NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
632439 |
5w77   |
27144 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_5w77
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 906
_Distance_constraint_stats_list.Viol_count 1539
_Distance_constraint_stats_list.Viol_total 2385.802
_Distance_constraint_stats_list.Viol_max 0.901
_Distance_constraint_stats_list.Viol_rms 0.0472
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0117
_Distance_constraint_stats_list.Viol_average_violations_only 0.1033
_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 DT 15.664 0.296 9 0 "[ . 1 .]"
1 2 DG 20.990 0.360 15 0 "[ . 1 .]"
1 3 DA 9.706 0.166 8 0 "[ . 1 .]"
1 4 DG 4.721 0.249 8 0 "[ . 1 .]"
1 5 DG 9.214 0.357 9 0 "[ . 1 .]"
1 6 DG 10.281 0.447 12 0 "[ . 1 .]"
1 7 DT 7.163 0.447 12 0 "[ . 1 .]"
1 8 DG 6.082 0.318 9 0 "[ . 1 .]"
1 9 DG 12.275 0.416 10 0 "[ . 1 .]"
1 10 DG 11.698 0.416 10 0 "[ . 1 .]"
1 11 DT 17.860 0.901 9 1 "[ . +1 .]"
1 12 DA 20.337 0.901 9 1 "[ . +1 .]"
1 13 DG 8.823 0.412 11 0 "[ . 1 .]"
1 14 DG 16.272 0.412 11 0 "[ . 1 .]"
1 15 DG 4.927 0.182 5 0 "[ . 1 .]"
1 16 DT 3.596 0.178 14 0 "[ . 1 .]"
1 17 DG 13.562 0.391 8 0 "[ . 1 .]"
1 18 DG 10.524 0.391 8 0 "[ . 1 .]"
1 19 DG 6.521 0.314 5 0 "[ . 1 .]"
1 20 DT 7.641 0.171 14 0 "[ . 1 .]"
1 21 DA 7.506 0.182 11 0 "[ . 1 .]"
1 22 DA 10.406 0.237 12 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 11 DT H4' 1 12 DA H1' 5.000 . 5.500 3.885 3.666 4.857 . 0 0 "[ . 1 .]" 1
2 1 12 DA H1' 1 13 DG H5'' 5.000 . 5.500 4.985 3.532 5.524 0.024 10 0 "[ . 1 .]" 1
3 1 12 DA H1' 1 12 DA H5' 5.000 . 5.500 4.727 3.998 5.197 . 0 0 "[ . 1 .]" 1
4 1 12 DA H1' 1 12 DA H5'' 5.000 . 5.500 4.693 4.154 5.034 . 0 0 "[ . 1 .]" 1
5 1 12 DA H1' 1 12 DA H2 6.000 . 6.500 4.531 4.347 4.835 . 0 0 "[ . 1 .]" 1
6 1 12 DA H1' 1 12 DA H8 4.000 . 4.500 3.842 3.692 3.915 . 0 0 "[ . 1 .]" 1
7 1 12 DA H1' 1 12 DA H2' 3.000 . 3.500 2.968 2.639 3.074 . 0 0 "[ . 1 .]" 1
8 1 12 DA H1' 1 12 DA H2'' 3.000 . 3.500 2.393 2.346 2.427 . 0 0 "[ . 1 .]" 1
9 1 12 DA H1' 1 12 DA H3' 5.000 . 5.500 3.856 3.789 4.110 . 0 0 "[ . 1 .]" 1
10 1 11 DT H5' 1 12 DA H1' 5.000 . 5.500 4.078 2.829 5.686 0.186 15 0 "[ . 1 .]" 1
11 1 11 DT H4' 1 12 DA H5' 5.000 . 5.500 3.102 2.114 3.730 . 0 0 "[ . 1 .]" 1
12 1 11 DT H4' 1 12 DA H5'' 5.000 . 5.500 3.382 2.093 4.393 . 0 0 "[ . 1 .]" 1
13 1 11 DT H4' 1 12 DA H8 5.000 . 5.500 2.917 2.809 3.141 . 0 0 "[ . 1 .]" 1
14 1 11 DT H4' 1 12 DA H3' 6.000 . 6.500 4.600 4.073 4.938 . 0 0 "[ . 1 .]" 1
15 1 11 DT H4' 1 11 DT H5' 3.000 . 3.500 2.479 2.180 2.889 . 0 0 "[ . 1 .]" 1
16 1 11 DT H1' 1 11 DT H4' 4.000 . 4.500 3.521 3.417 3.702 . 0 0 "[ . 1 .]" 1
17 1 11 DT H4' 1 11 DT H6 5.000 . 5.500 4.027 3.715 4.269 . 0 0 "[ . 1 .]" 1
18 1 11 DT H2' 1 11 DT H4' 4.000 . 4.500 3.938 3.845 4.022 . 0 0 "[ . 1 .]" 1
19 1 11 DT H2'' 1 11 DT H4' 4.000 . 4.500 3.601 3.055 4.060 . 0 0 "[ . 1 .]" 1
20 1 21 DA H2' 1 22 DA H1' 6.000 . 6.500 5.610 5.584 5.619 . 0 0 "[ . 1 .]" 1
21 1 21 DA H2'' 1 22 DA H1' 5.000 . 5.500 4.102 4.080 4.112 . 0 0 "[ . 1 .]" 1
22 1 21 DA H2' 1 22 DA H8 5.000 . 5.500 2.392 2.340 2.406 . 0 0 "[ . 1 .]" 1
23 1 21 DA H2' 1 21 DA H5' 5.000 . 5.500 5.299 5.290 5.305 . 0 0 "[ . 1 .]" 1
24 1 21 DA H2' 1 21 DA H5'' 5.000 . 5.500 4.916 4.908 4.926 . 0 0 "[ . 1 .]" 1
25 1 21 DA H2' 1 21 DA H4' 4.000 . 4.500 3.874 3.865 3.880 . 0 0 "[ . 1 .]" 1
26 1 21 DA H1' 1 21 DA H2' 3.000 . 3.500 2.776 2.773 2.779 . 0 0 "[ . 1 .]" 1
27 1 21 DA H2' 1 21 DA H8 3.000 . 3.500 2.994 2.969 3.047 . 0 0 "[ . 1 .]" 1
28 1 21 DA H2' 1 21 DA H2'' 2.500 . 3.000 1.758 1.757 1.759 0.043 13 0 "[ . 1 .]" 1
29 1 21 DA H2' 1 22 DA H5' 5.000 . 5.500 4.297 4.273 4.326 . 0 0 "[ . 1 .]" 1
30 1 21 DA H2' 1 22 DA H5'' 5.500 . 6.000 5.189 5.177 5.207 . 0 0 "[ . 1 .]" 1
31 1 19 DG H1' 1 20 DT H2' 6.000 . 6.500 5.852 5.772 5.946 . 0 0 "[ . 1 .]" 1
32 1 20 DT H2' 1 21 DA H8 5.000 . 5.500 2.946 2.894 2.973 . 0 0 "[ . 1 .]" 1
33 1 20 DT H2' 1 21 DA H4' 5.500 . 6.000 5.083 4.739 5.211 . 0 0 "[ . 1 .]" 1
34 1 20 DT H2' 1 21 DA H5' 5.000 . 5.500 3.973 3.679 4.073 . 0 0 "[ . 1 .]" 1
35 1 20 DT H2' 1 21 DA H5'' 5.000 . 5.500 4.959 4.725 5.059 . 0 0 "[ . 1 .]" 1
36 1 20 DT H2' 1 20 DT H5' 5.000 . 5.500 5.244 5.186 5.265 . 0 0 "[ . 1 .]" 1
37 1 20 DT H2' 1 20 DT H4' 4.000 . 4.500 3.819 3.803 3.868 . 0 0 "[ . 1 .]" 1
38 1 20 DT H1' 1 20 DT H2' 3.000 . 3.500 2.872 2.844 2.890 . 0 0 "[ . 1 .]" 1
39 1 20 DT H2' 1 20 DT H2'' 3.000 . 3.500 1.759 1.757 1.761 0.043 11 0 "[ . 1 .]" 1
40 1 20 DT H2' 1 20 DT M7 5.000 . 5.500 4.285 4.221 4.379 . 0 0 "[ . 1 .]" 1
41 1 20 DT H2' 1 20 DT H6 4.000 . 4.500 2.906 2.830 3.030 . 0 0 "[ . 1 .]" 1
42 1 16 DT H2'' 1 16 DT H5' 5.000 . 5.500 5.185 4.931 5.272 . 0 0 "[ . 1 .]" 1
43 1 16 DT H2'' 1 16 DT H5'' 5.000 . 5.500 4.796 4.622 4.946 . 0 0 "[ . 1 .]" 1
44 1 16 DT H2'' 1 16 DT H4' 4.000 . 4.500 3.709 2.799 4.018 . 0 0 "[ . 1 .]" 1
45 1 16 DT H1' 1 16 DT H2'' 3.000 . 3.500 2.379 2.331 2.401 . 0 0 "[ . 1 .]" 1
46 1 16 DT H2'' 1 16 DT M7 6.000 . 6.500 5.418 5.296 5.635 . 0 0 "[ . 1 .]" 1
47 1 16 DT H2'' 1 16 DT H6 4.000 . 4.500 3.994 3.893 4.130 . 0 0 "[ . 1 .]" 1
48 1 16 DT H2' 1 16 DT H2'' 3.000 . 3.500 1.761 1.759 1.762 0.041 11 0 "[ . 1 .]" 1
49 1 16 DT H2'' 1 16 DT H3' 3.000 . 3.500 2.794 2.701 3.043 . 0 0 "[ . 1 .]" 1
50 1 16 DT H2'' 1 17 DG Q5' 5.000 . 5.500 4.047 2.040 4.887 . 0 0 "[ . 1 .]" 1
51 1 12 DA H1' 1 13 DG H5' 6.000 . 6.500 5.739 4.321 6.633 0.133 9 0 "[ . 1 .]" 1
52 1 13 DG H5' 1 13 DG H5'' 2.500 . 3.000 1.776 1.773 1.778 0.027 15 0 "[ . 1 .]" 1
53 1 13 DG H4' 1 13 DG H5' 3.000 . 3.500 2.650 2.497 2.728 . 0 0 "[ . 1 .]" 1
54 1 13 DG H1' 1 13 DG H5' 5.000 . 5.500 4.408 4.281 4.598 . 0 0 "[ . 1 .]" 1
55 1 13 DG H5' 1 13 DG H8 4.000 . 4.500 2.420 2.133 2.931 . 0 0 "[ . 1 .]" 1
56 1 13 DG H2' 1 13 DG H5' 5.000 . 5.500 4.091 3.900 4.412 . 0 0 "[ . 1 .]" 1
57 1 13 DG H2'' 1 13 DG H5' 5.000 . 5.500 5.001 4.914 5.195 . 0 0 "[ . 1 .]" 1
58 1 13 DG H3' 1 13 DG H5' 4.000 . 4.500 3.634 3.599 3.681 . 0 0 "[ . 1 .]" 1
59 1 12 DA H2' 1 13 DG H5' 5.000 . 5.500 5.103 4.069 5.489 . 0 0 "[ . 1 .]" 1
60 1 12 DA H2'' 1 13 DG H5' 5.000 . 5.500 4.141 3.403 5.050 . 0 0 "[ . 1 .]" 1
61 1 12 DA H3' 1 13 DG H5' 5.000 . 5.500 4.601 3.541 5.238 . 0 0 "[ . 1 .]" 1
62 1 13 DG H4' 1 13 DG H5'' 3.000 . 3.500 2.247 2.198 2.339 . 0 0 "[ . 1 .]" 1
63 1 13 DG H1' 1 13 DG H5'' 5.000 . 5.500 5.147 5.127 5.173 . 0 0 "[ . 1 .]" 1
64 1 13 DG H5'' 1 13 DG H8 5.000 . 5.500 3.696 3.480 3.978 . 0 0 "[ . 1 .]" 1
65 1 13 DG H2' 1 13 DG H5'' 5.000 . 5.500 4.326 4.036 4.489 . 0 0 "[ . 1 .]" 1
66 1 13 DG H2'' 1 13 DG H5'' 5.000 . 5.500 5.091 4.948 5.180 . 0 0 "[ . 1 .]" 1
67 1 13 DG H3' 1 13 DG H5'' 4.000 . 4.500 2.894 2.626 3.045 . 0 0 "[ . 1 .]" 1
68 1 12 DA H2' 1 13 DG H5'' 5.000 . 5.500 3.774 3.012 4.103 . 0 0 "[ . 1 .]" 1
69 1 12 DA H2'' 1 13 DG H5'' 5.000 . 5.500 3.095 2.083 4.351 . 0 0 "[ . 1 .]" 1
70 1 12 DA H3' 1 13 DG H5'' 5.000 . 5.500 3.554 2.104 4.494 . 0 0 "[ . 1 .]" 1
71 1 12 DA H1' 1 13 DG H4' 6.000 . 6.500 5.881 4.267 6.826 0.326 14 0 "[ . 1 .]" 1
72 1 13 DG H1' 1 13 DG H4' 5.000 . 5.500 3.690 3.599 3.761 . 0 0 "[ . 1 .]" 1
73 1 13 DG H2' 1 13 DG H4' 5.000 . 5.500 3.972 3.879 4.005 . 0 0 "[ . 1 .]" 1
74 1 13 DG H2'' 1 13 DG H4' 5.000 . 5.500 3.946 3.894 4.045 . 0 0 "[ . 1 .]" 1
75 1 13 DG H3' 1 13 DG H4' 4.000 . 4.500 2.702 2.655 2.725 . 0 0 "[ . 1 .]" 1
76 1 13 DG H1' 1 13 DG H8 4.000 . 4.500 3.844 3.772 3.872 . 0 0 "[ . 1 .]" 1
77 1 13 DG H1' 1 13 DG H2' 3.000 . 3.500 2.943 2.905 3.001 . 0 0 "[ . 1 .]" 1
78 1 13 DG H1' 1 13 DG H2'' 3.000 . 3.500 2.326 2.306 2.361 . 0 0 "[ . 1 .]" 1
79 1 13 DG H1' 1 13 DG H3' 4.000 . 4.500 4.051 3.974 4.087 . 0 0 "[ . 1 .]" 1
80 1 13 DG H1' 1 14 DG H8 5.000 . 5.500 3.793 3.435 4.533 . 0 0 "[ . 1 .]" 1
81 1 13 DG H1' 1 14 DG H5' 5.000 . 5.500 3.563 2.659 5.705 0.205 1 0 "[ . 1 .]" 1
82 1 13 DG H1' 1 14 DG H5'' 5.000 . 5.500 4.853 4.401 5.177 . 0 0 "[ . 1 .]" 1
83 1 13 DG H2' 1 14 DG H5' 5.000 . 5.500 4.430 4.077 5.434 . 0 0 "[ . 1 .]" 1
84 1 13 DG H2' 1 14 DG H5'' 5.000 . 5.500 5.185 4.017 5.520 0.020 15 0 "[ . 1 .]" 1
85 1 13 DG H2'' 1 14 DG H5' 5.000 . 5.500 2.806 2.346 3.964 . 0 0 "[ . 1 .]" 1
86 1 13 DG H2'' 1 14 DG H5'' 5.000 . 5.500 3.627 2.925 3.839 . 0 0 "[ . 1 .]" 1
87 1 13 DG H3' 1 14 DG H5' 5.000 . 5.500 4.485 4.247 5.216 . 0 0 "[ . 1 .]" 1
88 1 13 DG H3' 1 14 DG H5'' 5.000 . 5.500 5.035 4.004 5.322 . 0 0 "[ . 1 .]" 1
89 1 12 DA H3' 1 13 DG H3' 5.000 . 5.500 4.431 3.252 5.633 0.133 15 0 "[ . 1 .]" 1
90 1 13 DG H2' 1 14 DG H4' 5.000 . 5.500 5.735 5.259 5.912 0.412 11 0 "[ . 1 .]" 1
91 1 13 DG H2'' 1 14 DG H4' 5.000 . 5.500 4.059 3.634 4.234 . 0 0 "[ . 1 .]" 1
92 1 12 DA H1' 1 14 DG H8 5.000 . 5.500 4.822 4.153 5.363 . 0 0 "[ . 1 .]" 1
93 1 13 DG H2' 1 13 DG H8 5.000 . 5.500 3.007 2.688 3.320 . 0 0 "[ . 1 .]" 1
94 1 13 DG H2'' 1 13 DG H8 5.000 . 5.500 4.359 4.152 4.553 . 0 0 "[ . 1 .]" 1
95 1 13 DG H3' 1 13 DG H8 6.000 . 6.500 3.967 3.701 4.346 . 0 0 "[ . 1 .]" 1
96 1 13 DG H4' 1 13 DG H8 6.000 . 6.500 4.180 4.092 4.384 . 0 0 "[ . 1 .]" 1
97 1 12 DA H1' 1 13 DG H2' 5.000 . 5.500 3.966 3.000 4.944 . 0 0 "[ . 1 .]" 1
98 1 13 DG H2' 1 13 DG H2'' 2.500 . 3.000 1.747 1.741 1.758 0.059 15 0 "[ . 1 .]" 1
99 1 13 DG H2' 1 13 DG H3' 3.000 . 3.500 2.350 2.336 2.379 . 0 0 "[ . 1 .]" 1
100 1 12 DA H1' 1 13 DG H2'' 5.500 . 6.000 5.056 4.234 6.068 0.068 9 0 "[ . 1 .]" 1
101 1 13 DG H2'' 1 13 DG H3' 3.000 . 3.500 2.786 2.731 2.813 . 0 0 "[ . 1 .]" 1
102 1 12 DA H1' 1 13 DG H3' 4.000 . 4.500 3.398 2.058 4.333 . 0 0 "[ . 1 .]" 1
103 1 12 DA H8 1 13 DG H3' 5.000 . 5.500 4.328 3.393 5.542 0.042 15 0 "[ . 1 .]" 1
104 1 12 DA H2' 1 13 DG H3' 4.000 . 4.500 3.339 2.086 4.443 . 0 0 "[ . 1 .]" 1
105 1 12 DA H2'' 1 13 DG H3' 4.000 . 4.500 2.584 2.066 3.825 . 0 0 "[ . 1 .]" 1
106 1 4 DG H4' 1 4 DG H5' 3.000 . 3.500 2.536 2.521 2.545 . 0 0 "[ . 1 .]" 1
107 1 4 DG H1' 1 4 DG H5' 5.000 . 5.500 4.561 4.554 4.573 . 0 0 "[ . 1 .]" 1
108 1 4 DG H5' 1 4 DG H8 5.000 . 5.500 3.836 3.802 3.864 . 0 0 "[ . 1 .]" 1
109 1 4 DG H2' 1 4 DG H5' 5.000 . 5.500 4.164 4.116 4.214 . 0 0 "[ . 1 .]" 1
110 1 4 DG H2'' 1 4 DG H5' 5.000 . 5.500 5.168 5.157 5.185 . 0 0 "[ . 1 .]" 1
111 1 4 DG H3' 1 4 DG H5' 4.000 . 4.500 3.680 3.670 3.689 . 0 0 "[ . 1 .]" 1
112 1 4 DG H4' 1 4 DG H5'' 3.000 . 3.500 2.300 2.297 2.310 . 0 0 "[ . 1 .]" 1
113 1 4 DG H1' 1 4 DG H5'' 5.000 . 5.500 5.030 4.993 5.071 . 0 0 "[ . 1 .]" 1
114 1 4 DG H5'' 1 4 DG H8 4.000 . 4.500 4.684 4.601 4.749 0.249 8 0 "[ . 1 .]" 1
115 1 4 DG H2' 1 4 DG H5'' 5.000 . 5.500 4.156 4.125 4.198 . 0 0 "[ . 1 .]" 1
116 1 4 DG H2'' 1 4 DG H5'' 5.000 . 5.500 4.989 4.975 5.005 . 0 0 "[ . 1 .]" 1
117 1 4 DG H3' 1 4 DG H5'' 4.000 . 4.500 2.715 2.693 2.721 . 0 0 "[ . 1 .]" 1
118 1 4 DG H1' 1 4 DG H4' 5.000 . 5.500 3.334 3.271 3.409 . 0 0 "[ . 1 .]" 1
119 1 4 DG H4' 1 4 DG H8 5.000 . 5.500 4.790 4.761 4.809 . 0 0 "[ . 1 .]" 1
120 1 4 DG H2' 1 4 DG H4' 5.000 . 5.500 3.903 3.883 3.928 . 0 0 "[ . 1 .]" 1
121 1 4 DG H2'' 1 4 DG H4' 5.000 . 5.500 3.985 3.970 3.997 . 0 0 "[ . 1 .]" 1
122 1 4 DG H3' 1 4 DG H4' 4.000 . 4.500 2.736 2.730 2.741 . 0 0 "[ . 1 .]" 1
123 1 4 DG H4' 1 5 DG H5' 5.000 . 5.500 3.864 3.746 3.930 . 0 0 "[ . 1 .]" 1
124 1 4 DG H1' 1 4 DG H8 4.000 . 4.500 3.871 3.864 3.877 . 0 0 "[ . 1 .]" 1
125 1 4 DG H1' 1 4 DG H2' 3.000 . 3.500 3.039 3.021 3.053 . 0 0 "[ . 1 .]" 1
126 1 4 DG H1' 1 4 DG H2'' 3.000 . 3.500 2.391 2.378 2.403 . 0 0 "[ . 1 .]" 1
127 1 4 DG H1' 1 4 DG H3' 4.000 . 4.500 3.892 3.848 3.944 . 0 0 "[ . 1 .]" 1
128 1 4 DG H1' 1 5 DG H5' 5.000 . 5.500 2.570 2.391 2.820 . 0 0 "[ . 1 .]" 1
129 1 4 DG H1' 1 5 DG H8 5.000 . 5.500 3.411 3.112 3.539 . 0 0 "[ . 1 .]" 1
130 1 4 DG H2' 1 4 DG H8 4.000 . 4.500 2.394 2.321 2.474 . 0 0 "[ . 1 .]" 1
131 1 4 DG H2'' 1 4 DG H8 4.000 . 4.500 3.867 3.836 3.909 . 0 0 "[ . 1 .]" 1
132 1 4 DG H3' 1 4 DG H8 5.000 . 5.500 4.226 4.082 4.342 . 0 0 "[ . 1 .]" 1
133 1 4 DG H8 1 5 DG H8 5.500 . 6.000 4.886 4.650 5.009 . 0 0 "[ . 1 .]" 1
134 1 3 DA H8 1 4 DG H8 5.500 . 6.000 5.896 5.793 6.011 0.011 15 0 "[ . 1 .]" 1
135 1 4 DG H2' 1 4 DG H2'' 3.000 . 3.500 1.761 1.759 1.762 0.041 14 0 "[ . 1 .]" 1
136 1 4 DG H2' 1 4 DG H3' 3.000 . 3.500 2.375 2.367 2.382 . 0 0 "[ . 1 .]" 1
137 1 4 DG H2' 1 5 DG H5' 5.000 . 5.500 4.672 4.615 4.746 . 0 0 "[ . 1 .]" 1
138 1 4 DG H2' 1 5 DG H8 5.000 . 5.500 3.504 3.339 3.589 . 0 0 "[ . 1 .]" 1
139 1 4 DG H2'' 1 4 DG H3' 3.000 . 3.500 2.727 2.713 2.745 . 0 0 "[ . 1 .]" 1
140 1 4 DG H2'' 1 5 DG H5' 5.000 . 5.500 3.257 3.213 3.352 . 0 0 "[ . 1 .]" 1
141 1 4 DG H2'' 1 5 DG H8 5.000 . 5.500 2.384 2.209 2.524 . 0 0 "[ . 1 .]" 1
142 1 4 DG H3' 1 5 DG H8 5.000 . 5.500 5.082 4.925 5.212 . 0 0 "[ . 1 .]" 1
143 1 8 DG H5' 1 8 DG H5'' 2.500 . 3.000 1.773 1.766 1.779 0.034 12 0 "[ . 1 .]" 1
144 1 8 DG H4' 1 8 DG H5' 3.000 . 3.500 2.359 2.300 2.591 . 0 0 "[ . 1 .]" 1
145 1 8 DG H1' 1 8 DG H5' 5.000 . 5.500 4.724 4.499 4.814 . 0 0 "[ . 1 .]" 1
146 1 8 DG H5' 1 8 DG H8 5.000 . 5.500 3.877 2.594 4.298 . 0 0 "[ . 1 .]" 1
147 1 8 DG H2' 1 8 DG H5' 5.000 . 5.500 4.867 4.017 5.395 . 0 0 "[ . 1 .]" 1
148 1 8 DG H2'' 1 8 DG H5' 5.000 . 5.500 5.065 4.893 5.288 . 0 0 "[ . 1 .]" 1
149 1 8 DG H3' 1 8 DG H5' 4.000 . 4.500 3.695 3.599 3.765 . 0 0 "[ . 1 .]" 1
150 1 7 DT H1' 1 8 DG H5' 5.000 . 5.500 5.092 3.996 5.750 0.250 12 0 "[ . 1 .]" 1
151 1 8 DG H4' 1 8 DG H5'' 3.000 . 3.500 2.485 2.269 2.541 . 0 0 "[ . 1 .]" 1
152 1 8 DG H1' 1 8 DG H5'' 5.000 . 5.500 5.080 4.951 5.156 . 0 0 "[ . 1 .]" 1
153 1 8 DG H5'' 1 8 DG H8 5.000 . 5.500 4.260 3.903 4.600 . 0 0 "[ . 1 .]" 1
154 1 8 DG H2' 1 8 DG H5'' 5.000 . 5.500 4.331 3.553 4.854 . 0 0 "[ . 1 .]" 1
155 1 8 DG H2'' 1 8 DG H5'' 5.000 . 5.500 4.660 4.573 5.009 . 0 0 "[ . 1 .]" 1
156 1 8 DG H3' 1 8 DG H5'' 4.000 . 4.500 2.588 2.292 2.787 . 0 0 "[ . 1 .]" 1
157 1 7 DT H1' 1 8 DG H5'' 5.000 . 5.500 3.959 2.894 4.363 . 0 0 "[ . 1 .]" 1
158 1 8 DG H1' 1 8 DG H4' 4.000 . 4.500 3.358 3.104 3.629 . 0 0 "[ . 1 .]" 1
159 1 8 DG H4' 1 8 DG H8 5.000 . 5.500 4.452 4.226 4.626 . 0 0 "[ . 1 .]" 1
160 1 8 DG H2' 1 8 DG H4' 5.000 . 5.500 3.846 3.776 3.921 . 0 0 "[ . 1 .]" 1
161 1 8 DG H2'' 1 8 DG H4' 5.000 . 5.500 3.371 2.774 4.042 . 0 0 "[ . 1 .]" 1
162 1 8 DG H3' 1 8 DG H4' 4.000 . 4.500 2.861 2.689 3.002 . 0 0 "[ . 1 .]" 1
163 1 8 DG H1' 1 8 DG H8 4.000 . 4.500 3.733 3.629 3.869 . 0 0 "[ . 1 .]" 1
164 1 8 DG H1' 1 8 DG H2' 2.500 . 3.000 2.904 2.795 3.032 0.032 11 0 "[ . 1 .]" 1
165 1 8 DG H1' 1 8 DG H2'' 3.000 . 3.500 2.345 2.316 2.380 . 0 0 "[ . 1 .]" 1
166 1 8 DG H1' 1 8 DG H3' 4.000 . 4.500 3.907 3.859 3.998 . 0 0 "[ . 1 .]" 1
167 1 8 DG H1' 1 9 DG Q5' 5.000 . 5.500 4.021 2.784 4.892 . 0 0 "[ . 1 .]" 1
168 1 8 DG H2' 1 9 DG Q5' 5.000 . 5.500 3.699 3.021 4.717 . 0 0 "[ . 1 .]" 1
169 1 8 DG H2'' 1 9 DG Q5' 5.000 . 5.500 2.696 2.088 3.305 . 0 0 "[ . 1 .]" 1
170 1 8 DG H3' 1 9 DG Q5' 5.000 . 5.500 4.082 3.673 4.435 . 0 0 "[ . 1 .]" 1
171 1 8 DG H2' 1 8 DG H8 4.000 . 4.500 3.454 2.492 4.103 . 0 0 "[ . 1 .]" 1
172 1 8 DG H2'' 1 8 DG H8 4.000 . 4.500 4.504 3.985 4.818 0.318 9 0 "[ . 1 .]" 1
173 1 8 DG H3' 1 8 DG H8 5.000 . 5.500 3.821 3.355 4.497 . 0 0 "[ . 1 .]" 1
174 1 8 DG H2' 1 8 DG H2'' 3.000 . 3.500 1.754 1.747 1.761 0.053 1 0 "[ . 1 .]" 1
175 1 8 DG H2' 1 8 DG H3' 3.000 . 3.500 2.377 2.361 2.394 . 0 0 "[ . 1 .]" 1
176 1 8 DG H2' 1 9 DG H8 5.000 . 5.500 2.401 1.904 3.152 . 0 0 "[ . 1 .]" 1
177 1 8 DG H2'' 1 8 DG H3' 3.000 . 3.500 2.888 2.705 3.036 . 0 0 "[ . 1 .]" 1
178 1 8 DG H2'' 1 9 DG H8 5.000 . 5.500 2.927 1.922 3.746 . 0 0 "[ . 1 .]" 1
179 1 8 DG H3' 1 9 DG H8 5.000 . 5.500 3.855 3.211 4.670 . 0 0 "[ . 1 .]" 1
180 1 9 DG H5' 1 9 DG H5'' 2.500 . 3.000 1.777 1.774 1.780 0.026 7 0 "[ . 1 .]" 1
181 1 9 DG H4' 1 9 DG H5' 3.000 . 3.500 2.459 2.396 2.539 . 0 0 "[ . 1 .]" 1
182 1 9 DG H1' 1 9 DG H5' 5.000 . 5.500 4.592 4.498 4.922 . 0 0 "[ . 1 .]" 1
183 1 9 DG H5' 1 9 DG H8 5.000 . 5.500 4.228 3.886 5.201 . 0 0 "[ . 1 .]" 1
184 1 9 DG H2' 1 9 DG H5' 5.000 . 5.500 4.875 4.276 5.357 . 0 0 "[ . 1 .]" 1
185 1 9 DG H2'' 1 9 DG H5' 5.000 . 5.500 5.043 4.753 5.231 . 0 0 "[ . 1 .]" 1
186 1 9 DG H3' 1 9 DG H5' 4.000 . 4.500 3.608 2.931 3.760 . 0 0 "[ . 1 .]" 1
187 1 9 DG H4' 1 9 DG H5'' 3.000 . 3.500 2.468 2.324 3.015 . 0 0 "[ . 1 .]" 1
188 1 9 DG H1' 1 9 DG H5'' 5.000 . 5.500 4.982 4.594 5.095 . 0 0 "[ . 1 .]" 1
189 1 9 DG H5'' 1 9 DG H8 5.000 . 5.500 4.630 3.601 4.985 . 0 0 "[ . 1 .]" 1
190 1 9 DG H2' 1 9 DG H5'' 5.000 . 5.500 4.596 4.192 4.970 . 0 0 "[ . 1 .]" 1
191 1 9 DG H2'' 1 9 DG H5'' 5.000 . 5.500 4.819 4.663 5.012 . 0 0 "[ . 1 .]" 1
192 1 9 DG H3' 1 9 DG H5'' 4.000 . 4.500 2.782 2.475 2.963 . 0 0 "[ . 1 .]" 1
193 1 9 DG H1' 1 9 DG H4' 3.000 . 3.500 3.116 2.765 3.339 . 0 0 "[ . 1 .]" 1
194 1 9 DG H4' 1 9 DG H8 5.000 . 5.500 4.664 4.498 4.923 . 0 0 "[ . 1 .]" 1
195 1 9 DG H2' 1 9 DG H4' 5.000 . 5.500 3.852 3.785 3.943 . 0 0 "[ . 1 .]" 1
196 1 9 DG H2'' 1 9 DG H4' 5.000 . 5.500 3.303 2.817 3.944 . 0 0 "[ . 1 .]" 1
197 1 9 DG H3' 1 9 DG H4' 4.000 . 4.500 2.912 2.762 3.011 . 0 0 "[ . 1 .]" 1
198 1 9 DG H1' 1 9 DG H8 3.000 . 3.500 3.750 3.659 3.859 0.359 10 0 "[ . 1 .]" 1
199 1 9 DG H1' 1 9 DG H2' 3.000 . 3.500 2.937 2.845 3.041 . 0 0 "[ . 1 .]" 1
200 1 9 DG H1' 1 9 DG H2'' 2.500 . 3.000 2.348 2.328 2.385 . 0 0 "[ . 1 .]" 1
201 1 9 DG H1' 1 9 DG H3' 4.000 . 4.500 3.888 3.866 3.921 . 0 0 "[ . 1 .]" 1
202 1 9 DG H1' 1 10 DG H8 5.000 . 5.500 4.703 3.476 5.516 0.016 1 0 "[ . 1 .]" 1
203 1 9 DG H1' 1 10 DG Q5' 5.000 . 5.500 3.785 2.976 4.499 . 0 0 "[ . 1 .]" 1
204 1 9 DG H2' 1 10 DG H5' 5.000 . 5.500 3.853 3.014 4.927 . 0 0 "[ . 1 .]" 1
205 1 9 DG H2' 1 10 DG H5'' 5.000 . 5.500 5.090 4.446 5.916 0.416 10 0 "[ . 1 .]" 1
206 1 9 DG H2'' 1 10 DG H5' 5.000 . 5.500 2.611 2.089 3.369 . 0 0 "[ . 1 .]" 1
207 1 9 DG H2'' 1 10 DG H5'' 5.000 . 5.500 4.000 3.755 4.310 . 0 0 "[ . 1 .]" 1
208 1 9 DG H2' 1 9 DG H8 5.000 . 5.500 3.345 2.477 3.948 . 0 0 "[ . 1 .]" 1
209 1 9 DG H2'' 1 9 DG H8 5.000 . 5.500 4.449 3.884 4.840 . 0 0 "[ . 1 .]" 1
210 1 9 DG H3' 1 9 DG H8 5.000 . 5.500 3.828 3.389 4.323 . 0 0 "[ . 1 .]" 1
211 1 9 DG H2' 1 9 DG H2'' 3.000 . 3.500 1.754 1.744 1.761 0.056 10 0 "[ . 1 .]" 1
212 1 9 DG H2' 1 9 DG H3' 3.000 . 3.500 2.368 2.347 2.386 . 0 0 "[ . 1 .]" 1
213 1 9 DG H2' 1 10 DG H8 5.000 . 5.500 2.867 2.218 3.560 . 0 0 "[ . 1 .]" 1
214 1 9 DG H2'' 1 9 DG H3' 3.000 . 3.500 2.917 2.746 3.041 . 0 0 "[ . 1 .]" 1
215 1 9 DG H2'' 1 10 DG H8 5.000 . 5.500 3.310 2.233 4.121 . 0 0 "[ . 1 .]" 1
216 1 9 DG H3' 1 10 DG H8 5.000 . 5.500 4.166 3.448 5.151 . 0 0 "[ . 1 .]" 1
217 1 18 DG H5' 1 18 DG H5'' 2.500 . 3.000 1.778 1.773 1.780 0.027 15 0 "[ . 1 .]" 1
218 1 18 DG H4' 1 18 DG H5' 3.000 . 3.500 2.519 2.391 2.564 . 0 0 "[ . 1 .]" 1
219 1 18 DG H1' 1 18 DG H5' 5.000 . 5.500 4.533 4.445 4.886 . 0 0 "[ . 1 .]" 1
220 1 18 DG H5' 1 18 DG H8 5.000 . 5.500 4.260 4.072 5.129 . 0 0 "[ . 1 .]" 1
221 1 18 DG H2' 1 18 DG H5' 5.000 . 5.500 4.370 4.098 4.802 . 0 0 "[ . 1 .]" 1
222 1 18 DG H2'' 1 18 DG H5' 5.000 . 5.500 5.210 4.879 5.320 . 0 0 "[ . 1 .]" 1
223 1 18 DG H3' 1 18 DG H5' 4.000 . 4.500 3.594 2.787 3.670 . 0 0 "[ . 1 .]" 1
224 1 18 DG H4' 1 18 DG H5'' 3.000 . 3.500 2.363 2.290 3.011 . 0 0 "[ . 1 .]" 1
225 1 18 DG H1' 1 18 DG H5'' 5.000 . 5.500 4.885 4.614 4.996 . 0 0 "[ . 1 .]" 1
226 1 18 DG H5'' 1 18 DG H8 5.000 . 5.500 5.050 3.636 5.274 . 0 0 "[ . 1 .]" 1
227 1 18 DG H2' 1 18 DG H5'' 5.000 . 5.500 4.337 4.039 4.671 . 0 0 "[ . 1 .]" 1
228 1 18 DG H2'' 1 18 DG H5'' 5.000 . 5.500 5.010 4.789 5.069 . 0 0 "[ . 1 .]" 1
229 1 18 DG H3' 1 18 DG H5'' 4.000 . 4.500 2.724 2.440 2.802 . 0 0 "[ . 1 .]" 1
230 1 18 DG H1' 1 18 DG H4' 5.000 . 5.500 3.014 2.804 3.266 . 0 0 "[ . 1 .]" 1
231 1 18 DG H4' 1 18 DG H8 5.000 . 5.500 4.878 4.630 4.970 . 0 0 "[ . 1 .]" 1
232 1 18 DG H2' 1 18 DG H4' 5.000 . 5.500 3.897 3.867 3.927 . 0 0 "[ . 1 .]" 1
233 1 18 DG H2'' 1 18 DG H4' 5.000 . 5.500 3.841 3.317 3.988 . 0 0 "[ . 1 .]" 1
234 1 18 DG H3' 1 18 DG H4' 4.000 . 4.500 2.821 2.750 2.958 . 0 0 "[ . 1 .]" 1
235 1 18 DG H1' 1 18 DG H8 4.000 . 4.500 3.865 3.757 3.889 . 0 0 "[ . 1 .]" 1
236 1 18 DG H1' 1 18 DG H2' 3.000 . 3.500 3.043 2.968 3.068 . 0 0 "[ . 1 .]" 1
237 1 18 DG H1' 1 18 DG H2'' 3.000 . 3.500 2.403 2.336 2.429 . 0 0 "[ . 1 .]" 1
238 1 18 DG H1' 1 18 DG H3' 5.000 . 5.500 3.838 3.759 3.932 . 0 0 "[ . 1 .]" 1
239 1 18 DG H2' 1 18 DG H8 4.000 . 4.500 2.717 2.423 3.446 . 0 0 "[ . 1 .]" 1
240 1 18 DG H2'' 1 18 DG H8 4.000 . 4.500 4.073 3.866 4.635 0.135 5 0 "[ . 1 .]" 1
241 1 18 DG H2' 1 18 DG H2'' 3.000 . 3.500 1.761 1.757 1.762 0.043 5 0 "[ . 1 .]" 1
242 1 18 DG H2' 1 18 DG H3' 3.000 . 3.500 2.371 2.328 2.397 . 0 0 "[ . 1 .]" 1
243 1 18 DG H1' 1 19 DG H8 5.000 . 5.500 3.392 3.094 3.917 . 0 0 "[ . 1 .]" 1
244 1 18 DG H1' 1 19 DG H1' 5.000 . 5.500 5.553 5.335 5.814 0.314 5 0 "[ . 1 .]" 1
245 1 18 DG H1' 1 19 DG Q2' 5.000 . 5.500 5.054 4.857 5.628 0.128 5 0 "[ . 1 .]" 1
246 1 18 DG H1' 1 19 DG H5' 5.000 . 5.500 3.029 2.828 3.453 . 0 0 "[ . 1 .]" 1
247 1 18 DG H1' 1 19 DG H5'' 5.000 . 5.500 4.749 4.527 5.218 . 0 0 "[ . 1 .]" 1
248 1 18 DG H2' 1 19 DG H8 5.000 . 5.500 3.358 1.960 3.890 . 0 0 "[ . 1 .]" 1
249 1 18 DG H2' 1 19 DG Q5' 5.000 . 5.500 4.636 3.839 4.847 . 0 0 "[ . 1 .]" 1
250 1 18 DG H2'' 1 18 DG H3' 3.000 . 3.500 2.772 2.715 2.935 . 0 0 "[ . 1 .]" 1
251 1 18 DG H2'' 1 19 DG H8 5.000 . 5.500 2.134 1.937 2.498 . 0 0 "[ . 1 .]" 1
252 1 18 DG H2'' 1 19 DG Q5' 5.000 . 5.500 3.248 2.230 3.541 . 0 0 "[ . 1 .]" 1
253 1 18 DG H3' 1 19 DG Q5' 5.000 . 5.500 4.272 4.061 4.311 . 0 0 "[ . 1 .]" 1
254 1 17 DG H5' 1 17 DG H5'' 2.500 . 3.000 1.777 1.770 1.780 0.030 11 0 "[ . 1 .]" 1
255 1 17 DG H4' 1 17 DG H5' 3.000 . 3.500 2.510 2.322 2.574 . 0 0 "[ . 1 .]" 1
256 1 17 DG H1' 1 17 DG H5' 5.000 . 5.500 4.562 4.487 4.709 . 0 0 "[ . 1 .]" 1
257 1 17 DG H5' 1 17 DG H8 5.000 . 5.500 3.176 2.838 4.218 . 0 0 "[ . 1 .]" 1
258 1 17 DG H2' 1 17 DG H5' 5.000 . 5.500 4.412 4.170 5.385 . 0 0 "[ . 1 .]" 1
259 1 17 DG H2'' 1 17 DG H5' 5.000 . 5.500 5.115 4.928 5.226 . 0 0 "[ . 1 .]" 1
260 1 17 DG H3' 1 17 DG H5' 4.000 . 4.500 3.684 3.665 3.753 . 0 0 "[ . 1 .]" 1
261 1 17 DG H4' 1 17 DG H5'' 3.000 . 3.500 2.344 2.291 2.507 . 0 0 "[ . 1 .]" 1
262 1 17 DG H1' 1 17 DG H5'' 5.000 . 5.500 5.118 5.083 5.141 . 0 0 "[ . 1 .]" 1
263 1 17 DG H5'' 1 17 DG H8 5.000 . 5.500 4.022 3.861 4.503 . 0 0 "[ . 1 .]" 1
264 1 17 DG H2' 1 17 DG H5'' 5.000 . 5.500 4.275 3.979 4.823 . 0 0 "[ . 1 .]" 1
265 1 17 DG H2'' 1 17 DG H5'' 5.000 . 5.500 4.931 4.606 5.039 . 0 0 "[ . 1 .]" 1
266 1 17 DG H3' 1 17 DG H5'' 4.000 . 4.500 2.697 2.573 2.762 . 0 0 "[ . 1 .]" 1
267 1 17 DG H1' 1 17 DG H4' 5.000 . 5.500 3.531 3.143 3.631 . 0 0 "[ . 1 .]" 1
268 1 17 DG H4' 1 17 DG H8 5.000 . 5.500 4.358 4.271 4.419 . 0 0 "[ . 1 .]" 1
269 1 17 DG H2' 1 17 DG H4' 5.000 . 5.500 3.946 3.797 4.004 . 0 0 "[ . 1 .]" 1
270 1 17 DG H2'' 1 17 DG H4' 5.000 . 5.500 3.803 2.819 4.015 . 0 0 "[ . 1 .]" 1
271 1 17 DG H3' 1 17 DG H4' 4.000 . 4.500 2.762 2.706 2.998 . 0 0 "[ . 1 .]" 1
272 1 17 DG H1' 1 18 DG H8 5.000 . 5.500 3.802 3.320 5.397 . 0 0 "[ . 1 .]" 1
273 1 17 DG H1' 1 18 DG Q5' 5.000 . 5.500 3.037 2.572 4.850 . 0 0 "[ . 1 .]" 1
274 1 17 DG H1' 1 17 DG H8 3.000 . 3.500 3.787 3.628 3.833 0.333 10 0 "[ . 1 .]" 1
275 1 17 DG H1' 1 17 DG H2' 3.000 . 3.500 2.937 2.811 2.997 . 0 0 "[ . 1 .]" 1
276 1 17 DG H1' 1 17 DG H2'' 3.000 . 3.500 2.331 2.308 2.366 . 0 0 "[ . 1 .]" 1
277 1 17 DG H1' 1 17 DG H3' 5.000 . 5.500 3.999 3.874 4.046 . 0 0 "[ . 1 .]" 1
278 1 17 DG H2' 1 17 DG H8 4.000 . 4.500 2.966 2.586 4.014 . 0 0 "[ . 1 .]" 1
279 1 17 DG H2'' 1 17 DG H8 4.000 . 4.500 4.291 4.067 4.762 0.262 11 0 "[ . 1 .]" 1
280 1 17 DG H3' 1 17 DG H8 5.000 . 5.500 3.934 3.362 4.411 . 0 0 "[ . 1 .]" 1
281 1 17 DG H2' 1 18 DG H1' 5.000 . 5.500 5.469 4.591 5.671 0.171 7 0 "[ . 1 .]" 1
282 1 17 DG H2' 1 18 DG H8 5.000 . 5.500 2.245 2.070 2.632 . 0 0 "[ . 1 .]" 1
283 1 17 DG H2' 1 17 DG H2'' 3.000 . 3.500 1.744 1.737 1.758 0.063 10 0 "[ . 1 .]" 1
284 1 17 DG H2' 1 17 DG H3' 3.000 . 3.500 2.369 2.361 2.385 . 0 0 "[ . 1 .]" 1
285 1 17 DG H2' 1 18 DG H4' 5.000 . 5.500 5.617 4.390 5.891 0.391 8 0 "[ . 1 .]" 1
286 1 17 DG H2' 1 18 DG Q5' 5.000 . 5.500 3.858 2.760 4.160 . 0 0 "[ . 1 .]" 1
287 1 17 DG H2'' 1 18 DG H1' 5.000 . 5.500 4.584 4.299 5.452 . 0 0 "[ . 1 .]" 1
288 1 17 DG H2'' 1 18 DG H8 5.000 . 5.500 2.361 1.951 4.187 . 0 0 "[ . 1 .]" 1
289 1 17 DG H2'' 1 17 DG H3' 3.000 . 3.500 2.810 2.740 3.032 . 0 0 "[ . 1 .]" 1
290 1 17 DG H2'' 1 18 DG H4' 5.000 . 5.500 4.139 3.809 4.213 . 0 0 "[ . 1 .]" 1
291 1 17 DG H2'' 1 18 DG Q5' 5.000 . 5.500 2.479 2.078 2.841 . 0 0 "[ . 1 .]" 1
292 1 14 DG H5' 1 14 DG H5'' 2.500 . 3.000 1.778 1.776 1.779 0.024 4 0 "[ . 1 .]" 1
293 1 14 DG H4' 1 14 DG H5' 3.000 . 3.500 2.496 2.381 2.543 . 0 0 "[ . 1 .]" 1
294 1 14 DG H1' 1 14 DG H5' 5.000 . 5.500 4.554 4.500 4.703 . 0 0 "[ . 1 .]" 1
295 1 14 DG H5' 1 14 DG H8 5.000 . 5.500 4.469 4.150 5.425 . 0 0 "[ . 1 .]" 1
296 1 14 DG H2' 1 14 DG H5' 5.000 . 5.500 4.255 4.083 4.834 . 0 0 "[ . 1 .]" 1
297 1 14 DG H2'' 1 14 DG H5' 5.000 . 5.500 5.129 4.932 5.199 . 0 0 "[ . 1 .]" 1
298 1 14 DG H3' 1 14 DG H5' 5.000 . 5.500 3.522 2.859 3.699 . 0 0 "[ . 1 .]" 1
299 1 14 DG H4' 1 14 DG H5'' 3.000 . 3.500 2.454 2.297 3.013 . 0 0 "[ . 1 .]" 1
300 1 14 DG H1' 1 14 DG H5'' 5.000 . 5.500 4.825 4.523 4.922 . 0 0 "[ . 1 .]" 1
301 1 14 DG H5'' 1 14 DG H8 5.000 . 5.500 4.927 3.962 5.246 . 0 0 "[ . 1 .]" 1
302 1 14 DG H2' 1 14 DG H5'' 5.000 . 5.500 4.135 4.040 4.185 . 0 0 "[ . 1 .]" 1
303 1 14 DG H2'' 1 14 DG H5'' 5.000 . 5.500 4.957 4.822 5.019 . 0 0 "[ . 1 .]" 1
304 1 14 DG H3' 1 14 DG H5'' 5.000 . 5.500 2.677 2.498 2.750 . 0 0 "[ . 1 .]" 1
305 1 14 DG H1' 1 14 DG H4' 5.000 . 5.500 2.980 2.528 3.150 . 0 0 "[ . 1 .]" 1
306 1 14 DG H4' 1 14 DG H8 5.000 . 5.500 4.907 4.649 5.051 . 0 0 "[ . 1 .]" 1
307 1 14 DG H2' 1 14 DG H4' 5.000 . 5.500 3.857 3.842 3.867 . 0 0 "[ . 1 .]" 1
308 1 14 DG H2'' 1 14 DG H4' 5.000 . 5.500 3.872 3.336 4.016 . 0 0 "[ . 1 .]" 1
309 1 14 DG H3' 1 14 DG H4' 4.000 . 4.500 2.797 2.744 2.973 . 0 0 "[ . 1 .]" 1
310 1 14 DG H4' 1 15 DG H8 6.000 . 6.500 6.262 5.807 6.520 0.020 14 0 "[ . 1 .]" 1
311 1 14 DG H1' 1 14 DG H8 3.000 . 3.500 3.823 3.696 3.865 0.365 7 0 "[ . 1 .]" 1
312 1 14 DG H1' 1 14 DG H2' 3.000 . 3.500 3.053 3.012 3.065 . 0 0 "[ . 1 .]" 1
313 1 14 DG H1' 1 14 DG H2'' 3.000 . 3.500 2.413 2.373 2.425 . 0 0 "[ . 1 .]" 1
314 1 14 DG H1' 1 14 DG H3' 4.000 . 4.500 3.769 3.722 3.870 . 0 0 "[ . 1 .]" 1
315 1 14 DG H1' 1 15 DG H8 5.000 . 5.500 3.869 3.565 4.567 . 0 0 "[ . 1 .]" 1
316 1 13 DG H2'' 1 14 DG H8 5.000 . 5.500 2.240 1.942 2.879 . 0 0 "[ . 1 .]" 1
317 1 14 DG H2' 1 14 DG H8 4.000 . 4.500 2.676 2.412 3.480 . 0 0 "[ . 1 .]" 1
318 1 14 DG H2'' 1 14 DG H8 4.000 . 4.500 3.959 3.716 4.630 0.130 1 0 "[ . 1 .]" 1
319 1 14 DG H3' 1 14 DG H8 5.000 . 5.500 4.518 4.314 4.588 . 0 0 "[ . 1 .]" 1
320 1 14 DG H2' 1 14 DG H2'' 3.000 . 3.500 1.759 1.753 1.762 0.047 1 0 "[ . 1 .]" 1
321 1 14 DG H2' 1 14 DG H3' 3.000 . 3.500 2.389 2.330 2.408 . 0 0 "[ . 1 .]" 1
322 1 14 DG H2' 1 15 DG H8 5.000 . 5.500 3.565 2.244 4.058 . 0 0 "[ . 1 .]" 1
323 1 14 DG H2'' 1 14 DG H3' 3.000 . 3.500 2.749 2.699 2.922 . 0 0 "[ . 1 .]" 1
324 1 14 DG H2'' 1 15 DG H8 5.000 . 5.500 2.705 2.629 2.838 . 0 0 "[ . 1 .]" 1
325 1 14 DG H3' 1 15 DG H8 5.000 . 5.500 5.176 4.207 5.534 0.034 7 0 "[ . 1 .]" 1
326 1 5 DG H4' 1 5 DG H5' 3.000 . 3.500 2.561 2.546 2.575 . 0 0 "[ . 1 .]" 1
327 1 5 DG H1' 1 5 DG H5' 5.000 . 5.500 4.504 4.494 4.527 . 0 0 "[ . 1 .]" 1
328 1 5 DG H5' 1 5 DG H8 5.000 . 5.500 4.181 3.981 4.283 . 0 0 "[ . 1 .]" 1
329 1 5 DG H2' 1 5 DG H5' 5.000 . 5.500 4.126 4.108 4.168 . 0 0 "[ . 1 .]" 1
330 1 5 DG H2'' 1 5 DG H5' 5.000 . 5.500 5.167 5.158 5.180 . 0 0 "[ . 1 .]" 1
331 1 5 DG H3' 1 5 DG H5' 5.000 . 5.500 3.663 3.656 3.671 . 0 0 "[ . 1 .]" 1
332 1 4 DG H1' 1 5 DG H4' 5.000 . 5.500 4.554 4.409 4.756 . 0 0 "[ . 1 .]" 1
333 1 5 DG H1' 1 5 DG H4' 4.000 . 4.500 3.102 3.032 3.193 . 0 0 "[ . 1 .]" 1
334 1 5 DG H4' 1 5 DG H8 5.000 . 5.500 4.964 4.873 5.018 . 0 0 "[ . 1 .]" 1
335 1 5 DG H2' 1 5 DG H4' 5.000 . 5.500 3.882 3.869 3.904 . 0 0 "[ . 1 .]" 1
336 1 5 DG H2'' 1 5 DG H4' 5.000 . 5.500 3.980 3.959 3.994 . 0 0 "[ . 1 .]" 1
337 1 5 DG H3' 1 5 DG H4' 4.000 . 4.500 2.767 2.749 2.783 . 0 0 "[ . 1 .]" 1
338 1 5 DG H1' 1 5 DG H8 3.000 . 3.500 3.850 3.844 3.857 0.357 9 0 "[ . 1 .]" 1
339 1 5 DG H1' 1 5 DG H2' 3.000 . 3.500 3.058 3.047 3.064 . 0 0 "[ . 1 .]" 1
340 1 5 DG H1' 1 5 DG H2'' 3.000 . 3.500 2.418 2.404 2.428 . 0 0 "[ . 1 .]" 1
341 1 5 DG H1' 1 5 DG H3' 5.000 . 5.500 3.786 3.745 3.848 . 0 0 "[ . 1 .]" 1
342 1 5 DG H1' 1 6 DG H5' 5.000 . 5.500 2.939 2.778 3.099 . 0 0 "[ . 1 .]" 1
343 1 5 DG H1' 1 6 DG H8 5.000 . 5.500 3.508 3.092 3.723 . 0 0 "[ . 1 .]" 1
344 1 5 DG H2' 1 5 DG H8 5.000 . 5.500 2.449 2.359 2.613 . 0 0 "[ . 1 .]" 1
345 1 5 DG H2'' 1 5 DG H8 5.000 . 5.500 3.799 3.720 3.962 . 0 0 "[ . 1 .]" 1
346 1 5 DG H3' 1 5 DG H8 5.000 . 5.500 4.480 4.322 4.581 . 0 0 "[ . 1 .]" 1
347 1 5 DG H2' 1 5 DG H2'' 2.500 . 3.000 1.761 1.759 1.762 0.041 13 0 "[ . 1 .]" 1
348 1 5 DG H2' 1 5 DG H3' 3.000 . 3.500 2.393 2.378 2.402 . 0 0 "[ . 1 .]" 1
349 1 5 DG H2' 1 6 DG H8 5.000 . 5.500 3.679 3.396 3.829 . 0 0 "[ . 1 .]" 1
350 1 4 DG H1' 1 5 DG H2'' 6.000 . 6.500 6.065 5.989 6.156 . 0 0 "[ . 1 .]" 1
351 1 5 DG H2'' 1 5 DG H3' 3.000 . 3.500 2.721 2.712 2.734 . 0 0 "[ . 1 .]" 1
352 1 5 DG H2'' 1 6 DG H8 5.000 . 5.500 2.306 2.040 2.447 . 0 0 "[ . 1 .]" 1
353 1 5 DG H3' 1 6 DG H8 5.000 . 5.500 4.980 4.746 5.114 . 0 0 "[ . 1 .]" 1
354 1 5 DG H3' 1 6 DG Q5' 5.000 . 5.500 4.371 4.236 4.522 . 0 0 "[ . 1 .]" 1
355 1 5 DG H2' 1 6 DG Q5' 5.000 . 5.500 4.846 4.789 4.906 . 0 0 "[ . 1 .]" 1
356 1 5 DG H2'' 1 6 DG Q5' 5.000 . 5.500 3.519 3.459 3.593 . 0 0 "[ . 1 .]" 1
357 1 10 DG H4' 1 10 DG H5' 3.000 . 3.500 2.493 2.458 2.529 . 0 0 "[ . 1 .]" 1
358 1 10 DG H1' 1 10 DG H5' 5.000 . 5.500 4.563 4.507 4.641 . 0 0 "[ . 1 .]" 1
359 1 10 DG H5' 1 10 DG H8 5.000 . 5.500 4.242 4.060 4.424 . 0 0 "[ . 1 .]" 1
360 1 10 DG H2' 1 10 DG H5' 5.000 . 5.500 4.225 4.143 4.427 . 0 0 "[ . 1 .]" 1
361 1 10 DG H2'' 1 10 DG H5' 5.000 . 5.500 5.205 5.167 5.265 . 0 0 "[ . 1 .]" 1
362 1 10 DG H3' 1 10 DG H5' 5.000 . 5.500 3.673 3.651 3.697 . 0 0 "[ . 1 .]" 1
363 1 10 DG H4' 1 12 DA H1' 5.000 . 5.500 4.288 3.129 5.484 . 0 0 "[ . 1 .]" 1
364 1 10 DG H4' 1 11 DT H4' 5.000 . 5.500 4.088 2.632 4.374 . 0 0 "[ . 1 .]" 1
365 1 10 DG H1' 1 10 DG H4' 4.000 . 4.500 3.222 3.078 3.333 . 0 0 "[ . 1 .]" 1
366 1 10 DG H4' 1 10 DG H8 5.000 . 5.500 4.956 4.841 5.090 . 0 0 "[ . 1 .]" 1
367 1 10 DG H2' 1 10 DG H4' 5.000 . 5.500 3.893 3.852 3.926 . 0 0 "[ . 1 .]" 1
368 1 10 DG H2'' 1 10 DG H4' 4.000 . 4.500 3.968 3.863 3.999 . 0 0 "[ . 1 .]" 1
369 1 10 DG H3' 1 10 DG H4' 4.000 . 4.500 2.756 2.728 2.825 . 0 0 "[ . 1 .]" 1
370 1 10 DG H4' 1 12 DA H2 6.000 . 6.500 6.306 5.172 6.663 0.163 14 0 "[ . 1 .]" 1
371 1 10 DG H4' 1 12 DA H8 6.000 . 6.500 6.198 5.055 6.603 0.103 1 0 "[ . 1 .]" 1
372 1 10 DG H4' 1 11 DT H5' 5.000 . 5.500 3.042 2.272 3.575 . 0 0 "[ . 1 .]" 1
373 1 10 DG H1' 1 11 DT H4' 6.000 . 6.500 5.841 5.286 6.537 0.037 15 0 "[ . 1 .]" 1
374 1 10 DG H1' 1 10 DG H8 4.000 . 4.500 3.886 3.882 3.890 . 0 0 "[ . 1 .]" 1
375 1 10 DG H1' 1 10 DG H2' 3.000 . 3.500 3.051 3.024 3.068 . 0 0 "[ . 1 .]" 1
376 1 10 DG H1' 1 10 DG H2'' 2.500 . 3.000 2.405 2.382 2.427 . 0 0 "[ . 1 .]" 1
377 1 10 DG H1' 1 10 DG H3' 4.000 . 4.500 3.856 3.789 3.927 . 0 0 "[ . 1 .]" 1
378 1 10 DG H1' 1 12 DA H2 5.000 . 5.500 4.676 3.344 5.505 0.005 11 0 "[ . 1 .]" 1
379 1 10 DG H1' 1 11 DT H5' 5.000 . 5.500 4.133 3.488 5.418 . 0 0 "[ . 1 .]" 1
380 1 10 DG H2' 1 10 DG H8 4.000 . 4.500 2.360 2.247 2.481 . 0 0 "[ . 1 .]" 1
381 1 10 DG H2'' 1 10 DG H8 4.000 . 4.500 3.781 3.630 3.920 . 0 0 "[ . 1 .]" 1
382 1 10 DG H3' 1 10 DG H8 5.000 . 5.500 4.333 4.157 4.494 . 0 0 "[ . 1 .]" 1
383 1 10 DG H2' 1 10 DG H2'' 2.500 . 3.000 1.760 1.759 1.762 0.041 13 0 "[ . 1 .]" 1
384 1 10 DG H2' 1 10 DG H3' 3.000 . 3.500 2.379 2.355 2.394 . 0 0 "[ . 1 .]" 1
385 1 10 DG H2'' 1 10 DG H3' 3.000 . 3.500 2.727 2.706 2.771 . 0 0 "[ . 1 .]" 1
386 1 10 DG H3' 1 11 DT H5' 5.000 . 5.500 4.626 4.088 5.024 . 0 0 "[ . 1 .]" 1
387 1 10 DG H3' 1 11 DT H6 6.000 . 6.500 5.873 4.984 6.747 0.247 9 0 "[ . 1 .]" 1
388 1 19 DG H5' 1 19 DG H5'' 2.500 . 3.000 1.777 1.776 1.778 0.024 10 0 "[ . 1 .]" 1
389 1 19 DG H4' 1 19 DG H5' 3.000 . 3.500 2.560 2.545 2.566 . 0 0 "[ . 1 .]" 1
390 1 19 DG H1' 1 19 DG H5' 5.000 . 5.500 4.530 4.510 4.548 . 0 0 "[ . 1 .]" 1
391 1 19 DG H5' 1 19 DG H8 5.000 . 5.500 3.897 3.782 4.092 . 0 0 "[ . 1 .]" 1
392 1 19 DG H2' 1 19 DG H5' 5.000 . 5.500 4.090 4.077 4.101 . 0 0 "[ . 1 .]" 1
393 1 19 DG H2'' 1 19 DG H5' 5.000 . 5.500 5.142 5.134 5.149 . 0 0 "[ . 1 .]" 1
394 1 19 DG H3' 1 19 DG H5' 5.000 . 5.500 3.661 3.652 3.665 . 0 0 "[ . 1 .]" 1
395 1 19 DG H4' 1 19 DG H5'' 3.000 . 3.500 2.298 2.291 2.318 . 0 0 "[ . 1 .]" 1
396 1 19 DG H1' 1 19 DG H5'' 5.000 . 5.500 4.976 4.934 5.016 . 0 0 "[ . 1 .]" 1
397 1 19 DG H5'' 1 19 DG H8 5.000 . 5.500 4.915 4.778 5.106 . 0 0 "[ . 1 .]" 1
398 1 19 DG H2' 1 19 DG H5'' 5.000 . 5.500 4.163 4.103 4.195 . 0 0 "[ . 1 .]" 1
399 1 19 DG H2'' 1 19 DG H5'' 5.000 . 5.500 5.003 4.963 5.023 . 0 0 "[ . 1 .]" 1
400 1 19 DG H3' 1 19 DG H5'' 3.000 . 3.500 2.733 2.679 2.760 . 0 0 "[ . 1 .]" 1
401 1 19 DG H1' 1 19 DG H4' 4.000 . 4.500 3.229 3.146 3.298 . 0 0 "[ . 1 .]" 1
402 1 19 DG H4' 1 19 DG H8 5.000 . 5.500 4.880 4.822 4.976 . 0 0 "[ . 1 .]" 1
403 1 19 DG H2' 1 19 DG H4' 4.000 . 4.500 3.888 3.878 3.897 . 0 0 "[ . 1 .]" 1
404 1 19 DG H2'' 1 19 DG H4' 4.000 . 4.500 3.998 3.994 4.006 . 0 0 "[ . 1 .]" 1
405 1 19 DG H3' 1 19 DG H4' 4.000 . 4.500 2.748 2.738 2.759 . 0 0 "[ . 1 .]" 1
406 1 19 DG H1' 1 19 DG H8 4.000 . 4.500 3.889 3.875 3.900 . 0 0 "[ . 1 .]" 1
407 1 19 DG H1' 1 19 DG H2' 3.000 . 3.500 3.052 3.038 3.063 . 0 0 "[ . 1 .]" 1
408 1 19 DG H1' 1 19 DG H2'' 3.000 . 3.500 2.407 2.397 2.418 . 0 0 "[ . 1 .]" 1
409 1 19 DG H1' 1 19 DG H3' 4.000 . 4.500 3.834 3.797 3.868 . 0 0 "[ . 1 .]" 1
410 1 19 DG H1' 1 20 DT H5' 5.000 . 5.500 2.579 2.489 2.660 . 0 0 "[ . 1 .]" 1
411 1 19 DG H1' 1 20 DT H5'' 5.000 . 5.500 4.284 4.197 4.382 . 0 0 "[ . 1 .]" 1
412 1 19 DG H1' 1 20 DT H4' 5.000 . 5.500 4.075 3.992 4.217 . 0 0 "[ . 1 .]" 1
413 1 19 DG H1' 1 20 DT M7 5.000 . 5.500 4.749 4.636 4.823 . 0 0 "[ . 1 .]" 1
414 1 19 DG H1' 1 20 DT H6 5.000 . 5.500 4.035 3.903 4.121 . 0 0 "[ . 1 .]" 1
415 1 19 DG H2' 1 19 DG H8 4.000 . 4.500 2.565 2.496 2.655 . 0 0 "[ . 1 .]" 1
416 1 19 DG H2'' 1 19 DG H8 4.000 . 4.500 3.958 3.868 4.044 . 0 0 "[ . 1 .]" 1
417 1 19 DG H3' 1 19 DG H8 4.000 . 4.500 4.472 4.380 4.534 0.034 13 0 "[ . 1 .]" 1
418 1 19 DG H8 1 20 DT M7 4.000 . 4.500 4.519 4.494 4.544 0.044 13 0 "[ . 1 .]" 1
419 1 19 DG H2' 1 19 DG H2'' 2.500 . 3.000 1.761 1.759 1.764 0.041 1 0 "[ . 1 .]" 1
420 1 19 DG H2' 1 19 DG H3' 3.000 . 3.500 2.387 2.383 2.394 . 0 0 "[ . 1 .]" 1
421 1 19 DG H2' 1 20 DT M7 5.000 . 5.500 3.187 3.017 3.412 . 0 0 "[ . 1 .]" 1
422 1 19 DG H2' 1 20 DT H6 5.000 . 5.500 4.143 4.037 4.324 . 0 0 "[ . 1 .]" 1
423 1 19 DG H2'' 1 19 DG H3' 3.000 . 3.500 2.721 2.718 2.725 . 0 0 "[ . 1 .]" 1
424 1 19 DG H2'' 1 20 DT M7 5.000 . 5.500 2.995 2.863 3.105 . 0 0 "[ . 1 .]" 1
425 1 19 DG H2'' 1 20 DT H6 5.000 . 5.500 2.691 2.569 2.835 . 0 0 "[ . 1 .]" 1
426 1 19 DG H2'' 1 20 DT H4' 5.000 . 5.500 4.881 4.816 4.967 . 0 0 "[ . 1 .]" 1
427 1 19 DG H2'' 1 20 DT H5' 5.000 . 5.500 3.322 3.273 3.372 . 0 0 "[ . 1 .]" 1
428 1 19 DG H2'' 1 20 DT H5'' 5.000 . 5.500 4.423 4.381 4.464 . 0 0 "[ . 1 .]" 1
429 1 19 DG H3' 1 20 DT M7 6.000 . 6.500 4.558 4.378 4.783 . 0 0 "[ . 1 .]" 1
430 1 19 DG H3' 1 20 DT H5' 5.000 . 5.500 4.406 4.377 4.441 . 0 0 "[ . 1 .]" 1
431 1 19 DG H3' 1 20 DT H5'' 5.000 . 5.500 5.433 5.415 5.447 . 0 0 "[ . 1 .]" 1
432 1 19 DG H4' 1 20 DT H5' 5.000 . 5.500 3.814 3.760 3.921 . 0 0 "[ . 1 .]" 1
433 1 19 DG H4' 1 20 DT H5'' 5.000 . 5.500 5.219 5.152 5.291 . 0 0 "[ . 1 .]" 1
434 1 14 DG H1' 1 15 DG H5' 5.000 . 5.500 2.652 2.269 3.352 . 0 0 "[ . 1 .]" 1
435 1 15 DG H5' 1 15 DG H5'' 2.500 . 3.000 1.776 1.774 1.777 0.026 3 0 "[ . 1 .]" 1
436 1 15 DG H4' 1 15 DG H5' 4.000 . 4.500 2.551 2.508 2.572 . 0 0 "[ . 1 .]" 1
437 1 15 DG H1' 1 15 DG H5' 5.000 . 5.500 4.503 4.472 4.549 . 0 0 "[ . 1 .]" 1
438 1 15 DG H5' 1 15 DG H8 5.000 . 5.500 4.348 4.218 4.633 . 0 0 "[ . 1 .]" 1
439 1 15 DG H2' 1 15 DG H5' 5.000 . 5.500 4.057 4.027 4.117 . 0 0 "[ . 1 .]" 1
440 1 15 DG H2'' 1 15 DG H5' 5.000 . 5.500 5.150 5.130 5.194 . 0 0 "[ . 1 .]" 1
441 1 15 DG H3' 1 15 DG H5' 4.000 . 4.500 3.680 3.660 3.693 . 0 0 "[ . 1 .]" 1
442 1 14 DG H1' 1 15 DG H5'' 5.000 . 5.500 4.360 3.999 5.099 . 0 0 "[ . 1 .]" 1
443 1 15 DG H4' 1 15 DG H5'' 3.000 . 3.500 2.306 2.292 2.338 . 0 0 "[ . 1 .]" 1
444 1 15 DG H1' 1 15 DG H5'' 5.000 . 5.500 4.869 4.840 4.904 . 0 0 "[ . 1 .]" 1
445 1 15 DG H5'' 1 15 DG H8 5.000 . 5.500 5.286 5.178 5.457 . 0 0 "[ . 1 .]" 1
446 1 15 DG H2' 1 15 DG H5'' 5.000 . 5.500 4.122 4.039 4.156 . 0 0 "[ . 1 .]" 1
447 1 15 DG H2'' 1 15 DG H5'' 5.000 . 5.500 4.980 4.916 5.007 . 0 0 "[ . 1 .]" 1
448 1 15 DG H3' 1 15 DG H5'' 3.000 . 3.500 2.724 2.637 2.755 . 0 0 "[ . 1 .]" 1
449 1 14 DG H1' 1 15 DG H4' 5.000 . 5.500 4.769 4.414 5.300 . 0 0 "[ . 1 .]" 1
450 1 15 DG H1' 1 15 DG H4' 3.000 . 3.500 3.033 2.981 3.089 . 0 0 "[ . 1 .]" 1
451 1 15 DG H4' 1 15 DG H8 5.000 . 5.500 5.042 4.976 5.201 . 0 0 "[ . 1 .]" 1
452 1 15 DG H2' 1 15 DG H4' 5.000 . 5.500 3.826 3.811 3.856 . 0 0 "[ . 1 .]" 1
453 1 15 DG H2'' 1 15 DG H4' 5.000 . 5.500 3.978 3.962 4.007 . 0 0 "[ . 1 .]" 1
454 1 15 DG H3' 1 15 DG H4' 4.000 . 4.500 2.727 2.702 2.769 . 0 0 "[ . 1 .]" 1
455 1 15 DG H1' 1 15 DG H8 4.000 . 4.500 3.890 3.887 3.894 . 0 0 "[ . 1 .]" 1
456 1 15 DG H1' 1 15 DG H2' 3.000 . 3.500 3.085 3.079 3.091 . 0 0 "[ . 1 .]" 1
457 1 15 DG H1' 1 15 DG H2'' 3.000 . 3.500 2.445 2.440 2.460 . 0 0 "[ . 1 .]" 1
458 1 15 DG H1' 1 15 DG H3' 4.000 . 4.500 3.731 3.708 3.772 . 0 0 "[ . 1 .]" 1
459 1 15 DG H1' 1 16 DT H5' 5.000 . 5.500 5.147 4.752 5.377 . 0 0 "[ . 1 .]" 1
460 1 15 DG H1' 1 16 DT H5'' 5.000 . 5.500 3.634 3.240 3.831 . 0 0 "[ . 1 .]" 1
461 1 15 DG H2' 1 15 DG H8 4.000 . 4.500 2.469 2.332 2.571 . 0 0 "[ . 1 .]" 1
462 1 15 DG H2'' 1 15 DG H8 4.000 . 4.500 3.738 3.542 3.832 . 0 0 "[ . 1 .]" 1
463 1 15 DG H3' 1 15 DG H8 5.000 . 5.500 4.633 4.529 4.715 . 0 0 "[ . 1 .]" 1
464 1 15 DG H2' 1 15 DG H2'' 2.500 . 3.000 1.761 1.759 1.762 0.041 6 0 "[ . 1 .]" 1
465 1 15 DG H2' 1 15 DG H3' 3.000 . 3.500 2.420 2.399 2.432 . 0 0 "[ . 1 .]" 1
466 1 15 DG H2'' 1 15 DG H3' 3.000 . 3.500 2.706 2.700 2.712 . 0 0 "[ . 1 .]" 1
467 1 15 DG H3' 1 16 DT H5' 5.000 . 5.500 5.187 5.161 5.208 . 0 0 "[ . 1 .]" 1
468 1 15 DG H3' 1 16 DT H5'' 5.000 . 5.500 4.339 4.233 4.394 . 0 0 "[ . 1 .]" 1
469 1 6 DG H5' 1 6 DG H5'' 2.500 . 3.000 1.777 1.775 1.779 0.025 10 0 "[ . 1 .]" 1
470 1 6 DG H4' 1 6 DG H5' 4.000 . 4.500 2.560 2.534 2.575 . 0 0 "[ . 1 .]" 1
471 1 6 DG H1' 1 6 DG H5' 5.000 . 5.500 4.514 4.502 4.527 . 0 0 "[ . 1 .]" 1
472 1 6 DG H5' 1 6 DG H8 5.000 . 5.500 4.152 3.956 4.351 . 0 0 "[ . 1 .]" 1
473 1 6 DG H3' 1 6 DG H5' 4.000 . 4.500 3.664 3.656 3.689 . 0 0 "[ . 1 .]" 1
474 1 6 DG H4' 1 6 DG H5'' 4.000 . 4.500 2.302 2.284 2.325 . 0 0 "[ . 1 .]" 1
475 1 6 DG H1' 1 6 DG H5'' 5.000 . 5.500 4.943 4.917 4.996 . 0 0 "[ . 1 .]" 1
476 1 6 DG H5'' 1 6 DG H8 5.000 . 5.500 5.078 4.908 5.199 . 0 0 "[ . 1 .]" 1
477 1 6 DG H2' 1 6 DG H5'' 5.000 . 5.500 4.152 4.094 4.231 . 0 0 "[ . 1 .]" 1
478 1 6 DG H2'' 1 6 DG H5'' 5.000 . 5.500 4.993 4.948 5.028 . 0 0 "[ . 1 .]" 1
479 1 6 DG H3' 1 6 DG H5'' 3.000 . 3.500 2.733 2.673 2.759 . 0 0 "[ . 1 .]" 1
480 1 5 DG H1' 1 6 DG H4' 5.000 . 5.500 5.027 4.881 5.151 . 0 0 "[ . 1 .]" 1
481 1 6 DG H1' 1 6 DG H4' 3.000 . 3.500 3.169 3.129 3.257 . 0 0 "[ . 1 .]" 1
482 1 6 DG H4' 1 6 DG H8 5.000 . 5.500 4.988 4.855 5.071 . 0 0 "[ . 1 .]" 1
483 1 6 DG H2' 1 6 DG H4' 5.000 . 5.500 3.871 3.856 3.898 . 0 0 "[ . 1 .]" 1
484 1 6 DG H2'' 1 6 DG H4' 5.000 . 5.500 3.987 3.963 4.000 . 0 0 "[ . 1 .]" 1
485 1 6 DG H3' 1 6 DG H4' 3.000 . 3.500 2.748 2.734 2.757 . 0 0 "[ . 1 .]" 1
486 1 6 DG H1' 1 6 DG H8 4.000 . 4.500 3.885 3.873 3.890 . 0 0 "[ . 1 .]" 1
487 1 6 DG H1' 1 6 DG H2' 3.000 . 3.500 3.059 3.042 3.067 . 0 0 "[ . 1 .]" 1
488 1 6 DG H1' 1 6 DG H2'' 3.000 . 3.500 2.409 2.392 2.418 . 0 0 "[ . 1 .]" 1
489 1 6 DG H1' 1 6 DG H3' 5.000 . 5.500 3.805 3.776 3.869 . 0 0 "[ . 1 .]" 1
490 1 6 DG H1' 1 7 DT H3' 5.000 . 5.500 4.713 3.894 5.335 . 0 0 "[ . 1 .]" 1
491 1 6 DG H1' 1 7 DT H5' 5.000 . 5.500 4.905 4.447 5.119 . 0 0 "[ . 1 .]" 1
492 1 6 DG H1' 1 7 DT H5'' 5.000 . 5.500 3.551 2.762 5.947 0.447 12 0 "[ . 1 .]" 1
493 1 6 DG H1' 1 22 DA H2 6.000 . 6.500 3.824 3.577 4.171 . 0 0 "[ . 1 .]" 1
494 1 6 DG H2' 1 22 DA H2 5.000 . 5.500 5.594 5.568 5.613 0.113 15 0 "[ . 1 .]" 1
495 1 6 DG H2'' 1 22 DA H2 5.000 . 5.500 4.063 4.006 4.153 . 0 0 "[ . 1 .]" 1
496 1 6 DG Q2' 1 7 DT Q5' 5.000 . 5.500 4.196 3.796 4.648 . 0 0 "[ . 1 .]" 1
497 1 6 DG H2' 1 6 DG H8 4.000 . 4.500 2.382 2.328 2.476 . 0 0 "[ . 1 .]" 1
498 1 6 DG H2'' 1 6 DG H8 4.000 . 4.500 3.747 3.656 3.853 . 0 0 "[ . 1 .]" 1
499 1 6 DG H3' 1 6 DG H8 5.000 . 5.500 4.442 4.302 4.517 . 0 0 "[ . 1 .]" 1
500 1 6 DG H2' 1 6 DG H5' 5.000 . 5.500 4.073 4.031 4.138 . 0 0 "[ . 1 .]" 1
501 1 6 DG H2' 1 6 DG H2'' 2.500 . 3.000 1.756 1.754 1.759 0.046 15 0 "[ . 1 .]" 1
502 1 6 DG H2' 1 6 DG H3' 3.000 . 3.500 2.394 2.377 2.407 . 0 0 "[ . 1 .]" 1
503 1 6 DG H2' 1 22 DA H4' 5.000 . 5.500 4.562 4.437 4.661 . 0 0 "[ . 1 .]" 1
504 1 6 DG H2' 1 22 DA H1' 5.000 . 5.500 3.116 2.956 3.240 . 0 0 "[ . 1 .]" 1
505 1 6 DG H2'' 1 6 DG H5' 5.000 . 5.500 5.131 5.114 5.146 . 0 0 "[ . 1 .]" 1
506 1 6 DG H2'' 1 6 DG H3' 3.000 . 3.500 2.716 2.704 2.734 . 0 0 "[ . 1 .]" 1
507 1 6 DG H2'' 1 22 DA H4' 5.000 . 5.500 4.261 4.200 4.312 . 0 0 "[ . 1 .]" 1
508 1 6 DG H1' 1 22 DA H4' 6.000 . 6.500 6.549 6.506 6.614 0.114 14 0 "[ . 1 .]" 1
509 1 3 DA H5' 1 3 DA H5'' 2.500 . 3.000 1.774 1.774 1.775 0.026 15 0 "[ . 1 .]" 1
510 1 3 DA H4' 1 3 DA H5' 3.000 . 3.500 2.494 2.488 2.505 . 0 0 "[ . 1 .]" 1
511 1 3 DA H1' 1 3 DA H5' 5.000 . 5.500 4.578 4.573 4.581 . 0 0 "[ . 1 .]" 1
512 1 3 DA H5' 1 3 DA H8 5.000 . 5.500 3.919 3.910 3.928 . 0 0 "[ . 1 .]" 1
513 1 3 DA H2' 1 3 DA H5' 5.000 . 5.500 5.137 5.077 5.163 . 0 0 "[ . 1 .]" 1
514 1 3 DA H2'' 1 3 DA H5' 5.000 . 5.500 5.077 5.045 5.120 . 0 0 "[ . 1 .]" 1
515 1 3 DA H3' 1 3 DA H5' 4.000 . 4.500 3.666 3.657 3.669 . 0 0 "[ . 1 .]" 1
516 1 2 DG H1' 1 3 DA H5' 5.000 . 5.500 2.870 2.828 2.913 . 0 0 "[ . 1 .]" 1
517 1 3 DA H4' 1 3 DA H5'' 3.000 . 3.500 2.369 2.363 2.371 . 0 0 "[ . 1 .]" 1
518 1 3 DA H1' 1 3 DA H5'' 5.000 . 5.500 5.220 5.210 5.226 . 0 0 "[ . 1 .]" 1
519 1 3 DA H5'' 1 3 DA H8 5.000 . 5.500 3.899 3.890 3.931 . 0 0 "[ . 1 .]" 1
520 1 3 DA H2' 1 3 DA H5'' 5.000 . 5.500 4.885 4.822 4.923 . 0 0 "[ . 1 .]" 1
521 1 3 DA H2'' 1 3 DA H5'' 5.000 . 5.500 4.910 4.887 4.944 . 0 0 "[ . 1 .]" 1
522 1 3 DA H3' 1 3 DA H5'' 4.000 . 4.500 2.816 2.778 2.848 . 0 0 "[ . 1 .]" 1
523 1 2 DG H1' 1 3 DA H5'' 5.000 . 5.500 4.633 4.592 4.676 . 0 0 "[ . 1 .]" 1
524 1 3 DA H4' 1 4 DG H8 5.000 . 5.500 5.503 5.401 5.543 0.043 13 0 "[ . 1 .]" 1
525 1 3 DA H1' 1 3 DA H4' 3.000 . 3.500 3.657 3.655 3.662 0.162 15 0 "[ . 1 .]" 1
526 1 3 DA H4' 1 3 DA H8 5.000 . 5.500 4.351 4.320 4.409 . 0 0 "[ . 1 .]" 1
527 1 3 DA H2' 1 3 DA H4' 4.000 . 4.500 4.010 3.992 4.035 . 0 0 "[ . 1 .]" 1
528 1 3 DA H2'' 1 3 DA H4' 4.000 . 4.500 3.250 3.185 3.353 . 0 0 "[ . 1 .]" 1
529 1 3 DA H3' 1 3 DA H4' 4.000 . 4.500 2.929 2.911 2.939 . 0 0 "[ . 1 .]" 1
530 1 2 DG H1' 1 3 DA H4' 6.000 . 6.500 4.690 4.654 4.745 . 0 0 "[ . 1 .]" 1
531 1 3 DA H1' 1 4 DG H8 5.000 . 5.500 4.011 3.831 4.230 . 0 0 "[ . 1 .]" 1
532 1 2 DG H8 1 3 DA H2 5.000 . 5.500 3.679 3.612 3.785 . 0 0 "[ . 1 .]" 1
533 1 2 DG H1' 1 3 DA H2 6.000 . 6.500 6.532 6.502 6.578 0.078 4 0 "[ . 1 .]" 1
534 1 2 DG H2' 1 3 DA H2 5.000 . 5.500 4.730 4.692 4.782 . 0 0 "[ . 1 .]" 1
535 1 2 DG H2'' 1 3 DA H2 5.000 . 5.500 5.518 5.508 5.533 0.033 1 0 "[ . 1 .]" 1
536 1 3 DA H2 1 17 DG H1' 5.000 . 5.500 5.577 5.498 5.621 0.121 3 0 "[ . 1 .]" 1
537 1 3 DA H2' 1 4 DG H8 5.000 . 5.500 3.062 2.975 3.273 . 0 0 "[ . 1 .]" 1
538 1 3 DA H2' 1 3 DA H2'' 3.000 . 3.500 1.761 1.759 1.762 0.041 13 0 "[ . 1 .]" 1
539 1 3 DA H2' 1 3 DA H3' 4.000 . 4.500 2.360 2.348 2.366 . 0 0 "[ . 1 .]" 1
540 1 3 DA H2'' 1 4 DG H8 5.000 . 5.500 2.364 2.259 2.481 . 0 0 "[ . 1 .]" 1
541 1 3 DA H2'' 1 3 DA H3' 4.000 . 4.500 3.013 2.993 3.023 . 0 0 "[ . 1 .]" 1
542 1 3 DA H3' 1 4 DG H8 5.000 . 5.500 4.895 4.847 4.946 . 0 0 "[ . 1 .]" 1
543 1 3 DA H1' 1 3 DA H3' 4.000 . 4.500 3.990 3.967 4.025 . 0 0 "[ . 1 .]" 1
544 1 3 DA H3' 1 3 DA H8 5.000 . 5.500 2.362 2.255 2.531 . 0 0 "[ . 1 .]" 1
545 1 22 DA H5' 1 22 DA H5'' 2.500 . 3.000 1.777 1.775 1.778 0.025 4 0 "[ . 1 .]" 1
546 1 22 DA H4' 1 22 DA H5' 3.000 . 3.500 2.444 2.442 2.447 . 0 0 "[ . 1 .]" 1
547 1 22 DA H1' 1 22 DA H5' 5.000 . 5.500 4.286 4.273 4.309 . 0 0 "[ . 1 .]" 1
548 1 22 DA H5' 1 22 DA H8 5.000 . 5.500 4.505 4.490 4.517 . 0 0 "[ . 1 .]" 1
549 1 22 DA H2' 1 22 DA H5' 5.000 . 5.500 5.249 5.243 5.265 . 0 0 "[ . 1 .]" 1
550 1 22 DA H2'' 1 22 DA H5' 5.000 . 5.500 5.098 5.080 5.107 . 0 0 "[ . 1 .]" 1
551 1 22 DA H3' 1 22 DA H5' 4.000 . 4.500 3.730 3.725 3.736 . 0 0 "[ . 1 .]" 1
552 1 21 DA H1' 1 22 DA H5' 6.000 . 6.500 4.819 4.796 4.834 . 0 0 "[ . 1 .]" 1
553 1 22 DA H4' 1 22 DA H5'' 3.000 . 3.500 2.412 2.407 2.418 . 0 0 "[ . 1 .]" 1
554 1 22 DA H1' 1 22 DA H5'' 5.000 . 5.500 4.800 4.782 4.836 . 0 0 "[ . 1 .]" 1
555 1 22 DA H5'' 1 22 DA H8 5.000 . 5.500 5.258 5.192 5.290 . 0 0 "[ . 1 .]" 1
556 1 22 DA H2' 1 22 DA H5'' 5.000 . 5.500 4.971 4.966 4.976 . 0 0 "[ . 1 .]" 1
557 1 22 DA H2'' 1 22 DA H5'' 5.000 . 5.500 4.753 4.742 4.760 . 0 0 "[ . 1 .]" 1
558 1 22 DA H3' 1 22 DA H5'' 4.000 . 4.500 3.007 3.001 3.012 . 0 0 "[ . 1 .]" 1
559 1 21 DA H1' 1 22 DA H5'' 6.000 . 6.500 6.206 6.196 6.216 . 0 0 "[ . 1 .]" 1
560 1 6 DG H8 1 22 DA H4' 6.000 . 6.500 6.716 6.676 6.737 0.237 12 0 "[ . 1 .]" 1
561 1 22 DA H1' 1 22 DA H4' 4.000 . 4.500 2.647 2.621 2.694 . 0 0 "[ . 1 .]" 1
562 1 22 DA H4' 1 22 DA H8 5.000 . 5.500 4.676 4.664 4.683 . 0 0 "[ . 1 .]" 1
563 1 22 DA H2' 1 22 DA H4' 4.000 . 4.500 3.778 3.775 3.781 . 0 0 "[ . 1 .]" 1
564 1 22 DA H2'' 1 22 DA H4' 4.000 . 4.500 2.974 2.946 2.987 . 0 0 "[ . 1 .]" 1
565 1 22 DA H3' 1 22 DA H4' 4.000 . 4.500 3.016 3.014 3.017 . 0 0 "[ . 1 .]" 1
566 1 21 DA H1' 1 22 DA H4' 5.000 . 5.500 5.578 5.564 5.594 0.094 10 0 "[ . 1 .]" 1
567 1 21 DA H2'' 1 22 DA H4' 6.000 . 6.500 3.997 3.985 4.006 . 0 0 "[ . 1 .]" 1
568 1 22 DA H1' 1 22 DA H2 5.000 . 5.500 4.691 4.677 4.700 . 0 0 "[ . 1 .]" 1
569 1 22 DA H1' 1 22 DA H8 4.000 . 4.500 3.756 3.747 3.763 . 0 0 "[ . 1 .]" 1
570 1 22 DA H1' 1 22 DA H2' 3.000 . 3.500 2.960 2.950 2.966 . 0 0 "[ . 1 .]" 1
571 1 22 DA H1' 1 22 DA H2'' 3.000 . 3.500 2.344 2.343 2.345 . 0 0 "[ . 1 .]" 1
572 1 22 DA H1' 1 22 DA H3' 4.000 . 4.500 3.881 3.877 3.887 . 0 0 "[ . 1 .]" 1
573 1 22 DA H2' 1 22 DA H8 5.000 . 5.500 3.611 3.588 3.647 . 0 0 "[ . 1 .]" 1
574 1 22 DA H2'' 1 22 DA H8 5.000 . 5.500 4.728 4.708 4.748 . 0 0 "[ . 1 .]" 1
575 1 22 DA H3' 1 22 DA H8 5.000 . 5.500 3.756 3.646 3.807 . 0 0 "[ . 1 .]" 1
576 1 21 DA H1' 1 22 DA H8 5.000 . 5.500 2.434 2.402 2.528 . 0 0 "[ . 1 .]" 1
577 1 22 DA H2 1 22 DA H2' 5.000 . 5.500 5.352 5.314 5.376 . 0 0 "[ . 1 .]" 1
578 1 22 DA H2' 1 22 DA H2'' 2.500 . 3.000 1.761 1.759 1.762 0.041 9 0 "[ . 1 .]" 1
579 1 22 DA H2' 1 22 DA H3' 4.000 . 4.500 2.354 2.351 2.360 . 0 0 "[ . 1 .]" 1
580 1 22 DA H2 1 22 DA H2'' 5.000 . 5.500 5.227 5.190 5.288 . 0 0 "[ . 1 .]" 1
581 1 22 DA H2'' 1 22 DA H3' 4.000 . 4.500 3.008 3.004 3.015 . 0 0 "[ . 1 .]" 1
582 1 21 DA H1' 1 22 DA H3' 6.000 . 6.500 5.733 5.705 5.760 . 0 0 "[ . 1 .]" 1
583 1 7 DT H5' 1 7 DT H5'' 2.500 . 3.000 1.766 1.761 1.769 0.039 12 0 "[ . 1 .]" 1
584 1 7 DT H4' 1 7 DT H5' 3.000 . 3.500 2.410 2.329 2.598 . 0 0 "[ . 1 .]" 1
585 1 7 DT H1' 1 7 DT H5' 5.000 . 5.500 4.728 4.532 5.074 . 0 0 "[ . 1 .]" 1
586 1 7 DT H5' 1 7 DT M7 5.000 . 5.500 4.650 3.789 5.023 . 0 0 "[ . 1 .]" 1
587 1 7 DT H5' 1 7 DT H6 4.000 . 4.500 3.476 2.679 3.860 . 0 0 "[ . 1 .]" 1
588 1 7 DT H2' 1 7 DT H5' 5.000 . 5.500 5.012 4.253 5.377 . 0 0 "[ . 1 .]" 1
589 1 7 DT H2'' 1 7 DT H5' 5.000 . 5.500 4.983 4.733 5.202 . 0 0 "[ . 1 .]" 1
590 1 7 DT H3' 1 7 DT H5' 3.000 . 3.500 3.600 2.319 3.710 0.210 1 0 "[ . 1 .]" 1
591 1 7 DT H4' 1 7 DT H5'' 3.000 . 3.500 2.473 2.287 2.974 . 0 0 "[ . 1 .]" 1
592 1 7 DT H1' 1 7 DT H5'' 5.000 . 5.500 5.100 4.222 5.188 . 0 0 "[ . 1 .]" 1
593 1 7 DT H5'' 1 7 DT M7 5.000 . 5.500 4.658 3.002 5.092 . 0 0 "[ . 1 .]" 1
594 1 7 DT H5'' 1 7 DT H6 3.000 . 3.500 3.491 1.941 3.814 0.314 4 0 "[ . 1 .]" 1
595 1 7 DT H2' 1 7 DT H5'' 5.000 . 5.500 4.614 4.091 4.829 . 0 0 "[ . 1 .]" 1
596 1 7 DT H2'' 1 7 DT H5'' 5.000 . 5.500 4.744 4.625 5.035 . 0 0 "[ . 1 .]" 1
597 1 7 DT H3' 1 7 DT H5'' 3.000 . 3.500 2.702 2.596 2.831 . 0 0 "[ . 1 .]" 1
598 1 7 DT H1' 1 7 DT H4' 3.000 . 3.500 3.472 3.409 3.687 0.187 12 0 "[ . 1 .]" 1
599 1 7 DT H4' 1 7 DT H6 4.000 . 4.500 3.960 3.836 4.055 . 0 0 "[ . 1 .]" 1
600 1 7 DT H2' 1 7 DT H4' 4.000 . 4.500 3.886 3.826 4.020 . 0 0 "[ . 1 .]" 1
601 1 7 DT H2'' 1 7 DT H4' 4.000 . 4.500 3.187 2.829 3.960 . 0 0 "[ . 1 .]" 1
602 1 7 DT H3' 1 7 DT H4' 4.000 . 4.500 2.908 2.712 2.987 . 0 0 "[ . 1 .]" 1
603 1 7 DT H1' 1 7 DT M7 6.000 . 6.500 5.165 5.145 5.180 . 0 0 "[ . 1 .]" 1
604 1 7 DT H1' 1 7 DT H6 4.000 . 4.500 3.686 3.657 3.714 . 0 0 "[ . 1 .]" 1
605 1 7 DT H1' 1 7 DT H2' 3.000 . 3.500 2.832 2.728 2.995 . 0 0 "[ . 1 .]" 1
606 1 7 DT H1' 1 7 DT H2'' 3.000 . 3.500 2.353 2.320 2.364 . 0 0 "[ . 1 .]" 1
607 1 7 DT H1' 1 7 DT H3' 4.000 . 4.500 3.920 3.866 4.014 . 0 0 "[ . 1 .]" 1
608 1 7 DT H6 1 7 DT M7 3.000 . 3.500 2.331 2.266 2.410 . 0 0 "[ . 1 .]" 1
609 1 7 DT H2' 1 7 DT M7 6.000 . 6.500 4.452 4.162 4.600 . 0 0 "[ . 1 .]" 1
610 1 7 DT H2'' 1 7 DT M7 6.000 . 6.500 5.630 5.496 5.701 . 0 0 "[ . 1 .]" 1
611 1 6 DG H3' 1 7 DT M7 6.000 . 6.500 3.785 2.810 6.569 0.069 12 0 "[ . 1 .]" 1
612 1 6 DG H4' 1 7 DT M7 6.000 . 6.500 3.993 3.378 5.315 . 0 0 "[ . 1 .]" 1
613 1 6 DG H5' 1 7 DT M7 6.000 . 6.500 4.509 3.378 6.583 0.083 10 0 "[ . 1 .]" 1
614 1 6 DG H5'' 1 7 DT M7 6.000 . 6.500 3.155 1.991 5.447 . 0 0 "[ . 1 .]" 1
615 1 7 DT H2' 1 7 DT H6 4.000 . 4.500 3.070 2.794 3.242 . 0 0 "[ . 1 .]" 1
616 1 7 DT H2'' 1 7 DT H6 4.000 . 4.500 4.128 3.987 4.221 . 0 0 "[ . 1 .]" 1
617 1 7 DT H3' 1 7 DT H6 4.000 . 4.500 2.571 2.056 4.024 . 0 0 "[ . 1 .]" 1
618 1 7 DT H2' 1 7 DT H2'' 2.500 . 3.000 1.760 1.755 1.765 0.045 13 0 "[ . 1 .]" 1
619 1 7 DT H2' 1 7 DT H3' 3.000 . 3.500 2.380 2.337 2.407 . 0 0 "[ . 1 .]" 1
620 1 7 DT H2'' 1 7 DT H3' 3.000 . 3.500 2.967 2.755 3.053 . 0 0 "[ . 1 .]" 1
621 1 7 DT H2' 1 8 DG H5' 5.000 . 5.500 4.427 3.643 5.634 0.134 13 0 "[ . 1 .]" 1
622 1 7 DT H2' 1 8 DG H5'' 5.000 . 5.500 3.569 2.071 4.487 . 0 0 "[ . 1 .]" 1
623 1 7 DT H2'' 1 8 DG H5' 5.000 . 5.500 3.309 2.804 3.973 . 0 0 "[ . 1 .]" 1
624 1 7 DT H2'' 1 8 DG H5'' 5.000 . 5.500 2.263 2.090 3.009 . 0 0 "[ . 1 .]" 1
625 1 12 DA H5' 1 12 DA H5'' 2.500 . 3.000 1.756 1.739 1.771 0.061 9 0 "[ . 1 .]" 1
626 1 12 DA H4' 1 12 DA H5' 3.000 . 3.500 2.508 2.373 3.003 . 0 0 "[ . 1 .]" 1
627 1 12 DA H5' 1 12 DA H8 5.000 . 5.500 4.306 2.410 5.447 . 0 0 "[ . 1 .]" 1
628 1 12 DA H2' 1 12 DA H5' 5.000 . 5.500 4.057 2.761 4.878 . 0 0 "[ . 1 .]" 1
629 1 12 DA H2'' 1 12 DA H5' 5.000 . 5.500 4.924 4.002 5.241 . 0 0 "[ . 1 .]" 1
630 1 12 DA H3' 1 12 DA H5' 3.000 . 3.500 3.247 2.419 3.700 0.200 3 0 "[ . 1 .]" 1
631 1 11 DT H5' 1 12 DA H5' 5.000 . 5.500 4.081 2.088 6.401 0.901 9 1 "[ . +1 .]" 1
632 1 11 DT H1' 1 12 DA H5' 6.000 . 6.500 6.050 5.005 6.935 0.435 7 0 "[ . 1 .]" 1
633 1 11 DT H6 1 12 DA H5' 6.000 . 6.500 5.814 4.893 6.963 0.463 9 0 "[ . 1 .]" 1
634 1 12 DA H4' 1 12 DA H5'' 3.000 . 3.500 2.592 2.332 3.019 . 0 0 "[ . 1 .]" 1
635 1 12 DA H5'' 1 12 DA H8 5.000 . 5.500 4.224 1.943 5.583 0.083 12 0 "[ . 1 .]" 1
636 1 12 DA H2' 1 12 DA H5'' 5.000 . 5.500 3.828 2.531 4.358 . 0 0 "[ . 1 .]" 1
637 1 12 DA H2'' 1 12 DA H5'' 5.000 . 5.500 4.705 4.007 4.979 . 0 0 "[ . 1 .]" 1
638 1 12 DA H3' 1 12 DA H5'' 3.000 . 3.500 2.716 2.404 3.650 0.150 15 0 "[ . 1 .]" 1
639 1 11 DT H5' 1 12 DA H5'' 5.000 . 5.500 4.567 3.587 5.265 . 0 0 "[ . 1 .]" 1
640 1 11 DT H6 1 12 DA H5'' 6.000 . 6.500 6.341 5.274 6.970 0.470 5 0 "[ . 1 .]" 1
641 1 12 DA H1' 1 12 DA H4' 5.000 . 5.500 3.482 3.254 3.915 . 0 0 "[ . 1 .]" 1
642 1 11 DT H4' 1 12 DA H4' 6.000 . 6.500 4.084 3.697 4.690 . 0 0 "[ . 1 .]" 1
643 1 12 DA H4' 1 12 DA H8 6.000 . 6.500 5.005 4.005 5.532 . 0 0 "[ . 1 .]" 1
644 1 12 DA H2' 1 12 DA H4' 4.000 . 4.500 3.881 3.803 4.009 . 0 0 "[ . 1 .]" 1
645 1 12 DA H2'' 1 12 DA H4' 4.000 . 4.500 3.846 3.018 4.092 . 0 0 "[ . 1 .]" 1
646 1 12 DA H3' 1 12 DA H4' 4.000 . 4.500 2.739 2.651 2.961 . 0 0 "[ . 1 .]" 1
647 1 11 DT H5' 1 12 DA H4' 6.000 . 6.500 4.361 3.046 6.258 . 0 0 "[ . 1 .]" 1
648 1 11 DT H4' 1 12 DA H2 5.000 . 5.500 5.622 5.248 6.022 0.522 9 1 "[ . +1 .]" 1
649 1 11 DT H5' 1 12 DA H2 5.000 . 5.500 4.543 3.881 5.641 0.141 6 0 "[ . 1 .]" 1
650 1 11 DT M7 1 12 DA H2 6.000 . 6.500 6.297 2.808 6.759 0.259 3 0 "[ . 1 .]" 1
651 1 12 DA H2' 1 12 DA H8 3.000 . 3.500 2.348 2.039 3.271 . 0 0 "[ . 1 .]" 1
652 1 12 DA H2'' 1 12 DA H8 4.000 . 4.500 3.542 3.138 4.242 . 0 0 "[ . 1 .]" 1
653 1 12 DA H3' 1 12 DA H8 4.000 . 4.500 3.897 1.903 4.557 0.057 6 0 "[ . 1 .]" 1
654 1 11 DT H5' 1 12 DA H8 5.000 . 5.500 4.953 4.358 5.286 . 0 0 "[ . 1 .]" 1
655 1 11 DT H1' 1 12 DA H8 6.000 . 6.500 4.699 3.928 5.371 . 0 0 "[ . 1 .]" 1
656 1 12 DA H2' 1 12 DA H2'' 2.500 . 3.000 1.756 1.741 1.761 0.059 15 0 "[ . 1 .]" 1
657 1 12 DA H2' 1 12 DA H3' 3.000 . 3.500 2.395 2.307 2.422 . 0 0 "[ . 1 .]" 1
658 1 12 DA H2'' 1 12 DA H3' 3.000 . 3.500 2.776 2.681 3.053 . 0 0 "[ . 1 .]" 1
659 1 11 DT H5' 1 12 DA H3' 6.000 . 6.500 5.858 4.905 6.789 0.289 15 0 "[ . 1 .]" 1
660 1 10 DG H5' 1 11 DT H5' 5.000 . 5.500 5.431 4.464 5.891 0.391 9 0 "[ . 1 .]" 1
661 1 11 DT H1' 1 11 DT H5' 5.000 . 5.500 4.628 4.075 5.123 . 0 0 "[ . 1 .]" 1
662 1 11 DT H5' 1 11 DT H6 4.000 . 4.500 3.288 1.888 3.821 . 0 0 "[ . 1 .]" 1
663 1 11 DT H2' 1 11 DT H5' 5.000 . 5.500 4.602 2.821 5.306 . 0 0 "[ . 1 .]" 1
664 1 11 DT H2'' 1 11 DT H5' 5.000 . 5.500 5.068 4.177 5.289 . 0 0 "[ . 1 .]" 1
665 1 11 DT H1' 1 11 DT M7 5.000 . 5.500 5.157 5.046 5.183 . 0 0 "[ . 1 .]" 1
666 1 11 DT H1' 1 11 DT H6 4.000 . 4.500 3.674 3.506 3.711 . 0 0 "[ . 1 .]" 1
667 1 11 DT H1' 1 11 DT H2' 3.000 . 3.500 2.900 2.759 3.015 . 0 0 "[ . 1 .]" 1
668 1 11 DT H1' 1 11 DT H2'' 3.000 . 3.500 2.353 2.324 2.373 . 0 0 "[ . 1 .]" 1
669 1 11 DT H6 1 11 DT M7 3.000 . 3.500 2.353 2.277 2.414 . 0 0 "[ . 1 .]" 1
670 1 11 DT H2'' 1 11 DT M7 5.000 . 5.500 5.489 5.315 5.778 0.278 9 0 "[ . 1 .]" 1
671 1 11 DT H2' 1 11 DT H6 4.000 . 4.500 2.722 2.369 3.427 . 0 0 "[ . 1 .]" 1
672 1 11 DT H2'' 1 11 DT H6 4.000 . 4.500 3.987 3.857 4.505 0.005 9 0 "[ . 1 .]" 1
673 1 11 DT H2' 1 12 DA H8 6.000 . 6.500 6.009 5.136 6.597 0.097 15 0 "[ . 1 .]" 1
674 1 11 DT H2' 1 11 DT H2'' 2.500 . 3.000 1.759 1.756 1.761 0.044 9 0 "[ . 1 .]" 1
675 1 11 DT H2'' 1 12 DA H8 6.000 . 6.500 4.964 3.506 6.237 . 0 0 "[ . 1 .]" 1
676 1 11 DT H3' 1 11 DT H4' 3.000 . 3.500 2.817 2.633 2.981 . 0 0 "[ . 1 .]" 1
677 1 11 DT H3' 1 12 DA H5' 5.000 . 5.500 3.538 2.067 5.164 . 0 0 "[ . 1 .]" 1
678 1 11 DT H3' 1 12 DA H5'' 5.000 . 5.500 4.006 2.307 5.339 . 0 0 "[ . 1 .]" 1
679 1 11 DT H3' 1 12 DA H8 5.000 . 5.500 5.234 4.892 5.618 0.118 14 0 "[ . 1 .]" 1
680 1 11 DT H3' 1 11 DT H5' 3.000 . 3.500 3.594 3.150 3.672 0.172 10 0 "[ . 1 .]" 1
681 1 11 DT H1' 1 11 DT H3' 4.000 . 4.500 3.969 3.931 4.056 . 0 0 "[ . 1 .]" 1
682 1 11 DT H3' 1 11 DT H6 4.000 . 4.500 3.090 1.983 4.502 0.002 9 0 "[ . 1 .]" 1
683 1 11 DT H2' 1 11 DT H3' 3.000 . 3.500 2.363 2.328 2.397 . 0 0 "[ . 1 .]" 1
684 1 11 DT H2'' 1 11 DT H3' 3.000 . 3.500 2.868 2.718 3.030 . 0 0 "[ . 1 .]" 1
685 1 21 DA H5' 1 22 DA H8 6.000 . 6.500 6.569 6.556 6.606 0.106 15 0 "[ . 1 .]" 1
686 1 21 DA H4' 1 21 DA H5' 3.000 . 3.500 2.426 2.421 2.434 . 0 0 "[ . 1 .]" 1
687 1 21 DA H4' 1 21 DA H5'' 3.000 . 3.500 2.416 2.411 2.419 . 0 0 "[ . 1 .]" 1
688 1 21 DA H1' 1 21 DA H5' 5.000 . 5.500 4.660 4.655 4.664 . 0 0 "[ . 1 .]" 1
689 1 21 DA H1' 1 21 DA H5'' 5.000 . 5.500 5.207 5.203 5.209 . 0 0 "[ . 1 .]" 1
690 1 21 DA H5' 1 21 DA H8 5.000 . 5.500 4.236 4.188 4.280 . 0 0 "[ . 1 .]" 1
691 1 21 DA H5'' 1 21 DA H8 5.000 . 5.500 4.109 4.080 4.158 . 0 0 "[ . 1 .]" 1
692 1 21 DA H2'' 1 21 DA H5' 5.000 . 5.500 4.971 4.965 4.981 . 0 0 "[ . 1 .]" 1
693 1 21 DA H2'' 1 21 DA H5'' 5.000 . 5.500 4.725 4.719 4.734 . 0 0 "[ . 1 .]" 1
694 1 21 DA H4' 1 22 DA H1' 5.000 . 5.500 5.626 5.608 5.651 0.151 2 0 "[ . 1 .]" 1
695 1 21 DA H4' 1 22 DA H5'' 5.000 . 5.500 4.895 4.852 4.927 . 0 0 "[ . 1 .]" 1
696 1 21 DA H4' 1 22 DA H8 5.000 . 5.500 4.762 4.742 4.800 . 0 0 "[ . 1 .]" 1
697 1 21 DA H1' 1 21 DA H4' 4.000 . 4.500 3.447 3.433 3.458 . 0 0 "[ . 1 .]" 1
698 1 21 DA H1' 1 22 DA H2' 6.000 . 6.500 5.720 5.675 5.764 . 0 0 "[ . 1 .]" 1
699 1 21 DA H1' 1 22 DA H2'' 6.000 . 6.500 6.393 6.350 6.428 . 0 0 "[ . 1 .]" 1
700 1 21 DA H4' 1 21 DA H8 5.000 . 5.500 4.373 4.356 4.398 . 0 0 "[ . 1 .]" 1
701 1 21 DA H2'' 1 21 DA H4' 4.000 . 4.500 2.938 2.921 2.954 . 0 0 "[ . 1 .]" 1
702 1 21 DA H1' 1 21 DA H8 4.000 . 4.500 3.891 3.889 3.893 . 0 0 "[ . 1 .]" 1
703 1 21 DA H1' 1 21 DA H2 5.000 . 5.500 4.480 4.476 4.484 . 0 0 "[ . 1 .]" 1
704 1 21 DA H1' 1 21 DA H2'' 3.000 . 3.500 2.347 2.345 2.350 . 0 0 "[ . 1 .]" 1
705 1 21 DA H2'' 1 21 DA H8 4.000 . 4.500 4.195 4.185 4.225 . 0 0 "[ . 1 .]" 1
706 1 20 DT H1' 1 21 DA H8 5.000 . 5.500 5.469 5.400 5.558 0.058 11 0 "[ . 1 .]" 1
707 1 20 DT H2'' 1 21 DA H8 5.000 . 5.500 3.614 3.465 3.844 . 0 0 "[ . 1 .]" 1
708 1 20 DT M7 1 21 DA H8 6.000 . 6.500 5.803 5.594 5.853 . 0 0 "[ . 1 .]" 1
709 1 20 DT H6 1 21 DA H8 5.000 . 5.500 5.482 5.354 5.523 0.023 14 0 "[ . 1 .]" 1
710 1 21 DA H2'' 1 22 DA H8 5.000 . 5.500 2.030 2.011 2.048 . 0 0 "[ . 1 .]" 1
711 1 21 DA H2'' 1 22 DA H5' 5.000 . 5.500 2.874 2.849 2.897 . 0 0 "[ . 1 .]" 1
712 1 21 DA H2'' 1 22 DA H5'' 5.000 . 5.500 4.020 4.012 4.027 . 0 0 "[ . 1 .]" 1
713 1 21 DA H2' 1 21 DA H3' 3.000 . 3.500 2.394 2.389 2.398 . 0 0 "[ . 1 .]" 1
714 1 21 DA H3' 1 22 DA H8 6.000 . 6.500 4.578 4.545 4.591 . 0 0 "[ . 1 .]" 1
715 1 21 DA H3' 1 21 DA H5' 3.000 . 3.500 3.677 3.672 3.682 0.182 11 0 "[ . 1 .]" 1
716 1 21 DA H3' 1 21 DA H5'' 3.000 . 3.500 2.826 2.817 2.842 . 0 0 "[ . 1 .]" 1
717 1 21 DA H3' 1 21 DA H4' 3.000 . 3.500 2.976 2.974 2.979 . 0 0 "[ . 1 .]" 1
718 1 21 DA H1' 1 21 DA H3' 4.000 . 4.500 3.909 3.906 3.913 . 0 0 "[ . 1 .]" 1
719 1 21 DA H3' 1 21 DA H8 5.000 . 5.500 2.220 2.190 2.252 . 0 0 "[ . 1 .]" 1
720 1 21 DA H2'' 1 21 DA H3' 3.000 . 3.500 3.041 3.036 3.044 . 0 0 "[ . 1 .]" 1
721 1 20 DT H5' 1 20 DT H5'' 2.500 . 3.000 1.774 1.772 1.776 0.028 14 0 "[ . 1 .]" 1
722 1 20 DT H4' 1 20 DT H5' 3.000 . 3.500 2.474 2.465 2.480 . 0 0 "[ . 1 .]" 1
723 1 20 DT H1' 1 20 DT H5' 5.000 . 5.500 4.492 4.468 4.521 . 0 0 "[ . 1 .]" 1
724 1 20 DT H2'' 1 20 DT H5' 5.000 . 5.500 5.041 5.004 5.107 . 0 0 "[ . 1 .]" 1
725 1 20 DT H5' 1 20 DT M7 6.000 . 6.500 5.390 5.281 5.476 . 0 0 "[ . 1 .]" 1
726 1 20 DT H5' 1 20 DT H6 4.000 . 4.500 4.126 4.017 4.192 . 0 0 "[ . 1 .]" 1
727 1 20 DT H4' 1 20 DT H5'' 3.000 . 3.500 2.366 2.362 2.370 . 0 0 "[ . 1 .]" 1
728 1 20 DT H1' 1 20 DT H5'' 5.000 . 5.500 5.032 5.006 5.067 . 0 0 "[ . 1 .]" 1
729 1 20 DT H2'' 1 20 DT H5'' 5.000 . 5.500 4.728 4.699 4.799 . 0 0 "[ . 1 .]" 1
730 1 20 DT H5'' 1 20 DT M7 6.000 . 6.500 5.761 5.632 5.860 . 0 0 "[ . 1 .]" 1
731 1 20 DT H5'' 1 20 DT H6 5.000 . 5.500 4.481 4.367 4.562 . 0 0 "[ . 1 .]" 1
732 1 20 DT H1' 1 20 DT H4' 3.000 . 3.500 3.044 2.995 3.104 . 0 0 "[ . 1 .]" 1
733 1 20 DT H2'' 1 20 DT H4' 4.000 . 4.500 2.946 2.893 3.075 . 0 0 "[ . 1 .]" 1
734 1 20 DT H4' 1 20 DT M7 6.000 . 6.500 5.901 5.843 5.943 . 0 0 "[ . 1 .]" 1
735 1 20 DT H4' 1 20 DT H6 4.000 . 4.500 4.255 4.194 4.304 . 0 0 "[ . 1 .]" 1
736 1 20 DT H1' 1 20 DT H2'' 3.000 . 3.500 2.329 2.324 2.333 . 0 0 "[ . 1 .]" 1
737 1 20 DT H1' 1 20 DT M7 5.000 . 5.500 5.149 5.141 5.153 . 0 0 "[ . 1 .]" 1
738 1 20 DT H1' 1 20 DT H6 3.000 . 3.500 3.664 3.659 3.666 0.166 5 0 "[ . 1 .]" 1
739 1 19 DG H1' 1 20 DT H2'' 6.000 . 6.500 5.899 5.811 6.090 . 0 0 "[ . 1 .]" 1
740 1 20 DT H2'' 1 20 DT M7 5.000 . 5.500 5.588 5.558 5.634 0.134 11 0 "[ . 1 .]" 1
741 1 20 DT H2'' 1 20 DT H6 4.000 . 4.500 4.111 4.090 4.155 . 0 0 "[ . 1 .]" 1
742 1 20 DT H2'' 1 21 DA H4' 5.000 . 5.500 3.870 3.737 3.893 . 0 0 "[ . 1 .]" 1
743 1 20 DT H2'' 1 21 DA H5' 5.000 . 5.500 2.614 2.434 2.656 . 0 0 "[ . 1 .]" 1
744 1 20 DT H2'' 1 21 DA H5'' 5.000 . 5.500 4.016 3.938 4.049 . 0 0 "[ . 1 .]" 1
745 1 20 DT H2' 1 20 DT H3' 3.000 . 3.500 2.366 2.352 2.374 . 0 0 "[ . 1 .]" 1
746 1 19 DG H1' 1 20 DT H3' 5.000 . 5.500 5.025 4.968 5.203 . 0 0 "[ . 1 .]" 1
747 1 20 DT H3' 1 21 DA H8 5.000 . 5.500 4.462 4.303 4.514 . 0 0 "[ . 1 .]" 1
748 1 20 DT H3' 1 20 DT H5' 3.000 . 3.500 3.660 3.644 3.671 0.171 14 0 "[ . 1 .]" 1
749 1 20 DT H3' 1 20 DT H5'' 3.000 . 3.500 2.973 2.919 2.988 . 0 0 "[ . 1 .]" 1
750 1 20 DT H3' 1 20 DT H4' 3.000 . 3.500 2.990 2.983 2.993 . 0 0 "[ . 1 .]" 1
751 1 20 DT H1' 1 20 DT H3' 4.000 . 4.500 3.912 3.892 3.942 . 0 0 "[ . 1 .]" 1
752 1 20 DT H2'' 1 20 DT H3' 3.000 . 3.500 3.021 2.999 3.028 . 0 0 "[ . 1 .]" 1
753 1 20 DT H3' 1 20 DT M7 5.000 . 5.500 4.108 4.007 4.277 . 0 0 "[ . 1 .]" 1
754 1 20 DT H3' 1 20 DT H6 4.000 . 4.500 2.552 2.466 2.737 . 0 0 "[ . 1 .]" 1
755 1 16 DT H5' 1 16 DT H5'' 2.500 . 3.000 1.774 1.771 1.775 0.029 14 0 "[ . 1 .]" 1
756 1 16 DT H4' 1 16 DT H5' 3.000 . 3.500 2.418 2.355 2.457 . 0 0 "[ . 1 .]" 1
757 1 16 DT H1' 1 16 DT H5' 5.000 . 5.500 4.653 4.572 4.685 . 0 0 "[ . 1 .]" 1
758 1 16 DT H5' 1 16 DT H6 6.000 . 6.500 3.677 3.289 4.411 . 0 0 "[ . 1 .]" 1
759 1 16 DT H2' 1 16 DT H5' 5.000 . 5.500 4.561 4.253 5.375 . 0 0 "[ . 1 .]" 1
760 1 16 DT H3' 1 16 DT H5' 4.000 . 4.500 3.708 3.684 3.751 . 0 0 "[ . 1 .]" 1
761 1 16 DT H4' 1 16 DT H5'' 3.000 . 3.500 2.432 2.367 2.500 . 0 0 "[ . 1 .]" 1
762 1 16 DT H1' 1 16 DT H5'' 5.000 . 5.500 5.035 5.000 5.131 . 0 0 "[ . 1 .]" 1
763 1 16 DT H5'' 1 16 DT H6 5.000 . 5.500 4.131 4.014 4.326 . 0 0 "[ . 1 .]" 1
764 1 16 DT H2' 1 16 DT H5'' 5.000 2.800 5.500 4.181 3.884 4.878 . 0 0 "[ . 1 .]" 1
765 1 16 DT H3' 1 16 DT H5'' 3.000 . 3.500 2.606 2.511 2.825 . 0 0 "[ . 1 .]" 1
766 1 16 DT H1' 1 16 DT H4' 4.000 . 4.500 3.296 3.028 3.416 . 0 0 "[ . 1 .]" 1
767 1 16 DT H4' 1 16 DT H6 4.000 . 4.500 4.279 4.111 4.383 . 0 0 "[ . 1 .]" 1
768 1 16 DT H2' 1 16 DT H4' 4.000 . 4.500 3.874 3.789 3.917 . 0 0 "[ . 1 .]" 1
769 1 16 DT H3' 1 16 DT H4' 4.000 . 4.500 2.799 2.711 3.009 . 0 0 "[ . 1 .]" 1
770 1 16 DT H1' 1 16 DT M7 6.000 . 6.500 5.161 5.153 5.166 . 0 0 "[ . 1 .]" 1
771 1 16 DT H1' 1 16 DT H6 3.000 . 3.500 3.671 3.662 3.678 0.178 14 0 "[ . 1 .]" 1
772 1 16 DT H1' 1 16 DT H2' 4.000 . 4.500 2.988 2.823 3.045 . 0 0 "[ . 1 .]" 1
773 1 16 DT H1' 1 16 DT H3' 4.000 . 4.500 3.881 3.856 3.938 . 0 0 "[ . 1 .]" 1
774 1 16 DT H1' 1 17 DG Q5' 5.000 . 5.500 4.071 3.699 4.508 . 0 0 "[ . 1 .]" 1
775 1 16 DT H3' 1 17 DG Q5' 5.000 . 5.500 4.104 3.838 4.257 . 0 0 "[ . 1 .]" 1
776 1 15 DG Q5' 1 16 DT H3' 5.000 . 5.500 2.574 2.317 2.814 . 0 0 "[ . 1 .]" 1
777 1 15 DG H1' 1 16 DT H3' 5.000 . 5.500 4.667 4.442 4.996 . 0 0 "[ . 1 .]" 1
778 1 16 DT H4' 1 17 DG Q5' 5.000 . 5.500 2.747 2.280 3.939 . 0 0 "[ . 1 .]" 1
779 1 16 DT H6 1 16 DT M7 3.000 . 3.500 2.349 2.296 2.412 . 0 0 "[ . 1 .]" 1
780 1 16 DT H3' 1 16 DT M7 6.000 . 6.500 5.205 3.761 5.704 . 0 0 "[ . 1 .]" 1
781 1 15 DG Q5' 1 16 DT M7 5.000 . 5.500 4.085 2.123 5.007 . 0 0 "[ . 1 .]" 1
782 1 15 DG H4' 1 16 DT M7 5.000 . 5.500 4.993 3.915 5.535 0.035 14 0 "[ . 1 .]" 1
783 1 16 DT H2' 1 16 DT H6 4.000 . 4.500 2.658 2.452 3.066 . 0 0 "[ . 1 .]" 1
784 1 16 DT H3' 1 16 DT H6 4.000 . 4.500 3.651 2.200 4.176 . 0 0 "[ . 1 .]" 1
785 1 16 DT H2' 1 16 DT M7 6.000 . 6.500 4.177 4.019 4.429 . 0 0 "[ . 1 .]" 1
786 1 16 DT H2' 1 16 DT H3' 4.000 . 4.500 2.374 2.359 2.391 . 0 0 "[ . 1 .]" 1
787 1 16 DT H2' 1 17 DG Q5' 5.000 . 5.500 4.858 3.257 5.481 . 0 0 "[ . 1 .]" 1
788 1 2 DG H5' 1 2 DG H5'' 2.500 . 3.000 1.774 1.773 1.775 0.027 7 0 "[ . 1 .]" 1
789 1 2 DG H4' 1 2 DG H5' 3.000 . 3.500 2.542 2.538 2.546 . 0 0 "[ . 1 .]" 1
790 1 2 DG H1' 1 2 DG H5' 5.000 . 5.500 4.522 4.518 4.527 . 0 0 "[ . 1 .]" 1
791 1 2 DG H5' 1 2 DG H8 5.000 . 5.500 4.381 4.357 4.408 . 0 0 "[ . 1 .]" 1
792 1 2 DG H2' 1 2 DG H5' 5.000 . 5.500 4.161 4.133 4.187 . 0 0 "[ . 1 .]" 1
793 1 2 DG H2'' 1 2 DG H5' 5.000 . 5.500 5.173 5.166 5.183 . 0 0 "[ . 1 .]" 1
794 1 1 DT H1' 1 2 DG H5' 4.000 . 4.500 2.702 2.659 2.740 . 0 0 "[ . 1 .]" 1
795 1 1 DT H6 1 2 DG H5' 5.500 . 6.000 5.928 5.904 5.944 . 0 0 "[ . 1 .]" 1
796 1 2 DG H5'' 1 3 DA H8 6.000 . 6.500 6.649 6.630 6.666 0.166 8 0 "[ . 1 .]" 1
797 1 2 DG H4' 1 2 DG H5'' 3.000 . 3.500 2.313 2.311 2.315 . 0 0 "[ . 1 .]" 1
798 1 2 DG H1' 1 2 DG H5'' 5.000 . 5.500 4.929 4.921 4.938 . 0 0 "[ . 1 .]" 1
799 1 2 DG H5'' 1 2 DG H8 6.000 . 6.500 5.203 5.181 5.225 . 0 0 "[ . 1 .]" 1
800 1 2 DG H2' 1 2 DG H5'' 5.000 . 5.500 4.187 4.167 4.205 . 0 0 "[ . 1 .]" 1
801 1 2 DG H2'' 1 2 DG H5'' 5.000 . 5.500 4.982 4.974 4.990 . 0 0 "[ . 1 .]" 1
802 1 1 DT H1' 1 2 DG H5'' 4.000 . 4.500 4.442 4.404 4.476 . 0 0 "[ . 1 .]" 1
803 1 1 DT H2' 1 2 DG H5'' 5.000 . 5.500 5.615 5.611 5.620 0.120 12 0 "[ . 1 .]" 1
804 1 1 DT H2'' 1 2 DG H5'' 5.000 . 5.500 3.927 3.922 3.932 . 0 0 "[ . 1 .]" 1
805 1 2 DG H1' 1 2 DG H4' 4.000 . 4.500 3.116 3.106 3.126 . 0 0 "[ . 1 .]" 1
806 1 2 DG H4' 1 2 DG H8 5.000 . 5.500 5.052 5.039 5.066 . 0 0 "[ . 1 .]" 1
807 1 1 DT H1' 1 2 DG H4' 4.000 . 4.500 4.352 4.329 4.387 . 0 0 "[ . 1 .]" 1
808 1 2 DG H1' 1 2 DG H8 4.000 . 4.500 3.893 3.891 3.894 . 0 0 "[ . 1 .]" 1
809 1 2 DG H1' 1 2 DG H2' 3.000 . 3.500 3.042 3.037 3.047 . 0 0 "[ . 1 .]" 1
810 1 2 DG H1' 1 2 DG H2'' 3.000 . 3.500 2.411 2.406 2.417 . 0 0 "[ . 1 .]" 1
811 1 2 DG H1' 1 3 DA Q2' 6.000 . 6.500 5.890 5.862 5.927 . 0 0 "[ . 1 .]" 1
812 1 2 DG H2' 1 2 DG H8 4.000 . 4.500 2.328 2.321 2.335 . 0 0 "[ . 1 .]" 1
813 1 2 DG H2'' 1 2 DG H8 4.000 . 4.500 3.707 3.687 3.727 . 0 0 "[ . 1 .]" 1
814 1 1 DT H5' 1 2 DG H8 4.500 . 5.000 5.058 5.047 5.068 0.068 5 0 "[ . 1 .]" 1
815 1 1 DT H4' 1 2 DG H8 5.500 . 6.000 5.810 5.794 5.822 . 0 0 "[ . 1 .]" 1
816 1 1 DT H1' 1 2 DG H8 4.500 . 5.000 3.736 3.683 3.781 . 0 0 "[ . 1 .]" 1
817 1 1 DT H2' 1 2 DG H8 4.000 . 4.500 2.279 2.257 2.298 . 0 0 "[ . 1 .]" 1
818 1 1 DT H2'' 1 2 DG H8 4.000 . 4.500 1.990 1.977 2.006 . 0 0 "[ . 1 .]" 1
819 1 1 DT H3' 1 2 DG H8 4.000 . 4.500 4.087 4.078 4.097 . 0 0 "[ . 1 .]" 1
820 1 1 DT H6 1 2 DG H8 5.000 . 5.500 4.198 4.108 4.256 . 0 0 "[ . 1 .]" 1
821 1 2 DG H2' 1 2 DG H4' 3.000 . 3.500 3.856 3.850 3.860 0.360 15 0 "[ . 1 .]" 1
822 1 2 DG H2' 1 2 DG H2'' 2.500 . 3.000 1.754 1.752 1.756 0.048 7 0 "[ . 1 .]" 1
823 1 2 DG H2' 1 3 DA H5' 5.000 . 5.500 4.322 4.309 4.347 . 0 0 "[ . 1 .]" 1
824 1 2 DG H2' 1 3 DA H5'' 5.000 . 5.500 5.632 5.620 5.651 0.151 7 0 "[ . 1 .]" 1
825 1 2 DG H2'' 1 2 DG H4' 4.000 . 4.500 3.936 3.926 3.948 . 0 0 "[ . 1 .]" 1
826 1 2 DG H2'' 1 3 DA H5' 5.000 . 5.500 2.652 2.633 2.678 . 0 0 "[ . 1 .]" 1
827 1 2 DG H2'' 1 3 DA H5'' 5.000 . 5.500 3.932 3.919 3.956 . 0 0 "[ . 1 .]" 1
828 1 2 DG H3' 1 3 DA H8 5.000 . 5.500 3.966 3.938 3.990 . 0 0 "[ . 1 .]" 1
829 1 2 DG H3' 1 2 DG H5' 3.000 . 3.500 3.631 3.629 3.634 0.134 3 0 "[ . 1 .]" 1
830 1 2 DG H3' 1 2 DG H5'' 3.000 . 3.500 2.684 2.677 2.693 . 0 0 "[ . 1 .]" 1
831 1 2 DG H3' 1 2 DG H4' 3.000 . 3.500 2.763 2.759 2.766 . 0 0 "[ . 1 .]" 1
832 1 2 DG H1' 1 2 DG H3' 4.000 . 4.500 3.827 3.813 3.839 . 0 0 "[ . 1 .]" 1
833 1 2 DG H3' 1 2 DG H8 5.000 . 5.500 4.381 4.358 4.411 . 0 0 "[ . 1 .]" 1
834 1 2 DG H2' 1 2 DG H3' 3.000 . 3.500 2.361 2.358 2.364 . 0 0 "[ . 1 .]" 1
835 1 2 DG H2'' 1 2 DG H3' 3.000 . 3.500 2.727 2.721 2.732 . 0 0 "[ . 1 .]" 1
836 1 1 DT H1' 1 2 DG H3' 5.000 . 5.500 5.525 5.511 5.536 0.036 13 0 "[ . 1 .]" 1
837 1 1 DT H2' 1 2 DG H3' 5.000 . 5.500 5.787 5.767 5.796 0.296 9 0 "[ . 1 .]" 1
838 1 1 DT H4' 1 1 DT H5' 3.000 . 3.500 2.984 2.979 2.991 . 0 0 "[ . 1 .]" 1
839 1 1 DT H1' 1 1 DT H5' 5.000 . 5.500 4.351 4.336 4.363 . 0 0 "[ . 1 .]" 1
840 1 1 DT H5' 1 1 DT H6 4.000 . 4.500 2.086 2.042 2.129 . 0 0 "[ . 1 .]" 1
841 1 1 DT H2' 1 1 DT H5' 4.000 . 4.500 2.787 2.773 2.801 . 0 0 "[ . 1 .]" 1
842 1 1 DT H2'' 1 1 DT H5' 5.000 . 5.500 4.091 4.084 4.102 . 0 0 "[ . 1 .]" 1
843 1 1 DT H3' 1 1 DT H5' 3.000 . 3.500 2.491 2.466 2.523 . 0 0 "[ . 1 .]" 1
844 1 1 DT H1' 1 1 DT H4' 3.000 . 3.500 3.591 3.575 3.612 0.112 10 0 "[ . 1 .]" 1
845 1 1 DT H4' 1 1 DT H6 4.000 . 4.500 4.189 4.161 4.217 . 0 0 "[ . 1 .]" 1
846 1 1 DT H2' 1 1 DT H4' 4.000 . 4.500 3.940 3.934 3.945 . 0 0 "[ . 1 .]" 1
847 1 1 DT H2'' 1 1 DT H4' 4.000 . 4.500 3.992 3.987 3.997 . 0 0 "[ . 1 .]" 1
848 1 1 DT H3' 1 1 DT H4' 3.000 . 3.500 2.694 2.691 2.696 . 0 0 "[ . 1 .]" 1
849 1 1 DT H1' 1 1 DT M7 5.000 . 5.500 5.164 5.161 5.166 . 0 0 "[ . 1 .]" 1
850 1 1 DT H1' 1 1 DT H6 3.000 . 3.500 3.683 3.681 3.684 0.184 5 0 "[ . 1 .]" 1
851 1 1 DT H1' 1 1 DT H2' 3.000 . 3.500 2.999 2.992 3.006 . 0 0 "[ . 1 .]" 1
852 1 1 DT H1' 1 1 DT H2'' 3.000 . 3.500 2.344 2.340 2.347 . 0 0 "[ . 1 .]" 1
853 1 1 DT H1' 1 1 DT H3' 4.000 . 4.500 3.993 3.984 4.003 . 0 0 "[ . 1 .]" 1
854 1 1 DT H5' 1 1 DT M7 5.000 . 5.500 3.496 3.446 3.536 . 0 0 "[ . 1 .]" 1
855 1 1 DT H4' 1 1 DT M7 5.000 . 5.500 5.699 5.678 5.723 0.223 8 0 "[ . 1 .]" 1
856 1 1 DT H6 1 1 DT M7 3.000 . 3.500 2.301 2.285 2.358 . 0 0 "[ . 1 .]" 1
857 1 1 DT M7 1 3 DA H2 5.500 . 6.000 5.301 5.082 5.436 . 0 0 "[ . 1 .]" 1
858 1 1 DT H2' 1 1 DT H6 3.000 . 3.500 2.305 2.252 2.365 . 0 0 "[ . 1 .]" 1
859 1 1 DT H2'' 1 1 DT H6 4.000 . 4.500 3.782 3.744 3.823 . 0 0 "[ . 1 .]" 1
860 1 1 DT H3' 1 1 DT H6 4.000 . 4.500 3.673 3.618 3.740 . 0 0 "[ . 1 .]" 1
861 1 1 DT H2' 1 2 DG H5' 4.000 . 4.500 4.372 4.359 4.386 . 0 0 "[ . 1 .]" 1
862 1 1 DT H2' 1 2 DG H4' 5.500 . 6.000 6.024 6.014 6.037 0.037 12 0 "[ . 1 .]" 1
863 1 1 DT H2' 1 1 DT H2'' 2.500 . 3.000 1.738 1.736 1.739 0.064 7 0 "[ . 1 .]" 1
864 1 1 DT H2' 1 1 DT H3' 4.000 . 4.500 2.360 2.358 2.364 . 0 0 "[ . 1 .]" 1
865 1 1 DT H2'' 1 2 DG H5' 4.000 . 4.500 2.787 2.777 2.794 . 0 0 "[ . 1 .]" 1
866 1 1 DT H2'' 1 2 DG H4' 4.000 . 4.500 4.348 4.342 4.357 . 0 0 "[ . 1 .]" 1
867 1 1 DT H2'' 1 2 DG H1' 4.000 . 4.500 4.446 4.430 4.460 . 0 0 "[ . 1 .]" 1
868 1 1 DT H2'' 1 1 DT H3' 3.000 . 3.500 2.748 2.744 2.752 . 0 0 "[ . 1 .]" 1
869 1 20 DT H6 1 20 DT M7 3.000 . 3.500 2.317 2.309 2.325 . 0 0 "[ . 1 .]" 1
870 1 12 DA H2 1 14 DG H8 5.000 . 5.500 5.572 4.774 5.816 0.316 7 0 "[ . 1 .]" 1
871 1 13 DG H5'' 1 14 DG H8 6.000 . 6.500 6.452 6.114 6.569 0.069 1 0 "[ . 1 .]" 1
872 1 3 DA H2 1 17 DG H1 5.000 . 5.500 4.121 3.727 4.583 . 0 0 "[ . 1 .]" 1
873 1 4 DG H8 1 17 DG H1 5.000 . 5.500 4.715 4.319 5.237 . 0 0 "[ . 1 .]" 1
874 1 5 DG H1 1 9 DG H8 5.000 . 5.500 5.232 5.000 5.490 . 0 0 "[ . 1 .]" 1
875 1 9 DG H1 1 14 DG H8 5.000 . 5.500 5.091 4.641 5.391 . 0 0 "[ . 1 .]" 1
876 1 5 DG H8 1 18 DG H1 5.000 . 5.500 5.339 5.130 5.522 0.022 7 0 "[ . 1 .]" 1
877 1 15 DG H1 1 19 DG H8 5.000 . 5.500 5.627 5.572 5.682 0.182 5 0 "[ . 1 .]" 1
878 1 10 DG H1 1 15 DG H8 5.000 . 5.500 5.043 4.916 5.244 . 0 0 "[ . 1 .]" 1
879 1 10 DG H1 1 14 DG H8 5.000 . 5.500 5.532 5.372 5.652 0.152 11 0 "[ . 1 .]" 1
880 1 6 DG H8 1 19 DG H1 5.000 . 5.500 5.221 5.067 5.393 . 0 0 "[ . 1 .]" 1
881 1 14 DG H1 1 18 DG H8 6.000 . 6.500 5.083 4.838 5.370 . 0 0 "[ . 1 .]" 1
882 1 6 DG H1 1 10 DG H8 5.000 . 5.500 5.561 5.500 5.643 0.143 5 0 "[ . 1 .]" 1
883 1 8 DG H1 1 13 DG H8 5.000 . 5.500 4.805 4.410 5.235 . 0 0 "[ . 1 .]" 1
884 1 13 DG H1 1 17 DG H8 5.000 . 5.500 5.142 4.432 5.599 0.099 5 0 "[ . 1 .]" 1
885 1 8 DG H1 1 13 DG H1 5.000 . 5.500 4.668 4.605 4.820 . 0 0 "[ . 1 .]" 1
886 1 13 DG H1 1 14 DG H1 3.000 . 3.500 3.522 3.431 3.604 0.104 14 0 "[ . 1 .]" 1
887 1 13 DG H1 1 17 DG H1 5.000 . 5.500 4.716 4.599 4.865 . 0 0 "[ . 1 .]" 1
888 1 4 DG H1 1 8 DG H1 5.000 . 5.500 4.669 4.564 4.792 . 0 0 "[ . 1 .]" 1
889 1 4 DG H1 1 17 DG H1 5.000 . 5.500 4.658 4.612 4.754 . 0 0 "[ . 1 .]" 1
890 1 4 DG H1 1 5 DG H1 3.000 . 3.500 3.575 3.527 3.657 0.157 7 0 "[ . 1 .]" 1
891 1 8 DG H1 1 9 DG H1 3.000 . 3.500 3.596 3.418 3.737 0.237 7 0 "[ . 1 .]" 1
892 1 5 DG H1 1 9 DG H1 5.000 . 5.500 4.685 4.620 4.780 . 0 0 "[ . 1 .]" 1
893 1 9 DG H1 1 14 DG H1 5.000 . 5.500 4.727 4.634 4.854 . 0 0 "[ . 1 .]" 1
894 1 9 DG H1 1 10 DG H1 3.000 . 3.500 3.734 3.635 3.827 0.327 1 0 "[ . 1 .]" 1
895 1 6 DG H1 1 9 DG H1 5.000 . 5.500 4.988 4.794 5.240 . 0 0 "[ . 1 .]" 1
896 1 17 DG H1 1 18 DG H1 3.000 . 3.500 3.530 3.352 3.639 0.139 11 0 "[ . 1 .]" 1
897 1 5 DG H1 1 18 DG H1 5.000 . 5.500 4.613 4.552 4.651 . 0 0 "[ . 1 .]" 1
898 1 15 DG H1 1 18 DG H1 5.000 . 5.500 4.298 4.151 4.535 . 0 0 "[ . 1 .]" 1
899 1 18 DG H1 1 19 DG H1 3.000 . 3.500 3.638 3.596 3.675 0.175 7 0 "[ . 1 .]" 1
900 1 5 DG H1 1 6 DG H1 3.000 . 3.500 3.648 3.557 3.709 0.209 2 0 "[ . 1 .]" 1
901 1 14 DG H1 1 15 DG H1 3.000 . 3.500 3.629 3.587 3.679 0.179 7 0 "[ . 1 .]" 1
902 1 10 DG H1 1 14 DG H1 5.000 . 5.500 5.003 4.704 5.195 . 0 0 "[ . 1 .]" 1
903 1 14 DG H1 1 18 DG H1 5.000 . 5.500 4.626 4.606 4.644 . 0 0 "[ . 1 .]" 1
904 1 6 DG H1 1 10 DG H1 5.000 . 5.500 4.595 4.558 4.625 . 0 0 "[ . 1 .]" 1
905 1 10 DG H1 1 15 DG H1 5.000 . 5.500 4.609 4.575 4.627 . 0 0 "[ . 1 .]" 1
906 1 15 DG H1 1 19 DG H1 5.000 . 5.500 4.525 4.514 4.537 . 0 0 "[ . 1 .]" 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 54
_Distance_constraint_stats_list.Viol_count 780
_Distance_constraint_stats_list.Viol_total 1385.530
_Distance_constraint_stats_list.Viol_max 0.389
_Distance_constraint_stats_list.Viol_rms 0.0657
_Distance_constraint_stats_list.Viol_average_all_restraints 0.1140
_Distance_constraint_stats_list.Viol_average_violations_only 0.1184
_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 4 DG 12.323 0.238 14 0 "[ . 1 .]"
1 5 DG 17.589 0.214 7 0 "[ . 1 .]"
1 6 DG 11.795 0.192 15 0 "[ . 1 .]"
1 8 DG 15.929 0.275 15 0 "[ . 1 .]"
1 9 DG 21.489 0.389 3 0 "[ . 1 .]"
1 10 DG 11.388 0.180 10 0 "[ . 1 .]"
1 13 DG 18.729 0.389 3 0 "[ . 1 .]"
1 14 DG 20.321 0.322 4 0 "[ . 1 .]"
1 15 DG 11.614 0.201 1 0 "[ . 1 .]"
1 17 DG 17.950 0.322 4 0 "[ . 1 .]"
1 18 DG 13.593 0.214 7 0 "[ . 1 .]"
1 19 DG 12.021 0.201 1 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 10 DG N2 1 15 DG N7 2.870 2.670 3.070 3.219 3.198 3.230 0.160 10 0 "[ . 1 .]" 2
2 1 10 DG H21 1 15 DG N7 1.860 . 2.060 2.221 2.201 2.240 0.180 10 0 "[ . 1 .]" 2
3 1 10 DG H1 1 15 DG O6 1.860 . 2.060 2.132 2.115 2.141 0.081 13 0 "[ . 1 .]" 2
4 1 10 DG N1 1 15 DG O6 2.870 2.670 3.070 3.075 3.051 3.097 0.027 12 0 "[ . 1 .]" 2
5 1 6 DG N2 1 10 DG N7 2.870 2.670 3.070 3.114 3.081 3.154 0.084 12 0 "[ . 1 .]" 2
6 1 6 DG H21 1 10 DG N7 1.860 . 2.060 2.201 2.189 2.217 0.157 12 0 "[ . 1 .]" 2
7 1 6 DG H1 1 10 DG O6 1.860 . 2.060 2.153 2.144 2.168 0.108 11 0 "[ . 1 .]" 2
8 1 6 DG N1 1 10 DG O6 2.870 2.670 3.070 3.162 3.152 3.180 0.110 11 0 "[ . 1 .]" 2
9 1 6 DG N7 1 19 DG N2 2.870 2.670 3.070 3.232 3.211 3.245 0.175 5 0 "[ . 1 .]" 2
10 1 6 DG N7 1 19 DG H21 1.860 . 2.060 2.241 2.226 2.252 0.192 15 0 "[ . 1 .]" 2
11 1 6 DG O6 1 19 DG H1 1.860 . 2.060 2.123 2.107 2.141 0.081 12 0 "[ . 1 .]" 2
12 1 6 DG O6 1 19 DG N1 2.870 2.670 3.070 3.079 3.060 3.115 0.045 12 0 "[ . 1 .]" 2
13 1 15 DG N2 1 19 DG N7 2.870 2.670 3.070 3.161 3.126 3.190 0.120 1 0 "[ . 1 .]" 2
14 1 15 DG H21 1 19 DG N7 1.860 . 2.060 2.244 2.228 2.261 0.201 1 0 "[ . 1 .]" 2
15 1 15 DG H1 1 19 DG O6 1.860 . 2.060 2.118 2.113 2.123 0.063 6 0 "[ . 1 .]" 2
16 1 15 DG N1 1 19 DG O6 2.870 2.670 3.070 3.122 3.117 3.130 0.060 6 0 "[ . 1 .]" 2
17 1 9 DG N2 1 14 DG N7 2.870 2.670 3.070 3.193 3.131 3.241 0.171 11 0 "[ . 1 .]" 2
18 1 9 DG H21 1 14 DG N7 1.860 . 2.060 2.206 2.147 2.244 0.184 11 0 "[ . 1 .]" 2
19 1 9 DG H1 1 14 DG O6 1.860 . 2.060 2.225 2.152 2.348 0.288 1 0 "[ . 1 .]" 2
20 1 9 DG N1 1 14 DG O6 2.870 2.670 3.070 3.198 3.114 3.299 0.229 10 0 "[ . 1 .]" 2
21 1 5 DG N2 1 9 DG N7 2.870 2.670 3.070 3.201 3.158 3.246 0.176 10 0 "[ . 1 .]" 2
22 1 5 DG H21 1 9 DG N7 1.860 . 2.060 2.218 2.184 2.261 0.201 10 0 "[ . 1 .]" 2
23 1 5 DG H1 1 9 DG O6 1.860 . 2.060 2.190 2.143 2.263 0.203 1 0 "[ . 1 .]" 2
24 1 5 DG N1 1 9 DG O6 2.870 2.670 3.070 3.176 3.130 3.240 0.170 1 0 "[ . 1 .]" 2
25 1 5 DG N7 1 18 DG N2 2.870 2.670 3.070 3.224 3.201 3.240 0.170 8 0 "[ . 1 .]" 2
26 1 5 DG N7 1 18 DG H21 1.860 . 2.060 2.245 2.230 2.274 0.214 7 0 "[ . 1 .]" 2
27 1 5 DG O6 1 18 DG H1 1.860 . 2.060 2.141 2.115 2.158 0.098 11 0 "[ . 1 .]" 2
28 1 5 DG O6 1 18 DG N1 2.870 2.670 3.070 3.126 3.103 3.139 0.069 14 0 "[ . 1 .]" 2
29 1 14 DG N2 1 18 DG N7 2.870 2.670 3.070 3.215 3.160 3.245 0.175 3 0 "[ . 1 .]" 2
30 1 14 DG H21 1 18 DG N7 1.860 . 2.060 2.226 2.204 2.244 0.184 3 0 "[ . 1 .]" 2
31 1 14 DG H1 1 18 DG O6 1.860 . 2.060 2.146 2.139 2.155 0.095 5 0 "[ . 1 .]" 2
32 1 14 DG N1 1 18 DG O6 2.870 2.670 3.070 3.103 3.059 3.145 0.075 11 0 "[ . 1 .]" 2
33 1 8 DG N2 1 13 DG N7 2.870 2.670 3.070 3.198 3.156 3.227 0.157 5 0 "[ . 1 .]" 2
34 1 8 DG H21 1 13 DG N7 1.860 . 2.060 2.206 2.176 2.232 0.172 1 0 "[ . 1 .]" 2
35 1 8 DG H1 1 13 DG O6 1.860 . 2.060 2.181 2.131 2.335 0.275 15 0 "[ . 1 .]" 2
36 1 8 DG N1 1 13 DG O6 2.870 2.670 3.070 3.084 2.963 3.234 0.164 9 0 "[ . 1 .]" 2
37 1 4 DG N2 1 8 DG N7 2.870 2.670 3.070 3.137 3.086 3.178 0.108 1 0 "[ . 1 .]" 2
38 1 4 DG H21 1 8 DG N7 1.860 . 2.060 2.191 2.155 2.224 0.164 12 0 "[ . 1 .]" 2
39 1 4 DG H1 1 8 DG O6 1.860 . 2.060 2.202 2.144 2.298 0.238 14 0 "[ . 1 .]" 2
40 1 4 DG N1 1 8 DG O6 2.870 2.670 3.070 3.178 3.144 3.271 0.201 11 0 "[ . 1 .]" 2
41 1 4 DG N7 1 17 DG N2 2.870 2.670 3.070 3.172 3.129 3.196 0.126 2 0 "[ . 1 .]" 2
42 1 4 DG N7 1 17 DG H21 1.860 . 2.060 2.188 2.163 2.203 0.143 3 0 "[ . 1 .]" 2
43 1 4 DG O6 1 17 DG H1 1.860 . 2.060 2.178 2.139 2.296 0.236 15 0 "[ . 1 .]" 2
44 1 4 DG O6 1 17 DG N1 2.870 2.670 3.070 3.059 2.942 3.158 0.088 7 0 "[ . 1 .]" 2
45 1 13 DG N2 1 17 DG N7 2.870 2.670 3.070 3.103 2.992 3.186 0.116 10 0 "[ . 1 .]" 2
46 1 13 DG H21 1 17 DG N7 1.860 . 2.060 2.163 2.127 2.191 0.131 10 0 "[ . 1 .]" 2
47 1 13 DG H1 1 17 DG O6 1.860 . 2.060 2.236 2.160 2.371 0.311 15 0 "[ . 1 .]" 2
48 1 13 DG N1 1 17 DG O6 2.870 2.670 3.070 3.208 3.153 3.274 0.204 15 0 "[ . 1 .]" 2
49 1 9 DG N2 1 13 DG OP1 2.870 2.670 3.070 3.065 2.852 3.213 0.143 12 0 "[ . 1 .]" 2
50 1 9 DG H22 1 13 DG OP1 1.860 . 2.060 2.372 2.265 2.449 0.389 3 0 "[ . 1 .]" 2
51 1 14 DG N2 1 17 DG OP1 2.870 2.670 3.070 3.188 3.108 3.264 0.194 7 0 "[ . 1 .]" 2
52 1 14 DG H22 1 17 DG OP1 1.860 . 2.060 2.305 2.156 2.382 0.322 4 0 "[ . 1 .]" 2
53 1 5 DG N2 1 8 DG OP1 2.870 2.670 3.070 3.112 3.071 3.146 0.076 15 0 "[ . 1 .]" 2
54 1 5 DG H22 1 8 DG OP1 1.860 . 2.060 2.191 2.139 2.249 0.189 15 0 "[ . 1 .]" 2
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