NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
545080 |
2lub   |
18515 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lub
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 422
_Distance_constraint_stats_list.Viol_count 183
_Distance_constraint_stats_list.Viol_total 187.114
_Distance_constraint_stats_list.Viol_max 0.684
_Distance_constraint_stats_list.Viol_rms 0.0281
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0044
_Distance_constraint_stats_list.Viol_average_violations_only 0.1022
_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 0.233 0.086 3 0 "[ . 1]"
1 2 G 0.000 0.000 . 0 "[ . 1]"
1 3 G 0.000 0.000 . 0 "[ . 1]"
1 4 U 0.000 0.000 . 0 "[ . 1]"
1 5 G 0.000 0.000 . 0 "[ . 1]"
1 6 A 0.000 0.000 . 0 "[ . 1]"
1 7 A 0.000 0.000 . 0 "[ . 1]"
1 8 A 0.000 0.000 . 0 "[ . 1]"
1 9 C 0.083 0.047 10 0 "[ . 1]"
1 10 G 1.218 0.353 4 0 "[ . 1]"
1 11 G 0.265 0.161 7 0 "[ . 1]"
1 12 A 0.000 0.000 . 0 "[ . 1]"
1 13 G 0.060 0.060 8 0 "[ . 1]"
1 14 G 0.060 0.060 8 0 "[ . 1]"
1 15 A 0.000 0.000 . 0 "[ . 1]"
1 16 C 1.373 0.327 1 0 "[ . 1]"
1 17 U 5.530 0.684 1 1 "[+ . 1]"
1 18 U 3.810 0.684 1 1 "[+ . 1]"
1 19 C 4.940 0.335 8 0 "[ . 1]"
1 20 G 0.010 0.010 9 0 "[ . 1]"
1 21 G 0.000 0.000 . 0 "[ . 1]"
1 22 U 0.000 0.000 . 0 "[ . 1]"
1 23 C 1.767 0.207 10 0 "[ . 1]"
1 24 C 0.025 0.025 2 0 "[ . 1]"
1 25 U 1.288 0.220 4 0 "[ . 1]"
1 26 C 0.182 0.062 4 0 "[ . 1]"
1 27 A 1.630 0.274 6 0 "[ . 1]"
1 28 A 1.357 0.238 2 0 "[ . 1]"
1 29 G 1.247 0.201 6 0 "[ . 1]"
1 30 U 0.153 0.076 10 0 "[ . 1]"
1 31 U 0.398 0.086 2 0 "[ . 1]"
1 32 U 0.000 0.000 . 0 "[ . 1]"
1 33 C 0.018 0.015 10 0 "[ . 1]"
1 34 A 0.060 0.037 2 0 "[ . 1]"
1 35 C 0.715 0.116 10 0 "[ . 1]"
1 36 C 0.792 0.122 10 0 "[ . 1]"
1 37 C 0.171 0.059 6 0 "[ . 1]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 G H1' 1 1 G H2' 2.510 . 3.140 2.795 2.751 2.863 . 0 0 "[ . 1]" 1
2 1 1 G H1' 1 1 G H3' 3.720 2.330 5.110 3.925 3.850 3.965 . 0 0 "[ . 1]" 1
3 1 1 G H1' 1 1 G H4' 3.140 2.160 4.120 3.525 3.255 3.713 . 0 0 "[ . 1]" 1
4 1 1 G H1' 1 1 G H8 3.340 2.220 4.460 3.557 3.494 3.672 . 0 0 "[ . 1]" 1
5 1 1 G H2' 1 1 G H8 3.260 2.200 4.320 4.273 4.021 4.406 0.086 3 0 "[ . 1]" 1
6 1 1 G H3' 1 1 G H8 3.160 2.160 4.160 3.651 3.269 3.918 . 0 0 "[ . 1]" 1
7 1 1 G H4' 1 1 G H8 4.350 2.460 6.240 4.290 4.133 4.496 . 0 0 "[ . 1]" 1
8 1 1 G H5' 1 1 G H8 4.180 2.430 5.930 4.202 3.951 4.524 . 0 0 "[ . 1]" 1
9 1 1 G H5'' 1 1 G H8 3.370 2.230 4.510 3.033 2.269 4.208 . 0 0 "[ . 1]" 1
10 1 1 G H8 1 2 G H8 4.600 2.480 6.500 4.954 4.552 5.197 . 0 0 "[ . 1]" 1
11 1 1 G H2' 1 2 G H1' 4.330 2.450 6.210 3.491 2.918 3.853 . 0 0 "[ . 1]" 1
12 1 2 G H1' 1 2 G H2' 2.630 . 3.320 2.854 2.818 2.884 . 0 0 "[ . 1]" 1
13 1 2 G H1' 1 2 G H3' 3.590 2.300 4.880 3.919 3.891 3.952 . 0 0 "[ . 1]" 1
14 1 1 G H1' 1 2 G H8 4.190 2.440 5.940 5.011 4.775 5.414 . 0 0 "[ . 1]" 1
15 1 1 G H2' 1 2 G H8 2.600 . 3.270 2.487 2.094 3.211 . 0 0 "[ . 1]" 1
16 1 1 G H3' 1 2 G H8 3.320 2.220 4.420 2.637 2.331 3.141 . 0 0 "[ . 1]" 1
17 1 2 G H1' 1 2 G H8 3.550 2.290 4.810 3.505 3.449 3.555 . 0 0 "[ . 1]" 1
18 1 2 G H2' 1 2 G H8 3.340 2.230 4.450 4.258 4.188 4.312 . 0 0 "[ . 1]" 1
19 1 2 G H2' 1 3 G H1' 3.620 2.310 4.930 3.616 3.429 3.791 . 0 0 "[ . 1]" 1
20 1 3 G H1' 1 3 G H2' 2.370 . 2.930 2.693 2.681 2.717 . 0 0 "[ . 1]" 1
21 1 2 G H1' 1 3 G H8 5.710 2.440 6.500 4.940 4.833 5.064 . 0 0 "[ . 1]" 1
22 1 2 G H2' 1 3 G H8 2.530 . 3.170 2.127 2.026 2.249 . 0 0 "[ . 1]" 1
23 1 2 G H3' 1 3 G H8 3.460 2.270 4.650 2.735 2.557 2.932 . 0 0 "[ . 1]" 1
24 1 3 G H1' 1 3 G H8 3.860 2.370 5.350 3.597 3.557 3.631 . 0 0 "[ . 1]" 1
25 1 3 G H2' 1 3 G H8 3.540 2.290 4.790 4.332 4.276 4.392 . 0 0 "[ . 1]" 1
26 1 3 G H8 1 4 U H5 4.570 2.480 6.500 4.544 4.438 4.723 . 0 0 "[ . 1]" 1
27 1 4 U H1' 1 4 U H2' 2.650 . 3.350 2.856 2.839 2.886 . 0 0 "[ . 1]" 1
28 1 4 U H2' 1 4 U H5 5.480 2.470 6.500 5.380 5.318 5.459 . 0 0 "[ . 1]" 1
29 1 3 G H1' 1 4 U H6 5.010 2.500 6.500 4.608 4.521 4.743 . 0 0 "[ . 1]" 1
30 1 3 G H2' 1 4 U H6 2.110 . 2.560 2.195 2.080 2.364 . 0 0 "[ . 1]" 1
31 1 4 U H1' 1 4 U H6 3.170 2.160 4.180 3.454 3.439 3.477 . 0 0 "[ . 1]" 1
32 1 4 U H5 1 4 U H6 2.600 . 3.280 2.394 2.387 2.402 . 0 0 "[ . 1]" 1
33 1 5 G H1' 1 5 G H2' 2.620 . 3.310 2.654 2.640 2.738 . 0 0 "[ . 1]" 1
34 1 4 U H1' 1 5 G H8 4.820 2.500 6.500 5.259 4.986 5.571 . 0 0 "[ . 1]" 1
35 1 4 U H2' 1 5 G H8 2.630 . 3.320 2.416 2.167 2.731 . 0 0 "[ . 1]" 1
36 1 5 G H1' 1 5 G H8 3.890 2.380 5.400 3.689 3.642 3.705 . 0 0 "[ . 1]" 1
37 1 5 G H2' 1 5 G H8 3.710 2.330 5.090 4.255 3.944 4.420 . 0 0 "[ . 1]" 1
38 1 5 G H2' 1 6 A H1' 3.980 2.390 5.570 3.778 3.578 3.994 . 0 0 "[ . 1]" 1
39 1 6 A H1' 1 6 A H2' 2.580 . 3.240 2.799 2.782 2.830 . 0 0 "[ . 1]" 1
40 1 6 A H1' 1 6 A H3' 4.180 2.440 5.920 3.910 3.886 3.936 . 0 0 "[ . 1]" 1
41 1 6 A H1' 1 6 A H2 4.680 2.490 6.500 5.008 4.984 5.027 . 0 0 "[ . 1]" 1
42 1 5 G H1' 1 6 A H8 4.870 2.500 6.500 4.900 4.775 5.140 . 0 0 "[ . 1]" 1
43 1 5 G H2' 1 6 A H8 2.730 . 3.480 2.408 2.147 2.820 . 0 0 "[ . 1]" 1
44 1 6 A H3' 1 6 A H8 3.290 2.200 4.380 3.483 3.345 3.627 . 0 0 "[ . 1]" 1
45 1 7 A H1' 1 7 A H2' 2.550 . 3.200 2.828 2.793 2.886 . 0 0 "[ . 1]" 1
46 1 6 A H2 1 7 A H2 4.390 2.460 6.320 4.402 4.311 4.478 . 0 0 "[ . 1]" 1
47 1 7 A H1' 1 7 A H2 4.710 2.490 6.500 4.936 4.908 4.987 . 0 0 "[ . 1]" 1
48 1 6 A H1' 1 7 A H8 4.940 2.500 6.500 4.776 4.693 4.854 . 0 0 "[ . 1]" 1
49 1 6 A H2' 1 7 A H8 2.510 . 3.140 2.091 2.047 2.197 . 0 0 "[ . 1]" 1
50 1 6 A H3' 1 7 A H8 3.840 2.370 5.310 2.767 2.595 2.924 . 0 0 "[ . 1]" 1
51 1 7 A H2' 1 7 A H8 3.700 2.330 5.070 4.136 4.050 4.243 . 0 0 "[ . 1]" 1
52 1 8 A H1' 1 8 A H2' 2.480 . 3.100 2.854 2.807 2.914 . 0 0 "[ . 1]" 1
53 1 8 A H1' 1 8 A H3' 3.890 2.380 5.400 3.939 3.921 3.975 . 0 0 "[ . 1]" 1
54 1 7 A H2 1 8 A H2 4.450 2.470 6.430 4.627 4.456 4.872 . 0 0 "[ . 1]" 1
55 1 8 A H1' 1 8 A H2 3.770 2.350 5.190 5.003 4.876 5.108 . 0 0 "[ . 1]" 1
56 1 8 A H2' 1 8 A H8 3.900 2.380 5.420 4.264 4.114 4.381 . 0 0 "[ . 1]" 1
57 1 8 A H3' 1 8 A H8 4.110 2.420 5.800 3.948 3.668 4.271 . 0 0 "[ . 1]" 1
58 1 9 C H1' 1 9 C H2' 2.550 . 3.200 2.899 2.851 2.944 . 0 0 "[ . 1]" 1
59 1 8 A H1' 1 9 C H6 4.610 2.480 6.500 4.896 4.713 5.058 . 0 0 "[ . 1]" 1
60 1 8 A H2' 1 9 C H6 2.460 . 3.060 2.134 2.066 2.297 . 0 0 "[ . 1]" 1
61 1 8 A H3' 1 9 C H6 3.980 2.400 5.560 3.160 2.889 3.351 . 0 0 "[ . 1]" 1
62 1 9 C H1' 1 9 C H6 3.470 2.260 4.680 3.481 3.401 3.612 . 0 0 "[ . 1]" 1
63 1 9 C H2' 1 9 C H6 3.290 2.200 4.380 3.852 3.481 4.049 . 0 0 "[ . 1]" 1
64 1 9 C H3' 1 9 C H6 3.020 2.110 3.930 3.567 3.087 3.949 0.019 1 0 "[ . 1]" 1
65 1 9 C H5 1 9 C H6 2.550 . 3.200 2.427 2.415 2.436 . 0 0 "[ . 1]" 1
66 1 9 C H5'' 1 9 C H6 4.000 2.400 5.600 4.357 4.091 4.681 . 0 0 "[ . 1]" 1
67 1 9 C H2' 1 10 G H1' 3.930 2.390 5.470 4.743 3.680 5.144 . 0 0 "[ . 1]" 1
68 1 10 G H1' 1 10 G H2' 2.810 2.020 3.600 2.922 2.751 3.067 . 0 0 "[ . 1]" 1
69 1 10 G H1' 1 10 G H3' 3.890 2.370 5.410 3.967 3.782 4.114 . 0 0 "[ . 1]" 1
70 1 9 C H1' 1 10 G H8 4.740 2.500 6.500 4.798 4.086 6.377 . 0 0 "[ . 1]" 1
71 1 9 C H2' 1 10 G H8 2.860 2.040 3.680 2.901 2.242 3.697 0.017 2 0 "[ . 1]" 1
72 1 9 C H6 1 10 G H8 4.770 2.500 6.500 5.522 4.705 6.116 . 0 0 "[ . 1]" 1
73 1 10 G H1' 1 10 G H8 3.410 2.250 4.570 3.285 2.546 3.725 . 0 0 "[ . 1]" 1
74 1 10 G H2' 1 10 G H8 3.170 2.170 4.170 3.038 2.088 4.523 0.353 4 0 "[ . 1]" 1
75 1 11 G H1' 1 11 G H2' 2.770 . 3.540 2.846 2.795 2.904 . 0 0 "[ . 1]" 1
76 1 10 G H1' 1 11 G H8 4.150 2.420 5.880 3.820 2.767 5.574 . 0 0 "[ . 1]" 1
77 1 10 G H2' 1 11 G H8 3.370 2.230 4.510 3.802 2.413 4.503 . 0 0 "[ . 1]" 1
78 1 10 G H3' 1 11 G H8 3.530 2.290 4.770 4.193 3.600 4.931 0.161 7 0 "[ . 1]" 1
79 1 11 G H1' 1 11 G H8 3.520 2.280 4.760 3.324 2.980 3.521 . 0 0 "[ . 1]" 1
80 1 11 G H2' 1 11 G H8 3.440 2.260 4.620 4.466 4.246 4.725 0.105 3 0 "[ . 1]" 1
81 1 12 A H1' 1 12 A H2' 2.780 2.010 3.550 2.793 2.761 2.820 . 0 0 "[ . 1]" 1
82 1 11 G H1' 1 12 A H8 4.310 2.450 6.170 5.479 5.112 5.957 . 0 0 "[ . 1]" 1
83 1 11 G H2' 1 12 A H8 3.010 2.100 3.920 2.878 2.324 3.892 . 0 0 "[ . 1]" 1
84 1 12 A H1' 1 12 A H8 4.410 2.460 6.360 3.740 3.699 3.774 . 0 0 "[ . 1]" 1
85 1 12 A H2' 1 12 A H8 4.250 2.450 6.050 3.877 3.762 4.007 . 0 0 "[ . 1]" 1
86 1 12 A H8 1 13 G H8 5.950 2.410 6.500 4.127 4.006 4.231 . 0 0 "[ . 1]" 1
87 1 12 A H2' 1 13 G H1' 3.390 2.240 4.540 3.153 2.800 3.546 . 0 0 "[ . 1]" 1
88 1 13 G H1' 1 13 G H3' 3.230 2.190 4.270 3.759 3.736 3.803 . 0 0 "[ . 1]" 1
89 1 12 A H1' 1 13 G H8 5.380 2.490 6.500 4.674 4.509 5.055 . 0 0 "[ . 1]" 1
90 1 12 A H2' 1 13 G H8 2.470 . 3.080 2.259 2.068 2.796 . 0 0 "[ . 1]" 1
91 1 13 G H1' 1 13 G H8 3.960 2.390 5.530 3.557 3.529 3.577 . 0 0 "[ . 1]" 1
92 1 13 G H2' 1 13 G H8 3.920 2.380 5.460 4.349 4.299 4.388 . 0 0 "[ . 1]" 1
93 1 13 G H3' 1 13 G H8 2.980 2.090 3.870 3.319 3.231 3.497 . 0 0 "[ . 1]" 1
94 1 13 G H5'' 1 13 G H8 3.760 2.340 5.180 4.171 3.992 4.374 . 0 0 "[ . 1]" 1
95 1 13 G H2' 1 14 G H1' 3.170 2.160 4.180 4.106 4.046 4.240 0.060 8 0 "[ . 1]" 1
96 1 14 G H1' 1 14 G H2' 2.530 . 3.170 2.717 2.707 2.725 . 0 0 "[ . 1]" 1
97 1 14 G H1' 1 14 G H5'' 5.980 2.400 6.500 5.150 5.119 5.189 . 0 0 "[ . 1]" 1
98 1 13 G H1' 1 14 G H8 4.860 2.500 6.500 4.837 4.761 4.963 . 0 0 "[ . 1]" 1
99 1 13 G H2' 1 14 G H8 2.340 . 2.890 2.381 2.278 2.533 . 0 0 "[ . 1]" 1
100 1 13 G H3' 1 14 G H8 3.140 2.150 4.130 2.509 2.429 2.599 . 0 0 "[ . 1]" 1
101 1 13 G H8 1 14 G H8 4.540 2.480 6.500 4.942 4.807 5.001 . 0 0 "[ . 1]" 1
102 1 14 G H1' 1 14 G H8 3.410 2.250 4.570 3.444 3.424 3.468 . 0 0 "[ . 1]" 1
103 1 14 G H2' 1 14 G H8 3.650 2.320 4.980 4.487 4.461 4.524 . 0 0 "[ . 1]" 1
104 1 14 G H3' 1 14 G H8 3.280 2.200 4.360 3.703 3.511 3.819 . 0 0 "[ . 1]" 1
105 1 14 G H5'' 1 14 G H8 3.750 2.340 5.160 4.414 4.309 4.587 . 0 0 "[ . 1]" 1
106 1 15 A H1' 1 15 A H2 4.810 2.500 6.500 5.343 5.264 5.389 . 0 0 "[ . 1]" 1
107 1 14 G H1' 1 15 A H8 4.760 2.490 6.500 4.872 4.620 5.034 . 0 0 "[ . 1]" 1
108 1 14 G H2' 1 15 A H8 2.530 . 3.170 2.680 2.222 2.902 . 0 0 "[ . 1]" 1
109 1 14 G H3' 1 15 A H8 2.950 2.080 3.820 2.559 2.297 2.806 . 0 0 "[ . 1]" 1
110 1 15 A H1' 1 15 A H8 3.610 2.300 4.920 3.262 3.166 3.378 . 0 0 "[ . 1]" 1
111 1 15 A H2' 1 16 C H1' 3.740 2.340 5.140 3.634 2.606 3.948 . 0 0 "[ . 1]" 1
112 1 16 C H1' 1 16 C H2' 2.350 . 2.900 2.793 2.778 2.827 . 0 0 "[ . 1]" 1
113 1 15 A H2' 1 16 C H5 3.880 2.370 5.390 3.608 3.251 4.156 . 0 0 "[ . 1]" 1
114 1 15 A H1' 1 16 C H6 4.770 2.490 6.500 4.885 4.732 4.956 . 0 0 "[ . 1]" 1
115 1 15 A H2' 1 16 C H6 2.470 . 3.080 2.287 2.085 2.462 . 0 0 "[ . 1]" 1
116 1 15 A H3' 1 16 C H6 2.670 . 3.380 2.367 2.110 2.909 . 0 0 "[ . 1]" 1
117 1 16 C H1' 1 16 C H6 3.420 2.250 3.800 3.163 3.142 3.247 . 0 0 "[ . 1]" 1
118 1 16 C H2' 1 16 C H6 3.320 2.220 4.420 4.422 4.284 4.455 0.035 8 0 "[ . 1]" 1
119 1 16 C H3' 1 16 C H6 2.880 2.050 3.710 3.665 3.630 3.690 . 0 0 "[ . 1]" 1
120 1 16 C H4' 1 16 C H6 3.470 2.270 4.670 4.214 4.159 4.344 . 0 0 "[ . 1]" 1
121 1 16 C H5 1 16 C H6 2.400 . 2.800 2.437 2.430 2.442 . 0 0 "[ . 1]" 1
122 1 16 C H5' 1 16 C H6 3.320 2.220 4.420 4.209 4.011 4.535 0.115 3 0 "[ . 1]" 1
123 1 16 C H5'' 1 16 C H6 3.780 2.350 5.210 4.081 3.224 4.549 . 0 0 "[ . 1]" 1
124 1 16 C H6 1 17 U H5 4.230 2.440 6.020 3.364 3.178 3.742 . 0 0 "[ . 1]" 1
125 1 17 U H1' 1 17 U H2' 2.420 . 2.800 2.838 2.820 2.861 0.061 7 0 "[ . 1]" 1
126 1 17 U H1' 1 17 U H3' 3.420 2.250 4.590 3.920 3.902 3.948 . 0 0 "[ . 1]" 1
127 1 16 C H5 1 17 U H5 3.360 2.230 4.490 2.932 2.737 2.983 . 0 0 "[ . 1]" 1
128 1 16 C H1' 1 17 U H6 4.220 2.440 6.000 4.943 4.814 5.541 . 0 0 "[ . 1]" 1
129 1 16 C H2' 1 17 U H6 2.730 . 3.480 3.570 3.434 3.807 0.327 1 0 "[ . 1]" 1
130 1 16 C H3' 1 17 U H6 3.090 2.130 4.050 2.606 2.425 2.978 . 0 0 "[ . 1]" 1
131 1 16 C H6 1 17 U H6 4.230 2.440 6.020 3.911 3.800 4.276 . 0 0 "[ . 1]" 1
132 1 17 U H1' 1 17 U H6 3.330 2.220 4.440 3.528 3.485 3.784 . 0 0 "[ . 1]" 1
133 1 17 U H2' 1 17 U H6 3.520 2.280 4.760 3.880 3.189 4.018 . 0 0 "[ . 1]" 1
134 1 17 U H3' 1 17 U H6 2.730 . 3.470 3.377 3.006 3.479 0.009 7 0 "[ . 1]" 1
135 1 17 U H4' 1 17 U H6 3.480 2.270 4.690 4.314 4.271 4.512 . 0 0 "[ . 1]" 1
136 1 17 U H5 1 17 U H6 2.450 . 3.050 2.427 2.376 2.438 . 0 0 "[ . 1]" 1
137 1 17 U H6 1 19 C H5 5.420 2.480 6.500 6.348 5.700 6.472 . 0 0 "[ . 1]" 1
138 1 18 U H1' 1 18 U H2' 3.070 2.130 4.010 3.057 3.041 3.072 . 0 0 "[ . 1]" 1
139 1 18 U H1' 1 18 U H3' 3.510 2.280 4.740 3.926 3.886 3.962 . 0 0 "[ . 1]" 1
140 1 18 U H1' 1 18 U H4' 3.090 2.140 4.040 3.331 3.278 3.398 . 0 0 "[ . 1]" 1
141 1 18 U H1' 1 18 U H5' 4.900 2.500 6.500 4.620 4.505 4.662 . 0 0 "[ . 1]" 1
142 1 17 U H1' 1 18 U H5 5.020 2.500 6.500 5.070 4.952 5.222 . 0 0 "[ . 1]" 1
143 1 17 U H4' 1 18 U H5 3.180 2.170 4.190 2.307 2.188 2.555 . 0 0 "[ . 1]" 1
144 1 18 U H2' 1 18 U H5 4.540 2.480 6.500 4.475 4.401 4.524 . 0 0 "[ . 1]" 1
145 1 17 U H1' 1 18 U H6 5.170 2.500 6.500 4.535 4.406 4.652 . 0 0 "[ . 1]" 1
146 1 17 U H2' 1 18 U H6 . 2.490 3.800 4.021 3.924 4.484 0.684 1 1 "[+ . 1]" 1
147 1 17 U H3' 1 18 U H6 3.270 2.200 4.340 4.207 4.181 4.246 . 0 0 "[ . 1]" 1
148 1 18 U H1' 1 18 U H6 3.740 2.340 5.140 3.748 3.729 3.765 . 0 0 "[ . 1]" 1
149 1 18 U H2' 1 18 U H6 2.320 . 2.860 2.328 2.303 2.378 . 0 0 "[ . 1]" 1
150 1 18 U H3' 1 18 U H6 4.150 2.430 5.870 3.987 3.854 4.142 . 0 0 "[ . 1]" 1
151 1 18 U H4' 1 18 U H6 3.840 2.370 5.310 4.580 4.526 4.646 . 0 0 "[ . 1]" 1
152 1 18 U H5' 1 18 U H6 4.190 2.430 5.950 3.857 3.623 4.040 . 0 0 "[ . 1]" 1
153 1 18 U H5'' 1 18 U H6 4.280 2.440 6.120 4.387 4.288 4.508 . 0 0 "[ . 1]" 1
154 1 18 U H6 1 19 C H5 5.010 2.500 6.500 4.518 4.437 4.589 . 0 0 "[ . 1]" 1
155 1 18 U H6 1 19 C H6 6.500 2.250 6.500 5.353 5.283 5.435 . 0 0 "[ . 1]" 1
156 1 18 U H3' 1 19 C H1' 5.560 2.470 6.500 5.427 5.335 5.615 . 0 0 "[ . 1]" 1
157 1 19 C H1' 1 19 C H2' 2.910 2.060 3.760 3.043 3.038 3.052 . 0 0 "[ . 1]" 1
158 1 17 U H2' 1 19 C H5 2.260 . 2.770 2.606 2.476 2.658 . 0 0 "[ . 1]" 1
159 1 17 U H3' 1 19 C H5 4.260 2.440 6.080 4.120 3.980 4.225 . 0 0 "[ . 1]" 1
160 1 18 U H2' 1 19 C H5 3.700 2.330 5.070 3.967 3.782 4.154 . 0 0 "[ . 1]" 1
161 1 18 U H3' 1 19 C H5 2.160 . 2.630 2.758 2.518 2.965 0.335 8 0 "[ . 1]" 1
162 1 18 U H4' 1 19 C H5 4.400 2.470 6.330 4.464 4.340 4.723 . 0 0 "[ . 1]" 1
163 1 19 C H2' 1 19 C H5 4.290 2.450 6.130 4.931 4.836 4.988 . 0 0 "[ . 1]" 1
164 1 17 U H1' 1 19 C H6 6.120 2.370 6.500 5.503 5.194 5.628 . 0 0 "[ . 1]" 1
165 1 17 U H2' 1 19 C H6 . 2.430 3.800 3.983 3.905 4.087 0.287 1 0 "[ . 1]" 1
166 1 18 U H1' 1 19 C H6 5.390 2.490 6.500 5.832 5.690 5.930 . 0 0 "[ . 1]" 1
167 1 18 U H2' 1 19 C H6 3.540 2.290 4.790 3.682 3.540 3.819 . 0 0 "[ . 1]" 1
168 1 18 U H3' 1 19 C H6 1.830 . 2.200 2.032 1.951 2.100 . 0 0 "[ . 1]" 1
169 1 19 C H1' 1 19 C H6 3.080 2.130 4.030 3.598 3.584 3.635 . 0 0 "[ . 1]" 1
170 1 19 C H2' 1 19 C H6 2.360 . 2.920 3.082 2.963 3.123 0.203 4 0 "[ . 1]" 1
171 1 19 C H3' 1 19 C H6 3.430 2.250 4.610 4.370 4.269 4.492 . 0 0 "[ . 1]" 1
172 1 19 C H4' 1 19 C H6 4.240 2.440 6.040 4.185 4.118 4.264 . 0 0 "[ . 1]" 1
173 1 19 C H5 1 19 C H6 2.390 . 2.960 2.427 2.413 2.440 . 0 0 "[ . 1]" 1
174 1 19 C H5' 1 19 C H6 3.420 2.250 4.590 3.435 3.115 3.909 . 0 0 "[ . 1]" 1
175 1 19 C H5'' 1 19 C H6 4.820 2.490 6.500 4.144 4.049 4.233 . 0 0 "[ . 1]" 1
176 1 19 C H4' 1 20 G H1' 3.420 2.250 4.590 4.524 4.452 4.585 . 0 0 "[ . 1]" 1
177 1 19 C H5'' 1 20 G H1' 4.710 2.490 6.500 5.115 4.846 5.295 . 0 0 "[ . 1]" 1
178 1 20 G H1' 1 20 G H2' 2.650 . 3.350 2.840 2.824 2.851 . 0 0 "[ . 1]" 1
179 1 20 G H1' 1 20 G H3' 4.060 2.410 5.710 3.898 3.881 3.929 . 0 0 "[ . 1]" 1
180 1 20 G H1' 1 20 G H5' 5.190 2.500 6.500 5.133 5.120 5.147 . 0 0 "[ . 1]" 1
181 1 20 G H2' 1 20 G H3' 2.610 . 3.290 2.389 2.368 2.427 . 0 0 "[ . 1]" 1
182 1 20 G H3' 1 20 G H5' 3.270 2.200 4.340 2.968 2.855 3.064 . 0 0 "[ . 1]" 1
183 1 20 G H3' 1 20 G H5'' 2.590 . 3.260 2.557 2.528 2.614 . 0 0 "[ . 1]" 1
184 1 19 C H4' 1 20 G H8 5.190 2.490 6.500 5.739 5.677 5.788 . 0 0 "[ . 1]" 1
185 1 19 C H5' 1 20 G H8 5.280 2.500 6.500 5.010 4.712 5.174 . 0 0 "[ . 1]" 1
186 1 19 C H5'' 1 20 G H8 5.860 2.420 6.500 6.239 5.927 6.510 0.010 9 0 "[ . 1]" 1
187 1 20 G H3' 1 21 G H8 3.670 2.320 5.020 2.728 2.607 2.873 . 0 0 "[ . 1]" 1
188 1 21 G H1' 1 21 G H8 3.490 2.270 4.710 3.685 3.638 3.737 . 0 0 "[ . 1]" 1
189 1 21 G H2' 1 21 G H8 3.960 2.390 5.530 4.041 3.839 4.140 . 0 0 "[ . 1]" 1
190 1 21 G H3' 1 21 G H8 3.170 2.160 4.180 3.111 2.858 3.302 . 0 0 "[ . 1]" 1
191 1 21 G H4' 1 21 G H8 4.180 2.430 5.930 4.275 4.238 4.412 . 0 0 "[ . 1]" 1
192 1 21 G H5' 1 21 G H8 3.660 2.320 5.000 4.154 4.096 4.329 . 0 0 "[ . 1]" 1
193 1 21 G H5'' 1 21 G H8 3.050 2.120 3.980 3.571 3.405 3.975 . 0 0 "[ . 1]" 1
194 1 21 G H8 1 22 U H5 4.730 2.490 6.500 4.437 4.272 4.774 . 0 0 "[ . 1]" 1
195 1 22 U H1' 1 22 U H2' 2.410 . 2.990 2.808 2.797 2.822 . 0 0 "[ . 1]" 1
196 1 21 G H2' 1 22 U H5 3.820 2.360 5.280 4.155 3.886 4.638 . 0 0 "[ . 1]" 1
197 1 21 G H1' 1 22 U H6 4.230 2.440 6.020 5.164 4.982 5.339 . 0 0 "[ . 1]" 1
198 1 21 G H2' 1 22 U H6 2.500 . 3.130 2.525 2.284 2.802 . 0 0 "[ . 1]" 1
199 1 21 G H3' 1 22 U H6 3.410 2.250 4.570 3.167 2.935 3.483 . 0 0 "[ . 1]" 1
200 1 22 U H1' 1 22 U H6 3.180 2.170 4.190 3.517 3.495 3.538 . 0 0 "[ . 1]" 1
201 1 22 U H2' 1 22 U H6 3.670 2.320 5.020 3.957 3.875 4.034 . 0 0 "[ . 1]" 1
202 1 22 U H3' 1 22 U H6 3.220 2.180 4.260 2.999 2.918 3.120 . 0 0 "[ . 1]" 1
203 1 22 U H5 1 22 U H6 2.530 . 3.170 2.408 2.403 2.414 . 0 0 "[ . 1]" 1
204 1 22 U H5' 1 22 U H6 3.250 2.190 4.310 4.069 3.987 4.247 . 0 0 "[ . 1]" 1
205 1 22 U H5'' 1 22 U H6 4.300 2.450 6.150 3.865 3.764 4.005 . 0 0 "[ . 1]" 1
206 1 22 U H6 1 23 C H5 4.230 2.440 6.020 4.547 4.141 4.745 . 0 0 "[ . 1]" 1
207 1 23 C H1' 1 23 C H2' 2.480 . 3.090 2.707 2.697 2.723 . 0 0 "[ . 1]" 1
208 1 22 U H2' 1 23 C H5 3.590 2.300 4.880 3.682 3.453 4.033 . 0 0 "[ . 1]" 1
209 1 22 U H5 1 23 C H5 3.950 2.390 5.510 4.399 4.042 4.618 . 0 0 "[ . 1]" 1
210 1 23 C H5 1 24 C H5 3.750 2.350 5.150 3.437 3.354 3.537 . 0 0 "[ . 1]" 1
211 1 22 U H1' 1 23 C H6 4.270 2.440 6.100 4.808 4.724 4.944 . 0 0 "[ . 1]" 1
212 1 22 U H2' 1 23 C H6 2.100 . 2.540 2.117 2.012 2.304 . 0 0 "[ . 1]" 1
213 1 22 U H3' 1 23 C H6 2.850 2.040 3.660 3.286 3.103 3.443 . 0 0 "[ . 1]" 1
214 1 22 U H5 1 23 C H6 5.310 2.490 6.500 5.911 5.677 6.139 . 0 0 "[ . 1]" 1
215 1 23 C H1' 1 23 C H6 3.020 2.110 3.930 3.394 3.357 3.510 . 0 0 "[ . 1]" 1
216 1 23 C H2' 1 23 C H6 3.040 2.110 3.970 4.141 4.010 4.177 0.207 10 0 "[ . 1]" 1
217 1 23 C H5 1 23 C H6 2.420 . 3.010 2.427 2.417 2.442 . 0 0 "[ . 1]" 1
218 1 24 C H1' 1 24 C H2' 2.640 . 3.340 2.938 2.691 2.978 . 0 0 "[ . 1]" 1
219 1 23 C H2' 1 24 C H5 3.690 2.330 5.050 4.249 4.018 4.503 . 0 0 "[ . 1]" 1
220 1 24 C H5 1 25 U H5 3.760 2.350 5.170 3.950 3.813 4.185 . 0 0 "[ . 1]" 1
221 1 23 C H1' 1 24 C H6 4.180 2.430 5.930 5.042 4.658 5.201 . 0 0 "[ . 1]" 1
222 1 23 C H2' 1 24 C H6 2.410 . 2.990 2.747 2.210 2.922 . 0 0 "[ . 1]" 1
223 1 24 C H1' 1 24 C H6 3.330 2.220 4.440 3.586 3.211 3.645 . 0 0 "[ . 1]" 1
224 1 24 C H2' 1 24 C H6 3.620 2.310 4.930 3.557 3.392 4.479 . 0 0 "[ . 1]" 1
225 1 24 C H5 1 24 C H6 2.530 . 3.170 2.449 2.442 2.453 . 0 0 "[ . 1]" 1
226 1 25 U H1' 1 25 U H2' 2.410 . 2.990 2.916 2.911 2.920 . 0 0 "[ . 1]" 1
227 1 24 C H1' 1 25 U H6 4.070 2.420 5.720 5.223 4.898 5.467 . 0 0 "[ . 1]" 1
228 1 24 C H2' 1 25 U H6 2.550 . 3.200 2.761 2.439 3.225 0.025 2 0 "[ . 1]" 1
229 1 24 C H5 1 25 U H6 4.300 2.450 6.150 5.189 4.862 5.674 . 0 0 "[ . 1]" 1
230 1 25 U H1' 1 25 U H6 3.590 2.300 4.880 3.516 3.445 3.601 . 0 0 "[ . 1]" 1
231 1 25 U H2' 1 25 U H6 2.810 2.020 3.600 3.717 3.601 3.820 0.220 4 0 "[ . 1]" 1
232 1 25 U H5 1 25 U H6 2.730 . 3.480 2.402 2.394 2.414 . 0 0 "[ . 1]" 1
233 1 26 C H1' 1 26 C H2' 2.570 . 3.230 2.890 2.858 2.923 . 0 0 "[ . 1]" 1
234 1 25 U H5 1 26 C H5 3.740 2.340 5.140 4.216 3.795 4.566 . 0 0 "[ . 1]" 1
235 1 25 U H1' 1 26 C H6 4.370 2.460 6.280 4.756 4.506 4.915 . 0 0 "[ . 1]" 1
236 1 25 U H2' 1 26 C H6 1.860 . 2.210 2.030 2.004 2.087 . 0 0 "[ . 1]" 1
237 1 25 U H5 1 26 C H6 5.840 2.430 6.500 6.286 5.907 6.532 0.032 10 0 "[ . 1]" 1
238 1 26 C H1' 1 26 C H6 3.310 2.220 4.400 3.569 3.499 3.624 . 0 0 "[ . 1]" 1
239 1 26 C H2' 1 26 C H6 3.310 2.220 4.400 3.600 3.363 3.825 . 0 0 "[ . 1]" 1
240 1 26 C H5 1 26 C H6 2.450 . 3.050 2.436 2.428 2.445 . 0 0 "[ . 1]" 1
241 1 26 C H2' 1 27 A H1' 3.660 2.320 5.000 3.296 2.661 3.696 . 0 0 "[ . 1]" 1
242 1 27 A H1' 1 27 A H2' 2.700 . 3.430 2.859 2.808 2.955 . 0 0 "[ . 1]" 1
243 1 27 A H1' 1 27 A H2 4.680 2.490 6.500 4.871 4.695 5.175 . 0 0 "[ . 1]" 1
244 1 26 C H1' 1 27 A H8 4.400 2.460 6.340 5.303 4.840 5.689 . 0 0 "[ . 1]" 1
245 1 26 C H2' 1 27 A H8 2.680 . 3.400 3.011 2.429 3.446 0.046 3 0 "[ . 1]" 1
246 1 26 C H5 1 27 A H8 4.720 2.490 6.500 4.387 4.316 4.451 . 0 0 "[ . 1]" 1
247 1 27 A H1' 1 27 A H8 3.520 2.280 4.760 3.632 3.420 3.748 . 0 0 "[ . 1]" 1
248 1 27 A H2' 1 27 A H8 3.080 2.130 4.030 4.075 3.810 4.304 0.274 6 0 "[ . 1]" 1
249 1 27 A H2' 1 28 A H1' 4.900 2.500 6.500 4.020 2.917 5.299 . 0 0 "[ . 1]" 1
250 1 28 A H1' 1 28 A H2' 3.090 2.130 4.050 2.896 2.817 3.050 . 0 0 "[ . 1]" 1
251 1 28 A H1' 1 28 A H3' 4.280 2.450 6.110 3.925 3.900 3.998 . 0 0 "[ . 1]" 1
252 1 28 A H1' 1 28 A H2 5.020 2.500 6.500 4.727 4.495 4.923 . 0 0 "[ . 1]" 1
253 1 27 A H1' 1 28 A H8 4.150 2.420 5.880 5.413 3.826 6.118 0.238 2 0 "[ . 1]" 1
254 1 27 A H2' 1 28 A H8 3.590 2.300 4.880 3.094 2.525 3.678 . 0 0 "[ . 1]" 1
255 1 27 A H8 1 28 A H8 4.660 2.480 6.500 6.160 5.609 6.559 0.059 10 0 "[ . 1]" 1
256 1 28 A H1' 1 28 A H8 3.880 2.370 5.390 3.720 3.592 3.843 . 0 0 "[ . 1]" 1
257 1 28 A H3' 1 28 A H8 3.560 2.300 4.820 3.548 3.056 4.420 . 0 0 "[ . 1]" 1
258 1 29 G H1' 1 29 G H2' 3.310 2.220 4.400 2.832 2.750 3.078 . 0 0 "[ . 1]" 1
259 1 28 A H1' 1 29 G H8 4.320 2.450 6.190 4.471 2.294 5.639 0.156 6 0 "[ . 1]" 1
260 1 28 A H2' 1 29 G H8 3.040 2.120 3.960 2.771 2.057 4.094 0.134 6 0 "[ . 1]" 1
261 1 28 A H3' 1 29 G H8 3.540 2.280 4.800 3.858 2.958 4.686 . 0 0 "[ . 1]" 1
262 1 29 G H1' 1 29 G H8 4.190 2.430 5.950 3.569 3.446 3.854 . 0 0 "[ . 1]" 1
263 1 29 G H2' 1 29 G H8 3.210 2.180 4.240 4.148 2.809 4.441 0.201 6 0 "[ . 1]" 1
264 1 29 G H8 1 30 U H5 4.700 2.490 6.500 4.325 3.705 4.804 . 0 0 "[ . 1]" 1
265 1 29 G H2' 1 30 U H1' 4.630 2.490 6.500 4.152 3.630 6.464 . 0 0 "[ . 1]" 1
266 1 30 U H1' 1 30 U H2' 2.660 . 3.370 2.791 2.741 2.915 . 0 0 "[ . 1]" 1
267 1 29 G H2' 1 30 U H5 4.230 2.440 6.020 3.753 3.451 4.246 . 0 0 "[ . 1]" 1
268 1 29 G H1' 1 30 U H6 4.420 2.470 6.370 4.768 3.993 4.941 . 0 0 "[ . 1]" 1
269 1 29 G H2' 1 30 U H6 2.960 2.090 3.830 2.356 2.066 3.490 0.024 1 0 "[ . 1]" 1
270 1 30 U H1' 1 30 U H6 3.610 2.310 4.910 3.381 3.321 3.571 . 0 0 "[ . 1]" 1
271 1 30 U H2' 1 30 U H6 3.710 2.330 5.090 4.231 3.569 4.404 . 0 0 "[ . 1]" 1
272 1 30 U H5 1 30 U H6 2.820 2.020 3.620 2.390 2.382 2.400 . 0 0 "[ . 1]" 1
273 1 30 U H6 1 31 U H5 4.410 2.470 6.350 4.212 4.001 4.484 . 0 0 "[ . 1]" 1
274 1 31 U H1' 1 31 U H2' 2.550 . 3.200 2.786 2.769 2.806 . 0 0 "[ . 1]" 1
275 1 30 U H5 1 31 U H5 4.150 2.430 5.870 4.679 4.479 4.947 . 0 0 "[ . 1]" 1
276 1 30 U H1' 1 31 U H6 4.570 2.480 6.500 4.707 4.275 4.810 . 0 0 "[ . 1]" 1
277 1 30 U H2' 1 31 U H6 2.500 . 3.130 2.069 1.905 2.147 . 0 0 "[ . 1]" 1
278 1 30 U H6 1 31 U H6 5.540 2.470 6.500 5.267 5.121 5.397 . 0 0 "[ . 1]" 1
279 1 31 U H1' 1 31 U H6 3.500 2.270 4.730 3.372 3.288 3.427 . 0 0 "[ . 1]" 1
280 1 31 U H2' 1 31 U H6 3.160 2.160 4.160 4.152 4.025 4.246 0.086 2 0 "[ . 1]" 1
281 1 31 U H5 1 31 U H6 2.670 . 3.390 2.428 2.419 2.435 . 0 0 "[ . 1]" 1
282 1 32 U H1' 1 32 U H2' 2.480 . 3.100 2.782 2.761 2.817 . 0 0 "[ . 1]" 1
283 1 31 U H2' 1 32 U H5 3.440 2.250 4.630 3.942 3.811 4.155 . 0 0 "[ . 1]" 1
284 1 31 U H1' 1 32 U H6 4.620 2.490 6.500 4.632 4.498 4.759 . 0 0 "[ . 1]" 1
285 1 31 U H2' 1 32 U H6 2.260 . 2.770 2.025 1.969 2.109 . 0 0 "[ . 1]" 1
286 1 32 U H1' 1 32 U H6 3.490 2.270 4.710 3.387 3.309 3.449 . 0 0 "[ . 1]" 1
287 1 32 U H2' 1 32 U H6 3.720 2.340 5.100 4.237 4.113 4.365 . 0 0 "[ . 1]" 1
288 1 32 U H5 1 32 U H6 2.590 . 3.260 2.410 2.404 2.415 . 0 0 "[ . 1]" 1
289 1 32 U H6 1 33 C H5 4.170 2.430 5.910 5.023 4.679 5.251 . 0 0 "[ . 1]" 1
290 1 33 C H1' 1 33 C H2' 2.540 . 3.190 2.718 2.695 2.749 . 0 0 "[ . 1]" 1
291 1 32 U H2' 1 33 C H5 3.690 2.330 5.050 4.277 4.010 4.497 . 0 0 "[ . 1]" 1
292 1 32 U H1' 1 33 C H6 4.480 2.480 6.480 4.561 4.418 4.684 . 0 0 "[ . 1]" 1
293 1 32 U H2' 1 33 C H6 2.210 . 2.700 2.134 1.978 2.290 . 0 0 "[ . 1]" 1
294 1 33 C H1' 1 33 C H6 3.420 2.250 4.590 3.132 3.102 3.149 . 0 0 "[ . 1]" 1
295 1 33 C H2' 1 33 C H6 3.390 2.240 4.540 4.504 4.414 4.555 0.015 10 0 "[ . 1]" 1
296 1 33 C H5 1 33 C H6 2.530 . 3.170 2.398 2.385 2.407 . 0 0 "[ . 1]" 1
297 1 33 C H2' 1 34 A H1' 3.410 2.250 4.570 3.275 2.960 3.791 . 0 0 "[ . 1]" 1
298 1 34 A H1' 1 34 A H2' 2.620 . 3.310 2.806 2.767 2.834 . 0 0 "[ . 1]" 1
299 1 34 A H1' 1 34 A H3' 3.920 2.380 5.460 3.878 3.855 3.903 . 0 0 "[ . 1]" 1
300 1 34 A H1' 1 34 A H2 4.890 2.500 6.500 5.095 4.982 5.179 . 0 0 "[ . 1]" 1
301 1 33 C H2' 1 34 A H8 2.360 . 2.920 2.326 2.172 2.688 . 0 0 "[ . 1]" 1
302 1 33 C H6 1 34 A H8 4.860 2.490 6.500 4.824 4.677 5.037 . 0 0 "[ . 1]" 1
303 1 34 A H1' 1 34 A H8 3.660 2.320 3.800 3.401 3.333 3.489 . 0 0 "[ . 1]" 1
304 1 34 A H2' 1 34 A H8 3.920 2.380 5.460 4.475 4.373 4.571 . 0 0 "[ . 1]" 1
305 1 34 A H3' 1 34 A H8 3.130 2.150 4.110 4.049 3.908 4.147 0.037 2 0 "[ . 1]" 1
306 1 34 A H8 1 35 C H5 4.200 2.440 5.960 4.976 4.833 5.113 . 0 0 "[ . 1]" 1
307 1 34 A H8 1 35 C H6 5.290 2.490 6.500 5.710 5.579 5.824 . 0 0 "[ . 1]" 1
308 1 34 A H3' 1 35 C H1' 6.050 2.390 6.500 5.488 5.241 5.796 . 0 0 "[ . 1]" 1
309 1 35 C H1' 1 35 C H2' 2.450 . 3.050 2.761 2.747 2.780 . 0 0 "[ . 1]" 1
310 1 35 C H1' 1 35 C H3' 3.290 2.200 4.380 3.850 3.822 3.879 . 0 0 "[ . 1]" 1
311 1 34 A H3' 1 35 C H5 3.820 2.360 5.280 3.355 2.894 3.700 . 0 0 "[ . 1]" 1
312 1 34 A H1' 1 35 C H6 4.960 2.500 6.500 4.888 4.818 4.970 . 0 0 "[ . 1]" 1
313 1 34 A H2' 1 35 C H6 2.190 . 2.670 2.140 2.024 2.213 . 0 0 "[ . 1]" 1
314 1 34 A H3' 1 35 C H6 3.710 2.330 5.090 2.773 2.444 3.163 . 0 0 "[ . 1]" 1
315 1 35 C H1' 1 35 C H6 3.480 2.270 4.690 3.382 3.360 3.402 . 0 0 "[ . 1]" 1
316 1 35 C H2' 1 35 C H6 3.870 2.370 5.370 4.239 4.188 4.306 . 0 0 "[ . 1]" 1
317 1 35 C H3' 1 35 C H6 2.640 . 3.340 3.411 3.378 3.456 0.116 10 0 "[ . 1]" 1
318 1 35 C H5 1 35 C H6 2.530 . 3.170 2.429 2.422 2.435 . 0 0 "[ . 1]" 1
319 1 35 C H5'' 1 35 C H6 4.190 2.430 5.950 3.975 3.745 4.126 . 0 0 "[ . 1]" 1
320 1 35 C H6 1 36 C H5 4.100 2.420 5.780 4.364 4.184 4.539 . 0 0 "[ . 1]" 1
321 1 36 C H1' 1 36 C H2' 2.450 . 3.050 2.840 2.817 2.860 . 0 0 "[ . 1]" 1
322 1 35 C H2' 1 36 C H5 3.910 2.380 5.440 3.774 3.689 3.870 . 0 0 "[ . 1]" 1
323 1 35 C H5 1 36 C H5 3.800 2.350 5.250 4.832 4.566 5.002 . 0 0 "[ . 1]" 1
324 1 35 C H1' 1 36 C H6 4.600 2.480 6.500 4.721 4.665 4.795 . 0 0 "[ . 1]" 1
325 1 35 C H2' 1 36 C H6 2.040 . 2.450 2.105 2.042 2.161 . 0 0 "[ . 1]" 1
326 1 35 C H3' 1 36 C H6 2.820 2.030 3.610 2.378 2.269 2.586 . 0 0 "[ . 1]" 1
327 1 35 C H5 1 36 C H6 4.880 2.490 6.500 6.220 6.012 6.326 . 0 0 "[ . 1]" 1
328 1 35 C H6 1 36 C H6 5.040 2.500 6.500 5.025 4.840 5.128 . 0 0 "[ . 1]" 1
329 1 36 C H1' 1 36 C H6 3.440 2.250 4.630 3.342 3.302 3.411 . 0 0 "[ . 1]" 1
330 1 36 C H2' 1 36 C H6 3.510 2.280 4.740 4.228 4.047 4.327 . 0 0 "[ . 1]" 1
331 1 36 C H3' 1 36 C H6 2.710 . 3.440 3.515 3.489 3.562 0.122 10 0 "[ . 1]" 1
332 1 36 C H5 1 36 C H6 2.400 . 2.980 2.417 2.409 2.426 . 0 0 "[ . 1]" 1
333 1 36 C H6 1 37 C H5 3.610 2.310 4.910 4.204 3.886 4.348 . 0 0 "[ . 1]" 1
334 1 36 C H2' 1 37 C H1' 4.190 2.430 5.950 4.459 4.020 5.076 . 0 0 "[ . 1]" 1
335 1 37 C H1' 1 37 C H2' 2.490 . 3.110 2.921 2.872 2.973 . 0 0 "[ . 1]" 1
336 1 37 C H1' 1 37 C H3' 3.450 2.260 4.640 3.942 3.913 3.956 . 0 0 "[ . 1]" 1
337 1 36 C H2' 1 37 C H5 3.640 2.310 4.970 4.196 3.971 4.442 . 0 0 "[ . 1]" 1
338 1 36 C H1' 1 37 C H6 4.230 2.440 6.020 5.168 4.881 5.374 . 0 0 "[ . 1]" 1
339 1 36 C H2' 1 37 C H6 2.330 . 2.870 2.684 2.335 2.909 0.039 4 0 "[ . 1]" 1
340 1 36 C H3' 1 37 C H6 3.200 2.180 4.220 2.978 2.784 3.226 . 0 0 "[ . 1]" 1
341 1 37 C H1' 1 37 C H6 3.330 2.220 4.440 3.588 3.540 3.636 . 0 0 "[ . 1]" 1
342 1 37 C H2' 1 37 C H6 3.330 2.220 4.440 3.538 3.265 3.829 . 0 0 "[ . 1]" 1
343 1 37 C H3' 1 37 C H6 2.660 . 3.370 3.303 2.976 3.429 0.059 6 0 "[ . 1]" 1
344 1 37 C H4' 1 37 C H6 3.490 2.270 4.710 4.311 4.249 4.413 . 0 0 "[ . 1]" 1
345 1 37 C H5 1 37 C H6 2.400 . 2.980 2.433 2.423 2.438 . 0 0 "[ . 1]" 1
346 1 37 C H5'' 1 37 C H6 4.760 2.490 6.500 4.540 4.322 4.848 . 0 0 "[ . 1]" 1
347 1 2 G H5' 1 2 G H8 3.660 . 5.330 4.512 3.990 4.880 . 0 0 "[ . 1]" 1
348 1 2 G H5'' 1 2 G H8 4.670 . 6.500 4.395 4.079 4.627 . 0 0 "[ . 1]" 1
349 1 3 G H3' 1 3 G H8 3.060 . 4.230 3.380 3.256 3.520 . 0 0 "[ . 1]" 1
350 1 3 G H3' 1 4 U H6 3.480 . 4.990 3.161 3.076 3.252 . 0 0 "[ . 1]" 1
351 1 3 G H8 1 4 U H6 6.030 . 6.500 5.124 5.013 5.296 . 0 0 "[ . 1]" 1
352 1 4 U H3' 1 4 U H6 2.620 . 3.480 3.374 3.290 3.433 . 0 0 "[ . 1]" 1
353 1 4 U H3' 1 5 G H8 3.040 . 4.200 3.352 3.162 3.468 . 0 0 "[ . 1]" 1
354 1 5 G H3' 1 5 G H8 3.870 . 5.740 3.132 3.011 3.425 . 0 0 "[ . 1]" 1
355 1 5 G H3' 1 6 A H8 3.270 . 4.600 2.896 2.626 3.132 . 0 0 "[ . 1]" 1
356 1 6 A H1' 1 6 A H8 3.870 . 5.750 3.649 3.636 3.657 . 0 0 "[ . 1]" 1
357 1 6 A H2' 1 6 A H8 3.830 . 5.670 4.164 4.080 4.226 . 0 0 "[ . 1]" 1
358 1 6 A H2' 1 7 A H1' 3.130 . 4.360 3.607 3.374 3.763 . 0 0 "[ . 1]" 1
359 1 7 A H3' 1 7 A H8 3.450 . 4.940 3.626 3.398 3.924 . 0 0 "[ . 1]" 1
360 1 7 A H2' 1 8 A H8 3.030 . 4.180 2.214 2.104 2.328 . 0 0 "[ . 1]" 1
361 1 7 A H3' 1 8 A H8 3.670 . 5.360 2.257 2.045 2.435 . 0 0 "[ . 1]" 1
362 1 8 A H1' 1 8 A H8 5.870 . 6.500 3.527 3.435 3.604 . 0 0 "[ . 1]" 1
363 1 8 A H2' 1 9 C H5 3.240 . 4.550 3.487 3.142 3.859 . 0 0 "[ . 1]" 1
364 1 9 C H5 1 10 G H8 5.640 . 6.500 5.943 5.078 6.547 0.047 10 0 "[ . 1]" 1
365 1 10 G H5'' 1 10 G H8 4.300 . 6.500 4.883 2.638 5.929 . 0 0 "[ . 1]" 1
366 1 12 A H1' 1 12 A H2 5.030 . 6.500 4.728 4.682 4.778 . 0 0 "[ . 1]" 1
367 1 11 G H8 1 12 A H8 5.120 . 6.500 5.839 5.369 6.364 . 0 0 "[ . 1]" 1
368 1 14 G H2' 1 15 A H1' 3.610 . 5.240 2.795 2.435 3.874 . 0 0 "[ . 1]" 1
369 1 14 G H8 1 15 A H8 5.260 . 6.500 4.831 4.503 5.355 . 0 0 "[ . 1]" 1
370 1 17 U H2' 1 17 U H3' 2.350 . 3.040 2.346 2.316 2.362 . 0 0 "[ . 1]" 1
371 1 16 C H1' 1 17 U H5 5.700 . 6.500 5.809 5.622 6.252 . 0 0 "[ . 1]" 1
372 1 16 C H3' 1 17 U H5 4.350 . 6.500 3.808 3.627 4.318 . 0 0 "[ . 1]" 1
373 1 18 U H3' 1 19 C H5'' 5.270 . 6.500 4.427 4.278 4.545 . 0 0 "[ . 1]" 1
374 1 17 U H2' 1 18 U H5 . . 5.500 5.337 5.267 5.626 0.126 1 0 "[ . 1]" 1
375 1 19 C H1' 1 19 C H3' 3.890 . 5.780 3.922 3.887 3.955 . 0 0 "[ . 1]" 1
376 1 19 C H2' 1 19 C H5'' 4.600 . 6.500 3.959 3.796 4.094 . 0 0 "[ . 1]" 1
377 1 19 C H3' 1 19 C H4' 2.610 . 3.460 2.738 2.694 2.768 . 0 0 "[ . 1]" 1
378 1 19 C H3' 1 19 C H5'' 2.890 . 3.930 2.443 2.279 2.584 . 0 0 "[ . 1]" 1
379 1 19 C H4' 1 19 C H5'' 2.430 . 3.170 2.458 2.390 2.583 . 0 0 "[ . 1]" 1
380 1 17 U H1' 1 19 C H5 4.490 . 6.500 5.121 4.829 5.226 . 0 0 "[ . 1]" 1
381 1 18 U H5' 1 19 C H5 4.000 . 6.000 3.822 3.623 4.153 . 0 0 "[ . 1]" 1
382 1 20 G H1' 1 20 G H4' 3.190 . 4.460 3.212 3.183 3.239 . 0 0 "[ . 1]" 1
383 1 20 G H4' 1 20 G H5' 2.340 . 3.020 2.422 2.394 2.441 . 0 0 "[ . 1]" 1
384 1 19 C H5'' 1 20 G H5' 6.500 . 6.500 5.699 5.517 5.814 . 0 0 "[ . 1]" 1
385 1 19 C H4' 1 20 G H5'' 2.030 . 2.540 2.361 2.314 2.382 . 0 0 "[ . 1]" 1
386 1 23 C H3' 1 23 C H6 2.630 . 3.490 3.350 2.747 3.543 0.053 1 0 "[ . 1]" 1
387 1 23 C H6 1 24 C H5 3.780 . 5.570 3.933 3.823 4.040 . 0 0 "[ . 1]" 1
388 1 23 C H6 1 24 C H6 4.320 . 6.500 4.786 4.513 4.961 . 0 0 "[ . 1]" 1
389 1 23 C H2' 1 24 C H1' 3.930 . 5.860 5.029 3.708 5.323 . 0 0 "[ . 1]" 1
390 1 23 C H3' 1 24 C H6 3.110 . 4.320 2.976 2.684 3.153 . 0 0 "[ . 1]" 1
391 1 23 C H5 1 24 C H6 5.730 . 6.500 5.352 5.110 5.504 . 0 0 "[ . 1]" 1
392 1 24 C H3' 1 24 C H6 2.970 . 4.080 3.438 3.268 3.886 . 0 0 "[ . 1]" 1
393 1 24 C H2' 1 25 U H1' 3.120 . 4.340 3.589 3.074 4.310 . 0 0 "[ . 1]" 1
394 1 24 C H2' 1 25 U H5 4.130 . 6.260 4.354 3.842 4.714 . 0 0 "[ . 1]" 1
395 1 24 C H3' 1 25 U H6 3.450 . 4.940 4.260 2.764 4.565 . 0 0 "[ . 1]" 1
396 1 25 U H3' 1 25 U H6 3.040 . 4.190 3.611 3.429 3.850 . 0 0 "[ . 1]" 1
397 1 25 U H6 1 26 C H6 5.440 . 6.500 5.241 4.907 5.425 . 0 0 "[ . 1]" 1
398 1 25 U H2' 1 26 C H5 2.390 . 3.100 2.765 2.547 3.162 0.062 4 0 "[ . 1]" 1
399 1 25 U H3' 1 26 C H6 3.710 . 5.430 3.626 3.357 3.899 . 0 0 "[ . 1]" 1
400 1 26 C H3' 1 26 C H6 2.880 . 3.920 3.157 2.880 3.396 . 0 0 "[ . 1]" 1
401 1 26 C H4' 1 26 C H6 5.080 . 6.500 4.224 4.172 4.327 . 0 0 "[ . 1]" 1
402 1 26 C H6 1 27 A H8 5.090 . 6.500 3.872 3.659 4.198 . 0 0 "[ . 1]" 1
403 1 29 G H3' 1 29 G H8 3.960 . 5.920 3.809 3.319 4.566 . 0 0 "[ . 1]" 1
404 1 29 G H5'' 1 29 G H8 3.930 . 5.860 3.189 2.355 4.503 . 0 0 "[ . 1]" 1
405 1 29 G H3' 1 30 U H6 3.950 . 5.900 3.138 2.501 5.046 . 0 0 "[ . 1]" 1
406 1 30 U H3' 1 30 U H6 3.610 . 5.240 3.611 3.420 3.774 . 0 0 "[ . 1]" 1
407 1 30 U Q5' 1 30 U H6 4.300 . 6.500 2.986 2.567 3.480 . 0 0 "[ . 1]" 1
408 1 30 U H3' 1 31 U H6 3.790 . 5.580 2.522 2.242 3.757 . 0 0 "[ . 1]" 1
409 1 30 U H5 1 31 U H6 6.500 . 6.500 6.394 6.017 6.576 0.076 10 0 "[ . 1]" 1
410 1 31 U H3' 1 31 U H6 3.290 . 4.650 3.278 2.977 3.570 . 0 0 "[ . 1]" 1
411 1 31 U H3' 1 32 U H6 3.720 . 5.450 2.928 2.700 3.074 . 0 0 "[ . 1]" 1
412 1 32 U H3' 1 32 U H6 2.710 . 3.630 3.315 3.127 3.454 . 0 0 "[ . 1]" 1
413 1 32 U H6 1 33 C H6 4.780 . 6.500 4.815 4.699 5.043 . 0 0 "[ . 1]" 1
414 1 32 U H2' 1 33 C H1' 3.390 . 4.830 3.047 2.939 3.366 . 0 0 "[ . 1]" 1
415 1 32 U H3' 1 33 C H6 3.420 . 4.880 2.895 2.428 3.221 . 0 0 "[ . 1]" 1
416 1 33 C H3' 1 34 A H8 2.980 . 4.090 2.103 2.024 2.201 . 0 0 "[ . 1]" 1
417 1 33 C H5 1 34 A H8 5.880 . 6.500 5.391 5.130 5.685 . 0 0 "[ . 1]" 1
418 1 34 A H5'' 1 34 A H8 4.660 . 6.500 4.742 4.453 4.978 . 0 0 "[ . 1]" 1
419 1 34 A H2' 1 35 C H1' 3.600 . 5.220 3.327 3.114 3.514 . 0 0 "[ . 1]" 1
420 1 35 C H2' 1 36 C H1' 3.250 . 4.570 3.308 3.157 3.503 . 0 0 "[ . 1]" 1
421 1 36 C H6 1 37 C H6 4.580 . 6.500 5.025 4.711 5.117 . 0 0 "[ . 1]" 1
422 1 37 C H2' 1 37 C H3' 2.260 . 2.900 2.349 2.331 2.366 . 0 0 "[ . 1]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 323
_Distance_constraint_stats_list.Viol_count 712
_Distance_constraint_stats_list.Viol_total 1054.762
_Distance_constraint_stats_list.Viol_max 1.853
_Distance_constraint_stats_list.Viol_rms 0.1292
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0327
_Distance_constraint_stats_list.Viol_average_violations_only 0.1481
_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 0.040 0.040 5 0 "[ . 1]"
1 2 G 3.509 0.272 10 0 "[ . 1]"
1 3 G 5.315 0.272 10 0 "[ . 1]"
1 4 U 5.039 0.338 9 0 "[ . 1]"
1 5 G 4.094 0.214 4 0 "[ . 1]"
1 6 A 3.768 0.214 4 0 "[ . 1]"
1 7 A 3.076 0.146 5 0 "[ . 1]"
1 8 A 0.459 0.122 10 0 "[ . 1]"
1 9 C 1.788 0.132 5 0 "[ . 1]"
1 10 G 2.044 0.266 9 0 "[ . 1]"
1 11 G 2.714 0.209 5 0 "[ . 1]"
1 12 A 4.000 0.209 5 0 "[ . 1]"
1 13 G 6.364 0.237 1 0 "[ . 1]"
1 14 G 3.669 0.237 1 0 "[ . 1]"
1 15 A 1.002 0.172 1 0 "[ . 1]"
1 16 C 6.850 0.360 1 0 "[ . 1]"
1 17 U 51.149 1.853 1 10 [+********-]
1 18 U 34.412 1.853 1 10 [+********-]
1 19 C 4.125 0.242 7 0 "[ . 1]"
1 20 G 16.911 1.057 1 10 [+*******-*]
1 21 G 2.176 0.173 1 0 "[ . 1]"
1 22 U 0.620 0.087 9 0 "[ . 1]"
1 23 C 1.736 0.087 9 0 "[ . 1]"
1 24 C 1.189 0.111 2 0 "[ . 1]"
1 25 U 1.466 0.109 7 0 "[ . 1]"
1 26 C 1.357 0.104 2 0 "[ . 1]"
1 27 A 0.778 0.119 5 0 "[ . 1]"
1 28 A 1.938 0.297 6 0 "[ . 1]"
1 29 G 5.655 0.297 6 0 "[ . 1]"
1 30 U 3.953 0.297 2 0 "[ . 1]"
1 31 U 3.193 0.187 5 0 "[ . 1]"
1 32 U 4.000 0.146 5 0 "[ . 1]"
1 33 C 5.673 0.338 9 0 "[ . 1]"
1 34 A 1.390 0.203 7 0 "[ . 1]"
1 35 C 4.119 0.203 7 0 "[ . 1]"
1 36 C 2.120 0.140 1 0 "[ . 1]"
1 37 C 1.063 0.137 3 0 "[ . 1]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 G H1 1 2 G H22 4.000 . 5.500 3.482 3.475 3.489 . 0 0 "[ . 1]" 2
2 1 2 G H1 1 3 G H1 4.000 . 5.500 3.618 3.546 3.708 . 0 0 "[ . 1]" 2
3 1 3 G H21 1 4 U H3 4.000 . 5.500 4.364 4.215 4.457 . 0 0 "[ . 1]" 2
4 1 3 G H1 1 3 G H22 3.000 . 3.800 3.461 3.451 3.468 . 0 0 "[ . 1]" 2
5 1 3 G H1 1 4 U H3 3.000 . 3.800 3.669 3.544 3.773 . 0 0 "[ . 1]" 2
6 1 4 U H3 1 5 G H1 4.000 . 5.500 4.949 4.667 5.179 . 0 0 "[ . 1]" 2
7 1 5 G H1 1 6 A H2 4.000 . 5.500 4.715 4.185 4.943 . 0 0 "[ . 1]" 2
8 1 6 A H2 1 31 U H3 4.000 . 5.500 5.651 5.616 5.685 0.185 9 0 "[ . 1]" 2
9 1 6 A H2 1 32 U H3 3.000 . 3.800 3.025 2.898 3.208 . 0 0 "[ . 1]" 2
10 1 6 A H61 1 32 U H3 3.000 . 3.800 2.251 2.155 2.317 . 0 0 "[ . 1]" 2
11 1 6 A H62 1 32 U H3 3.000 . 3.800 3.803 3.705 3.848 0.048 3 0 "[ . 1]" 2
12 1 7 A H2 1 31 U H3 3.000 . 3.800 2.916 2.847 3.047 . 0 0 "[ . 1]" 2
13 1 7 A H2 1 32 U H3 3.000 . 3.800 3.902 3.856 3.928 0.128 4 0 "[ . 1]" 2
14 1 7 A H61 1 31 U H3 3.000 . 3.800 2.219 2.052 2.289 . 0 0 "[ . 1]" 2
15 1 7 A H62 1 31 U H3 3.000 . 3.800 3.742 3.580 3.798 . 0 0 "[ . 1]" 2
16 1 8 A H2 1 29 G H1 4.000 . 5.500 4.700 4.430 4.844 . 0 0 "[ . 1]" 2
17 1 8 A H2 1 30 U H3 3.000 . 3.800 2.953 2.713 3.135 . 0 0 "[ . 1]" 2
18 1 8 A H2 1 31 U H3 4.000 . 5.500 4.173 4.031 4.325 . 0 0 "[ . 1]" 2
19 1 8 A H61 1 30 U H3 4.000 . 5.500 2.203 1.935 2.469 . 0 0 "[ . 1]" 2
20 1 8 A H62 1 30 U H3 4.000 . 5.500 3.728 3.485 3.956 . 0 0 "[ . 1]" 2
21 1 9 C H41 1 29 G H1 3.000 . 3.800 2.338 2.227 2.418 . 0 0 "[ . 1]" 2
22 1 9 C H42 1 29 G H1 3.000 . 3.800 3.890 3.820 3.932 0.132 5 0 "[ . 1]" 2
23 1 11 G H1 1 11 G H21 3.000 . 3.800 2.208 2.197 2.226 . 0 0 "[ . 1]" 2
24 1 11 G H1 1 12 A H2 3.000 . 3.800 3.945 3.899 4.009 0.209 5 0 "[ . 1]" 2
25 1 12 A H2 1 13 G H1 4.000 . 5.500 5.255 5.167 5.458 . 0 0 "[ . 1]" 2
26 1 12 A H2 1 25 U H3 3.000 . 3.800 2.575 2.324 2.754 . 0 0 "[ . 1]" 2
27 1 13 G H1 1 14 G H1 3.000 . 3.800 3.990 3.937 4.037 0.237 1 0 "[ . 1]" 2
28 1 13 G H1 1 13 G H21 3.000 . 3.800 2.232 2.213 2.242 . 0 0 "[ . 1]" 2
29 1 13 G H1 1 13 G H22 3.000 . 3.800 3.490 3.480 3.496 . 0 0 "[ . 1]" 2
30 1 14 G H1 1 14 G H22 3.000 . 3.800 3.482 3.473 3.490 . 0 0 "[ . 1]" 2
31 1 14 G H1 1 15 A H2 4.000 . 5.500 4.744 4.414 5.240 . 0 0 "[ . 1]" 2
32 1 15 A H2 1 21 G H1 4.000 . 5.500 4.807 4.651 5.133 . 0 0 "[ . 1]" 2
33 1 15 A H2 1 22 U H3 3.000 . 3.800 3.353 3.159 3.472 . 0 0 "[ . 1]" 2
34 1 15 A H61 1 21 G H1 4.000 . 5.500 4.684 4.440 4.853 . 0 0 "[ . 1]" 2
35 1 15 A H61 1 22 U H3 3.000 . 3.800 1.944 1.820 2.205 . 0 0 "[ . 1]" 2
36 1 14 G H1 1 15 A H62 4.000 . 5.500 4.067 3.608 4.343 . 0 0 "[ . 1]" 2
37 1 15 A H62 1 22 U H3 3.000 . 3.800 3.563 3.452 3.791 . 0 0 "[ . 1]" 2
38 1 16 C H41 1 17 U H3 3.000 . 3.800 3.793 3.186 3.882 0.082 3 0 "[ . 1]" 2
39 1 16 C H41 1 21 G H1 3.000 . 3.800 1.733 1.691 1.753 0.109 9 0 "[ . 1]" 2
40 1 16 C H42 1 21 G H1 3.000 . 3.800 3.369 3.343 3.389 . 0 0 "[ . 1]" 2
41 1 16 C H41 1 16 C H5 3.000 . 3.800 3.650 3.635 3.671 . 0 0 "[ . 1]" 2
42 1 17 U H1' 1 20 G H1 2.300 . 2.800 2.710 2.460 2.857 0.057 6 0 "[ . 1]" 2
43 1 17 U H1' 1 21 G H21 3.000 . 3.800 3.322 3.230 3.439 . 0 0 "[ . 1]" 2
44 1 17 U H2' 1 20 G H1 . . 2.800 3.740 3.636 3.857 1.057 1 10 [+*******-*] 2
45 1 17 U H3 1 20 G H1 3.000 . 3.800 4.062 4.005 4.095 0.295 9 0 "[ . 1]" 2
46 1 18 U H5 1 18 U H6 2.300 . 2.800 2.391 2.385 2.401 . 0 0 "[ . 1]" 2
47 1 19 C H1' 1 20 G H1 3.000 . 3.800 3.599 3.429 3.843 0.043 1 0 "[ . 1]" 2
48 1 19 C H5 1 20 G H1 4.000 . 5.500 4.852 4.761 4.964 . 0 0 "[ . 1]" 2
49 1 20 G H2' 1 20 G H8 3.000 . 3.800 3.483 3.451 3.535 . 0 0 "[ . 1]" 2
50 1 20 G H2' 1 21 G H8 3.000 . 3.800 3.468 3.245 3.659 . 0 0 "[ . 1]" 2
51 1 17 U H3 1 21 G H1 4.000 . 5.500 4.915 4.300 5.028 . 0 0 "[ . 1]" 2
52 1 20 G H1 1 21 G H1 4.000 . 5.500 4.492 4.348 4.631 . 0 0 "[ . 1]" 2
53 1 21 G H1 1 21 G H21 3.000 . 3.800 2.195 2.182 2.213 . 0 0 "[ . 1]" 2
54 1 21 G H1 1 21 G H22 3.000 . 3.800 3.460 3.451 3.471 . 0 0 "[ . 1]" 2
55 1 21 G H21 1 22 U H1' 3.000 . 3.800 3.627 3.412 3.819 0.019 1 0 "[ . 1]" 2
56 1 14 G H1 1 22 U H3 4.000 . 5.500 4.806 4.492 4.959 . 0 0 "[ . 1]" 2
57 1 21 G H1 1 22 U H3 3.000 . 3.800 3.715 3.557 3.834 0.034 9 0 "[ . 1]" 2
58 1 14 G H1 1 23 C H41 3.000 . 3.800 2.245 2.100 2.300 . 0 0 "[ . 1]" 2
59 1 22 U H3 1 23 C H41 4.000 . 5.500 4.117 3.769 4.338 . 0 0 "[ . 1]" 2
60 1 14 G H1 1 23 C H42 3.000 . 3.800 3.808 3.672 3.850 0.050 1 0 "[ . 1]" 2
61 1 13 G H1 1 24 C H41 2.300 . 2.800 2.193 2.101 2.329 . 0 0 "[ . 1]" 2
62 1 14 G H1 1 24 C H41 3.000 . 3.800 3.780 3.696 3.820 0.020 5 0 "[ . 1]" 2
63 1 24 C H41 1 25 U H3 4.000 . 5.500 4.213 4.179 4.279 . 0 0 "[ . 1]" 2
64 1 13 G H1 1 24 C H42 3.000 . 3.800 3.737 3.667 3.840 0.040 7 0 "[ . 1]" 2
65 1 14 G H1 1 24 C H42 3.000 . 3.800 3.785 3.719 3.883 0.083 2 0 "[ . 1]" 2
66 1 11 G H1 1 25 U H3 4.000 . 5.500 4.473 4.293 4.723 . 0 0 "[ . 1]" 2
67 1 13 G H1 1 25 U H3 4.000 . 5.500 3.564 3.402 3.696 . 0 0 "[ . 1]" 2
68 1 11 G H1 1 26 C H41 3.000 . 3.800 2.199 1.937 2.326 . 0 0 "[ . 1]" 2
69 1 11 G H1 1 26 C H42 3.000 . 3.800 3.753 3.529 3.858 0.058 7 0 "[ . 1]" 2
70 1 29 G H1 1 29 G H22 3.000 . 3.800 3.462 3.447 3.471 . 0 0 "[ . 1]" 2
71 1 29 G H1 1 30 U H3 3.000 . 3.800 3.721 3.450 3.824 0.024 10 0 "[ . 1]" 2
72 1 30 U H3 1 31 U H3 3.000 . 3.800 3.916 3.865 3.987 0.187 5 0 "[ . 1]" 2
73 1 31 U H3 1 32 U H3 3.000 . 3.800 3.695 3.571 3.801 0.001 5 0 "[ . 1]" 2
74 1 5 G H1 1 32 U H3 4.000 . 5.500 4.614 4.248 4.790 . 0 0 "[ . 1]" 2
75 1 33 C H1' 1 34 A H8 4.000 . 5.500 4.494 4.411 4.623 . 0 0 "[ . 1]" 2
76 1 5 G H1 1 33 C H41 2.300 . 2.800 2.014 1.835 2.215 . 0 0 "[ . 1]" 2
77 1 32 U H3 1 33 C H41 4.000 . 5.500 4.831 4.436 5.092 . 0 0 "[ . 1]" 2
78 1 5 G H1 1 33 C H42 3.000 . 3.800 3.567 3.390 3.782 . 0 0 "[ . 1]" 2
79 1 3 G H1 1 34 A H2 4.000 . 5.500 4.673 4.618 4.786 . 0 0 "[ . 1]" 2
80 1 4 U H3 1 34 A H2 3.000 . 3.800 3.090 2.932 3.176 . 0 0 "[ . 1]" 2
81 1 5 G H1 1 34 A H2 4.000 . 5.500 4.982 4.771 5.133 . 0 0 "[ . 1]" 2
82 1 3 G H1 1 34 A H61 4.000 . 5.500 4.211 4.007 4.354 . 0 0 "[ . 1]" 2
83 1 4 U H3 1 34 A H61 3.000 . 3.800 2.033 1.940 2.218 . 0 0 "[ . 1]" 2
84 1 3 G H1 1 34 A H62 4.000 . 5.500 5.362 5.197 5.516 0.016 3 0 "[ . 1]" 2
85 1 4 U H3 1 34 A H62 3.000 . 3.800 3.572 3.486 3.730 . 0 0 "[ . 1]" 2
86 1 5 G H1 1 34 A H62 4.000 . 5.500 4.533 4.029 4.819 . 0 0 "[ . 1]" 2
87 1 3 G H1 1 35 C H41 3.000 . 3.800 1.838 1.737 2.001 0.063 10 0 "[ . 1]" 2
88 1 3 G H1 1 35 C H42 3.000 . 3.800 3.447 3.359 3.588 . 0 0 "[ . 1]" 2
89 1 2 G H1 1 36 C H41 2.300 . 2.800 2.107 1.885 2.295 . 0 0 "[ . 1]" 2
90 1 2 G H1 1 36 C H42 3.000 . 3.800 3.635 3.442 3.798 . 0 0 "[ . 1]" 2
91 1 20 G H3' 1 20 G H8 4.000 . 5.500 5.200 5.168 5.247 . 0 0 "[ . 1]" 2
92 1 3 G H1' 1 4 U H5 4.000 . 5.500 5.619 5.578 5.672 0.172 3 0 "[ . 1]" 2
93 1 4 U H1' 1 4 U H5 4.000 . 5.500 5.242 5.214 5.277 . 0 0 "[ . 1]" 2
94 1 12 A H2 1 13 G H2' 4.000 . 5.500 5.630 5.579 5.688 0.188 2 0 "[ . 1]" 2
95 1 29 G H1' 1 30 U H5 4.000 . 5.500 5.561 5.408 5.665 0.165 1 0 "[ . 1]" 2
96 1 8 A H1' 1 9 C H5 4.000 . 5.500 5.486 5.307 5.622 0.122 10 0 "[ . 1]" 2
97 1 15 A H1' 1 16 C H5 4.000 . 5.500 5.284 5.090 5.638 0.138 1 0 "[ . 1]" 2
98 1 34 A H1' 1 35 C H5 4.000 . 5.500 5.637 5.551 5.703 0.203 7 0 "[ . 1]" 2
99 1 7 A H1' 1 7 A H8 4.000 . 5.500 3.635 3.604 3.659 . 0 0 "[ . 1]" 2
100 1 7 A H1' 1 8 A H8 4.000 . 5.500 4.801 4.666 4.932 . 0 0 "[ . 1]" 2
101 1 20 G H1' 1 20 G H8 2.300 . 2.800 2.591 2.566 2.605 . 0 0 "[ . 1]" 2
102 1 2 G H3' 1 2 G H8 4.000 . 5.500 3.882 3.648 4.171 . 0 0 "[ . 1]" 2
103 1 2 G H4' 1 2 G H8 4.000 . 5.500 4.503 4.409 4.571 . 0 0 "[ . 1]" 2
104 1 17 U H1' 1 21 G H1 3.000 . 3.800 3.177 3.082 3.322 . 0 0 "[ . 1]" 2
105 1 17 U H1' 1 21 G H22 3.000 . 3.800 3.894 3.845 3.973 0.173 1 0 "[ . 1]" 2
106 1 17 U H2' 1 19 C H41 3.000 . 3.800 3.353 3.019 3.514 . 0 0 "[ . 1]" 2
107 1 17 U H3' 1 19 C H41 3.000 . 3.800 3.946 3.912 3.988 0.188 1 0 "[ . 1]" 2
108 1 16 C H41 1 17 U H1' 3.000 . 3.800 3.976 3.928 4.141 0.341 1 0 "[ . 1]" 2
109 1 16 C H42 1 17 U H5 3.000 . 3.800 3.594 3.388 3.761 . 0 0 "[ . 1]" 2
110 1 16 C H2' 1 17 U H5'' 3.000 . 3.800 3.554 3.489 3.666 . 0 0 "[ . 1]" 2
111 1 17 U H2' 1 18 U H1' 4.000 . 5.500 6.893 6.718 7.353 1.853 1 10 [+*-*******] 2
112 1 17 U H2' 1 18 U H2' 2.300 . 2.800 4.064 3.808 4.485 1.685 1 10 [+*-*******] 2
113 1 18 U H2' 1 20 G H1 3.000 . 3.800 4.063 4.025 4.135 0.335 10 0 "[ . 1]" 2
114 1 17 U H2' 1 18 U H3' 3.000 . 3.800 4.321 4.098 4.569 0.769 1 5 "[+ *. ** -]" 2
115 1 19 C H6 1 20 G H1 3.000 . 3.800 3.991 3.937 4.042 0.242 7 0 "[ . 1]" 2
116 1 21 G H21 1 21 G H22 3.000 . 3.800 1.754 1.745 1.759 0.055 2 0 "[ . 1]" 2
117 1 21 G H2' 1 21 G H5'' 4.000 . 5.500 4.615 4.549 4.694 . 0 0 "[ . 1]" 2
118 1 20 G H1 1 21 G H8 4.000 . 5.500 5.387 5.149 5.549 0.049 1 0 "[ . 1]" 2
119 1 21 G H1 1 22 U H1' 4.000 . 5.500 4.425 4.286 4.617 . 0 0 "[ . 1]" 2
120 1 19 C H5'' 1 20 G H4' 4.000 . 5.500 5.457 5.249 5.582 0.082 6 0 "[ . 1]" 2
121 1 16 C H5 1 17 U H6 3.000 . 3.800 4.050 4.001 4.160 0.360 1 0 "[ . 1]" 2
122 1 1 G H1 1 2 G H1' 4.000 . 5.500 5.012 4.590 5.540 0.040 5 0 "[ . 1]" 2
123 1 2 G H1 1 3 G H1' 4.000 . 5.500 4.838 4.689 4.937 . 0 0 "[ . 1]" 2
124 1 2 G H1 1 3 G H21 3.000 . 3.800 4.037 4.001 4.072 0.272 10 0 "[ . 1]" 2
125 1 3 G H1 1 3 G H21 3.000 . 3.800 2.188 2.173 2.199 . 0 0 "[ . 1]" 2
126 1 2 G H1 1 3 G H22 4.000 . 5.500 4.331 4.252 4.382 . 0 0 "[ . 1]" 2
127 1 3 G H21 1 3 G H22 4.000 . 5.500 1.752 1.745 1.755 0.055 9 0 "[ . 1]" 2
128 1 3 G H1 1 4 U H1' 4.000 . 5.500 4.816 4.572 5.131 . 0 0 "[ . 1]" 2
129 1 3 G H1 1 4 U H6 4.000 . 5.500 5.328 5.215 5.475 . 0 0 "[ . 1]" 2
130 1 9 C H41 1 9 C H42 3.000 . 3.800 1.752 1.746 1.755 0.054 2 0 "[ . 1]" 2
131 1 9 C H5 1 29 G H1 4.000 . 5.500 5.004 4.958 5.100 . 0 0 "[ . 1]" 2
132 1 10 G H1' 1 29 G H1 4.000 . 5.500 5.419 4.731 5.766 0.266 9 0 "[ . 1]" 2
133 1 10 G H8 1 29 G H1 4.000 . 5.500 3.930 3.047 5.362 . 0 0 "[ . 1]" 2
134 1 11 G H1 1 11 G H22 3.000 . 3.800 3.472 3.464 3.484 . 0 0 "[ . 1]" 2
135 1 11 G H1 1 12 A H1' 4.000 . 5.500 5.311 4.782 5.545 0.045 7 0 "[ . 1]" 2
136 1 13 G H21 1 13 G H22 4.000 . 5.500 1.756 1.749 1.760 0.051 7 0 "[ . 1]" 2
137 1 14 G H1 1 14 G H21 3.000 . 3.800 2.227 2.213 2.242 . 0 0 "[ . 1]" 2
138 1 14 G H1 1 15 A H1' 4.000 . 5.500 5.033 4.663 5.561 0.061 1 0 "[ . 1]" 2
139 1 16 C H41 1 16 C H42 3.000 . 3.800 1.751 1.749 1.754 0.051 4 0 "[ . 1]" 2
140 1 23 C H41 1 23 C H42 3.000 . 3.800 1.754 1.750 1.758 0.050 2 0 "[ . 1]" 2
141 1 24 C H41 1 24 C H42 3.000 . 3.800 1.754 1.748 1.758 0.052 2 0 "[ . 1]" 2
142 1 11 G H1 1 26 C H1' 4.000 . 5.500 5.330 5.180 5.538 0.038 10 0 "[ . 1]" 2
143 1 26 C H41 1 26 C H42 3.000 . 3.800 1.754 1.751 1.757 0.049 6 0 "[ . 1]" 2
144 1 11 G H1 1 26 C H5 4.000 . 5.500 4.877 4.765 5.014 . 0 0 "[ . 1]" 2
145 1 26 C H41 1 26 C H5 3.000 . 3.800 3.677 3.662 3.691 . 0 0 "[ . 1]" 2
146 1 26 C H42 1 26 C H5 4.000 . 5.500 2.421 2.403 2.444 . 0 0 "[ . 1]" 2
147 1 11 G H1 1 27 A H1' 4.000 . 5.500 5.335 4.728 5.576 0.076 3 0 "[ . 1]" 2
148 1 11 G H1 1 27 A H2 4.000 . 5.500 5.036 4.345 5.554 0.054 2 0 "[ . 1]" 2
149 1 29 G H1 1 29 G H21 3.000 . 3.800 2.196 2.177 2.212 . 0 0 "[ . 1]" 2
150 1 29 G H1 1 30 U H1' 3.000 . 3.800 3.999 3.944 4.097 0.297 2 0 "[ . 1]" 2
151 1 33 C H41 1 33 C H42 3.000 . 3.800 1.747 1.741 1.754 0.059 9 0 "[ . 1]" 2
152 1 2 G H1 1 35 C H42 4.000 . 5.500 5.599 5.541 5.630 0.130 9 0 "[ . 1]" 2
153 1 35 C H41 1 35 C H42 3.000 . 3.800 1.749 1.742 1.754 0.058 3 0 "[ . 1]" 2
154 1 3 G H1 1 36 C H1' 4.000 . 5.500 5.306 5.064 5.503 0.003 3 0 "[ . 1]" 2
155 1 36 C H41 1 36 C H42 3.000 . 3.800 1.753 1.749 1.758 0.051 9 0 "[ . 1]" 2
156 1 3 G H1 1 36 C H5 4.000 . 5.500 5.025 4.937 5.165 . 0 0 "[ . 1]" 2
157 1 36 C H42 1 36 C H5 4.000 . 5.500 2.410 2.394 2.427 . 0 0 "[ . 1]" 2
158 1 36 C H5 1 37 C H41 4.000 . 5.500 5.347 5.055 5.528 0.028 5 0 "[ . 1]" 2
159 1 3 G H1 1 36 C H6 4.000 . 5.500 5.607 5.560 5.640 0.140 1 0 "[ . 1]" 2
160 1 1 G H1 1 37 C H1' 4.000 . 5.500 4.930 4.704 5.078 . 0 0 "[ . 1]" 2
161 1 1 G H1 1 37 C H41 3.000 . 3.800 2.750 2.542 3.012 . 0 0 "[ . 1]" 2
162 1 1 G H1 1 37 C H42 4.000 . 5.500 4.217 4.050 4.427 . 0 0 "[ . 1]" 2
163 1 37 C H41 1 37 C H42 3.000 . 3.800 1.756 1.751 1.761 0.049 1 0 "[ . 1]" 2
164 1 37 C H42 1 37 C H6 4.000 . 5.500 4.638 4.624 4.647 . 0 0 "[ . 1]" 2
165 1 2 G H1 1 37 C H5 4.000 . 5.500 4.612 4.233 4.902 . 0 0 "[ . 1]" 2
166 1 37 C H41 1 37 C H5 3.000 . 3.800 3.688 3.682 3.694 . 0 0 "[ . 1]" 2
167 1 37 C H42 1 37 C H5 4.000 . 5.500 2.432 2.422 2.443 . 0 0 "[ . 1]" 2
168 1 36 C H2' 1 37 C H5' 4.000 . 5.500 3.015 2.736 3.485 . 0 0 "[ . 1]" 2
169 1 36 C H2' 1 37 C H5'' 4.000 . 5.500 4.458 4.079 4.970 . 0 0 "[ . 1]" 2
170 1 37 C H41 1 37 C H6 4.000 . 5.500 5.368 5.360 5.376 . 0 0 "[ . 1]" 2
171 1 35 C H2' 1 36 C H3' 4.000 . 5.500 5.013 4.914 5.111 . 0 0 "[ . 1]" 2
172 1 11 G H1' 1 27 A H2 4.400 . 7.000 5.361 4.332 6.441 . 0 0 "[ . 1]" 2
173 1 27 A H2 1 28 A H1' 3.000 . 3.800 3.674 3.079 3.919 0.119 5 0 "[ . 1]" 2
174 1 10 G H1' 1 28 A H2 4.400 . 7.000 4.990 4.547 6.108 . 0 0 "[ . 1]" 2
175 1 28 A H2 1 29 G H1' 3.000 . 3.800 3.604 3.153 3.867 0.067 5 0 "[ . 1]" 2
176 1 11 G H1' 1 28 A H2 4.400 . 7.000 5.184 4.245 7.041 0.041 2 0 "[ . 1]" 2
177 1 12 A H2 1 26 C H1' 4.000 . 5.500 3.998 3.624 4.467 . 0 0 "[ . 1]" 2
178 1 12 A H2 1 13 G H1' 3.000 . 3.800 3.918 3.804 3.961 0.161 3 0 "[ . 1]" 2
179 1 5 G H1' 1 34 A H2 4.000 . 5.500 3.705 3.315 3.876 . 0 0 "[ . 1]" 2
180 1 34 A H2 1 35 C H1' 3.000 . 3.800 2.710 2.610 2.874 . 0 0 "[ . 1]" 2
181 1 6 A H2 1 33 C H1' 4.000 . 5.500 3.217 3.021 3.700 . 0 0 "[ . 1]" 2
182 1 6 A H2 1 7 A H1' 3.000 . 3.800 2.925 2.680 3.099 . 0 0 "[ . 1]" 2
183 1 7 A H2 1 32 U H1' 4.000 . 5.500 3.234 3.038 3.608 . 0 0 "[ . 1]" 2
184 1 7 A H2 1 8 A H1' 3.000 . 3.800 3.678 3.428 3.848 0.048 4 0 "[ . 1]" 2
185 1 8 A H2 1 31 U H1' 4.000 . 5.500 3.518 3.015 3.917 . 0 0 "[ . 1]" 2
186 1 8 A H2 1 9 C H1' 3.000 . 3.800 3.424 3.137 3.817 0.017 9 0 "[ . 1]" 2
187 1 15 A H2 1 23 C H1' 4.000 . 5.500 2.990 2.798 3.590 . 0 0 "[ . 1]" 2
188 1 15 A H2 1 16 C H1' 3.000 . 3.800 3.866 3.746 3.972 0.172 1 0 "[ . 1]" 2
189 1 10 G H8 1 11 G H8 4.000 . 5.500 5.533 5.367 5.662 0.162 3 0 "[ . 1]" 2
190 1 28 A H8 1 29 G H8 4.000 . 5.500 5.217 4.317 5.797 0.297 6 0 "[ . 1]" 2
191 1 15 A H1' 1 15 A H3' 4.000 . 5.500 3.863 3.834 3.919 . 0 0 "[ . 1]" 2
192 1 15 A H1' 1 15 A H2' . . 3.800 2.804 2.761 2.890 . 0 0 "[ . 1]" 2
193 1 4 U H3 1 5 G H1' 4.000 . 5.500 5.236 4.857 5.507 0.007 4 0 "[ . 1]" 2
194 1 5 G H1 1 5 G H2' 4.000 . 5.500 5.578 5.350 5.674 0.174 5 0 "[ . 1]" 2
195 1 4 U H3 1 5 G H8 4.000 . 5.500 5.348 5.008 5.512 0.012 1 0 "[ . 1]" 2
196 1 5 G H1 1 6 A H1' 4.000 . 5.500 5.095 4.891 5.298 . 0 0 "[ . 1]" 2
197 1 5 G H1 1 6 A H61 3.000 . 3.800 3.953 3.865 4.014 0.214 4 0 "[ . 1]" 2
198 1 7 A H1' 1 32 U H3 4.000 . 5.500 5.585 5.556 5.616 0.116 3 0 "[ . 1]" 2
199 1 7 A H61 1 32 U H3 3.000 . 3.800 3.911 3.885 3.946 0.146 5 0 "[ . 1]" 2
200 1 13 G H1 1 14 G H1' 4.000 . 5.500 5.584 5.535 5.659 0.159 7 0 "[ . 1]" 2
201 1 16 C H2' 1 21 G H1 4.000 . 5.500 5.357 5.159 5.462 . 0 0 "[ . 1]" 2
202 1 16 C H5 1 21 G H1 4.000 . 5.500 4.696 4.608 4.744 . 0 0 "[ . 1]" 2
203 1 16 C H5 1 22 U H3 4.000 . 5.500 4.923 4.512 5.219 . 0 0 "[ . 1]" 2
204 1 14 G H1 1 23 C H1' 4.000 . 5.500 5.530 5.399 5.571 0.071 5 0 "[ . 1]" 2
205 1 22 U H3 1 23 C H1' 4.000 . 5.500 4.856 4.613 5.393 . 0 0 "[ . 1]" 2
206 1 14 G H1 1 23 C H2' 4.000 . 5.500 5.021 4.915 5.087 . 0 0 "[ . 1]" 2
207 1 22 U H3 1 23 C H42 4.000 . 5.500 3.926 3.663 4.165 . 0 0 "[ . 1]" 2
208 1 14 G H1 1 23 C H5 4.000 . 5.500 4.952 4.863 4.991 . 0 0 "[ . 1]" 2
209 1 22 U H3 1 23 C H5 3.000 . 3.800 3.841 3.655 3.887 0.087 9 0 "[ . 1]" 2
210 1 22 U H3 1 23 C H6 4.000 . 5.500 4.548 4.387 4.742 . 0 0 "[ . 1]" 2
211 1 13 G H1 1 24 C H1' 4.000 . 5.500 5.250 5.105 5.611 0.111 2 0 "[ . 1]" 2
212 1 14 G H1 1 24 C H1' 4.000 . 5.500 5.432 5.153 5.519 0.019 7 0 "[ . 1]" 2
213 1 13 G H1 1 24 C H5 4.000 . 5.500 4.871 4.830 4.910 . 0 0 "[ . 1]" 2
214 1 14 G H1 1 24 C H5 4.000 . 5.500 3.918 3.719 4.205 . 0 0 "[ . 1]" 2
215 1 13 G H1 1 25 U H1' 4.000 . 5.500 5.216 4.887 5.351 . 0 0 "[ . 1]" 2
216 1 13 G H1 1 25 U H5 4.000 . 5.500 4.737 4.218 5.005 . 0 0 "[ . 1]" 2
217 1 13 G H1 1 25 U H6 4.000 . 5.500 5.509 5.154 5.609 0.109 7 0 "[ . 1]" 2
218 1 25 U H3 1 26 C H1' 4.000 . 5.500 5.529 5.363 5.604 0.104 2 0 "[ . 1]" 2
219 1 25 U H3 1 26 C H5 3.000 . 3.800 3.788 3.566 3.884 0.084 10 0 "[ . 1]" 2
220 1 25 U H3 1 26 C H6 4.000 . 5.500 4.858 4.677 5.010 . 0 0 "[ . 1]" 2
221 1 30 U H3 1 31 U H5 4.000 . 5.500 4.436 3.999 4.788 . 0 0 "[ . 1]" 2
222 1 31 U H3 1 31 U H6 4.000 . 5.500 4.757 4.740 4.768 . 0 0 "[ . 1]" 2
223 1 31 U H3 1 32 U H1' 4.000 . 5.500 4.913 4.726 5.085 . 0 0 "[ . 1]" 2
224 1 5 G H1 1 33 C H1' 4.000 . 5.500 5.661 5.610 5.708 0.208 3 0 "[ . 1]" 2
225 1 32 U H3 1 33 C H1' 4.000 . 5.500 4.378 4.149 4.832 . 0 0 "[ . 1]" 2
226 1 5 G H1 1 33 C H2' 4.000 . 5.500 5.209 5.075 5.337 . 0 0 "[ . 1]" 2
227 1 5 G H1 1 33 C H5 4.000 . 5.500 4.739 4.609 4.922 . 0 0 "[ . 1]" 2
228 1 32 U H3 1 33 C H5 3.000 . 3.800 3.882 3.851 3.929 0.129 8 0 "[ . 1]" 2
229 1 5 G H1 1 34 A H1' 4.000 . 5.500 4.768 4.476 5.183 . 0 0 "[ . 1]" 2
230 1 5 G H1 1 34 A H8 4.000 . 5.500 4.751 4.549 5.012 . 0 0 "[ . 1]" 2
231 1 4 U H3 1 35 C H1' 4.000 . 5.500 5.612 5.579 5.640 0.140 9 0 "[ . 1]" 2
232 1 4 U H3 1 35 C H41 4.000 . 5.500 4.105 4.044 4.205 . 0 0 "[ . 1]" 2
233 1 3 G H1 1 35 C H5 4.000 . 5.500 4.754 4.703 4.835 . 0 0 "[ . 1]" 2
234 1 2 G H1 1 36 C H5 4.000 . 5.500 4.759 4.671 4.876 . 0 0 "[ . 1]" 2
235 1 2 G H1 1 37 C H6 4.000 . 5.500 5.269 4.853 5.540 0.040 10 0 "[ . 1]" 2
236 1 36 C H5 1 37 C H6 4.000 . 5.500 5.547 5.445 5.637 0.137 3 0 "[ . 1]" 2
237 1 9 C H2' 1 9 C H5 4.000 . 5.500 5.347 5.051 5.547 0.047 8 0 "[ . 1]" 2
238 1 15 A H3' 1 15 A H8 4.000 . 5.500 4.130 4.004 4.456 . 0 0 "[ . 1]" 2
239 1 15 A H2' 1 15 A H8 4.000 . 5.500 4.619 4.469 4.692 . 0 0 "[ . 1]" 2
240 1 4 U H2' 1 4 U H6 4.000 . 5.500 3.993 3.941 4.041 . 0 0 "[ . 1]" 2
241 1 10 G H3' 1 10 G H8 4.000 . 5.500 4.502 3.625 5.397 . 0 0 "[ . 1]" 2
242 1 11 G H1' 1 11 G H3' 4.000 . 5.500 3.976 3.882 4.073 . 0 0 "[ . 1]" 2
243 1 11 G H3' 1 11 G H8 4.000 . 5.500 4.355 3.841 5.022 . 0 0 "[ . 1]" 2
244 1 11 G H3' 1 12 A H8 4.000 . 5.500 2.475 2.039 3.119 . 0 0 "[ . 1]" 2
245 1 19 C H41 1 19 C H42 4.000 . 5.500 1.751 1.745 1.761 0.055 8 0 "[ . 1]" 2
246 1 24 C H6 1 25 U H6 4.000 . 5.500 5.031 4.827 5.534 0.034 2 0 "[ . 1]" 2
247 1 9 C H42 1 9 C H6 4.000 . 5.500 4.625 4.603 4.635 . 0 0 "[ . 1]" 2
248 1 9 C H42 1 9 C H5 4.000 . 5.500 2.426 2.405 2.442 . 0 0 "[ . 1]" 2
249 1 16 C H42 1 16 C H6 4.000 . 5.500 4.594 4.572 4.632 . 0 0 "[ . 1]" 2
250 1 34 A H2 1 34 A H2' 4.000 . 5.500 4.127 3.989 4.336 . 0 0 "[ . 1]" 2
251 1 35 C H42 1 35 C H5 4.000 . 5.500 2.448 2.420 2.467 . 0 0 "[ . 1]" 2
252 1 17 U H5 1 19 C H42 4.000 . 5.500 5.452 5.296 5.533 0.033 6 0 "[ . 1]" 2
253 1 19 C H42 1 19 C H5 4.000 . 5.500 2.398 2.369 2.415 . 0 0 "[ . 1]" 2
254 1 17 U H6 1 19 C H42 4.000 . 5.500 5.125 4.375 5.278 . 0 0 "[ . 1]" 2
255 1 19 C H42 1 19 C H6 4.000 . 5.500 4.604 4.573 4.628 . 0 0 "[ . 1]" 2
256 1 34 A H2 1 34 A H62 4.000 . 5.500 5.261 5.257 5.267 . 0 0 "[ . 1]" 2
257 1 33 C H41 1 34 A H62 4.000 . 5.500 3.474 3.109 3.695 . 0 0 "[ . 1]" 2
258 1 34 A H62 1 35 C H41 4.000 . 5.500 4.369 4.161 4.567 . 0 0 "[ . 1]" 2
259 1 21 G H1' 1 21 G H2' 4.000 . 5.500 2.798 2.782 2.839 . 0 0 "[ . 1]" 2
260 1 34 A H62 1 35 C H42 4.000 . 5.500 4.093 3.937 4.303 . 0 0 "[ . 1]" 2
261 1 24 C H42 1 24 C H5 4.000 . 5.500 2.450 2.440 2.460 . 0 0 "[ . 1]" 2
262 1 10 G H8 1 28 A H2 4.400 . 7.000 5.911 5.283 7.038 0.038 3 0 "[ . 1]" 2
263 1 11 G H8 1 28 A H2 4.400 . 7.000 5.884 4.965 6.920 . 0 0 "[ . 1]" 2
264 1 27 A H2 1 28 A H2 4.000 . 5.500 4.126 3.315 4.867 . 0 0 "[ . 1]" 2
265 1 11 G H8 1 27 A H2 4.400 . 7.000 6.186 5.662 6.639 . 0 0 "[ . 1]" 2
266 1 9 C H3' 1 10 G H8 4.000 . 5.500 4.857 4.145 5.500 0.000 6 0 "[ . 1]" 2
267 1 10 G H5' 1 10 G H8 4.000 . 5.500 4.599 3.672 5.641 0.141 4 0 "[ . 1]" 2
268 1 33 C H3' 1 33 C H6 4.000 . 5.500 3.877 3.731 3.971 . 0 0 "[ . 1]" 2
269 1 10 G H4' 1 10 G H8 4.000 . 5.500 5.253 4.367 5.600 0.100 7 0 "[ . 1]" 2
270 1 26 C H3' 1 27 A H8 4.000 . 5.500 3.574 3.057 4.102 . 0 0 "[ . 1]" 2
271 1 27 A H3' 1 27 A H8 4.000 . 5.500 3.548 2.965 4.535 . 0 0 "[ . 1]" 2
272 1 27 A H5' 1 27 A H8 4.000 . 5.500 4.818 4.522 5.275 . 0 0 "[ . 1]" 2
273 1 27 A H5'' 1 27 A H8 4.000 . 5.500 3.453 2.913 3.963 . 0 0 "[ . 1]" 2
274 1 27 A H3' 1 28 A H8 4.000 . 5.500 4.582 3.673 5.318 . 0 0 "[ . 1]" 2
275 1 28 A H5' 1 28 A H8 4.000 . 5.500 4.181 2.307 4.894 . 0 0 "[ . 1]" 2
276 1 28 A H5'' 1 28 A H8 4.000 . 5.500 3.489 2.704 4.336 . 0 0 "[ . 1]" 2
277 1 2 G H1 1 35 C H41 4.400 . 7.000 4.357 4.297 4.406 . 0 0 "[ . 1]" 2
278 1 3 G H1 1 36 C H41 4.000 . 5.500 4.051 3.880 4.188 . 0 0 "[ . 1]" 2
279 1 3 G H1 1 36 C H42 4.000 . 5.500 4.544 4.375 4.750 . 0 0 "[ . 1]" 2
280 1 4 U H3 1 35 C H42 4.000 . 5.500 4.987 4.882 5.146 . 0 0 "[ . 1]" 2
281 1 4 U H3 1 33 C H41 4.000 . 5.500 4.605 4.420 4.716 . 0 0 "[ . 1]" 2
282 1 4 U H3 1 33 C H42 4.000 . 5.500 5.771 5.684 5.838 0.338 9 0 "[ . 1]" 2
283 1 5 G H1 1 34 A H61 4.000 . 5.500 4.847 4.399 5.109 . 0 0 "[ . 1]" 2
284 1 5 G H1 1 6 A H62 4.000 . 5.500 3.830 3.640 4.134 . 0 0 "[ . 1]" 2
285 1 32 U H3 1 33 C H42 4.000 . 5.500 4.761 4.460 4.934 . 0 0 "[ . 1]" 2
286 1 7 A H62 1 32 U H3 4.000 . 5.500 4.429 4.385 4.464 . 0 0 "[ . 1]" 2
287 1 8 A H61 1 31 U H3 4.400 . 7.000 4.518 4.169 4.733 . 0 0 "[ . 1]" 2
288 1 8 A H62 1 31 U H3 4.400 . 7.000 5.086 4.530 5.406 . 0 0 "[ . 1]" 2
289 1 6 A H61 1 31 U H3 4.000 . 5.500 4.389 4.250 4.450 . 0 0 "[ . 1]" 2
290 1 6 A H62 1 31 U H3 4.000 . 5.500 5.540 5.378 5.606 0.106 8 0 "[ . 1]" 2
291 1 7 A H61 1 30 U H3 4.400 . 7.000 4.063 3.757 4.402 . 0 0 "[ . 1]" 2
292 1 7 A H62 1 30 U H3 4.400 . 7.000 4.988 4.557 5.485 . 0 0 "[ . 1]" 2
293 1 9 C H41 1 30 U H3 4.400 . 7.000 3.903 3.768 4.027 . 0 0 "[ . 1]" 2
294 1 9 C H42 1 30 U H3 4.400 . 7.000 4.732 4.632 4.943 . 0 0 "[ . 1]" 2
295 1 28 A H2 1 29 G H1 4.000 . 5.500 4.978 4.593 5.522 0.022 10 0 "[ . 1]" 2
296 1 11 G H1 1 12 A H62 4.400 . 7.000 4.555 4.379 5.125 . 0 0 "[ . 1]" 2
297 1 12 A H62 1 25 U H3 4.400 . 7.000 4.592 4.350 4.809 . 0 0 "[ . 1]" 2
298 1 12 A H62 1 13 G H1 4.400 . 7.000 5.643 5.381 5.897 . 0 0 "[ . 1]" 2
299 1 25 U H3 1 26 C H41 4.000 . 5.500 4.033 3.879 4.211 . 0 0 "[ . 1]" 2
300 1 25 U H3 1 26 C H42 4.000 . 5.500 3.839 3.579 3.946 . 0 0 "[ . 1]" 2
301 1 24 C H42 1 25 U H3 4.000 . 5.500 5.534 5.496 5.568 0.068 2 0 "[ . 1]" 2
302 1 13 G H1 1 23 C H41 4.000 . 5.500 4.293 4.223 4.338 . 0 0 "[ . 1]" 2
303 1 13 G H1 1 23 C H42 4.000 . 5.500 5.477 5.408 5.541 0.041 4 0 "[ . 1]" 2
304 1 14 G H1 1 15 A H61 4.000 . 5.500 4.334 3.903 4.585 . 0 0 "[ . 1]" 2
305 1 16 C H41 1 22 U H3 4.000 . 5.500 3.560 3.241 3.852 . 0 0 "[ . 1]" 2
306 1 16 C H42 1 22 U H3 4.000 . 5.500 4.064 3.458 4.414 . 0 0 "[ . 1]" 2
307 1 24 C H6 1 25 U H5 4.000 . 5.500 4.943 4.670 5.208 . 0 0 "[ . 1]" 2
308 1 28 A H2' 1 28 A H8 3.000 . 3.800 3.599 2.410 3.991 0.191 5 0 "[ . 1]" 2
309 1 21 G H8 1 22 U H6 4.000 . 5.500 5.011 4.724 5.196 . 0 0 "[ . 1]" 2
310 1 2 G H8 1 3 G H8 4.000 . 5.500 5.412 5.189 5.555 0.055 2 0 "[ . 1]" 2
311 1 28 A H2' 1 29 G H1' 4.400 . 7.000 4.145 2.703 7.023 0.023 10 0 "[ . 1]" 2
312 1 25 U H2' 1 26 C H1' 4.000 . 5.500 4.853 4.710 5.024 . 0 0 "[ . 1]" 2
313 1 11 G H2' 1 12 A H1' 4.400 . 7.000 4.357 3.992 4.635 . 0 0 "[ . 1]" 2
314 1 8 A H2' 1 9 C H1' 4.000 . 5.500 4.134 3.787 4.691 . 0 0 "[ . 1]" 2
315 1 25 U Q5' 1 25 U H6 4.000 . 5.500 3.838 3.443 4.163 . 0 0 "[ . 1]" 2
316 1 4 U H2' 1 5 G H1' 4.000 . 5.500 3.411 3.177 3.606 . 0 0 "[ . 1]" 2
317 1 7 A H2' 1 8 A H1' 4.000 . 5.500 3.103 2.642 3.595 . 0 0 "[ . 1]" 2
318 1 21 G H2' 1 22 U H1' 4.000 . 5.500 3.759 3.626 3.869 . 0 0 "[ . 1]" 2
319 1 22 U H2' 1 23 C H1' 4.000 . 5.500 3.715 3.473 4.118 . 0 0 "[ . 1]" 2
320 1 30 U H2' 1 31 U H1' 4.000 . 5.500 3.897 3.626 4.799 . 0 0 "[ . 1]" 2
321 1 31 U H2' 1 32 U H1' 4.000 . 5.500 3.399 3.067 3.742 . 0 0 "[ . 1]" 2
322 1 3 G H2' 1 4 U H1' 4.000 . 5.500 3.999 3.910 4.092 . 0 0 "[ . 1]" 2
323 1 29 G H8 1 30 U H6 4.000 . 5.500 5.194 4.488 5.523 0.023 6 0 "[ . 1]" 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 81
_Distance_constraint_stats_list.Viol_count 99
_Distance_constraint_stats_list.Viol_total 28.877
_Distance_constraint_stats_list.Viol_max 0.125
_Distance_constraint_stats_list.Viol_rms 0.0125
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0036
_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 0.084 0.031 8 0 "[ . 1]"
1 2 G 0.000 0.000 . 0 "[ . 1]"
1 3 G 0.045 0.029 6 0 "[ . 1]"
1 4 U 0.000 0.000 . 0 "[ . 1]"
1 5 G 0.000 0.000 . 0 "[ . 1]"
1 6 A 0.000 0.000 . 0 "[ . 1]"
1 7 A 0.029 0.012 3 0 "[ . 1]"
1 8 A 0.028 0.014 2 0 "[ . 1]"
1 9 C 0.024 0.018 8 0 "[ . 1]"
1 11 G 0.137 0.070 10 0 "[ . 1]"
1 12 A 1.094 0.125 10 0 "[ . 1]"
1 13 G 0.858 0.058 1 0 "[ . 1]"
1 14 G 0.249 0.039 9 0 "[ . 1]"
1 15 A 0.000 0.000 . 0 "[ . 1]"
1 16 C 0.339 0.047 3 0 "[ . 1]"
1 17 U 0.000 0.000 . 0 "[ . 1]"
1 20 G 0.000 0.000 . 0 "[ . 1]"
1 21 G 0.339 0.047 3 0 "[ . 1]"
1 22 U 0.000 0.000 . 0 "[ . 1]"
1 23 C 0.249 0.039 9 0 "[ . 1]"
1 24 C 0.858 0.058 1 0 "[ . 1]"
1 25 U 1.094 0.125 10 0 "[ . 1]"
1 26 C 0.137 0.070 10 0 "[ . 1]"
1 29 G 0.024 0.018 8 0 "[ . 1]"
1 30 U 0.028 0.014 2 0 "[ . 1]"
1 31 U 0.029 0.012 3 0 "[ . 1]"
1 32 U 0.000 0.000 . 0 "[ . 1]"
1 33 C 0.000 0.000 . 0 "[ . 1]"
1 34 A 0.000 0.000 . 0 "[ . 1]"
1 35 C 0.045 0.029 6 0 "[ . 1]"
1 36 C 0.000 0.000 . 0 "[ . 1]"
1 37 C 0.084 0.031 8 0 "[ . 1]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 G H1 1 37 C N3 1.890 . 2.190 1.872 1.807 1.923 . 0 0 "[ . 1]" 3
2 1 1 G H21 1 37 C O2 2.080 . 2.380 1.788 1.637 1.932 . 0 0 "[ . 1]" 3
3 1 1 G O6 1 37 C H41 1.710 . 2.010 1.919 1.758 2.041 0.031 8 0 "[ . 1]" 3
4 1 1 G N1 1 37 C N3 2.910 2.410 3.210 2.867 2.814 2.901 . 0 0 "[ . 1]" 3
5 1 1 G O6 1 37 C N4 2.720 2.220 3.020 2.909 2.769 3.024 0.004 8 0 "[ . 1]" 3
6 1 1 G N2 1 37 C O2 3.080 2.580 3.380 2.779 2.642 2.921 . 0 0 "[ . 1]" 3
7 1 2 G H1 1 36 C N3 1.890 . 2.190 1.815 1.751 1.893 . 0 0 "[ . 1]" 3
8 1 2 G H21 1 36 C O2 2.080 . 2.380 1.817 1.676 1.951 . 0 0 "[ . 1]" 3
9 1 2 G O6 1 36 C H41 1.710 . 2.010 1.730 1.694 1.759 . 0 0 "[ . 1]" 3
10 1 2 G N1 1 36 C N3 2.910 2.410 3.210 2.802 2.761 2.857 . 0 0 "[ . 1]" 3
11 1 2 G O6 1 36 C N4 2.720 2.220 3.020 2.706 2.690 2.749 . 0 0 "[ . 1]" 3
12 1 2 G N2 1 36 C O2 3.080 2.580 3.380 2.807 2.683 2.918 . 0 0 "[ . 1]" 3
13 1 3 G H1 1 35 C N3 1.890 . 2.190 1.961 1.914 2.012 . 0 0 "[ . 1]" 3
14 1 3 G H21 1 35 C O2 2.080 . 2.380 1.914 1.817 1.982 . 0 0 "[ . 1]" 3
15 1 3 G O6 1 35 C H41 1.710 . 2.010 1.987 1.907 2.039 0.029 6 0 "[ . 1]" 3
16 1 3 G N1 1 35 C N3 2.910 2.410 3.210 2.936 2.891 2.977 . 0 0 "[ . 1]" 3
17 1 3 G O6 1 35 C N4 2.720 2.220 3.020 2.959 2.874 3.005 . 0 0 "[ . 1]" 3
18 1 3 G N2 1 35 C O2 3.080 2.580 3.380 2.814 2.736 2.885 . 0 0 "[ . 1]" 3
19 1 4 U H3 1 34 A N1 1.930 . 2.230 1.813 1.776 1.867 . 0 0 "[ . 1]" 3
20 1 4 U O4 1 34 A H61 1.820 . 2.120 1.931 1.863 2.010 . 0 0 "[ . 1]" 3
21 1 4 U N3 1 34 A N1 2.950 2.450 3.250 2.783 2.748 2.844 . 0 0 "[ . 1]" 3
22 1 4 U O4 1 34 A N6 2.830 2.330 3.130 2.933 2.863 3.011 . 0 0 "[ . 1]" 3
23 1 5 G H1 1 33 C N3 1.890 . 2.190 1.876 1.807 1.936 . 0 0 "[ . 1]" 3
24 1 5 G H21 1 33 C O2 2.080 . 2.380 2.112 1.889 2.231 . 0 0 "[ . 1]" 3
25 1 5 G O6 1 33 C H41 1.710 . 2.010 1.694 1.650 1.756 . 0 0 "[ . 1]" 3
26 1 5 G N1 1 33 C N3 2.910 2.410 3.210 2.882 2.806 2.948 . 0 0 "[ . 1]" 3
27 1 5 G O6 1 33 C N4 2.720 2.220 3.020 2.579 2.554 2.607 . 0 0 "[ . 1]" 3
28 1 5 G N2 1 33 C O2 3.080 2.580 3.380 3.110 2.865 3.236 . 0 0 "[ . 1]" 3
29 1 6 A N1 1 32 U H3 1.930 . 2.230 1.932 1.852 2.091 . 0 0 "[ . 1]" 3
30 1 6 A H61 1 32 U O4 1.820 . 2.120 1.838 1.665 1.974 . 0 0 "[ . 1]" 3
31 1 6 A N1 1 32 U N3 2.950 2.450 3.250 2.940 2.863 3.102 . 0 0 "[ . 1]" 3
32 1 6 A N6 1 32 U O4 2.830 2.330 3.130 2.830 2.666 2.967 . 0 0 "[ . 1]" 3
33 1 7 A N1 1 31 U H3 1.930 . 2.230 1.787 1.739 1.873 . 0 0 "[ . 1]" 3
34 1 7 A H61 1 31 U O4 1.820 . 2.120 2.025 1.871 2.132 0.012 3 0 "[ . 1]" 3
35 1 7 A N1 1 31 U N3 2.950 2.450 3.250 2.781 2.732 2.855 . 0 0 "[ . 1]" 3
36 1 7 A N6 1 31 U O4 2.830 2.330 3.130 3.031 2.875 3.136 0.006 4 0 "[ . 1]" 3
37 1 8 A N1 1 30 U H3 1.930 . 2.230 1.798 1.713 1.838 . 0 0 "[ . 1]" 3
38 1 8 A H61 1 30 U O4 1.820 . 2.120 2.002 1.881 2.134 0.014 2 0 "[ . 1]" 3
39 1 8 A N1 1 30 U N3 2.950 2.450 3.250 2.786 2.703 2.834 . 0 0 "[ . 1]" 3
40 1 8 A N6 1 30 U O4 2.830 2.330 3.130 3.004 2.888 3.144 0.014 2 0 "[ . 1]" 3
41 1 9 C N3 1 29 G H1 1.890 . 2.190 1.938 1.810 2.136 . 0 0 "[ . 1]" 3
42 1 9 C O2 1 29 G H21 2.080 . 2.380 2.108 1.786 2.398 0.018 8 0 "[ . 1]" 3
43 1 9 C H41 1 29 G O6 1.710 . 2.010 1.692 1.600 1.856 . 0 0 "[ . 1]" 3
44 1 9 C N3 1 29 G N1 2.910 2.410 3.210 2.947 2.825 3.147 . 0 0 "[ . 1]" 3
45 1 9 C N4 1 29 G O6 2.720 2.220 3.020 2.698 2.614 2.846 . 0 0 "[ . 1]" 3
46 1 9 C O2 1 29 G N2 3.080 2.580 3.380 3.104 2.793 3.386 0.006 8 0 "[ . 1]" 3
47 1 11 G H1 1 26 C N3 1.890 . 2.190 1.896 1.805 2.081 . 0 0 "[ . 1]" 3
48 1 11 G H21 1 26 C O2 2.080 . 2.380 1.983 1.750 2.447 0.067 10 0 "[ . 1]" 3
49 1 11 G O6 1 26 C H41 1.710 . 2.010 1.716 1.621 1.807 . 0 0 "[ . 1]" 3
50 1 11 G N1 1 26 C N3 2.910 2.410 3.210 2.898 2.809 3.089 . 0 0 "[ . 1]" 3
51 1 11 G O6 1 26 C N4 2.720 2.220 3.020 2.713 2.625 2.817 . 0 0 "[ . 1]" 3
52 1 11 G N2 1 26 C O2 3.080 2.580 3.380 2.973 2.743 3.450 0.070 10 0 "[ . 1]" 3
53 1 12 A N1 1 25 U H3 1.930 . 2.230 2.171 1.852 2.355 0.125 10 0 "[ . 1]" 3
54 1 12 A H61 1 25 U O4 1.820 . 2.120 2.157 2.114 2.188 0.068 8 0 "[ . 1]" 3
55 1 12 A N1 1 25 U N3 2.950 2.450 3.250 3.151 2.854 3.314 0.064 10 0 "[ . 1]" 3
56 1 12 A N6 1 25 U O4 2.830 2.330 3.130 3.133 3.086 3.177 0.047 9 0 "[ . 1]" 3
57 1 13 G H1 1 24 C N3 1.890 . 2.190 1.851 1.814 1.939 . 0 0 "[ . 1]" 3
58 1 13 G H21 1 24 C O2 2.080 . 2.380 1.597 1.556 1.796 0.024 1 0 "[ . 1]" 3
59 1 13 G O6 1 24 C H41 1.710 . 2.010 2.030 1.951 2.066 0.056 4 0 "[ . 1]" 3
60 1 13 G N1 1 24 C N3 2.910 2.410 3.210 2.849 2.819 2.932 . 0 0 "[ . 1]" 3
61 1 13 G O6 1 24 C N4 2.720 2.220 3.020 3.030 2.939 3.071 0.051 4 0 "[ . 1]" 3
62 1 13 G N2 1 24 C O2 3.080 2.580 3.380 2.575 2.522 2.778 0.058 1 0 "[ . 1]" 3
63 1 14 G H1 1 23 C N3 1.890 . 2.190 1.935 1.905 1.973 . 0 0 "[ . 1]" 3
64 1 14 G H21 1 23 C O2 2.080 . 2.380 1.735 1.662 1.787 . 0 0 "[ . 1]" 3
65 1 14 G O6 1 23 C H41 1.710 . 2.010 2.019 1.986 2.049 0.039 9 0 "[ . 1]" 3
66 1 14 G N1 1 23 C N3 2.910 2.410 3.210 2.933 2.904 2.974 . 0 0 "[ . 1]" 3
67 1 14 G O6 1 23 C N4 2.720 2.220 3.020 3.030 2.996 3.059 0.039 9 0 "[ . 1]" 3
68 1 14 G N2 1 23 C O2 3.080 2.580 3.380 2.717 2.651 2.773 . 0 0 "[ . 1]" 3
69 1 15 A N1 1 22 U H3 1.930 . 2.230 2.048 1.974 2.124 . 0 0 "[ . 1]" 3
70 1 15 A H61 1 22 U O4 1.820 . 2.120 1.947 1.767 2.120 . 0 0 "[ . 1]" 3
71 1 15 A N1 1 22 U N3 2.950 2.450 3.250 3.029 2.953 3.084 . 0 0 "[ . 1]" 3
72 1 15 A N6 1 22 U O4 2.830 2.330 3.130 2.925 2.763 3.115 . 0 0 "[ . 1]" 3
73 1 16 C N3 1 21 G H1 1.890 . 2.190 2.043 1.908 2.118 . 0 0 "[ . 1]" 3
74 1 16 C O2 1 21 G H21 2.080 . 2.380 2.367 2.125 2.427 0.047 3 0 "[ . 1]" 3
75 1 16 C H41 1 21 G O6 1.710 . 2.010 1.707 1.666 1.792 . 0 0 "[ . 1]" 3
76 1 16 C N3 1 21 G N1 2.910 2.410 3.210 3.039 2.900 3.109 . 0 0 "[ . 1]" 3
77 1 16 C N4 1 21 G O6 2.720 2.220 3.020 2.607 2.573 2.684 . 0 0 "[ . 1]" 3
78 1 16 C O2 1 21 G N2 3.080 2.580 3.380 3.347 3.095 3.418 0.038 3 0 "[ . 1]" 3
79 1 17 U O2' 1 20 G O6 2.900 2.400 3.400 2.532 2.468 2.715 . 0 0 "[ . 1]" 3
80 1 17 U O2 1 20 G N1 3.000 2.500 3.500 2.848 2.681 2.929 . 0 0 "[ . 1]" 3
81 1 17 U O2 1 20 G H1 2.000 . 2.500 1.842 1.741 1.913 . 0 0 "[ . 1]" 3
stop_
save_
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