NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
399173 |
1txs   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1txs
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 511
_Distance_constraint_stats_list.Viol_count 1166
_Distance_constraint_stats_list.Viol_total 3894.594
_Distance_constraint_stats_list.Viol_max 0.750
_Distance_constraint_stats_list.Viol_rms 0.0661
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0191
_Distance_constraint_stats_list.Viol_average_violations_only 0.1670
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 G 2.952 0.186 4 0 "[ . 1 . 2]"
1 2 G 8.831 0.330 10 0 "[ . 1 . 2]"
1 3 G 11.091 0.330 10 0 "[ . 1 . 2]"
1 4 C 5.777 0.317 3 0 "[ . 1 . 2]"
1 5 U 2.187 0.544 9 1 "[ . +1 . 2]"
1 6 A 4.812 0.544 9 1 "[ . +1 . 2]"
1 7 G 5.673 0.374 6 0 "[ . 1 . 2]"
1 8 C 13.534 0.472 9 0 "[ . 1 . 2]"
1 9 A 11.138 0.472 9 0 "[ . 1 . 2]"
1 10 C 5.071 0.439 11 0 "[ . 1 . 2]"
1 11 U 9.092 0.750 15 3 "[ * . 1- + 2]"
1 12 C 9.906 0.750 15 4 "[ * . -* + 2]"
1 13 U 4.988 0.515 10 1 "[ . + . 2]"
1 14 G 7.897 0.254 7 0 "[ . 1 . 2]"
1 15 G 11.847 0.313 18 0 "[ . 1 . 2]"
1 16 U 11.590 0.313 18 0 "[ . 1 . 2]"
1 17 A 15.869 0.520 18 3 "[* . 1 - . + 2]"
1 18 U 24.957 0.520 18 3 "[* . 1 - . + 2]"
1 19 U 30.064 0.440 10 0 "[ . 1 . 2]"
1 20 A 10.981 0.365 7 0 "[ . 1 . 2]"
1 21 C 29.121 0.503 20 1 "[ . 1 . +]"
1 22 G 8.673 0.503 20 1 "[ . 1 . +]"
1 23 G 2.094 0.338 18 0 "[ . 1 . 2]"
1 24 U 6.112 0.345 3 0 "[ . 1 . 2]"
1 25 A 12.167 0.345 3 0 "[ . 1 . 2]"
1 26 C 14.505 0.307 4 0 "[ . 1 . 2]"
1 27 C 4.631 0.307 4 0 "[ . 1 . 2]"
1 28 U 1.861 0.393 2 0 "[ . 1 . 2]"
1 29 U 5.529 0.706 19 2 "[ -. 1 . +2]"
1 30 U 5.214 0.706 19 2 "[ -. 1 . +2]"
1 31 G 8.692 0.381 5 0 "[ . 1 . 2]"
1 32 U 9.602 0.381 5 0 "[ . 1 . 2]"
1 33 G 5.782 0.313 16 0 "[ . 1 . 2]"
1 34 C 3.523 0.313 16 0 "[ . 1 . 2]"
1 35 G 6.884 0.449 17 0 "[ . 1 . 2]"
1 36 C 13.595 0.449 17 0 "[ . 1 . 2]"
1 37 C 17.538 0.534 7 4 "[ - + 1 . * *]"
1 38 C 10.827 0.534 7 4 "[ - + 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 2 G H5' 3.500 . 6.000 4.235 4.119 4.726 . 0 0 "[ . 1 . 2]" 1
2 1 1 G H1' 1 2 G H5'' 3.500 . 6.000 5.949 5.851 6.186 0.186 4 0 "[ . 1 . 2]" 1
3 1 1 G H1' 1 2 G H8 3.500 . 5.000 5.084 5.056 5.117 0.117 15 0 "[ . 1 . 2]" 1
4 1 1 G H1 1 2 G H1 3.500 . 6.000 3.708 3.621 4.036 . 0 0 "[ . 1 . 2]" 1
5 1 1 G H2' 1 2 G H5' 3.500 . 6.000 2.648 2.560 3.325 . 0 0 "[ . 1 . 2]" 1
6 1 1 G H2' 1 2 G H5'' 3.500 . 6.000 3.952 3.880 4.153 . 0 0 "[ . 1 . 2]" 1
7 1 1 G H2' 1 2 G H1' 3.500 . 5.000 4.236 4.112 4.320 . 0 0 "[ . 1 . 2]" 1
8 1 1 G H2' 1 2 G H4' 3.500 . 6.000 4.031 3.977 4.232 . 0 0 "[ . 1 . 2]" 1
9 1 1 G H2' 1 2 G H8 3.500 . 4.000 2.549 2.488 2.589 . 0 0 "[ . 1 . 2]" 1
10 1 1 G H4' 1 2 G H5' 3.500 . 6.000 4.518 4.381 4.889 . 0 0 "[ . 1 . 2]" 1
11 1 1 G H4' 1 2 G H5'' 3.500 . 6.000 5.761 5.692 6.046 0.046 4 0 "[ . 1 . 2]" 1
12 1 1 G H4' 1 2 G H8 3.500 . 6.000 5.991 5.797 6.130 0.130 10 0 "[ . 1 . 2]" 1
13 1 1 G H8 1 2 G H8 3.500 . 5.000 4.745 4.700 4.876 . 0 0 "[ . 1 . 2]" 1
14 1 2 G H1' 1 3 G H8 3.500 . 6.000 5.090 5.058 5.116 . 0 0 "[ . 1 . 2]" 1
15 1 2 G H2' 1 3 G H8 3.500 . 4.000 2.329 2.318 2.337 . 0 0 "[ . 1 . 2]" 1
16 1 2 G H3' 1 3 G H5' 3.500 . 5.000 4.716 4.654 4.758 . 0 0 "[ . 1 . 2]" 1
17 1 2 G H3' 1 3 G H5'' 3.500 . 5.000 5.294 5.280 5.330 0.330 10 0 "[ . 1 . 2]" 1
18 1 2 G H3' 1 3 G H8 3.500 . 4.000 3.397 3.291 3.496 . 0 0 "[ . 1 . 2]" 1
19 1 2 G H5'' 1 2 G H8 3.500 . 5.000 4.524 4.288 4.563 . 0 0 "[ . 1 . 2]" 1
20 1 2 G H5' 1 2 G H8 3.500 . 5.000 4.120 3.844 4.428 . 0 0 "[ . 1 . 2]" 1
21 1 3 G H1' 1 4 C H6 3.500 . 5.000 5.094 5.020 5.127 0.127 6 0 "[ . 1 . 2]" 1
22 1 3 G H1 1 4 C H1' 3.500 . 6.000 5.644 4.548 6.128 0.128 5 0 "[ . 1 . 2]" 1
23 1 3 G H1 1 35 G H1 3.500 . 6.000 4.264 3.886 4.525 . 0 0 "[ . 1 . 2]" 1
24 1 3 G H1 1 36 C H41 3.500 . 6.000 2.412 2.403 2.431 . 0 0 "[ . 1 . 2]" 1
25 1 3 G H1 1 36 C H42 3.500 . 6.000 3.921 3.916 3.926 . 0 0 "[ . 1 . 2]" 1
26 1 3 G H1 1 36 C H5 3.500 . 5.000 4.954 4.942 4.961 . 0 0 "[ . 1 . 2]" 1
27 1 3 G H2' 1 4 C H5 3.500 . 5.000 3.819 3.214 4.396 . 0 0 "[ . 1 . 2]" 1
28 1 3 G H2' 1 4 C H6 3.500 . 4.000 2.374 2.317 2.508 . 0 0 "[ . 1 . 2]" 1
29 1 3 G H3' 1 4 C H5 3.500 . 5.000 3.946 3.485 4.685 . 0 0 "[ . 1 . 2]" 1
30 1 3 G H3' 1 4 C H5' 3.500 . 5.000 4.578 3.760 5.261 0.261 19 0 "[ . 1 . 2]" 1
31 1 3 G H3' 1 4 C H5'' 3.500 . 5.000 4.667 3.340 5.317 0.317 3 0 "[ . 1 . 2]" 1
32 1 3 G H3' 1 4 C H6 3.500 . 4.000 3.224 2.414 3.697 . 0 0 "[ . 1 . 2]" 1
33 1 3 G H4' 1 4 C H6 3.500 . 6.000 5.702 5.277 6.094 0.094 19 0 "[ . 1 . 2]" 1
34 1 3 G H5' 1 3 G H8 3.500 . 6.000 4.335 4.169 4.389 . 0 0 "[ . 1 . 2]" 1
35 1 3 G H5'' 1 3 G H8 3.500 . 6.000 4.266 4.137 4.307 . 0 0 "[ . 1 . 2]" 1
36 1 3 G H8 1 4 C H5 3.500 . 5.000 4.137 3.634 4.457 . 0 0 "[ . 1 . 2]" 1
37 1 4 C H1' 1 6 A H8 3.500 . 6.000 5.963 5.734 6.207 0.207 17 0 "[ . 1 . 2]" 1
38 1 4 C H2' 1 6 A H8 3.500 . 6.000 4.895 3.827 5.623 . 0 0 "[ . 1 . 2]" 1
39 1 4 C H4' 1 4 C H6 3.500 . 5.000 4.108 3.956 4.192 . 0 0 "[ . 1 . 2]" 1
40 1 4 C H41 1 35 G H1 3.500 . 6.000 2.426 2.408 2.436 . 0 0 "[ . 1 . 2]" 1
41 1 4 C H42 1 35 G H1 3.500 . 6.000 3.939 3.923 3.947 . 0 0 "[ . 1 . 2]" 1
42 1 5 U H1' 1 5 U H6 3.500 . 5.000 3.409 3.272 3.550 . 0 0 "[ . 1 . 2]" 1
43 1 5 U H1' 1 6 A H8 3.500 . 5.000 4.526 2.350 5.544 0.544 9 1 "[ . +1 . 2]" 1
44 1 5 U H2' 1 6 A H8 3.500 . 4.000 3.462 2.328 4.086 0.086 15 0 "[ . 1 . 2]" 1
45 1 5 U H4' 1 6 A H8 3.500 . 5.000 4.829 3.726 5.177 0.177 17 0 "[ . 1 . 2]" 1
46 1 6 A H1' 1 7 G H8 3.500 . 5.000 4.247 2.333 5.223 0.223 15 0 "[ . 1 . 2]" 1
47 1 6 A H2' 1 6 A H8 3.500 . 5.000 3.700 2.276 4.668 . 0 0 "[ . 1 . 2]" 1
48 1 6 A H2' 1 7 G H8 3.500 . 5.000 2.911 2.337 4.077 . 0 0 "[ . 1 . 2]" 1
49 1 6 A H2' 1 7 G H5' 3.500 . 6.000 4.441 2.335 6.311 0.311 16 0 "[ . 1 . 2]" 1
50 1 6 A H2' 1 7 G H5'' 3.500 . 6.000 3.888 2.337 5.065 . 0 0 "[ . 1 . 2]" 1
51 1 6 A H2 1 7 G H1' 3.500 . 5.000 4.000 2.344 4.907 . 0 0 "[ . 1 . 2]" 1
52 1 6 A H4' 1 6 A H8 3.500 . 6.000 4.522 3.975 5.025 . 0 0 "[ . 1 . 2]" 1
53 1 6 A H4' 1 7 G H8 3.500 . 6.000 5.695 4.871 6.374 0.374 6 0 "[ . 1 . 2]" 1
54 1 6 A H8 1 7 G H8 3.500 . 5.000 4.587 3.887 4.956 . 0 0 "[ . 1 . 2]" 1
55 1 7 G H1' 1 8 C H6 3.500 . 6.000 4.931 4.897 5.029 . 0 0 "[ . 1 . 2]" 1
56 1 7 G H1 1 8 C H1' 3.500 . 5.000 5.181 5.115 5.282 0.282 10 0 "[ . 1 . 2]" 1
57 1 7 G H2' 1 8 C H5 3.500 . 5.000 3.674 3.347 3.886 . 0 0 "[ . 1 . 2]" 1
58 1 7 G H2' 1 8 C H6 3.500 . 4.000 2.327 2.298 2.385 . 0 0 "[ . 1 . 2]" 1
59 1 7 G H3' 1 8 C H5 3.500 . 5.000 3.302 3.014 3.678 . 0 0 "[ . 1 . 2]" 1
60 1 7 G H3' 1 8 C H6 3.500 . 4.000 2.777 2.512 3.092 . 0 0 "[ . 1 . 2]" 1
61 1 7 G H4' 1 7 G H8 3.500 . 5.000 4.395 4.236 4.660 . 0 0 "[ . 1 . 2]" 1
62 1 7 G H4' 1 8 C H6 3.500 . 6.000 5.447 5.248 5.672 . 0 0 "[ . 1 . 2]" 1
63 1 7 G H8 1 8 C H5 3.500 . 5.000 4.232 3.796 4.618 . 0 0 "[ . 1 . 2]" 1
64 1 8 C H1' 1 9 A H8 3.500 . 5.000 4.814 4.774 4.849 . 0 0 "[ . 1 . 2]" 1
65 1 8 C H2' 1 9 A H8 2.400 . 3.000 2.264 2.253 2.277 . 0 0 "[ . 1 . 2]" 1
66 1 8 C H2' 1 9 A H5' 3.500 . 5.000 3.740 3.567 3.908 . 0 0 "[ . 1 . 2]" 1
67 1 8 C H2' 1 9 A H5'' 3.500 . 5.000 4.537 4.433 4.716 . 0 0 "[ . 1 . 2]" 1
68 1 8 C H3' 1 9 A H5' 3.500 . 5.000 4.603 4.527 4.693 . 0 0 "[ . 1 . 2]" 1
69 1 8 C H3' 1 9 A H5'' 3.500 . 5.000 5.126 5.092 5.196 0.196 9 0 "[ . 1 . 2]" 1
70 1 8 C H3' 1 9 A H8 3.500 . 4.000 3.338 3.175 3.478 . 0 0 "[ . 1 . 2]" 1
71 1 8 C H41 1 33 G H1 3.500 . 6.000 2.419 2.411 2.429 . 0 0 "[ . 1 . 2]" 1
72 1 8 C H42 1 33 G H1 3.500 . 6.000 3.921 3.903 3.933 . 0 0 "[ . 1 . 2]" 1
73 1 8 C H5 1 9 A H8 3.500 . 5.000 5.370 5.318 5.472 0.472 9 0 "[ . 1 . 2]" 1
74 1 8 C H5 1 33 G H1 3.500 . 6.000 4.946 4.921 4.965 . 0 0 "[ . 1 . 2]" 1
75 1 8 C H6 1 9 A H8 3.500 . 5.000 4.884 4.817 4.956 . 0 0 "[ . 1 . 2]" 1
76 1 9 A H1' 1 10 C H1' 3.500 . 6.000 6.051 5.993 6.103 0.103 13 0 "[ . 1 . 2]" 1
77 1 9 A H1' 1 10 C H5 3.500 . 6.000 5.797 5.673 5.919 . 0 0 "[ . 1 . 2]" 1
78 1 9 A H1' 1 10 C H6 3.500 . 5.000 5.008 4.989 5.032 0.032 15 0 "[ . 1 . 2]" 1
79 1 9 A H2' 1 10 C H5 3.500 . 5.000 3.788 3.639 3.904 . 0 0 "[ . 1 . 2]" 1
80 1 9 A H2' 1 10 C H6 3.500 . 5.000 2.327 2.303 2.351 . 0 0 "[ . 1 . 2]" 1
81 1 9 A H3' 1 9 A H8 3.500 . 5.000 2.856 2.834 2.892 . 0 0 "[ . 1 . 2]" 1
82 1 9 A H3' 1 10 C H5 3.500 . 5.000 3.463 3.246 3.706 . 0 0 "[ . 1 . 2]" 1
83 1 9 A H3' 1 10 C H6 3.500 . 5.000 2.982 2.869 3.078 . 0 0 "[ . 1 . 2]" 1
84 1 9 A H2 1 10 C H1' 3.500 . 5.000 4.619 4.517 4.788 . 0 0 "[ . 1 . 2]" 1
85 1 9 A H2 1 31 G H1 3.500 . 6.000 5.631 5.327 5.760 . 0 0 "[ . 1 . 2]" 1
86 1 9 A H2 1 32 U H3 3.500 . 4.000 2.825 2.817 2.832 . 0 0 "[ . 1 . 2]" 1
87 1 9 A H2 1 33 G H1' 3.500 . 5.000 3.496 3.307 3.653 . 0 0 "[ . 1 . 2]" 1
88 1 9 A H2 1 33 G H1 3.500 . 6.000 4.736 4.552 4.961 . 0 0 "[ . 1 . 2]" 1
89 1 9 A H8 1 10 C H5 3.500 . 5.000 4.279 4.196 4.365 . 0 0 "[ . 1 . 2]" 1
90 1 10 C H1' 1 11 U H6 3.500 . 5.000 5.124 4.717 5.439 0.439 11 0 "[ . 1 . 2]" 1
91 1 10 C H2' 1 11 U H5 3.500 . 5.000 4.592 3.996 5.342 0.342 11 0 "[ . 1 . 2]" 1
92 1 10 C H2' 1 11 U H6 3.500 . 4.000 2.976 2.435 3.574 . 0 0 "[ . 1 . 2]" 1
93 1 10 C H3' 1 10 C H6 3.500 . 5.000 3.206 3.140 3.275 . 0 0 "[ . 1 . 2]" 1
94 1 10 C H3' 1 11 U H5 3.500 . 5.000 3.441 2.834 4.459 . 0 0 "[ . 1 . 2]" 1
95 1 10 C H3' 1 11 U H5' 3.500 . 5.000 4.340 3.836 4.828 . 0 0 "[ . 1 . 2]" 1
96 1 10 C H3' 1 11 U H5'' 3.500 . 5.000 4.210 3.336 4.896 . 0 0 "[ . 1 . 2]" 1
97 1 10 C H3' 1 11 U H6 3.500 . 4.000 2.703 2.337 3.450 . 0 0 "[ . 1 . 2]" 1
98 1 10 C H4' 1 10 C H6 3.500 . 5.000 3.991 3.952 4.031 . 0 0 "[ . 1 . 2]" 1
99 1 10 C H41 1 11 U H3 3.500 . 5.500 3.465 2.939 3.721 . 0 0 "[ . 1 . 2]" 1
100 1 10 C H41 1 31 G H1 3.500 . 5.500 2.436 2.424 2.446 . 0 0 "[ . 1 . 2]" 1
101 1 10 C H42 1 11 U H3 3.500 . 5.500 4.180 3.130 4.657 . 0 0 "[ . 1 . 2]" 1
102 1 10 C H42 1 31 G H1 3.500 . 5.500 3.947 3.939 3.956 . 0 0 "[ . 1 . 2]" 1
103 1 10 C H5 1 11 U H5 3.500 . 5.000 3.088 2.811 3.405 . 0 0 "[ . 1 . 2]" 1
104 1 10 C H5 1 11 U H6 3.500 . 6.000 4.898 4.338 5.353 . 0 0 "[ . 1 . 2]" 1
105 1 10 C H6 1 11 U H5 3.500 . 6.000 3.808 3.298 4.408 . 0 0 "[ . 1 . 2]" 1
106 1 10 C H6 1 11 U H6 3.500 . 6.000 4.683 4.375 4.945 . 0 0 "[ . 1 . 2]" 1
107 1 11 U H1' 1 12 C H6 3.500 . 5.000 5.085 4.691 5.322 0.322 15 0 "[ . 1 . 2]" 1
108 1 11 U H2' 1 12 C H5 3.500 . 5.000 3.363 2.559 4.318 . 0 0 "[ . 1 . 2]" 1
109 1 11 U H2' 1 12 C H6 3.500 . 4.000 2.507 2.313 2.778 . 0 0 "[ . 1 . 2]" 1
110 1 11 U H3 1 12 C H6 3.500 . 5.500 5.226 3.727 6.250 0.750 15 3 "[ * . 1- + 2]" 1
111 1 11 U H3 1 30 U H3 3.500 . 4.000 2.654 2.322 3.424 . 0 0 "[ . 1 . 2]" 1
112 1 11 U H3 1 31 G H1 3.500 . 5.500 4.403 3.957 4.932 . 0 0 "[ . 1 . 2]" 1
113 1 11 U H3' 1 12 C H5 3.500 . 5.000 3.945 3.138 5.393 0.393 16 0 "[ . 1 . 2]" 1
114 1 11 U H3' 1 12 C H6 3.500 . 5.000 3.862 3.440 4.570 . 0 0 "[ . 1 . 2]" 1
115 1 12 C H1' 1 13 U H6 3.500 . 5.000 5.098 4.883 5.379 0.379 19 0 "[ . 1 . 2]" 1
116 1 12 C H2' 1 13 U H5 3.500 . 5.000 3.706 2.458 4.608 . 0 0 "[ . 1 . 2]" 1
117 1 12 C H2' 1 13 U H6 3.500 . 4.000 2.635 2.344 2.837 . 0 0 "[ . 1 . 2]" 1
118 1 12 C H3' 1 13 U H5 3.500 . 5.000 4.629 3.427 5.515 0.515 10 1 "[ . + . 2]" 1
119 1 12 C H3' 1 13 U H6 3.500 . 5.000 4.045 3.565 4.485 . 0 0 "[ . 1 . 2]" 1
120 1 13 U H1' 1 14 G H8 3.500 . 6.000 5.293 5.020 5.880 . 0 0 "[ . 1 . 2]" 1
121 1 13 U H2' 1 14 G H8 3.500 . 4.000 2.596 2.339 3.247 . 0 0 "[ . 1 . 2]" 1
122 1 13 U H3' 1 14 G H5' 3.500 . 6.000 4.637 4.168 5.003 . 0 0 "[ . 1 . 2]" 1
123 1 13 U H3' 1 14 G H5'' 3.500 . 6.000 5.412 5.336 5.505 . 0 0 "[ . 1 . 2]" 1
124 1 13 U H3' 1 14 G H8 3.500 . 6.000 2.968 2.688 3.191 . 0 0 "[ . 1 . 2]" 1
125 1 13 U H3 1 14 G H1 3.500 . 5.500 5.383 4.897 5.627 0.127 19 0 "[ . 1 . 2]" 1
126 1 13 U H3 1 28 U H3 3.500 . 4.000 2.337 2.321 2.464 . 0 0 "[ . 1 . 2]" 1
127 1 14 G H1' 1 14 G H5' 3.500 . 5.000 4.785 4.608 4.905 . 0 0 "[ . 1 . 2]" 1
128 1 14 G H1' 1 14 G H5'' 3.500 . 5.000 5.214 5.180 5.254 0.254 7 0 "[ . 1 . 2]" 1
129 1 14 G H1' 1 14 G H8 3.500 . 5.000 3.759 3.717 3.787 . 0 0 "[ . 1 . 2]" 1
130 1 14 G H1' 1 15 G H8 3.500 . 5.000 4.767 4.681 4.865 . 0 0 "[ . 1 . 2]" 1
131 1 14 G H1 1 15 G H1 3.500 . 5.500 4.468 4.202 4.702 . 0 0 "[ . 1 . 2]" 1
132 1 14 G H1 1 26 C H41 3.500 . 6.000 4.960 4.820 5.076 . 0 0 "[ . 1 . 2]" 1
133 1 14 G H1 1 26 C H42 3.500 . 6.000 6.165 6.013 6.237 0.237 1 0 "[ . 1 . 2]" 1
134 1 14 G H1 1 27 C H41 3.500 . 6.000 2.437 2.419 2.461 . 0 0 "[ . 1 . 2]" 1
135 1 14 G H1 1 27 C H42 3.500 . 6.000 3.946 3.934 3.961 . 0 0 "[ . 1 . 2]" 1
136 1 14 G H1 1 27 C H5 3.500 . 5.500 4.973 4.964 4.983 . 0 0 "[ . 1 . 2]" 1
137 1 14 G H1 1 28 U H3 3.500 . 5.500 4.945 4.172 5.205 . 0 0 "[ . 1 . 2]" 1
138 1 14 G H2' 1 15 G H8 3.500 . 4.000 2.253 2.231 2.276 . 0 0 "[ . 1 . 2]" 1
139 1 14 G H3' 1 15 G H8 3.500 . 5.000 2.574 2.366 2.802 . 0 0 "[ . 1 . 2]" 1
140 1 14 G H3' 1 15 G H5' 3.500 . 6.000 4.380 4.299 4.502 . 0 0 "[ . 1 . 2]" 1
141 1 14 G H3' 1 15 G H5'' 3.500 . 6.000 5.188 5.103 5.316 . 0 0 "[ . 1 . 2]" 1
142 1 14 G H1' 1 14 G H4' 3.500 . 5.000 3.445 3.366 3.508 . 0 0 "[ . 1 . 2]" 1
143 1 14 G H8 1 15 G H8 3.500 . 5.000 4.469 4.143 4.842 . 0 0 "[ . 1 . 2]" 1
144 1 15 G H1 1 15 G H1' 3.500 . 6.000 6.192 6.164 6.230 0.230 18 0 "[ . 1 . 2]" 1
145 1 15 G H1' 1 15 G H8 3.500 . 5.000 3.620 3.583 3.648 . 0 0 "[ . 1 . 2]" 1
146 1 15 G H1' 1 16 U H5 3.500 . 6.000 5.713 5.588 5.831 . 0 0 "[ . 1 . 2]" 1
147 1 15 G H1' 1 16 U H6 3.500 . 5.000 4.962 4.929 5.001 0.001 10 0 "[ . 1 . 2]" 1
148 1 15 G H1 1 26 C H41 3.500 . 4.000 2.392 2.379 2.410 . 0 0 "[ . 1 . 2]" 1
149 1 15 G H1 1 26 C H42 3.500 . 4.000 3.910 3.899 3.921 . 0 0 "[ . 1 . 2]" 1
150 1 15 G H2' 1 15 G H8 3.500 . 5.000 4.300 4.258 4.346 . 0 0 "[ . 1 . 2]" 1
151 1 15 G H2' 1 16 U H5 3.500 . 6.000 3.786 3.714 3.870 . 0 0 "[ . 1 . 2]" 1
152 1 15 G H2' 1 16 U H6 2.400 . 3.000 2.315 2.285 2.340 . 0 0 "[ . 1 . 2]" 1
153 1 15 G H2' 1 16 U H5' 3.500 . 6.000 3.418 3.029 4.473 . 0 0 "[ . 1 . 2]" 1
154 1 15 G H2' 1 16 U H5'' 3.500 . 6.000 4.956 4.676 5.539 . 0 0 "[ . 1 . 2]" 1
155 1 15 G H3' 1 16 U H5' 3.500 . 5.000 3.861 3.625 4.482 . 0 0 "[ . 1 . 2]" 1
156 1 15 G H3' 1 16 U H5'' 3.500 . 5.000 5.137 5.001 5.277 0.277 15 0 "[ . 1 . 2]" 1
157 1 15 G H1' 1 15 G H3' 3.500 . 5.000 3.791 3.778 3.808 . 0 0 "[ . 1 . 2]" 1
158 1 15 G H3' 1 15 G H8 3.500 . 5.000 3.432 3.321 3.571 . 0 0 "[ . 1 . 2]" 1
159 1 15 G H3' 1 16 U H1' 3.500 . 6.000 5.722 5.460 5.868 . 0 0 "[ . 1 . 2]" 1
160 1 15 G H3' 1 16 U H5 3.500 . 5.000 3.088 2.894 3.334 . 0 0 "[ . 1 . 2]" 1
161 1 15 G H3' 1 16 U H6 3.500 . 4.000 2.586 2.427 2.762 . 0 0 "[ . 1 . 2]" 1
162 1 15 G H1' 1 15 G H4' 3.500 . 6.000 3.276 3.201 3.405 . 0 0 "[ . 1 . 2]" 1
163 1 15 G H1' 1 15 G H5'' 3.500 . 6.000 5.171 5.159 5.183 . 0 0 "[ . 1 . 2]" 1
164 1 15 G H5'' 1 15 G H8 3.500 . 6.000 4.357 4.135 4.521 . 0 0 "[ . 1 . 2]" 1
165 1 15 G H1' 1 15 G H5' 3.500 . 6.000 4.853 4.819 4.903 . 0 0 "[ . 1 . 2]" 1
166 1 15 G H5' 1 15 G H8 3.500 . 6.000 4.241 4.000 4.386 . 0 0 "[ . 1 . 2]" 1
167 1 16 U H1' 1 16 U H5' 3.500 . 5.000 4.608 4.562 4.798 . 0 0 "[ . 1 . 2]" 1
168 1 16 U H1' 1 16 U H5'' 3.500 . 5.000 5.169 5.150 5.183 0.183 16 0 "[ . 1 . 2]" 1
169 1 15 G H1 1 16 U H1' 3.500 . 5.500 5.354 5.113 5.491 . 0 0 "[ . 1 . 2]" 1
170 1 16 U H1' 1 16 U H6 3.500 . 5.000 3.535 3.431 3.565 . 0 0 "[ . 1 . 2]" 1
171 1 16 U H1' 1 17 A H8 3.500 . 5.000 4.997 4.939 5.044 0.044 7 0 "[ . 1 . 2]" 1
172 1 16 U H2' 1 16 U H6 3.500 . 5.000 3.924 3.866 4.101 . 0 0 "[ . 1 . 2]" 1
173 1 16 U H2' 1 17 A H1' 3.500 . 5.000 3.649 3.387 3.805 . 0 0 "[ . 1 . 2]" 1
174 1 16 U H2' 1 17 A H8 2.400 . 3.000 2.351 2.323 2.422 . 0 0 "[ . 1 . 2]" 1
175 1 16 U H3' 1 16 U H6 3.500 . 5.000 3.013 2.859 3.437 . 0 0 "[ . 1 . 2]" 1
176 1 16 U H3' 1 17 A H8 3.500 . 5.000 2.751 2.443 2.910 . 0 0 "[ . 1 . 2]" 1
177 1 15 G H1 1 16 U H3 3.500 . 5.500 3.774 3.714 3.880 . 0 0 "[ . 1 . 2]" 1
178 1 16 U H3 1 17 A H61 3.500 . 5.500 4.703 4.539 4.806 . 0 0 "[ . 1 . 2]" 1
179 1 16 U H3 1 17 A H62 3.500 . 5.500 4.274 4.197 4.359 . 0 0 "[ . 1 . 2]" 1
180 1 16 U H1' 1 16 U H4' 3.500 . 5.000 3.214 3.183 3.242 . 0 0 "[ . 1 . 2]" 1
181 1 15 G H1 1 16 U H5 3.500 . 6.000 5.483 5.217 5.591 . 0 0 "[ . 1 . 2]" 1
182 1 15 G H8 1 16 U H5 3.500 . 6.000 4.401 4.164 4.487 . 0 0 "[ . 1 . 2]" 1
183 1 16 U H1' 1 16 U H5 3.500 . 6.000 5.315 5.248 5.334 . 0 0 "[ . 1 . 2]" 1
184 1 15 G H8 1 16 U H6 3.500 . 5.000 5.263 5.139 5.313 0.313 18 0 "[ . 1 . 2]" 1
185 1 16 U H3 1 17 A H1' 3.500 . 6.000 5.323 5.195 5.448 . 0 0 "[ . 1 . 2]" 1
186 1 17 A H1' 1 17 A H8 3.500 . 5.000 3.710 3.685 3.723 . 0 0 "[ . 1 . 2]" 1
187 1 17 A H1' 1 25 A H2 3.500 . 5.000 4.457 4.364 4.594 . 0 0 "[ . 1 . 2]" 1
188 1 17 A H2' 1 18 U H5 3.500 . 5.000 4.162 3.422 5.177 0.177 15 0 "[ . 1 . 2]" 1
189 1 17 A H2' 1 18 U H6 3.500 . 4.000 2.859 2.417 3.294 . 0 0 "[ . 1 . 2]" 1
190 1 17 A H2 1 18 U H1' 3.500 . 5.000 3.956 3.580 4.313 . 0 0 "[ . 1 . 2]" 1
191 1 17 A H2 1 18 U H3 3.500 . 5.500 4.982 4.590 5.241 . 0 0 "[ . 1 . 2]" 1
192 1 17 A H2 1 23 G H1 3.500 . 5.500 4.811 4.590 5.080 . 0 0 "[ . 1 . 2]" 1
193 1 17 A H2 1 24 U H3 2.400 . 3.000 2.824 2.810 2.842 . 0 0 "[ . 1 . 2]" 1
194 1 17 A H3' 1 17 A H8 3.500 . 6.000 3.345 3.289 3.455 . 0 0 "[ . 1 . 2]" 1
195 1 17 A H3' 1 18 U H5 3.500 . 5.000 3.406 2.740 4.378 . 0 0 "[ . 1 . 2]" 1
196 1 17 A H3' 1 18 U H5' 3.500 . 5.000 4.965 4.187 5.506 0.506 12 1 "[ . 1 + . 2]" 1
197 1 17 A H3' 1 18 U H5'' 3.500 . 5.000 4.190 3.514 5.197 0.197 3 0 "[ . 1 . 2]" 1
198 1 17 A H3' 1 18 U H6 3.500 . 5.000 2.762 2.420 3.046 . 0 0 "[ . 1 . 2]" 1
199 1 17 A H4' 1 17 A H8 3.500 . 6.000 4.439 4.388 4.467 . 0 0 "[ . 1 . 2]" 1
200 1 17 A H4' 1 18 U H6 3.500 . 6.000 5.572 5.320 5.904 . 0 0 "[ . 1 . 2]" 1
201 1 17 A H5'' 1 17 A H8 3.500 . 6.000 4.294 4.152 4.376 . 0 0 "[ . 1 . 2]" 1
202 1 17 A H5' 1 17 A H8 3.500 . 6.000 4.266 4.159 4.348 . 0 0 "[ . 1 . 2]" 1
203 1 17 A H61 1 18 U H3 3.500 . 5.500 3.222 2.785 3.568 . 0 0 "[ . 1 . 2]" 1
204 1 17 A H61 1 24 U H3 3.500 . 5.500 2.473 2.453 2.502 . 0 0 "[ . 1 . 2]" 1
205 1 17 A H62 1 18 U H3 3.500 . 5.500 3.655 3.292 4.023 . 0 0 "[ . 1 . 2]" 1
206 1 17 A H62 1 24 U H3 3.500 . 5.500 3.986 3.970 4.004 . 0 0 "[ . 1 . 2]" 1
207 1 17 A H8 1 18 U H5 3.500 . 5.000 3.867 3.601 4.042 . 0 0 "[ . 1 . 2]" 1
208 1 17 A H8 1 18 U H6 3.500 . 6.000 4.906 4.049 5.455 . 0 0 "[ . 1 . 2]" 1
209 1 18 U H1' 1 18 U H6 3.500 . 5.000 3.508 3.461 3.569 . 0 0 "[ . 1 . 2]" 1
210 1 18 U H1' 1 19 U H6 3.500 . 5.000 5.169 4.922 5.297 0.297 10 0 "[ . 1 . 2]" 1
211 1 18 U H1' 1 23 G H1 3.500 . 6.000 4.284 4.036 4.556 . 0 0 "[ . 1 . 2]" 1
212 1 17 A H2 1 18 U H2' 3.500 . 6.000 6.181 5.734 6.452 0.452 9 0 "[ . 1 . 2]" 1
213 1 18 U H2' 1 18 U H3 3.500 . 6.000 4.379 4.297 4.494 . 0 0 "[ . 1 . 2]" 1
214 1 18 U H2' 1 18 U H6 3.500 . 5.000 4.041 3.920 4.127 . 0 0 "[ . 1 . 2]" 1
215 1 18 U H2' 1 19 U H1' 3.500 . 6.000 3.633 2.833 4.595 . 0 0 "[ . 1 . 2]" 1
216 1 18 U H2' 1 19 U H5 3.500 . 5.000 4.770 3.701 4.982 . 0 0 "[ . 1 . 2]" 1
217 1 18 U H2' 1 19 U H6 2.400 . 3.000 2.968 2.354 3.140 0.140 5 0 "[ . 1 . 2]" 1
218 1 18 U H1' 1 18 U H3' 3.500 . 6.000 3.887 3.852 3.916 . 0 0 "[ . 1 . 2]" 1
219 1 18 U H3' 1 18 U H6 3.500 . 5.000 3.328 3.035 3.542 . 0 0 "[ . 1 . 2]" 1
220 1 18 U H3' 1 19 U H5 3.500 . 5.000 4.604 2.961 5.138 0.138 8 0 "[ . 1 . 2]" 1
221 1 18 U H3' 1 19 U H6 3.500 . 5.000 3.085 2.334 3.774 . 0 0 "[ . 1 . 2]" 1
222 1 18 U H3' 1 19 U H5' 3.500 . 5.000 3.992 3.435 4.259 . 0 0 "[ . 1 . 2]" 1
223 1 18 U H3' 1 19 U H5'' 3.500 . 5.000 3.199 2.198 4.799 . 0 0 "[ . 1 . 2]" 1
224 1 18 U H1' 1 18 U H4' 3.500 . 6.000 3.460 3.366 3.566 . 0 0 "[ . 1 . 2]" 1
225 1 18 U H4' 1 18 U H6 3.500 . 5.000 3.957 3.872 4.047 . 0 0 "[ . 1 . 2]" 1
226 1 18 U H5 1 19 U H5 3.500 . 5.000 3.526 3.129 3.941 . 0 0 "[ . 1 . 2]" 1
227 1 18 U H5 1 19 U H6 3.500 . 6.000 4.871 4.619 5.560 . 0 0 "[ . 1 . 2]" 1
228 1 17 A H1' 1 18 U H6 3.500 . 5.000 5.385 5.122 5.520 0.520 18 2 "[- . 1 . + 2]" 1
229 1 18 U H3 1 19 U H1' 3.500 . 5.500 4.729 4.502 4.946 . 0 0 "[ . 1 . 2]" 1
230 1 19 U H1' 1 19 U H6 3.500 . 5.000 3.471 3.384 3.637 . 0 0 "[ . 1 . 2]" 1
231 1 19 U H1' 1 20 A H2' 3.500 . 6.000 5.195 4.566 5.493 . 0 0 "[ . 1 . 2]" 1
232 1 19 U H1' 1 20 A H8 3.500 . 6.000 4.260 4.000 4.742 . 0 0 "[ . 1 . 2]" 1
233 1 19 U H1' 1 21 C H5 3.500 . 5.000 4.965 4.904 4.988 . 0 0 "[ . 1 . 2]" 1
234 1 19 U H1' 1 21 C H6 3.500 . 5.000 4.788 4.403 4.954 . 0 0 "[ . 1 . 2]" 1
235 1 19 U H1' 1 22 G H1 3.500 . 4.000 3.224 2.352 3.568 . 0 0 "[ . 1 . 2]" 1
236 1 19 U H1' 1 23 G H1 3.500 . 4.000 3.687 3.362 3.898 . 0 0 "[ . 1 . 2]" 1
237 1 18 U H2' 1 19 U H2' 3.500 . 6.000 5.628 5.220 6.089 0.089 17 0 "[ . 1 . 2]" 1
238 1 19 U H2' 1 19 U H3' 3.500 . 4.000 2.361 2.346 2.390 . 0 0 "[ . 1 . 2]" 1
239 1 19 U H2' 1 19 U H4' 3.500 . 5.000 3.819 3.764 3.870 . 0 0 "[ . 1 . 2]" 1
240 1 19 U H2' 1 19 U H5 3.500 . 6.000 5.438 5.126 5.543 . 0 0 "[ . 1 . 2]" 1
241 1 19 U H2' 1 19 U H6 3.500 . 5.000 4.024 3.599 4.170 . 0 0 "[ . 1 . 2]" 1
242 1 19 U H2' 1 20 A H2' 3.500 . 5.000 3.720 3.469 4.271 . 0 0 "[ . 1 . 2]" 1
243 1 19 U H2' 1 20 A H3' 3.500 . 6.000 4.496 4.247 4.846 . 0 0 "[ . 1 . 2]" 1
244 1 19 U H2' 1 20 A H8 3.500 . 4.000 3.417 3.149 4.000 0.000 14 0 "[ . 1 . 2]" 1
245 1 19 U H2' 1 21 C H1' 3.500 . 5.000 4.339 4.240 4.523 . 0 0 "[ . 1 . 2]" 1
246 1 19 U H2' 1 21 C H41 3.500 . 5.500 5.105 4.795 5.194 . 0 0 "[ . 1 . 2]" 1
247 1 19 U H2' 1 21 C H5 3.500 . 4.000 2.261 2.215 2.298 . 0 0 "[ . 1 . 2]" 1
248 1 19 U H2' 1 21 C H6 3.500 . 5.000 2.535 2.426 2.811 . 0 0 "[ . 1 . 2]" 1
249 1 19 U H2' 1 22 G H1 3.500 . 4.000 3.493 3.310 3.868 . 0 0 "[ . 1 . 2]" 1
250 1 19 U H1' 1 19 U H3' 3.500 . 5.000 3.838 3.791 3.864 . 0 0 "[ . 1 . 2]" 1
251 1 19 U H3' 1 19 U H6 3.500 . 5.000 3.208 2.469 3.556 . 0 0 "[ . 1 . 2]" 1
252 1 19 U H3' 1 21 C H5 3.500 . 5.000 2.702 2.326 3.616 . 0 0 "[ . 1 . 2]" 1
253 1 19 U H3' 1 22 G H1 3.500 . 6.000 5.721 5.615 5.858 . 0 0 "[ . 1 . 2]" 1
254 1 19 U H1' 1 19 U H4' 3.500 . 6.000 3.310 3.197 3.444 . 0 0 "[ . 1 . 2]" 1
255 1 19 U H4' 1 20 A H2' 3.500 . 6.000 5.994 4.974 6.218 0.218 7 0 "[ . 1 . 2]" 1
256 1 19 U H4' 1 20 A H8 3.500 . 6.000 4.060 3.023 4.340 . 0 0 "[ . 1 . 2]" 1
257 1 18 U H1' 1 19 U H5 3.500 . 6.000 6.143 5.331 6.328 0.328 3 0 "[ . 1 . 2]" 1
258 1 18 U H6 1 19 U H5 3.500 . 6.000 4.424 3.415 4.971 . 0 0 "[ . 1 . 2]" 1
259 1 19 U H5 1 21 C H41 3.500 . 5.000 5.127 4.979 5.293 0.293 2 0 "[ . 1 . 2]" 1
260 1 19 U H5 1 21 C H42 3.500 . 5.000 5.364 5.290 5.440 0.440 10 0 "[ . 1 . 2]" 1
261 1 18 U H6 1 19 U H6 3.500 . 5.000 4.552 4.213 4.887 . 0 0 "[ . 1 . 2]" 1
262 1 19 U H6 1 21 C H41 3.500 . 6.000 5.628 5.439 5.915 . 0 0 "[ . 1 . 2]" 1
263 1 19 U H6 1 21 C H42 3.500 . 6.000 5.080 4.958 5.225 . 0 0 "[ . 1 . 2]" 1
264 1 19 U H6 1 22 G H1 3.500 . 6.000 6.044 5.699 6.163 0.163 20 0 "[ . 1 . 2]" 1
265 1 19 U H2' 1 20 A H5' 3.500 . 6.000 5.174 4.764 5.344 . 0 0 "[ . 1 . 2]" 1
266 1 19 U H2' 1 20 A H5'' 3.500 . 6.000 4.229 3.627 4.599 . 0 0 "[ . 1 . 2]" 1
267 1 20 A H2' 1 20 A H5' 3.500 . 5.000 4.412 4.110 4.531 . 0 0 "[ . 1 . 2]" 1
268 1 20 A H2' 1 20 A H5'' 3.500 . 5.000 3.604 2.801 3.883 . 0 0 "[ . 1 . 2]" 1
269 1 20 A H1' 1 20 A H4' 3.500 . 5.000 3.239 3.120 3.564 . 0 0 "[ . 1 . 2]" 1
270 1 20 A H1' 1 20 A H5' 3.500 . 6.000 4.827 4.756 5.032 . 0 0 "[ . 1 . 2]" 1
271 1 20 A H1' 1 20 A H5'' 3.500 . 6.000 4.886 4.699 4.931 . 0 0 "[ . 1 . 2]" 1
272 1 20 A H1' 1 20 A H8 3.500 . 5.000 3.888 3.884 3.889 . 0 0 "[ . 1 . 2]" 1
273 1 20 A H2' 1 20 A H3' 2.400 . 3.000 2.347 2.330 2.386 . 0 0 "[ . 1 . 2]" 1
274 1 20 A H2' 1 20 A H8 2.400 . 3.000 2.360 2.241 2.725 . 0 0 "[ . 1 . 2]" 1
275 1 20 A H2' 1 21 C H5 3.500 . 5.000 4.240 3.958 4.957 . 0 0 "[ . 1 . 2]" 1
276 1 20 A H2' 1 21 C H6 3.500 . 4.000 2.621 2.346 3.251 . 0 0 "[ . 1 . 2]" 1
277 1 20 A H2' 1 22 G H1 3.500 . 6.000 3.865 3.739 4.160 . 0 0 "[ . 1 . 2]" 1
278 1 20 A H1' 1 20 A H3' 3.500 . 5.000 3.859 3.842 3.893 . 0 0 "[ . 1 . 2]" 1
279 1 20 A H3' 1 20 A H8 3.500 . 5.000 4.276 4.210 4.450 . 0 0 "[ . 1 . 2]" 1
280 1 20 A H3' 1 21 C H5 3.500 . 4.000 3.807 3.456 4.293 0.293 7 0 "[ . 1 . 2]" 1
281 1 20 A H3' 1 21 C H1' 3.500 . 5.000 4.425 3.783 4.546 . 0 0 "[ . 1 . 2]" 1
282 1 20 A H3' 1 21 C H4' 3.500 . 5.000 4.559 3.996 4.876 . 0 0 "[ . 1 . 2]" 1
283 1 20 A H3' 1 21 C H6 3.500 . 4.000 2.398 2.158 2.731 . 0 0 "[ . 1 . 2]" 1
284 1 19 U H2' 1 20 A H4' 3.500 . 6.000 6.173 6.041 6.283 0.283 7 0 "[ . 1 . 2]" 1
285 1 20 A H2' 1 20 A H4' 3.500 . 4.000 3.864 3.782 3.904 . 0 0 "[ . 1 . 2]" 1
286 1 20 A H4' 1 20 A H8 3.500 . 5.000 4.831 4.387 4.960 . 0 0 "[ . 1 . 2]" 1
287 1 20 A H4' 1 21 C H5 3.500 . 5.000 5.194 5.108 5.365 0.365 7 0 "[ . 1 . 2]" 1
288 1 20 A H4' 1 21 C H6 3.500 . 5.000 4.826 4.368 4.966 . 0 0 "[ . 1 . 2]" 1
289 1 20 A H5'' 1 20 A H8 3.500 . 6.000 4.431 3.292 4.784 . 0 0 "[ . 1 . 2]" 1
290 1 20 A H5'' 1 21 C H5 3.500 . 5.000 2.727 2.357 2.919 . 0 0 "[ . 1 . 2]" 1
291 1 20 A H5' 1 20 A H8 3.500 . 6.000 4.570 3.821 4.798 . 0 0 "[ . 1 . 2]" 1
292 1 20 A H5' 1 21 C H5 3.500 . 5.000 3.841 3.455 4.026 . 0 0 "[ . 1 . 2]" 1
293 1 19 U H3' 1 20 A H8 3.500 . 6.000 4.551 3.903 4.823 . 0 0 "[ . 1 . 2]" 1
294 1 20 A H8 1 21 C H5 3.500 . 5.000 4.456 3.764 5.220 0.220 14 0 "[ . 1 . 2]" 1
295 1 20 A H8 1 21 C H6 3.500 . 5.000 3.947 3.627 4.475 . 0 0 "[ . 1 . 2]" 1
296 1 20 A H8 1 22 G H1 3.500 . 5.500 4.453 4.110 5.207 . 0 0 "[ . 1 . 2]" 1
297 1 21 C H1' 1 21 C H5'' 3.500 . 6.000 4.797 4.691 4.867 . 0 0 "[ . 1 . 2]" 1
298 1 21 C H1' 1 21 C H5' 3.500 . 6.000 4.849 4.781 4.914 . 0 0 "[ . 1 . 2]" 1
299 1 21 C H1' 1 21 C H6 3.500 . 5.000 2.849 2.837 2.864 . 0 0 "[ . 1 . 2]" 1
300 1 21 C H1' 1 22 G H1 3.500 . 6.000 2.906 2.759 2.984 . 0 0 "[ . 1 . 2]" 1
301 1 21 C H4' 1 21 C H6 3.500 . 6.000 4.423 4.416 4.431 . 0 0 "[ . 1 . 2]" 1
302 1 21 C H4' 1 22 G H5' 3.500 . 5.000 3.871 2.272 5.286 0.286 2 0 "[ . 1 . 2]" 1
303 1 21 C H4' 1 22 G H5'' 3.500 . 5.000 2.835 2.328 4.057 . 0 0 "[ . 1 . 2]" 1
304 1 21 C H4' 1 22 G H1' 3.500 . 5.000 4.821 3.946 5.102 0.102 20 0 "[ . 1 . 2]" 1
305 1 21 C H4' 1 22 G H1 3.500 . 6.000 4.746 4.545 5.045 . 0 0 "[ . 1 . 2]" 1
306 1 21 C H4' 1 22 G H3' 3.500 . 5.000 4.165 3.638 5.062 0.062 14 0 "[ . 1 . 2]" 1
307 1 21 C H4' 1 22 G H4' 3.500 . 5.000 4.710 4.619 5.083 0.083 14 0 "[ . 1 . 2]" 1
308 1 21 C H4' 1 22 G H8 3.500 . 5.000 5.137 3.725 5.503 0.503 20 1 "[ . 1 . +]" 1
309 1 19 U H3' 1 21 C H41 3.500 . 5.500 4.611 4.315 5.486 . 0 0 "[ . 1 . 2]" 1
310 1 19 U H3' 1 21 C H42 3.500 . 5.500 3.197 2.869 4.161 . 0 0 "[ . 1 . 2]" 1
311 1 21 C H2' 1 21 C H5' 3.500 . 5.000 5.168 5.025 5.260 0.260 20 0 "[ . 1 . 2]" 1
312 1 21 C H2' 1 21 C H5'' 3.500 . 5.000 4.329 4.300 4.377 . 0 0 "[ . 1 . 2]" 1
313 1 21 C Q5' 1 22 G H1' 3.500 . 6.000 4.847 4.523 4.944 . 0 0 "[ . 1 . 2]" 1
314 1 21 C Q5' 1 22 G Q5' 3.500 . 6.000 3.428 2.248 4.825 . 0 0 "[ . 1 . 2]" 1
315 1 19 U H6 1 21 C H5 3.500 . 5.000 5.215 5.136 5.294 0.294 10 0 "[ . 1 . 2]" 1
316 1 21 C H5 1 22 G H1 3.500 . 5.500 5.228 5.140 5.508 0.008 14 0 "[ . 1 . 2]" 1
317 1 21 C H6 1 22 G H1 3.500 . 4.000 3.533 3.422 4.029 0.029 14 0 "[ . 1 . 2]" 1
318 1 22 G H1' 1 22 G H8 2.400 . 3.000 2.569 2.562 2.597 . 0 0 "[ . 1 . 2]" 1
319 1 22 G H2' 1 22 G H3' 3.500 . 5.000 2.321 2.310 2.359 . 0 0 "[ . 1 . 2]" 1
320 1 22 G H2' 1 23 G H8 3.500 . 5.000 4.368 2.735 5.085 0.085 8 0 "[ . 1 . 2]" 1
321 1 22 G H1' 1 22 G H3' 3.500 . 5.000 3.929 3.881 3.945 . 0 0 "[ . 1 . 2]" 1
322 1 22 G H3' 1 22 G H8 3.500 . 6.000 5.593 5.302 5.651 . 0 0 "[ . 1 . 2]" 1
323 1 22 G H3' 1 23 G H8 3.500 . 5.000 3.274 2.296 3.655 . 0 0 "[ . 1 . 2]" 1
324 1 22 G H1' 1 22 G H4' 3.500 . 5.000 3.133 3.049 3.295 . 0 0 "[ . 1 . 2]" 1
325 1 22 G H3' 1 22 G H4' 3.500 . 4.000 3.022 3.004 3.048 . 0 0 "[ . 1 . 2]" 1
326 1 22 G H2' 1 22 G H8 3.500 . 5.000 4.142 3.825 4.328 . 0 0 "[ . 1 . 2]" 1
327 1 22 G H8 1 23 G H1' 3.500 . 6.000 5.762 5.397 5.986 . 0 0 "[ . 1 . 2]" 1
328 1 23 G H1' 1 23 G H8 3.500 . 5.000 3.667 3.629 3.710 . 0 0 "[ . 1 . 2]" 1
329 1 23 G H1' 1 24 U H6 3.500 . 5.000 4.728 4.538 4.903 . 0 0 "[ . 1 . 2]" 1
330 1 18 U H3 1 23 G H1 3.500 . 4.000 2.821 2.341 3.331 . 0 0 "[ . 1 . 2]" 1
331 1 19 U H2' 1 23 G H1 3.500 . 7.000 6.082 5.933 6.497 . 0 0 "[ . 1 . 2]" 1
332 1 23 G H2' 1 24 U H5 3.500 . 5.000 4.035 3.750 4.258 . 0 0 "[ . 1 . 2]" 1
333 1 23 G H2' 1 24 U H6 2.600 . 3.000 2.295 2.269 2.324 . 0 0 "[ . 1 . 2]" 1
334 1 23 G H2' 1 24 U H5' 3.500 . 5.000 3.782 3.452 4.295 . 0 0 "[ . 1 . 2]" 1
335 1 23 G H2' 1 24 U H5'' 3.500 . 5.000 4.852 4.581 5.294 0.294 13 0 "[ . 1 . 2]" 1
336 1 23 G H3' 1 23 G H8 3.500 . 5.000 3.376 3.158 3.531 . 0 0 "[ . 1 . 2]" 1
337 1 23 G H3' 1 24 U H6 3.500 . 4.000 2.441 2.309 2.726 . 0 0 "[ . 1 . 2]" 1
338 1 23 G H3' 1 24 U H5' 3.500 . 5.000 4.275 4.139 4.420 . 0 0 "[ . 1 . 2]" 1
339 1 23 G H3' 1 24 U H5'' 3.500 . 5.000 4.863 4.709 5.040 0.040 18 0 "[ . 1 . 2]" 1
340 1 23 G H3' 1 24 U H5 3.500 . 5.000 3.262 2.901 3.619 . 0 0 "[ . 1 . 2]" 1
341 1 23 G H4' 1 23 G H8 3.500 . 5.000 4.198 4.085 4.349 . 0 0 "[ . 1 . 2]" 1
342 1 23 G H4' 1 24 U H6 3.500 . 6.000 5.232 5.060 5.447 . 0 0 "[ . 1 . 2]" 1
343 1 22 G H1 1 23 G H8 3.500 . 5.500 5.226 3.972 5.838 0.338 18 0 "[ . 1 . 2]" 1
344 1 23 G H5'' 1 23 G H8 3.500 . 5.000 2.706 2.317 3.958 . 0 0 "[ . 1 . 2]" 1
345 1 23 G H5' 1 23 G H8 3.500 . 5.000 3.924 3.647 4.293 . 0 0 "[ . 1 . 2]" 1
346 1 23 G H8 1 24 U H6 3.500 . 6.000 4.559 4.054 4.971 . 0 0 "[ . 1 . 2]" 1
347 1 24 U H1' 1 24 U H6 3.500 . 6.000 3.453 3.436 3.467 . 0 0 "[ . 1 . 2]" 1
348 1 24 U H1' 1 25 A H1' 3.500 . 6.000 5.899 5.832 6.075 0.075 18 0 "[ . 1 . 2]" 1
349 1 24 U H1' 1 25 A H8 3.500 . 5.000 4.933 4.891 4.985 . 0 0 "[ . 1 . 2]" 1
350 1 24 U H2' 1 24 U H6 3.500 . 5.000 4.106 4.082 4.126 . 0 0 "[ . 1 . 2]" 1
351 1 24 U H2' 1 25 A H1' 3.500 . 5.000 3.621 3.526 3.821 . 0 0 "[ . 1 . 2]" 1
352 1 24 U H2' 1 25 A H8 2.400 . 3.000 2.327 2.301 2.379 . 0 0 "[ . 1 . 2]" 1
353 1 24 U H2' 1 25 A H5' 3.500 . 6.000 4.490 4.108 4.849 . 0 0 "[ . 1 . 2]" 1
354 1 24 U H2' 1 25 A H5'' 3.500 . 6.000 5.519 5.393 5.645 . 0 0 "[ . 1 . 2]" 1
355 1 24 U H3' 1 25 A H5' 3.500 . 5.000 4.465 4.242 4.707 . 0 0 "[ . 1 . 2]" 1
356 1 24 U H3' 1 25 A H5'' 3.500 . 5.000 5.258 5.200 5.345 0.345 3 0 "[ . 1 . 2]" 1
357 1 24 U H1' 1 24 U H3' 3.500 . 6.000 3.830 3.812 3.850 . 0 0 "[ . 1 . 2]" 1
358 1 24 U H3' 1 25 A H8 3.500 . 5.000 2.376 2.305 2.470 . 0 0 "[ . 1 . 2]" 1
359 1 18 U H3 1 24 U H3 3.500 . 5.500 3.983 3.777 4.251 . 0 0 "[ . 1 . 2]" 1
360 1 23 G H1 1 24 U H3 3.500 . 5.500 3.903 3.630 4.133 . 0 0 "[ . 1 . 2]" 1
361 1 24 U H3 1 25 A H61 3.500 . 5.500 4.550 4.118 4.685 . 0 0 "[ . 1 . 2]" 1
362 1 24 U H3 1 25 A H62 3.500 . 5.500 4.030 3.722 4.182 . 0 0 "[ . 1 . 2]" 1
363 1 24 U H4' 1 24 U H6 3.500 . 5.000 4.143 4.074 4.189 . 0 0 "[ . 1 . 2]" 1
364 1 23 G H8 1 24 U H5 3.500 . 5.000 3.639 3.169 4.111 . 0 0 "[ . 1 . 2]" 1
365 1 24 U H6 1 25 A H8 3.500 . 5.000 4.879 4.768 5.142 0.142 18 0 "[ . 1 . 2]" 1
366 1 17 A H2 1 25 A H1' 3.500 . 5.000 4.480 4.300 4.917 . 0 0 "[ . 1 . 2]" 1
367 1 24 U H3 1 25 A H1' 3.500 . 6.000 5.551 5.392 5.905 . 0 0 "[ . 1 . 2]" 1
368 1 25 A H1' 1 25 A H8 3.500 . 5.000 3.681 3.656 3.716 . 0 0 "[ . 1 . 2]" 1
369 1 25 A H1' 1 26 C H6 3.500 . 5.000 5.113 5.016 5.199 0.199 2 0 "[ . 1 . 2]" 1
370 1 25 A H2' 1 26 C H1' 3.500 . 6.000 4.019 3.844 4.201 . 0 0 "[ . 1 . 2]" 1
371 1 25 A H2' 1 26 C H5' 3.500 . 6.000 4.108 3.748 4.249 . 0 0 "[ . 1 . 2]" 1
372 1 25 A H2' 1 26 C H5'' 3.500 . 6.000 5.061 4.799 5.159 . 0 0 "[ . 1 . 2]" 1
373 1 25 A H2' 1 26 C H5 3.500 . 5.000 3.704 3.624 3.775 . 0 0 "[ . 1 . 2]" 1
374 1 25 A H2' 1 26 C H6 2.400 . 3.000 2.351 2.328 2.421 . 0 0 "[ . 1 . 2]" 1
375 1 15 G H1 1 25 A H2 3.500 . 5.500 4.747 4.679 4.817 . 0 0 "[ . 1 . 2]" 1
376 1 16 U H3 1 25 A H2 3.500 . 5.500 2.827 2.819 2.839 . 0 0 "[ . 1 . 2]" 1
377 1 25 A H3' 1 26 C H5 3.500 . 5.000 3.622 3.374 3.759 . 0 0 "[ . 1 . 2]" 1
378 1 25 A H3' 1 26 C H5' 3.500 . 5.000 4.530 4.434 4.611 . 0 0 "[ . 1 . 2]" 1
379 1 25 A H3' 1 26 C H5'' 3.500 . 5.000 5.197 5.041 5.233 0.233 7 0 "[ . 1 . 2]" 1
380 1 25 A H3' 1 26 C H6 3.500 . 6.000 3.070 2.930 3.193 . 0 0 "[ . 1 . 2]" 1
381 1 25 A H1' 1 25 A H4' 3.500 . 6.000 3.175 3.097 3.405 . 0 0 "[ . 1 . 2]" 1
382 1 25 A H5'' 1 25 A H8 3.500 . 6.000 4.516 3.999 4.629 . 0 0 "[ . 1 . 2]" 1
383 1 25 A H5' 1 25 A H8 3.500 . 6.000 4.251 3.926 4.475 . 0 0 "[ . 1 . 2]" 1
384 1 16 U H3 1 25 A H61 3.500 . 5.500 2.464 2.448 2.484 . 0 0 "[ . 1 . 2]" 1
385 1 16 U H3 1 25 A H62 3.500 . 5.500 3.970 3.957 3.985 . 0 0 "[ . 1 . 2]" 1
386 1 25 A H1' 1 26 C H1' 3.500 . 6.000 5.989 5.861 6.137 0.137 18 0 "[ . 1 . 2]" 1
387 1 25 A H2 1 26 C H1' 3.500 . 5.000 3.882 3.709 4.028 . 0 0 "[ . 1 . 2]" 1
388 1 26 C H1' 1 26 C H6 3.500 . 5.000 3.559 3.545 3.568 . 0 0 "[ . 1 . 2]" 1
389 1 26 C H1' 1 27 C H6 3.500 . 5.000 5.040 5.018 5.064 0.064 11 0 "[ . 1 . 2]" 1
390 1 26 C H2' 1 27 C H5' 3.500 . 6.000 3.656 3.449 4.257 . 0 0 "[ . 1 . 2]" 1
391 1 26 C H2' 1 27 C H5'' 3.500 . 6.000 4.981 4.762 5.400 . 0 0 "[ . 1 . 2]" 1
392 1 26 C H2' 1 26 C H6 3.500 . 5.000 3.911 3.889 3.930 . 0 0 "[ . 1 . 2]" 1
393 1 26 C H2' 1 27 C H5 3.500 . 5.000 3.809 3.692 3.899 . 0 0 "[ . 1 . 2]" 1
394 1 26 C H2' 1 27 C H6 2.400 . 3.000 2.314 2.291 2.335 . 0 0 "[ . 1 . 2]" 1
395 1 26 C H3' 1 27 C H5' 3.500 . 5.000 4.133 4.009 4.374 . 0 0 "[ . 1 . 2]" 1
396 1 26 C H3' 1 27 C H5'' 3.500 . 5.000 5.181 5.114 5.307 0.307 4 0 "[ . 1 . 2]" 1
397 1 26 C H3' 1 27 C H5 3.500 . 5.000 3.697 3.412 3.895 . 0 0 "[ . 1 . 2]" 1
398 1 26 C H1' 1 26 C H3' 3.500 . 5.000 3.827 3.821 3.832 . 0 0 "[ . 1 . 2]" 1
399 1 26 C H3' 1 26 C H6 3.500 . 5.000 2.968 2.918 3.031 . 0 0 "[ . 1 . 2]" 1
400 1 26 C H3' 1 27 C H6 3.500 . 5.000 2.981 2.709 3.167 . 0 0 "[ . 1 . 2]" 1
401 1 26 C H1' 1 26 C H4' 3.500 . 4.000 3.225 3.178 3.287 . 0 0 "[ . 1 . 2]" 1
402 1 26 C H4' 1 26 C H6 3.500 . 5.000 4.058 4.005 4.093 . 0 0 "[ . 1 . 2]" 1
403 1 26 C H4' 1 27 C H5' 3.500 . 5.000 4.516 4.334 4.809 . 0 0 "[ . 1 . 2]" 1
404 1 16 U H3 1 26 C H41 3.500 . 6.000 4.643 4.512 4.763 . 0 0 "[ . 1 . 2]" 1
405 1 16 U H3 1 26 C H42 3.500 . 6.000 5.603 5.463 5.706 . 0 0 "[ . 1 . 2]" 1
406 1 26 C H5'' 1 26 C H6 3.500 . 5.000 3.959 3.806 4.047 . 0 0 "[ . 1 . 2]" 1
407 1 26 C H5' 1 26 C H6 3.500 . 5.000 3.899 3.800 4.000 . 0 0 "[ . 1 . 2]" 1
408 1 25 A H1' 1 26 C H5 3.500 . 6.000 5.871 5.816 5.960 . 0 0 "[ . 1 . 2]" 1
409 1 25 A H8 1 26 C H5 3.500 . 6.000 4.624 4.516 4.724 . 0 0 "[ . 1 . 2]" 1
410 1 26 C H5 1 27 C H5 3.500 . 6.000 4.328 4.276 4.368 . 0 0 "[ . 1 . 2]" 1
411 1 26 C H5 1 27 C H6 3.500 . 6.000 5.855 5.778 5.931 . 0 0 "[ . 1 . 2]" 1
412 1 27 C H2' 1 27 C H6 3.500 . 5.000 3.880 3.851 3.945 . 0 0 "[ . 1 . 2]" 1
413 1 27 C H2' 1 28 U H1' 3.500 . 5.000 4.303 3.895 4.536 . 0 0 "[ . 1 . 2]" 1
414 1 27 C H2' 1 28 U H5 3.500 . 6.000 5.287 3.964 6.006 0.006 20 0 "[ . 1 . 2]" 1
415 1 27 C H2' 1 28 U H6 3.500 . 4.000 3.535 2.349 4.093 0.093 20 0 "[ . 1 . 2]" 1
416 1 27 C H1' 1 27 C H3' 3.500 . 5.000 3.773 3.763 3.786 . 0 0 "[ . 1 . 2]" 1
417 1 27 C H3' 1 27 C H6 3.500 . 5.000 2.812 2.739 2.953 . 0 0 "[ . 1 . 2]" 1
418 1 27 C H3' 1 28 U H5 3.500 . 6.000 4.542 3.113 5.282 . 0 0 "[ . 1 . 2]" 1
419 1 27 C H3' 1 28 U H6 3.500 . 4.000 3.618 2.952 3.965 . 0 0 "[ . 1 . 2]" 1
420 1 27 C H4' 1 27 C H6 3.500 . 5.000 4.110 4.092 4.128 . 0 0 "[ . 1 . 2]" 1
421 1 27 C H41 1 28 U H3 3.500 . 5.500 3.774 3.268 4.234 . 0 0 "[ . 1 . 2]" 1
422 1 27 C H42 1 28 U H3 3.500 . 5.500 4.213 3.669 4.658 . 0 0 "[ . 1 . 2]" 1
423 1 27 C H5 1 28 U H5 3.500 . 5.000 3.957 3.519 4.537 . 0 0 "[ . 1 . 2]" 1
424 1 27 C H1' 1 27 C H6 3.500 . 5.000 3.568 3.539 3.581 . 0 0 "[ . 1 . 2]" 1
425 1 27 C H6 1 28 U H5 3.500 . 6.000 4.815 3.933 5.281 . 0 0 "[ . 1 . 2]" 1
426 1 27 C H6 1 28 U H6 3.500 . 6.000 4.923 4.633 5.366 . 0 0 "[ . 1 . 2]" 1
427 1 28 U H1' 1 29 U H6 3.500 . 5.000 4.902 4.659 5.162 0.162 17 0 "[ . 1 . 2]" 1
428 1 28 U H2' 1 29 U H1' 3.500 . 5.000 3.673 2.460 5.112 0.112 15 0 "[ . 1 . 2]" 1
429 1 28 U H2' 1 29 U H5 3.500 . 5.000 4.067 2.427 4.854 . 0 0 "[ . 1 . 2]" 1
430 1 28 U H2' 1 29 U H6 3.500 . 4.000 2.537 2.230 2.847 . 0 0 "[ . 1 . 2]" 1
431 1 28 U H3' 1 29 U H5 3.500 . 5.000 4.430 3.281 5.393 0.393 2 0 "[ . 1 . 2]" 1
432 1 28 U H3' 1 29 U H6 3.500 . 5.000 3.239 2.330 3.834 . 0 0 "[ . 1 . 2]" 1
433 1 28 U H3 1 29 U H5 3.500 . 5.500 3.606 2.522 4.498 . 0 0 "[ . 1 . 2]" 1
434 1 29 U H2' 1 30 U H5 3.500 . 5.000 4.391 3.182 5.706 0.706 19 2 "[ -. 1 . +2]" 1
435 1 29 U H2' 1 30 U H6 3.500 . 4.000 2.880 2.300 4.009 0.009 19 0 "[ . 1 . 2]" 1
436 1 13 U H3 1 29 U H3 3.500 . 5.500 4.174 3.776 4.788 . 0 0 "[ . 1 . 2]" 1
437 1 28 U H3 1 29 U H3 3.500 . 5.500 4.610 3.826 5.124 . 0 0 "[ . 1 . 2]" 1
438 1 29 U H3' 1 30 U H5 3.500 . 5.000 4.386 3.229 5.336 0.336 7 0 "[ . 1 . 2]" 1
439 1 29 U H3' 1 30 U H6 3.500 . 5.000 3.410 2.340 3.973 . 0 0 "[ . 1 . 2]" 1
440 1 29 U H4' 1 29 U H6 3.500 . 5.000 3.947 3.853 4.098 . 0 0 "[ . 1 . 2]" 1
441 1 29 U H6 1 30 U H6 3.500 . 6.000 5.573 4.145 6.141 0.141 13 0 "[ . 1 . 2]" 1
442 1 30 U H1' 1 31 G H8 3.500 . 5.000 5.026 4.964 5.098 0.098 4 0 "[ . 1 . 2]" 1
443 1 30 U H2' 1 31 G H8 3.500 . 4.000 2.368 2.309 2.506 . 0 0 "[ . 1 . 2]" 1
444 1 30 U H3' 1 31 G H8 3.500 . 4.000 2.455 2.312 2.863 . 0 0 "[ . 1 . 2]" 1
445 1 30 U H3 1 31 G H1' 3.500 . 6.000 5.997 5.798 6.224 0.224 7 0 "[ . 1 . 2]" 1
446 1 30 U H3 1 31 G H1 3.500 . 6.000 4.992 4.320 5.409 . 0 0 "[ . 1 . 2]" 1
447 1 31 G H1' 1 32 U H6 3.500 . 5.000 5.019 4.970 5.060 0.060 20 0 "[ . 1 . 2]" 1
448 1 31 G H2' 1 31 G H8 3.500 . 5.000 4.099 4.065 4.136 . 0 0 "[ . 1 . 2]" 1
449 1 31 G H2' 1 32 U H5 3.500 . 5.000 3.856 3.711 3.952 . 0 0 "[ . 1 . 2]" 1
450 1 31 G H2' 1 32 U H6 3.500 . 4.000 2.331 2.309 2.375 . 0 0 "[ . 1 . 2]" 1
451 1 31 G H2' 1 32 U H1' 3.500 . 5.000 3.950 3.765 4.117 . 0 0 "[ . 1 . 2]" 1
452 1 31 G H3' 1 31 G H8 3.500 . 5.000 3.241 3.136 3.299 . 0 0 "[ . 1 . 2]" 1
453 1 31 G H3' 1 32 U H5 3.500 . 5.000 3.564 3.396 3.768 . 0 0 "[ . 1 . 2]" 1
454 1 31 G H3' 1 32 U H5' 3.500 . 5.000 4.407 4.295 4.507 . 0 0 "[ . 1 . 2]" 1
455 1 31 G H3' 1 32 U H5'' 3.500 . 5.000 5.170 5.104 5.213 0.213 3 0 "[ . 1 . 2]" 1
456 1 31 G H3' 1 32 U H6 3.500 . 5.000 2.911 2.768 3.087 . 0 0 "[ . 1 . 2]" 1
457 1 31 G H1 1 32 U H3 3.500 . 5.500 4.513 4.259 4.739 . 0 0 "[ . 1 . 2]" 1
458 1 31 G H1 1 32 U H5 3.500 . 5.500 5.675 5.560 5.881 0.381 5 0 "[ . 1 . 2]" 1
459 1 31 G H8 1 32 U H5 3.500 . 5.000 4.443 4.289 4.576 . 0 0 "[ . 1 . 2]" 1
460 1 32 U H1' 1 33 G H8 3.500 . 6.000 4.979 4.855 5.300 . 0 0 "[ . 1 . 2]" 1
461 1 32 U H3' 1 33 G H8 3.500 . 4.000 3.352 3.078 3.613 . 0 0 "[ . 1 . 2]" 1
462 1 32 U H3' 1 33 G H5' 3.500 . 5.000 4.974 4.402 5.276 0.276 7 0 "[ . 1 . 2]" 1
463 1 32 U H3' 1 33 G H5'' 3.500 . 5.000 4.014 3.681 4.458 . 0 0 "[ . 1 . 2]" 1
464 1 32 U H3 1 33 G H1' 3.500 . 6.000 4.944 4.295 5.186 . 0 0 "[ . 1 . 2]" 1
465 1 32 U H3 1 33 G H1 3.500 . 5.500 4.982 4.752 5.111 . 0 0 "[ . 1 . 2]" 1
466 1 33 G H1' 1 34 C H5 3.500 . 6.000 5.424 5.095 5.744 . 0 0 "[ . 1 . 2]" 1
467 1 33 G H1' 1 34 C H6 3.500 . 5.000 5.010 4.917 5.090 0.090 16 0 "[ . 1 . 2]" 1
468 1 33 G H2' 1 34 C H1' 3.500 . 5.000 4.538 3.987 4.821 . 0 0 "[ . 1 . 2]" 1
469 1 33 G H2' 1 34 C H5 3.500 . 5.000 3.834 3.500 4.081 . 0 0 "[ . 1 . 2]" 1
470 1 33 G H3' 1 34 C H5 3.500 . 5.000 3.326 2.707 3.741 . 0 0 "[ . 1 . 2]" 1
471 1 33 G H8 1 34 C H5 3.500 . 5.000 3.995 3.683 4.388 . 0 0 "[ . 1 . 2]" 1
472 1 33 G H8 1 34 C H6 3.500 . 5.000 5.152 5.064 5.313 0.313 16 0 "[ . 1 . 2]" 1
473 1 34 C H1' 1 35 G H8 3.500 . 6.000 4.951 4.517 5.703 . 0 0 "[ . 1 . 2]" 1
474 1 34 C H3' 1 35 G H5' 3.500 . 5.000 4.464 4.114 4.868 . 0 0 "[ . 1 . 2]" 1
475 1 34 C H3' 1 35 G H5'' 3.500 . 5.000 4.702 4.458 4.922 . 0 0 "[ . 1 . 2]" 1
476 1 34 C H3' 1 35 G H8 3.500 . 4.000 2.292 2.128 2.351 . 0 0 "[ . 1 . 2]" 1
477 1 35 G H1 1 36 C H41 3.500 . 5.500 4.483 4.060 4.780 . 0 0 "[ . 1 . 2]" 1
478 1 35 G H1 1 36 C H42 3.500 . 5.500 5.061 4.472 5.394 . 0 0 "[ . 1 . 2]" 1
479 1 35 G H1' 1 36 C H6 3.500 . 6.000 5.148 4.987 5.369 . 0 0 "[ . 1 . 2]" 1
480 1 35 G H2' 1 36 C H5 3.500 . 5.000 3.080 2.723 3.478 . 0 0 "[ . 1 . 2]" 1
481 1 35 G H2' 1 36 C H5' 3.500 . 6.000 4.273 3.531 4.577 . 0 0 "[ . 1 . 2]" 1
482 1 35 G H2' 1 36 C H5'' 3.500 . 6.000 5.195 5.029 5.391 . 0 0 "[ . 1 . 2]" 1
483 1 35 G H2' 1 36 C H6 3.500 . 5.000 2.415 2.343 2.608 . 0 0 "[ . 1 . 2]" 1
484 1 35 G H3' 1 36 C H5 3.500 . 5.000 3.340 3.010 3.803 . 0 0 "[ . 1 . 2]" 1
485 1 35 G H3' 1 36 C H5' 3.500 . 5.000 4.713 4.065 4.946 . 0 0 "[ . 1 . 2]" 1
486 1 35 G H3' 1 36 C H5'' 3.500 . 5.000 5.344 5.178 5.449 0.449 17 0 "[ . 1 . 2]" 1
487 1 35 G H3' 1 36 C H6 3.500 . 4.000 3.452 3.249 3.667 . 0 0 "[ . 1 . 2]" 1
488 1 35 G H1' 1 35 G H4' 3.500 . 6.000 3.138 3.033 3.239 . 0 0 "[ . 1 . 2]" 1
489 1 36 C H1' 1 37 C H6 3.500 . 5.000 4.823 4.801 4.860 . 0 0 "[ . 1 . 2]" 1
490 1 36 C H2' 1 37 C H5 3.500 . 5.000 3.926 3.896 3.948 . 0 0 "[ . 1 . 2]" 1
491 1 36 C H2' 1 37 C H6 2.400 . 3.000 2.304 2.292 2.316 . 0 0 "[ . 1 . 2]" 1
492 1 36 C H3' 1 37 C H5 3.500 . 5.000 3.221 3.160 3.400 . 0 0 "[ . 1 . 2]" 1
493 1 36 C H3' 1 37 C H6 3.500 . 4.000 2.381 2.323 2.615 . 0 0 "[ . 1 . 2]" 1
494 1 36 C H3' 1 37 C H5' 3.500 . 5.000 4.450 4.396 4.489 . 0 0 "[ . 1 . 2]" 1
495 1 36 C H3' 1 37 C H5'' 3.500 . 5.000 5.115 5.058 5.164 0.164 16 0 "[ . 1 . 2]" 1
496 1 36 C H5 1 37 C H6 3.500 . 5.000 5.220 5.187 5.260 0.260 10 0 "[ . 1 . 2]" 1
497 1 36 C H6 1 37 C H5 3.500 . 5.000 3.757 3.713 3.867 . 0 0 "[ . 1 . 2]" 1
498 1 37 C H1' 1 38 C H6 3.500 . 5.000 5.071 5.006 5.229 0.229 10 0 "[ . 1 . 2]" 1
499 1 37 C H2' 1 38 C H1' 3.500 . 6.000 5.506 5.423 5.559 . 0 0 "[ . 1 . 2]" 1
500 1 37 C H2' 1 38 C H5 3.500 . 5.000 2.577 2.486 2.779 . 0 0 "[ . 1 . 2]" 1
501 1 37 C H2' 1 38 C H5' 3.500 . 4.000 3.508 3.315 3.892 . 0 0 "[ . 1 . 2]" 1
502 1 37 C H2' 1 38 C H5'' 3.500 . 4.000 4.289 4.169 4.534 0.534 7 4 "[ - + 1 . * *]" 1
503 1 37 C H2' 1 38 C H6 2.400 . 3.000 2.434 2.385 2.593 . 0 0 "[ . 1 . 2]" 1
504 1 37 C H3' 1 38 C H5 3.500 . 5.000 3.216 3.137 3.368 . 0 0 "[ . 1 . 2]" 1
505 1 37 C H3' 1 38 C H5' 3.500 . 5.000 5.008 4.862 5.295 0.295 13 0 "[ . 1 . 2]" 1
506 1 37 C H3' 1 38 C H5'' 3.500 . 5.000 5.115 5.022 5.284 0.284 13 0 "[ . 1 . 2]" 1
507 1 37 C H3' 1 38 C H6 3.500 . 5.000 3.849 3.765 3.952 . 0 0 "[ . 1 . 2]" 1
508 1 38 C H3' 1 38 C H6 3.500 . 4.000 2.352 2.248 2.493 . 0 0 "[ . 1 . 2]" 1
509 1 38 C H4' 1 38 C H6 3.500 . 6.000 3.863 3.831 3.976 . 0 0 "[ . 1 . 2]" 1
510 1 38 C H5'' 1 38 C H6 3.500 . 6.000 3.487 3.443 3.626 . 0 0 "[ . 1 . 2]" 1
511 1 38 C H5' 1 38 C H6 3.500 . 6.000 3.294 3.196 3.607 . 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 82
_Distance_constraint_stats_list.Viol_count 0
_Distance_constraint_stats_list.Viol_total 0.000
_Distance_constraint_stats_list.Viol_max 0.000
_Distance_constraint_stats_list.Viol_rms 0.0000
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0000
_Distance_constraint_stats_list.Viol_average_violations_only 0.0000
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 G 0.000 0.000 . 0 "[ . 1 . 2]"
1 2 G 0.000 0.000 . 0 "[ . 1 . 2]"
1 3 G 0.000 0.000 . 0 "[ . 1 . 2]"
1 4 C 0.000 0.000 . 0 "[ . 1 . 2]"
1 7 G 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 C 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 A 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 C 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 U 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 C 0.000 0.000 . 0 "[ . 1 . 2]"
1 13 U 0.000 0.000 . 0 "[ . 1 . 2]"
1 14 G 0.000 0.000 . 0 "[ . 1 . 2]"
1 15 G 0.000 0.000 . 0 "[ . 1 . 2]"
1 16 U 0.000 0.000 . 0 "[ . 1 . 2]"
1 17 A 0.000 0.000 . 0 "[ . 1 . 2]"
1 18 U 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 G 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 U 0.000 0.000 . 0 "[ . 1 . 2]"
1 25 A 0.000 0.000 . 0 "[ . 1 . 2]"
1 26 C 0.000 0.000 . 0 "[ . 1 . 2]"
1 27 C 0.000 0.000 . 0 "[ . 1 . 2]"
1 28 U 0.000 0.000 . 0 "[ . 1 . 2]"
1 29 U 0.000 0.000 . 0 "[ . 1 . 2]"
1 30 U 0.000 0.000 . 0 "[ . 1 . 2]"
1 31 G 0.000 0.000 . 0 "[ . 1 . 2]"
1 32 U 0.000 0.000 . 0 "[ . 1 . 2]"
1 33 G 0.000 0.000 . 0 "[ . 1 . 2]"
1 34 C 0.000 0.000 . 0 "[ . 1 . 2]"
1 35 G 0.000 0.000 . 0 "[ . 1 . 2]"
1 36 C 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 C 0.000 0.000 . 0 "[ . 1 . 2]"
1 38 C 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 G N1 1 38 C N3 2.870 2.670 3.070 2.844 2.838 2.849 . 0 0 "[ . 1 . 2]" 2
2 1 1 G H1 1 38 C N3 1.860 . 2.060 1.874 1.851 1.884 . 0 0 "[ . 1 . 2]" 2
3 1 1 G O6 1 38 C N4 2.810 2.610 3.010 2.793 2.783 2.803 . 0 0 "[ . 1 . 2]" 2
4 1 1 G O6 1 38 C H41 1.800 . 2.000 1.805 1.794 1.809 . 0 0 "[ . 1 . 2]" 2
5 1 1 G N2 1 38 C O2 2.810 2.610 3.010 2.789 2.785 2.800 . 0 0 "[ . 1 . 2]" 2
6 1 1 G H21 1 38 C O2 1.790 . 1.990 1.849 1.837 1.867 . 0 0 "[ . 1 . 2]" 2
7 1 2 G N1 1 37 C N3 2.870 2.670 3.070 2.854 2.850 2.862 . 0 0 "[ . 1 . 2]" 2
8 1 2 G H1 1 37 C N3 1.860 . 2.060 1.858 1.853 1.865 . 0 0 "[ . 1 . 2]" 2
9 1 2 G O6 1 37 C N4 2.810 2.610 3.010 2.808 2.801 2.812 . 0 0 "[ . 1 . 2]" 2
10 1 2 G O6 1 37 C H41 1.800 . 2.000 1.825 1.813 1.833 . 0 0 "[ . 1 . 2]" 2
11 1 2 G N2 1 37 C O2 2.810 2.610 3.010 2.804 2.798 2.811 . 0 0 "[ . 1 . 2]" 2
12 1 2 G H21 1 37 C O2 1.790 . 1.990 1.828 1.822 1.834 . 0 0 "[ . 1 . 2]" 2
13 1 3 G N1 1 36 C N3 2.870 2.670 3.070 2.859 2.852 2.861 . 0 0 "[ . 1 . 2]" 2
14 1 3 G H1 1 36 C N3 1.860 . 2.060 1.850 1.848 1.852 . 0 0 "[ . 1 . 2]" 2
15 1 3 G O6 1 36 C N4 2.810 2.610 3.010 2.805 2.794 2.812 . 0 0 "[ . 1 . 2]" 2
16 1 3 G O6 1 36 C H41 1.800 . 2.000 1.821 1.816 1.833 . 0 0 "[ . 1 . 2]" 2
17 1 3 G N2 1 36 C O2 2.810 2.610 3.010 2.814 2.808 2.820 . 0 0 "[ . 1 . 2]" 2
18 1 3 G H21 1 36 C O2 1.790 . 1.990 1.816 1.809 1.822 . 0 0 "[ . 1 . 2]" 2
19 1 4 C N3 1 35 G N1 2.870 2.670 3.070 2.864 2.859 2.870 . 0 0 "[ . 1 . 2]" 2
20 1 4 C N3 1 35 G H1 1.860 . 2.060 1.856 1.852 1.862 . 0 0 "[ . 1 . 2]" 2
21 1 4 C N4 1 35 G O6 2.810 2.610 3.010 2.816 2.811 2.825 . 0 0 "[ . 1 . 2]" 2
22 1 4 C H41 1 35 G O6 1.800 . 2.000 1.811 1.802 1.818 . 0 0 "[ . 1 . 2]" 2
23 1 4 C O2 1 35 G N2 2.810 2.610 3.010 2.800 2.789 2.811 . 0 0 "[ . 1 . 2]" 2
24 1 4 C O2 1 35 G H21 1.790 . 1.990 1.805 1.792 1.818 . 0 0 "[ . 1 . 2]" 2
25 1 7 G N1 1 34 C N3 2.870 2.670 3.070 2.869 2.866 2.872 . 0 0 "[ . 1 . 2]" 2
26 1 7 G H1 1 34 C N3 1.860 . 2.060 1.861 1.859 1.869 . 0 0 "[ . 1 . 2]" 2
27 1 7 G O6 1 34 C N4 2.810 2.610 3.010 2.807 2.787 2.816 . 0 0 "[ . 1 . 2]" 2
28 1 7 G O6 1 34 C H41 1.800 . 2.000 1.801 1.784 1.816 . 0 0 "[ . 1 . 2]" 2
29 1 7 G N2 1 34 C O2 2.810 2.610 3.010 2.812 2.803 2.833 . 0 0 "[ . 1 . 2]" 2
30 1 7 G H21 1 34 C O2 1.790 . 1.990 1.810 1.801 1.834 . 0 0 "[ . 1 . 2]" 2
31 1 8 C N3 1 33 G N1 2.870 2.670 3.070 2.851 2.844 2.857 . 0 0 "[ . 1 . 2]" 2
32 1 8 C N3 1 33 G H1 1.860 . 2.060 1.842 1.835 1.848 . 0 0 "[ . 1 . 2]" 2
33 1 8 C N4 1 33 G O6 2.810 2.610 3.010 2.806 2.791 2.823 . 0 0 "[ . 1 . 2]" 2
34 1 8 C H41 1 33 G O6 1.800 . 2.000 1.835 1.819 1.849 . 0 0 "[ . 1 . 2]" 2
35 1 8 C O2 1 33 G N2 2.810 2.610 3.010 2.803 2.789 2.809 . 0 0 "[ . 1 . 2]" 2
36 1 8 C O2 1 33 G H21 1.790 . 1.990 1.803 1.794 1.813 . 0 0 "[ . 1 . 2]" 2
37 1 9 A N1 1 32 U N3 2.920 2.720 3.120 2.889 2.885 2.893 . 0 0 "[ . 1 . 2]" 2
38 1 9 A N1 1 32 U H3 1.810 . 2.010 1.884 1.878 1.892 . 0 0 "[ . 1 . 2]" 2
39 1 9 A N6 1 32 U O4 2.890 2.690 3.090 2.888 2.879 2.898 . 0 0 "[ . 1 . 2]" 2
40 1 9 A H61 1 32 U O4 1.870 . 2.070 1.880 1.871 1.891 . 0 0 "[ . 1 . 2]" 2
41 1 10 C N3 1 31 G N1 2.870 2.670 3.070 2.865 2.862 2.868 . 0 0 "[ . 1 . 2]" 2
42 1 10 C N3 1 31 G H1 1.860 . 2.060 1.857 1.853 1.860 . 0 0 "[ . 1 . 2]" 2
43 1 10 C N4 1 31 G O6 2.810 2.610 3.010 2.815 2.809 2.820 . 0 0 "[ . 1 . 2]" 2
44 1 10 C H41 1 31 G O6 1.800 . 2.000 1.808 1.802 1.813 . 0 0 "[ . 1 . 2]" 2
45 1 10 C O2 1 31 G N2 2.810 2.610 3.010 2.802 2.795 2.808 . 0 0 "[ . 1 . 2]" 2
46 1 10 C O2 1 31 G H21 1.790 . 1.990 1.799 1.790 1.805 . 0 0 "[ . 1 . 2]" 2
47 1 14 G N1 1 27 C N3 2.870 2.670 3.070 2.862 2.858 2.869 . 0 0 "[ . 1 . 2]" 2
48 1 14 G H1 1 27 C N3 1.860 . 2.060 1.855 1.848 1.866 . 0 0 "[ . 1 . 2]" 2
49 1 14 G O6 1 27 C N4 2.810 2.610 3.010 2.824 2.816 2.830 . 0 0 "[ . 1 . 2]" 2
50 1 14 G O6 1 27 C H41 1.800 . 2.000 1.825 1.811 1.844 . 0 0 "[ . 1 . 2]" 2
51 1 14 G N2 1 27 C O2 2.810 2.610 3.010 2.790 2.786 2.796 . 0 0 "[ . 1 . 2]" 2
52 1 14 G H21 1 27 C O2 1.790 . 1.990 1.788 1.785 1.794 . 0 0 "[ . 1 . 2]" 2
53 1 15 G N1 1 26 C N3 2.870 2.670 3.070 2.861 2.856 2.864 . 0 0 "[ . 1 . 2]" 2
54 1 15 G H1 1 26 C N3 1.860 . 2.060 1.855 1.853 1.859 . 0 0 "[ . 1 . 2]" 2
55 1 15 G O6 1 26 C N4 2.810 2.610 3.010 2.795 2.788 2.805 . 0 0 "[ . 1 . 2]" 2
56 1 15 G O6 1 26 C H41 1.800 . 2.000 1.794 1.789 1.801 . 0 0 "[ . 1 . 2]" 2
57 1 15 G N2 1 26 C O2 2.810 2.610 3.010 2.829 2.823 2.834 . 0 0 "[ . 1 . 2]" 2
58 1 15 G H21 1 26 C O2 1.790 . 1.990 1.825 1.820 1.830 . 0 0 "[ . 1 . 2]" 2
59 1 16 U N3 1 25 A N1 2.920 2.720 3.120 2.880 2.877 2.884 . 0 0 "[ . 1 . 2]" 2
60 1 16 U H3 1 25 A N1 1.810 . 2.010 1.878 1.872 1.892 . 0 0 "[ . 1 . 2]" 2
61 1 16 U O4 1 25 A N6 2.890 2.690 3.090 2.891 2.882 2.897 . 0 0 "[ . 1 . 2]" 2
62 1 16 U O4 1 25 A H61 1.870 . 2.070 1.901 1.894 1.905 . 0 0 "[ . 1 . 2]" 2
63 1 17 A N1 1 24 U N3 2.920 2.720 3.120 2.892 2.887 2.899 . 0 0 "[ . 1 . 2]" 2
64 1 17 A N1 1 24 U H3 1.810 . 2.010 1.887 1.883 1.893 . 0 0 "[ . 1 . 2]" 2
65 1 17 A N6 1 24 U O4 2.890 2.690 3.090 2.877 2.863 2.895 . 0 0 "[ . 1 . 2]" 2
66 1 17 A H61 1 24 U O4 1.870 . 2.070 1.884 1.876 1.900 . 0 0 "[ . 1 . 2]" 2
67 1 18 U H3 1 23 G O6 1.900 . 2.200 1.959 1.897 2.039 . 0 0 "[ . 1 . 2]" 2
68 1 18 U N3 1 23 G O6 3.000 2.720 3.080 2.937 2.889 2.962 . 0 0 "[ . 1 . 2]" 2
69 1 18 U O2 1 23 G H1 1.900 . 2.200 1.964 1.935 1.994 . 0 0 "[ . 1 . 2]" 2
70 1 18 U O2 1 23 G N1 3.000 2.720 3.080 2.946 2.888 3.002 . 0 0 "[ . 1 . 2]" 2
71 1 13 U O4 1 28 U N3 2.950 2.750 3.150 2.964 2.938 2.978 . 0 0 "[ . 1 . 2]" 2
72 1 13 U O4 1 28 U H3 2.000 . 2.200 1.989 1.968 2.015 . 0 0 "[ . 1 . 2]" 2
73 1 13 U N3 1 28 U O2 2.950 2.750 3.150 2.973 2.955 2.994 . 0 0 "[ . 1 . 2]" 2
74 1 13 U H3 1 28 U O2 2.000 . 2.200 1.986 1.973 2.013 . 0 0 "[ . 1 . 2]" 2
75 1 11 U N3 1 30 U O4 2.950 2.750 3.150 2.948 2.915 2.974 . 0 0 "[ . 1 . 2]" 2
76 1 11 U H3 1 30 U O4 2.000 . 2.200 1.987 1.956 2.026 . 0 0 "[ . 1 . 2]" 2
77 1 11 U O2 1 30 U N3 2.950 2.750 3.150 2.974 2.926 3.007 . 0 0 "[ . 1 . 2]" 2
78 1 11 U O2 1 30 U H3 2.000 . 2.200 1.993 1.963 2.032 . 0 0 "[ . 1 . 2]" 2
79 1 12 C N4 1 29 U O4 2.950 2.750 3.150 2.949 2.921 2.972 . 0 0 "[ . 1 . 2]" 2
80 1 12 C H41 1 29 U O4 2.000 . 2.200 1.982 1.965 2.000 . 0 0 "[ . 1 . 2]" 2
81 1 12 C N3 1 29 U N3 2.950 2.750 3.150 2.979 2.956 2.997 . 0 0 "[ . 1 . 2]" 2
82 1 12 C N3 1 29 U H3 2.000 . 2.200 2.002 1.975 2.050 . 0 0 "[ . 1 . 2]" 2
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