NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
640771 |
6ob1   |
30590 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6ob1
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 2846
_Distance_constraint_stats_list.Viol_count 7200
_Distance_constraint_stats_list.Viol_total 16141.955
_Distance_constraint_stats_list.Viol_max 1.602
_Distance_constraint_stats_list.Viol_rms 0.0500
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0142
_Distance_constraint_stats_list.Viol_average_violations_only 0.1121
_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 2 MET 21.004 0.399 5 0 "[ . 1 . 2]"
1 3 GLN 13.456 0.406 9 0 "[ . 1 . 2]"
1 4 ILE 21.160 0.445 20 0 "[ . 1 . 2]"
1 5 PHE 11.011 0.358 16 0 "[ . 1 . 2]"
1 6 VAL 6.087 0.276 6 0 "[ . 1 . 2]"
1 7 ASP 6.870 0.352 1 0 "[ . 1 . 2]"
1 8 THR 1.699 0.190 9 0 "[ . 1 . 2]"
1 9 VAL 3.423 0.256 2 0 "[ . 1 . 2]"
1 10 GLN 2.693 0.256 2 0 "[ . 1 . 2]"
1 11 TRP 26.514 1.602 15 8 "[* -** * 1 +* * 2]"
1 12 LYS 2.291 0.213 12 0 "[ . 1 . 2]"
1 13 THR 0.647 0.218 9 0 "[ . 1 . 2]"
1 14 ILE 6.282 0.390 15 0 "[ . 1 . 2]"
1 15 THR 6.491 0.390 15 0 "[ . 1 . 2]"
1 16 LEU 16.106 0.368 17 0 "[ . 1 . 2]"
1 17 GLU 5.201 0.325 12 0 "[ . 1 . 2]"
1 18 VAL 10.209 0.300 8 0 "[ . 1 . 2]"
1 19 GLU 13.737 0.459 14 0 "[ . 1 . 2]"
1 20 PRO 7.090 0.459 14 0 "[ . 1 . 2]"
1 21 SER 3.805 0.206 18 0 "[ . 1 . 2]"
1 22 ASP 10.403 0.440 5 0 "[ . 1 . 2]"
1 23 THR 8.195 0.225 8 0 "[ . 1 . 2]"
1 24 ILE 17.244 0.394 5 0 "[ . 1 . 2]"
1 25 GLU 4.786 0.257 7 0 "[ . 1 . 2]"
1 26 ASN 6.546 0.440 5 0 "[ . 1 . 2]"
1 27 VAL 3.925 0.163 12 0 "[ . 1 . 2]"
1 28 LYS 3.008 0.209 17 0 "[ . 1 . 2]"
1 29 ALA 2.947 0.368 8 0 "[ . 1 . 2]"
1 30 LYS 3.185 0.258 5 0 "[ . 1 . 2]"
1 31 ILE 5.715 0.266 12 0 "[ . 1 . 2]"
1 32 GLN 2.160 0.255 4 0 "[ . 1 . 2]"
1 33 ASP 2.612 0.154 12 0 "[ . 1 . 2]"
1 34 LYS 4.148 0.258 5 0 "[ . 1 . 2]"
1 35 GLU 0.995 0.320 4 0 "[ . 1 . 2]"
1 36 GLY 0.729 0.108 18 0 "[ . 1 . 2]"
1 37 ILE 4.512 0.266 12 0 "[ . 1 . 2]"
1 38 PRO 1.313 0.213 1 0 "[ . 1 . 2]"
1 39 PRO 7.309 0.368 8 0 "[ . 1 . 2]"
1 40 ASP 3.951 0.306 4 0 "[ . 1 . 2]"
1 41 GLN 3.378 0.286 5 0 "[ . 1 . 2]"
1 42 GLN 0.862 0.221 19 0 "[ . 1 . 2]"
1 43 ARG 4.096 0.388 3 0 "[ . 1 . 2]"
1 44 LEU 5.538 0.446 19 0 "[ . 1 . 2]"
1 45 ILE 9.247 0.462 10 0 "[ . 1 . 2]"
1 46 PHE 15.226 0.593 3 3 "[ + . 1 -* 2]"
1 47 ALA 1.318 0.462 10 0 "[ . 1 . 2]"
1 48 GLY 4.628 0.312 2 0 "[ . 1 . 2]"
1 49 LYS 6.350 0.436 12 0 "[ . 1 . 2]"
1 50 GLN 3.873 0.436 12 0 "[ . 1 . 2]"
1 51 LEU 12.737 0.373 9 0 "[ . 1 . 2]"
1 52 GLU 2.974 0.456 15 0 "[ . 1 . 2]"
1 53 ASP 1.108 0.265 19 0 "[ . 1 . 2]"
1 54 GLY 1.712 0.308 15 0 "[ . 1 . 2]"
1 55 ARG 9.789 0.456 15 0 "[ . 1 . 2]"
1 56 THR 6.359 0.206 18 0 "[ . 1 . 2]"
1 57 LEU 16.615 0.449 3 0 "[ . 1 . 2]"
1 58 SER 6.133 0.326 9 0 "[ . 1 . 2]"
1 59 ASP 0.099 0.055 13 0 "[ . 1 . 2]"
1 60 TYR 16.297 0.326 9 0 "[ . 1 . 2]"
1 61 ASN 2.430 0.198 16 0 "[ . 1 . 2]"
1 62 ILE 11.163 0.449 3 0 "[ . 1 . 2]"
1 63 GLN 1.339 0.232 19 0 "[ . 1 . 2]"
1 64 LYS 7.364 0.455 1 0 "[ . 1 . 2]"
1 65 GLU 9.431 0.258 17 0 "[ . 1 . 2]"
1 66 SER 0.648 0.204 7 0 "[ . 1 . 2]"
1 67 ALA 3.099 0.233 16 0 "[ . 1 . 2]"
1 68 LEU 15.710 0.593 3 3 "[ + . 1 -* 2]"
1 69 ILE 7.191 0.496 3 0 "[ . 1 . 2]"
1 70 LEU 7.069 0.446 19 0 "[ . 1 . 2]"
1 71 LEU 3.774 0.311 20 0 "[ . 1 . 2]"
1 72 LEU 0.210 0.127 19 0 "[ . 1 . 2]"
1 73 THR 2.451 0.286 5 0 "[ . 1 . 2]"
1 74 LEU 10.374 0.388 3 0 "[ . 1 . 2]"
1 75 ARG 2.216 0.324 3 0 "[ . 1 . 2]"
2 2 MET 15.711 0.455 1 0 "[ . 1 . 2]"
2 3 GLN 13.916 0.334 15 0 "[ . 1 . 2]"
2 4 ILE 17.606 0.368 17 0 "[ . 1 . 2]"
2 5 PHE 7.619 0.267 18 0 "[ . 1 . 2]"
2 6 VAL 10.557 0.346 5 0 "[ . 1 . 2]"
2 7 ASP 5.951 0.489 6 0 "[ . 1 . 2]"
2 8 THR 0.911 0.157 1 0 "[ . 1 . 2]"
2 9 VAL 3.824 0.953 9 1 "[ . +1 . 2]"
2 10 GLN 0.930 0.130 8 0 "[ . 1 . 2]"
2 11 TRP 5.810 0.299 15 0 "[ . 1 . 2]"
2 12 LYS 5.711 0.299 15 0 "[ . 1 . 2]"
2 13 THR 1.278 0.111 15 0 "[ . 1 . 2]"
2 14 ILE 7.167 0.451 8 0 "[ . 1 . 2]"
2 15 THR 7.584 0.451 8 0 "[ . 1 . 2]"
2 16 LEU 17.217 0.445 20 0 "[ . 1 . 2]"
2 17 GLU 5.637 0.406 9 0 "[ . 1 . 2]"
2 18 VAL 12.443 0.403 7 0 "[ . 1 . 2]"
2 19 GLU 15.119 0.504 7 1 "[ . + 1 . 2]"
2 20 PRO 9.398 0.504 7 1 "[ . + 1 . 2]"
2 21 SER 3.879 0.192 19 0 "[ . 1 . 2]"
2 22 ASP 8.460 0.459 18 0 "[ . 1 . 2]"
2 23 THR 7.261 0.229 5 0 "[ . 1 . 2]"
2 24 ILE 13.413 0.388 6 0 "[ . 1 . 2]"
2 25 GLU 3.376 0.302 6 0 "[ . 1 . 2]"
2 26 ASN 3.850 0.302 6 0 "[ . 1 . 2]"
2 27 VAL 2.497 0.091 20 0 "[ . 1 . 2]"
2 28 LYS 1.485 0.204 15 0 "[ . 1 . 2]"
2 29 ALA 2.345 0.274 1 0 "[ . 1 . 2]"
2 30 LYS 2.576 0.197 15 0 "[ . 1 . 2]"
2 31 ILE 6.033 0.188 8 0 "[ . 1 . 2]"
2 32 GLN 1.664 0.166 9 0 "[ . 1 . 2]"
2 33 ASP 2.240 0.180 20 0 "[ . 1 . 2]"
2 34 LYS 3.413 0.197 15 0 "[ . 1 . 2]"
2 35 GLU 0.562 0.188 8 0 "[ . 1 . 2]"
2 36 GLY 0.728 0.124 1 0 "[ . 1 . 2]"
2 37 ILE 3.590 0.258 1 0 "[ . 1 . 2]"
2 38 PRO 1.825 0.304 5 0 "[ . 1 . 2]"
2 39 PRO 6.113 0.313 13 0 "[ . 1 . 2]"
2 40 ASP 3.440 0.313 13 0 "[ . 1 . 2]"
2 41 GLN 5.636 0.304 5 0 "[ . 1 . 2]"
2 42 GLN 1.058 0.305 6 0 "[ . 1 . 2]"
2 43 ARG 4.806 0.352 2 0 "[ . 1 . 2]"
2 44 LEU 5.480 0.470 10 0 "[ . 1 . 2]"
2 45 ASP 1.548 0.249 20 0 "[ . 1 . 2]"
2 46 PHE 6.404 0.306 13 0 "[ . 1 . 2]"
2 47 ALA 0.515 0.080 13 0 "[ . 1 . 2]"
2 48 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
2 49 LYS 2.546 0.191 18 0 "[ . 1 . 2]"
2 50 GLN 1.575 0.382 4 0 "[ . 1 . 2]"
2 51 LEU 8.751 0.470 10 0 "[ . 1 . 2]"
2 52 GLU 3.494 0.251 12 0 "[ . 1 . 2]"
2 53 ASP 0.583 0.110 8 0 "[ . 1 . 2]"
2 54 GLY 1.617 0.314 1 0 "[ . 1 . 2]"
2 55 ARG 10.516 0.388 6 0 "[ . 1 . 2]"
2 56 THR 7.038 0.290 16 0 "[ . 1 . 2]"
2 57 LEU 15.999 0.397 18 0 "[ . 1 . 2]"
2 58 SER 5.950 0.333 20 0 "[ . 1 . 2]"
2 59 ASP 0.079 0.069 8 0 "[ . 1 . 2]"
2 60 TYR 9.201 0.333 20 0 "[ . 1 . 2]"
2 61 ASN 2.054 0.136 6 0 "[ . 1 . 2]"
2 62 ILE 12.488 0.321 13 0 "[ . 1 . 2]"
2 63 GLN 1.549 0.144 18 0 "[ . 1 . 2]"
2 64 LYS 11.685 0.361 20 0 "[ . 1 . 2]"
2 65 GLU 13.544 0.316 9 0 "[ . 1 . 2]"
2 66 SER 0.992 0.206 11 0 "[ . 1 . 2]"
2 67 ALA 2.461 0.291 15 0 "[ . 1 . 2]"
2 68 LEU 9.103 0.352 1 0 "[ . 1 . 2]"
2 69 ILE 6.494 0.363 17 0 "[ . 1 . 2]"
2 70 LEU 8.180 0.272 16 0 "[ . 1 . 2]"
2 71 LEU 2.813 0.363 17 0 "[ . 1 . 2]"
2 72 LEU 0.684 0.176 15 0 "[ . 1 . 2]"
2 73 THR 4.449 0.269 10 0 "[ . 1 . 2]"
2 74 LEU 3.947 0.352 2 0 "[ . 1 . 2]"
2 75 ARG 0.557 0.102 8 0 "[ . 1 . 2]"
3 3 GLU 2.149 0.240 3 0 "[ . 1 . 2]"
3 4 SER 1.621 0.222 12 0 "[ . 1 . 2]"
3 5 ASP 0.589 0.240 3 0 "[ . 1 . 2]"
3 6 SER 0.062 0.061 15 0 "[ . 1 . 2]"
3 7 GLY 0.189 0.189 8 0 "[ . 1 . 2]"
3 8 MET 0.816 0.189 8 0 "[ . 1 . 2]"
3 9 ALA 1.475 0.281 16 0 "[ . 1 . 2]"
3 10 SER 1.402 0.179 1 0 "[ . 1 . 2]"
3 11 GLN 3.710 0.242 5 0 "[ . 1 . 2]"
3 12 ALA 3.461 0.281 16 0 "[ . 1 . 2]"
3 13 ASP 2.248 0.211 10 0 "[ . 1 . 2]"
3 14 GLN 4.823 0.383 17 0 "[ . 1 . 2]"
3 15 LYS 17.260 0.522 15 1 "[ . 1 + 2]"
3 16 GLU 12.843 0.522 15 1 "[ . 1 + 2]"
3 17 GLU 6.837 0.354 9 0 "[ . 1 . 2]"
3 18 GLU 3.617 0.351 15 0 "[ . 1 . 2]"
3 19 LEU 9.963 0.398 18 0 "[ . 1 . 2]"
3 20 LEU 2.782 0.283 16 0 "[ . 1 . 2]"
3 21 LEU 8.837 0.330 9 0 "[ . 1 . 2]"
3 22 PHE 5.785 0.248 14 0 "[ . 1 . 2]"
3 23 TRP 9.560 0.318 17 0 "[ . 1 . 2]"
3 24 THR 4.900 0.292 11 0 "[ . 1 . 2]"
3 25 TYR 4.514 0.330 9 0 "[ . 1 . 2]"
3 26 ILE 20.975 0.506 4 1 "[ +. 1 . 2]"
3 27 GLN 5.133 0.311 16 0 "[ . 1 . 2]"
3 28 ALA 0.872 0.134 19 0 "[ . 1 . 2]"
3 29 MET 13.854 1.602 15 4 "[ -. * 1 +* 2]"
3 30 LEU 7.956 0.340 13 0 "[ . 1 . 2]"
3 31 THR 11.539 0.382 3 0 "[ . 1 . 2]"
3 32 ASN 1.573 0.168 7 0 "[ . 1 . 2]"
3 33 LEU 22.020 0.953 9 6 "[- ** +1 .* * 2]"
3 34 GLU 5.401 0.363 14 0 "[ . 1 . 2]"
3 35 SER 8.003 0.520 14 1 "[ . 1 +. 2]"
3 36 LEU 9.070 0.520 14 1 "[ . 1 +. 2]"
3 37 SER 2.268 0.278 2 0 "[ . 1 . 2]"
3 38 LEU 16.686 0.550 19 1 "[ . 1 . +2]"
3 39 ASP 1.194 0.319 16 0 "[ . 1 . 2]"
3 40 ARG 1.332 0.336 17 0 "[ . 1 . 2]"
3 41 ILE 7.354 0.550 19 1 "[ . 1 . +2]"
3 42 TYR 8.077 0.274 9 0 "[ . 1 . 2]"
3 43 ASN 1.796 0.340 11 0 "[ . 1 . 2]"
3 44 MET 4.371 0.291 11 0 "[ . 1 . 2]"
3 45 LEU 15.117 0.493 2 0 "[ . 1 . 2]"
3 46 ARG 5.776 0.401 20 0 "[ . 1 . 2]"
3 47 MET 3.792 0.312 2 0 "[ . 1 . 2]"
3 48 PHE 0.614 0.179 10 0 "[ . 1 . 2]"
3 49 VAL 6.233 0.296 18 0 "[ . 1 . 2]"
3 50 VAL 7.255 0.329 20 0 "[ . 1 . 2]"
3 51 THR 8.161 0.237 7 0 "[ . 1 . 2]"
3 52 GLY 12.653 0.366 7 0 "[ . 1 . 2]"
3 53 PRO 1.454 0.123 4 0 "[ . 1 . 2]"
3 54 ALA 5.002 0.366 7 0 "[ . 1 . 2]"
3 55 LEU 6.679 0.296 18 0 "[ . 1 . 2]"
3 56 ALA 0.215 0.126 7 0 "[ . 1 . 2]"
3 57 GLU 4.356 0.527 8 1 "[ . + 1 . 2]"
3 58 ILE 10.214 0.401 20 0 "[ . 1 . 2]"
3 59 ASP 4.308 0.240 5 0 "[ . 1 . 2]"
3 60 LEU 8.337 0.931 9 1 "[ . +1 . 2]"
3 61 GLN 8.548 0.931 9 1 "[ . +1 . 2]"
3 62 GLU 3.409 0.291 10 0 "[ . 1 . 2]"
3 63 LEU 11.965 0.307 6 0 "[ . 1 . 2]"
3 64 GLN 13.264 0.324 3 0 "[ . 1 . 2]"
3 65 GLY 3.191 0.324 3 0 "[ . 1 . 2]"
3 66 TYR 7.341 0.318 17 0 "[ . 1 . 2]"
3 67 LEU 14.853 0.469 11 0 "[ . 1 . 2]"
3 68 GLN 7.866 0.271 1 0 "[ . 1 . 2]"
3 69 LYS 10.776 0.342 3 0 "[ . 1 . 2]"
3 70 LYS 8.382 0.307 18 0 "[ . 1 . 2]"
3 71 VAL 3.463 0.180 3 0 "[ . 1 . 2]"
3 72 ARG 6.199 0.259 10 0 "[ . 1 . 2]"
3 73 ASP 7.967 0.338 14 0 "[ . 1 . 2]"
3 74 GLN 2.422 0.298 19 0 "[ . 1 . 2]"
3 75 GLN 3.529 0.307 18 0 "[ . 1 . 2]"
3 76 LEU 8.589 0.755 3 1 "[ + . 1 . 2]"
3 77 VAL 6.101 0.310 11 0 "[ . 1 . 2]"
3 78 TYR 15.834 0.285 19 0 "[ . 1 . 2]"
3 79 SER 6.867 0.450 20 0 "[ . 1 . 2]"
3 80 ALA 0.530 0.088 12 0 "[ . 1 . 2]"
3 81 GLY 11.345 0.285 19 0 "[ . 1 . 2]"
3 82 VAL 14.683 0.450 20 0 "[ . 1 . 2]"
3 83 TYR 12.144 0.359 20 0 "[ . 1 . 2]"
3 84 ARG 6.834 0.336 3 0 "[ . 1 . 2]"
3 85 LEU 20.371 0.755 3 1 "[ + . 1 . 2]"
3 86 PRO 4.185 0.235 4 0 "[ . 1 . 2]"
3 87 LYS 5.553 0.377 7 0 "[ . 1 . 2]"
3 88 ASN 2.624 0.261 8 0 "[ . 1 . 2]"
3 89 CYS 1.081 0.261 8 0 "[ . 1 . 2]"
3 90 SER 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 11 TRP HD1 3 33 LEU MD1 . . 4.020 3.754 2.596 4.456 0.436 9 0 "[ . 1 . 2]" 1
2 1 11 TRP HD1 3 33 LEU MD2 . . 4.020 3.632 2.851 4.293 0.273 10 0 "[ . 1 . 2]" 1
3 1 11 TRP HH2 3 33 LEU MD1 . . 4.520 4.527 3.333 5.405 0.885 18 4 "[- * 1 .* + 2]" 1
4 1 11 TRP HZ3 3 33 LEU MD2 . . 4.320 4.045 3.277 4.579 0.259 20 0 "[ . 1 . 2]" 1
5 1 11 TRP HZ2 3 33 LEU MD2 . . 4.420 4.183 2.210 5.150 0.730 6 1 "[ .+ 1 . 2]" 1
6 1 11 TRP QB 3 33 LEU QD . . 4.910 2.087 1.685 4.414 . 0 0 "[ . 1 . 2]" 1
7 1 11 TRP HZ3 3 33 LEU QD . . 4.180 3.486 3.025 4.265 0.085 20 0 "[ . 1 . 2]" 1
8 1 11 TRP HZ2 3 33 LEU QD . . 4.690 3.453 2.201 4.130 . 0 0 "[ . 1 . 2]" 1
9 1 11 TRP HD1 3 29 MET ME . . 4.900 5.187 4.787 6.502 1.602 15 4 "[ -. * 1 +* 2]" 1
10 1 11 TRP HH2 3 29 MET ME . . 4.900 3.021 2.311 3.605 . 0 0 "[ . 1 . 2]" 1
11 1 11 TRP HZ3 3 29 MET ME . . 4.500 4.252 2.953 4.767 0.267 20 0 "[ . 1 . 2]" 1
12 1 11 TRP HZ3 3 44 MET ME . . 4.710 4.552 2.832 4.862 0.152 6 0 "[ . 1 . 2]" 1
13 1 11 TRP HH2 3 44 MET ME . . 4.480 2.773 1.877 3.342 . 0 0 "[ . 1 . 2]" 1
14 1 11 TRP HZ2 3 44 MET ME . . 4.570 3.080 1.989 4.655 0.085 4 0 "[ . 1 . 2]" 1
15 1 69 ILE MG 3 44 MET ME . . 4.560 3.771 2.939 4.732 0.172 4 0 "[ . 1 . 2]" 1
16 1 69 ILE MD 3 44 MET ME . . 3.900 2.178 1.785 2.963 . 0 0 "[ . 1 . 2]" 1
17 1 69 ILE MG 3 48 PHE HZ . . 4.350 2.212 1.685 3.072 . 0 0 "[ . 1 . 2]" 1
18 1 69 ILE MD 3 25 TYR QE . . 4.950 4.121 2.719 5.261 0.311 12 0 "[ . 1 . 2]" 1
19 1 69 ILE MG 3 25 TYR QE . . 5.150 2.569 1.787 4.240 . 0 0 "[ . 1 . 2]" 1
20 1 69 ILE MD 3 44 MET QG . . 4.500 3.948 3.068 4.593 0.093 15 0 "[ . 1 . 2]" 1
21 1 69 ILE MD 3 48 PHE HZ . . 3.950 2.786 1.765 3.923 . 0 0 "[ . 1 . 2]" 1
22 1 69 ILE MD 3 48 PHE QE . . 3.940 3.267 2.760 3.966 0.026 3 0 "[ . 1 . 2]" 1
23 1 69 ILE MG 3 48 PHE QE . . 4.500 2.635 2.026 3.296 . 0 0 "[ . 1 . 2]" 1
24 1 45 ILE MD 3 25 TYR QE . . 3.500 2.623 1.972 3.553 0.053 20 0 "[ . 1 . 2]" 1
25 1 45 ILE MD 3 25 TYR QD . . 3.800 3.181 2.756 3.822 0.022 14 0 "[ . 1 . 2]" 1
26 1 45 ILE MD 3 24 THR MG . . 4.260 2.816 2.205 3.671 . 0 0 "[ . 1 . 2]" 1
27 1 45 ILE MG 3 24 THR MG . . 4.960 4.876 4.407 5.110 0.150 14 0 "[ . 1 . 2]" 1
28 1 45 ILE HG12 3 24 THR MG . . 5.260 4.953 4.198 5.345 0.085 3 0 "[ . 1 . 2]" 1
29 1 45 ILE MD 3 21 LEU MD1 . . 4.580 3.323 2.051 4.704 0.124 20 0 "[ . 1 . 2]" 1
30 1 45 ILE MG 3 21 LEU MD1 . . 4.580 3.114 2.098 3.992 . 0 0 "[ . 1 . 2]" 1
31 1 45 ILE MG 3 21 LEU MD2 . . 4.180 3.267 2.486 3.960 . 0 0 "[ . 1 . 2]" 1
32 1 45 ILE MD 3 21 LEU MD2 . . 4.080 3.233 2.282 4.203 0.123 5 0 "[ . 1 . 2]" 1
33 1 71 LEU MD1 3 28 ALA MB . . 4.090 2.903 1.761 4.142 0.052 16 0 "[ . 1 . 2]" 1
34 1 71 LEU HB3 3 24 THR MG . . 4.940 4.710 4.014 5.194 0.254 4 0 "[ . 1 . 2]" 1
35 1 71 LEU MD2 3 24 THR MG . . 4.440 3.544 1.960 4.585 0.145 20 0 "[ . 1 . 2]" 1
36 1 71 LEU MD2 3 28 ALA MB . . 4.040 2.296 1.739 3.919 . 0 0 "[ . 1 . 2]" 1
37 1 71 LEU QD 3 28 ALA MB . . 3.910 1.896 1.725 2.266 . 0 0 "[ . 1 . 2]" 1
38 1 47 ALA MB 3 51 THR MG . . 4.560 2.845 2.040 3.852 . 0 0 "[ . 1 . 2]" 1
39 1 47 ALA MB 3 47 MET ME . . 3.900 3.241 2.294 3.975 0.075 10 0 "[ . 1 . 2]" 1
40 1 67 ALA MB 3 47 MET ME . . 4.000 2.374 1.745 2.988 . 0 0 "[ . 1 . 2]" 1
41 1 67 ALA MB 3 47 MET QG . . 4.300 3.498 2.824 4.256 . 0 0 "[ . 1 . 2]" 1
42 1 48 GLY H 3 47 MET ME . . 4.500 4.560 4.307 4.812 0.312 2 0 "[ . 1 . 2]" 1
43 1 48 GLY HA2 3 21 LEU MD1 . . 4.560 2.767 1.806 3.835 . 0 0 "[ . 1 . 2]" 1
44 1 48 GLY HA3 3 21 LEU MD1 . . 4.560 3.491 1.953 4.706 0.146 17 0 "[ . 1 . 2]" 1
45 1 48 GLY HA2 3 21 LEU MD2 . . 4.960 3.162 2.044 4.716 . 0 0 "[ . 1 . 2]" 1
46 1 74 LEU HB3 3 31 THR MG . . 4.750 4.225 3.047 4.945 0.195 10 0 "[ . 1 . 2]" 1
47 1 74 LEU MD2 3 31 THR MG . . 4.510 4.105 2.472 4.891 0.381 16 0 "[ . 1 . 2]" 1
48 1 74 LEU MD1 3 31 THR MG . . 4.510 4.063 2.608 4.883 0.373 19 0 "[ . 1 . 2]" 1
49 1 74 LEU HB2 3 31 THR MG . . 4.970 3.673 2.318 4.391 . 0 0 "[ . 1 . 2]" 1
50 1 74 LEU HG 3 31 THR MG . . 4.990 4.410 3.134 5.050 0.060 8 0 "[ . 1 . 2]" 1
51 1 74 LEU HA 3 31 THR MG . . 4.970 2.207 1.729 3.864 . 0 0 "[ . 1 . 2]" 1
52 1 75 ARG H 3 31 THR MG . . 5.170 4.973 4.006 5.494 0.324 3 0 "[ . 1 . 2]" 1
53 1 73 THR HB 3 31 THR MG . . 4.970 4.714 4.086 5.079 0.109 12 0 "[ . 1 . 2]" 1
54 1 74 LEU QB 3 28 ALA MB . . 4.260 2.176 1.925 2.488 . 0 0 "[ . 1 . 2]" 1
55 1 74 LEU MD2 3 24 THR MG . . 4.530 3.527 2.091 4.822 0.292 11 0 "[ . 1 . 2]" 1
56 1 74 LEU HB3 3 24 THR MG . . 4.830 4.634 3.672 5.073 0.243 9 0 "[ . 1 . 2]" 1
57 2 9 VAL MG2 3 33 LEU MD2 . . 4.090 3.131 1.861 4.255 0.165 8 0 "[ . 1 . 2]" 1
58 2 9 VAL MG1 3 33 LEU MD2 . . 4.090 3.351 1.768 5.043 0.953 9 1 "[ . +1 . 2]" 1
59 2 9 VAL MG2 3 33 LEU MD1 . . 4.390 2.820 1.830 4.478 0.088 13 0 "[ . 1 . 2]" 1
60 2 9 VAL MG1 3 33 LEU MD1 . . 4.390 3.428 2.217 4.551 0.161 11 0 "[ . 1 . 2]" 1
61 1 2 MET HA 1 3 GLN H . . 3.050 2.336 2.133 2.630 . 0 0 "[ . 1 . 2]" 1
62 1 2 MET H 2 19 GLU HA . . 3.500 3.316 2.765 3.571 0.071 13 0 "[ . 1 . 2]" 1
63 1 2 MET H 1 2 MET ME . . 3.780 3.786 3.524 3.953 0.173 6 0 "[ . 1 . 2]" 1
64 1 2 MET H 2 18 VAL H . . 3.570 3.361 3.078 3.658 0.088 2 0 "[ . 1 . 2]" 1
65 1 2 MET ME 2 18 VAL H . . 5.460 4.518 4.029 5.522 0.062 6 0 "[ . 1 . 2]" 1
66 1 2 MET HA 1 3 GLN HE21 . . 3.510 2.749 2.163 3.682 0.172 4 0 "[ . 1 . 2]" 1
67 1 2 MET HA 1 3 GLN HE22 . . 3.510 3.014 2.327 3.710 0.200 11 0 "[ . 1 . 2]" 1
68 1 2 MET H 2 17 GLU QG . . 4.780 3.911 2.847 4.901 0.121 6 0 "[ . 1 . 2]" 1
69 1 2 MET HB2 2 64 LYS HA . . 4.740 2.102 1.796 2.360 . 0 0 "[ . 1 . 2]" 1
70 1 2 MET HB2 1 3 GLN H . . 4.220 2.618 1.937 2.832 . 0 0 "[ . 1 . 2]" 1
71 1 2 MET HB3 1 3 GLN H . . 4.220 3.906 3.441 4.054 . 0 0 "[ . 1 . 2]" 1
72 1 2 MET HB3 2 64 LYS HA . . 4.740 3.803 3.381 4.101 . 0 0 "[ . 1 . 2]" 1
73 1 2 MET HG2 1 3 GLN H . . 4.720 3.669 2.679 4.081 . 0 0 "[ . 1 . 2]" 1
74 1 2 MET H 1 2 MET HG2 . . 4.440 3.226 2.960 3.494 . 0 0 "[ . 1 . 2]" 1
75 1 2 MET H 1 2 MET HG3 . . 4.440 4.146 3.852 4.462 0.022 6 0 "[ . 1 . 2]" 1
76 1 2 MET HG3 1 3 GLN H . . 4.720 4.546 3.527 4.856 0.136 14 0 "[ . 1 . 2]" 1
77 1 2 MET ME 2 20 PRO HA . . 3.160 2.078 1.925 2.272 . 0 0 "[ . 1 . 2]" 1
78 1 2 MET ME 2 19 GLU HA . . 4.720 3.533 3.144 3.770 . 0 0 "[ . 1 . 2]" 1
79 1 2 MET ME 2 62 ILE MG . . 3.990 2.374 2.036 2.597 . 0 0 "[ . 1 . 2]" 1
80 1 2 MET ME 2 62 ILE MD . . 3.990 4.096 3.860 4.203 0.213 18 0 "[ . 1 . 2]" 1
81 1 2 MET HG2 2 62 ILE MG . . 4.890 2.884 2.539 3.472 . 0 0 "[ . 1 . 2]" 1
82 1 2 MET HG3 2 62 ILE MG . . 4.890 2.639 1.744 3.052 . 0 0 "[ . 1 . 2]" 1
83 1 3 GLN H 2 65 GLU H . . 3.200 3.092 2.520 3.411 0.211 12 0 "[ . 1 . 2]" 1
84 1 3 GLN H 2 64 LYS HA . . 3.230 2.410 1.956 3.095 . 0 0 "[ . 1 . 2]" 1
85 1 3 GLN HB3 1 4 ILE H . . 4.270 3.271 2.440 4.081 . 0 0 "[ . 1 . 2]" 1
86 1 3 GLN HA 2 18 VAL H . . 3.240 2.964 2.541 3.315 0.075 18 0 "[ . 1 . 2]" 1
87 1 3 GLN HA 1 4 ILE H . . 3.040 2.306 2.129 2.386 . 0 0 "[ . 1 . 2]" 1
88 1 3 GLN HA 2 17 GLU HA . . 3.090 1.853 1.723 2.113 . 0 0 "[ . 1 . 2]" 1
89 1 3 GLN H 1 3 GLN HG2 . . 4.140 2.971 2.058 4.230 0.090 14 0 "[ . 1 . 2]" 1
90 1 3 GLN HA 1 3 GLN HG3 . . 4.060 3.575 2.552 4.295 0.235 5 0 "[ . 1 . 2]" 1
91 1 3 GLN HA 1 3 GLN HG2 . . 4.060 3.719 3.553 3.817 . 0 0 "[ . 1 . 2]" 1
92 1 3 GLN H 1 3 GLN HG3 . . 4.140 3.579 3.293 3.845 . 0 0 "[ . 1 . 2]" 1
93 1 3 GLN H 2 64 LYS HB2 . . 4.020 2.670 2.283 3.053 . 0 0 "[ . 1 . 2]" 1
94 1 3 GLN H 2 64 LYS HB3 . . 4.020 3.065 2.501 3.742 . 0 0 "[ . 1 . 2]" 1
95 1 3 GLN H 1 3 GLN HB2 . . 3.870 3.169 2.568 3.808 . 0 0 "[ . 1 . 2]" 1
96 1 3 GLN H 1 3 GLN HB3 . . 3.870 3.491 3.043 3.771 . 0 0 "[ . 1 . 2]" 1
97 1 3 GLN HA 2 17 GLU HB3 . . 4.710 4.534 4.085 5.116 0.406 9 0 "[ . 1 . 2]" 1
98 1 3 GLN HA 2 17 GLU HB2 . . 4.710 4.078 3.456 4.837 0.127 20 0 "[ . 1 . 2]" 1
99 1 3 GLN HB2 1 4 ILE H . . 4.270 3.270 2.495 4.210 . 0 0 "[ . 1 . 2]" 1
100 1 3 GLN HA 2 18 VAL HB . . 4.970 5.016 4.592 5.373 0.403 7 0 "[ . 1 . 2]" 1
101 1 3 GLN HA 1 4 ILE MD . . 5.020 5.006 2.790 5.296 0.276 9 0 "[ . 1 . 2]" 1
102 1 4 ILE H 2 18 VAL H . . 4.340 4.448 4.285 4.640 0.300 12 0 "[ . 1 . 2]" 1
103 1 4 ILE MG 2 65 GLU H . . 4.990 4.418 3.416 5.204 0.214 12 0 "[ . 1 . 2]" 1
104 1 4 ILE HA 2 65 GLU H . . 3.300 3.349 3.122 3.509 0.209 7 0 "[ . 1 . 2]" 1
105 1 4 ILE HA 2 66 SER H . . 3.600 3.101 2.839 3.324 . 0 0 "[ . 1 . 2]" 1
106 1 4 ILE HA 1 5 PHE H . . 3.150 2.298 2.163 2.392 . 0 0 "[ . 1 . 2]" 1
107 1 4 ILE H 1 4 ILE HB . . 3.920 3.517 2.619 3.947 0.027 16 0 "[ . 1 . 2]" 1
108 1 4 ILE H 2 15 THR MG . . 4.980 4.380 3.733 5.188 0.208 4 0 "[ . 1 . 2]" 1
109 1 4 ILE H 1 4 ILE MG . . 4.070 3.298 2.674 3.999 . 0 0 "[ . 1 . 2]" 1
110 1 4 ILE H 2 17 GLU HA . . 4.080 3.264 3.038 3.579 . 0 0 "[ . 1 . 2]" 1
111 1 4 ILE H 2 16 LEU H . . 3.080 3.082 2.869 3.168 0.088 8 0 "[ . 1 . 2]" 1
112 1 4 ILE MD 2 16 LEU MD1 . . 3.780 2.328 1.791 3.830 0.050 12 0 "[ . 1 . 2]" 1
113 1 4 ILE MD 2 16 LEU MD2 . . 3.780 2.851 2.154 3.773 . 0 0 "[ . 1 . 2]" 1
114 1 4 ILE MG 2 16 LEU MD1 . . 3.980 4.003 2.330 4.425 0.445 20 0 "[ . 1 . 2]" 1
115 1 4 ILE MG 2 16 LEU MD2 . . 3.980 3.900 2.589 4.339 0.359 7 0 "[ . 1 . 2]" 1
116 1 4 ILE HA 2 65 GLU HA . . 3.100 3.181 2.979 3.309 0.209 12 0 "[ . 1 . 2]" 1
117 1 4 ILE HB 1 5 PHE H . . 4.230 3.003 2.383 4.126 . 0 0 "[ . 1 . 2]" 1
118 1 4 ILE MG 2 65 GLU HA . . 4.770 4.762 4.377 4.955 0.185 20 0 "[ . 1 . 2]" 1
119 1 4 ILE MG 1 5 PHE H . . 3.720 3.239 2.088 3.848 0.128 2 0 "[ . 1 . 2]" 1
120 1 4 ILE MG 2 66 SER H . . 4.080 3.517 2.662 4.286 0.206 11 0 "[ . 1 . 2]" 1
121 1 4 ILE HA 1 4 ILE MG . . 3.490 2.440 2.370 2.589 . 0 0 "[ . 1 . 2]" 1
122 1 4 ILE MG 2 66 SER QB . . 4.710 2.778 1.765 3.869 . 0 0 "[ . 1 . 2]" 1
123 1 4 ILE HA 1 4 ILE MD . . 4.420 4.122 3.178 4.288 . 0 0 "[ . 1 . 2]" 1
124 1 4 ILE HB 1 4 ILE MD . . 3.450 2.493 2.341 2.537 . 0 0 "[ . 1 . 2]" 1
125 1 5 PHE HA 1 6 VAL H . . 3.130 2.209 2.131 2.272 . 0 0 "[ . 1 . 2]" 1
126 1 5 PHE HB3 1 6 VAL H . . 4.540 3.664 3.259 3.925 . 0 0 "[ . 1 . 2]" 1
127 1 5 PHE H 2 67 ALA HA . . 3.150 3.112 2.499 3.441 0.291 15 0 "[ . 1 . 2]" 1
128 1 5 PHE H 2 68 LEU H . . 4.300 4.017 3.637 4.428 0.128 10 0 "[ . 1 . 2]" 1
129 1 5 PHE QE 2 15 THR HB . . 4.510 4.360 3.658 4.649 0.139 8 0 "[ . 1 . 2]" 1
130 1 5 PHE QE 2 15 THR MG . . 4.010 2.237 1.896 2.806 . 0 0 "[ . 1 . 2]" 1
131 1 5 PHE QD 2 15 THR HA . . 4.150 2.620 2.216 3.056 . 0 0 "[ . 1 . 2]" 1
132 1 5 PHE HB3 2 13 THR MG . . 4.950 1.998 1.793 2.321 . 0 0 "[ . 1 . 2]" 1
133 1 5 PHE HA 2 15 THR HA . . 3.150 2.564 2.330 2.846 . 0 0 "[ . 1 . 2]" 1
134 1 5 PHE HA 2 14 ILE H . . 4.800 4.380 4.008 4.700 . 0 0 "[ . 1 . 2]" 1
135 1 5 PHE HA 2 16 LEU H . . 3.500 3.710 3.605 3.858 0.358 16 0 "[ . 1 . 2]" 1
136 1 5 PHE QD 2 65 GLU HA . . 4.810 3.743 3.225 3.988 . 0 0 "[ . 1 . 2]" 1
137 1 5 PHE QE 2 65 GLU HA . . 4.260 3.338 2.901 3.615 . 0 0 "[ . 1 . 2]" 1
138 1 5 PHE QE 2 65 GLU H . . 4.960 5.014 4.768 5.142 0.182 7 0 "[ . 1 . 2]" 1
139 1 5 PHE HA 2 13 THR MG . . 5.090 3.312 2.880 3.642 . 0 0 "[ . 1 . 2]" 1
140 1 5 PHE HA 1 6 VAL QG . . 5.050 3.801 3.549 4.017 . 0 0 "[ . 1 . 2]" 1
141 1 5 PHE HB2 1 6 VAL H . . 4.540 4.327 4.123 4.461 . 0 0 "[ . 1 . 2]" 1
142 1 5 PHE HB2 2 13 THR MG . . 4.950 3.315 3.191 3.599 . 0 0 "[ . 1 . 2]" 1
143 1 5 PHE QE 2 65 GLU QG . . 3.720 3.369 2.500 3.907 0.187 16 0 "[ . 1 . 2]" 1
144 1 5 PHE HZ 2 15 THR MG . . 4.930 4.184 3.895 4.436 . 0 0 "[ . 1 . 2]" 1
145 1 5 PHE HZ 2 65 GLU HA . . 4.780 3.766 3.206 4.386 . 0 0 "[ . 1 . 2]" 1
146 1 5 PHE HZ 2 65 GLU HB2 . . 4.380 3.906 2.780 4.641 0.261 8 0 "[ . 1 . 2]" 1
147 1 5 PHE HZ 2 65 GLU HB3 . . 4.380 3.133 2.749 3.632 . 0 0 "[ . 1 . 2]" 1
148 1 5 PHE QD 2 15 THR MG . . 3.630 2.336 1.861 2.854 . 0 0 "[ . 1 . 2]" 1
149 1 5 PHE QD 2 67 ALA MB . . 4.920 2.815 2.102 4.102 . 0 0 "[ . 1 . 2]" 1
150 1 5 PHE H 1 5 PHE QD . . 4.780 3.462 3.034 3.698 . 0 0 "[ . 1 . 2]" 1
151 1 5 PHE QD 2 13 THR MG . . 4.880 3.176 2.639 3.550 . 0 0 "[ . 1 . 2]" 1
152 1 5 PHE QD 2 16 LEU H . . 4.880 4.115 3.583 4.701 . 0 0 "[ . 1 . 2]" 1
153 1 5 PHE HZ 2 65 GLU QG . . 4.780 3.388 1.985 4.896 0.116 20 0 "[ . 1 . 2]" 1
154 1 6 VAL H 2 14 ILE H . . 3.140 3.117 2.975 3.237 0.097 15 0 "[ . 1 . 2]" 1
155 1 6 VAL H 2 15 THR HA . . 3.530 3.573 3.200 3.806 0.276 6 0 "[ . 1 . 2]" 1
156 1 6 VAL H 1 6 VAL QG . . 3.630 2.456 2.083 2.804 . 0 0 "[ . 1 . 2]" 1
157 1 6 VAL HA 1 7 ASP H . . 3.090 2.157 2.058 2.235 . 0 0 "[ . 1 . 2]" 1
158 1 6 VAL HA 2 67 ALA HA . . 4.840 4.772 4.365 4.973 0.133 13 0 "[ . 1 . 2]" 1
159 1 6 VAL HA 2 68 LEU QB . . 4.580 3.085 1.914 4.583 0.003 10 0 "[ . 1 . 2]" 1
160 1 6 VAL QG 2 14 ILE HB . . 4.360 2.758 1.711 3.234 . 0 0 "[ . 1 . 2]" 1
161 1 6 VAL H 2 14 ILE HB . . 3.890 2.885 2.559 3.383 . 0 0 "[ . 1 . 2]" 1
162 1 6 VAL H 2 13 THR MG . . 3.730 3.753 3.528 3.841 0.111 15 0 "[ . 1 . 2]" 1
163 1 7 ASP HA 2 13 THR HA . . 3.170 2.142 1.853 2.323 . 0 0 "[ . 1 . 2]" 1
164 1 7 ASP QB 2 69 ILE H . . 5.000 4.470 4.022 5.027 0.027 8 0 "[ . 1 . 2]" 1
165 1 7 ASP HA 2 14 ILE H . . 4.270 3.185 2.917 3.373 . 0 0 "[ . 1 . 2]" 1
166 1 7 ASP HA 1 8 THR H . . 3.100 2.188 2.121 2.265 . 0 0 "[ . 1 . 2]" 1
167 1 7 ASP H 2 68 LEU H . . 4.100 3.254 2.826 3.922 . 0 0 "[ . 1 . 2]" 1
168 1 7 ASP H 2 70 LEU H . . 3.800 3.869 3.621 4.072 0.272 16 0 "[ . 1 . 2]" 1
169 1 7 ASP QB 2 68 LEU QB . . 5.120 5.057 4.406 5.352 0.232 7 0 "[ . 1 . 2]" 1
170 1 7 ASP H 1 7 ASP QB . . 3.850 2.379 2.258 2.476 . 0 0 "[ . 1 . 2]" 1
171 1 7 ASP HA 1 8 THR MG . . 4.440 3.893 3.673 4.473 0.033 9 0 "[ . 1 . 2]" 1
172 1 7 ASP H 2 69 ILE HA . . 4.140 3.175 2.503 3.742 . 0 0 "[ . 1 . 2]" 1
173 1 8 THR HA 1 9 VAL H . . 3.100 2.161 2.124 2.213 . 0 0 "[ . 1 . 2]" 1
174 1 8 THR H 2 12 LYS H . . 3.500 3.476 3.021 3.690 0.190 9 0 "[ . 1 . 2]" 1
175 1 8 THR HB 2 14 ILE MD . . 4.200 3.813 2.691 4.362 0.162 6 0 "[ . 1 . 2]" 1
176 1 8 THR HB 1 9 VAL H . . 4.440 4.101 3.608 4.398 . 0 0 "[ . 1 . 2]" 1
177 1 8 THR MG 2 14 ILE H . . 4.660 3.996 3.513 4.474 . 0 0 "[ . 1 . 2]" 1
178 1 8 THR MG 1 9 VAL H . . 4.770 4.130 3.764 4.363 . 0 0 "[ . 1 . 2]" 1
179 1 8 THR H 2 14 ILE MD . . 5.070 4.179 3.636 4.973 . 0 0 "[ . 1 . 2]" 1
180 1 8 THR H 2 13 THR HA . . 3.570 3.347 2.829 3.669 0.099 16 0 "[ . 1 . 2]" 1
181 1 9 VAL HB 1 10 GLN H . . 4.890 3.899 2.887 4.269 . 0 0 "[ . 1 . 2]" 1
182 1 9 VAL MG2 1 10 GLN H . . 3.900 2.956 2.395 4.099 0.199 16 0 "[ . 1 . 2]" 1
183 1 9 VAL MG1 1 10 GLN H . . 3.900 4.017 3.918 4.156 0.256 2 0 "[ . 1 . 2]" 1
184 1 10 GLN HA 1 11 TRP H . . 3.500 2.249 2.098 2.340 . 0 0 "[ . 1 . 2]" 1
185 1 10 GLN H 1 11 TRP H . . 4.340 3.812 3.425 4.355 0.015 20 0 "[ . 1 . 2]" 1
186 1 10 GLN QB 1 11 TRP H . . 4.340 3.796 2.808 4.081 . 0 0 "[ . 1 . 2]" 1
187 1 11 TRP HA 1 12 LYS H . . 3.560 2.173 2.120 2.225 . 0 0 "[ . 1 . 2]" 1
188 1 11 TRP HZ3 1 69 ILE MD . . 4.500 3.653 2.485 4.740 0.240 15 0 "[ . 1 . 2]" 1
189 1 11 TRP HZ2 1 69 ILE MD . . 4.500 3.479 2.076 4.549 0.049 13 0 "[ . 1 . 2]" 1
190 1 11 TRP HH2 1 69 ILE MG . . 4.900 4.968 4.610 5.396 0.496 3 0 "[ . 1 . 2]" 1
191 1 12 LYS HA 1 13 THR H . . 3.100 2.197 2.078 2.321 . 0 0 "[ . 1 . 2]" 1
192 1 13 THR HB 1 14 ILE H . . 4.870 4.194 3.144 4.405 . 0 0 "[ . 1 . 2]" 1
193 1 13 THR H 1 13 THR MG . . 4.770 3.762 3.116 3.860 . 0 0 "[ . 1 . 2]" 1
194 1 13 THR HA 1 13 THR MG . . 3.640 2.375 2.258 2.526 . 0 0 "[ . 1 . 2]" 1
195 1 13 THR MG 1 14 ILE H . . 4.030 2.995 2.587 3.377 . 0 0 "[ . 1 . 2]" 1
196 1 13 THR HA 1 14 ILE H . . 3.030 2.186 2.140 2.235 . 0 0 "[ . 1 . 2]" 1
197 1 14 ILE HB 1 15 THR H . . 4.780 3.932 3.272 4.367 . 0 0 "[ . 1 . 2]" 1
198 1 14 ILE MD 1 15 THR H . . 4.360 4.225 3.864 4.750 0.390 15 0 "[ . 1 . 2]" 1
199 1 14 ILE MG 1 15 THR H . . 4.860 2.516 1.756 3.197 . 0 0 "[ . 1 . 2]" 1
200 1 14 ILE HA 1 15 THR HA . . 4.740 4.507 4.456 4.576 . 0 0 "[ . 1 . 2]" 1
201 1 14 ILE HA 1 14 ILE MG . . 3.230 2.418 2.333 2.520 . 0 0 "[ . 1 . 2]" 1
202 1 14 ILE H 1 14 ILE MG . . 4.390 3.883 3.835 3.926 . 0 0 "[ . 1 . 2]" 1
203 1 14 ILE HB 1 14 ILE MD . . 3.390 3.086 2.462 3.297 . 0 0 "[ . 1 . 2]" 1
204 1 15 THR HB 1 16 LEU H . . 4.360 4.052 3.246 4.340 . 0 0 "[ . 1 . 2]" 1
205 1 15 THR HA 1 16 LEU H . . 3.110 2.151 2.103 2.191 . 0 0 "[ . 1 . 2]" 1
206 1 15 THR HA 1 16 LEU QB . . 5.000 4.527 4.468 4.621 . 0 0 "[ . 1 . 2]" 1
207 1 15 THR MG 1 16 LEU H . . 3.990 3.124 2.632 4.055 0.065 14 0 "[ . 1 . 2]" 1
208 1 16 LEU H 1 16 LEU MD2 . . 4.630 2.493 1.807 3.662 . 0 0 "[ . 1 . 2]" 1
209 1 16 LEU HA 1 17 GLU H . . 3.080 2.426 2.262 2.575 . 0 0 "[ . 1 . 2]" 1
210 1 16 LEU QB 1 17 GLU H . . 3.510 2.441 2.256 2.867 . 0 0 "[ . 1 . 2]" 1
211 1 16 LEU H 1 16 LEU QB . . 3.580 3.158 2.916 3.259 . 0 0 "[ . 1 . 2]" 1
212 1 16 LEU H 1 16 LEU MD1 . . 4.630 3.615 1.847 4.342 . 0 0 "[ . 1 . 2]" 1
213 1 16 LEU HA 1 16 LEU MD1 . . 3.980 3.988 3.555 4.192 0.212 16 0 "[ . 1 . 2]" 1
214 1 16 LEU HA 1 16 LEU MD2 . . 3.980 3.722 3.600 4.166 0.186 18 0 "[ . 1 . 2]" 1
215 1 17 GLU H 1 18 VAL H . . 5.300 4.448 4.271 4.593 . 0 0 "[ . 1 . 2]" 1
216 1 17 GLU HA 1 18 VAL H . . 3.100 2.200 2.091 2.352 . 0 0 "[ . 1 . 2]" 1
217 1 17 GLU H 1 17 GLU QG . . 4.240 3.784 3.066 4.241 0.001 18 0 "[ . 1 . 2]" 1
218 1 17 GLU HA 1 17 GLU QG . . 3.330 2.402 2.260 2.567 . 0 0 "[ . 1 . 2]" 1
219 1 17 GLU QG 1 18 VAL H . . 3.610 3.125 2.013 3.672 0.062 4 0 "[ . 1 . 2]" 1
220 1 17 GLU H 1 17 GLU HB2 . . 3.620 2.662 2.255 3.092 . 0 0 "[ . 1 . 2]" 1
221 1 17 GLU H 1 17 GLU HB3 . . 3.620 3.094 2.505 3.692 0.072 16 0 "[ . 1 . 2]" 1
222 1 18 VAL MG1 1 19 GLU H . . 4.220 3.355 3.146 3.511 . 0 0 "[ . 1 . 2]" 1
223 1 18 VAL HA 1 19 GLU H . . 3.290 2.503 2.380 2.645 . 0 0 "[ . 1 . 2]" 1
224 1 18 VAL MG2 1 19 GLU H . . 4.220 2.278 1.763 3.663 . 0 0 "[ . 1 . 2]" 1
225 1 18 VAL H 1 18 VAL MG1 . . 4.120 2.631 2.087 3.400 . 0 0 "[ . 1 . 2]" 1
226 1 18 VAL HB 1 19 GLU H . . 3.980 3.517 2.085 4.029 0.049 19 0 "[ . 1 . 2]" 1
227 1 18 VAL H 1 18 VAL MG2 . . 4.120 3.579 2.126 4.102 . 0 0 "[ . 1 . 2]" 1
228 1 19 GLU HB2 1 22 ASP H . . 4.090 3.146 2.485 4.189 0.099 13 0 "[ . 1 . 2]" 1
229 1 19 GLU HB3 1 22 ASP H . . 4.090 3.506 2.868 4.398 0.308 13 0 "[ . 1 . 2]" 1
230 1 19 GLU H 1 21 SER H . . 5.300 5.199 4.812 5.384 0.084 11 0 "[ . 1 . 2]" 1
231 1 19 GLU HA 1 20 PRO HD2 . . 3.370 2.420 2.225 2.731 . 0 0 "[ . 1 . 2]" 1
232 1 19 GLU HA 1 21 SER H . . 4.160 4.149 3.902 4.333 0.173 2 0 "[ . 1 . 2]" 1
233 1 19 GLU HA 1 20 PRO HD3 . . 3.370 2.418 1.911 2.628 . 0 0 "[ . 1 . 2]" 1
234 1 19 GLU H 1 20 PRO HD2 . . 5.150 4.944 4.864 5.254 0.104 19 0 "[ . 1 . 2]" 1
235 1 19 GLU HB3 1 20 PRO HD2 . . 5.130 2.471 1.998 3.759 . 0 0 "[ . 1 . 2]" 1
236 1 19 GLU H 1 20 PRO HD3 . . 5.150 5.065 4.607 5.169 0.019 13 0 "[ . 1 . 2]" 1
237 1 19 GLU H 1 19 GLU HG2 . . 4.260 3.349 2.638 4.320 0.060 19 0 "[ . 1 . 2]" 1
238 1 19 GLU HA 1 19 GLU HG2 . . 3.780 3.014 2.528 3.818 0.038 13 0 "[ . 1 . 2]" 1
239 1 19 GLU H 1 19 GLU HG3 . . 4.260 3.873 2.917 4.243 . 0 0 "[ . 1 . 2]" 1
240 1 19 GLU HA 1 19 GLU HG3 . . 3.780 3.527 2.471 3.838 0.058 1 0 "[ . 1 . 2]" 1
241 1 19 GLU HB3 1 20 PRO HD3 . . 5.130 3.817 3.347 4.870 . 0 0 "[ . 1 . 2]" 1
242 1 19 GLU HB2 1 20 PRO HD2 . . 5.130 3.815 2.212 4.477 . 0 0 "[ . 1 . 2]" 1
243 1 19 GLU HB2 1 20 PRO HD3 . . 5.130 4.823 3.693 5.158 0.028 11 0 "[ . 1 . 2]" 1
244 1 19 GLU HA 1 20 PRO HG2 . . 4.890 4.559 4.431 4.683 . 0 0 "[ . 1 . 2]" 1
245 1 19 GLU HA 1 20 PRO HG3 . . 4.890 4.558 4.084 4.726 . 0 0 "[ . 1 . 2]" 1
246 1 19 GLU H 1 57 LEU HG . . 5.080 3.647 3.331 3.826 . 0 0 "[ . 1 . 2]" 1
247 1 19 GLU H 1 57 LEU MD1 . . 4.700 4.783 4.438 4.920 0.220 1 0 "[ . 1 . 2]" 1
248 1 19 GLU H 1 57 LEU MD2 . . 4.700 3.997 3.482 4.425 . 0 0 "[ . 1 . 2]" 1
249 1 19 GLU H 1 22 ASP H . . 4.200 4.119 3.519 4.464 0.264 19 0 "[ . 1 . 2]" 1
250 1 20 PRO HA 1 22 ASP H . . 3.920 3.969 3.816 4.062 0.142 1 0 "[ . 1 . 2]" 1
251 1 20 PRO HA 1 58 SER H . . 3.770 3.099 2.838 3.458 . 0 0 "[ . 1 . 2]" 1
252 1 20 PRO HD2 1 21 SER H . . 4.860 2.827 2.573 3.050 . 0 0 "[ . 1 . 2]" 1
253 1 20 PRO HD3 1 21 SER H . . 4.860 3.957 3.826 4.093 . 0 0 "[ . 1 . 2]" 1
254 1 20 PRO HG2 1 21 SER H . . 4.900 2.704 2.374 4.226 . 0 0 "[ . 1 . 2]" 1
255 1 20 PRO HG3 1 21 SER H . . 4.900 4.099 3.893 4.667 . 0 0 "[ . 1 . 2]" 1
256 1 20 PRO HA 1 57 LEU HG . . 4.600 3.881 3.398 4.286 . 0 0 "[ . 1 . 2]" 1
257 1 21 SER HB3 1 56 THR MG . . 5.060 4.557 4.171 5.133 0.073 15 0 "[ . 1 . 2]" 1
258 1 21 SER HB2 1 22 ASP H . . 4.440 3.590 3.187 4.216 . 0 0 "[ . 1 . 2]" 1
259 1 21 SER H 1 22 ASP H . . 3.340 2.514 2.401 2.625 . 0 0 "[ . 1 . 2]" 1
260 1 21 SER H 1 21 SER HB3 . . 3.700 3.461 2.706 3.685 . 0 0 "[ . 1 . 2]" 1
261 1 21 SER H 1 21 SER HB2 . . 3.700 2.748 2.437 3.610 . 0 0 "[ . 1 . 2]" 1
262 1 21 SER HB3 1 22 ASP H . . 4.440 4.322 4.189 4.443 0.003 6 0 "[ . 1 . 2]" 1
263 1 21 SER HB2 1 56 THR MG . . 5.060 4.976 4.224 5.266 0.206 18 0 "[ . 1 . 2]" 1
264 1 21 SER HA 1 56 THR MG . . 4.110 2.957 2.593 3.254 . 0 0 "[ . 1 . 2]" 1
265 1 21 SER HA 1 22 ASP H . . 3.410 3.387 3.251 3.486 0.076 13 0 "[ . 1 . 2]" 1
266 1 22 ASP H 1 22 ASP HB2 . . 3.510 2.430 2.153 3.712 0.202 8 0 "[ . 1 . 2]" 1
267 1 22 ASP H 1 22 ASP HB3 . . 3.510 3.291 2.429 3.634 0.124 12 0 "[ . 1 . 2]" 1
268 1 22 ASP H 1 57 LEU H . . 4.100 4.161 3.905 4.327 0.227 13 0 "[ . 1 . 2]" 1
269 1 22 ASP HB3 1 26 ASN HD22 . . 4.500 3.543 2.591 4.940 0.440 5 0 "[ . 1 . 2]" 1
270 1 22 ASP HB2 1 26 ASN HD22 . . 4.500 4.545 4.149 4.764 0.264 2 0 "[ . 1 . 2]" 1
271 1 22 ASP HB3 1 26 ASN HD21 . . 4.500 2.450 1.735 3.888 . 0 0 "[ . 1 . 2]" 1
272 1 22 ASP HB2 1 26 ASN HD21 . . 4.500 3.614 3.076 4.524 0.024 2 0 "[ . 1 . 2]" 1
273 1 22 ASP HA 1 23 THR H . . 3.100 2.345 2.219 2.546 . 0 0 "[ . 1 . 2]" 1
274 1 22 ASP HA 1 23 THR MG . . 4.190 4.185 4.019 4.281 0.091 12 0 "[ . 1 . 2]" 1
275 1 23 THR HA 1 56 THR H . . 4.950 4.546 4.365 4.712 . 0 0 "[ . 1 . 2]" 1
276 1 23 THR HB 1 24 ILE MD . . 5.170 5.199 5.050 5.304 0.134 12 0 "[ . 1 . 2]" 1
277 1 23 THR HB 1 25 GLU HA . . 4.750 4.797 4.251 4.975 0.225 8 0 "[ . 1 . 2]" 1
278 1 23 THR HB 1 24 ILE HB . . 4.240 4.282 4.066 4.395 0.155 6 0 "[ . 1 . 2]" 1
279 1 23 THR HB 1 24 ILE HA . . 4.600 4.642 4.532 4.739 0.139 3 0 "[ . 1 . 2]" 1
280 1 23 THR HB 1 25 GLU QG . . 4.220 2.596 1.896 4.387 0.167 3 0 "[ . 1 . 2]" 1
281 1 23 THR HB 1 25 GLU H . . 3.220 2.239 1.975 2.379 . 0 0 "[ . 1 . 2]" 1
282 1 23 THR HB 1 24 ILE H . . 3.650 2.504 2.331 2.699 . 0 0 "[ . 1 . 2]" 1
283 1 23 THR H 1 56 THR HA . . 4.500 4.512 4.365 4.629 0.129 16 0 "[ . 1 . 2]" 1
284 1 23 THR HA 1 24 ILE H . . 3.530 2.317 2.245 2.397 . 0 0 "[ . 1 . 2]" 1
285 1 23 THR HA 1 56 THR HA . . 3.500 1.957 1.728 2.243 . 0 0 "[ . 1 . 2]" 1
286 1 23 THR HA 1 57 LEU H . . 4.610 3.428 2.991 3.989 . 0 0 "[ . 1 . 2]" 1
287 1 23 THR MG 1 24 ILE H . . 3.720 3.280 3.152 3.512 . 0 0 "[ . 1 . 2]" 1
288 1 23 THR H 1 23 THR MG . . 3.200 2.910 2.612 3.075 . 0 0 "[ . 1 . 2]" 1
289 1 23 THR MG 1 56 THR HA . . 4.100 3.120 2.715 3.642 . 0 0 "[ . 1 . 2]" 1
290 1 23 THR MG 1 24 ILE HB . . 4.990 5.082 5.022 5.170 0.180 5 0 "[ . 1 . 2]" 1
291 1 23 THR MG 1 25 GLU QB . . 4.720 4.190 3.036 4.588 . 0 0 "[ . 1 . 2]" 1
292 1 23 THR HA 1 56 THR MG . . 3.650 3.152 2.512 3.558 . 0 0 "[ . 1 . 2]" 1
293 1 24 ILE H 1 24 ILE MG . . 4.780 3.795 3.772 3.820 . 0 0 "[ . 1 . 2]" 1
294 1 24 ILE MG 1 25 GLU H . . 4.500 3.833 3.676 4.017 . 0 0 "[ . 1 . 2]" 1
295 1 24 ILE MG 1 53 ASP H . . 4.600 4.302 3.718 4.748 0.148 3 0 "[ . 1 . 2]" 1
296 1 24 ILE H 1 55 ARG H . . 5.020 3.709 3.293 4.101 . 0 0 "[ . 1 . 2]" 1
297 1 24 ILE MD 1 55 ARG H . . 4.500 4.783 4.641 4.894 0.394 5 0 "[ . 1 . 2]" 1
298 1 24 ILE MD 1 56 THR H . . 4.500 4.353 4.090 4.511 0.011 11 0 "[ . 1 . 2]" 1
299 1 24 ILE HA 1 27 VAL H . . 4.080 3.250 3.005 3.530 . 0 0 "[ . 1 . 2]" 1
300 1 24 ILE HA 1 24 ILE MG . . 3.500 2.436 2.399 2.513 . 0 0 "[ . 1 . 2]" 1
301 1 24 ILE HA 1 25 GLU H . . 3.500 3.497 3.435 3.545 0.045 16 0 "[ . 1 . 2]" 1
302 1 24 ILE HA 1 27 VAL HB . . 4.080 3.315 2.669 3.867 . 0 0 "[ . 1 . 2]" 1
303 1 24 ILE MG 1 25 GLU HA . . 4.890 3.951 3.710 4.204 . 0 0 "[ . 1 . 2]" 1
304 1 24 ILE H 1 56 THR HA . . 3.740 3.225 2.580 3.593 . 0 0 "[ . 1 . 2]" 1
305 1 24 ILE HB 1 53 ASP HA . . 3.700 2.153 1.723 3.679 . 0 0 "[ . 1 . 2]" 1
306 1 24 ILE MG 1 52 GLU HA . . 5.200 4.547 3.928 5.014 . 0 0 "[ . 1 . 2]" 1
307 1 24 ILE HB 1 25 GLU H . . 4.830 2.923 2.748 3.134 . 0 0 "[ . 1 . 2]" 1
308 1 24 ILE H 1 25 GLU H . . 3.100 2.551 2.450 2.682 . 0 0 "[ . 1 . 2]" 1
309 1 24 ILE H 1 24 ILE HB . . 4.020 2.586 2.500 2.694 . 0 0 "[ . 1 . 2]" 1
310 1 24 ILE MD 1 57 LEU MD1 . . 3.900 2.344 2.006 2.845 . 0 0 "[ . 1 . 2]" 1
311 1 24 ILE MG 1 57 LEU HA . . 4.950 5.147 5.017 5.239 0.289 5 0 "[ . 1 . 2]" 1
312 1 24 ILE MD 1 57 LEU MD2 . . 3.900 1.960 1.739 2.355 . 0 0 "[ . 1 . 2]" 1
313 1 24 ILE MG 1 57 LEU MD2 . . 4.200 3.962 3.516 4.280 0.080 16 0 "[ . 1 . 2]" 1
314 1 24 ILE MG 1 57 LEU MD1 . . 4.200 3.940 3.552 4.294 0.094 12 0 "[ . 1 . 2]" 1
315 1 24 ILE H 1 56 THR MG . . 4.880 4.846 4.312 5.076 0.196 14 0 "[ . 1 . 2]" 1
316 1 24 ILE HA 1 28 LYS H . . 4.750 4.339 4.037 4.505 . 0 0 "[ . 1 . 2]" 1
317 1 24 ILE MG 1 27 VAL H . . 4.640 4.189 3.966 4.389 . 0 0 "[ . 1 . 2]" 1
318 1 24 ILE MG 1 55 ARG H . . 5.300 4.546 4.239 5.135 . 0 0 "[ . 1 . 2]" 1
319 1 24 ILE MG 1 53 ASP HA . . 3.740 2.765 2.312 3.608 . 0 0 "[ . 1 . 2]" 1
320 1 24 ILE H 1 24 ILE MD . . 3.840 3.134 2.946 3.304 . 0 0 "[ . 1 . 2]" 1
321 1 24 ILE MD 1 56 THR HA . . 5.010 3.756 3.505 3.952 . 0 0 "[ . 1 . 2]" 1
322 1 24 ILE MD 1 51 LEU HA . . 4.220 4.193 3.812 4.390 0.170 14 0 "[ . 1 . 2]" 1
323 1 24 ILE HA 1 24 ILE MD . . 3.280 2.231 2.107 2.331 . 0 0 "[ . 1 . 2]" 1
324 1 24 ILE MD 1 60 TYR QE . . 4.020 2.610 2.058 4.003 . 0 0 "[ . 1 . 2]" 1
325 1 24 ILE MD 1 60 TYR QD . . 4.520 2.407 1.811 3.539 . 0 0 "[ . 1 . 2]" 1
326 1 25 GLU H 1 27 VAL H . . 4.500 4.422 4.192 4.606 0.106 12 0 "[ . 1 . 2]" 1
327 1 25 GLU H 1 26 ASN H . . 3.100 2.730 2.585 3.059 . 0 0 "[ . 1 . 2]" 1
328 1 25 GLU QB 1 26 ASN H . . 3.930 3.432 2.499 3.721 . 0 0 "[ . 1 . 2]" 1
329 1 25 GLU HA 1 29 ALA MB . . 4.740 4.445 4.063 4.666 . 0 0 "[ . 1 . 2]" 1
330 1 25 GLU HA 1 28 LYS H . . 4.050 3.443 3.111 3.942 . 0 0 "[ . 1 . 2]" 1
331 1 25 GLU HA 1 28 LYS QG . . 4.410 3.450 1.973 4.463 0.053 5 0 "[ . 1 . 2]" 1
332 1 25 GLU HA 1 29 ALA H . . 4.410 3.888 3.707 4.268 . 0 0 "[ . 1 . 2]" 1
333 1 25 GLU H 1 53 ASP HA . . 4.660 3.461 2.811 4.454 . 0 0 "[ . 1 . 2]" 1
334 1 25 GLU H 1 25 GLU QG . . 4.920 2.653 2.052 4.006 . 0 0 "[ . 1 . 2]" 1
335 1 25 GLU QG 1 26 ASN HA . . 4.070 3.647 3.243 4.327 0.257 7 0 "[ . 1 . 2]" 1
336 1 25 GLU QG 1 26 ASN H . . 3.820 2.656 2.219 3.749 . 0 0 "[ . 1 . 2]" 1
337 1 25 GLU HA 1 25 GLU QG . . 3.650 3.332 2.583 3.516 . 0 0 "[ . 1 . 2]" 1
338 1 26 ASN HA 1 29 ALA H . . 4.200 3.591 3.210 3.971 . 0 0 "[ . 1 . 2]" 1
339 1 26 ASN HA 1 27 VAL H . . 3.570 3.574 3.538 3.611 0.041 17 0 "[ . 1 . 2]" 1
340 1 26 ASN HB3 1 27 VAL H . . 4.570 3.156 2.074 3.863 . 0 0 "[ . 1 . 2]" 1
341 1 26 ASN H 1 27 VAL H . . 3.160 2.744 2.494 2.930 . 0 0 "[ . 1 . 2]" 1
342 1 26 ASN H 1 26 ASN HB2 . . 3.700 2.596 2.298 3.680 . 0 0 "[ . 1 . 2]" 1
343 1 26 ASN H 1 26 ASN HB3 . . 3.700 3.195 2.462 3.661 . 0 0 "[ . 1 . 2]" 1
344 1 26 ASN HA 1 30 LYS H . . 4.510 4.202 3.985 4.382 . 0 0 "[ . 1 . 2]" 1
345 1 26 ASN HA 1 27 VAL HA . . 4.810 4.866 4.725 4.938 0.128 20 0 "[ . 1 . 2]" 1
346 1 26 ASN HB2 1 27 VAL H . . 4.570 3.003 2.276 4.002 . 0 0 "[ . 1 . 2]" 1
347 1 26 ASN HA 1 29 ALA MB . . 3.800 2.747 2.326 3.349 . 0 0 "[ . 1 . 2]" 1
348 1 27 VAL H 1 28 LYS H . . 3.130 2.691 2.575 2.831 . 0 0 "[ . 1 . 2]" 1
349 1 27 VAL H 1 27 VAL HB . . 3.470 2.622 2.516 2.795 . 0 0 "[ . 1 . 2]" 1
350 1 27 VAL H 1 27 VAL MG2 . . 3.770 2.086 1.841 3.846 0.076 17 0 "[ . 1 . 2]" 1
351 1 27 VAL HA 1 30 LYS H . . 4.070 3.506 3.230 3.780 . 0 0 "[ . 1 . 2]" 1
352 1 27 VAL HA 1 27 VAL MG2 . . 3.260 2.494 2.341 2.572 . 0 0 "[ . 1 . 2]" 1
353 1 27 VAL HA 1 28 LYS HA . . 4.920 4.909 4.723 4.993 0.073 14 0 "[ . 1 . 2]" 1
354 1 27 VAL HB 1 28 LYS H . . 3.960 2.541 2.230 4.032 0.072 17 0 "[ . 1 . 2]" 1
355 1 27 VAL HA 1 30 LYS QG . . 4.920 2.898 1.934 3.744 . 0 0 "[ . 1 . 2]" 1
356 1 27 VAL H 1 30 LYS QG . . 4.830 4.517 4.031 4.993 0.163 12 0 "[ . 1 . 2]" 1
357 1 27 VAL H 1 27 VAL MG1 . . 3.770 3.736 2.259 3.836 0.066 8 0 "[ . 1 . 2]" 1
358 1 27 VAL HA 1 27 VAL MG1 . . 3.260 2.496 2.410 3.279 0.019 17 0 "[ . 1 . 2]" 1
359 1 28 LYS H 1 29 ALA H . . 3.250 2.766 2.538 2.927 . 0 0 "[ . 1 . 2]" 1
360 1 28 LYS HA 1 31 ILE H . . 5.030 3.850 3.219 4.197 . 0 0 "[ . 1 . 2]" 1
361 1 28 LYS HA 1 32 GLN H . . 4.730 4.160 3.800 4.323 . 0 0 "[ . 1 . 2]" 1
362 1 28 LYS H 1 28 LYS QG . . 3.920 3.574 2.125 4.042 0.122 9 0 "[ . 1 . 2]" 1
363 1 28 LYS QG 1 29 ALA HA . . 4.880 3.905 3.261 4.718 . 0 0 "[ . 1 . 2]" 1
364 1 28 LYS HA 1 31 ILE MG . . 4.310 4.026 3.564 4.426 0.116 3 0 "[ . 1 . 2]" 1
365 1 28 LYS HA 1 31 ILE MD . . 4.020 2.506 2.146 3.085 . 0 0 "[ . 1 . 2]" 1
366 1 29 ALA HA 1 32 GLN H . . 3.970 3.544 3.359 3.735 . 0 0 "[ . 1 . 2]" 1
367 1 29 ALA HA 1 32 GLN HB3 . . 4.090 2.399 2.135 2.637 . 0 0 "[ . 1 . 2]" 1
368 1 29 ALA HA 1 32 GLN HB2 . . 4.090 3.281 2.997 3.681 . 0 0 "[ . 1 . 2]" 1
369 1 29 ALA HA 1 39 PRO QD . . 4.780 4.896 4.331 5.148 0.368 8 0 "[ . 1 . 2]" 1
370 1 29 ALA H 1 30 LYS H . . 3.100 2.598 2.556 2.682 . 0 0 "[ . 1 . 2]" 1
371 1 30 LYS HB3 1 31 ILE H . . 4.160 3.614 2.986 4.019 . 0 0 "[ . 1 . 2]" 1
372 1 30 LYS H 1 31 ILE H . . 3.290 2.649 2.412 2.807 . 0 0 "[ . 1 . 2]" 1
373 1 30 LYS HA 1 33 ASP HB2 . . 3.610 3.180 2.751 3.716 0.106 7 0 "[ . 1 . 2]" 1
374 1 30 LYS HA 1 34 LYS QG . . 3.460 3.514 3.256 3.718 0.258 5 0 "[ . 1 . 2]" 1
375 1 30 LYS HA 1 34 LYS H . . 5.240 3.943 3.648 4.229 . 0 0 "[ . 1 . 2]" 1
376 1 30 LYS H 1 30 LYS QE . . 4.620 4.020 3.031 4.777 0.157 1 0 "[ . 1 . 2]" 1
377 1 30 LYS QE 1 30 LYS QG . . 3.160 2.345 2.176 2.454 . 0 0 "[ . 1 . 2]" 1
378 1 30 LYS HA 1 33 ASP HB3 . . 3.610 2.505 2.079 2.973 . 0 0 "[ . 1 . 2]" 1
379 1 30 LYS HB2 1 31 ILE H . . 4.160 2.999 2.486 4.073 . 0 0 "[ . 1 . 2]" 1
380 1 30 LYS HA 1 30 LYS QD . . 4.980 3.162 1.958 4.611 . 0 0 "[ . 1 . 2]" 1
381 1 30 LYS H 1 30 LYS QD . . 4.550 3.891 2.628 4.452 . 0 0 "[ . 1 . 2]" 1
382 1 30 LYS H 1 30 LYS QG . . 4.220 2.598 2.318 3.763 . 0 0 "[ . 1 . 2]" 1
383 1 31 ILE HB 1 32 GLN H . . 4.050 3.939 3.828 4.031 . 0 0 "[ . 1 . 2]" 1
384 1 31 ILE H 1 31 ILE HB . . 3.650 3.688 3.657 3.723 0.073 4 0 "[ . 1 . 2]" 1
385 1 31 ILE H 1 31 ILE MG . . 3.620 2.325 2.186 2.473 . 0 0 "[ . 1 . 2]" 1
386 1 31 ILE HA 1 35 GLU H . . 5.060 3.043 2.715 3.630 . 0 0 "[ . 1 . 2]" 1
387 1 31 ILE HA 1 34 LYS H . . 4.530 3.404 3.126 3.813 . 0 0 "[ . 1 . 2]" 1
388 1 31 ILE HA 1 31 ILE MG . . 3.150 2.363 2.298 2.421 . 0 0 "[ . 1 . 2]" 1
389 1 31 ILE HA 1 35 GLU QB . . 4.450 3.512 2.906 4.012 . 0 0 "[ . 1 . 2]" 1
390 1 31 ILE H 1 32 GLN H . . 3.280 2.577 2.486 2.648 . 0 0 "[ . 1 . 2]" 1
391 1 31 ILE HB 1 37 ILE HB . . 5.160 3.613 2.788 5.347 0.187 15 0 "[ . 1 . 2]" 1
392 1 31 ILE HA 1 34 LYS QB . . 4.190 2.910 2.413 3.318 . 0 0 "[ . 1 . 2]" 1
393 1 31 ILE HB 1 37 ILE HG12 . . 4.920 4.349 2.559 5.186 0.266 12 0 "[ . 1 . 2]" 1
394 1 31 ILE HB 1 37 ILE HG13 . . 4.920 3.606 2.943 3.984 . 0 0 "[ . 1 . 2]" 1
395 1 31 ILE HA 1 34 LYS QG . . 4.830 3.810 3.040 4.365 . 0 0 "[ . 1 . 2]" 1
396 1 31 ILE MG 1 32 GLN H . . 4.540 4.053 3.890 4.173 . 0 0 "[ . 1 . 2]" 1
397 1 31 ILE MD 1 32 GLN H . . 4.840 3.720 2.400 4.128 . 0 0 "[ . 1 . 2]" 1
398 1 31 ILE H 1 31 ILE MD . . 4.460 3.656 3.496 3.816 . 0 0 "[ . 1 . 2]" 1
399 1 31 ILE HA 1 31 ILE MD . . 4.100 4.163 3.789 4.265 0.165 5 0 "[ . 1 . 2]" 1
400 1 31 ILE HB 1 31 ILE MD . . 3.710 2.492 2.352 2.573 . 0 0 "[ . 1 . 2]" 1
401 1 31 ILE HB 1 37 ILE MD . . 3.730 2.009 1.683 3.338 . 0 0 "[ . 1 . 2]" 1
402 1 31 ILE MG 1 70 LEU MD1 . . 4.040 3.150 1.755 4.096 0.056 13 0 "[ . 1 . 2]" 1
403 1 31 ILE MG 1 70 LEU MD2 . . 4.040 3.519 1.823 4.108 0.068 20 0 "[ . 1 . 2]" 1
404 1 31 ILE MD 1 70 LEU MD1 . . 4.040 2.519 1.917 3.872 . 0 0 "[ . 1 . 2]" 1
405 1 31 ILE MD 1 70 LEU MD2 . . 4.040 2.401 1.813 3.571 . 0 0 "[ . 1 . 2]" 1
406 1 32 GLN H 1 32 GLN HB2 . . 4.010 2.521 2.395 2.707 . 0 0 "[ . 1 . 2]" 1
407 1 32 GLN H 1 32 GLN HB3 . . 4.010 2.545 2.415 2.723 . 0 0 "[ . 1 . 2]" 1
408 1 32 GLN HA 1 37 ILE H . . 3.810 2.280 1.852 2.618 . 0 0 "[ . 1 . 2]" 1
409 1 32 GLN HB3 1 33 ASP H . . 3.930 2.681 2.470 2.943 . 0 0 "[ . 1 . 2]" 1
410 1 32 GLN H 1 33 ASP H . . 3.240 2.638 2.532 2.729 . 0 0 "[ . 1 . 2]" 1
411 1 32 GLN HA 1 35 GLU H . . 4.440 4.391 4.125 4.493 0.053 7 0 "[ . 1 . 2]" 1
412 1 32 GLN HA 1 36 GLY H . . 3.450 3.142 2.875 3.496 0.046 8 0 "[ . 1 . 2]" 1
413 1 32 GLN HB2 1 33 ASP H . . 3.930 3.904 3.773 3.997 0.067 9 0 "[ . 1 . 2]" 1
414 1 33 ASP H 1 33 ASP HB3 . . 3.080 2.493 2.395 2.622 . 0 0 "[ . 1 . 2]" 1
415 1 33 ASP H 1 33 ASP HB2 . . 3.080 2.541 2.432 2.628 . 0 0 "[ . 1 . 2]" 1
416 1 33 ASP H 1 34 LYS H . . 3.110 2.589 2.507 2.708 . 0 0 "[ . 1 . 2]" 1
417 1 33 ASP HB3 1 34 LYS H . . 3.680 2.489 2.398 2.610 . 0 0 "[ . 1 . 2]" 1
418 1 33 ASP H 1 35 GLU H . . 5.110 4.389 4.082 4.802 . 0 0 "[ . 1 . 2]" 1
419 1 33 ASP HB2 1 34 LYS H . . 3.680 3.786 3.724 3.834 0.154 12 0 "[ . 1 . 2]" 1
420 1 34 LYS H 1 37 ILE H . . 5.390 5.294 5.085 5.450 0.060 4 0 "[ . 1 . 2]" 1
421 1 34 LYS H 1 36 GLY H . . 4.090 3.641 3.491 3.891 . 0 0 "[ . 1 . 2]" 1
422 1 34 LYS H 1 35 GLU H . . 3.170 2.619 2.442 2.855 . 0 0 "[ . 1 . 2]" 1
423 1 34 LYS H 1 34 LYS QB . . 3.100 2.467 2.307 2.597 . 0 0 "[ . 1 . 2]" 1
424 1 34 LYS H 1 34 LYS QG . . 3.380 2.400 2.274 2.537 . 0 0 "[ . 1 . 2]" 1
425 1 34 LYS QB 1 35 GLU H . . 3.460 2.340 2.033 2.840 . 0 0 "[ . 1 . 2]" 1
426 1 34 LYS QB 1 36 GLY H . . 4.650 4.330 4.052 4.669 0.019 8 0 "[ . 1 . 2]" 1
427 1 34 LYS H 1 34 LYS QD . . 4.180 3.607 3.085 4.331 0.151 11 0 "[ . 1 . 2]" 1
428 1 34 LYS HA 1 34 LYS QG . . 3.190 2.965 2.482 3.197 0.007 15 0 "[ . 1 . 2]" 1
429 1 34 LYS QE 1 34 LYS QG . . 3.260 2.297 2.156 2.462 . 0 0 "[ . 1 . 2]" 1
430 1 34 LYS QG 1 35 GLU H . . 4.320 3.970 3.779 4.299 . 0 0 "[ . 1 . 2]" 1
431 1 35 GLU HA 1 37 ILE H . . 5.080 4.826 4.558 5.069 . 0 0 "[ . 1 . 2]" 1
432 1 35 GLU H 1 36 GLY H . . 3.200 2.312 2.096 2.445 . 0 0 "[ . 1 . 2]" 1
433 1 35 GLU H 1 37 ILE H . . 4.560 3.810 3.522 4.019 . 0 0 "[ . 1 . 2]" 1
434 1 35 GLU H 1 35 GLU HG2 . . 4.530 3.639 2.333 4.601 0.071 4 0 "[ . 1 . 2]" 1
435 1 35 GLU H 1 35 GLU HG3 . . 4.530 3.884 2.452 4.545 0.015 20 0 "[ . 1 . 2]" 1
436 1 35 GLU H 1 35 GLU QB . . 3.510 2.402 2.233 2.613 . 0 0 "[ . 1 . 2]" 1
437 1 35 GLU QB 1 36 GLY H . . 4.650 3.074 2.783 3.425 . 0 0 "[ . 1 . 2]" 1
438 1 35 GLU HA 1 35 GLU HG2 . . 3.860 3.435 2.476 3.816 . 0 0 "[ . 1 . 2]" 1
439 1 35 GLU HA 1 35 GLU HG3 . . 3.860 3.027 2.501 3.864 0.004 2 0 "[ . 1 . 2]" 1
440 1 36 GLY H 1 37 ILE H . . 3.110 2.430 2.146 2.623 . 0 0 "[ . 1 . 2]" 1
441 1 37 ILE HA 1 38 PRO QG . . 4.210 3.853 3.673 4.026 . 0 0 "[ . 1 . 2]" 1
442 1 37 ILE MD 1 70 LEU MD1 . . 3.340 2.606 1.798 3.559 0.219 8 0 "[ . 1 . 2]" 1
443 1 37 ILE MG 1 70 LEU MD1 . . 3.540 3.261 1.923 3.766 0.226 16 0 "[ . 1 . 2]" 1
444 1 37 ILE MD 1 70 LEU MD2 . . 3.340 2.502 1.762 3.539 0.199 11 0 "[ . 1 . 2]" 1
445 1 37 ILE MG 1 70 LEU MD2 . . 3.540 2.795 1.765 3.678 0.138 17 0 "[ . 1 . 2]" 1
446 1 37 ILE H 1 37 ILE HB . . 3.830 2.755 2.320 3.720 . 0 0 "[ . 1 . 2]" 1
447 1 37 ILE HA 1 37 ILE MG . . 3.470 2.447 2.311 2.599 . 0 0 "[ . 1 . 2]" 1
448 1 37 ILE H 1 37 ILE MD . . 3.660 3.629 3.413 3.746 0.086 7 0 "[ . 1 . 2]" 1
449 1 39 PRO HB2 1 40 ASP H . . 3.860 3.099 2.831 3.432 . 0 0 "[ . 1 . 2]" 1
450 1 39 PRO HB3 1 40 ASP H . . 3.860 4.057 3.962 4.166 0.306 4 0 "[ . 1 . 2]" 1
451 1 38 PRO QG 1 41 GLN HE21 . . 4.500 3.722 2.894 4.642 0.142 11 0 "[ . 1 . 2]" 1
452 1 38 PRO QG 1 41 GLN HE22 . . 4.500 3.867 3.228 4.713 0.213 1 0 "[ . 1 . 2]" 1
453 1 39 PRO HA 1 42 GLN H . . 4.380 3.562 2.964 4.421 0.041 12 0 "[ . 1 . 2]" 1
454 1 39 PRO HG3 1 40 ASP H . . 4.430 3.971 3.776 4.228 . 0 0 "[ . 1 . 2]" 1
455 1 39 PRO QD 1 40 ASP H . . 4.590 3.094 2.724 3.359 . 0 0 "[ . 1 . 2]" 1
456 1 39 PRO HG2 1 40 ASP H . . 4.430 2.418 2.147 2.778 . 0 0 "[ . 1 . 2]" 1
457 1 40 ASP H 1 41 GLN H . . 3.020 2.711 2.335 2.856 . 0 0 "[ . 1 . 2]" 1
458 1 40 ASP H 1 42 GLN H . . 5.310 3.994 3.756 4.504 . 0 0 "[ . 1 . 2]" 1
459 1 40 ASP H 1 40 ASP QB . . 3.160 2.494 2.214 2.667 . 0 0 "[ . 1 . 2]" 1
460 1 40 ASP QB 1 41 GLN H . . 3.920 2.806 2.421 3.496 . 0 0 "[ . 1 . 2]" 1
461 1 41 GLN H 1 42 GLN H . . 3.100 2.377 2.224 2.704 . 0 0 "[ . 1 . 2]" 1
462 1 41 GLN H 1 41 GLN QG . . 3.800 2.630 1.997 4.049 0.249 8 0 "[ . 1 . 2]" 1
463 1 41 GLN QB 1 73 THR MG . . 4.730 3.810 2.192 5.016 0.286 5 0 "[ . 1 . 2]" 1
464 1 42 GLN HA 1 43 ARG H . . 3.190 2.196 2.062 2.345 . 0 0 "[ . 1 . 2]" 1
465 1 43 ARG QG 1 74 LEU H . . 4.740 4.223 3.679 4.815 0.075 17 0 "[ . 1 . 2]" 1
466 1 43 ARG HA 1 44 LEU H . . 3.100 2.255 2.131 2.450 . 0 0 "[ . 1 . 2]" 1
467 1 43 ARG QD 1 73 THR H . . 4.980 4.350 3.607 5.074 0.094 17 0 "[ . 1 . 2]" 1
468 1 43 ARG QD 1 74 LEU HA . . 4.620 4.740 4.522 5.008 0.388 3 0 "[ . 1 . 2]" 1
469 1 43 ARG HA 1 43 ARG QD . . 4.430 4.223 3.175 4.566 0.136 7 0 "[ . 1 . 2]" 1
470 1 43 ARG QD 1 74 LEU H . . 4.590 2.606 2.063 2.936 . 0 0 "[ . 1 . 2]" 1
471 1 43 ARG QD 1 75 ARG H . . 4.770 4.087 2.774 5.044 0.274 18 0 "[ . 1 . 2]" 1
472 1 43 ARG H 1 43 ARG QG . . 4.050 2.724 1.766 3.925 . 0 0 "[ . 1 . 2]" 1
473 1 43 ARG HA 1 43 ARG QG . . 3.530 2.921 2.430 3.580 0.050 5 0 "[ . 1 . 2]" 1
474 1 44 LEU HA 1 45 ILE H . . 3.100 2.208 2.127 2.285 . 0 0 "[ . 1 . 2]" 1
475 1 44 LEU H 1 44 LEU HG . . 4.080 3.562 2.193 4.346 0.266 13 0 "[ . 1 . 2]" 1
476 1 45 ILE HA 1 46 PHE H . . 3.100 2.171 2.133 2.265 . 0 0 "[ . 1 . 2]" 1
477 1 45 ILE H 1 45 ILE MG . . 4.080 3.974 3.887 4.074 . 0 0 "[ . 1 . 2]" 1
478 1 45 ILE H 1 45 ILE HB . . 3.630 2.864 2.669 3.108 . 0 0 "[ . 1 . 2]" 1
479 1 45 ILE HA 1 49 LYS H . . 4.330 4.316 4.069 4.492 0.162 20 0 "[ . 1 . 2]" 1
480 1 45 ILE MG 1 49 LYS H . . 4.330 2.624 2.259 3.435 . 0 0 "[ . 1 . 2]" 1
481 1 45 ILE H 1 45 ILE MD . . 4.570 4.152 3.269 4.452 . 0 0 "[ . 1 . 2]" 1
482 1 45 ILE MD 1 71 LEU MD2 . . 3.550 2.908 2.015 3.861 0.311 20 0 "[ . 1 . 2]" 1
483 1 45 ILE MD 1 71 LEU MD1 . . 3.550 2.478 1.812 3.767 0.217 8 0 "[ . 1 . 2]" 1
484 1 45 ILE HA 1 45 ILE MD . . 4.410 3.701 2.190 4.037 . 0 0 "[ . 1 . 2]" 1
485 1 46 PHE QD 1 47 ALA H . . 4.830 3.235 2.729 4.246 . 0 0 "[ . 1 . 2]" 1
486 1 46 PHE HB2 1 47 ALA H . . 5.440 4.496 3.353 4.728 . 0 0 "[ . 1 . 2]" 1
487 1 46 PHE HB3 1 47 ALA H . . 5.440 4.206 1.810 4.491 . 0 0 "[ . 1 . 2]" 1
488 1 46 PHE H 1 49 LYS H . . 3.510 2.822 2.524 3.214 . 0 0 "[ . 1 . 2]" 1
489 1 46 PHE H 1 47 ALA H . . 4.510 4.057 3.832 4.299 . 0 0 "[ . 1 . 2]" 1
490 1 46 PHE H 1 48 GLY H . . 4.510 3.740 3.396 4.688 0.178 10 0 "[ . 1 . 2]" 1
491 1 46 PHE H 1 51 LEU MD2 . . 4.460 2.879 2.093 3.928 . 0 0 "[ . 1 . 2]" 1
492 1 46 PHE H 1 51 LEU MD1 . . 4.460 4.115 2.462 4.581 0.121 15 0 "[ . 1 . 2]" 1
493 1 46 PHE HA 1 68 LEU MD2 . . 4.920 4.197 3.283 5.076 0.156 10 0 "[ . 1 . 2]" 1
494 1 46 PHE HA 1 68 LEU MD1 . . 4.920 4.117 2.228 5.064 0.144 8 0 "[ . 1 . 2]" 1
495 1 46 PHE HA 1 47 ALA H . . 3.120 2.246 2.161 2.874 . 0 0 "[ . 1 . 2]" 1
496 1 46 PHE QD 1 51 LEU MD2 . . 4.500 2.818 1.870 3.748 . 0 0 "[ . 1 . 2]" 1
497 1 46 PHE QD 1 51 LEU MD1 . . 4.500 2.649 1.792 3.671 . 0 0 "[ . 1 . 2]" 1
498 1 46 PHE HA 1 46 PHE HD1 . . 3.910 2.664 2.228 3.528 . 0 0 "[ . 1 . 2]" 1
499 1 46 PHE QD 1 68 LEU HA . . 4.200 3.310 2.390 4.354 0.154 9 0 "[ . 1 . 2]" 1
500 1 46 PHE HA 1 47 ALA HA . . 4.390 4.420 4.381 4.461 0.071 8 0 "[ . 1 . 2]" 1
501 1 46 PHE QD 1 68 LEU QB . . 5.390 3.551 2.573 4.952 . 0 0 "[ . 1 . 2]" 1
502 1 46 PHE HB2 1 51 LEU MD2 . . 4.340 2.094 1.748 3.153 . 0 0 "[ . 1 . 2]" 1
503 1 46 PHE QD 1 68 LEU HG . . 4.220 3.039 1.662 4.436 0.216 11 0 "[ . 1 . 2]" 1
504 1 46 PHE HA 1 68 LEU HG . . 4.370 3.882 3.294 4.660 0.290 18 0 "[ . 1 . 2]" 1
505 1 46 PHE HB2 1 51 LEU MD1 . . 4.340 2.554 2.022 3.538 . 0 0 "[ . 1 . 2]" 1
506 1 46 PHE HB3 1 51 LEU MD1 . . 4.340 3.187 1.983 4.412 0.072 10 0 "[ . 1 . 2]" 1
507 1 46 PHE HB3 1 51 LEU MD2 . . 4.340 2.537 1.830 3.407 . 0 0 "[ . 1 . 2]" 1
508 1 46 PHE HZ 1 62 ILE MG . . 3.900 3.078 2.098 4.018 0.118 11 0 "[ . 1 . 2]" 1
509 1 46 PHE HZ 1 62 ILE MD . . 4.300 3.992 3.073 4.506 0.206 17 0 "[ . 1 . 2]" 1
510 1 46 PHE QE 1 66 SER HB2 . . 4.450 3.527 2.380 4.316 . 0 0 "[ . 1 . 2]" 1
511 1 46 PHE QE 1 66 SER HB3 . . 4.450 2.300 1.809 3.071 . 0 0 "[ . 1 . 2]" 1
512 1 46 PHE HZ 1 62 ILE HA . . 4.500 3.952 2.224 4.855 0.355 12 0 "[ . 1 . 2]" 1
513 1 46 PHE QD 1 68 LEU MD2 . . 4.560 3.487 2.305 4.836 0.276 10 0 "[ . 1 . 2]" 1
514 1 46 PHE QD 1 68 LEU MD1 . . 4.560 2.866 1.779 3.671 . 0 0 "[ . 1 . 2]" 1
515 1 46 PHE HZ 1 68 LEU MD2 . . 4.960 5.222 4.850 5.553 0.593 3 3 "[ + . 1 -* 2]" 1
516 1 46 PHE HZ 1 68 LEU MD1 . . 4.960 4.440 3.371 5.292 0.332 17 0 "[ . 1 . 2]" 1
517 1 47 ALA HA 1 48 GLY H . . 3.140 2.922 2.331 3.092 . 0 0 "[ . 1 . 2]" 1
518 1 47 ALA MB 1 48 GLY H . . 4.880 3.655 3.570 3.739 . 0 0 "[ . 1 . 2]" 1
519 1 45 ILE MG 1 47 ALA H . . 4.140 3.765 3.204 4.602 0.462 10 0 "[ . 1 . 2]" 1
520 1 48 GLY H 1 49 LYS H . . 3.570 2.444 2.306 2.722 . 0 0 "[ . 1 . 2]" 1
521 1 45 ILE MG 1 48 GLY H . . 4.250 2.283 1.990 3.078 . 0 0 "[ . 1 . 2]" 1
522 1 49 LYS H 1 49 LYS QD . . 4.580 4.277 2.008 4.836 0.256 1 0 "[ . 1 . 2]" 1
523 1 49 LYS QB 1 60 TYR QD . . 4.440 3.094 2.001 4.254 . 0 0 "[ . 1 . 2]" 1
524 1 49 LYS H 1 49 LYS QB . . 3.440 2.541 2.454 2.625 . 0 0 "[ . 1 . 2]" 1
525 1 49 LYS QB 1 49 LYS QE . . 4.460 3.628 3.397 3.841 . 0 0 "[ . 1 . 2]" 1
526 1 49 LYS QD 1 60 TYR QE . . 4.920 3.662 2.878 5.194 0.274 17 0 "[ . 1 . 2]" 1
527 1 49 LYS QD 1 60 TYR QD . . 4.700 2.570 1.861 4.188 . 0 0 "[ . 1 . 2]" 1
528 1 49 LYS H 1 49 LYS QG . . 4.300 3.720 2.344 4.255 . 0 0 "[ . 1 . 2]" 1
529 1 49 LYS QG 1 60 TYR QE . . 4.170 3.026 1.972 4.361 0.191 11 0 "[ . 1 . 2]" 1
530 1 49 LYS QG 1 50 GLN H . . 4.360 3.363 2.368 4.796 0.436 12 0 "[ . 1 . 2]" 1
531 1 49 LYS HA 1 49 LYS QG . . 3.530 2.558 2.400 3.241 . 0 0 "[ . 1 . 2]" 1
532 1 49 LYS QB 1 60 TYR QE . . 4.190 3.609 2.202 4.513 0.323 9 0 "[ . 1 . 2]" 1
533 1 50 GLN QB 1 51 LEU H . . 5.080 3.243 2.874 3.728 . 0 0 "[ . 1 . 2]" 1
534 1 50 GLN H 1 50 GLN QG . . 3.960 2.772 1.982 4.036 0.076 18 0 "[ . 1 . 2]" 1
535 1 50 GLN H 1 50 GLN QB . . 3.650 2.511 2.251 3.017 . 0 0 "[ . 1 . 2]" 1
536 1 50 GLN HA 1 51 LEU MD1 . . 4.870 4.883 3.289 5.243 0.373 9 0 "[ . 1 . 2]" 1
537 1 50 GLN HA 1 51 LEU MD2 . . 4.870 3.429 2.571 5.223 0.353 17 0 "[ . 1 . 2]" 1
538 1 51 LEU HA 1 52 GLU H . . 3.480 2.181 2.073 2.278 . 0 0 "[ . 1 . 2]" 1
539 1 51 LEU H 1 51 LEU HG . . 3.910 3.300 2.178 4.054 0.144 7 0 "[ . 1 . 2]" 1
540 1 51 LEU H 1 51 LEU MD1 . . 3.980 3.716 2.345 3.988 0.008 8 0 "[ . 1 . 2]" 1
541 1 51 LEU MD1 1 52 GLU H . . 5.140 4.529 3.193 5.369 0.229 11 0 "[ . 1 . 2]" 1
542 1 51 LEU HA 1 51 LEU MD1 . . 4.280 2.944 2.107 3.892 . 0 0 "[ . 1 . 2]" 1
543 1 51 LEU H 1 51 LEU MD2 . . 3.980 2.629 2.033 3.755 . 0 0 "[ . 1 . 2]" 1
544 1 51 LEU MD2 1 52 GLU H . . 5.140 4.395 3.766 5.238 0.098 17 0 "[ . 1 . 2]" 1
545 1 51 LEU MD2 1 60 TYR QD . . 4.220 3.573 2.749 4.419 0.199 1 0 "[ . 1 . 2]" 1
546 1 51 LEU MD1 1 60 TYR QD . . 4.220 3.480 2.356 4.391 0.171 3 0 "[ . 1 . 2]" 1
547 1 51 LEU HA 1 51 LEU MD2 . . 4.280 2.651 2.089 3.831 . 0 0 "[ . 1 . 2]" 1
548 1 51 LEU HA 1 60 TYR QD . . 4.560 4.358 3.735 4.648 0.088 8 0 "[ . 1 . 2]" 1
549 1 51 LEU HB2 1 60 TYR QE . . 5.260 5.142 4.760 5.345 0.085 10 0 "[ . 1 . 2]" 1
550 1 51 LEU HA 1 60 TYR QE . . 4.090 2.878 1.929 3.170 . 0 0 "[ . 1 . 2]" 1
551 1 51 LEU H 1 60 TYR QE . . 5.230 4.876 3.966 5.348 0.118 13 0 "[ . 1 . 2]" 1
552 1 51 LEU HB3 1 60 TYR QE . . 5.260 4.022 3.296 4.560 . 0 0 "[ . 1 . 2]" 1
553 1 51 LEU MD2 1 60 TYR QE . . 4.020 3.375 2.594 4.192 0.172 17 0 "[ . 1 . 2]" 1
554 1 51 LEU MD1 1 60 TYR QE . . 4.020 3.461 2.434 4.317 0.297 5 0 "[ . 1 . 2]" 1
555 1 52 GLU HA 1 53 ASP H . . 3.050 2.187 2.074 2.279 . 0 0 "[ . 1 . 2]" 1
556 1 52 GLU HA 1 52 GLU HG2 . . 3.950 2.990 2.354 3.907 . 0 0 "[ . 1 . 2]" 1
557 1 52 GLU HA 1 52 GLU HG3 . . 3.950 3.073 2.433 3.780 . 0 0 "[ . 1 . 2]" 1
558 1 52 GLU QB 1 60 TYR QE . . 5.140 4.126 3.303 4.514 . 0 0 "[ . 1 . 2]" 1
559 1 52 GLU QB 1 55 ARG HD3 . . 4.670 2.906 1.784 4.819 0.149 8 0 "[ . 1 . 2]" 1
560 1 52 GLU H 1 52 GLU QB . . 3.480 2.396 2.212 2.691 . 0 0 "[ . 1 . 2]" 1
561 1 52 GLU QB 1 55 ARG HD2 . . 4.670 3.143 2.046 4.239 . 0 0 "[ . 1 . 2]" 1
562 1 52 GLU H 1 60 TYR QE . . 3.910 3.378 2.856 3.706 . 0 0 "[ . 1 . 2]" 1
563 1 53 ASP QB 1 54 GLY QA . . 5.120 4.015 3.356 4.358 . 0 0 "[ . 1 . 2]" 1
564 1 53 ASP H 1 53 ASP QB . . 3.770 2.433 2.182 2.706 . 0 0 "[ . 1 . 2]" 1
565 1 54 GLY H 1 55 ARG H . . 4.140 2.780 2.648 2.953 . 0 0 "[ . 1 . 2]" 1
566 1 55 ARG H 1 56 THR H . . 4.680 4.519 4.431 4.580 . 0 0 "[ . 1 . 2]" 1
567 1 55 ARG HA 1 56 THR H . . 3.290 2.569 2.419 2.720 . 0 0 "[ . 1 . 2]" 1
568 1 55 ARG HA 1 55 ARG HG2 . . 3.730 3.475 2.520 3.761 0.031 1 0 "[ . 1 . 2]" 1
569 1 55 ARG HG2 1 56 THR H . . 5.130 3.647 2.077 4.879 . 0 0 "[ . 1 . 2]" 1
570 1 55 ARG HG3 1 56 THR H . . 5.130 3.054 1.857 4.812 . 0 0 "[ . 1 . 2]" 1
571 1 55 ARG HA 1 55 ARG HG3 . . 3.730 2.692 2.329 3.800 0.070 15 0 "[ . 1 . 2]" 1
572 1 55 ARG HB2 1 60 TYR QE . . 4.430 2.992 2.133 4.452 0.022 8 0 "[ . 1 . 2]" 1
573 1 55 ARG HB3 1 60 TYR QE . . 4.430 2.256 1.811 2.931 . 0 0 "[ . 1 . 2]" 1
574 1 56 THR H 1 59 ASP H . . 4.480 3.827 3.475 4.307 . 0 0 "[ . 1 . 2]" 1
575 1 56 THR MG 1 59 ASP H . . 4.830 3.467 2.671 4.628 . 0 0 "[ . 1 . 2]" 1
576 1 56 THR HB 1 57 LEU H . . 3.880 3.332 2.276 3.934 0.054 9 0 "[ . 1 . 2]" 1
577 1 56 THR H 1 60 TYR H . . 5.150 5.188 4.873 5.334 0.184 2 0 "[ . 1 . 2]" 1
578 1 56 THR HA 1 58 SER H . . 5.000 4.366 4.064 4.812 . 0 0 "[ . 1 . 2]" 1
579 1 56 THR HB 1 58 SER H . . 3.810 3.263 2.339 3.755 . 0 0 "[ . 1 . 2]" 1
580 1 56 THR MG 1 58 SER H . . 4.820 2.745 1.799 4.655 . 0 0 "[ . 1 . 2]" 1
581 1 56 THR H 1 57 LEU H . . 5.250 4.561 4.510 4.646 . 0 0 "[ . 1 . 2]" 1
582 1 56 THR H 1 59 ASP HB2 . . 4.090 2.677 2.070 3.285 . 0 0 "[ . 1 . 2]" 1
583 1 56 THR H 1 59 ASP HB3 . . 4.090 2.820 2.378 3.623 . 0 0 "[ . 1 . 2]" 1
584 1 56 THR H 1 56 THR MG . . 3.830 3.529 2.694 3.905 0.075 5 0 "[ . 1 . 2]" 1
585 1 56 THR MG 1 57 LEU H . . 3.870 2.697 2.075 3.629 . 0 0 "[ . 1 . 2]" 1
586 1 56 THR HA 1 56 THR MG . . 3.260 2.384 2.316 2.471 . 0 0 "[ . 1 . 2]" 1
587 1 56 THR H 1 60 TYR QE . . 4.460 3.947 3.305 4.559 0.099 3 0 "[ . 1 . 2]" 1
588 1 57 LEU H 1 57 LEU HG . . 3.890 3.924 3.831 3.982 0.092 17 0 "[ . 1 . 2]" 1
589 1 57 LEU HB2 1 58 SER H . . 4.270 2.668 2.512 2.819 . 0 0 "[ . 1 . 2]" 1
590 1 57 LEU HA 1 60 TYR H . . 3.830 3.836 3.671 3.954 0.124 17 0 "[ . 1 . 2]" 1
591 1 57 LEU HB3 1 62 ILE HB . . 4.850 2.431 2.105 3.000 . 0 0 "[ . 1 . 2]" 1
592 1 57 LEU HB3 1 58 SER H . . 4.270 3.392 3.150 3.658 . 0 0 "[ . 1 . 2]" 1
593 1 57 LEU HA 1 62 ILE HB . . 4.830 3.701 3.251 4.327 . 0 0 "[ . 1 . 2]" 1
594 1 57 LEU HB2 1 62 ILE HB . . 4.850 4.137 3.787 4.707 . 0 0 "[ . 1 . 2]" 1
595 1 24 ILE MD 1 57 LEU HA . . 4.110 2.332 2.156 2.579 . 0 0 "[ . 1 . 2]" 1
596 1 57 LEU HA 1 62 ILE MD . . 3.860 2.703 1.841 3.699 . 0 0 "[ . 1 . 2]" 1
597 1 57 LEU MD2 1 62 ILE MD . . 4.300 4.079 3.309 4.749 0.449 3 0 "[ . 1 . 2]" 1
598 1 58 SER HB3 1 59 ASP H . . 4.170 3.103 2.843 4.146 . 0 0 "[ . 1 . 2]" 1
599 1 58 SER H 1 59 ASP H . . 3.530 2.694 2.550 2.777 . 0 0 "[ . 1 . 2]" 1
600 1 58 SER H 1 61 ASN H . . 4.820 4.878 4.777 5.018 0.198 16 0 "[ . 1 . 2]" 1
601 1 58 SER H 1 60 TYR H . . 4.990 4.293 4.003 4.491 . 0 0 "[ . 1 . 2]" 1
602 1 58 SER H 1 58 SER HB3 . . 3.900 2.625 2.465 3.592 . 0 0 "[ . 1 . 2]" 1
603 1 58 SER HB2 1 59 ASP H . . 4.170 4.047 3.313 4.184 0.014 8 0 "[ . 1 . 2]" 1
604 1 58 SER H 1 58 SER HB2 . . 3.900 2.571 2.398 3.590 . 0 0 "[ . 1 . 2]" 1
605 1 58 SER HA 1 61 ASN H . . 4.090 2.987 2.849 3.116 . 0 0 "[ . 1 . 2]" 1
606 1 58 SER HA 1 60 TYR H . . 3.650 3.867 3.743 3.976 0.326 9 0 "[ . 1 . 2]" 1
607 1 58 SER HA 1 62 ILE HB . . 4.950 4.451 3.556 4.963 0.013 5 0 "[ . 1 . 2]" 1
608 1 59 ASP H 1 60 TYR H . . 3.300 2.699 2.577 2.776 . 0 0 "[ . 1 . 2]" 1
609 1 59 ASP H 1 59 ASP HB2 . . 3.560 2.497 2.340 2.637 . 0 0 "[ . 1 . 2]" 1
610 1 59 ASP H 1 59 ASP HB3 . . 3.560 2.616 2.385 3.615 0.055 13 0 "[ . 1 . 2]" 1
611 1 59 ASP HB2 1 60 TYR H . . 4.280 3.952 3.113 4.115 . 0 0 "[ . 1 . 2]" 1
612 1 59 ASP HB3 1 60 TYR H . . 4.280 2.885 2.685 3.744 . 0 0 "[ . 1 . 2]" 1
613 1 60 TYR HB3 1 61 ASN H . . 5.130 4.288 4.118 4.408 . 0 0 "[ . 1 . 2]" 1
614 1 60 TYR H 1 61 ASN H . . 3.750 2.297 2.184 2.455 . 0 0 "[ . 1 . 2]" 1
615 1 60 TYR H 1 60 TYR HB3 . . 3.630 3.684 3.595 3.747 0.117 1 0 "[ . 1 . 2]" 1
616 1 60 TYR H 1 60 TYR HB2 . . 3.630 2.510 2.339 2.631 . 0 0 "[ . 1 . 2]" 1
617 1 60 TYR HB2 1 62 ILE MD . . 4.520 2.348 1.829 2.841 . 0 0 "[ . 1 . 2]" 1
618 1 60 TYR HB2 1 61 ASN H . . 5.130 3.552 3.297 3.692 . 0 0 "[ . 1 . 2]" 1
619 1 60 TYR QD 1 62 ILE MD . . 3.720 3.138 2.518 3.597 . 0 0 "[ . 1 . 2]" 1
620 1 60 TYR HB3 1 62 ILE MD . . 4.520 3.018 2.555 3.613 . 0 0 "[ . 1 . 2]" 1
621 1 61 ASN H 1 62 ILE H . . 3.030 2.795 2.558 2.945 . 0 0 "[ . 1 . 2]" 1
622 1 61 ASN H 1 61 ASN HB2 . . 3.840 3.114 2.996 3.606 . 0 0 "[ . 1 . 2]" 1
623 1 61 ASN HA 1 62 ILE H . . 3.340 2.622 2.411 2.860 . 0 0 "[ . 1 . 2]" 1
624 1 61 ASN H 1 61 ASN HB3 . . 3.840 3.674 3.592 3.996 0.156 7 0 "[ . 1 . 2]" 1
625 1 61 ASN HA 1 62 ILE HB . . 5.120 4.861 4.613 5.060 . 0 0 "[ . 1 . 2]" 1
626 1 62 ILE H 1 62 ILE HB . . 3.360 2.446 2.298 2.599 . 0 0 "[ . 1 . 2]" 1
627 1 62 ILE H 1 62 ILE HG12 . . 4.040 3.208 2.090 4.121 0.081 1 0 "[ . 1 . 2]" 1
628 1 62 ILE H 1 62 ILE HG13 . . 4.040 3.118 2.197 3.998 . 0 0 "[ . 1 . 2]" 1
629 1 62 ILE HA 1 62 ILE HG13 . . 4.190 3.117 2.380 3.858 . 0 0 "[ . 1 . 2]" 1
630 1 62 ILE HA 1 63 GLN H . . 3.190 2.135 2.065 2.186 . 0 0 "[ . 1 . 2]" 1
631 1 62 ILE HA 1 62 ILE HG12 . . 4.190 2.928 2.326 3.691 . 0 0 "[ . 1 . 2]" 1
632 1 62 ILE HA 1 63 GLN QG . . 4.960 3.728 3.303 4.572 . 0 0 "[ . 1 . 2]" 1
633 1 57 LEU MD2 1 62 ILE MG . . 4.500 4.550 4.353 4.685 0.185 8 0 "[ . 1 . 2]" 1
634 1 57 LEU MD1 1 62 ILE MG . . 4.500 2.077 1.797 2.457 . 0 0 "[ . 1 . 2]" 1
635 1 57 LEU MD1 1 62 ILE MD . . 4.300 2.321 1.748 3.127 . 0 0 "[ . 1 . 2]" 1
636 1 62 ILE MG 1 63 GLN H . . 4.030 3.213 2.668 3.509 . 0 0 "[ . 1 . 2]" 1
637 1 62 ILE HA 1 62 ILE MG . . 3.620 2.570 2.420 2.758 . 0 0 "[ . 1 . 2]" 1
638 1 62 ILE MG 1 63 GLN HA . . 4.020 4.012 3.764 4.252 0.232 19 0 "[ . 1 . 2]" 1
639 1 62 ILE MG 1 66 SER QB . . 4.200 2.775 2.229 3.183 . 0 0 "[ . 1 . 2]" 1
640 1 63 GLN HA 1 64 LYS H . . 3.070 2.597 2.390 2.766 . 0 0 "[ . 1 . 2]" 1
641 1 63 GLN HA 1 64 LYS HA . . 4.430 4.356 4.190 4.492 0.062 7 0 "[ . 1 . 2]" 1
642 1 63 GLN QG 1 64 LYS H . . 4.810 3.340 2.988 4.085 . 0 0 "[ . 1 . 2]" 1
643 1 63 GLN HA 1 63 GLN QG . . 3.510 3.360 2.634 3.548 0.038 1 0 "[ . 1 . 2]" 1
644 1 63 GLN QG 1 66 SER QB . . 4.360 3.032 1.785 4.564 0.204 7 0 "[ . 1 . 2]" 1
645 1 63 GLN H 1 63 GLN QG . . 4.190 2.052 1.864 2.859 . 0 0 "[ . 1 . 2]" 1
646 1 63 GLN QB 1 64 LYS H . . 3.380 2.182 2.003 2.542 . 0 0 "[ . 1 . 2]" 1
647 1 64 LYS H 1 64 LYS QG . . 3.850 3.349 1.875 4.045 0.195 1 0 "[ . 1 . 2]" 1
648 1 64 LYS HB2 1 65 GLU H . . 4.660 3.421 2.262 4.221 . 0 0 "[ . 1 . 2]" 1
649 1 64 LYS HA 1 66 SER H . . 4.780 3.428 3.135 3.675 . 0 0 "[ . 1 . 2]" 1
650 1 64 LYS HA 1 64 LYS QD . . 4.300 4.169 3.729 4.571 0.271 18 0 "[ . 1 . 2]" 1
651 1 64 LYS QG 1 65 GLU QG . . 3.920 2.729 1.758 3.765 . 0 0 "[ . 1 . 2]" 1
652 1 64 LYS HA 1 65 GLU QG . . 5.010 4.351 3.943 5.174 0.164 7 0 "[ . 1 . 2]" 1
653 1 64 LYS HB3 1 65 GLU H . . 4.660 3.850 3.615 4.138 . 0 0 "[ . 1 . 2]" 1
654 1 64 LYS QG 1 65 GLU HB2 . . 5.010 3.927 3.106 5.186 0.176 7 0 "[ . 1 . 2]" 1
655 1 64 LYS QG 1 65 GLU HB3 . . 5.010 4.469 2.973 5.189 0.179 15 0 "[ . 1 . 2]" 1
656 1 64 LYS QG 1 65 GLU H . . 4.320 3.005 2.081 4.054 . 0 0 "[ . 1 . 2]" 1
657 1 65 GLU H 1 66 SER H . . 4.050 2.785 2.639 3.076 . 0 0 "[ . 1 . 2]" 1
658 1 65 GLU H 1 65 GLU QG . . 4.680 2.997 2.598 3.928 . 0 0 "[ . 1 . 2]" 1
659 1 65 GLU HA 1 65 GLU QG . . 3.390 2.711 2.412 3.502 0.112 4 0 "[ . 1 . 2]" 1
660 1 66 SER H 1 66 SER QB . . 3.880 2.372 2.288 2.488 . 0 0 "[ . 1 . 2]" 1
661 1 62 ILE MG 1 66 SER HB2 . . 3.950 3.279 2.297 4.108 0.158 17 0 "[ . 1 . 2]" 1
662 1 62 ILE MG 1 66 SER HB3 . . 3.950 3.244 2.598 3.954 0.004 1 0 "[ . 1 . 2]" 1
663 1 66 SER HB2 1 67 ALA H . . 4.350 4.172 3.811 4.398 0.048 20 0 "[ . 1 . 2]" 1
664 1 66 SER HB3 1 67 ALA H . . 4.350 3.516 2.750 4.065 . 0 0 "[ . 1 . 2]" 1
665 1 67 ALA MB 1 68 LEU H . . 4.700 3.267 2.861 3.581 . 0 0 "[ . 1 . 2]" 1
666 1 67 ALA MB 1 68 LEU HA . . 5.390 4.320 4.122 4.483 . 0 0 "[ . 1 . 2]" 1
667 1 68 LEU HA 1 69 ILE H . . 3.290 2.316 2.190 2.475 . 0 0 "[ . 1 . 2]" 1
668 1 68 LEU QB 1 69 ILE H . . 4.210 3.281 2.469 3.884 . 0 0 "[ . 1 . 2]" 1
669 1 68 LEU H 1 68 LEU HG . . 4.540 4.061 3.362 4.606 0.066 10 0 "[ . 1 . 2]" 1
670 1 68 LEU HA 1 68 LEU HG . . 3.800 2.943 2.605 3.793 . 0 0 "[ . 1 . 2]" 1
671 1 69 ILE MG 1 70 LEU H . . 5.420 4.035 3.699 4.255 . 0 0 "[ . 1 . 2]" 1
672 1 69 ILE H 1 69 ILE MD . . 4.610 4.655 4.200 4.820 0.210 5 0 "[ . 1 . 2]" 1
673 1 69 ILE HB 1 70 LEU H . . 4.150 4.141 3.979 4.261 0.111 3 0 "[ . 1 . 2]" 1
674 1 69 ILE H 1 69 ILE MG . . 4.340 2.171 1.983 2.371 . 0 0 "[ . 1 . 2]" 1
675 1 69 ILE MD 1 69 ILE MG . . 3.920 2.181 1.956 3.257 . 0 0 "[ . 1 . 2]" 1
676 1 71 LEU H 1 72 LEU H . . 5.500 4.441 4.317 4.581 . 0 0 "[ . 1 . 2]" 1
677 1 72 LEU HB3 1 73 THR H . . 4.890 3.303 2.233 3.857 . 0 0 "[ . 1 . 2]" 1
678 1 72 LEU HB2 1 73 THR H . . 4.890 3.579 2.174 4.211 . 0 0 "[ . 1 . 2]" 1
679 1 72 LEU H 1 72 LEU MD1 . . 4.670 3.985 2.401 4.401 . 0 0 "[ . 1 . 2]" 1
680 1 72 LEU H 1 72 LEU MD2 . . 4.670 3.736 1.746 4.561 . 0 0 "[ . 1 . 2]" 1
681 1 72 LEU HA 1 73 THR H . . 3.100 2.439 2.275 2.539 . 0 0 "[ . 1 . 2]" 1
682 1 72 LEU HG 1 73 THR H . . 4.680 3.077 1.859 4.807 0.127 19 0 "[ . 1 . 2]" 1
683 1 73 THR HB 1 74 LEU H . . 4.990 4.319 3.727 4.526 . 0 0 "[ . 1 . 2]" 1
684 1 73 THR H 1 73 THR HB . . 3.990 2.923 2.495 3.572 . 0 0 "[ . 1 . 2]" 1
685 1 73 THR HA 1 74 LEU H . . 3.010 2.165 2.087 2.250 . 0 0 "[ . 1 . 2]" 1
686 1 73 THR HA 1 73 THR MG . . 3.620 2.411 2.254 2.547 . 0 0 "[ . 1 . 2]" 1
687 1 74 LEU HA 1 75 ARG H . . 3.530 3.515 3.379 3.589 0.059 14 0 "[ . 1 . 2]" 1
688 1 74 LEU HA 1 74 LEU MD2 . . 4.730 3.412 2.132 4.164 . 0 0 "[ . 1 . 2]" 1
689 1 74 LEU HA 1 74 LEU MD1 . . 4.730 3.270 2.125 4.142 . 0 0 "[ . 1 . 2]" 1
690 1 74 LEU MD1 1 75 ARG H . . 4.500 3.379 1.741 4.557 0.057 20 0 "[ . 1 . 2]" 1
691 1 74 LEU MD2 1 75 ARG H . . 4.500 3.865 2.599 4.577 0.077 20 0 "[ . 1 . 2]" 1
692 1 75 ARG H 1 75 ARG QG . . 4.470 3.408 1.994 4.428 . 0 0 "[ . 1 . 2]" 1
693 2 2 MET HA 2 3 GLN H . . 3.050 2.335 2.223 2.662 . 0 0 "[ . 1 . 2]" 1
694 1 19 GLU HA 2 2 MET H . . 3.500 3.256 2.744 3.686 0.186 6 0 "[ . 1 . 2]" 1
695 2 2 MET H 2 2 MET ME . . 3.780 3.708 3.484 3.919 0.139 4 0 "[ . 1 . 2]" 1
696 1 18 VAL H 2 2 MET H . . 3.570 3.369 3.030 3.672 0.102 13 0 "[ . 1 . 2]" 1
697 1 18 VAL H 2 2 MET ME . . 5.460 4.361 4.165 4.617 . 0 0 "[ . 1 . 2]" 1
698 2 2 MET HA 2 3 GLN HE21 . . 3.510 2.758 2.055 3.635 0.125 4 0 "[ . 1 . 2]" 1
699 2 2 MET HA 2 3 GLN HE22 . . 3.510 3.180 2.276 3.744 0.234 11 0 "[ . 1 . 2]" 1
700 1 17 GLU QG 2 2 MET H . . 4.780 4.131 2.735 4.966 0.186 5 0 "[ . 1 . 2]" 1
701 1 64 LYS HA 2 2 MET HB2 . . 4.740 2.092 1.893 2.317 . 0 0 "[ . 1 . 2]" 1
702 2 2 MET HB2 2 3 GLN H . . 4.220 2.602 1.929 2.851 . 0 0 "[ . 1 . 2]" 1
703 2 2 MET HB3 2 3 GLN H . . 4.220 3.876 3.466 4.032 . 0 0 "[ . 1 . 2]" 1
704 1 64 LYS HA 2 2 MET HB3 . . 4.740 3.765 3.450 4.062 . 0 0 "[ . 1 . 2]" 1
705 2 2 MET HG2 2 3 GLN H . . 4.720 3.809 3.126 4.104 . 0 0 "[ . 1 . 2]" 1
706 2 2 MET H 2 2 MET HG2 . . 4.440 3.136 2.905 3.287 . 0 0 "[ . 1 . 2]" 1
707 2 2 MET H 2 2 MET HG3 . . 4.440 4.048 3.812 4.307 . 0 0 "[ . 1 . 2]" 1
708 2 2 MET HG3 2 3 GLN H . . 4.720 4.620 3.835 4.857 0.137 1 0 "[ . 1 . 2]" 1
709 1 20 PRO HA 2 2 MET ME . . 3.160 2.114 1.926 2.402 . 0 0 "[ . 1 . 2]" 1
710 1 19 GLU HA 2 2 MET ME . . 4.720 3.444 3.019 3.823 . 0 0 "[ . 1 . 2]" 1
711 1 62 ILE MG 2 2 MET ME . . 3.990 2.216 2.025 2.587 . 0 0 "[ . 1 . 2]" 1
712 1 62 ILE MD 2 2 MET ME . . 3.990 4.036 3.755 4.232 0.242 12 0 "[ . 1 . 2]" 1
713 1 62 ILE MG 2 2 MET HG2 . . 4.890 2.973 2.333 3.455 . 0 0 "[ . 1 . 2]" 1
714 1 62 ILE MG 2 2 MET HG3 . . 4.890 2.693 2.165 3.276 . 0 0 "[ . 1 . 2]" 1
715 1 65 GLU H 2 3 GLN H . . 3.200 3.230 2.956 3.385 0.185 4 0 "[ . 1 . 2]" 1
716 1 64 LYS HA 2 3 GLN H . . 3.230 2.730 2.165 3.274 0.044 12 0 "[ . 1 . 2]" 1
717 2 3 GLN HB3 2 4 ILE H . . 4.270 3.317 2.509 4.127 . 0 0 "[ . 1 . 2]" 1
718 1 18 VAL H 2 3 GLN HA . . 3.240 3.243 2.791 3.508 0.268 19 0 "[ . 1 . 2]" 1
719 2 3 GLN HA 2 4 ILE H . . 3.040 2.255 2.097 2.383 . 0 0 "[ . 1 . 2]" 1
720 1 17 GLU HA 2 3 GLN HA . . 3.090 1.971 1.770 2.211 . 0 0 "[ . 1 . 2]" 1
721 2 3 GLN H 2 3 GLN HG2 . . 4.140 2.962 2.050 4.227 0.087 12 0 "[ . 1 . 2]" 1
722 2 3 GLN HA 2 3 GLN HG3 . . 4.060 3.528 2.505 4.301 0.241 4 0 "[ . 1 . 2]" 1
723 2 3 GLN HA 2 3 GLN HG2 . . 4.060 3.686 3.546 3.835 . 0 0 "[ . 1 . 2]" 1
724 2 3 GLN H 2 3 GLN HG3 . . 4.140 3.589 3.208 3.937 . 0 0 "[ . 1 . 2]" 1
725 1 64 LYS HB2 2 3 GLN H . . 4.420 3.127 2.296 3.807 . 0 0 "[ . 1 . 2]" 1
726 1 64 LYS HB3 2 3 GLN H . . 4.420 3.749 2.502 4.663 0.243 6 0 "[ . 1 . 2]" 1
727 2 3 GLN H 2 3 GLN HB2 . . 3.870 3.070 2.552 3.814 . 0 0 "[ . 1 . 2]" 1
728 2 3 GLN H 2 3 GLN HB3 . . 3.870 3.584 3.076 3.785 . 0 0 "[ . 1 . 2]" 1
729 1 17 GLU HB3 2 3 GLN HA . . 4.710 4.514 3.925 5.035 0.325 12 0 "[ . 1 . 2]" 1
730 1 17 GLU HB2 2 3 GLN HA . . 4.710 4.142 3.250 4.873 0.163 19 0 "[ . 1 . 2]" 1
731 2 3 GLN HB2 2 4 ILE H . . 4.270 3.563 2.646 4.144 . 0 0 "[ . 1 . 2]" 1
732 1 18 VAL H 2 4 ILE H . . 4.340 4.454 4.361 4.559 0.219 3 0 "[ . 1 . 2]" 1
733 2 3 GLN HA 2 4 ILE MD . . 5.020 5.113 4.921 5.230 0.210 19 0 "[ . 1 . 2]" 1
734 1 65 GLU H 2 4 ILE MG . . 4.890 3.758 3.063 3.982 . 0 0 "[ . 1 . 2]" 1
735 1 65 GLU H 2 4 ILE HA . . 3.300 3.297 2.912 3.425 0.125 4 0 "[ . 1 . 2]" 1
736 1 66 SER H 2 4 ILE HA . . 3.600 2.742 2.369 3.089 . 0 0 "[ . 1 . 2]" 1
737 2 4 ILE HA 2 5 PHE H . . 3.150 2.354 2.206 2.539 . 0 0 "[ . 1 . 2]" 1
738 2 4 ILE H 2 4 ILE HB . . 3.920 3.861 3.734 3.951 0.031 14 0 "[ . 1 . 2]" 1
739 1 15 THR MG 2 4 ILE H . . 4.980 4.197 3.451 5.207 0.227 14 0 "[ . 1 . 2]" 1
740 2 4 ILE H 2 4 ILE MG . . 4.070 3.132 2.789 3.469 . 0 0 "[ . 1 . 2]" 1
741 1 17 GLU HA 2 4 ILE H . . 4.080 3.253 2.923 3.596 . 0 0 "[ . 1 . 2]" 1
742 1 16 LEU H 2 4 ILE H . . 3.080 3.113 2.962 3.206 0.126 1 0 "[ . 1 . 2]" 1
743 1 65 GLU HA 2 4 ILE HA . . 3.100 2.988 2.441 3.151 0.051 1 0 "[ . 1 . 2]" 1
744 2 4 ILE HB 2 5 PHE H . . 4.230 2.414 2.006 2.740 . 0 0 "[ . 1 . 2]" 1
745 1 65 GLU HA 2 4 ILE MG . . 4.270 4.365 3.655 4.528 0.258 17 0 "[ . 1 . 2]" 1
746 2 4 ILE MG 2 5 PHE H . . 3.720 3.581 3.403 3.768 0.048 18 0 "[ . 1 . 2]" 1
747 1 66 SER H 2 4 ILE MG . . 4.080 2.610 1.926 3.006 . 0 0 "[ . 1 . 2]" 1
748 2 4 ILE HA 2 4 ILE MG . . 3.490 2.345 2.286 2.408 . 0 0 "[ . 1 . 2]" 1
749 1 66 SER QB 2 4 ILE MG . . 4.710 2.186 1.776 3.028 . 0 0 "[ . 1 . 2]" 1
750 2 4 ILE HA 2 4 ILE MD . . 4.420 4.268 4.256 4.281 . 0 0 "[ . 1 . 2]" 1
751 1 16 LEU MD1 2 4 ILE MD . . 3.780 2.323 1.998 2.988 . 0 0 "[ . 1 . 2]" 1
752 1 16 LEU MD2 2 4 ILE MD . . 3.780 2.695 2.119 3.010 . 0 0 "[ . 1 . 2]" 1
753 1 16 LEU MD1 2 4 ILE MG . . 4.380 4.520 3.633 4.693 0.313 2 0 "[ . 1 . 2]" 1
754 1 16 LEU MD2 2 4 ILE MG . . 4.380 4.466 4.194 4.748 0.368 17 0 "[ . 1 . 2]" 1
755 2 4 ILE HB 2 4 ILE MD . . 3.450 2.487 2.447 2.516 . 0 0 "[ . 1 . 2]" 1
756 1 16 LEU H 2 4 ILE HB . . 5.200 5.310 5.162 5.396 0.196 20 0 "[ . 1 . 2]" 1
757 2 5 PHE HA 2 6 VAL H . . 3.130 2.250 2.185 2.297 . 0 0 "[ . 1 . 2]" 1
758 2 5 PHE HB3 2 6 VAL H . . 4.540 3.688 3.069 4.001 . 0 0 "[ . 1 . 2]" 1
759 1 67 ALA HA 2 5 PHE H . . 3.150 3.125 2.806 3.374 0.224 7 0 "[ . 1 . 2]" 1
760 1 68 LEU H 2 5 PHE H . . 3.890 3.687 3.297 3.976 0.086 6 0 "[ . 1 . 2]" 1
761 1 15 THR HB 2 5 PHE QE . . 4.510 4.243 3.591 4.551 0.041 3 0 "[ . 1 . 2]" 1
762 1 15 THR MG 2 5 PHE QE . . 4.010 2.386 2.009 2.783 . 0 0 "[ . 1 . 2]" 1
763 1 15 THR HA 2 5 PHE QD . . 4.150 2.548 2.172 2.761 . 0 0 "[ . 1 . 2]" 1
764 1 13 THR MG 2 5 PHE HB3 . . 4.950 1.922 1.776 2.729 . 0 0 "[ . 1 . 2]" 1
765 1 15 THR HA 2 5 PHE HA . . 3.150 2.532 2.386 2.685 . 0 0 "[ . 1 . 2]" 1
766 1 14 ILE H 2 5 PHE HA . . 4.800 4.368 3.908 4.648 . 0 0 "[ . 1 . 2]" 1
767 1 16 LEU H 2 5 PHE HA . . 3.500 3.667 3.538 3.767 0.267 18 0 "[ . 1 . 2]" 1
768 1 65 GLU HA 2 5 PHE QD . . 4.810 3.789 3.393 4.021 . 0 0 "[ . 1 . 2]" 1
769 1 65 GLU HA 2 5 PHE QE . . 4.260 3.227 2.651 3.527 . 0 0 "[ . 1 . 2]" 1
770 1 65 GLU H 2 5 PHE QE . . 4.960 4.936 4.593 5.126 0.166 19 0 "[ . 1 . 2]" 1
771 1 13 THR MG 2 5 PHE HA . . 5.090 3.277 2.718 4.115 . 0 0 "[ . 1 . 2]" 1
772 2 5 PHE HA 2 6 VAL QG . . 5.050 3.655 3.249 4.031 . 0 0 "[ . 1 . 2]" 1
773 2 5 PHE HB2 2 6 VAL H . . 4.540 4.320 4.007 4.474 . 0 0 "[ . 1 . 2]" 1
774 1 13 THR MG 2 5 PHE HB2 . . 4.950 3.070 2.916 3.323 . 0 0 "[ . 1 . 2]" 1
775 1 65 GLU QG 2 5 PHE QE . . 3.720 3.319 2.954 3.876 0.156 4 0 "[ . 1 . 2]" 1
776 1 15 THR MG 2 5 PHE HZ . . 4.930 4.192 3.904 4.468 . 0 0 "[ . 1 . 2]" 1
777 1 15 THR MG 2 5 PHE QD . . 3.630 2.469 1.832 3.029 . 0 0 "[ . 1 . 2]" 1
778 1 67 ALA MB 2 5 PHE QD . . 4.920 3.045 2.310 3.848 . 0 0 "[ . 1 . 2]" 1
779 2 5 PHE H 2 5 PHE QD . . 4.780 3.413 3.218 3.667 . 0 0 "[ . 1 . 2]" 1
780 1 13 THR MG 2 5 PHE QD . . 4.880 3.404 3.130 4.178 . 0 0 "[ . 1 . 2]" 1
781 1 16 LEU H 2 5 PHE QD . . 4.880 4.105 3.601 4.567 . 0 0 "[ . 1 . 2]" 1
782 1 65 GLU HB2 2 5 PHE HZ . . 4.280 4.052 2.809 4.449 0.169 11 0 "[ . 1 . 2]" 1
783 1 65 GLU HB3 2 5 PHE HZ . . 4.280 3.014 2.651 3.823 . 0 0 "[ . 1 . 2]" 1
784 1 65 GLU QG 2 5 PHE HZ . . 4.780 3.091 2.158 4.902 0.122 7 0 "[ . 1 . 2]" 1
785 1 14 ILE H 2 6 VAL H . . 3.140 3.077 2.770 3.260 0.120 20 0 "[ . 1 . 2]" 1
786 1 15 THR HA 2 6 VAL H . . 3.530 3.714 3.477 3.876 0.346 5 0 "[ . 1 . 2]" 1
787 2 6 VAL H 2 6 VAL QG . . 3.630 2.330 2.048 2.830 . 0 0 "[ . 1 . 2]" 1
788 2 6 VAL HA 2 7 ASP H . . 3.090 2.136 2.071 2.201 . 0 0 "[ . 1 . 2]" 1
789 1 67 ALA HA 2 6 VAL HA . . 4.840 4.690 4.490 4.886 0.046 15 0 "[ . 1 . 2]" 1
790 1 68 LEU QB 2 6 VAL HA . . 4.580 2.319 1.941 2.975 . 0 0 "[ . 1 . 2]" 1
791 1 14 ILE HB 2 6 VAL QG . . 4.360 2.632 1.878 4.034 . 0 0 "[ . 1 . 2]" 1
792 1 14 ILE HB 2 6 VAL H . . 3.890 3.177 2.866 3.680 . 0 0 "[ . 1 . 2]" 1
793 1 13 THR MG 2 6 VAL H . . 3.730 3.524 3.123 3.948 0.218 9 0 "[ . 1 . 2]" 1
794 1 13 THR HA 2 7 ASP HA . . 3.170 1.901 1.722 2.272 . 0 0 "[ . 1 . 2]" 1
795 1 69 ILE H 2 7 ASP QB . . 5.000 4.768 4.329 5.137 0.137 12 0 "[ . 1 . 2]" 1
796 1 14 ILE H 2 7 ASP HA . . 4.270 3.138 2.661 3.769 . 0 0 "[ . 1 . 2]" 1
797 2 7 ASP HA 2 8 THR H . . 3.100 2.176 2.084 2.314 . 0 0 "[ . 1 . 2]" 1
798 1 68 LEU H 2 7 ASP H . . 4.100 3.841 3.531 4.229 0.129 8 0 "[ . 1 . 2]" 1
799 1 70 LEU H 2 7 ASP H . . 3.800 3.785 3.442 3.980 0.180 14 0 "[ . 1 . 2]" 1
800 1 68 LEU QB 2 7 ASP QB . . 5.120 5.011 4.600 5.370 0.250 10 0 "[ . 1 . 2]" 1
801 2 7 ASP H 2 7 ASP QB . . 3.850 2.311 2.235 2.489 . 0 0 "[ . 1 . 2]" 1
802 2 7 ASP HA 2 8 THR MG . . 4.440 3.763 3.310 4.119 . 0 0 "[ . 1 . 2]" 1
803 1 69 ILE HA 2 7 ASP H . . 4.140 2.822 2.455 3.147 . 0 0 "[ . 1 . 2]" 1
804 1 12 LYS H 2 8 THR H . . 3.500 3.201 2.788 3.542 0.042 13 0 "[ . 1 . 2]" 1
805 1 14 ILE MD 2 8 THR HB . . 4.200 4.028 3.330 4.357 0.157 1 0 "[ . 1 . 2]" 1
806 2 8 THR HB 2 9 VAL H . . 4.440 3.677 2.960 4.198 . 0 0 "[ . 1 . 2]" 1
807 2 8 THR HA 2 9 VAL H . . 3.100 2.194 2.115 2.279 . 0 0 "[ . 1 . 2]" 1
808 1 14 ILE H 2 8 THR MG . . 4.660 3.772 3.395 4.321 . 0 0 "[ . 1 . 2]" 1
809 2 8 THR MG 2 9 VAL H . . 4.770 3.890 3.647 4.095 . 0 0 "[ . 1 . 2]" 1
810 1 14 ILE MD 2 8 THR H . . 5.070 4.247 3.824 4.664 . 0 0 "[ . 1 . 2]" 1
811 1 13 THR HA 2 8 THR H . . 3.570 3.229 2.909 3.507 . 0 0 "[ . 1 . 2]" 1
812 2 9 VAL HB 2 10 GLN H . . 4.890 4.132 3.317 4.369 . 0 0 "[ . 1 . 2]" 1
813 2 9 VAL MG2 2 10 GLN H . . 4.300 3.295 2.563 4.416 0.116 12 0 "[ . 1 . 2]" 1
814 2 9 VAL MG1 2 10 GLN H . . 4.300 3.975 2.414 4.379 0.079 17 0 "[ . 1 . 2]" 1
815 2 10 GLN HA 2 11 TRP H . . 3.500 2.239 2.121 2.399 . 0 0 "[ . 1 . 2]" 1
816 2 10 GLN QB 2 11 TRP H . . 4.340 3.501 2.580 4.069 . 0 0 "[ . 1 . 2]" 1
817 2 10 GLN H 2 11 TRP H . . 4.340 4.084 3.522 4.470 0.130 8 0 "[ . 1 . 2]" 1
818 2 11 TRP HA 2 12 LYS H . . 3.560 2.178 2.101 2.449 . 0 0 "[ . 1 . 2]" 1
819 2 11 TRP HB3 2 12 LYS H . . 3.970 3.775 2.330 4.269 0.299 15 0 "[ . 1 . 2]" 1
820 2 11 TRP HB2 2 12 LYS H . . 3.970 4.060 2.976 4.237 0.267 18 0 "[ . 1 . 2]" 1
821 2 11 TRP HZ3 2 69 ILE MD . . 4.500 3.620 2.203 4.657 0.157 9 0 "[ . 1 . 2]" 1
822 2 11 TRP HZ3 2 69 ILE MG . . 4.900 4.355 2.883 5.062 0.162 5 0 "[ . 1 . 2]" 1
823 2 12 LYS HA 2 13 THR H . . 3.100 2.220 2.119 2.381 . 0 0 "[ . 1 . 2]" 1
824 2 13 THR HB 2 14 ILE H . . 4.870 4.304 4.155 4.410 . 0 0 "[ . 1 . 2]" 1
825 2 13 THR H 2 13 THR MG . . 4.770 3.851 3.785 3.975 . 0 0 "[ . 1 . 2]" 1
826 2 13 THR HA 2 13 THR MG . . 3.640 2.414 2.332 2.452 . 0 0 "[ . 1 . 2]" 1
827 2 13 THR MG 2 14 ILE H . . 4.030 3.026 2.690 3.233 . 0 0 "[ . 1 . 2]" 1
828 2 13 THR HA 2 14 ILE H . . 3.030 2.168 2.116 2.212 . 0 0 "[ . 1 . 2]" 1
829 2 14 ILE HB 2 15 THR H . . 4.780 3.874 3.256 4.377 . 0 0 "[ . 1 . 2]" 1
830 2 14 ILE MD 2 15 THR H . . 4.360 4.458 4.034 4.811 0.451 8 0 "[ . 1 . 2]" 1
831 2 14 ILE MG 2 15 THR H . . 4.860 2.427 1.789 3.319 . 0 0 "[ . 1 . 2]" 1
832 2 14 ILE HA 2 15 THR HA . . 4.740 4.517 4.446 4.612 . 0 0 "[ . 1 . 2]" 1
833 2 14 ILE HA 2 14 ILE MG . . 3.230 2.433 2.338 2.520 . 0 0 "[ . 1 . 2]" 1
834 2 14 ILE H 2 14 ILE MG . . 4.390 3.881 3.826 3.921 . 0 0 "[ . 1 . 2]" 1
835 2 14 ILE HB 2 14 ILE MD . . 3.390 2.839 2.395 3.295 . 0 0 "[ . 1 . 2]" 1
836 2 15 THR HB 2 16 LEU H . . 4.360 4.051 3.271 4.393 0.033 10 0 "[ . 1 . 2]" 1
837 2 15 THR HA 2 16 LEU H . . 3.110 2.132 2.078 2.190 . 0 0 "[ . 1 . 2]" 1
838 2 15 THR HA 2 16 LEU QB . . 5.000 4.464 3.856 4.656 . 0 0 "[ . 1 . 2]" 1
839 2 15 THR MG 2 16 LEU H . . 3.990 3.224 2.600 4.079 0.089 4 0 "[ . 1 . 2]" 1
840 2 16 LEU H 2 16 LEU MD2 . . 4.630 2.844 1.799 4.368 . 0 0 "[ . 1 . 2]" 1
841 2 16 LEU HA 2 17 GLU H . . 3.080 2.386 2.198 2.516 . 0 0 "[ . 1 . 2]" 1
842 2 16 LEU QB 2 17 GLU H . . 3.510 2.688 2.309 3.710 0.200 20 0 "[ . 1 . 2]" 1
843 2 16 LEU H 2 16 LEU QB . . 3.580 3.052 2.402 3.238 . 0 0 "[ . 1 . 2]" 1
844 1 4 ILE HB 2 16 LEU H . . 5.270 4.850 3.655 5.513 0.243 14 0 "[ . 1 . 2]" 1
845 2 16 LEU H 2 16 LEU MD1 . . 4.630 3.770 1.846 4.608 . 0 0 "[ . 1 . 2]" 1
846 2 16 LEU HA 2 16 LEU MD1 . . 3.980 3.986 3.597 4.187 0.207 15 0 "[ . 1 . 2]" 1
847 2 16 LEU HA 2 16 LEU MD2 . . 3.980 3.631 2.786 4.157 0.177 18 0 "[ . 1 . 2]" 1
848 2 17 GLU H 2 18 VAL H . . 5.300 4.445 4.328 4.561 . 0 0 "[ . 1 . 2]" 1
849 2 17 GLU HA 2 18 VAL H . . 3.100 2.199 2.067 2.323 . 0 0 "[ . 1 . 2]" 1
850 2 17 GLU H 2 17 GLU QG . . 4.240 3.919 3.188 4.268 0.028 15 0 "[ . 1 . 2]" 1
851 2 17 GLU HA 2 17 GLU QG . . 3.330 2.397 2.233 2.644 . 0 0 "[ . 1 . 2]" 1
852 2 17 GLU QG 2 18 VAL H . . 3.610 2.900 2.185 3.770 0.160 20 0 "[ . 1 . 2]" 1
853 2 17 GLU H 2 17 GLU HB2 . . 3.620 2.737 2.375 3.061 . 0 0 "[ . 1 . 2]" 1
854 2 17 GLU H 2 17 GLU HB3 . . 3.620 3.013 2.575 3.692 0.072 4 0 "[ . 1 . 2]" 1
855 2 18 VAL MG1 2 19 GLU H . . 4.220 3.149 2.729 3.389 . 0 0 "[ . 1 . 2]" 1
856 2 18 VAL HA 2 19 GLU H . . 3.290 2.514 2.444 2.673 . 0 0 "[ . 1 . 2]" 1
857 2 18 VAL MG2 2 19 GLU H . . 4.220 1.954 1.760 3.999 . 0 0 "[ . 1 . 2]" 1
858 2 18 VAL H 2 18 VAL MG1 . . 4.120 2.449 2.242 3.641 . 0 0 "[ . 1 . 2]" 1
859 2 18 VAL HB 2 19 GLU H . . 3.980 3.872 2.540 4.007 0.027 18 0 "[ . 1 . 2]" 1
860 2 18 VAL H 2 18 VAL MG2 . . 4.120 3.928 2.085 4.105 . 0 0 "[ . 1 . 2]" 1
861 2 19 GLU HB2 2 22 ASP H . . 4.090 2.997 2.586 4.146 0.056 18 0 "[ . 1 . 2]" 1
862 2 19 GLU HB3 2 22 ASP H . . 4.090 3.494 2.889 4.549 0.459 18 0 "[ . 1 . 2]" 1
863 2 19 GLU H 2 21 SER H . . 5.300 5.172 4.846 5.423 0.123 17 0 "[ . 1 . 2]" 1
864 2 19 GLU HA 2 20 PRO HD2 . . 3.370 2.460 2.214 2.878 . 0 0 "[ . 1 . 2]" 1
865 2 19 GLU HA 2 21 SER H . . 4.160 4.140 3.928 4.303 0.143 10 0 "[ . 1 . 2]" 1
866 2 19 GLU HA 2 20 PRO HD3 . . 3.370 2.365 1.902 2.579 . 0 0 "[ . 1 . 2]" 1
867 2 19 GLU H 2 20 PRO HD2 . . 5.150 4.961 4.844 5.271 0.121 17 0 "[ . 1 . 2]" 1
868 2 19 GLU HB3 2 20 PRO HD2 . . 5.130 2.399 2.064 3.802 . 0 0 "[ . 1 . 2]" 1
869 2 19 GLU H 2 20 PRO HD3 . . 5.150 5.029 4.642 5.193 0.043 3 0 "[ . 1 . 2]" 1
870 2 19 GLU H 2 19 GLU HG2 . . 4.260 3.113 2.560 4.155 . 0 0 "[ . 1 . 2]" 1
871 2 19 GLU HA 2 19 GLU HG2 . . 3.780 3.122 2.599 3.826 0.046 18 0 "[ . 1 . 2]" 1
872 2 19 GLU H 2 19 GLU HG3 . . 4.260 4.072 3.046 4.292 0.032 4 0 "[ . 1 . 2]" 1
873 2 19 GLU HA 2 19 GLU HG3 . . 3.780 3.703 3.042 3.815 0.035 3 0 "[ . 1 . 2]" 1
874 2 19 GLU HB3 2 20 PRO HD3 . . 5.130 3.706 3.329 4.689 . 0 0 "[ . 1 . 2]" 1
875 2 19 GLU HB2 2 20 PRO HD2 . . 5.130 3.775 2.253 4.471 . 0 0 "[ . 1 . 2]" 1
876 2 19 GLU HB2 2 20 PRO HD3 . . 5.130 4.738 3.574 5.032 . 0 0 "[ . 1 . 2]" 1
877 2 19 GLU HA 2 20 PRO HG2 . . 4.890 4.564 4.433 4.756 . 0 0 "[ . 1 . 2]" 1
878 2 19 GLU HA 2 20 PRO HG3 . . 4.890 4.513 4.077 4.724 . 0 0 "[ . 1 . 2]" 1
879 2 19 GLU H 2 57 LEU HG . . 5.080 3.672 3.317 3.775 . 0 0 "[ . 1 . 2]" 1
880 2 19 GLU H 2 57 LEU MD1 . . 4.700 4.861 4.589 4.956 0.256 10 0 "[ . 1 . 2]" 1
881 2 19 GLU H 2 57 LEU MD2 . . 4.700 4.026 3.865 4.269 . 0 0 "[ . 1 . 2]" 1
882 2 19 GLU H 2 22 ASP H . . 4.200 4.042 3.787 4.287 0.087 17 0 "[ . 1 . 2]" 1
883 2 20 PRO HA 2 22 ASP H . . 3.920 3.974 3.902 4.104 0.184 18 0 "[ . 1 . 2]" 1
884 2 20 PRO HA 2 58 SER H . . 3.770 3.079 2.808 3.339 . 0 0 "[ . 1 . 2]" 1
885 2 20 PRO HD2 2 21 SER H . . 4.860 2.782 2.566 2.879 . 0 0 "[ . 1 . 2]" 1
886 2 20 PRO HD3 2 21 SER H . . 4.860 3.945 3.853 4.070 . 0 0 "[ . 1 . 2]" 1
887 2 20 PRO HG2 2 21 SER H . . 4.900 2.850 2.377 4.214 . 0 0 "[ . 1 . 2]" 1
888 2 20 PRO HG3 2 21 SER H . . 4.900 4.141 3.910 4.652 . 0 0 "[ . 1 . 2]" 1
889 2 20 PRO HA 2 57 LEU HG . . 4.600 3.935 3.669 4.087 . 0 0 "[ . 1 . 2]" 1
890 2 21 SER HB3 2 56 THR MG . . 5.060 4.562 4.180 5.147 0.087 4 0 "[ . 1 . 2]" 1
891 2 21 SER HB2 2 22 ASP H . . 4.440 3.536 3.283 4.265 . 0 0 "[ . 1 . 2]" 1
892 2 21 SER H 2 22 ASP H . . 3.340 2.529 2.434 2.626 . 0 0 "[ . 1 . 2]" 1
893 2 21 SER H 2 21 SER HB3 . . 3.700 3.494 2.738 3.684 . 0 0 "[ . 1 . 2]" 1
894 2 21 SER H 2 21 SER HB2 . . 3.700 2.694 2.442 3.637 . 0 0 "[ . 1 . 2]" 1
895 2 21 SER HB3 2 22 ASP H . . 4.440 4.303 4.193 4.450 0.010 16 0 "[ . 1 . 2]" 1
896 2 21 SER HB2 2 56 THR MG . . 5.060 5.040 4.414 5.252 0.192 19 0 "[ . 1 . 2]" 1
897 2 21 SER HA 2 56 THR MG . . 4.110 2.985 2.622 3.268 . 0 0 "[ . 1 . 2]" 1
898 2 21 SER HA 2 22 ASP H . . 3.410 3.400 3.312 3.518 0.108 18 0 "[ . 1 . 2]" 1
899 2 22 ASP H 2 22 ASP HB2 . . 3.510 2.424 2.261 3.723 0.213 18 0 "[ . 1 . 2]" 1
900 2 22 ASP H 2 22 ASP HB3 . . 3.510 3.501 2.605 3.647 0.137 20 0 "[ . 1 . 2]" 1
901 2 22 ASP H 2 57 LEU H . . 4.100 4.176 4.101 4.257 0.157 13 0 "[ . 1 . 2]" 1
902 2 22 ASP HB3 2 26 ASN HD22 . . 4.500 3.123 1.955 4.499 . 0 0 "[ . 1 . 2]" 1
903 2 22 ASP HB2 2 26 ASN HD22 . . 4.500 4.377 2.309 4.730 0.230 3 0 "[ . 1 . 2]" 1
904 2 22 ASP HB3 2 26 ASN HD21 . . 4.500 2.439 1.756 3.822 . 0 0 "[ . 1 . 2]" 1
905 2 22 ASP HB2 2 26 ASN HD21 . . 4.500 3.800 1.881 4.448 . 0 0 "[ . 1 . 2]" 1
906 2 22 ASP HA 2 23 THR H . . 3.100 2.312 2.197 2.529 . 0 0 "[ . 1 . 2]" 1
907 2 22 ASP HA 2 23 THR MG . . 4.190 4.153 3.715 4.321 0.131 14 0 "[ . 1 . 2]" 1
908 2 23 THR HA 2 56 THR H . . 4.950 4.463 4.244 4.625 . 0 0 "[ . 1 . 2]" 1
909 2 23 THR HB 2 24 ILE MD . . 5.170 5.135 4.853 5.303 0.133 18 0 "[ . 1 . 2]" 1
910 2 23 THR HB 2 25 GLU HA . . 4.750 4.799 4.305 4.959 0.209 16 0 "[ . 1 . 2]" 1
911 2 23 THR HB 2 24 ILE HB . . 4.240 4.284 4.177 4.383 0.143 5 0 "[ . 1 . 2]" 1
912 2 23 THR HB 2 24 ILE HA . . 4.600 4.656 4.564 4.829 0.229 5 0 "[ . 1 . 2]" 1
913 2 23 THR HB 2 25 GLU QG . . 4.220 2.583 2.098 4.248 0.028 6 0 "[ . 1 . 2]" 1
914 2 23 THR HB 2 25 GLU H . . 3.220 2.224 1.937 2.416 . 0 0 "[ . 1 . 2]" 1
915 2 23 THR HB 2 24 ILE H . . 3.650 2.499 2.287 2.731 . 0 0 "[ . 1 . 2]" 1
916 2 23 THR H 2 56 THR HA . . 4.500 4.464 4.273 4.627 0.127 11 0 "[ . 1 . 2]" 1
917 2 23 THR HA 2 24 ILE H . . 3.530 2.346 2.205 2.469 . 0 0 "[ . 1 . 2]" 1
918 2 23 THR HA 2 56 THR HA . . 3.500 1.892 1.653 2.005 . 0 0 "[ . 1 . 2]" 1
919 2 23 THR HA 2 57 LEU H . . 4.610 3.381 3.069 3.710 . 0 0 "[ . 1 . 2]" 1
920 2 23 THR MG 2 24 ILE H . . 3.720 3.257 3.187 3.417 . 0 0 "[ . 1 . 2]" 1
921 2 23 THR H 2 23 THR MG . . 3.200 2.990 2.739 3.184 . 0 0 "[ . 1 . 2]" 1
922 2 23 THR MG 2 56 THR HA . . 4.100 2.945 2.525 3.390 . 0 0 "[ . 1 . 2]" 1
923 2 23 THR MG 2 24 ILE HB . . 4.990 5.060 5.010 5.149 0.159 15 0 "[ . 1 . 2]" 1
924 2 23 THR MG 2 25 GLU QB . . 4.720 4.215 3.146 4.579 . 0 0 "[ . 1 . 2]" 1
925 2 23 THR HA 2 56 THR MG . . 3.650 3.101 2.447 3.508 . 0 0 "[ . 1 . 2]" 1
926 2 24 ILE H 2 24 ILE MG . . 4.780 3.804 3.783 3.821 . 0 0 "[ . 1 . 2]" 1
927 2 24 ILE MG 2 25 GLU H . . 4.500 3.877 3.703 4.022 . 0 0 "[ . 1 . 2]" 1
928 2 24 ILE H 2 25 GLU H . . 3.500 2.565 2.417 2.764 . 0 0 "[ . 1 . 2]" 1
929 2 24 ILE MG 2 53 ASP H . . 4.600 4.185 3.920 4.597 . 0 0 "[ . 1 . 2]" 1
930 2 24 ILE H 2 55 ARG H . . 5.020 3.616 3.162 3.873 . 0 0 "[ . 1 . 2]" 1
931 2 24 ILE MD 2 55 ARG H . . 4.500 4.754 4.590 4.888 0.388 6 0 "[ . 1 . 2]" 1
932 2 24 ILE MD 2 56 THR H . . 4.500 4.541 4.297 4.691 0.191 14 0 "[ . 1 . 2]" 1
933 2 24 ILE HA 2 27 VAL H . . 4.080 3.186 2.861 3.411 . 0 0 "[ . 1 . 2]" 1
934 2 24 ILE HA 2 24 ILE MG . . 3.500 2.462 2.420 2.501 . 0 0 "[ . 1 . 2]" 1
935 2 24 ILE HA 2 25 GLU H . . 3.500 3.481 3.430 3.524 0.024 1 0 "[ . 1 . 2]" 1
936 2 24 ILE HA 2 27 VAL HB . . 4.080 3.264 2.845 3.701 . 0 0 "[ . 1 . 2]" 1
937 2 24 ILE MG 2 25 GLU HA . . 4.890 3.953 3.639 4.142 . 0 0 "[ . 1 . 2]" 1
938 2 24 ILE H 2 56 THR HA . . 3.740 3.317 2.970 3.662 . 0 0 "[ . 1 . 2]" 1
939 2 24 ILE HB 2 53 ASP HA . . 3.700 2.057 1.690 2.962 . 0 0 "[ . 1 . 2]" 1
940 2 24 ILE MG 2 52 GLU HA . . 5.200 4.468 3.989 4.872 . 0 0 "[ . 1 . 2]" 1
941 2 24 ILE HB 2 25 GLU H . . 4.830 3.025 2.802 3.221 . 0 0 "[ . 1 . 2]" 1
942 2 24 ILE H 2 24 ILE HB . . 4.020 2.577 2.514 2.669 . 0 0 "[ . 1 . 2]" 1
943 2 24 ILE MD 2 57 LEU MD1 . . 3.900 2.379 2.174 2.530 . 0 0 "[ . 1 . 2]" 1
944 2 24 ILE MD 2 57 LEU MD2 . . 3.900 1.953 1.787 2.181 . 0 0 "[ . 1 . 2]" 1
945 2 24 ILE MG 2 57 LEU MD2 . . 4.200 4.081 3.822 4.193 . 0 0 "[ . 1 . 2]" 1
946 2 24 ILE MG 2 57 LEU MD1 . . 4.200 4.159 3.903 4.292 0.092 3 0 "[ . 1 . 2]" 1
947 2 24 ILE H 2 56 THR MG . . 4.880 4.883 4.258 5.170 0.290 16 0 "[ . 1 . 2]" 1
948 2 24 ILE HA 2 28 LYS H . . 4.750 4.361 4.071 4.589 . 0 0 "[ . 1 . 2]" 1
949 2 24 ILE MG 2 27 VAL H . . 4.640 4.069 3.773 4.309 . 0 0 "[ . 1 . 2]" 1
950 2 24 ILE MG 2 55 ARG H . . 5.300 4.554 4.109 5.006 . 0 0 "[ . 1 . 2]" 1
951 2 24 ILE MG 2 53 ASP HA . . 3.740 2.606 2.211 3.011 . 0 0 "[ . 1 . 2]" 1
952 2 24 ILE H 2 24 ILE MD . . 3.840 3.071 2.890 3.234 . 0 0 "[ . 1 . 2]" 1
953 2 24 ILE MD 2 56 THR HA . . 5.010 3.822 3.530 4.142 . 0 0 "[ . 1 . 2]" 1
954 2 24 ILE MD 2 51 LEU HA . . 4.220 4.169 3.726 4.372 0.152 19 0 "[ . 1 . 2]" 1
955 2 24 ILE HA 2 24 ILE MD . . 3.280 2.219 2.100 2.316 . 0 0 "[ . 1 . 2]" 1
956 2 24 ILE MD 2 60 TYR QE . . 4.020 2.700 2.168 3.854 . 0 0 "[ . 1 . 2]" 1
957 2 25 GLU H 2 27 VAL H . . 4.500 4.384 4.161 4.555 0.055 20 0 "[ . 1 . 2]" 1
958 2 25 GLU H 2 26 ASN H . . 3.200 2.744 2.665 3.036 . 0 0 "[ . 1 . 2]" 1
959 2 25 GLU QB 2 26 ASN H . . 3.930 3.515 2.598 3.731 . 0 0 "[ . 1 . 2]" 1
960 2 25 GLU HA 2 29 ALA MB . . 4.740 4.392 4.141 4.744 0.004 1 0 "[ . 1 . 2]" 1
961 2 25 GLU HA 2 28 LYS H . . 4.050 3.470 2.952 3.885 . 0 0 "[ . 1 . 2]" 1
962 2 25 GLU HA 2 28 LYS QG . . 4.410 2.630 1.758 4.501 0.091 20 0 "[ . 1 . 2]" 1
963 2 25 GLU H 2 53 ASP HA . . 4.660 3.563 2.964 4.702 0.042 11 0 "[ . 1 . 2]" 1
964 2 25 GLU H 2 25 GLU QG . . 4.920 2.577 2.233 3.975 . 0 0 "[ . 1 . 2]" 1
965 2 25 GLU QG 2 26 ASN HA . . 4.070 3.488 3.234 4.232 0.162 5 0 "[ . 1 . 2]" 1
966 2 25 GLU QG 2 26 ASN H . . 3.820 2.498 2.269 3.376 . 0 0 "[ . 1 . 2]" 1
967 2 25 GLU HA 2 25 GLU QG . . 3.650 3.343 2.713 3.514 . 0 0 "[ . 1 . 2]" 1
968 2 25 GLU HA 2 29 ALA H . . 4.410 3.880 3.614 4.050 . 0 0 "[ . 1 . 2]" 1
969 2 26 ASN HA 2 29 ALA H . . 4.200 3.650 3.381 3.922 . 0 0 "[ . 1 . 2]" 1
970 2 26 ASN HB3 2 27 VAL H . . 4.570 3.442 2.211 3.770 . 0 0 "[ . 1 . 2]" 1
971 2 26 ASN H 2 27 VAL H . . 3.160 2.719 2.556 2.869 . 0 0 "[ . 1 . 2]" 1
972 2 26 ASN H 2 26 ASN HB2 . . 3.700 2.577 2.271 3.615 . 0 0 "[ . 1 . 2]" 1
973 2 26 ASN H 2 26 ASN HB3 . . 3.700 3.458 2.377 3.637 . 0 0 "[ . 1 . 2]" 1
974 2 26 ASN HA 2 30 LYS H . . 4.510 4.222 4.007 4.373 . 0 0 "[ . 1 . 2]" 1
975 2 26 ASN HA 2 27 VAL H . . 3.570 3.565 3.536 3.605 0.035 3 0 "[ . 1 . 2]" 1
976 2 26 ASN HA 2 27 VAL HA . . 4.810 4.854 4.785 4.901 0.091 20 0 "[ . 1 . 2]" 1
977 2 26 ASN HB2 2 27 VAL H . . 4.570 2.693 2.328 4.035 . 0 0 "[ . 1 . 2]" 1
978 2 26 ASN HA 2 29 ALA MB . . 3.800 2.710 2.432 2.927 . 0 0 "[ . 1 . 2]" 1
979 2 27 VAL H 2 28 LYS H . . 3.130 2.715 2.606 2.853 . 0 0 "[ . 1 . 2]" 1
980 2 27 VAL H 2 27 VAL HB . . 3.470 2.599 2.491 2.669 . 0 0 "[ . 1 . 2]" 1
981 2 27 VAL H 2 27 VAL MG2 . . 3.770 2.100 1.946 3.838 0.068 3 0 "[ . 1 . 2]" 1
982 2 27 VAL HA 2 30 LYS H . . 4.070 3.526 3.228 3.755 . 0 0 "[ . 1 . 2]" 1
983 2 27 VAL HA 2 27 VAL MG2 . . 3.260 2.497 2.403 2.542 . 0 0 "[ . 1 . 2]" 1
984 2 27 VAL HA 2 28 LYS HA . . 4.920 4.854 4.745 4.991 0.071 16 0 "[ . 1 . 2]" 1
985 2 27 VAL HB 2 28 LYS H . . 3.960 2.602 2.349 4.041 0.081 3 0 "[ . 1 . 2]" 1
986 2 27 VAL HA 2 30 LYS QG . . 4.920 2.788 1.886 3.585 . 0 0 "[ . 1 . 2]" 1
987 2 27 VAL H 2 30 LYS QG . . 4.830 4.400 4.140 4.774 . 0 0 "[ . 1 . 2]" 1
988 2 27 VAL H 2 27 VAL MG1 . . 3.770 3.727 2.183 3.827 0.057 6 0 "[ . 1 . 2]" 1
989 2 27 VAL HA 2 27 VAL MG1 . . 3.260 2.498 2.391 3.279 0.019 3 0 "[ . 1 . 2]" 1
990 2 28 LYS H 2 29 ALA H . . 3.150 2.701 2.606 2.912 . 0 0 "[ . 1 . 2]" 1
991 2 28 LYS HA 2 31 ILE H . . 5.130 3.675 3.393 4.000 . 0 0 "[ . 1 . 2]" 1
992 2 28 LYS HA 2 32 GLN H . . 4.730 4.079 3.771 4.266 . 0 0 "[ . 1 . 2]" 1
993 2 28 LYS H 2 28 LYS QG . . 3.920 2.936 1.972 4.035 0.115 19 0 "[ . 1 . 2]" 1
994 2 28 LYS QG 2 29 ALA HA . . 4.880 3.702 2.943 4.649 . 0 0 "[ . 1 . 2]" 1
995 2 28 LYS HA 2 31 ILE MG . . 4.310 3.828 3.362 4.206 . 0 0 "[ . 1 . 2]" 1
996 2 28 LYS HA 2 31 ILE MD . . 4.020 2.454 2.184 2.808 . 0 0 "[ . 1 . 2]" 1
997 2 29 ALA HA 2 32 GLN H . . 3.970 3.598 3.363 3.950 . 0 0 "[ . 1 . 2]" 1
998 2 29 ALA HA 2 32 GLN HB3 . . 4.090 2.483 2.052 3.009 . 0 0 "[ . 1 . 2]" 1
999 2 29 ALA HA 2 32 GLN HB2 . . 4.090 3.463 3.045 4.108 0.018 7 0 "[ . 1 . 2]" 1
1000 2 29 ALA HA 2 39 PRO QD . . 4.780 4.862 4.490 5.054 0.274 1 0 "[ . 1 . 2]" 1
1001 2 29 ALA H 2 30 LYS H . . 3.100 2.628 2.541 2.769 . 0 0 "[ . 1 . 2]" 1
1002 2 30 LYS HB3 2 31 ILE H . . 4.160 3.664 3.246 4.064 . 0 0 "[ . 1 . 2]" 1
1003 2 30 LYS H 2 31 ILE H . . 3.290 2.687 2.556 2.887 . 0 0 "[ . 1 . 2]" 1
1004 2 30 LYS HA 2 33 ASP HB2 . . 3.610 3.252 2.709 3.736 0.126 8 0 "[ . 1 . 2]" 1
1005 2 30 LYS HA 2 34 LYS QG . . 3.460 3.474 2.918 3.657 0.197 15 0 "[ . 1 . 2]" 1
1006 2 30 LYS HA 2 34 LYS H . . 5.240 3.870 3.546 4.207 . 0 0 "[ . 1 . 2]" 1
1007 2 30 LYS H 2 30 LYS QE . . 4.620 4.065 2.869 4.698 0.078 12 0 "[ . 1 . 2]" 1
1008 2 30 LYS QE 2 30 LYS QG . . 3.160 2.320 2.184 2.478 . 0 0 "[ . 1 . 2]" 1
1009 2 30 LYS HA 2 33 ASP HB3 . . 3.610 2.520 2.093 3.018 . 0 0 "[ . 1 . 2]" 1
1010 2 30 LYS HB2 2 31 ILE H . . 4.160 2.955 2.365 4.032 . 0 0 "[ . 1 . 2]" 1
1011 2 30 LYS HA 2 30 LYS QD . . 4.980 2.772 1.926 4.632 . 0 0 "[ . 1 . 2]" 1
1012 2 30 LYS H 2 30 LYS QD . . 4.550 3.828 3.188 4.524 . 0 0 "[ . 1 . 2]" 1
1013 2 30 LYS H 2 30 LYS QG . . 4.220 2.493 2.280 2.642 . 0 0 "[ . 1 . 2]" 1
1014 2 31 ILE HB 2 32 GLN H . . 4.050 3.953 3.773 4.070 0.020 14 0 "[ . 1 . 2]" 1
1015 2 31 ILE H 2 31 ILE HB . . 3.650 3.699 3.658 3.737 0.087 14 0 "[ . 1 . 2]" 1
1016 2 31 ILE H 2 31 ILE MG . . 3.620 2.305 2.213 2.425 . 0 0 "[ . 1 . 2]" 1
1017 2 31 ILE HA 2 35 GLU H . . 5.060 3.188 2.802 3.715 . 0 0 "[ . 1 . 2]" 1
1018 2 31 ILE HA 2 34 LYS H . . 4.530 3.563 3.366 3.969 . 0 0 "[ . 1 . 2]" 1
1019 2 31 ILE HA 2 31 ILE MG . . 3.150 2.373 2.290 2.414 . 0 0 "[ . 1 . 2]" 1
1020 2 31 ILE HA 2 35 GLU QB . . 4.450 3.685 2.815 4.638 0.188 8 0 "[ . 1 . 2]" 1
1021 2 31 ILE H 2 32 GLN H . . 3.180 2.621 2.504 2.784 . 0 0 "[ . 1 . 2]" 1
1022 2 31 ILE HB 2 37 ILE HB . . 5.160 2.899 2.131 4.954 . 0 0 "[ . 1 . 2]" 1
1023 2 31 ILE HA 2 34 LYS QB . . 4.190 2.988 2.568 3.477 . 0 0 "[ . 1 . 2]" 1
1024 2 31 ILE HB 2 37 ILE HG12 . . 4.920 4.566 4.014 5.100 0.180 9 0 "[ . 1 . 2]" 1
1025 2 31 ILE HB 2 37 ILE HG13 . . 4.920 3.595 3.116 4.085 . 0 0 "[ . 1 . 2]" 1
1026 2 31 ILE HA 2 34 LYS QG . . 4.830 3.966 3.208 4.614 . 0 0 "[ . 1 . 2]" 1
1027 2 31 ILE MG 2 32 GLN H . . 4.540 4.060 3.973 4.167 . 0 0 "[ . 1 . 2]" 1
1028 2 31 ILE MD 2 32 GLN H . . 4.840 3.898 2.453 4.171 . 0 0 "[ . 1 . 2]" 1
1029 2 31 ILE H 2 31 ILE MD . . 4.460 3.718 3.523 3.867 . 0 0 "[ . 1 . 2]" 1
1030 2 31 ILE HA 2 31 ILE MD . . 4.100 4.208 3.810 4.262 0.162 1 0 "[ . 1 . 2]" 1
1031 2 31 ILE HB 2 31 ILE MD . . 3.710 2.488 2.338 2.581 . 0 0 "[ . 1 . 2]" 1
1032 2 31 ILE HB 2 37 ILE MD . . 3.730 1.967 1.768 2.476 . 0 0 "[ . 1 . 2]" 1
1033 2 31 ILE MG 2 70 LEU MD1 . . 4.000 3.552 2.164 4.142 0.142 4 0 "[ . 1 . 2]" 1
1034 2 31 ILE MG 2 70 LEU MD2 . . 4.000 3.253 1.983 4.110 0.110 16 0 "[ . 1 . 2]" 1
1035 2 31 ILE MD 2 70 LEU MD1 . . 4.000 2.633 1.903 3.485 . 0 0 "[ . 1 . 2]" 1
1036 2 31 ILE MD 2 70 LEU MD2 . . 4.000 2.450 1.869 3.263 . 0 0 "[ . 1 . 2]" 1
1037 2 32 GLN H 2 32 GLN HB2 . . 4.010 2.547 2.408 2.711 . 0 0 "[ . 1 . 2]" 1
1038 2 32 GLN H 2 32 GLN HB3 . . 4.010 2.521 2.349 2.664 . 0 0 "[ . 1 . 2]" 1
1039 2 32 GLN HA 2 37 ILE H . . 3.810 2.241 1.983 2.643 . 0 0 "[ . 1 . 2]" 1
1040 2 32 GLN HB3 2 33 ASP H . . 3.930 2.686 2.504 3.027 . 0 0 "[ . 1 . 2]" 1
1041 2 32 GLN H 2 33 ASP H . . 3.240 2.618 2.450 2.763 . 0 0 "[ . 1 . 2]" 1
1042 2 32 GLN HA 2 35 GLU H . . 4.440 4.257 3.868 4.454 0.014 9 0 "[ . 1 . 2]" 1
1043 2 32 GLN HA 2 36 GLY H . . 3.450 3.118 2.549 3.436 . 0 0 "[ . 1 . 2]" 1
1044 2 32 GLN HB2 2 33 ASP H . . 3.930 3.918 3.846 4.013 0.083 17 0 "[ . 1 . 2]" 1
1045 2 33 ASP H 2 33 ASP HB3 . . 3.080 2.497 2.412 2.645 . 0 0 "[ . 1 . 2]" 1
1046 2 33 ASP H 2 33 ASP HB2 . . 3.080 2.539 2.391 2.644 . 0 0 "[ . 1 . 2]" 1
1047 2 33 ASP H 2 34 LYS H . . 3.110 2.599 2.383 2.731 . 0 0 "[ . 1 . 2]" 1
1048 2 33 ASP HB3 2 34 LYS H . . 3.680 2.461 2.339 2.763 . 0 0 "[ . 1 . 2]" 1
1049 2 33 ASP H 2 35 GLU H . . 5.110 4.344 4.163 4.719 . 0 0 "[ . 1 . 2]" 1
1050 2 33 ASP HB2 2 34 LYS H . . 3.680 3.768 3.682 3.860 0.180 20 0 "[ . 1 . 2]" 1
1051 2 34 LYS H 2 37 ILE H . . 5.390 5.261 5.049 5.434 0.044 10 0 "[ . 1 . 2]" 1
1052 2 34 LYS H 2 36 GLY H . . 4.090 3.676 3.510 4.090 0.000 13 0 "[ . 1 . 2]" 1
1053 2 34 LYS H 2 35 GLU H . . 3.170 2.623 2.366 2.927 . 0 0 "[ . 1 . 2]" 1
1054 2 34 LYS H 2 34 LYS QB . . 3.100 2.454 2.340 2.633 . 0 0 "[ . 1 . 2]" 1
1055 2 34 LYS H 2 34 LYS QG . . 3.380 2.389 2.174 2.659 . 0 0 "[ . 1 . 2]" 1
1056 2 34 LYS QB 2 35 GLU H . . 3.460 2.372 2.087 2.626 . 0 0 "[ . 1 . 2]" 1
1057 2 34 LYS QB 2 36 GLY H . . 4.650 4.311 4.047 4.504 . 0 0 "[ . 1 . 2]" 1
1058 2 34 LYS H 2 34 LYS QD . . 4.180 3.704 3.222 4.304 0.124 6 0 "[ . 1 . 2]" 1
1059 2 34 LYS HA 2 34 LYS QG . . 3.190 2.837 2.422 3.202 0.012 14 0 "[ . 1 . 2]" 1
1060 2 34 LYS QE 2 34 LYS QG . . 3.260 2.306 2.164 2.449 . 0 0 "[ . 1 . 2]" 1
1061 2 34 LYS QG 2 35 GLU H . . 4.320 4.012 3.906 4.241 . 0 0 "[ . 1 . 2]" 1
1062 2 35 GLU HA 2 37 ILE H . . 5.080 4.808 4.549 5.122 0.042 13 0 "[ . 1 . 2]" 1
1063 2 35 GLU H 2 36 GLY H . . 3.200 2.242 2.052 2.494 . 0 0 "[ . 1 . 2]" 1
1064 2 35 GLU H 2 37 ILE H . . 4.560 3.662 3.161 3.954 . 0 0 "[ . 1 . 2]" 1
1065 2 35 GLU H 2 35 GLU HG2 . . 3.920 2.926 2.289 3.889 . 0 0 "[ . 1 . 2]" 1
1066 2 35 GLU H 2 35 GLU HG3 . . 3.920 3.462 2.415 3.972 0.052 4 0 "[ . 1 . 2]" 1
1067 2 35 GLU H 2 35 GLU QB . . 3.510 2.534 2.330 3.049 . 0 0 "[ . 1 . 2]" 1
1068 2 35 GLU QB 2 36 GLY H . . 4.650 3.251 2.658 3.958 . 0 0 "[ . 1 . 2]" 1
1069 2 35 GLU HA 2 35 GLU HG2 . . 3.860 3.030 2.430 3.792 . 0 0 "[ . 1 . 2]" 1
1070 2 35 GLU HA 2 35 GLU HG3 . . 3.860 3.611 3.026 3.898 0.038 3 0 "[ . 1 . 2]" 1
1071 2 36 GLY H 2 37 ILE H . . 3.110 2.514 2.023 2.652 . 0 0 "[ . 1 . 2]" 1
1072 2 37 ILE H 2 37 ILE MG . . 4.090 3.791 3.257 3.859 . 0 0 "[ . 1 . 2]" 1
1073 2 37 ILE HA 2 38 PRO QG . . 4.210 3.887 3.700 4.044 . 0 0 "[ . 1 . 2]" 1
1074 2 37 ILE MD 2 70 LEU MD1 . . 3.340 3.131 1.841 3.558 0.218 16 0 "[ . 1 . 2]" 1
1075 2 37 ILE MG 2 70 LEU MD1 . . 3.540 3.022 1.902 3.798 0.258 1 0 "[ . 1 . 2]" 1
1076 2 37 ILE MD 2 70 LEU MD2 . . 3.340 2.178 1.770 3.534 0.194 15 0 "[ . 1 . 2]" 1
1077 2 37 ILE MG 2 70 LEU MD2 . . 3.540 2.543 1.804 3.685 0.145 13 0 "[ . 1 . 2]" 1
1078 2 37 ILE H 2 37 ILE HB . . 3.830 2.587 2.320 3.624 . 0 0 "[ . 1 . 2]" 1
1079 2 37 ILE HA 2 37 ILE MG . . 3.470 2.461 2.278 2.593 . 0 0 "[ . 1 . 2]" 1
1080 2 37 ILE H 2 37 ILE MD . . 3.660 3.676 3.520 3.738 0.078 8 0 "[ . 1 . 2]" 1
1081 2 39 PRO HB2 2 40 ASP H . . 3.860 3.060 2.778 3.457 . 0 0 "[ . 1 . 2]" 1
1082 2 39 PRO HB3 2 40 ASP H . . 3.860 4.030 3.931 4.173 0.313 13 0 "[ . 1 . 2]" 1
1083 2 38 PRO QG 2 41 GLN HE21 . . 4.500 3.400 1.864 4.791 0.291 10 0 "[ . 1 . 2]" 1
1084 2 38 PRO QG 2 41 GLN HE22 . . 4.500 3.931 2.525 4.804 0.304 5 0 "[ . 1 . 2]" 1
1085 2 39 PRO HA 2 42 GLN H . . 4.380 3.688 2.957 4.299 . 0 0 "[ . 1 . 2]" 1
1086 2 39 PRO HG3 2 40 ASP H . . 4.430 3.934 3.683 4.213 . 0 0 "[ . 1 . 2]" 1
1087 2 39 PRO QD 2 40 ASP H . . 4.590 3.099 2.832 3.380 . 0 0 "[ . 1 . 2]" 1
1088 2 39 PRO HG2 2 40 ASP H . . 4.430 2.372 2.025 2.776 . 0 0 "[ . 1 . 2]" 1
1089 2 40 ASP H 2 41 GLN H . . 3.020 2.638 2.318 2.914 . 0 0 "[ . 1 . 2]" 1
1090 2 40 ASP H 2 42 GLN H . . 5.310 4.015 3.662 4.407 . 0 0 "[ . 1 . 2]" 1
1091 2 40 ASP H 2 40 ASP QB . . 3.160 2.537 2.444 2.642 . 0 0 "[ . 1 . 2]" 1
1092 2 40 ASP QB 2 41 GLN H . . 3.920 2.790 2.392 3.445 . 0 0 "[ . 1 . 2]" 1
1093 2 41 GLN H 2 42 GLN H . . 3.100 2.444 2.262 2.703 . 0 0 "[ . 1 . 2]" 1
1094 2 41 GLN H 2 41 GLN QG . . 3.800 3.161 2.116 4.053 0.253 18 0 "[ . 1 . 2]" 1
1095 2 41 GLN QB 2 73 THR MG . . 4.730 3.825 2.383 4.683 . 0 0 "[ . 1 . 2]" 1
1096 2 42 GLN HA 2 43 ARG H . . 3.490 2.220 2.062 2.420 . 0 0 "[ . 1 . 2]" 1
1097 2 43 ARG QG 2 74 LEU H . . 4.740 3.297 2.368 4.948 0.208 10 0 "[ . 1 . 2]" 1
1098 2 43 ARG HA 2 44 LEU H . . 3.100 2.251 2.115 2.409 . 0 0 "[ . 1 . 2]" 1
1099 2 43 ARG QD 2 73 THR H . . 4.980 4.738 4.010 5.246 0.266 15 0 "[ . 1 . 2]" 1
1100 2 43 ARG QD 2 74 LEU HA . . 3.620 3.664 2.950 3.972 0.352 2 0 "[ . 1 . 2]" 1
1101 2 43 ARG HA 2 43 ARG QD . . 4.430 3.306 2.301 4.638 0.208 3 0 "[ . 1 . 2]" 1
1102 2 43 ARG QD 2 74 LEU H . . 4.590 2.369 1.700 4.824 0.234 4 0 "[ . 1 . 2]" 1
1103 2 43 ARG H 2 43 ARG QG . . 4.550 3.432 1.803 4.324 . 0 0 "[ . 1 . 2]" 1
1104 2 43 ARG HA 2 43 ARG QG . . 3.530 2.674 2.272 3.372 . 0 0 "[ . 1 . 2]" 1
1105 2 44 LEU HA 2 45 ASP H . . 3.100 2.188 2.098 2.257 . 0 0 "[ . 1 . 2]" 1
1106 2 44 LEU H 2 44 LEU HG . . 4.080 3.466 2.132 4.443 0.363 3 0 "[ . 1 . 2]" 1
1107 2 45 ASP HA 2 46 PHE H . . 3.100 2.179 2.091 2.280 . 0 0 "[ . 1 . 2]" 1
1108 2 45 ASP H 2 45 ASP QB . . 3.630 2.467 2.353 2.715 . 0 0 "[ . 1 . 2]" 1
1109 2 46 PHE QD 2 47 ALA H . . 4.830 3.535 2.877 4.269 . 0 0 "[ . 1 . 2]" 1
1110 2 46 PHE HB2 2 47 ALA H . . 5.440 4.535 4.416 4.700 . 0 0 "[ . 1 . 2]" 1
1111 2 46 PHE HB3 2 47 ALA H . . 5.440 4.434 4.122 4.507 . 0 0 "[ . 1 . 2]" 1
1112 2 46 PHE H 2 49 LYS H . . 3.510 2.768 2.309 3.253 . 0 0 "[ . 1 . 2]" 1
1113 2 46 PHE H 2 47 ALA H . . 4.510 3.951 3.804 4.117 . 0 0 "[ . 1 . 2]" 1
1114 2 46 PHE H 2 48 GLY H . . 4.510 3.527 3.067 3.958 . 0 0 "[ . 1 . 2]" 1
1115 2 46 PHE H 2 51 LEU MD2 . . 4.460 3.444 2.655 4.565 0.105 4 0 "[ . 1 . 2]" 1
1116 2 46 PHE H 2 51 LEU MD1 . . 4.460 4.252 2.535 4.654 0.194 14 0 "[ . 1 . 2]" 1
1117 2 46 PHE HA 2 68 LEU QD . . 4.290 3.488 2.186 4.016 . 0 0 "[ . 1 . 2]" 1
1118 2 46 PHE HA 2 47 ALA H . . 3.120 2.203 2.146 2.252 . 0 0 "[ . 1 . 2]" 1
1119 2 46 PHE HA 2 46 PHE HD1 . . 3.910 2.674 2.086 4.164 0.254 9 0 "[ . 1 . 2]" 1
1120 2 46 PHE QD 2 68 LEU HA . . 4.200 3.234 2.136 4.265 0.065 10 0 "[ . 1 . 2]" 1
1121 2 46 PHE HA 2 47 ALA HA . . 4.390 4.413 4.361 4.470 0.080 13 0 "[ . 1 . 2]" 1
1122 2 46 PHE QD 2 68 LEU QB . . 5.390 3.351 1.768 4.798 . 0 0 "[ . 1 . 2]" 1
1123 2 46 PHE HB2 2 51 LEU MD2 . . 4.340 2.101 1.782 3.244 . 0 0 "[ . 1 . 2]" 1
1124 2 46 PHE QD 2 68 LEU HG . . 4.220 2.793 1.824 4.342 0.122 3 0 "[ . 1 . 2]" 1
1125 2 46 PHE HA 2 68 LEU HG . . 4.370 3.871 2.574 4.676 0.306 13 0 "[ . 1 . 2]" 1
1126 2 46 PHE HB2 2 51 LEU MD1 . . 4.340 2.675 2.319 3.278 . 0 0 "[ . 1 . 2]" 1
1127 2 46 PHE HB3 2 51 LEU MD1 . . 4.340 2.957 2.001 4.327 . 0 0 "[ . 1 . 2]" 1
1128 2 46 PHE HB3 2 51 LEU MD2 . . 4.340 2.658 1.882 3.817 . 0 0 "[ . 1 . 2]" 1
1129 2 46 PHE HZ 2 62 ILE MG . . 3.900 3.601 2.195 4.094 0.194 20 0 "[ . 1 . 2]" 1
1130 2 46 PHE HZ 2 62 ILE MD . . 4.300 3.288 2.219 4.425 0.125 11 0 "[ . 1 . 2]" 1
1131 2 46 PHE QE 2 66 SER HB2 . . 4.450 2.987 1.795 4.163 . 0 0 "[ . 1 . 2]" 1
1132 2 46 PHE QE 2 66 SER HB3 . . 4.450 2.934 1.752 4.552 0.102 3 0 "[ . 1 . 2]" 1
1133 2 46 PHE HZ 2 62 ILE HA . . 4.500 3.154 2.074 4.675 0.175 12 0 "[ . 1 . 2]" 1
1134 2 46 PHE QD 2 68 LEU QD . . 4.560 2.658 1.714 3.161 . 0 0 "[ . 1 . 2]" 1
1135 2 46 PHE HZ 2 68 LEU QD . . 4.960 4.368 3.402 4.829 . 0 0 "[ . 1 . 2]" 1
1136 2 47 ALA HA 2 48 GLY H . . 3.140 2.943 2.819 3.041 . 0 0 "[ . 1 . 2]" 1
1137 2 47 ALA MB 2 48 GLY H . . 4.880 3.692 3.633 3.735 . 0 0 "[ . 1 . 2]" 1
1138 2 48 GLY H 2 49 LYS H . . 3.570 2.436 2.282 2.779 . 0 0 "[ . 1 . 2]" 1
1139 2 49 LYS H 2 49 LYS QD . . 4.580 4.113 2.211 4.771 0.191 18 0 "[ . 1 . 2]" 1
1140 2 49 LYS QB 2 60 TYR QD . . 4.440 3.818 2.255 4.579 0.139 3 0 "[ . 1 . 2]" 1
1141 2 49 LYS H 2 49 LYS QB . . 3.440 2.780 2.407 3.239 . 0 0 "[ . 1 . 2]" 1
1142 2 49 LYS QB 2 49 LYS QE . . 4.460 3.225 2.008 3.724 . 0 0 "[ . 1 . 2]" 1
1143 2 49 LYS QD 2 60 TYR QE . . 4.920 3.758 2.725 5.001 0.081 9 0 "[ . 1 . 2]" 1
1144 2 49 LYS QD 2 60 TYR QD . . 4.700 3.039 1.913 4.693 . 0 0 "[ . 1 . 2]" 1
1145 2 49 LYS H 2 49 LYS QG . . 4.300 3.181 2.135 4.140 . 0 0 "[ . 1 . 2]" 1
1146 2 49 LYS QG 2 60 TYR QE . . 4.170 3.427 2.091 4.284 0.114 10 0 "[ . 1 . 2]" 1
1147 2 49 LYS QG 2 50 GLN H . . 4.360 3.887 2.693 4.382 0.022 12 0 "[ . 1 . 2]" 1
1148 2 49 LYS HA 2 49 LYS QG . . 3.530 2.928 2.484 3.427 . 0 0 "[ . 1 . 2]" 1
1149 2 49 LYS QB 2 60 TYR QE . . 4.190 3.528 1.950 4.364 0.174 16 0 "[ . 1 . 2]" 1
1150 2 50 GLN QB 2 51 LEU H . . 5.080 2.980 2.421 3.749 . 0 0 "[ . 1 . 2]" 1
1151 2 50 GLN H 2 50 GLN QG . . 3.960 2.689 1.811 4.087 0.127 13 0 "[ . 1 . 2]" 1
1152 2 50 GLN H 2 50 GLN QB . . 3.650 2.564 2.274 2.970 . 0 0 "[ . 1 . 2]" 1
1153 2 50 GLN HA 2 51 LEU MD1 . . 4.870 4.359 3.005 5.078 0.208 12 0 "[ . 1 . 2]" 1
1154 2 50 GLN HA 2 51 LEU MD2 . . 4.870 3.363 2.507 5.252 0.382 4 0 "[ . 1 . 2]" 1
1155 2 51 LEU HA 2 52 GLU H . . 3.480 2.189 2.100 2.250 . 0 0 "[ . 1 . 2]" 1
1156 2 51 LEU H 2 51 LEU HG . . 3.910 3.527 2.414 4.192 0.282 10 0 "[ . 1 . 2]" 1
1157 2 51 LEU H 2 51 LEU MD1 . . 3.980 3.427 2.488 4.010 0.030 9 0 "[ . 1 . 2]" 1
1158 2 51 LEU MD1 2 52 GLU H . . 5.140 4.487 3.861 5.391 0.251 12 0 "[ . 1 . 2]" 1
1159 2 51 LEU HA 2 51 LEU MD1 . . 4.280 2.836 2.118 3.948 . 0 0 "[ . 1 . 2]" 1
1160 2 51 LEU H 2 51 LEU MD2 . . 3.980 2.576 1.851 3.991 0.011 4 0 "[ . 1 . 2]" 1
1161 2 51 LEU MD2 2 52 GLU H . . 5.140 4.653 3.800 5.301 0.161 4 0 "[ . 1 . 2]" 1
1162 2 51 LEU HA 2 51 LEU MD2 . . 4.280 2.957 2.088 3.770 . 0 0 "[ . 1 . 2]" 1
1163 2 51 LEU HA 2 60 TYR QD . . 4.560 4.437 3.828 4.674 0.114 13 0 "[ . 1 . 2]" 1
1164 2 51 LEU HB2 2 60 TYR QE . . 5.260 5.155 4.652 5.443 0.183 8 0 "[ . 1 . 2]" 1
1165 2 51 LEU HA 2 60 TYR QE . . 4.090 3.052 2.833 3.225 . 0 0 "[ . 1 . 2]" 1
1166 2 51 LEU HB3 2 60 TYR QE . . 5.260 3.820 3.060 4.499 . 0 0 "[ . 1 . 2]" 1
1167 2 52 GLU HA 2 53 ASP H . . 3.050 2.212 2.132 2.257 . 0 0 "[ . 1 . 2]" 1
1168 2 52 GLU HA 2 52 GLU HG2 . . 3.950 3.191 2.538 3.873 . 0 0 "[ . 1 . 2]" 1
1169 2 52 GLU HA 2 52 GLU HG3 . . 3.950 3.009 2.537 3.783 . 0 0 "[ . 1 . 2]" 1
1170 2 52 GLU QB 2 60 TYR QE . . 5.140 4.033 3.109 4.512 . 0 0 "[ . 1 . 2]" 1
1171 2 52 GLU QB 2 55 ARG HD3 . . 4.670 3.353 1.792 4.660 . 0 0 "[ . 1 . 2]" 1
1172 2 52 GLU H 2 52 GLU QB . . 3.480 2.387 2.210 2.523 . 0 0 "[ . 1 . 2]" 1
1173 2 52 GLU QB 2 55 ARG HD2 . . 4.670 3.147 1.913 4.227 . 0 0 "[ . 1 . 2]" 1
1174 2 52 GLU H 2 60 TYR QE . . 3.910 3.351 2.201 3.555 . 0 0 "[ . 1 . 2]" 1
1175 2 53 ASP QB 2 54 GLY QA . . 5.120 4.125 3.619 4.344 . 0 0 "[ . 1 . 2]" 1
1176 2 53 ASP H 2 53 ASP QB . . 3.770 2.428 2.192 2.584 . 0 0 "[ . 1 . 2]" 1
1177 2 54 GLY H 2 55 ARG H . . 4.140 2.739 2.555 2.910 . 0 0 "[ . 1 . 2]" 1
1178 2 55 ARG H 2 56 THR H . . 4.680 4.529 4.426 4.597 . 0 0 "[ . 1 . 2]" 1
1179 2 55 ARG HA 2 56 THR H . . 3.290 2.525 2.369 2.625 . 0 0 "[ . 1 . 2]" 1
1180 2 55 ARG HA 2 55 ARG HG2 . . 3.730 3.446 2.500 3.788 0.058 17 0 "[ . 1 . 2]" 1
1181 2 55 ARG HG2 2 56 THR H . . 5.130 3.656 1.943 5.055 . 0 0 "[ . 1 . 2]" 1
1182 2 55 ARG HG3 2 56 THR H . . 5.130 2.971 1.772 5.106 . 0 0 "[ . 1 . 2]" 1
1183 2 55 ARG HA 2 55 ARG HG3 . . 3.730 2.818 2.348 3.881 0.151 4 0 "[ . 1 . 2]" 1
1184 2 55 ARG HB2 2 60 TYR QE . . 4.430 3.067 1.773 4.366 . 0 0 "[ . 1 . 2]" 1
1185 2 55 ARG HB3 2 60 TYR QE . . 4.430 2.275 1.911 2.753 . 0 0 "[ . 1 . 2]" 1
1186 2 56 THR H 2 59 ASP H . . 4.480 3.889 3.497 4.266 . 0 0 "[ . 1 . 2]" 1
1187 2 56 THR MG 2 59 ASP H . . 4.830 3.489 2.734 4.517 . 0 0 "[ . 1 . 2]" 1
1188 2 56 THR HB 2 57 LEU H . . 3.880 3.251 2.267 3.917 0.037 8 0 "[ . 1 . 2]" 1
1189 2 56 THR H 2 60 TYR H . . 5.500 5.278 4.918 5.569 0.069 9 0 "[ . 1 . 2]" 1
1190 2 56 THR HA 2 58 SER H . . 5.000 4.333 4.108 4.496 . 0 0 "[ . 1 . 2]" 1
1191 2 56 THR HB 2 58 SER H . . 3.810 3.169 2.265 3.842 0.032 13 0 "[ . 1 . 2]" 1
1192 2 56 THR MG 2 58 SER H . . 4.820 2.782 1.744 4.207 . 0 0 "[ . 1 . 2]" 1
1193 2 56 THR H 2 57 LEU H . . 5.250 4.568 4.490 4.608 . 0 0 "[ . 1 . 2]" 1
1194 2 56 THR H 2 59 ASP HB2 . . 4.090 2.823 2.349 3.432 . 0 0 "[ . 1 . 2]" 1
1195 2 56 THR H 2 59 ASP HB3 . . 4.090 2.837 2.113 3.956 . 0 0 "[ . 1 . 2]" 1
1196 2 56 THR H 2 56 THR MG . . 3.830 3.489 2.737 3.879 0.049 13 0 "[ . 1 . 2]" 1
1197 2 56 THR MG 2 57 LEU H . . 3.870 2.712 2.135 3.614 . 0 0 "[ . 1 . 2]" 1
1198 2 56 THR HA 2 56 THR MG . . 3.260 2.377 2.296 2.526 . 0 0 "[ . 1 . 2]" 1
1199 2 56 THR H 2 60 TYR QE . . 4.460 4.078 3.306 4.559 0.099 2 0 "[ . 1 . 2]" 1
1200 2 57 LEU H 2 57 LEU HG . . 3.890 3.921 3.832 3.986 0.096 6 0 "[ . 1 . 2]" 1
1201 2 57 LEU HB2 2 58 SER H . . 4.270 2.715 2.604 2.869 . 0 0 "[ . 1 . 2]" 1
1202 2 57 LEU HA 2 60 TYR H . . 3.830 3.753 3.551 3.887 0.057 5 0 "[ . 1 . 2]" 1
1203 2 57 LEU HB3 2 62 ILE HB . . 4.850 2.581 2.262 3.113 . 0 0 "[ . 1 . 2]" 1
1204 2 57 LEU HB3 2 58 SER H . . 4.270 3.458 3.287 3.649 . 0 0 "[ . 1 . 2]" 1
1205 2 57 LEU HA 2 62 ILE HB . . 4.830 3.966 3.177 4.863 0.033 13 0 "[ . 1 . 2]" 1
1206 2 57 LEU HB2 2 62 ILE HB . . 4.850 4.290 3.990 4.776 . 0 0 "[ . 1 . 2]" 1
1207 2 24 ILE MD 2 57 LEU HA . . 4.110 2.591 2.331 2.808 . 0 0 "[ . 1 . 2]" 1
1208 2 57 LEU HA 2 62 ILE MD . . 3.860 3.159 1.786 3.797 . 0 0 "[ . 1 . 2]" 1
1209 2 57 LEU MD2 2 62 ILE MD . . 4.300 4.320 3.633 4.604 0.304 8 0 "[ . 1 . 2]" 1
1210 2 58 SER HB3 2 59 ASP H . . 4.170 3.016 2.699 3.899 . 0 0 "[ . 1 . 2]" 1
1211 2 58 SER H 2 59 ASP H . . 3.530 2.692 2.584 2.906 . 0 0 "[ . 1 . 2]" 1
1212 2 58 SER H 2 61 ASN H . . 4.820 4.860 4.723 4.954 0.134 18 0 "[ . 1 . 2]" 1
1213 2 58 SER H 2 60 TYR H . . 4.990 4.249 4.019 4.437 . 0 0 "[ . 1 . 2]" 1
1214 2 58 SER H 2 58 SER HB3 . . 3.900 2.685 2.518 3.639 . 0 0 "[ . 1 . 2]" 1
1215 2 58 SER HB2 2 59 ASP H . . 4.170 3.943 2.814 4.179 0.009 7 0 "[ . 1 . 2]" 1
1216 2 58 SER H 2 58 SER HB2 . . 3.900 2.538 2.476 2.600 . 0 0 "[ . 1 . 2]" 1
1217 2 58 SER HA 2 61 ASN H . . 4.090 3.033 2.850 3.233 . 0 0 "[ . 1 . 2]" 1
1218 2 58 SER HA 2 60 TYR H . . 3.650 3.868 3.782 3.983 0.333 20 0 "[ . 1 . 2]" 1
1219 2 58 SER HA 2 62 ILE HB . . 4.950 4.679 4.402 5.002 0.052 3 0 "[ . 1 . 2]" 1
1220 2 59 ASP H 2 60 TYR H . . 3.300 2.709 2.584 2.761 . 0 0 "[ . 1 . 2]" 1
1221 2 59 ASP H 2 59 ASP HB2 . . 3.560 2.513 2.344 2.671 . 0 0 "[ . 1 . 2]" 1
1222 2 59 ASP H 2 59 ASP HB3 . . 3.560 2.589 2.362 3.629 0.069 8 0 "[ . 1 . 2]" 1
1223 2 59 ASP HB2 2 60 TYR H . . 4.280 4.010 3.089 4.182 . 0 0 "[ . 1 . 2]" 1
1224 2 59 ASP HB3 2 60 TYR H . . 4.280 2.961 2.716 3.769 . 0 0 "[ . 1 . 2]" 1
1225 2 60 TYR HB3 2 61 ASN H . . 5.130 4.260 4.160 4.353 . 0 0 "[ . 1 . 2]" 1
1226 2 60 TYR H 2 61 ASN H . . 3.750 2.243 2.141 2.349 . 0 0 "[ . 1 . 2]" 1
1227 2 60 TYR H 2 60 TYR HB3 . . 3.630 3.683 3.644 3.716 0.086 8 0 "[ . 1 . 2]" 1
1228 2 60 TYR H 2 60 TYR HB2 . . 3.630 2.500 2.405 2.555 . 0 0 "[ . 1 . 2]" 1
1229 2 60 TYR HB2 2 62 ILE MD . . 4.520 2.415 1.802 2.939 . 0 0 "[ . 1 . 2]" 1
1230 2 60 TYR HB2 2 61 ASN H . . 5.130 3.537 3.371 3.711 . 0 0 "[ . 1 . 2]" 1
1231 2 60 TYR QD 2 62 ILE MD . . 3.720 3.379 2.613 3.837 0.117 15 0 "[ . 1 . 2]" 1
1232 2 60 TYR HB3 2 62 ILE MD . . 4.520 2.925 2.458 3.597 . 0 0 "[ . 1 . 2]" 1
1233 2 61 ASN H 2 62 ILE H . . 3.030 2.856 2.666 3.048 0.018 6 0 "[ . 1 . 2]" 1
1234 2 61 ASN H 2 61 ASN HB2 . . 3.840 3.075 2.954 3.521 . 0 0 "[ . 1 . 2]" 1
1235 2 61 ASN HA 2 62 ILE H . . 3.340 2.546 2.388 2.915 . 0 0 "[ . 1 . 2]" 1
1236 2 61 ASN H 2 61 ASN HB3 . . 3.840 3.650 3.572 3.976 0.136 6 0 "[ . 1 . 2]" 1
1237 2 61 ASN HA 2 62 ILE HB . . 5.120 4.770 4.535 5.077 . 0 0 "[ . 1 . 2]" 1
1238 2 62 ILE H 2 62 ILE HB . . 3.360 2.451 2.279 2.551 . 0 0 "[ . 1 . 2]" 1
1239 2 62 ILE H 2 62 ILE HG12 . . 4.040 2.592 1.959 4.186 0.146 20 0 "[ . 1 . 2]" 1
1240 2 62 ILE H 2 62 ILE HG13 . . 4.040 3.326 2.130 3.776 . 0 0 "[ . 1 . 2]" 1
1241 2 62 ILE HA 2 62 ILE HG13 . . 4.190 3.524 2.345 3.869 . 0 0 "[ . 1 . 2]" 1
1242 2 62 ILE HA 2 63 GLN H . . 3.190 2.173 2.066 2.296 . 0 0 "[ . 1 . 2]" 1
1243 2 62 ILE HA 2 62 ILE HG12 . . 4.190 2.946 2.292 3.642 . 0 0 "[ . 1 . 2]" 1
1244 2 62 ILE HA 2 63 GLN QG . . 4.960 4.013 3.799 5.056 0.096 4 0 "[ . 1 . 2]" 1
1245 2 57 LEU MD2 2 62 ILE MG . . 4.500 4.620 4.440 4.821 0.321 13 0 "[ . 1 . 2]" 1
1246 2 57 LEU MD1 2 62 ILE MG . . 4.500 2.104 1.849 2.431 . 0 0 "[ . 1 . 2]" 1
1247 2 57 LEU MD1 2 62 ILE MD . . 4.300 2.455 1.845 2.756 . 0 0 "[ . 1 . 2]" 1
1248 2 62 ILE MG 2 63 GLN H . . 4.030 2.971 2.422 3.196 . 0 0 "[ . 1 . 2]" 1
1249 2 62 ILE HA 2 62 ILE MG . . 3.620 2.544 2.441 2.777 . 0 0 "[ . 1 . 2]" 1
1250 2 62 ILE MG 2 63 GLN HA . . 4.020 3.951 3.577 4.109 0.089 4 0 "[ . 1 . 2]" 1
1251 2 62 ILE MG 2 66 SER QB . . 4.200 2.703 2.172 3.331 . 0 0 "[ . 1 . 2]" 1
1252 2 63 GLN HA 2 64 LYS H . . 3.070 2.340 2.255 2.490 . 0 0 "[ . 1 . 2]" 1
1253 2 63 GLN HA 2 64 LYS HA . . 4.430 4.365 4.274 4.443 0.013 15 0 "[ . 1 . 2]" 1
1254 2 63 GLN QG 2 64 LYS H . . 4.810 3.754 3.335 4.031 . 0 0 "[ . 1 . 2]" 1
1255 2 63 GLN HA 2 63 GLN QG . . 3.510 3.358 2.507 3.533 0.023 11 0 "[ . 1 . 2]" 1
1256 2 63 GLN QG 2 66 SER QB . . 4.360 2.849 1.779 4.175 . 0 0 "[ . 1 . 2]" 1
1257 2 63 GLN H 2 63 GLN QG . . 4.190 2.313 2.052 3.462 . 0 0 "[ . 1 . 2]" 1
1258 2 63 GLN QB 2 64 LYS H . . 3.380 2.583 2.183 3.192 . 0 0 "[ . 1 . 2]" 1
1259 2 64 LYS H 2 64 LYS QG . . 3.850 2.390 2.093 3.117 . 0 0 "[ . 1 . 2]" 1
1260 2 64 LYS HB2 2 65 GLU H . . 4.660 3.015 2.785 3.321 . 0 0 "[ . 1 . 2]" 1
1261 2 64 LYS HA 2 66 SER H . . 4.780 3.349 3.127 3.521 . 0 0 "[ . 1 . 2]" 1
1262 2 64 LYS HA 2 64 LYS QD . . 4.300 4.450 3.917 4.586 0.286 8 0 "[ . 1 . 2]" 1
1263 2 64 LYS QG 2 65 GLU QG . . 3.920 3.210 2.315 4.110 0.190 5 0 "[ . 1 . 2]" 1
1264 2 64 LYS HA 2 65 GLU QG . . 5.030 4.429 3.813 5.219 0.189 5 0 "[ . 1 . 2]" 1
1265 2 64 LYS HB3 2 65 GLU H . . 4.660 4.078 3.913 4.245 . 0 0 "[ . 1 . 2]" 1
1266 2 64 LYS QG 2 65 GLU HB2 . . 5.010 4.204 3.354 5.326 0.316 9 0 "[ . 1 . 2]" 1
1267 2 64 LYS QG 2 65 GLU HB3 . . 5.010 4.592 3.486 5.137 0.127 6 0 "[ . 1 . 2]" 1
1268 2 64 LYS QG 2 65 GLU H . . 4.320 3.956 3.755 4.178 . 0 0 "[ . 1 . 2]" 1
1269 2 65 GLU H 2 66 SER H . . 4.050 2.736 2.484 2.938 . 0 0 "[ . 1 . 2]" 1
1270 2 65 GLU H 2 65 GLU QG . . 4.300 3.258 2.658 3.949 . 0 0 "[ . 1 . 2]" 1
1271 2 65 GLU HA 2 65 GLU QG . . 3.390 2.929 2.486 3.560 0.170 15 0 "[ . 1 . 2]" 1
1272 2 66 SER H 2 66 SER QB . . 3.880 2.454 2.252 2.555 . 0 0 "[ . 1 . 2]" 1
1273 2 62 ILE MG 2 66 SER HB2 . . 3.950 3.056 2.253 3.973 0.023 4 0 "[ . 1 . 2]" 1
1274 2 62 ILE MG 2 66 SER HB3 . . 3.950 3.186 2.464 3.827 . 0 0 "[ . 1 . 2]" 1
1275 2 66 SER HB2 2 67 ALA H . . 4.350 3.847 3.011 4.427 0.077 16 0 "[ . 1 . 2]" 1
1276 2 66 SER HB3 2 67 ALA H . . 4.350 3.695 2.481 4.338 . 0 0 "[ . 1 . 2]" 1
1277 2 67 ALA MB 2 68 LEU H . . 4.700 3.182 2.745 3.499 . 0 0 "[ . 1 . 2]" 1
1278 2 67 ALA MB 2 68 LEU HA . . 5.390 4.274 4.082 4.486 . 0 0 "[ . 1 . 2]" 1
1279 2 68 LEU HA 2 69 ILE H . . 3.290 2.270 2.130 2.465 . 0 0 "[ . 1 . 2]" 1
1280 2 68 LEU QB 2 69 ILE H . . 4.210 3.104 2.571 4.011 . 0 0 "[ . 1 . 2]" 1
1281 2 68 LEU H 2 68 LEU HG . . 4.540 3.670 2.460 4.726 0.186 15 0 "[ . 1 . 2]" 1
1282 2 68 LEU HA 2 68 LEU HG . . 3.800 3.059 2.538 3.869 0.069 9 0 "[ . 1 . 2]" 1
1283 2 69 ILE MG 2 70 LEU H . . 5.420 4.139 3.916 4.348 . 0 0 "[ . 1 . 2]" 1
1284 2 69 ILE H 2 69 ILE MD . . 4.610 4.225 3.770 4.788 0.178 5 0 "[ . 1 . 2]" 1
1285 2 69 ILE HB 2 70 LEU H . . 4.150 3.695 2.863 4.306 0.156 14 0 "[ . 1 . 2]" 1
1286 2 69 ILE H 2 69 ILE MG . . 4.340 2.355 1.952 3.004 . 0 0 "[ . 1 . 2]" 1
1287 2 69 ILE MD 2 69 ILE MG . . 3.920 2.019 1.966 2.059 . 0 0 "[ . 1 . 2]" 1
1288 2 71 LEU H 2 72 LEU H . . 5.500 4.523 4.203 4.617 . 0 0 "[ . 1 . 2]" 1
1289 2 72 LEU HB3 2 73 THR H . . 4.890 2.891 2.205 4.055 . 0 0 "[ . 1 . 2]" 1
1290 2 72 LEU HB2 2 73 THR H . . 4.890 3.778 2.376 4.542 . 0 0 "[ . 1 . 2]" 1
1291 2 72 LEU H 2 72 LEU MD1 . . 4.670 2.952 1.996 4.155 . 0 0 "[ . 1 . 2]" 1
1292 2 72 LEU H 2 72 LEU MD2 . . 4.670 3.683 1.855 4.362 . 0 0 "[ . 1 . 2]" 1
1293 2 72 LEU HA 2 73 THR H . . 3.100 2.388 2.196 2.565 . 0 0 "[ . 1 . 2]" 1
1294 2 72 LEU HG 2 73 THR H . . 4.680 4.024 1.869 4.856 0.176 15 0 "[ . 1 . 2]" 1
1295 2 73 THR HB 2 74 LEU H . . 4.990 4.204 2.738 4.533 . 0 0 "[ . 1 . 2]" 1
1296 2 73 THR H 2 73 THR HB . . 3.990 2.631 2.428 3.897 . 0 0 "[ . 1 . 2]" 1
1297 2 73 THR HA 2 73 THR MG . . 3.620 3.149 2.375 3.287 . 0 0 "[ . 1 . 2]" 1
1298 2 73 THR HA 2 74 LEU H . . 3.010 2.221 2.091 2.487 . 0 0 "[ . 1 . 2]" 1
1299 2 74 LEU HA 2 75 ARG H . . 3.530 2.841 2.130 3.604 0.074 13 0 "[ . 1 . 2]" 1
1300 2 74 LEU HA 2 74 LEU MD2 . . 4.730 3.196 2.049 4.040 . 0 0 "[ . 1 . 2]" 1
1301 2 74 LEU HA 2 74 LEU MD1 . . 4.730 2.595 2.028 4.162 . 0 0 "[ . 1 . 2]" 1
1302 2 74 LEU MD1 2 75 ARG H . . 4.500 3.422 2.200 4.462 . 0 0 "[ . 1 . 2]" 1
1303 2 74 LEU MD2 2 75 ARG H . . 4.500 3.767 1.914 4.602 0.102 8 0 "[ . 1 . 2]" 1
1304 2 75 ARG H 2 75 ARG QG . . 4.470 3.641 2.058 4.545 0.075 19 0 "[ . 1 . 2]" 1
1305 3 3 GLU HA 3 5 ASP H . . 3.960 3.702 3.136 4.200 0.240 3 0 "[ . 1 . 2]" 1
1306 3 3 GLU QG 3 4 SER QB . . 4.440 4.155 2.481 4.662 0.222 12 0 "[ . 1 . 2]" 1
1307 3 5 ASP HA 3 6 SER H . . 3.500 2.414 2.132 3.561 0.061 15 0 "[ . 1 . 2]" 1
1308 3 8 MET HA 3 9 ALA H . . 3.570 2.540 2.074 3.578 0.008 11 0 "[ . 1 . 2]" 1
1309 3 8 MET ME 3 9 ALA H . . 4.340 3.715 2.315 4.522 0.182 17 0 "[ . 1 . 2]" 1
1310 3 9 ALA H 3 10 SER H . . 3.490 2.677 1.678 3.612 0.122 15 0 "[ . 1 . 2]" 1
1311 3 9 ALA HA 3 10 SER H . . 3.490 2.991 2.186 3.499 0.009 10 0 "[ . 1 . 2]" 1
1312 3 9 ALA MB 3 10 SER H . . 4.490 3.266 1.915 3.758 . 0 0 "[ . 1 . 2]" 1
1313 3 9 ALA HA 3 12 ALA MB . . 4.790 4.523 3.090 5.071 0.281 16 0 "[ . 1 . 2]" 1
1314 3 10 SER H 3 11 GLN H . . 3.600 2.894 1.751 3.774 0.174 15 0 "[ . 1 . 2]" 1
1315 3 10 SER QB 3 11 GLN H . . 3.900 3.235 1.905 3.923 0.023 10 0 "[ . 1 . 2]" 1
1316 3 10 SER HA 3 13 ASP QB . . 4.600 3.561 1.738 4.779 0.179 1 0 "[ . 1 . 2]" 1
1317 3 11 GLN QG 3 12 ALA H . . 4.340 3.110 1.982 4.093 . 0 0 "[ . 1 . 2]" 1
1318 3 11 GLN QB 3 12 ALA H . . 3.700 2.823 2.118 3.693 . 0 0 "[ . 1 . 2]" 1
1319 3 11 GLN H 3 12 ALA H . . 3.340 2.507 1.963 3.507 0.167 4 0 "[ . 1 . 2]" 1
1320 3 11 GLN HA 3 12 ALA H . . 3.440 3.526 3.442 3.576 0.136 7 0 "[ . 1 . 2]" 1
1321 3 11 GLN HA 3 11 GLN QG . . 3.520 2.962 2.458 3.540 0.020 5 0 "[ . 1 . 2]" 1
1322 3 11 GLN QG 3 12 ALA HA . . 4.520 3.687 3.011 4.516 . 0 0 "[ . 1 . 2]" 1
1323 3 12 ALA MB 3 13 ASP H . . 3.230 2.799 2.353 3.225 . 0 0 "[ . 1 . 2]" 1
1324 3 12 ALA HA 3 15 LYS QE . . 4.590 3.544 1.884 4.693 0.103 6 0 "[ . 1 . 2]" 1
1325 3 12 ALA HA 3 15 LYS QB . . 4.590 3.897 2.764 4.681 0.091 18 0 "[ . 1 . 2]" 1
1326 3 12 ALA H 3 13 ASP H . . 3.100 2.515 2.217 2.676 . 0 0 "[ . 1 . 2]" 1
1327 3 13 ASP H 3 14 GLN H . . 3.530 2.767 2.507 3.077 . 0 0 "[ . 1 . 2]" 1
1328 3 13 ASP HB3 3 14 GLN H . . 3.740 3.235 2.184 3.951 0.211 10 0 "[ . 1 . 2]" 1
1329 3 13 ASP HB2 3 14 GLN H . . 3.740 3.145 2.061 3.885 0.145 17 0 "[ . 1 . 2]" 1
1330 3 14 GLN H 3 14 GLN QB . . 3.670 2.459 2.192 2.700 . 0 0 "[ . 1 . 2]" 1
1331 3 14 GLN H 3 14 GLN QG . . 3.880 2.706 1.893 3.995 0.115 10 0 "[ . 1 . 2]" 1
1332 3 14 GLN QG 3 15 LYS H . . 3.900 2.636 1.837 3.955 0.055 9 0 "[ . 1 . 2]" 1
1333 3 14 GLN QB 3 15 LYS H . . 3.610 3.020 2.136 3.659 0.049 12 0 "[ . 1 . 2]" 1
1334 3 14 GLN H 3 15 LYS H . . 3.140 2.871 2.703 3.155 0.015 15 0 "[ . 1 . 2]" 1
1335 3 14 GLN HA 3 14 GLN QG . . 3.500 3.178 2.507 3.548 0.048 12 0 "[ . 1 . 2]" 1
1336 3 14 GLN QG 3 15 LYS QG . . 4.320 3.079 1.814 4.470 0.150 8 0 "[ . 1 . 2]" 1
1337 3 14 GLN QG 3 15 LYS QE . . 4.370 4.265 3.184 4.753 0.383 17 0 "[ . 1 . 2]" 1
1338 3 15 LYS H 3 15 LYS QB . . 3.750 2.553 2.401 2.835 . 0 0 "[ . 1 . 2]" 1
1339 3 15 LYS H 3 15 LYS QD . . 3.890 3.795 3.544 4.065 0.175 3 0 "[ . 1 . 2]" 1
1340 3 15 LYS H 3 15 LYS QG . . 3.400 1.947 1.793 2.099 . 0 0 "[ . 1 . 2]" 1
1341 3 15 LYS QG 3 17 GLU H . . 5.280 5.097 4.377 5.563 0.283 2 0 "[ . 1 . 2]" 1
1342 3 15 LYS HA 3 16 GLU H . . 3.570 3.551 3.522 3.579 0.009 7 0 "[ . 1 . 2]" 1
1343 3 15 LYS QB 3 16 GLU H . . 3.080 2.640 1.957 3.389 0.309 19 0 "[ . 1 . 2]" 1
1344 3 15 LYS QG 3 16 GLU H . . 3.920 3.142 1.926 3.933 0.013 6 0 "[ . 1 . 2]" 1
1345 3 15 LYS HA 3 15 LYS QG . . 3.290 2.839 2.377 3.392 0.102 18 0 "[ . 1 . 2]" 1
1346 3 15 LYS HA 3 15 LYS QE . . 4.170 4.259 3.817 4.590 0.420 4 0 "[ . 1 . 2]" 1
1347 3 15 LYS QB 3 15 LYS QE . . 3.370 2.484 1.804 3.539 0.169 2 0 "[ . 1 . 2]" 1
1348 3 15 LYS QE 3 15 LYS QG . . 3.030 2.324 2.095 2.767 . 0 0 "[ . 1 . 2]" 1
1349 3 15 LYS H 3 15 LYS QE . . 4.200 3.912 3.224 4.519 0.319 20 0 "[ . 1 . 2]" 1
1350 3 15 LYS QD 3 16 GLU H . . 4.100 4.242 3.862 4.622 0.522 15 1 "[ . 1 + 2]" 1
1351 3 15 LYS H 3 16 GLU H . . 3.500 2.694 2.451 2.873 . 0 0 "[ . 1 . 2]" 1
1352 3 16 GLU HA 3 20 LEU H . . 4.850 4.173 3.813 4.427 . 0 0 "[ . 1 . 2]" 1
1353 3 16 GLU HA 3 17 GLU H . . 3.570 3.570 3.523 3.600 0.030 19 0 "[ . 1 . 2]" 1
1354 3 16 GLU H 3 16 GLU QB . . 3.740 2.300 2.174 2.491 . 0 0 "[ . 1 . 2]" 1
1355 3 16 GLU HA 3 16 GLU QG . . 3.750 2.970 2.544 3.389 . 0 0 "[ . 1 . 2]" 1
1356 3 16 GLU QG 3 17 GLU HA . . 3.010 3.249 3.149 3.364 0.354 9 0 "[ . 1 . 2]" 1
1357 3 16 GLU QG 3 17 GLU H . . 3.740 3.092 2.163 3.467 . 0 0 "[ . 1 . 2]" 1
1358 3 16 GLU HA 3 19 LEU MD1 . . 4.580 3.238 2.183 4.574 . 0 0 "[ . 1 . 2]" 1
1359 3 16 GLU HA 3 19 LEU MD2 . . 4.580 4.240 2.729 4.978 0.398 18 0 "[ . 1 . 2]" 1
1360 3 16 GLU HA 3 19 LEU QB . . 3.380 2.780 2.098 3.319 . 0 0 "[ . 1 . 2]" 1
1361 3 17 GLU H 3 17 GLU QB . . 3.730 2.456 2.268 2.713 . 0 0 "[ . 1 . 2]" 1
1362 3 16 GLU H 3 17 GLU H . . 3.100 2.822 2.620 3.007 . 0 0 "[ . 1 . 2]" 1
1363 3 18 GLU H 3 19 LEU H . . 3.160 2.640 2.361 2.850 . 0 0 "[ . 1 . 2]" 1
1364 3 18 GLU H 3 18 GLU QG . . 3.930 3.230 2.098 4.079 0.149 19 0 "[ . 1 . 2]" 1
1365 3 18 GLU H 3 18 GLU QB . . 3.290 2.336 2.096 2.703 . 0 0 "[ . 1 . 2]" 1
1366 3 18 GLU QB 3 19 LEU H . . 3.560 2.586 2.174 3.633 0.073 6 0 "[ . 1 . 2]" 1
1367 3 18 GLU QG 3 22 PHE QE . . 4.860 3.434 2.047 4.715 . 0 0 "[ . 1 . 2]" 1
1368 3 18 GLU HA 3 18 GLU QG . . 3.660 2.753 2.087 3.434 . 0 0 "[ . 1 . 2]" 1
1369 3 18 GLU QB 3 22 PHE QE . . 4.560 3.156 2.028 4.408 . 0 0 "[ . 1 . 2]" 1
1370 3 19 LEU H 3 19 LEU HB2 . . 4.120 2.412 2.142 2.655 . 0 0 "[ . 1 . 2]" 1
1371 3 19 LEU H 3 19 LEU MD1 . . 4.330 3.328 2.328 3.890 . 0 0 "[ . 1 . 2]" 1
1372 3 19 LEU HB2 3 20 LEU H . . 4.480 2.799 2.423 3.082 . 0 0 "[ . 1 . 2]" 1
1373 3 19 LEU HB3 3 20 LEU H . . 4.480 3.574 3.001 3.927 . 0 0 "[ . 1 . 2]" 1
1374 3 19 LEU H 3 19 LEU HB3 . . 4.120 3.585 3.452 3.653 . 0 0 "[ . 1 . 2]" 1
1375 3 19 LEU H 3 19 LEU HG . . 4.410 3.037 2.128 4.379 . 0 0 "[ . 1 . 2]" 1
1376 3 19 LEU H 3 19 LEU MD2 . . 4.330 3.433 2.687 4.009 . 0 0 "[ . 1 . 2]" 1
1377 3 19 LEU MD2 3 66 TYR QE . . 3.500 2.896 2.189 3.559 0.059 14 0 "[ . 1 . 2]" 1
1378 3 19 LEU MD2 3 66 TYR QD . . 3.900 3.319 2.646 3.899 . 0 0 "[ . 1 . 2]" 1
1379 3 19 LEU MD1 3 66 TYR QE . . 3.500 3.143 2.598 3.722 0.222 8 0 "[ . 1 . 2]" 1
1380 3 19 LEU MD1 3 66 TYR QD . . 3.900 3.729 3.003 4.150 0.250 16 0 "[ . 1 . 2]" 1
1381 3 19 LEU MD1 3 55 LEU MD1 . . 3.900 3.101 1.887 4.049 0.149 7 0 "[ . 1 . 2]" 1
1382 3 19 LEU MD2 3 55 LEU MD1 . . 3.900 2.797 1.906 4.029 0.129 6 0 "[ . 1 . 2]" 1
1383 3 19 LEU MD1 3 55 LEU MD2 . . 3.900 3.127 2.063 4.057 0.157 18 0 "[ . 1 . 2]" 1
1384 3 19 LEU MD2 3 55 LEU MD2 . . 3.900 3.181 1.821 4.040 0.140 4 0 "[ . 1 . 2]" 1
1385 3 19 LEU H 3 20 LEU H . . 3.120 2.633 2.491 2.811 . 0 0 "[ . 1 . 2]" 1
1386 3 20 LEU H 3 21 LEU H . . 3.170 2.536 2.380 2.737 . 0 0 "[ . 1 . 2]" 1
1387 3 20 LEU HA 3 23 TRP H . . 4.750 3.344 3.118 3.562 . 0 0 "[ . 1 . 2]" 1
1388 3 20 LEU H 3 20 LEU HB3 . . 3.930 2.696 2.587 2.859 . 0 0 "[ . 1 . 2]" 1
1389 3 20 LEU H 3 20 LEU HB2 . . 3.930 2.370 2.283 2.460 . 0 0 "[ . 1 . 2]" 1
1390 3 20 LEU HA 3 20 LEU HG . . 4.200 3.706 2.388 3.817 . 0 0 "[ . 1 . 2]" 1
1391 3 20 LEU MD1 3 23 TRP HD1 . . 3.870 3.878 3.526 4.003 0.133 14 0 "[ . 1 . 2]" 1
1392 3 20 LEU HA 3 20 LEU MD1 . . 3.200 3.080 2.666 3.483 0.283 16 0 "[ . 1 . 2]" 1
1393 3 20 LEU HA 3 20 LEU MD2 . . 3.200 2.112 2.020 3.332 0.132 16 0 "[ . 1 . 2]" 1
1394 3 20 LEU MD2 3 23 TRP HD1 . . 3.870 2.553 2.116 3.558 . 0 0 "[ . 1 . 2]" 1
1395 3 21 LEU H 3 21 LEU HB2 . . 3.920 2.385 2.111 2.620 . 0 0 "[ . 1 . 2]" 1
1396 3 21 LEU H 3 21 LEU HB3 . . 3.920 2.723 2.407 3.274 . 0 0 "[ . 1 . 2]" 1
1397 3 21 LEU H 3 23 TRP H . . 4.840 3.930 3.722 4.101 . 0 0 "[ . 1 . 2]" 1
1398 3 21 LEU H 3 22 PHE H . . 3.140 2.621 2.445 2.790 . 0 0 "[ . 1 . 2]" 1
1399 3 21 LEU HA 3 25 TYR H . . 4.580 4.213 4.001 4.315 . 0 0 "[ . 1 . 2]" 1
1400 3 21 LEU MD1 3 25 TYR QD . . 4.500 3.905 2.092 4.830 0.330 9 0 "[ . 1 . 2]" 1
1401 3 21 LEU MD1 3 25 TYR QE . . 4.300 2.930 2.189 3.680 . 0 0 "[ . 1 . 2]" 1
1402 3 21 LEU MD2 3 25 TYR QD . . 4.500 4.179 3.003 4.721 0.221 17 0 "[ . 1 . 2]" 1
1403 3 21 LEU MD2 3 25 TYR QE . . 4.300 3.305 2.304 4.507 0.207 15 0 "[ . 1 . 2]" 1
1404 3 22 PHE H 3 23 TRP H . . 3.120 2.603 2.478 2.732 . 0 0 "[ . 1 . 2]" 1
1405 3 22 PHE HA 3 25 TYR H . . 4.780 3.398 3.203 3.583 . 0 0 "[ . 1 . 2]" 1
1406 3 22 PHE HA 3 22 PHE QE . . 4.490 4.349 4.255 4.485 . 0 0 "[ . 1 . 2]" 1
1407 3 22 PHE HA 3 22 PHE QD . . 3.500 2.146 1.895 2.612 . 0 0 "[ . 1 . 2]" 1
1408 3 22 PHE QE 3 55 LEU QB . . 4.900 3.923 3.315 4.978 0.078 14 0 "[ . 1 . 2]" 1
1409 3 22 PHE QE 3 58 ILE MG . . 4.070 3.259 2.185 4.208 0.138 10 0 "[ . 1 . 2]" 1
1410 3 22 PHE QD 3 58 ILE MD . . 4.490 3.897 3.119 4.507 0.017 14 0 "[ . 1 . 2]" 1
1411 3 22 PHE QE 3 58 ILE MD . . 3.980 3.470 2.505 4.080 0.100 16 0 "[ . 1 . 2]" 1
1412 3 22 PHE QE 3 55 LEU HG . . 5.200 3.602 2.089 5.203 0.003 12 0 "[ . 1 . 2]" 1
1413 3 22 PHE H 3 22 PHE QD . . 3.980 3.242 2.721 3.476 . 0 0 "[ . 1 . 2]" 1
1414 3 22 PHE QD 3 45 LEU MD2 . . 3.570 3.236 1.909 3.634 0.064 18 0 "[ . 1 . 2]" 1
1415 3 22 PHE QD 3 45 LEU MD1 . . 3.570 3.168 2.084 3.720 0.150 6 0 "[ . 1 . 2]" 1
1416 3 23 TRP HA 3 66 TYR QE . . 4.120 3.292 3.051 3.660 . 0 0 "[ . 1 . 2]" 1
1417 3 23 TRP H 3 66 TYR QE . . 4.520 4.304 3.951 4.565 0.045 12 0 "[ . 1 . 2]" 1
1418 3 23 TRP HE3 3 66 TYR QE . . 4.120 2.619 2.403 2.956 . 0 0 "[ . 1 . 2]" 1
1419 3 23 TRP HE3 3 66 TYR QD . . 4.520 4.221 3.880 4.691 0.171 9 0 "[ . 1 . 2]" 1
1420 3 23 TRP HZ3 3 66 TYR QE . . 4.520 4.251 3.455 4.599 0.079 15 0 "[ . 1 . 2]" 1
1421 3 23 TRP HZ3 3 66 TYR QD . . 4.820 4.924 4.817 5.138 0.318 17 0 "[ . 1 . 2]" 1
1422 3 23 TRP HE1 3 27 GLN HE22 . . 4.520 3.102 2.535 4.687 0.167 16 0 "[ . 1 . 2]" 1
1423 3 23 TRP HE1 3 27 GLN HE21 . . 4.520 3.062 2.008 4.285 . 0 0 "[ . 1 . 2]" 1
1424 3 23 TRP HA 3 26 ILE H . . 5.120 3.221 3.005 3.514 . 0 0 "[ . 1 . 2]" 1
1425 3 23 TRP H 3 25 TYR H . . 4.500 4.100 3.932 4.250 . 0 0 "[ . 1 . 2]" 1
1426 3 23 TRP HH2 3 27 GLN HA . . 5.090 4.101 3.429 4.714 . 0 0 "[ . 1 . 2]" 1
1427 3 23 TRP HA 3 27 GLN H . . 4.660 3.633 3.329 4.055 . 0 0 "[ . 1 . 2]" 1
1428 3 23 TRP HA 3 23 TRP HE3 . . 3.990 2.022 1.844 2.212 . 0 0 "[ . 1 . 2]" 1
1429 3 23 TRP HA 3 26 ILE HB . . 4.110 2.789 2.557 2.987 . 0 0 "[ . 1 . 2]" 1
1430 3 23 TRP HA 3 26 ILE MD . . 4.310 3.151 2.747 3.679 . 0 0 "[ . 1 . 2]" 1
1431 3 23 TRP HH2 3 75 GLN QG . . 4.740 2.923 2.408 4.247 . 0 0 "[ . 1 . 2]" 1
1432 3 23 TRP HZ2 3 75 GLN QG . . 3.910 2.357 1.740 3.399 . 0 0 "[ . 1 . 2]" 1
1433 3 23 TRP HH2 3 85 LEU HG . . 4.850 4.313 2.956 4.882 0.032 16 0 "[ . 1 . 2]" 1
1434 3 23 TRP HA 3 26 ILE MG . . 4.340 4.317 4.103 4.463 0.123 17 0 "[ . 1 . 2]" 1
1435 3 23 TRP HE3 3 26 ILE MG . . 4.030 3.372 3.109 3.511 . 0 0 "[ . 1 . 2]" 1
1436 3 23 TRP HZ3 3 26 ILE MG . . 3.900 2.532 2.242 2.982 . 0 0 "[ . 1 . 2]" 1
1437 3 23 TRP HE3 3 26 ILE MD . . 4.080 2.855 2.450 3.416 . 0 0 "[ . 1 . 2]" 1
1438 3 23 TRP HH2 3 26 ILE MG . . 4.580 4.158 3.693 4.636 0.056 16 0 "[ . 1 . 2]" 1
1439 3 23 TRP H 3 24 THR H . . 3.140 2.621 2.515 2.777 . 0 0 "[ . 1 . 2]" 1
1440 3 24 THR H 3 25 TYR H . . 3.180 2.632 2.470 2.741 . 0 0 "[ . 1 . 2]" 1
1441 3 24 THR H 3 24 THR HB . . 3.510 2.537 2.454 2.645 . 0 0 "[ . 1 . 2]" 1
1442 3 24 THR H 3 24 THR MG . . 3.900 3.827 3.785 3.854 . 0 0 "[ . 1 . 2]" 1
1443 3 24 THR HB 3 25 TYR H . . 4.410 2.746 2.618 2.819 . 0 0 "[ . 1 . 2]" 1
1444 3 24 THR HA 3 27 GLN HE22 . . 4.670 4.471 4.054 4.769 0.099 10 0 "[ . 1 . 2]" 1
1445 3 24 THR HA 3 27 GLN HE21 . . 4.670 3.894 2.796 4.844 0.174 12 0 "[ . 1 . 2]" 1
1446 3 24 THR MG 3 25 TYR H . . 4.020 3.570 3.375 3.746 . 0 0 "[ . 1 . 2]" 1
1447 3 24 THR HA 3 24 THR MG . . 3.230 2.504 2.411 2.582 . 0 0 "[ . 1 . 2]" 1
1448 3 25 TYR HB2 3 26 ILE H . . 4.930 2.353 2.150 2.754 . 0 0 "[ . 1 . 2]" 1
1449 3 25 TYR HB3 3 26 ILE H . . 4.930 3.220 2.691 3.479 . 0 0 "[ . 1 . 2]" 1
1450 3 25 TYR H 3 25 TYR HB3 . . 4.040 3.620 3.431 3.684 . 0 0 "[ . 1 . 2]" 1
1451 3 25 TYR H 3 25 TYR HB2 . . 4.040 2.484 2.147 2.647 . 0 0 "[ . 1 . 2]" 1
1452 3 25 TYR H 3 26 ILE H . . 3.110 2.868 2.762 2.985 . 0 0 "[ . 1 . 2]" 1
1453 3 25 TYR HA 3 25 TYR QD . . 3.870 2.240 2.059 2.368 . 0 0 "[ . 1 . 2]" 1
1454 3 25 TYR HA 3 28 ALA H . . 4.420 4.126 3.923 4.409 . 0 0 "[ . 1 . 2]" 1
1455 3 25 TYR HA 3 28 ALA MB . . 4.560 3.463 3.108 3.730 . 0 0 "[ . 1 . 2]" 1
1456 3 26 ILE HA 3 29 MET H . . 4.230 3.771 3.439 4.068 . 0 0 "[ . 1 . 2]" 1
1457 3 26 ILE H 3 27 GLN H . . 3.160 2.713 2.641 2.869 . 0 0 "[ . 1 . 2]" 1
1458 3 26 ILE H 3 26 ILE HB . . 3.890 2.664 2.547 2.848 . 0 0 "[ . 1 . 2]" 1
1459 3 26 ILE HB 3 27 GLN H . . 4.280 2.851 2.452 3.159 . 0 0 "[ . 1 . 2]" 1
1460 3 26 ILE HA 3 29 MET HB2 . . 4.960 4.303 2.891 5.181 0.221 16 0 "[ . 1 . 2]" 1
1461 3 26 ILE HA 3 29 MET ME . . 4.560 4.248 3.025 4.699 0.139 18 0 "[ . 1 . 2]" 1
1462 3 26 ILE HA 3 28 ALA H . . 4.770 4.771 4.516 4.904 0.134 19 0 "[ . 1 . 2]" 1
1463 3 26 ILE MG 3 45 LEU MD2 . . 4.550 4.379 3.700 4.580 0.030 12 0 "[ . 1 . 2]" 1
1464 3 26 ILE MG 3 45 LEU MD1 . . 4.550 4.143 3.603 4.673 0.123 16 0 "[ . 1 . 2]" 1
1465 3 26 ILE MD 3 45 LEU MD1 . . 4.050 2.023 1.650 2.242 . 0 0 "[ . 1 . 2]" 1
1466 3 26 ILE MD 3 45 LEU MD2 . . 4.050 1.963 1.751 2.428 . 0 0 "[ . 1 . 2]" 1
1467 3 26 ILE MD 3 45 LEU HA . . 4.850 5.200 5.031 5.343 0.493 2 0 "[ . 1 . 2]" 1
1468 3 26 ILE MD 3 67 LEU MD1 . . 4.050 3.457 2.317 4.000 . 0 0 "[ . 1 . 2]" 1
1469 3 26 ILE MD 3 67 LEU MD2 . . 4.050 2.928 2.296 3.914 . 0 0 "[ . 1 . 2]" 1
1470 3 26 ILE MG 3 67 LEU MD2 . . 4.350 3.420 2.501 4.323 . 0 0 "[ . 1 . 2]" 1
1471 3 26 ILE MG 3 67 LEU MD1 . . 4.350 3.728 2.518 4.568 0.218 5 0 "[ . 1 . 2]" 1
1472 3 26 ILE MG 3 41 ILE MD . . 4.050 3.405 3.053 4.016 . 0 0 "[ . 1 . 2]" 1
1473 3 26 ILE MG 3 41 ILE MG . . 5.750 2.759 1.810 4.105 . 0 0 "[ . 1 . 2]" 1
1474 3 26 ILE MD 3 41 ILE MD . . 4.050 2.563 2.050 4.252 0.202 19 0 "[ . 1 . 2]" 1
1475 3 26 ILE MD 3 41 ILE MG . . 4.050 3.744 2.730 4.258 0.208 6 0 "[ . 1 . 2]" 1
1476 3 26 ILE HA 3 29 MET HB3 . . 4.960 3.599 1.875 4.569 . 0 0 "[ . 1 . 2]" 1
1477 3 26 ILE MG 3 29 MET ME . . 4.280 4.526 4.395 4.786 0.506 4 1 "[ +. 1 . 2]" 1
1478 3 26 ILE H 3 26 ILE MG . . 4.170 3.830 3.805 3.851 . 0 0 "[ . 1 . 2]" 1
1479 3 26 ILE MG 3 27 GLN H . . 4.270 3.720 3.438 4.044 . 0 0 "[ . 1 . 2]" 1
1480 3 26 ILE HA 3 26 ILE MD . . 3.910 3.901 3.845 3.955 0.045 18 0 "[ . 1 . 2]" 1
1481 3 26 ILE HB 3 26 ILE MD . . 3.280 2.491 2.431 2.584 . 0 0 "[ . 1 . 2]" 1
1482 3 26 ILE MD 3 27 GLN H . . 5.030 4.794 4.414 5.039 0.009 15 0 "[ . 1 . 2]" 1
1483 3 27 GLN H 3 30 LEU H . . 4.970 4.630 4.493 4.726 . 0 0 "[ . 1 . 2]" 1
1484 3 27 GLN H 3 28 ALA H . . 3.100 2.652 2.502 2.824 . 0 0 "[ . 1 . 2]" 1
1485 3 27 GLN H 3 27 GLN HB2 . . 4.180 2.470 2.313 3.694 . 0 0 "[ . 1 . 2]" 1
1486 3 27 GLN HA 3 31 THR H . . 5.500 4.245 3.910 4.447 . 0 0 "[ . 1 . 2]" 1
1487 3 27 GLN HA 3 85 LEU MD1 . . 4.010 2.587 1.746 3.863 . 0 0 "[ . 1 . 2]" 1
1488 3 27 GLN HA 3 30 LEU H . . 4.280 3.721 3.182 4.077 . 0 0 "[ . 1 . 2]" 1
1489 3 27 GLN H 3 27 GLN HG2 . . 4.740 4.384 3.445 4.592 . 0 0 "[ . 1 . 2]" 1
1490 3 27 GLN HA 3 27 GLN HG2 . . 4.170 2.930 2.631 4.201 0.031 16 0 "[ . 1 . 2]" 1
1491 3 27 GLN HA 3 27 GLN HG3 . . 4.170 2.699 2.500 3.669 . 0 0 "[ . 1 . 2]" 1
1492 3 27 GLN H 3 27 GLN HG3 . . 4.740 3.993 1.944 4.490 . 0 0 "[ . 1 . 2]" 1
1493 3 27 GLN H 3 27 GLN HB3 . . 4.180 2.860 2.542 3.615 . 0 0 "[ . 1 . 2]" 1
1494 3 27 GLN HA 3 85 LEU MD2 . . 4.010 2.834 1.915 3.926 . 0 0 "[ . 1 . 2]" 1
1495 3 28 ALA H 3 29 MET H . . 3.160 2.573 2.426 2.665 . 0 0 "[ . 1 . 2]" 1
1496 3 28 ALA H 3 31 THR H . . 4.900 4.718 4.461 4.918 0.018 15 0 "[ . 1 . 2]" 1
1497 3 28 ALA HA 3 30 LEU H . . 4.900 4.663 4.327 4.921 0.021 12 0 "[ . 1 . 2]" 1
1498 3 28 ALA HA 3 31 THR HB . . 3.770 2.910 1.977 3.796 0.026 17 0 "[ . 1 . 2]" 1
1499 3 28 ALA HA 3 31 THR H . . 4.670 3.504 3.030 3.943 . 0 0 "[ . 1 . 2]" 1
1500 3 28 ALA MB 3 31 THR MG . . 4.810 3.843 3.212 4.511 . 0 0 "[ . 1 . 2]" 1
1501 3 28 ALA MB 3 29 MET H . . 3.530 2.857 2.651 3.003 . 0 0 "[ . 1 . 2]" 1
1502 3 28 ALA H 3 28 ALA MB . . 3.270 2.271 2.218 2.337 . 0 0 "[ . 1 . 2]" 1
1503 3 28 ALA MB 3 29 MET HA . . 4.970 4.065 3.952 4.187 . 0 0 "[ . 1 . 2]" 1
1504 3 29 MET HA 3 32 ASN H . . 4.570 4.116 3.701 4.575 0.005 18 0 "[ . 1 . 2]" 1
1505 3 29 MET HB2 3 30 LEU H . . 4.730 3.799 3.583 4.160 . 0 0 "[ . 1 . 2]" 1
1506 3 29 MET HB3 3 30 LEU H . . 4.730 3.371 2.180 4.088 . 0 0 "[ . 1 . 2]" 1
1507 3 29 MET H 3 30 LEU H . . 3.160 2.617 2.454 2.814 . 0 0 "[ . 1 . 2]" 1
1508 3 29 MET ME 3 44 MET ME . . 3.500 2.518 1.973 3.592 0.092 8 0 "[ . 1 . 2]" 1
1509 3 30 LEU HA 3 33 LEU H . . 4.860 3.256 2.505 3.896 . 0 0 "[ . 1 . 2]" 1
1510 3 30 LEU H 3 31 THR H . . 3.160 2.643 2.386 2.815 . 0 0 "[ . 1 . 2]" 1
1511 3 30 LEU H 3 30 LEU QB . . 3.570 2.292 2.170 2.493 . 0 0 "[ . 1 . 2]" 1
1512 3 30 LEU QB 3 31 THR H . . 3.790 3.150 2.886 3.253 . 0 0 "[ . 1 . 2]" 1
1513 3 30 LEU QB 3 32 ASN H . . 4.650 4.654 4.483 4.752 0.102 17 0 "[ . 1 . 2]" 1
1514 3 30 LEU HA 3 34 GLU QB . . 4.610 4.194 2.572 4.881 0.271 16 0 "[ . 1 . 2]" 1
1515 3 30 LEU HA 3 32 ASN H . . 4.630 3.644 3.306 3.976 . 0 0 "[ . 1 . 2]" 1
1516 3 30 LEU MD1 3 85 LEU MD1 . . 4.320 2.949 1.839 4.410 0.090 17 0 "[ . 1 . 2]" 1
1517 3 30 LEU MD1 3 85 LEU MD2 . . 4.320 3.316 2.651 4.527 0.207 5 0 "[ . 1 . 2]" 1
1518 3 30 LEU MD2 3 85 LEU MD1 . . 4.320 3.894 2.860 4.442 0.122 10 0 "[ . 1 . 2]" 1
1519 3 30 LEU MD2 3 85 LEU MD2 . . 4.320 4.230 3.115 4.608 0.288 8 0 "[ . 1 . 2]" 1
1520 3 30 LEU MD1 3 85 LEU H . . 4.620 3.274 1.927 4.757 0.137 5 0 "[ . 1 . 2]" 1
1521 3 30 LEU MD2 3 85 LEU H . . 4.620 3.011 1.970 4.724 0.104 4 0 "[ . 1 . 2]" 1
1522 3 31 THR H 3 32 ASN H . . 3.140 2.609 2.475 2.888 . 0 0 "[ . 1 . 2]" 1
1523 3 31 THR H 3 31 THR HB . . 3.690 2.458 2.154 2.631 . 0 0 "[ . 1 . 2]" 1
1524 3 31 THR HB 3 32 ASN H . . 4.030 3.578 2.793 4.198 0.168 7 0 "[ . 1 . 2]" 1
1525 3 31 THR HA 3 33 LEU H . . 5.160 5.161 4.632 5.542 0.382 3 0 "[ . 1 . 2]" 1
1526 3 31 THR H 3 31 THR MG . . 3.960 3.103 2.158 3.819 . 0 0 "[ . 1 . 2]" 1
1527 3 31 THR HA 3 31 THR MG . . 3.100 2.903 2.477 3.271 0.171 10 0 "[ . 1 . 2]" 1
1528 3 31 THR MG 3 32 ASN H . . 4.350 3.253 2.475 3.993 . 0 0 "[ . 1 . 2]" 1
1529 3 32 ASN HB3 3 33 LEU H . . 4.540 3.311 2.213 4.143 . 0 0 "[ . 1 . 2]" 1
1530 3 32 ASN H 3 34 GLU H . . 5.000 4.439 3.809 4.760 . 0 0 "[ . 1 . 2]" 1
1531 3 32 ASN HB2 3 33 LEU H . . 4.540 3.070 2.159 4.233 . 0 0 "[ . 1 . 2]" 1
1532 3 33 LEU H 3 33 LEU HB2 . . 3.890 2.759 2.357 3.782 . 0 0 "[ . 1 . 2]" 1
1533 3 33 LEU H 3 34 GLU H . . 3.410 3.449 2.704 3.773 0.363 14 0 "[ . 1 . 2]" 1
1534 3 33 LEU HG 3 34 GLU H . . 4.980 4.783 4.416 5.156 0.176 9 0 "[ . 1 . 2]" 1
1535 3 33 LEU HA 3 33 LEU HG . . 3.880 3.087 2.551 3.790 . 0 0 "[ . 1 . 2]" 1
1536 3 33 LEU HA 3 33 LEU MD2 . . 4.200 3.460 2.230 4.036 . 0 0 "[ . 1 . 2]" 1
1537 3 33 LEU H 3 33 LEU HB3 . . 3.890 3.129 2.346 3.722 . 0 0 "[ . 1 . 2]" 1
1538 3 33 LEU H 3 33 LEU MD2 . . 4.570 3.695 1.917 4.363 . 0 0 "[ . 1 . 2]" 1
1539 3 33 LEU H 3 33 LEU MD1 . . 4.570 3.525 1.973 4.342 . 0 0 "[ . 1 . 2]" 1
1540 3 33 LEU HA 3 33 LEU MD1 . . 4.200 3.333 2.248 4.202 0.002 3 0 "[ . 1 . 2]" 1
1541 3 35 SER H 3 85 LEU H . . 4.900 4.906 4.546 5.249 0.349 19 0 "[ . 1 . 2]" 1
1542 3 35 SER HA 3 36 LEU H . . 3.120 2.338 2.127 3.063 . 0 0 "[ . 1 . 2]" 1
1543 3 35 SER HA 3 84 ARG HB3 . . 4.460 2.696 2.022 4.070 . 0 0 "[ . 1 . 2]" 1
1544 3 35 SER HA 3 84 ARG HB2 . . 4.460 3.512 2.376 4.554 0.094 3 0 "[ . 1 . 2]" 1
1545 3 35 SER HA 3 84 ARG HA . . 4.580 3.667 2.076 4.670 0.090 16 0 "[ . 1 . 2]" 1
1546 3 36 LEU H 3 36 LEU MD2 . . 4.330 4.001 3.304 4.665 0.335 4 0 "[ . 1 . 2]" 1
1547 3 36 LEU H 3 83 TYR H . . 4.440 3.461 2.730 3.901 . 0 0 "[ . 1 . 2]" 1
1548 3 36 LEU H 3 82 VAL HB . . 5.340 3.908 2.277 5.499 0.159 17 0 "[ . 1 . 2]" 1
1549 3 36 LEU H 3 40 ARG QD . . 5.440 5.362 4.952 5.776 0.336 17 0 "[ . 1 . 2]" 1
1550 3 36 LEU HA 3 36 LEU MD2 . . 4.110 3.353 2.004 4.171 0.061 20 0 "[ . 1 . 2]" 1
1551 3 36 LEU MD2 3 40 ARG QD . . 4.740 3.195 1.956 4.073 . 0 0 "[ . 1 . 2]" 1
1552 3 36 LEU MD1 3 40 ARG QD . . 4.740 3.679 2.133 4.486 . 0 0 "[ . 1 . 2]" 1
1553 3 36 LEU HA 3 36 LEU MD1 . . 4.110 3.808 3.393 4.159 0.049 19 0 "[ . 1 . 2]" 1
1554 3 36 LEU H 3 36 LEU MD1 . . 4.330 3.411 2.151 4.436 0.106 19 0 "[ . 1 . 2]" 1
1555 3 37 SER H 3 38 LEU H . . 4.510 4.591 4.563 4.631 0.121 2 0 "[ . 1 . 2]" 1
1556 3 37 SER HA 3 39 ASP H . . 5.050 4.149 3.941 4.502 . 0 0 "[ . 1 . 2]" 1
1557 3 37 SER HA 3 82 VAL HB . . 4.380 3.527 2.489 4.658 0.278 2 0 "[ . 1 . 2]" 1
1558 3 37 SER HA 3 82 VAL HA . . 3.450 2.493 1.737 3.442 . 0 0 "[ . 1 . 2]" 1
1559 3 38 LEU H 3 83 TYR QD . . 4.950 3.539 3.050 4.234 . 0 0 "[ . 1 . 2]" 1
1560 3 38 LEU H 3 82 VAL HA . . 3.890 3.518 3.056 3.875 . 0 0 "[ . 1 . 2]" 1
1561 3 38 LEU HA 3 42 TYR H . . 5.200 4.005 3.669 4.181 . 0 0 "[ . 1 . 2]" 1
1562 3 38 LEU HG 3 39 ASP H . . 5.200 4.419 3.608 5.231 0.031 10 0 "[ . 1 . 2]" 1
1563 3 38 LEU H 3 39 ASP H . . 3.110 2.759 2.559 2.950 . 0 0 "[ . 1 . 2]" 1
1564 3 38 LEU HA 3 39 ASP HA . . 4.980 4.949 4.850 5.024 0.044 14 0 "[ . 1 . 2]" 1
1565 3 38 LEU HA 3 41 ILE HB . . 5.130 5.053 4.539 5.680 0.550 19 1 "[ . 1 . +2]" 1
1566 3 38 LEU HA 3 38 LEU HG . . 4.230 3.272 2.495 3.857 . 0 0 "[ . 1 . 2]" 1
1567 3 38 LEU MD1 3 83 TYR QD . . 3.920 3.434 2.508 4.203 0.283 16 0 "[ . 1 . 2]" 1
1568 3 38 LEU MD2 3 83 TYR QD . . 3.920 3.934 3.596 4.220 0.300 8 0 "[ . 1 . 2]" 1
1569 3 38 LEU MD2 3 83 TYR QE . . 3.760 2.440 1.788 3.822 0.062 8 0 "[ . 1 . 2]" 1
1570 3 38 LEU MD1 3 83 TYR QE . . 3.760 2.409 1.785 3.582 . 0 0 "[ . 1 . 2]" 1
1571 3 38 LEU MD1 3 67 LEU MD1 . . 3.960 2.843 1.786 4.275 0.315 14 0 "[ . 1 . 2]" 1
1572 3 38 LEU MD2 3 67 LEU MD2 . . 3.960 3.580 2.316 4.333 0.373 19 0 "[ . 1 . 2]" 1
1573 3 38 LEU MD2 3 67 LEU MD1 . . 3.960 3.392 2.099 4.429 0.469 11 0 "[ . 1 . 2]" 1
1574 3 38 LEU MD1 3 67 LEU MD2 . . 3.960 3.062 2.135 4.025 0.065 16 0 "[ . 1 . 2]" 1
1575 3 38 LEU HA 3 41 ILE MD . . 3.920 2.907 1.775 3.924 0.004 20 0 "[ . 1 . 2]" 1
1576 3 38 LEU HA 3 83 TYR QE . . 4.070 3.613 3.000 4.074 0.004 19 0 "[ . 1 . 2]" 1
1577 3 39 ASP H 3 39 ASP QB . . 3.000 2.463 2.212 2.639 . 0 0 "[ . 1 . 2]" 1
1578 3 39 ASP H 3 40 ARG H . . 3.180 2.862 2.678 3.121 . 0 0 "[ . 1 . 2]" 1
1579 3 39 ASP HA 3 42 TYR HB2 . . 4.210 3.755 3.052 4.305 0.095 6 0 "[ . 1 . 2]" 1
1580 3 39 ASP HA 3 42 TYR HB3 . . 4.210 2.616 2.224 3.025 . 0 0 "[ . 1 . 2]" 1
1581 3 39 ASP HA 3 42 TYR H . . 3.940 3.855 3.555 4.075 0.135 18 0 "[ . 1 . 2]" 1
1582 3 39 ASP QB 3 40 ARG H . . 3.670 2.657 2.197 3.504 . 0 0 "[ . 1 . 2]" 1
1583 3 39 ASP QB 3 40 ARG QG . . 4.880 3.698 2.975 5.199 0.319 16 0 "[ . 1 . 2]" 1
1584 3 40 ARG H 3 41 ILE H . . 3.930 2.824 2.680 3.060 . 0 0 "[ . 1 . 2]" 1
1585 3 40 ARG HA 3 40 ARG QD . . 4.260 3.986 3.043 4.281 0.021 4 0 "[ . 1 . 2]" 1
1586 3 41 ILE H 3 42 TYR H . . 4.480 2.628 2.481 2.760 . 0 0 "[ . 1 . 2]" 1
1587 3 41 ILE MD 3 42 TYR HA . . 5.190 3.112 2.674 4.675 . 0 0 "[ . 1 . 2]" 1
1588 3 41 ILE MD 3 42 TYR HB2 . . 4.320 3.537 3.033 4.501 0.181 17 0 "[ . 1 . 2]" 1
1589 3 41 ILE MD 3 42 TYR HB3 . . 4.320 4.274 3.725 4.594 0.274 9 0 "[ . 1 . 2]" 1
1590 3 41 ILE H 3 41 ILE HB . . 4.110 3.408 2.803 3.790 . 0 0 "[ . 1 . 2]" 1
1591 3 41 ILE HB 3 42 TYR H . . 4.460 4.062 3.392 4.314 . 0 0 "[ . 1 . 2]" 1
1592 3 41 ILE H 3 41 ILE MG . . 4.010 2.328 1.763 3.697 . 0 0 "[ . 1 . 2]" 1
1593 3 41 ILE HA 3 41 ILE MG . . 3.370 2.593 2.210 3.248 . 0 0 "[ . 1 . 2]" 1
1594 3 41 ILE MD 3 42 TYR H . . 4.510 2.734 2.152 3.119 . 0 0 "[ . 1 . 2]" 1
1595 3 41 ILE H 3 41 ILE MD . . 3.930 3.487 1.860 4.109 0.179 20 0 "[ . 1 . 2]" 1
1596 3 42 TYR QE 3 60 LEU H . . 4.820 3.954 3.103 4.760 . 0 0 "[ . 1 . 2]" 1
1597 3 42 TYR H 3 42 TYR QD . . 4.240 4.243 4.079 4.318 0.078 2 0 "[ . 1 . 2]" 1
1598 3 42 TYR H 3 43 ASN H . . 3.050 2.757 2.559 2.912 . 0 0 "[ . 1 . 2]" 1
1599 3 42 TYR HA 3 63 LEU HG . . 4.590 3.152 2.148 4.457 . 0 0 "[ . 1 . 2]" 1
1600 3 42 TYR QD 3 60 LEU HA . . 4.310 3.819 3.386 4.239 . 0 0 "[ . 1 . 2]" 1
1601 3 42 TYR QE 3 60 LEU HA . . 4.540 3.244 1.944 3.738 . 0 0 "[ . 1 . 2]" 1
1602 3 42 TYR QD 3 43 ASN HA . . 4.360 3.371 2.816 3.786 . 0 0 "[ . 1 . 2]" 1
1603 3 42 TYR QE 3 59 ASP HA . . 4.930 4.001 2.614 4.965 0.035 18 0 "[ . 1 . 2]" 1
1604 3 42 TYR QD 3 46 ARG QD . . 4.500 4.230 3.321 4.608 0.108 3 0 "[ . 1 . 2]" 1
1605 3 42 TYR QD 3 46 ARG QB . . 4.530 4.059 3.386 4.740 0.210 4 0 "[ . 1 . 2]" 1
1606 3 42 TYR QD 3 60 LEU MD1 . . 3.800 3.000 2.830 3.651 . 0 0 "[ . 1 . 2]" 1
1607 3 42 TYR QE 3 60 LEU MD1 . . 4.100 2.793 2.453 3.933 . 0 0 "[ . 1 . 2]" 1
1608 3 42 TYR QD 3 60 LEU MD2 . . 3.800 3.935 3.786 4.056 0.256 14 0 "[ . 1 . 2]" 1
1609 3 42 TYR HA 3 42 TYR QD . . 3.740 2.938 2.683 3.251 . 0 0 "[ . 1 . 2]" 1
1610 3 42 TYR QE 3 46 ARG QB . . 4.750 3.960 3.386 4.701 . 0 0 "[ . 1 . 2]" 1
1611 3 42 TYR QE 3 46 ARG QD . . 4.640 3.032 2.095 3.759 . 0 0 "[ . 1 . 2]" 1
1612 3 42 TYR QE 3 60 LEU MD2 . . 4.100 2.359 2.037 2.798 . 0 0 "[ . 1 . 2]" 1
1613 3 43 ASN H 3 44 MET H . . 3.170 2.735 2.635 2.953 . 0 0 "[ . 1 . 2]" 1
1614 3 43 ASN HA 3 46 ARG H . . 4.760 3.613 3.200 4.080 . 0 0 "[ . 1 . 2]" 1
1615 3 43 ASN H 3 43 ASN HB3 . . 4.090 3.347 2.618 3.672 . 0 0 "[ . 1 . 2]" 1
1616 3 43 ASN H 3 43 ASN HB2 . . 4.090 2.417 2.265 2.604 . 0 0 "[ . 1 . 2]" 1
1617 3 43 ASN HB2 3 44 MET H . . 4.610 3.103 2.471 3.928 . 0 0 "[ . 1 . 2]" 1
1618 3 43 ASN HB3 3 44 MET H . . 4.610 3.343 2.483 3.820 . 0 0 "[ . 1 . 2]" 1
1619 3 43 ASN HA 3 46 ARG QB . . 4.440 2.469 2.161 3.008 . 0 0 "[ . 1 . 2]" 1
1620 3 44 MET H 3 45 LEU H . . 3.450 2.868 2.770 2.984 . 0 0 "[ . 1 . 2]" 1
1621 3 44 MET ME 3 45 LEU H . . 4.520 4.550 3.961 4.811 0.291 11 0 "[ . 1 . 2]" 1
1622 3 44 MET QB 3 45 LEU H . . 4.220 2.330 2.066 3.454 . 0 0 "[ . 1 . 2]" 1
1623 3 44 MET QB 3 48 PHE QD . . 4.810 3.480 2.913 4.508 . 0 0 "[ . 1 . 2]" 1
1624 3 44 MET HA 3 44 MET ME . . 4.360 3.612 2.402 4.389 0.029 13 0 "[ . 1 . 2]" 1
1625 3 45 LEU H 3 46 ARG H . . 3.100 2.762 2.650 2.985 . 0 0 "[ . 1 . 2]" 1
1626 3 45 LEU HB2 3 46 ARG H . . 3.810 3.001 2.590 3.498 . 0 0 "[ . 1 . 2]" 1
1627 3 45 LEU HB3 3 46 ARG H . . 3.810 3.460 2.640 3.733 . 0 0 "[ . 1 . 2]" 1
1628 3 45 LEU MD1 3 46 ARG H . . 4.900 4.525 4.187 4.965 0.065 11 0 "[ . 1 . 2]" 1
1629 3 45 LEU MD2 3 46 ARG H . . 4.900 4.790 4.302 5.063 0.163 2 0 "[ . 1 . 2]" 1
1630 3 45 LEU HA 3 48 PHE QD . . 5.080 2.315 1.829 3.342 . 0 0 "[ . 1 . 2]" 1
1631 3 45 LEU H 3 45 LEU HG . . 4.650 3.739 2.470 4.540 . 0 0 "[ . 1 . 2]" 1
1632 3 45 LEU H 3 45 LEU MD2 . . 5.240 3.596 2.099 4.405 . 0 0 "[ . 1 . 2]" 1
1633 3 45 LEU H 3 45 LEU MD1 . . 5.240 2.947 2.158 4.134 . 0 0 "[ . 1 . 2]" 1
1634 3 45 LEU MD1 3 63 LEU MD1 . . 3.950 3.552 1.887 4.209 0.259 3 0 "[ . 1 . 2]" 1
1635 3 45 LEU MD1 3 63 LEU MD2 . . 3.950 3.313 1.861 4.070 0.120 4 0 "[ . 1 . 2]" 1
1636 3 45 LEU MD2 3 63 LEU MD1 . . 3.950 3.037 1.802 4.257 0.307 6 0 "[ . 1 . 2]" 1
1637 3 45 LEU MD2 3 63 LEU MD2 . . 3.950 2.672 1.723 4.198 0.248 1 0 "[ . 1 . 2]" 1
1638 3 46 ARG H 3 47 MET H . . 3.140 2.692 2.565 2.868 . 0 0 "[ . 1 . 2]" 1
1639 3 46 ARG H 3 46 ARG QB . . 3.190 2.290 2.227 2.398 . 0 0 "[ . 1 . 2]" 1
1640 3 46 ARG HA 3 49 VAL HB . . 4.830 3.565 2.202 4.735 . 0 0 "[ . 1 . 2]" 1
1641 3 46 ARG HA 3 46 ARG QD . . 3.760 2.399 1.927 3.951 0.191 17 0 "[ . 1 . 2]" 1
1642 3 46 ARG H 3 46 ARG QD . . 4.630 4.125 3.754 4.647 0.017 11 0 "[ . 1 . 2]" 1
1643 3 46 ARG QB 3 47 MET H . . 3.990 2.538 2.388 2.798 . 0 0 "[ . 1 . 2]" 1
1644 3 46 ARG H 3 46 ARG HG2 . . 4.590 3.786 2.447 4.666 0.076 8 0 "[ . 1 . 2]" 1
1645 3 46 ARG HG2 3 47 MET H . . 4.960 4.631 4.108 4.960 . 4 0 "[ . 1 . 2]" 1
1646 3 46 ARG HA 3 46 ARG HG2 . . 3.720 3.283 2.333 3.825 0.105 12 0 "[ . 1 . 2]" 1
1647 3 46 ARG H 3 46 ARG HG3 . . 4.590 4.156 2.804 4.541 . 0 0 "[ . 1 . 2]" 1
1648 3 46 ARG HG3 3 47 MET H . . 4.960 4.479 3.660 5.036 0.076 16 0 "[ . 1 . 2]" 1
1649 3 46 ARG HA 3 46 ARG HG3 . . 3.720 3.268 2.414 3.776 0.056 20 0 "[ . 1 . 2]" 1
1650 3 46 ARG HA 3 58 ILE MD . . 4.080 3.520 2.353 4.481 0.401 20 0 "[ . 1 . 2]" 1
1651 3 46 ARG QD 3 58 ILE MD . . 4.480 3.978 2.508 4.654 0.174 1 0 "[ . 1 . 2]" 1
1652 3 47 MET H 3 48 PHE H . . 3.160 2.862 2.767 2.989 . 0 0 "[ . 1 . 2]" 1
1653 3 47 MET QB 3 48 PHE H . . 5.420 2.706 2.282 3.532 . 0 0 "[ . 1 . 2]" 1
1654 3 47 MET H 3 47 MET QB . . 3.690 2.222 2.052 2.569 . 0 0 "[ . 1 . 2]" 1
1655 3 47 MET QG 3 48 PHE H . . 4.570 3.149 1.958 4.221 . 0 0 "[ . 1 . 2]" 1
1656 3 47 MET ME 3 48 PHE H . . 4.570 4.062 3.237 4.678 0.108 9 0 "[ . 1 . 2]" 1
1657 3 47 MET HA 3 47 MET ME . . 4.510 4.444 3.741 4.668 0.158 3 0 "[ . 1 . 2]" 1
1658 3 48 PHE HB3 3 49 VAL H . . 4.570 3.952 3.711 4.223 . 0 0 "[ . 1 . 2]" 1
1659 3 48 PHE HB2 3 49 VAL H . . 4.570 2.983 2.759 3.419 . 0 0 "[ . 1 . 2]" 1
1660 3 48 PHE H 3 49 VAL H . . 3.150 2.710 2.583 2.858 . 0 0 "[ . 1 . 2]" 1
1661 3 48 PHE QD 3 51 THR MG . . 4.700 4.367 3.865 4.879 0.179 10 0 "[ . 1 . 2]" 1
1662 3 48 PHE HA 3 48 PHE QD . . 3.950 2.331 2.138 2.674 . 0 0 "[ . 1 . 2]" 1
1663 3 49 VAL H 3 49 VAL MG2 . . 4.250 3.629 1.977 3.920 . 0 0 "[ . 1 . 2]" 1
1664 3 49 VAL H 3 49 VAL HB . . 4.120 2.612 2.197 3.726 . 0 0 "[ . 1 . 2]" 1
1665 3 49 VAL H 3 50 VAL H . . 3.120 2.528 2.372 2.762 . 0 0 "[ . 1 . 2]" 1
1666 3 49 VAL HA 3 51 THR H . . 4.280 4.405 4.336 4.490 0.210 12 0 "[ . 1 . 2]" 1
1667 3 49 VAL MG2 3 57 GLU HA . . 4.540 2.392 1.925 3.383 . 0 0 "[ . 1 . 2]" 1
1668 3 49 VAL HB 3 50 VAL H . . 4.190 3.908 3.092 4.147 . 0 0 "[ . 1 . 2]" 1
1669 3 49 VAL MG2 3 57 GLU QB . . 4.870 4.011 3.379 5.002 0.132 9 0 "[ . 1 . 2]" 1
1670 3 49 VAL H 3 49 VAL MG1 . . 4.250 2.577 2.310 3.883 . 0 0 "[ . 1 . 2]" 1
1671 3 49 VAL MG1 3 57 GLU HA . . 4.540 2.420 1.802 3.558 . 0 0 "[ . 1 . 2]" 1
1672 3 49 VAL MG1 3 57 GLU QB . . 4.870 3.494 2.577 4.959 0.089 10 0 "[ . 1 . 2]" 1
1673 3 49 VAL HA 3 54 ALA MB . . 4.790 2.516 1.708 4.959 0.169 16 0 "[ . 1 . 2]" 1
1674 3 50 VAL HB 3 51 THR H . . 4.070 4.082 4.044 4.139 0.069 17 0 "[ . 1 . 2]" 1
1675 3 50 VAL MG1 3 52 GLY H . . 4.880 4.656 4.310 5.209 0.329 20 0 "[ . 1 . 2]" 1
1676 3 50 VAL MG2 3 52 GLY H . . 4.880 4.838 4.375 5.114 0.234 19 0 "[ . 1 . 2]" 1
1677 3 50 VAL H 3 51 THR H . . 3.120 2.435 2.362 2.564 . 0 0 "[ . 1 . 2]" 1
1678 3 50 VAL H 3 50 VAL HB . . 3.520 2.960 2.570 3.720 0.200 8 0 "[ . 1 . 2]" 1
1679 3 51 THR MG 3 52 GLY H . . 4.230 4.224 4.140 4.295 0.065 3 0 "[ . 1 . 2]" 1
1680 3 51 THR HA 3 52 GLY H . . 3.480 3.433 3.403 3.482 0.002 11 0 "[ . 1 . 2]" 1
1681 3 51 THR HB 3 52 GLY HA2 . . 4.980 4.704 4.597 4.812 . 0 0 "[ . 1 . 2]" 1
1682 3 51 THR HB 3 52 GLY HA3 . . 4.980 4.842 4.643 4.953 . 0 0 "[ . 1 . 2]" 1
1683 3 51 THR H 3 52 GLY H . . 3.410 2.547 2.374 2.656 . 0 0 "[ . 1 . 2]" 1
1684 3 51 THR HB 3 52 GLY H . . 3.710 3.853 3.751 3.947 0.237 7 0 "[ . 1 . 2]" 1
1685 3 51 THR H 3 51 THR MG . . 3.890 2.605 2.465 2.695 . 0 0 "[ . 1 . 2]" 1
1686 3 52 GLY HA3 3 53 PRO HD2 . . 4.280 2.663 2.294 3.692 . 0 0 "[ . 1 . 2]" 1
1687 3 52 GLY HA2 3 53 PRO HD2 . . 4.280 2.771 2.084 3.328 . 0 0 "[ . 1 . 2]" 1
1688 3 52 GLY HA2 3 53 PRO HD3 . . 4.280 2.650 2.445 2.850 . 0 0 "[ . 1 . 2]" 1
1689 3 52 GLY HA3 3 53 PRO HD3 . . 4.280 3.405 2.796 4.232 . 0 0 "[ . 1 . 2]" 1
1690 3 52 GLY HA2 3 53 PRO HA . . 4.920 4.553 4.455 4.643 . 0 0 "[ . 1 . 2]" 1
1691 3 52 GLY HA3 3 53 PRO HA . . 4.920 4.755 4.665 4.957 0.037 7 0 "[ . 1 . 2]" 1
1692 3 52 GLY HA2 3 54 ALA H . . 4.820 4.086 3.596 4.543 . 0 0 "[ . 1 . 2]" 1
1693 3 52 GLY HA3 3 54 ALA H . . 4.820 3.161 2.771 3.598 . 0 0 "[ . 1 . 2]" 1
1694 3 52 GLY H 3 54 ALA H . . 4.500 4.333 3.655 4.866 0.366 7 0 "[ . 1 . 2]" 1
1695 3 53 PRO QG 3 54 ALA H . . 3.450 3.073 2.279 3.573 0.123 4 0 "[ . 1 . 2]" 1
1696 3 53 PRO HA 3 54 ALA MB . . 4.950 4.641 4.346 4.867 . 0 0 "[ . 1 . 2]" 1
1697 3 53 PRO HA 3 54 ALA H . . 3.380 3.311 3.093 3.503 0.123 20 0 "[ . 1 . 2]" 1
1698 3 53 PRO HB2 3 54 ALA H . . 4.600 3.848 3.087 4.282 . 0 0 "[ . 1 . 2]" 1
1699 3 53 PRO HB3 3 54 ALA H . . 4.600 4.393 4.013 4.631 0.031 16 0 "[ . 1 . 2]" 1
1700 3 54 ALA H 3 55 LEU H . . 4.190 4.048 2.891 4.363 0.173 6 0 "[ . 1 . 2]" 1
1701 3 54 ALA H 3 54 ALA MB . . 3.500 2.344 2.184 2.689 . 0 0 "[ . 1 . 2]" 1
1702 3 54 ALA MB 3 55 LEU H . . 3.740 2.783 1.882 3.551 . 0 0 "[ . 1 . 2]" 1
1703 3 55 LEU H 3 56 ALA H . . 3.100 2.533 1.919 3.033 . 0 0 "[ . 1 . 2]" 1
1704 3 55 LEU H 3 55 LEU QB . . 3.520 2.990 2.273 3.407 . 0 0 "[ . 1 . 2]" 1
1705 3 55 LEU HA 3 56 ALA H . . 3.510 3.086 2.696 3.408 . 0 0 "[ . 1 . 2]" 1
1706 3 55 LEU QB 3 56 ALA H . . 4.060 3.681 3.201 4.061 0.001 4 0 "[ . 1 . 2]" 1
1707 3 55 LEU HA 3 55 LEU HG . . 3.780 3.069 2.498 3.820 0.040 4 0 "[ . 1 . 2]" 1
1708 3 55 LEU H 3 55 LEU HG . . 4.370 3.193 2.628 4.501 0.131 7 0 "[ . 1 . 2]" 1
1709 3 55 LEU H 3 55 LEU MD1 . . 4.570 3.952 2.277 4.721 0.151 4 0 "[ . 1 . 2]" 1
1710 3 55 LEU H 3 55 LEU MD2 . . 4.570 3.626 2.401 4.602 0.032 11 0 "[ . 1 . 2]" 1
1711 3 56 ALA H 3 57 GLU H . . 3.900 3.115 2.680 4.026 0.126 7 0 "[ . 1 . 2]" 1
1712 3 56 ALA MB 3 57 GLU H . . 3.730 3.244 2.063 3.734 0.004 10 0 "[ . 1 . 2]" 1
1713 3 57 GLU QG 3 58 ILE H . . 4.370 4.091 2.639 4.450 0.080 17 0 "[ . 1 . 2]" 1
1714 3 57 GLU H 3 58 ILE H . . 3.670 3.792 3.691 3.974 0.304 4 0 "[ . 1 . 2]" 1
1715 3 57 GLU H 3 57 GLU QG . . 3.600 3.201 2.462 4.127 0.527 8 1 "[ . + 1 . 2]" 1
1716 3 57 GLU H 3 57 GLU QB . . 3.620 3.281 2.648 3.464 . 0 0 "[ . 1 . 2]" 1
1717 3 57 GLU HA 3 58 ILE MG . . 4.380 3.977 3.666 4.191 . 0 0 "[ . 1 . 2]" 1
1718 3 57 GLU HA 3 58 ILE H . . 3.240 2.155 2.083 2.246 . 0 0 "[ . 1 . 2]" 1
1719 3 57 GLU HA 3 57 GLU QG . . 3.360 2.690 2.349 3.555 0.195 7 0 "[ . 1 . 2]" 1
1720 3 58 ILE H 3 58 ILE HG13 . . 4.360 3.246 2.895 4.271 . 0 0 "[ . 1 . 2]" 1
1721 3 58 ILE H 3 59 ASP H . . 4.440 4.558 4.483 4.605 0.165 16 0 "[ . 1 . 2]" 1
1722 3 58 ILE H 3 58 ILE HG12 . . 4.360 2.145 1.794 4.511 0.151 20 0 "[ . 1 . 2]" 1
1723 3 58 ILE HA 3 59 ASP H . . 3.020 2.396 2.187 2.681 . 0 0 "[ . 1 . 2]" 1
1724 3 58 ILE HA 3 58 ILE HG13 . . 4.010 3.746 2.384 3.915 . 0 0 "[ . 1 . 2]" 1
1725 3 58 ILE H 3 58 ILE HB . . 3.690 3.599 2.316 3.735 0.045 9 0 "[ . 1 . 2]" 1
1726 3 58 ILE HB 3 59 ASP H . . 4.570 2.442 1.891 4.291 . 0 0 "[ . 1 . 2]" 1
1727 3 58 ILE HG12 3 59 ASP H . . 4.760 4.526 2.905 4.791 0.031 19 0 "[ . 1 . 2]" 1
1728 3 58 ILE HA 3 58 ILE HG12 . . 4.010 3.722 2.998 3.838 . 0 0 "[ . 1 . 2]" 1
1729 3 58 ILE HG13 3 59 ASP H . . 4.760 3.634 3.154 3.922 . 0 0 "[ . 1 . 2]" 1
1730 3 58 ILE H 3 58 ILE MG . . 3.660 2.449 2.168 2.955 . 0 0 "[ . 1 . 2]" 1
1731 3 58 ILE HA 3 58 ILE MG . . 3.410 2.409 2.284 3.277 . 0 0 "[ . 1 . 2]" 1
1732 3 58 ILE MD 3 58 ILE MG . . 3.420 2.016 1.854 2.052 . 0 0 "[ . 1 . 2]" 1
1733 3 58 ILE MG 3 59 ASP H . . 3.960 3.621 3.381 3.779 . 0 0 "[ . 1 . 2]" 1
1734 3 58 ILE HA 3 58 ILE MD . . 4.210 4.230 3.751 4.274 0.064 14 0 "[ . 1 . 2]" 1
1735 3 58 ILE MD 3 59 ASP H . . 4.300 4.324 3.919 4.540 0.240 5 0 "[ . 1 . 2]" 1
1736 3 58 ILE H 3 58 ILE MD . . 3.890 3.639 3.317 4.264 0.374 20 0 "[ . 1 . 2]" 1
1737 3 58 ILE HB 3 58 ILE MD . . 3.430 2.516 2.397 2.635 . 0 0 "[ . 1 . 2]" 1
1738 3 59 ASP HA 3 61 GLN H . . 4.810 4.615 4.422 4.865 0.055 13 0 "[ . 1 . 2]" 1
1739 3 59 ASP H 3 60 LEU H . . 4.530 4.459 4.369 4.537 0.007 18 0 "[ . 1 . 2]" 1
1740 3 59 ASP QB 3 61 GLN H . . 4.600 3.232 2.741 3.735 . 0 0 "[ . 1 . 2]" 1
1741 3 60 LEU HB2 3 62 GLU H . . 5.740 5.174 4.849 5.518 . 0 0 "[ . 1 . 2]" 1
1742 3 60 LEU HA 3 62 GLU H . . 5.430 4.381 4.170 5.070 . 0 0 "[ . 1 . 2]" 1
1743 3 60 LEU HB3 3 62 GLU H . . 5.740 5.406 4.763 5.752 0.012 20 0 "[ . 1 . 2]" 1
1744 3 60 LEU HA 3 64 GLN H . . 4.580 3.509 2.961 3.823 . 0 0 "[ . 1 . 2]" 1
1745 3 60 LEU HB3 3 61 GLN H . . 3.930 3.378 2.363 3.771 . 0 0 "[ . 1 . 2]" 1
1746 3 60 LEU H 3 61 GLN H . . 3.130 2.867 2.689 3.108 . 0 0 "[ . 1 . 2]" 1
1747 3 60 LEU HA 3 63 LEU H . . 4.820 3.545 3.147 4.064 . 0 0 "[ . 1 . 2]" 1
1748 3 60 LEU HA 3 60 LEU HG . . 3.970 3.754 3.720 3.797 . 0 0 "[ . 1 . 2]" 1
1749 3 60 LEU H 3 60 LEU HB2 . . 3.630 2.343 2.100 2.453 . 0 0 "[ . 1 . 2]" 1
1750 3 60 LEU HB2 3 61 GLN H . . 3.930 2.814 2.552 3.117 . 0 0 "[ . 1 . 2]" 1
1751 3 60 LEU H 3 60 LEU HB3 . . 3.630 3.570 3.240 3.625 . 0 0 "[ . 1 . 2]" 1
1752 3 60 LEU H 3 60 LEU HG . . 4.380 3.996 3.864 4.471 0.091 1 0 "[ . 1 . 2]" 1
1753 3 60 LEU HA 3 60 LEU MD1 . . 3.940 2.072 1.972 2.153 . 0 0 "[ . 1 . 2]" 1
1754 3 60 LEU HA 3 60 LEU MD2 . . 3.940 2.688 2.363 2.927 . 0 0 "[ . 1 . 2]" 1
1755 3 61 GLN H 3 62 GLU H . . 3.120 2.686 2.513 2.900 . 0 0 "[ . 1 . 2]" 1
1756 3 61 GLN QG 3 62 GLU H . . 3.540 2.796 1.930 3.719 0.179 20 0 "[ . 1 . 2]" 1
1757 3 61 GLN H 3 63 LEU H . . 4.540 4.195 3.962 4.458 . 0 0 "[ . 1 . 2]" 1
1758 3 61 GLN H 3 61 GLN QG . . 3.520 2.086 1.884 3.825 0.305 9 0 "[ . 1 . 2]" 1
1759 3 61 GLN HA 3 61 GLN QG . . 3.290 3.315 2.392 3.492 0.202 11 0 "[ . 1 . 2]" 1
1760 3 61 GLN H 3 61 GLN HB2 . . 3.900 3.481 2.196 3.680 . 0 0 "[ . 1 . 2]" 1
1761 3 61 GLN H 3 61 GLN HB3 . . 3.900 2.851 2.534 3.648 . 0 0 "[ . 1 . 2]" 1
1762 3 61 GLN HA 3 63 LEU H . . 5.200 4.552 4.193 4.890 . 0 0 "[ . 1 . 2]" 1
1763 3 61 GLN HA 3 64 GLN H . . 4.800 4.024 3.308 4.741 . 0 0 "[ . 1 . 2]" 1
1764 3 61 GLN HA 3 65 GLY H . . 4.700 3.617 3.231 4.232 . 0 0 "[ . 1 . 2]" 1
1765 3 62 GLU H 3 62 GLU HB2 . . 3.750 2.470 2.199 2.654 . 0 0 "[ . 1 . 2]" 1
1766 3 62 GLU H 3 62 GLU HB3 . . 3.750 3.198 2.431 3.641 . 0 0 "[ . 1 . 2]" 1
1767 3 63 LEU H 3 63 LEU HB3 . . 3.800 2.829 2.303 3.083 . 0 0 "[ . 1 . 2]" 1
1768 3 62 GLU H 3 63 LEU H . . 3.450 2.531 2.304 2.830 . 0 0 "[ . 1 . 2]" 1
1769 3 63 LEU H 3 64 GLN H . . 3.200 2.724 2.514 3.007 . 0 0 "[ . 1 . 2]" 1
1770 3 63 LEU MD2 3 64 GLN H . . 4.580 4.367 3.225 4.672 0.092 9 0 "[ . 1 . 2]" 1
1771 3 63 LEU HA 3 66 TYR QD . . 4.480 4.580 4.333 4.734 0.254 5 0 "[ . 1 . 2]" 1
1772 3 63 LEU HA 3 66 TYR H . . 4.480 3.455 2.946 3.813 . 0 0 "[ . 1 . 2]" 1
1773 3 63 LEU HA 3 67 LEU H . . 4.980 4.280 4.086 4.369 . 0 0 "[ . 1 . 2]" 1
1774 3 63 LEU HA 3 63 LEU MD1 . . 4.490 2.803 2.230 3.848 . 0 0 "[ . 1 . 2]" 1
1775 3 63 LEU H 3 63 LEU HB2 . . 3.800 2.207 2.042 2.661 . 0 0 "[ . 1 . 2]" 1
1776 3 63 LEU H 3 63 LEU MD2 . . 4.230 3.830 3.404 4.375 0.145 1 0 "[ . 1 . 2]" 1
1777 3 63 LEU HA 3 63 LEU MD2 . . 4.490 2.376 1.931 3.910 . 0 0 "[ . 1 . 2]" 1
1778 3 63 LEU H 3 63 LEU MD1 . . 4.230 4.285 4.121 4.383 0.153 3 0 "[ . 1 . 2]" 1
1779 3 63 LEU MD1 3 64 GLN H . . 4.580 3.877 3.346 4.606 0.026 4 0 "[ . 1 . 2]" 1
1780 3 64 GLN HA 3 67 LEU HB2 . . 4.500 2.789 2.460 4.145 . 0 0 "[ . 1 . 2]" 1
1781 3 64 GLN HA 3 67 LEU HB3 . . 4.500 4.258 3.432 4.507 0.007 1 0 "[ . 1 . 2]" 1
1782 3 64 GLN H 3 64 GLN HG2 . . 4.560 4.038 1.976 4.421 . 0 0 "[ . 1 . 2]" 1
1783 3 64 GLN HG2 3 65 GLY H . . 4.230 3.242 2.483 3.950 . 0 0 "[ . 1 . 2]" 1
1784 3 64 GLN H 3 65 GLY H . . 3.130 2.786 2.606 2.970 . 0 0 "[ . 1 . 2]" 1
1785 3 64 GLN H 3 64 GLN HG3 . . 4.560 4.391 3.512 4.591 0.031 10 0 "[ . 1 . 2]" 1
1786 3 64 GLN HG3 3 65 GLY H . . 4.230 4.264 2.975 4.554 0.324 3 0 "[ . 1 . 2]" 1
1787 3 64 GLN H 3 64 GLN HB2 . . 4.180 2.772 2.562 3.640 . 0 0 "[ . 1 . 2]" 1
1788 3 64 GLN H 3 64 GLN HB3 . . 4.180 2.412 2.209 3.601 . 0 0 "[ . 1 . 2]" 1
1789 3 64 GLN HA 3 68 GLN QB . . 4.520 4.521 4.024 4.722 0.202 7 0 "[ . 1 . 2]" 1
1790 3 64 GLN HA 3 68 GLN H . . 4.920 3.942 3.747 4.124 . 0 0 "[ . 1 . 2]" 1
1791 3 64 GLN HA 3 67 LEU H . . 4.520 3.564 3.363 3.799 . 0 0 "[ . 1 . 2]" 1
1792 3 65 GLY H 3 66 TYR H . . 3.130 2.795 2.602 2.996 . 0 0 "[ . 1 . 2]" 1
1793 3 66 TYR HA 3 69 LYS H . . 3.870 3.763 3.522 3.971 0.101 11 0 "[ . 1 . 2]" 1
1794 3 66 TYR HB2 3 67 LEU H . . 4.060 3.558 3.400 3.667 . 0 0 "[ . 1 . 2]" 1
1795 3 66 TYR HB3 3 67 LEU H . . 4.060 2.358 2.228 2.540 . 0 0 "[ . 1 . 2]" 1
1796 3 66 TYR HA 3 66 TYR QD . . 3.910 2.982 2.761 3.165 . 0 0 "[ . 1 . 2]" 1
1797 3 66 TYR QD 3 67 LEU H . . 4.040 3.719 3.114 4.099 0.059 7 0 "[ . 1 . 2]" 1
1798 3 66 TYR H 3 66 TYR QD . . 4.300 4.120 3.959 4.236 . 0 0 "[ . 1 . 2]" 1
1799 3 66 TYR H 3 67 LEU H . . 3.140 2.720 2.575 2.857 . 0 0 "[ . 1 . 2]" 1
1800 3 67 LEU H 3 69 LYS H . . 5.040 4.202 3.890 4.541 . 0 0 "[ . 1 . 2]" 1
1801 3 67 LEU H 3 68 GLN H . . 3.120 2.687 2.551 2.775 . 0 0 "[ . 1 . 2]" 1
1802 3 67 LEU HB3 3 68 GLN H . . 4.480 3.389 2.784 3.738 . 0 0 "[ . 1 . 2]" 1
1803 3 67 LEU MD2 3 68 GLN H . . 5.730 4.446 3.814 5.058 . 0 0 "[ . 1 . 2]" 1
1804 3 67 LEU HA 3 70 LYS H . . 4.860 3.447 3.225 3.619 . 0 0 "[ . 1 . 2]" 1
1805 3 67 LEU HB2 3 68 GLN H . . 4.480 2.713 2.468 3.748 . 0 0 "[ . 1 . 2]" 1
1806 3 67 LEU H 3 67 LEU HG . . 4.710 3.343 2.305 4.345 . 0 0 "[ . 1 . 2]" 1
1807 3 67 LEU H 3 67 LEU MD2 . . 4.450 3.021 2.110 4.322 . 0 0 "[ . 1 . 2]" 1
1808 3 67 LEU MD2 3 83 TYR QE . . 3.550 3.594 2.941 3.909 0.359 20 0 "[ . 1 . 2]" 1
1809 3 67 LEU MD1 3 83 TYR QE . . 3.550 3.091 2.458 3.644 0.094 17 0 "[ . 1 . 2]" 1
1810 3 67 LEU MD1 3 83 TYR QD . . 3.950 3.240 2.741 4.054 0.104 4 0 "[ . 1 . 2]" 1
1811 3 67 LEU MD2 3 83 TYR QD . . 3.950 3.617 2.820 4.307 0.357 11 0 "[ . 1 . 2]" 1
1812 3 67 LEU H 3 67 LEU MD1 . . 4.450 3.552 2.940 4.175 . 0 0 "[ . 1 . 2]" 1
1813 3 67 LEU MD1 3 68 GLN H . . 5.730 4.569 4.274 4.904 . 0 0 "[ . 1 . 2]" 1
1814 3 68 GLN HA 3 72 ARG H . . 4.100 4.061 3.771 4.244 0.144 8 0 "[ . 1 . 2]" 1
1815 3 68 GLN QB 3 69 LYS H . . 3.570 2.767 2.290 3.647 0.077 13 0 "[ . 1 . 2]" 1
1816 3 68 GLN H 3 69 LYS H . . 3.100 2.697 2.534 2.885 . 0 0 "[ . 1 . 2]" 1
1817 3 68 GLN H 3 68 GLN QB . . 3.730 2.311 2.156 2.565 . 0 0 "[ . 1 . 2]" 1
1818 3 68 GLN H 3 70 LYS H . . 5.170 4.269 3.989 4.507 . 0 0 "[ . 1 . 2]" 1
1819 3 68 GLN HE22 3 69 LYS QD . . 5.500 5.258 3.960 5.635 0.135 13 0 "[ . 1 . 2]" 1
1820 3 68 GLN HA 3 71 VAL H . . 3.910 3.478 2.936 3.789 . 0 0 "[ . 1 . 2]" 1
1821 3 68 GLN HA 3 71 VAL MG1 . . 4.090 4.100 3.813 4.259 0.169 15 0 "[ . 1 . 2]" 1
1822 3 68 GLN HA 3 72 ARG QD . . 4.420 4.277 3.284 4.585 0.165 19 0 "[ . 1 . 2]" 1
1823 3 68 GLN HA 3 68 GLN QG . . 3.780 2.910 2.563 3.579 . 0 0 "[ . 1 . 2]" 1
1824 3 68 GLN QG 3 69 LYS H . . 3.580 3.279 2.336 3.851 0.271 1 0 "[ . 1 . 2]" 1
1825 3 68 GLN HA 3 71 VAL HB . . 3.810 2.758 2.424 2.964 . 0 0 "[ . 1 . 2]" 1
1826 3 68 GLN HE21 3 69 LYS QD . . 5.500 4.750 4.254 5.656 0.156 7 0 "[ . 1 . 2]" 1
1827 3 68 GLN HA 3 71 VAL MG2 . . 4.090 3.102 2.209 3.663 . 0 0 "[ . 1 . 2]" 1
1828 3 69 LYS H 3 70 LYS H . . 3.190 2.864 2.753 3.002 . 0 0 "[ . 1 . 2]" 1
1829 3 69 LYS H 3 69 LYS HB2 . . 3.970 2.427 2.102 2.727 . 0 0 "[ . 1 . 2]" 1
1830 3 69 LYS QD 3 73 ASP H . . 4.420 4.098 3.178 4.465 0.045 18 0 "[ . 1 . 2]" 1
1831 3 69 LYS HA 3 72 ARG H . . 4.070 3.566 3.242 3.865 . 0 0 "[ . 1 . 2]" 1
1832 3 69 LYS HA 3 69 LYS QE . . 4.250 3.773 2.205 4.277 0.027 14 0 "[ . 1 . 2]" 1
1833 3 69 LYS HA 3 72 ARG QD . . 4.500 3.782 3.035 4.685 0.185 8 0 "[ . 1 . 2]" 1
1834 3 69 LYS QD 3 73 ASP HA . . 4.630 4.702 4.418 4.830 0.200 6 0 "[ . 1 . 2]" 1
1835 3 69 LYS QE 3 73 ASP HA . . 4.070 3.899 3.338 4.268 0.198 18 0 "[ . 1 . 2]" 1
1836 3 69 LYS QE 3 73 ASP H . . 4.080 4.187 3.544 4.418 0.338 14 0 "[ . 1 . 2]" 1
1837 3 69 LYS H 3 69 LYS HB3 . . 3.970 2.800 2.353 3.303 . 0 0 "[ . 1 . 2]" 1
1838 3 69 LYS HA 3 72 ARG QB . . 4.250 2.792 2.355 3.154 . 0 0 "[ . 1 . 2]" 1
1839 3 69 LYS HA 3 73 ASP H . . 5.290 4.237 3.990 4.347 . 0 0 "[ . 1 . 2]" 1
1840 3 69 LYS H 3 69 LYS QD . . 4.320 4.386 4.220 4.662 0.342 3 0 "[ . 1 . 2]" 1
1841 3 69 LYS HA 3 69 LYS HG2 . . 3.790 3.095 2.474 3.950 0.160 8 0 "[ . 1 . 2]" 1
1842 3 69 LYS QE 3 69 LYS HG2 . . 3.720 2.968 2.394 3.567 . 0 0 "[ . 1 . 2]" 1
1843 3 69 LYS QE 3 69 LYS HG3 . . 3.720 2.717 2.302 3.603 . 0 0 "[ . 1 . 2]" 1
1844 3 69 LYS HA 3 69 LYS HG3 . . 3.790 3.555 3.251 3.779 . 0 0 "[ . 1 . 2]" 1
1845 3 70 LYS H 3 72 ARG H . . 4.750 4.393 4.215 4.544 . 0 0 "[ . 1 . 2]" 1
1846 3 70 LYS H 3 71 VAL H . . 3.410 2.915 2.818 3.078 . 0 0 "[ . 1 . 2]" 1
1847 3 70 LYS H 3 70 LYS HG3 . . 4.370 3.779 3.616 4.454 0.084 15 0 "[ . 1 . 2]" 1
1848 3 70 LYS HA 3 75 GLN H . . 5.090 3.761 3.525 4.313 . 0 0 "[ . 1 . 2]" 1
1849 3 70 LYS HA 3 72 ARG H . . 4.860 4.586 4.413 4.732 . 0 0 "[ . 1 . 2]" 1
1850 3 70 LYS HA 3 73 ASP H . . 4.340 3.401 3.228 3.642 . 0 0 "[ . 1 . 2]" 1
1851 3 70 LYS H 3 70 LYS HE2 . . 5.000 4.388 4.122 4.961 . 0 0 "[ . 1 . 2]" 1
1852 3 70 LYS H 3 70 LYS HE3 . . 5.000 5.124 4.947 5.195 0.195 1 0 "[ . 1 . 2]" 1
1853 3 70 LYS HA 3 73 ASP HB2 . . 4.040 3.224 2.733 4.091 0.051 5 0 "[ . 1 . 2]" 1
1854 3 70 LYS HA 3 73 ASP HB3 . . 4.040 2.350 2.108 2.772 . 0 0 "[ . 1 . 2]" 1
1855 3 70 LYS HA 3 70 LYS HD2 . . 4.050 2.906 2.003 3.516 . 0 0 "[ . 1 . 2]" 1
1856 3 70 LYS HA 3 70 LYS HD3 . . 4.050 2.171 1.955 3.060 . 0 0 "[ . 1 . 2]" 1
1857 3 70 LYS H 3 70 LYS HG2 . . 4.370 2.485 2.151 4.421 0.051 15 0 "[ . 1 . 2]" 1
1858 3 71 VAL HB 3 72 ARG H . . 3.550 2.640 2.436 2.859 . 0 0 "[ . 1 . 2]" 1
1859 3 71 VAL H 3 72 ARG H . . 3.550 2.659 2.570 2.820 . 0 0 "[ . 1 . 2]" 1
1860 3 71 VAL H 3 71 VAL HB . . 3.230 2.511 2.406 2.646 . 0 0 "[ . 1 . 2]" 1
1861 3 71 VAL HA 3 76 LEU H . . 3.660 2.863 2.696 3.154 . 0 0 "[ . 1 . 2]" 1
1862 3 71 VAL HA 3 71 VAL MG1 . . 3.510 2.530 2.442 2.601 . 0 0 "[ . 1 . 2]" 1
1863 3 71 VAL HA 3 76 LEU QB . . 4.850 2.787 2.271 3.394 . 0 0 "[ . 1 . 2]" 1
1864 3 71 VAL MG2 3 78 TYR HB2 . . 5.970 2.415 1.905 3.116 . 0 0 "[ . 1 . 2]" 1
1865 3 71 VAL MG1 3 78 TYR HB2 . . 5.970 2.867 2.328 3.656 . 0 0 "[ . 1 . 2]" 1
1866 3 71 VAL HA 3 71 VAL MG2 . . 3.510 2.408 2.351 2.478 . 0 0 "[ . 1 . 2]" 1
1867 3 72 ARG H 3 73 ASP H . . 3.180 2.552 2.501 2.620 . 0 0 "[ . 1 . 2]" 1
1868 3 72 ARG QB 3 73 ASP H . . 3.200 3.149 2.612 3.287 0.087 2 0 "[ . 1 . 2]" 1
1869 3 72 ARG QB 3 74 GLN H . . 4.850 4.575 4.394 4.737 . 0 0 "[ . 1 . 2]" 1
1870 3 72 ARG HA 3 72 ARG QD . . 3.980 3.641 2.278 4.239 0.259 10 0 "[ . 1 . 2]" 1
1871 3 72 ARG H 3 72 ARG QD . . 3.970 3.442 2.281 3.934 . 0 0 "[ . 1 . 2]" 1
1872 3 72 ARG H 3 72 ARG QB . . 3.910 2.395 2.211 2.659 . 0 0 "[ . 1 . 2]" 1
1873 3 72 ARG QB 3 72 ARG QD . . 3.490 2.374 2.164 3.007 . 0 0 "[ . 1 . 2]" 1
1874 3 72 ARG HA 3 72 ARG HG2 . . 3.890 2.898 2.535 3.767 . 0 0 "[ . 1 . 2]" 1
1875 3 72 ARG HA 3 72 ARG HG3 . . 3.890 3.039 2.469 3.825 . 0 0 "[ . 1 . 2]" 1
1876 3 73 ASP H 3 73 ASP HB2 . . 3.750 2.612 2.468 2.734 . 0 0 "[ . 1 . 2]" 1
1877 3 73 ASP H 3 73 ASP HB3 . . 3.750 2.514 2.367 2.735 . 0 0 "[ . 1 . 2]" 1
1878 3 73 ASP H 3 74 GLN H . . 3.650 2.441 2.279 2.603 . 0 0 "[ . 1 . 2]" 1
1879 3 73 ASP HA 3 74 GLN HE22 . . 3.270 3.145 2.917 3.336 0.066 5 0 "[ . 1 . 2]" 1
1880 3 73 ASP HA 3 74 GLN HE21 . . 3.270 3.341 2.928 3.568 0.298 19 0 "[ . 1 . 2]" 1
1881 3 73 ASP HB2 3 74 GLN H . . 4.860 4.324 4.125 4.470 . 0 0 "[ . 1 . 2]" 1
1882 3 73 ASP HB3 3 74 GLN H . . 4.860 3.569 3.407 3.824 . 0 0 "[ . 1 . 2]" 1
1883 3 74 GLN H 3 76 LEU H . . 4.500 3.916 3.696 4.168 . 0 0 "[ . 1 . 2]" 1
1884 3 74 GLN H 3 74 GLN QG . . 3.520 3.136 2.706 3.386 . 0 0 "[ . 1 . 2]" 1
1885 3 74 GLN HA 3 76 LEU H . . 3.970 3.551 3.202 3.961 . 0 0 "[ . 1 . 2]" 1
1886 3 74 GLN HA 3 75 GLN H . . 3.170 3.033 2.755 3.137 . 0 0 "[ . 1 . 2]" 1
1887 3 74 GLN H 3 75 GLN H . . 3.170 2.631 2.561 2.795 . 0 0 "[ . 1 . 2]" 1
1888 3 74 GLN HA 3 74 GLN QG . . 3.400 2.488 2.407 2.625 . 0 0 "[ . 1 . 2]" 1
1889 3 75 GLN H 3 76 LEU H . . 3.080 2.307 2.007 2.439 . 0 0 "[ . 1 . 2]" 1
1890 3 75 GLN QG 3 76 LEU H . . 4.780 4.126 3.346 4.482 . 0 0 "[ . 1 . 2]" 1
1891 3 75 GLN H 3 75 GLN QB . . 3.790 2.297 2.192 2.940 . 0 0 "[ . 1 . 2]" 1
1892 3 75 GLN HA 3 75 GLN QG . . 3.350 2.770 2.353 3.402 0.052 15 0 "[ . 1 . 2]" 1
1893 3 76 LEU H 3 77 VAL H . . 4.460 4.347 4.174 4.469 0.009 12 0 "[ . 1 . 2]" 1
1894 3 76 LEU H 3 76 LEU QB . . 3.750 2.607 2.459 2.851 . 0 0 "[ . 1 . 2]" 1
1895 3 76 LEU H 3 86 PRO QD . . 4.760 4.066 3.736 4.352 . 0 0 "[ . 1 . 2]" 1
1896 3 76 LEU HA 3 77 VAL H . . 3.240 2.246 2.130 2.309 . 0 0 "[ . 1 . 2]" 1
1897 3 76 LEU QB 3 83 TYR QD . . 4.590 3.569 2.537 4.672 0.082 11 0 "[ . 1 . 2]" 1
1898 3 76 LEU MD2 3 83 TYR HB2 . . 6.200 4.259 3.286 5.424 . 0 0 "[ . 1 . 2]" 1
1899 3 76 LEU MD2 3 83 TYR HB3 . . 6.200 2.914 1.866 4.199 . 0 0 "[ . 1 . 2]" 1
1900 3 76 LEU MD1 3 83 TYR HB3 . . 6.200 2.410 1.812 3.211 . 0 0 "[ . 1 . 2]" 1
1901 3 76 LEU MD1 3 85 LEU MD1 . . 4.520 3.642 2.200 4.790 0.270 8 0 "[ . 1 . 2]" 1
1902 3 76 LEU MD1 3 85 LEU MD2 . . 4.520 3.723 2.016 5.275 0.755 3 1 "[ + . 1 . 2]" 1
1903 3 76 LEU MD2 3 85 LEU MD1 . . 4.520 3.303 1.860 4.780 0.260 10 0 "[ . 1 . 2]" 1
1904 3 76 LEU MD2 3 85 LEU MD2 . . 4.520 3.349 1.835 4.712 0.192 14 0 "[ . 1 . 2]" 1
1905 3 76 LEU HA 3 76 LEU MD2 . . 4.240 2.576 1.910 3.992 . 0 0 "[ . 1 . 2]" 1
1906 3 76 LEU HG 3 83 TYR QD . . 5.500 3.978 2.552 5.396 . 0 0 "[ . 1 . 2]" 1
1907 3 76 LEU HA 3 76 LEU MD1 . . 4.240 2.941 2.052 3.892 . 0 0 "[ . 1 . 2]" 1
1908 3 76 LEU MD1 3 84 ARG H . . 4.510 3.328 2.134 4.671 0.161 10 0 "[ . 1 . 2]" 1
1909 3 76 LEU MD2 3 84 ARG H . . 4.510 3.612 2.222 4.791 0.281 1 0 "[ . 1 . 2]" 1
1910 3 77 VAL H 3 78 TYR H . . 4.930 4.364 4.243 4.509 . 0 0 "[ . 1 . 2]" 1
1911 3 77 VAL HA 3 78 TYR H . . 3.180 2.159 2.111 2.260 . 0 0 "[ . 1 . 2]" 1
1912 3 77 VAL H 3 84 ARG H . . 4.020 3.289 2.777 3.538 . 0 0 "[ . 1 . 2]" 1
1913 3 77 VAL H 3 83 TYR HA . . 5.280 4.892 4.382 5.192 . 0 0 "[ . 1 . 2]" 1
1914 3 77 VAL H 3 77 VAL HB . . 3.460 2.656 2.407 3.770 0.310 11 0 "[ . 1 . 2]" 1
1915 3 77 VAL H 3 86 PRO QD . . 3.980 2.374 2.083 2.734 . 0 0 "[ . 1 . 2]" 1
1916 3 77 VAL H 3 77 VAL MG1 . . 3.700 3.611 2.228 3.840 0.140 17 0 "[ . 1 . 2]" 1
1917 3 77 VAL MG1 3 86 PRO QD . . 4.330 4.054 1.850 4.565 0.235 4 0 "[ . 1 . 2]" 1
1918 3 77 VAL MG2 3 86 PRO QD . . 4.330 2.276 1.869 4.392 0.062 3 0 "[ . 1 . 2]" 1
1919 3 77 VAL H 3 77 VAL MG2 . . 3.700 2.816 2.148 3.904 0.204 3 0 "[ . 1 . 2]" 1
1920 3 78 TYR H 3 78 TYR QD . . 4.340 4.308 4.244 4.380 0.040 11 0 "[ . 1 . 2]" 1
1921 3 78 TYR QD 3 79 SER H . . 3.900 3.134 2.311 3.935 0.035 13 0 "[ . 1 . 2]" 1
1922 3 78 TYR HA 3 79 SER H . . 3.010 2.184 2.148 2.211 . 0 0 "[ . 1 . 2]" 1
1923 3 78 TYR HB3 3 79 SER H . . 4.730 4.340 4.008 4.415 . 0 0 "[ . 1 . 2]" 1
1924 3 78 TYR HB2 3 79 SER H . . 4.730 4.556 4.449 4.640 . 0 0 "[ . 1 . 2]" 1
1925 3 78 TYR H 3 79 SER H . . 4.550 4.228 4.102 4.384 . 0 0 "[ . 1 . 2]" 1
1926 3 78 TYR HA 3 84 ARG H . . 4.600 3.838 3.621 4.117 . 0 0 "[ . 1 . 2]" 1
1927 3 78 TYR QE 3 82 VAL H . . 4.420 3.267 2.751 4.070 . 0 0 "[ . 1 . 2]" 1
1928 3 78 TYR HA 3 82 VAL H . . 4.680 4.375 4.124 4.548 . 0 0 "[ . 1 . 2]" 1
1929 3 78 TYR QD 3 82 VAL H . . 4.600 3.381 2.793 4.275 . 0 0 "[ . 1 . 2]" 1
1930 3 78 TYR HA 3 81 GLY H . . 5.190 5.332 5.283 5.398 0.208 13 0 "[ . 1 . 2]" 1
1931 3 78 TYR QD 3 83 TYR HA . . 4.020 3.115 2.988 3.295 . 0 0 "[ . 1 . 2]" 1
1932 3 78 TYR QE 3 83 TYR HA . . 4.920 4.827 4.478 5.032 0.112 19 0 "[ . 1 . 2]" 1
1933 3 78 TYR HA 3 83 TYR HA . . 3.330 2.681 2.560 2.839 . 0 0 "[ . 1 . 2]" 1
1934 3 78 TYR HA 3 83 TYR QD . . 4.700 3.210 2.487 3.996 . 0 0 "[ . 1 . 2]" 1
1935 3 78 TYR QE 3 79 SER H . . 5.400 4.886 4.282 5.090 . 0 0 "[ . 1 . 2]" 1
1936 3 78 TYR QE 3 81 GLY H . . 3.800 3.639 3.352 3.853 0.053 3 0 "[ . 1 . 2]" 1
1937 3 78 TYR QD 3 81 GLY H . . 4.200 4.054 3.730 4.281 0.081 19 0 "[ . 1 . 2]" 1
1938 3 78 TYR QE 3 81 GLY HA2 . . 3.850 2.481 2.330 2.603 . 0 0 "[ . 1 . 2]" 1
1939 3 78 TYR QE 3 81 GLY HA3 . . 3.850 3.899 3.753 3.986 0.136 18 0 "[ . 1 . 2]" 1
1940 3 78 TYR QD 3 83 TYR QD . . 3.630 3.290 2.829 3.727 0.097 3 0 "[ . 1 . 2]" 1
1941 3 78 TYR HA 3 78 TYR QD . . 3.970 2.085 1.880 2.496 . 0 0 "[ . 1 . 2]" 1
1942 3 78 TYR QE 3 82 VAL HA . . 3.540 3.579 3.397 3.680 0.140 7 0 "[ . 1 . 2]" 1
1943 3 78 TYR QE 3 83 TYR QD . . 4.140 4.106 3.550 4.372 0.232 20 0 "[ . 1 . 2]" 1
1944 3 79 SER H 3 82 VAL MG2 . . 4.810 3.593 2.630 4.961 0.151 2 0 "[ . 1 . 2]" 1
1945 3 79 SER H 3 82 VAL MG1 . . 4.810 4.542 3.320 5.260 0.450 20 0 "[ . 1 . 2]" 1
1946 3 79 SER H 3 83 TYR HA . . 4.060 3.418 3.043 3.748 . 0 0 "[ . 1 . 2]" 1
1947 3 79 SER H 3 82 VAL H . . 3.540 3.306 2.891 3.576 0.036 17 0 "[ . 1 . 2]" 1
1948 3 79 SER H 3 79 SER HB2 . . 3.770 2.665 2.341 3.688 . 0 0 "[ . 1 . 2]" 1
1949 3 79 SER H 3 79 SER HB3 . . 3.770 2.677 2.399 3.633 . 0 0 "[ . 1 . 2]" 1
1950 3 79 SER HA 3 82 VAL H . . 4.680 4.804 4.756 4.849 0.169 6 0 "[ . 1 . 2]" 1
1951 3 80 ALA H 3 82 VAL H . . 3.870 3.885 3.759 3.958 0.088 12 0 "[ . 1 . 2]" 1
1952 3 80 ALA MB 3 81 GLY H . . 4.170 3.737 3.718 3.766 . 0 0 "[ . 1 . 2]" 1
1953 3 80 ALA HA 3 82 VAL H . . 4.890 4.185 4.123 4.272 . 0 0 "[ . 1 . 2]" 1
1954 3 81 GLY H 3 82 VAL H . . 3.450 2.542 2.442 2.702 . 0 0 "[ . 1 . 2]" 1
1955 3 82 VAL H 3 83 TYR H . . 4.930 4.392 4.284 4.460 . 0 0 "[ . 1 . 2]" 1
1956 3 82 VAL H 3 82 VAL HB . . 3.800 3.666 2.577 3.922 0.122 8 0 "[ . 1 . 2]" 1
1957 3 82 VAL MG2 3 83 TYR HA . . 5.500 4.117 3.756 5.641 0.141 2 0 "[ . 1 . 2]" 1
1958 3 82 VAL MG1 3 83 TYR HA . . 5.500 5.187 3.782 5.662 0.162 6 0 "[ . 1 . 2]" 1
1959 3 82 VAL HB 3 83 TYR H . . 4.510 3.234 2.457 4.328 . 0 0 "[ . 1 . 2]" 1
1960 3 82 VAL MG1 3 83 TYR H . . 3.930 3.842 2.818 4.001 0.071 1 0 "[ . 1 . 2]" 1
1961 3 82 VAL HA 3 83 TYR H . . 3.080 2.266 2.166 2.440 . 0 0 "[ . 1 . 2]" 1
1962 3 82 VAL MG2 3 83 TYR H . . 3.930 3.266 2.394 3.874 . 0 0 "[ . 1 . 2]" 1
1963 3 83 TYR H 3 83 TYR QD . . 4.240 3.085 2.636 3.749 . 0 0 "[ . 1 . 2]" 1
1964 3 83 TYR QD 3 84 ARG H . . 4.530 3.584 3.000 4.173 . 0 0 "[ . 1 . 2]" 1
1965 3 83 TYR HA 3 84 ARG H . . 3.090 2.187 2.106 2.249 . 0 0 "[ . 1 . 2]" 1
1966 3 83 TYR HA 3 83 TYR QD . . 4.040 2.562 2.088 3.008 . 0 0 "[ . 1 . 2]" 1
1967 3 84 ARG HB2 3 85 LEU H . . 4.170 3.159 2.509 4.144 . 0 0 "[ . 1 . 2]" 1
1968 3 84 ARG H 3 84 ARG HG3 . . 4.410 3.206 2.611 4.695 0.285 11 0 "[ . 1 . 2]" 1
1969 3 84 ARG HA 3 85 LEU H . . 3.450 2.284 2.198 2.398 . 0 0 "[ . 1 . 2]" 1
1970 3 84 ARG QD 3 85 LEU H . . 4.550 4.227 3.177 4.886 0.336 3 0 "[ . 1 . 2]" 1
1971 3 84 ARG HA 3 84 ARG QD . . 4.310 4.113 3.725 4.480 0.170 6 0 "[ . 1 . 2]" 1
1972 3 84 ARG HB3 3 85 LEU H . . 4.170 4.108 3.136 4.332 0.162 8 0 "[ . 1 . 2]" 1
1973 3 84 ARG H 3 84 ARG HG2 . . 4.410 3.630 2.822 4.318 . 0 0 "[ . 1 . 2]" 1
1974 3 85 LEU H 3 86 PRO QD . . 4.630 4.374 4.139 4.495 . 0 0 "[ . 1 . 2]" 1
1975 3 85 LEU HA 3 86 PRO HG2 . . 4.670 4.388 4.214 4.561 . 0 0 "[ . 1 . 2]" 1
1976 3 85 LEU HG 3 86 PRO QD . . 4.680 3.670 2.525 4.709 0.029 8 0 "[ . 1 . 2]" 1
1977 3 85 LEU HB3 3 86 PRO QD . . 4.660 3.318 2.620 4.294 . 0 0 "[ . 1 . 2]" 1
1978 3 85 LEU HB2 3 86 PRO QD . . 4.660 4.160 3.942 4.370 . 0 0 "[ . 1 . 2]" 1
1979 3 85 LEU HA 3 86 PRO HG3 . . 4.670 4.487 4.403 4.569 . 0 0 "[ . 1 . 2]" 1
1980 3 85 LEU H 3 85 LEU HG . . 4.960 3.706 2.522 4.730 . 0 0 "[ . 1 . 2]" 1
1981 3 85 LEU H 3 85 LEU MD2 . . 3.840 3.860 3.458 4.263 0.423 3 0 "[ . 1 . 2]" 1
1982 3 85 LEU H 3 85 LEU MD1 . . 3.840 3.690 2.752 4.035 0.195 8 0 "[ . 1 . 2]" 1
1983 3 86 PRO HA 3 87 LYS QG . . 4.860 4.199 3.615 5.042 0.182 14 0 "[ . 1 . 2]" 1
1984 3 87 LYS H 3 87 LYS HB3 . . 4.180 3.657 2.669 4.192 0.012 2 0 "[ . 1 . 2]" 1
1985 3 87 LYS HA 3 87 LYS QE . . 4.210 4.054 2.800 4.539 0.329 17 0 "[ . 1 . 2]" 1
1986 3 87 LYS HA 3 88 ASN HA . . 4.680 4.615 4.320 4.827 0.147 9 0 "[ . 1 . 2]" 1
1987 3 87 LYS HA 3 87 LYS QG . . 3.550 2.815 2.225 3.547 . 0 0 "[ . 1 . 2]" 1
1988 3 87 LYS QE 3 87 LYS QG . . 3.090 2.386 2.147 2.855 . 0 0 "[ . 1 . 2]" 1
1989 3 87 LYS H 3 87 LYS HB2 . . 4.180 2.938 2.279 4.007 . 0 0 "[ . 1 . 2]" 1
1990 3 87 LYS HA 3 87 LYS QD . . 3.840 3.175 1.941 4.217 0.377 7 0 "[ . 1 . 2]" 1
1991 3 87 LYS H 3 87 LYS QG . . 3.720 2.708 1.918 3.928 0.208 13 0 "[ . 1 . 2]" 1
1992 3 89 CYS QB 3 90 SER H . . 4.410 2.931 1.946 3.843 . 0 0 "[ . 1 . 2]" 1
1993 1 2 MET H 1 2 MET QG . . 3.720 3.119 2.869 3.375 . 0 0 "[ . 1 . 2]" 1
1994 1 2 MET H 2 18 VAL QG . . 4.600 3.610 3.421 3.845 . 0 0 "[ . 1 . 2]" 1
1995 1 2 MET HA 1 2 MET QG . . 3.520 3.530 3.505 3.573 0.053 12 0 "[ . 1 . 2]" 1
1996 1 2 MET HA 1 3 GLN QG . . 3.870 4.052 3.651 4.269 0.399 5 0 "[ . 1 . 2]" 1
1997 1 2 MET HA 2 64 LYS QE . . 3.210 3.428 3.268 3.571 0.361 20 0 "[ . 1 . 2]" 1
1998 1 2 MET QB 1 3 GLN H . . 3.470 2.578 1.927 2.777 . 0 0 "[ . 1 . 2]" 1
1999 1 2 MET QB 2 18 VAL QG . . 4.170 4.270 3.962 4.392 0.222 2 0 "[ . 1 . 2]" 1
2000 1 2 MET QB 2 64 LYS HA . . 3.870 2.092 1.790 2.346 . 0 0 "[ . 1 . 2]" 1
2001 1 2 MET QB 2 64 LYS QB . . 3.880 2.126 1.864 2.529 . 0 0 "[ . 1 . 2]" 1
2002 1 2 MET QB 2 64 LYS QE . . 3.830 3.679 2.656 4.071 0.241 6 0 "[ . 1 . 2]" 1
2003 1 2 MET ME 1 2 MET QG . . 3.060 2.218 2.189 2.297 . 0 0 "[ . 1 . 2]" 1
2004 1 2 MET QG 1 3 GLN H . . 4.030 3.521 2.601 3.881 . 0 0 "[ . 1 . 2]" 1
2005 1 2 MET QG 1 3 GLN HA . . 4.500 4.177 3.375 4.480 . 0 0 "[ . 1 . 2]" 1
2006 1 2 MET QG 2 18 VAL H . . 3.830 3.944 3.510 4.093 0.263 7 0 "[ . 1 . 2]" 1
2007 1 2 MET QG 2 18 VAL QG . . 3.290 2.666 2.263 2.872 . 0 0 "[ . 1 . 2]" 1
2008 1 2 MET QG 2 62 ILE HA . . 4.870 4.866 4.592 5.103 0.233 4 0 "[ . 1 . 2]" 1
2009 1 2 MET ME 2 18 VAL QG . . 3.170 1.958 1.721 3.283 0.113 6 0 "[ . 1 . 2]" 1
2010 1 2 MET ME 2 20 PRO QB . . 4.480 2.972 2.258 3.483 . 0 0 "[ . 1 . 2]" 1
2011 1 2 MET ME 2 20 PRO QD . . 3.880 3.016 2.582 3.305 . 0 0 "[ . 1 . 2]" 1
2012 1 3 GLN H 1 3 GLN QB . . 3.380 2.831 2.521 3.218 . 0 0 "[ . 1 . 2]" 1
2013 1 3 GLN HA 1 3 GLN QG . . 3.540 3.111 2.504 3.566 0.026 3 0 "[ . 1 . 2]" 1
2014 1 3 GLN QB 1 4 ILE H . . 3.620 2.720 2.392 3.247 . 0 0 "[ . 1 . 2]" 1
2015 1 3 GLN QG 1 4 ILE H . . 5.170 4.193 3.873 4.748 . 0 0 "[ . 1 . 2]" 1
2016 1 4 ILE H 1 4 ILE QG . . 4.910 2.617 2.203 3.735 . 0 0 "[ . 1 . 2]" 1
2017 1 5 PHE QB 1 6 VAL H . . 3.870 3.475 3.142 3.661 . 0 0 "[ . 1 . 2]" 1
2018 1 5 PHE QB 2 13 THR MG . . 4.200 1.982 1.786 2.294 . 0 0 "[ . 1 . 2]" 1
2019 1 5 PHE QB 2 67 ALA HA . . 4.210 2.284 1.860 2.833 . 0 0 "[ . 1 . 2]" 1
2020 1 5 PHE QB 2 67 ALA MB . . 4.670 2.934 2.278 3.598 . 0 0 "[ . 1 . 2]" 1
2021 1 5 PHE QD 2 65 GLU QB . . 4.090 3.757 3.075 4.170 0.080 5 0 "[ . 1 . 2]" 1
2022 1 5 PHE QE 2 65 GLU QB . . 3.440 2.246 1.920 3.044 . 0 0 "[ . 1 . 2]" 1
2023 1 6 VAL H 2 14 ILE QG . . 4.270 4.380 4.249 4.540 0.270 11 0 "[ . 1 . 2]" 1
2024 1 6 VAL HA 2 68 LEU QD . . 4.230 3.053 1.803 3.749 . 0 0 "[ . 1 . 2]" 1
2025 1 6 VAL QG 2 68 LEU QD . . 3.540 2.413 1.724 3.305 . 0 0 "[ . 1 . 2]" 1
2026 1 7 ASP H 2 68 LEU QB . . 5.150 3.949 2.858 4.909 . 0 0 "[ . 1 . 2]" 1
2027 1 7 ASP H 2 68 LEU QD . . 4.030 4.078 2.627 4.382 0.352 1 0 "[ . 1 . 2]" 1
2028 1 9 VAL H 1 9 VAL QG . . 4.250 2.078 1.919 2.260 . 0 0 "[ . 1 . 2]" 1
2029 1 9 VAL QG 2 69 ILE MD . . 3.870 3.145 1.895 4.026 0.156 18 0 "[ . 1 . 2]" 1
2030 1 9 VAL QG 2 71 LEU H . . 5.250 4.655 4.035 5.326 0.076 3 0 "[ . 1 . 2]" 1
2031 1 11 TRP QB 1 12 LYS H . . 3.810 3.899 3.490 4.023 0.213 12 0 "[ . 1 . 2]" 1
2032 1 12 LYS H 1 12 LYS QG . . 4.790 3.669 2.384 4.402 . 0 0 "[ . 1 . 2]" 1
2033 1 13 THR HA 1 14 ILE QG . . 4.040 3.632 3.396 3.863 . 0 0 "[ . 1 . 2]" 1
2034 1 13 THR MG 2 5 PHE QB . . 4.200 1.896 1.764 2.522 . 0 0 "[ . 1 . 2]" 1
2035 1 14 ILE H 1 14 ILE QG . . 4.650 2.316 2.047 2.551 . 0 0 "[ . 1 . 2]" 1
2036 1 14 ILE QG 2 6 VAL H . . 4.270 4.434 4.370 4.519 0.249 13 0 "[ . 1 . 2]" 1
2037 1 16 LEU H 1 16 LEU QD . . 3.880 2.046 1.805 3.264 . 0 0 "[ . 1 . 2]" 1
2038 1 16 LEU HA 1 17 GLU QB . . 4.270 4.173 3.744 4.401 0.131 3 0 "[ . 1 . 2]" 1
2039 1 16 LEU QD 1 17 GLU H . . 3.750 3.458 2.639 3.806 0.056 15 0 "[ . 1 . 2]" 1
2040 1 17 GLU H 1 17 GLU QB . . 3.140 2.426 2.184 2.579 . 0 0 "[ . 1 . 2]" 1
2041 1 17 GLU HA 1 18 VAL QG . . 3.800 3.543 3.237 3.818 0.018 19 0 "[ . 1 . 2]" 1
2042 1 17 GLU QB 1 18 VAL H . . 3.700 3.273 2.566 3.713 0.013 18 0 "[ . 1 . 2]" 1
2043 1 17 GLU QB 1 18 VAL HA . . 4.300 4.217 3.726 4.555 0.255 14 0 "[ . 1 . 2]" 1
2044 1 18 VAL H 1 18 VAL QG . . 3.140 2.342 2.079 2.551 . 0 0 "[ . 1 . 2]" 1
2045 1 18 VAL H 2 2 MET QG . . 3.830 3.856 3.641 3.968 0.138 20 0 "[ . 1 . 2]" 1
2046 1 18 VAL HA 1 18 VAL QG . . 2.970 2.305 2.253 2.365 . 0 0 "[ . 1 . 2]" 1
2047 1 18 VAL QG 1 19 GLU H . . 3.540 2.167 1.754 3.110 . 0 0 "[ . 1 . 2]" 1
2048 1 18 VAL QG 1 19 GLU HA . . 5.190 3.717 3.495 4.146 . 0 0 "[ . 1 . 2]" 1
2049 1 18 VAL QG 1 22 ASP QB . . 3.630 2.961 2.284 3.930 0.300 8 0 "[ . 1 . 2]" 1
2050 1 18 VAL QG 1 26 ASN QB . . 3.750 3.522 2.671 3.876 0.126 3 0 "[ . 1 . 2]" 1
2051 1 18 VAL QG 1 26 ASN QD . . 4.850 3.521 1.878 4.713 . 0 0 "[ . 1 . 2]" 1
2052 1 18 VAL QG 2 2 MET H . . 4.600 3.626 3.309 3.877 . 0 0 "[ . 1 . 2]" 1
2053 1 18 VAL QG 2 2 MET QB . . 4.170 4.279 3.982 4.439 0.269 15 0 "[ . 1 . 2]" 1
2054 1 18 VAL QG 2 2 MET QG . . 3.290 2.659 2.313 2.871 . 0 0 "[ . 1 . 2]" 1
2055 1 18 VAL QG 2 2 MET ME . . 3.170 1.793 1.681 1.921 . 0 0 "[ . 1 . 2]" 1
2056 1 19 GLU H 1 19 GLU QB . . 3.470 2.524 2.258 2.914 . 0 0 "[ . 1 . 2]" 1
2057 1 19 GLU H 1 19 GLU QG . . 3.420 2.988 2.584 3.707 0.287 19 0 "[ . 1 . 2]" 1
2058 1 19 GLU H 1 20 PRO QD . . 4.480 4.448 4.328 4.502 0.022 15 0 "[ . 1 . 2]" 1
2059 1 19 GLU H 1 22 ASP QB . . 3.990 2.827 2.196 4.222 0.232 8 0 "[ . 1 . 2]" 1
2060 1 19 GLU H 1 57 LEU QD . . 3.710 3.792 3.410 4.007 0.297 12 0 "[ . 1 . 2]" 1
2061 1 19 GLU HA 1 19 GLU QG . . 3.200 2.804 2.421 3.337 0.137 13 0 "[ . 1 . 2]" 1
2062 1 19 GLU HA 1 20 PRO QG . . 4.230 4.058 3.792 4.158 . 0 0 "[ . 1 . 2]" 1
2063 1 19 GLU QB 1 20 PRO QD . . 3.370 2.337 1.974 2.809 . 0 0 "[ . 1 . 2]" 1
2064 1 19 GLU QB 1 21 SER H . . 3.310 2.716 2.431 3.224 . 0 0 "[ . 1 . 2]" 1
2065 1 19 GLU QG 1 20 PRO QD . . 3.400 3.583 3.143 3.859 0.459 14 0 "[ . 1 . 2]" 1
2066 1 19 GLU QG 1 21 SER H . . 4.750 4.575 1.879 4.893 0.143 15 0 "[ . 1 . 2]" 1
2067 1 20 PRO HA 1 57 LEU QD . . 3.890 3.899 3.582 4.062 0.172 2 0 "[ . 1 . 2]" 1
2068 1 20 PRO QB 1 21 SER H . . 3.860 3.238 2.761 3.474 . 0 0 "[ . 1 . 2]" 1
2069 1 20 PRO QB 1 21 SER HA . . 4.400 4.087 3.794 4.238 . 0 0 "[ . 1 . 2]" 1
2070 1 20 PRO QB 1 58 SER HA . . 4.840 3.520 3.027 4.409 . 0 0 "[ . 1 . 2]" 1
2071 1 20 PRO QB 1 58 SER QB . . 3.300 2.229 1.877 3.314 0.014 16 0 "[ . 1 . 2]" 1
2072 1 20 PRO QB 2 2 MET ME . . 4.480 3.013 2.647 3.493 . 0 0 "[ . 1 . 2]" 1
2073 1 20 PRO QG 1 21 SER H . . 4.210 2.653 2.354 3.928 . 0 0 "[ . 1 . 2]" 1
2074 1 20 PRO QD 1 21 SER H . . 4.220 2.768 2.538 2.971 . 0 0 "[ . 1 . 2]" 1
2075 1 20 PRO QD 1 22 ASP H . . 4.890 4.376 4.136 4.666 . 0 0 "[ . 1 . 2]" 1
2076 1 20 PRO QD 2 2 MET ME . . 3.880 3.011 2.734 3.425 . 0 0 "[ . 1 . 2]" 1
2077 1 21 SER H 1 21 SER QB . . 3.130 2.534 2.399 2.750 . 0 0 "[ . 1 . 2]" 1
2078 1 21 SER QB 1 22 ASP H . . 3.790 3.412 3.094 3.814 0.024 20 0 "[ . 1 . 2]" 1
2079 1 21 SER QB 1 56 THR MG . . 4.210 4.189 3.892 4.386 0.176 8 0 "[ . 1 . 2]" 1
2080 1 22 ASP H 1 22 ASP QB . . 3.000 2.310 2.131 2.793 . 0 0 "[ . 1 . 2]" 1
2081 1 22 ASP H 1 57 LEU QD . . 4.520 3.410 3.102 3.870 . 0 0 "[ . 1 . 2]" 1
2082 1 22 ASP QB 1 23 THR H . . 3.800 2.868 2.456 3.758 . 0 0 "[ . 1 . 2]" 1
2083 1 22 ASP QB 1 23 THR HA . . 4.850 4.398 4.174 4.871 0.021 5 0 "[ . 1 . 2]" 1
2084 1 22 ASP QB 1 26 ASN QB . . 4.010 3.092 2.380 4.253 0.243 2 0 "[ . 1 . 2]" 1
2085 1 22 ASP QB 1 26 ASN QD . . 3.330 2.296 1.719 3.456 0.126 2 0 "[ . 1 . 2]" 1
2086 1 22 ASP QB 1 57 LEU QB . . 4.410 3.838 3.321 4.750 0.340 8 0 "[ . 1 . 2]" 1
2087 1 22 ASP QB 1 57 LEU QD . . 3.550 2.377 1.925 3.739 0.189 8 0 "[ . 1 . 2]" 1
2088 1 23 THR H 1 57 LEU QD . . 4.470 3.797 3.600 4.043 . 0 0 "[ . 1 . 2]" 1
2089 1 24 ILE H 1 24 ILE QG . . 3.520 2.038 1.933 2.231 . 0 0 "[ . 1 . 2]" 1
2090 1 24 ILE HA 1 27 VAL QG . . 3.700 2.595 2.235 3.044 . 0 0 "[ . 1 . 2]" 1
2091 1 24 ILE MG 1 51 LEU QD . . 4.890 2.518 2.111 2.885 . 0 0 "[ . 1 . 2]" 1
2092 1 24 ILE QG 1 55 ARG H . . 4.670 3.154 2.980 3.265 . 0 0 "[ . 1 . 2]" 1
2093 1 24 ILE QG 1 56 THR H . . 4.460 3.809 3.419 4.140 . 0 0 "[ . 1 . 2]" 1
2094 1 24 ILE QG 1 56 THR HA . . 4.880 3.366 2.862 3.655 . 0 0 "[ . 1 . 2]" 1
2095 1 24 ILE QG 1 60 TYR QE . . 4.420 2.313 1.928 3.873 . 0 0 "[ . 1 . 2]" 1
2096 1 24 ILE MD 1 51 LEU QD . . 4.400 2.029 1.796 2.391 . 0 0 "[ . 1 . 2]" 1
2097 1 25 GLU H 1 28 LYS QE . . 4.940 4.677 3.949 5.149 0.209 17 0 "[ . 1 . 2]" 1
2098 1 25 GLU HA 1 28 LYS QB . . 4.080 2.575 1.910 4.257 0.177 11 0 "[ . 1 . 2]" 1
2099 1 25 GLU HA 1 28 LYS QE . . 4.340 2.258 1.778 2.785 . 0 0 "[ . 1 . 2]" 1
2100 1 25 GLU QG 1 26 ASN QB . . 4.430 4.076 3.396 4.551 0.121 5 0 "[ . 1 . 2]" 1
2101 1 26 ASN H 1 26 ASN QB . . 3.150 2.417 2.144 2.593 . 0 0 "[ . 1 . 2]" 1
2102 1 26 ASN HA 1 26 ASN QD . . 4.060 4.020 3.707 4.135 0.075 18 0 "[ . 1 . 2]" 1
2103 1 26 ASN QB 1 27 VAL H . . 3.710 2.455 2.060 3.500 . 0 0 "[ . 1 . 2]" 1
2104 1 26 ASN QB 1 27 VAL HA . . 5.070 4.017 3.840 4.585 . 0 0 "[ . 1 . 2]" 1
2105 1 26 ASN QB 1 27 VAL QG . . 4.210 3.089 2.703 4.081 . 0 0 "[ . 1 . 2]" 1
2106 1 26 ASN QB 1 29 ALA MB . . 4.900 4.379 3.898 4.992 0.092 6 0 "[ . 1 . 2]" 1
2107 1 27 VAL H 1 27 VAL QG . . 3.060 1.999 1.837 2.244 . 0 0 "[ . 1 . 2]" 1
2108 1 27 VAL HA 1 30 LYS QB . . 3.900 2.910 2.060 3.977 0.077 8 0 "[ . 1 . 2]" 1
2109 1 27 VAL QG 1 28 LYS H . . 3.940 3.131 2.291 3.303 . 0 0 "[ . 1 . 2]" 1
2110 1 27 VAL QG 1 28 LYS HA . . 4.090 3.612 3.313 3.895 . 0 0 "[ . 1 . 2]" 1
2111 1 28 LYS HA 1 31 ILE QG . . 4.190 2.305 1.817 2.615 . 0 0 "[ . 1 . 2]" 1
2112 1 28 LYS QD 1 39 PRO QB . . 3.380 2.322 1.783 3.228 . 0 0 "[ . 1 . 2]" 1
2113 1 28 LYS QE 1 29 ALA H . . 5.220 3.583 2.863 4.596 . 0 0 "[ . 1 . 2]" 1
2114 1 28 LYS QE 1 39 PRO QG . . 3.980 3.740 3.197 4.103 0.123 3 0 "[ . 1 . 2]" 1
2115 1 29 ALA HA 1 32 GLN QB . . 3.590 2.341 2.100 2.582 . 0 0 "[ . 1 . 2]" 1
2116 1 30 LYS H 1 30 LYS QB . . 3.370 2.436 2.154 2.621 . 0 0 "[ . 1 . 2]" 1
2117 1 30 LYS QB 1 31 ILE H . . 3.450 2.822 2.435 3.578 0.128 1 0 "[ . 1 . 2]" 1
2118 1 31 ILE H 1 31 ILE QG . . 4.390 2.113 1.895 2.314 . 0 0 "[ . 1 . 2]" 1
2119 1 31 ILE QG 1 32 GLN H . . 3.880 2.348 2.229 2.448 . 0 0 "[ . 1 . 2]" 1
2120 1 31 ILE QG 1 32 GLN HA . . 4.200 3.780 3.448 4.455 0.255 4 0 "[ . 1 . 2]" 1
2121 1 31 ILE QG 1 32 GLN QB . . 4.440 3.407 3.197 3.735 . 0 0 "[ . 1 . 2]" 1
2122 1 31 ILE QG 1 37 ILE HB . . 5.100 3.130 2.101 4.884 . 0 0 "[ . 1 . 2]" 1
2123 1 32 GLN H 1 32 GLN QB . . 3.400 2.251 2.181 2.320 . 0 0 "[ . 1 . 2]" 1
2124 1 32 GLN HA 1 32 GLN QG . . 3.420 2.511 2.413 2.567 . 0 0 "[ . 1 . 2]" 1
2125 1 32 GLN QB 1 32 GLN QE . . 3.900 2.281 1.854 3.528 . 0 0 "[ . 1 . 2]" 1
2126 1 32 GLN QB 1 33 ASP H . . 3.390 2.636 2.442 2.864 . 0 0 "[ . 1 . 2]" 1
2127 1 32 GLN QG 1 33 ASP H . . 4.630 3.778 3.438 4.170 . 0 0 "[ . 1 . 2]" 1
2128 1 32 GLN QG 1 33 ASP HA . . 4.370 3.824 3.360 4.313 . 0 0 "[ . 1 . 2]" 1
2129 1 32 GLN QG 1 36 GLY H . . 4.610 4.594 4.334 4.718 0.108 18 0 "[ . 1 . 2]" 1
2130 1 32 GLN QG 1 36 GLY QA . . 3.850 3.555 3.201 3.874 0.024 7 0 "[ . 1 . 2]" 1
2131 1 32 GLN QE 1 39 PRO QB . . 4.570 3.887 2.356 4.630 0.060 15 0 "[ . 1 . 2]" 1
2132 1 32 GLN QE 1 39 PRO QD . . 4.590 2.469 1.835 3.338 . 0 0 "[ . 1 . 2]" 1
2133 1 33 ASP QB 1 34 LYS QG . . 4.510 2.753 2.383 2.973 . 0 0 "[ . 1 . 2]" 1
2134 1 33 ASP QB 1 34 LYS QD . . 5.320 3.722 2.916 4.489 . 0 0 "[ . 1 . 2]" 1
2135 1 35 GLU H 1 35 GLU QG . . 3.700 3.220 2.313 4.020 0.320 4 0 "[ . 1 . 2]" 1
2136 1 35 GLU H 1 36 GLY QA . . 4.660 4.262 4.054 4.381 . 0 0 "[ . 1 . 2]" 1
2137 1 35 GLU H 1 37 ILE QG . . 4.880 4.041 3.530 4.411 . 0 0 "[ . 1 . 2]" 1
2138 1 35 GLU HA 1 35 GLU QG . . 3.390 2.689 2.375 3.216 . 0 0 "[ . 1 . 2]" 1
2139 1 35 GLU QG 1 36 GLY H . . 5.000 4.511 3.917 4.892 . 0 0 "[ . 1 . 2]" 1
2140 1 36 GLY QA 1 37 ILE QG . . 4.590 4.167 3.955 4.486 . 0 0 "[ . 1 . 2]" 1
2141 1 37 ILE H 1 37 ILE QG . . 4.490 2.185 1.915 2.467 . 0 0 "[ . 1 . 2]" 1
2142 1 38 PRO QB 1 40 ASP QB . . 4.930 3.585 2.235 4.828 . 0 0 "[ . 1 . 2]" 1
2143 1 38 PRO QB 1 41 GLN H . . 4.990 2.723 2.183 3.145 . 0 0 "[ . 1 . 2]" 1
2144 1 38 PRO QB 1 41 GLN QE . . 4.300 4.139 3.532 4.473 0.173 20 0 "[ . 1 . 2]" 1
2145 1 39 PRO QG 1 40 ASP H . . 3.880 2.398 2.135 2.742 . 0 0 "[ . 1 . 2]" 1
2146 1 39 PRO QG 1 40 ASP HA . . 4.820 4.442 3.975 4.835 0.015 13 0 "[ . 1 . 2]" 1
2147 1 41 GLN QE 1 73 THR HB . . 4.400 4.236 3.472 4.591 0.191 20 0 "[ . 1 . 2]" 1
2148 1 42 GLN H 1 42 GLN QG . . 4.790 3.576 2.299 4.254 . 0 0 "[ . 1 . 2]" 1
2149 1 42 GLN HA 1 42 GLN QE . . 4.700 4.340 2.770 4.921 0.221 19 0 "[ . 1 . 2]" 1
2150 1 44 LEU HA 1 44 LEU QD . . 3.240 2.584 2.060 3.399 0.159 15 0 "[ . 1 . 2]" 1
2151 1 44 LEU QB 1 45 ILE H . . 3.930 3.482 2.837 3.964 0.034 5 0 "[ . 1 . 2]" 1
2152 1 44 LEU QB 1 51 LEU H . . 3.960 3.482 2.856 4.089 0.129 15 0 "[ . 1 . 2]" 1
2153 1 44 LEU QB 1 70 LEU QD . . 3.300 3.206 2.428 3.746 0.446 19 0 "[ . 1 . 2]" 1
2154 1 44 LEU QD 1 45 ILE H . . 4.000 3.379 2.198 4.379 0.379 10 0 "[ . 1 . 2]" 1
2155 1 44 LEU QD 1 68 LEU QD . . 3.410 2.378 1.699 3.214 . 0 0 "[ . 1 . 2]" 1
2156 1 44 LEU QD 1 70 LEU QD . . 3.330 2.429 1.921 3.319 . 0 0 "[ . 1 . 2]" 1
2157 1 45 ILE H 1 45 ILE QG . . 4.230 2.861 2.378 3.183 . 0 0 "[ . 1 . 2]" 1
2158 1 45 ILE HA 1 45 ILE QG . . 3.720 2.634 2.447 3.256 . 0 0 "[ . 1 . 2]" 1
2159 1 45 ILE HA 1 46 PHE QB . . 4.630 3.955 3.711 4.151 . 0 0 "[ . 1 . 2]" 1
2160 1 45 ILE MG 1 48 GLY QA . . 4.740 2.507 2.362 3.051 . 0 0 "[ . 1 . 2]" 1
2161 1 45 ILE QG 1 48 GLY QA . . 5.060 5.134 4.727 5.366 0.306 10 0 "[ . 1 . 2]" 1
2162 1 45 ILE MD 1 48 GLY QA . . 4.580 4.191 3.821 4.686 0.106 14 0 "[ . 1 . 2]" 1
2163 1 46 PHE H 1 51 LEU QD . . 3.880 2.742 2.088 3.613 . 0 0 "[ . 1 . 2]" 1
2164 1 46 PHE HA 1 51 LEU QD . . 4.170 3.694 3.341 4.112 . 0 0 "[ . 1 . 2]" 1
2165 1 46 PHE HA 1 68 LEU QD . . 4.290 3.307 2.225 4.099 . 0 0 "[ . 1 . 2]" 1
2166 1 46 PHE QB 1 49 LYS QG . . 4.730 4.474 3.480 4.869 0.139 7 0 "[ . 1 . 2]" 1
2167 1 46 PHE QB 1 49 LYS QD . . 5.130 4.483 3.324 5.440 0.310 20 0 "[ . 1 . 2]" 1
2168 1 46 PHE QB 1 51 LEU QD . . 3.250 1.754 1.655 1.836 . 0 0 "[ . 1 . 2]" 1
2169 1 46 PHE QB 1 68 LEU HA . . 4.400 3.931 3.166 4.388 . 0 0 "[ . 1 . 2]" 1
2170 1 46 PHE QB 1 68 LEU HG . . 5.240 3.562 2.550 4.969 . 0 0 "[ . 1 . 2]" 1
2171 1 46 PHE QB 1 68 LEU QD . . 3.850 2.705 1.921 3.925 0.075 2 0 "[ . 1 . 2]" 1
2172 1 46 PHE QD 1 51 LEU QD . . 3.860 2.340 1.734 3.224 . 0 0 "[ . 1 . 2]" 1
2173 1 46 PHE QE 1 66 SER QB . . 3.840 2.264 1.775 3.009 . 0 0 "[ . 1 . 2]" 1
2174 1 46 PHE QE 1 68 LEU QD . . 4.470 2.893 2.127 3.594 . 0 0 "[ . 1 . 2]" 1
2175 1 46 PHE HZ 1 66 SER QB . . 3.830 2.613 2.043 3.331 . 0 0 "[ . 1 . 2]" 1
2176 1 49 LYS QB 1 51 LEU QD . . 4.250 3.304 2.146 4.248 . 0 0 "[ . 1 . 2]" 1
2177 1 49 LYS QG 1 51 LEU QD . . 4.590 3.784 2.848 4.627 0.037 8 0 "[ . 1 . 2]" 1
2178 1 49 LYS QD 1 51 LEU QD . . 4.910 4.139 3.380 4.740 . 0 0 "[ . 1 . 2]" 1
2179 1 50 GLN HA 1 51 LEU QD . . 3.850 3.276 2.557 3.828 . 0 0 "[ . 1 . 2]" 1
2180 1 51 LEU H 1 51 LEU QD . . 3.430 2.503 2.021 3.109 . 0 0 "[ . 1 . 2]" 1
2181 1 51 LEU HA 1 51 LEU QD . . 3.150 2.168 2.055 2.323 . 0 0 "[ . 1 . 2]" 1
2182 1 51 LEU QB 1 60 TYR QD . . 4.890 4.862 4.161 5.189 0.299 1 0 "[ . 1 . 2]" 1
2183 1 51 LEU QB 1 60 TYR QE . . 4.440 3.871 3.243 4.298 . 0 0 "[ . 1 . 2]" 1
2184 1 51 LEU QD 1 52 GLU H . . 4.160 3.783 3.138 4.004 . 0 0 "[ . 1 . 2]" 1
2185 1 51 LEU QD 1 60 TYR QD . . 3.660 2.840 2.334 3.106 . 0 0 "[ . 1 . 2]" 1
2186 1 51 LEU QD 1 60 TYR QE . . 3.310 2.745 2.380 2.912 . 0 0 "[ . 1 . 2]" 1
2187 1 51 LEU QD 1 62 ILE MD . . 4.000 2.477 2.077 3.158 . 0 0 "[ . 1 . 2]" 1
2188 1 52 GLU H 1 52 GLU QG . . 4.600 3.161 2.112 4.107 . 0 0 "[ . 1 . 2]" 1
2189 1 52 GLU H 1 55 ARG QB . . 3.770 3.461 2.882 3.880 0.110 18 0 "[ . 1 . 2]" 1
2190 1 52 GLU H 1 55 ARG QD . . 4.620 3.987 3.156 5.076 0.456 15 0 "[ . 1 . 2]" 1
2191 1 52 GLU HA 1 52 GLU QG . . 3.460 2.554 2.314 2.981 . 0 0 "[ . 1 . 2]" 1
2192 1 52 GLU QB 1 55 ARG QD . . 4.100 2.393 1.778 3.568 . 0 0 "[ . 1 . 2]" 1
2193 1 52 GLU QG 1 53 ASP H . . 4.210 3.707 2.618 4.475 0.265 19 0 "[ . 1 . 2]" 1
2194 1 52 GLU QG 1 55 ARG QD . . 4.470 3.506 2.239 4.505 0.035 15 0 "[ . 1 . 2]" 1
2195 1 54 GLY H 1 55 ARG QB . . 5.340 4.304 4.001 4.657 . 0 0 "[ . 1 . 2]" 1
2196 1 54 GLY QA 1 55 ARG QB . . 4.410 4.445 4.132 4.718 0.308 15 0 "[ . 1 . 2]" 1
2197 1 55 ARG H 1 55 ARG QG . . 4.070 3.816 2.560 4.174 0.104 17 0 "[ . 1 . 2]" 1
2198 1 55 ARG H 1 55 ARG QD . . 4.530 3.723 2.505 4.672 0.142 8 0 "[ . 1 . 2]" 1
2199 1 55 ARG HA 1 55 ARG QD . . 4.340 3.038 2.053 4.246 . 0 0 "[ . 1 . 2]" 1
2200 1 55 ARG QB 1 55 ARG QD . . 3.270 2.343 2.129 2.550 . 0 0 "[ . 1 . 2]" 1
2201 1 55 ARG QB 1 56 THR H . . 3.670 2.624 2.088 3.286 . 0 0 "[ . 1 . 2]" 1
2202 1 55 ARG QG 1 56 THR H . . 4.390 2.764 1.849 4.252 . 0 0 "[ . 1 . 2]" 1
2203 1 55 ARG QD 1 60 TYR QE . . 4.340 3.839 2.604 4.478 0.138 3 0 "[ . 1 . 2]" 1
2204 1 56 THR H 1 59 ASP QB . . 3.590 2.406 2.021 2.861 . 0 0 "[ . 1 . 2]" 1
2205 1 56 THR HB 1 57 LEU QD . . 5.250 4.723 3.844 5.202 . 0 0 "[ . 1 . 2]" 1
2206 1 56 THR HB 1 58 SER QB . . 3.760 3.583 2.947 3.905 0.145 10 0 "[ . 1 . 2]" 1
2207 1 56 THR MG 1 57 LEU QB . . 5.340 3.838 3.050 5.053 . 0 0 "[ . 1 . 2]" 1
2208 1 56 THR MG 1 58 SER QB . . 5.310 3.186 2.340 4.872 . 0 0 "[ . 1 . 2]" 1
2209 1 56 THR MG 1 59 ASP QB . . 4.380 3.857 3.559 4.263 . 0 0 "[ . 1 . 2]" 1
2210 1 57 LEU H 1 57 LEU QD . . 3.750 2.176 2.019 2.388 . 0 0 "[ . 1 . 2]" 1
2211 1 57 LEU HA 1 57 LEU QD . . 3.100 2.135 2.032 2.280 . 0 0 "[ . 1 . 2]" 1
2212 1 57 LEU HA 1 60 TYR QB . . 4.750 3.690 2.974 4.115 . 0 0 "[ . 1 . 2]" 1
2213 1 57 LEU QB 1 58 SER H . . 3.750 2.573 2.424 2.729 . 0 0 "[ . 1 . 2]" 1
2214 1 57 LEU QB 1 62 ILE H . . 4.970 3.839 3.540 4.115 . 0 0 "[ . 1 . 2]" 1
2215 1 57 LEU QB 1 62 ILE HB . . 4.110 2.414 2.094 2.968 . 0 0 "[ . 1 . 2]" 1
2216 1 57 LEU QD 1 58 SER H . . 5.300 3.908 3.821 4.044 . 0 0 "[ . 1 . 2]" 1
2217 1 57 LEU QD 1 59 ASP H . . 5.440 4.997 4.892 5.179 . 0 0 "[ . 1 . 2]" 1
2218 1 57 LEU QD 1 62 ILE MG . . 3.860 2.074 1.796 2.447 . 0 0 "[ . 1 . 2]" 1
2219 1 57 LEU QD 1 62 ILE MD . . 3.050 2.306 1.742 3.082 0.032 12 0 "[ . 1 . 2]" 1
2220 1 58 SER H 1 58 SER QB . . 3.210 2.287 2.228 2.584 . 0 0 "[ . 1 . 2]" 1
2221 1 58 SER QB 1 59 ASP H . . 3.540 2.966 2.791 3.554 0.014 6 0 "[ . 1 . 2]" 1
2222 1 58 SER QB 1 61 ASN H . . 5.200 4.620 4.190 4.747 . 0 0 "[ . 1 . 2]" 1
2223 1 59 ASP H 1 59 ASP QB . . 3.090 2.251 2.197 2.331 . 0 0 "[ . 1 . 2]" 1
2224 1 59 ASP QB 1 60 TYR H . . 3.680 2.791 2.641 3.091 . 0 0 "[ . 1 . 2]" 1
2225 1 60 TYR H 1 60 TYR QB . . 3.140 2.470 2.311 2.582 . 0 0 "[ . 1 . 2]" 1
2226 1 60 TYR QB 1 62 ILE H . . 5.030 3.329 3.032 3.916 . 0 0 "[ . 1 . 2]" 1
2227 1 60 TYR QB 1 62 ILE HB . . 5.040 4.258 3.631 5.069 0.029 12 0 "[ . 1 . 2]" 1
2228 1 60 TYR QB 1 62 ILE QG . . 4.610 2.394 1.719 3.804 . 0 0 "[ . 1 . 2]" 1
2229 1 60 TYR QB 1 62 ILE MD . . 3.860 2.249 1.810 2.648 . 0 0 "[ . 1 . 2]" 1
2230 1 60 TYR QD 1 62 ILE QG . . 5.070 3.887 3.178 5.036 . 0 0 "[ . 1 . 2]" 1
2231 1 61 ASN H 1 61 ASN QB . . 3.300 2.953 2.858 3.356 0.056 7 0 "[ . 1 . 2]" 1
2232 1 61 ASN QB 1 62 ILE H . . 3.970 4.004 3.879 4.085 0.115 17 0 "[ . 1 . 2]" 1
2233 1 62 ILE HA 1 62 ILE QG . . 3.560 2.526 2.258 3.104 . 0 0 "[ . 1 . 2]" 1
2234 1 62 ILE HA 2 2 MET QG . . 4.870 4.891 4.726 5.005 0.135 16 0 "[ . 1 . 2]" 1
2235 1 62 ILE QG 1 63 GLN H . . 5.150 4.340 3.949 4.874 . 0 0 "[ . 1 . 2]" 1
2236 1 64 LYS H 1 64 LYS QB . . 3.660 2.441 2.203 2.814 . 0 0 "[ . 1 . 2]" 1
2237 1 64 LYS HA 2 2 MET QB . . 3.870 2.081 1.885 2.304 . 0 0 "[ . 1 . 2]" 1
2238 1 64 LYS QB 1 65 GLU H . . 3.910 3.105 2.241 3.711 . 0 0 "[ . 1 . 2]" 1
2239 1 64 LYS QB 2 2 MET QB . . 3.880 2.236 1.907 2.535 . 0 0 "[ . 1 . 2]" 1
2240 1 64 LYS QB 2 3 GLN H . . 3.730 2.947 2.170 3.622 . 0 0 "[ . 1 . 2]" 1
2241 1 64 LYS QG 1 65 GLU QB . . 4.290 3.508 2.934 4.313 0.023 4 0 "[ . 1 . 2]" 1
2242 1 64 LYS QE 2 2 MET HA . . 3.210 3.177 2.409 3.665 0.455 1 0 "[ . 1 . 2]" 1
2243 1 64 LYS QE 2 2 MET QB . . 3.830 3.243 2.330 3.876 0.046 18 0 "[ . 1 . 2]" 1
2244 1 65 GLU QB 2 5 PHE QD . . 4.090 3.952 3.575 4.116 0.026 14 0 "[ . 1 . 2]" 1
2245 1 65 GLU QB 2 5 PHE QE . . 3.440 2.298 1.792 2.865 . 0 0 "[ . 1 . 2]" 1
2246 1 67 ALA HA 2 5 PHE QB . . 4.210 2.329 1.994 2.625 . 0 0 "[ . 1 . 2]" 1
2247 1 67 ALA HA 2 6 VAL QG . . 4.900 5.003 4.882 5.133 0.233 16 0 "[ . 1 . 2]" 1
2248 1 67 ALA MB 2 5 PHE QB . . 4.670 3.093 2.731 3.448 . 0 0 "[ . 1 . 2]" 1
2249 1 68 LEU H 1 68 LEU QB . . 3.660 2.491 2.222 2.827 . 0 0 "[ . 1 . 2]" 1
2250 1 68 LEU H 1 68 LEU QD . . 4.770 3.017 1.866 4.026 . 0 0 "[ . 1 . 2]" 1
2251 1 68 LEU HA 1 68 LEU QD . . 3.570 2.745 2.175 3.234 . 0 0 "[ . 1 . 2]" 1
2252 1 68 LEU QB 2 7 ASP H . . 5.150 3.642 3.277 4.172 . 0 0 "[ . 1 . 2]" 1
2253 1 68 LEU QD 1 69 ILE H . . 4.280 3.122 1.798 4.483 0.203 13 0 "[ . 1 . 2]" 1
2254 1 68 LEU QD 2 6 VAL HA . . 4.230 3.124 2.726 3.497 . 0 0 "[ . 1 . 2]" 1
2255 1 68 LEU QD 2 6 VAL QG . . 3.540 1.845 1.724 2.189 . 0 0 "[ . 1 . 2]" 1
2256 1 68 LEU QD 2 7 ASP H . . 4.030 4.200 3.569 4.519 0.489 6 0 "[ . 1 . 2]" 1
2257 1 69 ILE H 1 69 ILE QG . . 4.650 4.126 4.017 4.263 . 0 0 "[ . 1 . 2]" 1
2258 1 69 ILE HA 1 70 LEU QB . . 4.300 4.241 4.010 4.397 0.097 5 0 "[ . 1 . 2]" 1
2259 1 69 ILE QG 1 71 LEU HA . . 4.710 3.958 3.450 4.423 . 0 0 "[ . 1 . 2]" 1
2260 1 69 ILE MD 1 71 LEU QD . . 4.860 2.385 1.947 3.582 . 0 0 "[ . 1 . 2]" 1
2261 1 70 LEU H 1 70 LEU QB . . 3.620 2.384 2.264 2.520 . 0 0 "[ . 1 . 2]" 1
2262 1 70 LEU H 1 71 LEU QD . . 4.880 4.095 3.610 4.856 . 0 0 "[ . 1 . 2]" 1
2263 1 71 LEU H 1 71 LEU QD . . 4.800 2.622 1.974 3.280 . 0 0 "[ . 1 . 2]" 1
2264 1 71 LEU H 2 9 VAL QG . . 5.250 4.920 3.874 5.357 0.107 3 0 "[ . 1 . 2]" 1
2265 1 72 LEU H 1 72 LEU QD . . 4.020 3.255 1.744 3.977 . 0 0 "[ . 1 . 2]" 1
2266 1 72 LEU HA 1 72 LEU QD . . 3.680 2.506 1.927 3.456 . 0 0 "[ . 1 . 2]" 1
2267 1 72 LEU QB 1 72 LEU QD . . 2.800 1.996 1.954 2.104 . 0 0 "[ . 1 . 2]" 1
2268 1 72 LEU QB 1 73 THR H . . 4.260 2.875 2.153 3.513 . 0 0 "[ . 1 . 2]" 1
2269 1 72 LEU QD 1 73 THR H . . 4.640 2.769 1.739 3.787 . 0 0 "[ . 1 . 2]" 1
2270 1 73 THR HA 1 74 LEU QB . . 4.880 4.252 3.960 4.907 0.027 7 0 "[ . 1 . 2]" 1
2271 1 74 LEU H 1 74 LEU QD . . 4.470 3.431 1.777 3.944 . 0 0 "[ . 1 . 2]" 1
2272 1 74 LEU HA 1 74 LEU QD . . 3.830 2.693 2.117 3.507 . 0 0 "[ . 1 . 2]" 1
2273 1 75 ARG HA 1 75 ARG QD . . 4.750 3.674 1.988 4.636 . 0 0 "[ . 1 . 2]" 1
2274 2 2 MET H 2 2 MET QG . . 3.720 3.034 2.819 3.185 . 0 0 "[ . 1 . 2]" 1
2275 2 2 MET HA 2 2 MET QG . . 3.520 3.543 3.517 3.575 0.055 9 0 "[ . 1 . 2]" 1
2276 2 2 MET HA 2 3 GLN QG . . 3.870 3.955 3.428 4.204 0.334 15 0 "[ . 1 . 2]" 1
2277 2 2 MET QB 2 3 GLN H . . 3.470 2.562 1.920 2.795 . 0 0 "[ . 1 . 2]" 1
2278 2 2 MET ME 2 2 MET QG . . 3.060 2.226 2.196 2.246 . 0 0 "[ . 1 . 2]" 1
2279 2 2 MET QG 2 3 GLN H . . 4.030 3.639 2.995 3.897 . 0 0 "[ . 1 . 2]" 1
2280 2 2 MET QG 2 3 GLN HA . . 4.500 4.287 3.922 4.485 . 0 0 "[ . 1 . 2]" 1
2281 2 3 GLN H 2 3 GLN QB . . 3.380 2.819 2.507 3.223 . 0 0 "[ . 1 . 2]" 1
2282 2 3 GLN HA 2 3 GLN QG . . 3.540 3.078 2.465 3.552 0.012 4 0 "[ . 1 . 2]" 1
2283 2 3 GLN QB 2 4 ILE H . . 3.620 2.924 2.460 3.265 . 0 0 "[ . 1 . 2]" 1
2284 2 3 GLN QG 2 4 ILE H . . 5.170 4.380 4.008 4.704 . 0 0 "[ . 1 . 2]" 1
2285 2 4 ILE H 2 4 ILE QG . . 4.910 2.311 2.086 2.569 . 0 0 "[ . 1 . 2]" 1
2286 2 5 PHE QB 2 6 VAL H . . 3.870 3.488 2.977 3.723 . 0 0 "[ . 1 . 2]" 1
2287 2 9 VAL H 2 9 VAL QG . . 4.250 2.190 2.001 2.590 . 0 0 "[ . 1 . 2]" 1
2288 2 12 LYS H 2 12 LYS QG . . 4.790 3.439 2.614 4.417 . 0 0 "[ . 1 . 2]" 1
2289 2 13 THR HA 2 14 ILE QG . . 4.040 3.759 3.596 3.936 . 0 0 "[ . 1 . 2]" 1
2290 2 14 ILE H 2 14 ILE QG . . 4.650 2.357 2.168 2.553 . 0 0 "[ . 1 . 2]" 1
2291 2 16 LEU H 2 16 LEU QD . . 3.880 2.427 1.797 3.989 0.109 2 0 "[ . 1 . 2]" 1
2292 2 16 LEU HA 2 17 GLU QB . . 4.270 4.236 3.979 4.402 0.132 5 0 "[ . 1 . 2]" 1
2293 2 16 LEU QD 2 17 GLU H . . 3.750 3.351 1.967 3.815 0.065 5 0 "[ . 1 . 2]" 1
2294 2 16 LEU QD 2 17 GLU HA . . 4.650 3.898 3.084 4.554 . 0 0 "[ . 1 . 2]" 1
2295 2 17 GLU H 2 17 GLU QB . . 3.140 2.461 2.279 2.587 . 0 0 "[ . 1 . 2]" 1
2296 2 17 GLU HA 2 18 VAL QG . . 3.800 3.637 3.074 3.872 0.072 9 0 "[ . 1 . 2]" 1
2297 2 17 GLU QB 2 18 VAL H . . 3.700 3.395 2.781 3.708 0.008 2 0 "[ . 1 . 2]" 1
2298 2 17 GLU QB 2 18 VAL HA . . 4.300 4.342 3.886 4.549 0.249 2 0 "[ . 1 . 2]" 1
2299 2 18 VAL H 2 18 VAL QG . . 3.140 2.354 2.073 2.535 . 0 0 "[ . 1 . 2]" 1
2300 2 18 VAL HA 2 18 VAL QG . . 2.970 2.291 2.220 2.333 . 0 0 "[ . 1 . 2]" 1
2301 2 18 VAL QG 2 19 GLU H . . 3.540 1.880 1.741 2.764 . 0 0 "[ . 1 . 2]" 1
2302 2 18 VAL QG 2 19 GLU HA . . 5.190 3.613 3.337 4.421 . 0 0 "[ . 1 . 2]" 1
2303 2 18 VAL QG 2 22 ASP QB . . 3.630 2.559 2.135 3.848 0.218 18 0 "[ . 1 . 2]" 1
2304 2 18 VAL QG 2 26 ASN QB . . 3.750 3.267 2.596 3.845 0.095 18 0 "[ . 1 . 2]" 1
2305 2 18 VAL QG 2 26 ASN QD . . 4.850 3.871 1.963 4.867 0.017 7 0 "[ . 1 . 2]" 1
2306 2 19 GLU H 2 19 GLU QB . . 3.470 2.555 2.299 2.958 . 0 0 "[ . 1 . 2]" 1
2307 2 19 GLU H 2 19 GLU QG . . 3.420 2.936 2.505 3.241 . 0 0 "[ . 1 . 2]" 1
2308 2 19 GLU H 2 20 PRO QD . . 4.480 4.435 4.355 4.507 0.027 18 0 "[ . 1 . 2]" 1
2309 2 19 GLU H 2 22 ASP QB . . 3.990 2.767 2.474 3.771 . 0 0 "[ . 1 . 2]" 1
2310 2 19 GLU H 2 57 LEU QD . . 3.710 3.840 3.733 4.001 0.291 3 0 "[ . 1 . 2]" 1
2311 2 19 GLU HA 2 19 GLU QG . . 3.200 2.954 2.482 3.362 0.162 18 0 "[ . 1 . 2]" 1
2312 2 19 GLU HA 2 20 PRO QG . . 4.230 4.037 3.790 4.223 . 0 0 "[ . 1 . 2]" 1
2313 2 19 GLU QB 2 20 PRO QD . . 3.370 2.268 2.037 2.809 . 0 0 "[ . 1 . 2]" 1
2314 2 19 GLU QB 2 21 SER H . . 3.310 2.640 2.301 3.002 . 0 0 "[ . 1 . 2]" 1
2315 2 19 GLU QG 2 20 PRO QD . . 3.400 3.712 3.366 3.904 0.504 7 1 "[ . + 1 . 2]" 1
2316 2 19 GLU QG 2 21 SER H . . 4.750 4.526 2.048 4.864 0.114 2 0 "[ . 1 . 2]" 1
2317 2 20 PRO HA 2 57 LEU QD . . 3.890 3.938 3.780 4.043 0.153 5 0 "[ . 1 . 2]" 1
2318 2 20 PRO QB 2 21 SER H . . 3.860 3.184 2.637 3.491 . 0 0 "[ . 1 . 2]" 1
2319 2 20 PRO QB 2 21 SER HA . . 4.400 4.078 3.819 4.235 . 0 0 "[ . 1 . 2]" 1
2320 2 20 PRO QB 2 58 SER HA . . 4.840 3.400 2.909 3.814 . 0 0 "[ . 1 . 2]" 1
2321 2 20 PRO QB 2 58 SER QB . . 3.300 2.340 1.866 3.488 0.188 16 0 "[ . 1 . 2]" 1
2322 2 20 PRO QG 2 21 SER H . . 4.210 2.774 2.358 3.916 . 0 0 "[ . 1 . 2]" 1
2323 2 20 PRO QD 2 21 SER H . . 4.220 2.729 2.533 2.816 . 0 0 "[ . 1 . 2]" 1
2324 2 20 PRO QD 2 22 ASP H . . 4.890 4.350 4.166 4.562 . 0 0 "[ . 1 . 2]" 1
2325 2 21 SER H 2 21 SER QB . . 3.130 2.517 2.404 2.708 . 0 0 "[ . 1 . 2]" 1
2326 2 21 SER QB 2 22 ASP H . . 3.790 3.369 3.180 3.876 0.086 16 0 "[ . 1 . 2]" 1
2327 2 21 SER QB 2 56 THR MG . . 4.210 4.217 4.002 4.370 0.160 11 0 "[ . 1 . 2]" 1
2328 2 22 ASP H 2 22 ASP QB . . 3.000 2.331 2.236 2.558 . 0 0 "[ . 1 . 2]" 1
2329 2 22 ASP H 2 57 LEU QD . . 4.520 3.466 3.295 3.668 . 0 0 "[ . 1 . 2]" 1
2330 2 22 ASP QB 2 23 THR H . . 3.800 2.660 2.268 3.310 . 0 0 "[ . 1 . 2]" 1
2331 2 22 ASP QB 2 23 THR HA . . 4.850 4.286 4.105 4.725 . 0 0 "[ . 1 . 2]" 1
2332 2 22 ASP QB 2 26 ASN QB . . 4.010 2.991 2.363 3.844 . 0 0 "[ . 1 . 2]" 1
2333 2 22 ASP QB 2 26 ASN QD . . 3.330 2.220 1.741 3.355 0.025 8 0 "[ . 1 . 2]" 1
2334 2 22 ASP QB 2 57 LEU QB . . 4.410 3.821 3.377 4.807 0.397 18 0 "[ . 1 . 2]" 1
2335 2 22 ASP QB 2 57 LEU QD . . 3.550 2.426 2.033 3.680 0.130 18 0 "[ . 1 . 2]" 1
2336 2 23 THR H 2 57 LEU QD . . 4.470 3.768 3.385 3.984 . 0 0 "[ . 1 . 2]" 1
2337 2 24 ILE H 2 24 ILE QG . . 3.520 2.073 1.878 2.239 . 0 0 "[ . 1 . 2]" 1
2338 2 24 ILE HA 2 27 VAL QG . . 3.700 2.528 1.874 2.947 . 0 0 "[ . 1 . 2]" 1
2339 2 24 ILE QG 2 55 ARG H . . 4.670 3.126 2.972 3.276 . 0 0 "[ . 1 . 2]" 1
2340 2 24 ILE QG 2 56 THR H . . 4.460 4.014 3.694 4.443 . 0 0 "[ . 1 . 2]" 1
2341 2 24 ILE QG 2 56 THR HA . . 4.880 3.567 3.292 3.872 . 0 0 "[ . 1 . 2]" 1
2342 2 24 ILE QG 2 60 TYR QE . . 4.420 2.467 2.078 3.433 . 0 0 "[ . 1 . 2]" 1
2343 2 24 ILE MD 2 51 LEU QD . . 4.400 2.493 2.046 3.089 . 0 0 "[ . 1 . 2]" 1
2344 2 25 GLU H 2 28 LYS QE . . 4.940 4.629 4.324 5.101 0.161 15 0 "[ . 1 . 2]" 1
2345 2 25 GLU HA 2 28 LYS QB . . 4.080 3.190 1.731 4.284 0.204 15 0 "[ . 1 . 2]" 1
2346 2 25 GLU HA 2 28 LYS QE . . 4.340 2.297 1.933 2.731 . 0 0 "[ . 1 . 2]" 1
2347 2 25 GLU QG 2 26 ASN QB . . 4.430 4.040 3.622 4.732 0.302 6 0 "[ . 1 . 2]" 1
2348 2 26 ASN H 2 26 ASN QB . . 3.150 2.454 2.172 2.563 . 0 0 "[ . 1 . 2]" 1
2349 2 26 ASN HA 2 26 ASN QD . . 4.060 3.818 2.976 4.141 0.081 18 0 "[ . 1 . 2]" 1
2350 2 26 ASN QB 2 27 VAL H . . 3.710 2.487 2.188 3.463 . 0 0 "[ . 1 . 2]" 1
2351 2 26 ASN QB 2 27 VAL HA . . 5.070 3.924 3.780 4.631 . 0 0 "[ . 1 . 2]" 1
2352 2 26 ASN QB 2 27 VAL QG . . 4.210 3.036 2.572 3.914 . 0 0 "[ . 1 . 2]" 1
2353 2 26 ASN QB 2 29 ALA MB . . 4.900 4.327 4.058 4.633 . 0 0 "[ . 1 . 2]" 1
2354 2 27 VAL H 2 27 VAL QG . . 3.060 2.010 1.940 2.171 . 0 0 "[ . 1 . 2]" 1
2355 2 27 VAL HA 2 30 LYS QB . . 3.900 3.036 2.433 3.980 0.080 7 0 "[ . 1 . 2]" 1
2356 2 27 VAL QG 2 28 LYS H . . 3.940 3.164 2.256 3.327 . 0 0 "[ . 1 . 2]" 1
2357 2 27 VAL QG 2 28 LYS HA . . 4.090 3.587 3.257 3.897 . 0 0 "[ . 1 . 2]" 1
2358 2 28 LYS HA 2 31 ILE QG . . 4.190 2.116 1.847 2.494 . 0 0 "[ . 1 . 2]" 1
2359 2 28 LYS QD 2 39 PRO QB . . 3.380 2.371 1.713 3.322 . 0 0 "[ . 1 . 2]" 1
2360 2 28 LYS QE 2 29 ALA H . . 5.220 3.788 2.682 4.986 . 0 0 "[ . 1 . 2]" 1
2361 2 28 LYS QE 2 39 PRO QG . . 3.980 3.650 3.024 4.014 0.034 19 0 "[ . 1 . 2]" 1
2362 2 29 ALA HA 2 32 GLN QB . . 3.590 2.429 2.022 2.938 . 0 0 "[ . 1 . 2]" 1
2363 2 30 LYS H 2 30 LYS QB . . 3.370 2.479 2.381 2.597 . 0 0 "[ . 1 . 2]" 1
2364 2 30 LYS QB 2 31 ILE H . . 3.450 2.801 2.311 3.592 0.142 6 0 "[ . 1 . 2]" 1
2365 2 31 ILE H 2 31 ILE QG . . 4.390 2.170 1.953 2.329 . 0 0 "[ . 1 . 2]" 1
2366 2 31 ILE QG 2 32 GLN H . . 3.880 2.365 2.172 2.495 . 0 0 "[ . 1 . 2]" 1
2367 2 31 ILE QG 2 32 GLN HA . . 4.200 3.666 3.354 4.366 0.166 9 0 "[ . 1 . 2]" 1
2368 2 31 ILE QG 2 32 GLN QB . . 4.440 3.297 2.867 3.703 . 0 0 "[ . 1 . 2]" 1
2369 2 31 ILE QG 2 37 ILE HB . . 5.100 2.578 2.065 5.254 0.154 13 0 "[ . 1 . 2]" 1
2370 2 32 GLN H 2 32 GLN QB . . 3.400 2.252 2.191 2.311 . 0 0 "[ . 1 . 2]" 1
2371 2 32 GLN HA 2 32 GLN QG . . 3.420 2.514 2.409 2.635 . 0 0 "[ . 1 . 2]" 1
2372 2 32 GLN QB 2 32 GLN QE . . 3.900 2.432 1.806 3.520 . 0 0 "[ . 1 . 2]" 1
2373 2 32 GLN QB 2 33 ASP H . . 3.390 2.641 2.474 2.938 . 0 0 "[ . 1 . 2]" 1
2374 2 32 GLN QG 2 33 ASP H . . 4.630 3.752 3.328 4.227 . 0 0 "[ . 1 . 2]" 1
2375 2 32 GLN QG 2 33 ASP HA . . 4.370 3.802 3.406 4.348 . 0 0 "[ . 1 . 2]" 1
2376 2 32 GLN QG 2 36 GLY H . . 4.610 4.536 4.035 4.734 0.124 1 0 "[ . 1 . 2]" 1
2377 2 32 GLN QG 2 36 GLY QA . . 3.850 3.406 2.850 3.835 . 0 0 "[ . 1 . 2]" 1
2378 2 32 GLN QE 2 39 PRO QB . . 4.570 4.042 2.327 4.711 0.141 19 0 "[ . 1 . 2]" 1
2379 2 32 GLN QE 2 39 PRO QD . . 4.590 2.158 1.765 2.714 . 0 0 "[ . 1 . 2]" 1
2380 2 33 ASP QB 2 34 LYS QG . . 4.510 2.785 2.437 3.209 . 0 0 "[ . 1 . 2]" 1
2381 2 33 ASP QB 2 34 LYS QD . . 5.320 4.030 2.956 4.829 . 0 0 "[ . 1 . 2]" 1
2382 2 35 GLU H 2 36 GLY QA . . 4.660 4.188 4.005 4.445 . 0 0 "[ . 1 . 2]" 1
2383 2 35 GLU H 2 37 ILE QG . . 4.880 4.020 3.234 4.387 . 0 0 "[ . 1 . 2]" 1
2384 2 35 GLU HA 2 35 GLU QG . . 3.390 2.875 2.346 3.400 0.010 8 0 "[ . 1 . 2]" 1
2385 2 35 GLU QG 2 36 GLY H . . 5.000 4.248 3.322 4.558 . 0 0 "[ . 1 . 2]" 1
2386 2 36 GLY QA 2 37 ILE QG . . 4.590 4.132 3.873 4.421 . 0 0 "[ . 1 . 2]" 1
2387 2 37 ILE H 2 37 ILE QG . . 3.240 2.262 1.844 2.485 . 0 0 "[ . 1 . 2]" 1
2388 2 38 PRO QB 2 40 ASP QB . . 4.930 3.600 2.682 4.970 0.040 3 0 "[ . 1 . 2]" 1
2389 2 38 PRO QB 2 41 GLN H . . 4.990 2.636 2.230 3.096 . 0 0 "[ . 1 . 2]" 1
2390 2 38 PRO QB 2 41 GLN QE . . 4.300 3.827 2.501 4.472 0.172 10 0 "[ . 1 . 2]" 1
2391 2 39 PRO QG 2 40 ASP H . . 3.880 2.353 2.016 2.740 . 0 0 "[ . 1 . 2]" 1
2392 2 39 PRO QG 2 40 ASP HA . . 4.820 4.461 4.158 4.772 . 0 0 "[ . 1 . 2]" 1
2393 2 41 GLN QE 2 73 THR HB . . 4.400 4.449 4.042 4.669 0.269 10 0 "[ . 1 . 2]" 1
2394 2 42 GLN H 2 42 GLN QG . . 4.790 3.300 2.066 4.259 . 0 0 "[ . 1 . 2]" 1
2395 2 42 GLN HA 2 42 GLN QE . . 4.700 4.384 2.649 5.005 0.305 6 0 "[ . 1 . 2]" 1
2396 2 44 LEU HA 2 44 LEU QD . . 3.240 2.502 1.998 3.381 0.141 17 0 "[ . 1 . 2]" 1
2397 2 44 LEU QB 2 45 ASP H . . 3.930 3.496 2.762 3.956 0.026 5 0 "[ . 1 . 2]" 1
2398 2 44 LEU QB 2 51 LEU H . . 3.960 3.382 1.995 4.430 0.470 10 0 "[ . 1 . 2]" 1
2399 2 44 LEU QB 2 70 LEU QD . . 3.300 3.111 2.440 3.534 0.234 20 0 "[ . 1 . 2]" 1
2400 2 44 LEU QD 2 45 ASP H . . 4.000 3.422 2.177 4.249 0.249 20 0 "[ . 1 . 2]" 1
2401 2 44 LEU QD 2 68 LEU QD . . 3.410 2.593 1.789 3.595 0.185 20 0 "[ . 1 . 2]" 1
2402 2 44 LEU QD 2 70 LEU QD . . 3.330 2.484 1.877 3.433 0.103 10 0 "[ . 1 . 2]" 1
2403 2 45 ASP HA 2 46 PHE QB . . 4.630 3.965 3.859 4.090 . 0 0 "[ . 1 . 2]" 1
2404 2 46 PHE H 2 51 LEU QD . . 3.880 3.222 2.523 3.951 0.071 10 0 "[ . 1 . 2]" 1
2405 2 46 PHE HA 2 51 LEU QD . . 4.170 3.793 3.488 4.120 . 0 0 "[ . 1 . 2]" 1
2406 2 46 PHE QB 2 49 LYS QG . . 4.730 3.749 2.392 4.863 0.133 15 0 "[ . 1 . 2]" 1
2407 2 46 PHE QB 2 49 LYS QD . . 5.130 4.320 2.927 5.207 0.077 10 0 "[ . 1 . 2]" 1
2408 2 46 PHE QB 2 51 LEU QD . . 3.250 1.817 1.687 2.158 . 0 0 "[ . 1 . 2]" 1
2409 2 46 PHE QB 2 68 LEU HA . . 4.400 4.014 3.457 4.630 0.230 10 0 "[ . 1 . 2]" 1
2410 2 46 PHE QB 2 68 LEU HG . . 5.240 3.455 2.084 5.104 . 0 0 "[ . 1 . 2]" 1
2411 2 46 PHE QB 2 68 LEU QD . . 3.850 2.364 1.988 3.955 0.105 12 0 "[ . 1 . 2]" 1
2412 2 46 PHE QE 2 66 SER QB . . 3.840 2.320 1.745 3.850 0.010 3 0 "[ . 1 . 2]" 1
2413 2 46 PHE QE 2 68 LEU QD . . 4.470 3.191 2.303 3.880 . 0 0 "[ . 1 . 2]" 1
2414 2 46 PHE HZ 2 66 SER QB . . 3.830 2.794 2.041 3.919 0.089 14 0 "[ . 1 . 2]" 1
2415 2 49 LYS QB 2 51 LEU QD . . 4.250 3.830 2.719 4.349 0.099 7 0 "[ . 1 . 2]" 1
2416 2 49 LYS QG 2 51 LEU QD . . 4.590 3.693 2.918 4.652 0.062 12 0 "[ . 1 . 2]" 1
2417 2 49 LYS QD 2 51 LEU QD . . 4.910 4.292 3.555 4.729 . 0 0 "[ . 1 . 2]" 1
2418 2 50 GLN HA 2 51 LEU QD . . 3.850 3.154 2.480 3.936 0.086 16 0 "[ . 1 . 2]" 1
2419 2 51 LEU H 2 51 LEU QD . . 3.430 2.411 1.841 3.253 . 0 0 "[ . 1 . 2]" 1
2420 2 51 LEU HA 2 51 LEU QD . . 3.150 2.209 2.075 2.466 . 0 0 "[ . 1 . 2]" 1
2421 2 51 LEU QB 2 60 TYR QD . . 4.890 4.629 4.104 5.071 0.181 18 0 "[ . 1 . 2]" 1
2422 2 51 LEU QB 2 60 TYR QE . . 4.440 3.718 3.021 4.296 . 0 0 "[ . 1 . 2]" 1
2423 2 51 LEU QD 2 52 GLU H . . 4.160 3.862 3.724 4.102 . 0 0 "[ . 1 . 2]" 1
2424 2 51 LEU QD 2 60 TYR QD . . 4.190 2.915 2.704 3.109 . 0 0 "[ . 1 . 2]" 1
2425 2 51 LEU QD 2 60 TYR QE . . 4.000 2.875 2.630 3.326 . 0 0 "[ . 1 . 2]" 1
2426 2 51 LEU QD 2 62 ILE MD . . 4.000 2.617 1.951 3.482 . 0 0 "[ . 1 . 2]" 1
2427 2 52 GLU H 2 52 GLU QG . . 4.600 3.248 1.946 4.102 . 0 0 "[ . 1 . 2]" 1
2428 2 52 GLU H 2 55 ARG QB . . 3.770 3.392 3.074 3.876 0.106 1 0 "[ . 1 . 2]" 1
2429 2 52 GLU H 2 55 ARG QD . . 4.620 4.194 2.861 4.853 0.233 7 0 "[ . 1 . 2]" 1
2430 2 52 GLU HA 2 52 GLU QG . . 3.460 2.588 2.480 3.101 . 0 0 "[ . 1 . 2]" 1
2431 2 52 GLU QB 2 55 ARG QD . . 4.100 2.633 1.784 3.543 . 0 0 "[ . 1 . 2]" 1
2432 2 52 GLU QG 2 53 ASP H . . 4.210 3.784 2.349 4.320 0.110 8 0 "[ . 1 . 2]" 1
2433 2 52 GLU QG 2 55 ARG QD . . 4.470 3.666 2.748 4.617 0.147 7 0 "[ . 1 . 2]" 1
2434 2 54 GLY H 2 55 ARG QB . . 5.340 4.231 3.818 4.742 . 0 0 "[ . 1 . 2]" 1
2435 2 54 GLY QA 2 55 ARG QB . . 4.410 4.430 4.228 4.724 0.314 1 0 "[ . 1 . 2]" 1
2436 2 55 ARG H 2 55 ARG QG . . 4.070 3.760 2.349 4.185 0.115 3 0 "[ . 1 . 2]" 1
2437 2 55 ARG H 2 55 ARG QD . . 4.530 4.042 2.870 4.774 0.244 9 0 "[ . 1 . 2]" 1
2438 2 55 ARG HA 2 55 ARG QD . . 4.340 3.038 1.991 4.239 . 0 0 "[ . 1 . 2]" 1
2439 2 55 ARG QB 2 55 ARG QD . . 3.270 2.361 2.125 2.932 . 0 0 "[ . 1 . 2]" 1
2440 2 55 ARG QB 2 56 THR H . . 3.670 2.783 2.110 3.301 . 0 0 "[ . 1 . 2]" 1
2441 2 55 ARG QG 2 56 THR H . . 4.390 2.675 1.764 4.526 0.136 4 0 "[ . 1 . 2]" 1
2442 2 55 ARG QD 2 60 TYR QE . . 4.340 3.845 2.573 4.507 0.167 1 0 "[ . 1 . 2]" 1
2443 2 56 THR H 2 59 ASP QB . . 3.590 2.486 1.974 3.086 . 0 0 "[ . 1 . 2]" 1
2444 2 56 THR HB 2 57 LEU QD . . 5.250 4.659 3.879 5.201 . 0 0 "[ . 1 . 2]" 1
2445 2 56 THR HB 2 58 SER QB . . 3.760 3.465 2.999 3.853 0.093 17 0 "[ . 1 . 2]" 1
2446 2 56 THR MG 2 57 LEU QB . . 5.340 3.901 3.161 4.978 . 0 0 "[ . 1 . 2]" 1
2447 2 56 THR MG 2 58 SER QB . . 5.310 3.138 2.378 4.213 . 0 0 "[ . 1 . 2]" 1
2448 2 56 THR MG 2 59 ASP QB . . 4.380 3.867 3.562 4.378 . 0 0 "[ . 1 . 2]" 1
2449 2 57 LEU H 2 57 LEU QD . . 3.750 2.184 2.081 2.285 . 0 0 "[ . 1 . 2]" 1
2450 2 57 LEU HA 2 57 LEU QD . . 3.100 2.148 2.043 2.231 . 0 0 "[ . 1 . 2]" 1
2451 2 57 LEU HA 2 60 TYR QB . . 4.750 3.536 3.037 3.917 . 0 0 "[ . 1 . 2]" 1
2452 2 57 LEU QB 2 58 SER H . . 3.750 2.621 2.522 2.748 . 0 0 "[ . 1 . 2]" 1
2453 2 57 LEU QB 2 62 ILE H . . 4.970 3.829 3.638 4.058 . 0 0 "[ . 1 . 2]" 1
2454 2 57 LEU QB 2 62 ILE HB . . 4.110 2.561 2.250 3.074 . 0 0 "[ . 1 . 2]" 1
2455 2 57 LEU QD 2 58 SER H . . 5.300 3.923 3.831 4.032 . 0 0 "[ . 1 . 2]" 1
2456 2 57 LEU QD 2 59 ASP H . . 5.440 5.006 4.860 5.258 . 0 0 "[ . 1 . 2]" 1
2457 2 57 LEU QD 2 62 ILE MG . . 3.860 2.101 1.848 2.425 . 0 0 "[ . 1 . 2]" 1
2458 2 57 LEU QD 2 62 ILE MD . . 3.050 2.441 1.841 2.736 . 0 0 "[ . 1 . 2]" 1
2459 2 58 SER H 2 58 SER QB . . 3.210 2.300 2.252 2.547 . 0 0 "[ . 1 . 2]" 1
2460 2 58 SER QB 2 59 ASP H . . 3.540 2.854 2.652 3.019 . 0 0 "[ . 1 . 2]" 1
2461 2 58 SER QB 2 61 ASN H . . 5.200 4.660 4.349 4.829 . 0 0 "[ . 1 . 2]" 1
2462 2 59 ASP H 2 59 ASP QB . . 3.090 2.247 2.202 2.371 . 0 0 "[ . 1 . 2]" 1
2463 2 59 ASP QB 2 60 TYR H . . 3.680 2.860 2.674 3.086 . 0 0 "[ . 1 . 2]" 1
2464 2 60 TYR H 2 60 TYR QB . . 3.140 2.461 2.374 2.513 . 0 0 "[ . 1 . 2]" 1
2465 2 60 TYR QB 2 62 ILE H . . 5.030 3.432 3.092 3.826 . 0 0 "[ . 1 . 2]" 1
2466 2 60 TYR QB 2 62 ILE HB . . 5.040 4.463 3.867 4.826 . 0 0 "[ . 1 . 2]" 1
2467 2 60 TYR QB 2 62 ILE QG . . 4.610 2.321 1.756 3.653 . 0 0 "[ . 1 . 2]" 1
2468 2 60 TYR QB 2 62 ILE MD . . 3.860 2.291 1.783 2.814 . 0 0 "[ . 1 . 2]" 1
2469 2 60 TYR QD 2 62 ILE QG . . 5.070 3.746 3.057 5.055 . 0 0 "[ . 1 . 2]" 1
2470 2 61 ASN H 2 61 ASN QB . . 3.300 2.921 2.831 3.297 . 0 0 "[ . 1 . 2]" 1
2471 2 61 ASN QB 2 62 ILE H . . 3.970 4.014 3.861 4.079 0.109 5 0 "[ . 1 . 2]" 1
2472 2 62 ILE HA 2 62 ILE QG . . 3.560 2.680 2.229 2.901 . 0 0 "[ . 1 . 2]" 1
2473 2 62 ILE QG 2 63 GLN H . . 5.150 4.508 3.910 4.780 . 0 0 "[ . 1 . 2]" 1
2474 2 63 GLN QE 2 65 GLU H . . 5.060 5.083 4.906 5.204 0.144 18 0 "[ . 1 . 2]" 1
2475 2 64 LYS H 2 64 LYS QB . . 3.660 2.502 2.435 2.623 . 0 0 "[ . 1 . 2]" 1
2476 2 64 LYS QB 2 65 GLU H . . 3.910 2.939 2.731 3.208 . 0 0 "[ . 1 . 2]" 1
2477 2 64 LYS QG 2 65 GLU QB . . 4.290 3.633 3.292 4.276 . 0 0 "[ . 1 . 2]" 1
2478 2 68 LEU H 2 68 LEU QB . . 3.660 2.786 2.256 3.243 . 0 0 "[ . 1 . 2]" 1
2479 2 68 LEU H 2 68 LEU QD . . 4.770 2.381 1.798 4.044 . 0 0 "[ . 1 . 2]" 1
2480 2 68 LEU HA 2 68 LEU QD . . 3.570 3.046 2.176 3.443 . 0 0 "[ . 1 . 2]" 1
2481 2 68 LEU QD 2 69 ILE H . . 4.280 4.005 2.564 4.493 0.213 2 0 "[ . 1 . 2]" 1
2482 2 69 ILE H 2 69 ILE QG . . 4.650 3.072 2.116 4.126 . 0 0 "[ . 1 . 2]" 1
2483 2 69 ILE HA 2 70 LEU QB . . 4.300 4.137 3.942 4.414 0.114 7 0 "[ . 1 . 2]" 1
2484 2 69 ILE QG 2 71 LEU HA . . 4.710 4.632 4.025 5.073 0.363 17 0 "[ . 1 . 2]" 1
2485 2 70 LEU H 2 70 LEU QB . . 3.620 2.318 2.224 2.454 . 0 0 "[ . 1 . 2]" 1
2486 2 70 LEU H 2 71 LEU QD . . 4.880 4.406 3.681 5.147 0.267 2 0 "[ . 1 . 2]" 1
2487 2 71 LEU H 2 71 LEU QD . . 4.800 2.921 1.828 3.800 . 0 0 "[ . 1 . 2]" 1
2488 2 72 LEU H 2 72 LEU QD . . 4.020 2.542 1.852 3.785 . 0 0 "[ . 1 . 2]" 1
2489 2 72 LEU HA 2 72 LEU QD . . 3.680 2.561 1.982 3.452 . 0 0 "[ . 1 . 2]" 1
2490 2 72 LEU QB 2 72 LEU QD . . 2.800 2.003 1.980 2.108 . 0 0 "[ . 1 . 2]" 1
2491 2 72 LEU QB 2 73 THR H . . 4.260 2.726 2.178 3.788 . 0 0 "[ . 1 . 2]" 1
2492 2 72 LEU QD 2 73 THR H . . 4.640 3.559 2.364 4.444 . 0 0 "[ . 1 . 2]" 1
2493 2 73 THR HA 2 74 LEU QB . . 4.880 4.415 4.018 5.078 0.198 13 0 "[ . 1 . 2]" 1
2494 2 74 LEU H 2 74 LEU QD . . 4.470 3.541 1.955 4.196 . 0 0 "[ . 1 . 2]" 1
2495 2 74 LEU HA 2 74 LEU QD . . 3.830 2.257 1.985 3.406 . 0 0 "[ . 1 . 2]" 1
2496 2 75 ARG HA 2 75 ARG QD . . 4.750 3.320 2.005 4.648 . 0 0 "[ . 1 . 2]" 1
2497 3 7 GLY QA 3 8 MET QG . . 4.380 3.828 3.068 4.569 0.189 8 0 "[ . 1 . 2]" 1
2498 3 8 MET QB 3 9 ALA H . . 4.340 2.804 1.857 3.912 . 0 0 "[ . 1 . 2]" 1
2499 3 8 MET ME 3 8 MET QG . . 3.310 2.460 2.259 2.538 . 0 0 "[ . 1 . 2]" 1
2500 3 8 MET QG 3 9 ALA H . . 4.720 4.155 3.495 4.796 0.076 16 0 "[ . 1 . 2]" 1
2501 3 11 GLN QB 3 11 GLN QE . . 3.450 2.756 1.793 3.692 0.242 5 0 "[ . 1 . 2]" 1
2502 3 11 GLN QE 3 12 ALA HA . . 4.580 4.258 2.564 4.710 0.130 2 0 "[ . 1 . 2]" 1
2503 3 13 ASP H 3 13 ASP QB . . 3.140 2.458 2.188 2.907 . 0 0 "[ . 1 . 2]" 1
2504 3 13 ASP HA 3 17 GLU QG . . 3.990 3.600 2.990 4.200 0.210 18 0 "[ . 1 . 2]" 1
2505 3 14 GLN HA 3 17 GLU QG . . 4.630 3.760 2.136 4.741 0.111 4 0 "[ . 1 . 2]" 1
2506 3 14 GLN QB 3 14 GLN QE . . 3.950 3.044 1.800 3.752 . 0 0 "[ . 1 . 2]" 1
2507 3 16 GLU HA 3 19 LEU QD . . 3.750 2.857 2.179 3.805 0.055 17 0 "[ . 1 . 2]" 1
2508 3 17 GLU H 3 17 GLU QG . . 3.700 2.412 2.108 2.682 . 0 0 "[ . 1 . 2]" 1
2509 3 18 GLU QG 3 19 LEU QD . . 4.160 4.197 2.775 4.511 0.351 15 0 "[ . 1 . 2]" 1
2510 3 19 LEU H 3 19 LEU QB . . 3.580 2.375 2.123 2.593 . 0 0 "[ . 1 . 2]" 1
2511 3 19 LEU H 3 19 LEU QD . . 3.670 2.846 2.305 3.264 . 0 0 "[ . 1 . 2]" 1
2512 3 19 LEU H 3 55 LEU QD . . 3.880 3.570 3.099 3.900 0.020 14 0 "[ . 1 . 2]" 1
2513 3 19 LEU HA 3 19 LEU QD . . 3.960 2.099 2.009 2.320 . 0 0 "[ . 1 . 2]" 1
2514 3 19 LEU HA 3 22 PHE QB . . 4.750 2.476 2.111 2.773 . 0 0 "[ . 1 . 2]" 1
2515 3 19 LEU HA 3 55 LEU QD . . 3.970 3.718 3.288 4.047 0.077 14 0 "[ . 1 . 2]" 1
2516 3 19 LEU QB 3 20 LEU H . . 3.920 2.687 2.386 2.885 . 0 0 "[ . 1 . 2]" 1
2517 3 19 LEU QB 3 66 TYR QD . . 4.780 4.134 3.748 4.812 0.032 6 0 "[ . 1 . 2]" 1
2518 3 19 LEU QB 3 66 TYR QE . . 3.830 2.234 1.816 2.779 . 0 0 "[ . 1 . 2]" 1
2519 3 19 LEU QD 3 22 PHE QB . . 4.740 3.580 3.132 3.941 . 0 0 "[ . 1 . 2]" 1
2520 3 19 LEU QD 3 22 PHE QD . . 3.490 2.375 1.771 3.038 . 0 0 "[ . 1 . 2]" 1
2521 3 19 LEU QD 3 22 PHE QE . . 3.290 3.181 2.695 3.457 0.167 6 0 "[ . 1 . 2]" 1
2522 3 19 LEU QD 3 55 LEU QD . . 2.910 1.920 1.740 2.139 . 0 0 "[ . 1 . 2]" 1
2523 3 19 LEU QD 3 66 TYR QD . . 3.260 3.066 2.600 3.355 0.095 6 0 "[ . 1 . 2]" 1
2524 3 19 LEU QD 3 66 TYR QE . . 3.020 2.583 2.167 3.054 0.034 9 0 "[ . 1 . 2]" 1
2525 3 20 LEU H 3 20 LEU QB . . 3.410 2.222 2.175 2.259 . 0 0 "[ . 1 . 2]" 1
2526 3 20 LEU H 3 20 LEU QD . . 4.040 3.714 3.628 3.826 . 0 0 "[ . 1 . 2]" 1
2527 3 20 LEU H 3 23 TRP QB . . 4.930 4.628 4.410 4.903 . 0 0 "[ . 1 . 2]" 1
2528 3 20 LEU HA 3 23 TRP QB . . 3.710 2.377 2.131 2.695 . 0 0 "[ . 1 . 2]" 1
2529 3 20 LEU QB 3 21 LEU H . . 3.520 2.706 2.560 2.877 . 0 0 "[ . 1 . 2]" 1
2530 3 20 LEU QD 3 21 LEU H . . 3.600 3.645 3.514 3.748 0.148 8 0 "[ . 1 . 2]" 1
2531 3 20 LEU QD 3 23 TRP QB . . 3.930 2.726 2.426 3.579 . 0 0 "[ . 1 . 2]" 1
2532 3 20 LEU QD 3 23 TRP HD1 . . 3.110 2.499 2.102 3.275 0.165 16 0 "[ . 1 . 2]" 1
2533 3 20 LEU QD 3 24 THR H . . 4.090 3.567 3.412 3.698 . 0 0 "[ . 1 . 2]" 1
2534 3 21 LEU H 3 21 LEU QB . . 3.430 2.194 2.084 2.275 . 0 0 "[ . 1 . 2]" 1
2535 3 21 LEU H 3 21 LEU QD . . 3.770 3.765 3.711 3.827 0.057 18 0 "[ . 1 . 2]" 1
2536 3 21 LEU HA 3 21 LEU QD . . 4.050 2.108 1.897 2.322 . 0 0 "[ . 1 . 2]" 1
2537 3 21 LEU QB 3 22 PHE H . . 4.340 2.579 2.415 2.799 . 0 0 "[ . 1 . 2]" 1
2538 3 21 LEU QB 3 22 PHE HA . . 4.100 4.130 3.861 4.308 0.208 20 0 "[ . 1 . 2]" 1
2539 3 21 LEU QD 3 22 PHE H . . 4.170 3.731 2.961 4.098 . 0 0 "[ . 1 . 2]" 1
2540 3 21 LEU QD 3 22 PHE HA . . 4.150 3.924 2.778 4.398 0.248 14 0 "[ . 1 . 2]" 1
2541 3 21 LEU QD 3 25 TYR QD . . 3.820 3.384 2.084 3.962 0.142 13 0 "[ . 1 . 2]" 1
2542 3 21 LEU QD 3 25 TYR QE . . 3.530 2.533 2.172 3.025 . 0 0 "[ . 1 . 2]" 1
2543 3 22 PHE HA 3 25 TYR QB . . 4.630 2.839 2.321 3.195 . 0 0 "[ . 1 . 2]" 1
2544 3 22 PHE HA 3 45 LEU QD . . 4.470 3.131 2.391 3.822 . 0 0 "[ . 1 . 2]" 1
2545 3 22 PHE QB 3 45 LEU QD . . 3.880 2.091 1.822 2.669 . 0 0 "[ . 1 . 2]" 1
2546 3 22 PHE QE 3 45 LEU QD . . 3.950 3.864 3.403 4.119 0.169 5 0 "[ . 1 . 2]" 1
2547 3 22 PHE QE 3 55 LEU QD . . 3.650 1.881 1.730 2.165 . 0 0 "[ . 1 . 2]" 1
2548 3 23 TRP H 3 23 TRP QB . . 3.500 2.288 2.225 2.341 . 0 0 "[ . 1 . 2]" 1
2549 3 23 TRP QB 3 24 THR H . . 4.350 2.873 2.627 3.020 . 0 0 "[ . 1 . 2]" 1
2550 3 23 TRP HE3 3 70 LYS QE . . 5.040 3.237 2.785 3.627 . 0 0 "[ . 1 . 2]" 1
2551 3 23 TRP HE1 3 27 GLN QG . . 4.250 3.820 3.024 4.211 . 0 0 "[ . 1 . 2]" 1
2552 3 23 TRP HE1 3 27 GLN QE . . 3.960 2.707 1.971 3.642 . 0 0 "[ . 1 . 2]" 1
2553 3 23 TRP HE1 3 70 LYS QE . . 4.610 4.513 4.058 4.780 0.170 17 0 "[ . 1 . 2]" 1
2554 3 23 TRP HZ3 3 85 LEU QD . . 3.260 3.282 2.838 3.536 0.276 3 0 "[ . 1 . 2]" 1
2555 3 23 TRP HZ2 3 27 GLN QG . . 3.650 2.950 2.655 3.205 . 0 0 "[ . 1 . 2]" 1
2556 3 23 TRP HZ2 3 27 GLN QE . . 5.110 3.840 2.848 4.885 . 0 0 "[ . 1 . 2]" 1
2557 3 23 TRP HZ2 3 85 LEU QD . . 4.550 3.197 2.684 3.650 . 0 0 "[ . 1 . 2]" 1
2558 3 23 TRP HH2 3 27 GLN QG . . 3.600 3.698 3.461 3.911 0.311 16 0 "[ . 1 . 2]" 1
2559 3 23 TRP HH2 3 85 LEU QD . . 3.300 2.015 1.777 2.377 . 0 0 "[ . 1 . 2]" 1
2560 3 24 THR HA 3 27 GLN QB . . 4.790 2.987 2.230 4.744 . 0 0 "[ . 1 . 2]" 1
2561 3 24 THR HA 3 27 GLN QE . . 4.040 3.612 2.749 4.178 0.138 7 0 "[ . 1 . 2]" 1
2562 3 26 ILE HA 3 29 MET QB . . 4.210 3.413 1.852 4.240 0.030 16 0 "[ . 1 . 2]" 1
2563 3 26 ILE HA 3 29 MET QG . . 4.750 2.734 1.977 4.100 . 0 0 "[ . 1 . 2]" 1
2564 3 26 ILE HB 3 45 LEU QD . . 4.660 4.095 3.912 4.329 . 0 0 "[ . 1 . 2]" 1
2565 3 26 ILE MG 3 30 LEU QD . . 4.420 1.878 1.721 2.094 . 0 0 "[ . 1 . 2]" 1
2566 3 26 ILE MG 3 45 LEU QD . . 3.790 3.747 3.451 3.908 0.118 1 0 "[ . 1 . 2]" 1
2567 3 26 ILE QG 3 29 MET ME . . 5.290 4.775 3.905 5.378 0.088 4 0 "[ . 1 . 2]" 1
2568 3 26 ILE QG 3 45 LEU QD . . 4.900 2.019 1.786 2.266 . 0 0 "[ . 1 . 2]" 1
2569 3 26 ILE MD 3 30 LEU QD . . 3.990 4.144 3.866 4.330 0.340 13 0 "[ . 1 . 2]" 1
2570 3 26 ILE MD 3 70 LYS QE . . 4.830 4.693 4.272 4.960 0.130 14 0 "[ . 1 . 2]" 1
2571 3 27 GLN H 3 27 GLN QB . . 3.490 2.297 2.205 2.859 . 0 0 "[ . 1 . 2]" 1
2572 3 27 GLN H 3 27 GLN QG . . 3.870 3.657 1.934 4.007 0.137 15 0 "[ . 1 . 2]" 1
2573 3 27 GLN HA 3 27 GLN QG . . 3.600 2.479 2.365 3.451 . 0 0 "[ . 1 . 2]" 1
2574 3 27 GLN HA 3 85 LEU QD . . 3.350 2.036 1.742 2.541 . 0 0 "[ . 1 . 2]" 1
2575 3 27 GLN QB 3 28 ALA H . . 4.330 2.444 2.195 3.663 . 0 0 "[ . 1 . 2]" 1
2576 3 27 GLN QG 3 28 ALA H . . 4.880 3.858 2.958 4.156 . 0 0 "[ . 1 . 2]" 1
2577 3 29 MET H 3 29 MET QG . . 4.410 2.881 2.134 3.992 . 0 0 "[ . 1 . 2]" 1
2578 3 29 MET HA 3 32 ASN QD . . 5.570 4.407 2.892 5.684 0.114 3 0 "[ . 1 . 2]" 1
2579 3 29 MET QB 3 30 LEU H . . 4.100 3.053 2.162 3.610 . 0 0 "[ . 1 . 2]" 1
2580 3 29 MET QG 3 30 LEU H . . 5.590 2.596 1.912 3.591 . 0 0 "[ . 1 . 2]" 1
2581 3 29 MET QG 3 30 LEU HA . . 4.450 3.734 3.191 4.284 . 0 0 "[ . 1 . 2]" 1
2582 3 29 MET ME 3 44 MET QG . . 4.030 3.113 1.712 4.145 0.115 17 0 "[ . 1 . 2]" 1
2583 3 30 LEU HA 3 33 LEU QB . . 4.820 3.267 2.137 4.643 . 0 0 "[ . 1 . 2]" 1
2584 3 30 LEU QD 3 83 TYR HA . . 5.380 4.339 3.931 4.909 . 0 0 "[ . 1 . 2]" 1
2585 3 30 LEU QD 3 85 LEU QD . . 2.960 2.449 1.807 3.237 0.277 4 0 "[ . 1 . 2]" 1
2586 3 31 THR H 3 85 LEU QD . . 4.420 3.095 2.600 3.575 . 0 0 "[ . 1 . 2]" 1
2587 3 31 THR HA 3 85 LEU QD . . 3.730 2.998 2.235 3.855 0.125 9 0 "[ . 1 . 2]" 1
2588 3 31 THR HB 3 85 LEU QD . . 4.500 3.728 2.191 4.667 0.167 13 0 "[ . 1 . 2]" 1
2589 3 32 ASN H 3 32 ASN QB . . 3.460 2.664 2.411 3.218 . 0 0 "[ . 1 . 2]" 1
2590 3 32 ASN QB 3 33 LEU H . . 3.960 2.612 2.126 3.659 . 0 0 "[ . 1 . 2]" 1
2591 3 33 LEU H 3 33 LEU QB . . 3.410 2.473 2.153 3.002 . 0 0 "[ . 1 . 2]" 1
2592 3 33 LEU H 3 33 LEU QD . . 3.890 2.929 1.914 3.813 . 0 0 "[ . 1 . 2]" 1
2593 3 33 LEU HA 3 33 LEU QD . . 3.630 2.732 2.219 3.525 . 0 0 "[ . 1 . 2]" 1
2594 3 33 LEU QB 3 34 GLU H . . 3.850 3.828 2.341 3.995 0.145 20 0 "[ . 1 . 2]" 1
2595 3 34 GLU H 3 34 GLU QB . . 3.550 2.633 2.222 2.861 . 0 0 "[ . 1 . 2]" 1
2596 3 34 GLU HA 3 34 GLU QG . . 3.340 3.174 2.404 3.392 0.052 1 0 "[ . 1 . 2]" 1
2597 3 35 SER HA 3 82 VAL QG . . 4.890 3.285 2.499 4.860 . 0 0 "[ . 1 . 2]" 1
2598 3 35 SER HA 3 84 ARG QB . . 3.830 2.472 1.995 3.675 . 0 0 "[ . 1 . 2]" 1
2599 3 35 SER QB 3 36 LEU H . . 3.860 3.668 2.906 4.013 0.153 17 0 "[ . 1 . 2]" 1
2600 3 35 SER QB 3 36 LEU HG . . 4.820 4.856 4.045 5.057 0.237 17 0 "[ . 1 . 2]" 1
2601 3 35 SER QB 3 36 LEU QD . . 4.390 4.368 2.899 4.910 0.520 14 1 "[ . 1 +. 2]" 1
2602 3 35 SER QB 3 84 ARG QB . . 4.530 3.809 2.281 4.523 . 0 0 "[ . 1 . 2]" 1
2603 3 36 LEU H 3 36 LEU QD . . 3.390 3.066 2.146 3.600 0.210 7 0 "[ . 1 . 2]" 1
2604 3 36 LEU HA 3 36 LEU QD . . 3.540 2.972 1.998 3.521 . 0 0 "[ . 1 . 2]" 1
2605 3 36 LEU QB 3 37 SER QB . . 4.660 4.279 3.318 4.763 0.103 16 0 "[ . 1 . 2]" 1
2606 3 36 LEU QD 3 40 ARG QD . . 3.980 2.876 1.950 3.728 . 0 0 "[ . 1 . 2]" 1
2607 3 37 SER H 3 82 VAL QG . . 4.010 3.342 2.897 4.067 0.057 19 0 "[ . 1 . 2]" 1
2608 3 37 SER HA 3 38 LEU QB . . 4.640 4.143 3.929 4.239 . 0 0 "[ . 1 . 2]" 1
2609 3 37 SER HA 3 82 VAL QG . . 3.880 2.467 2.265 2.825 . 0 0 "[ . 1 . 2]" 1
2610 3 37 SER QB 3 38 LEU H . . 4.320 3.178 2.615 3.592 . 0 0 "[ . 1 . 2]" 1
2611 3 37 SER QB 3 39 ASP H . . 4.000 3.029 2.422 3.685 . 0 0 "[ . 1 . 2]" 1
2612 3 37 SER QB 3 40 ARG H . . 3.830 3.038 2.057 3.765 . 0 0 "[ . 1 . 2]" 1
2613 3 37 SER QB 3 40 ARG QD . . 4.210 3.360 2.236 4.251 0.041 9 0 "[ . 1 . 2]" 1
2614 3 37 SER QB 3 82 VAL QG . . 3.970 3.163 1.946 3.996 0.026 12 0 "[ . 1 . 2]" 1
2615 3 38 LEU H 3 38 LEU QB . . 3.490 2.208 2.086 2.273 . 0 0 "[ . 1 . 2]" 1
2616 3 38 LEU H 3 38 LEU QD . . 4.260 3.804 3.671 3.901 . 0 0 "[ . 1 . 2]" 1
2617 3 38 LEU H 3 82 VAL QG . . 4.050 4.160 3.892 4.360 0.310 9 0 "[ . 1 . 2]" 1
2618 3 38 LEU HA 3 38 LEU QD . . 3.930 2.367 2.105 2.789 . 0 0 "[ . 1 . 2]" 1
2619 3 38 LEU HA 3 41 ILE QG . . 4.730 3.294 2.264 4.977 0.247 13 0 "[ . 1 . 2]" 1
2620 3 38 LEU QB 3 39 ASP H . . 4.390 2.798 2.556 3.067 . 0 0 "[ . 1 . 2]" 1
2621 3 38 LEU QB 3 83 TYR QD . . 3.720 2.802 2.115 3.359 . 0 0 "[ . 1 . 2]" 1
2622 3 38 LEU QB 3 83 TYR QE . . 3.660 2.137 1.756 2.942 . 0 0 "[ . 1 . 2]" 1
2623 3 38 LEU HG 3 42 TYR QB . . 4.930 3.730 2.712 5.034 0.104 20 0 "[ . 1 . 2]" 1
2624 3 38 LEU QD 3 39 ASP H . . 4.680 3.950 3.714 4.170 . 0 0 "[ . 1 . 2]" 1
2625 3 38 LEU QD 3 42 TYR H . . 4.220 3.143 2.522 3.502 . 0 0 "[ . 1 . 2]" 1
2626 3 38 LEU QD 3 42 TYR HA . . 4.970 3.707 3.264 4.136 . 0 0 "[ . 1 . 2]" 1
2627 3 38 LEU QD 3 67 LEU QD . . 3.060 2.039 1.763 2.708 . 0 0 "[ . 1 . 2]" 1
2628 3 38 LEU QD 3 83 TYR QD . . 3.400 3.199 2.463 3.504 0.104 8 0 "[ . 1 . 2]" 1
2629 3 38 LEU QD 3 83 TYR QE . . 3.200 1.846 1.722 2.061 . 0 0 "[ . 1 . 2]" 1
2630 3 39 ASP HA 3 42 TYR QB . . 3.690 2.568 2.173 2.968 . 0 0 "[ . 1 . 2]" 1
2631 3 41 ILE H 3 41 ILE QG . . 4.450 2.716 1.776 4.166 . 0 0 "[ . 1 . 2]" 1
2632 3 41 ILE QG 3 42 TYR H . . 4.040 3.236 2.471 4.171 0.131 20 0 "[ . 1 . 2]" 1
2633 3 41 ILE MD 3 42 TYR QB . . 3.780 3.362 2.953 3.925 0.145 19 0 "[ . 1 . 2]" 1
2634 3 42 TYR H 3 45 LEU QB . . 5.340 4.945 4.688 5.336 . 0 0 "[ . 1 . 2]" 1
2635 3 42 TYR HA 3 45 LEU QB . . 4.280 2.888 2.592 3.384 . 0 0 "[ . 1 . 2]" 1
2636 3 42 TYR HA 3 45 LEU QD . . 4.740 3.618 2.998 4.272 . 0 0 "[ . 1 . 2]" 1
2637 3 42 TYR HA 3 63 LEU QD . . 4.300 2.211 1.799 2.635 . 0 0 "[ . 1 . 2]" 1
2638 3 42 TYR QB 3 63 LEU HG . . 5.070 3.582 2.411 5.259 0.189 16 0 "[ . 1 . 2]" 1
2639 3 42 TYR QB 3 63 LEU QD . . 3.950 2.722 2.368 3.118 . 0 0 "[ . 1 . 2]" 1
2640 3 42 TYR QD 3 60 LEU QD . . 3.330 2.902 2.765 3.309 . 0 0 "[ . 1 . 2]" 1
2641 3 42 TYR QD 3 63 LEU QD . . 3.630 2.399 1.732 2.997 . 0 0 "[ . 1 . 2]" 1
2642 3 42 TYR QE 3 43 ASN QD . . 5.300 4.220 3.094 5.434 0.134 16 0 "[ . 1 . 2]" 1
2643 3 42 TYR QE 3 46 ARG QG . . 5.570 3.319 2.907 4.272 . 0 0 "[ . 1 . 2]" 1
2644 3 42 TYR QE 3 60 LEU QD . . 3.260 2.235 1.943 2.698 . 0 0 "[ . 1 . 2]" 1
2645 3 42 TYR QE 3 63 LEU QD . . 4.100 3.590 3.106 4.146 0.046 19 0 "[ . 1 . 2]" 1
2646 3 43 ASN H 3 43 ASN QB . . 3.590 2.350 2.158 2.552 . 0 0 "[ . 1 . 2]" 1
2647 3 43 ASN H 3 43 ASN QD . . 3.800 3.145 2.063 4.140 0.340 11 0 "[ . 1 . 2]" 1
2648 3 43 ASN HA 3 43 ASN QD . . 4.240 3.037 1.792 4.102 . 0 0 "[ . 1 . 2]" 1
2649 3 44 MET H 3 44 MET QG . . 4.690 2.421 2.181 3.957 . 0 0 "[ . 1 . 2]" 1
2650 3 44 MET ME 3 44 MET QG . . 3.420 2.505 2.425 2.664 . 0 0 "[ . 1 . 2]" 1
2651 3 44 MET QG 3 45 LEU H . . 4.140 3.866 2.179 4.150 0.010 10 0 "[ . 1 . 2]" 1
2652 3 45 LEU H 3 45 LEU QB . . 3.220 2.289 2.139 2.605 . 0 0 "[ . 1 . 2]" 1
2653 3 45 LEU H 3 45 LEU QD . . 4.410 2.473 2.092 3.412 . 0 0 "[ . 1 . 2]" 1
2654 3 45 LEU HA 3 45 LEU QD . . 3.340 2.242 2.001 2.570 . 0 0 "[ . 1 . 2]" 1
2655 3 45 LEU QD 3 46 ARG HA . . 5.380 5.244 4.659 5.390 0.010 4 0 "[ . 1 . 2]" 1
2656 3 45 LEU QD 3 48 PHE QD . . 5.020 2.891 2.310 3.940 . 0 0 "[ . 1 . 2]" 1
2657 3 46 ARG H 3 46 ARG QG . . 4.010 3.422 2.414 4.090 0.080 8 0 "[ . 1 . 2]" 1
2658 3 46 ARG HA 3 49 VAL QG . . 3.570 1.982 1.747 2.859 . 0 0 "[ . 1 . 2]" 1
2659 3 46 ARG QG 3 47 MET H . . 4.230 3.995 3.506 4.314 0.084 5 0 "[ . 1 . 2]" 1
2660 3 47 MET HA 3 50 VAL QG . . 4.710 2.131 1.914 2.414 . 0 0 "[ . 1 . 2]" 1
2661 3 47 MET QB 3 50 VAL QG . . 4.000 3.802 3.365 4.044 0.044 12 0 "[ . 1 . 2]" 1
2662 3 48 PHE H 3 49 VAL QG . . 5.200 4.275 3.879 4.624 . 0 0 "[ . 1 . 2]" 1
2663 3 48 PHE QB 3 49 VAL H . . 4.000 2.898 2.699 3.280 . 0 0 "[ . 1 . 2]" 1
2664 3 49 VAL H 3 49 VAL QG . . 3.460 2.398 1.971 2.775 . 0 0 "[ . 1 . 2]" 1
2665 3 49 VAL HA 3 55 LEU QD . . 4.600 4.685 4.000 4.896 0.296 18 0 "[ . 1 . 2]" 1
2666 3 49 VAL HB 3 55 LEU QD . . 4.690 4.369 3.713 4.871 0.181 9 0 "[ . 1 . 2]" 1
2667 3 49 VAL QG 3 50 VAL H . . 4.640 2.513 2.243 3.451 . 0 0 "[ . 1 . 2]" 1
2668 3 49 VAL QG 3 51 THR H . . 5.010 4.310 4.189 4.775 . 0 0 "[ . 1 . 2]" 1
2669 3 49 VAL QG 3 55 LEU QD . . 3.520 2.659 2.155 3.016 . 0 0 "[ . 1 . 2]" 1
2670 3 49 VAL QG 3 57 GLU HA . . 3.780 2.040 1.795 2.397 . 0 0 "[ . 1 . 2]" 1
2671 3 49 VAL QG 3 57 GLU QB . . 4.060 3.219 2.525 3.803 . 0 0 "[ . 1 . 2]" 1
2672 3 50 VAL H 3 50 VAL QG . . 3.210 2.166 1.970 2.327 . 0 0 "[ . 1 . 2]" 1
2673 3 50 VAL HA 3 50 VAL QG . . 3.120 2.289 2.244 2.360 . 0 0 "[ . 1 . 2]" 1
2674 3 50 VAL QG 3 51 THR H . . 4.000 2.466 2.326 2.619 . 0 0 "[ . 1 . 2]" 1
2675 3 50 VAL QG 3 51 THR HB . . 4.710 4.629 4.412 4.812 0.102 3 0 "[ . 1 . 2]" 1
2676 3 50 VAL QG 3 51 THR MG . . 3.180 2.612 2.348 2.854 . 0 0 "[ . 1 . 2]" 1
2677 3 50 VAL QG 3 52 GLY H . . 4.080 4.160 4.096 4.217 0.137 17 0 "[ . 1 . 2]" 1
2678 3 51 THR HB 3 52 GLY QA . . 4.170 4.246 4.189 4.296 0.126 19 0 "[ . 1 . 2]" 1
2679 3 52 GLY QA 3 53 PRO HA . . 4.170 4.139 4.085 4.257 0.087 7 0 "[ . 1 . 2]" 1
2680 3 52 GLY QA 3 53 PRO QG . . 4.230 3.815 3.694 3.877 . 0 0 "[ . 1 . 2]" 1
2681 3 52 GLY QA 3 53 PRO QD . . 3.010 2.121 2.014 2.177 . 0 0 "[ . 1 . 2]" 1
2682 3 53 PRO QD 3 54 ALA H . . 3.450 2.859 2.383 3.367 . 0 0 "[ . 1 . 2]" 1
2683 3 54 ALA HA 3 55 LEU QD . . 4.560 3.963 2.829 4.609 0.049 16 0 "[ . 1 . 2]" 1
2684 3 55 LEU H 3 55 LEU QD . . 3.930 3.112 2.271 3.741 . 0 0 "[ . 1 . 2]" 1
2685 3 58 ILE H 3 58 ILE QG . . 3.720 2.094 1.781 3.902 0.182 20 0 "[ . 1 . 2]" 1
2686 3 58 ILE HA 3 58 ILE QG . . 3.370 3.319 2.296 3.392 0.022 15 0 "[ . 1 . 2]" 1
2687 3 58 ILE QG 3 59 ASP H . . 4.050 3.481 2.692 3.750 . 0 0 "[ . 1 . 2]" 1
2688 3 59 ASP H 3 59 ASP QB . . 3.270 2.547 2.391 2.913 . 0 0 "[ . 1 . 2]" 1
2689 3 59 ASP H 3 62 GLU QG . . 4.480 2.976 2.090 3.860 . 0 0 "[ . 1 . 2]" 1
2690 3 59 ASP QB 3 60 LEU H . . 3.610 3.148 2.137 3.347 . 0 0 "[ . 1 . 2]" 1
2691 3 60 LEU H 3 60 LEU QD . . 3.960 2.185 1.966 3.098 . 0 0 "[ . 1 . 2]" 1
2692 3 60 LEU HA 3 60 LEU QD . . 3.360 2.001 1.930 2.058 . 0 0 "[ . 1 . 2]" 1
2693 3 60 LEU HA 3 63 LEU QB . . 4.210 2.707 2.271 3.323 . 0 0 "[ . 1 . 2]" 1
2694 3 60 LEU HA 3 64 GLN QB . . 4.450 4.126 3.800 4.467 0.017 3 0 "[ . 1 . 2]" 1
2695 3 60 LEU QB 3 61 GLN H . . 3.390 2.662 2.288 2.977 . 0 0 "[ . 1 . 2]" 1
2696 3 60 LEU QB 3 61 GLN QG . . 3.960 4.053 3.732 4.891 0.931 9 1 "[ . +1 . 2]" 1
2697 3 60 LEU QB 3 62 GLU H . . 4.950 4.700 4.430 5.004 0.054 9 0 "[ . 1 . 2]" 1
2698 3 60 LEU QB 3 64 GLN H . . 4.490 4.435 3.979 4.750 0.260 1 0 "[ . 1 . 2]" 1
2699 3 60 LEU QB 3 64 GLN QB . . 3.710 3.769 3.345 3.921 0.211 3 0 "[ . 1 . 2]" 1
2700 3 60 LEU QD 3 63 LEU H . . 5.150 4.591 4.327 5.028 . 0 0 "[ . 1 . 2]" 1
2701 3 60 LEU QD 3 64 GLN QB . . 4.330 3.783 2.271 4.223 . 0 0 "[ . 1 . 2]" 1
2702 3 61 GLN H 3 61 GLN QB . . 3.330 2.654 2.107 2.903 . 0 0 "[ . 1 . 2]" 1
2703 3 61 GLN HA 3 64 GLN QB . . 4.690 2.942 2.057 4.729 0.039 20 0 "[ . 1 . 2]" 1
2704 3 61 GLN HA 3 64 GLN QG . . 4.340 4.005 2.273 4.519 0.179 10 0 "[ . 1 . 2]" 1
2705 3 61 GLN QE 3 62 GLU QB . . 4.270 3.549 1.931 4.561 0.291 10 0 "[ . 1 . 2]" 1
2706 3 61 GLN QE 3 62 GLU QG . . 3.940 3.285 2.109 4.228 0.288 3 0 "[ . 1 . 2]" 1
2707 3 62 GLU H 3 62 GLU QB . . 2.960 2.352 2.134 2.585 . 0 0 "[ . 1 . 2]" 1
2708 3 62 GLU HA 3 62 GLU QG . . 3.370 2.889 2.357 3.227 . 0 0 "[ . 1 . 2]" 1
2709 3 62 GLU QG 3 63 LEU H . . 4.070 4.011 3.602 4.287 0.217 5 0 "[ . 1 . 2]" 1
2710 3 63 LEU H 3 63 LEU QD . . 3.710 3.551 3.279 3.784 0.074 1 0 "[ . 1 . 2]" 1
2711 3 63 LEU HA 3 63 LEU QD . . 3.520 2.160 1.900 3.094 . 0 0 "[ . 1 . 2]" 1
2712 3 63 LEU HA 3 66 TYR QB . . 4.390 2.705 2.456 2.954 . 0 0 "[ . 1 . 2]" 1
2713 3 63 LEU QD 3 64 GLN H . . 3.650 3.530 3.166 3.728 0.078 12 0 "[ . 1 . 2]" 1
2714 3 63 LEU QD 3 64 GLN HA . . 3.640 3.720 3.276 3.913 0.273 15 0 "[ . 1 . 2]" 1
2715 3 63 LEU QD 3 65 GLY H . . 5.170 5.026 4.838 5.184 0.014 1 0 "[ . 1 . 2]" 1
2716 3 63 LEU QD 3 67 LEU H . . 4.560 3.819 3.496 4.231 . 0 0 "[ . 1 . 2]" 1
2717 3 64 GLN H 3 64 GLN QB . . 3.670 2.238 2.146 2.630 . 0 0 "[ . 1 . 2]" 1
2718 3 64 GLN H 3 64 GLN QG . . 3.780 3.694 1.966 3.960 0.180 14 0 "[ . 1 . 2]" 1
2719 3 64 GLN H 3 65 GLY QA . . 4.760 4.608 4.446 4.737 . 0 0 "[ . 1 . 2]" 1
2720 3 64 GLN HA 3 64 GLN QG . . 3.460 2.748 2.493 3.397 . 0 0 "[ . 1 . 2]" 1
2721 3 64 GLN HA 3 67 LEU QD . . 4.700 2.839 1.820 4.206 . 0 0 "[ . 1 . 2]" 1
2722 3 64 GLN QG 3 65 GLY H . . 3.700 3.144 2.365 3.723 0.023 3 0 "[ . 1 . 2]" 1
2723 3 65 GLY QA 3 68 GLN H . . 4.620 3.525 3.275 4.007 . 0 0 "[ . 1 . 2]" 1
2724 3 65 GLY QA 3 68 GLN QB . . 4.620 2.735 1.991 4.042 . 0 0 "[ . 1 . 2]" 1
2725 3 65 GLY QA 3 68 GLN QG . . 4.620 3.430 1.963 4.343 . 0 0 "[ . 1 . 2]" 1
2726 3 65 GLY QA 3 69 LYS H . . 4.620 3.796 3.635 3.885 . 0 0 "[ . 1 . 2]" 1
2727 3 66 TYR HA 3 69 LYS QB . . 4.210 2.908 2.719 3.102 . 0 0 "[ . 1 . 2]" 1
2728 3 67 LEU H 3 67 LEU QD . . 3.700 2.675 2.097 3.781 0.081 17 0 "[ . 1 . 2]" 1
2729 3 67 LEU HA 3 67 LEU QD . . 3.210 2.144 1.895 2.845 . 0 0 "[ . 1 . 2]" 1
2730 3 67 LEU HA 3 70 LYS QG . . 4.690 3.125 2.667 3.855 . 0 0 "[ . 1 . 2]" 1
2731 3 67 LEU HA 3 76 LEU QD . . 4.420 3.394 2.777 4.288 . 0 0 "[ . 1 . 2]" 1
2732 3 67 LEU QB 3 68 GLN H . . 3.880 2.573 2.392 2.838 . 0 0 "[ . 1 . 2]" 1
2733 3 67 LEU QB 3 83 TYR QE . . 4.800 2.782 2.326 4.114 . 0 0 "[ . 1 . 2]" 1
2734 3 67 LEU QD 3 68 GLN H . . 4.410 3.964 3.689 4.221 . 0 0 "[ . 1 . 2]" 1
2735 3 67 LEU QD 3 71 VAL H . . 4.980 4.865 3.789 5.160 0.180 3 0 "[ . 1 . 2]" 1
2736 3 67 LEU QD 3 76 LEU QB . . 5.320 3.809 3.200 4.375 . 0 0 "[ . 1 . 2]" 1
2737 3 67 LEU QD 3 76 LEU QD . . 3.100 2.348 1.801 2.897 . 0 0 "[ . 1 . 2]" 1
2738 3 68 GLN HA 3 71 VAL QG . . 3.430 3.002 2.197 3.443 0.013 20 0 "[ . 1 . 2]" 1
2739 3 68 GLN QE 3 69 LYS QD . . 4.690 4.353 3.745 4.856 0.166 14 0 "[ . 1 . 2]" 1
2740 3 68 GLN QE 3 72 ARG H . . 5.340 5.069 3.642 5.564 0.224 9 0 "[ . 1 . 2]" 1
2741 3 69 LYS H 3 69 LYS QB . . 3.200 2.218 2.076 2.324 . 0 0 "[ . 1 . 2]" 1
2742 3 69 LYS H 3 69 LYS QG . . 4.420 3.891 3.492 4.121 . 0 0 "[ . 1 . 2]" 1
2743 3 69 LYS HA 3 69 LYS QG . . 3.310 2.787 2.437 3.246 . 0 0 "[ . 1 . 2]" 1
2744 3 69 LYS QB 3 69 LYS QD . . 3.430 2.599 2.341 2.921 . 0 0 "[ . 1 . 2]" 1
2745 3 69 LYS QB 3 70 LYS H . . 3.560 2.457 2.287 2.694 . 0 0 "[ . 1 . 2]" 1
2746 3 69 LYS QE 3 69 LYS QG . . 3.210 2.436 2.158 2.833 . 0 0 "[ . 1 . 2]" 1
2747 3 69 LYS QG 3 70 LYS H . . 4.370 3.896 2.875 4.556 0.186 6 0 "[ . 1 . 2]" 1
2748 3 70 LYS H 3 70 LYS QG . . 3.710 2.419 2.137 3.953 0.243 15 0 "[ . 1 . 2]" 1
2749 3 70 LYS H 3 70 LYS QD . . 3.910 3.225 2.468 3.927 0.017 15 0 "[ . 1 . 2]" 1
2750 3 70 LYS H 3 70 LYS QE . . 4.380 4.139 3.957 4.515 0.135 1 0 "[ . 1 . 2]" 1
2751 3 70 LYS HA 3 70 LYS QD . . 3.540 2.032 1.943 2.128 . 0 0 "[ . 1 . 2]" 1
2752 3 70 LYS HA 3 70 LYS QE . . 4.420 4.048 3.775 4.152 . 0 0 "[ . 1 . 2]" 1
2753 3 70 LYS QB 3 71 VAL H . . 3.300 2.716 2.450 2.944 . 0 0 "[ . 1 . 2]" 1
2754 3 70 LYS QB 3 71 VAL QG . . 4.130 3.266 2.980 3.496 . 0 0 "[ . 1 . 2]" 1
2755 3 70 LYS QB 3 75 GLN QG . . 3.810 3.376 2.986 4.005 0.195 15 0 "[ . 1 . 2]" 1
2756 3 70 LYS QG 3 75 GLN QG . . 3.930 3.759 2.205 4.237 0.307 18 0 "[ . 1 . 2]" 1
2757 3 70 LYS QD 3 73 ASP QB . . 3.980 3.295 2.949 3.734 . 0 0 "[ . 1 . 2]" 1
2758 3 70 LYS QD 3 75 GLN H . . 4.820 4.739 4.448 5.002 0.182 8 0 "[ . 1 . 2]" 1
2759 3 70 LYS QD 3 75 GLN QB . . 4.780 2.776 2.418 3.940 . 0 0 "[ . 1 . 2]" 1
2760 3 70 LYS QD 3 75 GLN QG . . 3.250 2.445 1.857 3.286 0.036 6 0 "[ . 1 . 2]" 1
2761 3 70 LYS QD 3 75 GLN QE . . 4.390 3.869 2.230 4.508 0.118 6 0 "[ . 1 . 2]" 1
2762 3 70 LYS QE 3 75 GLN QE . . 5.390 4.974 3.523 5.494 0.104 10 0 "[ . 1 . 2]" 1
2763 3 71 VAL H 3 71 VAL QG . . 3.180 2.233 2.042 2.377 . 0 0 "[ . 1 . 2]" 1
2764 3 71 VAL H 3 76 LEU QD . . 4.830 4.224 3.115 4.735 . 0 0 "[ . 1 . 2]" 1
2765 3 71 VAL HA 3 71 VAL QG . . 2.960 2.194 2.185 2.205 . 0 0 "[ . 1 . 2]" 1
2766 3 71 VAL HA 3 76 LEU QD . . 4.860 4.285 3.658 4.845 . 0 0 "[ . 1 . 2]" 1
2767 3 71 VAL QG 3 72 ARG H . . 3.590 3.192 3.109 3.331 . 0 0 "[ . 1 . 2]" 1
2768 3 71 VAL QG 3 72 ARG HA . . 3.550 3.488 3.341 3.602 0.052 13 0 "[ . 1 . 2]" 1
2769 3 71 VAL QG 3 73 ASP H . . 5.130 4.445 4.370 4.720 . 0 0 "[ . 1 . 2]" 1
2770 3 71 VAL QG 3 74 GLN H . . 4.620 4.398 4.206 4.678 0.058 2 0 "[ . 1 . 2]" 1
2771 3 71 VAL QG 3 76 LEU H . . 4.720 3.942 3.837 4.099 . 0 0 "[ . 1 . 2]" 1
2772 3 71 VAL QG 3 78 TYR H . . 4.910 2.924 2.222 3.811 . 0 0 "[ . 1 . 2]" 1
2773 3 71 VAL QG 3 78 TYR QB . . 3.630 2.214 1.796 2.844 . 0 0 "[ . 1 . 2]" 1
2774 3 71 VAL MG1 3 78 TYR HB3 . . 5.970 3.267 2.464 4.429 . 0 0 "[ . 1 . 2]" 1
2775 3 71 VAL MG2 3 78 TYR HB3 . . 5.970 3.723 3.105 4.554 . 0 0 "[ . 1 . 2]" 1
2776 3 71 VAL QG 3 78 TYR QD . . 3.930 3.347 3.058 3.695 . 0 0 "[ . 1 . 2]" 1
2777 3 71 VAL QG 3 78 TYR QE . . 4.610 4.620 4.281 4.751 0.141 7 0 "[ . 1 . 2]" 1
2778 3 71 VAL QG 3 83 TYR QD . . 4.030 2.947 2.615 3.775 . 0 0 "[ . 1 . 2]" 1
2779 3 71 VAL QG 3 83 TYR QE . . 3.630 2.098 1.736 2.638 . 0 0 "[ . 1 . 2]" 1
2780 3 72 ARG H 3 72 ARG QG . . 3.460 2.596 2.246 3.626 0.166 3 0 "[ . 1 . 2]" 1
2781 3 72 ARG HA 3 72 ARG QG . . 3.320 2.568 2.396 3.264 . 0 0 "[ . 1 . 2]" 1
2782 3 72 ARG HA 3 74 GLN QE . . 3.990 3.426 2.946 4.006 0.016 5 0 "[ . 1 . 2]" 1
2783 3 72 ARG QB 3 74 GLN QE . . 4.690 4.177 4.003 4.435 . 0 0 "[ . 1 . 2]" 1
2784 3 73 ASP H 3 73 ASP QB . . 2.970 2.276 2.194 2.367 . 0 0 "[ . 1 . 2]" 1
2785 3 73 ASP HA 3 74 GLN QB . . 4.810 4.516 4.378 4.636 . 0 0 "[ . 1 . 2]" 1
2786 3 73 ASP QB 3 74 GLN H . . 4.240 3.408 3.280 3.619 . 0 0 "[ . 1 . 2]" 1
2787 3 74 GLN H 3 74 GLN QE . . 4.850 2.605 2.207 3.766 . 0 0 "[ . 1 . 2]" 1
2788 3 74 GLN HA 3 74 GLN QE . . 4.590 3.553 3.100 4.465 . 0 0 "[ . 1 . 2]" 1
2789 3 75 GLN HA 3 85 LEU QD . . 5.300 4.394 3.790 5.202 . 0 0 "[ . 1 . 2]" 1
2790 3 75 GLN HA 3 86 PRO QG . . 4.220 3.698 2.751 4.286 0.066 11 0 "[ . 1 . 2]" 1
2791 3 76 LEU HA 3 76 LEU QD . . 3.330 2.207 1.906 2.585 . 0 0 "[ . 1 . 2]" 1
2792 3 76 LEU HA 3 86 PRO QG . . 3.870 3.795 3.491 4.077 0.207 9 0 "[ . 1 . 2]" 1
2793 3 76 LEU QD 3 77 VAL H . . 4.410 2.145 1.781 2.839 . 0 0 "[ . 1 . 2]" 1
2794 3 76 LEU QD 3 83 TYR HA . . 5.280 3.060 2.708 3.493 . 0 0 "[ . 1 . 2]" 1
2795 3 76 LEU QD 3 83 TYR QB . . 3.830 1.968 1.743 2.172 . 0 0 "[ . 1 . 2]" 1
2796 3 76 LEU MD1 3 83 TYR HB2 . . 6.200 3.756 3.280 4.337 . 0 0 "[ . 1 . 2]" 1
2797 3 76 LEU QD 3 83 TYR QD . . 3.300 2.277 1.764 3.080 . 0 0 "[ . 1 . 2]" 1
2798 3 76 LEU QD 3 83 TYR QE . . 5.050 3.766 3.140 4.416 . 0 0 "[ . 1 . 2]" 1
2799 3 76 LEU QD 3 86 PRO QD . . 4.540 3.242 2.877 3.548 . 0 0 "[ . 1 . 2]" 1
2800 3 77 VAL H 3 77 VAL QG . . 3.190 2.657 2.091 2.879 . 0 0 "[ . 1 . 2]" 1
2801 3 77 VAL HA 3 77 VAL QG . . 3.150 2.214 2.175 2.412 . 0 0 "[ . 1 . 2]" 1
2802 3 77 VAL HA 3 86 PRO QG . . 4.680 4.708 4.420 4.850 0.170 6 0 "[ . 1 . 2]" 1
2803 3 77 VAL QG 3 78 TYR H . . 3.030 2.804 2.429 3.210 0.180 10 0 "[ . 1 . 2]" 1
2804 3 77 VAL QG 3 78 TYR HA . . 4.730 3.733 3.457 4.138 . 0 0 "[ . 1 . 2]" 1
2805 3 77 VAL QG 3 79 SER QB . . 3.680 3.361 2.621 3.829 0.149 10 0 "[ . 1 . 2]" 1
2806 3 77 VAL QG 3 84 ARG H . . 4.880 3.835 2.938 4.225 . 0 0 "[ . 1 . 2]" 1
2807 3 77 VAL QG 3 84 ARG QB . . 4.800 3.912 1.866 4.576 . 0 0 "[ . 1 . 2]" 1
2808 3 77 VAL QG 3 84 ARG QG . . 3.520 2.595 2.089 3.425 . 0 0 "[ . 1 . 2]" 1
2809 3 77 VAL QG 3 84 ARG QD . . 3.430 3.024 2.205 3.628 0.198 10 0 "[ . 1 . 2]" 1
2810 3 78 TYR H 3 78 TYR QB . . 3.390 2.358 2.282 2.457 . 0 0 "[ . 1 . 2]" 1
2811 3 78 TYR HA 3 79 SER QB . . 4.460 4.191 4.076 4.479 0.019 2 0 "[ . 1 . 2]" 1
2812 3 78 TYR QB 3 79 SER H . . 4.080 3.953 3.732 3.991 . 0 0 "[ . 1 . 2]" 1
2813 3 78 TYR QB 3 81 GLY H . . 5.060 5.232 5.099 5.345 0.285 19 0 "[ . 1 . 2]" 1
2814 3 78 TYR QB 3 83 TYR QD . . 4.160 3.483 3.085 4.087 . 0 0 "[ . 1 . 2]" 1
2815 3 78 TYR QD 3 81 GLY QA . . 3.810 3.997 3.884 4.060 0.250 14 0 "[ . 1 . 2]" 1
2816 3 78 TYR QE 3 81 GLY QA . . 3.220 2.454 2.309 2.571 . 0 0 "[ . 1 . 2]" 1
2817 3 78 TYR QE 3 82 VAL QG . . 4.890 4.409 4.199 4.638 . 0 0 "[ . 1 . 2]" 1
2818 3 79 SER H 3 79 SER QB . . 3.290 2.322 2.234 2.903 . 0 0 "[ . 1 . 2]" 1
2819 3 79 SER QB 3 82 VAL H . . 4.460 3.358 3.050 4.334 . 0 0 "[ . 1 . 2]" 1
2820 3 80 ALA H 3 82 VAL QG . . 4.760 2.989 2.542 4.071 . 0 0 "[ . 1 . 2]" 1
2821 3 80 ALA HA 3 81 GLY QA . . 4.720 3.918 3.872 3.963 . 0 0 "[ . 1 . 2]" 1
2822 3 80 ALA MB 3 82 VAL QG . . 4.450 3.321 2.999 3.717 . 0 0 "[ . 1 . 2]" 1
2823 3 81 GLY H 3 82 VAL QG . . 4.300 3.866 3.639 4.329 0.029 2 0 "[ . 1 . 2]" 1
2824 3 81 GLY QA 3 82 VAL HA . . 4.640 4.058 4.027 4.090 . 0 0 "[ . 1 . 2]" 1
2825 3 82 VAL H 3 82 VAL QG . . 3.270 2.331 2.229 2.975 . 0 0 "[ . 1 . 2]" 1
2826 3 82 VAL HA 3 83 TYR QB . . 4.690 4.354 4.247 4.593 . 0 0 "[ . 1 . 2]" 1
2827 3 82 VAL QG 3 83 TYR H . . 3.430 3.013 2.375 3.423 . 0 0 "[ . 1 . 2]" 1
2828 3 82 VAL QG 3 83 TYR HA . . 4.770 3.871 3.704 4.052 . 0 0 "[ . 1 . 2]" 1
2829 3 83 TYR QB 3 84 ARG H . . 4.130 2.901 2.738 3.105 . 0 0 "[ . 1 . 2]" 1
2830 3 84 ARG H 3 84 ARG QB . . 3.540 3.131 2.543 3.321 . 0 0 "[ . 1 . 2]" 1
2831 3 84 ARG H 3 84 ARG QG . . 3.870 2.878 2.581 3.991 0.121 11 0 "[ . 1 . 2]" 1
2832 3 84 ARG QB 3 84 ARG QD . . 3.400 2.279 2.088 2.774 . 0 0 "[ . 1 . 2]" 1
2833 3 84 ARG QB 3 85 LEU H . . 3.590 3.011 2.480 3.734 0.144 11 0 "[ . 1 . 2]" 1
2834 3 85 LEU H 3 85 LEU QB . . 3.490 2.270 2.085 2.434 . 0 0 "[ . 1 . 2]" 1
2835 3 85 LEU H 3 85 LEU QD . . 3.350 3.310 2.704 3.620 0.270 3 0 "[ . 1 . 2]" 1
2836 3 85 LEU HA 3 85 LEU QD . . 3.160 1.944 1.823 2.218 . 0 0 "[ . 1 . 2]" 1
2837 3 85 LEU HA 3 86 PRO QG . . 4.060 3.949 3.848 4.017 . 0 0 "[ . 1 . 2]" 1
2838 3 85 LEU QB 3 86 PRO QD . . 4.100 3.162 2.584 3.849 . 0 0 "[ . 1 . 2]" 1
2839 3 85 LEU QD 3 86 PRO QD . . 3.560 2.541 2.120 3.172 . 0 0 "[ . 1 . 2]" 1
2840 3 86 PRO QB 3 87 LYS H . . 4.010 3.261 1.776 4.079 0.069 9 0 "[ . 1 . 2]" 1
2841 3 86 PRO QG 3 87 LYS H . . 4.710 4.166 2.089 4.902 0.192 8 0 "[ . 1 . 2]" 1
2842 3 87 LYS H 3 87 LYS QB . . 3.610 2.733 2.253 3.426 . 0 0 "[ . 1 . 2]" 1
2843 3 87 LYS H 3 88 ASN QD . . 5.340 5.117 3.034 5.578 0.238 8 0 "[ . 1 . 2]" 1
2844 3 87 LYS QB 3 87 LYS QE . . 4.160 3.115 1.888 3.950 . 0 0 "[ . 1 . 2]" 1
2845 3 88 ASN HA 3 88 ASN QD . . 4.440 3.911 3.528 4.385 . 0 0 "[ . 1 . 2]" 1
2846 3 88 ASN QD 3 89 CYS HA . . 4.360 4.213 3.132 4.621 0.261 8 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 216
_Distance_constraint_stats_list.Viol_count 4289
_Distance_constraint_stats_list.Viol_total 19247.725
_Distance_constraint_stats_list.Viol_max 0.486
_Distance_constraint_stats_list.Viol_rms 0.0754
_Distance_constraint_stats_list.Viol_average_all_restraints 0.2228
_Distance_constraint_stats_list.Viol_average_violations_only 0.2244
_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 2 MET 17.622 0.354 5 0 "[ . 1 . 2]"
1 3 GLN 5.340 0.285 20 0 "[ . 1 . 2]"
1 4 ILE 18.647 0.393 7 0 "[ . 1 . 2]"
1 5 PHE 7.155 0.305 17 0 "[ . 1 . 2]"
1 6 VAL 17.398 0.313 12 0 "[ . 1 . 2]"
1 7 ASP 13.669 0.306 3 0 "[ . 1 . 2]"
1 8 THR 16.961 0.320 4 0 "[ . 1 . 2]"
1 10 GLN 19.990 0.364 3 0 "[ . 1 . 2]"
1 12 LYS 19.868 0.431 12 0 "[ . 1 . 2]"
1 14 ILE 16.294 0.283 4 0 "[ . 1 . 2]"
1 16 LEU 17.151 0.364 2 0 "[ . 1 . 2]"
1 18 VAL 17.574 0.327 16 0 "[ . 1 . 2]"
1 20 PRO 10.682 0.336 16 0 "[ . 1 . 2]"
1 24 ILE 17.743 0.373 1 0 "[ . 1 . 2]"
1 25 GLU 9.123 0.323 5 0 "[ . 1 . 2]"
1 26 ASN 7.248 0.320 15 0 "[ . 1 . 2]"
1 27 VAL 11.193 0.358 9 0 "[ . 1 . 2]"
1 28 LYS 22.341 0.373 1 0 "[ . 1 . 2]"
1 29 ALA 16.775 0.323 5 0 "[ . 1 . 2]"
1 30 LYS 14.976 0.320 15 0 "[ . 1 . 2]"
1 31 ILE 21.361 0.358 9 0 "[ . 1 . 2]"
1 32 GLN 12.306 0.366 5 0 "[ . 1 . 2]"
1 33 ASP 7.651 0.274 5 0 "[ . 1 . 2]"
1 34 LYS 7.728 0.293 13 0 "[ . 1 . 2]"
1 35 GLU 10.168 0.352 19 0 "[ . 1 . 2]"
1 41 GLN 8.672 0.434 9 0 "[ . 1 . 2]"
1 43 ARG 10.903 0.334 17 0 "[ . 1 . 2]"
1 45 ILE 22.001 0.401 17 0 "[ . 1 . 2]"
1 46 PHE 15.994 0.391 10 0 "[ . 1 . 2]"
1 49 LYS 15.994 0.391 10 0 "[ . 1 . 2]"
1 52 GLU 20.246 0.396 17 0 "[ . 1 . 2]"
1 55 ARG 18.918 0.369 1 0 "[ . 1 . 2]"
1 58 SER 21.597 0.336 16 0 "[ . 1 . 2]"
1 60 TYR 9.037 0.396 17 0 "[ . 1 . 2]"
1 61 ASN 10.915 0.323 8 0 "[ . 1 . 2]"
1 65 GLU 4.581 0.234 9 0 "[ . 1 . 2]"
1 66 SER 8.242 0.315 16 0 "[ . 1 . 2]"
1 68 LEU 8.000 0.283 4 0 "[ . 1 . 2]"
1 69 ILE 22.001 0.401 17 0 "[ . 1 . 2]"
1 70 LEU 9.322 0.324 6 0 "[ . 1 . 2]"
1 71 LEU 10.903 0.334 17 0 "[ . 1 . 2]"
1 73 THR 8.672 0.434 9 0 "[ . 1 . 2]"
2 2 MET 17.574 0.327 16 0 "[ . 1 . 2]"
2 3 GLN 4.581 0.234 9 0 "[ . 1 . 2]"
2 4 ILE 17.151 0.364 2 0 "[ . 1 . 2]"
2 5 PHE 8.242 0.315 16 0 "[ . 1 . 2]"
2 6 VAL 16.294 0.283 4 0 "[ . 1 . 2]"
2 7 ASP 17.323 0.324 6 0 "[ . 1 . 2]"
2 8 THR 19.868 0.431 12 0 "[ . 1 . 2]"
2 10 GLN 19.990 0.364 3 0 "[ . 1 . 2]"
2 12 LYS 16.961 0.320 4 0 "[ . 1 . 2]"
2 14 ILE 17.398 0.313 12 0 "[ . 1 . 2]"
2 16 LEU 18.647 0.393 7 0 "[ . 1 . 2]"
2 18 VAL 17.622 0.354 5 0 "[ . 1 . 2]"
2 20 PRO 10.028 0.312 5 0 "[ . 1 . 2]"
2 24 ILE 17.100 0.412 8 0 "[ . 1 . 2]"
2 25 GLU 9.914 0.316 3 0 "[ . 1 . 2]"
2 26 ASN 8.172 0.283 6 0 "[ . 1 . 2]"
2 27 VAL 12.180 0.402 20 0 "[ . 1 . 2]"
2 28 LYS 21.999 0.412 8 0 "[ . 1 . 2]"
2 29 ALA 17.769 0.316 3 0 "[ . 1 . 2]"
2 30 LYS 16.176 0.283 6 0 "[ . 1 . 2]"
2 31 ILE 23.256 0.402 20 0 "[ . 1 . 2]"
2 32 GLN 11.508 0.368 7 0 "[ . 1 . 2]"
2 33 ASP 7.855 0.285 1 0 "[ . 1 . 2]"
2 34 LYS 8.004 0.264 11 0 "[ . 1 . 2]"
2 35 GLU 11.077 0.368 11 0 "[ . 1 . 2]"
2 41 GLN 8.225 0.377 2 0 "[ . 1 . 2]"
2 43 ARG 9.394 0.325 13 0 "[ . 1 . 2]"
2 45 ASP 17.629 0.362 4 0 "[ . 1 . 2]"
2 46 PHE 16.652 0.340 8 0 "[ . 1 . 2]"
2 49 LYS 16.652 0.340 8 0 "[ . 1 . 2]"
2 52 GLU 20.076 0.373 19 0 "[ . 1 . 2]"
2 55 ARG 16.875 0.308 10 0 "[ . 1 . 2]"
2 58 SER 21.082 0.326 6 0 "[ . 1 . 2]"
2 60 TYR 9.811 0.373 19 0 "[ . 1 . 2]"
2 61 ASN 11.054 0.326 6 0 "[ . 1 . 2]"
2 63 GLN 5.155 0.222 11 0 "[ . 1 . 2]"
2 65 GLU 5.340 0.285 20 0 "[ . 1 . 2]"
2 66 SER 12.310 0.305 17 0 "[ . 1 . 2]"
2 68 LEU 5.981 0.281 18 0 "[ . 1 . 2]"
2 69 ILE 17.629 0.362 4 0 "[ . 1 . 2]"
2 70 LEU 7.688 0.306 3 0 "[ . 1 . 2]"
2 71 LEU 9.394 0.325 13 0 "[ . 1 . 2]"
2 73 THR 8.225 0.377 2 0 "[ . 1 . 2]"
3 13 ASP 9.261 0.399 10 0 "[ . 1 . 2]"
3 14 GLN 8.378 0.347 18 0 "[ . 1 . 2]"
3 15 LYS 9.450 0.345 7 0 "[ . 1 . 2]"
3 16 GLU 7.811 0.333 10 0 "[ . 1 . 2]"
3 17 GLU 17.142 0.399 10 0 "[ . 1 . 2]"
3 18 GLU 14.128 0.347 18 0 "[ . 1 . 2]"
3 19 LEU 17.874 0.345 7 0 "[ . 1 . 2]"
3 20 LEU 12.804 0.333 10 0 "[ . 1 . 2]"
3 21 LEU 18.405 0.333 2 0 "[ . 1 . 2]"
3 22 PHE 17.281 0.362 17 0 "[ . 1 . 2]"
3 23 TRP 14.213 0.262 15 0 "[ . 1 . 2]"
3 24 THR 4.993 0.229 9 0 "[ . 1 . 2]"
3 25 TYR 19.777 0.333 2 0 "[ . 1 . 2]"
3 26 ILE 20.779 0.362 17 0 "[ . 1 . 2]"
3 27 GLN 5.789 0.223 9 0 "[ . 1 . 2]"
3 29 MET 14.481 0.327 4 0 "[ . 1 . 2]"
3 30 LEU 9.248 0.315 12 0 "[ . 1 . 2]"
3 33 LEU 13.587 0.352 6 0 "[ . 1 . 2]"
3 35 SER 8.359 0.352 6 0 "[ . 1 . 2]"
3 36 LEU 18.932 0.486 19 0 "[ . 1 . 2]"
3 38 LEU 7.036 0.265 3 0 "[ . 1 . 2]"
3 39 ASP 10.679 0.365 15 0 "[ . 1 . 2]"
3 40 ARG 11.754 0.379 16 0 "[ . 1 . 2]"
3 41 ILE 9.853 0.347 10 0 "[ . 1 . 2]"
3 42 TYR 13.693 0.280 16 0 "[ . 1 . 2]"
3 43 ASN 21.727 0.365 15 0 "[ . 1 . 2]"
3 44 MET 23.346 0.379 16 0 "[ . 1 . 2]"
3 45 LEU 18.648 0.347 10 0 "[ . 1 . 2]"
3 46 ARG 17.205 0.370 10 0 "[ . 1 . 2]"
3 47 MET 22.376 0.342 15 0 "[ . 1 . 2]"
3 48 PHE 11.591 0.371 9 0 "[ . 1 . 2]"
3 49 VAL 8.794 0.313 18 0 "[ . 1 . 2]"
3 50 VAL 10.548 0.370 10 0 "[ . 1 . 2]"
3 51 THR 11.328 0.339 11 0 "[ . 1 . 2]"
3 53 PRO 10.073 0.367 12 0 "[ . 1 . 2]"
3 56 ALA 10.073 0.367 12 0 "[ . 1 . 2]"
3 59 ASP 9.717 0.358 16 0 "[ . 1 . 2]"
3 60 LEU 4.980 0.211 10 0 "[ . 1 . 2]"
3 61 GLN 9.809 0.362 3 0 "[ . 1 . 2]"
3 62 GLU 8.944 0.300 9 0 "[ . 1 . 2]"
3 63 LEU 21.495 0.361 9 0 "[ . 1 . 2]"
3 64 GLN 9.978 0.226 8 0 "[ . 1 . 2]"
3 65 GLY 20.953 0.362 3 0 "[ . 1 . 2]"
3 66 TYR 21.318 0.371 18 0 "[ . 1 . 2]"
3 67 LEU 19.631 0.361 9 0 "[ . 1 . 2]"
3 68 GLN 14.272 0.330 2 0 "[ . 1 . 2]"
3 69 LYS 16.156 0.339 7 0 "[ . 1 . 2]"
3 70 LYS 12.374 0.371 18 0 "[ . 1 . 2]"
3 71 VAL 7.853 0.327 17 0 "[ . 1 . 2]"
3 72 ARG 9.274 0.330 2 0 "[ . 1 . 2]"
3 73 ASP 5.012 0.275 11 0 "[ . 1 . 2]"
3 77 VAL 19.446 0.348 10 0 "[ . 1 . 2]"
3 79 SER 12.471 0.245 9 0 "[ . 1 . 2]"
3 81 GLY 5.976 0.227 3 0 "[ . 1 . 2]"
3 82 VAL 6.495 0.245 9 0 "[ . 1 . 2]"
3 83 TYR 18.932 0.486 19 0 "[ . 1 . 2]"
3 84 ARG 19.446 0.348 10 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 24 ILE O 1 28 LYS H . . 1.800 2.020 1.931 2.096 0.296 1 0 "[ . 1 . 2]" 2
2 1 24 ILE O 1 28 LYS N . . 2.700 2.982 2.874 3.073 0.373 1 0 "[ . 1 . 2]" 2
3 1 25 GLU O 1 29 ALA H . . 1.800 2.041 1.996 2.088 0.288 5 0 "[ . 1 . 2]" 2
4 1 25 GLU O 1 29 ALA N . . 2.700 2.915 2.796 3.023 0.323 5 0 "[ . 1 . 2]" 2
5 1 26 ASN O 1 30 LYS H . . 1.800 2.013 1.891 2.084 0.284 4 0 "[ . 1 . 2]" 2
6 1 26 ASN O 1 30 LYS N . . 2.700 2.848 2.684 3.020 0.320 15 0 "[ . 1 . 2]" 2
7 1 27 VAL O 1 31 ILE H . . 1.800 2.048 2.004 2.097 0.297 9 0 "[ . 1 . 2]" 2
8 1 27 VAL O 1 31 ILE N . . 2.700 3.011 2.952 3.058 0.358 9 0 "[ . 1 . 2]" 2
9 1 28 LYS O 1 32 GLN H . . 1.800 2.108 2.035 2.140 0.340 10 0 "[ . 1 . 2]" 2
10 1 28 LYS O 1 32 GLN N . . 2.700 3.007 2.873 3.066 0.366 5 0 "[ . 1 . 2]" 2
11 1 29 ALA O 1 33 ASP H . . 1.800 2.046 2.017 2.074 0.274 5 0 "[ . 1 . 2]" 2
12 1 29 ALA O 1 33 ASP N . . 2.700 2.836 2.753 2.937 0.237 2 0 "[ . 1 . 2]" 2
13 1 30 LYS O 1 34 LYS H . . 1.800 1.985 1.919 2.054 0.254 13 0 "[ . 1 . 2]" 2
14 1 30 LYS O 1 34 LYS N . . 2.700 2.901 2.812 2.993 0.293 13 0 "[ . 1 . 2]" 2
15 1 31 ILE O 1 35 GLU H . . 1.800 2.104 2.049 2.152 0.352 19 0 "[ . 1 . 2]" 2
16 1 31 ILE O 1 35 GLU N . . 2.700 2.904 2.794 3.037 0.337 8 0 "[ . 1 . 2]" 2
17 2 24 ILE O 2 28 LYS H . . 1.800 2.031 1.985 2.133 0.333 8 0 "[ . 1 . 2]" 2
18 2 24 ILE O 2 28 LYS N . . 2.700 2.993 2.946 3.112 0.412 8 0 "[ . 1 . 2]" 2
19 2 25 GLU O 2 29 ALA H . . 1.800 2.058 1.954 2.116 0.316 3 0 "[ . 1 . 2]" 2
20 2 25 GLU O 2 29 ALA N . . 2.700 2.938 2.828 3.008 0.308 10 0 "[ . 1 . 2]" 2
21 2 26 ASN O 2 30 LYS H . . 1.800 2.033 1.985 2.083 0.283 6 0 "[ . 1 . 2]" 2
22 2 26 ASN O 2 30 LYS N . . 2.700 2.876 2.712 2.954 0.254 14 0 "[ . 1 . 2]" 2
23 2 27 VAL O 2 31 ILE H . . 1.800 2.071 2.036 2.123 0.323 20 0 "[ . 1 . 2]" 2
24 2 27 VAL O 2 31 ILE N . . 2.700 3.038 2.993 3.102 0.402 20 0 "[ . 1 . 2]" 2
25 2 28 LYS O 2 32 GLN H . . 1.800 2.090 2.046 2.130 0.330 8 0 "[ . 1 . 2]" 2
26 2 28 LYS O 2 32 GLN N . . 2.700 2.985 2.893 3.068 0.368 7 0 "[ . 1 . 2]" 2
27 2 29 ALA O 2 33 ASP H . . 1.800 2.042 2.015 2.085 0.285 1 0 "[ . 1 . 2]" 2
28 2 29 ALA O 2 33 ASP N . . 2.700 2.850 2.701 2.920 0.220 10 0 "[ . 1 . 2]" 2
29 2 30 LYS O 2 34 LYS H . . 1.800 1.985 1.901 2.058 0.258 20 0 "[ . 1 . 2]" 2
30 2 30 LYS O 2 34 LYS N . . 2.700 2.915 2.829 2.964 0.264 11 0 "[ . 1 . 2]" 2
31 2 31 ILE O 2 35 GLU H . . 1.800 2.112 2.076 2.168 0.368 11 0 "[ . 1 . 2]" 2
32 2 31 ILE O 2 35 GLU N . . 2.700 2.942 2.849 3.052 0.352 1 0 "[ . 1 . 2]" 2
33 1 2 MET H 2 18 VAL O . . 1.800 2.067 2.029 2.129 0.329 14 0 "[ . 1 . 2]" 2
34 1 2 MET N 2 18 VAL O . . 2.700 2.973 2.744 3.054 0.354 5 0 "[ . 1 . 2]" 2
35 1 2 MET O 2 18 VAL H . . 1.800 1.943 1.863 2.053 0.253 6 0 "[ . 1 . 2]" 2
36 1 2 MET O 2 18 VAL N . . 2.700 2.898 2.794 3.021 0.321 6 0 "[ . 1 . 2]" 2
37 1 4 ILE H 2 16 LEU O . . 1.800 1.955 1.879 2.019 0.219 7 0 "[ . 1 . 2]" 2
38 1 4 ILE N 2 16 LEU O . . 2.700 2.881 2.776 2.977 0.277 7 0 "[ . 1 . 2]" 2
39 1 4 ILE O 2 16 LEU H . . 1.800 2.060 2.030 2.097 0.297 7 0 "[ . 1 . 2]" 2
40 1 4 ILE O 2 16 LEU N . . 2.700 3.037 2.997 3.093 0.393 7 0 "[ . 1 . 2]" 2
41 1 6 VAL H 2 14 ILE O . . 1.800 2.010 1.893 2.108 0.308 20 0 "[ . 1 . 2]" 2
42 1 6 VAL N 2 14 ILE O . . 2.700 2.891 2.766 2.964 0.264 20 0 "[ . 1 . 2]" 2
43 1 6 VAL O 2 14 ILE H . . 1.800 2.019 1.944 2.059 0.259 12 0 "[ . 1 . 2]" 2
44 1 6 VAL O 2 14 ILE N . . 2.700 2.950 2.878 3.013 0.313 12 0 "[ . 1 . 2]" 2
45 1 7 ASP O 2 70 LEU H . . 1.800 1.986 1.921 2.054 0.254 8 0 "[ . 1 . 2]" 2
46 1 7 ASP O 2 70 LEU N . . 2.700 2.898 2.826 3.006 0.306 3 0 "[ . 1 . 2]" 2
47 1 7 ASP H 2 68 LEU O . . 1.800 1.962 1.854 2.051 0.251 18 0 "[ . 1 . 2]" 2
48 1 7 ASP N 2 68 LEU O . . 2.700 2.837 2.710 2.981 0.281 18 0 "[ . 1 . 2]" 2
49 1 5 PHE H 2 66 SER O . . 1.800 1.962 1.885 2.037 0.237 17 0 "[ . 1 . 2]" 2
50 1 5 PHE N 2 66 SER O . . 2.700 2.895 2.751 3.005 0.305 17 0 "[ . 1 . 2]" 2
51 1 3 GLN O 2 65 GLU H . . 1.800 1.983 1.886 2.085 0.285 20 0 "[ . 1 . 2]" 2
52 1 3 GLN O 2 65 GLU N . . 2.700 2.783 2.690 2.891 0.191 19 0 "[ . 1 . 2]" 2
53 1 18 VAL O 2 2 MET H . . 1.800 2.053 1.936 2.124 0.324 1 0 "[ . 1 . 2]" 2
54 1 18 VAL O 2 2 MET N . . 2.700 2.922 2.755 3.027 0.327 16 0 "[ . 1 . 2]" 2
55 1 18 VAL H 2 2 MET O . . 1.800 1.972 1.920 2.064 0.264 17 0 "[ . 1 . 2]" 2
56 1 18 VAL N 2 2 MET O . . 2.700 2.932 2.865 2.999 0.299 16 0 "[ . 1 . 2]" 2
57 1 16 LEU O 2 4 ILE H . . 1.800 1.943 1.897 2.034 0.234 18 0 "[ . 1 . 2]" 2
58 1 16 LEU O 2 4 ILE N . . 2.700 2.858 2.801 2.895 0.195 15 0 "[ . 1 . 2]" 2
59 1 16 LEU H 2 4 ILE O . . 1.800 2.039 2.001 2.077 0.277 17 0 "[ . 1 . 2]" 2
60 1 16 LEU N 2 4 ILE O . . 2.700 3.018 2.971 3.064 0.364 2 0 "[ . 1 . 2]" 2
61 1 14 ILE O 2 6 VAL H . . 1.800 1.993 1.908 2.072 0.272 15 0 "[ . 1 . 2]" 2
62 1 14 ILE O 2 6 VAL N . . 2.700 2.891 2.823 2.946 0.246 14 0 "[ . 1 . 2]" 2
63 1 14 ILE H 2 6 VAL O . . 1.800 1.997 1.913 2.048 0.248 20 0 "[ . 1 . 2]" 2
64 1 14 ILE N 2 6 VAL O . . 2.700 2.934 2.820 2.983 0.283 4 0 "[ . 1 . 2]" 2
65 1 70 LEU H 2 7 ASP O . . 1.800 2.021 1.901 2.111 0.311 1 0 "[ . 1 . 2]" 2
66 1 70 LEU N 2 7 ASP O . . 2.700 2.946 2.844 3.024 0.324 6 0 "[ . 1 . 2]" 2
67 1 68 LEU O 2 7 ASP H . . 1.800 1.974 1.893 2.026 0.226 9 0 "[ . 1 . 2]" 2
68 1 68 LEU O 2 7 ASP N . . 2.700 2.926 2.846 2.983 0.283 4 0 "[ . 1 . 2]" 2
69 1 66 SER O 2 5 PHE H . . 1.800 1.975 1.865 2.042 0.242 16 0 "[ . 1 . 2]" 2
70 1 66 SER O 2 5 PHE N . . 2.700 2.937 2.832 3.015 0.315 16 0 "[ . 1 . 2]" 2
71 1 65 GLU H 2 3 GLN O . . 1.800 1.967 1.900 2.034 0.234 9 0 "[ . 1 . 2]" 2
72 1 65 GLU N 2 3 GLN O . . 2.700 2.762 2.697 2.892 0.192 12 0 "[ . 1 . 2]" 2
73 1 58 SER O 1 61 ASN H . . 1.800 2.092 2.057 2.123 0.323 8 0 "[ . 1 . 2]" 2
74 1 58 SER O 1 61 ASN N . . 2.700 2.954 2.903 3.006 0.306 13 0 "[ . 1 . 2]" 2
75 1 46 PHE O 1 49 LYS H . . 1.800 2.025 1.949 2.123 0.323 10 0 "[ . 1 . 2]" 2
76 1 46 PHE O 1 49 LYS N . . 2.700 2.901 2.802 3.091 0.391 10 0 "[ . 1 . 2]" 2
77 1 46 PHE H 1 49 LYS O . . 1.800 1.970 1.905 2.063 0.263 10 0 "[ . 1 . 2]" 2
78 1 46 PHE N 1 49 LYS O . . 2.700 2.904 2.815 3.007 0.307 10 0 "[ . 1 . 2]" 2
79 1 45 ILE O 1 69 ILE H . . 1.800 2.055 1.965 2.093 0.293 13 0 "[ . 1 . 2]" 2
80 1 45 ILE O 1 69 ILE N . . 2.700 2.993 2.763 3.065 0.365 9 0 "[ . 1 . 2]" 2
81 1 45 ILE H 1 69 ILE O . . 1.800 2.049 1.968 2.122 0.322 17 0 "[ . 1 . 2]" 2
82 1 45 ILE N 1 69 ILE O . . 2.700 3.002 2.849 3.101 0.401 17 0 "[ . 1 . 2]" 2
83 1 43 ARG O 1 71 LEU H . . 1.800 2.065 2.007 2.120 0.320 4 0 "[ . 1 . 2]" 2
84 1 43 ARG O 1 71 LEU N . . 2.700 2.980 2.903 3.034 0.334 17 0 "[ . 1 . 2]" 2
85 1 41 GLN O 1 73 THR H . . 1.800 2.119 2.028 2.234 0.434 9 0 "[ . 1 . 2]" 2
86 1 41 GLN O 1 73 THR N . . 2.700 2.814 2.686 3.009 0.309 12 0 "[ . 1 . 2]" 2
87 2 63 GLN O 2 66 SER H . . 2.000 2.186 2.143 2.222 0.222 11 0 "[ . 1 . 2]" 2
88 2 63 GLN O 2 66 SER N . . 3.000 3.072 3.025 3.118 0.118 12 0 "[ . 1 . 2]" 2
89 2 58 SER O 2 61 ASN H . . 1.800 2.095 2.070 2.126 0.326 6 0 "[ . 1 . 2]" 2
90 2 58 SER O 2 61 ASN N . . 2.700 2.958 2.929 2.991 0.291 15 0 "[ . 1 . 2]" 2
91 2 46 PHE O 2 49 LYS H . . 1.800 2.045 1.935 2.140 0.340 8 0 "[ . 1 . 2]" 2
92 2 46 PHE O 2 49 LYS N . . 2.700 2.910 2.773 2.999 0.299 5 0 "[ . 1 . 2]" 2
93 2 46 PHE H 2 49 LYS O . . 1.800 1.999 1.914 2.079 0.279 8 0 "[ . 1 . 2]" 2
94 2 46 PHE N 2 49 LYS O . . 2.700 2.879 2.764 2.977 0.277 8 0 "[ . 1 . 2]" 2
95 2 45 ASP O 2 69 ILE H . . 1.800 2.061 2.005 2.105 0.305 1 0 "[ . 1 . 2]" 2
96 2 45 ASP O 2 69 ILE N . . 2.700 2.878 2.760 3.062 0.362 4 0 "[ . 1 . 2]" 2
97 2 45 ASP H 2 69 ILE O . . 1.800 2.018 1.881 2.095 0.295 15 0 "[ . 1 . 2]" 2
98 2 45 ASP N 2 69 ILE O . . 2.700 2.924 2.821 3.008 0.308 18 0 "[ . 1 . 2]" 2
99 2 43 ARG O 2 71 LEU H . . 1.800 2.038 1.930 2.125 0.325 13 0 "[ . 1 . 2]" 2
100 2 43 ARG O 2 71 LEU N . . 2.700 2.932 2.845 2.998 0.298 7 0 "[ . 1 . 2]" 2
101 2 41 GLN O 2 73 THR H . . 1.800 2.101 2.005 2.177 0.377 2 0 "[ . 1 . 2]" 2
102 2 41 GLN O 2 73 THR N . . 2.700 2.806 2.666 3.017 0.317 10 0 "[ . 1 . 2]" 2
103 1 8 THR O 2 12 LYS H . . 1.800 2.063 1.981 2.105 0.305 6 0 "[ . 1 . 2]" 2
104 1 8 THR O 2 12 LYS N . . 2.700 2.925 2.844 3.020 0.320 4 0 "[ . 1 . 2]" 2
105 1 8 THR H 2 12 LYS O . . 1.800 2.020 1.942 2.071 0.271 14 0 "[ . 1 . 2]" 2
106 1 8 THR N 2 12 LYS O . . 2.700 2.840 2.725 2.997 0.297 8 0 "[ . 1 . 2]" 2
107 1 12 LYS H 2 8 THR O . . 1.800 2.068 1.927 2.176 0.376 12 0 "[ . 1 . 2]" 2
108 1 12 LYS N 2 8 THR O . . 2.700 3.014 2.896 3.131 0.431 12 0 "[ . 1 . 2]" 2
109 1 12 LYS O 2 8 THR H . . 1.800 2.000 1.942 2.069 0.269 2 0 "[ . 1 . 2]" 2
110 1 12 LYS O 2 8 THR N . . 2.700 2.911 2.809 3.009 0.309 2 0 "[ . 1 . 2]" 2
111 1 10 GLN O 2 10 GLN H . . 1.800 2.069 2.019 2.128 0.328 3 0 "[ . 1 . 2]" 2
112 1 10 GLN O 2 10 GLN N . . 2.700 2.982 2.860 3.064 0.364 3 0 "[ . 1 . 2]" 2
113 1 10 GLN H 2 10 GLN O . . 1.800 2.029 1.948 2.078 0.278 11 0 "[ . 1 . 2]" 2
114 1 10 GLN N 2 10 GLN O . . 2.700 2.920 2.774 2.997 0.297 13 0 "[ . 1 . 2]" 2
115 1 24 ILE H 1 55 ARG O . . 1.800 1.978 1.905 2.063 0.263 16 0 "[ . 1 . 2]" 2
116 1 24 ILE N 1 55 ARG O . . 2.700 2.908 2.842 2.978 0.278 7 0 "[ . 1 . 2]" 2
117 2 24 ILE H 2 55 ARG O . . 1.800 1.959 1.873 2.040 0.240 9 0 "[ . 1 . 2]" 2
118 2 24 ILE N 2 55 ARG O . . 2.700 2.872 2.779 2.954 0.254 13 0 "[ . 1 . 2]" 2
119 1 52 GLU O 1 55 ARG H . . 1.800 2.073 2.006 2.109 0.309 1 0 "[ . 1 . 2]" 2
120 1 52 GLU O 1 55 ARG N . . 2.700 2.987 2.901 3.069 0.369 1 0 "[ . 1 . 2]" 2
121 1 52 GLU H 1 60 TYR HH . . 1.800 2.032 1.862 2.115 0.315 17 0 "[ . 1 . 2]" 2
122 1 52 GLU N 1 60 TYR HH . . 2.700 2.903 2.579 3.096 0.396 17 0 "[ . 1 . 2]" 2
123 1 20 PRO O 1 58 SER H . . 1.800 2.082 2.041 2.131 0.331 5 0 "[ . 1 . 2]" 2
124 1 20 PRO O 1 58 SER N . . 2.700 2.952 2.841 3.036 0.336 16 0 "[ . 1 . 2]" 2
125 2 52 GLU O 2 55 ARG H . . 1.800 2.050 2.006 2.108 0.308 10 0 "[ . 1 . 2]" 2
126 2 52 GLU O 2 55 ARG N . . 2.700 2.963 2.911 3.007 0.307 18 0 "[ . 1 . 2]" 2
127 2 52 GLU H 2 60 TYR HH . . 1.800 2.025 1.787 2.109 0.309 5 0 "[ . 1 . 2]" 2
128 2 52 GLU N 2 60 TYR HH . . 2.700 2.961 2.624 3.073 0.373 19 0 "[ . 1 . 2]" 2
129 2 20 PRO O 2 58 SER H . . 1.800 2.070 2.020 2.112 0.312 5 0 "[ . 1 . 2]" 2
130 2 20 PRO O 2 58 SER N . . 2.700 2.932 2.857 2.998 0.298 5 0 "[ . 1 . 2]" 2
131 3 29 MET O 3 33 LEU H . . 1.800 1.939 1.858 2.049 0.249 19 0 "[ . 1 . 2]" 2
132 3 29 MET O 3 33 LEU N . . 2.700 2.819 2.650 2.937 0.237 4 0 "[ . 1 . 2]" 2
133 3 26 ILE O 3 30 LEU H . . 1.800 2.020 1.922 2.088 0.288 12 0 "[ . 1 . 2]" 2
134 3 26 ILE O 3 30 LEU N . . 2.700 2.942 2.797 3.015 0.315 12 0 "[ . 1 . 2]" 2
135 3 25 TYR O 3 29 MET H . . 1.800 2.041 1.948 2.117 0.317 4 0 "[ . 1 . 2]" 2
136 3 25 TYR O 3 29 MET N . . 2.700 2.922 2.784 3.027 0.327 4 0 "[ . 1 . 2]" 2
137 3 23 TRP O 3 27 GLN H . . 1.800 1.952 1.889 2.018 0.218 9 0 "[ . 1 . 2]" 2
138 3 23 TRP O 3 27 GLN N . . 2.700 2.837 2.746 2.923 0.223 9 0 "[ . 1 . 2]" 2
139 3 22 PHE O 3 26 ILE H . . 1.800 2.055 1.968 2.100 0.300 12 0 "[ . 1 . 2]" 2
140 3 22 PHE O 3 26 ILE N . . 2.700 3.021 2.940 3.062 0.362 17 0 "[ . 1 . 2]" 2
141 3 21 LEU O 3 25 TYR H . . 1.800 2.061 2.005 2.102 0.302 2 0 "[ . 1 . 2]" 2
142 3 21 LEU O 3 25 TYR N . . 2.700 2.965 2.893 3.033 0.333 2 0 "[ . 1 . 2]" 2
143 3 20 LEU O 3 24 THR H . . 1.800 1.984 1.924 2.029 0.229 9 0 "[ . 1 . 2]" 2
144 3 20 LEU O 3 24 THR N . . 2.700 2.765 2.693 2.874 0.174 9 0 "[ . 1 . 2]" 2
145 3 19 LEU O 3 23 TRP H . . 1.800 2.025 1.984 2.062 0.262 15 0 "[ . 1 . 2]" 2
146 3 19 LEU O 3 23 TRP N . . 2.700 2.897 2.798 2.954 0.254 6 0 "[ . 1 . 2]" 2
147 3 18 GLU O 3 22 PHE H . . 1.800 1.944 1.850 2.038 0.238 1 0 "[ . 1 . 2]" 2
148 3 18 GLU O 3 22 PHE N . . 2.700 2.844 2.707 2.966 0.266 18 0 "[ . 1 . 2]" 2
149 3 17 GLU O 3 21 LEU H . . 1.800 2.029 1.999 2.065 0.265 10 0 "[ . 1 . 2]" 2
150 3 17 GLU O 3 21 LEU N . . 2.700 2.865 2.736 2.965 0.265 13 0 "[ . 1 . 2]" 2
151 3 16 GLU O 3 20 LEU H . . 1.800 2.010 1.922 2.092 0.292 10 0 "[ . 1 . 2]" 2
152 3 16 GLU O 3 20 LEU N . . 2.700 2.881 2.721 3.033 0.333 10 0 "[ . 1 . 2]" 2
153 3 15 LYS O 3 19 LEU H . . 1.800 2.025 1.944 2.087 0.287 15 0 "[ . 1 . 2]" 2
154 3 15 LYS O 3 19 LEU N . . 2.700 2.947 2.766 3.045 0.345 7 0 "[ . 1 . 2]" 2
155 3 14 GLN O 3 18 GLU H . . 1.800 2.028 1.884 2.147 0.347 18 0 "[ . 1 . 2]" 2
156 3 14 GLN O 3 18 GLU N . . 2.700 2.891 2.769 3.022 0.322 18 0 "[ . 1 . 2]" 2
157 3 13 ASP O 3 17 GLU H . . 1.800 2.016 1.892 2.110 0.310 10 0 "[ . 1 . 2]" 2
158 3 13 ASP O 3 17 GLU N . . 2.700 2.947 2.791 3.099 0.399 10 0 "[ . 1 . 2]" 2
159 3 47 MET O 3 51 THR H . . 1.800 2.092 2.009 2.139 0.339 20 0 "[ . 1 . 2]" 2
160 3 47 MET O 3 51 THR N . . 2.700 2.974 2.860 3.039 0.339 11 0 "[ . 1 . 2]" 2
161 3 46 ARG O 3 50 VAL H . . 1.800 2.077 2.002 2.120 0.320 10 0 "[ . 1 . 2]" 2
162 3 46 ARG O 3 50 VAL N . . 2.700 2.951 2.766 3.070 0.370 10 0 "[ . 1 . 2]" 2
163 3 45 LEU O 3 49 VAL H . . 1.800 2.060 2.003 2.113 0.313 18 0 "[ . 1 . 2]" 2
164 3 45 LEU O 3 49 VAL N . . 2.700 2.880 2.726 2.981 0.281 17 0 "[ . 1 . 2]" 2
165 3 44 MET O 3 48 PHE H . . 1.800 2.062 1.977 2.118 0.318 16 0 "[ . 1 . 2]" 2
166 3 44 MET O 3 48 PHE N . . 2.700 3.018 2.942 3.071 0.371 9 0 "[ . 1 . 2]" 2
167 3 43 ASN O 3 47 MET H . . 1.800 2.063 2.034 2.104 0.304 14 0 "[ . 1 . 2]" 2
168 3 43 ASN O 3 47 MET N . . 2.700 2.989 2.874 3.042 0.342 15 0 "[ . 1 . 2]" 2
169 3 42 TYR O 3 46 ARG H . . 1.800 1.980 1.919 2.037 0.237 4 0 "[ . 1 . 2]" 2
170 3 42 TYR O 3 46 ARG N . . 2.700 2.853 2.755 2.980 0.280 16 0 "[ . 1 . 2]" 2
171 3 41 ILE O 3 45 LEU H . . 1.800 2.016 1.931 2.083 0.283 10 0 "[ . 1 . 2]" 2
172 3 41 ILE O 3 45 LEU N . . 2.700 2.977 2.881 3.047 0.347 10 0 "[ . 1 . 2]" 2
173 3 40 ARG O 3 44 MET H . . 1.800 2.076 2.004 2.117 0.317 16 0 "[ . 1 . 2]" 2
174 3 40 ARG O 3 44 MET N . . 2.700 3.011 2.930 3.079 0.379 16 0 "[ . 1 . 2]" 2
175 3 39 ASP O 3 43 ASN H . . 1.800 2.045 1.966 2.094 0.294 11 0 "[ . 1 . 2]" 2
176 3 39 ASP O 3 43 ASN N . . 2.700 2.989 2.871 3.065 0.365 15 0 "[ . 1 . 2]" 2
177 3 38 LEU O 3 42 TYR H . . 1.800 1.983 1.902 2.036 0.236 7 0 "[ . 1 . 2]" 2
178 3 38 LEU O 3 42 TYR N . . 2.700 2.869 2.736 2.965 0.265 3 0 "[ . 1 . 2]" 2
179 3 53 PRO O 3 56 ALA H . . 1.800 2.052 1.892 2.115 0.315 16 0 "[ . 1 . 2]" 2
180 3 53 PRO O 3 56 ALA N . . 2.700 2.951 2.779 3.067 0.367 12 0 "[ . 1 . 2]" 2
181 3 69 LYS O 3 73 ASP H . . 1.800 2.022 1.897 2.075 0.275 11 0 "[ . 1 . 2]" 2
182 3 69 LYS O 3 73 ASP N . . 2.700 2.709 2.608 2.812 0.112 5 0 "[ . 1 . 2]" 2
183 3 68 GLN O 3 72 ARG H . . 1.800 2.013 1.919 2.079 0.279 7 0 "[ . 1 . 2]" 2
184 3 68 GLN O 3 72 ARG N . . 2.700 2.951 2.823 3.030 0.330 2 0 "[ . 1 . 2]" 2
185 3 67 LEU O 3 71 VAL H . . 1.800 1.992 1.926 2.107 0.307 17 0 "[ . 1 . 2]" 2
186 3 67 LEU O 3 71 VAL N . . 2.700 2.900 2.826 3.027 0.327 17 0 "[ . 1 . 2]" 2
187 3 66 TYR O 3 70 LYS H . . 1.800 2.073 2.053 2.101 0.301 8 0 "[ . 1 . 2]" 2
188 3 66 TYR O 3 70 LYS N . . 2.700 3.046 3.008 3.071 0.371 18 0 "[ . 1 . 2]" 2
189 3 65 GLY O 3 69 LYS H . . 1.800 2.071 2.019 2.115 0.315 17 0 "[ . 1 . 2]" 2
190 3 65 GLY O 3 69 LYS N . . 2.700 2.986 2.931 3.039 0.339 7 0 "[ . 1 . 2]" 2
191 3 64 GLN O 3 68 GLN H . . 1.800 1.928 1.873 2.026 0.226 8 0 "[ . 1 . 2]" 2
192 3 64 GLN O 3 68 GLN N . . 2.700 2.822 2.706 2.895 0.195 3 0 "[ . 1 . 2]" 2
193 3 63 LEU O 3 67 LEU H . . 1.800 2.063 2.019 2.089 0.289 13 0 "[ . 1 . 2]" 2
194 3 63 LEU O 3 67 LEU N . . 2.700 3.026 2.945 3.061 0.361 9 0 "[ . 1 . 2]" 2
195 3 62 GLU O 3 66 TYR H . . 1.800 2.068 2.017 2.100 0.300 9 0 "[ . 1 . 2]" 2
196 3 62 GLU O 3 66 TYR N . . 2.700 2.880 2.774 2.998 0.298 9 0 "[ . 1 . 2]" 2
197 3 61 GLN O 3 65 GLY H . . 1.800 2.083 1.989 2.162 0.362 3 0 "[ . 1 . 2]" 2
198 3 61 GLN O 3 65 GLY N . . 2.700 2.907 2.854 2.980 0.280 16 0 "[ . 1 . 2]" 2
199 3 60 LEU O 3 64 GLN H . . 1.800 1.924 1.879 2.011 0.211 10 0 "[ . 1 . 2]" 2
200 3 60 LEU O 3 64 GLN N . . 2.700 2.825 2.729 2.887 0.187 20 0 "[ . 1 . 2]" 2
201 3 59 ASP O 3 63 LEU H . . 1.800 2.038 1.987 2.075 0.275 16 0 "[ . 1 . 2]" 2
202 3 59 ASP O 3 63 LEU N . . 2.700 2.948 2.820 3.058 0.358 16 0 "[ . 1 . 2]" 2
203 3 33 LEU O 3 35 SER H . . 1.800 2.051 1.918 2.152 0.352 6 0 "[ . 1 . 2]" 2
204 3 33 LEU O 3 35 SER N . . 2.700 2.864 2.637 2.965 0.265 7 0 "[ . 1 . 2]" 2
205 3 36 LEU O 3 83 TYR H . . 1.800 2.002 1.911 2.108 0.308 9 0 "[ . 1 . 2]" 2
206 3 36 LEU O 3 83 TYR N . . 2.700 2.860 2.708 3.003 0.303 4 0 "[ . 1 . 2]" 2
207 3 36 LEU H 3 83 TYR O . . 1.800 2.093 2.016 2.286 0.486 19 0 "[ . 1 . 2]" 2
208 3 36 LEU N 3 83 TYR O . . 2.700 2.992 2.883 3.098 0.398 5 0 "[ . 1 . 2]" 2
209 3 77 VAL H 3 84 ARG O . . 1.800 2.012 1.917 2.070 0.270 5 0 "[ . 1 . 2]" 2
210 3 77 VAL N 3 84 ARG O . . 2.700 2.913 2.847 2.983 0.283 5 0 "[ . 1 . 2]" 2
211 3 77 VAL O 3 84 ARG H . . 1.800 2.073 2.000 2.117 0.317 2 0 "[ . 1 . 2]" 2
212 3 77 VAL O 3 84 ARG N . . 2.700 2.975 2.894 3.048 0.348 10 0 "[ . 1 . 2]" 2
213 3 79 SER H 3 82 VAL O . . 1.800 1.980 1.901 2.045 0.245 9 0 "[ . 1 . 2]" 2
214 3 79 SER N 3 82 VAL O . . 2.700 2.845 2.781 2.913 0.213 6 0 "[ . 1 . 2]" 2
215 3 79 SER O 3 81 GLY H . . 1.800 2.004 1.974 2.027 0.227 3 0 "[ . 1 . 2]" 2
216 3 79 SER O 3 81 GLY N . . 2.700 2.795 2.739 2.830 0.130 18 0 "[ . 1 . 2]" 2
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