NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
655322 |
6m05   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6m05
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 308
_Distance_constraint_stats_list.Viol_count 255
_Distance_constraint_stats_list.Viol_total 189.649
_Distance_constraint_stats_list.Viol_max 0.329
_Distance_constraint_stats_list.Viol_rms 0.0287
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0062
_Distance_constraint_stats_list.Viol_average_violations_only 0.0744
_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 DG 1.370 0.104 7 0 "[ . 1]"
1 2 DT 4.273 0.274 3 0 "[ . 1]"
1 3 DT 3.054 0.274 3 0 "[ . 1]"
1 4 DA 2.814 0.197 6 0 "[ . 1]"
1 5 DG 2.249 0.197 6 0 "[ . 1]"
1 6 DG 0.668 0.086 6 0 "[ . 1]"
2 1 DG 3.168 0.260 8 0 "[ . 1]"
2 2 DT 4.383 0.270 9 0 "[ . 1]"
2 3 DT 1.217 0.235 8 0 "[ . 1]"
2 4 DA 0.696 0.329 9 0 "[ . 1]"
2 5 DG 1.220 0.111 6 0 "[ . 1]"
2 6 DG 0.829 0.090 1 0 "[ . 1]"
3 1 DG 1.185 0.129 6 0 "[ . 1]"
3 2 DT 1.109 0.129 6 0 "[ . 1]"
3 3 DT 0.290 0.064 10 0 "[ . 1]"
3 4 DA 0.484 0.064 10 0 "[ . 1]"
3 5 DG 0.972 0.090 1 0 "[ . 1]"
3 6 DG 0.966 0.088 3 0 "[ . 1]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 DG H1 1 1 DG H21 2.700 . 3.600 2.194 2.193 2.195 . 0 0 "[ . 1]" 1
2 1 1 DG H1 1 1 DG H22 2.700 . 3.600 3.464 3.462 3.464 . 0 0 "[ . 1]" 1
3 1 1 DG H1 1 3 DT H1' 2.700 . 3.600 3.302 2.820 3.605 0.005 9 0 "[ . 1]" 1
4 1 1 DG H1 1 3 DT H4' 3.800 2.600 5.000 4.859 4.470 5.104 0.104 7 0 "[ . 1]" 1
5 1 1 DG H1 1 5 DG H8 3.800 2.600 5.000 5.027 4.939 5.093 0.093 7 0 "[ . 1]" 1
6 1 1 DG H1 1 6 DG H1 3.800 2.600 5.000 4.120 3.030 4.851 . 0 0 "[ . 1]" 1
7 1 1 DG H1 2 1 DG H1 5.000 3.500 6.500 5.305 5.050 5.669 . 0 0 "[ . 1]" 1
8 1 1 DG H1 2 1 DG H8 5.000 3.500 6.500 6.145 5.679 6.566 0.066 4 0 "[ . 1]" 1
9 1 1 DG H1' 1 1 DG H2' 3.300 2.300 4.300 3.044 3.035 3.054 . 0 0 "[ . 1]" 1
10 1 1 DG H1' 1 1 DG H2'' 3.100 2.200 4.000 2.396 2.382 2.408 . 0 0 "[ . 1]" 1
11 1 1 DG H1' 1 1 DG H8 3.700 2.600 4.800 3.871 3.782 3.889 . 0 0 "[ . 1]" 1
12 1 1 DG H1' 1 2 DT H6 5.000 3.500 6.500 4.349 3.903 5.625 . 0 0 "[ . 1]" 1
13 1 1 DG H1' 1 3 DT H6 5.200 3.600 6.800 5.664 5.274 6.212 . 0 0 "[ . 1]" 1
14 1 1 DG H1' 1 3 DT M7 4.800 3.400 6.200 5.182 4.559 5.591 . 0 0 "[ . 1]" 1
15 1 1 DG H1' 2 1 DG H8 4.200 2.900 5.500 4.688 3.143 5.472 . 0 0 "[ . 1]" 1
16 1 1 DG H2' 1 1 DG H3' 3.400 2.400 4.400 2.380 2.372 2.389 0.028 3 0 "[ . 1]" 1
17 1 1 DG H2' 1 1 DG H8 3.200 2.200 4.200 2.407 2.240 3.350 . 0 0 "[ . 1]" 1
18 1 1 DG H2' 1 3 DT H6 4.500 3.100 5.900 5.449 4.142 5.839 . 0 0 "[ . 1]" 1
19 1 1 DG H2' 1 3 DT M7 4.200 3.000 5.400 3.719 2.972 4.167 0.028 7 0 "[ . 1]" 1
20 1 1 DG H2'' 1 1 DG H3' 3.400 2.400 4.400 2.717 2.710 2.723 . 0 0 "[ . 1]" 1
21 1 1 DG H2'' 1 1 DG H8 3.500 2.400 4.600 3.844 3.708 4.553 . 0 0 "[ . 1]" 1
22 1 1 DG H2'' 1 3 DT H6 4.400 3.100 5.700 4.824 4.408 5.271 . 0 0 "[ . 1]" 1
23 1 1 DG H2'' 1 3 DT M7 4.300 3.000 5.600 3.740 3.064 4.238 . 0 0 "[ . 1]" 1
24 1 1 DG H3' 1 1 DG H5' 3.300 2.300 4.300 3.681 3.678 3.685 . 0 0 "[ . 1]" 1
25 1 1 DG H3' 1 1 DG H5'' 3.300 2.300 4.300 2.634 2.617 2.646 . 0 0 "[ . 1]" 1
26 1 1 DG H4' 1 1 DG H8 4.500 3.100 5.900 4.839 4.465 4.917 . 0 0 "[ . 1]" 1
27 1 1 DG H5' 1 1 DG H8 4.400 3.100 5.700 3.960 3.296 4.109 . 0 0 "[ . 1]" 1
28 1 1 DG H5'' 1 1 DG H8 4.400 3.100 5.700 4.701 4.521 4.798 . 0 0 "[ . 1]" 1
29 1 1 DG H8 1 3 DT H6 4.800 3.400 6.200 6.154 5.711 6.272 0.072 8 0 "[ . 1]" 1
30 1 1 DG H8 1 3 DT M7 3.900 2.700 5.100 4.403 3.657 4.657 . 0 0 "[ . 1]" 1
31 1 1 DG H8 2 1 DG H1' 4.200 2.900 5.500 5.394 5.000 5.548 0.048 6 0 "[ . 1]" 1
32 1 1 DG H8 2 6 DG H1 3.800 2.600 5.000 4.963 4.853 5.089 0.089 10 0 "[ . 1]" 1
33 1 1 DG H8 2 6 DG H21 3.800 2.600 5.000 3.252 3.187 3.314 . 0 0 "[ . 1]" 1
34 1 2 DT H1' 1 2 DT H2' 3.600 2.500 4.700 3.054 3.049 3.058 . 0 0 "[ . 1]" 1
35 1 2 DT H1' 1 2 DT H2'' 3.300 2.300 4.300 2.419 2.407 2.428 . 0 0 "[ . 1]" 1
36 1 2 DT H1' 1 2 DT H4' 4.200 2.900 5.500 3.173 3.007 3.228 . 0 0 "[ . 1]" 1
37 1 2 DT H1' 1 2 DT H6 3.700 2.600 4.800 3.710 3.707 3.713 . 0 0 "[ . 1]" 1
38 1 2 DT H1' 1 3 DT H4' 5.100 3.600 6.600 5.896 5.750 5.980 . 0 0 "[ . 1]" 1
39 1 2 DT H1' 1 3 DT H6 6.100 4.300 7.900 7.324 7.137 7.479 . 0 0 "[ . 1]" 1
40 1 2 DT H2' 1 2 DT H6 3.100 2.200 4.000 2.001 1.974 2.041 0.226 9 0 "[ . 1]" 1
41 1 2 DT H2' 1 3 DT H6 5.600 3.900 7.300 5.762 5.525 6.176 . 0 0 "[ . 1]" 1
42 1 2 DT H2'' 1 2 DT H6 3.400 2.400 4.400 3.429 3.398 3.470 . 0 0 "[ . 1]" 1
43 1 2 DT H2'' 1 3 DT H6 5.600 3.900 7.300 5.524 5.369 5.732 . 0 0 "[ . 1]" 1
44 1 2 DT H4' 1 2 DT H6 4.600 3.200 6.000 4.767 4.729 4.835 . 0 0 "[ . 1]" 1
45 1 2 DT H4' 1 3 DT H6 5.600 3.900 7.300 6.280 6.006 6.612 . 0 0 "[ . 1]" 1
46 1 2 DT H6 1 2 DT M7 2.900 . 3.800 2.314 2.311 2.316 . 0 0 "[ . 1]" 1
47 1 2 DT H6 1 3 DT H4' 4.800 3.300 6.300 6.528 6.490 6.574 0.274 3 0 "[ . 1]" 1
48 1 3 DT H1' 1 3 DT H2' 4.100 2.900 5.300 3.035 3.023 3.059 . 0 0 "[ . 1]" 1
49 1 3 DT H1' 1 3 DT H2'' 3.300 2.300 4.300 2.387 2.372 2.419 . 0 0 "[ . 1]" 1
50 1 3 DT H1' 1 3 DT H3' 4.700 3.300 6.100 3.880 3.829 3.901 . 0 0 "[ . 1]" 1
51 1 3 DT H1' 1 3 DT H4' 4.700 3.300 6.100 3.327 3.236 3.406 0.064 9 0 "[ . 1]" 1
52 1 3 DT H1' 1 3 DT H5' 5.400 3.800 7.000 4.587 4.561 4.612 . 0 0 "[ . 1]" 1
53 1 3 DT H1' 1 3 DT H5'' 5.100 3.600 6.600 5.010 4.973 5.033 . 0 0 "[ . 1]" 1
54 1 3 DT H1' 1 3 DT H6 4.300 3.000 5.600 3.707 3.691 3.712 . 0 0 "[ . 1]" 1
55 1 3 DT H1' 1 4 DA H8 4.500 3.100 5.900 3.971 3.722 4.104 . 0 0 "[ . 1]" 1
56 1 3 DT H2' 1 3 DT H3' 3.300 2.300 4.300 2.375 2.366 2.396 . 0 0 "[ . 1]" 1
57 1 3 DT H2' 1 3 DT H6 3.300 2.300 4.300 2.343 2.297 2.557 0.003 10 0 "[ . 1]" 1
58 1 3 DT H2'' 1 3 DT H3' 3.400 2.400 4.400 2.724 2.713 2.730 . 0 0 "[ . 1]" 1
59 1 3 DT H2'' 1 3 DT H6 3.600 2.500 4.700 3.804 3.773 3.937 . 0 0 "[ . 1]" 1
60 1 3 DT H2'' 1 4 DA H8 3.800 2.700 4.900 2.763 2.610 3.294 0.090 1 0 "[ . 1]" 1
61 1 3 DT H3 2 6 DG H1 3.800 2.600 5.000 3.375 3.046 3.900 . 0 0 "[ . 1]" 1
62 1 3 DT H3 3 4 DA H2 2.700 . 3.600 2.759 2.542 2.880 . 0 0 "[ . 1]" 1
63 1 3 DT H3 3 5 DG H1 5.000 3.500 6.500 5.783 5.575 6.389 . 0 0 "[ . 1]" 1
64 1 3 DT H3' 1 3 DT H4' 3.200 2.200 4.200 2.745 2.729 2.759 . 0 0 "[ . 1]" 1
65 1 3 DT H3' 1 3 DT H6 4.000 2.800 5.200 4.019 3.925 4.275 . 0 0 "[ . 1]" 1
66 1 3 DT H4' 1 3 DT H6 4.000 2.800 5.200 4.447 4.380 4.495 . 0 0 "[ . 1]" 1
67 1 3 DT H5' 1 5 DG H8 5.500 3.800 7.200 6.605 6.213 6.986 . 0 0 "[ . 1]" 1
68 1 3 DT H5'' 1 5 DG H8 5.300 3.700 6.900 6.521 6.117 6.967 0.067 9 0 "[ . 1]" 1
69 1 3 DT H6 1 3 DT M7 2.900 . 3.800 2.404 2.400 2.407 . 0 0 "[ . 1]" 1
70 1 4 DA H1' 1 4 DA H2' 4.000 2.800 5.200 3.058 3.050 3.065 . 0 0 "[ . 1]" 1
71 1 4 DA H1' 1 4 DA H2'' 3.500 2.400 4.600 2.419 2.407 2.434 . 0 0 "[ . 1]" 1
72 1 4 DA H1' 1 4 DA H3' 4.200 2.900 5.500 3.842 3.800 3.870 . 0 0 "[ . 1]" 1
73 1 4 DA H1' 1 4 DA H4' 3.600 2.500 4.700 3.242 3.140 3.331 . 0 0 "[ . 1]" 1
74 1 4 DA H1' 1 4 DA H8 4.100 2.900 5.300 3.888 3.884 3.891 . 0 0 "[ . 1]" 1
75 1 4 DA H1' 1 5 DG H8 5.500 3.800 7.200 7.334 7.289 7.397 0.197 6 0 "[ . 1]" 1
76 1 4 DA H2' 1 4 DA H8 3.500 2.400 4.600 2.281 2.246 2.314 0.154 2 0 "[ . 1]" 1
77 1 4 DA H2'' 1 4 DA H8 3.600 2.500 4.700 3.681 3.638 3.719 . 0 0 "[ . 1]" 1
78 1 4 DA H3' 1 4 DA H4' 3.500 2.400 4.600 2.743 2.722 2.758 . 0 0 "[ . 1]" 1
79 1 4 DA H3' 1 4 DA H8 4.100 2.900 5.300 4.355 4.309 4.440 . 0 0 "[ . 1]" 1
80 1 4 DA H5' 1 4 DA H8 4.400 3.100 5.700 4.309 4.105 4.411 . 0 0 "[ . 1]" 1
81 1 5 DG H1 1 5 DG H21 2.700 . 3.600 2.195 2.194 2.196 . 0 0 "[ . 1]" 1
82 1 5 DG H1 1 5 DG H22 2.700 . 3.600 3.463 3.463 3.464 . 0 0 "[ . 1]" 1
83 1 5 DG H1 3 5 DG H1 3.800 2.600 5.000 4.609 4.525 4.669 . 0 0 "[ . 1]" 1
84 1 5 DG H1 3 5 DG H8 3.800 2.600 5.000 4.997 4.914 5.055 0.055 1 0 "[ . 1]" 1
85 1 5 DG H1 3 6 DG H1 3.800 2.600 5.000 4.342 3.702 4.912 . 0 0 "[ . 1]" 1
86 1 5 DG H1' 1 5 DG H2' 3.300 2.300 4.300 3.057 3.046 3.062 . 0 0 "[ . 1]" 1
87 1 5 DG H1' 1 5 DG H2'' 3.200 2.200 4.200 2.409 2.394 2.416 . 0 0 "[ . 1]" 1
88 1 5 DG H1' 1 5 DG H4' 3.700 2.600 4.800 2.978 2.849 3.116 . 0 0 "[ . 1]" 1
89 1 5 DG H1' 1 5 DG H8 3.000 2.100 3.900 2.530 2.527 2.534 . 0 0 "[ . 1]" 1
90 1 5 DG H1' 1 6 DG H8 4.400 3.100 5.700 4.485 4.275 5.199 . 0 0 "[ . 1]" 1
91 1 5 DG H2' 1 5 DG H8 4.000 2.800 5.200 4.549 4.517 4.571 . 0 0 "[ . 1]" 1
92 1 5 DG H2' 1 6 DG H8 3.500 2.400 4.600 2.941 2.668 3.254 . 0 0 "[ . 1]" 1
93 1 5 DG H2'' 1 5 DG H8 4.300 3.000 5.600 4.193 4.168 4.214 . 0 0 "[ . 1]" 1
94 1 5 DG H2'' 1 6 DG H8 3.000 2.100 3.900 2.282 2.085 2.817 0.015 6 0 "[ . 1]" 1
95 1 5 DG H21 3 5 DG H8 3.800 2.600 5.000 3.253 3.201 3.282 . 0 0 "[ . 1]" 1
96 1 5 DG H4' 1 5 DG H8 5.000 3.500 6.500 5.286 5.162 5.418 . 0 0 "[ . 1]" 1
97 1 5 DG H4' 1 6 DG H8 5.000 3.500 6.500 6.006 5.827 6.287 . 0 0 "[ . 1]" 1
98 1 5 DG H8 1 6 DG H1 5.000 3.500 6.500 5.916 5.313 6.120 . 0 0 "[ . 1]" 1
99 1 5 DG H8 1 6 DG H1' 5.400 3.800 7.000 5.381 4.665 6.440 . 0 0 "[ . 1]" 1
100 1 5 DG H8 1 6 DG H21 5.000 3.500 6.500 6.309 5.483 6.586 0.086 6 0 "[ . 1]" 1
101 1 5 DG H8 1 6 DG H4' 5.300 3.700 6.900 5.740 5.283 6.593 . 0 0 "[ . 1]" 1
102 1 5 DG H8 1 6 DG H8 5.800 4.100 7.500 5.552 5.162 6.485 . 0 0 "[ . 1]" 1
103 1 6 DG H1 1 6 DG H21 2.700 . 3.600 2.197 2.196 2.198 . 0 0 "[ . 1]" 1
104 1 6 DG H1 1 6 DG H22 2.700 . 3.600 3.465 3.464 3.466 . 0 0 "[ . 1]" 1
105 1 6 DG H1 2 1 DG H1 3.800 2.600 5.000 4.435 4.057 4.676 . 0 0 "[ . 1]" 1
106 1 6 DG H1 2 1 DG H8 3.800 2.600 5.000 4.959 4.769 5.027 0.027 3 0 "[ . 1]" 1
107 1 6 DG H1' 1 6 DG H2' 3.400 2.400 4.400 3.061 3.055 3.067 . 0 0 "[ . 1]" 1
108 1 6 DG H1' 1 6 DG H2'' 3.200 2.300 4.100 2.420 2.415 2.429 . 0 0 "[ . 1]" 1
109 1 6 DG H1' 1 6 DG H4' 4.100 2.900 5.300 3.247 3.214 3.284 . 0 0 "[ . 1]" 1
110 1 6 DG H1' 1 6 DG H8 3.700 2.600 4.800 3.880 3.862 3.888 . 0 0 "[ . 1]" 1
111 1 6 DG H2' 1 6 DG H8 2.800 . 3.600 2.248 2.120 2.316 . 0 0 "[ . 1]" 1
112 1 6 DG H2'' 1 6 DG H8 3.600 2.500 4.700 3.648 3.477 3.724 . 0 0 "[ . 1]" 1
113 1 6 DG H21 2 1 DG H8 3.800 2.600 5.000 3.247 3.137 3.292 . 0 0 "[ . 1]" 1
114 1 6 DG H4' 1 6 DG H8 5.000 3.500 6.500 5.022 4.972 5.148 . 0 0 "[ . 1]" 1
115 1 6 DG H8 3 6 DG H1 3.800 2.600 5.000 5.004 4.872 5.080 0.080 2 0 "[ . 1]" 1
116 1 6 DG H8 3 6 DG H21 3.800 2.600 5.000 3.243 3.159 3.316 . 0 0 "[ . 1]" 1
117 2 1 DG H1 2 1 DG H21 2.700 . 3.600 2.195 2.194 2.196 . 0 0 "[ . 1]" 1
118 2 1 DG H1 2 1 DG H22 2.700 . 3.600 3.463 3.462 3.464 . 0 0 "[ . 1]" 1
119 2 1 DG H1 2 5 DG H8 3.800 2.600 5.000 5.046 4.996 5.111 0.111 6 0 "[ . 1]" 1
120 2 1 DG H1' 2 1 DG H2' 3.300 2.300 4.300 3.052 3.039 3.061 . 0 0 "[ . 1]" 1
121 2 1 DG H1' 2 1 DG H2'' 3.100 2.200 4.000 2.413 2.387 2.427 . 0 0 "[ . 1]" 1
122 2 1 DG H1' 2 1 DG H8 3.700 2.600 4.800 3.883 3.878 3.887 . 0 0 "[ . 1]" 1
123 2 1 DG H1' 2 2 DT H6 5.500 3.800 7.200 5.517 5.190 5.604 . 0 0 "[ . 1]" 1
124 2 1 DG H2' 2 1 DG H8 3.300 2.300 4.300 2.450 2.306 2.497 . 0 0 "[ . 1]" 1
125 2 1 DG H2'' 2 1 DG H8 3.700 2.600 4.800 3.862 3.709 3.936 . 0 0 "[ . 1]" 1
126 2 1 DG H2'' 2 2 DT H6 4.800 3.400 6.200 3.189 3.140 3.244 0.260 8 0 "[ . 1]" 1
127 2 1 DG H21 2 5 DG H8 3.800 2.600 5.000 3.298 3.242 3.332 . 0 0 "[ . 1]" 1
128 2 1 DG H3' 2 1 DG H8 4.500 3.100 5.900 4.411 4.328 4.478 . 0 0 "[ . 1]" 1
129 2 1 DG H4' 2 1 DG H8 4.500 3.100 5.900 4.835 4.760 4.951 . 0 0 "[ . 1]" 1
130 2 1 DG H5' 2 1 DG H8 4.300 3.000 5.600 3.942 3.775 4.191 . 0 0 "[ . 1]" 1
131 2 1 DG H5'' 2 1 DG H8 4.300 3.000 5.600 4.766 4.607 4.940 . 0 0 "[ . 1]" 1
132 2 1 DG H8 2 2 DT M7 3.900 2.700 5.100 5.058 4.782 5.149 0.049 3 0 "[ . 1]" 1
133 2 2 DT H1' 2 2 DT H3' 4.900 3.400 6.400 3.825 3.804 3.849 . 0 0 "[ . 1]" 1
134 2 2 DT H1' 2 2 DT H6 4.400 3.100 5.700 3.713 3.707 3.718 . 0 0 "[ . 1]" 1
135 2 2 DT H1' 2 3 DT H6 5.500 3.800 7.200 4.340 3.921 5.027 . 0 0 "[ . 1]" 1
136 2 2 DT H2' 2 2 DT H6 3.400 2.400 4.400 2.274 2.130 2.382 0.270 9 0 "[ . 1]" 1
137 2 2 DT H2' 2 3 DT H6 4.400 3.100 5.700 5.015 3.944 5.487 . 0 0 "[ . 1]" 1
138 2 2 DT H2'' 2 2 DT H6 4.000 2.800 5.200 3.706 3.590 3.801 . 0 0 "[ . 1]" 1
139 2 2 DT H2'' 2 3 DT H6 4.400 3.100 5.700 3.598 2.914 3.992 0.186 8 0 "[ . 1]" 1
140 2 2 DT H3' 2 2 DT H6 4.600 3.200 6.000 4.109 3.931 4.194 . 0 0 "[ . 1]" 1
141 2 2 DT H4' 2 2 DT H6 5.400 3.800 7.000 4.614 4.524 4.714 . 0 0 "[ . 1]" 1
142 2 2 DT H6 2 2 DT M7 3.300 2.300 4.300 2.252 2.248 2.258 0.052 7 0 "[ . 1]" 1
143 2 3 DT H1' 2 3 DT H2' 3.500 2.400 4.600 3.059 3.048 3.075 . 0 0 "[ . 1]" 1
144 2 3 DT H1' 2 3 DT H2'' 3.300 2.300 4.300 2.418 2.396 2.451 . 0 0 "[ . 1]" 1
145 2 3 DT H1' 2 3 DT H3' 4.800 3.400 6.200 3.826 3.772 3.877 . 0 0 "[ . 1]" 1
146 2 3 DT H1' 2 3 DT H4' 3.900 2.700 5.100 3.218 3.092 3.359 . 0 0 "[ . 1]" 1
147 2 3 DT H1' 2 3 DT H6 4.200 2.900 5.500 3.713 3.706 3.717 . 0 0 "[ . 1]" 1
148 2 3 DT H1' 2 4 DA H8 4.000 2.800 5.200 3.633 2.896 4.877 . 0 0 "[ . 1]" 1
149 2 3 DT H2' 2 3 DT H3' 3.300 2.300 4.300 2.382 2.373 2.392 . 0 0 "[ . 1]" 1
150 2 3 DT H2' 2 3 DT H6 3.100 2.200 4.000 2.139 1.965 2.274 0.235 8 0 "[ . 1]" 1
151 2 3 DT H2' 2 4 DA H8 5.100 3.600 6.600 5.635 5.084 6.245 . 0 0 "[ . 1]" 1
152 2 3 DT H2'' 2 3 DT H3' 3.300 2.300 4.300 2.714 2.708 2.723 . 0 0 "[ . 1]" 1
153 2 3 DT H2'' 2 3 DT H6 3.400 2.400 4.400 3.570 3.312 3.741 . 0 0 "[ . 1]" 1
154 2 3 DT H2'' 2 4 DA H8 4.200 2.900 5.500 4.344 3.643 4.824 . 0 0 "[ . 1]" 1
155 2 3 DT H3' 2 3 DT H4' 3.200 2.200 4.200 2.745 2.718 2.774 . 0 0 "[ . 1]" 1
156 2 3 DT H3' 2 3 DT H6 4.300 3.000 5.600 4.090 4.009 4.158 . 0 0 "[ . 1]" 1
157 2 3 DT H3' 2 4 DA H8 4.500 3.100 5.900 4.978 4.180 5.440 . 0 0 "[ . 1]" 1
158 2 3 DT H4' 2 3 DT H6 3.800 2.700 4.900 4.659 4.467 4.866 . 0 0 "[ . 1]" 1
159 2 3 DT H6 2 3 DT M7 2.900 . 3.800 2.402 2.399 2.404 . 0 0 "[ . 1]" 1
160 2 4 DA H1' 2 4 DA H3' 4.000 2.800 5.200 3.879 3.860 3.896 . 0 0 "[ . 1]" 1
161 2 4 DA H1' 2 4 DA H4' 3.500 2.400 4.600 3.360 3.315 3.400 . 0 0 "[ . 1]" 1
162 2 4 DA H1' 2 4 DA H5' 5.400 3.800 7.000 4.565 4.503 4.611 . 0 0 "[ . 1]" 1
163 2 4 DA H1' 2 4 DA H5'' 5.400 3.800 7.000 5.030 5.002 5.049 . 0 0 "[ . 1]" 1
164 2 4 DA H1' 2 4 DA H8 3.900 2.700 5.100 3.808 3.760 3.895 . 0 0 "[ . 1]" 1
165 2 4 DA H2' 2 4 DA H8 3.900 2.700 5.100 3.103 2.371 3.420 0.329 9 0 "[ . 1]" 1
166 2 4 DA H2'' 2 4 DA H8 3.500 2.400 4.600 4.367 3.821 4.596 . 0 0 "[ . 1]" 1
167 2 4 DA H3' 2 4 DA H8 4.200 2.900 5.500 4.695 4.301 4.879 . 0 0 "[ . 1]" 1
168 2 4 DA H4' 2 4 DA H8 4.000 2.800 5.200 4.589 4.455 4.853 . 0 0 "[ . 1]" 1
169 2 4 DA H5' 2 4 DA H8 3.700 2.600 4.800 3.412 3.098 3.899 . 0 0 "[ . 1]" 1
170 2 4 DA H5' 2 5 DG H8 5.400 3.800 7.000 6.177 5.439 7.060 0.060 1 0 "[ . 1]" 1
171 2 4 DA H5'' 2 4 DA H8 3.700 2.600 4.800 4.604 4.531 4.690 . 0 0 "[ . 1]" 1
172 2 4 DA H5'' 2 5 DG H8 5.400 3.800 7.000 6.165 5.806 6.633 . 0 0 "[ . 1]" 1
173 2 5 DG H1 2 5 DG H21 2.700 . 3.600 2.196 2.195 2.197 . 0 0 "[ . 1]" 1
174 2 5 DG H1 2 5 DG H22 2.700 . 3.600 3.465 3.464 3.465 . 0 0 "[ . 1]" 1
175 2 5 DG H1 3 5 DG H1 3.800 2.600 5.000 4.310 3.368 4.827 . 0 0 "[ . 1]" 1
176 2 5 DG H1 3 6 DG H8 3.800 2.600 5.000 5.034 4.953 5.088 0.088 3 0 "[ . 1]" 1
177 2 5 DG H1' 2 5 DG H2' 3.300 2.300 4.300 3.053 3.049 3.060 . 0 0 "[ . 1]" 1
178 2 5 DG H1' 2 5 DG H2'' 3.100 2.200 4.000 2.415 2.409 2.424 . 0 0 "[ . 1]" 1
179 2 5 DG H1' 2 5 DG H3' 5.300 3.700 6.900 3.845 3.823 3.861 . 0 0 "[ . 1]" 1
180 2 5 DG H1' 2 5 DG H4' 3.500 2.400 4.600 3.044 2.945 3.118 . 0 0 "[ . 1]" 1
181 2 5 DG H1' 2 5 DG H5' 4.400 3.100 5.700 4.779 4.530 4.859 . 0 0 "[ . 1]" 1
182 2 5 DG H1' 2 5 DG H8 2.700 . 3.500 2.521 2.516 2.529 . 0 0 "[ . 1]" 1
183 2 5 DG H1' 2 6 DG H8 4.300 3.000 5.600 4.403 4.183 4.555 . 0 0 "[ . 1]" 1
184 2 5 DG H2' 2 5 DG H8 3.700 2.600 4.800 4.503 4.479 4.544 . 0 0 "[ . 1]" 1
185 2 5 DG H2' 2 6 DG H8 3.600 2.500 4.700 3.062 2.925 3.206 . 0 0 "[ . 1]" 1
186 2 5 DG H2'' 2 5 DG H8 4.000 2.800 5.200 4.104 4.073 4.123 . 0 0 "[ . 1]" 1
187 2 5 DG H2'' 2 6 DG H8 3.500 2.400 4.600 2.382 2.339 2.485 0.061 6 0 "[ . 1]" 1
188 2 5 DG H21 3 6 DG H8 3.800 2.600 5.000 3.276 3.237 3.309 . 0 0 "[ . 1]" 1
189 2 5 DG H3' 2 5 DG H8 5.100 3.600 6.600 6.087 6.080 6.096 . 0 0 "[ . 1]" 1
190 2 5 DG H8 2 6 DG H1' 4.500 3.100 5.900 5.124 4.644 5.606 . 0 0 "[ . 1]" 1
191 2 6 DG H1 2 6 DG H21 2.700 . 3.600 2.200 2.200 2.202 . 0 0 "[ . 1]" 1
192 2 6 DG H1 2 6 DG H22 2.700 . 3.600 3.467 3.466 3.468 . 0 0 "[ . 1]" 1
193 2 6 DG H1 3 4 DA H2 5.000 3.500 6.500 3.771 3.485 4.223 0.015 8 0 "[ . 1]" 1
194 2 6 DG H1 3 5 DG H1 3.800 2.600 5.000 4.572 4.518 4.675 . 0 0 "[ . 1]" 1
195 2 6 DG H1' 2 6 DG H2' 3.300 2.300 4.300 3.055 3.049 3.061 . 0 0 "[ . 1]" 1
196 2 6 DG H1' 2 6 DG H2'' 3.100 2.100 4.100 2.432 2.418 2.447 . 0 0 "[ . 1]" 1
197 2 6 DG H1' 2 6 DG H3' 4.100 2.900 5.300 3.858 3.846 3.871 . 0 0 "[ . 1]" 1
198 2 6 DG H1' 2 6 DG H4' 3.600 2.500 4.700 3.132 3.051 3.211 . 0 0 "[ . 1]" 1
199 2 6 DG H1' 2 6 DG H8 3.900 2.700 5.100 3.881 3.875 3.886 . 0 0 "[ . 1]" 1
200 2 6 DG H1' 3 4 DA H8 5.200 3.600 6.800 5.243 4.877 5.698 . 0 0 "[ . 1]" 1
201 2 6 DG H2' 2 6 DG H8 3.100 2.200 4.000 2.265 2.222 2.328 . 0 0 "[ . 1]" 1
202 2 6 DG H2' 3 4 DA H8 4.300 3.000 5.600 3.718 3.084 4.197 . 0 0 "[ . 1]" 1
203 2 6 DG H2'' 2 6 DG H8 3.200 2.200 4.200 3.688 3.636 3.751 . 0 0 "[ . 1]" 1
204 2 6 DG H2'' 3 4 DA H8 4.100 2.900 5.300 3.378 2.919 3.855 . 0 0 "[ . 1]" 1
205 2 6 DG H3' 2 6 DG H8 3.700 2.600 4.800 4.311 4.274 4.330 . 0 0 "[ . 1]" 1
206 2 6 DG H8 3 4 DA H1' 4.900 3.400 6.400 4.860 4.545 5.069 . 0 0 "[ . 1]" 1
207 2 6 DG H8 3 4 DA H2' 4.300 3.000 5.600 3.794 3.545 4.096 . 0 0 "[ . 1]" 1
208 2 6 DG H8 3 4 DA H2'' 4.500 3.100 5.900 3.175 3.073 3.406 0.027 6 0 "[ . 1]" 1
209 2 6 DG H8 3 4 DA H3' 5.900 4.100 7.700 5.501 5.314 5.776 . 0 0 "[ . 1]" 1
210 2 6 DG H8 3 4 DA H8 4.200 3.000 5.400 4.608 4.090 5.142 . 0 0 "[ . 1]" 1
211 2 6 DG H8 3 5 DG H1 3.800 2.600 5.000 5.029 4.999 5.090 0.090 1 0 "[ . 1]" 1
212 2 6 DG H8 3 5 DG H21 3.800 2.600 5.000 3.271 3.250 3.317 . 0 0 "[ . 1]" 1
213 3 1 DG H1' 3 1 DG H2' 2.800 . 3.600 3.056 3.051 3.062 . 0 0 "[ . 1]" 1
214 3 1 DG H1' 3 1 DG H2'' 2.900 . 3.800 2.409 2.400 2.421 . 0 0 "[ . 1]" 1
215 3 1 DG H1' 3 1 DG H3' 3.700 2.600 4.800 3.863 3.847 3.878 . 0 0 "[ . 1]" 1
216 3 1 DG H1' 3 1 DG H4' 3.700 2.600 4.800 3.241 3.043 3.335 . 0 0 "[ . 1]" 1
217 3 1 DG H1' 3 1 DG H8 3.000 2.100 3.900 2.557 2.522 2.646 . 0 0 "[ . 1]" 1
218 3 1 DG H1' 3 2 DT H6 4.300 3.000 5.600 5.046 4.030 5.569 . 0 0 "[ . 1]" 1
219 3 1 DG H2' 3 1 DG H8 3.800 2.700 4.900 4.272 4.007 4.423 . 0 0 "[ . 1]" 1
220 3 1 DG H2' 3 2 DT H6 4.000 2.800 5.200 3.485 2.914 5.267 0.067 8 0 "[ . 1]" 1
221 3 1 DG H2'' 3 1 DG H8 3.800 2.700 4.900 3.812 3.485 4.000 . 0 0 "[ . 1]" 1
222 3 1 DG H2'' 3 2 DT H6 4.000 2.800 5.200 3.023 2.709 3.608 0.091 9 0 "[ . 1]" 1
223 3 1 DG H3' 3 1 DG H8 4.600 3.200 6.000 5.975 5.807 6.060 0.060 7 0 "[ . 1]" 1
224 3 1 DG H3' 3 2 DT H6 5.100 3.600 6.600 3.780 3.471 4.800 0.129 6 0 "[ . 1]" 1
225 3 1 DG H8 3 2 DT M7 5.000 3.500 6.500 5.558 3.478 6.423 0.022 8 0 "[ . 1]" 1
226 3 2 DT H1' 3 2 DT H2' 3.600 2.500 4.700 3.057 3.043 3.063 . 0 0 "[ . 1]" 1
227 3 2 DT H1' 3 2 DT H2'' 3.300 2.300 4.300 2.429 2.402 2.441 . 0 0 "[ . 1]" 1
228 3 2 DT H1' 3 2 DT H3' 4.900 3.400 6.400 3.816 3.787 3.854 . 0 0 "[ . 1]" 1
229 3 2 DT H1' 3 2 DT H4' 4.000 2.800 5.200 3.169 3.087 3.354 . 0 0 "[ . 1]" 1
230 3 2 DT H1' 3 2 DT H5' 4.000 2.800 5.200 4.564 4.542 4.601 . 0 0 "[ . 1]" 1
231 3 2 DT H1' 3 2 DT H5'' 4.000 2.800 5.200 4.945 4.902 5.012 . 0 0 "[ . 1]" 1
232 3 2 DT H1' 3 2 DT H6 3.700 2.600 4.800 3.713 3.706 3.718 . 0 0 "[ . 1]" 1
233 3 2 DT H1' 3 3 DT H6 4.300 3.000 5.600 4.676 4.176 4.915 . 0 0 "[ . 1]" 1
234 3 2 DT H2' 3 2 DT H6 2.900 . 3.800 2.162 2.000 2.266 . 0 0 "[ . 1]" 1
235 3 2 DT H2'' 3 2 DT H6 3.300 2.300 4.300 3.599 3.419 3.728 . 0 0 "[ . 1]" 1
236 3 2 DT H3' 3 2 DT H6 3.900 2.700 5.100 4.122 4.015 4.193 . 0 0 "[ . 1]" 1
237 3 2 DT H3' 3 3 DT H6 4.800 3.400 6.200 4.135 3.346 5.428 0.054 10 0 "[ . 1]" 1
238 3 2 DT H4' 3 2 DT H6 3.900 2.700 5.100 4.648 4.464 4.767 . 0 0 "[ . 1]" 1
239 3 2 DT H5' 3 2 DT H6 4.000 2.800 5.200 3.951 3.525 4.152 . 0 0 "[ . 1]" 1
240 3 2 DT H5'' 3 2 DT H6 4.200 2.900 5.500 4.683 4.288 4.829 . 0 0 "[ . 1]" 1
241 3 2 DT H6 3 2 DT M7 3.000 2.100 3.900 2.261 2.255 2.264 . 0 0 "[ . 1]" 1
242 3 2 DT H6 3 3 DT M7 4.900 3.400 6.400 4.161 3.392 5.649 0.008 5 0 "[ . 1]" 1
243 3 3 DT H1' 3 3 DT H2' 3.400 2.400 4.400 3.052 3.043 3.059 . 0 0 "[ . 1]" 1
244 3 3 DT H1' 3 3 DT H2'' 3.400 2.400 4.400 2.408 2.397 2.421 0.003 6 0 "[ . 1]" 1
245 3 3 DT H1' 3 3 DT H3' 3.700 2.600 4.800 3.845 3.826 3.865 . 0 0 "[ . 1]" 1
246 3 3 DT H1' 3 3 DT H4' 3.600 2.500 4.700 3.271 3.200 3.331 . 0 0 "[ . 1]" 1
247 3 3 DT H1' 3 3 DT H6 3.500 2.400 4.600 3.714 3.711 3.717 . 0 0 "[ . 1]" 1
248 3 3 DT H1' 3 4 DA H8 4.500 3.100 5.900 5.154 5.059 5.302 . 0 0 "[ . 1]" 1
249 3 3 DT H2'' 3 3 DT H6 3.300 2.300 4.300 3.661 3.551 3.742 . 0 0 "[ . 1]" 1
250 3 3 DT H2'' 3 4 DA H8 3.900 2.700 5.100 2.778 2.670 2.915 0.030 9 0 "[ . 1]" 1
251 3 3 DT H3' 3 3 DT H6 4.000 2.800 5.200 4.069 4.035 4.121 . 0 0 "[ . 1]" 1
252 3 3 DT H3' 3 4 DA H8 4.000 2.800 5.200 3.556 3.410 3.702 . 0 0 "[ . 1]" 1
253 3 3 DT H4' 3 3 DT H6 3.700 2.600 4.800 4.568 4.488 4.653 . 0 0 "[ . 1]" 1
254 3 3 DT H6 3 3 DT M7 2.700 . 3.500 2.379 2.376 2.380 . 0 0 "[ . 1]" 1
255 3 3 DT H6 3 4 DA H8 4.900 3.400 6.400 4.800 4.711 4.922 . 0 0 "[ . 1]" 1
256 3 3 DT M7 3 4 DA H8 4.200 2.900 5.500 5.487 5.389 5.564 0.064 10 0 "[ . 1]" 1
257 3 4 DA H1' 3 4 DA H2' 3.700 2.600 4.800 3.062 3.057 3.066 . 0 0 "[ . 1]" 1
258 3 4 DA H1' 3 4 DA H2'' 3.300 2.300 4.300 2.424 2.415 2.433 . 0 0 "[ . 1]" 1
259 3 4 DA H1' 3 4 DA H3' 4.400 3.100 5.700 3.832 3.817 3.852 . 0 0 "[ . 1]" 1
260 3 4 DA H1' 3 4 DA H4' 4.500 3.100 5.900 3.221 3.175 3.265 . 0 0 "[ . 1]" 1
261 3 4 DA H1' 3 4 DA H8 3.800 2.700 4.900 3.886 3.879 3.892 . 0 0 "[ . 1]" 1
262 3 4 DA H1' 3 5 DG H1 3.800 2.600 5.000 3.714 3.488 4.014 . 0 0 "[ . 1]" 1
263 3 4 DA H1' 3 5 DG H21 3.800 2.600 5.000 2.688 2.550 3.542 0.050 7 0 "[ . 1]" 1
264 3 4 DA H2 3 5 DG H1 3.800 2.600 5.000 3.429 3.194 3.910 . 0 0 "[ . 1]" 1
265 3 4 DA H2' 3 4 DA H3' 3.100 2.200 4.000 2.392 2.386 2.396 . 0 0 "[ . 1]" 1
266 3 4 DA H2' 3 4 DA H8 3.100 2.200 4.000 2.268 2.231 2.320 . 0 0 "[ . 1]" 1
267 3 4 DA H2'' 3 4 DA H3' 3.200 2.200 4.200 2.714 2.709 2.722 . 0 0 "[ . 1]" 1
268 3 4 DA H2'' 3 4 DA H8 3.200 2.100 4.300 3.655 3.611 3.718 . 0 0 "[ . 1]" 1
269 3 4 DA H2'' 3 5 DG H1 3.800 2.600 5.000 4.577 4.230 4.790 . 0 0 "[ . 1]" 1
270 3 4 DA H3' 3 4 DA H4' 3.300 2.300 4.300 2.742 2.735 2.750 . 0 0 "[ . 1]" 1
271 3 4 DA H3' 3 4 DA H5' 3.300 2.300 4.300 3.671 3.666 3.681 . 0 0 "[ . 1]" 1
272 3 4 DA H3' 3 4 DA H5'' 3.400 2.400 4.400 2.635 2.613 2.659 . 0 0 "[ . 1]" 1
273 3 4 DA H3' 3 4 DA H8 3.700 2.600 4.800 4.380 4.330 4.423 . 0 0 "[ . 1]" 1
274 3 4 DA H4' 3 4 DA H8 5.000 3.500 6.500 5.034 4.989 5.082 . 0 0 "[ . 1]" 1
275 3 4 DA H5' 3 4 DA H8 4.500 3.100 5.900 4.349 4.229 4.434 . 0 0 "[ . 1]" 1
276 3 4 DA H5'' 3 4 DA H8 4.500 3.100 5.900 5.045 4.966 5.161 . 0 0 "[ . 1]" 1
277 3 5 DG H1 3 5 DG H21 2.700 . 3.600 2.195 2.195 2.196 . 0 0 "[ . 1]" 1
278 3 5 DG H1 3 5 DG H22 2.700 . 3.600 3.464 3.463 3.465 . 0 0 "[ . 1]" 1
279 3 5 DG H1' 3 5 DG H2' 3.700 2.600 4.800 3.067 3.063 3.070 . 0 0 "[ . 1]" 1
280 3 5 DG H1' 3 5 DG H2'' 3.300 2.300 4.300 2.429 2.422 2.437 . 0 0 "[ . 1]" 1
281 3 5 DG H1' 3 5 DG H3' 4.600 3.200 6.000 3.826 3.798 3.844 . 0 0 "[ . 1]" 1
282 3 5 DG H1' 3 5 DG H8 2.800 . 3.600 2.536 2.516 2.554 . 0 0 "[ . 1]" 1
283 3 5 DG H1' 3 6 DG H8 3.800 2.700 4.900 4.211 4.068 4.645 . 0 0 "[ . 1]" 1
284 3 5 DG H2' 3 5 DG H3' 2.900 . 3.800 2.371 2.358 2.391 . 0 0 "[ . 1]" 1
285 3 5 DG H2' 3 5 DG H8 4.100 2.900 5.300 4.402 4.294 4.536 . 0 0 "[ . 1]" 1
286 3 5 DG H2' 3 6 DG H8 3.300 2.300 4.300 2.925 2.775 3.147 . 0 0 "[ . 1]" 1
287 3 5 DG H2'' 3 5 DG H3' 3.000 . 4.000 2.743 2.716 2.763 . 0 0 "[ . 1]" 1
288 3 5 DG H2'' 3 5 DG H8 3.800 2.700 4.900 3.907 3.783 4.118 . 0 0 "[ . 1]" 1
289 3 5 DG H2'' 3 6 DG H8 3.100 2.200 4.000 2.210 2.149 2.378 0.051 4 0 "[ . 1]" 1
290 3 5 DG H3' 3 5 DG H4' 3.200 2.200 4.200 2.804 2.755 2.831 . 0 0 "[ . 1]" 1
291 3 5 DG H3' 3 5 DG H5' 3.100 2.200 4.000 3.651 3.643 3.664 . 0 0 "[ . 1]" 1
292 3 5 DG H3' 3 5 DG H5'' 3.200 2.200 4.200 2.680 2.629 2.817 . 0 0 "[ . 1]" 1
293 3 5 DG H3' 3 5 DG H8 4.800 3.400 6.200 6.015 5.963 6.087 . 0 0 "[ . 1]" 1
294 3 5 DG H3' 3 6 DG H8 4.100 2.900 5.300 4.464 4.193 4.658 . 0 0 "[ . 1]" 1
295 3 5 DG H8 3 6 DG H1 5.000 3.500 6.500 5.933 5.681 6.202 . 0 0 "[ . 1]" 1
296 3 5 DG H8 3 6 DG H1' 4.000 2.800 5.200 4.545 3.964 5.208 0.008 9 0 "[ . 1]" 1
297 3 5 DG H8 3 6 DG H2' 5.400 3.800 7.000 5.731 5.300 6.426 . 0 0 "[ . 1]" 1
298 3 5 DG H8 3 6 DG H2'' 5.500 3.800 7.200 6.403 5.896 7.112 . 0 0 "[ . 1]" 1
299 3 5 DG H8 3 6 DG H8 4.400 3.100 5.700 4.558 4.220 5.177 . 0 0 "[ . 1]" 1
300 3 6 DG H1 3 6 DG H21 2.700 . 3.600 2.196 2.195 2.197 . 0 0 "[ . 1]" 1
301 3 6 DG H1' 3 6 DG H2' 3.200 2.200 4.200 3.060 3.053 3.066 . 0 0 "[ . 1]" 1
302 3 6 DG H1' 3 6 DG H2'' 3.500 2.400 4.600 2.432 2.416 2.448 . 0 0 "[ . 1]" 1
303 3 6 DG H1' 3 6 DG H3' 4.200 2.900 5.500 3.844 3.826 3.860 . 0 0 "[ . 1]" 1
304 3 6 DG H1' 3 6 DG H4' 3.600 2.500 4.700 3.125 3.046 3.205 . 0 0 "[ . 1]" 1
305 3 6 DG H1' 3 6 DG H8 4.000 2.800 5.200 3.884 3.877 3.892 . 0 0 "[ . 1]" 1
306 3 6 DG H2' 3 6 DG H8 3.300 2.300 4.300 2.307 2.272 2.358 0.028 10 0 "[ . 1]" 1
307 3 6 DG H2'' 3 6 DG H8 3.100 2.200 4.000 3.717 3.682 3.763 . 0 0 "[ . 1]" 1
308 3 6 DG H3' 3 6 DG H8 3.900 2.700 5.100 4.345 4.300 4.392 . 0 0 "[ . 1]" 1
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