NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
450163 |
2qh4   |
7405 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2qh4
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 396
_Distance_constraint_stats_list.Viol_count 649
_Distance_constraint_stats_list.Viol_total 664.304
_Distance_constraint_stats_list.Viol_max 0.848
_Distance_constraint_stats_list.Viol_rms 0.0280
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0042
_Distance_constraint_stats_list.Viol_average_violations_only 0.0512
_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 5.631 0.653 17 2 "[ . - 1 . + 2]"
1 2 G 7.640 0.848 2 3 "[ + . - 1 . * 2]"
1 3 C 1.543 0.848 2 1 "[ + . 1 . 2]"
1 4 A 1.115 0.066 7 0 "[ . 1 . 2]"
1 5 C 1.090 0.064 12 0 "[ . 1 . 2]"
1 6 A 1.570 0.165 12 0 "[ . 1 . 2]"
1 7 G 1.564 0.165 12 0 "[ . 1 . 2]"
1 8 A 1.261 0.098 5 0 "[ . 1 . 2]"
1 9 G 1.193 0.060 12 0 "[ . 1 . 2]"
1 10 U 1.916 0.089 11 0 "[ . 1 . 2]"
1 11 U 1.993 0.111 5 0 "[ . 1 . 2]"
1 12 A 1.372 0.131 4 0 "[ . 1 . 2]"
1 13 U 4.994 0.315 9 0 "[ . 1 . 2]"
1 14 G 11.292 0.315 9 0 "[ . 1 . 2]"
1 15 U 2.049 0.064 12 0 "[ . 1 . 2]"
1 16 G 1.619 0.056 9 0 "[ . 1 . 2]"
1 17 C 4.787 0.450 12 0 "[ . 1 . 2]"
1 18 C 4.106 0.450 12 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 3.500 2.500 4.500 3.812 3.767 3.849 . 0 0 "[ . 1 . 2]" 1
2 1 1 G H2' 1 1 G H8 3.500 2.500 4.500 3.687 3.499 3.853 . 0 0 "[ . 1 . 2]" 1
3 1 1 G H1' 1 1 G H2' 2.500 . 3.500 2.742 2.719 2.806 . 0 0 "[ . 1 . 2]" 1
4 1 1 G H2' 1 1 G H5'' 5.500 4.500 6.500 4.764 4.675 4.973 . 0 0 "[ . 1 . 2]" 1
5 1 1 G H2' 1 1 G H5' 4.500 3.500 5.500 5.305 5.216 5.343 . 0 0 "[ . 1 . 2]" 1
6 1 1 G H3' 1 1 G H8 3.500 2.500 4.500 2.783 2.562 3.223 . 0 0 "[ . 1 . 2]" 1
7 1 1 G H1' 1 1 G H3' 3.500 2.500 4.500 3.895 3.869 3.925 . 0 0 "[ . 1 . 2]" 1
8 1 1 G H2' 1 1 G H3' 2.500 . 3.500 2.357 2.343 2.366 . 0 0 "[ . 1 . 2]" 1
9 1 1 G H4' 1 1 G H8 4.500 3.500 5.500 4.211 4.103 4.435 . 0 0 "[ . 1 . 2]" 1
10 1 1 G H1' 1 1 G H4' 3.500 2.500 4.500 3.492 3.277 3.575 . 0 0 "[ . 1 . 2]" 1
11 1 1 G H2' 1 1 G H4' 4.500 3.500 5.500 3.902 3.870 3.931 . 0 0 "[ . 1 . 2]" 1
12 1 1 G H5' 1 1 G H8 4.500 3.500 5.500 3.641 3.484 3.995 0.016 18 0 "[ . 1 . 2]" 1
13 1 1 G H5'' 1 1 G H8 4.500 3.500 5.500 3.763 3.498 4.341 0.002 2 0 "[ . 1 . 2]" 1
14 1 1 G H8 1 2 G H8 4.500 3.500 5.500 5.202 4.718 5.507 0.007 7 0 "[ . 1 . 2]" 1
15 1 1 G H1' 1 2 G H8 4.500 3.500 5.500 5.083 4.900 5.295 . 0 0 "[ . 1 . 2]" 1
16 1 1 G H2' 1 2 G H8 2.500 . 2.500 2.378 2.194 2.504 0.004 14 0 "[ . 1 . 2]" 1
17 1 1 G H3' 1 2 G H8 3.000 . 4.000 3.133 2.874 3.338 . 0 0 "[ . 1 . 2]" 1
18 1 1 G H5' 1 2 G H8 5.500 4.500 6.500 6.676 6.435 6.880 0.380 6 0 "[ . 1 . 2]" 1
19 1 2 G H2' 1 2 G H8 3.500 2.500 4.500 3.577 3.365 3.761 . 0 0 "[ . 1 . 2]" 1
20 1 1 G H2' 1 2 G H1' 4.500 3.500 5.500 4.773 4.228 5.137 . 0 0 "[ . 1 . 2]" 1
21 1 2 G H1' 1 2 G H8 3.500 2.500 4.500 3.844 3.811 3.870 . 0 0 "[ . 1 . 2]" 1
22 1 2 G H1' 1 2 G H3' 3.500 2.500 4.500 3.880 3.858 3.903 . 0 0 "[ . 1 . 2]" 1
23 1 2 G H1' 1 3 C H5 5.000 4.000 6.000 5.194 4.819 5.463 . 0 0 "[ . 1 . 2]" 1
24 1 2 G H1' 1 3 C H6 4.500 3.500 5.500 4.931 4.758 5.124 . 0 0 "[ . 1 . 2]" 1
25 1 2 G H1' 1 3 C H5' 6.000 5.000 7.000 5.165 4.152 5.600 0.848 2 1 "[ + . 1 . 2]" 1
26 1 1 G H2' 1 2 G H2' 5.500 4.500 6.500 5.580 5.330 5.784 . 0 0 "[ . 1 . 2]" 1
27 1 2 G H1' 1 2 G H2' 2.500 . 3.500 2.714 2.689 2.752 . 0 0 "[ . 1 . 2]" 1
28 1 1 G H1' 1 2 G H5' 6.000 5.000 7.000 5.075 4.347 5.471 0.653 17 2 "[ . - 1 . + 2]" 1
29 1 2 G H5' 1 2 G H8 3.500 2.500 4.500 3.155 2.692 3.666 . 0 0 "[ . 1 . 2]" 1
30 1 2 G H5'' 1 2 G H8 3.500 2.500 4.500 3.725 3.408 4.128 . 0 0 "[ . 1 . 2]" 1
31 1 2 G H2' 1 3 C H5 3.500 2.500 4.500 2.976 2.484 3.533 0.016 4 0 "[ . 1 . 2]" 1
32 1 3 C H2' 1 3 C H5 5.500 4.500 6.500 4.949 4.792 5.041 . 0 0 "[ . 1 . 2]" 1
33 1 3 C H5 1 3 C H5' 5.500 4.500 6.500 5.612 5.105 6.051 . 0 0 "[ . 1 . 2]" 1
34 1 3 C H5 1 3 C H6 2.500 . 3.500 2.451 2.448 2.453 . 0 0 "[ . 1 . 2]" 1
35 1 3 C H5' 1 3 C H6 3.500 2.500 4.500 3.445 3.040 3.779 . 0 0 "[ . 1 . 2]" 1
36 1 2 G H2' 1 3 C H6 2.500 . 2.500 2.273 2.186 2.487 . 0 0 "[ . 1 . 2]" 1
37 1 2 G H3' 1 3 C H6 3.000 . 4.000 3.331 2.930 3.783 . 0 0 "[ . 1 . 2]" 1
38 1 2 G H1' 1 3 C H1' 5.500 4.500 6.500 6.005 5.500 6.509 0.009 7 0 "[ . 1 . 2]" 1
39 1 3 C H1' 1 3 C H6 3.500 2.500 4.500 3.684 3.649 3.717 . 0 0 "[ . 1 . 2]" 1
40 1 3 C H1' 1 3 C H5' 4.500 3.500 5.500 4.740 4.658 4.826 . 0 0 "[ . 1 . 2]" 1
41 1 3 C H2' 1 3 C H6 3.500 2.500 4.500 3.395 3.160 3.556 . 0 0 "[ . 1 . 2]" 1
42 1 3 C H1' 1 3 C H2' 2.500 . 3.500 2.752 2.718 2.796 . 0 0 "[ . 1 . 2]" 1
43 1 3 C H1' 1 3 C H3' 3.500 2.500 4.500 3.884 3.871 3.909 . 0 0 "[ . 1 . 2]" 1
44 1 3 C H3' 1 3 C H5 4.500 3.500 5.500 4.402 4.216 4.643 . 0 0 "[ . 1 . 2]" 1
45 1 3 C H1' 1 3 C H4' 3.500 2.500 4.500 3.416 3.244 3.574 . 0 0 "[ . 1 . 2]" 1
46 1 3 C H5'' 1 4 A H8 6.000 5.000 7.000 5.491 5.122 5.950 . 0 0 "[ . 1 . 2]" 1
47 1 3 C H5'' 1 3 C H6 4.000 3.000 5.000 3.697 3.382 4.018 . 0 0 "[ . 1 . 2]" 1
48 1 4 A H2 1 4 A H2' 5.500 4.500 6.500 4.982 4.831 5.203 . 0 0 "[ . 1 . 2]" 1
49 1 4 A H2 1 16 G H8 6.000 5.000 7.000 6.915 6.675 7.033 0.033 7 0 "[ . 1 . 2]" 1
50 1 3 C H1' 1 4 A H8 4.500 3.500 5.500 4.929 4.774 5.106 . 0 0 "[ . 1 . 2]" 1
51 1 3 C H2' 1 4 A H8 2.500 . 2.500 2.224 2.180 2.386 . 0 0 "[ . 1 . 2]" 1
52 1 3 C H3' 1 4 A H8 2.500 . 3.500 2.782 2.489 3.090 . 0 0 "[ . 1 . 2]" 1
53 1 4 A H4' 1 4 A H8 4.500 3.500 5.500 4.361 4.130 4.535 . 0 0 "[ . 1 . 2]" 1
54 1 4 A H8 1 5 C H5 4.500 3.500 5.500 4.498 4.243 4.673 . 0 0 "[ . 1 . 2]" 1
55 1 4 A H8 1 5 C H6 5.500 4.500 6.500 5.673 5.509 5.928 . 0 0 "[ . 1 . 2]" 1
56 1 4 A H1' 1 4 A H2 4.500 3.500 5.500 4.677 4.642 4.724 . 0 0 "[ . 1 . 2]" 1
57 1 4 A H1' 1 4 A H8 4.500 3.500 5.500 3.780 3.753 3.797 . 0 0 "[ . 1 . 2]" 1
58 1 4 A H1' 1 4 A H3' 3.500 2.500 4.500 3.898 3.866 3.945 . 0 0 "[ . 1 . 2]" 1
59 1 4 A H1' 1 4 A H4' 3.500 2.500 4.500 3.348 3.143 3.567 . 0 0 "[ . 1 . 2]" 1
60 1 4 A H2' 1 4 A H8 3.500 2.500 4.500 3.757 3.558 3.862 . 0 0 "[ . 1 . 2]" 1
61 1 4 A H1' 1 4 A H2' 2.500 . 3.500 2.773 2.710 2.845 . 0 0 "[ . 1 . 2]" 1
62 1 4 A H3' 1 4 A H8 3.500 2.500 4.500 3.057 2.823 3.332 . 0 0 "[ . 1 . 2]" 1
63 1 4 A H3' 1 5 C H6 3.000 . 4.000 3.469 3.236 3.615 . 0 0 "[ . 1 . 2]" 1
64 1 4 A H4' 1 5 C H6 5.500 4.500 6.500 5.380 5.270 5.450 . 0 0 "[ . 1 . 2]" 1
65 1 4 A H5' 1 4 A H8 4.500 3.500 5.500 3.986 3.523 4.358 . 0 0 "[ . 1 . 2]" 1
66 1 4 A H2' 1 5 C H5 3.500 2.500 4.500 2.834 2.454 3.230 0.046 17 0 "[ . 1 . 2]" 1
67 1 4 A H5'' 1 4 A H8 4.500 3.500 5.500 4.082 3.568 4.457 . 0 0 "[ . 1 . 2]" 1
68 1 4 A H3' 1 5 C H5 3.500 2.500 4.500 3.253 2.767 3.612 . 0 0 "[ . 1 . 2]" 1
69 1 4 A H4' 1 5 C H5 5.500 4.500 6.500 6.038 5.601 6.307 . 0 0 "[ . 1 . 2]" 1
70 1 4 A H1' 1 5 C H6 4.500 3.500 5.500 4.963 4.786 5.097 . 0 0 "[ . 1 . 2]" 1
71 1 4 A H2' 1 5 C H6 2.500 . 2.500 2.332 2.240 2.461 . 0 0 "[ . 1 . 2]" 1
72 1 5 C H5 1 5 C H6 2.500 . 3.500 2.450 2.449 2.453 . 0 0 "[ . 1 . 2]" 1
73 1 4 A H2 1 5 C H1' 5.000 4.000 6.000 4.986 4.691 5.297 . 0 0 "[ . 1 . 2]" 1
74 1 5 C H1' 1 5 C H6 3.500 2.500 4.500 3.668 3.639 3.698 . 0 0 "[ . 1 . 2]" 1
75 1 5 C H1' 1 5 C H5' 5.500 4.500 6.500 4.713 4.604 4.790 . 0 0 "[ . 1 . 2]" 1
76 1 5 C H1' 1 5 C H2' 2.500 . 3.500 2.754 2.726 2.793 . 0 0 "[ . 1 . 2]" 1
77 1 5 C H1' 1 5 C H3' 3.500 2.500 4.500 3.895 3.873 3.917 . 0 0 "[ . 1 . 2]" 1
78 1 5 C H1' 1 5 C H5'' 4.500 3.500 5.500 5.236 5.197 5.264 . 0 0 "[ . 1 . 2]" 1
79 1 5 C H1' 1 6 A H5' 4.500 3.500 5.500 5.392 5.012 5.517 0.017 4 0 "[ . 1 . 2]" 1
80 1 5 C H3' 1 5 C H5 4.500 3.500 5.500 4.487 4.287 4.743 . 0 0 "[ . 1 . 2]" 1
81 1 5 C H3' 1 5 C H6 3.000 . 4.000 2.499 2.245 2.736 . 0 0 "[ . 1 . 2]" 1
82 1 5 C H3' 1 6 A H8 3.000 . 4.000 3.042 2.650 3.392 . 0 0 "[ . 1 . 2]" 1
83 1 5 C H1' 1 5 C H4' 3.500 2.500 4.500 3.424 3.303 3.549 . 0 0 "[ . 1 . 2]" 1
84 1 5 C H5'' 1 5 C H6 3.000 . 4.000 3.741 3.440 3.950 . 0 0 "[ . 1 . 2]" 1
85 1 5 C H4' 1 5 C H6 3.500 2.500 4.500 3.939 3.803 4.069 . 0 0 "[ . 1 . 2]" 1
86 1 5 C H5' 1 5 C H6 4.000 3.000 5.000 3.314 3.004 3.619 . 0 0 "[ . 1 . 2]" 1
87 1 4 A H1' 1 5 C H5' 4.500 3.500 5.500 5.083 4.511 5.418 . 0 0 "[ . 1 . 2]" 1
88 1 5 C H5 1 5 C H5' 6.000 5.000 7.000 5.488 5.096 5.857 . 0 0 "[ . 1 . 2]" 1
89 1 6 A H2 1 14 G H1' 4.500 3.500 5.500 5.246 4.900 5.521 0.021 20 0 "[ . 1 . 2]" 1
90 1 6 A H2 1 6 A H2' 4.500 3.500 5.500 5.023 4.963 5.081 . 0 0 "[ . 1 . 2]" 1
91 1 6 A H2 1 7 G H2' 5.500 4.500 6.500 6.484 6.340 6.522 0.022 5 0 "[ . 1 . 2]" 1
92 1 5 C H6 1 6 A H8 5.500 4.500 6.500 4.779 4.490 5.186 0.010 15 0 "[ . 1 . 2]" 1
93 1 5 C H1' 1 6 A H8 4.500 3.500 5.500 4.977 4.881 5.039 . 0 0 "[ . 1 . 2]" 1
94 1 5 C H2' 1 6 A H8 2.500 . 2.500 2.237 2.176 2.314 . 0 0 "[ . 1 . 2]" 1
95 1 6 A H2 1 14 G H8 5.500 4.500 6.500 6.496 6.424 6.535 0.035 12 0 "[ . 1 . 2]" 1
96 1 6 A H1' 1 6 A H8 4.500 3.500 5.500 3.797 3.779 3.812 . 0 0 "[ . 1 . 2]" 1
97 1 6 A H1' 1 7 G H4' 5.500 4.500 6.500 5.656 5.407 5.875 . 0 0 "[ . 1 . 2]" 1
98 1 6 A H1' 1 7 G H5'' 5.500 4.500 6.500 6.346 6.187 6.665 0.165 12 0 "[ . 1 . 2]" 1
99 1 6 A H1' 1 6 A H5'' 5.000 4.000 6.000 5.203 5.181 5.243 . 0 0 "[ . 1 . 2]" 1
100 1 6 A H2' 1 6 A H8 4.500 3.500 5.500 3.745 3.666 3.803 . 0 0 "[ . 1 . 2]" 1
101 1 6 A H1' 1 6 A H2' 2.500 . 3.500 2.751 2.726 2.795 . 0 0 "[ . 1 . 2]" 1
102 1 6 A H3' 1 6 A H8 3.500 2.500 4.500 2.909 2.786 3.146 . 0 0 "[ . 1 . 2]" 1
103 1 6 A H1' 1 6 A H3' 3.500 2.500 4.500 3.900 3.883 3.921 . 0 0 "[ . 1 . 2]" 1
104 1 6 A H3' 1 7 G H8 3.000 . 4.000 2.602 2.433 2.792 . 0 0 "[ . 1 . 2]" 1
105 1 6 A H4' 1 6 A H8 4.500 3.500 5.500 4.251 4.114 4.418 . 0 0 "[ . 1 . 2]" 1
106 1 6 A H4' 1 7 G H8 5.500 4.500 6.500 5.283 5.185 5.407 . 0 0 "[ . 1 . 2]" 1
107 1 6 A H5'' 1 6 A H8 3.500 2.500 4.500 3.810 3.426 4.255 . 0 0 "[ . 1 . 2]" 1
108 1 6 A H5' 1 6 A H8 4.500 3.500 5.500 3.739 3.504 4.001 . 0 0 "[ . 1 . 2]" 1
109 1 6 A H8 1 7 G H8 5.500 4.500 6.500 4.639 4.486 4.924 0.014 19 0 "[ . 1 . 2]" 1
110 1 6 A H1' 1 7 G H8 4.500 3.500 5.500 5.175 5.104 5.241 . 0 0 "[ . 1 . 2]" 1
111 1 6 A H2' 1 7 G H8 2.500 . 2.500 2.487 2.422 2.527 0.027 15 0 "[ . 1 . 2]" 1
112 1 6 A H2 1 7 G H1' 3.000 . 4.000 3.796 3.656 3.870 . 0 0 "[ . 1 . 2]" 1
113 1 6 A H2' 1 7 G H1' 4.500 3.500 5.500 3.511 3.453 3.624 0.047 5 0 "[ . 1 . 2]" 1
114 1 7 G H1' 1 7 G H2' 2.500 . 3.500 2.730 2.715 2.740 . 0 0 "[ . 1 . 2]" 1
115 1 7 G H1' 1 7 G H8 4.500 3.500 5.500 3.805 3.776 3.844 . 0 0 "[ . 1 . 2]" 1
116 1 7 G H1' 1 7 G H5' 5.500 4.500 6.500 4.820 4.746 4.913 . 0 0 "[ . 1 . 2]" 1
117 1 7 G H1' 1 7 G H5'' 4.500 3.500 5.500 5.233 5.194 5.256 . 0 0 "[ . 1 . 2]" 1
118 1 7 G H1' 1 8 A H8 4.500 3.500 5.500 4.539 4.220 5.117 . 0 0 "[ . 1 . 2]" 1
119 1 7 G H2' 1 8 A H8 2.500 . 3.500 2.305 2.186 2.716 . 0 0 "[ . 1 . 2]" 1
120 1 7 G H2' 1 7 G H8 4.500 3.500 5.500 3.734 3.558 3.847 . 0 0 "[ . 1 . 2]" 1
121 1 7 G H3' 1 7 G H8 3.500 2.500 4.500 2.749 2.530 2.907 . 0 0 "[ . 1 . 2]" 1
122 1 7 G H3' 1 8 A H8 3.500 2.500 4.500 4.022 3.574 4.420 . 0 0 "[ . 1 . 2]" 1
123 1 7 G H1' 1 7 G H3' 4.500 3.500 5.500 3.880 3.860 3.904 . 0 0 "[ . 1 . 2]" 1
124 1 7 G H4' 1 7 G H8 3.500 2.500 4.500 4.176 4.115 4.229 . 0 0 "[ . 1 . 2]" 1
125 1 7 G H1' 1 7 G H4' 2.500 . 3.500 3.512 3.480 3.541 0.041 16 0 "[ . 1 . 2]" 1
126 1 7 G H5' 1 7 G H8 4.500 3.500 5.500 3.570 3.471 3.710 0.029 16 0 "[ . 1 . 2]" 1
127 1 7 G H5'' 1 7 G H8 4.500 3.500 5.500 3.729 3.590 3.853 . 0 0 "[ . 1 . 2]" 1
128 1 8 A H5' 1 8 A H8 4.500 3.500 4.500 4.322 4.170 4.466 . 0 0 "[ . 1 . 2]" 1
129 1 7 G H8 1 8 A H8 5.500 4.500 6.500 5.669 5.142 6.216 . 0 0 "[ . 1 . 2]" 1
130 1 8 A H8 1 12 A H2 6.500 5.500 7.500 7.132 6.121 7.498 . 0 0 "[ . 1 . 2]" 1
131 1 8 A H2 1 11 U H5 6.000 5.000 7.000 5.606 4.976 6.797 0.024 8 0 "[ . 1 . 2]" 1
132 1 8 A H2 1 11 U H1' 4.000 3.000 5.000 3.647 3.193 4.050 . 0 0 "[ . 1 . 2]" 1
133 1 8 A H2 1 11 U H2' 4.000 3.000 5.000 3.295 2.999 3.927 0.001 7 0 "[ . 1 . 2]" 1
134 1 8 A H2 1 11 U H3' 5.000 4.000 6.000 5.143 4.980 5.426 . 0 0 "[ . 1 . 2]" 1
135 1 8 A H2 1 11 U H4' 5.500 4.500 6.500 6.404 6.233 6.502 0.002 5 0 "[ . 1 . 2]" 1
136 1 8 A H2 1 11 U H5'' 6.500 5.500 7.500 6.032 5.693 6.556 . 0 0 "[ . 1 . 2]" 1
137 1 8 A H1' 1 8 A H2 4.500 3.500 5.500 4.714 4.600 4.837 . 0 0 "[ . 1 . 2]" 1
138 1 8 A H2 1 12 A H1' 4.500 3.500 5.500 4.341 3.684 4.700 . 0 0 "[ . 1 . 2]" 1
139 1 8 A H2 1 12 A H5' 5.000 4.000 6.000 4.138 3.981 4.457 0.019 14 0 "[ . 1 . 2]" 1
140 1 8 A H2 1 12 A H5'' 5.000 4.000 6.000 5.714 5.507 6.005 0.005 15 0 "[ . 1 . 2]" 1
141 1 8 A H2 1 11 U H6 5.500 4.500 6.500 4.879 4.492 5.793 0.008 7 0 "[ . 1 . 2]" 1
142 1 7 G H4' 1 8 A H1' 6.000 5.000 7.000 6.596 6.114 7.008 0.008 13 0 "[ . 1 . 2]" 1
143 1 8 A H1' 1 8 A H5' 5.500 4.500 5.500 5.029 4.874 5.119 . 0 0 "[ . 1 . 2]" 1
144 1 8 A H1' 1 8 A H8 3.500 2.500 4.500 3.762 3.686 3.838 . 0 0 "[ . 1 . 2]" 1
145 1 8 A H1' 1 8 A H2' 2.500 . 3.500 2.799 2.757 2.837 . 0 0 "[ . 1 . 2]" 1
146 1 8 A H1' 1 8 A H4' 3.500 2.500 4.500 3.251 3.119 3.400 . 0 0 "[ . 1 . 2]" 1
147 1 8 A H1' 1 8 A H5'' 5.500 4.500 6.500 4.852 4.505 5.163 . 0 0 "[ . 1 . 2]" 1
148 1 8 A H1' 1 12 A H2 5.000 4.000 6.000 4.613 4.082 5.048 . 0 0 "[ . 1 . 2]" 1
149 1 8 A H2' 1 8 A H8 4.500 3.500 5.500 3.804 3.544 4.052 . 0 0 "[ . 1 . 2]" 1
150 1 8 A H2' 1 9 G H1' 5.500 4.500 6.500 6.115 5.619 6.474 . 0 0 "[ . 1 . 2]" 1
151 1 8 A H3' 1 8 A H8 3.500 2.500 4.500 3.244 2.896 3.466 . 0 0 "[ . 1 . 2]" 1
152 1 8 A H1' 1 8 A H3' 4.500 3.500 5.500 3.901 3.865 3.924 . 0 0 "[ . 1 . 2]" 1
153 1 8 A H4' 1 8 A H8 5.500 4.500 6.500 4.473 4.402 4.536 0.098 5 0 "[ . 1 . 2]" 1
154 1 8 A H5'' 1 8 A H8 4.000 3.000 5.000 3.501 2.945 4.158 0.055 14 0 "[ . 1 . 2]" 1
155 1 9 G H1' 1 9 G H8 3.500 2.500 4.500 3.781 3.731 3.840 . 0 0 "[ . 1 . 2]" 1
156 1 8 A H1' 1 9 G H8 5.500 4.500 6.500 5.672 5.011 6.471 . 0 0 "[ . 1 . 2]" 1
157 1 8 A H2' 1 9 G H8 3.500 2.500 4.500 3.784 3.389 4.165 . 0 0 "[ . 1 . 2]" 1
158 1 8 A H3' 1 9 G H8 4.500 3.500 5.500 5.433 5.051 5.511 0.011 11 0 "[ . 1 . 2]" 1
159 1 9 G H2' 1 9 G H8 3.500 2.500 4.500 3.317 3.047 3.496 . 0 0 "[ . 1 . 2]" 1
160 1 9 G H3' 1 9 G H8 5.500 4.500 6.500 4.494 4.440 4.592 0.060 12 0 "[ . 1 . 2]" 1
161 1 9 G H4' 1 9 G H8 5.500 4.500 6.500 4.712 4.662 4.802 . 0 0 "[ . 1 . 2]" 1
162 1 9 G H5' 1 9 G H8 5.500 4.500 6.500 5.261 4.896 5.415 . 0 0 "[ . 1 . 2]" 1
163 1 9 G H8 1 10 U H5 4.500 3.500 5.500 5.048 4.465 5.422 . 0 0 "[ . 1 . 2]" 1
164 1 9 G H8 1 10 U H6 5.500 4.500 6.500 6.290 5.967 6.525 0.025 12 0 "[ . 1 . 2]" 1
165 1 9 G H1' 1 10 U H6 5.500 4.500 6.500 5.529 5.212 5.622 . 0 0 "[ . 1 . 2]" 1
166 1 9 G H1' 1 9 G H2' 2.500 . 3.500 3.007 2.995 3.021 . 0 0 "[ . 1 . 2]" 1
167 1 9 G H1' 1 9 G H3' 4.500 3.500 5.500 3.909 3.877 3.937 . 0 0 "[ . 1 . 2]" 1
168 1 9 G H1' 1 9 G H4' 3.500 2.500 4.500 2.829 2.750 2.907 . 0 0 "[ . 1 . 2]" 1
169 1 9 G H1' 1 10 U H3' 5.500 4.500 6.500 6.517 6.429 6.543 0.043 7 0 "[ . 1 . 2]" 1
170 1 9 G H1' 1 10 U H4' 6.000 5.000 7.000 6.838 6.638 6.981 . 0 0 "[ . 1 . 2]" 1
171 1 9 G H1' 1 10 U H5'' 5.000 4.000 6.000 4.145 3.975 4.422 0.025 20 0 "[ . 1 . 2]" 1
172 1 9 G H1' 1 10 U H5' 5.500 4.500 6.500 4.629 4.465 5.116 0.035 9 0 "[ . 1 . 2]" 1
173 1 9 G H1' 1 9 G H5' 5.500 4.500 6.500 4.873 4.744 4.918 . 0 0 "[ . 1 . 2]" 1
174 1 10 U H4' 1 10 U H5 5.500 4.500 6.500 6.492 6.421 6.514 0.014 18 0 "[ . 1 . 2]" 1
175 1 10 U H5 1 10 U H5'' 4.500 3.500 5.500 5.041 4.446 5.379 . 0 0 "[ . 1 . 2]" 1
176 1 9 G H3' 1 10 U H5 5.500 4.500 6.500 5.600 4.893 6.026 . 0 0 "[ . 1 . 2]" 1
177 1 10 U H5 1 10 U H6 2.500 . 3.500 2.423 2.421 2.425 . 0 0 "[ . 1 . 2]" 1
178 1 9 G H3' 1 10 U H6 5.000 4.000 6.000 4.872 4.233 5.201 . 0 0 "[ . 1 . 2]" 1
179 1 9 G H2' 1 10 U H6 3.500 2.500 4.500 3.441 2.927 3.877 . 0 0 "[ . 1 . 2]" 1
180 1 10 U H2' 1 10 U H6 2.500 . 3.500 2.207 2.184 2.326 . 0 0 "[ . 1 . 2]" 1
181 1 10 U H6 1 11 U H3' 4.500 3.500 5.500 5.445 5.248 5.542 0.042 20 0 "[ . 1 . 2]" 1
182 1 10 U H6 1 11 U H2' 4.500 3.500 5.500 4.746 4.539 5.084 . 0 0 "[ . 1 . 2]" 1
183 1 10 U H6 1 11 U H5'' 4.500 3.500 5.500 5.024 4.440 5.194 . 0 0 "[ . 1 . 2]" 1
184 1 10 U H6 1 11 U H5' 5.500 4.500 6.500 4.870 4.501 5.326 . 0 0 "[ . 1 . 2]" 1
185 1 10 U H6 1 12 A H8 7.000 6.000 8.000 7.641 7.239 7.988 . 0 0 "[ . 1 . 2]" 1
186 1 10 U H1' 1 10 U H2' 3.500 2.500 4.500 2.778 2.763 2.784 . 0 0 "[ . 1 . 2]" 1
187 1 10 U H2' 1 11 U H1' 4.500 3.500 5.500 3.861 3.661 4.359 . 0 0 "[ . 1 . 2]" 1
188 1 10 U H3' 1 10 U H5 3.500 2.500 4.500 4.489 4.458 4.505 0.005 8 0 "[ . 1 . 2]" 1
189 1 10 U H3' 1 10 U H6 3.000 . 4.000 2.175 2.148 2.189 . 0 0 "[ . 1 . 2]" 1
190 1 10 U H1' 1 10 U H3' 4.500 3.500 5.500 4.027 4.021 4.034 . 0 0 "[ . 1 . 2]" 1
191 1 10 U H3' 1 11 U H1' 3.500 2.500 4.500 4.058 3.423 4.249 . 0 0 "[ . 1 . 2]" 1
192 1 10 U H4' 1 10 U H6 3.500 2.500 4.500 4.223 4.153 4.244 . 0 0 "[ . 1 . 2]" 1
193 1 10 U H1' 1 10 U H4' 3.500 2.500 4.500 3.637 3.624 3.692 . 0 0 "[ . 1 . 2]" 1
194 1 10 U H5'' 1 10 U H6 4.000 3.000 5.000 3.495 2.941 3.805 0.059 4 0 "[ . 1 . 2]" 1
195 1 10 U H1' 1 10 U H5'' 4.500 3.500 5.500 4.446 4.270 4.546 . 0 0 "[ . 1 . 2]" 1
196 1 10 U H5' 1 10 U H6 3.500 2.500 4.500 2.629 2.456 3.166 0.044 2 0 "[ . 1 . 2]" 1
197 1 10 U H5 1 10 U H5' 4.500 3.500 5.500 4.395 4.163 5.026 . 0 0 "[ . 1 . 2]" 1
198 1 10 U H1' 1 10 U H5' 5.500 4.500 6.500 4.695 4.538 5.017 . 0 0 "[ . 1 . 2]" 1
199 1 10 U H4' 1 11 U H5 5.500 4.500 6.500 5.513 4.895 5.871 . 0 0 "[ . 1 . 2]" 1
200 1 11 U H5 1 11 U H5' 5.500 4.500 6.500 6.075 5.639 6.529 0.029 4 0 "[ . 1 . 2]" 1
201 1 11 U H5 1 11 U H5'' 4.500 3.500 5.500 5.109 4.744 5.463 . 0 0 "[ . 1 . 2]" 1
202 1 11 U H5 1 11 U H6 2.500 . 3.500 2.426 2.423 2.428 . 0 0 "[ . 1 . 2]" 1
203 1 11 U H3' 1 11 U H6 4.500 3.500 5.500 4.136 3.928 4.320 . 0 0 "[ . 1 . 2]" 1
204 1 11 U H4' 1 11 U H6 4.500 3.500 5.500 4.167 3.973 4.301 . 0 0 "[ . 1 . 2]" 1
205 1 11 U H1' 1 11 U H5 4.500 3.500 5.500 5.424 5.399 5.440 . 0 0 "[ . 1 . 2]" 1
206 1 11 U H1' 1 11 U H6 4.500 3.500 5.500 3.707 3.673 3.730 . 0 0 "[ . 1 . 2]" 1
207 1 11 U H1' 1 11 U H2' 2.500 . 3.500 3.012 2.993 3.025 . 0 0 "[ . 1 . 2]" 1
208 1 11 U H1' 1 11 U H3' 3.500 2.500 4.500 3.914 3.880 3.958 . 0 0 "[ . 1 . 2]" 1
209 1 11 U H1' 1 11 U H5'' 5.500 4.500 6.500 4.580 4.402 4.748 0.098 13 0 "[ . 1 . 2]" 1
210 1 11 U H1' 1 12 A H8 5.000 4.000 6.000 5.373 4.761 5.807 . 0 0 "[ . 1 . 2]" 1
211 1 11 U H2' 1 12 A H8 3.000 . 4.000 3.087 2.772 3.420 . 0 0 "[ . 1 . 2]" 1
212 1 11 U H2' 1 12 A H1' 5.500 4.500 6.500 5.987 5.580 6.514 0.014 14 0 "[ . 1 . 2]" 1
213 1 11 U H3' 1 12 A H8 3.500 2.500 4.500 3.446 3.227 3.726 . 0 0 "[ . 1 . 2]" 1
214 1 11 U H3' 1 11 U H5 5.500 4.500 6.500 6.409 6.246 6.530 0.030 8 0 "[ . 1 . 2]" 1
215 1 11 U H1' 1 11 U H4' 2.500 . 3.500 3.497 3.290 3.611 0.111 5 0 "[ . 1 . 2]" 1
216 1 11 U H1' 1 11 U H5' 4.500 3.500 5.500 5.066 5.013 5.098 . 0 0 "[ . 1 . 2]" 1
217 1 10 U H1' 1 11 U H5' 5.000 4.000 6.000 5.492 4.720 6.089 0.089 11 0 "[ . 1 . 2]" 1
218 1 11 U H5'' 1 11 U H6 3.500 2.500 4.500 2.899 2.533 3.240 . 0 0 "[ . 1 . 2]" 1
219 1 7 G H1' 1 12 A H2 5.000 4.000 6.000 5.898 5.785 6.000 . 0 0 "[ . 1 . 2]" 1
220 1 7 G H2' 1 12 A H2 6.000 5.000 7.000 6.985 6.905 7.041 0.041 16 0 "[ . 1 . 2]" 1
221 1 12 A H1' 1 12 A H2 5.500 4.500 5.500 4.529 4.495 4.567 0.005 9 0 "[ . 1 . 2]" 1
222 1 6 A H2 1 12 A H2 5.500 4.500 6.500 5.745 5.276 6.020 . 0 0 "[ . 1 . 2]" 1
223 1 8 A H2 1 12 A H2 5.500 4.500 6.500 5.316 4.615 5.870 . 0 0 "[ . 1 . 2]" 1
224 1 8 A H2 1 12 A H8 4.500 3.000 6.000 3.900 3.278 4.987 . 0 0 "[ . 1 . 2]" 1
225 1 12 A H2 1 13 U H1' 3.500 2.500 4.500 2.765 2.562 3.181 . 0 0 "[ . 1 . 2]" 1
226 1 12 A H2 1 13 U H6 6.500 5.500 7.500 5.613 5.454 5.936 0.046 4 0 "[ . 1 . 2]" 1
227 1 12 A H2 1 13 U H3' 6.500 5.500 7.500 6.441 6.232 6.804 . 0 0 "[ . 1 . 2]" 1
228 1 11 U H4' 1 12 A H8 5.000 4.000 6.000 6.007 5.931 6.042 0.042 17 0 "[ . 1 . 2]" 1
229 1 11 U H5'' 1 12 A H8 5.500 4.500 6.500 4.745 4.459 5.432 0.041 10 0 "[ . 1 . 2]" 1
230 1 12 A H1' 1 12 A H8 3.000 . 4.000 3.875 3.864 3.885 . 0 0 "[ . 1 . 2]" 1
231 1 12 A H1' 1 12 A H5'' 4.500 3.500 5.500 4.936 4.916 4.962 . 0 0 "[ . 1 . 2]" 1
232 1 12 A H1' 1 13 U H1' 3.500 3.500 4.500 3.922 3.689 4.219 . 0 0 "[ . 1 . 2]" 1
233 1 12 A H1' 1 13 U H6 3.500 2.500 4.500 2.904 2.526 3.209 . 0 0 "[ . 1 . 2]" 1
234 1 12 A H1' 1 12 A H2' 3.500 2.500 4.500 3.038 3.029 3.041 . 0 0 "[ . 1 . 2]" 1
235 1 12 A H2' 1 12 A H8 2.500 . 3.500 2.164 2.128 2.205 . 0 0 "[ . 1 . 2]" 1
236 1 12 A H2' 1 12 A H4' 3.500 2.500 4.500 3.861 3.846 3.890 . 0 0 "[ . 1 . 2]" 1
237 1 12 A H2' 1 12 A H5' 3.500 2.500 4.500 4.051 3.706 4.344 . 0 0 "[ . 1 . 2]" 1
238 1 12 A H2' 1 12 A H5'' 3.500 2.500 4.500 4.158 4.015 4.346 . 0 0 "[ . 1 . 2]" 1
239 1 12 A H1' 1 12 A H3' 3.500 2.500 4.500 3.799 3.779 3.837 . 0 0 "[ . 1 . 2]" 1
240 1 12 A H3' 1 12 A H8 4.500 3.500 5.500 4.385 4.269 4.427 . 0 0 "[ . 1 . 2]" 1
241 1 12 A H2' 1 13 U H6 3.500 2.500 4.500 3.016 2.787 3.201 . 0 0 "[ . 1 . 2]" 1
242 1 12 A H4' 1 12 A H8 4.500 3.500 5.500 5.160 5.058 5.235 . 0 0 "[ . 1 . 2]" 1
243 1 12 A H1' 1 12 A H4' 3.500 2.500 4.500 3.083 3.034 3.131 . 0 0 "[ . 1 . 2]" 1
244 1 12 A H5' 1 12 A H8 5.000 4.000 6.000 4.590 4.272 4.838 . 0 0 "[ . 1 . 2]" 1
245 1 12 A H1' 1 12 A H5' 4.500 3.500 5.500 4.576 4.468 4.650 . 0 0 "[ . 1 . 2]" 1
246 1 12 A H5'' 1 12 A H8 4.500 3.500 5.500 5.392 5.179 5.631 0.131 4 0 "[ . 1 . 2]" 1
247 1 11 U H1' 1 12 A H5'' 4.500 3.500 5.500 5.253 5.015 5.495 . 0 0 "[ . 1 . 2]" 1
248 1 12 A H2' 1 13 U H5 3.000 . 4.000 3.088 2.792 3.351 . 0 0 "[ . 1 . 2]" 1
249 1 13 U H3' 1 13 U H5 4.500 3.500 5.500 5.063 4.803 5.451 . 0 0 "[ . 1 . 2]" 1
250 1 12 A H8 1 13 U H6 4.500 3.500 5.500 3.958 3.671 4.185 . 0 0 "[ . 1 . 2]" 1
251 1 12 A H4' 1 13 U H6 4.500 3.500 5.500 5.355 5.140 5.503 0.003 8 0 "[ . 1 . 2]" 1
252 1 13 U H5 1 13 U H6 2.500 . 3.500 2.426 2.423 2.429 . 0 0 "[ . 1 . 2]" 1
253 1 13 U H3' 1 13 U H6 3.000 . 4.000 3.184 3.009 3.479 . 0 0 "[ . 1 . 2]" 1
254 1 12 A H3' 1 13 U H6 3.500 2.500 4.500 4.387 4.268 4.447 . 0 0 "[ . 1 . 2]" 1
255 1 13 U H4' 1 13 U H6 3.500 2.500 4.500 4.205 4.120 4.287 . 0 0 "[ . 1 . 2]" 1
256 1 13 U H5'' 1 13 U H6 4.000 3.000 5.000 4.280 4.018 4.516 . 0 0 "[ . 1 . 2]" 1
257 1 13 U H1' 1 13 U H6 3.500 2.500 4.500 3.570 3.528 3.627 . 0 0 "[ . 1 . 2]" 1
258 1 13 U H1' 1 13 U H5' 4.500 3.500 5.500 4.753 4.598 4.839 . 0 0 "[ . 1 . 2]" 1
259 1 13 U H2' 1 13 U H6 3.500 2.500 4.500 3.686 3.392 3.846 . 0 0 "[ . 1 . 2]" 1
260 1 13 U H1' 1 13 U H2' 2.500 . 3.500 2.821 2.769 2.889 . 0 0 "[ . 1 . 2]" 1
261 1 13 U H2' 1 14 G H1' 4.500 3.500 5.500 4.563 4.240 4.888 . 0 0 "[ . 1 . 2]" 1
262 1 13 U H3' 1 14 G H1' 5.500 4.500 6.500 6.439 6.172 6.577 0.077 8 0 "[ . 1 . 2]" 1
263 1 13 U H3' 1 14 G H8 3.000 . 4.000 3.232 2.881 3.523 . 0 0 "[ . 1 . 2]" 1
264 1 12 A H1' 1 13 U H3' 5.500 4.500 6.500 4.861 4.645 5.063 . 0 0 "[ . 1 . 2]" 1
265 1 13 U H5' 1 13 U H6 3.500 2.500 4.500 3.988 3.766 4.159 . 0 0 "[ . 1 . 2]" 1
266 1 13 U H6 1 14 G H8 5.500 4.500 6.500 5.717 5.302 5.927 . 0 0 "[ . 1 . 2]" 1
267 1 13 U H1' 1 14 G H8 4.500 3.500 5.500 5.042 4.697 5.183 . 0 0 "[ . 1 . 2]" 1
268 1 13 U H2' 1 14 G H8 2.500 . 2.500 2.460 2.358 2.520 0.020 10 0 "[ . 1 . 2]" 1
269 1 13 U H5' 1 14 G H8 5.500 4.500 6.500 6.644 6.426 6.815 0.315 9 0 "[ . 1 . 2]" 1
270 1 14 G H3' 1 14 G H8 3.500 2.500 4.500 2.782 2.694 2.853 . 0 0 "[ . 1 . 2]" 1
271 1 14 G H2' 1 14 G H8 3.500 2.500 4.500 3.836 3.762 3.887 . 0 0 "[ . 1 . 2]" 1
272 1 14 G H1' 1 14 G H8 3.500 2.500 4.500 3.781 3.767 3.796 . 0 0 "[ . 1 . 2]" 1
273 1 14 G H1' 1 14 G H2' 2.500 . 3.500 2.712 2.695 2.736 . 0 0 "[ . 1 . 2]" 1
274 1 14 G H1' 1 14 G H3' 3.500 2.500 4.500 3.857 3.830 3.875 . 0 0 "[ . 1 . 2]" 1
275 1 14 G H1' 1 15 U H5 4.500 3.500 5.500 5.371 5.142 5.510 0.010 1 0 "[ . 1 . 2]" 1
276 1 14 G H2' 1 15 U H5 3.000 . 4.000 2.866 2.575 3.002 . 0 0 "[ . 1 . 2]" 1
277 1 14 G H3' 1 15 U H5 3.500 2.500 4.500 2.886 2.749 3.160 . 0 0 "[ . 1 . 2]" 1
278 1 14 G H3' 1 15 U H6 3.000 . 4.000 3.517 3.433 3.635 . 0 0 "[ . 1 . 2]" 1
279 1 14 G H5' 1 14 G H8 4.500 3.500 5.500 3.571 3.370 3.842 0.130 20 0 "[ . 1 . 2]" 1
280 1 14 G H1' 1 14 G H5'' 4.000 3.000 5.000 5.219 5.194 5.239 0.239 3 0 "[ . 1 . 2]" 1
281 1 14 G H8 1 15 U H5 5.500 4.500 6.500 4.490 4.449 4.549 0.051 20 0 "[ . 1 . 2]" 1
282 1 15 U H3' 1 15 U H5 4.500 3.500 5.500 4.883 4.698 5.190 . 0 0 "[ . 1 . 2]" 1
283 1 14 G H2' 1 15 U H6 2.500 . 2.500 2.342 2.195 2.464 . 0 0 "[ . 1 . 2]" 1
284 1 15 U H2' 1 15 U H6 4.000 3.300 4.000 3.304 3.249 3.389 0.051 17 0 "[ . 1 . 2]" 1
285 1 15 U H5 1 15 U H6 2.500 . 3.500 2.425 2.423 2.428 . 0 0 "[ . 1 . 2]" 1
286 1 15 U H1' 1 15 U H6 3.500 2.500 4.500 3.684 3.665 3.714 . 0 0 "[ . 1 . 2]" 1
287 1 15 U H1' 1 15 U H3' 3.500 2.500 4.500 4.024 4.007 4.040 . 0 0 "[ . 1 . 2]" 1
288 1 15 U H1' 1 15 U H5'' 4.500 3.500 5.500 5.184 5.148 5.235 . 0 0 "[ . 1 . 2]" 1
289 1 15 U H3' 1 15 U H6 2.500 . 3.500 2.872 2.653 3.148 . 0 0 "[ . 1 . 2]" 1
290 1 15 U H1' 1 15 U H4' 3.500 2.500 4.500 3.593 3.497 3.634 . 0 0 "[ . 1 . 2]" 1
291 1 15 U H4' 1 16 G H8 6.000 5.000 7.000 5.479 5.363 5.566 . 0 0 "[ . 1 . 2]" 1
292 1 15 U H4' 1 15 U H6 4.500 3.500 5.500 3.874 3.848 3.987 . 0 0 "[ . 1 . 2]" 1
293 1 15 U H5'' 1 15 U H6 4.000 3.000 5.000 3.287 3.194 3.502 . 0 0 "[ . 1 . 2]" 1
294 1 15 U H1' 1 16 G H8 5.500 4.500 6.500 5.097 4.959 5.179 . 0 0 "[ . 1 . 2]" 1
295 1 15 U H2' 1 16 G H8 2.500 . 2.500 2.353 2.195 2.436 . 0 0 "[ . 1 . 2]" 1
296 1 15 U H3' 1 16 G H8 3.000 . 4.000 2.885 2.594 3.197 . 0 0 "[ . 1 . 2]" 1
297 1 16 G H4' 1 16 G H8 4.500 3.500 5.500 4.437 4.264 4.661 . 0 0 "[ . 1 . 2]" 1
298 1 16 G H5'' 1 16 G H8 4.500 3.500 5.500 4.356 4.055 4.836 . 0 0 "[ . 1 . 2]" 1
299 1 4 A H2 1 16 G H1' 5.000 4.000 6.000 5.979 5.781 6.050 0.050 18 0 "[ . 1 . 2]" 1
300 1 16 G H1' 1 16 G H8 3.500 2.500 4.500 3.845 3.828 3.873 . 0 0 "[ . 1 . 2]" 1
301 1 16 G H1' 1 17 C H5' 5.500 4.500 6.500 5.068 4.504 5.856 . 0 0 "[ . 1 . 2]" 1
302 1 16 G H1' 1 17 C H1' 5.500 4.500 6.500 6.220 5.586 6.505 0.005 6 0 "[ . 1 . 2]" 1
303 1 16 G H2' 1 16 G H8 3.500 2.500 4.500 3.395 3.158 3.519 . 0 0 "[ . 1 . 2]" 1
304 1 16 G H3' 1 16 G H8 2.500 . 3.500 2.795 2.369 3.475 . 0 0 "[ . 1 . 2]" 1
305 1 16 G H1' 1 16 G H3' 3.500 2.500 4.500 3.904 3.863 3.952 . 0 0 "[ . 1 . 2]" 1
306 1 16 G H1' 1 16 G H4' 3.500 2.500 4.500 3.241 2.952 3.408 . 0 0 "[ . 1 . 2]" 1
307 1 16 G H5' 1 16 G H8 4.500 3.500 5.500 4.099 3.591 4.569 . 0 0 "[ . 1 . 2]" 1
308 1 16 G H4' 1 17 C H5 6.000 5.000 7.000 6.069 5.822 6.404 . 0 0 "[ . 1 . 2]" 1
309 1 16 G H1' 1 17 C H5 4.500 3.500 5.500 5.038 4.732 5.425 . 0 0 "[ . 1 . 2]" 1
310 1 16 G H3' 1 17 C H5 3.500 2.500 4.500 3.459 2.996 3.888 . 0 0 "[ . 1 . 2]" 1
311 1 16 G H3' 1 17 C H6 3.000 . 4.000 3.547 3.187 3.765 . 0 0 "[ . 1 . 2]" 1
312 1 16 G H2' 1 17 C H6 2.500 . 2.500 2.266 2.182 2.456 . 0 0 "[ . 1 . 2]" 1
313 1 17 C H5 1 17 C H6 3.500 2.500 4.500 2.458 2.457 2.460 0.043 15 0 "[ . 1 . 2]" 1
314 1 17 C H2' 1 17 C H6 3.500 2.500 4.500 3.229 3.035 3.519 . 0 0 "[ . 1 . 2]" 1
315 1 17 C H3' 1 17 C H6 2.500 . 3.500 2.343 2.185 2.812 . 0 0 "[ . 1 . 2]" 1
316 1 17 C H1' 1 17 C H6 3.000 . 4.000 3.698 3.638 3.722 . 0 0 "[ . 1 . 2]" 1
317 1 17 C H1' 1 17 C H5'' 4.500 3.500 5.500 5.205 5.141 5.257 . 0 0 "[ . 1 . 2]" 1
318 1 17 C H1' 1 17 C H2' 2.500 . 3.500 2.778 2.743 2.813 . 0 0 "[ . 1 . 2]" 1
319 1 17 C H2' 1 18 C H5 3.500 2.500 4.500 3.426 3.178 3.726 . 0 0 "[ . 1 . 2]" 1
320 1 17 C H1' 1 17 C H3' 3.500 2.500 4.500 3.898 3.883 3.916 . 0 0 "[ . 1 . 2]" 1
321 1 17 C H3' 1 18 C H5 3.500 2.500 4.500 3.192 2.871 3.549 . 0 0 "[ . 1 . 2]" 1
322 1 17 C H3' 1 17 C H5 5.000 4.000 6.000 4.464 4.274 4.810 . 0 0 "[ . 1 . 2]" 1
323 1 17 C H4' 1 17 C H6 3.500 2.500 4.500 4.039 3.889 4.152 . 0 0 "[ . 1 . 2]" 1
324 1 17 C H1' 1 17 C H4' 3.500 2.500 4.500 3.331 3.195 3.495 . 0 0 "[ . 1 . 2]" 1
325 1 16 G H1' 1 17 C H4' 6.000 5.000 7.000 6.770 6.263 7.005 0.005 9 0 "[ . 1 . 2]" 1
326 1 17 C H5'' 1 17 C H6 3.500 2.500 4.500 3.987 3.701 4.225 . 0 0 "[ . 1 . 2]" 1
327 1 17 C H5' 1 17 C H6 4.000 3.000 5.000 3.512 3.026 4.005 . 0 0 "[ . 1 . 2]" 1
328 1 17 C H1' 1 17 C H5' 5.500 4.500 6.500 4.653 4.558 4.805 . 0 0 "[ . 1 . 2]" 1
329 1 17 C H1' 1 18 C H6 4.500 3.500 5.500 5.016 4.907 5.191 . 0 0 "[ . 1 . 2]" 1
330 1 17 C H2' 1 18 C H6 2.500 . 2.500 2.255 2.195 2.443 . 0 0 "[ . 1 . 2]" 1
331 1 17 C H3' 1 18 C H6 3.000 . 4.000 2.930 2.727 3.061 . 0 0 "[ . 1 . 2]" 1
332 1 17 C H4' 1 18 C H6 5.500 4.500 6.500 5.421 5.262 5.561 . 0 0 "[ . 1 . 2]" 1
333 1 17 C H5' 1 18 C H6 5.500 4.500 6.500 6.465 6.212 6.522 0.022 9 0 "[ . 1 . 2]" 1
334 1 18 C H5 1 18 C H6 2.500 . 3.500 2.452 2.450 2.452 . 0 0 "[ . 1 . 2]" 1
335 1 18 C H4' 1 18 C H6 3.500 2.500 4.500 4.096 3.961 4.197 . 0 0 "[ . 1 . 2]" 1
336 1 18 C H5'' 1 18 C H6 4.000 3.000 5.000 3.936 3.569 4.167 . 0 0 "[ . 1 . 2]" 1
337 1 17 C H2' 1 18 C H1' 4.500 3.500 5.500 3.897 3.578 4.193 . 0 0 "[ . 1 . 2]" 1
338 1 18 C H1' 1 18 C H5 4.500 3.500 5.500 5.377 5.357 5.391 . 0 0 "[ . 1 . 2]" 1
339 1 18 C H1' 1 18 C H6 3.500 2.500 4.500 3.643 3.611 3.664 . 0 0 "[ . 1 . 2]" 1
340 1 18 C H2' 1 18 C H6 4.500 3.500 5.500 3.540 3.474 3.668 0.026 6 0 "[ . 1 . 2]" 1
341 1 18 C H2' 1 18 C H5 4.500 3.500 5.500 5.026 4.972 5.129 . 0 0 "[ . 1 . 2]" 1
342 1 18 C H1' 1 18 C H2' 3.500 2.500 4.500 2.790 2.748 2.828 . 0 0 "[ . 1 . 2]" 1
343 1 18 C H3' 1 18 C H6 3.500 2.500 4.500 2.681 2.553 2.844 . 0 0 "[ . 1 . 2]" 1
344 1 18 C H1' 1 18 C H4' 3.500 2.500 4.500 3.251 3.125 3.414 . 0 0 "[ . 1 . 2]" 1
345 1 18 C H5 1 18 C H5' 5.500 4.500 6.500 6.121 5.861 6.361 . 0 0 "[ . 1 . 2]" 1
346 1 18 C H5' 1 18 C H6 3.500 2.500 4.500 3.829 3.604 4.035 . 0 0 "[ . 1 . 2]" 1
347 1 18 C H1' 1 18 C H5' 4.500 3.500 5.500 4.785 4.722 4.882 . 0 0 "[ . 1 . 2]" 1
348 1 17 C H1' 1 18 C H5'' 6.000 5.000 7.000 7.151 6.739 7.450 0.450 12 0 "[ . 1 . 2]" 1
349 1 18 C H5 1 18 C H5'' 6.000 5.000 7.000 6.178 5.699 6.464 . 0 0 "[ . 1 . 2]" 1
350 1 1 G H1 1 18 C H41 3.500 2.500 3.500 3.055 2.597 3.449 . 0 0 "[ . 1 . 2]" 1
351 1 2 G H1 1 17 C H42 3.500 2.500 4.500 3.489 3.369 3.710 . 0 0 "[ . 1 . 2]" 1
352 1 2 G H1 1 18 C H41 4.500 3.500 5.500 4.465 3.966 4.728 . 0 0 "[ . 1 . 2]" 1
353 1 2 G H1 1 18 C H42 4.500 3.500 5.500 5.272 4.763 5.480 . 0 0 "[ . 1 . 2]" 1
354 1 3 C H41 1 15 U H3 4.500 3.500 5.500 4.444 4.207 4.822 . 0 0 "[ . 1 . 2]" 1
355 1 6 A H2 1 13 U H3 2.500 . 3.500 2.748 2.300 3.139 . 0 0 "[ . 1 . 2]" 1
356 1 7 G H22 1 13 U H3 5.000 4.000 6.000 4.361 4.020 4.793 . 0 0 "[ . 1 . 2]" 1
357 1 13 U H3 1 14 G H1 3.000 . 4.000 4.074 4.057 4.092 0.092 6 0 "[ . 1 . 2]" 1
358 1 5 C H41 1 14 G H1 2.500 . 3.500 1.807 1.773 1.899 0.027 8 0 "[ . 1 . 2]" 1
359 1 5 C H42 1 14 G H1 3.500 2.500 4.500 3.408 3.357 3.476 . 0 0 "[ . 1 . 2]" 1
360 1 4 A H2 1 15 U H3 2.500 . 3.500 2.357 2.277 2.503 . 0 0 "[ . 1 . 2]" 1
361 1 14 G H1 1 15 U H3 3.000 . 4.000 3.993 3.930 4.024 0.024 2 0 "[ . 1 . 2]" 1
362 1 4 A N1 1 15 U H3 . . 2.200 1.842 1.777 1.915 0.023 17 0 "[ . 1 . 2]" 1
363 1 15 U H3 1 16 G H1 3.500 2.500 4.500 4.521 4.475 4.555 0.055 12 0 "[ . 1 . 2]" 1
364 1 2 G H1 1 16 G H1 2.500 . 3.500 3.530 3.514 3.556 0.056 9 0 "[ . 1 . 2]" 1
365 1 3 C H41 1 16 G H1 2.500 . 3.500 1.836 1.771 1.976 0.029 7 0 "[ . 1 . 2]" 1
366 1 3 C H42 1 16 G H1 3.500 2.500 4.500 3.464 3.374 3.563 . 0 0 "[ . 1 . 2]" 1
367 1 2 G H1 1 17 C H41 2.500 . 3.500 1.873 1.759 2.110 . 0 0 "[ . 1 . 2]" 1
368 1 2 G H1 1 17 C N4 2.500 . 3.500 2.523 2.393 2.734 . 0 0 "[ . 1 . 2]" 1
369 1 3 C H41 1 4 A N6 3.500 2.500 4.500 3.260 2.767 3.745 . 0 0 "[ . 1 . 2]" 1
370 1 3 C H42 1 4 A N6 3.500 2.500 4.500 3.076 2.635 3.714 . 0 0 "[ . 1 . 2]" 1
371 1 3 C H42 1 16 G N1 3.500 2.500 4.500 4.275 4.142 4.372 . 0 0 "[ . 1 . 2]" 1
372 1 4 A H2 1 14 G N1 4.000 3.000 5.000 5.030 5.009 5.066 0.066 7 0 "[ . 1 . 2]" 1
373 1 4 A H2 1 15 U N3 3.000 . 4.000 3.117 3.070 3.227 . 0 0 "[ . 1 . 2]" 1
374 1 4 A N6 1 5 C H41 3.500 2.500 4.500 3.822 3.486 4.031 . 0 0 "[ . 1 . 2]" 1
375 1 5 C H41 1 6 A N6 3.500 2.500 4.500 4.048 3.695 4.346 . 0 0 "[ . 1 . 2]" 1
376 1 5 C H41 1 14 G N1 2.500 . 3.500 2.489 2.416 2.571 . 0 0 "[ . 1 . 2]" 1
377 1 5 C H42 1 6 A N6 4.000 3.000 5.000 3.949 3.475 4.397 . 0 0 "[ . 1 . 2]" 1
378 1 5 C H42 1 14 G N1 3.500 2.500 4.500 4.208 4.134 4.282 . 0 0 "[ . 1 . 2]" 1
379 1 6 A N6 1 7 G H22 4.500 3.500 5.500 4.252 3.770 4.705 . 0 0 "[ . 1 . 2]" 1
380 1 8 A N6 1 12 A H62 4.500 3.500 5.500 3.645 3.469 4.052 0.031 19 0 "[ . 1 . 2]" 1
381 1 7 G H22 1 12 A N6 3.500 2.500 4.500 2.574 2.478 2.836 0.022 16 0 "[ . 1 . 2]" 1
382 1 4 A N6 1 14 G H1 4.500 4.000 5.500 4.589 4.077 4.888 . 0 0 "[ . 1 . 2]" 1
383 1 5 C H41 1 5 C N3 3.500 2.500 4.500 2.515 2.512 2.519 . 0 0 "[ . 1 . 2]" 1
384 1 5 C N3 1 14 G H1 . . 2.200 1.981 1.883 2.057 . 0 0 "[ . 1 . 2]" 1
385 1 5 C N3 1 15 U H3 3.500 2.500 4.500 4.542 4.517 4.564 0.064 12 0 "[ . 1 . 2]" 1
386 1 5 C N4 1 14 G H1 2.500 . 3.500 2.442 2.386 2.500 . 0 0 "[ . 1 . 2]" 1
387 1 6 A N6 1 14 G H1 5.500 4.500 6.500 4.520 4.450 4.673 0.050 17 0 "[ . 1 . 2]" 1
388 1 14 G H1 1 15 U N3 3.500 2.500 4.500 4.410 4.335 4.499 . 0 0 "[ . 1 . 2]" 1
389 1 3 C N4 1 15 U H3 4.500 3.500 5.500 5.013 4.779 5.382 . 0 0 "[ . 1 . 2]" 1
390 1 4 A N6 1 15 U H3 2.500 . 3.500 3.354 3.189 3.494 . 0 0 "[ . 1 . 2]" 1
391 1 14 G N1 1 15 U H3 4.500 3.500 5.500 3.912 3.836 3.986 . 0 0 "[ . 1 . 2]" 1
392 1 3 C N4 1 16 G H1 2.500 . 3.500 2.501 2.401 2.584 . 0 0 "[ . 1 . 2]" 1
393 1 4 A N6 1 16 G H1 4.000 3.000 5.000 4.242 3.724 4.662 . 0 0 "[ . 1 . 2]" 1
394 1 16 G H1 1 17 C N4 4.500 3.500 5.500 4.257 3.925 4.672 . 0 0 "[ . 1 . 2]" 1
395 1 2 G N1 1 17 C H41 2.500 . 3.500 2.539 2.395 2.771 . 0 0 "[ . 1 . 2]" 1
396 1 2 G N1 1 17 C H42 3.500 2.500 4.500 4.267 4.133 4.489 . 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 34
_Distance_constraint_stats_list.Viol_count 83
_Distance_constraint_stats_list.Viol_total 23.146
_Distance_constraint_stats_list.Viol_max 0.039
_Distance_constraint_stats_list.Viol_rms 0.0059
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0017
_Distance_constraint_stats_list.Viol_average_violations_only 0.0139
_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 0.030 0.010 4 0 "[ . 1 . 2]"
1 2 G 0.050 0.020 12 0 "[ . 1 . 2]"
1 3 C 0.210 0.032 4 0 "[ . 1 . 2]"
1 4 A 0.035 0.014 14 0 "[ . 1 . 2]"
1 5 C 0.134 0.026 12 0 "[ . 1 . 2]"
1 6 A 0.391 0.039 17 0 "[ . 1 . 2]"
1 7 G 0.307 0.037 17 0 "[ . 1 . 2]"
1 12 A 0.307 0.037 17 0 "[ . 1 . 2]"
1 13 U 0.391 0.039 17 0 "[ . 1 . 2]"
1 14 G 0.134 0.026 12 0 "[ . 1 . 2]"
1 15 U 0.035 0.014 14 0 "[ . 1 . 2]"
1 16 G 0.210 0.032 4 0 "[ . 1 . 2]"
1 17 C 0.050 0.020 12 0 "[ . 1 . 2]"
1 18 C 0.030 0.010 4 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 18 C N3 2.000 . 2.200 2.084 1.892 2.204 0.004 4 0 "[ . 1 . 2]" 2
2 1 1 G N1 1 18 C N3 2.900 2.600 3.200 3.058 2.878 3.210 0.010 4 0 "[ . 1 . 2]" 2
3 1 1 G O6 1 18 C H41 2.000 . 2.200 2.017 1.869 2.203 0.003 6 0 "[ . 1 . 2]" 2
4 1 1 G O6 1 18 C N4 2.900 2.600 3.200 2.989 2.821 3.176 . 0 0 "[ . 1 . 2]" 2
5 1 1 G H21 1 18 C O2 2.000 . 2.200 2.034 1.801 2.203 0.003 2 0 "[ . 1 . 2]" 2
6 1 1 G N2 1 18 C O2 2.900 2.600 3.200 3.025 2.801 3.175 . 0 0 "[ . 1 . 2]" 2
7 1 2 G H1 1 17 C N3 2.000 . 2.200 2.025 1.891 2.182 . 0 0 "[ . 1 . 2]" 2
8 1 2 G N1 1 17 C N3 2.900 2.600 3.200 2.982 2.837 3.141 . 0 0 "[ . 1 . 2]" 2
9 1 2 G O6 1 17 C H41 2.000 . 2.200 2.016 1.796 2.166 0.004 7 0 "[ . 1 . 2]" 2
10 1 2 G O6 1 17 C N4 2.900 2.600 3.200 2.991 2.758 3.144 . 0 0 "[ . 1 . 2]" 2
11 1 2 G H21 1 17 C O2 2.000 . 2.200 1.923 1.780 2.214 0.020 12 0 "[ . 1 . 2]" 2
12 1 2 G N2 1 17 C O2 2.900 2.600 3.200 2.842 2.647 3.167 . 0 0 "[ . 1 . 2]" 2
13 1 3 C N3 1 16 G H1 2.000 . 2.200 2.055 1.907 2.172 . 0 0 "[ . 1 . 2]" 2
14 1 3 C N3 1 16 G N1 2.900 2.600 3.200 2.997 2.863 3.114 . 0 0 "[ . 1 . 2]" 2
15 1 3 C H41 1 16 G O6 2.000 . 2.200 2.126 1.868 2.232 0.032 4 0 "[ . 1 . 2]" 2
16 1 3 C N4 1 16 G O6 2.900 2.600 3.200 3.104 2.845 3.212 0.012 16 0 "[ . 1 . 2]" 2
17 1 3 C O2 1 16 G H21 2.000 . 2.200 1.876 1.768 2.130 0.032 5 0 "[ . 1 . 2]" 2
18 1 3 C O2 1 16 G N2 2.900 2.600 3.200 2.767 2.633 3.067 . 0 0 "[ . 1 . 2]" 2
19 1 4 A N1 1 15 U N3 2.900 2.600 3.200 2.833 2.769 2.906 . 0 0 "[ . 1 . 2]" 2
20 1 4 A H61 1 15 U O4 2.000 . 2.200 2.134 1.976 2.214 0.014 14 0 "[ . 1 . 2]" 2
21 1 4 A N6 1 15 U O4 2.900 2.600 3.200 3.101 2.943 3.181 . 0 0 "[ . 1 . 2]" 2
22 1 5 C N3 1 14 G N1 2.900 2.600 3.200 2.920 2.843 2.982 . 0 0 "[ . 1 . 2]" 2
23 1 5 C H41 1 14 G O6 2.000 . 2.200 2.027 1.849 2.218 0.018 15 0 "[ . 1 . 2]" 2
24 1 5 C N4 1 14 G O6 2.900 2.600 3.200 3.003 2.830 3.207 0.007 15 0 "[ . 1 . 2]" 2
25 1 5 C O2 1 14 G H21 2.000 . 2.200 1.839 1.774 1.927 0.026 12 0 "[ . 1 . 2]" 2
26 1 5 C O2 1 14 G N2 2.900 2.600 3.200 2.721 2.587 2.852 0.013 12 0 "[ . 1 . 2]" 2
27 1 6 A N1 1 13 U H3 2.000 . 2.200 1.787 1.761 1.890 0.039 17 0 "[ . 1 . 2]" 2
28 1 6 A N1 1 13 U N3 2.900 2.600 3.200 2.747 2.696 2.871 . 0 0 "[ . 1 . 2]" 2
29 1 6 A H61 1 13 U O4 2.000 . 2.200 2.055 1.951 2.221 0.021 12 0 "[ . 1 . 2]" 2
30 1 6 A N6 1 13 U O4 2.900 2.600 3.200 3.040 2.943 3.205 0.005 12 0 "[ . 1 . 2]" 2
31 1 7 G N3 1 12 A N6 2.900 2.600 3.200 2.599 2.567 2.666 0.033 13 0 "[ . 1 . 2]" 2
32 1 7 G N3 1 12 A H62 2.000 . 2.200 1.899 1.808 1.946 . 0 0 "[ . 1 . 2]" 2
33 1 7 G H22 1 12 A N7 2.000 . 2.200 2.139 1.929 2.237 0.037 17 0 "[ . 1 . 2]" 2
34 1 7 G N2 1 12 A N7 2.900 2.600 3.200 3.063 2.885 3.155 . 0 0 "[ . 1 . 2]" 2
stop_
save_
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