NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
468127 |
17ra   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_17ra
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 438
_Distance_constraint_stats_list.Viol_count 655
_Distance_constraint_stats_list.Viol_total 568.090
_Distance_constraint_stats_list.Viol_max 0.555
_Distance_constraint_stats_list.Viol_rms 0.0367
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0090
_Distance_constraint_stats_list.Viol_average_violations_only 0.0723
_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 0.602 0.051 10 0 "[ . 1 ]"
1 2 G 3.432 0.446 4 0 "[ . 1 ]"
1 3 C 2.960 0.555 4 1 "[ +. 1 ]"
1 4 G 4.447 0.555 4 1 "[ +. 1 ]"
1 5 U 2.546 0.138 11 0 "[ . 1 ]"
1 6 A 4.077 0.138 11 0 "[ . 1 ]"
1 7 A 2.787 0.118 9 0 "[ . 1 ]"
1 8 G 0.899 0.048 9 0 "[ . 1 ]"
1 9 G 2.307 0.091 5 0 "[ . 1 ]"
1 10 A 7.270 0.236 11 0 "[ . 1 ]"
1 11 U 7.639 0.272 11 0 "[ . 1 ]"
1 12 U 10.040 0.369 1 0 "[ . 1 ]"
1 13 A 11.959 0.369 1 0 "[ . 1 ]"
1 14 C 7.862 0.289 5 0 "[ . 1 ]"
1 15 C 1.192 0.104 5 0 "[ . 1 ]"
1 16 U 0.915 0.054 5 0 "[ . 1 ]"
1 17 A 3.813 0.184 7 0 "[ . 1 ]"
1 18 U 3.200 0.184 7 0 "[ . 1 ]"
1 19 G 1.766 0.286 8 0 "[ . 1 ]"
1 20 C 1.417 0.286 8 0 "[ . 1 ]"
1 21 C 2.945 0.446 4 0 "[ . 1 ]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 G H1 1 2 G H1' 4.400 . 7.000 6.152 5.485 6.753 . 0 0 "[ . 1 ]" 1
2 1 1 G H1 1 21 C H41 2.900 . 4.000 2.401 2.387 2.422 . 0 0 "[ . 1 ]" 1
3 1 1 G H1 1 21 C H42 2.900 . 4.000 4.009 4.007 4.014 0.014 3 0 "[ . 1 ]" 1
4 1 1 G H1 1 21 C H5 4.400 . 7.000 5.221 5.208 5.230 . 0 0 "[ . 1 ]" 1
5 1 1 G H1 1 21 C H6 4.400 . 7.000 6.053 6.041 6.069 . 0 0 "[ . 1 ]" 1
6 1 1 G H1' 1 1 G H8 3.400 . 5.000 3.798 3.747 3.821 . 0 0 "[ . 1 ]" 1
7 1 1 G H1' 1 2 G H1' 4.400 . 7.000 5.822 5.462 6.385 . 0 0 "[ . 1 ]" 1
8 1 1 G H1' 1 2 G H8 3.400 . 5.000 5.041 5.035 5.051 0.051 10 0 "[ . 1 ]" 1
9 1 1 G H2' 1 2 G H1' 4.400 . 7.000 4.405 4.161 4.647 . 0 0 "[ . 1 ]" 1
10 1 1 G H2' 1 2 G H5' 3.900 . 6.000 3.837 3.742 4.024 . 0 0 "[ . 1 ]" 1
11 1 1 G H2' 1 2 G H5'' 3.900 . 6.000 4.840 4.769 5.064 . 0 0 "[ . 1 ]" 1
12 1 1 G H2' 1 2 G H8 2.400 . 3.000 2.343 2.308 2.368 . 0 0 "[ . 1 ]" 1
13 1 2 G H1 1 19 G H1 3.400 . 5.000 4.645 4.226 5.002 0.002 7 0 "[ . 1 ]" 1
14 1 2 G H1 1 20 C H1' 3.900 . 6.000 5.675 5.650 5.698 . 0 0 "[ . 1 ]" 1
15 1 2 G H1 1 20 C H41 2.900 . 4.000 2.455 2.408 2.518 . 0 0 "[ . 1 ]" 1
16 1 2 G H1 1 20 C H42 2.900 . 4.000 4.016 4.012 4.024 0.024 3 0 "[ . 1 ]" 1
17 1 2 G H1 1 20 C H5 3.900 . 6.000 5.196 5.149 5.231 . 0 0 "[ . 1 ]" 1
18 1 2 G H1 1 21 C H1' 3.900 . 6.000 5.171 4.820 5.481 . 0 0 "[ . 1 ]" 1
19 1 2 G H1 1 21 C H42 3.400 . 5.000 5.228 5.010 5.446 0.446 4 0 "[ . 1 ]" 1
20 1 2 G H1 1 21 C H5 3.900 . 6.000 5.458 5.206 5.675 . 0 0 "[ . 1 ]" 1
21 1 2 G H1 1 21 C H6 3.900 . 6.000 5.759 5.418 6.004 0.004 11 0 "[ . 1 ]" 1
22 1 2 G H1' 1 2 G H8 3.400 . 5.000 3.791 3.769 3.814 . 0 0 "[ . 1 ]" 1
23 1 2 G H1' 1 3 C H5 4.400 . 7.000 5.995 5.609 6.436 . 0 0 "[ . 1 ]" 1
24 1 2 G H1' 1 3 C H6 3.900 . 6.000 5.560 5.495 5.615 . 0 0 "[ . 1 ]" 1
25 1 2 G H2' 1 2 G H8 3.900 . 6.000 3.822 3.739 3.892 . 0 0 "[ . 1 ]" 1
26 1 2 G H2' 1 3 C H1' 3.400 . 5.000 4.546 4.145 4.973 . 0 0 "[ . 1 ]" 1
27 1 2 G H2' 1 3 C H5 3.400 . 5.000 3.677 3.432 3.981 . 0 0 "[ . 1 ]" 1
28 1 2 G H2' 1 3 C H6 3.900 . 6.000 2.792 2.736 2.839 . 0 0 "[ . 1 ]" 1
29 1 2 G H3' 1 2 G H8 4.400 . 7.000 3.004 2.902 3.101 . 0 0 "[ . 1 ]" 1
30 1 2 G H3' 1 3 C H5 3.900 . 6.000 3.947 3.679 4.267 . 0 0 "[ . 1 ]" 1
31 1 2 G H5' 1 2 G H8 4.400 . 7.000 4.129 4.048 4.171 . 0 0 "[ . 1 ]" 1
32 1 2 G H5'' 1 2 G H8 3.400 . 5.000 4.254 4.176 4.306 . 0 0 "[ . 1 ]" 1
33 1 3 C H1' 1 3 C H5 4.400 . 7.000 5.407 5.396 5.415 . 0 0 "[ . 1 ]" 1
34 1 3 C H1' 1 3 C H6 3.400 . 5.000 3.674 3.652 3.688 . 0 0 "[ . 1 ]" 1
35 1 3 C H1' 1 4 G H1' 4.400 . 7.000 5.544 5.349 5.729 . 0 0 "[ . 1 ]" 1
36 1 3 C H1' 1 4 G H8 3.900 . 6.000 5.316 5.135 5.422 . 0 0 "[ . 1 ]" 1
37 1 3 C H2' 1 3 C H6 3.400 . 5.000 3.605 3.557 3.677 . 0 0 "[ . 1 ]" 1
38 1 3 C H2' 1 4 G H1' 3.400 . 5.000 4.260 4.184 4.314 . 0 0 "[ . 1 ]" 1
39 1 3 C H2' 1 4 G H5' 3.400 . 5.000 3.919 3.782 4.033 . 0 0 "[ . 1 ]" 1
40 1 3 C H2' 1 4 G H8 2.400 . 3.000 2.625 2.474 2.731 . 0 0 "[ . 1 ]" 1
41 1 3 C H3' 1 3 C H6 3.400 . 5.000 2.674 2.625 2.743 . 0 0 "[ . 1 ]" 1
42 1 3 C H3' 1 4 G H8 4.400 . 7.000 3.882 3.739 4.032 . 0 0 "[ . 1 ]" 1
43 1 3 C H4' 1 3 C H6 3.400 . 5.000 4.164 4.140 4.180 . 0 0 "[ . 1 ]" 1
44 1 3 C H41 1 19 G H1 2.900 . 4.000 2.435 2.408 2.454 . 0 0 "[ . 1 ]" 1
45 1 3 C H42 1 4 G H1 4.400 . 7.000 7.179 6.578 7.555 0.555 4 1 "[ +. 1 ]" 1
46 1 3 C H42 1 18 U H3 4.400 . 7.000 5.858 4.962 6.798 . 0 0 "[ . 1 ]" 1
47 1 3 C H42 1 19 G H1 2.900 . 4.000 4.012 4.002 4.020 0.020 10 0 "[ . 1 ]" 1
48 1 3 C H5' 1 3 C H6 4.400 . 7.000 4.027 3.928 4.085 . 0 0 "[ . 1 ]" 1
49 1 3 C H5'' 1 3 C H6 3.400 . 5.000 3.914 3.844 3.977 . 0 0 "[ . 1 ]" 1
50 1 4 G H1 1 5 U H1' 3.900 . 6.000 6.021 6.008 6.033 0.033 7 0 "[ . 1 ]" 1
51 1 4 G H1 1 5 U H3 4.400 . 7.000 4.788 4.551 4.954 . 0 0 "[ . 1 ]" 1
52 1 4 G H1 1 17 A H2 3.900 . 6.000 5.499 5.344 5.604 . 0 0 "[ . 1 ]" 1
53 1 4 G H1 1 17 A H61 3.900 . 6.000 4.382 4.006 5.116 . 0 0 "[ . 1 ]" 1
54 1 4 G H1 1 17 A H62 4.400 . 7.000 5.396 5.005 6.168 . 0 0 "[ . 1 ]" 1
55 1 4 G H1 1 18 U H1' 3.900 . 6.000 4.572 4.525 4.605 . 0 0 "[ . 1 ]" 1
56 1 4 G H1 1 18 U H3 2.900 . 4.000 2.948 2.913 2.964 . 0 0 "[ . 1 ]" 1
57 1 4 G H1 1 18 U H5 4.400 . 7.000 6.804 6.751 6.836 . 0 0 "[ . 1 ]" 1
58 1 4 G H1 1 19 G H1 4.400 . 7.000 4.689 4.483 4.945 . 0 0 "[ . 1 ]" 1
59 1 4 G H1 1 19 G H1' 3.900 . 6.000 4.553 4.071 5.079 . 0 0 "[ . 1 ]" 1
60 1 4 G H1 1 19 G H8 4.400 . 7.000 4.836 4.503 5.207 . 0 0 "[ . 1 ]" 1
61 1 4 G H1' 1 4 G H8 3.400 . 5.000 3.790 3.786 3.796 . 0 0 "[ . 1 ]" 1
62 1 4 G H1' 1 5 U H1' 4.400 . 7.000 6.975 6.845 7.017 0.017 3 0 "[ . 1 ]" 1
63 1 4 G H1' 1 5 U H5 3.400 . 5.000 5.089 5.078 5.101 0.101 10 0 "[ . 1 ]" 1
64 1 4 G H1' 1 5 U H6 3.900 . 6.000 5.013 4.928 5.093 . 0 0 "[ . 1 ]" 1
65 1 4 G H1' 1 19 G H1 3.900 . 6.000 5.873 5.588 6.018 0.018 10 0 "[ . 1 ]" 1
66 1 4 G H2' 1 4 G H8 3.400 . 5.000 3.834 3.821 3.849 . 0 0 "[ . 1 ]" 1
67 1 4 G H2' 1 5 U H1' 3.900 . 6.000 4.816 4.752 4.853 . 0 0 "[ . 1 ]" 1
68 1 4 G H2' 1 5 U H4' 4.400 . 7.000 5.089 4.987 5.140 . 0 0 "[ . 1 ]" 1
69 1 4 G H2' 1 5 U H5 3.900 . 6.000 3.167 3.097 3.246 . 0 0 "[ . 1 ]" 1
70 1 4 G H2' 1 5 U H5' 3.400 . 5.000 4.038 3.651 4.138 . 0 0 "[ . 1 ]" 1
71 1 4 G H2' 1 5 U H6 2.900 . 4.000 2.288 2.205 2.379 . 0 0 "[ . 1 ]" 1
72 1 4 G H21 1 5 U H3 4.400 . 7.000 6.131 5.745 6.331 . 0 0 "[ . 1 ]" 1
73 1 4 G H21 1 18 U H3 3.400 . 5.000 5.003 4.965 5.013 0.013 2 0 "[ . 1 ]" 1
74 1 4 G H21 1 19 G H1 3.900 . 6.000 5.652 5.582 5.711 . 0 0 "[ . 1 ]" 1
75 1 4 G H22 1 5 U H3 4.400 . 7.000 6.822 6.468 7.004 0.004 12 0 "[ . 1 ]" 1
76 1 4 G H22 1 18 U H3 4.400 . 7.000 6.404 6.371 6.430 . 0 0 "[ . 1 ]" 1
77 1 4 G H22 1 19 G H1 3.900 . 6.000 5.975 5.814 6.024 0.024 8 0 "[ . 1 ]" 1
78 1 4 G H3' 1 4 G H8 3.400 . 5.000 3.041 3.009 3.074 . 0 0 "[ . 1 ]" 1
79 1 4 G H3' 1 5 U H5 3.400 . 5.000 2.951 2.878 3.104 . 0 0 "[ . 1 ]" 1
80 1 4 G H3' 1 5 U H6 3.400 . 5.000 3.115 3.049 3.227 . 0 0 "[ . 1 ]" 1
81 1 4 G H4' 1 4 G H8 3.400 . 5.000 4.482 4.465 4.515 . 0 0 "[ . 1 ]" 1
82 1 4 G H5' 1 4 G H8 3.400 . 5.000 4.287 4.233 4.376 . 0 0 "[ . 1 ]" 1
83 1 4 G H5'' 1 4 G H8 3.400 . 5.000 4.263 4.207 4.358 . 0 0 "[ . 1 ]" 1
84 1 4 G H8 1 5 U H5 3.400 . 5.000 3.175 3.025 3.384 . 0 0 "[ . 1 ]" 1
85 1 4 G H8 1 19 G H1 3.900 . 6.000 5.926 5.740 6.023 0.023 11 0 "[ . 1 ]" 1
86 1 5 U H1' 1 5 U H5 4.400 . 7.000 5.352 5.345 5.360 . 0 0 "[ . 1 ]" 1
87 1 5 U H1' 1 5 U H6 3.400 . 5.000 3.611 3.598 3.626 . 0 0 "[ . 1 ]" 1
88 1 5 U H1' 1 6 A H8 3.400 . 5.000 5.095 5.050 5.138 0.138 11 0 "[ . 1 ]" 1
89 1 5 U H2' 1 5 U H5 4.400 . 7.000 5.257 5.230 5.284 . 0 0 "[ . 1 ]" 1
90 1 5 U H2' 1 5 U H6 3.400 . 5.000 3.756 3.713 3.792 . 0 0 "[ . 1 ]" 1
91 1 5 U H2' 1 6 A H1' 3.900 . 6.000 4.720 4.593 4.933 . 0 0 "[ . 1 ]" 1
92 1 5 U H2' 1 6 A H3' 3.900 . 6.000 4.735 4.286 5.267 . 0 0 "[ . 1 ]" 1
93 1 5 U H2' 1 6 A H4' 3.900 . 6.000 4.826 4.694 4.959 . 0 0 "[ . 1 ]" 1
94 1 5 U H2' 1 6 A H8 2.400 . 3.000 2.513 2.458 2.570 . 0 0 "[ . 1 ]" 1
95 1 5 U H3 1 17 A H2 2.900 . 4.000 3.361 3.314 3.399 . 0 0 "[ . 1 ]" 1
96 1 5 U H3 1 17 A H61 3.400 . 5.000 2.310 2.211 2.348 . 0 0 "[ . 1 ]" 1
97 1 5 U H3 1 17 A H62 3.400 . 5.000 3.844 3.778 3.905 . 0 0 "[ . 1 ]" 1
98 1 5 U H3 1 18 U H3 4.400 . 7.000 5.182 4.811 5.410 . 0 0 "[ . 1 ]" 1
99 1 5 U H3' 1 5 U H5 4.400 . 7.000 4.801 4.778 4.843 . 0 0 "[ . 1 ]" 1
100 1 5 U H3' 1 5 U H6 2.900 . 4.000 2.901 2.850 2.948 . 0 0 "[ . 1 ]" 1
101 1 5 U H3' 1 6 A H4' 4.400 . 7.000 6.409 6.207 6.545 . 0 0 "[ . 1 ]" 1
102 1 5 U H3' 1 6 A H8 3.400 . 5.000 3.983 3.761 4.233 . 0 0 "[ . 1 ]" 1
103 1 5 U H5' 1 5 U H6 4.400 . 7.000 3.862 3.697 3.895 . 0 0 "[ . 1 ]" 1
104 1 5 U H5'' 1 5 U H6 3.400 . 5.000 3.924 3.864 4.066 . 0 0 "[ . 1 ]" 1
105 1 5 U H6 1 6 A H8 4.400 . 7.000 5.589 5.360 5.899 . 0 0 "[ . 1 ]" 1
106 1 6 A H1' 1 6 A H8 3.400 . 5.000 3.860 3.835 3.875 . 0 0 "[ . 1 ]" 1
107 1 6 A H1' 1 7 A H1' 4.400 . 7.000 4.936 4.750 5.123 . 0 0 "[ . 1 ]" 1
108 1 6 A H1' 1 7 A H3' 4.400 . 7.000 6.876 6.741 6.931 . 0 0 "[ . 1 ]" 1
109 1 6 A H1' 1 7 A H8 3.400 . 5.000 5.054 5.034 5.082 0.082 12 0 "[ . 1 ]" 1
110 1 6 A H1' 1 17 A H2 3.400 . 5.000 5.034 5.019 5.046 0.046 4 0 "[ . 1 ]" 1
111 1 6 A H2 1 7 A H1' 4.400 . 7.000 4.571 3.488 5.367 . 0 0 "[ . 1 ]" 1
112 1 6 A H2 1 17 A H1' 3.900 . 6.000 3.512 3.236 3.843 . 0 0 "[ . 1 ]" 1
113 1 6 A H2 1 17 A H2 4.400 . 7.000 3.764 3.429 4.047 . 0 0 "[ . 1 ]" 1
114 1 6 A H2 1 17 A H8 4.400 . 7.000 5.818 5.515 6.284 . 0 0 "[ . 1 ]" 1
115 1 6 A H2' 1 6 A H8 2.400 . 3.000 3.086 3.051 3.106 0.106 2 0 "[ . 1 ]" 1
116 1 6 A H2' 1 7 A H1' 3.900 . 6.000 4.555 4.316 4.869 . 0 0 "[ . 1 ]" 1
117 1 6 A H2' 1 7 A H8 2.900 . 4.000 2.640 2.558 2.702 . 0 0 "[ . 1 ]" 1
118 1 6 A H3' 1 6 A H8 3.400 . 5.000 3.209 2.631 3.933 . 0 0 "[ . 1 ]" 1
119 1 6 A H3' 1 7 A H1' 4.400 . 7.000 6.630 6.481 6.751 . 0 0 "[ . 1 ]" 1
120 1 6 A H3' 1 7 A H8 3.400 . 5.000 4.373 4.226 4.527 . 0 0 "[ . 1 ]" 1
121 1 6 A H4' 1 6 A H8 4.400 . 7.000 4.588 4.451 4.715 . 0 0 "[ . 1 ]" 1
122 1 6 A H5' 1 6 A H8 3.400 . 5.000 4.350 4.044 4.635 . 0 0 "[ . 1 ]" 1
123 1 6 A H5'' 1 6 A H8 3.400 . 5.000 4.523 4.253 4.754 . 0 0 "[ . 1 ]" 1
124 1 6 A H8 1 7 A H1' 4.400 . 7.000 7.072 7.023 7.118 0.118 9 0 "[ . 1 ]" 1
125 1 6 A H8 1 7 A H8 4.400 . 7.000 4.863 4.676 5.214 . 0 0 "[ . 1 ]" 1
126 1 6 A H8 1 17 A H2 4.400 . 7.000 6.258 5.928 6.663 . 0 0 "[ . 1 ]" 1
127 1 7 A H1' 1 7 A H2 4.400 . 7.000 4.635 4.570 4.682 . 0 0 "[ . 1 ]" 1
128 1 7 A H1' 1 7 A H8 3.400 . 5.000 3.837 3.816 3.865 . 0 0 "[ . 1 ]" 1
129 1 7 A H1' 1 8 G H1' 4.400 . 7.000 5.488 5.249 5.778 . 0 0 "[ . 1 ]" 1
130 1 7 A H1' 1 8 G H8 3.400 . 5.000 5.037 5.022 5.045 0.045 12 0 "[ . 1 ]" 1
131 1 7 A H2 1 7 A H2' 4.400 . 7.000 5.244 5.119 5.419 . 0 0 "[ . 1 ]" 1
132 1 7 A H2 1 8 G H1' 3.400 . 5.000 4.982 4.803 5.048 0.048 9 0 "[ . 1 ]" 1
133 1 7 A H2 1 16 U H1' 3.400 . 5.000 4.337 4.105 4.675 . 0 0 "[ . 1 ]" 1
134 1 7 A H2 1 16 U H2' 3.400 . 5.000 5.041 5.024 5.054 0.054 5 0 "[ . 1 ]" 1
135 1 7 A H2 1 17 A H1' 3.400 . 5.000 4.922 4.586 5.055 0.055 7 0 "[ . 1 ]" 1
136 1 7 A H2' 1 7 A H8 2.900 . 4.000 3.647 3.508 3.733 . 0 0 "[ . 1 ]" 1
137 1 7 A H2' 1 8 G H1' 3.900 . 6.000 4.190 3.757 4.537 . 0 0 "[ . 1 ]" 1
138 1 7 A H2' 1 8 G H5' 3.900 . 6.000 4.131 3.942 4.296 . 0 0 "[ . 1 ]" 1
139 1 7 A H2' 1 8 G H5'' 3.900 . 6.000 4.955 4.775 5.078 . 0 0 "[ . 1 ]" 1
140 1 7 A H2' 1 8 G H8 2.900 . 4.000 2.410 2.342 2.515 . 0 0 "[ . 1 ]" 1
141 1 7 A H3' 1 7 A H8 4.400 . 7.000 2.783 2.613 2.906 . 0 0 "[ . 1 ]" 1
142 1 7 A H3' 1 8 G H8 4.400 . 7.000 3.570 2.912 4.146 . 0 0 "[ . 1 ]" 1
143 1 7 A H4' 1 7 A H8 4.400 . 7.000 4.417 4.399 4.485 . 0 0 "[ . 1 ]" 1
144 1 7 A H5' 1 7 A H8 3.400 . 5.000 4.274 4.177 4.585 . 0 0 "[ . 1 ]" 1
145 1 7 A H5'' 1 7 A H8 3.400 . 5.000 2.742 2.592 3.990 . 0 0 "[ . 1 ]" 1
146 1 8 G H1' 1 8 G H8 3.400 . 5.000 3.810 3.771 3.824 . 0 0 "[ . 1 ]" 1
147 1 8 G H1' 1 9 G H8 3.400 . 5.000 5.022 5.009 5.038 0.038 2 0 "[ . 1 ]" 1
148 1 8 G H2' 1 8 G H8 3.400 . 5.000 3.762 3.708 3.897 . 0 0 "[ . 1 ]" 1
149 1 8 G H2' 1 9 G H1' 3.400 . 5.000 3.969 3.744 4.385 . 0 0 "[ . 1 ]" 1
150 1 8 G H2' 1 9 G H5' 3.400 . 5.000 3.629 3.478 4.264 . 0 0 "[ . 1 ]" 1
151 1 8 G H2' 1 9 G H8 2.400 . 3.000 2.400 2.339 2.454 . 0 0 "[ . 1 ]" 1
152 1 8 G H3' 1 8 G H8 3.400 . 5.000 2.885 2.800 3.053 . 0 0 "[ . 1 ]" 1
153 1 8 G H3' 1 9 G H8 2.900 . 4.000 3.255 2.987 3.458 . 0 0 "[ . 1 ]" 1
154 1 8 G H4' 1 8 G H8 3.400 . 5.000 4.455 4.407 4.518 . 0 0 "[ . 1 ]" 1
155 1 8 G H5' 1 8 G H8 3.400 . 5.000 4.293 4.169 4.397 . 0 0 "[ . 1 ]" 1
156 1 8 G H5'' 1 8 G H8 3.400 . 5.000 4.203 4.057 4.400 . 0 0 "[ . 1 ]" 1
157 1 8 G H8 1 9 G H8 4.400 . 7.000 4.556 4.209 5.016 . 0 0 "[ . 1 ]" 1
158 1 9 G H1 1 10 A H1' 4.400 . 7.000 4.771 4.297 5.307 . 0 0 "[ . 1 ]" 1
159 1 9 G H1 1 14 C H41 2.900 . 4.000 2.691 2.627 2.750 . 0 0 "[ . 1 ]" 1
160 1 9 G H1 1 14 C H42 2.900 . 4.000 4.048 4.037 4.063 0.063 8 0 "[ . 1 ]" 1
161 1 9 G H1 1 14 C H5 4.400 . 7.000 5.065 5.025 5.120 . 0 0 "[ . 1 ]" 1
162 1 9 G H1 1 15 C H1' 4.400 . 7.000 5.600 5.234 6.048 . 0 0 "[ . 1 ]" 1
163 1 9 G H1 1 15 C H5 4.400 . 7.000 3.743 3.591 3.984 . 0 0 "[ . 1 ]" 1
164 1 9 G H1 1 15 C H6 4.400 . 7.000 4.723 4.324 4.954 . 0 0 "[ . 1 ]" 1
165 1 9 G H1' 1 9 G H8 3.400 . 5.000 3.730 3.710 3.758 . 0 0 "[ . 1 ]" 1
166 1 9 G H1' 1 10 A H8 3.900 . 6.000 4.548 4.346 4.675 . 0 0 "[ . 1 ]" 1
167 1 9 G H2' 1 9 G H8 3.400 . 5.000 4.034 3.970 4.100 . 0 0 "[ . 1 ]" 1
168 1 9 G H2' 1 10 A H4' 3.900 . 6.000 4.284 4.028 4.489 . 0 0 "[ . 1 ]" 1
169 1 9 G H2' 1 10 A H5' 3.400 . 5.000 4.001 3.758 4.164 . 0 0 "[ . 1 ]" 1
170 1 9 G H2' 1 10 A H5'' 3.400 . 5.000 5.011 4.833 5.077 0.077 8 0 "[ . 1 ]" 1
171 1 9 G H2' 1 10 A H8 2.900 . 4.000 2.110 1.914 2.250 . 0 0 "[ . 1 ]" 1
172 1 9 G H3' 1 9 G H8 3.400 . 5.000 3.163 3.054 3.354 . 0 0 "[ . 1 ]" 1
173 1 9 G H3' 1 10 A H8 2.900 . 4.000 2.333 2.240 2.436 . 0 0 "[ . 1 ]" 1
174 1 9 G H4' 1 9 G H8 4.400 . 7.000 4.480 4.438 4.516 . 0 0 "[ . 1 ]" 1
175 1 9 G H4' 1 10 A H8 3.400 . 5.000 5.064 5.049 5.091 0.091 5 0 "[ . 1 ]" 1
176 1 9 G H5' 1 9 G H8 3.400 . 5.000 4.273 4.179 4.359 . 0 0 "[ . 1 ]" 1
177 1 9 G H5' 1 10 A H8 3.900 . 6.000 6.013 5.918 6.087 0.087 11 0 "[ . 1 ]" 1
178 1 9 G H5'' 1 9 G H8 3.400 . 5.000 4.354 4.248 4.432 . 0 0 "[ . 1 ]" 1
179 1 9 G H5'' 1 10 A H8 3.900 . 6.000 4.977 4.839 5.114 . 0 0 "[ . 1 ]" 1
180 1 9 G H8 1 10 A H8 4.400 . 7.000 4.042 3.950 4.150 . 0 0 "[ . 1 ]" 1
181 1 10 A H1' 1 10 A H2 3.900 . 6.000 5.008 4.948 5.102 . 0 0 "[ . 1 ]" 1
182 1 10 A H1' 1 10 A H8 3.400 . 5.000 3.589 3.531 3.623 . 0 0 "[ . 1 ]" 1
183 1 10 A H1' 1 11 U H5' 4.400 . 7.000 4.439 4.364 4.572 . 0 0 "[ . 1 ]" 1
184 1 10 A H1' 1 11 U H6 4.400 . 7.000 5.323 5.270 5.420 . 0 0 "[ . 1 ]" 1
185 1 10 A H2 1 10 A H2' 3.400 . 5.000 4.023 3.861 4.114 . 0 0 "[ . 1 ]" 1
186 1 10 A H2 1 11 U H1' 3.400 . 5.000 5.035 5.003 5.112 0.112 11 0 "[ . 1 ]" 1
187 1 10 A H2 1 11 U H2' 3.900 . 6.000 6.117 6.002 6.189 0.189 4 0 "[ . 1 ]" 1
188 1 10 A H2 1 11 U H3' 4.400 . 7.000 6.618 6.205 6.875 . 0 0 "[ . 1 ]" 1
189 1 10 A H2 1 11 U H4' 4.400 . 7.000 4.565 4.093 5.018 . 0 0 "[ . 1 ]" 1
190 1 10 A H2 1 11 U H5' 4.400 . 7.000 3.874 3.167 4.272 . 0 0 "[ . 1 ]" 1
191 1 10 A H2 1 11 U H5'' 4.400 . 7.000 5.342 4.085 5.930 . 0 0 "[ . 1 ]" 1
192 1 10 A H2 1 12 U H1' 4.400 . 7.000 6.862 5.581 7.056 0.056 12 0 "[ . 1 ]" 1
193 1 10 A H2 1 12 U H4' 4.400 . 7.000 4.972 4.490 5.535 . 0 0 "[ . 1 ]" 1
194 1 10 A H2 1 12 U Q5' 4.400 . 7.000 6.030 5.429 6.669 . 0 0 "[ . 1 ]" 1
195 1 10 A H2 1 13 A H1' 4.400 . 7.000 4.235 3.969 5.048 . 0 0 "[ . 1 ]" 1
196 1 10 A H2 1 13 A H2' 4.400 . 7.000 6.939 6.761 7.054 0.054 8 0 "[ . 1 ]" 1
197 1 10 A H2 1 14 C H1' 3.400 . 5.000 4.856 4.210 5.191 0.191 5 0 "[ . 1 ]" 1
198 1 10 A H2 1 14 C H41 3.900 . 6.000 4.006 3.516 4.875 . 0 0 "[ . 1 ]" 1
199 1 10 A H2 1 14 C H42 3.900 . 6.000 4.628 4.080 5.636 . 0 0 "[ . 1 ]" 1
200 1 10 A H2 1 14 C H5 3.900 . 6.000 4.917 4.505 5.962 . 0 0 "[ . 1 ]" 1
201 1 10 A H2' 1 10 A H8 2.900 . 4.000 4.181 4.145 4.236 0.236 11 0 "[ . 1 ]" 1
202 1 10 A H2' 1 11 U H1' 3.900 . 6.000 5.660 5.535 5.891 . 0 0 "[ . 1 ]" 1
203 1 10 A H2' 1 11 U H5 3.400 . 5.000 4.004 3.623 4.448 . 0 0 "[ . 1 ]" 1
204 1 10 A H2' 1 11 U H5' 2.900 . 4.000 2.129 1.826 2.454 . 0 0 "[ . 1 ]" 1
205 1 10 A H2' 1 11 U H5'' 3.400 . 5.000 3.410 2.257 3.805 . 0 0 "[ . 1 ]" 1
206 1 10 A H2' 1 11 U H6 2.400 . 3.000 2.808 2.600 3.029 0.029 8 0 "[ . 1 ]" 1
207 1 10 A H3' 1 10 A H8 2.900 . 4.000 3.694 3.572 3.831 . 0 0 "[ . 1 ]" 1
208 1 10 A H3' 1 11 U H5 3.400 . 5.000 3.368 3.234 3.900 . 0 0 "[ . 1 ]" 1
209 1 10 A H3' 1 11 U H5' 3.400 . 5.000 3.826 2.875 4.105 . 0 0 "[ . 1 ]" 1
210 1 10 A H3' 1 11 U H5'' 3.400 . 5.000 4.510 3.992 4.690 . 0 0 "[ . 1 ]" 1
211 1 10 A H3' 1 11 U H6 2.900 . 4.000 2.899 2.788 3.174 . 0 0 "[ . 1 ]" 1
212 1 10 A H3' 1 13 A H2 4.400 . 7.000 6.309 5.848 6.839 . 0 0 "[ . 1 ]" 1
213 1 10 A H4' 1 10 A H8 3.400 . 5.000 4.606 4.582 4.654 . 0 0 "[ . 1 ]" 1
214 1 10 A H4' 1 11 U H5 4.400 . 7.000 6.161 6.046 6.700 . 0 0 "[ . 1 ]" 1
215 1 10 A H4' 1 11 U H6 4.400 . 7.000 5.769 5.711 6.053 . 0 0 "[ . 1 ]" 1
216 1 10 A H5' 1 10 A H8 3.400 . 5.000 4.381 4.335 4.473 . 0 0 "[ . 1 ]" 1
217 1 10 A H5' 1 11 U H5 4.400 . 7.000 6.189 5.987 6.755 . 0 0 "[ . 1 ]" 1
218 1 10 A H5' 1 11 U H5' 4.400 . 7.000 7.014 6.449 7.080 0.080 5 0 "[ . 1 ]" 1
219 1 10 A H5'' 1 10 A H8 3.400 . 5.000 4.642 4.568 4.788 . 0 0 "[ . 1 ]" 1
220 1 10 A H5'' 1 11 U H5' 4.400 . 7.000 6.117 5.364 6.217 . 0 0 "[ . 1 ]" 1
221 1 10 A H8 1 11 U H5 3.900 . 6.000 3.649 3.484 4.111 . 0 0 "[ . 1 ]" 1
222 1 10 A H8 1 11 U H6 4.400 . 7.000 5.006 4.849 5.469 . 0 0 "[ . 1 ]" 1
223 1 11 U H1' 1 11 U H5 4.400 . 7.000 5.465 5.460 5.468 . 0 0 "[ . 1 ]" 1
224 1 11 U H1' 1 11 U H6 3.400 . 5.000 3.758 3.746 3.762 . 0 0 "[ . 1 ]" 1
225 1 11 U H1' 1 12 U H3' 4.400 . 7.000 6.938 6.322 7.060 0.060 4 0 "[ . 1 ]" 1
226 1 11 U H1' 1 12 U H4' 3.900 . 6.000 4.739 4.527 4.822 . 0 0 "[ . 1 ]" 1
227 1 11 U H1' 1 12 U Q5' 3.900 . 6.000 4.769 3.625 5.114 . 0 0 "[ . 1 ]" 1
228 1 11 U H1' 1 12 U H6 3.400 . 5.000 4.294 2.899 4.661 . 0 0 "[ . 1 ]" 1
229 1 11 U H1' 1 13 A H2 4.400 . 7.000 3.656 3.289 5.235 . 0 0 "[ . 1 ]" 1
230 1 11 U H2' 1 11 U H5 3.900 . 6.000 4.316 4.255 4.418 . 0 0 "[ . 1 ]" 1
231 1 11 U H2' 1 11 U H6 2.400 . 3.000 2.279 2.167 2.480 . 0 0 "[ . 1 ]" 1
232 1 11 U H2' 1 12 U H6 4.400 . 7.000 6.094 5.358 6.239 . 0 0 "[ . 1 ]" 1
233 1 11 U H3' 1 11 U H6 2.900 . 4.000 4.050 4.027 4.085 0.085 5 0 "[ . 1 ]" 1
234 1 11 U H3' 1 12 U H4' 3.900 . 6.000 5.427 5.091 5.718 . 0 0 "[ . 1 ]" 1
235 1 11 U H3' 1 12 U Q5' 3.900 . 6.000 4.128 3.941 4.792 . 0 0 "[ . 1 ]" 1
236 1 11 U H3' 1 12 U H6 3.400 . 5.000 5.122 5.050 5.156 0.156 2 0 "[ . 1 ]" 1
237 1 11 U H3' 1 13 A H2 4.400 . 7.000 5.693 5.511 6.288 . 0 0 "[ . 1 ]" 1
238 1 11 U H4' 1 11 U H6 3.900 . 6.000 4.417 4.301 4.498 . 0 0 "[ . 1 ]" 1
239 1 11 U H4' 1 12 U H1' 4.400 . 7.000 5.798 5.499 6.078 . 0 0 "[ . 1 ]" 1
240 1 11 U H4' 1 12 U H3' 3.400 . 5.000 5.166 5.127 5.272 0.272 11 0 "[ . 1 ]" 1
241 1 11 U H4' 1 12 U H4' 3.400 . 5.000 2.963 2.734 3.207 . 0 0 "[ . 1 ]" 1
242 1 11 U H4' 1 12 U Q5' 3.400 . 5.000 2.565 2.174 3.564 . 0 0 "[ . 1 ]" 1
243 1 11 U H4' 1 12 U H6 3.900 . 6.000 4.559 4.403 4.760 . 0 0 "[ . 1 ]" 1
244 1 11 U H4' 1 13 A H2 3.900 . 6.000 3.695 3.412 4.487 . 0 0 "[ . 1 ]" 1
245 1 11 U H5' 1 11 U H6 3.400 . 5.000 3.168 2.047 3.397 . 0 0 "[ . 1 ]" 1
246 1 11 U H5' 1 13 A H2 3.400 . 5.000 3.704 2.577 4.692 . 0 0 "[ . 1 ]" 1
247 1 11 U H5'' 1 11 U H6 3.400 . 5.000 4.092 3.756 4.190 . 0 0 "[ . 1 ]" 1
248 1 11 U H5'' 1 13 A H2 3.400 . 5.000 4.989 4.114 5.100 0.100 11 0 "[ . 1 ]" 1
249 1 12 U H1' 1 12 U H6 2.900 . 4.000 3.649 3.640 3.656 . 0 0 "[ . 1 ]" 1
250 1 12 U H1' 1 13 A H2 4.400 . 7.000 5.706 5.092 5.885 . 0 0 "[ . 1 ]" 1
251 1 12 U H1' 1 13 A H8 3.900 . 6.000 3.419 3.177 3.671 . 0 0 "[ . 1 ]" 1
252 1 12 U H2' 1 12 U H5 4.400 . 7.000 4.806 4.794 4.817 . 0 0 "[ . 1 ]" 1
253 1 12 U H2' 1 12 U H6 2.400 . 3.000 3.124 3.098 3.155 0.155 5 0 "[ . 1 ]" 1
254 1 12 U H2' 1 13 A H8 3.400 . 5.000 5.282 5.162 5.369 0.369 1 0 "[ . 1 ]" 1
255 1 12 U H3' 1 12 U H6 3.400 . 5.000 4.359 4.338 4.378 . 0 0 "[ . 1 ]" 1
256 1 12 U H3' 1 13 A H8 3.400 . 5.000 5.085 5.002 5.168 0.168 5 0 "[ . 1 ]" 1
257 1 12 U H4' 1 12 U H6 3.400 . 5.000 4.016 3.947 4.054 . 0 0 "[ . 1 ]" 1
258 1 12 U H4' 1 13 A H1' 3.900 . 6.000 4.692 4.418 5.093 . 0 0 "[ . 1 ]" 1
259 1 12 U H4' 1 13 A H2 4.400 . 7.000 4.078 3.737 4.354 . 0 0 "[ . 1 ]" 1
260 1 12 U H4' 1 13 A H8 4.400 . 7.000 4.905 4.673 5.200 . 0 0 "[ . 1 ]" 1
261 1 12 U Q5' 1 12 U H6 3.900 . 6.000 2.924 1.786 3.158 . 0 0 "[ . 1 ]" 1
262 1 12 U Q5' 1 13 A H2 4.400 . 7.000 5.250 4.702 5.894 . 0 0 "[ . 1 ]" 1
263 1 12 U Q5' 1 13 A H8 4.400 . 7.000 6.057 5.946 6.147 . 0 0 "[ . 1 ]" 1
264 1 13 A H1' 1 13 A H2 3.900 . 6.000 4.419 4.314 4.501 . 0 0 "[ . 1 ]" 1
265 1 13 A H1' 1 13 A H8 2.900 . 4.000 3.882 3.858 3.901 . 0 0 "[ . 1 ]" 1
266 1 13 A H1' 1 14 C H1' 3.900 . 6.000 4.404 3.202 4.613 . 0 0 "[ . 1 ]" 1
267 1 13 A H1' 1 14 C H5 4.400 . 7.000 3.104 2.840 3.818 . 0 0 "[ . 1 ]" 1
268 1 13 A H1' 1 14 C H5' 4.400 . 7.000 5.370 4.683 5.531 . 0 0 "[ . 1 ]" 1
269 1 13 A H1' 1 14 C H6 3.400 . 5.000 2.845 2.393 2.989 . 0 0 "[ . 1 ]" 1
270 1 13 A H2 1 13 A H2' 4.400 . 7.000 6.821 6.701 6.900 . 0 0 "[ . 1 ]" 1
271 1 13 A H2 1 13 A H4' 4.400 . 7.000 7.234 7.141 7.316 0.316 4 0 "[ . 1 ]" 1
272 1 13 A H2 1 14 C H1' 3.900 . 6.000 5.828 3.467 6.135 0.135 8 0 "[ . 1 ]" 1
273 1 13 A H2 1 14 C H5 4.400 . 7.000 5.734 5.272 6.548 . 0 0 "[ . 1 ]" 1
274 1 13 A H2' 1 13 A H8 2.400 . 3.000 2.248 2.136 2.373 . 0 0 "[ . 1 ]" 1
275 1 13 A H2' 1 14 C H1' 4.400 . 7.000 6.993 6.219 7.070 0.070 11 0 "[ . 1 ]" 1
276 1 13 A H2' 1 14 C H5 4.400 . 7.000 4.710 4.570 4.895 . 0 0 "[ . 1 ]" 1
277 1 13 A H2' 1 14 C H5' 3.900 . 6.000 5.925 5.752 6.027 0.027 2 0 "[ . 1 ]" 1
278 1 13 A H2' 1 14 C H6 3.400 . 5.000 4.677 4.252 4.851 . 0 0 "[ . 1 ]" 1
279 1 13 A H3' 1 13 A H8 3.400 . 5.000 4.366 4.345 4.429 . 0 0 "[ . 1 ]" 1
280 1 13 A H3' 1 14 C H5 4.400 . 7.000 5.083 4.882 5.319 . 0 0 "[ . 1 ]" 1
281 1 13 A H3' 1 14 C H5' 3.900 . 6.000 3.946 3.732 4.441 . 0 0 "[ . 1 ]" 1
282 1 13 A H3' 1 14 C H6 3.400 . 5.000 4.092 3.953 4.261 . 0 0 "[ . 1 ]" 1
283 1 13 A H4' 1 13 A H8 3.900 . 6.000 5.027 4.899 5.152 . 0 0 "[ . 1 ]" 1
284 1 13 A H4' 1 14 C H5 4.400 . 7.000 5.582 5.236 6.346 . 0 0 "[ . 1 ]" 1
285 1 13 A H4' 1 14 C H6 3.400 . 5.000 3.760 3.380 4.375 . 0 0 "[ . 1 ]" 1
286 1 13 A H5' 1 13 A H8 3.400 . 5.000 4.863 4.686 5.035 0.035 9 0 "[ . 1 ]" 1
287 1 13 A H5' 1 14 C H6 3.900 . 6.000 5.840 5.492 6.289 0.289 5 0 "[ . 1 ]" 1
288 1 13 A H5'' 1 13 A H8 3.400 . 5.000 3.567 3.383 3.798 . 0 0 "[ . 1 ]" 1
289 1 13 A H5'' 1 14 C H6 3.900 . 6.000 5.711 5.466 5.954 . 0 0 "[ . 1 ]" 1
290 1 13 A H8 1 14 C H5 3.900 . 6.000 6.162 6.032 6.215 0.215 8 0 "[ . 1 ]" 1
291 1 13 A H8 1 14 C H6 4.400 . 7.000 6.331 5.817 6.463 . 0 0 "[ . 1 ]" 1
292 1 14 C H1' 1 14 C H5 4.400 . 7.000 5.258 5.233 5.293 . 0 0 "[ . 1 ]" 1
293 1 14 C H1' 1 14 C H6 3.400 . 5.000 3.482 3.451 3.535 . 0 0 "[ . 1 ]" 1
294 1 14 C H1' 1 15 C H5 4.400 . 7.000 5.590 4.910 5.945 . 0 0 "[ . 1 ]" 1
295 1 14 C H1' 1 15 C H6 3.400 . 5.000 5.081 5.061 5.104 0.104 5 0 "[ . 1 ]" 1
296 1 14 C H2' 1 14 C H5 4.400 . 7.000 5.469 5.394 5.518 . 0 0 "[ . 1 ]" 1
297 1 14 C H2' 1 14 C H6 4.400 . 7.000 4.012 3.919 4.085 . 0 0 "[ . 1 ]" 1
298 1 14 C H2' 1 15 C H1' 3.900 . 6.000 4.786 4.511 5.141 . 0 0 "[ . 1 ]" 1
299 1 14 C H2' 1 15 C H5 3.400 . 5.000 3.343 2.982 3.669 . 0 0 "[ . 1 ]" 1
300 1 14 C H2' 1 15 C H5' 3.900 . 6.000 4.190 3.559 4.824 . 0 0 "[ . 1 ]" 1
301 1 14 C H2' 1 15 C H6 3.400 . 5.000 2.313 2.295 2.345 . 0 0 "[ . 1 ]" 1
302 1 14 C H3' 1 14 C H5 4.400 . 7.000 5.046 4.944 5.115 . 0 0 "[ . 1 ]" 1
303 1 14 C H3' 1 14 C H6 4.400 . 7.000 3.255 3.128 3.345 . 0 0 "[ . 1 ]" 1
304 1 14 C H3' 1 15 C H5 3.900 . 6.000 3.382 3.068 3.751 . 0 0 "[ . 1 ]" 1
305 1 14 C H3' 1 15 C H5' 3.900 . 6.000 4.579 4.314 4.972 . 0 0 "[ . 1 ]" 1
306 1 14 C H3' 1 15 C H6 3.900 . 6.000 3.157 2.991 3.336 . 0 0 "[ . 1 ]" 1
307 1 14 C H4' 1 14 C H6 3.400 . 5.000 4.116 4.101 4.129 . 0 0 "[ . 1 ]" 1
308 1 14 C H5 1 14 C H5' 3.900 . 6.000 5.903 5.775 6.014 0.014 9 0 "[ . 1 ]" 1
309 1 14 C H5 1 15 C H5 3.900 . 6.000 4.880 3.874 5.368 . 0 0 "[ . 1 ]" 1
310 1 14 C H5' 1 14 C H6 2.900 . 4.000 3.634 3.510 3.759 . 0 0 "[ . 1 ]" 1
311 1 14 C H5'' 1 14 C H6 2.900 . 4.000 4.172 4.118 4.208 0.208 8 0 "[ . 1 ]" 1
312 1 15 C H1' 1 15 C H6 3.400 . 5.000 3.515 3.498 3.541 . 0 0 "[ . 1 ]" 1
313 1 15 C H1' 1 16 U H6 3.900 . 6.000 5.538 5.366 5.771 . 0 0 "[ . 1 ]" 1
314 1 15 C H2' 1 15 C H6 2.900 . 4.000 4.010 3.963 4.036 0.036 5 0 "[ . 1 ]" 1
315 1 15 C H2' 1 16 U H1' 3.400 . 5.000 4.117 3.973 4.390 . 0 0 "[ . 1 ]" 1
316 1 15 C H2' 1 16 U H5 3.900 . 6.000 4.534 4.313 4.728 . 0 0 "[ . 1 ]" 1
317 1 15 C H2' 1 16 U H6 2.400 . 3.000 2.820 2.621 3.015 0.015 2 0 "[ . 1 ]" 1
318 1 15 C H3' 1 15 C H6 2.900 . 4.000 3.275 3.148 3.344 . 0 0 "[ . 1 ]" 1
319 1 15 C H3' 1 16 U H6 2.900 . 4.000 3.418 2.962 3.606 . 0 0 "[ . 1 ]" 1
320 1 15 C H4' 1 15 C H6 3.400 . 5.000 4.190 4.168 4.213 . 0 0 "[ . 1 ]" 1
321 1 15 C H5 1 16 U H6 4.400 . 7.000 6.159 5.619 6.466 . 0 0 "[ . 1 ]" 1
322 1 15 C H5'' 1 15 C H6 3.400 . 5.000 4.235 4.170 4.309 . 0 0 "[ . 1 ]" 1
323 1 15 C H6 1 16 U H5 3.900 . 6.000 5.611 4.585 6.021 0.021 12 0 "[ . 1 ]" 1
324 1 15 C H6 1 16 U H6 4.400 . 7.000 5.615 5.103 5.888 . 0 0 "[ . 1 ]" 1
325 1 16 U H1' 1 16 U H6 3.900 . 6.000 3.604 3.556 3.648 . 0 0 "[ . 1 ]" 1
326 1 16 U H1' 1 17 A H1' 4.400 . 7.000 6.459 6.032 6.851 . 0 0 "[ . 1 ]" 1
327 1 16 U H1' 1 17 A H8 3.400 . 5.000 5.025 5.008 5.035 0.035 11 0 "[ . 1 ]" 1
328 1 16 U H2' 1 16 U H5 4.400 . 7.000 5.241 5.148 5.327 . 0 0 "[ . 1 ]" 1
329 1 16 U H2' 1 16 U H6 2.900 . 4.000 3.802 3.679 3.919 . 0 0 "[ . 1 ]" 1
330 1 16 U H2' 1 17 A H1' 3.900 . 6.000 4.832 4.196 5.381 . 0 0 "[ . 1 ]" 1
331 1 16 U H2' 1 17 A H8 2.400 . 3.000 2.476 2.393 2.589 . 0 0 "[ . 1 ]" 1
332 1 16 U H3' 1 16 U H5 4.400 . 7.000 4.730 4.672 4.801 . 0 0 "[ . 1 ]" 1
333 1 16 U H3' 1 16 U H6 2.900 . 4.000 2.901 2.772 3.037 . 0 0 "[ . 1 ]" 1
334 1 16 U H3' 1 17 A H8 3.400 . 5.000 3.624 2.982 4.314 . 0 0 "[ . 1 ]" 1
335 1 16 U H4' 1 17 A H8 3.900 . 6.000 5.798 5.655 5.948 . 0 0 "[ . 1 ]" 1
336 1 16 U H5 1 16 U H5'' 4.400 . 7.000 6.146 6.065 6.330 . 0 0 "[ . 1 ]" 1
337 1 16 U H5 1 17 A H8 4.400 . 7.000 6.090 5.172 7.035 0.035 2 0 "[ . 1 ]" 1
338 1 16 U H5' 1 16 U H6 4.400 . 7.000 3.989 3.934 4.109 . 0 0 "[ . 1 ]" 1
339 1 16 U H5'' 1 16 U H6 4.400 . 7.000 4.015 3.905 4.214 . 0 0 "[ . 1 ]" 1
340 1 16 U H6 1 17 A H8 4.400 . 7.000 5.342 4.655 6.074 . 0 0 "[ . 1 ]" 1
341 1 17 A H1' 1 17 A H2 3.900 . 6.000 4.791 4.718 4.853 . 0 0 "[ . 1 ]" 1
342 1 17 A H1' 1 17 A H8 3.400 . 5.000 3.751 3.711 3.795 . 0 0 "[ . 1 ]" 1
343 1 17 A H1' 1 18 U H1' 4.400 . 7.000 5.455 5.366 5.556 . 0 0 "[ . 1 ]" 1
344 1 17 A H1' 1 18 U H4' 3.900 . 6.000 6.053 6.041 6.065 0.065 2 0 "[ . 1 ]" 1
345 1 17 A H1' 1 18 U H5 4.400 . 7.000 5.862 5.770 5.944 . 0 0 "[ . 1 ]" 1
346 1 17 A H1' 1 18 U H6 3.400 . 5.000 4.779 4.735 4.829 . 0 0 "[ . 1 ]" 1
347 1 17 A H2 1 17 A H2' 4.400 . 7.000 4.769 4.607 4.979 . 0 0 "[ . 1 ]" 1
348 1 17 A H2 1 18 U H1' 2.900 . 4.000 3.351 3.100 3.743 . 0 0 "[ . 1 ]" 1
349 1 17 A H2 1 18 U H2' 4.400 . 7.000 6.001 5.743 6.362 . 0 0 "[ . 1 ]" 1
350 1 17 A H2 1 18 U H3 3.900 . 6.000 5.720 5.484 5.990 . 0 0 "[ . 1 ]" 1
351 1 17 A H2 1 18 U H4' 4.400 . 7.000 5.942 5.747 6.363 . 0 0 "[ . 1 ]" 1
352 1 17 A H2 1 18 U H5 4.400 . 7.000 6.917 6.723 7.016 0.016 8 0 "[ . 1 ]" 1
353 1 17 A H2' 1 17 A H8 2.900 . 4.000 3.951 3.822 4.038 0.038 2 0 "[ . 1 ]" 1
354 1 17 A H2' 1 18 U H1' 3.400 . 5.000 3.604 3.569 3.649 . 0 0 "[ . 1 ]" 1
355 1 17 A H2' 1 18 U H5 3.400 . 5.000 4.009 3.854 4.109 . 0 0 "[ . 1 ]" 1
356 1 17 A H2' 1 18 U H5'' 3.400 . 5.000 4.460 4.381 4.555 . 0 0 "[ . 1 ]" 1
357 1 17 A H2' 1 18 U H6 2.400 . 3.000 2.185 2.088 2.251 . 0 0 "[ . 1 ]" 1
358 1 17 A H3' 1 17 A H8 2.900 . 4.000 3.144 2.981 3.341 . 0 0 "[ . 1 ]" 1
359 1 17 A H3' 1 18 U H5 3.400 . 5.000 3.108 3.067 3.196 . 0 0 "[ . 1 ]" 1
360 1 17 A H3' 1 18 U H5'' 3.900 . 6.000 5.027 4.961 5.089 . 0 0 "[ . 1 ]" 1
361 1 17 A H3' 1 18 U H6 3.400 . 5.000 2.479 2.421 2.567 . 0 0 "[ . 1 ]" 1
362 1 17 A H4' 1 17 A H8 3.400 . 5.000 4.443 4.388 4.491 . 0 0 "[ . 1 ]" 1
363 1 17 A H4' 1 18 U H5 4.400 . 7.000 6.070 6.027 6.149 . 0 0 "[ . 1 ]" 1
364 1 17 A H4' 1 18 U H6 3.400 . 5.000 5.171 5.162 5.184 0.184 7 0 "[ . 1 ]" 1
365 1 17 A H5' 1 17 A H8 4.400 . 7.000 4.134 3.898 4.388 . 0 0 "[ . 1 ]" 1
366 1 17 A H5' 1 18 U H6 4.400 . 7.000 6.178 6.103 6.271 . 0 0 "[ . 1 ]" 1
367 1 17 A H5'' 1 17 A H8 3.400 . 5.000 4.345 4.205 4.448 . 0 0 "[ . 1 ]" 1
368 1 17 A H61 1 18 U H3 3.900 . 6.000 3.613 3.485 4.086 . 0 0 "[ . 1 ]" 1
369 1 17 A H62 1 18 U H3 3.900 . 6.000 3.570 3.338 4.288 . 0 0 "[ . 1 ]" 1
370 1 17 A H8 1 18 U H1' 4.400 . 7.000 6.508 6.337 6.821 . 0 0 "[ . 1 ]" 1
371 1 17 A H8 1 18 U H5 3.400 . 5.000 3.607 3.404 4.044 . 0 0 "[ . 1 ]" 1
372 1 17 A H8 1 18 U H6 4.400 . 7.000 4.347 4.145 4.681 . 0 0 "[ . 1 ]" 1
373 1 18 U H1' 1 18 U H3 3.900 . 6.000 4.627 4.614 4.650 . 0 0 "[ . 1 ]" 1
374 1 18 U H1' 1 18 U H5 4.400 . 7.000 5.354 5.338 5.366 . 0 0 "[ . 1 ]" 1
375 1 18 U H1' 1 18 U H6 3.400 . 5.000 3.590 3.565 3.609 . 0 0 "[ . 1 ]" 1
376 1 18 U H1' 1 19 G H8 3.400 . 5.000 5.025 5.017 5.031 0.031 3 0 "[ . 1 ]" 1
377 1 18 U H2' 1 18 U H5 3.900 . 6.000 5.292 5.261 5.333 . 0 0 "[ . 1 ]" 1
378 1 18 U H2' 1 18 U H6 2.900 . 4.000 3.871 3.827 3.925 . 0 0 "[ . 1 ]" 1
379 1 18 U H2' 1 19 G H1' 3.400 . 5.000 4.861 4.553 5.025 0.025 3 0 "[ . 1 ]" 1
380 1 18 U H2' 1 19 G H8 2.400 . 3.000 2.343 2.313 2.383 . 0 0 "[ . 1 ]" 1
381 1 18 U H3 1 19 G H1 4.400 . 7.000 5.051 4.490 5.905 . 0 0 "[ . 1 ]" 1
382 1 18 U H3 1 19 G H1' 4.400 . 7.000 6.582 6.053 6.970 . 0 0 "[ . 1 ]" 1
383 1 18 U H3' 1 18 U H5 4.400 . 7.000 4.835 4.801 4.884 . 0 0 "[ . 1 ]" 1
384 1 18 U H3' 1 18 U H6 2.900 . 4.000 3.043 2.984 3.128 . 0 0 "[ . 1 ]" 1
385 1 18 U H3' 1 19 G H8 3.400 . 5.000 3.659 3.406 3.835 . 0 0 "[ . 1 ]" 1
386 1 18 U H4' 1 18 U H6 3.400 . 5.000 4.168 4.158 4.182 . 0 0 "[ . 1 ]" 1
387 1 18 U H5' 1 18 U H6 4.400 . 7.000 3.753 3.707 3.829 . 0 0 "[ . 1 ]" 1
388 1 18 U H5'' 1 18 U H6 3.400 . 5.000 4.151 4.113 4.199 . 0 0 "[ . 1 ]" 1
389 1 18 U H6 1 19 G H8 4.400 . 7.000 5.537 5.236 5.923 . 0 0 "[ . 1 ]" 1
390 1 19 G H1 1 20 C H1' 3.900 . 6.000 5.696 5.141 6.023 0.023 3 0 "[ . 1 ]" 1
391 1 19 G H1 1 20 C H42 3.400 . 5.000 4.837 4.502 5.286 0.286 8 0 "[ . 1 ]" 1
392 1 19 G H1 1 20 C H5 3.900 . 6.000 5.393 5.186 5.708 . 0 0 "[ . 1 ]" 1
393 1 19 G H1 1 20 C H6 3.900 . 6.000 6.015 6.003 6.031 0.031 12 0 "[ . 1 ]" 1
394 1 19 G H1' 1 19 G H8 3.400 . 5.000 3.800 3.775 3.818 . 0 0 "[ . 1 ]" 1
395 1 19 G H1' 1 20 C H5 4.400 . 7.000 5.914 5.690 6.129 . 0 0 "[ . 1 ]" 1
396 1 19 G H1' 1 20 C H6 3.400 . 5.000 5.023 5.013 5.037 0.037 4 0 "[ . 1 ]" 1
397 1 19 G H2' 1 19 G H8 4.400 . 7.000 3.785 3.726 3.862 . 0 0 "[ . 1 ]" 1
398 1 19 G H2' 1 20 C H1' 4.400 . 7.000 4.424 4.112 4.687 . 0 0 "[ . 1 ]" 1
399 1 19 G H2' 1 20 C H5 3.400 . 5.000 3.788 3.660 3.973 . 0 0 "[ . 1 ]" 1
400 1 19 G H2' 1 20 C H5' 3.900 . 6.000 3.650 3.497 3.812 . 0 0 "[ . 1 ]" 1
401 1 19 G H2' 1 20 C H6 2.400 . 3.000 2.369 2.345 2.386 . 0 0 "[ . 1 ]" 1
402 1 19 G H3' 1 19 G H8 3.400 . 5.000 2.922 2.828 3.055 . 0 0 "[ . 1 ]" 1
403 1 19 G H3' 1 20 C H5 3.400 . 5.000 4.236 4.049 4.448 . 0 0 "[ . 1 ]" 1
404 1 19 G H3' 1 20 C H6 2.900 . 4.000 3.648 3.513 3.828 . 0 0 "[ . 1 ]" 1
405 1 19 G H5' 1 19 G H8 4.400 . 7.000 4.300 4.110 4.414 . 0 0 "[ . 1 ]" 1
406 1 19 G H5'' 1 19 G H8 3.400 . 5.000 4.252 4.127 4.332 . 0 0 "[ . 1 ]" 1
407 1 19 G H8 1 20 C H5 3.400 . 5.000 4.453 4.141 4.903 . 0 0 "[ . 1 ]" 1
408 1 19 G H8 1 20 C H6 4.400 . 7.000 5.099 4.781 5.472 . 0 0 "[ . 1 ]" 1
409 1 20 C H1' 1 20 C H42 4.400 . 7.000 6.647 6.645 6.649 . 0 0 "[ . 1 ]" 1
410 1 20 C H1' 1 20 C H5 4.400 . 7.000 5.385 5.377 5.394 . 0 0 "[ . 1 ]" 1
411 1 20 C H1' 1 20 C H6 3.400 . 5.000 3.639 3.621 3.656 . 0 0 "[ . 1 ]" 1
412 1 20 C H1' 1 21 C H4' 3.900 . 6.000 6.008 6.003 6.016 0.016 3 0 "[ . 1 ]" 1
413 1 20 C H2' 1 20 C H5 4.400 . 7.000 5.178 5.148 5.203 . 0 0 "[ . 1 ]" 1
414 1 20 C H2' 1 20 C H6 3.400 . 5.000 3.713 3.662 3.761 . 0 0 "[ . 1 ]" 1
415 1 20 C H2' 1 21 C H1' 3.900 . 6.000 4.269 4.212 4.317 . 0 0 "[ . 1 ]" 1
416 1 20 C H2' 1 21 C H5 3.900 . 6.000 4.234 4.174 4.381 . 0 0 "[ . 1 ]" 1
417 1 20 C H2' 1 21 C H5' 3.900 . 6.000 3.643 3.571 3.712 . 0 0 "[ . 1 ]" 1
418 1 20 C H2' 1 21 C H5'' 3.900 . 6.000 4.696 4.649 4.732 . 0 0 "[ . 1 ]" 1
419 1 20 C H2' 1 21 C H6 2.400 . 3.000 2.790 2.751 2.881 . 0 0 "[ . 1 ]" 1
420 1 20 C H3' 1 20 C H5 3.900 . 6.000 4.714 4.689 4.733 . 0 0 "[ . 1 ]" 1
421 1 20 C H3' 1 20 C H6 3.400 . 5.000 2.792 2.741 2.850 . 0 0 "[ . 1 ]" 1
422 1 20 C H3' 1 21 C H5 4.400 . 7.000 4.650 4.518 4.735 . 0 0 "[ . 1 ]" 1
423 1 20 C H3' 1 21 C H6 3.900 . 6.000 3.947 3.834 4.033 . 0 0 "[ . 1 ]" 1
424 1 20 C H4' 1 20 C H6 3.400 . 5.000 4.206 4.190 4.217 . 0 0 "[ . 1 ]" 1
425 1 20 C H41 1 21 C H5 3.900 . 6.000 5.745 5.545 5.924 . 0 0 "[ . 1 ]" 1
426 1 20 C H42 1 21 C H5 3.900 . 6.000 5.699 5.470 5.841 . 0 0 "[ . 1 ]" 1
427 1 20 C H5 1 20 C H5' 4.400 . 7.000 6.373 6.236 6.477 . 0 0 "[ . 1 ]" 1
428 1 20 C H5 1 21 C H5 4.400 . 7.000 5.383 5.082 5.534 . 0 0 "[ . 1 ]" 1
429 1 20 C H5'' 1 20 C H6 3.400 . 5.000 4.153 4.046 4.243 . 0 0 "[ . 1 ]" 1
430 1 21 C H1' 1 21 C H5 4.400 . 7.000 5.395 5.386 5.400 . 0 0 "[ . 1 ]" 1
431 1 21 C H1' 1 21 C H6 3.400 . 5.000 3.660 3.648 3.666 . 0 0 "[ . 1 ]" 1
432 1 21 C H2' 1 21 C H5 4.400 . 7.000 5.152 5.134 5.185 . 0 0 "[ . 1 ]" 1
433 1 21 C H2' 1 21 C H6 3.400 . 5.000 3.658 3.636 3.701 . 0 0 "[ . 1 ]" 1
434 1 21 C H3' 1 21 C H5 3.900 . 6.000 4.708 4.688 4.735 . 0 0 "[ . 1 ]" 1
435 1 21 C H3' 1 21 C H6 3.400 . 5.000 2.747 2.715 2.792 . 0 0 "[ . 1 ]" 1
436 1 21 C H5 1 21 C H5' 4.400 . 7.000 6.350 6.335 6.371 . 0 0 "[ . 1 ]" 1
437 1 21 C H5 1 21 C H5'' 4.400 . 7.000 6.174 6.158 6.210 . 0 0 "[ . 1 ]" 1
438 1 21 C H5' 1 21 C H6 3.400 . 5.000 4.034 4.019 4.054 . 0 0 "[ . 1 ]" 1
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