NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
581768 |
2mfd   |
19545 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2mfd
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 587
_Distance_constraint_stats_list.Viol_count 1024
_Distance_constraint_stats_list.Viol_total 999.390
_Distance_constraint_stats_list.Viol_max 1.206
_Distance_constraint_stats_list.Viol_rms 0.0233
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0043
_Distance_constraint_stats_list.Viol_average_violations_only 0.0488
_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 6.099 0.612 2 1 "[ + . 1 . 2]"
1 2 G 4.354 1.137 2 1 "[ + . 1 . 2]"
1 3 C 3.265 1.137 2 1 "[ + . 1 . 2]"
1 4 G 0.805 0.076 9 0 "[ . 1 . 2]"
1 5 U 4.611 0.108 1 0 "[ . 1 . 2]"
1 6 U 7.886 0.222 13 0 "[ . 1 . 2]"
1 7 C 2.481 0.089 18 0 "[ . 1 . 2]"
1 8 G 5.109 1.206 1 1 "[+ . 1 . 2]"
1 9 C 3.624 0.134 4 0 "[ . 1 . 2]"
1 10 U 0.986 0.134 4 0 "[ . 1 . 2]"
1 11 U 0.937 0.072 7 0 "[ . 1 . 2]"
1 12 A 8.434 1.206 1 1 "[+ . 1 . 2]"
1 13 G 4.899 0.126 4 0 "[ . 1 . 2]"
1 14 A 5.918 0.222 13 0 "[ . 1 . 2]"
1 15 A 3.778 0.123 19 0 "[ . 1 . 2]"
1 16 C 2.591 0.147 20 0 "[ . 1 . 2]"
1 17 G 3.689 0.147 20 0 "[ . 1 . 2]"
1 18 U 2.595 0.107 7 0 "[ . 1 . 2]"
1 19 C 1.467 0.084 15 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 2 G H1 2.700 . 5.300 4.174 3.555 4.805 . 0 0 "[ . 1 . 2]" 1
2 1 1 G H1 1 2 G H1' 2.700 . 5.300 5.242 4.895 5.912 0.612 2 1 "[ + . 1 . 2]" 1
3 1 1 G H1 1 18 U H3 2.700 . 5.300 4.656 4.297 4.931 . 0 0 "[ . 1 . 2]" 1
4 1 1 G H1 1 19 C H1' 2.700 . 5.300 4.890 4.482 5.212 . 0 0 "[ . 1 . 2]" 1
5 1 1 G H1 1 19 C H41 2.700 . 5.300 2.822 2.352 3.327 . 0 0 "[ . 1 . 2]" 1
6 1 1 G H1 1 19 C H42 2.700 . 5.300 4.273 3.897 4.706 . 0 0 "[ . 1 . 2]" 1
7 1 1 G H1 1 19 C H5 2.700 . 5.300 5.143 4.931 5.359 0.059 7 0 "[ . 1 . 2]" 1
8 1 1 G H1 1 1 G H1' 3.300 . 6.500 6.042 5.990 6.118 . 0 0 "[ . 1 . 2]" 1
9 1 1 G H1' 1 2 G H8 2.700 . 5.300 4.408 4.240 4.732 . 0 0 "[ . 1 . 2]" 1
10 1 1 G H1' 1 1 G H2' 2.800 . 2.800 2.768 2.736 2.813 0.013 1 0 "[ . 1 . 2]" 1
11 1 1 G H2' 1 1 G H8 3.800 . 3.800 3.951 3.877 4.041 0.241 12 0 "[ . 1 . 2]" 1
12 1 1 G H2' 1 2 G H1' 2.700 . 5.300 3.444 2.770 4.225 . 0 0 "[ . 1 . 2]" 1
13 1 1 G H2' 1 2 G H5'' 2.700 . 5.300 4.631 4.406 4.882 . 0 0 "[ . 1 . 2]" 1
14 1 1 G H2' 1 2 G H5' 2.700 . 5.300 3.943 3.581 4.471 . 0 0 "[ . 1 . 2]" 1
15 1 1 G H2' 1 2 G H8 2.800 . 2.800 1.787 1.684 2.099 0.116 3 0 "[ . 1 . 2]" 1
16 1 1 G H1' 1 1 G H3' 3.800 . 3.800 3.847 3.819 3.869 0.069 11 0 "[ . 1 . 2]" 1
17 1 1 G H2' 1 1 G H3' 2.800 . 2.800 2.393 2.379 2.406 . 0 0 "[ . 1 . 2]" 1
18 1 1 G H3' 1 1 G H8 3.800 . 3.800 2.852 2.659 3.141 . 0 0 "[ . 1 . 2]" 1
19 1 1 G H3' 1 2 G H8 2.700 . 5.300 2.768 2.371 3.105 . 0 0 "[ . 1 . 2]" 1
20 1 1 G H1' 1 1 G H4' 2.700 . 5.300 3.500 3.279 3.646 . 0 0 "[ . 1 . 2]" 1
21 1 1 G H2' 1 1 G H4' 3.800 . 3.800 3.822 3.774 3.857 0.057 6 0 "[ . 1 . 2]" 1
22 1 1 G H4' 1 1 G H8 3.300 . 6.500 4.150 3.948 4.393 . 0 0 "[ . 1 . 2]" 1
23 1 1 G H1' 1 1 G H5'' 3.300 . 6.500 5.120 5.009 5.196 . 0 0 "[ . 1 . 2]" 1
24 1 1 G H3' 1 1 G H5'' 3.800 . 3.800 2.521 2.312 2.778 . 0 0 "[ . 1 . 2]" 1
25 1 1 G H5'' 1 1 G H8 2.700 . 5.300 3.484 2.821 4.033 . 0 0 "[ . 1 . 2]" 1
26 1 1 G H1' 1 1 G H5' 3.300 . 6.500 4.907 4.748 5.078 . 0 0 "[ . 1 . 2]" 1
27 1 1 G H3' 1 1 G H5' 3.800 . 3.800 3.706 3.615 3.746 . 0 0 "[ . 1 . 2]" 1
28 1 1 G H5' 1 1 G H8 2.700 . 5.300 3.839 3.627 4.317 . 0 0 "[ . 1 . 2]" 1
29 1 1 G H8 1 2 G H8 2.700 . 5.300 4.527 4.074 5.058 . 0 0 "[ . 1 . 2]" 1
30 1 1 G HO2' 1 2 G H8 2.700 . 5.300 3.979 3.044 4.542 . 0 0 "[ . 1 . 2]" 1
31 1 2 G H1 1 3 C H1' 2.700 . 5.300 4.581 3.716 5.209 . 0 0 "[ . 1 . 2]" 1
32 1 2 G H1 1 3 C H41 3.300 . 6.500 4.506 4.077 5.658 . 0 0 "[ . 1 . 2]" 1
33 1 2 G H1 1 3 C H5 2.700 . 5.300 5.425 5.289 6.437 1.137 2 1 "[ + . 1 . 2]" 1
34 1 2 G H1 1 17 G H1 2.700 . 5.300 3.629 3.092 3.891 . 0 0 "[ . 1 . 2]" 1
35 1 2 G H1 1 18 U H2' 2.700 . 5.300 3.905 3.586 4.093 . 0 0 "[ . 1 . 2]" 1
36 1 2 G H1 1 18 U H3 2.800 . 2.800 2.414 2.062 2.774 . 0 0 "[ . 1 . 2]" 1
37 1 2 G H1 1 19 C H1' 2.700 . 5.300 4.511 3.993 4.988 . 0 0 "[ . 1 . 2]" 1
38 1 2 G H1 1 19 C H41 3.300 . 6.500 4.292 3.823 5.073 . 0 0 "[ . 1 . 2]" 1
39 1 2 G H1 1 19 C H42 3.300 . 6.500 4.567 4.214 5.414 . 0 0 "[ . 1 . 2]" 1
40 1 2 G H1 1 19 C H5 3.300 . 6.500 4.434 3.818 5.074 . 0 0 "[ . 1 . 2]" 1
41 1 2 G H1 1 19 C H6 3.300 . 6.500 4.656 3.788 5.495 . 0 0 "[ . 1 . 2]" 1
42 1 2 G H1' 1 3 C H5 3.300 . 6.500 5.212 4.799 5.949 . 0 0 "[ . 1 . 2]" 1
43 1 2 G H1' 1 3 C H6 2.700 . 5.300 4.892 4.591 5.268 . 0 0 "[ . 1 . 2]" 1
44 1 2 G H1' 1 2 G H2' 2.800 . 2.800 2.785 2.747 2.826 0.026 17 0 "[ . 1 . 2]" 1
45 1 2 G H2' 1 2 G H8 2.700 . 5.300 4.340 4.210 4.422 . 0 0 "[ . 1 . 2]" 1
46 1 2 G H2' 1 2 G HO2' 2.800 . 3.800 2.623 2.112 2.865 . 0 0 "[ . 1 . 2]" 1
47 1 2 G H2' 1 2 G Q2 3.985 . 6.170 3.943 3.757 4.166 . 0 0 "[ . 1 . 2]" 1
48 1 2 G H2' 1 3 C H1' 2.700 . 5.300 4.185 3.187 4.815 . 0 0 "[ . 1 . 2]" 1
49 1 2 G H2' 1 3 C H5 2.700 . 5.300 3.374 2.825 4.118 . 0 0 "[ . 1 . 2]" 1
50 1 2 G H2' 1 3 C H6 2.800 . 2.800 2.196 1.805 2.621 . 0 0 "[ . 1 . 2]" 1
51 1 2 G H3' 1 2 G H8 3.800 . 3.800 3.574 3.309 3.802 0.002 19 0 "[ . 1 . 2]" 1
52 1 2 G H3' 1 3 C H6 3.800 . 3.800 2.728 2.089 3.146 . 0 0 "[ . 1 . 2]" 1
53 1 2 G H1' 1 2 G H4' 3.800 . 3.800 3.468 3.308 3.621 . 0 0 "[ . 1 . 2]" 1
54 1 2 G H4' 1 2 G H8 2.700 . 5.300 4.373 4.156 4.511 . 0 0 "[ . 1 . 2]" 1
55 1 2 G H4' 1 2 G HO2' 3.800 . 3.800 2.601 2.143 3.823 0.023 15 0 "[ . 1 . 2]" 1
56 1 2 G H4' 1 3 C H6 3.300 . 6.500 5.204 4.876 5.563 . 0 0 "[ . 1 . 2]" 1
57 1 2 G H5'' 1 2 G H8 2.700 . 5.300 4.064 3.456 4.597 . 0 0 "[ . 1 . 2]" 1
58 1 2 G H5' 1 2 G H8 2.700 . 5.300 4.078 3.754 4.460 . 0 0 "[ . 1 . 2]" 1
59 1 2 G H8 1 3 C H42 2.700 . 5.300 4.690 3.922 5.295 . 0 0 "[ . 1 . 2]" 1
60 1 2 G H8 1 3 C H5 2.700 . 5.300 4.059 3.634 4.441 . 0 0 "[ . 1 . 2]" 1
61 1 2 G H8 1 3 C H6 3.300 . 6.500 5.407 4.785 6.028 . 0 0 "[ . 1 . 2]" 1
62 1 2 G H1' 1 2 G HO2' 3.800 . 3.800 3.100 1.934 3.459 . 0 0 "[ . 1 . 2]" 1
63 1 2 G H8 1 2 G HO2' 3.300 . 6.500 5.504 4.973 5.803 . 0 0 "[ . 1 . 2]" 1
64 1 2 G HO2' 1 3 C H1' 3.200 . 6.300 6.005 4.625 6.359 0.059 1 0 "[ . 1 . 2]" 1
65 1 2 G HO2' 1 3 C H6 2.700 . 5.300 4.181 3.553 4.756 . 0 0 "[ . 1 . 2]" 1
66 1 2 G Q2 1 3 C H1' 2.385 . 4.670 2.627 1.964 3.198 . 0 0 "[ . 1 . 2]" 1
67 1 2 G Q2 1 3 C H6 3.735 . 7.370 4.426 4.132 5.014 . 0 0 "[ . 1 . 2]" 1
68 1 2 G Q2 1 17 G H1 3.735 . 7.370 4.719 4.306 5.149 . 0 0 "[ . 1 . 2]" 1
69 1 2 G Q2 1 18 U H1' 3.135 . 6.170 4.548 4.164 5.152 . 0 0 "[ . 1 . 2]" 1
70 1 2 G Q2 1 18 U H2' 3.985 . 6.170 3.681 3.401 4.118 . 0 0 "[ . 1 . 2]" 1
71 1 2 G Q2 1 18 U H3 3.135 . 6.170 4.360 3.969 4.737 . 0 0 "[ . 1 . 2]" 1
72 1 2 G Q2 1 19 C H1' 2.385 . 4.670 2.608 2.288 3.076 . 0 0 "[ . 1 . 2]" 1
73 1 2 G Q2 1 19 C H4' 3.985 . 6.170 4.830 3.766 5.740 . 0 0 "[ . 1 . 2]" 1
74 1 2 G Q2 1 19 C H6 3.135 . 6.170 4.052 3.295 4.827 . 0 0 "[ . 1 . 2]" 1
75 1 3 C H1' 1 4 G H8 2.700 . 5.300 4.778 4.453 5.089 . 0 0 "[ . 1 . 2]" 1
76 1 3 C H2' 1 3 C H6 2.700 . 5.300 4.051 3.818 4.223 . 0 0 "[ . 1 . 2]" 1
77 1 3 C H2' 1 3 C HO2' 2.300 . 2.800 2.635 2.291 2.856 0.056 20 0 "[ . 1 . 2]" 1
78 1 3 C H2' 1 4 G H1' 2.700 . 5.300 2.984 2.426 3.725 . 0 0 "[ . 1 . 2]" 1
79 1 3 C H2' 1 4 G H8 2.800 . 2.800 2.199 1.788 2.591 0.012 3 0 "[ . 1 . 2]" 1
80 1 3 C H3' 1 3 C H5 2.700 . 5.300 4.679 4.378 4.972 . 0 0 "[ . 1 . 2]" 1
81 1 3 C H3' 1 3 C H6 3.800 . 3.800 3.017 2.632 3.337 . 0 0 "[ . 1 . 2]" 1
82 1 3 C H3' 1 4 G H8 3.800 . 3.800 2.386 2.119 2.666 . 0 0 "[ . 1 . 2]" 1
83 1 3 C H4' 1 3 C H6 2.700 . 5.300 3.967 3.848 4.095 . 0 0 "[ . 1 . 2]" 1
84 1 3 C H41 1 17 G H1 2.800 . 2.800 2.357 1.893 2.795 . 0 0 "[ . 1 . 2]" 1
85 1 3 C H41 1 18 U H3 2.700 . 5.300 4.235 3.744 4.948 . 0 0 "[ . 1 . 2]" 1
86 1 3 C H42 1 17 G H1 2.700 . 5.300 3.869 3.475 4.246 . 0 0 "[ . 1 . 2]" 1
87 1 3 C H42 1 18 U H3 3.300 . 6.500 5.333 4.929 6.230 . 0 0 "[ . 1 . 2]" 1
88 1 3 C H1' 1 3 C H5'' 2.700 . 5.300 5.166 5.093 5.248 . 0 0 "[ . 1 . 2]" 1
89 1 3 C H5'' 1 3 C H6 2.700 . 5.300 3.666 3.390 4.128 . 0 0 "[ . 1 . 2]" 1
90 1 3 C H1' 1 3 C H5' 2.700 . 5.300 4.819 4.613 4.965 . 0 0 "[ . 1 . 2]" 1
91 1 3 C H5' 1 3 C H6 2.700 . 5.300 3.539 3.078 3.976 . 0 0 "[ . 1 . 2]" 1
92 1 3 C H6 1 4 G H8 3.300 . 6.500 4.670 3.917 5.247 . 0 0 "[ . 1 . 2]" 1
93 1 3 C H6 1 17 G H1 3.300 . 6.500 5.644 5.572 5.686 . 0 0 "[ . 1 . 2]" 1
94 1 3 C H1' 1 3 C HO2' 3.800 . 3.800 3.002 1.978 3.473 . 0 0 "[ . 1 . 2]" 1
95 1 3 C H6 1 3 C HO2' 2.700 . 5.300 5.094 4.706 5.364 0.064 10 0 "[ . 1 . 2]" 1
96 1 3 C HO2' 1 4 G H8 2.700 . 5.300 4.283 3.726 5.112 . 0 0 "[ . 1 . 2]" 1
97 1 4 G H1 1 5 U H1' 2.700 . 5.300 4.905 4.281 5.347 0.047 19 0 "[ . 1 . 2]" 1
98 1 4 G H1 1 5 U H3 3.800 . 3.800 3.514 3.303 3.813 0.013 8 0 "[ . 1 . 2]" 1
99 1 4 G H1 1 15 A H2 2.700 . 5.300 4.784 4.486 5.123 . 0 0 "[ . 1 . 2]" 1
100 1 4 G H1 1 16 C H1' 3.300 . 6.500 5.360 5.055 5.636 . 0 0 "[ . 1 . 2]" 1
101 1 4 G H1 1 16 C H41 2.800 . 2.800 2.398 1.930 2.748 . 0 0 "[ . 1 . 2]" 1
102 1 4 G H1 1 16 C H42 2.700 . 5.300 3.904 3.467 4.181 . 0 0 "[ . 1 . 2]" 1
103 1 4 G H1 1 16 C H5 3.300 . 6.500 4.945 4.711 5.039 . 0 0 "[ . 1 . 2]" 1
104 1 4 G H1 1 17 G H1 2.700 . 5.300 4.407 4.036 4.732 . 0 0 "[ . 1 . 2]" 1
105 1 4 G H1 1 17 G H1' 2.700 . 5.300 4.494 3.957 5.084 . 0 0 "[ . 1 . 2]" 1
106 1 4 G H1 1 17 G H8 3.300 . 6.500 5.058 4.840 5.343 . 0 0 "[ . 1 . 2]" 1
107 1 4 G H1' 1 5 U H5 3.300 . 6.500 5.765 5.432 6.186 . 0 0 "[ . 1 . 2]" 1
108 1 4 G H1' 1 5 U H6 2.700 . 5.300 4.878 4.652 5.154 . 0 0 "[ . 1 . 2]" 1
109 1 4 G H1' 1 17 G H1 2.700 . 5.300 5.120 4.641 5.376 0.076 9 0 "[ . 1 . 2]" 1
110 1 4 G H1' 1 17 G Q2 2.385 . 4.670 2.887 2.487 3.171 . 0 0 "[ . 1 . 2]" 1
111 1 4 G H1' 1 4 G H2' 2.800 . 2.800 2.779 2.746 2.814 0.014 14 0 "[ . 1 . 2]" 1
112 1 4 G H2' 1 4 G HO2' 2.300 . 2.800 2.543 2.112 2.857 0.057 13 0 "[ . 1 . 2]" 1
113 1 4 G H2' 1 5 U H5 3.800 . 3.800 3.659 3.158 3.833 0.033 18 0 "[ . 1 . 2]" 1
114 1 4 G H2' 1 5 U H6 2.800 . 2.800 2.163 1.940 2.428 . 0 0 "[ . 1 . 2]" 1
115 1 4 G H3' 1 4 G H8 3.800 . 3.800 3.590 3.236 3.819 0.019 14 0 "[ . 1 . 2]" 1
116 1 4 G H3' 1 5 U H5 2.700 . 5.300 2.847 2.295 3.630 . 0 0 "[ . 1 . 2]" 1
117 1 4 G H3' 1 5 U H6 3.800 . 3.800 2.594 2.332 3.161 . 0 0 "[ . 1 . 2]" 1
118 1 4 G H1' 1 4 G H4' 3.800 . 3.800 3.509 3.333 3.665 . 0 0 "[ . 1 . 2]" 1
119 1 4 G H4' 1 4 G H8 2.700 . 5.300 4.342 4.187 4.506 . 0 0 "[ . 1 . 2]" 1
120 1 4 G H4' 1 5 U H6 2.700 . 5.300 4.994 4.776 5.306 0.006 2 0 "[ . 1 . 2]" 1
121 1 4 G H5'' 1 4 G H8 2.700 . 5.300 3.986 3.406 4.418 . 0 0 "[ . 1 . 2]" 1
122 1 4 G H5' 1 4 G H8 2.700 . 5.300 3.991 3.557 4.546 . 0 0 "[ . 1 . 2]" 1
123 1 4 G H8 1 5 U H5 2.700 . 5.300 4.849 4.502 5.316 0.016 12 0 "[ . 1 . 2]" 1
124 1 4 G H8 1 5 U H6 3.300 . 6.500 5.521 5.122 5.921 . 0 0 "[ . 1 . 2]" 1
125 1 4 G H8 1 17 G H1 3.300 . 6.500 5.454 5.047 5.813 . 0 0 "[ . 1 . 2]" 1
126 1 4 G H1' 1 4 G HO2' 3.800 . 3.800 2.904 2.226 3.479 . 0 0 "[ . 1 . 2]" 1
127 1 4 G HO2' 1 5 U H6 2.700 . 5.300 4.031 3.329 4.877 . 0 0 "[ . 1 . 2]" 1
128 1 4 G Q2 1 5 U H1' 2.385 . 4.670 2.223 1.829 2.638 . 0 0 "[ . 1 . 2]" 1
129 1 4 G Q2 1 16 C H41 3.135 . 6.170 4.288 3.834 4.572 . 0 0 "[ . 1 . 2]" 1
130 1 4 G Q2 1 17 G H1' 2.385 . 4.670 2.462 2.101 2.985 . 0 0 "[ . 1 . 2]" 1
131 1 5 U H1' 1 5 U H3 3.550 . 5.300 4.631 4.579 4.692 . 0 0 "[ . 1 . 2]" 1
132 1 5 U H1' 1 6 U H1' 2.700 . 5.300 4.932 4.636 5.235 . 0 0 "[ . 1 . 2]" 1
133 1 5 U H1' 1 6 U H5'' 3.300 . 6.500 6.549 6.491 6.596 0.096 16 0 "[ . 1 . 2]" 1
134 1 5 U H1' 1 6 U H5' 3.300 . 6.500 4.865 4.811 4.998 . 0 0 "[ . 1 . 2]" 1
135 1 5 U H1' 1 6 U H6 2.700 . 5.300 4.644 4.505 4.915 . 0 0 "[ . 1 . 2]" 1
136 1 5 U H2' 1 5 U H3 2.700 . 5.300 4.476 4.377 4.592 . 0 0 "[ . 1 . 2]" 1
137 1 5 U H2' 1 5 U H6 2.700 . 5.300 4.089 3.947 4.215 . 0 0 "[ . 1 . 2]" 1
138 1 5 U H2' 1 5 U HO2' 2.300 . 2.800 2.681 2.142 2.855 0.055 4 0 "[ . 1 . 2]" 1
139 1 5 U H2' 1 6 U H5 2.700 . 5.300 3.815 3.303 4.354 . 0 0 "[ . 1 . 2]" 1
140 1 5 U H2' 1 6 U H6 2.800 . 2.800 2.011 1.788 2.352 0.012 3 0 "[ . 1 . 2]" 1
141 1 5 U H3 1 6 U H1' 2.700 . 5.300 4.304 3.804 4.903 . 0 0 "[ . 1 . 2]" 1
142 1 5 U H3 1 6 U H3 3.800 . 3.800 3.673 3.409 3.811 0.011 11 0 "[ . 1 . 2]" 1
143 1 5 U H3 1 6 U H5 2.700 . 5.300 4.754 4.563 4.939 . 0 0 "[ . 1 . 2]" 1
144 1 5 U H3 1 6 U H6 2.700 . 5.300 4.867 4.459 5.283 . 0 0 "[ . 1 . 2]" 1
145 1 5 U H3 1 14 A H2 3.300 . 6.500 5.065 4.670 5.354 . 0 0 "[ . 1 . 2]" 1
146 1 5 U H3 1 15 A H2 2.800 . 2.800 2.834 2.796 2.872 0.072 1 0 "[ . 1 . 2]" 1
147 1 5 U H3 1 15 A H61 3.800 . 3.800 2.363 2.334 2.388 . 0 0 "[ . 1 . 2]" 1
148 1 5 U H3 1 15 A H62 3.800 . 3.800 3.867 3.837 3.908 0.108 1 0 "[ . 1 . 2]" 1
149 1 5 U H3 1 16 C H1' 2.700 . 5.300 5.212 4.835 5.355 0.055 3 0 "[ . 1 . 2]" 1
150 1 5 U H3 1 16 C H42 3.300 . 6.500 5.940 5.251 6.409 . 0 0 "[ . 1 . 2]" 1
151 1 5 U H1' 1 5 U H3' 3.800 . 3.800 3.841 3.790 3.858 0.058 4 0 "[ . 1 . 2]" 1
152 1 5 U H3' 1 5 U H5 2.700 . 5.300 4.746 4.425 5.015 . 0 0 "[ . 1 . 2]" 1
153 1 5 U H3' 1 5 U H6 3.800 . 3.800 3.077 2.818 3.384 . 0 0 "[ . 1 . 2]" 1
154 1 5 U H3' 1 6 U H6 3.800 . 3.800 2.504 2.149 2.844 . 0 0 "[ . 1 . 2]" 1
155 1 5 U H5 1 6 U H5 2.700 . 5.300 4.408 4.034 5.127 . 0 0 "[ . 1 . 2]" 1
156 1 5 U H5 1 6 U H6 3.300 . 6.500 5.734 5.188 6.399 . 0 0 "[ . 1 . 2]" 1
157 1 5 U H1' 1 5 U H5'' 2.700 . 5.300 5.206 5.163 5.229 . 0 0 "[ . 1 . 2]" 1
158 1 5 U H5'' 1 5 U H6 2.700 . 5.300 3.844 3.650 4.092 . 0 0 "[ . 1 . 2]" 1
159 1 5 U H1' 1 5 U H5' 2.700 . 5.300 4.710 4.588 4.828 . 0 0 "[ . 1 . 2]" 1
160 1 5 U H5' 1 5 U H6 2.700 . 5.300 3.336 3.000 3.617 . 0 0 "[ . 1 . 2]" 1
161 1 5 U H6 1 6 U H5 2.700 . 5.300 4.345 3.999 4.761 . 0 0 "[ . 1 . 2]" 1
162 1 5 U H6 1 6 U H6 2.700 . 5.300 4.806 4.521 5.302 0.002 8 0 "[ . 1 . 2]" 1
163 1 5 U H1' 1 5 U HO2' 3.800 . 3.800 2.648 1.950 3.273 . 0 0 "[ . 1 . 2]" 1
164 1 5 U H6 1 5 U HO2' 3.300 . 6.500 4.988 4.661 5.513 . 0 0 "[ . 1 . 2]" 1
165 1 5 U HO2' 1 6 U H6 2.700 . 5.300 4.331 3.677 4.983 . 0 0 "[ . 1 . 2]" 1
166 1 6 U H1' 1 6 U H3 3.550 . 5.300 4.592 4.549 4.621 . 0 0 "[ . 1 . 2]" 1
167 1 6 U H1' 1 7 C H6 2.700 . 5.300 4.566 4.388 4.752 . 0 0 "[ . 1 . 2]" 1
168 1 6 U H1' 1 14 A H2 2.700 . 5.300 5.151 4.931 5.325 0.025 4 0 "[ . 1 . 2]" 1
169 1 6 U H1' 1 15 A H2 3.800 . 3.800 2.821 2.482 3.154 . 0 0 "[ . 1 . 2]" 1
170 1 6 U H1' 1 6 U H2' 2.800 . 2.800 2.823 2.779 2.863 0.063 18 0 "[ . 1 . 2]" 1
171 1 6 U H2' 1 6 U H3 2.700 . 5.300 4.481 4.373 4.642 . 0 0 "[ . 1 . 2]" 1
172 1 6 U H2' 1 6 U H5 2.700 . 5.300 5.356 5.325 5.389 0.089 11 0 "[ . 1 . 2]" 1
173 1 6 U H2' 1 6 U H6 2.700 . 5.300 3.909 3.851 3.972 . 0 0 "[ . 1 . 2]" 1
174 1 6 U H2' 1 6 U HO2' 2.300 . 2.800 2.215 2.104 2.804 0.004 11 0 "[ . 1 . 2]" 1
175 1 6 U H2' 1 7 C H5 2.700 . 5.300 3.203 2.508 4.034 . 0 0 "[ . 1 . 2]" 1
176 1 6 U H2' 1 7 C H6 2.800 . 2.800 1.808 1.736 2.074 0.064 9 0 "[ . 1 . 2]" 1
177 1 6 U H2' 1 13 G H1 3.300 . 6.500 6.052 5.707 6.520 0.020 11 0 "[ . 1 . 2]" 1
178 1 6 U H3 1 7 C H41 2.700 . 5.300 4.128 3.767 4.677 . 0 0 "[ . 1 . 2]" 1
179 1 6 U H3 1 7 C H42 2.700 . 5.300 4.626 4.194 5.207 . 0 0 "[ . 1 . 2]" 1
180 1 6 U H3 1 7 C H5 2.700 . 5.300 4.821 4.538 5.124 . 0 0 "[ . 1 . 2]" 1
181 1 6 U H3 1 7 C H6 2.700 . 5.300 5.167 4.833 5.346 0.046 4 0 "[ . 1 . 2]" 1
182 1 6 U H3 1 13 G H1 2.700 . 5.300 3.557 3.272 3.829 . 0 0 "[ . 1 . 2]" 1
183 1 6 U H3 1 14 A H1' 3.300 . 6.500 6.660 6.625 6.722 0.222 13 0 "[ . 1 . 2]" 1
184 1 6 U H3 1 14 A H2 2.800 . 2.800 2.720 2.676 2.779 . 0 0 "[ . 1 . 2]" 1
185 1 6 U H3 1 14 A H61 3.800 . 3.800 2.428 2.387 2.473 . 0 0 "[ . 1 . 2]" 1
186 1 6 U H3 1 14 A H62 3.800 . 3.800 3.861 3.837 3.900 0.100 10 0 "[ . 1 . 2]" 1
187 1 6 U H3 1 15 A H2 3.800 . 3.800 3.712 3.276 3.855 0.055 1 0 "[ . 1 . 2]" 1
188 1 6 U H3' 1 6 U H5 2.700 . 5.300 4.997 4.580 5.320 0.020 20 0 "[ . 1 . 2]" 1
189 1 6 U H3' 1 6 U H6 3.800 . 3.800 3.202 2.773 3.489 . 0 0 "[ . 1 . 2]" 1
190 1 6 U H3' 1 7 C H5 2.700 . 5.300 3.315 3.076 3.591 . 0 0 "[ . 1 . 2]" 1
191 1 6 U H3' 1 7 C H6 3.800 . 3.800 3.039 2.729 3.325 . 0 0 "[ . 1 . 2]" 1
192 1 6 U H5'' 1 6 U H6 2.700 . 5.300 4.070 3.647 4.561 . 0 0 "[ . 1 . 2]" 1
193 1 6 U H5' 1 6 U H6 2.700 . 5.300 3.421 3.107 4.107 . 0 0 "[ . 1 . 2]" 1
194 1 6 U H6 1 7 C H42 3.300 . 6.500 5.605 5.139 6.110 . 0 0 "[ . 1 . 2]" 1
195 1 6 U H6 1 7 C H5 2.700 . 5.300 4.668 4.010 5.029 . 0 0 "[ . 1 . 2]" 1
196 1 6 U H6 1 7 C H6 3.300 . 6.500 5.201 4.658 5.572 . 0 0 "[ . 1 . 2]" 1
197 1 6 U H1' 1 6 U HO2' 3.800 . 3.800 3.111 1.958 3.323 . 0 0 "[ . 1 . 2]" 1
198 1 6 U HO2' 1 7 C H6 2.700 . 5.300 3.003 2.155 4.467 . 0 0 "[ . 1 . 2]" 1
199 1 7 C H1' 1 8 G H8 2.700 . 5.300 4.782 4.271 5.203 . 0 0 "[ . 1 . 2]" 1
200 1 7 C H1' 1 14 A H2 3.800 . 3.800 3.016 2.519 3.532 . 0 0 "[ . 1 . 2]" 1
201 1 7 C H1' 1 7 C H2' 2.800 . 2.800 2.768 2.742 2.794 . 0 0 "[ . 1 . 2]" 1
202 1 7 C H2' 1 7 C H5 3.300 . 6.500 5.573 5.500 5.651 . 0 0 "[ . 1 . 2]" 1
203 1 7 C H2' 1 7 C H6 2.700 . 5.300 4.135 4.079 4.210 . 0 0 "[ . 1 . 2]" 1
204 1 7 C H2' 1 7 C HO2' 2.300 . 2.800 2.680 2.196 2.861 0.061 18 0 "[ . 1 . 2]" 1
205 1 7 C H2' 1 8 G H5'' 2.700 . 5.300 3.717 3.480 3.989 . 0 0 "[ . 1 . 2]" 1
206 1 7 C H2' 1 8 G H5' 3.800 . 3.800 2.250 1.909 2.615 . 0 0 "[ . 1 . 2]" 1
207 1 7 C H2' 1 8 G H8 2.800 . 2.800 2.510 1.965 2.830 0.030 18 0 "[ . 1 . 2]" 1
208 1 7 C H2' 1 13 G H1 3.300 . 6.500 4.954 4.658 5.240 . 0 0 "[ . 1 . 2]" 1
209 1 7 C H2' 1 14 A H2 3.300 . 6.500 4.535 4.186 4.904 . 0 0 "[ . 1 . 2]" 1
210 1 7 C H1' 1 7 C H3' 3.800 . 3.800 3.860 3.816 3.889 0.089 18 0 "[ . 1 . 2]" 1
211 1 7 C H2' 1 7 C H3' 2.800 . 2.800 2.400 2.380 2.421 . 0 0 "[ . 1 . 2]" 1
212 1 7 C H3' 1 7 C H6 3.800 . 3.800 3.184 2.998 3.312 . 0 0 "[ . 1 . 2]" 1
213 1 7 C H3' 1 8 G H8 3.800 . 3.800 1.982 1.746 2.386 0.054 12 0 "[ . 1 . 2]" 1
214 1 7 C H1' 1 7 C H4' 3.800 . 3.800 3.554 3.441 3.638 . 0 0 "[ . 1 . 2]" 1
215 1 7 C H4' 1 7 C H6 2.700 . 5.300 3.940 3.830 4.033 . 0 0 "[ . 1 . 2]" 1
216 1 7 C H4' 1 8 G H8 2.700 . 5.300 4.868 4.562 5.265 . 0 0 "[ . 1 . 2]" 1
217 1 7 C H41 1 13 G H1 2.800 . 2.800 2.490 2.175 2.807 0.007 11 0 "[ . 1 . 2]" 1
218 1 7 C H42 1 8 G H8 3.300 . 6.500 5.970 5.093 6.369 . 0 0 "[ . 1 . 2]" 1
219 1 7 C H42 1 13 G H1 2.700 . 5.300 3.977 3.697 4.258 . 0 0 "[ . 1 . 2]" 1
220 1 7 C H5 1 8 G H8 2.700 . 5.300 5.042 4.400 5.322 0.022 8 0 "[ . 1 . 2]" 1
221 1 7 C H5'' 1 7 C H6 2.700 . 5.300 3.323 3.022 3.545 . 0 0 "[ . 1 . 2]" 1
222 1 7 C H5' 1 7 C H6 2.700 . 5.300 3.684 3.536 3.895 . 0 0 "[ . 1 . 2]" 1
223 1 7 C H6 1 8 G H8 2.700 . 5.300 4.261 3.790 4.702 . 0 0 "[ . 1 . 2]" 1
224 1 7 C H1' 1 7 C HO2' 3.800 . 3.800 2.614 1.961 3.446 . 0 0 "[ . 1 . 2]" 1
225 1 7 C HO2' 1 8 G H5'' 2.700 . 5.300 4.733 3.613 5.300 . 0 0 "[ . 1 . 2]" 1
226 1 7 C HO2' 1 8 G H8 2.700 . 5.300 4.800 4.210 5.320 0.020 2 0 "[ . 1 . 2]" 1
227 1 8 G H1' 1 9 C H4' 3.300 . 6.500 5.982 5.793 6.181 . 0 0 "[ . 1 . 2]" 1
228 1 8 G H1' 1 9 C H5 3.300 . 6.500 6.026 5.750 6.507 0.007 19 0 "[ . 1 . 2]" 1
229 1 8 G H1' 1 9 C H5'' 3.300 . 6.500 6.540 6.500 6.588 0.088 15 0 "[ . 1 . 2]" 1
230 1 8 G H1' 1 9 C H5' 3.300 . 6.500 4.823 4.779 4.879 . 0 0 "[ . 1 . 2]" 1
231 1 8 G H1' 1 9 C H6 2.700 . 5.300 5.005 4.847 5.316 0.016 19 0 "[ . 1 . 2]" 1
232 1 8 G H1' 1 12 A H2 3.800 . 3.800 3.829 2.847 5.006 1.206 1 1 "[+ . 1 . 2]" 1
233 1 8 G H1' 1 13 G H1 2.700 . 5.300 3.244 2.719 3.846 . 0 0 "[ . 1 . 2]" 1
234 1 8 G H1' 1 8 G H2' 2.800 . 2.800 2.762 2.744 2.789 . 0 0 "[ . 1 . 2]" 1
235 1 8 G H2' 1 8 G H8 2.700 . 5.300 4.327 4.174 4.436 . 0 0 "[ . 1 . 2]" 1
236 1 8 G H2' 1 9 C H3' 3.300 . 6.500 4.901 4.600 5.102 . 0 0 "[ . 1 . 2]" 1
237 1 8 G H2' 1 9 C H4' 2.700 . 5.300 4.721 3.940 5.080 . 0 0 "[ . 1 . 2]" 1
238 1 8 G H2' 1 9 C H5 2.700 . 5.300 3.448 3.104 4.206 . 0 0 "[ . 1 . 2]" 1
239 1 8 G H2' 1 9 C H5'' 2.700 . 5.300 4.805 4.243 4.982 . 0 0 "[ . 1 . 2]" 1
240 1 8 G H2' 1 9 C H5' 2.700 . 5.300 3.456 2.723 3.679 . 0 0 "[ . 1 . 2]" 1
241 1 8 G H2' 1 9 C H6 2.800 . 2.800 2.372 2.219 2.642 . 0 0 "[ . 1 . 2]" 1
242 1 8 G H2' 1 12 A H2 3.300 . 6.500 4.628 4.332 5.003 . 0 0 "[ . 1 . 2]" 1
243 1 8 G H1' 1 8 G H3' 3.800 . 3.800 3.866 3.820 3.910 0.110 1 0 "[ . 1 . 2]" 1
244 1 8 G H3' 1 8 G H8 3.800 . 3.800 3.485 3.239 3.755 . 0 0 "[ . 1 . 2]" 1
245 1 8 G H3' 1 9 C H5 2.700 . 5.300 3.904 3.074 4.198 . 0 0 "[ . 1 . 2]" 1
246 1 8 G H3' 1 9 C H5'' 3.300 . 6.500 5.221 4.787 5.296 . 0 0 "[ . 1 . 2]" 1
247 1 8 G H3' 1 9 C H5' 3.300 . 6.500 4.021 3.664 4.159 . 0 0 "[ . 1 . 2]" 1
248 1 8 G H3' 1 9 C H6 3.800 . 3.800 3.599 2.675 3.823 0.023 7 0 "[ . 1 . 2]" 1
249 1 8 G H4' 1 8 G H8 2.700 . 5.300 4.223 4.121 4.285 . 0 0 "[ . 1 . 2]" 1
250 1 8 G H4' 1 9 C H6 3.300 . 6.500 5.360 5.179 5.519 . 0 0 "[ . 1 . 2]" 1
251 1 8 G H1' 1 8 G H5'' 2.700 . 5.300 5.197 5.133 5.228 . 0 0 "[ . 1 . 2]" 1
252 1 8 G H3' 1 8 G H5'' 3.800 . 3.800 2.693 2.491 2.839 . 0 0 "[ . 1 . 2]" 1
253 1 8 G H5'' 1 8 G H8 2.700 . 5.300 3.974 3.701 4.166 . 0 0 "[ . 1 . 2]" 1
254 1 8 G H5'' 1 9 C H6 3.300 . 6.500 6.005 5.107 6.232 . 0 0 "[ . 1 . 2]" 1
255 1 8 G H5' 1 8 G H8 2.700 . 5.300 3.507 3.288 3.695 . 0 0 "[ . 1 . 2]" 1
256 1 8 G H8 1 9 C H5 3.300 . 6.500 6.251 5.062 6.567 0.067 18 0 "[ . 1 . 2]" 1
257 1 8 G H8 1 13 G H1 3.300 . 6.500 5.420 4.212 6.161 . 0 0 "[ . 1 . 2]" 1
258 1 8 G HO2' 1 9 C H4' 3.800 . 3.800 2.990 2.792 3.844 0.044 2 0 "[ . 1 . 2]" 1
259 1 8 G HO2' 1 9 C H5'' 3.800 . 3.800 3.651 3.486 3.765 . 0 0 "[ . 1 . 2]" 1
260 1 8 G HO2' 1 9 C H5' 3.800 . 3.800 2.153 1.791 2.262 0.009 2 0 "[ . 1 . 2]" 1
261 1 8 G HO2' 1 12 A H2 2.700 . 5.300 3.646 2.993 5.149 . 0 0 "[ . 1 . 2]" 1
262 1 8 G Q2 1 12 A H2 3.735 . 7.370 4.141 3.091 5.852 . 0 0 "[ . 1 . 2]" 1
263 1 9 C H1' 1 12 A H1' 3.300 . 6.500 5.776 4.814 6.532 0.032 2 0 "[ . 1 . 2]" 1
264 1 9 C H1' 1 12 A H2 3.300 . 6.500 3.451 2.730 5.293 . 0 0 "[ . 1 . 2]" 1
265 1 9 C H1' 1 9 C H2' 2.800 . 2.800 2.791 2.767 2.812 0.012 16 0 "[ . 1 . 2]" 1
266 1 9 C H2' 1 9 C H5 3.300 . 6.500 5.330 5.207 5.426 . 0 0 "[ . 1 . 2]" 1
267 1 9 C H2' 1 9 C H6 3.800 . 3.800 3.829 3.715 3.915 0.115 10 0 "[ . 1 . 2]" 1
268 1 9 C H2' 1 10 U H3' 3.300 . 6.500 5.690 4.612 6.548 0.048 11 0 "[ . 1 . 2]" 1
269 1 9 C H2' 1 10 U H4' 2.700 . 5.300 4.645 3.534 5.434 0.134 4 0 "[ . 1 . 2]" 1
270 1 9 C H2' 1 10 U H5 3.300 . 6.500 3.960 2.776 6.573 0.073 2 0 "[ . 1 . 2]" 1
271 1 9 C H2' 1 10 U H6 2.700 . 5.300 3.017 2.172 5.095 . 0 0 "[ . 1 . 2]" 1
272 1 9 C H2' 1 11 U H1' 3.300 . 6.500 5.957 5.254 6.558 0.058 5 0 "[ . 1 . 2]" 1
273 1 9 C H2' 1 11 U H2' 2.700 . 5.300 4.066 3.473 4.756 . 0 0 "[ . 1 . 2]" 1
274 1 9 C H2' 1 11 U H5 2.700 . 5.300 5.272 5.053 5.356 0.056 6 0 "[ . 1 . 2]" 1
275 1 9 C H2' 1 11 U H6 3.300 . 6.500 4.769 4.380 5.110 . 0 0 "[ . 1 . 2]" 1
276 1 9 C H3' 1 9 C H5 2.700 . 5.300 4.626 4.465 4.770 . 0 0 "[ . 1 . 2]" 1
277 1 9 C H3' 1 9 C H6 2.800 . 2.800 2.791 2.656 2.854 0.054 20 0 "[ . 1 . 2]" 1
278 1 9 C H3' 1 10 U H5 2.700 . 5.300 3.485 2.649 5.391 0.091 4 0 "[ . 1 . 2]" 1
279 1 9 C H3' 1 10 U H6 2.700 . 5.300 3.223 2.688 4.890 . 0 0 "[ . 1 . 2]" 1
280 1 9 C H1' 1 9 C H4' 3.800 . 3.800 3.474 3.422 3.542 . 0 0 "[ . 1 . 2]" 1
281 1 9 C H4' 1 9 C H6 2.700 . 5.300 3.914 3.841 3.988 . 0 0 "[ . 1 . 2]" 1
282 1 9 C H4' 1 10 U H5 3.300 . 6.500 5.921 4.936 6.511 0.011 18 0 "[ . 1 . 2]" 1
283 1 9 C H4' 1 10 U H6 3.300 . 6.500 5.179 4.437 5.602 . 0 0 "[ . 1 . 2]" 1
284 1 9 C H4' 1 11 U H5 2.700 . 5.300 4.018 2.901 5.087 . 0 0 "[ . 1 . 2]" 1
285 1 9 C H4' 1 12 A H2 3.300 . 6.500 4.912 4.078 6.314 . 0 0 "[ . 1 . 2]" 1
286 1 9 C H5 1 9 C H5'' 3.300 . 6.500 5.852 5.692 6.014 . 0 0 "[ . 1 . 2]" 1
287 1 9 C H5'' 1 9 C H6 2.700 . 5.300 3.710 3.577 3.814 . 0 0 "[ . 1 . 2]" 1
288 1 9 C H5 1 9 C H5' 3.300 . 6.500 5.455 5.263 5.600 . 0 0 "[ . 1 . 2]" 1
289 1 9 C H5' 1 9 C H6 2.700 . 5.300 3.252 3.094 3.378 . 0 0 "[ . 1 . 2]" 1
290 1 9 C H6 1 12 A H2 3.300 . 6.500 5.650 5.108 6.575 0.075 2 0 "[ . 1 . 2]" 1
291 1 10 U H1' 1 11 U H6 2.700 . 5.300 4.473 3.384 5.069 . 0 0 "[ . 1 . 2]" 1
292 1 10 U H2' 1 10 U H5 2.700 . 5.300 4.556 4.337 4.671 . 0 0 "[ . 1 . 2]" 1
293 1 10 U H2' 1 10 U H6 2.800 . 2.800 2.627 2.281 2.758 . 0 0 "[ . 1 . 2]" 1
294 1 10 U H2' 1 11 U H5 3.300 . 6.500 5.405 1.774 6.216 0.026 2 0 "[ . 1 . 2]" 1
295 1 10 U H2' 1 11 U H6 2.700 . 5.300 4.783 1.944 5.372 0.072 7 0 "[ . 1 . 2]" 1
296 1 10 U H2' 1 10 U H3' 2.800 . 2.800 2.430 2.372 2.458 . 0 0 "[ . 1 . 2]" 1
297 1 10 U H3' 1 10 U H6 2.700 . 5.300 4.362 3.915 4.569 . 0 0 "[ . 1 . 2]" 1
298 1 10 U H3' 1 11 U H5 3.300 . 6.500 4.877 3.355 5.596 . 0 0 "[ . 1 . 2]" 1
299 1 10 U H3' 1 11 U H6 2.700 . 5.300 3.819 2.016 4.611 . 0 0 "[ . 1 . 2]" 1
300 1 10 U H1' 1 10 U H4' 3.800 . 3.800 3.406 3.295 3.559 . 0 0 "[ . 1 . 2]" 1
301 1 10 U H3' 1 10 U H4' 2.800 . 2.800 2.673 2.633 2.703 . 0 0 "[ . 1 . 2]" 1
302 1 10 U H4' 1 10 U H6 2.700 . 5.300 4.316 4.217 4.451 . 0 0 "[ . 1 . 2]" 1
303 1 10 U H1' 1 10 U H5'' 3.300 . 6.500 4.820 4.729 4.945 . 0 0 "[ . 1 . 2]" 1
304 1 10 U H2' 1 10 U H5'' 2.700 . 5.300 3.230 2.866 3.630 . 0 0 "[ . 1 . 2]" 1
305 1 10 U H3' 1 10 U H5'' 3.800 . 3.800 2.276 2.182 2.479 . 0 0 "[ . 1 . 2]" 1
306 1 10 U H4' 1 10 U H5'' 2.800 . 2.800 2.632 2.446 2.707 . 0 0 "[ . 1 . 2]" 1
307 1 10 U H5'' 1 11 U H5 2.700 . 5.300 3.513 2.589 4.159 . 0 0 "[ . 1 . 2]" 1
308 1 10 U H1' 1 10 U H5' 3.300 . 6.500 4.857 4.688 4.952 . 0 0 "[ . 1 . 2]" 1
309 1 10 U H2' 1 10 U H5' 2.700 . 5.300 4.205 3.992 4.476 . 0 0 "[ . 1 . 2]" 1
310 1 10 U H3' 1 10 U H5' 3.800 . 3.800 3.533 3.459 3.707 . 0 0 "[ . 1 . 2]" 1
311 1 10 U H4' 1 10 U H5' 2.800 . 2.800 2.265 2.221 2.404 . 0 0 "[ . 1 . 2]" 1
312 1 10 U H5' 1 11 U H5 2.700 . 5.300 2.575 1.773 5.323 0.027 3 0 "[ . 1 . 2]" 1
313 1 11 U H1' 1 12 A H2 3.300 . 6.500 5.556 4.690 6.133 . 0 0 "[ . 1 . 2]" 1
314 1 11 U H1' 1 12 A H8 2.700 . 5.300 4.295 3.922 4.690 . 0 0 "[ . 1 . 2]" 1
315 1 11 U H1' 1 12 A Q5' 3.140 . 6.180 3.757 3.457 4.243 . 0 0 "[ . 1 . 2]" 1
316 1 11 U H2' 1 11 U H5 2.700 . 5.300 4.378 4.228 4.550 . 0 0 "[ . 1 . 2]" 1
317 1 11 U H2' 1 11 U H6 2.800 . 2.800 2.185 1.938 2.529 . 0 0 "[ . 1 . 2]" 1
318 1 11 U H2' 1 12 A H8 3.300 . 6.500 6.027 5.643 6.451 . 0 0 "[ . 1 . 2]" 1
319 1 11 U H1' 1 11 U H3' 3.800 . 3.800 3.760 3.728 3.809 0.009 18 0 "[ . 1 . 2]" 1
320 1 11 U H2' 1 11 U H3' 2.800 . 2.800 2.437 2.407 2.464 . 0 0 "[ . 1 . 2]" 1
321 1 11 U H3' 1 11 U H6 2.700 . 5.300 4.332 4.136 4.474 . 0 0 "[ . 1 . 2]" 1
322 1 11 U H3' 1 12 A H8 2.700 . 5.300 4.995 4.619 5.330 0.030 3 0 "[ . 1 . 2]" 1
323 1 11 U H3' 1 12 A Q5' 3.140 . 6.180 4.238 3.934 4.477 . 0 0 "[ . 1 . 2]" 1
324 1 11 U H1' 1 11 U H4' 3.800 . 3.800 3.147 2.942 3.295 . 0 0 "[ . 1 . 2]" 1
325 1 11 U H3' 1 11 U H4' 2.800 . 2.800 2.719 2.671 2.780 . 0 0 "[ . 1 . 2]" 1
326 1 11 U H4' 1 11 U H6 2.700 . 5.300 4.740 4.572 4.935 . 0 0 "[ . 1 . 2]" 1
327 1 11 U H4' 1 12 A H1' 3.300 . 6.500 5.148 4.663 5.404 . 0 0 "[ . 1 . 2]" 1
328 1 11 U H4' 1 12 A H3' 2.700 . 5.300 5.177 4.738 5.334 0.034 18 0 "[ . 1 . 2]" 1
329 1 11 U H4' 1 12 A H4' 2.700 . 5.300 3.136 2.727 3.375 . 0 0 "[ . 1 . 2]" 1
330 1 11 U H4' 1 12 A H8 2.700 . 5.300 4.833 4.434 5.295 . 0 0 "[ . 1 . 2]" 1
331 1 11 U H1' 1 11 U Q5' 3.140 . 6.180 4.231 4.169 4.282 . 0 0 "[ . 1 . 2]" 1
332 1 11 U H3' 1 11 U Q5' 1.890 . 3.680 2.311 2.143 2.454 . 0 0 "[ . 1 . 2]" 1
333 1 11 U Q5' 1 11 U H6 3.140 . 6.180 3.957 3.719 4.352 . 0 0 "[ . 1 . 2]" 1
334 1 11 U Q5' 1 12 A H3' 3.740 . 7.380 6.538 6.010 6.736 . 0 0 "[ . 1 . 2]" 1
335 1 11 U Q5' 1 12 A H8 3.740 . 7.380 6.121 5.771 6.548 . 0 0 "[ . 1 . 2]" 1
336 1 12 A H1' 1 12 A H8 2.800 . 3.800 3.866 3.852 3.873 0.073 1 0 "[ . 1 . 2]" 1
337 1 12 A H1' 1 13 G H1' 3.800 . 3.800 2.326 2.169 2.497 . 0 0 "[ . 1 . 2]" 1
338 1 12 A H1' 1 13 G H4' 2.700 . 5.300 4.057 3.790 4.338 . 0 0 "[ . 1 . 2]" 1
339 1 12 A H1' 1 13 G H5'' 3.550 . 5.300 5.325 5.209 5.365 0.065 17 0 "[ . 1 . 2]" 1
340 1 12 A H1' 1 13 G H8 2.700 . 5.300 3.305 2.926 3.918 . 0 0 "[ . 1 . 2]" 1
341 1 12 A H2 1 13 G H1 2.700 . 5.300 4.393 3.520 4.912 . 0 0 "[ . 1 . 2]" 1
342 1 12 A H2 1 13 G H1' 2.700 . 5.300 3.338 2.830 3.810 . 0 0 "[ . 1 . 2]" 1
343 1 12 A H2 1 13 G H22 3.300 . 6.500 4.442 3.701 4.972 . 0 0 "[ . 1 . 2]" 1
344 1 12 A H2 1 13 G H21 3.300 . 6.500 3.883 3.046 4.600 . 0 0 "[ . 1 . 2]" 1
345 1 12 A H2 1 13 G H8 3.300 . 6.500 5.071 4.653 5.668 . 0 0 "[ . 1 . 2]" 1
346 1 12 A H2' 1 12 A H8 2.800 . 2.800 2.452 2.207 2.699 . 0 0 "[ . 1 . 2]" 1
347 1 12 A H2' 1 12 A HO2' 2.300 . 2.800 2.838 2.817 2.854 0.054 1 0 "[ . 1 . 2]" 1
348 1 12 A H2' 1 13 G H4' 3.300 . 6.500 6.151 5.931 6.334 . 0 0 "[ . 1 . 2]" 1
349 1 12 A H2' 1 13 G H5'' 4.150 . 6.500 6.431 6.340 6.499 . 0 0 "[ . 1 . 2]" 1
350 1 12 A H2' 1 13 G H8 2.700 . 5.300 3.973 3.683 4.359 . 0 0 "[ . 1 . 2]" 1
351 1 12 A H1' 1 12 A H3' 3.800 . 3.800 3.860 3.825 3.901 0.101 11 0 "[ . 1 . 2]" 1
352 1 12 A H3' 1 12 A H8 2.700 . 5.300 4.416 4.302 4.540 . 0 0 "[ . 1 . 2]" 1
353 1 12 A H3' 1 13 G H4' 3.300 . 6.500 5.409 5.286 5.574 . 0 0 "[ . 1 . 2]" 1
354 1 12 A H3' 1 13 G H5'' 3.300 . 6.500 5.858 5.808 5.900 . 0 0 "[ . 1 . 2]" 1
355 1 12 A H3' 1 13 G H5' 2.700 . 5.300 5.218 5.121 5.296 . 0 0 "[ . 1 . 2]" 1
356 1 12 A H3' 1 13 G H8 2.700 . 5.300 4.882 4.701 5.161 . 0 0 "[ . 1 . 2]" 1
357 1 12 A H1' 1 12 A H4' 3.800 . 3.800 3.384 3.189 3.479 . 0 0 "[ . 1 . 2]" 1
358 1 12 A H2' 1 12 A H4' 3.800 . 3.800 3.834 3.807 3.856 0.056 11 0 "[ . 1 . 2]" 1
359 1 12 A H3' 1 12 A H4' 2.800 . 2.800 2.680 2.660 2.731 . 0 0 "[ . 1 . 2]" 1
360 1 12 A H4' 1 12 A H8 3.300 . 6.500 4.739 4.550 4.999 . 0 0 "[ . 1 . 2]" 1
361 1 12 A H4' 1 13 G H4' 2.700 . 5.300 4.856 4.644 5.039 . 0 0 "[ . 1 . 2]" 1
362 1 12 A H4' 1 13 G H5'' 3.300 . 6.500 6.567 6.475 6.626 0.126 4 0 "[ . 1 . 2]" 1
363 1 12 A H4' 1 13 G H5' 3.300 . 6.500 5.586 5.401 5.807 . 0 0 "[ . 1 . 2]" 1
364 1 12 A H4' 1 13 G H8 3.300 . 6.500 5.896 5.610 6.276 . 0 0 "[ . 1 . 2]" 1
365 1 12 A H8 1 13 G H1' 3.300 . 6.500 5.903 5.675 6.184 . 0 0 "[ . 1 . 2]" 1
366 1 12 A H8 1 13 G H8 3.300 . 6.500 5.618 4.914 6.344 . 0 0 "[ . 1 . 2]" 1
367 1 12 A H1' 1 12 A HO2' 3.800 . 3.800 2.449 2.305 2.586 . 0 0 "[ . 1 . 2]" 1
368 1 12 A H8 1 12 A HO2' 2.700 . 5.300 4.882 4.670 5.038 . 0 0 "[ . 1 . 2]" 1
369 1 12 A H1' 1 12 A Q5' 3.140 . 6.180 4.321 4.285 4.344 . 0 0 "[ . 1 . 2]" 1
370 1 12 A H2' 1 12 A Q5' 2.390 . 4.680 3.179 3.098 3.423 . 0 0 "[ . 1 . 2]" 1
371 1 12 A H3' 1 12 A Q5' 1.890 . 3.680 2.225 2.187 2.266 . 0 0 "[ . 1 . 2]" 1
372 1 12 A Q5' 1 12 A H8 3.140 . 6.180 3.721 3.484 4.222 . 0 0 "[ . 1 . 2]" 1
373 1 13 G H1 1 14 A H1' 2.700 . 5.300 4.940 4.674 5.313 0.013 13 0 "[ . 1 . 2]" 1
374 1 13 G H1 1 14 A H2 2.700 . 5.300 3.628 3.115 4.460 . 0 0 "[ . 1 . 2]" 1
375 1 13 G H1' 1 14 A H8 2.700 . 5.300 5.060 4.908 5.229 . 0 0 "[ . 1 . 2]" 1
376 1 13 G H1' 1 13 G H2' 2.800 . 2.800 2.786 2.757 2.824 0.024 20 0 "[ . 1 . 2]" 1
377 1 13 G H2' 1 13 G H8 2.700 . 5.300 4.452 4.342 4.580 . 0 0 "[ . 1 . 2]" 1
378 1 13 G H2' 1 13 G HO2' 2.300 . 2.800 2.612 2.120 2.854 0.054 19 0 "[ . 1 . 2]" 1
379 1 13 G H2' 1 14 A H8 2.800 . 2.800 2.621 2.359 2.776 . 0 0 "[ . 1 . 2]" 1
380 1 13 G H22 1 14 A H2 2.700 . 5.300 3.593 3.354 3.894 . 0 0 "[ . 1 . 2]" 1
381 1 13 G H21 1 14 A H2 2.700 . 5.300 4.795 4.472 5.096 . 0 0 "[ . 1 . 2]" 1
382 1 13 G H2' 1 13 G H3' 2.800 . 2.800 2.403 2.375 2.435 . 0 0 "[ . 1 . 2]" 1
383 1 13 G H3' 1 13 G H8 2.700 . 5.300 3.831 3.380 4.084 . 0 0 "[ . 1 . 2]" 1
384 1 13 G H3' 1 14 A H8 3.800 . 3.800 1.916 1.771 2.140 0.029 19 0 "[ . 1 . 2]" 1
385 1 13 G H1' 1 13 G H4' 2.700 . 5.300 3.460 3.327 3.557 . 0 0 "[ . 1 . 2]" 1
386 1 13 G H2' 1 13 G H4' 3.800 . 3.800 3.821 3.766 3.856 0.056 13 0 "[ . 1 . 2]" 1
387 1 13 G H4' 1 13 G H8 2.700 . 5.300 4.476 4.276 4.570 . 0 0 "[ . 1 . 2]" 1
388 1 13 G H2' 1 13 G H5'' 2.700 . 5.300 4.447 4.377 4.529 . 0 0 "[ . 1 . 2]" 1
389 1 13 G H4' 1 13 G H5'' 2.800 . 2.800 2.894 2.879 2.903 0.103 1 0 "[ . 1 . 2]" 1
390 1 13 G H5'' 1 13 G H8 3.800 . 3.800 3.677 3.191 3.848 0.048 19 0 "[ . 1 . 2]" 1
391 1 13 G H2' 1 13 G H5' 2.700 . 5.300 5.255 5.234 5.275 . 0 0 "[ . 1 . 2]" 1
392 1 13 G H4' 1 13 G H5' 2.800 . 2.800 2.211 2.205 2.217 . 0 0 "[ . 1 . 2]" 1
393 1 13 G H5' 1 13 G H8 2.700 . 5.300 4.653 4.242 4.835 . 0 0 "[ . 1 . 2]" 1
394 1 13 G H1' 1 13 G HO2' 3.800 . 3.800 2.985 2.040 3.443 . 0 0 "[ . 1 . 2]" 1
395 1 13 G HO2' 1 14 A H8 2.700 . 5.300 4.306 3.472 5.165 . 0 0 "[ . 1 . 2]" 1
396 1 14 A H1' 1 15 A H8 2.700 . 5.300 5.008 4.705 5.252 . 0 0 "[ . 1 . 2]" 1
397 1 14 A H2 1 15 A H1' 3.800 . 3.800 3.418 3.036 3.812 0.012 2 0 "[ . 1 . 2]" 1
398 1 14 A H2 1 15 A H2 2.700 . 5.300 3.620 3.229 3.868 . 0 0 "[ . 1 . 2]" 1
399 1 14 A H2 1 15 A H8 3.300 . 6.500 5.419 5.047 5.809 . 0 0 "[ . 1 . 2]" 1
400 1 14 A H1' 1 14 A H2' 2.800 . 2.800 2.778 2.749 2.811 0.011 10 0 "[ . 1 . 2]" 1
401 1 14 A H2' 1 14 A H8 2.700 . 5.300 4.287 4.200 4.434 . 0 0 "[ . 1 . 2]" 1
402 1 14 A H2' 1 14 A HO2' 2.300 . 2.800 2.580 2.131 2.853 0.053 9 0 "[ . 1 . 2]" 1
403 1 14 A H2' 1 15 A H8 2.800 . 2.800 2.410 2.121 2.805 0.005 14 0 "[ . 1 . 2]" 1
404 1 14 A H1' 1 14 A H3' 3.800 . 3.800 3.859 3.822 3.902 0.102 1 0 "[ . 1 . 2]" 1
405 1 14 A H2' 1 14 A H3' 2.800 . 2.800 2.398 2.372 2.415 . 0 0 "[ . 1 . 2]" 1
406 1 14 A H3' 1 14 A H8 3.800 . 3.800 3.471 3.289 3.658 . 0 0 "[ . 1 . 2]" 1
407 1 14 A H3' 1 15 A H8 3.800 . 3.800 2.402 1.964 2.905 . 0 0 "[ . 1 . 2]" 1
408 1 14 A H1' 1 14 A H4' 3.800 . 3.800 3.485 3.329 3.608 . 0 0 "[ . 1 . 2]" 1
409 1 14 A H4' 1 14 A H8 2.700 . 5.300 4.365 4.244 4.533 . 0 0 "[ . 1 . 2]" 1
410 1 14 A H4' 1 15 A H8 2.700 . 5.300 5.037 4.605 5.350 0.050 1 0 "[ . 1 . 2]" 1
411 1 14 A H1' 1 14 A H5'' 3.300 . 6.500 5.180 5.129 5.226 . 0 0 "[ . 1 . 2]" 1
412 1 14 A H5'' 1 14 A H8 2.700 . 5.300 4.151 3.739 4.457 . 0 0 "[ . 1 . 2]" 1
413 1 14 A H1' 1 14 A H5' 3.300 . 6.500 4.780 4.657 4.930 . 0 0 "[ . 1 . 2]" 1
414 1 14 A H5' 1 14 A H8 2.700 . 5.300 3.810 3.447 4.272 . 0 0 "[ . 1 . 2]" 1
415 1 14 A H1' 1 14 A HO2' 3.800 . 3.800 3.031 1.989 3.461 . 0 0 "[ . 1 . 2]" 1
416 1 14 A H8 1 14 A HO2' 3.300 . 6.500 5.506 4.956 5.822 . 0 0 "[ . 1 . 2]" 1
417 1 14 A HO2' 1 15 A H8 2.700 . 5.300 4.298 3.411 5.323 0.023 14 0 "[ . 1 . 2]" 1
418 1 15 A H1' 1 16 C H1' 3.300 . 6.500 5.334 4.730 6.230 . 0 0 "[ . 1 . 2]" 1
419 1 15 A H1' 1 16 C H6 2.700 . 5.300 4.626 4.336 5.050 . 0 0 "[ . 1 . 2]" 1
420 1 15 A H2 1 16 C H1' 3.800 . 3.800 2.917 2.612 3.255 . 0 0 "[ . 1 . 2]" 1
421 1 15 A H2 1 16 C H6 2.700 . 5.300 4.840 4.244 5.301 0.001 2 0 "[ . 1 . 2]" 1
422 1 15 A H1' 1 15 A H2' 2.800 . 2.800 2.754 2.726 2.799 . 0 0 "[ . 1 . 2]" 1
423 1 15 A H2' 1 15 A H8 2.700 . 5.300 4.338 4.147 4.438 . 0 0 "[ . 1 . 2]" 1
424 1 15 A H2' 1 15 A HO2' 2.300 . 2.800 2.619 2.116 2.860 0.060 11 0 "[ . 1 . 2]" 1
425 1 15 A H2' 1 16 C H5 2.700 . 5.300 3.889 3.369 4.529 . 0 0 "[ . 1 . 2]" 1
426 1 15 A H2' 1 16 C H6 2.800 . 2.800 2.072 1.758 2.573 0.042 8 0 "[ . 1 . 2]" 1
427 1 15 A H1' 1 15 A H3' 3.800 . 3.800 3.841 3.809 3.892 0.092 14 0 "[ . 1 . 2]" 1
428 1 15 A H2 1 15 A H3' 3.300 . 6.500 6.140 5.894 6.540 0.040 5 0 "[ . 1 . 2]" 1
429 1 15 A H3' 1 15 A H8 3.800 . 3.800 3.392 3.000 3.677 . 0 0 "[ . 1 . 2]" 1
430 1 15 A H3' 1 15 A HO2' 3.800 . 3.800 3.513 3.324 3.923 0.123 19 0 "[ . 1 . 2]" 1
431 1 15 A H3' 1 16 C H5 2.700 . 5.300 2.850 2.324 3.367 . 0 0 "[ . 1 . 2]" 1
432 1 15 A H3' 1 16 C H6 3.800 . 3.800 2.289 1.800 2.853 0.000 9 0 "[ . 1 . 2]" 1
433 1 15 A H8 1 16 C H5 2.700 . 5.300 4.206 3.850 4.753 . 0 0 "[ . 1 . 2]" 1
434 1 15 A H8 1 16 C H6 3.300 . 6.500 4.908 4.546 5.431 . 0 0 "[ . 1 . 2]" 1
435 1 15 A H1' 1 15 A HO2' 3.800 . 3.800 3.058 1.977 3.480 . 0 0 "[ . 1 . 2]" 1
436 1 15 A H8 1 15 A HO2' 3.300 . 6.500 5.401 4.911 5.823 . 0 0 "[ . 1 . 2]" 1
437 1 15 A HO2' 1 16 C H1' 3.200 . 6.300 5.178 3.874 6.002 . 0 0 "[ . 1 . 2]" 1
438 1 15 A HO2' 1 16 C H4' 2.700 . 5.300 4.709 3.774 5.328 0.028 1 0 "[ . 1 . 2]" 1
439 1 15 A HO2' 1 16 C H6 2.700 . 5.300 4.136 3.533 4.911 . 0 0 "[ . 1 . 2]" 1
440 1 16 C H1' 1 17 G H1' 2.700 . 5.300 4.947 4.650 5.316 0.016 13 0 "[ . 1 . 2]" 1
441 1 16 C H1' 1 17 G H8 2.700 . 5.300 4.874 4.729 5.060 . 0 0 "[ . 1 . 2]" 1
442 1 16 C H1' 1 16 C H2' 2.800 . 2.800 2.770 2.744 2.804 0.004 13 0 "[ . 1 . 2]" 1
443 1 16 C H2' 1 16 C H5 3.300 . 6.500 5.617 5.572 5.674 . 0 0 "[ . 1 . 2]" 1
444 1 16 C H2' 1 16 C H6 2.700 . 5.300 4.250 4.210 4.292 . 0 0 "[ . 1 . 2]" 1
445 1 16 C H2' 1 16 C HO2' 2.300 . 2.800 2.633 2.144 2.847 0.047 16 0 "[ . 1 . 2]" 1
446 1 16 C H2' 1 17 G H8 2.800 . 2.800 2.616 2.376 2.820 0.020 3 0 "[ . 1 . 2]" 1
447 1 16 C H1' 1 16 C H3' 3.800 . 3.800 3.814 3.761 3.866 0.066 9 0 "[ . 1 . 2]" 1
448 1 16 C H3' 1 16 C H5 3.300 . 6.500 4.775 4.531 5.078 . 0 0 "[ . 1 . 2]" 1
449 1 16 C H3' 1 16 C H6 3.800 . 3.800 3.295 3.120 3.459 . 0 0 "[ . 1 . 2]" 1
450 1 16 C H3' 1 17 G H8 3.800 . 3.800 2.184 1.838 2.445 . 0 0 "[ . 1 . 2]" 1
451 1 16 C H1' 1 16 C H4' 3.800 . 3.800 3.482 3.365 3.581 . 0 0 "[ . 1 . 2]" 1
452 1 16 C H4' 1 16 C H6 2.700 . 5.300 4.058 3.977 4.147 . 0 0 "[ . 1 . 2]" 1
453 1 16 C H4' 1 17 G H8 2.700 . 5.300 5.063 4.745 5.331 0.031 9 0 "[ . 1 . 2]" 1
454 1 16 C H41 1 17 G H8 2.700 . 5.300 5.375 5.333 5.447 0.147 20 0 "[ . 1 . 2]" 1
455 1 16 C H1' 1 16 C H5'' 3.300 . 6.500 5.171 5.102 5.246 . 0 0 "[ . 1 . 2]" 1
456 1 16 C H4' 1 16 C H5'' 2.800 . 2.800 2.540 2.384 2.678 . 0 0 "[ . 1 . 2]" 1
457 1 16 C H5'' 1 16 C H6 2.700 . 5.300 3.929 3.538 4.226 . 0 0 "[ . 1 . 2]" 1
458 1 16 C H1' 1 16 C H5' 3.300 . 6.500 4.820 4.648 5.009 . 0 0 "[ . 1 . 2]" 1
459 1 16 C H4' 1 16 C H5' 2.800 . 2.800 2.334 2.236 2.468 . 0 0 "[ . 1 . 2]" 1
460 1 16 C H5' 1 16 C H6 2.700 . 5.300 3.623 3.244 3.972 . 0 0 "[ . 1 . 2]" 1
461 1 16 C H1' 1 16 C HO2' 3.800 . 3.800 2.887 1.981 3.497 . 0 0 "[ . 1 . 2]" 1
462 1 16 C HO2' 1 17 G H8 2.700 . 5.300 4.807 4.242 5.306 0.006 4 0 "[ . 1 . 2]" 1
463 1 17 G H1 1 18 U H1' 2.700 . 5.300 4.056 3.724 4.540 . 0 0 "[ . 1 . 2]" 1
464 1 17 G H1 1 18 U H3 3.800 . 3.800 3.689 3.422 3.828 0.028 8 0 "[ . 1 . 2]" 1
465 1 17 G H1 1 18 U H5 3.300 . 6.500 5.856 5.383 6.400 . 0 0 "[ . 1 . 2]" 1
466 1 17 G H1' 1 18 U H5 3.300 . 6.500 5.539 5.282 5.765 . 0 0 "[ . 1 . 2]" 1
467 1 17 G H1' 1 18 U H6 2.700 . 5.300 4.824 4.576 5.062 . 0 0 "[ . 1 . 2]" 1
468 1 17 G H1' 1 17 G H2' 2.800 . 2.800 2.811 2.783 2.849 0.049 10 0 "[ . 1 . 2]" 1
469 1 17 G H2' 1 17 G H8 2.700 . 5.300 4.374 4.262 4.455 . 0 0 "[ . 1 . 2]" 1
470 1 17 G H2' 1 17 G HO2' 2.800 . 3.800 2.701 2.175 2.866 . 0 0 "[ . 1 . 2]" 1
471 1 17 G H2' 1 18 U H1' 2.700 . 5.300 3.528 2.818 4.250 . 0 0 "[ . 1 . 2]" 1
472 1 17 G H2' 1 18 U H5 3.800 . 3.800 3.755 3.269 3.878 0.078 3 0 "[ . 1 . 2]" 1
473 1 17 G H2' 1 18 U H5'' 2.700 . 5.300 4.863 4.487 5.169 . 0 0 "[ . 1 . 2]" 1
474 1 17 G H2' 1 18 U H5' 2.700 . 5.300 3.893 3.253 4.547 . 0 0 "[ . 1 . 2]" 1
475 1 17 G H2' 1 18 U H6 2.800 . 2.800 2.180 1.978 2.448 . 0 0 "[ . 1 . 2]" 1
476 1 17 G H1' 1 17 G H3' 3.800 . 3.800 3.845 3.817 3.884 0.084 10 0 "[ . 1 . 2]" 1
477 1 17 G H2' 1 17 G H3' 2.800 . 2.800 2.402 2.385 2.418 . 0 0 "[ . 1 . 2]" 1
478 1 17 G H3' 1 17 G H8 3.800 . 3.800 3.745 3.541 3.840 0.040 14 0 "[ . 1 . 2]" 1
479 1 17 G H3' 1 18 U H5 3.800 . 3.800 2.738 2.283 3.184 . 0 0 "[ . 1 . 2]" 1
480 1 17 G H3' 1 18 U H6 3.800 . 3.800 2.416 1.942 2.944 . 0 0 "[ . 1 . 2]" 1
481 1 17 G H1' 1 17 G H4' 2.700 . 5.300 3.312 3.161 3.462 . 0 0 "[ . 1 . 2]" 1
482 1 17 G H4' 1 17 G H8 2.700 . 5.300 4.530 4.470 4.614 . 0 0 "[ . 1 . 2]" 1
483 1 17 G H4' 1 18 U H6 2.700 . 5.300 5.024 4.626 5.308 0.008 2 0 "[ . 1 . 2]" 1
484 1 17 G H5'' 1 17 G H8 2.700 . 5.300 4.474 4.248 4.813 . 0 0 "[ . 1 . 2]" 1
485 1 17 G H5' 1 17 G H8 2.700 . 5.300 4.408 3.982 4.688 . 0 0 "[ . 1 . 2]" 1
486 1 17 G H8 1 18 U H5 2.700 . 5.300 4.217 3.860 4.567 . 0 0 "[ . 1 . 2]" 1
487 1 17 G H8 1 18 U H6 3.300 . 6.500 5.170 4.814 5.720 . 0 0 "[ . 1 . 2]" 1
488 1 17 G H1' 1 17 G HO2' 2.800 . 2.800 2.232 1.920 2.823 0.023 2 0 "[ . 1 . 2]" 1
489 1 17 G HO2' 1 18 U H6 2.700 . 5.300 4.653 4.013 5.058 . 0 0 "[ . 1 . 2]" 1
490 1 17 G Q2 1 18 U H1' 2.385 . 4.670 2.127 1.842 2.664 . 0 0 "[ . 1 . 2]" 1
491 1 18 U H1' 1 19 C H6 2.700 . 5.300 5.122 4.920 5.306 0.006 1 0 "[ . 1 . 2]" 1
492 1 18 U H1' 1 18 U H2' 2.800 . 2.800 2.785 2.760 2.810 0.010 12 0 "[ . 1 . 2]" 1
493 1 18 U H2' 1 18 U H3 2.700 . 5.300 4.372 4.270 4.437 . 0 0 "[ . 1 . 2]" 1
494 1 18 U H2' 1 18 U H6 2.700 . 5.300 4.154 4.064 4.318 . 0 0 "[ . 1 . 2]" 1
495 1 18 U H2' 1 19 C H1' 3.300 . 6.500 4.748 4.021 5.333 . 0 0 "[ . 1 . 2]" 1
496 1 18 U H2' 1 19 C H5 3.800 . 3.800 2.942 2.340 3.498 . 0 0 "[ . 1 . 2]" 1
497 1 18 U H2' 1 19 C H6 2.800 . 2.800 2.384 2.131 2.577 . 0 0 "[ . 1 . 2]" 1
498 1 18 U H3 1 19 C H1' 3.300 . 6.500 6.383 5.825 6.548 0.048 13 0 "[ . 1 . 2]" 1
499 1 18 U H3 1 19 C H41 3.800 . 3.800 3.258 2.818 3.667 . 0 0 "[ . 1 . 2]" 1
500 1 18 U H3 1 19 C H42 3.800 . 3.800 3.131 2.801 3.653 . 0 0 "[ . 1 . 2]" 1
501 1 18 U H3 1 19 C H5 2.700 . 5.300 3.892 3.152 4.584 . 0 0 "[ . 1 . 2]" 1
502 1 18 U H3 1 19 C H6 3.300 . 6.500 5.307 4.596 5.929 . 0 0 "[ . 1 . 2]" 1
503 1 18 U H1' 1 18 U H3' 3.800 . 3.800 3.862 3.824 3.907 0.107 7 0 "[ . 1 . 2]" 1
504 1 18 U H3' 1 18 U H5 2.700 . 5.300 4.926 4.702 5.162 . 0 0 "[ . 1 . 2]" 1
505 1 18 U H3' 1 18 U H6 3.800 . 3.800 3.297 3.121 3.611 . 0 0 "[ . 1 . 2]" 1
506 1 18 U H3' 1 19 C H5 3.800 . 3.800 3.096 2.617 3.796 . 0 0 "[ . 1 . 2]" 1
507 1 18 U H3' 1 19 C H6 3.800 . 3.800 3.373 2.813 3.693 . 0 0 "[ . 1 . 2]" 1
508 1 18 U H1' 1 18 U H4' 3.800 . 3.800 3.464 3.305 3.552 . 0 0 "[ . 1 . 2]" 1
509 1 18 U H2' 1 18 U H4' 3.800 . 3.800 3.828 3.770 3.862 0.062 7 0 "[ . 1 . 2]" 1
510 1 18 U H4' 1 18 U H6 2.700 . 5.300 4.036 3.945 4.159 . 0 0 "[ . 1 . 2]" 1
511 1 18 U H5 1 19 C H5 3.300 . 6.500 4.956 4.371 5.392 . 0 0 "[ . 1 . 2]" 1
512 1 18 U H1' 1 18 U H5'' 3.300 . 6.500 5.139 5.063 5.224 . 0 0 "[ . 1 . 2]" 1
513 1 18 U H4' 1 18 U H5'' 2.800 . 2.800 2.579 2.417 2.708 . 0 0 "[ . 1 . 2]" 1
514 1 18 U H5'' 1 18 U H6 2.700 . 5.300 3.805 3.386 4.217 . 0 0 "[ . 1 . 2]" 1
515 1 18 U H1' 1 18 U H5' 3.300 . 6.500 4.840 4.673 4.998 . 0 0 "[ . 1 . 2]" 1
516 1 18 U H4' 1 18 U H5' 2.800 . 2.800 2.308 2.224 2.436 . 0 0 "[ . 1 . 2]" 1
517 1 18 U H5' 1 18 U H6 2.700 . 5.300 3.645 3.224 3.946 . 0 0 "[ . 1 . 2]" 1
518 1 18 U H6 1 19 C H5 3.300 . 6.500 4.694 4.320 5.004 . 0 0 "[ . 1 . 2]" 1
519 1 18 U H6 1 19 C H6 3.300 . 6.500 5.952 5.629 6.286 . 0 0 "[ . 1 . 2]" 1
520 1 18 U H1' 1 18 U HO2' 3.800 . 3.800 3.042 1.993 3.427 . 0 0 "[ . 1 . 2]" 1
521 1 18 U HO2' 1 19 C H6 2.700 . 5.300 4.136 2.975 5.103 . 0 0 "[ . 1 . 2]" 1
522 1 19 C H1' 1 19 C H2' 2.800 . 2.800 2.811 2.776 2.853 0.053 3 0 "[ . 1 . 2]" 1
523 1 19 C H2' 1 19 C H5 2.700 . 5.300 5.177 5.009 5.299 . 0 0 "[ . 1 . 2]" 1
524 1 19 C H2' 1 19 C H6 3.800 . 3.800 3.650 3.448 3.812 0.012 19 0 "[ . 1 . 2]" 1
525 1 19 C H2' 1 19 C H3' 2.800 . 2.800 2.380 2.361 2.400 . 0 0 "[ . 1 . 2]" 1
526 1 19 C H3' 1 19 C H5 2.700 . 5.300 4.669 4.299 4.869 . 0 0 "[ . 1 . 2]" 1
527 1 19 C H3' 1 19 C H6 2.800 . 2.800 2.729 2.290 2.848 0.048 16 0 "[ . 1 . 2]" 1
528 1 19 C H1' 1 19 C H4' 3.800 . 3.800 3.428 3.233 3.563 . 0 0 "[ . 1 . 2]" 1
529 1 19 C H4' 1 19 C H6 3.300 . 6.500 3.964 3.780 4.154 . 0 0 "[ . 1 . 2]" 1
530 1 19 C H1' 1 19 C H5'' 2.700 . 5.300 5.161 5.050 5.224 . 0 0 "[ . 1 . 2]" 1
531 1 19 C H2' 1 19 C H5'' 2.700 . 5.300 4.878 4.530 5.134 . 0 0 "[ . 1 . 2]" 1
532 1 19 C H3' 1 19 C H5'' 3.800 . 3.800 2.806 2.318 3.165 . 0 0 "[ . 1 . 2]" 1
533 1 19 C H5'' 1 19 C H6 2.700 . 5.300 3.677 3.042 4.050 . 0 0 "[ . 1 . 2]" 1
534 1 19 C H1' 1 19 C H5' 2.700 . 5.300 4.677 4.483 4.993 . 0 0 "[ . 1 . 2]" 1
535 1 19 C H2' 1 19 C H5' 2.700 . 5.300 5.297 5.156 5.384 0.084 15 0 "[ . 1 . 2]" 1
536 1 19 C H3' 1 19 C H5' 3.800 . 3.800 3.672 3.595 3.733 . 0 0 "[ . 1 . 2]" 1
537 1 19 C H5' 1 19 C H6 2.700 . 5.300 3.412 2.812 3.953 . 0 0 "[ . 1 . 2]" 1
538 1 1 G H2' 1 1 G Q5' 3.740 . 7.380 4.413 4.308 4.519 . 0 0 "[ . 1 . 2]" 1
539 1 2 G H1' 1 2 G Q5' 3.740 . 7.380 4.451 4.376 4.493 . 0 0 "[ . 1 . 2]" 1
540 1 2 G Q5' 1 2 G H8 2.315 . 4.530 3.619 3.192 3.932 . 0 0 "[ . 1 . 2]" 1
541 1 2 G H2' 1 3 C Q5' 3.140 . 6.180 3.731 3.126 4.294 . 0 0 "[ . 1 . 2]" 1
542 1 2 G HO2' 1 3 C Q5' 3.140 . 6.180 3.572 2.540 5.194 . 0 0 "[ . 1 . 2]" 1
543 1 3 C H3' 1 3 C Q5' 2.025 . 3.950 2.610 2.378 2.885 . 0 0 "[ . 1 . 2]" 1
544 1 3 C Q5' 1 3 C H6 2.315 . 4.530 3.184 2.938 3.462 . 0 0 "[ . 1 . 2]" 1
545 1 3 C HO2' 1 4 G Q5' 3.140 . 6.180 3.910 2.795 5.227 . 0 0 "[ . 1 . 2]" 1
546 1 4 G H3' 1 4 G Q5' 1.805 . 3.510 2.465 2.259 2.792 . 0 0 "[ . 1 . 2]" 1
547 1 4 G Q5' 1 4 G H8 2.315 . 4.530 3.526 3.188 3.874 . 0 0 "[ . 1 . 2]" 1
548 1 4 G HO2' 1 5 U Q5' 3.140 . 6.180 3.032 2.019 4.411 . 0 0 "[ . 1 . 2]" 1
549 1 4 G H1 1 15 A Q6 3.735 . 7.370 3.431 2.955 3.838 . 0 0 "[ . 1 . 2]" 1
550 1 5 U H5 1 5 U Q5' 3.740 . 7.380 5.035 4.801 5.241 . 0 0 "[ . 1 . 2]" 1
551 1 5 U Q5' 1 5 U H6 2.315 . 4.530 3.139 2.879 3.336 . 0 0 "[ . 1 . 2]" 1
552 1 5 U HO2' 1 6 U Q5' 3.140 . 6.180 2.779 1.917 3.392 . 0 0 "[ . 1 . 2]" 1
553 1 6 U H1' 1 6 U Q5' 3.140 . 6.180 4.308 4.214 4.345 . 0 0 "[ . 1 . 2]" 1
554 1 6 U H5 1 6 U Q5' 3.740 . 7.380 5.229 4.856 5.726 . 0 0 "[ . 1 . 2]" 1
555 1 6 U Q5' 1 6 U H6 2.315 . 4.530 3.249 2.944 3.740 . 0 0 "[ . 1 . 2]" 1
556 1 6 U HO2' 1 7 C Q5' 3.140 . 6.180 3.180 2.857 4.465 . 0 0 "[ . 1 . 2]" 1
557 1 7 C H3' 1 7 C Q5' 2.025 . 3.950 2.337 2.287 2.443 . 0 0 "[ . 1 . 2]" 1
558 1 7 C H2' 1 7 C Q5' 3.140 . 6.180 4.346 4.308 4.408 . 0 0 "[ . 1 . 2]" 1
559 1 7 C H1' 1 7 C Q5' 3.140 . 6.180 4.479 4.458 4.492 . 0 0 "[ . 1 . 2]" 1
560 1 7 C H5 1 7 C Q5' 3.740 . 7.380 4.853 4.507 5.101 . 0 0 "[ . 1 . 2]" 1
561 1 8 G H3' 1 9 C Q5' 2.980 . 5.860 3.896 3.554 4.010 . 0 0 "[ . 1 . 2]" 1
562 1 8 G H1' 1 13 G Q2 2.385 . 4.670 2.264 1.851 2.860 . 0 0 "[ . 1 . 2]" 1
563 1 9 C Q5' 1 12 A H2 3.740 . 7.380 5.226 4.547 5.986 . 0 0 "[ . 1 . 2]" 1
564 1 9 C H3' 1 10 U Q5' 3.140 . 6.180 4.220 3.721 4.600 . 0 0 "[ . 1 . 2]" 1
565 1 9 C H2' 1 10 U Q5' 3.140 . 6.180 3.942 2.750 5.048 . 0 0 "[ . 1 . 2]" 1
566 1 10 U H2' 1 10 U Q5' 2.315 . 4.530 3.122 2.812 3.407 . 0 0 "[ . 1 . 2]" 1
567 1 10 U H1' 1 10 U Q5' 2.980 . 5.860 4.307 4.272 4.364 . 0 0 "[ . 1 . 2]" 1
568 1 10 U H5 1 10 U Q5' 3.740 . 7.380 5.336 5.038 5.604 . 0 0 "[ . 1 . 2]" 1
569 1 10 U Q5' 1 10 U H6 2.390 . 4.680 3.346 3.095 3.569 . 0 0 "[ . 1 . 2]" 1
570 1 13 G HO2' 1 14 A Q5' 3.140 . 6.180 3.900 3.133 4.929 . 0 0 "[ . 1 . 2]" 1
571 1 13 G H1 1 14 A Q6 3.735 . 7.370 4.260 3.758 4.617 . 0 0 "[ . 1 . 2]" 1
572 1 14 A H3' 1 14 A Q5' 2.025 . 3.950 2.635 2.463 2.784 . 0 0 "[ . 1 . 2]" 1
573 1 14 A H1' 1 14 A Q5' 2.980 . 5.860 4.411 4.340 4.474 . 0 0 "[ . 1 . 2]" 1
574 1 14 A Q5' 1 15 A H8 3.740 . 7.380 4.707 4.299 5.217 . 0 0 "[ . 1 . 2]" 1
575 1 14 A HO2' 1 15 A Q5' 3.140 . 6.180 4.208 2.529 6.039 . 0 0 "[ . 1 . 2]" 1
576 1 14 A H2 1 15 A Q6 3.735 . 7.370 5.158 4.730 5.482 . 0 0 "[ . 1 . 2]" 1
577 1 15 A HO2' 1 16 C Q5' 3.140 . 6.180 3.501 2.661 4.827 . 0 0 "[ . 1 . 2]" 1
578 1 16 C H3' 1 16 C Q5' 2.025 . 3.950 2.644 2.417 2.930 . 0 0 "[ . 1 . 2]" 1
579 1 16 C H1' 1 16 C Q5' 2.980 . 5.860 4.427 4.347 4.507 . 0 0 "[ . 1 . 2]" 1
580 1 16 C Q5' 1 16 C H6 2.315 . 4.530 3.319 3.117 3.577 . 0 0 "[ . 1 . 2]" 1
581 1 16 C HO2' 1 17 G Q5' 3.140 . 6.180 4.189 2.970 5.468 . 0 0 "[ . 1 . 2]" 1
582 1 17 G H3' 1 17 G Q5' 2.025 . 3.950 2.534 2.425 2.840 . 0 0 "[ . 1 . 2]" 1
583 1 17 G H2' 1 17 G Q5' 3.140 . 6.180 4.440 4.393 4.563 . 0 0 "[ . 1 . 2]" 1
584 1 17 G Q5' 1 17 G H8 2.315 . 4.530 3.944 3.769 4.169 . 0 0 "[ . 1 . 2]" 1
585 1 17 G HO2' 1 18 U Q5' 3.140 . 6.180 4.456 3.305 5.347 . 0 0 "[ . 1 . 2]" 1
586 1 18 U H2' 1 19 C Q5' 3.140 . 6.180 3.654 2.525 4.388 . 0 0 "[ . 1 . 2]" 1
587 1 18 U H5 1 19 C Q4 3.735 . 7.370 4.398 3.884 4.806 . 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 36
_Distance_constraint_stats_list.Viol_count 197
_Distance_constraint_stats_list.Viol_total 129.064
_Distance_constraint_stats_list.Viol_max 0.114
_Distance_constraint_stats_list.Viol_rms 0.0209
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0090
_Distance_constraint_stats_list.Viol_average_violations_only 0.0328
_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 0.466 0.067 5 0 "[ . 1 . 2]"
1 2 G 0.338 0.054 2 0 "[ . 1 . 2]"
1 3 C 0.524 0.072 19 0 "[ . 1 . 2]"
1 4 G 0.485 0.058 20 0 "[ . 1 . 2]"
1 5 U 0.268 0.043 20 0 "[ . 1 . 2]"
1 6 U 2.930 0.114 17 0 "[ . 1 . 2]"
1 7 C 1.443 0.093 16 0 "[ . 1 . 2]"
1 13 G 1.443 0.093 16 0 "[ . 1 . 2]"
1 14 A 2.930 0.114 17 0 "[ . 1 . 2]"
1 15 A 0.268 0.043 20 0 "[ . 1 . 2]"
1 16 C 0.485 0.058 20 0 "[ . 1 . 2]"
1 17 G 0.524 0.072 19 0 "[ . 1 . 2]"
1 18 U 0.338 0.054 2 0 "[ . 1 . 2]"
1 19 C 0.466 0.067 5 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 H22 1 19 C O2 1.900 . 2.000 1.846 1.733 2.034 0.067 5 0 "[ . 1 . 2]" 2
2 1 1 G N2 1 19 C O2 2.850 2.700 3.000 2.807 2.743 2.918 . 0 0 "[ . 1 . 2]" 2
3 1 1 G H1 1 19 C N3 1.900 . 2.000 1.901 1.843 1.981 . 0 0 "[ . 1 . 2]" 2
4 1 1 G N1 1 19 C N3 2.850 2.700 3.000 2.873 2.832 2.904 . 0 0 "[ . 1 . 2]" 2
5 1 1 G O6 1 19 C H41 1.900 . 2.000 1.899 1.770 2.047 0.047 3 0 "[ . 1 . 2]" 2
6 1 1 G O6 1 19 C N4 2.850 2.700 3.000 2.866 2.771 2.992 . 0 0 "[ . 1 . 2]" 2
7 1 2 G H1 1 18 U O2 1.900 . 2.000 1.846 1.775 2.054 0.054 2 0 "[ . 1 . 2]" 2
8 1 2 G N1 1 18 U O2 2.850 2.700 3.000 2.830 2.767 3.015 0.015 2 0 "[ . 1 . 2]" 2
9 1 2 G O6 1 18 U H3 1.900 . 2.000 1.920 1.770 2.046 0.046 13 0 "[ . 1 . 2]" 2
10 1 2 G O6 1 18 U N3 2.850 2.700 3.000 2.882 2.759 3.005 0.005 12 0 "[ . 1 . 2]" 2
11 1 3 C O2 1 17 G H22 1.900 . 2.000 1.791 1.728 1.888 0.072 19 0 "[ . 1 . 2]" 2
12 1 3 C O2 1 17 G N2 2.850 2.700 3.000 2.787 2.732 2.857 . 0 0 "[ . 1 . 2]" 2
13 1 3 C N3 1 17 G H1 1.900 . 2.000 1.831 1.767 1.890 0.033 5 0 "[ . 1 . 2]" 2
14 1 3 C N3 1 17 G N1 2.850 2.700 3.000 2.827 2.767 2.880 . 0 0 "[ . 1 . 2]" 2
15 1 3 C H41 1 17 G O6 1.900 . 2.000 1.834 1.763 1.982 0.037 11 0 "[ . 1 . 2]" 2
16 1 3 C N4 1 17 G O6 2.850 2.700 3.000 2.821 2.766 2.934 . 0 0 "[ . 1 . 2]" 2
17 1 4 G H22 1 16 C O2 1.900 . 2.000 1.868 1.755 2.021 0.045 3 0 "[ . 1 . 2]" 2
18 1 4 G N2 1 16 C O2 2.850 2.700 3.000 2.863 2.752 3.007 0.007 20 0 "[ . 1 . 2]" 2
19 1 4 G H1 1 16 C N3 1.900 . 2.000 1.871 1.821 1.959 . 0 0 "[ . 1 . 2]" 2
20 1 4 G N1 1 16 C N3 2.850 2.700 3.000 2.874 2.805 2.941 . 0 0 "[ . 1 . 2]" 2
21 1 4 G O6 1 16 C H41 1.900 . 2.000 2.000 1.816 2.058 0.058 20 0 "[ . 1 . 2]" 2
22 1 4 G O6 1 16 C N4 2.850 2.700 3.000 2.888 2.769 2.954 . 0 0 "[ . 1 . 2]" 2
23 1 5 U H3 1 15 A N1 1.900 . 2.000 1.804 1.782 1.870 0.018 6 0 "[ . 1 . 2]" 2
24 1 5 U N3 1 15 A N1 2.850 2.700 3.000 2.817 2.795 2.886 . 0 0 "[ . 1 . 2]" 2
25 1 5 U O4 1 15 A H61 1.900 . 2.000 1.968 1.802 2.043 0.043 20 0 "[ . 1 . 2]" 2
26 1 5 U O4 1 15 A N6 2.850 2.700 3.000 2.849 2.770 2.912 . 0 0 "[ . 1 . 2]" 2
27 1 6 U H3 1 14 A N1 1.900 . 2.000 1.727 1.686 1.764 0.114 8 0 "[ . 1 . 2]" 2
28 1 6 U N3 1 14 A N1 2.850 2.700 3.000 2.706 2.676 2.736 0.024 3 0 "[ . 1 . 2]" 2
29 1 6 U O4 1 14 A H61 1.900 . 2.000 2.070 2.025 2.114 0.114 17 0 "[ . 1 . 2]" 2
30 1 6 U O4 1 14 A N6 2.850 2.700 3.000 2.931 2.871 2.990 . 0 0 "[ . 1 . 2]" 2
31 1 7 C O2 1 13 G H22 1.900 . 2.000 1.986 1.850 2.057 0.057 18 0 "[ . 1 . 2]" 2
32 1 7 C O2 1 13 G N2 2.850 2.700 3.000 2.951 2.823 3.015 0.015 4 0 "[ . 1 . 2]" 2
33 1 7 C N3 1 13 G H1 1.900 . 2.000 1.798 1.746 1.834 0.054 4 0 "[ . 1 . 2]" 2
34 1 7 C N3 1 13 G N1 2.850 2.700 3.000 2.797 2.742 2.833 . 0 0 "[ . 1 . 2]" 2
35 1 7 C H41 1 13 G O6 1.900 . 2.000 2.046 1.957 2.093 0.093 16 0 "[ . 1 . 2]" 2
36 1 7 C N4 1 13 G O6 2.850 2.700 3.000 2.908 2.837 2.973 . 0 0 "[ . 1 . 2]" 2
stop_
save_
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