NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
372154 |
1d6x   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1d6x
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 134
_Distance_constraint_stats_list.Viol_count 279
_Distance_constraint_stats_list.Viol_total 390.226
_Distance_constraint_stats_list.Viol_max 0.281
_Distance_constraint_stats_list.Viol_rms 0.0294
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0081
_Distance_constraint_stats_list.Viol_average_violations_only 0.0736
_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 VAL 0.000 0.000 . 0 "[ . 1 . ]"
1 2 ARG 0.000 0.000 . 0 "[ . 1 . ]"
1 3 ARG 0.000 0.000 . 0 "[ . 1 . ]"
1 4 PHE 4.166 0.188 19 0 "[ . 1 . ]"
1 5 PRO 4.507 0.281 19 0 "[ . 1 . ]"
1 6 TRP 0.163 0.099 19 0 "[ . 1 . ]"
1 7 TRP 0.642 0.078 2 0 "[ . 1 . ]"
1 8 TRP 14.693 0.281 19 0 "[ . 1 . ]"
1 9 PRO 9.843 0.213 2 0 "[ . 1 . ]"
1 10 PHE 0.000 0.000 . 0 "[ . 1 . ]"
1 11 LEU 1.358 0.095 19 0 "[ . 1 . ]"
1 12 ARG 0.000 0.000 . 0 "[ . 1 . ]"
1 13 ARG 0.480 0.111 11 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 VAL HA 1 1 VAL QG 1.800 . 3.900 2.181 2.032 2.321 . 0 0 "[ . 1 . ]" 1
2 1 1 VAL HA 1 2 ARG H 1.800 . 2.800 2.331 2.139 2.780 . 0 0 "[ . 1 . ]" 1
3 1 1 VAL HA 1 2 ARG QB 1.800 . 6.000 4.210 3.838 4.650 . 0 0 "[ . 1 . ]" 1
4 1 1 VAL HB 1 2 ARG H 1.800 . 5.000 3.608 1.983 4.412 . 0 0 "[ . 1 . ]" 1
5 1 1 VAL QG 1 2 ARG H 1.800 . 8.400 2.472 1.886 3.558 . 0 0 "[ . 1 . ]" 1
6 1 1 VAL QG 1 2 ARG HA 1.800 . 8.400 3.792 3.039 4.381 . 0 0 "[ . 1 . ]" 1
7 1 1 VAL QG 1 2 ARG QD 1.800 . 9.400 5.060 4.138 6.099 . 0 0 "[ . 1 . ]" 1
8 1 1 VAL QG 1 3 ARG H 1.800 . 8.400 4.792 3.886 5.498 . 0 0 "[ . 1 . ]" 1
9 1 1 VAL QG 1 4 PHE H 1.800 . 8.400 5.285 4.185 6.283 . 0 0 "[ . 1 . ]" 1
10 1 1 VAL QG 1 4 PHE QD 1.800 . 10.400 5.422 3.843 6.355 . 0 0 "[ . 1 . ]" 1
11 1 2 ARG H 1 2 ARG QD 1.800 . 6.000 3.987 2.473 5.088 . 0 0 "[ . 1 . ]" 1
12 1 2 ARG H 1 3 ARG H 1.800 . 5.000 4.502 4.129 4.612 . 0 0 "[ . 1 . ]" 1
13 1 2 ARG HA 1 2 ARG QG 1.800 . 3.900 2.329 2.006 3.344 . 0 0 "[ . 1 . ]" 1
14 1 2 ARG HA 1 3 ARG H 1.800 . 5.000 2.399 2.111 2.734 . 0 0 "[ . 1 . ]" 1
15 1 2 ARG HA 1 3 ARG QB 1.800 . 4.300 3.913 3.819 3.992 . 0 0 "[ . 1 . ]" 1
16 1 3 ARG H 1 4 PHE H 1.800 . 5.000 2.784 1.926 3.934 . 0 0 "[ . 1 . ]" 1
17 1 3 ARG H 1 4 PHE QD 1.800 . 7.400 4.380 1.917 5.734 . 0 0 "[ . 1 . ]" 1
18 1 3 ARG HA 1 4 PHE QD 1.800 . 5.700 3.532 2.750 5.423 . 0 0 "[ . 1 . ]" 1
19 1 4 PHE H 1 4 PHE HB2 1.800 . 3.300 3.462 3.413 3.488 0.188 19 0 "[ . 1 . ]" 1
20 1 4 PHE H 1 4 PHE HB3 1.800 . 3.300 2.195 2.110 2.497 . 0 0 "[ . 1 . ]" 1
21 1 4 PHE H 1 8 TRP QB 1.800 . 6.000 5.444 5.433 5.461 . 0 0 "[ . 1 . ]" 1
22 1 4 PHE HA 1 5 PRO HB3 1.800 . 5.000 5.019 4.801 5.056 0.056 19 0 "[ . 1 . ]" 1
23 1 4 PHE HA 1 5 PRO HD2 1.800 . 5.000 1.963 1.903 2.230 . 0 0 "[ . 1 . ]" 1
24 1 4 PHE HA 1 5 PRO HD3 1.800 . 5.000 2.601 2.316 2.643 . 0 0 "[ . 1 . ]" 1
25 1 4 PHE HA 1 5 PRO HG2 1.800 . 5.000 4.154 4.094 4.392 . 0 0 "[ . 1 . ]" 1
26 1 4 PHE HA 1 5 PRO HG3 1.800 . 5.000 4.456 4.422 4.507 . 0 0 "[ . 1 . ]" 1
27 1 4 PHE QB 1 5 PRO HD2 1.800 . 6.000 3.510 2.468 3.689 . 0 0 "[ . 1 . ]" 1
28 1 4 PHE HB2 1 5 PRO HD3 1.800 . 5.000 4.746 3.888 4.816 . 0 0 "[ . 1 . ]" 1
29 1 4 PHE HB2 1 8 TRP HD1 1.800 . 6.000 5.043 4.049 5.197 . 0 0 "[ . 1 . ]" 1
30 1 4 PHE HB3 1 5 PRO HD3 1.800 . 5.000 4.992 4.479 5.033 0.033 19 0 "[ . 1 . ]" 1
31 1 4 PHE HB3 1 8 TRP HD1 1.800 . 6.000 5.860 4.412 6.017 0.017 2 0 "[ . 1 . ]" 1
32 1 4 PHE QD 1 5 PRO HD2 1.800 . 7.400 4.894 4.117 5.086 . 0 0 "[ . 1 . ]" 1
33 1 4 PHE QD 1 5 PRO HD3 1.800 . 7.400 5.200 4.957 5.347 . 0 0 "[ . 1 . ]" 1
34 1 4 PHE QD 1 5 PRO HG3 1.800 . 7.400 6.763 6.015 6.838 . 0 0 "[ . 1 . ]" 1
35 1 4 PHE QD 1 6 TRP HA 1.800 . 8.400 5.164 4.120 5.600 . 0 0 "[ . 1 . ]" 1
36 1 4 PHE QD 1 6 TRP HD1 1.800 . 7.400 6.741 5.552 6.928 . 0 0 "[ . 1 . ]" 1
37 1 4 PHE QD 1 8 TRP H 1.800 . 7.400 6.102 5.023 6.353 . 0 0 "[ . 1 . ]" 1
38 1 4 PHE QD 1 8 TRP QB 1.800 . 8.400 5.110 4.089 5.308 . 0 0 "[ . 1 . ]" 1
39 1 4 PHE QD 1 8 TRP HE3 1.800 . 7.400 3.910 2.872 4.219 . 0 0 "[ . 1 . ]" 1
40 1 5 PRO HA 1 6 TRP H 1.800 . 3.300 2.910 2.154 3.399 0.099 19 0 "[ . 1 . ]" 1
41 1 5 PRO HA 1 6 TRP HD1 1.800 . 5.000 2.807 2.619 2.963 . 0 0 "[ . 1 . ]" 1
42 1 5 PRO HA 1 7 TRP H 1.800 . 5.000 4.298 3.879 4.815 . 0 0 "[ . 1 . ]" 1
43 1 5 PRO HA 1 7 TRP HE1 1.800 . 5.000 4.962 4.880 5.018 0.018 19 0 "[ . 1 . ]" 1
44 1 5 PRO HA 1 8 TRP H 1.800 . 5.000 5.073 4.601 5.281 0.281 19 0 "[ . 1 . ]" 1
45 1 5 PRO HB2 1 6 TRP HD1 1.800 . 5.000 2.899 2.229 3.687 . 0 0 "[ . 1 . ]" 1
46 1 5 PRO HB2 1 7 TRP H 1.800 . 5.000 2.324 2.241 2.577 . 0 0 "[ . 1 . ]" 1
47 1 5 PRO HB2 1 7 TRP HD1 1.800 . 5.000 2.415 2.282 2.972 . 0 0 "[ . 1 . ]" 1
48 1 5 PRO HB2 1 7 TRP HE1 1.800 . 5.000 2.873 2.794 2.915 . 0 0 "[ . 1 . ]" 1
49 1 5 PRO HB2 1 7 TRP HZ2 1.800 . 5.000 4.966 4.328 5.015 0.015 3 0 "[ . 1 . ]" 1
50 1 5 PRO HB2 1 8 TRP H 1.800 . 5.000 3.540 3.508 3.611 . 0 0 "[ . 1 . ]" 1
51 1 5 PRO HB3 1 6 TRP H 1.800 . 5.000 3.180 3.110 4.012 . 0 0 "[ . 1 . ]" 1
52 1 5 PRO HB3 1 6 TRP HD1 1.800 . 5.000 3.602 3.215 4.174 . 0 0 "[ . 1 . ]" 1
53 1 5 PRO HB3 1 7 TRP H 1.800 . 5.000 3.995 3.904 4.260 . 0 0 "[ . 1 . ]" 1
54 1 5 PRO HB3 1 7 TRP HD1 1.800 . 5.000 3.705 3.555 4.363 . 0 0 "[ . 1 . ]" 1
55 1 5 PRO HB3 1 7 TRP HE1 1.800 . 5.000 2.883 2.715 3.383 . 0 0 "[ . 1 . ]" 1
56 1 5 PRO HB3 1 7 TRP HZ2 1.800 . 5.000 4.612 4.487 4.668 . 0 0 "[ . 1 . ]" 1
57 1 5 PRO HB3 1 8 TRP H 1.800 . 5.000 4.807 4.761 4.932 . 0 0 "[ . 1 . ]" 1
58 1 5 PRO HB3 1 8 TRP QB 1.800 . 6.000 4.347 4.115 4.388 . 0 0 "[ . 1 . ]" 1
59 1 5 PRO HB3 1 8 TRP HE3 1.800 . 5.000 5.077 5.046 5.201 0.201 2 0 "[ . 1 . ]" 1
60 1 5 PRO HG2 1 7 TRP HE1 1.800 . 5.000 4.053 3.967 4.583 . 0 0 "[ . 1 . ]" 1
61 1 5 PRO HG2 1 7 TRP HZ2 1.800 . 5.000 4.872 4.787 4.999 . 0 0 "[ . 1 . ]" 1
62 1 5 PRO HG2 1 8 TRP H 1.800 . 5.000 2.140 2.027 2.814 . 0 0 "[ . 1 . ]" 1
63 1 5 PRO HG2 1 8 TRP QB 1.800 . 6.000 1.795 1.775 1.859 . 0 0 "[ . 1 . ]" 1
64 1 5 PRO HG2 1 8 TRP HE3 1.800 . 5.000 3.117 2.929 3.818 . 0 0 "[ . 1 . ]" 1
65 1 5 PRO HG3 1 7 TRP HE1 1.800 . 5.000 3.170 2.907 4.238 . 0 0 "[ . 1 . ]" 1
66 1 5 PRO HG3 1 7 TRP HZ2 1.800 . 5.000 3.499 3.246 3.974 . 0 0 "[ . 1 . ]" 1
67 1 6 TRP H 1 6 TRP HD1 1.800 . 3.300 1.951 1.782 2.927 0.018 2 0 "[ . 1 . ]" 1
68 1 6 TRP H 1 6 TRP HE1 1.800 . 5.000 3.889 3.806 4.668 . 0 0 "[ . 1 . ]" 1
69 1 6 TRP H 1 7 TRP H 1.800 . 5.000 2.072 1.753 3.065 0.047 19 0 "[ . 1 . ]" 1
70 1 6 TRP H 1 8 TRP H 1.800 . 5.000 3.629 2.163 4.346 . 0 0 "[ . 1 . ]" 1
71 1 6 TRP HA 1 7 TRP H 1.800 . 5.000 3.144 3.051 3.518 . 0 0 "[ . 1 . ]" 1
72 1 6 TRP HA 1 9 PRO HD3 1.800 . 5.000 4.096 3.651 4.237 . 0 0 "[ . 1 . ]" 1
73 1 6 TRP HB2 1 7 TRP H 1.800 . 5.000 4.185 3.635 4.277 . 0 0 "[ . 1 . ]" 1
74 1 6 TRP HB3 1 7 TRP H 1.800 . 5.000 4.497 4.019 4.564 . 0 0 "[ . 1 . ]" 1
75 1 6 TRP HD1 1 7 TRP H 1.800 . 5.000 3.875 3.394 4.014 . 0 0 "[ . 1 . ]" 1
76 1 6 TRP HD1 1 7 TRP QB 1.800 . 6.000 5.183 5.165 5.201 . 0 0 "[ . 1 . ]" 1
77 1 6 TRP HD1 1 7 TRP HD1 1.800 . 5.000 3.552 3.268 3.710 . 0 0 "[ . 1 . ]" 1
78 1 6 TRP HE1 1 7 TRP HD1 1.800 . 5.000 3.580 2.630 3.822 . 0 0 "[ . 1 . ]" 1
79 1 6 TRP HE1 1 7 TRP HE1 1.800 . 5.000 4.615 3.390 4.899 . 0 0 "[ . 1 . ]" 1
80 1 7 TRP H 1 7 TRP HD1 1.800 . 5.000 2.818 2.217 2.972 . 0 0 "[ . 1 . ]" 1
81 1 7 TRP H 1 8 TRP H 1.800 . 5.000 1.953 1.844 2.585 . 0 0 "[ . 1 . ]" 1
82 1 7 TRP H 1 8 TRP HB3 1.800 . 5.000 3.571 3.475 4.085 . 0 0 "[ . 1 . ]" 1
83 1 7 TRP HA 1 7 TRP HD1 1.800 . 5.000 4.431 4.321 4.477 . 0 0 "[ . 1 . ]" 1
84 1 7 TRP HA 1 8 TRP H 1.800 . 5.000 3.265 3.131 3.328 . 0 0 "[ . 1 . ]" 1
85 1 7 TRP HA 1 8 TRP HE3 1.800 . 5.000 5.008 4.801 5.078 0.078 2 0 "[ . 1 . ]" 1
86 1 7 TRP HA 1 10 PHE QD 1.800 . 7.400 3.823 3.306 4.966 . 0 0 "[ . 1 . ]" 1
87 1 7 TRP HA 1 10 PHE QE 1.800 . 7.400 3.679 2.870 5.120 . 0 0 "[ . 1 . ]" 1
88 1 7 TRP QB 1 10 PHE QD 1.800 . 8.400 3.842 3.351 5.047 . 0 0 "[ . 1 . ]" 1
89 1 7 TRP QB 1 11 LEU QD 1.800 . 9.400 4.793 4.306 5.138 . 0 0 "[ . 1 . ]" 1
90 1 7 TRP HD1 1 8 TRP H 1.800 . 5.000 4.540 4.318 4.782 . 0 0 "[ . 1 . ]" 1
91 1 7 TRP HD1 1 11 LEU QD 1.800 . 8.400 5.807 5.554 6.068 . 0 0 "[ . 1 . ]" 1
92 1 8 TRP H 1 8 TRP HD1 1.800 . 5.000 5.087 5.069 5.111 0.111 19 0 "[ . 1 . ]" 1
93 1 8 TRP H 1 8 TRP HE3 1.800 . 5.000 2.350 2.193 2.446 . 0 0 "[ . 1 . ]" 1
94 1 8 TRP H 1 9 PRO HA 1.800 . 5.000 5.126 5.072 5.182 0.182 19 0 "[ . 1 . ]" 1
95 1 8 TRP H 1 9 PRO HD2 1.800 . 5.000 1.753 1.716 1.795 0.084 2 0 "[ . 1 . ]" 1
96 1 8 TRP H 1 9 PRO HD3 1.800 . 5.000 3.050 2.905 3.122 . 0 0 "[ . 1 . ]" 1
97 1 8 TRP QB 1 10 PHE QD 1.800 . 8.400 6.257 5.681 6.916 . 0 0 "[ . 1 . ]" 1
98 1 8 TRP HB2 1 9 PRO HD3 1.800 . 5.000 4.669 4.614 4.700 . 0 0 "[ . 1 . ]" 1
99 1 8 TRP HB3 1 9 PRO HD3 1.800 . 5.000 3.810 3.700 3.909 . 0 0 "[ . 1 . ]" 1
100 1 8 TRP HD1 1 9 PRO HA 1.800 . 5.000 3.984 3.819 4.016 . 0 0 "[ . 1 . ]" 1
101 1 8 TRP HD1 1 9 PRO HD2 1.800 . 5.000 5.128 5.105 5.141 0.141 2 0 "[ . 1 . ]" 1
102 1 8 TRP HD1 1 9 PRO HD3 1.800 . 5.000 4.615 4.580 4.636 . 0 0 "[ . 1 . ]" 1
103 1 8 TRP HD1 1 11 LEU QD 1.800 . 5.000 1.832 1.740 2.051 0.060 2 0 "[ . 1 . ]" 1
104 1 8 TRP HD1 1 11 LEU HG 1.800 . 5.000 4.089 3.566 4.883 . 0 0 "[ . 1 . ]" 1
105 1 8 TRP HE1 1 11 LEU QD 1.800 . 8.400 3.917 3.794 4.161 . 0 0 "[ . 1 . ]" 1
106 1 8 TRP HE3 1 9 PRO HA 1.800 . 5.000 5.166 5.146 5.213 0.213 2 0 "[ . 1 . ]" 1
107 1 8 TRP HE3 1 9 PRO HD2 1.800 . 5.000 2.725 2.638 2.935 . 0 0 "[ . 1 . ]" 1
108 1 8 TRP HE3 1 9 PRO HD3 1.800 . 5.000 2.594 2.553 2.633 . 0 0 "[ . 1 . ]" 1
109 1 8 TRP HE3 1 11 LEU QD 1.800 . 8.400 4.617 4.537 4.671 . 0 0 "[ . 1 . ]" 1
110 1 8 TRP HZ2 1 11 LEU QD 1.800 . 8.400 5.808 5.736 5.960 . 0 0 "[ . 1 . ]" 1
111 1 8 TRP HZ3 1 11 LEU QD 1.800 . 8.400 6.259 6.215 6.288 . 0 0 "[ . 1 . ]" 1
112 1 9 PRO HA 1 10 PHE H 1.800 . 5.000 3.534 3.514 3.568 . 0 0 "[ . 1 . ]" 1
113 1 9 PRO HA 1 11 LEU H 1.800 . 5.000 4.468 3.754 4.776 . 0 0 "[ . 1 . ]" 1
114 1 9 PRO HB3 1 10 PHE QD 1.800 . 8.400 5.079 4.261 5.446 . 0 0 "[ . 1 . ]" 1
115 1 9 PRO HD2 1 10 PHE H 1.800 . 5.000 3.700 3.595 3.808 . 0 0 "[ . 1 . ]" 1
116 1 9 PRO HD2 1 11 LEU H 1.800 . 5.000 5.023 4.715 5.095 0.095 19 0 "[ . 1 . ]" 1
117 1 9 PRO HD3 1 10 PHE H 1.800 . 5.000 4.366 4.304 4.418 . 0 0 "[ . 1 . ]" 1
118 1 9 PRO HG2 1 10 PHE HE1 1.800 . 7.400 4.802 2.661 6.061 . 0 0 "[ . 1 . ]" 1
119 1 10 PHE H 1 10 PHE HB2 1.800 . 3.300 2.669 2.492 3.089 . 0 0 "[ . 1 . ]" 1
120 1 10 PHE HA 1 10 PHE QD 1.800 . 7.000 2.605 2.123 3.164 . 0 0 "[ . 1 . ]" 1
121 1 10 PHE HA 1 11 LEU H 1.800 . 5.000 3.410 3.011 3.571 . 0 0 "[ . 1 . ]" 1
122 1 10 PHE HB2 1 11 LEU H 1.800 . 5.000 3.110 2.610 4.061 . 0 0 "[ . 1 . ]" 1
123 1 10 PHE HB2 1 11 LEU QD 1.800 . 8.400 4.552 3.321 5.277 . 0 0 "[ . 1 . ]" 1
124 1 10 PHE HB3 1 11 LEU H 1.800 . 5.000 4.091 3.714 4.631 . 0 0 "[ . 1 . ]" 1
125 1 10 PHE HB3 1 11 LEU QD 1.800 . 8.400 5.426 4.511 5.927 . 0 0 "[ . 1 . ]" 1
126 1 10 PHE QD 1 11 LEU QD 1.800 . 10.800 4.992 4.131 5.533 . 0 0 "[ . 1 . ]" 1
127 1 10 PHE QE 1 11 LEU QD 1.800 . 10.800 6.364 5.613 6.738 . 0 0 "[ . 1 . ]" 1
128 1 11 LEU H 1 11 LEU QD 1.800 . 7.400 2.502 1.895 2.813 . 0 0 "[ . 1 . ]" 1
129 1 11 LEU HA 1 11 LEU QD 1.800 . 5.000 3.131 1.997 3.421 . 0 0 "[ . 1 . ]" 1
130 1 11 LEU QD 1 11 LEU HG 1.800 . 5.200 1.876 1.856 1.888 . 0 0 "[ . 1 . ]" 1
131 1 12 ARG QG 1 13 ARG QD 1.800 . 7.000 4.976 3.640 5.635 . 0 0 "[ . 1 . ]" 1
132 1 13 ARG H 1 13 ARG HA 1.800 . 2.800 2.823 2.784 2.911 0.111 11 0 "[ . 1 . ]" 1
133 1 13 ARG HA 1 13 ARG QG 1.800 . 3.400 2.346 2.019 2.659 . 0 0 "[ . 1 . ]" 1
134 1 13 ARG QB 1 13 ARG QD 1.800 . 6.700 2.141 1.924 2.659 . 0 0 "[ . 1 . ]" 1
stop_
save_
Contact the webmaster for help, if required. Saturday, April 27, 2024 11:49:30 PM GMT (wattos1)