Content for NMR-STAR saveframe, "assigned_chemical_shifts_1"
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 34158
_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 $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' . . . 34158 1
2 '2D 1H-1H NOESY' . . . 34158 1
3 '2D DQF-COSY' . . . 34158 1
4 '2D 1H-1H TOCSY' . . . 34158 1
5 '2D 1H-13C HSQC' . . . 34158 1
6 1H-31PCOSY . . . 34158 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.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 DCZ H1' H 1 5.758 0.000 . . . . . . A 1 DCZ H1' . 34158 1
2 . 1 1 1 1 DCZ H3' H 1 4.704 0.001 . . . . . . A 1 DCZ H3' . 34158 1
3 . 1 1 1 1 DCZ H4' H 1 4.064 0.000 . . . . . . A 1 DCZ H4' . 34158 1
4 . 1 1 1 1 DCZ H5 H 1 5.862 0.000 . . . . . . A 1 DCZ H5 . 34158 1
5 . 1 1 1 1 DCZ H6 H 1 7.585 0.000 . . . . . . A 1 DCZ H6 . 34158 1
6 . 1 1 1 1 DCZ C1' C 13 85.374 0.000 . . . . . . A 1 DCZ C1' . 34158 1
7 . 1 1 1 1 DCZ C3' C 13 75.649 0.000 . . . . . . A 1 DCZ C3' . 34158 1
8 . 1 1 1 1 DCZ C4' C 13 85.759 0.000 . . . . . . A 1 DCZ C4' . 34158 1
9 . 1 1 1 1 DCZ C5 C 13 96.912 0.000 . . . . . . A 1 DCZ C5 . 34158 1
10 . 1 1 1 1 DCZ C6 C 13 140.437 0.000 . . . . . . A 1 DCZ C6 . 34158 1
11 . 1 1 2 2 DG H1' H 1 5.453 0.000 . . . . . . A 2 DG H1' . 34158 1
12 . 1 1 2 2 DG H3' H 1 5.040 0.002 . . . . . . A 2 DG H3' . 34158 1
13 . 1 1 2 2 DG H4' H 1 4.328 0.001 . . . . . . A 2 DG H4' . 34158 1
14 . 1 1 2 2 DG C1' C 13 81.373 0.000 . . . . . . A 2 DG C1' . 34158 1
15 . 1 1 2 2 DG C3' C 13 76.572 0.000 . . . . . . A 2 DG C3' . 34158 1
16 . 1 1 2 2 DG C4' C 13 84.687 0.000 . . . . . . A 2 DG C4' . 34158 1
17 . 1 1 2 2 DG P P 31 -1.090 0.000 . . . . . . A 2 DG P . 34158 1
18 . 1 1 3 3 DA H1' H 1 6.357 0.000 . . . . . . A 3 DA H1' . 34158 1
19 . 1 1 3 3 DA H2 H 1 7.976 0.000 . . . . . . A 3 DA H2 . 34158 1
20 . 1 1 3 3 DA H3' H 1 5.133 0.001 . . . . . . A 3 DA H3' . 34158 1
21 . 1 1 3 3 DA H4' H 1 4.522 0.001 . . . . . . A 3 DA H4' . 34158 1
22 . 1 1 3 3 DA H8 H 1 8.443 0.000 . . . . . . A 3 DA H8 . 34158 1
23 . 1 1 3 3 DA C1' C 13 81.955 0.000 . . . . . . A 3 DA C1' . 34158 1
24 . 1 1 3 3 DA C2 C 13 151.981 0.000 . . . . . . A 3 DA C2 . 34158 1
25 . 1 1 3 3 DA C3' C 13 77.360 0.000 . . . . . . A 3 DA C3' . 34158 1
26 . 1 1 3 3 DA C4' C 13 85.122 0.000 . . . . . . A 3 DA C4' . 34158 1
27 . 1 1 3 3 DA C8 C 13 138.761 0.000 . . . . . . A 3 DA C8 . 34158 1
28 . 1 1 3 3 DA P P 31 -0.869 0.003 . . . . . . A 3 DA P . 34158 1
29 . 1 1 4 4 DT H1' H 1 5.773 0.000 . . . . . . A 4 DT H1' . 34158 1
30 . 1 1 4 4 DT H3' H 1 5.052 0.001 . . . . . . A 4 DT H3' . 34158 1
31 . 1 1 4 4 DT H4' H 1 4.273 0.001 . . . . . . A 4 DT H4' . 34158 1
32 . 1 1 4 4 DT H6 H 1 7.434 0.000 . . . . . . A 4 DT H6 . 34158 1
33 . 1 1 4 4 DT H71 H 1 1.560 0.000 . . . . . . A 4 DT H71 . 34158 1
34 . 1 1 4 4 DT H72 H 1 1.560 0.000 . . . . . . A 4 DT H72 . 34158 1
35 . 1 1 4 4 DT H73 H 1 1.560 0.000 . . . . . . A 4 DT H73 . 34158 1
36 . 1 1 4 4 DT C1' C 13 83.365 0.000 . . . . . . A 4 DT C1' . 34158 1
37 . 1 1 4 4 DT C3' C 13 75.603 0.000 . . . . . . A 4 DT C3' . 34158 1
38 . 1 1 4 4 DT C4' C 13 82.914 0.000 . . . . . . A 4 DT C4' . 34158 1
39 . 1 1 4 4 DT C6 C 13 136.294 0.000 . . . . . . A 4 DT C6 . 34158 1
40 . 1 1 4 4 DT C7 C 13 11.354 0.000 . . . . . . A 4 DT C7 . 34158 1
41 . 1 1 4 4 DT P P 31 -1.460 0.001 . . . . . . A 4 DT P . 34158 1
42 . 1 1 5 5 DG H1' H 1 5.906 0.000 . . . . . . A 5 DG H1' . 34158 1
43 . 1 1 5 5 DG H3' H 1 5.053 0.001 . . . . . . A 5 DG H3' . 34158 1
44 . 1 1 5 5 DG H4' H 1 4.280 0.002 . . . . . . A 5 DG H4' . 34158 1
45 . 1 1 5 5 DG C1' C 13 82.664 0.000 . . . . . . A 5 DG C1' . 34158 1
46 . 1 1 5 5 DG C3' C 13 78.686 0.000 . . . . . . A 5 DG C3' . 34158 1
47 . 1 1 5 5 DG C4' C 13 85.095 0.000 . . . . . . A 5 DG C4' . 34158 1
48 . 1 1 5 5 DG P P 31 -0.418 0.001 . . . . . . A 5 DG P . 34158 1
49 . 1 1 6 6 DT H1' H 1 4.943 0.000 . . . . . . A 6 DT H1' . 34158 1
50 . 1 1 6 6 DT H3' H 1 4.581 0.002 . . . . . . A 6 DT H3' . 34158 1
51 . 1 1 6 6 DT H4' H 1 2.489 0.001 . . . . . . A 6 DT H4' . 34158 1
52 . 1 1 6 6 DT H6 H 1 6.964 0.000 . . . . . . A 6 DT H6 . 34158 1
53 . 1 1 6 6 DT H71 H 1 1.316 0.000 . . . . . . A 6 DT H71 . 34158 1
54 . 1 1 6 6 DT H72 H 1 1.316 0.000 . . . . . . A 6 DT H72 . 34158 1
55 . 1 1 6 6 DT H73 H 1 1.316 0.000 . . . . . . A 6 DT H73 . 34158 1
56 . 1 1 6 6 DT C1' C 13 81.648 0.000 . . . . . . A 6 DT C1' . 34158 1
57 . 1 1 6 6 DT C3' C 13 73.432 0.000 . . . . . . A 6 DT C3' . 34158 1
58 . 1 1 6 6 DT C4' C 13 81.150 0.000 . . . . . . A 6 DT C4' . 34158 1
59 . 1 1 6 6 DT C6 C 13 135.816 0.000 . . . . . . A 6 DT C6 . 34158 1
60 . 1 1 6 6 DT C7 C 13 11.555 0.000 . . . . . . A 6 DT C7 . 34158 1
61 . 1 1 6 6 DT P P 31 -1.032 0.000 . . . . . . A 6 DT P . 34158 1
62 . 1 1 7 7 DA H1' H 1 5.526 0.000 . . . . . . A 7 DA H1' . 34158 1
63 . 1 1 7 7 DA H2 H 1 8.031 0.000 . . . . . . A 7 DA H2 . 34158 1
64 . 1 1 7 7 DA H3' H 1 4.679 0.002 . . . . . . A 7 DA H3' . 34158 1
65 . 1 1 7 7 DA H4' H 1 2.959 0.000 . . . . . . A 7 DA H4' . 34158 1
66 . 1 1 7 7 DA H8 H 1 8.124 0.000 . . . . . . A 7 DA H8 . 34158 1
67 . 1 1 7 7 DA C1' C 13 81.525 0.000 . . . . . . A 7 DA C1' . 34158 1
68 . 1 1 7 7 DA C2 C 13 152.388 0.000 . . . . . . A 7 DA C2 . 34158 1
69 . 1 1 7 7 DA C3' C 13 76.598 0.000 . . . . . . A 7 DA C3' . 34158 1
70 . 1 1 7 7 DA C4' C 13 83.232 0.000 . . . . . . A 7 DA C4' . 34158 1
71 . 1 1 7 7 DA C8 C 13 139.787 0.000 . . . . . . A 7 DA C8 . 34158 1
72 . 1 1 7 7 DA P P 31 -1.887 0.000 . . . . . . A 7 DA P . 34158 1
73 . 1 1 8 8 DC H1' H 1 5.331 0.000 . . . . . . A 8 DC H1' . 34158 1
74 . 1 1 8 8 DC H3' H 1 4.551 0.004 . . . . . . A 8 DC H3' . 34158 1
75 . 1 1 8 8 DC H4' H 1 2.247 0.000 . . . . . . A 8 DC H4' . 34158 1
76 . 1 1 8 8 DC H5 H 1 5.269 0.000 . . . . . . A 8 DC H5 . 34158 1
77 . 1 1 8 8 DC H6 H 1 6.888 0.000 . . . . . . A 8 DC H6 . 34158 1
78 . 1 1 8 8 DC C1' C 13 81.570 0.000 . . . . . . A 8 DC C1' . 34158 1
79 . 1 1 8 8 DC C3' C 13 72.912 0.000 . . . . . . A 8 DC C3' . 34158 1
80 . 1 1 8 8 DC C4' C 13 80.842 0.000 . . . . . . A 8 DC C4' . 34158 1
81 . 1 1 8 8 DC C5 C 13 96.282 0.000 . . . . . . A 8 DC C5 . 34158 1
82 . 1 1 8 8 DC C6 C 13 139.878 0.000 . . . . . . A 8 DC C6 . 34158 1
83 . 1 1 8 8 DC P P 31 -1.891 0.000 . . . . . . A 8 DC P . 34158 1
84 . 1 1 9 9 DA H1' H 1 5.559 0.000 . . . . . . A 9 DA H1' . 34158 1
85 . 1 1 9 9 DA H2 H 1 7.729 0.000 . . . . . . A 9 DA H2 . 34158 1
86 . 1 1 9 9 DA H3' H 1 4.653 0.006 . . . . . . A 9 DA H3' . 34158 1
87 . 1 1 9 9 DA H4' H 1 2.647 0.000 . . . . . . A 9 DA H4' . 34158 1
88 . 1 1 9 9 DA H8 H 1 8.293 0.000 . . . . . . A 9 DA H8 . 34158 1
89 . 1 1 9 9 DA C1' C 13 80.482 0.000 . . . . . . A 9 DA C1' . 34158 1
90 . 1 1 9 9 DA C2 C 13 151.465 0.000 . . . . . . A 9 DA C2 . 34158 1
91 . 1 1 9 9 DA C3' C 13 74.231 0.000 . . . . . . A 9 DA C3' . 34158 1
92 . 1 1 9 9 DA C4' C 13 82.449 0.000 . . . . . . A 9 DA C4' . 34158 1
93 . 1 1 9 9 DA C8 C 13 139.418 0.000 . . . . . . A 9 DA C8 . 34158 1
94 . 1 1 9 9 DA P P 31 -1.940 0.000 . . . . . . A 9 DA P . 34158 1
95 . 1 1 10 10 DT H1' H 1 5.691 0.000 . . . . . . A 10 DT H1' . 34158 1
96 . 1 1 10 10 DT H3' H 1 4.764 0.000 . . . . . . A 10 DT H3' . 34158 1
97 . 1 1 10 10 DT H4' H 1 3.909 0.002 . . . . . . A 10 DT H4' . 34158 1
98 . 1 1 10 10 DT H71 H 1 1.442 0.000 . . . . . . A 10 DT H71 . 34158 1
99 . 1 1 10 10 DT H72 H 1 1.442 0.000 . . . . . . A 10 DT H72 . 34158 1
100 . 1 1 10 10 DT H73 H 1 1.442 0.000 . . . . . . A 10 DT H73 . 34158 1
101 . 1 1 10 10 DT C1' C 13 81.447 0.000 . . . . . . A 10 DT C1' . 34158 1
102 . 1 1 10 10 DT C3' C 13 73.023 0.000 . . . . . . A 10 DT C3' . 34158 1
103 . 1 1 10 10 DT C4' C 13 81.740 0.000 . . . . . . A 10 DT C4' . 34158 1
104 . 1 1 10 10 DT C7 C 13 11.307 0.000 . . . . . . A 10 DT C7 . 34158 1
105 . 1 1 10 10 DT P P 31 -1.837 0.000 . . . . . . A 10 DT P . 34158 1
106 . 1 1 11 11 DC H1' H 1 5.741 0.000 . . . . . . A 11 DC H1' . 34158 1
107 . 1 1 11 11 DC H4' H 1 4.115 0.001 . . . . . . A 11 DC H4' . 34158 1
108 . 1 1 11 11 DC H5 H 1 5.613 0.000 . . . . . . A 11 DC H5 . 34158 1
109 . 1 1 11 11 DC H6 H 1 7.414 0.000 . . . . . . A 11 DC H6 . 34158 1
110 . 1 1 11 11 DC C1' C 13 83.687 0.000 . . . . . . A 11 DC C1' . 34158 1
111 . 1 1 11 11 DC C4' C 13 82.795 0.000 . . . . . . A 11 DC C4' . 34158 1
112 . 1 1 11 11 DC C5 C 13 95.989 0.000 . . . . . . A 11 DC C5 . 34158 1
113 . 1 1 11 11 DC C6 C 13 141.090 0.000 . . . . . . A 11 DC C6 . 34158 1
114 . 1 1 11 11 DC P P 31 -1.189 0.001 . . . . . . A 11 DC P . 34158 1
115 . 1 1 12 12 DG H1' H 1 6.143 0.000 . . . . . . A 12 DG H1' . 34158 1
116 . 1 1 12 12 DG H3' H 1 4.680 0.000 . . . . . . A 12 DG H3' . 34158 1
117 . 1 1 12 12 DG H4' H 1 4.179 0.001 . . . . . . A 12 DG H4' . 34158 1
118 . 1 1 12 12 DG H8 H 1 7.928 0.000 . . . . . . A 12 DG H8 . 34158 1
119 . 1 1 12 12 DG C1' C 13 82.045 0.000 . . . . . . A 12 DG C1' . 34158 1
120 . 1 1 12 12 DG C3' C 13 70.929 0.000 . . . . . . A 12 DG C3' . 34158 1
121 . 1 1 12 12 DG C4' C 13 85.284 0.000 . . . . . . A 12 DG C4' . 34158 1
122 . 1 1 12 12 DG C8 C 13 136.308 0.000 . . . . . . A 12 DG C8 . 34158 1
123 . 1 1 12 12 DG P P 31 -0.964 0.000 . . . . . . A 12 DG P . 34158 1
124 . 2 1 1 1 DCZ H1' H 1 5.746 0.000 . . . . . . B 13 DCZ H1' . 34158 1
125 . 2 1 1 1 DCZ H3' H 1 4.723 0.001 . . . . . . B 13 DCZ H3' . 34158 1
126 . 2 1 1 1 DCZ H5 H 1 5.897 0.000 . . . . . . B 13 DCZ H5 . 34158 1
127 . 2 1 1 1 DCZ H6 H 1 7.639 0.000 . . . . . . B 13 DCZ H6 . 34158 1
128 . 2 1 1 1 DCZ C1' C 13 85.212 0.000 . . . . . . B 13 DCZ C1' . 34158 1
129 . 2 1 1 1 DCZ C3' C 13 75.058 0.000 . . . . . . B 13 DCZ C3' . 34158 1
130 . 2 1 1 1 DCZ C5 C 13 96.814 0.000 . . . . . . B 13 DCZ C5 . 34158 1
131 . 2 1 1 1 DCZ C6 C 13 140.529 0.000 . . . . . . B 13 DCZ C6 . 34158 1
132 . 2 1 2 2 DG H1' H 1 5.666 0.000 . . . . . . B 14 DG H1' . 34158 1
133 . 2 1 2 2 DG H3' H 1 5.046 0.002 . . . . . . B 14 DG H3' . 34158 1
134 . 2 1 2 2 DG H4' H 1 4.370 0.002 . . . . . . B 14 DG H4' . 34158 1
135 . 2 1 2 2 DG C1' C 13 81.435 0.000 . . . . . . B 14 DG C1' . 34158 1
136 . 2 1 2 2 DG C3' C 13 77.235 0.000 . . . . . . B 14 DG C3' . 34158 1
137 . 2 1 2 2 DG C4' C 13 84.706 0.000 . . . . . . B 14 DG C4' . 34158 1
138 . 2 1 2 2 DG P P 31 -1.099 0.002 . . . . . . B 14 DG P . 34158 1
139 . 2 1 3 3 DA H1' H 1 6.329 0.000 . . . . . . B 15 DA H1' . 34158 1
140 . 2 1 3 3 DA H2 H 1 7.892 0.000 . . . . . . B 15 DA H2 . 34158 1
141 . 2 1 3 3 DA H3' H 1 5.106 0.002 . . . . . . B 15 DA H3' . 34158 1
142 . 2 1 3 3 DA H4' H 1 4.508 0.001 . . . . . . B 15 DA H4' . 34158 1
143 . 2 1 3 3 DA H8 H 1 8.321 0.000 . . . . . . B 15 DA H8 . 34158 1
144 . 2 1 3 3 DA C1' C 13 82.207 0.000 . . . . . . B 15 DA C1' . 34158 1
145 . 2 1 3 3 DA C2 C 13 152.264 0.000 . . . . . . B 15 DA C2 . 34158 1
146 . 2 1 3 3 DA C3' C 13 77.082 0.000 . . . . . . B 15 DA C3' . 34158 1
147 . 2 1 3 3 DA C4' C 13 84.889 0.000 . . . . . . B 15 DA C4' . 34158 1
148 . 2 1 3 3 DA C8 C 13 138.514 0.000 . . . . . . B 15 DA C8 . 34158 1
149 . 2 1 3 3 DA P P 31 -1.176 0.001 . . . . . . B 15 DA P . 34158 1
150 . 2 1 4 4 DT H1' H 1 5.621 0.000 . . . . . . B 16 DT H1' . 34158 1
151 . 2 1 4 4 DT H3' H 1 4.928 0.003 . . . . . . B 16 DT H3' . 34158 1
152 . 2 1 4 4 DT H4' H 1 4.141 0.001 . . . . . . B 16 DT H4' . 34158 1
153 . 2 1 4 4 DT H6 H 1 7.279 0.000 . . . . . . B 16 DT H6 . 34158 1
154 . 2 1 4 4 DT H71 H 1 1.524 0.000 . . . . . . B 16 DT H71 . 34158 1
155 . 2 1 4 4 DT H72 H 1 1.524 0.000 . . . . . . B 16 DT H72 . 34158 1
156 . 2 1 4 4 DT H73 H 1 1.524 0.000 . . . . . . B 16 DT H73 . 34158 1
157 . 2 1 4 4 DT C1' C 13 82.388 0.000 . . . . . . B 16 DT C1' . 34158 1
158 . 2 1 4 4 DT C3' C 13 73.211 0.000 . . . . . . B 16 DT C3' . 34158 1
159 . 2 1 4 4 DT C4' C 13 82.200 0.000 . . . . . . B 16 DT C4' . 34158 1
160 . 2 1 4 4 DT C6 C 13 136.129 0.000 . . . . . . B 16 DT C6 . 34158 1
161 . 2 1 4 4 DT C7 C 13 11.383 0.000 . . . . . . B 16 DT C7 . 34158 1
162 . 2 1 4 4 DT P P 31 -1.350 0.000 . . . . . . B 16 DT P . 34158 1
163 . 2 1 5 5 DG H1' H 1 5.786 0.000 . . . . . . B 17 DG H1' . 34158 1
164 . 2 1 5 5 DG H3' H 1 5.000 0.001 . . . . . . B 17 DG H3' . 34158 1
165 . 2 1 5 5 DG H4' H 1 4.267 0.001 . . . . . . B 17 DG H4' . 34158 1
166 . 2 1 5 5 DG C1' C 13 82.651 0.000 . . . . . . B 17 DG C1' . 34158 1
167 . 2 1 5 5 DG C3' C 13 78.245 0.000 . . . . . . B 17 DG C3' . 34158 1
168 . 2 1 5 5 DG C4' C 13 84.880 0.000 . . . . . . B 17 DG C4' . 34158 1
169 . 2 1 5 5 DG P P 31 -0.481 0.004 . . . . . . B 17 DG P . 34158 1
170 . 2 1 6 6 DT H1' H 1 5.210 0.000 . . . . . . B 18 DT H1' . 34158 1
171 . 2 1 6 6 DT H3' H 1 4.626 0.003 . . . . . . B 18 DT H3' . 34158 1
172 . 2 1 6 6 DT H4' H 1 2.051 0.000 . . . . . . B 18 DT H4' . 34158 1
173 . 2 1 6 6 DT H6 H 1 6.979 0.000 . . . . . . B 18 DT H6 . 34158 1
174 . 2 1 6 6 DT H71 H 1 1.446 0.000 . . . . . . B 18 DT H71 . 34158 1
175 . 2 1 6 6 DT H72 H 1 1.446 0.000 . . . . . . B 18 DT H72 . 34158 1
176 . 2 1 6 6 DT H73 H 1 1.446 0.000 . . . . . . B 18 DT H73 . 34158 1
177 . 2 1 6 6 DT C1' C 13 81.941 0.000 . . . . . . B 18 DT C1' . 34158 1
178 . 2 1 6 6 DT C3' C 13 73.881 0.000 . . . . . . B 18 DT C3' . 34158 1
179 . 2 1 6 6 DT C4' C 13 81.463 0.000 . . . . . . B 18 DT C4' . 34158 1
180 . 2 1 6 6 DT C6 C 13 136.439 0.000 . . . . . . B 18 DT C6 . 34158 1
181 . 2 1 6 6 DT C7 C 13 12.156 0.000 . . . . . . B 18 DT C7 . 34158 1
182 . 2 1 6 6 DT P P 31 -1.562 0.000 . . . . . . B 18 DT P . 34158 1
183 . 2 1 7 7 DA H1' H 1 5.506 0.000 . . . . . . B 19 DA H1' . 34158 1
184 . 2 1 7 7 DA H2 H 1 8.050 0.000 . . . . . . B 19 DA H2 . 34158 1
185 . 2 1 7 7 DA H3' H 1 4.671 0.001 . . . . . . B 19 DA H3' . 34158 1
186 . 2 1 7 7 DA H4' H 1 2.642 0.000 . . . . . . B 19 DA H4' . 34158 1
187 . 2 1 7 7 DA H8 H 1 8.143 0.000 . . . . . . B 19 DA H8 . 34158 1
188 . 2 1 7 7 DA C1' C 13 80.861 0.000 . . . . . . B 19 DA C1' . 34158 1
189 . 2 1 7 7 DA C2 C 13 151.930 0.000 . . . . . . B 19 DA C2 . 34158 1
190 . 2 1 7 7 DA C3' C 13 75.491 0.000 . . . . . . B 19 DA C3' . 34158 1
191 . 2 1 7 7 DA C4' C 13 82.696 0.000 . . . . . . B 19 DA C4' . 34158 1
192 . 2 1 7 7 DA C8 C 13 139.555 0.000 . . . . . . B 19 DA C8 . 34158 1
193 . 2 1 7 7 DA P P 31 -1.615 0.000 . . . . . . B 19 DA P . 34158 1
194 . 2 1 8 8 DC H1' H 1 5.349 0.000 . . . . . . B 20 DC H1' . 34158 1
195 . 2 1 8 8 DC H3' H 1 4.561 0.001 . . . . . . B 20 DC H3' . 34158 1
196 . 2 1 8 8 DC H4' H 1 2.347 0.000 . . . . . . B 20 DC H4' . 34158 1
197 . 2 1 8 8 DC H5 H 1 5.287 0.000 . . . . . . B 20 DC H5 . 34158 1
198 . 2 1 8 8 DC H6 H 1 6.899 0.000 . . . . . . B 20 DC H6 . 34158 1
199 . 2 1 8 8 DC C1' C 13 81.570 0.000 . . . . . . B 20 DC C1' . 34158 1
200 . 2 1 8 8 DC C3' C 13 73.055 0.000 . . . . . . B 20 DC C3' . 34158 1
201 . 2 1 8 8 DC C4' C 13 81.030 0.000 . . . . . . B 20 DC C4' . 34158 1
202 . 2 1 8 8 DC C5 C 13 96.235 0.000 . . . . . . B 20 DC C5 . 34158 1
203 . 2 1 8 8 DC C6 C 13 139.707 0.000 . . . . . . B 20 DC C6 . 34158 1
204 . 2 1 8 8 DC P P 31 -2.006 0.000 . . . . . . B 20 DC P . 34158 1
205 . 2 1 9 9 DA H1' H 1 5.456 0.000 . . . . . . B 21 DA H1' . 34158 1
206 . 2 1 9 9 DA H2 H 1 7.738 0.000 . . . . . . B 21 DA H2 . 34158 1
207 . 2 1 9 9 DA H3' H 1 4.639 0.000 . . . . . . B 21 DA H3' . 34158 1
208 . 2 1 9 9 DA H4' H 1 2.783 0.000 . . . . . . B 21 DA H4' . 34158 1
209 . 2 1 9 9 DA C1' C 13 80.566 0.000 . . . . . . B 21 DA C1' . 34158 1
210 . 2 1 9 9 DA C2 C 13 150.877 0.000 . . . . . . B 21 DA C2 . 34158 1
211 . 2 1 9 9 DA C3' C 13 74.060 0.000 . . . . . . B 21 DA C3' . 34158 1
212 . 2 1 9 9 DA C4' C 13 82.519 0.000 . . . . . . B 21 DA C4' . 34158 1
213 . 2 1 9 9 DA P P 31 -1.945 0.000 . . . . . . B 21 DA P . 34158 1
214 . 2 1 10 10 DT H1' H 1 5.729 0.000 . . . . . . B 22 DT H1' . 34158 1
215 . 2 1 10 10 DT H3' H 1 4.771 0.001 . . . . . . B 22 DT H3' . 34158 1
216 . 2 1 10 10 DT H4' H 1 3.754 0.002 . . . . . . B 22 DT H4' . 34158 1
217 . 2 1 10 10 DT H71 H 1 1.354 0.000 . . . . . . B 22 DT H71 . 34158 1
218 . 2 1 10 10 DT H72 H 1 1.354 0.000 . . . . . . B 22 DT H72 . 34158 1
219 . 2 1 10 10 DT H73 H 1 1.354 0.000 . . . . . . B 22 DT H73 . 34158 1
220 . 2 1 10 10 DT C1' C 13 81.428 0.000 . . . . . . B 22 DT C1' . 34158 1
221 . 2 1 10 10 DT C3' C 13 73.568 0.000 . . . . . . B 22 DT C3' . 34158 1
222 . 2 1 10 10 DT C4' C 13 82.054 0.000 . . . . . . B 22 DT C4' . 34158 1
223 . 2 1 10 10 DT C7 C 13 11.216 0.000 . . . . . . B 22 DT C7 . 34158 1
224 . 2 1 10 10 DT P P 31 -2.092 0.000 . . . . . . B 22 DT P . 34158 1
225 . 2 1 11 11 DC H1' H 1 5.495 0.000 . . . . . . B 23 DC H1' . 34158 1
226 . 2 1 11 11 DC H3' H 1 4.829 0.010 . . . . . . B 23 DC H3' . 34158 1
227 . 2 1 11 11 DC H4' H 1 4.120 0.001 . . . . . . B 23 DC H4' . 34158 1
228 . 2 1 11 11 DC H5 H 1 5.647 0.000 . . . . . . B 23 DC H5 . 34158 1
229 . 2 1 11 11 DC H6 H 1 7.463 0.000 . . . . . . B 23 DC H6 . 34158 1
230 . 2 1 11 11 DC C1' C 13 84.063 0.000 . . . . . . B 23 DC C1' . 34158 1
231 . 2 1 11 11 DC C3' C 13 73.938 0.000 . . . . . . B 23 DC C3' . 34158 1
232 . 2 1 11 11 DC C4' C 13 83.447 0.000 . . . . . . B 23 DC C4' . 34158 1
233 . 2 1 11 11 DC C5 C 13 96.165 0.000 . . . . . . B 23 DC C5 . 34158 1
234 . 2 1 11 11 DC C6 C 13 141.160 0.000 . . . . . . B 23 DC C6 . 34158 1
235 . 2 1 11 11 DC P P 31 -1.360 0.002 . . . . . . B 23 DC P . 34158 1
236 . 2 1 12 12 DG H1' H 1 6.171 0.000 . . . . . . B 24 DG H1' . 34158 1
237 . 2 1 12 12 DG H3' H 1 4.675 0.000 . . . . . . B 24 DG H3' . 34158 1
238 . 2 1 12 12 DG H4' H 1 4.167 0.001 . . . . . . B 24 DG H4' . 34158 1
239 . 2 1 12 12 DG H8 H 1 7.943 0.000 . . . . . . B 24 DG H8 . 34158 1
240 . 2 1 12 12 DG C1' C 13 82.207 0.000 . . . . . . B 24 DG C1' . 34158 1
241 . 2 1 12 12 DG C3' C 13 70.669 0.000 . . . . . . B 24 DG C3' . 34158 1
242 . 2 1 12 12 DG C4' C 13 85.167 0.000 . . . . . . B 24 DG C4' . 34158 1
243 . 2 1 12 12 DG C8 C 13 136.480 0.000 . . . . . . B 24 DG C8 . 34158 1
244 . 2 1 12 12 DG P P 31 -0.519 0.001 . . . . . . B 24 DG P . 34158 1
245 . 3 2 1 1 9U2 H83 H 1 8.868 0.000 . . . . . . A 100 9U2 H83 . 34158 1
246 . 3 2 1 1 9U2 H85 H 1 4.143 0.000 . . . . . . A 100 9U2 H85 . 34158 1
247 . 3 2 1 1 9U2 H881 H 1 1.290 0.000 . . . . . . A 100 9U2 H881 . 34158 1
248 . 3 2 1 1 9U2 H991 H 1 1.535 0.000 . . . . . . A 100 9U2 H991 . 34158 1
249 . 3 2 1 1 9U2 C83 C 13 151.886 0.000 . . . . . . A 100 9U2 C83 . 34158 1
250 . 3 2 1 1 9U2 C85 C 13 27.604 0.000 . . . . . . A 100 9U2 C85 . 34158 1
251 . 3 2 1 1 9U2 CM8 C 13 25.154 0.000 . . . . . . A 100 9U2 CM8 . 34158 1
252 . 3 2 1 1 9U2 CM9 C 13 24.496 0.000 . . . . . . A 100 9U2 CM9 . 34158 1
253 . 4 3 1 1 PYB HB1 H 1 5.992 0.000 . . . . . . A 101 PYB HB1 . 34158 1
254 . 4 3 1 1 PYB HB H 1 7.663 0.000 . . . . . . A 101 PYB HB . 34158 1
255 . 4 3 1 1 PYB HD1 H 1 3.929 0.000 . . . . . . A 101 PYB HD1 . 34158 1
256 . 4 3 1 1 PYB CB1 C 13 103.988 0.000 . . . . . . A 101 PYB CB1 . 34158 1
257 . 4 3 1 1 PYB CB C 13 120.992 0.000 . . . . . . A 101 PYB CB . 34158 1
258 . 4 3 1 1 PYB CD C 13 37.633 0.000 . . . . . . A 101 PYB CD . 34158 1
259 . 5 3 1 1 PYB HB1 H 1 6.266 0.000 . . . . . . A 102 PYB HB1 . 34158 1
260 . 5 3 1 1 PYB HB H 1 7.625 0.000 . . . . . . A 102 PYB HB . 34158 1
261 . 5 3 1 1 PYB HD1 H 1 3.784 0.000 . . . . . . A 102 PYB HD1 . 34158 1
262 . 5 3 1 1 PYB CB1 C 13 102.624 0.000 . . . . . . A 102 PYB CB1 . 34158 1
263 . 5 3 1 1 PYB CB C 13 121.756 0.000 . . . . . . A 102 PYB CB . 34158 1
264 . 5 3 1 1 PYB CD C 13 37.252 0.000 . . . . . . A 102 PYB CD . 34158 1
265 . 6 3 1 1 PYB HB1 H 1 6.451 0.000 . . . . . . A 103 PYB HB1 . 34158 1
266 . 6 3 1 1 PYB HB H 1 7.094 0.000 . . . . . . A 103 PYB HB . 34158 1
267 . 6 3 1 1 PYB HD1 H 1 3.576 0.000 . . . . . . A 103 PYB HD1 . 34158 1
268 . 6 3 1 1 PYB CB1 C 13 105.277 0.000 . . . . . . A 103 PYB CB1 . 34158 1
269 . 6 3 1 1 PYB CB C 13 118.964 0.000 . . . . . . A 103 PYB CB . 34158 1
270 . 6 3 1 1 PYB CD C 13 36.267 0.000 . . . . . . A 103 PYB CD . 34158 1
271 . 8 5 1 1 IMT HB H 1 7.467 0.000 . . . . . . A 105 IMT HB . 34158 1
272 . 8 5 1 1 IMT HD1 H 1 3.955 0.000 . . . . . . A 105 IMT HD1 . 34158 1
273 . 8 5 1 1 IMT CB C 13 113.935 0.000 . . . . . . A 105 IMT CB . 34158 1
274 . 8 5 1 1 IMT CD C 13 36.401 0.000 . . . . . . A 105 IMT CD . 34158 1
275 . 9 3 1 1 PYB HB1 H 1 6.178 0.000 . . . . . . A 106 PYB HB1 . 34158 1
276 . 9 3 1 1 PYB HB H 1 7.629 0.000 . . . . . . A 106 PYB HB . 34158 1
277 . 9 3 1 1 PYB HD1 H 1 3.882 0.000 . . . . . . A 106 PYB HD1 . 34158 1
278 . 9 3 1 1 PYB CB1 C 13 104.328 0.000 . . . . . . A 106 PYB CB1 . 34158 1
279 . 9 3 1 1 PYB CB C 13 121.874 0.000 . . . . . . A 106 PYB CB . 34158 1
280 . 9 3 1 1 PYB CD C 13 37.725 0.000 . . . . . . A 106 PYB CD . 34158 1
281 . 10 3 1 1 PYB HB1 H 1 6.414 0.000 . . . . . . A 107 PYB HB1 . 34158 1
282 . 10 3 1 1 PYB HB H 1 7.506 0.000 . . . . . . A 107 PYB HB . 34158 1
283 . 10 3 1 1 PYB HD1 H 1 3.701 0.000 . . . . . . A 107 PYB HD1 . 34158 1
284 . 10 3 1 1 PYB CB1 C 13 102.464 0.000 . . . . . . A 107 PYB CB1 . 34158 1
285 . 10 3 1 1 PYB CB C 13 121.920 0.000 . . . . . . A 107 PYB CB . 34158 1
286 . 10 3 1 1 PYB CD C 13 37.058 0.000 . . . . . . A 107 PYB CD . 34158 1
287 . 11 3 1 1 PYB HB1 H 1 6.318 0.000 . . . . . . A 108 PYB HB1 . 34158 1
288 . 11 3 1 1 PYB HB H 1 7.046 0.000 . . . . . . A 108 PYB HB . 34158 1
289 . 11 3 1 1 PYB HD1 H 1 3.562 0.000 . . . . . . A 108 PYB HD1 . 34158 1
290 . 11 3 1 1 PYB C C 13 36.572 0.000 . . . . . . A 108 PYB C . 34158 1
291 . 11 3 1 1 PYB CB1 C 13 106.578 0.000 . . . . . . A 108 PYB CB1 . 34158 1
292 . 11 3 1 1 PYB CB C 13 119.914 0.000 . . . . . . A 108 PYB CB . 34158 1
293 . 11 3 1 1 PYB CD C 13 36.572 0.000 . . . . . . A 108 PYB CD . 34158 1
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