NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
387107 |
1m82   |
5528 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1m82
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 433
_Distance_constraint_stats_list.Viol_count 889
_Distance_constraint_stats_list.Viol_total 1628.713
_Distance_constraint_stats_list.Viol_max 0.301
_Distance_constraint_stats_list.Viol_rms 0.0200
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0039
_Distance_constraint_stats_list.Viol_average_violations_only 0.0591
_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 2.548 0.213 8 0 "[ . 1 . 2 . 3 ]"
1 2 G 1.016 0.205 27 0 "[ . 1 . 2 . 3 ]"
1 3 A 2.077 0.205 27 0 "[ . 1 . 2 . 3 ]"
1 4 A 1.581 0.128 30 0 "[ . 1 . 2 . 3 ]"
1 5 G 2.575 0.133 16 0 "[ . 1 . 2 . 3 ]"
1 6 C 0.160 0.065 15 0 "[ . 1 . 2 . 3 ]"
1 7 A 3.643 0.164 23 0 "[ . 1 . 2 . 3 ]"
1 8 G 6.432 0.241 18 0 "[ . 1 . 2 . 3 ]"
1 9 G 1.141 0.092 23 0 "[ . 1 . 2 . 3 ]"
1 10 C 3.346 0.153 15 0 "[ . 1 . 2 . 3 ]"
1 11 U 4.384 0.153 15 0 "[ . 1 . 2 . 3 ]"
1 12 U 3.673 0.107 21 0 "[ . 1 . 2 . 3 ]"
1 13 C 3.651 0.183 24 0 "[ . 1 . 2 . 3 ]"
1 14 G 3.984 0.237 20 0 "[ . 1 . 2 . 3 ]"
1 15 G 6.696 0.247 27 0 "[ . 1 . 2 . 3 ]"
1 16 C 0.186 0.031 21 0 "[ . 1 . 2 . 3 ]"
1 17 C 7.176 0.301 4 0 "[ . 1 . 2 . 3 ]"
1 18 U 12.802 0.301 4 0 "[ . 1 . 2 . 3 ]"
1 19 U 2.162 0.160 16 0 "[ . 1 . 2 . 3 ]"
1 20 G 5.845 0.198 23 0 "[ . 1 . 2 . 3 ]"
1 21 U 0.866 0.058 13 0 "[ . 1 . 2 . 3 ]"
1 22 U 0.273 0.058 13 0 "[ . 1 . 2 . 3 ]"
1 23 U 0.487 0.088 4 0 "[ . 1 . 2 . 3 ]"
1 24 C 1.398 0.088 4 0 "[ . 1 . 2 . 3 ]"
1 25 C 0.302 0.056 13 0 "[ . 1 . 2 . 3 ]"
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 H8 4.000 . 4.000 3.709 3.615 3.821 . 0 0 "[ . 1 . 2 . 3 ]" 1
2 1 2 G H1' 1 2 G H8 4.000 . 4.000 3.706 3.610 3.818 . 0 0 "[ . 1 . 2 . 3 ]" 1
3 1 3 A H1' 1 3 A H8 4.000 . 4.000 3.719 3.660 3.809 . 0 0 "[ . 1 . 2 . 3 ]" 1
4 1 4 A H1' 1 4 A H8 4.000 . 4.000 3.725 3.623 3.788 . 0 0 "[ . 1 . 2 . 3 ]" 1
5 1 5 G H1' 1 5 G H8 4.000 . 4.000 3.671 3.627 3.730 . 0 0 "[ . 1 . 2 . 3 ]" 1
6 1 6 C H1' 1 6 C H6 4.000 . 4.000 3.584 3.457 3.661 . 0 0 "[ . 1 . 2 . 3 ]" 1
7 1 7 A H1' 1 7 A H8 4.000 . 4.000 3.647 3.593 3.805 . 0 0 "[ . 1 . 2 . 3 ]" 1
8 1 8 G H1' 1 8 G H8 4.000 . 4.000 3.693 3.590 3.752 . 0 0 "[ . 1 . 2 . 3 ]" 1
9 1 9 G H1' 1 9 G H8 4.000 . 4.000 3.711 3.635 3.816 . 0 0 "[ . 1 . 2 . 3 ]" 1
10 1 10 C H1' 1 10 C H6 4.000 . 4.000 3.633 3.594 3.665 . 0 0 "[ . 1 . 2 . 3 ]" 1
11 1 11 U H1' 1 11 U H6 4.000 . 4.000 3.581 3.516 3.653 . 0 0 "[ . 1 . 2 . 3 ]" 1
12 1 12 U H1' 1 12 U H6 4.000 . 4.000 3.658 3.631 3.669 . 0 0 "[ . 1 . 2 . 3 ]" 1
13 1 13 C H1' 1 13 C H6 4.000 . 4.000 3.647 3.615 3.659 . 0 0 "[ . 1 . 2 . 3 ]" 1
14 1 14 G H1' 1 14 G H8 3.000 . 3.000 2.536 2.483 2.656 . 0 0 "[ . 1 . 2 . 3 ]" 1
15 1 15 G H1' 1 15 G H8 4.000 . 4.000 3.693 3.588 3.763 . 0 0 "[ . 1 . 2 . 3 ]" 1
16 1 16 C H1' 1 16 C H6 4.000 . 4.000 3.590 3.519 3.648 . 0 0 "[ . 1 . 2 . 3 ]" 1
17 1 17 C H1' 1 17 C H6 4.000 . 4.000 3.607 3.523 3.657 . 0 0 "[ . 1 . 2 . 3 ]" 1
18 1 18 U H1' 1 18 U H6 4.000 . 4.000 3.711 3.697 3.727 . 0 0 "[ . 1 . 2 . 3 ]" 1
19 1 19 U H1' 1 19 U H6 4.000 . 4.000 3.581 3.487 3.668 . 0 0 "[ . 1 . 2 . 3 ]" 1
20 1 20 G H1' 1 20 G H8 4.000 . 4.000 3.653 3.611 3.781 . 0 0 "[ . 1 . 2 . 3 ]" 1
21 1 21 U H1' 1 21 U H6 4.000 . 4.000 3.551 3.505 3.645 . 0 0 "[ . 1 . 2 . 3 ]" 1
22 1 23 U H1' 1 23 U H6 4.000 . 4.000 3.615 3.544 3.664 . 0 0 "[ . 1 . 2 . 3 ]" 1
23 1 24 C H1' 1 24 C H6 4.000 . 4.000 3.549 3.473 3.638 . 0 0 "[ . 1 . 2 . 3 ]" 1
24 1 25 C H1' 1 25 C H6 4.000 . 4.000 3.615 3.543 3.659 . 0 0 "[ . 1 . 2 . 3 ]" 1
25 1 1 G H2' 1 1 G H8 4.000 . 4.000 3.987 3.625 4.213 0.213 8 0 "[ . 1 . 2 . 3 ]" 1
26 1 2 G H2' 1 2 G H8 5.000 . 5.000 4.042 3.693 4.271 . 0 0 "[ . 1 . 2 . 3 ]" 1
27 1 5 G H2' 1 5 G H8 5.000 . 5.000 4.106 3.932 4.207 . 0 0 "[ . 1 . 2 . 3 ]" 1
28 1 6 C H2' 1 6 C H6 4.000 . 4.000 3.795 3.538 4.026 0.026 3 0 "[ . 1 . 2 . 3 ]" 1
29 1 7 A H2' 1 7 A H8 5.000 . 5.000 4.174 3.771 4.367 . 0 0 "[ . 1 . 2 . 3 ]" 1
30 1 8 G H2' 1 8 G H8 4.000 . 4.000 4.058 3.920 4.241 0.241 18 0 "[ . 1 . 2 . 3 ]" 1
31 1 9 G H2' 1 9 G H8 5.000 . 5.000 3.989 3.625 4.206 . 0 0 "[ . 1 . 2 . 3 ]" 1
32 1 10 C H2' 1 10 C H6 4.000 . 4.000 3.613 3.471 3.775 . 0 0 "[ . 1 . 2 . 3 ]" 1
33 1 11 U H2' 1 11 U H6 5.000 . 5.000 3.663 3.508 3.879 . 0 0 "[ . 1 . 2 . 3 ]" 1
34 1 12 U H2' 1 12 U H6 3.000 . 3.000 2.878 2.826 3.042 0.042 9 0 "[ . 1 . 2 . 3 ]" 1
35 1 13 C H2' 1 13 C H6 3.000 . 3.000 2.889 2.824 3.046 0.046 24 0 "[ . 1 . 2 . 3 ]" 1
36 1 14 G H2' 1 14 G H8 5.000 . 5.000 3.908 3.283 4.341 . 0 0 "[ . 1 . 2 . 3 ]" 1
37 1 15 G H2' 1 15 G H8 4.000 . 4.000 4.063 3.947 4.247 0.247 27 0 "[ . 1 . 2 . 3 ]" 1
38 1 17 C H2' 1 17 C H6 4.000 . 4.000 3.755 3.557 3.992 . 0 0 "[ . 1 . 2 . 3 ]" 1
39 1 18 U H2' 1 18 U H6 3.000 . 3.000 1.995 1.849 2.441 . 0 0 "[ . 1 . 2 . 3 ]" 1
40 1 19 U H2' 1 19 U H6 4.000 . 4.000 3.775 3.498 4.042 0.042 27 0 "[ . 1 . 2 . 3 ]" 1
41 1 20 G H2' 1 20 G H8 5.000 . 5.000 4.187 3.851 4.290 . 0 0 "[ . 1 . 2 . 3 ]" 1
42 1 21 U H2' 1 21 U H6 4.000 . 4.000 3.876 3.545 4.004 0.004 20 0 "[ . 1 . 2 . 3 ]" 1
43 1 23 U H2' 1 23 U H6 6.000 . 6.000 3.690 3.484 3.870 . 0 0 "[ . 1 . 2 . 3 ]" 1
44 1 24 C H2' 1 24 C H6 4.000 . 4.000 3.872 3.594 4.026 0.026 27 0 "[ . 1 . 2 . 3 ]" 1
45 1 25 C H2' 1 25 C H6 4.000 . 4.000 3.683 3.506 3.909 . 0 0 "[ . 1 . 2 . 3 ]" 1
46 1 1 G H3' 1 1 G H8 4.000 . 4.000 2.881 2.293 3.279 . 0 0 "[ . 1 . 2 . 3 ]" 1
47 1 3 A H3' 1 3 A H8 3.000 . 3.000 2.873 2.423 3.034 0.034 28 0 "[ . 1 . 2 . 3 ]" 1
48 1 5 G H3' 1 5 G H8 3.000 . 3.000 3.057 2.887 3.133 0.133 16 0 "[ . 1 . 2 . 3 ]" 1
49 1 6 C H3' 1 6 C H6 4.000 . 4.000 2.629 2.245 3.235 . 0 0 "[ . 1 . 2 . 3 ]" 1
50 1 7 A H3' 1 7 A H8 4.000 . 4.000 3.302 2.520 3.816 . 0 0 "[ . 1 . 2 . 3 ]" 1
51 1 10 C H3' 1 10 C H6 3.000 . 3.000 2.402 2.154 2.662 . 0 0 "[ . 1 . 2 . 3 ]" 1
52 1 11 U H3' 1 11 U H6 4.000 . 4.000 2.927 2.326 3.371 . 0 0 "[ . 1 . 2 . 3 ]" 1
53 1 12 U H3' 1 12 U H6 5.000 . 5.000 4.423 4.311 4.499 . 0 0 "[ . 1 . 2 . 3 ]" 1
54 1 14 G H3' 1 14 G H8 6.000 . 6.000 5.342 4.950 5.750 . 0 0 "[ . 1 . 2 . 3 ]" 1
55 1 15 G H3' 1 15 G H8 4.000 . 4.000 2.903 2.591 3.248 . 0 0 "[ . 1 . 2 . 3 ]" 1
56 1 16 C H3' 1 16 C H6 3.000 . 3.000 2.637 2.344 2.907 . 0 0 "[ . 1 . 2 . 3 ]" 1
57 1 17 C H3' 1 17 C H6 3.000 . 3.000 2.426 2.106 2.856 . 0 0 "[ . 1 . 2 . 3 ]" 1
58 1 18 U H3' 1 18 U H6 4.000 . 4.000 3.761 3.611 3.877 . 0 0 "[ . 1 . 2 . 3 ]" 1
59 1 19 U H3' 1 19 U H6 3.000 . 3.000 2.719 2.213 3.081 0.081 7 0 "[ . 1 . 2 . 3 ]" 1
60 1 20 G H3' 1 20 G H8 3.000 . 3.000 3.047 2.623 3.170 0.170 16 0 "[ . 1 . 2 . 3 ]" 1
61 1 21 U H3' 1 21 U H6 3.000 . 3.000 2.845 2.495 3.027 0.027 29 0 "[ . 1 . 2 . 3 ]" 1
62 1 24 C H3' 1 24 C H6 4.000 . 4.000 2.795 2.378 3.101 . 0 0 "[ . 1 . 2 . 3 ]" 1
63 1 25 C H3' 1 25 C H6 3.000 . 3.000 2.545 2.299 2.879 . 0 0 "[ . 1 . 2 . 3 ]" 1
64 1 1 G H4' 1 1 G H8 5.000 . 5.000 4.152 3.998 4.325 . 0 0 "[ . 1 . 2 . 3 ]" 1
65 1 5 G H4' 1 5 G H8 6.000 . 6.000 4.302 4.041 4.444 . 0 0 "[ . 1 . 2 . 3 ]" 1
66 1 6 C H4' 1 6 C H6 5.000 . 5.000 3.864 3.719 4.112 . 0 0 "[ . 1 . 2 . 3 ]" 1
67 1 8 G H4' 1 8 G H8 4.000 . 4.000 4.041 3.926 4.107 0.107 11 0 "[ . 1 . 2 . 3 ]" 1
68 1 10 C H4' 1 10 C H6 4.000 . 4.000 3.903 3.805 3.970 . 0 0 "[ . 1 . 2 . 3 ]" 1
69 1 11 U H4' 1 11 U H6 5.000 . 5.000 4.131 3.925 4.261 . 0 0 "[ . 1 . 2 . 3 ]" 1
70 1 12 U H4' 1 12 U H6 6.000 . 6.000 4.145 3.939 4.268 . 0 0 "[ . 1 . 2 . 3 ]" 1
71 1 13 C H4' 1 13 C H6 5.000 . 5.000 4.180 4.064 4.320 . 0 0 "[ . 1 . 2 . 3 ]" 1
72 1 14 G H4' 1 14 G H8 6.000 . 6.000 5.597 5.276 5.862 . 0 0 "[ . 1 . 2 . 3 ]" 1
73 1 15 G H4' 1 15 G H8 4.000 . 4.000 4.064 3.909 4.146 0.146 12 0 "[ . 1 . 2 . 3 ]" 1
74 1 16 C H4' 1 16 C H6 5.000 . 5.000 3.952 3.785 4.043 . 0 0 "[ . 1 . 2 . 3 ]" 1
75 1 18 U H4' 1 18 U H6 5.000 . 5.000 4.389 4.241 4.630 . 0 0 "[ . 1 . 2 . 3 ]" 1
76 1 19 U H4' 1 19 U H6 5.000 . 5.000 3.944 3.814 4.067 . 0 0 "[ . 1 . 2 . 3 ]" 1
77 1 24 C H4' 1 24 C H6 4.000 . 4.000 3.977 3.812 4.057 0.057 26 0 "[ . 1 . 2 . 3 ]" 1
78 1 1 G H5'' 1 1 G H8 4.000 . 4.000 2.702 2.080 4.010 0.010 27 0 "[ . 1 . 2 . 3 ]" 1
79 1 1 G H5' 1 1 G H8 4.000 . 4.000 3.009 2.158 4.000 . 0 0 "[ . 1 . 2 . 3 ]" 1
80 1 2 G H5'' 1 2 G H8 5.000 . 5.000 3.829 3.568 4.258 . 0 0 "[ . 1 . 2 . 3 ]" 1
81 1 3 A H5'' 1 3 A H8 5.000 . 5.000 3.835 3.593 4.448 . 0 0 "[ . 1 . 2 . 3 ]" 1
82 1 4 A H5'' 1 4 A H8 4.000 . 4.000 3.755 3.518 4.076 0.076 28 0 "[ . 1 . 2 . 3 ]" 1
83 1 5 G H5'' 1 5 G H8 5.000 . 5.000 4.216 3.666 4.629 . 0 0 "[ . 1 . 2 . 3 ]" 1
84 1 5 G H5' 1 5 G H8 6.000 . 6.000 3.621 2.932 4.286 . 0 0 "[ . 1 . 2 . 3 ]" 1
85 1 7 A H5' 1 7 A H8 7.000 . 7.000 3.676 2.894 4.088 . 0 0 "[ . 1 . 2 . 3 ]" 1
86 1 7 A H5'' 1 7 A H8 6.000 . 6.000 3.594 1.936 4.736 . 0 0 "[ . 1 . 2 . 3 ]" 1
87 1 8 G H5'' 1 8 G H8 6.000 . 6.000 3.395 1.945 3.922 . 0 0 "[ . 1 . 2 . 3 ]" 1
88 1 8 G H5' 1 8 G H8 7.000 . 7.000 2.849 1.919 3.772 . 0 0 "[ . 1 . 2 . 3 ]" 1
89 1 9 G H5'' 1 9 G H8 5.000 . 5.000 4.269 3.812 4.637 . 0 0 "[ . 1 . 2 . 3 ]" 1
90 1 10 C H5'' 1 10 C H6 4.000 . 4.000 3.765 3.530 3.889 . 0 0 "[ . 1 . 2 . 3 ]" 1
91 1 11 U H5'' 1 11 U H6 5.000 . 5.000 4.245 3.849 4.537 . 0 0 "[ . 1 . 2 . 3 ]" 1
92 1 11 U H5' 1 11 U H6 5.000 . 5.000 3.462 3.230 3.699 . 0 0 "[ . 1 . 2 . 3 ]" 1
93 1 12 U H5' 1 12 U H6 5.000 . 5.000 2.988 2.657 3.792 . 0 0 "[ . 1 . 2 . 3 ]" 1
94 1 12 U H5'' 1 12 U H6 5.000 . 5.000 3.684 1.976 4.199 . 0 0 "[ . 1 . 2 . 3 ]" 1
95 1 13 C H5'' 1 13 C H6 7.000 . 7.000 3.966 3.796 4.254 . 0 0 "[ . 1 . 2 . 3 ]" 1
96 1 13 C H5' 1 13 C H6 7.000 . 7.000 3.250 2.888 3.499 . 0 0 "[ . 1 . 2 . 3 ]" 1
97 1 15 G H5'' 1 15 G H8 6.000 . 6.000 2.829 1.864 3.868 . 0 0 "[ . 1 . 2 . 3 ]" 1
98 1 15 G H5' 1 15 G H8 6.000 . 6.000 3.466 2.478 3.832 . 0 0 "[ . 1 . 2 . 3 ]" 1
99 1 16 C H5'' 1 16 C H6 5.000 . 5.000 3.743 3.496 3.928 . 0 0 "[ . 1 . 2 . 3 ]" 1
100 1 18 U H5'' 1 18 U H6 6.000 . 6.000 3.919 3.666 4.559 . 0 0 "[ . 1 . 2 . 3 ]" 1
101 1 18 U H5' 1 18 U H6 6.000 . 6.000 2.475 1.899 3.768 . 0 0 "[ . 1 . 2 . 3 ]" 1
102 1 19 U H5'' 1 19 U H6 6.000 . 6.000 3.019 1.905 3.915 . 0 0 "[ . 1 . 2 . 3 ]" 1
103 1 19 U H5' 1 19 U H6 6.000 . 6.000 3.286 2.176 3.827 . 0 0 "[ . 1 . 2 . 3 ]" 1
104 1 20 G H5'' 1 20 G H8 5.000 . 5.000 3.689 1.878 4.125 . 0 0 "[ . 1 . 2 . 3 ]" 1
105 1 20 G H5' 1 20 G H8 5.000 . 5.000 2.806 1.855 3.260 . 0 0 "[ . 1 . 2 . 3 ]" 1
106 1 23 U H5'' 1 23 U H6 6.000 . 6.000 3.810 3.556 3.978 . 0 0 "[ . 1 . 2 . 3 ]" 1
107 1 24 C H5'' 1 24 C H6 5.000 . 5.000 3.842 3.543 4.080 . 0 0 "[ . 1 . 2 . 3 ]" 1
108 1 25 C H5'' 1 25 C H6 6.000 . 6.000 3.694 3.472 3.870 . 0 0 "[ . 1 . 2 . 3 ]" 1
109 1 1 G H1' 1 1 G H2' 3.000 . 3.000 2.768 2.738 2.801 . 0 0 "[ . 1 . 2 . 3 ]" 1
110 1 2 G H1' 1 2 G H2' 3.000 . 3.000 2.762 2.744 2.813 . 0 0 "[ . 1 . 2 . 3 ]" 1
111 1 3 A H1' 1 3 A H2' 3.000 . 3.000 2.755 2.730 2.803 . 0 0 "[ . 1 . 2 . 3 ]" 1
112 1 4 A H1' 1 4 A H2' 3.000 . 3.000 2.757 2.738 2.787 . 0 0 "[ . 1 . 2 . 3 ]" 1
113 1 5 G H1' 1 5 G H2' 3.000 . 3.000 2.790 2.746 2.838 . 0 0 "[ . 1 . 2 . 3 ]" 1
114 1 6 C H1' 1 6 C H2' 3.000 . 3.000 2.779 2.760 2.823 . 0 0 "[ . 1 . 2 . 3 ]" 1
115 1 7 A H1' 1 7 A H2' 3.000 . 3.000 2.792 2.729 2.888 . 0 0 "[ . 1 . 2 . 3 ]" 1
116 1 8 G H1' 1 8 G H2' 3.000 . 3.000 2.754 2.731 2.770 . 0 0 "[ . 1 . 2 . 3 ]" 1
117 1 9 G H1' 1 9 G H2' 3.000 . 3.000 2.797 2.757 2.830 . 0 0 "[ . 1 . 2 . 3 ]" 1
118 1 10 C H1' 1 10 C H2' 3.000 . 3.000 2.791 2.769 2.811 . 0 0 "[ . 1 . 2 . 3 ]" 1
119 1 11 U H1' 1 11 U H2' 3.000 . 3.000 2.858 2.799 2.925 . 0 0 "[ . 1 . 2 . 3 ]" 1
120 1 12 U H1' 1 12 U H2' 3.000 . 3.000 3.063 3.049 3.071 0.071 16 0 "[ . 1 . 2 . 3 ]" 1
121 1 13 C H1' 1 13 C H2' 3.000 . 3.000 3.066 3.051 3.073 0.073 3 0 "[ . 1 . 2 . 3 ]" 1
122 1 14 G H1' 1 14 G H2' 3.000 . 3.000 2.847 2.786 2.946 . 0 0 "[ . 1 . 2 . 3 ]" 1
123 1 15 G H1' 1 15 G H2' 5.000 . 5.000 2.756 2.741 2.775 . 0 0 "[ . 1 . 2 . 3 ]" 1
124 1 16 C H1' 1 16 C H2' 3.000 . 3.000 2.795 2.761 2.817 . 0 0 "[ . 1 . 2 . 3 ]" 1
125 1 17 C H1' 1 17 C H2' 3.000 . 3.000 2.762 2.746 2.781 . 0 0 "[ . 1 . 2 . 3 ]" 1
126 1 18 U H1' 1 18 U H2' 3.000 . 3.000 3.035 3.008 3.060 0.060 23 0 "[ . 1 . 2 . 3 ]" 1
127 1 19 U H1' 1 19 U H2' 3.000 . 3.000 2.794 2.767 2.828 . 0 0 "[ . 1 . 2 . 3 ]" 1
128 1 20 G H1' 1 20 G H2' 3.000 . 3.000 2.749 2.732 2.788 . 0 0 "[ . 1 . 2 . 3 ]" 1
129 1 21 U H1' 1 21 U H2' 3.000 . 3.000 2.791 2.770 2.810 . 0 0 "[ . 1 . 2 . 3 ]" 1
130 1 22 U H1' 1 22 U H2' 3.000 . 3.000 2.791 2.754 2.822 . 0 0 "[ . 1 . 2 . 3 ]" 1
131 1 23 U H1' 1 23 U H2' 3.000 . 3.000 2.792 2.762 2.830 . 0 0 "[ . 1 . 2 . 3 ]" 1
132 1 24 C H1' 1 24 C H2' 3.000 . 3.000 2.794 2.761 2.807 . 0 0 "[ . 1 . 2 . 3 ]" 1
133 1 25 C H1' 1 25 C H2' 3.000 . 3.000 2.790 2.770 2.804 . 0 0 "[ . 1 . 2 . 3 ]" 1
134 1 1 G H1' 1 1 G H3' 4.000 . 4.000 3.852 3.822 3.886 . 0 0 "[ . 1 . 2 . 3 ]" 1
135 1 3 A H1' 1 3 A H3' 4.000 . 4.000 3.831 3.802 3.866 . 0 0 "[ . 1 . 2 . 3 ]" 1
136 1 5 G H1' 1 5 G H3' 4.000 . 4.000 3.826 3.796 3.885 . 0 0 "[ . 1 . 2 . 3 ]" 1
137 1 6 C H1' 1 6 C H3' 4.000 . 4.000 3.860 3.806 3.912 . 0 0 "[ . 1 . 2 . 3 ]" 1
138 1 8 G H1' 1 8 G H3' 4.000 . 4.000 3.865 3.803 3.931 . 0 0 "[ . 1 . 2 . 3 ]" 1
139 1 9 G H1' 1 9 G H3' 4.000 . 4.000 3.836 3.803 3.854 . 0 0 "[ . 1 . 2 . 3 ]" 1
140 1 10 C H1' 1 10 C H3' 4.000 . 4.000 3.856 3.829 3.890 . 0 0 "[ . 1 . 2 . 3 ]" 1
141 1 11 U H1' 1 11 U H3' 4.000 . 4.000 3.901 3.844 3.971 . 0 0 "[ . 1 . 2 . 3 ]" 1
142 1 12 U H1' 1 12 U H3' 4.000 . 4.000 3.882 3.853 3.938 . 0 0 "[ . 1 . 2 . 3 ]" 1
143 1 13 C H1' 1 13 C H3' 4.000 . 4.000 3.856 3.814 3.918 . 0 0 "[ . 1 . 2 . 3 ]" 1
144 1 14 G H1' 1 14 G H3' 4.000 . 4.000 3.898 3.856 3.941 . 0 0 "[ . 1 . 2 . 3 ]" 1
145 1 15 G H1' 1 15 G H3' 5.000 . 5.000 3.844 3.792 3.897 . 0 0 "[ . 1 . 2 . 3 ]" 1
146 1 17 C H1' 1 17 C H3' 4.000 . 4.000 3.826 3.794 3.865 . 0 0 "[ . 1 . 2 . 3 ]" 1
147 1 18 U H1' 1 18 U H3' 5.000 . 5.000 3.974 3.901 4.041 . 0 0 "[ . 1 . 2 . 3 ]" 1
148 1 19 U H1' 1 19 U H3' 4.000 . 4.000 3.878 3.845 3.919 . 0 0 "[ . 1 . 2 . 3 ]" 1
149 1 20 G H1' 1 20 G H3' 4.000 . 4.000 3.838 3.802 3.916 . 0 0 "[ . 1 . 2 . 3 ]" 1
150 1 21 U H1' 1 21 U H3' 4.000 . 4.000 3.876 3.853 3.904 . 0 0 "[ . 1 . 2 . 3 ]" 1
151 1 22 U H1' 1 22 U H3' 4.000 . 4.000 3.855 3.836 3.886 . 0 0 "[ . 1 . 2 . 3 ]" 1
152 1 24 C H1' 1 24 C H3' 4.000 . 4.000 3.853 3.819 3.890 . 0 0 "[ . 1 . 2 . 3 ]" 1
153 1 1 G H1' 1 1 G H4' 4.000 . 4.000 3.534 3.417 3.661 . 0 0 "[ . 1 . 2 . 3 ]" 1
154 1 3 A H1' 1 3 A H4' 4.000 . 4.000 3.580 3.310 3.682 . 0 0 "[ . 1 . 2 . 3 ]" 1
155 1 4 A H1' 1 4 A H4' 4.000 . 4.000 3.596 3.438 3.683 . 0 0 "[ . 1 . 2 . 3 ]" 1
156 1 5 G H1' 1 5 G H4' 4.000 . 4.000 3.405 3.198 3.650 . 0 0 "[ . 1 . 2 . 3 ]" 1
157 1 6 C H1' 1 6 C H4' 4.000 . 4.000 3.514 3.330 3.623 . 0 0 "[ . 1 . 2 . 3 ]" 1
158 1 7 A H1' 1 7 A H4' 4.000 . 4.000 3.449 3.148 3.688 . 0 0 "[ . 1 . 2 . 3 ]" 1
159 1 8 G H1' 1 8 G H4' 4.000 . 4.000 3.617 3.542 3.754 . 0 0 "[ . 1 . 2 . 3 ]" 1
160 1 9 G H1' 1 9 G H4' 4.000 . 4.000 3.391 3.239 3.585 . 0 0 "[ . 1 . 2 . 3 ]" 1
161 1 10 C H1' 1 10 C H4' 4.000 . 4.000 3.448 3.397 3.520 . 0 0 "[ . 1 . 2 . 3 ]" 1
162 1 11 U H1' 1 11 U H4' 4.000 . 4.000 3.231 3.045 3.430 . 0 0 "[ . 1 . 2 . 3 ]" 1
163 1 12 U H1' 1 12 U H4' 4.000 . 4.000 3.499 3.382 3.654 . 0 0 "[ . 1 . 2 . 3 ]" 1
164 1 13 C H1' 1 13 C H4' 4.000 . 4.000 3.451 3.315 3.553 . 0 0 "[ . 1 . 2 . 3 ]" 1
165 1 14 G H1' 1 14 G H4' 4.000 . 4.000 3.252 2.924 3.531 . 0 0 "[ . 1 . 2 . 3 ]" 1
166 1 16 C H1' 1 16 C H4' 4.000 . 4.000 3.428 3.325 3.565 . 0 0 "[ . 1 . 2 . 3 ]" 1
167 1 18 U H1' 1 18 U H4' 4.000 . 4.000 3.627 3.375 3.805 . 0 0 "[ . 1 . 2 . 3 ]" 1
168 1 19 U H1' 1 19 U H4' 4.000 . 4.000 3.461 3.321 3.553 . 0 0 "[ . 1 . 2 . 3 ]" 1
169 1 20 G H1' 1 20 G H4' 4.000 . 4.000 3.639 3.479 3.722 . 0 0 "[ . 1 . 2 . 3 ]" 1
170 1 21 U H1' 1 21 U H4' 4.000 . 4.000 3.471 3.381 3.602 . 0 0 "[ . 1 . 2 . 3 ]" 1
171 1 22 U H1' 1 22 U H4' 4.000 . 4.000 3.442 3.321 3.632 . 0 0 "[ . 1 . 2 . 3 ]" 1
172 1 23 U H1' 1 23 U H4' 4.000 . 4.000 3.426 3.291 3.541 . 0 0 "[ . 1 . 2 . 3 ]" 1
173 1 24 C H1' 1 24 C H4' 4.000 . 4.000 3.424 3.355 3.554 . 0 0 "[ . 1 . 2 . 3 ]" 1
174 1 1 G H1' 1 1 G H5' 6.000 . 6.000 4.891 4.431 5.253 . 0 0 "[ . 1 . 2 . 3 ]" 1
175 1 1 G H1' 1 1 G H5'' 6.000 . 6.000 4.519 4.311 5.186 . 0 0 "[ . 1 . 2 . 3 ]" 1
176 1 2 G H1' 1 2 G H5'' 6.000 . 6.000 5.231 5.171 5.256 . 0 0 "[ . 1 . 2 . 3 ]" 1
177 1 3 A H1' 1 3 A H5'' 6.000 . 6.000 5.240 5.185 5.266 . 0 0 "[ . 1 . 2 . 3 ]" 1
178 1 4 A H1' 1 4 A H5'' 6.000 . 6.000 5.237 5.198 5.259 . 0 0 "[ . 1 . 2 . 3 ]" 1
179 1 5 G H1' 1 5 G H5' 6.000 . 6.000 4.634 4.523 4.899 . 0 0 "[ . 1 . 2 . 3 ]" 1
180 1 5 G H1' 1 5 G H5'' 6.000 . 6.000 5.196 5.126 5.255 . 0 0 "[ . 1 . 2 . 3 ]" 1
181 1 6 C H1' 1 6 C H5'' 6.000 . 6.000 5.224 5.168 5.241 . 0 0 "[ . 1 . 2 . 3 ]" 1
182 1 7 A H1' 1 7 A H5' 6.000 . 6.000 4.778 4.497 5.238 . 0 0 "[ . 1 . 2 . 3 ]" 1
183 1 7 A H1' 1 7 A H5'' 7.000 . 7.000 4.882 4.246 5.229 . 0 0 "[ . 1 . 2 . 3 ]" 1
184 1 8 G H1' 1 8 G H5' 7.000 . 7.000 4.601 4.348 5.259 . 0 0 "[ . 1 . 2 . 3 ]" 1
185 1 8 G H1' 1 8 G H5'' 6.000 . 6.000 5.022 4.269 5.252 . 0 0 "[ . 1 . 2 . 3 ]" 1
186 1 9 G H1' 1 9 G H5'' 6.000 . 6.000 5.193 5.137 5.249 . 0 0 "[ . 1 . 2 . 3 ]" 1
187 1 10 C H1' 1 10 C H5'' 6.000 . 6.000 5.210 5.186 5.237 . 0 0 "[ . 1 . 2 . 3 ]" 1
188 1 11 U H1' 1 11 U H5' 6.000 . 6.000 4.508 4.436 4.565 . 0 0 "[ . 1 . 2 . 3 ]" 1
189 1 11 U H1' 1 11 U H5'' 6.000 . 6.000 5.112 5.006 5.200 . 0 0 "[ . 1 . 2 . 3 ]" 1
190 1 12 U H1' 1 12 U H5' 7.000 . 7.000 4.640 4.473 5.083 . 0 0 "[ . 1 . 2 . 3 ]" 1
191 1 12 U H1' 1 12 U H5'' 7.000 . 7.000 4.877 4.096 5.045 . 0 0 "[ . 1 . 2 . 3 ]" 1
192 1 13 C H1' 1 13 C H5' 7.000 . 7.000 4.717 4.650 4.787 . 0 0 "[ . 1 . 2 . 3 ]" 1
193 1 13 C H1' 1 13 C H5'' 7.000 . 7.000 4.944 4.902 4.991 . 0 0 "[ . 1 . 2 . 3 ]" 1
194 1 14 G H1' 1 14 G H5' 7.000 . 7.000 4.659 4.341 5.158 . 0 0 "[ . 1 . 2 . 3 ]" 1
195 1 14 G H1' 1 14 G H5'' 7.000 . 7.000 4.648 4.299 4.857 . 0 0 "[ . 1 . 2 . 3 ]" 1
196 1 16 C H1' 1 16 C H5'' 6.000 . 6.000 5.201 5.171 5.241 . 0 0 "[ . 1 . 2 . 3 ]" 1
197 1 17 C H1' 1 17 C H5'' 6.000 . 6.000 5.237 5.210 5.256 . 0 0 "[ . 1 . 2 . 3 ]" 1
198 1 19 U H1' 1 19 U H5' 7.000 . 7.000 4.827 4.350 5.221 . 0 0 "[ . 1 . 2 . 3 ]" 1
199 1 19 U H1' 1 19 U H5'' 7.000 . 7.000 4.831 4.327 5.224 . 0 0 "[ . 1 . 2 . 3 ]" 1
200 1 20 G H1' 1 20 G H5' 7.000 . 7.000 4.558 4.256 4.922 . 0 0 "[ . 1 . 2 . 3 ]" 1
201 1 20 G H1' 1 20 G H5'' 7.000 . 7.000 5.189 4.256 5.264 . 0 0 "[ . 1 . 2 . 3 ]" 1
202 1 21 U H1' 1 21 U H5' 6.000 . 6.000 4.616 4.564 4.677 . 0 0 "[ . 1 . 2 . 3 ]" 1
203 1 21 U H1' 1 21 U H5'' 6.000 . 6.000 5.212 5.191 5.235 . 0 0 "[ . 1 . 2 . 3 ]" 1
204 1 22 U H1' 1 22 U H5'' 6.000 . 6.000 5.204 5.167 5.247 . 0 0 "[ . 1 . 2 . 3 ]" 1
205 1 24 C H1' 1 24 C H5'' 6.000 . 6.000 5.201 5.181 5.244 . 0 0 "[ . 1 . 2 . 3 ]" 1
206 1 25 C H1' 1 25 C H5'' 6.000 . 6.000 5.215 5.197 5.235 . 0 0 "[ . 1 . 2 . 3 ]" 1
207 1 3 A H1' 1 3 A H2 6.000 . 6.000 4.765 4.612 4.866 . 0 0 "[ . 1 . 2 . 3 ]" 1
208 1 4 A H1' 1 4 A H2 6.000 . 6.000 4.743 4.639 4.900 . 0 0 "[ . 1 . 2 . 3 ]" 1
209 1 6 C H1' 1 6 C H5 6.000 . 6.000 5.324 5.233 5.375 . 0 0 "[ . 1 . 2 . 3 ]" 1
210 1 6 C H2' 1 6 C H5 6.000 . 6.000 5.312 5.119 5.466 . 0 0 "[ . 1 . 2 . 3 ]" 1
211 1 6 C H3' 1 6 C H5 5.000 . 5.000 4.477 4.186 5.004 0.004 3 0 "[ . 1 . 2 . 3 ]" 1
212 1 7 A H1' 1 7 A H2 6.000 . 6.000 4.856 4.610 4.948 . 0 0 "[ . 1 . 2 . 3 ]" 1
213 1 7 A H2 1 7 A H2' 6.000 . 6.000 4.527 4.269 5.220 . 0 0 "[ . 1 . 2 . 3 ]" 1
214 1 10 C H1' 1 10 C H5 6.000 . 6.000 5.361 5.332 5.386 . 0 0 "[ . 1 . 2 . 3 ]" 1
215 1 10 C H2' 1 10 C H5 6.000 . 6.000 5.144 5.033 5.282 . 0 0 "[ . 1 . 2 . 3 ]" 1
216 1 10 C H3' 1 10 C H5 5.000 . 5.000 4.342 4.145 4.564 . 0 0 "[ . 1 . 2 . 3 ]" 1
217 1 11 U H2' 1 11 U H5 6.000 . 6.000 5.170 5.058 5.333 . 0 0 "[ . 1 . 2 . 3 ]" 1
218 1 11 U H3' 1 11 U H5 6.000 . 6.000 4.880 4.276 5.407 . 0 0 "[ . 1 . 2 . 3 ]" 1
219 1 12 U H1' 1 12 U H5 6.000 . 6.000 5.380 5.358 5.386 . 0 0 "[ . 1 . 2 . 3 ]" 1
220 1 12 U H2' 1 12 U H5 5.000 . 5.000 4.685 4.657 4.778 . 0 0 "[ . 1 . 2 . 3 ]" 1
221 1 13 C H1' 1 13 C H5 6.000 . 6.000 5.365 5.338 5.378 . 0 0 "[ . 1 . 2 . 3 ]" 1
222 1 13 C H2' 1 13 C H5 5.000 . 5.000 4.745 4.692 4.834 . 0 0 "[ . 1 . 2 . 3 ]" 1
223 1 16 C H1' 1 16 C H5 6.000 . 6.000 5.330 5.283 5.369 . 0 0 "[ . 1 . 2 . 3 ]" 1
224 1 16 C H3' 1 16 C H5 6.000 . 6.000 4.517 4.274 4.707 . 0 0 "[ . 1 . 2 . 3 ]" 1
225 1 18 U H2' 1 18 U H5 5.000 . 5.000 4.128 4.068 4.347 . 0 0 "[ . 1 . 2 . 3 ]" 1
226 1 18 U H3' 1 18 U H5 6.000 . 6.000 6.123 5.995 6.236 0.236 23 0 "[ . 1 . 2 . 3 ]" 1
227 1 19 U H5 1 19 U H5'' 6.000 . 6.000 5.109 3.865 6.056 0.056 10 0 "[ . 1 . 2 . 3 ]" 1
228 1 19 U H2' 1 19 U H5 6.000 . 6.000 5.272 5.067 5.473 . 0 0 "[ . 1 . 2 . 3 ]" 1
229 1 19 U H3' 1 19 U H5 6.000 . 6.000 4.555 4.186 4.838 . 0 0 "[ . 1 . 2 . 3 ]" 1
230 1 19 U H5 1 19 U H5' 6.000 . 6.000 5.363 4.272 6.004 0.004 17 0 "[ . 1 . 2 . 3 ]" 1
231 1 21 U H5 1 21 U H5'' 6.000 . 6.000 5.889 5.571 6.044 0.044 10 0 "[ . 1 . 2 . 3 ]" 1
232 1 21 U H1' 1 21 U H5 6.000 . 6.000 5.302 5.269 5.365 . 0 0 "[ . 1 . 2 . 3 ]" 1
233 1 21 U H2' 1 21 U H5 6.000 . 6.000 5.349 5.095 5.464 . 0 0 "[ . 1 . 2 . 3 ]" 1
234 1 21 U H3' 1 21 U H5 6.000 . 6.000 4.624 4.387 4.768 . 0 0 "[ . 1 . 2 . 3 ]" 1
235 1 21 U H5 1 21 U H5' 6.000 . 6.000 5.340 4.839 5.697 . 0 0 "[ . 1 . 2 . 3 ]" 1
236 1 25 C H1' 1 25 C H5 6.000 . 6.000 5.347 5.301 5.377 . 0 0 "[ . 1 . 2 . 3 ]" 1
237 1 25 C H2' 1 25 C H5 6.000 . 6.000 5.212 5.084 5.361 . 0 0 "[ . 1 . 2 . 3 ]" 1
238 1 25 C H3' 1 25 C H5 5.000 . 5.000 4.458 4.289 4.660 . 0 0 "[ . 1 . 2 . 3 ]" 1
239 1 1 G H1' 1 2 G H8 5.000 . 5.000 4.651 4.475 5.024 0.024 13 0 "[ . 1 . 2 . 3 ]" 1
240 1 2 G H1' 1 3 A H8 5.000 . 5.000 4.607 4.405 4.812 . 0 0 "[ . 1 . 2 . 3 ]" 1
241 1 3 A H1' 1 4 A H8 5.000 . 5.000 4.658 4.450 4.928 . 0 0 "[ . 1 . 2 . 3 ]" 1
242 1 3 A H2 1 4 A H1' 5.000 . 5.000 4.315 3.070 5.056 0.056 13 0 "[ . 1 . 2 . 3 ]" 1
243 1 4 A H1' 1 5 G H8 6.000 . 6.000 4.674 4.403 5.717 . 0 0 "[ . 1 . 2 . 3 ]" 1
244 1 4 A H2 1 5 G H1' 4.000 . 4.000 3.962 3.564 4.072 0.072 14 0 "[ . 1 . 2 . 3 ]" 1
245 1 5 G H1' 1 6 C H5 6.000 . 6.000 5.195 4.931 5.673 . 0 0 "[ . 1 . 2 . 3 ]" 1
246 1 5 G H1' 1 6 C H6 6.000 . 6.000 4.741 4.476 5.026 . 0 0 "[ . 1 . 2 . 3 ]" 1
247 1 6 C H1' 1 7 A H8 5.000 . 5.000 4.626 4.314 4.988 . 0 0 "[ . 1 . 2 . 3 ]" 1
248 1 7 A H1' 1 8 G H8 5.000 . 5.000 4.762 4.435 5.114 0.114 23 0 "[ . 1 . 2 . 3 ]" 1
249 1 7 A H2 1 8 G H1' 5.000 . 5.000 3.485 2.997 4.041 . 0 0 "[ . 1 . 2 . 3 ]" 1
250 1 8 G H1' 1 9 G H8 5.000 . 5.000 4.641 4.378 5.012 0.012 4 0 "[ . 1 . 2 . 3 ]" 1
251 1 9 G H1' 1 10 C H6 5.000 . 5.000 4.847 4.664 5.035 0.035 21 0 "[ . 1 . 2 . 3 ]" 1
252 1 10 C H1' 1 11 U H6 5.000 . 5.000 4.870 4.594 5.050 0.050 21 0 "[ . 1 . 2 . 3 ]" 1
253 1 11 U H1' 1 12 U H6 6.000 . 6.000 5.679 4.865 6.047 0.047 8 0 "[ . 1 . 2 . 3 ]" 1
254 1 12 U H1' 1 13 C H6 6.000 . 6.000 5.221 4.734 5.631 . 0 0 "[ . 1 . 2 . 3 ]" 1
255 1 16 C H1' 1 17 C H6 5.000 . 5.000 4.890 4.647 5.031 0.031 29 0 "[ . 1 . 2 . 3 ]" 1
256 1 17 C H1' 1 18 U H6 5.000 . 5.000 3.887 3.388 5.080 0.080 1 0 "[ . 1 . 2 . 3 ]" 1
257 1 18 U H1' 1 19 U H6 7.000 . 7.000 4.015 2.608 5.010 . 0 0 "[ . 1 . 2 . 3 ]" 1
258 1 19 U H1' 1 20 G H8 5.000 . 5.000 4.918 4.544 5.160 0.160 16 0 "[ . 1 . 2 . 3 ]" 1
259 1 20 G H1' 1 21 U H5 6.000 . 6.000 5.600 5.188 5.906 . 0 0 "[ . 1 . 2 . 3 ]" 1
260 1 20 G H1' 1 21 U H6 5.000 . 5.000 4.827 4.584 5.057 0.057 5 0 "[ . 1 . 2 . 3 ]" 1
261 1 21 U H1' 1 22 U H6 5.000 . 5.000 4.718 4.407 5.018 0.018 21 0 "[ . 1 . 2 . 3 ]" 1
262 1 24 C H1' 1 25 C H6 5.000 . 5.000 4.936 4.734 5.056 0.056 13 0 "[ . 1 . 2 . 3 ]" 1
263 1 1 G H2' 1 2 G H8 3.000 . 3.000 1.938 1.770 2.266 . 0 0 "[ . 1 . 2 . 3 ]" 1
264 1 2 G H2' 1 3 A H8 3.000 . 3.000 1.894 1.811 2.063 . 0 0 "[ . 1 . 2 . 3 ]" 1
265 1 3 A H2' 1 4 A H8 3.000 . 3.000 1.932 1.788 2.188 . 0 0 "[ . 1 . 2 . 3 ]" 1
266 1 4 A H2' 1 5 G H8 5.000 . 5.000 2.106 1.812 3.171 . 0 0 "[ . 1 . 2 . 3 ]" 1
267 1 5 G H2' 1 6 C H5 4.000 . 4.000 3.152 2.616 3.722 . 0 0 "[ . 1 . 2 . 3 ]" 1
268 1 5 G H2' 1 6 C H6 3.000 . 3.000 2.027 1.883 2.241 . 0 0 "[ . 1 . 2 . 3 ]" 1
269 1 6 C H2' 1 7 A H8 3.000 . 3.000 2.181 1.901 2.954 . 0 0 "[ . 1 . 2 . 3 ]" 1
270 1 7 A H2 1 8 G H2' 6.000 . 6.000 6.053 5.751 6.141 0.141 11 0 "[ . 1 . 2 . 3 ]" 1
271 1 7 A H2' 1 8 G H8 4.000 . 4.000 2.296 1.817 3.249 . 0 0 "[ . 1 . 2 . 3 ]" 1
272 1 8 G H2' 1 9 G H8 3.000 . 3.000 2.086 1.858 2.435 . 0 0 "[ . 1 . 2 . 3 ]" 1
273 1 9 G H2' 1 10 C H5 4.000 . 4.000 3.246 2.926 3.748 . 0 0 "[ . 1 . 2 . 3 ]" 1
274 1 9 G H2' 1 10 C H6 3.000 . 3.000 2.138 1.988 2.293 . 0 0 "[ . 1 . 2 . 3 ]" 1
275 1 10 C H2' 1 11 U H6 4.000 . 4.000 2.324 2.006 2.484 . 0 0 "[ . 1 . 2 . 3 ]" 1
276 1 10 C H2' 1 11 U H5 5.000 . 5.000 3.962 3.681 4.155 . 0 0 "[ . 1 . 2 . 3 ]" 1
277 1 11 U H2' 1 12 U H6 6.000 . 6.000 4.497 3.990 4.815 . 0 0 "[ . 1 . 2 . 3 ]" 1
278 1 12 U H2' 1 13 C H5 6.000 . 6.000 3.089 2.351 4.292 . 0 0 "[ . 1 . 2 . 3 ]" 1
279 1 12 U H2' 1 13 C H6 6.000 . 6.000 3.161 2.724 3.607 . 0 0 "[ . 1 . 2 . 3 ]" 1
280 1 14 G H2' 1 15 G H8 6.000 . 6.000 3.354 3.053 3.838 . 0 0 "[ . 1 . 2 . 3 ]" 1
281 1 15 G H2' 1 16 C H5 4.000 . 4.000 3.421 2.861 3.762 . 0 0 "[ . 1 . 2 . 3 ]" 1
282 1 15 G H2' 1 16 C H6 3.000 . 3.000 2.107 1.910 2.402 . 0 0 "[ . 1 . 2 . 3 ]" 1
283 1 16 C H2' 1 17 C H5 5.000 . 5.000 2.991 2.446 3.434 . 0 0 "[ . 1 . 2 . 3 ]" 1
284 1 16 C H2' 1 17 C H6 3.000 . 3.000 2.173 1.954 2.311 . 0 0 "[ . 1 . 2 . 3 ]" 1
285 1 17 C H2' 1 18 U H5 4.000 . 4.000 2.998 2.398 4.052 0.052 27 0 "[ . 1 . 2 . 3 ]" 1
286 1 17 C H2' 1 18 U H6 3.000 . 3.000 2.123 1.931 2.717 . 0 0 "[ . 1 . 2 . 3 ]" 1
287 1 18 U H2' 1 19 U H6 4.000 . 4.000 3.901 3.240 4.121 0.121 17 0 "[ . 1 . 2 . 3 ]" 1
288 1 18 U H2' 1 19 U H5 6.000 . 6.000 3.901 2.924 4.869 . 0 0 "[ . 1 . 2 . 3 ]" 1
289 1 19 U H2' 1 20 G H8 3.000 . 3.000 2.419 1.959 3.056 0.056 1 0 "[ . 1 . 2 . 3 ]" 1
290 1 20 G H2' 1 21 U H5 5.000 . 5.000 3.949 3.366 4.311 . 0 0 "[ . 1 . 2 . 3 ]" 1
291 1 20 G H2' 1 21 U H6 3.000 . 3.000 2.322 2.020 2.628 . 0 0 "[ . 1 . 2 . 3 ]" 1
292 1 21 U H2' 1 22 U H6 3.000 . 3.000 2.038 1.900 2.249 . 0 0 "[ . 1 . 2 . 3 ]" 1
293 1 23 U H2' 1 24 C H6 3.000 . 3.000 2.013 1.862 2.198 . 0 0 "[ . 1 . 2 . 3 ]" 1
294 1 24 C H2' 1 25 C H5 4.000 . 4.000 3.184 2.669 3.721 . 0 0 "[ . 1 . 2 . 3 ]" 1
295 1 24 C H2' 1 25 C H6 3.000 . 3.000 2.191 2.055 2.287 . 0 0 "[ . 1 . 2 . 3 ]" 1
296 1 1 G H3' 1 2 G H8 4.000 . 4.000 3.007 2.494 3.509 . 0 0 "[ . 1 . 2 . 3 ]" 1
297 1 2 G H3' 1 3 A H8 3.000 . 3.000 2.916 2.532 3.205 0.205 27 0 "[ . 1 . 2 . 3 ]" 1
298 1 3 A H3' 1 4 A H8 3.000 . 3.000 2.908 2.614 3.128 0.128 30 0 "[ . 1 . 2 . 3 ]" 1
299 1 5 G H3' 1 6 C H5 4.000 . 4.000 3.145 2.341 3.710 . 0 0 "[ . 1 . 2 . 3 ]" 1
300 1 5 G H3' 1 6 C H6 4.000 . 4.000 3.299 3.009 3.653 . 0 0 "[ . 1 . 2 . 3 ]" 1
301 1 6 C H3' 1 7 A H8 5.000 . 5.000 2.856 2.299 3.550 . 0 0 "[ . 1 . 2 . 3 ]" 1
302 1 7 A H3' 1 8 G H8 5.000 . 5.000 2.713 1.908 3.903 . 0 0 "[ . 1 . 2 . 3 ]" 1
303 1 9 G H3' 1 10 C H5 5.000 . 5.000 3.612 3.116 4.025 . 0 0 "[ . 1 . 2 . 3 ]" 1
304 1 9 G H3' 1 10 C H6 4.000 . 4.000 3.551 3.057 3.858 . 0 0 "[ . 1 . 2 . 3 ]" 1
305 1 10 C H3' 1 11 U H5 4.000 . 4.000 3.204 3.080 3.325 . 0 0 "[ . 1 . 2 . 3 ]" 1
306 1 10 C H3' 1 11 U H6 3.000 . 3.000 2.626 2.459 2.899 . 0 0 "[ . 1 . 2 . 3 ]" 1
307 1 11 U H3' 1 12 U H5 5.000 . 5.000 4.999 4.749 5.052 0.052 6 0 "[ . 1 . 2 . 3 ]" 1
308 1 12 U H3' 1 13 C H5 3.000 . 3.000 2.342 2.015 3.025 0.025 9 0 "[ . 1 . 2 . 3 ]" 1
309 1 12 U H3' 1 13 C H6 3.000 . 3.000 1.957 1.776 2.208 . 0 0 "[ . 1 . 2 . 3 ]" 1
310 1 14 G H3' 1 15 G H8 4.000 . 4.000 2.983 1.856 4.036 0.036 2 0 "[ . 1 . 2 . 3 ]" 1
311 1 15 G H3' 1 16 C H5 4.000 . 4.000 3.312 2.499 3.800 . 0 0 "[ . 1 . 2 . 3 ]" 1
312 1 15 G H3' 1 16 C H6 4.000 . 4.000 3.247 2.921 3.487 . 0 0 "[ . 1 . 2 . 3 ]" 1
313 1 16 C H3' 1 17 C H5 5.000 . 5.000 3.297 2.964 3.671 . 0 0 "[ . 1 . 2 . 3 ]" 1
314 1 16 C H3' 1 17 C H6 4.000 . 4.000 3.574 3.311 3.762 . 0 0 "[ . 1 . 2 . 3 ]" 1
315 1 17 C H3' 1 18 U H5 6.000 . 6.000 4.741 3.217 5.248 . 0 0 "[ . 1 . 2 . 3 ]" 1
316 1 17 C H3' 1 18 U H6 4.000 . 4.000 4.131 3.271 4.301 0.301 4 0 "[ . 1 . 2 . 3 ]" 1
317 1 18 U H3' 1 19 U H6 6.000 . 6.000 4.628 4.125 5.284 . 0 0 "[ . 1 . 2 . 3 ]" 1
318 1 18 U H3' 1 19 U H5 7.000 . 7.000 5.129 3.971 6.387 . 0 0 "[ . 1 . 2 . 3 ]" 1
319 1 19 U H3' 1 20 G H8 3.000 . 3.000 2.444 1.792 3.059 0.059 1 0 "[ . 1 . 2 . 3 ]" 1
320 1 20 G H3' 1 21 U H5 4.000 . 4.000 2.630 2.220 3.070 . 0 0 "[ . 1 . 2 . 3 ]" 1
321 1 20 G H3' 1 21 U H6 3.000 . 3.000 2.413 1.986 2.771 . 0 0 "[ . 1 . 2 . 3 ]" 1
322 1 24 C H3' 1 25 C H5 4.000 . 4.000 3.250 2.847 3.666 . 0 0 "[ . 1 . 2 . 3 ]" 1
323 1 24 C H3' 1 25 C H6 4.000 . 4.000 3.379 2.900 3.629 . 0 0 "[ . 1 . 2 . 3 ]" 1
324 1 6 C H4' 1 7 A H8 6.000 . 6.000 5.408 4.915 6.065 0.065 15 0 "[ . 1 . 2 . 3 ]" 1
325 1 10 C H4' 1 11 U H5 6.000 . 6.000 6.078 6.008 6.153 0.153 15 0 "[ . 1 . 2 . 3 ]" 1
326 1 11 U H4' 1 12 U H5 4.000 . 4.000 3.275 2.805 3.632 . 0 0 "[ . 1 . 2 . 3 ]" 1
327 1 11 U H4' 1 12 U H6 5.000 . 5.000 4.077 3.578 4.456 . 0 0 "[ . 1 . 2 . 3 ]" 1
328 1 12 U H4' 1 13 C H6 6.000 . 6.000 4.550 4.128 4.809 . 0 0 "[ . 1 . 2 . 3 ]" 1
329 1 19 U H4' 1 20 G H8 6.000 . 6.000 5.146 4.643 5.838 . 0 0 "[ . 1 . 2 . 3 ]" 1
330 1 6 C H5'' 1 7 A H8 7.000 . 7.000 5.902 5.353 6.642 . 0 0 "[ . 1 . 2 . 3 ]" 1
331 1 6 C H5' 1 7 A H8 7.000 . 7.000 6.280 5.877 7.020 0.020 14 0 "[ . 1 . 2 . 3 ]" 1
332 1 11 U H5'' 1 12 U H5 7.000 . 7.000 4.113 3.680 4.501 . 0 0 "[ . 1 . 2 . 3 ]" 1
333 1 11 U H5' 1 12 U H5 7.000 . 7.000 5.258 4.841 5.637 . 0 0 "[ . 1 . 2 . 3 ]" 1
334 1 12 U H5'' 1 13 C H5 6.000 . 6.000 2.747 1.925 3.187 . 0 0 "[ . 1 . 2 . 3 ]" 1
335 1 12 U H5'' 1 13 C H6 6.000 . 6.000 4.198 3.167 4.662 . 0 0 "[ . 1 . 2 . 3 ]" 1
336 1 12 U H5' 1 13 C H5 6.000 . 6.000 3.514 1.850 4.206 . 0 0 "[ . 1 . 2 . 3 ]" 1
337 1 12 U H5' 1 13 C H6 6.000 . 6.000 5.102 3.086 5.801 . 0 0 "[ . 1 . 2 . 3 ]" 1
338 1 13 C H5'' 1 14 G H8 7.000 . 7.000 5.953 5.019 7.003 0.003 24 0 "[ . 1 . 2 . 3 ]" 1
339 1 13 C H5' 1 14 G H8 7.000 . 7.000 5.054 4.132 5.929 . 0 0 "[ . 1 . 2 . 3 ]" 1
340 1 20 G H5'' 1 21 U H5 6.000 . 6.000 4.925 4.069 5.965 . 0 0 "[ . 1 . 2 . 3 ]" 1
341 1 20 G H5' 1 21 U H5 6.000 . 6.000 5.208 3.670 5.962 . 0 0 "[ . 1 . 2 . 3 ]" 1
342 1 1 G H2' 1 2 G H1' 6.000 . 6.000 4.080 3.391 4.735 . 0 0 "[ . 1 . 2 . 3 ]" 1
343 1 2 G H2' 1 3 A H1' 5.000 . 5.000 4.277 3.501 5.018 0.018 26 0 "[ . 1 . 2 . 3 ]" 1
344 1 5 G H2' 1 6 C H1' 6.000 . 6.000 4.515 3.763 4.876 . 0 0 "[ . 1 . 2 . 3 ]" 1
345 1 6 C H2' 1 7 A H1' 6.000 . 6.000 3.466 3.138 4.793 . 0 0 "[ . 1 . 2 . 3 ]" 1
346 1 17 C H2' 1 18 U H1' 6.000 . 6.000 5.413 3.712 5.779 . 0 0 "[ . 1 . 2 . 3 ]" 1
347 1 20 G H2' 1 21 U H1' 5.000 . 5.000 3.757 3.053 4.163 . 0 0 "[ . 1 . 2 . 3 ]" 1
348 1 24 C H2' 1 25 C H1' 5.000 . 5.000 4.418 3.629 4.869 . 0 0 "[ . 1 . 2 . 3 ]" 1
349 1 8 G H1' 1 9 G H1' 6.000 . 6.000 5.894 5.453 6.092 0.092 23 0 "[ . 1 . 2 . 3 ]" 1
350 1 9 G H1' 1 10 C H1' 6.000 . 6.000 5.736 4.685 6.063 0.063 25 0 "[ . 1 . 2 . 3 ]" 1
351 1 10 C H1' 1 11 U H1' 6.000 . 6.000 5.773 5.288 6.041 0.041 27 0 "[ . 1 . 2 . 3 ]" 1
352 1 11 U H1' 1 12 U H3' 7.000 . 7.000 6.086 5.410 6.714 . 0 0 "[ . 1 . 2 . 3 ]" 1
353 1 13 C H5'' 1 14 G H1' 7.000 . 7.000 5.559 4.732 6.505 . 0 0 "[ . 1 . 2 . 3 ]" 1
354 1 13 C H5' 1 14 G H1' 7.000 . 7.000 5.388 4.740 6.384 . 0 0 "[ . 1 . 2 . 3 ]" 1
355 1 13 C H1' 1 14 G H5'' 7.000 . 7.000 5.512 1.752 6.709 . 0 0 "[ . 1 . 2 . 3 ]" 1
356 1 13 C H1' 1 14 G H5' 7.000 . 7.000 4.977 3.032 5.344 . 0 0 "[ . 1 . 2 . 3 ]" 1
357 1 14 G H1' 1 15 G H3' 7.000 . 7.000 7.078 7.000 7.237 0.237 20 0 "[ . 1 . 2 . 3 ]" 1
358 1 14 G H3' 1 15 G H1' 6.000 . 6.000 4.765 4.282 5.589 . 0 0 "[ . 1 . 2 . 3 ]" 1
359 1 17 C H1' 1 18 U H3' 7.000 . 7.000 6.892 6.345 7.096 0.096 18 0 "[ . 1 . 2 . 3 ]" 1
360 1 20 G H1' 1 21 U H1' 6.000 . 6.000 5.672 4.924 6.038 0.038 3 0 "[ . 1 . 2 . 3 ]" 1
361 1 1 G H8 1 2 G H8 6.000 . 6.000 5.049 4.041 5.640 . 0 0 "[ . 1 . 2 . 3 ]" 1
362 1 2 G H8 1 3 A H8 6.000 . 6.000 5.036 4.111 5.612 . 0 0 "[ . 1 . 2 . 3 ]" 1
363 1 3 A H2 1 4 A H2 6.000 . 6.000 4.583 3.910 5.087 . 0 0 "[ . 1 . 2 . 3 ]" 1
364 1 3 A H2 1 4 A H8 6.000 . 6.000 5.523 4.881 6.045 0.045 9 0 "[ . 1 . 2 . 3 ]" 1
365 1 4 A H2 1 5 G H8 6.000 . 6.000 5.239 4.096 6.007 0.007 16 0 "[ . 1 . 2 . 3 ]" 1
366 1 4 A H8 1 5 G H8 6.000 . 6.000 4.738 4.046 5.531 . 0 0 "[ . 1 . 2 . 3 ]" 1
367 1 5 G H8 1 6 C H5 5.000 . 5.000 4.128 3.739 4.824 . 0 0 "[ . 1 . 2 . 3 ]" 1
368 1 5 G H8 1 6 C H6 6.000 . 6.000 5.346 4.997 5.732 . 0 0 "[ . 1 . 2 . 3 ]" 1
369 1 6 C H6 1 7 A H8 6.000 . 6.000 4.246 3.589 5.333 . 0 0 "[ . 1 . 2 . 3 ]" 1
370 1 7 A H8 1 8 G H8 6.000 . 6.000 4.634 3.152 5.365 . 0 0 "[ . 1 . 2 . 3 ]" 1
371 1 8 G H8 1 9 G H8 6.000 . 6.000 4.671 4.190 5.302 . 0 0 "[ . 1 . 2 . 3 ]" 1
372 1 9 G H8 1 10 C H5 6.000 . 6.000 4.572 3.769 4.971 . 0 0 "[ . 1 . 2 . 3 ]" 1
373 1 9 G H8 1 10 C H6 6.000 . 6.000 5.489 4.816 5.860 . 0 0 "[ . 1 . 2 . 3 ]" 1
374 1 10 C H5 1 11 U H5 4.000 . 4.000 2.784 2.617 3.114 . 0 0 "[ . 1 . 2 . 3 ]" 1
375 1 10 C H6 1 11 U H5 6.000 . 6.000 3.133 2.981 3.388 . 0 0 "[ . 1 . 2 . 3 ]" 1
376 1 10 C H6 1 11 U H6 6.000 . 6.000 3.948 3.694 4.122 . 0 0 "[ . 1 . 2 . 3 ]" 1
377 1 12 U H6 1 13 C H5 6.000 . 6.000 4.549 4.267 5.152 . 0 0 "[ . 1 . 2 . 3 ]" 1
378 1 12 U H6 1 13 C H6 6.000 . 6.000 5.701 5.450 5.972 . 0 0 "[ . 1 . 2 . 3 ]" 1
379 1 15 G H8 1 16 C H5 6.000 . 6.000 4.443 3.785 4.915 . 0 0 "[ . 1 . 2 . 3 ]" 1
380 1 15 G H8 1 16 C H6 6.000 . 6.000 5.326 5.097 5.520 . 0 0 "[ . 1 . 2 . 3 ]" 1
381 1 16 C H5 1 17 C H5 5.000 . 5.000 4.663 4.096 5.031 0.031 21 0 "[ . 1 . 2 . 3 ]" 1
382 1 16 C H6 1 17 C H5 6.000 . 6.000 4.387 3.813 4.757 . 0 0 "[ . 1 . 2 . 3 ]" 1
383 1 17 C H6 1 18 U H6 6.000 . 6.000 5.702 5.119 6.055 0.055 7 0 "[ . 1 . 2 . 3 ]" 1
384 1 18 U H6 1 19 U H5 7.000 . 7.000 5.278 3.721 6.534 . 0 0 "[ . 1 . 2 . 3 ]" 1
385 1 20 G H8 1 21 U H5 6.000 . 6.000 3.703 3.240 4.114 . 0 0 "[ . 1 . 2 . 3 ]" 1
386 1 20 G H8 1 21 U H6 6.000 . 6.000 4.699 4.327 5.151 . 0 0 "[ . 1 . 2 . 3 ]" 1
387 1 21 U H5 1 22 U H5 5.000 . 5.000 4.760 4.040 5.058 0.058 13 0 "[ . 1 . 2 . 3 ]" 1
388 1 21 U H6 1 22 U H5 6.000 . 6.000 4.457 3.774 5.072 . 0 0 "[ . 1 . 2 . 3 ]" 1
389 1 21 U H6 1 22 U H6 6.000 . 6.000 5.537 5.077 5.828 . 0 0 "[ . 1 . 2 . 3 ]" 1
390 1 23 U H6 1 24 C H6 6.000 . 6.000 4.636 3.904 5.347 . 0 0 "[ . 1 . 2 . 3 ]" 1
391 1 24 C H5 1 25 C H5 5.000 . 5.000 4.494 3.624 5.018 0.018 6 0 "[ . 1 . 2 . 3 ]" 1
392 1 24 C H6 1 25 C H5 6.000 . 6.000 4.345 3.554 4.947 . 0 0 "[ . 1 . 2 . 3 ]" 1
393 1 24 C H6 1 25 C H6 6.000 . 6.000 5.369 4.697 5.856 . 0 0 "[ . 1 . 2 . 3 ]" 1
394 1 10 C H2' 1 11 U H5'' 7.000 . 7.000 4.135 3.746 4.511 . 0 0 "[ . 1 . 2 . 3 ]" 1
395 1 10 C H2' 1 11 U H5' 7.000 . 7.000 2.560 2.145 2.949 . 0 0 "[ . 1 . 2 . 3 ]" 1
396 1 11 U H2' 1 12 U H3' 4.000 . 4.000 3.919 3.382 4.107 0.107 21 0 "[ . 1 . 2 . 3 ]" 1
397 1 11 U H4' 1 12 U H2' 6.000 . 6.000 4.723 4.262 5.303 . 0 0 "[ . 1 . 2 . 3 ]" 1
398 1 12 U H3' 1 13 C H5' 6.000 . 6.000 3.799 3.062 4.199 . 0 0 "[ . 1 . 2 . 3 ]" 1
399 1 12 U H3' 1 13 C H5'' 6.000 . 6.000 4.502 4.113 4.811 . 0 0 "[ . 1 . 2 . 3 ]" 1
400 1 13 C H5'' 1 14 G H4' 7.000 . 7.000 5.778 4.868 6.932 . 0 0 "[ . 1 . 2 . 3 ]" 1
401 1 12 U H2' 1 13 C H5'' 7.000 . 7.000 5.606 5.074 5.923 . 0 0 "[ . 1 . 2 . 3 ]" 1
402 1 12 U H2' 1 13 C H5' 7.000 . 7.000 4.209 3.393 4.685 . 0 0 "[ . 1 . 2 . 3 ]" 1
403 1 13 C H4' 1 14 G H3' 6.000 . 6.000 3.933 3.080 5.589 . 0 0 "[ . 1 . 2 . 3 ]" 1
404 1 13 C H4' 1 14 G H4' 5.000 . 5.000 4.611 4.053 5.027 0.027 9 0 "[ . 1 . 2 . 3 ]" 1
405 1 13 C H4' 1 14 G H5' 5.000 . 5.000 3.171 2.001 5.176 0.176 24 0 "[ . 1 . 2 . 3 ]" 1
406 1 13 C H4' 1 14 G H5'' 5.000 . 5.000 3.676 2.946 4.836 . 0 0 "[ . 1 . 2 . 3 ]" 1
407 1 13 C H5' 1 14 G H4' 7.000 . 7.000 6.376 5.401 7.183 0.183 24 0 "[ . 1 . 2 . 3 ]" 1
408 1 13 C H5' 1 14 G H5'' 7.000 . 7.000 5.390 4.941 6.652 . 0 0 "[ . 1 . 2 . 3 ]" 1
409 1 13 C H5'' 1 14 G H5'' 7.000 . 7.000 4.566 3.872 5.478 . 0 0 "[ . 1 . 2 . 3 ]" 1
410 1 13 C H5' 1 14 G H5' 7.000 . 7.000 5.031 3.418 7.165 0.165 24 0 "[ . 1 . 2 . 3 ]" 1
411 1 13 C H5'' 1 14 G H5' 7.000 . 7.000 4.320 2.571 7.090 0.090 24 0 "[ . 1 . 2 . 3 ]" 1
412 1 14 G H3' 1 15 G H5' 7.000 . 7.000 3.956 3.157 5.090 . 0 0 "[ . 1 . 2 . 3 ]" 1
413 1 14 G H3' 1 15 G H5'' 7.000 . 7.000 3.941 1.940 4.796 . 0 0 "[ . 1 . 2 . 3 ]" 1
414 1 14 G H2' 1 15 G H5'' 7.000 . 7.000 3.365 2.205 3.871 . 0 0 "[ . 1 . 2 . 3 ]" 1
415 1 14 G H2' 1 15 G H3' 6.000 . 6.000 4.396 4.235 4.675 . 0 0 "[ . 1 . 2 . 3 ]" 1
416 1 14 G H2' 1 15 G H4' 4.000 . 4.000 2.757 2.370 3.047 . 0 0 "[ . 1 . 2 . 3 ]" 1
417 1 14 G H2' 1 15 G H5' 7.000 . 7.000 2.989 1.963 3.921 . 0 0 "[ . 1 . 2 . 3 ]" 1
418 1 3 A H2 1 24 C H1' 4.000 . 4.000 3.468 2.714 4.045 0.045 14 0 "[ . 1 . 2 . 3 ]" 1
419 1 4 A H2 1 23 U H1' 4.000 . 4.000 3.341 2.859 3.891 . 0 0 "[ . 1 . 2 . 3 ]" 1
420 1 7 A H2 1 19 U H2' 7.000 . 7.000 6.208 4.822 7.024 0.024 16 0 "[ . 1 . 2 . 3 ]" 1
421 1 7 A H2 1 20 G H1' 4.000 . 4.000 4.020 3.554 4.164 0.164 23 0 "[ . 1 . 2 . 3 ]" 1
422 1 7 A H2 1 20 G H8 6.000 . 6.000 5.258 4.813 5.913 . 0 0 "[ . 1 . 2 . 3 ]" 1
423 1 7 A H2 1 20 G H2' 7.000 . 7.000 5.797 5.349 6.149 . 0 0 "[ . 1 . 2 . 3 ]" 1
424 1 11 U H1' 1 13 C H5 6.000 . 6.000 5.120 4.678 5.584 . 0 0 "[ . 1 . 2 . 3 ]" 1
425 1 11 U H2' 1 13 C H5 4.000 . 4.000 2.367 2.004 2.786 . 0 0 "[ . 1 . 2 . 3 ]" 1
426 1 11 U H3' 1 13 C H5 5.000 . 5.000 3.647 3.267 4.341 . 0 0 "[ . 1 . 2 . 3 ]" 1
427 1 11 U H6 1 13 C H5 7.000 . 7.000 5.517 5.014 5.900 . 0 0 "[ . 1 . 2 . 3 ]" 1
428 1 21 U H2' 1 22 U H5 4.000 . 4.000 2.684 2.140 3.566 . 0 0 "[ . 1 . 2 . 3 ]" 1
429 1 22 U H3' 1 22 U H5 5.000 . 5.000 4.514 4.136 4.923 . 0 0 "[ . 1 . 2 . 3 ]" 1
430 1 22 U H3' 1 22 U H6 4.000 . 4.000 2.686 2.199 3.209 . 0 0 "[ . 1 . 2 . 3 ]" 1
431 1 23 U H2' 1 24 C H1' 4.000 . 4.000 3.836 3.428 4.088 0.088 4 0 "[ . 1 . 2 . 3 ]" 1
432 1 22 U H2' 1 23 U H6 3.000 . 3.000 2.034 1.855 2.247 . 0 0 "[ . 1 . 2 . 3 ]" 1
433 1 20 G H4' 1 20 G H8 4.000 . 4.000 4.054 3.967 4.198 0.198 23 0 "[ . 1 . 2 . 3 ]" 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 130
_Distance_constraint_stats_list.Viol_count 357
_Distance_constraint_stats_list.Viol_total 628.170
_Distance_constraint_stats_list.Viol_max 0.239
_Distance_constraint_stats_list.Viol_rms 0.0233
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0050
_Distance_constraint_stats_list.Viol_average_violations_only 0.0568
_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 2 G 1.111 0.086 12 0 "[ . 1 . 2 . 3 ]"
1 3 A 0.851 0.054 24 0 "[ . 1 . 2 . 3 ]"
1 4 A 1.225 0.082 22 0 "[ . 1 . 2 . 3 ]"
1 5 G 0.642 0.086 5 0 "[ . 1 . 2 . 3 ]"
1 6 C 0.861 0.086 5 0 "[ . 1 . 2 . 3 ]"
1 7 A 0.285 0.079 3 0 "[ . 1 . 2 . 3 ]"
1 8 G 0.101 0.035 16 0 "[ . 1 . 2 . 3 ]"
1 9 G 0.510 0.059 4 0 "[ . 1 . 2 . 3 ]"
1 10 C 4.406 0.209 8 0 "[ . 1 . 2 . 3 ]"
1 11 U 8.634 0.239 28 0 "[ . 1 . 2 . 3 ]"
1 12 U 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 13 C 2.891 0.112 13 0 "[ . 1 . 2 . 3 ]"
1 14 G 5.240 0.209 8 0 "[ . 1 . 2 . 3 ]"
1 15 G 8.232 0.239 28 0 "[ . 1 . 2 . 3 ]"
1 16 C 1.642 0.084 26 0 "[ . 1 . 2 . 3 ]"
1 17 C 0.572 0.056 2 0 "[ . 1 . 2 . 3 ]"
1 20 G 0.027 0.027 25 0 "[ . 1 . 2 . 3 ]"
1 21 U 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 22 U 1.543 0.072 9 0 "[ . 1 . 2 . 3 ]"
1 23 U 0.643 0.082 22 0 "[ . 1 . 2 . 3 ]"
1 24 C 1.107 0.086 12 0 "[ . 1 . 2 . 3 ]"
1 25 C 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
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 2 G H1 1 24 C H41 3.000 . 3.000 3.014 2.381 3.086 0.086 12 0 "[ . 1 . 2 . 3 ]" 2
2 1 2 G H1 1 24 C H42 6.000 . 6.000 4.411 3.869 4.516 . 0 0 "[ . 1 . 2 . 3 ]" 2
3 1 2 G H1 1 24 C H5 6.000 . 6.000 5.169 4.915 5.352 . 0 0 "[ . 1 . 2 . 3 ]" 2
4 1 2 G H1 1 24 C H6 6.000 . 6.000 5.587 5.330 5.794 . 0 0 "[ . 1 . 2 . 3 ]" 2
5 1 2 G H1 1 25 C H5 6.000 . 6.000 4.622 3.624 5.699 . 0 0 "[ . 1 . 2 . 3 ]" 2
6 1 2 G H1 1 25 C H41 6.000 . 6.000 3.966 3.148 5.627 . 0 0 "[ . 1 . 2 . 3 ]" 2
7 1 2 G H1 1 3 A H2 6.000 . 6.000 4.770 3.584 5.860 . 0 0 "[ . 1 . 2 . 3 ]" 2
8 1 2 G H1 1 3 A H61 6.000 . 6.000 4.083 3.266 5.327 . 0 0 "[ . 1 . 2 . 3 ]" 2
9 1 2 G H1 1 3 A H62 6.000 . 6.000 4.288 3.349 5.506 . 0 0 "[ . 1 . 2 . 3 ]" 2
10 1 3 A H61 1 24 C H41 6.000 . 6.000 2.948 2.162 3.972 . 0 0 "[ . 1 . 2 . 3 ]" 2
11 1 3 A H62 1 24 C H41 6.000 . 6.000 3.733 2.919 4.858 . 0 0 "[ . 1 . 2 . 3 ]" 2
12 1 24 C H41 1 25 C H5 6.000 . 6.000 5.155 4.517 5.902 . 0 0 "[ . 1 . 2 . 3 ]" 2
13 1 3 A H2 1 23 U H3 3.000 . 3.000 2.840 2.506 3.022 0.022 20 0 "[ . 1 . 2 . 3 ]" 2
14 1 3 A H61 1 23 U H3 3.000 . 3.000 2.583 2.213 2.976 . 0 0 "[ . 1 . 2 . 3 ]" 2
15 1 3 A H62 1 23 U H3 6.000 . 6.000 3.920 3.649 4.241 . 0 0 "[ . 1 . 2 . 3 ]" 2
16 1 2 G H1 1 23 U H3 6.000 . 6.000 5.147 4.411 6.004 0.004 22 0 "[ . 1 . 2 . 3 ]" 2
17 1 23 U H3 1 24 C H42 6.000 . 6.000 4.914 4.054 5.878 . 0 0 "[ . 1 . 2 . 3 ]" 2
18 1 23 U H3 1 24 C H41 6.000 . 6.000 4.690 3.741 5.953 . 0 0 "[ . 1 . 2 . 3 ]" 2
19 1 23 U H3 1 24 C H1' 6.000 . 6.000 5.174 4.267 5.926 . 0 0 "[ . 1 . 2 . 3 ]" 2
20 1 4 A H2 1 23 U H3 6.000 . 6.000 3.534 2.994 3.910 . 0 0 "[ . 1 . 2 . 3 ]" 2
21 1 4 A H61 1 23 U H3 6.000 . 6.000 3.366 2.743 4.103 . 0 0 "[ . 1 . 2 . 3 ]" 2
22 1 4 A H62 1 23 U H3 6.000 . 6.000 3.996 3.473 4.673 . 0 0 "[ . 1 . 2 . 3 ]" 2
23 1 4 A H1' 1 23 U H3 6.000 . 6.000 5.812 4.898 6.082 0.082 22 0 "[ . 1 . 2 . 3 ]" 2
24 1 23 U H1' 1 23 U H3 6.000 . 6.000 4.518 4.478 4.568 . 0 0 "[ . 1 . 2 . 3 ]" 2
25 1 4 A H2 1 22 U H3 3.000 . 3.000 2.957 2.390 3.072 0.072 9 0 "[ . 1 . 2 . 3 ]" 2
26 1 4 A H61 1 22 U H3 3.000 . 3.000 2.322 2.004 2.953 . 0 0 "[ . 1 . 2 . 3 ]" 2
27 1 4 A H62 1 22 U H3 6.000 . 6.000 3.702 3.490 4.258 . 0 0 "[ . 1 . 2 . 3 ]" 2
28 1 22 U H3 1 23 U H3 6.000 . 6.000 3.714 3.027 4.252 . 0 0 "[ . 1 . 2 . 3 ]" 2
29 1 22 U H3 1 23 U H1' 6.000 . 6.000 5.423 4.435 6.014 0.014 27 0 "[ . 1 . 2 . 3 ]" 2
30 1 3 A H61 1 22 U H3 6.000 . 6.000 4.991 3.848 6.007 0.007 30 0 "[ . 1 . 2 . 3 ]" 2
31 1 3 A H2 1 22 U H3 6.000 . 6.000 5.986 5.550 6.054 0.054 24 0 "[ . 1 . 2 . 3 ]" 2
32 1 21 U H3 1 22 U H3 6.000 . 6.000 4.526 3.539 5.408 . 0 0 "[ . 1 . 2 . 3 ]" 2
33 1 5 G H1 1 22 U H3 6.000 . 6.000 3.482 2.606 4.485 . 0 0 "[ . 1 . 2 . 3 ]" 2
34 1 5 G H22 1 22 U H3 6.000 . 6.720 4.895 4.275 6.239 . 0 0 "[ . 1 . 2 . 3 ]" 2
35 1 5 G H21 1 22 U H3 6.000 . 6.720 4.435 3.953 5.744 . 0 0 "[ . 1 . 2 . 3 ]" 2
36 1 5 G H1' 1 22 U H3 6.000 . 6.000 5.479 4.680 6.042 0.042 21 0 "[ . 1 . 2 . 3 ]" 2
37 1 5 G H1 1 21 U H3 3.000 . 3.000 2.227 1.971 2.854 . 0 0 "[ . 1 . 2 . 3 ]" 2
38 1 5 G H22 1 21 U H3 6.000 . 6.720 5.604 5.346 6.305 . 0 0 "[ . 1 . 2 . 3 ]" 2
39 1 5 G H21 1 21 U H3 6.000 . 6.720 4.188 3.963 4.915 . 0 0 "[ . 1 . 2 . 3 ]" 2
40 1 6 C H42 1 21 U H3 6.000 . 6.000 4.319 3.171 5.513 . 0 0 "[ . 1 . 2 . 3 ]" 2
41 1 6 C H41 1 21 U H3 6.000 . 6.000 3.245 2.480 4.359 . 0 0 "[ . 1 . 2 . 3 ]" 2
42 1 5 G H1 1 6 C H42 6.000 . 6.000 4.639 3.911 5.140 . 0 0 "[ . 1 . 2 . 3 ]" 2
43 1 5 G H1 1 6 C H41 6.000 . 6.000 3.994 3.453 4.421 . 0 0 "[ . 1 . 2 . 3 ]" 2
44 1 5 G H1 1 6 C H1' 6.000 . 6.000 5.453 4.721 6.023 0.023 10 0 "[ . 1 . 2 . 3 ]" 2
45 1 5 G H22 1 6 C H42 6.000 . 6.720 6.630 6.000 6.806 0.086 5 0 "[ . 1 . 2 . 3 ]" 2
46 1 5 G H21 1 6 C H42 6.000 . 6.720 6.167 5.390 6.625 . 0 0 "[ . 1 . 2 . 3 ]" 2
47 1 5 G H22 1 6 C H41 6.000 . 6.720 6.397 5.737 6.696 . 0 0 "[ . 1 . 2 . 3 ]" 2
48 1 5 G H21 1 6 C H41 6.000 . 6.720 5.544 4.998 5.845 . 0 0 "[ . 1 . 2 . 3 ]" 2
49 1 5 G H22 1 6 C H1' 6.000 . 6.720 3.499 2.488 4.553 . 0 0 "[ . 1 . 2 . 3 ]" 2
50 1 5 G H21 1 6 C H1' 6.000 . 6.720 4.208 3.307 5.051 . 0 0 "[ . 1 . 2 . 3 ]" 2
51 1 5 G H22 1 6 C H6 6.000 . 6.720 4.982 4.410 5.949 . 0 0 "[ . 1 . 2 . 3 ]" 2
52 1 5 G H21 1 6 C H6 6.000 . 6.720 5.732 5.060 6.689 . 0 0 "[ . 1 . 2 . 3 ]" 2
53 1 4 A H2 1 5 G H22 6.000 . 6.720 5.545 4.824 6.376 . 0 0 "[ . 1 . 2 . 3 ]" 2
54 1 4 A H2 1 5 G H21 6.000 . 6.720 5.990 5.055 6.727 0.007 24 0 "[ . 1 . 2 . 3 ]" 2
55 1 5 G H22 1 22 U H1' 6.000 . 6.720 2.859 2.328 3.685 . 0 0 "[ . 1 . 2 . 3 ]" 2
56 1 5 G H21 1 22 U H1' 6.000 . 6.720 3.215 2.539 3.914 . 0 0 "[ . 1 . 2 . 3 ]" 2
57 1 6 C H41 1 20 G H1 3.000 . 3.000 2.444 1.963 3.027 0.027 25 0 "[ . 1 . 2 . 3 ]" 2
58 1 6 C H42 1 20 G H1 6.000 . 6.000 3.904 3.477 4.432 . 0 0 "[ . 1 . 2 . 3 ]" 2
59 1 6 C H5 1 20 G H1 6.000 . 6.000 4.907 4.667 5.180 . 0 0 "[ . 1 . 2 . 3 ]" 2
60 1 20 G H1 1 21 U H3 6.000 . 6.000 3.816 3.238 4.375 . 0 0 "[ . 1 . 2 . 3 ]" 2
61 1 20 G H1 1 21 U H1' 6.000 . 6.000 4.309 3.557 5.606 . 0 0 "[ . 1 . 2 . 3 ]" 2
62 1 5 G H1 1 20 G H1 6.000 . 6.000 4.137 2.968 4.914 . 0 0 "[ . 1 . 2 . 3 ]" 2
63 1 7 A H1' 1 20 G H1 6.000 . 6.000 4.383 3.715 5.639 . 0 0 "[ . 1 . 2 . 3 ]" 2
64 1 7 A H2 1 20 G H1 6.000 . 6.000 4.384 3.992 4.762 . 0 0 "[ . 1 . 2 . 3 ]" 2
65 1 6 C H41 1 7 A H2 6.000 . 6.000 5.819 5.260 6.079 0.079 3 0 "[ . 1 . 2 . 3 ]" 2
66 1 8 G H1 1 17 C H41 3.000 . 3.000 2.324 1.821 3.035 0.035 16 0 "[ . 1 . 2 . 3 ]" 2
67 1 8 G H1 1 17 C H42 6.000 . 6.000 3.795 3.431 4.438 . 0 0 "[ . 1 . 2 . 3 ]" 2
68 1 8 G H1 1 17 C H5 6.000 . 6.000 4.860 4.545 5.255 . 0 0 "[ . 1 . 2 . 3 ]" 2
69 1 8 G H1 1 17 C H6 6.000 . 6.000 5.632 5.280 5.780 . 0 0 "[ . 1 . 2 . 3 ]" 2
70 1 8 G H1 1 9 G H1 6.000 . 6.000 4.115 3.000 5.173 . 0 0 "[ . 1 . 2 . 3 ]" 2
71 1 8 G H1 1 9 G H1' 6.000 . 6.000 5.449 4.485 5.934 . 0 0 "[ . 1 . 2 . 3 ]" 2
72 1 16 C H41 1 17 C H41 6.000 . 6.000 4.090 2.643 5.495 . 0 0 "[ . 1 . 2 . 3 ]" 2
73 1 16 C H5 1 17 C H41 6.000 . 6.000 5.594 4.720 6.035 0.035 3 0 "[ . 1 . 2 . 3 ]" 2
74 1 9 G H1 1 16 C H41 3.000 . 3.000 2.492 1.973 3.059 0.059 4 0 "[ . 1 . 2 . 3 ]" 2
75 1 9 G H1 1 16 C H42 6.000 . 6.000 3.870 3.314 4.492 . 0 0 "[ . 1 . 2 . 3 ]" 2
76 1 9 G H1 1 16 C H5 6.000 . 6.000 4.822 4.477 5.277 . 0 0 "[ . 1 . 2 . 3 ]" 2
77 1 9 G H1 1 15 G H22 6.000 . 6.000 5.438 4.297 6.005 0.005 27 0 "[ . 1 . 2 . 3 ]" 2
78 1 9 G H1 1 10 C H1' 6.000 . 6.000 5.834 5.209 6.042 0.042 23 0 "[ . 1 . 2 . 3 ]" 2
79 1 9 G H1 1 17 C H1' 6.000 . 6.000 5.692 5.120 6.015 0.015 10 0 "[ . 1 . 2 . 3 ]" 2
80 1 9 G H1 1 17 C H6 6.000 . 6.000 5.389 4.666 6.056 0.056 2 0 "[ . 1 . 2 . 3 ]" 2
81 1 15 G H22 1 16 C H41 6.000 . 6.000 6.044 6.011 6.084 0.084 26 0 "[ . 1 . 2 . 3 ]" 2
82 1 15 G H21 1 16 C H41 6.000 . 6.000 5.153 5.008 5.384 . 0 0 "[ . 1 . 2 . 3 ]" 2
83 1 16 C H41 1 17 C H5 6.000 . 6.000 5.437 4.895 6.014 0.014 10 0 "[ . 1 . 2 . 3 ]" 2
84 1 9 G H1 1 15 G H1 6.000 . 6.000 3.960 2.754 4.655 . 0 0 "[ . 1 . 2 . 3 ]" 2
85 1 10 C H41 1 15 G H1 3.000 . 3.000 2.221 1.869 2.736 . 0 0 "[ . 1 . 2 . 3 ]" 2
86 1 10 C H42 1 15 G H1 6.000 . 6.000 3.588 3.180 4.065 . 0 0 "[ . 1 . 2 . 3 ]" 2
87 1 10 C H5 1 15 G H1 6.000 . 6.000 4.625 4.365 5.006 . 0 0 "[ . 1 . 2 . 3 ]" 2
88 1 11 U H1' 1 15 G H1 6.000 . 6.000 4.456 3.484 5.261 . 0 0 "[ . 1 . 2 . 3 ]" 2
89 1 14 G H1 1 15 G H1 6.000 . 6.000 3.881 3.494 4.600 . 0 0 "[ . 1 . 2 . 3 ]" 2
90 1 15 G H1 1 16 C H41 6.000 . 6.000 3.634 3.495 3.997 . 0 0 "[ . 1 . 2 . 3 ]" 2
91 1 15 G H1 1 16 C H1' 6.000 . 6.000 5.540 5.221 5.980 . 0 0 "[ . 1 . 2 . 3 ]" 2
92 1 10 C H41 1 15 G H22 6.000 . 6.000 5.463 4.980 6.035 0.035 22 0 "[ . 1 . 2 . 3 ]" 2
93 1 10 C H41 1 15 G H21 6.000 . 6.000 4.206 3.737 4.791 . 0 0 "[ . 1 . 2 . 3 ]" 2
94 1 10 C H41 1 11 U H5 6.000 . 6.000 4.813 4.458 5.271 . 0 0 "[ . 1 . 2 . 3 ]" 2
95 1 11 U H1' 1 15 G H22 6.000 . 6.000 4.257 3.478 4.936 . 0 0 "[ . 1 . 2 . 3 ]" 2
96 1 11 U H1' 1 15 G H21 6.000 . 6.000 3.852 3.021 4.417 . 0 0 "[ . 1 . 2 . 3 ]" 2
97 1 11 U HO2' 1 15 G H21 6.000 . 6.000 5.991 5.210 6.073 0.073 23 0 "[ . 1 . 2 . 3 ]" 2
98 1 15 G H22 1 16 C H1' 6.000 . 6.000 3.261 2.614 4.068 . 0 0 "[ . 1 . 2 . 3 ]" 2
99 1 15 G H21 1 16 C H1' 6.000 . 6.000 4.290 3.776 5.053 . 0 0 "[ . 1 . 2 . 3 ]" 2
100 1 10 C H1' 1 15 G H21 6.000 . 6.000 4.154 3.950 4.443 . 0 0 "[ . 1 . 2 . 3 ]" 2
101 1 10 C H2' 1 15 G H21 6.000 . 6.000 4.252 3.764 4.704 . 0 0 "[ . 1 . 2 . 3 ]" 2
102 1 10 C H42 1 11 U H3 6.000 . 6.000 3.946 3.209 4.683 . 0 0 "[ . 1 . 2 . 3 ]" 2
103 1 11 U H3 1 15 G H8 6.000 . 6.000 6.195 6.114 6.239 0.239 28 0 "[ . 1 . 2 . 3 ]" 2
104 1 11 U H6 1 11 U HO2' 6.000 . 6.000 5.123 4.960 5.287 . 0 0 "[ . 1 . 2 . 3 ]" 2
105 1 11 U H5 1 11 U HO2' 7.000 . 7.000 6.833 6.572 7.004 0.004 10 0 "[ . 1 . 2 . 3 ]" 2
106 1 11 U HO2' 1 12 U H2' 6.000 . 6.000 2.209 1.745 2.935 . 0 0 "[ . 1 . 2 . 3 ]" 2
107 1 11 U HO2' 1 12 U H6 6.000 . 6.000 4.096 3.357 4.577 . 0 0 "[ . 1 . 2 . 3 ]" 2
108 1 11 U HO2' 1 12 U H5 6.000 . 6.000 5.032 4.360 5.453 . 0 0 "[ . 1 . 2 . 3 ]" 2
109 1 11 U HO2' 1 13 C H41 6.000 . 6.000 6.059 6.025 6.112 0.112 13 0 "[ . 1 . 2 . 3 ]" 2
110 1 11 U HO2' 1 13 C H42 6.000 . 6.000 5.188 4.818 5.611 . 0 0 "[ . 1 . 2 . 3 ]" 2
111 1 11 U HO2' 1 13 C H5 6.000 . 6.000 3.736 3.246 4.586 . 0 0 "[ . 1 . 2 . 3 ]" 2
112 1 11 U HO2' 1 13 C H6 6.000 . 6.000 3.674 3.044 4.548 . 0 0 "[ . 1 . 2 . 3 ]" 2
113 1 11 U H6 1 13 C H41 6.000 . 6.000 4.154 2.856 5.108 . 0 0 "[ . 1 . 2 . 3 ]" 2
114 1 11 U H6 1 13 C H42 6.000 . 6.000 4.445 3.612 5.137 . 0 0 "[ . 1 . 2 . 3 ]" 2
115 1 11 U H5 1 13 C H41 6.000 . 6.000 4.097 2.765 5.146 . 0 0 "[ . 1 . 2 . 3 ]" 2
116 1 11 U H5 1 13 C H42 6.000 . 6.000 5.212 4.069 5.997 . 0 0 "[ . 1 . 2 . 3 ]" 2
117 1 11 U H2' 1 13 C H41 6.000 . 6.000 3.868 3.554 4.103 . 0 0 "[ . 1 . 2 . 3 ]" 2
118 1 11 U H2' 1 13 C H42 6.000 . 6.000 3.074 2.467 3.462 . 0 0 "[ . 1 . 2 . 3 ]" 2
119 1 11 U H3' 1 13 C H41 6.000 . 6.000 3.763 2.994 5.023 . 0 0 "[ . 1 . 2 . 3 ]" 2
120 1 11 U H3' 1 13 C H42 6.000 . 6.000 2.851 2.093 3.669 . 0 0 "[ . 1 . 2 . 3 ]" 2
121 1 10 C H42 1 14 G H1 6.000 . 6.000 6.134 6.071 6.209 0.209 8 0 "[ . 1 . 2 . 3 ]" 2
122 1 11 U H1' 1 14 G H1 6.000 . 6.000 4.094 3.463 5.745 . 0 0 "[ . 1 . 2 . 3 ]" 2
123 1 11 U HO2' 1 14 G H1 6.000 . 6.000 4.406 3.856 6.026 0.026 22 0 "[ . 1 . 2 . 3 ]" 2
124 1 11 U H2' 1 14 G H1 6.000 . 6.000 4.763 3.997 5.822 . 0 0 "[ . 1 . 2 . 3 ]" 2
125 1 13 C H1' 1 14 G H1 6.000 . 6.000 3.094 2.522 3.918 . 0 0 "[ . 1 . 2 . 3 ]" 2
126 1 13 C H6 1 14 G H1 6.000 . 6.000 4.718 4.095 5.046 . 0 0 "[ . 1 . 2 . 3 ]" 2
127 1 13 C H5 1 14 G H1 6.000 . 6.000 5.976 5.247 6.111 0.111 23 0 "[ . 1 . 2 . 3 ]" 2
128 1 14 G H1 1 15 G H21 6.000 . 6.000 4.796 4.171 5.595 . 0 0 "[ . 1 . 2 . 3 ]" 2
129 1 14 G H1 1 15 G H8 6.000 . 6.000 4.718 4.099 5.099 . 0 0 "[ . 1 . 2 . 3 ]" 2
130 1 14 G H1 1 15 G H1' 6.000 . 6.000 4.455 3.602 4.924 . 0 0 "[ . 1 . 2 . 3 ]" 2
stop_
save_
save_distance_constraint_statistics_3
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 3
_Distance_constraint_stats_list.Constraint_count 48
_Distance_constraint_stats_list.Viol_count 566
_Distance_constraint_stats_list.Viol_total 738.129
_Distance_constraint_stats_list.Viol_max 0.153
_Distance_constraint_stats_list.Viol_rms 0.0276
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0160
_Distance_constraint_stats_list.Viol_average_violations_only 0.0421
_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 1.542 0.097 13 0 "[ . 1 . 2 . 3 ]"
1 2 G 1.536 0.081 25 0 "[ . 1 . 2 . 3 ]"
1 3 A 2.436 0.087 3 0 "[ . 1 . 2 . 3 ]"
1 4 A 3.879 0.138 4 0 "[ . 1 . 2 . 3 ]"
1 5 G 5.145 0.119 10 0 "[ . 1 . 2 . 3 ]"
1 6 C 2.134 0.153 23 0 "[ . 1 . 2 . 3 ]"
1 8 G 1.292 0.104 8 0 "[ . 1 . 2 . 3 ]"
1 9 G 1.485 0.088 29 0 "[ . 1 . 2 . 3 ]"
1 10 C 4.362 0.136 16 0 "[ . 1 . 2 . 3 ]"
1 15 G 4.362 0.136 16 0 "[ . 1 . 2 . 3 ]"
1 16 C 1.485 0.088 29 0 "[ . 1 . 2 . 3 ]"
1 17 C 1.292 0.104 8 0 "[ . 1 . 2 . 3 ]"
1 20 G 2.134 0.153 23 0 "[ . 1 . 2 . 3 ]"
1 21 U 5.145 0.119 10 0 "[ . 1 . 2 . 3 ]"
1 22 U 3.879 0.138 4 0 "[ . 1 . 2 . 3 ]"
1 23 U 2.436 0.087 3 0 "[ . 1 . 2 . 3 ]"
1 24 C 1.536 0.081 25 0 "[ . 1 . 2 . 3 ]"
1 25 C 1.542 0.097 13 0 "[ . 1 . 2 . 3 ]"
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 H21 1 25 C O2 2.000 . 2.200 1.857 1.803 2.064 0.097 13 0 "[ . 1 . 2 . 3 ]" 3
2 1 1 G H1 1 25 C N3 2.000 . 2.100 1.943 1.852 2.077 . 0 0 "[ . 1 . 2 . 3 ]" 3
3 1 1 G O6 1 25 C H41 2.000 . 2.100 1.877 1.800 2.102 0.002 11 0 "[ . 1 . 2 . 3 ]" 3
4 1 1 G N1 1 25 C N3 2.900 2.750 3.050 2.872 2.820 2.966 . 0 0 "[ . 1 . 2 . 3 ]" 3
5 1 1 G N2 1 25 C O2 2.950 2.750 3.050 2.818 2.724 2.981 0.026 12 0 "[ . 1 . 2 . 3 ]" 3
6 1 1 G O6 1 25 C N4 2.950 2.750 3.050 2.828 2.744 3.000 0.006 9 0 "[ . 1 . 2 . 3 ]" 3
7 1 2 G H21 1 24 C O2 2.000 . 2.200 1.872 1.819 2.132 0.081 25 0 "[ . 1 . 2 . 3 ]" 3
8 1 2 G H1 1 24 C N3 2.000 . 2.100 1.912 1.843 2.031 . 0 0 "[ . 1 . 2 . 3 ]" 3
9 1 2 G O6 1 24 C H41 2.000 . 2.100 1.831 1.780 1.958 0.020 4 0 "[ . 1 . 2 . 3 ]" 3
10 1 2 G N1 1 24 C N3 2.900 2.750 3.050 2.823 2.761 2.930 . 0 0 "[ . 1 . 2 . 3 ]" 3
11 1 2 G N2 1 24 C O2 2.950 2.750 3.050 2.777 2.709 3.034 0.041 5 0 "[ . 1 . 2 . 3 ]" 3
12 1 2 G O6 1 24 C N4 2.950 2.750 3.050 2.773 2.729 2.913 0.021 18 0 "[ . 1 . 2 . 3 ]" 3
13 1 3 A N1 1 23 U H3 2.000 . 2.200 1.888 1.818 2.140 0.082 7 0 "[ . 1 . 2 . 3 ]" 3
14 1 3 A H61 1 23 U O4 2.000 . 2.100 1.908 1.780 2.119 0.020 23 0 "[ . 1 . 2 . 3 ]" 3
15 1 3 A N1 1 23 U N3 2.900 2.750 3.050 2.764 2.705 2.956 0.045 24 0 "[ . 1 . 2 . 3 ]" 3
16 1 3 A N6 1 23 U O4 2.950 2.800 3.100 2.784 2.713 2.932 0.087 3 0 "[ . 1 . 2 . 3 ]" 3
17 1 4 A N1 1 22 U H3 2.000 . 2.200 1.825 1.762 2.000 0.138 4 0 "[ . 1 . 2 . 3 ]" 3
18 1 4 A H61 1 22 U O4 2.000 . 2.100 1.919 1.768 2.126 0.032 11 0 "[ . 1 . 2 . 3 ]" 3
19 1 4 A N1 1 22 U N3 2.900 2.750 3.050 2.745 2.684 2.824 0.066 3 0 "[ . 1 . 2 . 3 ]" 3
20 1 4 A N6 1 22 U O4 2.950 2.800 3.100 2.808 2.667 3.016 0.133 5 0 "[ . 1 . 2 . 3 ]" 3
21 1 5 G O6 1 21 U H3 2.000 . 2.100 2.143 2.088 2.193 0.093 10 0 "[ . 1 . 2 . 3 ]" 3
22 1 5 G H1 1 21 U O2 2.000 . 2.100 1.853 1.717 2.106 0.083 8 0 "[ . 1 . 2 . 3 ]" 3
23 1 5 G O6 1 21 U N3 2.900 2.750 3.050 3.117 3.039 3.169 0.119 10 0 "[ . 1 . 2 . 3 ]" 3
24 1 5 G N1 1 21 U O2 2.950 2.750 3.050 2.754 2.665 3.060 0.085 9 0 "[ . 1 . 2 . 3 ]" 3
25 1 6 C O2 1 20 G H21 2.000 . 2.200 1.849 1.747 1.920 0.153 23 0 "[ . 1 . 2 . 3 ]" 3
26 1 6 C N3 1 20 G H1 2.000 . 2.100 1.870 1.796 1.993 0.004 19 0 "[ . 1 . 2 . 3 ]" 3
27 1 6 C H41 1 20 G O6 2.000 . 2.100 1.826 1.741 2.073 0.059 5 0 "[ . 1 . 2 . 3 ]" 3
28 1 6 C N3 1 20 G N1 2.900 2.750 3.050 2.831 2.760 2.976 . 0 0 "[ . 1 . 2 . 3 ]" 3
29 1 6 C O2 1 20 G N2 2.950 2.750 3.050 2.783 2.720 2.885 0.030 24 0 "[ . 1 . 2 . 3 ]" 3
30 1 6 C N4 1 20 G O6 2.950 2.750 3.050 2.787 2.707 3.063 0.043 2 0 "[ . 1 . 2 . 3 ]" 3
31 1 8 G H21 1 17 C O2 2.000 . 2.200 1.945 1.813 2.143 0.087 11 0 "[ . 1 . 2 . 3 ]" 3
32 1 8 G H1 1 17 C N3 2.000 . 2.100 1.933 1.835 2.045 . 0 0 "[ . 1 . 2 . 3 ]" 3
33 1 8 G O6 1 17 C H41 2.000 . 2.100 1.870 1.773 2.097 0.027 13 0 "[ . 1 . 2 . 3 ]" 3
34 1 8 G N1 1 17 C N3 2.900 2.750 3.050 2.888 2.794 2.998 . 0 0 "[ . 1 . 2 . 3 ]" 3
35 1 8 G N2 1 17 C O2 2.950 2.750 3.050 2.903 2.737 3.092 0.042 23 0 "[ . 1 . 2 . 3 ]" 3
36 1 8 G O6 1 17 C N4 2.950 2.750 3.050 2.764 2.646 2.937 0.104 8 0 "[ . 1 . 2 . 3 ]" 3
37 1 9 G H21 1 16 C O2 2.000 . 2.200 1.884 1.812 2.071 0.088 29 0 "[ . 1 . 2 . 3 ]" 3
38 1 9 G H1 1 16 C N3 2.000 . 2.100 1.929 1.845 2.027 . 0 0 "[ . 1 . 2 . 3 ]" 3
39 1 9 G O6 1 16 C H41 2.000 . 2.100 2.003 1.790 2.135 0.035 17 0 "[ . 1 . 2 . 3 ]" 3
40 1 9 G N1 1 16 C N3 2.900 2.750 3.050 2.863 2.790 2.976 . 0 0 "[ . 1 . 2 . 3 ]" 3
41 1 9 G N2 1 16 C O2 2.950 2.750 3.050 2.841 2.750 3.029 . 0 0 "[ . 1 . 2 . 3 ]" 3
42 1 9 G O6 1 16 C N4 2.950 2.750 3.050 2.789 2.701 2.917 0.049 6 0 "[ . 1 . 2 . 3 ]" 3
43 1 10 C O2 1 15 G H21 2.000 . 2.200 1.866 1.814 2.147 0.086 12 0 "[ . 1 . 2 . 3 ]" 3
44 1 10 C N3 1 15 G H1 2.000 . 2.100 1.855 1.805 2.028 . 0 0 "[ . 1 . 2 . 3 ]" 3
45 1 10 C H41 1 15 G O6 2.000 . 2.100 1.901 1.743 2.047 0.057 21 0 "[ . 1 . 2 . 3 ]" 3
46 1 10 C N3 1 15 G N1 2.900 2.750 3.050 2.789 2.743 2.915 0.007 9 0 "[ . 1 . 2 . 3 ]" 3
47 1 10 C O2 1 15 G N2 2.950 2.750 3.050 2.814 2.747 3.047 0.003 5 0 "[ . 1 . 2 . 3 ]" 3
48 1 10 C N4 1 15 G O6 2.950 2.750 3.050 2.661 2.614 2.708 0.136 16 0 "[ . 1 . 2 . 3 ]" 3
stop_
save_
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