3' C 13 73.431 0.3 . 1 . . . . A 3 A C3' . 34312 1
43 . 1 . 1 3 3 A C4' C 13 82.110 0.3 . 1 . . . . A 3 A C4' . 34312 1
44 . 1 . 1 3 3 A C5' C 13 66.021 0.3 . 1 . . . . A 3 A C5' . 34312 1
45 . 1 . 1 3 3 A C8 C 13 140.564 0.3 . 1 . . . . A 3 A C8 . 34312 1
46 . 1 . 1 4 4 C H1' H 1 5.464 0.020 . 1 . . . . A 4 C H1' . 34312 1
47 . 1 . 1 4 4 C H2' H 1 4.649 0.020 . 1 . . . . A 4 C H2' . 34312 1
48 . 1 . 1 4 4 C H3' H 1 4.476 0.020 . 1 . . . . A 4 C H3' . 34312 1
49 . 1 . 1 4 4 C H4' H 1 4.425 0.020 . 1 . . . . A 4 C H4' . 34312 1
50 . 1 . 1 4 4 C H5 H 1 5.266 0.020 . 1 . . . . A 4 C H5 . 34312 1
51 . 1 . 1 4 4 C H5' H 1 4.402 0.020 . 2 . . . . A 4 C H5' . 34312 1
52 . 1 . 1 4 4 C H5'' H 1 4.090 0.020 . 2 . . . . A 4 C H5'' . 34312 1
53 . 1 . 1 4 4 C H6 H 1 7.520 0.020 . 1 . . . . A 4 C H6 . 34312 1
54 . 1 . 1 4 4 C C1' C 13 93.572 0.3 . 1 . . . . A 4 C C1' . 34312 1
55 . 1 . 1 4 4 C C2' C 13 74.864 0.3 . 1 . . . . A 4 C C2' . 34312 1
56 . 1 . 1 4 4 C C3' C 13 72.312 0.3 . 1 . . . . A 4 C C3' . 34312 1
57 . 1 . 1 4 4 C C4' C 13 82.972 0.3 . 1 . . . . A 4 C C4' . 34312 1
58 . 1 . 1 4 4 C C5 C 13 97.125 0.3 . 1 . . . . A 4 C C5 . 34312 1
59 . 1 . 1 4 4 C C5' C 13 65.382 0.3 . 1 . . . . A 4 C C5' . 34312 1
60 . 1 . 1 4 4 C C6 C 13 141.088 0.3 . 1 . . . . A 4 C C6 . 34312 1
61 . 1 . 1 5 5 PSU H1' H 1 4.810 0.020 . 1 . . . . A 5 PSU H1' . 34312 1
62 . 1 . 1 5 5 PSU H2' H 1 4.576 0.020 . 1 . . . . A 5 PSU H2' . 34312 1
63 . 1 . 1 5 5 PSU H3' H 1 4.487 0.020 . 1 . . . . A 5 PSU H3' . 34312 1
64 . 1 . 1 5 5 PSU H4' H 1 4.229 0.020 . 1 . . . . A 5 PSU H4' . 34312 1
65 . 1 . 1 5 5 PSU H5' H 1 4.425 0.020 . 2 . . . . A 5 PSU H5'' . 34312 1
66 . 1 . 1 5 5 PSU H5'' H 1 4.025 0.020 . 2 . . . . A 5 PSU H5'' . 34312 1
67 . 1 . 1 5 5 PSU H6 H 1 7.423 0.020 . 1 . . . . A 5 PSU H6 . 34312 1
68 . 1 . 1 5 5 PSU C1' C 13 82.842 0.3 . 1 . . . . A 5 PSU C1' . 34312 1
69 . 1 . 1 5 5 PSU C2' C 13 75.149 0.3 . 1 . . . . A 5 PSU C2' . 34312 1
70 . 1 . 1 5 5 PSU C3' C 13 74.570 0.3 . 1 . . . . A 5 PSU C3' . 34312 1
71 . 1 . 1 5 5 PSU C4' C 13 79.517 0.3 . 1 . . . . A 5 PSU C4' . 34312 1
72 . 1 . 1 5 5 PSU C5' C 13 65.464 0.3 . 1 . . . . A 5 PSU C5' . 34312 1
73 . 1 . 1 5 5 PSU C6 C 13 140.776 0.3 . 1 . . . . A 5 PSU C6 . 34312 1
74 . 1 . 1 5 5 PSU HN3 H 1 10.504 0.020 . 1 . . . . A 5 PSU HN3 . 34312 1
75 . 1 . 1 6 6 PSU H1' H 1 4.745 0.020 . 1 . . . . A 6 PSU H1' . 34312 1
76 . 1 . 1 6 6 PSU H2' H 1 4.594 0.020 . 1 . . . . A 6 PSU H2' . 34312 1
77 . 1 . 1 6 6 PSU H3' H 1 4.481 0.020 . 1 . . . . A 6 PSU H3' . 34312 1
78 . 1 . 1 6 6 PSU H4' H 1 4.272 0.020 . 1 . . . . A 6 PSU H4' . 34312 1
79 . 1 . 1 6 6 PSU H5' H 1 4.422 0.020 . 2 . . . . A 6 PSU H5'' . 34312 1
80 . 1 . 1 6 6 PSU H5'' H 1 4.054 0.020 . 2 . . . . A 6 PSU H5'' . 34312 1
81 . 1 . 1 6 6 PSU H6 H 1 7.492 0.020 . 1 . . . . A 6 PSU H6 . 34312 1
82 . 1 . 1 6 6 PSU C1' C 13 82.654 0.3 . 1 . . . . A 6 PSU C1' . 34312 1
83 . 1 . 1 6 6 PSU C2' C 13 75.259 0.3 . 1 . . . . A 6 PSU C2' . 34312 1
84 . 1 . 1 6 6 PSU C3' C 13 75.097 0.3 . 1 . . . . A 6 PSU C3' . 34312 1
85 . 1 . 1 6 6 PSU C4' C 13 79.517 0.3 . 1 . . . . A 6 PSU C4' . 34312 1
86 . 1 . 1 6 6 PSU C5' C 13 66.214 0.3 . 1 . . . . A 6 PSU C5' . 34312 1
87 . 1 . 1 6 6 PSU C6 C 13 140.819 0.3 . 1 . . . . A 6 PSU C6 . 34312 1
88 . 1 . 1 6 6 PSU HN3 H 1 10.784 0.020 . 1 . . . . A 6 PSU HN3 . 34312 1
89 . 1 . 1 7 7 A H1' H 1 5.918 0.020 . 1 . . . . A 7 A H1' . 34312 1
90 . 1 . 1 7 7 A H2 H 1 7.035 0.020 . 1 . . . . A 7 A H2 . 34312 1
91 . 1 . 1 7 7 A H2' H 1 4.649 0.020 . 1 . . . . A 7 A H2' . 34312 1
92 . 1 . 1 7 7 A H3' H 1 4.666 0.020 . 1 . . . . A 7 A H3' . 34312 1
93 . 1 . 1 7 7 A H4' H 1 4.398 0.020 . 1 . . . . A 7 A H4' . 34312 1
94 . 1 . 1 7 7 A H5' H 1 4.390 0.020 . 2 . . . . A 7 A H5' . 34312 1
95 . 1 . 1 7 7 A H5'' H 1 4.117 0.020 . 2 . . . . A 7 A H5'' . 34312 1
96 . 1 . 1 7 7 A H8 H 1 8.087 0.020 . 1 . . . . A 7 A H8 . 34312 1
97 . 1 . 1 7 7 A C1' C 13 92.531 0.3 . 1 . . . . A 7 A C1' . 34312 1
98 . 1 . 1 7 7 A C2 C 13 152.964 0.3 . 1 . . . . A 7 A C2 . 34312 1
99 . 1 . 1 7 7 A C2' C 13 72.130 0.3 . 1 . . . . A 7 A C2' . 34312 1
100 . 1 . 1 7 7 A C3' C 13 72.166 0.3 . 1 . . . . A 7 A C3' . 34312 1
101 . 1 . 1 7 7 A C4' C 13 83.080 0.3 . 1 . . . . A 7 A C4' . 34312 1
102 . 1 . 1 7 7 A C5' C 13 66.439 0.3 . 1 . . . . A 7 A C5' . 34312 1
103 . 1 . 1 7 7 A C8 C 13 139.566 0.3 . 1 . . . . A 7 A C8 . 34312 1
104 . 1 . 1 8 8 C H1' H 1 5.282 0.020 . 1 . . . . A 8 C H1' . 34312 1
105 . 1 . 1 8 8 C H2' H 1 4.458 0.020 . 1 . . . . A 8 C H2' . 34312 1
106 . 1 . 1 8 8 C H3' H 1 4.234 0.020 . 1 . . . . A 8 C H3' . 34312 1
107 . 1 . 1 8 8 C H4' H 1 4.327 0.020 . 1 . . . . A 8 C H4' . 34312 1
108 . 1 . 1 8 8 C H5 H 1 5.120 0.020 . 1 . . . . A 8 C H5 . 34312 1
109 . 1 . 1 8 8 C H5' H 1 4.009 0.020 . 2 . . . . A 8 C H5' . 34312 1
110 . 1 . 1 8 8 C H5'' H 1 4.504 0.020 . 2 . . . . A 8 C H5'' . 34312 1
111 . 1 . 1 8 8 C H6 H 1 7.321 0.020 . 1 . . . . A 8 C H6 . 34312 1
112 . 1 . 1 8 8 C C1' C 13 93.559 0.3 . 1 . . . . A 8 C C1' . 34312 1
113 . 1 . 1 8 8 C C2' C 13 75.310 0.3 . 1 . . . . A 8 C C2' . 34312 1
114 . 1 . 1 8 8 C C3' C 13 71.655 0.3 . 1 . . . . A 8 C C3' . 34312 1
115 . 1 . 1 8 8 C C4' C 13 81.570 0.3 . 1 . . . . A 8 C C4' . 34312 1
116 . 1 . 1 8 8 C C5 C 13 96.837 0.3 . 1 . . . . A 8 C C5 . 34312 1
117 . 1 . 1 8 8 C C5' C 13 64.342 0.3 . 1 . . . . A 8 C C5' . 34312 1
118 . 1 . 1 8 8 C C6 C 13 140.316 0.3 . 1 . . . . A 8 C C6 . 34312 1
119 . 1 . 1 9 9 C H1' H 1 5.650 0.020 . 1 . . . . A 9 C H1' . 34312 1
120 . 1 . 1 9 9 C H2' H 1 4.416 0.020 . 1 . . . . A 9 C H2' . 34312 1
121 . 1 . 1 9 9 C H3' H 1 4.260 0.020 . 1 . . . . A 9 C H3' . 34312 1
122 . 1 . 1 9 9 C H4' H 1 4.323 0.020 . 1 . . . . A 9 C H4' . 34312 1
123 . 1 . 1 9 9 C H5 H 1 5.567 0.020 . 1 . . . . A 9 C H5 . 34312 1
124 . 1 . 1 9 9 C H5' H 1 4.441 0.020 . 2 . . . . A 9 C H5' . 34312 1
125 . 1 . 1 9 9 C H5'' H 1 4.034 0.020 . 2 . . . . A 9 C H5'' . 34312 1
126 . 1 . 1 9 9 C H6 H 1 7.688 0.020 . 1 . . . . A 9 C H6 . 34312 1
127 . 1 . 1 9 9 C C1' C 13 93.127 0.3 . 1 . . . . A 9 C C1' . 34312 1
128 . 1 . 1 9 9 C C2' C 13 73.858 0.3 . 1 . . . . A 9 C C2' . 34312 1
129 . 1 . 1 9 9 C C3' C 13 71.551 0.3 . 1 . . . . A 9 C C3' . 34312 1
130 . 1 . 1 9 9 C C4' C 13 85.619 0.3 . 1 . . . . A 9 C C4' . 34312 1
131 . 1 . 1 9 9 C C5 C 13 98.309 0.3 . 1 . . . . A 9 C C5 . 34312 1
132 . 1 . 1 9 9 C C5' C 13 64.445 0.3 . 1 . . . . A 9 C C5' . 34312 1
133 . 1 . 1 9 9 C C6 C 13 141.304 0.3 . 1 . . . . A 9 C C6 . 34312 1
134 . 1 . 1 10 10 U H1' H 1 5.535 0.020 . 1 . . . . A 10 U H1' . 34312 1
135 . 1 . 1 10 10 U H2' H 1 4.452 0.020 . 1 . . . . A 10 U H2' . 34312 1
136 . 1 . 1 10 10 U H3' H 1 4.288 0.020 . 1 . . . . A 10 U H3' . 34312 1
137 . 1 . 1 10 10 U H4' H 1 4.025 0.020 . 1 . . . . A 10 U H4' . 34312 1
138 . 1 . 1 10 10 U H5 H 1 5.565 0.020 . 1 . . . . A 10 U H5 . 34312 1
139 . 1 . 1 10 10 U H5' H 1 4.189 0.020 . 2 . . . . A 10 U H5' . 34312 1
140 . 1 . 1 10 10 U H5'' H 1 4.038 0.020 . 2 . . . . A 10 U H5'' . 34312 1
141 . 1 . 1 10 10 U H6 H 1 7.692 0.020 . 1 . . . . A 10 U H6 . 34312 1
142 . 1 . 1 10 10 U C1' C 13 91.850 0.3 . 1 . . . . A 10 U C1' . 34312 1
143 . 1 . 1 10 10 U C2' C 13 75.306 0.3 . 1 . . . . A 10 U C2' . 34312 1
144 . 1 . 1 10 10 U C3' C 13 72.220 0.3 . 1 . . . . A 10 U C3' . 34312 1
145 . 1 . 1 10 10 U C4' C 13 85.167 0.3 . 1 . . . . A 10 U C4' . 34312 1
146 . 1 . 1 10 10 U C5 C 13 104.592 0.3 . 1 . . . . A 10 U C5 . 34312 1
147 . 1 . 1 10 10 U C5' C 13 64.336 0.3 . 1 . . . . A 10 U C5' . 34312 1
148 . 1 . 1 10 10 U C6 C 13 141.849 0.3 . 1 . . . . A 10 U C6 . 34312 1
149 . 1 . 1 11 11 G H1' H 1 5.677 0.020 . 1 . . . . A 11 G H1' . 34312 1
150 . 1 . 1 11 11 G H2' H 1 4.440 0.020 . 1 . . . . A 11 G H2' . 34312 1
151 . 1 . 1 11 11 G H3' H 1 4.332 0.020 . 1 . . . . A 11 G H3' . 34312 1
152 . 1 . 1 11 11 G H4' H 1 4.212 0.020 . 1 . . . . A 11 G H4' . 34312 1
153 . 1 . 1 11 11 G H5' H 1 4.188 0.020 . 2 . . . . A 11 G H5' . 34312 1
154 . 1 . 1 11 11 G H5'' H 1 4.053 0.020 . 2 . . . . A 11 G H5'' . 34312 1
155 . 1 . 1 11 11 G H8 H 1 7.836 0.020 . 1 . . . . A 11 G H8 . 34312 1
156 . 1 . 1 11 11 G C1' C 13 90.019 0.3 . 1 . . . . A 11 G C1' . 34312 1
157 . 1 . 1 11 11 G C2' C 13 76.624 0.3 . 1 . . . . A 11 G C2' . 34312 1
158 . 1 . 1 11 11 G C3' C 13 72.055 0.3 . 1 . . . . A 11 G C3' . 34312 1
159 . 1 . 1 11 11 G C4' C 13 85.481 0.3 . 1 . . . . A 11 G C4' . 34312 1
160 . 1 . 1 11 11 G C5' C 13 66.799 0.3 . 1 . . . . A 11 G C5' . 34312 1
161 . 1 . 1 11 11 G C8 C 13 139.370 0.3 . 1 . . . . A 11 G C8 . 34312 1
162 . 2 . 2 1 1 G H1' H 1 5.678 0.020 . 1 . . . . B 12 G H1' . 34312 1
163 . 2 . 2 1 1 G H2' H 1 4.688 0.020 . 1 . . . . B 12 G H2' . 34312 1
164 . 2 . 2 1 1 G H3' H 1 4.664 0.020 . 1 . . . . B 12 G H3' . 34312 1
165 . 2 . 2 1 1 G H4' H 1 4.416 0.020 . 1 . . . . B 12 G H4' . 34312 1
166 . 2 . 2 1 1 G H5' H 1 3.804 0.020 . 2 . . . . B 12 G H5' . 34312 1
167 . 2 . 2 1 1 G H5'' H 1 3.750 0.020 . 2 . . . . B 12 G H5'' . 34312 1
168 . 2 . 2 1 1 G H8 H 1 7.808 0.020 . 1 . . . . B 12 G H8 . 34312 1
169 . 2 . 2 1 1 G C1' C 13 91.151 0.3 . 1 . . . . B 12 G C1' . 34312 1
170 . 2 . 2 1 1 G C2' C 13 75.156 0.3 . 1 . . . . B 12 G C2' . 34312 1
171 . 2 . 2 1 1 G C3' C 13 76.972 0.3 . 1 . . . . B 12 G C3' . 34312 1
172 . 2 . 2 1 1 G C4' C 13 87.007 0.3 . 1 . . . . B 12 G C4' . 34312 1
173 . 2 . 2 1 1 G C5' C 13 63.534 0.3 . 1 . . . . B 12 G C5' . 34312 1
174 . 2 . 2 1 1 G C8 C 13 140.656 0.3 . 1 . . . . B 12 G C8 . 34312 1
175 . 2 . 2 2 2 G H1' H 1 5.880 0.020 . 1 . . . . B 13 G H1' . 34312 1
176 . 2 . 2 2 2 G H2' H 1 4.874 0.020 . 1 . . . . B 13 G H2' . 34312 1
177 . 2 . 2 2 2 G H3' H 1 4.806 0.020 . 1 . . . . B 13 G H3' . 34312 1
178 . 2 . 2 2 2 G H4' H 1 4.547 0.020 . 1 . . . . B 13 G H4' . 34312 1
179 . 2 . 2 2 2 G H5' H 1 4.292 0.020 . 2 . . . . B 13 G H5' . 34312 1
180 . 2 . 2 2 2 G H5'' H 1 4.190 0.020 . 2 . . . . B 13 G H5'' . 34312 1
181 . 2 . 2 2 2 G H8 H 1 7.912 0.020 . 1 . . . . B 13 G H8 . 34312 1
182 . 2 . 2 2 2 G C1' C 13 90.053 0.3 . 1 . . . . B 13 G C1' . 34312 1
183 . 2 . 2 2 2 G C2' C 13 76.196 0.3 . 1 . . . . B 13 G C2' . 34312 1
184 . 2 . 2 2 2 G C3' C 13 75.647 0.3 . 1 . . . . B 13 G C3' . 34312 1
185 . 2 . 2 2 2 G C4' C 13 84.645 0.3 . 1 . . . . B 13 G C4' . 34312 1
186 . 2 . 2 2 2 G C5' C 13 67.457 0.3 . 1 . . . . B 13 G C5' . 34312 1
187 . 2 . 2 2 2 G C8 C 13 138.817 0.3 . 1 . . . . B 13 G C8 . 34312 1
188 . 2 . 2 3 3 A H1' H 1 5.986 0.020 . 1 . . . . B 14 A H1' . 34312 1
189 . 2 . 2 3 3 A H2 H 1 8.144 0.020 . 1 . . . . B 14 A H2 . 34312 1
190 . 2 . 2 3 3 A H2' H 1 4.815 0.020 . 1 . . . . B 14 A H2' . 34312 1
191 . 2 . 2 3 3 A H3' H 1 4.685 0.020 . 1 . . . . B 14 A H3' . 34312 1
192 . 2 . 2 3 3 A H4' H 1 4.615 0.020 . 1 . . . . B 14 A H4' . 34312 1
193 . 2 . 2 3 3 A H5' H 1 4.432 0.020 . 2 . . . . B 14 A H5' . 34312 1
194 . 2 . 2 3 3 A H5'' H 1 4.291 0.020 . 2 . . . . B 14 A H5'' . 34312 1
195 . 2 . 2 3 3 A H8 H 1 8.279 0.020 . 1 . . . . B 14 A H8 . 34312 1
196 . 2 . 2 3 3 A C1' C 13 91.846 0.3 . 1 . . . . B 14 A C1' . 34312 1
197 . 2 . 2 3 3 A C2 C 13 153.127 0.3 . 1 . . . . B 14 A C2 . 34312 1
198 . 2 . 2 3 3 A C2' C 13 75.603 0.3 . 1 . . . . B 14 A C2' . 34312 1
199 . 2 . 2 3 3 A C3' C 13 77.111 0.3 . 1 . . . . B 14 A C3' . 34312 1
200 . 2 . 2 3 3 A C4' C 13 83.671 0.3 . 1 . . . . B 14 A C4' . 34312 1
201 . 2 . 2 3 3 A C5' C 13 67.478 0.3 . 1 . . . . B 14 A C5' . 34312 1
202 . 2 . 2 3 3 A C8 C 13 142.798 0.3 . 1 . . . . B 14 A C8 . 34312 1
203 . 2 . 2 4 4 G H1' H 1 5.530 0.020 . 1 . . . . B 15 G H1' . 34312 1
204 . 2 . 2 4 4 G H2' H 1 4.723 0.020 . 1 . . . . B 15 G H2' . 34312 1
205 . 2 . 2 4 4 G H3' H 1 4.517 0.020 . 1 . . . . B 15 G H3' . 34312 1
206 . 2 . 2 4 4 G H4' H 1 4.617 0.020 . 1 . . . . B 15 G H4' . 34312 1
207 . 2 . 2 4 4 G H5' H 1 4.429 0.020 . 2 . . . . B 15 G H5' . 34312 1
208 . 2 . 2 4 4 G H5'' H 1 4.146 0.020 . 2 . . . . B 15 G H5'' . 34312 1
209 . 2 . 2 4 4 G H8 H 1 7.383 0.020 . 1 . . . . B 15 G H8 . 34312 1
210 . 2 . 2 4 4 G C1' C 13 92.924 0.3 . 1 . . . . B 15 G C1' . 34312 1
211 . 2 . 2 4 4 G C2' C 13 74.844 0.3 . 1 . . . . B 15 G C2' . 34312 1
212 . 2 . 2 4 4 G C3' C 13 72.785 0.3 . 1 . . . . B 15 G C3' . 34312 1
213 . 2 . 2 4 4 G C4' C 13 84.717 0.3 . 1 . . . . B 15 G C4' . 34312 1
214 . 2 . 2 4 4 G C5' C 13 65.699 0.3 . 1 . . . . B 15 G C5' . 34312 1
215 . 2 . 2 4 4 G C8 C 13 136.659 0.3 . 1 . . . . B 15 G C8 . 34312 1
216 . 2 . 2 5 5 U H1' H 1 5.522 0.020 . 1 . . . . B 16 U H1' . 34312 1
217 . 2 . 2 5 5 U H2' H 1 4.588 0.020 . 1 . . . . B 16 U H2' . 34312 1
218 . 2 . 2 5 5 U H3 H 1 13.648 0.020 . 1 . . . . B 16 U H3 . 34312 1
219 . 2 . 2 5 5 U H3' H 1 4.557 0.020 . 1 . . . . B 16 U H3' . 34312 1
220 . 2 . 2 5 5 U H4' H 1 4.325 0.020 . 1 . . . . B 16 U H4' . 34312 1
221 . 2 . 2 5 5 U H5 H 1 5.114 0.020 . 1 . . . . B 16 U H5 . 34312 1
222 . 2 . 2 5 5 U H5' H 1 4.563 0.020 . 2 . . . . B 16 U H5' . 34312 1
223 . 2 . 2 5 5 U H5'' H 1 4.140 0.020 . 2 . . . . B 16 U H5'' . 34312 1
224 . 2 . 2 5 5 U H6 H 1 7.755 0.020 . 1 . . . . B 16 U H6 . 34312 1
225 . 2 . 2 5 5 U C1' C 13 93.461 0.3 . 1 . . . . B 16 U C1' . 34312 1
226 . 2 . 2 5 5 U C2' C 13 73.243 0.3 . 1 . . . . B 16 U C2' . 34312 1
227 . 2 . 2 5 5 U C3' C 13 74.726 0.3 . 1 . . . . B 16 U C3' . 34312 1
228 . 2 . 2 5 5 U C4' C 13 83.502 0.3 . 1 . . . . B 16 U C4' . 34312 1
229 . 2 . 2 5 5 U C5 C 13 102.649 0.3 . 1 . . . . B 16 U C5 . 34312 1
230 . 2 . 2 5 5 U C5' C 13 64.238 0.3 . 1 . . . . B 16 U C5' . 34312 1
231 . 2 . 2 5 5 U C6 C 13 141.394 0.3 . 1 . . . . B 16 U C6 . 34312 1
232 . 2 . 2 6 6 A H1' H 1 5.940 0.020 . 1 . . . . B 17 A H1' . 34312 1
233 . 2 . 2 6 6 A H2 H 1 6.433 0.020 . 1 . . . . B 17 A H2 . 34312 1
234 . 2 . 2 6 6 A H2' H 1 4.729 0.020 . 1 . . . . B 17 A H2' . 34312 1
235 . 2 . 2 6 6 A H3' H 1 4.566 0.020 . 1 . . . . B 17 A H3' . 34312 1
236 . 2 . 2 6 6 A H4' H 1 4.449 0.020 . 1 . . . . B 17 A H4' . 34312 1
237 . 2 . 2 6 6 A H5' H 1 4.172 0.020 . 2 . . . . B 17 A H5' . 34312 1
238 . 2 . 2 6 6 A H5'' H 1 4.350 0.020 . 2 . . . . B 17 A H5'' . 34312 1
239 . 2 . 2 6 6 A H8 H 1 8.073 0.020 . 1 . . . . B 17 A H8 . 34312 1
240 . 2 . 2 6 6 A C1' C 13 92.217 0.3 . 1 . . . . B 17 A C1' . 34312 1
241 . 2 . 2 6 6 A C2 C 13 151.909 0.3 . 1 . . . . B 17 A C2 . 34312 1
242 . 2 . 2 6 6 A C2' C 13 73.029 0.3 . 1 . . . . B 17 A C2' . 34312 1
243 . 2 . 2 6 6 A C3' C 13 74.549 0.3 . 1 . . . . B 17 A C3' . 34312 1
244 . 2 . 2 6 6 A C4' C 13 81.825 0.3 . 1 . . . . B 17 A C4' . 34312 1
245 . 2 . 2 6 6 A C5' C 13 66.802 0.3 . 1 . . . . B 17 A C5' . 34312 1
246 . 2 . 2 6 6 A C8 C 13 139.532 0.3 . 1 . . . . B 17 A C8 . 34312 1
247 . 2 . 2 7 7 A H1' H 1 5.781 0.020 . 1 . . . . B 18 A H1' . 34312 1
248 . 2 . 2 7 7 A H2 H 1 7.324 0.020 . 1 . . . . B 18 A H2 . 34312 1
249 . 2 . 2 7 7 A H2' H 1 4.607 0.020 . 1 . . . . B 18 A H2' . 34312 1
250 . 2 . 2 7 7 A H3' H 1 4.492 0.020 . 1 . . . . B 18 A H3' . 34312 1
251 . 2 . 2 7 7 A H4' H 1 4.542 0.020 . 1 . . . . B 18 A H4' . 34312 1
252 . 2 . 2 7 7 A H5' H 1 4.128 0.020 . 2 . . . . B 18 A H5' . 34312 1
253 . 2 . 2 7 7 A H5'' H 1 4.298 0.020 . 2 . . . . B 18 A H5'' . 34312 1
254 . 2 . 2 7 7 A H8 H 1 7.644 0.020 . 1 . . . . B 18 A H8 . 34312 1
255 . 2 . 2 7 7 A C1' C 13 92.481 0.3 . 1 . . . . B 18 A C1' . 34312 1
256 . 2 . 2 7 7 A C2 C 13 152.792 0.3 . 1 . . . . B 18 A C2 . 34312 1
257 . 2 . 2 7 7 A C2' C 13 76.251 0.3 . 1 . . . . B 18 A C2' . 34312 1
258 . 2 . 2 7 7 A C3' C 13 72.380 0.3 . 1 . . . . B 18 A C3' . 34312 1
259 . 2 . 2 7 7 A C4' C 13 82.247 0.3 . 1 . . . . B 18 A C4' . 34312 1
260 . 2 . 2 7 7 A C5' C 13 67.250 0.3 . 1 . . . . B 18 A C5' . 34312 1
261 . 2 . 2 7 7 A C8 C 13 138.964 0.3 . 1 . . . . B 18 A C8 . 34312 1
262 . 2 . 2 8 8 G H1 H 1 12.543 0.020 . 1 . . . . B 19 G H1 . 34312 1
263 . 2 . 2 8 8 G H1' H 1 5.537 0.020 . 1 . . . . B 19 G H1' . 34312 1
264 . 2 . 2 8 8 G H2' H 1 4.559 0.020 . 1 . . . . B 19 G H2' . 34312 1
265 . 2 . 2 8 8 G H3' H 1 4.567 0.020 . 1 . . . . B 19 G H3' . 34312 1
266 . 2 . 2 8 8 G H4' H 1 4.409 0.020 . 1 . . . . B 19 G H4' . 34312 1
267 . 2 . 2 8 8 G H5' H 1 4.354 0.020 . 2 . . . . B 19 G H5' . 34312 1
268 . 2 . 2 8 8 G H5'' H 1 4.001 0.020 . 2 . . . . B 19 G H5'' . 34312 1
269 . 2 . 2 8 8 G H8 H 1 7.052 0.020 . 1 . . . . B 19 G H8 . 34312 1
270 . 2 . 2 8 8 G C1' C 13 92.764 0.3 . 1 . . . . B 19 G C1' . 34312 1
271 . 2 . 2 8 8 G C2' C 13 75.451 0.3 . 1 . . . . B 19 G C2' . 34312 1
272 . 2 . 2 8 8 G C3' C 13 71.928 0.3 . 1 . . . . B 19 G C3' . 34312 1
273 . 2 . 2 8 8 G C4' C 13 81.928 0.3 . 1 . . . . B 19 G C4' . 34312 1
274 . 2 . 2 8 8 G C5' C 13 65.542 0.3 . 1 . . . . B 19 G C5' . 34312 1
275 . 2 . 2 8 8 G C8 C 13 135.670 0.3 . 1 . . . . B 19 G C8 . 34312 1
276 . 2 . 2 9 9 U H1' H 1 5.694 0.020 . 1 . . . . B 20 U H1' . 34312 1
277 . 2 . 2 9 9 U H2' H 1 4.462 0.020 . 1 . . . . B 20 U H2' . 34312 1
278 . 2 . 2 9 9 U H3' H 1 4.396 0.020 . 1 . . . . B 20 U H3' . 34312 1
279 . 2 . 2 9 9 U H4' H 1 4.513 0.020 . 1 . . . . B 20 U H4' . 34312 1
280 . 2 . 2 9 9 U H5 H 1 5.016 0.020 . 1 . . . . B 20 U H5 . 34312 1
281 . 2 . 2 9 9 U H5' H 1 4.352 0.020 . 2 . . . . B 20 U H5' . 34312 1
282 . 2 . 2 9 9 U H5'' H 1 4.046 0.020 . 2 . . . . B 20 U H5'' . 34312 1
283 . 2 . 2 9 9 U H6 H 1 7.553 0.020 . 1 . . . . B 20 U H6 . 34312 1
284 . 2 . 2 9 9 U C1' C 13 92.632 0.3 . 1 . . . . B 20 U C1' . 34312 1
285 . 2 . 2 9 9 U C2' C 13 74.224 0.3 . 1 . . . . B 20 U C2' . 34312 1
286 . 2 . 2 9 9 U C3' C 13 74.751 0.3 . 1 . . . . B 20 U C3' . 34312 1
287 . 2 . 2 9 9 U C4' C 13 82.551 0.3 . 1 . . . . B 20 U C4' . 34312 1
288 . 2 . 2 9 9 U C5 C 13 102.820 0.3 . 1 . . . . B 20 U C5 . 34312 1
289 . 2 . 2 9 9 U C5' C 13 65.680 0.3 . 1 . . . . B 20 U C5' . 34312 1
290 . 2 . 2 9 9 U C6 C 13 141.429 0.3 . 1 . . . . B 20 U C6 . 34312 1
291 . 2 . 2 10 10 C H1' H 1 5.710 0.020 . 1 . . . . B 21 C H1' . 34312 1
292 . 2 . 2 10 10 C H2' H 1 4.418 0.020 . 1 . . . . B 21 C H2' . 34312 1
293 . 2 . 2 10 10 C H3' H 1 4.220 0.020 . 1 . . . . B 21 C H3' . 34312 1
294 . 2 . 2 10 10 C H4' H 1 4.323 0.020 . 1 . . . . B 21 C H4' . 34312 1
295 . 2 . 2 10 10 C H5 H 1 5.814 0.020 . 1 . . . . B 21 C H5 . 34312 1
296 . 2 . 2 10 10 C H5' H 1 4.092 0.020 . 2 . . . . B 21 C H5' . 34312 1
297 . 2 . 2 10 10 C H5'' H 1 4.076 0.020 . 2 . . . . B 21 C H5'' . 34312 1
298 . 2 . 2 10 10 C H6 H 1 7.772 0.020 . 1 . . . . B 21 C H6 . 34312 1
299 . 2 . 2 10 10 C C1' C 13 92.701 0.3 . 1 . . . . B 21 C C1' . 34312 1
300 . 2 . 2 10 10 C C2' C 13 75.619 0.3 . 1 . . . . B 21 C C2' . 34312 1
301 . 2 . 2 10 10 C C3' C 13 75.501 0.3 . 1 . . . . B 21 C C3' . 34312 1
302 . 2 . 2 10 10 C C4' C 13 82.432 0.3 . 1 . . . . B 21 C C4' . 34312 1
303 . 2 . 2 10 10 C C5 C 13 98.054 0.3 . 1 . . . . B 21 C C5 . 34312 1
304 . 2 . 2 10 10 C C5' C 13 66.790 0.3 . 1 . . . . B 21 C C5' . 34312 1
305 . 2 . 2 10 10 C C6 C 13 142.727 0.3 . 1 . . . . B 21 C C6 . 34312 1
306 . 2 . 2 11 11 U H1' H 1 5.745 0.020 . 1 . . . . B 22 U H1' . 34312 1
307 . 2 . 2 11 11 U H2' H 1 4.429 0.020 . 1 . . . . B 22 U H2' . 34312 1
308 . 2 . 2 11 11 U H3' H 1 4.208 0.020 . 1 . . . . B 22 U H3' . 34312 1
309 . 2 . 2 11 11 U H4' H 1 4.141 0.020 . 1 . . . . B 22 U H4' . 34312 1
310 . 2 . 2 11 11 U H5 H 1 5.667 0.020 . 1 . . . . B 22 U H5 . 34312 1
311 . 2 . 2 11 11 U H5' H 1 4.110 0.020 . 1 . . . . B 22 U H5' . 34312 1
312 . 2 . 2 11 11 U H5'' H 1 4.110 0.020 . 1 . . . . B 22 U H5'' . 34312 1
313 . 2 . 2 11 11 U H6 H 1 7.745 0.020 . 1 . . . . B 22 U H6 . 34312 1
314 . 2 . 2 11 11 U C1' C 13 91.009 0.3 . 1 . . . . B 22 U C1' . 34312 1
315 . 2 . 2 11 11 U C2' C 13 75.392 0.3 . 1 . . . . B 22 U C2' . 34312 1
316 . 2 . 2 11 11 U C3' C 13 71.369 0.3 . 1 . . . . B 22 U C3' . 34312 1
317 . 2 . 2 11 11 U C4' C 13 85.020 0.3 . 1 . . . . B 22 U C4' . 34312 1
318 . 2 . 2 11 11 U C5 C 13 104.564 0.3 . 1 . . . . B 22 U C5 . 34312 1
319 . 2 . 2 11 11 U C5' C 13 66.386 0.3 . 1 . . . . B 22 U C5' . 34312 1
320 . 2 . 2 11 11 U C6 C 13 143.298 0.3 . 1 . . . . B 22 U C6 . 34312 1
321 . 3 . 3 1 1 GDZ H2 H 1 7.054 0.020 . 1 . . . . A 101 GDZ H2 . 34312 1
322 . 3 . 3 1 1 GDZ H7 H 1 8.509 0.020 . 1 . . . . A 101 GDZ H7 . 34312 1
323 . 3 . 3 1 1 GDZ H8 H 1 7.431 0.020 . 1 . . . . A 101 GDZ H8 . 34312 1
324 . 3 . 3 1 1 GDZ H10A H 1 2.313 0.020 . 1 . . . . A 101 GDZ H10A . 34312 1
325 . 3 . 3 1 1 GDZ H10B H 1 2.313 0.020 . 1 . . . . A 101 GDZ H10B . 34312 1
326 . 3 . 3 1 1 GDZ H10C H 1 2.313 0.020 . 1 . . . . A 101 GDZ H10C . 34312 1
327 . 3 . 3 1 1 GDZ H12 H 1 7.574 0.020 . 1 . . . . A 101 GDZ H12 . 34312 1
328 . 3 . 3 1 1 GDZ H14 H 1 7.740 0.020 . 1 . . . . A 101 GDZ H14 . 34312 1
329 . 3 . 3 1 1 GDZ H17 H 1 7.299 0.020 . 1 . . . . A 101 GDZ H17 . 34312 1
330 . 3 . 3 1 1 GDZ H20 H 1 6.330 0.020 . 1 . . . . A 101 GDZ H20 . 34312 1
331 . 3 . 3 1 1 GDZ H23A H 1 3.679 0.020 . 2 . . . . A 101 GDZ H23A . 34312 1
332 . 3 . 3 1 1 GDZ H23B H 1 3.690 0.020 . 2 . . . . A 101 GDZ H23B . 34312 1
333 . 3 . 3 1 1 GDZ H24A H 1 3.257 0.020 . 2 . . . . A 101 GDZ H24A . 34312 1
334 . 3 . 3 1 1 GDZ H24B H 1 3.271 0.020 . 2 . . . . A 101 GDZ H24B . 34312 1
335 . 3 . 3 1 1 GDZ H26A H 1 3.046 0.020 . 2 . . . . A 101 GDZ H26A . 34312 1
336 . 3 . 3 1 1 GDZ H26B H 1 3.079 0.020 . 2 . . . . A 101 GDZ H26B . 34312 1
337 . 3 . 3 1 1 GDZ H27A H 1 3.781 0.020 . 2 . . . . A 101 GDZ H27A . 34312 1
338 . 3 . 3 1 1 GDZ H27B H 1 3.788 0.020 . 2 . . . . A 101 GDZ H27B . 34312 1
339 . 3 . 3 1 1 GDZ H29A H 1 2.982 0.020 . 1 . . . . A 101 GDZ H29A . 34312 1
340 . 3 . 3 1 1 GDZ H29B H 1 2.982 0.020 . 1 . . . . A 101 GDZ H29B . 34312 1
341 . 3 . 3 1 1 GDZ H29C H 1 2.982 0.020 . 1 . . . . A 101 GDZ H29C . 34312 1
stop_
save_