NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
571975 |
2mis   |
19692 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2mis
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 642
_Distance_constraint_stats_list.Viol_count 733
_Distance_constraint_stats_list.Viol_total 878.385
_Distance_constraint_stats_list.Viol_max 0.431
_Distance_constraint_stats_list.Viol_rms 0.0251
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0031
_Distance_constraint_stats_list.Viol_average_violations_only 0.0571
_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 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 2 A 1.264 0.046 19 0 "[ . 1 . 2 ]"
1 3 G 0.635 0.035 19 0 "[ . 1 . 2 ]"
1 4 C 0.130 0.026 17 0 "[ . 1 . 2 ]"
1 5 U 0.595 0.050 20 0 "[ . 1 . 2 ]"
1 6 G 1.443 0.050 20 0 "[ . 1 . 2 ]"
1 7 C 0.814 0.033 8 0 "[ . 1 . 2 ]"
1 8 A 3.334 0.257 21 0 "[ . 1 . 2 ]"
1 9 G 1.132 0.074 1 0 "[ . 1 . 2 ]"
1 10 C 1.119 0.074 1 0 "[ . 1 . 2 ]"
1 11 A 1.480 0.073 1 0 "[ . 1 . 2 ]"
1 12 C 1.936 0.067 13 0 "[ . 1 . 2 ]"
1 13 G 2.316 0.067 13 0 "[ . 1 . 2 ]"
1 14 A 1.740 0.060 21 0 "[ . 1 . 2 ]"
1 15 A 6.136 0.310 21 0 "[ . 1 . 2 ]"
1 16 A 5.350 0.310 21 0 "[ . 1 . 2 ]"
1 17 G 8.894 0.352 1 0 "[ . 1 . 2 ]"
1 18 U 1.960 0.078 21 0 "[ . 1 . 2 ]"
1 19 G 0.665 0.065 1 0 "[ . 1 . 2 ]"
1 20 A 1.669 0.067 18 0 "[ . 1 . 2 ]"
1 21 C 11.968 0.431 5 0 "[ . 1 . 2 ]"
1 22 G 1.555 0.062 20 0 "[ . 1 . 2 ]"
1 23 G 0.005 0.005 13 0 "[ . 1 . 2 ]"
1 24 C 10.111 0.431 5 0 "[ . 1 . 2 ]"
1 25 U 12.118 0.431 5 0 "[ . 1 . 2 ]"
1 26 C 3.322 0.111 19 0 "[ . 1 . 2 ]"
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 24 C H1' 1 24 C Q5' 5.500 . 5.500 4.322 4.208 4.387 . 0 0 "[ . 1 . 2 ]" 1
2 1 4 C H1' 1 4 C Q5' 7.500 2.800 7.500 4.041 3.964 4.100 . 0 0 "[ . 1 . 2 ]" 1
3 1 4 C H1' 1 4 C Q5' 5.500 . 5.500 4.316 4.281 4.346 . 0 0 "[ . 1 . 2 ]" 1
4 1 5 U H6 1 6 G H4' 7.500 2.800 7.500 4.807 4.457 5.152 . 0 0 "[ . 1 . 2 ]" 1
5 1 5 U H6 1 6 G H2' 7.500 2.800 7.500 3.291 3.088 3.737 . 0 0 "[ . 1 . 2 ]" 1
6 1 7 C H2' 1 7 C H5 7.500 2.800 7.500 5.023 5.008 5.057 . 0 0 "[ . 1 . 2 ]" 1
7 1 5 U H6 1 6 G H5' 7.500 2.800 7.500 6.135 5.544 6.336 . 0 0 "[ . 1 . 2 ]" 1
8 1 5 U H6 1 6 G H5'' 7.500 2.800 7.500 5.857 5.287 6.127 . 0 0 "[ . 1 . 2 ]" 1
9 1 7 C H2' 1 8 A H4' 5.500 . 5.500 5.480 5.371 5.518 0.018 19 0 "[ . 1 . 2 ]" 1
10 1 21 C H5' 1 22 G H8 7.500 2.800 7.500 5.819 5.762 5.901 . 0 0 "[ . 1 . 2 ]" 1
11 1 21 C H5'' 1 22 G H8 7.500 2.800 7.500 6.207 6.166 6.272 . 0 0 "[ . 1 . 2 ]" 1
12 1 1 G H1' 1 1 G H3' 4.200 . 4.200 3.881 3.876 3.886 . 0 0 "[ . 1 . 2 ]" 1
13 1 1 G H2' 1 1 G H4' 4.200 . 4.200 3.850 3.844 3.863 . 0 0 "[ . 1 . 2 ]" 1
14 1 1 G H4' 1 2 A H8 7.500 2.800 7.500 5.685 5.627 5.791 . 0 0 "[ . 1 . 2 ]" 1
15 1 1 G H3' 1 1 G H5' 4.200 . 4.200 3.680 3.612 3.705 . 0 0 "[ . 1 . 2 ]" 1
16 1 1 G H4' 1 1 G H5' 3.300 . 3.300 2.478 2.427 2.586 . 0 0 "[ . 1 . 2 ]" 1
17 1 1 G H3' 1 1 G H5'' 4.200 . 4.200 2.885 2.781 3.097 . 0 0 "[ . 1 . 2 ]" 1
18 1 1 G H4' 1 1 G H5'' 3.300 . 3.300 2.461 2.366 2.511 . 0 0 "[ . 1 . 2 ]" 1
19 1 1 G H2' 1 1 G H8 5.500 . 5.500 3.666 3.463 3.750 . 0 0 "[ . 1 . 2 ]" 1
20 1 1 G H4' 1 1 G H8 5.500 . 5.500 4.164 4.117 4.192 . 0 0 "[ . 1 . 2 ]" 1
21 1 2 A H1' 1 3 G H8 5.500 . 5.500 4.955 4.887 5.013 . 0 0 "[ . 1 . 2 ]" 1
22 1 2 A H1' 1 2 A H3' 4.200 . 4.200 3.864 3.854 3.875 . 0 0 "[ . 1 . 2 ]" 1
23 1 1 G H2' 1 2 A H1' 5.500 . 5.500 5.058 4.858 5.179 . 0 0 "[ . 1 . 2 ]" 1
24 1 1 G H1' 1 2 A H1' 7.500 2.800 7.500 7.165 6.805 7.396 . 0 0 "[ . 1 . 2 ]" 1
25 1 2 A H1' 1 26 C H1' 7.500 2.800 7.500 6.717 6.603 6.862 . 0 0 "[ . 1 . 2 ]" 1
26 1 2 A H2 1 3 G H1' 4.200 . 4.200 4.228 4.212 4.235 0.035 19 0 "[ . 1 . 2 ]" 1
27 1 2 A H2 1 26 C H1' 5.500 . 5.500 4.209 4.095 4.318 . 0 0 "[ . 1 . 2 ]" 1
28 1 2 A H1' 1 2 A H2 7.500 2.800 7.500 4.770 4.738 4.794 . 0 0 "[ . 1 . 2 ]" 1
29 1 2 A H2 1 3 G H8 7.500 2.800 7.500 5.513 5.409 5.782 . 0 0 "[ . 1 . 2 ]" 1
30 1 2 A H2 1 25 U H2' 7.500 2.800 7.500 5.132 4.996 5.201 . 0 0 "[ . 1 . 2 ]" 1
31 1 2 A H2 1 26 C H6 5.500 . 5.500 5.532 5.515 5.546 0.046 19 0 "[ . 1 . 2 ]" 1
32 1 1 G H1' 1 2 A H8 5.500 . 5.500 5.127 5.083 5.314 . 0 0 "[ . 1 . 2 ]" 1
33 1 1 G H8 1 2 A H8 5.500 . 5.500 5.084 4.673 5.277 . 0 0 "[ . 1 . 2 ]" 1
34 1 1 G H2' 1 2 A H8 3.300 . 3.300 2.383 2.348 2.568 . 0 0 "[ . 1 . 2 ]" 1
35 1 2 A H2' 1 2 A H8 4.200 . 4.200 3.680 3.607 3.751 . 0 0 "[ . 1 . 2 ]" 1
36 1 1 G H3' 1 2 A H8 4.200 . 4.200 3.305 3.239 3.383 . 0 0 "[ . 1 . 2 ]" 1
37 1 2 A H4' 1 2 A H8 5.500 . 5.500 4.178 4.139 4.201 . 0 0 "[ . 1 . 2 ]" 1
38 1 2 A H1' 1 3 G H1' 7.500 2.800 7.500 5.472 5.142 5.631 . 0 0 "[ . 1 . 2 ]" 1
39 1 2 A H2' 1 3 G H1' 5.500 . 5.500 4.048 3.974 4.233 . 0 0 "[ . 1 . 2 ]" 1
40 1 3 G H1' 1 3 G H3' 4.200 . 4.200 3.902 3.892 3.912 . 0 0 "[ . 1 . 2 ]" 1
41 1 2 A H3' 1 3 G H1' 7.500 2.800 7.500 6.286 6.160 6.519 . 0 0 "[ . 1 . 2 ]" 1
42 1 3 G H1' 1 4 C H1' 7.500 2.800 7.500 5.835 5.607 5.978 . 0 0 "[ . 1 . 2 ]" 1
43 1 2 A H8 1 3 G H8 7.500 2.800 7.500 4.766 4.515 5.191 . 0 0 "[ . 1 . 2 ]" 1
44 1 2 A H3' 1 3 G H8 4.200 . 4.200 3.441 3.230 3.705 . 0 0 "[ . 1 . 2 ]" 1
45 1 2 A H2' 1 3 G H8 4.200 . 4.200 2.348 2.341 2.350 . 0 0 "[ . 1 . 2 ]" 1
46 1 3 G H2' 1 3 G H8 5.500 . 5.500 3.481 3.388 3.558 . 0 0 "[ . 1 . 2 ]" 1
47 1 3 G H4' 1 3 G H8 5.500 . 5.500 4.404 4.309 4.461 . 0 0 "[ . 1 . 2 ]" 1
48 1 4 C H1' 1 5 U H5 7.500 2.800 7.500 6.201 6.074 6.339 . 0 0 "[ . 1 . 2 ]" 1
49 1 4 C H1' 1 4 C H3' 4.200 . 4.200 3.913 3.905 3.924 . 0 0 "[ . 1 . 2 ]" 1
50 1 3 G H8 1 4 C H5 7.500 2.800 7.500 4.150 3.655 4.688 . 0 0 "[ . 1 . 2 ]" 1
51 1 4 C H1' 1 4 C H5 5.500 . 5.500 5.410 5.399 5.422 . 0 0 "[ . 1 . 2 ]" 1
52 1 3 G H1' 1 4 C H5 7.500 2.800 7.500 5.878 5.734 5.987 . 0 0 "[ . 1 . 2 ]" 1
53 1 4 C H3' 1 4 C H5 5.500 . 5.500 4.891 4.760 5.048 . 0 0 "[ . 1 . 2 ]" 1
54 1 3 G H2' 1 4 C H5 4.200 . 4.200 3.498 3.175 3.835 . 0 0 "[ . 1 . 2 ]" 1
55 1 3 G H3' 1 4 C H5 4.200 . 4.200 4.047 3.793 4.202 0.002 7 0 "[ . 1 . 2 ]" 1
56 1 3 G H8 1 4 C H6 7.500 2.800 7.500 4.958 4.432 5.365 . 0 0 "[ . 1 . 2 ]" 1
57 1 3 G H1' 1 4 C H6 5.500 . 5.500 5.133 5.076 5.169 . 0 0 "[ . 1 . 2 ]" 1
58 1 3 G H3' 1 4 C H6 5.500 . 5.500 3.527 3.273 3.728 . 0 0 "[ . 1 . 2 ]" 1
59 1 4 C H2' 1 4 C H6 4.200 . 4.200 3.343 3.244 3.397 . 0 0 "[ . 1 . 2 ]" 1
60 1 4 C H4' 1 4 C H6 5.500 . 5.500 4.198 4.144 4.248 . 0 0 "[ . 1 . 2 ]" 1
61 1 3 G H2' 1 4 C H6 4.200 . 4.200 2.350 2.338 2.360 . 0 0 "[ . 1 . 2 ]" 1
62 1 4 C H6 1 5 U H1' 7.500 2.800 7.500 7.147 6.763 7.332 . 0 0 "[ . 1 . 2 ]" 1
63 1 5 U H1' 1 5 U H5 5.500 . 5.500 5.393 5.379 5.404 . 0 0 "[ . 1 . 2 ]" 1
64 1 5 U H1' 1 6 G H8 7.500 2.800 7.500 6.405 6.117 6.592 . 0 0 "[ . 1 . 2 ]" 1
65 1 5 U H1' 1 5 U H4' 4.200 . 4.200 3.319 3.131 3.378 . 0 0 "[ . 1 . 2 ]" 1
66 1 4 C H2' 1 5 U H1' 7.500 2.800 7.500 4.155 3.943 4.281 . 0 0 "[ . 1 . 2 ]" 1
67 1 5 U H1' 1 5 U H3' 4.200 . 4.200 3.885 3.876 3.928 . 0 0 "[ . 1 . 2 ]" 1
68 1 4 C H1' 1 5 U H1' 7.500 2.800 7.500 5.226 5.054 5.354 . 0 0 "[ . 1 . 2 ]" 1
69 1 4 C H2' 1 5 U H2' 7.500 2.800 7.500 5.438 5.179 5.524 . 0 0 "[ . 1 . 2 ]" 1
70 1 5 U H1' 1 5 U H2' 3.300 . 3.300 2.780 2.766 2.844 . 0 0 "[ . 1 . 2 ]" 1
71 1 5 U H2' 1 6 G H3' 5.500 . 5.500 4.920 4.865 5.236 . 0 0 "[ . 1 . 2 ]" 1
72 1 5 U H2' 1 5 U H3' 3.300 . 3.300 2.362 2.347 2.365 . 0 0 "[ . 1 . 2 ]" 1
73 1 5 U H2' 1 5 U H4' 4.200 . 4.200 3.838 3.822 3.851 . 0 0 "[ . 1 . 2 ]" 1
74 1 5 U H2' 1 6 G H2' 5.500 . 5.500 5.440 5.369 5.537 0.037 17 0 "[ . 1 . 2 ]" 1
75 1 5 U H3' 1 5 U H5 7.500 2.800 7.500 4.511 4.453 4.838 . 0 0 "[ . 1 . 2 ]" 1
76 1 5 U H2' 1 5 U H5 7.500 2.800 7.500 5.061 4.933 5.106 . 0 0 "[ . 1 . 2 ]" 1
77 1 4 C H5 1 5 U H5 5.500 . 5.500 5.307 4.790 5.502 0.002 10 0 "[ . 1 . 2 ]" 1
78 1 4 C H3' 1 5 U H5 5.500 . 5.500 3.990 3.861 4.222 . 0 0 "[ . 1 . 2 ]" 1
79 1 4 C H6 1 5 U H5 7.500 2.800 7.500 4.934 4.588 5.100 . 0 0 "[ . 1 . 2 ]" 1
80 1 4 C H6 1 5 U H6 7.500 2.800 7.500 5.299 4.963 5.410 . 0 0 "[ . 1 . 2 ]" 1
81 1 5 U H1' 1 5 U H6 4.200 . 4.200 3.624 3.617 3.640 . 0 0 "[ . 1 . 2 ]" 1
82 1 4 C H1' 1 5 U H6 7.500 2.800 7.500 5.034 4.966 5.170 . 0 0 "[ . 1 . 2 ]" 1
83 1 4 C H2' 1 5 U H6 3.300 . 3.300 2.348 2.343 2.350 . 0 0 "[ . 1 . 2 ]" 1
84 1 5 U H3' 1 5 U H6 3.300 . 3.300 2.682 2.641 2.863 . 0 0 "[ . 1 . 2 ]" 1
85 1 4 C H5' 1 5 U H6 7.500 2.800 7.500 7.170 7.120 7.254 . 0 0 "[ . 1 . 2 ]" 1
86 1 5 U H5' 1 5 U H6 5.500 . 5.500 3.721 3.615 4.031 . 0 0 "[ . 1 . 2 ]" 1
87 1 5 U H4' 1 5 U H6 5.500 . 5.500 3.990 3.941 4.140 . 0 0 "[ . 1 . 2 ]" 1
88 1 4 C H3' 1 5 U H6 4.200 . 4.200 3.672 3.529 3.805 . 0 0 "[ . 1 . 2 ]" 1
89 1 5 U H2' 1 5 U H6 4.200 . 4.200 3.615 3.438 3.656 . 0 0 "[ . 1 . 2 ]" 1
90 1 4 C H5'' 1 5 U H6 7.500 2.800 7.500 6.219 6.144 6.343 . 0 0 "[ . 1 . 2 ]" 1
91 1 5 U H5'' 1 5 U H6 5.500 . 5.500 3.719 3.609 4.031 . 0 0 "[ . 1 . 2 ]" 1
92 1 5 U H6 1 6 G Q5' 7.500 2.800 7.500 6.375 5.464 6.499 . 0 0 "[ . 1 . 2 ]" 1
93 1 4 C H5 1 5 U H6 7.500 2.800 7.500 6.407 5.935 6.525 . 0 0 "[ . 1 . 2 ]" 1
94 1 6 G H1' 1 6 G H3' 5.500 . 5.500 3.933 3.919 3.951 . 0 0 "[ . 1 . 2 ]" 1
95 1 6 G H1' 1 7 C H3' 7.500 2.800 7.500 7.521 7.512 7.533 0.033 8 0 "[ . 1 . 2 ]" 1
96 1 6 G H1' 1 6 G H4' 4.200 . 4.200 3.016 2.829 3.107 . 0 0 "[ . 1 . 2 ]" 1
97 1 5 U H2' 1 6 G H1' 4.200 . 4.200 4.219 4.128 4.250 0.050 20 0 "[ . 1 . 2 ]" 1
98 1 6 G H1' 1 6 G H2' 4.200 . 4.200 2.862 2.834 2.919 . 0 0 "[ . 1 . 2 ]" 1
99 1 6 G H1' 1 7 C H6 7.500 2.800 7.500 4.642 4.578 4.803 . 0 0 "[ . 1 . 2 ]" 1
100 1 6 G H2' 1 6 G H3' 4.200 . 4.200 2.345 2.335 2.348 . 0 0 "[ . 1 . 2 ]" 1
101 1 6 G H2' 1 9 G H8 5.500 . 5.500 4.088 3.748 4.404 . 0 0 "[ . 1 . 2 ]" 1
102 1 6 G H2' 1 9 G Q5' 7.500 2.800 7.500 5.126 4.754 5.527 . 0 0 "[ . 1 . 2 ]" 1
103 1 6 G H2' 1 6 G H4' 4.200 . 4.200 3.842 3.831 3.855 . 0 0 "[ . 1 . 2 ]" 1
104 1 6 G H3' 1 6 G H4' 4.200 . 4.200 3.049 3.043 3.050 . 0 0 "[ . 1 . 2 ]" 1
105 1 6 G H4' 1 6 G H8 7.500 2.800 7.500 4.539 4.455 4.638 . 0 0 "[ . 1 . 2 ]" 1
106 1 6 G H3' 1 6 G Q5' . . 4.200 2.577 2.322 2.607 . 0 0 "[ . 1 . 2 ]" 1
107 1 6 G H4' 1 6 G H5' 3.300 . 3.300 2.369 2.354 2.491 . 0 0 "[ . 1 . 2 ]" 1
108 1 6 G Q5' 1 9 G H8 7.500 2.800 7.500 6.670 6.354 6.707 . 0 0 "[ . 1 . 2 ]" 1
109 1 6 G H4' 1 6 G H5'' 3.300 . 3.300 2.617 2.587 3.048 . 0 0 "[ . 1 . 2 ]" 1
110 1 5 U H6 1 6 G H8 7.500 2.800 7.500 5.482 4.882 5.762 . 0 0 "[ . 1 . 2 ]" 1
111 1 6 G H2' 1 6 G H8 4.200 . 4.200 2.678 2.580 2.875 . 0 0 "[ . 1 . 2 ]" 1
112 1 5 U H2' 1 6 G H8 4.200 . 4.200 3.757 3.449 3.986 . 0 0 "[ . 1 . 2 ]" 1
113 1 5 U H3' 1 6 G H8 5.500 . 5.500 4.115 3.800 4.496 . 0 0 "[ . 1 . 2 ]" 1
114 1 6 G H3' 1 6 G H8 5.500 . 5.500 2.640 2.455 3.099 . 0 0 "[ . 1 . 2 ]" 1
115 1 5 U H4' 1 6 G H8 7.500 2.800 7.500 6.917 6.591 7.312 . 0 0 "[ . 1 . 2 ]" 1
116 1 6 G H8 1 7 C H6 7.500 2.800 7.500 5.915 5.771 6.344 . 0 0 "[ . 1 . 2 ]" 1
117 1 7 C H1' 1 7 C H3' 4.200 . 4.200 3.892 3.881 3.903 . 0 0 "[ . 1 . 2 ]" 1
118 1 7 C H1' 1 7 C H2' 3.300 . 3.300 2.802 2.782 2.820 . 0 0 "[ . 1 . 2 ]" 1
119 1 7 C H1' 1 7 C H4' 4.200 . 4.200 3.207 3.152 3.283 . 0 0 "[ . 1 . 2 ]" 1
120 1 7 C H1' 1 7 C H5 5.500 . 5.500 5.304 5.286 5.314 . 0 0 "[ . 1 . 2 ]" 1
121 1 7 C H1' 1 8 A H8 5.500 . 5.500 4.996 4.814 5.281 . 0 0 "[ . 1 . 2 ]" 1
122 1 7 C H2' 1 8 A H2' 4.200 . 4.200 2.382 2.348 2.558 . 0 0 "[ . 1 . 2 ]" 1
123 1 7 C H3' 1 8 A H1' 7.500 2.800 7.500 5.209 5.158 5.305 . 0 0 "[ . 1 . 2 ]" 1
124 1 7 C H3' 1 8 A H3' 4.200 . 4.200 2.449 2.348 2.810 . 0 0 "[ . 1 . 2 ]" 1
125 1 7 C H3' 1 8 A H2' 5.500 . 5.500 2.352 2.347 2.422 . 0 0 "[ . 1 . 2 ]" 1
126 1 7 C H4' 1 7 C H6 5.500 . 5.500 4.161 4.110 4.196 . 0 0 "[ . 1 . 2 ]" 1
127 1 6 G H1' 1 7 C H4' 7.500 2.800 7.500 7.367 7.032 7.508 0.008 13 0 "[ . 1 . 2 ]" 1
128 1 7 C H3' 1 7 C H4' 3.300 . 3.300 3.050 3.047 3.052 . 0 0 "[ . 1 . 2 ]" 1
129 1 7 C H4' 1 8 A H3' 7.500 2.800 7.500 5.357 5.220 5.720 . 0 0 "[ . 1 . 2 ]" 1
130 1 6 G H2' 1 7 C H5 7.500 2.800 7.500 2.832 2.784 3.155 0.016 7 0 "[ . 1 . 2 ]" 1
131 1 6 G H3' 1 7 C H5 5.500 . 5.500 4.774 4.448 5.045 . 0 0 "[ . 1 . 2 ]" 1
132 1 7 C H5 1 8 A H2' 7.500 2.800 7.500 4.185 3.825 4.490 . 0 0 "[ . 1 . 2 ]" 1
133 1 7 C H5 1 9 G H1' 5.500 . 5.500 2.934 2.559 3.312 . 0 0 "[ . 1 . 2 ]" 1
134 1 6 G H1' 1 7 C H5' 7.500 2.800 7.500 4.839 4.649 4.973 . 0 0 "[ . 1 . 2 ]" 1
135 1 7 C H2' 1 7 C Q5' 5.500 . 5.500 4.582 4.573 4.588 . 0 0 "[ . 1 . 2 ]" 1
136 1 7 C H4' 1 7 C H5' 4.200 . 4.200 2.642 2.615 2.674 . 0 0 "[ . 1 . 2 ]" 1
137 1 7 C H4' 1 7 C H5'' 4.200 . 4.200 2.346 2.343 2.350 . 0 0 "[ . 1 . 2 ]" 1
138 1 6 G H1' 1 7 C H5'' 7.500 2.800 7.500 6.113 5.971 6.202 . 0 0 "[ . 1 . 2 ]" 1
139 1 7 C H1' 1 7 C H6 4.200 . 4.200 3.535 3.513 3.546 . 0 0 "[ . 1 . 2 ]" 1
140 1 7 C H6 1 8 A H8 7.500 2.800 7.500 5.636 5.398 5.980 . 0 0 "[ . 1 . 2 ]" 1
141 1 6 G H3' 1 7 C H6 5.500 . 5.500 4.413 4.310 4.608 . 0 0 "[ . 1 . 2 ]" 1
142 1 7 C H3' 1 7 C H6 3.300 . 3.300 3.192 3.097 3.268 . 0 0 "[ . 1 . 2 ]" 1
143 1 7 C H2' 1 7 C H6 4.200 . 4.200 3.826 3.795 3.883 . 0 0 "[ . 1 . 2 ]" 1
144 1 7 C H5' 1 7 C H6 7.500 2.800 7.500 3.285 3.157 3.381 . 0 0 "[ . 1 . 2 ]" 1
145 1 7 C H5'' 1 7 C H6 7.500 2.800 7.500 4.434 4.308 4.521 . 0 0 "[ . 1 . 2 ]" 1
146 1 6 G H2' 1 7 C H6 5.500 . 5.500 3.294 3.089 3.748 . 0 0 "[ . 1 . 2 ]" 1
147 1 7 C H6 1 8 A H1' 7.500 2.800 7.500 6.053 5.785 6.399 . 0 0 "[ . 1 . 2 ]" 1
148 1 7 C H5 1 8 A H1' 7.500 2.800 7.500 5.492 5.132 5.938 . 0 0 "[ . 1 . 2 ]" 1
149 1 8 A H1' 1 8 A H3' 7.500 2.800 7.500 3.840 3.819 3.858 . 0 0 "[ . 1 . 2 ]" 1
150 1 7 C H2' 1 8 A H1' 5.500 . 5.500 5.088 4.963 5.226 . 0 0 "[ . 1 . 2 ]" 1
151 1 8 A H1' 1 8 A H2 7.500 2.800 7.500 4.646 4.613 4.700 . 0 0 "[ . 1 . 2 ]" 1
152 1 8 A H2' 1 8 A H4' 4.200 . 4.200 3.863 3.850 3.883 . 0 0 "[ . 1 . 2 ]" 1
153 1 8 A H1' 1 8 A H2' 4.200 . 4.200 3.028 3.025 3.033 . 0 0 "[ . 1 . 2 ]" 1
154 1 7 C H6 1 8 A H2' 4.200 . 4.200 3.584 3.301 3.867 . 0 0 "[ . 1 . 2 ]" 1
155 1 8 A H2' 1 9 G H1' 7.500 2.800 7.500 4.160 4.000 4.484 . 0 0 "[ . 1 . 2 ]" 1
156 1 8 A H2' 1 8 A H3' 4.200 . 4.200 2.394 2.378 2.403 . 0 0 "[ . 1 . 2 ]" 1
157 1 8 A H1' 1 8 A H4' 4.200 . 4.200 3.237 3.144 3.294 . 0 0 "[ . 1 . 2 ]" 1
158 1 8 A H3' 1 8 A H4' 4.200 . 4.200 2.825 2.805 2.859 . 0 0 "[ . 1 . 2 ]" 1
159 1 8 A H3' 1 8 A Q5' 5.500 2.800 5.500 2.646 2.543 2.736 0.257 21 0 "[ . 1 . 2 ]" 1
160 1 8 A H4' 1 8 A H5' 3.300 . 3.300 2.553 2.498 2.613 . 0 0 "[ . 1 . 2 ]" 1
161 1 8 A H4' 1 8 A Q5' 3.300 . 3.300 2.193 2.188 2.198 . 0 0 "[ . 1 . 2 ]" 1
162 1 7 C H2' 1 8 A H8 4.200 . 4.200 2.478 2.349 2.721 . 0 0 "[ . 1 . 2 ]" 1
163 1 8 A H3' 1 8 A H8 5.500 . 5.500 4.496 4.374 4.597 . 0 0 "[ . 1 . 2 ]" 1
164 1 8 A H2' 1 8 A H8 5.500 . 5.500 2.698 2.478 2.931 . 0 0 "[ . 1 . 2 ]" 1
165 1 8 A H4' 1 8 A H8 7.500 2.800 7.500 4.575 4.517 4.663 . 0 0 "[ . 1 . 2 ]" 1
166 1 7 C H3' 1 8 A H8 5.500 . 5.500 4.115 3.971 4.344 . 0 0 "[ . 1 . 2 ]" 1
167 1 9 G H1' 1 10 C H6 7.500 2.800 7.500 4.752 4.347 4.985 . 0 0 "[ . 1 . 2 ]" 1
168 1 9 G H1' 1 9 G H2' 3.300 . 3.300 2.862 2.818 2.929 . 0 0 "[ . 1 . 2 ]" 1
169 1 9 G H1' 1 10 C H2' 7.500 2.800 7.500 7.445 7.314 7.506 0.006 8 0 "[ . 1 . 2 ]" 1
170 1 8 A H1' 1 9 G H1' 5.500 . 5.500 3.595 3.395 3.901 . 0 0 "[ . 1 . 2 ]" 1
171 1 8 A H2 1 9 G H1' 7.500 2.800 7.500 4.227 3.737 4.690 . 0 0 "[ . 1 . 2 ]" 1
172 1 6 G H8 1 9 G H1' 7.500 2.800 7.500 6.367 6.166 6.592 . 0 0 "[ . 1 . 2 ]" 1
173 1 6 G H1' 1 9 G H1' 7.500 2.800 7.500 7.342 7.082 7.516 0.016 4 0 "[ . 1 . 2 ]" 1
174 1 9 G H1' 1 10 C H1' 7.500 2.800 7.500 5.257 5.149 5.409 . 0 0 "[ . 1 . 2 ]" 1
175 1 9 G H1' 1 10 C H4' 5.500 . 5.500 5.529 5.505 5.574 0.074 1 0 "[ . 1 . 2 ]" 1
176 1 9 G H1' 1 9 G H3' 5.500 . 5.500 3.927 3.902 3.953 . 0 0 "[ . 1 . 2 ]" 1
177 1 8 A H3' 1 9 G H3' 7.500 2.800 7.500 6.476 5.962 6.717 . 0 0 "[ . 1 . 2 ]" 1
178 1 9 G H3' 1 10 C H1' 7.500 2.800 7.500 6.431 6.060 6.942 . 0 0 "[ . 1 . 2 ]" 1
179 1 8 A H3' 1 9 G H4' 7.500 2.800 7.500 3.617 3.152 3.883 . 0 0 "[ . 1 . 2 ]" 1
180 1 9 G H1' 1 9 G H4' 4.200 . 4.200 3.004 2.782 3.131 . 0 0 "[ . 1 . 2 ]" 1
181 1 9 G H4' 1 10 C H5 7.500 2.800 7.500 6.434 6.232 6.568 . 0 0 "[ . 1 . 2 ]" 1
182 1 9 G H4' 1 10 C Q5' 5.500 . 5.500 3.785 3.748 3.817 . 0 0 "[ . 1 . 2 ]" 1
183 1 8 A H3' 1 9 G Q5' . 2.800 5.500 4.405 3.042 4.734 . 0 0 "[ . 1 . 2 ]" 1
184 1 9 G H2' 1 9 G H5' 5.500 . 5.500 4.665 4.287 4.797 . 0 0 "[ . 1 . 2 ]" 1
185 1 9 G H5' 1 9 G H8 7.500 2.800 7.500 4.261 3.547 4.666 . 0 0 "[ . 1 . 2 ]" 1
186 1 7 C H6 1 9 G H5' 7.500 2.800 7.500 7.392 6.689 7.513 0.013 17 0 "[ . 1 . 2 ]" 1
187 1 9 G H2' 1 9 G H5'' 5.500 . 5.500 4.610 4.419 5.171 . 0 0 "[ . 1 . 2 ]" 1
188 1 7 C H6 1 9 G H5'' 7.500 2.800 7.500 6.400 5.410 6.782 . 0 0 "[ . 1 . 2 ]" 1
189 1 9 G H5'' 1 9 G H8 7.500 2.800 7.500 3.230 2.821 4.360 . 0 0 "[ . 1 . 2 ]" 1
190 1 9 G H3' 1 9 G H8 5.500 . 5.500 3.071 2.801 3.460 . 0 0 "[ . 1 . 2 ]" 1
191 1 9 G H4' 1 9 G H8 7.500 2.800 7.500 4.444 4.352 4.572 . 0 0 "[ . 1 . 2 ]" 1
192 1 9 G H2' 1 9 G H8 5.500 . 5.500 3.307 3.044 3.491 . 0 0 "[ . 1 . 2 ]" 1
193 1 6 G H1' 1 9 G H8 7.500 2.800 7.500 6.617 6.429 6.878 . 0 0 "[ . 1 . 2 ]" 1
194 1 10 C H1' 1 11 A H8 5.500 . 5.500 5.521 5.507 5.573 0.073 1 0 "[ . 1 . 2 ]" 1
195 1 10 C H1' 1 10 C H3' 4.200 . 4.200 3.872 3.858 3.901 . 0 0 "[ . 1 . 2 ]" 1
196 1 10 C H1' 1 11 A H4' 7.500 2.800 7.500 7.208 6.859 7.340 . 0 0 "[ . 1 . 2 ]" 1
197 1 9 G H2' 1 10 C H1' 7.500 2.800 7.500 4.306 3.879 4.913 . 0 0 "[ . 1 . 2 ]" 1
198 1 10 C H1' 1 10 C H5 5.500 . 5.500 5.302 5.287 5.325 . 0 0 "[ . 1 . 2 ]" 1
199 1 10 C H3' 1 10 C H5 5.500 . 5.500 4.711 4.626 4.776 . 0 0 "[ . 1 . 2 ]" 1
200 1 9 G H3' 1 10 C H5 7.500 2.800 7.500 3.776 3.645 3.919 . 0 0 "[ . 1 . 2 ]" 1
201 1 10 C H2' 1 10 C H5 5.500 . 5.500 5.336 5.250 5.374 . 0 0 "[ . 1 . 2 ]" 1
202 1 9 G H2' 1 10 C H5 7.500 2.800 7.500 3.242 2.778 3.585 0.022 6 0 "[ . 1 . 2 ]" 1
203 1 9 G H8 1 10 C H6 7.500 2.800 7.500 5.419 5.273 5.518 . 0 0 "[ . 1 . 2 ]" 1
204 1 9 G H2' 1 10 C H6 5.500 . 5.500 2.347 2.340 2.352 . 0 0 "[ . 1 . 2 ]" 1
205 1 9 G H3' 1 10 C H6 5.500 . 5.500 3.537 3.325 3.833 . 0 0 "[ . 1 . 2 ]" 1
206 1 9 G H4' 1 10 C H6 7.500 2.800 7.500 5.168 5.019 5.246 . 0 0 "[ . 1 . 2 ]" 1
207 1 10 C H4' 1 10 C H6 5.500 . 5.500 3.949 3.922 3.969 . 0 0 "[ . 1 . 2 ]" 1
208 1 10 C H2' 1 10 C H6 4.200 . 4.200 3.905 3.784 3.980 . 0 0 "[ . 1 . 2 ]" 1
209 1 11 A H1' 1 11 A H2 5.500 . 5.500 4.665 4.659 4.670 . 0 0 "[ . 1 . 2 ]" 1
210 1 11 A H1' 1 12 C H1' 5.500 . 5.500 5.527 5.501 5.553 0.053 1 0 "[ . 1 . 2 ]" 1
211 1 11 A H1' 1 11 A H3' 4.200 . 4.200 3.871 3.864 3.876 . 0 0 "[ . 1 . 2 ]" 1
212 1 11 A H1' 1 11 A H4' 4.200 . 4.200 3.345 3.251 3.376 . 0 0 "[ . 1 . 2 ]" 1
213 1 11 A H1' 1 11 A H2' 3.300 . 3.300 2.756 2.750 2.775 . 0 0 "[ . 1 . 2 ]" 1
214 1 10 C H1' 1 11 A H1' 7.500 2.800 7.500 7.140 6.921 7.259 . 0 0 "[ . 1 . 2 ]" 1
215 1 10 C H2' 1 11 A H1' 5.500 . 5.500 5.012 4.948 5.083 . 0 0 "[ . 1 . 2 ]" 1
216 1 11 A H2 1 12 C H1' 5.500 . 5.500 5.416 5.264 5.493 . 0 0 "[ . 1 . 2 ]" 1
217 1 11 A H2 1 19 G H1' 5.500 . 5.500 4.554 4.402 4.766 . 0 0 "[ . 1 . 2 ]" 1
218 1 11 A H2 1 11 A H2' 7.500 2.800 7.500 5.568 5.537 5.615 . 0 0 "[ . 1 . 2 ]" 1
219 1 10 C H6 1 11 A H8 7.500 2.800 7.500 5.563 5.431 5.820 . 0 0 "[ . 1 . 2 ]" 1
220 1 11 A H3' 1 11 A H8 3.300 . 3.300 2.348 2.342 2.350 . 0 0 "[ . 1 . 2 ]" 1
221 1 10 C H3' 1 11 A H8 4.200 . 4.200 3.405 3.330 3.597 . 0 0 "[ . 1 . 2 ]" 1
222 1 11 A H4' 1 11 A H8 5.500 . 5.500 4.185 4.159 4.248 . 0 0 "[ . 1 . 2 ]" 1
223 1 11 A H2' 1 11 A H8 4.200 . 4.200 3.324 3.259 3.351 . 0 0 "[ . 1 . 2 ]" 1
224 1 10 C H2' 1 11 A H8 3.300 . 3.300 2.819 2.803 2.865 . 0 0 "[ . 1 . 2 ]" 1
225 1 11 A H8 1 12 C H6 5.500 . 5.500 4.152 4.004 4.262 . 0 0 "[ . 1 . 2 ]" 1
226 1 11 A H8 1 12 C H5 7.500 2.800 7.500 3.636 3.381 3.703 . 0 0 "[ . 1 . 2 ]" 1
227 1 10 C H4' 1 11 A H8 7.500 2.800 7.500 5.997 5.946 6.194 . 0 0 "[ . 1 . 2 ]" 1
228 1 11 A H3' 1 12 C H1' 7.500 2.800 7.500 6.060 6.013 6.114 . 0 0 "[ . 1 . 2 ]" 1
229 1 12 C H1' 1 12 C H4' 4.200 . 4.200 3.020 2.931 3.056 . 0 0 "[ . 1 . 2 ]" 1
230 1 12 C H1' 1 12 C H2' 3.300 . 3.300 2.864 2.854 2.892 . 0 0 "[ . 1 . 2 ]" 1
231 1 12 C H1' 1 12 C H3' 4.200 . 4.200 3.911 3.903 3.932 . 0 0 "[ . 1 . 2 ]" 1
232 1 11 A H2' 1 12 C H1' 5.500 . 5.500 3.890 3.861 3.932 . 0 0 "[ . 1 . 2 ]" 1
233 1 12 C H1' 1 13 G H8 5.500 . 5.500 5.495 5.436 5.518 0.018 11 0 "[ . 1 . 2 ]" 1
234 1 12 C H1' 1 12 C H5 5.500 . 5.500 5.347 5.340 5.370 . 0 0 "[ . 1 . 2 ]" 1
235 1 12 C H2' 1 12 C H5 7.500 2.800 7.500 5.069 4.962 5.086 . 0 0 "[ . 1 . 2 ]" 1
236 1 11 A H2' 1 12 C H5 4.200 . 4.200 3.913 3.837 3.999 . 0 0 "[ . 1 . 2 ]" 1
237 1 11 A H3' 1 12 C H5 7.500 2.800 7.500 3.989 3.898 4.132 . 0 0 "[ . 1 . 2 ]" 1
238 1 12 C H5 1 13 G H8 7.500 2.800 7.500 4.321 4.187 4.433 . 0 0 "[ . 1 . 2 ]" 1
239 1 11 A H1' 1 12 C H6 7.500 2.800 7.500 5.007 4.959 5.034 . 0 0 "[ . 1 . 2 ]" 1
240 1 11 A H3' 1 12 C H6 5.500 . 5.500 3.237 3.176 3.294 . 0 0 "[ . 1 . 2 ]" 1
241 1 12 C H4' 1 12 C H6 5.500 . 5.500 4.227 4.199 4.271 . 0 0 "[ . 1 . 2 ]" 1
242 1 12 C H3' 1 12 C H6 5.500 . 5.500 3.115 3.022 3.309 . 0 0 "[ . 1 . 2 ]" 1
243 1 11 A H2' 1 12 C H6 4.200 . 4.200 2.347 2.342 2.349 . 0 0 "[ . 1 . 2 ]" 1
244 1 12 C H2' 1 12 C H6 5.500 . 5.500 3.593 3.479 3.614 . 0 0 "[ . 1 . 2 ]" 1
245 1 11 A H4' 1 12 C H6 7.500 2.800 7.500 5.760 5.716 5.811 . 0 0 "[ . 1 . 2 ]" 1
246 1 13 G H1' 1 15 A H8 7.500 2.800 7.500 4.769 4.607 4.820 . 0 0 "[ . 1 . 2 ]" 1
247 1 12 C H1' 1 13 G H1' 7.500 2.800 7.500 5.713 5.624 5.810 . 0 0 "[ . 1 . 2 ]" 1
248 1 13 G H1' 1 13 G H3' 5.500 . 5.500 3.907 3.899 3.910 . 0 0 "[ . 1 . 2 ]" 1
249 1 13 G H1' 1 13 G H4' 4.200 . 4.200 3.114 3.089 3.147 . 0 0 "[ . 1 . 2 ]" 1
250 1 13 G H1' 1 13 G H2' 3.300 . 3.300 2.828 2.820 2.836 . 0 0 "[ . 1 . 2 ]" 1
251 1 12 C H2' 1 13 G H1' 5.500 . 5.500 3.911 3.873 3.942 . 0 0 "[ . 1 . 2 ]" 1
252 1 13 G H1' 1 13 G H8 5.500 . 5.500 3.711 3.702 3.720 . 0 0 "[ . 1 . 2 ]" 1
253 1 13 G H1' 1 14 A H8 7.500 2.800 7.500 6.809 6.780 6.861 . 0 0 "[ . 1 . 2 ]" 1
254 1 12 C H4' 1 13 G H1' 7.500 2.800 7.500 7.559 7.534 7.567 0.067 13 0 "[ . 1 . 2 ]" 1
255 1 13 G H1' 1 13 G H5' 7.500 2.800 7.500 5.119 5.109 5.134 . 0 0 "[ . 1 . 2 ]" 1
256 1 12 C H3' 1 13 G H1' 7.500 2.800 7.500 6.032 5.958 6.081 . 0 0 "[ . 1 . 2 ]" 1
257 1 13 G H1' 1 13 G H5'' 7.500 2.800 7.500 4.586 4.583 4.593 . 0 0 "[ . 1 . 2 ]" 1
258 1 13 G H3' 1 13 G H8 7.500 2.800 7.500 3.017 2.964 3.071 . 0 0 "[ . 1 . 2 ]" 1
259 1 12 C H2' 1 13 G H8 5.500 . 5.500 3.097 2.923 3.185 . 0 0 "[ . 1 . 2 ]" 1
260 1 13 G H2' 1 13 G H8 5.500 . 5.500 3.542 3.511 3.580 . 0 0 "[ . 1 . 2 ]" 1
261 1 12 C H4' 1 13 G H8 7.500 2.800 7.500 6.493 6.310 6.524 . 0 0 "[ . 1 . 2 ]" 1
262 1 12 C H3' 1 13 G H8 7.500 2.800 7.500 3.884 3.705 3.914 . 0 0 "[ . 1 . 2 ]" 1
263 1 13 G H4' 1 13 G H8 7.500 2.800 7.500 4.341 4.334 4.353 . 0 0 "[ . 1 . 2 ]" 1
264 1 12 C H5' 1 13 G H8 7.500 2.800 7.500 7.330 7.106 7.371 . 0 0 "[ . 1 . 2 ]" 1
265 1 12 C H5'' 1 13 G H8 7.500 2.800 7.500 6.448 6.218 6.496 . 0 0 "[ . 1 . 2 ]" 1
266 1 13 G H5' 1 13 G H8 7.500 2.800 7.500 4.293 4.271 4.339 . 0 0 "[ . 1 . 2 ]" 1
267 1 13 G H5'' 1 13 G H8 7.500 2.800 7.500 2.809 2.780 2.852 0.020 1 0 "[ . 1 . 2 ]" 1
268 1 14 A H1' 1 15 A H8 5.500 . 5.500 4.828 4.799 4.897 . 0 0 "[ . 1 . 2 ]" 1
269 1 14 A H1' 1 14 A H2 5.500 . 5.500 4.956 4.940 4.968 . 0 0 "[ . 1 . 2 ]" 1
270 1 14 A H1' 1 14 A H3' 4.200 . 4.200 3.863 3.855 3.870 . 0 0 "[ . 1 . 2 ]" 1
271 1 14 A H2 1 15 A H1' 3.300 . 3.300 2.502 2.455 2.616 . 0 0 "[ . 1 . 2 ]" 1
272 1 14 A H2 1 15 A H2' 7.500 2.800 7.500 5.103 5.040 5.226 . 0 0 "[ . 1 . 2 ]" 1
273 1 14 A H2 1 15 A H8 5.500 . 5.500 5.323 5.252 5.475 . 0 0 "[ . 1 . 2 ]" 1
274 1 14 A H2 1 15 A H2 5.500 . 5.500 5.264 5.153 5.418 . 0 0 "[ . 1 . 2 ]" 1
275 1 14 A H2' 1 15 A H3' 5.500 . 5.500 4.331 4.303 4.352 . 0 0 "[ . 1 . 2 ]" 1
276 1 14 A H2' 1 14 A H4' 4.200 . 4.200 3.847 3.840 3.857 . 0 0 "[ . 1 . 2 ]" 1
277 1 14 A H4' 1 15 A H1' 7.500 2.800 7.500 7.166 7.130 7.188 . 0 0 "[ . 1 . 2 ]" 1
278 1 14 A H3' 1 14 A Q5' 4.200 . 4.200 2.741 2.715 2.772 . 0 0 "[ . 1 . 2 ]" 1
279 1 14 A H4' 1 14 A Q5' 3.300 . 3.300 2.198 2.197 2.199 . 0 0 "[ . 1 . 2 ]" 1
280 1 14 A Q5' 1 15 A Q5' 7.500 2.800 7.500 4.942 4.875 4.961 . 0 0 "[ . 1 . 2 ]" 1
281 1 14 A H2' 1 14 A H8 4.200 . 4.200 4.051 4.019 4.067 . 0 0 "[ . 1 . 2 ]" 1
282 1 13 G H2' 1 14 A H8 5.500 . 5.500 5.542 5.508 5.550 0.050 10 0 "[ . 1 . 2 ]" 1
283 1 14 A H4' 1 14 A H8 5.500 . 5.500 4.209 4.199 4.227 . 0 0 "[ . 1 . 2 ]" 1
284 1 14 A H2' 1 15 A H1' 3.300 . 3.300 3.341 3.313 3.360 0.060 21 0 "[ . 1 . 2 ]" 1
285 1 15 A H1' 1 15 A H3' 4.200 . 4.200 3.900 3.892 3.916 . 0 0 "[ . 1 . 2 ]" 1
286 1 14 A H1' 1 15 A H1' 5.500 . 5.500 5.111 5.081 5.147 . 0 0 "[ . 1 . 2 ]" 1
287 1 15 A H1' 1 16 A H2 7.500 2.800 7.500 7.527 7.511 7.537 0.037 1 0 "[ . 1 . 2 ]" 1
288 1 14 A H3' 1 15 A H1' 7.500 2.800 7.500 5.315 5.291 5.348 . 0 0 "[ . 1 . 2 ]" 1
289 1 15 A H1' 1 15 A H2 7.500 2.800 7.500 4.939 4.888 4.948 . 0 0 "[ . 1 . 2 ]" 1
290 1 15 A H2 1 16 A H1' 5.500 . 5.500 2.792 2.619 3.061 . 0 0 "[ . 1 . 2 ]" 1
291 1 15 A H2 1 16 A H2 5.500 . 5.500 4.157 4.029 4.313 . 0 0 "[ . 1 . 2 ]" 1
292 1 14 A H1' 1 15 A H4' 7.500 2.800 7.500 5.390 5.331 5.447 . 0 0 "[ . 1 . 2 ]" 1
293 1 14 A H2' 1 15 A H4' 4.200 . 4.200 3.449 3.414 3.484 . 0 0 "[ . 1 . 2 ]" 1
294 1 14 A H3' 1 15 A H4' 5.500 . 5.500 5.285 5.254 5.311 . 0 0 "[ . 1 . 2 ]" 1
295 1 15 A H2' 1 15 A H4' 4.200 . 4.200 3.838 3.831 3.858 . 0 0 "[ . 1 . 2 ]" 1
296 1 15 A H4' 1 16 A H8 7.500 2.800 7.500 5.388 5.329 5.498 . 0 0 "[ . 1 . 2 ]" 1
297 1 15 A H3' 1 15 A Q5' 4.200 . 4.200 2.714 2.687 2.766 . 0 0 "[ . 1 . 2 ]" 1
298 1 14 A H3' 1 15 A H5' 5.500 . 5.500 3.784 3.677 3.808 . 0 0 "[ . 1 . 2 ]" 1
299 1 15 A H4' 1 15 A Q5' 3.300 . 3.300 2.199 2.197 2.202 . 0 0 "[ . 1 . 2 ]" 1
300 1 14 A H3' 1 15 A H5'' 5.500 . 5.500 4.910 4.889 4.925 . 0 0 "[ . 1 . 2 ]" 1
301 1 14 A H8 1 15 A H8 5.500 . 6.500 4.439 4.385 4.497 . 0 0 "[ . 1 . 2 ]" 1
302 1 14 A H2' 1 15 A H8 3.300 . 3.300 2.350 2.347 2.391 . 0 0 "[ . 1 . 2 ]" 1
303 1 13 G H3' 1 15 A H8 7.500 2.800 7.500 5.952 5.733 6.026 . 0 0 "[ . 1 . 2 ]" 1
304 1 14 A H3' 1 15 A H8 3.300 . 3.300 2.382 2.347 2.422 . 0 0 "[ . 1 . 2 ]" 1
305 1 15 A H2' 1 15 A H8 5.500 . 5.500 3.928 3.871 3.945 . 0 0 "[ . 1 . 2 ]" 1
306 1 15 A H4' 1 15 A H8 5.500 . 5.500 4.348 4.325 4.364 . 0 0 "[ . 1 . 2 ]" 1
307 1 14 A H4' 1 15 A H8 5.500 . 5.500 5.220 5.191 5.254 . 0 0 "[ . 1 . 2 ]" 1
308 1 13 G H2' 1 15 A H8 5.500 . 5.500 4.112 3.914 4.178 . 0 0 "[ . 1 . 2 ]" 1
309 1 13 G H4' 1 15 A H8 7.500 2.800 7.500 5.898 5.672 5.943 . 0 0 "[ . 1 . 2 ]" 1
310 1 13 G H8 1 15 A H8 7.500 2.800 7.500 7.469 7.295 7.506 0.006 11 0 "[ . 1 . 2 ]" 1
311 1 15 A H2' 1 16 A H1' 4.200 . 4.200 2.992 2.944 3.135 . 0 0 "[ . 1 . 2 ]" 1
312 1 15 A H1' 1 16 A H1' 7.000 . 7.000 4.744 4.715 4.905 . 0 0 "[ . 1 . 2 ]" 1
313 1 15 A H3' 1 16 A H1' 7.500 2.800 7.500 5.158 5.099 5.284 . 0 0 "[ . 1 . 2 ]" 1
314 1 16 A H1' 1 17 G H1' 7.500 2.800 7.500 4.554 4.472 4.668 . 0 0 "[ . 1 . 2 ]" 1
315 1 16 A H2' 1 17 G H1' 5.500 . 5.500 2.398 2.341 2.566 . 0 0 "[ . 1 . 2 ]" 1
316 1 16 A H2' 1 17 G H8 5.500 . 5.500 4.883 4.663 4.976 . 0 0 "[ . 1 . 2 ]" 1
317 1 16 A H1' 1 16 A H2 7.500 2.800 7.500 4.691 4.667 4.701 . 0 0 "[ . 1 . 2 ]" 1
318 1 16 A H1' 1 16 A H3' 5.500 . 5.500 3.885 3.838 3.896 . 0 0 "[ . 1 . 2 ]" 1
319 1 16 A H3' 1 17 G H8 5.500 . 5.500 3.925 3.651 4.020 . 0 0 "[ . 1 . 2 ]" 1
320 1 16 A H3' 1 16 A Q5' 5.500 . 5.500 2.704 2.691 2.761 . 0 0 "[ . 1 . 2 ]" 1
321 1 15 A H2' 1 16 A H3' 5.500 . 5.500 4.328 4.156 4.376 . 0 0 "[ . 1 . 2 ]" 1
322 1 16 A H2' 1 16 A H3' 3.300 . 3.300 2.354 2.348 2.377 . 0 0 "[ . 1 . 2 ]" 1
323 1 15 A H1' 1 16 A H8 5.500 . 5.500 5.349 5.317 5.400 . 0 0 "[ . 1 . 2 ]" 1
324 1 15 A H8 1 16 A H8 5.500 . 6.500 5.357 5.294 5.537 . 0 0 "[ . 1 . 2 ]" 1
325 1 15 A H2 1 16 A H8 7.500 2.800 7.500 6.151 6.097 6.320 . 0 0 "[ . 1 . 2 ]" 1
326 1 16 A H8 1 17 G H8 5.500 . 5.500 4.222 4.096 4.343 . 0 0 "[ . 1 . 2 ]" 1
327 1 16 A H2' 1 16 A H8 4.200 . 4.200 3.558 3.451 3.599 . 0 0 "[ . 1 . 2 ]" 1
328 1 15 A H3' 1 16 A H8 4.200 . 4.200 2.769 2.686 2.948 . 0 0 "[ . 1 . 2 ]" 1
329 1 16 A H4' 1 16 A H8 5.500 . 5.500 4.153 4.070 4.193 . 0 0 "[ . 1 . 2 ]" 1
330 1 15 A H2' 1 16 A H8 3.300 . 3.300 2.592 2.577 2.619 . 0 0 "[ . 1 . 2 ]" 1
331 1 14 A H2' 1 16 A H8 7.500 2.800 7.500 6.795 6.731 6.940 . 0 0 "[ . 1 . 2 ]" 1
332 1 17 G H1' 1 17 G H3' 5.500 . 5.500 3.839 3.833 3.846 . 0 0 "[ . 1 . 2 ]" 1
333 1 17 G H1' 1 17 G H2' 3.300 . 3.300 2.751 2.745 2.754 . 0 0 "[ . 1 . 2 ]" 1
334 1 17 G H1' 1 18 U H6 5.500 . 5.500 5.042 5.025 5.059 . 0 0 "[ . 1 . 2 ]" 1
335 1 16 A H8 1 17 G H1' 7.500 2.800 7.500 4.069 3.966 4.437 . 0 0 "[ . 1 . 2 ]" 1
336 1 16 A H2 1 17 G H1' 5.500 . 5.500 4.964 4.765 5.208 . 0 0 "[ . 1 . 2 ]" 1
337 1 17 G H1' 1 18 U Q5' 7.500 2.800 7.500 5.559 5.520 5.599 . 0 0 "[ . 1 . 2 ]" 1
338 1 16 A H3' 1 17 G H1' 7.500 2.800 7.500 3.645 3.536 3.990 . 0 0 "[ . 1 . 2 ]" 1
339 1 17 G H1' 1 18 U H4' 7.500 2.800 7.500 6.707 6.634 6.823 . 0 0 "[ . 1 . 2 ]" 1
340 1 16 A H4' 1 17 G H1' 7.500 2.800 7.500 6.045 5.970 6.295 . 0 0 "[ . 1 . 2 ]" 1
341 1 16 A H2' 1 17 G H2' 5.500 . 5.500 4.722 4.632 4.893 . 0 0 "[ . 1 . 2 ]" 1
342 1 17 G H3' 1 18 U H6 4.200 . 4.200 3.271 3.200 3.314 . 0 0 "[ . 1 . 2 ]" 1
343 1 16 A H2' 1 17 G H3' 5.500 . 5.500 4.990 4.858 5.164 . 0 0 "[ . 1 . 2 ]" 1
344 1 17 G H3' 1 18 U H4' 7.500 2.800 7.500 6.051 6.010 6.125 . 0 0 "[ . 1 . 2 ]" 1
345 1 17 G H2' 1 17 G H3' 3.300 . 3.300 2.379 2.375 2.382 . 0 0 "[ . 1 . 2 ]" 1
346 1 16 A H1' 1 17 G H4' 7.500 2.800 7.500 5.489 5.391 5.994 . 0 0 "[ . 1 . 2 ]" 1
347 1 17 G H1' 1 17 G H4' 4.200 . 4.200 3.312 3.283 3.337 . 0 0 "[ . 1 . 2 ]" 1
348 1 16 A H3' 1 17 G H4' 5.500 . 5.500 2.920 2.769 3.847 . 0 0 "[ . 1 . 2 ]" 1
349 1 16 A H2' 1 17 G H4' 3.300 . 3.300 2.848 2.741 3.352 0.052 15 0 "[ . 1 . 2 ]" 1
350 1 17 G H3' 1 17 G H4' 3.300 . 3.300 3.048 3.046 3.050 . 0 0 "[ . 1 . 2 ]" 1
351 1 17 G H2' 1 17 G H4' 4.200 . 4.200 3.784 3.774 3.793 . 0 0 "[ . 1 . 2 ]" 1
352 1 17 G H4' 1 18 U H5 7.500 2.800 7.500 6.512 6.223 6.633 . 0 0 "[ . 1 . 2 ]" 1
353 1 16 A H2' 1 17 G Q5' 5.500 . 5.500 4.353 4.220 4.407 . 0 0 "[ . 1 . 2 ]" 1
354 1 17 G H4' 1 17 G H5' 3.300 . 3.300 2.482 2.436 2.695 . 0 0 "[ . 1 . 2 ]" 1
355 1 17 G H2' 1 17 G H5' 5.500 . 5.500 4.898 4.747 4.956 . 0 0 "[ . 1 . 2 ]" 1
356 1 17 G H3' 1 17 G Q5' . . 3.300 2.311 2.277 2.411 . 0 0 "[ . 1 . 2 ]" 1
357 1 16 A H3' 1 17 G Q5' 4.200 . 4.200 3.138 3.097 3.246 . 0 0 "[ . 1 . 2 ]" 1
358 1 17 G H4' 1 17 G H5'' 3.300 . 3.300 3.043 3.016 3.046 . 0 0 "[ . 1 . 2 ]" 1
359 1 17 G H2' 1 17 G H5'' 5.500 . 5.500 4.496 4.457 4.719 . 0 0 "[ . 1 . 2 ]" 1
360 1 17 G Q5' 1 18 U H6 7.500 2.800 7.500 5.184 5.105 5.268 . 0 0 "[ . 1 . 2 ]" 1
361 1 17 G Q5' 1 17 G H8 7.500 2.800 7.500 2.465 2.448 2.521 0.352 1 0 "[ . 1 . 2 ]" 1
362 1 17 G H4' 1 17 G H8 5.500 . 5.500 4.188 4.168 4.197 . 0 0 "[ . 1 . 2 ]" 1
363 1 17 G H3' 1 17 G H8 5.500 . 5.500 2.576 2.545 2.614 . 0 0 "[ . 1 . 2 ]" 1
364 1 18 U H1' 1 19 G H8 5.500 . 5.500 5.080 5.042 5.105 . 0 0 "[ . 1 . 2 ]" 1
365 1 18 U H1' 1 19 G H1' 7.500 2.800 7.500 5.532 5.473 5.650 . 0 0 "[ . 1 . 2 ]" 1
366 1 18 U H1' 1 18 U H5 5.500 . 5.500 5.377 5.367 5.384 . 0 0 "[ . 1 . 2 ]" 1
367 1 11 A H2 1 18 U H1' 5.500 . 5.500 5.504 5.486 5.515 0.015 10 0 "[ . 1 . 2 ]" 1
368 1 18 U H1' 1 18 U H2' 3.300 . 3.300 2.839 2.818 2.852 . 0 0 "[ . 1 . 2 ]" 1
369 1 18 U H1' 1 18 U H4' 4.200 . 4.200 3.077 3.028 3.188 . 0 0 "[ . 1 . 2 ]" 1
370 1 18 U H1' 1 18 U H3' 4.200 . 4.200 3.904 3.900 3.908 . 0 0 "[ . 1 . 2 ]" 1
371 1 17 G H2' 1 18 U H1' 4.200 . 4.200 4.197 4.165 4.209 0.009 15 0 "[ . 1 . 2 ]" 1
372 1 17 G H8 1 18 U H1' 7.500 2.800 7.500 7.514 7.502 7.542 0.042 1 0 "[ . 1 . 2 ]" 1
373 1 17 G H4' 1 18 U H1' 7.500 2.800 7.500 7.568 7.553 7.578 0.078 21 0 "[ . 1 . 2 ]" 1
374 1 17 G H2' 1 18 U H5 7.500 2.800 7.500 3.521 3.292 3.610 . 0 0 "[ . 1 . 2 ]" 1
375 1 17 G H3' 1 18 U H5 7.500 2.800 7.500 3.687 3.367 3.829 . 0 0 "[ . 1 . 2 ]" 1
376 1 18 U H1' 1 18 U H6 5.500 . 5.500 3.616 3.604 3.628 . 0 0 "[ . 1 . 2 ]" 1
377 1 18 U H2' 1 18 U H6 4.200 . 4.200 3.484 3.468 3.513 . 0 0 "[ . 1 . 2 ]" 1
378 1 18 U H5' 1 18 U H6 5.500 . 5.500 4.027 3.866 4.102 . 0 0 "[ . 1 . 2 ]" 1
379 1 18 U H4' 1 18 U H6 5.500 . 5.500 4.163 4.110 4.200 . 0 0 "[ . 1 . 2 ]" 1
380 1 18 U H3' 1 18 U H6 5.500 . 5.500 2.895 2.773 3.017 . 0 0 "[ . 1 . 2 ]" 1
381 1 17 G H2' 1 18 U H6 3.300 . 3.300 2.345 2.331 2.348 . 0 0 "[ . 1 . 2 ]" 1
382 1 18 U H5'' 1 18 U H6 5.500 . 5.500 4.193 4.035 4.279 . 0 0 "[ . 1 . 2 ]" 1
383 1 17 G H8 1 18 U H6 7.500 2.800 7.500 4.717 4.670 4.811 . 0 0 "[ . 1 . 2 ]" 1
384 1 19 G H1' 1 19 G Q5' 5.500 . 5.500 4.350 4.320 4.397 . 0 0 "[ . 1 . 2 ]" 1
385 1 19 G H1' 1 19 G H4' 4.200 . 4.200 3.157 3.115 3.177 . 0 0 "[ . 1 . 2 ]" 1
386 1 19 G H1' 1 19 G H3' 4.200 . 4.200 3.902 3.894 3.909 . 0 0 "[ . 1 . 2 ]" 1
387 1 19 G H1' 1 19 G H2' 3.300 . 3.300 2.815 2.808 2.828 . 0 0 "[ . 1 . 2 ]" 1
388 1 18 U H3' 1 19 G H1' 7.500 2.800 7.500 6.599 6.526 6.681 . 0 0 "[ . 1 . 2 ]" 1
389 1 18 U H6 1 19 G H1' 7.500 2.800 7.500 7.481 7.436 7.509 0.009 12 0 "[ . 1 . 2 ]" 1
390 1 19 G H2' 1 20 A H1' 4.200 2.700 4.200 4.211 4.201 4.223 0.023 5 0 "[ . 1 . 2 ]" 1
391 1 18 U H3' 1 19 G H5' 7.500 2.800 7.500 4.159 4.041 4.481 . 0 0 "[ . 1 . 2 ]" 1
392 1 18 U H3' 1 19 G H5'' 7.500 2.800 7.500 5.224 5.168 5.365 . 0 0 "[ . 1 . 2 ]" 1
393 1 19 G H8 1 20 A H8 7.500 2.800 7.500 4.895 4.688 5.070 . 0 0 "[ . 1 . 2 ]" 1
394 1 18 U H6 1 19 G H8 5.500 . 5.500 5.244 5.115 5.331 . 0 0 "[ . 1 . 2 ]" 1
395 1 19 G H3' 1 19 G H8 4.200 . 4.200 2.953 2.905 3.037 . 0 0 "[ . 1 . 2 ]" 1
396 1 19 G H2' 1 19 G H8 4.200 . 4.200 3.549 3.494 3.655 . 0 0 "[ . 1 . 2 ]" 1
397 1 19 G H4' 1 19 G H8 5.500 . 5.500 4.335 4.319 4.366 . 0 0 "[ . 1 . 2 ]" 1
398 1 19 G Q5' 1 19 G H8 5.500 . 5.500 3.717 3.677 3.763 . 0 0 "[ . 1 . 2 ]" 1
399 1 18 U H2' 1 19 G H8 4.200 . 4.200 2.349 2.347 2.358 . 0 0 "[ . 1 . 2 ]" 1
400 1 18 U H4' 1 19 G H8 7.500 2.800 7.500 5.878 5.837 5.913 . 0 0 "[ . 1 . 2 ]" 1
401 1 20 A H1' 1 21 C H1' 7.500 2.800 7.500 6.385 6.348 6.451 . 0 0 "[ . 1 . 2 ]" 1
402 1 20 A H1' 1 20 A H3' 4.200 . 4.200 3.923 3.914 3.931 . 0 0 "[ . 1 . 2 ]" 1
403 1 19 G H1' 1 20 A H1' 7.500 2.800 7.500 5.803 5.529 5.981 . 0 0 "[ . 1 . 2 ]" 1
404 1 20 A H1' 1 21 C H4' 7.500 2.800 7.500 6.397 6.310 6.638 . 0 0 "[ . 1 . 2 ]" 1
405 1 20 A H2 1 20 A H2' 5.500 . 5.500 5.451 5.356 5.507 0.007 7 0 "[ . 1 . 2 ]" 1
406 1 20 A H2 1 21 C H1' 5.500 . 5.500 5.519 5.488 5.535 0.035 20 0 "[ . 1 . 2 ]" 1
407 1 10 C H1' 1 20 A H2 7.500 2.800 7.500 4.970 4.751 5.148 . 0 0 "[ . 1 . 2 ]" 1
408 1 20 A H1' 1 20 A H2 5.500 . 5.500 4.692 4.679 4.719 . 0 0 "[ . 1 . 2 ]" 1
409 1 20 A H2 1 21 C H5 7.500 2.800 7.500 6.334 6.080 6.646 . 0 0 "[ . 1 . 2 ]" 1
410 1 19 G H2' 1 20 A H2 7.500 2.800 7.500 7.323 7.231 7.499 . 0 0 "[ . 1 . 2 ]" 1
411 1 20 A H8 1 21 C H5 7.500 2.800 7.500 3.600 3.466 3.664 . 0 0 "[ . 1 . 2 ]" 1
412 1 19 G H1' 1 20 A H8 7.500 2.800 7.500 5.131 5.107 5.158 . 0 0 "[ . 1 . 2 ]" 1
413 1 19 G H3' 1 20 A H8 4.200 . 4.200 3.392 3.247 3.614 . 0 0 "[ . 1 . 2 ]" 1
414 1 20 A H2' 1 20 A H8 4.200 . 4.200 3.355 3.315 3.435 . 0 0 "[ . 1 . 2 ]" 1
415 1 20 A H4' 1 20 A H8 5.500 . 5.500 4.414 4.378 4.437 . 0 0 "[ . 1 . 2 ]" 1
416 1 19 G H2' 1 20 A H8 5.500 . 5.500 2.348 2.347 2.353 . 0 0 "[ . 1 . 2 ]" 1
417 1 21 C H1' 1 22 G H8 5.500 . 5.500 4.077 4.031 4.320 . 0 0 "[ . 1 . 2 ]" 1
418 1 20 A H2' 1 21 C H1' 4.200 . 4.200 4.249 4.223 4.267 0.067 18 0 "[ . 1 . 2 ]" 1
419 1 21 C H1' 1 21 C H3' 4.200 . 4.200 3.927 3.920 3.933 . 0 0 "[ . 1 . 2 ]" 1
420 1 21 C H1' 1 21 C H4' 3.300 . 3.300 2.893 2.853 2.981 . 0 0 "[ . 1 . 2 ]" 1
421 1 21 C H1' 1 21 C H2' 3.300 . 3.300 2.895 2.870 2.904 . 0 0 "[ . 1 . 2 ]" 1
422 1 20 A H2' 1 21 C H5 5.500 . 5.500 5.101 4.707 5.217 . 0 0 "[ . 1 . 2 ]" 1
423 1 20 A H1' 1 21 C H5 7.500 2.800 7.500 6.292 6.006 6.404 . 0 0 "[ . 1 . 2 ]" 1
424 1 20 A H2 1 21 C H6 7.500 2.800 7.500 5.970 5.837 6.170 . 0 0 "[ . 1 . 2 ]" 1
425 1 20 A H1' 1 21 C H6 7.500 2.800 7.500 5.191 5.075 5.317 . 0 0 "[ . 1 . 2 ]" 1
426 1 21 C H1' 1 21 C H6 5.500 . 5.500 3.553 3.544 3.559 . 0 0 "[ . 1 . 2 ]" 1
427 1 21 C Q5' 1 21 C H6 . 2.800 5.500 3.096 2.971 3.149 . 0 0 "[ . 1 . 2 ]" 1
428 1 21 C H2' 1 21 C H6 7.500 2.800 7.500 3.646 3.616 3.694 . 0 0 "[ . 1 . 2 ]" 1
429 1 21 C H4' 1 21 C H6 5.500 . 5.500 4.324 4.287 4.336 . 0 0 "[ . 1 . 2 ]" 1
430 1 20 A H3' 1 21 C H6 5.500 . 5.500 3.934 3.715 4.036 . 0 0 "[ . 1 . 2 ]" 1
431 1 21 C H3' 1 21 C H6 4.200 . 4.200 3.498 3.395 3.569 . 0 0 "[ . 1 . 2 ]" 1
432 1 20 A H2' 1 21 C H6 3.300 . 3.300 3.113 2.824 3.244 . 0 0 "[ . 1 . 2 ]" 1
433 1 20 A H8 1 21 C H6 7.500 2.800 7.500 3.280 3.226 3.490 . 0 0 "[ . 1 . 2 ]" 1
434 1 20 A H5' 1 21 C H6 7.500 2.800 7.500 6.700 6.594 6.745 . 0 0 "[ . 1 . 2 ]" 1
435 1 20 A H5'' 1 21 C H6 7.500 2.800 7.500 6.909 6.690 7.021 . 0 0 "[ . 1 . 2 ]" 1
436 1 22 G H1' 1 23 G H8 5.500 . 5.500 4.842 4.733 4.916 . 0 0 "[ . 1 . 2 ]" 1
437 1 21 C H1' 1 22 G H1' 5.500 . 5.500 5.537 5.512 5.562 0.062 20 0 "[ . 1 . 2 ]" 1
438 1 21 C H2' 1 22 G H1' 5.500 . 5.500 5.530 5.357 5.551 0.051 9 0 "[ . 1 . 2 ]" 1
439 1 21 C H2' 1 22 G H8 3.300 . 3.300 2.344 2.335 2.346 . 0 0 "[ . 1 . 2 ]" 1
440 1 22 G H2' 1 22 G H8 7.500 2.800 7.500 3.934 3.880 3.965 . 0 0 "[ . 1 . 2 ]" 1
441 1 22 G H4' 1 22 G H8 7.500 2.800 7.500 4.232 4.176 4.291 . 0 0 "[ . 1 . 2 ]" 1
442 1 21 C H3' 1 22 G H8 7.500 2.800 7.500 4.125 4.054 4.193 . 0 0 "[ . 1 . 2 ]" 1
443 1 21 C H6 1 22 G H8 7.500 2.800 7.500 5.938 5.909 6.000 . 0 0 "[ . 1 . 2 ]" 1
444 1 21 C H4' 1 22 G H8 7.500 2.800 7.500 5.000 4.967 5.127 . 0 0 "[ . 1 . 2 ]" 1
445 1 22 G H2' 1 23 G H1' 5.500 . 5.500 3.814 3.736 3.995 . 0 0 "[ . 1 . 2 ]" 1
446 1 23 G H1' 1 24 C H1' 7.500 2.800 7.500 6.153 5.526 6.374 . 0 0 "[ . 1 . 2 ]" 1
447 1 22 G H8 1 23 G H8 5.500 . 5.500 4.345 4.016 4.528 . 0 0 "[ . 1 . 2 ]" 1
448 1 23 G H8 1 24 C H6 5.500 . 5.500 4.960 4.358 5.276 . 0 0 "[ . 1 . 2 ]" 1
449 1 22 G H2' 1 23 G H8 3.300 . 3.300 2.348 2.343 2.350 . 0 0 "[ . 1 . 2 ]" 1
450 1 22 G H3' 1 23 G H8 3.300 . 3.300 2.682 2.568 2.786 . 0 0 "[ . 1 . 2 ]" 1
451 1 22 G H4' 1 23 G H8 5.500 . 5.500 5.427 5.349 5.505 0.005 13 0 "[ . 1 . 2 ]" 1
452 1 23 G H2' 1 23 G H8 5.500 . 5.500 3.833 3.713 3.958 . 0 0 "[ . 1 . 2 ]" 1
453 1 23 G H2' 1 24 C H1' 5.500 . 5.500 4.243 3.847 4.406 . 0 0 "[ . 1 . 2 ]" 1
454 1 24 C H1' 1 24 C H3' 4.200 . 4.200 3.896 3.870 3.941 . 0 0 "[ . 1 . 2 ]" 1
455 1 23 G H1' 1 24 C H5 7.500 2.800 7.500 5.742 5.569 5.949 . 0 0 "[ . 1 . 2 ]" 1
456 1 24 C H1' 1 24 C H5 5.500 . 5.500 5.393 5.377 5.408 . 0 0 "[ . 1 . 2 ]" 1
457 1 24 C H5 1 25 U H5 5.500 . 5.500 4.878 4.719 5.058 . 0 0 "[ . 1 . 2 ]" 1
458 1 23 G H3' 1 24 C H5 5.500 . 5.500 3.794 3.447 4.258 . 0 0 "[ . 1 . 2 ]" 1
459 1 24 C H3' 1 24 C H5 5.500 . 5.500 4.882 4.620 5.364 . 0 0 "[ . 1 . 2 ]" 1
460 1 23 G H2' 1 24 C H5 5.500 . 5.500 3.693 3.399 4.109 . 0 0 "[ . 1 . 2 ]" 1
461 1 23 G H8 1 24 C H5 7.500 2.800 7.500 4.087 3.844 4.262 . 0 0 "[ . 1 . 2 ]" 1
462 1 24 C H2' 1 24 C H5 7.500 2.800 7.500 4.942 4.798 5.038 . 0 0 "[ . 1 . 2 ]" 1
463 1 24 C H4' 1 24 C H5 7.500 2.800 7.500 6.600 6.511 6.720 . 0 0 "[ . 1 . 2 ]" 1
464 1 23 G H1' 1 24 C H6 5.500 . 5.500 5.075 4.944 5.131 . 0 0 "[ . 1 . 2 ]" 1
465 1 23 G H3' 1 24 C H6 4.200 . 4.200 3.216 3.108 3.383 . 0 0 "[ . 1 . 2 ]" 1
466 1 23 G H2' 1 24 C H6 3.300 . 3.300 2.347 2.341 2.350 . 0 0 "[ . 1 . 2 ]" 1
467 1 24 C H4' 1 24 C H6 5.500 . 5.500 4.191 4.089 4.341 . 0 0 "[ . 1 . 2 ]" 1
468 1 24 C H2' 1 24 C H6 4.200 . 4.200 3.455 3.259 3.582 . 0 0 "[ . 1 . 2 ]" 1
469 1 23 G H4' 1 24 C H6 7.500 2.800 7.500 5.701 5.592 5.884 . 0 0 "[ . 1 . 2 ]" 1
470 1 2 A H2 1 25 U H1' 7.500 2.800 7.500 5.255 5.149 5.324 . 0 0 "[ . 1 . 2 ]" 1
471 1 25 U H1' 1 26 C H6 5.500 . 5.500 4.881 4.823 4.987 . 0 0 "[ . 1 . 2 ]" 1
472 1 25 U H1' 1 25 U H3' 4.200 . 4.200 3.857 3.849 3.870 . 0 0 "[ . 1 . 2 ]" 1
473 1 24 C H2' 1 25 U H1' 5.500 . 5.500 4.910 4.597 5.465 . 0 0 "[ . 1 . 2 ]" 1
474 1 25 U H1' 1 26 C H1' 7.500 2.800 7.500 6.181 6.108 6.277 . 0 0 "[ . 1 . 2 ]" 1
475 1 25 U H1' 1 26 C H4' 7.500 2.800 7.500 6.187 6.098 6.309 . 0 0 "[ . 1 . 2 ]" 1
476 1 25 U H1' 1 25 U H5 7.500 2.800 7.500 5.437 5.404 5.451 . 0 0 "[ . 1 . 2 ]" 1
477 1 25 U H3' 1 25 U H5 5.500 . 5.500 4.268 4.221 4.328 . 0 0 "[ . 1 . 2 ]" 1
478 1 24 C H3' 1 25 U H5 5.500 . 5.500 3.969 3.796 4.134 . 0 0 "[ . 1 . 2 ]" 1
479 1 24 C H2' 1 25 U H5 5.500 . 5.500 2.839 2.347 3.136 . 0 0 "[ . 1 . 2 ]" 1
480 1 24 C H1' 1 25 U H5 7.500 2.800 7.500 5.389 4.886 5.669 . 0 0 "[ . 1 . 2 ]" 1
481 1 24 C H6 1 25 U H5 7.500 2.800 7.500 4.656 4.430 4.797 . 0 0 "[ . 1 . 2 ]" 1
482 1 24 C H4' 1 25 U H5 7.500 2.800 7.500 6.428 6.169 6.595 . 0 0 "[ . 1 . 2 ]" 1
483 1 24 C H1' 1 25 U H6 5.500 . 5.500 4.819 4.353 5.018 . 0 0 "[ . 1 . 2 ]" 1
484 1 24 C H3' 1 25 U H6 4.200 . 4.200 3.930 3.789 4.146 . 0 0 "[ . 1 . 2 ]" 1
485 1 25 U H4' 1 25 U H6 5.500 . 5.500 3.981 3.951 4.010 . 0 0 "[ . 1 . 2 ]" 1
486 1 24 C H2' 1 25 U H6 3.300 . 3.300 2.345 2.328 2.349 . 0 0 "[ . 1 . 2 ]" 1
487 1 25 U H2' 1 25 U H6 4.200 . 4.200 3.445 3.361 3.491 . 0 0 "[ . 1 . 2 ]" 1
488 1 24 C H6 1 25 U H6 5.500 . 5.500 5.554 5.531 5.589 0.089 13 0 "[ . 1 . 2 ]" 1
489 1 24 C H4' 1 25 U H6 7.500 2.800 7.500 5.583 5.340 5.691 . 0 0 "[ . 1 . 2 ]" 1
490 1 25 U H2' 1 26 C H1' 4.200 . 4.200 4.147 4.090 4.202 0.002 17 0 "[ . 1 . 2 ]" 1
491 1 26 C H2' 1 26 C H6 4.200 . 4.200 3.779 3.755 3.818 . 0 0 "[ . 1 . 2 ]" 1
492 1 25 U H2' 1 26 C H2' 5.500 . 5.500 5.439 5.365 5.496 . 0 0 "[ . 1 . 2 ]" 1
493 1 26 C H1' 1 26 C H3' 4.200 . 4.200 3.863 3.861 3.869 . 0 0 "[ . 1 . 2 ]" 1
494 1 26 C H3' 1 26 C Q5' 4.200 . 4.200 2.848 2.755 2.902 . 0 0 "[ . 1 . 2 ]" 1
495 1 25 U H2' 1 26 C H3' 5.500 . 5.500 4.522 4.454 4.690 . 0 0 "[ . 1 . 2 ]" 1
496 1 26 C H2' 1 26 C H3' 3.300 . 3.300 2.345 2.335 2.348 . 0 0 "[ . 1 . 2 ]" 1
497 1 26 C H4' 1 26 C H6 4.200 . 4.200 4.230 4.218 4.243 0.043 21 0 "[ . 1 . 2 ]" 1
498 1 26 C H2' 1 26 C H4' 4.200 . 4.200 3.793 3.789 3.797 . 0 0 "[ . 1 . 2 ]" 1
499 1 26 C H4' 1 26 C Q5' 3.300 . 3.300 2.198 2.197 2.200 . 0 0 "[ . 1 . 2 ]" 1
500 1 26 C H4' 1 26 C H5 7.500 2.800 7.500 6.629 6.619 6.641 . 0 0 "[ . 1 . 2 ]" 1
501 1 25 U H5 1 26 C H5 5.500 . 5.500 2.669 2.536 2.930 . 0 0 "[ . 1 . 2 ]" 1
502 1 25 U H6 1 26 C H5 7.500 2.800 7.500 3.557 3.456 3.686 . 0 0 "[ . 1 . 2 ]" 1
503 1 25 U H3' 1 26 C H5 5.500 . 5.500 3.860 3.780 3.938 . 0 0 "[ . 1 . 2 ]" 1
504 1 25 U H2' 1 26 C H5 4.200 . 4.200 4.186 4.066 4.214 0.014 1 0 "[ . 1 . 2 ]" 1
505 1 26 C H3' 1 26 C H5 5.500 . 5.500 5.102 5.054 5.153 . 0 0 "[ . 1 . 2 ]" 1
506 1 26 C H2' 1 26 C H5 7.500 2.800 7.500 5.184 5.165 5.209 . 0 0 "[ . 1 . 2 ]" 1
507 1 26 C H1' 1 26 C H5 5.500 . 5.500 5.300 5.287 5.307 . 0 0 "[ . 1 . 2 ]" 1
508 1 26 C H5 1 26 C Q5' 7.500 2.800 7.500 5.740 5.678 5.798 . 0 0 "[ . 1 . 2 ]" 1
509 1 25 U H6 1 26 C H6 5.500 . 5.500 3.898 3.788 4.031 . 0 0 "[ . 1 . 2 ]" 1
510 1 25 U H4' 1 26 C H6 5.500 . 5.500 5.586 5.559 5.611 0.111 19 0 "[ . 1 . 2 ]" 1
511 1 25 U H3' 1 26 C H6 4.200 . 4.200 2.943 2.881 3.015 . 0 0 "[ . 1 . 2 ]" 1
512 1 25 U H2' 1 26 C H6 3.300 . 3.300 2.344 2.330 2.346 . 0 0 "[ . 1 . 2 ]" 1
513 1 25 U H5 1 26 C H6 7.500 2.800 7.500 4.361 4.252 4.594 . 0 0 "[ . 1 . 2 ]" 1
514 1 6 G H1' 1 8 A H2' 7.500 2.800 7.500 4.172 3.816 4.471 . 0 0 "[ . 1 . 2 ]" 1
515 1 6 G H1' 1 9 G H4' 7.500 2.800 7.500 5.026 4.698 5.173 . 0 0 "[ . 1 . 2 ]" 1
516 1 2 A H2 1 26 C H4' 7.500 2.800 7.500 6.461 6.337 6.588 . 0 0 "[ . 1 . 2 ]" 1
517 1 20 A H4' 1 21 C H1' 7.500 2.800 7.500 6.106 6.006 6.195 . 0 0 "[ . 1 . 2 ]" 1
518 1 6 G H3' 1 9 G H2' 7.500 2.800 7.500 7.485 7.318 7.545 0.045 12 0 "[ . 1 . 2 ]" 1
519 1 1 G H1 1 26 C H41 7.500 2.800 7.500 3.106 3.086 3.135 . 0 0 "[ . 1 . 2 ]" 1
520 1 1 G H1 1 2 A H2 7.500 2.800 7.500 6.368 6.189 6.531 . 0 0 "[ . 1 . 2 ]" 1
521 1 2 A H2 1 25 U H3 3.300 . 3.300 2.590 2.571 2.630 . 0 0 "[ . 1 . 2 ]" 1
522 1 2 A H2 1 26 C Q4 7.500 2.800 7.500 6.133 5.924 6.250 . 0 0 "[ . 1 . 2 ]" 1
523 1 1 G Q2 1 2 A H1' 7.500 2.800 7.500 5.640 5.240 6.355 . 0 0 "[ . 1 . 2 ]" 1
524 1 2 A H2 1 3 G H1 5.500 . 5.500 4.922 4.744 5.089 . 0 0 "[ . 1 . 2 ]" 1
525 1 3 G H1 1 23 G H1 5.500 . 5.500 4.386 3.773 4.746 . 0 0 "[ . 1 . 2 ]" 1
526 1 3 G H1 1 4 C H42 5.500 . 5.500 5.493 5.394 5.508 0.008 2 0 "[ . 1 . 2 ]" 1
527 1 3 G H1 1 4 C H5 7.500 2.800 7.500 6.177 6.068 6.291 . 0 0 "[ . 1 . 2 ]" 1
528 1 3 G Q2 1 4 C H1' 5.500 . 5.500 4.398 3.870 4.675 . 0 0 "[ . 1 . 2 ]" 1
529 1 3 G Q2 1 24 C H1' 5.500 . 5.500 4.102 4.038 4.144 . 0 0 "[ . 1 . 2 ]" 1
530 1 3 G H1 1 24 C H5 7.500 2.800 7.500 5.202 5.184 5.221 . 0 0 "[ . 1 . 2 ]" 1
531 1 3 G H1 1 24 C H6 7.500 2.800 7.500 5.696 5.674 5.711 . 0 0 "[ . 1 . 2 ]" 1
532 1 3 G H1 1 24 C Q4 3.300 . 3.300 2.951 2.944 2.962 . 0 0 "[ . 1 . 2 ]" 1
533 1 3 G H1 1 25 U H3 5.500 . 5.500 2.777 2.565 3.024 . 0 0 "[ . 1 . 2 ]" 1
534 1 4 C Q4 1 5 U H5 7.500 2.800 7.500 5.640 5.322 5.778 . 0 0 "[ . 1 . 2 ]" 1
535 1 4 C H1' 1 4 C H42 7.500 2.800 7.500 6.687 6.663 6.696 . 0 0 "[ . 1 . 2 ]" 1
536 1 4 C H42 1 5 U H3 7.500 2.800 7.500 5.821 4.932 6.068 . 0 0 "[ . 1 . 2 ]" 1
537 1 4 C H42 1 23 G H1 5.500 . 5.500 4.209 4.149 4.360 . 0 0 "[ . 1 . 2 ]" 1
538 1 4 C H42 1 24 C H41 5.500 . 5.500 4.271 3.857 4.535 . 0 0 "[ . 1 . 2 ]" 1
539 1 4 C H1' 1 5 U H3 7.500 2.800 7.500 7.470 7.322 7.526 0.026 17 0 "[ . 1 . 2 ]" 1
540 1 5 U H1' 1 5 U H3 5.500 . 5.500 4.647 4.604 4.652 . 0 0 "[ . 1 . 2 ]" 1
541 1 5 U H3 1 21 C Q4 7.500 2.800 7.500 4.398 4.190 4.671 . 0 0 "[ . 1 . 2 ]" 1
542 1 5 U H3 1 22 G H1 3.300 . 3.300 2.564 2.348 2.825 . 0 0 "[ . 1 . 2 ]" 1
543 1 5 U H3 1 22 G Q2 5.500 . 5.500 4.359 4.176 4.720 . 0 0 "[ . 1 . 2 ]" 1
544 1 5 U H5 1 23 G H1 7.500 2.800 7.500 6.369 6.181 6.610 . 0 0 "[ . 1 . 2 ]" 1
545 1 5 U H3 1 5 U H5 7.500 2.800 7.500 4.114 4.098 4.132 . 0 0 "[ . 1 . 2 ]" 1
546 1 6 G H1 1 9 G Q2 7.500 2.800 7.500 6.155 5.733 6.419 . 0 0 "[ . 1 . 2 ]" 1
547 1 6 G Q2 1 21 C H1' 7.500 2.800 7.500 4.249 4.118 4.300 . 0 0 "[ . 1 . 2 ]" 1
548 1 6 G H1' 1 6 G Q2 7.500 2.800 7.500 3.228 3.127 3.446 . 0 0 "[ . 1 . 2 ]" 1
549 1 5 U H3 1 6 G H8 7.500 2.800 7.500 5.768 5.349 5.980 . 0 0 "[ . 1 . 2 ]" 1
550 1 6 G H8 1 22 G H1 7.500 2.800 7.500 6.894 6.410 7.280 . 0 0 "[ . 1 . 2 ]" 1
551 1 6 G H1' 1 22 G Q2 5.500 . 5.500 3.035 2.915 3.293 . 0 0 "[ . 1 . 2 ]" 1
552 1 19 G Q2 1 20 A H1' 5.500 . 5.500 4.460 4.102 4.623 . 0 0 "[ . 1 . 2 ]" 1
553 1 8 A H1' 1 8 A Q6 7.500 2.800 7.500 6.091 6.088 6.097 . 0 0 "[ . 1 . 2 ]" 1
554 1 8 A H1' 1 9 G Q2 7.500 2.800 7.500 6.689 6.665 6.703 . 0 0 "[ . 1 . 2 ]" 1
555 1 10 C H41 1 11 A Q6 5.500 . 5.500 2.880 2.665 3.687 . 0 0 "[ . 1 . 2 ]" 1
556 1 10 C H41 1 19 G H1 3.300 . 3.300 2.825 2.798 2.870 . 0 0 "[ . 1 . 2 ]" 1
557 1 10 C H41 1 20 A H2 7.500 2.800 7.500 7.186 6.974 7.237 . 0 0 "[ . 1 . 2 ]" 1
558 1 10 C H42 1 11 A Q6 7.500 2.800 7.500 3.302 3.094 4.066 . 0 0 "[ . 1 . 2 ]" 1
559 1 10 C H42 1 19 G H1 5.500 . 5.500 4.260 4.240 4.282 . 0 0 "[ . 1 . 2 ]" 1
560 1 11 A H2 1 12 C Q4 7.500 2.800 7.500 5.870 5.732 5.924 . 0 0 "[ . 1 . 2 ]" 1
561 1 11 A H2 1 17 G H1 5.500 . 5.500 4.861 4.773 5.083 . 0 0 "[ . 1 . 2 ]" 1
562 1 11 A H2 1 18 U H3 3.300 . 3.300 2.600 2.559 2.794 . 0 0 "[ . 1 . 2 ]" 1
563 1 11 A H2 1 19 G H1 5.500 . 5.500 5.516 5.480 5.565 0.065 1 0 "[ . 1 . 2 ]" 1
564 1 11 A H2 1 19 G Q2 7.500 2.800 7.500 4.514 4.444 4.596 . 0 0 "[ . 1 . 2 ]" 1
565 1 11 A H8 1 19 G H1 7.500 2.800 7.500 6.024 5.935 6.099 . 0 0 "[ . 1 . 2 ]" 1
566 1 11 A Q6 1 12 C H41 5.500 . 5.500 2.987 2.421 3.115 . 0 0 "[ . 1 . 2 ]" 1
567 1 12 C H41 1 17 G H1 3.300 . 3.300 3.080 2.967 3.142 . 0 0 "[ . 1 . 2 ]" 1
568 1 12 C H6 1 17 G H1 7.500 2.800 7.500 5.702 5.691 5.726 . 0 0 "[ . 1 . 2 ]" 1
569 1 13 G H1' 1 15 A Q6 5.500 . 5.500 3.847 3.663 3.949 . 0 0 "[ . 1 . 2 ]" 1
570 1 13 G H1' 1 16 A Q6 5.500 . 5.500 2.306 2.239 2.406 . 0 0 "[ . 1 . 2 ]" 1
571 1 14 A Q6 1 15 A Q6 7.500 2.800 7.500 3.588 3.463 3.713 . 0 0 "[ . 1 . 2 ]" 1
572 1 14 A Q6 1 15 A H2 5.500 . 5.500 4.219 3.984 4.287 . 0 0 "[ . 1 . 2 ]" 1
573 1 13 G Q2 1 15 A H8 5.500 . 5.500 4.911 4.901 4.924 . 0 0 "[ . 1 . 2 ]" 1
574 1 15 A Q6 1 16 A H2 7.500 2.800 7.500 2.577 2.490 2.648 0.310 21 0 "[ . 1 . 2 ]" 1
575 1 13 G H1 1 16 A H8 7.500 2.800 7.500 6.227 6.109 6.357 . 0 0 "[ . 1 . 2 ]" 1
576 1 13 G Q2 1 16 A H8 7.500 2.800 7.500 2.957 2.818 3.107 . 0 0 "[ . 1 . 2 ]" 1
577 1 11 A Q6 1 17 G H1 7.500 2.800 7.500 3.918 3.365 4.067 . 0 0 "[ . 1 . 2 ]" 1
578 1 12 C H5 1 17 G H1 7.500 2.800 7.500 5.242 5.225 5.293 . 0 0 "[ . 1 . 2 ]" 1
579 1 13 G H1 1 17 G H1 7.500 2.800 7.500 4.927 4.788 5.066 . 0 0 "[ . 1 . 2 ]" 1
580 1 16 A H8 1 17 G H1 7.500 2.800 7.500 7.381 6.940 7.520 0.020 11 0 "[ . 1 . 2 ]" 1
581 1 12 C H1' 1 17 G Q2 5.500 . 5.500 3.821 3.798 3.909 . 0 0 "[ . 1 . 2 ]" 1
582 1 13 G H1' 1 17 G Q2 5.500 . 5.500 4.494 4.391 4.622 . 0 0 "[ . 1 . 2 ]" 1
583 1 17 G Q2 1 18 U H1' 5.500 . 5.500 4.864 4.737 4.907 . 0 0 "[ . 1 . 2 ]" 1
584 1 17 G H1 1 18 U H3 5.500 . 5.500 3.803 3.504 3.904 . 0 0 "[ . 1 . 2 ]" 1
585 1 10 C H41 1 18 U H3 7.500 2.800 7.500 5.120 4.966 5.617 . 0 0 "[ . 1 . 2 ]" 1
586 1 10 C H42 1 18 U H3 7.500 2.800 7.500 6.435 6.284 6.840 . 0 0 "[ . 1 . 2 ]" 1
587 1 11 A Q6 1 18 U H3 3.300 . 3.300 2.746 2.556 2.794 . 0 0 "[ . 1 . 2 ]" 1
588 1 17 G H8 1 18 U H3 7.500 2.800 7.500 7.187 6.902 7.353 . 0 0 "[ . 1 . 2 ]" 1
589 1 18 U H1' 1 18 U H3 7.500 2.800 7.500 4.649 4.597 4.653 . 0 0 "[ . 1 . 2 ]" 1
590 1 18 U H3 1 19 G H1 7.500 2.800 7.500 5.505 5.408 5.768 . 0 0 "[ . 1 . 2 ]" 1
591 1 9 G Q2 1 19 G H1 7.500 2.800 7.500 6.065 5.941 6.193 . 0 0 "[ . 1 . 2 ]" 1
592 1 10 C H5 1 19 G H1 7.500 2.800 7.500 5.129 5.115 5.158 . 0 0 "[ . 1 . 2 ]" 1
593 1 10 C H6 1 19 G H1 7.500 2.800 7.500 5.670 5.643 5.699 . 0 0 "[ . 1 . 2 ]" 1
594 1 10 C H1' 1 19 G Q2 5.500 . 5.500 4.219 4.125 4.259 . 0 0 "[ . 1 . 2 ]" 1
595 1 11 A H1' 1 19 G Q2 5.500 . 5.500 4.242 4.155 4.426 . 0 0 "[ . 1 . 2 ]" 1
596 1 11 A Q6 1 19 G H1 7.500 2.800 7.500 4.236 4.113 4.691 . 0 0 "[ . 1 . 2 ]" 1
597 1 18 U H3 1 19 G H8 7.500 2.800 7.500 5.414 5.327 5.493 . 0 0 "[ . 1 . 2 ]" 1
598 1 18 U H3 1 19 G H1' 5.500 . 5.500 5.421 5.312 5.561 0.061 1 0 "[ . 1 . 2 ]" 1
599 1 19 G H1' 1 19 G Q2 5.500 . 5.500 4.550 4.529 4.589 . 0 0 "[ . 1 . 2 ]" 1
600 1 10 C Q4 1 20 A H2 7.500 2.800 7.500 6.694 6.514 6.718 . 0 0 "[ . 1 . 2 ]" 1
601 1 9 G Q2 1 20 A H2 3.300 . 3.300 1.890 1.863 1.934 . 0 0 "[ . 1 . 2 ]" 1
602 1 19 G H1 1 20 A H2 5.500 . 5.500 5.087 4.965 5.196 . 0 0 "[ . 1 . 2 ]" 1
603 1 19 G Q2 1 20 A H2 7.500 2.800 7.500 4.630 4.399 4.818 . 0 0 "[ . 1 . 2 ]" 1
604 1 6 G H1 1 21 C H41 5.500 . 5.500 3.005 2.909 3.104 . 0 0 "[ . 1 . 2 ]" 1
605 1 6 G H1 1 21 C H42 5.500 . 5.500 4.461 4.384 4.546 . 0 0 "[ . 1 . 2 ]" 1
606 1 5 U H5 1 21 C H42 7.500 2.800 7.500 6.475 6.194 7.498 . 0 0 "[ . 1 . 2 ]" 1
607 1 20 A H2 1 21 C H42 7.500 2.800 7.500 5.505 5.263 5.592 . 0 0 "[ . 1 . 2 ]" 1
608 1 21 C Q4 1 21 C H5 7.500 2.800 7.500 2.372 2.369 2.373 0.431 5 0 "[ . 1 . 2 ]" 1
609 1 6 G H1 1 22 G H1 7.500 2.800 7.500 4.669 4.411 5.058 . 0 0 "[ . 1 . 2 ]" 1
610 1 21 C H41 1 22 G H1 7.500 2.800 7.500 6.831 6.468 7.256 . 0 0 "[ . 1 . 2 ]" 1
611 1 4 C H42 1 22 G H1 7.500 2.800 7.500 6.703 6.684 6.718 . 0 0 "[ . 1 . 2 ]" 1
612 1 22 G H1 1 23 G H8 7.500 2.800 7.500 5.686 5.564 5.788 . 0 0 "[ . 1 . 2 ]" 1
613 1 5 U H2' 1 22 G Q2 7.500 2.800 7.500 4.694 4.471 4.954 . 0 0 "[ . 1 . 2 ]" 1
614 1 22 G Q2 1 23 G H8 7.500 2.800 7.500 5.273 5.183 5.407 . 0 0 "[ . 1 . 2 ]" 1
615 1 21 C Q4 1 22 G H8 7.500 2.800 7.500 6.690 6.585 6.717 . 0 0 "[ . 1 . 2 ]" 1
616 1 22 G H1' 1 22 G Q2 7.500 2.800 7.500 4.709 4.659 4.725 . 0 0 "[ . 1 . 2 ]" 1
617 1 5 U H1' 1 22 G Q2 5.500 . 5.500 2.982 2.872 3.217 . 0 0 "[ . 1 . 2 ]" 1
618 1 4 C H5 1 23 G H1 7.500 2.800 7.500 5.142 5.101 5.215 . 0 0 "[ . 1 . 2 ]" 1
619 1 4 C H6 1 23 G H1 7.500 2.800 7.500 5.747 5.722 5.775 . 0 0 "[ . 1 . 2 ]" 1
620 1 5 U H1' 1 23 G Q2 5.500 . 5.500 3.315 3.053 3.565 . 0 0 "[ . 1 . 2 ]" 1
621 1 5 U H3 1 23 G H1 5.500 . 5.500 4.484 4.250 4.780 . 0 0 "[ . 1 . 2 ]" 1
622 1 5 U H6 1 23 G H1 7.500 2.800 7.500 6.256 6.075 6.501 . 0 0 "[ . 1 . 2 ]" 1
623 1 22 G H1 1 23 G H1 7.500 2.800 7.500 4.152 3.807 4.702 . 0 0 "[ . 1 . 2 ]" 1
624 1 23 G H1 1 24 C H41 5.500 . 5.500 4.060 3.666 4.568 . 0 0 "[ . 1 . 2 ]" 1
625 1 23 G H1 1 24 C H42 7.500 2.800 7.500 4.879 4.443 5.347 . 0 0 "[ . 1 . 2 ]" 1
626 1 4 C H1' 1 23 G Q2 5.500 . 5.500 4.117 4.064 4.160 . 0 0 "[ . 1 . 2 ]" 1
627 1 23 G Q2 1 24 C H1' 5.500 . 5.500 3.771 3.459 4.125 . 0 0 "[ . 1 . 2 ]" 1
628 1 5 U H3 1 23 G H8 7.500 2.800 7.500 7.287 7.078 7.471 . 0 0 "[ . 1 . 2 ]" 1
629 1 24 C H41 1 25 U H5 7.500 2.800 7.500 5.402 5.179 5.599 . 0 0 "[ . 1 . 2 ]" 1
630 1 24 C H42 1 25 U H5 7.500 2.800 7.500 5.451 5.218 5.711 . 0 0 "[ . 1 . 2 ]" 1
631 1 1 G H1 1 25 U H3 7.500 2.800 7.500 6.315 6.224 6.467 . 0 0 "[ . 1 . 2 ]" 1
632 1 2 A Q6 1 25 U H3 5.500 . 5.500 2.799 2.764 2.819 . 0 0 "[ . 1 . 2 ]" 1
633 1 24 C Q4 1 25 U H3 7.500 2.800 7.500 4.677 4.521 4.871 . 0 0 "[ . 1 . 2 ]" 1
634 1 25 U H3 1 26 C H41 5.500 . 5.500 5.503 5.455 5.511 0.011 13 0 "[ . 1 . 2 ]" 1
635 1 25 U H3 1 26 C H42 5.500 . 5.500 5.240 5.189 5.300 . 0 0 "[ . 1 . 2 ]" 1
636 1 25 U H3 1 26 C H5 7.500 2.800 7.500 4.692 4.592 4.922 . 0 0 "[ . 1 . 2 ]" 1
637 1 25 U H3 1 26 C H6 7.500 2.800 7.500 4.879 4.792 5.226 . 0 0 "[ . 1 . 2 ]" 1
638 1 3 G H1 1 25 U H6 7.500 2.800 7.500 5.227 5.089 5.383 . 0 0 "[ . 1 . 2 ]" 1
639 1 25 U H6 1 26 C Q4 7.500 2.800 7.500 5.191 5.108 5.313 . 0 0 "[ . 1 . 2 ]" 1
640 1 25 U H1' 1 25 U H3 7.500 2.800 7.500 4.651 4.601 4.656 . 0 0 "[ . 1 . 2 ]" 1
641 1 3 G Q2 1 25 U H1' 5.500 . 5.500 3.248 2.922 3.525 . 0 0 "[ . 1 . 2 ]" 1
642 1 1 G H1 1 26 C H42 7.500 2.800 7.500 4.537 4.518 4.553 . 0 0 "[ . 1 . 2 ]" 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 63
_Distance_constraint_stats_list.Viol_count 172
_Distance_constraint_stats_list.Viol_total 549.422
_Distance_constraint_stats_list.Viol_max 1.182
_Distance_constraint_stats_list.Viol_rms 0.1338
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0198
_Distance_constraint_stats_list.Viol_average_violations_only 0.1521
_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 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 2 A 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 3 G 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 4 C 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 5 U 0.017 0.009 8 0 "[ . 1 . 2 ]"
1 6 G 0.079 0.024 1 0 "[ . 1 . 2 ]"
1 7 C 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 8 A 0.028 0.009 12 0 "[ . 1 . 2 ]"
1 9 G 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 10 C 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 11 A 0.652 0.048 6 0 "[ . 1 . 2 ]"
1 12 C 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 13 G 0.662 0.034 18 0 "[ . 1 . 2 ]"
1 14 A 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 15 A 22.441 1.182 15 21 [**************+*-****]
1 16 A 0.847 0.059 15 0 "[ . 1 . 2 ]"
1 17 G 0.539 0.033 12 0 "[ . 1 . 2 ]"
1 18 U 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 19 G 0.897 0.059 5 0 "[ . 1 . 2 ]"
1 20 A 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 21 C 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 22 G 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 23 G 0.001 0.001 19 0 "[ . 1 . 2 ]"
2 1 MG 23.950 1.182 15 21 [**************+*-****]
3 1 MG 2.088 0.059 5 0 "[ . 1 . 2 ]"
4 1 MG 0.107 0.024 1 0 "[ . 1 . 2 ]"
5 1 MG 0.018 0.009 8 0 "[ . 1 . 2 ]"
6 1 MG 0.000 0.000 . 0 "[ . 1 . 2 ]"
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 15 A OP2 2 1 MG MG 2.000 . 2.200 3.269 3.087 3.382 1.182 15 21 [**************+*-****] 2
2 1 14 A H3' 2 1 MG MG 8.000 . 8.000 5.404 5.239 5.479 . 0 0 "[ . 1 . 2 ]" 2
3 1 14 A Q5' 2 1 MG MG 8.000 . 8.000 6.049 5.918 6.111 . 0 0 "[ . 1 . 2 ]" 2
4 1 15 A N7 2 1 MG MG 8.000 . 8.000 6.690 6.457 6.917 . 0 0 "[ . 1 . 2 ]" 2
5 1 16 A H3' 2 1 MG MG 8.000 . 8.000 8.040 8.006 8.059 0.059 15 0 "[ . 1 . 2 ]" 2
6 1 16 A N9 2 1 MG MG 8.000 . 8.000 7.195 7.078 7.397 . 0 0 "[ . 1 . 2 ]" 2
7 1 15 A N9 2 1 MG MG 8.000 . 8.000 6.578 6.415 6.703 . 0 0 "[ . 1 . 2 ]" 2
8 1 12 C H6 2 1 MG MG 10.000 . 10.000 8.636 8.349 8.796 . 0 0 "[ . 1 . 2 ]" 2
9 1 12 C H5 2 1 MG MG 10.000 . 10.000 6.955 6.626 7.143 . 0 0 "[ . 1 . 2 ]" 2
10 1 17 G H8 2 1 MG MG 10.000 . 10.000 6.334 6.260 6.621 . 0 0 "[ . 1 . 2 ]" 2
11 1 17 G H1 2 1 MG MG 10.000 . 10.000 6.122 5.963 6.330 . 0 0 "[ . 1 . 2 ]" 2
12 1 12 C H42 2 1 MG MG 10.000 . 10.000 5.077 4.726 5.271 . 0 0 "[ . 1 . 2 ]" 2
13 1 17 G Q5' 2 1 MG MG 10.000 . 10.000 7.493 7.428 7.840 . 0 0 "[ . 1 . 2 ]" 2
14 1 19 G H8 3 1 MG MG 8.000 . 8.000 8.043 8.025 8.059 0.059 5 0 "[ . 1 . 2 ]" 2
15 1 11 A N9 3 1 MG MG 8.000 . 8.000 7.978 7.910 8.044 0.044 1 0 "[ . 1 . 2 ]" 2
16 1 11 A H8 3 1 MG MG 8.000 . 8.000 8.028 7.997 8.048 0.048 6 0 "[ . 1 . 2 ]" 2
17 1 17 G H3' 3 1 MG MG 8.000 . 8.000 8.026 8.014 8.033 0.033 12 0 "[ . 1 . 2 ]" 2
18 1 18 U H3 3 1 MG MG 8.000 . 8.000 5.425 5.264 5.656 . 0 0 "[ . 1 . 2 ]" 2
19 1 9 G H8 3 1 MG MG 10.000 . 10.000 7.694 7.168 7.933 . 0 0 "[ . 1 . 2 ]" 2
20 1 20 A N7 3 1 MG MG 10.000 . 10.000 7.000 6.377 7.501 . 0 0 "[ . 1 . 2 ]" 2
21 1 6 G H2' 4 1 MG MG 8.000 . 8.000 7.955 7.720 8.024 0.024 1 0 "[ . 1 . 2 ]" 2
22 1 8 A H8 4 1 MG MG 8.000 . 8.000 7.604 7.182 7.755 . 0 0 "[ . 1 . 2 ]" 2
23 1 8 A H3' 4 1 MG MG 8.000 . 8.000 3.542 3.268 3.674 . 0 0 "[ . 1 . 2 ]" 2
24 1 8 A H4' 4 1 MG MG 8.000 . 8.000 4.926 4.690 5.137 . 0 0 "[ . 1 . 2 ]" 2
25 1 8 A N9 4 1 MG MG 8.000 . 8.000 7.936 7.638 8.009 0.009 12 0 "[ . 1 . 2 ]" 2
26 1 6 G H8 4 1 MG MG 10.000 . 10.000 8.639 8.339 8.817 . 0 0 "[ . 1 . 2 ]" 2
27 1 20 A N7 5 1 MG MG 8.000 . 8.000 7.288 6.492 7.902 . 0 0 "[ . 1 . 2 ]" 2
28 1 5 U H5 5 1 MG MG 8.000 . 8.000 7.800 7.414 8.009 0.009 8 0 "[ . 1 . 2 ]" 2
29 1 3 G N9 5 1 MG MG 10.000 . 10.000 7.520 6.540 8.215 . 0 0 "[ . 1 . 2 ]" 2
30 1 21 C H5 5 1 MG MG 10.000 . 10.000 5.108 4.360 5.686 . 0 0 "[ . 1 . 2 ]" 2
31 1 4 C H41 5 1 MG MG 10.000 . 10.000 3.917 3.363 4.346 . 0 0 "[ . 1 . 2 ]" 2
32 1 2 A N7 6 1 MG MG 8.000 . 8.000 5.055 3.619 6.470 . 0 0 "[ . 1 . 2 ]" 2
33 1 2 A H8 6 1 MG MG 8.000 . 8.000 6.179 4.608 7.788 . 0 0 "[ . 1 . 2 ]" 2
34 1 15 A OP1 2 1 MG MG 7.000 . 7.000 2.370 2.347 2.372 . 0 0 "[ . 1 . 2 ]" 2
35 1 13 G H1 2 1 MG MG 7.000 . 7.000 3.938 3.909 3.998 . 0 0 "[ . 1 . 2 ]" 2
36 1 13 G N1 2 1 MG MG 7.000 . 7.000 3.784 3.762 3.847 . 0 0 "[ . 1 . 2 ]" 2
37 1 13 G H8 2 1 MG MG 7.000 . 7.000 7.002 6.963 7.021 0.021 1 0 "[ . 1 . 2 ]" 2
38 1 13 G C8 2 1 MG MG 7.000 . 7.000 6.098 6.058 6.127 . 0 0 "[ . 1 . 2 ]" 2
39 1 13 G H3' 2 1 MG MG 7.000 . 7.000 6.994 6.948 7.012 0.012 14 0 "[ . 1 . 2 ]" 2
40 1 13 G C3' 2 1 MG MG 7.000 . 7.000 7.022 6.979 7.034 0.034 18 0 "[ . 1 . 2 ]" 2
41 1 16 A N7 2 1 MG MG 7.000 . 7.000 5.420 5.293 5.676 . 0 0 "[ . 1 . 2 ]" 2
42 1 11 A N7 3 1 MG MG 7.000 . 7.000 6.084 6.046 6.145 . 0 0 "[ . 1 . 2 ]" 2
43 1 18 U H5 3 1 MG MG 7.000 . 7.000 4.738 4.558 5.079 . 0 0 "[ . 1 . 2 ]" 2
44 1 18 U C5 3 1 MG MG 7.000 . 7.000 5.054 4.870 5.373 . 0 0 "[ . 1 . 2 ]" 2
45 1 10 C Q4 3 1 MG MG 7.000 . 7.000 2.612 2.537 2.795 . 0 0 "[ . 1 . 2 ]" 2
46 1 10 C N4 3 1 MG MG 7.000 . 7.000 3.285 3.217 3.486 . 0 0 "[ . 1 . 2 ]" 2
47 1 9 G OP2 4 1 MG MG 7.000 . 7.000 2.367 2.330 2.370 . 0 0 "[ . 1 . 2 ]" 2
48 1 8 A OP1 4 1 MG MG 7.000 . 7.000 6.478 6.067 6.998 . 0 0 "[ . 1 . 2 ]" 2
49 1 8 A OP2 4 1 MG MG 7.000 . 7.000 4.347 3.970 5.067 . 0 0 "[ . 1 . 2 ]" 2
50 1 7 C OP1 4 1 MG MG 7.000 . 7.000 3.837 3.582 4.115 . 0 0 "[ . 1 . 2 ]" 2
51 1 7 C OP2 4 1 MG MG 7.000 . 7.000 4.660 4.216 5.145 . 0 0 "[ . 1 . 2 ]" 2
52 1 23 G N7 5 1 MG MG 7.000 . 7.000 5.149 4.717 5.391 . 0 0 "[ . 1 . 2 ]" 2
53 1 23 G H8 5 1 MG MG 7.000 . 7.000 6.786 6.357 7.001 0.001 19 0 "[ . 1 . 2 ]" 2
54 1 23 G C8 5 1 MG MG 7.000 . 7.000 6.339 5.899 6.560 . 0 0 "[ . 1 . 2 ]" 2
55 1 22 G H8 5 1 MG MG 7.000 . 7.000 5.031 4.651 5.528 . 0 0 "[ . 1 . 2 ]" 2
56 1 22 G C8 5 1 MG MG 7.000 . 7.000 4.939 4.555 5.391 . 0 0 "[ . 1 . 2 ]" 2
57 1 5 U H3 5 1 MG MG 7.000 . 7.000 5.584 5.232 5.810 . 0 0 "[ . 1 . 2 ]" 2
58 1 5 U N3 5 1 MG MG 7.000 . 7.000 6.252 5.899 6.481 . 0 0 "[ . 1 . 2 ]" 2
59 1 6 G H1 5 1 MG MG 7.000 . 7.000 5.053 4.674 5.617 . 0 0 "[ . 1 . 2 ]" 2
60 1 6 G N1 5 1 MG MG 7.000 . 7.000 5.950 5.573 6.467 . 0 0 "[ . 1 . 2 ]" 2
61 1 3 G N7 6 1 MG MG 7.000 . 7.000 5.817 4.496 6.876 . 0 0 "[ . 1 . 2 ]" 2
62 1 1 G H8 6 1 MG MG 7.000 . 7.000 5.413 4.114 6.105 . 0 0 "[ . 1 . 2 ]" 2
63 1 1 G C8 6 1 MG MG 7.000 . 7.000 5.568 4.125 6.310 . 0 0 "[ . 1 . 2 ]" 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 21
_Distance_constraint_stats_list.Viol_count 26
_Distance_constraint_stats_list.Viol_total 4.852
_Distance_constraint_stats_list.Viol_max 0.018
_Distance_constraint_stats_list.Viol_rms 0.0024
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0005
_Distance_constraint_stats_list.Viol_average_violations_only 0.0089
_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 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 2 A 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 3 G 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 4 C 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 6 G 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 8 A 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 9 G 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 10 C 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 11 A 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 12 C 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 14 A 0.218 0.018 17 0 "[ . 1 . 2 ]"
1 15 A 0.008 0.005 15 0 "[ . 1 . 2 ]"
1 16 A 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 17 G 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 19 G 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 20 A 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 22 G 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 23 G 0.004 0.004 17 0 "[ . 1 . 2 ]"
1 24 C 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 25 U 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 26 C 0.000 0.000 . 0 "[ . 1 . 2 ]"
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 3.800 3.600 4.000 3.712 3.688 3.760 . 0 0 "[ . 1 . 2 ]" 3
2 1 2 A H1' 1 2 A H8 3.800 3.600 4.000 3.713 3.698 3.727 . 0 0 "[ . 1 . 2 ]" 3
3 1 3 G H1' 1 3 G H8 3.800 3.600 4.000 3.729 3.709 3.751 . 0 0 "[ . 1 . 2 ]" 3
4 1 4 C H1' 1 4 C H6 3.600 3.400 3.800 3.660 3.645 3.671 . 0 0 "[ . 1 . 2 ]" 3
5 1 6 G H1' 1 6 G H8 3.800 3.600 4.000 3.805 3.799 3.807 . 0 0 "[ . 1 . 2 ]" 3
6 1 8 A H1' 1 8 A H8 3.800 3.600 4.000 3.789 3.755 3.809 . 0 0 "[ . 1 . 2 ]" 3
7 1 9 G H1' 1 9 G H8 3.800 3.600 4.000 3.752 3.724 3.780 . 0 0 "[ . 1 . 2 ]" 3
8 1 10 C H1' 1 10 C H6 3.600 3.400 3.800 3.549 3.526 3.575 . 0 0 "[ . 1 . 2 ]" 3
9 1 11 A H1' 1 11 A H8 3.800 3.600 4.000 3.786 3.780 3.790 . 0 0 "[ . 1 . 2 ]" 3
10 1 12 C H1' 1 12 C H6 3.600 3.400 3.800 3.599 3.589 3.625 . 0 0 "[ . 1 . 2 ]" 3
11 1 14 A H1' 1 14 A H8 3.800 3.600 4.000 3.590 3.582 3.601 0.018 17 0 "[ . 1 . 2 ]" 3
12 1 15 A H1' 1 15 A H8 3.800 3.600 4.000 3.603 3.595 3.621 0.005 15 0 "[ . 1 . 2 ]" 3
13 1 16 A H1' 1 16 A H8 3.800 3.600 4.000 3.737 3.726 3.758 . 0 0 "[ . 1 . 2 ]" 3
14 1 17 G H1' 1 17 G H8 3.800 3.600 4.000 3.733 3.721 3.737 . 0 0 "[ . 1 . 2 ]" 3
15 1 19 G H1' 1 19 G H8 3.800 3.600 4.000 3.720 3.697 3.730 . 0 0 "[ . 1 . 2 ]" 3
16 1 20 A H1' 1 20 A H8 3.800 3.600 4.000 3.748 3.732 3.756 . 0 0 "[ . 1 . 2 ]" 3
17 1 22 G H1' 1 22 G H8 3.800 3.300 4.000 3.615 3.603 3.653 . 0 0 "[ . 1 . 2 ]" 3
18 1 23 G H1' 1 23 G H8 3.800 3.600 4.000 3.642 3.596 3.678 0.004 17 0 "[ . 1 . 2 ]" 3
19 1 24 C H1' 1 24 C H6 3.600 3.400 3.800 3.635 3.619 3.650 . 0 0 "[ . 1 . 2 ]" 3
20 1 25 U H1' 1 25 U H6 3.600 3.400 3.800 3.670 3.657 3.683 . 0 0 "[ . 1 . 2 ]" 3
21 1 26 C H1' 1 26 C H6 3.600 3.400 3.800 3.534 3.518 3.542 . 0 0 "[ . 1 . 2 ]" 3
stop_
save_
save_distance_constraint_statistics_4
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 4
_Distance_constraint_stats_list.Constraint_count 291
_Distance_constraint_stats_list.Viol_count 171
_Distance_constraint_stats_list.Viol_total 104.798
_Distance_constraint_stats_list.Viol_max 0.098
_Distance_constraint_stats_list.Viol_rms 0.0065
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0008
_Distance_constraint_stats_list.Viol_average_violations_only 0.0292
_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 0.031 0.012 17 0 "[ . 1 . 2 ]"
1 2 A 0.305 0.026 11 0 "[ . 1 . 2 ]"
1 3 G 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 4 C 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 5 U 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 6 G 0.015 0.015 17 0 "[ . 1 . 2 ]"
1 7 C 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 8 A 0.256 0.022 3 0 "[ . 1 . 2 ]"
1 9 G 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 10 C 1.127 0.092 16 0 "[ . 1 . 2 ]"
1 11 A 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 12 C 0.287 0.031 15 0 "[ . 1 . 2 ]"
1 13 G 0.287 0.031 15 0 "[ . 1 . 2 ]"
1 14 A 0.148 0.014 20 0 "[ . 1 . 2 ]"
1 15 A 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 16 A 2.246 0.098 18 0 "[ . 1 . 2 ]"
1 17 G 2.246 0.098 18 0 "[ . 1 . 2 ]"
1 18 U 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 19 G 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 20 A 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 21 C 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 22 G 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 23 G 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 24 C 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 25 U 0.606 0.050 6 0 "[ . 1 . 2 ]"
1 26 C 0.000 0.000 . 0 "[ . 1 . 2 ]"
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 H3' 1 1 G H8 2.800 . 3.800 2.778 2.488 2.907 . 0 0 "[ . 1 . 2 ]" 4
2 1 2 A H3' 1 2 A H8 2.800 . 3.800 2.738 2.682 2.785 . 0 0 "[ . 1 . 2 ]" 4
3 1 3 G H3' 1 3 G H8 2.800 . 3.800 3.006 2.800 3.192 . 0 0 "[ . 1 . 2 ]" 4
4 1 4 C H3' 1 4 C H6 3.000 2.400 3.600 2.808 2.690 2.946 . 0 0 "[ . 1 . 2 ]" 4
5 1 10 C H3' 1 10 C H6 3.000 2.400 3.600 2.979 2.908 3.075 . 0 0 "[ . 1 . 2 ]" 4
6 1 14 A H3' 1 14 A H8 2.800 . 3.800 3.241 3.172 3.299 . 0 0 "[ . 1 . 2 ]" 4
7 1 15 A H3' 1 15 A H8 2.800 . 3.800 3.406 3.360 3.460 . 0 0 "[ . 1 . 2 ]" 4
8 1 16 A H3' 1 16 A H8 2.400 . 3.000 2.648 2.349 2.727 . 0 0 "[ . 1 . 2 ]" 4
9 1 20 A H3' 1 20 A H8 2.800 . 3.800 2.989 2.943 3.077 . 0 0 "[ . 1 . 2 ]" 4
10 1 22 G H3' 1 22 G H8 2.800 . 3.800 3.052 2.860 3.181 . 0 0 "[ . 1 . 2 ]" 4
11 1 23 G H3' 1 23 G H8 2.800 . 3.800 3.161 2.980 3.301 . 0 0 "[ . 1 . 2 ]" 4
12 1 24 C H3' 1 24 C H6 3.000 2.400 3.600 2.883 2.684 3.255 . 0 0 "[ . 1 . 2 ]" 4
13 1 25 U H3' 1 25 U H6 3.000 2.400 3.600 2.371 2.350 2.388 0.050 6 0 "[ . 1 . 2 ]" 4
14 1 26 C H3' 1 26 C H6 3.000 2.400 3.600 3.225 3.182 3.268 . 0 0 "[ . 1 . 2 ]" 4
15 1 1 G H1' 1 1 G H5' 5.000 2.500 7.000 4.737 4.639 4.788 . 0 0 "[ . 1 . 2 ]" 4
16 1 1 G H1' 1 1 G H5'' 5.000 3.600 7.000 5.228 5.217 5.243 . 0 0 "[ . 1 . 2 ]" 4
17 1 1 G H1' 1 2 A H5' 5.000 3.600 7.000 5.398 5.226 5.453 . 0 0 "[ . 1 . 2 ]" 4
18 1 1 G H1' 1 2 A H5'' 5.000 3.600 7.000 6.956 6.800 7.012 0.012 17 0 "[ . 1 . 2 ]" 4
19 1 1 G H2' 1 1 G H5' 5.000 3.600 7.000 5.310 5.231 5.343 . 0 0 "[ . 1 . 2 ]" 4
20 1 1 G H2' 1 1 G H5'' 5.000 3.600 7.000 4.909 4.840 5.048 . 0 0 "[ . 1 . 2 ]" 4
21 1 1 G H5' 1 2 A H1' 5.000 4.000 40.000 10.247 10.107 10.341 . 0 0 "[ . 1 . 2 ]" 4
22 1 1 G H5'' 1 2 A H1' 5.000 4.000 40.000 9.465 9.332 9.654 . 0 0 "[ . 1 . 2 ]" 4
23 1 2 A H1' 1 2 A H5' 5.000 3.600 7.000 4.708 4.677 4.761 . 0 0 "[ . 1 . 2 ]" 4
24 1 2 A H1' 1 2 A H5'' 5.000 3.600 7.000 5.231 5.221 5.241 . 0 0 "[ . 1 . 2 ]" 4
25 1 2 A H1' 1 3 G H5' 5.000 4.000 40.000 4.826 4.269 5.095 . 0 0 "[ . 1 . 2 ]" 4
26 1 2 A H1' 1 3 G H5'' 5.000 4.000 40.000 6.481 6.028 6.719 . 0 0 "[ . 1 . 2 ]" 4
27 1 1 G H5' 1 2 A H2' 5.000 3.600 40.000 10.478 10.343 10.631 . 0 0 "[ . 1 . 2 ]" 4
28 1 1 G H5'' 1 2 A H2' 5.000 3.600 40.000 9.358 9.134 9.633 . 0 0 "[ . 1 . 2 ]" 4
29 1 2 A H2' 1 2 A H5' 5.000 3.600 40.000 5.303 5.281 5.335 . 0 0 "[ . 1 . 2 ]" 4
30 1 2 A H2' 1 2 A H5'' 5.000 3.600 40.000 4.957 4.900 4.991 . 0 0 "[ . 1 . 2 ]" 4
31 1 2 A H5' 1 3 G H1' 5.000 4.000 40.000 9.278 9.149 9.375 . 0 0 "[ . 1 . 2 ]" 4
32 1 2 A H5'' 1 3 G H1' 5.000 4.000 40.000 8.901 8.797 9.096 . 0 0 "[ . 1 . 2 ]" 4
33 1 3 G H1' 1 3 G H5' 5.000 4.000 40.000 4.660 4.589 4.731 . 0 0 "[ . 1 . 2 ]" 4
34 1 3 G H1' 1 3 G H5'' 5.000 3.600 7.000 5.105 5.060 5.165 . 0 0 "[ . 1 . 2 ]" 4
35 1 3 G H1' 1 4 C H5' 5.000 3.600 7.000 5.132 4.951 5.274 . 0 0 "[ . 1 . 2 ]" 4
36 1 3 G H1' 1 4 C H5'' 5.000 3.600 7.000 6.751 6.601 6.863 . 0 0 "[ . 1 . 2 ]" 4
37 1 3 G H5' 1 4 C H1' 5.000 3.600 40.000 9.451 9.269 9.548 . 0 0 "[ . 1 . 2 ]" 4
38 1 3 G H5'' 1 4 C H1' 5.000 3.600 40.000 8.872 8.701 8.994 . 0 0 "[ . 1 . 2 ]" 4
39 1 4 C H1' 1 4 C H5' 5.000 3.600 40.000 4.660 4.621 4.693 . 0 0 "[ . 1 . 2 ]" 4
40 1 4 C H1' 1 4 C H5'' 5.000 3.600 40.000 5.097 5.057 5.130 . 0 0 "[ . 1 . 2 ]" 4
41 1 4 C H1' 1 5 U H5' 5.000 3.600 40.000 5.028 4.797 5.204 . 0 0 "[ . 1 . 2 ]" 4
42 1 4 C H1' 1 5 U H5'' 5.000 3.600 40.000 6.553 6.348 6.705 . 0 0 "[ . 1 . 2 ]" 4
43 1 4 C H2' 1 4 C H5' 5.000 4.000 40.000 5.324 5.314 5.332 . 0 0 "[ . 1 . 2 ]" 4
44 1 4 C H5' 1 5 U H1' 5.000 2.500 40.000 9.139 9.068 9.215 . 0 0 "[ . 1 . 2 ]" 4
45 1 4 C H5'' 1 5 U H1' 5.000 2.500 40.000 8.697 8.637 8.746 . 0 0 "[ . 1 . 2 ]" 4
46 1 5 U H1' 1 5 U H5' 5.000 2.500 7.000 4.835 4.759 4.855 . 0 0 "[ . 1 . 2 ]" 4
47 1 5 U H1' 1 5 U H5'' 5.000 2.500 7.000 5.187 5.126 5.199 . 0 0 "[ . 1 . 2 ]" 4
48 1 5 U H1' 1 6 G H5' 5.000 4.000 40.000 5.847 5.654 7.553 . 0 0 "[ . 1 . 2 ]" 4
49 1 5 U H1' 1 6 G H5'' 5.000 4.000 40.000 7.181 6.507 7.312 . 0 0 "[ . 1 . 2 ]" 4
50 1 5 U H2' 1 5 U H5' 5.000 2.500 7.000 5.373 5.355 5.377 . 0 0 "[ . 1 . 2 ]" 4
51 1 5 U H5' 1 6 G H1' 5.000 3.600 40.000 9.546 9.410 9.574 . 0 0 "[ . 1 . 2 ]" 4
52 1 5 U H5'' 1 6 G H1' 5.000 3.600 40.000 8.670 8.494 8.703 . 0 0 "[ . 1 . 2 ]" 4
53 1 6 G H1' 1 6 G H5' 5.000 3.600 7.000 4.719 4.642 4.972 . 0 0 "[ . 1 . 2 ]" 4
54 1 6 G H1' 1 6 G H5'' 5.000 3.600 7.000 5.059 4.643 5.116 . 0 0 "[ . 1 . 2 ]" 4
55 1 6 G H1' 1 7 C H5' 5.000 3.600 7.000 5.335 4.991 5.566 . 0 0 "[ . 1 . 2 ]" 4
56 1 5 U H5' 1 6 G H2' 5.000 4.000 40.000 10.142 10.012 10.204 . 0 0 "[ . 1 . 2 ]" 4
57 1 5 U H5'' 1 6 G H2' 5.000 2.500 40.000 8.882 8.732 8.968 . 0 0 "[ . 1 . 2 ]" 4
58 1 6 G H2' 1 6 G H5'' 5.000 2.500 7.000 4.718 4.316 4.749 . 0 0 "[ . 1 . 2 ]" 4
59 1 6 G H2' 1 7 C H5' 5.000 2.500 7.000 4.858 4.370 5.474 . 0 0 "[ . 1 . 2 ]" 4
60 1 6 G H2' 1 7 C H5'' 5.000 2.500 7.000 6.260 5.861 6.780 . 0 0 "[ . 1 . 2 ]" 4
61 1 6 G H5' 1 7 C H1' 5.000 4.000 40.000 9.354 8.425 9.857 . 0 0 "[ . 1 . 2 ]" 4
62 1 6 G H5'' 1 7 C H1' 5.000 4.000 40.000 8.800 8.432 9.410 . 0 0 "[ . 1 . 2 ]" 4
63 1 7 C H1' 1 7 C H5' 5.000 3.600 7.000 4.581 4.562 4.603 . 0 0 "[ . 1 . 2 ]" 4
64 1 7 C H1' 1 7 C H5'' 5.000 4.000 40.000 5.160 5.132 5.197 . 0 0 "[ . 1 . 2 ]" 4
65 1 7 C H1' 1 8 A H5' 5.000 4.000 40.000 7.192 7.089 7.306 . 0 0 "[ . 1 . 2 ]" 4
66 1 7 C H1' 1 8 A H5'' 5.000 4.000 40.000 7.242 7.101 7.297 . 0 0 "[ . 1 . 2 ]" 4
67 1 7 C H2' 1 7 C H5' 5.000 2.500 7.000 4.404 4.359 4.438 . 0 0 "[ . 1 . 2 ]" 4
68 1 7 C H5' 1 8 A H1' 5.000 4.000 40.000 8.228 8.058 8.441 . 0 0 "[ . 1 . 2 ]" 4
69 1 7 C H5'' 1 8 A H1' 5.000 4.000 40.000 8.178 8.043 8.379 . 0 0 "[ . 1 . 2 ]" 4
70 1 8 A H1' 1 8 A H5' 5.000 2.500 7.000 4.628 4.577 4.685 . 0 0 "[ . 1 . 2 ]" 4
71 1 8 A H1' 1 8 A H5'' 5.000 2.500 7.000 5.021 4.997 5.038 . 0 0 "[ . 1 . 2 ]" 4
72 1 8 A H1' 1 9 G H5' 5.000 4.000 40.000 5.374 4.998 6.030 . 0 0 "[ . 1 . 2 ]" 4
73 1 8 A H1' 1 9 G H5'' 5.000 4.000 40.000 5.690 5.191 6.108 . 0 0 "[ . 1 . 2 ]" 4
74 1 7 C H5' 1 8 A H2' 5.000 4.000 40.000 5.480 5.300 5.575 . 0 0 "[ . 1 . 2 ]" 4
75 1 7 C H5'' 1 8 A H2' 5.000 4.000 40.000 5.473 5.374 5.528 . 0 0 "[ . 1 . 2 ]" 4
76 1 8 A H2' 1 8 A H5' 5.000 2.500 7.000 4.070 3.930 4.223 . 0 0 "[ . 1 . 2 ]" 4
77 1 8 A H2' 1 8 A H5'' 5.000 2.500 7.000 4.067 3.900 4.173 . 0 0 "[ . 1 . 2 ]" 4
78 1 8 A H2' 1 9 G H5' 5.000 2.500 7.000 6.319 5.983 6.487 . 0 0 "[ . 1 . 2 ]" 4
79 1 8 A H2' 1 9 G H5'' 5.000 2.500 7.000 6.009 4.497 6.449 . 0 0 "[ . 1 . 2 ]" 4
80 1 8 A H5' 1 9 G H1' 5.000 4.000 40.000 7.615 7.420 7.920 . 0 0 "[ . 1 . 2 ]" 4
81 1 8 A H5'' 1 9 G H1' 5.000 4.000 40.000 7.503 7.405 7.761 . 0 0 "[ . 1 . 2 ]" 4
82 1 9 G H1' 1 9 G H5' 5.000 3.600 7.000 5.018 4.703 5.131 . 0 0 "[ . 1 . 2 ]" 4
83 1 9 G H1' 1 9 G H5'' 5.000 3.600 7.000 4.573 4.467 4.619 . 0 0 "[ . 1 . 2 ]" 4
84 1 9 G H1' 1 10 C H5' 5.000 3.600 7.000 4.619 4.392 4.820 . 0 0 "[ . 1 . 2 ]" 4
85 1 9 G H1' 1 10 C H5'' 5.000 3.600 7.000 6.302 6.058 6.501 . 0 0 "[ . 1 . 2 ]" 4
86 1 9 G H5' 1 10 C H1' 5.000 4.000 40.000 8.586 8.311 8.907 . 0 0 "[ . 1 . 2 ]" 4
87 1 9 G H5'' 1 10 C H1' 5.000 4.000 40.000 8.689 8.332 9.287 . 0 0 "[ . 1 . 2 ]" 4
88 1 10 C H1' 1 10 C H5' 5.000 2.500 7.000 4.816 4.806 4.828 . 0 0 "[ . 1 . 2 ]" 4
89 1 10 C H1' 1 10 C H5'' 5.000 3.600 7.000 5.242 5.231 5.248 . 0 0 "[ . 1 . 2 ]" 4
90 1 10 C H1' 1 11 A H5' 5.000 3.600 7.000 5.128 4.822 5.245 . 0 0 "[ . 1 . 2 ]" 4
91 1 10 C H1' 1 11 A H5'' 5.000 3.600 40.000 6.746 6.492 6.830 . 0 0 "[ . 1 . 2 ]" 4
92 1 10 C H5' 1 11 A H1' 5.000 3.600 40.000 10.253 10.207 10.301 . 0 0 "[ . 1 . 2 ]" 4
93 1 10 C H5'' 1 11 A H1' 5.000 4.000 40.000 9.369 9.317 9.419 . 0 0 "[ . 1 . 2 ]" 4
94 1 11 A H1' 1 11 A H5' 5.000 3.600 7.000 4.660 4.640 4.690 . 0 0 "[ . 1 . 2 ]" 4
95 1 11 A H1' 1 11 A H5'' 5.000 3.600 7.000 5.229 5.192 5.240 . 0 0 "[ . 1 . 2 ]" 4
96 1 11 A H1' 1 12 C H5' 5.000 3.600 40.000 5.409 5.280 5.443 . 0 0 "[ . 1 . 2 ]" 4
97 1 11 A H1' 1 12 C H5'' 5.000 3.600 7.000 6.904 6.806 6.926 . 0 0 "[ . 1 . 2 ]" 4
98 1 11 A H5'' 1 12 C H1' 5.000 2.500 40.000 8.818 8.774 8.866 . 0 0 "[ . 1 . 2 ]" 4
99 1 12 C H1' 1 12 C H5' 5.000 2.500 40.000 4.700 4.663 4.718 . 0 0 "[ . 1 . 2 ]" 4
100 1 12 C H1' 1 12 C H5'' 5.000 4.000 40.000 5.087 5.047 5.104 . 0 0 "[ . 1 . 2 ]" 4
101 1 12 C H1' 1 13 G H5' 5.000 2.500 7.000 7.014 7.002 7.031 0.031 15 0 "[ . 1 . 2 ]" 4
102 1 12 C H1' 1 13 G H5'' 5.000 2.500 7.000 5.740 5.707 5.768 . 0 0 "[ . 1 . 2 ]" 4
103 1 13 G H5' 1 14 A H1' 5.000 4.000 40.000 9.635 9.548 9.699 . 0 0 "[ . 1 . 2 ]" 4
104 1 13 G H5'' 1 14 A H1' 5.000 4.000 40.000 10.632 10.548 10.687 . 0 0 "[ . 1 . 2 ]" 4
105 1 14 A H1' 1 14 A H5' 5.000 4.000 40.000 4.783 4.761 4.798 . 0 0 "[ . 1 . 2 ]" 4
106 1 14 A H1' 1 14 A H5'' 5.000 4.000 40.000 5.239 5.235 5.242 . 0 0 "[ . 1 . 2 ]" 4
107 1 14 A H1' 1 15 A H5' 5.000 4.000 7.000 4.668 4.521 4.707 . 0 0 "[ . 1 . 2 ]" 4
108 1 14 A H1' 1 15 A H5'' 5.000 4.000 7.000 6.360 6.242 6.395 . 0 0 "[ . 1 . 2 ]" 4
109 1 13 G H5'' 1 14 A H2' 5.000 3.600 40.000 9.535 9.389 9.599 . 0 0 "[ . 1 . 2 ]" 4
110 1 14 A H2' 1 14 A H5' 5.000 3.600 7.000 5.345 5.337 5.350 . 0 0 "[ . 1 . 2 ]" 4
111 1 14 A H2' 1 14 A H5'' 5.000 3.600 7.000 4.876 4.855 4.901 . 0 0 "[ . 1 . 2 ]" 4
112 1 14 A H2' 1 15 A H5' 5.000 2.500 5.500 2.830 2.722 2.861 . 0 0 "[ . 1 . 2 ]" 4
113 1 14 A H2' 1 15 A H5'' 5.000 3.600 7.000 4.168 4.114 4.195 . 0 0 "[ . 1 . 2 ]" 4
114 1 14 A H5' 1 15 A H1' 5.000 4.000 40.000 8.571 8.545 8.600 . 0 0 "[ . 1 . 2 ]" 4
115 1 14 A H5'' 1 15 A H1' 5.000 4.000 40.000 8.079 8.037 8.125 . 0 0 "[ . 1 . 2 ]" 4
116 1 15 A H1' 1 15 A H5' 5.000 2.500 7.000 4.729 4.697 4.744 . 0 0 "[ . 1 . 2 ]" 4
117 1 15 A H1' 1 15 A H5'' 5.000 3.600 7.000 5.166 5.155 5.178 . 0 0 "[ . 1 . 2 ]" 4
118 1 15 A H1' 1 16 A H5' 5.000 3.600 7.000 5.025 4.777 5.146 . 0 0 "[ . 1 . 2 ]" 4
119 1 15 A H1' 1 16 A H5'' 5.000 3.600 40.000 6.629 6.436 6.735 . 0 0 "[ . 1 . 2 ]" 4
120 1 14 A H5'' 1 15 A H2' 5.000 2.500 40.000 8.869 8.798 8.922 . 0 0 "[ . 1 . 2 ]" 4
121 1 15 A H2' 1 15 A H5'' 5.000 2.500 40.000 4.837 4.823 4.885 . 0 0 "[ . 1 . 2 ]" 4
122 1 15 A H5' 1 16 A H1' 5.000 4.000 40.000 8.293 8.259 8.429 . 0 0 "[ . 1 . 2 ]" 4
123 1 15 A H5'' 1 16 A H1' 5.000 4.000 40.000 7.798 7.740 7.935 . 0 0 "[ . 1 . 2 ]" 4
124 1 16 A H1' 1 16 A H5' 5.000 3.600 7.000 4.777 4.749 4.790 . 0 0 "[ . 1 . 2 ]" 4
125 1 16 A H1' 1 16 A H5'' 5.000 3.600 7.000 5.219 5.208 5.247 . 0 0 "[ . 1 . 2 ]" 4
126 1 16 A H1' 1 17 G H5' 5.000 4.000 40.000 7.392 7.298 7.941 . 0 0 "[ . 1 . 2 ]" 4
127 1 16 A H1' 1 17 G H5'' 5.000 3.600 7.000 7.072 6.877 7.098 0.098 18 0 "[ . 1 . 2 ]" 4
128 1 15 A H5' 1 16 A H2' 5.000 4.000 40.000 9.704 9.675 9.806 . 0 0 "[ . 1 . 2 ]" 4
129 1 17 G H5' 1 18 U H1' 5.000 4.000 40.000 8.815 8.673 8.861 . 0 0 "[ . 1 . 2 ]" 4
130 1 17 G H5'' 1 18 U H1' 5.000 4.000 40.000 8.622 8.530 8.897 . 0 0 "[ . 1 . 2 ]" 4
131 1 18 U H1' 1 18 U H5' 5.000 2.500 7.000 4.703 4.686 4.735 . 0 0 "[ . 1 . 2 ]" 4
132 1 18 U H1' 1 18 U H5'' 5.000 3.600 7.000 5.105 5.081 5.148 . 0 0 "[ . 1 . 2 ]" 4
133 1 18 U H1' 1 19 G H5' 5.000 4.000 40.000 4.381 4.212 4.924 . 0 0 "[ . 1 . 2 ]" 4
134 1 18 U H1' 1 19 G H5'' 5.000 4.000 40.000 6.109 5.974 6.512 . 0 0 "[ . 1 . 2 ]" 4
135 1 18 U H5' 1 19 G H1' 5.000 3.600 40.000 9.423 9.337 9.497 . 0 0 "[ . 1 . 2 ]" 4
136 1 18 U H5'' 1 19 G H1' 5.000 3.600 40.000 8.904 8.802 8.988 . 0 0 "[ . 1 . 2 ]" 4
137 1 19 G H1' 1 19 G H5'' 5.000 3.600 7.000 5.150 5.131 5.160 . 0 0 "[ . 1 . 2 ]" 4
138 1 19 G H1' 1 20 A H5' 5.000 4.000 40.000 4.351 4.126 4.551 . 0 0 "[ . 1 . 2 ]" 4
139 1 19 G H1' 1 20 A H5'' 5.000 4.000 40.000 6.113 5.885 6.320 . 0 0 "[ . 1 . 2 ]" 4
140 1 19 G H2' 1 19 G H5'' 5.000 2.500 7.000 4.882 4.762 4.931 . 0 0 "[ . 1 . 2 ]" 4
141 1 19 G H5' 1 20 A H1' 5.000 4.000 40.000 9.392 9.300 9.461 . 0 0 "[ . 1 . 2 ]" 4
142 1 19 G H5'' 1 20 A H1' 5.000 4.000 40.000 8.813 8.686 8.892 . 0 0 "[ . 1 . 2 ]" 4
143 1 20 A H1' 1 20 A H5' 5.000 3.600 7.000 4.552 4.537 4.594 . 0 0 "[ . 1 . 2 ]" 4
144 1 20 A H1' 1 20 A H5'' 5.000 3.600 7.000 5.073 5.052 5.113 . 0 0 "[ . 1 . 2 ]" 4
145 1 20 A H1' 1 21 C H5' 5.000 2.500 40.000 6.886 6.753 7.101 . 0 0 "[ . 1 . 2 ]" 4
146 1 20 A H1' 1 21 C H5'' 5.000 2.500 40.000 5.584 5.443 5.747 . 0 0 "[ . 1 . 2 ]" 4
147 1 20 A H5' 1 21 C H1' 5.000 4.000 40.000 9.290 9.202 9.374 . 0 0 "[ . 1 . 2 ]" 4
148 1 20 A H5'' 1 21 C H1' 5.000 4.000 40.000 9.158 9.012 9.225 . 0 0 "[ . 1 . 2 ]" 4
149 1 21 C H1' 1 21 C H5' 5.000 2.500 7.000 5.026 5.009 5.070 . 0 0 "[ . 1 . 2 ]" 4
150 1 21 C H1' 1 21 C H5'' 5.000 3.400 7.000 4.585 4.580 4.596 . 0 0 "[ . 1 . 2 ]" 4
151 1 21 C H1' 1 22 G H5' 5.000 3.400 40.000 5.239 5.119 5.350 . 0 0 "[ . 1 . 2 ]" 4
152 1 21 C H1' 1 22 G H5'' 5.000 3.400 40.000 6.699 6.629 6.758 . 0 0 "[ . 1 . 2 ]" 4
153 1 21 C H5' 1 22 G H1' 5.000 4.000 40.000 8.862 8.813 8.918 . 0 0 "[ . 1 . 2 ]" 4
154 1 21 C H5'' 1 22 G H1' 5.000 4.000 40.000 9.245 9.225 9.278 . 0 0 "[ . 1 . 2 ]" 4
155 1 22 G H1' 1 22 G H5' 5.000 2.500 7.000 4.782 4.756 4.800 . 0 0 "[ . 1 . 2 ]" 4
156 1 22 G H1' 1 22 G H5'' 5.000 3.600 7.000 5.213 5.189 5.228 . 0 0 "[ . 1 . 2 ]" 4
157 1 22 G H1' 1 23 G H5' 5.000 3.600 40.000 5.426 4.999 5.551 . 0 0 "[ . 1 . 2 ]" 4
158 1 22 G H1' 1 23 G H5'' 5.000 3.600 40.000 6.957 6.633 7.051 . 0 0 "[ . 1 . 2 ]" 4
159 1 22 G H5' 1 23 G H1' 5.000 3.600 40.000 9.136 9.060 9.296 . 0 0 "[ . 1 . 2 ]" 4
160 1 22 G H5'' 1 23 G H1' 5.000 4.000 40.000 8.495 8.420 8.678 . 0 0 "[ . 1 . 2 ]" 4
161 1 23 G H1' 1 23 G H5' 5.000 2.500 7.000 4.771 4.724 4.796 . 0 0 "[ . 1 . 2 ]" 4
162 1 23 G H1' 1 23 G H5'' 5.000 3.600 7.000 5.157 5.135 5.182 . 0 0 "[ . 1 . 2 ]" 4
163 1 23 G H1' 1 24 C H5' 5.000 2.500 40.000 5.406 4.800 5.718 . 0 0 "[ . 1 . 2 ]" 4
164 1 23 G H1' 1 24 C H5'' 5.000 3.600 40.000 6.983 6.473 7.232 . 0 0 "[ . 1 . 2 ]" 4
165 1 23 G H5' 1 24 C H1' 5.000 2.500 40.000 9.560 9.174 9.732 . 0 0 "[ . 1 . 2 ]" 4
166 1 23 G H5'' 1 24 C H1' 5.000 3.600 40.000 8.787 8.627 8.939 . 0 0 "[ . 1 . 2 ]" 4
167 1 24 C H1' 1 24 C H5' 5.000 2.500 7.000 4.667 4.543 4.739 . 0 0 "[ . 1 . 2 ]" 4
168 1 24 C H1' 1 24 C H5'' 5.000 3.600 40.000 5.102 4.969 5.176 . 0 0 "[ . 1 . 2 ]" 4
169 1 24 C H1' 1 25 U H5' 5.000 2.500 40.000 5.222 4.723 5.453 . 0 0 "[ . 1 . 2 ]" 4
170 1 24 C H1' 1 25 U H5'' 5.000 3.600 40.000 6.718 6.302 6.939 . 0 0 "[ . 1 . 2 ]" 4
171 1 24 C H5' 1 25 U H1' 5.000 2.500 40.000 9.654 9.509 9.771 . 0 0 "[ . 1 . 2 ]" 4
172 1 24 C H5'' 1 25 U H1' 5.000 3.600 40.000 9.144 9.025 9.347 . 0 0 "[ . 1 . 2 ]" 4
173 1 25 U H1' 1 25 U H5' 5.000 2.500 7.000 4.752 4.679 4.778 . 0 0 "[ . 1 . 2 ]" 4
174 1 25 U H1' 1 25 U H5'' 5.000 3.600 7.000 5.203 5.197 5.215 . 0 0 "[ . 1 . 2 ]" 4
175 1 25 U H1' 1 26 C H5' 5.000 3.600 7.000 4.734 4.558 5.081 . 0 0 "[ . 1 . 2 ]" 4
176 1 25 U H1' 1 26 C H5'' 5.000 3.600 7.000 6.487 6.330 6.774 . 0 0 "[ . 1 . 2 ]" 4
177 1 25 U H5' 1 26 C H1' 5.000 3.600 40.000 9.454 9.382 9.511 . 0 0 "[ . 1 . 2 ]" 4
178 1 25 U H5'' 1 26 C H1' 5.000 3.600 40.000 8.781 8.718 8.887 . 0 0 "[ . 1 . 2 ]" 4
179 1 26 C H1' 1 26 C H5' 5.000 3.600 7.000 4.616 4.582 4.662 . 0 0 "[ . 1 . 2 ]" 4
180 1 26 C H1' 1 26 C H5'' 5.000 3.600 7.000 5.100 5.078 5.115 . 0 0 "[ . 1 . 2 ]" 4
181 1 25 U H5' 1 26 C H2' 5.000 3.600 40.000 10.132 10.058 10.235 . 0 0 "[ . 1 . 2 ]" 4
182 1 26 C H2' 1 26 C H5' 5.000 3.600 7.000 5.299 5.271 5.336 . 0 0 "[ . 1 . 2 ]" 4
183 1 26 C H2' 1 26 C H5'' 5.000 3.600 7.000 4.938 4.856 4.990 . 0 0 "[ . 1 . 2 ]" 4
184 1 1 G H5' 1 1 G H8 5.000 2.500 7.500 3.608 3.371 3.782 . 0 0 "[ . 1 . 2 ]" 4
185 1 1 G H5'' 1 1 G H8 5.000 2.500 7.500 4.026 3.853 4.194 . 0 0 "[ . 1 . 2 ]" 4
186 1 1 G H8 1 2 A H5' 5.000 5.000 40.000 6.893 6.635 7.009 . 0 0 "[ . 1 . 2 ]" 4
187 1 1 G H8 1 2 A H5'' 5.000 5.000 40.000 7.821 7.519 7.948 . 0 0 "[ . 1 . 2 ]" 4
188 1 1 G H5' 1 2 A H8 5.000 4.000 7.500 6.940 6.878 7.010 . 0 0 "[ . 1 . 2 ]" 4
189 1 1 G H5'' 1 2 A H8 5.000 5.000 40.000 6.057 5.908 6.278 . 0 0 "[ . 1 . 2 ]" 4
190 1 2 A H5' 1 2 A H8 3.900 3.600 7.500 3.587 3.574 3.595 0.026 11 0 "[ . 1 . 2 ]" 4
191 1 2 A H5'' 1 2 A H8 3.200 2.500 7.500 4.111 3.980 4.189 . 0 0 "[ . 1 . 2 ]" 4
192 1 2 A H8 1 3 G H5' 5.000 5.000 40.000 6.477 6.000 6.672 . 0 0 "[ . 1 . 2 ]" 4
193 1 2 A H8 1 3 G H5'' 5.000 5.000 40.000 7.671 7.408 7.779 . 0 0 "[ . 1 . 2 ]" 4
194 1 2 A H5' 1 3 G H8 5.000 5.000 40.000 7.007 6.847 7.240 . 0 0 "[ . 1 . 2 ]" 4
195 1 2 A H5'' 1 3 G H8 5.000 5.000 40.000 6.365 6.075 6.622 . 0 0 "[ . 1 . 2 ]" 4
196 1 3 G H5' 1 3 G H8 5.000 3.600 7.500 4.207 4.034 4.346 . 0 0 "[ . 1 . 2 ]" 4
197 1 3 G H5'' 1 3 G H8 5.000 3.600 7.500 4.561 4.279 4.713 . 0 0 "[ . 1 . 2 ]" 4
198 1 3 G H8 1 4 C H5' 5.000 3.600 40.000 6.874 6.519 7.169 . 0 0 "[ . 1 . 2 ]" 4
199 1 3 G H8 1 4 C H5'' 5.000 3.600 40.000 7.958 7.627 8.218 . 0 0 "[ . 1 . 2 ]" 4
200 1 3 G H5' 1 4 C H6 5.000 4.000 7.500 7.129 6.923 7.281 . 0 0 "[ . 1 . 2 ]" 4
201 1 3 G H5'' 1 4 C H6 5.000 4.000 7.500 6.262 6.033 6.526 . 0 0 "[ . 1 . 2 ]" 4
202 1 4 C H5' 1 4 C H6 3.800 3.400 7.500 4.048 3.957 4.157 . 0 0 "[ . 1 . 2 ]" 4
203 1 4 C H5'' 1 4 C H6 5.000 3.400 7.500 4.303 4.171 4.428 . 0 0 "[ . 1 . 2 ]" 4
204 1 4 C H6 1 5 U H5' 5.000 5.000 40.000 6.831 6.694 6.992 . 0 0 "[ . 1 . 2 ]" 4
205 1 4 C H6 1 5 U H5'' 5.000 5.000 40.000 7.873 7.772 8.029 . 0 0 "[ . 1 . 2 ]" 4
206 1 5 U H5' 1 6 G H8 5.000 5.000 40.000 7.791 7.496 7.970 . 0 0 "[ . 1 . 2 ]" 4
207 1 5 U H5'' 1 6 G H8 5.000 5.000 40.000 6.542 6.254 6.936 . 0 0 "[ . 1 . 2 ]" 4
208 1 6 G H5' 1 6 G H8 5.000 3.600 7.500 4.838 4.667 5.006 . 0 0 "[ . 1 . 2 ]" 4
209 1 6 G H5'' 1 6 G H8 5.000 3.600 7.500 4.472 3.585 4.743 0.015 17 0 "[ . 1 . 2 ]" 4
210 1 6 G H8 1 7 C H5' 5.000 5.000 40.000 6.753 6.398 7.335 . 0 0 "[ . 1 . 2 ]" 4
211 1 6 G H8 1 7 C H5'' 5.000 5.000 40.000 8.036 7.725 8.614 . 0 0 "[ . 1 . 2 ]" 4
212 1 7 C H5' 1 8 A H8 5.000 5.000 40.000 7.434 7.268 7.680 . 0 0 "[ . 1 . 2 ]" 4
213 1 7 C H5'' 1 8 A H8 5.000 5.000 40.000 7.219 7.106 7.482 . 0 0 "[ . 1 . 2 ]" 4
214 1 8 A H5' 1 8 A H8 5.000 3.600 7.500 3.592 3.578 3.681 0.022 3 0 "[ . 1 . 2 ]" 4
215 1 8 A H5'' 1 8 A H8 5.000 3.600 7.500 4.656 4.530 4.776 . 0 0 "[ . 1 . 2 ]" 4
216 1 8 A H8 1 9 G H5' 5.000 5.000 40.000 8.506 8.276 8.748 . 0 0 "[ . 1 . 2 ]" 4
217 1 8 A H8 1 9 G H5'' 5.000 5.000 40.000 8.454 7.138 8.954 . 0 0 "[ . 1 . 2 ]" 4
218 1 9 G H5' 1 10 C H6 5.000 5.000 40.000 5.831 5.623 6.094 . 0 0 "[ . 1 . 2 ]" 4
219 1 9 G H5'' 1 10 C H6 5.000 5.000 40.000 6.221 5.881 6.940 . 0 0 "[ . 1 . 2 ]" 4
220 1 10 C H5' 1 10 C H6 3.800 3.400 7.000 3.346 3.308 3.379 0.092 16 0 "[ . 1 . 2 ]" 4
221 1 10 C H5'' 1 10 C H6 5.000 3.400 7.500 3.758 3.694 3.806 . 0 0 "[ . 1 . 2 ]" 4
222 1 10 C H6 1 11 A H5' 5.000 3.400 40.000 6.765 6.558 6.879 . 0 0 "[ . 1 . 2 ]" 4
223 1 10 C H6 1 11 A H5'' 5.000 3.400 40.000 7.856 7.736 7.980 . 0 0 "[ . 1 . 2 ]" 4
224 1 10 C H5' 1 11 A H8 5.000 5.000 40.000 7.109 7.038 7.269 . 0 0 "[ . 1 . 2 ]" 4
225 1 10 C H5'' 1 11 A H8 5.000 5.000 40.000 6.011 5.945 6.194 . 0 0 "[ . 1 . 2 ]" 4
226 1 11 A H5' 1 11 A H8 5.000 3.600 7.500 3.674 3.601 3.851 . 0 0 "[ . 1 . 2 ]" 4
227 1 11 A H5'' 1 11 A H8 5.000 3.600 7.500 4.136 4.036 4.311 . 0 0 "[ . 1 . 2 ]" 4
228 1 11 A H8 1 12 C H5' 5.000 3.600 40.000 6.482 6.406 6.528 . 0 0 "[ . 1 . 2 ]" 4
229 1 11 A H8 1 12 C H5'' 5.000 3.600 40.000 7.300 7.220 7.338 . 0 0 "[ . 1 . 2 ]" 4
230 1 11 A H5' 1 12 C H6 5.000 3.600 40.000 6.791 6.740 6.848 . 0 0 "[ . 1 . 2 ]" 4
231 1 11 A H5'' 1 12 C H6 5.000 2.500 40.000 6.257 6.175 6.349 . 0 0 "[ . 1 . 2 ]" 4
232 1 12 C H5' 1 12 C H6 5.000 2.500 7.500 4.180 4.130 4.282 . 0 0 "[ . 1 . 2 ]" 4
233 1 12 C H5'' 1 12 C H6 5.000 4.000 7.500 4.289 4.213 4.441 . 0 0 "[ . 1 . 2 ]" 4
234 1 12 C H6 1 13 G H5' 5.000 2.500 40.000 7.017 6.946 7.073 . 0 0 "[ . 1 . 2 ]" 4
235 1 12 C H6 1 13 G H5'' 5.000 2.500 40.000 5.287 5.218 5.338 . 0 0 "[ . 1 . 2 ]" 4
236 1 13 G H5' 1 14 A H8 5.000 5.000 40.000 6.365 6.295 6.436 . 0 0 "[ . 1 . 2 ]" 4
237 1 13 G H5'' 1 14 A H8 5.000 5.000 40.000 7.609 7.537 7.668 . 0 0 "[ . 1 . 2 ]" 4
238 1 14 A H5' 1 14 A H8 5.000 3.600 7.500 3.593 3.586 3.597 0.014 20 0 "[ . 1 . 2 ]" 4
239 1 14 A H5'' 1 14 A H8 5.000 3.600 7.500 4.168 4.129 4.220 . 0 0 "[ . 1 . 2 ]" 4
240 1 14 A H8 1 15 A H5' 5.000 5.000 40.000 6.485 6.385 6.520 . 0 0 "[ . 1 . 2 ]" 4
241 1 14 A H8 1 15 A H5'' 5.000 5.000 40.000 7.866 7.811 7.899 . 0 0 "[ . 1 . 2 ]" 4
242 1 14 A H5' 1 15 A H8 5.000 5.000 40.000 6.026 5.991 6.059 . 0 0 "[ . 1 . 2 ]" 4
243 1 14 A H5'' 1 15 A H8 5.000 5.000 40.000 5.125 5.064 5.182 . 0 0 "[ . 1 . 2 ]" 4
244 1 15 A H5' 1 15 A H8 5.000 2.500 7.500 3.931 3.843 3.977 . 0 0 "[ . 1 . 2 ]" 4
245 1 15 A H5'' 1 15 A H8 3.900 3.600 7.500 4.469 4.406 4.533 . 0 0 "[ . 1 . 2 ]" 4
246 1 15 A H8 1 16 A H5' 5.000 3.600 7.500 6.970 6.824 7.049 . 0 0 "[ . 1 . 2 ]" 4
247 1 15 A H8 1 16 A H5'' 5.000 3.600 40.000 8.238 8.150 8.296 . 0 0 "[ . 1 . 2 ]" 4
248 1 15 A H5' 1 16 A H8 5.000 3.600 7.500 6.459 6.378 6.633 . 0 0 "[ . 1 . 2 ]" 4
249 1 15 A H5'' 1 16 A H8 5.000 3.600 7.500 5.325 5.236 5.533 . 0 0 "[ . 1 . 2 ]" 4
250 1 16 A H5' 1 16 A H8 5.000 3.600 7.500 3.730 3.651 3.797 . 0 0 "[ . 1 . 2 ]" 4
251 1 16 A H5'' 1 16 A H8 3.900 3.600 7.500 3.883 3.764 3.967 . 0 0 "[ . 1 . 2 ]" 4
252 1 16 A H8 1 17 G H5' 5.000 5.000 40.000 6.105 6.029 6.693 . 0 0 "[ . 1 . 2 ]" 4
253 1 16 A H8 1 17 G H5'' 5.000 5.000 40.000 4.974 4.961 5.070 0.039 16 0 "[ . 1 . 2 ]" 4
254 1 18 U H5' 1 19 G H8 5.000 4.000 7.500 7.326 7.284 7.401 . 0 0 "[ . 1 . 2 ]" 4
255 1 18 U H5'' 1 19 G H8 5.000 4.000 7.500 6.360 6.297 6.455 . 0 0 "[ . 1 . 2 ]" 4
256 1 19 G H5'' 1 19 G H8 5.000 3.600 7.500 4.407 4.277 4.515 . 0 0 "[ . 1 . 2 ]" 4
257 1 19 G H8 1 20 A H5' 5.000 5.000 40.000 6.115 5.989 6.338 . 0 0 "[ . 1 . 2 ]" 4
258 1 19 G H8 1 20 A H5'' 5.000 5.000 40.000 7.713 7.581 7.880 . 0 0 "[ . 1 . 2 ]" 4
259 1 19 G H5' 1 20 A H8 5.000 5.000 40.000 7.021 6.926 7.192 . 0 0 "[ . 1 . 2 ]" 4
260 1 19 G H5'' 1 20 A H8 5.000 2.500 40.000 6.169 5.838 6.448 . 0 0 "[ . 1 . 2 ]" 4
261 1 20 A H5' 1 20 A H8 5.000 2.500 7.500 3.872 3.794 3.953 . 0 0 "[ . 1 . 2 ]" 4
262 1 20 A H5'' 1 20 A H8 5.000 2.500 7.500 4.728 4.603 4.782 . 0 0 "[ . 1 . 2 ]" 4
263 1 20 A H8 1 21 C H5' 5.000 2.500 7.500 6.164 6.051 6.468 . 0 0 "[ . 1 . 2 ]" 4
264 1 20 A H8 1 21 C H5'' 5.000 2.500 7.500 4.404 4.289 4.706 . 0 0 "[ . 1 . 2 ]" 4
265 1 21 C H5' 1 22 G H8 5.000 5.000 40.000 6.255 6.215 6.347 . 0 0 "[ . 1 . 2 ]" 4
266 1 21 C H5'' 1 22 G H8 5.000 5.000 40.000 6.498 6.471 6.559 . 0 0 "[ . 1 . 2 ]" 4
267 1 22 G H5' 1 22 G H8 5.000 3.600 7.500 3.791 3.724 3.899 . 0 0 "[ . 1 . 2 ]" 4
268 1 22 G H5'' 1 22 G H8 5.000 2.500 7.500 4.193 4.036 4.347 . 0 0 "[ . 1 . 2 ]" 4
269 1 22 G H8 1 23 G H5' 5.000 5.000 40.000 6.927 6.751 7.013 . 0 0 "[ . 1 . 2 ]" 4
270 1 22 G H8 1 23 G H5'' 5.000 5.000 40.000 7.872 7.670 7.979 . 0 0 "[ . 1 . 2 ]" 4
271 1 22 G H5' 1 23 G H8 5.000 5.000 40.000 6.336 6.204 6.438 . 0 0 "[ . 1 . 2 ]" 4
272 1 22 G H5'' 1 23 G H8 5.000 5.000 40.000 5.436 5.326 5.551 . 0 0 "[ . 1 . 2 ]" 4
273 1 23 G H5' 1 23 G H8 3.300 2.500 7.500 4.117 4.020 4.197 . 0 0 "[ . 1 . 2 ]" 4
274 1 23 G H5'' 1 23 G H8 5.000 2.500 7.500 4.377 4.222 4.471 . 0 0 "[ . 1 . 2 ]" 4
275 1 23 G H8 1 24 C H5'' 5.000 2.500 40.000 8.104 7.721 8.309 . 0 0 "[ . 1 . 2 ]" 4
276 1 23 G H5' 1 24 C H6 5.000 2.500 40.000 6.883 6.798 7.010 . 0 0 "[ . 1 . 2 ]" 4
277 1 23 G H5'' 1 24 C H6 5.000 3.400 40.000 5.858 5.751 6.066 . 0 0 "[ . 1 . 2 ]" 4
278 1 24 C H5' 1 24 C H6 3.300 2.500 7.500 4.009 3.792 4.300 . 0 0 "[ . 1 . 2 ]" 4
279 1 24 C H5'' 1 24 C H6 5.000 3.400 7.500 4.315 4.054 4.701 . 0 0 "[ . 1 . 2 ]" 4
280 1 24 C H6 1 25 U H5' 5.000 2.500 40.000 7.073 6.966 7.203 . 0 0 "[ . 1 . 2 ]" 4
281 1 24 C H6 1 25 U H5'' 5.000 3.400 40.000 8.040 7.915 8.238 . 0 0 "[ . 1 . 2 ]" 4
282 1 24 C H5' 1 25 U H6 5.000 2.500 40.000 7.289 7.223 7.346 . 0 0 "[ . 1 . 2 ]" 4
283 1 24 C H5'' 1 25 U H6 5.000 3.400 40.000 6.417 6.301 6.546 . 0 0 "[ . 1 . 2 ]" 4
284 1 25 U H5' 1 25 U H6 3.300 2.500 7.500 3.692 3.619 3.744 . 0 0 "[ . 1 . 2 ]" 4
285 1 25 U H5'' 1 25 U H6 5.000 3.400 7.500 3.861 3.775 4.021 . 0 0 "[ . 1 . 2 ]" 4
286 1 25 U H6 1 26 C H5' 5.000 5.000 40.000 5.802 5.629 6.110 . 0 0 "[ . 1 . 2 ]" 4
287 1 25 U H6 1 26 C H5'' 5.000 5.000 40.000 7.095 7.019 7.244 . 0 0 "[ . 1 . 2 ]" 4
288 1 25 U H5' 1 26 C H6 5.000 3.400 40.000 6.571 6.517 6.641 . 0 0 "[ . 1 . 2 ]" 4
289 1 25 U H5'' 1 26 C H6 5.000 3.400 40.000 5.766 5.655 5.972 . 0 0 "[ . 1 . 2 ]" 4
290 1 26 C H5' 1 26 C H6 3.800 3.400 7.500 3.831 3.743 3.972 . 0 0 "[ . 1 . 2 ]" 4
291 1 26 C H5'' 1 26 C H6 5.000 3.400 7.500 4.572 4.492 4.633 . 0 0 "[ . 1 . 2 ]" 4
stop_
save_
save_distance_constraint_statistics_5
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 5
_Distance_constraint_stats_list.Constraint_count 52
_Distance_constraint_stats_list.Viol_count 764
_Distance_constraint_stats_list.Viol_total 436.411
_Distance_constraint_stats_list.Viol_max 0.105
_Distance_constraint_stats_list.Viol_rms 0.0224
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0190
_Distance_constraint_stats_list.Viol_average_violations_only 0.0272
_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 0.815 0.031 6 0 "[ . 1 . 2 ]"
1 2 A 1.018 0.032 10 0 "[ . 1 . 2 ]"
1 3 G 2.416 0.077 19 0 "[ . 1 . 2 ]"
1 4 C 2.677 0.072 20 0 "[ . 1 . 2 ]"
1 5 U 1.511 0.063 11 0 "[ . 1 . 2 ]"
1 6 G 0.337 0.017 10 0 "[ . 1 . 2 ]"
1 9 G 1.154 0.057 14 0 "[ . 1 . 2 ]"
1 10 C 3.168 0.097 1 0 "[ . 1 . 2 ]"
1 11 A 2.853 0.105 1 0 "[ . 1 . 2 ]"
1 12 C 3.861 0.076 21 0 "[ . 1 . 2 ]"
1 13 G 0.972 0.055 13 0 "[ . 1 . 2 ]"
1 16 A 0.972 0.055 13 0 "[ . 1 . 2 ]"
1 17 G 3.861 0.076 21 0 "[ . 1 . 2 ]"
1 18 U 2.853 0.105 1 0 "[ . 1 . 2 ]"
1 19 G 3.168 0.097 1 0 "[ . 1 . 2 ]"
1 20 A 1.154 0.057 14 0 "[ . 1 . 2 ]"
1 21 C 0.337 0.017 10 0 "[ . 1 . 2 ]"
1 22 G 1.511 0.063 11 0 "[ . 1 . 2 ]"
1 23 G 2.677 0.072 20 0 "[ . 1 . 2 ]"
1 24 C 2.416 0.077 19 0 "[ . 1 . 2 ]"
1 25 U 1.018 0.032 10 0 "[ . 1 . 2 ]"
1 26 C 0.815 0.031 6 0 "[ . 1 . 2 ]"
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 O6 1 26 C N4 2.910 2.870 2.950 2.927 2.911 2.960 0.010 8 0 "[ . 1 . 2 ]" 5
2 1 3 G O6 1 24 C N4 2.910 2.870 2.950 2.939 2.908 2.964 0.014 6 0 "[ . 1 . 2 ]" 5
3 1 4 C N4 1 23 G O6 2.910 2.870 2.950 2.882 2.866 2.916 0.004 21 0 "[ . 1 . 2 ]" 5
4 1 6 G O6 1 21 C N4 2.910 2.870 2.950 2.932 2.882 2.956 0.006 6 0 "[ . 1 . 2 ]" 5
5 1 10 C N4 1 19 G O6 2.910 2.870 2.950 2.911 2.829 2.958 0.041 1 0 "[ . 1 . 2 ]" 5
6 1 12 C N4 1 17 G O6 2.910 2.870 2.950 2.956 2.937 2.962 0.012 8 0 "[ . 1 . 2 ]" 5
7 1 1 G H1 1 26 C N3 2.000 . 2.040 2.056 2.045 2.071 0.031 6 0 "[ . 1 . 2 ]" 5
8 1 3 G H1 1 24 C N3 2.000 . 2.040 2.039 2.003 2.064 0.024 13 0 "[ . 1 . 2 ]" 5
9 1 4 C N3 1 23 G H1 2.000 . 2.040 1.955 1.944 1.967 0.016 11 0 "[ . 1 . 2 ]" 5
10 1 6 G H1 1 21 C N3 2.000 . 2.040 2.012 1.979 2.056 0.016 13 0 "[ . 1 . 2 ]" 5
11 1 10 C N3 1 19 G H1 2.000 . 2.040 1.926 1.912 1.949 0.048 1 0 "[ . 1 . 2 ]" 5
12 1 12 C N3 1 17 G H1 2.000 . 2.040 2.047 1.987 2.062 0.022 10 0 "[ . 1 . 2 ]" 5
13 1 1 G N1 1 26 C N3 2.950 2.910 2.990 2.932 2.908 2.945 0.002 17 0 "[ . 1 . 2 ]" 5
14 1 3 G N1 1 24 C N3 2.950 2.910 2.990 2.983 2.967 3.000 0.010 1 0 "[ . 1 . 2 ]" 5
15 1 4 C N3 1 23 G N1 2.950 2.910 2.990 2.982 2.954 2.995 0.005 12 0 "[ . 1 . 2 ]" 5
16 1 6 G N1 1 21 C N3 2.950 2.910 2.990 2.928 2.907 2.952 0.003 13 0 "[ . 1 . 2 ]" 5
17 1 10 C N3 1 19 G N1 2.950 2.910 2.990 2.919 2.907 2.946 0.003 5 0 "[ . 1 . 2 ]" 5
18 1 12 C N3 1 17 G N1 2.950 2.910 2.990 3.004 2.987 3.008 0.018 19 0 "[ . 1 . 2 ]" 5
19 1 1 G N2 1 26 C O2 2.860 2.820 2.900 2.899 2.879 2.919 0.019 8 0 "[ . 1 . 2 ]" 5
20 1 3 G N2 1 24 C O2 2.860 2.820 2.900 2.932 2.918 2.951 0.051 17 0 "[ . 1 . 2 ]" 5
21 1 4 C O2 1 23 G N2 2.860 2.820 2.900 2.956 2.944 2.968 0.068 9 0 "[ . 1 . 2 ]" 5
22 1 6 G N2 1 21 C O2 2.860 2.820 2.900 2.904 2.877 2.914 0.014 1 0 "[ . 1 . 2 ]" 5
23 1 10 C O2 1 19 G N2 2.860 2.820 2.900 2.969 2.948 2.997 0.097 1 0 "[ . 1 . 2 ]" 5
24 1 12 C O2 1 17 G N2 2.860 2.820 2.900 2.963 2.942 2.976 0.076 21 0 "[ . 1 . 2 ]" 5
25 1 1 G N2 1 26 C H6 7.250 7.210 7.290 7.198 7.192 7.206 0.018 6 0 "[ . 1 . 2 ]" 5
26 1 3 G N2 1 24 C H6 7.250 7.210 7.290 7.145 7.133 7.165 0.077 19 0 "[ . 1 . 2 ]" 5
27 1 4 C H6 1 23 G N2 7.250 7.210 7.290 7.157 7.138 7.180 0.072 20 0 "[ . 1 . 2 ]" 5
28 1 6 G N2 1 21 C H6 7.250 7.210 7.290 7.202 7.193 7.207 0.017 10 0 "[ . 1 . 2 ]" 5
29 1 10 C H6 1 19 G N2 7.250 7.210 7.290 7.175 7.167 7.196 0.043 20 0 "[ . 1 . 2 ]" 5
30 1 12 C H6 1 17 G N2 7.250 7.210 7.290 7.153 7.141 7.191 0.069 17 0 "[ . 1 . 2 ]" 5
31 1 1 G O6 1 26 C H5 5.450 5.410 5.490 5.496 5.481 5.502 0.012 1 0 "[ . 1 . 2 ]" 5
32 1 3 G O6 1 24 C H5 5.450 5.410 5.490 5.494 5.455 5.509 0.019 4 0 "[ . 1 . 2 ]" 5
33 1 4 C H5 1 23 G O6 5.450 5.410 5.490 5.500 5.481 5.513 0.023 18 0 "[ . 1 . 2 ]" 5
34 1 6 G O6 1 21 C H5 5.450 5.410 5.490 5.469 5.433 5.497 0.007 3 0 "[ . 1 . 2 ]" 5
35 1 10 C H5 1 19 G O6 5.450 5.410 5.490 5.403 5.383 5.442 0.027 21 0 "[ . 1 . 2 ]" 5
36 1 12 C H5 1 17 G O6 5.450 5.410 5.490 5.522 5.510 5.533 0.043 15 0 "[ . 1 . 2 ]" 5
37 1 2 A N1 1 25 U H3 1.870 . 1.910 1.927 1.914 1.937 0.027 21 0 "[ . 1 . 2 ]" 5
38 1 11 A N1 1 18 U H3 1.870 . 1.910 1.911 1.904 1.932 0.022 1 0 "[ . 1 . 2 ]" 5
39 1 2 A N6 1 25 U O4 2.950 2.910 2.990 2.920 2.907 2.948 0.003 4 0 "[ . 1 . 2 ]" 5
40 1 11 A N6 1 18 U O4 2.950 2.910 2.990 2.871 2.864 2.881 0.046 6 0 "[ . 1 . 2 ]" 5
41 1 2 A N1 1 25 U N3 2.820 2.780 2.860 2.864 2.831 2.883 0.023 10 0 "[ . 1 . 2 ]" 5
42 1 11 A N1 1 18 U N3 2.820 2.780 2.860 2.935 2.928 2.965 0.105 1 0 "[ . 1 . 2 ]" 5
43 1 2 A N6 1 25 U H5 5.600 5.560 5.640 5.536 5.528 5.549 0.032 10 0 "[ . 1 . 2 ]" 5
44 1 11 A N6 1 18 U H5 5.600 5.560 5.640 5.541 5.532 5.547 0.028 3 0 "[ . 1 . 2 ]" 5
45 1 13 G H22 1 16 A N7 1.990 . 2.030 1.909 1.895 1.953 0.055 13 0 "[ . 1 . 2 ]" 5
46 1 13 G N3 1 16 A H62 1.990 . 2.030 2.006 1.940 2.044 0.014 13 0 "[ . 1 . 2 ]" 5
47 1 5 U H3 1 22 G O6 1.950 . 1.990 2.035 2.004 2.053 0.063 11 0 "[ . 1 . 2 ]" 5
48 1 5 U O2 1 22 G H1 1.950 . 1.990 1.890 1.871 1.923 0.039 17 0 "[ . 1 . 2 ]" 5
49 1 5 U N3 1 22 G O6 2.900 2.860 2.940 2.886 2.828 2.949 0.032 6 0 "[ . 1 . 2 ]" 5
50 1 5 U O2 1 22 G N1 2.900 2.860 2.940 2.872 2.841 2.915 0.019 11 0 "[ . 1 . 2 ]" 5
51 1 9 G H1 1 20 A N1 1.990 . 2.030 2.076 2.066 2.087 0.057 14 0 "[ . 1 . 2 ]" 5
52 1 9 G O6 1 20 A H61 1.950 . 1.990 1.991 1.903 2.011 0.021 13 0 "[ . 1 . 2 ]" 5
stop_
save_
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