NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
499314 |
2l4a   |
17234 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2l4a
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 907
_Distance_constraint_stats_list.Viol_count 3337
_Distance_constraint_stats_list.Viol_total 9806.625
_Distance_constraint_stats_list.Viol_max 0.437
_Distance_constraint_stats_list.Viol_rms 0.0529
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0160
_Distance_constraint_stats_list.Viol_average_violations_only 0.1130
_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 4 SER 0.000 0.000 . 0 "[ . 1 . 2 . ]"
1 5 LYS 2.427 0.233 6 0 "[ . 1 . 2 . ]"
1 6 LYS 8.483 0.370 20 0 "[ . 1 . 2 . ]"
1 7 ARG 8.950 0.370 20 0 "[ . 1 . 2 . ]"
1 8 PRO 6.914 0.252 8 0 "[ . 1 . 2 . ]"
1 9 GLY 4.827 0.357 19 0 "[ . 1 . 2 . ]"
1 10 LYS 1.636 0.234 1 0 "[ . 1 . 2 . ]"
1 11 ASP 4.212 0.354 13 0 "[ . 1 . 2 . ]"
1 12 LEU 8.696 0.354 13 0 "[ . 1 . 2 . ]"
1 13 ASP 5.412 0.247 22 0 "[ . 1 . 2 . ]"
1 14 ARG 6.576 0.247 22 0 "[ . 1 . 2 . ]"
1 15 ILE 15.678 0.397 17 0 "[ . 1 . 2 . ]"
1 16 ASP 6.623 0.160 4 0 "[ . 1 . 2 . ]"
1 17 ARG 16.990 0.364 5 0 "[ . 1 . 2 . ]"
1 18 ASN 16.954 0.364 5 0 "[ . 1 . 2 . ]"
1 19 ILE 14.049 0.256 17 0 "[ . 1 . 2 . ]"
1 20 LEU 12.601 0.243 26 0 "[ . 1 . 2 . ]"
1 21 ASN 3.756 0.205 12 0 "[ . 1 . 2 . ]"
1 22 GLU 10.365 0.256 17 0 "[ . 1 . 2 . ]"
1 23 LEU 7.483 0.218 19 0 "[ . 1 . 2 . ]"
1 24 GLN 0.356 0.068 16 0 "[ . 1 . 2 . ]"
1 25 LYS 18.172 0.354 22 0 "[ . 1 . 2 . ]"
1 26 ASP 12.285 0.354 22 0 "[ . 1 . 2 . ]"
1 27 GLY 0.795 0.109 7 0 "[ . 1 . 2 . ]"
1 28 ARG 2.038 0.146 5 0 "[ . 1 . 2 . ]"
1 29 ILE 10.056 0.242 17 0 "[ . 1 . 2 . ]"
1 30 SER 9.714 0.242 17 0 "[ . 1 . 2 . ]"
1 31 ASN 14.569 0.388 23 0 "[ . 1 . 2 . ]"
1 32 VAL 5.755 0.247 16 0 "[ . 1 . 2 . ]"
1 33 GLU 1.996 0.099 7 0 "[ . 1 . 2 . ]"
1 34 LEU 12.653 0.388 23 0 "[ . 1 . 2 . ]"
1 35 SER 32.981 0.401 23 0 "[ . 1 . 2 . ]"
1 36 LYS 0.544 0.161 11 0 "[ . 1 . 2 . ]"
1 37 ARG 16.937 0.326 23 0 "[ . 1 . 2 . ]"
1 38 VAL 28.963 0.326 23 0 "[ . 1 . 2 . ]"
1 39 GLY 8.630 0.266 25 0 "[ . 1 . 2 . ]"
1 40 LEU 37.713 0.401 23 0 "[ . 1 . 2 . ]"
1 41 SER 20.353 0.335 17 0 "[ . 1 . 2 . ]"
1 42 PRO 34.257 0.347 23 0 "[ . 1 . 2 . ]"
1 43 THR 2.032 0.144 24 0 "[ . 1 . 2 . ]"
1 44 PRO 15.441 0.430 16 0 "[ . 1 . 2 . ]"
1 45 CYS 16.023 0.400 5 0 "[ . 1 . 2 . ]"
1 46 LEU 21.368 0.322 21 0 "[ . 1 . 2 . ]"
1 47 GLU 16.898 0.430 16 0 "[ . 1 . 2 . ]"
1 48 ARG 14.743 0.400 5 0 "[ . 1 . 2 . ]"
1 49 VAL 27.471 0.293 11 0 "[ . 1 . 2 . ]"
1 50 ARG 20.161 0.367 25 0 "[ . 1 . 2 . ]"
1 51 ARG 13.631 0.367 25 0 "[ . 1 . 2 . ]"
1 52 LEU 7.793 0.259 26 0 "[ . 1 . 2 . ]"
1 53 GLU 2.361 0.171 18 0 "[ . 1 . 2 . ]"
1 54 ARG 0.220 0.051 22 0 "[ . 1 . 2 . ]"
1 55 GLN 1.985 0.259 26 0 "[ . 1 . 2 . ]"
1 56 GLY 1.030 0.127 22 0 "[ . 1 . 2 . ]"
1 57 PHE 2.573 0.116 26 0 "[ . 1 . 2 . ]"
1 58 ILE 21.902 0.360 24 0 "[ . 1 . 2 . ]"
1 59 GLN 6.098 0.225 2 0 "[ . 1 . 2 . ]"
1 60 GLY 3.818 0.225 2 0 "[ . 1 . 2 . ]"
1 61 TYR 13.449 0.437 24 0 "[ . 1 . 2 . ]"
1 62 THR 38.277 0.437 24 0 "[ . 1 . 2 . ]"
1 63 ALA 17.275 0.426 15 0 "[ . 1 . 2 . ]"
1 64 LEU 17.804 0.368 9 0 "[ . 1 . 2 . ]"
1 65 LEU 19.306 0.342 4 0 "[ . 1 . 2 . ]"
1 66 ASN 4.157 0.289 13 0 "[ . 1 . 2 . ]"
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 4 SER HA 1 5 LYS H 1.800 . 5.200 2.700 2.213 3.590 . 0 0 "[ . 1 . 2 . ]" 1
2 1 5 LYS QD 1 25 LYS H 1.800 . 4.200 4.282 3.964 4.433 0.233 6 0 "[ . 1 . 2 . ]" 1
3 1 6 LYS HA 1 9 GLY QA 1.800 . 4.200 4.353 3.881 4.557 0.357 19 0 "[ . 1 . 2 . ]" 1
4 1 6 LYS HA 1 7 ARG H 1.800 . 3.200 3.168 2.288 3.570 0.370 20 0 "[ . 1 . 2 . ]" 1
5 1 7 ARG H 1 7 ARG QG 1.800 . 5.200 3.185 2.035 4.102 . 0 0 "[ . 1 . 2 . ]" 1
6 1 7 ARG HA 1 8 PRO QD 1.800 . 3.200 2.812 2.472 3.452 0.252 8 0 "[ . 1 . 2 . ]" 1
7 1 7 ARG QB 1 8 PRO QD 1.800 . 4.200 1.697 1.594 1.775 0.206 26 0 "[ . 1 . 2 . ]" 1
8 1 7 ARG HA 1 7 ARG QG 1.800 . 3.200 2.556 1.949 3.282 0.082 14 0 "[ . 1 . 2 . ]" 1
9 1 7 ARG QG 1 8 PRO QD 1.800 . 4.200 2.754 1.732 3.688 0.068 13 0 "[ . 1 . 2 . ]" 1
10 1 8 PRO QB 1 12 LEU QD 1.800 . 5.200 3.191 1.799 4.325 0.001 25 0 "[ . 1 . 2 . ]" 1
11 1 8 PRO QD 1 51 ARG QD 1.800 . 5.200 5.257 4.545 5.385 0.185 7 0 "[ . 1 . 2 . ]" 1
12 1 8 PRO HA 1 9 GLY H 1.800 . 4.200 2.902 2.638 3.590 . 0 0 "[ . 1 . 2 . ]" 1
13 1 8 PRO QD 1 8 PRO QG 1.800 . 4.200 1.956 1.942 1.967 . 0 0 "[ . 1 . 2 . ]" 1
14 1 8 PRO HA 1 12 LEU QD 1.800 . 5.200 4.252 3.812 5.362 0.162 6 0 "[ . 1 . 2 . ]" 1
15 1 8 PRO HA 1 8 PRO QD 1.800 . 4.200 3.416 3.353 3.502 . 0 0 "[ . 1 . 2 . ]" 1
16 1 8 PRO HA 1 9 GLY QA 1.800 . 5.200 4.274 4.137 4.452 . 0 0 "[ . 1 . 2 . ]" 1
17 1 9 GLY QA 1 12 LEU QD 1.800 . 5.200 2.276 1.811 4.349 . 0 0 "[ . 1 . 2 . ]" 1
18 1 9 GLY QA 1 10 LYS H 1.800 . 5.200 2.566 2.180 2.860 . 0 0 "[ . 1 . 2 . ]" 1
19 1 9 GLY QA 1 12 LEU HG 1.800 . 4.200 4.007 1.811 4.277 0.077 8 0 "[ . 1 . 2 . ]" 1
20 1 10 LYS HA 1 10 LYS QG 1.800 . 4.200 2.634 2.041 3.306 . 0 0 "[ . 1 . 2 . ]" 1
21 1 10 LYS HA 1 11 ASP H 1.800 . 3.200 3.019 2.208 3.434 0.234 1 0 "[ . 1 . 2 . ]" 1
22 1 10 LYS QB 1 11 ASP H 1.800 . 5.200 2.922 1.836 4.060 . 0 0 "[ . 1 . 2 . ]" 1
23 1 10 LYS QG 1 11 ASP HA 1.800 . 4.200 4.028 3.394 4.235 0.035 19 0 "[ . 1 . 2 . ]" 1
24 1 10 LYS QG 1 11 ASP H 1.800 . 5.200 2.700 1.830 4.148 . 0 0 "[ . 1 . 2 . ]" 1
25 1 11 ASP HA 1 12 LEU H 1.800 . 3.200 2.501 2.245 3.306 0.106 23 0 "[ . 1 . 2 . ]" 1
26 1 11 ASP QB 1 12 LEU QD 1.800 . 5.200 4.692 3.031 5.298 0.098 6 0 "[ . 1 . 2 . ]" 1
27 1 11 ASP HA 1 12 LEU QB 1.800 . 4.200 4.272 4.079 4.554 0.354 13 0 "[ . 1 . 2 . ]" 1
28 1 11 ASP QB 1 12 LEU H 1.800 . 5.200 3.726 1.798 4.062 0.002 23 0 "[ . 1 . 2 . ]" 1
29 1 12 LEU H 1 12 LEU QB 1.800 . 3.200 2.583 2.023 3.337 0.137 13 0 "[ . 1 . 2 . ]" 1
30 1 12 LEU QB 1 12 LEU QD 1.800 . 4.200 1.885 1.765 2.045 0.035 19 0 "[ . 1 . 2 . ]" 1
31 1 12 LEU QD 1 12 LEU HG 1.800 . 4.200 1.898 1.881 1.912 . 0 0 "[ . 1 . 2 . ]" 1
32 1 12 LEU H 1 12 LEU QD 1.800 . 5.200 3.666 2.026 3.945 . 0 0 "[ . 1 . 2 . ]" 1
33 1 12 LEU HG 1 52 LEU QD 1.800 . 5.200 3.872 2.786 4.558 . 0 0 "[ . 1 . 2 . ]" 1
34 1 12 LEU QD 1 20 LEU H 1.800 . 5.200 4.773 4.136 5.233 0.033 25 0 "[ . 1 . 2 . ]" 1
35 1 12 LEU QD 1 16 ASP QB 1.800 . 4.200 1.878 1.673 2.638 0.127 25 0 "[ . 1 . 2 . ]" 1
36 1 12 LEU QD 1 20 LEU QB 1.800 . 5.200 3.944 3.084 4.580 . 0 0 "[ . 1 . 2 . ]" 1
37 1 12 LEU QD 1 20 LEU QD 1.800 . 4.200 2.369 1.798 2.993 0.002 10 0 "[ . 1 . 2 . ]" 1
38 1 12 LEU QB 1 17 ARG QB 1.800 . 4.200 3.006 2.037 4.261 0.061 13 0 "[ . 1 . 2 . ]" 1
39 1 12 LEU QD 1 14 ARG QD 1.800 . 5.200 5.154 4.661 5.381 0.181 6 0 "[ . 1 . 2 . ]" 1
40 1 12 LEU H 1 12 LEU HG 1.800 . 5.200 3.957 2.407 4.899 . 0 0 "[ . 1 . 2 . ]" 1
41 1 12 LEU QD 1 57 PHE QB 1.800 . 5.200 4.924 4.141 5.316 0.116 26 0 "[ . 1 . 2 . ]" 1
42 1 12 LEU QB 1 17 ARG QG 1.800 . 4.200 3.358 1.816 4.278 0.078 8 0 "[ . 1 . 2 . ]" 1
43 1 12 LEU QD 1 52 LEU HA 1.800 . 5.200 4.499 3.388 5.147 . 0 0 "[ . 1 . 2 . ]" 1
44 1 12 LEU QD 1 52 LEU HG 1.800 . 5.200 3.750 2.792 4.447 . 0 0 "[ . 1 . 2 . ]" 1
45 1 12 LEU QB 1 16 ASP H 1.800 . 5.200 5.018 4.153 5.296 0.096 4 0 "[ . 1 . 2 . ]" 1
46 1 12 LEU QB 1 52 LEU QD 1.800 . 5.200 4.116 2.239 4.801 . 0 0 "[ . 1 . 2 . ]" 1
47 1 12 LEU HA 1 16 ASP QB 1.800 . 4.200 3.881 2.744 4.233 0.033 25 0 "[ . 1 . 2 . ]" 1
48 1 12 LEU QD 1 16 ASP HA 1.800 . 5.200 3.958 3.666 4.631 . 0 0 "[ . 1 . 2 . ]" 1
49 1 12 LEU QB 1 17 ARG HA 1.800 . 5.200 4.311 2.898 4.991 . 0 0 "[ . 1 . 2 . ]" 1
50 1 12 LEU QD 1 16 ASP H 1.800 . 5.200 3.627 3.203 4.273 . 0 0 "[ . 1 . 2 . ]" 1
51 1 12 LEU QB 1 17 ARG H 1.800 . 5.200 3.584 2.697 4.114 . 0 0 "[ . 1 . 2 . ]" 1
52 1 12 LEU QD 1 17 ARG HA 1.800 . 5.200 2.721 1.872 3.481 . 0 0 "[ . 1 . 2 . ]" 1
53 1 12 LEU QD 1 17 ARG H 1.800 . 5.200 2.483 1.797 3.191 0.003 18 0 "[ . 1 . 2 . ]" 1
54 1 12 LEU HG 1 16 ASP QB 1.800 . 4.200 3.966 1.813 4.309 0.109 13 0 "[ . 1 . 2 . ]" 1
55 1 12 LEU HA 1 13 ASP H 1.800 . 3.200 2.277 2.210 2.624 . 0 0 "[ . 1 . 2 . ]" 1
56 1 12 LEU QD 1 17 ARG QB 1.800 . 5.200 2.515 1.743 3.923 0.057 13 0 "[ . 1 . 2 . ]" 1
57 1 12 LEU QD 1 17 ARG QD 1.800 . 5.200 3.693 2.611 4.663 . 0 0 "[ . 1 . 2 . ]" 1
58 1 12 LEU HA 1 12 LEU QD 1.800 . 4.200 2.373 1.749 3.351 0.051 25 0 "[ . 1 . 2 . ]" 1
59 1 12 LEU QD 1 17 ARG QG 1.800 . 5.200 2.905 1.765 4.596 0.035 13 0 "[ . 1 . 2 . ]" 1
60 1 12 LEU QB 1 13 ASP H 1.800 . 4.200 3.413 2.204 3.931 . 0 0 "[ . 1 . 2 . ]" 1
61 1 12 LEU QB 1 16 ASP QB 1.800 . 4.200 3.411 1.868 3.988 . 0 0 "[ . 1 . 2 . ]" 1
62 1 12 LEU QD 1 13 ASP H 1.800 . 5.200 2.501 1.790 4.060 0.010 4 0 "[ . 1 . 2 . ]" 1
63 1 12 LEU QD 1 52 LEU QD 1.800 . 4.200 2.105 1.761 2.568 0.039 23 0 "[ . 1 . 2 . ]" 1
64 1 12 LEU HA 1 12 LEU HG 1.800 . 3.200 2.570 2.081 3.532 0.332 13 0 "[ . 1 . 2 . ]" 1
65 1 12 LEU HG 1 13 ASP H 1.800 . 5.200 4.083 2.978 4.715 . 0 0 "[ . 1 . 2 . ]" 1
66 1 12 LEU HA 1 52 LEU QD 1.800 . 5.200 4.612 3.667 5.265 0.065 6 0 "[ . 1 . 2 . ]" 1
67 1 13 ASP H 1 16 ASP QB 1.800 . 3.200 2.913 2.236 3.220 0.020 6 0 "[ . 1 . 2 . ]" 1
68 1 13 ASP H 1 13 ASP QB 1.800 . 3.200 2.108 1.933 2.509 . 0 0 "[ . 1 . 2 . ]" 1
69 1 13 ASP QB 1 14 ARG H 1.800 . 4.200 3.289 2.819 3.775 . 0 0 "[ . 1 . 2 . ]" 1
70 1 13 ASP QB 1 15 ILE H 1.800 . 5.200 2.644 2.206 3.618 . 0 0 "[ . 1 . 2 . ]" 1
71 1 13 ASP HA 1 14 ARG HA 1.800 . 4.200 4.406 4.366 4.447 0.247 22 0 "[ . 1 . 2 . ]" 1
72 1 13 ASP HA 1 14 ARG H 1.800 . 4.200 2.271 2.196 2.512 . 0 0 "[ . 1 . 2 . ]" 1
73 1 13 ASP QB 1 16 ASP H 1.800 . 5.200 2.574 2.116 3.267 . 0 0 "[ . 1 . 2 . ]" 1
74 1 14 ARG HA 1 14 ARG QD 1.800 . 3.200 2.046 1.820 2.759 . 0 0 "[ . 1 . 2 . ]" 1
75 1 14 ARG HA 1 14 ARG QG 1.800 . 4.200 2.808 2.146 3.143 . 0 0 "[ . 1 . 2 . ]" 1
76 1 14 ARG HA 1 16 ASP H 1.800 . 5.200 4.296 3.904 4.877 . 0 0 "[ . 1 . 2 . ]" 1
77 1 14 ARG H 1 14 ARG QB 1.800 . 3.200 2.284 1.963 2.532 . 0 0 "[ . 1 . 2 . ]" 1
78 1 14 ARG HA 1 17 ARG QD 1.800 . 4.200 2.601 1.845 4.202 0.002 25 0 "[ . 1 . 2 . ]" 1
79 1 14 ARG QB 1 15 ILE H 1.800 . 4.200 2.755 2.519 3.012 . 0 0 "[ . 1 . 2 . ]" 1
80 1 14 ARG QD 1 15 ILE H 1.800 . 5.200 4.645 4.197 5.205 0.005 18 0 "[ . 1 . 2 . ]" 1
81 1 14 ARG HA 1 15 ILE H 1.800 . 4.200 3.512 3.450 3.570 . 0 0 "[ . 1 . 2 . ]" 1
82 1 14 ARG QG 1 15 ILE H 1.800 . 4.200 4.087 3.744 4.350 0.150 15 0 "[ . 1 . 2 . ]" 1
83 1 15 ILE MD 1 16 ASP H 1.800 . 5.200 4.237 3.874 4.373 . 0 0 "[ . 1 . 2 . ]" 1
84 1 15 ILE MG 1 40 LEU QB 1.800 . 5.200 2.975 2.547 3.063 . 0 0 "[ . 1 . 2 . ]" 1
85 1 15 ILE MD 1 18 ASN QB 1.800 . 5.200 3.869 3.450 4.569 . 0 0 "[ . 1 . 2 . ]" 1
86 1 15 ILE MG 1 40 LEU QD 1.800 . 4.200 1.621 1.559 1.765 0.241 5 0 "[ . 1 . 2 . ]" 1
87 1 15 ILE MG 1 40 LEU HA 1.800 . 5.200 5.223 5.014 5.343 0.143 17 0 "[ . 1 . 2 . ]" 1
88 1 15 ILE H 1 15 ILE HB 1.800 . 3.200 2.537 2.131 2.654 . 0 0 "[ . 1 . 2 . ]" 1
89 1 15 ILE MD 1 38 VAL HB 1.800 . 5.200 3.295 2.807 5.137 . 0 0 "[ . 1 . 2 . ]" 1
90 1 15 ILE MG 1 45 CYS HA 1.800 . 5.200 2.874 2.275 3.198 . 0 0 "[ . 1 . 2 . ]" 1
91 1 15 ILE MG 1 18 ASN QB 1.800 . 5.200 4.217 3.680 5.111 . 0 0 "[ . 1 . 2 . ]" 1
92 1 15 ILE MD 1 15 ILE QG 1.800 . 4.200 1.897 1.885 1.917 . 0 0 "[ . 1 . 2 . ]" 1
93 1 15 ILE HA 1 48 ARG QB 1.800 . 4.200 4.450 4.371 4.597 0.397 17 0 "[ . 1 . 2 . ]" 1
94 1 15 ILE MD 1 15 ILE MG 1.800 . 4.200 2.242 2.069 3.215 . 0 0 "[ . 1 . 2 . ]" 1
95 1 15 ILE HB 1 16 ASP HA 1.800 . 5.200 4.253 4.085 4.617 . 0 0 "[ . 1 . 2 . ]" 1
96 1 15 ILE HA 1 15 ILE MD 1.800 . 4.200 1.935 1.800 2.160 0.000 16 0 "[ . 1 . 2 . ]" 1
97 1 15 ILE MD 1 18 ASN H 1.800 . 5.200 4.996 4.677 5.184 . 0 0 "[ . 1 . 2 . ]" 1
98 1 15 ILE HB 1 16 ASP H 1.800 . 3.200 2.729 2.289 3.069 . 0 0 "[ . 1 . 2 . ]" 1
99 1 15 ILE HA 1 16 ASP H 1.800 . 4.200 3.526 3.457 3.583 . 0 0 "[ . 1 . 2 . ]" 1
100 1 15 ILE H 1 15 ILE QG 1.800 . 5.200 1.963 1.799 3.398 0.001 6 0 "[ . 1 . 2 . ]" 1
101 1 15 ILE HA 1 38 VAL QG 1.800 . 5.200 3.241 2.014 3.884 . 0 0 "[ . 1 . 2 . ]" 1
102 1 15 ILE H 1 15 ILE MG 1.800 . 5.200 3.693 3.610 3.726 . 0 0 "[ . 1 . 2 . ]" 1
103 1 15 ILE HA 1 17 ARG H 1.800 . 5.200 4.888 4.197 5.252 0.052 15 0 "[ . 1 . 2 . ]" 1
104 1 15 ILE HB 1 15 ILE MD 1.800 . 4.200 3.126 2.444 3.189 . 0 0 "[ . 1 . 2 . ]" 1
105 1 15 ILE MD 1 48 ARG QG 1.800 . 5.200 4.386 3.800 4.628 . 0 0 "[ . 1 . 2 . ]" 1
106 1 15 ILE HA 1 15 ILE QG 1.800 . 4.200 3.083 2.468 3.208 . 0 0 "[ . 1 . 2 . ]" 1
107 1 15 ILE HA 1 15 ILE MG 1.800 . 4.200 2.182 2.067 2.605 . 0 0 "[ . 1 . 2 . ]" 1
108 1 15 ILE HA 1 38 VAL HB 1.800 . 5.200 3.481 3.052 4.803 . 0 0 "[ . 1 . 2 . ]" 1
109 1 15 ILE MG 1 48 ARG QD 1.800 . 4.200 2.004 1.697 2.476 0.103 21 0 "[ . 1 . 2 . ]" 1
110 1 15 ILE HA 1 19 ILE H 1.800 . 4.200 3.886 3.590 4.112 . 0 0 "[ . 1 . 2 . ]" 1
111 1 15 ILE MG 1 16 ASP HA 1.800 . 4.200 3.982 3.031 4.199 . 0 0 "[ . 1 . 2 . ]" 1
112 1 15 ILE MG 1 48 ARG QG 1.800 . 4.200 1.960 1.791 2.750 0.009 20 0 "[ . 1 . 2 . ]" 1
113 1 15 ILE MG 1 16 ASP H 1.800 . 5.200 3.776 2.910 4.025 . 0 0 "[ . 1 . 2 . ]" 1
114 1 15 ILE QG 1 15 ILE MG 1.800 . 4.200 2.101 2.049 2.215 . 0 0 "[ . 1 . 2 . ]" 1
115 1 15 ILE HA 1 40 LEU QD 1.800 . 5.200 3.079 2.713 4.104 . 0 0 "[ . 1 . 2 . ]" 1
116 1 15 ILE HB 1 40 LEU QD 1.800 . 5.200 3.653 3.000 3.849 . 0 0 "[ . 1 . 2 . ]" 1
117 1 15 ILE HA 1 18 ASN H 1.800 . 4.200 4.006 3.532 4.229 0.029 3 0 "[ . 1 . 2 . ]" 1
118 1 15 ILE H 1 15 ILE MD 1.800 . 5.200 2.493 1.830 2.799 . 0 0 "[ . 1 . 2 . ]" 1
119 1 15 ILE QG 1 38 VAL HB 1.800 . 5.200 5.026 2.739 5.271 0.071 19 0 "[ . 1 . 2 . ]" 1
120 1 15 ILE MG 1 38 VAL HA 1.800 . 5.200 5.253 4.796 5.386 0.186 6 0 "[ . 1 . 2 . ]" 1
121 1 15 ILE MG 1 38 VAL HB 1.800 . 4.200 3.005 2.805 3.622 . 0 0 "[ . 1 . 2 . ]" 1
122 1 15 ILE HA 1 18 ASN QB 1.800 . 4.200 3.062 2.544 4.177 . 0 0 "[ . 1 . 2 . ]" 1
123 1 15 ILE MD 1 40 LEU QD 1.800 . 5.200 2.066 1.776 3.272 0.024 24 0 "[ . 1 . 2 . ]" 1
124 1 15 ILE MG 1 19 ILE HA 1.800 . 5.200 5.097 4.534 5.243 0.043 3 0 "[ . 1 . 2 . ]" 1
125 1 15 ILE MG 1 19 ILE HB 1.800 . 5.200 4.076 3.204 4.538 . 0 0 "[ . 1 . 2 . ]" 1
126 1 15 ILE MG 1 19 ILE H 1.800 . 5.200 4.296 3.732 4.641 . 0 0 "[ . 1 . 2 . ]" 1
127 1 16 ASP QB 1 19 ILE H 1.800 . 5.200 4.784 4.630 4.966 . 0 0 "[ . 1 . 2 . ]" 1
128 1 16 ASP HA 1 17 ARG H 1.800 . 4.200 3.581 3.513 3.607 . 0 0 "[ . 1 . 2 . ]" 1
129 1 16 ASP HA 1 48 ARG QB 1.800 . 4.200 3.294 2.361 3.836 . 0 0 "[ . 1 . 2 . ]" 1
130 1 16 ASP HA 1 48 ARG QD 1.800 . 5.200 4.917 4.588 5.325 0.125 21 0 "[ . 1 . 2 . ]" 1
131 1 16 ASP QB 1 18 ASN H 1.800 . 5.200 4.650 4.285 5.310 0.110 21 0 "[ . 1 . 2 . ]" 1
132 1 16 ASP HA 1 38 VAL QG 1.800 . 5.200 5.024 4.605 5.306 0.106 13 0 "[ . 1 . 2 . ]" 1
133 1 16 ASP HA 1 19 ILE HA 1.800 . 5.200 5.295 5.172 5.360 0.160 4 0 "[ . 1 . 2 . ]" 1
134 1 16 ASP HA 1 19 ILE HB 1.800 . 4.200 2.330 2.180 2.518 . 0 0 "[ . 1 . 2 . ]" 1
135 1 16 ASP HA 1 19 ILE H 1.800 . 4.200 3.525 3.325 3.783 . 0 0 "[ . 1 . 2 . ]" 1
136 1 16 ASP HA 1 19 ILE MD 1.800 . 4.200 2.548 1.913 3.072 . 0 0 "[ . 1 . 2 . ]" 1
137 1 16 ASP H 1 48 ARG QD 1.800 . 5.200 4.095 3.512 5.255 0.055 13 0 "[ . 1 . 2 . ]" 1
138 1 16 ASP HA 1 34 LEU QD 1.800 . 5.200 5.223 5.079 5.350 0.150 18 0 "[ . 1 . 2 . ]" 1
139 1 16 ASP HA 1 52 LEU QD 1.800 . 4.200 1.959 1.760 2.370 0.040 23 0 "[ . 1 . 2 . ]" 1
140 1 16 ASP HA 1 19 ILE QG 1.800 . 4.200 3.867 3.649 4.017 . 0 0 "[ . 1 . 2 . ]" 1
141 1 16 ASP HA 1 19 ILE MG 1.800 . 4.200 3.302 2.894 3.845 . 0 0 "[ . 1 . 2 . ]" 1
142 1 16 ASP QB 1 52 LEU QD 1.800 . 4.200 1.860 1.727 2.080 0.073 26 0 "[ . 1 . 2 . ]" 1
143 1 16 ASP HA 1 20 LEU H 1.800 . 4.200 4.004 3.768 4.214 0.014 8 0 "[ . 1 . 2 . ]" 1
144 1 16 ASP H 1 16 ASP QB 1.800 . 3.200 2.261 2.042 2.525 . 0 0 "[ . 1 . 2 . ]" 1
145 1 16 ASP QB 1 17 ARG HA 1.800 . 5.200 3.896 3.820 3.985 . 0 0 "[ . 1 . 2 . ]" 1
146 1 16 ASP HA 1 20 LEU QD 1.800 . 4.200 3.988 3.311 4.257 0.057 18 0 "[ . 1 . 2 . ]" 1
147 1 16 ASP QB 1 17 ARG H 1.800 . 4.200 2.348 2.044 2.778 . 0 0 "[ . 1 . 2 . ]" 1
148 1 17 ARG HA 1 20 LEU QB 1.800 . 4.200 2.562 2.263 2.954 . 0 0 "[ . 1 . 2 . ]" 1
149 1 17 ARG HA 1 20 LEU QD 1.800 . 4.200 2.483 1.807 3.003 . 0 0 "[ . 1 . 2 . ]" 1
150 1 17 ARG H 1 17 ARG QB 1.800 . 3.200 2.310 1.924 2.686 . 0 0 "[ . 1 . 2 . ]" 1
151 1 17 ARG H 1 17 ARG QD 1.800 . 5.200 3.768 3.303 4.550 . 0 0 "[ . 1 . 2 . ]" 1
152 1 17 ARG HA 1 19 ILE H 1.800 . 5.200 4.368 3.997 4.571 . 0 0 "[ . 1 . 2 . ]" 1
153 1 17 ARG H 1 18 ASN QB 1.800 . 5.200 4.459 4.229 4.939 . 0 0 "[ . 1 . 2 . ]" 1
154 1 17 ARG H 1 17 ARG QG 1.800 . 3.200 2.275 1.758 3.336 0.136 11 0 "[ . 1 . 2 . ]" 1
155 1 17 ARG HA 1 18 ASN H 1.800 . 3.200 3.545 3.502 3.564 0.364 5 0 "[ . 1 . 2 . ]" 1
156 1 17 ARG QB 1 18 ASN H 1.800 . 3.200 2.964 1.918 3.365 0.165 12 0 "[ . 1 . 2 . ]" 1
157 1 17 ARG QD 1 18 ASN H 1.800 . 5.200 3.676 2.063 5.084 . 0 0 "[ . 1 . 2 . ]" 1
158 1 17 ARG QG 1 18 ASN H 1.800 . 5.200 2.406 1.761 4.296 0.039 9 0 "[ . 1 . 2 . ]" 1
159 1 17 ARG HA 1 17 ARG QD 1.800 . 4.200 4.102 3.651 4.312 0.112 10 0 "[ . 1 . 2 . ]" 1
160 1 17 ARG HA 1 17 ARG QG 1.800 . 4.200 2.984 2.055 3.371 . 0 0 "[ . 1 . 2 . ]" 1
161 1 17 ARG HA 1 20 LEU HG 1.800 . 4.200 3.882 3.232 4.224 0.024 19 0 "[ . 1 . 2 . ]" 1
162 1 17 ARG HA 1 20 LEU H 1.800 . 3.200 3.391 3.289 3.443 0.243 20 0 "[ . 1 . 2 . ]" 1
163 1 17 ARG QD 1 17 ARG QG 1.800 . 4.200 2.070 2.034 2.105 . 0 0 "[ . 1 . 2 . ]" 1
164 1 18 ASN HA 1 21 ASN QB 1.800 . 4.200 2.495 2.236 2.738 . 0 0 "[ . 1 . 2 . ]" 1
165 1 18 ASN H 1 19 ILE HA 1.800 . 5.200 5.277 5.218 5.353 0.153 3 0 "[ . 1 . 2 . ]" 1
166 1 18 ASN H 1 19 ILE HB 1.800 . 5.200 4.402 4.325 4.529 . 0 0 "[ . 1 . 2 . ]" 1
167 1 18 ASN HA 1 22 GLU H 1.800 . 4.200 4.122 3.805 4.311 0.111 8 0 "[ . 1 . 2 . ]" 1
168 1 18 ASN HA 1 21 ASN H 1.800 . 3.200 3.338 3.283 3.405 0.205 12 0 "[ . 1 . 2 . ]" 1
169 1 18 ASN HA 1 19 ILE H 1.800 . 4.200 3.543 3.494 3.569 . 0 0 "[ . 1 . 2 . ]" 1
170 1 18 ASN QB 1 22 GLU QG 1.800 . 5.200 4.124 3.054 5.227 0.027 16 0 "[ . 1 . 2 . ]" 1
171 1 18 ASN QB 1 38 VAL QG 1.800 . 4.200 2.191 1.758 3.097 0.042 15 0 "[ . 1 . 2 . ]" 1
172 1 18 ASN QB 1 38 VAL HA 1.800 . 4.200 3.701 3.036 4.225 0.025 4 0 "[ . 1 . 2 . ]" 1
173 1 18 ASN QB 1 38 VAL HB 1.800 . 4.200 3.661 3.093 4.396 0.196 17 0 "[ . 1 . 2 . ]" 1
174 1 18 ASN QB 1 19 ILE HA 1.800 . 5.200 3.977 3.823 4.449 . 0 0 "[ . 1 . 2 . ]" 1
175 1 18 ASN QB 1 19 ILE H 1.800 . 4.200 2.662 2.395 3.445 . 0 0 "[ . 1 . 2 . ]" 1
176 1 18 ASN H 1 18 ASN QB 1.800 . 3.200 2.111 1.935 2.481 . 0 0 "[ . 1 . 2 . ]" 1
177 1 19 ILE MG 1 23 LEU QD 1.800 . 4.200 2.064 1.741 2.793 0.059 16 0 "[ . 1 . 2 . ]" 1
178 1 19 ILE HA 1 22 GLU HA 1.800 . 5.200 5.338 5.236 5.456 0.256 17 0 "[ . 1 . 2 . ]" 1
179 1 19 ILE HA 1 22 GLU H 1.800 . 4.200 3.386 3.283 3.497 . 0 0 "[ . 1 . 2 . ]" 1
180 1 19 ILE HA 1 34 LEU HA 1.800 . 5.200 5.133 4.850 5.271 0.071 23 0 "[ . 1 . 2 . ]" 1
181 1 19 ILE MG 1 49 VAL QG 1.800 . 4.200 1.666 1.611 1.785 0.189 7 0 "[ . 1 . 2 . ]" 1
182 1 19 ILE MG 1 34 LEU HA 1.800 . 5.200 5.031 4.745 5.263 0.063 3 0 "[ . 1 . 2 . ]" 1
183 1 19 ILE MG 1 34 LEU HG 1.800 . 5.200 3.854 2.303 4.289 . 0 0 "[ . 1 . 2 . ]" 1
184 1 19 ILE H 1 19 ILE HB 1.800 . 3.200 2.116 2.046 2.274 . 0 0 "[ . 1 . 2 . ]" 1
185 1 19 ILE HA 1 38 VAL HB 1.800 . 5.200 5.106 4.703 5.283 0.083 16 0 "[ . 1 . 2 . ]" 1
186 1 19 ILE MG 1 34 LEU QD 1.800 . 4.200 1.814 1.701 1.974 0.099 8 0 "[ . 1 . 2 . ]" 1
187 1 19 ILE MG 1 52 LEU QD 1.800 . 4.200 2.379 1.831 3.011 . 0 0 "[ . 1 . 2 . ]" 1
188 1 19 ILE MD 1 20 LEU H 1.800 . 5.200 4.605 4.322 4.794 . 0 0 "[ . 1 . 2 . ]" 1
189 1 19 ILE QG 1 19 ILE MG 1.800 . 4.200 2.272 2.134 2.366 . 0 0 "[ . 1 . 2 . ]" 1
190 1 19 ILE HB 1 19 ILE MD 1.800 . 4.200 2.273 2.048 2.403 . 0 0 "[ . 1 . 2 . ]" 1
191 1 19 ILE H 1 20 LEU QB 1.800 . 5.200 4.381 4.200 4.582 . 0 0 "[ . 1 . 2 . ]" 1
192 1 19 ILE HA 1 19 ILE QG 1.800 . 4.200 2.247 2.170 2.367 . 0 0 "[ . 1 . 2 . ]" 1
193 1 19 ILE MD 1 49 VAL H 1.800 . 5.200 2.872 2.492 3.164 . 0 0 "[ . 1 . 2 . ]" 1
194 1 19 ILE HA 1 19 ILE MG 1.800 . 4.200 2.589 2.403 2.709 . 0 0 "[ . 1 . 2 . ]" 1
195 1 19 ILE HA 1 22 GLU QB 1.800 . 4.200 2.476 2.279 2.875 . 0 0 "[ . 1 . 2 . ]" 1
196 1 19 ILE H 1 19 ILE QG 1.800 . 3.200 2.582 2.262 2.805 . 0 0 "[ . 1 . 2 . ]" 1
197 1 19 ILE HA 1 22 GLU QG 1.800 . 5.200 3.254 2.186 4.282 . 0 0 "[ . 1 . 2 . ]" 1
198 1 19 ILE HA 1 38 VAL QG 1.800 . 4.200 2.487 2.225 2.747 . 0 0 "[ . 1 . 2 . ]" 1
199 1 19 ILE H 1 19 ILE MG 1.800 . 4.200 3.600 3.534 3.675 . 0 0 "[ . 1 . 2 . ]" 1
200 1 19 ILE HB 1 38 VAL QG 1.800 . 5.200 3.724 3.481 4.042 . 0 0 "[ . 1 . 2 . ]" 1
201 1 19 ILE HA 1 23 LEU QD 1.800 . 5.200 3.770 3.192 5.091 . 0 0 "[ . 1 . 2 . ]" 1
202 1 19 ILE HB 1 49 VAL QG 1.800 . 5.200 3.557 3.075 3.895 . 0 0 "[ . 1 . 2 . ]" 1
203 1 19 ILE HA 1 34 LEU QD 1.800 . 4.200 2.420 1.788 3.198 0.012 18 0 "[ . 1 . 2 . ]" 1
204 1 19 ILE HB 1 34 LEU QD 1.800 . 5.200 3.719 3.488 3.989 . 0 0 "[ . 1 . 2 . ]" 1
205 1 19 ILE HB 1 52 LEU QD 1.800 . 4.200 2.831 2.348 3.201 . 0 0 "[ . 1 . 2 . ]" 1
206 1 19 ILE MD 1 38 VAL HB 1.800 . 5.200 4.121 3.750 4.520 . 0 0 "[ . 1 . 2 . ]" 1
207 1 19 ILE MG 1 20 LEU QD 1.800 . 4.200 3.272 2.620 3.688 . 0 0 "[ . 1 . 2 . ]" 1
208 1 19 ILE H 1 38 VAL QG 1.800 . 5.200 3.045 2.752 3.631 . 0 0 "[ . 1 . 2 . ]" 1
209 1 19 ILE H 1 19 ILE MD 1.800 . 4.200 3.575 3.137 3.801 . 0 0 "[ . 1 . 2 . ]" 1
210 1 19 ILE HB 1 20 LEU H 1.800 . 3.200 2.733 2.562 2.910 . 0 0 "[ . 1 . 2 . ]" 1
211 1 19 ILE MD 1 48 ARG QD 1.800 . 4.200 3.616 2.777 4.134 . 0 0 "[ . 1 . 2 . ]" 1
212 1 19 ILE MD 1 48 ARG QG 1.800 . 4.200 3.230 2.958 3.822 . 0 0 "[ . 1 . 2 . ]" 1
213 1 19 ILE MD 1 45 CYS QB 1.800 . 5.200 3.929 3.234 4.598 . 0 0 "[ . 1 . 2 . ]" 1
214 1 19 ILE QG 1 38 VAL QG 1.800 . 4.200 1.834 1.691 2.142 0.109 16 0 "[ . 1 . 2 . ]" 1
215 1 19 ILE MD 1 48 ARG H 1.800 . 5.200 4.073 3.511 4.466 . 0 0 "[ . 1 . 2 . ]" 1
216 1 19 ILE HA 1 20 LEU H 1.800 . 4.200 3.559 3.527 3.594 . 0 0 "[ . 1 . 2 . ]" 1
217 1 19 ILE MD 1 19 ILE QG 1.800 . 4.200 1.899 1.879 1.917 . 0 0 "[ . 1 . 2 . ]" 1
218 1 19 ILE MD 1 19 ILE MG 1.800 . 4.200 1.937 1.743 2.270 0.057 19 0 "[ . 1 . 2 . ]" 1
219 1 19 ILE MD 1 38 VAL QG 1.800 . 5.200 2.770 2.418 3.067 . 0 0 "[ . 1 . 2 . ]" 1
220 1 19 ILE H 1 34 LEU QD 1.800 . 5.200 4.441 3.884 5.012 . 0 0 "[ . 1 . 2 . ]" 1
221 1 19 ILE H 1 52 LEU QD 1.800 . 5.200 4.038 3.615 4.355 . 0 0 "[ . 1 . 2 . ]" 1
222 1 19 ILE MD 1 35 SER HA 1.800 . 5.200 4.495 4.052 5.134 . 0 0 "[ . 1 . 2 . ]" 1
223 1 19 ILE MG 1 20 LEU HA 1.800 . 4.200 3.222 2.885 3.496 . 0 0 "[ . 1 . 2 . ]" 1
224 1 19 ILE MG 1 20 LEU HG 1.800 . 4.200 3.077 2.573 3.491 . 0 0 "[ . 1 . 2 . ]" 1
225 1 19 ILE MG 1 20 LEU H 1.800 . 4.200 3.049 2.528 3.350 . 0 0 "[ . 1 . 2 . ]" 1
226 1 19 ILE MD 1 45 CYS HA 1.800 . 4.200 2.912 1.831 3.488 . 0 0 "[ . 1 . 2 . ]" 1
227 1 19 ILE MG 1 49 VAL HB 1.800 . 5.200 3.493 2.757 4.082 . 0 0 "[ . 1 . 2 . ]" 1
228 1 19 ILE MG 1 49 VAL H 1.800 . 5.200 3.953 3.545 4.241 . 0 0 "[ . 1 . 2 . ]" 1
229 1 19 ILE MD 1 49 VAL QG 1.800 . 5.200 2.298 1.816 2.811 . 0 0 "[ . 1 . 2 . ]" 1
230 1 19 ILE HA 1 19 ILE MD 1.800 . 4.200 3.747 3.697 3.823 . 0 0 "[ . 1 . 2 . ]" 1
231 1 20 LEU QD 1 58 ILE QG 1.800 . 4.200 3.397 2.695 3.762 . 0 0 "[ . 1 . 2 . ]" 1
232 1 20 LEU QD 1 58 ILE MG 1.800 . 4.200 3.817 3.368 4.173 . 0 0 "[ . 1 . 2 . ]" 1
233 1 20 LEU QD 1 20 LEU HG 1.800 . 4.200 1.898 1.879 1.915 . 0 0 "[ . 1 . 2 . ]" 1
234 1 20 LEU QD 1 57 PHE HA 1.800 . 4.200 4.119 3.818 4.239 0.039 21 0 "[ . 1 . 2 . ]" 1
235 1 20 LEU H 1 20 LEU QD 1.800 . 5.200 3.139 2.819 3.338 . 0 0 "[ . 1 . 2 . ]" 1
236 1 20 LEU QD 1 24 GLN H 1.800 . 5.200 4.857 4.291 5.181 . 0 0 "[ . 1 . 2 . ]" 1
237 1 20 LEU QB 1 20 LEU QD 1.800 . 4.200 1.894 1.818 1.937 . 0 0 "[ . 1 . 2 . ]" 1
238 1 20 LEU QD 1 52 LEU QB 1.800 . 4.200 2.493 2.042 2.992 . 0 0 "[ . 1 . 2 . ]" 1
239 1 20 LEU H 1 52 LEU QD 1.800 . 5.200 3.158 2.786 3.653 . 0 0 "[ . 1 . 2 . ]" 1
240 1 20 LEU QD 1 52 LEU HA 1.800 . 5.200 3.879 3.413 4.478 . 0 0 "[ . 1 . 2 . ]" 1
241 1 20 LEU QB 1 21 ASN H 1.800 . 3.200 2.528 2.386 2.657 . 0 0 "[ . 1 . 2 . ]" 1
242 1 20 LEU HA 1 20 LEU QD 1.800 . 4.200 2.042 1.816 2.325 . 0 0 "[ . 1 . 2 . ]" 1
243 1 20 LEU HA 1 20 LEU HG 1.800 . 4.200 2.703 2.506 2.953 . 0 0 "[ . 1 . 2 . ]" 1
244 1 20 LEU HA 1 24 GLN H 1.800 . 5.200 4.115 3.858 4.433 . 0 0 "[ . 1 . 2 . ]" 1
245 1 20 LEU QD 1 57 PHE QB 1.800 . 4.200 2.368 1.794 2.736 0.006 17 0 "[ . 1 . 2 . ]" 1
246 1 20 LEU H 1 20 LEU HG 1.800 . 3.200 2.473 1.922 2.906 . 0 0 "[ . 1 . 2 . ]" 1
247 1 20 LEU HA 1 23 LEU QD 1.800 . 5.200 3.148 2.245 3.897 . 0 0 "[ . 1 . 2 . ]" 1
248 1 20 LEU HA 1 58 ILE MG 1.800 . 5.200 5.373 5.220 5.443 0.243 26 0 "[ . 1 . 2 . ]" 1
249 1 20 LEU QD 1 58 ILE H 1.800 . 5.200 4.890 4.298 5.195 . 0 0 "[ . 1 . 2 . ]" 1
250 1 20 LEU HA 1 23 LEU H 1.800 . 3.200 3.302 3.209 3.418 0.218 19 0 "[ . 1 . 2 . ]" 1
251 1 21 ASN QB 1 22 GLU HA 1.800 . 5.200 4.158 3.912 4.482 . 0 0 "[ . 1 . 2 . ]" 1
252 1 21 ASN QB 1 22 GLU H 1.800 . 3.200 2.681 2.251 2.872 . 0 0 "[ . 1 . 2 . ]" 1
253 1 21 ASN H 1 21 ASN QB 1.800 . 3.200 2.102 1.925 2.232 . 0 0 "[ . 1 . 2 . ]" 1
254 1 21 ASN QB 1 24 GLN QB 1.800 . 5.200 4.489 4.290 4.729 . 0 0 "[ . 1 . 2 . ]" 1
255 1 21 ASN HA 1 24 GLN QG 1.800 . 4.200 4.030 3.526 4.268 0.068 16 0 "[ . 1 . 2 . ]" 1
256 1 21 ASN QB 1 22 GLU QG 1.800 . 5.200 3.552 2.777 5.118 . 0 0 "[ . 1 . 2 . ]" 1
257 1 21 ASN HA 1 24 GLN H 1.800 . 5.200 3.539 3.376 3.776 . 0 0 "[ . 1 . 2 . ]" 1
258 1 21 ASN HA 1 25 LYS H 1.800 . 5.200 4.155 3.761 4.564 . 0 0 "[ . 1 . 2 . ]" 1
259 1 21 ASN HA 1 22 GLU H 1.800 . 4.200 3.528 3.498 3.574 . 0 0 "[ . 1 . 2 . ]" 1
260 1 22 GLU HA 1 29 ILE MD 1.800 . 5.200 5.003 4.220 5.240 0.040 7 0 "[ . 1 . 2 . ]" 1
261 1 22 GLU QB 1 23 LEU H 1.800 . 3.200 2.691 2.375 3.339 0.139 22 0 "[ . 1 . 2 . ]" 1
262 1 22 GLU QG 1 37 ARG QD 1.800 . 4.200 3.243 1.865 4.295 0.095 3 0 "[ . 1 . 2 . ]" 1
263 1 22 GLU HA 1 22 GLU QG 1.800 . 4.200 2.580 2.094 3.424 . 0 0 "[ . 1 . 2 . ]" 1
264 1 22 GLU QG 1 23 LEU H 1.800 . 5.200 3.948 1.946 4.496 . 0 0 "[ . 1 . 2 . ]" 1
265 1 22 GLU QG 1 29 ILE MD 1.800 . 5.200 4.350 3.368 5.209 0.009 17 0 "[ . 1 . 2 . ]" 1
266 1 22 GLU QB 1 22 GLU QG 1.800 . 4.200 2.049 1.996 2.108 . 0 0 "[ . 1 . 2 . ]" 1
267 1 22 GLU HA 1 25 LYS QB 1.800 . 3.200 2.940 2.289 3.284 0.084 26 0 "[ . 1 . 2 . ]" 1
268 1 22 GLU HA 1 25 LYS H 1.800 . 3.200 3.360 3.292 3.427 0.227 19 0 "[ . 1 . 2 . ]" 1
269 1 22 GLU HA 1 25 LYS QE 1.800 . 3.200 2.867 1.919 3.241 0.041 15 0 "[ . 1 . 2 . ]" 1
270 1 22 GLU HA 1 25 LYS QG 1.800 . 4.200 2.797 1.933 4.164 . 0 0 "[ . 1 . 2 . ]" 1
271 1 22 GLU HA 1 29 ILE MG 1.800 . 5.200 5.199 4.813 5.369 0.169 20 0 "[ . 1 . 2 . ]" 1
272 1 22 GLU QG 1 38 VAL QG 1.800 . 5.200 2.748 1.985 3.579 . 0 0 "[ . 1 . 2 . ]" 1
273 1 22 GLU QG 1 34 LEU QD 1.800 . 4.200 3.437 1.766 4.187 0.034 16 0 "[ . 1 . 2 . ]" 1
274 1 22 GLU HA 1 23 LEU H 1.800 . 4.200 3.545 3.508 3.586 . 0 0 "[ . 1 . 2 . ]" 1
275 1 22 GLU H 1 22 GLU QG 1.800 . 3.200 2.634 2.088 3.264 0.064 8 0 "[ . 1 . 2 . ]" 1
276 1 23 LEU QD 1 49 VAL QG 1.800 . 5.200 2.638 2.105 2.932 . 0 0 "[ . 1 . 2 . ]" 1
277 1 23 LEU QD 1 34 LEU QB 1.800 . 5.200 3.740 3.230 4.353 . 0 0 "[ . 1 . 2 . ]" 1
278 1 23 LEU HG 1 34 LEU QD 1.800 . 4.200 2.862 1.785 4.223 0.023 18 0 "[ . 1 . 2 . ]" 1
279 1 23 LEU QD 1 58 ILE QG 1.800 . 5.200 4.702 2.972 5.327 0.127 3 0 "[ . 1 . 2 . ]" 1
280 1 23 LEU QB 1 24 GLN H 1.800 . 5.200 2.719 2.539 2.996 . 0 0 "[ . 1 . 2 . ]" 1
281 1 23 LEU QD 1 28 ARG QD 1.800 . 5.200 5.175 4.777 5.317 0.117 22 0 "[ . 1 . 2 . ]" 1
282 1 23 LEU QD 1 24 GLN H 1.800 . 5.200 3.931 3.645 4.203 . 0 0 "[ . 1 . 2 . ]" 1
283 1 23 LEU QD 1 26 ASP H 1.800 . 5.200 4.391 4.016 4.785 . 0 0 "[ . 1 . 2 . ]" 1
284 1 23 LEU QD 1 49 VAL HA 1.800 . 5.200 4.848 3.888 5.248 0.048 1 0 "[ . 1 . 2 . ]" 1
285 1 23 LEU HA 1 24 GLN H 1.800 . 5.200 3.531 3.462 3.572 . 0 0 "[ . 1 . 2 . ]" 1
286 1 23 LEU HA 1 29 ILE MD 1.800 . 5.200 4.318 3.455 4.742 . 0 0 "[ . 1 . 2 . ]" 1
287 1 23 LEU H 1 34 LEU QD 1.800 . 5.200 3.839 3.253 4.477 . 0 0 "[ . 1 . 2 . ]" 1
288 1 23 LEU HA 1 26 ASP H 1.800 . 4.200 3.465 3.156 3.974 . 0 0 "[ . 1 . 2 . ]" 1
289 1 23 LEU HA 1 25 LYS H 1.800 . 5.200 4.502 4.307 4.717 . 0 0 "[ . 1 . 2 . ]" 1
290 1 23 LEU QD 1 62 THR MG 1.800 . 5.200 2.619 1.778 4.237 0.022 22 0 "[ . 1 . 2 . ]" 1
291 1 23 LEU HA 1 27 GLY QA 1.800 . 4.200 3.305 2.552 4.071 . 0 0 "[ . 1 . 2 . ]" 1
292 1 23 LEU QD 1 29 ILE HA 1.800 . 5.200 4.934 4.727 5.276 0.076 10 0 "[ . 1 . 2 . ]" 1
293 1 23 LEU QD 1 29 ILE HB 1.800 . 5.200 4.110 3.810 4.445 . 0 0 "[ . 1 . 2 . ]" 1
294 1 23 LEU QD 1 29 ILE H 1.800 . 5.200 3.254 2.914 3.764 . 0 0 "[ . 1 . 2 . ]" 1
295 1 23 LEU HA 1 29 ILE MG 1.800 . 5.200 2.640 2.203 2.940 . 0 0 "[ . 1 . 2 . ]" 1
296 1 23 LEU QB 1 23 LEU QD 1.800 . 4.200 1.966 1.781 2.076 0.019 19 0 "[ . 1 . 2 . ]" 1
297 1 23 LEU HA 1 29 ILE H 1.800 . 5.200 4.607 4.209 5.213 0.013 26 0 "[ . 1 . 2 . ]" 1
298 1 23 LEU QD 1 27 GLY QA 1.800 . 4.200 2.752 1.771 3.416 0.029 11 0 "[ . 1 . 2 . ]" 1
299 1 23 LEU QD 1 61 TYR QB 1.800 . 5.200 2.240 1.695 5.269 0.105 2 0 "[ . 1 . 2 . ]" 1
300 1 23 LEU QD 1 27 GLY H 1.800 . 5.200 4.806 3.874 5.278 0.078 14 0 "[ . 1 . 2 . ]" 1
301 1 23 LEU HG 1 24 GLN H 1.800 . 5.200 4.962 4.391 5.259 0.059 23 0 "[ . 1 . 2 . ]" 1
302 1 23 LEU HA 1 27 GLY H 1.800 . 5.200 4.830 4.039 5.309 0.109 7 0 "[ . 1 . 2 . ]" 1
303 1 23 LEU H 1 23 LEU QB 1.800 . 3.200 2.030 1.925 2.224 . 0 0 "[ . 1 . 2 . ]" 1
304 1 23 LEU QD 1 23 LEU HG 1.800 . 4.200 1.893 1.879 1.910 . 0 0 "[ . 1 . 2 . ]" 1
305 1 23 LEU H 1 23 LEU QD 1.800 . 5.200 2.633 1.791 3.647 0.009 21 0 "[ . 1 . 2 . ]" 1
306 1 23 LEU QD 1 29 ILE MG 1.800 . 4.200 1.891 1.713 2.144 0.087 23 0 "[ . 1 . 2 . ]" 1
307 1 23 LEU HA 1 23 LEU QD 1.800 . 4.200 1.851 1.720 2.448 0.080 1 0 "[ . 1 . 2 . ]" 1
308 1 23 LEU HA 1 23 LEU HG 1.800 . 4.200 3.160 2.323 3.563 . 0 0 "[ . 1 . 2 . ]" 1
309 1 23 LEU QD 1 58 ILE MD 1.800 . 5.200 3.225 1.878 3.948 . 0 0 "[ . 1 . 2 . ]" 1
310 1 24 GLN H 1 24 GLN QB 1.800 . 3.200 2.093 1.937 2.210 . 0 0 "[ . 1 . 2 . ]" 1
311 1 24 GLN QB 1 25 LYS H 1.800 . 3.200 2.560 2.425 2.738 . 0 0 "[ . 1 . 2 . ]" 1
312 1 24 GLN H 1 24 GLN QG 1.800 . 4.200 3.653 2.553 3.996 . 0 0 "[ . 1 . 2 . ]" 1
313 1 24 GLN QG 1 25 LYS H 1.800 . 5.200 3.753 3.099 4.536 . 0 0 "[ . 1 . 2 . ]" 1
314 1 24 GLN HA 1 24 GLN QG 1.800 . 4.200 2.574 1.972 3.109 . 0 0 "[ . 1 . 2 . ]" 1
315 1 25 LYS HA 1 26 ASP QB 1.800 . 5.200 4.903 4.660 5.242 0.042 18 0 "[ . 1 . 2 . ]" 1
316 1 25 LYS H 1 26 ASP HA 1.800 . 5.200 5.161 5.064 5.281 0.081 15 0 "[ . 1 . 2 . ]" 1
317 1 25 LYS QE 1 25 LYS QG 1.800 . 4.200 2.157 1.900 2.592 . 0 0 "[ . 1 . 2 . ]" 1
318 1 25 LYS QB 1 26 ASP QB 1.800 . 4.200 3.980 3.163 4.268 0.068 15 0 "[ . 1 . 2 . ]" 1
319 1 25 LYS H 1 26 ASP QB 1.800 . 5.200 4.403 4.166 5.185 . 0 0 "[ . 1 . 2 . ]" 1
320 1 25 LYS QB 1 25 LYS QE 1.800 . 4.200 3.059 1.780 3.684 0.020 19 0 "[ . 1 . 2 . ]" 1
321 1 25 LYS HA 1 26 ASP HA 1.800 . 4.200 4.532 4.472 4.554 0.354 22 0 "[ . 1 . 2 . ]" 1
322 1 25 LYS HA 1 26 ASP H 1.800 . 4.200 3.500 3.434 3.569 . 0 0 "[ . 1 . 2 . ]" 1
323 1 25 LYS QB 1 26 ASP H 1.800 . 3.200 3.190 2.297 3.435 0.235 26 0 "[ . 1 . 2 . ]" 1
324 1 25 LYS H 1 25 LYS QB 1.800 . 3.200 2.082 1.940 2.338 . 0 0 "[ . 1 . 2 . ]" 1
325 1 25 LYS H 1 25 LYS QD 1.800 . 4.200 3.992 3.671 4.242 0.042 6 0 "[ . 1 . 2 . ]" 1
326 1 25 LYS H 1 25 LYS QE 1.800 . 5.200 4.555 3.223 5.136 . 0 0 "[ . 1 . 2 . ]" 1
327 1 25 LYS QG 1 26 ASP H 1.800 . 5.200 2.601 1.830 4.442 . 0 0 "[ . 1 . 2 . ]" 1
328 1 25 LYS H 1 25 LYS QG 1.800 . 3.200 2.795 2.208 3.295 0.095 1 0 "[ . 1 . 2 . ]" 1
329 1 26 ASP H 1 29 ILE MD 1.800 . 5.200 5.072 4.599 5.261 0.061 5 0 "[ . 1 . 2 . ]" 1
330 1 26 ASP QB 1 29 ILE HA 1.800 . 5.200 4.747 4.017 5.250 0.050 17 0 "[ . 1 . 2 . ]" 1
331 1 26 ASP QB 1 29 ILE HB 1.800 . 4.200 2.584 2.116 3.034 . 0 0 "[ . 1 . 2 . ]" 1
332 1 26 ASP QB 1 29 ILE H 1.800 . 5.200 4.090 3.209 5.253 0.053 25 0 "[ . 1 . 2 . ]" 1
333 1 26 ASP HA 1 27 GLY QA 1.800 . 4.200 4.155 4.065 4.256 0.056 11 0 "[ . 1 . 2 . ]" 1
334 1 26 ASP H 1 29 ILE MG 1.800 . 5.200 4.189 3.793 4.518 . 0 0 "[ . 1 . 2 . ]" 1
335 1 26 ASP QB 1 27 GLY H 1.800 . 5.200 3.933 3.831 4.002 . 0 0 "[ . 1 . 2 . ]" 1
336 1 26 ASP HA 1 29 ILE MG 1.800 . 5.200 4.687 4.140 5.210 0.010 3 0 "[ . 1 . 2 . ]" 1
337 1 26 ASP QB 1 29 ILE MD 1.800 . 4.200 2.916 2.427 3.990 . 0 0 "[ . 1 . 2 . ]" 1
338 1 26 ASP HA 1 28 ARG QD 1.800 . 4.200 2.959 1.930 4.312 0.112 8 0 "[ . 1 . 2 . ]" 1
339 1 26 ASP QB 1 29 ILE QG 1.800 . 4.200 4.173 3.793 4.279 0.079 3 0 "[ . 1 . 2 . ]" 1
340 1 26 ASP HA 1 27 GLY H 1.800 . 3.200 2.490 2.303 2.722 . 0 0 "[ . 1 . 2 . ]" 1
341 1 26 ASP QB 1 29 ILE MG 1.800 . 4.200 2.677 1.836 3.955 . 0 0 "[ . 1 . 2 . ]" 1
342 1 26 ASP H 1 26 ASP QB 1.800 . 3.200 2.468 2.268 3.147 . 0 0 "[ . 1 . 2 . ]" 1
343 1 27 GLY QA 1 28 ARG H 1.800 . 4.200 2.674 2.230 2.934 . 0 0 "[ . 1 . 2 . ]" 1
344 1 27 GLY H 1 28 ARG QG 1.800 . 5.200 4.444 2.930 5.231 0.031 26 0 "[ . 1 . 2 . ]" 1
345 1 27 GLY QA 1 29 ILE H 1.800 . 5.200 3.538 2.928 4.222 . 0 0 "[ . 1 . 2 . ]" 1
346 1 28 ARG H 1 28 ARG QG 1.800 . 3.200 2.594 1.816 3.256 0.056 25 0 "[ . 1 . 2 . ]" 1
347 1 28 ARG QB 1 29 ILE H 1.800 . 5.200 3.921 3.468 4.077 . 0 0 "[ . 1 . 2 . ]" 1
348 1 28 ARG HA 1 29 ILE H 1.800 . 3.200 2.980 2.420 3.234 0.034 15 0 "[ . 1 . 2 . ]" 1
349 1 28 ARG HA 1 28 ARG QD 1.800 . 4.200 3.635 2.963 4.009 . 0 0 "[ . 1 . 2 . ]" 1
350 1 28 ARG HA 1 29 ILE MG 1.800 . 5.200 4.463 4.095 4.783 . 0 0 "[ . 1 . 2 . ]" 1
351 1 28 ARG H 1 28 ARG QB 1.800 . 3.200 2.939 2.234 3.346 0.146 5 0 "[ . 1 . 2 . ]" 1
352 1 28 ARG H 1 28 ARG QD 1.800 . 4.200 2.318 1.805 3.323 . 0 0 "[ . 1 . 2 . ]" 1
353 1 29 ILE MD 1 37 ARG H 1.800 . 5.200 4.534 4.010 4.862 . 0 0 "[ . 1 . 2 . ]" 1
354 1 29 ILE HB 1 29 ILE MD 1.800 . 4.200 2.336 2.127 2.464 . 0 0 "[ . 1 . 2 . ]" 1
355 1 29 ILE MD 1 33 GLU HA 1.800 . 5.200 4.029 3.754 4.352 . 0 0 "[ . 1 . 2 . ]" 1
356 1 29 ILE HA 1 29 ILE QG 1.800 . 3.200 2.400 2.286 2.486 . 0 0 "[ . 1 . 2 . ]" 1
357 1 29 ILE MD 1 33 GLU H 1.800 . 5.200 4.371 3.990 4.829 . 0 0 "[ . 1 . 2 . ]" 1
358 1 29 ILE QG 1 34 LEU H 1.800 . 4.200 2.978 2.627 3.330 . 0 0 "[ . 1 . 2 . ]" 1
359 1 29 ILE HA 1 29 ILE MG 1.800 . 4.200 3.187 3.172 3.203 . 0 0 "[ . 1 . 2 . ]" 1
360 1 29 ILE MG 1 34 LEU HA 1.800 . 4.200 3.967 3.517 4.254 0.054 19 0 "[ . 1 . 2 . ]" 1
361 1 29 ILE QG 1 33 GLU QG 1.800 . 4.200 2.742 1.998 3.187 . 0 0 "[ . 1 . 2 . ]" 1
362 1 29 ILE H 1 29 ILE MG 1.800 . 3.200 1.901 1.800 2.203 . 0 0 "[ . 1 . 2 . ]" 1
363 1 29 ILE MG 1 34 LEU HG 1.800 . 5.200 2.560 2.076 4.540 . 0 0 "[ . 1 . 2 . ]" 1
364 1 29 ILE MG 1 34 LEU H 1.800 . 5.200 4.459 3.953 4.954 . 0 0 "[ . 1 . 2 . ]" 1
365 1 29 ILE QG 1 30 SER H 1.800 . 3.200 2.479 2.079 2.822 . 0 0 "[ . 1 . 2 . ]" 1
366 1 29 ILE QG 1 34 LEU QB 1.800 . 4.200 2.865 2.267 3.816 . 0 0 "[ . 1 . 2 . ]" 1
367 1 29 ILE MG 1 30 SER HA 1.800 . 5.200 4.171 3.775 4.440 . 0 0 "[ . 1 . 2 . ]" 1
368 1 29 ILE MG 1 30 SER H 1.800 . 5.200 3.811 3.426 4.056 . 0 0 "[ . 1 . 2 . ]" 1
369 1 29 ILE MD 1 33 GLU QG 1.800 . 4.200 2.430 1.804 3.141 . 0 0 "[ . 1 . 2 . ]" 1
370 1 29 ILE MD 1 34 LEU QB 1.800 . 4.200 3.040 2.287 3.459 . 0 0 "[ . 1 . 2 . ]" 1
371 1 29 ILE MD 1 31 ASN HA 1.800 . 5.200 4.838 4.199 5.193 . 0 0 "[ . 1 . 2 . ]" 1
372 1 29 ILE MD 1 29 ILE QG 1.800 . 4.200 1.892 1.878 1.917 . 0 0 "[ . 1 . 2 . ]" 1
373 1 29 ILE MD 1 29 ILE MG 1.800 . 4.200 1.918 1.749 2.274 0.051 18 0 "[ . 1 . 2 . ]" 1
374 1 29 ILE MG 1 33 GLU QB 1.800 . 5.200 4.116 3.718 4.498 . 0 0 "[ . 1 . 2 . ]" 1
375 1 29 ILE MG 1 33 GLU QG 1.800 . 5.200 4.804 4.179 5.191 . 0 0 "[ . 1 . 2 . ]" 1
376 1 29 ILE MG 1 34 LEU QD 1.800 . 4.200 2.455 1.850 2.969 . 0 0 "[ . 1 . 2 . ]" 1
377 1 29 ILE MD 1 34 LEU HA 1.800 . 4.200 2.271 1.856 2.830 . 0 0 "[ . 1 . 2 . ]" 1
378 1 29 ILE H 1 29 ILE MD 1.800 . 5.200 4.367 4.144 4.730 . 0 0 "[ . 1 . 2 . ]" 1
379 1 29 ILE MD 1 34 LEU HG 1.800 . 4.200 2.444 1.852 4.250 0.050 18 0 "[ . 1 . 2 . ]" 1
380 1 29 ILE MD 1 34 LEU H 1.800 . 5.200 3.103 2.716 3.555 . 0 0 "[ . 1 . 2 . ]" 1
381 1 29 ILE MD 1 30 SER H 1.800 . 5.200 4.201 3.852 4.516 . 0 0 "[ . 1 . 2 . ]" 1
382 1 29 ILE H 1 29 ILE HB 1.800 . 3.200 2.879 2.418 3.271 0.071 26 0 "[ . 1 . 2 . ]" 1
383 1 29 ILE QG 1 29 ILE MG 1.800 . 4.200 2.278 2.080 2.387 . 0 0 "[ . 1 . 2 . ]" 1
384 1 29 ILE HB 1 30 SER H 1.800 . 4.200 4.191 4.043 4.274 0.074 25 0 "[ . 1 . 2 . ]" 1
385 1 29 ILE HB 1 33 GLU QB 1.800 . 4.200 4.158 3.936 4.242 0.042 19 0 "[ . 1 . 2 . ]" 1
386 1 29 ILE HA 1 33 GLU QG 1.800 . 5.200 4.802 4.059 5.210 0.010 17 0 "[ . 1 . 2 . ]" 1
387 1 29 ILE HB 1 33 GLU QG 1.800 . 5.200 4.415 3.643 5.017 . 0 0 "[ . 1 . 2 . ]" 1
388 1 29 ILE HA 1 30 SER HA 1.800 . 4.200 4.430 4.390 4.442 0.242 17 0 "[ . 1 . 2 . ]" 1
389 1 29 ILE HA 1 30 SER H 1.800 . 3.200 2.254 2.191 2.339 . 0 0 "[ . 1 . 2 . ]" 1
390 1 29 ILE MD 1 37 ARG QD 1.800 . 4.200 2.231 1.761 3.145 0.039 20 0 "[ . 1 . 2 . ]" 1
391 1 29 ILE HB 1 34 LEU QD 1.800 . 5.200 4.813 4.001 5.263 0.063 23 0 "[ . 1 . 2 . ]" 1
392 1 29 ILE HA 1 29 ILE MD 1.800 . 4.200 3.798 3.683 3.877 . 0 0 "[ . 1 . 2 . ]" 1
393 1 29 ILE MG 1 31 ASN HA 1.800 . 5.200 4.823 4.579 5.180 . 0 0 "[ . 1 . 2 . ]" 1
394 1 29 ILE MG 1 37 ARG QD 1.800 . 5.200 4.182 3.613 4.865 . 0 0 "[ . 1 . 2 . ]" 1
395 1 30 SER HA 1 64 LEU QB 1.800 . 4.200 4.264 3.419 4.435 0.235 22 0 "[ . 1 . 2 . ]" 1
396 1 30 SER QB 1 33 GLU H 1.800 . 5.200 3.725 2.586 4.677 . 0 0 "[ . 1 . 2 . ]" 1
397 1 30 SER QB 1 31 ASN H 1.800 . 5.200 2.260 1.796 3.338 0.004 20 0 "[ . 1 . 2 . ]" 1
398 1 30 SER H 1 33 GLU QG 1.800 . 5.200 4.984 3.878 5.299 0.099 7 0 "[ . 1 . 2 . ]" 1
399 1 30 SER QB 1 33 GLU QB 1.800 . 5.200 4.051 2.904 4.860 . 0 0 "[ . 1 . 2 . ]" 1
400 1 30 SER HA 1 31 ASN H 1.800 . 5.200 2.993 2.303 3.579 . 0 0 "[ . 1 . 2 . ]" 1
401 1 30 SER QB 1 32 VAL HB 1.800 . 4.200 3.616 2.716 4.266 0.066 13 0 "[ . 1 . 2 . ]" 1
402 1 30 SER QB 1 32 VAL H 1.800 . 4.200 3.188 2.365 3.703 . 0 0 "[ . 1 . 2 . ]" 1
403 1 30 SER QB 1 32 VAL QG 1.800 . 5.200 3.627 2.825 4.167 . 0 0 "[ . 1 . 2 . ]" 1
404 1 31 ASN HA 1 32 VAL HA 1.800 . 5.200 4.955 4.911 4.991 . 0 0 "[ . 1 . 2 . ]" 1
405 1 31 ASN HA 1 32 VAL H 1.800 . 4.200 3.590 3.534 3.609 . 0 0 "[ . 1 . 2 . ]" 1
406 1 31 ASN QB 1 32 VAL HA 1.800 . 5.200 4.169 3.796 4.566 . 0 0 "[ . 1 . 2 . ]" 1
407 1 31 ASN QB 1 32 VAL H 1.800 . 3.200 2.929 2.287 3.274 0.074 3 0 "[ . 1 . 2 . ]" 1
408 1 31 ASN HA 1 34 LEU HA 1.800 . 4.200 4.460 4.401 4.588 0.388 23 0 "[ . 1 . 2 . ]" 1
409 1 31 ASN HA 1 34 LEU HG 1.800 . 4.200 4.087 3.242 4.253 0.053 21 0 "[ . 1 . 2 . ]" 1
410 1 31 ASN HA 1 34 LEU H 1.800 . 4.200 3.093 2.926 3.213 . 0 0 "[ . 1 . 2 . ]" 1
411 1 31 ASN HA 1 35 SER QB 1.800 . 4.200 4.363 4.301 4.419 0.219 18 0 "[ . 1 . 2 . ]" 1
412 1 31 ASN QB 1 32 VAL QG 1.800 . 5.200 3.744 3.261 4.171 . 0 0 "[ . 1 . 2 . ]" 1
413 1 31 ASN QB 1 46 LEU QD 1.800 . 4.200 1.949 1.740 2.634 0.060 6 0 "[ . 1 . 2 . ]" 1
414 1 31 ASN QB 1 34 LEU QB 1.800 . 5.200 3.414 3.262 3.643 . 0 0 "[ . 1 . 2 . ]" 1
415 1 31 ASN QB 1 65 LEU HA 1.800 . 4.200 4.000 3.269 4.272 0.072 24 0 "[ . 1 . 2 . ]" 1
416 1 31 ASN HA 1 35 SER H 1.800 . 4.200 3.950 3.268 4.084 . 0 0 "[ . 1 . 2 . ]" 1
417 1 31 ASN HA 1 32 VAL QG 1.800 . 5.200 4.839 4.693 4.998 . 0 0 "[ . 1 . 2 . ]" 1
418 1 31 ASN HA 1 49 VAL QG 1.800 . 4.200 4.223 3.994 4.406 0.206 10 0 "[ . 1 . 2 . ]" 1
419 1 31 ASN HA 1 34 LEU QB 1.800 . 3.200 1.761 1.722 1.800 0.078 14 0 "[ . 1 . 2 . ]" 1
420 1 31 ASN QB 1 46 LEU HG 1.800 . 4.200 2.295 1.851 3.318 . 0 0 "[ . 1 . 2 . ]" 1
421 1 31 ASN HA 1 34 LEU QD 1.800 . 4.200 2.539 2.228 3.503 . 0 0 "[ . 1 . 2 . ]" 1
422 1 31 ASN HA 1 33 GLU H 1.800 . 5.200 4.759 4.346 5.056 . 0 0 "[ . 1 . 2 . ]" 1
423 1 32 VAL QG 1 35 SER QB 1.800 . 5.200 3.901 3.801 3.998 . 0 0 "[ . 1 . 2 . ]" 1
424 1 32 VAL QG 1 33 GLU HA 1.800 . 4.200 3.340 3.026 3.741 . 0 0 "[ . 1 . 2 . ]" 1
425 1 32 VAL QG 1 33 GLU H 1.800 . 5.200 2.740 2.387 3.130 . 0 0 "[ . 1 . 2 . ]" 1
426 1 32 VAL HA 1 42 PRO HA 1.800 . 4.200 4.115 3.921 4.242 0.042 22 0 "[ . 1 . 2 . ]" 1
427 1 32 VAL H 1 32 VAL HB 1.800 . 3.200 2.450 2.226 2.665 . 0 0 "[ . 1 . 2 . ]" 1
428 1 32 VAL QG 1 42 PRO HA 1.800 . 5.200 4.783 4.655 4.879 . 0 0 "[ . 1 . 2 . ]" 1
429 1 32 VAL H 1 32 VAL QG 1.800 . 4.200 2.079 1.825 2.430 . 0 0 "[ . 1 . 2 . ]" 1
430 1 32 VAL HA 1 35 SER QB 1.800 . 4.200 2.889 2.737 2.960 . 0 0 "[ . 1 . 2 . ]" 1
431 1 32 VAL QG 1 42 PRO QB 1.800 . 4.200 2.832 2.603 3.006 . 0 0 "[ . 1 . 2 . ]" 1
432 1 32 VAL QG 1 34 LEU H 1.800 . 5.200 4.242 4.018 4.527 . 0 0 "[ . 1 . 2 . ]" 1
433 1 32 VAL QG 1 42 PRO QG 1.800 . 4.200 2.988 2.703 3.301 . 0 0 "[ . 1 . 2 . ]" 1
434 1 32 VAL QG 1 33 GLU QG 1.800 . 5.200 4.613 3.904 4.945 . 0 0 "[ . 1 . 2 . ]" 1
435 1 32 VAL HA 1 42 PRO QB 1.800 . 4.200 2.023 1.830 2.247 . 0 0 "[ . 1 . 2 . ]" 1
436 1 32 VAL QG 1 36 LYS QD 1.800 . 4.200 3.188 1.958 4.320 0.120 20 0 "[ . 1 . 2 . ]" 1
437 1 32 VAL QG 1 36 LYS QE 1.800 . 4.200 2.838 1.959 4.173 . 0 0 "[ . 1 . 2 . ]" 1
438 1 32 VAL HA 1 42 PRO QD 1.800 . 5.200 4.223 3.932 4.534 . 0 0 "[ . 1 . 2 . ]" 1
439 1 32 VAL QG 1 36 LYS QG 1.800 . 5.200 4.081 3.188 5.146 . 0 0 "[ . 1 . 2 . ]" 1
440 1 32 VAL HA 1 35 SER HA 1.800 . 5.200 5.396 5.328 5.447 0.247 16 0 "[ . 1 . 2 . ]" 1
441 1 32 VAL HA 1 42 PRO QG 1.800 . 4.200 3.091 2.697 3.413 . 0 0 "[ . 1 . 2 . ]" 1
442 1 32 VAL HA 1 35 SER H 1.800 . 4.200 3.504 3.318 3.669 . 0 0 "[ . 1 . 2 . ]" 1
443 1 32 VAL HA 1 32 VAL QG 1.800 . 4.200 2.067 1.991 2.167 . 0 0 "[ . 1 . 2 . ]" 1
444 1 32 VAL HB 1 32 VAL QG 1.800 . 4.200 1.899 1.880 1.917 . 0 0 "[ . 1 . 2 . ]" 1
445 1 32 VAL QG 1 36 LYS H 1.800 . 5.200 4.354 3.882 4.604 . 0 0 "[ . 1 . 2 . ]" 1
446 1 32 VAL HB 1 33 GLU H 1.800 . 4.200 2.160 2.019 2.442 . 0 0 "[ . 1 . 2 . ]" 1
447 1 33 GLU QG 1 34 LEU H 1.800 . 5.200 4.157 3.631 4.458 . 0 0 "[ . 1 . 2 . ]" 1
448 1 33 GLU QG 1 36 LYS QD 1.800 . 5.200 4.630 3.675 5.226 0.026 3 0 "[ . 1 . 2 . ]" 1
449 1 33 GLU HA 1 35 SER H 1.800 . 5.200 3.847 3.653 4.935 . 0 0 "[ . 1 . 2 . ]" 1
450 1 33 GLU HA 1 33 GLU QG 1.800 . 4.200 2.273 1.972 2.760 . 0 0 "[ . 1 . 2 . ]" 1
451 1 33 GLU H 1 34 LEU HA 1.800 . 5.200 5.244 5.175 5.295 0.095 20 0 "[ . 1 . 2 . ]" 1
452 1 33 GLU QG 1 37 ARG QD 1.800 . 4.200 3.213 1.800 4.241 0.041 24 0 "[ . 1 . 2 . ]" 1
453 1 33 GLU HA 1 36 LYS QE 1.800 . 4.200 3.635 2.130 4.233 0.033 20 0 "[ . 1 . 2 . ]" 1
454 1 33 GLU H 1 33 GLU QG 1.800 . 4.200 3.923 3.738 3.991 . 0 0 "[ . 1 . 2 . ]" 1
455 1 33 GLU HA 1 34 LEU H 1.800 . 5.200 3.512 3.473 3.560 . 0 0 "[ . 1 . 2 . ]" 1
456 1 33 GLU QG 1 34 LEU HA 1.800 . 5.200 4.554 3.640 5.173 . 0 0 "[ . 1 . 2 . ]" 1
457 1 34 LEU HA 1 34 LEU QD 1.800 . 4.200 2.120 1.850 2.554 . 0 0 "[ . 1 . 2 . ]" 1
458 1 34 LEU QD 1 37 ARG QD 1.800 . 5.200 3.813 1.855 4.927 . 0 0 "[ . 1 . 2 . ]" 1
459 1 34 LEU QB 1 34 LEU QD 1.800 . 4.200 1.925 1.804 2.033 . 0 0 "[ . 1 . 2 . ]" 1
460 1 34 LEU HG 1 49 VAL QG 1.800 . 5.200 4.364 3.620 4.955 . 0 0 "[ . 1 . 2 . ]" 1
461 1 34 LEU H 1 34 LEU HG 1.800 . 4.200 3.886 3.578 4.379 0.179 14 0 "[ . 1 . 2 . ]" 1
462 1 34 LEU HA 1 35 SER H 1.800 . 5.200 3.444 3.419 3.570 . 0 0 "[ . 1 . 2 . ]" 1
463 1 34 LEU QD 1 49 VAL QG 1.800 . 4.200 2.068 1.715 3.550 0.085 14 0 "[ . 1 . 2 . ]" 1
464 1 34 LEU H 1 34 LEU QB 1.800 . 3.200 1.983 1.917 2.141 . 0 0 "[ . 1 . 2 . ]" 1
465 1 34 LEU QD 1 34 LEU HG 1.800 . 4.200 1.899 1.880 1.914 . 0 0 "[ . 1 . 2 . ]" 1
466 1 34 LEU H 1 34 LEU QD 1.800 . 5.200 3.619 2.925 3.693 . 0 0 "[ . 1 . 2 . ]" 1
467 1 34 LEU HA 1 37 ARG H 1.800 . 4.200 3.803 3.050 4.205 0.005 3 0 "[ . 1 . 2 . ]" 1
468 1 34 LEU HA 1 37 ARG QB 1.800 . 4.200 2.980 1.954 4.123 . 0 0 "[ . 1 . 2 . ]" 1
469 1 34 LEU HA 1 37 ARG QD 1.800 . 4.200 3.356 1.731 4.252 0.069 17 0 "[ . 1 . 2 . ]" 1
470 1 34 LEU HA 1 37 ARG QG 1.800 . 4.200 3.309 1.792 4.250 0.050 10 0 "[ . 1 . 2 . ]" 1
471 1 34 LEU QD 1 38 VAL H 1.800 . 5.200 4.416 3.412 5.243 0.043 14 0 "[ . 1 . 2 . ]" 1
472 1 34 LEU QD 1 62 THR HA 1.800 . 5.200 3.908 2.914 5.258 0.058 18 0 "[ . 1 . 2 . ]" 1
473 1 34 LEU QD 1 62 THR HB 1.800 . 5.200 2.630 1.840 4.332 . 0 0 "[ . 1 . 2 . ]" 1
474 1 34 LEU HG 1 35 SER H 1.800 . 5.200 5.117 4.466 5.255 0.055 2 0 "[ . 1 . 2 . ]" 1
475 1 34 LEU HA 1 38 VAL QG 1.800 . 4.200 3.369 3.004 3.798 . 0 0 "[ . 1 . 2 . ]" 1
476 1 34 LEU QB 1 35 SER H 1.800 . 4.200 2.971 2.173 3.085 . 0 0 "[ . 1 . 2 . ]" 1
477 1 34 LEU HA 1 34 LEU HG 1.800 . 4.200 2.417 2.094 3.523 . 0 0 "[ . 1 . 2 . ]" 1
478 1 34 LEU QD 1 35 SER H 1.800 . 5.200 3.950 3.462 4.253 . 0 0 "[ . 1 . 2 . ]" 1
479 1 34 LEU HG 1 38 VAL QG 1.800 . 5.200 4.328 3.037 4.738 . 0 0 "[ . 1 . 2 . ]" 1
480 1 34 LEU HA 1 38 VAL H 1.800 . 5.200 4.674 3.962 4.916 . 0 0 "[ . 1 . 2 . ]" 1
481 1 34 LEU QB 1 49 VAL QG 1.800 . 5.200 3.738 3.389 4.202 . 0 0 "[ . 1 . 2 . ]" 1
482 1 35 SER QB 1 45 CYS QB 1.800 . 4.200 2.211 2.140 2.336 . 0 0 "[ . 1 . 2 . ]" 1
483 1 35 SER QB 1 38 VAL QG 1.800 . 4.200 3.915 3.560 4.330 0.130 16 0 "[ . 1 . 2 . ]" 1
484 1 35 SER QB 1 42 PRO QB 1.800 . 4.200 1.950 1.829 2.036 . 0 0 "[ . 1 . 2 . ]" 1
485 1 35 SER H 1 36 LYS QB 1.800 . 5.200 4.376 3.988 4.892 . 0 0 "[ . 1 . 2 . ]" 1
486 1 35 SER HA 1 40 LEU HG 1.800 . 5.200 3.022 2.131 5.601 0.401 23 0 "[ . 1 . 2 . ]" 1
487 1 35 SER H 1 42 PRO HA 1.800 . 5.200 4.117 3.624 4.270 . 0 0 "[ . 1 . 2 . ]" 1
488 1 35 SER HA 1 40 LEU H 1.800 . 4.200 3.970 3.375 4.135 . 0 0 "[ . 1 . 2 . ]" 1
489 1 35 SER QB 1 46 LEU QD 1.800 . 4.200 3.886 3.639 4.018 . 0 0 "[ . 1 . 2 . ]" 1
490 1 35 SER HA 1 36 LYS H 1.800 . 5.200 3.572 3.492 3.591 . 0 0 "[ . 1 . 2 . ]" 1
491 1 35 SER QB 1 40 LEU QB 1.800 . 4.200 4.398 3.750 4.505 0.305 15 0 "[ . 1 . 2 . ]" 1
492 1 35 SER HA 1 45 CYS QB 1.800 . 4.200 2.193 2.002 2.396 . 0 0 "[ . 1 . 2 . ]" 1
493 1 35 SER HA 1 37 ARG H 1.800 . 5.200 4.512 4.169 5.142 . 0 0 "[ . 1 . 2 . ]" 1
494 1 35 SER QB 1 40 LEU H 1.800 . 5.200 4.439 4.176 4.587 . 0 0 "[ . 1 . 2 . ]" 1
495 1 35 SER HA 1 38 VAL QG 1.800 . 5.200 2.574 2.196 3.051 . 0 0 "[ . 1 . 2 . ]" 1
496 1 35 SER HA 1 42 PRO QB 1.800 . 4.200 4.366 4.273 4.439 0.239 23 0 "[ . 1 . 2 . ]" 1
497 1 35 SER H 1 35 SER QB 1.800 . 3.200 2.268 2.014 2.332 . 0 0 "[ . 1 . 2 . ]" 1
498 1 35 SER HA 1 39 GLY H 1.800 . 5.200 4.994 4.674 5.288 0.088 17 0 "[ . 1 . 2 . ]" 1
499 1 35 SER QB 1 36 LYS H 1.800 . 4.200 3.271 3.164 3.500 . 0 0 "[ . 1 . 2 . ]" 1
500 1 35 SER HA 1 42 PRO HA 1.800 . 4.200 3.286 3.192 3.367 . 0 0 "[ . 1 . 2 . ]" 1
501 1 35 SER HA 1 46 LEU QD 1.800 . 5.200 5.424 5.328 5.522 0.322 21 0 "[ . 1 . 2 . ]" 1
502 1 35 SER HA 1 40 LEU QB 1.800 . 4.200 4.236 2.608 4.423 0.223 19 0 "[ . 1 . 2 . ]" 1
503 1 35 SER HA 1 40 LEU QD 1.800 . 5.200 2.335 1.859 4.139 . 0 0 "[ . 1 . 2 . ]" 1
504 1 35 SER H 1 38 VAL QG 1.800 . 5.200 3.936 3.565 4.449 . 0 0 "[ . 1 . 2 . ]" 1
505 1 35 SER QB 1 42 PRO HA 1.800 . 3.200 1.714 1.678 1.770 0.122 19 0 "[ . 1 . 2 . ]" 1
506 1 35 SER HA 1 38 VAL HB 1.800 . 5.200 5.006 3.063 5.332 0.132 14 0 "[ . 1 . 2 . ]" 1
507 1 35 SER HA 1 38 VAL H 1.800 . 4.200 4.096 3.575 4.246 0.046 11 0 "[ . 1 . 2 . ]" 1
508 1 36 LYS H 1 36 LYS QD 1.800 . 4.200 3.247 1.965 4.258 0.058 20 0 "[ . 1 . 2 . ]" 1
509 1 36 LYS H 1 36 LYS QG 1.800 . 4.200 2.508 1.858 3.857 . 0 0 "[ . 1 . 2 . ]" 1
510 1 36 LYS QB 1 37 ARG H 1.800 . 3.200 2.845 2.400 3.361 0.161 11 0 "[ . 1 . 2 . ]" 1
511 1 36 LYS H 1 38 VAL QG 1.800 . 5.200 3.950 3.385 4.743 . 0 0 "[ . 1 . 2 . ]" 1
512 1 36 LYS QG 1 37 ARG H 1.800 . 5.200 4.024 1.787 4.540 0.013 19 0 "[ . 1 . 2 . ]" 1
513 1 36 LYS QB 1 38 VAL H 1.800 . 5.200 4.535 4.190 4.747 . 0 0 "[ . 1 . 2 . ]" 1
514 1 36 LYS QB 1 36 LYS QE 1.800 . 4.200 2.864 1.885 3.682 . 0 0 "[ . 1 . 2 . ]" 1
515 1 37 ARG QG 1 38 VAL H 1.800 . 4.200 3.689 2.222 4.401 0.201 2 0 "[ . 1 . 2 . ]" 1
516 1 37 ARG H 1 38 VAL HA 1.800 . 5.200 5.257 5.151 5.379 0.179 11 0 "[ . 1 . 2 . ]" 1
517 1 37 ARG HA 1 39 GLY H 1.800 . 4.200 4.108 3.608 4.303 0.103 25 0 "[ . 1 . 2 . ]" 1
518 1 37 ARG QB 1 37 ARG QD 1.800 . 4.200 2.142 1.959 2.371 . 0 0 "[ . 1 . 2 . ]" 1
519 1 37 ARG H 1 37 ARG QB 1.800 . 3.200 2.179 1.935 2.575 . 0 0 "[ . 1 . 2 . ]" 1
520 1 37 ARG QB 1 38 VAL QG 1.800 . 4.200 3.016 2.404 3.646 . 0 0 "[ . 1 . 2 . ]" 1
521 1 37 ARG H 1 37 ARG QD 1.800 . 5.200 4.003 2.797 4.447 . 0 0 "[ . 1 . 2 . ]" 1
522 1 37 ARG H 1 38 VAL QG 1.800 . 5.200 3.202 3.022 3.512 . 0 0 "[ . 1 . 2 . ]" 1
523 1 37 ARG QB 1 39 GLY H 1.800 . 5.200 4.712 4.305 5.115 . 0 0 "[ . 1 . 2 . ]" 1
524 1 37 ARG HA 1 38 VAL H 1.800 . 3.200 3.422 3.393 3.526 0.326 23 0 "[ . 1 . 2 . ]" 1
525 1 37 ARG H 1 37 ARG QG 1.800 . 3.200 2.559 1.843 3.408 0.208 12 0 "[ . 1 . 2 . ]" 1
526 1 37 ARG QD 1 37 ARG QG 1.800 . 4.200 2.075 2.012 2.112 . 0 0 "[ . 1 . 2 . ]" 1
527 1 37 ARG HA 1 39 GLY QA 1.800 . 5.200 5.342 5.093 5.433 0.233 14 0 "[ . 1 . 2 . ]" 1
528 1 37 ARG QD 1 38 VAL QG 1.800 . 5.200 4.021 2.526 4.812 . 0 0 "[ . 1 . 2 . ]" 1
529 1 37 ARG QB 1 38 VAL H 1.800 . 4.200 3.144 2.574 3.669 . 0 0 "[ . 1 . 2 . ]" 1
530 1 37 ARG HA 1 37 ARG QD 1.800 . 4.200 3.863 2.688 4.525 0.325 19 0 "[ . 1 . 2 . ]" 1
531 1 37 ARG QD 1 38 VAL H 1.800 . 5.200 5.001 4.126 5.329 0.129 7 0 "[ . 1 . 2 . ]" 1
532 1 38 VAL HB 1 38 VAL QG 1.800 . 4.200 1.899 1.878 1.913 . 0 0 "[ . 1 . 2 . ]" 1
533 1 38 VAL QG 1 40 LEU HA 1.800 . 5.200 4.637 3.954 5.347 0.147 15 0 "[ . 1 . 2 . ]" 1
534 1 38 VAL QG 1 40 LEU HG 1.800 . 4.200 2.090 1.661 4.282 0.139 10 0 "[ . 1 . 2 . ]" 1
535 1 38 VAL QG 1 40 LEU H 1.800 . 4.200 2.668 1.940 3.525 . 0 0 "[ . 1 . 2 . ]" 1
536 1 38 VAL QG 1 45 CYS HA 1.800 . 4.200 3.906 3.410 4.303 0.103 15 0 "[ . 1 . 2 . ]" 1
537 1 38 VAL H 1 38 VAL HB 1.800 . 4.200 3.465 2.603 3.581 . 0 0 "[ . 1 . 2 . ]" 1
538 1 38 VAL HB 1 40 LEU QD 1.800 . 5.200 1.927 1.671 3.750 0.129 2 0 "[ . 1 . 2 . ]" 1
539 1 38 VAL QG 1 45 CYS QB 1.800 . 5.200 3.597 3.178 4.122 . 0 0 "[ . 1 . 2 . ]" 1
540 1 38 VAL QG 1 39 GLY H 1.800 . 5.200 2.633 2.033 3.650 . 0 0 "[ . 1 . 2 . ]" 1
541 1 38 VAL HB 1 40 LEU HG 1.800 . 4.200 3.753 3.502 4.409 0.209 17 0 "[ . 1 . 2 . ]" 1
542 1 38 VAL HB 1 40 LEU H 1.800 . 5.200 4.355 2.589 4.647 . 0 0 "[ . 1 . 2 . ]" 1
543 1 38 VAL HA 1 40 LEU H 1.800 . 5.200 5.134 4.183 5.307 0.107 15 0 "[ . 1 . 2 . ]" 1
544 1 38 VAL QG 1 40 LEU QB 1.800 . 5.200 3.375 1.875 3.837 . 0 0 "[ . 1 . 2 . ]" 1
545 1 38 VAL QG 1 40 LEU QD 1.800 . 4.200 1.795 1.585 2.800 0.215 15 0 "[ . 1 . 2 . ]" 1
546 1 38 VAL H 1 38 VAL QG 1.800 . 3.200 1.767 1.719 2.216 0.081 24 0 "[ . 1 . 2 . ]" 1
547 1 38 VAL HB 1 39 GLY H 1.800 . 5.200 3.897 3.695 4.371 . 0 0 "[ . 1 . 2 . ]" 1
548 1 38 VAL H 1 39 GLY QA 1.800 . 5.200 4.133 4.032 4.447 . 0 0 "[ . 1 . 2 . ]" 1
549 1 38 VAL HA 1 39 GLY H 1.800 . 3.200 3.360 3.112 3.466 0.266 25 0 "[ . 1 . 2 . ]" 1
550 1 38 VAL HA 1 38 VAL QG 1.800 . 4.200 2.079 1.963 2.266 . 0 0 "[ . 1 . 2 . ]" 1
551 1 39 GLY QA 1 40 LEU QD 1.800 . 5.200 3.379 2.791 4.936 . 0 0 "[ . 1 . 2 . ]" 1
552 1 39 GLY QA 1 40 LEU HA 1.800 . 5.200 4.042 4.026 4.070 . 0 0 "[ . 1 . 2 . ]" 1
553 1 39 GLY QA 1 40 LEU H 1.800 . 4.200 2.764 2.697 2.881 . 0 0 "[ . 1 . 2 . ]" 1
554 1 40 LEU HG 1 41 SER H 1.800 . 4.200 4.208 3.015 4.413 0.213 2 0 "[ . 1 . 2 . ]" 1
555 1 40 LEU QB 1 44 PRO QB 1.800 . 4.200 3.919 3.698 4.454 0.254 23 0 "[ . 1 . 2 . ]" 1
556 1 40 LEU QB 1 44 PRO QG 1.800 . 5.200 3.092 2.861 3.866 . 0 0 "[ . 1 . 2 . ]" 1
557 1 40 LEU H 1 40 LEU QB 1.800 . 5.200 3.133 2.258 3.280 . 0 0 "[ . 1 . 2 . ]" 1
558 1 40 LEU QD 1 40 LEU HG 1.800 . 4.200 1.895 1.886 1.909 . 0 0 "[ . 1 . 2 . ]" 1
559 1 40 LEU H 1 40 LEU QD 1.800 . 5.200 2.832 2.333 3.847 . 0 0 "[ . 1 . 2 . ]" 1
560 1 40 LEU QB 1 45 CYS HA 1.800 . 4.200 3.849 2.972 4.321 0.121 15 0 "[ . 1 . 2 . ]" 1
561 1 40 LEU QB 1 45 CYS H 1.800 . 5.200 3.919 3.591 4.332 . 0 0 "[ . 1 . 2 . ]" 1
562 1 40 LEU HA 1 40 LEU HG 1.800 . 4.200 3.433 2.761 3.513 . 0 0 "[ . 1 . 2 . ]" 1
563 1 40 LEU HG 1 45 CYS QB 1.800 . 5.200 3.527 2.528 4.934 . 0 0 "[ . 1 . 2 . ]" 1
564 1 40 LEU QD 1 45 CYS HA 1.800 . 4.200 1.859 1.682 2.067 0.118 15 0 "[ . 1 . 2 . ]" 1
565 1 40 LEU QD 1 45 CYS H 1.800 . 5.200 2.753 2.201 3.070 . 0 0 "[ . 1 . 2 . ]" 1
566 1 40 LEU QB 1 45 CYS QB 1.800 . 4.200 3.620 2.399 4.158 . 0 0 "[ . 1 . 2 . ]" 1
567 1 40 LEU QD 1 44 PRO HA 1.800 . 5.200 4.990 3.663 5.258 0.058 19 0 "[ . 1 . 2 . ]" 1
568 1 40 LEU HA 1 40 LEU QD 1.800 . 4.200 3.238 1.771 3.430 0.029 23 0 "[ . 1 . 2 . ]" 1
569 1 40 LEU QD 1 44 PRO QB 1.800 . 5.200 3.390 1.733 3.728 0.067 16 0 "[ . 1 . 2 . ]" 1
570 1 40 LEU QD 1 44 PRO QG 1.800 . 5.200 2.988 1.777 3.428 0.023 23 0 "[ . 1 . 2 . ]" 1
571 1 40 LEU QB 1 41 SER H 1.800 . 5.200 2.630 2.307 3.783 . 0 0 "[ . 1 . 2 . ]" 1
572 1 40 LEU QB 1 42 PRO HA 1.800 . 5.200 5.296 4.615 5.499 0.299 15 0 "[ . 1 . 2 . ]" 1
573 1 40 LEU QD 1 41 SER H 1.800 . 5.200 3.462 1.824 3.852 . 0 0 "[ . 1 . 2 . ]" 1
574 1 40 LEU H 1 40 LEU HG 1.800 . 4.200 2.216 1.855 4.338 0.138 23 0 "[ . 1 . 2 . ]" 1
575 1 40 LEU QD 1 42 PRO HA 1.800 . 5.200 3.719 3.347 4.460 . 0 0 "[ . 1 . 2 . ]" 1
576 1 40 LEU QD 1 49 VAL HB 1.800 . 5.200 5.391 5.258 5.493 0.293 11 0 "[ . 1 . 2 . ]" 1
577 1 40 LEU HA 1 41 SER H 1.800 . 5.200 2.404 2.245 2.479 . 0 0 "[ . 1 . 2 . ]" 1
578 1 40 LEU QB 1 40 LEU QD 1.800 . 4.200 1.752 1.694 1.928 0.106 4 0 "[ . 1 . 2 . ]" 1
579 1 40 LEU HG 1 45 CYS HA 1.800 . 5.200 4.361 3.374 4.744 . 0 0 "[ . 1 . 2 . ]" 1
580 1 40 LEU HG 1 45 CYS H 1.800 . 5.200 4.955 2.391 5.279 0.079 5 0 "[ . 1 . 2 . ]" 1
581 1 40 LEU QD 1 48 ARG QD 1.800 . 5.200 2.981 1.823 3.550 . 0 0 "[ . 1 . 2 . ]" 1
582 1 40 LEU QD 1 45 CYS QB 1.800 . 5.200 1.888 1.733 2.751 0.067 5 0 "[ . 1 . 2 . ]" 1
583 1 41 SER QB 1 43 THR HB 1.800 . 4.200 2.988 2.743 3.819 . 0 0 "[ . 1 . 2 . ]" 1
584 1 41 SER H 1 44 PRO QD 1.800 . 5.200 3.901 3.787 4.058 . 0 0 "[ . 1 . 2 . ]" 1
585 1 41 SER QB 1 43 THR H 1.800 . 5.200 2.997 2.859 3.160 . 0 0 "[ . 1 . 2 . ]" 1
586 1 41 SER H 1 44 PRO QG 1.800 . 4.200 2.750 2.530 2.994 . 0 0 "[ . 1 . 2 . ]" 1
587 1 41 SER HA 1 42 PRO QB 1.800 . 4.200 4.517 4.449 4.535 0.335 17 0 "[ . 1 . 2 . ]" 1
588 1 41 SER HA 1 42 PRO QD 1.800 . 3.200 2.049 1.999 2.077 . 0 0 "[ . 1 . 2 . ]" 1
589 1 41 SER HA 1 42 PRO QG 1.800 . 4.200 3.988 3.950 4.020 . 0 0 "[ . 1 . 2 . ]" 1
590 1 41 SER H 1 42 PRO QD 1.800 . 5.200 4.369 4.351 4.380 . 0 0 "[ . 1 . 2 . ]" 1
591 1 41 SER H 1 41 SER QB 1.800 . 3.200 2.213 1.964 2.875 . 0 0 "[ . 1 . 2 . ]" 1
592 1 41 SER QB 1 44 PRO QB 1.800 . 5.200 3.871 3.579 4.332 . 0 0 "[ . 1 . 2 . ]" 1
593 1 41 SER QB 1 42 PRO HA 1.800 . 4.200 4.455 4.406 4.500 0.300 23 0 "[ . 1 . 2 . ]" 1
594 1 41 SER QB 1 44 PRO QD 1.800 . 4.200 1.960 1.790 2.141 0.010 23 0 "[ . 1 . 2 . ]" 1
595 1 41 SER QB 1 44 PRO QG 1.800 . 4.200 2.138 1.830 2.631 . 0 0 "[ . 1 . 2 . ]" 1
596 1 41 SER HA 1 42 PRO HA 1.800 . 4.200 4.302 4.260 4.310 0.110 19 0 "[ . 1 . 2 . ]" 1
597 1 41 SER QB 1 42 PRO QD 1.800 . 4.200 2.269 2.041 2.558 . 0 0 "[ . 1 . 2 . ]" 1
598 1 41 SER QB 1 42 PRO QG 1.800 . 4.200 3.854 3.719 4.014 . 0 0 "[ . 1 . 2 . ]" 1
599 1 41 SER H 1 44 PRO QB 1.800 . 5.200 4.477 4.146 4.788 . 0 0 "[ . 1 . 2 . ]" 1
600 1 42 PRO QD 1 42 PRO QG 1.800 . 4.200 1.955 1.945 1.960 . 0 0 "[ . 1 . 2 . ]" 1
601 1 42 PRO HA 1 44 PRO QD 1.800 . 5.200 3.582 3.462 3.810 . 0 0 "[ . 1 . 2 . ]" 1
602 1 42 PRO HA 1 45 CYS QB 1.800 . 4.200 1.740 1.716 1.785 0.084 20 0 "[ . 1 . 2 . ]" 1
603 1 42 PRO QB 1 43 THR H 1.800 . 4.200 2.935 2.774 3.034 . 0 0 "[ . 1 . 2 . ]" 1
604 1 42 PRO HA 1 42 PRO QD 1.800 . 4.200 3.415 3.388 3.444 . 0 0 "[ . 1 . 2 . ]" 1
605 1 42 PRO QD 1 43 THR H 1.800 . 5.200 2.508 2.383 2.610 . 0 0 "[ . 1 . 2 . ]" 1
606 1 42 PRO QG 1 43 THR HA 1.800 . 5.200 4.141 4.095 4.207 . 0 0 "[ . 1 . 2 . ]" 1
607 1 42 PRO HA 1 43 THR H 1.800 . 4.200 3.586 3.571 3.598 . 0 0 "[ . 1 . 2 . ]" 1
608 1 42 PRO QG 1 43 THR H 1.800 . 4.200 2.123 1.983 2.262 . 0 0 "[ . 1 . 2 . ]" 1
609 1 42 PRO HA 1 45 CYS HA 1.800 . 4.200 4.406 4.305 4.547 0.347 23 0 "[ . 1 . 2 . ]" 1
610 1 42 PRO HA 1 45 CYS H 1.800 . 4.200 3.080 2.933 3.182 . 0 0 "[ . 1 . 2 . ]" 1
611 1 43 THR MG 1 46 LEU QB 1.800 . 5.200 4.593 4.355 4.771 . 0 0 "[ . 1 . 2 . ]" 1
612 1 43 THR HA 1 43 THR MG 1.800 . 4.200 2.607 1.948 2.724 . 0 0 "[ . 1 . 2 . ]" 1
613 1 43 THR MG 1 46 LEU QD 1.800 . 5.200 3.856 3.333 4.063 . 0 0 "[ . 1 . 2 . ]" 1
614 1 43 THR H 1 43 THR HB 1.800 . 3.200 2.300 2.143 3.227 0.027 17 0 "[ . 1 . 2 . ]" 1
615 1 43 THR HA 1 44 PRO QD 1.800 . 4.200 3.468 3.460 3.478 . 0 0 "[ . 1 . 2 . ]" 1
616 1 43 THR HA 1 45 CYS H 1.800 . 5.200 4.842 4.699 5.057 . 0 0 "[ . 1 . 2 . ]" 1
617 1 43 THR HB 1 44 PRO QD 1.800 . 3.200 1.758 1.729 1.798 0.071 6 0 "[ . 1 . 2 . ]" 1
618 1 43 THR H 1 43 THR MG 1.800 . 5.200 3.612 3.268 3.694 . 0 0 "[ . 1 . 2 . ]" 1
619 1 43 THR HA 1 46 LEU HG 1.800 . 5.200 5.129 4.788 5.258 0.058 18 0 "[ . 1 . 2 . ]" 1
620 1 43 THR HA 1 46 LEU H 1.800 . 5.200 4.272 4.033 4.407 . 0 0 "[ . 1 . 2 . ]" 1
621 1 43 THR MG 1 46 LEU H 1.800 . 5.200 5.110 4.977 5.344 0.144 24 0 "[ . 1 . 2 . ]" 1
622 1 43 THR H 1 44 PRO QD 1.800 . 3.200 2.307 2.224 2.383 . 0 0 "[ . 1 . 2 . ]" 1
623 1 43 THR MG 1 44 PRO QB 1.800 . 5.200 3.357 3.004 5.110 . 0 0 "[ . 1 . 2 . ]" 1
624 1 43 THR MG 1 44 PRO QD 1.800 . 4.200 2.065 1.797 3.388 0.003 11 0 "[ . 1 . 2 . ]" 1
625 1 43 THR MG 1 44 PRO QG 1.800 . 5.200 3.537 3.250 4.963 . 0 0 "[ . 1 . 2 . ]" 1
626 1 43 THR MG 1 47 GLU QG 1.800 . 4.200 3.859 2.937 4.220 0.020 24 0 "[ . 1 . 2 . ]" 1
627 1 43 THR HA 1 46 LEU QB 1.800 . 4.200 3.795 3.217 4.116 . 0 0 "[ . 1 . 2 . ]" 1
628 1 43 THR HA 1 46 LEU QD 1.800 . 4.200 2.316 2.032 2.457 . 0 0 "[ . 1 . 2 . ]" 1
629 1 43 THR HA 1 47 GLU H 1.800 . 5.200 4.919 4.542 5.140 . 0 0 "[ . 1 . 2 . ]" 1
630 1 43 THR MG 1 47 GLU H 1.800 . 5.200 4.689 4.445 5.262 0.062 26 0 "[ . 1 . 2 . ]" 1
631 1 44 PRO HA 1 48 ARG H 1.800 . 5.200 4.068 3.751 4.348 . 0 0 "[ . 1 . 2 . ]" 1
632 1 44 PRO HA 1 45 CYS H 1.800 . 4.200 3.597 3.578 3.612 . 0 0 "[ . 1 . 2 . ]" 1
633 1 44 PRO QB 1 45 CYS H 1.800 . 4.200 3.022 2.839 3.132 . 0 0 "[ . 1 . 2 . ]" 1
634 1 44 PRO QD 1 45 CYS H 1.800 . 4.200 2.420 2.288 2.559 . 0 0 "[ . 1 . 2 . ]" 1
635 1 44 PRO HA 1 46 LEU QB 1.800 . 4.200 4.352 4.267 4.436 0.236 5 0 "[ . 1 . 2 . ]" 1
636 1 44 PRO QG 1 45 CYS H 1.800 . 4.200 2.192 1.995 2.356 . 0 0 "[ . 1 . 2 . ]" 1
637 1 44 PRO QD 1 44 PRO QG 1.800 . 4.200 1.955 1.945 1.959 . 0 0 "[ . 1 . 2 . ]" 1
638 1 44 PRO HA 1 47 GLU HA 1.800 . 4.200 4.549 4.448 4.630 0.430 16 0 "[ . 1 . 2 . ]" 1
639 1 44 PRO HA 1 47 GLU H 1.800 . 4.200 2.860 2.761 2.956 . 0 0 "[ . 1 . 2 . ]" 1
640 1 44 PRO HA 1 47 GLU QB 1.800 . 3.200 1.829 1.755 2.022 0.045 5 0 "[ . 1 . 2 . ]" 1
641 1 44 PRO HA 1 47 GLU QG 1.800 . 4.200 2.677 1.851 3.646 . 0 0 "[ . 1 . 2 . ]" 1
642 1 45 CYS HA 1 48 ARG QB 1.800 . 4.200 2.860 2.658 3.078 . 0 0 "[ . 1 . 2 . ]" 1
643 1 45 CYS HA 1 48 ARG QD 1.800 . 4.200 3.879 1.884 4.272 0.072 6 0 "[ . 1 . 2 . ]" 1
644 1 45 CYS HA 1 48 ARG QG 1.800 . 4.200 2.568 2.082 4.213 0.013 17 0 "[ . 1 . 2 . ]" 1
645 1 45 CYS HA 1 46 LEU H 1.800 . 4.200 3.554 3.525 3.571 . 0 0 "[ . 1 . 2 . ]" 1
646 1 45 CYS H 1 45 CYS QB 1.800 . 3.200 2.194 2.137 2.216 . 0 0 "[ . 1 . 2 . ]" 1
647 1 45 CYS HA 1 49 VAL QG 1.800 . 5.200 4.840 4.316 5.275 0.075 20 0 "[ . 1 . 2 . ]" 1
648 1 45 CYS QB 1 46 LEU H 1.800 . 3.200 2.276 2.149 2.501 . 0 0 "[ . 1 . 2 . ]" 1
649 1 45 CYS HA 1 47 GLU H 1.800 . 5.200 4.643 4.329 4.785 . 0 0 "[ . 1 . 2 . ]" 1
650 1 45 CYS H 1 46 LEU QB 1.800 . 5.200 4.753 4.614 4.817 . 0 0 "[ . 1 . 2 . ]" 1
651 1 45 CYS QB 1 46 LEU QD 1.800 . 5.200 2.912 2.662 3.203 . 0 0 "[ . 1 . 2 . ]" 1
652 1 45 CYS HA 1 48 ARG HA 1.800 . 5.200 5.466 5.370 5.600 0.400 5 0 "[ . 1 . 2 . ]" 1
653 1 45 CYS HA 1 48 ARG H 1.800 . 4.200 3.449 3.329 3.540 . 0 0 "[ . 1 . 2 . ]" 1
654 1 46 LEU QD 1 49 VAL HB 1.800 . 4.200 4.262 4.197 4.391 0.191 22 0 "[ . 1 . 2 . ]" 1
655 1 46 LEU QB 1 47 GLU H 1.800 . 4.200 2.253 2.151 2.457 . 0 0 "[ . 1 . 2 . ]" 1
656 1 46 LEU HG 1 47 GLU H 1.800 . 4.200 4.368 4.307 4.456 0.256 22 0 "[ . 1 . 2 . ]" 1
657 1 46 LEU QD 1 47 GLU H 1.800 . 5.200 3.429 3.300 3.615 . 0 0 "[ . 1 . 2 . ]" 1
658 1 46 LEU HA 1 46 LEU HG 1.800 . 4.200 2.362 2.273 2.432 . 0 0 "[ . 1 . 2 . ]" 1
659 1 46 LEU QD 1 50 ARG H 1.800 . 5.200 4.773 4.522 4.990 . 0 0 "[ . 1 . 2 . ]" 1
660 1 46 LEU HA 1 49 VAL HA 1.800 . 5.200 4.973 4.793 5.135 . 0 0 "[ . 1 . 2 . ]" 1
661 1 46 LEU HA 1 49 VAL HB 1.800 . 3.200 2.226 2.065 2.319 . 0 0 "[ . 1 . 2 . ]" 1
662 1 46 LEU HA 1 49 VAL H 1.800 . 4.200 3.103 2.905 3.271 . 0 0 "[ . 1 . 2 . ]" 1
663 1 46 LEU QB 1 46 LEU QD 1.800 . 4.200 1.730 1.681 1.753 0.119 15 0 "[ . 1 . 2 . ]" 1
664 1 46 LEU HA 1 49 VAL QG 1.800 . 4.200 2.575 2.053 3.085 . 0 0 "[ . 1 . 2 . ]" 1
665 1 46 LEU HA 1 46 LEU QD 1.800 . 4.200 2.841 2.672 2.993 . 0 0 "[ . 1 . 2 . ]" 1
666 1 46 LEU H 1 46 LEU QB 1.800 . 3.200 2.326 2.232 2.382 . 0 0 "[ . 1 . 2 . ]" 1
667 1 46 LEU H 1 46 LEU HG 1.800 . 4.200 2.378 2.207 2.591 . 0 0 "[ . 1 . 2 . ]" 1
668 1 46 LEU QD 1 46 LEU HG 1.800 . 3.200 1.891 1.880 1.897 . 0 0 "[ . 1 . 2 . ]" 1
669 1 46 LEU H 1 46 LEU QD 1.800 . 5.200 2.285 2.032 2.555 . 0 0 "[ . 1 . 2 . ]" 1
670 1 46 LEU HA 1 47 GLU H 1.800 . 4.200 3.573 3.548 3.586 . 0 0 "[ . 1 . 2 . ]" 1
671 1 46 LEU QB 1 49 VAL HB 1.800 . 4.200 4.269 4.088 4.389 0.189 17 0 "[ . 1 . 2 . ]" 1
672 1 46 LEU HG 1 49 VAL HB 1.800 . 4.200 4.213 4.038 4.309 0.109 26 0 "[ . 1 . 2 . ]" 1
673 1 47 GLU HA 1 50 ARG QD 1.800 . 4.200 4.192 2.977 4.430 0.230 11 0 "[ . 1 . 2 . ]" 1
674 1 47 GLU H 1 47 GLU QG 1.800 . 3.200 2.815 2.005 3.292 0.092 6 0 "[ . 1 . 2 . ]" 1
675 1 47 GLU HA 1 47 GLU QG 1.800 . 4.200 2.153 1.916 2.702 . 0 0 "[ . 1 . 2 . ]" 1
676 1 47 GLU QB 1 48 ARG HA 1.800 . 5.200 3.921 3.828 3.995 . 0 0 "[ . 1 . 2 . ]" 1
677 1 47 GLU QG 1 48 ARG H 1.800 . 5.200 4.295 3.916 4.470 . 0 0 "[ . 1 . 2 . ]" 1
678 1 48 ARG HA 1 48 ARG QD 1.800 . 4.200 2.900 2.430 3.880 . 0 0 "[ . 1 . 2 . ]" 1
679 1 48 ARG H 1 48 ARG QD 1.800 . 5.200 3.647 2.105 4.016 . 0 0 "[ . 1 . 2 . ]" 1
680 1 48 ARG HA 1 49 VAL HA 1.800 . 5.200 4.845 4.794 4.875 . 0 0 "[ . 1 . 2 . ]" 1
681 1 48 ARG HA 1 49 VAL H 1.800 . 4.200 3.570 3.537 3.589 . 0 0 "[ . 1 . 2 . ]" 1
682 1 48 ARG QB 1 49 VAL H 1.800 . 4.200 2.251 2.025 2.634 . 0 0 "[ . 1 . 2 . ]" 1
683 1 48 ARG H 1 49 VAL QG 1.800 . 5.200 4.512 4.368 4.619 . 0 0 "[ . 1 . 2 . ]" 1
684 1 48 ARG QB 1 48 ARG QD 1.800 . 4.200 2.029 1.918 2.170 . 0 0 "[ . 1 . 2 . ]" 1
685 1 49 VAL QG 1 53 GLU HA 1.800 . 5.200 4.650 4.090 4.995 . 0 0 "[ . 1 . 2 . ]" 1
686 1 49 VAL QG 1 52 LEU QB 1.800 . 5.200 3.062 2.942 3.153 . 0 0 "[ . 1 . 2 . ]" 1
687 1 49 VAL QG 1 52 LEU QD 1.800 . 4.200 2.791 2.462 3.263 . 0 0 "[ . 1 . 2 . ]" 1
688 1 49 VAL HB 1 58 ILE MD 1.800 . 5.200 5.119 4.318 5.268 0.068 8 0 "[ . 1 . 2 . ]" 1
689 1 49 VAL HA 1 49 VAL QG 1.800 . 4.200 1.994 1.888 2.118 . 0 0 "[ . 1 . 2 . ]" 1
690 1 49 VAL HB 1 49 VAL QG 1.800 . 4.200 1.907 1.888 1.918 . 0 0 "[ . 1 . 2 . ]" 1
691 1 49 VAL HA 1 52 LEU QB 1.800 . 4.200 2.496 2.216 2.734 . 0 0 "[ . 1 . 2 . ]" 1
692 1 49 VAL HA 1 52 LEU QD 1.800 . 5.200 2.341 1.803 2.868 . 0 0 "[ . 1 . 2 . ]" 1
693 1 49 VAL H 1 49 VAL HB 1.800 . 3.200 1.976 1.921 2.102 . 0 0 "[ . 1 . 2 . ]" 1
694 1 49 VAL HA 1 52 LEU HA 1.800 . 5.200 5.242 5.131 5.308 0.108 7 0 "[ . 1 . 2 . ]" 1
695 1 49 VAL QG 1 58 ILE MD 1.800 . 4.200 2.597 2.098 2.798 . 0 0 "[ . 1 . 2 . ]" 1
696 1 49 VAL HA 1 52 LEU HG 1.800 . 4.200 3.419 2.866 4.208 0.008 16 0 "[ . 1 . 2 . ]" 1
697 1 49 VAL QG 1 61 TYR QB 1.800 . 4.200 4.044 2.276 4.285 0.085 7 0 "[ . 1 . 2 . ]" 1
698 1 49 VAL QG 1 50 ARG QD 1.800 . 5.200 3.287 2.720 4.056 . 0 0 "[ . 1 . 2 . ]" 1
699 1 49 VAL H 1 49 VAL QG 1.800 . 4.200 2.761 2.518 2.865 . 0 0 "[ . 1 . 2 . ]" 1
700 1 49 VAL H 1 52 LEU QD 1.800 . 5.200 4.307 3.850 4.777 . 0 0 "[ . 1 . 2 . ]" 1
701 1 49 VAL HB 1 50 ARG H 1.800 . 3.200 2.919 2.387 3.246 0.046 16 0 "[ . 1 . 2 . ]" 1
702 1 49 VAL QG 1 53 GLU QG 1.800 . 5.200 3.435 2.885 4.226 . 0 0 "[ . 1 . 2 . ]" 1
703 1 49 VAL QG 1 52 LEU HA 1.800 . 5.200 5.368 5.287 5.442 0.242 19 0 "[ . 1 . 2 . ]" 1
704 1 49 VAL QG 1 52 LEU HG 1.800 . 5.200 4.402 4.005 4.897 . 0 0 "[ . 1 . 2 . ]" 1
705 1 49 VAL QG 1 58 ILE QG 1.800 . 4.200 2.961 2.264 3.790 . 0 0 "[ . 1 . 2 . ]" 1
706 1 49 VAL HA 1 50 ARG H 1.800 . 5.200 3.577 3.541 3.603 . 0 0 "[ . 1 . 2 . ]" 1
707 1 49 VAL QG 1 63 ALA MB 1.800 . 5.200 5.208 4.127 5.409 0.209 20 0 "[ . 1 . 2 . ]" 1
708 1 49 VAL QG 1 62 THR HA 1.800 . 5.200 4.361 1.887 5.019 . 0 0 "[ . 1 . 2 . ]" 1
709 1 49 VAL QG 1 62 THR HB 1.800 . 5.200 3.026 1.850 3.715 . 0 0 "[ . 1 . 2 . ]" 1
710 1 49 VAL QG 1 62 THR MG 1.800 . 4.200 1.670 1.549 2.034 0.251 19 0 "[ . 1 . 2 . ]" 1
711 1 49 VAL HA 1 58 ILE MD 1.800 . 4.200 3.438 2.859 3.676 . 0 0 "[ . 1 . 2 . ]" 1
712 1 49 VAL QG 1 50 ARG HA 1.800 . 4.200 2.811 2.691 3.030 . 0 0 "[ . 1 . 2 . ]" 1
713 1 49 VAL QG 1 50 ARG H 1.800 . 5.200 2.092 1.793 2.638 0.007 17 0 "[ . 1 . 2 . ]" 1
714 1 50 ARG QD 1 50 ARG QG 1.800 . 4.200 2.055 2.005 2.110 . 0 0 "[ . 1 . 2 . ]" 1
715 1 50 ARG HA 1 51 ARG H 1.800 . 3.200 3.555 3.507 3.567 0.367 25 0 "[ . 1 . 2 . ]" 1
716 1 50 ARG HA 1 50 ARG QD 1.800 . 3.200 2.797 2.351 3.379 0.179 7 0 "[ . 1 . 2 . ]" 1
717 1 50 ARG HA 1 53 GLU QG 1.800 . 3.200 3.250 3.114 3.371 0.171 18 0 "[ . 1 . 2 . ]" 1
718 1 50 ARG HA 1 53 GLU H 1.800 . 4.200 3.088 2.934 3.221 . 0 0 "[ . 1 . 2 . ]" 1
719 1 50 ARG QG 1 51 ARG H 1.800 . 5.200 3.846 3.622 4.391 . 0 0 "[ . 1 . 2 . ]" 1
720 1 50 ARG H 1 50 ARG QB 1.800 . 3.200 2.449 1.985 2.607 . 0 0 "[ . 1 . 2 . ]" 1
721 1 50 ARG QG 1 62 THR MG 1.800 . 5.200 4.994 4.085 5.377 0.177 7 0 "[ . 1 . 2 . ]" 1
722 1 50 ARG H 1 50 ARG QD 1.800 . 5.200 3.464 2.214 3.960 . 0 0 "[ . 1 . 2 . ]" 1
723 1 50 ARG HA 1 62 THR MG 1.800 . 5.200 5.268 5.055 5.448 0.248 24 0 "[ . 1 . 2 . ]" 1
724 1 50 ARG QD 1 62 THR MG 1.800 . 5.200 5.236 3.844 5.434 0.234 12 0 "[ . 1 . 2 . ]" 1
725 1 50 ARG H 1 50 ARG QG 1.800 . 4.200 2.027 1.742 3.558 0.058 20 0 "[ . 1 . 2 . ]" 1
726 1 51 ARG QD 1 52 LEU QD 1.800 . 5.200 2.979 1.912 3.911 . 0 0 "[ . 1 . 2 . ]" 1
727 1 51 ARG QG 1 55 GLN QG 1.800 . 4.200 3.764 2.602 4.260 0.060 9 0 "[ . 1 . 2 . ]" 1
728 1 51 ARG HA 1 51 ARG QG 1.800 . 3.200 3.050 2.408 3.421 0.221 26 0 "[ . 1 . 2 . ]" 1
729 1 51 ARG QG 1 52 LEU HA 1.800 . 4.200 3.417 2.941 4.267 0.067 12 0 "[ . 1 . 2 . ]" 1
730 1 51 ARG QG 1 52 LEU H 1.800 . 4.200 2.919 1.881 3.933 . 0 0 "[ . 1 . 2 . ]" 1
731 1 51 ARG H 1 51 ARG QB 1.800 . 3.200 2.059 1.942 2.186 . 0 0 "[ . 1 . 2 . ]" 1
732 1 51 ARG H 1 51 ARG QD 1.800 . 5.200 4.199 3.830 4.388 . 0 0 "[ . 1 . 2 . ]" 1
733 1 51 ARG QD 1 55 GLN H 1.800 . 5.200 4.333 3.623 5.147 . 0 0 "[ . 1 . 2 . ]" 1
734 1 51 ARG H 1 51 ARG QG 1.800 . 4.200 3.734 3.026 4.009 . 0 0 "[ . 1 . 2 . ]" 1
735 1 51 ARG QD 1 51 ARG QG 1.800 . 3.200 2.068 2.054 2.101 . 0 0 "[ . 1 . 2 . ]" 1
736 1 51 ARG HA 1 52 LEU H 1.800 . 4.200 3.560 3.532 3.576 . 0 0 "[ . 1 . 2 . ]" 1
737 1 52 LEU QB 1 53 GLU H 1.800 . 4.200 2.852 2.478 3.003 . 0 0 "[ . 1 . 2 . ]" 1
738 1 52 LEU QB 1 58 ILE QG 1.800 . 4.200 2.173 1.796 2.696 0.004 21 0 "[ . 1 . 2 . ]" 1
739 1 52 LEU QB 1 58 ILE MG 1.800 . 5.200 3.720 3.515 4.062 . 0 0 "[ . 1 . 2 . ]" 1
740 1 52 LEU QD 1 53 GLU H 1.800 . 5.200 4.202 4.032 4.280 . 0 0 "[ . 1 . 2 . ]" 1
741 1 52 LEU HA 1 55 GLN H 1.800 . 4.200 3.670 3.285 3.958 . 0 0 "[ . 1 . 2 . ]" 1
742 1 52 LEU QD 1 55 GLN QB 1.800 . 5.200 3.696 2.766 4.629 . 0 0 "[ . 1 . 2 . ]" 1
743 1 52 LEU H 1 58 ILE MD 1.800 . 5.200 4.314 3.486 4.676 . 0 0 "[ . 1 . 2 . ]" 1
744 1 52 LEU H 1 52 LEU HG 1.800 . 3.200 2.331 1.962 3.171 . 0 0 "[ . 1 . 2 . ]" 1
745 1 52 LEU HA 1 52 LEU QD 1.800 . 4.200 2.000 1.811 2.272 . 0 0 "[ . 1 . 2 . ]" 1
746 1 52 LEU HA 1 53 GLU H 1.800 . 4.200 3.480 3.438 3.565 . 0 0 "[ . 1 . 2 . ]" 1
747 1 52 LEU QD 1 57 PHE QB 1.800 . 5.200 2.846 2.023 4.008 . 0 0 "[ . 1 . 2 . ]" 1
748 1 52 LEU HA 1 58 ILE MD 1.800 . 5.200 4.073 3.798 4.541 . 0 0 "[ . 1 . 2 . ]" 1
749 1 52 LEU QB 1 52 LEU QD 1.800 . 4.200 1.900 1.843 1.945 . 0 0 "[ . 1 . 2 . ]" 1
750 1 52 LEU QD 1 57 PHE HA 1.800 . 5.200 5.129 4.332 5.275 0.075 21 0 "[ . 1 . 2 . ]" 1
751 1 52 LEU QD 1 57 PHE H 1.800 . 5.200 4.742 2.905 5.120 . 0 0 "[ . 1 . 2 . ]" 1
752 1 52 LEU HA 1 55 GLN QB 1.800 . 4.200 3.061 2.320 4.459 0.259 26 0 "[ . 1 . 2 . ]" 1
753 1 52 LEU H 1 52 LEU QB 1.800 . 3.200 2.221 1.984 2.365 . 0 0 "[ . 1 . 2 . ]" 1
754 1 52 LEU HA 1 58 ILE QG 1.800 . 5.200 3.799 3.541 4.474 . 0 0 "[ . 1 . 2 . ]" 1
755 1 52 LEU HA 1 55 GLN QG 1.800 . 4.200 2.993 1.951 4.191 . 0 0 "[ . 1 . 2 . ]" 1
756 1 52 LEU QD 1 52 LEU HG 1.800 . 4.200 1.894 1.879 1.912 . 0 0 "[ . 1 . 2 . ]" 1
757 1 52 LEU H 1 52 LEU QD 1.800 . 4.200 3.117 2.958 3.415 . 0 0 "[ . 1 . 2 . ]" 1
758 1 52 LEU HG 1 58 ILE MD 1.800 . 5.200 4.192 3.885 4.539 . 0 0 "[ . 1 . 2 . ]" 1
759 1 52 LEU HA 1 57 PHE H 1.800 . 5.200 4.670 3.525 5.218 0.018 10 0 "[ . 1 . 2 . ]" 1
760 1 52 LEU QB 1 58 ILE MD 1.800 . 4.200 1.898 1.710 2.272 0.090 15 0 "[ . 1 . 2 . ]" 1
761 1 52 LEU QB 1 57 PHE QB 1.800 . 4.200 2.707 1.941 4.206 0.006 26 0 "[ . 1 . 2 . ]" 1
762 1 52 LEU HA 1 52 LEU HG 1.800 . 4.200 2.822 2.431 3.011 . 0 0 "[ . 1 . 2 . ]" 1
763 1 52 LEU QB 1 57 PHE QD 1.800 . 4.200 3.919 2.962 4.278 0.078 19 0 "[ . 1 . 2 . ]" 1
764 1 52 LEU QD 1 58 ILE QG 1.800 . 5.200 3.368 3.174 3.561 . 0 0 "[ . 1 . 2 . ]" 1
765 1 52 LEU QB 1 53 GLU HA 1.800 . 5.200 4.012 3.931 4.066 . 0 0 "[ . 1 . 2 . ]" 1
766 1 53 GLU H 1 58 ILE MG 1.800 . 5.200 4.541 4.001 5.204 0.004 10 0 "[ . 1 . 2 . ]" 1
767 1 53 GLU QG 1 62 THR MG 1.800 . 5.200 4.365 3.358 5.154 . 0 0 "[ . 1 . 2 . ]" 1
768 1 53 GLU HA 1 56 GLY H 1.800 . 4.200 3.848 3.341 4.230 0.030 26 0 "[ . 1 . 2 . ]" 1
769 1 53 GLU QB 1 58 ILE HB 1.800 . 4.200 3.290 1.842 3.822 . 0 0 "[ . 1 . 2 . ]" 1
770 1 53 GLU QG 1 59 GLN HA 1.800 . 5.200 4.734 4.007 5.255 0.055 18 0 "[ . 1 . 2 . ]" 1
771 1 53 GLU HA 1 58 ILE QG 1.800 . 4.200 2.229 1.826 2.614 . 0 0 "[ . 1 . 2 . ]" 1
772 1 53 GLU HA 1 58 ILE MG 1.800 . 4.200 3.861 3.466 4.293 0.093 10 0 "[ . 1 . 2 . ]" 1
773 1 53 GLU QG 1 58 ILE HB 1.800 . 4.200 2.106 1.749 3.290 0.051 22 0 "[ . 1 . 2 . ]" 1
774 1 53 GLU QG 1 54 ARG H 1.800 . 4.200 3.987 2.551 4.238 0.038 26 0 "[ . 1 . 2 . ]" 1
775 1 53 GLU HA 1 55 GLN H 1.800 . 5.200 4.059 3.790 4.535 . 0 0 "[ . 1 . 2 . ]" 1
776 1 53 GLU QG 1 58 ILE MD 1.800 . 5.200 4.212 3.500 5.286 0.086 23 0 "[ . 1 . 2 . ]" 1
777 1 53 GLU HA 1 53 GLU QG 1.800 . 3.200 2.185 1.929 3.086 . 0 0 "[ . 1 . 2 . ]" 1
778 1 53 GLU HA 1 56 GLY QA 1.800 . 5.200 4.286 3.688 4.836 . 0 0 "[ . 1 . 2 . ]" 1
779 1 53 GLU H 1 58 ILE MD 1.800 . 5.200 4.043 2.652 4.472 . 0 0 "[ . 1 . 2 . ]" 1
780 1 53 GLU H 1 53 GLU QB 1.800 . 3.200 1.986 1.914 2.110 . 0 0 "[ . 1 . 2 . ]" 1
781 1 53 GLU QG 1 58 ILE QG 1.800 . 5.200 3.066 1.981 4.128 . 0 0 "[ . 1 . 2 . ]" 1
782 1 53 GLU QG 1 58 ILE MG 1.800 . 4.200 2.979 2.226 4.151 . 0 0 "[ . 1 . 2 . ]" 1
783 1 53 GLU QG 1 65 LEU QD 1.800 . 5.200 2.756 1.729 5.294 0.094 10 0 "[ . 1 . 2 . ]" 1
784 1 53 GLU HA 1 58 ILE HB 1.800 . 3.200 2.335 1.861 2.849 . 0 0 "[ . 1 . 2 . ]" 1
785 1 53 GLU HA 1 58 ILE MD 1.800 . 4.200 3.838 2.796 4.204 0.004 26 0 "[ . 1 . 2 . ]" 1
786 1 53 GLU QB 1 58 ILE QG 1.800 . 4.200 3.093 2.143 4.261 0.061 15 0 "[ . 1 . 2 . ]" 1
787 1 53 GLU H 1 53 GLU QG 1.800 . 4.200 3.535 2.706 3.873 . 0 0 "[ . 1 . 2 . ]" 1
788 1 53 GLU QB 1 58 ILE MG 1.800 . 5.200 3.787 2.410 4.545 . 0 0 "[ . 1 . 2 . ]" 1
789 1 53 GLU HA 1 54 ARG H 1.800 . 4.200 3.582 3.510 3.593 . 0 0 "[ . 1 . 2 . ]" 1
790 1 54 ARG HA 1 55 GLN H 1.800 . 4.200 3.511 3.457 3.584 . 0 0 "[ . 1 . 2 . ]" 1
791 1 54 ARG H 1 54 ARG QB 1.800 . 3.200 2.383 2.189 2.570 . 0 0 "[ . 1 . 2 . ]" 1
792 1 54 ARG H 1 54 ARG QD 1.800 . 4.200 3.881 2.962 4.201 0.001 18 0 "[ . 1 . 2 . ]" 1
793 1 54 ARG H 1 54 ARG QG 1.800 . 3.200 2.116 1.864 2.521 . 0 0 "[ . 1 . 2 . ]" 1
794 1 54 ARG QB 1 55 GLN H 1.800 . 4.200 2.953 2.409 3.646 . 0 0 "[ . 1 . 2 . ]" 1
795 1 54 ARG QG 1 55 GLN H 1.800 . 4.200 3.523 1.867 4.251 0.051 22 0 "[ . 1 . 2 . ]" 1
796 1 54 ARG H 1 55 GLN QG 1.800 . 5.200 4.212 3.422 4.942 . 0 0 "[ . 1 . 2 . ]" 1
797 1 54 ARG HA 1 56 GLY H 1.800 . 5.200 3.629 3.351 4.783 . 0 0 "[ . 1 . 2 . ]" 1
798 1 55 GLN QB 1 56 GLY H 1.800 . 4.200 3.586 3.291 4.024 . 0 0 "[ . 1 . 2 . ]" 1
799 1 55 GLN HA 1 55 GLN QG 1.800 . 3.200 2.741 2.036 3.302 0.102 9 0 "[ . 1 . 2 . ]" 1
800 1 55 GLN H 1 55 GLN QB 1.800 . 3.200 2.368 2.040 3.183 . 0 0 "[ . 1 . 2 . ]" 1
801 1 55 GLN HA 1 56 GLY H 1.800 . 3.200 3.188 2.695 3.327 0.127 22 0 "[ . 1 . 2 . ]" 1
802 1 55 GLN H 1 55 GLN QG 1.800 . 3.200 2.324 1.818 3.109 . 0 0 "[ . 1 . 2 . ]" 1
803 1 55 GLN HA 1 56 GLY QA 1.800 . 5.200 4.218 4.061 4.259 . 0 0 "[ . 1 . 2 . ]" 1
804 1 55 GLN QB 1 55 GLN QG 1.800 . 4.200 2.058 2.031 2.110 . 0 0 "[ . 1 . 2 . ]" 1
805 1 56 GLY QA 1 58 ILE H 1.800 . 5.200 3.478 3.277 4.620 . 0 0 "[ . 1 . 2 . ]" 1
806 1 56 GLY QA 1 57 PHE H 1.800 . 4.200 2.604 2.154 2.813 . 0 0 "[ . 1 . 2 . ]" 1
807 1 57 PHE QB 1 58 ILE H 1.800 . 4.200 3.497 3.308 3.917 . 0 0 "[ . 1 . 2 . ]" 1
808 1 57 PHE H 1 57 PHE QB 1.800 . 3.200 2.484 2.224 2.677 . 0 0 "[ . 1 . 2 . ]" 1
809 1 57 PHE HA 1 58 ILE H 1.800 . 3.200 3.169 2.415 3.312 0.112 5 0 "[ . 1 . 2 . ]" 1
810 1 57 PHE QB 1 58 ILE MD 1.800 . 5.200 2.583 2.123 3.465 . 0 0 "[ . 1 . 2 . ]" 1
811 1 57 PHE H 1 58 ILE MG 1.800 . 5.200 5.112 4.880 5.286 0.086 15 0 "[ . 1 . 2 . ]" 1
812 1 57 PHE QB 1 58 ILE QG 1.800 . 5.200 2.713 2.335 4.128 . 0 0 "[ . 1 . 2 . ]" 1
813 1 57 PHE QB 1 58 ILE MG 1.800 . 5.200 4.765 4.433 5.163 . 0 0 "[ . 1 . 2 . ]" 1
814 1 58 ILE HA 1 58 ILE MD 1.800 . 4.200 2.177 1.927 3.861 . 0 0 "[ . 1 . 2 . ]" 1
815 1 58 ILE MG 1 62 THR HA 1.800 . 5.200 3.715 2.495 4.215 . 0 0 "[ . 1 . 2 . ]" 1
816 1 58 ILE MG 1 62 THR HB 1.800 . 5.200 3.282 1.717 4.325 0.083 24 0 "[ . 1 . 2 . ]" 1
817 1 58 ILE MG 1 61 TYR HA 1.800 . 5.200 4.528 3.785 4.953 . 0 0 "[ . 1 . 2 . ]" 1
818 1 58 ILE MG 1 61 TYR H 1.800 . 5.200 3.764 3.418 4.116 . 0 0 "[ . 1 . 2 . ]" 1
819 1 58 ILE HA 1 63 ALA HA 1.800 . 4.200 4.492 4.386 4.560 0.360 24 0 "[ . 1 . 2 . ]" 1
820 1 58 ILE MD 1 58 ILE QG 1.800 . 3.200 1.884 1.877 1.900 . 0 0 "[ . 1 . 2 . ]" 1
821 1 58 ILE HB 1 58 ILE MD 1.800 . 4.200 3.126 2.482 3.186 . 0 0 "[ . 1 . 2 . ]" 1
822 1 58 ILE HA 1 58 ILE QG 1.800 . 4.200 3.031 2.704 3.156 . 0 0 "[ . 1 . 2 . ]" 1
823 1 58 ILE HA 1 58 ILE MG 1.800 . 4.200 2.217 2.053 2.319 . 0 0 "[ . 1 . 2 . ]" 1
824 1 58 ILE MG 1 60 GLY QA 1.800 . 5.200 4.987 4.460 5.251 0.051 26 0 "[ . 1 . 2 . ]" 1
825 1 58 ILE MD 1 62 THR HB 1.800 . 5.200 4.472 3.324 5.285 0.085 10 0 "[ . 1 . 2 . ]" 1
826 1 58 ILE MD 1 61 TYR HA 1.800 . 5.200 5.082 3.445 5.342 0.142 17 0 "[ . 1 . 2 . ]" 1
827 1 58 ILE MD 1 62 THR MG 1.800 . 5.200 3.269 2.510 4.520 . 0 0 "[ . 1 . 2 . ]" 1
828 1 58 ILE QG 1 59 GLN H 1.800 . 5.200 4.403 4.063 4.576 . 0 0 "[ . 1 . 2 . ]" 1
829 1 58 ILE MG 1 59 GLN H 1.800 . 4.200 4.124 3.068 4.316 0.116 26 0 "[ . 1 . 2 . ]" 1
830 1 58 ILE H 1 58 ILE QG 1.800 . 4.200 2.430 2.302 2.533 . 0 0 "[ . 1 . 2 . ]" 1
831 1 58 ILE H 1 58 ILE MG 1.800 . 5.200 3.935 3.895 3.980 . 0 0 "[ . 1 . 2 . ]" 1
832 1 58 ILE QG 1 58 ILE MG 1.800 . 4.200 2.366 2.268 2.407 . 0 0 "[ . 1 . 2 . ]" 1
833 1 58 ILE MD 1 61 TYR QB 1.800 . 5.200 2.642 2.085 4.699 . 0 0 "[ . 1 . 2 . ]" 1
834 1 58 ILE HB 1 59 GLN H 1.800 . 4.200 4.087 3.721 4.279 0.079 2 0 "[ . 1 . 2 . ]" 1
835 1 58 ILE H 1 58 ILE HB 1.800 . 3.200 2.879 2.737 3.108 . 0 0 "[ . 1 . 2 . ]" 1
836 1 58 ILE MG 1 61 TYR QB 1.800 . 4.200 2.492 2.036 4.309 0.109 15 0 "[ . 1 . 2 . ]" 1
837 1 58 ILE HA 1 59 GLN QG 1.800 . 4.200 4.160 3.673 4.322 0.122 14 0 "[ . 1 . 2 . ]" 1
838 1 58 ILE MD 1 59 GLN H 1.800 . 5.200 4.489 4.228 5.358 0.158 10 0 "[ . 1 . 2 . ]" 1
839 1 58 ILE HA 1 59 GLN H 1.800 . 3.200 2.865 2.199 3.200 0.000 22 0 "[ . 1 . 2 . ]" 1
840 1 58 ILE MG 1 62 THR MG 1.800 . 5.200 2.142 1.554 4.096 0.246 25 0 "[ . 1 . 2 . ]" 1
841 1 58 ILE MG 1 63 ALA HA 1.800 . 5.200 2.412 1.984 3.082 . 0 0 "[ . 1 . 2 . ]" 1
842 1 58 ILE H 1 58 ILE MD 1.800 . 5.200 3.542 3.191 4.090 . 0 0 "[ . 1 . 2 . ]" 1
843 1 58 ILE MG 1 59 GLN QG 1.800 . 5.200 5.058 3.551 5.290 0.090 14 0 "[ . 1 . 2 . ]" 1
844 1 59 GLN QB 1 59 GLN QG 1.800 . 3.200 2.071 2.051 2.107 . 0 0 "[ . 1 . 2 . ]" 1
845 1 59 GLN HA 1 59 GLN QG 1.800 . 4.200 3.302 3.290 3.341 . 0 0 "[ . 1 . 2 . ]" 1
846 1 59 GLN QB 1 60 GLY H 1.800 . 5.200 3.750 3.611 3.957 . 0 0 "[ . 1 . 2 . ]" 1
847 1 59 GLN HA 1 60 GLY H 1.800 . 3.200 3.283 2.386 3.425 0.225 2 0 "[ . 1 . 2 . ]" 1
848 1 59 GLN QG 1 60 GLY H 1.800 . 5.200 2.544 2.123 4.142 . 0 0 "[ . 1 . 2 . ]" 1
849 1 59 GLN QB 1 60 GLY QA 1.800 . 5.200 4.233 4.158 4.301 . 0 0 "[ . 1 . 2 . ]" 1
850 1 59 GLN HA 1 60 GLY QA 1.800 . 5.200 4.226 3.977 4.286 . 0 0 "[ . 1 . 2 . ]" 1
851 1 59 GLN H 1 59 GLN QG 1.800 . 4.200 1.888 1.799 2.094 0.001 14 0 "[ . 1 . 2 . ]" 1
852 1 59 GLN QG 1 60 GLY QA 1.800 . 4.200 3.355 3.035 3.968 . 0 0 "[ . 1 . 2 . ]" 1
853 1 60 GLY QA 1 61 TYR HA 1.800 . 5.200 4.146 4.103 4.489 . 0 0 "[ . 1 . 2 . ]" 1
854 1 60 GLY QA 1 61 TYR H 1.800 . 4.200 2.720 2.617 2.762 . 0 0 "[ . 1 . 2 . ]" 1
855 1 60 GLY QA 1 63 ALA MB 1.800 . 5.200 3.001 2.441 4.543 . 0 0 "[ . 1 . 2 . ]" 1
856 1 61 TYR QB 1 64 LEU QD 1.800 . 5.200 4.841 4.460 5.314 0.114 10 0 "[ . 1 . 2 . ]" 1
857 1 61 TYR HA 1 62 THR MG 1.800 . 5.200 5.105 4.104 5.637 0.437 24 0 "[ . 1 . 2 . ]" 1
858 1 61 TYR HA 1 62 THR HA 1.800 . 4.200 4.498 4.440 4.568 0.368 10 0 "[ . 1 . 2 . ]" 1
859 1 61 TYR QB 1 62 THR HA 1.800 . 4.200 4.080 3.974 4.119 . 0 0 "[ . 1 . 2 . ]" 1
860 1 61 TYR HA 1 62 THR H 1.800 . 4.200 3.381 3.313 3.534 . 0 0 "[ . 1 . 2 . ]" 1
861 1 61 TYR QB 1 62 THR H 1.800 . 4.200 1.793 1.763 1.829 0.037 19 0 "[ . 1 . 2 . ]" 1
862 1 61 TYR H 1 61 TYR QB 1.800 . 3.200 2.463 2.258 3.331 0.131 10 0 "[ . 1 . 2 . ]" 1
863 1 61 TYR QB 1 62 THR MG 1.800 . 5.200 3.300 2.249 4.487 . 0 0 "[ . 1 . 2 . ]" 1
864 1 61 TYR HA 1 63 ALA MB 1.800 . 5.200 4.954 4.699 5.626 0.426 15 0 "[ . 1 . 2 . ]" 1
865 1 62 THR HA 1 64 LEU HG 1.800 . 4.200 2.686 2.329 4.284 0.084 15 0 "[ . 1 . 2 . ]" 1
866 1 62 THR HA 1 64 LEU H 1.800 . 5.200 3.264 3.098 4.671 . 0 0 "[ . 1 . 2 . ]" 1
867 1 62 THR MG 1 64 LEU HG 1.800 . 4.200 3.612 2.822 4.026 . 0 0 "[ . 1 . 2 . ]" 1
868 1 62 THR MG 1 64 LEU H 1.800 . 5.200 4.164 3.992 4.306 . 0 0 "[ . 1 . 2 . ]" 1
869 1 62 THR HA 1 62 THR MG 1.800 . 4.200 2.901 1.935 3.191 . 0 0 "[ . 1 . 2 . ]" 1
870 1 62 THR HB 1 63 ALA H 1.800 . 4.200 4.297 3.706 4.516 0.316 11 0 "[ . 1 . 2 . ]" 1
871 1 62 THR MG 1 65 LEU QB 1.800 . 5.200 2.465 1.726 3.225 0.074 15 0 "[ . 1 . 2 . ]" 1
872 1 62 THR MG 1 65 LEU QD 1.800 . 5.200 1.897 1.626 3.231 0.174 13 0 "[ . 1 . 2 . ]" 1
873 1 62 THR HA 1 63 ALA H 1.800 . 3.200 3.087 2.924 3.364 0.164 10 0 "[ . 1 . 2 . ]" 1
874 1 62 THR MG 1 63 ALA MB 1.800 . 5.200 4.486 4.146 5.258 0.058 4 0 "[ . 1 . 2 . ]" 1
875 1 62 THR HA 1 65 LEU QB 1.800 . 4.200 4.261 4.012 4.493 0.293 10 0 "[ . 1 . 2 . ]" 1
876 1 62 THR HA 1 65 LEU QD 1.800 . 4.200 4.108 3.452 4.423 0.223 15 0 "[ . 1 . 2 . ]" 1
877 1 62 THR HB 1 65 LEU QB 1.800 . 4.200 4.048 2.564 4.358 0.158 16 0 "[ . 1 . 2 . ]" 1
878 1 62 THR HB 1 65 LEU QD 1.800 . 4.200 3.679 1.768 4.392 0.192 25 0 "[ . 1 . 2 . ]" 1
879 1 62 THR HA 1 63 ALA MB 1.800 . 5.200 4.333 3.549 4.569 . 0 0 "[ . 1 . 2 . ]" 1
880 1 62 THR MG 1 63 ALA HA 1.800 . 5.200 3.944 3.354 5.569 0.369 15 0 "[ . 1 . 2 . ]" 1
881 1 62 THR MG 1 63 ALA H 1.800 . 5.200 3.548 3.179 4.401 . 0 0 "[ . 1 . 2 . ]" 1
882 1 62 THR H 1 62 THR HB 1.800 . 4.200 2.612 2.311 3.568 . 0 0 "[ . 1 . 2 . ]" 1
883 1 62 THR H 1 62 THR MG 1.800 . 5.200 2.439 1.762 3.674 0.038 15 0 "[ . 1 . 2 . ]" 1
884 1 62 THR HB 1 64 LEU HG 1.800 . 4.200 4.276 2.634 4.568 0.368 9 0 "[ . 1 . 2 . ]" 1
885 1 63 ALA H 1 63 ALA MB 1.800 . 4.200 2.090 1.939 2.857 . 0 0 "[ . 1 . 2 . ]" 1
886 1 63 ALA MB 1 65 LEU QD 1.800 . 5.200 3.994 3.344 5.159 . 0 0 "[ . 1 . 2 . ]" 1
887 1 63 ALA HA 1 65 LEU QD 1.800 . 5.200 2.908 1.993 5.002 . 0 0 "[ . 1 . 2 . ]" 1
888 1 63 ALA MB 1 64 LEU HG 1.800 . 5.200 4.254 3.428 4.545 . 0 0 "[ . 1 . 2 . ]" 1
889 1 63 ALA MB 1 64 LEU H 1.800 . 4.200 2.750 2.560 3.600 . 0 0 "[ . 1 . 2 . ]" 1
890 1 63 ALA HA 1 64 LEU QD 1.800 . 5.200 4.654 4.140 4.967 . 0 0 "[ . 1 . 2 . ]" 1
891 1 63 ALA HA 1 64 LEU H 1.800 . 4.200 3.480 2.973 3.534 . 0 0 "[ . 1 . 2 . ]" 1
892 1 63 ALA HA 1 66 ASN QB 1.800 . 5.200 4.580 2.812 5.397 0.197 8 0 "[ . 1 . 2 . ]" 1
893 1 64 LEU QB 1 64 LEU QD 1.800 . 3.200 1.788 1.710 1.867 0.090 23 0 "[ . 1 . 2 . ]" 1
894 1 64 LEU HA 1 65 LEU H 1.800 . 3.200 3.415 3.064 3.542 0.342 4 0 "[ . 1 . 2 . ]" 1
895 1 64 LEU HG 1 65 LEU HA 1.800 . 4.200 4.204 4.007 4.322 0.122 16 0 "[ . 1 . 2 . ]" 1
896 1 64 LEU HG 1 65 LEU H 1.800 . 3.200 2.085 1.826 2.815 . 0 0 "[ . 1 . 2 . ]" 1
897 1 64 LEU QB 1 65 LEU H 1.800 . 3.200 2.821 1.777 3.435 0.235 26 0 "[ . 1 . 2 . ]" 1
898 1 64 LEU H 1 64 LEU HG 1.800 . 4.200 2.002 1.830 2.274 . 0 0 "[ . 1 . 2 . ]" 1
899 1 64 LEU H 1 64 LEU QB 1.800 . 3.200 2.580 2.359 3.361 0.161 15 0 "[ . 1 . 2 . ]" 1
900 1 64 LEU H 1 64 LEU QD 1.800 . 5.200 2.218 1.789 3.225 0.011 6 0 "[ . 1 . 2 . ]" 1
901 1 64 LEU HA 1 64 LEU QD 1.800 . 4.200 3.388 3.316 3.449 . 0 0 "[ . 1 . 2 . ]" 1
902 1 65 LEU HA 1 66 ASN H 1.800 . 3.200 3.171 2.293 3.489 0.289 13 0 "[ . 1 . 2 . ]" 1
903 1 65 LEU HA 1 65 LEU QD 1.800 . 4.200 3.167 2.834 3.380 . 0 0 "[ . 1 . 2 . ]" 1
904 1 65 LEU H 1 65 LEU QD 1.800 . 5.200 2.833 1.819 3.939 . 0 0 "[ . 1 . 2 . ]" 1
905 1 65 LEU QB 1 66 ASN H 1.800 . 4.200 3.715 3.027 4.035 . 0 0 "[ . 1 . 2 . ]" 1
906 1 65 LEU QD 1 66 ASN HA 1.800 . 4.200 3.041 2.138 3.965 . 0 0 "[ . 1 . 2 . ]" 1
907 1 65 LEU QD 1 66 ASN H 1.800 . 5.200 2.972 1.781 4.146 0.019 21 0 "[ . 1 . 2 . ]" 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 34
_Distance_constraint_stats_list.Viol_count 249
_Distance_constraint_stats_list.Viol_total 488.576
_Distance_constraint_stats_list.Viol_max 0.210
_Distance_constraint_stats_list.Viol_rms 0.0424
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0213
_Distance_constraint_stats_list.Viol_average_violations_only 0.0755
_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 14 ARG 0.674 0.086 10 0 "[ . 1 . 2 . ]"
1 15 ILE 0.651 0.132 5 0 "[ . 1 . 2 . ]"
1 16 ASP 0.000 0.000 . 0 "[ . 1 . 2 . ]"
1 17 ARG 0.007 0.007 8 0 "[ . 1 . 2 . ]"
1 18 ASN 0.674 0.086 10 0 "[ . 1 . 2 . ]"
1 19 ILE 0.668 0.132 5 0 "[ . 1 . 2 . ]"
1 20 LEU 0.096 0.034 20 0 "[ . 1 . 2 . ]"
1 21 ASN 0.188 0.045 15 0 "[ . 1 . 2 . ]"
1 22 GLU 0.000 0.000 . 0 "[ . 1 . 2 . ]"
1 23 LEU 0.018 0.018 15 0 "[ . 1 . 2 . ]"
1 24 GLN 0.096 0.034 20 0 "[ . 1 . 2 . ]"
1 25 LYS 0.181 0.045 15 0 "[ . 1 . 2 . ]"
1 31 ASN 2.863 0.129 16 0 "[ . 1 . 2 . ]"
1 32 VAL 0.622 0.077 4 0 "[ . 1 . 2 . ]"
1 33 GLU 0.263 0.109 17 0 "[ . 1 . 2 . ]"
1 35 SER 2.863 0.129 16 0 "[ . 1 . 2 . ]"
1 36 LYS 0.622 0.077 4 0 "[ . 1 . 2 . ]"
1 37 ARG 0.263 0.109 17 0 "[ . 1 . 2 . ]"
1 45 CYS 0.000 0.000 . 0 "[ . 1 . 2 . ]"
1 46 LEU 4.707 0.168 5 0 "[ . 1 . 2 . ]"
1 47 GLU 2.175 0.117 24 0 "[ . 1 . 2 . ]"
1 48 ARG 5.783 0.210 6 0 "[ . 1 . 2 . ]"
1 49 VAL 0.033 0.021 13 0 "[ . 1 . 2 . ]"
1 50 ARG 5.426 0.168 5 0 "[ . 1 . 2 . ]"
1 51 ARG 2.175 0.117 24 0 "[ . 1 . 2 . ]"
1 52 LEU 5.783 0.210 6 0 "[ . 1 . 2 . ]"
1 53 GLU 0.033 0.021 13 0 "[ . 1 . 2 . ]"
1 54 ARG 0.718 0.078 15 0 "[ . 1 . 2 . ]"
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 14 ARG O 1 18 ASN H 1.950 . 2.300 2.304 2.193 2.386 0.086 10 0 "[ . 1 . 2 . ]" 2
2 1 14 ARG O 1 18 ASN N 2.900 2.500 3.300 3.197 3.029 3.321 0.021 10 0 "[ . 1 . 2 . ]" 2
3 1 15 ILE O 1 19 ILE H 1.950 . 2.300 2.204 1.617 2.432 0.132 5 0 "[ . 1 . 2 . ]" 2
4 1 15 ILE O 1 19 ILE N 2.900 2.500 3.300 3.007 2.547 3.220 . 0 0 "[ . 1 . 2 . ]" 2
5 1 16 ASP O 1 20 LEU H 1.950 . 2.300 1.882 1.623 2.175 . 0 0 "[ . 1 . 2 . ]" 2
6 1 16 ASP O 1 20 LEU N 2.900 2.500 3.300 2.775 2.507 3.099 . 0 0 "[ . 1 . 2 . ]" 2
7 1 17 ARG O 1 21 ASN H 1.950 . 2.300 1.977 1.697 2.307 0.007 8 0 "[ . 1 . 2 . ]" 2
8 1 17 ARG O 1 21 ASN N 2.900 2.500 3.300 2.912 2.639 3.229 . 0 0 "[ . 1 . 2 . ]" 2
9 1 18 ASN O 1 22 GLU H 1.950 . 2.300 2.031 1.772 2.163 . 0 0 "[ . 1 . 2 . ]" 2
10 1 18 ASN O 1 22 GLU N 2.900 2.500 3.300 2.880 2.657 3.036 . 0 0 "[ . 1 . 2 . ]" 2
11 1 19 ILE O 1 23 LEU H 1.950 . 2.300 1.946 1.582 2.250 0.018 15 0 "[ . 1 . 2 . ]" 2
12 1 19 ILE O 1 23 LEU N 2.900 2.500 3.300 2.827 2.538 3.102 . 0 0 "[ . 1 . 2 . ]" 2
13 1 20 LEU O 1 24 GLN H 1.950 . 2.300 2.076 1.755 2.334 0.034 20 0 "[ . 1 . 2 . ]" 2
14 1 20 LEU O 1 24 GLN N 2.900 2.500 3.300 2.956 2.632 3.246 . 0 0 "[ . 1 . 2 . ]" 2
15 1 21 ASN O 1 25 LYS H 1.950 . 2.300 2.165 1.626 2.345 0.045 15 0 "[ . 1 . 2 . ]" 2
16 1 21 ASN O 1 25 LYS N 2.900 2.500 3.300 3.072 2.581 3.273 . 0 0 "[ . 1 . 2 . ]" 2
17 1 31 ASN O 1 35 SER H 1.950 . 2.300 1.761 1.479 1.912 0.121 18 0 "[ . 1 . 2 . ]" 2
18 1 31 ASN O 1 35 SER N 2.900 2.500 3.300 2.399 2.371 2.434 0.129 16 0 "[ . 1 . 2 . ]" 2
19 1 32 VAL O 1 36 LYS H 1.950 . 2.300 2.296 2.049 2.377 0.077 4 0 "[ . 1 . 2 . ]" 2
20 1 32 VAL O 1 36 LYS N 2.900 2.500 3.300 3.215 2.999 3.308 0.008 12 0 "[ . 1 . 2 . ]" 2
21 1 33 GLU O 1 37 ARG H 1.950 . 2.300 2.205 1.809 2.409 0.109 17 0 "[ . 1 . 2 . ]" 2
22 1 33 GLU O 1 37 ARG N 2.900 2.500 3.300 3.062 2.671 3.330 0.030 17 0 "[ . 1 . 2 . ]" 2
23 1 45 CYS O 1 49 VAL H 1.950 . 2.300 1.807 1.629 1.931 . 0 0 "[ . 1 . 2 . ]" 2
24 1 45 CYS O 1 49 VAL N 2.900 2.500 3.300 2.761 2.560 2.885 . 0 0 "[ . 1 . 2 . ]" 2
25 1 46 LEU O 1 50 ARG H 1.950 . 2.300 1.485 1.432 1.606 0.168 5 0 "[ . 1 . 2 . ]" 2
26 1 46 LEU O 1 50 ARG N 2.900 2.500 3.300 2.434 2.381 2.504 0.119 24 0 "[ . 1 . 2 . ]" 2
27 1 47 GLU O 1 51 ARG H 1.950 . 2.300 2.368 2.317 2.417 0.117 24 0 "[ . 1 . 2 . ]" 2
28 1 47 GLU O 1 51 ARG N 2.900 2.500 3.300 3.304 3.235 3.363 0.063 24 0 "[ . 1 . 2 . ]" 2
29 1 48 ARG O 1 52 LEU H 1.950 . 2.300 2.462 2.394 2.510 0.210 6 0 "[ . 1 . 2 . ]" 2
30 1 48 ARG O 1 52 LEU N 2.900 2.500 3.300 3.360 3.288 3.430 0.130 4 0 "[ . 1 . 2 . ]" 2
31 1 49 VAL O 1 53 GLU H 1.950 . 2.300 2.049 1.579 2.312 0.021 13 0 "[ . 1 . 2 . ]" 2
32 1 49 VAL O 1 53 GLU N 2.900 2.500 3.300 2.806 2.509 3.029 . 0 0 "[ . 1 . 2 . ]" 2
33 1 50 ARG O 1 54 ARG H 1.950 . 2.300 2.159 1.543 2.378 0.078 15 0 "[ . 1 . 2 . ]" 2
34 1 50 ARG O 1 54 ARG N 2.900 2.500 3.300 3.051 2.447 3.297 0.053 18 0 "[ . 1 . 2 . ]" 2
stop_
save_
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