NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
398138 |
1tbk   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1tbk
save_distance_constraint_statistics_1
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 1
_Distance_constraint_stats_list.Constraint_count 497
_Distance_constraint_stats_list.Viol_count 119
_Distance_constraint_stats_list.Viol_total 14.372
_Distance_constraint_stats_list.Viol_max 0.040
_Distance_constraint_stats_list.Viol_rms 0.0022
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0002
_Distance_constraint_stats_list.Viol_average_violations_only 0.0110
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 G 0.013 0.006 10 0 "[ . 1 ]"
1 2 C 0.021 0.006 10 0 "[ . 1 ]"
1 3 G 0.038 0.011 11 0 "[ . 1 ]"
1 4 A 0.076 0.011 11 0 "[ . 1 ]"
1 5 G 0.044 0.009 3 0 "[ . 1 ]"
1 6 U 0.003 0.003 2 0 "[ . 1 ]"
1 7 U 0.078 0.013 9 0 "[ . 1 ]"
1 8 G 0.209 0.024 1 0 "[ . 1 ]"
1 9 A 0.387 0.039 10 0 "[ . 1 ]"
1 10 C 0.406 0.032 1 0 "[ . 1 ]"
1 11 U 0.179 0.040 3 0 "[ . 1 ]"
1 12 A 0.176 0.022 2 0 "[ . 1 ]"
1 13 C 0.020 0.011 2 0 "[ . 1 ]"
1 14 U 0.011 0.005 5 0 "[ . 1 ]"
1 15 C 0.011 0.004 10 0 "[ . 1 ]"
1 16 G 0.006 0.003 5 0 "[ . 1 ]"
1 17 C 0.006 0.003 5 0 "[ . 1 ]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 G H1' 1 1 G H3' 4.000 . 4.100 3.890 3.885 3.897 . 0 0 "[ . 1 ]" 1
2 1 1 G H1' 1 1 G H5' 5.000 . 5.500 4.724 4.634 4.823 . 0 0 "[ . 1 ]" 1
3 1 1 G H1' 1 1 G H5'' 5.000 . 5.500 5.252 5.231 5.265 . 0 0 "[ . 1 ]" 1
4 1 1 G H1' 1 1 G H8 4.000 . 4.100 3.778 3.679 3.822 . 0 0 "[ . 1 ]" 1
5 1 1 G H2' 1 1 G H3' 3.000 . 3.000 2.356 2.353 2.358 . 0 0 "[ . 1 ]" 1
6 1 1 G H2' 1 1 G H4' 4.000 . 4.100 3.900 3.892 3.902 . 0 0 "[ . 1 ]" 1
7 1 1 G H2' 1 1 G H5' 5.000 . 5.500 5.251 5.183 5.314 . 0 0 "[ . 1 ]" 1
8 1 1 G H2' 1 1 G H5'' 5.000 . 5.500 4.904 4.777 5.034 . 0 0 "[ . 1 ]" 1
9 1 1 G H2' 1 1 G H8 5.000 . 5.500 3.812 3.660 4.087 . 0 0 "[ . 1 ]" 1
10 1 1 G H2' 1 2 C H5'' 5.000 . 7.000 5.841 5.644 6.141 . 0 0 "[ . 1 ]" 1
11 1 1 G H2' 1 2 C H1' 5.000 . 5.500 4.385 3.841 5.108 . 0 0 "[ . 1 ]" 1
12 1 1 G H2' 1 2 C H5 5.000 . 5.500 3.129 2.674 3.428 . 0 0 "[ . 1 ]" 1
13 1 1 G H2' 1 2 C H6 3.000 . 3.000 2.703 2.413 2.993 . 0 0 "[ . 1 ]" 1
14 1 1 G H3' 1 1 G H5'' 5.000 . 5.500 2.850 2.664 3.048 . 0 0 "[ . 1 ]" 1
15 1 1 G H3' 1 1 G H5' 5.000 . 5.500 3.616 3.569 3.652 . 0 0 "[ . 1 ]" 1
16 1 1 G H3' 1 1 G H8 4.000 . 4.100 2.923 2.706 3.349 . 0 0 "[ . 1 ]" 1
17 1 1 G H3' 1 2 C H5 5.000 . 5.500 2.339 2.316 2.366 . 0 0 "[ . 1 ]" 1
18 1 1 G H3' 1 2 C H5'' 5.000 . 7.000 5.286 5.060 5.405 . 0 0 "[ . 1 ]" 1
19 1 1 G H3' 1 2 C H6 3.000 . 3.000 2.658 2.504 2.765 . 0 0 "[ . 1 ]" 1
20 1 1 G H4' 1 1 G H5'' 3.000 . 3.000 2.431 2.358 2.517 . 0 0 "[ . 1 ]" 1
21 1 1 G H4' 1 1 G H5' 5.000 . 5.500 2.506 2.418 2.594 . 0 0 "[ . 1 ]" 1
22 1 1 G H4' 1 1 G H8 5.000 . 5.500 4.216 4.181 4.290 . 0 0 "[ . 1 ]" 1
23 1 1 G H4' 1 2 C H5 5.000 . 7.000 5.320 5.212 5.374 . 0 0 "[ . 1 ]" 1
24 1 1 G H4' 1 2 C H6 5.000 . 5.500 5.073 4.925 5.296 . 0 0 "[ . 1 ]" 1
25 1 1 G H5'' 1 2 C H5 5.000 . 5.500 4.764 4.394 5.100 . 0 0 "[ . 1 ]" 1
26 1 1 G H5' 1 2 C H5 5.000 . 5.500 5.476 5.405 5.506 0.006 10 0 "[ . 1 ]" 1
27 1 1 G H5' 1 1 G H8 5.000 . 5.500 3.392 3.199 3.592 . 0 0 "[ . 1 ]" 1
28 1 1 G H5'' 1 1 G H8 5.000 . 5.500 3.942 3.733 4.118 . 0 0 "[ . 1 ]" 1
29 1 1 G H8 1 2 C H5 5.000 . 7.000 3.466 3.064 3.847 . 0 0 "[ . 1 ]" 1
30 1 1 G H8 1 2 C H6 5.000 . 5.500 5.139 4.776 5.444 . 0 0 "[ . 1 ]" 1
31 1 2 C H1' 1 2 C H3' 4.000 . 4.100 3.891 3.880 3.902 . 0 0 "[ . 1 ]" 1
32 1 2 C H1' 1 2 C H5' 5.000 . 5.500 4.892 4.865 4.918 . 0 0 "[ . 1 ]" 1
33 1 2 C H1' 1 2 C H5'' 5.000 . 5.500 5.190 5.181 5.206 . 0 0 "[ . 1 ]" 1
34 1 2 C H1' 1 2 C H5 5.000 . 5.500 5.333 5.301 5.364 . 0 0 "[ . 1 ]" 1
35 1 2 C H1' 1 2 C H6 4.000 . 4.100 3.573 3.526 3.615 . 0 0 "[ . 1 ]" 1
36 1 2 C H1' 1 3 G H5' 5.000 . 7.000 6.828 6.599 7.005 0.005 5 0 "[ . 1 ]" 1
37 1 2 C H1' 1 3 G H8 5.000 . 5.500 5.234 5.086 5.414 . 0 0 "[ . 1 ]" 1
38 1 2 C H1' 1 16 G H1 6.000 2.800 7.000 5.153 5.025 5.298 . 0 0 "[ . 1 ]" 1
39 1 2 C H2' 1 2 C H6 4.000 . 4.100 3.823 3.717 3.935 . 0 0 "[ . 1 ]" 1
40 1 2 C H2' 1 3 G H8 4.000 . 4.100 2.552 2.379 2.697 . 0 0 "[ . 1 ]" 1
41 1 2 C H3' 1 2 C H6 4.000 . 4.100 2.961 2.720 3.156 . 0 0 "[ . 1 ]" 1
42 1 2 C H3' 1 3 G H8 4.000 . 4.100 2.661 2.415 2.896 . 0 0 "[ . 1 ]" 1
43 1 2 C H4' 1 2 C H6 5.000 . 5.500 3.961 3.862 4.038 . 0 0 "[ . 1 ]" 1
44 1 2 C H5' 1 2 C H6 5.000 . 5.500 3.530 3.404 3.697 . 0 0 "[ . 1 ]" 1
45 1 2 C H5'' 1 2 C H6 4.000 . 4.100 3.634 3.378 3.853 . 0 0 "[ . 1 ]" 1
46 1 2 C H41 1 16 G H1 4.500 . 5.500 2.756 2.575 2.939 . 0 0 "[ . 1 ]" 1
47 1 2 C H42 1 16 G H1 4.500 . 5.500 4.236 4.105 4.380 . 0 0 "[ . 1 ]" 1
48 1 2 C Q4 1 2 C H6 4.500 . 5.500 4.378 4.377 4.379 . 0 0 "[ . 1 ]" 1
49 1 2 C Q4 1 3 G H21 6.000 . 7.000 6.032 5.564 6.234 . 0 0 "[ . 1 ]" 1
50 1 2 C H6 1 3 G H8 5.000 . 5.500 5.208 4.738 5.503 0.003 6 0 "[ . 1 ]" 1
51 1 3 G H1' 1 3 G H3' 4.000 . 4.100 3.888 3.879 3.897 . 0 0 "[ . 1 ]" 1
52 1 3 G H1' 1 3 G H5'' 5.000 . 5.500 5.200 5.182 5.230 . 0 0 "[ . 1 ]" 1
53 1 3 G H1' 1 3 G H5' 5.000 . 5.500 4.888 4.828 4.916 . 0 0 "[ . 1 ]" 1
54 1 3 G H1 1 3 G H1' 6.000 . 7.000 6.043 5.985 6.087 . 0 0 "[ . 1 ]" 1
55 1 3 G H1' 1 3 G H8 4.000 . 4.100 3.755 3.713 3.810 . 0 0 "[ . 1 ]" 1
56 1 3 G H1' 1 4 A H8 5.000 . 5.500 5.067 5.013 5.106 . 0 0 "[ . 1 ]" 1
57 1 3 G H1' 1 16 G H1 6.000 . 7.000 6.471 6.106 6.774 . 0 0 "[ . 1 ]" 1
58 1 3 G H1' 1 16 G Q2 6.000 . 7.000 4.941 4.261 5.951 . 0 0 "[ . 1 ]" 1
59 1 3 G H2' 1 3 G H5'' 5.000 . 5.500 4.696 4.659 4.775 . 0 0 "[ . 1 ]" 1
60 1 3 G H2' 1 3 G H8 4.000 . 4.100 3.893 3.713 4.027 . 0 0 "[ . 1 ]" 1
61 1 3 G H2' 1 4 A H8 3.000 . 3.000 2.344 2.315 2.390 . 0 0 "[ . 1 ]" 1
62 1 3 G H3' 1 3 G H5'' 4.000 . 4.100 2.554 2.505 2.663 . 0 0 "[ . 1 ]" 1
63 1 3 G H3' 1 3 G H8 4.000 . 4.100 3.037 2.766 3.184 . 0 0 "[ . 1 ]" 1
64 1 3 G H3' 1 4 A H8 3.000 . 3.000 2.944 2.664 3.011 0.011 11 0 "[ . 1 ]" 1
65 1 3 G H4' 1 3 G H8 5.000 . 5.500 4.239 4.195 4.286 . 0 0 "[ . 1 ]" 1
66 1 3 G H5' 1 3 G H8 5.000 . 5.500 3.731 3.577 3.848 . 0 0 "[ . 1 ]" 1
67 1 3 G H5'' 1 3 G H8 4.000 . 4.100 3.792 3.657 3.867 . 0 0 "[ . 1 ]" 1
68 1 3 G H1 1 3 G Q2 4.500 . 5.500 2.194 2.192 2.195 . 0 0 "[ . 1 ]" 1
69 1 3 G H1 1 4 A H1' 4.500 . 5.500 5.475 5.330 5.511 0.011 2 0 "[ . 1 ]" 1
70 1 3 G H1 1 4 A H2 4.500 . 5.500 3.963 3.554 4.471 . 0 0 "[ . 1 ]" 1
71 1 3 G H1 1 4 A Q6 6.000 . 7.000 4.576 3.498 5.067 . 0 0 "[ . 1 ]" 1
72 1 3 G H1 1 4 A H8 6.000 . 7.000 6.585 6.071 6.839 . 0 0 "[ . 1 ]" 1
73 1 3 G H1 1 14 U H3 6.000 . 7.000 4.926 4.211 5.605 . 0 0 "[ . 1 ]" 1
74 1 3 G H1 1 15 C H41 4.500 . 5.500 2.964 2.849 3.049 . 0 0 "[ . 1 ]" 1
75 1 3 G H1 1 15 C H42 4.500 . 5.500 4.405 4.323 4.470 . 0 0 "[ . 1 ]" 1
76 1 3 G H1 1 15 C H5 6.000 . 7.000 5.253 5.209 5.292 . 0 0 "[ . 1 ]" 1
77 1 3 G H1 1 16 G H1' 6.000 . 7.000 6.543 5.823 6.874 . 0 0 "[ . 1 ]" 1
78 1 3 G H1 1 16 G H1 6.000 . 7.000 4.200 3.409 4.993 . 0 0 "[ . 1 ]" 1
79 1 3 G H1 1 16 G H8 6.000 . 7.000 6.313 5.543 6.821 . 0 0 "[ . 1 ]" 1
80 1 3 G H21 1 15 C Q4 4.500 . 5.500 4.865 4.759 4.901 . 0 0 "[ . 1 ]" 1
81 1 3 G Q2 1 4 A H1' 6.000 . 7.000 3.424 3.143 3.677 . 0 0 "[ . 1 ]" 1
82 1 3 G Q2 1 4 A H2 6.000 . 7.000 3.795 3.405 4.022 . 0 0 "[ . 1 ]" 1
83 1 3 G Q2 1 4 A H8 6.000 . 7.000 5.702 5.226 6.123 . 0 0 "[ . 1 ]" 1
84 1 3 G Q2 1 15 C H1' 4.500 . 5.500 4.067 3.973 4.161 . 0 0 "[ . 1 ]" 1
85 1 3 G Q2 1 15 C H41 4.500 . 5.500 4.878 4.775 4.906 . 0 0 "[ . 1 ]" 1
86 1 3 G Q2 1 16 G H1' 6.000 . 7.000 4.909 3.741 5.972 . 0 0 "[ . 1 ]" 1
87 1 3 G Q2 1 16 G H1 6.000 . 7.000 4.963 4.525 5.403 . 0 0 "[ . 1 ]" 1
88 1 3 G Q2 1 16 G H8 6.000 . 7.000 5.567 4.940 5.873 . 0 0 "[ . 1 ]" 1
89 1 3 G H8 1 4 A H8 5.000 . 5.500 5.106 4.789 5.309 . 0 0 "[ . 1 ]" 1
90 1 3 G H8 1 16 G H1 6.000 . 7.000 6.415 5.853 6.881 . 0 0 "[ . 1 ]" 1
91 1 4 A H1' 1 4 A H2 5.000 . 5.500 4.684 4.623 4.745 . 0 0 "[ . 1 ]" 1
92 1 4 A H1' 1 4 A H3' 4.000 . 4.100 3.895 3.890 3.899 . 0 0 "[ . 1 ]" 1
93 1 4 A H1' 1 4 A H5'' 5.000 . 5.500 5.195 5.179 5.221 . 0 0 "[ . 1 ]" 1
94 1 4 A H1' 1 4 A H5' 5.000 . 5.500 4.851 4.770 4.880 . 0 0 "[ . 1 ]" 1
95 1 4 A H1' 1 4 A H8 4.000 . 4.100 3.774 3.736 3.810 . 0 0 "[ . 1 ]" 1
96 1 4 A H1' 1 5 G H5' 5.000 . 7.000 5.193 4.608 5.479 . 0 0 "[ . 1 ]" 1
97 1 4 A H1' 1 5 G H5'' 5.000 . 7.000 6.702 6.199 6.942 . 0 0 "[ . 1 ]" 1
98 1 4 A H1' 1 5 G H8 5.000 . 5.500 5.057 4.962 5.091 . 0 0 "[ . 1 ]" 1
99 1 4 A H2 1 4 A H2' 5.000 . 5.500 4.906 4.710 5.103 . 0 0 "[ . 1 ]" 1
100 1 4 A H2' 1 4 A H8 4.000 . 4.100 3.801 3.674 3.931 . 0 0 "[ . 1 ]" 1
101 1 4 A H2' 1 5 G H1' 5.000 . 5.500 3.993 3.658 4.256 . 0 0 "[ . 1 ]" 1
102 1 4 A H2' 1 5 G H8 3.000 . 3.000 2.336 2.323 2.348 . 0 0 "[ . 1 ]" 1
103 1 4 A H2' 1 5 G H5'' 5.000 . 5.500 4.858 4.645 4.999 . 0 0 "[ . 1 ]" 1
104 1 4 A H3' 1 4 A H5'' 4.000 . 4.100 2.605 2.552 2.755 . 0 0 "[ . 1 ]" 1
105 1 4 A H3' 1 4 A H8 4.000 . 4.100 3.034 2.875 3.181 . 0 0 "[ . 1 ]" 1
106 1 4 A H3' 1 5 G H8 4.000 . 4.100 3.406 3.257 3.782 . 0 0 "[ . 1 ]" 1
107 1 4 A H4' 1 4 A H8 5.000 . 5.500 4.329 4.301 4.358 . 0 0 "[ . 1 ]" 1
108 1 4 A H5' 1 4 A H8 5.000 . 5.500 3.911 3.756 4.030 . 0 0 "[ . 1 ]" 1
109 1 4 A H5'' 1 4 A H8 4.000 . 4.100 4.002 3.924 4.082 . 0 0 "[ . 1 ]" 1
110 1 4 A H4' 1 5 G H8 5.000 . 7.000 5.640 5.505 5.810 . 0 0 "[ . 1 ]" 1
111 1 4 A H2 1 4 A Q6 4.500 . 5.500 4.259 4.257 4.260 . 0 0 "[ . 1 ]" 1
112 1 4 A H2 1 5 G H1' 4.000 . 4.100 4.063 3.903 4.108 0.008 5 0 "[ . 1 ]" 1
113 1 4 A H2 1 5 G H4' 5.000 . 7.000 6.963 6.815 7.009 0.009 3 0 "[ . 1 ]" 1
114 1 4 A H2 1 5 G H1 6.000 . 7.000 5.618 4.808 6.297 . 0 0 "[ . 1 ]" 1
115 1 4 A H2 1 5 G Q2 6.000 . 7.000 4.635 4.017 5.289 . 0 0 "[ . 1 ]" 1
116 1 4 A H2 1 15 C H1' 4.000 . 4.100 3.937 3.696 4.104 0.004 10 0 "[ . 1 ]" 1
117 1 4 A H2 1 14 U H1' 5.000 . 5.500 5.335 5.239 5.440 . 0 0 "[ . 1 ]" 1
118 1 4 A H2 1 14 U H2' 5.000 . 5.500 4.739 4.298 5.018 . 0 0 "[ . 1 ]" 1
119 1 4 A H2 1 14 U H3 4.500 . 5.500 2.910 2.641 3.158 . 0 0 "[ . 1 ]" 1
120 1 4 A H2 1 15 C H2' 5.000 . 7.000 5.856 5.576 6.119 . 0 0 "[ . 1 ]" 1
121 1 4 A Q6 1 5 G H1 6.000 . 7.000 4.901 3.569 5.809 . 0 0 "[ . 1 ]" 1
122 1 4 A Q6 1 13 C H41 6.000 . 7.000 4.827 2.993 5.696 . 0 0 "[ . 1 ]" 1
123 1 4 A Q6 1 13 C H42 6.000 . 7.000 5.412 3.690 6.238 . 0 0 "[ . 1 ]" 1
124 1 4 A Q6 1 15 C H41 6.000 . 7.000 3.919 3.347 4.819 . 0 0 "[ . 1 ]" 1
125 1 4 A Q6 1 15 C H42 6.000 . 7.000 4.588 3.970 5.598 . 0 0 "[ . 1 ]" 1
126 1 4 A H8 1 5 G H8 5.000 . 5.500 5.419 5.215 5.505 0.005 11 0 "[ . 1 ]" 1
127 1 5 G H1' 1 5 G H3' 4.000 . 4.100 3.894 3.886 3.901 . 0 0 "[ . 1 ]" 1
128 1 5 G H1' 1 5 G H5' 5.000 . 5.500 4.863 4.826 4.889 . 0 0 "[ . 1 ]" 1
129 1 5 G H1' 1 5 G H5'' 5.000 . 5.500 5.185 5.176 5.199 . 0 0 "[ . 1 ]" 1
130 1 5 G H1' 1 5 G H8 4.000 . 4.100 3.760 3.717 3.814 . 0 0 "[ . 1 ]" 1
131 1 5 G H1' 1 6 U H5' 5.000 . 7.000 5.409 4.438 6.113 . 0 0 "[ . 1 ]" 1
132 1 5 G H1' 1 6 U H5 5.000 . 7.000 6.039 5.565 6.477 . 0 0 "[ . 1 ]" 1
133 1 5 G H1' 1 6 U H6 5.000 . 5.500 5.086 5.053 5.120 . 0 0 "[ . 1 ]" 1
134 1 5 G H2' 1 5 G H5'' 5.000 . 5.500 4.706 4.678 4.732 . 0 0 "[ . 1 ]" 1
135 1 5 G H2' 1 5 G H8 5.000 . 5.500 3.829 3.613 3.952 . 0 0 "[ . 1 ]" 1
136 1 5 G H2' 1 6 U H5 5.000 . 5.500 3.610 3.216 4.090 . 0 0 "[ . 1 ]" 1
137 1 5 G H2' 1 6 U H6 3.000 . 3.000 2.342 2.319 2.369 . 0 0 "[ . 1 ]" 1
138 1 5 G H3' 1 5 G H5' 4.000 . 4.100 3.672 3.667 3.685 . 0 0 "[ . 1 ]" 1
139 1 5 G H3' 1 5 G H8 4.000 . 4.100 3.093 2.902 3.267 . 0 0 "[ . 1 ]" 1
140 1 5 G H3' 1 6 U H5 5.000 . 5.500 3.583 2.894 4.156 . 0 0 "[ . 1 ]" 1
141 1 5 G H3' 1 6 U H6 5.000 . 5.500 3.238 2.996 3.429 . 0 0 "[ . 1 ]" 1
142 1 5 G H4' 1 5 G H8 5.000 . 5.500 4.348 4.304 4.376 . 0 0 "[ . 1 ]" 1
143 1 5 G H4' 1 6 U H6 5.000 . 7.000 5.546 5.128 5.699 . 0 0 "[ . 1 ]" 1
144 1 5 G H5' 1 5 G H8 5.000 . 5.500 3.979 3.888 4.079 . 0 0 "[ . 1 ]" 1
145 1 5 G H5'' 1 5 G H8 4.000 . 4.100 4.040 3.932 4.104 0.004 6 0 "[ . 1 ]" 1
146 1 5 G H5' 1 6 U H6 5.000 . 7.000 6.838 6.517 6.999 . 0 0 "[ . 1 ]" 1
147 1 5 G H5'' 1 6 U H6 5.000 . 7.000 5.662 5.297 5.887 . 0 0 "[ . 1 ]" 1
148 1 5 G H1 1 5 G H21 6.000 . 7.000 2.218 2.217 2.220 . 0 0 "[ . 1 ]" 1
149 1 5 G H1 1 5 G Q2 6.000 . 7.000 2.195 2.194 2.196 . 0 0 "[ . 1 ]" 1
150 1 5 G H1 1 6 U H1' 6.000 . 7.000 5.684 4.877 6.743 . 0 0 "[ . 1 ]" 1
151 1 5 G H1 1 12 A H2 6.000 . 7.000 5.207 4.542 5.851 . 0 0 "[ . 1 ]" 1
152 1 5 G H1 1 12 A Q6 6.000 . 7.000 4.762 4.006 5.888 . 0 0 "[ . 1 ]" 1
153 1 5 G H1 1 13 C H41 4.500 . 5.500 2.967 2.798 3.190 . 0 0 "[ . 1 ]" 1
154 1 5 G H1 1 13 C H42 4.500 . 5.500 4.400 4.277 4.565 . 0 0 "[ . 1 ]" 1
155 1 5 G H1 1 14 U H1' 6.000 . 7.000 4.662 4.127 5.302 . 0 0 "[ . 1 ]" 1
156 1 5 G H1 1 14 U H3 6.000 . 7.000 3.904 3.509 4.627 . 0 0 "[ . 1 ]" 1
157 1 5 G Q2 1 6 U H1' 6.000 . 7.000 3.649 2.964 4.634 . 0 0 "[ . 1 ]" 1
158 1 5 G Q2 1 12 A H2 6.000 . 7.000 4.735 4.147 5.301 . 0 0 "[ . 1 ]" 1
159 1 5 G Q2 1 14 U H1' 6.000 . 7.000 2.345 2.010 2.771 . 0 0 "[ . 1 ]" 1
160 1 5 G Q2 1 14 U H3 6.000 . 7.000 3.977 3.494 4.721 . 0 0 "[ . 1 ]" 1
161 1 5 G H8 1 6 U H5 5.000 . 5.500 4.706 4.188 5.435 . 0 0 "[ . 1 ]" 1
162 1 5 G H8 1 6 U H6 5.000 . 5.500 5.341 4.988 5.503 0.003 2 0 "[ . 1 ]" 1
163 1 6 U H1' 1 6 U H3' 4.000 . 4.100 3.903 3.884 3.912 . 0 0 "[ . 1 ]" 1
164 1 6 U H1' 1 6 U H5' 5.000 . 5.500 4.837 4.802 4.886 . 0 0 "[ . 1 ]" 1
165 1 6 U H1' 1 6 U H5'' 5.000 . 5.500 5.170 5.144 5.205 . 0 0 "[ . 1 ]" 1
166 1 6 U H1' 1 6 U H5 5.000 . 7.000 5.352 5.310 5.389 . 0 0 "[ . 1 ]" 1
167 1 6 U H1' 1 6 U H6 4.000 . 4.100 3.600 3.535 3.652 . 0 0 "[ . 1 ]" 1
168 1 6 U H1' 1 7 U H5' 5.000 . 7.000 4.840 4.382 5.296 . 0 0 "[ . 1 ]" 1
169 1 6 U H1' 1 7 U H6 5.000 . 5.500 5.064 4.934 5.140 . 0 0 "[ . 1 ]" 1
170 1 6 U H1' 1 12 A H2 5.000 . 7.000 5.186 4.084 5.663 . 0 0 "[ . 1 ]" 1
171 1 6 U H2' 1 6 U H5'' 5.000 . 5.500 4.709 4.679 4.749 . 0 0 "[ . 1 ]" 1
172 1 6 U H2' 1 6 U H5 5.000 . 7.000 5.118 4.981 5.328 . 0 0 "[ . 1 ]" 1
173 1 6 U H2' 1 6 U H6 4.000 . 4.100 3.670 3.484 3.930 . 0 0 "[ . 1 ]" 1
174 1 6 U H2' 1 7 U H6 3.000 . 3.000 2.346 2.338 2.364 . 0 0 "[ . 1 ]" 1
175 1 6 U H2' 1 7 U H5 5.000 . 5.500 3.852 3.274 4.332 . 0 0 "[ . 1 ]" 1
176 1 6 U H3' 1 6 U H5'' 4.000 . 4.100 2.589 2.541 2.651 . 0 0 "[ . 1 ]" 1
177 1 6 U H3' 1 6 U H5 5.000 . 5.500 4.787 4.635 4.919 . 0 0 "[ . 1 ]" 1
178 1 6 U H3' 1 6 U H6 4.000 . 4.100 2.925 2.675 3.109 . 0 0 "[ . 1 ]" 1
179 1 6 U H3' 1 7 U H5 5.000 . 5.500 2.899 2.659 3.258 . 0 0 "[ . 1 ]" 1
180 1 6 U H3' 1 7 U H6 4.000 . 4.100 2.689 2.361 3.058 . 0 0 "[ . 1 ]" 1
181 1 6 U H4' 1 6 U H5'' 3.000 . 3.000 2.589 2.556 2.615 . 0 0 "[ . 1 ]" 1
182 1 6 U H4' 1 6 U H6 5.000 . 5.500 4.064 3.952 4.132 . 0 0 "[ . 1 ]" 1
183 1 6 U H4' 1 7 U H6 5.000 . 5.500 5.287 5.040 5.429 . 0 0 "[ . 1 ]" 1
184 1 6 U H5' 1 6 U H6 5.000 . 5.500 3.764 3.451 3.922 . 0 0 "[ . 1 ]" 1
185 1 6 U H5'' 1 6 U H6 5.000 . 5.500 3.862 3.678 4.041 . 0 0 "[ . 1 ]" 1
186 1 6 U H5' 1 7 U H6 5.000 . 7.000 6.336 6.010 6.679 . 0 0 "[ . 1 ]" 1
187 1 6 U H5 1 7 U H5 5.000 . 5.500 4.462 4.067 4.982 . 0 0 "[ . 1 ]" 1
188 1 6 U H5 1 7 U H6 5.000 . 7.000 5.645 5.034 6.203 . 0 0 "[ . 1 ]" 1
189 1 6 U H6 1 7 U H5' 5.000 . 7.000 6.475 6.173 6.720 . 0 0 "[ . 1 ]" 1
190 1 6 U H6 1 7 U H5 5.000 . 5.500 4.076 3.656 4.436 . 0 0 "[ . 1 ]" 1
191 1 6 U H6 1 7 U H6 5.000 . 5.500 4.713 4.231 5.195 . 0 0 "[ . 1 ]" 1
192 1 7 U H1' 1 7 U H3' 4.000 . 4.100 3.900 3.880 3.917 . 0 0 "[ . 1 ]" 1
193 1 7 U H1' 1 7 U H5' 5.000 . 5.500 4.789 4.685 4.873 . 0 0 "[ . 1 ]" 1
194 1 7 U H1' 1 7 U H5'' 5.000 . 5.500 5.211 5.157 5.259 . 0 0 "[ . 1 ]" 1
195 1 7 U H1' 1 7 U H5 5.000 . 7.000 5.362 5.309 5.405 . 0 0 "[ . 1 ]" 1
196 1 7 U H1' 1 7 U H6 4.000 . 4.100 3.614 3.537 3.674 . 0 0 "[ . 1 ]" 1
197 1 7 U H1' 1 8 G H5' 5.000 . 7.000 6.892 6.761 7.007 0.007 8 0 "[ . 1 ]" 1
198 1 7 U H1' 1 8 G H5'' 5.000 . 7.000 5.423 5.217 5.641 . 0 0 "[ . 1 ]" 1
199 1 7 U H1' 1 8 G H3' 5.000 . 7.000 5.030 4.684 5.417 . 0 0 "[ . 1 ]" 1
200 1 7 U H1' 1 8 G H8 5.000 . 7.000 6.004 5.385 6.325 . 0 0 "[ . 1 ]" 1
201 1 7 U H1' 1 9 A H8 5.000 . 5.500 5.040 4.490 5.508 0.008 3 0 "[ . 1 ]" 1
202 1 7 U H1' 1 10 C H5 5.000 . 5.500 5.178 4.141 5.513 0.013 9 0 "[ . 1 ]" 1
203 1 7 U H1' 1 12 A H2 4.000 . 4.100 3.948 3.665 4.105 0.005 5 0 "[ . 1 ]" 1
204 1 7 U H2' 1 7 U H6 4.000 . 4.100 3.655 3.483 3.893 . 0 0 "[ . 1 ]" 1
205 1 7 U H2' 1 8 G H1' 5.000 . 7.000 6.377 6.231 6.645 . 0 0 "[ . 1 ]" 1
206 1 7 U H2' 1 8 G H8 4.000 . 4.100 3.935 3.476 4.113 0.013 4 0 "[ . 1 ]" 1
207 1 7 U H2' 1 9 A H8 4.000 . 4.100 3.887 3.679 4.077 . 0 0 "[ . 1 ]" 1
208 1 7 U H3' 1 7 U H5'' 5.000 . 5.500 2.705 2.558 2.934 . 0 0 "[ . 1 ]" 1
209 1 7 U H3' 1 7 U H5 5.000 . 7.000 4.657 4.316 4.853 . 0 0 "[ . 1 ]" 1
210 1 7 U H3' 1 7 U H6 4.000 . 4.100 2.803 2.382 3.126 . 0 0 "[ . 1 ]" 1
211 1 7 U H3' 1 8 G H8 5.000 . 5.500 4.544 4.360 4.710 . 0 0 "[ . 1 ]" 1
212 1 7 U H3' 1 9 A H8 5.000 . 7.000 6.087 5.752 6.400 . 0 0 "[ . 1 ]" 1
213 1 7 U H4' 1 7 U H6 5.000 . 5.500 3.977 3.854 4.100 . 0 0 "[ . 1 ]" 1
214 1 7 U H4' 1 8 G H8 5.000 . 7.000 5.511 5.091 5.866 . 0 0 "[ . 1 ]" 1
215 1 7 U H5 1 7 U H5'' 5.000 . 7.000 5.884 5.661 6.134 . 0 0 "[ . 1 ]" 1
216 1 7 U H5 1 7 U H5' 5.000 . 7.000 5.663 5.231 6.107 . 0 0 "[ . 1 ]" 1
217 1 7 U H5'' 1 7 U H6 4.000 . 4.100 3.762 3.589 3.959 . 0 0 "[ . 1 ]" 1
218 1 7 U H5' 1 7 U H6 5.000 . 5.500 3.466 3.127 3.850 . 0 0 "[ . 1 ]" 1
219 1 7 U H6 1 8 G H5' 5.000 . 7.000 6.151 5.640 6.523 . 0 0 "[ . 1 ]" 1
220 1 8 G H1' 1 8 G H2' 4.000 . 4.100 2.724 2.711 2.735 . 0 0 "[ . 1 ]" 1
221 1 8 G H1' 1 8 G H3' 4.000 . 4.100 3.891 3.880 3.900 . 0 0 "[ . 1 ]" 1
222 1 8 G H1' 1 8 G H4' 4.000 . 4.100 3.561 3.521 3.599 . 0 0 "[ . 1 ]" 1
223 1 8 G H1' 1 8 G H5' 5.000 . 7.000 4.849 4.746 4.897 . 0 0 "[ . 1 ]" 1
224 1 8 G H1' 1 8 G H5'' 5.000 . 7.000 5.220 5.199 5.255 . 0 0 "[ . 1 ]" 1
225 1 8 G H1' 1 8 G Q2 6.000 . 7.000 4.464 4.363 4.564 . 0 0 "[ . 1 ]" 1
226 1 8 G H1' 1 8 G H8 4.000 . 4.100 3.784 3.727 3.841 . 0 0 "[ . 1 ]" 1
227 1 8 G H1' 1 9 A H1' 5.000 . 7.000 4.392 4.125 4.652 . 0 0 "[ . 1 ]" 1
228 1 8 G H1' 1 9 A H2' 5.000 . 7.000 6.855 6.691 7.003 0.003 1 0 "[ . 1 ]" 1
229 1 8 G H1' 1 9 A H4' 5.000 . 7.000 5.488 5.185 5.719 . 0 0 "[ . 1 ]" 1
230 1 8 G H1' 1 9 A H5'' 5.000 . 7.000 6.411 5.845 6.943 . 0 0 "[ . 1 ]" 1
231 1 8 G H1' 1 9 A H5' 5.000 . 7.000 5.915 4.744 6.935 . 0 0 "[ . 1 ]" 1
232 1 8 G H1' 1 9 A H8 5.000 . 5.500 4.980 4.749 5.174 . 0 0 "[ . 1 ]" 1
233 1 8 G H2' 1 8 G H4' 4.000 . 4.100 3.919 3.906 3.933 . 0 0 "[ . 1 ]" 1
234 1 8 G H2' 1 8 G H5'' 5.000 . 5.500 4.736 4.672 4.865 . 0 0 "[ . 1 ]" 1
235 1 8 G H2' 1 8 G H8 4.000 . 4.100 3.813 3.588 4.001 . 0 0 "[ . 1 ]" 1
236 1 8 G H2' 1 9 A H8 4.000 . 4.100 2.406 2.335 2.603 . 0 0 "[ . 1 ]" 1
237 1 8 G H3' 1 8 G H4' 3.000 . 3.000 3.016 3.011 3.024 0.024 1 0 "[ . 1 ]" 1
238 1 8 G H3' 1 8 G H5'' 4.000 . 4.100 2.604 2.514 2.786 . 0 0 "[ . 1 ]" 1
239 1 8 G H3' 1 8 G H8 4.000 . 4.100 2.876 2.563 3.139 . 0 0 "[ . 1 ]" 1
240 1 8 G H3' 1 9 A H8 4.000 . 4.100 2.634 2.349 2.859 . 0 0 "[ . 1 ]" 1
241 1 8 G H4' 1 8 G H5' 3.000 . 3.000 2.402 2.368 2.483 . 0 0 "[ . 1 ]" 1
242 1 8 G H4' 1 8 G H5'' 3.000 . 3.000 2.537 2.450 2.578 . 0 0 "[ . 1 ]" 1
243 1 8 G H4' 1 8 G H8 5.000 . 5.500 4.144 4.090 4.206 . 0 0 "[ . 1 ]" 1
244 1 8 G H4' 1 9 A H8 5.000 . 5.500 5.342 5.141 5.504 0.004 5 0 "[ . 1 ]" 1
245 1 8 G H5' 1 8 G H8 5.000 . 5.500 3.495 3.394 3.593 . 0 0 "[ . 1 ]" 1
246 1 8 G H5'' 1 8 G H8 5.000 . 5.500 3.621 3.409 3.758 . 0 0 "[ . 1 ]" 1
247 1 8 G H5' 1 9 A H8 5.000 . 7.000 6.218 6.001 6.496 . 0 0 "[ . 1 ]" 1
248 1 8 G H5'' 1 9 A H8 5.000 . 7.000 5.096 4.838 5.398 . 0 0 "[ . 1 ]" 1
249 1 8 G Q2 1 9 A H1' 4.500 . 5.500 2.924 2.613 3.403 . 0 0 "[ . 1 ]" 1
250 1 8 G Q2 1 9 A H2 6.000 . 7.000 4.099 3.646 5.339 . 0 0 "[ . 1 ]" 1
251 1 8 G Q2 1 10 C H1' 6.000 . 7.000 6.150 5.918 6.242 . 0 0 "[ . 1 ]" 1
252 1 8 G H8 1 9 A H8 5.000 . 5.500 4.438 3.436 5.150 . 0 0 "[ . 1 ]" 1
253 1 9 A H1' 1 9 A H2' 4.000 . 4.100 2.732 2.716 2.755 . 0 0 "[ . 1 ]" 1
254 1 9 A H1' 1 9 A H2 5.000 . 5.500 4.760 4.644 4.959 . 0 0 "[ . 1 ]" 1
255 1 9 A H1' 1 9 A H3' 4.000 . 4.100 3.889 3.885 3.895 . 0 0 "[ . 1 ]" 1
256 1 9 A H1' 1 9 A H4' 4.000 . 4.100 3.523 3.407 3.589 . 0 0 "[ . 1 ]" 1
257 1 9 A H1' 1 9 A H5' 5.000 . 7.000 5.062 4.860 5.270 . 0 0 "[ . 1 ]" 1
258 1 9 A H1' 1 9 A H5'' 5.000 . 7.000 4.914 4.515 5.209 . 0 0 "[ . 1 ]" 1
259 1 9 A H1' 1 9 A H8 4.000 . 4.100 3.728 3.602 3.801 . 0 0 "[ . 1 ]" 1
260 1 9 A H1' 1 10 C H5'' 5.000 . 7.000 6.543 6.134 7.013 0.013 8 0 "[ . 1 ]" 1
261 1 9 A H1' 1 10 C H5' 5.000 . 5.500 4.939 4.443 5.501 0.001 8 0 "[ . 1 ]" 1
262 1 9 A H1' 1 10 C H6 5.000 . 5.500 4.938 4.614 5.431 . 0 0 "[ . 1 ]" 1
263 1 9 A H2 1 9 A H2' 5.000 . 7.000 4.668 4.162 5.010 . 0 0 "[ . 1 ]" 1
264 1 9 A H2' 1 9 A H3' 3.000 . 3.000 2.356 2.352 2.358 . 0 0 "[ . 1 ]" 1
265 1 9 A H2' 1 9 A H5'' 5.000 . 5.500 4.498 4.249 4.732 . 0 0 "[ . 1 ]" 1
266 1 9 A H2' 1 9 A H5' 5.000 . 5.500 5.152 4.852 5.352 . 0 0 "[ . 1 ]" 1
267 1 9 A H2' 1 9 A H8 5.000 . 5.500 3.965 3.759 4.255 . 0 0 "[ . 1 ]" 1
268 1 9 A H2' 1 10 C H1' 5.000 . 7.000 3.730 3.303 4.132 . 0 0 "[ . 1 ]" 1
269 1 9 A H2' 1 10 C H5 5.000 . 5.500 4.266 3.584 5.042 . 0 0 "[ . 1 ]" 1
270 1 9 A H2' 1 10 C H6 4.000 . 4.100 2.471 2.326 3.254 . 0 0 "[ . 1 ]" 1
271 1 9 A H2 1 9 A Q6 6.000 . 7.000 4.259 4.258 4.260 . 0 0 "[ . 1 ]" 1
272 1 9 A H3' 1 9 A H4' 3.000 . 3.000 3.018 3.013 3.031 0.031 1 0 "[ . 1 ]" 1
273 1 9 A H3' 1 9 A H5'' 5.000 . 5.500 2.431 2.148 2.613 . 0 0 "[ . 1 ]" 1
274 1 9 A H3' 1 9 A H5' 5.000 . 5.500 3.299 2.766 3.681 . 0 0 "[ . 1 ]" 1
275 1 9 A H3' 1 9 A H8 4.000 . 4.100 3.144 2.811 3.593 . 0 0 "[ . 1 ]" 1
276 1 9 A H3' 1 10 C H5' 5.000 . 5.500 4.046 3.851 4.500 . 0 0 "[ . 1 ]" 1
277 1 9 A H3' 1 10 C H5'' 5.000 . 7.000 4.849 4.521 4.999 . 0 0 "[ . 1 ]" 1
278 1 9 A H3' 1 10 C H5 5.000 . 5.500 3.147 2.395 3.931 . 0 0 "[ . 1 ]" 1
279 1 9 A H3' 1 10 C H6 5.000 . 5.500 2.475 2.330 2.747 . 0 0 "[ . 1 ]" 1
280 1 9 A H4' 1 9 A H5'' 3.000 . 3.000 2.790 2.563 3.039 0.039 10 0 "[ . 1 ]" 1
281 1 9 A H4' 1 9 A H5' 3.000 . 3.000 2.386 2.296 2.454 . 0 0 "[ . 1 ]" 1
282 1 9 A H4' 1 9 A H8 5.000 . 5.500 4.237 4.136 4.308 . 0 0 "[ . 1 ]" 1
283 1 9 A H4' 1 10 C H5 5.000 . 7.000 5.967 5.290 6.767 . 0 0 "[ . 1 ]" 1
284 1 9 A H4' 1 10 C H6 5.000 . 5.500 5.271 5.075 5.495 . 0 0 "[ . 1 ]" 1
285 1 9 A H4' 1 11 U H1' 5.000 . 7.000 6.635 6.273 7.002 0.002 11 0 "[ . 1 ]" 1
286 1 9 A H5'' 1 9 A H8 5.000 . 5.500 3.150 2.342 3.957 . 0 0 "[ . 1 ]" 1
287 1 9 A H5' 1 9 A H8 5.000 . 5.500 3.893 3.549 4.213 . 0 0 "[ . 1 ]" 1
288 1 9 A H5' 1 10 C H5 5.000 . 7.000 5.418 4.204 6.640 . 0 0 "[ . 1 ]" 1
289 1 9 A H5'' 1 10 C H5 5.000 . 7.000 4.235 3.120 5.698 . 0 0 "[ . 1 ]" 1
290 1 9 A H5'' 1 10 C H6 5.000 . 7.000 4.637 3.840 5.191 . 0 0 "[ . 1 ]" 1
291 1 9 A H2 1 10 C H1' 4.000 . 4.100 3.378 2.669 4.100 . 0 0 "[ . 1 ]" 1
292 1 9 A H2 1 10 C H4' 5.000 . 7.000 5.430 4.361 6.302 . 0 0 "[ . 1 ]" 1
293 1 9 A H2 1 10 C H5' 5.000 . 7.000 6.474 5.480 7.000 . 0 0 "[ . 1 ]" 1
294 1 9 A Q6 1 9 A H8 6.000 . 7.000 4.663 4.662 4.665 . 0 0 "[ . 1 ]" 1
295 1 9 A H8 1 10 C H5 5.000 . 5.500 3.727 3.064 4.273 . 0 0 "[ . 1 ]" 1
296 1 9 A H8 1 10 C H6 5.000 . 5.500 4.370 3.424 5.190 . 0 0 "[ . 1 ]" 1
297 1 10 C H1' 1 10 C H2' 4.000 . 4.100 2.827 2.751 2.949 . 0 0 "[ . 1 ]" 1
298 1 10 C H1' 1 10 C H3' 5.000 . 5.500 3.920 3.895 3.951 . 0 0 "[ . 1 ]" 1
299 1 10 C H1' 1 10 C H4' 4.000 . 4.100 3.198 2.851 3.463 . 0 0 "[ . 1 ]" 1
300 1 10 C H1' 1 10 C H5' 5.000 . 7.000 4.756 4.616 4.853 . 0 0 "[ . 1 ]" 1
301 1 10 C H1' 1 10 C H5'' 5.000 . 7.000 5.124 4.955 5.211 . 0 0 "[ . 1 ]" 1
302 1 10 C H1' 1 10 C H5 5.000 . 7.000 5.350 5.314 5.403 . 0 0 "[ . 1 ]" 1
303 1 10 C H1' 1 10 C H6 4.000 . 4.100 3.600 3.547 3.676 . 0 0 "[ . 1 ]" 1
304 1 10 C H1' 1 11 U H5'' 5.000 . 7.000 6.703 6.448 7.010 0.010 3 0 "[ . 1 ]" 1
305 1 10 C H1' 1 11 U H6 5.000 . 7.000 6.428 6.121 6.996 . 0 0 "[ . 1 ]" 1
306 1 10 C H1' 1 12 A H8 5.000 . 7.000 6.988 6.940 7.022 0.022 2 0 "[ . 1 ]" 1
307 1 10 C H2' 1 10 C H3' 3.000 . 3.000 2.339 2.310 2.354 . 0 0 "[ . 1 ]" 1
308 1 10 C H2' 1 10 C H5'' 5.000 . 7.000 4.715 4.594 4.813 . 0 0 "[ . 1 ]" 1
309 1 10 C H2' 1 10 C H5 5.000 . 7.000 5.064 4.815 5.258 . 0 0 "[ . 1 ]" 1
310 1 10 C H2' 1 10 C H6 4.000 . 4.100 3.593 3.259 3.854 . 0 0 "[ . 1 ]" 1
311 1 10 C H2' 1 11 U H6 5.000 . 5.500 4.519 4.095 5.214 . 0 0 "[ . 1 ]" 1
312 1 10 C H2' 1 12 A H8 5.000 . 5.500 4.656 4.180 4.978 . 0 0 "[ . 1 ]" 1
313 1 10 C H3' 1 10 C H4' 3.000 . 3.000 3.025 3.011 3.032 0.032 1 0 "[ . 1 ]" 1
314 1 10 C H3' 1 10 C H5' 4.000 . 4.100 3.661 3.640 3.683 . 0 0 "[ . 1 ]" 1
315 1 10 C H3' 1 10 C H5'' 4.000 . 4.100 2.613 2.515 2.735 . 0 0 "[ . 1 ]" 1
316 1 10 C H3' 1 10 C H6 4.000 . 4.100 3.137 2.476 3.953 . 0 0 "[ . 1 ]" 1
317 1 10 C H3' 1 11 U H5 5.000 . 7.000 4.723 4.385 5.363 . 0 0 "[ . 1 ]" 1
318 1 10 C H3' 1 11 U H6 5.000 . 5.500 2.564 2.305 3.130 . 0 0 "[ . 1 ]" 1
319 1 10 C H4' 1 10 C H5'' 3.000 . 3.000 2.560 2.507 2.589 . 0 0 "[ . 1 ]" 1
320 1 10 C H4' 1 10 C H6 5.000 . 5.500 4.128 3.902 4.339 . 0 0 "[ . 1 ]" 1
321 1 10 C H4' 1 11 U H5 5.000 . 7.000 6.035 5.561 6.659 . 0 0 "[ . 1 ]" 1
322 1 10 C H4' 1 11 U H6 5.000 . 5.500 4.787 4.484 5.128 . 0 0 "[ . 1 ]" 1
323 1 10 C H5'' 1 10 C H6 5.000 . 5.500 4.093 3.457 4.751 . 0 0 "[ . 1 ]" 1
324 1 10 C H5' 1 10 C H6 5.000 . 5.500 3.833 3.426 4.275 . 0 0 "[ . 1 ]" 1
325 1 10 C H5'' 1 11 U H6 5.000 . 7.000 3.145 2.949 3.290 . 0 0 "[ . 1 ]" 1
326 1 10 C H5 1 10 C H6 3.000 . 3.000 2.451 2.450 2.452 . 0 0 "[ . 1 ]" 1
327 1 10 C H6 1 11 U H1' 5.000 . 7.000 3.360 2.783 4.179 . 0 0 "[ . 1 ]" 1
328 1 10 C H6 1 11 U H4' 5.000 . 7.000 4.323 3.990 4.701 . 0 0 "[ . 1 ]" 1
329 1 10 C H6 1 11 U H5' 5.000 . 7.000 5.648 4.908 6.995 . 0 0 "[ . 1 ]" 1
330 1 11 U H1' 1 11 U H2' 4.000 . 4.100 2.737 2.721 2.765 . 0 0 "[ . 1 ]" 1
331 1 11 U H1' 1 11 U H3' 5.000 . 5.500 3.896 3.885 3.905 . 0 0 "[ . 1 ]" 1
332 1 11 U H1' 1 11 U H4' 4.000 . 4.100 3.510 3.408 3.578 . 0 0 "[ . 1 ]" 1
333 1 11 U H1' 1 11 U H5' 5.000 . 7.000 5.087 4.990 5.240 . 0 0 "[ . 1 ]" 1
334 1 11 U H1' 1 11 U H5'' 5.000 . 7.000 4.954 4.523 5.141 . 0 0 "[ . 1 ]" 1
335 1 11 U H1' 1 12 A H8 5.000 . 5.500 4.492 4.278 4.565 . 0 0 "[ . 1 ]" 1
336 1 11 U H2' 1 11 U H6 4.000 . 4.100 3.975 3.836 4.061 . 0 0 "[ . 1 ]" 1
337 1 11 U H2' 1 12 A H8 4.000 . 4.100 4.101 4.067 4.112 0.012 2 0 "[ . 1 ]" 1
338 1 11 U H3' 1 11 U H5'' 4.000 . 4.100 2.359 2.289 2.546 . 0 0 "[ . 1 ]" 1
339 1 11 U H3' 1 11 U H5' 4.000 . 4.100 3.362 2.603 3.648 . 0 0 "[ . 1 ]" 1
340 1 11 U H3' 1 11 U H5 5.000 . 7.000 4.829 4.607 5.003 . 0 0 "[ . 1 ]" 1
341 1 11 U H3' 1 11 U H6 4.000 . 4.100 3.184 2.894 3.374 . 0 0 "[ . 1 ]" 1
342 1 11 U H3' 1 12 A H8 4.000 . 4.100 3.832 3.748 4.052 . 0 0 "[ . 1 ]" 1
343 1 11 U H4' 1 11 U H5'' 3.000 . 3.000 2.814 2.695 3.040 0.040 3 0 "[ . 1 ]" 1
344 1 11 U H4' 1 11 U H5' 3.000 . 3.000 2.347 2.272 2.554 . 0 0 "[ . 1 ]" 1
345 1 11 U H4' 1 11 U H5 5.000 . 7.000 6.335 6.267 6.447 . 0 0 "[ . 1 ]" 1
346 1 11 U H4' 1 11 U H6 5.000 . 5.500 3.949 3.862 4.060 . 0 0 "[ . 1 ]" 1
347 1 11 U H4' 1 12 A H1' 5.000 . 7.000 4.269 3.828 4.633 . 0 0 "[ . 1 ]" 1
348 1 11 U H4' 1 12 A H8 5.000 . 5.500 2.335 2.302 2.364 . 0 0 "[ . 1 ]" 1
349 1 11 U H5 1 11 U H5' 5.000 . 7.000 5.803 5.622 5.995 . 0 0 "[ . 1 ]" 1
350 1 11 U H5 1 11 U H5'' 5.000 . 7.000 4.952 4.177 5.554 . 0 0 "[ . 1 ]" 1
351 1 11 U H5'' 1 11 U H6 4.000 . 4.100 3.085 2.326 3.648 . 0 0 "[ . 1 ]" 1
352 1 11 U H5' 1 11 U H6 4.000 . 4.100 3.697 3.505 3.988 . 0 0 "[ . 1 ]" 1
353 1 11 U H5'' 1 12 A H8 5.000 . 5.500 4.440 4.205 4.931 . 0 0 "[ . 1 ]" 1
354 1 11 U H5' 1 12 A H8 5.000 . 7.000 4.219 3.877 4.471 . 0 0 "[ . 1 ]" 1
355 1 11 U H5' 1 12 A H1' 5.000 . 7.000 5.669 4.892 6.005 . 0 0 "[ . 1 ]" 1
356 1 11 U H5'' 1 12 A H1' 5.000 . 7.000 6.636 6.023 6.988 . 0 0 "[ . 1 ]" 1
357 1 11 U H6 1 12 A H8 5.000 . 7.000 5.889 5.772 5.997 . 0 0 "[ . 1 ]" 1
358 1 12 A H1' 1 12 A H2 5.000 . 5.500 4.837 4.738 4.870 . 0 0 "[ . 1 ]" 1
359 1 12 A H1' 1 12 A H3' 4.000 . 4.100 3.892 3.882 3.897 . 0 0 "[ . 1 ]" 1
360 1 12 A H1' 1 12 A H5' 5.000 . 5.500 4.702 4.628 4.781 . 0 0 "[ . 1 ]" 1
361 1 12 A H1' 1 12 A H5'' 5.000 . 7.000 5.245 5.223 5.265 . 0 0 "[ . 1 ]" 1
362 1 12 A H1' 1 12 A H8 4.000 . 4.100 3.681 3.660 3.743 . 0 0 "[ . 1 ]" 1
363 1 12 A H1' 1 13 C H1' 5.000 . 7.000 5.361 4.808 5.812 . 0 0 "[ . 1 ]" 1
364 1 12 A H1' 1 13 C H5 5.000 . 7.000 6.048 5.706 6.427 . 0 0 "[ . 1 ]" 1
365 1 12 A H1' 1 13 C H6 5.000 . 5.500 5.133 5.029 5.261 . 0 0 "[ . 1 ]" 1
366 1 12 A H2 1 12 A H2' 5.000 . 7.000 4.472 4.401 4.752 . 0 0 "[ . 1 ]" 1
367 1 12 A H2' 1 12 A H4' 4.000 . 4.100 3.887 3.873 3.901 . 0 0 "[ . 1 ]" 1
368 1 12 A H2' 1 12 A H5'' 5.000 . 7.000 4.933 4.821 5.029 . 0 0 "[ . 1 ]" 1
369 1 12 A H2' 1 12 A H8 4.000 . 4.100 4.068 3.904 4.108 0.008 9 0 "[ . 1 ]" 1
370 1 12 A H2' 1 13 C H1' 5.000 . 5.500 3.401 2.831 3.862 . 0 0 "[ . 1 ]" 1
371 1 12 A H2' 1 13 C H5 5.000 . 5.500 3.744 3.490 4.068 . 0 0 "[ . 1 ]" 1
372 1 12 A H2' 1 13 C H6 3.000 . 3.000 2.448 2.325 2.642 . 0 0 "[ . 1 ]" 1
373 1 12 A H3' 1 12 A H5'' 4.000 . 4.100 2.898 2.740 3.052 . 0 0 "[ . 1 ]" 1
374 1 12 A H3' 1 12 A H8 4.000 . 4.100 3.373 3.185 3.478 . 0 0 "[ . 1 ]" 1
375 1 12 A H3' 1 13 C H1' 5.000 . 7.000 5.398 4.844 5.833 . 0 0 "[ . 1 ]" 1
376 1 12 A H3' 1 13 C H5 5.000 . 5.500 2.967 2.733 3.311 . 0 0 "[ . 1 ]" 1
377 1 12 A H3' 1 13 C H6 4.000 . 4.100 2.627 2.452 2.911 . 0 0 "[ . 1 ]" 1
378 1 12 A H4' 1 12 A H5'' 3.000 . 3.000 2.416 2.355 2.494 . 0 0 "[ . 1 ]" 1
379 1 12 A H4' 1 12 A H8 5.000 . 5.500 4.340 4.289 4.411 . 0 0 "[ . 1 ]" 1
380 1 12 A H4' 1 13 C H6 5.000 . 7.000 5.045 4.895 5.251 . 0 0 "[ . 1 ]" 1
381 1 12 A H5' 1 12 A H8 5.000 . 5.500 3.445 3.155 3.752 . 0 0 "[ . 1 ]" 1
382 1 12 A H5'' 1 12 A H8 5.000 . 5.500 4.287 4.185 4.510 . 0 0 "[ . 1 ]" 1
383 1 12 A H5'' 1 13 C H6 5.000 . 7.000 5.229 4.871 5.608 . 0 0 "[ . 1 ]" 1
384 1 12 A H2 1 12 A Q6 4.500 . 5.500 4.259 4.258 4.259 . 0 0 "[ . 1 ]" 1
385 1 12 A H2 1 13 C H1' 4.000 . 4.100 3.893 3.491 4.089 . 0 0 "[ . 1 ]" 1
386 1 12 A H2 1 13 C Q4 6.000 . 7.000 5.848 5.358 6.193 . 0 0 "[ . 1 ]" 1
387 1 12 A Q6 1 12 A H8 6.000 . 7.000 4.663 4.661 4.665 . 0 0 "[ . 1 ]" 1
388 1 12 A Q6 1 13 C H41 6.000 . 7.000 4.049 3.383 4.841 . 0 0 "[ . 1 ]" 1
389 1 12 A Q6 1 13 C H42 6.000 . 7.000 4.584 3.850 5.207 . 0 0 "[ . 1 ]" 1
390 1 12 A H8 1 13 C H5 5.000 . 5.500 4.780 4.497 5.338 . 0 0 "[ . 1 ]" 1
391 1 12 A H8 1 13 C H6 5.000 . 5.500 5.470 5.422 5.511 0.011 2 0 "[ . 1 ]" 1
392 1 13 C H1' 1 13 C H3' 4.000 . 4.100 3.893 3.887 3.900 . 0 0 "[ . 1 ]" 1
393 1 13 C H1' 1 13 C H5' 5.000 . 5.500 4.884 4.859 4.910 . 0 0 "[ . 1 ]" 1
394 1 13 C H1' 1 13 C H5'' 5.000 . 5.500 5.187 5.169 5.206 . 0 0 "[ . 1 ]" 1
395 1 13 C H1' 1 13 C H5 5.000 . 7.000 5.317 5.285 5.339 . 0 0 "[ . 1 ]" 1
396 1 13 C H1' 1 13 C H6 4.000 . 4.100 3.551 3.504 3.582 . 0 0 "[ . 1 ]" 1
397 1 13 C H1' 1 14 U H5' 5.000 . 7.000 5.349 4.909 5.769 . 0 0 "[ . 1 ]" 1
398 1 13 C H1' 1 14 U H6 5.000 . 5.500 5.051 4.992 5.136 . 0 0 "[ . 1 ]" 1
399 1 13 C H2' 1 13 C H5'' 5.000 . 5.500 4.687 4.668 4.710 . 0 0 "[ . 1 ]" 1
400 1 13 C H2' 1 13 C H6 4.000 . 4.100 3.872 3.789 3.958 . 0 0 "[ . 1 ]" 1
401 1 13 C H2' 1 14 U H1' 5.000 . 5.500 3.853 3.555 4.429 . 0 0 "[ . 1 ]" 1
402 1 13 C H2' 1 14 U H5' 4.000 . 4.100 3.949 3.660 4.105 0.005 5 0 "[ . 1 ]" 1
403 1 13 C H2' 1 14 U H5 5.000 . 5.500 3.550 2.985 3.849 . 0 0 "[ . 1 ]" 1
404 1 13 C H2' 1 14 U H6 3.000 . 3.000 2.361 2.333 2.423 . 0 0 "[ . 1 ]" 1
405 1 13 C H3' 1 13 C H6 4.000 . 4.100 3.071 2.944 3.295 . 0 0 "[ . 1 ]" 1
406 1 13 C H3' 1 14 U H5 5.000 . 5.500 3.477 3.016 3.915 . 0 0 "[ . 1 ]" 1
407 1 13 C H3' 1 14 U H6 4.000 . 4.100 3.272 3.082 3.518 . 0 0 "[ . 1 ]" 1
408 1 13 C H3' 1 13 C H5'' 4.000 . 4.100 2.547 2.516 2.575 . 0 0 "[ . 1 ]" 1
409 1 13 C H3' 1 13 C H5 5.000 . 7.000 4.811 4.726 5.003 . 0 0 "[ . 1 ]" 1
410 1 13 C H4' 1 13 C H6 5.000 . 5.500 4.005 3.946 4.090 . 0 0 "[ . 1 ]" 1
411 1 13 C H4' 1 14 U H5 5.000 . 7.000 6.383 5.872 6.749 . 0 0 "[ . 1 ]" 1
412 1 13 C H5 1 13 C H5'' 5.000 . 7.000 5.806 5.658 6.055 . 0 0 "[ . 1 ]" 1
413 1 13 C H5'' 1 13 C H6 4.000 . 4.100 3.752 3.649 3.999 . 0 0 "[ . 1 ]" 1
414 1 13 C H5' 1 13 C H6 5.000 . 5.500 3.590 3.438 3.779 . 0 0 "[ . 1 ]" 1
415 1 13 C H5'' 1 14 U H6 5.000 . 7.000 5.580 5.372 5.859 . 0 0 "[ . 1 ]" 1
416 1 13 C H41 1 14 U H3 6.000 . 7.000 5.355 4.631 5.906 . 0 0 "[ . 1 ]" 1
417 1 13 C Q4 1 13 C H6 4.500 . 5.500 4.378 4.377 4.380 . 0 0 "[ . 1 ]" 1
418 1 13 C Q4 1 14 U H3 6.000 . 7.000 5.102 4.451 5.620 . 0 0 "[ . 1 ]" 1
419 1 13 C H6 1 14 U H5 5.000 . 7.000 5.395 4.792 5.796 . 0 0 "[ . 1 ]" 1
420 1 13 C H6 1 14 U H6 5.000 . 7.000 5.722 5.485 6.041 . 0 0 "[ . 1 ]" 1
421 1 14 U H1' 1 14 U H3' 4.000 . 4.100 3.888 3.882 3.893 . 0 0 "[ . 1 ]" 1
422 1 14 U H1' 1 14 U H5' 5.000 . 5.500 4.875 4.778 4.900 . 0 0 "[ . 1 ]" 1
423 1 14 U H1' 1 14 U H5'' 5.000 . 5.500 5.201 5.189 5.245 . 0 0 "[ . 1 ]" 1
424 1 14 U H1' 1 14 U H3 4.500 . 5.500 4.581 4.560 4.612 . 0 0 "[ . 1 ]" 1
425 1 14 U H1' 1 14 U H5 5.000 . 7.000 5.344 5.315 5.363 . 0 0 "[ . 1 ]" 1
426 1 14 U H1' 1 14 U H6 4.000 . 4.100 3.586 3.546 3.615 . 0 0 "[ . 1 ]" 1
427 1 14 U H2' 1 14 U H6 4.000 . 4.100 3.785 3.675 3.903 . 0 0 "[ . 1 ]" 1
428 1 14 U H2' 1 15 C H6 3.000 . 3.000 2.379 2.343 2.433 . 0 0 "[ . 1 ]" 1
429 1 14 U H3' 1 14 U H5 5.000 . 7.000 4.637 4.556 4.754 . 0 0 "[ . 1 ]" 1
430 1 14 U H3' 1 14 U H6 4.000 . 4.100 2.875 2.764 3.057 . 0 0 "[ . 1 ]" 1
431 1 14 U H3' 1 15 C H6 3.000 . 3.000 2.953 2.792 3.002 0.002 10 0 "[ . 1 ]" 1
432 1 14 U H4' 1 14 U H5'' 3.000 . 3.000 2.578 2.478 2.599 . 0 0 "[ . 1 ]" 1
433 1 14 U H4' 1 14 U H6 5.000 . 5.500 3.930 3.871 3.971 . 0 0 "[ . 1 ]" 1
434 1 14 U H5' 1 14 U H6 5.000 . 5.500 3.454 3.144 3.560 . 0 0 "[ . 1 ]" 1
435 1 14 U H5'' 1 14 U H6 5.000 . 5.500 3.586 3.485 3.670 . 0 0 "[ . 1 ]" 1
436 1 14 U H5 1 15 C H5 5.000 . 5.500 4.700 4.139 5.151 . 0 0 "[ . 1 ]" 1
437 1 14 U H3 1 14 U H6 6.000 . 7.000 4.807 4.806 4.808 . 0 0 "[ . 1 ]" 1
438 1 14 U H3 1 15 C Q4 4.500 . 5.500 4.219 3.731 4.617 . 0 0 "[ . 1 ]" 1
439 1 14 U H5 1 15 C Q4 6.000 . 7.000 4.302 3.442 4.717 . 0 0 "[ . 1 ]" 1
440 1 14 U H6 1 15 C H5 5.000 . 7.000 4.528 3.971 4.789 . 0 0 "[ . 1 ]" 1
441 1 15 C H1' 1 15 C H3' 4.000 . 4.100 3.897 3.888 3.904 . 0 0 "[ . 1 ]" 1
442 1 15 C H1' 1 15 C H5' 5.000 . 5.500 4.872 4.857 4.888 . 0 0 "[ . 1 ]" 1
443 1 15 C H1' 1 15 C H5'' 5.000 . 5.500 5.182 5.169 5.204 . 0 0 "[ . 1 ]" 1
444 1 15 C H1' 1 15 C H6 4.000 . 4.100 3.578 3.548 3.603 . 0 0 "[ . 1 ]" 1
445 1 15 C H1' 1 16 G H8 5.000 . 5.500 5.244 5.106 5.389 . 0 0 "[ . 1 ]" 1
446 1 15 C H2' 1 15 C H6 4.000 . 4.100 3.785 3.688 3.910 . 0 0 "[ . 1 ]" 1
447 1 15 C H2' 1 16 G H1' 5.000 . 5.500 4.684 4.098 5.399 . 0 0 "[ . 1 ]" 1
448 1 15 C H2' 1 16 G H8 3.000 . 3.000 2.527 2.347 2.692 . 0 0 "[ . 1 ]" 1
449 1 15 C H3' 1 15 C H5 5.000 . 7.000 4.785 4.716 4.856 . 0 0 "[ . 1 ]" 1
450 1 15 C H3' 1 15 C H6 4.000 . 4.100 2.985 2.894 3.066 . 0 0 "[ . 1 ]" 1
451 1 15 C H3' 1 16 G H8 3.000 . 3.000 2.830 2.647 2.997 . 0 0 "[ . 1 ]" 1
452 1 15 C H4' 1 15 C H6 5.000 . 5.500 4.016 3.934 4.064 . 0 0 "[ . 1 ]" 1
453 1 15 C H5 1 15 C H5'' 5.000 . 7.000 5.858 5.634 5.968 . 0 0 "[ . 1 ]" 1
454 1 15 C H5'' 1 15 C H6 4.000 . 4.100 3.755 3.631 3.843 . 0 0 "[ . 1 ]" 1
455 1 15 C H5' 1 15 C H6 5.000 . 5.500 3.643 3.385 3.763 . 0 0 "[ . 1 ]" 1
456 1 15 C H41 1 16 G H1 6.000 . 7.000 4.478 3.638 5.936 . 0 0 "[ . 1 ]" 1
457 1 15 C Q4 1 15 C H6 4.500 . 5.500 4.378 4.377 4.380 . 0 0 "[ . 1 ]" 1
458 1 15 C H5 1 15 C H6 3.000 . 3.000 2.451 2.450 2.452 . 0 0 "[ . 1 ]" 1
459 1 15 C H6 1 16 G H8 5.000 . 5.500 5.278 4.996 5.487 . 0 0 "[ . 1 ]" 1
460 1 16 G H1' 1 16 G H3' 4.000 . 4.100 3.891 3.885 3.902 . 0 0 "[ . 1 ]" 1
461 1 16 G H1' 1 16 G H5' 5.000 . 5.500 4.845 4.670 4.902 . 0 0 "[ . 1 ]" 1
462 1 16 G H1' 1 16 G H5'' 5.000 . 5.500 5.208 5.182 5.261 . 0 0 "[ . 1 ]" 1
463 1 16 G H1' 1 16 G H8 4.000 . 4.100 3.788 3.741 3.835 . 0 0 "[ . 1 ]" 1
464 1 16 G H2' 1 16 G H8 4.000 . 4.100 3.761 3.585 3.936 . 0 0 "[ . 1 ]" 1
465 1 16 G H2' 1 17 C H5 5.000 . 5.500 3.466 2.580 3.981 . 0 0 "[ . 1 ]" 1
466 1 16 G H2' 1 17 C H6 4.000 . 4.100 2.354 2.326 2.496 . 0 0 "[ . 1 ]" 1
467 1 16 G H3' 1 16 G H5'' 4.000 . 4.100 2.624 2.517 2.957 . 0 0 "[ . 1 ]" 1
468 1 16 G H3' 1 16 G H8 4.000 . 4.100 2.904 2.619 3.098 . 0 0 "[ . 1 ]" 1
469 1 16 G H3' 1 17 C H5 5.000 . 5.500 2.967 2.346 3.583 . 0 0 "[ . 1 ]" 1
470 1 16 G H3' 1 17 C H6 3.000 . 3.000 2.863 2.714 2.997 . 0 0 "[ . 1 ]" 1
471 1 16 G H4' 1 16 G H8 5.000 . 5.500 4.255 4.199 4.335 . 0 0 "[ . 1 ]" 1
472 1 16 G H4' 1 17 C H6 5.000 . 5.500 5.372 5.170 5.503 0.003 5 0 "[ . 1 ]" 1
473 1 16 G H5' 1 16 G H8 5.000 . 5.500 3.753 3.388 3.924 . 0 0 "[ . 1 ]" 1
474 1 16 G H5'' 1 16 G H8 4.000 . 4.100 3.849 3.684 4.042 . 0 0 "[ . 1 ]" 1
475 1 16 G H1 1 16 G Q2 4.500 . 5.500 2.194 2.192 2.195 . 0 0 "[ . 1 ]" 1
476 1 16 G H1 1 17 C H1' 6.000 . 7.000 6.359 5.389 6.963 . 0 0 "[ . 1 ]" 1
477 1 16 G H1 1 17 C H42 6.000 . 7.000 6.252 4.761 7.001 0.001 1 0 "[ . 1 ]" 1
478 1 16 G H1 1 17 C H41 6.000 . 7.000 5.784 4.372 6.772 . 0 0 "[ . 1 ]" 1
479 1 16 G H8 1 17 C H5 5.000 . 7.000 3.703 2.850 4.625 . 0 0 "[ . 1 ]" 1
480 1 16 G H8 1 17 C H6 5.000 . 7.000 4.876 4.508 5.241 . 0 0 "[ . 1 ]" 1
481 1 17 C H1' 1 17 C H3' 4.000 . 4.100 3.840 3.833 3.849 . 0 0 "[ . 1 ]" 1
482 1 17 C H1' 1 17 C H5' 5.000 . 5.500 4.762 4.640 4.875 . 0 0 "[ . 1 ]" 1
483 1 17 C H1' 1 17 C H5'' 5.000 . 5.500 5.204 5.183 5.223 . 0 0 "[ . 1 ]" 1
484 1 17 C H1' 1 17 C H5 5.000 . 7.000 5.343 5.307 5.368 . 0 0 "[ . 1 ]" 1
485 1 17 C H1' 1 17 C H6 4.000 . 4.100 3.589 3.534 3.625 . 0 0 "[ . 1 ]" 1
486 1 17 C H2' 1 17 C H3' 3.000 . 3.000 2.344 2.341 2.347 . 0 0 "[ . 1 ]" 1
487 1 17 C H2' 1 17 C H5' 5.000 . 5.500 5.307 5.228 5.356 . 0 0 "[ . 1 ]" 1
488 1 17 C H2' 1 17 C H5 5.000 . 5.500 5.191 5.108 5.298 . 0 0 "[ . 1 ]" 1
489 1 17 C H2' 1 17 C H6 4.000 . 4.100 3.758 3.637 3.908 . 0 0 "[ . 1 ]" 1
490 1 17 C H3' 1 17 C H5 5.000 . 7.000 4.661 4.581 4.768 . 0 0 "[ . 1 ]" 1
491 1 17 C H3' 1 17 C H6 4.000 . 4.100 2.833 2.679 3.036 . 0 0 "[ . 1 ]" 1
492 1 17 C H4' 1 17 C H5' 5.000 . 5.500 2.448 2.368 2.566 . 0 0 "[ . 1 ]" 1
493 1 17 C H4' 1 17 C H5'' 5.000 . 5.500 2.493 2.382 2.582 . 0 0 "[ . 1 ]" 1
494 1 17 C H4' 1 17 C H6 4.000 . 4.100 4.021 3.941 4.077 . 0 0 "[ . 1 ]" 1
495 1 17 C H5' 1 17 C H6 5.000 . 5.500 3.475 3.292 3.692 . 0 0 "[ . 1 ]" 1
496 1 17 C H5'' 1 17 C H6 5.000 . 5.500 3.912 3.618 4.147 . 0 0 "[ . 1 ]" 1
497 1 17 C Q4 1 17 C H6 4.500 . 5.500 4.378 4.377 4.379 . 0 0 "[ . 1 ]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 29
_Distance_constraint_stats_list.Viol_count 73
_Distance_constraint_stats_list.Viol_total 4.053
_Distance_constraint_stats_list.Viol_max 0.013
_Distance_constraint_stats_list.Viol_rms 0.0027
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0012
_Distance_constraint_stats_list.Viol_average_violations_only 0.0050
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 G 0.037 0.007 11 0 "[ . 1 ]"
1 2 C 0.070 0.010 5 0 "[ . 1 ]"
1 3 G 0.039 0.012 5 0 "[ . 1 ]"
1 4 A 0.028 0.009 2 0 "[ . 1 ]"
1 5 G 0.143 0.013 2 0 "[ . 1 ]"
1 6 U 0.052 0.013 4 0 "[ . 1 ]"
1 12 A 0.052 0.013 4 0 "[ . 1 ]"
1 13 C 0.143 0.013 2 0 "[ . 1 ]"
1 14 U 0.028 0.009 2 0 "[ . 1 ]"
1 15 C 0.039 0.012 5 0 "[ . 1 ]"
1 16 G 0.070 0.010 5 0 "[ . 1 ]"
1 17 C 0.037 0.007 11 0 "[ . 1 ]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 3 G O6 1 15 C N4 2.910 2.810 3.010 2.956 2.864 2.995 . 0 0 "[ . 1 ]" 2
2 1 5 G O6 1 13 C N4 2.910 2.810 3.010 2.950 2.904 2.983 . 0 0 "[ . 1 ]" 2
3 1 2 C N4 1 16 G O6 2.910 2.810 3.010 2.893 2.805 3.020 0.010 5 0 "[ . 1 ]" 2
4 1 1 G O6 1 17 C N4 2.910 2.810 3.010 2.991 2.931 3.015 0.005 5 0 "[ . 1 ]" 2
5 1 3 G H1 1 15 C N3 2.000 . 2.100 2.002 1.956 2.063 . 0 0 "[ . 1 ]" 2
6 1 5 G H1 1 13 C N3 2.000 . 2.100 2.016 1.945 2.113 0.013 2 0 "[ . 1 ]" 2
7 1 2 C N3 1 16 G H1 2.000 . 2.100 1.982 1.917 2.042 . 0 0 "[ . 1 ]" 2
8 1 1 G H1 1 17 C N3 2.000 . 2.100 2.036 1.933 2.099 . 0 0 "[ . 1 ]" 2
9 1 3 G N1 1 15 C N3 2.950 2.850 3.050 2.968 2.945 2.998 . 0 0 "[ . 1 ]" 2
10 1 5 G N1 1 13 C N3 2.950 2.850 3.050 2.977 2.933 3.015 . 0 0 "[ . 1 ]" 2
11 1 2 C N3 1 16 G N1 2.950 2.850 3.050 2.955 2.919 2.990 . 0 0 "[ . 1 ]" 2
12 1 1 G N1 1 17 C N3 2.950 2.850 3.050 2.986 2.921 3.035 . 0 0 "[ . 1 ]" 2
13 1 3 G N2 1 15 C O2 2.860 2.760 2.960 2.918 2.863 2.960 0.000 2 0 "[ . 1 ]" 2
14 1 5 G N2 1 13 C O2 2.860 2.760 2.960 2.942 2.885 2.969 0.009 8 0 "[ . 1 ]" 2
15 1 2 C O2 1 16 G N2 2.860 2.760 2.960 2.952 2.929 2.969 0.009 4 0 "[ . 1 ]" 2
16 1 1 G N2 1 17 C O2 2.860 2.760 2.960 2.946 2.893 2.965 0.005 4 0 "[ . 1 ]" 2
17 1 3 G N2 1 15 C H6 7.250 7.150 7.350 7.177 7.138 7.231 0.012 5 0 "[ . 1 ]" 2
18 1 5 G N2 1 13 C H6 7.250 7.150 7.350 7.146 7.137 7.160 0.013 5 0 "[ . 1 ]" 2
19 1 2 C H6 1 16 G N2 7.250 7.150 7.350 7.156 7.142 7.209 0.008 5 0 "[ . 1 ]" 2
20 1 1 G N2 1 17 C H6 7.250 7.150 7.350 7.174 7.149 7.255 0.001 9 0 "[ . 1 ]" 2
21 1 3 G O6 1 15 C H5 5.450 5.350 5.550 5.527 5.412 5.554 0.004 7 0 "[ . 1 ]" 2
22 1 5 G O6 1 13 C H5 5.450 5.350 5.550 5.547 5.519 5.560 0.010 3 0 "[ . 1 ]" 2
23 1 2 C H5 1 16 G O6 5.450 5.350 5.550 5.501 5.410 5.554 0.004 6 0 "[ . 1 ]" 2
24 1 1 G O6 1 17 C H5 5.450 5.350 5.550 5.500 5.426 5.557 0.007 11 0 "[ . 1 ]" 2
25 1 4 A N1 1 14 U H3 1.870 . 1.970 1.928 1.775 1.975 0.005 10 0 "[ . 1 ]" 2
26 1 4 A N6 1 14 U O4 2.950 2.850 3.050 2.953 2.850 3.044 0.000 6 0 "[ . 1 ]" 2
27 1 4 A N1 1 14 U N3 2.820 2.720 2.920 2.874 2.784 2.925 0.005 8 0 "[ . 1 ]" 2
28 1 6 U N3 1 12 A N1 2.820 2.720 2.920 2.911 2.807 2.933 0.013 4 0 "[ . 1 ]" 2
29 1 4 A N6 1 14 U H5 5.600 5.500 5.700 5.602 5.491 5.692 0.009 2 0 "[ . 1 ]" 2
stop_
save_
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