NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
599195 |
2n0j   |
25526 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2n0j
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 714
_Distance_constraint_stats_list.Viol_count 864
_Distance_constraint_stats_list.Viol_total 820.335
_Distance_constraint_stats_list.Viol_max 0.079
_Distance_constraint_stats_list.Viol_rms 0.0121
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0029
_Distance_constraint_stats_list.Viol_average_violations_only 0.0475
_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 0.555 0.067 18 0 "[ . 1 . 2]"
1 2 G 1.862 0.068 1 0 "[ . 1 . 2]"
1 3 C 1.947 0.067 10 0 "[ . 1 . 2]"
1 4 U 3.091 0.071 13 0 "[ . 1 . 2]"
1 5 G 2.832 0.070 17 0 "[ . 1 . 2]"
1 6 C 3.394 0.074 6 0 "[ . 1 . 2]"
1 7 U 0.992 0.065 10 0 "[ . 1 . 2]"
1 9 G 3.945 0.074 14 0 "[ . 1 . 2]"
1 10 U 1.052 0.063 2 0 "[ . 1 . 2]"
1 11 C 1.562 0.071 8 0 "[ . 1 . 2]"
1 12 C 1.012 0.054 8 0 "[ . 1 . 2]"
1 13 U 2.738 0.063 12 0 "[ . 1 . 2]"
1 14 U 8.145 0.075 12 0 "[ . 1 . 2]"
1 15 U 3.243 0.075 12 0 "[ . 1 . 2]"
1 16 A 3.579 0.074 6 0 "[ . 1 . 2]"
1 17 A 0.656 0.064 20 0 "[ . 1 . 2]"
1 18 U 3.760 0.066 12 0 "[ . 1 . 2]"
1 19 G 1.617 0.069 2 0 "[ . 1 . 2]"
1 20 G 3.225 0.074 3 0 "[ . 1 . 2]"
1 21 U 2.092 0.079 15 0 "[ . 1 . 2]"
1 22 C 2.019 0.068 19 0 "[ . 1 . 2]"
1 23 C 1.421 0.069 7 0 "[ . 1 . 2]"
1 24 A 0.651 0.070 17 0 "[ . 1 . 2]"
1 25 G 2.884 0.067 12 0 "[ . 1 . 2]"
1 26 U 2.421 0.064 6 0 "[ . 1 . 2]"
1 27 C 1.184 0.064 6 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 G H1' 1 1 G Q5' . . 6.500 4.280 4.092 4.467 . 0 0 "[ . 1 . 2]" 1
2 1 1 G Q5' 1 1 G H8 . . 4.300 2.668 2.175 3.950 . 0 0 "[ . 1 . 2]" 1
3 1 1 G H1' 1 1 G H4' . . 4.300 3.498 3.201 3.639 . 0 0 "[ . 1 . 2]" 1
4 1 1 G H4' 1 1 G H8 . . 5.700 4.285 4.129 4.547 . 0 0 "[ . 1 . 2]" 1
5 1 1 G H1' 1 1 G H2' . . 3.500 2.733 2.684 2.800 . 0 0 "[ . 1 . 2]" 1
6 1 1 G H2' 1 1 G H8 . . 4.300 4.288 4.035 4.367 0.067 18 0 "[ . 1 . 2]" 1
7 1 1 G H2' 1 2 G H8 . . 2.800 2.351 2.062 2.831 0.031 14 0 "[ . 1 . 2]" 1
8 1 1 G H1' 1 1 G H8 . . 5.700 3.617 3.403 3.741 . 0 0 "[ . 1 . 2]" 1
9 1 1 G H1' 1 2 G H8 . . 5.700 4.906 4.674 5.300 . 0 0 "[ . 1 . 2]" 1
10 1 1 G H1 1 2 G H1 . . 6.500 4.377 3.962 4.752 . 0 0 "[ . 1 . 2]" 1
11 1 1 G H1 1 26 U H3 . . 6.500 4.416 3.574 4.946 . 0 0 "[ . 1 . 2]" 1
12 1 1 G H1 1 27 C H41 . . 4.300 2.473 2.075 2.845 . 0 0 "[ . 1 . 2]" 1
13 1 1 G H1 1 27 C H42 . . 4.300 3.975 3.533 4.326 0.026 14 0 "[ . 1 . 2]" 1
14 1 1 G H1 1 27 C H5 . . 6.500 5.044 4.833 5.239 . 0 0 "[ . 1 . 2]" 1
15 1 1 G H8 1 2 G H8 . . 6.500 5.481 4.673 5.858 . 0 0 "[ . 1 . 2]" 1
16 1 2 G Q5' 1 2 G H8 . . 4.300 3.641 3.489 3.792 . 0 0 "[ . 1 . 2]" 1
17 1 2 G H3' 1 2 G H4' . . 4.300 3.014 2.982 3.042 . 0 0 "[ . 1 . 2]" 1
18 1 2 G H2' 1 2 G H4' . . 4.300 3.767 3.652 3.846 . 0 0 "[ . 1 . 2]" 1
19 1 2 G H1' 1 2 G H4' . . 4.300 3.350 3.197 3.448 . 0 0 "[ . 1 . 2]" 1
20 1 2 G H4' 1 2 G H8 . . 4.300 4.355 4.330 4.368 0.068 1 0 "[ . 1 . 2]" 1
21 1 2 G H4' 1 3 C H6 . . 5.700 5.635 5.264 5.767 0.067 10 0 "[ . 1 . 2]" 1
22 1 2 G H2' 1 2 G H3' . . 4.300 2.422 2.388 2.459 . 0 0 "[ . 1 . 2]" 1
23 1 2 G H1' 1 2 G H3' . . 4.300 3.837 3.769 3.897 . 0 0 "[ . 1 . 2]" 1
24 1 2 G H3' 1 2 G H8 . . 4.300 3.127 2.641 3.634 . 0 0 "[ . 1 . 2]" 1
25 1 2 G H3' 1 3 C H5 . . 5.700 3.522 2.989 3.897 . 0 0 "[ . 1 . 2]" 1
26 1 2 G H3' 1 3 C H6 . . 4.300 3.030 2.500 3.396 . 0 0 "[ . 1 . 2]" 1
27 1 2 G H2' 1 2 G H8 . . 4.300 4.074 3.762 4.305 0.005 6 0 "[ . 1 . 2]" 1
28 1 2 G H2' 1 3 C H5 . . 4.300 3.985 3.668 4.337 0.037 10 0 "[ . 1 . 2]" 1
29 1 2 G H2' 1 3 C H6 . . 2.800 2.510 2.270 2.729 . 0 0 "[ . 1 . 2]" 1
30 1 2 G H1' 1 2 G H8 . . 5.700 3.712 3.566 3.791 . 0 0 "[ . 1 . 2]" 1
31 1 2 G H1' 1 3 C H6 . . 5.700 5.039 4.815 5.350 . 0 0 "[ . 1 . 2]" 1
32 1 2 G H1 1 3 C H1' . . 6.500 4.877 4.424 5.331 . 0 0 "[ . 1 . 2]" 1
33 1 2 G H1 1 3 C H6 . . 6.500 6.136 5.720 6.441 . 0 0 "[ . 1 . 2]" 1
34 1 2 G H1 1 25 G H21 . . 6.500 4.203 3.490 4.757 . 0 0 "[ . 1 . 2]" 1
35 1 2 G H1 1 26 U H3' . . 6.500 6.431 6.199 6.550 0.050 19 0 "[ . 1 . 2]" 1
36 1 2 G H1 1 26 U H2' . . 6.500 4.417 4.050 4.610 . 0 0 "[ . 1 . 2]" 1
37 1 2 G H1 1 26 U H3 . . 3.500 2.490 2.146 2.886 . 0 0 "[ . 1 . 2]" 1
38 1 2 G H1 1 26 U H6 . . 6.500 6.017 5.847 6.292 . 0 0 "[ . 1 . 2]" 1
39 1 2 G H1 1 27 C H1' . . 6.500 4.157 3.434 4.957 . 0 0 "[ . 1 . 2]" 1
40 1 2 G H1 1 27 C H41 . . 5.700 4.704 3.968 5.433 . 0 0 "[ . 1 . 2]" 1
41 1 2 G H1 1 27 C H5 . . 5.700 4.806 4.251 5.634 . 0 0 "[ . 1 . 2]" 1
42 1 2 G H1 1 27 C H6 . . 5.700 4.761 4.212 5.306 . 0 0 "[ . 1 . 2]" 1
43 1 2 G H8 1 3 C H5 . . 5.700 3.830 3.505 4.532 . 0 0 "[ . 1 . 2]" 1
44 1 3 C Q5' 1 3 C H6 . . 5.700 3.508 3.321 3.735 . 0 0 "[ . 1 . 2]" 1
45 1 3 C H1' 1 3 C H4' . . 4.300 3.271 3.134 3.404 . 0 0 "[ . 1 . 2]" 1
46 1 3 C H4' 1 3 C H6 . . 4.300 4.172 4.138 4.229 . 0 0 "[ . 1 . 2]" 1
47 1 3 C H4' 1 4 U H6 . . 6.500 5.817 5.555 5.995 . 0 0 "[ . 1 . 2]" 1
48 1 3 C H2' 1 3 C H3' . . 2.800 2.392 2.327 2.453 . 0 0 "[ . 1 . 2]" 1
49 1 3 C H1' 1 3 C H3' . . 4.300 3.841 3.749 3.890 . 0 0 "[ . 1 . 2]" 1
50 1 3 C H3' 1 3 C H5 . . 5.700 4.666 4.381 4.886 . 0 0 "[ . 1 . 2]" 1
51 1 3 C H3' 1 3 C H6 . . 2.800 2.645 2.423 2.864 0.064 10 0 "[ . 1 . 2]" 1
52 1 3 C H3' 1 4 U H5 . . 5.700 3.955 3.386 4.581 . 0 0 "[ . 1 . 2]" 1
53 1 3 C H3' 1 4 U H6 . . 4.300 3.445 3.110 3.782 . 0 0 "[ . 1 . 2]" 1
54 1 3 C H1' 1 3 C H2' . . 2.800 2.767 2.737 2.797 . 0 0 "[ . 1 . 2]" 1
55 1 3 C H2' 1 3 C H5 . . 5.700 5.161 4.780 5.403 . 0 0 "[ . 1 . 2]" 1
56 1 3 C H2' 1 3 C H6 . . 4.300 3.620 3.295 3.839 . 0 0 "[ . 1 . 2]" 1
57 1 3 C H2' 1 4 U H6 . . 2.800 2.383 2.174 2.610 . 0 0 "[ . 1 . 2]" 1
58 1 3 C H1' 1 3 C H6 . . 4.300 3.672 3.628 3.707 . 0 0 "[ . 1 . 2]" 1
59 1 3 C H1' 1 4 U H6 . . 5.700 5.021 4.821 5.218 . 0 0 "[ . 1 . 2]" 1
60 1 3 C H41 1 4 U H3 . . 4.300 4.199 3.794 4.344 0.044 19 0 "[ . 1 . 2]" 1
61 1 3 C H41 1 25 G H1 . . 2.800 2.368 2.051 2.630 . 0 0 "[ . 1 . 2]" 1
62 1 3 C H41 1 26 U H3 . . 5.700 3.819 3.469 4.152 . 0 0 "[ . 1 . 2]" 1
63 1 3 C H42 1 4 U H3 . . 5.700 5.045 4.461 5.434 . 0 0 "[ . 1 . 2]" 1
64 1 3 C H42 1 25 G H1 . . 4.300 3.877 3.589 4.144 . 0 0 "[ . 1 . 2]" 1
65 1 3 C H6 1 4 U H5 . . 5.700 4.066 3.941 4.450 . 0 0 "[ . 1 . 2]" 1
66 1 4 U H2' 1 4 U H4' . . 4.300 3.761 3.718 3.816 . 0 0 "[ . 1 . 2]" 1
67 1 4 U H1' 1 4 U H4' . . 4.300 3.215 3.121 3.314 . 0 0 "[ . 1 . 2]" 1
68 1 4 U H4' 1 4 U H6 . . 4.300 4.211 4.165 4.255 . 0 0 "[ . 1 . 2]" 1
69 1 4 U H1' 1 4 U H3' . . 4.300 3.865 3.826 3.907 . 0 0 "[ . 1 . 2]" 1
70 1 4 U H3' 1 4 U H5 . . 5.700 4.951 4.685 5.141 . 0 0 "[ . 1 . 2]" 1
71 1 4 U H3' 1 4 U H6 . . 4.300 2.901 2.746 3.205 . 0 0 "[ . 1 . 2]" 1
72 1 4 U H3' 1 5 G H8 . . 4.300 3.489 3.433 3.753 . 0 0 "[ . 1 . 2]" 1
73 1 4 U H1' 1 4 U H2' . . 2.800 2.775 2.743 2.809 0.009 15 0 "[ . 1 . 2]" 1
74 1 4 U H2' 1 4 U H5 . . 6.500 5.344 4.925 5.516 . 0 0 "[ . 1 . 2]" 1
75 1 4 U H2' 1 4 U H6 . . 4.300 3.766 3.502 3.934 . 0 0 "[ . 1 . 2]" 1
76 1 4 U H2' 1 5 G H2' . . 6.500 4.506 4.130 4.832 . 0 0 "[ . 1 . 2]" 1
77 1 4 U H2' 1 5 G H1' . . 6.500 4.758 4.391 5.016 . 0 0 "[ . 1 . 2]" 1
78 1 4 U H2' 1 5 G H8 . . 4.300 2.815 2.740 3.218 . 0 0 "[ . 1 . 2]" 1
79 1 4 U H1' 1 4 U H6 . . 4.300 3.629 3.556 3.697 . 0 0 "[ . 1 . 2]" 1
80 1 4 U H1' 1 5 G H8 . . 5.700 5.520 5.299 5.754 0.054 18 0 "[ . 1 . 2]" 1
81 1 4 U H3 1 5 G H1 . . 5.700 4.186 3.726 4.703 . 0 0 "[ . 1 . 2]" 1
82 1 4 U H6 1 5 G H8 . . 6.500 5.210 4.768 5.653 . 0 0 "[ . 1 . 2]" 1
83 1 4 U H6 1 25 G H1 . . 5.700 5.722 5.465 5.766 0.066 7 0 "[ . 1 . 2]" 1
84 1 5 G H4' 1 5 G Q5' . . 4.300 2.149 2.111 2.172 . 0 0 "[ . 1 . 2]" 1
85 1 5 G H2' 1 5 G Q5' . . 5.700 3.473 3.223 3.678 . 0 0 "[ . 1 . 2]" 1
86 1 5 G Q5' 1 5 G H8 . . 5.700 3.887 3.704 4.193 . 0 0 "[ . 1 . 2]" 1
87 1 5 G Q5' 1 6 C H5 . . 5.700 3.947 3.009 4.727 . 0 0 "[ . 1 . 2]" 1
88 1 5 G H3' 1 5 G H4' . . 3.500 2.767 2.706 2.810 . 0 0 "[ . 1 . 2]" 1
89 1 5 G H1' 1 5 G H4' . . 5.700 3.390 3.162 3.514 . 0 0 "[ . 1 . 2]" 1
90 1 5 G H4' 1 5 G H8 . . 5.700 4.828 4.679 4.990 . 0 0 "[ . 1 . 2]" 1
91 1 5 G H4' 1 6 C H5 . . 5.700 5.366 4.927 5.753 0.053 18 0 "[ . 1 . 2]" 1
92 1 5 G H1' 1 5 G H3' . . 5.700 3.857 3.765 3.943 . 0 0 "[ . 1 . 2]" 1
93 1 5 G H3' 1 5 G H8 . . 4.300 4.290 4.140 4.357 0.057 1 0 "[ . 1 . 2]" 1
94 1 5 G H3' 1 6 C H5 . . 5.700 3.079 2.302 3.695 . 0 0 "[ . 1 . 2]" 1
95 1 5 G H1' 1 5 G H2' . . 4.300 3.014 2.976 3.040 . 0 0 "[ . 1 . 2]" 1
96 1 5 G H2' 1 5 G H8 . . 2.800 2.396 2.238 2.813 0.013 9 0 "[ . 1 . 2]" 1
97 1 5 G H2' 1 6 C H5 . . 4.300 2.357 2.088 2.778 . 0 0 "[ . 1 . 2]" 1
98 1 5 G H2' 1 6 C H6 . . 5.700 3.146 2.526 4.079 . 0 0 "[ . 1 . 2]" 1
99 1 5 G H2' 1 9 G H8 . . 5.700 3.838 2.728 4.645 . 0 0 "[ . 1 . 2]" 1
100 1 5 G H1' 1 5 G H8 . . 4.300 3.884 3.858 3.923 . 0 0 "[ . 1 . 2]" 1
101 1 5 G H1' 1 9 G H8 . . 4.300 4.136 3.686 4.362 0.062 20 0 "[ . 1 . 2]" 1
102 1 5 G H1' 1 24 A H2 . . 6.500 5.211 4.758 6.198 . 0 0 "[ . 1 . 2]" 1
103 1 5 G H1 1 9 G H1 . . 4.300 4.029 3.937 4.324 0.024 20 0 "[ . 1 . 2]" 1
104 1 5 G H1 1 9 G H8 . . 6.500 6.478 6.114 6.563 0.063 12 0 "[ . 1 . 2]" 1
105 1 5 G H1 1 22 C H42 . . 5.700 5.023 4.440 5.400 . 0 0 "[ . 1 . 2]" 1
106 1 5 G H1 1 23 C H41 . . 2.800 2.175 1.948 2.664 . 0 0 "[ . 1 . 2]" 1
107 1 5 G H1 1 23 C H42 . . 4.300 3.716 3.460 4.198 . 0 0 "[ . 1 . 2]" 1
108 1 5 G H1 1 24 A H1' . . 5.700 5.521 5.144 5.770 0.070 17 0 "[ . 1 . 2]" 1
109 1 5 G H8 1 6 C H5 . . 5.700 3.513 2.856 4.332 . 0 0 "[ . 1 . 2]" 1
110 1 6 C H2' 1 6 C H4' . . 4.300 3.854 3.679 4.088 . 0 0 "[ . 1 . 2]" 1
111 1 6 C H1' 1 6 C H4' . . 4.300 3.526 3.029 3.960 . 0 0 "[ . 1 . 2]" 1
112 1 6 C H4' 1 6 C H6 . . 5.700 4.136 3.859 4.356 . 0 0 "[ . 1 . 2]" 1
113 1 6 C H2' 1 6 C H3' . . 2.800 2.356 2.278 2.430 . 0 0 "[ . 1 . 2]" 1
114 1 6 C H3' 1 6 C H6 . . 4.300 3.719 3.311 4.061 . 0 0 "[ . 1 . 2]" 1
115 1 6 C H2' 1 6 C H5 . . 5.700 5.665 5.301 5.768 0.068 1 0 "[ . 1 . 2]" 1
116 1 6 C H2' 1 6 C H6 . . 4.300 4.352 4.209 4.372 0.072 1 0 "[ . 1 . 2]" 1
117 1 6 C H1' 1 6 C H5 . . 5.700 5.168 4.992 5.293 . 0 0 "[ . 1 . 2]" 1
118 1 6 C H1' 1 6 C H6 . . 5.700 3.317 3.180 3.480 . 0 0 "[ . 1 . 2]" 1
119 1 6 C H5 1 17 A H2 . . 5.700 4.715 3.594 5.554 . 0 0 "[ . 1 . 2]" 1
120 1 7 U H4' 1 7 U Q5' . . 4.300 2.454 2.170 2.568 . 0 0 "[ . 1 . 2]" 1
121 1 7 U Q5' 1 7 U H6 . . 4.300 2.500 2.010 3.626 . 0 0 "[ . 1 . 2]" 1
122 1 7 U H2' 1 7 U H4' . . 5.700 3.819 3.651 3.925 . 0 0 "[ . 1 . 2]" 1
123 1 7 U H1' 1 7 U H4' . . 4.300 3.355 3.042 3.494 . 0 0 "[ . 1 . 2]" 1
124 1 7 U H4' 1 7 U H6 . . 5.700 4.104 3.962 4.412 . 0 0 "[ . 1 . 2]" 1
125 1 7 U H2' 1 7 U H3' . . 2.800 2.390 2.328 2.431 . 0 0 "[ . 1 . 2]" 1
126 1 7 U H3' 1 7 U H6 . . 4.300 2.431 2.022 4.221 . 0 0 "[ . 1 . 2]" 1
127 1 7 U H1' 1 7 U H2' . . 4.300 2.773 2.714 3.034 . 0 0 "[ . 1 . 2]" 1
128 1 7 U H2' 1 7 U H5 . . 5.700 4.958 4.441 5.208 . 0 0 "[ . 1 . 2]" 1
129 1 7 U H2' 1 7 U H6 . . 3.500 3.393 2.275 3.562 0.062 12 0 "[ . 1 . 2]" 1
130 1 7 U H1' 1 7 U H5 . . 5.700 5.415 5.362 5.462 . 0 0 "[ . 1 . 2]" 1
131 1 7 U H1' 1 7 U H6 . . 4.300 3.708 3.637 3.776 . 0 0 "[ . 1 . 2]" 1
132 1 9 G H3' 1 9 G H5' . . 4.300 3.706 3.644 3.767 . 0 0 "[ . 1 . 2]" 1
133 1 9 G H1' 1 9 G H5' . . 6.500 4.632 4.461 4.752 . 0 0 "[ . 1 . 2]" 1
134 1 9 G H5' 1 9 G H8 . . 5.700 4.159 3.856 4.395 . 0 0 "[ . 1 . 2]" 1
135 1 9 G H3' 1 9 G H5'' . . 4.300 2.986 2.777 3.171 . 0 0 "[ . 1 . 2]" 1
136 1 9 G H1' 1 9 G H5'' . . 6.500 5.177 5.046 5.260 . 0 0 "[ . 1 . 2]" 1
137 1 9 G H5'' 1 9 G H8 . . 5.700 5.221 4.895 5.370 . 0 0 "[ . 1 . 2]" 1
138 1 9 G H1' 1 9 G H4' . . 4.300 3.230 3.012 3.445 . 0 0 "[ . 1 . 2]" 1
139 1 9 G H4' 1 9 G H8 . . 5.700 4.626 4.565 4.692 . 0 0 "[ . 1 . 2]" 1
140 1 9 G H2' 1 9 G H3' . . 4.300 2.359 2.324 2.388 . 0 0 "[ . 1 . 2]" 1
141 1 9 G H1' 1 9 G H3' . . 5.700 3.856 3.819 3.881 . 0 0 "[ . 1 . 2]" 1
142 1 9 G H3' 1 9 G H8 . . 4.300 4.327 4.191 4.367 0.067 5 0 "[ . 1 . 2]" 1
143 1 9 G H3' 1 10 U H5 . . 4.300 2.686 2.370 3.066 . 0 0 "[ . 1 . 2]" 1
144 1 9 G H3' 1 10 U H6 . . 4.300 2.583 2.340 2.870 . 0 0 "[ . 1 . 2]" 1
145 1 9 G H2' 1 9 G H8 . . 5.700 4.595 4.466 4.670 . 0 0 "[ . 1 . 2]" 1
146 1 9 G H2' 1 10 U H1' . . 5.700 4.848 4.334 5.115 . 0 0 "[ . 1 . 2]" 1
147 1 9 G H2' 1 10 U H5 . . 6.500 3.715 3.023 4.234 . 0 0 "[ . 1 . 2]" 1
148 1 9 G H2' 1 10 U H6 . . 3.500 3.237 2.566 3.550 0.050 6 0 "[ . 1 . 2]" 1
149 1 9 G H1' 1 9 G H8 . . 4.300 3.329 3.245 3.427 . 0 0 "[ . 1 . 2]" 1
150 1 9 G H1' 1 10 U H5 . . 6.500 5.164 4.748 5.411 . 0 0 "[ . 1 . 2]" 1
151 1 9 G H1' 1 10 U H6 . . 6.500 5.694 5.197 6.039 . 0 0 "[ . 1 . 2]" 1
152 1 9 G H1 1 10 U H1' . . 5.700 5.614 5.258 5.763 0.063 2 0 "[ . 1 . 2]" 1
153 1 9 G H1 1 10 U H3 . . 4.300 3.879 3.444 4.351 0.051 10 0 "[ . 1 . 2]" 1
154 1 9 G H1 1 21 U H3 . . 6.500 5.021 4.285 5.904 . 0 0 "[ . 1 . 2]" 1
155 1 9 G H1 1 21 U H5 . . 6.500 5.480 5.051 5.983 . 0 0 "[ . 1 . 2]" 1
156 1 9 G H1 1 22 C H41 . . 2.800 2.363 2.164 2.536 . 0 0 "[ . 1 . 2]" 1
157 1 9 G H1 1 22 C H42 . . 4.300 3.872 3.672 4.044 . 0 0 "[ . 1 . 2]" 1
158 1 9 G H1 1 23 C H42 . . 5.700 4.755 3.586 5.549 . 0 0 "[ . 1 . 2]" 1
159 1 9 G H8 1 10 U H5 . . 5.700 4.137 3.950 4.497 . 0 0 "[ . 1 . 2]" 1
160 1 10 U H3' 1 10 U H4' . . 3.500 3.032 3.010 3.045 . 0 0 "[ . 1 . 2]" 1
161 1 10 U H2' 1 10 U H4' . . 4.300 3.762 3.712 3.805 . 0 0 "[ . 1 . 2]" 1
162 1 10 U H1' 1 10 U H4' . . 4.300 3.241 3.037 3.330 . 0 0 "[ . 1 . 2]" 1
163 1 10 U H4' 1 10 U H6 . . 4.300 4.169 4.073 4.341 0.041 16 0 "[ . 1 . 2]" 1
164 1 10 U H2' 1 10 U H3' . . 2.800 2.406 2.357 2.438 . 0 0 "[ . 1 . 2]" 1
165 1 10 U H1' 1 10 U H3' . . 4.300 3.832 3.763 3.869 . 0 0 "[ . 1 . 2]" 1
166 1 10 U H3' 1 10 U H5 . . 5.700 4.754 4.364 5.121 . 0 0 "[ . 1 . 2]" 1
167 1 10 U H3' 1 10 U H6 . . 2.800 2.535 2.247 2.850 0.050 16 0 "[ . 1 . 2]" 1
168 1 10 U H3' 1 11 C H5 . . 5.700 4.412 4.086 4.717 . 0 0 "[ . 1 . 2]" 1
169 1 10 U H3' 1 11 C H6 . . 4.300 3.848 3.441 4.141 . 0 0 "[ . 1 . 2]" 1
170 1 10 U H1' 1 10 U H2' . . 2.800 2.769 2.746 2.821 0.021 16 0 "[ . 1 . 2]" 1
171 1 10 U H2' 1 10 U H5 . . 6.500 5.311 4.974 5.517 . 0 0 "[ . 1 . 2]" 1
172 1 10 U H2' 1 10 U H6 . . 4.300 3.558 3.328 3.736 . 0 0 "[ . 1 . 2]" 1
173 1 10 U H2' 1 11 C H1' . . 4.300 3.812 3.477 4.317 0.017 16 0 "[ . 1 . 2]" 1
174 1 10 U H2' 1 11 C H5 . . 4.300 3.618 3.362 3.958 . 0 0 "[ . 1 . 2]" 1
175 1 10 U H2' 1 11 C H6 . . 4.300 2.378 2.069 2.659 . 0 0 "[ . 1 . 2]" 1
176 1 10 U H1' 1 10 U H3 . . 5.700 4.506 4.373 4.600 . 0 0 "[ . 1 . 2]" 1
177 1 10 U H1' 1 10 U H5 . . 5.700 5.332 5.258 5.418 . 0 0 "[ . 1 . 2]" 1
178 1 10 U H1' 1 10 U H6 . . 5.700 3.685 3.641 3.724 . 0 0 "[ . 1 . 2]" 1
179 1 10 U H1' 1 11 C H6 . . 5.700 4.951 4.566 5.330 . 0 0 "[ . 1 . 2]" 1
180 1 10 U H3 1 11 C H41 . . 4.300 3.405 3.128 3.879 . 0 0 "[ . 1 . 2]" 1
181 1 10 U H3 1 11 C H42 . . 4.300 3.769 3.412 4.212 . 0 0 "[ . 1 . 2]" 1
182 1 10 U H3 1 11 C H5 . . 5.700 4.654 4.251 5.099 . 0 0 "[ . 1 . 2]" 1
183 1 10 U H3 1 20 G H1 . . 4.300 4.084 3.657 4.356 0.056 10 0 "[ . 1 . 2]" 1
184 1 10 U H3 1 21 U H3 . . 4.300 3.200 2.785 3.846 . 0 0 "[ . 1 . 2]" 1
185 1 10 U H3 1 21 U H5 . . 5.700 4.586 4.452 4.772 . 0 0 "[ . 1 . 2]" 1
186 1 10 U H5 1 11 C H42 . . 5.700 4.455 4.010 4.889 . 0 0 "[ . 1 . 2]" 1
187 1 10 U H5 1 11 C H5 . . 5.700 4.576 3.907 5.068 . 0 0 "[ . 1 . 2]" 1
188 1 11 C H1' 1 11 C H4' . . 4.300 3.197 3.082 3.360 . 0 0 "[ . 1 . 2]" 1
189 1 11 C H4' 1 11 C H6 . . 4.300 4.217 4.162 4.285 . 0 0 "[ . 1 . 2]" 1
190 1 11 C H1' 1 11 C H6 . . 4.300 3.667 3.611 3.702 . 0 0 "[ . 1 . 2]" 1
191 1 11 C H1' 1 12 C H5 . . 5.700 5.625 5.193 5.754 0.054 8 0 "[ . 1 . 2]" 1
192 1 11 C H1' 1 12 C H6 . . 5.700 5.013 4.743 5.181 . 0 0 "[ . 1 . 2]" 1
193 1 11 C H41 1 20 G H1 . . 4.300 2.109 1.821 2.354 . 0 0 "[ . 1 . 2]" 1
194 1 11 C H42 1 20 G H1 . . 4.300 3.616 3.312 3.861 . 0 0 "[ . 1 . 2]" 1
195 1 11 C H5 1 12 C H5 . . 5.700 3.851 3.402 4.244 . 0 0 "[ . 1 . 2]" 1
196 1 12 C H4' 1 12 C Q5' . . 2.800 2.137 2.084 2.189 . 0 0 "[ . 1 . 2]" 1
197 1 12 C Q5' 1 12 C H6 . . 4.300 3.871 3.621 4.049 . 0 0 "[ . 1 . 2]" 1
198 1 12 C H4' 1 12 C H6 . . 5.700 4.336 4.178 4.432 . 0 0 "[ . 1 . 2]" 1
199 1 12 C H2' 1 12 C H3' . . 3.500 2.426 2.376 2.477 . 0 0 "[ . 1 . 2]" 1
200 1 12 C H1' 1 12 C H3' . . 4.300 3.853 3.802 3.904 . 0 0 "[ . 1 . 2]" 1
201 1 12 C H3' 1 12 C H5 . . 5.700 5.022 4.624 5.293 . 0 0 "[ . 1 . 2]" 1
202 1 12 C H3' 1 12 C H6 . . 4.300 3.046 2.640 3.292 . 0 0 "[ . 1 . 2]" 1
203 1 12 C H3' 1 13 U H5 . . 4.300 3.197 2.932 3.532 . 0 0 "[ . 1 . 2]" 1
204 1 12 C H3' 1 13 U H6 . . 4.300 2.898 2.696 3.056 . 0 0 "[ . 1 . 2]" 1
205 1 12 C H1' 1 12 C H2' . . 2.800 2.784 2.733 2.825 0.025 3 0 "[ . 1 . 2]" 1
206 1 12 C H2' 1 12 C H5 . . 5.700 5.337 5.106 5.558 . 0 0 "[ . 1 . 2]" 1
207 1 12 C H1' 1 12 C H5 . . 6.500 5.270 5.170 5.365 . 0 0 "[ . 1 . 2]" 1
208 1 12 C H1' 1 12 C H6 . . 4.300 3.600 3.542 3.682 . 0 0 "[ . 1 . 2]" 1
209 1 12 C H1' 1 13 U H6 . . 5.700 4.877 4.731 4.987 . 0 0 "[ . 1 . 2]" 1
210 1 12 C H41 1 13 U H3 . . 4.300 3.296 3.108 3.565 . 0 0 "[ . 1 . 2]" 1
211 1 12 C H41 1 18 U H3 . . 5.700 4.706 4.368 5.038 . 0 0 "[ . 1 . 2]" 1
212 1 12 C H41 1 19 G H1 . . 3.500 2.457 2.164 2.601 . 0 0 "[ . 1 . 2]" 1
213 1 12 C H42 1 13 U H3 . . 4.300 3.740 3.463 4.170 . 0 0 "[ . 1 . 2]" 1
214 1 12 C H42 1 18 U H3 . . 6.500 5.874 5.463 6.403 . 0 0 "[ . 1 . 2]" 1
215 1 12 C H42 1 19 G H1 . . 4.300 3.954 3.655 4.113 . 0 0 "[ . 1 . 2]" 1
216 1 12 C H5 1 13 U H5 . . 4.300 3.985 3.625 4.344 0.044 18 0 "[ . 1 . 2]" 1
217 1 12 C H6 1 13 U H5 . . 4.300 3.690 3.492 3.955 . 0 0 "[ . 1 . 2]" 1
218 1 13 U Q5' 1 13 U H6 . . 5.700 3.311 3.206 3.417 . 0 0 "[ . 1 . 2]" 1
219 1 13 U H3' 1 13 U H4' . . 3.500 3.046 3.032 3.058 . 0 0 "[ . 1 . 2]" 1
220 1 13 U H2' 1 13 U H4' . . 4.300 3.767 3.726 3.813 . 0 0 "[ . 1 . 2]" 1
221 1 13 U H1' 1 13 U H4' . . 4.300 3.404 3.345 3.464 . 0 0 "[ . 1 . 2]" 1
222 1 13 U H4' 1 13 U H6 . . 4.300 4.088 4.038 4.134 . 0 0 "[ . 1 . 2]" 1
223 1 13 U H4' 1 14 U H6 . . 6.500 6.010 5.742 6.178 . 0 0 "[ . 1 . 2]" 1
224 1 13 U H2' 1 13 U H3' . . 2.800 2.430 2.379 2.465 . 0 0 "[ . 1 . 2]" 1
225 1 13 U H1' 1 13 U H3' . . 4.300 3.772 3.751 3.803 . 0 0 "[ . 1 . 2]" 1
226 1 13 U H3 1 13 U H3' . . 5.700 5.753 5.732 5.763 0.063 12 0 "[ . 1 . 2]" 1
227 1 13 U H3' 1 13 U H5 . . 5.700 4.424 4.326 4.666 . 0 0 "[ . 1 . 2]" 1
228 1 13 U H3' 1 13 U H6 . . 2.800 2.520 2.395 2.807 0.007 9 0 "[ . 1 . 2]" 1
229 1 13 U H3' 1 14 U H5 . . 4.300 4.211 3.901 4.356 0.056 17 0 "[ . 1 . 2]" 1
230 1 13 U H3' 1 14 U H6 . . 4.300 3.565 3.338 3.768 . 0 0 "[ . 1 . 2]" 1
231 1 13 U H1' 1 13 U H2' . . 2.800 2.722 2.697 2.741 . 0 0 "[ . 1 . 2]" 1
232 1 13 U H2' 1 13 U H3 . . 5.700 4.624 4.566 4.698 . 0 0 "[ . 1 . 2]" 1
233 1 13 U H2' 1 13 U H5 . . 6.500 5.313 5.186 5.535 . 0 0 "[ . 1 . 2]" 1
234 1 13 U H2' 1 13 U H6 . . 4.300 3.809 3.721 3.956 . 0 0 "[ . 1 . 2]" 1
235 1 13 U H2' 1 14 U H5 . . 4.300 4.214 3.865 4.355 0.055 11 0 "[ . 1 . 2]" 1
236 1 13 U H2' 1 14 U H6 . . 2.800 2.587 2.239 2.794 . 0 0 "[ . 1 . 2]" 1
237 1 13 U H1' 1 13 U H3 . . 5.700 4.541 4.493 4.608 . 0 0 "[ . 1 . 2]" 1
238 1 13 U H1' 1 13 U H5 . . 6.500 5.357 5.289 5.402 . 0 0 "[ . 1 . 2]" 1
239 1 13 U H1' 1 13 U H6 . . 5.700 3.663 3.607 3.699 . 0 0 "[ . 1 . 2]" 1
240 1 13 U H1' 1 14 U H5 . . 6.500 6.040 5.757 6.296 . 0 0 "[ . 1 . 2]" 1
241 1 13 U H1' 1 14 U H6 . . 5.700 5.065 4.769 5.343 . 0 0 "[ . 1 . 2]" 1
242 1 13 U H1' 1 18 U H3 . . 5.700 4.167 4.043 4.411 . 0 0 "[ . 1 . 2]" 1
243 1 13 U H1' 1 19 G H21 . . 3.500 2.754 2.459 3.166 . 0 0 "[ . 1 . 2]" 1
244 1 13 U H1' 1 19 G H1 . . 4.300 3.673 3.456 3.971 . 0 0 "[ . 1 . 2]" 1
245 1 13 U H3 1 14 U H3 . . 4.300 4.197 3.911 4.353 0.053 3 0 "[ . 1 . 2]" 1
246 1 13 U H3 1 14 U H5 . . 5.700 4.262 3.838 4.639 . 0 0 "[ . 1 . 2]" 1
247 1 13 U H3 1 14 U H6 . . 5.700 4.670 4.342 5.062 . 0 0 "[ . 1 . 2]" 1
248 1 13 U H3 1 18 U H3 . . 3.500 2.781 2.540 2.942 . 0 0 "[ . 1 . 2]" 1
249 1 13 U H3 1 18 U H5 . . 5.700 4.431 4.302 4.547 . 0 0 "[ . 1 . 2]" 1
250 1 13 U H3 1 19 G H21 . . 6.500 5.387 5.088 5.602 . 0 0 "[ . 1 . 2]" 1
251 1 13 U H3 1 19 G H1 . . 4.300 3.810 3.549 4.016 . 0 0 "[ . 1 . 2]" 1
252 1 13 U H5 1 14 U H5 . . 5.700 3.975 3.370 4.612 . 0 0 "[ . 1 . 2]" 1
253 1 13 U H6 1 14 U H5 . . 5.700 4.490 4.008 4.905 . 0 0 "[ . 1 . 2]" 1
254 1 13 U H6 1 18 U H3 . . 6.500 6.173 5.986 6.238 . 0 0 "[ . 1 . 2]" 1
255 1 14 U H4' 1 14 U Q5' . . 2.800 2.186 2.155 2.219 . 0 0 "[ . 1 . 2]" 1
256 1 14 U Q5' 1 14 U H6 . . 4.300 3.641 3.546 3.763 . 0 0 "[ . 1 . 2]" 1
257 1 14 U H3' 1 14 U H4' . . 4.300 3.035 3.017 3.049 . 0 0 "[ . 1 . 2]" 1
258 1 14 U H2' 1 14 U H4' . . 4.300 3.753 3.714 3.818 . 0 0 "[ . 1 . 2]" 1
259 1 14 U H1' 1 14 U H4' . . 4.300 3.149 3.062 3.275 . 0 0 "[ . 1 . 2]" 1
260 1 14 U H4' 1 14 U H5 . . 6.500 6.557 6.540 6.571 0.071 5 0 "[ . 1 . 2]" 1
261 1 14 U H4' 1 14 U H6 . . 4.300 4.187 4.146 4.236 . 0 0 "[ . 1 . 2]" 1
262 1 14 U H3' 1 14 U HO2' . . 4.300 3.989 3.923 4.030 . 0 0 "[ . 1 . 2]" 1
263 1 14 U H1' 1 14 U H3' . . 4.300 3.848 3.821 3.869 . 0 0 "[ . 1 . 2]" 1
264 1 14 U H3' 1 14 U H5 . . 5.700 4.672 4.406 4.902 . 0 0 "[ . 1 . 2]" 1
265 1 14 U H3' 1 14 U H6 . . 3.500 2.700 2.473 2.999 . 0 0 "[ . 1 . 2]" 1
266 1 14 U H3' 1 16 A H8 . . 5.700 5.598 5.479 5.755 0.055 7 0 "[ . 1 . 2]" 1
267 1 14 U H2' 1 14 U HO2' . . 2.800 2.111 2.051 2.175 . 0 0 "[ . 1 . 2]" 1
268 1 14 U H2' 1 14 U H3 . . 6.500 4.730 4.594 4.946 . 0 0 "[ . 1 . 2]" 1
269 1 14 U H2' 1 14 U H6 . . 5.700 3.599 3.426 3.716 . 0 0 "[ . 1 . 2]" 1
270 1 14 U H2' 1 15 U H6 . . 5.700 3.948 3.539 4.397 . 0 0 "[ . 1 . 2]" 1
271 1 14 U H2' 1 16 A H3' . . 6.500 5.114 4.964 5.280 . 0 0 "[ . 1 . 2]" 1
272 1 14 U H2' 1 16 A H8 . . 4.300 3.224 3.095 3.410 . 0 0 "[ . 1 . 2]" 1
273 1 14 U H1' 1 14 U HO2' . . 2.800 2.564 2.405 2.671 . 0 0 "[ . 1 . 2]" 1
274 1 14 U H3 1 14 U HO2' . . 6.500 5.537 5.350 5.656 . 0 0 "[ . 1 . 2]" 1
275 1 14 U H6 1 14 U HO2' . . 5.700 5.174 5.082 5.270 . 0 0 "[ . 1 . 2]" 1
276 1 14 U HO2' 1 15 U H5 . . 4.300 3.846 3.320 4.347 0.047 16 0 "[ . 1 . 2]" 1
277 1 14 U HO2' 1 15 U H6 . . 4.300 3.173 2.823 3.600 . 0 0 "[ . 1 . 2]" 1
278 1 14 U HO2' 1 16 A H3' . . 6.500 5.170 5.023 5.327 . 0 0 "[ . 1 . 2]" 1
279 1 14 U HO2' 1 16 A H8 . . 4.300 2.983 2.904 3.223 . 0 0 "[ . 1 . 2]" 1
280 1 14 U HO2' 1 18 U H1' . . 4.300 3.785 3.331 4.093 . 0 0 "[ . 1 . 2]" 1
281 1 14 U HO2' 1 18 U H3 . . 5.700 5.716 5.500 5.763 0.063 14 0 "[ . 1 . 2]" 1
282 1 14 U H1' 1 14 U H3 . . 5.700 4.527 4.485 4.558 . 0 0 "[ . 1 . 2]" 1
283 1 14 U H1' 1 14 U H5 . . 6.500 5.353 5.280 5.410 . 0 0 "[ . 1 . 2]" 1
284 1 14 U H1' 1 14 U H6 . . 4.300 3.650 3.583 3.690 . 0 0 "[ . 1 . 2]" 1
285 1 14 U H1' 1 16 A H8 . . 4.300 3.983 3.755 4.285 . 0 0 "[ . 1 . 2]" 1
286 1 14 U H1' 1 18 U H1' . . 4.300 3.390 3.155 3.595 . 0 0 "[ . 1 . 2]" 1
287 1 14 U H1' 1 18 U H3 . . 4.300 3.238 2.994 3.387 . 0 0 "[ . 1 . 2]" 1
288 1 14 U H1' 1 18 U H6 . . 6.500 4.964 4.678 5.178 . 0 0 "[ . 1 . 2]" 1
289 1 14 U H3 1 16 A H3' . . 3.500 2.798 2.664 2.946 . 0 0 "[ . 1 . 2]" 1
290 1 14 U H3 1 16 A H1' . . 6.500 6.531 6.441 6.566 0.066 5 0 "[ . 1 . 2]" 1
291 1 14 U H3 1 16 A H8 . . 5.700 3.770 3.546 3.901 . 0 0 "[ . 1 . 2]" 1
292 1 14 U H3 1 18 U H1' . . 6.500 6.429 6.242 6.561 0.061 19 0 "[ . 1 . 2]" 1
293 1 14 U H3 1 18 U H3 . . 5.700 4.807 4.558 5.091 . 0 0 "[ . 1 . 2]" 1
294 1 14 U H3 1 18 U H5 . . 4.300 3.501 3.229 3.860 . 0 0 "[ . 1 . 2]" 1
295 1 14 U H3 1 18 U H6 . . 5.700 4.975 4.772 5.286 . 0 0 "[ . 1 . 2]" 1
296 1 14 U H5 1 18 U H3 . . 6.500 5.520 5.250 5.804 . 0 0 "[ . 1 . 2]" 1
297 1 14 U H6 1 18 U H3 . . 5.700 4.617 4.332 4.876 . 0 0 "[ . 1 . 2]" 1
298 1 15 U H1' 1 15 U Q5' . . 5.700 4.379 4.220 4.487 . 0 0 "[ . 1 . 2]" 1
299 1 15 U H3' 1 15 U H4' . . 4.300 3.005 2.971 3.023 . 0 0 "[ . 1 . 2]" 1
300 1 15 U H2' 1 15 U H4' . . 4.300 3.722 3.663 3.772 . 0 0 "[ . 1 . 2]" 1
301 1 15 U H1' 1 15 U H4' . . 4.300 3.152 2.998 3.344 . 0 0 "[ . 1 . 2]" 1
302 1 15 U H4' 1 15 U H5 . . 6.500 6.563 6.545 6.571 0.071 5 0 "[ . 1 . 2]" 1
303 1 15 U H4' 1 15 U H6 . . 4.300 4.244 4.163 4.322 0.022 1 0 "[ . 1 . 2]" 1
304 1 15 U H4' 1 16 A H8 . . 5.700 5.434 5.258 5.641 . 0 0 "[ . 1 . 2]" 1
305 1 15 U H2' 1 15 U H3' . . 2.800 2.410 2.379 2.461 . 0 0 "[ . 1 . 2]" 1
306 1 15 U H1' 1 15 U H3' . . 4.300 3.866 3.817 3.905 . 0 0 "[ . 1 . 2]" 1
307 1 15 U H3' 1 15 U H5 . . 5.700 5.047 4.714 5.356 . 0 0 "[ . 1 . 2]" 1
308 1 15 U H3' 1 15 U H6 . . 4.300 3.055 2.741 3.469 . 0 0 "[ . 1 . 2]" 1
309 1 15 U H3' 1 16 A H3' . . 6.500 4.510 4.298 4.703 . 0 0 "[ . 1 . 2]" 1
310 1 15 U H3' 1 16 A H8 . . 4.300 2.561 2.403 2.803 . 0 0 "[ . 1 . 2]" 1
311 1 15 U H1' 1 15 U H2' . . 2.800 2.784 2.736 2.818 0.018 2 0 "[ . 1 . 2]" 1
312 1 15 U H2' 1 15 U H5 . . 5.700 5.370 5.016 5.702 0.002 16 0 "[ . 1 . 2]" 1
313 1 15 U H2' 1 15 U H6 . . 4.300 3.835 3.527 4.206 . 0 0 "[ . 1 . 2]" 1
314 1 15 U H2' 1 16 A H3' . . 5.700 4.350 4.058 4.643 . 0 0 "[ . 1 . 2]" 1
315 1 15 U H2' 1 16 A H1' . . 4.300 4.090 3.710 4.358 0.058 19 0 "[ . 1 . 2]" 1
316 1 15 U H2' 1 16 A H8 . . 4.300 3.038 2.709 3.346 . 0 0 "[ . 1 . 2]" 1
317 1 15 U H1' 1 15 U H5 . . 5.700 5.235 5.061 5.376 . 0 0 "[ . 1 . 2]" 1
318 1 15 U H1' 1 15 U H6 . . 4.300 3.606 3.460 3.704 . 0 0 "[ . 1 . 2]" 1
319 1 15 U H1' 1 16 A H1' . . 6.500 6.229 5.619 6.564 0.064 20 0 "[ . 1 . 2]" 1
320 1 15 U H1' 1 16 A H8 . . 5.700 5.512 5.189 5.742 0.042 13 0 "[ . 1 . 2]" 1
321 1 15 U H6 1 16 A H8 . . 6.500 4.446 4.000 4.880 . 0 0 "[ . 1 . 2]" 1
322 1 16 A H3' 1 16 A Q5' . . 5.700 2.769 2.484 2.887 . 0 0 "[ . 1 . 2]" 1
323 1 16 A H2' 1 16 A H4' . . 4.300 3.820 3.674 3.872 . 0 0 "[ . 1 . 2]" 1
324 1 16 A H1' 1 16 A H4' . . 4.300 3.356 3.121 3.509 . 0 0 "[ . 1 . 2]" 1
325 1 16 A H4' 1 16 A H8 . . 5.700 4.345 4.142 4.578 . 0 0 "[ . 1 . 2]" 1
326 1 16 A H2' 1 16 A H3' . . 2.800 2.378 2.337 2.434 . 0 0 "[ . 1 . 2]" 1
327 1 16 A H1' 1 16 A H3' . . 4.300 3.826 3.764 3.871 . 0 0 "[ . 1 . 2]" 1
328 1 16 A H3' 1 16 A H8 . . 2.800 2.367 2.158 2.500 . 0 0 "[ . 1 . 2]" 1
329 1 16 A H3' 1 18 U H5 . . 6.500 3.929 3.677 4.174 . 0 0 "[ . 1 . 2]" 1
330 1 16 A H3' 1 18 U H6 . . 4.300 4.257 4.089 4.362 0.062 15 0 "[ . 1 . 2]" 1
331 1 16 A H2' 1 16 A HO2' . . 2.800 2.115 2.066 2.223 . 0 0 "[ . 1 . 2]" 1
332 1 16 A H1' 1 16 A H2' . . 2.800 2.768 2.706 2.824 0.024 20 0 "[ . 1 . 2]" 1
333 1 16 A H2 1 16 A H2' . . 6.500 5.643 5.503 5.935 . 0 0 "[ . 1 . 2]" 1
334 1 16 A H2' 1 16 A H8 . . 4.300 3.403 3.054 3.491 . 0 0 "[ . 1 . 2]" 1
335 1 16 A H2' 1 17 A H4' . . 5.700 3.275 2.666 3.830 . 0 0 "[ . 1 . 2]" 1
336 1 16 A H2' 1 18 U H5 . . 4.300 3.630 3.352 3.921 . 0 0 "[ . 1 . 2]" 1
337 1 16 A H2' 1 18 U H6 . . 3.500 2.779 2.615 3.076 . 0 0 "[ . 1 . 2]" 1
338 1 16 A H1' 1 16 A HO2' . . 4.300 2.748 2.455 2.941 . 0 0 "[ . 1 . 2]" 1
339 1 16 A H1' 1 16 A H2 . . 5.700 4.509 4.461 4.585 . 0 0 "[ . 1 . 2]" 1
340 1 16 A H1' 1 16 A H8 . . 4.300 3.880 3.851 3.912 . 0 0 "[ . 1 . 2]" 1
341 1 16 A H1' 1 18 U H6 . . 6.500 5.153 4.911 5.519 . 0 0 "[ . 1 . 2]" 1
342 1 16 A H2 1 18 U H4' . . 4.300 3.214 2.924 3.738 . 0 0 "[ . 1 . 2]" 1
343 1 16 A H8 1 18 U H1' . . 5.700 4.941 4.476 5.187 . 0 0 "[ . 1 . 2]" 1
344 1 16 A H8 1 18 U H6 . . 6.500 4.729 4.410 4.876 . 0 0 "[ . 1 . 2]" 1
345 1 17 A H4' 1 17 A Q5' . . 4.300 2.458 2.392 2.569 . 0 0 "[ . 1 . 2]" 1
346 1 17 A H3' 1 17 A Q5' . . 5.700 2.437 2.086 2.693 . 0 0 "[ . 1 . 2]" 1
347 1 17 A H2' 1 17 A Q5' . . 4.300 2.303 2.182 2.597 . 0 0 "[ . 1 . 2]" 1
348 1 17 A H1' 1 17 A Q5' . . 6.500 3.889 3.827 4.026 . 0 0 "[ . 1 . 2]" 1
349 1 17 A Q5' 1 17 A H8 . . 4.300 2.307 2.069 2.666 . 0 0 "[ . 1 . 2]" 1
350 1 17 A Q5' 1 18 U H5 . . 4.300 2.741 2.141 3.700 . 0 0 "[ . 1 . 2]" 1
351 1 17 A Q5' 1 18 U H6 . . 6.500 4.051 3.789 4.460 . 0 0 "[ . 1 . 2]" 1
352 1 17 A H2' 1 17 A H4' . . 4.300 3.780 3.709 3.855 . 0 0 "[ . 1 . 2]" 1
353 1 17 A H1' 1 17 A H4' . . 4.300 3.557 3.372 3.680 . 0 0 "[ . 1 . 2]" 1
354 1 17 A H4' 1 17 A H8 . . 5.700 4.510 4.234 4.662 . 0 0 "[ . 1 . 2]" 1
355 1 17 A H4' 1 18 U H5 . . 2.800 2.400 2.170 2.741 . 0 0 "[ . 1 . 2]" 1
356 1 17 A H4' 1 18 U H6 . . 4.300 2.294 2.088 2.469 . 0 0 "[ . 1 . 2]" 1
357 1 17 A H2' 1 17 A H3' . . 4.300 2.375 2.317 2.408 . 0 0 "[ . 1 . 2]" 1
358 1 17 A H1' 1 17 A H3' . . 4.300 3.890 3.804 3.966 . 0 0 "[ . 1 . 2]" 1
359 1 17 A H3' 1 17 A H8 . . 5.700 4.612 4.263 4.986 . 0 0 "[ . 1 . 2]" 1
360 1 17 A H3' 1 18 U H5 . . 5.700 4.655 4.240 5.276 . 0 0 "[ . 1 . 2]" 1
361 1 17 A H3' 1 18 U H6 . . 5.700 4.365 4.078 4.738 . 0 0 "[ . 1 . 2]" 1
362 1 17 A H2' 1 17 A H8 . . 3.500 2.849 2.353 3.477 . 0 0 "[ . 1 . 2]" 1
363 1 17 A H2' 1 18 U H5 . . 6.500 5.480 5.283 5.825 . 0 0 "[ . 1 . 2]" 1
364 1 17 A H1' 1 17 A H2 . . 5.700 4.493 4.363 4.636 . 0 0 "[ . 1 . 2]" 1
365 1 17 A H1' 1 17 A H8 . . 4.300 3.889 3.773 3.953 . 0 0 "[ . 1 . 2]" 1
366 1 17 A H1' 1 18 U Q5' . . 6.500 5.823 5.383 6.116 . 0 0 "[ . 1 . 2]" 1
367 1 17 A H1' 1 18 U H5 . . 6.500 5.394 4.840 5.879 . 0 0 "[ . 1 . 2]" 1
368 1 17 A H8 1 18 U H5 . . 6.500 5.124 4.452 5.487 . 0 0 "[ . 1 . 2]" 1
369 1 18 U H4' 1 18 U Q5' . . 2.800 2.174 2.150 2.199 . 0 0 "[ . 1 . 2]" 1
370 1 18 U H2' 1 18 U H4' . . 4.300 3.760 3.709 3.802 . 0 0 "[ . 1 . 2]" 1
371 1 18 U H1' 1 18 U H4' . . 4.300 3.224 3.035 3.312 . 0 0 "[ . 1 . 2]" 1
372 1 18 U H4' 1 18 U H6 . . 5.700 4.207 4.097 4.371 . 0 0 "[ . 1 . 2]" 1
373 1 18 U H2' 1 18 U H3' . . 2.800 2.428 2.386 2.455 . 0 0 "[ . 1 . 2]" 1
374 1 18 U H1' 1 18 U H3' . . 5.700 3.859 3.822 3.897 . 0 0 "[ . 1 . 2]" 1
375 1 18 U H3' 1 18 U H5 . . 5.700 5.081 4.845 5.391 . 0 0 "[ . 1 . 2]" 1
376 1 18 U H3' 1 18 U H6 . . 4.300 3.122 2.772 3.336 . 0 0 "[ . 1 . 2]" 1
377 1 18 U H3' 1 19 G H8 . . 4.300 3.397 3.035 3.847 . 0 0 "[ . 1 . 2]" 1
378 1 18 U H1' 1 18 U H2' . . 4.300 2.785 2.758 2.827 . 0 0 "[ . 1 . 2]" 1
379 1 18 U H2' 1 18 U H5 . . 5.700 5.502 5.292 5.644 . 0 0 "[ . 1 . 2]" 1
380 1 18 U H2' 1 18 U H6 . . 4.300 3.967 3.682 4.162 . 0 0 "[ . 1 . 2]" 1
381 1 18 U H2' 1 19 G H1' . . 4.300 4.183 3.660 4.357 0.057 11 0 "[ . 1 . 2]" 1
382 1 18 U H2' 1 19 G H8 . . 2.800 2.421 2.117 2.835 0.035 16 0 "[ . 1 . 2]" 1
383 1 18 U H1' 1 18 U H3 . . 5.700 4.556 4.469 4.644 . 0 0 "[ . 1 . 2]" 1
384 1 18 U H1' 1 18 U H6 . . 4.300 3.548 3.501 3.628 . 0 0 "[ . 1 . 2]" 1
385 1 18 U H1' 1 19 G H8 . . 5.700 5.105 4.783 5.591 . 0 0 "[ . 1 . 2]" 1
386 1 18 U H3 1 19 G H21 . . 6.500 5.272 4.701 5.615 . 0 0 "[ . 1 . 2]" 1
387 1 18 U H3 1 19 G H1 . . 5.700 4.131 3.756 4.398 . 0 0 "[ . 1 . 2]" 1
388 1 19 G H1' 1 19 G H4' . . 4.300 3.311 3.196 3.435 . 0 0 "[ . 1 . 2]" 1
389 1 19 G H4' 1 19 G H8 . . 5.700 4.328 4.204 4.459 . 0 0 "[ . 1 . 2]" 1
390 1 19 G H3' 1 19 G H8 . . 3.500 2.617 2.321 2.921 . 0 0 "[ . 1 . 2]" 1
391 1 19 G H3' 1 20 G H8 . . 4.300 3.692 3.499 3.881 . 0 0 "[ . 1 . 2]" 1
392 1 19 G H2' 1 19 G H8 . . 4.300 3.612 3.363 3.786 . 0 0 "[ . 1 . 2]" 1
393 1 19 G H2' 1 20 G Q5' . . 6.500 3.235 2.866 3.589 . 0 0 "[ . 1 . 2]" 1
394 1 19 G H2' 1 20 G H4' . . 5.700 3.935 3.807 4.137 . 0 0 "[ . 1 . 2]" 1
395 1 19 G H2' 1 20 G H1' . . 4.300 3.675 3.465 3.838 . 0 0 "[ . 1 . 2]" 1
396 1 19 G H2' 1 20 G H8 . . 4.300 2.755 2.740 2.813 . 0 0 "[ . 1 . 2]" 1
397 1 19 G H1' 1 19 G H8 . . 4.300 3.823 3.758 3.889 . 0 0 "[ . 1 . 2]" 1
398 1 19 G H1' 1 20 G H1' . . 5.700 4.897 4.662 5.158 . 0 0 "[ . 1 . 2]" 1
399 1 19 G H1' 1 20 G H8 . . 5.700 5.304 5.143 5.390 . 0 0 "[ . 1 . 2]" 1
400 1 20 G H4' 1 20 G Q5' . . 4.300 2.126 2.099 2.148 . 0 0 "[ . 1 . 2]" 1
401 1 20 G Q5' 1 20 G H8 . . 4.300 3.843 3.748 4.008 . 0 0 "[ . 1 . 2]" 1
402 1 20 G H3' 1 20 G H4' . . 4.300 3.009 2.994 3.025 . 0 0 "[ . 1 . 2]" 1
403 1 20 G H2' 1 20 G H4' . . 4.300 3.715 3.678 3.753 . 0 0 "[ . 1 . 2]" 1
404 1 20 G H1' 1 20 G H4' . . 4.300 3.237 3.065 3.358 . 0 0 "[ . 1 . 2]" 1
405 1 20 G H4' 1 20 G H8 . . 4.300 4.366 4.356 4.374 0.074 3 0 "[ . 1 . 2]" 1
406 1 20 G H2' 1 20 G H3' . . 2.800 2.432 2.393 2.478 . 0 0 "[ . 1 . 2]" 1
407 1 20 G H1' 1 20 G H3' . . 4.300 3.860 3.808 3.910 . 0 0 "[ . 1 . 2]" 1
408 1 20 G H3' 1 20 G H8 . . 4.300 2.913 2.636 3.156 . 0 0 "[ . 1 . 2]" 1
409 1 20 G H3' 1 21 U H5 . . 5.700 4.970 4.727 5.239 . 0 0 "[ . 1 . 2]" 1
410 1 20 G H3' 1 21 U H6 . . 5.700 4.223 3.985 4.406 . 0 0 "[ . 1 . 2]" 1
411 1 20 G H1' 1 20 G H2' . . 3.500 2.791 2.749 2.857 . 0 0 "[ . 1 . 2]" 1
412 1 20 G H2' 1 20 G H8 . . 4.300 3.847 3.603 3.976 . 0 0 "[ . 1 . 2]" 1
413 1 20 G H2' 1 21 U H5 . . 4.300 3.911 3.524 4.299 . 0 0 "[ . 1 . 2]" 1
414 1 20 G H2' 1 21 U H6 . . 2.800 2.611 2.301 2.846 0.046 8 0 "[ . 1 . 2]" 1
415 1 20 G H1' 1 20 G H8 . . 4.300 3.724 3.651 3.800 . 0 0 "[ . 1 . 2]" 1
416 1 20 G H1' 1 21 U H6 . . 5.700 5.110 4.703 5.513 . 0 0 "[ . 1 . 2]" 1
417 1 20 G H1 1 21 U H3 . . 5.700 3.977 3.412 4.323 . 0 0 "[ . 1 . 2]" 1
418 1 20 G H1 1 21 U H5 . . 5.700 4.335 3.821 5.026 . 0 0 "[ . 1 . 2]" 1
419 1 20 G H8 1 21 U H5 . . 6.500 5.147 4.682 5.581 . 0 0 "[ . 1 . 2]" 1
420 1 21 U H3' 1 21 U H4' . . 4.300 3.031 3.002 3.046 . 0 0 "[ . 1 . 2]" 1
421 1 21 U H1' 1 21 U H4' . . 4.300 3.032 2.865 3.137 . 0 0 "[ . 1 . 2]" 1
422 1 21 U H1' 1 21 U H3' . . 4.300 3.876 3.853 3.906 . 0 0 "[ . 1 . 2]" 1
423 1 21 U H3' 1 21 U H5 . . 5.700 4.957 4.663 5.207 . 0 0 "[ . 1 . 2]" 1
424 1 21 U H3' 1 21 U H6 . . 4.300 2.967 2.607 3.237 . 0 0 "[ . 1 . 2]" 1
425 1 21 U H3' 1 22 C H5 . . 4.300 3.506 3.150 3.849 . 0 0 "[ . 1 . 2]" 1
426 1 21 U H3' 1 22 C H6 . . 4.300 3.034 2.731 3.247 . 0 0 "[ . 1 . 2]" 1
427 1 21 U H2' 1 21 U H5 . . 6.500 5.242 4.935 5.446 . 0 0 "[ . 1 . 2]" 1
428 1 21 U H2' 1 21 U H6 . . 4.300 3.725 3.405 3.934 . 0 0 "[ . 1 . 2]" 1
429 1 21 U H2' 1 22 C H6 . . 3.500 2.669 2.381 3.238 . 0 0 "[ . 1 . 2]" 1
430 1 21 U H1' 1 21 U H6 . . 5.700 3.612 3.556 3.688 . 0 0 "[ . 1 . 2]" 1
431 1 21 U H1' 1 22 C H6 . . 5.700 5.303 4.928 5.709 0.009 11 0 "[ . 1 . 2]" 1
432 1 21 U H5 1 22 C H41 . . 5.700 4.080 3.804 4.493 . 0 0 "[ . 1 . 2]" 1
433 1 21 U H5 1 22 C H5 . . 5.700 3.874 3.428 4.316 . 0 0 "[ . 1 . 2]" 1
434 1 21 U H6 1 22 C H5 . . 5.700 3.695 3.329 3.956 . 0 0 "[ . 1 . 2]" 1
435 1 21 U H6 1 22 C H6 . . 6.500 4.512 4.090 4.846 . 0 0 "[ . 1 . 2]" 1
436 1 22 C H2' 1 22 C H4' . . 5.700 3.762 3.713 3.809 . 0 0 "[ . 1 . 2]" 1
437 1 22 C H1' 1 22 C H4' . . 4.300 3.201 3.104 3.327 . 0 0 "[ . 1 . 2]" 1
438 1 22 C H4' 1 22 C H5 . . 6.500 6.555 6.488 6.568 0.068 19 0 "[ . 1 . 2]" 1
439 1 22 C H4' 1 22 C H6 . . 4.300 4.202 4.120 4.252 . 0 0 "[ . 1 . 2]" 1
440 1 22 C H1' 1 22 C H3' . . 4.300 3.844 3.772 3.887 . 0 0 "[ . 1 . 2]" 1
441 1 22 C H3' 1 22 C H5 . . 5.700 4.779 4.512 4.960 . 0 0 "[ . 1 . 2]" 1
442 1 22 C H3' 1 22 C H6 . . 2.800 2.725 2.429 2.847 0.047 13 0 "[ . 1 . 2]" 1
443 1 22 C H3' 1 23 C H5 . . 4.300 4.067 3.776 4.348 0.048 7 0 "[ . 1 . 2]" 1
444 1 22 C H1' 1 22 C H2' . . 4.300 2.785 2.755 2.811 . 0 0 "[ . 1 . 2]" 1
445 1 22 C H2' 1 22 C H5 . . 6.500 5.228 4.895 5.461 . 0 0 "[ . 1 . 2]" 1
446 1 22 C H2' 1 22 C H6 . . 4.300 3.655 3.449 3.911 . 0 0 "[ . 1 . 2]" 1
447 1 22 C H2' 1 23 C H5 . . 4.300 3.836 3.284 4.339 0.039 4 0 "[ . 1 . 2]" 1
448 1 22 C H2' 1 23 C H6 . . 3.500 2.459 2.147 2.828 . 0 0 "[ . 1 . 2]" 1
449 1 22 C H1' 1 22 C H5 . . 6.500 5.310 5.225 5.388 . 0 0 "[ . 1 . 2]" 1
450 1 22 C H1' 1 22 C H6 . . 4.300 3.662 3.599 3.712 . 0 0 "[ . 1 . 2]" 1
451 1 22 C H42 1 23 C H41 . . 5.700 3.427 3.062 3.923 . 0 0 "[ . 1 . 2]" 1
452 1 22 C H6 1 23 C H5 . . 4.300 3.915 3.639 4.330 0.030 10 0 "[ . 1 . 2]" 1
453 1 23 C H1' 1 23 C Q5' . . 5.700 4.326 4.274 4.445 . 0 0 "[ . 1 . 2]" 1
454 1 23 C H5 1 23 C Q5' . . 6.500 5.706 5.490 5.883 . 0 0 "[ . 1 . 2]" 1
455 1 23 C Q5' 1 23 C H6 . . 6.500 3.712 3.498 3.866 . 0 0 "[ . 1 . 2]" 1
456 1 23 C H1' 1 23 C H4' . . 4.300 3.153 3.070 3.297 . 0 0 "[ . 1 . 2]" 1
457 1 23 C H4' 1 23 C H5 . . 6.500 6.555 6.528 6.569 0.069 7 0 "[ . 1 . 2]" 1
458 1 23 C H4' 1 23 C H6 . . 4.300 4.206 4.159 4.259 . 0 0 "[ . 1 . 2]" 1
459 1 23 C H2' 1 23 C H3' . . 4.300 2.424 2.348 2.475 . 0 0 "[ . 1 . 2]" 1
460 1 23 C H1' 1 23 C H3' . . 4.300 3.849 3.818 3.879 . 0 0 "[ . 1 . 2]" 1
461 1 23 C H3' 1 23 C H5 . . 5.700 4.673 4.406 5.005 . 0 0 "[ . 1 . 2]" 1
462 1 23 C H3' 1 23 C H6 . . 2.800 2.616 2.406 2.827 0.027 19 0 "[ . 1 . 2]" 1
463 1 23 C H3' 1 24 A H8 . . 5.700 3.535 3.294 4.015 . 0 0 "[ . 1 . 2]" 1
464 1 23 C H1' 1 23 C H2' . . 4.300 2.784 2.747 2.831 . 0 0 "[ . 1 . 2]" 1
465 1 23 C H2' 1 23 C H5 . . 6.500 5.135 4.846 5.473 . 0 0 "[ . 1 . 2]" 1
466 1 23 C H2' 1 23 C H6 . . 5.700 3.571 3.317 3.789 . 0 0 "[ . 1 . 2]" 1
467 1 23 C H2' 1 24 A H1' . . 4.300 3.892 3.609 4.265 . 0 0 "[ . 1 . 2]" 1
468 1 23 C H2' 1 24 A H8 . . 2.800 2.432 2.195 2.816 0.016 6 0 "[ . 1 . 2]" 1
469 1 23 C H1' 1 23 C H5 . . 5.700 5.332 5.260 5.416 . 0 0 "[ . 1 . 2]" 1
470 1 23 C H1' 1 24 A H8 . . 5.700 5.141 4.886 5.616 . 0 0 "[ . 1 . 2]" 1
471 1 24 A H2' 1 24 A Q5' . . 5.700 4.565 4.496 4.634 . 0 0 "[ . 1 . 2]" 1
472 1 24 A H1' 1 24 A Q5' . . 5.700 4.426 4.364 4.468 . 0 0 "[ . 1 . 2]" 1
473 1 24 A Q5' 1 24 A H8 . . 6.500 3.645 3.488 3.890 . 0 0 "[ . 1 . 2]" 1
474 1 24 A H1' 1 24 A H4' . . 4.300 3.386 3.222 3.535 . 0 0 "[ . 1 . 2]" 1
475 1 24 A H4' 1 24 A H8 . . 5.700 4.375 4.288 4.485 . 0 0 "[ . 1 . 2]" 1
476 1 24 A H3' 1 24 A H8 . . 4.300 2.748 2.440 3.029 . 0 0 "[ . 1 . 2]" 1
477 1 24 A H3' 1 25 G H8 . . 4.300 3.327 3.073 3.739 . 0 0 "[ . 1 . 2]" 1
478 1 24 A H2' 1 24 A H8 . . 5.700 3.839 3.672 4.037 . 0 0 "[ . 1 . 2]" 1
479 1 24 A H2' 1 25 G H1' . . 5.700 4.034 3.765 4.280 . 0 0 "[ . 1 . 2]" 1
480 1 24 A H2' 1 25 G H8 . . 2.800 2.204 2.069 2.476 . 0 0 "[ . 1 . 2]" 1
481 1 24 A H1' 1 24 A H2 . . 5.700 4.526 4.384 4.637 . 0 0 "[ . 1 . 2]" 1
482 1 24 A H1' 1 24 A H8 . . 5.700 3.826 3.764 3.888 . 0 0 "[ . 1 . 2]" 1
483 1 24 A H2 1 25 G H1' . . 4.300 3.960 3.417 4.350 0.050 17 0 "[ . 1 . 2]" 1
484 1 25 G H3' 1 25 G Q5' . . 4.300 2.830 2.658 2.943 . 0 0 "[ . 1 . 2]" 1
485 1 25 G Q5' 1 25 G H8 . . 4.300 3.654 3.532 3.779 . 0 0 "[ . 1 . 2]" 1
486 1 25 G H3' 1 25 G H4' . . 4.300 3.025 3.007 3.042 . 0 0 "[ . 1 . 2]" 1
487 1 25 G H2' 1 25 G H4' . . 5.700 3.750 3.700 3.824 . 0 0 "[ . 1 . 2]" 1
488 1 25 G H1' 1 25 G H4' . . 4.300 3.337 3.198 3.434 . 0 0 "[ . 1 . 2]" 1
489 1 25 G H4' 1 25 G H8 . . 4.300 4.340 4.291 4.367 0.067 12 0 "[ . 1 . 2]" 1
490 1 25 G H4' 1 26 U H6 . . 6.500 5.527 5.274 5.997 . 0 0 "[ . 1 . 2]" 1
491 1 25 G H2' 1 25 G H3' . . 2.800 2.422 2.354 2.457 . 0 0 "[ . 1 . 2]" 1
492 1 25 G H1' 1 25 G H3' . . 4.300 3.832 3.772 3.870 . 0 0 "[ . 1 . 2]" 1
493 1 25 G H3' 1 25 G H8 . . 4.300 2.791 2.549 3.174 . 0 0 "[ . 1 . 2]" 1
494 1 25 G H3' 1 26 U H5 . . 4.300 3.357 2.933 3.722 . 0 0 "[ . 1 . 2]" 1
495 1 25 G H3' 1 26 U H6 . . 4.300 2.998 2.600 3.450 . 0 0 "[ . 1 . 2]" 1
496 1 25 G H1' 1 25 G H2' . . 2.800 2.748 2.701 2.795 . 0 0 "[ . 1 . 2]" 1
497 1 25 G H2' 1 25 G H8 . . 4.300 3.861 3.560 4.132 . 0 0 "[ . 1 . 2]" 1
498 1 25 G H2' 1 26 U H5 . . 4.300 3.959 3.653 4.346 0.046 3 0 "[ . 1 . 2]" 1
499 1 25 G H2' 1 26 U H6 . . 2.800 2.370 2.136 2.838 0.038 7 0 "[ . 1 . 2]" 1
500 1 25 G H1' 1 25 G H8 . . 5.700 3.785 3.721 3.844 . 0 0 "[ . 1 . 2]" 1
501 1 25 G H1' 1 26 U H6 . . 5.700 4.960 4.784 5.467 . 0 0 "[ . 1 . 2]" 1
502 1 25 G H21 1 26 U H3 . . 6.500 5.031 4.475 5.552 . 0 0 "[ . 1 . 2]" 1
503 1 25 G H1 1 26 U H2' . . 6.500 6.527 6.359 6.563 0.063 7 0 "[ . 1 . 2]" 1
504 1 25 G H1 1 26 U H3 . . 4.300 3.566 3.240 3.813 . 0 0 "[ . 1 . 2]" 1
505 1 25 G H8 1 26 U H5 . . 5.700 3.652 3.326 4.368 . 0 0 "[ . 1 . 2]" 1
506 1 25 G H8 1 26 U H6 . . 5.700 4.514 4.111 5.060 . 0 0 "[ . 1 . 2]" 1
507 1 26 U H3' 1 26 U H4' . . 4.300 3.023 3.007 3.043 . 0 0 "[ . 1 . 2]" 1
508 1 26 U H1' 1 26 U H4' . . 4.300 3.314 3.149 3.385 . 0 0 "[ . 1 . 2]" 1
509 1 26 U H4' 1 26 U H6 . . 4.300 4.113 4.029 4.164 . 0 0 "[ . 1 . 2]" 1
510 1 26 U H4' 1 27 C H6 . . 5.700 5.727 5.538 5.764 0.064 6 0 "[ . 1 . 2]" 1
511 1 26 U H2' 1 26 U H3' . . 2.800 2.413 2.359 2.448 . 0 0 "[ . 1 . 2]" 1
512 1 26 U H1' 1 26 U H3' . . 4.300 3.807 3.742 3.849 . 0 0 "[ . 1 . 2]" 1
513 1 26 U H3 1 26 U H3' . . 6.500 5.998 5.789 6.179 . 0 0 "[ . 1 . 2]" 1
514 1 26 U H3' 1 26 U H6 . . 2.800 2.479 2.241 2.814 0.014 9 0 "[ . 1 . 2]" 1
515 1 26 U H3' 1 27 C H5 . . 5.700 4.053 3.588 4.568 . 0 0 "[ . 1 . 2]" 1
516 1 26 U H3' 1 27 C H6 . . 4.300 3.599 3.353 3.809 . 0 0 "[ . 1 . 2]" 1
517 1 26 U H1' 1 26 U H2' . . 2.800 2.751 2.728 2.797 . 0 0 "[ . 1 . 2]" 1
518 1 26 U H2' 1 26 U H3 . . 6.500 4.745 4.479 4.871 . 0 0 "[ . 1 . 2]" 1
519 1 26 U H2' 1 26 U H6 . . 4.300 3.626 3.415 3.837 . 0 0 "[ . 1 . 2]" 1
520 1 26 U H2' 1 27 C H5 . . 4.300 3.435 2.876 4.045 . 0 0 "[ . 1 . 2]" 1
521 1 26 U H2' 1 27 C H6 . . 2.800 2.159 2.070 2.323 . 0 0 "[ . 1 . 2]" 1
522 1 26 U H1' 1 26 U H6 . . 4.300 3.691 3.637 3.734 . 0 0 "[ . 1 . 2]" 1
523 1 26 U H1' 1 27 C H6 . . 5.700 4.721 4.563 4.929 . 0 0 "[ . 1 . 2]" 1
524 1 26 U H3 1 27 C H41 . . 5.700 3.426 3.018 3.807 . 0 0 "[ . 1 . 2]" 1
525 1 26 U H3 1 27 C H42 . . 5.700 3.165 2.733 4.156 . 0 0 "[ . 1 . 2]" 1
526 1 26 U H3 1 27 C H5 . . 6.500 3.785 3.372 4.504 . 0 0 "[ . 1 . 2]" 1
527 1 26 U H3 1 27 C H6 . . 6.500 4.944 4.487 5.463 . 0 0 "[ . 1 . 2]" 1
528 1 26 U H5 1 27 C H5 . . 5.700 3.685 3.240 4.254 . 0 0 "[ . 1 . 2]" 1
529 1 27 C H1' 1 27 C H5' . . 5.700 5.178 4.654 5.329 . 0 0 "[ . 1 . 2]" 1
530 1 27 C H4' 1 27 C Q5' . . 2.800 2.297 2.158 2.402 . 0 0 "[ . 1 . 2]" 1
531 1 27 C H3' 1 27 C Q5' . . 4.300 2.342 2.112 2.918 . 0 0 "[ . 1 . 2]" 1
532 1 27 C H1' 1 27 C Q5' . . 5.700 4.343 4.242 4.438 . 0 0 "[ . 1 . 2]" 1
533 1 27 C H1' 1 27 C H4' . . 4.300 3.522 3.170 3.716 . 0 0 "[ . 1 . 2]" 1
534 1 27 C H4' 1 27 C H6 . . 4.300 4.026 3.920 4.193 . 0 0 "[ . 1 . 2]" 1
535 1 27 C H1' 1 27 C H3' . . 4.300 3.786 3.715 3.870 . 0 0 "[ . 1 . 2]" 1
536 1 27 C H3' 1 27 C H5 . . 5.700 4.623 4.141 5.163 . 0 0 "[ . 1 . 2]" 1
537 1 27 C H3' 1 27 C H6 . . 4.300 2.922 2.533 3.324 . 0 0 "[ . 1 . 2]" 1
538 1 27 C H2' 1 27 C H5 . . 5.700 5.452 5.009 5.756 0.056 11 0 "[ . 1 . 2]" 1
539 1 27 C H2' 1 27 C H6 . . 4.300 4.035 3.555 4.301 0.001 4 0 "[ . 1 . 2]" 1
540 1 27 C H1' 1 27 C H5 . . 6.500 5.293 5.127 5.397 . 0 0 "[ . 1 . 2]" 1
541 1 27 C H1' 1 27 C H6 . . 4.300 3.587 3.484 3.683 . 0 0 "[ . 1 . 2]" 1
542 1 1 G H1 1 1 G H2' . . 6.500 5.738 5.447 6.188 . 0 0 "[ . 1 . 2]" 1
543 1 1 G H1 1 1 G H1' . . 6.500 6.150 5.932 6.337 . 0 0 "[ . 1 . 2]" 1
544 1 1 G H1 1 2 G Q2 . . 6.500 5.315 4.816 5.844 . 0 0 "[ . 1 . 2]" 1
545 1 1 G H1 1 2 G H8 . . 6.500 5.344 4.878 5.964 . 0 0 "[ . 1 . 2]" 1
546 1 1 G H1 1 27 C H1' . . 6.500 5.169 4.885 5.436 . 0 0 "[ . 1 . 2]" 1
547 1 1 G H1 1 27 C H6 . . 6.500 5.697 5.494 5.786 . 0 0 "[ . 1 . 2]" 1
548 1 2 G H1 1 2 G H2' . . 6.500 5.979 5.807 6.207 . 0 0 "[ . 1 . 2]" 1
549 1 2 G H2' 1 3 C Q5' . . 6.500 2.893 2.483 3.967 . 0 0 "[ . 1 . 2]" 1
550 1 2 G H1 1 2 G H1' . . 6.500 5.983 5.902 6.122 . 0 0 "[ . 1 . 2]" 1
551 1 2 G Q2 1 26 U H3 . . 5.700 4.547 4.020 5.040 . 0 0 "[ . 1 . 2]" 1
552 1 2 G H1 1 3 C Q4 . . 5.700 4.202 3.751 4.665 . 0 0 "[ . 1 . 2]" 1
553 1 2 G H1 1 25 G H1 . . 4.300 3.604 3.218 4.053 . 0 0 "[ . 1 . 2]" 1
554 1 2 G H1 1 26 U H1' . . 6.500 4.116 3.986 4.316 . 0 0 "[ . 1 . 2]" 1
555 1 2 G H1 1 26 U H5 . . 6.500 6.215 5.912 6.545 0.045 4 0 "[ . 1 . 2]" 1
556 1 3 C H5 1 3 C Q5' . . 5.700 5.499 5.326 5.737 0.037 13 0 "[ . 1 . 2]" 1
557 1 3 C H3' 1 3 C H4' . . 4.300 3.027 3.005 3.051 . 0 0 "[ . 1 . 2]" 1
558 1 3 C H2' 1 3 C H4' . . 4.300 3.771 3.704 3.836 . 0 0 "[ . 1 . 2]" 1
559 1 3 C H4' 1 3 C H5 . . 6.500 6.546 6.522 6.565 0.065 13 0 "[ . 1 . 2]" 1
560 1 3 C H1' 1 3 C H5 . . 5.700 5.337 5.286 5.407 . 0 0 "[ . 1 . 2]" 1
561 1 3 C H6 1 25 G H1 . . 6.500 5.739 5.693 5.785 . 0 0 "[ . 1 . 2]" 1
562 1 4 U H5 1 4 U Q5' . . 6.500 5.669 5.520 5.827 . 0 0 "[ . 1 . 2]" 1
563 1 4 U Q5' 1 4 U H6 . . 5.700 3.676 3.533 3.812 . 0 0 "[ . 1 . 2]" 1
564 1 4 U H4' 1 4 U H5 . . 6.500 6.561 6.548 6.571 0.071 13 0 "[ . 1 . 2]" 1
565 1 4 U H3 1 4 U H3' . . 6.500 6.207 6.050 6.369 . 0 0 "[ . 1 . 2]" 1
566 1 4 U H2' 1 4 U H3 . . 6.500 4.734 4.543 4.907 . 0 0 "[ . 1 . 2]" 1
567 1 4 U H2' 1 24 A H2 . . 6.500 5.440 5.006 5.751 . 0 0 "[ . 1 . 2]" 1
568 1 4 U H1' 1 4 U H5 . . 5.700 5.268 5.195 5.366 . 0 0 "[ . 1 . 2]" 1
569 1 4 U H3 1 5 G H1' . . 6.500 6.458 6.134 6.558 0.058 11 0 "[ . 1 . 2]" 1
570 1 4 U H3 1 5 G H8 . . 6.500 5.904 5.275 6.246 . 0 0 "[ . 1 . 2]" 1
571 1 4 U H3 1 23 C H41 . . 6.500 4.203 3.578 4.962 . 0 0 "[ . 1 . 2]" 1
572 1 4 U H3 1 23 C H42 . . 6.500 5.308 4.702 6.017 . 0 0 "[ . 1 . 2]" 1
573 1 4 U H3 1 24 A H61 . . 4.300 2.367 2.121 2.739 . 0 0 "[ . 1 . 2]" 1
574 1 4 U H3 1 24 A H62 . . 4.300 3.877 3.644 4.131 . 0 0 "[ . 1 . 2]" 1
575 1 4 U H3 1 25 G Q2 . . 5.700 4.040 3.543 4.507 . 0 0 "[ . 1 . 2]" 1
576 1 4 U H3 1 25 G H1 . . 4.300 3.662 3.361 4.187 . 0 0 "[ . 1 . 2]" 1
577 1 5 G Q5' 1 6 C H6 . . 5.700 4.792 3.969 5.760 0.060 11 0 "[ . 1 . 2]" 1
578 1 5 G H3' 1 6 C H6 . . 4.300 2.998 2.489 3.748 . 0 0 "[ . 1 . 2]" 1
579 1 5 G H1 1 5 G H1' . . 6.500 5.905 5.800 6.028 . 0 0 "[ . 1 . 2]" 1
580 1 5 G H1' 1 6 C H5 . . 6.500 5.277 4.829 5.602 . 0 0 "[ . 1 . 2]" 1
581 1 5 G H1' 1 6 C H6 . . 6.500 5.384 4.960 6.000 . 0 0 "[ . 1 . 2]" 1
582 1 5 G H1 1 22 C H41 . . 5.700 4.054 3.555 4.601 . 0 0 "[ . 1 . 2]" 1
583 1 5 G H1 1 23 C H1' . . 6.500 5.399 4.999 5.644 . 0 0 "[ . 1 . 2]" 1
584 1 6 C H4' 1 6 C H5 . . 6.500 6.356 5.974 6.574 0.074 6 0 "[ . 1 . 2]" 1
585 1 6 C H3' 1 6 C H5 . . 5.700 5.094 4.543 5.472 . 0 0 "[ . 1 . 2]" 1
586 1 6 C H6 1 9 G H8 . . 4.300 4.356 4.312 4.374 0.074 14 0 "[ . 1 . 2]" 1
587 1 7 U H4' 1 7 U H5 . . 6.500 6.480 6.335 6.565 0.065 10 0 "[ . 1 . 2]" 1
588 1 7 U H3' 1 7 U H5 . . 6.500 4.465 3.997 6.564 0.064 14 0 "[ . 1 . 2]" 1
589 1 9 G H5' 1 10 U H5 . . 6.500 5.225 4.754 5.626 . 0 0 "[ . 1 . 2]" 1
590 1 9 G H5'' 1 10 U H5 . . 5.700 4.907 4.467 5.458 . 0 0 "[ . 1 . 2]" 1
591 1 9 G H4' 1 10 U H5 . . 5.700 5.388 5.070 5.691 . 0 0 "[ . 1 . 2]" 1
592 1 9 G H4' 1 10 U H6 . . 5.700 5.513 5.137 5.733 0.033 14 0 "[ . 1 . 2]" 1
593 1 9 G H1 1 9 G H2' . . 6.500 5.647 5.461 5.787 . 0 0 "[ . 1 . 2]" 1
594 1 9 G H1 1 9 G H1' . . 6.500 6.311 6.142 6.420 . 0 0 "[ . 1 . 2]" 1
595 1 9 G H1 1 22 C H2' . . 5.700 5.532 5.077 5.755 0.055 9 0 "[ . 1 . 2]" 1
596 1 9 G H1 1 22 C H5 . . 5.700 5.000 4.885 5.102 . 0 0 "[ . 1 . 2]" 1
597 1 9 G H1 1 23 C H1' . . 5.700 5.377 4.986 5.757 0.057 6 0 "[ . 1 . 2]" 1
598 1 10 U H3 1 10 U H3' . . 6.500 6.325 6.011 6.547 0.047 16 0 "[ . 1 . 2]" 1
599 1 10 U H2' 1 10 U H3 . . 5.700 5.085 4.868 5.378 . 0 0 "[ . 1 . 2]" 1
600 1 10 U H3 1 10 U H6 . . 5.700 4.830 4.806 4.847 . 0 0 "[ . 1 . 2]" 1
601 1 10 U H3 1 11 C H6 . . 6.500 5.679 5.304 6.119 . 0 0 "[ . 1 . 2]" 1
602 1 10 U H3 1 20 G H21 . . 6.500 5.300 4.873 5.843 . 0 0 "[ . 1 . 2]" 1
603 1 10 U H3 1 22 C H41 . . 5.700 4.432 3.799 4.976 . 0 0 "[ . 1 . 2]" 1
604 1 10 U H3 1 22 C H42 . . 6.500 5.538 5.156 6.026 . 0 0 "[ . 1 . 2]" 1
605 1 10 U H5 1 11 C H41 . . 6.500 5.559 5.222 5.929 . 0 0 "[ . 1 . 2]" 1
606 1 10 U H6 1 11 C H5 . . 5.700 4.423 3.786 4.953 . 0 0 "[ . 1 . 2]" 1
607 1 11 C H4' 1 11 C H5 . . 6.500 6.559 6.537 6.571 0.071 8 0 "[ . 1 . 2]" 1
608 1 11 C H4' 1 12 C H6 . . 5.700 5.516 5.285 5.729 0.029 16 0 "[ . 1 . 2]" 1
609 1 11 C H3' 1 11 C H6 . . 4.300 2.812 2.741 3.038 . 0 0 "[ . 1 . 2]" 1
610 1 11 C H3' 1 12 C H6 . . 5.700 3.081 2.949 3.314 . 0 0 "[ . 1 . 2]" 1
611 1 11 C H2' 1 11 C H5 . . 5.700 5.200 4.974 5.409 . 0 0 "[ . 1 . 2]" 1
612 1 11 C H2' 1 11 C H6 . . 4.300 3.664 3.523 3.829 . 0 0 "[ . 1 . 2]" 1
613 1 11 C H2' 1 12 C H6 . . 2.800 2.307 2.143 2.498 . 0 0 "[ . 1 . 2]" 1
614 1 11 C H41 1 12 C H41 . . 4.300 3.594 3.226 3.839 . 0 0 "[ . 1 . 2]" 1
615 1 11 C H41 1 12 C H42 . . 4.300 3.617 2.865 4.094 . 0 0 "[ . 1 . 2]" 1
616 1 11 C H41 1 19 G H1 . . 5.700 5.118 4.683 5.416 . 0 0 "[ . 1 . 2]" 1
617 1 11 C H42 1 19 G H1 . . 6.500 6.178 5.792 6.466 . 0 0 "[ . 1 . 2]" 1
618 1 11 C Q4 1 20 G H21 . . 6.500 4.151 3.810 4.381 . 0 0 "[ . 1 . 2]" 1
619 1 11 C Q4 1 20 G H22 . . 6.500 5.445 5.146 5.679 . 0 0 "[ . 1 . 2]" 1
620 1 11 C H6 1 12 C H5 . . 4.300 3.939 3.565 4.239 . 0 0 "[ . 1 . 2]" 1
621 1 12 C H2' 1 12 C H6 . . 4.300 3.842 3.607 4.071 . 0 0 "[ . 1 . 2]" 1
622 1 12 C H2' 1 13 U H6 . . 4.300 2.214 2.112 2.313 . 0 0 "[ . 1 . 2]" 1
623 1 12 C H1' 1 19 G H21 . . 6.500 4.308 4.161 4.558 . 0 0 "[ . 1 . 2]" 1
624 1 12 C H41 1 19 G H21 . . 6.500 4.656 4.321 4.836 . 0 0 "[ . 1 . 2]" 1
625 1 12 C H41 1 20 G H1 . . 4.300 3.594 3.455 3.879 . 0 0 "[ . 1 . 2]" 1
626 1 12 C H42 1 20 G H1 . . 4.300 4.107 3.457 4.350 0.050 5 0 "[ . 1 . 2]" 1
627 1 12 C H5 1 13 U H6 . . 5.700 5.482 5.162 5.751 0.051 18 0 "[ . 1 . 2]" 1
628 1 12 C H5 1 19 G H1 . . 5.700 5.033 4.878 5.124 . 0 0 "[ . 1 . 2]" 1
629 1 12 C H5 1 20 G H1 . . 5.700 4.946 4.161 5.361 . 0 0 "[ . 1 . 2]" 1
630 1 13 U H4' 1 13 U H5 . . 6.500 6.483 6.414 6.531 0.031 9 0 "[ . 1 . 2]" 1
631 1 13 U H2' 1 19 G H21 . . 6.500 5.428 5.107 5.808 . 0 0 "[ . 1 . 2]" 1
632 1 13 U H3 1 18 U H6 . . 6.500 6.200 6.100 6.353 . 0 0 "[ . 1 . 2]" 1
633 1 13 U H5 1 18 U H3 . . 6.500 6.470 6.272 6.561 0.061 18 0 "[ . 1 . 2]" 1
634 1 13 U H5 1 19 G H1 . . 6.500 5.867 5.372 6.223 . 0 0 "[ . 1 . 2]" 1
635 1 13 U H6 1 19 G H21 . . 6.500 5.190 4.831 5.527 . 0 0 "[ . 1 . 2]" 1
636 1 14 U H3 1 14 U H3' . . 6.500 6.195 6.022 6.358 . 0 0 "[ . 1 . 2]" 1
637 1 14 U H2' 1 14 U H5 . . 5.700 5.083 4.904 5.235 . 0 0 "[ . 1 . 2]" 1
638 1 14 U H2' 1 16 A Q6 . . 4.300 4.329 3.804 4.374 0.074 6 0 "[ . 1 . 2]" 1
639 1 14 U HO2' 1 15 U H4' . . 5.700 5.767 5.759 5.775 0.075 12 0 "[ . 1 . 2]" 1
640 1 14 U HO2' 1 16 A Q6 . . 4.300 2.367 1.912 2.467 . 0 0 "[ . 1 . 2]" 1
641 1 14 U HO2' 1 18 U H4' . . 6.500 6.080 5.379 6.551 0.051 19 0 "[ . 1 . 2]" 1
642 1 14 U HO2' 1 18 U H5 . . 6.500 6.536 6.344 6.566 0.066 12 0 "[ . 1 . 2]" 1
643 1 14 U HO2' 1 18 U H6 . . 5.700 5.685 5.535 5.763 0.063 19 0 "[ . 1 . 2]" 1
644 1 14 U H1' 1 16 A Q6 . . 6.500 3.693 3.213 4.052 . 0 0 "[ . 1 . 2]" 1
645 1 14 U H3 1 17 A H4' . . 5.700 5.464 5.184 5.732 0.032 8 0 "[ . 1 . 2]" 1
646 1 15 U H5 1 15 U Q5' . . 6.500 5.768 5.648 5.909 . 0 0 "[ . 1 . 2]" 1
647 1 15 U Q5' 1 15 U H6 . . 5.700 3.784 3.689 3.899 . 0 0 "[ . 1 . 2]" 1
648 1 15 U H5 1 16 A Q6 . . 4.300 2.856 2.522 3.176 . 0 0 "[ . 1 . 2]" 1
649 1 15 U H6 1 16 A Q6 . . 5.700 3.846 3.496 4.073 . 0 0 "[ . 1 . 2]" 1
650 1 16 A H1' 1 16 A Q5' . . 5.700 4.409 4.355 4.485 . 0 0 "[ . 1 . 2]" 1
651 1 16 A Q5' 1 16 A H8 . . 5.700 3.629 3.407 4.143 . 0 0 "[ . 1 . 2]" 1
652 1 16 A H3' 1 16 A HO2' . . 5.700 3.963 3.887 4.071 . 0 0 "[ . 1 . 2]" 1
653 1 16 A H2' 1 17 A H2' . . 5.700 5.699 5.468 5.764 0.064 20 0 "[ . 1 . 2]" 1
654 1 16 A HO2' 1 17 A H3' . . 4.300 2.520 2.212 2.683 . 0 0 "[ . 1 . 2]" 1
655 1 16 A H1' 1 18 U H4' . . 6.500 5.837 5.539 6.238 . 0 0 "[ . 1 . 2]" 1
656 1 16 A H2 1 16 A Q6 . . 5.700 4.271 4.229 4.304 . 0 0 "[ . 1 . 2]" 1
657 1 16 A H2 1 18 U Q5' . . 4.300 2.789 2.582 3.025 . 0 0 "[ . 1 . 2]" 1
658 1 16 A Q6 1 16 A H8 . . 5.700 4.565 4.490 4.634 . 0 0 "[ . 1 . 2]" 1
659 1 16 A Q6 1 18 U Q5' . . 6.500 4.819 4.306 5.072 . 0 0 "[ . 1 . 2]" 1
660 1 16 A Q6 1 18 U H1' . . 4.300 2.686 2.476 2.879 . 0 0 "[ . 1 . 2]" 1
661 1 16 A Q6 1 18 U H3 . . 6.500 6.051 5.651 6.302 . 0 0 "[ . 1 . 2]" 1
662 1 17 A H2' 1 18 U H6 . . 6.500 5.945 5.811 6.195 . 0 0 "[ . 1 . 2]" 1
663 1 18 U H5 1 18 U Q5' . . 6.500 5.647 5.370 5.903 . 0 0 "[ . 1 . 2]" 1
664 1 18 U Q5' 1 18 U H6 . . 4.300 3.606 3.337 3.811 . 0 0 "[ . 1 . 2]" 1
665 1 18 U H4' 1 19 G H8 . . 6.500 5.774 5.502 6.158 . 0 0 "[ . 1 . 2]" 1
666 1 18 U H3 1 18 U H3' . . 6.500 6.152 5.815 6.428 . 0 0 "[ . 1 . 2]" 1
667 1 18 U H2' 1 18 U H3 . . 5.700 4.749 4.499 4.873 . 0 0 "[ . 1 . 2]" 1
668 1 18 U H1' 1 19 G H1' . . 6.500 5.800 5.163 6.229 . 0 0 "[ . 1 . 2]" 1
669 1 18 U H3 1 19 G H22 . . 6.500 5.553 5.005 6.004 . 0 0 "[ . 1 . 2]" 1
670 1 18 U H6 1 19 G H8 . . 6.500 5.242 4.812 5.743 . 0 0 "[ . 1 . 2]" 1
671 1 19 G Q5' 1 19 G H8 . . 5.700 3.673 3.509 3.861 . 0 0 "[ . 1 . 2]" 1
672 1 19 G H8 1 20 G H8 . . 6.500 4.648 4.237 4.996 . 0 0 "[ . 1 . 2]" 1
673 1 19 G H8 1 20 G H1' . . 6.500 6.543 6.329 6.569 0.069 2 0 "[ . 1 . 2]" 1
674 1 19 G H1 1 19 G H2' . . 6.500 6.245 6.150 6.450 . 0 0 "[ . 1 . 2]" 1
675 1 19 G H1' 1 19 G H21 . . 6.500 5.800 5.628 5.954 . 0 0 "[ . 1 . 2]" 1
676 1 19 G H1 1 19 G H1' . . 6.500 5.983 5.900 6.062 . 0 0 "[ . 1 . 2]" 1
677 1 19 G H22 1 20 G H1' . . 4.300 3.500 2.867 4.329 0.029 16 0 "[ . 1 . 2]" 1
678 1 19 G H1 1 20 G H8 . . 6.500 6.303 5.864 6.554 0.054 8 0 "[ . 1 . 2]" 1
679 1 20 G H1' 1 20 G Q5' . . 6.500 4.405 4.300 4.456 . 0 0 "[ . 1 . 2]" 1
680 1 20 G H2' 1 20 G H22 . . 6.500 4.732 4.316 5.086 . 0 0 "[ . 1 . 2]" 1
681 1 20 G H1' 1 20 G H21 . . 6.500 5.820 5.702 5.946 . 0 0 "[ . 1 . 2]" 1
682 1 20 G H1' 1 20 G H22 . . 6.500 4.598 4.387 4.794 . 0 0 "[ . 1 . 2]" 1
683 1 20 G H21 1 21 U H3 . . 6.500 3.609 2.820 4.230 . 0 0 "[ . 1 . 2]" 1
684 1 20 G H22 1 21 U H2' . . 6.500 6.066 5.178 6.546 0.046 19 0 "[ . 1 . 2]" 1
685 1 20 G H22 1 21 U H3 . . 6.500 4.618 3.794 5.250 . 0 0 "[ . 1 . 2]" 1
686 1 20 G H1 1 21 U H6 . . 6.500 5.505 5.162 6.082 . 0 0 "[ . 1 . 2]" 1
687 1 21 U H2' 1 21 U H4' . . 4.300 3.678 3.608 3.720 . 0 0 "[ . 1 . 2]" 1
688 1 21 U H4' 1 21 U H5 . . 6.500 6.572 6.564 6.579 0.079 15 0 "[ . 1 . 2]" 1
689 1 21 U H4' 1 21 U H6 . . 5.700 4.272 4.222 4.339 . 0 0 "[ . 1 . 2]" 1
690 1 21 U H4' 1 22 C H6 . . 5.700 5.670 5.407 5.761 0.061 20 0 "[ . 1 . 2]" 1
691 1 21 U H5 1 22 C H42 . . 5.700 3.463 3.443 3.654 . 0 0 "[ . 1 . 2]" 1
692 1 22 C H3' 1 22 C H4' . . 4.300 3.030 3.015 3.041 . 0 0 "[ . 1 . 2]" 1
693 1 22 C H2' 1 22 C H3' . . 2.800 2.407 2.365 2.457 . 0 0 "[ . 1 . 2]" 1
694 1 22 C H41 1 23 C H41 . . 5.700 3.179 2.863 3.427 . 0 0 "[ . 1 . 2]" 1
695 1 22 C H41 1 23 C H42 . . 4.300 3.490 2.903 4.022 . 0 0 "[ . 1 . 2]" 1
696 1 23 C H2' 1 23 C H4' . . 4.300 3.712 3.664 3.796 . 0 0 "[ . 1 . 2]" 1
697 1 23 C H5 1 24 A H8 . . 6.500 5.759 4.760 6.487 . 0 0 "[ . 1 . 2]" 1
698 1 24 A H2 1 24 A H2' . . 6.500 5.066 4.787 5.354 . 0 0 "[ . 1 . 2]" 1
699 1 24 A H1' 1 25 G H8 . . 5.700 4.775 4.606 5.102 . 0 0 "[ . 1 . 2]" 1
700 1 24 A H2 1 25 G H1 . . 5.700 5.225 4.580 5.740 0.040 3 0 "[ . 1 . 2]" 1
701 1 24 A H8 1 25 G H8 . . 5.700 4.701 4.186 5.225 . 0 0 "[ . 1 . 2]" 1
702 1 25 G H1' 1 25 G Q5' . . 5.700 4.407 4.326 4.469 . 0 0 "[ . 1 . 2]" 1
703 1 26 U H2' 1 26 U H4' . . 4.300 3.775 3.730 3.849 . 0 0 "[ . 1 . 2]" 1
704 1 26 U H4' 1 26 U H5 . . 6.500 6.493 6.401 6.550 0.050 8 0 "[ . 1 . 2]" 1
705 1 26 U H3' 1 26 U H5 . . 5.700 4.406 4.135 4.678 . 0 0 "[ . 1 . 2]" 1
706 1 26 U H2' 1 26 U H5 . . 5.700 5.095 4.817 5.358 . 0 0 "[ . 1 . 2]" 1
707 1 26 U H2' 1 27 C H3' . . 5.700 4.751 4.194 5.275 . 0 0 "[ . 1 . 2]" 1
708 1 26 U H2' 1 27 C H1' . . 5.700 4.291 3.820 4.745 . 0 0 "[ . 1 . 2]" 1
709 1 26 U H1' 1 26 U H3 . . 5.700 4.567 4.516 4.615 . 0 0 "[ . 1 . 2]" 1
710 1 26 U H1' 1 26 U H5 . . 5.700 5.401 5.352 5.439 . 0 0 "[ . 1 . 2]" 1
711 1 26 U H3 1 27 C H1' . . 6.500 5.869 5.244 6.535 0.035 14 0 "[ . 1 . 2]" 1
712 1 26 U H6 1 27 C H5 . . 6.500 4.068 3.573 4.318 . 0 0 "[ . 1 . 2]" 1
713 1 27 C Q5' 1 27 C H6 . . 5.700 2.489 2.057 3.658 . 0 0 "[ . 1 . 2]" 1
714 1 27 C H4' 1 27 C H5 . . 6.500 6.376 6.230 6.557 0.057 8 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 56
_Distance_constraint_stats_list.Viol_count 97
_Distance_constraint_stats_list.Viol_total 58.311
_Distance_constraint_stats_list.Viol_max 0.065
_Distance_constraint_stats_list.Viol_rms 0.0098
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0026
_Distance_constraint_stats_list.Viol_average_violations_only 0.0301
_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 0.320 0.054 6 0 "[ . 1 . 2]"
1 2 G 0.162 0.051 13 0 "[ . 1 . 2]"
1 3 C 0.396 0.054 12 0 "[ . 1 . 2]"
1 4 U 0.309 0.065 6 0 "[ . 1 . 2]"
1 5 G 0.406 0.060 6 0 "[ . 1 . 2]"
1 9 G 0.061 0.029 10 0 "[ . 1 . 2]"
1 10 U 0.346 0.059 16 0 "[ . 1 . 2]"
1 11 C 0.204 0.049 17 0 "[ . 1 . 2]"
1 12 C 0.174 0.050 9 0 "[ . 1 . 2]"
1 13 U 0.000 0.000 . 0 "[ . 1 . 2]"
1 14 U 0.539 0.058 11 0 "[ . 1 . 2]"
1 16 A 0.000 0.000 . 0 "[ . 1 . 2]"
1 17 A 0.539 0.058 11 0 "[ . 1 . 2]"
1 18 U 0.000 0.000 . 0 "[ . 1 . 2]"
1 19 G 0.174 0.050 9 0 "[ . 1 . 2]"
1 20 G 0.204 0.049 17 0 "[ . 1 . 2]"
1 21 U 0.346 0.059 16 0 "[ . 1 . 2]"
1 22 C 0.061 0.029 10 0 "[ . 1 . 2]"
1 23 C 0.406 0.060 6 0 "[ . 1 . 2]"
1 24 A 0.309 0.065 6 0 "[ . 1 . 2]"
1 25 G 0.396 0.054 12 0 "[ . 1 . 2]"
1 26 U 0.162 0.051 13 0 "[ . 1 . 2]"
1 27 C 0.320 0.054 6 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 G H21 1 27 C O2 . . 2.000 1.885 1.790 2.054 0.054 6 0 "[ . 1 . 2]" 2
2 1 1 G N2 1 27 C O2 . . 3.000 2.888 2.808 3.054 0.054 6 0 "[ . 1 . 2]" 2
3 1 1 G H1 1 27 C N3 . . 2.000 1.911 1.851 2.007 0.007 10 0 "[ . 1 . 2]" 2
4 1 1 G N1 1 27 C N3 . . 3.000 2.902 2.846 2.958 . 0 0 "[ . 1 . 2]" 2
5 1 1 G O6 1 27 C H41 . . 2.000 1.884 1.798 2.052 0.052 18 0 "[ . 1 . 2]" 2
6 1 1 G O6 1 27 C N4 . . 3.000 2.851 2.768 3.029 0.029 8 0 "[ . 1 . 2]" 2
7 1 2 G H1 1 26 U O2 . . 2.000 1.815 1.757 1.989 . 0 0 "[ . 1 . 2]" 2
8 1 2 G N1 1 26 U O2 . . 3.000 2.808 2.732 2.990 . 0 0 "[ . 1 . 2]" 2
9 1 2 G O6 1 26 U H3 . . 2.000 1.903 1.796 2.036 0.036 13 0 "[ . 1 . 2]" 2
10 1 2 G O6 1 26 U N3 . . 3.000 2.903 2.784 3.051 0.051 13 0 "[ . 1 . 2]" 2
11 1 3 C O2 1 25 G H21 . . 2.000 1.926 1.785 2.039 0.039 4 0 "[ . 1 . 2]" 2
12 1 3 C O2 1 25 G N2 . . 3.000 2.924 2.784 3.042 0.042 15 0 "[ . 1 . 2]" 2
13 1 3 C N3 1 25 G H1 . . 2.000 1.916 1.871 1.980 . 0 0 "[ . 1 . 2]" 2
14 1 3 C N3 1 25 G N1 . . 3.000 2.926 2.880 2.977 . 0 0 "[ . 1 . 2]" 2
15 1 3 C H41 1 25 G O6 . . 2.000 1.913 1.831 2.051 0.051 12 0 "[ . 1 . 2]" 2
16 1 3 C N4 1 25 G O6 . . 3.000 2.924 2.848 3.054 0.054 12 0 "[ . 1 . 2]" 2
17 1 4 U H3 1 24 A N1 . . 2.000 1.926 1.844 2.023 0.023 5 0 "[ . 1 . 2]" 2
18 1 4 U N3 1 24 A N1 . . 3.000 2.926 2.843 3.038 0.038 5 0 "[ . 1 . 2]" 2
19 1 4 U O4 1 24 A H61 . . 2.000 1.911 1.777 2.065 0.065 6 0 "[ . 1 . 2]" 2
20 1 4 U O4 1 24 A N6 . . 3.000 2.914 2.794 3.054 0.054 18 0 "[ . 1 . 2]" 2
21 1 5 G H21 1 23 C O2 . . 2.000 1.932 1.794 2.023 0.023 14 0 "[ . 1 . 2]" 2
22 1 5 G N2 1 23 C O2 . . 3.000 2.927 2.810 3.040 0.040 14 0 "[ . 1 . 2]" 2
23 1 5 G H1 1 23 C N3 . . 2.000 1.977 1.900 2.060 0.060 6 0 "[ . 1 . 2]" 2
24 1 5 G N1 1 23 C N3 . . 3.000 2.968 2.904 3.019 0.019 14 0 "[ . 1 . 2]" 2
25 1 5 G O6 1 23 C H41 . . 2.000 1.894 1.819 2.048 0.048 6 0 "[ . 1 . 2]" 2
26 1 5 G O6 1 23 C N4 . . 3.000 2.896 2.807 3.038 0.038 7 0 "[ . 1 . 2]" 2
27 1 9 G H21 1 22 C O2 . . 2.000 1.889 1.758 2.024 0.024 10 0 "[ . 1 . 2]" 2
28 1 9 G N2 1 22 C O2 . . 3.000 2.871 2.772 3.029 0.029 10 0 "[ . 1 . 2]" 2
29 1 9 G H1 1 22 C N3 . . 2.000 1.919 1.879 1.987 . 0 0 "[ . 1 . 2]" 2
30 1 9 G N1 1 22 C N3 . . 3.000 2.923 2.886 2.966 . 0 0 "[ . 1 . 2]" 2
31 1 9 G O6 1 22 C H41 . . 2.000 1.867 1.753 1.977 . 0 0 "[ . 1 . 2]" 2
32 1 9 G O6 1 22 C N4 . . 3.000 2.882 2.774 2.994 . 0 0 "[ . 1 . 2]" 2
33 1 10 U H3 1 21 U O4 . . 2.000 1.944 1.833 2.059 0.059 16 0 "[ . 1 . 2]" 2
34 1 10 U N3 1 21 U O4 . . 3.000 2.934 2.832 3.047 0.047 15 0 "[ . 1 . 2]" 2
35 1 11 C O2 1 20 G H21 . . 2.000 1.855 1.782 1.939 . 0 0 "[ . 1 . 2]" 2
36 1 11 C O2 1 20 G N2 . . 3.000 2.836 2.794 2.947 . 0 0 "[ . 1 . 2]" 2
37 1 11 C N3 1 20 G H1 . . 2.000 1.950 1.891 2.049 0.049 17 0 "[ . 1 . 2]" 2
38 1 11 C N3 1 20 G N1 . . 3.000 2.925 2.869 2.972 . 0 0 "[ . 1 . 2]" 2
39 1 11 C H41 1 20 G O6 . . 2.000 1.910 1.820 2.031 0.031 17 0 "[ . 1 . 2]" 2
40 1 11 C N4 1 20 G O6 . . 3.000 2.917 2.818 3.038 0.038 8 0 "[ . 1 . 2]" 2
41 1 12 C O2 1 19 G H21 . . 2.000 1.902 1.829 2.042 0.042 9 0 "[ . 1 . 2]" 2
42 1 12 C O2 1 19 G N2 . . 3.000 2.917 2.847 3.050 0.050 9 0 "[ . 1 . 2]" 2
43 1 12 C N3 1 19 G H1 . . 2.000 1.927 1.895 1.980 . 0 0 "[ . 1 . 2]" 2
44 1 12 C N3 1 19 G N1 . . 3.000 2.937 2.905 2.987 . 0 0 "[ . 1 . 2]" 2
45 1 12 C H41 1 19 G O6 . . 2.000 1.805 1.759 1.869 . 0 0 "[ . 1 . 2]" 2
46 1 12 C N4 1 19 G O6 . . 3.000 2.817 2.763 2.879 . 0 0 "[ . 1 . 2]" 2
47 1 13 U H3 1 18 U O4 . . 2.000 1.826 1.775 1.929 . 0 0 "[ . 1 . 2]" 2
48 1 13 U N3 1 18 U O4 . . 3.000 2.811 2.763 2.890 . 0 0 "[ . 1 . 2]" 2
49 1 13 U O2 1 18 U H3 . . 2.000 1.881 1.831 1.984 . 0 0 "[ . 1 . 2]" 2
50 1 13 U O2 1 18 U N3 . . 3.000 2.877 2.829 2.988 . 0 0 "[ . 1 . 2]" 2
51 1 16 A HO2' 1 18 U OP1 . . 2.200 1.750 1.733 1.860 . 0 0 "[ . 1 . 2]" 2
52 1 16 A O2' 1 18 U OP1 . . 3.200 2.711 2.679 2.777 . 0 0 "[ . 1 . 2]" 2
53 1 14 U H3 1 17 A OP2 . . 2.000 1.952 1.822 2.058 0.058 11 0 "[ . 1 . 2]" 2
54 1 14 U N3 1 17 A OP2 . . 3.000 2.958 2.835 3.052 0.052 20 0 "[ . 1 . 2]" 2
55 1 14 U HO2' 1 16 A N7 . . 2.000 1.745 1.728 1.790 . 0 0 "[ . 1 . 2]" 2
56 1 14 U O2' 1 16 A N7 . . 3.000 2.704 2.674 2.752 . 0 0 "[ . 1 . 2]" 2
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