NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
529474 |
2lna   |
18156 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lna
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 1343
_Distance_constraint_stats_list.Viol_count 461
_Distance_constraint_stats_list.Viol_total 745.729
_Distance_constraint_stats_list.Viol_max 0.458
_Distance_constraint_stats_list.Viol_rms 0.0146
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0014
_Distance_constraint_stats_list.Viol_average_violations_only 0.0809
_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 11 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 13 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 14 SER 0.320 0.060 19 0 "[ . 1 . 2]"
1 15 GLY 0.500 0.175 9 0 "[ . 1 . 2]"
1 16 ARG 0.968 0.169 19 0 "[ . 1 . 2]"
1 17 GLU 0.840 0.242 17 0 "[ . 1 . 2]"
1 18 ILE 0.651 0.169 19 0 "[ . 1 . 2]"
1 19 THR 0.441 0.288 11 0 "[ . 1 . 2]"
1 20 TRP 1.960 0.400 6 0 "[ . 1 . 2]"
1 21 LYS 0.700 0.240 9 0 "[ . 1 . 2]"
1 22 ASP 0.813 0.288 11 0 "[ . 1 . 2]"
1 23 PHE 1.375 0.225 14 0 "[ . 1 . 2]"
1 24 VAL 3.551 0.400 6 0 "[ . 1 . 2]"
1 25 ASN 1.556 0.240 9 0 "[ . 1 . 2]"
1 26 ASN 0.523 0.225 14 0 "[ . 1 . 2]"
1 27 TYR 1.280 0.193 16 0 "[ . 1 . 2]"
1 28 LEU 2.229 0.217 16 0 "[ . 1 . 2]"
1 29 SER 1.019 0.161 12 0 "[ . 1 . 2]"
1 30 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 31 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 32 VAL 0.252 0.145 20 0 "[ . 1 . 2]"
1 33 VAL 0.848 0.188 6 0 "[ . 1 . 2]"
1 34 ASP 0.157 0.057 15 0 "[ . 1 . 2]"
1 35 ARG 0.394 0.183 4 0 "[ . 1 . 2]"
1 36 LEU 0.519 0.065 11 0 "[ . 1 . 2]"
1 37 GLU 0.090 0.052 16 0 "[ . 1 . 2]"
1 38 VAL 1.857 0.207 6 0 "[ . 1 . 2]"
1 39 VAL 1.502 0.303 15 0 "[ . 1 . 2]"
1 40 ASN 2.278 0.303 15 0 "[ . 1 . 2]"
1 41 LYS 0.657 0.173 3 0 "[ . 1 . 2]"
1 42 ARG 0.300 0.139 16 0 "[ . 1 . 2]"
1 43 PHE 0.294 0.139 16 0 "[ . 1 . 2]"
1 44 VAL 0.351 0.062 20 0 "[ . 1 . 2]"
1 45 ARG 0.100 0.100 11 0 "[ . 1 . 2]"
1 46 VAL 0.200 0.112 20 0 "[ . 1 . 2]"
1 47 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 48 PHE 0.418 0.117 15 0 "[ . 1 . 2]"
1 49 THR 2.603 0.198 4 0 "[ . 1 . 2]"
1 50 PRO 1.170 0.198 4 0 "[ . 1 . 2]"
1 51 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 LYS 1.532 0.458 17 0 "[ . 1 . 2]"
1 53 THR 0.728 0.124 8 0 "[ . 1 . 2]"
1 54 PRO 0.686 0.130 9 0 "[ . 1 . 2]"
1 55 VAL 0.939 0.163 3 0 "[ . 1 . 2]"
1 56 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 57 GLY 0.756 0.130 9 0 "[ . 1 . 2]"
1 58 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 59 TYR 0.901 0.175 9 0 "[ . 1 . 2]"
1 60 VAL 1.217 0.130 18 0 "[ . 1 . 2]"
1 61 TRP 0.244 0.217 17 0 "[ . 1 . 2]"
1 62 PHE 0.538 0.242 17 0 "[ . 1 . 2]"
1 63 ASN 0.022 0.022 2 0 "[ . 1 . 2]"
1 64 ILE 0.354 0.091 19 0 "[ . 1 . 2]"
1 65 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 66 SER 0.184 0.091 19 0 "[ . 1 . 2]"
1 67 VAL 0.467 0.128 1 0 "[ . 1 . 2]"
1 68 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 69 THR 0.347 0.106 5 0 "[ . 1 . 2]"
1 70 PHE 0.048 0.022 10 0 "[ . 1 . 2]"
1 71 GLU 2.271 0.189 11 0 "[ . 1 . 2]"
1 72 ARG 1.164 0.454 5 0 "[ . 1 . 2]"
1 73 ASN 0.475 0.125 20 0 "[ . 1 . 2]"
1 74 LEU 1.921 0.189 11 0 "[ . 1 . 2]"
1 75 GLU 0.406 0.116 10 0 "[ . 1 . 2]"
1 76 THR 0.144 0.058 4 0 "[ . 1 . 2]"
1 77 LEU 0.450 0.217 10 0 "[ . 1 . 2]"
1 78 GLN 1.167 0.218 10 0 "[ . 1 . 2]"
1 79 GLN 1.008 0.455 9 0 "[ . 1 . 2]"
1 80 GLU 1.286 0.417 7 0 "[ . 1 . 2]"
1 81 LEU 0.311 0.099 8 0 "[ . 1 . 2]"
1 82 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 83 ILE 2.702 0.302 15 0 "[ . 1 . 2]"
1 84 GLU 0.598 0.164 8 0 "[ . 1 . 2]"
1 85 GLY 1.371 0.258 2 0 "[ . 1 . 2]"
1 86 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 87 ASN 0.284 0.067 2 0 "[ . 1 . 2]"
1 88 ARG 4.300 0.302 15 0 "[ . 1 . 2]"
1 89 VAL 0.945 0.239 19 0 "[ . 1 . 2]"
1 90 PRO 0.469 0.065 11 0 "[ . 1 . 2]"
1 91 VAL 0.038 0.038 18 0 "[ . 1 . 2]"
1 92 VAL 1.219 0.207 6 0 "[ . 1 . 2]"
1 93 TYR 0.299 0.128 1 0 "[ . 1 . 2]"
1 94 ILE 0.721 0.402 7 0 "[ . 1 . 2]"
1 95 ALA 0.172 0.113 7 0 "[ . 1 . 2]"
1 96 GLU 1.780 0.402 7 0 "[ . 1 . 2]"
1 97 SER 0.910 0.152 14 0 "[ . 1 . 2]"
1 98 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 99 GLY 0.767 0.152 14 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 11 MET H 1 11 MET QG 1.800 . 5.000 3.493 2.159 4.586 . 0 0 "[ . 1 . 2]" 1
2 1 12 LYS H 1 12 LYS HG3 1.800 . 5.000 3.494 2.005 4.610 . 0 0 "[ . 1 . 2]" 1
3 1 12 LYS H 1 12 LYS HG2 1.800 . 5.000 3.822 2.031 4.983 . 0 0 "[ . 1 . 2]" 1
4 1 13 ARG QB 1 13 ARG HD3 1.800 . 5.000 2.813 2.380 3.488 . 0 0 "[ . 1 . 2]" 1
5 1 13 ARG QB 1 13 ARG HD2 1.800 . 5.000 2.707 2.368 3.561 . 0 0 "[ . 1 . 2]" 1
6 1 13 ARG H 1 13 ARG QG 1.800 . 5.000 3.429 2.009 4.401 . 0 0 "[ . 1 . 2]" 1
7 1 14 SER HA 1 15 GLY H 1.800 . 3.500 2.899 2.165 3.560 0.060 19 0 "[ . 1 . 2]" 1
8 1 15 GLY QA 1 59 TYR QD 1.800 . 6.000 4.757 3.014 6.175 0.175 9 0 "[ . 1 . 2]" 1
9 1 15 GLY QA 1 61 TRP HD1 1.800 . 5.000 3.019 1.903 4.596 . 0 0 "[ . 1 . 2]" 1
10 1 15 GLY QA 1 61 TRP HE1 1.800 . 6.000 3.604 2.570 4.621 . 0 0 "[ . 1 . 2]" 1
11 1 15 GLY H 1 16 ARG H 1.800 . 5.000 3.997 2.781 4.642 . 0 0 "[ . 1 . 2]" 1
12 1 15 GLY H 1 61 TRP HD1 1.800 . 6.000 4.395 2.266 6.005 0.005 10 0 "[ . 1 . 2]" 1
13 1 16 ARG HA 1 16 ARG QD 1.800 . 5.000 3.460 2.036 4.564 . 0 0 "[ . 1 . 2]" 1
14 1 16 ARG HA 1 17 GLU H 1.800 . 3.500 2.194 2.138 2.254 . 0 0 "[ . 1 . 2]" 1
15 1 16 ARG HA 1 61 TRP HE1 1.800 . 6.000 4.094 3.361 5.077 . 0 0 "[ . 1 . 2]" 1
16 1 16 ARG QB 1 16 ARG QD 1.800 . 3.500 2.440 2.168 2.856 . 0 0 "[ . 1 . 2]" 1
17 1 16 ARG QB 1 60 VAL HA 1.800 . 5.000 3.163 2.680 4.263 . 0 0 "[ . 1 . 2]" 1
18 1 16 ARG QB 1 60 VAL MG1 1.800 . 5.000 1.925 1.670 3.616 0.130 18 0 "[ . 1 . 2]" 1
19 1 16 ARG HB3 1 17 GLU H 1.800 . 5.000 3.986 3.292 4.421 . 0 0 "[ . 1 . 2]" 1
20 1 16 ARG HB2 1 17 GLU H 1.800 . 5.000 4.296 3.417 4.554 . 0 0 "[ . 1 . 2]" 1
21 1 16 ARG QD 1 18 ILE MG 1.800 . 5.000 3.908 2.205 5.119 0.119 14 0 "[ . 1 . 2]" 1
22 1 16 ARG QG 1 17 GLU H 1.800 . 5.000 3.754 2.679 4.878 . 0 0 "[ . 1 . 2]" 1
23 1 16 ARG QG 1 18 ILE MG 1.800 . 5.000 3.470 2.124 5.169 0.169 19 0 "[ . 1 . 2]" 1
24 1 16 ARG QG 1 60 VAL MG1 1.800 . 5.000 3.207 1.894 3.949 . 0 0 "[ . 1 . 2]" 1
25 1 16 ARG H 1 16 ARG QG 1.800 . 5.000 3.435 2.096 4.114 . 0 0 "[ . 1 . 2]" 1
26 1 16 ARG H 1 59 TYR H 1.800 . 6.000 4.901 3.976 5.816 . 0 0 "[ . 1 . 2]" 1
27 1 16 ARG H 1 60 VAL HA 1.800 . 5.000 2.420 2.019 3.012 . 0 0 "[ . 1 . 2]" 1
28 1 16 ARG H 1 60 VAL MG1 1.800 . 5.000 3.048 2.106 3.965 . 0 0 "[ . 1 . 2]" 1
29 1 16 ARG H 1 61 TRP HD1 1.800 . 5.000 3.381 2.331 4.785 . 0 0 "[ . 1 . 2]" 1
30 1 16 ARG H 1 61 TRP HE1 1.800 . 6.000 4.266 3.055 5.364 . 0 0 "[ . 1 . 2]" 1
31 1 17 GLU HA 1 18 ILE MG 1.800 . 5.000 3.840 3.517 4.112 . 0 0 "[ . 1 . 2]" 1
32 1 17 GLU HA 1 18 ILE H 1.800 . 3.500 2.156 2.101 2.216 . 0 0 "[ . 1 . 2]" 1
33 1 17 GLU HA 1 61 TRP HE1 1.800 . 6.000 3.932 3.120 4.676 . 0 0 "[ . 1 . 2]" 1
34 1 17 GLU HA 1 61 TRP H 1.800 . 5.000 2.993 2.535 3.445 . 0 0 "[ . 1 . 2]" 1
35 1 17 GLU QB 1 61 TRP HE1 1.800 . 5.000 3.596 2.682 5.217 0.217 17 0 "[ . 1 . 2]" 1
36 1 17 GLU QB 1 61 TRP HZ2 1.800 . 5.000 3.065 2.491 4.975 . 0 0 "[ . 1 . 2]" 1
37 1 17 GLU HB3 1 18 ILE H 1.800 . 5.000 4.191 3.674 4.457 . 0 0 "[ . 1 . 2]" 1
38 1 17 GLU HB2 1 18 ILE H 1.800 . 5.000 4.351 4.134 4.547 . 0 0 "[ . 1 . 2]" 1
39 1 17 GLU QG 1 18 ILE H 1.800 . 5.000 3.137 2.415 4.402 . 0 0 "[ . 1 . 2]" 1
40 1 17 GLU HG3 1 62 PHE HA 1.800 . 5.000 3.297 1.815 5.242 0.242 17 0 "[ . 1 . 2]" 1
41 1 17 GLU HG2 1 62 PHE HA 1.800 . 5.000 3.638 2.362 5.211 0.211 10 0 "[ . 1 . 2]" 1
42 1 17 GLU H 1 17 GLU HB3 1.800 . 3.500 2.644 2.426 3.616 0.116 10 0 "[ . 1 . 2]" 1
43 1 17 GLU H 1 17 GLU HB2 1.800 . 3.500 2.621 2.285 2.823 . 0 0 "[ . 1 . 2]" 1
44 1 17 GLU H 1 17 GLU QG 1.800 . 5.000 3.905 2.648 4.054 . 0 0 "[ . 1 . 2]" 1
45 1 17 GLU H 1 18 ILE H 1.800 . 5.000 4.391 4.251 4.567 . 0 0 "[ . 1 . 2]" 1
46 1 17 GLU H 1 61 TRP HE1 1.800 . 5.000 3.746 3.117 4.483 . 0 0 "[ . 1 . 2]" 1
47 1 18 ILE HA 1 18 ILE MD 1.800 . 5.000 4.264 4.221 4.288 . 0 0 "[ . 1 . 2]" 1
48 1 18 ILE HA 1 18 ILE MG 1.800 . 3.500 2.418 2.373 2.478 . 0 0 "[ . 1 . 2]" 1
49 1 18 ILE HA 1 19 THR MG 1.800 . 5.000 3.759 3.513 4.084 . 0 0 "[ . 1 . 2]" 1
50 1 18 ILE HA 1 19 THR H 1.800 . 3.500 2.501 2.445 2.628 . 0 0 "[ . 1 . 2]" 1
51 1 18 ILE HB 1 19 THR H 1.800 . 3.500 2.311 2.102 2.534 . 0 0 "[ . 1 . 2]" 1
52 1 18 ILE HB 1 22 ASP QB 1.800 . 5.000 2.185 1.713 4.282 0.087 10 0 "[ . 1 . 2]" 1
53 1 18 ILE HB 1 22 ASP H 1.800 . 6.000 4.356 3.954 5.100 . 0 0 "[ . 1 . 2]" 1
54 1 18 ILE MD 1 19 THR H 1.800 . 5.000 4.063 3.748 4.411 . 0 0 "[ . 1 . 2]" 1
55 1 18 ILE MD 1 22 ASP HB3 1.800 . 5.000 3.383 2.793 5.030 0.030 11 0 "[ . 1 . 2]" 1
56 1 18 ILE MD 1 22 ASP HB2 1.800 . 5.000 3.578 2.390 5.034 0.034 8 0 "[ . 1 . 2]" 1
57 1 18 ILE MD 1 22 ASP H 1.800 . 6.000 4.566 4.141 4.986 . 0 0 "[ . 1 . 2]" 1
58 1 18 ILE MD 1 23 PHE HA 1.800 . 5.000 2.360 2.067 2.674 . 0 0 "[ . 1 . 2]" 1
59 1 18 ILE MD 1 23 PHE HB3 1.800 . 5.000 3.491 3.361 3.752 . 0 0 "[ . 1 . 2]" 1
60 1 18 ILE MD 1 23 PHE HB2 1.800 . 5.000 2.179 1.963 2.484 . 0 0 "[ . 1 . 2]" 1
61 1 18 ILE MD 1 23 PHE QD 1.800 . 5.000 2.952 2.344 3.352 . 0 0 "[ . 1 . 2]" 1
62 1 18 ILE MD 1 23 PHE H 1.800 . 5.000 2.762 2.438 3.004 . 0 0 "[ . 1 . 2]" 1
63 1 18 ILE MD 1 24 VAL H 1.800 . 6.000 4.782 4.581 4.956 . 0 0 "[ . 1 . 2]" 1
64 1 18 ILE MD 1 27 TYR QD 1.800 . 5.000 2.678 2.408 3.008 . 0 0 "[ . 1 . 2]" 1
65 1 18 ILE MD 1 27 TYR QE 1.800 . 3.500 2.335 1.895 2.750 . 0 0 "[ . 1 . 2]" 1
66 1 18 ILE MD 1 60 VAL HB 1.800 . 5.000 2.555 2.086 3.239 . 0 0 "[ . 1 . 2]" 1
67 1 18 ILE MD 1 60 VAL MG1 1.800 . 5.000 3.288 2.713 3.781 . 0 0 "[ . 1 . 2]" 1
68 1 18 ILE MD 1 62 PHE QB 1.800 . 6.000 3.512 3.154 4.307 . 0 0 "[ . 1 . 2]" 1
69 1 18 ILE MD 1 62 PHE QD 1.800 . 5.000 2.550 2.278 3.023 . 0 0 "[ . 1 . 2]" 1
70 1 18 ILE MD 1 62 PHE QE 1.800 . 6.000 3.617 3.167 3.993 . 0 0 "[ . 1 . 2]" 1
71 1 18 ILE MD 1 62 PHE HZ 1.800 . 6.000 5.553 5.110 5.880 . 0 0 "[ . 1 . 2]" 1
72 1 18 ILE QG 1 19 THR H 1.800 . 5.000 3.369 3.123 3.625 . 0 0 "[ . 1 . 2]" 1
73 1 18 ILE QG 1 23 PHE QB 1.800 . 6.000 3.135 2.807 3.529 . 0 0 "[ . 1 . 2]" 1
74 1 18 ILE QG 1 60 VAL HB 1.800 . 5.000 2.814 2.461 3.332 . 0 0 "[ . 1 . 2]" 1
75 1 18 ILE QG 1 62 PHE QE 1.800 . 5.000 4.514 3.966 4.819 . 0 0 "[ . 1 . 2]" 1
76 1 18 ILE HG13 1 61 TRP H 1.800 . 5.000 4.498 4.108 4.998 . 0 0 "[ . 1 . 2]" 1
77 1 18 ILE HG13 1 62 PHE QB 1.800 . 6.000 2.292 1.914 3.088 . 0 0 "[ . 1 . 2]" 1
78 1 18 ILE HG13 1 62 PHE QD 1.800 . 5.000 2.941 2.488 3.494 . 0 0 "[ . 1 . 2]" 1
79 1 18 ILE HG12 1 61 TRP H 1.800 . 5.000 2.826 2.501 3.264 . 0 0 "[ . 1 . 2]" 1
80 1 18 ILE HG12 1 62 PHE QB 1.800 . 6.000 3.088 2.558 3.751 . 0 0 "[ . 1 . 2]" 1
81 1 18 ILE HG12 1 62 PHE QD 1.800 . 5.000 3.186 2.857 3.430 . 0 0 "[ . 1 . 2]" 1
82 1 18 ILE MD 1 18 ILE MG 1.800 . 5.000 2.053 1.988 2.115 . 0 0 "[ . 1 . 2]" 1
83 1 18 ILE QG 1 18 ILE MG 1.800 . 3.500 2.388 2.336 2.437 . 0 0 "[ . 1 . 2]" 1
84 1 18 ILE MG 1 19 THR H 1.800 . 5.000 3.722 3.607 3.856 . 0 0 "[ . 1 . 2]" 1
85 1 18 ILE MG 1 27 TYR QE 1.800 . 5.000 2.430 1.908 2.932 . 0 0 "[ . 1 . 2]" 1
86 1 18 ILE MG 1 60 VAL HB 1.800 . 5.000 2.219 2.011 2.491 . 0 0 "[ . 1 . 2]" 1
87 1 18 ILE MG 1 60 VAL MG1 1.800 . 5.000 2.533 2.168 3.140 . 0 0 "[ . 1 . 2]" 1
88 1 18 ILE MG 1 61 TRP H 1.800 . 5.000 3.323 2.992 3.662 . 0 0 "[ . 1 . 2]" 1
89 1 18 ILE MG 1 62 PHE QD 1.800 . 6.000 4.969 4.696 5.152 . 0 0 "[ . 1 . 2]" 1
90 1 18 ILE H 1 18 ILE MD 1.800 . 5.000 3.833 3.641 4.127 . 0 0 "[ . 1 . 2]" 1
91 1 18 ILE H 1 18 ILE HG13 1.800 . 5.000 3.022 2.864 3.160 . 0 0 "[ . 1 . 2]" 1
92 1 18 ILE H 1 18 ILE HG12 1.800 . 5.000 2.201 1.965 2.569 . 0 0 "[ . 1 . 2]" 1
93 1 18 ILE H 1 19 THR H 1.800 . 6.000 4.466 4.351 4.574 . 0 0 "[ . 1 . 2]" 1
94 1 18 ILE H 1 61 TRP H 1.800 . 5.000 3.077 2.599 3.497 . 0 0 "[ . 1 . 2]" 1
95 1 18 ILE H 1 62 PHE HA 1.800 . 5.000 3.462 2.909 4.183 . 0 0 "[ . 1 . 2]" 1
96 1 18 ILE H 1 62 PHE QB 1.800 . 6.000 3.398 2.979 3.827 . 0 0 "[ . 1 . 2]" 1
97 1 18 ILE H 1 62 PHE QD 1.800 . 6.000 4.600 4.213 5.004 . 0 0 "[ . 1 . 2]" 1
98 1 19 THR HA 1 19 THR MG 1.800 . 3.500 2.517 2.354 3.288 . 0 0 "[ . 1 . 2]" 1
99 1 19 THR HA 1 20 TRP H 1.800 . 2.700 2.389 2.258 2.503 . 0 0 "[ . 1 . 2]" 1
100 1 19 THR HB 1 22 ASP H 1.800 . 5.000 3.914 3.412 4.665 . 0 0 "[ . 1 . 2]" 1
101 1 19 THR HG1 1 22 ASP QB 1.800 . 6.000 3.356 2.060 5.341 . 0 0 "[ . 1 . 2]" 1
102 1 19 THR HG1 1 22 ASP H 1.800 . 5.000 2.811 2.230 4.939 . 0 0 "[ . 1 . 2]" 1
103 1 19 THR HG1 1 19 THR MG 1.800 . 5.000 2.364 2.087 3.072 . 0 0 "[ . 1 . 2]" 1
104 1 19 THR MG 1 20 TRP H 1.800 . 5.000 3.771 3.548 3.925 . 0 0 "[ . 1 . 2]" 1
105 1 19 THR MG 1 21 LYS H 1.800 . 5.000 4.176 2.772 4.620 . 0 0 "[ . 1 . 2]" 1
106 1 19 THR MG 1 22 ASP H 1.800 . 5.000 3.992 1.712 4.913 0.088 9 0 "[ . 1 . 2]" 1
107 1 19 THR H 1 19 THR HG1 1.800 . 5.000 2.667 1.991 4.646 . 0 0 "[ . 1 . 2]" 1
108 1 19 THR H 1 19 THR MG 1.800 . 3.500 2.488 2.043 2.919 . 0 0 "[ . 1 . 2]" 1
109 1 19 THR H 1 20 TRP H 1.800 . 5.000 4.553 4.496 4.590 . 0 0 "[ . 1 . 2]" 1
110 1 19 THR H 1 22 ASP QB 1.800 . 3.500 2.623 2.231 3.788 0.288 11 0 "[ . 1 . 2]" 1
111 1 19 THR H 1 22 ASP H 1.800 . 5.000 3.576 3.275 4.055 . 0 0 "[ . 1 . 2]" 1
112 1 19 THR H 1 23 PHE H 1.800 . 5.000 4.285 3.879 4.601 . 0 0 "[ . 1 . 2]" 1
113 1 20 TRP HA 1 20 TRP HE3 1.800 . 5.000 2.795 2.555 3.106 . 0 0 "[ . 1 . 2]" 1
114 1 20 TRP HA 1 23 PHE HB3 1.800 . 5.000 2.417 2.158 2.870 . 0 0 "[ . 1 . 2]" 1
115 1 20 TRP HA 1 23 PHE HB2 1.800 . 5.000 3.342 3.097 3.944 . 0 0 "[ . 1 . 2]" 1
116 1 20 TRP HA 1 23 PHE QD 1.800 . 5.000 3.454 2.939 3.771 . 0 0 "[ . 1 . 2]" 1
117 1 20 TRP HA 1 23 PHE H 1.800 . 5.000 3.535 3.343 3.821 . 0 0 "[ . 1 . 2]" 1
118 1 20 TRP HA 1 24 VAL H 1.800 . 5.000 4.202 3.991 4.512 . 0 0 "[ . 1 . 2]" 1
119 1 20 TRP HB3 1 21 LYS H 1.800 . 5.000 2.697 2.606 2.794 . 0 0 "[ . 1 . 2]" 1
120 1 20 TRP HB2 1 21 LYS H 1.800 . 5.000 3.996 3.931 4.074 . 0 0 "[ . 1 . 2]" 1
121 1 20 TRP HD1 1 21 LYS HA 1.800 . 5.000 3.766 3.540 4.189 . 0 0 "[ . 1 . 2]" 1
122 1 20 TRP HD1 1 21 LYS QB 1.800 . 5.000 4.357 3.923 5.079 0.079 20 0 "[ . 1 . 2]" 1
123 1 20 TRP HD1 1 21 LYS H 1.800 . 5.000 3.810 3.548 4.151 . 0 0 "[ . 1 . 2]" 1
124 1 20 TRP HD1 1 24 VAL MG2 1.800 . 5.000 3.401 3.060 3.967 . 0 0 "[ . 1 . 2]" 1
125 1 20 TRP HE1 1 24 VAL MG1 1.800 . 5.000 4.629 4.232 5.108 0.108 2 0 "[ . 1 . 2]" 1
126 1 20 TRP HE1 1 24 VAL MG2 1.800 . 5.000 2.863 2.515 3.393 . 0 0 "[ . 1 . 2]" 1
127 1 20 TRP HE1 1 73 ASN QB 1.800 . 5.000 3.345 2.466 4.064 . 0 0 "[ . 1 . 2]" 1
128 1 20 TRP HE1 1 77 LEU MD2 1.800 . 5.000 3.036 2.462 3.776 . 0 0 "[ . 1 . 2]" 1
129 1 20 TRP HE3 1 23 PHE QD 1.800 . 5.000 3.166 2.957 3.434 . 0 0 "[ . 1 . 2]" 1
130 1 20 TRP HE3 1 24 VAL MG2 1.800 . 5.000 4.484 4.163 4.840 . 0 0 "[ . 1 . 2]" 1
131 1 20 TRP HE3 1 62 PHE QE 1.800 . 5.000 2.539 2.246 2.874 . 0 0 "[ . 1 . 2]" 1
132 1 20 TRP HE3 1 62 PHE HZ 1.800 . 6.000 3.276 2.729 4.018 . 0 0 "[ . 1 . 2]" 1
133 1 20 TRP HH2 1 74 LEU HA 1.800 . 5.000 2.468 2.088 2.890 . 0 0 "[ . 1 . 2]" 1
134 1 20 TRP HH2 1 74 LEU HB3 1.800 . 6.000 3.967 3.631 4.398 . 0 0 "[ . 1 . 2]" 1
135 1 20 TRP HH2 1 74 LEU HB2 1.800 . 6.000 2.354 1.950 2.794 . 0 0 "[ . 1 . 2]" 1
136 1 20 TRP HH2 1 74 LEU MD1 1.800 . 5.000 2.304 1.901 2.779 . 0 0 "[ . 1 . 2]" 1
137 1 20 TRP HH2 1 74 LEU H 1.800 . 5.000 3.435 3.067 3.962 . 0 0 "[ . 1 . 2]" 1
138 1 20 TRP HH2 1 77 LEU QB 1.800 . 6.000 4.258 3.753 4.729 . 0 0 "[ . 1 . 2]" 1
139 1 20 TRP H 1 20 TRP HB3 1.800 . 3.500 2.518 2.427 2.583 . 0 0 "[ . 1 . 2]" 1
140 1 20 TRP H 1 20 TRP HB2 1.800 . 3.500 2.612 2.511 2.758 . 0 0 "[ . 1 . 2]" 1
141 1 20 TRP H 1 20 TRP HD1 1.800 . 5.000 4.999 4.861 5.064 0.064 10 0 "[ . 1 . 2]" 1
142 1 20 TRP H 1 21 LYS H 1.800 . 3.500 2.834 2.744 2.933 . 0 0 "[ . 1 . 2]" 1
143 1 20 TRP H 1 22 ASP H 1.800 . 5.000 4.486 4.234 4.653 . 0 0 "[ . 1 . 2]" 1
144 1 20 TRP HZ2 1 24 VAL MG2 1.800 . 5.000 3.524 3.245 3.847 . 0 0 "[ . 1 . 2]" 1
145 1 20 TRP HZ2 1 73 ASN HB3 1.800 . 5.000 3.078 2.338 5.110 0.110 20 0 "[ . 1 . 2]" 1
146 1 20 TRP HZ2 1 73 ASN HB2 1.800 . 5.000 3.461 2.953 3.832 . 0 0 "[ . 1 . 2]" 1
147 1 20 TRP HZ2 1 74 LEU HA 1.800 . 5.000 2.870 2.560 3.333 . 0 0 "[ . 1 . 2]" 1
148 1 20 TRP HZ2 1 74 LEU QB 1.800 . 6.000 4.053 3.619 4.565 . 0 0 "[ . 1 . 2]" 1
149 1 20 TRP HZ2 1 74 LEU MD1 1.800 . 5.000 3.806 3.436 4.267 . 0 0 "[ . 1 . 2]" 1
150 1 20 TRP HZ2 1 74 LEU H 1.800 . 5.000 3.861 3.137 4.347 . 0 0 "[ . 1 . 2]" 1
151 1 20 TRP HZ2 1 77 LEU QB 1.800 . 5.000 3.027 2.408 3.570 . 0 0 "[ . 1 . 2]" 1
152 1 20 TRP HZ2 1 77 LEU MD2 1.800 . 5.000 2.304 1.995 3.421 . 0 0 "[ . 1 . 2]" 1
153 1 20 TRP HZ3 1 24 VAL MG2 1.800 . 5.000 4.934 4.436 5.400 0.400 6 0 "[ . 1 . 2]" 1
154 1 20 TRP HZ3 1 36 LEU MD1 1.800 . 5.000 3.706 2.817 4.787 . 0 0 "[ . 1 . 2]" 1
155 1 20 TRP HZ3 1 62 PHE QE 1.800 . 5.000 2.885 2.224 3.454 . 0 0 "[ . 1 . 2]" 1
156 1 20 TRP HZ3 1 62 PHE HZ 1.800 . 6.000 2.562 2.294 3.124 . 0 0 "[ . 1 . 2]" 1
157 1 20 TRP HZ3 1 74 LEU MD1 1.800 . 5.000 3.288 2.798 3.809 . 0 0 "[ . 1 . 2]" 1
158 1 21 LYS HA 1 21 LYS QD 1.800 . 5.000 3.850 2.034 4.576 . 0 0 "[ . 1 . 2]" 1
159 1 21 LYS HA 1 24 VAL HB 1.800 . 5.000 3.171 2.505 3.672 . 0 0 "[ . 1 . 2]" 1
160 1 21 LYS HA 1 24 VAL MG1 1.800 . 5.000 4.438 3.921 4.923 . 0 0 "[ . 1 . 2]" 1
161 1 21 LYS HA 1 24 VAL MG2 1.800 . 5.000 3.118 2.206 3.808 . 0 0 "[ . 1 . 2]" 1
162 1 21 LYS HA 1 24 VAL H 1.800 . 5.000 3.644 2.897 3.964 . 0 0 "[ . 1 . 2]" 1
163 1 21 LYS HA 1 25 ASN H 1.800 . 5.000 4.234 3.770 4.619 . 0 0 "[ . 1 . 2]" 1
164 1 21 LYS QB 1 21 LYS QD 1.800 . 3.500 2.320 2.162 2.885 . 0 0 "[ . 1 . 2]" 1
165 1 21 LYS QB 1 21 LYS QE 1.800 . 5.000 3.098 1.988 3.934 . 0 0 "[ . 1 . 2]" 1
166 1 21 LYS QB 1 22 ASP H 1.800 . 3.500 2.598 2.354 3.435 . 0 0 "[ . 1 . 2]" 1
167 1 21 LYS QD 1 25 ASN HD21 1.800 . 6.000 4.751 2.506 6.240 0.240 9 0 "[ . 1 . 2]" 1
168 1 21 LYS QD 1 25 ASN HD22 1.800 . 6.000 4.383 2.159 5.508 . 0 0 "[ . 1 . 2]" 1
169 1 21 LYS QE 1 25 ASN HD21 1.800 . 6.000 4.509 3.206 6.115 0.115 8 0 "[ . 1 . 2]" 1
170 1 21 LYS QE 1 25 ASN HD22 1.800 . 6.000 4.009 2.234 6.121 0.121 14 0 "[ . 1 . 2]" 1
171 1 21 LYS QG 1 22 ASP H 1.800 . 5.000 3.599 2.138 4.445 . 0 0 "[ . 1 . 2]" 1
172 1 21 LYS QG 1 25 ASN QD 1.800 . 5.000 2.829 2.135 4.049 . 0 0 "[ . 1 . 2]" 1
173 1 21 LYS HG3 1 25 ASN HD21 1.800 . 6.000 3.938 2.789 6.108 0.108 20 0 "[ . 1 . 2]" 1
174 1 21 LYS HG3 1 25 ASN HD22 1.800 . 6.000 3.714 2.784 5.799 . 0 0 "[ . 1 . 2]" 1
175 1 21 LYS HG2 1 25 ASN HD21 1.800 . 6.000 3.772 2.530 5.563 . 0 0 "[ . 1 . 2]" 1
176 1 21 LYS HG2 1 25 ASN HD22 1.800 . 6.000 3.752 2.331 5.650 . 0 0 "[ . 1 . 2]" 1
177 1 21 LYS H 1 21 LYS QB 1.800 . 3.500 2.279 2.178 2.490 . 0 0 "[ . 1 . 2]" 1
178 1 21 LYS H 1 21 LYS QD 1.800 . 5.000 4.391 3.767 4.799 . 0 0 "[ . 1 . 2]" 1
179 1 21 LYS H 1 21 LYS HG3 1.800 . 5.000 4.229 2.246 4.589 . 0 0 "[ . 1 . 2]" 1
180 1 21 LYS H 1 21 LYS HG2 1.800 . 5.000 4.329 2.273 4.654 . 0 0 "[ . 1 . 2]" 1
181 1 21 LYS H 1 22 ASP H 1.800 . 3.500 2.916 2.606 3.007 . 0 0 "[ . 1 . 2]" 1
182 1 22 ASP HA 1 24 VAL H 1.800 . 5.000 4.531 4.162 4.786 . 0 0 "[ . 1 . 2]" 1
183 1 22 ASP HA 1 25 ASN H 1.800 . 5.000 3.753 3.335 4.088 . 0 0 "[ . 1 . 2]" 1
184 1 22 ASP HA 1 26 ASN QD 1.800 . 5.000 3.695 1.760 4.755 0.040 20 0 "[ . 1 . 2]" 1
185 1 22 ASP QB 1 23 PHE H 1.800 . 3.500 2.600 2.309 3.534 0.034 11 0 "[ . 1 . 2]" 1
186 1 22 ASP QB 1 26 ASN QD 1.800 . 5.000 3.719 2.120 4.973 . 0 0 "[ . 1 . 2]" 1
187 1 22 ASP H 1 22 ASP QB 1.800 . 3.500 2.392 2.205 2.588 . 0 0 "[ . 1 . 2]" 1
188 1 22 ASP H 1 23 PHE H 1.800 . 3.500 2.618 2.509 2.765 . 0 0 "[ . 1 . 2]" 1
189 1 22 ASP H 1 24 VAL H 1.800 . 5.000 4.317 4.006 4.529 . 0 0 "[ . 1 . 2]" 1
190 1 23 PHE HA 1 23 PHE QD 1.800 . 5.000 2.519 2.421 2.645 . 0 0 "[ . 1 . 2]" 1
191 1 23 PHE HA 1 26 ASN QB 1.800 . 5.000 4.271 3.542 5.225 0.225 14 0 "[ . 1 . 2]" 1
192 1 23 PHE HA 1 26 ASN H 1.800 . 5.000 4.478 4.173 4.847 . 0 0 "[ . 1 . 2]" 1
193 1 23 PHE HA 1 27 TYR QB 1.800 . 5.000 2.830 2.539 3.162 . 0 0 "[ . 1 . 2]" 1
194 1 23 PHE HA 1 27 TYR QD 1.800 . 3.500 1.797 1.607 2.192 0.193 16 0 "[ . 1 . 2]" 1
195 1 23 PHE HA 1 27 TYR QE 1.800 . 5.000 3.593 3.254 3.779 . 0 0 "[ . 1 . 2]" 1
196 1 23 PHE HA 1 27 TYR H 1.800 . 5.000 3.946 3.742 4.253 . 0 0 "[ . 1 . 2]" 1
197 1 23 PHE HA 1 28 LEU H 1.800 . 5.000 4.069 3.837 4.305 . 0 0 "[ . 1 . 2]" 1
198 1 23 PHE QB 1 27 TYR QD 1.800 . 5.000 3.690 3.364 4.007 . 0 0 "[ . 1 . 2]" 1
199 1 23 PHE HB3 1 24 VAL MG2 1.800 . 6.000 3.205 2.980 3.390 . 0 0 "[ . 1 . 2]" 1
200 1 23 PHE HB3 1 24 VAL H 1.800 . 5.000 2.579 2.431 2.739 . 0 0 "[ . 1 . 2]" 1
201 1 23 PHE HB2 1 24 VAL MG2 1.800 . 6.000 4.707 4.497 4.877 . 0 0 "[ . 1 . 2]" 1
202 1 23 PHE HB2 1 24 VAL H 1.800 . 5.000 3.947 3.848 4.046 . 0 0 "[ . 1 . 2]" 1
203 1 23 PHE QD 1 24 VAL HA 1.800 . 6.000 3.891 3.643 4.133 . 0 0 "[ . 1 . 2]" 1
204 1 23 PHE QD 1 24 VAL MG2 1.800 . 5.000 2.800 2.377 3.265 . 0 0 "[ . 1 . 2]" 1
205 1 23 PHE QD 1 24 VAL H 1.800 . 5.000 3.467 3.339 3.635 . 0 0 "[ . 1 . 2]" 1
206 1 23 PHE QD 1 27 TYR QB 1.800 . 5.000 2.778 2.487 3.237 . 0 0 "[ . 1 . 2]" 1
207 1 23 PHE QD 1 27 TYR QD 1.800 . 5.000 3.109 1.828 3.786 . 0 0 "[ . 1 . 2]" 1
208 1 23 PHE QD 1 28 LEU MD1 1.800 . 5.000 4.472 3.794 4.824 . 0 0 "[ . 1 . 2]" 1
209 1 23 PHE QD 1 28 LEU H 1.800 . 5.000 4.014 3.739 4.437 . 0 0 "[ . 1 . 2]" 1
210 1 23 PHE QD 1 33 VAL MG2 1.800 . 6.000 3.485 3.150 3.767 . 0 0 "[ . 1 . 2]" 1
211 1 23 PHE QD 1 46 VAL MG1 1.800 . 5.000 2.746 2.339 3.365 . 0 0 "[ . 1 . 2]" 1
212 1 23 PHE QD 1 46 VAL MG2 1.800 . 5.000 2.371 2.088 2.924 . 0 0 "[ . 1 . 2]" 1
213 1 23 PHE QE 1 24 VAL HA 1.800 . 6.000 4.528 4.364 4.785 . 0 0 "[ . 1 . 2]" 1
214 1 23 PHE QE 1 24 VAL MG2 1.800 . 5.000 3.858 3.177 4.598 . 0 0 "[ . 1 . 2]" 1
215 1 23 PHE QE 1 27 TYR QB 1.800 . 5.000 3.497 2.921 4.263 . 0 0 "[ . 1 . 2]" 1
216 1 23 PHE QE 1 28 LEU QB 1.800 . 6.000 3.045 2.762 3.397 . 0 0 "[ . 1 . 2]" 1
217 1 23 PHE QE 1 28 LEU MD1 1.800 . 5.000 2.973 2.514 3.472 . 0 0 "[ . 1 . 2]" 1
218 1 23 PHE QE 1 28 LEU MD2 1.800 . 5.000 2.562 2.012 4.677 . 0 0 "[ . 1 . 2]" 1
219 1 23 PHE QE 1 28 LEU H 1.800 . 5.000 4.270 3.983 4.782 . 0 0 "[ . 1 . 2]" 1
220 1 23 PHE QE 1 33 VAL MG1 1.800 . 5.000 2.553 2.114 3.030 . 0 0 "[ . 1 . 2]" 1
221 1 23 PHE QE 1 33 VAL MG2 1.800 . 5.000 2.207 1.831 2.994 . 0 0 "[ . 1 . 2]" 1
222 1 23 PHE QE 1 36 LEU MD1 1.800 . 6.000 2.779 2.275 3.014 . 0 0 "[ . 1 . 2]" 1
223 1 23 PHE QE 1 36 LEU MD2 1.800 . 5.000 2.238 1.761 2.563 0.039 6 0 "[ . 1 . 2]" 1
224 1 23 PHE QE 1 46 VAL HB 1.800 . 6.000 4.909 4.453 5.449 . 0 0 "[ . 1 . 2]" 1
225 1 23 PHE QE 1 46 VAL MG1 1.800 . 5.000 2.352 2.040 3.113 . 0 0 "[ . 1 . 2]" 1
226 1 23 PHE QE 1 46 VAL MG2 1.800 . 5.000 2.882 2.494 3.258 . 0 0 "[ . 1 . 2]" 1
227 1 23 PHE H 1 23 PHE HB3 1.800 . 3.500 2.435 2.350 2.515 . 0 0 "[ . 1 . 2]" 1
228 1 23 PHE H 1 23 PHE HB2 1.800 . 3.500 2.717 2.594 2.795 . 0 0 "[ . 1 . 2]" 1
229 1 23 PHE H 1 23 PHE QD 1.800 . 5.000 4.235 4.210 4.258 . 0 0 "[ . 1 . 2]" 1
230 1 23 PHE H 1 24 VAL MG2 1.800 . 5.000 4.240 4.082 4.556 . 0 0 "[ . 1 . 2]" 1
231 1 23 PHE H 1 24 VAL H 1.800 . 3.500 2.888 2.784 2.963 . 0 0 "[ . 1 . 2]" 1
232 1 23 PHE H 1 27 TYR QD 1.800 . 5.000 4.076 3.773 4.690 . 0 0 "[ . 1 . 2]" 1
233 1 23 PHE HZ 1 28 LEU MD1 1.800 . 5.000 2.363 1.983 2.839 . 0 0 "[ . 1 . 2]" 1
234 1 23 PHE HZ 1 33 VAL MG1 1.800 . 6.000 3.295 2.433 4.380 . 0 0 "[ . 1 . 2]" 1
235 1 23 PHE HZ 1 33 VAL MG2 1.800 . 5.000 3.586 2.653 4.648 . 0 0 "[ . 1 . 2]" 1
236 1 23 PHE HZ 1 36 LEU MD1 1.800 . 5.000 1.898 1.764 2.237 0.036 9 0 "[ . 1 . 2]" 1
237 1 23 PHE HZ 1 36 LEU MD2 1.800 . 5.000 2.494 1.918 3.114 . 0 0 "[ . 1 . 2]" 1
238 1 24 VAL HA 1 24 VAL MG1 1.800 . 3.500 2.487 2.414 2.595 . 0 0 "[ . 1 . 2]" 1
239 1 24 VAL HA 1 24 VAL MG2 1.800 . 3.500 2.405 2.318 2.493 . 0 0 "[ . 1 . 2]" 1
240 1 24 VAL HA 1 28 LEU HA 1.800 . 6.000 4.926 4.604 5.191 . 0 0 "[ . 1 . 2]" 1
241 1 24 VAL HA 1 28 LEU HB3 1.800 . 5.000 2.081 1.762 2.290 0.038 8 0 "[ . 1 . 2]" 1
242 1 24 VAL HA 1 28 LEU HB2 1.800 . 5.000 3.049 2.717 3.321 . 0 0 "[ . 1 . 2]" 1
243 1 24 VAL HA 1 28 LEU MD2 1.800 . 5.000 2.938 2.530 3.503 . 0 0 "[ . 1 . 2]" 1
244 1 24 VAL HA 1 28 LEU H 1.800 . 5.000 3.352 3.105 3.601 . 0 0 "[ . 1 . 2]" 1
245 1 24 VAL HA 1 29 SER H 1.800 . 5.000 3.531 3.312 3.758 . 0 0 "[ . 1 . 2]" 1
246 1 24 VAL HB 1 25 ASN HD21 1.800 . 6.000 3.757 1.853 5.856 . 0 0 "[ . 1 . 2]" 1
247 1 24 VAL HB 1 25 ASN HD22 1.800 . 6.000 4.023 2.950 5.167 . 0 0 "[ . 1 . 2]" 1
248 1 24 VAL HB 1 25 ASN H 1.800 . 3.500 2.351 2.217 2.595 . 0 0 "[ . 1 . 2]" 1
249 1 24 VAL HB 1 28 LEU MD2 1.800 . 6.000 5.004 4.490 5.552 . 0 0 "[ . 1 . 2]" 1
250 1 24 VAL MG1 1 25 ASN HA 1.800 . 5.000 3.067 2.761 3.410 . 0 0 "[ . 1 . 2]" 1
251 1 24 VAL MG1 1 25 ASN H 1.800 . 5.000 3.185 2.840 3.465 . 0 0 "[ . 1 . 2]" 1
252 1 24 VAL MG1 1 77 LEU MD2 1.800 . 3.500 2.146 1.805 3.085 . 0 0 "[ . 1 . 2]" 1
253 1 24 VAL MG2 1 25 ASN H 1.800 . 5.000 3.757 3.652 3.927 . 0 0 "[ . 1 . 2]" 1
254 1 24 VAL MG2 1 28 LEU QB 1.800 . 5.000 3.569 3.153 3.779 . 0 0 "[ . 1 . 2]" 1
255 1 24 VAL MG2 1 28 LEU MD2 1.800 . 5.000 2.962 2.126 3.837 . 0 0 "[ . 1 . 2]" 1
256 1 24 VAL MG2 1 28 LEU HG 1.800 . 6.000 5.177 4.318 5.789 . 0 0 "[ . 1 . 2]" 1
257 1 24 VAL MG2 1 28 LEU H 1.800 . 5.000 5.089 4.836 5.217 0.217 16 0 "[ . 1 . 2]" 1
258 1 24 VAL MG2 1 74 LEU HA 1.800 . 6.000 5.155 4.648 5.655 . 0 0 "[ . 1 . 2]" 1
259 1 24 VAL MG2 1 77 LEU MD2 1.800 . 3.500 1.921 1.747 2.497 0.053 9 0 "[ . 1 . 2]" 1
260 1 24 VAL H 1 24 VAL HB 1.800 . 3.500 2.533 2.361 2.665 . 0 0 "[ . 1 . 2]" 1
261 1 24 VAL H 1 24 VAL MG1 1.800 . 5.000 3.791 3.745 3.823 . 0 0 "[ . 1 . 2]" 1
262 1 24 VAL H 1 24 VAL MG2 1.800 . 3.500 2.054 1.954 2.248 . 0 0 "[ . 1 . 2]" 1
263 1 24 VAL H 1 27 TYR H 1.800 . 5.000 4.874 4.765 5.007 0.007 18 0 "[ . 1 . 2]" 1
264 1 24 VAL H 1 29 SER H 1.800 . 6.000 5.815 5.695 5.917 . 0 0 "[ . 1 . 2]" 1
265 1 24 VAL H 1 77 LEU MD2 1.800 . 6.000 4.691 4.405 5.724 . 0 0 "[ . 1 . 2]" 1
266 1 25 ASN HB3 1 26 ASN H 1.800 . 5.000 3.673 3.356 4.192 . 0 0 "[ . 1 . 2]" 1
267 1 25 ASN HB2 1 26 ASN H 1.800 . 5.000 2.810 2.330 4.040 . 0 0 "[ . 1 . 2]" 1
268 1 25 ASN H 1 25 ASN QB 1.800 . 3.500 2.474 2.321 2.813 . 0 0 "[ . 1 . 2]" 1
269 1 25 ASN H 1 25 ASN HD21 1.800 . 5.000 2.959 1.809 4.678 . 0 0 "[ . 1 . 2]" 1
270 1 25 ASN H 1 25 ASN HD22 1.800 . 5.000 3.837 3.354 4.747 . 0 0 "[ . 1 . 2]" 1
271 1 25 ASN H 1 26 ASN H 1.800 . 3.500 2.691 2.510 2.821 . 0 0 "[ . 1 . 2]" 1
272 1 25 ASN H 1 27 TYR H 1.800 . 6.000 4.078 3.965 4.195 . 0 0 "[ . 1 . 2]" 1
273 1 25 ASN H 1 29 SER H 1.800 . 5.000 5.040 4.937 5.161 0.161 12 0 "[ . 1 . 2]" 1
274 1 26 ASN HA 1 30 LYS QB 1.800 . 6.000 4.897 4.421 5.525 . 0 0 "[ . 1 . 2]" 1
275 1 26 ASN HA 1 30 LYS QD 1.800 . 6.000 3.740 2.625 5.346 . 0 0 "[ . 1 . 2]" 1
276 1 26 ASN HA 1 30 LYS QE 1.800 . 5.000 3.092 2.144 4.770 . 0 0 "[ . 1 . 2]" 1
277 1 26 ASN HA 1 30 LYS QG 1.800 . 5.000 3.752 2.921 4.672 . 0 0 "[ . 1 . 2]" 1
278 1 26 ASN HB3 1 27 TYR QD 1.800 . 5.000 3.982 3.051 5.063 0.063 14 0 "[ . 1 . 2]" 1
279 1 26 ASN HB3 1 27 TYR QE 1.800 . 5.000 3.896 3.223 5.085 0.085 14 0 "[ . 1 . 2]" 1
280 1 26 ASN HB3 1 27 TYR H 1.800 . 5.000 3.930 2.812 4.508 . 0 0 "[ . 1 . 2]" 1
281 1 26 ASN HB2 1 27 TYR QD 1.800 . 5.000 3.516 2.813 5.034 0.034 9 0 "[ . 1 . 2]" 1
282 1 26 ASN HB2 1 27 TYR QE 1.800 . 5.000 3.584 2.815 5.075 0.075 9 0 "[ . 1 . 2]" 1
283 1 26 ASN HB2 1 27 TYR H 1.800 . 5.000 3.457 2.862 4.251 . 0 0 "[ . 1 . 2]" 1
284 1 26 ASN H 1 26 ASN QB 1.800 . 3.500 2.432 2.209 2.943 . 0 0 "[ . 1 . 2]" 1
285 1 26 ASN H 1 26 ASN QD 1.800 . 5.000 3.652 2.139 4.514 . 0 0 "[ . 1 . 2]" 1
286 1 26 ASN H 1 27 TYR QD 1.800 . 5.000 4.185 3.501 4.967 . 0 0 "[ . 1 . 2]" 1
287 1 26 ASN H 1 27 TYR H 1.800 . 3.500 2.490 2.418 2.585 . 0 0 "[ . 1 . 2]" 1
288 1 27 TYR HA 1 27 TYR QD 1.800 . 3.500 2.508 2.056 2.982 . 0 0 "[ . 1 . 2]" 1
289 1 27 TYR HA 1 30 LYS QD 1.800 . 6.000 4.233 3.008 5.886 . 0 0 "[ . 1 . 2]" 1
290 1 27 TYR HA 1 30 LYS H 1.800 . 5.000 3.971 3.748 4.244 . 0 0 "[ . 1 . 2]" 1
291 1 27 TYR HA 1 32 VAL MG2 1.800 . 3.500 2.025 1.845 2.391 . 0 0 "[ . 1 . 2]" 1
292 1 27 TYR QB 1 28 LEU HA 1.800 . 6.000 3.745 3.659 3.880 . 0 0 "[ . 1 . 2]" 1
293 1 27 TYR QB 1 28 LEU H 1.800 . 3.500 2.173 2.103 2.259 . 0 0 "[ . 1 . 2]" 1
294 1 27 TYR QB 1 33 VAL MG2 1.800 . 3.500 2.113 1.937 2.316 . 0 0 "[ . 1 . 2]" 1
295 1 27 TYR HB3 1 32 VAL MG2 1.800 . 5.000 2.708 2.395 2.930 . 0 0 "[ . 1 . 2]" 1
296 1 27 TYR HB2 1 32 VAL MG2 1.800 . 5.000 3.937 3.685 4.134 . 0 0 "[ . 1 . 2]" 1
297 1 27 TYR QD 1 28 LEU H 1.800 . 5.000 4.026 3.820 4.222 . 0 0 "[ . 1 . 2]" 1
298 1 27 TYR QD 1 32 VAL MG1 1.800 . 5.000 4.337 3.840 4.860 . 0 0 "[ . 1 . 2]" 1
299 1 27 TYR QD 1 32 VAL MG2 1.800 . 3.500 2.249 1.977 2.678 . 0 0 "[ . 1 . 2]" 1
300 1 27 TYR QD 1 33 VAL MG2 1.800 . 5.000 3.737 3.421 4.025 . 0 0 "[ . 1 . 2]" 1
301 1 27 TYR QE 1 60 VAL MG1 1.800 . 5.000 3.060 2.365 3.448 . 0 0 "[ . 1 . 2]" 1
302 1 27 TYR H 1 27 TYR QB 1.800 . 3.500 2.662 2.552 2.743 . 0 0 "[ . 1 . 2]" 1
303 1 27 TYR H 1 28 LEU HB3 1.800 . 6.000 4.480 4.287 4.804 . 0 0 "[ . 1 . 2]" 1
304 1 27 TYR H 1 28 LEU HB2 1.800 . 6.000 4.820 4.701 4.940 . 0 0 "[ . 1 . 2]" 1
305 1 27 TYR H 1 28 LEU H 1.800 . 3.500 2.454 2.294 2.531 . 0 0 "[ . 1 . 2]" 1
306 1 27 TYR H 1 29 SER H 1.800 . 5.000 3.654 3.395 3.813 . 0 0 "[ . 1 . 2]" 1
307 1 27 TYR H 1 30 LYS QG 1.800 . 6.000 4.533 3.516 5.802 . 0 0 "[ . 1 . 2]" 1
308 1 27 TYR H 1 32 VAL MG2 1.800 . 5.000 4.481 4.344 4.737 . 0 0 "[ . 1 . 2]" 1
309 1 27 TYR H 1 33 VAL MG2 1.800 . 6.000 4.693 4.517 4.940 . 0 0 "[ . 1 . 2]" 1
310 1 28 LEU HA 1 28 LEU MD1 1.800 . 3.500 2.294 1.973 3.589 0.089 7 0 "[ . 1 . 2]" 1
311 1 28 LEU HA 1 28 LEU MD2 1.800 . 5.000 3.900 3.457 3.993 . 0 0 "[ . 1 . 2]" 1
312 1 28 LEU HA 1 30 LYS H 1.800 . 5.000 4.029 3.912 4.112 . 0 0 "[ . 1 . 2]" 1
313 1 28 LEU HA 1 31 GLY H 1.800 . 5.000 3.663 3.435 4.038 . 0 0 "[ . 1 . 2]" 1
314 1 28 LEU HA 1 33 VAL HB 1.800 . 5.000 3.423 2.845 3.994 . 0 0 "[ . 1 . 2]" 1
315 1 28 LEU HA 1 33 VAL H 1.800 . 5.000 4.044 3.594 4.499 . 0 0 "[ . 1 . 2]" 1
316 1 28 LEU QB 1 28 LEU MD1 1.800 . 3.500 2.358 2.150 2.404 . 0 0 "[ . 1 . 2]" 1
317 1 28 LEU QB 1 28 LEU MD2 1.800 . 3.500 2.154 2.125 2.261 . 0 0 "[ . 1 . 2]" 1
318 1 28 LEU QB 1 31 GLY H 1.800 . 6.000 5.044 4.876 5.366 . 0 0 "[ . 1 . 2]" 1
319 1 28 LEU QB 1 81 LEU MD1 1.800 . 5.000 3.585 2.987 4.149 . 0 0 "[ . 1 . 2]" 1
320 1 28 LEU HB3 1 29 SER H 1.800 . 5.000 2.494 2.270 2.632 . 0 0 "[ . 1 . 2]" 1
321 1 28 LEU HB2 1 29 SER H 1.800 . 5.000 3.826 3.694 3.933 . 0 0 "[ . 1 . 2]" 1
322 1 28 LEU MD1 1 29 SER H 1.800 . 6.000 4.546 4.411 4.681 . 0 0 "[ . 1 . 2]" 1
323 1 28 LEU MD2 1 29 SER H 1.800 . 5.000 4.108 2.896 4.397 . 0 0 "[ . 1 . 2]" 1
324 1 28 LEU MD2 1 77 LEU QB 1.800 . 5.000 3.384 2.065 3.921 . 0 0 "[ . 1 . 2]" 1
325 1 28 LEU MD2 1 77 LEU HG 1.800 . 5.000 2.747 2.356 3.222 . 0 0 "[ . 1 . 2]" 1
326 1 28 LEU MD2 1 78 GLN H 1.800 . 6.000 4.355 3.776 4.853 . 0 0 "[ . 1 . 2]" 1
327 1 28 LEU HG 1 31 GLY H 1.800 . 6.000 5.070 4.838 5.237 . 0 0 "[ . 1 . 2]" 1
328 1 28 LEU H 1 28 LEU HB3 1.800 . 3.500 2.575 2.459 2.724 . 0 0 "[ . 1 . 2]" 1
329 1 28 LEU H 1 28 LEU HB2 1.800 . 3.500 2.464 2.413 2.540 . 0 0 "[ . 1 . 2]" 1
330 1 28 LEU H 1 28 LEU MD1 1.800 . 5.000 4.132 3.997 4.339 . 0 0 "[ . 1 . 2]" 1
331 1 28 LEU H 1 28 LEU MD2 1.800 . 5.000 4.315 4.226 4.410 . 0 0 "[ . 1 . 2]" 1
332 1 28 LEU H 1 29 SER H 1.800 . 5.000 2.856 2.777 2.920 . 0 0 "[ . 1 . 2]" 1
333 1 28 LEU H 1 30 LYS H 1.800 . 5.000 4.052 3.907 4.214 . 0 0 "[ . 1 . 2]" 1
334 1 28 LEU H 1 33 VAL MG2 1.800 . 5.000 3.258 2.959 3.605 . 0 0 "[ . 1 . 2]" 1
335 1 29 SER HA 1 81 LEU MD1 1.800 . 5.000 2.509 1.813 3.258 . 0 0 "[ . 1 . 2]" 1
336 1 29 SER HA 1 81 LEU MD2 1.800 . 5.000 3.825 2.425 4.861 . 0 0 "[ . 1 . 2]" 1
337 1 29 SER QB 1 81 LEU MD1 1.800 . 5.000 2.953 2.110 3.994 . 0 0 "[ . 1 . 2]" 1
338 1 29 SER QB 1 81 LEU MD2 1.800 . 5.000 3.254 2.360 4.286 . 0 0 "[ . 1 . 2]" 1
339 1 29 SER HB3 1 30 LYS H 1.800 . 5.000 3.934 2.981 4.395 . 0 0 "[ . 1 . 2]" 1
340 1 29 SER HB2 1 30 LYS H 1.800 . 5.000 3.825 3.123 4.279 . 0 0 "[ . 1 . 2]" 1
341 1 29 SER H 1 29 SER QB 1.800 . 3.500 2.422 2.205 2.558 . 0 0 "[ . 1 . 2]" 1
342 1 29 SER H 1 30 LYS H 1.800 . 5.000 2.729 2.600 2.844 . 0 0 "[ . 1 . 2]" 1
343 1 29 SER H 1 31 GLY H 1.800 . 5.000 4.139 3.984 4.436 . 0 0 "[ . 1 . 2]" 1
344 1 29 SER H 1 81 LEU MD1 1.800 . 6.000 3.736 3.213 4.460 . 0 0 "[ . 1 . 2]" 1
345 1 29 SER H 1 81 LEU MD2 1.800 . 6.000 5.194 4.473 6.084 0.084 20 0 "[ . 1 . 2]" 1
346 1 30 LYS HA 1 30 LYS QD 1.800 . 5.000 3.331 2.039 4.231 . 0 0 "[ . 1 . 2]" 1
347 1 30 LYS QB 1 30 LYS QE 1.800 . 5.000 3.555 1.970 3.937 . 0 0 "[ . 1 . 2]" 1
348 1 30 LYS QB 1 32 VAL MG1 1.800 . 5.000 2.105 1.866 2.403 . 0 0 "[ . 1 . 2]" 1
349 1 30 LYS HB3 1 31 GLY H 1.800 . 5.000 4.264 4.128 4.378 . 0 0 "[ . 1 . 2]" 1
350 1 30 LYS HB3 1 32 VAL MG2 1.800 . 5.000 3.863 3.113 4.605 . 0 0 "[ . 1 . 2]" 1
351 1 30 LYS HB3 1 32 VAL H 1.800 . 5.000 3.890 3.522 4.350 . 0 0 "[ . 1 . 2]" 1
352 1 30 LYS HB2 1 31 GLY H 1.800 . 5.000 3.575 3.340 3.760 . 0 0 "[ . 1 . 2]" 1
353 1 30 LYS HB2 1 32 VAL MG2 1.800 . 5.000 2.861 2.382 3.428 . 0 0 "[ . 1 . 2]" 1
354 1 30 LYS HB2 1 32 VAL H 1.800 . 5.000 3.125 2.738 3.437 . 0 0 "[ . 1 . 2]" 1
355 1 30 LYS QE 1 30 LYS QG 1.800 . 3.500 2.326 2.168 2.452 . 0 0 "[ . 1 . 2]" 1
356 1 30 LYS QG 1 31 GLY H 1.800 . 6.000 4.541 4.271 5.033 . 0 0 "[ . 1 . 2]" 1
357 1 30 LYS QG 1 32 VAL MG1 1.800 . 5.000 3.780 3.289 4.228 . 0 0 "[ . 1 . 2]" 1
358 1 30 LYS H 1 30 LYS QB 1.800 . 3.500 2.427 2.308 2.530 . 0 0 "[ . 1 . 2]" 1
359 1 30 LYS H 1 30 LYS QG 1.800 . 5.000 2.856 2.340 3.801 . 0 0 "[ . 1 . 2]" 1
360 1 30 LYS H 1 31 GLY H 1.800 . 3.500 2.340 2.200 2.443 . 0 0 "[ . 1 . 2]" 1
361 1 30 LYS H 1 32 VAL MG2 1.800 . 5.000 4.043 3.573 4.423 . 0 0 "[ . 1 . 2]" 1
362 1 30 LYS H 1 32 VAL H 1.800 . 5.000 3.750 3.636 3.907 . 0 0 "[ . 1 . 2]" 1
363 1 31 GLY H 1 32 VAL MG1 1.800 . 5.000 4.200 4.123 4.313 . 0 0 "[ . 1 . 2]" 1
364 1 31 GLY H 1 32 VAL MG2 1.800 . 5.000 4.255 3.980 4.600 . 0 0 "[ . 1 . 2]" 1
365 1 31 GLY H 1 32 VAL H 1.800 . 3.500 2.844 2.750 2.979 . 0 0 "[ . 1 . 2]" 1
366 1 31 GLY H 1 33 VAL MG2 1.800 . 5.000 4.383 4.225 4.625 . 0 0 "[ . 1 . 2]" 1
367 1 31 GLY H 1 33 VAL H 1.800 . 5.000 4.276 4.003 4.508 . 0 0 "[ . 1 . 2]" 1
368 1 32 VAL HA 1 32 VAL MG1 1.800 . 3.500 2.431 2.378 2.502 . 0 0 "[ . 1 . 2]" 1
369 1 32 VAL HA 1 49 THR MG 1.800 . 5.000 3.341 2.291 4.463 . 0 0 "[ . 1 . 2]" 1
370 1 32 VAL HA 1 49 THR H 1.800 . 5.000 3.901 3.540 4.528 . 0 0 "[ . 1 . 2]" 1
371 1 32 VAL HA 1 52 LYS QE 1.800 . 5.000 3.809 2.097 5.145 0.145 20 0 "[ . 1 . 2]" 1
372 1 32 VAL HB 1 33 VAL H 1.800 . 5.000 4.407 4.333 4.477 . 0 0 "[ . 1 . 2]" 1
373 1 32 VAL HB 1 48 PHE QD 1.800 . 5.000 3.073 2.536 4.380 . 0 0 "[ . 1 . 2]" 1
374 1 32 VAL HB 1 49 THR H 1.800 . 5.000 4.193 3.843 4.622 . 0 0 "[ . 1 . 2]" 1
375 1 32 VAL HB 1 52 LYS QB 1.800 . 5.000 2.889 1.936 4.314 . 0 0 "[ . 1 . 2]" 1
376 1 32 VAL MG1 1 52 LYS QD 1.800 . 5.000 2.652 1.844 4.996 . 0 0 "[ . 1 . 2]" 1
377 1 32 VAL MG1 1 52 LYS QE 1.800 . 5.000 3.342 1.894 5.107 0.107 12 0 "[ . 1 . 2]" 1
378 1 32 VAL MG1 1 52 LYS QG 1.800 . 5.000 3.290 1.922 4.329 . 0 0 "[ . 1 . 2]" 1
379 1 32 VAL MG2 1 33 VAL MG2 1.800 . 5.000 2.565 2.356 2.925 . 0 0 "[ . 1 . 2]" 1
380 1 32 VAL MG2 1 33 VAL H 1.800 . 5.000 3.174 3.022 3.343 . 0 0 "[ . 1 . 2]" 1
381 1 32 VAL MG2 1 48 PHE QD 1.800 . 5.000 2.492 1.961 3.192 . 0 0 "[ . 1 . 2]" 1
382 1 32 VAL MG2 1 48 PHE QE 1.800 . 5.000 2.755 2.064 3.950 . 0 0 "[ . 1 . 2]" 1
383 1 32 VAL MG2 1 48 PHE HZ 1.800 . 6.000 4.730 4.122 5.994 . 0 0 "[ . 1 . 2]" 1
384 1 32 VAL H 1 32 VAL MG1 1.800 . 3.500 2.403 2.250 2.700 . 0 0 "[ . 1 . 2]" 1
385 1 32 VAL H 1 32 VAL MG2 1.800 . 3.500 2.184 2.058 2.371 . 0 0 "[ . 1 . 2]" 1
386 1 32 VAL H 1 33 VAL HB 1.800 . 6.000 4.731 4.555 4.887 . 0 0 "[ . 1 . 2]" 1
387 1 32 VAL H 1 33 VAL MG2 1.800 . 5.000 3.214 3.025 3.463 . 0 0 "[ . 1 . 2]" 1
388 1 32 VAL H 1 33 VAL H 1.800 . 3.500 2.509 2.246 2.677 . 0 0 "[ . 1 . 2]" 1
389 1 33 VAL HA 1 33 VAL MG2 1.800 . 3.500 2.525 2.461 2.576 . 0 0 "[ . 1 . 2]" 1
390 1 33 VAL HA 1 34 ASP QB 1.800 . 6.000 4.043 3.941 4.139 . 0 0 "[ . 1 . 2]" 1
391 1 33 VAL HA 1 34 ASP H 1.800 . 3.500 2.178 2.133 2.223 . 0 0 "[ . 1 . 2]" 1
392 1 33 VAL HA 1 35 ARG H 1.800 . 5.000 4.043 3.790 4.204 . 0 0 "[ . 1 . 2]" 1
393 1 33 VAL HA 1 48 PHE HA 1.800 . 5.000 2.410 1.919 3.147 . 0 0 "[ . 1 . 2]" 1
394 1 33 VAL HA 1 48 PHE QB 1.800 . 6.000 4.356 3.742 5.166 . 0 0 "[ . 1 . 2]" 1
395 1 33 VAL HA 1 48 PHE QD 1.800 . 5.000 3.781 2.627 4.844 . 0 0 "[ . 1 . 2]" 1
396 1 33 VAL HA 1 49 THR H 1.800 . 3.500 3.415 3.063 3.583 0.083 15 0 "[ . 1 . 2]" 1
397 1 33 VAL HB 1 89 VAL MG1 1.800 . 5.000 3.046 2.617 3.983 . 0 0 "[ . 1 . 2]" 1
398 1 33 VAL HB 1 89 VAL MG2 1.800 . 5.000 2.622 1.844 4.537 . 0 0 "[ . 1 . 2]" 1
399 1 33 VAL MG1 1 34 ASP H 1.800 . 3.500 2.703 2.501 2.894 . 0 0 "[ . 1 . 2]" 1
400 1 33 VAL MG1 1 35 ARG H 1.800 . 3.500 2.565 2.335 2.736 . 0 0 "[ . 1 . 2]" 1
401 1 33 VAL MG1 1 46 VAL MG1 1.800 . 3.500 2.085 1.870 2.398 . 0 0 "[ . 1 . 2]" 1
402 1 33 VAL MG1 1 47 THR H 1.800 . 5.000 2.973 2.744 3.395 . 0 0 "[ . 1 . 2]" 1
403 1 33 VAL MG1 1 48 PHE HA 1.800 . 5.000 3.918 3.308 4.732 . 0 0 "[ . 1 . 2]" 1
404 1 33 VAL MG1 1 49 THR H 1.800 . 6.000 5.110 4.744 5.289 . 0 0 "[ . 1 . 2]" 1
405 1 33 VAL MG2 1 34 ASP H 1.800 . 5.000 4.178 4.091 4.250 . 0 0 "[ . 1 . 2]" 1
406 1 33 VAL MG2 1 46 VAL MG1 1.800 . 3.500 2.172 2.011 2.423 . 0 0 "[ . 1 . 2]" 1
407 1 33 VAL MG2 1 48 PHE QD 1.800 . 5.000 3.939 2.782 4.837 . 0 0 "[ . 1 . 2]" 1
408 1 33 VAL H 1 33 VAL HB 1.800 . 3.500 2.627 2.536 2.715 . 0 0 "[ . 1 . 2]" 1
409 1 33 VAL H 1 33 VAL MG1 1.800 . 5.000 3.868 3.823 3.910 . 0 0 "[ . 1 . 2]" 1
410 1 33 VAL H 1 33 VAL MG2 1.800 . 3.500 2.331 2.241 2.481 . 0 0 "[ . 1 . 2]" 1
411 1 33 VAL H 1 34 ASP H 1.800 . 5.000 4.449 4.386 4.486 . 0 0 "[ . 1 . 2]" 1
412 1 33 VAL H 1 46 VAL MG1 1.800 . 6.000 5.054 4.854 5.389 . 0 0 "[ . 1 . 2]" 1
413 1 33 VAL H 1 49 THR MG 1.800 . 5.000 4.001 3.344 5.188 0.188 6 0 "[ . 1 . 2]" 1
414 1 34 ASP QB 1 35 ARG QG 1.800 . 5.000 3.107 2.333 5.023 0.023 19 0 "[ . 1 . 2]" 1
415 1 34 ASP QB 1 49 THR MG 1.800 . 5.000 2.858 2.095 4.359 . 0 0 "[ . 1 . 2]" 1
416 1 34 ASP HB3 1 35 ARG H 1.800 . 5.000 2.410 2.230 2.519 . 0 0 "[ . 1 . 2]" 1
417 1 34 ASP HB3 1 47 THR HB 1.800 . 6.000 2.875 2.144 3.469 . 0 0 "[ . 1 . 2]" 1
418 1 34 ASP HB3 1 47 THR MG 1.800 . 5.000 2.400 1.921 2.948 . 0 0 "[ . 1 . 2]" 1
419 1 34 ASP HB3 1 48 PHE HA 1.800 . 6.000 4.216 3.636 5.070 . 0 0 "[ . 1 . 2]" 1
420 1 34 ASP HB3 1 49 THR HA 1.800 . 5.000 3.611 3.353 4.117 . 0 0 "[ . 1 . 2]" 1
421 1 34 ASP HB3 1 49 THR H 1.800 . 6.000 4.478 4.196 4.823 . 0 0 "[ . 1 . 2]" 1
422 1 34 ASP HB3 1 50 PRO QD 1.800 . 6.000 4.282 3.542 5.333 . 0 0 "[ . 1 . 2]" 1
423 1 34 ASP HB2 1 35 ARG H 1.800 . 5.000 3.762 3.590 3.881 . 0 0 "[ . 1 . 2]" 1
424 1 34 ASP HB2 1 47 THR HB 1.800 . 6.000 4.546 3.551 5.181 . 0 0 "[ . 1 . 2]" 1
425 1 34 ASP HB2 1 47 THR MG 1.800 . 5.000 3.414 2.879 4.077 . 0 0 "[ . 1 . 2]" 1
426 1 34 ASP HB2 1 48 PHE HA 1.800 . 6.000 4.060 3.650 4.395 . 0 0 "[ . 1 . 2]" 1
427 1 34 ASP HB2 1 49 THR HA 1.800 . 5.000 2.013 1.743 2.773 0.057 15 0 "[ . 1 . 2]" 1
428 1 34 ASP HB2 1 49 THR H 1.800 . 6.000 3.421 3.166 3.688 . 0 0 "[ . 1 . 2]" 1
429 1 34 ASP HB2 1 50 PRO QD 1.800 . 6.000 3.142 2.515 4.231 . 0 0 "[ . 1 . 2]" 1
430 1 34 ASP H 1 35 ARG H 1.800 . 3.500 2.339 2.273 2.407 . 0 0 "[ . 1 . 2]" 1
431 1 34 ASP H 1 46 VAL MG1 1.800 . 5.000 4.430 3.959 4.672 . 0 0 "[ . 1 . 2]" 1
432 1 34 ASP H 1 47 THR MG 1.800 . 5.000 3.774 3.238 4.264 . 0 0 "[ . 1 . 2]" 1
433 1 34 ASP H 1 47 THR H 1.800 . 6.000 4.340 3.857 4.597 . 0 0 "[ . 1 . 2]" 1
434 1 34 ASP H 1 48 PHE HA 1.800 . 5.000 2.789 2.247 3.642 . 0 0 "[ . 1 . 2]" 1
435 1 34 ASP H 1 49 THR MG 1.800 . 5.000 3.649 3.076 4.846 . 0 0 "[ . 1 . 2]" 1
436 1 34 ASP H 1 49 THR H 1.800 . 5.000 3.421 2.862 3.752 . 0 0 "[ . 1 . 2]" 1
437 1 35 ARG HA 1 36 LEU H 1.800 . 3.500 2.353 2.259 2.472 . 0 0 "[ . 1 . 2]" 1
438 1 35 ARG HA 1 47 THR HB 1.800 . 5.000 4.580 4.169 4.973 . 0 0 "[ . 1 . 2]" 1
439 1 35 ARG HA 1 89 VAL MG1 1.800 . 5.000 2.201 1.926 2.932 . 0 0 "[ . 1 . 2]" 1
440 1 35 ARG HA 1 89 VAL MG2 1.800 . 5.000 4.526 3.885 5.183 0.183 4 0 "[ . 1 . 2]" 1
441 1 35 ARG HA 1 90 PRO HD3 1.800 . 5.000 4.310 3.855 4.563 . 0 0 "[ . 1 . 2]" 1
442 1 35 ARG HA 1 90 PRO HD2 1.800 . 5.000 2.672 2.311 2.984 . 0 0 "[ . 1 . 2]" 1
443 1 35 ARG HA 1 90 PRO QG 1.800 . 5.000 3.410 2.359 4.511 . 0 0 "[ . 1 . 2]" 1
444 1 35 ARG QB 1 35 ARG QD 1.800 . 3.500 2.338 2.173 2.454 . 0 0 "[ . 1 . 2]" 1
445 1 35 ARG QB 1 35 ARG HE 1.800 . 5.000 2.750 2.054 4.074 . 0 0 "[ . 1 . 2]" 1
446 1 35 ARG QB 1 36 LEU H 1.800 . 3.500 2.634 2.270 3.524 0.024 6 0 "[ . 1 . 2]" 1
447 1 35 ARG QB 1 47 THR HB 1.800 . 5.000 3.802 2.253 4.257 . 0 0 "[ . 1 . 2]" 1
448 1 35 ARG QB 1 90 PRO HD3 1.800 . 5.000 4.656 3.726 5.045 0.045 12 0 "[ . 1 . 2]" 1
449 1 35 ARG QB 1 90 PRO HD2 1.800 . 5.000 3.330 2.157 3.887 . 0 0 "[ . 1 . 2]" 1
450 1 35 ARG QB 1 90 PRO QG 1.800 . 5.000 2.800 1.791 4.133 0.009 1 0 "[ . 1 . 2]" 1
451 1 35 ARG QB 1 92 VAL MG2 1.800 . 5.000 2.645 2.104 4.180 . 0 0 "[ . 1 . 2]" 1
452 1 35 ARG QD 1 37 GLU QG 1.800 . 5.000 2.926 2.426 4.037 . 0 0 "[ . 1 . 2]" 1
453 1 35 ARG QD 1 92 VAL MG2 1.800 . 5.000 2.182 1.758 3.943 0.042 20 0 "[ . 1 . 2]" 1
454 1 35 ARG HD3 1 92 VAL MG1 1.800 . 6.000 4.425 3.579 5.814 . 0 0 "[ . 1 . 2]" 1
455 1 35 ARG HD2 1 92 VAL MG1 1.800 . 6.000 4.434 3.309 5.727 . 0 0 "[ . 1 . 2]" 1
456 1 35 ARG HE 1 92 VAL MG2 1.800 . 6.000 3.845 2.172 4.413 . 0 0 "[ . 1 . 2]" 1
457 1 35 ARG QG 1 36 LEU H 1.800 . 5.000 3.438 2.181 3.995 . 0 0 "[ . 1 . 2]" 1
458 1 35 ARG QG 1 37 GLU QG 1.800 . 5.000 2.330 1.917 4.129 . 0 0 "[ . 1 . 2]" 1
459 1 35 ARG QG 1 47 THR HB 1.800 . 5.000 2.307 1.820 3.994 . 0 0 "[ . 1 . 2]" 1
460 1 35 ARG QG 1 90 PRO QG 1.800 . 6.000 4.601 2.161 6.039 0.039 12 0 "[ . 1 . 2]" 1
461 1 35 ARG H 1 35 ARG QG 1.800 . 5.000 2.810 2.358 4.181 . 0 0 "[ . 1 . 2]" 1
462 1 35 ARG H 1 36 LEU H 1.800 . 5.000 4.346 4.303 4.393 . 0 0 "[ . 1 . 2]" 1
463 1 35 ARG H 1 46 VAL MG1 1.800 . 6.000 4.829 4.144 5.106 . 0 0 "[ . 1 . 2]" 1
464 1 35 ARG H 1 47 THR HB 1.800 . 5.000 2.418 2.040 3.038 . 0 0 "[ . 1 . 2]" 1
465 1 35 ARG H 1 47 THR MG 1.800 . 5.000 3.565 3.204 3.985 . 0 0 "[ . 1 . 2]" 1
466 1 35 ARG H 1 47 THR H 1.800 . 5.000 3.435 3.230 3.576 . 0 0 "[ . 1 . 2]" 1
467 1 35 ARG H 1 48 PHE HA 1.800 . 6.000 4.779 4.271 5.606 . 0 0 "[ . 1 . 2]" 1
468 1 35 ARG H 1 89 VAL MG1 1.800 . 5.000 3.425 3.082 4.712 . 0 0 "[ . 1 . 2]" 1
469 1 36 LEU HA 1 36 LEU MD1 1.800 . 5.000 3.895 3.850 3.940 . 0 0 "[ . 1 . 2]" 1
470 1 36 LEU HA 1 36 LEU MD2 1.800 . 3.500 1.972 1.910 2.059 . 0 0 "[ . 1 . 2]" 1
471 1 36 LEU HA 1 37 GLU H 1.800 . 3.500 2.150 2.101 2.216 . 0 0 "[ . 1 . 2]" 1
472 1 36 LEU HA 1 44 VAL MG1 1.800 . 5.000 3.030 2.820 3.257 . 0 0 "[ . 1 . 2]" 1
473 1 36 LEU HA 1 46 VAL HA 1.800 . 5.000 3.151 2.770 3.347 . 0 0 "[ . 1 . 2]" 1
474 1 36 LEU HA 1 47 THR H 1.800 . 5.000 3.334 3.088 3.622 . 0 0 "[ . 1 . 2]" 1
475 1 36 LEU QB 1 44 VAL MG1 1.800 . 3.500 2.004 1.901 2.183 . 0 0 "[ . 1 . 2]" 1
476 1 36 LEU QB 1 74 LEU MD2 1.800 . 5.000 3.494 2.953 3.942 . 0 0 "[ . 1 . 2]" 1
477 1 36 LEU QB 1 89 VAL MG1 1.800 . 5.000 3.172 2.826 3.397 . 0 0 "[ . 1 . 2]" 1
478 1 36 LEU QB 1 91 VAL HA 1.800 . 5.000 2.667 2.487 2.954 . 0 0 "[ . 1 . 2]" 1
479 1 36 LEU QB 1 91 VAL MG2 1.800 . 5.000 2.529 2.045 2.895 . 0 0 "[ . 1 . 2]" 1
480 1 36 LEU MD1 1 44 VAL MG1 1.800 . 5.000 2.703 2.322 3.076 . 0 0 "[ . 1 . 2]" 1
481 1 36 LEU MD1 1 62 PHE HZ 1.800 . 5.000 3.124 1.964 3.777 . 0 0 "[ . 1 . 2]" 1
482 1 36 LEU MD1 1 70 PHE QE 1.800 . 5.000 2.452 2.004 2.974 . 0 0 "[ . 1 . 2]" 1
483 1 36 LEU MD1 1 70 PHE HZ 1.800 . 5.000 1.993 1.861 2.237 . 0 0 "[ . 1 . 2]" 1
484 1 36 LEU MD1 1 74 LEU MD1 1.800 . 5.000 2.297 2.195 2.652 . 0 0 "[ . 1 . 2]" 1
485 1 36 LEU MD1 1 74 LEU MD2 1.800 . 3.500 2.181 1.936 2.627 . 0 0 "[ . 1 . 2]" 1
486 1 36 LEU MD1 1 89 VAL MG1 1.800 . 3.500 2.739 2.350 2.962 . 0 0 "[ . 1 . 2]" 1
487 1 36 LEU MD2 1 37 GLU H 1.800 . 5.000 3.656 3.500 3.845 . 0 0 "[ . 1 . 2]" 1
488 1 36 LEU MD2 1 44 VAL MG1 1.800 . 3.500 2.185 1.961 2.610 . 0 0 "[ . 1 . 2]" 1
489 1 36 LEU MD2 1 46 VAL HA 1.800 . 3.500 2.104 1.882 2.538 . 0 0 "[ . 1 . 2]" 1
490 1 36 LEU MD2 1 46 VAL MG1 1.800 . 5.000 2.644 2.285 2.990 . 0 0 "[ . 1 . 2]" 1
491 1 36 LEU MD2 1 46 VAL MG2 1.800 . 3.500 2.352 1.967 2.721 . 0 0 "[ . 1 . 2]" 1
492 1 36 LEU MD2 1 47 THR H 1.800 . 5.000 3.095 2.793 3.458 . 0 0 "[ . 1 . 2]" 1
493 1 36 LEU MD2 1 62 PHE QD 1.800 . 6.000 4.698 4.195 5.212 . 0 0 "[ . 1 . 2]" 1
494 1 36 LEU MD2 1 62 PHE QE 1.800 . 5.000 2.912 2.387 3.488 . 0 0 "[ . 1 . 2]" 1
495 1 36 LEU MD2 1 62 PHE HZ 1.800 . 5.000 3.291 2.708 3.850 . 0 0 "[ . 1 . 2]" 1
496 1 36 LEU MD2 1 70 PHE QE 1.800 . 6.000 3.817 3.426 4.290 . 0 0 "[ . 1 . 2]" 1
497 1 36 LEU MD2 1 70 PHE HZ 1.800 . 5.000 3.691 3.448 4.011 . 0 0 "[ . 1 . 2]" 1
498 1 36 LEU HG 1 44 VAL MG1 1.800 . 5.000 4.126 3.959 4.458 . 0 0 "[ . 1 . 2]" 1
499 1 36 LEU HG 1 89 VAL MG1 1.800 . 3.500 1.952 1.754 2.237 0.046 8 0 "[ . 1 . 2]" 1
500 1 36 LEU HG 1 89 VAL MG2 1.800 . 5.000 4.064 3.670 4.490 . 0 0 "[ . 1 . 2]" 1
501 1 36 LEU H 1 36 LEU QB 1.800 . 3.500 2.463 2.358 2.510 . 0 0 "[ . 1 . 2]" 1
502 1 36 LEU H 1 36 LEU MD1 1.800 . 5.000 4.077 3.943 4.210 . 0 0 "[ . 1 . 2]" 1
503 1 36 LEU H 1 36 LEU HG 1.800 . 5.000 3.097 2.884 3.289 . 0 0 "[ . 1 . 2]" 1
504 1 36 LEU H 1 47 THR HB 1.800 . 6.000 5.176 4.876 5.528 . 0 0 "[ . 1 . 2]" 1
505 1 36 LEU H 1 89 VAL MG1 1.800 . 5.000 2.810 2.585 3.233 . 0 0 "[ . 1 . 2]" 1
506 1 36 LEU H 1 90 PRO HD3 1.800 . 6.000 5.897 5.645 6.065 0.065 11 0 "[ . 1 . 2]" 1
507 1 36 LEU H 1 90 PRO HD2 1.800 . 6.000 4.516 4.226 4.831 . 0 0 "[ . 1 . 2]" 1
508 1 36 LEU H 1 91 VAL HA 1.800 . 5.000 2.908 2.587 3.287 . 0 0 "[ . 1 . 2]" 1
509 1 36 LEU H 1 91 VAL MG1 1.800 . 6.000 4.562 4.175 4.944 . 0 0 "[ . 1 . 2]" 1
510 1 36 LEU H 1 92 VAL MG2 1.800 . 5.000 3.649 2.992 4.259 . 0 0 "[ . 1 . 2]" 1
511 1 36 LEU H 1 92 VAL H 1.800 . 5.000 3.716 3.346 4.307 . 0 0 "[ . 1 . 2]" 1
512 1 37 GLU HA 1 38 VAL MG2 1.800 . 5.000 3.621 3.335 3.733 . 0 0 "[ . 1 . 2]" 1
513 1 37 GLU HA 1 38 VAL H 1.800 . 3.500 2.174 2.145 2.224 . 0 0 "[ . 1 . 2]" 1
514 1 37 GLU HA 1 91 VAL MG1 1.800 . 5.000 4.431 4.010 5.038 0.038 18 0 "[ . 1 . 2]" 1
515 1 37 GLU HA 1 92 VAL HB 1.800 . 5.000 2.473 1.923 3.018 . 0 0 "[ . 1 . 2]" 1
516 1 37 GLU HA 1 92 VAL MG1 1.800 . 5.000 3.847 3.101 4.304 . 0 0 "[ . 1 . 2]" 1
517 1 37 GLU HA 1 92 VAL MG2 1.800 . 5.000 3.735 3.377 4.110 . 0 0 "[ . 1 . 2]" 1
518 1 37 GLU HA 1 92 VAL H 1.800 . 5.000 2.817 2.452 3.319 . 0 0 "[ . 1 . 2]" 1
519 1 37 GLU HA 1 94 ILE QG 1.800 . 6.000 3.652 3.079 4.962 . 0 0 "[ . 1 . 2]" 1
520 1 37 GLU QB 1 39 VAL MG2 1.800 . 5.000 2.807 2.393 3.302 . 0 0 "[ . 1 . 2]" 1
521 1 37 GLU QB 1 44 VAL MG1 1.800 . 6.000 4.427 4.088 4.884 . 0 0 "[ . 1 . 2]" 1
522 1 37 GLU QB 1 45 ARG H 1.800 . 5.000 3.277 2.814 3.708 . 0 0 "[ . 1 . 2]" 1
523 1 37 GLU QB 1 92 VAL HB 1.800 . 5.000 3.575 3.008 3.953 . 0 0 "[ . 1 . 2]" 1
524 1 37 GLU QB 1 92 VAL MG1 1.800 . 5.000 4.077 3.429 4.598 . 0 0 "[ . 1 . 2]" 1
525 1 37 GLU QB 1 92 VAL MG2 1.800 . 6.000 4.566 4.141 4.990 . 0 0 "[ . 1 . 2]" 1
526 1 37 GLU QB 1 92 VAL H 1.800 . 6.000 4.818 4.443 5.336 . 0 0 "[ . 1 . 2]" 1
527 1 37 GLU QB 1 94 ILE MD 1.800 . 5.000 2.629 1.901 4.262 . 0 0 "[ . 1 . 2]" 1
528 1 37 GLU QB 1 94 ILE QG 1.800 . 5.000 2.946 1.978 3.898 . 0 0 "[ . 1 . 2]" 1
529 1 37 GLU HB3 1 38 VAL H 1.800 . 5.000 3.723 3.586 3.841 . 0 0 "[ . 1 . 2]" 1
530 1 37 GLU HB2 1 38 VAL H 1.800 . 5.000 4.420 4.322 4.493 . 0 0 "[ . 1 . 2]" 1
531 1 37 GLU QG 1 92 VAL MG1 1.800 . 5.000 3.233 2.281 3.833 . 0 0 "[ . 1 . 2]" 1
532 1 37 GLU QG 1 92 VAL MG2 1.800 . 3.500 2.993 2.561 3.430 . 0 0 "[ . 1 . 2]" 1
533 1 37 GLU QG 1 92 VAL H 1.800 . 6.000 3.982 3.466 4.771 . 0 0 "[ . 1 . 2]" 1
534 1 37 GLU QG 1 94 ILE MD 1.800 . 5.000 3.132 2.268 3.967 . 0 0 "[ . 1 . 2]" 1
535 1 37 GLU H 1 37 GLU QG 1.800 . 5.000 2.576 2.240 3.554 . 0 0 "[ . 1 . 2]" 1
536 1 37 GLU H 1 38 VAL H 1.800 . 5.000 4.312 4.224 4.375 . 0 0 "[ . 1 . 2]" 1
537 1 37 GLU H 1 44 VAL HA 1.800 . 5.000 4.630 4.050 5.052 0.052 16 0 "[ . 1 . 2]" 1
538 1 37 GLU H 1 44 VAL MG1 1.800 . 5.000 3.218 2.622 3.799 . 0 0 "[ . 1 . 2]" 1
539 1 37 GLU H 1 45 ARG H 1.800 . 5.000 3.137 2.627 3.662 . 0 0 "[ . 1 . 2]" 1
540 1 37 GLU H 1 46 VAL HA 1.800 . 5.000 4.162 3.443 4.539 . 0 0 "[ . 1 . 2]" 1
541 1 37 GLU H 1 92 VAL HB 1.800 . 6.000 4.824 4.098 5.496 . 0 0 "[ . 1 . 2]" 1
542 1 38 VAL HA 1 39 VAL MG2 1.800 . 5.000 3.719 3.581 3.853 . 0 0 "[ . 1 . 2]" 1
543 1 38 VAL HA 1 39 VAL H 1.800 . 3.500 2.225 2.189 2.300 . 0 0 "[ . 1 . 2]" 1
544 1 38 VAL HA 1 43 PHE H 1.800 . 5.000 4.536 4.160 4.793 . 0 0 "[ . 1 . 2]" 1
545 1 38 VAL HA 1 44 VAL HA 1.800 . 5.000 2.093 1.833 2.333 . 0 0 "[ . 1 . 2]" 1
546 1 38 VAL HA 1 44 VAL MG1 1.800 . 5.000 3.236 2.806 3.851 . 0 0 "[ . 1 . 2]" 1
547 1 38 VAL HA 1 44 VAL MG2 1.800 . 5.000 2.680 2.244 3.318 . 0 0 "[ . 1 . 2]" 1
548 1 38 VAL HA 1 45 ARG H 1.800 . 5.000 3.454 2.972 3.858 . 0 0 "[ . 1 . 2]" 1
549 1 38 VAL HB 1 39 VAL H 1.800 . 5.000 4.444 4.386 4.491 . 0 0 "[ . 1 . 2]" 1
550 1 38 VAL HB 1 41 LYS H 1.800 . 5.000 4.375 3.841 4.794 . 0 0 "[ . 1 . 2]" 1
551 1 38 VAL HB 1 93 TYR HA 1.800 . 5.000 2.388 1.974 2.636 . 0 0 "[ . 1 . 2]" 1
552 1 38 VAL HB 1 93 TYR QD 1.800 . 5.000 2.708 2.154 3.424 . 0 0 "[ . 1 . 2]" 1
553 1 38 VAL HB 1 93 TYR QE 1.800 . 5.000 3.855 3.176 4.823 . 0 0 "[ . 1 . 2]" 1
554 1 38 VAL HB 1 94 ILE H 1.800 . 5.000 3.578 2.871 4.118 . 0 0 "[ . 1 . 2]" 1
555 1 38 VAL MG1 1 39 VAL H 1.800 . 5.000 3.418 3.270 3.546 . 0 0 "[ . 1 . 2]" 1
556 1 38 VAL MG1 1 41 LYS HA 1.800 . 3.500 1.939 1.656 2.353 0.144 7 0 "[ . 1 . 2]" 1
557 1 38 VAL MG1 1 41 LYS H 1.800 . 5.000 2.720 2.403 3.058 . 0 0 "[ . 1 . 2]" 1
558 1 38 VAL MG1 1 42 ARG H 1.800 . 5.000 3.875 3.486 4.222 . 0 0 "[ . 1 . 2]" 1
559 1 38 VAL MG1 1 43 PHE H 1.800 . 5.000 3.652 3.231 3.902 . 0 0 "[ . 1 . 2]" 1
560 1 38 VAL MG1 1 44 VAL MG2 1.800 . 5.000 2.247 1.836 2.711 . 0 0 "[ . 1 . 2]" 1
561 1 38 VAL MG1 1 64 ILE MD 1.800 . 3.500 2.110 1.832 2.457 . 0 0 "[ . 1 . 2]" 1
562 1 38 VAL MG1 1 67 VAL MG1 1.800 . 5.000 2.568 1.965 3.491 . 0 0 "[ . 1 . 2]" 1
563 1 38 VAL MG1 1 67 VAL MG2 1.800 . 5.000 2.788 2.030 3.525 . 0 0 "[ . 1 . 2]" 1
564 1 38 VAL MG1 1 93 TYR HA 1.800 . 5.000 3.882 3.545 4.092 . 0 0 "[ . 1 . 2]" 1
565 1 38 VAL MG1 1 93 TYR QD 1.800 . 5.000 2.962 2.503 3.706 . 0 0 "[ . 1 . 2]" 1
566 1 38 VAL MG1 1 93 TYR QE 1.800 . 5.000 3.086 2.164 4.706 . 0 0 "[ . 1 . 2]" 1
567 1 38 VAL MG2 1 44 VAL HA 1.800 . 5.000 3.329 2.739 3.732 . 0 0 "[ . 1 . 2]" 1
568 1 38 VAL MG2 1 44 VAL MG2 1.800 . 3.500 1.823 1.738 1.952 0.062 20 0 "[ . 1 . 2]" 1
569 1 38 VAL MG2 1 70 PHE QD 1.800 . 5.000 3.212 2.804 3.662 . 0 0 "[ . 1 . 2]" 1
570 1 38 VAL MG2 1 70 PHE QE 1.800 . 5.000 2.447 2.244 2.628 . 0 0 "[ . 1 . 2]" 1
571 1 38 VAL MG2 1 70 PHE HZ 1.800 . 5.000 3.491 2.875 3.875 . 0 0 "[ . 1 . 2]" 1
572 1 38 VAL MG2 1 91 VAL HB 1.800 . 6.000 4.490 4.398 4.737 . 0 0 "[ . 1 . 2]" 1
573 1 38 VAL MG2 1 91 VAL MG1 1.800 . 3.500 2.049 1.935 2.241 . 0 0 "[ . 1 . 2]" 1
574 1 38 VAL MG2 1 92 VAL HB 1.800 . 6.000 5.066 4.451 5.554 . 0 0 "[ . 1 . 2]" 1
575 1 38 VAL MG2 1 92 VAL H 1.800 . 5.000 3.476 2.895 3.703 . 0 0 "[ . 1 . 2]" 1
576 1 38 VAL MG2 1 93 TYR HA 1.800 . 5.000 3.545 3.067 3.885 . 0 0 "[ . 1 . 2]" 1
577 1 38 VAL MG2 1 93 TYR QE 1.800 . 5.000 3.076 2.591 3.852 . 0 0 "[ . 1 . 2]" 1
578 1 38 VAL H 1 38 VAL HB 1.800 . 3.500 2.620 2.545 2.707 . 0 0 "[ . 1 . 2]" 1
579 1 38 VAL H 1 38 VAL MG1 1.800 . 5.000 3.851 3.809 3.887 . 0 0 "[ . 1 . 2]" 1
580 1 38 VAL H 1 38 VAL MG2 1.800 . 3.500 2.277 2.158 2.405 . 0 0 "[ . 1 . 2]" 1
581 1 38 VAL H 1 39 VAL MG2 1.800 . 6.000 4.288 3.947 4.633 . 0 0 "[ . 1 . 2]" 1
582 1 38 VAL H 1 39 VAL H 1.800 . 5.000 4.149 3.999 4.311 . 0 0 "[ . 1 . 2]" 1
583 1 38 VAL H 1 44 VAL MG1 1.800 . 6.000 4.074 3.603 4.547 . 0 0 "[ . 1 . 2]" 1
584 1 38 VAL H 1 91 VAL MG1 1.800 . 5.000 3.763 3.463 4.247 . 0 0 "[ . 1 . 2]" 1
585 1 38 VAL H 1 92 VAL HB 1.800 . 5.000 3.937 3.398 4.394 . 0 0 "[ . 1 . 2]" 1
586 1 38 VAL H 1 92 VAL MG2 1.800 . 5.000 5.001 4.642 5.207 0.207 6 0 "[ . 1 . 2]" 1
587 1 38 VAL H 1 92 VAL H 1.800 . 5.000 3.464 3.055 3.751 . 0 0 "[ . 1 . 2]" 1
588 1 38 VAL H 1 93 TYR QD 1.800 . 5.000 4.720 4.362 5.111 0.111 8 0 "[ . 1 . 2]" 1
589 1 38 VAL H 1 94 ILE H 1.800 . 5.000 3.432 2.964 3.802 . 0 0 "[ . 1 . 2]" 1
590 1 39 VAL HA 1 39 VAL MG1 1.800 . 3.500 2.453 2.362 2.490 . 0 0 "[ . 1 . 2]" 1
591 1 39 VAL HA 1 40 ASN H 1.800 . 3.500 2.103 2.045 2.151 . 0 0 "[ . 1 . 2]" 1
592 1 39 VAL HA 1 41 LYS H 1.800 . 5.000 3.755 3.556 4.080 . 0 0 "[ . 1 . 2]" 1
593 1 39 VAL HA 1 94 ILE HB 1.800 . 5.000 2.407 1.664 3.141 0.136 20 0 "[ . 1 . 2]" 1
594 1 39 VAL HA 1 94 ILE QG 1.800 . 5.000 4.198 3.129 5.161 0.161 4 0 "[ . 1 . 2]" 1
595 1 39 VAL HA 1 94 ILE MG 1.800 . 5.000 3.432 2.442 4.207 . 0 0 "[ . 1 . 2]" 1
596 1 39 VAL HA 1 94 ILE H 1.800 . 5.000 3.261 2.563 3.790 . 0 0 "[ . 1 . 2]" 1
597 1 39 VAL HB 1 43 PHE QE 1.800 . 6.000 3.081 2.938 3.302 . 0 0 "[ . 1 . 2]" 1
598 1 39 VAL HB 1 43 PHE HZ 1.800 . 6.000 3.096 2.752 3.319 . 0 0 "[ . 1 . 2]" 1
599 1 39 VAL MG1 1 40 ASN HA 1.800 . 5.000 4.189 3.734 4.485 . 0 0 "[ . 1 . 2]" 1
600 1 39 VAL MG1 1 40 ASN QB 1.800 . 5.000 2.921 2.266 3.209 . 0 0 "[ . 1 . 2]" 1
601 1 39 VAL MG1 1 40 ASN QD 1.800 . 5.000 3.518 1.920 4.182 . 0 0 "[ . 1 . 2]" 1
602 1 39 VAL MG1 1 40 ASN HD21 1.800 . 5.000 4.006 1.938 4.876 . 0 0 "[ . 1 . 2]" 1
603 1 39 VAL MG1 1 40 ASN HD22 1.800 . 5.000 4.047 2.857 5.303 0.303 15 0 "[ . 1 . 2]" 1
604 1 39 VAL MG1 1 40 ASN H 1.800 . 5.000 2.903 2.651 3.113 . 0 0 "[ . 1 . 2]" 1
605 1 39 VAL MG1 1 42 ARG QB 1.800 . 6.000 4.442 3.756 5.267 . 0 0 "[ . 1 . 2]" 1
606 1 39 VAL MG1 1 43 PHE QD 1.800 . 5.000 4.337 4.031 4.772 . 0 0 "[ . 1 . 2]" 1
607 1 39 VAL MG1 1 43 PHE QE 1.800 . 5.000 3.080 2.789 3.586 . 0 0 "[ . 1 . 2]" 1
608 1 39 VAL MG1 1 43 PHE H 1.800 . 6.000 4.881 4.542 5.253 . 0 0 "[ . 1 . 2]" 1
609 1 39 VAL MG1 1 43 PHE HZ 1.800 . 5.000 2.756 2.492 3.365 . 0 0 "[ . 1 . 2]" 1
610 1 39 VAL MG1 1 94 ILE HB 1.800 . 5.000 3.372 2.772 4.175 . 0 0 "[ . 1 . 2]" 1
611 1 39 VAL MG1 1 94 ILE QG 1.800 . 6.000 4.775 3.601 5.744 . 0 0 "[ . 1 . 2]" 1
612 1 39 VAL MG1 1 94 ILE MG 1.800 . 5.000 2.946 2.217 3.939 . 0 0 "[ . 1 . 2]" 1
613 1 39 VAL MG1 1 95 ALA HA 1.800 . 6.000 4.456 3.568 5.457 . 0 0 "[ . 1 . 2]" 1
614 1 39 VAL MG1 1 96 GLU QB 1.800 . 5.000 3.450 1.990 5.061 0.061 7 0 "[ . 1 . 2]" 1
615 1 39 VAL MG1 1 96 GLU QG 1.800 . 5.000 3.568 1.962 5.184 0.184 1 0 "[ . 1 . 2]" 1
616 1 39 VAL MG1 1 96 GLU H 1.800 . 5.000 3.731 2.247 4.994 . 0 0 "[ . 1 . 2]" 1
617 1 39 VAL MG2 1 40 ASN H 1.800 . 5.000 4.139 4.014 4.234 . 0 0 "[ . 1 . 2]" 1
618 1 39 VAL MG2 1 43 PHE QE 1.800 . 5.000 3.083 2.798 3.464 . 0 0 "[ . 1 . 2]" 1
619 1 39 VAL MG2 1 43 PHE H 1.800 . 6.000 5.071 4.768 5.384 . 0 0 "[ . 1 . 2]" 1
620 1 39 VAL MG2 1 43 PHE HZ 1.800 . 5.000 3.323 2.788 3.943 . 0 0 "[ . 1 . 2]" 1
621 1 39 VAL MG2 1 45 ARG H 1.800 . 5.000 3.409 2.850 4.096 . 0 0 "[ . 1 . 2]" 1
622 1 39 VAL MG2 1 94 ILE HB 1.800 . 5.000 2.676 1.887 3.583 . 0 0 "[ . 1 . 2]" 1
623 1 39 VAL MG2 1 94 ILE MD 1.800 . 5.000 3.211 2.029 4.959 . 0 0 "[ . 1 . 2]" 1
624 1 39 VAL MG2 1 94 ILE QG 1.800 . 5.000 3.586 2.284 4.502 . 0 0 "[ . 1 . 2]" 1
625 1 39 VAL MG2 1 94 ILE MG 1.800 . 5.000 3.132 2.324 4.330 . 0 0 "[ . 1 . 2]" 1
626 1 39 VAL MG2 1 94 ILE H 1.800 . 5.000 4.262 3.492 4.992 . 0 0 "[ . 1 . 2]" 1
627 1 39 VAL H 1 39 VAL MG1 1.800 . 5.000 3.823 3.764 3.866 . 0 0 "[ . 1 . 2]" 1
628 1 39 VAL H 1 39 VAL MG2 1.800 . 3.500 2.271 2.105 2.425 . 0 0 "[ . 1 . 2]" 1
629 1 39 VAL H 1 42 ARG H 1.800 . 5.000 4.705 4.479 5.006 0.006 17 0 "[ . 1 . 2]" 1
630 1 39 VAL H 1 43 PHE H 1.800 . 5.000 3.666 3.353 3.947 . 0 0 "[ . 1 . 2]" 1
631 1 39 VAL H 1 44 VAL HA 1.800 . 5.000 3.047 2.654 3.700 . 0 0 "[ . 1 . 2]" 1
632 1 39 VAL H 1 44 VAL MG2 1.800 . 5.000 4.303 3.865 4.982 . 0 0 "[ . 1 . 2]" 1
633 1 39 VAL H 1 45 ARG H 1.800 . 5.000 3.785 3.413 4.271 . 0 0 "[ . 1 . 2]" 1
634 1 40 ASN HA 1 42 ARG H 1.800 . 6.000 4.258 4.162 4.429 . 0 0 "[ . 1 . 2]" 1
635 1 40 ASN HA 1 95 ALA HA 1.800 . 5.000 2.846 1.757 5.113 0.113 7 0 "[ . 1 . 2]" 1
636 1 40 ASN QB 1 42 ARG QB 1.800 . 5.000 3.055 2.218 4.191 . 0 0 "[ . 1 . 2]" 1
637 1 40 ASN QB 1 42 ARG H 1.800 . 5.000 3.135 2.725 4.216 . 0 0 "[ . 1 . 2]" 1
638 1 40 ASN HB3 1 41 LYS H 1.800 . 6.000 4.422 4.045 4.593 . 0 0 "[ . 1 . 2]" 1
639 1 40 ASN HB2 1 41 LYS H 1.800 . 6.000 4.225 4.049 4.587 . 0 0 "[ . 1 . 2]" 1
640 1 40 ASN QD 1 96 GLU QB 1.800 . 5.000 2.915 1.873 4.308 . 0 0 "[ . 1 . 2]" 1
641 1 40 ASN QD 1 96 GLU H 1.800 . 3.500 3.300 2.234 3.716 0.216 17 0 "[ . 1 . 2]" 1
642 1 40 ASN QD 1 97 SER H 1.800 . 5.000 4.117 1.966 5.071 0.071 1 0 "[ . 1 . 2]" 1
643 1 40 ASN H 1 41 LYS QG 1.800 . 5.000 4.679 4.389 5.173 0.173 3 0 "[ . 1 . 2]" 1
644 1 40 ASN H 1 41 LYS H 1.800 . 5.000 2.827 2.700 3.055 . 0 0 "[ . 1 . 2]" 1
645 1 40 ASN H 1 94 ILE HB 1.800 . 5.000 3.668 2.401 4.400 . 0 0 "[ . 1 . 2]" 1
646 1 40 ASN H 1 94 ILE MG 1.800 . 6.000 3.779 2.350 4.616 . 0 0 "[ . 1 . 2]" 1
647 1 40 ASN H 1 95 ALA HA 1.800 . 5.000 3.012 2.278 4.862 . 0 0 "[ . 1 . 2]" 1
648 1 40 ASN H 1 95 ALA MB 1.800 . 5.000 4.114 2.305 4.975 . 0 0 "[ . 1 . 2]" 1
649 1 40 ASN H 1 96 GLU H 1.800 . 5.000 3.573 2.909 4.293 . 0 0 "[ . 1 . 2]" 1
650 1 41 LYS HA 1 41 LYS QD 1.800 . 5.000 4.057 3.003 4.374 . 0 0 "[ . 1 . 2]" 1
651 1 41 LYS HA 1 41 LYS QG 1.800 . 3.500 2.517 2.354 3.397 . 0 0 "[ . 1 . 2]" 1
652 1 41 LYS HA 1 64 ILE MD 1.800 . 6.000 3.176 2.788 3.808 . 0 0 "[ . 1 . 2]" 1
653 1 41 LYS HA 1 67 VAL MG1 1.800 . 5.000 4.060 3.343 4.504 . 0 0 "[ . 1 . 2]" 1
654 1 41 LYS HA 1 67 VAL MG2 1.800 . 5.000 2.837 2.138 3.484 . 0 0 "[ . 1 . 2]" 1
655 1 41 LYS QB 1 41 LYS QD 1.800 . 3.500 2.262 2.145 2.438 . 0 0 "[ . 1 . 2]" 1
656 1 41 LYS QB 1 41 LYS QE 1.800 . 5.000 3.201 2.054 3.934 . 0 0 "[ . 1 . 2]" 1
657 1 41 LYS QB 1 67 VAL MG1 1.800 . 6.000 3.923 2.883 4.627 . 0 0 "[ . 1 . 2]" 1
658 1 41 LYS QB 1 67 VAL MG2 1.800 . 3.500 2.052 1.786 2.459 0.014 10 0 "[ . 1 . 2]" 1
659 1 41 LYS QD 1 67 VAL MG2 1.800 . 5.000 2.824 2.203 4.140 . 0 0 "[ . 1 . 2]" 1
660 1 41 LYS QE 1 67 VAL MG2 1.800 . 5.000 3.814 2.015 4.647 . 0 0 "[ . 1 . 2]" 1
661 1 41 LYS QG 1 42 ARG H 1.800 . 5.000 4.508 3.891 4.964 . 0 0 "[ . 1 . 2]" 1
662 1 41 LYS QE 1 41 LYS HG3 1.800 . 5.000 2.698 2.395 3.490 . 0 0 "[ . 1 . 2]" 1
663 1 41 LYS QE 1 41 LYS HG2 1.800 . 5.000 2.880 2.384 3.556 . 0 0 "[ . 1 . 2]" 1
664 1 41 LYS H 1 41 LYS QD 1.800 . 6.000 4.570 2.008 4.878 . 0 0 "[ . 1 . 2]" 1
665 1 41 LYS H 1 41 LYS QG 1.800 . 3.500 2.793 2.558 3.255 . 0 0 "[ . 1 . 2]" 1
666 1 41 LYS H 1 42 ARG QB 1.800 . 6.000 4.823 4.520 5.177 . 0 0 "[ . 1 . 2]" 1
667 1 41 LYS H 1 42 ARG H 1.800 . 5.000 2.909 2.797 3.060 . 0 0 "[ . 1 . 2]" 1
668 1 41 LYS H 1 43 PHE H 1.800 . 5.000 4.222 3.994 4.431 . 0 0 "[ . 1 . 2]" 1
669 1 41 LYS H 1 67 VAL MG2 1.800 . 5.000 4.587 3.855 5.062 0.062 7 0 "[ . 1 . 2]" 1
670 1 42 ARG HA 1 42 ARG QD 1.800 . 5.000 3.631 2.012 4.357 . 0 0 "[ . 1 . 2]" 1
671 1 42 ARG HA 1 64 ILE MD 1.800 . 6.000 4.659 3.915 5.301 . 0 0 "[ . 1 . 2]" 1
672 1 42 ARG QB 1 42 ARG QD 1.800 . 3.500 2.349 2.148 2.960 . 0 0 "[ . 1 . 2]" 1
673 1 42 ARG QB 1 42 ARG HE 1.800 . 5.000 3.463 1.827 4.132 . 0 0 "[ . 1 . 2]" 1
674 1 42 ARG QB 1 43 PHE QD 1.800 . 5.000 2.164 1.803 2.499 . 0 0 "[ . 1 . 2]" 1
675 1 42 ARG HB3 1 43 PHE H 1.800 . 5.000 3.250 2.477 3.934 . 0 0 "[ . 1 . 2]" 1
676 1 42 ARG HB2 1 43 PHE H 1.800 . 5.000 3.329 2.398 4.083 . 0 0 "[ . 1 . 2]" 1
677 1 42 ARG QD 1 43 PHE QD 1.800 . 5.000 3.645 2.355 5.139 0.139 16 0 "[ . 1 . 2]" 1
678 1 42 ARG QG 1 43 PHE QD 1.800 . 5.000 3.249 2.124 4.357 . 0 0 "[ . 1 . 2]" 1
679 1 42 ARG H 1 42 ARG QB 1.800 . 3.500 2.358 2.190 2.536 . 0 0 "[ . 1 . 2]" 1
680 1 42 ARG H 1 43 PHE QD 1.800 . 6.000 4.083 3.530 4.517 . 0 0 "[ . 1 . 2]" 1
681 1 42 ARG H 1 43 PHE H 1.800 . 3.500 2.283 1.996 2.636 . 0 0 "[ . 1 . 2]" 1
682 1 43 PHE HA 1 43 PHE QD 1.800 . 5.000 3.804 3.776 3.823 . 0 0 "[ . 1 . 2]" 1
683 1 43 PHE HA 1 44 VAL MG2 1.800 . 5.000 3.314 3.136 3.484 . 0 0 "[ . 1 . 2]" 1
684 1 43 PHE HA 1 44 VAL H 1.800 . 3.500 2.414 2.235 2.578 . 0 0 "[ . 1 . 2]" 1
685 1 43 PHE HA 1 62 PHE H 1.800 . 6.000 5.010 4.625 5.918 . 0 0 "[ . 1 . 2]" 1
686 1 43 PHE HA 1 64 ILE MD 1.800 . 6.000 3.688 3.114 3.974 . 0 0 "[ . 1 . 2]" 1
687 1 43 PHE HA 1 64 ILE QG 1.800 . 6.000 2.326 1.966 2.681 . 0 0 "[ . 1 . 2]" 1
688 1 43 PHE HA 1 64 ILE MG 1.800 . 6.000 3.253 2.905 3.687 . 0 0 "[ . 1 . 2]" 1
689 1 43 PHE HA 1 64 ILE H 1.800 . 5.000 2.366 2.052 3.087 . 0 0 "[ . 1 . 2]" 1
690 1 43 PHE QB 1 61 TRP HE3 1.800 . 5.000 2.239 1.960 2.851 . 0 0 "[ . 1 . 2]" 1
691 1 43 PHE QB 1 64 ILE H 1.800 . 5.000 3.527 3.106 3.909 . 0 0 "[ . 1 . 2]" 1
692 1 43 PHE HB3 1 44 VAL H 1.800 . 5.000 3.726 3.615 3.880 . 0 0 "[ . 1 . 2]" 1
693 1 43 PHE HB3 1 63 ASN HA 1.800 . 5.000 2.424 2.121 3.094 . 0 0 "[ . 1 . 2]" 1
694 1 43 PHE HB2 1 44 VAL H 1.800 . 5.000 2.348 2.137 2.638 . 0 0 "[ . 1 . 2]" 1
695 1 43 PHE HB2 1 63 ASN HA 1.800 . 5.000 2.590 2.261 2.931 . 0 0 "[ . 1 . 2]" 1
696 1 43 PHE QD 1 44 VAL H 1.800 . 5.000 3.200 2.715 3.684 . 0 0 "[ . 1 . 2]" 1
697 1 43 PHE QD 1 45 ARG H 1.800 . 5.000 4.110 3.699 4.486 . 0 0 "[ . 1 . 2]" 1
698 1 43 PHE QD 1 61 TRP QB 1.800 . 5.000 2.411 1.937 3.191 . 0 0 "[ . 1 . 2]" 1
699 1 43 PHE H 1 43 PHE QD 1.800 . 5.000 2.996 2.690 3.296 . 0 0 "[ . 1 . 2]" 1
700 1 43 PHE H 1 44 VAL MG2 1.800 . 5.000 4.455 4.225 4.815 . 0 0 "[ . 1 . 2]" 1
701 1 43 PHE H 1 44 VAL H 1.800 . 5.000 4.324 4.289 4.358 . 0 0 "[ . 1 . 2]" 1
702 1 44 VAL HA 1 44 VAL MG1 1.800 . 3.500 2.445 2.396 2.506 . 0 0 "[ . 1 . 2]" 1
703 1 44 VAL HA 1 45 ARG H 1.800 . 3.500 2.173 2.103 2.217 . 0 0 "[ . 1 . 2]" 1
704 1 44 VAL HB 1 45 ARG H 1.800 . 5.000 4.156 4.044 4.263 . 0 0 "[ . 1 . 2]" 1
705 1 44 VAL HB 1 62 PHE QB 1.800 . 6.000 4.950 4.800 5.126 . 0 0 "[ . 1 . 2]" 1
706 1 44 VAL HB 1 62 PHE QD 1.800 . 5.000 3.727 3.500 3.887 . 0 0 "[ . 1 . 2]" 1
707 1 44 VAL HB 1 62 PHE QE 1.800 . 5.000 3.105 2.959 3.211 . 0 0 "[ . 1 . 2]" 1
708 1 44 VAL HB 1 62 PHE H 1.800 . 5.000 3.710 3.504 3.987 . 0 0 "[ . 1 . 2]" 1
709 1 44 VAL HB 1 64 ILE MG 1.800 . 5.000 3.262 2.939 3.495 . 0 0 "[ . 1 . 2]" 1
710 1 44 VAL HB 1 70 PHE QD 1.800 . 6.000 4.706 4.409 5.053 . 0 0 "[ . 1 . 2]" 1
711 1 44 VAL HB 1 70 PHE QE 1.800 . 6.000 4.022 3.774 4.195 . 0 0 "[ . 1 . 2]" 1
712 1 44 VAL MG1 1 45 ARG QB 1.800 . 5.000 4.171 4.018 4.394 . 0 0 "[ . 1 . 2]" 1
713 1 44 VAL MG1 1 45 ARG H 1.800 . 3.500 2.677 2.527 2.864 . 0 0 "[ . 1 . 2]" 1
714 1 44 VAL MG1 1 46 VAL MG2 1.800 . 5.000 3.287 2.679 3.757 . 0 0 "[ . 1 . 2]" 1
715 1 44 VAL MG1 1 62 PHE QD 1.800 . 5.000 4.343 4.195 4.486 . 0 0 "[ . 1 . 2]" 1
716 1 44 VAL MG1 1 62 PHE QE 1.800 . 5.000 3.163 3.023 3.407 . 0 0 "[ . 1 . 2]" 1
717 1 44 VAL MG1 1 62 PHE H 1.800 . 5.000 4.491 4.196 4.751 . 0 0 "[ . 1 . 2]" 1
718 1 44 VAL MG1 1 62 PHE HZ 1.800 . 5.000 2.763 2.544 3.027 . 0 0 "[ . 1 . 2]" 1
719 1 44 VAL MG2 1 45 ARG H 1.800 . 5.000 4.101 3.973 4.224 . 0 0 "[ . 1 . 2]" 1
720 1 44 VAL MG2 1 62 PHE QB 1.800 . 6.000 5.418 5.175 5.772 . 0 0 "[ . 1 . 2]" 1
721 1 44 VAL MG2 1 62 PHE QD 1.800 . 5.000 4.074 3.744 4.525 . 0 0 "[ . 1 . 2]" 1
722 1 44 VAL MG2 1 62 PHE QE 1.800 . 5.000 3.062 2.764 3.524 . 0 0 "[ . 1 . 2]" 1
723 1 44 VAL MG2 1 62 PHE H 1.800 . 5.000 4.829 4.642 5.035 0.035 9 0 "[ . 1 . 2]" 1
724 1 44 VAL MG2 1 64 ILE MD 1.800 . 5.000 2.004 1.862 2.174 . 0 0 "[ . 1 . 2]" 1
725 1 44 VAL MG2 1 64 ILE QG 1.800 . 5.000 2.789 2.489 3.366 . 0 0 "[ . 1 . 2]" 1
726 1 44 VAL MG2 1 64 ILE MG 1.800 . 5.000 2.046 1.910 2.185 . 0 0 "[ . 1 . 2]" 1
727 1 44 VAL H 1 44 VAL HB 1.800 . 3.500 2.667 2.534 2.800 . 0 0 "[ . 1 . 2]" 1
728 1 44 VAL H 1 44 VAL MG1 1.800 . 5.000 3.883 3.822 3.947 . 0 0 "[ . 1 . 2]" 1
729 1 44 VAL H 1 44 VAL MG2 1.800 . 3.500 2.720 2.465 2.905 . 0 0 "[ . 1 . 2]" 1
730 1 44 VAL H 1 45 ARG H 1.800 . 5.000 4.324 4.249 4.393 . 0 0 "[ . 1 . 2]" 1
731 1 44 VAL H 1 61 TRP HE3 1.800 . 5.000 3.914 3.566 4.253 . 0 0 "[ . 1 . 2]" 1
732 1 44 VAL H 1 62 PHE QD 1.800 . 5.000 4.288 4.083 4.457 . 0 0 "[ . 1 . 2]" 1
733 1 44 VAL H 1 62 PHE H 1.800 . 5.000 3.070 2.821 3.710 . 0 0 "[ . 1 . 2]" 1
734 1 44 VAL H 1 63 ASN HA 1.800 . 5.000 3.530 3.352 3.860 . 0 0 "[ . 1 . 2]" 1
735 1 44 VAL H 1 64 ILE MD 1.800 . 6.000 4.315 3.965 4.662 . 0 0 "[ . 1 . 2]" 1
736 1 44 VAL H 1 64 ILE H 1.800 . 6.000 4.236 3.920 4.889 . 0 0 "[ . 1 . 2]" 1
737 1 45 ARG HA 1 46 VAL MG2 1.800 . 5.000 3.515 3.228 3.789 . 0 0 "[ . 1 . 2]" 1
738 1 45 ARG HA 1 61 TRP HA 1.800 . 5.000 2.669 2.164 3.437 . 0 0 "[ . 1 . 2]" 1
739 1 45 ARG HA 1 61 TRP QB 1.800 . 5.000 2.208 2.023 2.403 . 0 0 "[ . 1 . 2]" 1
740 1 45 ARG HA 1 62 PHE H 1.800 . 5.000 3.866 3.482 4.461 . 0 0 "[ . 1 . 2]" 1
741 1 45 ARG QB 1 45 ARG HE 1.800 . 5.000 2.649 1.941 4.005 . 0 0 "[ . 1 . 2]" 1
742 1 45 ARG QB 1 46 VAL HA 1.800 . 6.000 4.847 4.515 4.950 . 0 0 "[ . 1 . 2]" 1
743 1 45 ARG QG 1 59 TYR QD 1.800 . 5.000 3.922 2.261 5.100 0.100 11 0 "[ . 1 . 2]" 1
744 1 45 ARG QG 1 61 TRP QB 1.800 . 5.000 2.775 1.878 4.558 . 0 0 "[ . 1 . 2]" 1
745 1 45 ARG HG3 1 46 VAL H 1.800 . 6.000 3.654 2.701 5.257 . 0 0 "[ . 1 . 2]" 1
746 1 45 ARG HG2 1 46 VAL H 1.800 . 6.000 3.453 2.800 5.206 . 0 0 "[ . 1 . 2]" 1
747 1 45 ARG H 1 45 ARG HG3 1.800 . 6.000 4.455 2.595 4.907 . 0 0 "[ . 1 . 2]" 1
748 1 45 ARG H 1 45 ARG HG2 1.800 . 6.000 4.373 3.607 4.634 . 0 0 "[ . 1 . 2]" 1
749 1 46 VAL HA 1 46 VAL MG2 1.800 . 3.500 2.507 2.448 2.545 . 0 0 "[ . 1 . 2]" 1
750 1 46 VAL HA 1 47 THR H 1.800 . 3.500 2.168 2.134 2.210 . 0 0 "[ . 1 . 2]" 1
751 1 46 VAL HB 1 47 THR H 1.800 . 5.000 4.368 4.268 4.417 . 0 0 "[ . 1 . 2]" 1
752 1 46 VAL HB 1 48 PHE QE 1.800 . 6.000 4.059 2.778 4.921 . 0 0 "[ . 1 . 2]" 1
753 1 46 VAL HB 1 60 VAL MG2 1.800 . 3.500 1.909 1.771 2.159 0.029 20 0 "[ . 1 . 2]" 1
754 1 46 VAL HB 1 60 VAL H 1.800 . 5.000 3.079 2.619 3.544 . 0 0 "[ . 1 . 2]" 1
755 1 46 VAL MG1 1 47 THR H 1.800 . 3.500 3.216 2.928 3.302 . 0 0 "[ . 1 . 2]" 1
756 1 46 VAL MG1 1 48 PHE QD 1.800 . 5.000 3.761 2.894 4.372 . 0 0 "[ . 1 . 2]" 1
757 1 46 VAL MG1 1 60 VAL MG2 1.800 . 3.500 2.552 2.376 2.761 . 0 0 "[ . 1 . 2]" 1
758 1 46 VAL MG2 1 47 THR H 1.800 . 5.000 4.295 4.201 4.370 . 0 0 "[ . 1 . 2]" 1
759 1 46 VAL MG2 1 61 TRP HA 1.800 . 5.000 2.428 2.072 2.780 . 0 0 "[ . 1 . 2]" 1
760 1 46 VAL MG2 1 61 TRP H 1.800 . 5.000 4.105 3.796 4.390 . 0 0 "[ . 1 . 2]" 1
761 1 46 VAL MG2 1 62 PHE QD 1.800 . 5.000 2.583 2.155 3.063 . 0 0 "[ . 1 . 2]" 1
762 1 46 VAL MG2 1 62 PHE QE 1.800 . 3.500 2.073 1.935 2.476 . 0 0 "[ . 1 . 2]" 1
763 1 46 VAL MG2 1 62 PHE H 1.800 . 5.000 3.837 3.523 4.113 . 0 0 "[ . 1 . 2]" 1
764 1 46 VAL MG2 1 62 PHE HZ 1.800 . 5.000 3.936 3.638 4.159 . 0 0 "[ . 1 . 2]" 1
765 1 46 VAL H 1 46 VAL MG1 1.800 . 5.000 3.836 3.804 3.859 . 0 0 "[ . 1 . 2]" 1
766 1 46 VAL H 1 46 VAL MG2 1.800 . 3.500 2.225 2.139 2.396 . 0 0 "[ . 1 . 2]" 1
767 1 46 VAL H 1 47 THR H 1.800 . 6.000 4.295 4.229 4.456 . 0 0 "[ . 1 . 2]" 1
768 1 46 VAL H 1 59 TYR QD 1.800 . 6.000 5.203 3.670 6.112 0.112 20 0 "[ . 1 . 2]" 1
769 1 46 VAL H 1 60 VAL MG2 1.800 . 5.000 3.586 3.247 3.875 . 0 0 "[ . 1 . 2]" 1
770 1 46 VAL H 1 60 VAL H 1.800 . 6.000 4.107 3.690 4.561 . 0 0 "[ . 1 . 2]" 1
771 1 46 VAL H 1 61 TRP HA 1.800 . 5.000 2.607 2.286 2.986 . 0 0 "[ . 1 . 2]" 1
772 1 47 THR HA 1 47 THR MG 1.800 . 3.500 2.446 2.385 2.491 . 0 0 "[ . 1 . 2]" 1
773 1 47 THR HA 1 48 PHE H 1.800 . 3.500 2.180 2.122 2.245 . 0 0 "[ . 1 . 2]" 1
774 1 47 THR HB 1 48 PHE H 1.800 . 5.000 4.135 4.015 4.264 . 0 0 "[ . 1 . 2]" 1
775 1 47 THR MG 1 48 PHE H 1.800 . 5.000 2.747 2.517 2.941 . 0 0 "[ . 1 . 2]" 1
776 1 47 THR H 1 47 THR MG 1.800 . 5.000 3.826 3.792 3.872 . 0 0 "[ . 1 . 2]" 1
777 1 47 THR H 1 48 PHE H 1.800 . 5.000 4.435 4.356 4.519 . 0 0 "[ . 1 . 2]" 1
778 1 48 PHE HA 1 48 PHE QD 1.800 . 5.000 2.801 2.024 3.119 . 0 0 "[ . 1 . 2]" 1
779 1 48 PHE HA 1 49 THR H 1.800 . 3.500 2.285 2.161 2.462 . 0 0 "[ . 1 . 2]" 1
780 1 48 PHE QB 1 52 LYS QB 1.800 . 5.000 3.542 2.075 4.828 . 0 0 "[ . 1 . 2]" 1
781 1 48 PHE QB 1 53 THR HA 1.800 . 6.000 3.081 1.883 5.032 . 0 0 "[ . 1 . 2]" 1
782 1 48 PHE QB 1 53 THR H 1.800 . 5.000 3.687 2.985 4.435 . 0 0 "[ . 1 . 2]" 1
783 1 48 PHE HB3 1 49 THR H 1.800 . 5.000 2.774 2.237 3.346 . 0 0 "[ . 1 . 2]" 1
784 1 48 PHE HB3 1 53 THR MG 1.800 . 5.000 3.278 2.227 5.000 . 0 0 "[ . 1 . 2]" 1
785 1 48 PHE HB2 1 49 THR H 1.800 . 5.000 3.873 3.473 4.217 . 0 0 "[ . 1 . 2]" 1
786 1 48 PHE HB2 1 53 THR MG 1.800 . 5.000 2.584 1.790 3.932 0.010 15 0 "[ . 1 . 2]" 1
787 1 48 PHE QD 1 49 THR H 1.800 . 6.000 3.835 3.512 4.220 . 0 0 "[ . 1 . 2]" 1
788 1 48 PHE QD 1 53 THR MG 1.800 . 5.000 2.998 2.035 3.591 . 0 0 "[ . 1 . 2]" 1
789 1 48 PHE QE 1 53 THR MG 1.800 . 5.000 4.411 3.220 5.117 0.117 15 0 "[ . 1 . 2]" 1
790 1 48 PHE QE 1 60 VAL MG1 1.800 . 5.000 3.039 2.482 3.640 . 0 0 "[ . 1 . 2]" 1
791 1 48 PHE QE 1 60 VAL MG2 1.800 . 5.000 2.645 1.998 3.326 . 0 0 "[ . 1 . 2]" 1
792 1 48 PHE H 1 48 PHE QB 1.800 . 3.500 2.453 2.376 2.535 . 0 0 "[ . 1 . 2]" 1
793 1 48 PHE H 1 48 PHE QD 1.800 . 5.000 2.599 2.208 3.363 . 0 0 "[ . 1 . 2]" 1
794 1 48 PHE HZ 1 60 VAL MG1 1.800 . 5.000 2.652 2.092 3.522 . 0 0 "[ . 1 . 2]" 1
795 1 48 PHE HZ 1 60 VAL MG2 1.800 . 5.000 2.151 1.863 2.809 . 0 0 "[ . 1 . 2]" 1
796 1 49 THR HA 1 49 THR MG 1.800 . 3.500 2.536 2.253 3.272 . 0 0 "[ . 1 . 2]" 1
797 1 49 THR HA 1 50 PRO QD 1.800 . 3.500 2.042 1.907 2.259 . 0 0 "[ . 1 . 2]" 1
798 1 49 THR HA 1 50 PRO QG 1.800 . 5.000 3.959 3.806 4.160 . 0 0 "[ . 1 . 2]" 1
799 1 49 THR HB 1 50 PRO QD 1.800 . 3.500 3.146 2.302 3.698 0.198 4 0 "[ . 1 . 2]" 1
800 1 49 THR HB 1 52 LYS QB 1.800 . 5.000 3.937 2.044 5.041 0.041 1 0 "[ . 1 . 2]" 1
801 1 49 THR MG 1 50 PRO QD 1.800 . 3.500 3.190 1.916 3.681 0.181 10 0 "[ . 1 . 2]" 1
802 1 49 THR H 1 49 THR MG 1.800 . 3.500 2.520 1.997 3.669 0.169 4 0 "[ . 1 . 2]" 1
803 1 49 THR H 1 52 LYS QB 1.800 . 5.000 3.420 2.641 4.125 . 0 0 "[ . 1 . 2]" 1
804 1 50 PRO HA 1 52 LYS H 1.800 . 5.000 4.117 3.475 4.894 . 0 0 "[ . 1 . 2]" 1
805 1 51 GLY H 1 52 LYS QB 1.800 . 6.000 4.672 4.024 5.242 . 0 0 "[ . 1 . 2]" 1
806 1 51 GLY H 1 52 LYS H 1.800 . 5.000 2.671 2.052 3.422 . 0 0 "[ . 1 . 2]" 1
807 1 52 LYS QB 1 52 LYS QD 1.800 . 3.500 2.346 2.152 2.797 . 0 0 "[ . 1 . 2]" 1
808 1 52 LYS HB3 1 53 THR H 1.800 . 5.000 3.837 2.352 4.469 . 0 0 "[ . 1 . 2]" 1
809 1 52 LYS HB2 1 53 THR H 1.800 . 5.000 3.344 2.162 4.428 . 0 0 "[ . 1 . 2]" 1
810 1 52 LYS QG 1 53 THR H 1.800 . 5.000 4.282 3.019 4.934 . 0 0 "[ . 1 . 2]" 1
811 1 52 LYS QE 1 52 LYS HG3 1.800 . 5.000 2.671 2.388 3.544 . 0 0 "[ . 1 . 2]" 1
812 1 52 LYS QE 1 52 LYS HG2 1.800 . 5.000 2.749 2.447 3.360 . 0 0 "[ . 1 . 2]" 1
813 1 52 LYS H 1 52 LYS QB 1.800 . 3.500 2.455 2.174 2.719 . 0 0 "[ . 1 . 2]" 1
814 1 52 LYS H 1 52 LYS QD 1.800 . 5.000 3.772 2.196 4.737 . 0 0 "[ . 1 . 2]" 1
815 1 52 LYS H 1 52 LYS QG 1.800 . 3.500 2.900 2.271 3.958 0.458 17 0 "[ . 1 . 2]" 1
816 1 52 LYS H 1 53 THR H 1.800 . 3.500 2.521 2.110 3.624 0.124 8 0 "[ . 1 . 2]" 1
817 1 53 THR HA 1 54 PRO QD 1.800 . 3.500 2.018 1.860 2.130 . 0 0 "[ . 1 . 2]" 1
818 1 53 THR HB 1 54 PRO QD 1.800 . 5.000 3.954 2.843 4.441 . 0 0 "[ . 1 . 2]" 1
819 1 53 THR MG 1 54 PRO QD 1.800 . 5.000 2.924 2.210 4.202 . 0 0 "[ . 1 . 2]" 1
820 1 53 THR MG 1 54 PRO QG 1.800 . 6.000 4.248 2.982 5.636 . 0 0 "[ . 1 . 2]" 1
821 1 53 THR MG 1 57 GLY QA 1.800 . 5.000 3.672 1.979 5.081 0.081 8 0 "[ . 1 . 2]" 1
822 1 53 THR MG 1 57 GLY H 1.800 . 6.000 4.716 3.165 5.806 . 0 0 "[ . 1 . 2]" 1
823 1 53 THR H 1 53 THR MG 1.800 . 5.000 3.389 2.316 3.972 . 0 0 "[ . 1 . 2]" 1
824 1 54 PRO HA 1 55 VAL MG1 1.800 . 6.000 4.696 3.653 6.096 0.096 12 0 "[ . 1 . 2]" 1
825 1 54 PRO HA 1 55 VAL MG2 1.800 . 6.000 4.635 3.482 5.814 . 0 0 "[ . 1 . 2]" 1
826 1 54 PRO HA 1 55 VAL H 1.800 . 3.500 2.478 2.167 3.553 0.053 12 0 "[ . 1 . 2]" 1
827 1 54 PRO HA 1 56 ASP H 1.800 . 5.000 4.194 3.367 4.903 . 0 0 "[ . 1 . 2]" 1
828 1 54 PRO QB 1 56 ASP H 1.800 . 5.000 3.077 2.368 4.309 . 0 0 "[ . 1 . 2]" 1
829 1 54 PRO QB 1 57 GLY H 1.800 . 5.000 3.584 1.825 5.107 0.107 5 0 "[ . 1 . 2]" 1
830 1 54 PRO HB3 1 55 VAL H 1.800 . 5.000 3.593 2.784 4.455 . 0 0 "[ . 1 . 2]" 1
831 1 54 PRO HB2 1 55 VAL H 1.800 . 5.000 3.056 1.899 4.258 . 0 0 "[ . 1 . 2]" 1
832 1 54 PRO QD 1 55 VAL H 1.800 . 5.000 4.752 3.393 5.040 0.040 6 0 "[ . 1 . 2]" 1
833 1 54 PRO QG 1 56 ASP H 1.800 . 6.000 4.218 2.526 5.612 . 0 0 "[ . 1 . 2]" 1
834 1 54 PRO QG 1 57 GLY H 1.800 . 5.000 4.001 1.951 5.130 0.130 9 0 "[ . 1 . 2]" 1
835 1 55 VAL HA 1 55 VAL QG 1.800 . 3.500 2.291 2.189 2.389 . 0 0 "[ . 1 . 2]" 1
836 1 55 VAL HA 1 55 VAL MG1 1.800 . 3.500 2.775 2.378 3.279 . 0 0 "[ . 1 . 2]" 1
837 1 55 VAL HA 1 55 VAL MG2 1.800 . 3.500 2.608 2.353 3.263 . 0 0 "[ . 1 . 2]" 1
838 1 55 VAL HB 1 56 ASP H 1.800 . 5.000 3.546 2.435 4.265 . 0 0 "[ . 1 . 2]" 1
839 1 55 VAL QG 1 56 ASP HA 1.800 . 5.000 3.596 3.189 4.150 . 0 0 "[ . 1 . 2]" 1
840 1 55 VAL QG 1 56 ASP H 1.800 . 5.000 2.787 2.124 3.491 . 0 0 "[ . 1 . 2]" 1
841 1 55 VAL MG1 1 56 ASP HA 1.800 . 6.000 4.130 3.379 5.740 . 0 0 "[ . 1 . 2]" 1
842 1 55 VAL MG1 1 56 ASP H 1.800 . 5.000 3.220 2.137 4.209 . 0 0 "[ . 1 . 2]" 1
843 1 55 VAL MG1 1 57 GLY H 1.800 . 6.000 4.772 4.169 5.561 . 0 0 "[ . 1 . 2]" 1
844 1 55 VAL MG2 1 56 ASP HA 1.800 . 6.000 4.580 3.442 5.681 . 0 0 "[ . 1 . 2]" 1
845 1 55 VAL MG2 1 56 ASP H 1.800 . 5.000 3.604 2.502 4.115 . 0 0 "[ . 1 . 2]" 1
846 1 55 VAL MG2 1 57 GLY H 1.800 . 6.000 5.123 3.644 6.080 0.080 20 0 "[ . 1 . 2]" 1
847 1 55 VAL H 1 55 VAL HB 1.800 . 3.500 2.777 2.453 3.663 0.163 3 0 "[ . 1 . 2]" 1
848 1 55 VAL H 1 55 VAL MG1 1.800 . 5.000 2.800 1.970 3.840 . 0 0 "[ . 1 . 2]" 1
849 1 55 VAL H 1 55 VAL MG2 1.800 . 5.000 2.781 1.950 3.832 . 0 0 "[ . 1 . 2]" 1
850 1 56 ASP HB3 1 57 GLY H 1.800 . 5.000 3.654 2.668 4.557 . 0 0 "[ . 1 . 2]" 1
851 1 56 ASP HB2 1 57 GLY H 1.800 . 5.000 3.798 2.534 4.618 . 0 0 "[ . 1 . 2]" 1
852 1 58 GLN QG 1 59 TYR H 1.800 . 6.000 4.185 2.678 4.875 . 0 0 "[ . 1 . 2]" 1
853 1 58 GLN H 1 58 GLN QG 1.800 . 5.000 2.907 2.064 4.326 . 0 0 "[ . 1 . 2]" 1
854 1 59 TYR HA 1 59 TYR QD 1.800 . 5.000 2.923 2.426 3.810 . 0 0 "[ . 1 . 2]" 1
855 1 59 TYR HA 1 60 VAL MG2 1.800 . 5.000 3.791 3.431 4.162 . 0 0 "[ . 1 . 2]" 1
856 1 59 TYR HA 1 60 VAL H 1.800 . 3.500 2.268 2.074 2.528 . 0 0 "[ . 1 . 2]" 1
857 1 59 TYR QD 1 60 VAL HA 1.800 . 6.000 5.671 3.468 6.107 0.107 6 0 "[ . 1 . 2]" 1
858 1 59 TYR QD 1 60 VAL H 1.800 . 5.000 3.854 3.275 4.475 . 0 0 "[ . 1 . 2]" 1
859 1 59 TYR H 1 59 TYR QD 1.800 . 5.000 2.663 1.848 3.757 . 0 0 "[ . 1 . 2]" 1
860 1 60 VAL HA 1 60 VAL MG1 1.800 . 3.500 2.403 2.333 2.497 . 0 0 "[ . 1 . 2]" 1
861 1 60 VAL HA 1 61 TRP HD1 1.800 . 5.000 3.032 2.861 3.518 . 0 0 "[ . 1 . 2]" 1
862 1 60 VAL HA 1 61 TRP H 1.800 . 3.500 2.426 2.218 2.607 . 0 0 "[ . 1 . 2]" 1
863 1 60 VAL HB 1 61 TRP H 1.800 . 3.500 2.471 2.090 2.897 . 0 0 "[ . 1 . 2]" 1
864 1 60 VAL MG1 1 61 TRP H 1.800 . 5.000 3.746 3.551 3.908 . 0 0 "[ . 1 . 2]" 1
865 1 60 VAL MG2 1 61 TRP H 1.800 . 5.000 3.410 3.049 3.875 . 0 0 "[ . 1 . 2]" 1
866 1 60 VAL H 1 60 VAL MG1 1.800 . 5.000 2.864 2.632 3.091 . 0 0 "[ . 1 . 2]" 1
867 1 60 VAL H 1 60 VAL MG2 1.800 . 5.000 2.161 2.038 2.382 . 0 0 "[ . 1 . 2]" 1
868 1 61 TRP HA 1 62 PHE QD 1.800 . 5.000 3.164 2.947 3.386 . 0 0 "[ . 1 . 2]" 1
869 1 61 TRP HA 1 62 PHE H 1.800 . 3.500 2.409 2.341 2.529 . 0 0 "[ . 1 . 2]" 1
870 1 61 TRP HE3 1 62 PHE HA 1.800 . 5.000 3.560 3.144 4.370 . 0 0 "[ . 1 . 2]" 1
871 1 61 TRP HE3 1 62 PHE H 1.800 . 5.000 3.122 2.857 3.526 . 0 0 "[ . 1 . 2]" 1
872 1 61 TRP HE3 1 63 ASN H 1.800 . 5.000 4.171 3.642 5.022 0.022 2 0 "[ . 1 . 2]" 1
873 1 61 TRP H 1 61 TRP HD1 1.800 . 5.000 3.037 2.591 3.297 . 0 0 "[ . 1 . 2]" 1
874 1 61 TRP H 1 61 TRP HE3 1.800 . 6.000 5.326 5.142 5.718 . 0 0 "[ . 1 . 2]" 1
875 1 61 TRP HZ3 1 63 ASN HA 1.800 . 5.000 3.860 3.102 4.548 . 0 0 "[ . 1 . 2]" 1
876 1 62 PHE HA 1 62 PHE QD 1.800 . 5.000 3.791 3.773 3.804 . 0 0 "[ . 1 . 2]" 1
877 1 62 PHE HA 1 63 ASN H 1.800 . 3.500 2.248 2.212 2.317 . 0 0 "[ . 1 . 2]" 1
878 1 62 PHE QB 1 64 ILE H 1.800 . 6.000 5.705 5.223 5.989 . 0 0 "[ . 1 . 2]" 1
879 1 62 PHE QD 1 63 ASN H 1.800 . 5.000 4.061 3.757 4.255 . 0 0 "[ . 1 . 2]" 1
880 1 62 PHE QD 1 64 ILE MG 1.800 . 5.000 2.570 2.365 2.920 . 0 0 "[ . 1 . 2]" 1
881 1 62 PHE QD 1 70 PHE QD 1.800 . 5.000 4.633 4.343 4.900 . 0 0 "[ . 1 . 2]" 1
882 1 62 PHE QE 1 64 ILE MG 1.800 . 5.000 2.407 2.194 2.783 . 0 0 "[ . 1 . 2]" 1
883 1 62 PHE QE 1 70 PHE QD 1.800 . 5.000 2.487 2.236 2.808 . 0 0 "[ . 1 . 2]" 1
884 1 62 PHE QE 1 70 PHE QE 1.800 . 5.000 2.988 2.404 3.362 . 0 0 "[ . 1 . 2]" 1
885 1 62 PHE H 1 62 PHE QD 1.800 . 5.000 3.017 2.780 3.300 . 0 0 "[ . 1 . 2]" 1
886 1 62 PHE H 1 63 ASN H 1.800 . 5.000 4.328 4.288 4.373 . 0 0 "[ . 1 . 2]" 1
887 1 62 PHE HZ 1 70 PHE QE 1.800 . 5.000 2.068 1.847 2.264 . 0 0 "[ . 1 . 2]" 1
888 1 63 ASN HA 1 64 ILE MG 1.800 . 6.000 3.785 3.511 3.954 . 0 0 "[ . 1 . 2]" 1
889 1 63 ASN HA 1 64 ILE H 1.800 . 3.500 2.228 2.142 2.327 . 0 0 "[ . 1 . 2]" 1
890 1 63 ASN H 1 63 ASN QB 1.800 . 3.500 2.626 2.344 2.844 . 0 0 "[ . 1 . 2]" 1
891 1 63 ASN H 1 63 ASN QD 1.800 . 5.000 3.058 2.146 4.132 . 0 0 "[ . 1 . 2]" 1
892 1 63 ASN H 1 63 ASN HD21 1.800 . 5.000 3.282 2.179 4.677 . 0 0 "[ . 1 . 2]" 1
893 1 63 ASN H 1 63 ASN HD22 1.800 . 5.000 3.910 3.190 4.668 . 0 0 "[ . 1 . 2]" 1
894 1 63 ASN H 1 64 ILE H 1.800 . 6.000 4.566 4.390 4.644 . 0 0 "[ . 1 . 2]" 1
895 1 64 ILE HA 1 64 ILE MD 1.800 . 5.000 4.258 4.230 4.283 . 0 0 "[ . 1 . 2]" 1
896 1 64 ILE HA 1 64 ILE MG 1.800 . 3.500 2.340 2.294 2.411 . 0 0 "[ . 1 . 2]" 1
897 1 64 ILE HB 1 65 GLY H 1.800 . 5.000 3.379 2.116 3.978 . 0 0 "[ . 1 . 2]" 1
898 1 64 ILE HB 1 66 SER H 1.800 . 5.000 3.680 3.035 4.424 . 0 0 "[ . 1 . 2]" 1
899 1 64 ILE HB 1 70 PHE H 1.800 . 5.000 3.986 3.372 4.698 . 0 0 "[ . 1 . 2]" 1
900 1 64 ILE MD 1 66 SER HA 1.800 . 6.000 4.800 4.266 5.186 . 0 0 "[ . 1 . 2]" 1
901 1 64 ILE MD 1 66 SER H 1.800 . 5.000 4.722 4.333 5.091 0.091 19 0 "[ . 1 . 2]" 1
902 1 64 ILE MD 1 67 VAL HA 1.800 . 3.500 1.915 1.750 2.412 0.050 1 0 "[ . 1 . 2]" 1
903 1 64 ILE MD 1 67 VAL MG1 1.800 . 6.000 2.846 2.452 3.481 . 0 0 "[ . 1 . 2]" 1
904 1 64 ILE MD 1 67 VAL MG2 1.800 . 6.000 2.160 1.949 2.633 . 0 0 "[ . 1 . 2]" 1
905 1 64 ILE MD 1 70 PHE HB3 1.800 . 5.000 2.844 2.527 3.247 . 0 0 "[ . 1 . 2]" 1
906 1 64 ILE MD 1 70 PHE HB2 1.800 . 5.000 2.797 2.326 3.255 . 0 0 "[ . 1 . 2]" 1
907 1 64 ILE MD 1 70 PHE QD 1.800 . 5.000 3.277 3.039 3.531 . 0 0 "[ . 1 . 2]" 1
908 1 64 ILE MD 1 70 PHE H 1.800 . 5.000 4.087 3.724 4.517 . 0 0 "[ . 1 . 2]" 1
909 1 64 ILE QG 1 65 GLY QA 1.800 . 6.000 3.807 3.189 4.617 . 0 0 "[ . 1 . 2]" 1
910 1 64 ILE MD 1 64 ILE MG 1.800 . 3.500 2.050 1.987 2.113 . 0 0 "[ . 1 . 2]" 1
911 1 64 ILE HG13 1 64 ILE MG 1.800 . 5.000 3.259 3.243 3.279 . 0 0 "[ . 1 . 2]" 1
912 1 64 ILE HG12 1 64 ILE MG 1.800 . 5.000 2.452 2.390 2.505 . 0 0 "[ . 1 . 2]" 1
913 1 64 ILE MG 1 66 SER H 1.800 . 6.000 4.991 4.464 5.579 . 0 0 "[ . 1 . 2]" 1
914 1 64 ILE MG 1 70 PHE HB3 1.800 . 5.000 3.424 3.172 3.957 . 0 0 "[ . 1 . 2]" 1
915 1 64 ILE MG 1 70 PHE HB2 1.800 . 5.000 2.192 1.935 2.590 . 0 0 "[ . 1 . 2]" 1
916 1 64 ILE MG 1 70 PHE QD 1.800 . 5.000 2.745 2.507 3.203 . 0 0 "[ . 1 . 2]" 1
917 1 64 ILE MG 1 70 PHE H 1.800 . 6.000 4.330 4.096 4.682 . 0 0 "[ . 1 . 2]" 1
918 1 64 ILE H 1 64 ILE MD 1.800 . 5.000 3.868 3.647 4.032 . 0 0 "[ . 1 . 2]" 1
919 1 64 ILE H 1 64 ILE HG13 1.800 . 5.000 2.937 2.849 3.067 . 0 0 "[ . 1 . 2]" 1
920 1 64 ILE H 1 64 ILE HG12 1.800 . 5.000 2.237 1.959 2.479 . 0 0 "[ . 1 . 2]" 1
921 1 65 GLY H 1 66 SER H 1.800 . 6.000 3.214 1.958 4.060 . 0 0 "[ . 1 . 2]" 1
922 1 66 SER HA 1 67 VAL H 1.800 . 3.500 2.173 2.117 2.232 . 0 0 "[ . 1 . 2]" 1
923 1 66 SER QB 1 68 ASP H 1.800 . 5.000 3.668 2.920 4.327 . 0 0 "[ . 1 . 2]" 1
924 1 66 SER QB 1 69 THR HB 1.800 . 3.500 2.396 2.048 2.933 . 0 0 "[ . 1 . 2]" 1
925 1 66 SER QB 1 69 THR MG 1.800 . 5.000 3.538 3.244 3.840 . 0 0 "[ . 1 . 2]" 1
926 1 66 SER QB 1 69 THR H 1.800 . 5.000 2.648 2.234 3.314 . 0 0 "[ . 1 . 2]" 1
927 1 66 SER H 1 69 THR MG 1.800 . 6.000 4.783 3.749 5.549 . 0 0 "[ . 1 . 2]" 1
928 1 67 VAL HA 1 67 VAL MG1 1.800 . 3.500 2.428 2.351 2.494 . 0 0 "[ . 1 . 2]" 1
929 1 67 VAL HA 1 67 VAL MG2 1.800 . 3.500 2.503 2.421 2.618 . 0 0 "[ . 1 . 2]" 1
930 1 67 VAL HA 1 70 PHE HB3 1.800 . 5.000 2.467 2.216 2.769 . 0 0 "[ . 1 . 2]" 1
931 1 67 VAL HA 1 70 PHE HB2 1.800 . 5.000 3.430 3.000 3.699 . 0 0 "[ . 1 . 2]" 1
932 1 67 VAL HA 1 70 PHE QD 1.800 . 5.000 3.618 2.848 4.094 . 0 0 "[ . 1 . 2]" 1
933 1 67 VAL HA 1 70 PHE H 1.800 . 5.000 3.442 3.135 3.660 . 0 0 "[ . 1 . 2]" 1
934 1 67 VAL HA 1 71 GLU H 1.800 . 5.000 4.192 4.019 4.416 . 0 0 "[ . 1 . 2]" 1
935 1 67 VAL HB 1 68 ASP H 1.800 . 3.500 2.761 2.631 2.984 . 0 0 "[ . 1 . 2]" 1
936 1 67 VAL HB 1 93 TYR QE 1.800 . 6.000 4.645 3.703 5.531 . 0 0 "[ . 1 . 2]" 1
937 1 67 VAL MG1 1 68 ASP HA 1.800 . 5.000 3.820 3.560 4.052 . 0 0 "[ . 1 . 2]" 1
938 1 67 VAL MG1 1 68 ASP H 1.800 . 5.000 3.719 3.498 3.876 . 0 0 "[ . 1 . 2]" 1
939 1 67 VAL MG1 1 70 PHE QD 1.800 . 5.000 2.933 2.373 3.471 . 0 0 "[ . 1 . 2]" 1
940 1 67 VAL MG1 1 70 PHE H 1.800 . 5.000 4.755 4.472 4.999 . 0 0 "[ . 1 . 2]" 1
941 1 67 VAL MG1 1 71 GLU QB 1.800 . 6.000 3.956 3.278 4.387 . 0 0 "[ . 1 . 2]" 1
942 1 67 VAL MG1 1 71 GLU QG 1.800 . 5.000 2.763 2.318 4.143 . 0 0 "[ . 1 . 2]" 1
943 1 67 VAL MG1 1 71 GLU H 1.800 . 5.000 3.973 3.740 4.264 . 0 0 "[ . 1 . 2]" 1
944 1 67 VAL MG1 1 93 TYR QD 1.800 . 5.000 3.346 2.439 3.906 . 0 0 "[ . 1 . 2]" 1
945 1 67 VAL MG1 1 93 TYR QE 1.800 . 3.500 2.119 1.850 2.882 . 0 0 "[ . 1 . 2]" 1
946 1 67 VAL MG2 1 68 ASP H 1.800 . 5.000 3.798 3.617 3.924 . 0 0 "[ . 1 . 2]" 1
947 1 67 VAL MG2 1 70 PHE QD 1.800 . 6.000 4.687 4.354 5.012 . 0 0 "[ . 1 . 2]" 1
948 1 67 VAL MG2 1 71 GLU QG 1.800 . 6.000 5.103 4.636 6.039 0.039 2 0 "[ . 1 . 2]" 1
949 1 67 VAL MG2 1 93 TYR QD 1.800 . 5.000 4.302 3.831 4.956 . 0 0 "[ . 1 . 2]" 1
950 1 67 VAL MG2 1 93 TYR QE 1.800 . 5.000 3.920 3.237 5.128 0.128 1 0 "[ . 1 . 2]" 1
951 1 67 VAL H 1 67 VAL MG2 1.800 . 5.000 1.928 1.820 2.045 . 0 0 "[ . 1 . 2]" 1
952 1 67 VAL H 1 68 ASP H 1.800 . 5.000 2.736 2.642 2.799 . 0 0 "[ . 1 . 2]" 1
953 1 68 ASP HA 1 71 GLU QB 1.800 . 5.000 3.247 2.812 4.348 . 0 0 "[ . 1 . 2]" 1
954 1 68 ASP HA 1 71 GLU H 1.800 . 5.000 3.664 3.456 3.794 . 0 0 "[ . 1 . 2]" 1
955 1 68 ASP HA 1 72 ARG H 1.800 . 5.000 4.163 3.944 4.382 . 0 0 "[ . 1 . 2]" 1
956 1 68 ASP HB3 1 69 THR H 1.800 . 5.000 3.110 2.359 3.880 . 0 0 "[ . 1 . 2]" 1
957 1 68 ASP HB2 1 69 THR H 1.800 . 5.000 3.290 2.468 3.999 . 0 0 "[ . 1 . 2]" 1
958 1 68 ASP H 1 68 ASP QB 1.800 . 3.500 2.365 2.197 2.560 . 0 0 "[ . 1 . 2]" 1
959 1 68 ASP H 1 69 THR H 1.800 . 3.500 2.732 2.586 2.906 . 0 0 "[ . 1 . 2]" 1
960 1 68 ASP H 1 70 PHE H 1.800 . 5.000 4.239 3.993 4.375 . 0 0 "[ . 1 . 2]" 1
961 1 69 THR HA 1 69 THR MG 1.800 . 3.500 2.441 2.350 2.505 . 0 0 "[ . 1 . 2]" 1
962 1 69 THR HA 1 71 GLU H 1.800 . 6.000 4.545 4.311 4.861 . 0 0 "[ . 1 . 2]" 1
963 1 69 THR HA 1 72 ARG QB 1.800 . 5.000 3.125 2.544 4.296 . 0 0 "[ . 1 . 2]" 1
964 1 69 THR HA 1 72 ARG QD 1.800 . 5.000 3.784 2.727 5.106 0.106 5 0 "[ . 1 . 2]" 1
965 1 69 THR HA 1 72 ARG QG 1.800 . 6.000 3.425 1.920 4.725 . 0 0 "[ . 1 . 2]" 1
966 1 69 THR HA 1 72 ARG H 1.800 . 5.000 3.694 3.422 4.172 . 0 0 "[ . 1 . 2]" 1
967 1 69 THR HA 1 73 ASN QB 1.800 . 6.000 4.992 4.431 5.594 . 0 0 "[ . 1 . 2]" 1
968 1 69 THR HA 1 73 ASN H 1.800 . 5.000 3.994 3.752 4.356 . 0 0 "[ . 1 . 2]" 1
969 1 69 THR HB 1 70 PHE H 1.800 . 3.500 2.558 2.424 2.759 . 0 0 "[ . 1 . 2]" 1
970 1 69 THR MG 1 70 PHE H 1.800 . 5.000 3.517 3.344 3.748 . 0 0 "[ . 1 . 2]" 1
971 1 69 THR MG 1 72 ARG QG 1.800 . 6.000 4.836 3.343 6.094 0.094 10 0 "[ . 1 . 2]" 1
972 1 69 THR MG 1 73 ASN QD 1.800 . 3.500 2.155 1.762 3.550 0.050 11 0 "[ . 1 . 2]" 1
973 1 69 THR MG 1 73 ASN HD21 1.800 . 5.000 2.773 2.058 4.094 . 0 0 "[ . 1 . 2]" 1
974 1 69 THR MG 1 73 ASN HD22 1.800 . 5.000 2.309 1.786 3.893 0.014 3 0 "[ . 1 . 2]" 1
975 1 69 THR MG 1 73 ASN H 1.800 . 5.000 4.154 3.930 4.457 . 0 0 "[ . 1 . 2]" 1
976 1 69 THR H 1 69 THR HB 1.800 . 3.500 2.585 2.473 2.727 . 0 0 "[ . 1 . 2]" 1
977 1 69 THR H 1 69 THR MG 1.800 . 5.000 3.799 3.771 3.840 . 0 0 "[ . 1 . 2]" 1
978 1 69 THR H 1 71 GLU H 1.800 . 5.000 4.283 4.097 4.543 . 0 0 "[ . 1 . 2]" 1
979 1 70 PHE HA 1 70 PHE QD 1.800 . 3.500 2.677 2.537 2.962 . 0 0 "[ . 1 . 2]" 1
980 1 70 PHE HA 1 71 GLU HA 1.800 . 5.000 4.801 4.714 4.852 . 0 0 "[ . 1 . 2]" 1
981 1 70 PHE HA 1 73 ASN QB 1.800 . 5.000 3.423 2.960 4.741 . 0 0 "[ . 1 . 2]" 1
982 1 70 PHE HA 1 73 ASN QD 1.800 . 5.000 3.578 2.096 5.022 0.022 9 0 "[ . 1 . 2]" 1
983 1 70 PHE HA 1 73 ASN HD21 1.800 . 6.000 3.917 2.818 5.386 . 0 0 "[ . 1 . 2]" 1
984 1 70 PHE HA 1 73 ASN HD22 1.800 . 6.000 4.707 2.114 6.022 0.022 10 0 "[ . 1 . 2]" 1
985 1 70 PHE HA 1 73 ASN H 1.800 . 5.000 4.084 3.803 4.378 . 0 0 "[ . 1 . 2]" 1
986 1 70 PHE HB3 1 71 GLU H 1.800 . 5.000 2.604 2.465 2.795 . 0 0 "[ . 1 . 2]" 1
987 1 70 PHE HB2 1 71 GLU H 1.800 . 5.000 3.957 3.864 4.093 . 0 0 "[ . 1 . 2]" 1
988 1 70 PHE QD 1 71 GLU HA 1.800 . 5.000 3.716 3.588 3.913 . 0 0 "[ . 1 . 2]" 1
989 1 70 PHE QD 1 71 GLU QG 1.800 . 5.000 3.064 2.208 4.607 . 0 0 "[ . 1 . 2]" 1
990 1 70 PHE QD 1 71 GLU H 1.800 . 5.000 3.320 2.912 3.669 . 0 0 "[ . 1 . 2]" 1
991 1 70 PHE QD 1 74 LEU QB 1.800 . 6.000 3.867 3.608 4.181 . 0 0 "[ . 1 . 2]" 1
992 1 70 PHE QE 1 74 LEU QB 1.800 . 6.000 3.724 3.421 4.025 . 0 0 "[ . 1 . 2]" 1
993 1 70 PHE QE 1 74 LEU MD1 1.800 . 5.000 3.304 2.851 3.838 . 0 0 "[ . 1 . 2]" 1
994 1 70 PHE QE 1 74 LEU MD2 1.800 . 5.000 2.980 2.818 3.311 . 0 0 "[ . 1 . 2]" 1
995 1 70 PHE QE 1 91 VAL MG1 1.800 . 5.000 2.113 1.817 2.438 . 0 0 "[ . 1 . 2]" 1
996 1 70 PHE H 1 70 PHE HB3 1.800 . 3.500 2.401 2.210 2.519 . 0 0 "[ . 1 . 2]" 1
997 1 70 PHE H 1 70 PHE HB2 1.800 . 3.500 2.697 2.609 2.841 . 0 0 "[ . 1 . 2]" 1
998 1 70 PHE H 1 70 PHE QD 1.800 . 5.000 4.220 4.083 4.272 . 0 0 "[ . 1 . 2]" 1
999 1 70 PHE H 1 71 GLU H 1.800 . 3.500 2.920 2.797 3.068 . 0 0 "[ . 1 . 2]" 1
1000 1 70 PHE HZ 1 74 LEU MD1 1.800 . 5.000 3.801 3.241 4.376 . 0 0 "[ . 1 . 2]" 1
1001 1 70 PHE HZ 1 74 LEU MD2 1.800 . 5.000 2.618 2.403 2.889 . 0 0 "[ . 1 . 2]" 1
1002 1 70 PHE HZ 1 91 VAL MG1 1.800 . 5.000 3.370 2.808 3.784 . 0 0 "[ . 1 . 2]" 1
1003 1 70 PHE HZ 1 91 VAL MG2 1.800 . 5.000 3.187 2.773 3.559 . 0 0 "[ . 1 . 2]" 1
1004 1 71 GLU HA 1 71 GLU QG 1.800 . 3.500 2.798 2.437 3.459 . 0 0 "[ . 1 . 2]" 1
1005 1 71 GLU HA 1 73 ASN H 1.800 . 5.000 4.645 4.295 4.901 . 0 0 "[ . 1 . 2]" 1
1006 1 71 GLU HA 1 74 LEU HB3 1.800 . 5.000 2.685 2.237 2.933 . 0 0 "[ . 1 . 2]" 1
1007 1 71 GLU HA 1 74 LEU HB2 1.800 . 5.000 3.475 2.685 3.715 . 0 0 "[ . 1 . 2]" 1
1008 1 71 GLU HA 1 74 LEU MD1 1.800 . 5.000 5.071 4.585 5.189 0.189 11 0 "[ . 1 . 2]" 1
1009 1 71 GLU HA 1 74 LEU MD2 1.800 . 5.000 3.242 3.034 3.525 . 0 0 "[ . 1 . 2]" 1
1010 1 71 GLU HA 1 74 LEU H 1.800 . 5.000 3.694 3.042 3.967 . 0 0 "[ . 1 . 2]" 1
1011 1 71 GLU HA 1 75 GLU H 1.800 . 5.000 4.024 3.530 4.358 . 0 0 "[ . 1 . 2]" 1
1012 1 71 GLU QB 1 72 ARG H 1.800 . 3.500 2.735 2.357 3.622 0.122 8 0 "[ . 1 . 2]" 1
1013 1 71 GLU QG 1 72 ARG H 1.800 . 5.000 3.631 2.071 4.255 . 0 0 "[ . 1 . 2]" 1
1014 1 71 GLU QG 1 93 TYR QE 1.800 . 6.000 4.113 2.620 5.626 . 0 0 "[ . 1 . 2]" 1
1015 1 71 GLU H 1 71 GLU QB 1.800 . 3.500 2.452 2.259 2.612 . 0 0 "[ . 1 . 2]" 1
1016 1 71 GLU H 1 71 GLU QG 1.800 . 3.500 2.268 2.112 2.574 . 0 0 "[ . 1 . 2]" 1
1017 1 71 GLU H 1 72 ARG QB 1.800 . 5.000 4.764 4.379 5.054 0.054 17 0 "[ . 1 . 2]" 1
1018 1 71 GLU H 1 72 ARG H 1.800 . 3.500 2.715 2.574 2.901 . 0 0 "[ . 1 . 2]" 1
1019 1 72 ARG HA 1 72 ARG QD 1.800 . 5.000 3.773 2.172 4.585 . 0 0 "[ . 1 . 2]" 1
1020 1 72 ARG HA 1 74 LEU H 1.800 . 5.000 4.603 4.387 4.852 . 0 0 "[ . 1 . 2]" 1
1021 1 72 ARG HA 1 76 THR H 1.800 . 5.000 4.206 3.952 4.433 . 0 0 "[ . 1 . 2]" 1
1022 1 72 ARG QB 1 72 ARG QD 1.800 . 3.500 2.394 2.150 2.908 . 0 0 "[ . 1 . 2]" 1
1023 1 72 ARG QB 1 73 ASN H 1.800 . 3.500 2.677 2.314 3.625 0.125 20 0 "[ . 1 . 2]" 1
1024 1 72 ARG QB 1 74 LEU H 1.800 . 6.000 4.796 4.562 5.263 . 0 0 "[ . 1 . 2]" 1
1025 1 72 ARG QB 1 76 THR H 1.800 . 6.000 5.008 4.838 5.560 . 0 0 "[ . 1 . 2]" 1
1026 1 72 ARG QG 1 73 ASN H 1.800 . 5.000 3.847 2.280 4.313 . 0 0 "[ . 1 . 2]" 1
1027 1 72 ARG H 1 72 ARG QB 1.800 . 3.500 2.475 2.121 2.764 . 0 0 "[ . 1 . 2]" 1
1028 1 72 ARG H 1 72 ARG QD 1.800 . 5.000 3.903 2.866 4.394 . 0 0 "[ . 1 . 2]" 1
1029 1 72 ARG H 1 72 ARG QG 1.800 . 3.500 2.392 2.072 3.954 0.454 5 0 "[ . 1 . 2]" 1
1030 1 72 ARG H 1 73 ASN H 1.800 . 3.500 2.723 2.638 2.906 . 0 0 "[ . 1 . 2]" 1
1031 1 72 ARG H 1 74 LEU H 1.800 . 5.000 4.147 4.015 4.256 . 0 0 "[ . 1 . 2]" 1
1032 1 73 ASN HA 1 73 ASN QD 1.800 . 5.000 3.754 2.521 4.359 . 0 0 "[ . 1 . 2]" 1
1033 1 73 ASN HA 1 73 ASN HD21 1.800 . 6.000 4.039 2.563 4.591 . 0 0 "[ . 1 . 2]" 1
1034 1 73 ASN HA 1 75 GLU H 1.800 . 5.000 4.643 4.300 4.921 . 0 0 "[ . 1 . 2]" 1
1035 1 73 ASN HA 1 76 THR HB 1.800 . 5.000 2.973 2.605 3.371 . 0 0 "[ . 1 . 2]" 1
1036 1 73 ASN HA 1 76 THR H 1.800 . 5.000 3.762 3.290 4.119 . 0 0 "[ . 1 . 2]" 1
1037 1 73 ASN HA 1 77 LEU H 1.800 . 5.000 3.832 3.624 4.039 . 0 0 "[ . 1 . 2]" 1
1038 1 73 ASN HB3 1 74 LEU H 1.800 . 5.000 3.642 3.386 4.141 . 0 0 "[ . 1 . 2]" 1
1039 1 73 ASN HB2 1 74 LEU H 1.800 . 5.000 2.823 2.435 4.006 . 0 0 "[ . 1 . 2]" 1
1040 1 73 ASN H 1 73 ASN QB 1.800 . 3.500 2.443 2.343 2.708 . 0 0 "[ . 1 . 2]" 1
1041 1 73 ASN H 1 73 ASN QD 1.800 . 5.000 3.185 1.910 4.230 . 0 0 "[ . 1 . 2]" 1
1042 1 73 ASN H 1 74 LEU HB3 1.800 . 6.000 4.790 4.645 5.063 . 0 0 "[ . 1 . 2]" 1
1043 1 73 ASN H 1 74 LEU HB2 1.800 . 6.000 4.877 4.750 5.000 . 0 0 "[ . 1 . 2]" 1
1044 1 73 ASN H 1 74 LEU H 1.800 . 3.500 2.615 2.534 2.719 . 0 0 "[ . 1 . 2]" 1
1045 1 73 ASN H 1 75 GLU H 1.800 . 5.000 4.318 4.050 4.512 . 0 0 "[ . 1 . 2]" 1
1046 1 74 LEU HA 1 74 LEU MD1 1.800 . 3.500 2.167 2.039 2.250 . 0 0 "[ . 1 . 2]" 1
1047 1 74 LEU HA 1 74 LEU MD2 1.800 . 5.000 3.955 3.913 3.984 . 0 0 "[ . 1 . 2]" 1
1048 1 74 LEU HA 1 77 LEU HB3 1.800 . 5.000 2.764 2.325 4.265 . 0 0 "[ . 1 . 2]" 1
1049 1 74 LEU HA 1 77 LEU HB2 1.800 . 5.000 3.550 2.814 4.058 . 0 0 "[ . 1 . 2]" 1
1050 1 74 LEU HA 1 77 LEU H 1.800 . 5.000 3.950 3.461 4.324 . 0 0 "[ . 1 . 2]" 1
1051 1 74 LEU HA 1 78 GLN H 1.800 . 5.000 4.092 3.587 4.355 . 0 0 "[ . 1 . 2]" 1
1052 1 74 LEU QB 1 74 LEU MD2 1.800 . 3.500 2.138 2.118 2.149 . 0 0 "[ . 1 . 2]" 1
1053 1 74 LEU QB 1 75 GLU QB 1.800 . 6.000 4.282 3.820 4.785 . 0 0 "[ . 1 . 2]" 1
1054 1 74 LEU QB 1 76 THR H 1.800 . 6.000 4.798 4.639 5.021 . 0 0 "[ . 1 . 2]" 1
1055 1 74 LEU HB3 1 75 GLU H 1.800 . 5.000 2.463 2.291 2.857 . 0 0 "[ . 1 . 2]" 1
1056 1 74 LEU HB2 1 75 GLU H 1.800 . 5.000 3.799 3.691 3.944 . 0 0 "[ . 1 . 2]" 1
1057 1 74 LEU MD1 1 75 GLU H 1.800 . 6.000 4.528 4.380 4.802 . 0 0 "[ . 1 . 2]" 1
1058 1 74 LEU MD1 1 78 GLN HE21 1.800 . 5.000 3.614 2.097 4.960 . 0 0 "[ . 1 . 2]" 1
1059 1 74 LEU MD1 1 78 GLN HE22 1.800 . 5.000 3.940 3.021 4.916 . 0 0 "[ . 1 . 2]" 1
1060 1 74 LEU MD1 1 78 GLN HG3 1.800 . 5.000 2.887 2.675 3.420 . 0 0 "[ . 1 . 2]" 1
1061 1 74 LEU MD1 1 78 GLN HG2 1.800 . 5.000 3.741 3.338 4.345 . 0 0 "[ . 1 . 2]" 1
1062 1 74 LEU MD1 1 78 GLN H 1.800 . 6.000 4.315 3.979 4.758 . 0 0 "[ . 1 . 2]" 1
1063 1 74 LEU MD1 1 89 VAL HB 1.800 . 5.000 3.465 2.864 4.252 . 0 0 "[ . 1 . 2]" 1
1064 1 74 LEU MD2 1 75 GLU H 1.800 . 5.000 4.157 3.851 4.679 . 0 0 "[ . 1 . 2]" 1
1065 1 74 LEU MD2 1 78 GLN HE21 1.800 . 5.000 3.814 2.596 4.949 . 0 0 "[ . 1 . 2]" 1
1066 1 74 LEU MD2 1 78 GLN HE22 1.800 . 5.000 3.371 2.751 4.313 . 0 0 "[ . 1 . 2]" 1
1067 1 74 LEU MD2 1 78 GLN QG 1.800 . 5.000 4.248 3.851 4.647 . 0 0 "[ . 1 . 2]" 1
1068 1 74 LEU MD2 1 89 VAL HB 1.800 . 6.000 3.683 3.029 4.484 . 0 0 "[ . 1 . 2]" 1
1069 1 74 LEU MD2 1 91 VAL MG2 1.800 . 3.500 2.112 1.894 2.341 . 0 0 "[ . 1 . 2]" 1
1070 1 74 LEU HG 1 78 GLN HE21 1.800 . 5.000 2.749 1.803 4.522 . 0 0 "[ . 1 . 2]" 1
1071 1 74 LEU HG 1 78 GLN HE22 1.800 . 5.000 3.031 2.427 4.186 . 0 0 "[ . 1 . 2]" 1
1072 1 74 LEU HG 1 78 GLN QG 1.800 . 5.000 3.023 2.535 3.422 . 0 0 "[ . 1 . 2]" 1
1073 1 74 LEU H 1 74 LEU HB3 1.800 . 3.500 2.570 2.470 2.747 . 0 0 "[ . 1 . 2]" 1
1074 1 74 LEU H 1 74 LEU HB2 1.800 . 3.500 2.441 2.337 2.497 . 0 0 "[ . 1 . 2]" 1
1075 1 74 LEU H 1 74 LEU MD1 1.800 . 5.000 4.096 3.940 4.176 . 0 0 "[ . 1 . 2]" 1
1076 1 74 LEU H 1 74 LEU MD2 1.800 . 5.000 4.299 4.226 4.334 . 0 0 "[ . 1 . 2]" 1
1077 1 74 LEU H 1 75 GLU QB 1.800 . 6.000 4.926 4.731 5.296 . 0 0 "[ . 1 . 2]" 1
1078 1 74 LEU H 1 75 GLU H 1.800 . 3.500 2.865 2.726 2.975 . 0 0 "[ . 1 . 2]" 1
1079 1 75 GLU HA 1 75 GLU QG 1.800 . 3.500 2.978 2.399 3.496 . 0 0 "[ . 1 . 2]" 1
1080 1 75 GLU HA 1 78 GLN QB 1.800 . 5.000 2.828 2.432 3.529 . 0 0 "[ . 1 . 2]" 1
1081 1 75 GLU HA 1 78 GLN HE21 1.800 . 5.000 2.916 1.788 5.116 0.116 10 0 "[ . 1 . 2]" 1
1082 1 75 GLU HA 1 78 GLN HE22 1.800 . 5.000 3.847 2.999 5.073 0.073 10 0 "[ . 1 . 2]" 1
1083 1 75 GLU HA 1 78 GLN H 1.800 . 5.000 3.618 3.214 4.110 . 0 0 "[ . 1 . 2]" 1
1084 1 75 GLU QB 1 76 THR H 1.800 . 3.500 2.755 2.278 3.558 0.058 4 0 "[ . 1 . 2]" 1
1085 1 75 GLU QG 1 76 THR H 1.800 . 5.000 3.674 2.127 4.240 . 0 0 "[ . 1 . 2]" 1
1086 1 75 GLU H 1 75 GLU QB 1.800 . 3.500 2.484 2.362 2.674 . 0 0 "[ . 1 . 2]" 1
1087 1 75 GLU H 1 75 GLU QG 1.800 . 3.500 2.273 2.056 2.440 . 0 0 "[ . 1 . 2]" 1
1088 1 75 GLU H 1 76 THR H 1.800 . 3.500 2.746 2.634 2.831 . 0 0 "[ . 1 . 2]" 1
1089 1 76 THR HA 1 76 THR MG 1.800 . 3.500 2.448 2.398 2.496 . 0 0 "[ . 1 . 2]" 1
1090 1 76 THR HA 1 79 GLN QB 1.800 . 5.000 3.067 2.567 4.132 . 0 0 "[ . 1 . 2]" 1
1091 1 76 THR HA 1 79 GLN H 1.800 . 5.000 3.678 3.385 4.079 . 0 0 "[ . 1 . 2]" 1
1092 1 76 THR HB 1 77 LEU H 1.800 . 3.500 2.339 2.166 2.571 . 0 0 "[ . 1 . 2]" 1
1093 1 76 THR MG 1 77 LEU H 1.800 . 5.000 3.370 3.089 3.708 . 0 0 "[ . 1 . 2]" 1
1094 1 76 THR MG 1 80 GLU QG 1.800 . 5.000 3.048 2.450 4.990 . 0 0 "[ . 1 . 2]" 1
1095 1 76 THR MG 1 80 GLU H 1.800 . 5.000 4.282 3.987 4.559 . 0 0 "[ . 1 . 2]" 1
1096 1 76 THR H 1 76 THR HB 1.800 . 3.500 2.585 2.481 2.675 . 0 0 "[ . 1 . 2]" 1
1097 1 76 THR H 1 76 THR MG 1.800 . 5.000 3.801 3.758 3.831 . 0 0 "[ . 1 . 2]" 1
1098 1 76 THR H 1 77 LEU QB 1.800 . 6.000 4.230 4.102 4.452 . 0 0 "[ . 1 . 2]" 1
1099 1 77 LEU HA 1 77 LEU MD1 1.800 . 3.500 2.195 1.873 3.043 . 0 0 "[ . 1 . 2]" 1
1100 1 77 LEU HA 1 79 GLN H 1.800 . 5.000 4.537 4.239 4.854 . 0 0 "[ . 1 . 2]" 1
1101 1 77 LEU HA 1 80 GLU QB 1.800 . 5.000 2.766 2.318 3.960 . 0 0 "[ . 1 . 2]" 1
1102 1 77 LEU HA 1 80 GLU QG 1.800 . 5.000 3.338 1.965 4.578 . 0 0 "[ . 1 . 2]" 1
1103 1 77 LEU HA 1 80 GLU H 1.800 . 5.000 3.563 3.183 3.850 . 0 0 "[ . 1 . 2]" 1
1104 1 77 LEU HA 1 81 LEU MD1 1.800 . 5.000 4.489 3.666 5.051 0.051 15 0 "[ . 1 . 2]" 1
1105 1 77 LEU QB 1 81 LEU MD1 1.800 . 6.000 4.029 2.537 4.552 . 0 0 "[ . 1 . 2]" 1
1106 1 77 LEU HB3 1 78 GLN H 1.800 . 5.000 2.523 2.293 3.171 . 0 0 "[ . 1 . 2]" 1
1107 1 77 LEU HB2 1 78 GLN H 1.800 . 5.000 3.764 2.755 3.914 . 0 0 "[ . 1 . 2]" 1
1108 1 77 LEU MD1 1 78 GLN H 1.800 . 6.000 4.451 3.549 4.637 . 0 0 "[ . 1 . 2]" 1
1109 1 77 LEU MD1 1 80 GLU H 1.800 . 5.000 4.733 4.323 5.082 0.082 19 0 "[ . 1 . 2]" 1
1110 1 77 LEU MD1 1 81 LEU MD1 1.800 . 5.000 2.575 2.092 3.504 . 0 0 "[ . 1 . 2]" 1
1111 1 77 LEU MD1 1 81 LEU HG 1.800 . 5.000 2.755 2.211 3.398 . 0 0 "[ . 1 . 2]" 1
1112 1 77 LEU MD1 1 81 LEU H 1.800 . 5.000 4.186 3.843 4.711 . 0 0 "[ . 1 . 2]" 1
1113 1 77 LEU MD2 1 81 LEU MD1 1.800 . 5.000 3.179 2.782 4.572 . 0 0 "[ . 1 . 2]" 1
1114 1 77 LEU HG 1 78 GLN HA 1.800 . 6.000 4.015 3.452 6.217 0.217 10 0 "[ . 1 . 2]" 1
1115 1 77 LEU HG 1 78 GLN H 1.800 . 6.000 3.863 3.470 5.083 . 0 0 "[ . 1 . 2]" 1
1116 1 77 LEU HG 1 81 LEU MD1 1.800 . 5.000 2.577 2.147 4.402 . 0 0 "[ . 1 . 2]" 1
1117 1 77 LEU H 1 77 LEU QB 1.800 . 3.500 2.194 2.147 2.274 . 0 0 "[ . 1 . 2]" 1
1118 1 77 LEU H 1 77 LEU MD1 1.800 . 5.000 4.065 3.651 4.393 . 0 0 "[ . 1 . 2]" 1
1119 1 77 LEU H 1 77 LEU MD2 1.800 . 5.000 4.104 2.318 4.292 . 0 0 "[ . 1 . 2]" 1
1120 1 77 LEU H 1 77 LEU HG 1.800 . 5.000 4.510 4.138 4.564 . 0 0 "[ . 1 . 2]" 1
1121 1 77 LEU H 1 78 GLN H 1.800 . 3.500 2.926 2.744 3.046 . 0 0 "[ . 1 . 2]" 1
1122 1 78 GLN HA 1 81 LEU HB3 1.800 . 5.000 4.466 4.028 4.996 . 0 0 "[ . 1 . 2]" 1
1123 1 78 GLN HA 1 81 LEU HB2 1.800 . 5.000 2.793 2.362 3.258 . 0 0 "[ . 1 . 2]" 1
1124 1 78 GLN HA 1 81 LEU MD1 1.800 . 5.000 3.117 2.459 3.901 . 0 0 "[ . 1 . 2]" 1
1125 1 78 GLN HA 1 81 LEU H 1.800 . 5.000 3.472 3.120 3.741 . 0 0 "[ . 1 . 2]" 1
1126 1 78 GLN HA 1 83 ILE HB 1.800 . 5.000 2.521 2.029 5.163 0.163 8 0 "[ . 1 . 2]" 1
1127 1 78 GLN HA 1 83 ILE MD 1.800 . 5.000 2.942 2.428 3.871 . 0 0 "[ . 1 . 2]" 1
1128 1 78 GLN QB 1 78 GLN HE21 1.800 . 5.000 2.563 1.872 3.852 . 0 0 "[ . 1 . 2]" 1
1129 1 78 GLN QB 1 78 GLN HE22 1.800 . 5.000 3.564 3.267 4.135 . 0 0 "[ . 1 . 2]" 1
1130 1 78 GLN QB 1 79 GLN H 1.800 . 3.500 2.678 2.416 2.896 . 0 0 "[ . 1 . 2]" 1
1131 1 78 GLN QB 1 83 ILE HB 1.800 . 5.000 2.541 2.002 4.705 . 0 0 "[ . 1 . 2]" 1
1132 1 78 GLN QB 1 83 ILE MG 1.800 . 5.000 2.838 2.194 4.347 . 0 0 "[ . 1 . 2]" 1
1133 1 78 GLN HE22 1 88 ARG QB 1.800 . 5.000 3.756 2.204 5.218 0.218 10 0 "[ . 1 . 2]" 1
1134 1 78 GLN HE22 1 89 VAL HB 1.800 . 6.000 4.459 2.354 5.764 . 0 0 "[ . 1 . 2]" 1
1135 1 78 GLN HE22 1 89 VAL H 1.800 . 5.000 3.655 2.029 4.743 . 0 0 "[ . 1 . 2]" 1
1136 1 78 GLN QG 1 79 GLN H 1.800 . 5.000 4.277 4.065 4.419 . 0 0 "[ . 1 . 2]" 1
1137 1 78 GLN QG 1 83 ILE HB 1.800 . 5.000 2.911 2.398 4.643 . 0 0 "[ . 1 . 2]" 1
1138 1 78 GLN HG3 1 83 ILE MD 1.800 . 5.000 4.324 3.731 5.093 0.093 9 0 "[ . 1 . 2]" 1
1139 1 78 GLN HG2 1 83 ILE MD 1.800 . 5.000 3.140 2.401 4.012 . 0 0 "[ . 1 . 2]" 1
1140 1 78 GLN H 1 78 GLN QB 1.800 . 3.500 2.360 2.245 2.475 . 0 0 "[ . 1 . 2]" 1
1141 1 78 GLN H 1 78 GLN QE 1.800 . 5.000 3.904 3.297 5.074 0.074 9 0 "[ . 1 . 2]" 1
1142 1 78 GLN H 1 78 GLN HG3 1.800 . 5.000 2.522 2.333 2.760 . 0 0 "[ . 1 . 2]" 1
1143 1 78 GLN H 1 78 GLN HG2 1.800 . 5.000 3.683 3.434 3.939 . 0 0 "[ . 1 . 2]" 1
1144 1 78 GLN H 1 79 GLN H 1.800 . 3.500 2.682 2.587 2.744 . 0 0 "[ . 1 . 2]" 1
1145 1 78 GLN H 1 81 LEU QB 1.800 . 6.000 5.061 4.834 5.335 . 0 0 "[ . 1 . 2]" 1
1146 1 78 GLN H 1 81 LEU MD1 1.800 . 6.000 4.648 4.139 5.387 . 0 0 "[ . 1 . 2]" 1
1147 1 78 GLN H 1 83 ILE MD 1.800 . 6.000 5.144 4.579 6.047 0.047 18 0 "[ . 1 . 2]" 1
1148 1 79 GLN HA 1 81 LEU H 1.800 . 5.000 4.536 4.184 4.830 . 0 0 "[ . 1 . 2]" 1
1149 1 79 GLN HA 1 82 GLY H 1.800 . 5.000 3.529 3.097 3.771 . 0 0 "[ . 1 . 2]" 1
1150 1 79 GLN HA 1 83 ILE H 1.800 . 5.000 4.241 3.252 4.720 . 0 0 "[ . 1 . 2]" 1
1151 1 79 GLN QB 1 79 GLN QE 1.800 . 5.000 2.798 1.775 3.525 0.025 19 0 "[ . 1 . 2]" 1
1152 1 79 GLN HB3 1 80 GLU H 1.800 . 5.000 3.685 2.557 4.088 . 0 0 "[ . 1 . 2]" 1
1153 1 79 GLN HB2 1 80 GLU H 1.800 . 5.000 3.186 2.615 4.156 . 0 0 "[ . 1 . 2]" 1
1154 1 79 GLN H 1 79 GLN QG 1.800 . 3.500 2.608 2.193 3.955 0.455 9 0 "[ . 1 . 2]" 1
1155 1 79 GLN H 1 80 GLU H 1.800 . 3.500 2.647 2.573 2.778 . 0 0 "[ . 1 . 2]" 1
1156 1 80 GLU HA 1 80 GLU QG 1.800 . 3.500 2.713 2.433 3.399 . 0 0 "[ . 1 . 2]" 1
1157 1 80 GLU QB 1 82 GLY H 1.800 . 5.000 4.456 4.316 4.899 . 0 0 "[ . 1 . 2]" 1
1158 1 80 GLU HB3 1 81 LEU H 1.800 . 5.000 3.465 2.340 4.073 . 0 0 "[ . 1 . 2]" 1
1159 1 80 GLU HB2 1 81 LEU H 1.800 . 5.000 2.860 2.441 3.902 . 0 0 "[ . 1 . 2]" 1
1160 1 80 GLU HG3 1 81 LEU H 1.800 . 6.000 4.535 2.404 5.156 . 0 0 "[ . 1 . 2]" 1
1161 1 80 GLU HG2 1 81 LEU H 1.800 . 6.000 4.476 2.841 5.125 . 0 0 "[ . 1 . 2]" 1
1162 1 80 GLU H 1 80 GLU QB 1.800 . 3.500 2.395 2.117 2.627 . 0 0 "[ . 1 . 2]" 1
1163 1 80 GLU H 1 80 GLU QG 1.800 . 3.500 2.565 2.190 3.917 0.417 7 0 "[ . 1 . 2]" 1
1164 1 80 GLU H 1 81 LEU H 1.800 . 3.500 2.620 2.540 2.764 . 0 0 "[ . 1 . 2]" 1
1165 1 80 GLU H 1 82 GLY H 1.800 . 5.000 3.840 3.710 3.961 . 0 0 "[ . 1 . 2]" 1
1166 1 81 LEU HA 1 81 LEU MD1 1.800 . 5.000 3.943 3.864 4.000 . 0 0 "[ . 1 . 2]" 1
1167 1 81 LEU HA 1 81 LEU MD2 1.800 . 3.500 2.126 2.020 2.230 . 0 0 "[ . 1 . 2]" 1
1168 1 81 LEU HA 1 83 ILE H 1.800 . 5.000 4.529 4.334 4.784 . 0 0 "[ . 1 . 2]" 1
1169 1 81 LEU QB 1 81 LEU MD1 1.800 . 3.500 2.149 2.123 2.160 . 0 0 "[ . 1 . 2]" 1
1170 1 81 LEU QB 1 81 LEU MD2 1.800 . 3.500 2.398 2.322 2.491 . 0 0 "[ . 1 . 2]" 1
1171 1 81 LEU QB 1 83 ILE QG 1.800 . 5.000 2.359 1.752 3.838 0.048 18 0 "[ . 1 . 2]" 1
1172 1 81 LEU HB3 1 82 GLY H 1.800 . 5.000 4.188 4.044 4.380 . 0 0 "[ . 1 . 2]" 1
1173 1 81 LEU HB3 1 83 ILE MD 1.800 . 5.000 2.972 2.569 5.099 0.099 8 0 "[ . 1 . 2]" 1
1174 1 81 LEU HB2 1 82 GLY H 1.800 . 5.000 3.380 3.199 3.671 . 0 0 "[ . 1 . 2]" 1
1175 1 81 LEU HB2 1 83 ILE MD 1.800 . 5.000 2.683 1.888 4.102 . 0 0 "[ . 1 . 2]" 1
1176 1 81 LEU MD1 1 82 GLY H 1.800 . 6.000 5.177 4.940 5.410 . 0 0 "[ . 1 . 2]" 1
1177 1 81 LEU MD2 1 82 GLY H 1.800 . 6.000 4.778 4.550 4.897 . 0 0 "[ . 1 . 2]" 1
1178 1 81 LEU HG 1 82 GLY H 1.800 . 6.000 4.728 4.551 4.946 . 0 0 "[ . 1 . 2]" 1
1179 1 81 LEU H 1 81 LEU QB 1.800 . 3.500 2.430 2.321 2.514 . 0 0 "[ . 1 . 2]" 1
1180 1 81 LEU H 1 81 LEU MD1 1.800 . 5.000 3.750 3.519 3.938 . 0 0 "[ . 1 . 2]" 1
1181 1 81 LEU H 1 81 LEU MD2 1.800 . 5.000 3.400 3.067 3.625 . 0 0 "[ . 1 . 2]" 1
1182 1 81 LEU H 1 81 LEU HG 1.800 . 3.500 2.468 2.269 2.654 . 0 0 "[ . 1 . 2]" 1
1183 1 81 LEU H 1 82 GLY H 1.800 . 3.500 2.572 2.446 2.678 . 0 0 "[ . 1 . 2]" 1
1184 1 81 LEU H 1 83 ILE MD 1.800 . 5.000 4.614 3.596 5.029 0.029 18 0 "[ . 1 . 2]" 1
1185 1 82 GLY QA 1 83 ILE H 1.800 . 3.500 2.898 2.759 2.947 . 0 0 "[ . 1 . 2]" 1
1186 1 82 GLY H 1 83 ILE MD 1.800 . 6.000 4.976 3.625 5.500 . 0 0 "[ . 1 . 2]" 1
1187 1 82 GLY H 1 83 ILE QG 1.800 . 6.000 4.251 3.693 5.536 . 0 0 "[ . 1 . 2]" 1
1188 1 82 GLY H 1 83 ILE H 1.800 . 3.500 2.517 2.424 2.718 . 0 0 "[ . 1 . 2]" 1
1189 1 83 ILE HA 1 83 ILE MD 1.800 . 5.000 3.712 2.384 3.946 . 0 0 "[ . 1 . 2]" 1
1190 1 83 ILE HA 1 83 ILE QG 1.800 . 3.500 2.533 2.358 3.501 0.001 8 0 "[ . 1 . 2]" 1
1191 1 83 ILE HA 1 83 ILE MG 1.800 . 3.500 2.527 2.243 2.741 . 0 0 "[ . 1 . 2]" 1
1192 1 83 ILE HA 1 84 GLU H 1.800 . 3.500 2.223 2.124 2.297 . 0 0 "[ . 1 . 2]" 1
1193 1 83 ILE HB 1 83 ILE MD 1.800 . 3.500 2.509 2.398 3.283 . 0 0 "[ . 1 . 2]" 1
1194 1 83 ILE HB 1 84 GLU H 1.800 . 5.000 4.366 2.598 4.576 . 0 0 "[ . 1 . 2]" 1
1195 1 83 ILE QG 1 84 GLU H 1.800 . 5.000 4.386 4.013 4.924 . 0 0 "[ . 1 . 2]" 1
1196 1 83 ILE MG 1 84 GLU HA 1.800 . 5.000 3.829 3.101 5.164 0.164 8 0 "[ . 1 . 2]" 1
1197 1 83 ILE MG 1 84 GLU H 1.800 . 3.500 3.262 2.792 3.560 0.060 9 0 "[ . 1 . 2]" 1
1198 1 83 ILE MG 1 87 ASN HB3 1.800 . 5.000 2.841 2.231 3.588 . 0 0 "[ . 1 . 2]" 1
1199 1 83 ILE MG 1 87 ASN HB2 1.800 . 5.000 3.498 1.973 4.619 . 0 0 "[ . 1 . 2]" 1
1200 1 83 ILE MG 1 87 ASN H 1.800 . 5.000 4.469 3.435 5.055 0.055 20 0 "[ . 1 . 2]" 1
1201 1 83 ILE MG 1 88 ARG HA 1.800 . 3.500 2.025 1.760 3.134 0.040 5 0 "[ . 1 . 2]" 1
1202 1 83 ILE MG 1 88 ARG QD 1.800 . 5.000 4.404 2.684 5.130 0.130 13 0 "[ . 1 . 2]" 1
1203 1 83 ILE MG 1 88 ARG HE 1.800 . 5.000 4.619 3.523 5.302 0.302 15 0 "[ . 1 . 2]" 1
1204 1 83 ILE MG 1 88 ARG QG 1.800 . 5.000 2.989 1.981 4.800 . 0 0 "[ . 1 . 2]" 1
1205 1 83 ILE MG 1 88 ARG H 1.800 . 5.000 3.444 2.761 3.787 . 0 0 "[ . 1 . 2]" 1
1206 1 83 ILE MG 1 89 VAL H 1.800 . 5.000 3.204 2.718 5.038 0.038 8 0 "[ . 1 . 2]" 1
1207 1 83 ILE H 1 83 ILE HB 1.800 . 3.500 2.478 2.278 3.594 0.094 8 0 "[ . 1 . 2]" 1
1208 1 83 ILE H 1 83 ILE MD 1.800 . 5.000 3.432 2.048 3.813 . 0 0 "[ . 1 . 2]" 1
1209 1 83 ILE H 1 83 ILE QG 1.800 . 3.500 2.349 1.921 3.566 0.066 1 0 "[ . 1 . 2]" 1
1210 1 83 ILE H 1 84 GLU H 1.800 . 5.000 4.366 4.147 4.606 . 0 0 "[ . 1 . 2]" 1
1211 1 84 GLU HA 1 84 GLU QG 1.800 . 3.500 3.104 2.452 3.526 0.026 4 0 "[ . 1 . 2]" 1
1212 1 84 GLU HA 1 85 GLY QA 1.800 . 5.000 4.020 3.896 4.164 . 0 0 "[ . 1 . 2]" 1
1213 1 84 GLU HA 1 85 GLY H 1.800 . 3.500 2.347 2.163 2.642 . 0 0 "[ . 1 . 2]" 1
1214 1 84 GLU HA 1 88 ARG QD 1.800 . 5.000 3.514 2.223 4.934 . 0 0 "[ . 1 . 2]" 1
1215 1 84 GLU HA 1 88 ARG HE 1.800 . 5.000 3.263 1.991 5.040 0.040 19 0 "[ . 1 . 2]" 1
1216 1 84 GLU HA 1 88 ARG H 1.800 . 5.000 4.234 3.429 5.149 0.149 1 0 "[ . 1 . 2]" 1
1217 1 84 GLU QB 1 85 GLY H 1.800 . 3.500 2.533 2.098 2.953 . 0 0 "[ . 1 . 2]" 1
1218 1 84 GLU QG 1 85 GLY H 1.800 . 5.000 3.961 3.377 4.717 . 0 0 "[ . 1 . 2]" 1
1219 1 84 GLU H 1 84 GLU QB 1.800 . 3.500 2.997 2.453 3.335 . 0 0 "[ . 1 . 2]" 1
1220 1 84 GLU H 1 84 GLU QG 1.800 . 3.500 2.701 2.332 3.263 . 0 0 "[ . 1 . 2]" 1
1221 1 84 GLU H 1 87 ASN QB 1.800 . 5.000 2.476 1.934 3.282 . 0 0 "[ . 1 . 2]" 1
1222 1 84 GLU H 1 87 ASN QD 1.800 . 5.000 3.907 2.391 4.872 . 0 0 "[ . 1 . 2]" 1
1223 1 84 GLU H 1 87 ASN H 1.800 . 5.000 3.876 3.431 4.242 . 0 0 "[ . 1 . 2]" 1
1224 1 84 GLU H 1 88 ARG H 1.800 . 5.000 4.173 3.451 4.916 . 0 0 "[ . 1 . 2]" 1
1225 1 85 GLY QA 1 86 GLU H 1.800 . 3.500 2.245 2.086 2.875 . 0 0 "[ . 1 . 2]" 1
1226 1 85 GLY QA 1 88 ARG QB 1.800 . 6.000 3.703 2.039 4.630 . 0 0 "[ . 1 . 2]" 1
1227 1 85 GLY QA 1 88 ARG QD 1.800 . 5.000 3.710 1.965 5.115 0.115 4 0 "[ . 1 . 2]" 1
1228 1 85 GLY QA 1 88 ARG HE 1.800 . 6.000 4.809 2.859 6.171 0.171 3 0 "[ . 1 . 2]" 1
1229 1 85 GLY QA 1 88 ARG QG 1.800 . 5.000 3.981 2.615 5.258 0.258 2 0 "[ . 1 . 2]" 1
1230 1 85 GLY QA 1 88 ARG H 1.800 . 6.000 3.963 3.264 4.303 . 0 0 "[ . 1 . 2]" 1
1231 1 85 GLY HA3 1 87 ASN H 1.800 . 5.000 3.980 3.384 5.013 0.013 8 0 "[ . 1 . 2]" 1
1232 1 85 GLY HA2 1 87 ASN H 1.800 . 5.000 4.667 4.408 5.067 0.067 10 0 "[ . 1 . 2]" 1
1233 1 85 GLY H 1 86 GLU H 1.800 . 5.000 4.185 2.823 4.562 . 0 0 "[ . 1 . 2]" 1
1234 1 85 GLY H 1 87 ASN H 1.800 . 5.000 4.703 4.285 4.981 . 0 0 "[ . 1 . 2]" 1
1235 1 85 GLY H 1 88 ARG QD 1.800 . 5.000 3.290 2.201 5.241 0.241 8 0 "[ . 1 . 2]" 1
1236 1 85 GLY H 1 88 ARG HE 1.800 . 5.000 3.760 2.129 5.092 0.092 19 0 "[ . 1 . 2]" 1
1237 1 85 GLY H 1 88 ARG QG 1.800 . 5.000 3.494 2.238 5.003 0.003 8 0 "[ . 1 . 2]" 1
1238 1 86 GLU HA 1 88 ARG H 1.800 . 5.000 4.026 3.674 4.436 . 0 0 "[ . 1 . 2]" 1
1239 1 86 GLU HB3 1 87 ASN H 1.800 . 5.000 3.668 2.558 4.311 . 0 0 "[ . 1 . 2]" 1
1240 1 86 GLU HB2 1 87 ASN H 1.800 . 5.000 3.392 2.503 4.327 . 0 0 "[ . 1 . 2]" 1
1241 1 86 GLU QG 1 87 ASN H 1.800 . 5.000 3.899 2.450 4.488 . 0 0 "[ . 1 . 2]" 1
1242 1 86 GLU H 1 86 GLU QB 1.800 . 3.500 2.429 2.201 2.629 . 0 0 "[ . 1 . 2]" 1
1243 1 86 GLU H 1 86 GLU QG 1.800 . 5.000 2.944 2.068 4.018 . 0 0 "[ . 1 . 2]" 1
1244 1 86 GLU H 1 87 ASN H 1.800 . 5.000 2.552 2.393 2.733 . 0 0 "[ . 1 . 2]" 1
1245 1 86 GLU H 1 88 ARG H 1.800 . 6.000 4.029 3.609 4.409 . 0 0 "[ . 1 . 2]" 1
1246 1 87 ASN HB3 1 88 ARG H 1.800 . 5.000 3.769 2.972 4.346 . 0 0 "[ . 1 . 2]" 1
1247 1 87 ASN HB2 1 88 ARG H 1.800 . 5.000 3.673 3.093 4.293 . 0 0 "[ . 1 . 2]" 1
1248 1 87 ASN H 1 87 ASN QB 1.800 . 3.500 2.365 2.181 2.528 . 0 0 "[ . 1 . 2]" 1
1249 1 87 ASN H 1 87 ASN QD 1.800 . 5.000 3.847 2.153 4.535 . 0 0 "[ . 1 . 2]" 1
1250 1 87 ASN H 1 88 ARG QB 1.800 . 5.000 4.379 3.823 4.711 . 0 0 "[ . 1 . 2]" 1
1251 1 87 ASN H 1 88 ARG QG 1.800 . 6.000 4.737 3.660 6.067 0.067 2 0 "[ . 1 . 2]" 1
1252 1 87 ASN H 1 88 ARG H 1.800 . 3.500 2.453 2.133 2.650 . 0 0 "[ . 1 . 2]" 1
1253 1 88 ARG HA 1 88 ARG QD 1.800 . 5.000 4.043 2.225 4.630 . 0 0 "[ . 1 . 2]" 1
1254 1 88 ARG HA 1 89 VAL MG2 1.800 . 5.000 3.392 3.044 3.626 . 0 0 "[ . 1 . 2]" 1
1255 1 88 ARG HA 1 89 VAL H 1.800 . 3.500 2.210 2.105 2.337 . 0 0 "[ . 1 . 2]" 1
1256 1 88 ARG QB 1 88 ARG HE 1.800 . 5.000 3.268 1.893 4.472 . 0 0 "[ . 1 . 2]" 1
1257 1 88 ARG QD 1 89 VAL H 1.800 . 5.000 4.744 3.454 5.239 0.239 19 0 "[ . 1 . 2]" 1
1258 1 88 ARG QG 1 89 VAL H 1.800 . 5.000 3.435 2.261 4.526 . 0 0 "[ . 1 . 2]" 1
1259 1 88 ARG H 1 88 ARG QB 1.800 . 3.500 2.364 2.172 2.599 . 0 0 "[ . 1 . 2]" 1
1260 1 88 ARG H 1 88 ARG QD 1.800 . 5.000 4.252 3.733 5.058 0.058 8 0 "[ . 1 . 2]" 1
1261 1 88 ARG H 1 88 ARG QG 1.800 . 5.000 2.980 2.097 4.033 . 0 0 "[ . 1 . 2]" 1
1262 1 88 ARG H 1 89 VAL H 1.800 . 6.000 4.587 4.510 4.656 . 0 0 "[ . 1 . 2]" 1
1263 1 89 VAL HA 1 89 VAL MG1 1.800 . 3.500 2.458 2.361 2.577 . 0 0 "[ . 1 . 2]" 1
1264 1 89 VAL HA 1 89 VAL MG2 1.800 . 3.500 2.447 2.336 2.545 . 0 0 "[ . 1 . 2]" 1
1265 1 89 VAL HA 1 90 PRO HD3 1.800 . 3.500 2.309 2.015 2.713 . 0 0 "[ . 1 . 2]" 1
1266 1 89 VAL HA 1 90 PRO HD2 1.800 . 3.500 2.340 2.033 2.708 . 0 0 "[ . 1 . 2]" 1
1267 1 89 VAL MG1 1 90 PRO HA 1.800 . 5.000 4.455 4.225 4.623 . 0 0 "[ . 1 . 2]" 1
1268 1 89 VAL MG1 1 90 PRO HD3 1.800 . 5.000 3.792 3.496 4.358 . 0 0 "[ . 1 . 2]" 1
1269 1 89 VAL MG1 1 90 PRO HD2 1.800 . 5.000 2.781 2.303 3.483 . 0 0 "[ . 1 . 2]" 1
1270 1 89 VAL MG2 1 90 PRO HD3 1.800 . 5.000 4.340 3.994 4.731 . 0 0 "[ . 1 . 2]" 1
1271 1 89 VAL MG2 1 90 PRO HD2 1.800 . 5.000 4.064 3.663 4.493 . 0 0 "[ . 1 . 2]" 1
1272 1 89 VAL H 1 89 VAL HB 1.800 . 3.500 2.536 2.415 2.675 . 0 0 "[ . 1 . 2]" 1
1273 1 89 VAL H 1 89 VAL MG1 1.800 . 5.000 3.812 3.772 3.880 . 0 0 "[ . 1 . 2]" 1
1274 1 89 VAL H 1 89 VAL MG2 1.800 . 3.500 2.285 1.991 2.692 . 0 0 "[ . 1 . 2]" 1
1275 1 90 PRO HA 1 91 VAL MG2 1.800 . 5.000 3.475 3.165 3.772 . 0 0 "[ . 1 . 2]" 1
1276 1 90 PRO HA 1 91 VAL H 1.800 . 2.700 2.202 2.129 2.292 . 0 0 "[ . 1 . 2]" 1
1277 1 90 PRO HB3 1 91 VAL H 1.800 . 5.000 3.666 3.192 4.193 . 0 0 "[ . 1 . 2]" 1
1278 1 90 PRO HB2 1 91 VAL H 1.800 . 5.000 3.535 2.812 4.122 . 0 0 "[ . 1 . 2]" 1
1279 1 91 VAL HA 1 91 VAL MG1 1.800 . 3.500 2.438 2.341 2.514 . 0 0 "[ . 1 . 2]" 1
1280 1 91 VAL HA 1 91 VAL MG2 1.800 . 3.500 2.478 2.417 2.568 . 0 0 "[ . 1 . 2]" 1
1281 1 91 VAL HA 1 92 VAL H 1.800 . 3.500 2.169 2.109 2.212 . 0 0 "[ . 1 . 2]" 1
1282 1 91 VAL HB 1 93 TYR QE 1.800 . 5.000 3.672 3.114 4.436 . 0 0 "[ . 1 . 2]" 1
1283 1 91 VAL MG1 1 92 VAL HA 1.800 . 5.000 4.030 3.752 4.236 . 0 0 "[ . 1 . 2]" 1
1284 1 91 VAL MG1 1 92 VAL H 1.800 . 3.500 2.896 2.627 3.141 . 0 0 "[ . 1 . 2]" 1
1285 1 91 VAL MG1 1 93 TYR HA 1.800 . 6.000 4.151 3.758 4.634 . 0 0 "[ . 1 . 2]" 1
1286 1 91 VAL MG1 1 93 TYR QD 1.800 . 5.000 3.448 2.652 4.001 . 0 0 "[ . 1 . 2]" 1
1287 1 91 VAL MG1 1 93 TYR QE 1.800 . 5.000 2.850 2.208 3.394 . 0 0 "[ . 1 . 2]" 1
1288 1 91 VAL MG2 1 92 VAL H 1.800 . 5.000 4.187 4.079 4.301 . 0 0 "[ . 1 . 2]" 1
1289 1 91 VAL H 1 91 VAL HB 1.800 . 3.500 2.619 2.516 2.768 . 0 0 "[ . 1 . 2]" 1
1290 1 91 VAL H 1 91 VAL MG1 1.800 . 5.000 3.873 3.831 3.918 . 0 0 "[ . 1 . 2]" 1
1291 1 91 VAL H 1 91 VAL MG2 1.800 . 3.500 2.548 2.374 2.696 . 0 0 "[ . 1 . 2]" 1
1292 1 91 VAL H 1 92 VAL MG2 1.800 . 5.000 4.140 3.805 4.392 . 0 0 "[ . 1 . 2]" 1
1293 1 91 VAL H 1 92 VAL H 1.800 . 5.000 4.355 4.240 4.478 . 0 0 "[ . 1 . 2]" 1
1294 1 92 VAL HA 1 92 VAL MG1 1.800 . 3.500 2.413 2.331 2.491 . 0 0 "[ . 1 . 2]" 1
1295 1 92 VAL HA 1 93 TYR QD 1.800 . 5.000 3.969 3.345 4.552 . 0 0 "[ . 1 . 2]" 1
1296 1 92 VAL HA 1 93 TYR H 1.800 . 3.500 2.223 2.169 2.320 . 0 0 "[ . 1 . 2]" 1
1297 1 92 VAL HB 1 93 TYR H 1.800 . 5.000 4.369 3.960 4.495 . 0 0 "[ . 1 . 2]" 1
1298 1 92 VAL MG1 1 93 TYR H 1.800 . 5.000 3.267 2.413 3.560 . 0 0 "[ . 1 . 2]" 1
1299 1 92 VAL MG1 1 94 ILE MD 1.800 . 5.000 2.503 2.023 3.122 . 0 0 "[ . 1 . 2]" 1
1300 1 92 VAL MG2 1 93 TYR H 1.800 . 5.000 4.350 4.117 4.479 . 0 0 "[ . 1 . 2]" 1
1301 1 92 VAL H 1 92 VAL MG1 1.800 . 5.000 3.906 3.829 3.985 . 0 0 "[ . 1 . 2]" 1
1302 1 92 VAL H 1 92 VAL MG2 1.800 . 3.500 2.533 2.315 2.744 . 0 0 "[ . 1 . 2]" 1
1303 1 93 TYR HA 1 93 TYR QD 1.800 . 5.000 2.888 2.640 3.160 . 0 0 "[ . 1 . 2]" 1
1304 1 93 TYR HA 1 93 TYR QE 1.800 . 5.000 4.645 4.502 4.836 . 0 0 "[ . 1 . 2]" 1
1305 1 93 TYR HA 1 94 ILE QG 1.800 . 6.000 3.920 3.520 4.692 . 0 0 "[ . 1 . 2]" 1
1306 1 93 TYR HA 1 94 ILE MG 1.800 . 6.000 5.534 5.463 5.607 . 0 0 "[ . 1 . 2]" 1
1307 1 93 TYR HA 1 94 ILE H 1.800 . 3.500 2.162 2.096 2.223 . 0 0 "[ . 1 . 2]" 1
1308 1 93 TYR QD 1 94 ILE H 1.800 . 5.000 4.443 4.099 4.808 . 0 0 "[ . 1 . 2]" 1
1309 1 93 TYR H 1 93 TYR QB 1.800 . 3.500 2.449 2.263 2.643 . 0 0 "[ . 1 . 2]" 1
1310 1 93 TYR H 1 93 TYR QD 1.800 . 3.500 2.465 2.013 2.784 . 0 0 "[ . 1 . 2]" 1
1311 1 93 TYR H 1 94 ILE H 1.800 . 5.000 4.366 4.210 4.491 . 0 0 "[ . 1 . 2]" 1
1312 1 94 ILE HA 1 94 ILE MD 1.800 . 5.000 3.228 2.006 3.958 . 0 0 "[ . 1 . 2]" 1
1313 1 94 ILE HA 1 94 ILE MG 1.800 . 3.500 2.488 2.388 2.597 . 0 0 "[ . 1 . 2]" 1
1314 1 94 ILE HA 1 95 ALA MB 1.800 . 5.000 4.048 3.899 4.282 . 0 0 "[ . 1 . 2]" 1
1315 1 94 ILE HA 1 95 ALA H 1.800 . 3.500 2.233 2.153 2.330 . 0 0 "[ . 1 . 2]" 1
1316 1 94 ILE HB 1 95 ALA H 1.800 . 5.000 4.154 3.849 4.465 . 0 0 "[ . 1 . 2]" 1
1317 1 94 ILE MD 1 95 ALA H 1.800 . 6.000 4.627 3.602 5.220 . 0 0 "[ . 1 . 2]" 1
1318 1 94 ILE HG13 1 95 ALA H 1.800 . 6.000 5.233 4.646 5.629 . 0 0 "[ . 1 . 2]" 1
1319 1 94 ILE HG12 1 95 ALA H 1.800 . 6.000 4.818 4.348 5.416 . 0 0 "[ . 1 . 2]" 1
1320 1 94 ILE MD 1 94 ILE MG 1.800 . 3.500 2.177 1.998 3.255 . 0 0 "[ . 1 . 2]" 1
1321 1 94 ILE QG 1 94 ILE MG 1.800 . 3.500 2.359 2.139 2.456 . 0 0 "[ . 1 . 2]" 1
1322 1 94 ILE MG 1 95 ALA HA 1.800 . 5.000 3.674 3.152 4.031 . 0 0 "[ . 1 . 2]" 1
1323 1 94 ILE MG 1 95 ALA H 1.800 . 3.500 2.651 2.218 3.104 . 0 0 "[ . 1 . 2]" 1
1324 1 94 ILE MG 1 96 GLU HA 1.800 . 6.000 4.059 2.410 6.402 0.402 7 0 "[ . 1 . 2]" 1
1325 1 94 ILE MG 1 96 GLU QG 1.800 . 5.000 3.507 1.791 4.997 0.009 10 0 "[ . 1 . 2]" 1
1326 1 94 ILE MG 1 96 GLU H 1.800 . 5.000 3.148 1.805 4.594 . 0 0 "[ . 1 . 2]" 1
1327 1 94 ILE H 1 94 ILE HB 1.800 . 3.500 2.579 2.328 2.764 . 0 0 "[ . 1 . 2]" 1
1328 1 94 ILE H 1 94 ILE MD 1.800 . 5.000 3.687 2.061 4.256 . 0 0 "[ . 1 . 2]" 1
1329 1 94 ILE H 1 94 ILE QG 1.800 . 5.000 2.747 2.258 3.472 . 0 0 "[ . 1 . 2]" 1
1330 1 94 ILE H 1 95 ALA H 1.800 . 5.000 4.420 4.284 4.526 . 0 0 "[ . 1 . 2]" 1
1331 1 95 ALA HA 1 96 GLU H 1.800 . 3.500 2.395 2.124 3.347 . 0 0 "[ . 1 . 2]" 1
1332 1 95 ALA H 1 95 ALA MB 1.800 . 3.500 2.523 2.261 2.973 . 0 0 "[ . 1 . 2]" 1
1333 1 95 ALA H 1 96 GLU H 1.800 . 5.000 3.647 2.510 4.553 . 0 0 "[ . 1 . 2]" 1
1334 1 96 GLU HB3 1 97 SER H 1.800 . 6.000 3.530 1.916 4.485 . 0 0 "[ . 1 . 2]" 1
1335 1 96 GLU HB2 1 97 SER H 1.800 . 6.000 3.533 2.023 4.558 . 0 0 "[ . 1 . 2]" 1
1336 1 96 GLU H 1 96 GLU QG 1.800 . 5.000 3.259 1.927 4.481 . 0 0 "[ . 1 . 2]" 1
1337 1 97 SER HA 1 98 ASP H 1.800 . 3.500 2.630 2.170 3.449 . 0 0 "[ . 1 . 2]" 1
1338 1 97 SER HA 1 99 GLY H 1.800 . 5.000 4.121 3.339 5.152 0.152 14 0 "[ . 1 . 2]" 1
1339 1 97 SER QB 1 99 GLY H 1.800 . 5.000 4.384 2.740 5.145 0.145 9 0 "[ . 1 . 2]" 1
1340 1 98 ASP HB3 1 99 GLY H 1.800 . 5.000 3.295 2.101 4.488 . 0 0 "[ . 1 . 2]" 1
1341 1 98 ASP HB2 1 99 GLY H 1.800 . 5.000 3.842 2.698 4.536 . 0 0 "[ . 1 . 2]" 1
1342 1 98 ASP H 1 98 ASP QB 1.800 . 3.500 2.510 2.200 3.402 . 0 0 "[ . 1 . 2]" 1
1343 1 98 ASP H 1 99 GLY H 1.800 . 5.000 2.833 1.947 4.131 . 0 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 70
_Distance_constraint_stats_list.Viol_count 53
_Distance_constraint_stats_list.Viol_total 29.129
_Distance_constraint_stats_list.Viol_max 0.100
_Distance_constraint_stats_list.Viol_rms 0.0071
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0010
_Distance_constraint_stats_list.Viol_average_violations_only 0.0275
_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 16 ARG 0.056 0.038 20 0 "[ . 1 . 2]"
1 18 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 19 THR 0.014 0.014 14 0 "[ . 1 . 2]"
1 20 TRP 0.000 0.000 . 0 "[ . 1 . 2]"
1 21 LYS 0.293 0.087 14 0 "[ . 1 . 2]"
1 22 ASP 0.008 0.008 3 0 "[ . 1 . 2]"
1 23 PHE 0.014 0.014 14 0 "[ . 1 . 2]"
1 24 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 25 ASN 0.293 0.087 14 0 "[ . 1 . 2]"
1 26 ASN 0.008 0.008 3 0 "[ . 1 . 2]"
1 28 LEU 0.063 0.041 12 0 "[ . 1 . 2]"
1 29 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 31 GLY 0.063 0.041 12 0 "[ . 1 . 2]"
1 32 VAL 0.009 0.009 14 0 "[ . 1 . 2]"
1 34 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 35 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 36 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 38 VAL 0.022 0.017 16 0 "[ . 1 . 2]"
1 39 VAL 0.012 0.012 15 0 "[ . 1 . 2]"
1 40 ASN 0.100 0.100 13 0 "[ . 1 . 2]"
1 43 PHE 0.012 0.012 15 0 "[ . 1 . 2]"
1 44 VAL 0.011 0.011 14 0 "[ . 1 . 2]"
1 45 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 46 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 47 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 49 THR 0.009 0.009 14 0 "[ . 1 . 2]"
1 60 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 61 TRP 0.056 0.038 20 0 "[ . 1 . 2]"
1 62 PHE 0.011 0.011 14 0 "[ . 1 . 2]"
1 66 SER 0.095 0.046 7 0 "[ . 1 . 2]"
1 67 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 68 ASP 0.013 0.013 9 0 "[ . 1 . 2]"
1 69 THR 0.000 0.000 17 0 "[ . 1 . 2]"
1 70 PHE 0.100 0.046 7 0 "[ . 1 . 2]"
1 71 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 72 ARG 0.269 0.093 14 0 "[ . 1 . 2]"
1 73 ASN 0.000 0.000 17 0 "[ . 1 . 2]"
1 74 LEU 0.005 0.005 11 0 "[ . 1 . 2]"
1 75 GLU 0.253 0.068 16 0 "[ . 1 . 2]"
1 76 THR 0.256 0.093 14 0 "[ . 1 . 2]"
1 77 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 78 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 79 GLN 0.253 0.068 16 0 "[ . 1 . 2]"
1 80 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 81 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 84 GLU 0.245 0.078 10 0 "[ . 1 . 2]"
1 87 ASN 0.245 0.078 10 0 "[ . 1 . 2]"
1 90 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 94 ILE 0.122 0.100 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 18 ILE H 1 61 TRP O 1.700 . 2.300 1.958 1.878 2.093 . 0 0 "[ . 1 . 2]" 2
2 1 18 ILE N 1 61 TRP O 2.700 2.700 3.300 2.854 2.770 2.997 . 0 0 "[ . 1 . 2]" 2
3 1 19 THR O 1 23 PHE H 1.700 . 2.300 2.115 1.994 2.314 0.014 14 0 "[ . 1 . 2]" 2
4 1 19 THR O 1 23 PHE N 2.700 2.700 3.300 3.054 2.920 3.268 . 0 0 "[ . 1 . 2]" 2
5 1 20 TRP O 1 24 VAL H 1.700 . 2.300 2.069 1.954 2.232 . 0 0 "[ . 1 . 2]" 2
6 1 20 TRP O 1 24 VAL N 2.700 2.700 3.300 3.004 2.914 3.167 . 0 0 "[ . 1 . 2]" 2
7 1 21 LYS O 1 25 ASN H 1.700 . 2.300 2.213 2.027 2.387 0.087 14 0 "[ . 1 . 2]" 2
8 1 21 LYS O 1 25 ASN N 2.700 2.700 3.300 3.179 3.005 3.362 0.062 14 0 "[ . 1 . 2]" 2
9 1 22 ASP O 1 26 ASN H 1.700 . 2.300 2.139 2.001 2.308 0.008 3 0 "[ . 1 . 2]" 2
10 1 22 ASP O 1 26 ASN N 2.700 2.700 3.300 3.041 2.909 3.187 . 0 0 "[ . 1 . 2]" 2
11 1 24 VAL O 1 29 SER H 1.700 . 2.300 1.979 1.908 2.073 . 0 0 "[ . 1 . 2]" 2
12 1 24 VAL O 1 29 SER N 2.700 2.700 3.300 2.925 2.859 3.015 . 0 0 "[ . 1 . 2]" 2
13 1 28 LEU O 1 31 GLY H 1.700 . 2.300 2.169 2.053 2.341 0.041 12 0 "[ . 1 . 2]" 2
14 1 28 LEU O 1 31 GLY N 2.700 2.700 3.300 3.080 2.950 3.304 0.004 12 0 "[ . 1 . 2]" 2
15 1 34 ASP H 1 47 THR O 1.700 . 2.300 1.899 1.850 1.993 . 0 0 "[ . 1 . 2]" 2
16 1 34 ASP N 1 47 THR O 2.700 2.700 3.300 2.812 2.728 2.936 . 0 0 "[ . 1 . 2]" 2
17 1 36 LEU H 1 90 PRO O 1.700 . 2.300 1.981 1.913 2.084 . 0 0 "[ . 1 . 2]" 2
18 1 36 LEU N 1 90 PRO O 2.700 2.700 3.300 2.936 2.864 3.050 . 0 0 "[ . 1 . 2]" 2
19 1 37 GLU H 1 45 ARG O 1.700 . 2.300 2.127 2.020 2.251 . 0 0 "[ . 1 . 2]" 2
20 1 37 GLU N 1 45 ARG O 2.700 2.700 3.300 3.042 2.929 3.156 . 0 0 "[ . 1 . 2]" 2
21 1 38 VAL H 1 92 VAL O 1.700 . 2.300 2.029 1.927 2.134 . 0 0 "[ . 1 . 2]" 2
22 1 38 VAL N 1 92 VAL O 2.700 2.700 3.300 2.911 2.822 3.035 . 0 0 "[ . 1 . 2]" 2
23 1 39 VAL H 1 43 PHE O 1.700 . 2.300 2.187 2.064 2.312 0.012 15 0 "[ . 1 . 2]" 2
24 1 39 VAL N 1 43 PHE O 2.700 2.700 3.300 2.905 2.747 3.018 . 0 0 "[ . 1 . 2]" 2
25 1 40 ASN H 1 94 ILE O 1.700 . 2.300 2.015 1.882 2.400 0.100 13 0 "[ . 1 . 2]" 2
26 1 40 ASN N 1 94 ILE O 2.700 2.700 3.300 2.856 2.751 3.045 . 0 0 "[ . 1 . 2]" 2
27 1 44 VAL H 1 62 PHE O 1.700 . 2.300 1.999 1.928 2.177 . 0 0 "[ . 1 . 2]" 2
28 1 44 VAL N 1 62 PHE O 2.700 2.700 3.300 2.958 2.880 3.102 . 0 0 "[ . 1 . 2]" 2
29 1 37 GLU O 1 45 ARG H 1.700 . 2.300 1.938 1.883 1.997 . 0 0 "[ . 1 . 2]" 2
30 1 37 GLU O 1 45 ARG N 2.700 2.700 3.300 2.865 2.817 2.919 . 0 0 "[ . 1 . 2]" 2
31 1 46 VAL H 1 60 VAL O 1.700 . 2.300 2.017 1.904 2.206 . 0 0 "[ . 1 . 2]" 2
32 1 46 VAL N 1 60 VAL O 2.700 2.700 3.300 2.886 2.787 2.998 . 0 0 "[ . 1 . 2]" 2
33 1 35 ARG O 1 47 THR H 1.700 . 2.300 2.137 1.995 2.291 . 0 0 "[ . 1 . 2]" 2
34 1 35 ARG O 1 47 THR N 2.700 2.700 3.300 3.065 2.913 3.227 . 0 0 "[ . 1 . 2]" 2
35 1 32 VAL O 1 49 THR H 1.700 . 2.300 2.088 1.981 2.309 0.009 14 0 "[ . 1 . 2]" 2
36 1 32 VAL O 1 49 THR N 2.700 2.700 3.300 3.026 2.891 3.251 . 0 0 "[ . 1 . 2]" 2
37 1 16 ARG O 1 61 TRP H 1.700 . 2.300 2.159 2.059 2.338 0.038 20 0 "[ . 1 . 2]" 2
38 1 16 ARG O 1 61 TRP N 2.700 2.700 3.300 3.040 2.886 3.222 . 0 0 "[ . 1 . 2]" 2
39 1 44 VAL O 1 62 PHE H 1.700 . 2.300 2.122 2.004 2.311 0.011 14 0 "[ . 1 . 2]" 2
40 1 44 VAL O 1 62 PHE N 2.700 2.700 3.300 3.069 2.966 3.236 . 0 0 "[ . 1 . 2]" 2
41 1 66 SER O 1 70 PHE H 1.700 . 2.300 2.199 1.957 2.346 0.046 7 0 "[ . 1 . 2]" 2
42 1 66 SER O 1 70 PHE N 2.700 2.700 3.300 3.153 2.919 3.322 0.022 7 0 "[ . 1 . 2]" 2
43 1 67 VAL O 1 71 GLU H 1.700 . 2.300 2.082 2.012 2.233 . 0 0 "[ . 1 . 2]" 2
44 1 67 VAL O 1 71 GLU N 2.700 2.700 3.300 3.011 2.912 3.176 . 0 0 "[ . 1 . 2]" 2
45 1 68 ASP O 1 72 ARG H 1.700 . 2.300 2.138 1.916 2.313 0.013 9 0 "[ . 1 . 2]" 2
46 1 68 ASP O 1 72 ARG N 2.700 2.700 3.300 3.082 2.871 3.255 . 0 0 "[ . 1 . 2]" 2
47 1 69 THR O 1 73 ASN H 1.700 . 2.300 2.108 1.987 2.300 0.000 17 0 "[ . 1 . 2]" 2
48 1 69 THR O 1 73 ASN N 2.700 2.700 3.300 3.053 2.907 3.234 . 0 0 "[ . 1 . 2]" 2
49 1 70 PHE O 1 74 LEU H 1.700 . 2.300 2.051 1.949 2.305 0.005 11 0 "[ . 1 . 2]" 2
50 1 70 PHE O 1 74 LEU N 2.700 2.700 3.300 2.966 2.877 3.187 . 0 0 "[ . 1 . 2]" 2
51 1 71 GLU O 1 75 GLU H 1.700 . 2.300 2.043 1.907 2.233 . 0 0 "[ . 1 . 2]" 2
52 1 71 GLU O 1 75 GLU N 2.700 2.700 3.300 2.987 2.869 3.194 . 0 0 "[ . 1 . 2]" 2
53 1 72 ARG O 1 76 THR H 1.700 . 2.300 2.261 2.106 2.393 0.093 14 0 "[ . 1 . 2]" 2
54 1 72 ARG O 1 76 THR N 2.700 2.700 3.300 3.202 3.064 3.320 0.020 14 0 "[ . 1 . 2]" 2
55 1 73 ASN O 1 77 LEU H 1.700 . 2.300 2.003 1.909 2.116 . 0 0 "[ . 1 . 2]" 2
56 1 73 ASN O 1 77 LEU N 2.700 2.700 3.300 2.922 2.832 3.023 . 0 0 "[ . 1 . 2]" 2
57 1 74 LEU O 1 78 GLN H 1.700 . 2.300 2.023 1.912 2.156 . 0 0 "[ . 1 . 2]" 2
58 1 74 LEU O 1 78 GLN N 2.700 2.700 3.300 2.932 2.777 3.104 . 0 0 "[ . 1 . 2]" 2
59 1 75 GLU O 1 79 GLN H 1.700 . 2.300 2.215 1.999 2.368 0.068 16 0 "[ . 1 . 2]" 2
60 1 75 GLU O 1 79 GLN N 2.700 2.700 3.300 3.125 2.967 3.273 . 0 0 "[ . 1 . 2]" 2
61 1 76 THR O 1 80 GLU H 1.700 . 2.300 2.097 1.968 2.295 . 0 0 "[ . 1 . 2]" 2
62 1 76 THR O 1 80 GLU N 2.700 2.700 3.300 2.973 2.855 3.179 . 0 0 "[ . 1 . 2]" 2
63 1 77 LEU O 1 81 LEU H 1.700 . 2.300 2.033 1.902 2.269 . 0 0 "[ . 1 . 2]" 2
64 1 77 LEU O 1 81 LEU N 2.700 2.700 3.300 2.950 2.849 3.123 . 0 0 "[ . 1 . 2]" 2
65 1 84 GLU O 1 87 ASN H 1.700 . 2.300 2.240 2.103 2.378 0.078 10 0 "[ . 1 . 2]" 2
66 1 84 GLU O 1 87 ASN N 2.700 2.700 3.300 3.074 2.800 3.226 . 0 0 "[ . 1 . 2]" 2
67 1 36 LEU O 1 92 VAL H 1.700 . 2.300 1.987 1.917 2.095 . 0 0 "[ . 1 . 2]" 2
68 1 36 LEU O 1 92 VAL N 2.700 2.700 3.300 2.929 2.865 3.023 . 0 0 "[ . 1 . 2]" 2
69 1 38 VAL O 1 94 ILE H 1.700 . 2.300 2.130 1.964 2.317 0.017 16 0 "[ . 1 . 2]" 2
70 1 38 VAL O 1 94 ILE N 2.700 2.700 3.300 3.019 2.857 3.258 . 0 0 "[ . 1 . 2]" 2
stop_
save_
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