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 34157
_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 DQF-COSY' . . . 34157 1
2 '2D 1H-1H TOCSY' . . . 34157 1
3 '2D 1H-13C HSQC' . . . 34157 1
4 '1H-31P COSY' . . . 34157 1
5 '2D 1H-1H NOESY' . . . 34157 1
6 '2D 1H-1H NOESY' . . . 34157 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 5.759 0.001 . 1 . . . . A 1 DCZ H1' . 34157 1
2 . 1 1 1 1 DCZ H2'1 H 1 1.851 0.002 . 1 . . . . A 1 DCZ H2'1 . 34157 1
3 . 1 1 1 1 DCZ H2'2 H 1 2.372 0.001 . 1 . . . . A 1 DCZ H2'2 . 34157 1
4 . 1 1 1 1 DCZ H3' H 1 4.699 0.002 . 1 . . . . A 1 DCZ H3' . 34157 1
5 . 1 1 1 1 DCZ H4' H 1 4.058 0.001 . 1 . . . . A 1 DCZ H4' . 34157 1
6 . 1 1 1 1 DCZ H5 H 1 5.879 0.000 . 1 . . . . A 1 DCZ H5 . 34157 1
7 . 1 1 1 1 DCZ H5'1 H 1 3.707 0.000 . 1 . . . . A 1 DCZ H5'1 . 34157 1
8 . 1 1 1 1 DCZ H5'2 H 1 3.707 0.000 . 1 . . . . A 1 DCZ H5'2 . 34157 1
9 . 1 1 1 1 DCZ H6 H 1 7.591 0.002 . 1 . . . . A 1 DCZ H6 . 34157 1
10 . 1 1 2 2 DG H1 H 1 12.889 0.002 . 1 . . . . A 2 DG H1 . 34157 1
11 . 1 1 2 2 DG H1' H 1 5.432 0.001 . 1 . . . . A 2 DG H1' . 34157 1
12 . 1 1 2 2 DG H2' H 1 2.761 0.000 . 1 . . . . A 2 DG H2' . 34157 1
13 . 1 1 2 2 DG H2'' H 1 2.852 0.000 . 1 . . . . A 2 DG H2'' . 34157 1
14 . 1 1 2 2 DG H3' H 1 5.030 0.001 . 1 . . . . A 2 DG H3' . 34157 1
15 . 1 1 2 2 DG H4' H 1 4.316 0.001 . 1 . . . . A 2 DG H4' . 34157 1
16 . 1 1 2 2 DG H5' H 1 3.973 0.000 . 1 . . . . A 2 DG H5' . 34157 1
17 . 1 1 2 2 DG H5'' H 1 4.098 0.000 . 1 . . . . A 2 DG H5'' . 34157 1
18 . 1 1 2 2 DG H8 H 1 8.015 0.001 . 1 . . . . A 2 DG H8 . 34157 1
19 . 1 1 3 3 DA H1' H 1 6.346 0.001 . 1 . . . . A 3 DA H1' . 34157 1
20 . 1 1 3 3 DA H2 H 1 7.964 0.001 . 1 . . . . A 3 DA H2 . 34157 1
21 . 1 1 3 3 DA H2' H 1 2.828 0.001 . 1 . . . . A 3 DA H2' . 34157 1
22 . 1 1 3 3 DA H2'' H 1 3.007 0.002 . 1 . . . . A 3 DA H2'' . 34157 1
23 . 1 1 3 3 DA H3' H 1 5.122 0.001 . 1 . . . . A 3 DA H3' . 34157 1
24 . 1 1 3 3 DA H4' H 1 4.515 0.001 . 1 . . . . A 3 DA H4' . 34157 1
25 . 1 1 3 3 DA H5' H 1 4.203 0.001 . 1 . . . . A 3 DA H5' . 34157 1
26 . 1 1 3 3 DA H5'' H 1 4.261 0.000 . 1 . . . . A 3 DA H5'' . 34157 1
27 . 1 1 3 3 DA H8 H 1 8.429 0.001 . 1 . . . . A 3 DA H8 . 34157 1
28 . 1 1 4 4 DT H1' H 1 5.724 0.001 . 1 . . . . A 4 DT H1' . 34157 1
29 . 1 1 4 4 DT H2' H 1 2.492 0.001 . 1 . . . . A 4 DT H2' . 34157 1
30 . 1 1 4 4 DT H2'' H 1 2.575 0.001 . 1 . . . . A 4 DT H2'' . 34157 1
31 . 1 1 4 4 DT H3 H 1 13.724 0.001 . 1 . . . . A 4 DT H3 . 34157 1
32 . 1 1 4 4 DT H3' H 1 5.030 0.000 . 1 . . . . A 4 DT H3' . 34157 1
33 . 1 1 4 4 DT H4' H 1 4.254 0.000 . 1 . . . . A 4 DT H4' . 34157 1
34 . 1 1 4 4 DT H6 H 1 7.415 0.001 . 1 . . . . A 4 DT H6 . 34157 1
35 . 1 1 4 4 DT H71 H 1 1.554 0.000 . 1 . . . . A 4 DT H71 . 34157 1
36 . 1 1 4 4 DT H72 H 1 1.554 0.000 . 1 . . . . A 4 DT H72 . 34157 1
37 . 1 1 4 4 DT H73 H 1 1.554 0.000 . 1 . . . . A 4 DT H73 . 34157 1
38 . 1 1 5 5 DG H1 H 1 12.464 0.001 . 1 . . . . A 5 DG H1 . 34157 1
39 . 1 1 5 5 DG H1' H 1 5.858 0.001 . 1 . . . . A 5 DG H1' . 34157 1
40 . 1 1 5 5 DG H2' H 1 2.678 0.001 . 1 . . . . A 5 DG H2' . 34157 1
41 . 1 1 5 5 DG H2'' H 1 2.587 0.001 . 1 . . . . A 5 DG H2'' . 34157 1
42 . 1 1 5 5 DG H3' H 1 5.029 0.000 . 1 . . . . A 5 DG H3' . 34157 1
43 . 1 1 5 5 DG H4' H 1 4.251 0.001 . 1 . . . . A 5 DG H4' . 34157 1
44 . 1 1 5 5 DG H8 H 1 7.993 0.001 . 1 . . . . A 5 DG H8 . 34157 1
45 . 1 1 5 5 DG H21 H 1 8.303 0.001 . 1 . . . . A 5 DG H21 . 34157 1
46 . 1 1 5 5 DG H22 H 1 6.760 0.001 . 1 . . . . A 5 DG H22 . 34157 1
47 . 1 1 6 6 DT H1' H 1 4.893 0.002 . 1 . . . . A 6 DT H1' . 34157 1
48 . 1 1 6 6 DT H2' H 1 1.721 0.001 . 1 . . . . A 6 DT H2' . 34157 1
49 . 1 1 6 6 DT H2'' H 1 2.211 0.001 . 1 . . . . A 6 DT H2'' . 34157 1
50 . 1 1 6 6 DT H3 H 1 12.350 0.001 . 1 . . . . A 6 DT H3 . 34157 1
51 . 1 1 6 6 DT H3' H 1 4.564 0.001 . 1 . . . . A 6 DT H3' . 34157 1
52 . 1 1 6 6 DT H4' H 1 2.609 0.000 . 1 . . . . A 6 DT H4' . 34157 1
53 . 1 1 6 6 DT H5' H 1 3.384 0.001 . 1 . . . . A 6 DT H5' . 34157 1
54 . 1 1 6 6 DT H5'' H 1 3.851 0.001 . 1 . . . . A 6 DT H5'' . 34157 1
55 . 1 1 6 6 DT H6 H 1 6.955 0.001 . 1 . . . . A 6 DT H6 . 34157 1
56 . 1 1 6 6 DT H71 H 1 1.346 0.002 . 1 . . . . A 6 DT H71 . 34157 1
57 . 1 1 6 6 DT H72 H 1 1.346 0.002 . 1 . . . . A 6 DT H72 . 34157 1
58 . 1 1 6 6 DT H73 H 1 1.346 0.002 . 1 . . . . A 6 DT H73 . 34157 1
59 . 1 1 7 7 DA H1' H 1 5.514 0.001 . 1 . . . . A 7 DA H1' . 34157 1
60 . 1 1 7 7 DA H2 H 1 8.041 0.001 . 1 . . . . A 7 DA H2 . 34157 1
61 . 1 1 7 7 DA H2' H 1 2.182 0.002 . 1 . . . . A 7 DA H2' . 34157 1
62 . 1 1 7 7 DA H2'' H 1 2.684 0.000 . 1 . . . . A 7 DA H2'' . 34157 1
63 . 1 1 7 7 DA H3' H 1 4.671 0.001 . 1 . . . . A 7 DA H3' . 34157 1
64 . 1 1 7 7 DA H4' H 1 2.831 0.001 . 1 . . . . A 7 DA H4' . 34157 1
65 . 1 1 7 7 DA H5' H 1 3.579 0.001 . 1 . . . . A 7 DA H5' . 34157 1
66 . 1 1 7 7 DA H8 H 1 8.119 0.001 . 1 . . . . A 7 DA H8 . 34157 1
67 . 1 1 7 7 DA H61 H 1 8.454 0.001 . 1 . . . . A 7 DA H61 . 34157 1
68 . 1 1 8 8 DC H1' H 1 5.304 0.002 . 1 . . . . A 8 DC H1' . 34157 1
69 . 1 1 8 8 DC H2' H 1 1.439 0.000 . 1 . . . . A 8 DC H2' . 34157 1
70 . 1 1 8 8 DC H2'' H 1 2.304 0.000 . 1 . . . . A 8 DC H2'' . 34157 1
71 . 1 1 8 8 DC H3' H 1 4.539 0.002 . 1 . . . . A 8 DC H3' . 34157 1
72 . 1 1 8 8 DC H4' H 1 2.173 0.001 . 1 . . . . A 8 DC H4' . 34157 1
73 . 1 1 8 8 DC H5 H 1 5.273 0.001 . 1 . . . . A 8 DC H5 . 34157 1
74 . 1 1 8 8 DC H5' H 1 3.421 0.001 . 1 . . . . A 8 DC H5' . 34157 1
75 . 1 1 8 8 DC H5'' H 1 3.782 0.000 . 1 . . . . A 8 DC H5'' . 34157 1
76 . 1 1 8 8 DC H6 H 1 6.876 0.001 . 1 . . . . A 8 DC H6 . 34157 1
77 . 1 1 8 8 DC H41 H 1 8.608 0.536 . 1 . . . . A 8 DC H41 . 34157 1
78 . 1 1 8 8 DC H42 H 1 6.397 0.001 . 1 . . . . A 8 DC H42 . 34157 1
79 . 1 1 9 9 DA H1' H 1 5.558 0.002 . 1 . . . . A 9 DA H1' . 34157 1
80 . 1 1 9 9 DA H2 H 1 7.731 0.001 . 1 . . . . A 9 DA H2 . 34157 1
81 . 1 1 9 9 DA H2' H 1 2.174 0.000 . 1 . . . . A 9 DA H2' . 34157 1
82 . 1 1 9 9 DA H2'' H 1 2.561 0.000 . 1 . . . . A 9 DA H2'' . 34157 1
83 . 1 1 9 9 DA H3' H 1 4.653 0.001 . 1 . . . . A 9 DA H3' . 34157 1
84 . 1 1 9 9 DA H4' H 1 2.645 0.001 . 1 . . . . A 9 DA H4' . 34157 1
85 . 1 1 9 9 DA H5' H 1 3.550 0.001 . 1 . . . . A 9 DA H5' . 34157 1
86 . 1 1 9 9 DA H5'' H 1 3.663 0.000 . 1 . . . . A 9 DA H5'' . 34157 1
87 . 1 1 9 9 DA H8 H 1 8.297 0.000 . 1 . . . . A 9 DA H8 . 34157 1
88 . 1 1 10 10 DT H1' H 1 5.683 0.002 . 1 . . . . A 10 DT H1' . 34157 1
89 . 1 1 10 10 DT H2' H 1 1.860 0.001 . 1 . . . . A 10 DT H2' . 34157 1
90 . 1 1 10 10 DT H2'' H 1 2.288 0.001 . 1 . . . . A 10 DT H2'' . 34157 1
91 . 1 1 10 10 DT H3 H 1 13.532 0.000 . 1 . . . . A 10 DT H3 . 34157 1
92 . 1 1 10 10 DT H3' H 1 4.763 0.001 . 1 . . . . A 10 DT H3' . 34157 1
93 . 1 1 10 10 DT H4' H 1 3.897 0.002 . 1 . . . . A 10 DT H4' . 34157 1
94 . 1 1 10 10 DT H5' H 1 3.443 0.002 . 1 . . . . A 10 DT H5' . 34157 1
95 . 1 1 10 10 DT H5'' H 1 3.659 0.000 . 1 . . . . A 10 DT H5'' . 34157 1
96 . 1 1 10 10 DT H6 H 1 6.962 0.002 . 1 . . . . A 10 DT H6 . 34157 1
97 . 1 1 10 10 DT H71 H 1 1.437 0.001 . 1 . . . . A 10 DT H71 . 34157 1
98 . 1 1 10 10 DT H72 H 1 1.437 0.001 . 1 . . . . A 10 DT H72 . 34157 1
99 . 1 1 10 10 DT H73 H 1 1.437 0.001 . 1 . . . . A 10 DT H73 . 34157 1
100 . 1 1 11 11 DC H1' H 1 5.731 0.001 . 1 . . . . A 11 DC H1' . 34157 1
101 . 1 1 11 11 DC H2' H 1 1.959 0.001 . 1 . . . . A 11 DC H2' . 34157 1
102 . 1 1 11 11 DC H2'' H 1 2.352 0.001 . 1 . . . . A 11 DC H2'' . 34157 1
103 . 1 1 11 11 DC H3' H 1 4.816 0.000 . 1 . . . . A 11 DC H3' . 34157 1
104 . 1 1 11 11 DC H4' H 1 4.101 0.001 . 1 . . . . A 11 DC H4' . 34157 1
105 . 1 1 11 11 DC H5 H 1 5.614 0.001 . 1 . . . . A 11 DC H5 . 34157 1
106 . 1 1 11 11 DC H6 H 1 7.403 0.001 . 1 . . . . A 11 DC H6 . 34157 1
107 . 1 1 11 11 DC H41 H 1 8.395 0.496 . 1 . . . . A 11 DC H41 . 34157 1
108 . 1 1 11 11 DC H42 H 1 6.907 0.001 . 1 . . . . A 11 DC H42 . 34157 1
109 . 1 1 12 12 DG H1' H 1 6.148 0.000 . 1 . . . . A 12 DG H1' . 34157 1
110 . 1 1 12 12 DG H2' H 1 2.364 0.000 . 1 . . . . A 12 DG H2' . 34157 1
111 . 1 1 12 12 DG H2'' H 1 2.592 0.002 . 1 . . . . A 12 DG H2'' . 34157 1
112 . 1 1 12 12 DG H3' H 1 4.674 0.000 . 1 . . . . A 12 DG H3' . 34157 1
113 . 1 1 12 12 DG H4' H 1 4.174 0.000 . 1 . . . . A 12 DG H4' . 34157 1
114 . 1 1 12 12 DG H5' H 1 4.084 0.000 . 1 . . . . A 12 DG H5' . 34157 1
115 . 1 1 12 12 DG H8 H 1 7.933 0.001 . 1 . . . . A 12 DG H8 . 34157 1
116 . 2 1 1 1 DCZ H1' H 1 5.742 0.001 . 1 . . . . B 13 DCZ H1' . 34157 1
117 . 2 1 1 1 DCZ H2'1 H 1 1.965 0.001 . 1 . . . . B 13 DCZ H2'1 . 34157 1
118 . 2 1 1 1 DCZ H2'2 H 1 2.431 0.002 . 1 . . . . B 13 DCZ H2'2 . 34157 1
119 . 2 1 1 1 DCZ H3' H 1 4.720 0.002 . 1 . . . . B 13 DCZ H3' . 34157 1
120 . 2 1 1 1 DCZ H4' H 1 4.065 0.002 . 1 . . . . B 13 DCZ H4' . 34157 1
121 . 2 1 1 1 DCZ H5 H 1 5.912 0.001 . 1 . . . . B 13 DCZ H5 . 34157 1
122 . 2 1 1 1 DCZ H5'1 H 1 3.735 0.000 . 1 . . . . B 13 DCZ H5'1 . 34157 1
123 . 2 1 1 1 DCZ H5'2 H 1 3.735 0.000 . 1 . . . . B 13 DCZ H5'2 . 34157 1
124 . 2 1 1 1 DCZ H6 H 1 7.648 0.002 . 1 . . . . B 13 DCZ H6 . 34157 1
125 . 2 1 2 2 DG H1 H 1 12.824 0.001 . 1 . . . . B 14 DG H1 . 34157 1
126 . 2 1 2 2 DG H1' H 1 5.660 0.001 . 1 . . . . B 14 DG H1' . 34157 1
127 . 2 1 2 2 DG H2' H 1 2.764 0.001 . 1 . . . . B 14 DG H2' . 34157 1
128 . 2 1 2 2 DG H2'' H 1 2.884 0.002 . 1 . . . . B 14 DG H2'' . 34157 1
129 . 2 1 2 2 DG H3' H 1 5.037 0.002 . 1 . . . . B 14 DG H3' . 34157 1
130 . 2 1 2 2 DG H4' H 1 4.360 0.001 . 1 . . . . B 14 DG H4' . 34157 1
131 . 2 1 2 2 DG H5' H 1 4.002 0.000 . 1 . . . . B 14 DG H5' . 34157 1
132 . 2 1 2 2 DG H5'' H 1 4.115 0.000 . 1 . . . . B 14 DG H5'' . 34157 1
133 . 2 1 2 2 DG H8 H 1 8.001 0.001 . 1 . . . . B 14 DG H8 . 34157 1
134 . 2 1 3 3 DA H1' H 1 6.321 0.001 . 1 . . . . B 15 DA H1' . 34157 1
135 . 2 1 3 3 DA H2 H 1 7.891 0.001 . 1 . . . . B 15 DA H2 . 34157 1
136 . 2 1 3 3 DA H2' H 1 2.696 0.001 . 1 . . . . B 15 DA H2' . 34157 1
137 . 2 1 3 3 DA H2'' H 1 2.971 0.001 . 1 . . . . B 15 DA H2'' . 34157 1
138 . 2 1 3 3 DA H3' H 1 5.094 0.001 . 1 . . . . B 15 DA H3' . 34157 1
139 . 2 1 3 3 DA H4' H 1 4.500 0.001 . 1 . . . . B 15 DA H4' . 34157 1
140 . 2 1 3 3 DA H5' H 1 4.256 0.000 . 1 . . . . B 15 DA H5' . 34157 1
141 . 2 1 3 3 DA H5'' H 1 4.255 0.000 . 1 . . . . B 15 DA H5'' . 34157 1
142 . 2 1 3 3 DA H8 H 1 8.312 0.001 . 1 . . . . B 15 DA H8 . 34157 1
143 . 2 1 4 4 DT H1' H 1 5.611 0.001 . 1 . . . . B 16 DT H1' . 34157 1
144 . 2 1 4 4 DT H2' H 1 2.243 0.000 . 1 . . . . B 16 DT H2' . 34157 1
145 . 2 1 4 4 DT H2'' H 1 2.369 0.001 . 1 . . . . B 16 DT H2'' . 34157 1
146 . 2 1 4 4 DT H3 H 1 13.499 0.001 . 1 . . . . B 16 DT H3 . 34157 1
147 . 2 1 4 4 DT H3' H 1 4.921 0.002 . 1 . . . . B 16 DT H3' . 34157 1
148 . 2 1 4 4 DT H4' H 1 4.132 0.001 . 1 . . . . B 16 DT H4' . 34157 1
149 . 2 1 4 4 DT H5' H 1 4.178 0.000 . 1 . . . . B 16 DT H5' . 34157 1
150 . 2 1 4 4 DT H5'' H 1 4.248 0.001 . 1 . . . . B 16 DT H5'' . 34157 1
151 . 2 1 4 4 DT H6 H 1 7.270 0.001 . 1 . . . . B 16 DT H6 . 34157 1
152 . 2 1 4 4 DT H71 H 1 1.517 0.001 . 1 . . . . B 16 DT H71 . 34157 1
153 . 2 1 4 4 DT H72 H 1 1.517 0.001 . 1 . . . . B 16 DT H72 . 34157 1
154 . 2 1 4 4 DT H73 H 1 1.517 0.001 . 1 . . . . B 16 DT H73 . 34157 1
155 . 2 1 5 5 DG H1 H 1 12.739 0.000 . 1 . . . . B 17 DG H1 . 34157 1
156 . 2 1 5 5 DG H1' H 1 5.780 0.001 . 1 . . . . B 17 DG H1' . 34157 1
157 . 2 1 5 5 DG H2' H 1 2.633 0.001 . 1 . . . . B 17 DG H2' . 34157 1
158 . 2 1 5 5 DG H2'' H 1 2.634 0.000 . 1 . . . . B 17 DG H2'' . 34157 1
159 . 2 1 5 5 DG H3' H 1 4.990 0.002 . 1 . . . . B 17 DG H3' . 34157 1
160 . 2 1 5 5 DG H4' H 1 4.258 0.001 . 1 . . . . B 17 DG H4' . 34157 1
161 . 2 1 5 5 DG H5' H 1 3.644 0.001 . 1 . . . . B 17 DG H5' . 34157 1
162 . 2 1 5 5 DG H5'' H 1 3.837 0.000 . 1 . . . . B 17 DG H5'' . 34157 1
163 . 2 1 5 5 DG H8 H 1 8.002 0.000 . 1 . . . . B 17 DG H8 . 34157 1
164 . 2 1 5 5 DG H21 H 1 8.494 0.001 . 1 . . . . B 17 DG H21 . 34157 1
165 . 2 1 5 5 DG H22 H 1 7.239 0.001 . 1 . . . . B 17 DG H22 . 34157 1
166 . 2 1 6 6 DT H1' H 1 5.190 0.001 . 1 . . . . B 18 DT H1' . 34157 1
167 . 2 1 6 6 DT H2' H 1 1.697 0.001 . 1 . . . . B 18 DT H2' . 34157 1
168 . 2 1 6 6 DT H2'' H 1 2.244 0.001 . 1 . . . . B 18 DT H2'' . 34157 1
169 . 2 1 6 6 DT H3 H 1 12.776 0.002 . 1 . . . . B 18 DT H3 . 34157 1
170 . 2 1 6 6 DT H3' H 1 4.620 0.002 . 1 . . . . B 18 DT H3' . 34157 1
171 . 2 1 6 6 DT H4' H 1 2.046 0.001 . 1 . . . . B 18 DT H4' . 34157 1
172 . 2 1 6 6 DT H6 H 1 6.969 0.001 . 1 . . . . B 18 DT H6 . 34157 1
173 . 2 1 6 6 DT H71 H 1 1.438 0.001 . 1 . . . . B 18 DT H71 . 34157 1
174 . 2 1 6 6 DT H72 H 1 1.438 0.001 . 1 . . . . B 18 DT H72 . 34157 1
175 . 2 1 6 6 DT H73 H 1 1.438 0.001 . 1 . . . . B 18 DT H73 . 34157 1
176 . 2 1 7 7 DA H1' H 1 5.506 0.001 . 1 . . . . B 19 DA H1' . 34157 1
177 . 2 1 7 7 DA H2 H 1 8.022 0.002 . 1 . . . . B 19 DA H2 . 34157 1
178 . 2 1 7 7 DA H2' H 1 2.160 0.002 . 1 . . . . B 19 DA H2' . 34157 1
179 . 2 1 7 7 DA H2'' H 1 2.699 0.001 . 1 . . . . B 19 DA H2'' . 34157 1
180 . 2 1 7 7 DA H3' H 1 4.664 0.001 . 1 . . . . B 19 DA H3' . 34157 1
181 . 2 1 7 7 DA H4' H 1 2.604 0.001 . 1 . . . . B 19 DA H4' . 34157 1
182 . 2 1 7 7 DA H5' H 1 3.576 0.000 . 1 . . . . B 19 DA H5' . 34157 1
183 . 2 1 7 7 DA H5'' H 1 3.780 0.001 . 1 . . . . B 19 DA H5'' . 34157 1
184 . 2 1 7 7 DA H8 H 1 8.141 0.001 . 1 . . . . B 19 DA H8 . 34157 1
185 . 2 1 7 7 DA H61 H 1 8.446 0.001 . 1 . . . . B 19 DA H61 . 34157 1
186 . 2 1 7 7 DA H62 H 1 5.602 0.001 . 1 . . . . B 19 DA H62 . 34157 1
187 . 2 1 8 8 DC H1' H 1 5.331 0.001 . 1 . . . . B 20 DC H1' . 34157 1
188 . 2 1 8 8 DC H2' H 1 1.511 0.000 . 1 . . . . B 20 DC H2' . 34157 1
189 . 2 1 8 8 DC H2'' H 1 2.296 0.001 . 1 . . . . B 20 DC H2'' . 34157 1
190 . 2 1 8 8 DC H3' H 1 4.549 0.001 . 1 . . . . B 20 DC H3' . 34157 1
191 . 2 1 8 8 DC H4' H 1 2.316 0.002 . 1 . . . . B 20 DC H4' . 34157 1
192 . 2 1 8 8 DC H5 H 1 5.315 0.002 . 1 . . . . B 20 DC H5 . 34157 1
193 . 2 1 8 8 DC H5' H 1 3.445 0.000 . 1 . . . . B 20 DC H5' . 34157 1
194 . 2 1 8 8 DC H5'' H 1 3.777 0.000 . 1 . . . . B 20 DC H5'' . 34157 1
195 . 2 1 8 8 DC H6 H 1 6.914 0.001 . 1 . . . . B 20 DC H6 . 34157 1
196 . 2 1 8 8 DC H41 H 1 8.691 0.001 . 1 . . . . B 20 DC H41 . 34157 1
197 . 2 1 8 8 DC H42 H 1 6.501 0.001 . 1 . . . . B 20 DC H42 . 34157 1
198 . 2 1 9 9 DA H1' H 1 5.473 0.001 . 1 . . . . B 21 DA H1' . 34157 1
199 . 2 1 9 9 DA H2 H 1 7.711 0.001 . 1 . . . . B 21 DA H2 . 34157 1
200 . 2 1 9 9 DA H2' H 1 2.178 0.001 . 1 . . . . B 21 DA H2' . 34157 1
201 . 2 1 9 9 DA H2'' H 1 2.475 0.001 . 1 . . . . B 21 DA H2'' . 34157 1
202 . 2 1 9 9 DA H3' H 1 4.642 0.002 . 1 . . . . B 21 DA H3' . 34157 1
203 . 2 1 9 9 DA H4' H 1 2.886 0.001 . 1 . . . . B 21 DA H4' . 34157 1
204 . 2 1 9 9 DA H5' H 1 3.537 0.001 . 1 . . . . B 21 DA H5' . 34157 1
205 . 2 1 9 9 DA H8 H 1 8.299 0.001 . 1 . . . . B 21 DA H8 . 34157 1
206 . 2 1 10 10 DT H1' H 1 5.722 0.001 . 1 . . . . B 22 DT H1' . 34157 1
207 . 2 1 10 10 DT H2' H 1 1.835 0.001 . 1 . . . . B 22 DT H2' . 34157 1
208 . 2 1 10 10 DT H2'' H 1 2.097 0.001 . 1 . . . . B 22 DT H2'' . 34157 1
209 . 2 1 10 10 DT H3 H 1 13.818 0.001 . 1 . . . . B 22 DT H3 . 34157 1
210 . 2 1 10 10 DT H3' H 1 4.765 0.001 . 1 . . . . B 22 DT H3' . 34157 1
211 . 2 1 10 10 DT H4' H 1 3.741 0.000 . 1 . . . . B 22 DT H4' . 34157 1
212 . 2 1 10 10 DT H5' H 1 3.531 0.001 . 1 . . . . B 22 DT H5' . 34157 1
213 . 2 1 10 10 DT H5'' H 1 3.736 0.001 . 1 . . . . B 22 DT H5'' . 34157 1
214 . 2 1 10 10 DT H6 H 1 6.950 0.001 . 1 . . . . B 22 DT H6 . 34157 1
215 . 2 1 10 10 DT H71 H 1 1.355 0.002 . 1 . . . . B 22 DT H71 . 34157 1
216 . 2 1 10 10 DT H72 H 1 1.355 0.002 . 1 . . . . B 22 DT H72 . 34157 1
217 . 2 1 10 10 DT H73 H 1 1.355 0.002 . 1 . . . . B 22 DT H73 . 34157 1
218 . 2 1 11 11 DC H1' H 1 5.487 0.001 . 1 . . . . B 23 DC H1' . 34157 1
219 . 2 1 11 11 DC H2' H 1 2.095 0.000 . 1 . . . . B 23 DC H2' . 34157 1
220 . 2 1 11 11 DC H2'' H 1 2.308 0.002 . 1 . . . . B 23 DC H2'' . 34157 1
221 . 2 1 11 11 DC H3' H 1 4.791 0.001 . 1 . . . . B 23 DC H3' . 34157 1
222 . 2 1 11 11 DC H4' H 1 4.110 0.001 . 1 . . . . B 23 DC H4' . 34157 1
223 . 2 1 11 11 DC H5 H 1 5.649 0.001 . 1 . . . . B 23 DC H5 . 34157 1
224 . 2 1 11 11 DC H6 H 1 7.457 0.001 . 1 . . . . B 23 DC H6 . 34157 1
225 . 2 1 11 11 DC H41 H 1 8.630 0.000 . 1 . . . . B 23 DC H41 . 34157 1
226 . 2 1 11 11 DC H42 H 1 6.951 0.001 . 1 . . . . B 23 DC H42 . 34157 1
227 . 2 1 12 12 DG H1' H 1 6.170 0.001 . 1 . . . . B 24 DG H1' . 34157 1
228 . 2 1 12 12 DG H2' H 1 2.396 0.001 . 1 . . . . B 24 DG H2' . 34157 1
229 . 2 1 12 12 DG H2'' H 1 2.613 0.001 . 1 . . . . B 24 DG H2'' . 34157 1
230 . 2 1 12 12 DG H3' H 1 4.676 0.001 . 1 . . . . B 24 DG H3' . 34157 1
231 . 2 1 12 12 DG H4' H 1 4.162 0.000 . 1 . . . . B 24 DG H4' . 34157 1
232 . 2 1 12 12 DG H5' H 1 4.048 0.000 . 1 . . . . B 24 DG H5' . 34157 1
233 . 2 1 12 12 DG H8 H 1 7.941 0.001 . 1 . . . . B 24 DG H8 . 34157 1
234 . 3 2 1 1 9T5 H881 H 1 2.773 0.001 . 1 . . . . A 101 9T5 H881 . 34157 1
235 . 3 2 1 1 9T5 H83 H 1 8.968 0.001 . 2 . . . . A 101 9T5 H83 . 34157 1
236 . 4 3 1 1 PYB H H 1 9.737 0.002 . 1 . . . . A 102 PYB H . 34157 1
237 . 4 3 1 1 PYB HB1 H 1 5.990 0.001 . 1 . . . . A 102 PYB HB1 . 34157 1
238 . 4 3 1 1 PYB HB H 1 7.628 0.002 . 1 . . . . A 102 PYB HB . 34157 1
239 . 4 3 1 1 PYB HD1 H 1 3.921 0.002 . 1 . . . . A 102 PYB HD1 . 34157 1
240 . 5 3 1 1 PYB H H 1 10.486 0.001 . 1 . . . . A 103 PYB H . 34157 1
241 . 5 3 1 1 PYB HB1 H 1 6.231 0.001 . 1 . . . . A 103 PYB HB1 . 34157 1
242 . 5 3 1 1 PYB HB H 1 7.611 0.002 . 1 . . . . A 103 PYB HB . 34157 1
243 . 5 3 1 1 PYB HD1 H 1 3.782 0.000 . 1 . . . . A 103 PYB HD1 . 34157 1
244 . 6 3 1 1 PYB H H 1 9.158 0.001 . 1 . . . . A 104 PYB H . 34157 1
245 . 6 3 1 1 PYB HB1 H 1 6.428 0.001 . 1 . . . . A 104 PYB HB1 . 34157 1
246 . 6 3 1 1 PYB HB H 1 7.084 0.001 . 1 . . . . A 104 PYB HB . 34157 1
247 . 6 3 1 1 PYB HD1 H 1 3.542 0.001 . 1 . . . . A 104 PYB HD1 . 34157 1
248 . 7 4 1 1 ABU H H 1 8.230 0.001 . 1 . . . . A 105 ABU H . 34157 1
249 . 7 4 1 1 ABU HG1 H 1 2.173 0.001 . 2 . . . . A 105 ABU HG1 . 34157 1
250 . 7 4 1 1 ABU HG2 H 1 2.480 0.001 . 2 . . . . A 105 ABU HG2 . 34157 1
251 . 7 4 1 1 ABU HB1 H 1 1.555 0.001 . 2 . . . . A 105 ABU HB1 . 34157 1
252 . 7 4 1 1 ABU HB2 H 1 2.272 0.002 . 2 . . . . A 105 ABU HB2 . 34157 1
253 . 7 4 1 1 ABU HA2 H 1 2.769 0.001 . 2 . . . . A 105 ABU HA2 . 34157 1
254 . 7 4 1 1 ABU HA1 H 1 3.448 0.001 . 1 . . . . A 105 ABU HA1 . 34157 1
255 . 8 5 1 1 IMT H H 1 10.417 0.001 . 1 . . . . A 106 IMT H . 34157 1
256 . 8 5 1 1 IMT HB H 1 7.460 0.001 . 1 . . . . A 106 IMT HB . 34157 1
257 . 8 5 1 1 IMT HD1 H 1 3.947 0.001 . 1 . . . . A 106 IMT HD1 . 34157 1
258 . 9 3 1 1 PYB H H 1 9.769 0.002 . 1 . . . . A 107 PYB H . 34157 1
259 . 9 3 1 1 PYB HB1 H 1 6.170 0.001 . 1 . . . . A 107 PYB HB1 . 34157 1
260 . 9 3 1 1 PYB HB H 1 7.623 0.002 . 1 . . . . A 107 PYB HB . 34157 1
261 . 9 3 1 1 PYB HD1 H 1 3.871 0.002 . 1 . . . . A 107 PYB HD1 . 34157 1
262 . 10 3 1 1 PYB H H 1 10.677 0.001 . 1 . . . . A 108 PYB H . 34157 1
263 . 10 3 1 1 PYB HB1 H 1 6.363 0.002 . 1 . . . . A 108 PYB HB1 . 34157 1
264 . 10 3 1 1 PYB HB H 1 7.523 0.001 . 1 . . . . A 108 PYB HB . 34157 1
265 . 10 3 1 1 PYB HD1 H 1 3.775 0.001 . 1 . . . . A 108 PYB HD1 . 34157 1
266 . 11 3 1 1 PYB H H 1 9.270 0.001 . 1 . . . . A 109 PYB H . 34157 1
267 . 11 3 1 1 PYB HB1 H 1 6.307 0.002 . 1 . . . . A 109 PYB HB1 . 34157 1
268 . 11 3 1 1 PYB HB H 1 7.099 0.001 . 1 . . . . A 109 PYB HB . 34157 1
269 . 11 3 1 1 PYB HD1 H 1 3.543 0.001 . 1 . . . . A 109 PYB HD1 . 34157 1
270 . 12 6 1 1 9T8 H031 H 1 3.144 0.001 . 2 . . . . A 110 9T8 H031 . 34157 1
271 . 12 6 1 1 9T8 H032 H 1 3.170 0.001 . 2 . . . . A 110 9T8 H032 . 34157 1
272 . 12 6 1 1 9T8 H041 H 1 1.943 0.001 . 2 . . . . A 110 9T8 H041 . 34157 1
273 . 12 6 1 1 9T8 H042 H 1 2.137 0.002 . 2 . . . . A 110 9T8 H042 . 34157 1
274 . 12 6 1 1 9T8 H051 H 1 2.975 0.000 . 2 . . . . A 110 9T8 H051 . 34157 1
275 . 12 6 1 1 9T8 H052 H 1 3.612 0.001 . 2 . . . . A 110 9T8 H052 . 34157 1
276 . 12 6 1 1 9T8 H071 H 1 1.669 0.001 . 2 . . . . A 110 9T8 H071 . 34157 1
277 . 12 6 1 1 9T8 H072 H 1 2.078 0.001 . 2 . . . . A 110 9T8 H072 . 34157 1
278 . 12 6 1 1 9T8 H081 H 1 2.892 0.002 . 2 . . . . A 110 9T8 H081 . 34157 1
279 . 12 6 1 1 9T8 H082 H 1 3.779 0.000 . 2 . . . . A 110 9T8 H082 . 34157 1
280 . 12 6 1 1 9T8 HN02 H 1 8.135 0.001 . 1 . . . . A 110 9T8 HN02 . 34157 1
281 . 12 6 1 1 9T8 H1 H 1 9.156 0.002 . 1 . . . . A 110 9T8 H1 . 34157 1
stop_
save_