NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
441844 |
2kbn   |
16051 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2kbn
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 1434
_Distance_constraint_stats_list.Viol_count 693
_Distance_constraint_stats_list.Viol_total 529.380
_Distance_constraint_stats_list.Viol_max 0.264
_Distance_constraint_stats_list.Viol_rms 0.0084
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0009
_Distance_constraint_stats_list.Viol_average_violations_only 0.0382
_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 3 PRO 0.584 0.183 8 0 "[ . 1 . 2]"
1 4 GLN 0.085 0.060 16 0 "[ . 1 . 2]"
1 5 LEU 0.817 0.183 8 0 "[ . 1 . 2]"
1 6 THR 0.281 0.095 18 0 "[ . 1 . 2]"
1 7 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 ILE 0.281 0.077 6 0 "[ . 1 . 2]"
1 9 VAL 0.275 0.041 14 0 "[ . 1 . 2]"
1 10 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 ILE 0.763 0.144 19 0 "[ . 1 . 2]"
1 12 VAL 0.759 0.187 13 0 "[ . 1 . 2]"
1 13 GLU 0.681 0.079 8 0 "[ . 1 . 2]"
1 14 ASN 0.897 0.148 20 0 "[ . 1 . 2]"
1 15 GLY 0.122 0.038 20 0 "[ . 1 . 2]"
1 16 GLN 0.346 0.079 15 0 "[ . 1 . 2]"
1 17 TRP 0.047 0.030 3 0 "[ . 1 . 2]"
1 18 ALA 0.092 0.079 15 0 "[ . 1 . 2]"
1 19 ASN 0.178 0.067 8 0 "[ . 1 . 2]"
1 20 LEU 0.151 0.030 19 0 "[ . 1 . 2]"
1 21 LYS 0.785 0.073 9 0 "[ . 1 . 2]"
1 22 ALA 0.324 0.074 18 0 "[ . 1 . 2]"
1 23 LYS 0.552 0.075 16 0 "[ . 1 . 2]"
1 24 VAL 0.046 0.046 12 0 "[ . 1 . 2]"
1 25 ILE 0.583 0.147 11 0 "[ . 1 . 2]"
1 26 GLN 0.760 0.091 4 0 "[ . 1 . 2]"
1 27 LEU 1.080 0.258 19 0 "[ . 1 . 2]"
1 28 TRP 0.132 0.052 3 0 "[ . 1 . 2]"
1 29 GLU 0.131 0.045 14 0 "[ . 1 . 2]"
1 30 ASN 0.680 0.067 11 0 "[ . 1 . 2]"
1 31 THR 0.155 0.084 1 0 "[ . 1 . 2]"
1 32 HIS 0.554 0.120 4 0 "[ . 1 . 2]"
1 33 GLU 0.642 0.150 7 0 "[ . 1 . 2]"
1 34 SER 0.029 0.028 16 0 "[ . 1 . 2]"
1 35 ILE 0.657 0.120 4 0 "[ . 1 . 2]"
1 36 SER 0.245 0.056 1 0 "[ . 1 . 2]"
1 37 GLN 0.988 0.088 11 0 "[ . 1 . 2]"
1 38 VAL 0.266 0.062 14 0 "[ . 1 . 2]"
1 39 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 40 LEU 1.540 0.142 20 0 "[ . 1 . 2]"
1 41 LEU 0.204 0.052 11 0 "[ . 1 . 2]"
1 42 GLY 0.214 0.047 13 0 "[ . 1 . 2]"
1 43 ASP 0.573 0.131 6 0 "[ . 1 . 2]"
1 44 GLU 0.144 0.131 6 0 "[ . 1 . 2]"
1 45 THR 0.248 0.041 14 0 "[ . 1 . 2]"
1 46 GLY 0.148 0.050 10 0 "[ . 1 . 2]"
1 47 ILE 0.504 0.119 7 0 "[ . 1 . 2]"
1 48 ILE 0.607 0.229 12 0 "[ . 1 . 2]"
1 49 LYS 1.923 0.229 12 0 "[ . 1 . 2]"
1 50 PHE 0.563 0.088 11 0 "[ . 1 . 2]"
1 51 THR 0.506 0.078 11 0 "[ . 1 . 2]"
1 52 ILE 0.948 0.165 12 0 "[ . 1 . 2]"
1 53 TRP 0.974 0.082 17 0 "[ . 1 . 2]"
1 54 LYS 1.127 0.165 12 0 "[ . 1 . 2]"
1 55 ASN 0.079 0.041 6 0 "[ . 1 . 2]"
1 56 ALA 0.660 0.080 17 0 "[ . 1 . 2]"
1 57 GLU 0.314 0.074 16 0 "[ . 1 . 2]"
1 58 LEU 0.179 0.045 4 0 "[ . 1 . 2]"
1 59 PRO 0.299 0.228 11 0 "[ . 1 . 2]"
1 60 LEU 0.404 0.228 11 0 "[ . 1 . 2]"
1 61 LEU 0.438 0.097 3 0 "[ . 1 . 2]"
1 62 GLU 0.040 0.023 13 0 "[ . 1 . 2]"
1 63 GLN 0.579 0.108 5 0 "[ . 1 . 2]"
1 64 GLY 0.167 0.108 5 0 "[ . 1 . 2]"
1 65 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 66 SER 1.032 0.075 16 0 "[ . 1 . 2]"
1 67 TYR 0.338 0.092 17 0 "[ . 1 . 2]"
1 68 LEU 1.628 0.168 14 0 "[ . 1 . 2]"
1 69 LEU 0.237 0.092 17 0 "[ . 1 . 2]"
1 70 ARG 0.716 0.073 15 0 "[ . 1 . 2]"
1 71 SER 0.140 0.030 19 0 "[ . 1 . 2]"
1 72 VAL 0.214 0.059 1 0 "[ . 1 . 2]"
1 73 VAL 1.024 0.082 17 0 "[ . 1 . 2]"
1 74 VAL 0.296 0.066 10 0 "[ . 1 . 2]"
1 75 GLY 0.089 0.038 20 0 "[ . 1 . 2]"
1 76 GLU 0.005 0.005 5 0 "[ . 1 . 2]"
1 77 TYR 0.644 0.095 7 0 "[ . 1 . 2]"
1 78 ASN 0.109 0.045 18 0 "[ . 1 . 2]"
1 79 ASP 0.109 0.045 18 0 "[ . 1 . 2]"
1 80 ARG 0.479 0.095 7 0 "[ . 1 . 2]"
1 81 PHE 0.183 0.085 10 0 "[ . 1 . 2]"
1 82 GLN 0.402 0.059 3 0 "[ . 1 . 2]"
1 83 VAL 0.400 0.044 3 0 "[ . 1 . 2]"
1 84 GLN 0.752 0.066 10 0 "[ . 1 . 2]"
1 85 VAL 0.022 0.022 15 0 "[ . 1 . 2]"
1 86 ASN 0.226 0.049 5 0 "[ . 1 . 2]"
1 87 LYS 1.609 0.168 14 0 "[ . 1 . 2]"
1 88 ASN 1.412 0.168 14 0 "[ . 1 . 2]"
1 89 SER 0.264 0.045 4 0 "[ . 1 . 2]"
1 90 SER 0.173 0.043 6 0 "[ . 1 . 2]"
1 91 ILE 0.024 0.017 3 0 "[ . 1 . 2]"
1 92 GLU 1.332 0.168 14 0 "[ . 1 . 2]"
1 93 LYS 0.224 0.073 12 0 "[ . 1 . 2]"
1 94 LEU 0.365 0.133 14 0 "[ . 1 . 2]"
1 95 SER 0.149 0.075 3 0 "[ . 1 . 2]"
1 96 GLU 0.105 0.075 3 0 "[ . 1 . 2]"
1 97 PRO 0.044 0.044 16 0 "[ . 1 . 2]"
1 98 ILE 1.951 0.231 11 0 "[ . 1 . 2]"
1 99 GLU 0.958 0.198 3 0 "[ . 1 . 2]"
1 100 VAL 0.497 0.264 3 0 "[ . 1 . 2]"
1 101 GLY 0.137 0.058 3 0 "[ . 1 . 2]"
1 102 LEU 0.277 0.058 3 0 "[ . 1 . 2]"
1 103 GLU 0.007 0.007 16 0 "[ . 1 . 2]"
1 104 HIS 0.004 0.002 2 0 "[ . 1 . 2]"
1 105 HIS 0.004 0.002 2 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 4 GLN H 1 5 LEU H 1.800 . 4.810 4.027 3.690 4.185 . 0 0 "[ . 1 . 2]" 1
2 1 5 LEU H 1 6 THR H 1.800 . 5.140 4.613 4.548 4.650 . 0 0 "[ . 1 . 2]" 1
3 1 6 THR H 1 7 LYS H 1.800 . 5.120 4.360 4.303 4.398 . 0 0 "[ . 1 . 2]" 1
4 1 7 LYS H 1 8 ILE H 1.800 . 5.080 4.627 4.571 4.661 . 0 0 "[ . 1 . 2]" 1
5 1 8 ILE H 1 9 VAL H 1.800 . 4.310 2.704 2.665 2.734 . 0 0 "[ . 1 . 2]" 1
6 1 9 VAL H 1 10 ASP H 1.800 . 3.770 2.610 2.571 2.641 . 0 0 "[ . 1 . 2]" 1
7 1 11 ILE H 1 12 VAL H 1.800 . 5.170 4.419 4.179 4.543 . 0 0 "[ . 1 . 2]" 1
8 1 12 VAL H 1 13 GLU H 1.800 . 5.030 1.798 1.721 2.019 0.079 8 0 "[ . 1 . 2]" 1
9 1 13 GLU H 1 14 ASN H 1.800 . 4.990 4.383 4.300 4.464 . 0 0 "[ . 1 . 2]" 1
10 1 15 GLY H 1 16 GLN H 1.800 . 4.110 2.770 2.343 3.787 . 0 0 "[ . 1 . 2]" 1
11 1 17 TRP H 1 18 ALA H 1.800 . 4.840 4.514 4.227 4.576 . 0 0 "[ . 1 . 2]" 1
12 1 18 ALA H 1 19 ASN H 1.800 . 4.890 4.384 4.361 4.403 . 0 0 "[ . 1 . 2]" 1
13 1 19 ASN H 1 20 LEU H 1.800 . 5.070 4.562 4.536 4.605 . 0 0 "[ . 1 . 2]" 1
14 1 20 LEU H 1 21 LYS H 1.800 . 4.890 4.297 4.145 4.438 . 0 0 "[ . 1 . 2]" 1
15 1 21 LYS H 1 22 ALA H 1.800 . 4.710 4.444 4.365 4.518 . 0 0 "[ . 1 . 2]" 1
16 1 25 ILE H 1 26 GLN H 1.800 . 3.290 2.356 1.820 2.683 . 0 0 "[ . 1 . 2]" 1
17 1 26 GLN H 1 27 LEU H 1.800 . 4.850 4.301 4.141 4.370 . 0 0 "[ . 1 . 2]" 1
18 1 27 LEU H 1 28 TRP H 1.800 . 4.860 4.365 4.291 4.495 . 0 0 "[ . 1 . 2]" 1
19 1 29 GLU H 1 30 ASN H 1.800 . 5.900 4.610 4.437 4.695 . 0 0 "[ . 1 . 2]" 1
20 1 30 ASN H 1 31 THR H 1.800 . 5.800 3.843 1.887 4.613 . 0 0 "[ . 1 . 2]" 1
21 1 31 THR H 1 32 HIS H 1.800 . 4.170 2.630 1.869 4.009 . 0 0 "[ . 1 . 2]" 1
22 1 32 HIS H 1 33 GLU H 1.800 . 5.220 3.999 2.472 4.625 . 0 0 "[ . 1 . 2]" 1
23 1 34 SER H 1 35 ILE H 1.800 . 4.210 2.629 1.799 3.431 0.001 20 0 "[ . 1 . 2]" 1
24 1 35 ILE H 1 36 SER H 1.800 . 5.440 4.430 4.302 4.602 . 0 0 "[ . 1 . 2]" 1
25 1 36 SER H 1 37 GLN H 1.800 . 3.540 2.763 2.487 2.991 . 0 0 "[ . 1 . 2]" 1
26 1 37 GLN H 1 38 VAL H 1.800 . 4.830 4.420 4.351 4.468 . 0 0 "[ . 1 . 2]" 1
27 1 38 VAL H 1 39 GLY H 1.800 . 5.040 4.384 4.338 4.479 . 0 0 "[ . 1 . 2]" 1
28 1 39 GLY H 1 40 LEU H 1.800 . 4.890 4.302 4.187 4.385 . 0 0 "[ . 1 . 2]" 1
29 1 40 LEU H 1 41 LEU H 1.800 . 5.950 4.442 4.405 4.483 . 0 0 "[ . 1 . 2]" 1
30 1 41 LEU H 1 42 GLY H 1.800 . 5.030 4.437 4.345 4.555 . 0 0 "[ . 1 . 2]" 1
31 1 42 GLY H 1 43 ASP H 1.800 . 4.710 4.591 4.290 4.649 . 0 0 "[ . 1 . 2]" 1
32 1 43 ASP H 1 44 GLU H 1.800 . 5.320 4.195 2.420 4.415 . 0 0 "[ . 1 . 2]" 1
33 1 44 GLU H 1 45 THR H 1.800 . 4.200 2.716 2.470 3.338 . 0 0 "[ . 1 . 2]" 1
34 1 45 THR H 1 46 GLY H 1.800 . 3.030 2.347 2.229 2.888 . 0 0 "[ . 1 . 2]" 1
35 1 46 GLY H 1 47 ILE H 1.800 . 4.960 4.451 4.270 4.540 . 0 0 "[ . 1 . 2]" 1
36 1 47 ILE H 1 48 ILE H 1.800 . 5.280 4.448 4.375 4.505 . 0 0 "[ . 1 . 2]" 1
37 1 48 ILE H 1 49 LYS H 1.800 . 6.050 4.394 4.329 4.482 . 0 0 "[ . 1 . 2]" 1
38 1 49 LYS H 1 50 PHE H 1.800 . 5.280 4.634 4.589 4.662 . 0 0 "[ . 1 . 2]" 1
39 1 50 PHE H 1 51 THR H 1.800 . 5.020 4.408 4.365 4.437 . 0 0 "[ . 1 . 2]" 1
40 1 51 THR H 1 52 ILE H 1.800 . 5.070 4.335 4.271 4.421 . 0 0 "[ . 1 . 2]" 1
41 1 52 ILE H 1 53 TRP H 1.800 . 5.270 4.431 4.340 4.500 . 0 0 "[ . 1 . 2]" 1
42 1 53 TRP H 1 54 LYS H 1.800 . 5.020 4.535 4.312 4.602 . 0 0 "[ . 1 . 2]" 1
43 1 54 LYS H 1 55 ASN H 1.800 . 5.020 2.793 2.398 3.489 . 0 0 "[ . 1 . 2]" 1
44 1 55 ASN H 1 56 ALA H 1.800 . 4.170 2.676 2.467 3.054 . 0 0 "[ . 1 . 2]" 1
45 1 56 ALA H 1 57 GLU H 1.800 . 4.020 2.556 1.823 3.078 . 0 0 "[ . 1 . 2]" 1
46 1 60 LEU H 1 61 LEU H 1.800 . 5.140 4.618 4.365 4.670 . 0 0 "[ . 1 . 2]" 1
47 1 61 LEU H 1 62 GLU H 1.800 . 5.210 4.615 4.541 4.649 . 0 0 "[ . 1 . 2]" 1
48 1 62 GLU H 1 63 GLN H 1.800 . 5.070 4.576 4.437 4.644 . 0 0 "[ . 1 . 2]" 1
49 1 63 GLN H 1 64 GLY H 1.800 . 5.170 4.602 4.504 4.663 . 0 0 "[ . 1 . 2]" 1
50 1 64 GLY H 1 65 GLU H 1.800 . 3.580 2.434 2.178 2.632 . 0 0 "[ . 1 . 2]" 1
51 1 65 GLU H 1 66 SER H 1.800 . 4.820 4.467 4.375 4.582 . 0 0 "[ . 1 . 2]" 1
52 1 66 SER H 1 67 TYR H 1.800 . 5.150 4.615 4.538 4.645 . 0 0 "[ . 1 . 2]" 1
53 1 67 TYR H 1 68 LEU H 1.800 . 4.970 4.382 4.334 4.457 . 0 0 "[ . 1 . 2]" 1
54 1 69 LEU H 1 70 ARG H 1.800 . 5.080 4.487 4.306 4.614 . 0 0 "[ . 1 . 2]" 1
55 1 72 VAL H 1 73 VAL H 1.800 . 5.050 4.522 4.441 4.588 . 0 0 "[ . 1 . 2]" 1
56 1 73 VAL H 1 74 VAL H 1.800 . 5.240 4.448 4.417 4.542 . 0 0 "[ . 1 . 2]" 1
57 1 75 GLY H 1 76 GLU H 1.800 . 4.860 4.558 4.459 4.619 . 0 0 "[ . 1 . 2]" 1
58 1 77 TYR H 1 78 ASN H 1.800 . 5.200 4.033 3.467 4.559 . 0 0 "[ . 1 . 2]" 1
59 1 78 ASN H 1 79 ASP H 1.800 . 4.980 3.859 2.754 4.654 . 0 0 "[ . 1 . 2]" 1
60 1 79 ASP H 1 80 ARG H 1.800 . 3.670 2.635 1.863 3.457 . 0 0 "[ . 1 . 2]" 1
61 1 80 ARG H 1 81 PHE H 1.800 . 5.170 4.435 3.873 4.637 . 0 0 "[ . 1 . 2]" 1
62 1 81 PHE H 1 82 GLN H 1.800 . 5.890 4.524 4.443 4.633 . 0 0 "[ . 1 . 2]" 1
63 1 84 GLN H 1 85 VAL H 1.800 . 5.150 4.422 4.339 4.528 . 0 0 "[ . 1 . 2]" 1
64 1 86 ASN H 1 87 LYS H 1.800 . 5.160 4.396 4.323 4.468 . 0 0 "[ . 1 . 2]" 1
65 1 88 ASN H 1 89 SER H 1.800 . 3.180 2.740 2.270 3.073 . 0 0 "[ . 1 . 2]" 1
66 1 90 SER H 1 91 ILE H 1.800 . 5.060 4.491 4.405 4.649 . 0 0 "[ . 1 . 2]" 1
67 1 92 GLU H 1 93 LYS H 1.800 . 4.940 4.365 4.241 4.486 . 0 0 "[ . 1 . 2]" 1
68 1 93 LYS H 1 94 LEU H 1.800 . 5.140 4.549 4.457 4.598 . 0 0 "[ . 1 . 2]" 1
69 1 94 LEU H 1 95 SER H 1.800 . 5.190 4.500 4.443 4.544 . 0 0 "[ . 1 . 2]" 1
70 1 95 SER H 1 96 GLU H 1.800 . 3.430 2.534 2.395 2.991 . 0 0 "[ . 1 . 2]" 1
71 1 98 ILE H 1 99 GLU H 1.800 . 4.980 4.285 2.467 4.629 . 0 0 "[ . 1 . 2]" 1
72 1 99 GLU H 1 100 VAL H 1.800 . 5.680 4.342 3.195 4.636 . 0 0 "[ . 1 . 2]" 1
73 1 100 VAL H 1 101 GLY H 1.800 . 4.210 2.301 1.987 3.498 . 0 0 "[ . 1 . 2]" 1
74 1 101 GLY H 1 102 LEU H 1.800 . 4.320 3.098 1.776 4.378 0.058 3 0 "[ . 1 . 2]" 1
75 1 102 LEU H 1 103 GLU H 1.800 . 4.070 2.458 2.295 2.933 . 0 0 "[ . 1 . 2]" 1
76 1 103 GLU H 1 104 HIS H 1.800 . 5.060 3.741 2.500 4.663 . 0 0 "[ . 1 . 2]" 1
77 1 8 ILE H 1 10 ASP H 1.800 . 5.280 3.927 3.884 3.981 . 0 0 "[ . 1 . 2]" 1
78 1 9 VAL H 1 11 ILE H 1.800 . 5.160 4.102 3.995 4.225 . 0 0 "[ . 1 . 2]" 1
79 1 33 GLU H 1 35 ILE H 1.800 . 5.080 3.873 2.261 4.747 . 0 0 "[ . 1 . 2]" 1
80 1 43 ASP H 1 45 THR H 1.800 . 4.940 4.488 3.620 4.718 . 0 0 "[ . 1 . 2]" 1
81 1 44 GLU H 1 46 GLY H 1.800 . 5.590 4.108 3.651 4.204 . 0 0 "[ . 1 . 2]" 1
82 1 55 ASN H 1 57 GLU H 1.800 . 5.200 4.263 3.746 5.177 . 0 0 "[ . 1 . 2]" 1
83 1 63 GLN H 1 65 GLU H 1.800 . 5.730 5.037 4.455 5.470 . 0 0 "[ . 1 . 2]" 1
84 1 3 PRO HA 1 4 GLN H 1.800 . 3.040 2.263 2.227 2.303 . 0 0 "[ . 1 . 2]" 1
85 1 4 GLN HA 1 5 LEU H 1.800 . 3.110 2.317 2.261 2.482 . 0 0 "[ . 1 . 2]" 1
86 1 5 LEU HA 1 6 THR H 1.800 . 3.230 2.212 2.137 2.269 . 0 0 "[ . 1 . 2]" 1
87 1 6 THR HA 1 7 LYS H 1.800 . 3.150 2.172 2.127 2.317 . 0 0 "[ . 1 . 2]" 1
88 1 7 LYS HA 1 8 ILE H 1.800 . 3.770 2.313 2.253 2.385 . 0 0 "[ . 1 . 2]" 1
89 1 11 ILE HA 1 12 VAL H 1.800 . 3.520 2.167 2.135 2.257 . 0 0 "[ . 1 . 2]" 1
90 1 13 GLU HA 1 14 ASN H 1.800 . 3.150 2.208 2.152 2.274 . 0 0 "[ . 1 . 2]" 1
91 1 14 ASN HA 1 15 GLY H 1.800 . 3.310 2.320 2.188 2.450 . 0 0 "[ . 1 . 2]" 1
92 1 16 GLN HA 1 17 TRP H 1.800 . 3.730 2.188 2.131 2.253 . 0 0 "[ . 1 . 2]" 1
93 1 17 TRP HA 1 18 ALA H 1.800 . 3.200 2.202 2.149 2.245 . 0 0 "[ . 1 . 2]" 1
94 1 18 ALA HA 1 19 ASN H 1.800 . 3.080 2.600 2.485 2.734 . 0 0 "[ . 1 . 2]" 1
95 1 19 ASN HA 1 20 LEU H 1.800 . 3.180 2.272 2.209 2.337 . 0 0 "[ . 1 . 2]" 1
96 1 20 LEU HA 1 21 LYS H 1.800 . 3.080 2.180 2.125 2.252 . 0 0 "[ . 1 . 2]" 1
97 1 21 LYS HA 1 22 ALA H 1.800 . 2.960 2.218 2.145 2.266 . 0 0 "[ . 1 . 2]" 1
98 1 22 ALA HA 1 23 LYS H 1.800 . 3.220 2.557 2.437 2.692 . 0 0 "[ . 1 . 2]" 1
99 1 23 LYS HA 1 24 VAL H 1.800 . 3.530 2.221 2.188 2.299 . 0 0 "[ . 1 . 2]" 1
100 1 24 VAL HA 1 25 ILE H 1.800 . 3.330 2.172 2.126 2.292 . 0 0 "[ . 1 . 2]" 1
101 1 26 GLN HA 1 27 LEU H 1.800 . 2.960 2.213 2.127 2.293 . 0 0 "[ . 1 . 2]" 1
102 1 27 LEU HA 1 28 TRP H 1.800 . 3.630 2.212 2.181 2.289 . 0 0 "[ . 1 . 2]" 1
103 1 28 TRP HA 1 29 GLU H 1.800 . 3.180 2.185 2.116 2.244 . 0 0 "[ . 1 . 2]" 1
104 1 29 GLU HA 1 30 ASN H 1.800 . 3.040 2.215 2.110 2.322 . 0 0 "[ . 1 . 2]" 1
105 1 32 HIS HA 1 33 GLU H 1.800 . 3.530 2.601 2.153 3.575 0.045 9 0 "[ . 1 . 2]" 1
106 1 35 ILE HA 1 36 SER H 1.800 . 3.430 2.158 2.121 2.199 . 0 0 "[ . 1 . 2]" 1
107 1 37 GLN HA 1 38 VAL H 1.800 . 3.040 2.308 2.208 2.383 . 0 0 "[ . 1 . 2]" 1
108 1 38 VAL HA 1 39 GLY H 1.800 . 3.060 2.253 2.179 2.378 . 0 0 "[ . 1 . 2]" 1
109 1 40 LEU HA 1 41 LEU H 1.800 . 3.450 2.260 2.202 2.386 . 0 0 "[ . 1 . 2]" 1
110 1 41 LEU HA 1 42 GLY H 1.800 . 3.380 2.174 2.108 2.370 . 0 0 "[ . 1 . 2]" 1
111 1 42 GLY HA3 1 43 ASP H 1.800 . 3.700 2.918 2.768 3.188 . 0 0 "[ . 1 . 2]" 1
112 1 42 GLY HA2 1 43 ASP H 1.800 . 3.740 2.300 2.157 2.418 . 0 0 "[ . 1 . 2]" 1
113 1 46 GLY QA 1 47 ILE H 1.800 . 3.100 2.217 2.120 2.286 . 0 0 "[ . 1 . 2]" 1
114 1 47 ILE HA 1 48 ILE H 1.800 . 3.500 2.260 2.145 2.358 . 0 0 "[ . 1 . 2]" 1
115 1 48 ILE HA 1 49 LYS H 1.800 . 3.490 2.227 2.178 2.285 . 0 0 "[ . 1 . 2]" 1
116 1 49 LYS HA 1 50 PHE H 1.800 . 3.260 2.312 2.253 2.372 . 0 0 "[ . 1 . 2]" 1
117 1 50 PHE HA 1 51 THR H 1.800 . 3.420 2.305 2.245 2.407 . 0 0 "[ . 1 . 2]" 1
118 1 51 THR HA 1 52 ILE H 1.800 . 3.320 2.201 2.127 2.288 . 0 0 "[ . 1 . 2]" 1
119 1 52 ILE HA 1 53 TRP H 1.800 . 3.420 2.158 2.125 2.187 . 0 0 "[ . 1 . 2]" 1
120 1 53 TRP HA 1 54 LYS H 1.800 . 3.750 2.211 2.152 2.276 . 0 0 "[ . 1 . 2]" 1
121 1 54 LYS HA 1 55 ASN H 1.800 . 3.750 3.223 2.648 3.535 . 0 0 "[ . 1 . 2]" 1
122 1 57 GLU HA 1 58 LEU H 1.800 . 3.720 2.578 2.182 2.853 . 0 0 "[ . 1 . 2]" 1
123 1 59 PRO HA 1 60 LEU H 1.800 . 2.780 2.347 2.233 3.008 0.228 11 0 "[ . 1 . 2]" 1
124 1 60 LEU HA 1 61 LEU H 1.800 . 3.260 2.217 2.184 2.289 . 0 0 "[ . 1 . 2]" 1
125 1 61 LEU HA 1 62 GLU H 1.800 . 3.340 2.245 2.153 2.297 . 0 0 "[ . 1 . 2]" 1
126 1 62 GLU HA 1 63 GLN H 1.800 . 2.970 2.229 2.153 2.292 . 0 0 "[ . 1 . 2]" 1
127 1 63 GLN HA 1 64 GLY H 1.800 . 3.120 2.199 2.132 2.246 . 0 0 "[ . 1 . 2]" 1
128 1 65 GLU HA 1 66 SER H 1.800 . 3.220 2.232 2.199 2.298 . 0 0 "[ . 1 . 2]" 1
129 1 66 SER HA 1 67 TYR H 1.800 . 3.290 2.264 2.189 2.334 . 0 0 "[ . 1 . 2]" 1
130 1 67 TYR HA 1 68 LEU H 1.800 . 3.330 2.221 2.167 2.253 . 0 0 "[ . 1 . 2]" 1
131 1 68 LEU HA 1 69 LEU H 1.800 . 3.250 2.165 2.127 2.203 . 0 0 "[ . 1 . 2]" 1
132 1 69 LEU HA 1 70 ARG H 1.800 . 3.130 2.185 2.141 2.217 . 0 0 "[ . 1 . 2]" 1
133 1 70 ARG HA 1 71 SER H 1.800 . 3.410 2.179 2.108 2.234 . 0 0 "[ . 1 . 2]" 1
134 1 71 SER HA 1 72 VAL H 1.800 . 3.410 2.595 2.336 2.792 . 0 0 "[ . 1 . 2]" 1
135 1 72 VAL HA 1 73 VAL H 1.800 . 3.280 2.358 2.165 2.405 . 0 0 "[ . 1 . 2]" 1
136 1 73 VAL HA 1 74 VAL H 1.800 . 3.440 2.189 2.142 2.233 . 0 0 "[ . 1 . 2]" 1
137 1 74 VAL HA 1 75 GLY H 1.800 . 3.360 2.158 2.108 2.194 . 0 0 "[ . 1 . 2]" 1
138 1 75 GLY HA3 1 76 GLU H 1.800 . 3.450 2.710 2.505 3.019 . 0 0 "[ . 1 . 2]" 1
139 1 75 GLY HA2 1 76 GLU H 1.800 . 3.420 2.472 2.209 2.680 . 0 0 "[ . 1 . 2]" 1
140 1 76 GLU HA 1 77 TYR H 1.800 . 3.330 2.174 2.116 2.221 . 0 0 "[ . 1 . 2]" 1
141 1 77 TYR HA 1 78 ASN H 1.800 . 3.440 2.219 2.117 2.371 . 0 0 "[ . 1 . 2]" 1
142 1 80 ARG HA 1 81 PHE H 1.800 . 3.600 2.617 2.235 3.178 . 0 0 "[ . 1 . 2]" 1
143 1 81 PHE HA 1 82 GLN H 1.800 . 3.560 2.279 2.149 2.417 . 0 0 "[ . 1 . 2]" 1
144 1 82 GLN HA 1 83 VAL H 1.800 . 3.340 2.357 2.171 2.539 . 0 0 "[ . 1 . 2]" 1
145 1 83 VAL HA 1 84 GLN H 1.800 . 3.320 2.173 2.132 2.234 . 0 0 "[ . 1 . 2]" 1
146 1 84 GLN HA 1 85 VAL H 1.800 . 3.210 2.161 2.094 2.193 . 0 0 "[ . 1 . 2]" 1
147 1 85 VAL HA 1 86 ASN H 1.800 . 3.260 2.189 2.126 2.246 . 0 0 "[ . 1 . 2]" 1
148 1 86 ASN HA 1 87 LYS H 1.800 . 3.740 2.590 2.468 2.724 . 0 0 "[ . 1 . 2]" 1
149 1 89 SER HA 1 90 SER H 1.800 . 3.290 2.278 2.156 2.413 . 0 0 "[ . 1 . 2]" 1
150 1 90 SER HA 1 91 ILE H 1.800 . 2.980 2.275 2.195 2.358 . 0 0 "[ . 1 . 2]" 1
151 1 91 ILE HA 1 92 GLU H 1.800 . 3.070 2.185 2.140 2.207 . 0 0 "[ . 1 . 2]" 1
152 1 92 GLU HA 1 93 LYS H 1.800 . 2.870 2.179 2.117 2.240 . 0 0 "[ . 1 . 2]" 1
153 1 93 LYS HA 1 94 LEU H 1.800 . 3.650 2.177 2.135 2.209 . 0 0 "[ . 1 . 2]" 1
154 1 94 LEU HA 1 95 SER H 1.800 . 3.260 2.167 2.142 2.192 . 0 0 "[ . 1 . 2]" 1
155 1 95 SER HA 1 96 GLU H 1.800 . 3.880 3.264 2.961 3.359 . 0 0 "[ . 1 . 2]" 1
156 1 97 PRO HA 1 98 ILE H 1.800 . 3.120 2.300 2.250 2.419 . 0 0 "[ . 1 . 2]" 1
157 1 98 ILE HA 1 99 GLU H 1.800 . 3.040 2.269 2.119 3.230 0.190 17 0 "[ . 1 . 2]" 1
158 1 100 VAL HA 1 101 GLY H 1.800 . 3.870 3.256 2.639 3.555 . 0 0 "[ . 1 . 2]" 1
159 1 7 LYS HA 1 9 VAL H 1.800 . 4.910 4.352 4.264 4.449 . 0 0 "[ . 1 . 2]" 1
160 1 8 ILE HA 1 10 ASP H 1.800 . 4.790 3.969 3.870 4.041 . 0 0 "[ . 1 . 2]" 1
161 1 9 VAL HA 1 11 ILE H 1.800 . 4.810 3.562 3.420 4.115 . 0 0 "[ . 1 . 2]" 1
162 1 11 ILE HA 1 13 GLU H 1.800 . 4.470 3.436 3.247 3.798 . 0 0 "[ . 1 . 2]" 1
163 1 24 VAL HA 1 26 GLN H 1.800 . 4.750 4.056 3.590 4.545 . 0 0 "[ . 1 . 2]" 1
164 1 35 ILE HA 1 37 GLN H 1.800 . 4.810 4.543 4.044 4.839 0.029 19 0 "[ . 1 . 2]" 1
165 1 54 LYS HA 1 56 ALA H 1.800 . 5.030 3.651 2.851 4.167 . 0 0 "[ . 1 . 2]" 1
166 1 63 GLN HA 1 65 GLU H 1.800 . 4.070 3.456 3.255 3.770 . 0 0 "[ . 1 . 2]" 1
167 1 94 LEU HA 1 96 GLU H 1.800 . 4.610 3.552 3.449 3.708 . 0 0 "[ . 1 . 2]" 1
168 1 99 GLU HA 1 101 GLY H 1.800 . 4.820 3.586 3.323 4.397 . 0 0 "[ . 1 . 2]" 1
169 1 8 ILE HA 1 11 ILE H 1.800 . 4.580 3.672 3.336 3.849 . 0 0 "[ . 1 . 2]" 1
170 1 54 LYS HA 1 57 GLU H 1.800 . 4.580 3.533 2.949 4.654 0.074 16 0 "[ . 1 . 2]" 1
171 1 54 LYS HA 1 58 LEU H 1.800 . 5.080 4.115 3.270 5.085 0.005 1 0 "[ . 1 . 2]" 1
172 1 4 GLN QB 1 5 LEU H 1.800 . 4.460 3.850 3.753 4.047 . 0 0 "[ . 1 . 2]" 1
173 1 5 LEU QB 1 6 THR H 1.800 . 4.070 2.996 2.731 3.275 . 0 0 "[ . 1 . 2]" 1
174 1 6 THR HB 1 7 LYS H 1.800 . 4.830 4.163 4.031 4.208 . 0 0 "[ . 1 . 2]" 1
175 1 7 LYS HB3 1 8 ILE H 1.800 . 4.760 2.723 2.587 2.904 . 0 0 "[ . 1 . 2]" 1
176 1 7 LYS HB2 1 8 ILE H 1.800 . 4.760 3.859 3.704 4.110 . 0 0 "[ . 1 . 2]" 1
177 1 8 ILE HB 1 9 VAL H 1.800 . 4.200 2.537 2.483 2.591 . 0 0 "[ . 1 . 2]" 1
178 1 9 VAL HB 1 10 ASP H 1.800 . 5.170 4.061 3.988 4.165 . 0 0 "[ . 1 . 2]" 1
179 1 10 ASP HB3 1 11 ILE H 1.800 . 4.840 3.752 2.746 4.200 . 0 0 "[ . 1 . 2]" 1
180 1 10 ASP HB2 1 11 ILE H 1.800 . 4.840 3.822 3.120 4.303 . 0 0 "[ . 1 . 2]" 1
181 1 12 VAL HB 1 13 GLU H 1.800 . 4.650 4.216 3.689 4.424 . 0 0 "[ . 1 . 2]" 1
182 1 13 GLU HB3 1 14 ASN H 1.800 . 4.870 3.535 2.744 4.106 . 0 0 "[ . 1 . 2]" 1
183 1 13 GLU HB2 1 14 ASN H 1.800 . 4.870 3.912 2.944 4.283 . 0 0 "[ . 1 . 2]" 1
184 1 14 ASN HB2 1 15 GLY H 1.800 . 4.590 3.078 2.396 4.177 . 0 0 "[ . 1 . 2]" 1
185 1 16 GLN HB3 1 17 TRP H 1.800 . 5.600 4.077 3.266 4.217 . 0 0 "[ . 1 . 2]" 1
186 1 16 GLN HB2 1 17 TRP H 1.800 . 5.600 4.031 2.919 4.302 . 0 0 "[ . 1 . 2]" 1
187 1 17 TRP HB3 1 18 ALA H 1.800 . 5.350 3.248 3.082 3.814 . 0 0 "[ . 1 . 2]" 1
188 1 17 TRP HB2 1 18 ALA H 1.800 . 5.350 4.203 3.963 4.480 . 0 0 "[ . 1 . 2]" 1
189 1 18 ALA MB 1 19 ASN H 1.800 . 3.310 2.071 1.875 2.267 . 0 0 "[ . 1 . 2]" 1
190 1 19 ASN HB3 1 20 LEU H 1.800 . 4.760 3.067 2.750 4.097 . 0 0 "[ . 1 . 2]" 1
191 1 19 ASN HB2 1 20 LEU H 1.800 . 4.760 3.946 3.842 4.080 . 0 0 "[ . 1 . 2]" 1
192 1 20 LEU HB3 1 21 LYS H 1.800 . 4.690 3.981 2.798 4.185 . 0 0 "[ . 1 . 2]" 1
193 1 20 LEU HB2 1 21 LYS H 1.800 . 4.870 4.211 3.894 4.530 . 0 0 "[ . 1 . 2]" 1
194 1 22 ALA MB 1 23 LYS H 1.800 . 3.550 2.116 1.859 2.351 . 0 0 "[ . 1 . 2]" 1
195 1 25 ILE HB 1 26 GLN H 1.800 . 3.790 2.530 2.034 3.823 0.033 10 0 "[ . 1 . 2]" 1
196 1 26 GLN QB 1 27 LEU H 1.800 . 4.110 3.393 2.796 3.773 . 0 0 "[ . 1 . 2]" 1
197 1 27 LEU HB3 1 28 TRP H 1.800 . 5.440 3.966 2.964 4.319 . 0 0 "[ . 1 . 2]" 1
198 1 27 LEU HB2 1 28 TRP H 1.800 . 4.720 3.223 2.879 4.150 . 0 0 "[ . 1 . 2]" 1
199 1 28 TRP HB3 1 29 GLU H 1.800 . 4.330 3.527 2.825 4.274 . 0 0 "[ . 1 . 2]" 1
200 1 28 TRP HB2 1 29 GLU H 1.800 . 4.920 4.199 3.732 4.572 . 0 0 "[ . 1 . 2]" 1
201 1 29 GLU QB 1 30 ASN H 1.800 . 3.800 3.247 2.760 3.819 0.019 16 0 "[ . 1 . 2]" 1
202 1 31 THR HB 1 32 HIS H 1.800 . 4.680 4.069 2.630 4.652 . 0 0 "[ . 1 . 2]" 1
203 1 34 SER HB3 1 35 ILE H 1.800 . 5.130 3.412 2.239 4.399 . 0 0 "[ . 1 . 2]" 1
204 1 34 SER HB2 1 35 ILE H 1.800 . 5.130 3.696 2.678 4.483 . 0 0 "[ . 1 . 2]" 1
205 1 36 SER QB 1 37 GLN H 1.800 . 3.440 2.026 1.780 2.338 0.020 6 0 "[ . 1 . 2]" 1
206 1 37 GLN QB 1 38 VAL H 1.800 . 4.040 2.882 2.483 3.529 . 0 0 "[ . 1 . 2]" 1
207 1 38 VAL HB 1 39 GLY H 1.800 . 4.420 3.685 2.589 4.251 . 0 0 "[ . 1 . 2]" 1
208 1 40 LEU HB3 1 41 LEU H 1.800 . 4.640 3.895 3.414 4.155 . 0 0 "[ . 1 . 2]" 1
209 1 40 LEU HB2 1 41 LEU H 1.800 . 4.250 2.861 2.567 3.074 . 0 0 "[ . 1 . 2]" 1
210 1 41 LEU HB3 1 42 GLY H 1.800 . 4.110 3.202 2.588 3.384 . 0 0 "[ . 1 . 2]" 1
211 1 41 LEU HB2 1 42 GLY H 1.800 . 4.360 4.033 3.565 4.166 . 0 0 "[ . 1 . 2]" 1
212 1 43 ASP HB3 1 44 GLU H 1.800 . 4.410 3.671 2.584 4.103 . 0 0 "[ . 1 . 2]" 1
213 1 43 ASP HB2 1 44 GLU H 1.800 . 4.410 3.883 1.920 4.541 0.131 6 0 "[ . 1 . 2]" 1
214 1 44 GLU HB3 1 45 THR H 1.800 . 5.210 3.716 3.042 4.220 . 0 0 "[ . 1 . 2]" 1
215 1 44 GLU HB2 1 45 THR H 1.800 . 5.210 3.687 2.733 4.199 . 0 0 "[ . 1 . 2]" 1
216 1 45 THR HB 1 46 GLY H 1.800 . 4.490 4.243 4.073 4.380 . 0 0 "[ . 1 . 2]" 1
217 1 47 ILE HB 1 48 ILE H 1.800 . 4.460 3.386 2.610 4.176 . 0 0 "[ . 1 . 2]" 1
218 1 48 ILE HB 1 49 LYS H 1.800 . 5.120 4.098 3.976 4.316 . 0 0 "[ . 1 . 2]" 1
219 1 50 PHE HB3 1 51 THR H 1.800 . 4.320 4.020 3.888 4.155 . 0 0 "[ . 1 . 2]" 1
220 1 50 PHE HB2 1 51 THR H 1.800 . 4.260 2.740 2.506 2.930 . 0 0 "[ . 1 . 2]" 1
221 1 51 THR HB 1 52 ILE H 1.800 . 4.750 4.126 3.959 4.264 . 0 0 "[ . 1 . 2]" 1
222 1 53 TRP HB3 1 54 LYS H 1.800 . 4.540 3.186 2.909 3.803 . 0 0 "[ . 1 . 2]" 1
223 1 53 TRP HB2 1 54 LYS H 1.800 . 4.810 4.137 3.816 4.483 . 0 0 "[ . 1 . 2]" 1
224 1 55 ASN HB3 1 56 ALA H 1.800 . 5.200 3.604 2.559 4.413 . 0 0 "[ . 1 . 2]" 1
225 1 55 ASN HB2 1 56 ALA H 1.800 . 5.200 3.392 2.628 4.303 . 0 0 "[ . 1 . 2]" 1
226 1 56 ALA MB 1 57 GLU H 1.800 . 3.640 2.615 1.782 3.133 0.018 4 0 "[ . 1 . 2]" 1
227 1 57 GLU QB 1 58 LEU H 1.800 . 4.100 3.888 3.456 3.959 . 0 0 "[ . 1 . 2]" 1
228 1 59 PRO QB 1 60 LEU H 1.800 . 3.820 2.916 2.610 3.891 0.071 11 0 "[ . 1 . 2]" 1
229 1 60 LEU HB3 1 61 LEU H 1.800 . 3.940 2.976 2.695 3.115 . 0 0 "[ . 1 . 2]" 1
230 1 60 LEU HB2 1 61 LEU H 1.800 . 4.600 3.933 3.750 4.040 . 0 0 "[ . 1 . 2]" 1
231 1 61 LEU HB3 1 62 GLU H 1.800 . 4.040 2.994 2.829 3.182 . 0 0 "[ . 1 . 2]" 1
232 1 61 LEU HB2 1 62 GLU H 1.800 . 4.690 4.140 3.997 4.256 . 0 0 "[ . 1 . 2]" 1
233 1 62 GLU HB3 1 63 GLN H 1.800 . 5.060 3.284 2.641 4.245 . 0 0 "[ . 1 . 2]" 1
234 1 62 GLU HB2 1 63 GLN H 1.800 . 5.060 4.056 3.808 4.419 . 0 0 "[ . 1 . 2]" 1
235 1 63 GLN QB 1 64 GLY H 1.800 . 4.550 3.590 2.960 3.776 . 0 0 "[ . 1 . 2]" 1
236 1 65 GLU HB3 1 66 SER H 1.800 . 3.730 2.856 2.655 2.951 . 0 0 "[ . 1 . 2]" 1
237 1 66 SER QB 1 67 TYR H 1.800 . 4.100 2.908 2.616 3.579 . 0 0 "[ . 1 . 2]" 1
238 1 67 TYR HB3 1 68 LEU H 1.800 . 4.280 2.896 2.703 3.052 . 0 0 "[ . 1 . 2]" 1
239 1 67 TYR HB2 1 68 LEU H 1.800 . 4.580 4.030 3.843 4.190 . 0 0 "[ . 1 . 2]" 1
240 1 68 LEU HB3 1 69 LEU H 1.800 . 5.630 4.362 4.058 4.508 . 0 0 "[ . 1 . 2]" 1
241 1 68 LEU HB2 1 69 LEU H 1.800 . 5.370 4.296 4.221 4.495 . 0 0 "[ . 1 . 2]" 1
242 1 69 LEU HB3 1 70 ARG H 1.800 . 4.810 3.306 3.048 3.703 . 0 0 "[ . 1 . 2]" 1
243 1 70 ARG QB 1 71 SER H 1.800 . 4.190 2.956 2.749 3.250 . 0 0 "[ . 1 . 2]" 1
244 1 71 SER HB3 1 72 VAL H 1.800 . 5.760 4.490 4.191 4.689 . 0 0 "[ . 1 . 2]" 1
245 1 71 SER HB2 1 72 VAL H 1.800 . 5.760 4.473 4.252 4.682 . 0 0 "[ . 1 . 2]" 1
246 1 72 VAL HB 1 73 VAL H 1.800 . 3.410 2.543 2.428 3.225 . 0 0 "[ . 1 . 2]" 1
247 1 74 VAL HB 1 75 GLY H 1.800 . 5.320 4.231 3.462 4.420 . 0 0 "[ . 1 . 2]" 1
248 1 76 GLU HB3 1 77 TYR H 1.800 . 5.120 3.956 3.144 4.291 . 0 0 "[ . 1 . 2]" 1
249 1 76 GLU HB2 1 77 TYR H 1.800 . 5.120 3.999 3.102 4.400 . 0 0 "[ . 1 . 2]" 1
250 1 78 ASN HB3 1 79 ASP H 1.800 . 4.650 3.132 1.755 4.447 0.045 18 0 "[ . 1 . 2]" 1
251 1 78 ASN HB2 1 79 ASP H 1.800 . 4.650 3.284 1.772 4.660 0.028 9 0 "[ . 1 . 2]" 1
252 1 80 ARG QB 1 81 PHE H 1.800 . 3.690 2.186 1.715 3.514 0.085 10 0 "[ . 1 . 2]" 1
253 1 81 PHE HB3 1 82 GLN H 1.800 . 4.410 2.846 2.562 3.165 . 0 0 "[ . 1 . 2]" 1
254 1 81 PHE HB2 1 82 GLN H 1.800 . 4.150 3.954 3.618 4.167 0.017 6 0 "[ . 1 . 2]" 1
255 1 82 GLN QB 1 83 VAL H 1.800 . 3.800 2.893 2.144 3.800 . 0 0 "[ . 1 . 2]" 1
256 1 83 VAL HB 1 84 GLN H 1.800 . 4.410 3.270 3.033 3.359 . 0 0 "[ . 1 . 2]" 1
257 1 84 GLN HB3 1 85 VAL H 1.800 . 4.110 3.391 3.178 3.640 . 0 0 "[ . 1 . 2]" 1
258 1 84 GLN HB2 1 85 VAL H 1.800 . 4.410 4.281 4.181 4.400 . 0 0 "[ . 1 . 2]" 1
259 1 85 VAL HB 1 86 ASN H 1.800 . 5.030 4.219 4.057 4.393 . 0 0 "[ . 1 . 2]" 1
260 1 86 ASN HB3 1 87 LYS H 1.800 . 3.650 3.031 2.002 3.699 0.049 5 0 "[ . 1 . 2]" 1
261 1 86 ASN HB2 1 87 LYS H 1.800 . 4.460 2.471 1.798 3.515 0.002 8 0 "[ . 1 . 2]" 1
262 1 87 LYS QB 1 88 ASN H 1.800 . 4.610 2.586 1.743 3.834 0.057 8 0 "[ . 1 . 2]" 1
263 1 88 ASN HB3 1 89 SER H 1.800 . 4.420 3.552 2.637 4.460 0.040 9 0 "[ . 1 . 2]" 1
264 1 88 ASN HB2 1 89 SER H 1.800 . 5.580 3.840 2.741 4.641 . 0 0 "[ . 1 . 2]" 1
265 1 89 SER QB 1 90 SER H 1.800 . 3.880 3.072 2.532 3.904 0.024 20 0 "[ . 1 . 2]" 1
266 1 90 SER QB 1 91 ILE H 1.800 . 4.000 2.948 2.616 3.600 . 0 0 "[ . 1 . 2]" 1
267 1 91 ILE HB 1 92 GLU H 1.800 . 5.060 4.183 4.150 4.213 . 0 0 "[ . 1 . 2]" 1
268 1 92 GLU HB3 1 93 LYS H 1.800 . 4.990 3.814 3.079 4.308 . 0 0 "[ . 1 . 2]" 1
269 1 92 GLU HB2 1 93 LYS H 1.800 . 4.500 4.175 3.944 4.295 . 0 0 "[ . 1 . 2]" 1
270 1 94 LEU HB3 1 95 SER H 1.800 . 4.370 3.242 3.023 3.340 . 0 0 "[ . 1 . 2]" 1
271 1 95 SER QB 1 96 GLU H 1.800 . 3.880 3.587 3.233 3.955 0.075 3 0 "[ . 1 . 2]" 1
272 1 97 PRO HB3 1 98 ILE H 1.800 . 4.080 3.488 3.201 3.741 . 0 0 "[ . 1 . 2]" 1
273 1 97 PRO HB2 1 98 ILE H 1.800 . 3.810 3.256 2.770 3.703 . 0 0 "[ . 1 . 2]" 1
274 1 98 ILE HB 1 99 GLU H 1.800 . 4.490 4.011 2.945 4.282 . 0 0 "[ . 1 . 2]" 1
275 1 99 GLU QB 1 100 VAL H 1.800 . 4.440 3.308 1.793 4.037 0.007 10 0 "[ . 1 . 2]" 1
276 1 100 VAL HB 1 101 GLY H 1.800 . 4.890 3.941 2.520 4.476 . 0 0 "[ . 1 . 2]" 1
277 1 102 LEU QB 1 103 GLU H 1.800 . 4.460 3.156 2.028 3.861 . 0 0 "[ . 1 . 2]" 1
278 1 103 GLU QB 1 104 HIS H 1.800 . 4.590 3.227 1.869 4.052 . 0 0 "[ . 1 . 2]" 1
279 1 104 HIS QB 1 105 HIS H 1.800 . 4.390 3.055 1.798 4.069 0.002 2 0 "[ . 1 . 2]" 1
280 1 3 PRO QG 1 4 GLN H 1.800 . 5.070 4.549 4.418 4.678 . 0 0 "[ . 1 . 2]" 1
281 1 4 GLN QG 1 5 LEU H 1.800 . 5.040 4.322 3.502 4.741 . 0 0 "[ . 1 . 2]" 1
282 1 5 LEU MD1 1 6 THR H 1.800 . 5.500 4.522 2.915 5.168 . 0 0 "[ . 1 . 2]" 1
283 1 5 LEU MD2 1 6 THR H 1.800 . 4.060 3.645 3.244 4.155 0.095 18 0 "[ . 1 . 2]" 1
284 1 6 THR MG 1 7 LYS H 1.800 . 3.430 2.617 2.471 3.230 . 0 0 "[ . 1 . 2]" 1
285 1 8 ILE MG 1 9 VAL H 1.800 . 4.320 3.303 3.216 3.559 . 0 0 "[ . 1 . 2]" 1
286 1 9 VAL MG1 1 10 ASP H 1.800 . 3.410 2.292 2.157 2.460 . 0 0 "[ . 1 . 2]" 1
287 1 9 VAL MG2 1 10 ASP H 1.800 . 5.120 3.858 3.770 3.910 . 0 0 "[ . 1 . 2]" 1
288 1 11 ILE MG 1 12 VAL H 1.800 . 4.460 2.958 2.688 3.437 . 0 0 "[ . 1 . 2]" 1
289 1 12 VAL MG1 1 13 GLU H 1.800 . 4.460 4.077 1.933 4.355 . 0 0 "[ . 1 . 2]" 1
290 1 12 VAL MG2 1 13 GLU H 1.800 . 3.370 2.901 1.978 3.314 . 0 0 "[ . 1 . 2]" 1
291 1 13 GLU QG 1 14 ASN H 1.800 . 5.540 3.568 2.340 4.598 . 0 0 "[ . 1 . 2]" 1
292 1 16 GLN HG3 1 17 TRP H 1.800 . 5.030 3.172 2.617 4.883 . 0 0 "[ . 1 . 2]" 1
293 1 17 TRP HE3 1 18 ALA H 1.800 . 5.730 3.924 3.423 4.482 . 0 0 "[ . 1 . 2]" 1
294 1 20 LEU QD 1 21 LYS H 1.800 . 4.480 2.474 1.791 4.036 0.009 16 0 "[ . 1 . 2]" 1
295 1 23 LYS QG 1 24 VAL H 1.800 . 4.250 2.701 2.267 4.034 . 0 0 "[ . 1 . 2]" 1
296 1 24 VAL MG1 1 25 ILE H 1.800 . 4.110 2.856 2.581 3.484 . 0 0 "[ . 1 . 2]" 1
297 1 25 ILE HG12 1 26 GLN H 1.800 . 5.000 4.265 2.710 4.983 . 0 0 "[ . 1 . 2]" 1
298 1 25 ILE MG 1 26 GLN H 1.800 . 3.980 3.329 2.764 3.970 . 0 0 "[ . 1 . 2]" 1
299 1 26 GLN QG 1 27 LEU H 1.800 . 4.480 2.891 2.180 4.566 0.086 19 0 "[ . 1 . 2]" 1
300 1 27 LEU MD2 1 28 TRP H 1.800 . 5.100 4.549 3.416 5.152 0.052 3 0 "[ . 1 . 2]" 1
301 1 29 GLU QG 1 30 ASN H 1.800 . 4.500 3.597 2.315 4.545 0.045 14 0 "[ . 1 . 2]" 1
302 1 31 THR MG 1 32 HIS H 1.800 . 5.040 3.994 2.932 4.348 . 0 0 "[ . 1 . 2]" 1
303 1 35 ILE QG 1 36 SER H 1.800 . 5.070 4.117 3.999 4.273 . 0 0 "[ . 1 . 2]" 1
304 1 35 ILE MG 1 36 SER H 1.800 . 3.820 2.640 2.427 2.909 . 0 0 "[ . 1 . 2]" 1
305 1 37 GLN QE 1 38 VAL H 1.800 . 5.870 5.119 4.107 5.893 0.023 15 0 "[ . 1 . 2]" 1
306 1 37 GLN QG 1 38 VAL H 1.800 . 3.980 3.260 1.907 3.946 . 0 0 "[ . 1 . 2]" 1
307 1 38 VAL QG 1 39 GLY H 1.800 . 3.860 2.685 2.148 3.520 . 0 0 "[ . 1 . 2]" 1
308 1 40 LEU QD 1 41 LEU H 1.800 . 4.380 3.820 2.906 4.147 . 0 0 "[ . 1 . 2]" 1
309 1 41 LEU MD1 1 42 GLY H 1.800 . 5.500 5.030 4.545 5.135 . 0 0 "[ . 1 . 2]" 1
310 1 41 LEU MD2 1 42 GLY H 1.800 . 4.070 3.702 3.560 3.796 . 0 0 "[ . 1 . 2]" 1
311 1 44 GLU QG 1 45 THR H 1.800 . 4.920 3.822 2.551 4.267 . 0 0 "[ . 1 . 2]" 1
312 1 45 THR MG 1 46 GLY H 1.800 . 4.320 4.042 3.908 4.334 0.014 6 0 "[ . 1 . 2]" 1
313 1 47 ILE QG 1 48 ILE H 1.800 . 5.160 3.944 3.428 4.757 . 0 0 "[ . 1 . 2]" 1
314 1 47 ILE MG 1 48 ILE H 1.800 . 4.370 3.233 2.341 3.895 . 0 0 "[ . 1 . 2]" 1
315 1 48 ILE MD 1 49 LYS H 1.800 . 4.500 3.409 1.700 4.174 0.100 12 0 "[ . 1 . 2]" 1
316 1 48 ILE HG13 1 49 LYS H 1.800 . 4.000 2.559 2.270 4.229 0.229 12 0 "[ . 1 . 2]" 1
317 1 48 ILE HG12 1 49 LYS H 1.800 . 4.060 3.012 2.437 4.084 0.024 1 0 "[ . 1 . 2]" 1
318 1 48 ILE MG 1 49 LYS H 1.800 . 4.500 3.642 3.212 3.787 . 0 0 "[ . 1 . 2]" 1
319 1 49 LYS QD 1 50 PHE H 1.800 . 5.560 4.540 3.344 5.281 . 0 0 "[ . 1 . 2]" 1
320 1 50 PHE QD 1 51 THR H 1.800 . 4.500 3.421 3.196 3.790 . 0 0 "[ . 1 . 2]" 1
321 1 51 THR MG 1 52 ILE H 1.800 . 3.980 3.040 2.368 3.990 0.010 11 0 "[ . 1 . 2]" 1
322 1 52 ILE MG 1 53 TRP H 1.800 . 4.030 2.763 2.595 2.926 . 0 0 "[ . 1 . 2]" 1
323 1 60 LEU MD1 1 61 LEU H 1.800 . 5.050 4.832 4.634 4.946 . 0 0 "[ . 1 . 2]" 1
324 1 60 LEU MD2 1 61 LEU H 1.800 . 3.830 3.522 3.400 3.628 . 0 0 "[ . 1 . 2]" 1
325 1 60 LEU HG 1 61 LEU H 1.800 . 5.800 5.043 4.938 5.136 . 0 0 "[ . 1 . 2]" 1
326 1 61 LEU MD1 1 62 GLU H 1.800 . 4.980 4.336 3.088 4.524 . 0 0 "[ . 1 . 2]" 1
327 1 61 LEU MD2 1 62 GLU H 1.800 . 4.850 4.645 4.479 4.802 . 0 0 "[ . 1 . 2]" 1
328 1 61 LEU HG 1 62 GLU H 1.800 . 4.950 3.911 3.751 4.967 0.017 12 0 "[ . 1 . 2]" 1
329 1 62 GLU QG 1 63 GLN H 1.800 . 4.600 3.561 2.222 4.623 0.023 13 0 "[ . 1 . 2]" 1
330 1 63 GLN HE21 1 64 GLY H 1.800 . 5.850 4.665 2.505 5.829 . 0 0 "[ . 1 . 2]" 1
331 1 63 GLN HG3 1 64 GLY H 1.800 . 4.890 3.270 2.461 4.919 0.029 5 0 "[ . 1 . 2]" 1
332 1 63 GLN HG2 1 64 GLY H 1.800 . 4.090 2.985 2.481 4.198 0.108 5 0 "[ . 1 . 2]" 1
333 1 65 GLU QG 1 66 SER H 1.800 . 5.820 4.126 3.810 4.449 . 0 0 "[ . 1 . 2]" 1
334 1 67 TYR QD 1 68 LEU H 1.800 . 4.570 3.493 3.100 3.833 . 0 0 "[ . 1 . 2]" 1
335 1 68 LEU MD1 1 69 LEU H 1.800 . 3.690 2.109 1.974 2.486 . 0 0 "[ . 1 . 2]" 1
336 1 68 LEU MD2 1 69 LEU H 1.800 . 5.510 4.580 3.273 4.949 . 0 0 "[ . 1 . 2]" 1
337 1 69 LEU MD2 1 70 ARG H 1.800 . 5.030 3.772 3.580 4.733 . 0 0 "[ . 1 . 2]" 1
338 1 70 ARG HG3 1 71 SER H 1.800 . 5.890 4.898 4.814 5.050 . 0 0 "[ . 1 . 2]" 1
339 1 70 ARG HG2 1 71 SER H 1.800 . 5.060 4.106 3.934 4.251 . 0 0 "[ . 1 . 2]" 1
340 1 72 VAL MG1 1 73 VAL H 1.800 . 4.580 3.596 3.466 3.720 . 0 0 "[ . 1 . 2]" 1
341 1 72 VAL MG2 1 73 VAL H 1.800 . 4.730 3.669 3.520 4.113 . 0 0 "[ . 1 . 2]" 1
342 1 73 VAL MG1 1 74 VAL H 1.800 . 4.500 3.805 3.682 4.006 . 0 0 "[ . 1 . 2]" 1
343 1 73 VAL MG2 1 74 VAL H 1.800 . 4.020 2.498 2.379 2.585 . 0 0 "[ . 1 . 2]" 1
344 1 74 VAL MG1 1 75 GLY H 1.800 . 3.660 2.966 2.642 3.690 0.030 10 0 "[ . 1 . 2]" 1
345 1 76 GLU QG 1 77 TYR H 1.800 . 4.290 3.674 2.796 4.295 0.005 5 0 "[ . 1 . 2]" 1
346 1 77 TYR QD 1 78 ASN H 1.800 . 5.040 3.761 2.362 4.784 . 0 0 "[ . 1 . 2]" 1
347 1 78 ASN HD21 1 79 ASP H 1.800 . 6.050 4.197 2.416 5.215 . 0 0 "[ . 1 . 2]" 1
348 1 78 ASN HD22 1 79 ASP H 1.800 . 6.050 5.057 2.922 6.038 . 0 0 "[ . 1 . 2]" 1
349 1 78 ASN QD 1 79 ASP H 1.800 . 5.210 3.976 2.307 4.921 . 0 0 "[ . 1 . 2]" 1
350 1 80 ARG QD 1 81 PHE H 1.800 . 4.930 4.091 2.619 4.927 . 0 0 "[ . 1 . 2]" 1
351 1 80 ARG QG 1 81 PHE H 1.800 . 4.280 3.521 1.789 4.269 0.011 19 0 "[ . 1 . 2]" 1
352 1 81 PHE QD 1 82 GLN H 1.800 . 4.580 3.701 3.438 4.037 . 0 0 "[ . 1 . 2]" 1
353 1 82 GLN QG 1 83 VAL H 1.800 . 4.940 3.047 1.979 3.841 . 0 0 "[ . 1 . 2]" 1
354 1 83 VAL MG1 1 84 GLN H 1.800 . 4.540 3.920 3.701 4.108 . 0 0 "[ . 1 . 2]" 1
355 1 83 VAL MG2 1 84 GLN H 1.800 . 5.240 3.997 3.818 4.162 . 0 0 "[ . 1 . 2]" 1
356 1 85 VAL MG1 1 86 ASN H 1.800 . 3.790 2.876 2.491 3.350 . 0 0 "[ . 1 . 2]" 1
357 1 85 VAL MG2 1 86 ASN H 1.800 . 4.470 4.177 4.007 4.341 . 0 0 "[ . 1 . 2]" 1
358 1 86 ASN HD21 1 87 LYS H 1.800 . 6.050 4.664 3.249 5.283 . 0 0 "[ . 1 . 2]" 1
359 1 87 LYS QG 1 88 ASN H 1.800 . 4.200 2.622 1.755 4.310 0.110 6 0 "[ . 1 . 2]" 1
360 1 88 ASN HD21 1 89 SER H 1.800 . 6.050 4.856 4.041 5.543 . 0 0 "[ . 1 . 2]" 1
361 1 91 ILE HG12 1 92 GLU H 1.800 . 5.520 4.341 4.274 4.406 . 0 0 "[ . 1 . 2]" 1
362 1 91 ILE MG 1 92 GLU H 1.800 . 3.730 2.539 2.435 2.614 . 0 0 "[ . 1 . 2]" 1
363 1 92 GLU QG 1 93 LYS H 1.800 . 4.890 3.311 2.506 4.746 . 0 0 "[ . 1 . 2]" 1
364 1 93 LYS QD 1 94 LEU H 1.800 . 5.090 4.784 4.591 5.084 . 0 0 "[ . 1 . 2]" 1
365 1 93 LYS HG3 1 94 LEU H 1.800 . 4.820 3.259 2.775 4.860 0.040 12 0 "[ . 1 . 2]" 1
366 1 93 LYS HG2 1 94 LEU H 1.800 . 4.820 3.111 2.730 4.058 . 0 0 "[ . 1 . 2]" 1
367 1 93 LYS QG 1 94 LEU H 1.800 . 4.070 2.821 2.507 3.866 . 0 0 "[ . 1 . 2]" 1
368 1 94 LEU QD 1 95 SER H 1.800 . 4.860 3.525 2.959 4.029 . 0 0 "[ . 1 . 2]" 1
369 1 97 PRO QG 1 98 ILE H 1.800 . 4.700 4.494 4.273 4.664 . 0 0 "[ . 1 . 2]" 1
370 1 98 ILE MD 1 99 GLU H 1.800 . 5.250 4.946 3.801 5.229 . 0 0 "[ . 1 . 2]" 1
371 1 98 ILE HG13 1 99 GLU H 1.800 . 5.650 4.955 4.167 5.523 . 0 0 "[ . 1 . 2]" 1
372 1 98 ILE HG12 1 99 GLU H 1.800 . 5.650 4.607 4.320 5.274 . 0 0 "[ . 1 . 2]" 1
373 1 98 ILE QG 1 99 GLU H 1.800 . 4.890 4.203 3.972 4.796 . 0 0 "[ . 1 . 2]" 1
374 1 98 ILE MG 1 99 GLU H 1.800 . 3.790 2.922 2.406 3.988 0.198 3 0 "[ . 1 . 2]" 1
375 1 99 GLU QG 1 100 VAL H 1.800 . 5.050 3.957 2.846 4.632 . 0 0 "[ . 1 . 2]" 1
376 1 100 VAL MG1 1 101 GLY H 1.800 . 5.640 4.020 2.445 4.359 . 0 0 "[ . 1 . 2]" 1
377 1 100 VAL MG2 1 101 GLY H 1.800 . 4.670 3.368 2.526 4.331 . 0 0 "[ . 1 . 2]" 1
378 1 8 ILE HB 1 10 ASP H 1.800 . 6.050 4.757 4.697 4.816 . 0 0 "[ . 1 . 2]" 1
379 1 30 ASN QB 1 32 HIS H 1.800 . 4.620 3.181 2.353 4.653 0.033 16 0 "[ . 1 . 2]" 1
380 1 43 ASP HB3 1 45 THR H 1.800 . 5.310 2.912 2.297 4.126 . 0 0 "[ . 1 . 2]" 1
381 1 43 ASP HB2 1 45 THR H 1.800 . 5.310 3.936 2.787 4.508 . 0 0 "[ . 1 . 2]" 1
382 1 54 LYS QB 1 56 ALA H 1.800 . 5.150 4.599 3.711 5.140 . 0 0 "[ . 1 . 2]" 1
383 1 78 ASN QB 1 80 ARG H 1.800 . 5.800 3.463 2.469 5.095 . 0 0 "[ . 1 . 2]" 1
384 1 94 LEU HB3 1 96 GLU H 1.800 . 3.410 2.421 2.195 2.859 . 0 0 "[ . 1 . 2]" 1
385 1 94 LEU HB2 1 96 GLU H 1.800 . 4.510 3.551 2.884 3.934 . 0 0 "[ . 1 . 2]" 1
386 1 99 GLU QB 1 101 GLY H 1.800 . 5.190 3.331 2.338 5.010 . 0 0 "[ . 1 . 2]" 1
387 1 3 PRO QG 1 5 LEU H 1.800 . 5.210 4.610 3.956 5.393 0.183 8 0 "[ . 1 . 2]" 1
388 1 8 ILE MG 1 10 ASP H 1.800 . 5.460 4.666 4.582 4.794 . 0 0 "[ . 1 . 2]" 1
389 1 9 VAL MG2 1 11 ILE H 1.800 . 6.050 4.601 4.465 5.033 . 0 0 "[ . 1 . 2]" 1
390 1 11 ILE MG 1 13 GLU H 1.800 . 4.220 3.022 2.687 3.965 . 0 0 "[ . 1 . 2]" 1
391 1 24 VAL MG1 1 26 GLN H 1.800 . 4.110 3.141 2.778 3.696 . 0 0 "[ . 1 . 2]" 1
392 1 30 ASN HD21 1 32 HIS H 1.800 . 4.400 3.424 2.079 4.382 . 0 0 "[ . 1 . 2]" 1
393 1 30 ASN HD22 1 32 HIS H 1.800 . 4.160 3.473 2.699 4.227 0.067 11 0 "[ . 1 . 2]" 1
394 1 35 ILE MG 1 37 GLN H 1.800 . 3.550 3.084 2.575 3.466 . 0 0 "[ . 1 . 2]" 1
395 1 50 PHE QD 1 52 ILE H 1.800 . 5.380 4.236 3.688 4.632 . 0 0 "[ . 1 . 2]" 1
396 1 50 PHE QE 1 52 ILE H 1.800 . 6.050 4.564 4.022 5.008 . 0 0 "[ . 1 . 2]" 1
397 1 68 LEU MD1 1 70 ARG H 1.800 . 4.800 4.650 3.512 4.841 0.041 2 0 "[ . 1 . 2]" 1
398 1 73 VAL MG1 1 75 GLY H 1.800 . 6.050 4.070 3.731 4.323 . 0 0 "[ . 1 . 2]" 1
399 1 91 ILE MG 1 93 LYS H 1.800 . 4.950 4.170 3.826 4.433 . 0 0 "[ . 1 . 2]" 1
400 1 94 LEU QD 1 96 GLU H 1.800 . 4.360 3.710 3.196 4.020 . 0 0 "[ . 1 . 2]" 1
401 1 99 GLU QG 1 101 GLY H 1.800 . 5.100 4.160 2.130 5.155 0.055 2 0 "[ . 1 . 2]" 1
402 1 32 HIS QB 1 35 ILE H 1.800 . 5.280 2.936 2.162 4.450 . 0 0 "[ . 1 . 2]" 1
403 1 77 TYR QB 1 80 ARG H 1.800 . 4.660 3.848 2.380 4.426 . 0 0 "[ . 1 . 2]" 1
404 1 7 LYS QG 1 10 ASP H 1.800 . 5.930 4.675 4.366 4.830 . 0 0 "[ . 1 . 2]" 1
405 1 35 ILE MG 1 38 VAL H 1.800 . 4.760 4.270 3.862 4.515 . 0 0 "[ . 1 . 2]" 1
406 1 86 ASN HD21 1 89 SER H 1.800 . 6.050 5.194 3.294 6.072 0.022 19 0 "[ . 1 . 2]" 1
407 1 6 THR MG 1 10 ASP H 1.800 . 5.000 4.184 3.943 4.947 . 0 0 "[ . 1 . 2]" 1
408 1 85 VAL MG1 1 89 SER H 1.800 . 5.000 4.355 3.291 4.739 . 0 0 "[ . 1 . 2]" 1
409 1 8 ILE HA 1 11 ILE HB 1.800 . 4.990 3.648 2.880 4.166 . 0 0 "[ . 1 . 2]" 1
410 1 8 ILE HA 1 11 ILE MD 1.800 . 3.590 2.271 2.063 3.282 . 0 0 "[ . 1 . 2]" 1
411 1 8 ILE HA 1 11 ILE HG13 1.800 . 4.540 2.762 2.324 3.214 . 0 0 "[ . 1 . 2]" 1
412 1 8 ILE HA 1 11 ILE HG12 1.800 . 4.960 4.007 2.334 4.643 . 0 0 "[ . 1 . 2]" 1
413 1 69 LEU HA 1 72 VAL MG1 1.800 . 4.710 3.749 3.299 3.939 . 0 0 "[ . 1 . 2]" 1
414 1 99 GLU HA 1 102 LEU MD1 1.800 . 6.050 4.910 2.920 6.093 0.043 8 0 "[ . 1 . 2]" 1
415 1 6 THR H 1 19 ASN H 1.800 . 5.280 4.185 3.511 4.606 . 0 0 "[ . 1 . 2]" 1
416 1 6 THR H 1 21 LYS H 1.800 . 5.440 4.273 3.678 4.761 . 0 0 "[ . 1 . 2]" 1
417 1 7 LYS H 1 10 ASP H 1.800 . 4.850 4.106 3.839 4.428 . 0 0 "[ . 1 . 2]" 1
418 1 8 ILE H 1 45 THR H 1.800 . 5.820 5.168 4.795 5.700 . 0 0 "[ . 1 . 2]" 1
419 1 9 VAL H 1 45 THR H 1.800 . 6.050 5.991 5.734 6.083 0.033 11 0 "[ . 1 . 2]" 1
420 1 15 GLY H 1 74 VAL H 1.800 . 4.770 3.862 3.372 4.646 . 0 0 "[ . 1 . 2]" 1
421 1 16 GLN H 1 74 VAL H 1.800 . 4.710 2.956 2.025 3.398 . 0 0 "[ . 1 . 2]" 1
422 1 18 ALA H 1 72 VAL H 1.800 . 3.880 2.921 2.482 3.148 . 0 0 "[ . 1 . 2]" 1
423 1 19 ASN H 1 71 SER H 1.800 . 5.780 4.829 4.461 5.026 . 0 0 "[ . 1 . 2]" 1
424 1 20 LEU H 1 69 LEU H 1.800 . 4.160 3.335 3.040 3.663 . 0 0 "[ . 1 . 2]" 1
425 1 20 LEU H 1 71 SER H 1.800 . 5.360 5.240 4.895 5.390 0.030 19 0 "[ . 1 . 2]" 1
426 1 24 VAL H 1 64 GLY H 1.800 . 4.800 3.969 3.459 4.370 . 0 0 "[ . 1 . 2]" 1
427 1 24 VAL H 1 65 GLU H 1.800 . 4.800 3.379 2.696 3.812 . 0 0 "[ . 1 . 2]" 1
428 1 25 ILE H 1 41 LEU H 1.800 . 5.670 5.321 5.096 5.722 0.052 11 0 "[ . 1 . 2]" 1
429 1 25 ILE H 1 42 GLY H 1.800 . 4.410 3.398 2.743 3.777 . 0 0 "[ . 1 . 2]" 1
430 1 28 TRP H 1 38 VAL H 1.800 . 4.800 3.385 2.865 4.113 . 0 0 "[ . 1 . 2]" 1
431 1 28 TRP H 1 39 GLY H 1.800 . 6.050 4.750 4.421 5.034 . 0 0 "[ . 1 . 2]" 1
432 1 37 GLN H 1 52 ILE H 1.800 . 4.170 3.129 2.843 3.465 . 0 0 "[ . 1 . 2]" 1
433 1 39 GLY H 1 50 PHE H 1.800 . 4.080 3.049 2.865 3.404 . 0 0 "[ . 1 . 2]" 1
434 1 40 LEU H 1 50 PHE H 1.800 . 5.610 4.976 4.876 5.083 . 0 0 "[ . 1 . 2]" 1
435 1 41 LEU H 1 49 LYS H 1.800 . 6.050 4.980 4.887 5.150 . 0 0 "[ . 1 . 2]" 1
436 1 41 LEU H 1 50 PHE H 1.800 . 5.220 4.816 4.420 5.054 . 0 0 "[ . 1 . 2]" 1
437 1 43 ASP H 1 46 GLY H 1.800 . 3.670 3.542 3.150 3.699 0.029 8 0 "[ . 1 . 2]" 1
438 1 51 THR H 1 85 VAL H 1.800 . 4.860 3.630 3.092 3.962 . 0 0 "[ . 1 . 2]" 1
439 1 53 TRP H 1 85 VAL H 1.800 . 5.570 3.808 3.482 4.314 . 0 0 "[ . 1 . 2]" 1
440 1 62 GLU H 1 65 GLU H 1.800 . 6.050 5.547 5.036 6.031 . 0 0 "[ . 1 . 2]" 1
441 1 66 SER H 1 94 LEU H 1.800 . 5.050 4.343 4.196 4.584 . 0 0 "[ . 1 . 2]" 1
442 1 67 TYR H 1 94 LEU H 1.800 . 5.650 4.823 4.587 5.098 . 0 0 "[ . 1 . 2]" 1
443 1 68 LEU H 1 92 GLU H 1.800 . 4.040 2.630 2.503 2.763 . 0 0 "[ . 1 . 2]" 1
444 1 68 LEU H 1 93 LYS H 1.800 . 5.790 5.093 4.891 5.240 . 0 0 "[ . 1 . 2]" 1
445 1 68 LEU H 1 94 LEU H 1.800 . 5.650 4.494 4.318 4.651 . 0 0 "[ . 1 . 2]" 1
446 1 73 VAL H 1 84 GLN H 1.800 . 4.750 3.540 3.274 4.018 . 0 0 "[ . 1 . 2]" 1
447 1 73 VAL H 1 86 ASN H 1.800 . 5.900 4.845 4.042 5.545 . 0 0 "[ . 1 . 2]" 1
448 1 75 GLY H 1 82 GLN H 1.800 . 4.000 3.590 3.125 3.947 . 0 0 "[ . 1 . 2]" 1
449 1 77 TYR H 1 82 GLN H 1.800 . 4.980 3.916 3.176 4.473 . 0 0 "[ . 1 . 2]" 1
450 1 86 ASN H 1 89 SER H 1.800 . 4.280 3.771 2.934 4.308 0.028 20 0 "[ . 1 . 2]" 1
451 1 17 TRP HA 1 72 VAL H 1.800 . 5.180 4.311 3.772 4.633 . 0 0 "[ . 1 . 2]" 1
452 1 17 TRP HA 1 73 VAL H 1.800 . 5.430 5.005 4.454 5.100 . 0 0 "[ . 1 . 2]" 1
453 1 19 ASN HA 1 71 SER H 1.800 . 4.150 3.306 3.012 3.476 . 0 0 "[ . 1 . 2]" 1
454 1 19 ASN HA 1 72 VAL H 1.800 . 4.880 3.744 3.603 4.035 . 0 0 "[ . 1 . 2]" 1
455 1 21 LYS HA 1 67 TYR H 1.800 . 4.950 4.728 4.419 4.983 0.033 14 0 "[ . 1 . 2]" 1
456 1 21 LYS HA 1 69 LEU H 1.800 . 4.350 2.983 2.872 3.177 . 0 0 "[ . 1 . 2]" 1
457 1 22 ALA HA 1 44 GLU H 1.800 . 6.050 5.704 5.287 6.051 0.001 6 0 "[ . 1 . 2]" 1
458 1 23 LYS HA 1 66 SER H 1.800 . 4.750 4.718 4.514 4.825 0.075 16 0 "[ . 1 . 2]" 1
459 1 34 SER HA 1 54 LYS H 1.800 . 4.950 4.528 3.876 4.978 0.028 16 0 "[ . 1 . 2]" 1
460 1 38 VAL HA 1 50 PHE H 1.800 . 6.030 4.679 4.419 5.029 . 0 0 "[ . 1 . 2]" 1
461 1 38 VAL HA 1 52 ILE H 1.800 . 5.380 3.614 3.303 3.904 . 0 0 "[ . 1 . 2]" 1
462 1 40 LEU HA 1 49 LYS H 1.800 . 5.390 4.703 4.588 4.988 . 0 0 "[ . 1 . 2]" 1
463 1 50 PHE HA 1 83 VAL H 1.800 . 4.770 2.633 2.381 2.876 . 0 0 "[ . 1 . 2]" 1
464 1 52 ILE HA 1 85 VAL H 1.800 . 4.150 3.188 2.717 3.663 . 0 0 "[ . 1 . 2]" 1
465 1 67 TYR HA 1 94 LEU H 1.800 . 3.820 3.108 2.921 3.531 . 0 0 "[ . 1 . 2]" 1
466 1 72 VAL HA 1 86 ASN H 1.800 . 5.360 4.149 3.666 4.692 . 0 0 "[ . 1 . 2]" 1
467 1 74 VAL HA 1 82 GLN H 1.800 . 5.790 4.542 4.050 5.326 . 0 0 "[ . 1 . 2]" 1
468 1 74 VAL HA 1 83 VAL H 1.800 . 5.860 4.871 4.720 5.017 . 0 0 "[ . 1 . 2]" 1
469 1 74 VAL HA 1 84 GLN H 1.800 . 4.420 3.320 2.698 3.521 . 0 0 "[ . 1 . 2]" 1
470 1 76 GLU HA 1 82 GLN H 1.800 . 5.140 3.778 3.334 4.291 . 0 0 "[ . 1 . 2]" 1
471 1 6 THR H 1 20 LEU HA 1.800 . 5.000 2.944 2.381 3.675 . 0 0 "[ . 1 . 2]" 1
472 1 15 GLY H 1 75 GLY HA3 1.800 . 5.430 5.251 4.850 5.468 0.038 20 0 "[ . 1 . 2]" 1
473 1 16 GLN H 1 73 VAL HA 1.800 . 6.050 4.426 3.241 5.007 . 0 0 "[ . 1 . 2]" 1
474 1 18 ALA H 1 71 SER HA 1.800 . 4.930 4.057 3.562 4.541 . 0 0 "[ . 1 . 2]" 1
475 1 18 ALA H 1 73 VAL HA 1.800 . 5.070 4.078 3.870 4.176 . 0 0 "[ . 1 . 2]" 1
476 1 20 LEU H 1 70 ARG HA 1.800 . 5.040 3.919 3.527 4.315 . 0 0 "[ . 1 . 2]" 1
477 1 23 LYS H 1 42 GLY HA3 1.800 . 5.240 4.307 3.999 4.632 . 0 0 "[ . 1 . 2]" 1
478 1 23 LYS H 1 42 GLY HA2 1.800 . 5.470 4.980 4.728 5.178 . 0 0 "[ . 1 . 2]" 1
479 1 23 LYS H 1 43 ASP HA 1.800 . 4.660 4.086 3.603 4.335 . 0 0 "[ . 1 . 2]" 1
480 1 23 LYS H 1 66 SER HA 1.800 . 5.900 4.779 4.438 4.938 . 0 0 "[ . 1 . 2]" 1
481 1 24 VAL H 1 66 SER HA 1.800 . 5.260 3.594 3.309 4.035 . 0 0 "[ . 1 . 2]" 1
482 1 25 ILE H 1 41 LEU HA 1.800 . 4.080 2.904 2.629 3.120 . 0 0 "[ . 1 . 2]" 1
483 1 26 GLN H 1 41 LEU HA 1.800 . 5.080 4.581 4.164 4.989 . 0 0 "[ . 1 . 2]" 1
484 1 28 TRP H 1 38 VAL HA 1.800 . 6.050 4.945 4.448 5.323 . 0 0 "[ . 1 . 2]" 1
485 1 28 TRP H 1 39 GLY QA 1.800 . 4.490 3.022 2.665 3.368 . 0 0 "[ . 1 . 2]" 1
486 1 36 SER H 1 53 TRP HA 1.800 . 5.030 3.202 2.614 3.620 . 0 0 "[ . 1 . 2]" 1
487 1 37 GLN H 1 51 THR HA 1.800 . 5.120 4.877 4.510 5.176 0.056 2 0 "[ . 1 . 2]" 1
488 1 41 LEU H 1 47 ILE HA 1.800 . 5.780 4.528 4.258 5.205 . 0 0 "[ . 1 . 2]" 1
489 1 41 LEU H 1 49 LYS HA 1.800 . 4.730 3.657 3.213 3.890 . 0 0 "[ . 1 . 2]" 1
490 1 43 ASP H 1 47 ILE HA 1.800 . 5.060 3.633 2.914 3.888 . 0 0 "[ . 1 . 2]" 1
491 1 49 LYS H 1 82 GLN HA 1.800 . 4.990 3.493 3.236 3.906 . 0 0 "[ . 1 . 2]" 1
492 1 51 THR H 1 84 GLN HA 1.800 . 4.160 2.893 2.639 3.188 . 0 0 "[ . 1 . 2]" 1
493 1 53 TRP H 1 86 ASN HA 1.800 . 5.060 3.908 3.401 4.247 . 0 0 "[ . 1 . 2]" 1
494 1 56 ALA H 1 87 LYS HA 1.800 . 5.530 5.389 4.763 5.603 0.073 20 0 "[ . 1 . 2]" 1
495 1 67 TYR H 1 93 LYS HA 1.800 . 5.680 5.448 4.993 5.677 . 0 0 "[ . 1 . 2]" 1
496 1 73 VAL H 1 85 VAL HA 1.800 . 4.880 4.417 4.047 4.863 . 0 0 "[ . 1 . 2]" 1
497 1 75 GLY H 1 83 VAL HA 1.800 . 5.010 2.922 2.137 3.543 . 0 0 "[ . 1 . 2]" 1
498 1 77 TYR H 1 81 PHE HA 1.800 . 4.190 2.876 1.983 3.872 . 0 0 "[ . 1 . 2]" 1
499 1 86 ASN H 1 89 SER HA 1.800 . 5.720 4.994 4.530 5.712 . 0 0 "[ . 1 . 2]" 1
500 1 17 TRP HA 1 73 VAL HA 1.800 . 3.770 2.744 2.601 2.906 . 0 0 "[ . 1 . 2]" 1
501 1 19 ASN HA 1 70 ARG HA 1.800 . 4.140 2.727 2.324 3.391 . 0 0 "[ . 1 . 2]" 1
502 1 21 LYS HA 1 68 LEU HA 1.800 . 4.020 2.579 2.453 2.825 . 0 0 "[ . 1 . 2]" 1
503 1 22 ALA HA 1 66 SER HA 1.800 . 5.590 5.356 4.892 5.596 0.006 8 0 "[ . 1 . 2]" 1
504 1 23 LYS HA 1 66 SER HA 1.800 . 3.830 2.245 2.211 2.277 . 0 0 "[ . 1 . 2]" 1
505 1 24 VAL HA 1 41 LEU HA 1.800 . 4.440 2.704 2.512 3.030 . 0 0 "[ . 1 . 2]" 1
506 1 27 LEU HA 1 39 GLY HA3 1.800 . 4.990 2.307 2.205 2.783 . 0 0 "[ . 1 . 2]" 1
507 1 27 LEU HA 1 39 GLY HA2 1.800 . 4.990 3.167 2.758 3.715 . 0 0 "[ . 1 . 2]" 1
508 1 35 ILE HA 1 53 TRP HA 1.800 . 3.870 3.001 2.577 3.642 . 0 0 "[ . 1 . 2]" 1
509 1 38 VAL HA 1 51 THR HA 1.800 . 4.250 2.579 2.376 2.746 . 0 0 "[ . 1 . 2]" 1
510 1 40 LEU HA 1 49 LYS HA 1.800 . 4.140 2.228 2.166 2.296 . 0 0 "[ . 1 . 2]" 1
511 1 42 GLY HA3 1 47 ILE HA 1.800 . 4.600 4.549 4.137 4.647 0.047 13 0 "[ . 1 . 2]" 1
512 1 42 GLY HA2 1 47 ILE HA 1.800 . 5.140 2.816 2.498 2.898 . 0 0 "[ . 1 . 2]" 1
513 1 43 ASP HA 1 100 VAL HA 1.800 . 5.970 5.292 4.499 6.017 0.047 6 0 "[ . 1 . 2]" 1
514 1 44 GLU HA 1 100 VAL HA 1.800 . 4.250 3.804 2.980 4.253 0.003 19 0 "[ . 1 . 2]" 1
515 1 67 TYR HA 1 93 LYS HA 1.800 . 4.290 2.840 2.412 3.076 . 0 0 "[ . 1 . 2]" 1
516 1 72 VAL HA 1 85 VAL HA 1.800 . 4.420 3.959 3.579 4.389 . 0 0 "[ . 1 . 2]" 1
517 1 76 GLU HA 1 81 PHE HA 1.800 . 4.220 3.127 2.397 3.462 . 0 0 "[ . 1 . 2]" 1
518 1 5 LEU MD2 1 20 LEU H 1.800 . 5.000 4.445 3.833 4.988 . 0 0 "[ . 1 . 2]" 1
519 1 5 LEU MD2 1 21 LYS H 1.800 . 5.000 3.901 2.467 5.025 0.025 10 0 "[ . 1 . 2]" 1
520 1 6 THR MG 1 11 ILE H 1.800 . 5.000 4.181 3.410 4.524 . 0 0 "[ . 1 . 2]" 1
521 1 8 ILE HB 1 46 GLY H 1.800 . 5.000 4.731 4.254 5.050 0.050 10 0 "[ . 1 . 2]" 1
522 1 8 ILE MD 1 43 ASP H 1.800 . 5.000 4.250 3.377 5.050 0.050 12 0 "[ . 1 . 2]" 1
523 1 8 ILE MD 1 46 GLY H 1.800 . 5.000 3.550 2.898 5.003 0.003 17 0 "[ . 1 . 2]" 1
524 1 8 ILE MD 1 48 ILE H 1.800 . 5.000 3.449 2.844 5.008 0.008 12 0 "[ . 1 . 2]" 1
525 1 8 ILE MG 1 47 ILE H 1.800 . 5.000 3.762 2.925 4.237 . 0 0 "[ . 1 . 2]" 1
526 1 8 ILE MG 1 48 ILE H 1.800 . 5.000 4.507 4.055 4.927 . 0 0 "[ . 1 . 2]" 1
527 1 11 ILE MD 1 83 VAL H 1.800 . 6.000 5.591 5.225 6.032 0.032 2 0 "[ . 1 . 2]" 1
528 1 21 LYS QG 1 67 TYR H 1.800 . 5.000 3.719 3.329 4.301 . 0 0 "[ . 1 . 2]" 1
529 1 22 ALA MB 1 43 ASP H 1.800 . 5.000 4.758 4.105 5.037 0.037 3 0 "[ . 1 . 2]" 1
530 1 23 LYS QB 1 98 ILE H 1.800 . 5.000 3.232 2.597 3.801 . 0 0 "[ . 1 . 2]" 1
531 1 24 VAL HB 1 64 GLY H 1.800 . 5.000 2.742 2.118 3.483 . 0 0 "[ . 1 . 2]" 1
532 1 24 VAL HB 1 65 GLU H 1.800 . 5.000 2.951 2.475 3.292 . 0 0 "[ . 1 . 2]" 1
533 1 24 VAL MG1 1 64 GLY H 1.800 . 5.000 3.201 2.526 3.633 . 0 0 "[ . 1 . 2]" 1
534 1 24 VAL MG2 1 62 GLU H 1.800 . 5.000 4.248 3.412 4.906 . 0 0 "[ . 1 . 2]" 1
535 1 24 VAL MG2 1 65 GLU H 1.800 . 5.000 3.963 3.062 4.503 . 0 0 "[ . 1 . 2]" 1
536 1 24 VAL MG2 1 67 TYR H 1.800 . 5.000 4.411 3.893 4.825 . 0 0 "[ . 1 . 2]" 1
537 1 25 ILE MD 1 42 GLY H 1.800 . 5.000 2.971 2.569 3.652 . 0 0 "[ . 1 . 2]" 1
538 1 25 ILE HG13 1 42 GLY H 1.800 . 5.000 2.947 2.076 4.481 . 0 0 "[ . 1 . 2]" 1
539 1 25 ILE HG12 1 42 GLY H 1.800 . 5.000 3.189 1.825 4.719 . 0 0 "[ . 1 . 2]" 1
540 1 27 LEU MD1 1 61 LEU H 1.800 . 5.000 4.165 3.067 5.097 0.097 3 0 "[ . 1 . 2]" 1
541 1 27 LEU MD1 1 63 GLN H 1.800 . 5.000 3.896 3.161 4.512 . 0 0 "[ . 1 . 2]" 1
542 1 30 ASN HD22 1 35 ILE H 1.800 . 5.000 4.313 2.434 5.018 0.018 20 0 "[ . 1 . 2]" 1
543 1 35 ILE MG 1 52 ILE H 1.800 . 5.000 3.302 2.634 4.063 . 0 0 "[ . 1 . 2]" 1
544 1 37 GLN QE 1 61 LEU H 1.800 . 5.000 3.436 1.770 4.807 0.030 13 0 "[ . 1 . 2]" 1
545 1 40 LEU HB3 1 50 PHE H 1.800 . 5.000 4.759 4.430 5.019 0.019 13 0 "[ . 1 . 2]" 1
546 1 48 ILE MD 1 82 GLN H 1.800 . 5.000 4.216 3.777 4.544 . 0 0 "[ . 1 . 2]" 1
547 1 48 ILE MD 1 83 VAL H 1.800 . 5.000 3.619 2.906 4.513 . 0 0 "[ . 1 . 2]" 1
548 1 58 LEU MD1 1 89 SER H 1.800 . 5.000 4.358 2.590 5.045 0.045 4 0 "[ . 1 . 2]" 1
549 1 58 LEU MD2 1 91 ILE H 1.800 . 5.000 4.208 2.281 4.924 . 0 0 "[ . 1 . 2]" 1
550 1 66 SER HB3 1 98 ILE H 1.800 . 5.000 3.724 2.543 5.030 0.030 2 0 "[ . 1 . 2]" 1
551 1 66 SER HB2 1 98 ILE H 1.800 . 5.000 4.244 3.154 4.870 . 0 0 "[ . 1 . 2]" 1
552 1 66 SER QB 1 98 ILE H 1.800 . 5.000 3.317 2.520 4.385 . 0 0 "[ . 1 . 2]" 1
553 1 67 TYR QE 1 93 LYS H 1.800 . 5.000 4.542 3.948 5.057 0.057 11 0 "[ . 1 . 2]" 1
554 1 68 LEU HB3 1 92 GLU H 1.800 . 5.000 2.991 2.667 3.314 . 0 0 "[ . 1 . 2]" 1
555 1 68 LEU HB2 1 92 GLU H 1.800 . 5.000 4.562 3.702 4.856 . 0 0 "[ . 1 . 2]" 1
556 1 70 ARG QB 1 90 SER H 1.800 . 5.000 3.008 2.510 3.468 . 0 0 "[ . 1 . 2]" 1
557 1 72 VAL MG2 1 84 GLN H 1.800 . 5.000 4.871 4.496 5.059 0.059 1 0 "[ . 1 . 2]" 1
558 1 73 VAL MG1 1 84 GLN H 1.800 . 5.000 3.162 2.924 3.466 . 0 0 "[ . 1 . 2]" 1
559 1 74 VAL MG1 1 82 GLN H 1.800 . 5.000 2.968 2.450 4.079 . 0 0 "[ . 1 . 2]" 1
560 1 74 VAL MG1 1 84 GLN H 1.800 . 5.000 4.870 3.670 5.036 0.036 1 0 "[ . 1 . 2]" 1
561 1 74 VAL MG2 1 84 GLN H 1.800 . 5.000 4.711 4.393 5.066 0.066 10 0 "[ . 1 . 2]" 1
562 1 4 GLN H 1 19 ASN QD 1.800 . 5.000 3.316 1.836 5.024 0.024 15 0 "[ . 1 . 2]" 1
563 1 6 THR H 1 19 ASN QB 1.800 . 5.000 3.981 3.316 4.404 . 0 0 "[ . 1 . 2]" 1
564 1 6 THR H 1 20 LEU QD 1.800 . 5.000 3.573 2.329 4.368 . 0 0 "[ . 1 . 2]" 1
565 1 7 LYS H 1 10 ASP HB3 1.800 . 4.270 3.332 2.531 4.081 . 0 0 "[ . 1 . 2]" 1
566 1 7 LYS H 1 10 ASP HB2 1.800 . 4.270 2.915 2.406 3.526 . 0 0 "[ . 1 . 2]" 1
567 1 7 LYS H 1 9 VAL MG1 1.800 . 5.270 4.677 4.398 5.005 . 0 0 "[ . 1 . 2]" 1
568 1 9 VAL H 1 45 THR HB 1.800 . 5.000 2.677 2.259 2.975 . 0 0 "[ . 1 . 2]" 1
569 1 9 VAL H 1 45 THR MG 1.800 . 5.000 3.664 3.327 3.949 . 0 0 "[ . 1 . 2]" 1
570 1 12 VAL H 1 16 GLN QE 1.800 . 5.000 3.920 3.165 4.789 . 0 0 "[ . 1 . 2]" 1
571 1 13 GLU H 1 16 GLN QE 1.800 . 4.750 4.243 3.046 4.784 0.034 10 0 "[ . 1 . 2]" 1
572 1 13 GLU H 1 16 GLN HE21 1.800 . 5.630 5.143 3.360 5.679 0.049 7 0 "[ . 1 . 2]" 1
573 1 13 GLU H 1 16 GLN HE22 1.800 . 5.630 4.551 3.431 5.255 . 0 0 "[ . 1 . 2]" 1
574 1 14 ASN H 1 81 PHE QE 1.800 . 5.500 3.492 2.567 4.371 . 0 0 "[ . 1 . 2]" 1
575 1 15 GLY H 1 73 VAL MG2 1.800 . 5.000 3.613 3.188 4.404 . 0 0 "[ . 1 . 2]" 1
576 1 15 GLY H 1 74 VAL HB 1.800 . 5.000 2.957 2.157 3.924 . 0 0 "[ . 1 . 2]" 1
577 1 15 GLY H 1 74 VAL MG1 1.800 . 5.000 3.714 2.955 5.023 0.023 10 0 "[ . 1 . 2]" 1
578 1 16 GLN H 1 74 VAL HB 1.800 . 5.000 2.821 2.113 4.835 . 0 0 "[ . 1 . 2]" 1
579 1 16 GLN H 1 74 VAL MG1 1.800 . 5.000 4.260 3.599 4.790 . 0 0 "[ . 1 . 2]" 1
580 1 18 ALA H 1 72 VAL MG2 1.800 . 5.000 2.951 2.776 3.144 . 0 0 "[ . 1 . 2]" 1
581 1 20 LEU H 1 68 LEU MD1 1.800 . 5.000 3.450 3.167 3.688 . 0 0 "[ . 1 . 2]" 1
582 1 20 LEU H 1 69 LEU HB3 1.800 . 5.000 3.828 3.543 4.357 . 0 0 "[ . 1 . 2]" 1
583 1 20 LEU H 1 72 VAL MG1 1.800 . 5.000 4.323 4.031 4.663 . 0 0 "[ . 1 . 2]" 1
584 1 22 ALA H 1 98 ILE MD 1.800 . 5.000 3.919 3.274 4.981 . 0 0 "[ . 1 . 2]" 1
585 1 23 LYS H 1 98 ILE MD 1.800 . 5.000 3.601 2.499 5.052 0.052 6 0 "[ . 1 . 2]" 1
586 1 23 LYS H 1 98 ILE MG 1.800 . 5.000 4.690 4.109 5.033 0.033 9 0 "[ . 1 . 2]" 1
587 1 24 VAL H 1 41 LEU MD2 1.800 . 5.000 3.690 3.541 3.861 . 0 0 "[ . 1 . 2]" 1
588 1 25 ILE H 1 41 LEU MD2 1.800 . 5.000 3.278 2.887 3.784 . 0 0 "[ . 1 . 2]" 1
589 1 26 GLN H 1 40 LEU QD 1.800 . 5.000 3.100 1.926 3.986 . 0 0 "[ . 1 . 2]" 1
590 1 27 LEU H 1 63 GLN HG3 1.800 . 5.000 4.495 3.127 5.016 0.016 13 0 "[ . 1 . 2]" 1
591 1 28 TRP H 1 38 VAL QG 1.800 . 5.000 3.552 2.985 4.339 . 0 0 "[ . 1 . 2]" 1
592 1 32 HIS H 1 35 ILE HB 1.800 . 4.960 3.956 2.660 4.690 . 0 0 "[ . 1 . 2]" 1
593 1 32 HIS H 1 35 ILE MD 1.800 . 5.510 5.001 3.130 5.630 0.120 4 0 "[ . 1 . 2]" 1
594 1 32 HIS H 1 35 ILE MG 1.800 . 5.690 4.592 3.593 5.327 . 0 0 "[ . 1 . 2]" 1
595 1 36 SER H 1 52 ILE MG 1.800 . 5.000 4.011 3.363 4.639 . 0 0 "[ . 1 . 2]" 1
596 1 37 GLN H 1 52 ILE HB 1.800 . 5.000 2.470 2.066 2.748 . 0 0 "[ . 1 . 2]" 1
597 1 37 GLN H 1 52 ILE MD 1.800 . 5.000 3.979 3.324 5.031 0.031 1 0 "[ . 1 . 2]" 1
598 1 37 GLN H 1 52 ILE HG13 1.800 . 5.000 4.428 3.998 4.597 . 0 0 "[ . 1 . 2]" 1
599 1 37 GLN H 1 52 ILE HG12 1.800 . 5.500 5.113 3.639 5.543 0.043 19 0 "[ . 1 . 2]" 1
600 1 40 LEU H 1 50 PHE QE 1.800 . 5.000 2.576 2.344 2.834 . 0 0 "[ . 1 . 2]" 1
601 1 41 LEU H 1 50 PHE QD 1.800 . 5.000 3.319 3.142 3.503 . 0 0 "[ . 1 . 2]" 1
602 1 43 ASP H 1 100 VAL MG1 1.800 . 5.000 3.540 2.709 4.978 . 0 0 "[ . 1 . 2]" 1
603 1 43 ASP H 1 47 ILE MG 1.800 . 5.000 3.947 3.071 4.988 . 0 0 "[ . 1 . 2]" 1
604 1 44 GLU H 1 98 ILE MG 1.800 . 5.000 3.499 2.632 4.812 . 0 0 "[ . 1 . 2]" 1
605 1 51 THR H 1 85 VAL MG2 1.800 . 5.000 3.662 3.161 4.120 . 0 0 "[ . 1 . 2]" 1
606 1 56 ALA H 1 58 LEU MD1 1.800 . 6.050 4.711 4.309 5.517 . 0 0 "[ . 1 . 2]" 1
607 1 62 GLU H 1 67 TYR QE 1.800 . 5.000 2.725 2.033 3.344 . 0 0 "[ . 1 . 2]" 1
608 1 65 GLU H 1 67 TYR QD 1.800 . 5.720 4.670 4.302 5.016 . 0 0 "[ . 1 . 2]" 1
609 1 65 GLU H 1 67 TYR QE 1.800 . 6.050 3.503 2.873 3.965 . 0 0 "[ . 1 . 2]" 1
610 1 66 SER H 1 93 LYS QG 1.800 . 5.000 4.468 3.700 5.073 0.073 12 0 "[ . 1 . 2]" 1
611 1 66 SER H 1 97 PRO HB3 1.800 . 5.000 4.375 3.827 4.718 . 0 0 "[ . 1 . 2]" 1
612 1 68 LEU H 1 92 GLU QG 1.800 . 5.000 4.677 4.476 4.925 . 0 0 "[ . 1 . 2]" 1
613 1 68 LEU H 1 94 LEU QD 1.800 . 5.000 2.992 2.561 3.876 . 0 0 "[ . 1 . 2]" 1
614 1 70 ARG H 1 90 SER QB 1.800 . 5.000 3.948 3.409 4.799 . 0 0 "[ . 1 . 2]" 1
615 1 73 VAL H 1 84 GLN HB2 1.800 . 5.000 3.879 3.556 4.255 . 0 0 "[ . 1 . 2]" 1
616 1 73 VAL H 1 86 ASN HD21 1.800 . 5.000 4.413 3.437 5.023 0.023 18 0 "[ . 1 . 2]" 1
617 1 86 ASN H 1 89 SER QB 1.800 . 4.040 2.581 1.795 3.375 0.005 14 0 "[ . 1 . 2]" 1
618 1 92 GLU H 1 94 LEU QD 1.800 . 4.730 4.216 3.800 4.863 0.133 14 0 "[ . 1 . 2]" 1
619 1 5 LEU HA 1 19 ASN HB3 1.800 . 5.000 3.648 2.820 3.986 . 0 0 "[ . 1 . 2]" 1
620 1 5 LEU HA 1 19 ASN QB 1.800 . 5.000 2.616 2.322 3.140 . 0 0 "[ . 1 . 2]" 1
621 1 5 LEU HA 1 19 ASN HB2 1.800 . 5.000 2.919 2.342 4.904 . 0 0 "[ . 1 . 2]" 1
622 1 5 LEU MD2 1 19 ASN HA 1.800 . 5.000 4.753 4.365 5.067 0.067 8 0 "[ . 1 . 2]" 1
623 1 5 LEU MD2 1 20 LEU HA 1.800 . 5.000 3.914 2.550 4.890 . 0 0 "[ . 1 . 2]" 1
624 1 6 THR MG 1 11 ILE HA 1.800 . 5.000 3.918 3.671 4.661 . 0 0 "[ . 1 . 2]" 1
625 1 7 LYS HA 1 45 THR MG 1.800 . 5.000 3.322 2.310 4.079 . 0 0 "[ . 1 . 2]" 1
626 1 7 LYS HA 1 9 VAL MG1 1.800 . 5.600 4.412 4.361 4.520 . 0 0 "[ . 1 . 2]" 1
627 1 8 ILE MD 1 47 ILE HA 1.800 . 5.000 3.334 2.629 4.686 . 0 0 "[ . 1 . 2]" 1
628 1 8 ILE MG 1 48 ILE HA 1.800 . 5.000 3.819 3.460 4.172 . 0 0 "[ . 1 . 2]" 1
629 1 9 VAL HA 1 45 THR HB 1.800 . 5.000 4.925 4.541 5.041 0.041 14 0 "[ . 1 . 2]" 1
630 1 9 VAL HB 1 45 THR HA 1.800 . 5.000 4.578 4.001 5.006 0.006 20 0 "[ . 1 . 2]" 1
631 1 9 VAL MG1 1 45 THR HA 1.800 . 5.000 4.408 3.771 4.884 . 0 0 "[ . 1 . 2]" 1
632 1 10 ASP HA 1 12 VAL MG1 1.800 . 4.410 3.728 3.273 4.354 . 0 0 "[ . 1 . 2]" 1
633 1 11 ILE HA 1 16 GLN QE 1.800 . 5.000 3.364 2.038 4.549 . 0 0 "[ . 1 . 2]" 1
634 1 12 VAL HA 1 81 PHE QE 1.800 . 5.000 3.801 2.733 5.008 0.008 13 0 "[ . 1 . 2]" 1
635 1 13 GLU HA 1 81 PHE QE 1.800 . 5.000 3.896 2.845 4.666 . 0 0 "[ . 1 . 2]" 1
636 1 13 GLU HA 1 81 PHE HZ 1.800 . 5.000 4.413 2.919 5.016 0.016 12 0 "[ . 1 . 2]" 1
637 1 14 ASN HA 1 74 VAL HB 1.800 . 5.000 3.223 2.496 4.389 . 0 0 "[ . 1 . 2]" 1
638 1 14 ASN HA 1 74 VAL MG1 1.800 . 5.000 3.222 2.275 4.966 . 0 0 "[ . 1 . 2]" 1
639 1 15 GLY HA3 1 73 VAL MG2 1.800 . 5.000 3.739 3.409 4.412 . 0 0 "[ . 1 . 2]" 1
640 1 15 GLY HA2 1 73 VAL MG2 1.800 . 5.000 2.419 2.105 3.012 . 0 0 "[ . 1 . 2]" 1
641 1 15 GLY QA 1 17 TRP HE1 1.800 . 5.600 4.586 3.808 5.630 0.030 3 0 "[ . 1 . 2]" 1
642 1 15 GLY QA 1 73 VAL MG2 1.800 . 5.000 2.389 2.088 2.964 . 0 0 "[ . 1 . 2]" 1
643 1 17 TRP HA 1 72 VAL MG2 1.800 . 5.000 4.160 4.037 4.315 . 0 0 "[ . 1 . 2]" 1
644 1 17 TRP HA 1 73 VAL MG2 1.800 . 5.000 3.868 3.664 4.119 . 0 0 "[ . 1 . 2]" 1
645 1 17 TRP HA 1 74 VAL MG2 1.800 . 5.000 4.151 3.839 4.405 . 0 0 "[ . 1 . 2]" 1
646 1 17 TRP HE3 1 71 SER HA 1.800 . 5.000 3.360 2.895 4.022 . 0 0 "[ . 1 . 2]" 1
647 1 19 ASN HA 1 72 VAL MG1 1.800 . 5.000 4.167 3.962 4.549 . 0 0 "[ . 1 . 2]" 1
648 1 19 ASN QB 1 70 ARG HA 1.800 . 5.000 3.032 2.689 3.440 . 0 0 "[ . 1 . 2]" 1
649 1 21 LYS HA 1 68 LEU MD1 1.800 . 5.000 3.139 2.812 3.412 . 0 0 "[ . 1 . 2]" 1
650 1 21 LYS QG 1 68 LEU HA 1.800 . 5.000 2.815 2.375 3.286 . 0 0 "[ . 1 . 2]" 1
651 1 22 ALA HA 1 98 ILE MD 1.800 . 5.000 2.707 2.067 4.287 . 0 0 "[ . 1 . 2]" 1
652 1 22 ALA HA 1 98 ILE MG 1.800 . 5.000 4.097 3.638 4.405 . 0 0 "[ . 1 . 2]" 1
653 1 23 LYS QE 1 64 GLY QA 1.800 . 5.000 3.013 2.063 4.854 . 0 0 "[ . 1 . 2]" 1
654 1 24 VAL HA 1 41 LEU MD2 1.800 . 5.000 2.109 2.037 2.263 . 0 0 "[ . 1 . 2]" 1
655 1 24 VAL HB 1 63 GLN HA 1.800 . 5.000 2.668 2.326 3.184 . 0 0 "[ . 1 . 2]" 1
656 1 24 VAL MG1 1 26 GLN HA 1.800 . 5.150 3.714 3.232 4.121 . 0 0 "[ . 1 . 2]" 1
657 1 24 VAL MG1 1 63 GLN HA 1.800 . 5.000 2.352 2.099 3.138 . 0 0 "[ . 1 . 2]" 1
658 1 24 VAL MG2 1 61 LEU HA 1.800 . 5.300 4.611 4.208 5.213 . 0 0 "[ . 1 . 2]" 1
659 1 25 ILE MD 1 42 GLY HA3 1.800 . 5.000 2.387 2.060 2.993 . 0 0 "[ . 1 . 2]" 1
660 1 25 ILE MD 1 42 GLY HA2 1.800 . 5.000 3.116 2.319 4.460 . 0 0 "[ . 1 . 2]" 1
661 1 26 GLN HA 1 63 GLN HE21 1.800 . 5.000 3.361 1.778 4.671 0.022 9 0 "[ . 1 . 2]" 1
662 1 26 GLN HA 1 63 GLN HE22 1.800 . 5.000 3.759 2.718 5.012 0.012 8 0 "[ . 1 . 2]" 1
663 1 26 GLN HA 1 63 GLN HG3 1.800 . 5.000 3.480 2.323 4.571 . 0 0 "[ . 1 . 2]" 1
664 1 27 LEU MD1 1 62 GLU HA 1.800 . 5.000 4.067 3.295 4.907 . 0 0 "[ . 1 . 2]" 1
665 1 27 LEU MD1 1 63 GLN HA 1.800 . 5.000 4.016 3.049 4.833 . 0 0 "[ . 1 . 2]" 1
666 1 27 LEU MD2 1 63 GLN HA 1.800 . 5.000 3.586 2.522 4.751 . 0 0 "[ . 1 . 2]" 1
667 1 29 GLU HA 1 37 GLN QG 1.800 . 5.000 2.970 2.133 4.823 . 0 0 "[ . 1 . 2]" 1
668 1 30 ASN HA 1 38 VAL QG 1.800 . 5.000 4.212 3.151 5.001 0.001 12 0 "[ . 1 . 2]" 1
669 1 35 ILE HA 1 53 TRP HE3 1.800 . 5.000 4.024 3.068 4.960 . 0 0 "[ . 1 . 2]" 1
670 1 35 ILE MG 1 38 VAL HA 1.800 . 4.880 4.189 3.664 4.575 . 0 0 "[ . 1 . 2]" 1
671 1 36 SER HA 1 54 LYS HG2 1.800 . 5.000 4.177 2.665 5.008 0.008 12 0 "[ . 1 . 2]" 1
672 1 38 VAL HA 1 51 THR MG 1.800 . 5.000 4.205 3.485 5.062 0.062 14 0 "[ . 1 . 2]" 1
673 1 38 VAL QG 1 51 THR HA 1.800 . 5.000 2.850 2.262 3.426 . 0 0 "[ . 1 . 2]" 1
674 1 40 LEU HA 1 50 PHE QD 1.800 . 5.000 2.427 2.267 2.697 . 0 0 "[ . 1 . 2]" 1
675 1 40 LEU HB2 1 49 LYS HA 1.800 . 5.000 3.718 3.141 4.418 . 0 0 "[ . 1 . 2]" 1
676 1 40 LEU QD 1 42 GLY HA3 1.800 . 5.550 4.929 3.821 5.565 0.015 3 0 "[ . 1 . 2]" 1
677 1 40 LEU QD 1 49 LYS HA 1.800 . 5.000 4.228 3.639 4.474 . 0 0 "[ . 1 . 2]" 1
678 1 42 GLY HA3 1 100 VAL MG1 1.800 . 5.000 3.650 2.694 4.711 . 0 0 "[ . 1 . 2]" 1
679 1 42 GLY HA3 1 47 ILE MG 1.800 . 5.000 3.868 2.936 4.556 . 0 0 "[ . 1 . 2]" 1
680 1 42 GLY HA2 1 100 VAL MG1 1.800 . 5.000 4.479 3.791 5.028 0.028 4 0 "[ . 1 . 2]" 1
681 1 42 GLY HA2 1 47 ILE MG 1.800 . 5.000 2.688 2.268 3.294 . 0 0 "[ . 1 . 2]" 1
682 1 43 ASP HA 1 100 VAL MG1 1.800 . 5.000 3.499 2.217 4.576 . 0 0 "[ . 1 . 2]" 1
683 1 43 ASP HA 1 98 ILE MD 1.800 . 5.000 4.006 2.200 5.035 0.035 3 0 "[ . 1 . 2]" 1
684 1 43 ASP HA 1 98 ILE MG 1.800 . 5.000 3.411 2.390 4.825 . 0 0 "[ . 1 . 2]" 1
685 1 44 GLU HA 1 100 VAL MG1 1.800 . 5.000 3.610 2.294 5.010 0.010 3 0 "[ . 1 . 2]" 1
686 1 48 ILE MD 1 82 GLN HA 1.800 . 5.000 2.856 2.190 3.655 . 0 0 "[ . 1 . 2]" 1
687 1 50 PHE HA 1 83 VAL MG2 1.800 . 5.000 2.396 2.210 2.631 . 0 0 "[ . 1 . 2]" 1
688 1 51 THR HB 1 84 GLN HA 1.800 . 5.000 3.861 3.080 4.984 . 0 0 "[ . 1 . 2]" 1
689 1 51 THR MG 1 53 TRP HA 1.800 . 5.510 4.366 3.769 5.456 . 0 0 "[ . 1 . 2]" 1
690 1 52 ILE HA 1 85 VAL HB 1.800 . 5.000 2.423 2.304 2.710 . 0 0 "[ . 1 . 2]" 1
691 1 52 ILE HA 1 85 VAL MG1 1.800 . 5.000 3.931 3.750 4.241 . 0 0 "[ . 1 . 2]" 1
692 1 52 ILE HA 1 85 VAL MG2 1.800 . 5.000 3.440 2.963 3.922 . 0 0 "[ . 1 . 2]" 1
693 1 52 ILE MG 1 54 LYS HA 1.800 . 4.350 3.840 3.251 4.123 . 0 0 "[ . 1 . 2]" 1
694 1 53 TRP HD1 1 86 ASN HA 1.800 . 5.000 3.883 3.449 4.257 . 0 0 "[ . 1 . 2]" 1
695 1 53 TRP HE1 1 84 GLN HA 1.800 . 5.000 3.313 2.668 4.023 . 0 0 "[ . 1 . 2]" 1
696 1 56 ALA MB 1 58 LEU HA 1.800 . 5.950 4.687 4.357 5.740 . 0 0 "[ . 1 . 2]" 1
697 1 58 LEU MD1 1 90 SER HA 1.800 . 5.000 4.162 2.734 5.043 0.043 6 0 "[ . 1 . 2]" 1
698 1 58 LEU MD2 1 90 SER HA 1.800 . 5.000 3.848 2.234 4.559 . 0 0 "[ . 1 . 2]" 1
699 1 66 SER HA 1 98 ILE MD 1.800 . 5.000 4.228 3.370 5.019 0.019 11 0 "[ . 1 . 2]" 1
700 1 66 SER QB 1 97 PRO HA 1.800 . 5.000 2.609 2.264 3.200 . 0 0 "[ . 1 . 2]" 1
701 1 67 TYR HA 1 94 LEU QD 1.800 . 5.000 3.099 2.498 4.028 . 0 0 "[ . 1 . 2]" 1
702 1 67 TYR HB3 1 93 LYS HA 1.800 . 5.000 4.607 4.288 4.877 . 0 0 "[ . 1 . 2]" 1
703 1 67 TYR QD 1 93 LYS HA 1.800 . 5.000 2.734 2.314 3.511 . 0 0 "[ . 1 . 2]" 1
704 1 67 TYR QE 1 93 LYS HA 1.800 . 5.000 3.336 2.631 4.274 . 0 0 "[ . 1 . 2]" 1
705 1 68 LEU MD1 1 70 ARG HA 1.800 . 4.370 4.224 3.331 4.424 0.054 8 0 "[ . 1 . 2]" 1
706 1 69 LEU MD2 1 91 ILE HA 1.800 . 5.000 3.247 2.696 4.645 . 0 0 "[ . 1 . 2]" 1
707 1 70 ARG HA 1 72 VAL MG1 1.800 . 5.050 3.990 3.810 4.225 . 0 0 "[ . 1 . 2]" 1
708 1 71 SER QB 1 89 SER HA 1.800 . 5.000 2.544 2.255 3.751 . 0 0 "[ . 1 . 2]" 1
709 1 72 VAL MG1 1 85 VAL HA 1.800 . 5.000 2.635 2.251 2.946 . 0 0 "[ . 1 . 2]" 1
710 1 72 VAL MG2 1 85 VAL HA 1.800 . 5.500 5.045 4.703 5.341 . 0 0 "[ . 1 . 2]" 1
711 1 73 VAL MG1 1 84 GLN HA 1.800 . 5.000 4.610 4.340 4.980 . 0 0 "[ . 1 . 2]" 1
712 1 74 VAL MG2 1 83 VAL HA 1.800 . 5.000 3.582 3.167 4.534 . 0 0 "[ . 1 . 2]" 1
713 1 91 ILE MG 1 93 LYS HA 1.800 . 5.510 4.190 3.982 4.390 . 0 0 "[ . 1 . 2]" 1
714 1 95 SER HA 1 97 PRO HD3 1.800 . 5.010 4.190 3.746 5.054 0.044 16 0 "[ . 1 . 2]" 1
715 1 3 PRO QB 1 19 ASN QD 1.800 . 5.000 2.918 1.778 4.993 0.022 20 0 "[ . 1 . 2]" 1
716 1 3 PRO QD 1 68 LEU MD2 1.800 . 5.000 4.614 3.922 5.018 0.018 17 0 "[ . 1 . 2]" 1
717 1 3 PRO HG3 1 68 LEU MD1 1.800 . 5.000 4.210 3.181 4.975 . 0 0 "[ . 1 . 2]" 1
718 1 3 PRO HG2 1 68 LEU MD1 1.800 . 5.000 4.201 3.595 4.822 . 0 0 "[ . 1 . 2]" 1
719 1 3 PRO QG 1 5 LEU MD2 1.800 . 4.820 2.712 2.141 4.015 . 0 0 "[ . 1 . 2]" 1
720 1 3 PRO QG 1 68 LEU MD1 1.800 . 5.000 3.718 2.997 4.122 . 0 0 "[ . 1 . 2]" 1
721 1 3 PRO QG 1 68 LEU MD2 1.800 . 5.000 3.094 2.414 3.691 . 0 0 "[ . 1 . 2]" 1
722 1 5 LEU MD1 1 21 LYS QB 1.800 . 5.000 3.331 2.028 4.694 . 0 0 "[ . 1 . 2]" 1
723 1 5 LEU MD1 1 21 LYS QE 1.800 . 5.000 3.089 2.286 4.134 . 0 0 "[ . 1 . 2]" 1
724 1 5 LEU MD1 1 68 LEU MD1 1.800 . 5.000 3.807 2.495 4.680 . 0 0 "[ . 1 . 2]" 1
725 1 5 LEU MD2 1 19 ASN HB3 1.800 . 5.000 2.916 2.572 3.748 . 0 0 "[ . 1 . 2]" 1
726 1 5 LEU MD2 1 19 ASN HB2 1.800 . 5.000 2.778 2.319 4.910 . 0 0 "[ . 1 . 2]" 1
727 1 6 THR HB 1 18 ALA MB 1.800 . 5.000 2.950 2.550 3.297 . 0 0 "[ . 1 . 2]" 1
728 1 6 THR HB 1 20 LEU QD 1.800 . 5.000 3.256 2.116 4.957 . 0 0 "[ . 1 . 2]" 1
729 1 6 THR MG 1 10 ASP HB3 1.800 . 5.000 2.814 2.093 4.590 . 0 0 "[ . 1 . 2]" 1
730 1 6 THR MG 1 10 ASP QB 1.800 . 5.000 2.474 2.066 3.554 . 0 0 "[ . 1 . 2]" 1
731 1 6 THR MG 1 10 ASP HB2 1.800 . 5.000 3.185 2.366 4.234 . 0 0 "[ . 1 . 2]" 1
732 1 6 THR MG 1 11 ILE MD 1.800 . 5.000 3.351 2.294 3.966 . 0 0 "[ . 1 . 2]" 1
733 1 6 THR MG 1 11 ILE HG13 1.800 . 5.000 3.008 2.396 4.684 . 0 0 "[ . 1 . 2]" 1
734 1 6 THR MG 1 11 ILE HG12 1.800 . 5.000 3.124 2.834 3.561 . 0 0 "[ . 1 . 2]" 1
735 1 6 THR MG 1 16 GLN QE 1.800 . 5.000 3.038 2.123 3.805 . 0 0 "[ . 1 . 2]" 1
736 1 6 THR MG 1 16 GLN HE21 1.800 . 5.000 3.568 2.242 4.839 . 0 0 "[ . 1 . 2]" 1
737 1 6 THR MG 1 16 GLN HE22 1.800 . 5.000 3.386 2.435 4.149 . 0 0 "[ . 1 . 2]" 1
738 1 6 THR MG 1 18 ALA MB 1.800 . 5.000 3.132 2.398 3.403 . 0 0 "[ . 1 . 2]" 1
739 1 6 THR MG 1 20 LEU QD 1.800 . 5.000 3.427 2.484 4.177 . 0 0 "[ . 1 . 2]" 1
740 1 6 THR MG 1 9 VAL MG1 1.800 . 5.740 5.245 4.947 5.780 0.040 2 0 "[ . 1 . 2]" 1
741 1 7 LYS QB 1 10 ASP QB 1.800 . 4.840 2.471 2.194 2.885 . 0 0 "[ . 1 . 2]" 1
742 1 7 LYS QB 1 45 THR MG 1.800 . 5.000 2.362 2.119 2.716 . 0 0 "[ . 1 . 2]" 1
743 1 7 LYS QD 1 45 THR MG 1.800 . 5.000 2.716 2.243 4.261 . 0 0 "[ . 1 . 2]" 1
744 1 7 LYS QD 1 9 VAL MG1 1.800 . 5.350 3.227 2.903 4.677 . 0 0 "[ . 1 . 2]" 1
745 1 7 LYS QE 1 45 THR MG 1.800 . 5.000 3.636 2.023 4.774 . 0 0 "[ . 1 . 2]" 1
746 1 7 LYS QG 1 45 THR MG 1.800 . 5.000 2.676 2.207 3.755 . 0 0 "[ . 1 . 2]" 1
747 1 7 LYS QG 1 9 VAL MG1 1.800 . 4.810 3.876 3.441 4.059 . 0 0 "[ . 1 . 2]" 1
748 1 8 ILE MD 1 22 ALA MB 1.800 . 5.000 3.547 2.904 4.159 . 0 0 "[ . 1 . 2]" 1
749 1 8 ILE MD 1 43 ASP QB 1.800 . 5.000 2.320 1.997 3.797 . 0 0 "[ . 1 . 2]" 1
750 1 8 ILE MG 1 48 ILE HB 1.800 . 5.000 2.477 2.184 2.954 . 0 0 "[ . 1 . 2]" 1
751 1 8 ILE MG 1 48 ILE MD 1.800 . 5.000 2.520 2.146 3.836 . 0 0 "[ . 1 . 2]" 1
752 1 8 ILE MG 1 48 ILE MG 1.800 . 5.000 3.605 3.269 4.050 . 0 0 "[ . 1 . 2]" 1
753 1 9 VAL HB 1 45 THR HB 1.800 . 5.000 3.193 2.580 3.650 . 0 0 "[ . 1 . 2]" 1
754 1 9 VAL HB 1 45 THR MG 1.800 . 5.000 4.313 3.769 4.793 . 0 0 "[ . 1 . 2]" 1
755 1 9 VAL MG1 1 45 THR HB 1.800 . 5.000 3.016 2.275 3.376 . 0 0 "[ . 1 . 2]" 1
756 1 9 VAL MG1 1 45 THR MG 1.800 . 5.000 3.160 2.579 3.535 . 0 0 "[ . 1 . 2]" 1
757 1 9 VAL MG2 1 45 THR HB 1.800 . 5.000 4.661 4.156 5.031 0.031 19 0 "[ . 1 . 2]" 1
758 1 11 ILE HB 1 48 ILE MD 1.800 . 5.000 4.357 3.647 4.979 . 0 0 "[ . 1 . 2]" 1
759 1 11 ILE MD 1 48 ILE HB 1.800 . 5.000 4.290 3.625 5.013 0.013 19 0 "[ . 1 . 2]" 1
760 1 11 ILE MD 1 48 ILE MD 1.800 . 5.000 2.513 1.946 3.230 . 0 0 "[ . 1 . 2]" 1
761 1 11 ILE MD 1 48 ILE MG 1.800 . 5.000 4.169 3.649 4.673 . 0 0 "[ . 1 . 2]" 1
762 1 11 ILE HG13 1 83 VAL MG1 1.800 . 5.500 5.433 4.729 5.544 0.044 3 0 "[ . 1 . 2]" 1
763 1 11 ILE MG 1 16 GLN QE 1.800 . 5.000 3.980 2.437 5.013 0.013 8 0 "[ . 1 . 2]" 1
764 1 11 ILE MG 1 48 ILE MD 1.800 . 5.000 3.657 3.090 4.172 . 0 0 "[ . 1 . 2]" 1
765 1 11 ILE MG 1 74 VAL MG1 1.800 . 5.000 2.278 1.972 2.944 . 0 0 "[ . 1 . 2]" 1
766 1 11 ILE MG 1 74 VAL MG2 1.800 . 5.000 3.091 2.080 3.894 . 0 0 "[ . 1 . 2]" 1
767 1 11 ILE MG 1 81 PHE HB3 1.800 . 5.000 2.640 2.224 3.366 . 0 0 "[ . 1 . 2]" 1
768 1 11 ILE MG 1 81 PHE HB2 1.800 . 5.000 2.923 2.118 3.631 . 0 0 "[ . 1 . 2]" 1
769 1 11 ILE MG 1 81 PHE QD 1.800 . 5.000 2.925 2.508 3.635 . 0 0 "[ . 1 . 2]" 1
770 1 12 VAL MG2 1 16 GLN QE 1.800 . 5.000 4.363 3.664 5.027 0.027 16 0 "[ . 1 . 2]" 1
771 1 16 GLN QB 1 18 ALA MB 1.800 . 4.750 4.280 3.457 4.521 . 0 0 "[ . 1 . 2]" 1
772 1 16 GLN QB 1 74 VAL MG2 1.800 . 5.000 2.718 2.189 4.010 . 0 0 "[ . 1 . 2]" 1
773 1 16 GLN HE21 1 18 ALA MB 1.800 . 5.200 3.976 2.844 5.204 0.004 6 0 "[ . 1 . 2]" 1
774 1 16 GLN HE22 1 18 ALA MB 1.800 . 5.200 4.671 4.063 5.279 0.079 15 0 "[ . 1 . 2]" 1
775 1 16 GLN HG3 1 74 VAL MG2 1.800 . 5.000 4.427 2.118 5.022 0.022 13 0 "[ . 1 . 2]" 1
776 1 16 GLN HG2 1 18 ALA MB 1.800 . 5.310 3.472 2.839 5.265 . 0 0 "[ . 1 . 2]" 1
777 1 17 TRP HD1 1 73 VAL MG2 1.800 . 5.000 4.182 3.825 4.791 . 0 0 "[ . 1 . 2]" 1
778 1 17 TRP HE1 1 73 VAL MG2 1.800 . 5.000 3.390 2.966 4.122 . 0 0 "[ . 1 . 2]" 1
779 1 17 TRP HZ2 1 73 VAL MG1 1.800 . 5.000 4.113 3.471 5.007 0.007 20 0 "[ . 1 . 2]" 1
780 1 18 ALA MB 1 20 LEU QD 1.800 . 5.080 4.492 2.679 5.047 . 0 0 "[ . 1 . 2]" 1
781 1 18 ALA MB 1 72 VAL MG2 1.800 . 5.000 3.820 3.523 3.988 . 0 0 "[ . 1 . 2]" 1
782 1 19 ASN HB3 1 68 LEU MD1 1.800 . 5.000 3.079 2.472 4.293 . 0 0 "[ . 1 . 2]" 1
783 1 19 ASN HB2 1 68 LEU MD1 1.800 . 5.000 4.053 3.562 4.457 . 0 0 "[ . 1 . 2]" 1
784 1 20 LEU HB3 1 69 LEU HB2 1.800 . 5.000 2.876 2.338 4.801 . 0 0 "[ . 1 . 2]" 1
785 1 20 LEU HB3 1 69 LEU MD1 1.800 . 5.000 2.709 2.272 4.157 . 0 0 "[ . 1 . 2]" 1
786 1 20 LEU HB2 1 69 LEU HB2 1.800 . 5.000 3.958 2.843 4.813 . 0 0 "[ . 1 . 2]" 1
787 1 20 LEU HB2 1 69 LEU MD1 1.800 . 5.000 3.962 2.739 4.840 . 0 0 "[ . 1 . 2]" 1
788 1 20 LEU HB2 1 72 VAL MG2 1.800 . 5.000 3.324 2.629 3.908 . 0 0 "[ . 1 . 2]" 1
789 1 21 LYS QB 1 68 LEU MD1 1.800 . 5.000 2.302 2.200 3.546 . 0 0 "[ . 1 . 2]" 1
790 1 21 LYS QB 1 68 LEU MD2 1.800 . 5.000 4.104 2.238 4.339 . 0 0 "[ . 1 . 2]" 1
791 1 21 LYS HD3 1 66 SER QB 1.800 . 5.000 4.786 3.547 5.061 0.061 12 0 "[ . 1 . 2]" 1
792 1 21 LYS HD3 1 94 LEU QD 1.800 . 5.000 2.877 2.154 4.068 . 0 0 "[ . 1 . 2]" 1
793 1 21 LYS HD2 1 94 LEU QD 1.800 . 5.000 3.294 2.061 4.994 . 0 0 "[ . 1 . 2]" 1
794 1 21 LYS HD2 1 98 ILE MD 1.800 . 5.000 3.413 2.288 4.903 . 0 0 "[ . 1 . 2]" 1
795 1 21 LYS QE 1 66 SER QB 1.800 . 5.500 5.170 4.673 5.538 0.038 6 0 "[ . 1 . 2]" 1
796 1 21 LYS QE 1 68 LEU MD2 1.800 . 5.000 3.939 1.981 5.026 0.026 1 0 "[ . 1 . 2]" 1
797 1 21 LYS QE 1 94 LEU QD 1.800 . 5.000 3.258 2.023 4.717 . 0 0 "[ . 1 . 2]" 1
798 1 21 LYS QE 1 98 ILE MD 1.800 . 5.000 3.584 2.251 5.073 0.073 9 0 "[ . 1 . 2]" 1
799 1 21 LYS QG 1 68 LEU MD1 1.800 . 5.000 3.145 2.372 4.076 . 0 0 "[ . 1 . 2]" 1
800 1 22 ALA MB 1 41 LEU MD1 1.800 . 5.000 2.381 2.244 2.561 . 0 0 "[ . 1 . 2]" 1
801 1 22 ALA MB 1 41 LEU MD2 1.800 . 5.000 3.361 3.179 3.492 . 0 0 "[ . 1 . 2]" 1
802 1 22 ALA MB 1 43 ASP QB 1.800 . 5.000 2.728 2.231 3.777 . 0 0 "[ . 1 . 2]" 1
803 1 22 ALA MB 1 98 ILE MG 1.800 . 5.000 4.947 4.616 5.074 0.074 18 0 "[ . 1 . 2]" 1
804 1 23 LYS QB 1 100 VAL MG2 1.800 . 5.000 4.364 2.942 5.027 0.027 9 0 "[ . 1 . 2]" 1
805 1 23 LYS QB 1 98 ILE MD 1.800 . 5.000 3.160 2.277 4.102 . 0 0 "[ . 1 . 2]" 1
806 1 23 LYS QB 1 98 ILE MG 1.800 . 5.000 3.947 3.399 5.011 0.011 7 0 "[ . 1 . 2]" 1
807 1 24 VAL MG1 1 27 LEU HB3 1.800 . 5.010 3.124 2.375 4.524 . 0 0 "[ . 1 . 2]" 1
808 1 24 VAL MG1 1 27 LEU HB2 1.800 . 5.040 4.194 2.199 4.998 . 0 0 "[ . 1 . 2]" 1
809 1 24 VAL MG1 1 41 LEU MD2 1.800 . 5.000 2.774 2.477 2.919 . 0 0 "[ . 1 . 2]" 1
810 1 24 VAL MG1 1 50 PHE QE 1.800 . 5.500 3.588 2.640 4.121 . 0 0 "[ . 1 . 2]" 1
811 1 24 VAL MG1 1 50 PHE HZ 1.800 . 5.500 3.465 2.756 4.175 . 0 0 "[ . 1 . 2]" 1
812 1 24 VAL MG1 1 61 LEU MD2 1.800 . 5.000 4.038 3.426 5.046 0.046 12 0 "[ . 1 . 2]" 1
813 1 24 VAL MG1 1 63 GLN QB 1.800 . 5.000 3.456 3.030 4.137 . 0 0 "[ . 1 . 2]" 1
814 1 24 VAL MG1 1 63 GLN HG3 1.800 . 5.000 3.012 2.307 4.180 . 0 0 "[ . 1 . 2]" 1
815 1 24 VAL MG2 1 41 LEU MD2 1.800 . 5.000 2.021 1.906 2.296 . 0 0 "[ . 1 . 2]" 1
816 1 24 VAL MG2 1 61 LEU HB3 1.800 . 5.000 2.436 2.260 2.925 . 0 0 "[ . 1 . 2]" 1
817 1 24 VAL MG2 1 61 LEU MD1 1.800 . 5.000 4.350 3.025 4.819 . 0 0 "[ . 1 . 2]" 1
818 1 24 VAL MG2 1 61 LEU MD2 1.800 . 5.000 2.655 2.240 4.480 . 0 0 "[ . 1 . 2]" 1
819 1 24 VAL MG2 1 61 LEU HG 1.800 . 5.000 4.018 3.498 4.791 . 0 0 "[ . 1 . 2]" 1
820 1 24 VAL MG2 1 67 TYR QD 1.800 . 5.000 2.198 2.069 2.413 . 0 0 "[ . 1 . 2]" 1
821 1 24 VAL MG2 1 67 TYR QE 1.800 . 5.000 2.676 2.257 3.460 . 0 0 "[ . 1 . 2]" 1
822 1 25 ILE HB 1 40 LEU QD 1.800 . 5.000 2.883 2.048 4.668 . 0 0 "[ . 1 . 2]" 1
823 1 25 ILE HG13 1 40 LEU QD 1.800 . 5.000 3.662 2.368 4.718 . 0 0 "[ . 1 . 2]" 1
824 1 25 ILE HG13 1 47 ILE MG 1.800 . 5.000 4.708 3.892 5.024 0.024 18 0 "[ . 1 . 2]" 1
825 1 26 GLN QB 1 40 LEU MD1 1.800 . 5.000 3.376 2.214 4.068 . 0 0 "[ . 1 . 2]" 1
826 1 26 GLN QB 1 40 LEU QD 1.800 . 5.000 2.477 2.174 3.684 . 0 0 "[ . 1 . 2]" 1
827 1 26 GLN QB 1 40 LEU MD2 1.800 . 5.000 2.710 2.201 5.055 0.055 17 0 "[ . 1 . 2]" 1
828 1 27 LEU MD1 1 37 GLN QE 1.800 . 5.000 2.698 1.785 3.981 0.015 8 0 "[ . 1 . 2]" 1
829 1 27 LEU MD1 1 37 GLN HE21 1.800 . 5.000 3.538 2.199 5.008 0.008 17 0 "[ . 1 . 2]" 1
830 1 27 LEU MD1 1 37 GLN HE22 1.800 . 5.000 2.886 1.799 4.178 0.001 8 0 "[ . 1 . 2]" 1
831 1 27 LEU MD1 1 63 GLN QB 1.800 . 5.000 3.272 2.567 4.183 . 0 0 "[ . 1 . 2]" 1
832 1 27 LEU MD1 1 63 GLN HG3 1.800 . 5.000 4.400 2.568 5.041 0.041 12 0 "[ . 1 . 2]" 1
833 1 27 LEU MD2 1 37 GLN QE 1.800 . 5.000 4.281 2.017 4.998 . 0 0 "[ . 1 . 2]" 1
834 1 27 LEU MD2 1 63 GLN HG2 1.800 . 5.000 4.122 2.048 5.100 0.100 3 0 "[ . 1 . 2]" 1
835 1 27 LEU HG 1 63 GLN QB 1.800 . 5.000 4.514 3.696 5.036 0.036 9 0 "[ . 1 . 2]" 1
836 1 28 TRP HB3 1 38 VAL QG 1.800 . 5.000 3.713 2.527 4.634 . 0 0 "[ . 1 . 2]" 1
837 1 28 TRP HB2 1 38 VAL QG 1.800 . 5.000 3.141 2.184 4.726 . 0 0 "[ . 1 . 2]" 1
838 1 28 TRP HE3 1 38 VAL QG 1.800 . 5.500 3.605 2.176 5.546 0.046 5 0 "[ . 1 . 2]" 1
839 1 30 ASN QB 1 35 ILE MG 1.800 . 5.000 2.897 2.133 4.833 . 0 0 "[ . 1 . 2]" 1
840 1 30 ASN QB 1 38 VAL QG 1.800 . 5.000 2.819 2.243 5.014 0.014 16 0 "[ . 1 . 2]" 1
841 1 30 ASN HD21 1 35 ILE HB 1.800 . 5.000 2.641 1.798 4.848 0.002 14 0 "[ . 1 . 2]" 1
842 1 30 ASN HD21 1 35 ILE MG 1.800 . 5.000 2.694 1.767 4.216 0.033 5 0 "[ . 1 . 2]" 1
843 1 30 ASN HD22 1 32 HIS QB 1.800 . 5.140 2.759 1.826 4.589 . 0 0 "[ . 1 . 2]" 1
844 1 30 ASN HD22 1 35 ILE HB 1.800 . 5.000 2.788 1.805 4.195 . 0 0 "[ . 1 . 2]" 1
845 1 30 ASN HD22 1 35 ILE MG 1.800 . 5.000 3.112 1.753 4.707 0.047 7 0 "[ . 1 . 2]" 1
846 1 32 HIS QB 1 35 ILE HB 1.800 . 4.370 2.730 2.114 3.291 . 0 0 "[ . 1 . 2]" 1
847 1 32 HIS QB 1 35 ILE MD 1.800 . 3.880 3.192 2.261 3.878 . 0 0 "[ . 1 . 2]" 1
848 1 32 HIS QB 1 35 ILE QG 1.800 . 4.600 3.773 2.943 4.633 0.033 3 0 "[ . 1 . 2]" 1
849 1 32 HIS HD2 1 35 ILE MD 1.800 . 4.580 3.959 2.756 4.603 0.023 14 0 "[ . 1 . 2]" 1
850 1 35 ILE HB 1 38 VAL QG 1.800 . 5.260 4.524 3.715 5.254 . 0 0 "[ . 1 . 2]" 1
851 1 35 ILE MD 1 38 VAL QG 1.800 . 4.500 3.493 2.829 4.182 . 0 0 "[ . 1 . 2]" 1
852 1 35 ILE HG13 1 53 TRP HE3 1.800 . 5.000 4.465 3.504 5.016 0.016 1 0 "[ . 1 . 2]" 1
853 1 35 ILE HG12 1 53 TRP HE3 1.800 . 5.000 4.356 3.208 5.018 0.018 9 0 "[ . 1 . 2]" 1
854 1 35 ILE QG 1 51 THR MG 1.800 . 5.500 3.060 2.248 4.170 . 0 0 "[ . 1 . 2]" 1
855 1 35 ILE QG 1 53 TRP HZ3 1.800 . 5.000 3.375 2.260 4.447 . 0 0 "[ . 1 . 2]" 1
856 1 35 ILE MG 1 38 VAL HB 1.800 . 4.790 3.545 2.417 4.753 . 0 0 "[ . 1 . 2]" 1
857 1 35 ILE MG 1 38 VAL QG 1.800 . 3.400 2.686 1.922 3.403 0.003 17 0 "[ . 1 . 2]" 1
858 1 35 ILE MG 1 51 THR MG 1.800 . 5.500 2.627 1.892 4.018 . 0 0 "[ . 1 . 2]" 1
859 1 36 SER QB 1 52 ILE HB 1.800 . 5.000 2.512 2.302 2.897 . 0 0 "[ . 1 . 2]" 1
860 1 36 SER QB 1 52 ILE MD 1.800 . 5.000 3.946 3.223 5.056 0.056 1 0 "[ . 1 . 2]" 1
861 1 36 SER QB 1 52 ILE HG13 1.800 . 5.300 4.805 4.272 5.259 . 0 0 "[ . 1 . 2]" 1
862 1 36 SER QB 1 52 ILE HG12 1.800 . 5.300 5.053 4.493 5.335 0.035 15 0 "[ . 1 . 2]" 1
863 1 36 SER QB 1 54 LYS HG3 1.800 . 5.000 3.072 2.317 5.053 0.053 20 0 "[ . 1 . 2]" 1
864 1 36 SER QB 1 54 LYS HG2 1.800 . 5.000 3.083 2.308 5.024 0.024 2 0 "[ . 1 . 2]" 1
865 1 37 GLN QB 1 50 PHE QE 1.800 . 5.000 4.382 3.511 5.047 0.047 14 0 "[ . 1 . 2]" 1
866 1 37 GLN QB 1 50 PHE HZ 1.800 . 5.000 4.876 3.886 5.088 0.088 11 0 "[ . 1 . 2]" 1
867 1 37 GLN QB 1 52 ILE MD 1.800 . 5.300 3.212 2.185 5.374 0.074 13 0 "[ . 1 . 2]" 1
868 1 37 GLN QB 1 60 LEU MD2 1.800 . 5.000 3.378 2.199 4.340 . 0 0 "[ . 1 . 2]" 1
869 1 37 GLN HE21 1 60 LEU HB3 1.800 . 5.000 4.416 3.465 5.026 0.026 1 0 "[ . 1 . 2]" 1
870 1 37 GLN HE21 1 60 LEU MD2 1.800 . 5.000 3.525 1.845 4.415 . 0 0 "[ . 1 . 2]" 1
871 1 37 GLN HE22 1 60 LEU HB3 1.800 . 5.000 3.329 2.570 5.023 0.023 4 0 "[ . 1 . 2]" 1
872 1 37 GLN HE22 1 60 LEU MD2 1.800 . 5.000 3.205 2.253 4.565 . 0 0 "[ . 1 . 2]" 1
873 1 37 GLN QE 1 60 LEU MD2 1.800 . 5.000 2.904 1.793 3.722 0.007 15 0 "[ . 1 . 2]" 1
874 1 38 VAL QG 1 51 THR MG 1.800 . 5.000 3.164 2.112 4.198 . 0 0 "[ . 1 . 2]" 1
875 1 40 LEU HB3 1 49 LYS QD 1.800 . 5.800 3.960 2.284 4.899 . 0 0 "[ . 1 . 2]" 1
876 1 40 LEU HB3 1 49 LYS QG 1.800 . 5.000 2.926 2.320 4.261 . 0 0 "[ . 1 . 2]" 1
877 1 40 LEU HB2 1 49 LYS QD 1.800 . 5.300 5.007 3.613 5.442 0.142 20 0 "[ . 1 . 2]" 1
878 1 40 LEU QD 1 47 ILE HB 1.800 . 5.000 3.590 2.251 5.119 0.119 7 0 "[ . 1 . 2]" 1
879 1 40 LEU QD 1 47 ILE MG 1.800 . 5.000 2.726 2.062 3.376 . 0 0 "[ . 1 . 2]" 1
880 1 41 LEU HB3 1 43 ASP QB 1.800 . 5.750 4.869 4.574 5.783 0.033 10 0 "[ . 1 . 2]" 1
881 1 41 LEU HB2 1 48 ILE MG 1.800 . 5.000 2.431 2.217 3.001 . 0 0 "[ . 1 . 2]" 1
882 1 41 LEU HB2 1 83 VAL MG2 1.800 . 5.000 4.860 4.544 5.035 0.035 17 0 "[ . 1 . 2]" 1
883 1 41 LEU MD1 1 48 ILE MG 1.800 . 5.000 2.917 2.549 3.537 . 0 0 "[ . 1 . 2]" 1
884 1 41 LEU MD1 1 50 PHE HB2 1.800 . 5.000 3.512 2.895 4.084 . 0 0 "[ . 1 . 2]" 1
885 1 41 LEU MD1 1 50 PHE QD 1.800 . 5.000 3.248 3.021 3.466 . 0 0 "[ . 1 . 2]" 1
886 1 41 LEU MD1 1 69 LEU MD1 1.800 . 5.500 2.581 2.265 2.857 . 0 0 "[ . 1 . 2]" 1
887 1 41 LEU MD1 1 69 LEU MD2 1.800 . 5.500 3.792 2.986 4.243 . 0 0 "[ . 1 . 2]" 1
888 1 41 LEU MD1 1 83 VAL MG2 1.800 . 5.000 3.036 2.558 3.447 . 0 0 "[ . 1 . 2]" 1
889 1 41 LEU MD1 1 85 VAL MG2 1.800 . 5.000 4.450 3.976 4.771 . 0 0 "[ . 1 . 2]" 1
890 1 41 LEU MD2 1 50 PHE QD 1.800 . 5.000 3.230 2.866 3.565 . 0 0 "[ . 1 . 2]" 1
891 1 41 LEU MD2 1 50 PHE QE 1.800 . 5.000 2.617 2.405 2.769 . 0 0 "[ . 1 . 2]" 1
892 1 41 LEU MD2 1 61 LEU MD2 1.800 . 5.000 3.446 3.007 5.011 0.011 12 0 "[ . 1 . 2]" 1
893 1 41 LEU MD2 1 69 LEU MD1 1.800 . 5.500 4.206 3.725 4.776 . 0 0 "[ . 1 . 2]" 1
894 1 43 ASP QB 1 98 ILE MG 1.800 . 5.000 4.561 3.420 5.056 0.056 9 0 "[ . 1 . 2]" 1
895 1 48 ILE MD 1 81 PHE HB3 1.800 . 5.000 3.682 2.823 4.566 . 0 0 "[ . 1 . 2]" 1
896 1 48 ILE MD 1 81 PHE HB2 1.800 . 5.000 3.512 2.525 4.188 . 0 0 "[ . 1 . 2]" 1
897 1 48 ILE MD 1 83 VAL MG1 1.800 . 5.000 2.491 1.977 3.940 . 0 0 "[ . 1 . 2]" 1
898 1 48 ILE MD 1 83 VAL MG2 1.800 . 5.000 3.329 2.447 4.495 . 0 0 "[ . 1 . 2]" 1
899 1 48 ILE MG 1 82 GLN QB 1.800 . 6.000 5.515 4.903 6.058 0.058 20 0 "[ . 1 . 2]" 1
900 1 49 LYS QB 1 77 TYR QE 1.800 . 5.000 4.793 4.003 5.083 0.083 11 0 "[ . 1 . 2]" 1
901 1 49 LYS QE 1 77 TYR QE 1.800 . 5.000 3.469 2.297 5.033 0.033 14 0 "[ . 1 . 2]" 1
902 1 50 PHE QD 1 52 ILE MD 1.800 . 3.730 3.269 2.071 3.751 0.021 5 0 "[ . 1 . 2]" 1
903 1 50 PHE QD 1 52 ILE HG12 1.800 . 4.740 3.418 2.760 3.732 . 0 0 "[ . 1 . 2]" 1
904 1 50 PHE QD 1 85 VAL MG2 1.800 . 5.000 3.162 2.444 3.585 . 0 0 "[ . 1 . 2]" 1
905 1 50 PHE QE 1 52 ILE MD 1.800 . 3.670 2.296 2.071 2.743 . 0 0 "[ . 1 . 2]" 1
906 1 50 PHE QE 1 52 ILE HG12 1.800 . 4.570 3.462 2.400 3.909 . 0 0 "[ . 1 . 2]" 1
907 1 50 PHE QE 1 61 LEU MD2 1.800 . 5.000 3.146 2.306 4.299 . 0 0 "[ . 1 . 2]" 1
908 1 50 PHE HZ 1 61 LEU MD2 1.800 . 5.000 3.958 3.144 4.958 . 0 0 "[ . 1 . 2]" 1
909 1 51 THR HB 1 53 TRP HE1 1.800 . 4.660 4.032 2.977 4.738 0.078 11 0 "[ . 1 . 2]" 1
910 1 52 ILE MD 1 61 LEU MD1 1.800 . 5.000 2.382 2.042 3.738 . 0 0 "[ . 1 . 2]" 1
911 1 52 ILE MD 1 61 LEU MD2 1.800 . 5.000 2.741 2.230 3.492 . 0 0 "[ . 1 . 2]" 1
912 1 52 ILE MD 1 85 VAL HB 1.800 . 5.000 4.000 2.224 4.940 . 0 0 "[ . 1 . 2]" 1
913 1 52 ILE MD 1 85 VAL MG1 1.800 . 5.000 4.005 2.773 5.022 0.022 15 0 "[ . 1 . 2]" 1
914 1 52 ILE MG 1 54 LYS HG2 1.800 . 5.500 4.944 3.685 5.665 0.165 12 0 "[ . 1 . 2]" 1
915 1 52 ILE MG 1 58 LEU QB 1.800 . 5.000 2.956 2.105 3.759 . 0 0 "[ . 1 . 2]" 1
916 1 52 ILE MG 1 58 LEU MD1 1.800 . 5.500 2.995 2.050 3.880 . 0 0 "[ . 1 . 2]" 1
917 1 52 ILE MG 1 61 LEU MD1 1.800 . 5.000 3.746 2.915 5.060 0.060 12 0 "[ . 1 . 2]" 1
918 1 52 ILE MG 1 85 VAL HB 1.800 . 5.000 2.998 2.599 3.336 . 0 0 "[ . 1 . 2]" 1
919 1 53 TRP HE1 1 73 VAL MG1 1.800 . 5.000 4.990 4.555 5.082 0.082 17 0 "[ . 1 . 2]" 1
920 1 53 TRP HE1 1 84 GLN HB3 1.800 . 5.000 2.058 1.789 2.449 0.011 6 0 "[ . 1 . 2]" 1
921 1 53 TRP HE1 1 84 GLN HB2 1.800 . 5.000 3.656 3.367 4.125 . 0 0 "[ . 1 . 2]" 1
922 1 53 TRP HE1 1 84 GLN HG2 1.800 . 5.000 2.524 1.968 3.061 . 0 0 "[ . 1 . 2]" 1
923 1 54 LYS QB 1 56 ALA MB 1.800 . 5.800 5.674 5.309 5.880 0.080 17 0 "[ . 1 . 2]" 1
924 1 56 ALA MB 1 58 LEU MD1 1.800 . 4.440 2.618 1.943 4.387 . 0 0 "[ . 1 . 2]" 1
925 1 56 ALA MB 1 58 LEU MD2 1.800 . 4.710 2.990 2.196 4.321 . 0 0 "[ . 1 . 2]" 1
926 1 56 ALA MB 1 58 LEU HG 1.800 . 4.110 2.574 2.076 3.931 . 0 0 "[ . 1 . 2]" 1
927 1 58 LEU QB 1 91 ILE MD 1.800 . 5.000 2.596 2.156 3.353 . 0 0 "[ . 1 . 2]" 1
928 1 58 LEU MD1 1 89 SER QB 1.800 . 5.000 3.315 2.242 4.642 . 0 0 "[ . 1 . 2]" 1
929 1 58 LEU MD2 1 91 ILE HB 1.800 . 5.300 4.199 2.468 5.211 . 0 0 "[ . 1 . 2]" 1
930 1 58 LEU MD2 1 91 ILE MD 1.800 . 5.000 3.321 2.221 4.420 . 0 0 "[ . 1 . 2]" 1
931 1 59 PRO HD2 1 91 ILE MD 1.800 . 5.000 3.787 2.684 4.575 . 0 0 "[ . 1 . 2]" 1
932 1 61 LEU HB3 1 67 TYR QE 1.800 . 5.000 3.070 2.565 3.704 . 0 0 "[ . 1 . 2]" 1
933 1 61 LEU MD1 1 69 LEU MD2 1.800 . 5.500 4.222 3.319 5.059 . 0 0 "[ . 1 . 2]" 1
934 1 61 LEU MD1 1 91 ILE HB 1.800 . 5.000 4.450 4.095 4.683 . 0 0 "[ . 1 . 2]" 1
935 1 61 LEU MD1 1 91 ILE MD 1.800 . 5.000 2.248 2.124 2.632 . 0 0 "[ . 1 . 2]" 1
936 1 61 LEU MD1 1 91 ILE HG13 1.800 . 5.000 4.911 4.678 5.017 0.017 3 0 "[ . 1 . 2]" 1
937 1 61 LEU MD1 1 91 ILE HG12 1.800 . 5.000 4.364 3.873 4.704 . 0 0 "[ . 1 . 2]" 1
938 1 61 LEU MD1 1 91 ILE MG 1.800 . 5.000 3.030 2.549 3.294 . 0 0 "[ . 1 . 2]" 1
939 1 61 LEU MD2 1 69 LEU MD1 1.800 . 5.500 4.069 3.398 5.215 . 0 0 "[ . 1 . 2]" 1
940 1 61 LEU MD2 1 69 LEU MD2 1.800 . 5.500 3.121 2.566 4.441 . 0 0 "[ . 1 . 2]" 1
941 1 61 LEU MD2 1 85 VAL MG2 1.800 . 5.000 4.105 3.543 4.565 . 0 0 "[ . 1 . 2]" 1
942 1 61 LEU MD2 1 91 ILE MD 1.800 . 5.000 2.744 2.264 3.475 . 0 0 "[ . 1 . 2]" 1
943 1 61 LEU MD2 1 91 ILE MG 1.800 . 5.000 2.992 2.302 3.862 . 0 0 "[ . 1 . 2]" 1
944 1 65 GLU HB3 1 67 TYR QE 1.800 . 4.890 3.480 3.278 3.642 . 0 0 "[ . 1 . 2]" 1
945 1 65 GLU HB3 1 93 LYS QG 1.800 . 5.000 3.212 2.742 3.696 . 0 0 "[ . 1 . 2]" 1
946 1 65 GLU HB2 1 67 TYR QE 1.800 . 4.710 2.353 2.317 2.554 . 0 0 "[ . 1 . 2]" 1
947 1 66 SER HB3 1 94 LEU HB2 1.800 . 5.000 3.365 2.354 4.294 . 0 0 "[ . 1 . 2]" 1
948 1 66 SER HB3 1 98 ILE MD 1.800 . 5.000 3.710 2.726 5.009 0.009 9 0 "[ . 1 . 2]" 1
949 1 66 SER HB2 1 94 LEU HB2 1.800 . 5.000 2.851 2.349 3.884 . 0 0 "[ . 1 . 2]" 1
950 1 66 SER HB2 1 98 ILE MD 1.800 . 5.000 3.931 2.523 5.020 0.020 12 0 "[ . 1 . 2]" 1
951 1 66 SER QB 1 94 LEU HB2 1.800 . 5.000 2.575 2.113 3.019 . 0 0 "[ . 1 . 2]" 1
952 1 66 SER QB 1 98 ILE MD 1.800 . 5.000 3.311 2.326 4.229 . 0 0 "[ . 1 . 2]" 1
953 1 66 SER QB 1 98 ILE QG 1.800 . 5.000 3.021 2.228 3.811 . 0 0 "[ . 1 . 2]" 1
954 1 67 TYR HB3 1 69 LEU MD1 1.800 . 5.470 4.642 3.308 5.135 . 0 0 "[ . 1 . 2]" 1
955 1 67 TYR HB3 1 69 LEU MD2 1.800 . 4.630 3.262 2.922 4.358 . 0 0 "[ . 1 . 2]" 1
956 1 67 TYR HB3 1 69 LEU HG 1.800 . 5.120 4.063 3.562 4.422 . 0 0 "[ . 1 . 2]" 1
957 1 67 TYR HB3 1 91 ILE MG 1.800 . 5.000 2.476 2.202 2.977 . 0 0 "[ . 1 . 2]" 1
958 1 67 TYR HB2 1 69 LEU MD1 1.800 . 4.790 4.475 3.090 4.836 0.046 14 0 "[ . 1 . 2]" 1
959 1 67 TYR HB2 1 69 LEU MD2 1.800 . 4.920 3.902 3.485 4.552 . 0 0 "[ . 1 . 2]" 1
960 1 67 TYR HB2 1 69 LEU HG 1.800 . 5.120 4.342 4.123 4.539 . 0 0 "[ . 1 . 2]" 1
961 1 67 TYR HB2 1 91 ILE MG 1.800 . 5.000 3.898 3.611 4.432 . 0 0 "[ . 1 . 2]" 1
962 1 67 TYR QD 1 69 LEU MD1 1.800 . 6.050 5.626 4.597 6.037 . 0 0 "[ . 1 . 2]" 1
963 1 67 TYR QD 1 69 LEU MD2 1.800 . 5.300 4.603 4.221 5.392 0.092 17 0 "[ . 1 . 2]" 1
964 1 67 TYR QD 1 91 ILE MG 1.800 . 5.000 2.365 2.030 2.645 . 0 0 "[ . 1 . 2]" 1
965 1 67 TYR QE 1 91 ILE MG 1.800 . 5.000 3.539 3.095 3.910 . 0 0 "[ . 1 . 2]" 1
966 1 67 TYR QE 1 93 LYS QB 1.800 . 5.000 2.778 2.313 4.405 . 0 0 "[ . 1 . 2]" 1
967 1 68 LEU HB3 1 94 LEU QD 1.800 . 5.000 2.641 2.246 3.752 . 0 0 "[ . 1 . 2]" 1
968 1 68 LEU HB2 1 92 GLU QG 1.800 . 5.000 4.970 3.938 5.097 0.097 18 0 "[ . 1 . 2]" 1
969 1 68 LEU HB2 1 94 LEU QD 1.800 . 5.000 2.174 1.992 2.570 . 0 0 "[ . 1 . 2]" 1
970 1 68 LEU MD1 1 70 ARG QB 1.800 . 5.370 4.659 3.883 4.838 . 0 0 "[ . 1 . 2]" 1
971 1 68 LEU MD1 1 70 ARG HD3 1.800 . 4.940 4.577 3.785 5.013 0.073 15 0 "[ . 1 . 2]" 1
972 1 68 LEU MD1 1 70 ARG QD 1.800 . 4.020 3.807 3.463 4.046 0.026 7 0 "[ . 1 . 2]" 1
973 1 68 LEU MD1 1 70 ARG HD2 1.800 . 4.940 4.293 3.587 4.999 0.059 2 0 "[ . 1 . 2]" 1
974 1 68 LEU MD1 1 70 ARG HG3 1.800 . 5.090 3.160 2.263 3.618 . 0 0 "[ . 1 . 2]" 1
975 1 68 LEU MD1 1 70 ARG HG2 1.800 . 4.950 3.348 2.577 3.786 . 0 0 "[ . 1 . 2]" 1
976 1 68 LEU MD2 1 70 ARG HG3 1.800 . 5.010 3.373 3.110 4.965 . 0 0 "[ . 1 . 2]" 1
977 1 68 LEU MD2 1 70 ARG HG2 1.800 . 5.580 3.580 3.229 5.067 . 0 0 "[ . 1 . 2]" 1
978 1 68 LEU MD2 1 92 GLU QG 1.800 . 5.000 3.983 3.253 5.168 0.168 14 0 "[ . 1 . 2]" 1
979 1 68 LEU MD2 1 94 LEU QD 1.800 . 5.000 2.748 2.072 3.084 . 0 0 "[ . 1 . 2]" 1
980 1 68 LEU HG 1 70 ARG HD3 1.800 . 6.020 3.811 3.100 5.650 . 0 0 "[ . 1 . 2]" 1
981 1 68 LEU HG 1 70 ARG QD 1.800 . 5.060 3.210 2.775 4.988 . 0 0 "[ . 1 . 2]" 1
982 1 68 LEU HG 1 70 ARG HD2 1.800 . 6.020 3.758 2.850 5.551 . 0 0 "[ . 1 . 2]" 1
983 1 68 LEU HG 1 70 ARG HE 1.800 . 6.050 4.847 2.999 5.770 . 0 0 "[ . 1 . 2]" 1
984 1 68 LEU HG 1 94 LEU QD 1.800 . 5.000 4.195 3.350 4.543 . 0 0 "[ . 1 . 2]" 1
985 1 69 LEU HB3 1 72 VAL MG1 1.800 . 5.080 2.176 2.125 2.253 . 0 0 "[ . 1 . 2]" 1
986 1 69 LEU HB3 1 72 VAL MG2 1.800 . 5.530 3.153 2.659 3.637 . 0 0 "[ . 1 . 2]" 1
987 1 69 LEU HB3 1 85 VAL MG1 1.800 . 5.500 4.248 3.437 5.331 . 0 0 "[ . 1 . 2]" 1
988 1 69 LEU HB3 1 85 VAL MG2 1.800 . 5.500 3.765 3.343 4.218 . 0 0 "[ . 1 . 2]" 1
989 1 69 LEU HB2 1 72 VAL MG1 1.800 . 5.000 3.290 2.934 3.475 . 0 0 "[ . 1 . 2]" 1
990 1 69 LEU MD1 1 72 VAL MG1 1.800 . 5.030 3.002 2.603 4.192 . 0 0 "[ . 1 . 2]" 1
991 1 69 LEU MD1 1 85 VAL MG2 1.800 . 5.000 2.928 2.186 4.252 . 0 0 "[ . 1 . 2]" 1
992 1 69 LEU MD2 1 72 VAL MG1 1.800 . 5.010 3.155 2.638 3.394 . 0 0 "[ . 1 . 2]" 1
993 1 69 LEU MD2 1 85 VAL MG1 1.800 . 5.000 3.108 2.506 3.851 . 0 0 "[ . 1 . 2]" 1
994 1 69 LEU MD2 1 85 VAL MG2 1.800 . 5.000 2.764 2.052 3.216 . 0 0 "[ . 1 . 2]" 1
995 1 69 LEU MD2 1 91 ILE MD 1.800 . 5.000 2.939 2.675 3.094 . 0 0 "[ . 1 . 2]" 1
996 1 69 LEU MD2 1 91 ILE HG12 1.800 . 5.000 2.151 2.022 2.835 . 0 0 "[ . 1 . 2]" 1
997 1 69 LEU MD2 1 91 ILE MG 1.800 . 5.000 2.788 2.514 3.841 . 0 0 "[ . 1 . 2]" 1
998 1 70 ARG QB 1 90 SER QB 1.800 . 5.000 2.621 2.238 3.716 . 0 0 "[ . 1 . 2]" 1
999 1 70 ARG QD 1 90 SER QB 1.800 . 5.000 3.503 2.541 5.039 0.039 17 0 "[ . 1 . 2]" 1
1000 1 72 VAL HB 1 85 VAL MG2 1.800 . 5.000 3.905 3.404 4.550 . 0 0 "[ . 1 . 2]" 1
1001 1 72 VAL MG1 1 85 VAL MG2 1.800 . 5.000 2.586 2.144 3.042 . 0 0 "[ . 1 . 2]" 1
1002 1 72 VAL MG1 1 89 SER HB3 1.800 . 5.000 2.909 2.206 3.771 . 0 0 "[ . 1 . 2]" 1
1003 1 72 VAL MG1 1 89 SER HB2 1.800 . 5.000 2.960 2.073 4.035 . 0 0 "[ . 1 . 2]" 1
1004 1 72 VAL MG2 1 83 VAL HB 1.800 . 5.000 3.341 2.870 3.718 . 0 0 "[ . 1 . 2]" 1
1005 1 72 VAL MG2 1 83 VAL MG1 1.800 . 5.000 3.387 2.667 3.862 . 0 0 "[ . 1 . 2]" 1
1006 1 73 VAL MG1 1 84 GLN HB3 1.800 . 5.000 3.476 3.205 3.867 . 0 0 "[ . 1 . 2]" 1
1007 1 73 VAL MG1 1 84 GLN HB2 1.800 . 5.000 2.281 2.066 2.632 . 0 0 "[ . 1 . 2]" 1
1008 1 73 VAL MG1 1 84 GLN HE21 1.800 . 5.000 4.768 2.561 5.044 0.044 13 0 "[ . 1 . 2]" 1
1009 1 73 VAL MG1 1 84 GLN HE22 1.800 . 5.000 4.682 3.575 4.937 . 0 0 "[ . 1 . 2]" 1
1010 1 73 VAL MG1 1 84 GLN HG3 1.800 . 5.000 3.857 3.628 4.240 . 0 0 "[ . 1 . 2]" 1
1011 1 73 VAL MG1 1 84 GLN HG2 1.800 . 5.000 4.701 4.489 5.021 0.021 12 0 "[ . 1 . 2]" 1
1012 1 73 VAL MG1 1 86 ASN HD21 1.800 . 5.000 3.243 2.421 4.673 . 0 0 "[ . 1 . 2]" 1
1013 1 73 VAL MG1 1 86 ASN HD22 1.800 . 5.000 2.695 1.941 3.644 . 0 0 "[ . 1 . 2]" 1
1014 1 74 VAL MG1 1 81 PHE HB3 1.800 . 5.000 2.615 2.039 3.761 . 0 0 "[ . 1 . 2]" 1
1015 1 74 VAL MG1 1 81 PHE HB2 1.800 . 5.000 3.872 3.054 4.445 . 0 0 "[ . 1 . 2]" 1
1016 1 74 VAL MG1 1 81 PHE QD 1.800 . 5.000 2.850 2.208 4.989 . 0 0 "[ . 1 . 2]" 1
1017 1 77 TYR QB 1 80 ARG QB 1.800 . 4.890 3.388 2.315 4.080 . 0 0 "[ . 1 . 2]" 1
1018 1 77 TYR QB 1 82 GLN QG 1.800 . 5.000 3.068 2.099 4.291 . 0 0 "[ . 1 . 2]" 1
1019 1 77 TYR QD 1 80 ARG QD 1.800 . 6.050 4.845 3.417 6.145 0.095 7 0 "[ . 1 . 2]" 1
1020 1 77 TYR QD 1 80 ARG QG 1.800 . 5.960 4.584 3.766 5.988 0.028 11 0 "[ . 1 . 2]" 1
1021 1 77 TYR QD 1 82 GLN QB 1.800 . 5.000 3.662 2.443 4.320 . 0 0 "[ . 1 . 2]" 1
1022 1 77 TYR QD 1 82 GLN HE21 1.800 . 5.000 4.262 2.665 5.017 0.017 17 0 "[ . 1 . 2]" 1
1023 1 77 TYR QD 1 82 GLN QG 1.800 . 5.000 4.241 2.621 4.990 . 0 0 "[ . 1 . 2]" 1
1024 1 77 TYR QE 1 80 ARG QB 1.800 . 5.870 4.752 3.990 5.937 0.067 11 0 "[ . 1 . 2]" 1
1025 1 83 VAL HB 1 85 VAL MG2 1.800 . 5.100 4.018 3.788 4.499 . 0 0 "[ . 1 . 2]" 1
1026 1 85 VAL MG1 1 89 SER HB3 1.800 . 5.000 2.689 2.041 3.643 . 0 0 "[ . 1 . 2]" 1
1027 1 85 VAL MG1 1 89 SER QB 1.800 . 5.000 2.302 1.938 3.088 . 0 0 "[ . 1 . 2]" 1
1028 1 85 VAL MG1 1 89 SER HB2 1.800 . 5.000 2.730 2.075 3.601 . 0 0 "[ . 1 . 2]" 1
1029 1 85 VAL MG1 1 91 ILE MD 1.800 . 5.000 2.295 2.065 2.953 . 0 0 "[ . 1 . 2]" 1
1030 1 92 GLU QG 1 94 LEU QD 1.800 . 4.190 3.077 2.224 4.270 0.080 2 0 "[ . 1 . 2]" 1
1031 1 98 ILE HB 1 100 VAL MG2 1.800 . 6.050 4.813 2.366 6.066 0.016 8 0 "[ . 1 . 2]" 1
1032 1 99 GLU QG 1 102 LEU QB 1.800 . 6.050 4.854 2.372 6.079 0.029 11 0 "[ . 1 . 2]" 1
1033 1 4 GLN HA 1 4 GLN QE 1.800 . 5.250 4.279 3.007 5.310 0.060 16 0 "[ . 1 . 2]" 1
1034 1 4 GLN HA 1 4 GLN QG 1.800 . 3.900 2.523 2.296 3.298 . 0 0 "[ . 1 . 2]" 1
1035 1 4 GLN H 1 4 GLN QB 1.800 . 2.980 2.424 2.244 2.828 . 0 0 "[ . 1 . 2]" 1
1036 1 5 LEU HA 1 5 LEU MD1 1.800 . 4.390 3.492 2.156 3.843 . 0 0 "[ . 1 . 2]" 1
1037 1 5 LEU HA 1 5 LEU MD2 1.800 . 3.760 2.142 2.102 2.252 . 0 0 "[ . 1 . 2]" 1
1038 1 5 LEU HB3 1 5 LEU MD1 1.800 . 3.690 2.348 2.220 2.606 . 0 0 "[ . 1 . 2]" 1
1039 1 5 LEU HB3 1 5 LEU MD2 1.800 . 3.650 2.472 2.266 3.204 . 0 0 "[ . 1 . 2]" 1
1040 1 5 LEU HB2 1 5 LEU MD1 1.800 . 3.690 2.528 2.239 3.215 . 0 0 "[ . 1 . 2]" 1
1041 1 5 LEU HB2 1 5 LEU MD2 1.800 . 3.650 3.044 2.379 3.213 . 0 0 "[ . 1 . 2]" 1
1042 1 5 LEU H 1 5 LEU HB3 1.800 . 4.140 3.609 3.537 3.642 . 0 0 "[ . 1 . 2]" 1
1043 1 5 LEU H 1 5 LEU QB 1.800 . 3.450 2.421 2.184 2.528 . 0 0 "[ . 1 . 2]" 1
1044 1 5 LEU H 1 5 LEU HB2 1.800 . 4.140 2.461 2.205 2.581 . 0 0 "[ . 1 . 2]" 1
1045 1 5 LEU H 1 5 LEU MD1 1.800 . 4.190 3.615 3.190 3.984 . 0 0 "[ . 1 . 2]" 1
1046 1 5 LEU H 1 5 LEU HG 1.800 . 4.050 2.468 1.943 3.895 . 0 0 "[ . 1 . 2]" 1
1047 1 6 THR HA 1 6 THR MG 1.800 . 3.380 2.356 2.278 3.194 . 0 0 "[ . 1 . 2]" 1
1048 1 6 THR H 1 6 THR HB 1.800 . 3.620 2.682 2.621 3.142 . 0 0 "[ . 1 . 2]" 1
1049 1 6 THR H 1 6 THR MG 1.800 . 4.330 3.794 2.396 3.887 . 0 0 "[ . 1 . 2]" 1
1050 1 8 ILE HA 1 8 ILE MD 1.800 . 4.230 3.652 2.088 3.872 . 0 0 "[ . 1 . 2]" 1
1051 1 8 ILE MD 1 8 ILE MG 1.800 . 3.490 2.040 1.808 3.238 . 0 0 "[ . 1 . 2]" 1
1052 1 8 ILE H 1 8 ILE HB 1.800 . 3.920 2.454 2.400 2.624 . 0 0 "[ . 1 . 2]" 1
1053 1 8 ILE H 1 8 ILE MD 1.800 . 4.660 3.220 1.723 3.463 0.077 6 0 "[ . 1 . 2]" 1
1054 1 8 ILE H 1 8 ILE MG 1.800 . 4.460 3.754 3.743 3.765 . 0 0 "[ . 1 . 2]" 1
1055 1 9 VAL HA 1 9 VAL MG1 1.800 . 3.850 3.202 3.194 3.216 . 0 0 "[ . 1 . 2]" 1
1056 1 9 VAL HA 1 9 VAL MG2 1.800 . 3.190 2.301 2.270 2.328 . 0 0 "[ . 1 . 2]" 1
1057 1 9 VAL H 1 9 VAL HB 1.800 . 3.820 2.496 2.420 2.589 . 0 0 "[ . 1 . 2]" 1
1058 1 9 VAL H 1 9 VAL MG1 1.800 . 3.320 2.063 1.935 2.193 . 0 0 "[ . 1 . 2]" 1
1059 1 9 VAL H 1 9 VAL MG2 1.800 . 4.350 3.763 3.748 3.773 . 0 0 "[ . 1 . 2]" 1
1060 1 10 ASP H 1 10 ASP HB3 1.800 . 3.930 3.091 2.532 3.626 . 0 0 "[ . 1 . 2]" 1
1061 1 10 ASP H 1 10 ASP QB 1.800 . 3.420 2.312 2.253 2.364 . 0 0 "[ . 1 . 2]" 1
1062 1 10 ASP H 1 10 ASP HB2 1.800 . 3.930 2.465 2.344 2.621 . 0 0 "[ . 1 . 2]" 1
1063 1 11 ILE HA 1 11 ILE MD 1.800 . 4.490 3.662 2.233 3.827 . 0 0 "[ . 1 . 2]" 1
1064 1 11 ILE HA 1 11 ILE HG13 1.800 . 4.480 2.961 2.837 3.787 . 0 0 "[ . 1 . 2]" 1
1065 1 11 ILE HA 1 11 ILE HG12 1.800 . 3.740 2.561 2.516 2.804 . 0 0 "[ . 1 . 2]" 1
1066 1 11 ILE HA 1 11 ILE MG 1.800 . 3.700 2.364 2.308 2.388 . 0 0 "[ . 1 . 2]" 1
1067 1 11 ILE HG13 1 11 ILE MG 1.800 . 4.320 3.129 2.536 3.200 . 0 0 "[ . 1 . 2]" 1
1068 1 11 ILE HG12 1 11 ILE MG 1.800 . 3.030 2.425 2.328 3.174 0.144 19 0 "[ . 1 . 2]" 1
1069 1 11 ILE H 1 11 ILE HB 1.800 . 3.210 2.446 2.416 2.512 . 0 0 "[ . 1 . 2]" 1
1070 1 11 ILE H 1 11 ILE MD 1.800 . 3.610 3.572 3.459 3.651 0.041 19 0 "[ . 1 . 2]" 1
1071 1 11 ILE H 1 11 ILE HG13 1.800 . 3.760 2.494 2.198 3.333 . 0 0 "[ . 1 . 2]" 1
1072 1 11 ILE H 1 11 ILE HG12 1.800 . 4.060 3.561 2.132 3.785 . 0 0 "[ . 1 . 2]" 1
1073 1 11 ILE H 1 11 ILE MG 1.800 . 4.860 3.776 3.764 3.785 . 0 0 "[ . 1 . 2]" 1
1074 1 12 VAL HA 1 12 VAL MG1 1.800 . 3.320 2.342 2.226 3.205 . 0 0 "[ . 1 . 2]" 1
1075 1 12 VAL HA 1 12 VAL MG2 1.800 . 3.970 3.159 2.397 3.213 . 0 0 "[ . 1 . 2]" 1
1076 1 12 VAL H 1 12 VAL MG1 1.800 . 4.230 2.997 1.800 3.344 0.000 13 0 "[ . 1 . 2]" 1
1077 1 12 VAL H 1 12 VAL MG2 1.800 . 3.560 2.212 1.813 3.747 0.187 13 0 "[ . 1 . 2]" 1
1078 1 13 GLU HA 1 13 GLU HG3 1.800 . 4.030 3.110 2.406 3.761 . 0 0 "[ . 1 . 2]" 1
1079 1 13 GLU HA 1 13 GLU HG2 1.800 . 4.030 3.044 2.414 3.713 . 0 0 "[ . 1 . 2]" 1
1080 1 13 GLU H 1 13 GLU HB3 1.800 . 4.260 3.416 2.684 3.856 . 0 0 "[ . 1 . 2]" 1
1081 1 13 GLU H 1 13 GLU QB 1.800 . 3.660 2.730 2.532 3.156 . 0 0 "[ . 1 . 2]" 1
1082 1 13 GLU H 1 13 GLU HB2 1.800 . 4.260 3.067 2.598 3.890 . 0 0 "[ . 1 . 2]" 1
1083 1 13 GLU H 1 13 GLU QG 1.800 . 4.320 3.216 2.106 4.216 . 0 0 "[ . 1 . 2]" 1
1084 1 14 ASN HA 1 14 ASN HD21 1.800 . 5.740 4.060 1.781 4.725 0.019 20 0 "[ . 1 . 2]" 1
1085 1 14 ASN HA 1 14 ASN QD 1.800 . 4.930 3.831 1.774 4.443 0.026 20 0 "[ . 1 . 2]" 1
1086 1 14 ASN H 1 14 ASN HB3 1.800 . 3.420 2.940 2.630 3.568 0.148 20 0 "[ . 1 . 2]" 1
1087 1 14 ASN H 1 14 ASN HD21 1.800 . 5.370 3.986 2.981 4.524 . 0 0 "[ . 1 . 2]" 1
1088 1 14 ASN H 1 14 ASN HD22 1.800 . 5.500 4.206 3.435 5.590 0.090 16 0 "[ . 1 . 2]" 1
1089 1 16 GLN HA 1 16 GLN HG3 1.800 . 4.380 2.656 2.400 3.748 . 0 0 "[ . 1 . 2]" 1
1090 1 16 GLN QB 1 16 GLN QE 1.800 . 4.840 2.790 1.798 3.571 0.002 13 0 "[ . 1 . 2]" 1
1091 1 16 GLN H 1 16 GLN QB 1.800 . 3.430 2.542 2.246 3.373 . 0 0 "[ . 1 . 2]" 1
1092 1 16 GLN H 1 16 GLN HG3 1.800 . 4.990 4.291 2.768 4.840 . 0 0 "[ . 1 . 2]" 1
1093 1 17 TRP HA 1 17 TRP HD1 1.800 . 4.750 3.988 3.806 4.215 . 0 0 "[ . 1 . 2]" 1
1094 1 17 TRP HA 1 17 TRP HE1 1.800 . 5.840 5.258 5.154 5.461 . 0 0 "[ . 1 . 2]" 1
1095 1 17 TRP HA 1 17 TRP HE3 1.800 . 5.640 3.254 2.791 3.550 . 0 0 "[ . 1 . 2]" 1
1096 1 17 TRP H 1 17 TRP HD1 1.800 . 4.250 2.578 2.056 3.004 . 0 0 "[ . 1 . 2]" 1
1097 1 18 ALA H 1 18 ALA MB 1.800 . 3.540 2.890 2.788 2.931 . 0 0 "[ . 1 . 2]" 1
1098 1 19 ASN H 1 19 ASN HD21 1.800 . 5.090 3.781 1.838 4.511 . 0 0 "[ . 1 . 2]" 1
1099 1 19 ASN H 1 19 ASN QD 1.800 . 4.330 3.567 1.831 4.340 0.010 14 0 "[ . 1 . 2]" 1
1100 1 20 LEU H 1 20 LEU HB3 1.800 . 4.150 2.932 2.654 3.867 . 0 0 "[ . 1 . 2]" 1
1101 1 20 LEU H 1 20 LEU HB2 1.800 . 3.780 3.154 2.693 3.368 . 0 0 "[ . 1 . 2]" 1
1102 1 20 LEU H 1 20 LEU QD 1.800 . 4.250 3.816 2.431 4.007 . 0 0 "[ . 1 . 2]" 1
1103 1 21 LYS HA 1 21 LYS HD2 1.800 . 5.080 4.641 4.517 4.746 . 0 0 "[ . 1 . 2]" 1
1104 1 21 LYS H 1 21 LYS QB 1.800 . 3.860 2.469 2.395 2.572 . 0 0 "[ . 1 . 2]" 1
1105 1 21 LYS H 1 21 LYS HE3 1.800 . 6.050 5.139 4.733 5.609 . 0 0 "[ . 1 . 2]" 1
1106 1 21 LYS H 1 21 LYS QG 1.800 . 4.990 4.037 3.982 4.101 . 0 0 "[ . 1 . 2]" 1
1107 1 22 ALA H 1 22 ALA MB 1.800 . 3.370 2.806 2.777 2.838 . 0 0 "[ . 1 . 2]" 1
1108 1 23 LYS H 1 23 LYS HB3 1.800 . 3.940 2.697 2.500 3.095 . 0 0 "[ . 1 . 2]" 1
1109 1 23 LYS H 1 23 LYS QB 1.800 . 3.400 2.534 2.362 2.969 . 0 0 "[ . 1 . 2]" 1
1110 1 23 LYS H 1 23 LYS HB2 1.800 . 3.940 3.097 2.802 3.819 . 0 0 "[ . 1 . 2]" 1
1111 1 24 VAL HA 1 24 VAL MG1 1.800 . 3.850 2.351 2.269 2.409 . 0 0 "[ . 1 . 2]" 1
1112 1 24 VAL HA 1 24 VAL MG2 1.800 . 3.730 2.392 2.347 2.482 . 0 0 "[ . 1 . 2]" 1
1113 1 24 VAL H 1 24 VAL HB 1.800 . 3.610 2.459 2.366 2.668 . 0 0 "[ . 1 . 2]" 1
1114 1 24 VAL H 1 24 VAL MG1 1.800 . 4.800 3.771 3.744 3.793 . 0 0 "[ . 1 . 2]" 1
1115 1 24 VAL H 1 24 VAL MG2 1.800 . 3.280 2.264 1.842 2.439 . 0 0 "[ . 1 . 2]" 1
1116 1 25 ILE HA 1 25 ILE MD 1.800 . 3.980 3.359 2.088 4.127 0.147 11 0 "[ . 1 . 2]" 1
1117 1 25 ILE HA 1 25 ILE HG12 1.800 . 4.440 2.957 2.551 3.745 . 0 0 "[ . 1 . 2]" 1
1118 1 25 ILE HA 1 25 ILE MG 1.800 . 3.660 2.324 2.240 2.394 . 0 0 "[ . 1 . 2]" 1
1119 1 25 ILE HG13 1 25 ILE MG 1.800 . 3.770 2.926 2.270 3.200 . 0 0 "[ . 1 . 2]" 1
1120 1 25 ILE HG12 1 25 ILE MG 1.800 . 4.050 2.592 2.288 3.198 . 0 0 "[ . 1 . 2]" 1
1121 1 25 ILE H 1 25 ILE HB 1.800 . 4.140 2.691 2.426 3.784 . 0 0 "[ . 1 . 2]" 1
1122 1 25 ILE H 1 25 ILE MD 1.800 . 4.410 3.459 2.851 3.828 . 0 0 "[ . 1 . 2]" 1
1123 1 25 ILE H 1 25 ILE HG13 1.800 . 4.600 2.919 1.983 3.826 . 0 0 "[ . 1 . 2]" 1
1124 1 25 ILE H 1 25 ILE HG12 1.800 . 4.070 3.070 1.900 3.971 . 0 0 "[ . 1 . 2]" 1
1125 1 25 ILE H 1 25 ILE MG 1.800 . 4.300 3.639 2.741 3.839 . 0 0 "[ . 1 . 2]" 1
1126 1 26 GLN HA 1 26 GLN QE 1.800 . 5.410 3.974 2.972 5.477 0.067 17 0 "[ . 1 . 2]" 1
1127 1 26 GLN H 1 26 GLN QB 1.800 . 3.860 2.763 2.552 3.315 . 0 0 "[ . 1 . 2]" 1
1128 1 26 GLN H 1 26 GLN HG3 1.800 . 5.010 4.455 3.379 4.819 . 0 0 "[ . 1 . 2]" 1
1129 1 26 GLN H 1 26 GLN QG 1.800 . 4.400 3.876 2.512 4.245 . 0 0 "[ . 1 . 2]" 1
1130 1 26 GLN H 1 26 GLN HG2 1.800 . 5.010 4.418 2.576 5.101 0.091 4 0 "[ . 1 . 2]" 1
1131 1 27 LEU HA 1 27 LEU MD1 1.800 . 4.690 3.913 2.631 4.159 . 0 0 "[ . 1 . 2]" 1
1132 1 27 LEU HA 1 27 LEU MD2 1.800 . 4.230 3.439 2.114 4.095 . 0 0 "[ . 1 . 2]" 1
1133 1 27 LEU HB3 1 27 LEU MD1 1.800 . 3.600 2.555 2.291 3.208 . 0 0 "[ . 1 . 2]" 1
1134 1 27 LEU HB2 1 27 LEU MD1 1.800 . 3.770 2.358 2.199 3.212 . 0 0 "[ . 1 . 2]" 1
1135 1 27 LEU HB2 1 27 LEU MD2 1.800 . 4.350 3.036 2.347 3.221 . 0 0 "[ . 1 . 2]" 1
1136 1 27 LEU H 1 27 LEU MD1 1.800 . 4.630 3.560 1.758 4.652 0.042 17 0 "[ . 1 . 2]" 1
1137 1 27 LEU H 1 27 LEU HG 1.800 . 4.160 2.966 1.884 4.418 0.258 19 0 "[ . 1 . 2]" 1
1138 1 28 TRP HA 1 28 TRP HE1 1.800 . 5.410 4.901 4.599 5.335 . 0 0 "[ . 1 . 2]" 1
1139 1 28 TRP H 1 28 TRP HD1 1.800 . 5.860 4.241 2.882 5.295 . 0 0 "[ . 1 . 2]" 1
1140 1 29 GLU H 1 29 GLU QB 1.800 . 3.070 2.406 2.228 2.620 . 0 0 "[ . 1 . 2]" 1
1141 1 30 ASN HA 1 30 ASN HD21 1.800 . 5.190 4.148 2.586 4.690 . 0 0 "[ . 1 . 2]" 1
1142 1 30 ASN H 1 30 ASN QB 1.800 . 3.660 2.593 2.288 3.210 . 0 0 "[ . 1 . 2]" 1
1143 1 30 ASN H 1 30 ASN HD21 1.800 . 5.010 4.495 1.743 5.032 0.057 17 0 "[ . 1 . 2]" 1
1144 1 31 THR HA 1 31 THR MG 1.800 . 3.110 2.452 2.250 3.194 0.084 1 0 "[ . 1 . 2]" 1
1145 1 31 THR H 1 31 THR MG 1.800 . 5.100 2.968 1.770 3.957 0.030 1 0 "[ . 1 . 2]" 1
1146 1 32 HIS H 1 32 HIS QB 1.800 . 3.120 2.358 2.213 2.581 . 0 0 "[ . 1 . 2]" 1
1147 1 33 GLU HA 1 33 GLU QG 1.800 . 3.740 2.577 2.268 3.324 . 0 0 "[ . 1 . 2]" 1
1148 1 33 GLU H 1 33 GLU QB 1.800 . 3.520 2.569 2.212 3.343 . 0 0 "[ . 1 . 2]" 1
1149 1 33 GLU H 1 33 GLU QG 1.800 . 4.280 3.216 1.853 4.430 0.150 7 0 "[ . 1 . 2]" 1
1150 1 35 ILE HA 1 35 ILE MD 1.800 . 4.440 3.832 3.803 3.901 . 0 0 "[ . 1 . 2]" 1
1151 1 35 ILE H 1 35 ILE HB 1.800 . 3.330 2.543 2.407 2.726 . 0 0 "[ . 1 . 2]" 1
1152 1 35 ILE H 1 35 ILE MD 1.800 . 4.100 3.713 3.336 3.975 . 0 0 "[ . 1 . 2]" 1
1153 1 35 ILE H 1 35 ILE HG13 1.800 . 4.650 2.652 1.969 2.977 . 0 0 "[ . 1 . 2]" 1
1154 1 35 ILE H 1 35 ILE QG 1.800 . 3.770 2.611 1.957 2.917 . 0 0 "[ . 1 . 2]" 1
1155 1 35 ILE H 1 35 ILE HG12 1.800 . 4.650 3.928 3.396 4.179 . 0 0 "[ . 1 . 2]" 1
1156 1 35 ILE H 1 35 ILE MG 1.800 . 4.480 3.819 3.753 3.903 . 0 0 "[ . 1 . 2]" 1
1157 1 36 SER H 1 36 SER QB 1.800 . 3.590 2.327 2.215 2.718 . 0 0 "[ . 1 . 2]" 1
1158 1 37 GLN QB 1 37 GLN QE 1.800 . 4.820 3.023 1.781 3.551 0.019 18 0 "[ . 1 . 2]" 1
1159 1 37 GLN H 1 37 GLN QG 1.800 . 4.860 3.129 2.159 4.300 . 0 0 "[ . 1 . 2]" 1
1160 1 38 VAL HA 1 38 VAL QG 1.800 . 3.700 2.258 2.066 2.334 . 0 0 "[ . 1 . 2]" 1
1161 1 38 VAL H 1 38 VAL QG 1.800 . 3.210 2.162 1.962 2.906 . 0 0 "[ . 1 . 2]" 1
1162 1 40 LEU HA 1 40 LEU QD 1.800 . 4.430 3.294 2.954 3.379 . 0 0 "[ . 1 . 2]" 1
1163 1 40 LEU HB3 1 40 LEU MD1 1.800 . 4.460 2.733 2.259 3.217 . 0 0 "[ . 1 . 2]" 1
1164 1 40 LEU HB3 1 40 LEU MD2 1.800 . 4.460 2.287 2.187 3.206 . 0 0 "[ . 1 . 2]" 1
1165 1 41 LEU HA 1 41 LEU MD1 1.800 . 5.080 3.842 3.813 3.884 . 0 0 "[ . 1 . 2]" 1
1166 1 41 LEU HA 1 41 LEU MD2 1.800 . 3.550 2.148 2.109 2.193 . 0 0 "[ . 1 . 2]" 1
1167 1 41 LEU HB3 1 41 LEU MD1 1.800 . 4.200 2.392 2.333 2.462 . 0 0 "[ . 1 . 2]" 1
1168 1 41 LEU HB3 1 41 LEU MD2 1.800 . 3.410 2.278 2.244 2.309 . 0 0 "[ . 1 . 2]" 1
1169 1 41 LEU HB2 1 41 LEU MD1 1.800 . 3.670 2.331 2.272 2.393 . 0 0 "[ . 1 . 2]" 1
1170 1 41 LEU H 1 41 LEU HB2 1.800 . 4.030 2.650 2.613 2.710 . 0 0 "[ . 1 . 2]" 1
1171 1 41 LEU H 1 41 LEU MD1 1.800 . 4.740 3.823 3.749 3.925 . 0 0 "[ . 1 . 2]" 1
1172 1 41 LEU H 1 41 LEU MD2 1.800 . 4.610 3.509 3.355 3.638 . 0 0 "[ . 1 . 2]" 1
1173 1 44 GLU H 1 44 GLU HB3 1.800 . 4.220 3.054 2.450 4.146 . 0 0 "[ . 1 . 2]" 1
1174 1 44 GLU H 1 44 GLU QB 1.800 . 3.710 2.420 2.231 3.382 . 0 0 "[ . 1 . 2]" 1
1175 1 44 GLU H 1 44 GLU HB2 1.800 . 4.220 2.757 2.426 3.626 . 0 0 "[ . 1 . 2]" 1
1176 1 44 GLU H 1 44 GLU HG3 1.800 . 4.740 3.299 2.125 4.452 . 0 0 "[ . 1 . 2]" 1
1177 1 44 GLU H 1 44 GLU QG 1.800 . 4.090 2.790 1.918 3.979 . 0 0 "[ . 1 . 2]" 1
1178 1 44 GLU H 1 44 GLU HG2 1.800 . 4.740 3.475 1.932 4.502 . 0 0 "[ . 1 . 2]" 1
1179 1 45 THR HA 1 45 THR MG 1.800 . 3.450 2.395 2.235 2.455 . 0 0 "[ . 1 . 2]" 1
1180 1 45 THR H 1 45 THR MG 1.800 . 3.580 2.307 2.139 2.744 . 0 0 "[ . 1 . 2]" 1
1181 1 47 ILE HA 1 47 ILE MD 1.800 . 4.640 3.857 2.129 4.146 . 0 0 "[ . 1 . 2]" 1
1182 1 47 ILE HA 1 47 ILE MG 1.800 . 3.730 2.321 2.251 2.425 . 0 0 "[ . 1 . 2]" 1
1183 1 47 ILE HB 1 47 ILE MD 1.800 . 3.770 2.394 2.196 3.228 . 0 0 "[ . 1 . 2]" 1
1184 1 47 ILE QG 1 47 ILE MG 1.800 . 3.740 2.252 2.053 2.294 . 0 0 "[ . 1 . 2]" 1
1185 1 47 ILE H 1 47 ILE HB 1.800 . 4.290 3.289 2.589 3.964 . 0 0 "[ . 1 . 2]" 1
1186 1 47 ILE H 1 47 ILE MD 1.800 . 4.630 3.658 1.689 3.989 0.111 20 0 "[ . 1 . 2]" 1
1187 1 47 ILE H 1 47 ILE QG 1.800 . 4.190 2.511 2.059 3.398 . 0 0 "[ . 1 . 2]" 1
1188 1 47 ILE H 1 47 ILE MG 1.800 . 4.160 3.296 2.734 3.874 . 0 0 "[ . 1 . 2]" 1
1189 1 48 ILE HA 1 48 ILE MD 1.800 . 4.370 3.208 2.100 3.686 . 0 0 "[ . 1 . 2]" 1
1190 1 48 ILE HA 1 48 ILE HG13 1.800 . 3.670 2.550 2.309 3.572 . 0 0 "[ . 1 . 2]" 1
1191 1 48 ILE HA 1 48 ILE HG12 1.800 . 3.920 3.240 2.442 3.708 . 0 0 "[ . 1 . 2]" 1
1192 1 48 ILE MD 1 48 ILE MG 1.800 . 3.250 2.336 1.826 3.253 0.003 3 0 "[ . 1 . 2]" 1
1193 1 48 ILE HG12 1 48 ILE MG 1.800 . 4.130 2.303 2.192 3.200 . 0 0 "[ . 1 . 2]" 1
1194 1 48 ILE H 1 48 ILE MD 1.800 . 6.000 4.609 4.286 4.836 . 0 0 "[ . 1 . 2]" 1
1195 1 48 ILE H 1 48 ILE MG 1.800 . 3.640 2.193 1.997 2.795 . 0 0 "[ . 1 . 2]" 1
1196 1 49 LYS HA 1 49 LYS HD3 1.800 . 4.960 4.046 2.213 4.638 . 0 0 "[ . 1 . 2]" 1
1197 1 49 LYS HA 1 49 LYS QD 1.800 . 4.330 3.495 2.175 4.110 . 0 0 "[ . 1 . 2]" 1
1198 1 49 LYS HA 1 49 LYS HD2 1.800 . 4.960 3.982 2.307 4.726 . 0 0 "[ . 1 . 2]" 1
1199 1 49 LYS HA 1 49 LYS QE 1.800 . 4.930 4.398 3.929 4.894 . 0 0 "[ . 1 . 2]" 1
1200 1 49 LYS QB 1 49 LYS QD 1.800 . 3.620 2.222 2.121 2.378 . 0 0 "[ . 1 . 2]" 1
1201 1 49 LYS QB 1 49 LYS QE 1.800 . 4.610 2.842 2.138 3.785 . 0 0 "[ . 1 . 2]" 1
1202 1 49 LYS QE 1 49 LYS QG 1.800 . 3.670 2.347 2.128 2.851 . 0 0 "[ . 1 . 2]" 1
1203 1 49 LYS H 1 49 LYS HD3 1.800 . 5.570 4.389 1.789 5.038 0.011 9 0 "[ . 1 . 2]" 1
1204 1 49 LYS H 1 49 LYS QD 1.800 . 4.830 3.823 1.782 4.422 0.018 9 0 "[ . 1 . 2]" 1
1205 1 49 LYS H 1 49 LYS HD2 1.800 . 5.570 4.386 2.619 4.941 . 0 0 "[ . 1 . 2]" 1
1206 1 49 LYS H 1 49 LYS HG3 1.800 . 5.310 2.857 2.446 4.018 . 0 0 "[ . 1 . 2]" 1
1207 1 49 LYS H 1 49 LYS HG2 1.800 . 5.310 3.463 2.208 4.105 . 0 0 "[ . 1 . 2]" 1
1208 1 50 PHE HA 1 50 PHE QD 1.800 . 5.010 3.711 3.690 3.722 . 0 0 "[ . 1 . 2]" 1
1209 1 50 PHE H 1 50 PHE QD 1.800 . 3.920 2.389 2.022 2.726 . 0 0 "[ . 1 . 2]" 1
1210 1 50 PHE H 1 50 PHE QE 1.800 . 5.220 4.135 3.915 4.350 . 0 0 "[ . 1 . 2]" 1
1211 1 51 THR HA 1 51 THR MG 1.800 . 3.940 2.624 2.267 3.211 . 0 0 "[ . 1 . 2]" 1
1212 1 51 THR H 1 51 THR HB 1.800 . 4.020 2.945 2.670 3.458 . 0 0 "[ . 1 . 2]" 1
1213 1 51 THR H 1 51 THR MG 1.800 . 4.730 3.282 2.067 3.909 . 0 0 "[ . 1 . 2]" 1
1214 1 52 ILE HA 1 52 ILE MD 1.800 . 5.300 3.476 2.067 3.857 . 0 0 "[ . 1 . 2]" 1
1215 1 52 ILE HA 1 52 ILE MG 1.800 . 3.290 2.329 2.294 2.416 . 0 0 "[ . 1 . 2]" 1
1216 1 52 ILE HG13 1 52 ILE MG 1.800 . 4.320 3.017 2.270 3.201 . 0 0 "[ . 1 . 2]" 1
1217 1 52 ILE HG12 1 52 ILE MG 1.800 . 4.490 2.513 2.323 3.208 . 0 0 "[ . 1 . 2]" 1
1218 1 52 ILE H 1 52 ILE HB 1.800 . 3.840 2.505 2.400 2.598 . 0 0 "[ . 1 . 2]" 1
1219 1 52 ILE H 1 52 ILE MD 1.800 . 4.650 3.590 3.113 3.735 . 0 0 "[ . 1 . 2]" 1
1220 1 52 ILE H 1 52 ILE HG12 1.800 . 4.360 3.586 2.297 3.978 . 0 0 "[ . 1 . 2]" 1
1221 1 53 TRP HA 1 53 TRP HE3 1.800 . 4.610 3.145 2.439 3.819 . 0 0 "[ . 1 . 2]" 1
1222 1 53 TRP HB2 1 53 TRP HE1 1.800 . 5.370 4.787 4.743 4.855 . 0 0 "[ . 1 . 2]" 1
1223 1 53 TRP H 1 53 TRP HB3 1.800 . 4.250 3.644 3.592 3.733 . 0 0 "[ . 1 . 2]" 1
1224 1 53 TRP H 1 53 TRP HB2 1.800 . 3.920 2.431 2.317 2.662 . 0 0 "[ . 1 . 2]" 1
1225 1 53 TRP H 1 53 TRP HD1 1.800 . 4.260 2.537 1.845 3.072 . 0 0 "[ . 1 . 2]" 1
1226 1 53 TRP H 1 53 TRP HE1 1.800 . 5.470 4.757 4.284 5.054 . 0 0 "[ . 1 . 2]" 1
1227 1 53 TRP H 1 53 TRP HE3 1.800 . 5.710 5.376 4.918 5.630 . 0 0 "[ . 1 . 2]" 1
1228 1 54 LYS HA 1 54 LYS HD3 1.800 . 5.920 4.380 2.308 5.508 . 0 0 "[ . 1 . 2]" 1
1229 1 54 LYS HA 1 54 LYS HE3 1.800 . 6.050 4.947 4.148 6.047 . 0 0 "[ . 1 . 2]" 1
1230 1 54 LYS HA 1 54 LYS HE2 1.800 . 6.050 5.051 4.387 6.076 0.026 10 0 "[ . 1 . 2]" 1
1231 1 54 LYS HA 1 54 LYS HG3 1.800 . 4.300 3.088 2.337 3.786 . 0 0 "[ . 1 . 2]" 1
1232 1 54 LYS HA 1 54 LYS HG2 1.800 . 4.490 2.756 2.397 3.741 . 0 0 "[ . 1 . 2]" 1
1233 1 54 LYS QB 1 54 LYS HD3 1.800 . 4.350 2.516 2.246 3.426 . 0 0 "[ . 1 . 2]" 1
1234 1 54 LYS QB 1 54 LYS HD2 1.800 . 4.410 2.651 2.281 3.309 . 0 0 "[ . 1 . 2]" 1
1235 1 54 LYS QB 1 54 LYS QE 1.800 . 4.850 2.955 2.140 3.676 . 0 0 "[ . 1 . 2]" 1
1236 1 54 LYS QE 1 54 LYS HG2 1.800 . 3.990 2.620 2.237 3.317 . 0 0 "[ . 1 . 2]" 1
1237 1 54 LYS H 1 54 LYS HD3 1.800 . 5.440 4.635 3.923 5.069 . 0 0 "[ . 1 . 2]" 1
1238 1 54 LYS H 1 54 LYS HD2 1.800 . 5.610 4.326 3.851 5.100 . 0 0 "[ . 1 . 2]" 1
1239 1 55 ASN HA 1 55 ASN QD 1.800 . 4.910 3.299 1.798 4.440 0.002 20 0 "[ . 1 . 2]" 1
1240 1 55 ASN H 1 55 ASN HD21 1.800 . 5.730 3.974 1.765 4.660 0.035 6 0 "[ . 1 . 2]" 1
1241 1 55 ASN H 1 55 ASN QD 1.800 . 4.980 3.727 1.759 4.476 0.041 6 0 "[ . 1 . 2]" 1
1242 1 56 ALA H 1 56 ALA MB 1.800 . 3.010 2.353 2.158 2.794 . 0 0 "[ . 1 . 2]" 1
1243 1 57 GLU HA 1 57 GLU QG 1.800 . 3.320 2.685 2.287 3.308 . 0 0 "[ . 1 . 2]" 1
1244 1 57 GLU H 1 57 GLU HA 1.800 . 2.930 2.463 2.326 2.873 . 0 0 "[ . 1 . 2]" 1
1245 1 57 GLU H 1 57 GLU QG 1.800 . 3.380 2.655 2.525 2.833 . 0 0 "[ . 1 . 2]" 1
1246 1 58 LEU HA 1 58 LEU MD1 1.800 . 4.400 3.821 3.764 3.864 . 0 0 "[ . 1 . 2]" 1
1247 1 58 LEU HA 1 58 LEU MD2 1.800 . 3.230 2.158 2.065 2.239 . 0 0 "[ . 1 . 2]" 1
1248 1 58 LEU QB 1 58 LEU MD1 1.800 . 3.220 2.102 2.091 2.113 . 0 0 "[ . 1 . 2]" 1
1249 1 58 LEU QB 1 58 LEU MD2 1.800 . 3.200 2.234 2.160 2.320 . 0 0 "[ . 1 . 2]" 1
1250 1 58 LEU H 1 58 LEU QB 1.800 . 3.000 2.532 2.255 2.673 . 0 0 "[ . 1 . 2]" 1
1251 1 58 LEU H 1 58 LEU MD1 1.800 . 4.550 3.688 3.420 4.193 . 0 0 "[ . 1 . 2]" 1
1252 1 58 LEU H 1 58 LEU MD2 1.800 . 4.960 3.516 2.811 4.218 . 0 0 "[ . 1 . 2]" 1
1253 1 58 LEU H 1 58 LEU HG 1.800 . 4.260 2.492 2.040 3.242 . 0 0 "[ . 1 . 2]" 1
1254 1 60 LEU HA 1 60 LEU MD1 1.800 . 4.350 3.817 3.790 3.832 . 0 0 "[ . 1 . 2]" 1
1255 1 60 LEU HA 1 60 LEU MD2 1.800 . 3.200 2.112 2.087 2.130 . 0 0 "[ . 1 . 2]" 1
1256 1 60 LEU HB3 1 60 LEU MD1 1.800 . 3.970 2.369 2.276 2.425 . 0 0 "[ . 1 . 2]" 1
1257 1 60 LEU HB3 1 60 LEU MD2 1.800 . 3.750 2.298 2.273 2.361 . 0 0 "[ . 1 . 2]" 1
1258 1 60 LEU HB2 1 60 LEU MD1 1.800 . 3.590 2.356 2.280 2.454 . 0 0 "[ . 1 . 2]" 1
1259 1 60 LEU HB2 1 60 LEU MD2 1.800 . 3.920 3.211 3.207 3.215 . 0 0 "[ . 1 . 2]" 1
1260 1 60 LEU H 1 60 LEU HB3 1.800 . 4.040 3.638 3.596 4.060 0.020 11 0 "[ . 1 . 2]" 1
1261 1 60 LEU H 1 60 LEU MD1 1.800 . 4.320 3.569 3.460 4.285 . 0 0 "[ . 1 . 2]" 1
1262 1 60 LEU H 1 60 LEU MD2 1.800 . 3.630 3.093 2.758 3.345 . 0 0 "[ . 1 . 2]" 1
1263 1 60 LEU H 1 60 LEU HG 1.800 . 3.030 2.044 1.873 2.730 . 0 0 "[ . 1 . 2]" 1
1264 1 61 LEU HA 1 61 LEU MD1 1.800 . 3.530 2.484 2.092 2.672 . 0 0 "[ . 1 . 2]" 1
1265 1 61 LEU HA 1 61 LEU MD2 1.800 . 4.640 3.684 2.665 3.757 . 0 0 "[ . 1 . 2]" 1
1266 1 61 LEU HA 1 61 LEU HG 1.800 . 4.050 2.433 2.317 3.671 . 0 0 "[ . 1 . 2]" 1
1267 1 61 LEU HB3 1 61 LEU MD1 1.800 . 3.950 3.156 2.304 3.203 . 0 0 "[ . 1 . 2]" 1
1268 1 61 LEU HB3 1 61 LEU MD2 1.800 . 3.880 2.409 2.282 3.211 . 0 0 "[ . 1 . 2]" 1
1269 1 61 LEU HB2 1 61 LEU MD1 1.800 . 3.810 2.351 2.249 3.224 . 0 0 "[ . 1 . 2]" 1
1270 1 61 LEU HB2 1 61 LEU MD2 1.800 . 3.970 2.354 2.295 2.434 . 0 0 "[ . 1 . 2]" 1
1271 1 61 LEU H 1 61 LEU HB2 1.800 . 4.060 2.277 2.243 2.343 . 0 0 "[ . 1 . 2]" 1
1272 1 61 LEU H 1 61 LEU MD1 1.800 . 4.330 2.102 1.898 3.615 . 0 0 "[ . 1 . 2]" 1
1273 1 61 LEU H 1 61 LEU MD2 1.800 . 4.540 3.706 1.754 3.935 0.046 12 0 "[ . 1 . 2]" 1
1274 1 61 LEU H 1 61 LEU HG 1.800 . 4.600 3.890 3.763 4.005 . 0 0 "[ . 1 . 2]" 1
1275 1 62 GLU HA 1 62 GLU QG 1.800 . 3.640 2.564 2.287 2.868 . 0 0 "[ . 1 . 2]" 1
1276 1 62 GLU H 1 62 GLU QB 1.800 . 3.690 2.359 2.256 2.465 . 0 0 "[ . 1 . 2]" 1
1277 1 62 GLU H 1 62 GLU QG 1.800 . 4.770 3.067 2.322 4.093 . 0 0 "[ . 1 . 2]" 1
1278 1 63 GLN HA 1 63 GLN HE21 1.800 . 5.560 4.764 3.541 5.185 . 0 0 "[ . 1 . 2]" 1
1279 1 63 GLN HA 1 63 GLN HG3 1.800 . 4.210 2.687 2.390 3.598 . 0 0 "[ . 1 . 2]" 1
1280 1 63 GLN HA 1 63 GLN HG2 1.800 . 4.270 2.890 2.317 3.179 . 0 0 "[ . 1 . 2]" 1
1281 1 63 GLN QB 1 63 GLN HE22 1.800 . 4.980 4.003 3.229 4.359 . 0 0 "[ . 1 . 2]" 1
1282 1 63 GLN H 1 63 GLN HG3 1.800 . 5.080 4.364 2.406 4.685 . 0 0 "[ . 1 . 2]" 1
1283 1 63 GLN H 1 63 GLN HG2 1.800 . 5.060 4.337 3.186 4.491 . 0 0 "[ . 1 . 2]" 1
1284 1 65 GLU HA 1 65 GLU QG 1.800 . 3.950 2.553 2.271 2.839 . 0 0 "[ . 1 . 2]" 1
1285 1 65 GLU H 1 65 GLU HB2 1.800 . 3.420 2.633 2.450 2.768 . 0 0 "[ . 1 . 2]" 1
1286 1 65 GLU H 1 65 GLU QG 1.800 . 3.790 3.113 2.726 3.741 . 0 0 "[ . 1 . 2]" 1
1287 1 67 TYR HA 1 67 TYR QD 1.800 . 4.570 2.608 2.422 2.910 . 0 0 "[ . 1 . 2]" 1
1288 1 67 TYR H 1 67 TYR HB3 1.800 . 4.160 3.831 3.719 3.879 . 0 0 "[ . 1 . 2]" 1
1289 1 67 TYR H 1 67 TYR HB2 1.800 . 4.270 2.716 2.515 2.786 . 0 0 "[ . 1 . 2]" 1
1290 1 67 TYR H 1 67 TYR QD 1.800 . 4.470 3.375 3.007 3.722 . 0 0 "[ . 1 . 2]" 1
1291 1 68 LEU HA 1 68 LEU MD1 1.800 . 3.550 2.123 2.069 2.210 . 0 0 "[ . 1 . 2]" 1
1292 1 68 LEU HA 1 68 LEU MD2 1.800 . 4.470 3.719 2.130 3.839 . 0 0 "[ . 1 . 2]" 1
1293 1 68 LEU HB3 1 68 LEU MD1 1.800 . 4.090 3.162 2.417 3.209 . 0 0 "[ . 1 . 2]" 1
1294 1 68 LEU HB3 1 68 LEU MD2 1.800 . 3.710 2.434 2.338 3.195 . 0 0 "[ . 1 . 2]" 1
1295 1 68 LEU HB2 1 68 LEU MD1 1.800 . 4.470 2.412 2.350 3.213 . 0 0 "[ . 1 . 2]" 1
1296 1 68 LEU HB2 1 68 LEU MD2 1.800 . 3.650 2.316 2.205 2.382 . 0 0 "[ . 1 . 2]" 1
1297 1 68 LEU H 1 68 LEU HB3 1.800 . 3.740 2.462 2.378 2.867 . 0 0 "[ . 1 . 2]" 1
1298 1 68 LEU H 1 68 LEU HB2 1.800 . 3.780 3.070 2.573 3.156 . 0 0 "[ . 1 . 2]" 1
1299 1 68 LEU H 1 68 LEU MD2 1.800 . 4.890 4.410 3.918 4.511 . 0 0 "[ . 1 . 2]" 1
1300 1 69 LEU HA 1 69 LEU MD1 1.800 . 4.440 3.786 3.429 3.874 . 0 0 "[ . 1 . 2]" 1
1301 1 69 LEU HA 1 69 LEU MD2 1.800 . 3.890 2.250 2.082 3.450 . 0 0 "[ . 1 . 2]" 1
1302 1 69 LEU HA 1 69 LEU HG 1.800 . 4.150 3.047 2.401 3.193 . 0 0 "[ . 1 . 2]" 1
1303 1 69 LEU HB3 1 69 LEU MD1 1.800 . 3.700 2.445 2.299 3.141 . 0 0 "[ . 1 . 2]" 1
1304 1 69 LEU HB3 1 69 LEU MD2 1.800 . 4.070 2.291 2.203 2.344 . 0 0 "[ . 1 . 2]" 1
1305 1 69 LEU HB2 1 69 LEU MD1 1.800 . 3.450 2.350 2.209 2.420 . 0 0 "[ . 1 . 2]" 1
1306 1 69 LEU HB2 1 69 LEU MD2 1.800 . 3.760 3.157 2.716 3.211 . 0 0 "[ . 1 . 2]" 1
1307 1 69 LEU H 1 69 LEU HB3 1.800 . 4.050 3.692 3.642 3.718 . 0 0 "[ . 1 . 2]" 1
1308 1 69 LEU H 1 69 LEU MD1 1.800 . 3.760 3.534 1.804 3.784 0.024 16 0 "[ . 1 . 2]" 1
1309 1 69 LEU H 1 69 LEU MD2 1.800 . 4.820 3.481 3.079 4.160 . 0 0 "[ . 1 . 2]" 1
1310 1 69 LEU H 1 69 LEU HG 1.800 . 3.960 2.463 2.124 3.232 . 0 0 "[ . 1 . 2]" 1
1311 1 70 ARG HA 1 70 ARG HD3 1.800 . 5.470 4.597 4.227 4.763 . 0 0 "[ . 1 . 2]" 1
1312 1 70 ARG HA 1 70 ARG QD 1.800 . 4.650 4.075 3.911 4.175 . 0 0 "[ . 1 . 2]" 1
1313 1 70 ARG HA 1 70 ARG HD2 1.800 . 5.470 4.584 4.175 4.776 . 0 0 "[ . 1 . 2]" 1
1314 1 70 ARG HA 1 70 ARG HG2 1.800 . 4.350 2.447 2.395 2.494 . 0 0 "[ . 1 . 2]" 1
1315 1 70 ARG QB 1 70 ARG HD3 1.800 . 3.870 2.642 2.337 3.311 . 0 0 "[ . 1 . 2]" 1
1316 1 70 ARG QB 1 70 ARG HD2 1.800 . 3.870 2.930 2.330 3.316 . 0 0 "[ . 1 . 2]" 1
1317 1 70 ARG QB 1 70 ARG HE 1.800 . 4.750 2.424 2.123 3.988 . 0 0 "[ . 1 . 2]" 1
1318 1 70 ARG H 1 70 ARG QB 1.800 . 3.640 2.557 2.435 2.645 . 0 0 "[ . 1 . 2]" 1
1319 1 70 ARG H 1 70 ARG QD 1.800 . 5.390 4.366 4.090 4.785 . 0 0 "[ . 1 . 2]" 1
1320 1 70 ARG H 1 70 ARG HG3 1.800 . 4.260 3.014 2.735 3.191 . 0 0 "[ . 1 . 2]" 1
1321 1 70 ARG H 1 70 ARG HG2 1.800 . 4.550 4.097 3.800 4.268 . 0 0 "[ . 1 . 2]" 1
1322 1 72 VAL HA 1 72 VAL MG1 1.800 . 3.720 2.234 2.203 2.289 . 0 0 "[ . 1 . 2]" 1
1323 1 72 VAL HA 1 72 VAL MG2 1.800 . 4.170 3.199 3.186 3.215 . 0 0 "[ . 1 . 2]" 1
1324 1 72 VAL H 1 72 VAL MG1 1.800 . 3.620 2.929 2.792 3.118 . 0 0 "[ . 1 . 2]" 1
1325 1 72 VAL H 1 72 VAL MG2 1.800 . 3.130 2.033 1.831 2.200 . 0 0 "[ . 1 . 2]" 1
1326 1 73 VAL HA 1 73 VAL MG1 1.800 . 4.070 3.209 3.204 3.216 . 0 0 "[ . 1 . 2]" 1
1327 1 73 VAL HA 1 73 VAL MG2 1.800 . 3.880 2.277 2.237 2.392 . 0 0 "[ . 1 . 2]" 1
1328 1 73 VAL H 1 73 VAL HB 1.800 . 4.260 2.978 2.719 3.249 . 0 0 "[ . 1 . 2]" 1
1329 1 73 VAL H 1 73 VAL MG1 1.800 . 3.380 1.992 1.853 2.092 . 0 0 "[ . 1 . 2]" 1
1330 1 73 VAL H 1 73 VAL MG2 1.800 . 4.250 3.869 3.814 3.905 . 0 0 "[ . 1 . 2]" 1
1331 1 74 VAL HA 1 74 VAL MG1 1.800 . 3.580 2.303 2.223 2.352 . 0 0 "[ . 1 . 2]" 1
1332 1 74 VAL HA 1 74 VAL MG2 1.800 . 3.940 2.446 2.263 3.156 . 0 0 "[ . 1 . 2]" 1
1333 1 74 VAL H 1 74 VAL HB 1.800 . 3.710 2.609 2.427 3.570 . 0 0 "[ . 1 . 2]" 1
1334 1 74 VAL H 1 74 VAL MG1 1.800 . 4.480 3.743 2.933 3.817 . 0 0 "[ . 1 . 2]" 1
1335 1 77 TYR HA 1 77 TYR QD 1.800 . 3.650 2.620 2.290 3.017 . 0 0 "[ . 1 . 2]" 1
1336 1 77 TYR HA 1 77 TYR QE 1.800 . 5.030 4.468 4.284 4.670 . 0 0 "[ . 1 . 2]" 1
1337 1 77 TYR H 1 77 TYR QD 1.800 . 5.120 4.246 3.005 4.417 . 0 0 "[ . 1 . 2]" 1
1338 1 80 ARG HA 1 80 ARG QD 1.800 . 4.230 3.608 2.180 4.171 . 0 0 "[ . 1 . 2]" 1
1339 1 80 ARG HB3 1 80 ARG QD 1.800 . 4.350 2.645 2.254 3.481 . 0 0 "[ . 1 . 2]" 1
1340 1 80 ARG HB2 1 80 ARG QD 1.800 . 4.350 2.728 2.347 3.536 . 0 0 "[ . 1 . 2]" 1
1341 1 80 ARG H 1 80 ARG QG 1.800 . 4.810 2.985 2.481 4.253 . 0 0 "[ . 1 . 2]" 1
1342 1 81 PHE HA 1 81 PHE QD 1.800 . 4.100 2.732 2.563 2.856 . 0 0 "[ . 1 . 2]" 1
1343 1 81 PHE H 1 81 PHE QD 1.800 . 4.410 2.793 2.296 3.179 . 0 0 "[ . 1 . 2]" 1
1344 1 82 GLN HA 1 82 GLN HE21 1.800 . 5.760 4.764 3.989 5.819 0.059 3 0 "[ . 1 . 2]" 1
1345 1 82 GLN QB 1 82 GLN HE21 1.800 . 4.730 2.970 1.757 3.939 0.043 7 0 "[ . 1 . 2]" 1
1346 1 82 GLN QB 1 82 GLN HE22 1.800 . 4.230 3.685 3.121 4.115 . 0 0 "[ . 1 . 2]" 1
1347 1 82 GLN H 1 82 GLN QG 1.800 . 4.230 3.113 2.151 4.116 . 0 0 "[ . 1 . 2]" 1
1348 1 83 VAL HA 1 83 VAL MG1 1.800 . 3.870 2.322 2.211 2.448 . 0 0 "[ . 1 . 2]" 1
1349 1 83 VAL HA 1 83 VAL MG2 1.800 . 4.220 3.195 3.175 3.217 . 0 0 "[ . 1 . 2]" 1
1350 1 83 VAL H 1 83 VAL MG2 1.800 . 4.760 1.894 1.802 1.999 . 0 0 "[ . 1 . 2]" 1
1351 1 84 GLN HA 1 84 GLN HG2 1.800 . 4.420 2.430 2.387 2.478 . 0 0 "[ . 1 . 2]" 1
1352 1 84 GLN HB3 1 84 GLN HE21 1.800 . 4.520 4.345 2.241 4.473 . 0 0 "[ . 1 . 2]" 1
1353 1 84 GLN HB2 1 84 GLN HE21 1.800 . 4.460 4.113 1.921 4.401 . 0 0 "[ . 1 . 2]" 1
1354 1 84 GLN HB2 1 84 GLN HE22 1.800 . 5.220 4.460 3.509 4.611 . 0 0 "[ . 1 . 2]" 1
1355 1 84 GLN H 1 84 GLN HE21 1.800 . 5.620 5.080 4.356 5.371 . 0 0 "[ . 1 . 2]" 1
1356 1 84 GLN H 1 84 GLN HG3 1.800 . 4.130 2.755 2.642 2.892 . 0 0 "[ . 1 . 2]" 1
1357 1 84 GLN H 1 84 GLN HG2 1.800 . 4.930 3.897 3.750 3.995 . 0 0 "[ . 1 . 2]" 1
1358 1 85 VAL HA 1 85 VAL MG1 1.800 . 3.670 2.306 2.253 2.366 . 0 0 "[ . 1 . 2]" 1
1359 1 85 VAL HA 1 85 VAL MG2 1.800 . 3.640 2.416 2.323 2.521 . 0 0 "[ . 1 . 2]" 1
1360 1 85 VAL H 1 85 VAL MG1 1.800 . 4.370 3.814 3.785 3.854 . 0 0 "[ . 1 . 2]" 1
1361 1 85 VAL H 1 85 VAL MG2 1.800 . 3.510 2.250 2.034 2.548 . 0 0 "[ . 1 . 2]" 1
1362 1 86 ASN H 1 86 ASN HD21 1.800 . 5.130 2.919 1.776 4.571 0.024 18 0 "[ . 1 . 2]" 1
1363 1 86 ASN H 1 86 ASN HD22 1.800 . 5.120 3.746 2.892 5.108 . 0 0 "[ . 1 . 2]" 1
1364 1 87 LYS HA 1 87 LYS QD 1.800 . 4.480 3.803 2.191 4.455 . 0 0 "[ . 1 . 2]" 1
1365 1 87 LYS HA 1 87 LYS QG 1.800 . 3.690 2.620 2.225 3.320 . 0 0 "[ . 1 . 2]" 1
1366 1 87 LYS QB 1 87 LYS QE 1.800 . 4.610 3.337 2.137 3.804 . 0 0 "[ . 1 . 2]" 1
1367 1 87 LYS H 1 87 LYS QB 1.800 . 3.740 2.628 2.242 3.435 . 0 0 "[ . 1 . 2]" 1
1368 1 87 LYS H 1 87 LYS QG 1.800 . 4.260 3.487 1.791 4.337 0.077 13 0 "[ . 1 . 2]" 1
1369 1 88 ASN HA 1 88 ASN HD21 1.800 . 4.420 3.220 1.782 4.477 0.057 16 0 "[ . 1 . 2]" 1
1370 1 88 ASN HA 1 88 ASN HD22 1.800 . 4.860 4.032 3.270 4.935 0.075 9 0 "[ . 1 . 2]" 1
1371 1 88 ASN H 1 88 ASN HB3 1.800 . 3.950 3.324 2.419 3.910 . 0 0 "[ . 1 . 2]" 1
1372 1 88 ASN H 1 88 ASN HB2 1.800 . 4.200 2.815 2.282 3.668 . 0 0 "[ . 1 . 2]" 1
1373 1 88 ASN H 1 88 ASN HD21 1.800 . 5.490 4.422 2.984 5.546 0.056 6 0 "[ . 1 . 2]" 1
1374 1 89 SER H 1 89 SER QB 1.800 . 3.430 2.397 2.244 2.619 . 0 0 "[ . 1 . 2]" 1
1375 1 90 SER H 1 90 SER QB 1.800 . 3.690 2.644 2.150 3.194 . 0 0 "[ . 1 . 2]" 1
1376 1 91 ILE HA 1 91 ILE MD 1.800 . 4.350 3.825 3.808 3.848 . 0 0 "[ . 1 . 2]" 1
1377 1 91 ILE HA 1 91 ILE HG13 1.800 . 4.310 2.884 2.858 2.955 . 0 0 "[ . 1 . 2]" 1
1378 1 91 ILE HA 1 91 ILE HG12 1.800 . 4.290 2.552 2.510 2.602 . 0 0 "[ . 1 . 2]" 1
1379 1 91 ILE HA 1 91 ILE MG 1.800 . 3.760 2.336 2.317 2.358 . 0 0 "[ . 1 . 2]" 1
1380 1 91 ILE HB 1 91 ILE MD 1.800 . 3.780 2.315 2.244 2.377 . 0 0 "[ . 1 . 2]" 1
1381 1 91 ILE HG13 1 91 ILE MG 1.800 . 3.870 3.193 3.186 3.201 . 0 0 "[ . 1 . 2]" 1
1382 1 91 ILE HG12 1 91 ILE MG 1.800 . 3.690 2.339 2.312 2.360 . 0 0 "[ . 1 . 2]" 1
1383 1 91 ILE H 1 91 ILE HB 1.800 . 3.490 2.651 2.601 2.723 . 0 0 "[ . 1 . 2]" 1
1384 1 91 ILE H 1 91 ILE MD 1.800 . 5.250 3.975 3.872 4.095 . 0 0 "[ . 1 . 2]" 1
1385 1 91 ILE H 1 91 ILE HG13 1.800 . 3.990 2.973 2.874 3.078 . 0 0 "[ . 1 . 2]" 1
1386 1 91 ILE H 1 91 ILE HG12 1.800 . 4.860 4.156 4.088 4.232 . 0 0 "[ . 1 . 2]" 1
1387 1 91 ILE H 1 91 ILE MG 1.800 . 4.720 3.857 3.837 3.883 . 0 0 "[ . 1 . 2]" 1
1388 1 92 GLU HA 1 92 GLU QG 1.800 . 3.780 2.579 2.344 3.108 . 0 0 "[ . 1 . 2]" 1
1389 1 92 GLU H 1 92 GLU QG 1.800 . 4.110 3.616 2.627 4.170 0.060 8 0 "[ . 1 . 2]" 1
1390 1 93 LYS HA 1 93 LYS QD 1.800 . 4.750 3.985 3.904 4.180 . 0 0 "[ . 1 . 2]" 1
1391 1 93 LYS HA 1 93 LYS HG3 1.800 . 4.400 2.478 2.316 2.811 . 0 0 "[ . 1 . 2]" 1
1392 1 93 LYS HA 1 93 LYS HG2 1.800 . 4.400 2.985 2.374 3.110 . 0 0 "[ . 1 . 2]" 1
1393 1 93 LYS H 1 93 LYS QB 1.800 . 3.180 2.290 2.248 2.310 . 0 0 "[ . 1 . 2]" 1
1394 1 93 LYS H 1 93 LYS HG3 1.800 . 5.130 4.313 2.619 4.532 . 0 0 "[ . 1 . 2]" 1
1395 1 93 LYS H 1 93 LYS QG 1.800 . 4.490 3.847 2.576 3.998 . 0 0 "[ . 1 . 2]" 1
1396 1 93 LYS H 1 93 LYS HG2 1.800 . 5.130 4.391 3.811 4.586 . 0 0 "[ . 1 . 2]" 1
1397 1 94 LEU HA 1 94 LEU QD 1.800 . 3.440 2.138 1.967 2.388 . 0 0 "[ . 1 . 2]" 1
1398 1 94 LEU H 1 94 LEU HB3 1.800 . 4.150 3.631 3.563 3.750 . 0 0 "[ . 1 . 2]" 1
1399 1 94 LEU H 1 94 LEU HB2 1.800 . 3.430 2.401 2.278 2.619 . 0 0 "[ . 1 . 2]" 1
1400 1 94 LEU H 1 94 LEU MD1 1.800 . 4.920 3.414 2.359 4.124 . 0 0 "[ . 1 . 2]" 1
1401 1 94 LEU H 1 94 LEU QD 1.800 . 4.190 2.639 2.196 3.302 . 0 0 "[ . 1 . 2]" 1
1402 1 94 LEU H 1 94 LEU MD2 1.800 . 4.920 3.283 2.206 4.059 . 0 0 "[ . 1 . 2]" 1
1403 1 96 GLU H 1 96 GLU QB 1.800 . 3.090 2.569 2.399 3.088 . 0 0 "[ . 1 . 2]" 1
1404 1 98 ILE HA 1 98 ILE MD 1.800 . 3.880 3.597 2.096 4.111 0.231 11 0 "[ . 1 . 2]" 1
1405 1 98 ILE MD 1 98 ILE MG 1.800 . 2.950 1.908 1.806 2.018 . 0 0 "[ . 1 . 2]" 1
1406 1 98 ILE QG 1 98 ILE MG 1.800 . 3.690 2.272 2.232 2.311 . 0 0 "[ . 1 . 2]" 1
1407 1 98 ILE H 1 98 ILE HB 1.800 . 4.230 2.619 2.378 3.639 . 0 0 "[ . 1 . 2]" 1
1408 1 98 ILE H 1 98 ILE MD 1.800 . 4.070 3.527 2.923 3.752 . 0 0 "[ . 1 . 2]" 1
1409 1 98 ILE H 1 98 ILE QG 1.800 . 3.740 2.365 1.774 2.696 0.026 9 0 "[ . 1 . 2]" 1
1410 1 98 ILE H 1 98 ILE MG 1.800 . 4.030 3.654 2.276 3.823 . 0 0 "[ . 1 . 2]" 1
1411 1 99 GLU HA 1 99 GLU QG 1.800 . 3.940 2.545 2.275 3.456 . 0 0 "[ . 1 . 2]" 1
1412 1 99 GLU H 1 99 GLU QB 1.800 . 3.560 2.468 2.272 3.227 . 0 0 "[ . 1 . 2]" 1
1413 1 99 GLU H 1 99 GLU QG 1.800 . 5.400 2.897 1.816 4.392 . 0 0 "[ . 1 . 2]" 1
1414 1 100 VAL HA 1 100 VAL MG1 1.800 . 3.620 2.339 2.222 3.202 . 0 0 "[ . 1 . 2]" 1
1415 1 100 VAL HA 1 100 VAL MG2 1.800 . 3.740 2.900 2.386 3.217 . 0 0 "[ . 1 . 2]" 1
1416 1 100 VAL H 1 100 VAL HB 1.800 . 4.090 3.305 2.530 3.990 . 0 0 "[ . 1 . 2]" 1
1417 1 100 VAL H 1 100 VAL MG1 1.800 . 4.440 3.008 1.778 3.866 0.022 3 0 "[ . 1 . 2]" 1
1418 1 100 VAL H 1 100 VAL MG2 1.800 . 3.450 2.136 1.784 3.714 0.264 3 0 "[ . 1 . 2]" 1
1419 1 102 LEU HA 1 102 LEU MD1 1.800 . 3.840 2.868 2.103 3.851 0.011 2 0 "[ . 1 . 2]" 1
1420 1 102 LEU HA 1 102 LEU MD2 1.800 . 4.000 3.074 2.116 4.032 0.032 6 0 "[ . 1 . 2]" 1
1421 1 102 LEU QB 1 102 LEU MD1 1.800 . 3.160 2.195 2.108 2.297 . 0 0 "[ . 1 . 2]" 1
1422 1 102 LEU QB 1 102 LEU MD2 1.800 . 3.170 2.180 2.093 2.319 . 0 0 "[ . 1 . 2]" 1
1423 1 102 LEU H 1 102 LEU QB 1.800 . 3.420 2.345 2.232 2.667 . 0 0 "[ . 1 . 2]" 1
1424 1 102 LEU H 1 102 LEU MD1 1.800 . 4.480 3.184 1.908 4.096 . 0 0 "[ . 1 . 2]" 1
1425 1 102 LEU H 1 102 LEU MD2 1.800 . 4.710 3.422 1.782 4.409 0.018 5 0 "[ . 1 . 2]" 1
1426 1 103 GLU HA 1 103 GLU HG3 1.800 . 4.310 3.205 2.349 3.749 . 0 0 "[ . 1 . 2]" 1
1427 1 103 GLU HA 1 103 GLU HG2 1.800 . 4.310 2.959 2.321 3.725 . 0 0 "[ . 1 . 2]" 1
1428 1 103 GLU H 1 103 GLU QB 1.800 . 3.430 2.620 2.282 3.307 . 0 0 "[ . 1 . 2]" 1
1429 1 103 GLU H 1 103 GLU HG3 1.800 . 5.540 3.446 2.181 5.202 . 0 0 "[ . 1 . 2]" 1
1430 1 103 GLU H 1 103 GLU QG 1.800 . 4.760 2.720 1.793 4.406 0.007 16 0 "[ . 1 . 2]" 1
1431 1 103 GLU H 1 103 GLU HG2 1.800 . 5.540 3.244 1.807 4.904 . 0 0 "[ . 1 . 2]" 1
1432 1 105 HIS H 1 105 HIS QB 1.800 . 3.640 2.629 2.258 3.295 . 0 0 "[ . 1 . 2]" 1
1433 1 87 LYS QB 1 88 ASN HB2 1.800 . 5.240 4.312 3.527 5.331 0.091 1 0 "[ . 1 . 2]" 1
1434 1 87 LYS QG 1 88 ASN HB3 1.800 . 5.300 4.387 2.703 5.468 0.168 14 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 84
_Distance_constraint_stats_list.Viol_count 606
_Distance_constraint_stats_list.Viol_total 574.318
_Distance_constraint_stats_list.Viol_max 0.251
_Distance_constraint_stats_list.Viol_rms 0.0299
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0171
_Distance_constraint_stats_list.Viol_average_violations_only 0.0474
_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 3 PRO 0.838 0.149 18 0 "[ . 1 . 2]"
1 4 GLN 0.282 0.070 1 0 "[ . 1 . 2]"
1 5 LEU 0.838 0.149 18 0 "[ . 1 . 2]"
1 6 THR 0.282 0.064 15 0 "[ . 1 . 2]"
1 7 LYS 0.644 0.063 6 0 "[ . 1 . 2]"
1 8 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 ASP 0.644 0.063 6 0 "[ . 1 . 2]"
1 11 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 15 GLY 0.012 0.012 20 0 "[ . 1 . 2]"
1 16 GLN 0.681 0.092 16 0 "[ . 1 . 2]"
1 18 ALA 2.938 0.122 15 0 "[ . 1 . 2]"
1 19 ASN 0.564 0.070 1 0 "[ . 1 . 2]"
1 20 LEU 0.117 0.040 3 0 "[ . 1 . 2]"
1 22 ALA 2.926 0.152 16 0 "[ . 1 . 2]"
1 23 LYS 0.683 0.059 17 0 "[ . 1 . 2]"
1 24 VAL 2.426 0.105 14 0 "[ . 1 . 2]"
1 26 GLN 2.275 0.114 3 0 "[ . 1 . 2]"
1 28 TRP 0.365 0.051 16 0 "[ . 1 . 2]"
1 30 ASN 0.933 0.092 5 0 "[ . 1 . 2]"
1 36 SER 1.003 0.092 5 0 "[ . 1 . 2]"
1 37 GLN 0.454 0.095 14 0 "[ . 1 . 2]"
1 38 VAL 0.365 0.051 16 0 "[ . 1 . 2]"
1 39 GLY 1.903 0.124 4 0 "[ . 1 . 2]"
1 40 LEU 2.275 0.114 3 0 "[ . 1 . 2]"
1 41 LEU 0.859 0.079 6 0 "[ . 1 . 2]"
1 42 GLY 0.683 0.059 17 0 "[ . 1 . 2]"
1 43 ASP 0.111 0.058 17 0 "[ . 1 . 2]"
1 46 GLY 0.111 0.058 17 0 "[ . 1 . 2]"
1 48 ILE 0.859 0.079 6 0 "[ . 1 . 2]"
1 49 LYS 0.437 0.072 11 0 "[ . 1 . 2]"
1 50 PHE 1.903 0.124 4 0 "[ . 1 . 2]"
1 51 THR 0.917 0.130 17 0 "[ . 1 . 2]"
1 52 ILE 0.524 0.095 14 0 "[ . 1 . 2]"
1 53 TRP 1.155 0.126 1 0 "[ . 1 . 2]"
1 64 GLY 0.181 0.068 5 0 "[ . 1 . 2]"
1 65 GLU 2.245 0.105 14 0 "[ . 1 . 2]"
1 66 SER 0.953 0.070 12 0 "[ . 1 . 2]"
1 67 TYR 2.926 0.152 16 0 "[ . 1 . 2]"
1 68 LEU 1.608 0.141 2 0 "[ . 1 . 2]"
1 69 LEU 0.117 0.040 3 0 "[ . 1 . 2]"
1 70 ARG 2.001 0.126 6 0 "[ . 1 . 2]"
1 72 VAL 2.938 0.122 15 0 "[ . 1 . 2]"
1 73 VAL 0.060 0.040 12 0 "[ . 1 . 2]"
1 74 VAL 0.693 0.092 16 0 "[ . 1 . 2]"
1 75 GLY 1.161 0.080 14 0 "[ . 1 . 2]"
1 77 TYR 1.047 0.251 7 0 "[ . 1 . 2]"
1 80 ARG 1.047 0.251 7 0 "[ . 1 . 2]"
1 82 GLN 1.161 0.080 14 0 "[ . 1 . 2]"
1 83 VAL 1.323 0.130 17 0 "[ . 1 . 2]"
1 84 GLN 0.060 0.040 12 0 "[ . 1 . 2]"
1 85 VAL 1.186 0.126 1 0 "[ . 1 . 2]"
1 86 ASN 0.576 0.125 8 0 "[ . 1 . 2]"
1 89 SER 0.576 0.125 8 0 "[ . 1 . 2]"
1 90 SER 2.001 0.126 6 0 "[ . 1 . 2]"
1 92 GLU 1.608 0.141 2 0 "[ . 1 . 2]"
1 94 LEU 0.953 0.070 12 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 3 PRO O 1 5 LEU H 1.700 . 2.300 2.296 1.893 2.449 0.149 18 0 "[ . 1 . 2]" 2
2 1 3 PRO O 1 5 LEU N 2.700 2.700 3.300 2.926 2.684 3.094 0.016 14 0 "[ . 1 . 2]" 2
3 1 6 THR H 1 19 ASN O 1.700 . 2.300 2.219 2.025 2.364 0.064 15 0 "[ . 1 . 2]" 2
4 1 6 THR N 1 19 ASN O 2.700 2.700 3.300 2.978 2.740 3.235 . 0 0 "[ . 1 . 2]" 2
5 1 7 LYS O 1 10 ASP H 1.700 . 2.300 2.332 2.308 2.363 0.063 6 0 "[ . 1 . 2]" 2
6 1 7 LYS O 1 10 ASP N 2.700 2.700 3.300 3.063 3.035 3.112 . 0 0 "[ . 1 . 2]" 2
7 1 8 ILE O 1 11 ILE H 1.700 . 2.300 2.030 1.896 2.270 . 0 0 "[ . 1 . 2]" 2
8 1 8 ILE O 1 11 ILE N 2.700 2.700 3.300 2.942 2.831 3.088 . 0 0 "[ . 1 . 2]" 2
9 1 15 GLY H 1 74 VAL O 1.700 . 2.300 1.928 1.760 2.312 0.012 20 0 "[ . 1 . 2]" 2
10 1 15 GLY N 1 74 VAL O 2.700 2.700 3.300 2.836 2.706 3.142 . 0 0 "[ . 1 . 2]" 2
11 1 18 ALA H 1 72 VAL O 1.700 . 2.300 2.384 2.343 2.422 0.122 15 0 "[ . 1 . 2]" 2
12 1 18 ALA N 1 72 VAL O 2.700 2.700 3.300 3.301 3.240 3.347 0.047 14 0 "[ . 1 . 2]" 2
13 1 4 GLN O 1 19 ASN H 1.700 . 2.300 2.229 1.868 2.370 0.070 1 0 "[ . 1 . 2]" 2
14 1 4 GLN O 1 19 ASN N 2.700 2.700 3.300 3.092 2.742 3.248 . 0 0 "[ . 1 . 2]" 2
15 1 20 LEU H 1 69 LEU O 1.700 . 2.300 2.164 1.880 2.340 0.040 3 0 "[ . 1 . 2]" 2
16 1 20 LEU N 1 69 LEU O 2.700 2.700 3.300 3.043 2.799 3.223 . 0 0 "[ . 1 . 2]" 2
17 1 22 ALA H 1 67 TYR O 1.700 . 2.300 2.397 2.355 2.452 0.152 16 0 "[ . 1 . 2]" 2
18 1 22 ALA N 1 67 TYR O 2.700 2.700 3.300 3.349 3.292 3.405 0.105 16 0 "[ . 1 . 2]" 2
19 1 23 LYS H 1 42 GLY O 1.700 . 2.300 2.248 1.994 2.359 0.059 17 0 "[ . 1 . 2]" 2
20 1 23 LYS N 1 42 GLY O 2.700 2.700 3.300 3.213 2.965 3.331 0.031 8 0 "[ . 1 . 2]" 2
21 1 24 VAL H 1 65 GLU O 1.700 . 2.300 2.373 2.339 2.405 0.105 14 0 "[ . 1 . 2]" 2
22 1 24 VAL N 1 65 GLU O 2.700 2.700 3.300 3.339 3.316 3.366 0.066 16 0 "[ . 1 . 2]" 2
23 1 28 TRP H 1 38 VAL O 1.700 . 2.300 2.001 1.733 2.305 0.005 18 0 "[ . 1 . 2]" 2
24 1 28 TRP N 1 38 VAL O 2.700 2.700 3.300 2.903 2.672 3.206 0.028 5 0 "[ . 1 . 2]" 2
25 1 30 ASN H 1 36 SER O 1.700 . 2.300 2.332 2.152 2.392 0.092 5 0 "[ . 1 . 2]" 2
26 1 30 ASN N 1 36 SER O 2.700 2.700 3.300 3.228 2.894 3.350 0.050 15 0 "[ . 1 . 2]" 2
27 1 36 SER H 1 52 ILE O 1.700 . 2.300 2.085 1.810 2.347 0.047 13 0 "[ . 1 . 2]" 2
28 1 36 SER N 1 52 ILE O 2.700 2.700 3.300 3.003 2.725 3.307 0.007 13 0 "[ . 1 . 2]" 2
29 1 28 TRP O 1 38 VAL H 1.700 . 2.300 2.175 1.822 2.351 0.051 16 0 "[ . 1 . 2]" 2
30 1 28 TRP O 1 38 VAL N 2.700 2.700 3.300 3.138 2.777 3.324 0.024 8 0 "[ . 1 . 2]" 2
31 1 39 GLY H 1 50 PHE O 1.700 . 2.300 2.371 2.336 2.424 0.124 4 0 "[ . 1 . 2]" 2
32 1 39 GLY N 1 50 PHE O 2.700 2.700 3.300 3.318 3.257 3.354 0.054 16 0 "[ . 1 . 2]" 2
33 1 26 GLN O 1 40 LEU H 1.700 . 2.300 2.381 2.268 2.414 0.114 3 0 "[ . 1 . 2]" 2
34 1 26 GLN O 1 40 LEU N 2.700 2.700 3.300 3.325 3.227 3.392 0.092 3 0 "[ . 1 . 2]" 2
35 1 41 LEU H 1 48 ILE O 1.700 . 2.300 1.945 1.829 2.096 . 0 0 "[ . 1 . 2]" 2
36 1 41 LEU N 1 48 ILE O 2.700 2.700 3.300 2.898 2.787 3.062 . 0 0 "[ . 1 . 2]" 2
37 1 23 LYS O 1 42 GLY H 1.700 . 2.300 1.963 1.830 2.256 . 0 0 "[ . 1 . 2]" 2
38 1 23 LYS O 1 42 GLY N 2.700 2.700 3.300 2.815 2.674 3.086 0.026 3 0 "[ . 1 . 2]" 2
39 1 43 ASP H 1 46 GLY O 2.000 . 2.600 2.365 1.942 2.603 0.058 17 0 "[ . 1 . 2]" 2
40 1 43 ASP N 1 46 GLY O 2.700 2.700 3.300 2.934 2.748 3.346 0.046 6 0 "[ . 1 . 2]" 2
41 1 41 LEU O 1 48 ILE H 1.700 . 2.300 2.324 2.189 2.379 0.079 6 0 "[ . 1 . 2]" 2
42 1 41 LEU O 1 48 ILE N 2.700 2.700 3.300 3.247 3.123 3.354 0.054 5 0 "[ . 1 . 2]" 2
43 1 39 GLY O 1 50 PHE H 1.700 . 2.300 2.123 1.926 2.305 0.005 1 0 "[ . 1 . 2]" 2
44 1 39 GLY O 1 50 PHE N 2.700 2.700 3.300 3.060 2.845 3.260 . 0 0 "[ . 1 . 2]" 2
45 1 51 THR H 1 83 VAL O 1.700 . 2.300 2.323 2.178 2.430 0.130 17 0 "[ . 1 . 2]" 2
46 1 51 THR N 1 83 VAL O 2.700 2.700 3.300 3.244 3.118 3.319 0.019 11 0 "[ . 1 . 2]" 2
47 1 37 GLN O 1 52 ILE H 1.700 . 2.300 2.175 1.992 2.395 0.095 14 0 "[ . 1 . 2]" 2
48 1 37 GLN O 1 52 ILE N 2.700 2.700 3.300 3.138 2.960 3.350 0.050 14 0 "[ . 1 . 2]" 2
49 1 53 TRP H 1 85 VAL O 1.700 . 2.300 2.306 1.953 2.426 0.126 1 0 "[ . 1 . 2]" 2
50 1 53 TRP N 1 85 VAL O 2.700 2.700 3.300 3.250 2.917 3.352 0.052 20 0 "[ . 1 . 2]" 2
51 1 24 VAL O 1 64 GLY H 1.700 . 2.300 2.229 1.987 2.368 0.068 5 0 "[ . 1 . 2]" 2
52 1 24 VAL O 1 64 GLY N 2.700 2.700 3.300 3.127 2.790 3.293 . 0 0 "[ . 1 . 2]" 2
53 1 68 LEU H 1 92 GLU O 1.700 . 2.300 2.126 1.925 2.243 . 0 0 "[ . 1 . 2]" 2
54 1 68 LEU N 1 92 GLU O 2.700 2.700 3.300 3.039 2.813 3.165 . 0 0 "[ . 1 . 2]" 2
55 1 20 LEU O 1 69 LEU H 1.700 . 2.300 2.003 1.814 2.327 0.027 7 0 "[ . 1 . 2]" 2
56 1 20 LEU O 1 69 LEU N 2.700 2.700 3.300 2.907 2.715 3.196 . 0 0 "[ . 1 . 2]" 2
57 1 70 ARG H 1 90 SER O 1.700 . 2.300 2.285 2.109 2.351 0.051 13 0 "[ . 1 . 2]" 2
58 1 70 ARG N 1 90 SER O 2.700 2.700 3.300 3.181 3.013 3.289 . 0 0 "[ . 1 . 2]" 2
59 1 18 ALA O 1 72 VAL H 1.700 . 2.300 2.340 2.273 2.377 0.077 6 0 "[ . 1 . 2]" 2
60 1 18 ALA O 1 72 VAL N 2.700 2.700 3.300 3.295 3.236 3.339 0.039 6 0 "[ . 1 . 2]" 2
61 1 16 GLN O 1 74 VAL H 1.700 . 2.300 2.310 2.002 2.392 0.092 16 0 "[ . 1 . 2]" 2
62 1 16 GLN O 1 74 VAL N 2.700 2.700 3.300 3.208 2.944 3.278 . 0 0 "[ . 1 . 2]" 2
63 1 75 GLY H 1 82 GLN O 1.700 . 2.300 2.006 1.750 2.323 0.023 10 0 "[ . 1 . 2]" 2
64 1 75 GLY N 1 82 GLN O 2.700 2.700 3.300 2.778 2.639 3.086 0.061 11 0 "[ . 1 . 2]" 2
65 1 77 TYR H 1 80 ARG O 1.700 . 2.300 2.224 1.907 2.430 0.130 2 0 "[ . 1 . 2]" 2
66 1 77 TYR N 1 80 ARG O 2.700 2.700 3.300 3.063 2.659 3.291 0.041 12 0 "[ . 1 . 2]" 2
67 1 77 TYR O 1 80 ARG H 1.700 . 2.300 2.053 1.740 2.551 0.251 7 0 "[ . 1 . 2]" 2
68 1 77 TYR O 1 80 ARG N 2.700 2.700 3.300 2.778 2.604 3.069 0.096 11 0 "[ . 1 . 2]" 2
69 1 75 GLY O 1 82 GLN H 1.700 . 2.300 2.330 2.220 2.380 0.080 14 0 "[ . 1 . 2]" 2
70 1 75 GLY O 1 82 GLN N 2.700 2.700 3.300 3.270 3.116 3.346 0.046 1 0 "[ . 1 . 2]" 2
71 1 49 LYS O 1 83 VAL H 1.700 . 2.300 2.267 2.104 2.372 0.072 11 0 "[ . 1 . 2]" 2
72 1 49 LYS O 1 83 VAL N 2.700 2.700 3.300 3.202 2.994 3.336 0.036 10 0 "[ . 1 . 2]" 2
73 1 73 VAL O 1 84 GLN H 1.700 . 2.300 2.067 1.929 2.340 0.040 12 0 "[ . 1 . 2]" 2
74 1 73 VAL O 1 84 GLN N 2.700 2.700 3.300 3.036 2.866 3.320 0.020 12 0 "[ . 1 . 2]" 2
75 1 51 THR O 1 85 VAL H 1.700 . 2.300 2.191 2.019 2.331 0.031 18 0 "[ . 1 . 2]" 2
76 1 51 THR O 1 85 VAL N 2.700 2.700 3.300 3.152 2.919 3.286 . 0 0 "[ . 1 . 2]" 2
77 1 86 ASN O 1 89 SER H 1.700 . 2.300 2.267 2.026 2.425 0.125 8 0 "[ . 1 . 2]" 2
78 1 86 ASN O 1 89 SER N 2.700 2.700 3.300 3.050 2.899 3.304 0.004 8 0 "[ . 1 . 2]" 2
79 1 70 ARG O 1 90 SER H 1.700 . 2.300 2.375 2.245 2.426 0.126 6 0 "[ . 1 . 2]" 2
80 1 70 ARG O 1 90 SER N 2.700 2.700 3.300 3.258 3.127 3.336 0.036 14 0 "[ . 1 . 2]" 2
81 1 68 LEU O 1 92 GLU H 1.700 . 2.300 2.373 2.274 2.441 0.141 2 0 "[ . 1 . 2]" 2
82 1 68 LEU O 1 92 GLU N 2.700 2.700 3.300 3.277 3.147 3.340 0.040 2 0 "[ . 1 . 2]" 2
83 1 66 SER O 1 94 LEU H 1.700 . 2.300 2.328 2.186 2.370 0.070 12 0 "[ . 1 . 2]" 2
84 1 66 SER O 1 94 LEU N 2.700 2.700 3.300 3.299 3.147 3.343 0.043 11 0 "[ . 1 . 2]" 2
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