Content for NMR-STAR saveframe, "assigned_chemical_shifts_5"
save_assigned_chemical_shifts_5
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_5
_Assigned_chem_shift_list.Entry_ID 52355
_Assigned_chem_shift_list.ID 5
_Assigned_chem_shift_list.Name list_5
_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
5 '2D 1H-1H NOESY' . . . 52355 5
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 . . 52355 5
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 DC H1' H 1 5.764 0.01 . 1 . . . . . 1 DC H1' . 52355 5
2 . 1 . 1 1 1 DC H2' H 1 1.991 0.01 . 1 . . . . . 1 DC H2' . 52355 5
3 . 1 . 1 1 1 DC H2'' H 1 2.442 0.01 . 1 . . . . . 1 DC H2'' . 52355 5
4 . 1 . 1 1 1 DC H3' H 1 4.727 0.01 . 1 . . . . . 1 DC H3' . 52355 5
5 . 1 . 1 1 1 DC H4' H 1 4.090 0.01 . 1 . . . . . 1 DC H4' . 52355 5
6 . 1 . 1 1 1 DC H5 H 1 5.929 0.01 . 1 . . . . . 1 DC H5 . 52355 5
7 . 1 . 1 1 1 DC H6 H 1 7.659 0.01 . 1 . . . . . 1 DC H6 . 52355 5
8 . 1 . 1 2 2 DG H1 H 1 13.100 0.01 . 1 . . . . . 2 DG H1 . 52355 5
9 . 1 . 1 2 2 DG H1' H 1 5.920 0.01 . 1 . . . . . 2 DG H1' . 52355 5
10 . 1 . 1 2 2 DG H2' H 1 2.729 0.01 . 1 . . . . . 2 DG H2' . 52355 5
11 . 1 . 1 2 2 DG H2'' H 1 2.749 0.01 . 1 . . . . . 2 DG H2'' . 52355 5
12 . 1 . 1 2 2 DG H3' H 1 5.011 0.01 . 1 . . . . . 2 DG H3' . 52355 5
13 . 1 . 1 2 2 DG H4' H 1 4.390 0.01 . 1 . . . . . 2 DG H4' . 52355 5
14 . 1 . 1 2 2 DG H8 H 1 8.013 0.01 . 1 . . . . . 2 DG H8 . 52355 5
15 . 1 . 1 2 2 DG P P 31 -4.077 0.05 . 1 . . . . . 2 DG P . 52355 5
16 . 1 . 1 3 3 DC H1' H 1 6.035 0.01 . 1 . . . . . 3 DC H1' . 52355 5
17 . 1 . 1 3 3 DC H2' H 1 2.143 0.01 . 1 . . . . . 3 DC H2' . 52355 5
18 . 1 . 1 3 3 DC H2'' H 1 2.469 0.01 . 1 . . . . . 3 DC H2'' . 52355 5
19 . 1 . 1 3 3 DC H3' H 1 4.886 0.01 . 1 . . . . . 3 DC H3' . 52355 5
20 . 1 . 1 3 3 DC H4' H 1 4.288 0.01 . 1 . . . . . 3 DC H4' . 52355 5
21 . 1 . 1 3 3 DC H5 H 1 5.463 0.01 . 1 . . . . . 3 DC H5 . 52355 5
22 . 1 . 1 3 3 DC H6 H 1 7.479 0.01 . 1 . . . . . 3 DC H6 . 52355 5
23 . 1 . 1 3 3 DC H41 H 1 8.186 0.01 . 1 . . . . . 3 DC H41 . 52355 5
24 . 1 . 1 3 3 DC H42 H 1 6.429 0.01 . 1 . . . . . 3 DC H42 . 52355 5
25 . 1 . 1 3 3 DC P P 31 -4.188 0.05 . 1 . . . . . 3 DC P . 52355 5
26 . 1 . 1 4 4 DC H1' H 1 5.600 0.01 . 1 . . . . . 4 DC H1' . 52355 5
27 . 1 . 1 4 4 DC H2' H 1 1.787 0.01 . 1 . . . . . 4 DC H2' . 52355 5
28 . 1 . 1 4 4 DC H2'' H 1 2.185 0.01 . 1 . . . . . 4 DC H2'' . 52355 5
29 . 1 . 1 4 4 DC H3' H 1 4.815 0.01 . 1 . . . . . 4 DC H3' . 52355 5
30 . 1 . 1 4 4 DC H4' H 1 4.093 0.01 . 1 . . . . . 4 DC H4' . 52355 5
31 . 1 . 1 4 4 DC H5 H 1 5.612 0.01 . 1 . . . . . 4 DC H5 . 52355 5
32 . 1 . 1 4 4 DC H6 H 1 7.340 0.01 . 1 . . . . . 4 DC H6 . 52355 5
33 . 1 . 1 4 4 DC H41 H 1 8.493 0.01 . 1 . . . . . 4 DC H41 . 52355 5
34 . 1 . 1 4 4 DC H42 H 1 6.899 0.01 . 1 . . . . . 4 DC H42 . 52355 5
35 . 1 . 1 4 4 DC P P 31 -4.098 0.05 . 1 . . . . . 4 DC P . 52355 5
36 . 1 . 1 5 5 DG H1 H 1 12.909 0.01 . 1 . . . . . 5 DG H1 . 52355 5
37 . 1 . 1 5 5 DG H1' H 1 5.956 0.01 . 1 . . . . . 5 DG H1' . 52355 5
38 . 1 . 1 5 5 DG H2' H 1 2.157 0.01 . 1 . . . . . 5 DG H2' . 52355 5
39 . 1 . 1 5 5 DG H2'' H 1 2.428 0.01 . 1 . . . . . 5 DG H2'' . 52355 5
40 . 1 . 1 5 5 DG H3' H 1 4.966 0.01 . 1 . . . . . 5 DG H3' . 52355 5
41 . 1 . 1 5 5 DG H8 H 1 7.432 0.01 . 1 . . . . . 5 DG H8 . 52355 5
42 . 1 . 1 5 5 DG P P 31 -4.076 0.05 . 1 . . . . . 5 DG P . 52355 5
43 . 1 . 1 6 6 DG H1' H 1 5.712 0.01 . 1 . . . . . 6 DG H1' . 52355 5
44 . 1 . 1 6 6 DG H2' H 1 3.128 0.01 . 2 . . . . . 6 DG H2' . 52355 5
45 . 1 . 1 6 6 DG H2'' H 1 3.136 0.01 . 2 . . . . . 6 DG H2'' . 52355 5
46 . 1 . 1 6 6 DG H3' H 1 5.256 0.01 . 1 . . . . . 6 DG H3' . 52355 5
47 . 1 . 1 6 6 DG H8 H 1 8.295 0.01 . 1 . . . . . 6 DG H8 . 52355 5
48 . 1 . 1 6 6 DG P P 31 -4.794 0.05 . 1 . . . . . 6 DG P . 52355 5
49 . 1 . 1 7 7 DG H1 H 1 11.663 0.01 . 1 . . . . . 7 DG H1 . 52355 5
50 . 1 . 1 7 7 DG H1' H 1 6.398 0.01 . 1 . . . . . 7 DG H1' . 52355 5
51 . 1 . 1 7 7 DG H2' H 1 3.241 0.01 . 2 . . . . . 7 DG H2' . 52355 5
52 . 1 . 1 7 7 DG H2'' H 1 3.008 0.01 . 2 . . . . . 7 DG H2'' . 52355 5
53 . 1 . 1 7 7 DG H3' H 1 4.887 0.01 . 1 . . . . . 7 DG H3' . 52355 5
54 . 1 . 1 7 7 DG H8 H 1 8.444 0.01 . 1 . . . . . 7 DG H8 . 52355 5
55 . 1 . 1 7 7 DG P P 31 -3.901 0.05 . 1 . . . . . 7 DG P . 52355 5
56 . 1 . 1 8 8 DG H1 H 1 12.760 0.01 . 1 . . . . . 8 DG H1 . 52355 5
57 . 1 . 1 8 8 DG H1' H 1 6.009 0.01 . 1 . . . . . 8 DG H1' . 52355 5
58 . 1 . 1 8 8 DG H2' H 1 2.565 0.01 . 2 . . . . . 8 DG H2' . 52355 5
59 . 1 . 1 8 8 DG H2'' H 1 2.832 0.01 . 2 . . . . . 8 DG H2'' . 52355 5
60 . 1 . 1 8 8 DG H3' H 1 4.895 0.01 . 1 . . . . . 8 DG H3' . 52355 5
61 . 1 . 1 8 8 DG H8 H 1 7.770 0.01 . 1 . . . . . 8 DG H8 . 52355 5
62 . 1 . 1 8 8 DG P P 31 -4.101 0.05 . 1 . . . . . 8 DG P . 52355 5
63 . 1 . 1 9 9 DT H1' H 1 6.062 0.01 . 1 . . . . . 9 DT H1' . 52355 5
64 . 1 . 1 9 9 DT H2' H 1 1.851 0.01 . 2 . . . . . 9 DT H2' . 52355 5
65 . 1 . 1 9 9 DT H2'' H 1 2.424 0.01 . 2 . . . . . 9 DT H2'' . 52355 5
66 . 1 . 1 9 9 DT H3 H 1 13.901 0.01 . 1 . . . . . 9 DT H3 . 52355 5
67 . 1 . 1 9 9 DT H3' H 1 4.779 0.01 . 1 . . . . . 9 DT H3' . 52355 5
68 . 1 . 1 9 9 DT H6 H 1 7.437 0.01 . 1 . . . . . 9 DT H6 . 52355 5
69 . 1 . 1 9 9 DT H71 H 1 1.394 0.01 . 3 . . . . . 9 DT H71 . 52355 5
70 . 1 . 1 9 9 DT H72 H 1 1.394 0.01 . 3 . . . . . 9 DT H72 . 52355 5
71 . 1 . 1 9 9 DT H73 H 1 1.394 0.01 . 3 . . . . . 9 DT H73 . 52355 5
72 . 1 . 1 9 9 DT P P 31 -4.343 0.05 . 1 . . . . . 9 DT P . 52355 5
73 . 1 . 1 10 10 DC H1' H 1 6.015 0.01 . 1 . . . . . 10 DC H1' . 52355 5
74 . 1 . 1 10 10 DC H2' H 1 1.741 0.01 . 1 . . . . . 10 DC H2' . 52355 5
75 . 1 . 1 10 10 DC H2'' H 1 2.248 0.01 . 1 . . . . . 10 DC H2'' . 52355 5
76 . 1 . 1 10 10 DC H5 H 1 5.454 0.01 . 1 . . . . . 10 DC H5 . 52355 5
77 . 1 . 1 10 10 DC H6 H 1 7.222 0.01 . 1 . . . . . 10 DC H6 . 52355 5
78 . 1 . 1 10 10 DC H41 H 1 8.500 0.01 . 1 . . . . . 10 DC H41 . 52355 5
79 . 1 . 1 10 10 DC H42 H 1 7.128 0.01 . 1 . . . . . 10 DC H42 . 52355 5
80 . 1 . 1 10 10 DC P P 31 -4.522 0.05 . 1 . . . . . 10 DC P . 52355 5
81 . 1 . 1 11 11 DG H1' H 1 5.339 0.01 . 1 . . . . . 11 DG H1' . 52355 5
82 . 1 . 1 11 11 DG H2' H 1 2.697 0.01 . 1 . . . . . 11 DG H2' . 52355 5
83 . 1 . 1 11 11 DG H2'' H 1 2.558 0.01 . 1 . . . . . 11 DG H2'' . 52355 5
84 . 1 . 1 11 11 DG H3' H 1 4.940 0.01 . 1 . . . . . 11 DG H3' . 52355 5
85 . 1 . 1 11 11 DG H8 H 1 8.125 0.01 . 1 . . . . . 11 DG H8 . 52355 5
86 . 1 . 1 12 12 DA H1' H 1 5.978 0.01 . 1 . . . . . 12 DA H1' . 52355 5
87 . 1 . 1 12 12 DA H2' H 1 2.261 0.01 . 1 . . . . . 12 DA H2' . 52355 5
88 . 1 . 1 12 12 DA H2'' H 1 2.322 0.01 . 1 . . . . . 12 DA H2'' . 52355 5
89 . 1 . 1 12 12 DA H3' H 1 4.578 0.01 . 1 . . . . . 12 DA H3' . 52355 5
90 . 1 . 1 12 12 DA H8 H 1 8.128 0.01 . 1 . . . . . 12 DA H8 . 52355 5
91 . 1 . 1 13 13 DA H1' H 1 6.242 0.01 . 1 . . . . . 13 DA H1' . 52355 5
92 . 1 . 1 13 13 DA H2' H 1 2.840 0.01 . 2 . . . . . 13 DA H2' . 52355 5
93 . 1 . 1 13 13 DA H2'' H 1 2.840 0.01 . 2 . . . . . 13 DA H2'' . 52355 5
94 . 1 . 1 13 13 DA H8 H 1 7.976 0.01 . 1 . . . . . 13 DA H8 . 52355 5
95 . 1 . 1 13 13 DA P P 31 -4.655 0.05 . 1 . . . . . 13 DA P . 52355 5
96 . 1 . 1 14 14 DG H1 H 1 12.955 0.01 . 1 . . . . . 14 DG H1 . 52355 5
97 . 1 . 1 14 14 DG H1' H 1 5.018 0.01 . 1 . . . . . 14 DG H1' . 52355 5
98 . 1 . 1 14 14 DG H2' H 1 2.659 0.01 . 1 . . . . . 14 DG H2' . 52355 5
99 . 1 . 1 14 14 DG H2'' H 1 2.550 0.01 . 1 . . . . . 14 DG H2'' . 52355 5
100 . 1 . 1 14 14 DG H3' H 1 4.913 0.01 . 1 . . . . . 14 DG H3' . 52355 5
101 . 1 . 1 14 14 DG H8 H 1 8.078 0.01 . 1 . . . . . 14 DG H8 . 52355 5
102 . 1 . 1 15 15 DA H1' H 1 6.247 0.01 . 1 . . . . . 15 DA H1' . 52355 5
103 . 1 . 1 15 15 DA H2 H 1 8.062 0.01 . 1 . . . . . 15 DA H2 . 52355 5
104 . 1 . 1 15 15 DA H2' H 1 2.579 0.01 . 1 . . . . . 15 DA H2' . 52355 5
105 . 1 . 1 15 15 DA H2'' H 1 2.766 0.01 . 1 . . . . . 15 DA H2'' . 52355 5
106 . 1 . 1 15 15 DA H3' H 1 5.034 0.01 . 1 . . . . . 15 DA H3' . 52355 5
107 . 1 . 1 15 15 DA H8 H 1 8.196 0.01 . 1 . . . . . 15 DA H8 . 52355 5
108 . 1 . 1 15 15 DA P P 31 -3.493 0.05 . 1 . . . . . 15 DA P . 52355 5
109 . 1 . 1 16 16 DC H1' H 1 5.933 0.01 . 1 . . . . . 16 DC H1' . 52355 5
110 . 1 . 1 16 16 DC H2' H 1 1.982 0.01 . 1 . . . . . 16 DC H2' . 52355 5
111 . 1 . 1 16 16 DC H2'' H 1 2.308 0.01 . 1 . . . . . 16 DC H2'' . 52355 5
112 . 1 . 1 16 16 DC H3' H 1 4.816 0.01 . 1 . . . . . 16 DC H3' . 52355 5
113 . 1 . 1 16 16 DC H5 H 1 5.005 0.01 . 1 . . . . . 16 DC H5 . 52355 5
114 . 1 . 1 16 16 DC H6 H 1 7.247 0.01 . 1 . . . . . 16 DC H6 . 52355 5
115 . 1 . 1 16 16 DC H41 H 1 8.102 0.01 . 1 . . . . . 16 DC H41 . 52355 5
116 . 1 . 1 16 16 DC H42 H 1 6.542 0.01 . 1 . . . . . 16 DC H42 . 52355 5
117 . 1 . 1 17 17 DT H1' H 1 5.417 0.01 . 1 . . . . . 17 DT H1' . 52355 5
118 . 1 . 1 17 17 DT H2' H 1 0.552 0.01 . 1 . . . . . 17 DT H2' . 52355 5
119 . 1 . 1 17 17 DT H2'' H 1 1.551 0.01 . 1 . . . . . 17 DT H2'' . 52355 5
120 . 1 . 1 17 17 DT H3 H 1 10.840 0.01 . 1 . . . . . 17 DT H3 . 52355 5
121 . 1 . 1 17 17 DT H3' H 1 4.374 0.01 . 1 . . . . . 17 DT H3' . 52355 5
122 . 1 . 1 17 17 DT H4' H 1 4.182 0.01 . 1 . . . . . 17 DT H4' . 52355 5
123 . 1 . 1 17 17 DT H5' H 1 4.123 0.01 . 2 . . . . . 17 DT H5' . 52355 5
124 . 1 . 1 17 17 DT H5'' H 1 3.687 0.01 . 2 . . . . . 17 DT H5'' . 52355 5
125 . 1 . 1 17 17 DT H6 H 1 6.956 0.01 . 1 . . . . . 17 DT H6 . 52355 5
126 . 1 . 1 17 17 DT H71 H 1 1.325 0.01 . 3 . . . . . 17 DT H71 . 52355 5
127 . 1 . 1 17 17 DT H72 H 1 1.325 0.01 . 3 . . . . . 17 DT H72 . 52355 5
128 . 1 . 1 17 17 DT H73 H 1 1.325 0.01 . 3 . . . . . 17 DT H73 . 52355 5
129 . 1 . 1 17 17 DT P P 31 -5.006 0.05 . 1 . . . . . 17 DT P . 52355 5
130 . 1 . 1 18 18 DG H1 H 1 12.901 0.01 . 1 . . . . . 18 DG H1 . 52355 5
131 . 1 . 1 18 18 DG H1' H 1 5.357 0.01 . 1 . . . . . 18 DG H1' . 52355 5
132 . 1 . 1 18 18 DG H2' H 1 2.840 0.01 . 1 . . . . . 18 DG H2' . 52355 5
133 . 1 . 1 18 18 DG H2'' H 1 2.476 0.01 . 1 . . . . . 18 DG H2'' . 52355 5
134 . 1 . 1 18 18 DG H3' H 1 4.971 0.01 . 1 . . . . . 18 DG H3' . 52355 5
135 . 1 . 1 18 18 DG H8 H 1 7.973 0.01 . 1 . . . . . 18 DG H8 . 52355 5
136 . 1 . 1 18 18 DG P P 31 -4.410 0.05 . 1 . . . . . 18 DG P . 52355 5
137 . 1 . 1 19 19 DC H1' H 1 6.230 0.01 . 1 . . . . . 19 DC H1' . 52355 5
138 . 1 . 1 19 19 DC H2' H 1 2.003 0.01 . 1 . . . . . 19 DC H2' . 52355 5
139 . 1 . 1 19 19 DC H2'' H 1 2.334 0.01 . 1 . . . . . 19 DC H2'' . 52355 5
140 . 1 . 1 19 19 DC H3' H 1 4.941 0.01 . 1 . . . . . 19 DC H3' . 52355 5
141 . 1 . 1 19 19 DC H5 H 1 5.871 0.01 . 1 . . . . . 19 DC H5 . 52355 5
142 . 1 . 1 19 19 DC H6 H 1 7.577 0.01 . 1 . . . . . 19 DC H6 . 52355 5
143 . 1 . 1 19 19 DC H41 H 1 7.742 0.01 . 1 . . . . . 19 DC H41 . 52355 5
144 . 1 . 1 19 19 DC H42 H 1 6.680 0.01 . 1 . . . . . 19 DC H42 . 52355 5
145 . 1 . 1 19 19 DC P P 31 -2.814 0.05 . 1 . . . . . 19 DC P . 52355 5
146 . 1 . 1 20 20 DC H1' H 1 6.411 0.01 . 1 . . . . . 20 DC H1' . 52355 5
147 . 1 . 1 20 20 DC H2' H 1 2.801 0.01 . 2 . . . . . 20 DC H2' . 52355 5
148 . 1 . 1 20 20 DC H2'' H 1 2.771 0.01 . 2 . . . . . 20 DC H2'' . 52355 5
149 . 1 . 1 20 20 DC H3' H 1 5.150 0.01 . 1 . . . . . 20 DC H3' . 52355 5
150 . 1 . 1 20 20 DC H5 H 1 5.862 0.01 . 1 . . . . . 20 DC H5 . 52355 5
151 . 1 . 1 20 20 DC H6 H 1 7.852 0.01 . 1 . . . . . 20 DC H6 . 52355 5
152 . 1 . 1 20 20 DC H41 H 1 8.939 0.01 . 1 . . . . . 20 DC H41 . 52355 5
153 . 1 . 1 20 20 DC H42 H 1 6.971 0.01 . 1 . . . . . 20 DC H42 . 52355 5
154 . 1 . 1 20 20 DC P P 31 -4.915 0.05 . 1 . . . . . 20 DC P . 52355 5
155 . 1 . 1 21 21 DA H1' H 1 6.313 0.01 . 1 . . . . . 21 DA H1' . 52355 5
156 . 1 . 1 21 21 DA H2' H 1 2.170 0.01 . 1 . . . . . 21 DA H2' . 52355 5
157 . 1 . 1 21 21 DA H2'' H 1 2.808 0.01 . 1 . . . . . 21 DA H2'' . 52355 5
158 . 1 . 1 21 21 DA H3' H 1 5.208 0.01 . 1 . . . . . 21 DA H3' . 52355 5
159 . 1 . 1 21 21 DA H8 H 1 7.842 0.01 . 1 . . . . . 21 DA H8 . 52355 5
160 . 1 . 1 21 21 DA P P 31 -3.015 0.05 . 1 . . . . . 21 DA P . 52355 5
161 . 1 . 1 22 22 DG H1 H 1 13.130 0.01 . 1 . . . . . 22 DG H1 . 52355 5
162 . 1 . 1 22 22 DG H1' H 1 5.951 0.01 . 1 . . . . . 22 DG H1' . 52355 5
163 . 1 . 1 22 22 DG H2' H 1 2.477 0.01 . 2 . . . . . 22 DG H2' . 52355 5
164 . 1 . 1 22 22 DG H2'' H 1 2.536 0.01 . 2 . . . . . 22 DG H2'' . 52355 5
165 . 1 . 1 22 22 DG H3' H 1 4.697 0.01 . 1 . . . . . 22 DG H3' . 52355 5
166 . 1 . 1 22 22 DG H8 H 1 7.976 0.01 . 1 . . . . . 22 DG H8 . 52355 5
167 . 1 . 1 22 22 DG P P 31 -3.867 0.05 . 1 . . . . . 22 DG P . 52355 5
168 . 1 . 1 23 23 DC H1' H 1 5.460 0.01 . 1 . . . . . 23 DC H1' . 52355 5
169 . 1 . 1 23 23 DC H2' H 1 1.783 0.01 . 1 . . . . . 23 DC H2' . 52355 5
170 . 1 . 1 23 23 DC H2'' H 1 2.299 0.01 . 1 . . . . . 23 DC H2'' . 52355 5
171 . 1 . 1 23 23 DC H3' H 1 4.455 0.01 . 1 . . . . . 23 DC H3' . 52355 5
172 . 1 . 1 23 23 DC H5 H 1 6.166 0.01 . 1 . . . . . 23 DC H5 . 52355 5
173 . 1 . 1 23 23 DC H6 H 1 7.597 0.01 . 1 . . . . . 23 DC H6 . 52355 5
174 . 1 . 1 23 23 DC P P 31 -3.550 0.05 . 1 . . . . . 23 DC P . 52355 5
175 . 1 . 1 24 24 DG H1 H 1 13.205 0.01 . 1 . . . . . 24 DG H1 . 52355 5
176 . 1 . 1 24 24 DG H1' H 1 5.724 0.01 . 1 . . . . . 24 DG H1' . 52355 5
177 . 1 . 1 24 24 DG H2' H 1 2.555 0.01 . 1 . . . . . 24 DG H2' . 52355 5
178 . 1 . 1 24 24 DG H2'' H 1 2.799 0.01 . 1 . . . . . 24 DG H2'' . 52355 5
179 . 1 . 1 24 24 DG H3' H 1 4.720 0.01 . 1 . . . . . 24 DG H3' . 52355 5
180 . 1 . 1 24 24 DG H8 H 1 7.663 0.01 . 1 . . . . . 24 DG H8 . 52355 5
181 . 1 . 1 24 24 DG P P 31 -3.856 0.05 . 1 . . . . . 24 DG P . 52355 5
182 . 1 . 1 25 25 DG H1 H 1 12.516 0.01 . 1 . . . . . 25 DG H1 . 52355 5
183 . 1 . 1 25 25 DG H1' H 1 5.154 0.01 . 1 . . . . . 25 DG H1' . 52355 5
184 . 1 . 1 25 25 DG H2' H 1 2.462 0.01 . 1 . . . . . 25 DG H2' . 52355 5
185 . 1 . 1 25 25 DG H2'' H 1 2.298 0.01 . 1 . . . . . 25 DG H2'' . 52355 5
186 . 1 . 1 25 25 DG H3' H 1 4.780 0.01 . 1 . . . . . 25 DG H3' . 52355 5
187 . 1 . 1 25 25 DG H8 H 1 7.734 0.01 . 1 . . . . . 25 DG H8 . 52355 5
188 . 1 . 1 26 26 DC H1' H 1 6.056 0.01 . 1 . . . . . 26 DC H1' . 52355 5
189 . 1 . 1 26 26 DC H2' H 1 2.208 0.01 . 2 . . . . . 26 DC H2' . 52355 5
190 . 1 . 1 26 26 DC H2'' H 1 2.435 0.01 . 2 . . . . . 26 DC H2'' . 52355 5
191 . 1 . 1 26 26 DC H3' H 1 4.711 0.01 . 1 . . . . . 26 DC H3' . 52355 5
192 . 1 . 1 26 26 DC H5 H 1 5.645 0.01 . 1 . . . . . 26 DC H5 . 52355 5
193 . 1 . 1 26 26 DC H6 H 1 7.435 0.01 . 1 . . . . . 26 DC H6 . 52355 5
194 . 1 . 1 26 26 DC H41 H 1 8.061 0.01 . 1 . . . . . 26 DC H41 . 52355 5
195 . 1 . 1 26 26 DC H42 H 1 6.763 0.01 . 1 . . . . . 26 DC H42 . 52355 5
196 . 1 . 1 26 26 DC P P 31 -3.233 0.05 . 1 . . . . . 26 DC P . 52355 5
197 . 1 . 1 27 27 DT H1' H 1 6.131 0.01 . 1 . . . . . 27 DT H1' . 52355 5
198 . 1 . 1 27 27 DT H2' H 1 1.647 0.01 . 1 . . . . . 27 DT H2' . 52355 5
199 . 1 . 1 27 27 DT H2'' H 1 2.288 0.01 . 1 . . . . . 27 DT H2'' . 52355 5
200 . 1 . 1 27 27 DT H3' H 1 4.660 0.01 . 1 . . . . . 27 DT H3' . 52355 5
201 . 1 . 1 27 27 DT H6 H 1 7.231 0.01 . 1 . . . . . 27 DT H6 . 52355 5
202 . 1 . 1 27 27 DT H71 H 1 1.645 0.01 . 3 . . . . . 27 DT H71 . 52355 5
203 . 1 . 1 27 27 DT H72 H 1 1.645 0.01 . 3 . . . . . 27 DT H72 . 52355 5
204 . 1 . 1 27 27 DT H73 H 1 1.645 0.01 . 3 . . . . . 27 DT H73 . 52355 5
205 . 1 . 1 27 27 DT P P 31 -4.845 0.05 . 1 . . . . . 27 DT P . 52355 5
206 . 1 . 1 28 28 DC H1' H 1 5.985 0.01 . 1 . . . . . 28 DC H1' . 52355 5
207 . 1 . 1 28 28 DC H2' H 1 2.158 0.01 . 2 . . . . . 28 DC H2' . 52355 5
208 . 1 . 1 28 28 DC H2'' H 1 2.381 0.01 . 2 . . . . . 28 DC H2'' . 52355 5
209 . 1 . 1 28 28 DC H3' H 1 4.883 0.01 . 1 . . . . . 28 DC H3' . 52355 5
210 . 1 . 1 28 28 DC H5 H 1 5.571 0.01 . 1 . . . . . 28 DC H5 . 52355 5
211 . 1 . 1 28 28 DC H6 H 1 7.288 0.01 . 1 . . . . . 28 DC H6 . 52355 5
212 . 1 . 1 28 28 DC H41 H 1 8.689 0.01 . 1 . . . . . 28 DC H41 . 52355 5
213 . 1 . 1 28 28 DC H42 H 1 7.243 0.01 . 1 . . . . . 28 DC H42 . 52355 5
214 . 1 . 1 28 28 DC P P 31 -4.654 0.05 . 1 . . . . . 28 DC P . 52355 5
215 . 1 . 1 29 29 DG H3' H 1 5.002 0.01 . 1 . . . . . 29 DG H3' . 52355 5
216 . 1 . 1 29 29 DG H8 H 1 8.123 0.01 . 1 . . . . . 29 DG H8 . 52355 5
217 . 1 . 1 30 30 DA H1' H 1 5.097 0.01 . 1 . . . . . 30 DA H1' . 52355 5
218 . 1 . 1 30 30 DA H2' H 1 1.326 0.01 . 2 . . . . . 30 DA H2' . 52355 5
219 . 1 . 1 30 30 DA H2'' H 1 2.287 0.01 . 2 . . . . . 30 DA H2'' . 52355 5
220 . 1 . 1 30 30 DA H3' H 1 4.643 0.01 . 1 . . . . . 30 DA H3' . 52355 5
221 . 1 . 1 30 30 DA H8 H 1 8.051 0.01 . 1 . . . . . 30 DA H8 . 52355 5
222 . 1 . 1 30 30 DA P P 31 -2.622 0.05 . 1 . . . . . 30 DA P . 52355 5
223 . 1 . 1 31 31 DC H1' H 1 4.894 0.01 . 1 . . . . . 31 DC H1' . 52355 5
224 . 1 . 1 31 31 DC H2' H 1 2.186 0.01 . 1 . . . . . 31 DC H2' . 52355 5
225 . 1 . 1 31 31 DC H2'' H 1 2.298 0.01 . 1 . . . . . 31 DC H2'' . 52355 5
226 . 1 . 1 31 31 DC H3' H 1 4.790 0.01 . 1 . . . . . 31 DC H3' . 52355 5
227 . 1 . 1 31 31 DC H5 H 1 5.753 0.01 . 1 . . . . . 31 DC H5 . 52355 5
228 . 1 . 1 31 31 DC H6 H 1 7.438 0.01 . 1 . . . . . 31 DC H6 . 52355 5
229 . 1 . 1 31 31 DC H41 H 1 8.494 0.01 . 1 . . . . . 31 DC H41 . 52355 5
230 . 1 . 1 31 31 DC H42 H 1 7.028 0.01 . 1 . . . . . 31 DC H42 . 52355 5
231 . 1 . 1 31 31 DC P P 31 -4.788 0.05 . 1 . . . . . 31 DC P . 52355 5
232 . 1 . 1 32 32 DG H1 H 1 13.204 0.01 . 1 . . . . . 32 DG H1 . 52355 5
233 . 1 . 1 32 32 DG H1' H 1 5.690 0.01 . 1 . . . . . 32 DG H1' . 52355 5
234 . 1 . 1 32 32 DG H2' H 1 2.721 0.01 . 1 . . . . . 32 DG H2' . 52355 5
235 . 1 . 1 32 32 DG H2'' H 1 2.820 0.01 . 1 . . . . . 32 DG H2'' . 52355 5
236 . 1 . 1 32 32 DG H3' H 1 5.042 0.01 . 1 . . . . . 32 DG H3' . 52355 5
237 . 1 . 1 32 32 DG H8 H 1 7.839 0.01 . 1 . . . . . 32 DG H8 . 52355 5
238 . 1 . 1 32 32 DG P P 31 -3.377 0.05 . 1 . . . . . 32 DG P . 52355 5
239 . 1 . 1 33 33 DG H1 H 1 13.027 0.01 . 1 . . . . . 33 DG H1 . 52355 5
240 . 1 . 1 33 33 DG H1' H 1 5.882 0.01 . 1 . . . . . 33 DG H1' . 52355 5
241 . 1 . 1 33 33 DG H2' H 1 2.593 0.01 . 1 . . . . . 33 DG H2' . 52355 5
242 . 1 . 1 33 33 DG H2'' H 1 2.723 0.01 . 1 . . . . . 33 DG H2'' . 52355 5
243 . 1 . 1 33 33 DG H3' H 1 5.021 0.01 . 1 . . . . . 33 DG H3' . 52355 5
244 . 1 . 1 33 33 DG H8 H 1 7.805 0.01 . 1 . . . . . 33 DG H8 . 52355 5
245 . 1 . 1 33 33 DG P P 31 -4.247 0.05 . 1 . . . . . 33 DG P . 52355 5
246 . 1 . 1 34 34 DC H1' H 1 5.742 0.01 . 1 . . . . . 34 DC H1' . 52355 5
247 . 1 . 1 34 34 DC H2' H 1 1.919 0.01 . 1 . . . . . 34 DC H2' . 52355 5
248 . 1 . 1 34 34 DC H2'' H 1 2.350 0.01 . 1 . . . . . 34 DC H2'' . 52355 5
249 . 1 . 1 34 34 DC H3' H 1 4.833 0.01 . 1 . . . . . 34 DC H3' . 52355 5
250 . 1 . 1 34 34 DC H5 H 1 5.450 0.01 . 1 . . . . . 34 DC H5 . 52355 5
251 . 1 . 1 34 34 DC H6 H 1 7.321 0.01 . 1 . . . . . 34 DC H6 . 52355 5
252 . 1 . 1 34 34 DC H41 H 1 8.451 0.01 . 1 . . . . . 34 DC H41 . 52355 5
253 . 1 . 1 34 34 DC H42 H 1 6.633 0.01 . 1 . . . . . 34 DC H42 . 52355 5
254 . 1 . 1 34 34 DC P P 31 -4.079 0.05 . 1 . . . . . 34 DC P . 52355 5
255 . 1 . 1 35 35 DG H1' H 1 6.172 0.01 . 1 . . . . . 35 DG H1' . 52355 5
256 . 1 . 1 35 35 DG H2' H 1 2.630 0.01 . 1 . . . . . 35 DG H2' . 52355 5
257 . 1 . 1 35 35 DG H2'' H 1 2.390 0.01 . 1 . . . . . 35 DG H2'' . 52355 5
258 . 1 . 1 35 35 DG H3' H 1 4.702 0.01 . 1 . . . . . 35 DG H3' . 52355 5
259 . 1 . 1 35 35 DG H8 H 1 7.947 0.01 . 1 . . . . . 35 DG H8 . 52355 5
260 . 1 . 1 35 35 DG P P 31 -3.934 0.05 . 1 . . . . . 35 DG P . 52355 5
stop_
save_