NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
404477 |
1x2z   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1x2z
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 132
_Distance_constraint_stats_list.Viol_count 76
_Distance_constraint_stats_list.Viol_total 4.803
_Distance_constraint_stats_list.Viol_max 0.325
_Distance_constraint_stats_list.Viol_rms 0.0620
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0364
_Distance_constraint_stats_list.Viol_average_violations_only 0.0632
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 DG 0.197 0.061 1 0 "[ ]"
1 2 DA 0.261 0.191 1 0 "[ ]"
1 3 DC 0.096 0.033 1 0 "[ ]"
1 4 DT 0.204 0.095 1 0 "[ ]"
1 5 DG 0.276 0.107 1 0 "[ ]"
1 6 DT 0.513 0.194 1 0 "[ ]"
1 7 DG 0.140 0.087 1 0 "[ ]"
1 8 DC 0.325 0.208 1 0 "[ ]"
1 9 DA 0.333 0.181 1 0 "[ ]"
1 10 DG 0.503 0.322 1 0 "[ ]"
1 11 DT 0.196 0.125 1 0 "[ ]"
1 12 DC 0.155 0.125 1 0 "[ ]"
2 1 DG 0.232 0.092 1 0 "[ ]"
2 2 DA 0.238 0.187 1 0 "[ ]"
2 3 DC 0.094 0.035 1 0 "[ ]"
2 4 DT 0.203 0.096 1 0 "[ ]"
2 5 DG 0.278 0.107 1 0 "[ ]"
2 6 DT 0.515 0.193 1 0 "[ ]"
2 7 DG 0.144 0.089 1 0 "[ ]"
2 8 DC 0.322 0.207 1 0 "[ ]"
2 9 DA 0.325 0.180 1 0 "[ ]"
2 10 DG 0.501 0.325 1 0 "[ ]"
2 11 DT 0.163 0.097 1 0 "[ ]"
2 12 DC 0.120 0.097 1 0 "[ ]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 DG H1' 1 1 DG H2' 3.340 3.130 3.550 3.074 3.074 3.074 0.056 1 0 "[ ]" 1
2 1 1 DG H1' 1 1 DG H2'' 2.300 2.090 2.510 2.417 2.417 2.417 . 0 0 "[ ]" 1
3 1 1 DG H1' 1 2 DA H8 4.150 3.930 4.370 3.914 3.914 3.914 0.016 1 0 "[ ]" 1
4 1 1 DG H2' 1 1 DG H8 2.340 2.130 2.550 2.585 2.585 2.585 0.035 1 0 "[ ]" 1
5 1 1 DG H2' 1 2 DA H8 4.380 4.160 4.600 4.130 4.130 4.130 0.030 1 0 "[ ]" 1
6 1 1 DG H2'' 1 1 DG H8 3.670 3.460 3.880 3.941 3.941 3.941 0.061 1 0 "[ ]" 1
7 1 2 DA H1' 1 2 DA H2' 2.950 2.740 3.160 3.058 3.058 3.058 . 0 0 "[ ]" 1
8 1 2 DA H1' 1 2 DA H2'' 2.320 2.110 2.530 2.381 2.381 2.381 . 0 0 "[ ]" 1
9 1 2 DA H1' 1 2 DA H8 3.850 3.620 4.080 3.856 3.856 3.856 . 0 0 "[ ]" 1
10 1 2 DA H1' 1 3 DC H6 3.500 3.280 3.720 3.255 3.255 3.255 0.025 1 0 "[ ]" 1
11 1 2 DA H2' 1 3 DC H6 3.540 3.320 3.760 3.387 3.387 3.387 . 0 0 "[ ]" 1
12 1 2 DA H2'' 1 2 DA H8 3.360 3.150 3.570 3.761 3.761 3.761 0.191 1 0 "[ ]" 1
13 1 2 DA H2'' 1 3 DC H6 2.250 2.040 2.460 2.063 2.063 2.063 . 0 0 "[ ]" 1
14 1 3 DC H1' 1 3 DC H2' 3.060 2.850 3.270 3.060 3.060 3.060 . 0 0 "[ ]" 1
15 1 3 DC H1' 1 3 DC H6 3.800 3.580 4.020 3.727 3.727 3.727 . 0 0 "[ ]" 1
16 1 3 DC H1' 1 4 DT H6 3.600 3.380 3.820 3.367 3.367 3.367 0.013 1 0 "[ ]" 1
17 1 3 DC H2' 1 3 DC H6 2.510 2.300 2.720 2.267 2.267 2.267 0.033 1 0 "[ ]" 1
18 1 3 DC H2'' 1 3 DC H6 3.470 3.260 3.680 3.705 3.705 3.705 0.025 1 0 "[ ]" 1
19 1 4 DT H1' 1 4 DT H2' 2.930 2.720 3.140 3.060 3.060 3.060 . 0 0 "[ ]" 1
20 1 4 DT H1' 1 4 DT H2'' 2.160 . 2.370 2.380 2.380 2.380 0.010 1 0 "[ ]" 1
21 1 4 DT H1' 1 4 DT H6 3.380 3.160 3.600 3.695 3.695 3.695 0.095 1 0 "[ ]" 1
22 1 4 DT H1' 1 5 DG H8 3.820 3.600 4.040 3.527 3.527 3.527 0.073 1 0 "[ ]" 1
23 1 4 DT H2' 1 4 DT H6 2.190 . 2.400 2.389 2.389 2.389 . 0 0 "[ ]" 1
24 1 4 DT H2' 1 5 DG H8 3.470 3.250 3.690 3.237 3.237 3.237 0.013 1 0 "[ ]" 1
25 1 5 DG H1' 1 5 DG H2' 3.300 3.090 3.510 3.066 3.066 3.066 0.024 1 0 "[ ]" 1
26 1 5 DG H1' 1 5 DG H2'' 2.500 2.290 2.710 2.394 2.394 2.394 . 0 0 "[ ]" 1
27 1 5 DG H1' 1 6 DT H6 4.010 3.790 4.230 3.683 3.683 3.683 0.107 1 0 "[ ]" 1
28 1 5 DG H2' 1 6 DT H6 3.850 3.640 4.060 3.694 3.694 3.694 . 0 0 "[ ]" 1
29 1 5 DG H2'' 1 5 DG H8 3.950 3.740 4.160 3.915 3.915 3.915 . 0 0 "[ ]" 1
30 1 5 DG H2'' 1 6 DT H6 2.440 2.230 2.650 2.171 2.171 2.171 0.059 1 0 "[ ]" 1
31 1 6 DT H1' 1 6 DT H2' 3.140 2.930 3.350 3.053 3.053 3.053 . 0 0 "[ ]" 1
32 1 6 DT H1' 1 6 DT H2'' 2.290 2.080 2.500 2.349 2.349 2.349 . 0 0 "[ ]" 1
33 1 6 DT H1' 1 6 DT H6 4.160 3.930 4.390 3.736 3.736 3.736 0.194 1 0 "[ ]" 1
34 1 6 DT H1' 1 7 DG H8 3.710 3.490 3.930 3.403 3.403 3.403 0.087 1 0 "[ ]" 1
35 1 6 DT H2' 1 7 DG H8 3.790 3.580 4.000 3.577 3.577 3.577 0.003 1 0 "[ ]" 1
36 1 6 DT H2'' 1 6 DT H6 4.070 3.860 4.280 3.796 3.796 3.796 0.064 1 0 "[ ]" 1
37 1 6 DT H2'' 1 7 DG H8 2.740 2.530 2.950 2.530 2.530 2.530 . 0 0 "[ ]" 1
38 1 7 DG H1' 1 7 DG H2' 2.840 2.630 3.050 3.059 3.059 3.059 0.009 1 0 "[ ]" 1
39 1 7 DG H1' 1 7 DG H2'' 2.140 . 2.350 2.371 2.371 2.371 0.021 1 0 "[ ]" 1
40 1 7 DG H1' 1 8 DC H6 3.730 3.510 3.950 3.492 3.492 3.492 0.018 1 0 "[ ]" 1
41 1 7 DG H2'' 1 8 DC H6 2.210 . 2.280 1.998 1.998 1.998 0.002 1 0 "[ ]" 1
42 1 8 DC H1' 1 8 DC H2' 2.910 2.700 3.120 3.047 3.047 3.047 . 0 0 "[ ]" 1
43 1 8 DC H1' 1 8 DC H2'' 2.090 . 2.300 2.344 2.344 2.344 0.044 1 0 "[ ]" 1
44 1 8 DC H1' 1 9 DA H8 4.070 3.840 4.300 3.797 3.797 3.797 0.043 1 0 "[ ]" 1
45 1 8 DC H2' 1 8 DC H6 2.720 2.510 2.930 2.302 2.302 2.302 0.208 1 0 "[ ]" 1
46 1 8 DC H2' 1 9 DA H8 3.570 3.360 3.780 3.778 3.778 3.778 . 0 0 "[ ]" 1
47 1 8 DC H2'' 1 9 DA H8 2.430 2.220 2.640 2.650 2.650 2.650 0.010 1 0 "[ ]" 1
48 1 9 DA H1' 1 9 DA H2' 3.080 2.870 3.290 3.068 3.068 3.068 . 0 0 "[ ]" 1
49 1 9 DA H1' 1 9 DA H2'' 2.410 2.200 2.620 2.415 2.415 2.415 . 0 0 "[ ]" 1
50 1 9 DA H1' 1 9 DA H8 3.680 3.460 3.900 3.857 3.857 3.857 . 0 0 "[ ]" 1
51 1 9 DA H1' 1 10 DG H8 3.890 3.670 4.110 3.581 3.581 3.581 0.089 1 0 "[ ]" 1
52 1 9 DA H2' 1 9 DA H8 2.360 2.150 2.570 2.194 2.194 2.194 . 0 0 "[ ]" 1
53 1 9 DA H2' 1 10 DG H8 3.920 3.710 4.130 3.972 3.972 3.972 . 0 0 "[ ]" 1
54 1 9 DA H2'' 1 9 DA H8 3.150 2.940 3.360 3.541 3.541 3.541 0.181 1 0 "[ ]" 1
55 1 9 DA H2'' 1 10 DG H8 2.560 2.350 2.770 2.780 2.780 2.780 0.010 1 0 "[ ]" 1
56 1 10 DG H1' 1 10 DG H2' 2.480 2.270 2.690 3.012 3.012 3.012 0.322 1 0 "[ ]" 1
57 1 10 DG H1' 1 10 DG H2'' 2.300 2.090 2.510 2.290 2.290 2.290 . 0 0 "[ ]" 1
58 1 10 DG H1' 1 10 DG H8 3.380 2.810 3.950 3.878 3.878 3.878 . 0 0 "[ ]" 1
59 1 10 DG H2' 1 10 DG H8 2.710 2.500 2.920 2.481 2.481 2.481 0.019 1 0 "[ ]" 1
60 1 10 DG H2' 1 11 DT H6 2.780 2.570 2.810 2.851 2.851 2.851 0.041 1 0 "[ ]" 1
61 1 10 DG H2'' 1 10 DG H8 4.170 3.960 4.380 3.938 3.938 3.938 0.022 1 0 "[ ]" 1
62 1 11 DT H1' 1 11 DT H2' 3.130 2.920 3.340 3.065 3.065 3.065 . 0 0 "[ ]" 1
63 1 11 DT H1' 1 11 DT H2'' 2.310 2.100 2.520 2.389 2.389 2.389 . 0 0 "[ ]" 1
64 1 11 DT H1' 1 11 DT H6 3.850 3.630 4.070 3.713 3.713 3.713 . 0 0 "[ ]" 1
65 1 11 DT H1' 1 12 DC H6 4.550 4.310 4.790 4.185 4.185 4.185 0.125 1 0 "[ ]" 1
66 1 11 DT H2' 1 12 DC H6 4.090 3.870 4.310 3.840 3.840 3.840 0.030 1 0 "[ ]" 1
67 2 1 DG H1' 2 1 DG H2' 3.340 3.130 3.550 3.071 3.071 3.071 0.059 1 0 "[ ]" 1
68 2 1 DG H1' 2 1 DG H2'' 2.300 2.090 2.510 2.414 2.414 2.414 . 0 0 "[ ]" 1
69 2 1 DG H1' 2 2 DA H8 4.150 3.930 4.370 3.904 3.904 3.904 0.026 1 0 "[ ]" 1
70 2 1 DG H2' 2 1 DG H8 2.340 2.130 2.550 2.605 2.605 2.605 0.055 1 0 "[ ]" 1
71 2 1 DG H2' 2 2 DA H8 4.380 4.160 4.600 4.197 4.197 4.197 . 0 0 "[ ]" 1
72 2 1 DG H2'' 2 1 DG H8 3.670 3.460 3.880 3.972 3.972 3.972 0.092 1 0 "[ ]" 1
73 2 2 DA H1' 2 2 DA H2' 2.950 2.740 3.160 3.059 3.059 3.059 . 0 0 "[ ]" 1
74 2 2 DA H1' 2 2 DA H2'' 2.320 2.110 2.530 2.384 2.384 2.384 . 0 0 "[ ]" 1
75 2 2 DA H1' 2 2 DA H8 3.850 3.620 4.080 3.858 3.858 3.858 . 0 0 "[ ]" 1
76 2 2 DA H1' 2 3 DC H6 3.500 3.280 3.720 3.256 3.256 3.256 0.024 1 0 "[ ]" 1
77 2 2 DA H2' 2 3 DC H6 3.540 3.320 3.760 3.362 3.362 3.362 . 0 0 "[ ]" 1
78 2 2 DA H2'' 2 2 DA H8 3.360 3.150 3.570 3.757 3.757 3.757 0.187 1 0 "[ ]" 1
79 2 2 DA H2'' 2 3 DC H6 2.250 2.040 2.460 2.039 2.039 2.039 0.001 1 0 "[ ]" 1
80 2 3 DC H1' 2 3 DC H2' 3.060 2.850 3.270 3.060 3.060 3.060 . 0 0 "[ ]" 1
81 2 3 DC H1' 2 3 DC H6 3.800 3.580 4.020 3.727 3.727 3.727 . 0 0 "[ ]" 1
82 2 3 DC H1' 2 4 DT H6 3.600 3.380 3.820 3.369 3.369 3.369 0.011 1 0 "[ ]" 1
83 2 3 DC H2' 2 3 DC H6 2.510 2.300 2.720 2.265 2.265 2.265 0.035 1 0 "[ ]" 1
84 2 3 DC H2'' 2 3 DC H6 3.470 3.260 3.680 3.703 3.703 3.703 0.023 1 0 "[ ]" 1
85 2 4 DT H1' 2 4 DT H2' 2.930 2.720 3.140 3.060 3.060 3.060 . 0 0 "[ ]" 1
86 2 4 DT H1' 2 4 DT H2'' 2.160 . 2.370 2.380 2.380 2.380 0.010 1 0 "[ ]" 1
87 2 4 DT H1' 2 4 DT H6 3.380 3.160 3.600 3.696 3.696 3.696 0.096 1 0 "[ ]" 1
88 2 4 DT H1' 2 5 DG H8 3.820 3.600 4.040 3.528 3.528 3.528 0.072 1 0 "[ ]" 1
89 2 4 DT H2' 2 4 DT H6 2.190 . 2.400 2.389 2.389 2.389 . 0 0 "[ ]" 1
90 2 4 DT H2' 2 5 DG H8 3.470 3.250 3.690 3.236 3.236 3.236 0.014 1 0 "[ ]" 1
91 2 5 DG H1' 2 5 DG H2' 3.300 3.090 3.510 3.066 3.066 3.066 0.024 1 0 "[ ]" 1
92 2 5 DG H1' 2 5 DG H2'' 2.500 2.290 2.710 2.395 2.395 2.395 . 0 0 "[ ]" 1
93 2 5 DG H1' 2 6 DT H6 4.010 3.790 4.230 3.683 3.683 3.683 0.107 1 0 "[ ]" 1
94 2 5 DG H2' 2 6 DT H6 3.850 3.640 4.060 3.695 3.695 3.695 . 0 0 "[ ]" 1
95 2 5 DG H2'' 2 5 DG H8 3.950 3.740 4.160 3.919 3.919 3.919 . 0 0 "[ ]" 1
96 2 5 DG H2'' 2 6 DT H6 2.440 2.230 2.650 2.169 2.169 2.169 0.061 1 0 "[ ]" 1
97 2 6 DT H1' 2 6 DT H2' 3.140 2.930 3.350 3.053 3.053 3.053 . 0 0 "[ ]" 1
98 2 6 DT H1' 2 6 DT H2'' 2.290 2.080 2.500 2.349 2.349 2.349 . 0 0 "[ ]" 1
99 2 6 DT H1' 2 6 DT H6 4.160 3.930 4.390 3.737 3.737 3.737 0.193 1 0 "[ ]" 1
100 2 6 DT H1' 2 7 DG H8 3.710 3.490 3.930 3.401 3.401 3.401 0.089 1 0 "[ ]" 1
101 2 6 DT H2' 2 7 DG H8 3.790 3.580 4.000 3.613 3.613 3.613 . 0 0 "[ ]" 1
102 2 6 DT H2'' 2 6 DT H6 4.070 3.860 4.280 3.799 3.799 3.799 0.061 1 0 "[ ]" 1
103 2 6 DT H2'' 2 7 DG H8 2.740 2.530 2.950 2.526 2.526 2.526 0.004 1 0 "[ ]" 1
104 2 7 DG H1' 2 7 DG H2' 2.840 2.630 3.050 3.059 3.059 3.059 0.009 1 0 "[ ]" 1
105 2 7 DG H1' 2 7 DG H2'' 2.140 . 2.350 2.372 2.372 2.372 0.022 1 0 "[ ]" 1
106 2 7 DG H1' 2 8 DC H6 3.730 3.510 3.950 3.493 3.493 3.493 0.017 1 0 "[ ]" 1
107 2 7 DG H2'' 2 8 DC H6 2.210 . 2.280 1.997 1.997 1.997 0.003 1 0 "[ ]" 1
108 2 8 DC H1' 2 8 DC H2' 2.910 2.700 3.120 3.048 3.048 3.048 . 0 0 "[ ]" 1
109 2 8 DC H1' 2 8 DC H2'' 2.090 . 2.300 2.344 2.344 2.344 0.044 1 0 "[ ]" 1
110 2 8 DC H1' 2 9 DA H8 4.070 3.840 4.300 3.802 3.802 3.802 0.038 1 0 "[ ]" 1
111 2 8 DC H2' 2 8 DC H6 2.720 2.510 2.930 2.303 2.303 2.303 0.207 1 0 "[ ]" 1
112 2 8 DC H2' 2 9 DA H8 3.570 3.360 3.780 3.779 3.779 3.779 . 0 0 "[ ]" 1
113 2 8 DC H2'' 2 9 DA H8 2.430 2.220 2.640 2.654 2.654 2.654 0.014 1 0 "[ ]" 1
114 2 9 DA H1' 2 9 DA H2' 3.080 2.870 3.290 3.068 3.068 3.068 . 0 0 "[ ]" 1
115 2 9 DA H1' 2 9 DA H2'' 2.410 2.200 2.620 2.413 2.413 2.413 . 0 0 "[ ]" 1
116 2 9 DA H1' 2 9 DA H8 3.680 3.460 3.900 3.857 3.857 3.857 . 0 0 "[ ]" 1
117 2 9 DA H1' 2 10 DG H8 3.890 3.670 4.110 3.588 3.588 3.588 0.082 1 0 "[ ]" 1
118 2 9 DA H2' 2 9 DA H8 2.360 2.150 2.570 2.191 2.191 2.191 . 0 0 "[ ]" 1
119 2 9 DA H2' 2 10 DG H8 3.920 3.710 4.130 3.937 3.937 3.937 . 0 0 "[ ]" 1
120 2 9 DA H2'' 2 9 DA H8 3.150 2.940 3.360 3.540 3.540 3.540 0.180 1 0 "[ ]" 1
121 2 9 DA H2'' 2 10 DG H8 2.560 2.350 2.770 2.781 2.781 2.781 0.011 1 0 "[ ]" 1
122 2 10 DG H1' 2 10 DG H2' 2.480 2.270 2.690 3.015 3.015 3.015 0.325 1 0 "[ ]" 1
123 2 10 DG H1' 2 10 DG H2'' 2.300 2.090 2.510 2.295 2.295 2.295 . 0 0 "[ ]" 1
124 2 10 DG H1' 2 10 DG H8 3.380 2.810 3.950 3.879 3.879 3.879 . 0 0 "[ ]" 1
125 2 10 DG H2' 2 10 DG H8 2.710 2.500 2.920 2.485 2.485 2.485 0.015 1 0 "[ ]" 1
126 2 10 DG H2' 2 11 DT H6 2.780 2.570 2.810 2.853 2.853 2.853 0.043 1 0 "[ ]" 1
127 2 10 DG H2'' 2 10 DG H8 4.170 3.960 4.380 3.936 3.936 3.936 0.024 1 0 "[ ]" 1
128 2 11 DT H1' 2 11 DT H2' 3.130 2.920 3.340 3.060 3.060 3.060 . 0 0 "[ ]" 1
129 2 11 DT H1' 2 11 DT H2'' 2.310 2.100 2.520 2.372 2.372 2.372 . 0 0 "[ ]" 1
130 2 11 DT H1' 2 11 DT H6 3.850 3.630 4.070 3.715 3.715 3.715 . 0 0 "[ ]" 1
131 2 11 DT H1' 2 12 DC H6 4.550 4.310 4.790 4.213 4.213 4.213 0.097 1 0 "[ ]" 1
132 2 11 DT H2' 2 12 DC H6 4.090 3.870 4.310 3.847 3.847 3.847 0.023 1 0 "[ ]" 1
stop_
save_
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