NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
397186 |
1ssj   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1ssj
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 377
_Distance_constraint_stats_list.Viol_count 1158
_Distance_constraint_stats_list.Viol_total 1687.157
_Distance_constraint_stats_list.Viol_max 1.299
_Distance_constraint_stats_list.Viol_rms 0.0970
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0448
_Distance_constraint_stats_list.Viol_average_violations_only 0.1457
_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 DC 3.420 0.210 3 0 "[ . 1]"
1 2 DC 11.620 0.362 3 0 "[ . 1]"
1 3 DA 34.482 0.557 10 9 "[** **-***+]"
1 4 DC 23.376 0.532 5 2 "[ + -]"
1 5 HOB 12.454 1.299 3 1 "[ + . 1]"
1 6 DG 4.648 0.541 7 1 "[ . + 1]"
1 7 DG 8.961 0.286 7 0 "[ . 1]"
1 8 DA 14.204 0.367 6 0 "[ . 1]"
1 9 DA 17.783 0.359 10 0 "[ . 1]"
1 10 DC 19.261 0.331 1 0 "[ . 1]"
2 1 DG 8.353 0.256 2 0 "[ . 1]"
2 2 DT 11.219 0.331 5 0 "[ . 1]"
2 3 DT 6.595 0.294 5 0 "[ . 1]"
2 4 DC 7.857 0.286 7 0 "[ . 1]"
2 5 DC 13.091 1.299 3 1 "[ + . 1]"
2 6 DG 8.796 0.454 9 0 "[ . 1]"
2 7 DG 11.601 0.509 7 1 "[ . + 1]"
2 8 DT 13.618 0.573 5 5 "[ * +*- *1]"
2 9 DG 20.280 0.573 5 5 "[ * +*- *1]"
2 10 DG 6.499 0.269 6 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 DC H1' 1 1 DC H2' . . 3.600 2.995 2.964 3.009 . 0 0 "[ . 1]" 1
2 1 1 DC H1' 1 1 DC H2'' . . 2.690 2.252 2.211 2.278 . 0 0 "[ . 1]" 1
3 1 1 DC H1' 1 1 DC H3' . . 4.290 3.954 3.898 3.996 . 0 0 "[ . 1]" 1
4 1 1 DC H1' 1 1 DC H4' . . 3.540 3.404 3.176 3.560 0.020 2 0 "[ . 1]" 1
5 1 1 DC H1' 1 2 DC H6 . . 4.270 4.336 4.281 4.382 0.112 7 0 "[ . 1]" 1
6 1 1 DC H2' 1 1 DC H3' . . 2.710 2.302 2.279 2.336 . 0 0 "[ . 1]" 1
7 1 1 DC H2' 1 1 DC H6 . . 2.840 2.658 2.433 2.809 . 0 0 "[ . 1]" 1
8 1 1 DC H2' 1 2 DC H5 . . 3.070 2.506 2.469 2.600 . 0 0 "[ . 1]" 1
9 1 1 DC H2'' 1 1 DC H3' . . 3.830 2.846 2.828 2.878 . 0 0 "[ . 1]" 1
10 1 1 DC H2'' 1 2 DC H5 . . 4.330 3.477 3.411 3.634 . 0 0 "[ . 1]" 1
11 1 1 DC H3' 1 1 DC H4' . . 3.050 2.787 2.722 2.838 . 0 0 "[ . 1]" 1
12 1 1 DC H3' 1 2 DC H5 . . 4.360 4.429 4.245 4.483 0.123 3 0 "[ . 1]" 1
13 1 1 DC H3' 1 2 DC H6 . . 3.970 3.960 3.737 4.039 0.069 8 0 "[ . 1]" 1
14 1 1 DC H4' 1 1 DC H6 . . 3.960 4.115 4.057 4.170 0.210 3 0 "[ . 1]" 1
15 1 1 DC H42 1 2 DC H41 . . 4.000 3.456 3.073 3.736 . 0 0 "[ . 1]" 1
16 1 1 DC H5 1 2 DC H41 . . 5.000 4.324 3.909 4.656 . 0 0 "[ . 1]" 1
17 1 1 DC H6 1 2 DC H5 . . 3.970 3.936 3.734 4.032 0.062 8 0 "[ . 1]" 1
18 1 2 DC H1' 1 2 DC H2' . . 4.070 3.012 3.003 3.020 . 0 0 "[ . 1]" 1
19 1 2 DC H1' 1 2 DC H2'' . . 2.620 2.306 2.289 2.318 . 0 0 "[ . 1]" 1
20 1 2 DC H1' 1 2 DC H3' . . 4.340 3.833 3.816 3.856 . 0 0 "[ . 1]" 1
21 1 2 DC H1' 1 2 DC H4' . . 3.170 3.237 3.196 3.329 0.159 7 0 "[ . 1]" 1
22 1 2 DC H1' 1 2 DC H6 . . 3.870 3.738 3.720 3.757 . 0 0 "[ . 1]" 1
23 1 2 DC H1' 1 3 DA H2' . . 4.500 3.768 3.726 3.793 . 0 0 "[ . 1]" 1
24 1 2 DC H1' 1 3 DA H2'' . . 5.000 5.304 5.271 5.362 0.362 3 0 "[ . 1]" 1
25 1 2 DC H1' 1 3 DA H4' . . 5.030 4.527 4.429 4.652 . 0 0 "[ . 1]" 1
26 1 2 DC H1' 1 3 DA H8 . . 3.740 3.849 3.790 3.896 0.156 1 0 "[ . 1]" 1
27 1 2 DC H2' 1 2 DC H3' . . 2.580 2.224 2.177 2.264 . 0 0 "[ . 1]" 1
28 1 2 DC H2' 1 2 DC H6 . . 2.440 2.151 2.080 2.198 . 0 0 "[ . 1]" 1
29 1 2 DC H2' 1 3 DA H8 . . 3.620 3.274 3.180 3.364 . 0 0 "[ . 1]" 1
30 1 2 DC H2'' 1 2 DC H6 . . 3.800 3.637 3.548 3.695 . 0 0 "[ . 1]" 1
31 1 2 DC H2'' 1 3 DA H8 . . 3.360 2.701 2.640 2.749 . 0 0 "[ . 1]" 1
32 1 2 DC H3' 1 2 DC H6 . . 4.000 3.888 3.766 3.964 . 0 0 "[ . 1]" 1
33 1 2 DC H3' 1 3 DA H8 . . 5.000 5.101 5.027 5.149 0.149 6 0 "[ . 1]" 1
34 1 2 DC H4' 1 2 DC H6 . . 4.620 4.674 4.613 4.746 0.126 2 0 "[ . 1]" 1
35 1 2 DC H41 2 9 DG H1 . . 3.000 1.958 1.904 2.041 . 0 0 "[ . 1]" 1
36 1 2 DC H42 2 8 DT H3 . . 5.000 5.129 5.078 5.221 0.221 6 0 "[ . 1]" 1
37 1 2 DC H42 2 9 DG H1 . . 3.500 3.488 3.411 3.556 0.056 3 0 "[ . 1]" 1
38 1 2 DC H5 2 9 DG H1 . . 4.500 4.702 4.631 4.741 0.241 3 0 "[ . 1]" 1
39 1 2 DC H6 1 3 DA H8 . . 4.850 4.165 3.965 4.355 . 0 0 "[ . 1]" 1
40 1 3 DA H1' 1 3 DA H2 . . 4.500 4.400 4.339 4.490 . 0 0 "[ . 1]" 1
41 1 3 DA H1' 1 3 DA H2' . . 3.430 3.117 3.103 3.128 . 0 0 "[ . 1]" 1
42 1 3 DA H1' 1 3 DA H2'' . . 2.740 2.533 2.489 2.572 . 0 0 "[ . 1]" 1
43 1 3 DA H1' 1 3 DA H3' . . 3.550 3.748 3.712 3.830 0.280 2 0 "[ . 1]" 1
44 1 3 DA H1' 1 3 DA H4' . . 3.310 2.736 2.682 2.800 . 0 0 "[ . 1]" 1
45 1 3 DA H1' 1 3 DA H8 . . 3.940 3.541 3.518 3.563 . 0 0 "[ . 1]" 1
46 1 3 DA H1' 1 4 DC H2'' . . 5.000 5.220 5.172 5.284 0.284 3 0 "[ . 1]" 1
47 1 3 DA H1' 1 4 DC H41 . . 5.000 5.404 5.330 5.457 0.457 1 0 "[ . 1]" 1
48 1 3 DA H1' 1 4 DC H6 . . 4.100 2.678 2.615 2.716 . 0 0 "[ . 1]" 1
49 1 3 DA H2 1 4 DC H1' . . 3.910 4.093 3.998 4.156 0.246 6 0 "[ . 1]" 1
50 1 3 DA H2 1 4 DC H5 . . 5.000 5.429 5.336 5.514 0.514 10 1 "[ . +]" 1
51 1 3 DA H2 2 7 DG H1 . . 5.000 3.486 3.300 3.639 . 0 0 "[ . 1]" 1
52 1 3 DA H2 2 8 DT H1' . . 4.690 4.824 4.785 4.872 0.182 1 0 "[ . 1]" 1
53 1 3 DA H2 2 8 DT H3 . . 3.000 2.845 2.723 2.985 . 0 0 "[ . 1]" 1
54 1 3 DA H2 2 9 DG H1 . . 4.000 4.142 4.089 4.195 0.195 10 0 "[ . 1]" 1
55 1 3 DA H2 2 9 DG H1' . . 4.780 4.884 4.758 4.962 0.182 5 0 "[ . 1]" 1
56 1 3 DA H2' 1 3 DA H4' . . 3.670 3.698 3.666 3.737 0.067 2 0 "[ . 1]" 1
57 1 3 DA H2' 1 3 DA H8 . . 2.570 2.050 2.018 2.088 . 0 0 "[ . 1]" 1
58 1 3 DA H2' 1 4 DC H5 . . 4.310 4.218 4.152 4.315 0.005 5 0 "[ . 1]" 1
59 1 3 DA H2' 1 4 DC H6 . . 4.430 4.308 4.256 4.355 . 0 0 "[ . 1]" 1
60 1 3 DA H2'' 1 3 DA H3' . . 3.090 2.615 2.582 2.703 . 0 0 "[ . 1]" 1
61 1 3 DA H2'' 1 3 DA H4' . . 3.840 3.826 3.723 3.887 0.047 3 0 "[ . 1]" 1
62 1 3 DA H2'' 1 3 DA H8 . . 3.770 2.848 2.773 2.911 . 0 0 "[ . 1]" 1
63 1 3 DA H2'' 1 4 DC H5 . . 4.000 3.106 3.018 3.271 . 0 0 "[ . 1]" 1
64 1 3 DA H2'' 1 4 DC H6 . . 3.430 2.708 2.655 2.746 . 0 0 "[ . 1]" 1
65 1 3 DA H3' 1 3 DA H8 . . 4.190 4.274 4.167 4.337 0.147 10 0 "[ . 1]" 1
66 1 3 DA H3' 1 4 DC H6 . . 5.060 4.786 4.635 5.079 0.019 2 0 "[ . 1]" 1
67 1 3 DA H4' 1 3 DA H8 . . 4.500 5.032 4.984 5.057 0.557 10 9 "[** **-***+]" 1
68 1 3 DA H8 1 4 DC H42 . . 5.000 4.236 4.028 4.494 . 0 0 "[ . 1]" 1
69 1 3 DA H8 1 4 DC H5 . . 4.380 3.551 3.454 3.697 . 0 0 "[ . 1]" 1
70 1 3 DA H8 1 4 DC H6 . . 4.240 4.697 4.656 4.772 0.532 5 1 "[ + 1]" 1
71 1 4 DC H1' 1 4 DC H2' . . 3.310 3.093 3.082 3.101 . 0 0 "[ . 1]" 1
72 1 4 DC H1' 1 4 DC H2'' . . 2.600 2.467 2.439 2.491 . 0 0 "[ . 1]" 1
73 1 4 DC H1' 1 4 DC H3' . . 4.760 3.786 3.718 3.821 . 0 0 "[ . 1]" 1
74 1 4 DC H1' 1 4 DC H4' . . 2.830 2.719 2.539 2.919 0.089 2 0 "[ . 1]" 1
75 1 4 DC H1' 1 4 DC H5 . . 5.500 5.396 5.367 5.413 . 0 0 "[ . 1]" 1
76 1 4 DC H1' 1 4 DC H6 . . 4.340 3.811 3.776 3.829 . 0 0 "[ . 1]" 1
77 1 4 DC H1' 1 5 HOB C15 . . 5.000 5.261 4.941 5.460 0.460 7 0 "[ . 1]" 1
78 1 4 DC H2' 1 4 DC H3' . . 4.680 2.331 2.270 2.409 . 0 0 "[ . 1]" 1
79 1 4 DC H2' 1 4 DC H5 . . 4.610 4.602 4.555 4.651 0.041 10 0 "[ . 1]" 1
80 1 4 DC H2' 1 4 DC H6 . . 4.180 2.325 2.288 2.407 . 0 0 "[ . 1]" 1
81 1 4 DC H2'' 1 4 DC H3' . . 3.490 2.775 2.748 2.818 . 0 0 "[ . 1]" 1
82 1 4 DC H2'' 1 4 DC H6 . . 3.500 3.570 3.402 3.703 0.203 2 0 "[ . 1]" 1
83 1 4 DC H4' 1 4 DC H6 . . 4.880 4.885 4.689 4.993 0.113 10 0 "[ . 1]" 1
84 1 4 DC H41 2 7 DG H1 . . 3.500 2.170 1.974 2.352 . 0 0 "[ . 1]" 1
85 1 4 DC H41 2 8 DT H3 . . 4.000 3.748 3.579 3.932 . 0 0 "[ . 1]" 1
86 1 4 DC H42 2 7 DG H1 . . 4.000 3.721 3.532 3.922 . 0 0 "[ . 1]" 1
87 1 4 DC H5 1 5 HOB C15 . . 5.000 5.215 4.851 5.415 0.415 4 0 "[ . 1]" 1
88 1 4 DC H5 1 5 HOB H101 . . 5.000 4.040 3.586 4.318 . 0 0 "[ . 1]" 1
89 1 4 DC H5 1 5 HOB H102 . . 5.000 3.170 2.906 3.397 . 0 0 "[ . 1]" 1
90 1 4 DC H5 2 7 DG H1 . . 5.500 4.803 4.697 4.943 . 0 0 "[ . 1]" 1
91 1 4 DC H6 1 5 HOB C15 . . 6.000 5.465 5.118 5.685 . 0 0 "[ . 1]" 1
92 1 5 HOB C15 1 6 DG H8 . . 6.000 5.910 5.843 5.986 . 0 0 "[ . 1]" 1
93 1 5 HOB C24 2 6 DG H1' . . 6.000 4.582 4.012 5.055 . 0 0 "[ . 1]" 1
94 1 5 HOB C24 2 6 DG H4' . . 6.000 5.640 4.971 6.186 0.186 10 0 "[ . 1]" 1
95 1 5 HOB C24 2 7 DG H4' . . 5.000 5.287 5.132 5.385 0.385 10 0 "[ . 1]" 1
96 1 5 HOB C29 2 7 DG H1' . . 5.000 4.777 3.975 5.002 0.002 9 0 "[ . 1]" 1
97 1 5 HOB H1' 1 5 HOB H2' . . 3.410 3.075 2.925 3.102 . 0 0 "[ . 1]" 1
98 1 5 HOB H1' 1 5 HOB H21 . . 4.000 3.519 3.338 3.719 . 0 0 "[ . 1]" 1
99 1 5 HOB H1' 1 5 HOB H3' . . 4.530 3.899 3.835 4.013 . 0 0 "[ . 1]" 1
100 1 5 HOB H1' 1 5 HOB H31 . . 4.000 3.908 2.767 4.144 0.144 2 0 "[ . 1]" 1
101 1 5 HOB H1' 1 5 HOB H32 . . 4.000 3.791 3.381 4.082 0.082 8 0 "[ . 1]" 1
102 1 5 HOB H1' 1 5 HOB H41 . . 5.000 3.055 2.118 4.266 . 0 0 "[ . 1]" 1
103 1 5 HOB H1' 1 5 HOB H42 . . 5.000 4.070 3.666 4.221 . 0 0 "[ . 1]" 1
104 1 5 HOB H131 1 6 DG H8 . . 5.000 3.637 3.523 3.759 . 0 0 "[ . 1]" 1
105 1 5 HOB H141 1 6 DG H8 . . 5.000 4.035 2.602 4.590 . 0 0 "[ . 1]" 1
106 1 5 HOB H142 1 6 DG H8 . . 5.000 3.036 2.475 4.646 . 0 0 "[ . 1]" 1
107 1 5 HOB H2' 1 5 HOB H21 . . 4.000 3.634 3.183 4.036 0.036 1 0 "[ . 1]" 1
108 1 5 HOB H2' 1 5 HOB H22 . . 4.000 3.369 2.206 3.974 . 0 0 "[ . 1]" 1
109 1 5 HOB H2' 1 5 HOB H3' . . 3.260 2.475 2.400 2.505 . 0 0 "[ . 1]" 1
110 1 5 HOB H21 1 5 HOB H5 . . 5.000 4.126 3.813 4.345 . 0 0 "[ . 1]" 1
111 1 5 HOB H21 1 6 DG H2' . . 4.000 3.743 3.489 4.029 0.029 5 0 "[ . 1]" 1
112 1 5 HOB H21 1 6 DG H2'' . . 4.000 4.054 3.929 4.114 0.114 4 0 "[ . 1]" 1
113 1 5 HOB H22 1 5 HOB H5 . . 5.000 2.780 2.372 3.230 . 0 0 "[ . 1]" 1
114 1 5 HOB H22 1 6 DG H2' . . 4.000 2.895 2.518 3.404 . 0 0 "[ . 1]" 1
115 1 5 HOB H22 1 6 DG H2'' . . 4.000 3.774 3.363 4.081 0.081 6 0 "[ . 1]" 1
116 1 5 HOB H261 2 5 DC H1' . . 6.000 4.256 3.908 4.862 . 0 0 "[ . 1]" 1
117 1 5 HOB H261 2 5 DC H2' . . 5.500 5.057 4.559 5.923 0.423 10 0 "[ . 1]" 1
118 1 5 HOB H261 2 5 DC H2'' . . 5.000 3.767 3.326 4.219 . 0 0 "[ . 1]" 1
119 1 5 HOB H261 2 6 DG H1' . . 5.500 3.114 2.504 3.654 . 0 0 "[ . 1]" 1
120 1 5 HOB H261 2 6 DG H3' . . 6.000 5.353 5.025 5.580 . 0 0 "[ . 1]" 1
121 1 5 HOB H261 2 6 DG H4' . . 5.000 3.089 2.634 3.374 . 0 0 "[ . 1]" 1
122 1 5 HOB H261 2 6 DG H5' . . 5.500 4.728 2.918 5.493 . 0 0 "[ . 1]" 1
123 1 5 HOB H261 2 6 DG H8 . . 5.500 5.292 4.733 5.632 0.132 10 0 "[ . 1]" 1
124 1 5 HOB H261 2 7 DG H1' . . 5.500 4.893 4.330 5.106 . 0 0 "[ . 1]" 1
125 1 5 HOB H261 2 7 DG H8 . . 5.000 4.379 3.860 4.615 . 0 0 "[ . 1]" 1
126 1 5 HOB H3' 1 6 DG H8 . . 4.950 4.990 4.631 5.133 0.183 8 0 "[ . 1]" 1
127 1 5 HOB H302 2 5 DC H1' . . 6.000 5.168 3.100 7.299 1.299 3 1 "[ + . 1]" 1
128 1 5 HOB H302 2 7 DG H1' . . 6.000 5.671 5.235 6.036 0.036 4 0 "[ . 1]" 1
129 1 5 HOB H31 1 5 HOB H5 . . 4.000 3.659 3.614 3.714 . 0 0 "[ . 1]" 1
130 1 5 HOB H41 1 5 HOB H5 . . 3.000 2.928 2.834 2.988 . 0 0 "[ . 1]" 1
131 1 5 HOB H42 1 5 HOB H5 . . 3.000 2.681 2.276 2.775 . 0 0 "[ . 1]" 1
132 1 5 HOB H9 1 6 DG H8 . . 5.000 3.750 3.275 4.146 . 0 0 "[ . 1]" 1
133 1 6 DG H1 2 5 DC H41 . . 5.000 2.322 2.053 2.592 . 0 0 "[ . 1]" 1
134 1 6 DG H1' 1 6 DG H2' . . 3.810 3.039 3.025 3.066 . 0 0 "[ . 1]" 1
135 1 6 DG H1' 1 6 DG H2'' . . 2.870 2.365 2.332 2.409 . 0 0 "[ . 1]" 1
136 1 6 DG H1' 1 6 DG H3' . . 4.440 3.938 3.868 3.983 . 0 0 "[ . 1]" 1
137 1 6 DG H1' 1 6 DG H4' . . 4.000 3.554 3.304 3.779 . 0 0 "[ . 1]" 1
138 1 6 DG H1' 1 6 DG H8 . . 4.020 3.757 3.553 3.831 . 0 0 "[ . 1]" 1
139 1 6 DG H1' 1 7 DG H8 . . 3.940 3.894 3.562 4.014 0.074 9 0 "[ . 1]" 1
140 1 6 DG H2'' 1 6 DG H3' . . 2.920 2.746 2.722 2.774 . 0 0 "[ . 1]" 1
141 1 6 DG H3' 1 6 DG H8 . . 4.330 4.106 3.902 4.215 . 0 0 "[ . 1]" 1
142 1 6 DG H4' 1 6 DG H8 . . 4.650 4.931 4.772 5.191 0.541 7 1 "[ . + 1]" 1
143 1 7 DG H1 1 8 DA H2 . . 3.500 3.581 3.524 3.661 0.161 6 0 "[ . 1]" 1
144 1 7 DG H1 2 3 DT H3 . . 4.000 3.948 3.794 4.076 0.076 4 0 "[ . 1]" 1
145 1 7 DG H1 2 4 DC H41 . . 4.000 2.023 1.961 2.104 . 0 0 "[ . 1]" 1
146 1 7 DG H1 2 4 DC H5 . . 4.500 4.742 4.695 4.786 0.286 7 0 "[ . 1]" 1
147 1 7 DG H1 2 5 DC H41 . . 5.000 3.966 3.739 4.122 . 0 0 "[ . 1]" 1
148 1 7 DG H1' 1 7 DG H2' . . 3.380 3.060 3.047 3.074 . 0 0 "[ . 1]" 1
149 1 7 DG H1' 1 7 DG H2'' . . 2.820 2.406 2.381 2.430 . 0 0 "[ . 1]" 1
150 1 7 DG H1' 1 7 DG H3' . . 4.030 3.824 3.763 3.872 . 0 0 "[ . 1]" 1
151 1 7 DG H1' 1 7 DG H4' . . 3.540 3.401 3.177 3.564 0.024 5 0 "[ . 1]" 1
152 1 7 DG H1' 1 7 DG H8 . . 4.370 3.760 3.731 3.786 . 0 0 "[ . 1]" 1
153 1 7 DG H1' 1 8 DA H8 . . 3.810 3.815 3.672 3.895 0.085 3 0 "[ . 1]" 1
154 1 7 DG H2' 1 7 DG H8 . . 2.490 2.271 2.228 2.356 . 0 0 "[ . 1]" 1
155 1 7 DG H2' 1 8 DA H8 . . 5.290 2.878 2.815 2.935 . 0 0 "[ . 1]" 1
156 1 7 DG H3' 1 7 DG H8 . . 4.110 4.187 4.131 4.245 0.135 3 0 "[ . 1]" 1
157 1 7 DG H4' 1 7 DG H8 . . 4.190 4.407 4.354 4.450 0.260 4 0 "[ . 1]" 1
158 1 7 DG H8 1 8 DA H8 . . 3.860 4.070 3.991 4.141 0.281 6 0 "[ . 1]" 1
159 1 8 DA H1' 1 8 DA H2' . . 2.910 3.011 2.982 3.027 0.117 7 0 "[ . 1]" 1
160 1 8 DA H1' 1 8 DA H2'' . . 2.550 2.409 2.329 2.489 . 0 0 "[ . 1]" 1
161 1 8 DA H1' 1 8 DA H3' . . 3.630 3.707 3.658 3.751 0.121 1 0 "[ . 1]" 1
162 1 8 DA H1' 1 8 DA H4' . . 3.050 2.719 2.528 2.990 . 0 0 "[ . 1]" 1
163 1 8 DA H1' 1 8 DA H8 . . 3.930 3.784 3.744 3.814 . 0 0 "[ . 1]" 1
164 1 8 DA H1' 1 9 DA H8 . . 3.590 3.540 3.071 3.819 0.229 1 0 "[ . 1]" 1
165 1 8 DA H2 1 9 DA H2 . . 3.000 3.198 3.119 3.265 0.265 6 0 "[ . 1]" 1
166 1 8 DA H2 2 2 DT H3 . . 5.000 4.802 4.415 5.010 0.010 8 0 "[ . 1]" 1
167 1 8 DA H2 2 3 DT H3 . . 3.000 2.464 2.318 2.581 . 0 0 "[ . 1]" 1
168 1 8 DA H2' 1 8 DA H4' . . 3.660 3.721 3.701 3.736 0.076 1 0 "[ . 1]" 1
169 1 8 DA H2' 1 9 DA H8 . . 3.860 4.062 3.912 4.219 0.359 10 0 "[ . 1]" 1
170 1 8 DA H2'' 1 8 DA H3' . . 2.960 2.714 2.684 2.743 . 0 0 "[ . 1]" 1
171 1 8 DA H2'' 1 8 DA H4' . . 4.400 3.849 3.792 3.946 . 0 0 "[ . 1]" 1
172 1 8 DA H2'' 1 8 DA H8 . . 3.910 3.620 3.555 3.700 . 0 0 "[ . 1]" 1
173 1 8 DA H2'' 1 9 DA H8 . . 3.210 2.518 2.453 2.594 . 0 0 "[ . 1]" 1
174 1 8 DA H3' 1 8 DA H8 . . 4.260 4.321 4.265 4.424 0.164 4 0 "[ . 1]" 1
175 1 8 DA H4' 1 8 DA H8 . . 4.420 4.727 4.671 4.787 0.367 6 0 "[ . 1]" 1
176 1 9 DA H1' 1 9 DA H2 . . 4.540 4.435 4.346 4.506 . 0 0 "[ . 1]" 1
177 1 9 DA H1' 1 9 DA H2'' . . 2.540 2.329 2.304 2.361 . 0 0 "[ . 1]" 1
178 1 9 DA H1' 1 9 DA H3' . . 3.570 3.722 3.698 3.753 0.183 8 0 "[ . 1]" 1
179 1 9 DA H1' 1 9 DA H4' . . 3.540 3.489 3.381 3.568 0.028 1 0 "[ . 1]" 1
180 1 9 DA H1' 1 9 DA H8 . . 4.490 3.811 3.782 3.852 . 0 0 "[ . 1]" 1
181 1 9 DA H1' 1 10 DC H5 . . 4.480 4.673 4.627 4.743 0.263 7 0 "[ . 1]" 1
182 1 9 DA H1' 1 10 DC H6 . . 3.880 3.489 3.285 3.732 . 0 0 "[ . 1]" 1
183 1 9 DA H1' 2 3 DT H3 . . 6.000 6.041 6.003 6.095 0.095 6 0 "[ . 1]" 1
184 1 9 DA H2 1 10 DC H1' . . 4.070 3.326 3.264 3.408 . 0 0 "[ . 1]" 1
185 1 9 DA H2 1 10 DC H2'' . . 5.170 5.435 5.398 5.494 0.324 4 0 "[ . 1]" 1
186 1 9 DA H2 1 10 DC H4' . . 4.940 4.536 4.304 5.056 0.116 7 0 "[ . 1]" 1
187 1 9 DA H2 2 1 DG H1 . . 5.000 4.712 4.467 4.945 . 0 0 "[ . 1]" 1
188 1 9 DA H2 2 2 DT H3 . . 3.000 2.820 2.657 3.006 0.006 6 0 "[ . 1]" 1
189 1 9 DA H2 2 3 DT H3 . . 3.500 2.937 2.718 3.391 . 0 0 "[ . 1]" 1
190 1 9 DA H2' 1 9 DA H3' . . 2.630 2.284 2.257 2.315 . 0 0 "[ . 1]" 1
191 1 9 DA H2' 1 9 DA H4' . . 3.590 3.690 3.668 3.717 0.127 3 0 "[ . 1]" 1
192 1 9 DA H2' 1 9 DA H8 . . 2.660 2.601 2.363 2.673 0.013 4 0 "[ . 1]" 1
193 1 9 DA H2' 1 10 DC H5 . . 4.160 3.461 3.381 3.552 . 0 0 "[ . 1]" 1
194 1 9 DA H2' 1 10 DC H6 . . 3.820 3.234 3.117 3.374 . 0 0 "[ . 1]" 1
195 1 9 DA H2'' 1 9 DA H3' . . 3.070 2.565 2.551 2.592 . 0 0 "[ . 1]" 1
196 1 9 DA H2'' 1 9 DA H8 . . 3.960 3.983 3.809 4.040 0.080 4 0 "[ . 1]" 1
197 1 9 DA H2'' 1 10 DC H5 . . 4.250 3.693 3.520 3.840 . 0 0 "[ . 1]" 1
198 1 9 DA H2'' 1 10 DC H6 . . 2.940 2.228 2.183 2.304 . 0 0 "[ . 1]" 1
199 1 9 DA H3' 1 9 DA H4' . . 2.970 2.724 2.694 2.757 . 0 0 "[ . 1]" 1
200 1 9 DA H3' 1 9 DA H8 . . 4.450 4.477 4.294 4.542 0.092 4 0 "[ . 1]" 1
201 1 9 DA H3' 1 10 DC H6 . . 4.500 4.694 4.641 4.759 0.259 9 0 "[ . 1]" 1
202 1 9 DA H4' 1 9 DA H8 . . 4.450 4.497 4.389 4.575 0.125 3 0 "[ . 1]" 1
203 1 9 DA H8 1 10 DC H5 . . 4.290 3.705 3.506 3.807 . 0 0 "[ . 1]" 1
204 1 9 DA H8 1 10 DC H6 . . 4.480 4.648 4.568 4.731 0.251 1 0 "[ . 1]" 1
205 1 10 DC H1' 1 10 DC H2' . . 3.390 3.007 2.990 3.018 . 0 0 "[ . 1]" 1
206 1 10 DC H1' 1 10 DC H2'' . . 2.350 2.233 2.217 2.249 . 0 0 "[ . 1]" 1
207 1 10 DC H1' 1 10 DC H3' . . 3.670 3.781 3.746 3.810 0.140 4 0 "[ . 1]" 1
208 1 10 DC H1' 1 10 DC H4' . . 2.780 2.730 2.636 2.830 0.050 7 0 "[ . 1]" 1
209 1 10 DC H1' 1 10 DC H5 . . 5.000 5.314 5.306 5.331 0.331 1 0 "[ . 1]" 1
210 1 10 DC H1' 1 10 DC H6 . . 3.710 3.593 3.562 3.611 . 0 0 "[ . 1]" 1
211 1 10 DC H2' 1 10 DC H3' . . 2.650 2.184 2.146 2.198 . 0 0 "[ . 1]" 1
212 1 10 DC H2' 1 10 DC H4' . . 3.940 3.887 3.873 3.905 . 0 0 "[ . 1]" 1
213 1 10 DC H2' 1 10 DC H5 . . 4.180 4.256 4.206 4.277 0.097 9 0 "[ . 1]" 1
214 1 10 DC H2' 1 10 DC H6 . . 2.790 2.322 2.267 2.465 . 0 0 "[ . 1]" 1
215 1 10 DC H2'' 1 10 DC H3' . . 3.730 2.834 2.819 2.881 . 0 0 "[ . 1]" 1
216 1 10 DC H2'' 1 10 DC H6 . . 3.550 3.721 3.664 3.822 0.272 7 0 "[ . 1]" 1
217 1 10 DC H3' 1 10 DC H4' . . 3.750 2.968 2.932 2.994 . 0 0 "[ . 1]" 1
218 1 10 DC H3' 1 10 DC H5 . . 6.000 5.909 5.807 6.011 0.011 2 0 "[ . 1]" 1
219 1 10 DC H3' 1 10 DC H6 . . 3.380 3.599 3.509 3.676 0.296 2 0 "[ . 1]" 1
220 1 10 DC H4' 1 10 DC H6 . . 4.500 4.421 4.245 4.496 . 0 0 "[ . 1]" 1
221 1 10 DC H41 2 1 DG H1 . . 3.500 2.441 2.204 2.598 . 0 0 "[ . 1]" 1
222 1 10 DC H41 2 2 DT H3 . . 5.500 4.568 4.323 4.828 . 0 0 "[ . 1]" 1
223 1 10 DC H42 2 1 DG H1 . . 4.000 3.991 3.773 4.135 0.135 7 0 "[ . 1]" 1
224 1 10 DC H42 2 2 DT H3 . . 6.000 5.644 5.244 5.911 . 0 0 "[ . 1]" 1
225 1 10 DC H6 2 1 DG H1 . . 5.500 5.655 5.625 5.690 0.190 8 0 "[ . 1]" 1
226 2 1 DG H1 2 2 DT H3 . . 4.500 3.397 3.285 3.514 . 0 0 "[ . 1]" 1
227 2 1 DG H1' 2 1 DG H2' . . 3.930 2.893 2.882 2.900 . 0 0 "[ . 1]" 1
228 2 1 DG H1' 2 1 DG H2'' . . 2.550 2.073 2.054 2.091 . 0 0 "[ . 1]" 1
229 2 1 DG H1' 2 1 DG H3' . . 4.100 3.964 3.896 4.001 . 0 0 "[ . 1]" 1
230 2 1 DG H1' 2 1 DG H8 . . 3.860 3.837 3.806 3.875 0.015 8 0 "[ . 1]" 1
231 2 1 DG H1' 2 2 DT H6 . . 3.580 3.780 3.698 3.827 0.247 7 0 "[ . 1]" 1
232 2 1 DG H1' 2 2 DT M7 . . 4.590 3.970 3.932 3.998 . 0 0 "[ . 1]" 1
233 2 1 DG H2' 2 1 DG H3' . . 2.810 2.247 2.226 2.268 . 0 0 "[ . 1]" 1
234 2 1 DG H2' 2 1 DG H8 . . 2.820 2.798 2.738 2.863 0.043 9 0 "[ . 1]" 1
235 2 1 DG H2'' 2 1 DG H3' . . 3.470 2.768 2.746 2.818 . 0 0 "[ . 1]" 1
236 2 1 DG H2'' 2 1 DG H8 . . 4.050 4.195 4.161 4.216 0.166 7 0 "[ . 1]" 1
237 2 1 DG H2'' 2 2 DT H6 . . 3.090 2.241 2.198 2.278 . 0 0 "[ . 1]" 1
238 2 1 DG H3' 2 1 DG H4' . . 3.240 2.813 2.757 2.872 . 0 0 "[ . 1]" 1
239 2 1 DG H3' 2 1 DG H8 . . 4.400 4.025 3.855 4.181 . 0 0 "[ . 1]" 1
240 2 1 DG H3' 2 2 DT H6 . . 4.030 4.235 4.181 4.286 0.256 2 0 "[ . 1]" 1
241 2 1 DG H3' 2 2 DT M7 . . 4.000 3.467 3.449 3.501 . 0 0 "[ . 1]" 1
242 2 1 DG H4' 2 1 DG H8 . . 4.490 4.399 4.282 4.519 0.029 2 0 "[ . 1]" 1
243 2 1 DG H8 2 2 DT H6 . . 5.000 5.083 5.023 5.114 0.114 1 0 "[ . 1]" 1
244 2 1 DG H8 2 2 DT M7 . . 4.000 2.751 2.606 2.909 . 0 0 "[ . 1]" 1
245 2 2 DT H1' 2 2 DT H2' . . 3.100 2.994 2.960 3.031 . 0 0 "[ . 1]" 1
246 2 2 DT H1' 2 2 DT H2'' . . 2.440 2.292 2.230 2.387 . 0 0 "[ . 1]" 1
247 2 2 DT H1' 2 2 DT H3' . . 3.710 3.819 3.791 3.848 0.138 6 0 "[ . 1]" 1
248 2 2 DT H1' 2 2 DT H4' . . 3.150 2.977 2.620 3.252 0.102 4 0 "[ . 1]" 1
249 2 2 DT H1' 2 2 DT H6 . . 3.500 3.580 3.557 3.594 0.094 7 0 "[ . 1]" 1
250 2 2 DT H1' 2 2 DT M7 . . 6.000 5.094 5.066 5.109 . 0 0 "[ . 1]" 1
251 2 2 DT H1' 2 3 DT M7 . . 4.500 3.861 3.767 3.951 . 0 0 "[ . 1]" 1
252 2 2 DT H2' 2 2 DT H4' . . 3.590 3.648 3.603 3.678 0.088 3 0 "[ . 1]" 1
253 2 2 DT H2' 2 2 DT H6 . . 2.420 2.401 2.357 2.460 0.040 8 0 "[ . 1]" 1
254 2 2 DT H2'' 2 2 DT H6 . . 3.750 3.816 3.788 3.863 0.113 8 0 "[ . 1]" 1
255 2 2 DT H3 2 3 DT H3 . . 5.000 3.274 3.191 3.371 . 0 0 "[ . 1]" 1
256 2 2 DT H3' 2 2 DT H4' . . 2.930 2.775 2.696 2.878 . 0 0 "[ . 1]" 1
257 2 2 DT H3' 2 3 DT M7 . . 4.140 3.100 2.743 3.408 . 0 0 "[ . 1]" 1
258 2 2 DT H4' 2 2 DT H6 . . 3.850 4.121 4.063 4.181 0.331 5 0 "[ . 1]" 1
259 2 2 DT H4' 2 3 DT M7 . . 5.450 4.831 4.736 4.886 . 0 0 "[ . 1]" 1
260 2 2 DT H6 2 3 DT M7 . . 4.390 3.432 3.050 3.706 . 0 0 "[ . 1]" 1
261 2 3 DT H1' 2 3 DT H2' . . 3.170 3.013 2.994 3.034 . 0 0 "[ . 1]" 1
262 2 3 DT H1' 2 3 DT H2'' . . 2.380 2.354 2.323 2.393 0.013 9 0 "[ . 1]" 1
263 2 3 DT H1' 2 3 DT H3' . . 3.840 3.838 3.775 3.880 0.040 7 0 "[ . 1]" 1
264 2 3 DT H1' 2 3 DT H6 . . 3.320 3.604 3.585 3.614 0.294 5 0 "[ . 1]" 1
265 2 3 DT H1' 2 3 DT M7 . . 6.000 5.090 5.083 5.100 . 0 0 "[ . 1]" 1
266 2 3 DT H1' 2 4 DC H6 . . 3.980 3.359 3.059 4.025 0.045 6 0 "[ . 1]" 1
267 2 3 DT H2' 2 3 DT H4' . . 3.430 3.681 3.668 3.708 0.278 1 0 "[ . 1]" 1
268 2 3 DT H2' 2 3 DT H6 . . 2.390 2.015 1.975 2.093 . 0 0 "[ . 1]" 1
269 2 3 DT H2' 2 4 DC H6 . . 3.950 3.718 3.497 3.868 . 0 0 "[ . 1]" 1
270 2 3 DT H2'' 2 4 DC H6 . . 3.310 2.446 2.299 2.740 . 0 0 "[ . 1]" 1
271 2 3 DT H3 2 4 DC H41 . . 6.000 3.647 3.514 3.757 . 0 0 "[ . 1]" 1
272 2 3 DT H3 2 4 DC H42 . . 5.000 4.011 3.572 4.449 . 0 0 "[ . 1]" 1
273 2 3 DT H4' 2 3 DT H6 . . 4.560 4.540 4.412 4.615 0.055 2 0 "[ . 1]" 1
274 2 3 DT H6 2 4 DC H5 . . 3.430 3.434 3.293 3.516 0.086 10 0 "[ . 1]" 1
275 2 3 DT M7 2 4 DC H5 . . 4.290 3.507 3.287 3.609 . 0 0 "[ . 1]" 1
276 2 4 DC H1' 2 4 DC H2'' . . 2.580 2.388 2.345 2.421 . 0 0 "[ . 1]" 1
277 2 4 DC H1' 2 4 DC H3' . . 3.780 3.684 3.612 3.759 . 0 0 "[ . 1]" 1
278 2 4 DC H1' 2 4 DC H6 . . 3.650 3.673 3.661 3.703 0.053 6 0 "[ . 1]" 1
279 2 4 DC H1' 2 5 DC H6 . . 4.830 4.959 4.852 5.011 0.181 9 0 "[ . 1]" 1
280 2 4 DC H2' 2 4 DC H6 . . 2.510 2.218 2.100 2.327 . 0 0 "[ . 1]" 1
281 2 4 DC H2' 2 5 DC H5 . . 3.500 3.526 3.483 3.593 0.093 9 0 "[ . 1]" 1
282 2 4 DC H2' 2 5 DC H6 . . 4.270 3.313 3.201 3.400 . 0 0 "[ . 1]" 1
283 2 4 DC H2'' 2 4 DC H6 . . 3.820 3.551 3.446 3.644 . 0 0 "[ . 1]" 1
284 2 4 DC H2'' 2 5 DC H5 . . 3.880 3.973 3.899 4.007 0.127 9 0 "[ . 1]" 1
285 2 4 DC H2'' 2 5 DC H6 . . 3.590 2.873 2.844 2.891 . 0 0 "[ . 1]" 1
286 2 4 DC H3' 2 4 DC H6 . . 4.450 4.330 4.173 4.468 0.018 5 0 "[ . 1]" 1
287 2 4 DC H4' 2 4 DC H6 . . 4.430 4.583 4.504 4.671 0.241 7 0 "[ . 1]" 1
288 2 4 DC H6 2 5 DC H6 . . 4.340 4.417 4.272 4.493 0.153 6 0 "[ . 1]" 1
289 2 5 DC H1' 2 5 DC H2' . . 3.080 2.911 2.880 2.966 . 0 0 "[ . 1]" 1
290 2 5 DC H1' 2 5 DC H2'' . . 2.520 2.064 2.020 2.114 . 0 0 "[ . 1]" 1
291 2 5 DC H1' 2 5 DC H3' . . 3.790 3.842 3.784 3.880 0.090 4 0 "[ . 1]" 1
292 2 5 DC H1' 2 5 DC H4' . . 3.020 2.913 2.733 3.065 0.045 3 0 "[ . 1]" 1
293 2 5 DC H1' 2 5 DC H6 . . 4.470 3.745 3.717 3.756 . 0 0 "[ . 1]" 1
294 2 5 DC H1' 2 6 DG H8 . . 5.000 5.377 5.308 5.454 0.454 9 0 "[ . 1]" 1
295 2 5 DC H2' 2 5 DC H3' . . 2.780 2.278 2.243 2.325 . 0 0 "[ . 1]" 1
296 2 5 DC H2' 2 5 DC H4' . . 4.190 3.900 3.838 3.968 . 0 0 "[ . 1]" 1
297 2 5 DC H2' 2 5 DC H6 . . 2.930 2.298 2.185 2.378 . 0 0 "[ . 1]" 1
298 2 5 DC H2' 2 6 DG H8 . . 4.500 3.074 2.684 4.033 . 0 0 "[ . 1]" 1
299 2 5 DC H2'' 2 5 DC H4' . . 3.190 3.437 3.317 3.528 0.338 3 0 "[ . 1]" 1
300 2 5 DC H2'' 2 5 DC H6 . . 4.020 3.787 3.602 3.867 . 0 0 "[ . 1]" 1
301 2 5 DC H2'' 2 6 DG H1' . . 5.000 4.682 3.624 5.026 0.026 1 0 "[ . 1]" 1
302 2 5 DC H2'' 2 6 DG H8 . . 4.520 3.573 3.482 3.790 . 0 0 "[ . 1]" 1
303 2 5 DC H3' 2 5 DC H4' . . 2.880 2.894 2.847 2.928 0.048 4 0 "[ . 1]" 1
304 2 5 DC H3' 2 5 DC H6 . . 3.550 3.580 3.285 3.683 0.133 5 0 "[ . 1]" 1
305 2 5 DC H3' 2 6 DG H8 . . 5.000 3.959 3.761 4.278 . 0 0 "[ . 1]" 1
306 2 5 DC H4' 2 5 DC H6 . . 4.700 4.713 4.631 4.802 0.102 9 0 "[ . 1]" 1
307 2 6 DG H1' 2 6 DG H8 . . 5.000 3.852 3.828 3.875 . 0 0 "[ . 1]" 1
308 2 6 DG H1' 2 7 DG H8 . . 3.530 3.207 2.909 3.576 0.046 10 0 "[ . 1]" 1
309 2 6 DG H2' 2 6 DG H8 . . 3.500 2.484 2.444 2.538 . 0 0 "[ . 1]" 1
310 2 6 DG H2'' 2 6 DG H8 . . 3.500 3.893 3.855 3.936 0.436 4 0 "[ . 1]" 1
311 2 6 DG H2'' 2 7 DG H8 . . 3.310 3.280 2.971 3.476 0.166 6 0 "[ . 1]" 1
312 2 6 DG H3' 2 7 DG H8 . . 4.650 4.451 4.148 4.663 0.013 3 0 "[ . 1]" 1
313 2 7 DG H1 2 8 DT H3 . . 4.000 3.274 3.206 3.390 . 0 0 "[ . 1]" 1
314 2 7 DG H1' 2 7 DG H2' . . 3.260 3.042 3.033 3.053 . 0 0 "[ . 1]" 1
315 2 7 DG H1' 2 7 DG H2'' . . 2.550 2.365 2.349 2.386 . 0 0 "[ . 1]" 1
316 2 7 DG H1' 2 7 DG H3' . . 3.980 3.840 3.806 3.874 . 0 0 "[ . 1]" 1
317 2 7 DG H1' 2 7 DG H4' . . 3.380 3.411 3.268 3.500 0.120 1 0 "[ . 1]" 1
318 2 7 DG H1' 2 7 DG H8 . . 4.140 3.661 3.643 3.698 . 0 0 "[ . 1]" 1
319 2 7 DG H1' 2 8 DT H6 . . 4.450 4.239 4.078 4.373 . 0 0 "[ . 1]" 1
320 2 7 DG H1' 2 8 DT M7 . . 5.000 4.275 4.242 4.337 . 0 0 "[ . 1]" 1
321 2 7 DG H2' 2 7 DG H8 . . 2.810 2.716 2.642 2.768 . 0 0 "[ . 1]" 1
322 2 7 DG H2' 2 8 DT H6 . . 3.200 2.635 2.559 2.684 . 0 0 "[ . 1]" 1
323 2 7 DG H2'' 2 7 DG H8 . . 4.000 4.058 4.017 4.087 0.087 10 0 "[ . 1]" 1
324 2 7 DG H2'' 2 8 DT H6 . . 3.090 2.449 2.409 2.489 . 0 0 "[ . 1]" 1
325 2 7 DG H3' 2 7 DG H8 . . 4.490 4.376 4.287 4.452 . 0 0 "[ . 1]" 1
326 2 7 DG H3' 2 8 DT H6 . . 4.500 4.443 4.306 4.522 0.022 2 0 "[ . 1]" 1
327 2 7 DG H4' 2 7 DG H8 . . 3.500 3.953 3.886 4.009 0.509 7 1 "[ . + 1]" 1
328 2 7 DG H4' 2 8 DT M7 . . 6.000 5.132 5.065 5.194 . 0 0 "[ . 1]" 1
329 2 7 DG H8 2 8 DT H6 . . 4.300 4.539 4.409 4.641 0.341 4 0 "[ . 1]" 1
330 2 7 DG H8 2 8 DT M7 . . 4.020 2.602 2.549 2.673 . 0 0 "[ . 1]" 1
331 2 8 DT H1' 2 8 DT H2' . . 3.300 3.066 3.045 3.089 . 0 0 "[ . 1]" 1
332 2 8 DT H1' 2 8 DT H2'' . . 2.550 2.435 2.338 2.557 0.007 1 0 "[ . 1]" 1
333 2 8 DT H1' 2 8 DT H3' . . 4.160 3.846 3.658 3.944 . 0 0 "[ . 1]" 1
334 2 8 DT H1' 2 8 DT H4' . . 3.170 2.548 2.489 2.623 . 0 0 "[ . 1]" 1
335 2 8 DT H1' 2 8 DT H6 . . 3.650 3.716 3.672 3.742 0.092 4 0 "[ . 1]" 1
336 2 8 DT H1' 2 8 DT M7 . . 6.130 5.108 5.084 5.124 . 0 0 "[ . 1]" 1
337 2 8 DT H1' 2 9 DG H8 . . 4.130 3.434 3.022 3.711 . 0 0 "[ . 1]" 1
338 2 8 DT H2' 2 8 DT H4' . . 3.590 3.669 3.635 3.692 0.102 8 0 "[ . 1]" 1
339 2 8 DT H2' 2 8 DT H6 . . 2.510 2.263 2.093 2.393 . 0 0 "[ . 1]" 1
340 2 8 DT H2' 2 9 DG H8 . . 3.750 3.180 2.959 3.734 . 0 0 "[ . 1]" 1
341 2 8 DT H2'' 2 8 DT H6 . . 3.750 3.674 3.233 3.839 0.089 2 0 "[ . 1]" 1
342 2 8 DT H2'' 2 9 DG H4' . . 5.000 4.362 4.112 5.020 0.020 10 0 "[ . 1]" 1
343 2 8 DT H2'' 2 9 DG H8 . . 3.360 2.440 2.381 2.486 . 0 0 "[ . 1]" 1
344 2 8 DT H3 2 9 DG H1 . . 4.000 3.975 3.788 4.084 0.084 8 0 "[ . 1]" 1
345 2 8 DT H3' 2 8 DT H6 . . 4.240 4.053 3.683 4.331 0.091 10 0 "[ . 1]" 1
346 2 8 DT H3' 2 9 DG H8 . . 4.810 4.921 4.842 5.001 0.191 1 0 "[ . 1]" 1
347 2 8 DT H4' 2 8 DT H6 . . 4.620 4.644 4.511 4.833 0.213 10 0 "[ . 1]" 1
348 2 8 DT H4' 2 9 DG H8 . . 5.000 5.493 5.386 5.573 0.573 5 5 "[ * +*- *1]" 1
349 2 8 DT H6 2 9 DG H8 . . 4.190 4.037 3.883 4.191 0.001 6 0 "[ . 1]" 1
350 2 8 DT M7 2 9 DG H8 . . 5.550 4.732 4.682 4.768 . 0 0 "[ . 1]" 1
351 2 9 DG H1' 2 9 DG H2' . . 2.980 3.043 3.033 3.056 0.076 5 0 "[ . 1]" 1
352 2 9 DG H1' 2 9 DG H2'' . . 2.610 2.452 2.397 2.496 . 0 0 "[ . 1]" 1
353 2 9 DG H1' 2 9 DG H3' . . 3.640 3.720 3.692 3.741 0.101 6 0 "[ . 1]" 1
354 2 9 DG H1' 2 9 DG H4' . . 3.220 3.046 2.843 3.176 . 0 0 "[ . 1]" 1
355 2 9 DG H1' 2 9 DG H8 . . 4.090 3.803 3.774 3.821 . 0 0 "[ . 1]" 1
356 2 9 DG H1' 2 10 DG H8 . . 3.350 3.236 2.876 3.457 0.107 4 0 "[ . 1]" 1
357 2 9 DG H2' 2 9 DG H4' . . 3.950 3.748 3.704 3.794 . 0 0 "[ . 1]" 1
358 2 9 DG H2' 2 9 DG H8 . . 2.540 2.394 2.337 2.529 . 0 0 "[ . 1]" 1
359 2 9 DG H2' 2 10 DG H8 . . 3.930 4.107 4.028 4.199 0.269 6 0 "[ . 1]" 1
360 2 9 DG H2'' 2 9 DG H4' . . 3.900 3.983 3.923 4.032 0.132 9 0 "[ . 1]" 1
361 2 9 DG H2'' 2 9 DG H8 . . 3.860 3.727 3.657 3.860 . 0 0 "[ . 1]" 1
362 2 9 DG H2'' 2 10 DG H8 . . 3.200 2.401 2.317 2.535 . 0 0 "[ . 1]" 1
363 2 9 DG H3' 2 9 DG H4' . . 2.920 2.819 2.772 2.895 . 0 0 "[ . 1]" 1
364 2 9 DG H3' 2 9 DG H8 . . 4.000 4.306 4.241 4.364 0.364 2 0 "[ . 1]" 1
365 2 9 DG H3' 2 10 DG H8 . . 4.250 4.301 4.010 4.453 0.203 7 0 "[ . 1]" 1
366 2 9 DG H4' 2 9 DG H8 . . 4.610 4.696 4.644 4.759 0.149 5 0 "[ . 1]" 1
367 2 9 DG H4' 2 10 DG H8 . . 5.220 5.144 4.776 5.341 0.121 3 0 "[ . 1]" 1
368 2 10 DG H1' 2 10 DG H2'' . . 2.550 2.345 2.296 2.371 . 0 0 "[ . 1]" 1
369 2 10 DG H1' 2 10 DG H3' . . 3.850 3.920 3.877 3.961 0.111 4 0 "[ . 1]" 1
370 2 10 DG H1' 2 10 DG H8 . . 4.480 3.781 3.753 3.816 . 0 0 "[ . 1]" 1
371 2 10 DG H2' 2 10 DG H3' . . 2.640 2.300 2.235 2.324 . 0 0 "[ . 1]" 1
372 2 10 DG H2' 2 10 DG H8 . . 2.680 2.627 2.532 2.715 0.035 5 0 "[ . 1]" 1
373 2 10 DG H2'' 2 10 DG H3' . . 3.370 2.709 2.680 2.760 . 0 0 "[ . 1]" 1
374 2 10 DG H2'' 2 10 DG H8 . . 4.070 4.073 4.012 4.129 0.059 5 0 "[ . 1]" 1
375 2 10 DG H3' 2 10 DG H4' . . 3.830 2.820 2.802 2.867 . 0 0 "[ . 1]" 1
376 2 10 DG H3' 2 10 DG H8 . . 4.110 4.081 3.798 4.238 0.128 6 0 "[ . 1]" 1
377 2 10 DG H4' 2 10 DG H8 . . 4.010 4.199 4.158 4.242 0.232 2 0 "[ . 1]" 1
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