NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
443409 |
2kel   |
16153 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2kel
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 3663
_Distance_constraint_stats_list.Viol_count 5584
_Distance_constraint_stats_list.Viol_total 3600.831
_Distance_constraint_stats_list.Viol_max 1.101
_Distance_constraint_stats_list.Viol_rms 0.0349
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0098
_Distance_constraint_stats_list.Viol_average_violations_only 0.0645
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 11 LYS 3.285 0.866 6 1 "[ .+ 1]"
1 12 GLN 1.801 0.866 6 1 "[ .+ 1]"
1 13 LYS 8.178 0.270 4 0 "[ . 1]"
1 14 ALA 4.954 0.147 4 0 "[ . 1]"
1 15 VAL 7.044 0.188 8 0 "[ . 1]"
1 16 PHE 11.273 0.321 6 0 "[ . 1]"
1 17 GLY 0.877 0.092 2 0 "[ . 1]"
1 18 ILE 10.217 0.133 4 0 "[ . 1]"
1 19 TYR 3.391 0.132 3 0 "[ . 1]"
1 20 MET 15.550 0.275 8 0 "[ . 1]"
1 21 ASP 9.416 0.173 4 0 "[ . 1]"
1 22 LYS 8.083 0.205 10 0 "[ . 1]"
1 23 ASP 4.878 0.152 9 0 "[ . 1]"
1 24 LEU 17.629 0.392 8 0 "[ . 1]"
1 25 LYS 16.948 0.392 8 0 "[ . 1]"
1 26 THR 7.083 0.261 10 0 "[ . 1]"
1 27 ARG 9.797 0.261 10 0 "[ . 1]"
1 28 LEU 16.470 0.316 5 0 "[ . 1]"
1 29 LYS 5.751 0.137 9 0 "[ . 1]"
1 30 VAL 8.077 0.151 3 0 "[ . 1]"
1 31 TYR 14.780 0.197 1 0 "[ . 1]"
1 32 CYS 8.160 0.121 5 0 "[ . 1]"
1 33 ALA 1.976 0.136 8 0 "[ . 1]"
1 34 LYS 10.278 0.388 10 0 "[ . 1]"
1 35 ASN 7.318 0.388 10 0 "[ . 1]"
1 36 ASN 10.057 1.101 5 3 "[-* + 1]"
1 37 LEU 12.095 0.388 10 0 "[ . 1]"
1 38 GLN 3.248 0.116 6 0 "[ . 1]"
1 39 LEU 8.817 0.172 8 0 "[ . 1]"
1 40 THR 5.315 0.152 2 0 "[ . 1]"
1 41 GLN 4.698 0.261 10 0 "[ . 1]"
1 42 ALA 5.979 0.183 1 0 "[ . 1]"
1 43 ILE 16.197 0.272 5 0 "[ . 1]"
1 44 GLU 13.843 0.238 1 0 "[ . 1]"
1 45 GLU 4.537 0.172 8 0 "[ . 1]"
1 46 ALA 9.762 0.261 10 0 "[ . 1]"
1 47 ILE 22.770 0.302 1 0 "[ . 1]"
1 48 LYS 12.234 0.301 1 0 "[ . 1]"
1 49 GLU 9.514 0.391 9 0 "[ . 1]"
1 50 TYR 26.158 0.302 1 0 "[ . 1]"
1 51 LEU 14.114 0.272 5 0 "[ . 1]"
1 52 GLN 7.023 0.217 3 0 "[ . 1]"
1 53 LYS 14.213 0.302 1 0 "[ . 1]"
1 54 ARG 16.602 0.298 7 0 "[ . 1]"
1 55 ASN 10.209 0.298 7 0 "[ . 1]"
1 56 GLY 3.732 0.151 3 0 "[ . 1]"
2 11 LYS 3.276 0.872 6 1 "[ .+ 1]"
2 12 GLN 1.795 0.872 6 1 "[ .+ 1]"
2 13 LYS 8.261 0.269 4 0 "[ . 1]"
2 14 ALA 4.974 0.147 4 0 "[ . 1]"
2 15 VAL 7.047 0.190 8 0 "[ . 1]"
2 16 PHE 11.163 0.316 5 0 "[ . 1]"
2 17 GLY 0.916 0.094 2 0 "[ . 1]"
2 18 ILE 10.246 0.133 4 0 "[ . 1]"
2 19 TYR 3.475 0.135 3 0 "[ . 1]"
2 20 MET 15.480 0.282 8 0 "[ . 1]"
2 21 ASP 9.377 0.176 4 0 "[ . 1]"
2 22 LYS 8.023 0.207 10 0 "[ . 1]"
2 23 ASP 4.908 0.153 9 0 "[ . 1]"
2 24 LEU 17.566 0.390 8 0 "[ . 1]"
2 25 LYS 16.865 0.390 8 0 "[ . 1]"
2 26 THR 7.090 0.261 3 0 "[ . 1]"
2 27 ARG 9.752 0.261 3 0 "[ . 1]"
2 28 LEU 16.378 0.321 6 0 "[ . 1]"
2 29 LYS 5.778 0.136 4 0 "[ . 1]"
2 30 VAL 8.037 0.153 3 0 "[ . 1]"
2 31 TYR 14.714 0.195 1 0 "[ . 1]"
2 32 CYS 8.161 0.120 1 0 "[ . 1]"
2 33 ALA 1.995 0.135 8 0 "[ . 1]"
2 34 LYS 10.298 0.387 10 0 "[ . 1]"
2 35 ASN 7.389 0.387 10 0 "[ . 1]"
2 36 ASN 10.127 1.096 5 3 "[-* + 1]"
2 37 LEU 12.137 0.387 10 0 "[ . 1]"
2 38 GLN 3.264 0.121 6 0 "[ . 1]"
2 39 LEU 8.772 0.173 8 0 "[ . 1]"
2 40 THR 5.371 0.154 2 0 "[ . 1]"
2 41 GLN 4.603 0.267 10 0 "[ . 1]"
2 42 ALA 5.917 0.179 1 0 "[ . 1]"
2 43 ILE 16.327 0.280 5 0 "[ . 1]"
2 44 GLU 13.873 0.238 1 0 "[ . 1]"
2 45 GLU 4.621 0.173 8 0 "[ . 1]"
2 46 ALA 9.681 0.267 10 0 "[ . 1]"
2 47 ILE 22.807 0.301 1 0 "[ . 1]"
2 48 LYS 12.343 0.302 1 0 "[ . 1]"
2 49 GLU 9.551 0.386 9 0 "[ . 1]"
2 50 TYR 26.258 0.301 1 0 "[ . 1]"
2 51 LEU 14.272 0.280 5 0 "[ . 1]"
2 52 GLN 7.040 0.224 3 0 "[ . 1]"
2 53 LYS 14.200 0.302 1 0 "[ . 1]"
2 54 ARG 16.696 0.301 7 0 "[ . 1]"
2 55 ASN 10.268 0.301 7 0 "[ . 1]"
2 56 GLY 3.738 0.153 3 0 "[ . 1]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 40 THR H 1 40 THR HB 2.680 2.363 2.997 2.687 2.651 2.756 . 0 0 "[ . 1]" 1
2 2 40 THR H 2 40 THR HB 2.680 2.363 2.997 2.690 2.651 2.754 . 0 0 "[ . 1]" 1
3 1 26 THR HA 1 30 VAL H 3.532 . 6.000 4.069 3.999 4.192 . 0 0 "[ . 1]" 1
4 2 26 THR HA 2 30 VAL H 3.532 . 6.000 4.069 4.004 4.191 . 0 0 "[ . 1]" 1
5 1 40 THR HA 2 18 ILE MD . . 3.055 2.229 2.183 2.261 . 0 0 "[ . 1]" 1
6 1 18 ILE MD 2 40 THR HA . . 3.055 2.232 2.190 2.257 . 0 0 "[ . 1]" 1
7 1 32 CYS H 1 32 CYS HA 2.854 2.479 3.229 2.860 2.839 2.872 . 0 0 "[ . 1]" 1
8 2 32 CYS H 2 32 CYS HA 2.854 2.479 3.229 2.860 2.842 2.870 . 0 0 "[ . 1]" 1
9 1 32 CYS HA 1 32 CYS HB2 2.916 2.597 3.235 3.020 3.016 3.023 . 0 0 "[ . 1]" 1
10 2 32 CYS HA 2 32 CYS HB2 2.916 2.597 3.235 3.019 3.016 3.021 . 0 0 "[ . 1]" 1
11 1 32 CYS HA 1 37 LEU MD2 2.592 . 6.000 3.739 3.605 3.825 . 0 0 "[ . 1]" 1
12 2 32 CYS HA 2 37 LEU MD2 2.592 . 6.000 3.737 3.611 3.821 . 0 0 "[ . 1]" 1
13 1 43 ILE HA 1 43 ILE MG 1.973 . 6.000 2.747 2.739 2.754 . 0 0 "[ . 1]" 1
14 2 43 ILE HA 2 43 ILE MG 1.973 . 6.000 2.747 2.743 2.753 . 0 0 "[ . 1]" 1
15 1 31 TYR HA 1 31 TYR QD 2.444 2.129 2.759 2.675 2.457 2.797 0.038 5 0 "[ . 1]" 1
16 2 31 TYR HA 2 31 TYR QD 2.444 2.129 2.759 2.673 2.460 2.797 0.038 5 0 "[ . 1]" 1
17 1 31 TYR HA 1 31 TYR HB2 2.320 2.058 2.582 2.432 2.410 2.457 . 0 0 "[ . 1]" 1
18 2 31 TYR HA 2 31 TYR HB2 2.320 2.058 2.582 2.432 2.412 2.454 . 0 0 "[ . 1]" 1
19 1 31 TYR HA 1 34 LYS QB 2.934 2.564 3.304 2.681 2.547 2.852 0.017 10 0 "[ . 1]" 1
20 2 31 TYR HA 2 34 LYS QB 2.934 2.564 3.304 2.681 2.550 2.853 0.014 10 0 "[ . 1]" 1
21 1 15 VAL H 1 15 VAL HA 3.000 2.615 3.385 2.948 2.944 2.952 . 0 0 "[ . 1]" 1
22 2 15 VAL H 2 15 VAL HA 3.000 2.615 3.385 2.949 2.943 2.956 . 0 0 "[ . 1]" 1
23 1 15 VAL HA 2 19 TYR QD . 2.559 3.327 2.733 2.618 2.842 . 0 0 "[ . 1]" 1
24 1 19 TYR QD 2 15 VAL HA . 2.559 3.327 2.731 2.610 2.840 . 0 0 "[ . 1]" 1
25 1 48 LYS HA 1 48 LYS QG 2.939 2.606 3.272 2.876 2.663 3.176 . 0 0 "[ . 1]" 1
26 2 48 LYS HA 2 48 LYS QG 2.939 2.606 3.272 2.876 2.663 3.175 . 0 0 "[ . 1]" 1
27 1 44 GLU HA 1 44 GLU HG2 2.417 2.082 2.752 2.525 2.460 2.567 . 0 0 "[ . 1]" 1
28 2 44 GLU HA 2 44 GLU HG2 2.417 2.082 2.752 2.526 2.459 2.571 . 0 0 "[ . 1]" 1
29 1 29 LYS HA 1 32 CYS HB2 3.300 2.720 3.880 2.709 2.688 2.749 0.032 6 0 "[ . 1]" 1
30 2 29 LYS HA 2 32 CYS HB2 3.300 2.720 3.880 2.709 2.687 2.749 0.033 7 0 "[ . 1]" 1
31 1 29 LYS HA 1 29 LYS QB 2.196 . 2.432 2.336 2.306 2.361 . 0 0 "[ . 1]" 1
32 2 29 LYS HA 2 29 LYS QB 2.196 . 2.432 2.337 2.306 2.358 . 0 0 "[ . 1]" 1
33 1 22 LYS HA 1 25 LYS QB 2.357 . 6.000 2.955 2.854 3.124 . 0 0 "[ . 1]" 1
34 2 22 LYS HA 2 25 LYS QB 2.357 . 6.000 2.953 2.854 3.124 . 0 0 "[ . 1]" 1
35 1 20 MET ME 1 25 LYS HA 2.115 . 2.389 2.451 2.399 2.664 0.275 8 0 "[ . 1]" 1
36 2 20 MET ME 2 25 LYS HA 2.115 . 2.389 2.453 2.395 2.671 0.282 8 0 "[ . 1]" 1
37 1 29 LYS HA 1 29 LYS QG 2.611 2.287 2.935 2.498 2.453 2.558 . 0 0 "[ . 1]" 1
38 2 29 LYS HA 2 29 LYS QG 2.611 2.287 2.935 2.496 2.450 2.551 . 0 0 "[ . 1]" 1
39 1 45 GLU HA 1 48 LYS HB2 3.160 2.857 3.463 3.365 3.245 3.474 0.011 10 0 "[ . 1]" 1
40 2 45 GLU HA 2 48 LYS HB2 3.160 2.857 3.463 3.367 3.251 3.478 0.015 10 0 "[ . 1]" 1
41 1 18 ILE HA 1 19 TYR H 2.443 2.175 2.711 2.422 2.358 2.483 . 0 0 "[ . 1]" 1
42 2 18 ILE HA 2 19 TYR H 2.443 2.175 2.711 2.421 2.367 2.481 . 0 0 "[ . 1]" 1
43 1 27 ARG HA 1 27 ARG HB3 2.555 . 6.000 3.004 2.986 3.016 . 0 0 "[ . 1]" 1
44 2 27 ARG HA 2 27 ARG HB3 2.555 . 6.000 3.003 2.983 3.015 . 0 0 "[ . 1]" 1
45 1 27 ARG HA 1 27 ARG HG3 2.621 . 6.000 3.346 3.272 3.449 . 0 0 "[ . 1]" 1
46 2 27 ARG HA 2 27 ARG HG3 2.621 . 6.000 3.347 3.273 3.454 . 0 0 "[ . 1]" 1
47 1 16 PHE QR 1 18 ILE HA 4.203 3.626 4.780 4.865 4.831 4.903 0.123 8 0 "[ . 1]" 1
48 2 16 PHE QR 2 18 ILE HA 4.203 3.626 4.780 4.864 4.831 4.903 0.123 10 0 "[ . 1]" 1
49 1 41 GLN H 1 41 GLN HA 2.764 2.424 3.104 2.772 2.759 2.786 . 0 0 "[ . 1]" 1
50 2 41 GLN H 2 41 GLN HA 2.764 2.424 3.104 2.772 2.761 2.782 . 0 0 "[ . 1]" 1
51 1 52 GLN HA 1 52 GLN HG2 3.722 3.404 4.040 3.592 3.554 3.626 . 0 0 "[ . 1]" 1
52 2 52 GLN HA 2 52 GLN HG2 3.722 3.404 4.040 3.592 3.555 3.623 . 0 0 "[ . 1]" 1
53 1 39 LEU HA 1 39 LEU HB2 2.477 2.196 2.758 2.810 2.785 2.829 0.071 8 0 "[ . 1]" 1
54 2 39 LEU HA 2 39 LEU HB2 2.477 2.196 2.758 2.810 2.783 2.828 0.070 8 0 "[ . 1]" 1
55 1 18 ILE HA 1 18 ILE HG12 3.429 3.017 3.841 3.760 3.748 3.787 . 0 0 "[ . 1]" 1
56 2 18 ILE HA 2 18 ILE HG12 3.429 3.017 3.841 3.760 3.747 3.782 . 0 0 "[ . 1]" 1
57 1 18 ILE HA 1 18 ILE MG 1.725 . 6.000 2.295 2.276 2.315 . 0 0 "[ . 1]" 1
58 2 18 ILE HA 2 18 ILE MG 1.725 . 6.000 2.295 2.277 2.314 . 0 0 "[ . 1]" 1
59 1 34 LYS H 1 34 LYS HA 2.698 2.397 2.999 2.833 2.818 2.854 . 0 0 "[ . 1]" 1
60 2 34 LYS H 2 34 LYS HA 2.698 2.397 2.999 2.832 2.817 2.853 . 0 0 "[ . 1]" 1
61 1 53 LYS H 1 53 LYS HA 2.639 2.351 2.927 2.858 2.844 2.878 . 0 0 "[ . 1]" 1
62 2 53 LYS H 2 53 LYS HA 2.639 2.351 2.927 2.859 2.846 2.877 . 0 0 "[ . 1]" 1
63 1 34 LYS HA 1 35 ASN H 3.699 3.202 4.196 3.527 3.515 3.536 . 0 0 "[ . 1]" 1
64 2 34 LYS HA 2 35 ASN H 3.699 3.202 4.196 3.526 3.513 3.532 . 0 0 "[ . 1]" 1
65 1 53 LYS HA 1 54 ARG H 3.164 2.775 3.553 3.370 3.348 3.392 . 0 0 "[ . 1]" 1
66 2 53 LYS HA 2 54 ARG H 3.164 2.775 3.553 3.371 3.352 3.394 . 0 0 "[ . 1]" 1
67 1 34 LYS HA 1 34 LYS QB 2.207 2.009 2.405 2.361 2.349 2.377 . 0 0 "[ . 1]" 1
68 2 34 LYS HA 2 34 LYS QB 2.207 2.009 2.405 2.360 2.349 2.375 . 0 0 "[ . 1]" 1
69 1 24 LEU HA 2 48 LYS QE 3.816 3.206 4.426 3.711 3.359 4.117 . 0 0 "[ . 1]" 1
70 1 48 LYS QE 2 24 LEU HA 3.816 3.206 4.426 3.709 3.366 4.108 . 0 0 "[ . 1]" 1
71 1 23 ASP H 1 23 ASP HA 2.817 2.469 3.165 2.735 2.721 2.756 . 0 0 "[ . 1]" 1
72 2 23 ASP H 2 23 ASP HA 2.817 2.469 3.165 2.734 2.721 2.756 . 0 0 "[ . 1]" 1
73 1 50 TYR QD 1 51 LEU HA 5.217 3.807 6.627 3.821 3.773 3.884 0.034 3 0 "[ . 1]" 1
74 2 50 TYR QD 2 51 LEU HA 5.217 3.807 6.627 3.821 3.771 3.883 0.036 3 0 "[ . 1]" 1
75 1 23 ASP HA 1 23 ASP HB3 2.727 2.488 2.966 3.016 2.996 3.020 0.054 10 0 "[ . 1]" 1
76 2 23 ASP HA 2 23 ASP HB3 2.727 2.488 2.966 3.016 3.000 3.021 0.055 3 0 "[ . 1]" 1
77 1 24 LEU HA 1 24 LEU QD 1.678 . 6.000 2.389 2.152 2.886 . 0 0 "[ . 1]" 1
78 2 24 LEU HA 2 24 LEU QD 1.678 . 6.000 2.390 2.148 2.890 . 0 0 "[ . 1]" 1
79 1 54 ARG H 1 54 ARG HA 2.977 2.620 3.334 2.921 2.912 2.928 . 0 0 "[ . 1]" 1
80 2 54 ARG H 2 54 ARG HA 2.977 2.620 3.334 2.921 2.909 2.928 . 0 0 "[ . 1]" 1
81 1 21 ASP HA 1 21 ASP HB2 2.732 2.472 2.992 2.991 2.979 3.013 0.021 10 0 "[ . 1]" 1
82 2 21 ASP HA 2 21 ASP HB2 2.732 2.472 2.992 2.992 2.980 3.010 0.018 10 0 "[ . 1]" 1
83 1 54 ARG HA 1 54 ARG HB2 2.874 2.495 3.253 2.678 2.646 2.716 . 0 0 "[ . 1]" 1
84 2 54 ARG HA 2 54 ARG HB2 2.874 2.495 3.253 2.677 2.648 2.708 . 0 0 "[ . 1]" 1
85 1 54 ARG HA 1 54 ARG HG2 3.481 3.164 3.798 3.622 3.603 3.646 . 0 0 "[ . 1]" 1
86 2 54 ARG HA 2 54 ARG HG2 3.481 3.164 3.798 3.622 3.597 3.649 . 0 0 "[ . 1]" 1
87 1 54 ARG HA 1 54 ARG HB3 3.210 2.814 3.606 2.968 2.946 2.989 . 0 0 "[ . 1]" 1
88 2 54 ARG HA 2 54 ARG HB3 3.210 2.814 3.606 2.968 2.947 2.991 . 0 0 "[ . 1]" 1
89 1 46 ALA H 1 46 ALA HA 2.894 2.522 3.266 2.808 2.798 2.820 . 0 0 "[ . 1]" 1
90 2 46 ALA H 2 46 ALA HA 2.894 2.522 3.266 2.808 2.797 2.818 . 0 0 "[ . 1]" 1
91 1 46 ALA HA 2 50 TYR QD 2.270 . 2.454 2.351 2.258 2.455 0.001 1 0 "[ . 1]" 1
92 1 50 TYR QD 2 46 ALA HA 2.270 . 2.454 2.349 2.248 2.456 0.002 1 0 "[ . 1]" 1
93 1 42 ALA HA 1 45 GLU QB 2.765 2.423 3.107 2.625 2.500 2.833 . 0 0 "[ . 1]" 1
94 2 42 ALA HA 2 45 GLU QB 2.765 2.423 3.107 2.625 2.497 2.831 . 0 0 "[ . 1]" 1
95 1 13 LYS HA 1 13 LYS QG 3.633 3.226 4.040 3.354 3.336 3.452 . 0 0 "[ . 1]" 1
96 2 13 LYS HA 2 13 LYS QG 3.633 3.226 4.040 3.353 3.334 3.450 . 0 0 "[ . 1]" 1
97 1 14 ALA HA 1 15 VAL HB 4.347 . 6.000 5.122 5.066 5.177 . 0 0 "[ . 1]" 1
98 2 14 ALA HA 2 15 VAL HB 4.347 . 6.000 5.122 5.068 5.180 . 0 0 "[ . 1]" 1
99 1 14 ALA HA 1 14 ALA MB 1.769 . 2.031 2.129 2.121 2.132 0.101 3 0 "[ . 1]" 1
100 2 14 ALA HA 2 14 ALA MB 1.769 . 2.031 2.129 2.120 2.134 0.103 5 0 "[ . 1]" 1
101 1 37 LEU HB2 1 38 GLN H 4.454 3.884 5.024 3.960 3.944 3.978 . 0 0 "[ . 1]" 1
102 2 37 LEU HB2 2 38 GLN H 4.454 3.884 5.024 3.960 3.944 3.980 . 0 0 "[ . 1]" 1
103 1 37 LEU HA 1 37 LEU HB2 3.256 2.800 3.712 2.895 2.881 2.915 . 0 0 "[ . 1]" 1
104 2 37 LEU HA 2 37 LEU HB2 3.256 2.800 3.712 2.895 2.882 2.913 . 0 0 "[ . 1]" 1
105 1 32 CYS HA 1 37 LEU HB3 3.108 2.728 3.488 2.941 2.811 3.054 . 0 0 "[ . 1]" 1
106 2 32 CYS HA 2 37 LEU HB3 3.108 2.728 3.488 2.940 2.807 3.057 . 0 0 "[ . 1]" 1
107 1 37 LEU HB2 1 37 LEU MD1 1.882 . 6.000 2.417 2.390 2.466 . 0 0 "[ . 1]" 1
108 2 37 LEU HB2 2 37 LEU MD1 1.882 . 6.000 2.415 2.393 2.461 . 0 0 "[ . 1]" 1
109 1 37 LEU HB3 1 37 LEU MD1 2.500 . 6.000 3.199 3.195 3.204 . 0 0 "[ . 1]" 1
110 2 37 LEU HB3 2 37 LEU MD1 2.500 . 6.000 3.198 3.195 3.204 . 0 0 "[ . 1]" 1
111 1 56 GLY H 1 56 GLY HA3 2.746 2.444 3.048 2.904 2.847 2.945 . 0 0 "[ . 1]" 1
112 2 56 GLY H 2 56 GLY HA3 2.746 2.444 3.048 2.905 2.850 2.946 . 0 0 "[ . 1]" 1
113 1 56 GLY HA3 2 31 TYR QD 4.119 . 6.000 4.930 4.668 5.352 . 0 0 "[ . 1]" 1
114 1 31 TYR QD 2 56 GLY HA3 4.119 . 6.000 4.934 4.678 5.314 . 0 0 "[ . 1]" 1
115 1 51 LEU MD1 1 56 GLY HA3 2.374 . 6.000 3.444 3.187 3.668 . 0 0 "[ . 1]" 1
116 2 51 LEU MD1 2 56 GLY HA3 2.374 . 6.000 3.444 3.179 3.667 . 0 0 "[ . 1]" 1
117 1 17 GLY HA2 1 18 ILE H 2.326 2.071 2.581 2.214 2.201 2.232 . 0 0 "[ . 1]" 1
118 2 17 GLY HA2 2 18 ILE H 2.326 2.071 2.581 2.213 2.198 2.244 . 0 0 "[ . 1]" 1
119 1 56 GLY HA2 2 31 TYR QD 2.824 . 6.000 3.468 3.305 3.790 . 0 0 "[ . 1]" 1
120 1 31 TYR QD 2 56 GLY HA2 2.824 . 6.000 3.471 3.323 3.747 . 0 0 "[ . 1]" 1
121 1 39 LEU HA 1 39 LEU HB3 2.715 2.377 3.053 2.874 2.847 2.903 . 0 0 "[ . 1]" 1
122 2 39 LEU HA 2 39 LEU HB3 2.715 2.377 3.053 2.874 2.845 2.899 . 0 0 "[ . 1]" 1
123 1 28 LEU HB2 1 29 LYS H 3.965 3.482 4.448 3.856 3.826 3.876 . 0 0 "[ . 1]" 1
124 2 28 LEU HB2 2 29 LYS H 3.965 3.482 4.448 3.855 3.832 3.870 . 0 0 "[ . 1]" 1
125 1 24 LEU HA 1 24 LEU HB2 2.589 2.233 2.945 2.347 2.293 2.378 . 0 0 "[ . 1]" 1
126 2 24 LEU HA 2 24 LEU HB2 2.589 2.233 2.945 2.348 2.294 2.378 . 0 0 "[ . 1]" 1
127 1 24 LEU HA 1 24 LEU HB3 3.048 2.687 3.409 2.988 2.965 3.001 . 0 0 "[ . 1]" 1
128 2 24 LEU HA 2 24 LEU HB3 3.048 2.687 3.409 2.989 2.965 3.001 . 0 0 "[ . 1]" 1
129 1 24 LEU HB3 1 24 LEU QD 1.713 . 2.007 2.068 2.020 2.098 0.091 5 0 "[ . 1]" 1
130 2 24 LEU HB3 2 24 LEU QD 1.713 . 2.007 2.068 2.020 2.095 0.088 5 0 "[ . 1]" 1
131 1 28 LEU HB2 1 28 LEU MD1 2.115 . 6.000 3.134 3.130 3.138 . 0 0 "[ . 1]" 1
132 2 28 LEU HB2 2 28 LEU MD1 2.115 . 6.000 3.132 3.127 3.138 . 0 0 "[ . 1]" 1
133 1 51 LEU HB2 1 51 LEU MD2 1.769 . 2.098 2.147 2.137 2.156 0.058 9 0 "[ . 1]" 1
134 2 51 LEU HB2 2 51 LEU MD2 1.769 . 2.098 2.147 2.135 2.155 0.057 9 0 "[ . 1]" 1
135 1 51 LEU HB2 1 51 LEU MD1 3.023 2.474 3.572 3.077 3.060 3.093 . 0 0 "[ . 1]" 1
136 2 51 LEU HB2 2 51 LEU MD1 3.023 2.474 3.572 3.076 3.058 3.098 . 0 0 "[ . 1]" 1
137 1 54 ARG HD2 2 31 TYR QE 5.027 4.418 5.636 5.161 5.011 5.429 . 0 0 "[ . 1]" 1
138 1 31 TYR QE 2 54 ARG HD2 5.027 4.418 5.636 5.159 5.009 5.442 . 0 0 "[ . 1]" 1
139 1 18 ILE HB 1 19 TYR H 2.210 . 2.506 2.276 2.126 2.430 . 0 0 "[ . 1]" 1
140 2 18 ILE HB 2 19 TYR H 2.210 . 2.506 2.275 2.135 2.428 . 0 0 "[ . 1]" 1
141 1 23 ASP HB2 1 24 LEU H 4.081 3.648 4.514 3.984 3.911 4.103 . 0 0 "[ . 1]" 1
142 2 23 ASP HB2 2 24 LEU H 4.081 3.648 4.514 3.985 3.905 4.104 . 0 0 "[ . 1]" 1
143 1 23 ASP HA 1 23 ASP HB2 2.660 2.338 2.982 2.410 2.336 2.437 0.002 5 0 "[ . 1]" 1
144 2 23 ASP HA 2 23 ASP HB2 2.660 2.338 2.982 2.411 2.342 2.440 . 0 0 "[ . 1]" 1
145 1 18 ILE HA 1 18 ILE HB 2.513 2.194 2.832 2.466 2.445 2.482 . 0 0 "[ . 1]" 1
146 2 18 ILE HA 2 18 ILE HB 2.513 2.194 2.832 2.467 2.447 2.484 . 0 0 "[ . 1]" 1
147 1 50 TYR QB 2 46 ALA HA . 2.109 2.709 2.124 2.092 2.161 0.017 2 0 "[ . 1]" 1
148 1 46 ALA HA 2 50 TYR QB . 2.109 2.709 2.126 2.095 2.160 0.014 2 0 "[ . 1]" 1
149 1 19 TYR HB3 2 13 LYS QD 2.674 2.389 2.959 2.713 2.359 2.982 0.030 7 0 "[ . 1]" 1
150 1 13 LYS QD 2 19 TYR HB3 2.674 2.389 2.959 2.715 2.364 2.977 0.025 7 0 "[ . 1]" 1
151 1 50 TYR QB 2 46 ALA MB 1.943 . 2.226 2.096 2.047 2.125 . 0 0 "[ . 1]" 1
152 1 46 ALA MB 2 50 TYR QB 1.943 . 2.226 2.099 2.062 2.132 . 0 0 "[ . 1]" 1
153 1 19 TYR HB2 2 13 LYS QD 3.953 3.517 4.389 3.838 3.496 4.207 0.021 7 0 "[ . 1]" 1
154 1 13 LYS QD 2 19 TYR HB2 3.953 3.517 4.389 3.841 3.506 4.209 0.011 7 0 "[ . 1]" 1
155 1 20 MET H 1 20 MET HB3 3.717 . 6.000 2.960 2.728 3.063 . 0 0 "[ . 1]" 1
156 2 20 MET H 2 20 MET HB3 3.717 . 6.000 2.958 2.732 3.061 . 0 0 "[ . 1]" 1
157 1 55 ASN HB2 1 56 GLY H 5.541 . 6.000 3.047 2.909 3.182 . 0 0 "[ . 1]" 1
158 2 55 ASN HB2 2 56 GLY H 5.541 . 6.000 3.045 2.893 3.178 . 0 0 "[ . 1]" 1
159 1 20 MET HA 1 20 MET HB3 2.906 2.496 3.316 2.472 2.454 2.586 0.042 10 0 "[ . 1]" 1
160 2 20 MET HA 2 20 MET HB3 2.906 2.496 3.316 2.472 2.453 2.585 0.043 10 0 "[ . 1]" 1
161 1 55 ASN HA 1 55 ASN HB2 2.784 2.507 3.061 2.596 2.581 2.619 . 0 0 "[ . 1]" 1
162 2 55 ASN HA 2 55 ASN HB2 2.784 2.507 3.061 2.596 2.582 2.619 . 0 0 "[ . 1]" 1
163 1 45 GLU H 1 45 GLU HG3 4.509 . 6.000 3.627 3.467 3.729 . 0 0 "[ . 1]" 1
164 2 45 GLU H 2 45 GLU HG3 4.509 . 6.000 3.626 3.468 3.713 . 0 0 "[ . 1]" 1
165 1 45 GLU HG2 2 50 TYR QE 5.065 4.429 5.701 5.209 5.106 5.343 . 0 0 "[ . 1]" 1
166 1 50 TYR QE 2 45 GLU HG2 5.065 4.429 5.701 5.205 5.090 5.335 . 0 0 "[ . 1]" 1
167 1 45 GLU HG3 2 50 TYR QE 4.628 3.972 5.284 4.464 4.341 4.655 . 0 0 "[ . 1]" 1
168 1 50 TYR QE 2 45 GLU HG3 4.628 3.972 5.284 4.461 4.333 4.663 . 0 0 "[ . 1]" 1
169 1 45 GLU HA 1 45 GLU HG3 3.678 3.302 4.054 3.745 3.681 3.766 . 0 0 "[ . 1]" 1
170 2 45 GLU HA 2 45 GLU HG3 3.678 3.302 4.054 3.745 3.679 3.772 . 0 0 "[ . 1]" 1
171 1 45 GLU QB 1 45 GLU HG2 2.609 2.337 2.881 2.380 2.332 2.445 0.005 9 0 "[ . 1]" 1
172 2 45 GLU QB 2 45 GLU HG2 2.609 2.337 2.881 2.379 2.329 2.444 0.008 3 0 "[ . 1]" 1
173 1 13 LYS QB 1 13 LYS QD 2.561 . 6.000 2.120 2.093 2.176 . 0 0 "[ . 1]" 1
174 2 13 LYS QB 2 13 LYS QD 2.561 . 6.000 2.118 2.087 2.167 . 0 0 "[ . 1]" 1
175 1 38 GLN H 1 38 GLN HG2 3.460 3.150 3.770 3.689 3.635 3.733 . 0 0 "[ . 1]" 1
176 2 38 GLN H 2 38 GLN HG2 3.460 3.150 3.770 3.691 3.627 3.737 . 0 0 "[ . 1]" 1
177 1 31 TYR QD 1 34 LYS QB 2.992 . 6.000 4.105 3.755 4.400 . 0 0 "[ . 1]" 1
178 2 31 TYR QD 2 34 LYS QB 2.992 . 6.000 4.104 3.755 4.395 . 0 0 "[ . 1]" 1
179 1 22 LYS H 1 22 LYS QB 2.313 2.053 2.573 2.240 2.206 2.259 . 0 0 "[ . 1]" 1
180 2 22 LYS H 2 22 LYS QB 2.313 2.053 2.573 2.239 2.203 2.260 . 0 0 "[ . 1]" 1
181 1 11 LYS H 1 11 LYS QB 2.860 2.562 3.158 2.785 2.250 3.455 0.312 4 0 "[ . 1]" 1
182 2 11 LYS H 2 11 LYS QB 2.860 2.562 3.158 2.788 2.264 3.454 0.298 4 0 "[ . 1]" 1
183 1 53 LYS HA 1 53 LYS HB2 2.351 2.093 2.609 2.500 2.459 2.537 . 0 0 "[ . 1]" 1
184 2 53 LYS HA 2 53 LYS HB2 2.351 2.093 2.609 2.500 2.459 2.535 . 0 0 "[ . 1]" 1
185 1 48 LYS HB3 2 24 LEU QD 2.573 . 6.000 3.518 3.138 3.730 . 0 0 "[ . 1]" 1
186 1 24 LEU QD 2 48 LYS HB3 2.573 . 6.000 3.521 3.151 3.732 . 0 0 "[ . 1]" 1
187 1 29 LYS H 1 29 LYS QB 2.294 2.036 2.552 2.239 2.225 2.246 . 0 0 "[ . 1]" 1
188 2 29 LYS H 2 29 LYS QB 2.294 2.036 2.552 2.240 2.229 2.248 . 0 0 "[ . 1]" 1
189 1 30 VAL H 1 30 VAL HB 2.300 2.026 2.574 2.472 2.426 2.520 . 0 0 "[ . 1]" 1
190 2 30 VAL H 2 30 VAL HB 2.300 2.026 2.574 2.473 2.429 2.527 . 0 0 "[ . 1]" 1
191 1 25 LYS H 1 25 LYS QB 2.291 . 2.615 2.197 2.155 2.210 . 0 0 "[ . 1]" 1
192 2 25 LYS H 2 25 LYS QB 2.291 . 2.615 2.197 2.152 2.219 . 0 0 "[ . 1]" 1
193 1 46 ALA HA 1 48 LYS HB3 2.763 . 6.000 5.199 5.107 5.255 . 0 0 "[ . 1]" 1
194 2 46 ALA HA 2 48 LYS HB3 2.763 . 6.000 5.199 5.112 5.255 . 0 0 "[ . 1]" 1
195 1 20 MET ME 1 20 MET HG2 2.801 . 6.000 3.302 2.318 3.415 . 0 0 "[ . 1]" 1
196 2 20 MET ME 2 20 MET HG2 2.801 . 6.000 3.301 2.308 3.416 . 0 0 "[ . 1]" 1
197 1 27 ARG HB2 2 51 LEU MD2 3.583 3.043 4.123 4.168 4.146 4.222 0.099 1 0 "[ . 1]" 1
198 1 51 LEU MD2 2 27 ARG HB2 3.583 3.043 4.123 4.167 4.142 4.221 0.098 1 0 "[ . 1]" 1
199 1 45 GLU H 1 45 GLU QB 2.748 . 6.000 2.388 2.247 2.470 . 0 0 "[ . 1]" 1
200 2 45 GLU H 2 45 GLU QB 2.748 . 6.000 2.387 2.250 2.471 . 0 0 "[ . 1]" 1
201 1 49 GLU QB 2 50 TYR QD 2.313 . 2.669 2.694 2.494 2.798 0.129 1 0 "[ . 1]" 1
202 1 50 TYR QD 2 49 GLU QB 2.313 . 2.669 2.694 2.498 2.792 0.123 8 0 "[ . 1]" 1
203 1 25 LYS HD3 1 25 LYS HE3 2.415 2.090 2.740 2.485 2.461 2.520 . 0 0 "[ . 1]" 1
204 2 25 LYS HD3 2 25 LYS HE3 2.415 2.090 2.740 2.487 2.463 2.522 . 0 0 "[ . 1]" 1
205 1 25 LYS QB 1 25 LYS HD3 2.123 . 2.376 2.233 2.223 2.245 . 0 0 "[ . 1]" 1
206 2 25 LYS QB 2 25 LYS HD3 2.123 . 2.376 2.231 2.220 2.239 . 0 0 "[ . 1]" 1
207 1 25 LYS HD3 1 25 LYS HG3 2.484 2.167 2.801 2.627 2.616 2.636 . 0 0 "[ . 1]" 1
208 2 25 LYS HD3 2 25 LYS HG3 2.484 2.167 2.801 2.628 2.612 2.638 . 0 0 "[ . 1]" 1
209 1 45 GLU QB 1 46 ALA H 2.425 . 6.000 2.644 2.536 2.775 . 0 0 "[ . 1]" 1
210 2 45 GLU QB 2 46 ALA H 2.425 . 6.000 2.642 2.532 2.772 . 0 0 "[ . 1]" 1
211 1 47 ILE HA 1 47 ILE HG13 3.852 . 6.000 2.433 2.377 2.489 . 0 0 "[ . 1]" 1
212 2 47 ILE HA 2 47 ILE HG13 3.852 . 6.000 2.432 2.378 2.491 . 0 0 "[ . 1]" 1
213 1 47 ILE HB 1 47 ILE HG13 2.679 2.257 3.101 2.470 2.392 2.512 . 0 0 "[ . 1]" 1
214 2 47 ILE HB 2 47 ILE HG13 2.679 2.257 3.101 2.469 2.392 2.512 . 0 0 "[ . 1]" 1
215 1 47 ILE MD 1 47 ILE HG13 1.801 . 2.122 2.112 2.110 2.115 . 0 0 "[ . 1]" 1
216 2 47 ILE MD 2 47 ILE HG13 1.801 . 2.122 2.112 2.109 2.117 . 0 0 "[ . 1]" 1
217 1 41 GLN HA 1 41 GLN HB3 2.975 2.665 3.285 3.020 3.016 3.024 . 0 0 "[ . 1]" 1
218 2 41 GLN HA 2 41 GLN HB3 2.975 2.665 3.285 3.020 3.017 3.022 . 0 0 "[ . 1]" 1
219 1 52 GLN HB3 1 53 LYS H 3.247 2.862 3.632 3.506 3.384 3.640 0.008 10 0 "[ . 1]" 1
220 2 52 GLN HB3 2 53 LYS H 3.247 2.862 3.632 3.506 3.378 3.635 0.003 10 0 "[ . 1]" 1
221 1 51 LEU MD2 2 28 LEU H 2.459 . 2.923 2.647 2.560 2.745 . 0 0 "[ . 1]" 1
222 1 28 LEU H 2 51 LEU MD2 2.459 . 2.923 2.649 2.563 2.744 . 0 0 "[ . 1]" 1
223 1 51 LEU MD2 2 28 LEU HA 1.856 . 2.253 2.284 2.261 2.314 0.061 1 0 "[ . 1]" 1
224 1 28 LEU HA 2 51 LEU MD2 1.856 . 2.253 2.285 2.256 2.314 0.061 1 0 "[ . 1]" 1
225 1 25 LYS HA 1 28 LEU MD1 3.337 . 6.000 4.229 4.170 4.288 . 0 0 "[ . 1]" 1
226 2 25 LYS HA 2 28 LEU MD1 3.337 . 6.000 4.226 4.167 4.290 . 0 0 "[ . 1]" 1
227 1 28 LEU MD1 1 31 TYR HB3 3.354 2.416 4.292 3.297 3.201 3.416 . 0 0 "[ . 1]" 1
228 2 28 LEU MD1 2 31 TYR HB3 3.354 2.416 4.292 3.297 3.200 3.420 . 0 0 "[ . 1]" 1
229 1 50 TYR QB 1 51 LEU MD2 2.778 2.252 3.304 3.269 3.126 3.370 0.066 1 0 "[ . 1]" 1
230 2 50 TYR QB 2 51 LEU MD2 2.778 2.252 3.304 3.268 3.131 3.367 0.063 1 0 "[ . 1]" 1
231 1 51 LEU MD2 2 28 LEU HB2 1.503 . 1.746 1.803 1.762 1.850 0.104 9 0 "[ . 1]" 1
232 1 28 LEU HB2 2 51 LEU MD2 1.503 . 1.746 1.806 1.773 1.857 0.111 9 0 "[ . 1]" 1
233 1 48 LYS HB3 1 48 LYS QG 2.434 2.117 2.751 2.147 2.130 2.165 . 0 0 "[ . 1]" 1
234 2 48 LYS HB3 2 48 LYS QG 2.434 2.117 2.751 2.148 2.133 2.164 . 0 0 "[ . 1]" 1
235 1 51 LEU MD2 2 28 LEU HB3 2.894 2.452 3.336 3.306 3.273 3.341 0.005 9 0 "[ . 1]" 1
236 1 28 LEU HB3 2 51 LEU MD2 2.894 2.452 3.336 3.308 3.274 3.349 0.013 9 0 "[ . 1]" 1
237 1 32 CYS HB3 1 33 ALA H 4.890 . 6.000 3.940 3.746 4.070 . 0 0 "[ . 1]" 1
238 2 32 CYS HB3 2 33 ALA H 4.890 . 6.000 3.937 3.747 4.063 . 0 0 "[ . 1]" 1
239 1 16 PHE QR 1 18 ILE HG12 3.322 2.554 4.090 2.894 2.862 2.933 . 0 0 "[ . 1]" 1
240 2 16 PHE QR 2 18 ILE HG12 3.322 2.554 4.090 2.896 2.858 2.940 . 0 0 "[ . 1]" 1
241 1 22 LYS H 1 22 LYS QG 4.349 3.857 4.841 3.941 3.926 3.951 . 0 0 "[ . 1]" 1
242 2 22 LYS H 2 22 LYS QG 4.349 3.857 4.841 3.940 3.926 3.952 . 0 0 "[ . 1]" 1
243 1 39 LEU HA 1 39 LEU MD2 1.756 . 6.000 2.317 2.241 2.397 . 0 0 "[ . 1]" 1
244 2 39 LEU HA 2 39 LEU MD2 1.756 . 6.000 2.316 2.244 2.395 . 0 0 "[ . 1]" 1
245 1 25 LYS HD3 1 25 LYS HG2 2.265 . 6.000 2.979 2.975 2.982 . 0 0 "[ . 1]" 1
246 2 25 LYS HD3 2 25 LYS HG2 2.265 . 6.000 2.978 2.974 2.983 . 0 0 "[ . 1]" 1
247 1 25 LYS HG2 1 39 LEU MD1 2.126 . 6.000 3.097 3.007 3.211 . 0 0 "[ . 1]" 1
248 2 25 LYS HG2 2 39 LEU MD1 2.126 . 6.000 3.096 3.007 3.212 . 0 0 "[ . 1]" 1
249 1 34 LYS H 1 34 LYS HG3 4.865 4.287 5.443 4.459 4.449 4.465 . 0 0 "[ . 1]" 1
250 2 34 LYS H 2 34 LYS HG3 4.865 4.287 5.443 4.458 4.445 4.467 . 0 0 "[ . 1]" 1
251 1 11 LYS HA 1 11 LYS QG 2.928 . 6.000 2.877 2.353 3.361 . 0 0 "[ . 1]" 1
252 2 11 LYS HA 2 11 LYS QG 2.928 . 6.000 2.879 2.353 3.363 . 0 0 "[ . 1]" 1
253 1 29 LYS HA 1 39 LEU MD1 1.974 . 6.000 2.910 2.752 3.044 . 0 0 "[ . 1]" 1
254 2 29 LYS HA 2 39 LEU MD1 1.974 . 6.000 2.911 2.753 3.042 . 0 0 "[ . 1]" 1
255 1 22 LYS HA 1 22 LYS QG 2.717 2.404 3.030 2.526 2.474 2.590 . 0 0 "[ . 1]" 1
256 2 22 LYS HA 2 22 LYS QG 2.717 2.404 3.030 2.525 2.479 2.587 . 0 0 "[ . 1]" 1
257 1 37 LEU H 1 37 LEU MD1 2.531 2.085 2.977 2.891 2.733 2.959 . 0 0 "[ . 1]" 1
258 2 37 LEU H 2 37 LEU MD1 2.531 2.085 2.977 2.893 2.734 2.964 . 0 0 "[ . 1]" 1
259 1 37 LEU HA 1 37 LEU MD1 1.751 . 2.073 2.081 2.029 2.120 0.047 10 0 "[ . 1]" 1
260 2 37 LEU HA 2 37 LEU MD1 1.751 . 2.073 2.083 2.028 2.121 0.048 10 0 "[ . 1]" 1
261 1 31 TYR QE 1 37 LEU MD1 2.603 . 6.000 4.245 4.071 4.478 . 0 0 "[ . 1]" 1
262 2 31 TYR QE 2 37 LEU MD1 2.603 . 6.000 4.240 4.069 4.479 . 0 0 "[ . 1]" 1
263 1 28 LEU MD2 2 50 TYR QE 1.554 . 2.074 1.996 1.849 2.098 0.024 3 0 "[ . 1]" 1
264 1 50 TYR QE 2 28 LEU MD2 1.554 . 2.074 1.995 1.839 2.099 0.025 3 0 "[ . 1]" 1
265 1 28 LEU MD2 2 51 LEU MD1 1.012 . 6.000 1.977 1.871 2.083 . 0 0 "[ . 1]" 1
266 1 51 LEU MD1 2 28 LEU MD2 1.012 . 6.000 1.974 1.875 2.074 . 0 0 "[ . 1]" 1
267 1 30 VAL H 1 30 VAL MG2 1.526 . 6.000 2.007 1.949 2.081 . 0 0 "[ . 1]" 1
268 2 30 VAL H 2 30 VAL MG2 1.526 . 6.000 2.008 1.952 2.080 . 0 0 "[ . 1]" 1
269 1 27 ARG HA 1 30 VAL MG2 2.002 . 6.000 2.995 2.815 3.174 . 0 0 "[ . 1]" 1
270 2 27 ARG HA 2 30 VAL MG2 2.002 . 6.000 2.995 2.815 3.175 . 0 0 "[ . 1]" 1
271 1 29 LYS QE 1 30 VAL MG2 3.350 2.790 3.910 3.949 3.908 4.008 0.098 2 0 "[ . 1]" 1
272 2 29 LYS QE 2 30 VAL MG2 3.350 2.790 3.910 3.951 3.912 4.009 0.099 2 0 "[ . 1]" 1
273 1 29 LYS QD 1 30 VAL MG2 2.285 . 2.719 2.679 2.416 2.753 0.034 1 0 "[ . 1]" 1
274 2 29 LYS QD 2 30 VAL MG2 2.285 . 2.719 2.679 2.419 2.751 0.032 1 0 "[ . 1]" 1
275 1 29 LYS QG 1 30 VAL MG2 2.790 . 6.000 4.279 4.095 4.332 . 0 0 "[ . 1]" 1
276 2 29 LYS QG 2 30 VAL MG2 2.790 . 6.000 4.278 4.098 4.327 . 0 0 "[ . 1]" 1
277 1 51 LEU MD1 2 31 TYR QD 2.332 . 6.000 2.994 2.932 3.052 . 0 0 "[ . 1]" 1
278 1 31 TYR QD 2 51 LEU MD1 2.332 . 6.000 2.995 2.938 3.052 . 0 0 "[ . 1]" 1
279 1 40 THR MG 2 19 TYR QD 3.340 . 6.000 4.634 4.480 4.820 . 0 0 "[ . 1]" 1
280 1 19 TYR QD 2 40 THR MG 3.340 . 6.000 4.636 4.482 4.827 . 0 0 "[ . 1]" 1
281 1 40 THR MG 2 20 MET HA 3.442 2.532 4.352 2.798 2.643 2.986 . 0 0 "[ . 1]" 1
282 1 20 MET HA 2 40 THR MG 3.442 2.532 4.352 2.800 2.630 3.004 . 0 0 "[ . 1]" 1
283 1 51 LEU MD1 2 28 LEU HA 1.536 . 6.000 2.265 2.164 2.364 . 0 0 "[ . 1]" 1
284 1 28 LEU HA 2 51 LEU MD1 1.536 . 6.000 2.267 2.157 2.380 . 0 0 "[ . 1]" 1
285 1 26 THR MG 1 27 ARG HA 2.083 . 6.000 3.585 3.411 3.742 . 0 0 "[ . 1]" 1
286 2 26 THR MG 2 27 ARG HA 2.083 . 6.000 3.587 3.415 3.743 . 0 0 "[ . 1]" 1
287 1 26 THR HA 1 26 THR MG 1.784 . 6.000 2.499 2.442 2.544 . 0 0 "[ . 1]" 1
288 2 26 THR HA 2 26 THR MG 1.784 . 6.000 2.500 2.436 2.541 . 0 0 "[ . 1]" 1
289 1 51 LEU MD1 2 27 ARG QD 2.641 . 6.000 3.524 3.318 3.709 . 0 0 "[ . 1]" 1
290 1 27 ARG QD 2 51 LEU MD1 2.641 . 6.000 3.523 3.312 3.683 . 0 0 "[ . 1]" 1
291 1 40 THR MG 2 19 TYR HB2 2.326 . 6.000 3.594 3.508 3.800 . 0 0 "[ . 1]" 1
292 1 19 TYR HB2 2 40 THR MG 2.326 . 6.000 3.600 3.513 3.814 . 0 0 "[ . 1]" 1
293 1 40 THR MG 1 44 GLU HB2 2.851 . 6.000 4.287 4.222 4.348 . 0 0 "[ . 1]" 1
294 2 40 THR MG 2 44 GLU HB2 2.851 . 6.000 4.285 4.218 4.344 . 0 0 "[ . 1]" 1
295 1 26 THR MG 1 29 LYS QB 2.431 . 6.000 2.905 2.771 3.105 . 0 0 "[ . 1]" 1
296 2 26 THR MG 2 29 LYS QB 2.431 . 6.000 2.905 2.776 3.106 . 0 0 "[ . 1]" 1
297 1 40 THR MG 1 44 GLU HG3 2.088 . 2.562 2.491 2.433 2.551 . 0 0 "[ . 1]" 1
298 2 40 THR MG 2 44 GLU HG3 2.088 . 2.562 2.487 2.427 2.557 . 0 0 "[ . 1]" 1
299 1 26 THR MG 1 27 ARG HB3 3.121 . 6.000 5.138 4.877 5.330 . 0 0 "[ . 1]" 1
300 2 26 THR MG 2 27 ARG HB3 3.121 . 6.000 5.140 4.878 5.333 . 0 0 "[ . 1]" 1
301 1 51 LEU HB3 1 51 LEU MD1 2.070 . 6.000 2.810 2.781 2.834 . 0 0 "[ . 1]" 1
302 2 51 LEU HB3 2 51 LEU MD1 2.070 . 6.000 2.810 2.787 2.832 . 0 0 "[ . 1]" 1
303 1 14 ALA MB 1 16 PHE QR 2.588 . 6.000 4.800 4.703 4.909 . 0 0 "[ . 1]" 1
304 2 14 ALA MB 2 16 PHE QR 2.588 . 6.000 4.802 4.704 4.909 . 0 0 "[ . 1]" 1
305 1 15 VAL MG1 2 19 TYR QE 1.924 . 6.000 2.525 2.376 2.618 . 0 0 "[ . 1]" 1
306 1 19 TYR QE 2 15 VAL MG1 1.924 . 6.000 2.525 2.372 2.627 . 0 0 "[ . 1]" 1
307 1 14 ALA MB 2 22 LYS HA 2.037 . 3.070 2.666 2.475 2.818 . 0 0 "[ . 1]" 1
308 1 22 LYS HA 2 14 ALA MB 2.037 . 3.070 2.663 2.471 2.814 . 0 0 "[ . 1]" 1
309 1 15 VAL MG1 2 17 GLY HA2 3.210 2.749 3.916 3.742 3.669 3.826 . 0 0 "[ . 1]" 1
310 1 17 GLY HA2 2 15 VAL MG1 3.210 2.749 3.916 3.743 3.661 3.819 . 0 0 "[ . 1]" 1
311 1 14 ALA MB 2 20 MET HG3 2.881 2.199 3.563 3.588 3.371 3.629 0.066 5 0 "[ . 1]" 1
312 1 20 MET HG3 2 14 ALA MB 2.881 2.199 3.563 3.587 3.356 3.631 0.068 5 0 "[ . 1]" 1
313 1 15 VAL MG1 2 19 TYR QD 1.896 . 6.000 2.682 2.617 2.781 . 0 0 "[ . 1]" 1
314 1 19 TYR QD 2 15 VAL MG1 1.896 . 6.000 2.681 2.619 2.777 . 0 0 "[ . 1]" 1
315 1 14 ALA MB 2 22 LYS QE 3.223 . 6.000 4.614 2.707 5.652 . 0 0 "[ . 1]" 1
316 1 22 LYS QE 2 14 ALA MB 3.223 . 6.000 4.614 2.697 5.647 . 0 0 "[ . 1]" 1
317 1 30 VAL MG1 1 33 ALA MB 1.654 . 6.000 3.170 3.024 3.318 . 0 0 "[ . 1]" 1
318 2 30 VAL MG1 2 33 ALA MB 1.654 . 6.000 3.169 3.010 3.315 . 0 0 "[ . 1]" 1
319 1 15 VAL MG1 2 18 ILE HB 2.971 . 6.000 5.502 5.435 5.603 . 0 0 "[ . 1]" 1
320 1 18 ILE HB 2 15 VAL MG1 2.971 . 6.000 5.498 5.427 5.595 . 0 0 "[ . 1]" 1
321 1 15 VAL HA 1 15 VAL MG2 1.944 . 6.000 2.633 2.614 2.652 . 0 0 "[ . 1]" 1
322 2 15 VAL HA 2 15 VAL MG2 1.944 . 6.000 2.633 2.616 2.650 . 0 0 "[ . 1]" 1
323 1 15 VAL MG2 1 16 PHE HA 5.197 3.937 6.457 5.331 5.307 5.354 . 0 0 "[ . 1]" 1
324 2 15 VAL MG2 2 16 PHE HA 5.197 3.937 6.457 5.329 5.309 5.350 . 0 0 "[ . 1]" 1
325 1 15 VAL HB 1 15 VAL MG2 1.770 . 2.056 2.124 2.121 2.126 0.070 8 0 "[ . 1]" 1
326 2 15 VAL HB 2 15 VAL MG2 1.770 . 2.056 2.124 2.121 2.127 0.071 1 0 "[ . 1]" 1
327 1 42 ALA MB 1 43 ILE H 1.794 . 6.000 2.412 2.386 2.458 . 0 0 "[ . 1]" 1
328 2 42 ALA MB 2 43 ILE H 1.794 . 6.000 2.413 2.386 2.458 . 0 0 "[ . 1]" 1
329 1 31 TYR QE 1 42 ALA MB 2.435 . 6.000 3.134 2.837 3.383 . 0 0 "[ . 1]" 1
330 2 31 TYR QE 2 42 ALA MB 2.435 . 6.000 3.136 2.838 3.381 . 0 0 "[ . 1]" 1
331 1 42 ALA MB 2 50 TYR QE 1.689 . 6.000 2.604 2.497 2.688 . 0 0 "[ . 1]" 1
332 1 50 TYR QE 2 42 ALA MB 1.689 . 6.000 2.599 2.484 2.681 . 0 0 "[ . 1]" 1
333 1 39 LEU HA 1 42 ALA MB 1.964 . 6.000 2.847 2.782 2.950 . 0 0 "[ . 1]" 1
334 2 39 LEU HA 2 42 ALA MB 1.964 . 6.000 2.848 2.788 2.950 . 0 0 "[ . 1]" 1
335 1 41 GLN HB3 1 42 ALA MB 3.153 . 6.000 3.855 3.780 3.914 . 0 0 "[ . 1]" 1
336 2 41 GLN HB3 2 42 ALA MB 3.153 . 6.000 3.856 3.784 3.909 . 0 0 "[ . 1]" 1
337 1 42 ALA MB 1 45 GLU QB 3.317 . 6.000 3.984 3.843 4.183 . 0 0 "[ . 1]" 1
338 2 42 ALA MB 2 45 GLU QB 3.317 . 6.000 3.985 3.845 4.184 . 0 0 "[ . 1]" 1
339 1 28 LEU MD2 1 42 ALA MB 0.955 . 6.000 1.768 1.678 1.903 . 0 0 "[ . 1]" 1
340 2 28 LEU MD2 2 42 ALA MB 0.955 . 6.000 1.769 1.681 1.903 . 0 0 "[ . 1]" 1
341 1 16 PHE QR 1 18 ILE MG 1.788 . 6.000 2.244 2.222 2.272 . 0 0 "[ . 1]" 1
342 2 16 PHE QR 2 18 ILE MG 1.788 . 6.000 2.243 2.220 2.272 . 0 0 "[ . 1]" 1
343 1 29 LYS QE 1 33 ALA MB 2.770 2.229 3.311 2.919 2.706 3.087 . 0 0 "[ . 1]" 1
344 2 29 LYS QE 2 33 ALA MB 2.770 2.229 3.311 2.920 2.704 3.097 . 0 0 "[ . 1]" 1
345 1 18 ILE HB 1 18 ILE MG 1.782 . 2.136 2.125 2.123 2.128 . 0 0 "[ . 1]" 1
346 2 18 ILE HB 2 18 ILE MG 1.782 . 2.136 2.126 2.124 2.128 . 0 0 "[ . 1]" 1
347 1 33 ALA MB 1 34 LYS H 1.959 . 6.000 2.597 2.543 2.652 . 0 0 "[ . 1]" 1
348 2 33 ALA MB 2 34 LYS H 1.959 . 6.000 2.594 2.533 2.651 . 0 0 "[ . 1]" 1
349 1 46 ALA MB 1 47 ILE H 1.779 . 6.000 2.212 2.168 2.258 . 0 0 "[ . 1]" 1
350 2 46 ALA MB 2 47 ILE H 1.779 . 6.000 2.213 2.170 2.260 . 0 0 "[ . 1]" 1
351 1 43 ILE MG 1 47 ILE H 3.104 2.375 3.833 3.633 3.581 3.687 . 0 0 "[ . 1]" 1
352 2 43 ILE MG 2 47 ILE H 3.104 2.375 3.833 3.632 3.575 3.684 . 0 0 "[ . 1]" 1
353 1 46 ALA MB 2 50 TYR QD 2.264 . 2.662 2.594 2.497 2.672 0.010 5 0 "[ . 1]" 1
354 1 50 TYR QD 2 46 ALA MB 2.264 . 2.662 2.591 2.493 2.671 0.009 5 0 "[ . 1]" 1
355 1 40 THR HA 1 43 ILE MG 3.163 2.631 3.695 3.713 3.647 3.755 0.060 3 0 "[ . 1]" 1
356 2 40 THR HA 2 43 ILE MG 3.163 2.631 3.695 3.714 3.644 3.753 0.058 3 0 "[ . 1]" 1
357 1 46 ALA MB 2 47 ILE HA 1.398 . 1.525 1.523 1.468 1.581 0.056 8 0 "[ . 1]" 1
358 1 47 ILE HA 2 46 ALA MB 1.398 . 1.525 1.522 1.470 1.579 0.054 8 0 "[ . 1]" 1
359 1 43 ILE MG 1 44 GLU HG2 2.682 . 6.000 3.222 3.159 3.266 . 0 0 "[ . 1]" 1
360 2 43 ILE MG 2 44 GLU HG2 2.682 . 6.000 3.222 3.161 3.268 . 0 0 "[ . 1]" 1
361 1 20 MET ME 1 25 LYS H 2.568 . 6.000 3.315 3.165 3.903 . 0 0 "[ . 1]" 1
362 2 20 MET ME 2 25 LYS H 2.568 . 6.000 3.314 3.163 3.904 . 0 0 "[ . 1]" 1
363 1 16 PHE QR 1 20 MET ME 1.783 . 6.000 5.260 4.815 5.400 . 0 0 "[ . 1]" 1
364 2 16 PHE QR 2 20 MET ME 1.783 . 6.000 5.260 4.816 5.398 . 0 0 "[ . 1]" 1
365 1 20 MET ME 2 43 ILE MG 1.041 . 6.000 2.470 2.211 2.564 . 0 0 "[ . 1]" 1
366 1 43 ILE MG 2 20 MET ME 1.041 . 6.000 2.470 2.200 2.557 . 0 0 "[ . 1]" 1
367 1 18 ILE H 1 18 ILE MD 3.459 3.002 3.916 3.873 3.852 3.918 0.002 7 0 "[ . 1]" 1
368 2 18 ILE H 2 18 ILE MD 3.459 3.002 3.916 3.872 3.847 3.916 . 7 0 "[ . 1]" 1
369 1 16 PHE QR 1 43 ILE MD 1.689 . 6.000 5.843 5.714 5.930 . 0 0 "[ . 1]" 1
370 2 16 PHE QR 2 43 ILE MD 1.689 . 6.000 5.843 5.714 5.932 . 0 0 "[ . 1]" 1
371 1 18 ILE HA 1 18 ILE MD 3.148 . 6.000 4.171 4.165 4.175 . 0 0 "[ . 1]" 1
372 2 18 ILE HA 2 18 ILE MD 3.148 . 6.000 4.171 4.166 4.175 . 0 0 "[ . 1]" 1
373 1 47 ILE MD 2 25 LYS HA 2.058 . 2.469 2.360 2.314 2.397 . 0 0 "[ . 1]" 1
374 1 25 LYS HA 2 47 ILE MD 2.058 . 2.469 2.360 2.311 2.394 . 0 0 "[ . 1]" 1
375 1 47 ILE HA 1 47 ILE MD 2.777 . 6.000 3.742 3.701 3.793 . 0 0 "[ . 1]" 1
376 2 47 ILE HA 2 47 ILE MD 2.777 . 6.000 3.743 3.700 3.795 . 0 0 "[ . 1]" 1
377 1 43 ILE HA 1 43 ILE MD 2.079 . 2.431 2.449 2.432 2.463 0.032 4 0 "[ . 1]" 1
378 2 43 ILE HA 2 43 ILE MD 2.079 . 2.431 2.451 2.425 2.466 0.035 4 0 "[ . 1]" 1
379 1 18 ILE MD 2 16 PHE HB2 3.914 3.190 4.638 4.290 4.135 4.465 . 0 0 "[ . 1]" 1
380 1 16 PHE HB2 2 18 ILE MD 3.914 3.190 4.638 4.290 4.127 4.460 . 0 0 "[ . 1]" 1
381 1 18 ILE MD 2 44 GLU HG2 4.502 3.360 5.644 4.032 3.976 4.117 . 0 0 "[ . 1]" 1
382 1 44 GLU HG2 2 18 ILE MD 4.502 3.360 5.644 4.034 3.983 4.114 . 0 0 "[ . 1]" 1
383 1 44 GLU HG2 1 47 ILE MD 4.809 3.527 6.091 5.278 5.175 5.359 . 0 0 "[ . 1]" 1
384 2 44 GLU HG2 2 47 ILE MD 4.809 3.527 6.091 5.279 5.175 5.365 . 0 0 "[ . 1]" 1
385 1 28 LEU HB2 1 43 ILE MD 2.839 . 6.000 4.307 4.174 4.409 . 0 0 "[ . 1]" 1
386 2 28 LEU HB2 2 43 ILE MD 2.839 . 6.000 4.307 4.174 4.410 . 0 0 "[ . 1]" 1
387 1 42 ALA MB 1 43 ILE MD 1.718 . 6.000 2.786 2.758 2.826 . 0 0 "[ . 1]" 1
388 2 42 ALA MB 2 43 ILE MD 1.718 . 6.000 2.786 2.759 2.823 . 0 0 "[ . 1]" 1
389 1 18 ILE MD 2 43 ILE HA 4.087 3.347 4.827 4.736 4.700 4.817 . 0 0 "[ . 1]" 1
390 1 43 ILE HA 2 18 ILE MD 4.087 3.347 4.827 4.733 4.697 4.817 . 0 0 "[ . 1]" 1
391 1 47 ILE MD 2 43 ILE HA 2.264 . 6.000 3.201 3.142 3.303 . 0 0 "[ . 1]" 1
392 1 43 ILE HA 2 47 ILE MD 2.264 . 6.000 3.201 3.140 3.302 . 0 0 "[ . 1]" 1
393 1 18 ILE HB 1 18 ILE MD 1.768 . 6.000 2.372 2.359 2.388 . 0 0 "[ . 1]" 1
394 2 18 ILE HB 2 18 ILE MD 1.768 . 6.000 2.372 2.359 2.387 . 0 0 "[ . 1]" 1
395 1 47 ILE MD 2 28 LEU HB3 1.905 . 2.322 2.109 2.052 2.151 . 0 0 "[ . 1]" 1
396 1 28 LEU HB3 2 47 ILE MD 1.905 . 2.322 2.109 2.052 2.155 . 0 0 "[ . 1]" 1
397 1 27 ARG H 1 27 ARG HG2 5.272 . 6.000 4.520 4.477 4.542 . 0 0 "[ . 1]" 1
398 2 27 ARG H 2 27 ARG HG2 5.272 . 6.000 4.521 4.474 4.545 . 0 0 "[ . 1]" 1
399 1 27 ARG HA 1 27 ARG HG2 4.463 3.928 4.998 3.930 3.899 3.979 0.029 9 0 "[ . 1]" 1
400 2 27 ARG HA 2 27 ARG HG2 4.463 3.928 4.998 3.930 3.897 3.978 0.031 9 0 "[ . 1]" 1
401 1 27 ARG HG2 2 48 LYS QE 3.525 2.856 4.194 4.143 3.901 4.347 0.153 6 0 "[ . 1]" 1
402 1 48 LYS QE 2 27 ARG HG2 3.525 2.856 4.194 4.140 3.900 4.348 0.154 6 0 "[ . 1]" 1
403 1 28 LEU HB3 1 28 LEU MD1 1.674 . 2.027 2.168 2.159 2.176 0.149 3 0 "[ . 1]" 1
404 2 28 LEU HB3 2 28 LEU MD1 1.674 . 2.027 2.167 2.153 2.175 0.148 3 0 "[ . 1]" 1
405 1 50 TYR QD 1 51 LEU HG 3.508 . 6.000 5.132 5.020 5.274 . 0 0 "[ . 1]" 1
406 2 50 TYR QD 2 51 LEU HG 3.508 . 6.000 5.132 5.024 5.275 . 0 0 "[ . 1]" 1
407 1 39 LEU H 1 39 LEU HG 5.305 . 6.000 4.412 4.362 4.468 . 0 0 "[ . 1]" 1
408 2 39 LEU H 2 39 LEU HG 5.305 . 6.000 4.412 4.360 4.467 . 0 0 "[ . 1]" 1
409 1 39 LEU HA 1 39 LEU HG 3.907 3.318 4.496 3.617 3.607 3.634 . 0 0 "[ . 1]" 1
410 2 39 LEU HA 2 39 LEU HG 3.907 3.318 4.496 3.617 3.606 3.630 . 0 0 "[ . 1]" 1
411 1 39 LEU MD2 1 39 LEU HG 2.517 . 3.167 2.123 2.120 2.127 . 0 0 "[ . 1]" 1
412 2 39 LEU MD2 2 39 LEU HG 2.517 . 3.167 2.124 2.120 2.129 . 0 0 "[ . 1]" 1
413 1 39 LEU MD1 1 39 LEU HG 2.778 2.004 3.552 2.120 2.116 2.124 . 0 0 "[ . 1]" 1
414 2 39 LEU MD1 2 39 LEU HG 2.778 2.004 3.552 2.121 2.119 2.123 . 0 0 "[ . 1]" 1
415 1 16 PHE QR 1 18 ILE HB 3.876 3.242 4.510 4.075 4.054 4.103 . 0 0 "[ . 1]" 1
416 2 16 PHE QR 2 18 ILE HB 3.876 3.242 4.510 4.075 4.053 4.102 . 0 0 "[ . 1]" 1
417 1 34 LYS HA 1 36 ASN H 3.287 2.883 3.691 3.807 3.758 3.856 0.165 6 0 "[ . 1]" 1
418 2 34 LYS HA 2 36 ASN H 3.287 2.883 3.691 3.807 3.760 3.858 0.167 6 0 "[ . 1]" 1
419 1 37 LEU HA 1 37 LEU MD2 4.012 3.303 4.721 3.771 3.764 3.783 . 0 0 "[ . 1]" 1
420 2 37 LEU HA 2 37 LEU MD2 4.012 3.303 4.721 3.771 3.766 3.782 . 0 0 "[ . 1]" 1
421 1 37 LEU MD2 1 41 GLN QG 3.466 2.945 3.987 3.699 3.429 4.083 0.096 10 0 "[ . 1]" 1
422 2 37 LEU MD2 2 41 GLN QG 3.466 2.945 3.987 3.699 3.436 4.084 0.097 10 0 "[ . 1]" 1
423 1 37 LEU MD2 1 41 GLN HB3 3.045 . 6.000 3.695 3.456 3.937 . 0 0 "[ . 1]" 1
424 2 37 LEU MD2 2 41 GLN HB3 3.045 . 6.000 3.694 3.460 3.938 . 0 0 "[ . 1]" 1
425 1 24 LEU H 1 25 LYS HA 4.235 . 6.000 5.288 5.199 5.354 . 0 0 "[ . 1]" 1
426 2 24 LEU H 2 25 LYS HA 4.235 . 6.000 5.288 5.201 5.360 . 0 0 "[ . 1]" 1
427 1 36 ASN H 1 36 ASN HB3 4.080 3.650 4.510 4.078 4.055 4.114 . 0 0 "[ . 1]" 1
428 2 36 ASN H 2 36 ASN HB3 4.080 3.650 4.510 4.079 4.055 4.112 . 0 0 "[ . 1]" 1
429 1 37 LEU HB2 1 37 LEU MD2 2.006 . 2.421 2.342 2.289 2.368 . 0 0 "[ . 1]" 1
430 2 37 LEU HB2 2 37 LEU MD2 2.006 . 2.421 2.342 2.293 2.365 . 0 0 "[ . 1]" 1
431 1 37 LEU HB3 1 37 LEU MD2 2.184 . 2.654 2.347 2.325 2.389 . 0 0 "[ . 1]" 1
432 2 37 LEU HB3 2 37 LEU MD2 2.184 . 2.654 2.346 2.317 2.387 . 0 0 "[ . 1]" 1
433 1 37 LEU HA 1 37 LEU HG 3.844 . 6.000 2.538 2.506 2.601 . 0 0 "[ . 1]" 1
434 2 37 LEU HA 2 37 LEU HG 3.844 . 6.000 2.539 2.511 2.597 . 0 0 "[ . 1]" 1
435 1 35 ASN HB2 1 37 LEU HG 4.957 4.196 5.718 4.793 4.734 4.853 . 0 0 "[ . 1]" 1
436 2 35 ASN HB2 2 37 LEU HG 4.957 4.196 5.718 4.793 4.736 4.852 . 0 0 "[ . 1]" 1
437 1 44 GLU HG2 2 24 LEU QD 3.006 2.385 3.627 2.665 2.432 2.842 . 0 0 "[ . 1]" 1
438 1 24 LEU QD 2 44 GLU HG2 3.006 2.385 3.627 2.666 2.421 2.830 . 0 0 "[ . 1]" 1
439 1 47 ILE H 1 47 ILE HB 2.126 . 2.370 2.463 2.408 2.496 0.126 10 0 "[ . 1]" 1
440 2 47 ILE H 2 47 ILE HB 2.126 . 2.370 2.462 2.411 2.493 0.123 10 0 "[ . 1]" 1
441 1 44 GLU HA 1 44 GLU HB3 2.691 2.319 3.063 2.484 2.474 2.494 . 0 0 "[ . 1]" 1
442 2 44 GLU HA 2 44 GLU HB3 2.691 2.319 3.063 2.482 2.472 2.492 . 0 0 "[ . 1]" 1
443 1 42 ALA H 1 44 GLU HB2 4.163 . 6.000 5.077 5.008 5.146 . 0 0 "[ . 1]" 1
444 2 42 ALA H 2 44 GLU HB2 4.163 . 6.000 5.076 5.010 5.148 . 0 0 "[ . 1]" 1
445 1 41 GLN H 1 44 GLU HB2 3.913 . 6.000 5.152 5.059 5.222 . 0 0 "[ . 1]" 1
446 2 41 GLN H 2 44 GLU HB2 3.913 . 6.000 5.150 5.052 5.226 . 0 0 "[ . 1]" 1
447 1 44 GLU HB2 1 46 ALA H 3.545 . 6.000 4.804 4.725 4.901 . 0 0 "[ . 1]" 1
448 2 44 GLU HB2 2 46 ALA H 3.545 . 6.000 4.802 4.725 4.891 . 0 0 "[ . 1]" 1
449 1 54 ARG HB3 1 54 ARG HD3 3.228 2.919 3.537 3.448 3.391 3.515 . 0 0 "[ . 1]" 1
450 2 54 ARG HB3 2 54 ARG HD3 3.228 2.919 3.537 3.448 3.397 3.518 . 0 0 "[ . 1]" 1
451 1 56 GLY HA2 2 27 ARG QD 2.238 . 6.000 2.719 2.345 2.990 . 0 0 "[ . 1]" 1
452 1 27 ARG QD 2 56 GLY HA2 2.238 . 6.000 2.719 2.339 3.005 . 0 0 "[ . 1]" 1
453 1 17 GLY H 1 18 ILE MG 2.253 . 6.000 3.135 3.016 3.219 . 0 0 "[ . 1]" 1
454 2 17 GLY H 2 18 ILE MG 2.253 . 6.000 3.140 3.019 3.231 . 0 0 "[ . 1]" 1
455 1 18 ILE MG 2 39 LEU HB3 2.829 2.150 3.508 3.204 3.085 3.295 . 0 0 "[ . 1]" 1
456 1 39 LEU HB3 2 18 ILE MG 2.829 2.150 3.508 3.202 3.082 3.305 . 0 0 "[ . 1]" 1
457 1 20 MET HG3 1 24 LEU QD 3.534 2.794 4.274 3.498 3.243 3.721 . 0 0 "[ . 1]" 1
458 2 20 MET HG3 2 24 LEU QD 3.534 2.794 4.274 3.499 3.245 3.720 . 0 0 "[ . 1]" 1
459 1 20 MET ME 1 20 MET HG3 1.864 . 6.000 2.592 2.492 3.382 . 0 0 "[ . 1]" 1
460 2 20 MET ME 2 20 MET HG3 1.864 . 6.000 2.592 2.494 3.377 . 0 0 "[ . 1]" 1
461 1 27 ARG HA 1 30 VAL HB 2.995 2.569 3.421 3.149 2.928 3.336 . 0 0 "[ . 1]" 1
462 2 27 ARG HA 2 30 VAL HB 2.995 2.569 3.421 3.149 2.928 3.336 . 0 0 "[ . 1]" 1
463 1 19 TYR QD 2 13 LYS QD 3.562 3.089 4.035 3.789 3.131 4.073 0.038 6 0 "[ . 1]" 1
464 1 13 LYS QD 2 19 TYR QD 3.562 3.089 4.035 3.789 3.127 4.074 0.039 6 0 "[ . 1]" 1
465 1 50 TYR QD 2 45 GLU HA 3.556 . 6.000 5.543 5.421 5.622 . 0 0 "[ . 1]" 1
466 1 45 GLU HA 2 50 TYR QD 3.556 . 6.000 5.545 5.428 5.615 . 0 0 "[ . 1]" 1
467 1 16 PHE QE 2 43 ILE MD 1.677 . 2.130 2.189 2.170 2.212 0.082 9 0 "[ . 1]" 1
468 1 43 ILE MD 2 16 PHE QE 1.677 . 2.130 2.187 2.166 2.205 0.075 2 0 "[ . 1]" 1
469 1 19 TYR QE 2 13 LYS QD 3.591 . 6.000 5.018 4.296 5.346 . 0 0 "[ . 1]" 1
470 1 13 LYS QD 2 19 TYR QE 3.591 . 6.000 5.017 4.299 5.348 . 0 0 "[ . 1]" 1
471 1 50 TYR QE 2 45 GLU HA 4.080 3.507 4.653 4.590 4.409 4.719 0.066 3 0 "[ . 1]" 1
472 1 45 GLU HA 2 50 TYR QE 4.080 3.507 4.653 4.593 4.422 4.715 0.062 3 0 "[ . 1]" 1
473 1 50 TYR QE 2 46 ALA MB . 3.093 6.000 3.415 3.302 3.515 . 0 0 "[ . 1]" 1
474 1 46 ALA MB 2 50 TYR QE . 3.093 6.000 3.416 3.306 3.520 . 0 0 "[ . 1]" 1
475 1 40 THR HB 2 20 MET H 6.756 5.410 8.102 6.741 6.556 6.958 . 0 0 "[ . 1]" 1
476 1 20 MET H 2 40 THR HB 6.756 5.410 8.102 6.743 6.543 6.972 . 0 0 "[ . 1]" 1
477 1 40 THR HB 2 20 MET HA 3.742 . 6.000 5.256 5.031 5.526 . 0 0 "[ . 1]" 1
478 1 20 MET HA 2 40 THR HB 3.742 . 6.000 5.258 5.006 5.552 . 0 0 "[ . 1]" 1
479 1 40 THR HA 2 19 TYR H 5.652 4.804 6.000 5.279 5.087 5.477 . 0 0 "[ . 1]" 1
480 1 19 TYR H 2 40 THR HA 5.652 4.804 6.000 5.282 5.073 5.484 . 0 0 "[ . 1]" 1
481 1 44 GLU HA 2 20 MET ME 2.909 2.168 3.027 2.839 2.741 3.057 0.030 8 0 "[ . 1]" 1
482 1 20 MET ME 2 44 GLU HA 2.909 2.168 3.027 2.842 2.736 3.064 0.037 8 0 "[ . 1]" 1
483 1 44 GLU HA 2 24 LEU QD 2.173 . 2.696 2.293 2.124 2.418 . 0 0 "[ . 1]" 1
484 1 24 LEU QD 2 44 GLU HA 2.173 . 2.696 2.293 2.139 2.415 . 0 0 "[ . 1]" 1
485 1 46 ALA HA 2 50 TYR QE . 3.368 3.431 3.518 3.483 3.555 0.124 8 0 "[ . 1]" 1
486 1 50 TYR QE 2 46 ALA HA . 3.368 3.431 3.516 3.477 3.551 0.120 8 0 "[ . 1]" 1
487 1 17 GLY HA3 2 15 VAL HA 6.095 5.271 6.919 6.823 6.730 6.925 0.006 7 0 "[ . 1]" 1
488 1 15 VAL HA 2 17 GLY HA3 6.095 5.271 6.919 6.821 6.739 6.937 0.018 7 0 "[ . 1]" 1
489 1 17 GLY HA3 2 18 ILE H 5.581 4.954 6.208 5.351 5.208 5.519 . 0 0 "[ . 1]" 1
490 1 18 ILE H 2 17 GLY HA3 5.581 4.954 6.208 5.350 5.220 5.518 . 0 0 "[ . 1]" 1
491 1 25 LYS HE3 2 16 PHE HA 3.699 3.121 4.277 4.128 4.008 4.232 . 0 0 "[ . 1]" 1
492 1 16 PHE HA 2 25 LYS HE3 3.699 3.121 4.277 4.128 4.008 4.246 . 0 0 "[ . 1]" 1
493 1 53 LYS QE 2 53 LYS QD 4.197 . 6.000 3.583 2.952 4.159 . 0 0 "[ . 1]" 1
494 1 53 LYS QD 2 53 LYS QE 4.197 . 6.000 3.583 2.957 4.160 . 0 0 "[ . 1]" 1
495 1 43 ILE HB 2 18 ILE MD 2.135 . 2.638 2.530 2.492 2.625 . 0 0 "[ . 1]" 1
496 1 18 ILE MD 2 43 ILE HB 2.135 . 2.638 2.534 2.485 2.625 . 0 0 "[ . 1]" 1
497 1 51 LEU MD2 2 27 ARG HG2 2.510 . 3.082 2.659 2.503 2.804 . 0 0 "[ . 1]" 1
498 1 27 ARG HG2 2 51 LEU MD2 2.510 . 3.082 2.658 2.493 2.809 . 0 0 "[ . 1]" 1
499 1 51 LEU MD2 2 27 ARG HG3 2.230 . 2.853 2.226 2.043 2.387 . 0 0 "[ . 1]" 1
500 1 27 ARG HG3 2 51 LEU MD2 2.230 . 2.853 2.227 2.037 2.388 . 0 0 "[ . 1]" 1
501 1 48 LYS QG 2 24 LEU QD 3.810 3.246 4.374 3.599 3.302 3.774 . 0 0 "[ . 1]" 1
502 1 24 LEU QD 2 48 LYS QG 3.810 3.246 4.374 3.603 3.299 3.777 . 0 0 "[ . 1]" 1
503 1 51 LEU MD2 2 27 ARG HE 4.500 3.796 5.204 4.850 4.657 4.976 . 0 0 "[ . 1]" 1
504 1 27 ARG HE 2 51 LEU MD2 4.500 3.796 5.204 4.847 4.655 4.978 . 0 0 "[ . 1]" 1
505 1 24 LEU QD 2 48 LYS QE . . 2.223 1.845 1.783 1.975 0.098 6 0 "[ . 1]" 1
506 1 48 LYS QE 2 24 LEU QD . . 2.223 1.843 1.781 1.968 0.100 6 0 "[ . 1]" 1
507 1 28 LEU MD2 2 50 TYR QD 1.778 . 2.433 2.335 2.204 2.443 0.010 2 0 "[ . 1]" 1
508 1 50 TYR QD 2 28 LEU MD2 1.778 . 2.433 2.335 2.192 2.446 0.013 1 0 "[ . 1]" 1
509 1 51 LEU MD1 2 31 TYR H 4.551 3.557 5.545 4.089 4.001 4.179 . 0 0 "[ . 1]" 1
510 1 31 TYR H 2 51 LEU MD1 4.551 3.557 5.545 4.089 3.990 4.188 . 0 0 "[ . 1]" 1
511 1 51 LEU MD1 2 31 TYR QE 3.556 2.610 4.502 3.868 3.803 3.954 . 0 0 "[ . 1]" 1
512 1 31 TYR QE 2 51 LEU MD1 3.556 2.610 4.502 3.870 3.801 3.950 . 0 0 "[ . 1]" 1
513 1 15 VAL MG1 2 17 GLY HA3 3.864 2.975 4.753 4.201 4.114 4.297 . 0 0 "[ . 1]" 1
514 1 17 GLY HA3 2 15 VAL MG1 3.864 2.975 4.753 4.202 4.123 4.293 . 0 0 "[ . 1]" 1
515 1 51 LEU MD1 2 31 TYR HA 3.874 3.202 4.546 4.342 4.266 4.414 . 0 0 "[ . 1]" 1
516 1 31 TYR HA 2 51 LEU MD1 3.874 3.202 4.546 4.344 4.259 4.421 . 0 0 "[ . 1]" 1
517 1 51 LEU MD1 2 31 TYR HB2 2.272 . 2.784 2.315 2.269 2.361 . 0 0 "[ . 1]" 1
518 1 31 TYR HB2 2 51 LEU MD1 2.272 . 2.784 2.315 2.261 2.367 . 0 0 "[ . 1]" 1
519 1 51 LEU MD1 2 28 LEU HB2 2.944 2.354 3.534 3.479 3.421 3.549 0.015 9 0 "[ . 1]" 1
520 1 28 LEU HB2 2 51 LEU MD1 2.944 2.354 3.534 3.479 3.420 3.555 0.021 9 0 "[ . 1]" 1
521 1 14 ALA MB 2 22 LYS H 4.081 3.045 5.117 4.015 3.741 4.220 . 0 0 "[ . 1]" 1
522 1 22 LYS H 2 14 ALA MB 4.081 3.045 5.117 4.011 3.749 4.221 . 0 0 "[ . 1]" 1
523 1 15 VAL MG1 2 18 ILE H 3.154 2.440 3.868 3.554 3.515 3.597 . 0 0 "[ . 1]" 1
524 1 18 ILE H 2 15 VAL MG1 3.154 2.440 3.868 3.550 3.508 3.590 . 0 0 "[ . 1]" 1
525 1 15 VAL MG2 2 19 TYR QE 2.040 . 2.949 1.970 1.884 2.056 . 0 0 "[ . 1]" 1
526 1 19 TYR QE 2 15 VAL MG2 2.040 . 2.949 1.969 1.907 2.065 . 0 0 "[ . 1]" 1
527 1 42 ALA MB 2 50 TYR QD 3.112 . 4.440 4.095 4.027 4.234 . 0 0 "[ . 1]" 1
528 1 50 TYR QD 2 42 ALA MB 3.112 . 4.440 4.091 4.017 4.227 . 0 0 "[ . 1]" 1
529 1 42 ALA MB 2 51 LEU MD1 3.541 . 5.637 4.334 4.163 4.463 . 0 0 "[ . 1]" 1
530 1 51 LEU MD1 2 42 ALA MB 3.541 . 5.637 4.330 4.168 4.459 . 0 0 "[ . 1]" 1
531 1 18 ILE MG 2 40 THR HA 2.824 . 3.259 2.804 2.719 2.887 . 0 0 "[ . 1]" 1
532 1 40 THR HA 2 18 ILE MG 2.824 . 3.259 2.803 2.730 2.874 . 0 0 "[ . 1]" 1
533 1 47 ILE MG 2 28 LEU HB2 3.826 2.956 4.696 4.180 4.029 4.284 . 0 0 "[ . 1]" 1
534 1 28 LEU HB2 2 47 ILE MG 3.826 2.956 4.696 4.182 4.024 4.280 . 0 0 "[ . 1]" 1
535 1 47 ILE MG 2 20 MET ME 1.473 . 1.961 2.013 1.985 2.051 0.090 1 0 "[ . 1]" 1
536 1 20 MET ME 2 47 ILE MG 1.473 . 1.961 2.015 1.991 2.053 0.092 1 0 "[ . 1]" 1
537 1 18 ILE MG 2 40 THR MG 2.409 . 3.078 2.965 2.942 2.998 . 0 0 "[ . 1]" 1
538 1 40 THR MG 2 18 ILE MG 2.409 . 3.078 2.966 2.937 3.010 . 0 0 "[ . 1]" 1
539 1 47 ILE MG 2 24 LEU QD 1.093 . 6.000 1.554 1.516 1.581 . 0 0 "[ . 1]" 1
540 1 24 LEU QD 2 47 ILE MG 1.093 . 6.000 1.554 1.512 1.579 . 0 0 "[ . 1]" 1
541 1 46 ALA MB 2 47 ILE H 2.864 2.331 3.397 3.360 3.253 3.423 0.026 4 0 "[ . 1]" 1
542 1 47 ILE H 2 46 ALA MB 2.864 2.331 3.397 3.361 3.257 3.423 0.026 4 0 "[ . 1]" 1
543 1 46 ALA MB 2 50 TYR HA 5.775 . 6.000 4.335 4.256 4.396 . 0 0 "[ . 1]" 1
544 1 50 TYR HA 2 46 ALA MB 5.775 . 6.000 4.333 4.245 4.398 . 0 0 "[ . 1]" 1
545 1 43 ILE MG 2 43 ILE HA 3.734 2.829 4.639 4.716 4.695 4.740 0.101 8 0 "[ . 1]" 1
546 1 43 ILE HA 2 43 ILE MG 3.734 2.829 4.639 4.715 4.693 4.745 0.106 8 0 "[ . 1]" 1
547 1 20 MET ME 2 48 LYS H 4.420 3.324 5.516 5.288 5.205 5.402 . 0 0 "[ . 1]" 1
548 1 48 LYS H 2 20 MET ME 4.420 3.324 5.516 5.282 5.184 5.396 . 0 0 "[ . 1]" 1
549 1 20 MET ME 2 44 GLU H 4.644 3.535 5.753 4.347 4.262 4.483 . 0 0 "[ . 1]" 1
550 1 44 GLU H 2 20 MET ME 4.644 3.535 5.753 4.346 4.257 4.488 . 0 0 "[ . 1]" 1
551 1 46 ALA MB 2 50 TYR H 4.228 3.457 4.999 3.878 3.862 3.912 . 0 0 "[ . 1]" 1
552 1 50 TYR H 2 46 ALA MB 4.228 3.457 4.999 3.875 3.850 3.902 . 0 0 "[ . 1]" 1
553 1 20 MET ME 2 16 PHE QD 2.661 . 6.000 4.180 3.674 4.323 . 0 0 "[ . 1]" 1
554 1 16 PHE QD 2 20 MET ME 2.661 . 6.000 4.182 3.679 4.328 . 0 0 "[ . 1]" 1
555 1 43 ILE MG 2 20 MET HB3 2.727 2.066 3.388 3.400 3.334 3.506 0.118 8 0 "[ . 1]" 1
556 1 20 MET HB3 2 43 ILE MG 2.727 2.066 3.388 3.403 3.338 3.512 0.124 8 0 "[ . 1]" 1
557 1 43 ILE MG 2 18 ILE MD 0.847 . 6.000 1.808 1.749 1.892 . 0 0 "[ . 1]" 1
558 1 18 ILE MD 2 43 ILE MG 0.847 . 6.000 1.812 1.762 1.890 . 0 0 "[ . 1]" 1
559 1 47 ILE MD 2 28 LEU H 3.774 3.038 4.510 3.801 3.752 3.844 . 0 0 "[ . 1]" 1
560 1 28 LEU H 2 47 ILE MD 3.774 3.038 4.510 3.800 3.747 3.846 . 0 0 "[ . 1]" 1
561 1 18 ILE MD 2 16 PHE QD 2.452 . 6.000 3.606 3.532 3.675 . 0 0 "[ . 1]" 1
562 1 16 PHE QD 2 18 ILE MD 2.452 . 6.000 3.608 3.529 3.674 . 0 0 "[ . 1]" 1
563 1 18 ILE MD 2 20 MET ME 3.118 . 6.000 5.395 5.186 5.526 . 0 0 "[ . 1]" 1
564 1 20 MET ME 2 18 ILE MD 3.118 . 6.000 5.392 5.177 5.518 . 0 0 "[ . 1]" 1
565 1 47 ILE MD 2 20 MET ME 0.990 . 6.000 2.023 1.614 2.139 . 0 0 "[ . 1]" 1
566 1 20 MET ME 2 47 ILE MD 0.990 . 6.000 2.024 1.599 2.143 . 0 0 "[ . 1]" 1
567 1 18 ILE MD 2 42 ALA MB 3.377 . 6.000 5.429 5.392 5.558 . 0 0 "[ . 1]" 1
568 1 42 ALA MB 2 18 ILE MD 3.377 . 6.000 5.427 5.384 5.564 . 0 0 "[ . 1]" 1
569 1 18 ILE MD 2 40 THR MG 1.334 . 1.957 1.571 1.523 1.616 . 0 0 "[ . 1]" 1
570 1 40 THR MG 2 18 ILE MD 1.334 . 1.957 1.573 1.528 1.619 . 0 0 "[ . 1]" 1
571 1 47 ILE MD 2 43 ILE MD 1.099 . 6.000 1.983 1.915 2.033 . 0 0 "[ . 1]" 1
572 1 43 ILE MD 2 47 ILE MD 1.099 . 6.000 1.985 1.921 2.041 . 0 0 "[ . 1]" 1
573 1 14 ALA MB 2 22 LYS QB 3.268 2.267 4.269 2.705 2.349 3.117 . 0 0 "[ . 1]" 1
574 1 22 LYS QB 2 14 ALA MB 3.268 2.267 4.269 2.704 2.347 3.118 . 0 0 "[ . 1]" 1
575 1 14 ALA MB 2 20 MET ME 3.173 . 6.000 5.101 5.048 5.198 . 0 0 "[ . 1]" 1
576 1 20 MET ME 2 14 ALA MB 3.173 . 6.000 5.102 5.053 5.196 . 0 0 "[ . 1]" 1
577 1 18 ILE HB 2 43 ILE MG 3.439 . 6.000 4.895 4.857 4.939 . 0 0 "[ . 1]" 1
578 1 43 ILE MG 2 18 ILE HB 3.439 . 6.000 4.892 4.851 4.945 . 0 0 "[ . 1]" 1
579 1 18 ILE MG 2 39 LEU HG 4.407 3.282 5.532 4.452 4.344 4.591 . 0 0 "[ . 1]" 1
580 1 39 LEU HG 2 18 ILE MG 4.407 3.282 5.532 4.451 4.342 4.593 . 0 0 "[ . 1]" 1
581 1 47 ILE MD 2 31 TYR QD 3.633 . 6.000 5.769 5.647 5.947 . 0 0 "[ . 1]" 1
582 1 31 TYR QD 2 47 ILE MD 3.633 . 6.000 5.768 5.647 5.962 . 0 0 "[ . 1]" 1
583 1 25 LYS HE2 2 14 ALA MB 5.743 3.886 7.600 4.161 4.056 4.369 . 0 0 "[ . 1]" 1
584 1 14 ALA MB 2 25 LYS HE2 5.743 3.886 7.600 4.160 4.051 4.376 . 0 0 "[ . 1]" 1
585 1 28 LEU HA 2 47 ILE HG13 5.643 4.663 6.623 5.104 4.896 5.450 . 0 0 "[ . 1]" 1
586 1 47 ILE HG13 2 28 LEU HA 5.643 4.663 6.623 5.102 4.887 5.444 . 0 0 "[ . 1]" 1
587 1 46 ALA HA 2 46 ALA MB 4.467 3.101 5.833 4.397 4.274 4.525 . 0 0 "[ . 1]" 1
588 1 46 ALA MB 2 46 ALA HA 4.467 3.101 5.833 4.398 4.274 4.520 . 0 0 "[ . 1]" 1
589 1 45 GLU QB 2 50 TYR QE 3.307 . 6.000 2.507 2.313 2.704 . 0 0 "[ . 1]" 1
590 1 50 TYR QE 2 45 GLU QB 3.307 . 6.000 2.504 2.299 2.711 . 0 0 "[ . 1]" 1
591 1 47 ILE MG 2 18 ILE MD 2.029 . 6.000 4.818 4.725 4.922 . 0 0 "[ . 1]" 1
592 1 18 ILE MD 2 47 ILE MG 2.029 . 6.000 4.819 4.722 4.921 . 0 0 "[ . 1]" 1
593 1 47 ILE MD 2 20 MET HG2 5.264 3.992 6.536 5.725 4.889 5.898 . 0 0 "[ . 1]" 1
594 1 20 MET HG2 2 47 ILE MD 5.264 3.992 6.536 5.727 4.885 5.900 . 0 0 "[ . 1]" 1
595 1 16 PHE QE 2 39 LEU HG 3.559 . 6.000 2.329 2.203 2.435 . 0 0 "[ . 1]" 1
596 1 39 LEU HG 2 16 PHE QE 3.559 . 6.000 2.330 2.200 2.433 . 0 0 "[ . 1]" 1
597 1 31 TYR QE 2 51 LEU HB3 5.661 4.384 6.938 6.965 6.853 7.064 0.126 6 0 "[ . 1]" 1
598 1 51 LEU HB3 2 31 TYR QE 5.661 4.384 6.938 6.962 6.860 7.066 0.128 6 0 "[ . 1]" 1
599 1 50 TYR QD 2 45 GLU QB 4.872 3.922 5.822 4.027 3.882 4.163 0.040 8 0 "[ . 1]" 1
600 1 45 GLU QB 2 50 TYR QD 4.872 3.922 5.822 4.028 3.888 4.158 0.034 8 0 "[ . 1]" 1
601 1 28 LEU HA 1 31 TYR QD 3.634 3.222 4.046 3.882 3.783 3.983 . 0 0 "[ . 1]" 1
602 2 28 LEU HA 2 31 TYR QD 3.634 3.222 4.046 3.882 3.789 3.994 . 0 0 "[ . 1]" 1
603 1 31 TYR HB2 1 31 TYR QD 2.422 2.140 2.704 2.496 2.454 2.559 . 0 0 "[ . 1]" 1
604 2 31 TYR HB2 2 31 TYR QD 2.422 2.140 2.704 2.494 2.449 2.555 . 0 0 "[ . 1]" 1
605 1 31 TYR HB3 1 31 TYR QD 2.107 . 2.375 2.304 2.278 2.331 . 0 0 "[ . 1]" 1
606 2 31 TYR HB3 2 31 TYR QD 2.107 . 2.375 2.305 2.282 2.335 . 0 0 "[ . 1]" 1
607 1 31 TYR QD 1 42 ALA MB 2.318 . 6.000 2.621 2.484 2.844 . 0 0 "[ . 1]" 1
608 2 31 TYR QD 2 42 ALA MB 2.318 . 6.000 2.620 2.483 2.843 . 0 0 "[ . 1]" 1
609 1 31 TYR QD 1 37 LEU MD2 2.060 . 6.000 3.328 3.203 3.503 . 0 0 "[ . 1]" 1
610 2 31 TYR QD 2 37 LEU MD2 2.060 . 6.000 3.325 3.198 3.502 . 0 0 "[ . 1]" 1
611 1 28 LEU MD2 1 31 TYR QD 1.633 . 6.000 2.148 2.035 2.297 . 0 0 "[ . 1]" 1
612 2 28 LEU MD2 2 31 TYR QD 1.633 . 6.000 2.150 2.039 2.302 . 0 0 "[ . 1]" 1
613 1 31 TYR QD 2 51 LEU MD2 2.722 . 6.000 4.703 4.650 4.770 . 0 0 "[ . 1]" 1
614 1 51 LEU MD2 2 31 TYR QD 2.722 . 6.000 4.703 4.651 4.781 . 0 0 "[ . 1]" 1
615 1 16 PHE HA 1 16 PHE QR 2.265 . 2.659 2.006 1.947 2.056 . 0 0 "[ . 1]" 1
616 2 16 PHE HA 2 16 PHE QR 2.265 . 2.659 2.006 1.955 2.053 . 0 0 "[ . 1]" 1
617 1 16 PHE QR 2 40 THR HA 3.121 2.637 3.605 3.106 3.072 3.185 . 0 0 "[ . 1]" 1
618 1 40 THR HA 2 16 PHE QR 3.121 2.637 3.605 3.107 3.067 3.178 . 0 0 "[ . 1]" 1
619 1 16 PHE HB2 1 16 PHE QR 2.704 2.416 2.992 2.683 2.664 2.701 . 0 0 "[ . 1]" 1
620 2 16 PHE HB2 2 16 PHE QR 2.704 2.416 2.992 2.682 2.663 2.703 . 0 0 "[ . 1]" 1
621 1 16 PHE HB3 1 16 PHE QR 2.277 . 2.556 2.277 2.269 2.289 . 0 0 "[ . 1]" 1
622 2 16 PHE HB3 2 16 PHE QR 2.277 . 2.556 2.279 2.269 2.290 . 0 0 "[ . 1]" 1
623 1 16 PHE QR 2 20 MET HG2 3.761 . 6.000 4.442 4.352 4.557 . 0 0 "[ . 1]" 1
624 1 20 MET HG2 2 16 PHE QR 3.761 . 6.000 4.442 4.354 4.550 . 0 0 "[ . 1]" 1
625 1 16 PHE QR 2 25 LYS HE2 2.678 2.307 3.049 3.028 2.898 3.080 0.031 3 0 "[ . 1]" 1
626 1 25 LYS HE2 2 16 PHE QR 2.678 2.307 3.049 3.026 2.886 3.083 0.034 3 0 "[ . 1]" 1
627 1 16 PHE QR 2 25 LYS HE3 2.616 2.252 2.980 2.939 2.797 3.025 0.045 2 0 "[ . 1]" 1
628 1 25 LYS HE3 2 16 PHE QR 2.616 2.252 2.980 2.941 2.800 3.016 0.036 2 0 "[ . 1]" 1
629 1 16 PHE QR 2 40 THR MG 2.678 . 6.000 3.993 3.956 4.035 . 0 0 "[ . 1]" 1
630 1 40 THR MG 2 16 PHE QR 2.678 . 6.000 3.994 3.951 4.046 . 0 0 "[ . 1]" 1
631 1 16 PHE QR 2 25 LYS HG3 2.987 . 6.000 3.633 3.567 3.727 . 0 0 "[ . 1]" 1
632 1 25 LYS HG3 2 16 PHE QR 2.987 . 6.000 3.632 3.577 3.730 . 0 0 "[ . 1]" 1
633 1 16 PHE QR 1 18 ILE MD 1.351 . 6.000 1.823 1.765 1.876 . 0 0 "[ . 1]" 1
634 2 16 PHE QR 2 18 ILE MD 1.351 . 6.000 1.822 1.762 1.867 . 0 0 "[ . 1]" 1
635 1 16 PHE QR 2 43 ILE HB 2.506 2.098 2.914 2.908 2.800 2.960 0.046 5 0 "[ . 1]" 1
636 1 43 ILE HB 2 16 PHE QR 2.506 2.098 2.914 2.906 2.802 2.953 0.039 5 0 "[ . 1]" 1
637 1 16 PHE QR 2 39 LEU HB3 2.230 . 2.510 2.042 1.938 2.169 0.012 1 0 "[ . 1]" 1
638 1 39 LEU HB3 2 16 PHE QR 2.230 . 2.510 2.042 1.938 2.171 0.012 4 0 "[ . 1]" 1
639 1 16 PHE QR 2 39 LEU MD1 1.639 . 1.960 1.792 1.765 1.810 . 0 0 "[ . 1]" 1
640 1 39 LEU MD1 2 16 PHE QR 1.639 . 1.960 1.792 1.762 1.818 . 0 0 "[ . 1]" 1
641 1 16 PHE QR 2 43 ILE MD 1.727 . 2.119 2.008 1.943 2.042 . 0 0 "[ . 1]" 1
642 1 43 ILE MD 2 16 PHE QR 1.727 . 2.119 2.007 1.948 2.037 . 0 0 "[ . 1]" 1
643 1 19 TYR HA 1 19 TYR QD 2.288 . 2.593 2.517 2.451 2.602 0.009 7 0 "[ . 1]" 1
644 2 19 TYR HA 2 19 TYR QD 2.288 . 2.593 2.516 2.451 2.604 0.011 7 0 "[ . 1]" 1
645 1 19 TYR QD 2 14 ALA HA 3.156 . 6.000 4.486 4.395 4.570 . 0 0 "[ . 1]" 1
646 1 14 ALA HA 2 19 TYR QD 3.156 . 6.000 4.489 4.379 4.571 . 0 0 "[ . 1]" 1
647 1 19 TYR HB2 1 19 TYR QD 2.306 2.033 2.579 2.280 2.263 2.300 . 0 0 "[ . 1]" 1
648 2 19 TYR HB2 2 19 TYR QD 2.306 2.033 2.579 2.284 2.270 2.299 . 0 0 "[ . 1]" 1
649 1 19 TYR HB3 1 19 TYR QD 2.632 2.347 2.917 2.582 2.544 2.612 . 0 0 "[ . 1]" 1
650 2 19 TYR HB3 2 19 TYR QD 2.632 2.347 2.917 2.582 2.547 2.612 . 0 0 "[ . 1]" 1
651 1 19 TYR QD 2 15 VAL HB 3.867 3.397 4.337 4.356 4.301 4.407 0.070 6 0 "[ . 1]" 1
652 1 15 VAL HB 2 19 TYR QD 3.867 3.397 4.337 4.360 4.317 4.412 0.075 6 0 "[ . 1]" 1
653 1 19 TYR QD 2 13 LYS QB 4.645 4.242 5.048 4.240 4.160 4.313 0.082 2 0 "[ . 1]" 1
654 1 13 LYS QB 2 19 TYR QD 4.645 4.242 5.048 4.237 4.160 4.304 0.082 2 0 "[ . 1]" 1
655 1 19 TYR QD 2 15 VAL MG2 1.325 . 1.732 1.801 1.775 1.825 0.093 3 0 "[ . 1]" 1
656 1 15 VAL MG2 2 19 TYR QD 1.325 . 1.732 1.805 1.785 1.829 0.097 8 0 "[ . 1]" 1
657 1 31 TYR QE 1 37 LEU MD2 1.379 . 6.000 2.166 1.998 2.460 . 0 0 "[ . 1]" 1
658 2 31 TYR QE 2 37 LEU MD2 1.379 . 6.000 2.164 1.999 2.458 . 0 0 "[ . 1]" 1
659 1 19 TYR QE 2 15 VAL HB 2.955 . 6.000 4.299 4.222 4.385 . 0 0 "[ . 1]" 1
660 1 15 VAL HB 2 19 TYR QE 2.955 . 6.000 4.302 4.231 4.382 . 0 0 "[ . 1]" 1
661 1 50 TYR QB 1 50 TYR QD 1.990 . 2.211 2.113 2.104 2.126 . 0 0 "[ . 1]" 1
662 2 50 TYR QB 2 50 TYR QD 1.990 . 2.211 2.113 2.105 2.120 . 0 0 "[ . 1]" 1
663 1 50 TYR HA 1 50 TYR QD 2.339 2.039 2.639 2.548 2.390 2.651 0.012 1 0 "[ . 1]" 1
664 2 50 TYR HA 2 50 TYR QD 2.339 2.039 2.639 2.548 2.395 2.650 0.011 2 0 "[ . 1]" 1
665 1 50 TYR QD 1 51 LEU MD2 1.907 . 6.000 2.901 2.723 2.956 . 0 0 "[ . 1]" 1
666 2 50 TYR QD 2 51 LEU MD2 1.907 . 6.000 2.901 2.722 2.954 . 0 0 "[ . 1]" 1
667 1 50 TYR QD 1 51 LEU MD1 1.347 . 6.000 2.577 2.400 2.780 . 0 0 "[ . 1]" 1
668 2 50 TYR QD 2 51 LEU MD1 1.347 . 6.000 2.577 2.401 2.780 . 0 0 "[ . 1]" 1
669 1 50 TYR QE 2 31 TYR QD 2.171 . 6.000 3.116 2.893 3.322 . 0 0 "[ . 1]" 1
670 1 31 TYR QD 2 50 TYR QE 2.171 . 6.000 3.116 2.892 3.322 . 0 0 "[ . 1]" 1
671 1 50 TYR QE 2 31 TYR QE 2.213 . 6.000 2.868 2.656 3.107 . 0 0 "[ . 1]" 1
672 1 31 TYR QE 2 50 TYR QE 2.213 . 6.000 2.865 2.654 3.102 . 0 0 "[ . 1]" 1
673 1 50 TYR QE 2 42 ALA HA 2.992 2.575 3.409 3.528 3.483 3.588 0.179 1 0 "[ . 1]" 1
674 1 42 ALA HA 2 50 TYR QE 2.992 2.575 3.409 3.532 3.491 3.592 0.183 1 0 "[ . 1]" 1
675 1 50 TYR QE 1 54 ARG HD2 3.677 3.279 4.075 4.130 4.101 4.190 0.115 5 0 "[ . 1]" 1
676 2 50 TYR QE 2 54 ARG HD2 3.677 3.279 4.075 4.129 4.098 4.183 0.108 5 0 "[ . 1]" 1
677 1 50 TYR QE 1 51 LEU MD1 1.725 . 6.000 3.225 3.139 3.383 . 0 0 "[ . 1]" 1
678 2 50 TYR QE 2 51 LEU MD1 1.725 . 6.000 3.226 3.140 3.383 . 0 0 "[ . 1]" 1
679 1 19 TYR HA 2 15 VAL HA 2.112 . 2.303 2.299 2.242 2.332 0.029 8 0 "[ . 1]" 1
680 1 15 VAL HA 2 19 TYR HA 2.112 . 2.303 2.302 2.248 2.344 0.041 8 0 "[ . 1]" 1
681 1 19 TYR HA 1 19 TYR HB2 2.895 2.609 3.181 3.029 3.027 3.031 . 0 0 "[ . 1]" 1
682 2 19 TYR HA 2 19 TYR HB2 2.895 2.609 3.181 3.029 3.028 3.031 . 0 0 "[ . 1]" 1
683 1 19 TYR HA 1 19 TYR HB3 2.339 2.059 2.619 2.470 2.457 2.483 . 0 0 "[ . 1]" 1
684 2 19 TYR HA 2 19 TYR HB3 2.339 2.059 2.619 2.470 2.460 2.482 . 0 0 "[ . 1]" 1
685 1 19 TYR HA 2 15 VAL MG2 . 2.670 3.904 3.672 3.599 3.736 . 0 0 "[ . 1]" 1
686 1 15 VAL MG2 2 19 TYR HA . 2.670 3.904 3.674 3.600 3.745 . 0 0 "[ . 1]" 1
687 1 19 TYR HA 2 15 VAL MG1 2.399 2.342 3.458 3.332 3.242 3.409 . 0 0 "[ . 1]" 1
688 1 15 VAL MG1 2 19 TYR HA 2.399 2.342 3.458 3.333 3.240 3.413 . 0 0 "[ . 1]" 1
689 1 35 ASN HA 1 35 ASN HB2 2.814 2.558 3.070 3.022 3.018 3.025 . 0 0 "[ . 1]" 1
690 2 35 ASN HA 2 35 ASN HB2 2.814 2.558 3.070 3.021 3.017 3.025 . 0 0 "[ . 1]" 1
691 1 14 ALA HA 1 15 VAL MG1 3.647 . 6.000 5.358 5.312 5.388 . 0 0 "[ . 1]" 1
692 2 14 ALA HA 2 15 VAL MG1 3.647 . 6.000 5.358 5.313 5.386 . 0 0 "[ . 1]" 1
693 1 13 LYS QB 1 14 ALA HA 3.091 . 6.000 4.244 4.119 4.483 . 0 0 "[ . 1]" 1
694 2 13 LYS QB 2 14 ALA HA 3.091 . 6.000 4.244 4.121 4.478 . 0 0 "[ . 1]" 1
695 1 13 LYS QG 1 14 ALA HA 2.603 . 6.000 3.938 3.686 4.860 . 0 0 "[ . 1]" 1
696 2 13 LYS QG 2 14 ALA HA 2.603 . 6.000 3.937 3.682 4.851 . 0 0 "[ . 1]" 1
697 1 14 ALA HA 1 15 VAL HA 3.375 . 6.000 4.395 4.337 4.425 . 0 0 "[ . 1]" 1
698 2 14 ALA HA 2 15 VAL HA 3.375 . 6.000 4.395 4.333 4.426 . 0 0 "[ . 1]" 1
699 1 23 ASP HA 1 26 THR HB 2.202 . 2.444 2.441 2.306 2.520 0.076 8 0 "[ . 1]" 1
700 2 23 ASP HA 2 26 THR HB 2.202 . 2.444 2.442 2.305 2.518 0.074 8 0 "[ . 1]" 1
701 1 23 ASP HA 1 26 THR MG 2.352 . 6.000 3.563 3.392 3.707 . 0 0 "[ . 1]" 1
702 2 23 ASP HA 2 26 THR MG 2.352 . 6.000 3.565 3.392 3.708 . 0 0 "[ . 1]" 1
703 1 21 ASP HA 1 21 ASP HB3 2.392 2.133 2.651 2.621 2.524 2.661 0.010 7 0 "[ . 1]" 1
704 2 21 ASP HA 2 21 ASP HB3 2.392 2.133 2.651 2.622 2.531 2.657 0.006 7 0 "[ . 1]" 1
705 1 15 VAL HA 1 15 VAL HB 2.730 2.404 3.056 2.981 2.974 2.987 . 0 0 "[ . 1]" 1
706 2 15 VAL HA 2 15 VAL HB 2.730 2.404 3.056 2.981 2.977 2.985 . 0 0 "[ . 1]" 1
707 1 15 VAL HA 1 15 VAL MG1 1.694 . 6.000 2.246 2.234 2.266 . 0 0 "[ . 1]" 1
708 2 15 VAL HA 2 15 VAL MG1 1.694 . 6.000 2.246 2.232 2.265 . 0 0 "[ . 1]" 1
709 1 38 GLN HA 1 38 GLN HG2 2.363 2.119 2.607 2.576 2.504 2.622 0.015 7 0 "[ . 1]" 1
710 2 38 GLN HA 2 38 GLN HG2 2.363 2.119 2.607 2.579 2.507 2.628 0.021 7 0 "[ . 1]" 1
711 1 38 GLN HA 1 38 GLN QB 2.359 2.111 2.607 2.368 2.352 2.385 . 0 0 "[ . 1]" 1
712 2 38 GLN HA 2 38 GLN QB 2.359 2.111 2.607 2.368 2.353 2.382 . 0 0 "[ . 1]" 1
713 1 38 GLN HA 1 38 GLN HG3 2.713 2.463 2.963 3.039 2.990 3.064 0.101 4 0 "[ . 1]" 1
714 2 38 GLN HA 2 38 GLN HG3 2.713 2.463 2.963 3.040 2.997 3.059 0.096 4 0 "[ . 1]" 1
715 1 33 ALA HA 1 36 ASN HA 3.293 2.909 3.677 3.282 3.207 3.423 . 0 0 "[ . 1]" 1
716 2 33 ALA HA 2 36 ASN HA 3.293 2.909 3.677 3.282 3.201 3.420 . 0 0 "[ . 1]" 1
717 1 36 ASN HA 1 36 ASN HB3 2.545 2.307 2.783 2.573 2.531 2.627 . 0 0 "[ . 1]" 1
718 2 36 ASN HA 2 36 ASN HB3 2.545 2.307 2.783 2.573 2.530 2.625 . 0 0 "[ . 1]" 1
719 1 26 THR HA 1 26 THR HB 2.513 . 6.000 3.022 3.015 3.028 . 0 0 "[ . 1]" 1
720 2 26 THR HA 2 26 THR HB 2.513 . 6.000 3.022 3.015 3.030 . 0 0 "[ . 1]" 1
721 1 51 LEU MD1 1 56 GLY HA2 2.508 . 6.000 2.292 1.981 2.708 . 0 0 "[ . 1]" 1
722 2 51 LEU MD1 2 56 GLY HA2 2.508 . 6.000 2.292 1.974 2.718 . 0 0 "[ . 1]" 1
723 1 39 LEU HA 1 39 LEU MD1 . . 1.921 1.880 1.846 1.918 . 0 0 "[ . 1]" 1
724 2 39 LEU HA 2 39 LEU MD1 . . 1.921 1.879 1.851 1.918 . 0 0 "[ . 1]" 1
725 1 18 ILE HA 2 40 THR MG 3.359 2.882 3.836 3.861 3.851 3.884 0.048 8 0 "[ . 1]" 1
726 1 40 THR MG 2 18 ILE HA 3.359 2.882 3.836 3.859 3.845 3.887 0.051 8 0 "[ . 1]" 1
727 1 33 ALA HA 1 34 LYS HA 3.861 . 6.000 4.741 4.698 4.765 . 0 0 "[ . 1]" 1
728 2 33 ALA HA 2 34 LYS HA 3.861 . 6.000 4.739 4.698 4.767 . 0 0 "[ . 1]" 1
729 1 41 GLN HA 1 41 GLN QG 2.611 2.329 2.893 2.400 2.294 2.455 0.035 10 0 "[ . 1]" 1
730 2 41 GLN HA 2 41 GLN QG 2.611 2.329 2.893 2.399 2.294 2.456 0.035 10 0 "[ . 1]" 1
731 1 41 GLN HA 1 41 GLN HB2 2.603 2.268 2.938 2.523 2.483 2.555 . 0 0 "[ . 1]" 1
732 2 41 GLN HA 2 41 GLN HB2 2.603 2.268 2.938 2.523 2.484 2.555 . 0 0 "[ . 1]" 1
733 1 50 TYR HA 2 46 ALA HA 3.884 3.484 4.284 3.913 3.758 4.064 . 0 0 "[ . 1]" 1
734 1 46 ALA HA 2 50 TYR HA 3.884 3.484 4.284 3.913 3.760 4.061 . 0 0 "[ . 1]" 1
735 1 50 TYR HA 1 50 TYR QB 2.226 . 2.456 2.300 2.284 2.316 . 0 0 "[ . 1]" 1
736 2 50 TYR HA 2 50 TYR QB 2.226 . 2.456 2.301 2.283 2.318 . 0 0 "[ . 1]" 1
737 1 50 TYR HA 1 53 LYS HB2 3.299 2.950 3.648 3.505 3.322 3.653 0.005 5 0 "[ . 1]" 1
738 2 50 TYR HA 2 53 LYS HB2 3.299 2.950 3.648 3.505 3.324 3.650 0.002 5 0 "[ . 1]" 1
739 1 54 ARG HA 1 54 ARG HD2 2.803 2.409 3.197 2.524 2.375 2.684 0.034 5 0 "[ . 1]" 1
740 2 54 ARG HA 2 54 ARG HD2 2.803 2.409 3.197 2.522 2.382 2.687 0.027 5 0 "[ . 1]" 1
741 1 54 ARG HA 1 54 ARG HG3 2.291 2.028 2.554 2.406 2.350 2.527 . 0 0 "[ . 1]" 1
742 2 54 ARG HA 2 54 ARG HG3 2.291 2.028 2.554 2.407 2.348 2.528 . 0 0 "[ . 1]" 1
743 1 40 THR HA 1 41 GLN HA 4.849 4.072 5.626 4.832 4.812 4.860 . 0 0 "[ . 1]" 1
744 2 40 THR HA 2 41 GLN HA 4.849 4.072 5.626 4.833 4.807 4.859 . 0 0 "[ . 1]" 1
745 1 52 GLN HA 1 52 GLN HG3 2.636 2.310 2.962 2.334 2.274 2.417 0.036 5 0 "[ . 1]" 1
746 2 52 GLN HA 2 52 GLN HG3 2.636 2.310 2.962 2.333 2.273 2.411 0.037 5 0 "[ . 1]" 1
747 1 52 GLN HA 1 52 GLN HB2 3.004 2.704 3.304 2.980 2.960 2.997 . 0 0 "[ . 1]" 1
748 2 52 GLN HA 2 52 GLN HB2 3.004 2.704 3.304 2.980 2.960 2.997 . 0 0 "[ . 1]" 1
749 1 52 GLN HA 1 52 GLN HB3 2.739 2.461 3.017 2.655 2.606 2.705 . 0 0 "[ . 1]" 1
750 2 52 GLN HA 2 52 GLN HB3 2.739 2.461 3.017 2.656 2.608 2.709 . 0 0 "[ . 1]" 1
751 1 31 TYR HA 1 31 TYR HB3 2.837 2.555 3.119 3.026 3.023 3.029 . 0 0 "[ . 1]" 1
752 2 31 TYR HA 2 31 TYR HB3 2.837 2.555 3.119 3.025 3.022 3.027 . 0 0 "[ . 1]" 1
753 1 30 VAL MG1 1 31 TYR HA 2.341 . 6.000 3.645 3.618 3.687 . 0 0 "[ . 1]" 1
754 2 30 VAL MG1 2 31 TYR HA 2.341 . 6.000 3.644 3.614 3.678 . 0 0 "[ . 1]" 1
755 1 49 GLU HA 1 49 GLU HG2 3.393 3.079 3.707 3.094 2.740 3.634 0.339 8 0 "[ . 1]" 1
756 2 49 GLU HA 2 49 GLU HG2 3.393 3.079 3.707 3.093 2.734 3.631 0.345 8 0 "[ . 1]" 1
757 1 49 GLU HA 1 49 GLU HG3 2.750 2.473 3.027 2.693 2.325 3.418 0.391 9 0 "[ . 1]" 1
758 2 49 GLU HA 2 49 GLU HG3 2.750 2.473 3.027 2.691 2.326 3.413 0.386 9 0 "[ . 1]" 1
759 1 45 GLU HA 1 45 GLU HG2 2.936 2.588 3.284 2.916 2.640 3.155 . 0 0 "[ . 1]" 1
760 2 45 GLU HA 2 45 GLU HG2 2.936 2.588 3.284 2.920 2.639 3.146 . 0 0 "[ . 1]" 1
761 1 45 GLU HA 1 45 GLU QB 2.308 2.081 2.535 2.403 2.369 2.461 . 0 0 "[ . 1]" 1
762 2 45 GLU HA 2 45 GLU QB 2.308 2.081 2.535 2.403 2.369 2.463 . 0 0 "[ . 1]" 1
763 1 45 GLU HA 1 48 LYS HB3 2.197 . 2.474 2.386 2.303 2.482 0.008 8 0 "[ . 1]" 1
764 2 45 GLU HA 2 48 LYS HB3 2.197 . 2.474 2.387 2.299 2.484 0.010 8 0 "[ . 1]" 1
765 1 26 THR HA 1 27 ARG HA 4.240 3.669 4.811 4.848 4.832 4.875 0.064 2 0 "[ . 1]" 1
766 2 26 THR HA 2 27 ARG HA 4.240 3.669 4.811 4.849 4.833 4.876 0.065 2 0 "[ . 1]" 1
767 1 32 CYS HA 1 32 CYS HB3 2.419 2.173 2.665 2.467 2.455 2.491 . 0 0 "[ . 1]" 1
768 2 32 CYS HA 2 32 CYS HB3 2.419 2.173 2.665 2.466 2.458 2.493 . 0 0 "[ . 1]" 1
769 1 29 LYS HA 1 39 LEU MD2 1.739 . 2.081 2.086 2.065 2.102 0.021 10 0 "[ . 1]" 1
770 2 29 LYS HA 2 39 LEU MD2 1.739 . 2.081 2.084 2.057 2.097 0.016 3 0 "[ . 1]" 1
771 1 28 LEU MD1 1 29 LYS HA 2.215 . 6.000 3.094 3.022 3.123 . 0 0 "[ . 1]" 1
772 2 28 LEU MD1 2 29 LYS HA 2.215 . 6.000 3.094 3.023 3.124 . 0 0 "[ . 1]" 1
773 1 32 CYS HA 1 37 LEU HB2 2.131 . 2.414 2.199 2.138 2.250 . 0 0 "[ . 1]" 1
774 2 32 CYS HA 2 37 LEU HB2 2.131 . 2.414 2.199 2.140 2.249 . 0 0 "[ . 1]" 1
775 1 40 THR HA 1 43 ILE HB 2.390 2.075 2.705 2.567 2.505 2.602 . 0 0 "[ . 1]" 1
776 2 40 THR HA 2 43 ILE HB 2.390 2.075 2.705 2.569 2.507 2.606 . 0 0 "[ . 1]" 1
777 1 40 THR HA 1 40 THR MG 1.674 . 6.000 2.313 2.284 2.340 . 0 0 "[ . 1]" 1
778 2 40 THR HA 2 40 THR MG 1.674 . 6.000 2.312 2.287 2.333 . 0 0 "[ . 1]" 1
779 1 40 THR HA 1 43 ILE MD 2.090 . 6.000 3.285 3.241 3.323 . 0 0 "[ . 1]" 1
780 2 40 THR HA 2 43 ILE MD 2.090 . 6.000 3.287 3.237 3.330 . 0 0 "[ . 1]" 1
781 1 26 THR HA 1 29 LYS QD 3.747 3.373 4.121 3.737 3.510 3.865 . 0 0 "[ . 1]" 1
782 2 26 THR HA 2 29 LYS QD 3.747 3.373 4.121 3.738 3.503 3.868 . 0 0 "[ . 1]" 1
783 1 26 THR HA 1 30 VAL MG2 2.690 . 6.000 4.094 4.046 4.171 . 0 0 "[ . 1]" 1
784 2 26 THR HA 2 30 VAL MG2 2.690 . 6.000 4.094 4.046 4.171 . 0 0 "[ . 1]" 1
785 1 26 THR HA 1 29 LYS QB 2.361 2.073 2.649 2.025 1.943 2.140 0.130 8 0 "[ . 1]" 1
786 2 26 THR HA 2 29 LYS QB 2.361 2.073 2.649 2.024 1.945 2.140 0.128 8 0 "[ . 1]" 1
787 1 48 LYS HA 1 48 LYS HB3 2.427 . 6.000 3.018 3.010 3.023 . 0 0 "[ . 1]" 1
788 2 48 LYS HA 2 48 LYS HB3 2.427 . 6.000 3.019 3.011 3.023 . 0 0 "[ . 1]" 1
789 1 22 LYS HA 1 22 LYS QB 2.193 . 2.412 2.330 2.320 2.339 . 0 0 "[ . 1]" 1
790 2 22 LYS HA 2 22 LYS QB 2.193 . 2.412 2.330 2.321 2.336 . 0 0 "[ . 1]" 1
791 1 48 LYS HA 2 24 LEU QD 1.669 . 2.019 2.112 2.059 2.194 0.175 4 0 "[ . 1]" 1
792 1 24 LEU QD 2 48 LYS HA 1.669 . 2.019 2.116 2.054 2.198 0.179 9 0 "[ . 1]" 1
793 1 47 ILE MG 1 48 LYS HA 2.133 . 6.000 3.313 3.211 3.413 . 0 0 "[ . 1]" 1
794 2 47 ILE MG 2 48 LYS HA 2.133 . 6.000 3.315 3.212 3.409 . 0 0 "[ . 1]" 1
795 1 48 LYS HA 1 51 LEU MD2 2.078 . 6.000 3.153 3.011 3.263 . 0 0 "[ . 1]" 1
796 2 48 LYS HA 2 51 LEU MD2 2.078 . 6.000 3.153 3.010 3.260 . 0 0 "[ . 1]" 1
797 1 30 VAL HA 1 30 VAL HB 2.605 2.283 2.927 3.004 2.999 3.006 0.079 10 0 "[ . 1]" 1
798 2 30 VAL HA 2 30 VAL HB 2.605 2.283 2.927 3.004 3.002 3.006 0.079 10 0 "[ . 1]" 1
799 1 30 VAL HA 1 33 ALA MB 1.684 . 6.000 2.348 2.245 2.467 . 0 0 "[ . 1]" 1
800 2 30 VAL HA 2 33 ALA MB 1.684 . 6.000 2.349 2.247 2.471 . 0 0 "[ . 1]" 1
801 1 29 LYS QG 1 30 VAL HA 5.306 . 6.000 4.554 4.321 4.677 . 0 0 "[ . 1]" 1
802 2 29 LYS QG 2 30 VAL HA 5.306 . 6.000 4.553 4.320 4.673 . 0 0 "[ . 1]" 1
803 1 30 VAL HA 1 30 VAL MG2 1.614 . 6.000 2.356 2.333 2.398 . 0 0 "[ . 1]" 1
804 2 30 VAL HA 2 30 VAL MG2 1.614 . 6.000 2.356 2.332 2.398 . 0 0 "[ . 1]" 1
805 1 44 GLU HA 1 44 GLU HB2 2.762 2.465 3.059 3.021 3.015 3.026 . 0 0 "[ . 1]" 1
806 2 44 GLU HA 2 44 GLU HB2 2.762 2.465 3.059 3.020 3.015 3.023 . 0 0 "[ . 1]" 1
807 1 44 GLU HA 1 44 GLU HG3 2.432 . 6.000 3.090 3.065 3.128 . 0 0 "[ . 1]" 1
808 2 44 GLU HA 2 44 GLU HG3 2.432 . 6.000 3.092 3.077 3.115 . 0 0 "[ . 1]" 1
809 1 43 ILE MG 1 44 GLU HA 1.897 . 6.000 2.720 2.673 2.750 . 0 0 "[ . 1]" 1
810 2 43 ILE MG 2 44 GLU HA 1.897 . 6.000 2.722 2.678 2.746 . 0 0 "[ . 1]" 1
811 1 44 GLU HA 1 47 ILE MG 1.431 . 1.751 1.823 1.775 1.861 0.110 2 0 "[ . 1]" 1
812 2 44 GLU HA 2 47 ILE MG 1.431 . 1.751 1.822 1.773 1.858 0.107 2 0 "[ . 1]" 1
813 1 25 LYS HA 1 28 LEU HB2 3.059 . 6.000 3.696 3.635 3.846 . 0 0 "[ . 1]" 1
814 2 25 LYS HA 2 28 LEU HB2 3.059 . 6.000 3.694 3.632 3.844 . 0 0 "[ . 1]" 1
815 1 25 LYS HA 1 28 LEU HB3 2.666 2.282 3.050 3.024 2.988 3.084 0.034 8 0 "[ . 1]" 1
816 2 25 LYS HA 2 28 LEU HB3 2.666 2.282 3.050 3.022 2.981 3.085 0.035 8 0 "[ . 1]" 1
817 1 25 LYS HA 1 25 LYS HG2 2.559 2.245 2.873 2.876 2.800 2.915 0.042 5 0 "[ . 1]" 1
818 2 25 LYS HA 2 25 LYS HG2 2.559 2.245 2.873 2.876 2.798 2.914 0.041 5 0 "[ . 1]" 1
819 1 25 LYS HA 1 25 LYS HG3 2.294 2.003 2.585 2.585 2.531 2.629 0.044 4 0 "[ . 1]" 1
820 2 25 LYS HA 2 25 LYS HG3 2.294 2.003 2.585 2.585 2.530 2.630 0.045 4 0 "[ . 1]" 1
821 1 51 LEU HA 1 54 ARG HB2 3.441 3.007 3.875 3.294 3.133 3.462 . 0 0 "[ . 1]" 1
822 2 51 LEU HA 2 54 ARG HB2 3.441 3.007 3.875 3.294 3.134 3.460 . 0 0 "[ . 1]" 1
823 1 51 LEU HA 1 51 LEU HB2 2.644 2.341 2.947 2.957 2.950 2.963 0.016 5 0 "[ . 1]" 1
824 2 51 LEU HA 2 51 LEU HB2 2.644 2.341 2.947 2.957 2.952 2.964 0.017 5 0 "[ . 1]" 1
825 1 51 LEU HA 1 51 LEU HB3 2.328 2.034 2.622 2.669 2.658 2.684 0.062 4 0 "[ . 1]" 1
826 2 51 LEU HA 2 51 LEU HB3 2.328 2.034 2.622 2.668 2.658 2.682 0.060 1 0 "[ . 1]" 1
827 1 47 ILE HA 1 50 TYR QB 2.107 . 2.371 2.173 2.118 2.230 . 0 0 "[ . 1]" 1
828 2 47 ILE HA 2 50 TYR QB 2.107 . 2.371 2.174 2.116 2.234 . 0 0 "[ . 1]" 1
829 1 47 ILE HA 1 47 ILE HB 2.427 2.033 2.821 2.462 2.431 2.505 . 0 0 "[ . 1]" 1
830 2 47 ILE HA 2 47 ILE HB 2.427 2.033 2.821 2.463 2.431 2.506 . 0 0 "[ . 1]" 1
831 1 51 LEU HA 1 51 LEU HG 2.630 . 6.000 3.381 3.357 3.416 . 0 0 "[ . 1]" 1
832 2 51 LEU HA 2 51 LEU HG 2.630 . 6.000 3.381 3.355 3.413 . 0 0 "[ . 1]" 1
833 1 47 ILE HA 1 47 ILE MG 2.063 . 6.000 3.208 3.202 3.213 . 0 0 "[ . 1]" 1
834 2 47 ILE HA 2 47 ILE MG 2.063 . 6.000 3.208 3.204 3.215 . 0 0 "[ . 1]" 1
835 1 27 ARG HB2 1 27 ARG QD 3.438 . 6.000 2.901 2.824 3.003 . 0 0 "[ . 1]" 1
836 2 27 ARG HB2 2 27 ARG QD 3.438 . 6.000 2.901 2.817 3.005 . 0 0 "[ . 1]" 1
837 1 27 ARG QD 1 27 ARG HG2 2.388 2.103 2.673 2.353 2.321 2.385 . 0 0 "[ . 1]" 1
838 2 27 ARG QD 2 27 ARG HG2 2.388 2.103 2.673 2.353 2.320 2.385 . 0 0 "[ . 1]" 1
839 1 27 ARG HB3 1 27 ARG QD 3.768 3.385 4.151 3.505 3.486 3.524 . 0 0 "[ . 1]" 1
840 2 27 ARG HB3 2 27 ARG QD 3.768 3.385 4.151 3.505 3.483 3.523 . 0 0 "[ . 1]" 1
841 1 27 ARG QD 1 27 ARG HG3 2.233 . 2.519 2.179 2.174 2.182 . 0 0 "[ . 1]" 1
842 2 27 ARG QD 2 27 ARG HG3 2.233 . 2.519 2.178 2.172 2.182 . 0 0 "[ . 1]" 1
843 1 28 LEU MD2 1 31 TYR HB2 2.793 2.353 3.233 3.048 2.987 3.132 . 0 0 "[ . 1]" 1
844 2 28 LEU MD2 2 31 TYR HB2 2.793 2.353 3.233 3.048 2.988 3.137 . 0 0 "[ . 1]" 1
845 1 31 TYR HB3 2 51 LEU MD1 1.820 . 6.000 2.794 2.674 2.946 . 0 0 "[ . 1]" 1
846 1 51 LEU MD1 2 31 TYR HB3 1.820 . 6.000 2.791 2.679 2.941 . 0 0 "[ . 1]" 1
847 1 48 LYS QE 1 51 LEU MD2 2.161 . 6.000 3.565 3.137 4.155 . 0 0 "[ . 1]" 1
848 2 48 LYS QE 2 51 LEU MD2 2.161 . 6.000 3.566 3.138 4.160 . 0 0 "[ . 1]" 1
849 1 13 LYS QE 1 13 LYS QG 2.789 2.469 3.109 2.363 2.199 2.415 0.270 4 0 "[ . 1]" 1
850 2 13 LYS QE 2 13 LYS QG 2.789 2.469 3.109 2.362 2.200 2.413 0.269 4 0 "[ . 1]" 1
851 1 49 GLU QB 1 49 GLU HG2 2.430 2.181 2.679 2.223 2.151 2.271 0.030 2 0 "[ . 1]" 1
852 2 49 GLU QB 2 49 GLU HG2 2.430 2.181 2.679 2.223 2.151 2.269 0.030 2 0 "[ . 1]" 1
853 1 35 ASN HB2 1 37 LEU MD2 2.177 . 6.000 3.014 2.795 3.095 . 0 0 "[ . 1]" 1
854 2 35 ASN HB2 2 37 LEU MD2 2.177 . 6.000 3.014 2.806 3.094 . 0 0 "[ . 1]" 1
855 1 35 ASN HB2 1 37 LEU HB2 2.447 2.093 2.801 2.524 2.480 2.648 . 0 0 "[ . 1]" 1
856 2 35 ASN HB2 2 37 LEU HB2 2.447 2.093 2.801 2.524 2.483 2.644 . 0 0 "[ . 1]" 1
857 1 19 TYR HB3 2 40 THR MG 3.279 . 6.000 4.553 4.464 4.739 . 0 0 "[ . 1]" 1
858 1 40 THR MG 2 19 TYR HB3 3.279 . 6.000 4.548 4.462 4.722 . 0 0 "[ . 1]" 1
859 1 44 GLU HB2 1 44 GLU HG2 3.069 2.714 3.424 3.003 3.000 3.005 . 0 0 "[ . 1]" 1
860 2 44 GLU HB2 2 44 GLU HG2 3.069 2.714 3.424 3.003 3.001 3.005 . 0 0 "[ . 1]" 1
861 1 20 MET HB3 1 20 MET HG2 2.559 2.199 2.919 2.500 2.258 2.549 . 0 0 "[ . 1]" 1
862 2 20 MET HB3 2 20 MET HG2 2.559 2.199 2.919 2.499 2.255 2.546 . 0 0 "[ . 1]" 1
863 1 20 MET HG2 1 25 LYS HD3 2.520 2.139 2.901 2.732 2.643 2.812 . 0 0 "[ . 1]" 1
864 2 20 MET HG2 2 25 LYS HD3 2.520 2.139 2.901 2.735 2.653 2.812 . 0 0 "[ . 1]" 1
865 1 54 ARG HD2 1 54 ARG HG3 2.552 2.220 2.884 2.348 2.323 2.393 . 0 0 "[ . 1]" 1
866 2 54 ARG HD2 2 54 ARG HG3 2.552 2.220 2.884 2.348 2.321 2.390 . 0 0 "[ . 1]" 1
867 1 25 LYS HD3 1 25 LYS HE2 2.819 2.493 3.145 3.018 3.014 3.023 . 0 0 "[ . 1]" 1
868 2 25 LYS HD3 2 25 LYS HE2 2.819 2.493 3.145 3.019 3.015 3.022 . 0 0 "[ . 1]" 1
869 1 25 LYS HE2 1 25 LYS HG2 2.386 2.012 2.760 2.330 2.275 2.365 . 0 0 "[ . 1]" 1
870 2 25 LYS HE2 2 25 LYS HG2 2.386 2.012 2.760 2.326 2.267 2.361 . 0 0 "[ . 1]" 1
871 1 38 GLN QB 1 38 GLN HG2 2.350 2.143 2.557 2.320 2.303 2.343 . 0 0 "[ . 1]" 1
872 2 38 GLN QB 2 38 GLN HG2 2.350 2.143 2.557 2.321 2.301 2.342 . 0 0 "[ . 1]" 1
873 1 52 GLN HB3 1 52 GLN HG2 2.909 . 6.000 2.355 2.302 2.398 . 0 0 "[ . 1]" 1
874 2 52 GLN HB3 2 52 GLN HG2 2.909 . 6.000 2.355 2.305 2.397 . 0 0 "[ . 1]" 1
875 1 49 GLU QB 1 49 GLU HG3 2.425 2.183 2.667 2.371 2.126 2.481 0.057 10 0 "[ . 1]" 1
876 2 49 GLU QB 2 49 GLU HG3 2.425 2.183 2.667 2.370 2.126 2.481 0.057 10 0 "[ . 1]" 1
877 1 54 ARG HB2 1 54 ARG HD3 1.994 . 2.219 2.182 2.124 2.221 0.002 4 0 "[ . 1]" 1
878 2 54 ARG HB2 2 54 ARG HD3 1.994 . 2.219 2.182 2.127 2.222 0.003 4 0 "[ . 1]" 1
879 1 44 GLU HG3 2 18 ILE HG13 2.727 . 6.000 5.630 5.577 5.734 . 0 0 "[ . 1]" 1
880 1 18 ILE HG13 2 44 GLU HG3 2.727 . 6.000 5.636 5.584 5.737 . 0 0 "[ . 1]" 1
881 1 25 LYS QB 1 25 LYS HG2 2.382 2.078 2.686 2.383 2.370 2.395 . 0 0 "[ . 1]" 1
882 2 25 LYS QB 2 25 LYS HG2 2.382 2.078 2.686 2.383 2.370 2.396 . 0 0 "[ . 1]" 1
883 1 25 LYS QB 1 25 LYS HG3 2.187 . 2.475 2.289 2.272 2.303 . 0 0 "[ . 1]" 1
884 2 25 LYS QB 2 25 LYS HG3 2.187 . 2.475 2.289 2.275 2.304 . 0 0 "[ . 1]" 1
885 1 35 ASN HB3 1 37 LEU MD2 2.538 . 6.000 3.446 3.225 3.561 . 0 0 "[ . 1]" 1
886 2 35 ASN HB3 2 37 LEU MD2 2.538 . 6.000 3.447 3.233 3.555 . 0 0 "[ . 1]" 1
887 1 51 LEU HB3 1 51 LEU HG 2.383 . 2.793 2.226 2.220 2.235 . 0 0 "[ . 1]" 1
888 2 51 LEU HB3 2 51 LEU HG 2.383 . 2.793 2.226 2.222 2.235 . 0 0 "[ . 1]" 1
889 1 20 MET ME 1 25 LYS HG2 2.926 . 6.000 3.670 3.566 3.737 . 0 0 "[ . 1]" 1
890 2 20 MET ME 2 25 LYS HG2 2.926 . 6.000 3.671 3.571 3.739 . 0 0 "[ . 1]" 1
891 1 25 LYS HD2 1 25 LYS HG2 2.344 2.076 2.612 2.631 2.622 2.637 0.025 2 0 "[ . 1]" 1
892 2 25 LYS HD2 2 25 LYS HG2 2.344 2.076 2.612 2.631 2.619 2.638 0.026 10 0 "[ . 1]" 1
893 1 24 LEU HG 2 47 ILE MG 1.952 . 6.000 2.949 2.485 3.221 . 0 0 "[ . 1]" 1
894 1 47 ILE MG 2 24 LEU HG 1.952 . 6.000 2.949 2.484 3.219 . 0 0 "[ . 1]" 1
895 1 30 VAL MG2 1 33 ALA MB 2.181 . 6.000 3.775 3.636 3.862 . 0 0 "[ . 1]" 1
896 2 30 VAL MG2 2 33 ALA MB 2.181 . 6.000 3.775 3.629 3.861 . 0 0 "[ . 1]" 1
897 1 29 LYS QG 1 39 LEU MD2 2.187 . 2.628 2.259 2.035 2.533 . 0 0 "[ . 1]" 1
898 2 29 LYS QG 2 39 LEU MD2 2.187 . 2.628 2.259 2.041 2.535 . 0 0 "[ . 1]" 1
899 1 18 ILE MD 1 18 ILE HG12 1.744 . 2.081 2.109 2.106 2.111 0.030 4 0 "[ . 1]" 1
900 2 18 ILE MD 2 18 ILE HG12 1.744 . 2.081 2.108 2.106 2.110 0.029 4 0 "[ . 1]" 1
901 1 51 LEU HB3 1 51 LEU MD2 2.191 . 6.000 3.024 3.007 3.037 . 0 0 "[ . 1]" 1
902 2 51 LEU HB3 2 51 LEU MD2 2.191 . 6.000 3.023 3.004 3.039 . 0 0 "[ . 1]" 1
903 1 28 LEU MD1 2 51 LEU MD1 1.768 . 6.000 4.142 4.010 4.253 . 0 0 "[ . 1]" 1
904 1 51 LEU MD1 2 28 LEU MD1 1.768 . 6.000 4.140 4.015 4.245 . 0 0 "[ . 1]" 1
905 1 19 TYR QE 2 14 ALA HA 3.588 . 6.000 5.972 5.838 6.043 0.043 2 0 "[ . 1]" 1
906 1 14 ALA HA 2 19 TYR QE 3.588 . 6.000 5.973 5.818 6.046 0.046 2 0 "[ . 1]" 1
907 1 50 TYR QE 1 51 LEU MD2 2.909 . 6.000 4.367 4.102 4.454 . 0 0 "[ . 1]" 1
908 2 50 TYR QE 2 51 LEU MD2 2.909 . 6.000 4.367 4.107 4.455 . 0 0 "[ . 1]" 1
909 1 50 TYR QE 2 28 LEU MD1 2.580 . 6.000 4.002 3.897 4.102 . 0 0 "[ . 1]" 1
910 1 28 LEU MD1 2 50 TYR QE 2.580 . 6.000 4.004 3.908 4.096 . 0 0 "[ . 1]" 1
911 1 50 TYR QE 2 37 LEU MD2 2.986 . 6.000 4.102 3.921 4.236 . 0 0 "[ . 1]" 1
912 1 37 LEU MD2 2 50 TYR QE 2.986 . 6.000 4.104 3.924 4.241 . 0 0 "[ . 1]" 1
913 1 50 TYR QE 2 28 LEU HA 4.120 3.247 4.993 4.982 4.828 5.051 0.058 3 0 "[ . 1]" 1
914 1 28 LEU HA 2 50 TYR QE 4.120 3.247 4.993 4.982 4.830 5.053 0.060 3 0 "[ . 1]" 1
915 1 19 TYR HA 1 19 TYR QE 4.089 3.488 4.690 4.540 4.527 4.554 . 0 0 "[ . 1]" 1
916 2 19 TYR HA 2 19 TYR QE 4.089 3.488 4.690 4.539 4.526 4.555 . 0 0 "[ . 1]" 1
917 1 19 TYR QE 2 15 VAL HA 3.766 3.146 4.386 4.191 4.074 4.325 . 0 0 "[ . 1]" 1
918 1 15 VAL HA 2 19 TYR QE 3.766 3.146 4.386 4.192 4.073 4.320 . 0 0 "[ . 1]" 1
919 1 18 ILE HA 1 19 TYR QE 5.110 4.121 6.099 5.010 4.737 5.201 . 0 0 "[ . 1]" 1
920 2 18 ILE HA 2 19 TYR QE 5.110 4.121 6.099 5.013 4.729 5.197 . 0 0 "[ . 1]" 1
921 1 19 TYR HB3 1 19 TYR QE 4.291 3.725 4.857 4.459 4.452 4.465 . 0 0 "[ . 1]" 1
922 2 19 TYR HB3 2 19 TYR QE 4.291 3.725 4.857 4.459 4.453 4.464 . 0 0 "[ . 1]" 1
923 1 50 TYR QD 1 54 ARG HD2 4.573 3.935 5.211 4.962 4.818 5.153 . 0 0 "[ . 1]" 1
924 2 50 TYR QD 2 54 ARG HD2 4.573 3.935 5.211 4.962 4.821 5.155 . 0 0 "[ . 1]" 1
925 1 50 TYR QD 2 49 GLU HG3 5.064 4.096 6.032 4.821 3.952 5.285 0.144 10 0 "[ . 1]" 1
926 1 49 GLU HG3 2 50 TYR QD 5.064 4.096 6.032 4.822 3.953 5.281 0.143 10 0 "[ . 1]" 1
927 1 19 TYR QE 2 13 LYS QG 4.356 . 6.000 5.841 5.578 6.132 0.132 3 0 "[ . 1]" 1
928 1 13 LYS QG 2 19 TYR QE 4.356 . 6.000 5.838 5.579 6.135 0.135 3 0 "[ . 1]" 1
929 1 50 TYR QD 1 54 ARG HD3 3.481 2.919 4.043 3.635 3.486 3.719 . 0 0 "[ . 1]" 1
930 2 50 TYR QD 2 54 ARG HD3 3.481 2.919 4.043 3.635 3.491 3.717 . 0 0 "[ . 1]" 1
931 1 50 TYR QD 1 51 LEU HB3 4.362 . 6.000 5.527 5.485 5.602 . 0 0 "[ . 1]" 1
932 2 50 TYR QD 2 51 LEU HB3 4.362 . 6.000 5.526 5.481 5.600 . 0 0 "[ . 1]" 1
933 1 31 TYR QE 1 35 ASN HB2 4.263 3.668 4.858 4.335 4.231 4.501 . 0 0 "[ . 1]" 1
934 2 31 TYR QE 2 35 ASN HB2 4.263 3.668 4.858 4.334 4.225 4.500 . 0 0 "[ . 1]" 1
935 1 19 TYR QD 2 13 LYS QG 4.519 3.841 5.197 4.576 4.226 5.014 . 0 0 "[ . 1]" 1
936 1 13 LYS QG 2 19 TYR QD 4.519 3.841 5.197 4.575 4.228 5.008 . 0 0 "[ . 1]" 1
937 1 16 PHE QR 2 40 THR HB 5.770 4.920 6.620 5.260 5.212 5.337 . 0 0 "[ . 1]" 1
938 1 40 THR HB 2 16 PHE QR 5.770 4.920 6.620 5.259 5.214 5.333 . 0 0 "[ . 1]" 1
939 1 31 TYR QD 2 51 LEU HA 3.845 . 6.000 4.903 4.805 4.995 . 0 0 "[ . 1]" 1
940 1 51 LEU HA 2 31 TYR QD 3.845 . 6.000 4.902 4.808 4.991 . 0 0 "[ . 1]" 1
941 1 28 LEU MD1 1 31 TYR QD 2.677 . 3.375 3.321 3.167 3.414 0.039 8 0 "[ . 1]" 1
942 2 28 LEU MD1 2 31 TYR QD 2.677 . 3.375 3.322 3.164 3.414 0.039 8 0 "[ . 1]" 1
943 1 16 PHE QR 2 39 LEU HG 3.469 . 6.000 2.218 2.120 2.298 . 0 0 "[ . 1]" 1
944 1 39 LEU HG 2 16 PHE QR 3.469 . 6.000 2.219 2.119 2.298 . 0 0 "[ . 1]" 1
945 1 16 PHE QR 2 28 LEU MD1 2.082 . 6.000 3.788 3.745 3.835 . 0 0 "[ . 1]" 1
946 1 28 LEU MD1 2 16 PHE QR 2.082 . 6.000 3.786 3.750 3.831 . 0 0 "[ . 1]" 1
947 1 48 LYS HA 1 50 TYR QD 4.863 3.995 5.731 5.790 5.740 5.830 0.099 8 0 "[ . 1]" 1
948 2 48 LYS HA 2 50 TYR QD 4.863 3.995 5.731 5.789 5.741 5.832 0.101 8 0 "[ . 1]" 1
949 1 50 TYR QB 1 50 TYR QE 4.509 3.815 5.203 3.915 3.907 3.925 . 0 0 "[ . 1]" 1
950 2 50 TYR QB 2 50 TYR QE 4.509 3.815 5.203 3.916 3.908 3.924 . 0 0 "[ . 1]" 1
951 1 19 TYR QE 2 13 LYS QE 3.621 . 6.000 5.079 4.262 5.633 . 0 0 "[ . 1]" 1
952 1 13 LYS QE 2 19 TYR QE 3.621 . 6.000 5.077 4.274 5.634 . 0 0 "[ . 1]" 1
953 1 50 TYR QE 1 54 ARG HD3 3.804 2.878 4.730 2.811 2.739 2.881 0.139 5 0 "[ . 1]" 1
954 2 50 TYR QE 2 54 ARG HD3 3.804 2.878 4.730 2.811 2.729 2.880 0.149 5 0 "[ . 1]" 1
955 1 31 TYR QE 2 50 TYR QD 3.662 3.567 5.067 4.946 4.804 5.088 0.021 4 0 "[ . 1]" 1
956 1 50 TYR QD 2 31 TYR QE 3.662 3.567 5.067 4.947 4.803 5.092 0.025 4 0 "[ . 1]" 1
957 1 31 TYR QD 2 50 TYR QD . 2.888 5.540 4.825 4.634 5.012 . 0 0 "[ . 1]" 1
958 1 50 TYR QD 2 31 TYR QD . 2.888 5.540 4.825 4.625 5.021 . 0 0 "[ . 1]" 1
959 1 19 TYR HA 2 14 ALA HA 3.900 . 6.000 5.107 5.038 5.207 . 0 0 "[ . 1]" 1
960 1 14 ALA HA 2 19 TYR HA 3.900 . 6.000 5.109 5.071 5.216 . 0 0 "[ . 1]" 1
961 1 18 ILE HA 1 19 TYR HA 4.263 3.702 4.824 4.406 4.387 4.424 . 0 0 "[ . 1]" 1
962 2 18 ILE HA 2 19 TYR HA 4.263 3.702 4.824 4.407 4.387 4.420 . 0 0 "[ . 1]" 1
963 1 14 ALA HA 2 22 LYS HA 4.501 . 6.000 5.310 5.095 5.479 . 0 0 "[ . 1]" 1
964 1 22 LYS HA 2 14 ALA HA 4.501 . 6.000 5.307 5.086 5.500 . 0 0 "[ . 1]" 1
965 1 26 THR HB 1 27 ARG HA 4.875 4.222 5.528 4.577 4.487 4.666 . 0 0 "[ . 1]" 1
966 2 26 THR HB 2 27 ARG HA 4.875 4.222 5.528 4.577 4.490 4.671 . 0 0 "[ . 1]" 1
967 1 28 LEU HA 1 31 TYR HA 4.778 4.284 5.272 4.818 4.738 4.883 . 0 0 "[ . 1]" 1
968 2 28 LEU HA 2 31 TYR HA 4.778 4.284 5.272 4.818 4.737 4.879 . 0 0 "[ . 1]" 1
969 1 39 LEU HA 1 40 THR HA 4.131 3.555 4.707 4.778 4.769 4.791 0.084 4 0 "[ . 1]" 1
970 2 39 LEU HA 2 40 THR HA 4.131 3.555 4.707 4.779 4.769 4.795 0.088 4 0 "[ . 1]" 1
971 1 30 VAL HA 1 33 ALA HA 4.572 3.970 5.174 5.009 4.865 5.134 . 0 0 "[ . 1]" 1
972 2 30 VAL HA 2 33 ALA HA 4.572 3.970 5.174 5.010 4.869 5.139 . 0 0 "[ . 1]" 1
973 1 41 GLN HA 1 44 GLU HA 5.511 4.832 6.190 5.495 5.356 5.556 . 0 0 "[ . 1]" 1
974 2 41 GLN HA 2 44 GLU HA 5.511 4.832 6.190 5.494 5.351 5.557 . 0 0 "[ . 1]" 1
975 1 34 LYS HA 1 35 ASN HA 4.306 3.797 4.815 4.583 4.573 4.592 . 0 0 "[ . 1]" 1
976 2 34 LYS HA 2 35 ASN HA 4.306 3.797 4.815 4.582 4.573 4.588 . 0 0 "[ . 1]" 1
977 1 19 TYR HA 2 15 VAL HB 4.898 4.480 5.471 5.186 5.137 5.240 . 0 0 "[ . 1]" 1
978 1 15 VAL HB 2 19 TYR HA 4.898 4.480 5.471 5.189 5.135 5.252 . 0 0 "[ . 1]" 1
979 1 19 TYR HA 2 13 LYS QB 4.995 4.337 5.653 4.279 4.229 4.383 0.108 5 0 "[ . 1]" 1
980 1 13 LYS QB 2 19 TYR HA 4.995 4.337 5.653 4.278 4.229 4.379 0.108 5 0 "[ . 1]" 1
981 1 19 TYR HA 2 40 THR MG 4.030 3.097 4.435 4.073 4.005 4.205 . 0 0 "[ . 1]" 1
982 1 40 THR MG 2 19 TYR HA 4.030 3.097 4.435 4.071 4.008 4.186 . 0 0 "[ . 1]" 1
983 1 14 ALA HA 1 15 VAL MG2 3.026 2.405 3.647 3.227 3.185 3.252 . 0 0 "[ . 1]" 1
984 2 14 ALA HA 2 15 VAL MG2 3.026 2.405 3.647 3.226 3.186 3.250 . 0 0 "[ . 1]" 1
985 1 18 ILE MD 1 19 TYR HA 4.585 3.661 5.509 5.007 4.902 5.059 . 0 0 "[ . 1]" 1
986 2 18 ILE MD 2 19 TYR HA 4.585 3.661 5.509 5.009 4.909 5.065 . 0 0 "[ . 1]" 1
987 1 16 PHE HA 1 16 PHE HB2 2.827 2.450 3.204 2.628 2.611 2.649 . 0 0 "[ . 1]" 1
988 2 16 PHE HA 2 16 PHE HB2 2.827 2.450 3.204 2.627 2.608 2.650 . 0 0 "[ . 1]" 1
989 1 16 PHE HA 1 16 PHE HB3 3.294 2.898 3.690 2.995 2.987 3.001 . 0 0 "[ . 1]" 1
990 2 16 PHE HA 2 16 PHE HB3 3.294 2.898 3.690 2.995 2.987 3.001 . 0 0 "[ . 1]" 1
991 1 20 MET HG2 2 16 PHE HA 4.971 4.337 5.605 5.295 5.163 5.695 0.090 8 0 "[ . 1]" 1
992 1 16 PHE HA 2 20 MET HG2 4.971 4.337 5.605 5.296 5.164 5.700 0.095 8 0 "[ . 1]" 1
993 1 35 ASN HB3 1 37 LEU HA 4.244 3.760 4.728 4.750 4.720 4.769 0.041 9 0 "[ . 1]" 1
994 2 35 ASN HB3 2 37 LEU HA 4.244 3.760 4.728 4.751 4.721 4.773 0.045 5 0 "[ . 1]" 1
995 1 15 VAL HB 1 16 PHE HA 4.631 3.762 5.500 4.146 4.117 4.187 . 0 0 "[ . 1]" 1
996 2 15 VAL HB 2 16 PHE HA 4.631 3.762 5.500 4.143 4.119 4.185 . 0 0 "[ . 1]" 1
997 1 35 ASN HA 1 35 ASN HB3 2.764 2.429 3.099 2.514 2.500 2.531 . 0 0 "[ . 1]" 1
998 2 35 ASN HA 2 35 ASN HB3 2.764 2.429 3.099 2.513 2.498 2.529 . 0 0 "[ . 1]" 1
999 1 34 LYS QB 1 35 ASN HA 5.339 . 6.000 4.291 4.234 4.351 . 0 0 "[ . 1]" 1
1000 2 34 LYS QB 2 35 ASN HA 5.339 . 6.000 4.291 4.240 4.347 . 0 0 "[ . 1]" 1
1001 1 35 ASN HA 1 37 LEU MD1 4.484 3.612 5.356 3.936 3.834 4.050 . 0 0 "[ . 1]" 1
1002 2 35 ASN HA 2 37 LEU MD1 4.484 3.612 5.356 3.935 3.828 4.051 . 0 0 "[ . 1]" 1
1003 1 35 ASN HA 1 36 ASN HB2 3.776 3.251 4.301 4.220 4.149 4.274 . 0 0 "[ . 1]" 1
1004 2 35 ASN HA 2 36 ASN HB2 3.776 3.251 4.301 4.222 4.151 4.277 . 0 0 "[ . 1]" 1
1005 1 13 LYS HA 2 21 ASP HB2 5.945 5.293 6.597 5.225 5.117 5.384 0.176 4 0 "[ . 1]" 1
1006 1 21 ASP HB2 2 13 LYS HA 5.945 5.293 6.597 5.223 5.120 5.377 0.173 4 0 "[ . 1]" 1
1007 1 13 LYS QE 1 14 ALA HA 4.937 . 6.000 5.747 5.171 6.076 0.076 6 0 "[ . 1]" 1
1008 2 13 LYS QE 2 14 ALA HA 4.937 . 6.000 5.745 5.158 6.071 0.071 6 0 "[ . 1]" 1
1009 1 24 LEU HA 1 25 LYS HA 5.095 4.220 5.970 4.807 4.767 4.889 . 0 0 "[ . 1]" 1
1010 2 24 LEU HA 2 25 LYS HA 5.095 4.220 5.970 4.807 4.768 4.890 . 0 0 "[ . 1]" 1
1011 1 44 GLU HA 1 45 GLU HA 4.492 3.791 5.193 4.770 4.725 4.812 . 0 0 "[ . 1]" 1
1012 2 44 GLU HA 2 45 GLU HA 4.492 3.791 5.193 4.770 4.724 4.814 . 0 0 "[ . 1]" 1
1013 1 40 THR HA 1 40 THR HB 2.602 2.287 2.917 3.008 3.002 3.013 0.096 8 0 "[ . 1]" 1
1014 2 40 THR HA 2 40 THR HB 2.602 2.287 2.917 3.008 3.003 3.014 0.097 8 0 "[ . 1]" 1
1015 1 15 VAL HA 1 16 PHE HB3 4.008 . 6.000 4.756 4.692 4.826 . 0 0 "[ . 1]" 1
1016 2 15 VAL HA 2 16 PHE HB3 4.008 . 6.000 4.756 4.690 4.820 . 0 0 "[ . 1]" 1
1017 1 55 ASN HA 1 55 ASN HB3 2.301 2.084 2.518 2.324 2.316 2.331 . 0 0 "[ . 1]" 1
1018 2 55 ASN HA 2 55 ASN HB3 2.301 2.084 2.518 2.324 2.313 2.332 . 0 0 "[ . 1]" 1
1019 1 32 CYS HB3 1 38 GLN HA 4.686 3.750 5.622 3.742 3.714 3.786 0.036 5 0 "[ . 1]" 1
1020 2 32 CYS HB3 2 38 GLN HA 4.686 3.750 5.622 3.743 3.716 3.786 0.034 5 0 "[ . 1]" 1
1021 1 28 LEU HA 1 31 TYR HB3 2.445 2.087 2.803 2.301 2.172 2.386 . 0 0 "[ . 1]" 1
1022 2 28 LEU HA 2 31 TYR HB3 2.445 2.087 2.803 2.300 2.176 2.380 . 0 0 "[ . 1]" 1
1023 1 36 ASN HA 1 36 ASN HB2 2.443 . 6.000 3.003 2.989 3.010 . 0 0 "[ . 1]" 1
1024 2 36 ASN HA 2 36 ASN HB2 2.443 . 6.000 3.003 2.992 3.011 . 0 0 "[ . 1]" 1
1025 1 41 GLN HA 1 45 GLU HG2 4.740 3.945 5.535 4.141 3.924 4.621 0.021 3 0 "[ . 1]" 1
1026 2 41 GLN HA 2 45 GLU HG2 4.740 3.945 5.535 4.135 3.918 4.630 0.027 3 0 "[ . 1]" 1
1027 1 38 GLN HA 1 39 LEU MD2 4.378 3.672 5.084 4.472 4.351 4.630 . 0 0 "[ . 1]" 1
1028 2 38 GLN HA 2 39 LEU MD2 4.378 3.672 5.084 4.473 4.359 4.625 . 0 0 "[ . 1]" 1
1029 1 50 TYR HA 1 53 LYS HB3 3.102 2.673 3.531 2.697 2.578 2.853 0.095 6 0 "[ . 1]" 1
1030 2 50 TYR HA 2 53 LYS HB3 3.102 2.673 3.531 2.697 2.578 2.857 0.095 6 0 "[ . 1]" 1
1031 1 40 THR HA 1 43 ILE HA 5.135 4.471 5.799 5.377 5.338 5.407 . 0 0 "[ . 1]" 1
1032 2 40 THR HA 2 43 ILE HA 5.135 4.471 5.799 5.380 5.341 5.410 . 0 0 "[ . 1]" 1
1033 1 45 GLU HA 1 48 LYS QE 5.528 5.014 6.042 5.481 5.004 5.778 0.010 6 0 "[ . 1]" 1
1034 2 45 GLU HA 2 48 LYS QE 5.528 5.014 6.042 5.482 5.001 5.778 0.013 6 0 "[ . 1]" 1
1035 1 32 CYS HA 1 35 ASN HB2 4.042 3.402 4.682 3.368 3.329 3.405 0.073 5 0 "[ . 1]" 1
1036 2 32 CYS HA 2 35 ASN HB2 4.042 3.402 4.682 3.366 3.330 3.402 0.072 5 0 "[ . 1]" 1
1037 1 25 LYS HA 1 25 LYS HE2 5.284 4.664 5.904 5.122 4.988 5.183 . 0 0 "[ . 1]" 1
1038 2 25 LYS HA 2 25 LYS HE2 5.284 4.664 5.904 5.119 4.981 5.176 . 0 0 "[ . 1]" 1
1039 1 43 ILE HA 1 43 ILE HB 2.461 . 6.000 2.966 2.959 2.970 . 0 0 "[ . 1]" 1
1040 2 43 ILE HA 2 43 ILE HB 2.461 . 6.000 2.966 2.960 2.971 . 0 0 "[ . 1]" 1
1041 1 45 GLU HA 1 48 LYS QG 4.878 . 6.000 3.613 3.528 3.686 . 0 0 "[ . 1]" 1
1042 2 45 GLU HA 2 48 LYS QG 4.878 . 6.000 3.613 3.521 3.681 . 0 0 "[ . 1]" 1
1043 1 29 LYS HA 1 30 VAL MG2 4.002 3.309 4.695 4.820 4.803 4.832 0.137 9 0 "[ . 1]" 1
1044 2 29 LYS HA 2 30 VAL MG2 4.002 3.309 4.695 4.821 4.807 4.831 0.136 4 0 "[ . 1]" 1
1045 1 24 LEU HA 2 51 LEU MD2 2.967 . 6.000 4.098 4.014 4.288 . 0 0 "[ . 1]" 1
1046 1 51 LEU MD2 2 24 LEU HA 2.967 . 6.000 4.097 4.006 4.278 . 0 0 "[ . 1]" 1
1047 1 25 LYS HG2 1 26 THR HA 3.958 3.275 4.641 4.127 3.997 4.348 . 0 0 "[ . 1]" 1
1048 2 25 LYS HG2 2 26 THR HA 3.958 3.275 4.641 4.127 3.993 4.346 . 0 0 "[ . 1]" 1
1049 1 32 CYS HB2 1 39 LEU MD2 2.517 . 3.188 2.383 2.308 2.443 . 0 0 "[ . 1]" 1
1050 2 32 CYS HB2 2 39 LEU MD2 2.517 . 3.188 2.384 2.310 2.443 . 0 0 "[ . 1]" 1
1051 1 21 ASP HB2 1 24 LEU HB3 2.902 . 6.000 2.524 2.287 2.747 . 0 0 "[ . 1]" 1
1052 2 21 ASP HB2 2 24 LEU HB3 2.902 . 6.000 2.523 2.293 2.747 . 0 0 "[ . 1]" 1
1053 1 21 ASP HB2 1 24 LEU QD 3.453 2.765 4.141 2.991 2.685 3.235 0.080 4 0 "[ . 1]" 1
1054 2 21 ASP HB2 2 24 LEU QD 3.453 2.765 4.141 2.987 2.678 3.233 0.087 4 0 "[ . 1]" 1
1055 1 20 MET HB3 1 20 MET HG3 3.364 2.897 3.831 3.001 2.956 3.011 . 0 0 "[ . 1]" 1
1056 2 20 MET HB3 2 20 MET HG3 3.364 2.897 3.831 3.002 2.954 3.012 . 0 0 "[ . 1]" 1
1057 1 19 TYR HB3 2 13 LYS QB 4.159 . 6.000 2.790 2.607 2.969 . 0 0 "[ . 1]" 1
1058 1 13 LYS QB 2 19 TYR HB3 4.159 . 6.000 2.790 2.603 2.962 . 0 0 "[ . 1]" 1
1059 1 35 ASN HB2 1 37 LEU MD1 2.782 2.146 3.418 2.340 2.147 2.448 . 0 0 "[ . 1]" 1
1060 2 35 ASN HB2 2 37 LEU MD1 2.782 2.146 3.418 2.339 2.149 2.447 . 0 0 "[ . 1]" 1
1061 1 19 TYR HB3 2 15 VAL MG1 3.962 3.238 4.686 4.677 4.625 4.708 0.022 8 0 "[ . 1]" 1
1062 1 15 VAL MG1 2 19 TYR HB3 3.962 3.238 4.686 4.678 4.621 4.709 0.023 10 0 "[ . 1]" 1
1063 1 19 TYR HB3 2 15 VAL MG2 4.527 3.541 5.513 4.187 4.154 4.261 . 0 0 "[ . 1]" 1
1064 1 15 VAL MG2 2 19 TYR HB3 4.527 3.541 5.513 4.191 4.159 4.252 . 0 0 "[ . 1]" 1
1065 1 25 LYS HE2 1 25 LYS HG3 4.071 3.569 4.573 3.526 3.504 3.543 0.065 10 0 "[ . 1]" 1
1066 2 25 LYS HE2 2 25 LYS HG3 4.071 3.569 4.573 3.525 3.506 3.540 0.063 10 0 "[ . 1]" 1
1067 1 18 ILE HG13 1 20 MET HG3 5.746 4.787 6.705 5.058 4.916 5.277 . 0 0 "[ . 1]" 1
1068 2 18 ILE HG13 2 20 MET HG3 5.746 4.787 6.705 5.055 4.915 5.262 . 0 0 "[ . 1]" 1
1069 1 27 ARG HG2 2 51 LEU MD1 4.568 3.722 5.414 4.205 4.103 4.330 . 0 0 "[ . 1]" 1
1070 1 51 LEU MD1 2 27 ARG HG2 4.568 3.722 5.414 4.208 4.089 4.328 . 0 0 "[ . 1]" 1
1071 1 39 LEU HG 1 43 ILE MD 3.370 2.636 4.104 4.148 4.125 4.182 0.078 7 0 "[ . 1]" 1
1072 2 39 LEU HG 2 43 ILE MD 3.370 2.636 4.104 4.149 4.124 4.188 0.084 7 0 "[ . 1]" 1
1073 1 40 THR MG 2 18 ILE HG13 2.397 . 2.945 2.941 2.886 2.973 0.028 7 0 "[ . 1]" 1
1074 1 18 ILE HG13 2 40 THR MG 2.397 . 2.945 2.945 2.889 2.976 0.031 7 0 "[ . 1]" 1
1075 1 26 THR MG 1 30 VAL MG1 2.718 . 6.000 4.936 4.823 5.067 . 0 0 "[ . 1]" 1
1076 2 26 THR MG 2 30 VAL MG1 2.718 . 6.000 4.936 4.826 5.069 . 0 0 "[ . 1]" 1
1077 1 21 ASP H 1 21 ASP HA 2.604 2.304 2.904 2.795 2.768 2.859 . 0 0 "[ . 1]" 1
1078 2 21 ASP H 2 21 ASP HA 2.604 2.304 2.904 2.795 2.770 2.860 . 0 0 "[ . 1]" 1
1079 1 21 ASP H 2 13 LYS QG 6.190 5.180 7.200 7.009 6.837 7.210 0.010 2 0 "[ . 1]" 1
1080 1 13 LYS QG 2 21 ASP H 6.190 5.180 7.200 7.011 6.832 7.213 0.013 2 0 "[ . 1]" 1
1081 1 20 MET HA 1 21 ASP H 2.442 2.160 2.724 2.427 2.359 2.637 . 0 0 "[ . 1]" 1
1082 2 20 MET HA 2 21 ASP H 2.442 2.160 2.724 2.428 2.360 2.637 . 0 0 "[ . 1]" 1
1083 1 21 ASP H 1 21 ASP HB2 2.266 2.004 2.528 2.315 2.270 2.406 . 0 0 "[ . 1]" 1
1084 2 21 ASP H 2 21 ASP HB2 2.266 2.004 2.528 2.311 2.262 2.397 . 0 0 "[ . 1]" 1
1085 1 21 ASP H 1 21 ASP HB3 3.143 2.870 3.416 3.554 3.535 3.573 0.157 4 0 "[ . 1]" 1
1086 2 21 ASP H 2 21 ASP HB3 3.143 2.870 3.416 3.552 3.530 3.568 0.152 4 0 "[ . 1]" 1
1087 1 20 MET HB2 1 21 ASP H 2.598 2.267 2.929 2.554 2.344 2.644 . 0 0 "[ . 1]" 1
1088 2 20 MET HB2 2 21 ASP H 2.598 2.267 2.929 2.556 2.342 2.650 . 0 0 "[ . 1]" 1
1089 1 20 MET HB3 1 21 ASP H 3.883 3.505 4.261 3.875 3.805 3.925 . 0 0 "[ . 1]" 1
1090 2 20 MET HB3 2 21 ASP H 3.883 3.505 4.261 3.876 3.801 3.932 . 0 0 "[ . 1]" 1
1091 1 38 GLN HA 1 39 LEU H 2.185 . 2.433 2.185 2.174 2.195 . 0 0 "[ . 1]" 1
1092 2 38 GLN HA 2 39 LEU H 2.185 . 2.433 2.186 2.166 2.202 . 0 0 "[ . 1]" 1
1093 1 39 LEU H 1 39 LEU HA 2.604 2.272 2.936 2.730 2.720 2.739 . 0 0 "[ . 1]" 1
1094 2 39 LEU H 2 39 LEU HA 2.604 2.272 2.936 2.729 2.718 2.737 . 0 0 "[ . 1]" 1
1095 1 38 GLN HG3 1 39 LEU H 3.973 . 6.000 5.042 5.004 5.072 . 0 0 "[ . 1]" 1
1096 2 38 GLN HG3 2 39 LEU H 3.973 . 6.000 5.044 5.009 5.077 . 0 0 "[ . 1]" 1
1097 1 38 GLN QB 1 39 LEU H 3.192 2.836 3.548 3.065 3.021 3.105 . 0 0 "[ . 1]" 1
1098 2 38 GLN QB 2 39 LEU H 3.192 2.836 3.548 3.067 3.007 3.117 . 0 0 "[ . 1]" 1
1099 1 39 LEU H 1 39 LEU HB2 2.298 . 2.616 2.080 2.066 2.093 . 0 0 "[ . 1]" 1
1100 2 39 LEU H 2 39 LEU HB2 2.298 . 2.616 2.080 2.065 2.089 . 0 0 "[ . 1]" 1
1101 1 39 LEU H 1 39 LEU HB3 3.285 2.973 3.597 3.296 3.221 3.349 . 0 0 "[ . 1]" 1
1102 2 39 LEU H 2 39 LEU HB3 3.285 2.973 3.597 3.297 3.222 3.347 . 0 0 "[ . 1]" 1
1103 1 39 LEU H 1 39 LEU MD1 3.190 . 6.000 4.038 4.013 4.068 . 0 0 "[ . 1]" 1
1104 2 39 LEU H 2 39 LEU MD1 3.190 . 6.000 4.038 4.006 4.067 . 0 0 "[ . 1]" 1
1105 1 39 LEU H 1 39 LEU MD2 2.853 2.355 3.351 2.986 2.870 3.134 . 0 0 "[ . 1]" 1
1106 2 39 LEU H 2 39 LEU MD2 2.853 2.355 3.351 2.984 2.868 3.126 . 0 0 "[ . 1]" 1
1107 1 31 TYR HA 1 32 CYS H 3.370 2.964 3.776 3.517 3.514 3.521 . 0 0 "[ . 1]" 1
1108 2 31 TYR HA 2 32 CYS H 3.370 2.964 3.776 3.516 3.514 3.520 . 0 0 "[ . 1]" 1
1109 1 30 VAL HA 1 32 CYS H 4.244 3.593 4.895 4.140 4.085 4.173 . 0 0 "[ . 1]" 1
1110 2 30 VAL HA 2 32 CYS H 4.244 3.593 4.895 4.139 4.089 4.176 . 0 0 "[ . 1]" 1
1111 1 32 CYS H 1 32 CYS HB2 2.232 . 2.472 2.482 2.434 2.497 0.025 9 0 "[ . 1]" 1
1112 2 32 CYS H 2 32 CYS HB2 2.232 . 2.472 2.481 2.431 2.501 0.029 9 0 "[ . 1]" 1
1113 1 21 ASP HB3 1 22 LYS H 2.230 . 2.488 2.553 2.523 2.611 0.123 4 0 "[ . 1]" 1
1114 2 21 ASP HB3 2 22 LYS H 2.230 . 2.488 2.554 2.522 2.616 0.128 4 0 "[ . 1]" 1
1115 1 30 VAL MG2 1 32 CYS H 4.315 3.566 5.064 5.169 5.152 5.183 0.119 6 0 "[ . 1]" 1
1116 2 30 VAL MG2 2 32 CYS H 4.315 3.566 5.064 5.169 5.154 5.184 0.120 3 0 "[ . 1]" 1
1117 1 32 CYS H 2 51 LEU MD1 3.748 . 6.000 5.086 4.969 5.233 . 0 0 "[ . 1]" 1
1118 1 51 LEU MD1 2 32 CYS H 3.748 . 6.000 5.084 4.973 5.219 . 0 0 "[ . 1]" 1
1119 1 22 LYS H 1 22 LYS HA 2.781 2.450 3.112 2.868 2.850 2.882 . 0 0 "[ . 1]" 1
1120 2 22 LYS H 2 22 LYS HA 2.781 2.450 3.112 2.868 2.854 2.880 . 0 0 "[ . 1]" 1
1121 1 21 ASP HB2 1 22 LYS H 3.865 3.485 4.245 3.905 3.803 3.955 . 0 0 "[ . 1]" 1
1122 2 21 ASP HB2 2 22 LYS H 3.865 3.485 4.245 3.906 3.807 3.960 . 0 0 "[ . 1]" 1
1123 1 13 LYS QB 1 14 ALA H 2.800 2.488 3.112 2.645 2.475 3.003 0.013 7 0 "[ . 1]" 1
1124 2 13 LYS QB 2 14 ALA H 2.800 2.488 3.112 2.645 2.470 3.009 0.018 7 0 "[ . 1]" 1
1125 1 14 ALA H 1 14 ALA MB 1.838 . 6.000 2.544 2.431 2.596 . 0 0 "[ . 1]" 1
1126 2 14 ALA H 2 14 ALA MB 1.838 . 6.000 2.544 2.422 2.595 . 0 0 "[ . 1]" 1
1127 1 15 VAL HA 1 16 PHE H 2.151 . 2.365 2.371 2.348 2.384 0.019 7 0 "[ . 1]" 1
1128 2 15 VAL HA 2 16 PHE H 2.151 . 2.365 2.373 2.351 2.390 0.025 7 0 "[ . 1]" 1
1129 1 16 PHE H 1 16 PHE HB2 2.758 2.429 3.087 3.081 3.020 3.109 0.022 6 0 "[ . 1]" 1
1130 2 16 PHE H 2 16 PHE HB2 2.758 2.429 3.087 3.081 3.031 3.113 0.026 6 0 "[ . 1]" 1
1131 1 16 PHE H 1 16 PHE HB3 2.832 2.508 3.156 3.093 3.069 3.113 . 0 0 "[ . 1]" 1
1132 2 16 PHE H 2 16 PHE HB3 2.832 2.508 3.156 3.091 3.068 3.115 . 0 0 "[ . 1]" 1
1133 1 15 VAL MG1 1 16 PHE H 1.538 . 1.850 1.797 1.744 1.847 . 0 0 "[ . 1]" 1
1134 2 15 VAL MG1 2 16 PHE H 1.538 . 1.850 1.796 1.743 1.852 0.002 8 0 "[ . 1]" 1
1135 1 16 PHE H 2 18 ILE HG12 4.547 3.921 5.173 4.471 4.371 4.539 . 0 0 "[ . 1]" 1
1136 1 18 ILE HG12 2 16 PHE H 4.547 3.921 5.173 4.468 4.366 4.527 . 0 0 "[ . 1]" 1
1137 1 16 PHE H 2 18 ILE HG13 3.496 2.989 4.003 3.909 3.859 3.967 . 0 0 "[ . 1]" 1
1138 1 18 ILE HG13 2 16 PHE H 3.496 2.989 4.003 3.901 3.847 3.970 . 0 0 "[ . 1]" 1
1139 1 29 LYS H 1 30 VAL HA 4.530 . 6.000 5.338 5.317 5.367 . 0 0 "[ . 1]" 1
1140 2 29 LYS H 2 30 VAL HA 4.530 . 6.000 5.337 5.314 5.364 . 0 0 "[ . 1]" 1
1141 1 28 LEU HA 1 29 LYS H 3.137 2.713 3.561 3.545 3.538 3.559 . 0 0 "[ . 1]" 1
1142 2 28 LEU HA 2 29 LYS H 3.137 2.713 3.561 3.544 3.537 3.557 . 0 0 "[ . 1]" 1
1143 1 27 ARG HA 1 29 LYS H 4.176 3.517 4.835 4.352 4.310 4.424 . 0 0 "[ . 1]" 1
1144 2 27 ARG HA 2 29 LYS H 4.176 3.517 4.835 4.350 4.314 4.421 . 0 0 "[ . 1]" 1
1145 1 29 LYS H 1 29 LYS HA 2.536 2.235 2.837 2.785 2.774 2.792 . 0 0 "[ . 1]" 1
1146 2 29 LYS H 2 29 LYS HA 2.536 2.235 2.837 2.787 2.776 2.796 . 0 0 "[ . 1]" 1
1147 1 26 THR HA 1 29 LYS H 2.956 2.604 3.308 2.923 2.855 3.014 . 0 0 "[ . 1]" 1
1148 2 26 THR HA 2 29 LYS H 2.956 2.604 3.308 2.924 2.856 3.025 . 0 0 "[ . 1]" 1
1149 1 25 LYS HA 1 29 LYS H 3.503 . 6.000 4.269 4.219 4.311 . 0 0 "[ . 1]" 1
1150 2 25 LYS HA 2 29 LYS H 3.503 . 6.000 4.267 4.219 4.311 . 0 0 "[ . 1]" 1
1151 1 29 LYS H 1 29 LYS QD 3.378 . 6.000 4.202 4.131 4.244 . 0 0 "[ . 1]" 1
1152 2 29 LYS H 2 29 LYS QD 3.378 . 6.000 4.203 4.135 4.245 . 0 0 "[ . 1]" 1
1153 1 29 LYS H 1 29 LYS QG 4.055 3.653 4.457 4.032 4.014 4.061 . 0 0 "[ . 1]" 1
1154 2 29 LYS H 2 29 LYS QG 4.055 3.653 4.457 4.033 4.014 4.061 . 0 0 "[ . 1]" 1
1155 1 28 LEU HB3 1 29 LYS H 2.382 2.068 2.696 2.678 2.655 2.705 0.009 6 0 "[ . 1]" 1
1156 2 28 LEU HB3 2 29 LYS H 2.382 2.068 2.696 2.678 2.657 2.704 0.008 6 0 "[ . 1]" 1
1157 1 26 THR MG 1 29 LYS H 3.268 . 6.000 4.354 4.289 4.410 . 0 0 "[ . 1]" 1
1158 2 26 THR MG 2 29 LYS H 3.268 . 6.000 4.355 4.294 4.413 . 0 0 "[ . 1]" 1
1159 1 29 LYS H 1 30 VAL MG2 2.992 . 6.000 4.086 3.997 4.150 . 0 0 "[ . 1]" 1
1160 2 29 LYS H 2 30 VAL MG2 2.992 . 6.000 4.084 3.994 4.148 . 0 0 "[ . 1]" 1
1161 1 29 LYS H 1 39 LEU MD2 3.138 . 6.000 4.033 3.965 4.104 . 0 0 "[ . 1]" 1
1162 2 29 LYS H 2 39 LEU MD2 3.138 . 6.000 4.034 3.970 4.100 . 0 0 "[ . 1]" 1
1163 1 28 LEU MD1 1 29 LYS H 2.383 . 6.000 3.380 3.323 3.415 . 0 0 "[ . 1]" 1
1164 2 28 LEU MD1 2 29 LYS H 2.383 . 6.000 3.380 3.326 3.413 . 0 0 "[ . 1]" 1
1165 1 38 GLN H 1 38 GLN HA 2.676 2.356 2.996 2.899 2.887 2.906 . 0 0 "[ . 1]" 1
1166 2 38 GLN H 2 38 GLN HA 2.676 2.356 2.996 2.898 2.888 2.905 . 0 0 "[ . 1]" 1
1167 1 38 GLN H 1 38 GLN QB 2.196 . 2.423 2.427 2.403 2.450 0.027 2 0 "[ . 1]" 1
1168 2 38 GLN H 2 38 GLN QB 2.196 . 2.423 2.426 2.399 2.453 0.030 2 0 "[ . 1]" 1
1169 1 37 LEU MD2 1 38 GLN H 3.218 . 6.000 3.954 3.873 4.099 . 0 0 "[ . 1]" 1
1170 2 37 LEU MD2 2 38 GLN H 3.218 . 6.000 3.954 3.871 4.096 . 0 0 "[ . 1]" 1
1171 1 27 ARG HA 1 30 VAL H 3.669 3.082 4.256 3.519 3.423 3.630 . 0 0 "[ . 1]" 1
1172 2 27 ARG HA 2 30 VAL H 3.669 3.082 4.256 3.520 3.426 3.626 . 0 0 "[ . 1]" 1
1173 1 29 LYS HA 1 30 VAL H 3.391 3.002 3.780 3.514 3.505 3.523 . 0 0 "[ . 1]" 1
1174 2 29 LYS HA 2 30 VAL H 3.391 3.002 3.780 3.513 3.505 3.524 . 0 0 "[ . 1]" 1
1175 1 30 VAL H 1 30 VAL HA 2.434 . 6.000 2.825 2.818 2.837 . 0 0 "[ . 1]" 1
1176 2 30 VAL H 2 30 VAL HA 2.434 . 6.000 2.826 2.818 2.839 . 0 0 "[ . 1]" 1
1177 1 29 LYS QD 1 30 VAL H 2.992 2.623 3.361 3.012 2.784 3.137 . 0 0 "[ . 1]" 1
1178 2 29 LYS QD 2 30 VAL H 2.992 2.623 3.361 3.013 2.785 3.133 . 0 0 "[ . 1]" 1
1179 1 28 LEU MD1 1 30 VAL H 3.495 . 6.000 4.872 4.787 4.950 . 0 0 "[ . 1]" 1
1180 2 28 LEU MD1 2 30 VAL H 3.495 . 6.000 4.870 4.783 4.946 . 0 0 "[ . 1]" 1
1181 1 44 GLU HA 1 48 LYS H 3.554 3.083 4.025 3.889 3.788 3.984 . 0 0 "[ . 1]" 1
1182 2 44 GLU HA 2 48 LYS H 3.554 3.083 4.025 3.893 3.794 3.992 . 0 0 "[ . 1]" 1
1183 1 47 ILE HA 1 48 LYS H 3.034 2.627 3.441 3.470 3.458 3.484 0.043 6 0 "[ . 1]" 1
1184 2 47 ILE HA 2 48 LYS H 3.034 2.627 3.441 3.470 3.457 3.487 0.046 10 0 "[ . 1]" 1
1185 1 48 LYS H 2 24 LEU QD 2.991 2.493 3.489 2.848 2.661 3.006 . 0 0 "[ . 1]" 1
1186 1 24 LEU QD 2 48 LYS H 2.991 2.493 3.489 2.853 2.668 3.001 . 0 0 "[ . 1]" 1
1187 1 47 ILE MG 1 48 LYS H 1.977 . 2.386 2.370 2.276 2.426 0.040 4 0 "[ . 1]" 1
1188 2 47 ILE MG 2 48 LYS H 1.977 . 2.386 2.374 2.287 2.425 0.039 4 0 "[ . 1]" 1
1189 1 49 GLU H 1 49 GLU HG2 3.146 . 6.000 3.822 2.596 4.209 . 0 0 "[ . 1]" 1
1190 2 49 GLU H 2 49 GLU HG2 3.146 . 6.000 3.821 2.600 4.205 . 0 0 "[ . 1]" 1
1191 1 49 GLU H 1 49 GLU HG3 3.358 3.033 3.683 3.409 2.933 3.925 0.242 5 0 "[ . 1]" 1
1192 2 49 GLU H 2 49 GLU HG3 3.358 3.033 3.683 3.409 2.933 3.925 0.242 5 0 "[ . 1]" 1
1193 1 20 MET H 2 14 ALA HA 3.488 . 6.000 5.207 5.107 5.340 . 0 0 "[ . 1]" 1
1194 1 14 ALA HA 2 20 MET H 3.488 . 6.000 5.210 5.111 5.354 . 0 0 "[ . 1]" 1
1195 1 47 ILE H 1 47 ILE HA 2.386 2.101 2.671 2.802 2.787 2.811 0.140 2 0 "[ . 1]" 1
1196 2 47 ILE H 2 47 ILE HA 2.386 2.101 2.671 2.802 2.786 2.812 0.141 2 0 "[ . 1]" 1
1197 1 19 TYR HB2 1 20 MET H 3.722 . 6.000 4.419 4.403 4.439 . 0 0 "[ . 1]" 1
1198 2 19 TYR HB2 2 20 MET H 3.722 . 6.000 4.419 4.399 4.438 . 0 0 "[ . 1]" 1
1199 1 19 TYR HB3 1 20 MET H 3.490 3.110 3.870 3.861 3.765 3.906 0.036 8 0 "[ . 1]" 1
1200 2 19 TYR HB3 2 20 MET H 3.490 3.110 3.870 3.862 3.764 3.903 0.033 8 0 "[ . 1]" 1
1201 1 20 MET H 1 20 MET HG3 3.750 3.343 4.157 3.256 3.070 3.295 0.273 8 0 "[ . 1]" 1
1202 2 20 MET H 2 20 MET HG3 3.750 3.343 4.157 3.254 3.061 3.294 0.282 8 0 "[ . 1]" 1
1203 1 28 LEU H 1 28 LEU HB3 2.301 2.059 2.543 2.560 2.542 2.580 0.037 4 0 "[ . 1]" 1
1204 2 28 LEU H 2 28 LEU HB3 2.301 2.059 2.543 2.560 2.544 2.576 0.033 4 0 "[ . 1]" 1
1205 1 26 THR HA 1 28 LEU H 4.174 3.576 4.772 4.472 4.379 4.601 . 0 0 "[ . 1]" 1
1206 2 26 THR HA 2 28 LEU H 4.174 3.576 4.772 4.473 4.365 4.604 . 0 0 "[ . 1]" 1
1207 1 13 LYS H 1 13 LYS HA 2.669 2.351 2.987 2.940 2.923 2.949 . 0 0 "[ . 1]" 1
1208 2 13 LYS H 2 13 LYS HA 2.669 2.351 2.987 2.939 2.927 2.946 . 0 0 "[ . 1]" 1
1209 1 40 THR H 1 40 THR HA 2.560 2.254 2.866 2.786 2.772 2.801 . 0 0 "[ . 1]" 1
1210 2 40 THR H 2 40 THR HA 2.560 2.254 2.866 2.785 2.772 2.797 . 0 0 "[ . 1]" 1
1211 1 13 LYS H 1 13 LYS QE 4.603 4.131 5.075 4.676 4.282 4.947 . 0 0 "[ . 1]" 1
1212 2 13 LYS H 2 13 LYS QE 4.603 4.131 5.075 4.673 4.276 4.943 . 0 0 "[ . 1]" 1
1213 1 40 THR H 1 40 THR MG 2.801 . 6.000 3.723 3.705 3.744 . 0 0 "[ . 1]" 1
1214 2 40 THR H 2 40 THR MG 2.801 . 6.000 3.724 3.707 3.744 . 0 0 "[ . 1]" 1
1215 1 39 LEU MD2 1 40 THR H 3.494 . 6.000 4.604 4.560 4.654 . 0 0 "[ . 1]" 1
1216 2 39 LEU MD2 2 40 THR H 3.494 . 6.000 4.604 4.564 4.650 . 0 0 "[ . 1]" 1
1217 1 23 ASP H 1 23 ASP HB2 2.442 2.180 2.704 2.542 2.473 2.646 . 0 0 "[ . 1]" 1
1218 2 23 ASP H 2 23 ASP HB2 2.442 2.180 2.704 2.542 2.474 2.640 . 0 0 "[ . 1]" 1
1219 1 21 ASP HB3 1 23 ASP H 3.391 2.971 3.811 3.383 3.235 3.573 . 0 0 "[ . 1]" 1
1220 2 21 ASP HB3 2 23 ASP H 3.391 2.971 3.811 3.386 3.239 3.566 . 0 0 "[ . 1]" 1
1221 1 49 GLU HA 1 52 GLN H 3.552 3.100 4.004 3.296 3.074 3.478 0.026 8 0 "[ . 1]" 1
1222 2 49 GLU HA 2 52 GLN H 3.552 3.100 4.004 3.296 3.075 3.479 0.025 8 0 "[ . 1]" 1
1223 1 51 LEU HA 1 52 GLN H 3.090 2.720 3.460 3.515 3.500 3.528 0.068 1 0 "[ . 1]" 1
1224 2 51 LEU HA 2 52 GLN H 3.090 2.720 3.460 3.515 3.503 3.530 0.070 6 0 "[ . 1]" 1
1225 1 18 ILE H 1 18 ILE HG12 2.567 2.201 2.933 2.283 2.262 2.348 . 0 0 "[ . 1]" 1
1226 2 18 ILE H 2 18 ILE HG12 2.567 2.201 2.933 2.281 2.256 2.343 . 0 0 "[ . 1]" 1
1227 1 45 GLU HA 1 46 ALA H 3.197 2.804 3.590 3.510 3.491 3.522 . 0 0 "[ . 1]" 1
1228 2 45 GLU HA 2 46 ALA H 3.197 2.804 3.590 3.511 3.494 3.521 . 0 0 "[ . 1]" 1
1229 1 43 ILE HA 1 46 ALA H 2.902 2.526 3.278 3.354 3.306 3.391 0.113 3 0 "[ . 1]" 1
1230 2 43 ILE HA 2 46 ALA H 2.902 2.526 3.278 3.353 3.309 3.391 0.113 3 0 "[ . 1]" 1
1231 1 37 LEU H 1 37 LEU MD2 3.156 . 6.000 3.983 3.878 4.026 . 0 0 "[ . 1]" 1
1232 2 37 LEU H 2 37 LEU MD2 3.156 . 6.000 3.986 3.884 4.029 . 0 0 "[ . 1]" 1
1233 1 32 CYS HB3 1 37 LEU H 4.566 3.847 5.285 3.884 3.827 3.951 0.020 7 0 "[ . 1]" 1
1234 2 32 CYS HB3 2 37 LEU H 4.566 3.847 5.285 3.880 3.817 3.951 0.030 7 0 "[ . 1]" 1
1235 1 51 LEU H 1 51 LEU HA 2.351 . 6.000 2.794 2.782 2.810 . 0 0 "[ . 1]" 1
1236 2 51 LEU H 2 51 LEU HA 2.351 . 6.000 2.794 2.780 2.810 . 0 0 "[ . 1]" 1
1237 1 35 ASN HB2 1 37 LEU H 2.402 2.130 2.674 2.755 2.725 2.774 0.100 8 0 "[ . 1]" 1
1238 2 35 ASN HB2 2 37 LEU H 2.402 2.130 2.674 2.757 2.724 2.780 0.106 8 0 "[ . 1]" 1
1239 1 51 LEU H 1 51 LEU HB2 2.027 . 2.249 2.214 2.195 2.240 . 0 0 "[ . 1]" 1
1240 2 51 LEU H 2 51 LEU HB2 2.027 . 2.249 2.212 2.190 2.241 . 0 0 "[ . 1]" 1
1241 1 51 LEU H 1 51 LEU HB3 3.481 3.145 3.817 3.504 3.490 3.523 . 0 0 "[ . 1]" 1
1242 2 51 LEU H 2 51 LEU HB3 3.481 3.145 3.817 3.503 3.486 3.524 . 0 0 "[ . 1]" 1
1243 1 55 ASN HB3 1 56 GLY H 2.828 . 6.000 3.861 3.793 3.930 . 0 0 "[ . 1]" 1
1244 2 55 ASN HB3 2 56 GLY H 2.828 . 6.000 3.861 3.798 3.923 . 0 0 "[ . 1]" 1
1245 1 46 ALA H 1 47 ILE MG 2.595 . 6.000 3.815 3.678 3.967 . 0 0 "[ . 1]" 1
1246 2 46 ALA H 2 47 ILE MG 2.595 . 6.000 3.815 3.688 3.970 . 0 0 "[ . 1]" 1
1247 1 27 ARG HB2 1 27 ARG HE 2.547 2.177 2.917 2.190 2.133 2.299 0.044 5 0 "[ . 1]" 1
1248 2 27 ARG HB2 2 27 ARG HE 2.547 2.177 2.917 2.191 2.134 2.312 0.043 2 0 "[ . 1]" 1
1249 1 27 ARG HE 1 27 ARG HG2 2.611 2.274 2.948 2.523 2.454 2.564 . 0 0 "[ . 1]" 1
1250 2 27 ARG HE 2 27 ARG HG2 2.611 2.274 2.948 2.526 2.446 2.564 . 0 0 "[ . 1]" 1
1251 1 14 ALA HA 1 15 VAL H 2.330 2.087 2.573 2.479 2.397 2.562 . 0 0 "[ . 1]" 1
1252 2 14 ALA HA 2 15 VAL H 2.330 2.087 2.573 2.480 2.386 2.561 . 0 0 "[ . 1]" 1
1253 1 32 CYS HA 1 33 ALA H 3.170 2.778 3.562 3.448 3.404 3.495 . 0 0 "[ . 1]" 1
1254 2 32 CYS HA 2 33 ALA H 3.170 2.778 3.562 3.448 3.406 3.489 . 0 0 "[ . 1]" 1
1255 1 32 CYS HB2 1 33 ALA H 2.872 2.539 3.205 2.972 2.753 3.128 . 0 0 "[ . 1]" 1
1256 2 32 CYS HB2 2 33 ALA H 2.872 2.539 3.205 2.969 2.757 3.123 . 0 0 "[ . 1]" 1
1257 1 30 VAL MG2 1 33 ALA H 3.866 . 6.000 4.885 4.797 4.930 . 0 0 "[ . 1]" 1
1258 2 30 VAL MG2 2 33 ALA H 3.866 . 6.000 4.885 4.796 4.932 . 0 0 "[ . 1]" 1
1259 1 26 THR H 1 26 THR HB 2.350 2.064 2.636 2.378 2.332 2.447 . 0 0 "[ . 1]" 1
1260 2 26 THR H 2 26 THR HB 2.350 2.064 2.636 2.379 2.337 2.451 . 0 0 "[ . 1]" 1
1261 1 24 LEU HA 1 26 THR H 3.622 3.130 4.114 4.151 4.116 4.205 0.091 9 0 "[ . 1]" 1
1262 2 24 LEU HA 2 26 THR H 3.622 3.130 4.114 4.151 4.114 4.195 0.081 9 0 "[ . 1]" 1
1263 1 26 THR H 1 27 ARG HA 5.014 4.414 5.614 5.101 5.059 5.154 . 0 0 "[ . 1]" 1
1264 2 26 THR H 2 27 ARG HA 5.014 4.414 5.614 5.101 5.063 5.149 . 0 0 "[ . 1]" 1
1265 1 26 THR H 1 26 THR HA 2.570 2.269 2.871 2.866 2.861 2.873 0.002 2 0 "[ . 1]" 1
1266 2 26 THR H 2 26 THR HA 2.570 2.269 2.871 2.865 2.859 2.872 0.001 6 0 "[ . 1]" 1
1267 1 26 THR H 1 26 THR MG 2.809 . 6.000 3.741 3.723 3.766 . 0 0 "[ . 1]" 1
1268 2 26 THR H 2 26 THR MG 2.809 . 6.000 3.741 3.724 3.764 . 0 0 "[ . 1]" 1
1269 1 25 LYS HG2 1 26 THR H 3.374 . 6.000 4.200 4.116 4.366 . 0 0 "[ . 1]" 1
1270 2 25 LYS HG2 2 26 THR H 3.374 . 6.000 4.200 4.120 4.365 . 0 0 "[ . 1]" 1
1271 1 40 THR HA 1 43 ILE H 2.946 2.588 3.304 3.388 3.373 3.403 0.099 1 0 "[ . 1]" 1
1272 2 40 THR HA 2 43 ILE H 2.946 2.588 3.304 3.390 3.374 3.408 0.104 1 0 "[ . 1]" 1
1273 1 43 ILE H 1 43 ILE HA 2.499 2.207 2.791 2.800 2.797 2.805 0.014 1 0 "[ . 1]" 1
1274 2 43 ILE H 2 43 ILE HA 2.499 2.207 2.791 2.800 2.795 2.807 0.016 8 0 "[ . 1]" 1
1275 1 45 GLU H 1 45 GLU HG2 2.304 2.056 2.552 2.366 2.257 2.622 0.070 10 0 "[ . 1]" 1
1276 2 45 GLU H 2 45 GLU HG2 2.304 2.056 2.552 2.362 2.259 2.619 0.067 10 0 "[ . 1]" 1
1277 1 23 ASP HA 1 24 LEU H 3.217 2.838 3.596 3.499 3.474 3.517 . 0 0 "[ . 1]" 1
1278 2 23 ASP HA 2 24 LEU H 3.217 2.838 3.596 3.498 3.475 3.518 . 0 0 "[ . 1]" 1
1279 1 23 ASP HB3 1 24 LEU H 2.795 2.430 3.160 2.724 2.639 2.865 . 0 0 "[ . 1]" 1
1280 2 23 ASP HB3 2 24 LEU H 2.795 2.430 3.160 2.726 2.624 2.864 . 0 0 "[ . 1]" 1
1281 1 24 LEU H 1 26 THR HB 4.699 3.908 5.490 4.538 4.463 4.613 . 0 0 "[ . 1]" 1
1282 2 24 LEU H 2 26 THR HB 4.699 3.908 5.490 4.538 4.458 4.615 . 0 0 "[ . 1]" 1
1283 1 26 THR HB 1 27 ARG H 2.675 2.339 3.011 2.782 2.672 2.883 . 0 0 "[ . 1]" 1
1284 2 26 THR HB 2 27 ARG H 2.675 2.339 3.011 2.784 2.669 2.886 . 0 0 "[ . 1]" 1
1285 1 27 ARG H 1 27 ARG HA 2.604 2.307 2.901 2.784 2.772 2.799 . 0 0 "[ . 1]" 1
1286 2 27 ARG H 2 27 ARG HA 2.604 2.307 2.901 2.784 2.774 2.798 . 0 0 "[ . 1]" 1
1287 1 27 ARG H 1 27 ARG HB2 2.751 2.465 3.037 2.750 2.683 2.839 . 0 0 "[ . 1]" 1
1288 2 27 ARG H 2 27 ARG HB2 2.751 2.465 3.037 2.752 2.686 2.840 . 0 0 "[ . 1]" 1
1289 1 27 ARG H 1 27 ARG HB3 2.124 . 2.384 2.261 2.189 2.300 . 0 0 "[ . 1]" 1
1290 2 27 ARG H 2 27 ARG HB3 2.124 . 2.384 2.261 2.185 2.305 . 0 0 "[ . 1]" 1
1291 1 26 THR MG 1 27 ARG H 2.475 . 6.000 3.411 3.224 3.566 . 0 0 "[ . 1]" 1
1292 2 26 THR MG 2 27 ARG H 2.475 . 6.000 3.413 3.229 3.566 . 0 0 "[ . 1]" 1
1293 1 31 TYR H 1 31 TYR HB2 2.534 2.239 2.829 2.561 2.523 2.597 . 0 0 "[ . 1]" 1
1294 2 31 TYR H 2 31 TYR HB2 2.534 2.239 2.829 2.562 2.527 2.599 . 0 0 "[ . 1]" 1
1295 1 44 GLU H 1 44 GLU HG2 3.208 2.914 3.502 3.373 3.346 3.387 . 0 0 "[ . 1]" 1
1296 2 44 GLU H 2 44 GLU HG2 3.208 2.914 3.502 3.372 3.356 3.387 . 0 0 "[ . 1]" 1
1297 1 43 ILE MD 1 44 GLU H 3.033 . 6.000 4.242 4.223 4.257 . 0 0 "[ . 1]" 1
1298 2 43 ILE MD 2 44 GLU H 3.033 . 6.000 4.242 4.223 4.261 . 0 0 "[ . 1]" 1
1299 1 24 LEU QD 1 25 LYS H 1.965 . 2.269 2.396 2.338 2.661 0.392 8 0 "[ . 1]" 1
1300 2 24 LEU QD 2 25 LYS H 1.965 . 2.269 2.394 2.339 2.659 0.390 8 0 "[ . 1]" 1
1301 1 21 ASP HB2 1 25 LYS H 3.709 3.274 4.144 4.162 4.018 4.288 0.144 8 0 "[ . 1]" 1
1302 2 21 ASP HB2 2 25 LYS H 3.709 3.274 4.144 4.161 4.022 4.287 0.143 8 0 "[ . 1]" 1
1303 1 33 ALA HA 1 34 LYS H 2.995 . 6.000 3.496 3.482 3.503 . 0 0 "[ . 1]" 1
1304 2 33 ALA HA 2 34 LYS H 2.995 . 6.000 3.497 3.481 3.513 . 0 0 "[ . 1]" 1
1305 1 34 LYS H 1 34 LYS QB 2.055 . 2.257 2.224 2.202 2.242 . 0 0 "[ . 1]" 1
1306 2 34 LYS H 2 34 LYS QB 2.055 . 2.257 2.224 2.201 2.244 . 0 0 "[ . 1]" 1
1307 1 34 LYS H 1 34 LYS QD 4.644 4.175 5.113 4.455 4.298 4.619 . 0 0 "[ . 1]" 1
1308 2 34 LYS H 2 34 LYS QD 4.644 4.175 5.113 4.456 4.297 4.625 . 0 0 "[ . 1]" 1
1309 1 34 LYS H 1 34 LYS HG2 4.017 3.628 4.406 4.413 4.393 4.456 0.050 2 0 "[ . 1]" 1
1310 2 34 LYS H 2 34 LYS HG2 4.017 3.628 4.406 4.414 4.388 4.455 0.049 2 0 "[ . 1]" 1
1311 1 29 LYS QD 1 34 LYS H 4.729 . 6.000 5.782 5.660 5.897 . 0 0 "[ . 1]" 1
1312 2 29 LYS QD 2 34 LYS H 4.729 . 6.000 5.781 5.648 5.897 . 0 0 "[ . 1]" 1
1313 1 39 LEU HA 1 42 ALA H 3.032 . 6.000 3.691 3.607 3.746 . 0 0 "[ . 1]" 1
1314 2 39 LEU HA 2 42 ALA H 3.032 . 6.000 3.692 3.617 3.746 . 0 0 "[ . 1]" 1
1315 1 42 ALA H 1 42 ALA HA 2.568 2.273 2.863 2.845 2.831 2.859 . 0 0 "[ . 1]" 1
1316 2 42 ALA H 2 42 ALA HA 2.568 2.273 2.863 2.845 2.834 2.857 . 0 0 "[ . 1]" 1
1317 1 41 GLN HB3 1 42 ALA H 2.566 2.267 2.865 2.623 2.561 2.681 . 0 0 "[ . 1]" 1
1318 2 41 GLN HB3 2 42 ALA H 2.566 2.267 2.865 2.623 2.564 2.681 . 0 0 "[ . 1]" 1
1319 1 37 LEU HG 1 41 GLN HE22 3.134 . 6.000 2.294 1.841 2.607 . 0 0 "[ . 1]" 1
1320 2 37 LEU HG 2 41 GLN HE22 3.134 . 6.000 2.294 1.846 2.599 . 0 0 "[ . 1]" 1
1321 1 37 LEU MD1 1 41 GLN HE22 2.461 2.074 2.848 2.827 2.385 2.905 0.057 7 0 "[ . 1]" 1
1322 2 37 LEU MD1 2 41 GLN HE22 2.461 2.074 2.848 2.827 2.389 2.894 0.046 7 0 "[ . 1]" 1
1323 1 38 GLN HE22 1 38 GLN HG2 4.009 3.643 4.375 3.874 3.527 4.064 0.116 6 0 "[ . 1]" 1
1324 2 38 GLN HE22 2 38 GLN HG2 4.009 3.643 4.375 3.872 3.522 4.061 0.121 6 0 "[ . 1]" 1
1325 1 36 ASN H 1 36 ASN HA 2.112 . 2.303 2.276 2.267 2.283 . 0 0 "[ . 1]" 1
1326 2 36 ASN H 2 36 ASN HA 2.112 . 2.303 2.276 2.270 2.281 . 0 0 "[ . 1]" 1
1327 1 35 ASN HA 1 36 ASN H 3.112 2.734 3.490 3.205 3.175 3.237 . 0 0 "[ . 1]" 1
1328 2 35 ASN HA 2 36 ASN H 3.112 2.734 3.490 3.204 3.175 3.235 . 0 0 "[ . 1]" 1
1329 1 54 ARG HA 1 55 ASN H 3.208 2.879 3.537 3.560 3.549 3.573 0.036 5 0 "[ . 1]" 1
1330 2 54 ARG HA 2 55 ASN H 3.208 2.879 3.537 3.559 3.546 3.574 0.037 5 0 "[ . 1]" 1
1331 1 55 ASN H 1 55 ASN HB3 3.038 . 6.000 3.800 3.763 3.831 . 0 0 "[ . 1]" 1
1332 2 55 ASN H 2 55 ASN HB3 3.038 . 6.000 3.800 3.765 3.829 . 0 0 "[ . 1]" 1
1333 1 55 ASN HB3 1 55 ASN HD22 3.696 3.370 4.022 3.479 3.470 3.487 . 0 0 "[ . 1]" 1
1334 2 55 ASN HB3 2 55 ASN HD22 3.696 3.370 4.022 3.480 3.469 3.489 . 0 0 "[ . 1]" 1
1335 1 50 TYR HA 1 53 LYS H 3.339 2.919 3.759 3.384 3.311 3.460 . 0 0 "[ . 1]" 1
1336 2 50 TYR HA 2 53 LYS H 3.339 2.919 3.759 3.384 3.306 3.462 . 0 0 "[ . 1]" 1
1337 1 52 GLN HB2 1 53 LYS H 2.935 2.558 3.312 2.989 2.894 3.077 . 0 0 "[ . 1]" 1
1338 2 52 GLN HB2 2 53 LYS H 2.935 2.558 3.312 2.991 2.891 3.078 . 0 0 "[ . 1]" 1
1339 1 53 LYS H 1 53 LYS HB2 2.249 . 2.506 2.502 2.436 2.547 0.041 5 0 "[ . 1]" 1
1340 2 53 LYS H 2 53 LYS HB2 2.249 . 2.506 2.503 2.439 2.549 0.043 5 0 "[ . 1]" 1
1341 1 31 TYR H 1 32 CYS H 2.456 2.160 2.752 2.570 2.551 2.596 . 0 0 "[ . 1]" 1
1342 2 31 TYR H 2 32 CYS H 2.456 2.160 2.752 2.569 2.550 2.595 . 0 0 "[ . 1]" 1
1343 1 31 TYR QD 1 32 CYS H 2.824 . 6.000 3.577 3.432 3.756 . 0 0 "[ . 1]" 1
1344 2 31 TYR QD 2 32 CYS H 2.824 . 6.000 3.577 3.430 3.754 . 0 0 "[ . 1]" 1
1345 1 21 ASP H 1 22 LYS H 4.349 3.890 4.808 4.626 4.617 4.643 . 0 0 "[ . 1]" 1
1346 2 21 ASP H 2 22 LYS H 4.349 3.890 4.808 4.626 4.614 4.643 . 0 0 "[ . 1]" 1
1347 1 31 TYR H 1 31 TYR QD 3.448 . 6.000 4.152 4.139 4.162 . 0 0 "[ . 1]" 1
1348 2 31 TYR H 2 31 TYR QD 3.448 . 6.000 4.152 4.143 4.161 . 0 0 "[ . 1]" 1
1349 1 34 LYS H 1 35 ASN H 2.334 2.066 2.602 2.577 2.517 2.618 0.016 6 0 "[ . 1]" 1
1350 2 34 LYS H 2 35 ASN H 2.334 2.066 2.602 2.578 2.518 2.625 0.023 10 0 "[ . 1]" 1
1351 1 36 ASN H 1 37 LEU H 2.514 2.228 2.800 2.714 2.621 2.792 . 0 0 "[ . 1]" 1
1352 2 36 ASN H 2 37 LEU H 2.514 2.228 2.800 2.709 2.620 2.785 . 0 0 "[ . 1]" 1
1353 1 55 ASN H 1 56 GLY H 2.366 2.103 2.629 2.564 2.479 2.635 0.006 4 0 "[ . 1]" 1
1354 2 55 ASN H 2 56 GLY H 2.366 2.103 2.629 2.566 2.490 2.636 0.007 4 0 "[ . 1]" 1
1355 1 42 ALA H 1 43 ILE H 2.654 2.314 2.994 2.654 2.600 2.686 . 0 0 "[ . 1]" 1
1356 2 42 ALA H 2 43 ILE H 2.654 2.314 2.994 2.655 2.598 2.688 . 0 0 "[ . 1]" 1
1357 1 40 THR H 1 41 GLN H 2.654 2.315 2.993 2.773 2.727 2.807 . 0 0 "[ . 1]" 1
1358 2 40 THR H 2 41 GLN H 2.654 2.315 2.993 2.775 2.739 2.798 . 0 0 "[ . 1]" 1
1359 1 19 TYR QD 1 20 MET H 3.832 3.362 4.302 4.357 4.325 4.409 0.107 8 0 "[ . 1]" 1
1360 2 19 TYR QD 2 20 MET H 3.832 3.362 4.302 4.358 4.329 4.406 0.104 8 0 "[ . 1]" 1
1361 1 35 ASN H 1 36 ASN H 2.230 . 2.472 2.349 2.294 2.402 . 0 0 "[ . 1]" 1
1362 2 35 ASN H 2 36 ASN H 2.230 . 2.472 2.348 2.296 2.399 . 0 0 "[ . 1]" 1
1363 1 54 ARG H 1 55 ASN H 2.387 2.133 2.641 2.562 2.481 2.629 . 0 0 "[ . 1]" 1
1364 2 54 ARG H 2 55 ASN H 2.387 2.133 2.641 2.563 2.481 2.619 . 0 0 "[ . 1]" 1
1365 1 16 PHE QR 1 17 GLY H 2.884 2.574 3.194 3.239 3.195 3.286 0.092 2 0 "[ . 1]" 1
1366 2 16 PHE QR 2 17 GLY H 2.884 2.574 3.194 3.241 3.195 3.288 0.094 2 0 "[ . 1]" 1
1367 1 50 TYR QD 1 51 LEU H 2.901 2.533 3.269 3.289 3.248 3.315 0.046 7 0 "[ . 1]" 1
1368 2 50 TYR QD 2 51 LEU H 2.901 2.533 3.269 3.289 3.252 3.321 0.052 7 0 "[ . 1]" 1
1369 1 39 LEU H 1 40 THR H 2.867 2.501 3.233 2.980 2.935 3.014 . 0 0 "[ . 1]" 1
1370 2 39 LEU H 2 40 THR H 2.867 2.501 3.233 2.983 2.949 3.024 . 0 0 "[ . 1]" 1
1371 1 16 PHE H 2 18 ILE H 2.574 2.285 2.863 2.954 2.933 2.979 0.116 7 0 "[ . 1]" 1
1372 1 18 ILE H 2 16 PHE H 2.574 2.285 2.863 2.948 2.923 2.969 0.106 7 0 "[ . 1]" 1
1373 1 13 LYS H 1 14 ALA H 3.184 . 6.000 4.490 4.344 4.537 . 0 0 "[ . 1]" 1
1374 2 13 LYS H 2 14 ALA H 3.184 . 6.000 4.489 4.334 4.536 . 0 0 "[ . 1]" 1
1375 1 37 LEU H 1 38 GLN H 4.306 3.836 4.776 4.580 4.574 4.589 . 0 0 "[ . 1]" 1
1376 2 37 LEU H 2 38 GLN H 4.306 3.836 4.776 4.581 4.574 4.588 . 0 0 "[ . 1]" 1
1377 1 33 ALA H 1 34 LYS H 2.495 2.184 2.806 2.369 2.272 2.496 . 0 0 "[ . 1]" 1
1378 2 33 ALA H 2 34 LYS H 2.495 2.184 2.806 2.371 2.277 2.491 . 0 0 "[ . 1]" 1
1379 1 45 GLU H 1 46 ALA H 2.365 2.093 2.637 2.590 2.501 2.670 0.033 10 0 "[ . 1]" 1
1380 2 45 GLU H 2 46 ALA H 2.365 2.093 2.637 2.590 2.501 2.670 0.033 10 0 "[ . 1]" 1
1381 1 25 LYS H 1 26 THR H 2.271 . 2.546 2.564 2.508 2.684 0.138 8 0 "[ . 1]" 1
1382 2 25 LYS H 2 26 THR H 2.271 . 2.546 2.566 2.508 2.687 0.141 8 0 "[ . 1]" 1
1383 1 26 THR H 1 27 ARG H 2.498 2.172 2.824 2.452 2.400 2.520 . 0 0 "[ . 1]" 1
1384 2 26 THR H 2 27 ARG H 2.498 2.172 2.824 2.451 2.402 2.517 . 0 0 "[ . 1]" 1
1385 1 46 ALA H 1 47 ILE H 2.445 2.176 2.714 2.742 2.723 2.759 0.045 10 0 "[ . 1]" 1
1386 2 46 ALA H 2 47 ILE H 2.445 2.176 2.714 2.744 2.726 2.755 0.041 5 0 "[ . 1]" 1
1387 1 29 LYS H 1 32 CYS H 3.149 . 6.000 4.599 4.564 4.655 . 0 0 "[ . 1]" 1
1388 2 29 LYS H 2 32 CYS H 3.149 . 6.000 4.599 4.564 4.657 . 0 0 "[ . 1]" 1
1389 1 30 VAL H 1 32 CYS H 3.572 3.135 4.009 3.946 3.891 3.963 . 0 0 "[ . 1]" 1
1390 2 30 VAL H 2 32 CYS H 3.572 3.135 4.009 3.944 3.895 3.963 . 0 0 "[ . 1]" 1
1391 1 35 ASN HA 1 35 ASN HD21 3.699 3.282 4.116 3.788 3.734 3.822 . 0 0 "[ . 1]" 1
1392 2 35 ASN HA 2 35 ASN HD21 3.699 3.282 4.116 3.788 3.739 3.827 . 0 0 "[ . 1]" 1
1393 1 31 TYR HA 1 35 ASN HD21 2.943 2.576 3.310 3.148 2.941 3.326 0.016 6 0 "[ . 1]" 1
1394 2 31 TYR HA 2 35 ASN HD21 2.943 2.576 3.310 3.146 2.944 3.319 0.009 6 0 "[ . 1]" 1
1395 1 35 ASN HB2 1 35 ASN HD21 2.389 2.047 2.731 2.257 2.244 2.273 . 0 0 "[ . 1]" 1
1396 2 35 ASN HB2 2 35 ASN HD21 2.389 2.047 2.731 2.259 2.242 2.277 . 0 0 "[ . 1]" 1
1397 1 34 LYS QB 1 35 ASN HD21 2.948 2.565 3.331 2.818 2.677 2.976 . 0 0 "[ . 1]" 1
1398 2 34 LYS QB 2 35 ASN HD21 2.948 2.565 3.331 2.817 2.679 2.975 . 0 0 "[ . 1]" 1
1399 1 35 ASN HB3 1 35 ASN HD21 3.275 2.978 3.572 3.476 3.468 3.484 . 0 0 "[ . 1]" 1
1400 2 35 ASN HB3 2 35 ASN HD21 3.275 2.978 3.572 3.477 3.466 3.486 . 0 0 "[ . 1]" 1
1401 1 35 ASN H 1 35 ASN HA 2.661 2.370 2.952 2.925 2.921 2.929 . 0 0 "[ . 1]" 1
1402 2 35 ASN H 2 35 ASN HA 2.661 2.370 2.952 2.926 2.922 2.930 . 0 0 "[ . 1]" 1
1403 1 38 GLN QB 1 41 GLN H 2.608 2.292 2.924 2.328 2.275 2.383 0.017 2 0 "[ . 1]" 1
1404 2 38 GLN QB 2 41 GLN H 2.608 2.292 2.924 2.329 2.276 2.387 0.016 2 0 "[ . 1]" 1
1405 1 54 ARG H 1 54 ARG HB2 2.332 2.087 2.577 2.452 2.374 2.510 . 0 0 "[ . 1]" 1
1406 2 54 ARG H 2 54 ARG HB2 2.332 2.087 2.577 2.452 2.376 2.504 . 0 0 "[ . 1]" 1
1407 1 54 ARG H 1 54 ARG HB3 2.491 2.239 2.743 2.863 2.805 2.920 0.177 7 0 "[ . 1]" 1
1408 2 54 ARG H 2 54 ARG HB3 2.491 2.239 2.743 2.862 2.807 2.917 0.174 7 0 "[ . 1]" 1
1409 1 53 LYS HB2 1 54 ARG H 3.681 3.298 4.064 4.088 4.028 4.112 0.048 6 0 "[ . 1]" 1
1410 2 53 LYS HB2 2 54 ARG H 3.681 3.298 4.064 4.087 4.030 4.113 0.049 6 0 "[ . 1]" 1
1411 1 55 ASN HB3 1 55 ASN HD21 2.914 . 6.000 2.229 2.208 2.246 . 0 0 "[ . 1]" 1
1412 2 55 ASN HB3 2 55 ASN HD21 2.914 . 6.000 2.232 2.208 2.253 . 0 0 "[ . 1]" 1
1413 1 40 THR HA 1 41 GLN H 3.322 2.858 3.786 3.548 3.527 3.561 . 0 0 "[ . 1]" 1
1414 2 40 THR HA 2 41 GLN H 3.322 2.858 3.786 3.547 3.526 3.560 . 0 0 "[ . 1]" 1
1415 1 35 ASN HD21 1 37 LEU MD2 2.797 . 6.000 4.053 3.833 4.145 . 0 0 "[ . 1]" 1
1416 2 35 ASN HD21 2 37 LEU MD2 2.797 . 6.000 4.055 3.830 4.154 . 0 0 "[ . 1]" 1
1417 1 35 ASN H 1 37 LEU H 3.333 2.892 3.774 3.321 3.265 3.352 . 0 0 "[ . 1]" 1
1418 2 35 ASN H 2 37 LEU H 3.333 2.892 3.774 3.322 3.264 3.352 . 0 0 "[ . 1]" 1
1419 1 56 GLY H 2 31 TYR QD 2.522 . 6.000 3.063 2.731 3.385 . 0 0 "[ . 1]" 1
1420 1 31 TYR QD 2 56 GLY H 2.522 . 6.000 3.065 2.718 3.361 . 0 0 "[ . 1]" 1
1421 1 34 LYS H 1 36 ASN H 3.202 2.830 3.574 3.603 3.578 3.632 0.058 8 0 "[ . 1]" 1
1422 2 34 LYS H 2 36 ASN H 3.202 2.830 3.574 3.604 3.578 3.627 0.053 8 0 "[ . 1]" 1
1423 1 29 LYS H 1 31 TYR H 4.263 3.617 4.909 3.971 3.926 4.038 . 0 0 "[ . 1]" 1
1424 2 29 LYS H 2 31 TYR H 4.263 3.617 4.909 3.970 3.927 4.040 . 0 0 "[ . 1]" 1
1425 1 38 GLN H 1 39 LEU H 4.067 3.604 4.530 4.506 4.494 4.520 . 0 0 "[ . 1]" 1
1426 2 38 GLN H 2 39 LEU H 4.067 3.604 4.530 4.505 4.486 4.526 . 0 0 "[ . 1]" 1
1427 1 28 LEU H 1 29 LYS H 2.467 2.164 2.770 2.739 2.681 2.788 0.018 4 0 "[ . 1]" 1
1428 2 28 LEU H 2 29 LYS H 2.467 2.164 2.770 2.737 2.671 2.791 0.021 4 0 "[ . 1]" 1
1429 1 42 ALA H 1 44 GLU H 3.616 3.123 4.109 4.053 4.016 4.091 . 0 0 "[ . 1]" 1
1430 2 42 ALA H 2 44 GLU H 3.616 3.123 4.109 4.053 4.005 4.099 . 0 0 "[ . 1]" 1
1431 1 31 TYR QD 1 35 ASN HD21 2.536 . 6.000 3.289 3.114 3.445 . 0 0 "[ . 1]" 1
1432 2 31 TYR QD 2 35 ASN HD21 2.536 . 6.000 3.287 3.112 3.436 . 0 0 "[ . 1]" 1
1433 1 40 THR HB 1 42 ALA H 4.854 4.217 5.491 4.816 4.785 4.848 . 0 0 "[ . 1]" 1
1434 2 40 THR HB 2 42 ALA H 4.854 4.217 5.491 4.817 4.796 4.837 . 0 0 "[ . 1]" 1
1435 1 50 TYR H 1 50 TYR HA 2.468 2.217 2.719 2.833 2.815 2.853 0.134 1 0 "[ . 1]" 1
1436 2 50 TYR H 2 50 TYR HA 2.468 2.217 2.719 2.832 2.812 2.849 0.130 1 0 "[ . 1]" 1
1437 1 13 LYS HA 1 14 ALA H 1.978 . 6.000 2.209 2.075 2.280 . 0 0 "[ . 1]" 1
1438 2 13 LYS HA 2 14 ALA H 1.978 . 6.000 2.212 2.077 2.284 . 0 0 "[ . 1]" 1
1439 1 50 TYR H 1 50 TYR QB 2.008 . 2.203 2.183 2.162 2.201 . 0 0 "[ . 1]" 1
1440 2 50 TYR H 2 50 TYR QB 2.008 . 2.203 2.183 2.162 2.204 0.001 10 0 "[ . 1]" 1
1441 1 27 ARG H 1 27 ARG HE 5.900 . 6.000 4.918 4.810 5.132 . 0 0 "[ . 1]" 1
1442 2 27 ARG H 2 27 ARG HE 5.900 . 6.000 4.920 4.801 5.146 . 0 0 "[ . 1]" 1
1443 1 27 ARG QD 1 27 ARG HE 2.917 2.524 3.310 2.491 2.469 2.502 0.055 6 0 "[ . 1]" 1
1444 2 27 ARG QD 2 27 ARG HE 2.917 2.524 3.310 2.492 2.472 2.502 0.052 6 0 "[ . 1]" 1
1445 1 27 ARG HE 2 48 LYS QE 3.219 . 6.000 5.555 5.323 5.912 . 0 0 "[ . 1]" 1
1446 1 48 LYS QE 2 27 ARG HE 3.219 . 6.000 5.556 5.335 5.921 . 0 0 "[ . 1]" 1
1447 1 27 ARG HE 1 27 ARG HG3 3.686 3.285 4.087 3.613 3.591 3.637 . 0 0 "[ . 1]" 1
1448 2 27 ARG HE 2 27 ARG HG3 3.686 3.285 4.087 3.615 3.600 3.640 . 0 0 "[ . 1]" 1
1449 1 27 ARG HE 2 51 LEU MD1 5.276 4.429 6.123 5.786 5.643 5.919 . 0 0 "[ . 1]" 1
1450 1 51 LEU MD1 2 27 ARG HE 5.276 4.429 6.123 5.791 5.651 5.933 . 0 0 "[ . 1]" 1
1451 1 27 ARG HA 1 27 ARG HE 4.669 . 6.000 3.609 3.504 3.822 . 0 0 "[ . 1]" 1
1452 2 27 ARG HA 2 27 ARG HE 4.669 . 6.000 3.608 3.512 3.840 . 0 0 "[ . 1]" 1
1453 1 22 LYS H 1 23 ASP H 2.989 2.573 3.405 2.632 2.546 2.740 0.027 3 0 "[ . 1]" 1
1454 2 22 LYS H 2 23 ASP H 2.989 2.573 3.405 2.632 2.547 2.749 0.026 3 0 "[ . 1]" 1
1455 1 22 LYS H 1 24 LEU H 3.662 3.146 4.178 3.922 3.848 4.006 . 0 0 "[ . 1]" 1
1456 2 22 LYS H 2 24 LEU H 3.662 3.146 4.178 3.920 3.842 4.004 . 0 0 "[ . 1]" 1
1457 1 21 ASP HA 1 22 LYS H 2.721 2.380 3.062 2.323 2.285 2.359 0.095 4 0 "[ . 1]" 1
1458 2 21 ASP HA 2 22 LYS H 2.721 2.380 3.062 2.324 2.288 2.357 0.092 5 0 "[ . 1]" 1
1459 1 16 PHE H 1 16 PHE QR 3.624 . 6.000 4.296 4.276 4.314 . 0 0 "[ . 1]" 1
1460 2 16 PHE H 2 16 PHE QR 3.624 . 6.000 4.297 4.275 4.314 . 0 0 "[ . 1]" 1
1461 1 16 PHE H 2 19 TYR HA 4.038 3.583 4.493 3.941 3.815 4.007 . 0 0 "[ . 1]" 1
1462 1 19 TYR HA 2 16 PHE H 4.038 3.583 4.493 3.939 3.817 4.008 . 0 0 "[ . 1]" 1
1463 1 16 PHE H 1 16 PHE HA 3.449 2.918 3.980 2.902 2.896 2.908 0.022 2 0 "[ . 1]" 1
1464 2 16 PHE H 2 16 PHE HA 3.449 2.918 3.980 2.902 2.896 2.911 0.022 2 0 "[ . 1]" 1
1465 1 16 PHE H 2 17 GLY HA2 3.844 3.259 4.429 3.810 3.757 3.914 . 0 0 "[ . 1]" 1
1466 1 17 GLY HA2 2 16 PHE H 3.844 3.259 4.429 3.810 3.767 3.896 . 0 0 "[ . 1]" 1
1467 1 15 VAL HB 1 16 PHE H 2.752 2.420 3.084 3.248 3.234 3.272 0.188 8 0 "[ . 1]" 1
1468 2 15 VAL HB 2 16 PHE H 2.752 2.420 3.084 3.250 3.237 3.274 0.190 8 0 "[ . 1]" 1
1469 1 16 PHE H 2 18 ILE HB 3.437 . 6.000 5.593 5.547 5.647 . 0 0 "[ . 1]" 1
1470 1 18 ILE HB 2 16 PHE H 3.437 . 6.000 5.586 5.550 5.648 . 0 0 "[ . 1]" 1
1471 1 39 LEU H 1 41 GLN H 5.393 4.442 6.344 4.430 4.403 4.482 0.039 8 0 "[ . 1]" 1
1472 2 39 LEU H 2 41 GLN H 5.393 4.442 6.344 4.435 4.391 4.475 0.051 4 0 "[ . 1]" 1
1473 1 37 LEU HA 1 39 LEU H 4.716 . 6.000 6.106 6.087 6.122 0.122 5 0 "[ . 1]" 1
1474 2 37 LEU HA 2 39 LEU H 4.716 . 6.000 6.104 6.082 6.123 0.123 10 0 "[ . 1]" 1
1475 1 38 GLN HG2 1 39 LEU H 4.008 3.612 4.404 4.345 4.231 4.435 0.031 2 0 "[ . 1]" 1
1476 2 38 GLN HG2 2 39 LEU H 4.008 3.612 4.404 4.348 4.241 4.443 0.039 2 0 "[ . 1]" 1
1477 1 20 MET H 1 21 ASP H 4.466 3.896 5.036 4.545 4.523 4.561 . 0 0 "[ . 1]" 1
1478 2 20 MET H 2 21 ASP H 4.466 3.896 5.036 4.545 4.525 4.562 . 0 0 "[ . 1]" 1
1479 1 21 ASP H 1 24 LEU QD 2.987 2.465 3.509 3.179 2.935 3.423 . 0 0 "[ . 1]" 1
1480 2 21 ASP H 2 24 LEU QD 2.987 2.465 3.509 3.178 2.930 3.409 . 0 0 "[ . 1]" 1
1481 1 14 ALA H 2 20 MET H 2.675 . 6.000 3.463 3.292 3.602 . 0 0 "[ . 1]" 1
1482 1 20 MET H 2 14 ALA H 2.675 . 6.000 3.458 3.290 3.591 . 0 0 "[ . 1]" 1
1483 1 14 ALA H 1 15 VAL H 3.609 . 6.000 4.393 4.372 4.428 . 0 0 "[ . 1]" 1
1484 2 14 ALA H 2 15 VAL H 3.609 . 6.000 4.394 4.373 4.432 . 0 0 "[ . 1]" 1
1485 1 14 ALA H 2 19 TYR HA 3.917 3.333 4.501 4.156 4.078 4.280 . 0 0 "[ . 1]" 1
1486 1 19 TYR HA 2 14 ALA H 3.917 3.333 4.501 4.151 4.082 4.270 . 0 0 "[ . 1]" 1
1487 1 14 ALA H 2 22 LYS HA 4.132 3.482 4.782 4.429 4.263 4.568 . 0 0 "[ . 1]" 1
1488 1 22 LYS HA 2 14 ALA H 4.132 3.482 4.782 4.430 4.246 4.605 . 0 0 "[ . 1]" 1
1489 1 13 LYS QE 1 14 ALA H 6.353 5.514 7.192 5.937 5.671 6.256 . 0 0 "[ . 1]" 1
1490 2 13 LYS QE 2 14 ALA H 6.353 5.514 7.192 5.935 5.670 6.254 . 0 0 "[ . 1]" 1
1491 1 14 ALA H 2 19 TYR HB3 5.204 4.161 6.247 4.191 4.145 4.331 0.016 10 0 "[ . 1]" 1
1492 1 19 TYR HB3 2 14 ALA H 5.204 4.161 6.247 4.186 4.142 4.337 0.019 1 0 "[ . 1]" 1
1493 1 19 TYR H 1 19 TYR QD 2.950 2.543 3.357 3.190 3.081 3.238 . 0 0 "[ . 1]" 1
1494 2 19 TYR H 2 19 TYR QD 2.950 2.543 3.357 3.194 3.078 3.242 . 0 0 "[ . 1]" 1
1495 1 19 TYR H 1 19 TYR QE 6.170 4.649 7.691 4.899 4.823 4.937 . 0 0 "[ . 1]" 1
1496 2 19 TYR H 2 19 TYR QE 6.170 4.649 7.691 4.902 4.819 4.941 . 0 0 "[ . 1]" 1
1497 1 19 TYR H 1 19 TYR HA 2.826 2.440 3.212 2.940 2.934 2.943 . 0 0 "[ . 1]" 1
1498 2 19 TYR H 2 19 TYR HA 2.826 2.440 3.212 2.939 2.936 2.942 . 0 0 "[ . 1]" 1
1499 1 19 TYR H 1 19 TYR HB2 2.578 2.240 2.916 2.573 2.542 2.617 . 0 0 "[ . 1]" 1
1500 2 19 TYR H 2 19 TYR HB2 2.578 2.240 2.916 2.574 2.542 2.618 . 0 0 "[ . 1]" 1
1501 1 19 TYR H 1 19 TYR HB3 3.832 3.436 4.228 3.724 3.705 3.750 . 0 0 "[ . 1]" 1
1502 2 19 TYR H 2 19 TYR HB3 3.832 3.436 4.228 3.724 3.706 3.752 . 0 0 "[ . 1]" 1
1503 1 19 TYR H 2 40 THR MG 2.453 . 2.984 2.542 2.357 2.766 . 0 0 "[ . 1]" 1
1504 1 40 THR MG 2 19 TYR H 2.453 . 2.984 2.537 2.371 2.753 . 0 0 "[ . 1]" 1
1505 1 18 ILE HG12 1 19 TYR H 4.281 3.811 4.751 4.694 4.562 4.757 0.006 3 0 "[ . 1]" 1
1506 2 18 ILE HG12 2 19 TYR H 4.281 3.811 4.751 4.691 4.562 4.762 0.011 3 0 "[ . 1]" 1
1507 1 18 ILE HG13 1 19 TYR H 3.885 3.298 4.472 3.678 3.486 3.776 . 0 0 "[ . 1]" 1
1508 2 18 ILE HG13 2 19 TYR H 3.885 3.298 4.472 3.674 3.489 3.784 . 0 0 "[ . 1]" 1
1509 1 23 ASP H 1 24 LEU H 2.514 2.210 2.818 2.853 2.810 2.880 0.062 8 0 "[ . 1]" 1
1510 2 23 ASP H 2 24 LEU H 2.514 2.210 2.818 2.855 2.818 2.880 0.062 5 0 "[ . 1]" 1
1511 1 24 LEU H 1 24 LEU HA 2.917 2.544 3.290 2.839 2.815 2.859 . 0 0 "[ . 1]" 1
1512 2 24 LEU H 2 24 LEU HA 2.917 2.544 3.290 2.839 2.815 2.862 . 0 0 "[ . 1]" 1
1513 1 22 LYS HA 1 24 LEU H 3.854 3.257 4.451 4.299 4.182 4.405 . 0 0 "[ . 1]" 1
1514 2 22 LYS HA 2 24 LEU H 3.854 3.257 4.451 4.296 4.180 4.417 . 0 0 "[ . 1]" 1
1515 1 24 LEU H 1 24 LEU HB2 2.975 2.642 3.308 2.720 2.611 2.888 0.031 10 0 "[ . 1]" 1
1516 2 24 LEU H 2 24 LEU HB2 2.975 2.642 3.308 2.720 2.613 2.888 0.029 10 0 "[ . 1]" 1
1517 1 24 LEU H 1 24 LEU HB3 2.330 2.037 2.623 2.168 2.108 2.210 . 0 0 "[ . 1]" 1
1518 2 24 LEU H 2 24 LEU HB3 2.330 2.037 2.623 2.167 2.104 2.204 . 0 0 "[ . 1]" 1
1519 1 24 LEU H 1 24 LEU QD 3.029 2.613 3.445 3.507 3.471 3.557 0.112 8 0 "[ . 1]" 1
1520 2 24 LEU H 2 24 LEU QD 3.029 2.613 3.445 3.506 3.468 3.554 0.109 8 0 "[ . 1]" 1
1521 1 24 LEU H 1 26 THR MG 5.178 4.287 6.069 5.826 5.754 5.901 . 0 0 "[ . 1]" 1
1522 2 24 LEU H 2 26 THR MG 5.178 4.287 6.069 5.825 5.748 5.900 . 0 0 "[ . 1]" 1
1523 1 32 CYS H 1 33 ALA H 2.583 2.250 2.916 2.489 2.448 2.562 . 0 0 "[ . 1]" 1
1524 2 32 CYS H 2 33 ALA H 2.583 2.250 2.916 2.488 2.453 2.558 . 0 0 "[ . 1]" 1
1525 1 40 THR H 1 42 ALA H 4.315 3.626 5.004 4.095 4.051 4.158 . 0 0 "[ . 1]" 1
1526 2 40 THR H 2 42 ALA H 4.315 3.626 5.004 4.097 4.057 4.154 . 0 0 "[ . 1]" 1
1527 1 33 ALA H 1 35 ASN H 3.762 3.306 4.218 4.005 3.947 4.087 . 0 0 "[ . 1]" 1
1528 2 33 ALA H 2 35 ASN H 3.762 3.306 4.218 4.005 3.944 4.078 . 0 0 "[ . 1]" 1
1529 1 42 ALA H 2 50 TYR QE 5.589 4.384 6.794 5.776 5.694 5.856 . 0 0 "[ . 1]" 1
1530 1 50 TYR QE 2 42 ALA H 5.589 4.384 6.794 5.772 5.687 5.854 . 0 0 "[ . 1]" 1
1531 1 41 GLN HA 1 42 ALA H 2.927 . 6.000 3.516 3.504 3.523 . 0 0 "[ . 1]" 1
1532 2 41 GLN HA 2 42 ALA H 2.927 . 6.000 3.516 3.504 3.524 . 0 0 "[ . 1]" 1
1533 1 40 THR HA 1 42 ALA H 3.669 3.136 4.202 4.247 4.234 4.263 0.061 4 0 "[ . 1]" 1
1534 2 40 THR HA 2 42 ALA H 3.669 3.136 4.202 4.248 4.231 4.263 0.061 4 0 "[ . 1]" 1
1535 1 30 VAL HA 1 33 ALA H 2.838 2.467 3.209 3.077 2.978 3.136 . 0 0 "[ . 1]" 1
1536 2 30 VAL HA 2 33 ALA H 2.838 2.467 3.209 3.076 2.977 3.134 . 0 0 "[ . 1]" 1
1537 1 30 VAL HB 1 33 ALA H 6.170 5.081 7.259 5.221 5.123 5.358 . 0 0 "[ . 1]" 1
1538 2 30 VAL HB 2 33 ALA H 6.170 5.081 7.259 5.221 5.129 5.361 . 0 0 "[ . 1]" 1
1539 1 38 GLN QB 1 42 ALA H 4.247 3.723 4.771 3.832 3.686 3.960 0.037 2 0 "[ . 1]" 1
1540 2 38 GLN QB 2 42 ALA H 4.247 3.723 4.771 3.834 3.686 3.961 0.037 2 0 "[ . 1]" 1
1541 1 13 LYS H 1 13 LYS QB 3.464 3.041 3.887 2.907 2.821 3.019 0.220 5 0 "[ . 1]" 1
1542 2 13 LYS H 2 13 LYS QB 3.464 3.041 3.887 2.907 2.824 3.024 0.217 5 0 "[ . 1]" 1
1543 1 30 VAL MG1 1 33 ALA H 2.585 . 6.000 4.317 4.211 4.430 . 0 0 "[ . 1]" 1
1544 2 30 VAL MG1 2 33 ALA H 2.585 . 6.000 4.317 4.213 4.424 . 0 0 "[ . 1]" 1
1545 1 42 ALA H 1 43 ILE MD 2.683 . 6.000 4.165 4.109 4.188 . 0 0 "[ . 1]" 1
1546 2 42 ALA H 2 43 ILE MD 2.683 . 6.000 4.166 4.109 4.189 . 0 0 "[ . 1]" 1
1547 1 49 GLU H 1 50 TYR H 2.533 2.225 2.841 2.606 2.518 2.728 . 0 0 "[ . 1]" 1
1548 2 49 GLU H 2 50 TYR H 2.533 2.225 2.841 2.603 2.517 2.720 . 0 0 "[ . 1]" 1
1549 1 50 TYR H 1 51 LEU H 2.484 2.194 2.774 2.549 2.457 2.631 . 0 0 "[ . 1]" 1
1550 2 50 TYR H 2 51 LEU H 2.484 2.194 2.774 2.550 2.462 2.637 . 0 0 "[ . 1]" 1
1551 1 50 TYR H 1 53 LYS H 4.918 4.069 5.767 4.444 4.397 4.480 . 0 0 "[ . 1]" 1
1552 2 50 TYR H 2 53 LYS H 4.918 4.069 5.767 4.444 4.397 4.483 . 0 0 "[ . 1]" 1
1553 1 50 TYR H 1 50 TYR QD 3.595 3.214 3.976 4.104 4.075 4.127 0.151 9 0 "[ . 1]" 1
1554 2 50 TYR H 2 50 TYR QD 3.595 3.214 3.976 4.104 4.075 4.125 0.149 9 0 "[ . 1]" 1
1555 1 47 ILE HA 1 50 TYR H 3.139 2.787 3.491 3.455 3.411 3.508 0.017 8 0 "[ . 1]" 1
1556 2 47 ILE HA 2 50 TYR H 3.139 2.787 3.491 3.456 3.414 3.506 0.015 8 0 "[ . 1]" 1
1557 1 49 GLU HG2 1 50 TYR H 4.362 . 6.000 5.350 4.814 5.585 . 0 0 "[ . 1]" 1
1558 2 49 GLU HG2 2 50 TYR H 4.362 . 6.000 5.346 4.809 5.589 . 0 0 "[ . 1]" 1
1559 1 49 GLU HG3 1 50 TYR H 5.083 4.463 5.703 5.102 4.875 5.504 . 0 0 "[ . 1]" 1
1560 2 49 GLU HG3 2 50 TYR H 5.083 4.463 5.703 5.099 4.877 5.507 . 0 0 "[ . 1]" 1
1561 1 49 GLU QB 1 50 TYR H 2.866 2.557 3.175 3.146 3.022 3.228 0.053 1 0 "[ . 1]" 1
1562 2 49 GLU QB 2 50 TYR H 2.866 2.557 3.175 3.144 3.009 3.227 0.052 1 0 "[ . 1]" 1
1563 1 48 LYS HB3 1 50 TYR H 3.920 3.475 4.365 4.408 4.375 4.449 0.084 6 0 "[ . 1]" 1
1564 2 48 LYS HB3 2 50 TYR H 3.920 3.475 4.365 4.408 4.374 4.452 0.087 6 0 "[ . 1]" 1
1565 1 50 TYR H 1 51 LEU MD2 3.286 . 6.000 4.227 4.148 4.316 . 0 0 "[ . 1]" 1
1566 2 50 TYR H 2 51 LEU MD2 3.286 . 6.000 4.229 4.143 4.322 . 0 0 "[ . 1]" 1
1567 1 11 LYS H 1 12 GLN QG 4.188 . 6.000 4.985 3.792 6.866 0.866 6 1 "[ .+ 1]" 1
1568 2 11 LYS H 2 12 GLN QG 4.188 . 6.000 4.981 3.797 6.872 0.872 6 1 "[ .+ 1]" 1
1569 1 26 THR H 1 29 LYS H 3.922 3.366 4.478 4.356 4.315 4.399 . 0 0 "[ . 1]" 1
1570 2 26 THR H 2 29 LYS H 3.922 3.366 4.478 4.355 4.318 4.397 . 0 0 "[ . 1]" 1
1571 1 31 TYR H 1 31 TYR QE 4.988 . 6.000 6.166 6.155 6.173 0.173 8 0 "[ . 1]" 1
1572 2 31 TYR H 2 31 TYR QE 4.988 . 6.000 6.166 6.157 6.175 0.175 9 0 "[ . 1]" 1
1573 1 30 VAL HA 1 31 TYR H 2.993 2.624 3.362 3.459 3.454 3.464 0.102 9 0 "[ . 1]" 1
1574 2 30 VAL HA 2 31 TYR H 2.993 2.624 3.362 3.459 3.451 3.462 0.100 9 0 "[ . 1]" 1
1575 1 25 LYS HA 1 28 LEU H 3.236 2.766 3.706 3.693 3.626 3.792 0.086 8 0 "[ . 1]" 1
1576 2 25 LYS HA 2 28 LEU H 3.236 2.766 3.706 3.692 3.630 3.792 0.086 8 0 "[ . 1]" 1
1577 1 30 VAL HB 1 31 TYR H 2.404 2.114 2.694 2.717 2.697 2.744 0.050 1 0 "[ . 1]" 1
1578 2 30 VAL HB 2 31 TYR H 2.404 2.114 2.694 2.716 2.699 2.749 0.055 1 0 "[ . 1]" 1
1579 1 28 LEU H 1 28 LEU HB2 2.296 2.021 2.571 2.312 2.245 2.359 . 0 0 "[ . 1]" 1
1580 2 28 LEU H 2 28 LEU HB2 2.296 2.021 2.571 2.312 2.239 2.360 . 0 0 "[ . 1]" 1
1581 1 30 VAL MG2 1 31 TYR H 2.937 . 6.000 3.790 3.743 3.827 . 0 0 "[ . 1]" 1
1582 2 30 VAL MG2 2 31 TYR H 2.937 . 6.000 3.789 3.744 3.828 . 0 0 "[ . 1]" 1
1583 1 28 LEU H 1 28 LEU MD1 3.077 . 6.000 4.162 4.150 4.180 . 0 0 "[ . 1]" 1
1584 2 28 LEU H 2 28 LEU MD1 3.077 . 6.000 4.161 4.152 4.179 . 0 0 "[ . 1]" 1
1585 1 28 LEU H 2 51 LEU MD1 3.071 . 6.000 4.209 4.126 4.315 . 0 0 "[ . 1]" 1
1586 1 51 LEU MD1 2 28 LEU H 3.071 . 6.000 4.210 4.119 4.310 . 0 0 "[ . 1]" 1
1587 1 27 ARG H 1 28 LEU H 2.647 2.304 2.990 2.804 2.781 2.825 . 0 0 "[ . 1]" 1
1588 2 27 ARG H 2 28 LEU H 2.647 2.304 2.990 2.802 2.774 2.837 . 0 0 "[ . 1]" 1
1589 1 30 VAL H 1 31 TYR H 2.630 2.280 2.980 2.521 2.477 2.542 . 0 0 "[ . 1]" 1
1590 2 30 VAL H 2 31 TYR H 2.630 2.280 2.980 2.521 2.480 2.539 . 0 0 "[ . 1]" 1
1591 1 48 LYS H 1 50 TYR H 2.829 . 6.000 3.584 3.497 3.669 . 0 0 "[ . 1]" 1
1592 2 48 LYS H 2 50 TYR H 2.829 . 6.000 3.581 3.494 3.665 . 0 0 "[ . 1]" 1
1593 1 15 VAL H 2 19 TYR QE 3.472 . 6.000 5.295 5.169 5.469 . 0 0 "[ . 1]" 1
1594 1 19 TYR QE 2 15 VAL H 3.472 . 6.000 5.292 5.144 5.473 . 0 0 "[ . 1]" 1
1595 1 15 VAL H 2 19 TYR HA 5.966 . 6.000 4.695 4.655 4.725 . 0 0 "[ . 1]" 1
1596 1 19 TYR HA 2 15 VAL H 5.966 . 6.000 4.694 4.661 4.727 . 0 0 "[ . 1]" 1
1597 1 28 LEU HA 1 30 VAL H 4.787 3.914 5.660 4.220 4.139 4.325 . 0 0 "[ . 1]" 1
1598 2 28 LEU HA 2 30 VAL H 4.787 3.914 5.660 4.218 4.140 4.316 . 0 0 "[ . 1]" 1
1599 1 45 GLU HA 1 48 LYS H 3.114 2.755 3.473 3.490 3.427 3.554 0.081 8 0 "[ . 1]" 1
1600 2 45 GLU HA 2 48 LYS H 3.114 2.755 3.473 3.489 3.421 3.558 0.085 8 0 "[ . 1]" 1
1601 1 26 THR HA 1 27 ARG H 3.074 2.696 3.452 3.503 3.489 3.523 0.071 10 0 "[ . 1]" 1
1602 2 26 THR HA 2 27 ARG H 3.074 2.696 3.452 3.502 3.486 3.526 0.074 10 0 "[ . 1]" 1
1603 1 48 LYS H 1 48 LYS HA 2.649 2.272 3.026 2.839 2.818 2.856 . 0 0 "[ . 1]" 1
1604 2 48 LYS H 2 48 LYS HA 2.649 2.272 3.026 2.839 2.821 2.856 . 0 0 "[ . 1]" 1
1605 1 27 ARG QD 1 30 VAL H 3.738 . 6.000 4.608 4.414 4.835 . 0 0 "[ . 1]" 1
1606 2 27 ARG QD 2 30 VAL H 3.738 . 6.000 4.610 4.414 4.835 . 0 0 "[ . 1]" 1
1607 1 48 LYS H 1 48 LYS HB3 2.118 . 2.352 2.384 2.321 2.427 0.075 4 0 "[ . 1]" 1
1608 2 48 LYS H 2 48 LYS HB3 2.118 . 2.352 2.381 2.317 2.423 0.071 4 0 "[ . 1]" 1
1609 1 15 VAL H 1 15 VAL HB 2.593 2.288 2.898 2.862 2.838 2.909 0.011 5 0 "[ . 1]" 1
1610 2 15 VAL H 2 15 VAL HB 2.593 2.288 2.898 2.862 2.837 2.906 0.008 5 0 "[ . 1]" 1
1611 1 48 LYS H 1 48 LYS HB2 2.368 2.114 2.622 2.643 2.614 2.677 0.055 10 0 "[ . 1]" 1
1612 2 48 LYS H 2 48 LYS HB2 2.368 2.114 2.622 2.644 2.616 2.678 0.056 10 0 "[ . 1]" 1
1613 1 29 LYS QG 1 30 VAL H 3.944 3.516 4.372 4.136 3.987 4.209 . 0 0 "[ . 1]" 1
1614 2 29 LYS QG 2 30 VAL H 3.944 3.516 4.372 4.135 3.998 4.203 . 0 0 "[ . 1]" 1
1615 1 14 ALA MB 1 15 VAL H 1.932 . 2.247 2.286 2.218 2.355 0.108 8 0 "[ . 1]" 1
1616 2 14 ALA MB 2 15 VAL H 1.932 . 2.247 2.289 2.223 2.355 0.108 8 0 "[ . 1]" 1
1617 1 27 ARG H 2 51 LEU MD2 3.424 . 6.000 4.617 4.560 4.660 . 0 0 "[ . 1]" 1
1618 1 51 LEU MD2 2 27 ARG H 3.424 . 6.000 4.614 4.581 4.650 . 0 0 "[ . 1]" 1
1619 1 15 VAL H 1 15 VAL MG1 2.510 . 6.000 3.889 3.865 3.915 . 0 0 "[ . 1]" 1
1620 2 15 VAL H 2 15 VAL MG1 2.510 . 6.000 3.889 3.868 3.912 . 0 0 "[ . 1]" 1
1621 1 42 ALA H 1 46 ALA H 4.076 . 6.000 5.759 5.707 5.789 . 0 0 "[ . 1]" 1
1622 2 42 ALA H 2 46 ALA H 4.076 . 6.000 5.756 5.710 5.792 . 0 0 "[ . 1]" 1
1623 1 46 ALA H 2 50 TYR QD 3.666 . 6.000 4.250 4.212 4.291 . 0 0 "[ . 1]" 1
1624 1 50 TYR QD 2 46 ALA H 3.666 . 6.000 4.248 4.206 4.283 . 0 0 "[ . 1]" 1
1625 1 46 ALA H 2 50 TYR QE 3.741 3.189 4.293 4.086 4.025 4.144 . 0 0 "[ . 1]" 1
1626 1 50 TYR QE 2 46 ALA H 3.741 3.189 4.293 4.083 4.031 4.139 . 0 0 "[ . 1]" 1
1627 1 22 LYS HA 1 23 ASP H 3.494 3.072 3.916 3.548 3.527 3.565 . 0 0 "[ . 1]" 1
1628 2 22 LYS HA 2 23 ASP H 3.494 3.072 3.916 3.549 3.527 3.566 . 0 0 "[ . 1]" 1
1629 1 44 GLU HA 1 46 ALA H 3.832 3.221 4.443 4.223 4.142 4.277 . 0 0 "[ . 1]" 1
1630 2 44 GLU HA 2 46 ALA H 3.832 3.221 4.443 4.222 4.134 4.265 . 0 0 "[ . 1]" 1
1631 1 48 LYS H 1 50 TYR QB 3.850 3.342 4.358 4.196 4.136 4.262 . 0 0 "[ . 1]" 1
1632 2 48 LYS H 2 50 TYR QB 3.850 3.342 4.358 4.194 4.131 4.267 . 0 0 "[ . 1]" 1
1633 1 22 LYS QG 1 23 ASP H 2.690 2.391 2.989 2.994 2.921 3.043 0.054 3 0 "[ . 1]" 1
1634 2 22 LYS QG 2 23 ASP H 2.690 2.391 2.989 2.993 2.917 3.040 0.051 3 0 "[ . 1]" 1
1635 1 30 VAL H 2 51 LEU MD2 3.834 . 6.000 5.587 5.519 5.664 . 0 0 "[ . 1]" 1
1636 1 51 LEU MD2 2 30 VAL H 3.834 . 6.000 5.585 5.520 5.651 . 0 0 "[ . 1]" 1
1637 1 16 PHE QR 1 18 ILE H 3.527 . 6.000 4.286 4.209 4.325 . 0 0 "[ . 1]" 1
1638 2 16 PHE QR 2 18 ILE H 3.527 . 6.000 4.285 4.210 4.320 . 0 0 "[ . 1]" 1
1639 1 19 TYR HA 1 20 MET H 2.228 . 2.497 2.169 2.144 2.196 . 0 0 "[ . 1]" 1
1640 2 19 TYR HA 2 20 MET H 2.228 . 2.497 2.170 2.144 2.199 . 0 0 "[ . 1]" 1
1641 1 20 MET H 1 20 MET HA 3.154 2.701 3.607 2.949 2.946 2.954 . 0 0 "[ . 1]" 1
1642 2 20 MET H 2 20 MET HA 3.154 2.701 3.607 2.948 2.944 2.952 . 0 0 "[ . 1]" 1
1643 1 20 MET H 2 15 VAL HA 3.388 2.943 3.833 3.248 3.157 3.406 . 0 0 "[ . 1]" 1
1644 1 15 VAL HA 2 20 MET H 3.388 2.943 3.833 3.252 3.161 3.412 . 0 0 "[ . 1]" 1
1645 1 17 GLY HA3 1 18 ILE H 3.792 3.444 4.140 3.443 3.424 3.463 0.020 9 0 "[ . 1]" 1
1646 2 17 GLY HA3 2 18 ILE H 3.792 3.444 4.140 3.443 3.424 3.469 0.020 9 0 "[ . 1]" 1
1647 1 20 MET H 1 20 MET HG2 2.408 2.039 2.777 2.111 1.991 2.837 0.060 8 0 "[ . 1]" 1
1648 2 20 MET H 2 20 MET HG2 2.408 2.039 2.777 2.110 1.989 2.841 0.064 8 0 "[ . 1]" 1
1649 1 22 LYS QB 1 23 ASP H 2.401 2.108 2.694 2.158 2.125 2.218 . 0 0 "[ . 1]" 1
1650 2 22 LYS QB 2 23 ASP H 2.401 2.108 2.694 2.157 2.117 2.219 . 0 0 "[ . 1]" 1
1651 1 18 ILE H 1 18 ILE HB 3.718 3.210 4.226 3.784 3.769 3.803 . 0 0 "[ . 1]" 1
1652 2 18 ILE H 2 18 ILE HB 3.718 3.210 4.226 3.785 3.767 3.806 . 0 0 "[ . 1]" 1
1653 1 46 ALA HA 1 47 ILE H 3.443 2.946 3.940 3.546 3.539 3.558 . 0 0 "[ . 1]" 1
1654 2 46 ALA HA 2 47 ILE H 3.443 2.946 3.940 3.545 3.540 3.553 . 0 0 "[ . 1]" 1
1655 1 44 GLU HA 1 47 ILE H 3.220 2.773 3.667 3.483 3.432 3.537 . 0 0 "[ . 1]" 1
1656 2 44 GLU HA 2 47 ILE H 3.220 2.773 3.667 3.483 3.438 3.535 . 0 0 "[ . 1]" 1
1657 1 52 GLN H 1 52 GLN HG2 3.940 3.576 4.304 4.196 4.118 4.262 . 0 0 "[ . 1]" 1
1658 2 52 GLN H 2 52 GLN HG2 3.940 3.576 4.304 4.198 4.123 4.261 . 0 0 "[ . 1]" 1
1659 1 51 LEU HB3 1 52 GLN H 2.988 2.638 3.338 3.351 3.289 3.407 0.069 9 0 "[ . 1]" 1
1660 2 51 LEU HB3 2 52 GLN H 2.988 2.638 3.338 3.352 3.289 3.410 0.072 9 0 "[ . 1]" 1
1661 1 51 LEU MD1 1 52 GLN H 2.785 . 6.000 4.449 4.410 4.476 . 0 0 "[ . 1]" 1
1662 2 51 LEU MD1 2 52 GLN H 2.785 . 6.000 4.450 4.411 4.471 . 0 0 "[ . 1]" 1
1663 1 38 GLN H 1 41 GLN HE22 3.790 3.315 4.265 3.758 3.471 4.050 . 0 0 "[ . 1]" 1
1664 2 38 GLN H 2 41 GLN HE22 3.790 3.315 4.265 3.761 3.463 4.054 . 0 0 "[ . 1]" 1
1665 1 38 GLN H 1 41 GLN H 4.232 3.737 4.727 4.270 4.116 4.389 . 0 0 "[ . 1]" 1
1666 2 38 GLN H 2 41 GLN H 4.232 3.737 4.727 4.269 4.118 4.400 . 0 0 "[ . 1]" 1
1667 1 52 GLN H 1 54 ARG H 4.067 3.488 4.646 3.731 3.686 3.760 . 0 0 "[ . 1]" 1
1668 2 52 GLN H 2 54 ARG H 4.067 3.488 4.646 3.729 3.683 3.762 . 0 0 "[ . 1]" 1
1669 1 37 LEU HA 1 38 GLN H 2.424 2.135 2.713 2.364 2.336 2.393 . 0 0 "[ . 1]" 1
1670 2 37 LEU HA 2 38 GLN H 2.424 2.135 2.713 2.364 2.342 2.392 . 0 0 "[ . 1]" 1
1671 1 38 GLN H 1 41 GLN HA 6.053 5.277 6.829 5.622 5.510 5.722 . 0 0 "[ . 1]" 1
1672 2 38 GLN H 2 41 GLN HA 6.053 5.277 6.829 5.622 5.502 5.735 . 0 0 "[ . 1]" 1
1673 1 52 GLN H 1 52 GLN HA 2.784 2.475 3.093 2.872 2.857 2.883 . 0 0 "[ . 1]" 1
1674 2 52 GLN H 2 52 GLN HA 2.784 2.475 3.093 2.872 2.856 2.884 . 0 0 "[ . 1]" 1
1675 1 52 GLN H 1 52 GLN HB2 2.310 2.010 2.610 2.252 2.160 2.327 . 0 0 "[ . 1]" 1
1676 2 52 GLN H 2 52 GLN HB2 2.310 2.010 2.610 2.254 2.156 2.331 . 0 0 "[ . 1]" 1
1677 1 37 LEU HG 1 38 GLN H 2.624 2.306 2.942 2.819 2.718 2.963 0.021 4 0 "[ . 1]" 1
1678 2 37 LEU HG 2 38 GLN H 2.624 2.306 2.942 2.820 2.715 2.958 0.016 4 0 "[ . 1]" 1
1679 1 37 LEU MD1 1 38 GLN H 2.875 . 6.000 3.790 3.682 3.861 . 0 0 "[ . 1]" 1
1680 2 37 LEU MD1 2 38 GLN H 2.875 . 6.000 3.792 3.684 3.866 . 0 0 "[ . 1]" 1
1681 1 41 GLN H 1 42 ALA H 2.521 2.226 2.816 2.724 2.683 2.757 . 0 0 "[ . 1]" 1
1682 2 41 GLN H 2 42 ALA H 2.521 2.226 2.816 2.724 2.703 2.752 . 0 0 "[ . 1]" 1
1683 1 38 GLN HA 1 41 GLN H 5.276 4.520 6.032 4.520 4.494 4.566 0.026 4 0 "[ . 1]" 1
1684 2 38 GLN HA 2 41 GLN H 5.276 4.520 6.032 4.524 4.489 4.570 0.031 4 0 "[ . 1]" 1
1685 1 41 GLN H 1 41 GLN HB2 2.039 . 2.271 2.324 2.258 2.371 0.100 2 0 "[ . 1]" 1
1686 2 41 GLN H 2 41 GLN HB2 2.039 . 2.271 2.324 2.268 2.374 0.103 2 0 "[ . 1]" 1
1687 1 39 LEU HB3 1 41 GLN H 4.104 . 6.000 5.117 5.080 5.217 . 0 0 "[ . 1]" 1
1688 2 39 LEU HB3 2 41 GLN H 4.104 . 6.000 5.119 5.071 5.225 . 0 0 "[ . 1]" 1
1689 1 41 GLN H 1 42 ALA MB 2.811 . 6.000 4.388 4.355 4.428 . 0 0 "[ . 1]" 1
1690 2 41 GLN H 2 42 ALA MB 2.811 . 6.000 4.388 4.368 4.414 . 0 0 "[ . 1]" 1
1691 1 23 ASP H 1 25 LYS H 4.104 . 6.000 4.661 4.598 4.784 . 0 0 "[ . 1]" 1
1692 2 23 ASP H 2 25 LYS H 4.104 . 6.000 4.665 4.588 4.782 . 0 0 "[ . 1]" 1
1693 1 21 ASP HA 1 25 LYS H 4.082 . 6.000 5.233 5.153 5.340 . 0 0 "[ . 1]" 1
1694 2 21 ASP HA 2 25 LYS H 4.082 . 6.000 5.235 5.151 5.341 . 0 0 "[ . 1]" 1
1695 1 24 LEU HA 1 25 LYS H 3.679 3.159 4.199 3.595 3.572 3.608 . 0 0 "[ . 1]" 1
1696 2 24 LEU HA 2 25 LYS H 3.679 3.159 4.199 3.595 3.572 3.607 . 0 0 "[ . 1]" 1
1697 1 22 LYS HA 1 25 LYS H 3.210 2.784 3.636 3.723 3.676 3.824 0.188 8 0 "[ . 1]" 1
1698 2 22 LYS HA 2 25 LYS H 3.210 2.784 3.636 3.721 3.671 3.818 0.182 8 0 "[ . 1]" 1
1699 1 25 LYS H 1 25 LYS HA 2.609 2.273 2.945 2.806 2.774 2.819 . 0 0 "[ . 1]" 1
1700 2 25 LYS H 2 25 LYS HA 2.609 2.273 2.945 2.806 2.775 2.822 . 0 0 "[ . 1]" 1
1701 1 24 LEU HB3 1 25 LYS H 2.190 . 2.465 2.427 2.372 2.469 0.004 3 0 "[ . 1]" 1
1702 2 24 LEU HB3 2 25 LYS H 2.190 . 2.465 2.427 2.374 2.476 0.011 3 0 "[ . 1]" 1
1703 1 25 LYS H 1 25 LYS HG2 3.870 . 6.000 4.485 4.464 4.531 . 0 0 "[ . 1]" 1
1704 2 25 LYS H 2 25 LYS HG2 3.870 . 6.000 4.487 4.468 4.529 . 0 0 "[ . 1]" 1
1705 1 25 LYS H 1 25 LYS HG3 3.717 . 6.000 4.317 4.169 4.366 . 0 0 "[ . 1]" 1
1706 2 25 LYS H 2 25 LYS HG3 3.717 . 6.000 4.316 4.168 4.370 . 0 0 "[ . 1]" 1
1707 1 42 ALA H 1 45 GLU H 4.684 3.918 5.450 4.662 4.626 4.736 . 0 0 "[ . 1]" 1
1708 2 42 ALA H 2 45 GLU H 4.684 3.918 5.450 4.662 4.626 4.739 . 0 0 "[ . 1]" 1
1709 1 45 GLU H 2 50 TYR QD 6.375 4.984 7.766 6.070 6.002 6.117 . 0 0 "[ . 1]" 1
1710 1 50 TYR QD 2 45 GLU H 6.375 4.984 7.766 6.069 5.996 6.122 . 0 0 "[ . 1]" 1
1711 1 45 GLU H 2 50 TYR QE 4.444 . 6.000 5.159 5.112 5.209 . 0 0 "[ . 1]" 1
1712 1 50 TYR QE 2 45 GLU H 4.444 . 6.000 5.157 5.107 5.204 . 0 0 "[ . 1]" 1
1713 1 41 GLN HA 1 45 GLU H 4.155 3.528 4.782 4.013 3.930 4.072 . 0 0 "[ . 1]" 1
1714 2 41 GLN HA 2 45 GLU H 4.155 3.528 4.782 4.010 3.931 4.077 . 0 0 "[ . 1]" 1
1715 1 45 GLU H 1 45 GLU HA 2.656 2.346 2.966 2.818 2.786 2.840 . 0 0 "[ . 1]" 1
1716 2 45 GLU H 2 45 GLU HA 2.656 2.346 2.966 2.818 2.788 2.842 . 0 0 "[ . 1]" 1
1717 1 44 GLU HA 1 45 GLU H 3.288 2.836 3.740 3.556 3.551 3.568 . 0 0 "[ . 1]" 1
1718 2 44 GLU HA 2 45 GLU H 3.288 2.836 3.740 3.556 3.549 3.567 . 0 0 "[ . 1]" 1
1719 1 43 ILE HA 1 45 GLU H 4.187 3.587 4.787 4.634 4.556 4.778 . 0 0 "[ . 1]" 1
1720 2 43 ILE HA 2 45 GLU H 4.187 3.587 4.787 4.636 4.563 4.780 . 0 0 "[ . 1]" 1
1721 1 44 GLU HB2 1 45 GLU H 2.466 2.144 2.788 2.519 2.467 2.574 . 0 0 "[ . 1]" 1
1722 2 44 GLU HB2 2 45 GLU H 2.466 2.144 2.788 2.518 2.464 2.577 . 0 0 "[ . 1]" 1
1723 1 42 ALA MB 1 45 GLU H 3.211 . 6.000 4.630 4.576 4.714 . 0 0 "[ . 1]" 1
1724 2 42 ALA MB 2 45 GLU H 3.211 . 6.000 4.631 4.575 4.717 . 0 0 "[ . 1]" 1
1725 1 44 GLU H 1 46 ALA H 3.833 3.263 4.403 3.862 3.795 3.935 . 0 0 "[ . 1]" 1
1726 2 44 GLU H 2 46 ALA H 3.833 3.263 4.403 3.861 3.795 3.921 . 0 0 "[ . 1]" 1
1727 1 41 GLN H 1 44 GLU H 5.790 4.531 7.049 4.756 4.700 4.797 . 0 0 "[ . 1]" 1
1728 2 41 GLN H 2 44 GLU H 5.790 4.531 7.049 4.755 4.693 4.799 . 0 0 "[ . 1]" 1
1729 1 41 GLN HA 1 44 GLU H 3.221 2.818 3.624 3.593 3.497 3.642 0.018 8 0 "[ . 1]" 1
1730 2 41 GLN HA 2 44 GLU H 3.221 2.818 3.624 3.593 3.495 3.649 0.025 8 0 "[ . 1]" 1
1731 1 40 THR HA 1 44 GLU H 3.881 3.299 4.463 4.013 3.980 4.047 . 0 0 "[ . 1]" 1
1732 2 40 THR HA 2 44 GLU H 3.881 3.299 4.463 4.014 3.990 4.047 . 0 0 "[ . 1]" 1
1733 1 44 GLU H 1 44 GLU HA 2.516 2.209 2.823 2.809 2.800 2.813 . 0 0 "[ . 1]" 1
1734 2 44 GLU H 2 44 GLU HA 2.516 2.209 2.823 2.809 2.801 2.813 . 0 0 "[ . 1]" 1
1735 1 43 ILE HA 1 44 GLU H 3.240 2.775 3.705 3.528 3.521 3.536 . 0 0 "[ . 1]" 1
1736 2 43 ILE HA 2 44 GLU H 3.240 2.775 3.705 3.528 3.519 3.534 . 0 0 "[ . 1]" 1
1737 1 44 GLU H 1 44 GLU HB2 2.422 2.117 2.727 2.490 2.461 2.510 . 0 0 "[ . 1]" 1
1738 2 44 GLU H 2 44 GLU HB2 2.422 2.117 2.727 2.490 2.459 2.509 . 0 0 "[ . 1]" 1
1739 1 44 GLU H 1 44 GLU HG3 2.019 . 2.256 2.208 2.155 2.260 0.004 10 0 "[ . 1]" 1
1740 2 44 GLU H 2 44 GLU HG3 2.019 . 2.256 2.208 2.146 2.265 0.009 8 0 "[ . 1]" 1
1741 1 43 ILE HB 1 44 GLU H 2.528 2.218 2.838 2.767 2.756 2.790 . 0 0 "[ . 1]" 1
1742 2 43 ILE HB 2 44 GLU H 2.528 2.218 2.838 2.766 2.754 2.791 . 0 0 "[ . 1]" 1
1743 1 40 THR MG 1 44 GLU H 2.703 . 6.000 3.910 3.872 3.938 . 0 0 "[ . 1]" 1
1744 2 40 THR MG 2 44 GLU H 2.703 . 6.000 3.908 3.880 3.932 . 0 0 "[ . 1]" 1
1745 1 43 ILE MG 1 44 GLU H 2.085 . 2.444 2.567 2.551 2.588 0.144 10 0 "[ . 1]" 1
1746 2 43 ILE MG 2 44 GLU H 2.085 . 2.444 2.567 2.554 2.587 0.143 10 0 "[ . 1]" 1
1747 1 49 GLU H 2 50 TYR QD 3.946 3.323 4.569 4.446 4.337 4.540 . 0 0 "[ . 1]" 1
1748 1 50 TYR QD 2 49 GLU H 3.946 3.323 4.569 4.446 4.346 4.531 . 0 0 "[ . 1]" 1
1749 1 48 LYS HA 1 49 GLU H 3.037 . 6.000 3.575 3.558 3.596 . 0 0 "[ . 1]" 1
1750 2 48 LYS HA 2 49 GLU H 3.037 . 6.000 3.573 3.554 3.594 . 0 0 "[ . 1]" 1
1751 1 47 ILE HA 1 49 GLU H 4.559 3.867 5.251 4.857 4.710 5.003 . 0 0 "[ . 1]" 1
1752 2 47 ILE HA 2 49 GLU H 4.559 3.867 5.251 4.854 4.708 4.994 . 0 0 "[ . 1]" 1
1753 1 49 GLU H 1 49 GLU QB 2.334 2.070 2.598 2.227 2.134 2.261 . 0 0 "[ . 1]" 1
1754 2 49 GLU H 2 49 GLU QB 2.334 2.070 2.598 2.226 2.130 2.260 . 0 0 "[ . 1]" 1
1755 1 48 LYS HB3 1 49 GLU H 2.150 . 2.437 2.242 2.135 2.353 . 0 0 "[ . 1]" 1
1756 2 48 LYS HB3 2 49 GLU H 2.150 . 2.437 2.243 2.134 2.358 . 0 0 "[ . 1]" 1
1757 1 48 LYS HB2 1 49 GLU H 4.166 . 6.000 3.711 3.637 3.802 . 0 0 "[ . 1]" 1
1758 2 48 LYS HB2 2 49 GLU H 4.166 . 6.000 3.710 3.635 3.805 . 0 0 "[ . 1]" 1
1759 1 48 LYS QG 1 49 GLU H 3.974 . 6.000 3.125 3.032 3.277 . 0 0 "[ . 1]" 1
1760 2 48 LYS QG 2 49 GLU H 3.974 . 6.000 3.126 3.035 3.277 . 0 0 "[ . 1]" 1
1761 1 52 GLN H 1 53 LYS H 2.582 2.256 2.908 2.474 2.434 2.544 . 0 0 "[ . 1]" 1
1762 2 52 GLN H 2 53 LYS H 2.582 2.256 2.908 2.473 2.430 2.549 . 0 0 "[ . 1]" 1
1763 1 31 TYR QE 1 32 CYS H 5.083 4.128 6.038 5.603 5.501 5.697 . 0 0 "[ . 1]" 1
1764 2 31 TYR QE 2 32 CYS H 5.083 4.128 6.038 5.605 5.498 5.694 . 0 0 "[ . 1]" 1
1765 1 28 LEU HA 1 32 CYS H 4.049 3.536 4.562 4.134 4.090 4.191 . 0 0 "[ . 1]" 1
1766 2 28 LEU HA 2 32 CYS H 4.049 3.536 4.562 4.133 4.088 4.196 . 0 0 "[ . 1]" 1
1767 1 51 LEU HA 1 53 LYS H 4.239 3.610 4.868 4.389 4.257 4.524 . 0 0 "[ . 1]" 1
1768 2 51 LEU HA 2 53 LYS H 4.239 3.610 4.868 4.390 4.259 4.509 . 0 0 "[ . 1]" 1
1769 1 32 CYS H 1 32 CYS HB3 3.729 3.374 4.084 3.603 3.596 3.611 . 0 0 "[ . 1]" 1
1770 2 32 CYS H 2 32 CYS HB3 3.729 3.374 4.084 3.603 3.595 3.609 . 0 0 "[ . 1]" 1
1771 1 52 GLN HG2 1 53 LYS H 4.805 4.298 5.312 5.305 5.231 5.367 0.055 6 0 "[ . 1]" 1
1772 2 52 GLN HG2 2 53 LYS H 4.805 4.298 5.312 5.306 5.224 5.365 0.053 6 0 "[ . 1]" 1
1773 1 30 VAL HB 1 32 CYS H 4.486 3.923 5.049 4.999 4.989 5.008 . 0 0 "[ . 1]" 1
1774 2 30 VAL HB 2 32 CYS H 4.486 3.923 5.049 4.997 4.982 5.005 . 0 0 "[ . 1]" 1
1775 1 28 LEU MD2 1 32 CYS H 2.633 . 6.000 3.704 3.644 3.763 . 0 0 "[ . 1]" 1
1776 2 28 LEU MD2 2 32 CYS H 2.633 . 6.000 3.705 3.646 3.757 . 0 0 "[ . 1]" 1
1777 1 50 TYR QE 1 51 LEU H 3.774 . 6.000 5.287 5.240 5.314 . 0 0 "[ . 1]" 1
1778 2 50 TYR QE 2 51 LEU H 3.774 . 6.000 5.288 5.243 5.330 . 0 0 "[ . 1]" 1
1779 1 37 LEU H 1 37 LEU HA 2.818 2.457 3.179 2.846 2.804 2.863 . 0 0 "[ . 1]" 1
1780 2 37 LEU H 2 37 LEU HA 2.818 2.457 3.179 2.848 2.805 2.866 . 0 0 "[ . 1]" 1
1781 1 36 ASN HA 1 37 LEU H 2.627 . 6.000 2.979 2.947 3.013 . 0 0 "[ . 1]" 1
1782 2 36 ASN HA 2 37 LEU H 2.627 . 6.000 2.976 2.954 3.017 . 0 0 "[ . 1]" 1
1783 1 50 TYR HA 1 51 LEU H 3.149 2.790 3.508 3.545 3.537 3.553 0.045 4 0 "[ . 1]" 1
1784 2 50 TYR HA 2 51 LEU H 3.149 2.790 3.508 3.545 3.536 3.553 0.045 4 0 "[ . 1]" 1
1785 1 31 TYR HA 1 35 ASN HD22 4.223 3.701 4.745 3.933 3.707 4.125 . 0 0 "[ . 1]" 1
1786 2 31 TYR HA 2 35 ASN HD22 4.223 3.701 4.745 3.934 3.699 4.111 0.002 2 0 "[ . 1]" 1
1787 1 36 ASN HB2 1 37 LEU H 3.624 3.114 4.134 4.032 4.006 4.059 . 0 0 "[ . 1]" 1
1788 2 36 ASN HB2 2 37 LEU H 3.624 3.114 4.134 4.032 4.000 4.063 . 0 0 "[ . 1]" 1
1789 1 35 ASN HB3 1 35 ASN HD22 4.156 3.763 4.549 4.057 4.051 4.065 . 0 0 "[ . 1]" 1
1790 2 35 ASN HB3 2 35 ASN HD22 4.156 3.763 4.549 4.057 4.050 4.063 . 0 0 "[ . 1]" 1
1791 1 35 ASN HD21 1 37 LEU HB2 3.788 3.309 4.267 4.222 4.167 4.302 0.035 10 0 "[ . 1]" 1
1792 2 35 ASN HD21 2 37 LEU HB2 3.788 3.309 4.267 4.224 4.156 4.315 0.048 10 0 "[ . 1]" 1
1793 1 37 LEU H 1 37 LEU HB2 2.066 . 2.329 2.062 2.041 2.083 . 0 0 "[ . 1]" 1
1794 2 37 LEU H 2 37 LEU HB2 2.066 . 2.329 2.064 2.040 2.085 . 0 0 "[ . 1]" 1
1795 1 35 ASN HD22 1 37 LEU MD2 3.983 3.192 4.774 4.741 4.545 4.798 0.024 5 0 "[ . 1]" 1
1796 2 35 ASN HD22 2 37 LEU MD2 3.983 3.192 4.774 4.742 4.542 4.801 0.027 2 0 "[ . 1]" 1
1797 1 51 LEU H 1 51 LEU MD2 2.118 . 2.525 2.510 2.441 2.559 0.034 1 0 "[ . 1]" 1
1798 2 51 LEU H 2 51 LEU MD2 2.118 . 2.525 2.510 2.440 2.558 0.033 1 0 "[ . 1]" 1
1799 1 51 LEU H 1 51 LEU MD1 2.329 . 6.000 3.050 2.929 3.153 . 0 0 "[ . 1]" 1
1800 2 51 LEU H 2 51 LEU MD1 2.329 . 6.000 3.050 2.930 3.160 . 0 0 "[ . 1]" 1
1801 1 34 LYS H 1 35 ASN HD21 4.128 3.595 4.661 4.085 4.004 4.161 . 0 0 "[ . 1]" 1
1802 2 34 LYS H 2 35 ASN HD21 4.128 3.595 4.661 4.086 4.019 4.165 . 0 0 "[ . 1]" 1
1803 1 34 LYS H 1 35 ASN HA 6.114 5.194 7.034 5.211 5.169 5.242 0.025 2 0 "[ . 1]" 1
1804 2 34 LYS H 2 35 ASN HA 6.114 5.194 7.034 5.212 5.167 5.249 0.027 2 0 "[ . 1]" 1
1805 1 30 VAL HA 1 34 LYS H 3.518 3.044 3.992 3.964 3.897 4.016 0.024 7 0 "[ . 1]" 1
1806 2 30 VAL HA 2 34 LYS H 3.518 3.044 3.992 3.962 3.894 4.012 0.020 7 0 "[ . 1]" 1
1807 1 34 LYS H 1 35 ASN HB2 5.115 4.442 5.788 4.823 4.762 4.870 . 0 0 "[ . 1]" 1
1808 2 34 LYS H 2 35 ASN HB2 5.115 4.442 5.788 4.824 4.766 4.877 . 0 0 "[ . 1]" 1
1809 1 30 VAL MG1 1 34 LYS H 2.692 . 6.000 3.860 3.821 3.934 . 0 0 "[ . 1]" 1
1810 2 30 VAL MG1 2 34 LYS H 2.692 . 6.000 3.857 3.812 3.939 . 0 0 "[ . 1]" 1
1811 1 35 ASN HD22 1 36 ASN H 6.003 5.380 6.626 5.979 5.938 6.022 . 0 0 "[ . 1]" 1
1812 2 35 ASN HD22 2 36 ASN H 6.003 5.380 6.626 5.979 5.938 6.027 . 0 0 "[ . 1]" 1
1813 1 36 ASN H 1 36 ASN QD 4.510 3.961 5.059 4.125 3.611 4.399 0.350 6 0 "[ . 1]" 1
1814 2 36 ASN H 2 36 ASN QD 4.510 3.961 5.059 4.129 3.608 4.412 0.353 6 0 "[ . 1]" 1
1815 1 35 ASN HD21 1 36 ASN H 5.158 4.528 5.788 4.616 4.566 4.681 . 0 0 "[ . 1]" 1
1816 2 35 ASN HD21 2 36 ASN H 5.158 4.528 5.788 4.615 4.568 4.692 . 0 0 "[ . 1]" 1
1817 1 32 CYS HA 1 36 ASN H 3.933 3.445 4.421 4.192 4.116 4.297 . 0 0 "[ . 1]" 1
1818 2 32 CYS HA 2 36 ASN H 3.933 3.445 4.421 4.188 4.104 4.299 . 0 0 "[ . 1]" 1
1819 1 36 ASN H 1 36 ASN HB2 3.188 2.795 3.581 3.394 3.319 3.481 . 0 0 "[ . 1]" 1
1820 2 36 ASN H 2 36 ASN HB2 3.188 2.795 3.581 3.396 3.323 3.475 . 0 0 "[ . 1]" 1
1821 1 35 ASN HB3 1 36 ASN H 3.973 3.541 4.405 4.260 4.213 4.306 . 0 0 "[ . 1]" 1
1822 2 35 ASN HB3 2 36 ASN H 3.973 3.541 4.405 4.257 4.218 4.297 . 0 0 "[ . 1]" 1
1823 1 53 LYS H 1 54 ARG H 2.225 . 2.462 2.447 2.370 2.491 0.029 7 0 "[ . 1]" 1
1824 2 53 LYS H 2 54 ARG H 2.225 . 2.462 2.445 2.369 2.488 0.026 7 0 "[ . 1]" 1
1825 1 54 ARG H 1 55 ASN HA 3.953 3.471 4.435 4.489 4.465 4.528 0.093 5 0 "[ . 1]" 1
1826 2 54 ARG H 2 55 ASN HA 3.953 3.471 4.435 4.490 4.475 4.527 0.092 5 0 "[ . 1]" 1
1827 1 51 LEU HA 1 54 ARG H 3.372 2.901 3.843 3.513 3.450 3.589 . 0 0 "[ . 1]" 1
1828 2 51 LEU HA 2 54 ARG H 3.372 2.901 3.843 3.513 3.447 3.587 . 0 0 "[ . 1]" 1
1829 1 54 ARG H 1 54 ARG HD2 4.396 3.899 4.893 4.589 4.504 4.722 . 0 0 "[ . 1]" 1
1830 2 54 ARG H 2 54 ARG HD2 4.396 3.899 4.893 4.589 4.506 4.723 . 0 0 "[ . 1]" 1
1831 1 54 ARG H 1 54 ARG HG3 4.075 3.665 4.485 4.504 4.492 4.529 0.044 5 0 "[ . 1]" 1
1832 2 54 ARG H 2 54 ARG HG3 4.075 3.665 4.485 4.504 4.493 4.531 0.046 5 0 "[ . 1]" 1
1833 1 25 LYS HA 1 26 THR H 2.721 . 6.000 3.465 3.448 3.479 . 0 0 "[ . 1]" 1
1834 2 25 LYS HA 2 26 THR H 2.721 . 6.000 3.465 3.449 3.481 . 0 0 "[ . 1]" 1
1835 1 23 ASP HB3 1 26 THR H 5.725 4.832 6.618 5.517 5.456 5.582 . 0 0 "[ . 1]" 1
1836 2 23 ASP HB3 2 26 THR H 5.725 4.832 6.618 5.519 5.455 5.583 . 0 0 "[ . 1]" 1
1837 1 25 LYS QB 1 26 THR H 2.749 2.405 3.093 2.656 2.526 2.742 . 0 0 "[ . 1]" 1
1838 2 25 LYS QB 2 26 THR H 2.749 2.405 3.093 2.656 2.517 2.745 . 0 0 "[ . 1]" 1
1839 1 25 LYS HG3 1 26 THR H 4.155 . 6.000 5.002 4.973 5.070 . 0 0 "[ . 1]" 1
1840 2 25 LYS HG3 2 26 THR H 4.155 . 6.000 5.002 4.971 5.072 . 0 0 "[ . 1]" 1
1841 1 50 TYR QD 1 55 ASN H 5.318 4.510 6.126 6.163 6.085 6.207 0.081 4 0 "[ . 1]" 1
1842 2 50 TYR QD 2 55 ASN H 5.318 4.510 6.126 6.162 6.082 6.208 0.082 4 0 "[ . 1]" 1
1843 1 55 ASN H 2 31 TYR QD 4.351 3.595 5.107 5.034 4.819 5.165 0.058 4 0 "[ . 1]" 1
1844 1 31 TYR QD 2 55 ASN H 4.351 3.595 5.107 5.034 4.808 5.176 0.069 9 0 "[ . 1]" 1
1845 1 43 ILE H 2 16 PHE QR 4.842 3.802 5.882 4.099 4.009 4.151 . 0 0 "[ . 1]" 1
1846 1 16 PHE QR 2 43 ILE H 4.842 3.802 5.882 4.101 4.005 4.147 . 0 0 "[ . 1]" 1
1847 1 41 GLN H 1 43 ILE H 4.017 3.434 4.600 4.325 4.284 4.363 . 0 0 "[ . 1]" 1
1848 2 41 GLN H 2 43 ILE H 4.017 3.434 4.600 4.326 4.271 4.362 . 0 0 "[ . 1]" 1
1849 1 39 LEU HA 1 43 ILE H 3.714 3.110 4.318 4.231 4.150 4.300 . 0 0 "[ . 1]" 1
1850 2 39 LEU HA 2 43 ILE H 3.714 3.110 4.318 4.233 4.157 4.301 . 0 0 "[ . 1]" 1
1851 1 42 ALA HA 1 43 ILE H 3.395 2.900 3.890 3.573 3.569 3.580 . 0 0 "[ . 1]" 1
1852 2 42 ALA HA 2 43 ILE H 3.395 2.900 3.890 3.573 3.568 3.579 . 0 0 "[ . 1]" 1
1853 1 43 ILE H 1 44 GLU HA 5.357 4.527 6.187 5.340 5.327 5.356 . 0 0 "[ . 1]" 1
1854 2 43 ILE H 2 44 GLU HA 5.357 4.527 6.187 5.339 5.323 5.354 . 0 0 "[ . 1]" 1
1855 1 51 LEU HA 1 55 ASN H 3.759 3.123 4.395 3.111 3.062 3.183 0.061 3 0 "[ . 1]" 1
1856 2 51 LEU HA 2 55 ASN H 3.759 3.123 4.395 3.111 3.063 3.177 0.060 3 0 "[ . 1]" 1
1857 1 43 ILE H 1 44 GLU HG2 6.943 5.920 7.966 5.901 5.884 5.920 0.036 4 0 "[ . 1]" 1
1858 2 43 ILE H 2 44 GLU HG2 6.943 5.920 7.966 5.899 5.881 5.911 0.039 4 0 "[ . 1]" 1
1859 1 54 ARG HB2 1 55 ASN H 4.140 . 6.000 3.149 3.048 3.227 . 0 0 "[ . 1]" 1
1860 2 54 ARG HB2 2 55 ASN H 4.140 . 6.000 3.148 3.044 3.221 . 0 0 "[ . 1]" 1
1861 1 43 ILE H 1 43 ILE HB 2.095 . 2.354 2.228 2.217 2.236 . 0 0 "[ . 1]" 1
1862 2 43 ILE H 2 43 ILE HB 2.095 . 2.354 2.227 2.209 2.239 . 0 0 "[ . 1]" 1
1863 1 54 ARG HG2 1 55 ASN H 4.646 4.108 5.184 4.099 4.026 4.343 0.082 2 0 "[ . 1]" 1
1864 2 54 ARG HG2 2 55 ASN H 4.646 4.108 5.184 4.096 4.015 4.345 0.093 2 0 "[ . 1]" 1
1865 1 54 ARG HG3 1 55 ASN H 4.475 3.935 5.015 4.004 3.937 4.090 . 0 0 "[ . 1]" 1
1866 2 54 ARG HG3 2 55 ASN H 4.475 3.935 5.015 4.001 3.938 4.094 . 0 0 "[ . 1]" 1
1867 1 54 ARG HB3 1 55 ASN H 2.838 . 6.000 1.893 1.803 2.053 . 0 0 "[ . 1]" 1
1868 2 54 ARG HB3 2 55 ASN H 2.838 . 6.000 1.890 1.804 2.053 . 0 0 "[ . 1]" 1
1869 1 38 GLN HA 1 38 GLN HE22 6.304 5.628 6.980 5.940 5.636 6.072 . 0 0 "[ . 1]" 1
1870 2 38 GLN HA 2 38 GLN HE22 6.304 5.628 6.980 5.944 5.640 6.068 . 0 0 "[ . 1]" 1
1871 1 38 GLN HA 1 38 GLN HE21 6.453 . 6.000 4.847 4.252 5.128 . 0 0 "[ . 1]" 1
1872 2 38 GLN HA 2 38 GLN HE21 6.453 . 6.000 4.850 4.258 5.126 . 0 0 "[ . 1]" 1
1873 1 31 TYR QE 1 35 ASN H 4.659 . 6.000 5.535 5.408 5.673 . 0 0 "[ . 1]" 1
1874 2 31 TYR QE 2 35 ASN H 4.659 . 6.000 5.534 5.403 5.666 . 0 0 "[ . 1]" 1
1875 1 35 ASN H 1 36 ASN HA 4.572 4.114 5.030 4.437 4.407 4.461 . 0 0 "[ . 1]" 1
1876 2 35 ASN H 2 36 ASN HA 4.572 4.114 5.030 4.437 4.418 4.461 . 0 0 "[ . 1]" 1
1877 1 33 ALA HA 1 35 ASN H 4.188 3.614 4.762 4.594 4.485 4.647 . 0 0 "[ . 1]" 1
1878 2 33 ALA HA 2 35 ASN H 4.188 3.614 4.762 4.593 4.485 4.649 . 0 0 "[ . 1]" 1
1879 1 32 CYS HA 1 35 ASN H 3.127 2.716 3.538 3.565 3.524 3.593 0.055 9 0 "[ . 1]" 1
1880 2 32 CYS HA 2 35 ASN H 3.127 2.716 3.538 3.563 3.526 3.595 0.057 9 0 "[ . 1]" 1
1881 1 35 ASN H 1 35 ASN HB2 2.395 2.089 2.701 2.423 2.409 2.435 . 0 0 "[ . 1]" 1
1882 2 35 ASN H 2 35 ASN HB2 2.395 2.089 2.701 2.423 2.411 2.432 . 0 0 "[ . 1]" 1
1883 1 35 ASN H 1 35 ASN HB3 3.328 3.034 3.622 3.638 3.630 3.649 0.027 9 0 "[ . 1]" 1
1884 2 35 ASN H 2 35 ASN HB3 3.328 3.034 3.622 3.638 3.633 3.645 0.023 5 0 "[ . 1]" 1
1885 1 34 LYS HG2 1 35 ASN H 4.453 3.941 4.965 3.785 3.643 3.956 0.298 6 0 "[ . 1]" 1
1886 2 34 LYS HG2 2 35 ASN H 4.453 3.941 4.965 3.786 3.641 3.953 0.300 6 0 "[ . 1]" 1
1887 1 37 LEU HA 1 41 GLN HE21 4.393 3.924 4.862 4.121 3.791 4.507 0.133 10 0 "[ . 1]" 1
1888 2 37 LEU HA 2 41 GLN HE21 4.393 3.924 4.862 4.116 3.797 4.491 0.127 10 0 "[ . 1]" 1
1889 1 38 GLN HA 1 41 GLN HE21 7.471 6.185 8.757 6.433 6.152 6.631 0.033 10 0 "[ . 1]" 1
1890 2 38 GLN HA 2 41 GLN HE21 7.471 6.185 8.757 6.429 6.155 6.618 0.030 10 0 "[ . 1]" 1
1891 1 36 ASN HA 1 36 ASN QD . 3.918 4.978 3.603 2.817 4.016 1.101 5 3 "[-* + 1]" 1
1892 2 36 ASN HA 2 36 ASN QD . 3.918 4.978 3.607 2.822 4.022 1.096 5 3 "[-* + 1]" 1
1893 1 41 GLN HA 1 41 GLN HE21 6.581 . 6.000 4.935 4.860 5.087 . 0 0 "[ . 1]" 1
1894 2 41 GLN HA 2 41 GLN HE21 6.581 . 6.000 4.934 4.856 5.084 . 0 0 "[ . 1]" 1
1895 1 41 GLN HA 1 41 GLN HE22 7.819 . 6.000 5.961 5.862 5.999 . 0 0 "[ . 1]" 1
1896 2 41 GLN HA 2 41 GLN HE22 7.819 . 6.000 5.963 5.864 5.996 . 0 0 "[ . 1]" 1
1897 1 41 GLN HE21 1 41 GLN QG 2.722 . 6.000 2.210 2.186 2.258 . 0 0 "[ . 1]" 1
1898 2 41 GLN HE21 2 41 GLN QG 2.722 . 6.000 2.213 2.197 2.253 . 0 0 "[ . 1]" 1
1899 1 41 GLN HB3 1 41 GLN HE22 3.938 3.453 4.423 3.819 3.695 3.864 . 0 0 "[ . 1]" 1
1900 2 41 GLN HB3 2 41 GLN HE22 3.938 3.453 4.423 3.821 3.698 3.869 . 0 0 "[ . 1]" 1
1901 1 41 GLN HB3 1 41 GLN HE21 3.627 . 6.000 2.888 2.834 2.990 . 0 0 "[ . 1]" 1
1902 2 41 GLN HB3 2 41 GLN HE21 3.627 . 6.000 2.885 2.831 2.992 . 0 0 "[ . 1]" 1
1903 1 37 LEU MD1 1 41 GLN HE21 3.193 2.667 3.719 3.179 2.904 3.541 . 0 0 "[ . 1]" 1
1904 2 37 LEU MD1 2 41 GLN HE21 3.193 2.667 3.719 3.178 2.899 3.549 . 0 0 "[ . 1]" 1
1905 1 55 ASN HA 1 55 ASN HD22 5.860 5.282 6.438 5.307 5.286 5.333 . 0 0 "[ . 1]" 1
1906 2 55 ASN HA 2 55 ASN HD22 5.860 5.282 6.438 5.307 5.284 5.330 . 0 0 "[ . 1]" 1
1907 1 54 ARG HA 1 55 ASN HD22 4.870 4.202 5.538 5.381 5.212 5.546 0.008 8 0 "[ . 1]" 1
1908 2 54 ARG HA 2 55 ASN HD22 4.870 4.202 5.538 5.386 5.241 5.557 0.019 8 0 "[ . 1]" 1
1909 1 55 ASN HA 1 56 GLY H 2.676 . 6.000 3.577 3.568 3.584 . 0 0 "[ . 1]" 1
1910 2 55 ASN HA 2 56 GLY H 2.676 . 6.000 3.578 3.567 3.590 . 0 0 "[ . 1]" 1
1911 1 51 LEU HA 1 56 GLY H 3.468 3.007 3.929 3.880 3.763 3.951 0.022 3 0 "[ . 1]" 1
1912 2 51 LEU HA 2 56 GLY H 3.468 3.007 3.929 3.882 3.780 3.954 0.025 3 0 "[ . 1]" 1
1913 1 54 ARG HB2 1 56 GLY H 5.045 4.574 5.516 4.867 4.656 5.100 . 0 0 "[ . 1]" 1
1914 2 54 ARG HB2 2 56 GLY H 5.045 4.574 5.516 4.869 4.658 5.099 . 0 0 "[ . 1]" 1
1915 1 54 ARG HG2 1 56 GLY H 4.828 4.156 5.500 4.553 4.267 5.094 . 0 0 "[ . 1]" 1
1916 2 54 ARG HG2 2 56 GLY H 4.828 4.156 5.500 4.552 4.265 5.105 . 0 0 "[ . 1]" 1
1917 1 54 ARG HB3 1 56 GLY H 3.340 2.955 3.725 3.174 2.975 3.399 . 0 0 "[ . 1]" 1
1918 2 54 ARG HB3 2 56 GLY H 3.340 2.955 3.725 3.176 2.981 3.416 . 0 0 "[ . 1]" 1
1919 1 51 LEU MD1 1 56 GLY H 2.315 . 6.000 2.988 2.860 3.070 . 0 0 "[ . 1]" 1
1920 2 51 LEU MD1 2 56 GLY H 2.315 . 6.000 2.990 2.860 3.068 . 0 0 "[ . 1]" 1
1921 1 16 PHE H 1 17 GLY H 4.490 3.884 5.096 4.075 4.008 4.180 . 0 0 "[ . 1]" 1
1922 2 16 PHE H 2 17 GLY H 4.490 3.884 5.096 4.075 4.006 4.177 . 0 0 "[ . 1]" 1
1923 1 16 PHE HA 1 17 GLY H 2.547 . 6.000 2.141 2.128 2.165 . 0 0 "[ . 1]" 1
1924 2 16 PHE HA 2 17 GLY H 2.547 . 6.000 2.142 2.131 2.163 . 0 0 "[ . 1]" 1
1925 1 14 ALA HA 1 17 GLY H 9.263 6.857 11.669 9.208 9.106 9.286 . 0 0 "[ . 1]" 1
1926 2 14 ALA HA 2 17 GLY H 9.263 6.857 11.669 9.207 9.101 9.289 . 0 0 "[ . 1]" 1
1927 1 17 GLY H 1 17 GLY HA2 2.925 2.626 3.224 2.955 2.949 2.960 . 0 0 "[ . 1]" 1
1928 2 17 GLY H 2 17 GLY HA2 2.925 2.626 3.224 2.956 2.945 2.960 . 0 0 "[ . 1]" 1
1929 1 16 PHE HB3 1 17 GLY H 3.473 . 6.000 4.025 3.910 4.100 . 0 0 "[ . 1]" 1
1930 2 16 PHE HB3 2 17 GLY H 3.473 . 6.000 4.029 3.909 4.109 . 0 0 "[ . 1]" 1
1931 1 52 GLN HE22 1 52 GLN HG3 4.299 3.796 4.802 4.014 3.806 4.044 . 0 0 "[ . 1]" 1
1932 2 52 GLN HE22 2 52 GLN HG3 4.299 3.796 4.802 4.013 3.802 4.043 . 0 0 "[ . 1]" 1
1933 1 52 GLN HB2 1 52 GLN HE22 4.350 3.783 4.917 3.874 3.784 4.459 . 0 0 "[ . 1]" 1
1934 2 52 GLN HB2 2 52 GLN HE22 4.350 3.783 4.917 3.873 3.777 4.469 0.006 5 0 "[ . 1]" 1
1935 1 40 THR H 1 44 GLU H 4.708 . 6.000 6.034 6.010 6.062 0.062 3 0 "[ . 1]" 1
1936 2 40 THR H 2 44 GLU H 4.708 . 6.000 6.035 6.017 6.073 0.073 3 0 "[ . 1]" 1
1937 1 38 GLN HA 1 40 THR H 4.016 3.520 4.512 4.263 4.227 4.315 . 0 0 "[ . 1]" 1
1938 2 38 GLN HA 2 40 THR H 4.016 3.520 4.512 4.265 4.231 4.311 . 0 0 "[ . 1]" 1
1939 1 38 GLN HG3 1 40 THR H 4.336 . 6.000 5.966 5.865 6.016 0.016 4 0 "[ . 1]" 1
1940 2 38 GLN HG3 2 40 THR H 4.336 . 6.000 5.966 5.856 6.009 0.009 4 0 "[ . 1]" 1
1941 1 38 GLN QB 1 40 THR H 3.144 2.724 3.564 3.008 2.925 3.067 . 0 0 "[ . 1]" 1
1942 2 38 GLN QB 2 40 THR H 3.144 2.724 3.564 3.008 2.912 3.065 . 0 0 "[ . 1]" 1
1943 1 39 LEU HB2 1 40 THR H 2.863 2.563 3.163 3.067 2.996 3.140 . 0 0 "[ . 1]" 1
1944 2 39 LEU HB2 2 40 THR H 2.863 2.563 3.163 3.068 3.002 3.135 . 0 0 "[ . 1]" 1
1945 1 39 LEU HB3 1 40 THR H 2.479 2.140 2.818 2.590 2.526 2.725 . 0 0 "[ . 1]" 1
1946 2 39 LEU HB3 2 40 THR H 2.479 2.140 2.818 2.589 2.529 2.726 . 0 0 "[ . 1]" 1
1947 1 40 THR H 2 18 ILE HB 5.006 4.419 5.593 4.615 4.530 4.727 . 0 0 "[ . 1]" 1
1948 1 18 ILE HB 2 40 THR H 5.006 4.419 5.593 4.618 4.528 4.705 . 0 0 "[ . 1]" 1
1949 1 50 TYR QD 1 54 ARG HE 3.817 . 6.000 5.820 5.593 6.061 0.061 2 0 "[ . 1]" 1
1950 2 50 TYR QD 2 54 ARG HE 3.817 . 6.000 5.820 5.585 6.064 0.064 2 0 "[ . 1]" 1
1951 1 50 TYR QE 1 54 ARG HE 3.890 3.336 4.444 4.206 3.860 4.528 0.084 4 0 "[ . 1]" 1
1952 2 50 TYR QE 2 54 ARG HE 3.890 3.336 4.444 4.206 3.856 4.536 0.092 2 0 "[ . 1]" 1
1953 1 54 ARG HA 1 54 ARG HE 5.502 . 6.000 4.618 4.463 4.758 . 0 0 "[ . 1]" 1
1954 2 54 ARG HA 2 54 ARG HE 5.502 . 6.000 4.616 4.466 4.760 . 0 0 "[ . 1]" 1
1955 1 54 ARG HD2 1 54 ARG HE 2.781 2.441 3.121 2.741 2.644 2.839 . 0 0 "[ . 1]" 1
1956 2 54 ARG HD2 2 54 ARG HE 2.781 2.441 3.121 2.741 2.645 2.840 . 0 0 "[ . 1]" 1
1957 1 54 ARG HD3 1 54 ARG HE 2.741 2.376 3.106 2.848 2.774 2.916 . 0 0 "[ . 1]" 1
1958 2 54 ARG HD3 2 54 ARG HE 2.741 2.376 3.106 2.848 2.773 2.911 . 0 0 "[ . 1]" 1
1959 1 54 ARG HE 1 54 ARG HG2 3.080 . 6.000 2.436 2.318 2.562 . 0 0 "[ . 1]" 1
1960 2 54 ARG HE 2 54 ARG HG2 3.080 . 6.000 2.436 2.319 2.561 . 0 0 "[ . 1]" 1
1961 1 54 ARG HE 1 54 ARG HG3 3.295 . 6.000 2.714 2.580 2.836 . 0 0 "[ . 1]" 1
1962 2 54 ARG HE 2 54 ARG HG3 3.295 . 6.000 2.713 2.580 2.832 . 0 0 "[ . 1]" 1
1963 1 54 ARG HB3 1 54 ARG HE 5.164 4.579 5.749 4.580 4.519 4.662 0.060 3 0 "[ . 1]" 1
1964 2 54 ARG HB3 2 54 ARG HE 5.164 4.579 5.749 4.579 4.529 4.661 0.050 3 0 "[ . 1]" 1
1965 1 31 TYR HB3 1 33 ALA H 4.933 4.253 5.613 4.815 4.705 4.960 . 0 0 "[ . 1]" 1
1966 2 31 TYR HB3 2 33 ALA H 4.933 4.253 5.613 4.817 4.715 4.960 . 0 0 "[ . 1]" 1
1967 1 11 LYS HA 1 13 LYS H 2.721 . 6.000 5.609 4.263 6.103 0.103 5 0 "[ . 1]" 1
1968 2 11 LYS HA 2 13 LYS H 2.721 . 6.000 5.615 4.267 6.114 0.114 5 0 "[ . 1]" 1
1969 1 13 LYS QG 1 14 ALA H 2.717 . 6.000 3.852 3.604 4.470 . 0 0 "[ . 1]" 1
1970 2 13 LYS QG 2 14 ALA H 2.717 . 6.000 3.852 3.597 4.473 . 0 0 "[ . 1]" 1
1971 1 13 LYS H 1 13 LYS QG 4.084 . 6.000 2.144 2.080 2.201 . 0 0 "[ . 1]" 1
1972 2 13 LYS H 2 13 LYS QG 4.084 . 6.000 2.144 2.078 2.204 . 0 0 "[ . 1]" 1
1973 1 17 GLY H 1 17 GLY HA3 2.791 2.445 3.137 2.535 2.512 2.565 . 0 0 "[ . 1]" 1
1974 2 17 GLY H 2 17 GLY HA3 2.791 2.445 3.137 2.534 2.513 2.559 . 0 0 "[ . 1]" 1
1975 1 21 ASP H 2 13 LYS HA 4.205 3.724 4.686 4.529 4.406 4.642 . 0 0 "[ . 1]" 1
1976 1 13 LYS HA 2 21 ASP H 4.205 3.724 4.686 4.531 4.415 4.649 . 0 0 "[ . 1]" 1
1977 1 20 MET HG3 1 21 ASP H 2.847 . 6.000 3.699 3.014 3.869 . 0 0 "[ . 1]" 1
1978 2 20 MET HG3 2 21 ASP H 2.847 . 6.000 3.699 3.013 3.868 . 0 0 "[ . 1]" 1
1979 1 21 ASP H 2 40 THR MG 3.650 . 6.000 4.556 4.344 4.739 . 0 0 "[ . 1]" 1
1980 1 40 THR MG 2 21 ASP H 3.650 . 6.000 4.556 4.358 4.722 . 0 0 "[ . 1]" 1
1981 1 20 MET ME 1 21 ASP H 3.268 . 6.000 4.141 4.008 4.661 . 0 0 "[ . 1]" 1
1982 2 20 MET ME 2 21 ASP H 3.268 . 6.000 4.140 4.000 4.652 . 0 0 "[ . 1]" 1
1983 1 22 LYS H 2 13 LYS HA 3.263 2.889 3.637 3.354 2.979 3.640 0.003 2 0 "[ . 1]" 1
1984 1 13 LYS HA 2 22 LYS H 3.263 2.889 3.637 3.354 3.002 3.640 0.003 2 0 "[ . 1]" 1
1985 1 22 LYS H 1 26 THR HB 4.057 . 6.000 6.142 6.089 6.205 0.205 10 0 "[ . 1]" 1
1986 2 22 LYS H 2 26 THR HB 4.057 . 6.000 6.141 6.088 6.207 0.207 10 0 "[ . 1]" 1
1987 1 18 ILE H 1 18 ILE HA 2.947 2.554 3.340 2.946 2.943 2.949 . 0 0 "[ . 1]" 1
1988 2 18 ILE H 2 18 ILE HA 2.947 2.554 3.340 2.946 2.945 2.949 . 0 0 "[ . 1]" 1
1989 1 18 ILE H 2 16 PHE HB2 3.287 . 6.000 4.397 4.269 4.490 . 0 0 "[ . 1]" 1
1990 1 16 PHE HB2 2 18 ILE H 3.287 . 6.000 4.395 4.273 4.496 . 0 0 "[ . 1]" 1
1991 1 23 ASP H 1 23 ASP HB3 2.252 . 6.000 2.512 2.304 2.608 . 0 0 "[ . 1]" 1
1992 2 23 ASP H 2 23 ASP HB3 2.252 . 6.000 2.513 2.311 2.615 . 0 0 "[ . 1]" 1
1993 1 22 LYS QG 1 24 LEU H 3.837 . 6.000 4.794 4.654 4.881 . 0 0 "[ . 1]" 1
1994 2 22 LYS QG 2 24 LEU H 3.837 . 6.000 4.791 4.648 4.884 . 0 0 "[ . 1]" 1
1995 1 25 LYS H 1 25 LYS HE2 4.870 . 6.000 6.056 6.009 6.106 0.106 6 0 "[ . 1]" 1
1996 2 25 LYS H 2 25 LYS HE2 4.870 . 6.000 6.054 6.007 6.104 0.104 6 0 "[ . 1]" 1
1997 1 23 ASP HA 1 26 THR H 2.898 . 6.000 3.757 3.691 3.841 . 0 0 "[ . 1]" 1
1998 2 23 ASP HA 2 26 THR H 2.898 . 6.000 3.759 3.694 3.839 . 0 0 "[ . 1]" 1
1999 1 23 ASP HA 1 27 ARG H 3.530 3.105 3.955 3.827 3.681 3.959 0.004 5 0 "[ . 1]" 1
2000 2 23 ASP HA 2 27 ARG H 3.530 3.105 3.955 3.830 3.692 3.968 0.013 5 0 "[ . 1]" 1
2001 1 31 TYR H 1 31 TYR HA 2.559 2.284 2.834 2.811 2.802 2.816 . 0 0 "[ . 1]" 1
2002 2 31 TYR H 2 31 TYR HA 2.559 2.284 2.834 2.810 2.803 2.817 . 0 0 "[ . 1]" 1
2003 1 28 LEU HA 1 31 TYR H 2.557 . 6.000 3.057 3.009 3.149 . 0 0 "[ . 1]" 1
2004 2 28 LEU HA 2 31 TYR H 2.557 . 6.000 3.057 3.008 3.147 . 0 0 "[ . 1]" 1
2005 1 24 LEU QD 1 27 ARG H 2.946 . 6.000 4.318 3.991 4.951 . 0 0 "[ . 1]" 1
2006 2 24 LEU QD 2 27 ARG H 2.946 . 6.000 4.317 3.984 4.961 . 0 0 "[ . 1]" 1
2007 1 29 LYS H 2 51 LEU MD2 3.978 3.303 4.653 4.604 4.555 4.636 . 0 0 "[ . 1]" 1
2008 1 51 LEU MD2 2 29 LYS H 3.978 3.303 4.653 4.601 4.562 4.629 . 0 0 "[ . 1]" 1
2009 1 29 LYS H 2 51 LEU MD1 5.864 4.246 7.482 5.447 5.354 5.530 . 0 0 "[ . 1]" 1
2010 1 51 LEU MD1 2 29 LYS H 5.864 4.246 7.482 5.445 5.362 5.513 . 0 0 "[ . 1]" 1
2011 1 28 LEU H 1 28 LEU HA 2.894 2.466 3.322 2.787 2.758 2.812 . 0 0 "[ . 1]" 1
2012 2 28 LEU H 2 28 LEU HA 2.894 2.466 3.322 2.787 2.757 2.813 . 0 0 "[ . 1]" 1
2013 1 27 ARG HG2 1 28 LEU H 3.809 3.378 4.240 4.007 3.948 4.081 . 0 0 "[ . 1]" 1
2014 2 27 ARG HG2 2 28 LEU H 3.809 3.378 4.240 4.008 3.950 4.089 . 0 0 "[ . 1]" 1
2015 1 27 ARG HG3 1 28 LEU H 2.763 2.399 3.127 2.860 2.813 2.906 . 0 0 "[ . 1]" 1
2016 2 27 ARG HG3 2 28 LEU H 2.763 2.399 3.127 2.862 2.820 2.909 . 0 0 "[ . 1]" 1
2017 1 30 VAL H 1 30 VAL MG1 2.624 . 6.000 3.746 3.738 3.752 . 0 0 "[ . 1]" 1
2018 2 30 VAL H 2 30 VAL MG1 2.624 . 6.000 3.746 3.738 3.758 . 0 0 "[ . 1]" 1
2019 1 30 VAL MG1 1 31 TYR H 2.152 . 6.000 3.545 3.528 3.600 . 0 0 "[ . 1]" 1
2020 2 30 VAL MG1 2 31 TYR H 2.152 . 6.000 3.544 3.527 3.599 . 0 0 "[ . 1]" 1
2021 1 32 CYS H 1 34 LYS H 3.979 3.522 4.436 4.021 3.980 4.067 . 0 0 "[ . 1]" 1
2022 2 32 CYS H 2 34 LYS H 3.979 3.522 4.436 4.021 3.980 4.068 . 0 0 "[ . 1]" 1
2023 1 31 TYR HB3 1 32 CYS H 2.292 2.011 2.573 2.621 2.605 2.631 0.058 1 0 "[ . 1]" 1
2024 2 31 TYR HB3 2 32 CYS H 2.292 2.011 2.573 2.621 2.606 2.635 0.062 10 0 "[ . 1]" 1
2025 1 28 LEU HB2 1 32 CYS H 4.860 . 6.000 6.093 6.071 6.107 0.107 5 0 "[ . 1]" 1
2026 2 28 LEU HB2 2 32 CYS H 4.860 . 6.000 6.093 6.070 6.107 0.107 5 0 "[ . 1]" 1
2027 1 33 ALA H 1 36 ASN H 3.964 3.449 4.479 4.539 4.481 4.615 0.136 8 0 "[ . 1]" 1
2028 2 33 ALA H 2 36 ASN H 3.964 3.449 4.479 4.538 4.469 4.614 0.135 8 0 "[ . 1]" 1
2029 1 31 TYR QD 1 34 LYS H 2.939 . 6.000 5.386 5.226 5.553 . 0 0 "[ . 1]" 1
2030 2 31 TYR QD 2 34 LYS H 2.939 . 6.000 5.386 5.227 5.550 . 0 0 "[ . 1]" 1
2031 1 32 CYS HA 1 34 LYS H 4.065 3.484 4.646 4.308 4.248 4.366 . 0 0 "[ . 1]" 1
2032 2 32 CYS HA 2 34 LYS H 4.065 3.484 4.646 4.309 4.245 4.370 . 0 0 "[ . 1]" 1
2033 1 35 ASN H 1 35 ASN HD22 5.329 . 6.000 3.823 3.733 3.903 . 0 0 "[ . 1]" 1
2034 2 35 ASN H 2 35 ASN HD22 5.329 . 6.000 3.825 3.719 3.901 . 0 0 "[ . 1]" 1
2035 1 34 LYS QB 1 35 ASN H 2.514 2.223 2.805 2.554 2.446 2.686 . 0 0 "[ . 1]" 1
2036 2 34 LYS QB 2 35 ASN H 2.514 2.223 2.805 2.554 2.449 2.679 . 0 0 "[ . 1]" 1
2037 1 33 ALA HA 1 36 ASN H 2.648 . 6.000 3.567 3.515 3.654 . 0 0 "[ . 1]" 1
2038 2 33 ALA HA 2 36 ASN H 2.648 . 6.000 3.566 3.517 3.651 . 0 0 "[ . 1]" 1
2039 1 52 GLN HA 1 55 ASN H 2.865 . 6.000 4.078 3.978 4.186 . 0 0 "[ . 1]" 1
2040 2 52 GLN HA 2 55 ASN H 2.865 . 6.000 4.079 3.984 4.196 . 0 0 "[ . 1]" 1
2041 1 51 LEU H 1 53 LYS H 3.231 . 6.000 4.116 4.016 4.200 . 0 0 "[ . 1]" 1
2042 2 51 LEU H 2 53 LYS H 3.231 . 6.000 4.117 4.014 4.188 . 0 0 "[ . 1]" 1
2043 1 48 LYS HA 1 51 LEU H 2.569 . 6.000 3.670 3.591 3.734 . 0 0 "[ . 1]" 1
2044 2 48 LYS HA 2 51 LEU H 2.569 . 6.000 3.668 3.591 3.725 . 0 0 "[ . 1]" 1
2045 1 32 CYS HA 1 37 LEU H 2.749 2.435 3.063 2.605 2.517 2.766 . 0 0 "[ . 1]" 1
2046 2 32 CYS HA 2 37 LEU H 2.749 2.435 3.063 2.605 2.515 2.769 . 0 0 "[ . 1]" 1
2047 1 50 TYR QB 1 51 LEU H 2.220 . 2.467 2.390 2.261 2.470 0.003 6 0 "[ . 1]" 1
2048 2 50 TYR QB 2 51 LEU H 2.220 . 2.467 2.388 2.260 2.469 0.002 8 0 "[ . 1]" 1
2049 1 32 CYS HA 1 38 GLN H 5.991 . 6.000 5.117 5.022 5.172 . 0 0 "[ . 1]" 1
2050 2 32 CYS HA 2 38 GLN H 5.991 . 6.000 5.118 5.019 5.176 . 0 0 "[ . 1]" 1
2051 1 38 GLN H 1 41 GLN HB2 3.070 . 6.000 3.574 3.406 3.712 . 0 0 "[ . 1]" 1
2052 2 38 GLN H 2 41 GLN HB2 3.070 . 6.000 3.575 3.414 3.715 . 0 0 "[ . 1]" 1
2053 1 38 GLN H 1 38 GLN HG3 2.147 . 6.000 2.482 2.394 2.594 . 0 0 "[ . 1]" 1
2054 2 38 GLN H 2 38 GLN HG3 2.147 . 6.000 2.485 2.402 2.592 . 0 0 "[ . 1]" 1
2055 1 37 LEU HB3 1 38 GLN H 2.321 2.024 2.618 2.658 2.633 2.703 0.085 7 0 "[ . 1]" 1
2056 2 37 LEU HB3 2 38 GLN H 2.321 2.024 2.618 2.659 2.645 2.694 0.076 7 0 "[ . 1]" 1
2057 1 39 LEU H 1 40 THR HB 5.881 4.986 6.776 5.311 5.257 5.379 . 0 0 "[ . 1]" 1
2058 2 39 LEU H 2 40 THR HB 5.881 4.986 6.776 5.316 5.263 5.408 . 0 0 "[ . 1]" 1
2059 1 28 LEU MD1 1 39 LEU H 2.966 . 6.000 5.069 4.976 5.177 . 0 0 "[ . 1]" 1
2060 2 28 LEU MD1 2 39 LEU H 2.966 . 6.000 5.069 4.974 5.179 . 0 0 "[ . 1]" 1
2061 1 41 GLN H 1 42 ALA HA 3.445 . 6.000 5.340 5.308 5.362 . 0 0 "[ . 1]" 1
2062 2 41 GLN H 2 42 ALA HA 3.445 . 6.000 5.340 5.323 5.358 . 0 0 "[ . 1]" 1
2063 1 39 LEU HA 1 41 GLN H 3.298 . 6.000 4.726 4.670 4.788 . 0 0 "[ . 1]" 1
2064 2 39 LEU HA 2 41 GLN H 3.298 . 6.000 4.728 4.682 4.786 . 0 0 "[ . 1]" 1
2065 1 40 THR HB 1 41 GLN H 2.139 . 2.382 2.383 2.354 2.399 0.017 8 0 "[ . 1]" 1
2066 2 40 THR HB 2 41 GLN H 2.139 . 2.382 2.383 2.365 2.401 0.019 7 0 "[ . 1]" 1
2067 1 41 GLN H 1 41 GLN QG 2.991 . 6.000 3.919 3.887 3.936 . 0 0 "[ . 1]" 1
2068 2 41 GLN H 2 41 GLN QG 2.991 . 6.000 3.919 3.892 3.937 . 0 0 "[ . 1]" 1
2069 1 41 GLN H 1 41 GLN HB3 2.274 . 6.000 2.661 2.591 2.708 . 0 0 "[ . 1]" 1
2070 2 41 GLN H 2 41 GLN HB3 2.274 . 6.000 2.660 2.590 2.702 . 0 0 "[ . 1]" 1
2071 1 41 GLN H 1 43 ILE HB 3.298 . 6.000 5.146 5.063 5.183 . 0 0 "[ . 1]" 1
2072 2 41 GLN H 2 43 ILE HB 3.298 . 6.000 5.146 5.058 5.181 . 0 0 "[ . 1]" 1
2073 1 40 THR MG 1 41 GLN H 2.575 . 6.000 3.544 3.512 3.602 . 0 0 "[ . 1]" 1
2074 2 40 THR MG 2 41 GLN H 2.575 . 6.000 3.543 3.512 3.604 . 0 0 "[ . 1]" 1
2075 1 41 GLN QG 1 42 ALA H 3.844 3.410 4.278 3.918 3.751 4.249 . 0 0 "[ . 1]" 1
2076 2 41 GLN QG 2 42 ALA H 3.844 3.410 4.278 3.918 3.756 4.249 . 0 0 "[ . 1]" 1
2077 1 41 GLN HB2 1 42 ALA H 3.559 3.190 3.928 3.779 3.719 3.808 . 0 0 "[ . 1]" 1
2078 2 41 GLN HB2 2 42 ALA H 3.559 3.190 3.928 3.780 3.726 3.807 . 0 0 "[ . 1]" 1
2079 1 42 ALA H 1 43 ILE HB 4.086 3.613 4.559 4.520 4.465 4.560 0.001 3 0 "[ . 1]" 1
2080 2 42 ALA H 2 43 ILE HB 4.086 3.613 4.559 4.519 4.462 4.559 0.000 3 0 "[ . 1]" 1
2081 1 40 THR MG 1 42 ALA H 2.774 . 6.000 5.008 4.971 5.039 . 0 0 "[ . 1]" 1
2082 2 40 THR MG 2 42 ALA H 2.774 . 6.000 5.008 4.970 5.039 . 0 0 "[ . 1]" 1
2083 1 37 LEU MD2 1 42 ALA H 2.477 . 6.000 3.899 3.610 4.146 . 0 0 "[ . 1]" 1
2084 2 37 LEU MD2 2 42 ALA H 2.477 . 6.000 3.897 3.609 4.134 . 0 0 "[ . 1]" 1
2085 1 43 ILE H 1 44 GLU H 2.927 2.499 3.355 2.747 2.729 2.770 . 0 0 "[ . 1]" 1
2086 2 43 ILE H 2 44 GLU H 2.927 2.499 3.355 2.746 2.725 2.763 . 0 0 "[ . 1]" 1
2087 1 41 GLN HA 1 43 ILE H 4.068 3.482 4.654 4.658 4.622 4.674 0.020 8 0 "[ . 1]" 1
2088 2 41 GLN HA 2 43 ILE H 4.068 3.482 4.654 4.658 4.639 4.672 0.018 3 0 "[ . 1]" 1
2089 1 40 THR MG 1 43 ILE H 2.384 . 6.000 4.669 4.646 4.708 . 0 0 "[ . 1]" 1
2090 2 40 THR MG 2 43 ILE H 2.384 . 6.000 4.668 4.647 4.698 . 0 0 "[ . 1]" 1
2091 1 28 LEU MD1 1 43 ILE H 1.828 . 6.000 3.188 3.100 3.279 . 0 0 "[ . 1]" 1
2092 2 28 LEU MD1 2 43 ILE H 1.828 . 6.000 3.189 3.102 3.286 . 0 0 "[ . 1]" 1
2093 1 42 ALA MB 1 44 GLU H 3.704 3.050 4.358 4.484 4.463 4.502 0.144 8 0 "[ . 1]" 1
2094 2 42 ALA MB 2 44 GLU H 3.704 3.050 4.358 4.484 4.465 4.501 0.143 2 0 "[ . 1]" 1
2095 1 44 GLU H 1 45 GLU H 3.088 2.617 3.559 2.753 2.733 2.794 . 0 0 "[ . 1]" 1
2096 2 44 GLU H 2 45 GLU H 3.088 2.617 3.559 2.755 2.732 2.800 . 0 0 "[ . 1]" 1
2097 1 48 LYS H 1 51 LEU MD2 2.954 . 6.000 4.592 4.447 4.658 . 0 0 "[ . 1]" 1
2098 2 48 LYS H 2 51 LEU MD2 2.954 . 6.000 4.593 4.448 4.658 . 0 0 "[ . 1]" 1
2099 1 47 ILE MG 1 49 GLU H 3.653 . 6.000 4.669 4.606 4.746 . 0 0 "[ . 1]" 1
2100 2 47 ILE MG 2 49 GLU H 3.653 . 6.000 4.667 4.602 4.744 . 0 0 "[ . 1]" 1
2101 1 49 GLU HA 1 50 TYR H 3.327 2.882 3.772 3.355 3.315 3.402 . 0 0 "[ . 1]" 1
2102 2 49 GLU HA 2 50 TYR H 3.327 2.882 3.772 3.355 3.315 3.402 . 0 0 "[ . 1]" 1
2103 1 48 LYS HA 1 50 TYR H 3.316 2.786 3.846 3.879 3.828 3.913 0.067 8 0 "[ . 1]" 1
2104 2 48 LYS HA 2 50 TYR H 3.316 2.786 3.846 3.879 3.826 3.911 0.065 7 0 "[ . 1]" 1
2105 1 50 TYR H 1 51 LEU MD1 4.360 3.527 5.193 5.107 4.993 5.227 0.034 9 0 "[ . 1]" 1
2106 2 50 TYR H 2 51 LEU MD1 4.360 3.527 5.193 5.108 4.997 5.227 0.034 9 0 "[ . 1]" 1
2107 1 50 TYR QD 1 52 GLN H 4.816 4.063 5.569 5.467 5.425 5.513 . 0 0 "[ . 1]" 1
2108 2 50 TYR QD 2 52 GLN H 4.816 4.063 5.569 5.466 5.418 5.514 . 0 0 "[ . 1]" 1
2109 1 50 TYR H 1 52 GLN H 3.323 2.892 3.754 3.800 3.765 3.846 0.092 5 0 "[ . 1]" 1
2110 2 50 TYR H 2 52 GLN H 3.323 2.892 3.754 3.798 3.767 3.848 0.094 5 0 "[ . 1]" 1
2111 1 48 LYS HA 1 52 GLN H 3.568 . 6.000 4.652 4.527 4.783 . 0 0 "[ . 1]" 1
2112 2 48 LYS HA 2 52 GLN H 3.568 . 6.000 4.650 4.522 4.780 . 0 0 "[ . 1]" 1
2113 1 50 TYR QB 1 52 GLN H 3.655 . 6.000 4.572 4.468 4.668 . 0 0 "[ . 1]" 1
2114 2 50 TYR QB 2 52 GLN H 3.655 . 6.000 4.569 4.460 4.663 . 0 0 "[ . 1]" 1
2115 1 51 LEU HB2 1 52 GLN H 2.372 . 6.000 2.929 2.862 3.017 . 0 0 "[ . 1]" 1
2116 2 51 LEU HB2 2 52 GLN H 2.372 . 6.000 2.930 2.863 3.020 . 0 0 "[ . 1]" 1
2117 1 49 GLU HA 1 53 LYS H 2.674 . 6.000 3.868 3.750 3.970 . 0 0 "[ . 1]" 1
2118 2 49 GLU HA 2 53 LYS H 2.674 . 6.000 3.870 3.756 3.972 . 0 0 "[ . 1]" 1
2119 1 53 LYS H 1 53 LYS HG3 3.672 . 6.000 4.445 4.404 4.473 . 0 0 "[ . 1]" 1
2120 2 53 LYS H 2 53 LYS HG3 3.672 . 6.000 4.444 4.405 4.469 . 0 0 "[ . 1]" 1
2121 1 53 LYS H 1 53 LYS HB3 2.135 . 6.000 2.558 2.476 2.640 . 0 0 "[ . 1]" 1
2122 2 53 LYS H 2 53 LYS HB3 2.135 . 6.000 2.558 2.479 2.637 . 0 0 "[ . 1]" 1
2123 1 53 LYS HB3 1 54 ARG H 2.662 . 6.000 3.164 3.062 3.232 . 0 0 "[ . 1]" 1
2124 2 53 LYS HB3 2 54 ARG H 2.662 . 6.000 3.163 3.062 3.222 . 0 0 "[ . 1]" 1
2125 1 51 LEU MD1 1 54 ARG H 3.165 . 6.000 4.557 4.508 4.639 . 0 0 "[ . 1]" 1
2126 2 51 LEU MD1 2 54 ARG H 3.165 . 6.000 4.558 4.507 4.641 . 0 0 "[ . 1]" 1
2127 1 55 ASN H 1 56 GLY HA2 3.161 . 6.000 4.166 4.010 4.394 . 0 0 "[ . 1]" 1
2128 2 55 ASN H 2 56 GLY HA2 3.161 . 6.000 4.167 4.015 4.395 . 0 0 "[ . 1]" 1
2129 1 55 ASN HD22 1 56 GLY H 3.537 . 6.000 4.158 4.090 4.234 . 0 0 "[ . 1]" 1
2130 2 55 ASN HD22 2 56 GLY H 3.537 . 6.000 4.156 4.078 4.225 . 0 0 "[ . 1]" 1
2131 1 41 GLN HB2 1 41 GLN HE22 4.304 3.834 4.774 4.448 4.356 4.637 . 0 0 "[ . 1]" 1
2132 2 41 GLN HB2 2 41 GLN HE22 4.304 3.834 4.774 4.450 4.371 4.634 . 0 0 "[ . 1]" 1
2133 1 35 ASN H 1 35 ASN HD21 2.353 2.064 2.642 2.388 2.309 2.448 . 0 0 "[ . 1]" 1
2134 2 35 ASN H 2 35 ASN HD21 2.353 2.064 2.642 2.389 2.301 2.461 . 0 0 "[ . 1]" 1
2135 1 31 TYR QE 1 35 ASN HD21 2.751 . 6.000 3.586 3.427 3.734 . 0 0 "[ . 1]" 1
2136 2 31 TYR QE 2 35 ASN HD21 2.751 . 6.000 3.585 3.427 3.740 . 0 0 "[ . 1]" 1
2137 1 14 ALA H 2 20 MET HA 4.038 3.402 4.674 4.508 4.458 4.621 . 0 0 "[ . 1]" 1
2138 1 20 MET HA 2 14 ALA H 4.038 3.402 4.674 4.501 4.458 4.589 . 0 0 "[ . 1]" 1
2139 1 14 ALA H 2 21 ASP HA 4.181 . 6.000 3.324 3.216 3.502 . 0 0 "[ . 1]" 1
2140 1 21 ASP HA 2 14 ALA H 4.181 . 6.000 3.322 3.210 3.482 . 0 0 "[ . 1]" 1
2141 1 56 GLY H 1 56 GLY HA2 2.277 2.053 2.501 2.351 2.296 2.425 . 0 0 "[ . 1]" 1
2142 2 56 GLY H 2 56 GLY HA2 2.277 2.053 2.501 2.351 2.297 2.427 . 0 0 "[ . 1]" 1
2143 1 40 THR HB 2 18 ILE MD 5.310 . 6.000 3.676 3.652 3.708 . 0 0 "[ . 1]" 1
2144 1 18 ILE MD 2 40 THR HB 5.310 . 6.000 3.677 3.655 3.710 . 0 0 "[ . 1]" 1
2145 1 26 THR HA 1 29 LYS QD 3.482 3.084 3.880 3.332 3.221 3.393 . 0 0 "[ . 1]" 1
2146 2 26 THR HA 2 29 LYS QD 3.482 3.084 3.880 3.332 3.217 3.395 . 0 0 "[ . 1]" 1
2147 1 26 THR HA 1 29 LYS QG 3.464 3.053 3.875 3.048 3.024 3.075 0.029 8 0 "[ . 1]" 1
2148 1 18 ILE HB 2 40 THR HA 3.464 3.053 3.875 3.049 3.024 3.081 0.029 8 0 "[ . 1]" 1
2149 1 43 ILE HA 1 43 ILE HG13 1.956 . 2.236 2.038 2.008 2.076 . 0 0 "[ . 1]" 1
2150 2 43 ILE HA 2 43 ILE HG13 1.956 . 2.236 2.037 2.003 2.075 . 0 0 "[ . 1]" 1
2151 1 47 ILE HA 1 47 ILE MD 2.647 . 6.000 3.381 3.341 3.429 . 0 0 "[ . 1]" 1
2152 2 47 ILE HA 2 47 ILE MD 2.647 . 6.000 3.381 3.341 3.430 . 0 0 "[ . 1]" 1
2153 1 44 GLU HB3 1 48 LYS HA 5.715 4.843 6.587 4.970 4.932 4.990 . 0 0 "[ . 1]" 1
2154 2 44 GLU HB3 2 48 LYS HA 5.715 4.843 6.587 4.970 4.930 4.991 . 0 0 "[ . 1]" 1
2155 1 48 LYS HA 1 48 LYS HB2 2.488 2.188 2.788 2.315 2.073 2.383 0.115 3 0 "[ . 1]" 1
2156 2 48 LYS HA 2 48 LYS HB2 2.488 2.188 2.788 2.314 2.066 2.381 0.122 3 0 "[ . 1]" 1
2157 1 24 LEU QD 1 25 LYS HA 1.807 . 2.103 2.138 2.109 2.158 0.055 10 0 "[ . 1]" 1
2158 1 24 LEU QD 2 44 GLU HA 1.807 . 2.103 2.138 2.121 2.165 0.062 7 0 "[ . 1]" 1
2159 1 44 GLU HA 1 51 LEU MD2 2.434 . 6.000 4.757 4.711 4.837 . 0 0 "[ . 1]" 1
2160 1 18 ILE MD 2 44 GLU HA 2.434 . 6.000 4.759 4.713 4.840 . 0 0 "[ . 1]" 1
2161 1 25 LYS HA 1 29 LYS HA 3.883 . 6.000 5.680 5.642 5.724 . 0 0 "[ . 1]" 1
2162 2 25 LYS HA 2 29 LYS HA 3.883 . 6.000 5.678 5.643 5.724 . 0 0 "[ . 1]" 1
2163 1 29 LYS HA 1 29 LYS QE 3.908 3.552 4.264 3.904 3.827 3.950 . 0 0 "[ . 1]" 1
2164 2 29 LYS HA 2 29 LYS QE 3.908 3.552 4.264 3.904 3.826 3.949 . 0 0 "[ . 1]" 1
2165 1 45 GLU HA 1 49 GLU H 2.608 2.331 2.885 2.731 2.680 2.770 . 0 0 "[ . 1]" 1
2166 2 45 GLU HA 2 49 GLU H 2.608 2.331 2.885 2.732 2.683 2.769 . 0 0 "[ . 1]" 1
2167 1 27 ARG H 1 27 ARG HA 2.681 2.371 2.991 2.656 2.645 2.665 . 0 0 "[ . 1]" 1
2168 2 27 ARG H 2 27 ARG HA 2.681 2.371 2.991 2.656 2.646 2.665 . 0 0 "[ . 1]" 1
2169 1 22 LYS HA 1 22 LYS QD 3.794 3.435 4.153 3.918 3.836 4.050 . 0 0 "[ . 1]" 1
2170 2 22 LYS HA 2 22 LYS QD 3.794 3.435 4.153 3.917 3.839 4.051 . 0 0 "[ . 1]" 1
2171 1 22 LYS HA 1 22 LYS QG 2.494 2.182 2.806 2.303 2.203 2.393 . 0 0 "[ . 1]" 1
2172 1 14 ALA MB 2 22 LYS HA 2.494 2.182 2.806 2.304 2.207 2.392 . 0 0 "[ . 1]" 1
2173 1 41 GLN HA 1 41 GLN HB3 2.445 2.186 2.704 2.545 2.458 2.594 . 0 0 "[ . 1]" 1
2174 2 41 GLN HA 2 41 GLN HB3 2.445 2.186 2.704 2.544 2.454 2.596 . 0 0 "[ . 1]" 1
2175 1 34 LYS HA 1 34 LYS HG3 2.176 . 2.371 2.467 2.387 2.527 0.156 6 0 "[ . 1]" 1
2176 2 34 LYS HA 2 34 LYS HG3 2.176 . 2.371 2.467 2.382 2.526 0.155 6 0 "[ . 1]" 1
2177 1 24 LEU H 1 24 LEU HA 2.877 2.522 3.232 2.698 2.676 2.716 . 0 0 "[ . 1]" 1
2178 2 24 LEU H 2 24 LEU HA 2.877 2.522 3.232 2.698 2.675 2.718 . 0 0 "[ . 1]" 1
2179 1 51 LEU HA 1 51 LEU HB2 2.667 2.354 2.980 2.780 2.770 2.789 . 0 0 "[ . 1]" 1
2180 2 51 LEU HA 2 51 LEU HB2 2.667 2.354 2.980 2.780 2.770 2.789 . 0 0 "[ . 1]" 1
2181 1 51 LEU HA 1 51 LEU MD2 2.526 2.174 2.878 2.785 2.725 2.863 . 0 0 "[ . 1]" 1
2182 2 51 LEU HA 2 51 LEU MD2 2.526 2.174 2.878 2.785 2.727 2.862 . 0 0 "[ . 1]" 1
2183 1 19 TYR HA 2 15 VAL QG 2.927 2.388 3.466 3.095 3.020 3.159 . 0 0 "[ . 1]" 1
2184 1 15 VAL QG 2 19 TYR HA 2.927 2.388 3.466 3.096 3.020 3.164 . 0 0 "[ . 1]" 1
2185 1 21 ASP HA 1 22 LYS QB 3.890 3.544 4.236 3.694 3.665 3.721 . 0 0 "[ . 1]" 1
2186 2 21 ASP HA 2 22 LYS QB 3.890 3.544 4.236 3.695 3.666 3.720 . 0 0 "[ . 1]" 1
2187 1 21 ASP HA 1 24 LEU HB3 5.374 . 6.000 3.601 3.384 3.837 . 0 0 "[ . 1]" 1
2188 1 13 LYS QB 2 21 ASP HA 5.374 . 6.000 3.601 3.393 3.837 . 0 0 "[ . 1]" 1
2189 1 13 LYS HA 1 13 LYS QD 3.093 . 6.000 3.578 3.401 3.637 . 0 0 "[ . 1]" 1
2190 2 13 LYS HA 2 13 LYS QD 3.093 . 6.000 3.576 3.396 3.635 . 0 0 "[ . 1]" 1
2191 1 21 ASP HA 1 22 LYS QG 4.621 4.128 5.114 4.960 4.859 5.060 . 0 0 "[ . 1]" 1
2192 1 13 LYS QD 2 21 ASP HA 4.621 4.128 5.114 4.962 4.868 5.063 . 0 0 "[ . 1]" 1
2193 1 42 ALA HA 1 43 ILE H 3.065 2.674 3.456 3.133 3.107 3.171 . 0 0 "[ . 1]" 1
2194 2 42 ALA HA 2 43 ILE H 3.065 2.674 3.456 3.133 3.106 3.174 . 0 0 "[ . 1]" 1
2195 1 38 GLN HA 1 41 GLN H 4.657 . 6.000 3.736 3.717 3.749 . 0 0 "[ . 1]" 1
2196 2 38 GLN HA 2 41 GLN H 4.657 . 6.000 3.738 3.723 3.749 . 0 0 "[ . 1]" 1
2197 1 17 GLY H 1 17 GLY HA3 2.245 2.028 2.462 2.165 2.130 2.206 . 0 0 "[ . 1]" 1
2198 2 17 GLY H 2 17 GLY HA3 2.245 2.028 2.462 2.165 2.131 2.207 . 0 0 "[ . 1]" 1
2199 1 15 VAL MG1 1 17 GLY HA3 3.187 2.779 3.595 3.434 3.369 3.495 . 0 0 "[ . 1]" 1
2200 1 15 VAL MG1 2 17 GLY HA3 3.187 2.779 3.595 3.433 3.366 3.495 . 0 0 "[ . 1]" 1
2201 1 17 GLY HA2 1 18 ILE MG 2.406 . 6.000 3.405 3.367 3.425 . 0 0 "[ . 1]" 1
2202 1 15 VAL MG1 2 17 GLY HA2 2.406 . 6.000 3.405 3.374 3.425 . 0 0 "[ . 1]" 1
2203 1 51 LEU H 1 51 LEU HB2 2.251 . 2.525 2.151 2.135 2.173 . 0 0 "[ . 1]" 1
2204 2 51 LEU H 2 51 LEU HB2 2.251 . 2.525 2.150 2.132 2.174 . 0 0 "[ . 1]" 1
2205 1 28 LEU HB2 1 28 LEU HG 2.190 . 2.513 2.138 2.116 2.165 . 0 0 "[ . 1]" 1
2206 1 47 ILE HG12 2 28 LEU HB2 2.190 . 2.513 2.137 2.109 2.161 . 0 0 "[ . 1]" 1
2207 1 25 LYS HD3 1 25 LYS HE3 2.421 2.072 2.770 2.366 2.336 2.401 . 0 0 "[ . 1]" 1
2208 1 14 ALA MB 2 25 LYS HE3 2.421 2.072 2.770 2.368 2.339 2.402 . 0 0 "[ . 1]" 1
2209 1 24 LEU HB2 1 24 LEU QD 1.841 . 2.107 2.048 1.894 2.125 0.018 10 0 "[ . 1]" 1
2210 2 24 LEU HB2 2 24 LEU QD 1.841 . 2.107 2.048 1.890 2.125 0.018 10 0 "[ . 1]" 1
2211 1 20 MET HB2 1 20 MET ME 2.265 . 2.654 2.173 2.070 2.686 0.032 8 0 "[ . 1]" 1
2212 2 20 MET HB2 2 20 MET ME 2.265 . 2.654 2.172 2.071 2.682 0.028 8 0 "[ . 1]" 1
2213 1 43 ILE HB 1 43 ILE MG 1.351 . 6.000 2.016 2.008 2.035 . 0 0 "[ . 1]" 1
2214 1 18 ILE MD 2 43 ILE HB 1.351 . 6.000 2.017 2.005 2.034 . 0 0 "[ . 1]" 1
2215 1 41 GLN QG 1 42 ALA HA 3.581 3.257 3.905 3.354 3.286 3.501 . 0 0 "[ . 1]" 1
2216 2 41 GLN QG 2 42 ALA HA 3.581 3.257 3.905 3.354 3.284 3.503 . 0 0 "[ . 1]" 1
2217 1 41 GLN HB3 1 41 GLN QG 2.470 2.199 2.741 2.166 2.143 2.214 0.056 7 0 "[ . 1]" 1
2218 2 41 GLN HB3 2 41 GLN QG 2.470 2.199 2.741 2.166 2.144 2.215 0.055 2 0 "[ . 1]" 1
2219 1 31 TYR HA 1 34 LYS QB 2.220 2.018 2.422 2.213 2.173 2.265 . 0 0 "[ . 1]" 1
2220 2 31 TYR HA 2 34 LYS QB 2.220 2.018 2.422 2.213 2.174 2.264 . 0 0 "[ . 1]" 1
2221 1 22 LYS QB 1 25 LYS HE3 3.378 . 6.000 5.445 4.803 5.768 . 0 0 "[ . 1]" 1
2222 2 22 LYS QB 2 25 LYS HE3 3.378 . 6.000 5.445 4.810 5.769 . 0 0 "[ . 1]" 1
2223 1 29 LYS QB 1 39 LEU QD 2.118 . 2.440 2.468 2.440 2.500 0.060 10 0 "[ . 1]" 1
2224 2 29 LYS QB 2 39 LEU QD 2.118 . 2.440 2.470 2.441 2.499 0.059 10 0 "[ . 1]" 1
2225 1 20 MET HB2 1 20 MET HG3 2.565 . 6.000 1.978 1.863 2.290 . 0 0 "[ . 1]" 1
2226 2 20 MET HB2 2 20 MET HG3 2.565 . 6.000 1.978 1.861 2.291 . 0 0 "[ . 1]" 1
2227 1 18 ILE MD 1 20 MET HG2 4.288 3.237 5.339 3.832 3.708 3.899 . 0 0 "[ . 1]" 1
2228 1 15 VAL MG2 2 20 MET HG2 4.288 3.237 5.339 3.832 3.708 3.901 . 0 0 "[ . 1]" 1
2229 1 18 ILE MD 1 20 MET HG3 3.677 . 6.000 4.600 4.453 4.818 . 0 0 "[ . 1]" 1
2230 1 15 VAL MG2 2 20 MET HG3 3.677 . 6.000 4.600 4.451 4.812 . 0 0 "[ . 1]" 1
2231 1 20 MET HG2 1 25 LYS HD3 2.541 2.226 2.856 2.539 2.484 2.586 . 0 0 "[ . 1]" 1
2232 2 20 MET HG2 2 25 LYS HD3 2.541 2.226 2.856 2.541 2.490 2.586 . 0 0 "[ . 1]" 1
2233 1 25 LYS HD3 2 16 PHE QR 4.132 3.584 4.680 3.779 3.739 3.816 . 0 0 "[ . 1]" 1
2234 1 16 PHE QR 2 25 LYS HD3 4.132 3.584 4.680 3.782 3.743 3.811 . 0 0 "[ . 1]" 1
2235 1 45 GLU QB 2 50 TYR QE 2.399 2.099 2.699 2.464 2.277 2.641 . 0 0 "[ . 1]" 1
2236 1 50 TYR QE 2 45 GLU QB 2.399 2.099 2.699 2.462 2.276 2.647 . 0 0 "[ . 1]" 1
2237 1 45 GLU HA 1 45 GLU QB 2.479 2.220 2.738 2.169 2.133 2.185 0.087 9 0 "[ . 1]" 1
2238 2 45 GLU HA 2 45 GLU QB 2.479 2.220 2.738 2.169 2.131 2.185 0.089 9 0 "[ . 1]" 1
2239 1 49 GLU QB 1 50 TYR QB 3.133 2.817 3.449 3.577 3.508 3.669 0.220 8 0 "[ . 1]" 1
2240 1 50 TYR QB 2 49 GLU QB 3.133 2.817 3.449 3.576 3.511 3.665 0.216 8 0 "[ . 1]" 1
2241 1 42 ALA MB 1 45 GLU QB 3.609 3.184 4.034 3.865 3.746 4.030 . 0 0 "[ . 1]" 1
2242 1 53 LYS HG3 2 49 GLU QB 3.609 3.184 4.034 3.865 3.749 4.031 . 0 0 "[ . 1]" 1
2243 1 47 ILE H 1 47 ILE HG13 3.903 3.449 4.357 4.201 4.175 4.237 . 0 0 "[ . 1]" 1
2244 1 28 LEU H 2 47 ILE HG13 3.903 3.449 4.357 4.200 4.173 4.236 . 0 0 "[ . 1]" 1
2245 1 47 ILE H 1 47 ILE HG12 3.043 . 6.000 3.929 3.859 4.047 . 0 0 "[ . 1]" 1
2246 1 28 LEU H 2 47 ILE HG12 3.043 . 6.000 3.930 3.862 4.044 . 0 0 "[ . 1]" 1
2247 1 49 GLU HA 1 52 GLN HB2 2.366 2.120 2.612 2.409 2.294 2.553 . 0 0 "[ . 1]" 1
2248 2 49 GLU HA 2 52 GLN HB2 2.366 2.120 2.612 2.409 2.296 2.555 . 0 0 "[ . 1]" 1
2249 1 48 LYS H 1 48 LYS QG 4.263 . 6.000 3.015 2.943 3.133 . 0 0 "[ . 1]" 1
2250 2 48 LYS H 2 48 LYS QG 4.263 . 6.000 3.015 2.945 3.133 . 0 0 "[ . 1]" 1
2251 1 28 LEU MD1 2 16 PHE HE1 3.195 2.626 3.764 4.018 3.962 4.080 0.316 5 0 "[ . 1]" 1
2252 1 16 PHE HE1 2 28 LEU MD1 3.195 2.626 3.764 4.019 3.955 4.085 0.321 6 0 "[ . 1]" 1
2253 1 51 LEU MD2 2 24 LEU HA 4.024 3.231 4.817 3.862 3.802 3.977 . 0 0 "[ . 1]" 1
2254 1 24 LEU HA 2 51 LEU MD2 4.024 3.231 4.817 3.863 3.804 3.985 . 0 0 "[ . 1]" 1
2255 1 51 LEU MD2 2 27 ARG QD 3.552 2.984 4.120 3.392 3.230 3.519 . 0 0 "[ . 1]" 1
2256 1 27 ARG QD 2 51 LEU MD2 3.552 2.984 4.120 3.392 3.225 3.516 . 0 0 "[ . 1]" 1
2257 1 28 LEU MD1 1 43 ILE HB 2.575 . 6.000 4.374 4.295 4.446 . 0 0 "[ . 1]" 1
2258 1 51 LEU HG 2 28 LEU MD1 2.575 . 6.000 4.373 4.292 4.446 . 0 0 "[ . 1]" 1
2259 1 28 LEU HB3 1 28 LEU MD1 1.158 . 6.000 1.537 1.509 1.580 . 0 0 "[ . 1]" 1
2260 2 28 LEU HB3 2 28 LEU MD1 1.158 . 6.000 1.537 1.509 1.581 . 0 0 "[ . 1]" 1
2261 1 18 ILE MD 1 18 ILE HG12 1.621 . 1.882 1.959 1.956 1.965 0.083 4 0 "[ . 1]" 1
2262 2 18 ILE MD 2 18 ILE HG12 1.621 . 1.882 1.959 1.955 1.964 0.082 9 0 "[ . 1]" 1
2263 1 18 ILE HG13 1 20 MET H 2.630 2.238 3.022 3.060 2.974 3.153 0.131 9 0 "[ . 1]" 1
2264 1 47 ILE H 2 24 LEU QD 2.630 2.238 3.022 3.059 2.972 3.154 0.132 9 0 "[ . 1]" 1
2265 1 24 LEU QD 1 25 LYS HA 1.789 . 2.124 2.138 2.121 2.163 0.039 7 0 "[ . 1]" 1
2266 1 44 GLU HA 2 24 LEU QD 1.789 . 2.124 2.138 2.110 2.159 0.035 10 0 "[ . 1]" 1
2267 1 24 LEU QD 1 25 LYS QB 2.035 . 6.000 2.802 2.717 3.193 . 0 0 "[ . 1]" 1
2268 1 47 ILE HB 2 24 LEU QD 2.035 . 6.000 2.802 2.716 3.194 . 0 0 "[ . 1]" 1
2269 1 29 LYS QG 1 32 CYS HB2 3.814 3.385 4.243 3.632 3.596 3.671 . 0 0 "[ . 1]" 1
2270 2 29 LYS QG 2 32 CYS HB2 3.814 3.385 4.243 3.633 3.594 3.670 . 0 0 "[ . 1]" 1
2271 1 37 LEU H 1 39 LEU MD1 2.912 . 6.000 6.076 6.069 6.088 0.088 4 0 "[ . 1]" 1
2272 1 18 ILE H 2 39 LEU MD1 2.912 . 6.000 6.076 6.070 6.086 0.086 4 0 "[ . 1]" 1
2273 1 11 LYS QG 1 13 LYS HA 3.534 . 6.000 5.503 4.011 5.938 . 0 0 "[ . 1]" 1
2274 1 13 LYS HA 2 22 LYS QG 3.534 . 6.000 5.500 4.011 5.917 . 0 0 "[ . 1]" 1
2275 1 28 LEU MD2 1 32 CYS HB2 3.236 2.616 3.856 3.826 3.716 3.895 0.039 7 0 "[ . 1]" 1
2276 2 28 LEU MD2 2 32 CYS HB2 3.236 2.616 3.856 3.827 3.717 3.896 0.040 7 0 "[ . 1]" 1
2277 1 11 LYS H 1 11 LYS QG 4.293 . 6.000 2.493 2.005 2.958 . 0 0 "[ . 1]" 1
2278 2 11 LYS H 2 11 LYS QG 4.293 . 6.000 2.497 2.014 2.963 . 0 0 "[ . 1]" 1
2279 1 29 LYS QE 1 29 LYS QG 2.502 . 6.000 2.001 1.884 2.147 . 0 0 "[ . 1]" 1
2280 2 29 LYS QE 2 29 LYS QG 2.502 . 6.000 2.001 1.885 2.148 . 0 0 "[ . 1]" 1
2281 1 40 THR H 1 40 THR MG 2.903 . 6.000 3.611 3.591 3.635 . 0 0 "[ . 1]" 1
2282 1 18 ILE H 2 40 THR MG 2.903 . 6.000 3.612 3.594 3.635 . 0 0 "[ . 1]" 1
2283 1 50 TYR H 1 51 LEU MD1 3.475 2.892 4.058 3.932 3.847 4.021 . 0 0 "[ . 1]" 1
2284 1 31 TYR H 2 51 LEU MD1 3.475 2.892 4.058 3.933 3.840 4.027 . 0 0 "[ . 1]" 1
2285 1 51 LEU MD1 1 54 ARG H 3.091 2.538 3.644 3.668 3.618 3.714 0.070 6 0 "[ . 1]" 1
2286 1 31 TYR QE 2 51 LEU MD1 3.091 2.538 3.644 3.669 3.617 3.712 0.068 6 0 "[ . 1]" 1
2287 1 51 LEU MD1 1 52 GLN HA 3.501 2.972 4.030 4.049 4.009 4.089 0.059 9 0 "[ . 1]" 1
2288 1 27 ARG HA 2 51 LEU MD1 3.501 2.972 4.030 4.049 4.005 4.094 0.064 9 0 "[ . 1]" 1
2289 1 50 TYR QB 1 51 LEU MD1 2.113 . 6.000 3.171 3.057 3.310 . 0 0 "[ . 1]" 1
2290 2 50 TYR QB 2 51 LEU MD1 2.113 . 6.000 3.170 3.051 3.310 . 0 0 "[ . 1]" 1
2291 1 40 THR MG 1 44 GLU HG2 2.826 . 6.000 3.405 3.343 3.502 . 0 0 "[ . 1]" 1
2292 1 19 TYR HB3 2 40 THR MG 2.826 . 6.000 3.403 3.336 3.505 . 0 0 "[ . 1]" 1
2293 1 40 THR MG 1 41 GLN QG 3.147 . 6.000 4.613 4.521 4.697 . 0 0 "[ . 1]" 1
2294 1 20 MET HG3 2 40 THR MG 3.147 . 6.000 4.613 4.516 4.702 . 0 0 "[ . 1]" 1
2295 1 51 LEU MD1 1 54 ARG HB2 2.386 . 6.000 3.233 3.164 3.284 . 0 0 "[ . 1]" 1
2296 1 28 LEU HB2 2 51 LEU MD1 2.386 . 6.000 3.234 3.168 3.287 . 0 0 "[ . 1]" 1
2297 1 40 THR MG 1 43 ILE HB 2.130 . 6.000 2.656 2.478 2.789 . 0 0 "[ . 1]" 1
2298 1 20 MET HB3 2 40 THR MG 2.130 . 6.000 2.656 2.470 2.808 . 0 0 "[ . 1]" 1
2299 1 51 LEU MD1 2 28 LEU HB3 2.561 . 6.000 3.957 3.837 4.060 . 0 0 "[ . 1]" 1
2300 1 28 LEU HB3 2 51 LEU MD1 2.561 . 6.000 3.959 3.832 4.067 . 0 0 "[ . 1]" 1
2301 1 15 VAL H 1 15 VAL MG1 2.744 . 6.000 3.502 3.480 3.544 . 0 0 "[ . 1]" 1
2302 1 19 TYR H 2 15 VAL MG1 2.744 . 6.000 3.500 3.482 3.539 . 0 0 "[ . 1]" 1
2303 1 22 LYS QE 1 26 THR MG 3.492 2.769 4.215 3.403 2.952 4.227 0.012 4 0 "[ . 1]" 1
2304 2 22 LYS QE 2 26 THR MG 3.492 2.769 4.215 3.401 2.955 4.233 0.018 4 0 "[ . 1]" 1
2305 1 14 ALA MB 2 20 MET HG2 3.179 2.535 3.823 3.529 3.448 3.667 . 0 0 "[ . 1]" 1
2306 1 20 MET HG2 2 14 ALA MB 3.179 2.535 3.823 3.530 3.454 3.667 . 0 0 "[ . 1]" 1
2307 1 27 ARG HA 1 30 VAL MG1 2.517 . 6.000 3.477 3.446 3.512 . 0 0 "[ . 1]" 1
2308 2 27 ARG HA 2 30 VAL MG1 2.517 . 6.000 3.476 3.443 3.508 . 0 0 "[ . 1]" 1
2309 1 29 LYS QE 1 30 VAL MG1 2.881 . 6.000 4.260 3.716 4.833 . 0 0 "[ . 1]" 1
2310 2 29 LYS QE 2 30 VAL MG1 2.881 . 6.000 4.259 3.717 4.832 . 0 0 "[ . 1]" 1
2311 1 15 VAL MG1 1 16 PHE HB3 4.380 3.482 5.278 4.213 4.175 4.238 . 0 0 "[ . 1]" 1
2312 1 19 TYR HB2 2 15 VAL MG1 4.380 3.482 5.278 4.211 4.174 4.232 . 0 0 "[ . 1]" 1
2313 1 14 ALA MB 1 15 VAL MG1 2.636 . 6.000 4.867 4.855 4.885 . 0 0 "[ . 1]" 1
2314 1 25 LYS HD3 2 15 VAL MG1 2.636 . 6.000 4.867 4.847 4.882 . 0 0 "[ . 1]" 1
2315 1 14 ALA H 1 15 VAL MG2 3.114 . 6.000 3.819 3.798 3.855 . 0 0 "[ . 1]" 1
2316 2 14 ALA H 2 15 VAL MG2 3.114 . 6.000 3.820 3.803 3.856 . 0 0 "[ . 1]" 1
2317 1 15 VAL MG2 1 17 GLY HA2 3.532 . 6.000 6.000 5.931 6.040 0.040 9 0 "[ . 1]" 1
2318 1 17 GLY HA2 2 15 VAL MG2 3.532 . 6.000 6.002 5.926 6.038 0.038 9 0 "[ . 1]" 1
2319 1 31 TYR HB3 1 42 ALA MB 3.122 2.422 3.822 3.508 3.471 3.567 . 0 0 "[ . 1]" 1
2320 2 31 TYR HB3 2 42 ALA MB 3.122 2.422 3.822 3.507 3.471 3.567 . 0 0 "[ . 1]" 1
2321 1 42 ALA MB 1 44 GLU HG2 3.189 . 6.000 5.085 4.825 5.462 . 0 0 "[ . 1]" 1
2322 2 42 ALA MB 2 44 GLU HG2 3.189 . 6.000 5.081 4.835 5.459 . 0 0 "[ . 1]" 1
2323 1 39 LEU HB2 1 42 ALA MB 3.142 . 6.000 4.090 4.063 4.147 . 0 0 "[ . 1]" 1
2324 2 39 LEU HB2 2 42 ALA MB 3.142 . 6.000 4.089 4.062 4.142 . 0 0 "[ . 1]" 1
2325 1 43 ILE HA 1 47 ILE MG 3.304 2.763 3.845 3.749 3.708 3.790 . 0 0 "[ . 1]" 1
2326 1 43 ILE HA 2 47 ILE MG 3.304 2.763 3.845 3.749 3.707 3.789 . 0 0 "[ . 1]" 1
2327 1 47 ILE HG12 1 47 ILE MG 1.395 . 6.000 1.916 1.888 1.967 . 0 0 "[ . 1]" 1
2328 1 20 MET ME 2 47 ILE MG 1.395 . 6.000 1.918 1.890 1.969 . 0 0 "[ . 1]" 1
2329 1 14 ALA MB 1 47 ILE MG 2.671 . 6.000 5.425 5.349 5.512 . 0 0 "[ . 1]" 1
2330 2 14 ALA MB 2 47 ILE MG 2.671 . 6.000 5.423 5.351 5.514 . 0 0 "[ . 1]" 1
2331 1 18 ILE MG 2 25 LYS HE2 3.100 . 6.000 5.896 5.809 6.027 0.027 2 0 "[ . 1]" 1
2332 1 25 LYS HE2 2 18 ILE MG 3.100 . 6.000 5.893 5.805 6.022 0.022 2 0 "[ . 1]" 1
2333 1 18 ILE HG13 1 18 ILE MG 2.167 . 6.000 3.067 3.051 3.079 . 0 0 "[ . 1]" 1
2334 1 39 LEU MD1 2 18 ILE MG 2.167 . 6.000 3.066 3.050 3.082 . 0 0 "[ . 1]" 1
2335 1 29 LYS HA 1 33 ALA MB 3.609 2.927 4.291 4.360 4.320 4.394 0.103 1 0 "[ . 1]" 1
2336 2 29 LYS HA 2 33 ALA MB 3.609 2.927 4.291 4.362 4.324 4.396 0.105 10 0 "[ . 1]" 1
2337 1 43 ILE H 1 43 ILE MG 2.906 . 6.000 3.484 3.478 3.497 . 0 0 "[ . 1]" 1
2338 2 43 ILE H 2 43 ILE MG 2.906 . 6.000 3.483 3.474 3.496 . 0 0 "[ . 1]" 1
2339 1 44 GLU H 1 46 ALA MB 3.065 2.623 3.507 3.651 3.635 3.665 0.158 2 0 "[ . 1]" 1
2340 1 50 TYR H 2 46 ALA MB 3.065 2.623 3.507 3.649 3.634 3.665 0.158 1 0 "[ . 1]" 1
2341 1 43 ILE HA 1 46 ALA MB 1.627 . 1.877 1.938 1.905 1.975 0.098 1 0 "[ . 1]" 1
2342 1 50 TYR QB 2 46 ALA MB 1.627 . 1.877 1.936 1.898 1.975 0.098 1 0 "[ . 1]" 1
2343 1 43 ILE MG 1 44 GLU QB 3.269 2.757 3.781 3.902 3.888 3.922 0.141 8 0 "[ . 1]" 1
2344 2 43 ILE MG 2 44 GLU QB 3.269 2.757 3.781 3.903 3.886 3.918 0.137 8 0 "[ . 1]" 1
2345 1 46 ALA MB 1 47 ILE HB 2.679 2.193 3.165 2.713 2.659 2.783 . 0 0 "[ . 1]" 1
2346 1 47 ILE HB 2 46 ALA MB 2.679 2.193 3.165 2.713 2.660 2.780 . 0 0 "[ . 1]" 1
2347 1 20 MET ME 1 46 ALA MB 2.794 . 6.000 3.291 3.131 3.360 . 0 0 "[ . 1]" 1
2348 1 47 ILE HG12 2 46 ALA MB 2.794 . 6.000 3.292 3.135 3.362 . 0 0 "[ . 1]" 1
2349 1 14 ALA MB 1 43 ILE MG 2.437 . 6.000 4.651 4.619 4.669 . 0 0 "[ . 1]" 1
2350 1 25 LYS HD3 2 43 ILE MG 2.437 . 6.000 4.651 4.619 4.669 . 0 0 "[ . 1]" 1
2351 1 20 MET H 1 20 MET ME 3.860 3.177 4.543 4.043 3.991 4.082 . 0 0 "[ . 1]" 1
2352 1 47 ILE H 2 20 MET ME 3.860 3.177 4.543 4.042 3.991 4.081 . 0 0 "[ . 1]" 1
2353 1 20 MET ME 1 24 LEU H 4.569 3.636 5.502 4.775 4.690 4.998 . 0 0 "[ . 1]" 1
2354 1 43 ILE H 2 20 MET ME 4.569 3.636 5.502 4.774 4.693 4.990 . 0 0 "[ . 1]" 1
2355 1 20 MET ME 1 25 LYS HA 1.805 . 6.000 2.314 2.267 2.509 . 0 0 "[ . 1]" 1
2356 1 44 GLU HA 2 20 MET ME 1.805 . 6.000 2.314 2.262 2.512 . 0 0 "[ . 1]" 1
2357 1 20 MET ME 1 43 ILE HG13 1.822 . 6.000 3.310 3.160 3.384 . 0 0 "[ . 1]" 1
2358 1 47 ILE HG13 2 20 MET ME 1.822 . 6.000 3.310 3.156 3.381 . 0 0 "[ . 1]" 1
2359 1 47 ILE H 1 47 ILE MD 2.801 . 6.000 3.564 3.529 3.589 . 0 0 "[ . 1]" 1
2360 1 28 LEU H 2 47 ILE MD 2.801 . 6.000 3.564 3.525 3.589 . 0 0 "[ . 1]" 1
2361 1 28 LEU HA 1 43 ILE MD 3.620 . 6.000 5.336 5.260 5.407 . 0 0 "[ . 1]" 1
2362 1 18 ILE HA 2 43 ILE MD 3.620 . 6.000 5.336 5.259 5.409 . 0 0 "[ . 1]" 1
2363 1 16 PHE HB3 1 18 ILE MD 3.801 2.961 4.641 3.499 3.433 3.541 . 0 0 "[ . 1]" 1
2364 1 16 PHE HB3 2 18 ILE MD 3.801 2.961 4.641 3.501 3.434 3.543 . 0 0 "[ . 1]" 1
2365 1 47 ILE MD 2 20 MET HB3 2.257 . 6.000 4.157 4.117 4.201 . 0 0 "[ . 1]" 1
2366 1 20 MET HB3 2 47 ILE MD 2.257 . 6.000 4.158 4.114 4.204 . 0 0 "[ . 1]" 1
2367 1 20 MET ME 1 43 ILE MD 1.632 . 6.000 2.595 2.505 2.670 . 0 0 "[ . 1]" 1
2368 2 20 MET ME 2 43 ILE MD 1.632 . 6.000 2.595 2.500 2.672 . 0 0 "[ . 1]" 1
2369 1 47 ILE MD 2 20 MET ME 1.224 . 1.464 1.550 1.501 1.584 0.120 9 0 "[ . 1]" 1
2370 1 20 MET ME 2 47 ILE MD 1.224 . 1.464 1.548 1.501 1.580 0.116 9 0 "[ . 1]" 1
2371 1 25 LYS HG2 1 43 ILE MD 2.766 . 6.000 3.909 3.862 3.976 . 0 0 "[ . 1]" 1
2372 1 18 ILE HG12 2 43 ILE MD 2.766 . 6.000 3.909 3.861 3.968 . 0 0 "[ . 1]" 1
2373 1 18 ILE MD 1 20 MET HG3 3.679 . 6.000 4.652 4.502 4.890 . 0 0 "[ . 1]" 1
2374 1 41 GLN QG 2 18 ILE MD 3.679 . 6.000 4.653 4.500 4.884 . 0 0 "[ . 1]" 1
2375 1 47 ILE MD 2 20 MET HG3 4.747 3.549 5.945 4.726 4.541 4.956 . 0 0 "[ . 1]" 1
2376 1 20 MET HG3 2 47 ILE MD 4.747 3.549 5.945 4.728 4.545 4.953 . 0 0 "[ . 1]" 1
2377 1 18 ILE MD 1 20 MET HB3 1.733 . 6.000 2.254 2.215 2.285 . 0 0 "[ . 1]" 1
2378 1 43 ILE HB 2 18 ILE MD 1.733 . 6.000 2.252 2.213 2.281 . 0 0 "[ . 1]" 1
2379 1 18 ILE MD 1 20 MET ME 1.865 . 6.000 3.359 3.020 3.468 . 0 0 "[ . 1]" 1
2380 1 39 LEU HB3 2 18 ILE MD 1.865 . 6.000 3.359 3.012 3.470 . 0 0 "[ . 1]" 1
2381 1 24 LEU QD 1 28 LEU HB3 2.871 2.431 3.311 2.837 2.810 2.879 . 0 0 "[ . 1]" 1
2382 2 24 LEU QD 2 28 LEU HB3 2.871 2.431 3.311 2.836 2.810 2.876 . 0 0 "[ . 1]" 1
2383 1 51 LEU H 1 51 LEU HG 4.660 . 6.000 3.774 3.707 3.813 . 0 0 "[ . 1]" 1
2384 1 27 ARG HE 2 51 LEU HG 4.660 . 6.000 3.773 3.711 3.807 . 0 0 "[ . 1]" 1
2385 1 47 ILE HG12 1 51 LEU MD2 1.785 . 2.126 2.064 1.969 2.167 0.041 8 0 "[ . 1]" 1
2386 1 27 ARG HG3 2 51 LEU MD2 1.785 . 2.126 2.065 1.965 2.168 0.042 8 0 "[ . 1]" 1
2387 1 51 LEU MD1 2 27 ARG HG3 2.655 2.210 3.100 3.057 2.977 3.113 0.013 10 0 "[ . 1]" 1
2388 1 27 ARG HG3 2 51 LEU MD1 2.655 2.210 3.100 3.056 2.987 3.118 0.018 10 0 "[ . 1]" 1
2389 1 28 LEU MD1 1 39 LEU HG 2.781 . 6.000 3.738 3.719 3.770 . 0 0 "[ . 1]" 1
2390 2 28 LEU MD1 2 39 LEU HG 2.781 . 6.000 3.738 3.719 3.769 . 0 0 "[ . 1]" 1
2391 1 24 LEU QD 1 27 ARG H 3.867 3.122 4.612 3.880 3.757 4.032 . 0 0 "[ . 1]" 1
2392 1 44 GLU H 2 24 LEU QD 3.867 3.122 4.612 3.878 3.754 4.033 . 0 0 "[ . 1]" 1
2393 1 37 LEU MD2 1 38 GLN HG3 5.275 4.232 6.318 4.847 4.697 4.995 . 0 0 "[ . 1]" 1
2394 2 37 LEU MD2 2 38 GLN HG3 5.275 4.232 6.318 4.847 4.701 4.987 . 0 0 "[ . 1]" 1
2395 1 16 PHE HB3 1 17 GLY HA2 2.415 . 6.000 3.945 3.872 3.986 . 0 0 "[ . 1]" 1
2396 1 16 PHE HB3 2 17 GLY HA2 2.415 . 6.000 3.945 3.873 3.995 . 0 0 "[ . 1]" 1
2397 1 28 LEU HA 1 29 LYS QG 3.429 . 6.000 5.464 5.292 5.559 . 0 0 "[ . 1]" 1
2398 2 28 LEU HA 2 29 LYS QG 3.429 . 6.000 5.465 5.290 5.555 . 0 0 "[ . 1]" 1
2399 1 24 LEU HB2 1 27 ARG H 4.286 . 6.000 5.276 5.194 5.357 . 0 0 "[ . 1]" 1
2400 1 27 ARG H 2 51 LEU HB2 4.286 . 6.000 5.277 5.194 5.356 . 0 0 "[ . 1]" 1
2401 1 43 ILE HA 2 18 ILE MD 2.210 . 6.000 4.567 4.530 4.628 . 0 0 "[ . 1]" 1
2402 1 18 ILE MD 2 43 ILE HA 2.210 . 6.000 4.570 4.537 4.629 . 0 0 "[ . 1]" 1
2403 1 47 ILE HB 1 47 ILE HG13 2.781 2.295 3.267 2.263 2.225 2.302 0.070 1 0 "[ . 1]" 1
2404 1 43 ILE HG13 2 47 ILE HB 2.781 2.295 3.267 2.263 2.225 2.304 0.070 1 0 "[ . 1]" 1
2405 1 44 GLU HB2 1 46 ALA MB 3.485 . 6.000 3.953 3.599 4.150 . 0 0 "[ . 1]" 1
2406 1 24 LEU QD 2 44 GLU HB2 3.485 . 6.000 3.954 3.588 4.156 . 0 0 "[ . 1]" 1
2407 1 44 GLU HB3 2 24 LEU QD 2.752 2.316 3.188 2.716 2.318 2.966 . 0 0 "[ . 1]" 1
2408 1 24 LEU QD 2 44 GLU HB3 2.752 2.316 3.188 2.717 2.304 2.961 0.012 4 0 "[ . 1]" 1
2409 1 46 ALA MB 1 50 TYR HA 5.445 . 6.000 4.158 4.081 4.223 . 0 0 "[ . 1]" 1
2410 1 28 LEU MD2 2 50 TYR HA 5.445 . 6.000 4.160 4.090 4.222 . 0 0 "[ . 1]" 1
2411 1 41 GLN HE21 1 41 GLN QG 2.892 . 6.000 1.969 1.950 1.995 . 0 0 "[ . 1]" 1
2412 2 41 GLN HE21 2 41 GLN QG 2.892 . 6.000 1.970 1.956 1.994 . 0 0 "[ . 1]" 1
2413 1 31 TYR QE 2 54 ARG HB3 5.334 . 6.000 3.505 3.410 3.616 . 0 0 "[ . 1]" 1
2414 1 18 ILE MD 2 41 GLN H 5.334 . 6.000 3.503 3.413 3.615 . 0 0 "[ . 1]" 1
2415 1 48 LYS HA 2 20 MET ME 4.386 3.660 5.112 5.096 4.916 5.173 0.061 7 0 "[ . 1]" 1
2416 1 20 MET ME 2 48 LYS HA 4.386 3.660 5.112 5.099 4.915 5.178 0.066 7 0 "[ . 1]" 1
2417 1 25 LYS HA 2 47 ILE HB 4.586 3.925 5.247 5.420 5.363 5.485 0.238 1 0 "[ . 1]" 1
2418 1 47 ILE HB 2 25 LYS HA 4.586 3.925 5.247 5.420 5.364 5.485 0.238 1 0 "[ . 1]" 1
2419 1 19 TYR HA 2 14 ALA H . 2.984 3.658 3.593 3.556 3.628 . 0 0 "[ . 1]" 1
2420 1 14 ALA H 2 19 TYR HA . 2.984 3.658 3.596 3.558 3.623 . 0 0 "[ . 1]" 1
2421 1 19 TYR HA 2 13 LYS QD 5.543 . 6.000 4.270 3.968 4.416 . 0 0 "[ . 1]" 1
2422 1 13 LYS QD 2 19 TYR HA 5.543 . 6.000 4.270 3.963 4.431 . 0 0 "[ . 1]" 1
2423 1 13 LYS HA 2 22 LYS QG 5.059 4.404 5.714 5.651 5.447 5.816 0.102 5 0 "[ . 1]" 1
2424 1 22 LYS QG 2 13 LYS HA 5.059 4.404 5.714 5.653 5.421 5.809 0.095 5 0 "[ . 1]" 1
2425 1 21 ASP HA 2 11 LYS QG 5.383 4.815 5.951 5.428 4.700 5.727 0.115 2 0 "[ . 1]" 1
2426 1 11 LYS QG 2 21 ASP HA 5.383 4.815 5.951 5.429 4.702 5.741 0.113 2 0 "[ . 1]" 1
2427 1 17 GLY HA3 2 15 VAL MG2 4.208 . 6.000 5.884 5.816 5.941 . 0 0 "[ . 1]" 1
2428 1 15 VAL MG2 2 17 GLY HA3 4.208 . 6.000 5.884 5.810 5.942 . 0 0 "[ . 1]" 1
2429 1 17 GLY HA2 2 15 VAL MG2 3.339 . 6.000 5.076 5.008 5.140 . 0 0 "[ . 1]" 1
2430 1 15 VAL MG2 2 17 GLY HA2 3.339 . 6.000 5.076 5.008 5.142 . 0 0 "[ . 1]" 1
2431 1 25 LYS HE2 2 16 PHE QR 4.401 . 6.000 3.044 2.900 3.103 . 0 0 "[ . 1]" 1
2432 1 16 PHE QR 2 25 LYS HE2 4.401 . 6.000 3.046 2.912 3.099 . 0 0 "[ . 1]" 1
2433 1 51 LEU MD2 2 24 LEU QD 1.377 . 6.000 2.097 2.051 2.160 . 0 0 "[ . 1]" 1
2434 1 24 LEU QD 2 51 LEU MD2 1.377 . 6.000 2.099 2.051 2.174 . 0 0 "[ . 1]" 1
2435 1 28 LEU MD1 2 16 PHE QE 2.995 . 6.000 4.497 4.459 4.537 . 0 0 "[ . 1]" 1
2436 1 16 PHE QE 2 28 LEU MD1 2.995 . 6.000 4.499 4.464 4.541 . 0 0 "[ . 1]" 1
2437 1 24 LEU QD 2 44 GLU HG3 3.259 2.783 3.735 3.298 3.000 3.466 . 0 0 "[ . 1]" 1
2438 1 44 GLU HG3 2 24 LEU QD 3.259 2.783 3.735 3.296 2.990 3.462 . 0 0 "[ . 1]" 1
2439 1 18 ILE HG13 2 15 VAL HB 3.636 . 6.000 6.075 5.978 6.111 0.111 7 0 "[ . 1]" 1
2440 1 15 VAL HB 2 18 ILE HG13 3.636 . 6.000 6.076 5.983 6.111 0.111 7 0 "[ . 1]" 1
2441 1 24 LEU QD 2 47 ILE H 3.483 2.693 4.273 2.786 2.618 2.914 0.075 4 0 "[ . 1]" 1
2442 1 47 ILE H 2 24 LEU QD 3.483 2.693 4.273 2.782 2.610 2.918 0.083 9 0 "[ . 1]" 1
2443 1 39 LEU MD1 2 16 PHE HZ 2.370 . 2.887 1.816 1.787 1.842 0.066 2 0 "[ . 1]" 1
2444 1 16 PHE HZ 2 39 LEU MD1 2.370 . 2.887 1.817 1.790 1.841 0.063 2 0 "[ . 1]" 1
2445 1 39 LEU MD2 2 16 PHE QE 3.182 2.691 3.673 3.566 3.498 3.612 . 0 0 "[ . 1]" 1
2446 1 16 PHE QE 2 39 LEU MD2 3.182 2.691 3.673 3.566 3.496 3.614 . 0 0 "[ . 1]" 1
2447 1 39 LEU MD1 2 18 ILE MD 2.381 . 6.000 3.663 3.594 3.728 . 0 0 "[ . 1]" 1
2448 1 18 ILE MD 2 39 LEU MD1 2.381 . 6.000 3.663 3.589 3.733 . 0 0 "[ . 1]" 1
2449 1 51 LEU MD1 2 27 ARG HE 4.848 4.077 5.619 5.451 5.320 5.569 . 0 0 "[ . 1]" 1
2450 1 27 ARG HE 2 51 LEU MD1 4.848 4.077 5.619 5.448 5.316 5.546 . 0 0 "[ . 1]" 1
2451 1 42 ALA MB 2 47 ILE MD 2.811 . 3.702 3.779 3.733 3.819 0.117 8 0 "[ . 1]" 1
2452 1 47 ILE MD 2 42 ALA MB 2.811 . 3.702 3.778 3.731 3.807 0.105 8 0 "[ . 1]" 1
2453 1 47 ILE MG 2 24 LEU H 5.222 4.115 6.329 5.612 5.533 5.666 . 0 0 "[ . 1]" 1
2454 1 24 LEU H 2 47 ILE MG 5.222 4.115 6.329 5.613 5.532 5.670 . 0 0 "[ . 1]" 1
2455 1 18 ILE MG 2 16 PHE QD 3.096 . 6.000 5.403 5.276 5.501 . 0 0 "[ . 1]" 1
2456 1 16 PHE QD 2 18 ILE MG 3.096 . 6.000 5.401 5.276 5.497 . 0 0 "[ . 1]" 1
2457 1 18 ILE MG 2 39 LEU HB2 4.112 3.106 5.118 3.810 3.749 3.887 . 0 0 "[ . 1]" 1
2458 1 39 LEU HB2 2 18 ILE MG 4.112 3.106 5.118 3.807 3.743 3.886 . 0 0 "[ . 1]" 1
2459 1 47 ILE MG 2 28 LEU HB3 3.330 . 6.000 4.589 4.459 4.678 . 0 0 "[ . 1]" 1
2460 1 28 LEU HB3 2 47 ILE MG 3.330 . 6.000 4.591 4.453 4.688 . 0 0 "[ . 1]" 1
2461 1 18 ILE MG 2 43 ILE MD 1.814 . 6.000 3.475 3.428 3.519 . 0 0 "[ . 1]" 1
2462 1 43 ILE MD 2 18 ILE MG 1.814 . 6.000 3.471 3.420 3.514 . 0 0 "[ . 1]" 1
2463 1 46 ALA MB 2 47 ILE MD 2.658 2.020 3.296 3.334 3.321 3.357 0.061 8 0 "[ . 1]" 1
2464 1 47 ILE MD 2 46 ALA MB 2.658 2.020 3.296 3.334 3.314 3.355 0.059 8 0 "[ . 1]" 1
2465 1 43 ILE MG 2 25 LYS HA 6.935 3.788 10.082 5.421 5.361 5.507 . 0 0 "[ . 1]" 1
2466 1 25 LYS HA 2 43 ILE MG 6.935 3.788 10.082 5.420 5.362 5.506 . 0 0 "[ . 1]" 1
2467 1 20 MET ME 2 18 ILE MD 1.836 . 6.000 4.652 4.605 4.722 . 0 0 "[ . 1]" 1
2468 1 18 ILE MD 2 20 MET ME 1.836 . 6.000 4.651 4.602 4.717 . 0 0 "[ . 1]" 1
2469 1 43 ILE MD 2 16 PHE QE 1.752 . 2.196 2.014 1.953 2.045 . 0 0 "[ . 1]" 1
2470 1 16 PHE QE 2 43 ILE MD 1.752 . 2.196 2.016 1.948 2.050 . 0 0 "[ . 1]" 1
2471 1 47 ILE MD 2 20 MET HB3 3.876 3.034 4.718 4.371 4.318 4.439 . 0 0 "[ . 1]" 1
2472 1 20 MET HB3 2 47 ILE MD 3.876 3.034 4.718 4.372 4.314 4.444 . 0 0 "[ . 1]" 1
2473 1 43 ILE MD 2 20 MET ME 2.911 . 6.000 5.590 5.377 5.667 . 0 0 "[ . 1]" 1
2474 1 20 MET ME 2 43 ILE MD 2.911 . 6.000 5.590 5.386 5.672 . 0 0 "[ . 1]" 1
2475 1 47 ILE MD 2 24 LEU QD 1.645 . 2.122 2.100 2.003 2.166 0.044 8 0 "[ . 1]" 1
2476 1 24 LEU QD 2 47 ILE MD 1.645 . 2.122 2.100 2.003 2.166 0.044 8 0 "[ . 1]" 1
2477 1 25 LYS HA 2 51 LEU MD2 5.098 3.654 6.542 4.232 4.186 4.288 . 0 0 "[ . 1]" 1
2478 1 18 ILE MD 2 44 GLU HA 5.098 3.654 6.542 4.231 4.188 4.288 . 0 0 "[ . 1]" 1
2479 1 46 ALA MB 2 46 ALA H 4.521 3.711 5.331 4.238 4.210 4.257 . 0 0 "[ . 1]" 1
2480 1 46 ALA H 2 46 ALA MB 4.521 3.711 5.331 4.236 4.208 4.250 . 0 0 "[ . 1]" 1
2481 1 51 LEU MD1 2 24 LEU HB2 4.577 . 6.000 5.878 5.725 6.055 0.055 2 0 "[ . 1]" 1
2482 1 24 LEU HB2 2 51 LEU MD1 4.577 . 6.000 5.879 5.724 6.056 0.056 2 0 "[ . 1]" 1
2483 1 16 PHE QE 2 25 LYS HD3 5.053 4.061 6.045 4.434 4.372 4.497 . 0 0 "[ . 1]" 1
2484 1 25 LYS HD3 2 16 PHE QE 5.053 4.061 6.045 4.433 4.378 4.492 . 0 0 "[ . 1]" 1
2485 1 31 TYR QE 2 55 ASN HB2 5.854 4.413 7.295 4.880 4.638 4.979 . 0 0 "[ . 1]" 1
2486 1 55 ASN HB2 2 31 TYR QE 5.854 4.413 7.295 4.876 4.644 4.975 . 0 0 "[ . 1]" 1
2487 1 31 TYR QD 2 56 GLY HA2 3.695 3.309 4.081 3.350 3.235 3.561 0.074 10 0 "[ . 1]" 1
2488 1 56 GLY HA2 2 31 TYR QD 3.695 3.309 4.081 3.347 3.220 3.588 0.089 7 0 "[ . 1]" 1
2489 1 31 TYR HA 1 31 TYR QD 2.484 2.216 2.752 2.597 2.413 2.695 . 0 0 "[ . 1]" 1
2490 2 31 TYR HA 2 31 TYR QD 2.484 2.216 2.752 2.595 2.415 2.696 . 0 0 "[ . 1]" 1
2491 1 31 TYR QD 1 32 CYS HA 2.963 2.583 3.343 3.227 3.164 3.311 . 0 0 "[ . 1]" 1
2492 2 31 TYR QD 2 32 CYS HA 2.963 2.583 3.343 3.225 3.159 3.309 . 0 0 "[ . 1]" 1
2493 1 31 TYR QD 2 55 ASN HB2 2.704 . 6.000 4.480 4.273 4.742 . 0 0 "[ . 1]" 1
2494 1 55 ASN HB2 2 31 TYR QD 2.704 . 6.000 4.477 4.278 4.766 . 0 0 "[ . 1]" 1
2495 1 16 PHE QR 1 18 ILE HA 3.572 3.176 3.968 3.677 3.623 3.747 . 0 0 "[ . 1]" 1
2496 1 39 LEU HA 2 16 PHE QR 3.572 3.176 3.968 3.677 3.629 3.752 . 0 0 "[ . 1]" 1
2497 1 16 PHE QR 2 25 LYS HA 4.072 . 6.000 5.061 4.962 5.115 . 0 0 "[ . 1]" 1
2498 1 25 LYS HA 2 16 PHE QR 4.072 . 6.000 5.059 4.960 5.113 . 0 0 "[ . 1]" 1
2499 1 14 ALA MB 1 16 PHE QR 3.258 2.914 3.602 3.628 3.590 3.648 0.046 6 0 "[ . 1]" 1
2500 1 25 LYS HD3 2 16 PHE QR 3.258 2.914 3.602 3.626 3.596 3.653 0.051 6 0 "[ . 1]" 1
2501 1 15 VAL HA 1 16 PHE QR 4.806 4.304 5.308 5.134 5.087 5.165 . 0 0 "[ . 1]" 1
2502 1 38 GLN HA 2 16 PHE QR 4.806 4.304 5.308 5.134 5.088 5.166 . 0 0 "[ . 1]" 1
2503 1 15 VAL HB 1 16 PHE QR 2.812 . 6.000 3.732 3.384 3.841 . 0 0 "[ . 1]" 1
2504 1 20 MET ME 2 16 PHE QR 2.812 . 6.000 3.731 3.379 3.837 . 0 0 "[ . 1]" 1
2505 1 16 PHE QR 1 18 ILE HB 2.904 . 6.000 3.934 3.885 3.975 . 0 0 "[ . 1]" 1
2506 1 29 LYS QG 2 16 PHE QR 2.904 . 6.000 3.934 3.886 3.975 . 0 0 "[ . 1]" 1
2507 1 16 PHE QR 1 18 ILE HG12 2.423 2.115 2.731 2.797 2.767 2.820 0.089 9 0 "[ . 1]" 1
2508 1 25 LYS HG2 2 16 PHE QR 2.423 2.115 2.731 2.798 2.769 2.824 0.093 9 0 "[ . 1]" 1
2509 1 16 PHE QR 2 39 LEU MD2 2.603 2.273 2.933 3.021 2.998 3.038 0.105 10 0 "[ . 1]" 1
2510 1 39 LEU MD2 2 16 PHE QR 2.603 2.273 2.933 3.019 3.003 3.037 0.104 3 0 "[ . 1]" 1
2511 1 19 TYR QD 2 13 LYS QD 3.370 3.041 3.699 3.352 2.968 3.550 0.073 3 0 "[ . 1]" 1
2512 1 13 LYS QD 2 19 TYR QD 3.370 3.041 3.699 3.351 2.962 3.545 0.079 3 0 "[ . 1]" 1
2513 1 19 TYR QD 2 14 ALA MB 3.649 . 6.000 4.388 4.187 4.807 . 0 0 "[ . 1]" 1
2514 1 14 ALA MB 2 19 TYR QD 3.649 . 6.000 4.387 4.186 4.807 . 0 0 "[ . 1]" 1
2515 1 31 TYR HA 1 31 TYR QE 4.337 3.909 4.765 4.180 4.123 4.281 . 0 0 "[ . 1]" 1
2516 2 31 TYR HA 2 31 TYR QE 4.337 3.909 4.765 4.180 4.122 4.283 . 0 0 "[ . 1]" 1
2517 1 31 TYR QE 2 54 ARG HD2 5.521 . 6.000 4.803 4.709 4.945 . 0 0 "[ . 1]" 1
2518 1 54 ARG HD2 2 31 TYR QE 5.521 . 6.000 4.803 4.710 4.938 . 0 0 "[ . 1]" 1
2519 1 31 TYR QE 1 45 GLU QB 3.980 . 6.000 3.559 3.488 3.771 . 0 0 "[ . 1]" 1
2520 1 54 ARG HB2 2 31 TYR QE 3.980 . 6.000 3.560 3.488 3.774 . 0 0 "[ . 1]" 1
2521 1 31 TYR QE 1 37 LEU HB3 3.601 3.226 3.976 3.919 3.801 4.013 0.037 7 0 "[ . 1]" 1
2522 1 54 ARG HD3 2 31 TYR QE 3.601 3.226 3.976 3.920 3.802 4.015 0.039 7 0 "[ . 1]" 1
2523 1 31 TYR QE 1 42 ALA MB 2.631 . 6.000 3.067 2.804 3.276 . 0 0 "[ . 1]" 1
2524 2 31 TYR QE 2 42 ALA MB 2.631 . 6.000 3.068 2.805 3.276 . 0 0 "[ . 1]" 1
2525 1 28 LEU MD2 1 31 TYR QE 2.519 . 6.000 3.339 3.225 3.452 . 0 0 "[ . 1]" 1
2526 2 28 LEU MD2 2 31 TYR QE 2.519 . 6.000 3.340 3.230 3.452 . 0 0 "[ . 1]" 1
2527 1 31 TYR QE 2 54 ARG HB3 3.171 2.805 3.537 3.446 3.354 3.553 0.016 2 0 "[ . 1]" 1
2528 1 18 ILE MD 2 41 GLN H 3.171 2.805 3.537 3.444 3.350 3.550 0.013 6 0 "[ . 1]" 1
2529 1 18 ILE HB 1 19 TYR QE 3.708 . 6.000 4.863 4.249 5.144 . 0 0 "[ . 1]" 1
2530 1 13 LYS QD 2 19 TYR QE 3.708 . 6.000 4.862 4.252 5.140 . 0 0 "[ . 1]" 1
2531 1 50 TYR QD 1 51 LEU HG 2.754 . 6.000 4.615 4.465 4.734 . 0 0 "[ . 1]" 1
2532 2 50 TYR QD 2 51 LEU HG 2.754 . 6.000 4.614 4.470 4.734 . 0 0 "[ . 1]" 1
2533 1 50 TYR QD 2 28 LEU MD2 1.621 . 6.000 2.168 2.094 2.217 . 0 0 "[ . 1]" 1
2534 1 28 LEU MD2 2 50 TYR QD 1.621 . 6.000 2.169 2.104 2.218 . 0 0 "[ . 1]" 1
2535 1 47 ILE MG 1 50 TYR QD 2.536 . 6.000 4.282 4.208 4.361 . 0 0 "[ . 1]" 1
2536 1 28 LEU MD1 2 50 TYR QD 2.536 . 6.000 4.283 4.215 4.358 . 0 0 "[ . 1]" 1
2537 1 47 ILE HA 1 50 TYR QD 2.664 . 6.000 3.126 3.050 3.186 . 0 0 "[ . 1]" 1
2538 2 47 ILE HA 2 50 TYR QD 2.664 . 6.000 3.125 3.050 3.185 . 0 0 "[ . 1]" 1
2539 1 50 TYR QE 2 37 LEU HB2 4.386 . 6.000 5.899 5.716 6.029 0.029 6 0 "[ . 1]" 1
2540 1 37 LEU HB2 2 50 TYR QE 4.386 . 6.000 5.900 5.719 6.036 0.036 6 0 "[ . 1]" 1
2541 1 13 LYS QB 1 14 ALA HA 3.426 . 6.000 4.130 4.021 4.305 . 0 0 "[ . 1]" 1
2542 1 22 LYS QD 2 14 ALA HA 3.426 . 6.000 4.131 4.022 4.302 . 0 0 "[ . 1]" 1
2543 1 13 LYS QD 1 14 ALA HA 2.934 . 6.000 4.709 3.384 5.002 . 0 0 "[ . 1]" 1
2544 1 22 LYS QG 2 14 ALA HA 2.934 . 6.000 4.706 3.375 5.005 . 0 0 "[ . 1]" 1
2545 1 23 ASP HA 1 24 LEU HA 3.289 . 6.000 4.148 4.054 4.247 . 0 0 "[ . 1]" 1
2546 2 23 ASP HA 2 24 LEU HA 3.289 . 6.000 4.148 4.054 4.246 . 0 0 "[ . 1]" 1
2547 1 23 ASP HA 1 23 ASP HB2 2.212 2.002 2.422 2.106 2.072 2.115 . 0 0 "[ . 1]" 1
2548 2 23 ASP HA 2 23 ASP HB2 2.212 2.002 2.422 2.106 2.073 2.118 . 0 0 "[ . 1]" 1
2549 1 15 VAL HA 2 20 MET HB3 3.998 3.649 4.347 3.999 3.974 4.030 . 0 0 "[ . 1]" 1
2550 1 20 MET HB3 2 15 VAL HA 3.998 3.649 4.347 3.999 3.971 4.034 . 0 0 "[ . 1]" 1
2551 1 15 VAL HA 2 25 LYS HD2 3.686 3.384 3.988 3.417 3.269 3.549 0.115 4 0 "[ . 1]" 1
2552 1 13 LYS QB 2 21 ASP HA 3.686 3.384 3.988 3.417 3.278 3.549 0.106 4 0 "[ . 1]" 1
2553 1 15 VAL HA 2 18 ILE HB 3.099 . 6.000 3.966 3.935 3.993 . 0 0 "[ . 1]" 1
2554 1 13 LYS QD 2 21 ASP HA 3.099 . 6.000 3.967 3.936 3.994 . 0 0 "[ . 1]" 1
2555 1 14 ALA MB 1 15 VAL HA 2.593 2.326 2.860 2.949 2.898 3.004 0.144 4 0 "[ . 1]" 1
2556 1 14 ALA MB 2 21 ASP HA 2.593 2.326 2.860 2.949 2.893 3.007 0.147 4 0 "[ . 1]" 1
2557 1 51 LEU MD2 1 56 GLY HA2 3.589 . 6.000 4.035 3.785 4.377 . 0 0 "[ . 1]" 1
2558 2 51 LEU MD2 2 56 GLY HA2 3.589 . 6.000 4.036 3.781 4.383 . 0 0 "[ . 1]" 1
2559 1 33 ALA MB 1 36 ASN HA 4.217 3.734 4.700 4.337 4.306 4.398 . 0 0 "[ . 1]" 1
2560 2 33 ALA MB 2 36 ASN HA 4.217 3.734 4.700 4.337 4.305 4.398 . 0 0 "[ . 1]" 1
2561 1 22 LYS QD 1 26 THR HB 3.749 3.437 4.061 3.655 3.516 3.907 . 0 0 "[ . 1]" 1
2562 1 27 ARG HG3 2 56 GLY HA2 3.749 3.437 4.061 3.655 3.496 3.912 . 0 0 "[ . 1]" 1
2563 1 29 LYS QG 1 39 LEU HA 3.416 . 6.000 4.539 4.456 4.624 . 0 0 "[ . 1]" 1
2564 1 28 LEU HA 1 28 LEU MD2 1.598 . 1.911 1.852 1.824 1.886 . 0 0 "[ . 1]" 1
2565 2 28 LEU HA 2 28 LEU MD2 1.598 . 1.911 1.851 1.828 1.883 . 0 0 "[ . 1]" 1
2566 1 11 LYS HA 1 11 LYS QD 2.805 . 6.000 2.395 1.899 2.621 . 0 0 "[ . 1]" 1
2567 2 11 LYS HA 2 11 LYS QD 2.805 . 6.000 2.395 1.895 2.620 . 0 0 "[ . 1]" 1
2568 1 28 LEU HA 1 28 LEU MD1 1.912 . 6.000 2.667 2.608 2.713 . 0 0 "[ . 1]" 1
2569 2 28 LEU HA 2 28 LEU MD1 1.912 . 6.000 2.667 2.610 2.713 . 0 0 "[ . 1]" 1
2570 1 28 LEU HA 1 31 TYR HB2 2.852 2.492 3.212 2.733 2.643 2.811 . 0 0 "[ . 1]" 1
2571 2 28 LEU HA 2 31 TYR HB2 2.852 2.492 3.212 2.733 2.645 2.811 . 0 0 "[ . 1]" 1
2572 1 18 ILE HA 1 18 ILE MG 1.586 . 6.000 2.040 2.021 2.056 . 0 0 "[ . 1]" 1
2573 1 51 LEU MD2 2 28 LEU HA 1.586 . 6.000 2.040 2.025 2.055 . 0 0 "[ . 1]" 1
2574 1 47 ILE HA 1 50 TYR HA 4.102 3.683 4.521 4.165 4.143 4.191 . 0 0 "[ . 1]" 1
2575 2 47 ILE HA 2 50 TYR HA 4.102 3.683 4.521 4.165 4.143 4.191 . 0 0 "[ . 1]" 1
2576 1 49 GLU QB 1 50 TYR HA 2.645 2.371 2.919 2.640 2.609 2.667 . 0 0 "[ . 1]" 1
2577 2 49 GLU QB 2 50 TYR HA 2.645 2.371 2.919 2.640 2.610 2.660 . 0 0 "[ . 1]" 1
2578 1 50 TYR HA 1 53 LYS HA 3.834 3.452 4.216 4.329 4.309 4.353 0.137 2 0 "[ . 1]" 1
2579 2 50 TYR HA 2 53 LYS HA 3.834 3.452 4.216 4.329 4.309 4.353 0.137 2 0 "[ . 1]" 1
2580 1 40 THR HB 2 18 ILE HB 3.343 3.038 3.648 3.227 3.029 3.349 0.009 5 0 "[ . 1]" 1
2581 1 18 ILE HB 2 40 THR HB 3.343 3.038 3.648 3.227 3.035 3.353 0.003 5 0 "[ . 1]" 1
2582 1 40 THR HB 2 18 ILE MD 2.633 2.365 2.901 2.897 2.878 2.916 0.015 2 0 "[ . 1]" 1
2583 1 18 ILE MD 2 40 THR HB 2.633 2.365 2.901 2.898 2.878 2.918 0.017 2 0 "[ . 1]" 1
2584 1 25 LYS HA 1 27 ARG HB3 4.355 3.809 4.901 3.999 3.949 4.045 . 0 0 "[ . 1]" 1
2585 1 20 MET HB3 2 44 GLU HA 4.355 3.809 4.901 4.000 3.955 4.048 . 0 0 "[ . 1]" 1
2586 1 29 LYS HA 1 31 TYR HA 4.121 3.625 4.617 4.626 4.611 4.642 0.025 8 0 "[ . 1]" 1
2587 2 29 LYS HA 2 31 TYR HA 4.121 3.625 4.617 4.625 4.611 4.640 0.023 8 0 "[ . 1]" 1
2588 1 30 VAL MG2 1 31 TYR HA 3.618 3.165 4.071 3.905 3.851 3.972 . 0 0 "[ . 1]" 1
2589 2 30 VAL MG2 2 31 TYR HA 3.618 3.165 4.071 3.906 3.849 3.971 . 0 0 "[ . 1]" 1
2590 1 31 TYR HA 2 51 LEU MD1 3.160 . 6.000 4.170 4.112 4.230 . 0 0 "[ . 1]" 1
2591 1 51 LEU MD1 2 31 TYR HA 3.160 . 6.000 4.169 4.118 4.224 . 0 0 "[ . 1]" 1
2592 1 24 LEU HA 1 25 LYS QB 3.587 3.218 3.956 3.899 3.786 3.993 0.037 5 0 "[ . 1]" 1
2593 2 24 LEU HA 2 25 LYS QB 3.587 3.218 3.956 3.899 3.788 3.994 0.038 5 0 "[ . 1]" 1
2594 1 24 LEU HA 1 24 LEU HB2 2.022 . 2.201 2.025 1.999 2.063 . 0 0 "[ . 1]" 1
2595 2 24 LEU HA 2 24 LEU HB2 2.022 . 2.201 2.025 2.001 2.062 . 0 0 "[ . 1]" 1
2596 1 20 MET ME 1 24 LEU HA 3.183 2.938 3.428 3.523 3.450 3.573 0.145 2 0 "[ . 1]" 1
2597 1 48 LYS QD 2 24 LEU HA 3.183 2.938 3.428 3.522 3.448 3.573 0.145 2 0 "[ . 1]" 1
2598 1 34 LYS HA 1 34 LYS HG2 2.416 2.173 2.659 2.432 2.393 2.518 . 0 0 "[ . 1]" 1
2599 2 34 LYS HA 2 34 LYS HG2 2.416 2.173 2.659 2.431 2.387 2.516 . 0 0 "[ . 1]" 1
2600 1 24 LEU HA 2 51 LEU MD2 3.967 3.380 4.554 3.946 3.876 4.102 . 0 0 "[ . 1]" 1
2601 1 51 LEU MD2 2 24 LEU HA 3.967 3.380 4.554 3.945 3.870 4.095 . 0 0 "[ . 1]" 1
2602 1 24 LEU HA 2 48 LYS QE 3.548 3.250 3.846 3.366 3.166 3.603 0.084 3 0 "[ . 1]" 1
2603 1 48 LYS QE 2 24 LEU HA 3.548 3.250 3.846 3.364 3.171 3.601 0.079 3 0 "[ . 1]" 1
2604 1 24 LEU HA 1 27 ARG HB3 2.190 . 2.431 2.254 2.183 2.301 . 0 0 "[ . 1]" 1
2605 2 24 LEU HA 2 27 ARG HB3 2.190 . 2.431 2.254 2.181 2.299 . 0 0 "[ . 1]" 1
2606 1 24 LEU HA 2 47 ILE MG 2.995 . 6.000 4.657 4.573 4.734 . 0 0 "[ . 1]" 1
2607 1 47 ILE MG 2 24 LEU HA 2.995 . 6.000 4.656 4.573 4.737 . 0 0 "[ . 1]" 1
2608 1 30 VAL MG1 1 31 TYR HA 2.241 . 6.000 2.788 2.520 2.943 . 0 0 "[ . 1]" 1
2609 2 30 VAL MG1 2 31 TYR HA 2.241 . 6.000 2.787 2.522 2.935 . 0 0 "[ . 1]" 1
2610 1 48 LYS QE 1 49 GLU HA 4.055 3.636 4.474 4.049 3.626 4.401 0.010 5 0 "[ . 1]" 1
2611 1 53 LYS QE 2 49 GLU HA 4.055 3.636 4.474 4.047 3.628 4.393 0.008 5 0 "[ . 1]" 1
2612 1 24 LEU HA 1 27 ARG HG2 3.297 3.002 3.592 3.392 3.344 3.452 . 0 0 "[ . 1]" 1
2613 2 24 LEU HA 2 27 ARG HG2 3.297 3.002 3.592 3.392 3.346 3.450 . 0 0 "[ . 1]" 1
2614 1 20 MET ME 1 24 LEU HA 3.094 2.800 3.388 3.105 3.050 3.214 . 0 0 "[ . 1]" 1
2615 1 48 LYS QD 2 24 LEU HA 3.094 2.800 3.388 3.105 3.049 3.215 . 0 0 "[ . 1]" 1
2616 1 27 ARG HA 2 51 LEU MD2 3.468 . 6.000 4.421 4.385 4.459 . 0 0 "[ . 1]" 1
2617 1 51 LEU MD2 2 27 ARG HA 3.468 . 6.000 4.420 4.384 4.460 . 0 0 "[ . 1]" 1
2618 1 29 LYS HA 1 29 LYS QD 3.059 2.783 3.335 3.033 2.990 3.122 . 0 0 "[ . 1]" 1
2619 2 29 LYS HA 2 29 LYS QD 3.059 2.783 3.335 3.034 2.990 3.123 . 0 0 "[ . 1]" 1
2620 1 28 LEU HB2 1 29 LYS HA 3.123 . 6.000 5.585 5.568 5.598 . 0 0 "[ . 1]" 1
2621 2 28 LEU HB2 2 29 LYS HA 3.123 . 6.000 5.585 5.574 5.597 . 0 0 "[ . 1]" 1
2622 1 29 LYS HA 1 32 CYS HB2 2.313 2.068 2.558 2.526 2.513 2.550 . 0 0 "[ . 1]" 1
2623 2 29 LYS HA 2 32 CYS HB2 2.313 2.068 2.558 2.526 2.513 2.550 . 0 0 "[ . 1]" 1
2624 1 29 LYS HA 1 29 LYS QG 2.319 2.071 2.567 2.367 2.326 2.412 . 0 0 "[ . 1]" 1
2625 2 29 LYS HA 2 29 LYS QG 2.319 2.071 2.567 2.366 2.325 2.410 . 0 0 "[ . 1]" 1
2626 1 46 ALA HA 1 47 ILE HA 3.614 3.163 4.065 3.624 3.568 3.682 . 0 0 "[ . 1]" 1
2627 1 47 ILE HA 2 46 ALA HA 3.614 3.163 4.065 3.625 3.576 3.679 . 0 0 "[ . 1]" 1
2628 1 45 GLU QB 1 46 ALA HA 2.926 2.597 3.255 3.192 3.078 3.283 0.028 3 0 "[ . 1]" 1
2629 2 45 GLU QB 2 46 ALA HA 2.926 2.597 3.255 3.191 3.075 3.286 0.031 3 0 "[ . 1]" 1
2630 1 22 LYS HA 1 25 LYS HA 3.647 . 6.000 4.427 4.394 4.456 . 0 0 "[ . 1]" 1
2631 2 22 LYS HA 2 25 LYS HA 3.647 . 6.000 4.426 4.394 4.459 . 0 0 "[ . 1]" 1
2632 1 20 MET ME 1 22 LYS HA 3.437 3.112 3.762 3.355 3.320 3.408 . 0 0 "[ . 1]" 1
2633 1 53 LYS QD 2 46 ALA HA 3.437 3.112 3.762 3.356 3.322 3.406 . 0 0 "[ . 1]" 1
2634 1 22 LYS HA 1 22 LYS QG 2.545 2.260 2.830 2.457 2.417 2.507 . 0 0 "[ . 1]" 1
2635 1 18 ILE HB 2 40 THR HA 2.545 2.260 2.830 2.456 2.421 2.506 . 0 0 "[ . 1]" 1
2636 1 22 LYS HA 1 25 LYS QB 2.869 2.526 3.212 2.870 2.782 3.006 . 0 0 "[ . 1]" 1
2637 2 22 LYS HA 2 25 LYS QB 2.869 2.526 3.212 2.869 2.783 3.007 . 0 0 "[ . 1]" 1
2638 1 26 THR HA 1 39 LEU MD2 3.981 3.471 4.491 4.397 4.338 4.474 . 0 0 "[ . 1]" 1
2639 2 26 THR HA 2 39 LEU MD2 3.981 3.471 4.491 4.398 4.341 4.476 . 0 0 "[ . 1]" 1
2640 1 40 THR HA 1 43 ILE MD 2.049 . 6.000 3.077 3.032 3.105 . 0 0 "[ . 1]" 1
2641 2 40 THR HA 2 43 ILE MD 2.049 . 6.000 3.079 3.028 3.106 . 0 0 "[ . 1]" 1
2642 1 22 LYS HA 1 24 LEU QD 3.291 2.785 3.797 3.703 3.661 3.751 . 0 0 "[ . 1]" 1
2643 1 18 ILE HG13 2 40 THR HA 3.291 2.785 3.797 3.703 3.659 3.754 . 0 0 "[ . 1]" 1
2644 1 26 THR HA 1 27 ARG HB2 3.933 . 6.000 5.426 5.384 5.479 . 0 0 "[ . 1]" 1
2645 2 26 THR HA 2 27 ARG HB2 3.933 . 6.000 5.427 5.384 5.480 . 0 0 "[ . 1]" 1
2646 1 25 LYS HG2 1 26 THR HA 3.732 3.238 4.226 3.866 3.783 4.007 . 0 0 "[ . 1]" 1
2647 1 18 ILE HG12 2 40 THR HA 3.732 3.238 4.226 3.866 3.779 4.008 . 0 0 "[ . 1]" 1
2648 1 30 VAL HA 2 51 LEU MD1 3.818 . 6.000 5.191 5.074 5.280 . 0 0 "[ . 1]" 1
2649 1 51 LEU MD1 2 30 VAL HA 3.818 . 6.000 5.189 5.077 5.282 . 0 0 "[ . 1]" 1
2650 1 30 VAL HA 1 34 LYS QB 3.032 2.623 3.441 3.276 3.123 3.404 . 0 0 "[ . 1]" 1
2651 2 30 VAL HA 2 34 LYS QB 3.032 2.623 3.441 3.274 3.122 3.404 . 0 0 "[ . 1]" 1
2652 1 29 LYS QD 1 30 VAL HA 2.452 2.153 2.751 2.243 2.173 2.283 . 0 0 "[ . 1]" 1
2653 2 29 LYS QD 2 30 VAL HA 2.452 2.153 2.751 2.242 2.174 2.282 . 0 0 "[ . 1]" 1
2654 1 20 MET ME 1 25 LYS HA 1.836 . 6.000 2.313 2.263 2.507 . 0 0 "[ . 1]" 1
2655 1 20 MET ME 2 44 GLU HA 1.836 . 6.000 2.314 2.266 2.514 . 0 0 "[ . 1]" 1
2656 1 43 ILE MG 1 47 ILE HA 2.787 . 6.000 4.385 4.332 4.435 . 0 0 "[ . 1]" 1
2657 1 43 ILE MD 2 47 ILE HA 2.787 . 6.000 4.386 4.332 4.439 . 0 0 "[ . 1]" 1
2658 1 47 ILE HA 1 51 LEU MD2 2.333 . 6.000 3.141 3.104 3.168 . 0 0 "[ . 1]" 1
2659 2 47 ILE HA 2 51 LEU MD2 2.333 . 6.000 3.141 3.105 3.169 . 0 0 "[ . 1]" 1
2660 1 47 ILE HA 1 47 ILE HG12 3.083 2.714 3.452 3.014 2.823 3.119 . 0 0 "[ . 1]" 1
2661 1 28 LEU HG 2 47 ILE HA 3.083 2.714 3.452 3.012 2.820 3.113 . 0 0 "[ . 1]" 1
2662 1 47 ILE HA 1 47 ILE MD 2.280 . 2.580 2.713 2.667 2.775 0.195 5 0 "[ . 1]" 1
2663 2 47 ILE HA 2 47 ILE MD 2.280 . 2.580 2.712 2.669 2.774 0.194 5 0 "[ . 1]" 1
2664 1 32 CYS HB2 1 33 ALA MB 3.834 3.404 4.264 3.891 3.803 3.938 . 0 0 "[ . 1]" 1
2665 2 32 CYS HB2 2 33 ALA MB 3.834 3.404 4.264 3.892 3.803 3.943 . 0 0 "[ . 1]" 1
2666 1 28 LEU MD2 1 31 TYR HB2 2.660 2.231 3.089 2.953 2.886 3.027 . 0 0 "[ . 1]" 1
2667 2 28 LEU MD2 2 31 TYR HB2 2.660 2.231 3.089 2.953 2.886 3.031 . 0 0 "[ . 1]" 1
2668 1 30 VAL MG1 1 31 TYR HB2 3.706 3.115 4.297 4.401 4.367 4.418 0.121 5 0 "[ . 1]" 1
2669 2 30 VAL MG1 2 31 TYR HB2 3.706 3.115 4.297 4.400 4.363 4.417 0.120 1 0 "[ . 1]" 1
2670 1 27 ARG QD 2 48 LYS QE 2.698 . 6.000 5.316 5.212 5.564 . 0 0 "[ . 1]" 1
2671 1 48 LYS QE 2 27 ARG QD 2.698 . 6.000 5.315 5.222 5.565 . 0 0 "[ . 1]" 1
2672 1 27 ARG QD 2 51 LEU MD2 3.014 2.599 3.429 3.379 3.215 3.481 0.052 4 0 "[ . 1]" 1
2673 1 51 LEU MD2 2 27 ARG QD 3.014 2.599 3.429 3.379 3.219 3.484 0.055 4 0 "[ . 1]" 1
2674 1 17 GLY HA2 1 18 ILE MG 3.440 2.942 3.938 3.336 3.186 3.447 . 0 0 "[ . 1]" 1
2675 1 51 LEU MD2 2 27 ARG QD 3.440 2.942 3.938 3.336 3.189 3.443 . 0 0 "[ . 1]" 1
2676 1 28 LEU MD1 1 31 TYR HB3 2.080 . 6.000 3.139 3.063 3.221 . 0 0 "[ . 1]" 1
2677 2 28 LEU MD1 2 31 TYR HB3 2.080 . 6.000 3.140 3.062 3.223 . 0 0 "[ . 1]" 1
2678 1 28 LEU MD1 1 31 TYR HB3 1.724 . 6.000 2.386 2.374 2.395 . 0 0 "[ . 1]" 1
2679 2 28 LEU MD1 2 31 TYR HB3 1.724 . 6.000 2.387 2.373 2.398 . 0 0 "[ . 1]" 1
2680 1 43 ILE HA 1 43 ILE MD 2.074 . 2.453 2.289 2.278 2.296 . 0 0 "[ . 1]" 1
2681 2 43 ILE HA 2 43 ILE MD 2.074 . 2.453 2.289 2.275 2.298 . 0 0 "[ . 1]" 1
2682 1 31 TYR HB3 2 51 LEU MD2 2.063 . 6.000 3.094 3.044 3.172 . 0 0 "[ . 1]" 1
2683 1 47 ILE MD 2 43 ILE HA 2.063 . 6.000 3.094 3.046 3.171 . 0 0 "[ . 1]" 1
2684 1 28 LEU MD2 1 31 TYR HB3 1.495 . 1.719 1.762 1.741 1.779 0.060 1 0 "[ . 1]" 1
2685 2 28 LEU MD2 2 31 TYR HB3 1.495 . 1.719 1.762 1.739 1.778 0.059 1 0 "[ . 1]" 1
2686 1 16 PHE HB2 1 18 ILE MD 3.380 . 6.000 4.029 3.910 4.156 . 0 0 "[ . 1]" 1
2687 1 18 ILE MD 2 16 PHE HB2 3.380 . 6.000 4.029 3.916 4.160 . 0 0 "[ . 1]" 1
2688 1 29 LYS QE 1 33 ALA MB 2.567 . 6.000 2.142 2.059 2.365 . 0 0 "[ . 1]" 1
2689 2 29 LYS QE 2 33 ALA MB 2.567 . 6.000 2.142 2.062 2.366 . 0 0 "[ . 1]" 1
2690 1 29 LYS QE 1 30 VAL MG1 3.051 . 6.000 4.020 3.636 4.381 . 0 0 "[ . 1]" 1
2691 2 29 LYS QE 2 30 VAL MG1 3.051 . 6.000 4.018 3.637 4.382 . 0 0 "[ . 1]" 1
2692 1 48 LYS QE 2 27 ARG HB2 3.835 . 6.000 2.656 1.677 3.605 . 0 0 "[ . 1]" 1
2693 1 27 ARG HB2 2 48 LYS QE 3.835 . 6.000 2.660 1.668 3.605 . 0 0 "[ . 1]" 1
2694 1 29 LYS QD 1 29 LYS QE 1.939 . 2.129 1.699 1.670 1.732 0.079 3 0 "[ . 1]" 1
2695 2 29 LYS QD 2 29 LYS QE 1.939 . 2.129 1.699 1.671 1.732 0.078 3 0 "[ . 1]" 1
2696 1 48 LYS HB3 1 48 LYS QE 2.845 . 6.000 3.417 3.375 3.490 . 0 0 "[ . 1]" 1
2697 1 27 ARG HG2 2 48 LYS QE 2.845 . 6.000 3.418 3.384 3.492 . 0 0 "[ . 1]" 1
2698 1 53 LYS HB2 1 53 LYS QE 2.999 2.712 3.286 3.175 2.815 3.430 0.144 8 0 "[ . 1]" 1
2699 1 53 LYS HB2 2 53 LYS QE 2.999 2.712 3.286 3.174 2.812 3.435 0.149 8 0 "[ . 1]" 1
2700 1 16 PHE HB3 1 40 THR MG 2.507 . 6.000 5.328 5.282 5.423 . 0 0 "[ . 1]" 1
2701 1 40 THR MG 2 16 PHE HB3 2.507 . 6.000 5.327 5.275 5.430 . 0 0 "[ . 1]" 1
2702 1 11 LYS QG 1 13 LYS QE 3.098 . 6.000 4.578 4.322 4.836 . 0 0 "[ . 1]" 1
2703 1 25 LYS HD3 2 16 PHE HB3 3.098 . 6.000 4.575 4.323 4.836 . 0 0 "[ . 1]" 1
2704 1 20 MET HG3 1 21 ASP HB2 5.472 4.606 6.338 4.953 4.554 5.137 0.052 8 0 "[ . 1]" 1
2705 2 20 MET HG3 2 21 ASP HB2 5.472 4.606 6.338 4.950 4.554 5.135 0.052 8 0 "[ . 1]" 1
2706 1 21 ASP HB2 1 24 LEU HB2 3.943 . 6.000 3.307 3.059 3.512 . 0 0 "[ . 1]" 1
2707 2 21 ASP HB2 2 24 LEU HB2 3.943 . 6.000 3.307 3.058 3.509 . 0 0 "[ . 1]" 1
2708 1 19 TYR HB3 2 14 ALA MB 4.429 3.973 4.885 4.198 4.142 4.252 . 0 0 "[ . 1]" 1
2709 1 14 ALA MB 2 19 TYR HB3 4.429 3.973 4.885 4.199 4.144 4.250 . 0 0 "[ . 1]" 1
2710 1 25 LYS HE2 1 39 LEU MD2 3.802 3.072 4.532 4.563 4.482 4.602 0.070 9 0 "[ . 1]" 1
2711 2 25 LYS HE2 2 39 LEU MD2 3.802 3.072 4.532 4.562 4.482 4.603 0.071 9 0 "[ . 1]" 1
2712 1 21 ASP HB3 1 22 LYS QB 3.888 3.526 4.250 3.512 3.436 3.649 0.090 1 0 "[ . 1]" 1
2713 2 21 ASP HB3 2 22 LYS QB 3.888 3.526 4.250 3.510 3.436 3.646 0.090 1 0 "[ . 1]" 1
2714 1 21 ASP HB3 1 24 LEU HB3 2.779 2.431 3.127 2.434 2.347 2.793 0.084 1 0 "[ . 1]" 1
2715 1 20 MET ME 2 44 GLU HG2 2.779 2.431 3.127 2.433 2.355 2.793 0.076 1 0 "[ . 1]" 1
2716 1 21 ASP HB3 1 24 LEU HB3 3.302 2.987 3.617 3.043 2.949 3.216 0.038 3 0 "[ . 1]" 1
2717 1 24 LEU HG 2 44 GLU HG2 3.302 2.987 3.617 3.038 2.952 3.200 0.035 3 0 "[ . 1]" 1
2718 1 20 MET HG2 2 14 ALA MB 2.915 2.571 3.259 2.898 2.883 2.934 . 0 0 "[ . 1]" 1
2719 1 14 ALA MB 2 20 MET HG2 2.915 2.571 3.259 2.899 2.882 2.936 . 0 0 "[ . 1]" 1
2720 1 18 ILE MD 1 20 MET HG2 3.159 2.857 3.461 3.446 3.365 3.486 0.025 10 0 "[ . 1]" 1
2721 2 18 ILE MD 2 20 MET HG2 3.159 2.857 3.461 3.446 3.363 3.490 0.029 10 0 "[ . 1]" 1
2722 1 22 LYS QG 1 25 LYS HE2 3.351 . 6.000 4.385 4.237 4.532 . 0 0 "[ . 1]" 1
2723 2 22 LYS QG 2 25 LYS HE2 3.351 . 6.000 4.385 4.243 4.530 . 0 0 "[ . 1]" 1
2724 1 20 MET ME 1 25 LYS HE2 4.193 3.805 4.581 4.518 3.966 4.678 0.097 9 0 "[ . 1]" 1
2725 2 20 MET ME 2 25 LYS HE2 4.193 3.805 4.581 4.518 3.968 4.675 0.094 9 0 "[ . 1]" 1
2726 1 22 LYS QG 1 25 LYS HE3 3.683 . 6.000 4.456 4.297 4.567 . 0 0 "[ . 1]" 1
2727 2 22 LYS QG 2 25 LYS HE3 3.683 . 6.000 4.457 4.303 4.567 . 0 0 "[ . 1]" 1
2728 1 38 GLN QB 1 41 GLN HB3 2.125 . 2.333 2.162 2.019 2.252 . 0 0 "[ . 1]" 1
2729 2 38 GLN QB 2 41 GLN HB3 2.125 . 2.333 2.162 2.022 2.250 . 0 0 "[ . 1]" 1
2730 1 24 LEU QD 1 28 LEU HB2 2.005 . 2.289 2.377 2.353 2.405 0.116 2 0 "[ . 1]" 1
2731 1 47 ILE HG13 2 28 LEU HB2 2.005 . 2.289 2.375 2.350 2.400 0.111 2 0 "[ . 1]" 1
2732 1 28 LEU HB2 1 28 LEU MD1 2.120 . 6.000 3.049 3.027 3.059 . 0 0 "[ . 1]" 1
2733 1 47 ILE MG 2 28 LEU HB2 2.120 . 6.000 3.048 3.029 3.058 . 0 0 "[ . 1]" 1
2734 1 40 THR MG 1 44 GLU HG3 1.977 . 2.223 2.027 2.008 2.048 . 0 0 "[ . 1]" 1
2735 2 40 THR MG 2 44 GLU HG3 1.977 . 2.223 2.027 2.008 2.045 . 0 0 "[ . 1]" 1
2736 1 47 ILE HB 1 47 ILE HG13 1.978 . 2.225 2.245 2.208 2.287 0.062 8 0 "[ . 1]" 1
2737 1 24 LEU QD 2 47 ILE HB 1.978 . 2.225 2.245 2.209 2.288 0.063 8 0 "[ . 1]" 1
2738 1 43 ILE MG 1 44 GLU HG3 1.895 . 6.000 2.733 2.681 2.769 . 0 0 "[ . 1]" 1
2739 2 43 ILE MG 2 44 GLU HG3 1.895 . 6.000 2.734 2.685 2.767 . 0 0 "[ . 1]" 1
2740 1 43 ILE MG 1 44 GLU HG3 1.867 . 6.000 2.627 2.593 2.656 . 0 0 "[ . 1]" 1
2741 1 18 ILE MD 2 44 GLU HG3 1.867 . 6.000 2.629 2.596 2.657 . 0 0 "[ . 1]" 1
2742 1 27 ARG HB3 1 27 ARG HG2 1.965 . 2.153 2.165 2.117 2.206 0.053 6 0 "[ . 1]" 1
2743 1 20 MET HB3 2 44 GLU HG3 1.965 . 2.153 2.166 2.118 2.205 0.052 6 0 "[ . 1]" 1
2744 1 18 ILE HG12 1 20 MET HB3 3.853 3.417 4.289 4.285 4.241 4.314 0.025 7 0 "[ . 1]" 1
2745 1 18 ILE HG12 2 43 ILE HB 3.853 3.417 4.289 4.283 4.238 4.308 0.019 7 0 "[ . 1]" 1
2746 1 20 MET HB3 2 40 THR MG 2.536 2.098 2.974 2.656 2.470 2.809 . 0 0 "[ . 1]" 1
2747 1 40 THR MG 2 20 MET HB3 2.536 2.098 2.974 2.656 2.478 2.789 . 0 0 "[ . 1]" 1
2748 1 43 ILE HB 1 43 ILE MG 1.471 . 1.742 1.839 1.833 1.847 0.105 4 0 "[ . 1]" 1
2749 1 18 ILE MD 2 43 ILE HB 1.471 . 1.742 1.839 1.834 1.847 0.105 4 0 "[ . 1]" 1
2750 1 48 LYS HB2 1 48 LYS QG 2.086 . 2.296 1.921 1.884 1.936 . 0 0 "[ . 1]" 1
2751 2 48 LYS HB2 2 48 LYS QG 2.086 . 2.296 1.922 1.883 1.938 . 0 0 "[ . 1]" 1
2752 1 24 LEU HB3 1 24 LEU QD 1.487 . 1.762 1.750 1.731 1.761 . 0 0 "[ . 1]" 1
2753 2 24 LEU HB3 2 24 LEU QD 1.487 . 1.762 1.750 1.730 1.761 . 0 0 "[ . 1]" 1
2754 1 18 ILE HB 1 18 ILE HG12 2.618 2.342 2.894 2.681 2.675 2.687 . 0 0 "[ . 1]" 1
2755 2 18 ILE HB 2 18 ILE HG12 2.618 2.342 2.894 2.681 2.677 2.687 . 0 0 "[ . 1]" 1
2756 1 28 LEU MD2 1 42 ALA MB 1.921 . 2.380 1.700 1.618 1.807 . 0 0 "[ . 1]" 1
2757 2 28 LEU MD2 2 42 ALA MB 1.921 . 2.380 1.701 1.619 1.807 . 0 0 "[ . 1]" 1
2758 1 14 ALA MB 1 15 VAL MG2 2.854 2.375 3.333 3.120 3.095 3.153 . 0 0 "[ . 1]" 1
2759 1 51 LEU MD2 2 28 LEU HB3 2.854 2.375 3.333 3.119 3.096 3.147 . 0 0 "[ . 1]" 1
2760 1 40 THR MG 2 18 ILE MD 1.948 . 2.384 1.547 1.506 1.585 0.006 4 0 "[ . 1]" 1
2761 1 18 ILE MD 2 40 THR MG 1.948 . 2.384 1.545 1.502 1.584 0.010 4 0 "[ . 1]" 1
2762 1 28 LEU MD1 2 47 ILE MD 1.033 . 6.000 1.858 1.776 1.903 . 0 0 "[ . 1]" 1
2763 1 47 ILE MD 2 28 LEU MD1 1.033 . 6.000 1.858 1.775 1.912 . 0 0 "[ . 1]" 1
2764 1 47 ILE HG12 1 50 TYR QE 3.906 3.275 4.537 4.646 4.533 4.839 0.302 1 0 "[ . 1]" 1
2765 1 48 LYS HB2 2 50 TYR QE 3.906 3.275 4.537 4.646 4.535 4.838 0.301 1 0 "[ . 1]" 1
2766 1 50 TYR QE 1 51 LEU HG 3.603 . 6.000 5.426 5.333 5.532 . 0 0 "[ . 1]" 1
2767 1 35 ASN HB3 2 50 TYR QE 3.603 . 6.000 5.427 5.334 5.530 . 0 0 "[ . 1]" 1
2768 1 50 TYR QB 1 50 TYR QE 3.243 2.850 3.636 3.705 3.674 3.727 0.091 8 0 "[ . 1]" 1
2769 1 31 TYR HB3 2 50 TYR QE 3.243 2.850 3.636 3.706 3.675 3.727 0.091 8 0 "[ . 1]" 1
2770 1 47 ILE HA 1 50 TYR QE 3.635 . 6.000 4.438 4.395 4.502 . 0 0 "[ . 1]" 1
2771 2 47 ILE HA 2 50 TYR QE 3.635 . 6.000 4.438 4.396 4.500 . 0 0 "[ . 1]" 1
2772 1 50 TYR HA 1 50 TYR QE 4.247 3.711 4.783 4.478 4.378 4.565 . 0 0 "[ . 1]" 1
2773 2 50 TYR HA 2 50 TYR QE 4.247 3.711 4.783 4.477 4.382 4.565 . 0 0 "[ . 1]" 1
2774 1 50 TYR QD 2 42 ALA HA 4.345 3.718 4.972 4.849 4.739 4.946 . 0 0 "[ . 1]" 1
2775 1 42 ALA HA 2 50 TYR QD 4.345 3.718 4.972 4.852 4.741 4.953 . 0 0 "[ . 1]" 1
2776 1 19 TYR HB2 1 19 TYR QE 3.989 3.433 4.545 4.114 3.843 4.246 . 0 0 "[ . 1]" 1
2777 1 13 LYS QE 2 19 TYR QE 3.989 3.433 4.545 4.115 3.850 4.247 . 0 0 "[ . 1]" 1
2778 1 47 ILE HB 1 50 TYR QD 4.762 4.078 5.446 4.776 4.676 4.859 . 0 0 "[ . 1]" 1
2779 1 48 LYS HB3 2 50 TYR QD 4.762 4.078 5.446 4.776 4.680 4.863 . 0 0 "[ . 1]" 1
2780 1 47 ILE HG12 1 50 TYR QD 3.327 2.831 3.823 3.413 3.319 3.481 . 0 0 "[ . 1]" 1
2781 2 47 ILE HG12 2 50 TYR QD 3.327 2.831 3.823 3.412 3.318 3.481 . 0 0 "[ . 1]" 1
2782 1 19 TYR QE 2 13 LYS QB 3.820 . 6.000 5.955 5.864 6.069 0.069 9 0 "[ . 1]" 1
2783 1 13 LYS QB 2 19 TYR QE 3.820 . 6.000 5.952 5.859 6.060 0.060 9 0 "[ . 1]" 1
2784 1 50 TYR QD 1 51 LEU HB2 3.748 3.153 4.343 3.760 3.611 3.901 . 0 0 "[ . 1]" 1
2785 2 50 TYR QD 2 51 LEU HB2 3.748 3.153 4.343 3.759 3.609 3.904 . 0 0 "[ . 1]" 1
2786 1 19 TYR QD 2 40 THR HB 5.621 4.846 6.396 5.426 4.884 5.921 . 0 0 "[ . 1]" 1
2787 1 40 THR HB 2 19 TYR QD 5.621 4.846 6.396 5.427 4.894 5.930 . 0 0 "[ . 1]" 1
2788 1 31 TYR QE 1 32 CYS HA 3.798 . 6.000 4.753 4.622 4.926 . 0 0 "[ . 1]" 1
2789 2 31 TYR QE 2 32 CYS HA 3.798 . 6.000 4.753 4.624 4.925 . 0 0 "[ . 1]" 1
2790 1 28 LEU HA 1 31 TYR QE 5.842 . 6.000 4.524 4.483 4.570 . 0 0 "[ . 1]" 1
2791 2 28 LEU HA 2 31 TYR QE 5.842 . 6.000 4.526 4.492 4.568 . 0 0 "[ . 1]" 1
2792 1 31 TYR QE 2 56 GLY HA2 4.530 3.946 5.114 4.950 4.836 5.084 . 0 0 "[ . 1]" 1
2793 1 56 GLY HA2 2 31 TYR QE 4.530 3.946 5.114 4.947 4.829 5.107 . 0 0 "[ . 1]" 1
2794 1 31 TYR HA 1 31 TYR QE 4.420 . 6.000 3.470 3.283 3.678 . 0 0 "[ . 1]" 1
2795 2 31 TYR HA 2 31 TYR QE 4.420 . 6.000 3.470 3.289 3.677 . 0 0 "[ . 1]" 1
2796 1 31 TYR QE 2 51 LEU HA 4.636 3.981 5.291 5.125 5.012 5.259 . 0 0 "[ . 1]" 1
2797 1 51 LEU HA 2 31 TYR QE 4.636 3.981 5.291 5.124 5.015 5.261 . 0 0 "[ . 1]" 1
2798 1 31 TYR QE 1 32 CYS HB3 5.145 4.152 6.138 4.918 4.272 5.513 . 0 0 "[ . 1]" 1
2799 1 34 LYS QE 2 55 ASN HD21 5.145 4.152 6.138 4.915 4.263 5.502 . 0 0 "[ . 1]" 1
2800 1 31 TYR QE 2 50 TYR QB 4.306 . 6.000 5.346 5.271 5.425 . 0 0 "[ . 1]" 1
2801 1 50 TYR QB 2 31 TYR QE 4.306 . 6.000 5.345 5.270 5.435 . 0 0 "[ . 1]" 1
2802 1 31 TYR QE 1 35 ASN HB3 5.266 . 6.000 4.255 4.214 4.325 . 0 0 "[ . 1]" 1
2803 1 51 LEU HG 2 31 TYR QE 5.266 . 6.000 4.254 4.214 4.324 . 0 0 "[ . 1]" 1
2804 1 28 LEU HG 1 31 TYR QE 5.884 . 6.000 3.374 2.644 3.716 . 0 0 "[ . 1]" 1
2805 2 28 LEU HG 2 31 TYR QE 5.884 . 6.000 3.372 2.652 3.723 . 0 0 "[ . 1]" 1
2806 1 31 TYR QE 1 37 LEU HB2 3.851 3.315 4.387 3.971 3.775 4.253 . 0 0 "[ . 1]" 1
2807 2 31 TYR QE 2 37 LEU HB2 3.851 3.315 4.387 3.970 3.780 4.250 . 0 0 "[ . 1]" 1
2808 1 31 TYR QE 2 54 ARG HG3 3.921 3.434 4.408 3.314 3.280 3.370 0.154 3 0 "[ . 1]" 1
2809 1 54 ARG HG3 2 31 TYR QE 3.921 3.434 4.408 3.316 3.283 3.369 0.151 9 0 "[ . 1]" 1
2810 1 28 LEU MD1 1 31 TYR QE 3.818 3.026 4.610 4.603 4.443 4.672 0.062 8 0 "[ . 1]" 1
2811 2 28 LEU MD1 2 31 TYR QE 3.818 3.026 4.610 4.605 4.444 4.677 0.067 8 0 "[ . 1]" 1
2812 1 16 PHE QR 1 17 GLY HA3 5.541 4.816 6.266 5.016 4.999 5.027 . 0 0 "[ . 1]" 1
2813 1 17 GLY HA3 2 16 PHE QR 5.541 4.816 6.266 5.017 5.001 5.028 . 0 0 "[ . 1]" 1
2814 1 31 TYR QD 1 32 CYS HB3 4.460 3.976 4.944 4.312 4.171 4.545 . 0 0 "[ . 1]" 1
2815 2 31 TYR QD 2 32 CYS HB3 4.460 3.976 4.944 4.312 4.172 4.545 . 0 0 "[ . 1]" 1
2816 1 16 PHE QR 1 17 GLY HA2 4.132 3.605 4.659 4.035 4.000 4.079 . 0 0 "[ . 1]" 1
2817 1 17 GLY HA2 2 16 PHE QR 4.132 3.605 4.659 4.034 4.002 4.078 . 0 0 "[ . 1]" 1
2818 1 30 VAL HB 1 31 TYR QD 4.345 3.798 4.892 4.821 4.721 4.891 . 0 0 "[ . 1]" 1
2819 1 54 ARG HB2 2 31 TYR QD 4.345 3.798 4.892 4.821 4.722 4.890 . 0 0 "[ . 1]" 1
2820 1 28 LEU HB2 1 31 TYR QD 4.992 4.267 5.717 4.908 4.808 4.995 . 0 0 "[ . 1]" 1
2821 1 54 ARG HB2 2 31 TYR QD 4.992 4.267 5.717 4.908 4.811 4.998 . 0 0 "[ . 1]" 1
2822 1 20 MET ME 1 31 TYR QD 4.640 . 6.000 5.851 5.755 5.913 . 0 0 "[ . 1]" 1
2823 1 47 ILE HG12 2 31 TYR QD 4.640 . 6.000 5.851 5.753 5.910 . 0 0 "[ . 1]" 1
2824 1 31 TYR QD 1 37 LEU HB2 3.903 3.359 4.447 3.538 3.491 3.617 . 0 0 "[ . 1]" 1
2825 2 31 TYR QD 2 37 LEU HB2 3.903 3.359 4.447 3.537 3.491 3.614 . 0 0 "[ . 1]" 1
2826 1 30 VAL MG2 1 31 TYR QD 4.598 3.974 5.222 4.869 4.794 4.917 . 0 0 "[ . 1]" 1
2827 1 51 LEU HB3 2 31 TYR QD 4.598 3.974 5.222 4.870 4.797 4.919 . 0 0 "[ . 1]" 1
2828 1 16 PHE QR 2 27 ARG HB2 5.350 4.379 6.321 6.351 6.295 6.413 0.092 10 0 "[ . 1]" 1
2829 1 27 ARG HB2 2 16 PHE QR 5.350 4.379 6.321 6.350 6.298 6.412 0.091 10 0 "[ . 1]" 1
2830 1 50 TYR QE 2 38 GLN QB 4.902 4.109 5.695 5.569 5.482 5.675 . 0 0 "[ . 1]" 1
2831 1 38 GLN QB 2 50 TYR QE 4.902 4.109 5.695 5.570 5.478 5.660 . 0 0 "[ . 1]" 1
2832 1 31 TYR QD 1 45 GLU HG2 6.079 5.159 6.999 6.471 6.353 6.707 . 0 0 "[ . 1]" 1
2833 1 54 ARG HD2 2 31 TYR QD 6.079 5.159 6.999 6.471 6.343 6.701 . 0 0 "[ . 1]" 1
2834 1 50 TYR QE 1 51 LEU HB2 4.595 3.725 5.465 4.887 4.753 5.018 . 0 0 "[ . 1]" 1
2835 2 50 TYR QE 2 51 LEU HB2 4.595 3.725 5.465 4.887 4.756 5.016 . 0 0 "[ . 1]" 1
2836 1 28 LEU HG 1 31 TYR QD 5.642 . 6.000 3.527 3.169 3.920 . 0 0 "[ . 1]" 1
2837 2 28 LEU HG 2 31 TYR QD 5.642 . 6.000 3.528 3.173 3.922 . 0 0 "[ . 1]" 1
2838 1 31 TYR QE 1 34 LYS QB 5.503 . 6.000 4.306 4.113 4.490 . 0 0 "[ . 1]" 1
2839 1 34 LYS QB 2 55 ASN HD21 5.503 . 6.000 4.308 4.114 4.490 . 0 0 "[ . 1]" 1
2840 1 31 TYR QE 1 35 ASN HB3 4.157 3.669 4.645 4.388 4.331 4.470 . 0 0 "[ . 1]" 1
2841 1 20 MET HB3 2 41 GLN H 4.157 3.669 4.645 4.387 4.331 4.468 . 0 0 "[ . 1]" 1
2842 1 47 ILE MD 1 50 TYR QE 4.640 3.754 5.526 3.965 3.789 4.035 . 0 0 "[ . 1]" 1
2843 2 47 ILE MD 2 50 TYR QE 4.640 3.754 5.526 3.965 3.793 4.034 . 0 0 "[ . 1]" 1
2844 1 50 TYR QE 2 43 ILE MD 3.034 . 6.000 5.105 4.947 5.176 . 0 0 "[ . 1]" 1
2845 1 43 ILE MD 2 50 TYR QE 3.034 . 6.000 5.108 4.959 5.185 . 0 0 "[ . 1]" 1
2846 1 31 TYR QD 2 51 LEU MD2 3.291 . 6.000 4.070 3.944 4.147 . 0 0 "[ . 1]" 1
2847 1 51 LEU MD2 2 31 TYR QD 3.291 . 6.000 4.070 3.950 4.148 . 0 0 "[ . 1]" 1
2848 1 43 ILE MG 1 50 TYR QD 4.113 . 6.000 6.085 6.064 6.122 0.122 8 0 "[ . 1]" 1
2849 1 43 ILE MG 2 50 TYR QD 4.113 . 6.000 6.086 6.068 6.127 0.127 8 0 "[ . 1]" 1
2850 1 19 TYR HA 2 13 LYS HA 4.848 4.198 5.498 4.793 4.707 4.915 . 0 0 "[ . 1]" 1
2851 1 13 LYS HA 2 19 TYR HA 4.848 4.198 5.498 4.794 4.704 4.922 . 0 0 "[ . 1]" 1
2852 1 13 LYS HA 2 22 LYS HA 4.578 3.949 5.207 4.521 4.297 4.668 . 0 0 "[ . 1]" 1
2853 1 22 LYS HA 2 13 LYS HA 4.578 3.949 5.207 4.520 4.277 4.667 . 0 0 "[ . 1]" 1
2854 1 23 ASP HA 1 26 THR HA 4.891 4.396 5.386 5.212 5.127 5.275 . 0 0 "[ . 1]" 1
2855 2 23 ASP HA 2 26 THR HA 4.891 4.396 5.386 5.214 5.125 5.271 . 0 0 "[ . 1]" 1
2856 1 21 ASP HA 1 22 LYS HA 4.084 3.625 4.543 3.988 3.969 4.008 . 0 0 "[ . 1]" 1
2857 2 21 ASP HA 2 22 LYS HA 4.084 3.625 4.543 3.990 3.972 4.009 . 0 0 "[ . 1]" 1
2858 1 24 LEU HA 1 26 THR HB 4.599 4.031 5.167 4.240 3.991 4.499 0.040 3 0 "[ . 1]" 1
2859 1 31 TYR HA 2 56 GLY HA2 4.599 4.031 5.167 4.242 3.987 4.485 0.044 3 0 "[ . 1]" 1
2860 1 27 ARG HA 1 28 LEU HA 4.423 3.929 4.917 4.165 4.134 4.180 . 0 0 "[ . 1]" 1
2861 2 27 ARG HA 2 28 LEU HA 4.423 3.929 4.917 4.164 4.132 4.179 . 0 0 "[ . 1]" 1
2862 1 38 GLN HA 1 40 THR HB 4.701 4.130 5.272 4.594 4.538 4.650 . 0 0 "[ . 1]" 1
2863 2 38 GLN HA 2 40 THR HB 4.701 4.130 5.272 4.595 4.539 4.649 . 0 0 "[ . 1]" 1
2864 1 25 LYS HA 1 28 LEU HA 5.733 4.778 6.688 5.539 5.504 5.611 . 0 0 "[ . 1]" 1
2865 2 25 LYS HA 2 28 LEU HA 5.733 4.778 6.688 5.538 5.501 5.611 . 0 0 "[ . 1]" 1
2866 1 18 ILE HB 1 19 TYR HA 4.201 3.695 4.707 4.093 3.866 4.222 . 0 0 "[ . 1]" 1
2867 1 13 LYS QD 2 19 TYR HA 4.201 3.695 4.707 4.094 3.866 4.220 . 0 0 "[ . 1]" 1
2868 1 19 TYR HA 1 25 LYS HD3 4.275 3.725 4.825 4.615 4.581 4.637 . 0 0 "[ . 1]" 1
2869 1 14 ALA MB 2 19 TYR HA 4.275 3.725 4.825 4.615 4.580 4.639 . 0 0 "[ . 1]" 1
2870 1 33 ALA MB 1 35 ASN HA 4.821 4.298 5.344 5.024 4.980 5.115 . 0 0 "[ . 1]" 1
2871 2 33 ALA MB 2 35 ASN HA 4.821 4.298 5.344 5.023 4.977 5.107 . 0 0 "[ . 1]" 1
2872 1 13 LYS QD 2 19 TYR HA 5.283 . 6.000 4.094 3.863 4.223 . 0 0 "[ . 1]" 1
2873 1 19 TYR HA 2 13 LYS QD 5.283 . 6.000 4.094 3.869 4.218 . 0 0 "[ . 1]" 1
2874 1 14 ALA MB 2 19 TYR HA 4.314 3.755 4.873 4.615 4.579 4.639 . 0 0 "[ . 1]" 1
2875 1 19 TYR HA 2 14 ALA MB 4.314 3.755 4.873 4.615 4.582 4.637 . 0 0 "[ . 1]" 1
2876 1 20 MET HG3 2 16 PHE HA 5.757 5.183 6.331 5.258 5.139 5.369 0.044 10 0 "[ . 1]" 1
2877 1 16 PHE HA 2 20 MET HG3 5.757 5.183 6.331 5.259 5.137 5.369 0.046 10 0 "[ . 1]" 1
2878 1 14 ALA MB 1 16 PHE HA 5.676 . 6.000 4.520 4.491 4.591 . 0 0 "[ . 1]" 1
2879 1 16 PHE HA 2 25 LYS HD3 5.676 . 6.000 4.522 4.490 4.592 . 0 0 "[ . 1]" 1
2880 1 15 VAL MG2 1 16 PHE HA 3.709 3.027 4.391 3.949 3.913 3.994 . 0 0 "[ . 1]" 1
2881 2 15 VAL MG2 2 16 PHE HA 3.709 3.027 4.391 3.949 3.914 3.996 . 0 0 "[ . 1]" 1
2882 1 16 PHE HA 1 18 ILE MD 4.779 3.859 5.699 5.226 5.176 5.249 . 0 0 "[ . 1]" 1
2883 1 16 PHE HA 2 18 ILE MD 4.779 3.859 5.699 5.227 5.176 5.249 . 0 0 "[ . 1]" 1
2884 1 20 MET HA 1 25 LYS HG3 5.072 4.348 5.796 5.278 5.113 5.349 . 0 0 "[ . 1]" 1
2885 2 20 MET HA 2 25 LYS HG3 5.072 4.348 5.796 5.278 5.121 5.345 . 0 0 "[ . 1]" 1
2886 1 35 ASN HA 1 37 LEU HB3 6.904 6.129 7.679 6.540 6.517 6.572 . 0 0 "[ . 1]" 1
2887 2 35 ASN HA 2 37 LEU HB3 6.904 6.129 7.679 6.539 6.516 6.572 . 0 0 "[ . 1]" 1
2888 1 13 LYS QD 2 19 TYR HA 5.619 . 6.000 4.627 4.165 4.851 . 0 0 "[ . 1]" 1
2889 1 19 TYR HA 2 13 LYS QD 5.619 . 6.000 4.626 4.171 4.847 . 0 0 "[ . 1]" 1
2890 1 14 ALA HA 1 15 VAL HB 4.468 3.897 5.039 4.294 4.022 4.462 . 0 0 "[ . 1]" 1
2891 1 22 LYS QB 2 14 ALA HA 4.468 3.897 5.039 4.294 4.018 4.461 . 0 0 "[ . 1]" 1
2892 1 13 LYS QE 1 14 ALA HA 4.608 . 6.000 5.500 5.045 5.748 . 0 0 "[ . 1]" 1
2893 1 19 TYR HB2 2 14 ALA HA 4.608 . 6.000 5.498 5.034 5.744 . 0 0 "[ . 1]" 1
2894 1 24 LEU HA 2 48 LYS HA 4.223 3.697 4.749 4.400 4.354 4.475 . 0 0 "[ . 1]" 1
2895 1 48 LYS HA 2 24 LEU HA 4.223 3.697 4.749 4.399 4.350 4.473 . 0 0 "[ . 1]" 1
2896 1 27 ARG HA 1 30 VAL HA 4.102 3.568 4.636 4.494 4.434 4.589 . 0 0 "[ . 1]" 1
2897 2 27 ARG HA 2 30 VAL HA 4.102 3.568 4.636 4.494 4.431 4.591 . 0 0 "[ . 1]" 1
2898 1 29 LYS HA 1 33 ALA HA 5.118 . 6.000 4.573 4.548 4.617 . 0 0 "[ . 1]" 1
2899 2 29 LYS HA 2 33 ALA HA 5.118 . 6.000 4.574 4.553 4.619 . 0 0 "[ . 1]" 1
2900 1 41 GLN HA 1 42 ALA HA 4.297 3.741 4.853 4.225 4.205 4.251 . 0 0 "[ . 1]" 1
2901 2 41 GLN HA 2 42 ALA HA 4.297 3.741 4.853 4.225 4.206 4.251 . 0 0 "[ . 1]" 1
2902 1 33 ALA HA 1 38 GLN HA 5.965 5.309 6.621 6.274 6.126 6.369 . 0 0 "[ . 1]" 1
2903 2 33 ALA HA 2 38 GLN HA 5.965 5.309 6.621 6.275 6.126 6.371 . 0 0 "[ . 1]" 1
2904 1 23 ASP HB2 1 26 THR HB 4.899 4.414 5.384 4.650 4.578 4.705 . 0 0 "[ . 1]" 1
2905 2 23 ASP HB2 2 26 THR HB 4.899 4.414 5.384 4.652 4.577 4.703 . 0 0 "[ . 1]" 1
2906 1 33 ALA HA 1 36 ASN HB3 4.974 4.378 5.570 4.588 4.484 4.642 . 0 0 "[ . 1]" 1
2907 2 33 ALA HA 2 36 ASN HB3 4.974 4.378 5.570 4.587 4.475 4.647 . 0 0 "[ . 1]" 1
2908 1 40 THR HB 2 19 TYR HB2 4.607 3.909 5.305 4.527 4.497 4.575 . 0 0 "[ . 1]" 1
2909 1 19 TYR HB2 2 40 THR HB 4.607 3.909 5.305 4.530 4.492 4.577 . 0 0 "[ . 1]" 1
2910 1 50 TYR HA 1 53 LYS QE 5.597 . 6.000 4.240 2.822 4.983 . 0 0 "[ . 1]" 1
2911 1 53 LYS QE 2 50 TYR HA 5.597 . 6.000 4.241 2.823 4.979 . 0 0 "[ . 1]" 1
2912 1 23 ASP HB2 1 24 LEU HA 5.172 4.538 5.806 5.364 5.329 5.419 . 0 0 "[ . 1]" 1
2913 2 23 ASP HB2 2 24 LEU HA 5.172 4.538 5.806 5.365 5.322 5.421 . 0 0 "[ . 1]" 1
2914 1 31 TYR HA 2 56 GLY HA3 4.335 3.835 4.835 4.737 4.449 4.920 0.085 1 0 "[ . 1]" 1
2915 1 56 GLY HA3 2 31 TYR HA 4.335 3.835 4.835 4.736 4.450 4.916 0.081 1 0 "[ . 1]" 1
2916 1 51 LEU HA 1 52 GLN HA 4.648 3.983 5.313 4.567 4.540 4.594 . 0 0 "[ . 1]" 1
2917 2 51 LEU HA 2 52 GLN HA 4.648 3.983 5.313 4.567 4.541 4.598 . 0 0 "[ . 1]" 1
2918 1 21 ASP HB2 1 24 LEU HA 5.158 . 6.000 4.770 4.645 4.842 . 0 0 "[ . 1]" 1
2919 2 21 ASP HB2 2 24 LEU HA 5.158 . 6.000 4.770 4.647 4.847 . 0 0 "[ . 1]" 1
2920 1 37 LEU HB2 1 38 GLN HA 4.657 4.093 5.221 4.921 4.886 4.966 . 0 0 "[ . 1]" 1
2921 2 37 LEU HB2 2 38 GLN HA 4.657 4.093 5.221 4.922 4.888 4.964 . 0 0 "[ . 1]" 1
2922 1 15 VAL HA 2 18 ILE HG12 5.673 . 6.000 5.022 4.956 5.135 . 0 0 "[ . 1]" 1
2923 1 18 ILE HG12 2 15 VAL HA 5.673 . 6.000 5.022 4.954 5.133 . 0 0 "[ . 1]" 1
2924 1 15 VAL HA 2 18 ILE HG13 3.947 3.404 4.490 4.280 4.227 4.319 . 0 0 "[ . 1]" 1
2925 1 18 ILE HG13 2 15 VAL HA 3.947 3.404 4.490 4.279 4.235 4.323 . 0 0 "[ . 1]" 1
2926 1 17 GLY HA3 1 18 ILE HG13 4.623 4.062 5.184 4.153 4.005 4.302 0.057 6 0 "[ . 1]" 1
2927 1 24 LEU QD 2 56 GLY HA2 4.623 4.062 5.184 4.154 4.006 4.305 0.056 3 0 "[ . 1]" 1
2928 1 26 THR HB 1 30 VAL MG2 3.916 3.445 4.387 3.347 3.294 3.435 0.151 3 0 "[ . 1]" 1
2929 2 26 THR HB 2 30 VAL MG2 3.916 3.445 4.387 3.349 3.292 3.433 0.153 3 0 "[ . 1]" 1
2930 1 50 TYR HA 1 53 LYS QD 3.619 3.220 4.018 3.616 3.275 4.064 0.046 2 0 "[ . 1]" 1
2931 1 53 LYS QD 2 50 TYR HA 3.619 3.220 4.018 3.617 3.280 4.062 0.044 2 0 "[ . 1]" 1
2932 1 50 TYR HA 1 51 LEU MD1 3.801 . 6.000 4.748 4.689 4.821 . 0 0 "[ . 1]" 1
2933 2 50 TYR HA 2 51 LEU MD1 3.801 . 6.000 4.748 4.686 4.820 . 0 0 "[ . 1]" 1
2934 1 28 LEU MD1 1 40 THR HB 3.887 . 6.000 5.150 5.129 5.180 . 0 0 "[ . 1]" 1
2935 1 47 ILE MG 2 50 TYR HA 3.887 . 6.000 5.152 5.128 5.186 . 0 0 "[ . 1]" 1
2936 1 28 LEU MD1 1 40 THR HB 3.953 . 6.000 5.272 5.232 5.303 . 0 0 "[ . 1]" 1
2937 1 47 ILE MG 2 50 TYR HA 3.953 . 6.000 5.272 5.232 5.305 . 0 0 "[ . 1]" 1
2938 1 29 LYS HA 1 31 TYR HB3 2.891 . 6.000 3.910 3.877 3.942 . 0 0 "[ . 1]" 1
2939 2 29 LYS HA 2 31 TYR HB3 2.891 . 6.000 3.910 3.878 3.940 . 0 0 "[ . 1]" 1
2940 1 47 ILE HA 1 48 LYS HA 4.048 3.398 4.698 4.587 4.547 4.618 . 0 0 "[ . 1]" 1
2941 2 47 ILE HA 2 48 LYS HA 4.048 3.398 4.698 4.586 4.549 4.613 . 0 0 "[ . 1]" 1
2942 1 31 TYR HA 2 56 GLY HA3 4.367 3.809 4.925 4.619 4.372 4.771 . 0 0 "[ . 1]" 1
2943 1 56 GLY HA3 2 31 TYR HA 4.367 3.809 4.925 4.619 4.373 4.768 . 0 0 "[ . 1]" 1
2944 1 21 ASP HB3 1 24 LEU HA 5.937 . 6.000 5.048 4.978 5.204 . 0 0 "[ . 1]" 1
2945 2 21 ASP HB3 2 24 LEU HA 5.937 . 6.000 5.047 4.984 5.195 . 0 0 "[ . 1]" 1
2946 1 21 ASP HB3 1 24 LEU HA 4.524 . 6.000 3.734 3.420 4.193 . 0 0 "[ . 1]" 1
2947 2 21 ASP HB3 2 24 LEU HA 4.524 . 6.000 3.729 3.432 4.190 . 0 0 "[ . 1]" 1
2948 1 25 LYS HA 1 25 LYS QB 2.224 . 2.474 2.338 2.322 2.380 . 0 0 "[ . 1]" 1
2949 2 25 LYS HA 2 25 LYS QB 2.224 . 2.474 2.339 2.322 2.381 . 0 0 "[ . 1]" 1
2950 1 26 THR HA 1 30 VAL HB 5.941 . 6.000 4.866 4.831 4.901 . 0 0 "[ . 1]" 1
2951 2 26 THR HA 2 30 VAL HB 5.941 . 6.000 4.866 4.830 4.898 . 0 0 "[ . 1]" 1
2952 1 22 LYS QB 1 25 LYS HA 4.983 4.368 5.598 4.967 4.851 5.028 . 0 0 "[ . 1]" 1
2953 1 24 LEU HB2 2 44 GLU HA 4.983 4.368 5.598 4.967 4.851 5.027 . 0 0 "[ . 1]" 1
2954 1 26 THR HA 1 27 ARG HB3 4.829 4.182 5.476 4.623 4.545 4.685 . 0 0 "[ . 1]" 1
2955 1 27 ARG HB3 2 48 LYS HA 4.829 4.182 5.476 4.623 4.541 4.685 . 0 0 "[ . 1]" 1
2956 1 20 MET ME 1 43 ILE HA 4.099 3.523 4.675 4.263 4.117 4.367 . 0 0 "[ . 1]" 1
2957 1 20 MET ME 2 43 ILE HA 4.099 3.523 4.675 4.262 4.119 4.368 . 0 0 "[ . 1]" 1
2958 1 28 LEU HB3 1 31 TYR HB3 3.557 2.981 4.133 3.419 3.391 3.474 . 0 0 "[ . 1]" 1
2959 2 28 LEU HB3 2 31 TYR HB3 3.557 2.981 4.133 3.419 3.391 3.474 . 0 0 "[ . 1]" 1
2960 1 29 LYS QG 1 32 CYS HB2 4.136 3.565 4.707 3.493 3.468 3.528 0.097 1 0 "[ . 1]" 1
2961 2 29 LYS QG 2 32 CYS HB2 4.136 3.565 4.707 3.494 3.467 3.527 0.098 1 0 "[ . 1]" 1
2962 1 43 ILE HA 1 47 ILE HB 3.820 3.198 4.442 3.506 3.412 3.589 . 0 0 "[ . 1]" 1
2963 1 47 ILE HB 2 43 ILE HA 3.820 3.198 4.442 3.504 3.412 3.578 . 0 0 "[ . 1]" 1
2964 1 20 MET ME 1 43 ILE HA 3.565 3.079 4.051 3.526 3.421 3.597 . 0 0 "[ . 1]" 1
2965 1 47 ILE HG12 2 43 ILE HA 3.565 3.079 4.051 3.527 3.422 3.598 . 0 0 "[ . 1]" 1
2966 1 31 TYR HB3 2 54 ARG HB2 4.460 3.915 5.005 4.897 4.775 5.029 0.024 3 0 "[ . 1]" 1
2967 1 54 ARG HB2 2 31 TYR HB3 4.460 3.915 5.005 4.896 4.770 5.029 0.024 3 0 "[ . 1]" 1
2968 1 30 VAL HB 1 31 TYR HB3 4.477 3.956 4.998 4.538 4.483 4.593 . 0 0 "[ . 1]" 1
2969 2 30 VAL HB 2 31 TYR HB3 4.477 3.956 4.998 4.537 4.481 4.593 . 0 0 "[ . 1]" 1
2970 1 29 LYS HA 2 51 LEU MD1 4.047 . 6.000 5.137 5.038 5.249 . 0 0 "[ . 1]" 1
2971 1 51 LEU MD1 2 29 LYS HA 4.047 . 6.000 5.135 5.039 5.255 . 0 0 "[ . 1]" 1
2972 1 29 LYS HA 2 47 ILE MD 4.690 3.786 5.594 4.594 4.583 4.610 . 0 0 "[ . 1]" 1
2973 1 47 ILE MD 2 29 LYS HA 4.690 3.786 5.594 4.594 4.582 4.610 . 0 0 "[ . 1]" 1
2974 1 27 ARG HA 2 51 LEU MD1 4.312 3.561 5.063 4.187 4.124 4.242 . 0 0 "[ . 1]" 1
2975 1 51 LEU MD1 2 27 ARG HA 4.312 3.561 5.063 4.186 4.130 4.235 . 0 0 "[ . 1]" 1
2976 1 24 LEU HA 2 47 ILE MG 3.243 2.702 3.784 3.819 3.783 3.855 0.071 5 0 "[ . 1]" 1
2977 1 47 ILE MG 2 24 LEU HA 3.243 2.702 3.784 3.819 3.781 3.855 0.071 5 0 "[ . 1]" 1
2978 1 22 LYS HA 1 25 LYS HG3 4.769 4.158 5.380 5.482 5.411 5.532 0.152 2 0 "[ . 1]" 1
2979 2 22 LYS HA 2 25 LYS HG3 4.769 4.158 5.380 5.481 5.408 5.534 0.154 2 0 "[ . 1]" 1
2980 1 25 LYS HG3 1 26 THR HA 4.784 4.091 5.477 5.264 5.183 5.341 . 0 0 "[ . 1]" 1
2981 2 25 LYS HG3 2 26 THR HA 4.784 4.091 5.477 5.263 5.181 5.343 . 0 0 "[ . 1]" 1
2982 1 30 VAL MG1 1 31 TYR HB3 3.268 . 6.000 4.689 4.617 4.727 . 0 0 "[ . 1]" 1
2983 2 30 VAL MG1 2 31 TYR HB3 3.268 . 6.000 4.687 4.616 4.723 . 0 0 "[ . 1]" 1
2984 1 16 PHE HB2 2 18 ILE HG13 3.314 2.877 3.751 3.407 3.285 3.486 . 0 0 "[ . 1]" 1
2985 1 18 ILE HG13 2 16 PHE HB2 3.314 2.877 3.751 3.407 3.293 3.487 . 0 0 "[ . 1]" 1
2986 1 16 PHE HB2 1 18 ILE MG 4.347 . 6.000 3.677 3.609 3.742 . 0 0 "[ . 1]" 1
2987 1 18 ILE MD 2 16 PHE HB2 4.347 . 6.000 3.676 3.611 3.742 . 0 0 "[ . 1]" 1
2988 1 15 VAL MG2 1 16 PHE HB2 4.113 3.389 4.837 3.861 3.771 3.957 . 0 0 "[ . 1]" 1
2989 1 18 ILE MD 2 16 PHE HB2 4.113 3.389 4.837 3.861 3.774 3.958 . 0 0 "[ . 1]" 1
2990 1 16 PHE HB2 2 18 ILE HG12 5.187 . 6.000 4.028 3.854 4.140 . 0 0 "[ . 1]" 1
2991 1 18 ILE HG12 2 16 PHE HB2 5.187 . 6.000 4.030 3.856 4.146 . 0 0 "[ . 1]" 1
2992 1 21 ASP HB2 1 25 LYS QB 4.190 3.720 4.660 4.350 3.568 4.630 0.152 9 0 "[ . 1]" 1
2993 1 12 GLN HB3 2 23 ASP HB2 4.190 3.720 4.660 4.349 3.567 4.625 0.153 9 0 "[ . 1]" 1
2994 1 21 ASP HB2 2 44 GLU HB3 3.726 . 6.000 4.157 3.860 4.511 . 0 0 "[ . 1]" 1
2995 1 44 GLU HB3 2 21 ASP HB2 3.726 . 6.000 4.153 3.859 4.506 . 0 0 "[ . 1]" 1
2996 1 20 MET HB3 1 21 ASP HB2 5.561 4.907 6.215 4.908 4.816 5.205 0.091 7 0 "[ . 1]" 1
2997 1 53 LYS HB2 2 49 GLU HG2 5.561 4.907 6.215 4.907 4.810 5.203 0.097 7 0 "[ . 1]" 1
2998 1 16 PHE HB3 1 18 ILE HG12 4.205 . 6.000 2.965 2.841 3.065 . 0 0 "[ . 1]" 1
2999 1 18 ILE HG12 2 16 PHE HB3 4.205 . 6.000 2.967 2.843 3.073 . 0 0 "[ . 1]" 1
3000 1 29 LYS QE 1 39 LEU MD2 3.280 2.681 3.879 2.872 2.809 2.947 . 0 0 "[ . 1]" 1
3001 2 29 LYS QE 2 39 LEU MD2 3.280 2.681 3.879 2.873 2.812 2.948 . 0 0 "[ . 1]" 1
3002 1 32 CYS HB3 1 37 LEU MD1 3.488 . 6.000 4.266 4.136 4.334 . 0 0 "[ . 1]" 1
3003 2 32 CYS HB3 2 37 LEU MD1 3.488 . 6.000 4.267 4.135 4.337 . 0 0 "[ . 1]" 1
3004 1 15 VAL MG1 1 16 PHE HB3 3.919 3.236 4.602 4.212 4.175 4.236 . 0 0 "[ . 1]" 1
3005 1 15 VAL MG1 2 19 TYR HB2 3.919 3.236 4.602 4.212 4.175 4.234 . 0 0 "[ . 1]" 1
3006 1 13 LYS QE 1 15 VAL MG2 3.590 2.870 4.310 3.288 3.239 3.343 . 0 0 "[ . 1]" 1
3007 1 18 ILE MD 2 16 PHE HB3 3.590 2.870 4.310 3.286 3.239 3.339 . 0 0 "[ . 1]" 1
3008 1 13 LYS QE 1 15 VAL MG2 4.294 3.321 5.267 3.234 3.188 3.288 0.133 4 0 "[ . 1]" 1
3009 1 18 ILE MD 2 16 PHE HB3 4.294 3.321 5.267 3.232 3.190 3.285 0.131 4 0 "[ . 1]" 1
3010 1 20 MET ME 1 25 LYS HE2 4.756 4.190 5.322 4.755 4.630 4.855 . 0 0 "[ . 1]" 1
3011 1 53 LYS QD 2 52 GLN HG2 4.756 4.190 5.322 4.754 4.630 4.856 . 0 0 "[ . 1]" 1
3012 1 25 LYS HE3 1 25 LYS HG3 4.522 4.032 5.012 4.016 3.972 4.052 0.060 10 0 "[ . 1]" 1
3013 2 25 LYS HE3 2 25 LYS HG3 4.522 4.032 5.012 4.016 3.973 4.050 0.059 10 0 "[ . 1]" 1
3014 1 18 ILE HG13 1 20 MET HG2 4.352 . 6.000 3.239 3.082 3.325 . 0 0 "[ . 1]" 1
3015 2 18 ILE HG13 2 20 MET HG2 4.352 . 6.000 3.237 3.080 3.316 . 0 0 "[ . 1]" 1
3016 1 20 MET HG3 1 24 LEU QD 4.053 . 6.000 3.213 3.083 3.329 . 0 0 "[ . 1]" 1
3017 2 20 MET HG3 2 24 LEU QD 4.053 . 6.000 3.213 3.082 3.330 . 0 0 "[ . 1]" 1
3018 1 20 MET HG3 1 25 LYS HG3 3.746 . 6.000 3.104 2.974 3.294 . 0 0 "[ . 1]" 1
3019 2 20 MET HG3 2 25 LYS HG3 3.746 . 6.000 3.104 2.981 3.291 . 0 0 "[ . 1]" 1
3020 1 28 LEU HB2 2 51 LEU MD1 2.985 2.382 3.588 3.234 3.167 3.287 . 0 0 "[ . 1]" 1
3021 1 51 LEU MD1 2 28 LEU HB2 2.985 2.382 3.588 3.234 3.165 3.284 . 0 0 "[ . 1]" 1
3022 1 20 MET ME 2 51 LEU MD1 2.846 . 6.000 4.261 4.048 4.444 . 0 0 "[ . 1]" 1
3023 1 51 LEU MD1 2 20 MET ME 2.846 . 6.000 4.261 4.048 4.449 . 0 0 "[ . 1]" 1
3024 1 30 VAL HB 2 51 LEU MD1 3.640 2.972 4.308 3.777 3.645 3.924 . 0 0 "[ . 1]" 1
3025 1 51 LEU MD1 2 30 VAL HB 3.640 2.972 4.308 3.778 3.647 3.925 . 0 0 "[ . 1]" 1
3026 1 26 THR MG 1 30 VAL HB 4.273 3.595 4.951 4.539 4.388 4.664 . 0 0 "[ . 1]" 1
3027 2 26 THR MG 2 30 VAL HB 4.273 3.595 4.951 4.540 4.391 4.665 . 0 0 "[ . 1]" 1
3028 1 11 LYS QB 1 12 GLN HB2 4.404 . 6.000 3.164 2.552 3.613 . 0 0 "[ . 1]" 1
3029 1 22 LYS QB 2 12 GLN HB2 4.404 . 6.000 3.166 2.547 3.621 . 0 0 "[ . 1]" 1
3030 1 37 LEU HB3 2 51 LEU MD1 3.718 . 6.000 4.885 4.702 5.283 . 0 0 "[ . 1]" 1
3031 1 51 LEU MD1 2 37 LEU HB3 3.718 . 6.000 4.884 4.699 5.286 . 0 0 "[ . 1]" 1
3032 1 12 GLN HB2 1 13 LYS QG 4.445 3.867 5.023 4.253 3.796 4.470 0.071 6 0 "[ . 1]" 1
3033 2 12 GLN HB2 2 13 LYS QG 4.445 3.867 5.023 4.255 3.803 4.471 0.064 6 0 "[ . 1]" 1
3034 1 25 LYS HG2 1 39 LEU HG 4.155 3.526 4.784 4.242 4.204 4.295 . 0 0 "[ . 1]" 1
3035 2 25 LYS HG2 2 39 LEU HG 4.155 3.526 4.784 4.241 4.200 4.295 . 0 0 "[ . 1]" 1
3036 1 20 MET HB3 2 47 ILE MG 2.834 . 6.000 3.847 3.818 3.890 . 0 0 "[ . 1]" 1
3037 1 28 LEU MD1 2 51 LEU HG 2.834 . 6.000 3.847 3.821 3.890 . 0 0 "[ . 1]" 1
3038 1 18 ILE HB 1 18 ILE HG13 1.830 . 2.198 1.735 1.655 1.851 . 0 0 "[ . 1]" 1
3039 2 18 ILE HB 2 18 ILE HG13 1.830 . 2.198 1.736 1.659 1.851 . 0 0 "[ . 1]" 1
3040 1 28 LEU MD1 1 40 THR MG 2.660 . 6.000 4.545 4.502 4.612 . 0 0 "[ . 1]" 1
3041 2 28 LEU MD1 2 40 THR MG 2.660 . 6.000 4.545 4.504 4.609 . 0 0 "[ . 1]" 1
3042 1 40 THR MG 1 47 ILE MG 4.706 3.781 5.631 4.604 4.578 4.632 . 0 0 "[ . 1]" 1
3043 2 40 THR MG 2 47 ILE MG 4.706 3.781 5.631 4.603 4.579 4.634 . 0 0 "[ . 1]" 1
3044 1 18 ILE HG12 2 43 ILE MD 2.667 . 6.000 3.631 3.568 3.665 . 0 0 "[ . 1]" 1
3045 1 43 ILE MD 2 18 ILE HG12 2.667 . 6.000 3.630 3.570 3.666 . 0 0 "[ . 1]" 1
3046 1 49 GLU HA 1 50 TYR QD 4.224 3.640 4.808 4.726 4.631 4.806 . 0 0 "[ . 1]" 1
3047 1 42 ALA HA 2 50 TYR QD 4.224 3.640 4.808 4.728 4.633 4.811 0.003 1 0 "[ . 1]" 1
3048 1 21 ASP H 1 22 LYS QG 4.750 4.140 5.360 5.466 5.402 5.497 0.137 2 0 "[ . 1]" 1
3049 1 13 LYS QD 2 21 ASP H 4.750 4.140 5.360 5.466 5.396 5.503 0.143 2 0 "[ . 1]" 1
3050 1 21 ASP H 1 25 LYS HD3 4.037 . 6.000 4.960 4.912 5.027 . 0 0 "[ . 1]" 1
3051 1 14 ALA MB 2 21 ASP H 4.037 . 6.000 4.962 4.914 5.015 . 0 0 "[ . 1]" 1
3052 1 32 CYS H 1 33 ALA HA 5.424 4.660 6.188 5.013 4.984 5.063 . 0 0 "[ . 1]" 1
3053 2 32 CYS H 2 33 ALA HA 5.424 4.660 6.188 5.015 4.990 5.065 . 0 0 "[ . 1]" 1
3054 1 22 LYS H 1 22 LYS HA 2.383 2.129 2.637 2.552 2.543 2.560 . 0 0 "[ . 1]" 1
3055 2 22 LYS H 2 22 LYS HA 2.383 2.129 2.637 2.552 2.544 2.560 . 0 0 "[ . 1]" 1
3056 1 32 CYS H 1 32 CYS HB3 2.898 2.643 3.153 3.206 3.165 3.233 0.080 10 0 "[ . 1]" 1
3057 2 32 CYS H 2 32 CYS HB3 2.898 2.643 3.153 3.205 3.162 3.240 0.087 10 0 "[ . 1]" 1
3058 1 32 CYS H 1 33 ALA MB 3.486 3.081 3.891 3.960 3.939 3.990 0.099 8 0 "[ . 1]" 1
3059 2 32 CYS H 2 33 ALA MB 3.486 3.081 3.891 3.960 3.939 3.992 0.101 9 0 "[ . 1]" 1
3060 1 30 VAL MG1 1 32 CYS H 3.441 . 6.000 4.608 4.578 4.639 . 0 0 "[ . 1]" 1
3061 2 30 VAL MG1 2 32 CYS H 3.441 . 6.000 4.607 4.576 4.642 . 0 0 "[ . 1]" 1
3062 1 28 LEU MD2 1 32 CYS H 2.736 . 6.000 3.352 3.319 3.387 . 0 0 "[ . 1]" 1
3063 2 28 LEU MD2 2 32 CYS H 2.736 . 6.000 3.352 3.318 3.387 . 0 0 "[ . 1]" 1
3064 1 21 ASP HA 1 22 LYS H 2.110 . 2.331 2.001 1.989 2.019 . 0 0 "[ . 1]" 1
3065 2 21 ASP HA 2 22 LYS H 2.110 . 2.331 2.002 1.989 2.022 . 0 0 "[ . 1]" 1
3066 1 22 LYS H 2 12 GLN HB2 3.874 . 6.000 4.471 3.071 5.484 . 0 0 "[ . 1]" 1
3067 1 12 GLN HB2 2 22 LYS H 3.874 . 6.000 4.472 3.075 5.493 . 0 0 "[ . 1]" 1
3068 1 22 LYS H 1 22 LYS QB 2.025 . 2.247 1.915 1.901 1.927 . 0 0 "[ . 1]" 1
3069 2 22 LYS H 2 22 LYS QB 2.025 . 2.247 1.915 1.904 1.925 . 0 0 "[ . 1]" 1
3070 1 22 LYS H 1 22 LYS QD 3.640 . 6.000 3.209 3.147 3.252 . 0 0 "[ . 1]" 1
3071 2 22 LYS H 2 22 LYS QD 3.640 . 6.000 3.209 3.149 3.251 . 0 0 "[ . 1]" 1
3072 1 22 LYS H 1 22 LYS QG 3.300 2.973 3.627 3.425 3.404 3.436 . 0 0 "[ . 1]" 1
3073 2 22 LYS H 2 22 LYS QG 3.300 2.973 3.627 3.425 3.405 3.439 . 0 0 "[ . 1]" 1
3074 1 22 LYS H 1 26 THR MG 4.132 . 6.000 5.429 5.279 5.563 . 0 0 "[ . 1]" 1
3075 1 13 LYS QG 2 22 LYS H 4.132 . 6.000 5.431 5.290 5.566 . 0 0 "[ . 1]" 1
3076 1 13 LYS QD 1 14 ALA H 3.290 . 6.000 4.087 3.639 4.231 . 0 0 "[ . 1]" 1
3077 1 25 LYS HD3 2 14 ALA H 3.290 . 6.000 4.085 3.638 4.225 . 0 0 "[ . 1]" 1
3078 1 12 GLN HA 1 14 ALA H 4.496 3.870 5.122 4.685 4.617 4.743 . 0 0 "[ . 1]" 1
3079 1 18 ILE HA 2 16 PHE H 4.496 3.870 5.122 4.681 4.621 4.747 . 0 0 "[ . 1]" 1
3080 1 25 LYS HG3 1 29 LYS H 3.711 . 6.000 5.114 5.071 5.217 . 0 0 "[ . 1]" 1
3081 2 25 LYS HG3 2 29 LYS H 3.711 . 6.000 5.114 5.071 5.216 . 0 0 "[ . 1]" 1
3082 1 28 LEU MD2 1 29 LYS H 2.602 . 6.000 3.211 3.173 3.260 . 0 0 "[ . 1]" 1
3083 2 28 LEU MD2 2 29 LYS H 2.602 . 6.000 3.212 3.171 3.261 . 0 0 "[ . 1]" 1
3084 1 38 GLN H 1 38 GLN HG2 3.539 3.220 3.858 3.494 3.449 3.534 . 0 0 "[ . 1]" 1
3085 2 38 GLN H 2 38 GLN HG2 3.539 3.220 3.858 3.496 3.454 3.533 . 0 0 "[ . 1]" 1
3086 1 28 LEU MD2 1 30 VAL H 3.318 2.812 3.824 3.702 3.607 3.757 . 0 0 "[ . 1]" 1
3087 2 28 LEU MD2 2 30 VAL H 3.318 2.812 3.824 3.703 3.608 3.760 . 0 0 "[ . 1]" 1
3088 1 29 LYS QB 1 30 VAL H 2.396 2.145 2.647 2.221 2.205 2.235 . 0 0 "[ . 1]" 1
3089 2 29 LYS QB 2 30 VAL H 2.396 2.145 2.647 2.220 2.206 2.233 . 0 0 "[ . 1]" 1
3090 1 30 VAL H 1 30 VAL MG1 2.775 . 6.000 3.420 3.392 3.471 . 0 0 "[ . 1]" 1
3091 2 30 VAL H 2 30 VAL MG1 2.775 . 6.000 3.421 3.392 3.470 . 0 0 "[ . 1]" 1
3092 1 30 VAL H 1 31 TYR HA 5.589 4.767 6.411 4.847 4.808 4.881 . 0 0 "[ . 1]" 1
3093 2 30 VAL H 2 31 TYR HA 5.589 4.767 6.411 4.847 4.809 4.880 . 0 0 "[ . 1]" 1
3094 1 27 ARG HG3 1 30 VAL H 3.714 . 6.000 4.962 4.896 4.998 . 0 0 "[ . 1]" 1
3095 2 27 ARG HG3 2 30 VAL H 3.714 . 6.000 4.963 4.901 4.993 . 0 0 "[ . 1]" 1
3096 1 45 GLU HA 1 48 LYS H 3.437 3.013 3.861 3.186 3.121 3.240 . 0 0 "[ . 1]" 1
3097 2 45 GLU HA 2 48 LYS H 3.437 3.013 3.861 3.186 3.120 3.243 . 0 0 "[ . 1]" 1
3098 1 48 LYS H 1 48 LYS HA 2.488 2.180 2.796 2.735 2.719 2.751 . 0 0 "[ . 1]" 1
3099 2 48 LYS H 2 48 LYS HA 2.488 2.180 2.796 2.735 2.721 2.751 . 0 0 "[ . 1]" 1
3100 1 48 LYS H 1 48 LYS HB2 2.604 2.344 2.864 2.589 2.562 2.620 . 0 0 "[ . 1]" 1
3101 2 48 LYS H 2 48 LYS HB2 2.604 2.344 2.864 2.590 2.562 2.622 . 0 0 "[ . 1]" 1
3102 1 20 MET H 2 40 THR MG 3.125 2.812 3.438 2.972 2.907 3.037 . 0 0 "[ . 1]" 1
3103 1 40 THR MG 2 20 MET H 3.125 2.812 3.438 2.972 2.911 3.040 . 0 0 "[ . 1]" 1
3104 1 48 LYS H 1 48 LYS HB3 2.146 . 2.381 2.052 1.997 2.082 . 0 0 "[ . 1]" 1
3105 2 48 LYS H 2 48 LYS HB3 2.146 . 2.381 2.051 1.996 2.082 . 0 0 "[ . 1]" 1
3106 1 20 MET H 2 16 PHE HB3 5.107 . 6.000 3.795 3.719 3.873 . 0 0 "[ . 1]" 1
3107 1 16 PHE HB3 2 20 MET H 5.107 . 6.000 3.796 3.722 3.874 . 0 0 "[ . 1]" 1
3108 1 47 ILE H 1 47 ILE HB 1.905 . 2.091 1.955 1.918 1.981 . 0 0 "[ . 1]" 1
3109 2 47 ILE H 2 47 ILE HB 1.905 . 2.091 1.954 1.918 1.981 . 0 0 "[ . 1]" 1
3110 1 24 LEU HA 1 28 LEU H 3.979 3.474 4.484 4.194 4.109 4.313 . 0 0 "[ . 1]" 1
3111 2 24 LEU HA 2 28 LEU H 3.979 3.474 4.484 4.194 4.108 4.310 . 0 0 "[ . 1]" 1
3112 1 46 ALA HA 1 47 ILE H 3.263 2.872 3.654 3.309 3.288 3.333 . 0 0 "[ . 1]" 1
3113 2 46 ALA HA 2 47 ILE H 3.263 2.872 3.654 3.308 3.290 3.332 . 0 0 "[ . 1]" 1
3114 1 43 ILE HA 1 47 ILE H 3.552 3.142 3.962 3.310 3.283 3.336 . 0 0 "[ . 1]" 1
3115 1 50 TYR QB 2 47 ILE H 3.552 3.142 3.962 3.309 3.283 3.330 . 0 0 "[ . 1]" 1
3116 1 20 MET H 2 16 PHE HB3 4.429 3.945 4.913 4.185 4.034 4.310 . 0 0 "[ . 1]" 1
3117 1 16 PHE HB3 2 20 MET H 4.429 3.945 4.913 4.185 4.034 4.310 . 0 0 "[ . 1]" 1
3118 1 18 ILE HG12 1 20 MET H 4.586 3.949 5.223 4.370 4.296 4.425 . 0 0 "[ . 1]" 1
3119 2 18 ILE HG12 2 20 MET H 4.586 3.949 5.223 4.369 4.295 4.424 . 0 0 "[ . 1]" 1
3120 1 25 LYS HA 1 28 LEU H 2.785 2.451 3.119 3.186 3.152 3.208 0.089 8 0 "[ . 1]" 1
3121 2 25 LYS HA 2 28 LEU H 2.785 2.451 3.119 3.186 3.154 3.207 0.088 8 0 "[ . 1]" 1
3122 1 27 ARG HG3 1 28 LEU H 2.369 2.122 2.616 2.795 2.755 2.833 0.217 2 0 "[ . 1]" 1
3123 1 47 ILE HG12 2 28 LEU H 2.369 2.122 2.616 2.796 2.761 2.836 0.220 2 0 "[ . 1]" 1
3124 1 24 LEU QD 1 28 LEU H 2.287 . 2.640 2.168 2.122 2.217 . 0 0 "[ . 1]" 1
3125 1 46 ALA MB 2 47 ILE H 2.287 . 2.640 2.169 2.124 2.219 . 0 0 "[ . 1]" 1
3126 1 18 ILE MD 1 20 MET H 2.524 . 6.000 3.371 3.317 3.423 . 0 0 "[ . 1]" 1
3127 1 15 VAL MG2 2 20 MET H 2.524 . 6.000 3.371 3.316 3.421 . 0 0 "[ . 1]" 1
3128 1 27 ARG QD 1 28 LEU H 4.460 3.888 5.032 3.970 3.852 4.029 0.036 1 0 "[ . 1]" 1
3129 2 27 ARG QD 2 28 LEU H 4.460 3.888 5.032 3.970 3.852 4.029 0.036 1 0 "[ . 1]" 1
3130 1 23 ASP H 1 25 LYS HE2 5.079 4.397 5.761 5.303 5.246 5.393 . 0 0 "[ . 1]" 1
3131 2 23 ASP H 2 25 LYS HE2 5.079 4.397 5.761 5.303 5.253 5.378 . 0 0 "[ . 1]" 1
3132 1 38 GLN HG2 1 40 THR H 4.873 . 6.000 4.059 3.988 4.114 . 0 0 "[ . 1]" 1
3133 2 38 GLN HG2 2 40 THR H 4.873 . 6.000 4.061 3.991 4.115 . 0 0 "[ . 1]" 1
3134 1 11 LYS H 1 11 LYS QB 1.909 . 2.073 2.068 1.973 2.129 0.056 8 0 "[ . 1]" 1
3135 2 11 LYS H 2 11 LYS QB 1.909 . 2.073 2.068 1.968 2.135 0.062 7 0 "[ . 1]" 1
3136 1 13 LYS H 1 13 LYS QB 2.337 2.126 2.548 2.419 2.378 2.506 . 0 0 "[ . 1]" 1
3137 2 13 LYS H 2 13 LYS QB 2.337 2.126 2.548 2.419 2.380 2.506 . 0 0 "[ . 1]" 1
3138 1 23 ASP H 1 24 LEU QD 3.507 2.980 4.034 3.926 3.870 3.972 . 0 0 "[ . 1]" 1
3139 1 24 LEU QD 2 52 GLN H 3.507 2.980 4.034 3.926 3.867 3.974 . 0 0 "[ . 1]" 1
3140 1 28 LEU MD1 1 40 THR H 3.012 . 6.000 4.240 4.192 4.265 . 0 0 "[ . 1]" 1
3141 2 28 LEU MD1 2 40 THR H 3.012 . 6.000 4.241 4.187 4.264 . 0 0 "[ . 1]" 1
3142 1 28 LEU MD1 1 40 THR H 3.491 . 6.000 5.166 5.098 5.230 . 0 0 "[ . 1]" 1
3143 2 28 LEU MD1 2 40 THR H 3.491 . 6.000 5.167 5.101 5.235 . 0 0 "[ . 1]" 1
3144 1 22 LYS QE 1 23 ASP H 4.590 4.029 5.151 4.326 3.905 5.077 0.124 9 0 "[ . 1]" 1
3145 2 22 LYS QE 2 23 ASP H 4.590 4.029 5.151 4.325 3.908 5.073 0.121 9 0 "[ . 1]" 1
3146 1 18 ILE H 2 16 PHE HB3 3.528 3.082 3.974 3.145 3.070 3.223 0.012 8 0 "[ . 1]" 1
3147 1 16 PHE HB3 2 18 ILE H 3.528 3.082 3.974 3.143 3.073 3.231 0.009 8 0 "[ . 1]" 1
3148 1 45 GLU QB 1 46 ALA H 2.906 . 6.000 2.573 2.484 2.668 . 0 0 "[ . 1]" 1
3149 2 45 GLU QB 2 46 ALA H 2.906 . 6.000 2.571 2.480 2.665 . 0 0 "[ . 1]" 1
3150 1 13 LYS H 2 21 ASP HB3 4.617 4.058 5.176 4.067 4.008 4.171 0.050 9 0 "[ . 1]" 1
3151 1 21 ASP HB3 2 13 LYS H 4.617 4.058 5.176 4.065 4.005 4.167 0.053 9 0 "[ . 1]" 1
3152 1 45 GLU HG3 1 46 ALA H 5.134 . 6.000 3.985 3.932 4.047 . 0 0 "[ . 1]" 1
3153 2 45 GLU HG3 2 46 ALA H 5.134 . 6.000 3.986 3.932 4.047 . 0 0 "[ . 1]" 1
3154 1 18 ILE H 1 18 ILE HG13 2.182 . 2.468 2.086 2.072 2.102 . 0 0 "[ . 1]" 1
3155 2 18 ILE H 2 18 ILE HG13 2.182 . 2.468 2.088 2.077 2.105 . 0 0 "[ . 1]" 1
3156 1 17 GLY HA3 1 18 ILE H 3.003 2.727 3.279 2.810 2.791 2.833 . 0 0 "[ . 1]" 1
3157 2 17 GLY HA3 2 18 ILE H 3.003 2.727 3.279 2.807 2.795 2.836 . 0 0 "[ . 1]" 1
3158 1 32 CYS HB2 1 37 LEU H 4.527 4.033 5.021 4.917 4.859 4.972 . 0 0 "[ . 1]" 1
3159 1 31 TYR HB2 2 51 LEU H 4.527 4.033 5.021 4.916 4.854 4.973 . 0 0 "[ . 1]" 1
3160 1 44 GLU HG3 1 46 ALA H 3.628 3.253 4.003 4.002 3.973 4.034 0.031 8 0 "[ . 1]" 1
3161 1 47 ILE HB 2 46 ALA H 3.628 3.253 4.003 4.002 3.977 4.030 0.027 8 0 "[ . 1]" 1
3162 1 18 ILE H 2 40 THR MG 4.431 3.766 5.096 4.002 3.879 4.154 . 0 0 "[ . 1]" 1
3163 1 40 THR MG 2 18 ILE H 4.431 3.766 5.096 4.001 3.876 4.153 . 0 0 "[ . 1]" 1
3164 1 18 ILE H 2 43 ILE MD 3.103 . 6.000 4.897 4.846 4.933 . 0 0 "[ . 1]" 1
3165 1 43 ILE MD 2 18 ILE H 3.103 . 6.000 4.897 4.853 4.934 . 0 0 "[ . 1]" 1
3166 1 18 ILE H 1 18 ILE HB 2.604 . 6.000 3.050 3.032 3.075 . 0 0 "[ . 1]" 1
3167 2 18 ILE H 2 18 ILE HB 2.604 . 6.000 3.051 3.031 3.075 . 0 0 "[ . 1]" 1
3168 1 27 ARG HB3 1 27 ARG HE 2.972 2.730 3.214 3.124 3.103 3.159 . 0 0 "[ . 1]" 1
3169 2 27 ARG HB3 2 27 ARG HE 2.972 2.730 3.214 3.125 3.105 3.164 . 0 0 "[ . 1]" 1
3170 1 17 GLY H 1 18 ILE HG12 3.279 . 6.000 4.401 4.332 4.467 . 0 0 "[ . 1]" 1
3171 1 18 ILE HG12 2 17 GLY H 3.279 . 6.000 4.405 4.338 4.470 . 0 0 "[ . 1]" 1
3172 1 27 ARG HE 1 30 VAL HB 4.455 3.914 4.996 4.154 4.053 4.219 . 0 0 "[ . 1]" 1
3173 2 27 ARG HE 2 30 VAL HB 4.455 3.914 4.996 4.153 4.051 4.221 . 0 0 "[ . 1]" 1
3174 1 18 ILE H 2 40 THR MG 3.358 2.910 3.806 3.612 3.592 3.634 . 0 0 "[ . 1]" 1
3175 1 40 THR MG 2 18 ILE H 3.358 2.910 3.806 3.612 3.593 3.635 . 0 0 "[ . 1]" 1
3176 1 17 GLY H 2 43 ILE MD 2.943 . 6.000 4.967 4.900 5.020 . 0 0 "[ . 1]" 1
3177 1 43 ILE MD 2 17 GLY H 2.943 . 6.000 4.967 4.909 5.023 . 0 0 "[ . 1]" 1
3178 1 51 LEU H 1 51 LEU MD1 2.014 . 6.000 2.685 2.649 2.738 . 0 0 "[ . 1]" 1
3179 2 51 LEU H 2 51 LEU MD1 2.014 . 6.000 2.687 2.650 2.744 . 0 0 "[ . 1]" 1
3180 1 27 ARG HA 1 27 ARG HE 3.874 3.434 4.314 3.467 3.380 3.651 0.054 1 0 "[ . 1]" 1
3181 2 27 ARG HA 2 27 ARG HE 3.874 3.434 4.314 3.466 3.387 3.665 0.047 1 0 "[ . 1]" 1
3182 1 17 GLY H 1 17 GLY HA2 2.579 2.313 2.845 2.367 2.352 2.374 . 0 0 "[ . 1]" 1
3183 2 17 GLY H 2 17 GLY HA2 2.579 2.313 2.845 2.367 2.354 2.375 . 0 0 "[ . 1]" 1
3184 1 16 PHE HB3 1 17 GLY H 2.848 . 6.000 3.748 3.611 3.925 . 0 0 "[ . 1]" 1
3185 1 48 LYS QE 2 27 ARG HE 2.848 . 6.000 3.750 3.620 3.929 . 0 0 "[ . 1]" 1
3186 1 24 LEU HA 1 27 ARG HE 3.523 . 6.000 4.204 4.080 4.306 . 0 0 "[ . 1]" 1
3187 1 31 TYR HA 2 56 GLY H 3.523 . 6.000 4.205 4.079 4.307 . 0 0 "[ . 1]" 1
3188 1 55 ASN HB2 1 56 GLY H 2.380 2.161 2.599 2.644 2.563 2.705 0.106 7 0 "[ . 1]" 1
3189 2 55 ASN HB2 2 56 GLY H 2.380 2.161 2.599 2.644 2.558 2.704 0.105 7 0 "[ . 1]" 1
3190 1 15 VAL H 2 20 MET HB2 4.528 . 6.000 6.014 5.983 6.047 0.047 5 0 "[ . 1]" 1
3191 1 20 MET HB2 2 15 VAL H 4.528 . 6.000 6.014 5.981 6.044 0.044 5 0 "[ . 1]" 1
3192 1 31 TYR HA 1 33 ALA H 3.911 3.432 4.390 3.932 3.761 4.110 . 0 0 "[ . 1]" 1
3193 2 31 TYR HA 2 33 ALA H 3.911 3.432 4.390 3.933 3.772 4.106 . 0 0 "[ . 1]" 1
3194 1 20 MET ME 1 26 THR H 3.694 . 6.000 4.571 4.506 4.766 . 0 0 "[ . 1]" 1
3195 1 47 ILE HG12 2 26 THR H 3.694 . 6.000 4.571 4.508 4.769 . 0 0 "[ . 1]" 1
3196 1 24 LEU HB3 1 26 THR H 4.250 3.756 4.744 4.293 4.038 4.431 . 0 0 "[ . 1]" 1
3197 2 24 LEU HB3 2 26 THR H 4.250 3.756 4.744 4.294 4.045 4.428 . 0 0 "[ . 1]" 1
3198 1 26 THR H 1 27 ARG HB2 4.991 4.428 5.554 4.759 4.664 4.855 . 0 0 "[ . 1]" 1
3199 2 26 THR H 2 27 ARG HB2 4.991 4.428 5.554 4.758 4.668 4.851 . 0 0 "[ . 1]" 1
3200 1 22 LYS QG 1 26 THR H 3.115 . 6.000 3.862 3.798 3.990 . 0 0 "[ . 1]" 1
3201 2 22 LYS QG 2 26 THR H 3.115 . 6.000 3.861 3.799 3.993 . 0 0 "[ . 1]" 1
3202 1 40 THR MG 1 43 ILE H 4.145 3.456 4.834 4.502 4.484 4.531 . 0 0 "[ . 1]" 1
3203 2 40 THR MG 2 43 ILE H 4.145 3.456 4.834 4.501 4.484 4.523 . 0 0 "[ . 1]" 1
3204 1 43 ILE H 1 43 ILE MG 2.429 . 6.000 3.405 3.389 3.431 . 0 0 "[ . 1]" 1
3205 1 18 ILE MD 2 43 ILE H 2.429 . 6.000 3.405 3.388 3.427 . 0 0 "[ . 1]" 1
3206 1 41 GLN HB2 1 43 ILE H 4.483 . 6.000 5.257 5.196 5.335 . 0 0 "[ . 1]" 1
3207 2 41 GLN HB2 2 43 ILE H 4.483 . 6.000 5.256 5.195 5.335 . 0 0 "[ . 1]" 1
3208 1 41 GLN HA 1 43 ILE H 3.249 . 6.000 3.790 3.731 3.831 . 0 0 "[ . 1]" 1
3209 2 41 GLN HA 2 43 ILE H 3.249 . 6.000 3.788 3.733 3.832 . 0 0 "[ . 1]" 1
3210 1 24 LEU H 1 25 LYS QB 3.558 3.199 3.917 3.527 3.493 3.571 . 0 0 "[ . 1]" 1
3211 2 24 LEU H 2 25 LYS QB 3.558 3.199 3.917 3.526 3.491 3.565 . 0 0 "[ . 1]" 1
3212 1 24 LEU H 1 24 LEU QD 2.620 2.285 2.955 3.097 3.071 3.127 0.172 8 0 "[ . 1]" 1
3213 2 24 LEU H 2 24 LEU QD 2.620 2.285 2.955 3.097 3.071 3.128 0.173 8 0 "[ . 1]" 1
3214 1 24 LEU H 1 24 LEU QD 2.970 2.608 3.332 3.204 3.178 3.244 . 0 0 "[ . 1]" 1
3215 2 24 LEU H 2 24 LEU QD 2.970 2.608 3.332 3.203 3.177 3.244 . 0 0 "[ . 1]" 1
3216 1 24 LEU H 1 24 LEU HA 2.881 2.525 3.237 2.717 2.691 2.742 . 0 0 "[ . 1]" 1
3217 2 24 LEU H 2 24 LEU HA 2.881 2.525 3.237 2.717 2.691 2.744 . 0 0 "[ . 1]" 1
3218 1 21 ASP HB2 1 24 LEU H 2.979 2.690 3.268 3.317 3.199 3.352 0.084 1 0 "[ . 1]" 1
3219 2 21 ASP HB2 2 24 LEU H 2.979 2.690 3.268 3.319 3.203 3.363 0.095 1 0 "[ . 1]" 1
3220 1 22 LYS QE 1 27 ARG H 4.805 . 6.000 5.622 5.365 5.849 . 0 0 "[ . 1]" 1
3221 1 48 LYS QE 2 27 ARG H 4.805 . 6.000 5.621 5.366 5.852 . 0 0 "[ . 1]" 1
3222 1 20 MET ME 1 27 ARG H 3.335 2.978 3.692 3.557 3.541 3.580 . 0 0 "[ . 1]" 1
3223 1 20 MET ME 2 44 GLU H 3.335 2.978 3.692 3.557 3.542 3.578 . 0 0 "[ . 1]" 1
3224 1 27 ARG H 2 51 LEU MD2 3.227 . 6.000 4.218 4.172 4.260 . 0 0 "[ . 1]" 1
3225 1 51 LEU MD2 2 27 ARG H 3.227 . 6.000 4.217 4.181 4.253 . 0 0 "[ . 1]" 1
3226 1 28 LEU MD1 1 31 TYR H 3.056 2.561 3.551 3.610 3.571 3.658 0.107 4 0 "[ . 1]" 1
3227 2 28 LEU MD1 2 31 TYR H 3.056 2.561 3.551 3.609 3.572 3.658 0.107 4 0 "[ . 1]" 1
3228 1 24 LEU HA 1 25 LYS H 2.854 2.521 3.187 2.716 2.708 2.721 . 0 0 "[ . 1]" 1
3229 2 24 LEU HA 2 25 LYS H 2.854 2.521 3.187 2.715 2.708 2.723 . 0 0 "[ . 1]" 1
3230 1 30 VAL HA 1 31 TYR H 2.785 2.453 3.117 3.232 3.219 3.243 0.126 8 0 "[ . 1]" 1
3231 2 30 VAL HA 2 31 TYR H 2.785 2.453 3.117 3.232 3.218 3.242 0.125 7 0 "[ . 1]" 1
3232 1 25 LYS H 1 25 LYS HA 2.388 2.115 2.661 2.501 2.483 2.508 . 0 0 "[ . 1]" 1
3233 2 25 LYS H 2 25 LYS HA 2.388 2.115 2.661 2.501 2.484 2.508 . 0 0 "[ . 1]" 1
3234 1 22 LYS QE 1 25 LYS H 6.146 5.344 6.948 5.402 5.356 5.483 . 0 0 "[ . 1]" 1
3235 2 22 LYS QE 2 25 LYS H 6.146 5.344 6.948 5.401 5.356 5.486 . 0 0 "[ . 1]" 1
3236 1 25 LYS H 1 25 LYS QB 2.150 . 2.419 1.961 1.941 1.987 . 0 0 "[ . 1]" 1
3237 2 25 LYS H 2 25 LYS QB 2.150 . 2.419 1.961 1.936 1.985 . 0 0 "[ . 1]" 1
3238 1 40 THR MG 1 44 GLU H 3.566 3.017 4.115 3.722 3.686 3.739 . 0 0 "[ . 1]" 1
3239 2 40 THR MG 2 44 GLU H 3.566 3.017 4.115 3.721 3.680 3.737 . 0 0 "[ . 1]" 1
3240 1 25 LYS H 1 25 LYS HG3 3.235 2.815 3.655 3.390 3.348 3.421 . 0 0 "[ . 1]" 1
3241 2 25 LYS H 2 25 LYS HG3 3.235 2.815 3.655 3.389 3.348 3.421 . 0 0 "[ . 1]" 1
3242 1 25 LYS H 2 47 ILE MD 3.034 . 6.000 4.083 4.038 4.113 . 0 0 "[ . 1]" 1
3243 1 18 ILE MG 2 44 GLU H 3.034 . 6.000 4.082 4.041 4.117 . 0 0 "[ . 1]" 1
3244 1 31 TYR H 2 51 LEU MD1 2.884 . 6.000 3.933 3.839 4.027 . 0 0 "[ . 1]" 1
3245 1 51 LEU MD1 2 31 TYR H 2.884 . 6.000 3.933 3.848 4.021 . 0 0 "[ . 1]" 1
3246 1 31 TYR H 1 33 ALA MB 3.503 . 6.000 4.582 4.491 4.700 . 0 0 "[ . 1]" 1
3247 2 31 TYR H 2 33 ALA MB 3.503 . 6.000 4.582 4.496 4.697 . 0 0 "[ . 1]" 1
3248 1 42 ALA HA 1 44 GLU H 2.864 2.556 3.172 3.262 3.227 3.301 0.129 7 0 "[ . 1]" 1
3249 2 42 ALA HA 2 44 GLU H 2.864 2.556 3.172 3.262 3.228 3.300 0.128 7 0 "[ . 1]" 1
3250 1 20 MET HG3 1 25 LYS H 4.072 3.586 4.558 3.778 3.687 3.892 . 0 0 "[ . 1]" 1
3251 2 20 MET HG3 2 25 LYS H 4.072 3.586 4.558 3.778 3.691 3.891 . 0 0 "[ . 1]" 1
3252 1 25 LYS H 1 25 LYS HE3 4.267 3.833 4.701 4.659 4.532 4.858 0.157 10 0 "[ . 1]" 1
3253 2 25 LYS H 2 25 LYS HE3 4.267 3.833 4.701 4.657 4.534 4.860 0.159 10 0 "[ . 1]" 1
3254 1 22 LYS QG 1 25 LYS H 3.493 3.080 3.906 3.689 3.678 3.706 . 0 0 "[ . 1]" 1
3255 1 14 ALA MB 2 25 LYS H 3.493 3.080 3.906 3.689 3.674 3.704 . 0 0 "[ . 1]" 1
3256 1 25 LYS H 1 26 THR MG 4.576 3.730 5.422 5.252 5.186 5.302 . 0 0 "[ . 1]" 1
3257 2 25 LYS H 2 26 THR MG 4.576 3.730 5.422 5.253 5.187 5.301 . 0 0 "[ . 1]" 1
3258 1 25 LYS H 2 47 ILE MG 2.818 2.394 3.242 3.408 3.391 3.439 0.197 1 0 "[ . 1]" 1
3259 1 47 ILE MG 2 25 LYS H 2.818 2.394 3.242 3.407 3.391 3.437 0.195 1 0 "[ . 1]" 1
3260 1 22 LYS HA 1 25 LYS H 3.140 2.792 3.488 3.377 3.352 3.435 . 0 0 "[ . 1]" 1
3261 2 22 LYS HA 2 25 LYS H 3.140 2.792 3.488 3.376 3.350 3.432 . 0 0 "[ . 1]" 1
3262 1 22 LYS HA 1 25 LYS H 3.137 2.787 3.487 3.323 3.304 3.355 . 0 0 "[ . 1]" 1
3263 2 22 LYS HA 2 25 LYS H 3.137 2.787 3.487 3.323 3.301 3.355 . 0 0 "[ . 1]" 1
3264 1 20 MET ME 1 25 LYS H 2.978 2.623 3.333 3.090 3.004 3.379 0.046 8 0 "[ . 1]" 1
3265 1 20 MET ME 2 44 GLU H 2.978 2.623 3.333 3.090 3.002 3.383 0.050 8 0 "[ . 1]" 1
3266 1 21 ASP HA 1 25 LYS H 4.957 4.232 5.682 4.568 4.502 4.697 . 0 0 "[ . 1]" 1
3267 2 21 ASP HA 2 25 LYS H 4.957 4.232 5.682 4.569 4.505 4.697 . 0 0 "[ . 1]" 1
3268 1 25 LYS H 1 25 LYS HD3 3.783 3.359 4.207 4.259 4.238 4.284 0.077 7 0 "[ . 1]" 1
3269 1 14 ALA MB 2 25 LYS H 3.783 3.359 4.207 4.259 4.233 4.280 0.073 7 0 "[ . 1]" 1
3270 1 31 TYR HA 1 34 LYS H 2.478 2.225 2.731 2.700 2.661 2.735 0.004 2 0 "[ . 1]" 1
3271 2 31 TYR HA 2 34 LYS H 2.478 2.225 2.731 2.699 2.660 2.736 0.005 2 0 "[ . 1]" 1
3272 1 41 GLN HB2 1 41 GLN HE22 3.574 3.219 3.929 3.583 3.539 3.629 . 0 0 "[ . 1]" 1
3273 2 41 GLN HB2 2 41 GLN HE22 3.574 3.219 3.929 3.584 3.545 3.630 . 0 0 "[ . 1]" 1
3274 1 38 GLN HG2 1 41 GLN HE22 4.608 4.082 5.134 4.777 4.533 5.028 . 0 0 "[ . 1]" 1
3275 2 38 GLN HG2 2 41 GLN HE22 4.608 4.082 5.134 4.773 4.544 5.029 . 0 0 "[ . 1]" 1
3276 1 41 GLN HE22 1 41 GLN QG 2.914 2.688 3.140 3.130 3.098 3.190 0.050 10 0 "[ . 1]" 1
3277 2 41 GLN HE22 2 41 GLN QG 2.914 2.688 3.140 3.131 3.100 3.190 0.050 10 0 "[ . 1]" 1
3278 1 38 GLN QB 1 41 GLN HE22 4.620 . 6.000 3.700 3.552 3.864 . 0 0 "[ . 1]" 1
3279 2 38 GLN QB 2 41 GLN HE22 4.620 . 6.000 3.701 3.551 3.864 . 0 0 "[ . 1]" 1
3280 1 37 LEU MD2 1 41 GLN HE22 3.274 2.748 3.800 3.224 2.713 3.414 0.035 10 0 "[ . 1]" 1
3281 2 37 LEU MD2 2 41 GLN HE22 3.274 2.748 3.800 3.224 2.720 3.416 0.028 10 0 "[ . 1]" 1
3282 1 36 ASN H 1 36 ASN HB2 2.788 2.520 3.056 3.222 3.174 3.279 0.223 8 0 "[ . 1]" 1
3283 2 36 ASN H 2 36 ASN HB2 2.788 2.520 3.056 3.224 3.176 3.275 0.219 8 0 "[ . 1]" 1
3284 1 35 ASN HB2 1 36 ASN H 3.146 2.852 3.440 3.384 3.355 3.413 . 0 0 "[ . 1]" 1
3285 2 35 ASN HB2 2 36 ASN H 3.146 2.852 3.440 3.382 3.361 3.406 . 0 0 "[ . 1]" 1
3286 1 35 ASN HB3 1 36 ASN H 4.414 3.886 4.942 4.123 4.094 4.149 . 0 0 "[ . 1]" 1
3287 2 35 ASN HB3 2 36 ASN H 4.414 3.886 4.942 4.121 4.097 4.145 . 0 0 "[ . 1]" 1
3288 1 34 LYS HA 1 36 ASN H 2.980 2.641 3.319 3.497 3.453 3.536 0.217 3 0 "[ . 1]" 1
3289 2 34 LYS HA 2 36 ASN H 2.980 2.641 3.319 3.498 3.454 3.543 0.224 3 0 "[ . 1]" 1
3290 1 34 LYS QB 1 36 ASN H 4.001 3.578 4.424 4.151 4.093 4.204 . 0 0 "[ . 1]" 1
3291 2 34 LYS QB 2 36 ASN H 4.001 3.578 4.424 4.151 4.093 4.204 . 0 0 "[ . 1]" 1
3292 1 49 GLU QB 1 53 LYS H 3.294 2.977 3.611 3.252 3.187 3.330 . 0 0 "[ . 1]" 1
3293 2 49 GLU QB 2 53 LYS H 3.294 2.977 3.611 3.252 3.183 3.328 . 0 0 "[ . 1]" 1
3294 1 53 LYS H 1 53 LYS HG2 4.150 3.711 4.589 4.266 4.217 4.329 . 0 0 "[ . 1]" 1
3295 2 53 LYS H 2 53 LYS HG2 4.150 3.711 4.589 4.266 4.220 4.325 . 0 0 "[ . 1]" 1
3296 1 53 LYS H 1 53 LYS QE 5.344 . 6.000 4.320 3.730 4.570 . 0 0 "[ . 1]" 1
3297 1 34 LYS QE 2 55 ASN HD22 5.344 . 6.000 4.317 3.734 4.564 . 0 0 "[ . 1]" 1
3298 1 53 LYS H 1 53 LYS QD 4.477 3.994 4.960 4.166 4.006 4.427 . 0 0 "[ . 1]" 1
3299 1 53 LYS QD 2 53 LYS H 4.477 3.994 4.960 4.166 4.003 4.427 . 0 0 "[ . 1]" 1
3300 1 53 LYS H 1 54 ARG HB3 4.695 4.006 5.384 4.207 4.011 4.280 . 0 0 "[ . 1]" 1
3301 2 53 LYS H 2 54 ARG HB3 4.695 4.006 5.384 4.208 3.999 4.283 0.007 5 0 "[ . 1]" 1
3302 1 52 GLN HA 1 52 GLN HE22 5.283 4.600 5.966 4.893 4.639 5.184 . 0 0 "[ . 1]" 1
3303 1 24 LEU HA 2 52 GLN HE22 5.283 4.600 5.966 4.893 4.642 5.186 . 0 0 "[ . 1]" 1
3304 1 40 THR MG 1 46 ALA H 3.482 . 6.000 4.851 4.727 5.003 . 0 0 "[ . 1]" 1
3305 2 40 THR MG 2 46 ALA H 3.482 . 6.000 4.850 4.727 5.004 . 0 0 "[ . 1]" 1
3306 1 15 VAL H 1 15 VAL MG1 2.533 . 6.000 3.501 3.482 3.543 . 0 0 "[ . 1]" 1
3307 1 15 VAL MG1 2 19 TYR H 2.533 . 6.000 3.500 3.480 3.539 . 0 0 "[ . 1]" 1
3308 1 18 ILE H 1 18 ILE MG 2.305 . 2.674 2.361 2.315 2.401 . 0 0 "[ . 1]" 1
3309 2 18 ILE H 2 18 ILE MG 2.305 . 2.674 2.361 2.313 2.399 . 0 0 "[ . 1]" 1
3310 1 20 MET H 2 15 VAL MG1 2.619 . 6.000 3.464 3.426 3.497 . 0 0 "[ . 1]" 1
3311 1 15 VAL MG1 2 20 MET H 2.619 . 6.000 3.465 3.430 3.496 . 0 0 "[ . 1]" 1
3312 1 17 GLY H 1 18 ILE MG 1.879 . 6.000 2.341 2.286 2.390 . 0 0 "[ . 1]" 1
3313 2 17 GLY H 2 18 ILE MG 1.879 . 6.000 2.341 2.285 2.386 . 0 0 "[ . 1]" 1
3314 1 11 LYS H 1 11 LYS QB 2.564 . 6.000 2.027 1.943 2.083 . 0 0 "[ . 1]" 1
3315 2 11 LYS H 2 11 LYS QB 2.564 . 6.000 2.027 1.938 2.090 . 0 0 "[ . 1]" 1
3316 1 20 MET H 1 20 MET HB3 2.014 . 6.000 2.313 2.206 2.466 . 0 0 "[ . 1]" 1
3317 2 20 MET H 2 20 MET HB3 2.014 . 6.000 2.312 2.208 2.467 . 0 0 "[ . 1]" 1
3318 1 48 LYS H 1 50 TYR QB 4.027 3.531 4.523 3.687 3.655 3.726 . 0 0 "[ . 1]" 1
3319 1 50 TYR QB 2 49 GLU H 4.027 3.531 4.523 3.685 3.652 3.719 . 0 0 "[ . 1]" 1
3320 1 50 TYR H 1 50 TYR QD 3.519 3.156 3.882 3.948 3.933 3.961 0.079 5 0 "[ . 1]" 1
3321 1 50 TYR QD 2 50 TYR H 3.519 3.156 3.882 3.948 3.934 3.962 0.080 5 0 "[ . 1]" 1
3322 1 37 LEU H 1 41 GLN HE21 3.934 . 6.000 6.030 5.888 6.261 0.261 10 0 "[ . 1]" 1
3323 2 37 LEU H 2 41 GLN HE21 3.934 . 6.000 6.028 5.891 6.267 0.267 10 0 "[ . 1]" 1
3324 1 15 VAL H 2 19 TYR QE 3.333 . 6.000 4.516 4.465 4.550 . 0 0 "[ . 1]" 1
3325 1 19 TYR QE 2 15 VAL H 3.333 . 6.000 4.516 4.460 4.558 . 0 0 "[ . 1]" 1
3326 1 47 ILE H 1 50 TYR QD 4.070 3.470 4.670 4.152 4.077 4.213 . 0 0 "[ . 1]" 1
3327 1 50 TYR QD 2 47 ILE H 4.070 3.470 4.670 4.152 4.083 4.207 . 0 0 "[ . 1]" 1
3328 1 14 ALA H 2 19 TYR QD 3.521 . 6.000 4.201 4.139 4.249 . 0 0 "[ . 1]" 1
3329 1 19 TYR QD 2 14 ALA H 3.521 . 6.000 4.200 4.143 4.245 . 0 0 "[ . 1]" 1
3330 1 43 ILE H 2 50 TYR QE 4.209 3.636 4.782 4.752 4.713 4.785 0.003 1 0 "[ . 1]" 1
3331 1 50 TYR QE 2 43 ILE H 4.209 3.636 4.782 4.749 4.701 4.786 0.004 1 0 "[ . 1]" 1
3332 1 46 ALA H 2 50 TYR QE 3.796 3.243 4.349 3.956 3.910 4.003 . 0 0 "[ . 1]" 1
3333 1 50 TYR QE 2 46 ALA H 3.796 3.243 4.349 3.954 3.916 4.000 . 0 0 "[ . 1]" 1
3334 1 22 LYS H 1 23 ASP H 2.582 2.276 2.888 2.466 2.400 2.530 . 0 0 "[ . 1]" 1
3335 2 22 LYS H 2 23 ASP H 2.582 2.276 2.888 2.467 2.404 2.540 . 0 0 "[ . 1]" 1
3336 1 14 ALA H 1 15 VAL H 3.274 2.946 3.602 3.574 3.552 3.614 0.012 10 0 "[ . 1]" 1
3337 2 14 ALA H 2 15 VAL H 3.274 2.946 3.602 3.575 3.554 3.614 0.012 10 0 "[ . 1]" 1
3338 1 14 ALA H 2 20 MET H 3.075 2.702 3.448 3.353 3.222 3.469 0.021 8 0 "[ . 1]" 1
3339 1 20 MET H 2 14 ALA H 3.075 2.702 3.448 3.349 3.219 3.458 0.010 8 0 "[ . 1]" 1
3340 1 48 LYS H 1 50 TYR H 2.935 2.542 3.328 2.545 2.471 2.640 0.071 8 0 "[ . 1]" 1
3341 2 48 LYS H 2 50 TYR H 2.935 2.542 3.328 2.543 2.471 2.634 0.071 8 0 "[ . 1]" 1
3342 1 23 ASP H 1 25 LYS H 3.201 2.825 3.577 3.640 3.619 3.663 0.086 5 0 "[ . 1]" 1
3343 2 23 ASP H 2 25 LYS H 3.201 2.825 3.577 3.639 3.621 3.667 0.090 5 0 "[ . 1]" 1
3344 1 24 LEU H 1 25 LYS H 2.174 . 2.407 2.279 2.241 2.309 . 0 0 "[ . 1]" 1
3345 2 24 LEU H 2 25 LYS H 2.174 . 2.407 2.278 2.242 2.310 . 0 0 "[ . 1]" 1
3346 1 43 ILE H 1 47 ILE H 3.807 3.377 4.237 4.173 4.123 4.237 0.000 10 0 "[ . 1]" 1
3347 2 43 ILE H 2 47 ILE H 3.807 3.377 4.237 4.174 4.122 4.242 0.005 10 0 "[ . 1]" 1
3348 1 54 ARG H 1 54 ARG HG3 3.916 3.468 4.364 3.911 3.840 4.007 . 0 0 "[ . 1]" 1
3349 2 54 ARG H 2 54 ARG HG3 3.916 3.468 4.364 3.912 3.839 4.008 . 0 0 "[ . 1]" 1
3350 1 31 TYR QE 2 54 ARG HG2 2.587 2.281 2.893 2.524 2.283 2.828 . 0 0 "[ . 1]" 1
3351 1 54 ARG HG2 2 31 TYR QE 2.587 2.281 2.893 2.527 2.303 2.822 . 0 0 "[ . 1]" 1
3352 1 53 LYS HG3 1 54 ARG H 3.549 3.210 3.888 4.146 4.098 4.186 0.298 7 0 "[ . 1]" 1
3353 2 53 LYS HG3 2 54 ARG H 3.549 3.210 3.888 4.146 4.101 4.189 0.301 7 0 "[ . 1]" 1
3354 1 53 LYS HG2 1 54 ARG H 4.324 3.878 4.770 3.909 3.745 4.044 0.133 5 0 "[ . 1]" 1
3355 2 53 LYS HG2 2 54 ARG H 4.324 3.878 4.770 3.909 3.752 4.041 0.126 5 0 "[ . 1]" 1
3356 1 52 GLN HA 1 54 ARG H 2.743 2.450 3.036 3.119 3.060 3.163 0.127 5 0 "[ . 1]" 1
3357 2 52 GLN HA 2 54 ARG H 2.743 2.450 3.036 3.119 3.062 3.163 0.127 5 0 "[ . 1]" 1
3358 1 34 LYS HG3 1 35 ASN HD21 4.631 . 6.000 4.078 4.015 4.118 . 0 0 "[ . 1]" 1
3359 2 34 LYS HG3 2 35 ASN HD21 4.631 . 6.000 4.080 4.005 4.126 . 0 0 "[ . 1]" 1
3360 1 27 ARG H 1 27 ARG HE 5.316 4.741 5.891 4.726 4.661 4.889 0.080 2 0 "[ . 1]" 1
3361 1 31 TYR H 2 56 GLY H 5.316 4.741 5.891 4.728 4.655 4.899 0.086 2 0 "[ . 1]" 1
3362 1 44 GLU H 1 46 ALA H 3.722 . 6.000 2.515 2.433 2.590 . 0 0 "[ . 1]" 1
3363 2 44 GLU H 2 46 ALA H 3.722 . 6.000 2.516 2.437 2.596 . 0 0 "[ . 1]" 1
3364 1 21 ASP HB3 1 25 LYS H 3.905 3.526 4.284 3.985 3.841 4.277 . 0 0 "[ . 1]" 1
3365 2 21 ASP HB3 2 25 LYS H 3.905 3.526 4.284 3.983 3.850 4.270 . 0 0 "[ . 1]" 1
3366 1 42 ALA H 1 43 ILE MG 4.344 3.572 5.116 4.936 4.910 4.960 . 0 0 "[ . 1]" 1
3367 1 18 ILE MD 2 42 ALA H 4.344 3.572 5.116 4.937 4.911 4.957 . 0 0 "[ . 1]" 1
3368 1 46 ALA HA 1 48 LYS H 3.766 3.272 4.260 3.649 3.620 3.686 . 0 0 "[ . 1]" 1
3369 2 46 ALA HA 2 48 LYS H 3.766 3.272 4.260 3.648 3.624 3.685 . 0 0 "[ . 1]" 1
3370 1 38 GLN HG3 1 41 GLN H 4.219 3.816 4.622 4.671 4.640 4.702 0.080 10 0 "[ . 1]" 1
3371 2 38 GLN HG3 2 41 GLN H 4.219 3.816 4.622 4.672 4.640 4.698 0.076 10 0 "[ . 1]" 1
3372 1 20 MET ME 1 29 LYS H 3.295 . 6.000 4.401 4.372 4.427 . 0 0 "[ . 1]" 1
3373 2 20 MET ME 2 29 LYS H 3.295 . 6.000 4.401 4.374 4.426 . 0 0 "[ . 1]" 1
3374 1 14 ALA H 1 15 VAL MG2 2.840 . 6.000 3.731 3.712 3.763 . 0 0 "[ . 1]" 1
3375 1 18 ILE MD 2 16 PHE H 2.840 . 6.000 3.732 3.716 3.764 . 0 0 "[ . 1]" 1
3376 1 18 ILE HG13 1 20 MET H 2.979 2.508 3.450 2.678 2.542 2.789 . 0 0 "[ . 1]" 1
3377 1 24 LEU QD 2 48 LYS H 2.979 2.508 3.450 2.680 2.537 2.790 . 0 0 "[ . 1]" 1
3378 1 18 ILE MG 1 20 MET H 3.028 . 6.000 4.158 4.106 4.211 . 0 0 "[ . 1]" 1
3379 1 15 VAL MG1 2 20 MET H 3.028 . 6.000 4.160 4.107 4.215 . 0 0 "[ . 1]" 1
3380 1 28 LEU MD2 1 43 ILE H 3.076 2.659 3.493 3.172 3.144 3.195 . 0 0 "[ . 1]" 1
3381 2 28 LEU MD2 2 43 ILE H 3.076 2.659 3.493 3.172 3.143 3.199 . 0 0 "[ . 1]" 1
3382 1 28 LEU MD1 1 43 ILE H 2.325 . 6.000 3.094 3.028 3.176 . 0 0 "[ . 1]" 1
3383 2 28 LEU MD1 2 43 ILE H 2.325 . 6.000 3.095 3.030 3.182 . 0 0 "[ . 1]" 1
3384 1 11 LYS H 1 12 GLN HB2 3.011 2.795 3.227 3.157 2.752 3.378 0.151 3 0 "[ . 1]" 1
3385 2 11 LYS H 2 12 GLN HB2 3.011 2.795 3.227 3.161 2.764 3.375 0.148 3 0 "[ . 1]" 1
3386 1 27 ARG HE 1 30 VAL MG2 4.664 3.983 5.345 4.780 4.565 5.027 . 0 0 "[ . 1]" 1
3387 1 51 LEU HB3 2 27 ARG HE 4.664 3.983 5.345 4.781 4.555 5.039 . 0 0 "[ . 1]" 1
3388 1 24 LEU QD 1 27 ARG HE 3.858 . 6.000 5.325 4.959 5.843 . 0 0 "[ . 1]" 1
3389 2 24 LEU QD 2 27 ARG HE 3.858 . 6.000 5.327 4.964 5.837 . 0 0 "[ . 1]" 1
3390 1 37 LEU HB3 1 39 LEU H 4.064 3.438 4.690 4.339 4.304 4.413 . 0 0 "[ . 1]" 1
3391 2 37 LEU HB3 2 39 LEU H 4.064 3.438 4.690 4.338 4.301 4.418 . 0 0 "[ . 1]" 1
3392 1 21 ASP H 1 21 ASP HB3 3.242 2.881 3.603 2.971 2.918 3.097 . 0 0 "[ . 1]" 1
3393 1 44 GLU HG2 2 21 ASP H 3.242 2.881 3.603 2.968 2.909 3.094 . 0 0 "[ . 1]" 1
3394 1 21 ASP H 1 24 LEU HB3 4.177 3.630 4.724 3.762 3.631 3.855 . 0 0 "[ . 1]" 1
3395 1 13 LYS QB 2 21 ASP H 4.177 3.630 4.724 3.762 3.628 3.861 0.002 10 0 "[ . 1]" 1
3396 1 18 ILE MD 1 21 ASP H 4.486 3.650 5.322 5.132 5.082 5.231 . 0 0 "[ . 1]" 1
3397 1 43 ILE MG 2 21 ASP H 4.486 3.650 5.322 5.132 5.084 5.233 . 0 0 "[ . 1]" 1
3398 1 14 ALA H 2 20 MET HB2 5.297 4.317 6.277 4.747 4.694 4.837 . 0 0 "[ . 1]" 1
3399 1 20 MET HB2 2 14 ALA H 5.297 4.317 6.277 4.745 4.691 4.834 . 0 0 "[ . 1]" 1
3400 1 14 ALA H 2 20 MET HB3 4.278 3.652 4.904 4.190 3.954 4.376 . 0 0 "[ . 1]" 1
3401 1 20 MET HB3 2 14 ALA H 4.278 3.652 4.904 4.194 3.938 4.403 . 0 0 "[ . 1]" 1
3402 1 14 ALA H 1 15 VAL QG 4.053 3.127 4.979 4.646 4.578 4.737 . 0 0 "[ . 1]" 1
3403 2 14 ALA H 2 15 VAL QG 4.053 3.127 4.979 4.644 4.575 4.738 . 0 0 "[ . 1]" 1
3404 1 19 TYR H 1 20 MET ME 5.819 4.793 6.845 6.245 6.176 6.304 . 0 0 "[ . 1]" 1
3405 1 20 MET ME 2 19 TYR H 5.819 4.793 6.845 6.243 6.176 6.302 . 0 0 "[ . 1]" 1
3406 1 18 ILE MD 1 19 TYR H 2.678 . 6.000 3.325 3.248 3.426 . 0 0 "[ . 1]" 1
3407 2 18 ILE MD 2 19 TYR H 2.678 . 6.000 3.325 3.255 3.427 . 0 0 "[ . 1]" 1
3408 1 24 LEU H 2 43 ILE MG 4.190 . 6.000 6.177 6.129 6.280 0.280 5 0 "[ . 1]" 1
3409 1 43 ILE MG 2 24 LEU H 4.190 . 6.000 6.176 6.126 6.272 0.272 5 0 "[ . 1]" 1
3410 1 13 LYS H 1 14 ALA H 4.428 3.851 5.005 4.155 4.057 4.264 . 0 0 "[ . 1]" 1
3411 1 22 LYS H 2 13 LYS H 4.428 3.851 5.005 4.153 4.045 4.272 . 0 0 "[ . 1]" 1
3412 1 39 LEU HB2 1 42 ALA H 4.041 3.575 4.507 4.363 4.323 4.401 . 0 0 "[ . 1]" 1
3413 2 39 LEU HB2 2 42 ALA H 4.041 3.575 4.507 4.363 4.321 4.401 . 0 0 "[ . 1]" 1
3414 1 11 LYS QG 1 13 LYS H 3.722 3.400 4.044 3.911 3.668 4.099 0.055 7 0 "[ . 1]" 1
3415 2 11 LYS QG 2 13 LYS H 3.722 3.400 4.044 3.910 3.660 4.093 0.049 7 0 "[ . 1]" 1
3416 1 28 LEU MD2 1 42 ALA H 3.016 . 6.000 4.113 4.086 4.135 . 0 0 "[ . 1]" 1
3417 2 28 LEU MD2 2 42 ALA H 3.016 . 6.000 4.113 4.088 4.137 . 0 0 "[ . 1]" 1
3418 1 13 LYS H 1 15 VAL MG1 6.346 3.749 8.943 8.373 8.271 8.431 . 0 0 "[ . 1]" 1
3419 1 18 ILE MG 2 13 LYS H 6.346 3.749 8.943 8.371 8.264 8.430 . 0 0 "[ . 1]" 1
3420 1 50 TYR H 1 50 TYR QE 4.501 . 6.000 5.626 5.549 5.677 . 0 0 "[ . 1]" 1
3421 1 50 TYR QE 2 50 TYR H 4.501 . 6.000 5.626 5.551 5.677 . 0 0 "[ . 1]" 1
3422 1 50 TYR H 1 51 LEU HG 3.745 . 6.000 5.081 4.968 5.203 . 0 0 "[ . 1]" 1
3423 2 50 TYR H 2 51 LEU HG 3.745 . 6.000 5.080 4.970 5.202 . 0 0 "[ . 1]" 1
3424 1 46 ALA MB 1 50 TYR H 2.987 . 6.000 3.630 3.611 3.641 . 0 0 "[ . 1]" 1
3425 1 24 LEU QD 2 50 TYR H 2.987 . 6.000 3.633 3.620 3.646 . 0 0 "[ . 1]" 1
3426 1 27 ARG H 1 29 LYS H 3.489 3.033 3.945 3.494 3.438 3.544 . 0 0 "[ . 1]" 1
3427 2 27 ARG H 2 29 LYS H 3.489 3.033 3.945 3.491 3.436 3.538 . 0 0 "[ . 1]" 1
3428 1 24 LEU HA 1 28 LEU H 3.523 3.068 3.978 3.369 3.357 3.391 . 0 0 "[ . 1]" 1
3429 2 24 LEU HA 2 28 LEU H 3.523 3.068 3.978 3.368 3.357 3.391 . 0 0 "[ . 1]" 1
3430 1 29 LYS H 1 29 LYS QE 6.018 5.334 6.702 5.577 5.513 5.632 . 0 0 "[ . 1]" 1
3431 2 29 LYS H 2 29 LYS QE 6.018 5.334 6.702 5.578 5.515 5.633 . 0 0 "[ . 1]" 1
3432 1 29 LYS QE 1 31 TYR H 4.458 . 6.000 5.560 5.505 5.624 . 0 0 "[ . 1]" 1
3433 2 29 LYS QE 2 31 TYR H 4.458 . 6.000 5.560 5.506 5.621 . 0 0 "[ . 1]" 1
3434 1 28 LEU MD2 1 29 LYS H 2.851 . 6.000 3.469 3.403 3.535 . 0 0 "[ . 1]" 1
3435 2 28 LEU MD2 2 29 LYS H 2.851 . 6.000 3.470 3.400 3.537 . 0 0 "[ . 1]" 1
3436 1 14 ALA H 1 15 VAL H 3.796 3.349 4.243 3.956 3.944 3.966 . 0 0 "[ . 1]" 1
3437 2 14 ALA H 2 15 VAL H 3.796 3.349 4.243 3.958 3.946 3.972 . 0 0 "[ . 1]" 1
3438 1 24 LEU HA 1 27 ARG H 2.892 2.528 3.256 2.659 2.634 2.672 . 0 0 "[ . 1]" 1
3439 2 24 LEU HA 2 27 ARG H 2.892 2.528 3.256 2.659 2.633 2.671 . 0 0 "[ . 1]" 1
3440 1 22 LYS QE 1 27 ARG H 3.917 . 6.000 5.910 5.697 6.074 0.074 4 0 "[ . 1]" 1
3441 1 48 LYS QE 2 27 ARG H 3.917 . 6.000 5.908 5.699 6.078 0.078 4 0 "[ . 1]" 1
3442 1 13 LYS QE 1 15 VAL H 6.243 5.219 7.267 6.411 6.027 6.614 . 0 0 "[ . 1]" 1
3443 1 19 TYR HB2 2 15 VAL H 6.243 5.219 7.267 6.408 6.021 6.621 . 0 0 "[ . 1]" 1
3444 1 20 MET ME 1 27 ARG H 3.600 3.227 3.973 3.963 3.927 3.989 0.016 9 0 "[ . 1]" 1
3445 2 20 MET ME 2 27 ARG H 3.600 3.227 3.973 3.963 3.926 3.995 0.022 9 0 "[ . 1]" 1
3446 1 13 LYS QB 1 15 VAL H 5.078 4.280 5.876 5.126 5.035 5.245 . 0 0 "[ . 1]" 1
3447 1 25 LYS HD2 2 15 VAL H 5.078 4.280 5.876 5.128 5.046 5.251 . 0 0 "[ . 1]" 1
3448 1 22 LYS QG 1 27 ARG H 3.900 . 6.000 4.534 4.479 4.620 . 0 0 "[ . 1]" 1
3449 2 22 LYS QG 2 27 ARG H 3.900 . 6.000 4.532 4.474 4.619 . 0 0 "[ . 1]" 1
3450 1 28 LEU H 1 30 VAL MG2 3.302 . 6.000 4.828 4.703 4.957 . 0 0 "[ . 1]" 1
3451 1 51 LEU HB3 2 28 LEU H 3.302 . 6.000 4.827 4.701 4.956 . 0 0 "[ . 1]" 1
3452 1 46 ALA MB 1 48 LYS H 2.371 . 6.000 2.802 2.632 2.941 . 0 0 "[ . 1]" 1
3453 1 24 LEU QD 2 48 LYS H 2.371 . 6.000 2.806 2.639 2.937 . 0 0 "[ . 1]" 1
3454 1 44 GLU HG3 1 46 ALA H 3.858 3.420 4.296 4.260 4.227 4.298 0.002 8 0 "[ . 1]" 1
3455 2 44 GLU HG3 2 46 ALA H 3.858 3.420 4.296 4.261 4.233 4.294 . 0 0 "[ . 1]" 1
3456 1 22 LYS QD 1 23 ASP H 3.774 3.398 4.150 3.742 3.548 3.912 . 0 0 "[ . 1]" 1
3457 2 22 LYS QD 2 23 ASP H 3.774 3.398 4.150 3.740 3.547 3.915 . 0 0 "[ . 1]" 1
3458 1 18 ILE H 1 18 ILE HG13 2.263 . 2.579 2.140 2.124 2.155 . 0 0 "[ . 1]" 1
3459 2 18 ILE H 2 18 ILE HG13 2.263 . 2.579 2.142 2.124 2.158 . 0 0 "[ . 1]" 1
3460 1 20 MET H 2 13 LYS HA 4.102 3.555 4.649 4.616 4.428 4.701 0.052 8 0 "[ . 1]" 1
3461 1 13 LYS HA 2 20 MET H 4.102 3.555 4.649 4.617 4.435 4.704 0.055 8 0 "[ . 1]" 1
3462 1 19 TYR HB2 1 20 MET H 4.424 3.917 4.931 4.119 4.074 4.149 . 0 0 "[ . 1]" 1
3463 1 16 PHE HB3 2 20 MET H 4.424 3.917 4.931 4.119 4.074 4.149 . 0 0 "[ . 1]" 1
3464 1 18 ILE H 1 18 ILE MD 2.372 2.042 2.702 2.805 2.760 2.825 0.123 1 0 "[ . 1]" 1
3465 2 18 ILE H 2 18 ILE MD 2.372 2.042 2.702 2.803 2.760 2.822 0.120 1 0 "[ . 1]" 1
3466 1 47 ILE H 1 50 TYR QD 5.832 4.741 6.923 4.980 4.952 5.008 . 0 0 "[ . 1]" 1
3467 1 50 TYR QD 2 47 ILE H 5.832 4.741 6.923 4.979 4.947 5.006 . 0 0 "[ . 1]" 1
3468 1 43 ILE HA 1 47 ILE H 3.458 3.020 3.896 3.545 3.517 3.580 . 0 0 "[ . 1]" 1
3469 2 43 ILE HA 2 47 ILE H 3.458 3.020 3.896 3.543 3.519 3.576 . 0 0 "[ . 1]" 1
3470 1 20 MET H 1 20 MET ME 3.222 2.873 3.571 3.703 3.671 3.725 0.154 1 0 "[ . 1]" 1
3471 1 20 MET ME 2 47 ILE H 3.222 2.873 3.571 3.704 3.670 3.726 0.155 1 0 "[ . 1]" 1
3472 1 46 ALA MB 1 47 ILE H 2.013 . 2.316 2.184 2.143 2.224 . 0 0 "[ . 1]" 1
3473 1 46 ALA MB 2 47 ILE H 2.013 . 2.316 2.184 2.147 2.226 . 0 0 "[ . 1]" 1
3474 1 20 MET H 2 15 VAL QG 2.971 . 6.000 3.772 3.738 3.822 . 0 0 "[ . 1]" 1
3475 1 15 VAL QG 2 20 MET H 2.971 . 6.000 3.773 3.743 3.821 . 0 0 "[ . 1]" 1
3476 1 37 LEU H 1 38 GLN H 4.353 3.865 4.841 4.386 4.355 4.406 . 0 0 "[ . 1]" 1
3477 2 37 LEU H 2 38 GLN H 4.353 3.865 4.841 4.386 4.354 4.402 . 0 0 "[ . 1]" 1
3478 1 40 THR HB 1 41 GLN H 2.597 2.261 2.933 2.252 2.230 2.264 0.031 4 0 "[ . 1]" 1
3479 2 40 THR HB 2 41 GLN H 2.597 2.261 2.933 2.252 2.238 2.267 0.023 4 0 "[ . 1]" 1
3480 1 28 LEU MD2 1 41 GLN H 3.872 . 6.000 5.056 5.029 5.080 . 0 0 "[ . 1]" 1
3481 1 18 ILE HG13 2 41 GLN H 3.872 . 6.000 5.056 5.029 5.083 . 0 0 "[ . 1]" 1
3482 1 41 GLN H 1 43 ILE MD 3.189 . 6.000 4.951 4.889 4.984 . 0 0 "[ . 1]" 1
3483 2 41 GLN H 2 43 ILE MD 3.189 . 6.000 4.952 4.881 4.986 . 0 0 "[ . 1]" 1
3484 1 22 LYS QG 1 25 LYS H 3.962 3.515 4.409 4.145 4.122 4.174 . 0 0 "[ . 1]" 1
3485 2 22 LYS QG 2 25 LYS H 3.962 3.515 4.409 4.144 4.119 4.173 . 0 0 "[ . 1]" 1
3486 1 45 GLU H 1 47 ILE H 4.383 3.774 4.992 3.994 3.963 4.043 . 0 0 "[ . 1]" 1
3487 2 45 GLU H 2 47 ILE H 4.383 3.774 4.992 3.996 3.963 4.047 . 0 0 "[ . 1]" 1
3488 1 31 TYR QE 1 45 GLU H 7.430 5.646 9.214 5.595 5.517 5.661 0.129 10 0 "[ . 1]" 1
3489 2 31 TYR QE 2 45 GLU H 7.430 5.646 9.214 5.595 5.525 5.664 0.121 10 0 "[ . 1]" 1
3490 1 45 GLU H 1 48 LYS HB2 4.195 3.628 4.762 4.810 4.755 4.848 0.086 6 0 "[ . 1]" 1
3491 1 20 MET ME 2 45 GLU H 4.195 3.628 4.762 4.812 4.765 4.849 0.087 6 0 "[ . 1]" 1
3492 1 44 GLU HB2 1 45 GLU H 2.690 . 6.000 2.179 2.084 2.243 . 0 0 "[ . 1]" 1
3493 2 44 GLU HB2 2 45 GLU H 2.690 . 6.000 2.179 2.085 2.241 . 0 0 "[ . 1]" 1
3494 1 28 LEU MD2 1 45 GLU H 3.044 . 6.000 3.920 3.780 4.017 . 0 0 "[ . 1]" 1
3495 1 24 LEU QD 2 45 GLU H 3.044 . 6.000 3.922 3.783 4.023 . 0 0 "[ . 1]" 1
3496 1 43 ILE MD 1 45 GLU H 3.093 . 6.000 4.412 4.383 4.485 . 0 0 "[ . 1]" 1
3497 2 43 ILE MD 2 45 GLU H 3.093 . 6.000 4.414 4.385 4.488 . 0 0 "[ . 1]" 1
3498 1 44 GLU H 1 47 ILE H 5.002 4.155 5.849 4.455 4.423 4.480 . 0 0 "[ . 1]" 1
3499 2 44 GLU H 2 47 ILE H 5.002 4.155 5.849 4.455 4.422 4.483 . 0 0 "[ . 1]" 1
3500 1 43 ILE H 1 44 GLU H 2.399 2.112 2.686 2.450 2.433 2.471 . 0 0 "[ . 1]" 1
3501 2 43 ILE H 2 44 GLU H 2.399 2.112 2.686 2.450 2.431 2.478 . 0 0 "[ . 1]" 1
3502 1 42 ALA HA 1 44 GLU H 3.929 3.418 4.440 4.240 4.204 4.265 . 0 0 "[ . 1]" 1
3503 2 42 ALA HA 2 44 GLU H 3.929 3.418 4.440 4.240 4.195 4.262 . 0 0 "[ . 1]" 1
3504 1 41 GLN QG 1 44 GLU H 4.365 3.910 4.820 4.819 4.759 4.868 0.048 4 0 "[ . 1]" 1
3505 2 41 GLN QG 2 44 GLU H 4.365 3.910 4.820 4.818 4.757 4.866 0.046 4 0 "[ . 1]" 1
3506 1 39 LEU MD1 1 44 GLU H 2.907 . 6.000 3.793 3.698 3.854 . 0 0 "[ . 1]" 1
3507 1 24 LEU QD 2 44 GLU H 2.907 . 6.000 3.793 3.694 3.857 . 0 0 "[ . 1]" 1
3508 1 43 ILE MG 1 49 GLU H 4.588 3.542 5.634 5.331 5.209 5.429 . 0 0 "[ . 1]" 1
3509 2 43 ILE MG 2 49 GLU H 4.588 3.542 5.634 5.329 5.204 5.431 . 0 0 "[ . 1]" 1
3510 1 46 ALA H 1 49 GLU H 4.302 3.703 4.901 3.967 3.888 4.067 . 0 0 "[ . 1]" 1
3511 2 46 ALA H 2 49 GLU H 4.302 3.703 4.901 3.966 3.890 4.064 . 0 0 "[ . 1]" 1
3512 1 49 GLU H 1 50 TYR HA 5.409 4.611 6.207 4.912 4.857 4.986 . 0 0 "[ . 1]" 1
3513 1 50 TYR HA 2 49 GLU H 5.409 4.611 6.207 4.910 4.855 4.982 . 0 0 "[ . 1]" 1
3514 1 49 GLU H 1 50 TYR QB 3.997 3.552 4.442 4.092 3.989 4.232 . 0 0 "[ . 1]" 1
3515 1 50 TYR QB 2 49 GLU H 3.997 3.552 4.442 4.089 3.986 4.220 . 0 0 "[ . 1]" 1
3516 1 44 GLU HG2 1 49 GLU H 7.284 5.799 8.769 7.600 7.401 7.718 . 0 0 "[ . 1]" 1
3517 1 54 ARG HD2 2 49 GLU H 7.284 5.799 8.769 7.600 7.404 7.722 . 0 0 "[ . 1]" 1
3518 1 49 GLU H 1 53 LYS HG2 6.077 5.090 7.064 6.696 6.363 6.941 . 0 0 "[ . 1]" 1
3519 1 53 LYS HG2 2 49 GLU H 6.077 5.090 7.064 6.695 6.367 6.937 . 0 0 "[ . 1]" 1
3520 1 46 ALA MB 1 49 GLU H 3.571 3.036 4.106 4.067 3.955 4.156 0.050 7 0 "[ . 1]" 1
3521 1 24 LEU QD 2 49 GLU H 3.571 3.036 4.106 4.067 3.951 4.156 0.050 7 0 "[ . 1]" 1
3522 1 52 GLN HA 1 53 LYS H 2.714 2.417 3.011 2.735 2.727 2.749 . 0 0 "[ . 1]" 1
3523 2 52 GLN HA 2 53 LYS H 2.714 2.417 3.011 2.735 2.729 2.747 . 0 0 "[ . 1]" 1
3524 1 29 LYS HA 1 32 CYS H 2.769 2.413 3.125 2.687 2.682 2.695 . 0 0 "[ . 1]" 1
3525 2 29 LYS HA 2 32 CYS H 2.769 2.413 3.125 2.687 2.681 2.696 . 0 0 "[ . 1]" 1
3526 1 52 GLN HB3 1 53 LYS H 3.072 2.743 3.401 3.343 3.268 3.430 0.029 10 0 "[ . 1]" 1
3527 2 52 GLN HB3 2 53 LYS H 3.072 2.743 3.401 3.343 3.263 3.428 0.027 10 0 "[ . 1]" 1
3528 1 32 CYS H 1 34 LYS QB 5.238 4.515 5.961 4.755 4.703 4.838 . 0 0 "[ . 1]" 1
3529 1 51 LEU HG 2 32 CYS H 5.238 4.515 5.961 4.754 4.703 4.837 . 0 0 "[ . 1]" 1
3530 1 28 LEU HG 1 32 CYS H 4.049 3.515 4.583 4.593 4.530 4.623 0.040 8 0 "[ . 1]" 1
3531 2 28 LEU HG 2 32 CYS H 4.049 3.515 4.583 4.594 4.529 4.617 0.034 8 0 "[ . 1]" 1
3532 1 51 LEU MD2 1 53 LYS H 5.300 4.569 6.031 4.800 4.705 4.906 . 0 0 "[ . 1]" 1
3533 2 51 LEU MD2 2 53 LYS H 5.300 4.569 6.031 4.799 4.708 4.899 . 0 0 "[ . 1]" 1
3534 1 31 TYR QE 1 37 LEU H 4.704 4.002 5.406 4.379 4.295 4.433 . 0 0 "[ . 1]" 1
3535 2 31 TYR QE 2 37 LEU H 4.704 4.002 5.406 4.380 4.289 4.439 . 0 0 "[ . 1]" 1
3536 1 31 TYR HA 1 37 LEU H 3.906 . 6.000 4.846 4.803 4.865 . 0 0 "[ . 1]" 1
3537 2 31 TYR HA 2 37 LEU H 3.906 . 6.000 4.845 4.802 4.867 . 0 0 "[ . 1]" 1
3538 1 49 GLU QB 1 51 LEU H 4.137 . 6.000 5.019 4.970 5.056 . 0 0 "[ . 1]" 1
3539 1 49 GLU QB 2 51 LEU H 4.137 . 6.000 5.018 4.971 5.058 . 0 0 "[ . 1]" 1
3540 1 33 ALA MB 1 35 ASN HD22 4.342 . 6.000 5.449 5.409 5.508 . 0 0 "[ . 1]" 1
3541 2 33 ALA MB 2 35 ASN HD22 4.342 . 6.000 5.451 5.407 5.513 . 0 0 "[ . 1]" 1
3542 1 37 LEU H 1 37 LEU MD1 2.497 2.120 2.874 2.852 2.704 2.916 0.042 7 0 "[ . 1]" 1
3543 1 28 LEU MD2 2 51 LEU H 2.497 2.120 2.874 2.854 2.705 2.920 0.046 7 0 "[ . 1]" 1
3544 1 31 TYR HB2 1 34 LYS H 5.643 4.828 6.458 4.772 4.736 4.798 0.092 8 0 "[ . 1]" 1
3545 2 31 TYR HB2 2 34 LYS H 5.643 4.828 6.458 4.771 4.734 4.798 0.094 8 0 "[ . 1]" 1
3546 1 32 CYS HB3 1 34 LYS H 5.292 4.695 5.889 4.975 4.693 5.211 0.002 1 0 "[ . 1]" 1
3547 2 32 CYS HB3 2 34 LYS H 5.292 4.695 5.889 4.974 4.689 5.209 0.006 1 0 "[ . 1]" 1
3548 1 33 ALA MB 1 36 ASN H 3.918 3.448 4.388 3.945 3.901 3.984 . 0 0 "[ . 1]" 1
3549 2 33 ALA MB 2 36 ASN H 3.918 3.448 4.388 3.943 3.902 3.982 . 0 0 "[ . 1]" 1
3550 1 30 VAL MG1 1 36 ASN H 3.850 . 6.000 5.529 5.419 5.589 . 0 0 "[ . 1]" 1
3551 2 30 VAL MG1 2 36 ASN H 3.850 . 6.000 5.527 5.427 5.584 . 0 0 "[ . 1]" 1
3552 1 51 LEU H 1 54 ARG H 4.138 3.710 4.566 4.374 4.315 4.397 . 0 0 "[ . 1]" 1
3553 2 51 LEU H 2 54 ARG H 4.138 3.710 4.566 4.374 4.311 4.397 . 0 0 "[ . 1]" 1
3554 1 50 TYR QB 1 54 ARG H 5.830 4.938 6.722 4.961 4.870 5.062 0.068 5 0 "[ . 1]" 1
3555 2 50 TYR QB 2 54 ARG H 5.830 4.938 6.722 4.960 4.868 5.063 0.070 5 0 "[ . 1]" 1
3556 1 53 LYS HG3 1 54 ARG H 3.510 . 6.000 4.369 4.313 4.392 . 0 0 "[ . 1]" 1
3557 2 53 LYS HG3 2 54 ARG H 3.510 . 6.000 4.369 4.315 4.391 . 0 0 "[ . 1]" 1
3558 1 23 ASP H 1 26 THR H 4.958 . 6.000 3.854 3.798 3.907 . 0 0 "[ . 1]" 1
3559 2 23 ASP H 2 26 THR H 4.958 . 6.000 3.855 3.793 3.909 . 0 0 "[ . 1]" 1
3560 1 25 LYS H 1 26 THR H 2.818 . 6.000 2.229 2.190 2.264 . 0 0 "[ . 1]" 1
3561 2 25 LYS H 2 26 THR H 2.818 . 6.000 2.229 2.191 2.267 . 0 0 "[ . 1]" 1
3562 1 20 MET ME 1 26 THR H 3.477 3.119 3.835 4.038 3.895 4.096 0.261 10 0 "[ . 1]" 1
3563 2 20 MET ME 2 26 THR H 3.477 3.119 3.835 4.039 3.896 4.096 0.261 3 0 "[ . 1]" 1
3564 1 40 THR H 1 43 ILE H 5.013 4.082 5.944 4.109 4.091 4.135 . 0 0 "[ . 1]" 1
3565 2 40 THR H 2 43 ILE H 5.013 4.082 5.944 4.109 4.092 4.133 . 0 0 "[ . 1]" 1
3566 1 55 ASN H 2 32 CYS HA 7.182 5.581 8.783 8.547 8.442 8.638 . 0 0 "[ . 1]" 1
3567 1 32 CYS HA 2 55 ASN H 7.182 5.581 8.783 8.548 8.445 8.633 . 0 0 "[ . 1]" 1
3568 1 55 ASN H 1 55 ASN HB2 3.537 3.156 3.918 3.638 3.568 3.719 . 0 0 "[ . 1]" 1
3569 2 55 ASN H 2 55 ASN HB2 3.537 3.156 3.918 3.638 3.574 3.719 . 0 0 "[ . 1]" 1
3570 1 41 GLN HB3 1 43 ILE H 4.219 3.742 4.696 4.467 4.428 4.488 . 0 0 "[ . 1]" 1
3571 2 41 GLN HB3 2 43 ILE H 4.219 3.742 4.696 4.466 4.425 4.491 . 0 0 "[ . 1]" 1
3572 1 51 LEU HG 1 55 ASN H 4.662 4.080 5.244 5.251 5.149 5.383 0.139 5 0 "[ . 1]" 1
3573 2 51 LEU HG 2 55 ASN H 4.662 4.080 5.244 5.252 5.150 5.381 0.137 5 0 "[ . 1]" 1
3574 1 39 LEU MD1 1 43 ILE H 3.350 2.850 3.850 3.360 3.344 3.387 . 0 0 "[ . 1]" 1
3575 2 39 LEU MD1 2 43 ILE H 3.350 2.850 3.850 3.360 3.337 3.386 . 0 0 "[ . 1]" 1
3576 1 28 LEU MD2 1 43 ILE H 4.100 3.366 4.834 3.395 3.369 3.423 . 0 0 "[ . 1]" 1
3577 2 28 LEU MD2 2 43 ILE H 4.100 3.366 4.834 3.395 3.367 3.425 . 0 0 "[ . 1]" 1
3578 1 31 TYR HA 1 35 ASN H 3.311 2.913 3.709 3.296 3.267 3.330 . 0 0 "[ . 1]" 1
3579 2 31 TYR HA 2 35 ASN H 3.311 2.913 3.709 3.295 3.267 3.329 . 0 0 "[ . 1]" 1
3580 1 30 VAL MG1 1 35 ASN H 3.103 . 6.000 4.694 4.560 4.739 . 0 0 "[ . 1]" 1
3581 2 30 VAL MG1 2 35 ASN H 3.103 . 6.000 4.693 4.568 4.735 . 0 0 "[ . 1]" 1
3582 1 55 ASN HD21 1 56 GLY H 3.744 3.289 4.199 3.521 3.410 3.668 . 0 0 "[ . 1]" 1
3583 1 31 TYR QE 2 56 GLY H 3.744 3.289 4.199 3.525 3.423 3.650 . 0 0 "[ . 1]" 1
3584 1 52 GLN HA 1 56 GLY H 3.514 . 6.000 4.900 4.604 5.134 . 0 0 "[ . 1]" 1
3585 1 31 TYR HA 2 56 GLY H 3.514 . 6.000 4.902 4.595 5.139 . 0 0 "[ . 1]" 1
3586 1 51 LEU HB2 1 56 GLY H 4.049 3.590 4.508 4.577 4.546 4.618 0.110 10 0 "[ . 1]" 1
3587 2 51 LEU HB2 2 56 GLY H 4.049 3.590 4.508 4.579 4.551 4.615 0.107 10 0 "[ . 1]" 1
3588 1 51 LEU HB3 1 56 GLY H 3.845 3.389 4.301 4.195 4.131 4.261 . 0 0 "[ . 1]" 1
3589 2 51 LEU HB3 2 56 GLY H 3.845 3.389 4.301 4.196 4.127 4.264 . 0 0 "[ . 1]" 1
3590 1 54 ARG HD3 1 56 GLY H 6.683 5.832 7.534 6.280 6.006 6.695 . 0 0 "[ . 1]" 1
3591 1 34 LYS HG3 2 56 GLY H 6.683 5.832 7.534 6.280 6.006 6.707 . 0 0 "[ . 1]" 1
3592 1 56 GLY H 2 24 LEU QD 3.851 . 6.000 5.652 5.495 5.809 . 0 0 "[ . 1]" 1
3593 1 24 LEU QD 2 56 GLY H 3.851 . 6.000 5.656 5.505 5.810 . 0 0 "[ . 1]" 1
3594 1 49 GLU HA 1 52 GLN HE22 4.620 4.025 5.215 4.289 3.974 5.232 0.051 9 0 "[ . 1]" 1
3595 1 24 LEU HA 2 52 GLN HE22 4.620 4.025 5.215 4.289 3.967 5.242 0.058 9 0 "[ . 1]" 1
3596 1 39 LEU QD 1 40 THR H 2.985 . 6.000 3.871 3.844 3.916 . 0 0 "[ . 1]" 1
3597 2 39 LEU QD 2 40 THR H 2.985 . 6.000 3.871 3.840 3.916 . 0 0 "[ . 1]" 1
3598 1 40 THR H 1 43 ILE MD 3.011 . 6.000 3.914 3.871 3.952 . 0 0 "[ . 1]" 1
3599 1 18 ILE MD 2 40 THR H 3.011 . 6.000 3.915 3.867 3.947 . 0 0 "[ . 1]" 1
3600 1 54 ARG HB2 1 54 ARG HE 4.714 4.159 5.269 4.127 4.034 4.241 0.125 9 0 "[ . 1]" 1
3601 1 45 GLU QB 2 54 ARG HE 4.714 4.159 5.269 4.126 4.035 4.243 0.124 9 0 "[ . 1]" 1
3602 1 24 LEU QD 1 28 LEU H 2.906 2.453 3.359 3.394 3.207 3.667 0.308 9 0 "[ . 1]" 1
3603 2 24 LEU QD 2 28 LEU H 2.906 2.453 3.359 3.392 3.204 3.659 0.300 9 0 "[ . 1]" 1
3604 1 22 LYS H 1 22 LYS QD 5.194 . 6.000 4.087 3.995 4.184 . 0 0 "[ . 1]" 1
3605 2 22 LYS H 2 22 LYS QD 5.194 . 6.000 4.086 3.995 4.184 . 0 0 "[ . 1]" 1
3606 1 22 LYS H 1 26 THR MG 4.032 . 6.000 5.628 5.445 5.798 . 0 0 "[ . 1]" 1
3607 1 13 LYS QG 2 22 LYS H 4.032 . 6.000 5.631 5.459 5.802 . 0 0 "[ . 1]" 1
3608 1 22 LYS H 1 25 LYS QB 5.458 . 6.000 4.499 4.247 4.695 . 0 0 "[ . 1]" 1
3609 1 12 GLN HB3 2 22 LYS H 5.458 . 6.000 4.500 4.250 4.695 . 0 0 "[ . 1]" 1
3610 1 19 TYR H 1 22 LYS QB 8.815 7.004 10.626 7.384 7.278 7.501 . 0 0 "[ . 1]" 1
3611 1 39 LEU HB2 2 19 TYR H 8.815 7.004 10.626 7.381 7.278 7.479 . 0 0 "[ . 1]" 1
3612 1 16 PHE H 1 17 GLY HA3 2.738 . 6.000 4.464 4.402 4.509 . 0 0 "[ . 1]" 1
3613 1 17 GLY HA3 2 16 PHE H 2.738 . 6.000 4.465 4.411 4.509 . 0 0 "[ . 1]" 1
3614 1 19 TYR HB3 1 20 MET H 3.798 3.383 4.213 3.777 3.702 3.819 . 0 0 "[ . 1]" 1
3615 1 44 GLU HG2 2 20 MET H 3.798 3.383 4.213 3.777 3.702 3.816 . 0 0 "[ . 1]" 1
3616 1 41 GLN QG 1 45 GLU H 3.598 3.268 3.928 3.420 3.328 3.498 . 0 0 "[ . 1]" 1
3617 2 41 GLN QG 2 45 GLU H 3.598 3.268 3.928 3.418 3.327 3.484 . 0 0 "[ . 1]" 1
3618 1 20 MET HG2 1 25 LYS H 4.685 4.164 5.206 4.139 4.039 4.382 0.125 3 0 "[ . 1]" 1
3619 2 20 MET HG2 2 25 LYS H 4.685 4.164 5.206 4.137 4.045 4.373 0.119 8 0 "[ . 1]" 1
3620 1 25 LYS H 1 43 ILE MD 2.661 . 6.000 4.504 4.358 4.623 . 0 0 "[ . 1]" 1
3621 1 47 ILE MG 2 25 LYS H 2.661 . 6.000 4.502 4.359 4.616 . 0 0 "[ . 1]" 1
3622 1 27 ARG HB2 1 30 VAL H 3.915 . 6.000 5.089 5.028 5.167 . 0 0 "[ . 1]" 1
3623 2 27 ARG HB2 2 30 VAL H 3.915 . 6.000 5.089 5.032 5.162 . 0 0 "[ . 1]" 1
3624 1 29 LYS QG 1 32 CYS H 3.639 3.209 4.069 3.997 3.958 4.018 . 0 0 "[ . 1]" 1
3625 2 29 LYS QG 2 32 CYS H 3.639 3.209 4.069 3.997 3.965 4.021 . 0 0 "[ . 1]" 1
3626 1 34 LYS HG3 1 35 ASN H 3.163 2.803 3.523 3.863 3.830 3.911 0.388 10 0 "[ . 1]" 1
3627 2 34 LYS HG3 2 35 ASN H 3.163 2.803 3.523 3.862 3.823 3.910 0.387 10 0 "[ . 1]" 1
3628 1 34 LYS HG3 1 36 ASN H 4.003 . 6.000 5.256 5.170 5.331 . 0 0 "[ . 1]" 1
3629 2 34 LYS HG3 2 36 ASN H 4.003 . 6.000 5.255 5.169 5.329 . 0 0 "[ . 1]" 1
3630 1 37 LEU H 1 38 GLN HG2 5.537 4.832 6.242 6.065 5.970 6.142 . 0 0 "[ . 1]" 1
3631 2 37 LEU H 2 38 GLN HG2 5.537 4.832 6.242 6.066 5.975 6.143 . 0 0 "[ . 1]" 1
3632 1 32 CYS HB3 1 37 LEU H 3.450 3.044 3.856 3.708 3.614 3.828 . 0 0 "[ . 1]" 1
3633 2 32 CYS HB3 2 37 LEU H 3.450 3.044 3.856 3.706 3.607 3.827 . 0 0 "[ . 1]" 1
3634 1 32 CYS HA 1 39 LEU H 5.856 4.910 6.802 5.025 4.990 5.054 . 0 0 "[ . 1]" 1
3635 2 32 CYS HA 2 39 LEU H 5.856 4.910 6.802 5.026 4.993 5.056 . 0 0 "[ . 1]" 1
3636 1 40 THR H 1 41 GLN HA 3.467 . 6.000 5.040 5.021 5.056 . 0 0 "[ . 1]" 1
3637 1 18 ILE HA 2 40 THR H 3.467 . 6.000 5.042 5.018 5.061 . 0 0 "[ . 1]" 1
3638 1 37 LEU HB2 1 42 ALA H 3.442 . 6.000 4.626 4.426 4.753 . 0 0 "[ . 1]" 1
3639 2 37 LEU HB2 2 42 ALA H 3.442 . 6.000 4.626 4.429 4.752 . 0 0 "[ . 1]" 1
3640 1 38 GLN QB 1 43 ILE H 3.101 . 6.000 4.228 4.175 4.290 . 0 0 "[ . 1]" 1
3641 1 47 ILE HB 2 43 ILE H 3.101 . 6.000 4.227 4.173 4.281 . 0 0 "[ . 1]" 1
3642 1 20 MET ME 1 43 ILE H 2.303 . 6.000 5.596 5.475 5.662 . 0 0 "[ . 1]" 1
3643 1 20 MET ME 2 43 ILE H 2.303 . 6.000 5.596 5.483 5.666 . 0 0 "[ . 1]" 1
3644 1 43 ILE H 2 18 ILE MG 2.449 . 6.000 4.254 4.232 4.293 . 0 0 "[ . 1]" 1
3645 1 18 ILE MG 2 43 ILE H 2.449 . 6.000 4.253 4.225 4.288 . 0 0 "[ . 1]" 1
3646 1 28 LEU HG 1 44 GLU H 3.288 . 6.000 4.248 4.172 4.370 . 0 0 "[ . 1]" 1
3647 1 20 MET ME 2 44 GLU H 3.288 . 6.000 4.249 4.176 4.366 . 0 0 "[ . 1]" 1
3648 1 44 GLU H 1 47 ILE MD 2.851 . 6.000 5.084 5.049 5.107 . 0 0 "[ . 1]" 1
3649 1 18 ILE MG 2 44 GLU H 2.851 . 6.000 5.084 5.044 5.111 . 0 0 "[ . 1]" 1
3650 1 44 GLU HG3 1 45 GLU H 3.929 3.494 4.364 3.989 3.956 4.022 . 0 0 "[ . 1]" 1
3651 2 44 GLU HG3 2 45 GLU H 3.929 3.494 4.364 3.989 3.953 4.022 . 0 0 "[ . 1]" 1
3652 1 45 GLU H 1 47 ILE MD 3.777 . 6.000 5.946 5.917 6.010 0.010 10 0 "[ . 1]" 1
3653 1 18 ILE MG 2 45 GLU H 3.777 . 6.000 5.948 5.918 6.013 0.013 10 0 "[ . 1]" 1
3654 1 46 ALA HA 1 50 TYR H 4.018 3.565 4.471 4.110 4.033 4.213 . 0 0 "[ . 1]" 1
3655 1 46 ALA HA 2 50 TYR H 4.018 3.565 4.471 4.110 4.031 4.212 . 0 0 "[ . 1]" 1
3656 1 47 ILE HG12 1 50 TYR H 3.946 3.516 4.376 4.315 4.216 4.401 0.025 1 0 "[ . 1]" 1
3657 1 53 LYS QD 2 50 TYR H 3.946 3.516 4.376 4.315 4.214 4.401 0.025 1 0 "[ . 1]" 1
3658 1 50 TYR H 1 53 LYS HG2 5.614 4.730 6.498 6.346 6.272 6.482 . 0 0 "[ . 1]" 1
3659 1 53 LYS HG2 2 50 TYR H 5.614 4.730 6.498 6.345 6.273 6.480 . 0 0 "[ . 1]" 1
3660 1 51 LEU HB2 1 55 ASN H 5.037 4.346 5.728 4.942 4.886 4.987 . 0 0 "[ . 1]" 1
3661 2 51 LEU HB2 2 55 ASN H 5.037 4.346 5.728 4.942 4.889 4.987 . 0 0 "[ . 1]" 1
3662 1 25 LYS QB 1 27 ARG H 3.219 . 6.000 4.111 4.063 4.139 . 0 0 "[ . 1]" 1
3663 2 25 LYS QB 2 27 ARG H 3.219 . 6.000 4.111 4.061 4.138 . 0 0 "[ . 1]" 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 54
_Distance_constraint_stats_list.Viol_count 19
_Distance_constraint_stats_list.Viol_total 3.817
_Distance_constraint_stats_list.Viol_max 0.032
_Distance_constraint_stats_list.Viol_rms 0.0040
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0007
_Distance_constraint_stats_list.Viol_average_violations_only 0.0201
_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 12 GLN 0.018 0.018 3 0 "[ . 1]"
1 14 ALA 0.000 0.000 . 0 "[ . 1]"
1 16 PHE 0.000 0.000 . 0 "[ . 1]"
1 18 ILE 0.000 0.000 . 0 "[ . 1]"
1 20 MET 0.000 0.000 . 0 "[ . 1]"
1 21 ASP 0.027 0.015 9 0 "[ . 1]"
1 22 LYS 0.030 0.016 7 0 "[ . 1]"
1 23 ASP 0.000 0.000 . 0 "[ . 1]"
1 24 LEU 0.000 0.000 . 0 "[ . 1]"
1 25 LYS 0.027 0.015 9 0 "[ . 1]"
1 26 THR 0.000 0.000 . 0 "[ . 1]"
1 27 ARG 0.000 0.000 . 0 "[ . 1]"
1 28 LEU 0.000 0.000 . 0 "[ . 1]"
1 29 LYS 0.000 0.000 . 0 "[ . 1]"
1 30 VAL 0.000 0.000 . 0 "[ . 1]"
1 31 TYR 0.000 0.000 . 0 "[ . 1]"
1 32 CYS 0.000 0.000 . 0 "[ . 1]"
1 33 ALA 0.000 0.000 . 0 "[ . 1]"
1 34 LYS 0.000 0.000 . 0 "[ . 1]"
1 35 ASN 0.000 0.000 . 0 "[ . 1]"
1 39 LEU 0.000 0.000 . 0 "[ . 1]"
1 40 THR 0.000 0.000 . 0 "[ . 1]"
1 41 GLN 0.000 0.000 . 0 "[ . 1]"
1 42 ALA 0.000 0.000 . 0 "[ . 1]"
1 43 ILE 0.000 0.000 . 0 "[ . 1]"
1 44 GLU 0.000 0.000 . 0 "[ . 1]"
1 45 GLU 0.000 0.000 . 0 "[ . 1]"
1 46 ALA 0.019 0.019 1 0 "[ . 1]"
1 47 ILE 0.000 0.000 . 0 "[ . 1]"
1 48 LYS 0.128 0.032 10 0 "[ . 1]"
1 49 GLU 0.000 0.000 . 0 "[ . 1]"
1 50 TYR 0.019 0.019 1 0 "[ . 1]"
1 51 LEU 0.000 0.000 . 0 "[ . 1]"
1 52 GLN 0.128 0.032 10 0 "[ . 1]"
1 53 LYS 0.000 0.000 . 0 "[ . 1]"
1 55 ASN 0.000 0.000 . 0 "[ . 1]"
1 56 GLY 0.000 0.000 . 0 "[ . 1]"
2 12 GLN 0.030 0.016 7 0 "[ . 1]"
2 14 ALA 0.000 0.000 . 0 "[ . 1]"
2 16 PHE 0.000 0.000 . 0 "[ . 1]"
2 18 ILE 0.000 0.000 . 0 "[ . 1]"
2 20 MET 0.000 0.000 . 0 "[ . 1]"
2 21 ASP 0.029 0.016 8 0 "[ . 1]"
2 22 LYS 0.018 0.018 3 0 "[ . 1]"
2 23 ASP 0.000 0.000 . 0 "[ . 1]"
2 24 LEU 0.000 0.000 . 0 "[ . 1]"
2 25 LYS 0.029 0.016 8 0 "[ . 1]"
2 26 THR 0.000 0.000 . 0 "[ . 1]"
2 27 ARG 0.000 0.000 . 0 "[ . 1]"
2 28 LEU 0.000 0.000 . 0 "[ . 1]"
2 29 LYS 0.000 0.000 . 0 "[ . 1]"
2 30 VAL 0.000 0.000 . 0 "[ . 1]"
2 31 TYR 0.000 0.000 . 0 "[ . 1]"
2 32 CYS 0.000 0.000 . 0 "[ . 1]"
2 33 ALA 0.000 0.000 . 0 "[ . 1]"
2 34 LYS 0.000 0.000 . 0 "[ . 1]"
2 35 ASN 0.000 0.000 . 0 "[ . 1]"
2 39 LEU 0.000 0.000 . 0 "[ . 1]"
2 40 THR 0.000 0.000 . 0 "[ . 1]"
2 41 GLN 0.000 0.000 . 0 "[ . 1]"
2 42 ALA 0.000 0.000 . 0 "[ . 1]"
2 43 ILE 0.000 0.000 . 0 "[ . 1]"
2 44 GLU 0.000 0.000 . 0 "[ . 1]"
2 45 GLU 0.000 0.000 . 0 "[ . 1]"
2 46 ALA 0.015 0.015 1 0 "[ . 1]"
2 47 ILE 0.000 0.000 . 0 "[ . 1]"
2 48 LYS 0.116 0.032 10 0 "[ . 1]"
2 49 GLU 0.000 0.000 . 0 "[ . 1]"
2 50 TYR 0.015 0.015 1 0 "[ . 1]"
2 51 LEU 0.000 0.000 . 0 "[ . 1]"
2 52 GLN 0.116 0.032 10 0 "[ . 1]"
2 53 LYS 0.000 0.000 . 0 "[ . 1]"
2 55 ASN 0.000 0.000 . 0 "[ . 1]"
2 56 GLY 0.000 0.000 . 0 "[ . 1]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 14 ALA H 2 20 MET O 2.000 . 2.400 1.771 1.675 1.882 . 0 0 "[ . 1]" 2
2 1 20 MET O 2 14 ALA H 2.000 . 2.400 1.768 1.650 1.879 . 0 0 "[ . 1]" 2
3 1 16 PHE H 2 18 ILE O 2.000 . 2.400 2.214 2.141 2.259 . 0 0 "[ . 1]" 2
4 1 18 ILE O 2 16 PHE H 2.000 . 2.400 2.210 2.134 2.262 . 0 0 "[ . 1]" 2
5 1 18 ILE H 2 16 PHE O 2.000 . 2.400 2.225 2.112 2.357 . 0 0 "[ . 1]" 2
6 1 16 PHE O 2 18 ILE H 2.000 . 2.400 2.226 2.110 2.360 . 0 0 "[ . 1]" 2
7 1 22 LYS H 2 12 GLN O 2.000 . 2.400 2.088 1.891 2.416 0.016 7 0 "[ . 1]" 2
8 1 12 GLN O 2 22 LYS H 2.000 . 2.400 2.090 1.912 2.418 0.018 3 0 "[ . 1]" 2
9 1 21 ASP O 1 25 LYS H 2.000 . 2.400 2.296 2.144 2.415 0.015 9 0 "[ . 1]" 2
10 1 22 LYS O 1 26 THR H 2.000 . 2.400 1.659 1.615 1.734 . 0 0 "[ . 1]" 2
11 1 23 ASP O 1 27 ARG H 2.000 . 2.400 1.970 1.841 2.135 . 0 0 "[ . 1]" 2
12 1 24 LEU O 1 28 LEU H 2.000 . 2.400 2.153 2.061 2.251 . 0 0 "[ . 1]" 2
13 1 25 LYS O 1 29 LYS H 2.000 . 2.400 2.001 1.945 2.061 . 0 0 "[ . 1]" 2
14 1 26 THR O 1 30 VAL H 2.000 . 2.400 2.023 1.963 2.166 . 0 0 "[ . 1]" 2
15 1 27 ARG O 1 31 TYR H 2.000 . 2.400 2.190 2.039 2.317 . 0 0 "[ . 1]" 2
16 1 28 LEU O 1 32 CYS H 2.000 . 2.400 1.911 1.893 1.928 . 0 0 "[ . 1]" 2
17 1 29 LYS O 1 33 ALA H 2.000 . 2.400 2.150 2.046 2.283 . 0 0 "[ . 1]" 2
18 1 30 VAL O 1 34 LYS H 2.000 . 2.400 1.916 1.887 1.992 . 0 0 "[ . 1]" 2
19 1 39 LEU O 1 43 ILE H 2.000 . 2.400 1.984 1.919 2.042 . 0 0 "[ . 1]" 2
20 1 40 THR O 1 44 GLU H 2.000 . 2.400 1.866 1.828 1.901 . 0 0 "[ . 1]" 2
21 1 41 GLN O 1 45 GLU H 2.000 . 2.400 1.960 1.867 1.999 . 0 0 "[ . 1]" 2
22 1 42 ALA O 1 46 ALA H 2.000 . 2.400 1.823 1.771 1.865 . 0 0 "[ . 1]" 2
23 1 43 ILE O 1 47 ILE H 2.000 . 2.400 1.699 1.659 1.723 . 0 0 "[ . 1]" 2
24 1 44 GLU O 1 48 LYS H 2.000 . 2.400 2.006 1.861 2.144 . 0 0 "[ . 1]" 2
25 1 45 GLU O 1 49 GLU H 2.000 . 2.400 1.944 1.852 2.025 . 0 0 "[ . 1]" 2
26 1 46 ALA O 1 50 TYR H 2.000 . 2.400 2.300 2.210 2.419 0.019 1 0 "[ . 1]" 2
27 1 47 ILE O 1 51 LEU H 2.000 . 2.400 2.277 2.199 2.371 . 0 0 "[ . 1]" 2
28 1 48 LYS O 1 52 GLN H 2.000 . 2.400 2.354 2.229 2.432 0.032 10 0 "[ . 1]" 2
29 1 49 GLU O 1 53 LYS H 2.000 . 2.400 2.087 1.881 2.367 . 0 0 "[ . 1]" 2
30 2 21 ASP O 2 25 LYS H 2.000 . 2.400 2.297 2.148 2.416 0.016 8 0 "[ . 1]" 2
31 2 22 LYS O 2 26 THR H 2.000 . 2.400 1.658 1.613 1.732 . 0 0 "[ . 1]" 2
32 2 23 ASP O 2 27 ARG H 2.000 . 2.400 1.972 1.839 2.138 . 0 0 "[ . 1]" 2
33 2 24 LEU O 2 28 LEU H 2.000 . 2.400 2.151 2.060 2.241 . 0 0 "[ . 1]" 2
34 2 25 LYS O 2 29 LYS H 2.000 . 2.400 2.003 1.940 2.061 . 0 0 "[ . 1]" 2
35 2 26 THR O 2 30 VAL H 2.000 . 2.400 2.021 1.958 2.171 . 0 0 "[ . 1]" 2
36 2 27 ARG O 2 31 TYR H 2.000 . 2.400 2.190 2.046 2.318 . 0 0 "[ . 1]" 2
37 2 28 LEU O 2 32 CYS H 2.000 . 2.400 1.912 1.889 1.933 . 0 0 "[ . 1]" 2
38 2 29 LYS O 2 33 ALA H 2.000 . 2.400 2.152 2.053 2.278 . 0 0 "[ . 1]" 2
39 2 30 VAL O 2 34 LYS H 2.000 . 2.400 1.910 1.873 1.995 . 0 0 "[ . 1]" 2
40 2 39 LEU O 2 43 ILE H 2.000 . 2.400 1.986 1.926 2.043 . 0 0 "[ . 1]" 2
41 2 40 THR O 2 44 GLU H 2.000 . 2.400 1.865 1.826 1.904 . 0 0 "[ . 1]" 2
42 2 41 GLN O 2 45 GLU H 2.000 . 2.400 1.959 1.867 2.014 . 0 0 "[ . 1]" 2
43 2 42 ALA O 2 46 ALA H 2.000 . 2.400 1.820 1.774 1.850 . 0 0 "[ . 1]" 2
44 2 43 ILE O 2 47 ILE H 2.000 . 2.400 1.698 1.652 1.724 . 0 0 "[ . 1]" 2
45 2 44 GLU O 2 48 LYS H 2.000 . 2.400 2.015 1.870 2.153 . 0 0 "[ . 1]" 2
46 2 45 GLU O 2 49 GLU H 2.000 . 2.400 1.946 1.859 2.032 . 0 0 "[ . 1]" 2
47 2 46 ALA O 2 50 TYR H 2.000 . 2.400 2.301 2.209 2.415 0.015 1 0 "[ . 1]" 2
48 2 47 ILE O 2 51 LEU H 2.000 . 2.400 2.276 2.192 2.367 . 0 0 "[ . 1]" 2
49 2 48 LYS O 2 52 GLN H 2.000 . 2.400 2.352 2.224 2.432 0.032 10 0 "[ . 1]" 2
50 2 49 GLU O 2 53 LYS H 2.000 . 2.400 2.087 1.881 2.367 . 0 0 "[ . 1]" 2
51 1 31 TYR O 1 35 ASN HD21 2.000 . 2.400 1.957 1.828 2.040 . 0 0 "[ . 1]" 2
52 2 31 TYR O 2 35 ASN HD21 2.000 . 2.400 1.960 1.822 2.037 . 0 0 "[ . 1]" 2
53 1 55 ASN OD1 1 56 GLY H 2.000 . 2.400 1.758 1.712 1.801 . 0 0 "[ . 1]" 2
54 2 55 ASN OD1 2 56 GLY H 2.000 . 2.400 1.758 1.714 1.793 . 0 0 "[ . 1]" 2
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