NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
527680 |
2lmq   |
18131 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lmq
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 951
_Distance_constraint_stats_list.Viol_count 6241
_Distance_constraint_stats_list.Viol_total 9625.874
_Distance_constraint_stats_list.Viol_max 1.340
_Distance_constraint_stats_list.Viol_rms 0.1214
_Distance_constraint_stats_list.Viol_average_all_restraints 0.1012
_Distance_constraint_stats_list.Viol_average_violations_only 0.1542
_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 12 VAL 1.165 0.231 10 0 "[ . 1]"
1 15 GLN 1.931 0.272 10 0 "[ . 1]"
1 16 LYS 1.931 0.272 10 0 "[ . 1]"
1 17 LEU 2.417 0.249 8 0 "[ . 1]"
1 18 VAL 0.165 0.130 2 0 "[ . 1]"
1 19 PHE 0.888 0.114 2 0 "[ . 1]"
1 21 ALA 2.575 0.231 2 0 "[ . 1]"
1 23 ASP 2.588 0.388 8 0 "[ . 1]"
1 24 VAL 2.588 0.388 8 0 "[ . 1]"
1 29 GLY 2.434 0.291 1 0 "[ . 1]"
1 30 ALA 9.266 0.608 9 2 "[ -. +1]"
1 31 ILE 4.039 0.608 9 1 "[ . +1]"
1 32 ILE 5.444 0.302 1 0 "[ . 1]"
1 34 LEU 10.453 0.470 7 0 "[ . 1]"
1 35 MET 6.018 0.470 7 0 "[ . 1]"
1 36 VAL 9.464 0.503 1 1 "[+ . 1]"
1 37 GLY 5.260 0.442 9 0 "[ . 1]"
1 38 GLY 2.850 0.314 4 0 "[ . 1]"
1 39 VAL 7.801 0.766 6 2 "[ -.+ 1]"
1 40 VAL 0.367 0.096 4 0 "[ . 1]"
2 12 VAL 3.505 0.431 8 0 "[ . 1]"
2 15 GLN 2.331 0.292 10 0 "[ . 1]"
2 16 LYS 3.855 0.292 10 0 "[ . 1]"
2 17 LEU 3.375 0.328 4 0 "[ . 1]"
2 18 VAL 1.931 0.136 2 0 "[ . 1]"
2 19 PHE 0.468 0.126 10 0 "[ . 1]"
2 20 PHE 0.914 0.118 9 0 "[ . 1]"
2 21 ALA 4.413 0.249 7 0 "[ . 1]"
2 22 GLU 1.823 0.231 2 0 "[ . 1]"
2 23 ASP 1.881 0.457 2 0 "[ . 1]"
2 24 VAL 1.881 0.457 2 0 "[ . 1]"
2 29 GLY 2.232 0.447 1 0 "[ . 1]"
2 30 ALA 9.725 0.447 1 0 "[ . 1]"
2 31 ILE 7.985 0.527 4 1 "[ +. 1]"
2 32 ILE 6.303 0.356 4 0 "[ . 1]"
2 33 GLY 5.191 0.258 9 0 "[ . 1]"
2 34 LEU 8.667 0.383 2 0 "[ . 1]"
2 35 MET 11.260 0.383 2 0 "[ . 1]"
2 36 VAL 9.084 0.503 10 1 "[ . +]"
2 37 GLY 4.955 0.435 4 0 "[ . 1]"
2 38 GLY 2.967 0.420 3 0 "[ . 1]"
2 39 VAL 11.654 0.766 6 3 "[ *.+ *1]"
2 40 VAL 0.140 0.059 8 0 "[ . 1]"
3 12 VAL 5.498 0.578 8 1 "[ . + 1]"
3 13 HIS 0.367 0.096 4 0 "[ . 1]"
3 15 GLN 5.346 0.342 4 0 "[ . 1]"
3 16 LYS 6.538 0.342 4 0 "[ . 1]"
3 17 LEU 6.807 0.302 1 0 "[ . 1]"
3 18 VAL 1.839 0.203 5 0 "[ . 1]"
3 19 PHE 7.487 0.503 1 1 "[+ . 1]"
3 20 PHE 1.386 0.230 8 0 "[ . 1]"
3 21 ALA 6.063 0.327 8 0 "[ . 1]"
3 22 GLU 2.511 0.249 7 0 "[ . 1]"
3 23 ASP 2.638 0.720 8 1 "[ . + 1]"
3 24 VAL 2.638 0.720 8 1 "[ . + 1]"
3 29 GLY 3.098 0.328 7 0 "[ . 1]"
3 30 ALA 9.862 0.455 5 0 "[ . 1]"
3 31 ILE 9.826 0.801 5 1 "[ + 1]"
3 32 ILE 6.035 0.432 3 0 "[ . 1]"
3 33 GLY 4.005 0.251 2 0 "[ . 1]"
3 34 LEU 8.005 0.459 7 0 "[ . 1]"
3 35 MET 11.951 0.459 7 0 "[ . 1]"
3 36 VAL 11.077 0.504 4 1 "[ +. 1]"
3 37 GLY 5.218 0.440 3 0 "[ . 1]"
3 38 GLY 3.455 0.372 4 0 "[ . 1]"
3 39 VAL 13.833 0.697 3 3 "[ + .- *1]"
3 40 VAL 0.415 0.094 4 0 "[ . 1]"
4 12 VAL 6.543 0.605 2 2 "[ + . - 1]"
4 13 HIS 0.140 0.059 8 0 "[ . 1]"
4 15 GLN 5.831 0.373 8 0 "[ . 1]"
4 16 LYS 7.629 0.373 8 0 "[ . 1]"
4 17 LEU 7.729 0.356 4 0 "[ . 1]"
4 18 VAL 2.051 0.225 8 0 "[ . 1]"
4 19 PHE 6.204 0.503 10 1 "[ . +]"
4 20 PHE 1.807 0.153 10 0 "[ . 1]"
4 21 ALA 7.569 0.447 6 0 "[ . 1]"
4 22 GLU 4.104 0.327 8 0 "[ . 1]"
4 23 ASP 1.599 0.390 10 0 "[ . 1]"
4 24 VAL 1.599 0.390 10 0 "[ . 1]"
4 29 GLY 3.541 0.372 5 0 "[ . 1]"
4 30 ALA 9.685 0.454 1 0 "[ . 1]"
4 31 ILE 8.879 0.646 6 3 "[- .+ * 1]"
4 32 ILE 7.314 0.443 8 0 "[ . 1]"
4 33 GLY 3.260 0.237 1 0 "[ . 1]"
4 34 LEU 7.968 0.341 8 0 "[ . 1]"
4 35 MET 10.515 0.368 3 0 "[ . 1]"
4 36 VAL 8.843 0.458 2 0 "[ . 1]"
4 37 GLY 5.179 0.448 1 0 "[ . 1]"
4 38 GLY 3.677 0.355 9 0 "[ . 1]"
4 39 VAL 15.407 1.275 4 5 "[ -+.** *1]"
4 40 VAL 0.194 0.127 3 0 "[ . 1]"
5 12 VAL 6.068 0.605 2 2 "[ + . - 1]"
5 13 HIS 0.415 0.094 4 0 "[ . 1]"
5 15 GLN 6.202 0.353 5 0 "[ . 1]"
5 16 LYS 7.879 0.353 5 0 "[ . 1]"
5 17 LEU 6.947 0.377 3 0 "[ . 1]"
5 18 VAL 2.194 0.175 10 0 "[ . 1]"
5 19 PHE 7.950 0.504 4 1 "[ +. 1]"
5 20 PHE 2.255 0.194 1 0 "[ . 1]"
5 21 ALA 6.337 0.338 5 0 "[ . 1]"
5 22 GLU 4.949 0.447 6 0 "[ . 1]"
5 23 ASP 2.110 0.703 3 2 "[ + .- 1]"
5 24 VAL 2.110 0.703 3 2 "[ + .- 1]"
5 29 GLY 3.950 0.431 2 0 "[ . 1]"
5 30 ALA 10.672 0.454 1 0 "[ . 1]"
5 31 ILE 8.263 0.645 6 3 "[ -+ * 1]"
5 32 ILE 0.869 0.142 4 0 "[ . 1]"
5 33 GLY 3.144 0.248 3 0 "[ . 1]"
5 34 LEU 6.524 1.190 3 1 "[ + . 1]"
5 35 MET 10.637 0.490 3 0 "[ . 1]"
5 36 VAL 5.897 1.340 3 1 "[ + . 1]"
5 37 GLY 4.238 0.448 9 0 "[ . 1]"
5 38 GLY 2.413 0.264 5 0 "[ . 1]"
5 39 VAL 10.348 0.698 4 4 "[ -+.* *1]"
6 12 VAL 2.683 0.508 7 1 "[ . + 1]"
6 13 HIS 0.194 0.127 3 0 "[ . 1]"
6 15 GLN 5.645 0.350 4 0 "[ . 1]"
6 16 LYS 7.254 0.350 4 0 "[ . 1]"
6 17 LEU 3.742 0.430 4 0 "[ . 1]"
6 18 VAL 1.109 0.175 10 0 "[ . 1]"
6 19 PHE 5.766 0.458 2 0 "[ . 1]"
6 20 PHE 3.135 0.303 8 0 "[ . 1]"
6 21 ALA 0.736 0.175 10 0 "[ . 1]"
6 22 GLU 2.787 0.338 5 0 "[ . 1]"
6 23 ASP 1.852 0.504 10 1 "[ . +]"
6 24 VAL 1.852 0.504 10 1 "[ . +]"
6 29 GLY 4.027 0.398 8 0 "[ . 1]"
6 30 ALA 6.739 0.398 8 0 "[ . 1]"
6 31 ILE 6.841 0.576 6 1 "[ .+ 1]"
6 33 GLY 2.245 1.190 3 1 "[ + . 1]"
6 34 LEU 1.263 0.227 6 0 "[ . 1]"
6 35 MET 10.013 1.340 3 1 "[ + . 1]"
6 36 VAL 1.856 0.456 5 0 "[ . 1]"
6 37 GLY 2.757 0.456 5 0 "[ . 1]"
6 38 GLY 2.251 0.324 3 0 "[ . 1]"
6 39 VAL 6.744 0.567 9 1 "[ . +1]"
7 12 VAL 1.519 0.261 6 0 "[ . 1]"
7 15 GLN 1.732 0.198 7 0 "[ . 1]"
7 16 LYS 1.732 0.198 7 0 "[ . 1]"
7 17 LEU 1.991 0.176 6 0 "[ . 1]"
7 18 VAL 0.177 0.086 9 0 "[ . 1]"
7 19 PHE 0.977 0.170 5 0 "[ . 1]"
7 21 ALA 2.459 0.196 4 0 "[ . 1]"
7 23 ASP 2.217 0.382 5 0 "[ . 1]"
7 24 VAL 2.217 0.382 5 0 "[ . 1]"
7 29 GLY 2.692 0.328 2 0 "[ . 1]"
7 30 ALA 8.567 0.491 6 0 "[ . 1]"
7 31 ILE 4.192 0.412 3 0 "[ . 1]"
7 32 ILE 5.981 0.262 10 0 "[ . 1]"
7 34 LEU 10.854 0.395 8 0 "[ . 1]"
7 35 MET 6.501 0.395 8 0 "[ . 1]"
7 36 VAL 7.712 0.410 8 0 "[ . 1]"
7 37 GLY 4.303 0.410 8 0 "[ . 1]"
7 38 GLY 2.885 0.344 8 0 "[ . 1]"
7 39 VAL 7.404 0.502 1 1 "[+ . 1]"
7 40 VAL 0.283 0.126 7 0 "[ . 1]"
8 12 VAL 3.561 0.355 2 0 "[ . 1]"
8 15 GLN 2.368 0.271 8 0 "[ . 1]"
8 16 LYS 3.236 0.271 8 0 "[ . 1]"
8 17 LEU 3.304 0.222 1 0 "[ . 1]"
8 18 VAL 1.924 0.173 9 0 "[ . 1]"
8 19 PHE 0.478 0.121 5 0 "[ . 1]"
8 20 PHE 1.085 0.170 5 0 "[ . 1]"
8 21 ALA 4.904 0.400 6 0 "[ . 1]"
8 22 GLU 1.933 0.196 4 0 "[ . 1]"
8 23 ASP 2.077 0.357 9 0 "[ . 1]"
8 24 VAL 2.077 0.357 9 0 "[ . 1]"
8 29 GLY 2.742 0.420 6 0 "[ . 1]"
8 30 ALA 9.167 0.491 6 0 "[ . 1]"
8 31 ILE 7.623 0.426 6 0 "[ . 1]"
8 32 ILE 7.099 0.373 4 0 "[ . 1]"
8 33 GLY 5.025 0.276 8 0 "[ . 1]"
8 34 LEU 9.733 0.385 5 0 "[ . 1]"
8 35 MET 12.151 0.385 5 0 "[ . 1]"
8 36 VAL 9.247 0.449 1 0 "[ . 1]"
8 37 GLY 4.192 0.449 1 0 "[ . 1]"
8 38 GLY 3.431 0.388 2 0 "[ . 1]"
8 39 VAL 12.934 0.554 6 4 "[- *.+* 1]"
8 40 VAL 0.329 0.122 10 0 "[ . 1]"
9 12 VAL 5.366 0.518 8 1 "[ . + 1]"
9 13 HIS 0.283 0.126 7 0 "[ . 1]"
9 15 GLN 5.490 0.350 9 0 "[ . 1]"
9 16 LYS 6.206 0.350 9 0 "[ . 1]"
9 17 LEU 6.420 0.289 2 0 "[ . 1]"
9 18 VAL 2.113 0.155 9 0 "[ . 1]"
9 19 PHE 6.749 0.369 10 0 "[ . 1]"
9 20 PHE 1.141 0.166 4 0 "[ . 1]"
9 21 ALA 6.441 0.394 6 0 "[ . 1]"
9 22 GLU 3.508 0.400 6 0 "[ . 1]"
9 23 ASP 2.567 0.679 10 1 "[ . +]"
9 24 VAL 2.567 0.679 10 1 "[ . +]"
9 29 GLY 3.812 0.370 4 0 "[ . 1]"
9 30 ALA 10.259 0.386 6 0 "[ . 1]"
9 31 ILE 10.023 0.494 6 0 "[ . 1]"
9 32 ILE 7.725 0.602 5 1 "[ + 1]"
9 33 GLY 4.114 0.280 2 0 "[ . 1]"
9 34 LEU 7.077 0.380 3 0 "[ . 1]"
9 35 MET 12.281 0.380 3 0 "[ . 1]"
9 36 VAL 8.917 0.508 10 1 "[ . +]"
9 37 GLY 4.213 0.390 10 0 "[ . 1]"
9 38 GLY 2.554 0.385 7 0 "[ . 1]"
9 39 VAL 13.456 0.903 6 4 "[ **.+- 1]"
9 40 VAL 0.266 0.088 4 0 "[ . 1]"
10 12 VAL 5.890 0.518 8 1 "[ . + 1]"
10 13 HIS 0.329 0.122 10 0 "[ . 1]"
10 15 GLN 5.239 0.322 5 0 "[ . 1]"
10 16 LYS 5.687 0.310 2 0 "[ . 1]"
10 17 LEU 7.824 0.373 4 0 "[ . 1]"
10 18 VAL 3.331 0.289 2 0 "[ . 1]"
10 19 PHE 6.954 0.418 3 0 "[ . 1]"
10 20 PHE 1.753 0.192 4 0 "[ . 1]"
10 21 ALA 8.332 0.540 9 2 "[ .- +1]"
10 22 GLU 3.675 0.394 6 0 "[ . 1]"
10 23 ASP 1.837 0.716 6 1 "[ .+ 1]"
10 24 VAL 1.837 0.716 6 1 "[ .+ 1]"
10 29 GLY 3.955 0.463 7 0 "[ . 1]"
10 30 ALA 11.449 0.463 7 0 "[ . 1]"
10 31 ILE 11.498 1.275 4 2 "[ +. - 1]"
10 32 ILE 7.123 0.364 9 0 "[ . 1]"
10 33 GLY 3.469 0.285 8 0 "[ . 1]"
10 34 LEU 7.314 0.317 5 0 "[ . 1]"
10 35 MET 9.379 0.352 6 0 "[ . 1]"
10 36 VAL 8.152 0.477 9 0 "[ . 1]"
10 37 GLY 3.074 0.421 9 0 "[ . 1]"
10 38 GLY 3.060 0.406 8 0 "[ . 1]"
10 39 VAL 14.598 1.231 6 4 "[ * *+* 1]"
10 40 VAL 0.453 0.242 7 0 "[ . 1]"
11 12 VAL 4.734 0.370 9 0 "[ . 1]"
11 13 HIS 0.266 0.088 4 0 "[ . 1]"
11 15 GLN 5.787 0.355 1 0 "[ . 1]"
11 16 LYS 7.134 0.355 1 0 "[ . 1]"
11 17 LEU 8.164 0.602 5 1 "[ + 1]"
11 18 VAL 3.416 0.176 9 0 "[ . 1]"
11 19 PHE 7.227 0.508 10 1 "[ . +]"
11 20 PHE 1.981 0.188 4 0 "[ . 1]"
11 21 ALA 7.255 0.427 3 0 "[ . 1]"
11 22 GLU 5.382 0.540 9 2 "[ .- +1]"
11 23 ASP 2.803 0.702 7 2 "[ . + -1]"
11 24 VAL 2.803 0.702 7 2 "[ . + -1]"
11 29 GLY 3.458 0.398 7 0 "[ . 1]"
11 30 ALA 9.504 0.398 7 0 "[ . 1]"
11 31 ILE 8.766 0.698 4 3 "[ +.* -1]"
11 32 ILE 0.863 0.133 7 0 "[ . 1]"
11 33 GLY 2.600 0.185 6 0 "[ . 1]"
11 34 LEU 4.292 0.296 8 0 "[ . 1]"
11 35 MET 8.910 0.300 4 0 "[ . 1]"
11 36 VAL 2.597 0.442 4 0 "[ . 1]"
11 37 GLY 3.153 0.442 4 0 "[ . 1]"
11 38 GLY 2.279 0.296 6 0 "[ . 1]"
11 39 VAL 10.303 0.760 7 4 "[* .*+* 1]"
12 12 VAL 2.168 0.370 9 0 "[ . 1]"
12 13 HIS 0.453 0.242 7 0 "[ . 1]"
12 15 GLN 5.961 0.329 5 0 "[ . 1]"
12 16 LYS 7.963 0.329 5 0 "[ . 1]"
12 17 LEU 4.211 0.364 9 0 "[ . 1]"
12 18 VAL 1.557 0.176 9 0 "[ . 1]"
12 19 PHE 6.478 0.477 9 0 "[ . 1]"
12 20 PHE 2.532 0.372 4 0 "[ . 1]"
12 21 ALA 0.752 0.268 6 0 "[ . 1]"
12 22 GLU 4.277 0.427 3 0 "[ . 1]"
12 23 ASP 1.131 0.226 10 0 "[ . 1]"
12 24 VAL 1.131 0.226 10 0 "[ . 1]"
12 29 GLY 3.622 0.396 3 0 "[ . 1]"
12 30 ALA 6.061 0.396 3 0 "[ . 1]"
12 31 ILE 6.659 0.567 9 1 "[ . +1]"
12 33 GLY 0.388 0.064 3 0 "[ . 1]"
12 34 LEU 1.044 0.179 7 0 "[ . 1]"
12 35 MET 5.060 0.196 4 0 "[ . 1]"
12 36 VAL 1.473 0.457 3 0 "[ . 1]"
12 37 GLY 2.126 0.457 3 0 "[ . 1]"
12 38 GLY 2.326 0.335 7 0 "[ . 1]"
12 39 VAL 7.221 0.559 1 2 "[+ . - 1]"
13 12 VAL 1.155 0.200 2 0 "[ . 1]"
13 15 GLN 2.564 0.274 3 0 "[ . 1]"
13 16 LYS 2.564 0.274 3 0 "[ . 1]"
13 17 LEU 1.597 0.157 4 0 "[ . 1]"
13 18 VAL 0.010 0.010 7 0 "[ . 1]"
13 19 PHE 0.555 0.075 9 0 "[ . 1]"
13 21 ALA 2.107 0.175 1 0 "[ . 1]"
13 23 ASP 2.395 0.401 7 0 "[ . 1]"
13 24 VAL 2.395 0.401 7 0 "[ . 1]"
13 29 GLY 3.038 0.390 5 0 "[ . 1]"
13 30 ALA 8.351 0.542 2 1 "[ + . 1]"
13 31 ILE 4.401 0.542 2 1 "[ + . 1]"
13 32 ILE 6.311 0.291 2 0 "[ . 1]"
13 34 LEU 9.739 0.359 9 0 "[ . 1]"
13 35 MET 5.988 0.359 9 0 "[ . 1]"
13 36 VAL 8.642 0.432 10 0 "[ . 1]"
13 37 GLY 4.375 0.391 2 0 "[ . 1]"
13 38 GLY 2.779 0.353 10 0 "[ . 1]"
13 39 VAL 7.096 0.552 4 1 "[ +. 1]"
13 40 VAL 0.188 0.056 3 0 "[ . 1]"
14 12 VAL 3.298 0.438 2 0 "[ . 1]"
14 15 GLN 2.338 0.269 1 0 "[ . 1]"
14 16 LYS 3.160 0.269 1 0 "[ . 1]"
14 17 LEU 2.805 0.253 5 0 "[ . 1]"
14 18 VAL 1.267 0.157 4 0 "[ . 1]"
14 19 PHE 0.421 0.099 2 0 "[ . 1]"
14 20 PHE 0.437 0.074 7 0 "[ . 1]"
14 21 ALA 3.063 0.217 5 0 "[ . 1]"
14 22 GLU 1.752 0.175 1 0 "[ . 1]"
14 23 ASP 2.566 0.408 7 0 "[ . 1]"
14 24 VAL 2.566 0.408 7 0 "[ . 1]"
14 29 GLY 2.020 0.230 7 0 "[ . 1]"
14 30 ALA 8.026 0.402 5 0 "[ . 1]"
14 31 ILE 7.632 0.554 6 1 "[ .+ 1]"
14 32 ILE 6.569 0.455 1 0 "[ . 1]"
14 33 GLY 4.095 0.243 5 0 "[ . 1]"
14 34 LEU 8.524 0.454 9 0 "[ . 1]"
14 35 MET 12.117 0.454 9 0 "[ . 1]"
14 36 VAL 9.433 0.479 10 0 "[ . 1]"
14 37 GLY 4.716 0.413 1 0 "[ . 1]"
14 38 GLY 2.929 0.344 5 0 "[ . 1]"
14 39 VAL 11.293 0.552 4 1 "[ +. 1]"
14 40 VAL 0.405 0.170 8 0 "[ . 1]"
15 12 VAL 5.434 0.494 2 0 "[ . 1]"
15 13 HIS 0.188 0.056 3 0 "[ . 1]"
15 15 GLN 5.452 0.432 10 0 "[ . 1]"
15 16 LYS 5.751 0.346 2 0 "[ . 1]"
15 17 LEU 6.704 0.291 2 0 "[ . 1]"
15 18 VAL 1.757 0.204 1 0 "[ . 1]"
15 19 PHE 6.876 0.384 5 0 "[ . 1]"
15 20 PHE 0.959 0.156 2 0 "[ . 1]"
15 21 ALA 5.748 0.378 6 0 "[ . 1]"
15 22 GLU 1.613 0.217 5 0 "[ . 1]"
15 23 ASP 1.284 0.311 1 0 "[ . 1]"
15 24 VAL 1.284 0.311 1 0 "[ . 1]"
15 29 GLY 3.017 0.556 2 1 "[ + . 1]"
15 30 ALA 9.305 0.556 2 1 "[ + . 1]"
15 31 ILE 9.076 0.903 6 1 "[ .+ 1]"
15 32 ILE 7.029 0.490 1 0 "[ . 1]"
15 33 GLY 3.599 0.260 7 0 "[ . 1]"
15 34 LEU 7.682 0.319 10 0 "[ . 1]"
15 35 MET 11.617 0.319 10 0 "[ . 1]"
15 36 VAL 9.663 0.473 8 0 "[ . 1]"
15 37 GLY 4.547 0.435 2 0 "[ . 1]"
15 38 GLY 3.324 0.400 1 0 "[ . 1]"
15 39 VAL 14.522 0.801 5 3 "[ *+ - 1]"
15 40 VAL 0.556 0.230 8 0 "[ . 1]"
16 12 VAL 6.581 0.494 2 0 "[ . 1]"
16 13 HIS 0.405 0.170 8 0 "[ . 1]"
16 15 GLN 5.940 0.363 6 0 "[ . 1]"
16 16 LYS 7.276 0.363 6 0 "[ . 1]"
16 17 LEU 7.414 0.455 1 0 "[ . 1]"
16 18 VAL 2.257 0.244 5 0 "[ . 1]"
16 19 PHE 6.698 0.479 10 0 "[ . 1]"
16 20 PHE 1.366 0.137 9 0 "[ . 1]"
16 21 ALA 6.871 0.373 9 0 "[ . 1]"
16 22 GLU 3.771 0.378 6 0 "[ . 1]"
16 23 ASP 1.724 0.374 3 0 "[ . 1]"
16 24 VAL 1.724 0.374 3 0 "[ . 1]"
16 29 GLY 3.106 0.442 3 0 "[ . 1]"
16 30 ALA 9.280 0.442 3 0 "[ . 1]"
16 31 ILE 11.332 1.231 6 3 "[ -+* 1]"
16 32 ILE 6.705 0.428 5 0 "[ . 1]"
16 33 GLY 2.706 0.266 2 0 "[ . 1]"
16 34 LEU 6.708 0.403 6 0 "[ . 1]"
16 35 MET 9.708 0.403 6 0 "[ . 1]"
16 36 VAL 8.127 0.478 1 0 "[ . 1]"
16 37 GLY 3.749 0.441 7 0 "[ . 1]"
16 38 GLY 3.439 0.385 5 0 "[ . 1]"
16 39 VAL 14.429 0.910 8 4 "[- ** + 1]"
16 40 VAL 0.554 0.175 6 0 "[ . 1]"
17 12 VAL 6.066 0.428 3 0 "[ . 1]"
17 13 HIS 0.556 0.230 8 0 "[ . 1]"
17 15 GLN 5.698 0.361 3 0 "[ . 1]"
17 16 LYS 7.144 0.361 3 0 "[ . 1]"
17 17 LEU 7.947 0.490 1 0 "[ . 1]"
17 18 VAL 2.166 0.180 1 0 "[ . 1]"
17 19 PHE 7.377 0.473 8 0 "[ . 1]"
17 20 PHE 2.213 0.260 3 0 "[ . 1]"
17 21 ALA 5.444 0.348 5 0 "[ . 1]"
17 22 GLU 3.859 0.373 9 0 "[ . 1]"
17 23 ASP 1.308 0.294 7 0 "[ . 1]"
17 24 VAL 1.308 0.294 7 0 "[ . 1]"
17 29 GLY 3.256 0.347 8 0 "[ . 1]"
17 30 ALA 7.738 0.347 8 0 "[ . 1]"
17 31 ILE 6.989 0.583 6 3 "[ .+-* 1]"
17 32 ILE 0.796 0.114 5 0 "[ . 1]"
17 33 GLY 1.944 0.166 2 0 "[ . 1]"
17 34 LEU 4.037 0.291 6 0 "[ . 1]"
17 35 MET 8.410 0.295 5 0 "[ . 1]"
17 36 VAL 3.517 0.484 2 0 "[ . 1]"
17 37 GLY 3.901 0.484 2 0 "[ . 1]"
17 38 GLY 2.196 0.262 6 0 "[ . 1]"
17 39 VAL 11.002 0.910 8 3 "[ -* + 1]"
18 12 VAL 2.776 0.376 1 0 "[ . 1]"
18 13 HIS 0.554 0.175 6 0 "[ . 1]"
18 15 GLN 5.438 0.339 1 0 "[ . 1]"
18 16 LYS 7.637 0.339 1 0 "[ . 1]"
18 17 LEU 3.575 0.428 5 0 "[ . 1]"
18 18 VAL 1.436 0.166 7 0 "[ . 1]"
18 19 PHE 6.854 0.478 1 0 "[ . 1]"
18 20 PHE 2.758 0.313 2 0 "[ . 1]"
18 21 ALA 0.383 0.078 8 0 "[ . 1]"
18 22 GLU 2.712 0.348 5 0 "[ . 1]"
18 23 ASP 1.740 0.655 10 1 "[ . +]"
18 24 VAL 1.740 0.655 10 1 "[ . +]"
18 29 GLY 3.906 0.363 3 0 "[ . 1]"
18 30 ALA 6.062 0.363 3 0 "[ . 1]"
18 31 ILE 5.613 0.545 7 1 "[ . + 1]"
18 33 GLY 0.682 0.126 8 0 "[ . 1]"
18 34 LEU 1.423 0.220 6 0 "[ . 1]"
18 35 MET 5.565 0.220 6 0 "[ . 1]"
18 36 VAL 1.610 0.460 1 0 "[ . 1]"
18 37 GLY 2.345 0.460 1 0 "[ . 1]"
18 38 GLY 2.822 0.268 7 0 "[ . 1]"
18 39 VAL 7.869 0.576 6 1 "[ .+ 1]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 12 VAL C 2 12 VAL C 4.650 4.500 4.800 4.917 4.824 5.031 0.231 10 0 "[ . 1]" 1
2 1 15 GLN C 1 16 LYS C 3.100 2.900 3.300 3.242 3.151 3.572 0.272 10 0 "[ . 1]" 1
3 1 15 GLN N 1 16 LYS N 3.300 3.200 3.400 3.565 3.543 3.597 0.197 2 0 "[ . 1]" 1
4 1 17 LEU C 2 18 VAL N 4.000 3.900 4.100 4.058 3.926 4.181 0.081 2 0 "[ . 1]" 1
5 1 17 LEU H 2 16 LYS O 1.800 . 1.900 2.045 1.978 2.149 0.249 8 0 "[ . 1]" 1
6 1 17 LEU N 2 16 LYS C 4.000 3.900 4.100 4.044 3.952 4.175 0.075 10 0 "[ . 1]" 1
7 1 17 LEU O 2 18 VAL H 1.800 . 1.900 1.968 1.819 2.036 0.136 2 0 "[ . 1]" 1
8 1 18 VAL C 2 18 VAL C 4.650 4.500 4.800 4.758 4.621 4.930 0.130 2 0 "[ . 1]" 1
9 1 19 PHE C 2 20 PHE N 4.000 3.900 4.100 4.047 3.910 4.137 0.037 2 0 "[ . 1]" 1
10 1 19 PHE H 2 18 VAL O 1.800 . 1.900 1.925 1.764 1.986 0.086 2 0 "[ . 1]" 1
11 1 19 PHE N 2 18 VAL C 4.000 3.900 4.100 4.023 3.894 4.170 0.070 2 0 "[ . 1]" 1
12 1 19 PHE O 2 20 PHE H 1.800 . 1.900 1.890 1.721 2.014 0.114 2 0 "[ . 1]" 1
13 1 21 ALA C 2 22 GLU N 4.000 3.900 4.100 4.153 3.978 4.275 0.175 2 0 "[ . 1]" 1
14 1 21 ALA CB 2 21 ALA CB 4.650 4.500 4.800 4.681 4.474 4.881 0.081 4 0 "[ . 1]" 1
15 1 21 ALA H 2 20 PHE O 1.800 . 1.900 1.885 1.681 2.018 0.118 9 0 "[ . 1]" 1
16 1 21 ALA N 2 20 PHE C 4.000 3.900 4.100 4.027 3.835 4.154 0.065 8 0 "[ . 1]" 1
17 1 21 ALA O 2 22 GLU H 1.800 . 1.900 2.006 1.907 2.131 0.231 2 0 "[ . 1]" 1
18 1 23 ASP C 1 24 VAL C 2.750 2.600 2.900 3.156 3.036 3.288 0.388 8 0 "[ . 1]" 1
19 1 23 ASP N 1 24 VAL N 2.950 2.800 3.100 2.882 2.777 2.964 0.023 4 0 "[ . 1]" 1
20 1 29 GLY C 1 30 ALA C 3.500 3.400 3.600 3.434 3.189 3.740 0.211 9 0 "[ . 1]" 1
21 1 29 GLY N 1 30 ALA N 3.450 3.300 3.600 3.160 3.009 3.304 0.291 1 0 "[ . 1]" 1
22 1 30 ALA C 2 30 ALA C 4.650 4.500 4.800 4.833 4.539 5.050 0.250 4 0 "[ . 1]" 1
23 1 30 ALA C 2 31 ILE N 4.000 3.900 4.100 4.200 3.929 4.422 0.322 4 0 "[ . 1]" 1
24 1 30 ALA N 1 31 ILE N 3.450 3.400 3.500 3.227 2.792 3.552 0.608 9 1 "[ . +1]" 1
25 1 30 ALA O 2 31 ILE H 1.800 . 1.900 2.161 1.847 2.427 0.527 4 1 "[ +. 1]" 1
26 1 31 ILE CB 13 39 VAL CB 4.500 3.000 6.000 6.047 5.718 6.259 0.259 2 0 "[ . 1]" 1
27 1 31 ILE CD1 13 39 VAL CB 4.500 3.000 6.000 4.173 3.636 4.929 . 0 0 "[ . 1]" 1
28 1 31 ILE CD1 13 39 VAL N 3.000 . 4.000 4.056 3.623 4.347 0.347 6 0 "[ . 1]" 1
29 1 31 ILE CG1 13 39 VAL CB 4.500 3.000 6.000 5.260 4.620 5.758 . 0 0 "[ . 1]" 1
30 1 32 ILE C 2 33 GLY N 4.000 3.900 4.100 3.755 3.701 3.812 0.199 10 0 "[ . 1]" 1
31 1 32 ILE CD1 3 17 LEU CB 5.500 3.000 8.000 8.113 8.053 8.173 0.173 4 0 "[ . 1]" 1
32 1 32 ILE CD1 3 19 PHE CZ 4.500 3.000 6.000 4.717 4.262 4.983 . 0 0 "[ . 1]" 1
33 1 32 ILE CG1 3 19 PHE CZ 4.500 3.000 6.000 5.722 5.042 5.988 . 0 0 "[ . 1]" 1
34 1 32 ILE CG2 3 17 LEU CB 5.500 3.000 8.000 8.179 8.054 8.302 0.302 1 0 "[ . 1]" 1
35 1 32 ILE CG2 3 19 PHE CZ 4.500 3.000 6.000 4.717 4.322 4.897 . 0 0 "[ . 1]" 1
36 1 32 ILE H 2 31 ILE O 1.800 . 1.900 1.967 1.902 2.066 0.166 2 0 "[ . 1]" 1
37 1 32 ILE N 2 31 ILE C 4.000 3.900 4.100 4.109 4.057 4.212 0.112 2 0 "[ . 1]" 1
38 1 32 ILE O 2 33 GLY H 1.800 . 1.900 1.712 1.650 1.875 0.050 2 0 "[ . 1]" 1
39 1 34 LEU C 2 35 MET N 4.000 3.900 4.100 4.187 4.100 4.259 0.159 5 0 "[ . 1]" 1
40 1 34 LEU CB 3 19 PHE CZ 4.500 3.000 6.000 6.004 5.804 6.123 0.123 8 0 "[ . 1]" 1
41 1 34 LEU CG 3 19 PHE CZ 4.500 3.000 6.000 6.147 6.085 6.261 0.261 7 0 "[ . 1]" 1
42 1 34 LEU H 2 33 GLY O 1.800 . 1.900 2.117 2.080 2.158 0.258 9 0 "[ . 1]" 1
43 1 34 LEU N 1 35 MET CE 6.000 5.000 7.000 7.258 7.107 7.470 0.470 7 0 "[ . 1]" 1
44 1 34 LEU N 2 33 GLY C 4.000 3.900 4.100 4.243 4.206 4.287 0.187 3 0 "[ . 1]" 1
45 1 34 LEU O 2 35 MET H 1.800 . 1.900 2.062 2.005 2.140 0.240 7 0 "[ . 1]" 1
46 1 35 MET C 2 35 MET C 4.650 4.500 4.800 4.879 4.784 4.956 0.156 10 0 "[ . 1]" 1
47 1 35 MET CE 1 37 GLY N 6.000 5.000 7.000 7.224 7.061 7.410 0.410 7 0 "[ . 1]" 1
48 1 35 MET CE 2 35 MET CE 4.650 4.500 4.800 4.784 4.533 4.981 0.181 3 0 "[ . 1]" 1
49 1 36 VAL C 1 37 GLY C 3.100 3.000 3.200 3.484 3.090 3.642 0.442 9 0 "[ . 1]" 1
50 1 36 VAL CB 3 19 PHE CZ 4.500 3.000 6.000 6.282 6.107 6.503 0.503 1 1 "[+ . 1]" 1
51 1 36 VAL CG1 3 15 GLN CG 4.500 3.000 6.000 4.685 3.613 6.052 0.052 1 0 "[ . 1]" 1
52 1 36 VAL CG1 3 19 PHE CZ 4.500 3.000 6.000 6.026 5.127 6.367 0.367 2 0 "[ . 1]" 1
53 1 36 VAL CG2 3 15 GLN CG 4.500 3.000 6.000 6.108 6.017 6.265 0.265 10 0 "[ . 1]" 1
54 1 36 VAL CG2 3 19 PHE CZ 4.500 3.000 6.000 5.387 4.950 6.089 0.089 8 0 "[ . 1]" 1
55 1 36 VAL H 2 35 MET O 1.800 . 1.900 1.947 1.856 2.032 0.132 2 0 "[ . 1]" 1
56 1 36 VAL N 1 37 GLY N 3.450 3.300 3.600 3.334 3.252 3.441 0.048 4 0 "[ . 1]" 1
57 1 36 VAL N 2 35 MET C 4.000 3.900 4.100 4.101 3.988 4.167 0.067 2 0 "[ . 1]" 1
58 1 38 GLY C 1 39 VAL C 3.350 3.100 3.600 3.438 3.034 3.604 0.066 5 0 "[ . 1]" 1
59 1 38 GLY N 1 39 VAL N 3.400 3.300 3.500 3.022 2.986 3.076 0.314 4 0 "[ . 1]" 1
60 1 39 VAL C 2 39 VAL C 4.650 4.500 4.800 5.057 4.835 5.566 0.766 6 2 "[ -.+ 1]" 1
61 1 39 VAL CB 7 31 ILE CB 4.500 3.000 6.000 6.067 5.817 6.209 0.209 6 0 "[ . 1]" 1
62 1 39 VAL CB 7 31 ILE CD1 4.500 3.000 6.000 3.964 3.515 4.776 . 0 0 "[ . 1]" 1
63 1 39 VAL CB 7 31 ILE CG1 4.500 3.000 6.000 5.256 4.585 5.699 . 0 0 "[ . 1]" 1
64 1 39 VAL N 7 31 ILE CD1 3.000 . 4.000 4.117 3.642 4.269 0.269 6 0 "[ . 1]" 1
65 1 40 VAL C 3 13 HIS CB 4.500 3.000 6.000 5.218 4.631 5.822 . 0 0 "[ . 1]" 1
66 1 40 VAL CG1 3 13 HIS CE1 4.500 3.000 6.000 4.962 3.865 6.096 0.096 4 0 "[ . 1]" 1
67 1 40 VAL CG2 3 13 HIS CE1 4.500 3.000 6.000 5.387 3.717 6.056 0.056 2 0 "[ . 1]" 1
68 2 12 VAL C 3 12 VAL C 4.650 4.500 4.800 5.034 4.852 5.231 0.431 8 0 "[ . 1]" 1
69 2 15 GLN C 2 16 LYS C 3.100 2.900 3.300 3.319 3.214 3.592 0.292 10 0 "[ . 1]" 1
70 2 15 GLN N 2 16 LYS N 3.300 3.200 3.400 3.577 3.544 3.621 0.221 6 0 "[ . 1]" 1
71 2 17 LEU C 3 18 VAL N 4.000 3.900 4.100 4.111 4.014 4.231 0.131 2 0 "[ . 1]" 1
72 2 17 LEU H 3 16 LYS O 1.800 . 1.900 2.076 2.005 2.228 0.328 4 0 "[ . 1]" 1
73 2 17 LEU N 3 16 LYS C 4.000 3.900 4.100 4.148 4.044 4.237 0.137 4 0 "[ . 1]" 1
74 2 17 LEU O 3 18 VAL H 1.800 . 1.900 1.967 1.843 2.103 0.203 5 0 "[ . 1]" 1
75 2 18 VAL C 3 18 VAL C 4.650 4.500 4.800 4.828 4.762 4.906 0.106 2 0 "[ . 1]" 1
76 2 19 PHE C 3 20 PHE N 4.000 3.900 4.100 3.952 3.881 4.092 0.019 7 0 "[ . 1]" 1
77 2 19 PHE H 3 18 VAL O 1.800 . 1.900 1.888 1.745 2.026 0.126 10 0 "[ . 1]" 1
78 2 19 PHE N 3 18 VAL C 4.000 3.900 4.100 4.042 3.932 4.178 0.078 10 0 "[ . 1]" 1
79 2 19 PHE O 3 20 PHE H 1.800 . 1.900 1.787 1.713 1.933 0.033 4 0 "[ . 1]" 1
80 2 21 ALA C 3 22 GLU N 4.000 3.900 4.100 4.194 4.000 4.349 0.249 7 0 "[ . 1]" 1
81 2 21 ALA CB 3 21 ALA CB 4.650 4.500 4.800 4.697 4.422 4.901 0.101 3 0 "[ . 1]" 1
82 2 21 ALA H 3 20 PHE O 1.800 . 1.900 1.991 1.697 2.130 0.230 8 0 "[ . 1]" 1
83 2 21 ALA N 3 20 PHE C 4.000 3.900 4.100 4.075 3.888 4.183 0.083 8 0 "[ . 1]" 1
84 2 21 ALA O 3 22 GLU H 1.800 . 1.900 2.047 1.968 2.137 0.237 4 0 "[ . 1]" 1
85 2 23 ASP C 2 24 VAL C 2.750 2.600 2.900 3.087 2.918 3.357 0.457 2 0 "[ . 1]" 1
86 2 23 ASP N 2 24 VAL N 2.950 2.800 3.100 2.905 2.792 3.063 0.008 9 0 "[ . 1]" 1
87 2 29 GLY C 2 30 ALA C 3.500 3.400 3.600 3.327 2.953 3.619 0.447 1 0 "[ . 1]" 1
88 2 29 GLY N 2 30 ALA N 3.450 3.300 3.600 3.243 3.060 3.436 0.240 9 0 "[ . 1]" 1
89 2 30 ALA C 3 30 ALA C 4.650 4.500 4.800 4.901 4.784 5.006 0.206 4 0 "[ . 1]" 1
90 2 30 ALA C 3 31 ILE N 4.000 3.900 4.100 4.292 4.253 4.361 0.261 4 0 "[ . 1]" 1
91 2 30 ALA N 2 31 ILE N 3.450 3.400 3.500 3.389 3.234 3.638 0.166 1 0 "[ . 1]" 1
92 2 30 ALA O 3 31 ILE H 1.800 . 1.900 2.206 2.125 2.295 0.395 4 0 "[ . 1]" 1
93 2 31 ILE CB 14 39 VAL CB 4.500 3.000 6.000 5.935 5.619 6.202 0.202 7 0 "[ . 1]" 1
94 2 31 ILE CD1 14 39 VAL CB 4.500 3.000 6.000 4.066 3.512 4.776 . 0 0 "[ . 1]" 1
95 2 31 ILE CD1 14 39 VAL N 3.000 . 4.000 4.160 3.743 4.465 0.465 8 0 "[ . 1]" 1
96 2 31 ILE CG1 14 39 VAL CB 4.500 3.000 6.000 4.902 4.186 5.500 . 0 0 "[ . 1]" 1
97 2 32 ILE C 3 33 GLY N 4.000 3.900 4.100 3.841 3.760 3.906 0.140 1 0 "[ . 1]" 1
98 2 32 ILE CD1 4 17 LEU CB 5.500 3.000 8.000 8.271 8.161 8.356 0.356 4 0 "[ . 1]" 1
99 2 32 ILE CD1 4 19 PHE CZ 4.500 3.000 6.000 5.119 4.989 5.250 . 0 0 "[ . 1]" 1
100 2 32 ILE CG1 4 19 PHE CZ 4.500 3.000 6.000 6.051 5.863 6.167 0.167 9 0 "[ . 1]" 1
101 2 32 ILE CG2 4 17 LEU CB 5.500 3.000 8.000 8.113 7.942 8.345 0.345 8 0 "[ . 1]" 1
102 2 32 ILE CG2 4 19 PHE CZ 4.500 3.000 6.000 4.771 4.405 5.080 . 0 0 "[ . 1]" 1
103 2 32 ILE H 3 31 ILE O 1.800 . 1.900 1.959 1.802 2.040 0.140 7 0 "[ . 1]" 1
104 2 32 ILE N 3 31 ILE C 4.000 3.900 4.100 4.106 3.958 4.202 0.102 7 0 "[ . 1]" 1
105 2 32 ILE O 3 33 GLY H 1.800 . 1.900 1.759 1.687 1.922 0.022 8 0 "[ . 1]" 1
106 2 34 LEU C 3 35 MET N 4.000 3.900 4.100 4.213 4.125 4.279 0.179 6 0 "[ . 1]" 1
107 2 34 LEU CB 4 19 PHE CZ 4.500 3.000 6.000 5.256 4.846 5.871 . 0 0 "[ . 1]" 1
108 2 34 LEU CG 4 19 PHE CZ 4.500 3.000 6.000 5.216 5.008 6.028 0.028 6 0 "[ . 1]" 1
109 2 34 LEU H 3 33 GLY O 1.800 . 1.900 2.098 2.020 2.151 0.251 2 0 "[ . 1]" 1
110 2 34 LEU N 2 35 MET CE 6.000 5.000 7.000 7.271 7.065 7.383 0.383 2 0 "[ . 1]" 1
111 2 34 LEU N 3 33 GLY C 4.000 3.900 4.100 4.240 4.201 4.289 0.189 7 0 "[ . 1]" 1
112 2 34 LEU O 3 35 MET H 1.800 . 1.900 2.043 1.966 2.127 0.227 6 0 "[ . 1]" 1
113 2 35 MET C 3 35 MET C 4.650 4.500 4.800 4.930 4.755 5.050 0.250 2 0 "[ . 1]" 1
114 2 35 MET CE 2 37 GLY N 6.000 5.000 7.000 7.156 7.006 7.279 0.279 8 0 "[ . 1]" 1
115 2 35 MET CE 3 35 MET CE 4.650 4.500 4.800 4.920 4.828 5.052 0.252 10 0 "[ . 1]" 1
116 2 36 VAL C 2 37 GLY C 3.100 3.000 3.200 3.531 3.303 3.635 0.435 4 0 "[ . 1]" 1
117 2 36 VAL CB 4 19 PHE CZ 4.500 3.000 6.000 6.281 6.065 6.503 0.503 10 1 "[ . +]" 1
118 2 36 VAL CG1 4 15 GLN CG 4.500 3.000 6.000 5.084 3.681 6.229 0.229 5 0 "[ . 1]" 1
119 2 36 VAL CG1 4 19 PHE CZ 4.500 3.000 6.000 5.906 5.324 6.380 0.380 7 0 "[ . 1]" 1
120 2 36 VAL CG2 4 15 GLN CG 4.500 3.000 6.000 5.657 4.492 6.198 0.198 3 0 "[ . 1]" 1
121 2 36 VAL CG2 4 19 PHE CZ 4.500 3.000 6.000 5.594 4.975 6.292 0.292 6 0 "[ . 1]" 1
122 2 36 VAL H 3 35 MET O 1.800 . 1.900 1.940 1.840 2.027 0.127 7 0 "[ . 1]" 1
123 2 36 VAL N 2 37 GLY N 3.450 3.300 3.600 3.386 3.254 3.596 0.046 9 0 "[ . 1]" 1
124 2 36 VAL N 3 35 MET C 4.000 3.900 4.100 4.086 3.984 4.198 0.098 5 0 "[ . 1]" 1
125 2 38 GLY C 2 39 VAL C 3.350 3.100 3.600 3.569 3.439 3.672 0.072 1 0 "[ . 1]" 1
126 2 38 GLY N 2 39 VAL N 3.400 3.300 3.500 3.022 2.880 3.142 0.420 3 0 "[ . 1]" 1
127 2 39 VAL C 3 39 VAL C 4.650 4.500 4.800 5.164 4.936 5.396 0.596 9 2 "[ .- +1]" 1
128 2 39 VAL CB 8 31 ILE CB 4.500 3.000 6.000 5.658 4.184 6.216 0.216 2 0 "[ . 1]" 1
129 2 39 VAL CB 8 31 ILE CD1 4.500 3.000 6.000 4.149 3.227 4.751 . 0 0 "[ . 1]" 1
130 2 39 VAL CB 8 31 ILE CG1 4.500 3.000 6.000 5.125 4.675 5.592 . 0 0 "[ . 1]" 1
131 2 39 VAL N 8 31 ILE CD1 3.000 . 4.000 4.186 4.022 4.426 0.426 6 0 "[ . 1]" 1
132 2 40 VAL C 4 13 HIS CB 4.500 3.000 6.000 5.334 4.383 6.025 0.025 1 0 "[ . 1]" 1
133 2 40 VAL CG1 4 13 HIS CE1 4.500 3.000 6.000 4.980 3.544 6.059 0.059 8 0 "[ . 1]" 1
134 2 40 VAL CG2 4 13 HIS CE1 4.500 3.000 6.000 5.110 4.005 5.942 . 0 0 "[ . 1]" 1
135 3 12 VAL C 4 12 VAL C 4.650 4.500 4.800 5.116 5.028 5.378 0.578 8 1 "[ . + 1]" 1
136 3 15 GLN C 3 16 LYS C 3.100 2.900 3.300 3.545 3.443 3.642 0.342 4 0 "[ . 1]" 1
137 3 15 GLN N 3 16 LYS N 3.300 3.200 3.400 3.577 3.523 3.627 0.227 7 0 "[ . 1]" 1
138 3 17 LEU C 4 18 VAL N 4.000 3.900 4.100 4.093 3.915 4.183 0.083 3 0 "[ . 1]" 1
139 3 17 LEU H 4 16 LYS O 1.800 . 1.900 2.045 1.990 2.095 0.195 8 0 "[ . 1]" 1
140 3 17 LEU N 4 16 LYS C 4.000 3.900 4.100 4.210 4.160 4.260 0.160 10 0 "[ . 1]" 1
141 3 17 LEU O 4 18 VAL H 1.800 . 1.900 1.989 1.788 2.125 0.225 8 0 "[ . 1]" 1
142 3 18 VAL C 4 18 VAL C 4.650 4.500 4.800 4.749 4.594 4.810 0.010 5 0 "[ . 1]" 1
143 3 19 PHE C 4 20 PHE N 4.000 3.900 4.100 4.069 3.968 4.155 0.055 10 0 "[ . 1]" 1
144 3 19 PHE H 4 18 VAL O 1.800 . 1.900 1.873 1.672 1.983 0.083 7 0 "[ . 1]" 1
145 3 19 PHE N 4 18 VAL C 4.000 3.900 4.100 4.016 3.823 4.115 0.077 8 0 "[ . 1]" 1
146 3 19 PHE O 4 20 PHE H 1.800 . 1.900 1.954 1.881 2.053 0.153 10 0 "[ . 1]" 1
147 3 21 ALA C 4 22 GLU N 4.000 3.900 4.100 4.264 4.030 4.383 0.283 8 0 "[ . 1]" 1
148 3 21 ALA CB 4 21 ALA CB 4.650 4.500 4.800 4.755 4.440 4.971 0.171 2 0 "[ . 1]" 1
149 3 21 ALA H 4 20 PHE O 1.800 . 1.900 1.976 1.884 2.047 0.147 2 0 "[ . 1]" 1
150 3 21 ALA N 4 20 PHE C 4.000 3.900 4.100 4.104 3.881 4.173 0.073 10 0 "[ . 1]" 1
151 3 21 ALA O 4 22 GLU H 1.800 . 1.900 2.140 2.009 2.227 0.327 8 0 "[ . 1]" 1
152 3 23 ASP C 3 24 VAL C 2.750 2.600 2.900 3.156 2.991 3.620 0.720 8 1 "[ . + 1]" 1
153 3 23 ASP N 3 24 VAL N 2.950 2.800 3.100 2.881 2.775 3.145 0.045 7 0 "[ . 1]" 1
154 3 29 GLY C 3 30 ALA C 3.500 3.400 3.600 3.306 3.141 3.509 0.259 3 0 "[ . 1]" 1
155 3 29 GLY N 3 30 ALA N 3.450 3.300 3.600 3.101 2.972 3.232 0.328 7 0 "[ . 1]" 1
156 3 30 ALA C 4 30 ALA C 4.650 4.500 4.800 4.900 4.701 5.062 0.262 1 0 "[ . 1]" 1
157 3 30 ALA C 4 31 ILE N 4.000 3.900 4.100 4.258 4.098 4.354 0.254 5 0 "[ . 1]" 1
158 3 30 ALA N 3 31 ILE N 3.450 3.400 3.500 3.461 3.325 3.596 0.096 10 0 "[ . 1]" 1
159 3 30 ALA O 4 31 ILE H 1.800 . 1.900 2.168 2.029 2.355 0.455 5 0 "[ . 1]" 1
160 3 31 ILE CB 15 39 VAL CB 4.500 3.000 6.000 5.522 4.550 6.140 0.140 3 0 "[ . 1]" 1
161 3 31 ILE CD1 15 39 VAL CB 4.500 3.000 6.000 4.210 3.517 5.156 . 0 0 "[ . 1]" 1
162 3 31 ILE CD1 15 39 VAL N 3.000 . 4.000 4.309 4.127 4.801 0.801 5 1 "[ + 1]" 1
163 3 31 ILE CG1 15 39 VAL CB 4.500 3.000 6.000 5.010 4.128 5.963 . 0 0 "[ . 1]" 1
164 3 32 ILE C 4 33 GLY N 4.000 3.900 4.100 3.943 3.847 4.124 0.053 10 0 "[ . 1]" 1
165 3 32 ILE CD1 5 17 LEU CB 5.500 3.000 8.000 8.313 8.215 8.377 0.377 3 0 "[ . 1]" 1
166 3 32 ILE CD1 5 19 PHE CZ 4.500 3.000 6.000 5.214 4.976 5.650 . 0 0 "[ . 1]" 1
167 3 32 ILE CG1 5 19 PHE CZ 4.500 3.000 6.000 6.086 5.946 6.432 0.432 3 0 "[ . 1]" 1
168 3 32 ILE CG2 5 17 LEU CB 5.500 3.000 8.000 8.097 7.849 8.189 0.189 4 0 "[ . 1]" 1
169 3 32 ILE CG2 5 19 PHE CZ 4.500 3.000 6.000 4.750 4.438 5.025 . 0 0 "[ . 1]" 1
170 3 32 ILE H 4 31 ILE O 1.800 . 1.900 1.903 1.730 2.001 0.101 6 0 "[ . 1]" 1
171 3 32 ILE N 4 31 ILE C 4.000 3.900 4.100 4.076 3.925 4.170 0.070 5 0 "[ . 1]" 1
172 3 32 ILE O 4 33 GLY H 1.800 . 1.900 1.815 1.685 1.947 0.047 4 0 "[ . 1]" 1
173 3 34 LEU C 4 35 MET N 4.000 3.900 4.100 4.221 4.125 4.352 0.252 3 0 "[ . 1]" 1
174 3 34 LEU CB 5 19 PHE CZ 4.500 3.000 6.000 5.122 4.851 5.421 . 0 0 "[ . 1]" 1
175 3 34 LEU CG 5 19 PHE CZ 4.500 3.000 6.000 5.010 4.509 5.796 . 0 0 "[ . 1]" 1
176 3 34 LEU H 4 33 GLY O 1.800 . 1.900 2.067 2.015 2.137 0.237 1 0 "[ . 1]" 1
177 3 34 LEU N 3 35 MET CE 6.000 5.000 7.000 7.216 7.141 7.459 0.459 7 0 "[ . 1]" 1
178 3 34 LEU N 4 33 GLY C 4.000 3.900 4.100 4.228 4.172 4.276 0.176 10 0 "[ . 1]" 1
179 3 34 LEU O 4 35 MET H 1.800 . 1.900 2.068 1.945 2.153 0.253 3 0 "[ . 1]" 1
180 3 35 MET C 4 35 MET C 4.650 4.500 4.800 4.904 4.854 4.975 0.175 1 0 "[ . 1]" 1
181 3 35 MET CE 3 37 GLY N 6.000 5.000 7.000 7.145 6.916 7.234 0.234 1 0 "[ . 1]" 1
182 3 35 MET CE 4 35 MET CE 4.650 4.500 4.800 4.937 4.756 5.138 0.338 1 0 "[ . 1]" 1
183 3 36 VAL C 3 37 GLY C 3.100 3.000 3.200 3.565 3.292 3.640 0.440 3 0 "[ . 1]" 1
184 3 36 VAL CB 5 19 PHE CZ 4.500 3.000 6.000 6.250 6.099 6.437 0.437 9 0 "[ . 1]" 1
185 3 36 VAL CG1 5 15 GLN CG 4.500 3.000 6.000 4.461 3.615 6.137 0.137 4 0 "[ . 1]" 1
186 3 36 VAL CG1 5 19 PHE CZ 4.500 3.000 6.000 6.095 5.295 6.428 0.428 9 0 "[ . 1]" 1
187 3 36 VAL CG2 5 15 GLN CG 4.500 3.000 6.000 5.639 4.533 6.243 0.243 2 0 "[ . 1]" 1
188 3 36 VAL CG2 5 19 PHE CZ 4.500 3.000 6.000 5.533 4.993 6.504 0.504 4 1 "[ +. 1]" 1
189 3 36 VAL H 4 35 MET O 1.800 . 1.900 1.854 1.760 2.040 0.140 7 0 "[ . 1]" 1
190 3 36 VAL N 3 37 GLY N 3.450 3.300 3.600 3.424 3.268 3.544 0.032 9 0 "[ . 1]" 1
191 3 36 VAL N 4 35 MET C 4.000 3.900 4.100 3.961 3.848 4.152 0.052 5 0 "[ . 1]" 1
192 3 38 GLY C 3 39 VAL C 3.350 3.100 3.600 3.426 2.869 3.684 0.231 5 0 "[ . 1]" 1
193 3 38 GLY N 3 39 VAL N 3.400 3.300 3.500 3.019 2.928 3.104 0.372 4 0 "[ . 1]" 1
194 3 39 VAL C 4 39 VAL C 4.650 4.500 4.800 5.178 4.879 5.497 0.697 3 3 "[ + .- *1]" 1
195 3 39 VAL CB 9 31 ILE CB 4.500 3.000 6.000 5.721 4.529 6.164 0.164 8 0 "[ . 1]" 1
196 3 39 VAL CB 9 31 ILE CD1 4.500 3.000 6.000 4.126 3.577 5.211 . 0 0 "[ . 1]" 1
197 3 39 VAL CB 9 31 ILE CG1 4.500 3.000 6.000 5.003 4.217 6.260 0.260 4 0 "[ . 1]" 1
198 3 39 VAL N 9 31 ILE CD1 3.000 . 4.000 4.199 3.797 4.494 0.494 6 0 "[ . 1]" 1
199 3 40 VAL C 5 13 HIS CB 4.500 3.000 6.000 5.442 4.887 6.092 0.092 3 0 "[ . 1]" 1
200 3 40 VAL CG1 5 13 HIS CE1 4.500 3.000 6.000 4.805 3.845 6.004 0.004 7 0 "[ . 1]" 1
201 3 40 VAL CG2 5 13 HIS CE1 4.500 3.000 6.000 5.529 3.850 6.094 0.094 4 0 "[ . 1]" 1
202 4 12 VAL C 5 12 VAL C 4.650 4.500 4.800 5.138 4.964 5.405 0.605 2 1 "[ + . 1]" 1
203 4 15 GLN C 4 16 LYS C 3.100 2.900 3.300 3.614 3.562 3.673 0.373 8 0 "[ . 1]" 1
204 4 15 GLN N 4 16 LYS N 3.300 3.200 3.400 3.595 3.566 3.654 0.254 8 0 "[ . 1]" 1
205 4 17 LEU C 5 18 VAL N 4.000 3.900 4.100 4.131 4.072 4.198 0.098 5 0 "[ . 1]" 1
206 4 17 LEU H 5 16 LYS O 1.800 . 1.900 2.050 1.980 2.137 0.237 9 0 "[ . 1]" 1
207 4 17 LEU N 5 16 LYS C 4.000 3.900 4.100 4.229 4.140 4.294 0.194 9 0 "[ . 1]" 1
208 4 17 LEU O 5 18 VAL H 1.800 . 1.900 1.966 1.889 2.006 0.106 8 0 "[ . 1]" 1
209 4 18 VAL C 5 18 VAL C 4.650 4.500 4.800 4.813 4.717 4.918 0.118 5 0 "[ . 1]" 1
210 4 19 PHE C 5 20 PHE N 4.000 3.900 4.100 4.057 3.917 4.195 0.095 7 0 "[ . 1]" 1
211 4 19 PHE H 5 18 VAL O 1.800 . 1.900 1.899 1.689 1.992 0.092 7 0 "[ . 1]" 1
212 4 19 PHE N 5 18 VAL C 4.000 3.900 4.100 4.028 3.878 4.121 0.022 8 0 "[ . 1]" 1
213 4 19 PHE O 5 20 PHE H 1.800 . 1.900 1.946 1.828 2.051 0.151 7 0 "[ . 1]" 1
214 4 21 ALA C 5 22 GLU N 4.000 3.900 4.100 4.295 4.164 4.461 0.361 6 0 "[ . 1]" 1
215 4 21 ALA CB 5 21 ALA CB 4.650 4.500 4.800 4.728 4.248 4.872 0.252 8 0 "[ . 1]" 1
216 4 21 ALA H 5 20 PHE O 1.800 . 1.900 2.000 1.888 2.094 0.194 1 0 "[ . 1]" 1
217 4 21 ALA N 5 20 PHE C 4.000 3.900 4.100 4.137 4.046 4.183 0.083 10 0 "[ . 1]" 1
218 4 21 ALA O 5 22 GLU H 1.800 . 1.900 2.200 2.019 2.347 0.447 6 0 "[ . 1]" 1
219 4 23 ASP C 4 24 VAL C 2.750 2.600 2.900 3.057 2.867 3.290 0.390 10 0 "[ . 1]" 1
220 4 23 ASP N 4 24 VAL N 2.950 2.800 3.100 2.954 2.851 3.035 . 0 0 "[ . 1]" 1
221 4 29 GLY C 4 30 ALA C 3.500 3.400 3.600 3.410 3.054 3.675 0.346 1 0 "[ . 1]" 1
222 4 29 GLY N 4 30 ALA N 3.450 3.300 3.600 3.057 2.928 3.184 0.372 5 0 "[ . 1]" 1
223 4 30 ALA C 5 30 ALA C 4.650 4.500 4.800 4.932 4.779 5.254 0.454 1 0 "[ . 1]" 1
224 4 30 ALA C 5 31 ILE N 4.000 3.900 4.100 4.219 4.113 4.340 0.240 1 0 "[ . 1]" 1
225 4 30 ALA N 4 31 ILE N 3.450 3.400 3.500 3.505 3.354 3.683 0.183 5 0 "[ . 1]" 1
226 4 30 ALA O 5 31 ILE H 1.800 . 1.900 2.091 1.912 2.254 0.354 9 0 "[ . 1]" 1
227 4 31 ILE CB 16 39 VAL CB 4.500 3.000 6.000 5.572 4.920 6.109 0.109 9 0 "[ . 1]" 1
228 4 31 ILE CD1 16 39 VAL CB 4.500 3.000 6.000 3.848 3.350 4.661 . 0 0 "[ . 1]" 1
229 4 31 ILE CD1 16 39 VAL N 3.000 . 4.000 4.328 4.009 4.646 0.646 6 3 "[- .+ * 1]" 1
230 4 31 ILE CG1 16 39 VAL CB 4.500 3.000 6.000 4.879 4.229 5.824 . 0 0 "[ . 1]" 1
231 4 32 ILE C 5 33 GLY N 4.000 3.900 4.100 3.869 3.722 4.096 0.178 3 0 "[ . 1]" 1
232 4 32 ILE CD1 6 17 LEU CB 5.500 3.000 8.000 8.254 8.157 8.430 0.430 4 0 "[ . 1]" 1
233 4 32 ILE CD1 6 19 PHE CZ 4.500 3.000 6.000 5.394 5.227 5.578 . 0 0 "[ . 1]" 1
234 4 32 ILE CG1 6 19 PHE CZ 4.500 3.000 6.000 6.172 5.974 6.443 0.443 8 0 "[ . 1]" 1
235 4 32 ILE CG2 6 17 LEU CB 5.500 3.000 8.000 8.062 7.608 8.330 0.330 6 0 "[ . 1]" 1
236 4 32 ILE CG2 6 19 PHE CZ 4.500 3.000 6.000 4.877 4.356 5.332 . 0 0 "[ . 1]" 1
237 4 32 ILE H 5 31 ILE O 1.800 . 1.900 1.957 1.744 2.103 0.203 10 0 "[ . 1]" 1
238 4 32 ILE N 5 31 ILE C 4.000 3.900 4.100 4.057 3.925 4.166 0.066 2 0 "[ . 1]" 1
239 4 32 ILE O 5 33 GLY H 1.800 . 1.900 1.736 1.626 1.946 0.074 5 0 "[ . 1]" 1
240 4 34 LEU C 5 35 MET N 4.000 3.900 4.100 4.275 4.157 4.378 0.278 5 0 "[ . 1]" 1
241 4 34 LEU CB 6 19 PHE CZ 4.500 3.000 6.000 5.132 4.505 6.045 0.045 4 0 "[ . 1]" 1
242 4 34 LEU CG 6 19 PHE CZ 4.500 3.000 6.000 4.708 4.496 5.099 . 0 0 "[ . 1]" 1
243 4 34 LEU H 5 33 GLY O 1.800 . 1.900 2.039 1.894 2.148 0.248 3 0 "[ . 1]" 1
244 4 34 LEU N 4 35 MET CE 6.000 5.000 7.000 7.147 7.051 7.292 0.292 10 0 "[ . 1]" 1
245 4 34 LEU N 5 33 GLY C 4.000 3.900 4.100 4.185 3.948 4.274 0.174 5 0 "[ . 1]" 1
246 4 34 LEU O 5 35 MET H 1.800 . 1.900 2.128 2.024 2.241 0.341 8 0 "[ . 1]" 1
247 4 35 MET C 5 35 MET C 4.650 4.500 4.800 4.799 4.657 4.939 0.139 7 0 "[ . 1]" 1
248 4 35 MET CE 4 37 GLY N 6.000 5.000 7.000 7.163 6.908 7.290 0.290 2 0 "[ . 1]" 1
249 4 35 MET CE 5 35 MET CE 4.650 4.500 4.800 4.862 4.417 5.168 0.368 3 0 "[ . 1]" 1
250 4 36 VAL C 4 37 GLY C 3.100 3.000 3.200 3.540 3.328 3.648 0.448 1 0 "[ . 1]" 1
251 4 36 VAL CB 6 19 PHE CZ 4.500 3.000 6.000 6.195 5.755 6.458 0.458 2 0 "[ . 1]" 1
252 4 36 VAL CG1 6 15 GLN CG 4.500 3.000 6.000 4.731 3.513 6.096 0.096 3 0 "[ . 1]" 1
253 4 36 VAL CG1 6 19 PHE CZ 4.500 3.000 6.000 5.903 5.219 6.306 0.306 1 0 "[ . 1]" 1
254 4 36 VAL CG2 6 15 GLN CG 4.500 3.000 6.000 5.820 5.201 6.185 0.185 8 0 "[ . 1]" 1
255 4 36 VAL CG2 6 19 PHE CZ 4.500 3.000 6.000 5.404 4.584 6.291 0.291 7 0 "[ . 1]" 1
256 4 36 VAL H 5 35 MET O 1.800 . 1.900 1.839 1.685 2.075 0.175 7 0 "[ . 1]" 1
257 4 36 VAL N 4 37 GLY N 3.450 3.300 3.600 3.409 3.268 3.618 0.032 9 0 "[ . 1]" 1
258 4 36 VAL N 5 35 MET C 4.000 3.900 4.100 3.906 3.739 4.090 0.161 6 0 "[ . 1]" 1
259 4 38 GLY C 4 39 VAL C 3.350 3.100 3.600 3.195 2.847 3.607 0.253 10 0 "[ . 1]" 1
260 4 38 GLY N 4 39 VAL N 3.400 3.300 3.500 3.032 2.945 3.160 0.355 9 0 "[ . 1]" 1
261 4 39 VAL C 5 39 VAL C 4.650 4.500 4.800 5.115 4.869 5.323 0.523 3 1 "[ + . 1]" 1
262 4 39 VAL CB 10 31 ILE CB 4.500 3.000 6.000 5.514 4.720 6.052 0.052 10 0 "[ . 1]" 1
263 4 39 VAL CB 10 31 ILE CD1 4.500 3.000 6.000 3.710 3.082 4.323 . 0 0 "[ . 1]" 1
264 4 39 VAL CB 10 31 ILE CG1 4.500 3.000 6.000 4.705 3.903 5.390 . 0 0 "[ . 1]" 1
265 4 39 VAL N 10 31 ILE CD1 3.000 . 4.000 4.470 4.147 5.275 1.275 4 2 "[ +. - 1]" 1
266 4 40 VAL C 6 13 HIS CB 4.500 3.000 6.000 5.197 4.125 6.127 0.127 3 0 "[ . 1]" 1
267 4 40 VAL CG1 6 13 HIS CE1 4.500 3.000 6.000 4.839 3.476 6.067 0.067 1 0 "[ . 1]" 1
268 4 40 VAL CG2 6 13 HIS CE1 4.500 3.000 6.000 5.231 4.469 5.972 . 0 0 "[ . 1]" 1
269 5 12 VAL C 6 12 VAL C 4.650 4.500 4.800 5.068 4.968 5.308 0.508 7 1 "[ . + 1]" 1
270 5 15 GLN C 5 16 LYS C 3.100 2.900 3.300 3.619 3.577 3.653 0.353 5 0 "[ . 1]" 1
271 5 15 GLN N 5 16 LYS N 3.300 3.200 3.400 3.589 3.572 3.610 0.210 7 0 "[ . 1]" 1
272 5 17 LEU C 6 18 VAL N 4.000 3.900 4.100 4.075 3.955 4.149 0.049 8 0 "[ . 1]" 1
273 5 17 LEU H 6 16 LYS O 1.800 . 1.900 2.027 1.916 2.071 0.171 9 0 "[ . 1]" 1
274 5 17 LEU N 6 16 LYS C 4.000 3.900 4.100 4.193 4.080 4.241 0.141 3 0 "[ . 1]" 1
275 5 17 LEU O 6 18 VAL H 1.800 . 1.900 1.918 1.803 2.001 0.101 8 0 "[ . 1]" 1
276 5 18 VAL C 6 18 VAL C 4.650 4.500 4.800 4.843 4.722 4.975 0.175 10 0 "[ . 1]" 1
277 5 19 PHE C 6 20 PHE N 4.000 3.900 4.100 4.093 3.940 4.219 0.119 8 0 "[ . 1]" 1
278 5 19 PHE H 6 18 VAL O 1.800 . 1.900 1.877 1.740 1.957 0.057 9 0 "[ . 1]" 1
279 5 19 PHE N 6 18 VAL C 4.000 3.900 4.100 4.025 3.903 4.111 0.011 9 0 "[ . 1]" 1
280 5 19 PHE O 6 20 PHE H 1.800 . 1.900 1.959 1.865 2.013 0.113 8 0 "[ . 1]" 1
281 5 21 ALA C 6 22 GLU N 4.000 3.900 4.100 4.173 4.051 4.313 0.213 4 0 "[ . 1]" 1
282 5 21 ALA CB 6 21 ALA CB 4.650 4.500 4.800 4.655 4.341 4.975 0.175 10 0 "[ . 1]" 1
283 5 21 ALA H 6 20 PHE O 1.800 . 1.900 2.050 1.779 2.203 0.303 8 0 "[ . 1]" 1
284 5 21 ALA N 6 20 PHE C 4.000 3.900 4.100 4.127 3.955 4.203 0.103 3 0 "[ . 1]" 1
285 5 21 ALA O 6 22 GLU H 1.800 . 1.900 2.101 2.004 2.238 0.338 5 0 "[ . 1]" 1
286 5 23 ASP C 5 24 VAL C 2.750 2.600 2.900 3.111 2.902 3.603 0.703 3 2 "[ + .- 1]" 1
287 5 23 ASP N 5 24 VAL N 2.950 2.800 3.100 2.951 2.850 3.034 . 0 0 "[ . 1]" 1
288 5 29 GLY C 5 30 ALA C 3.500 3.400 3.600 3.287 2.969 3.750 0.431 2 0 "[ . 1]" 1
289 5 29 GLY N 5 30 ALA N 3.450 3.300 3.600 3.114 3.007 3.186 0.293 1 0 "[ . 1]" 1
290 5 30 ALA C 6 30 ALA C 4.650 4.500 4.800 4.912 4.648 5.062 0.262 1 0 "[ . 1]" 1
291 5 30 ALA C 6 31 ILE N 4.000 3.900 4.100 4.196 4.120 4.279 0.179 5 0 "[ . 1]" 1
292 5 30 ALA N 5 31 ILE N 3.450 3.400 3.500 3.633 3.447 3.700 0.200 8 0 "[ . 1]" 1
293 5 30 ALA O 6 31 ILE H 1.800 . 1.900 2.075 1.938 2.164 0.264 3 0 "[ . 1]" 1
294 5 31 ILE CB 17 39 VAL CB 4.500 3.000 6.000 5.684 5.050 6.161 0.161 8 0 "[ . 1]" 1
295 5 31 ILE CD1 17 39 VAL CB 4.500 3.000 6.000 3.769 3.198 4.479 . 0 0 "[ . 1]" 1
296 5 31 ILE CD1 17 39 VAL N 3.000 . 4.000 4.113 3.143 4.645 0.645 6 3 "[ -+ * 1]" 1
297 5 31 ILE CG1 17 39 VAL CB 4.500 3.000 6.000 4.735 4.124 5.750 . 0 0 "[ . 1]" 1
298 5 32 ILE C 6 33 GLY N 4.000 3.900 4.100 3.934 3.761 4.100 0.139 3 0 "[ . 1]" 1
299 5 32 ILE H 6 31 ILE O 1.800 . 1.900 1.870 1.721 2.018 0.118 5 0 "[ . 1]" 1
300 5 32 ILE N 6 31 ILE C 4.000 3.900 4.100 3.972 3.845 4.093 0.055 4 0 "[ . 1]" 1
301 5 32 ILE O 6 33 GLY H 1.800 . 1.900 1.861 1.687 2.042 0.142 4 0 "[ . 1]" 1
302 5 34 LEU C 6 35 MET N 4.000 3.900 4.100 4.120 3.584 4.230 0.316 3 0 "[ . 1]" 1
303 5 34 LEU H 6 33 GLY O 1.800 . 1.900 2.016 1.784 3.090 1.190 3 1 "[ + . 1]" 1
304 5 34 LEU N 5 35 MET CE 6.000 5.000 7.000 7.131 6.940 7.290 0.290 8 0 "[ . 1]" 1
305 5 34 LEU N 6 33 GLY C 4.000 3.900 4.100 4.024 3.778 4.181 0.122 3 0 "[ . 1]" 1
306 5 34 LEU O 6 35 MET H 1.800 . 1.900 2.137 1.972 2.972 1.072 3 1 "[ + . 1]" 1
307 5 35 MET C 6 35 MET C 4.650 4.500 4.800 4.765 4.406 4.949 0.149 7 0 "[ . 1]" 1
308 5 35 MET CE 5 37 GLY N 6.000 5.000 7.000 7.111 6.882 7.278 0.278 8 0 "[ . 1]" 1
309 5 35 MET CE 6 35 MET CE 4.650 4.500 4.800 4.859 4.444 5.290 0.490 3 0 "[ . 1]" 1
310 5 36 VAL C 5 37 GLY C 3.100 3.000 3.200 3.419 2.908 3.648 0.448 9 0 "[ . 1]" 1
311 5 36 VAL H 6 35 MET O 1.800 . 1.900 2.002 1.645 3.240 1.340 3 1 "[ + . 1]" 1
312 5 36 VAL N 5 37 GLY N 3.450 3.300 3.600 3.583 3.335 3.655 0.055 2 0 "[ . 1]" 1
313 5 36 VAL N 6 35 MET C 4.000 3.900 4.100 3.949 3.504 4.240 0.396 3 0 "[ . 1]" 1
314 5 38 GLY C 5 39 VAL C 3.350 3.100 3.600 3.199 2.860 3.589 0.240 1 0 "[ . 1]" 1
315 5 38 GLY N 5 39 VAL N 3.400 3.300 3.500 3.141 3.036 3.239 0.264 5 0 "[ . 1]" 1
316 5 39 VAL C 6 39 VAL C 4.650 4.500 4.800 5.010 4.745 5.207 0.407 1 0 "[ . 1]" 1
317 5 39 VAL CB 11 31 ILE CB 4.500 3.000 6.000 5.911 5.237 6.128 0.128 8 0 "[ . 1]" 1
318 5 39 VAL CB 11 31 ILE CD1 4.500 3.000 6.000 3.960 3.613 4.767 . 0 0 "[ . 1]" 1
319 5 39 VAL CB 11 31 ILE CG1 4.500 3.000 6.000 4.899 4.621 5.662 . 0 0 "[ . 1]" 1
320 5 39 VAL N 11 31 ILE CD1 3.000 . 4.000 4.046 3.137 4.698 0.698 4 3 "[ +.* -1]" 1
321 6 15 GLN C 6 16 LYS C 3.100 2.900 3.300 3.600 3.550 3.650 0.350 4 0 "[ . 1]" 1
322 6 15 GLN N 6 16 LYS N 3.300 3.200 3.400 3.604 3.574 3.631 0.231 9 0 "[ . 1]" 1
323 6 23 ASP C 6 24 VAL C 2.750 2.600 2.900 3.075 2.829 3.404 0.504 10 1 "[ . +]" 1
324 6 23 ASP N 6 24 VAL N 2.950 2.800 3.100 2.916 2.847 3.001 . 0 0 "[ . 1]" 1
325 6 29 GLY C 6 30 ALA C 3.500 3.400 3.600 3.432 3.185 3.684 0.215 1 0 "[ . 1]" 1
326 6 29 GLY N 6 30 ALA N 3.450 3.300 3.600 2.995 2.902 3.108 0.398 8 0 "[ . 1]" 1
327 6 30 ALA N 6 31 ILE N 3.450 3.400 3.500 3.644 3.540 3.679 0.179 1 0 "[ . 1]" 1
328 6 31 ILE CB 18 39 VAL CB 4.500 3.000 6.000 5.950 5.549 6.220 0.220 1 0 "[ . 1]" 1
329 6 31 ILE CD1 18 39 VAL CB 4.500 3.000 6.000 4.051 3.668 4.427 . 0 0 "[ . 1]" 1
330 6 31 ILE CD1 18 39 VAL N 3.000 . 4.000 4.052 3.374 4.576 0.576 6 1 "[ .+ 1]" 1
331 6 31 ILE CG1 18 39 VAL CB 4.500 3.000 6.000 4.990 4.545 5.761 . 0 0 "[ . 1]" 1
332 6 34 LEU N 6 35 MET CE 6.000 5.000 7.000 6.953 5.264 7.227 0.227 6 0 "[ . 1]" 1
333 6 35 MET CE 6 37 GLY N 6.000 5.000 7.000 6.977 5.882 7.171 0.171 6 0 "[ . 1]" 1
334 6 36 VAL C 6 37 GLY C 3.100 3.000 3.200 3.290 2.939 3.656 0.456 5 0 "[ . 1]" 1
335 6 36 VAL N 6 37 GLY N 3.450 3.300 3.600 3.565 3.448 3.635 0.035 1 0 "[ . 1]" 1
336 6 38 GLY C 6 39 VAL C 3.350 3.100 3.600 3.497 3.120 3.686 0.086 5 0 "[ . 1]" 1
337 6 38 GLY N 6 39 VAL N 3.400 3.300 3.500 3.100 2.976 3.156 0.324 3 0 "[ . 1]" 1
338 6 39 VAL CB 12 31 ILE CB 4.500 3.000 6.000 5.751 4.431 6.169 0.169 5 0 "[ . 1]" 1
339 6 39 VAL CB 12 31 ILE CD1 4.500 3.000 6.000 3.984 3.580 4.752 . 0 0 "[ . 1]" 1
340 6 39 VAL CB 12 31 ILE CG1 4.500 3.000 6.000 4.914 4.529 5.754 . 0 0 "[ . 1]" 1
341 6 39 VAL N 12 31 ILE CD1 3.000 . 4.000 4.170 4.054 4.567 0.567 9 1 "[ . +1]" 1
342 7 12 VAL C 8 12 VAL C 4.650 4.500 4.800 4.952 4.837 5.061 0.261 6 0 "[ . 1]" 1
343 7 15 GLN C 7 16 LYS C 3.100 2.900 3.300 3.238 3.155 3.351 0.051 7 0 "[ . 1]" 1
344 7 15 GLN N 7 16 LYS N 3.300 3.200 3.400 3.568 3.545 3.598 0.198 7 0 "[ . 1]" 1
345 7 17 LEU C 8 18 VAL N 4.000 3.900 4.100 4.067 3.927 4.204 0.104 9 0 "[ . 1]" 1
346 7 17 LEU H 8 16 LYS O 1.800 . 1.900 1.976 1.877 2.076 0.176 6 0 "[ . 1]" 1
347 7 17 LEU N 8 16 LYS C 4.000 3.900 4.100 4.002 3.892 4.124 0.024 7 0 "[ . 1]" 1
348 7 17 LEU O 8 18 VAL H 1.800 . 1.900 1.989 1.888 2.073 0.173 9 0 "[ . 1]" 1
349 7 18 VAL C 8 18 VAL C 4.650 4.500 4.800 4.716 4.553 4.886 0.086 9 0 "[ . 1]" 1
350 7 19 PHE C 8 20 PHE N 4.000 3.900 4.100 4.065 3.914 4.169 0.069 5 0 "[ . 1]" 1
351 7 19 PHE H 8 18 VAL O 1.800 . 1.900 1.875 1.702 1.935 0.035 9 0 "[ . 1]" 1
352 7 19 PHE N 8 18 VAL C 4.000 3.900 4.100 3.964 3.847 4.081 0.053 5 0 "[ . 1]" 1
353 7 19 PHE O 8 20 PHE H 1.800 . 1.900 1.926 1.735 2.070 0.170 5 0 "[ . 1]" 1
354 7 21 ALA C 8 22 GLU N 4.000 3.900 4.100 4.169 4.079 4.259 0.159 10 0 "[ . 1]" 1
355 7 21 ALA CB 8 21 ALA CB 4.650 4.500 4.800 4.596 4.431 4.811 0.069 6 0 "[ . 1]" 1
356 7 21 ALA H 8 20 PHE O 1.800 . 1.900 1.891 1.726 1.982 0.082 4 0 "[ . 1]" 1
357 7 21 ALA N 8 20 PHE C 4.000 3.900 4.100 4.020 3.905 4.101 0.001 8 0 "[ . 1]" 1
358 7 21 ALA O 8 22 GLU H 1.800 . 1.900 2.022 1.958 2.096 0.196 4 0 "[ . 1]" 1
359 7 23 ASP C 7 24 VAL C 2.750 2.600 2.900 3.120 2.996 3.282 0.382 5 0 "[ . 1]" 1
360 7 23 ASP N 7 24 VAL N 2.950 2.800 3.100 2.899 2.781 3.009 0.019 6 0 "[ . 1]" 1
361 7 29 GLY C 7 30 ALA C 3.500 3.400 3.600 3.504 3.188 3.757 0.212 2 0 "[ . 1]" 1
362 7 29 GLY N 7 30 ALA N 3.450 3.300 3.600 3.178 2.972 3.686 0.328 2 0 "[ . 1]" 1
363 7 30 ALA C 8 30 ALA C 4.650 4.500 4.800 4.837 4.498 5.291 0.491 6 0 "[ . 1]" 1
364 7 30 ALA C 8 31 ILE N 4.000 3.900 4.100 4.185 3.970 4.321 0.221 6 0 "[ . 1]" 1
365 7 30 ALA N 7 31 ILE N 3.450 3.400 3.500 3.220 2.988 3.413 0.412 3 0 "[ . 1]" 1
366 7 30 ALA O 8 31 ILE H 1.800 . 1.900 2.122 1.947 2.324 0.424 4 0 "[ . 1]" 1
367 7 32 ILE C 8 33 GLY N 4.000 3.900 4.100 3.752 3.691 3.879 0.209 9 0 "[ . 1]" 1
368 7 32 ILE CD1 9 17 LEU CB 5.500 3.000 8.000 8.129 8.055 8.250 0.250 6 0 "[ . 1]" 1
369 7 32 ILE CD1 9 19 PHE CZ 4.500 3.000 6.000 4.742 4.472 5.243 . 0 0 "[ . 1]" 1
370 7 32 ILE CG1 9 19 PHE CZ 4.500 3.000 6.000 5.728 5.409 6.028 0.028 8 0 "[ . 1]" 1
371 7 32 ILE CG2 9 17 LEU CB 5.500 3.000 8.000 8.174 8.076 8.262 0.262 10 0 "[ . 1]" 1
372 7 32 ILE CG2 9 19 PHE CZ 4.500 3.000 6.000 4.692 4.551 4.865 . 0 0 "[ . 1]" 1
373 7 32 ILE H 8 31 ILE O 1.800 . 1.900 1.983 1.894 2.054 0.154 8 0 "[ . 1]" 1
374 7 32 ILE N 8 31 ILE C 4.000 3.900 4.100 4.134 3.987 4.236 0.136 8 0 "[ . 1]" 1
375 7 32 ILE O 8 33 GLY H 1.800 . 1.900 1.728 1.662 1.808 0.038 1 0 "[ . 1]" 1
376 7 34 LEU C 8 35 MET N 4.000 3.900 4.100 4.215 4.145 4.250 0.150 1 0 "[ . 1]" 1
377 7 34 LEU CB 9 19 PHE CZ 4.500 3.000 6.000 6.085 5.937 6.199 0.199 3 0 "[ . 1]" 1
378 7 34 LEU CG 9 19 PHE CZ 4.500 3.000 6.000 6.129 6.051 6.204 0.204 6 0 "[ . 1]" 1
379 7 34 LEU H 8 33 GLY O 1.800 . 1.900 2.117 2.035 2.176 0.276 8 0 "[ . 1]" 1
380 7 34 LEU N 7 35 MET CE 6.000 5.000 7.000 7.225 7.131 7.395 0.395 8 0 "[ . 1]" 1
381 7 34 LEU N 8 33 GLY C 4.000 3.900 4.100 4.233 4.164 4.290 0.190 8 0 "[ . 1]" 1
382 7 34 LEU O 8 35 MET H 1.800 . 1.900 2.075 2.018 2.125 0.225 7 0 "[ . 1]" 1
383 7 35 MET C 8 35 MET C 4.650 4.500 4.800 4.924 4.772 5.037 0.237 1 0 "[ . 1]" 1
384 7 35 MET CE 7 37 GLY N 6.000 5.000 7.000 7.219 7.114 7.314 0.314 3 0 "[ . 1]" 1
385 7 35 MET CE 8 35 MET CE 4.650 4.500 4.800 4.875 4.758 4.995 0.195 4 0 "[ . 1]" 1
386 7 36 VAL C 7 37 GLY C 3.100 3.000 3.200 3.376 3.026 3.610 0.410 8 0 "[ . 1]" 1
387 7 36 VAL CB 9 19 PHE CZ 4.500 3.000 6.000 6.205 6.091 6.369 0.369 10 0 "[ . 1]" 1
388 7 36 VAL CG1 9 15 GLN CG 4.500 3.000 6.000 4.646 3.751 6.095 0.095 10 0 "[ . 1]" 1
389 7 36 VAL CG1 9 19 PHE CZ 4.500 3.000 6.000 6.074 5.446 6.285 0.285 2 0 "[ . 1]" 1
390 7 36 VAL CG2 9 15 GLN CG 4.500 3.000 6.000 5.995 4.795 6.270 0.270 2 0 "[ . 1]" 1
391 7 36 VAL CG2 9 19 PHE CZ 4.500 3.000 6.000 5.366 4.954 6.130 0.130 1 0 "[ . 1]" 1
392 7 36 VAL H 8 35 MET O 1.800 . 1.900 1.929 1.785 2.012 0.112 1 0 "[ . 1]" 1
393 7 36 VAL N 7 37 GLY N 3.450 3.300 3.600 3.349 3.244 3.492 0.056 6 0 "[ . 1]" 1
394 7 36 VAL N 8 35 MET C 4.000 3.900 4.100 4.097 3.968 4.171 0.071 10 0 "[ . 1]" 1
395 7 38 GLY C 7 39 VAL C 3.350 3.100 3.600 3.353 3.074 3.554 0.026 6 0 "[ . 1]" 1
396 7 38 GLY N 7 39 VAL N 3.400 3.300 3.500 3.014 2.956 3.110 0.344 8 0 "[ . 1]" 1
397 7 39 VAL C 8 39 VAL C 4.650 4.500 4.800 5.043 4.823 5.302 0.502 1 1 "[+ . 1]" 1
398 7 39 VAL CB 13 31 ILE CB 4.500 3.000 6.000 5.734 4.797 6.157 0.157 2 0 "[ . 1]" 1
399 7 39 VAL CB 13 31 ILE CD1 4.500 3.000 6.000 4.026 3.519 5.086 . 0 0 "[ . 1]" 1
400 7 39 VAL CB 13 31 ILE CG1 4.500 3.000 6.000 5.308 4.988 5.943 . 0 0 "[ . 1]" 1
401 7 39 VAL N 13 31 ILE CD1 3.000 . 4.000 4.134 3.790 4.427 0.427 6 0 "[ . 1]" 1
402 7 40 VAL C 9 13 HIS CB 4.500 3.000 6.000 5.099 4.519 5.839 . 0 0 "[ . 1]" 1
403 7 40 VAL CG1 9 13 HIS CE1 4.500 3.000 6.000 5.174 3.664 6.057 0.057 1 0 "[ . 1]" 1
404 7 40 VAL CG2 9 13 HIS CE1 4.500 3.000 6.000 5.441 3.859 6.126 0.126 7 0 "[ . 1]" 1
405 8 12 VAL C 9 12 VAL C 4.650 4.500 4.800 5.004 4.884 5.155 0.355 2 0 "[ . 1]" 1
406 8 15 GLN C 8 16 LYS C 3.100 2.900 3.300 3.331 3.173 3.571 0.271 8 0 "[ . 1]" 1
407 8 15 GLN N 8 16 LYS N 3.300 3.200 3.400 3.566 3.534 3.605 0.205 10 0 "[ . 1]" 1
408 8 17 LEU C 9 18 VAL N 4.000 3.900 4.100 4.124 4.057 4.176 0.076 2 0 "[ . 1]" 1
409 8 17 LEU H 9 16 LYS O 1.800 . 1.900 2.053 1.940 2.122 0.222 1 0 "[ . 1]" 1
410 8 17 LEU N 9 16 LYS C 4.000 3.900 4.100 4.123 3.989 4.229 0.129 8 0 "[ . 1]" 1
411 8 17 LEU O 9 18 VAL H 1.800 . 1.900 2.003 1.945 2.055 0.155 9 0 "[ . 1]" 1
412 8 18 VAL C 9 18 VAL C 4.650 4.500 4.800 4.826 4.716 4.926 0.126 2 0 "[ . 1]" 1
413 8 19 PHE C 9 20 PHE N 4.000 3.900 4.100 4.051 3.885 4.169 0.069 9 0 "[ . 1]" 1
414 8 19 PHE H 9 18 VAL O 1.800 . 1.900 1.827 1.778 1.953 0.053 2 0 "[ . 1]" 1
415 8 19 PHE N 9 18 VAL C 4.000 3.900 4.100 3.995 3.915 4.119 0.019 2 0 "[ . 1]" 1
416 8 19 PHE O 9 20 PHE H 1.800 . 1.900 1.876 1.689 2.021 0.121 5 0 "[ . 1]" 1
417 8 21 ALA C 9 22 GLU N 4.000 3.900 4.100 4.249 4.086 4.493 0.393 6 0 "[ . 1]" 1
418 8 21 ALA CB 9 21 ALA CB 4.650 4.500 4.800 4.612 4.375 4.878 0.125 6 0 "[ . 1]" 1
419 8 21 ALA H 9 20 PHE O 1.800 . 1.900 1.952 1.777 2.066 0.166 4 0 "[ . 1]" 1
420 8 21 ALA N 9 20 PHE C 4.000 3.900 4.100 4.052 3.965 4.163 0.063 4 0 "[ . 1]" 1
421 8 21 ALA O 9 22 GLU H 1.800 . 1.900 2.100 1.942 2.300 0.400 6 0 "[ . 1]" 1
422 8 23 ASP C 8 24 VAL C 2.750 2.600 2.900 3.098 2.827 3.257 0.357 9 0 "[ . 1]" 1
423 8 23 ASP N 8 24 VAL N 2.950 2.800 3.100 2.912 2.784 3.032 0.016 8 0 "[ . 1]" 1
424 8 29 GLY C 8 30 ALA C 3.500 3.400 3.600 3.308 2.988 3.628 0.412 10 0 "[ . 1]" 1
425 8 29 GLY N 8 30 ALA N 3.450 3.300 3.600 3.228 2.880 3.420 0.420 6 0 "[ . 1]" 1
426 8 30 ALA C 9 30 ALA C 4.650 4.500 4.800 4.849 4.735 4.955 0.155 7 0 "[ . 1]" 1
427 8 30 ALA C 9 31 ILE N 4.000 3.900 4.100 4.258 4.199 4.347 0.247 7 0 "[ . 1]" 1
428 8 30 ALA N 8 31 ILE N 3.450 3.400 3.500 3.417 3.254 3.606 0.146 10 0 "[ . 1]" 1
429 8 30 ALA O 9 31 ILE H 1.800 . 1.900 2.185 2.084 2.265 0.365 7 0 "[ . 1]" 1
430 8 32 ILE C 9 33 GLY N 4.000 3.900 4.100 3.862 3.730 4.043 0.170 7 0 "[ . 1]" 1
431 8 32 ILE CD1 10 17 LEU CB 5.500 3.000 8.000 8.272 8.164 8.373 0.373 4 0 "[ . 1]" 1
432 8 32 ILE CD1 10 19 PHE CZ 4.500 3.000 6.000 5.156 4.990 5.374 . 0 0 "[ . 1]" 1
433 8 32 ILE CG1 10 19 PHE CZ 4.500 3.000 6.000 6.060 5.895 6.176 0.176 7 0 "[ . 1]" 1
434 8 32 ILE CG2 10 17 LEU CB 5.500 3.000 8.000 8.091 7.738 8.249 0.249 2 0 "[ . 1]" 1
435 8 32 ILE CG2 10 19 PHE CZ 4.500 3.000 6.000 4.777 4.261 5.144 . 0 0 "[ . 1]" 1
436 8 32 ILE H 9 31 ILE O 1.800 . 1.900 2.021 1.925 2.139 0.239 4 0 "[ . 1]" 1
437 8 32 ILE N 9 31 ILE C 4.000 3.900 4.100 4.158 4.026 4.241 0.141 2 0 "[ . 1]" 1
438 8 32 ILE O 9 33 GLY H 1.800 . 1.900 1.812 1.711 1.960 0.060 5 0 "[ . 1]" 1
439 8 34 LEU C 9 35 MET N 4.000 3.900 4.100 4.243 4.179 4.366 0.266 5 0 "[ . 1]" 1
440 8 34 LEU CB 10 19 PHE CZ 4.500 3.000 6.000 5.501 5.030 6.202 0.202 5 0 "[ . 1]" 1
441 8 34 LEU CG 10 19 PHE CZ 4.500 3.000 6.000 5.287 4.669 5.711 . 0 0 "[ . 1]" 1
442 8 34 LEU H 9 33 GLY O 1.800 . 1.900 2.106 2.033 2.180 0.280 2 0 "[ . 1]" 1
443 8 34 LEU N 8 35 MET CE 6.000 5.000 7.000 7.278 7.215 7.385 0.385 5 0 "[ . 1]" 1
444 8 34 LEU N 9 33 GLY C 4.000 3.900 4.100 4.242 4.181 4.298 0.198 2 0 "[ . 1]" 1
445 8 34 LEU O 9 35 MET H 1.800 . 1.900 2.084 1.991 2.255 0.355 5 0 "[ . 1]" 1
446 8 35 MET C 9 35 MET C 4.650 4.500 4.800 4.921 4.766 5.034 0.234 9 0 "[ . 1]" 1
447 8 35 MET CE 8 37 GLY N 6.000 5.000 7.000 7.145 7.027 7.250 0.250 5 0 "[ . 1]" 1
448 8 35 MET CE 9 35 MET CE 4.650 4.500 4.800 4.905 4.809 5.061 0.261 5 0 "[ . 1]" 1
449 8 36 VAL C 8 37 GLY C 3.100 3.000 3.200 3.431 2.913 3.649 0.449 1 0 "[ . 1]" 1
450 8 36 VAL CB 10 19 PHE CZ 4.500 3.000 6.000 6.226 6.120 6.321 0.321 1 0 "[ . 1]" 1
451 8 36 VAL CG1 10 15 GLN CG 4.500 3.000 6.000 4.162 3.450 5.743 . 0 0 "[ . 1]" 1
452 8 36 VAL CG1 10 19 PHE CZ 4.500 3.000 6.000 6.257 6.058 6.418 0.418 3 0 "[ . 1]" 1
453 8 36 VAL CG2 10 15 GLN CG 4.500 3.000 6.000 5.876 4.265 6.322 0.322 5 0 "[ . 1]" 1
454 8 36 VAL CG2 10 19 PHE CZ 4.500 3.000 6.000 5.299 4.985 6.297 0.297 6 0 "[ . 1]" 1
455 8 36 VAL H 9 35 MET O 1.800 . 1.900 1.888 1.723 1.956 0.056 5 0 "[ . 1]" 1
456 8 36 VAL N 8 37 GLY N 3.450 3.300 3.600 3.362 3.276 3.516 0.024 6 0 "[ . 1]" 1
457 8 36 VAL N 9 35 MET C 4.000 3.900 4.100 4.045 3.905 4.145 0.045 6 0 "[ . 1]" 1
458 8 38 GLY C 8 39 VAL C 3.350 3.100 3.600 3.503 2.872 3.661 0.228 3 0 "[ . 1]" 1
459 8 38 GLY N 8 39 VAL N 3.400 3.300 3.500 2.997 2.912 3.071 0.388 2 0 "[ . 1]" 1
460 8 39 VAL C 9 39 VAL C 4.650 4.500 4.800 5.224 5.080 5.314 0.514 4 2 "[ +. - 1]" 1
461 8 39 VAL CB 14 31 ILE CB 4.500 3.000 6.000 5.435 4.086 6.178 0.178 9 0 "[ . 1]" 1
462 8 39 VAL CB 14 31 ILE CD1 4.500 3.000 6.000 4.084 3.368 5.184 . 0 0 "[ . 1]" 1
463 8 39 VAL CB 14 31 ILE CG1 4.500 3.000 6.000 5.093 4.593 6.086 0.086 3 0 "[ . 1]" 1
464 8 39 VAL N 14 31 ILE CD1 3.000 . 4.000 4.250 4.068 4.554 0.554 6 1 "[ .+ 1]" 1
465 8 40 VAL C 10 13 HIS CB 4.500 3.000 6.000 5.024 4.015 5.915 . 0 0 "[ . 1]" 1
466 8 40 VAL CG1 10 13 HIS CE1 4.500 3.000 6.000 5.201 3.101 6.084 0.084 2 0 "[ . 1]" 1
467 8 40 VAL CG2 10 13 HIS CE1 4.500 3.000 6.000 4.876 3.477 6.122 0.122 10 0 "[ . 1]" 1
468 9 12 VAL C 10 12 VAL C 4.650 4.500 4.800 5.132 4.948 5.318 0.518 8 1 "[ . + 1]" 1
469 9 15 GLN C 9 16 LYS C 3.100 2.900 3.300 3.541 3.376 3.650 0.350 9 0 "[ . 1]" 1
470 9 15 GLN N 9 16 LYS N 3.300 3.200 3.400 3.582 3.485 3.671 0.271 9 0 "[ . 1]" 1
471 9 17 LEU C 10 18 VAL N 4.000 3.900 4.100 4.148 4.005 4.219 0.119 4 0 "[ . 1]" 1
472 9 17 LEU H 10 16 LYS O 1.800 . 1.900 1.980 1.820 2.066 0.166 3 0 "[ . 1]" 1
473 9 17 LEU N 10 16 LYS C 4.000 3.900 4.100 4.161 4.000 4.243 0.143 8 0 "[ . 1]" 1
474 9 17 LEU O 10 18 VAL H 1.800 . 1.900 2.017 1.850 2.189 0.289 2 0 "[ . 1]" 1
475 9 18 VAL C 10 18 VAL C 4.650 4.500 4.800 4.798 4.614 4.909 0.109 7 0 "[ . 1]" 1
476 9 19 PHE C 10 20 PHE N 4.000 3.900 4.100 4.062 3.985 4.122 0.022 10 0 "[ . 1]" 1
477 9 19 PHE H 10 18 VAL O 1.800 . 1.900 1.896 1.690 1.995 0.095 8 0 "[ . 1]" 1
478 9 19 PHE N 10 18 VAL C 4.000 3.900 4.100 4.028 3.884 4.128 0.028 8 0 "[ . 1]" 1
479 9 19 PHE O 10 20 PHE H 1.800 . 1.900 1.934 1.843 2.033 0.133 2 0 "[ . 1]" 1
480 9 21 ALA C 10 22 GLU N 4.000 3.900 4.100 4.244 4.164 4.370 0.270 6 0 "[ . 1]" 1
481 9 21 ALA CB 10 21 ALA CB 4.650 4.500 4.800 4.855 4.445 5.073 0.273 10 0 "[ . 1]" 1
482 9 21 ALA H 10 20 PHE O 1.800 . 1.900 1.985 1.860 2.092 0.192 4 0 "[ . 1]" 1
483 9 21 ALA N 10 20 PHE C 4.000 3.900 4.100 4.103 3.978 4.201 0.101 4 0 "[ . 1]" 1
484 9 21 ALA O 10 22 GLU H 1.800 . 1.900 2.123 2.015 2.294 0.394 6 0 "[ . 1]" 1
485 9 23 ASP C 9 24 VAL C 2.750 2.600 2.900 3.149 2.822 3.579 0.679 10 1 "[ . +]" 1
486 9 23 ASP N 9 24 VAL N 2.950 2.800 3.100 2.912 2.825 3.004 . 0 0 "[ . 1]" 1
487 9 29 GLY C 9 30 ALA C 3.500 3.400 3.600 3.272 3.030 3.558 0.370 4 0 "[ . 1]" 1
488 9 29 GLY N 9 30 ALA N 3.450 3.300 3.600 3.073 2.949 3.208 0.351 7 0 "[ . 1]" 1
489 9 30 ALA C 10 30 ALA C 4.650 4.500 4.800 4.899 4.829 4.996 0.196 7 0 "[ . 1]" 1
490 9 30 ALA C 10 31 ILE N 4.000 3.900 4.100 4.249 4.145 4.350 0.250 6 0 "[ . 1]" 1
491 9 30 ALA N 9 31 ILE N 3.450 3.400 3.500 3.557 3.421 3.674 0.174 9 0 "[ . 1]" 1
492 9 30 ALA O 10 31 ILE H 1.800 . 1.900 2.161 1.973 2.286 0.386 6 0 "[ . 1]" 1
493 9 32 ILE C 10 33 GLY N 4.000 3.900 4.100 3.906 3.793 4.048 0.107 9 0 "[ . 1]" 1
494 9 32 ILE CD1 11 17 LEU CB 5.500 3.000 8.000 8.162 7.077 8.324 0.324 4 0 "[ . 1]" 1
495 9 32 ILE CD1 11 19 PHE CZ 4.500 3.000 6.000 5.154 4.982 5.300 . 0 0 "[ . 1]" 1
496 9 32 ILE CG1 11 19 PHE CZ 4.500 3.000 6.000 6.127 5.959 6.254 0.254 4 0 "[ . 1]" 1
497 9 32 ILE CG2 11 17 LEU CB 5.500 3.000 8.000 8.198 8.096 8.602 0.602 5 1 "[ + 1]" 1
498 9 32 ILE CG2 11 19 PHE CZ 4.500 3.000 6.000 4.986 4.617 5.875 . 0 0 "[ . 1]" 1
499 9 32 ILE H 10 31 ILE O 1.800 . 1.900 2.005 1.894 2.068 0.168 8 0 "[ . 1]" 1
500 9 32 ILE N 10 31 ILE C 4.000 3.900 4.100 4.139 4.041 4.221 0.121 5 0 "[ . 1]" 1
501 9 32 ILE O 10 33 GLY H 1.800 . 1.900 1.825 1.711 1.953 0.053 5 0 "[ . 1]" 1
502 9 34 LEU C 10 35 MET N 4.000 3.900 4.100 4.194 4.087 4.244 0.144 5 0 "[ . 1]" 1
503 9 34 LEU CB 11 19 PHE CZ 4.500 3.000 6.000 5.390 5.039 5.838 . 0 0 "[ . 1]" 1
504 9 34 LEU CG 11 19 PHE CZ 4.500 3.000 6.000 5.188 4.573 5.942 . 0 0 "[ . 1]" 1
505 9 34 LEU H 10 33 GLY O 1.800 . 1.900 2.079 2.037 2.185 0.285 8 0 "[ . 1]" 1
506 9 34 LEU N 9 35 MET CE 6.000 5.000 7.000 7.187 7.098 7.380 0.380 3 0 "[ . 1]" 1
507 9 34 LEU N 10 33 GLY C 4.000 3.900 4.100 4.230 4.185 4.258 0.158 6 0 "[ . 1]" 1
508 9 34 LEU O 10 35 MET H 1.800 . 1.900 2.017 1.937 2.062 0.162 3 0 "[ . 1]" 1
509 9 35 MET C 10 35 MET C 4.650 4.500 4.800 4.903 4.723 5.025 0.225 9 0 "[ . 1]" 1
510 9 35 MET CE 9 37 GLY N 6.000 5.000 7.000 7.200 7.082 7.329 0.329 3 0 "[ . 1]" 1
511 9 35 MET CE 10 35 MET CE 4.650 4.500 4.800 4.939 4.702 5.152 0.352 6 0 "[ . 1]" 1
512 9 36 VAL C 9 37 GLY C 3.100 3.000 3.200 3.360 2.874 3.590 0.390 10 0 "[ . 1]" 1
513 9 36 VAL CB 11 19 PHE CZ 4.500 3.000 6.000 6.254 6.081 6.369 0.369 3 0 "[ . 1]" 1
514 9 36 VAL CG1 11 15 GLN CG 4.500 3.000 6.000 4.590 3.391 6.082 0.082 8 0 "[ . 1]" 1
515 9 36 VAL CG1 11 19 PHE CZ 4.500 3.000 6.000 6.119 5.351 6.508 0.508 10 1 "[ . +]" 1
516 9 36 VAL CG2 11 15 GLN CG 4.500 3.000 6.000 5.766 4.218 6.333 0.333 7 0 "[ . 1]" 1
517 9 36 VAL CG2 11 19 PHE CZ 4.500 3.000 6.000 5.524 5.082 6.232 0.232 8 0 "[ . 1]" 1
518 9 36 VAL H 10 35 MET O 1.800 . 1.900 1.856 1.662 2.011 0.111 2 0 "[ . 1]" 1
519 9 36 VAL N 9 37 GLY N 3.450 3.300 3.600 3.460 3.266 3.602 0.034 3 0 "[ . 1]" 1
520 9 36 VAL N 10 35 MET C 4.000 3.900 4.100 4.019 3.834 4.190 0.090 2 0 "[ . 1]" 1
521 9 38 GLY C 9 39 VAL C 3.350 3.100 3.600 3.534 3.353 3.646 0.046 2 0 "[ . 1]" 1
522 9 38 GLY N 9 39 VAL N 3.400 3.300 3.500 3.056 2.915 3.159 0.385 7 0 "[ . 1]" 1
523 9 39 VAL C 10 39 VAL C 4.650 4.500 4.800 5.131 4.893 5.527 0.727 7 3 "[ * .-+ 1]" 1
524 9 39 VAL CB 15 31 ILE CB 4.500 3.000 6.000 5.737 4.960 6.289 0.289 9 0 "[ . 1]" 1
525 9 39 VAL CB 15 31 ILE CD1 4.500 3.000 6.000 3.939 3.216 4.427 . 0 0 "[ . 1]" 1
526 9 39 VAL CB 15 31 ILE CG1 4.500 3.000 6.000 4.926 4.404 5.187 . 0 0 "[ . 1]" 1
527 9 39 VAL N 15 31 ILE CD1 3.000 . 4.000 4.266 3.885 4.903 0.903 6 1 "[ .+ 1]" 1
528 9 40 VAL C 11 13 HIS CB 4.500 3.000 6.000 5.267 4.070 5.962 . 0 0 "[ . 1]" 1
529 9 40 VAL CG1 11 13 HIS CE1 4.500 3.000 6.000 4.930 3.744 6.088 0.088 4 0 "[ . 1]" 1
530 9 40 VAL CG2 11 13 HIS CE1 4.500 3.000 6.000 5.440 3.602 6.061 0.061 3 0 "[ . 1]" 1
531 10 12 VAL C 11 12 VAL C 4.650 4.500 4.800 5.057 4.953 5.154 0.354 9 0 "[ . 1]" 1
532 10 15 GLN C 10 16 LYS C 3.100 2.900 3.300 3.542 3.404 3.610 0.310 2 0 "[ . 1]" 1
533 10 15 GLN N 10 16 LYS N 3.300 3.200 3.400 3.568 3.473 3.616 0.216 6 0 "[ . 1]" 1
534 10 17 LEU C 11 18 VAL N 4.000 3.900 4.100 4.132 3.955 4.272 0.172 3 0 "[ . 1]" 1
535 10 17 LEU H 11 16 LYS O 1.800 . 1.900 2.039 1.981 2.093 0.193 1 0 "[ . 1]" 1
536 10 17 LEU N 11 16 LYS C 4.000 3.900 4.100 4.216 4.148 4.275 0.175 3 0 "[ . 1]" 1
537 10 17 LEU O 11 18 VAL H 1.800 . 1.900 1.960 1.757 2.066 0.166 3 0 "[ . 1]" 1
538 10 18 VAL C 11 18 VAL C 4.650 4.500 4.800 4.884 4.804 4.960 0.160 3 0 "[ . 1]" 1
539 10 19 PHE C 11 20 PHE N 4.000 3.900 4.100 4.017 3.854 4.097 0.046 6 0 "[ . 1]" 1
540 10 19 PHE H 11 18 VAL O 1.800 . 1.900 1.930 1.806 1.987 0.087 10 0 "[ . 1]" 1
541 10 19 PHE N 11 18 VAL C 4.000 3.900 4.100 4.079 3.968 4.151 0.051 7 0 "[ . 1]" 1
542 10 19 PHE O 11 20 PHE H 1.800 . 1.900 1.889 1.706 1.992 0.092 10 0 "[ . 1]" 1
543 10 21 ALA C 11 22 GLU N 4.000 3.900 4.100 4.331 4.163 4.561 0.461 2 0 "[ . 1]" 1
544 10 21 ALA CB 11 21 ALA CB 4.650 4.500 4.800 4.603 4.423 4.859 0.077 10 0 "[ . 1]" 1
545 10 21 ALA H 11 20 PHE O 1.800 . 1.900 2.007 1.850 2.088 0.188 4 0 "[ . 1]" 1
546 10 21 ALA N 11 20 PHE C 4.000 3.900 4.100 4.132 3.933 4.197 0.097 3 0 "[ . 1]" 1
547 10 21 ALA O 11 22 GLU H 1.800 . 1.900 2.207 2.053 2.440 0.540 9 2 "[ .- +1]" 1
548 10 23 ASP C 10 24 VAL C 2.750 2.600 2.900 3.069 2.768 3.616 0.716 6 1 "[ .+ 1]" 1
549 10 23 ASP N 10 24 VAL N 2.950 2.800 3.100 2.981 2.836 3.110 0.010 10 0 "[ . 1]" 1
550 10 29 GLY C 10 30 ALA C 3.500 3.400 3.600 3.243 2.937 3.692 0.463 7 0 "[ . 1]" 1
551 10 29 GLY N 10 30 ALA N 3.450 3.300 3.600 3.116 2.971 3.255 0.329 4 0 "[ . 1]" 1
552 10 30 ALA C 11 30 ALA C 4.650 4.500 4.800 4.941 4.834 5.085 0.285 7 0 "[ . 1]" 1
553 10 30 ALA C 11 31 ILE N 4.000 3.900 4.100 4.246 4.198 4.281 0.181 10 0 "[ . 1]" 1
554 10 30 ALA N 10 31 ILE N 3.450 3.400 3.500 3.595 3.423 3.699 0.199 2 0 "[ . 1]" 1
555 10 30 ALA O 11 31 ILE H 1.800 . 1.900 2.154 2.059 2.237 0.337 10 0 "[ . 1]" 1
556 10 32 ILE C 11 33 GLY N 4.000 3.900 4.100 3.887 3.830 3.998 0.070 3 0 "[ . 1]" 1
557 10 32 ILE CD1 12 17 LEU CB 5.500 3.000 8.000 8.255 8.060 8.364 0.364 9 0 "[ . 1]" 1
558 10 32 ILE CD1 12 19 PHE CZ 4.500 3.000 6.000 5.258 5.006 5.493 . 0 0 "[ . 1]" 1
559 10 32 ILE CG1 12 19 PHE CZ 4.500 3.000 6.000 6.173 6.048 6.261 0.261 5 0 "[ . 1]" 1
560 10 32 ILE CG2 12 17 LEU CB 5.500 3.000 8.000 8.162 7.961 8.282 0.282 2 0 "[ . 1]" 1
561 10 32 ILE CG2 12 19 PHE CZ 4.500 3.000 6.000 4.883 4.579 5.031 . 0 0 "[ . 1]" 1
562 10 32 ILE H 11 31 ILE O 1.800 . 1.900 1.951 1.721 2.074 0.174 5 0 "[ . 1]" 1
563 10 32 ILE N 11 31 ILE C 4.000 3.900 4.100 4.033 3.878 4.126 0.026 6 0 "[ . 1]" 1
564 10 32 ILE O 11 33 GLY H 1.800 . 1.900 1.749 1.684 1.897 0.016 3 0 "[ . 1]" 1
565 10 34 LEU C 11 35 MET N 4.000 3.900 4.100 4.239 4.152 4.345 0.245 4 0 "[ . 1]" 1
566 10 34 LEU CB 12 19 PHE CZ 4.500 3.000 6.000 4.996 4.571 6.008 0.008 8 0 "[ . 1]" 1
567 10 34 LEU CG 12 19 PHE CZ 4.500 3.000 6.000 4.772 4.448 5.013 . 0 0 "[ . 1]" 1
568 10 34 LEU H 11 33 GLY O 1.800 . 1.900 2.028 1.964 2.085 0.185 6 0 "[ . 1]" 1
569 10 34 LEU N 10 35 MET CE 6.000 5.000 7.000 7.165 7.066 7.317 0.317 5 0 "[ . 1]" 1
570 10 34 LEU N 11 33 GLY C 4.000 3.900 4.100 4.203 4.142 4.231 0.131 9 0 "[ . 1]" 1
571 10 34 LEU O 11 35 MET H 1.800 . 1.900 2.096 2.014 2.200 0.300 4 0 "[ . 1]" 1
572 10 35 MET C 11 35 MET C 4.650 4.500 4.800 4.773 4.653 4.922 0.122 2 0 "[ . 1]" 1
573 10 35 MET CE 10 37 GLY N 6.000 5.000 7.000 7.147 7.042 7.271 0.271 2 0 "[ . 1]" 1
574 10 35 MET CE 11 35 MET CE 4.650 4.500 4.800 4.836 4.410 4.926 0.126 6 0 "[ . 1]" 1
575 10 36 VAL C 10 37 GLY C 3.100 3.000 3.200 3.267 2.964 3.621 0.421 9 0 "[ . 1]" 1
576 10 36 VAL CB 12 19 PHE CZ 4.500 3.000 6.000 6.253 5.903 6.477 0.477 9 0 "[ . 1]" 1
577 10 36 VAL CG1 12 15 GLN CG 4.500 3.000 6.000 4.796 3.648 6.119 0.119 4 0 "[ . 1]" 1
578 10 36 VAL CG1 12 19 PHE CZ 4.500 3.000 6.000 6.047 5.288 6.415 0.415 5 0 "[ . 1]" 1
579 10 36 VAL CG2 12 15 GLN CG 4.500 3.000 6.000 5.862 4.179 6.238 0.238 8 0 "[ . 1]" 1
580 10 36 VAL CG2 12 19 PHE CZ 4.500 3.000 6.000 5.456 4.734 6.268 0.268 4 0 "[ . 1]" 1
581 10 36 VAL H 11 35 MET O 1.800 . 1.900 1.803 1.647 2.002 0.102 4 0 "[ . 1]" 1
582 10 36 VAL N 10 37 GLY N 3.450 3.300 3.600 3.413 3.292 3.640 0.040 5 0 "[ . 1]" 1
583 10 36 VAL N 11 35 MET C 4.000 3.900 4.100 3.889 3.691 4.055 0.209 6 0 "[ . 1]" 1
584 10 38 GLY C 10 39 VAL C 3.350 3.100 3.600 3.387 2.849 3.600 0.251 5 0 "[ . 1]" 1
585 10 38 GLY N 10 39 VAL N 3.400 3.300 3.500 3.021 2.894 3.140 0.406 8 0 "[ . 1]" 1
586 10 39 VAL C 11 39 VAL C 4.650 4.500 4.800 5.090 4.823 5.560 0.760 7 2 "[ .-+ 1]" 1
587 10 39 VAL CB 16 31 ILE CB 4.500 3.000 6.000 5.643 4.968 6.095 0.095 3 0 "[ . 1]" 1
588 10 39 VAL CB 16 31 ILE CD1 4.500 3.000 6.000 3.893 2.964 4.540 0.036 6 0 "[ . 1]" 1
589 10 39 VAL CB 16 31 ILE CG1 4.500 3.000 6.000 4.906 4.351 5.297 . 0 0 "[ . 1]" 1
590 10 39 VAL N 16 31 ILE CD1 3.000 . 4.000 4.508 4.150 5.231 1.231 6 3 "[ -+* 1]" 1
591 10 40 VAL C 12 13 HIS CB 4.500 3.000 6.000 5.378 4.283 6.242 0.242 7 0 "[ . 1]" 1
592 10 40 VAL CG1 12 13 HIS CE1 4.500 3.000 6.000 4.311 3.563 5.560 . 0 0 "[ . 1]" 1
593 10 40 VAL CG2 12 13 HIS CE1 4.500 3.000 6.000 5.277 3.533 6.069 0.069 9 0 "[ . 1]" 1
594 11 12 VAL C 12 12 VAL C 4.650 4.500 4.800 5.017 4.916 5.170 0.370 9 0 "[ . 1]" 1
595 11 15 GLN C 11 16 LYS C 3.100 2.900 3.300 3.573 3.369 3.655 0.355 1 0 "[ . 1]" 1
596 11 15 GLN N 11 16 LYS N 3.300 3.200 3.400 3.585 3.514 3.617 0.217 9 0 "[ . 1]" 1
597 11 17 LEU C 12 18 VAL N 4.000 3.900 4.100 4.069 3.884 4.165 0.065 3 0 "[ . 1]" 1
598 11 17 LEU H 12 16 LYS O 1.800 . 1.900 2.065 2.003 2.137 0.237 5 0 "[ . 1]" 1
599 11 17 LEU N 12 16 LYS C 4.000 3.900 4.100 4.234 4.154 4.307 0.207 2 0 "[ . 1]" 1
600 11 17 LEU O 12 18 VAL H 1.800 . 1.900 1.923 1.784 2.026 0.126 5 0 "[ . 1]" 1
601 11 18 VAL C 12 18 VAL C 4.650 4.500 4.800 4.850 4.647 4.976 0.176 9 0 "[ . 1]" 1
602 11 19 PHE C 12 20 PHE N 4.000 3.900 4.100 4.055 3.955 4.180 0.080 3 0 "[ . 1]" 1
603 11 19 PHE H 12 18 VAL O 1.800 . 1.900 1.907 1.868 1.997 0.097 8 0 "[ . 1]" 1
604 11 19 PHE N 12 18 VAL C 4.000 3.900 4.100 4.052 3.953 4.154 0.054 8 0 "[ . 1]" 1
605 11 19 PHE O 12 20 PHE H 1.800 . 1.900 1.941 1.867 1.995 0.095 3 0 "[ . 1]" 1
606 11 21 ALA C 12 22 GLU N 4.000 3.900 4.100 4.217 3.994 4.408 0.308 6 0 "[ . 1]" 1
607 11 21 ALA CB 12 21 ALA CB 4.650 4.500 4.800 4.711 4.232 4.955 0.268 6 0 "[ . 1]" 1
608 11 21 ALA H 12 20 PHE O 1.800 . 1.900 2.054 1.972 2.272 0.372 4 0 "[ . 1]" 1
609 11 21 ALA N 12 20 PHE C 4.000 3.900 4.100 4.126 4.054 4.172 0.072 4 0 "[ . 1]" 1
610 11 21 ALA O 12 22 GLU H 1.800 . 1.900 2.200 2.062 2.327 0.427 3 0 "[ . 1]" 1
611 11 23 ASP C 11 24 VAL C 2.750 2.600 2.900 3.172 2.820 3.602 0.702 7 2 "[ . + -1]" 1
612 11 23 ASP N 11 24 VAL N 2.950 2.800 3.100 2.906 2.812 3.028 . 0 0 "[ . 1]" 1
613 11 29 GLY C 11 30 ALA C 3.500 3.400 3.600 3.284 3.143 3.674 0.257 3 0 "[ . 1]" 1
614 11 29 GLY N 11 30 ALA N 3.450 3.300 3.600 3.126 2.902 3.224 0.398 7 0 "[ . 1]" 1
615 11 30 ALA C 12 30 ALA C 4.650 4.500 4.800 4.866 4.556 5.170 0.370 7 0 "[ . 1]" 1
616 11 30 ALA C 12 31 ILE N 4.000 3.900 4.100 4.175 4.012 4.317 0.217 6 0 "[ . 1]" 1
617 11 30 ALA N 11 31 ILE N 3.450 3.400 3.500 3.619 3.453 3.692 0.192 6 0 "[ . 1]" 1
618 11 30 ALA O 12 31 ILE H 1.800 . 1.900 2.044 1.937 2.228 0.328 6 0 "[ . 1]" 1
619 11 32 ILE C 12 33 GLY N 4.000 3.900 4.100 4.046 3.967 4.114 0.014 6 0 "[ . 1]" 1
620 11 32 ILE H 12 31 ILE O 1.800 . 1.900 1.906 1.698 2.033 0.133 7 0 "[ . 1]" 1
621 11 32 ILE N 12 31 ILE C 4.000 3.900 4.100 4.062 3.895 4.227 0.127 6 0 "[ . 1]" 1
622 11 32 ILE O 12 33 GLY H 1.800 . 1.900 1.901 1.868 1.936 0.036 3 0 "[ . 1]" 1
623 11 34 LEU C 12 35 MET N 4.000 3.900 4.100 4.171 4.041 4.250 0.150 5 0 "[ . 1]" 1
624 11 34 LEU H 12 33 GLY O 1.800 . 1.900 1.870 1.716 1.964 0.064 3 0 "[ . 1]" 1
625 11 34 LEU N 11 35 MET CE 6.000 5.000 7.000 7.192 7.111 7.296 0.296 8 0 "[ . 1]" 1
626 11 34 LEU N 12 33 GLY C 4.000 3.900 4.100 4.054 3.893 4.130 0.030 10 0 "[ . 1]" 1
627 11 34 LEU O 12 35 MET H 1.800 . 1.900 2.034 1.939 2.096 0.196 4 0 "[ . 1]" 1
628 11 35 MET C 12 35 MET C 4.650 4.500 4.800 4.791 4.639 4.890 0.090 9 0 "[ . 1]" 1
629 11 35 MET CE 11 37 GLY N 6.000 5.000 7.000 7.108 6.875 7.246 0.246 7 0 "[ . 1]" 1
630 11 35 MET CE 12 35 MET CE 4.650 4.500 4.800 4.751 4.478 4.929 0.129 8 0 "[ . 1]" 1
631 11 36 VAL C 11 37 GLY C 3.100 3.000 3.200 3.265 2.912 3.642 0.442 4 0 "[ . 1]" 1
632 11 36 VAL H 12 35 MET O 1.800 . 1.900 1.833 1.675 2.036 0.136 4 0 "[ . 1]" 1
633 11 36 VAL N 11 37 GLY N 3.450 3.300 3.600 3.586 3.504 3.647 0.047 3 0 "[ . 1]" 1
634 11 36 VAL N 12 35 MET C 4.000 3.900 4.100 3.927 3.770 4.111 0.130 6 0 "[ . 1]" 1
635 11 38 GLY C 11 39 VAL C 3.350 3.100 3.600 3.357 2.884 3.666 0.216 5 0 "[ . 1]" 1
636 11 38 GLY N 11 39 VAL N 3.400 3.300 3.500 3.108 3.004 3.179 0.296 6 0 "[ . 1]" 1
637 11 39 VAL C 12 39 VAL C 4.650 4.500 4.800 5.056 4.854 5.359 0.559 1 1 "[+ . 1]" 1
638 11 39 VAL CB 17 31 ILE CB 4.500 3.000 6.000 5.819 5.002 6.082 0.082 8 0 "[ . 1]" 1
639 11 39 VAL CB 17 31 ILE CD1 4.500 3.000 6.000 3.802 3.338 4.641 . 0 0 "[ . 1]" 1
640 11 39 VAL CB 17 31 ILE CG1 4.500 3.000 6.000 4.894 4.422 5.919 . 0 0 "[ . 1]" 1
641 11 39 VAL N 17 31 ILE CD1 3.000 . 4.000 4.123 3.308 4.583 0.583 6 3 "[ .+-* 1]" 1
642 12 15 GLN C 12 16 LYS C 3.100 2.900 3.300 3.577 3.428 3.629 0.329 5 0 "[ . 1]" 1
643 12 15 GLN N 12 16 LYS N 3.300 3.200 3.400 3.620 3.595 3.650 0.250 5 0 "[ . 1]" 1
644 12 23 ASP C 12 24 VAL C 2.750 2.600 2.900 3.013 2.908 3.126 0.226 10 0 "[ . 1]" 1
645 12 23 ASP N 12 24 VAL N 2.950 2.800 3.100 2.913 2.840 2.982 . 0 0 "[ . 1]" 1
646 12 29 GLY C 12 30 ALA C 3.500 3.400 3.600 3.529 3.188 3.688 0.212 2 0 "[ . 1]" 1
647 12 29 GLY N 12 30 ALA N 3.450 3.300 3.600 3.004 2.904 3.092 0.396 3 0 "[ . 1]" 1
648 12 30 ALA N 12 31 ILE N 3.450 3.400 3.500 3.632 3.562 3.666 0.166 6 0 "[ . 1]" 1
649 12 34 LEU N 12 35 MET CE 6.000 5.000 7.000 7.081 6.766 7.179 0.179 7 0 "[ . 1]" 1
650 12 35 MET CE 12 37 GLY N 6.000 5.000 7.000 7.002 6.710 7.159 0.159 6 0 "[ . 1]" 1
651 12 36 VAL C 12 37 GLY C 3.100 3.000 3.200 3.210 2.914 3.657 0.457 3 0 "[ . 1]" 1
652 12 36 VAL N 12 37 GLY N 3.450 3.300 3.600 3.555 3.485 3.644 0.044 5 0 "[ . 1]" 1
653 12 38 GLY C 12 39 VAL C 3.350 3.100 3.600 3.416 2.938 3.663 0.162 10 0 "[ . 1]" 1
654 12 38 GLY N 12 39 VAL N 3.400 3.300 3.500 3.103 2.965 3.170 0.335 7 0 "[ . 1]" 1
655 12 39 VAL CB 18 31 ILE CB 4.500 3.000 6.000 5.927 5.224 6.286 0.286 5 0 "[ . 1]" 1
656 12 39 VAL CB 18 31 ILE CD1 4.500 3.000 6.000 3.873 3.515 4.514 . 0 0 "[ . 1]" 1
657 12 39 VAL CB 18 31 ILE CG1 4.500 3.000 6.000 4.869 4.062 5.296 . 0 0 "[ . 1]" 1
658 12 39 VAL N 18 31 ILE CD1 3.000 . 4.000 4.087 3.692 4.545 0.545 7 1 "[ . + 1]" 1
659 13 12 VAL C 14 12 VAL C 4.650 4.500 4.800 4.914 4.784 5.000 0.200 2 0 "[ . 1]" 1
660 13 15 GLN C 13 16 LYS C 3.100 2.900 3.300 3.347 3.147 3.574 0.274 3 0 "[ . 1]" 1
661 13 15 GLN N 13 16 LYS N 3.300 3.200 3.400 3.591 3.563 3.611 0.211 1 0 "[ . 1]" 1
662 13 17 LEU C 14 18 VAL N 4.000 3.900 4.100 4.053 3.924 4.214 0.114 4 0 "[ . 1]" 1
663 13 17 LEU H 14 16 LYS O 1.800 . 1.900 1.977 1.866 2.053 0.153 9 0 "[ . 1]" 1
664 13 17 LEU N 14 16 LYS C 4.000 3.900 4.100 4.032 3.949 4.111 0.011 4 0 "[ . 1]" 1
665 13 17 LEU O 14 18 VAL H 1.800 . 1.900 1.965 1.911 2.057 0.157 4 0 "[ . 1]" 1
666 13 18 VAL C 14 18 VAL C 4.650 4.500 4.800 4.745 4.610 4.810 0.010 7 0 "[ . 1]" 1
667 13 19 PHE C 14 20 PHE N 4.000 3.900 4.100 4.032 3.886 4.103 0.014 4 0 "[ . 1]" 1
668 13 19 PHE H 14 18 VAL O 1.800 . 1.900 1.905 1.780 1.975 0.075 9 0 "[ . 1]" 1
669 13 19 PHE N 14 18 VAL C 4.000 3.900 4.100 3.987 3.906 4.046 . 0 0 "[ . 1]" 1
670 13 19 PHE O 14 20 PHE H 1.800 . 1.900 1.905 1.719 1.974 0.074 7 0 "[ . 1]" 1
671 13 21 ALA C 14 22 GLU N 4.000 3.900 4.100 4.156 4.086 4.272 0.172 7 0 "[ . 1]" 1
672 13 21 ALA CB 14 21 ALA CB 4.650 4.500 4.800 4.696 4.462 4.887 0.087 4 0 "[ . 1]" 1
673 13 21 ALA H 14 20 PHE O 1.800 . 1.900 1.828 1.696 1.950 0.050 6 0 "[ . 1]" 1
674 13 21 ALA N 14 20 PHE C 4.000 3.900 4.100 3.957 3.868 4.034 0.032 5 0 "[ . 1]" 1
675 13 21 ALA O 14 22 GLU H 1.800 . 1.900 2.018 1.958 2.075 0.175 1 0 "[ . 1]" 1
676 13 23 ASP C 13 24 VAL C 2.750 2.600 2.900 3.139 3.009 3.301 0.401 7 0 "[ . 1]" 1
677 13 23 ASP N 13 24 VAL N 2.950 2.800 3.100 2.897 2.799 2.967 0.001 6 0 "[ . 1]" 1
678 13 29 GLY C 13 30 ALA C 3.500 3.400 3.600 3.622 3.010 3.744 0.390 5 0 "[ . 1]" 1
679 13 29 GLY N 13 30 ALA N 3.450 3.300 3.600 3.149 2.991 3.430 0.309 2 0 "[ . 1]" 1
680 13 30 ALA C 14 30 ALA C 4.650 4.500 4.800 4.808 4.560 5.111 0.311 6 0 "[ . 1]" 1
681 13 30 ALA C 14 31 ILE N 4.000 3.900 4.100 4.149 3.966 4.307 0.207 5 0 "[ . 1]" 1
682 13 30 ALA N 13 31 ILE N 3.450 3.400 3.500 3.169 2.858 3.337 0.542 2 1 "[ + . 1]" 1
683 13 30 ALA O 14 31 ILE H 1.800 . 1.900 2.042 1.900 2.285 0.385 6 0 "[ . 1]" 1
684 13 32 ILE C 14 33 GLY N 4.000 3.900 4.100 3.814 3.754 3.903 0.146 9 0 "[ . 1]" 1
685 13 32 ILE CD1 15 17 LEU CB 5.500 3.000 8.000 8.155 8.066 8.209 0.209 6 0 "[ . 1]" 1
686 13 32 ILE CD1 15 19 PHE CZ 4.500 3.000 6.000 4.772 4.590 5.013 . 0 0 "[ . 1]" 1
687 13 32 ILE CG1 15 19 PHE CZ 4.500 3.000 6.000 5.783 5.613 6.046 0.046 5 0 "[ . 1]" 1
688 13 32 ILE CG2 15 17 LEU CB 5.500 3.000 8.000 8.186 8.082 8.291 0.291 2 0 "[ . 1]" 1
689 13 32 ILE CG2 15 19 PHE CZ 4.500 3.000 6.000 4.663 4.493 5.026 . 0 0 "[ . 1]" 1
690 13 32 ILE H 14 31 ILE O 1.800 . 1.900 2.001 1.840 2.075 0.175 3 0 "[ . 1]" 1
691 13 32 ILE N 14 31 ILE C 4.000 3.900 4.100 4.171 4.015 4.287 0.187 3 0 "[ . 1]" 1
692 13 32 ILE O 14 33 GLY H 1.800 . 1.900 1.715 1.643 1.830 0.057 7 0 "[ . 1]" 1
693 13 34 LEU C 14 35 MET N 4.000 3.900 4.100 4.217 4.151 4.262 0.162 4 0 "[ . 1]" 1
694 13 34 LEU CB 15 19 PHE CZ 4.500 3.000 6.000 6.042 5.940 6.143 0.143 2 0 "[ . 1]" 1
695 13 34 LEU CG 15 19 PHE CZ 4.500 3.000 6.000 6.128 6.038 6.208 0.208 4 0 "[ . 1]" 1
696 13 34 LEU H 14 33 GLY O 1.800 . 1.900 2.101 2.006 2.143 0.243 5 0 "[ . 1]" 1
697 13 34 LEU N 13 35 MET CE 6.000 5.000 7.000 7.216 7.049 7.359 0.359 9 0 "[ . 1]" 1
698 13 34 LEU N 14 33 GLY C 4.000 3.900 4.100 4.210 4.148 4.249 0.149 5 0 "[ . 1]" 1
699 13 34 LEU O 14 35 MET H 1.800 . 1.900 2.054 1.974 2.116 0.216 4 0 "[ . 1]" 1
700 13 35 MET C 14 35 MET C 4.650 4.500 4.800 4.915 4.839 4.998 0.198 2 0 "[ . 1]" 1
701 13 35 MET CE 13 37 GLY N 6.000 5.000 7.000 7.193 7.118 7.310 0.310 8 0 "[ . 1]" 1
702 13 35 MET CE 14 35 MET CE 4.650 4.500 4.800 4.832 4.568 5.044 0.244 5 0 "[ . 1]" 1
703 13 36 VAL C 13 37 GLY C 3.100 3.000 3.200 3.443 3.189 3.591 0.391 2 0 "[ . 1]" 1
704 13 36 VAL CB 15 19 PHE CZ 4.500 3.000 6.000 6.151 6.005 6.328 0.328 1 0 "[ . 1]" 1
705 13 36 VAL CG1 15 15 GLN CG 4.500 3.000 6.000 4.705 3.710 6.083 0.083 2 0 "[ . 1]" 1
706 13 36 VAL CG1 15 19 PHE CZ 4.500 3.000 6.000 6.170 5.422 6.384 0.384 5 0 "[ . 1]" 1
707 13 36 VAL CG2 15 15 GLN CG 4.500 3.000 6.000 6.072 5.421 6.432 0.432 10 0 "[ . 1]" 1
708 13 36 VAL CG2 15 19 PHE CZ 4.500 3.000 6.000 5.248 4.890 6.227 0.227 2 0 "[ . 1]" 1
709 13 36 VAL H 14 35 MET O 1.800 . 1.900 1.937 1.813 2.019 0.119 10 0 "[ . 1]" 1
710 13 36 VAL N 13 37 GLY N 3.450 3.300 3.600 3.389 3.294 3.490 0.006 5 0 "[ . 1]" 1
711 13 36 VAL N 14 35 MET C 4.000 3.900 4.100 4.075 3.951 4.128 0.028 7 0 "[ . 1]" 1
712 13 38 GLY C 13 39 VAL C 3.350 3.100 3.600 3.403 3.149 3.609 0.009 6 0 "[ . 1]" 1
713 13 38 GLY N 13 39 VAL N 3.400 3.300 3.500 3.023 2.947 3.084 0.353 10 0 "[ . 1]" 1
714 13 39 VAL C 14 39 VAL C 4.650 4.500 4.800 5.027 4.867 5.352 0.552 4 1 "[ +. 1]" 1
715 13 40 VAL C 15 13 HIS CB 4.500 3.000 6.000 5.301 3.364 6.019 0.019 1 0 "[ . 1]" 1
716 13 40 VAL CG1 15 13 HIS CE1 4.500 3.000 6.000 5.474 4.355 6.056 0.056 3 0 "[ . 1]" 1
717 13 40 VAL CG2 15 13 HIS CE1 4.500 3.000 6.000 5.356 3.840 6.023 0.023 2 0 "[ . 1]" 1
718 14 12 VAL C 15 12 VAL C 4.650 4.500 4.800 5.014 4.890 5.238 0.438 2 0 "[ . 1]" 1
719 14 15 GLN C 14 16 LYS C 3.100 2.900 3.300 3.341 3.176 3.569 0.269 1 0 "[ . 1]" 1
720 14 15 GLN N 14 16 LYS N 3.300 3.200 3.400 3.559 3.518 3.609 0.209 1 0 "[ . 1]" 1
721 14 17 LEU C 15 18 VAL N 4.000 3.900 4.100 4.078 3.899 4.156 0.056 3 0 "[ . 1]" 1
722 14 17 LEU H 15 16 LYS O 1.800 . 1.900 2.058 1.967 2.153 0.253 5 0 "[ . 1]" 1
723 14 17 LEU N 15 16 LYS C 4.000 3.900 4.100 4.118 4.034 4.196 0.096 2 0 "[ . 1]" 1
724 14 17 LEU O 15 18 VAL H 1.800 . 1.900 1.954 1.791 2.104 0.204 1 0 "[ . 1]" 1
725 14 18 VAL C 15 18 VAL C 4.650 4.500 4.800 4.816 4.725 4.883 0.083 2 0 "[ . 1]" 1
726 14 19 PHE C 15 20 PHE N 4.000 3.900 4.100 4.017 3.888 4.116 0.016 1 0 "[ . 1]" 1
727 14 19 PHE H 15 18 VAL O 1.800 . 1.900 1.868 1.755 1.999 0.099 2 0 "[ . 1]" 1
728 14 19 PHE N 15 18 VAL C 4.000 3.900 4.100 4.026 3.876 4.149 0.049 2 0 "[ . 1]" 1
729 14 19 PHE O 15 20 PHE H 1.800 . 1.900 1.848 1.688 1.963 0.063 1 0 "[ . 1]" 1
730 14 21 ALA C 15 22 GLU N 4.000 3.900 4.100 4.132 3.980 4.268 0.168 7 0 "[ . 1]" 1
731 14 21 ALA CB 15 21 ALA CB 4.650 4.500 4.800 4.731 4.486 4.941 0.141 3 0 "[ . 1]" 1
732 14 21 ALA H 15 20 PHE O 1.800 . 1.900 1.947 1.706 2.056 0.156 2 0 "[ . 1]" 1
733 14 21 ALA N 15 20 PHE C 4.000 3.900 4.100 4.046 3.867 4.115 0.033 1 0 "[ . 1]" 1
734 14 21 ALA O 15 22 GLU H 1.800 . 1.900 2.011 1.928 2.117 0.217 5 0 "[ . 1]" 1
735 14 23 ASP C 14 24 VAL C 2.750 2.600 2.900 3.152 2.965 3.308 0.408 7 0 "[ . 1]" 1
736 14 23 ASP N 14 24 VAL N 2.950 2.800 3.100 2.889 2.752 2.962 0.048 1 0 "[ . 1]" 1
737 14 29 GLY C 14 30 ALA C 3.500 3.400 3.600 3.421 3.177 3.750 0.223 9 0 "[ . 1]" 1
738 14 29 GLY N 14 30 ALA N 3.450 3.300 3.600 3.237 3.070 3.484 0.230 7 0 "[ . 1]" 1
739 14 30 ALA C 15 30 ALA C 4.650 4.500 4.800 4.860 4.700 5.016 0.216 6 0 "[ . 1]" 1
740 14 30 ALA C 15 31 ILE N 4.000 3.900 4.100 4.234 4.123 4.283 0.183 8 0 "[ . 1]" 1
741 14 30 ALA N 14 31 ILE N 3.450 3.400 3.500 3.387 3.223 3.638 0.177 4 0 "[ . 1]" 1
742 14 30 ALA O 15 31 ILE H 1.800 . 1.900 2.148 2.010 2.302 0.402 5 0 "[ . 1]" 1
743 14 32 ILE C 15 33 GLY N 4.000 3.900 4.100 3.896 3.779 4.092 0.121 6 0 "[ . 1]" 1
744 14 32 ILE CD1 16 17 LEU CB 5.500 3.000 8.000 8.166 7.204 8.362 0.362 7 0 "[ . 1]" 1
745 14 32 ILE CD1 16 19 PHE CZ 4.500 3.000 6.000 5.145 4.690 5.365 . 0 0 "[ . 1]" 1
746 14 32 ILE CG1 16 19 PHE CZ 4.500 3.000 6.000 6.020 5.711 6.295 0.295 6 0 "[ . 1]" 1
747 14 32 ILE CG2 16 17 LEU CB 5.500 3.000 8.000 8.180 8.082 8.455 0.455 1 0 "[ . 1]" 1
748 14 32 ILE CG2 16 19 PHE CZ 4.500 3.000 6.000 4.917 4.631 5.663 . 0 0 "[ . 1]" 1
749 14 32 ILE H 15 31 ILE O 1.800 . 1.900 1.938 1.712 2.078 0.178 6 0 "[ . 1]" 1
750 14 32 ILE N 15 31 ILE C 4.000 3.900 4.100 4.108 3.890 4.231 0.131 6 0 "[ . 1]" 1
751 14 32 ILE O 15 33 GLY H 1.800 . 1.900 1.790 1.674 1.969 0.069 1 0 "[ . 1]" 1
752 14 34 LEU C 15 35 MET N 4.000 3.900 4.100 4.211 4.139 4.274 0.174 3 0 "[ . 1]" 1
753 14 34 LEU CB 16 19 PHE CZ 4.500 3.000 6.000 5.542 4.928 6.059 0.059 8 0 "[ . 1]" 1
754 14 34 LEU CG 16 19 PHE CZ 4.500 3.000 6.000 5.584 4.898 6.011 0.011 2 0 "[ . 1]" 1
755 14 34 LEU H 15 33 GLY O 1.800 . 1.900 2.093 2.047 2.160 0.260 7 0 "[ . 1]" 1
756 14 34 LEU N 14 35 MET CE 6.000 5.000 7.000 7.278 7.119 7.454 0.454 9 0 "[ . 1]" 1
757 14 34 LEU N 15 33 GLY C 4.000 3.900 4.100 4.220 4.152 4.279 0.179 8 0 "[ . 1]" 1
758 14 34 LEU O 15 35 MET H 1.800 . 1.900 2.044 1.971 2.105 0.205 10 0 "[ . 1]" 1
759 14 35 MET C 15 35 MET C 4.650 4.500 4.800 4.887 4.705 5.018 0.218 3 0 "[ . 1]" 1
760 14 35 MET CE 14 37 GLY N 6.000 5.000 7.000 7.168 7.027 7.248 0.248 7 0 "[ . 1]" 1
761 14 35 MET CE 15 35 MET CE 4.650 4.500 4.800 4.949 4.862 5.021 0.221 5 0 "[ . 1]" 1
762 14 36 VAL C 14 37 GLY C 3.100 3.000 3.200 3.435 2.864 3.613 0.413 1 0 "[ . 1]" 1
763 14 36 VAL CB 16 19 PHE CZ 4.500 3.000 6.000 6.298 6.112 6.479 0.479 10 0 "[ . 1]" 1
764 14 36 VAL CG1 16 15 GLN CG 4.500 3.000 6.000 4.637 3.503 6.113 0.113 7 0 "[ . 1]" 1
765 14 36 VAL CG1 16 19 PHE CZ 4.500 3.000 6.000 6.080 5.578 6.463 0.463 6 0 "[ . 1]" 1
766 14 36 VAL CG2 16 15 GLN CG 4.500 3.000 6.000 5.731 4.411 6.274 0.274 4 0 "[ . 1]" 1
767 14 36 VAL CG2 16 19 PHE CZ 4.500 3.000 6.000 5.557 4.908 6.331 0.331 9 0 "[ . 1]" 1
768 14 36 VAL H 15 35 MET O 1.800 . 1.900 1.916 1.849 1.968 0.068 5 0 "[ . 1]" 1
769 14 36 VAL N 14 37 GLY N 3.450 3.300 3.600 3.387 3.163 3.561 0.137 8 0 "[ . 1]" 1
770 14 36 VAL N 15 35 MET C 4.000 3.900 4.100 4.059 3.966 4.148 0.048 9 0 "[ . 1]" 1
771 14 38 GLY C 14 39 VAL C 3.350 3.100 3.600 3.440 2.914 3.683 0.186 10 0 "[ . 1]" 1
772 14 38 GLY N 14 39 VAL N 3.400 3.300 3.500 3.052 2.956 3.119 0.344 5 0 "[ . 1]" 1
773 14 39 VAL C 15 39 VAL C 4.650 4.500 4.800 5.163 5.012 5.351 0.551 4 1 "[ +. 1]" 1
774 14 40 VAL C 16 13 HIS CB 4.500 3.000 6.000 5.434 4.268 6.170 0.170 8 0 "[ . 1]" 1
775 14 40 VAL CG1 16 13 HIS CE1 4.500 3.000 6.000 5.024 3.270 6.050 0.050 8 0 "[ . 1]" 1
776 14 40 VAL CG2 16 13 HIS CE1 4.500 3.000 6.000 5.247 3.725 6.132 0.132 1 0 "[ . 1]" 1
777 15 12 VAL C 16 12 VAL C 4.650 4.500 4.800 5.129 5.011 5.294 0.494 2 0 "[ . 1]" 1
778 15 15 GLN C 15 16 LYS C 3.100 2.900 3.300 3.514 3.310 3.646 0.346 2 0 "[ . 1]" 1
779 15 15 GLN N 15 16 LYS N 3.300 3.200 3.400 3.572 3.508 3.646 0.246 10 0 "[ . 1]" 1
780 15 17 LEU C 16 18 VAL N 4.000 3.900 4.100 4.118 3.975 4.272 0.172 5 0 "[ . 1]" 1
781 15 17 LEU H 16 16 LYS O 1.800 . 1.900 2.025 1.960 2.108 0.208 9 0 "[ . 1]" 1
782 15 17 LEU N 16 16 LYS C 4.000 3.900 4.100 4.191 4.139 4.316 0.216 9 0 "[ . 1]" 1
783 15 17 LEU O 16 18 VAL H 1.800 . 1.900 1.965 1.775 2.144 0.244 5 0 "[ . 1]" 1
784 15 18 VAL C 16 18 VAL C 4.650 4.500 4.800 4.816 4.712 4.934 0.134 1 0 "[ . 1]" 1
785 15 19 PHE C 16 20 PHE N 4.000 3.900 4.100 4.071 3.917 4.140 0.040 2 0 "[ . 1]" 1
786 15 19 PHE H 16 18 VAL O 1.800 . 1.900 1.901 1.754 2.031 0.131 9 0 "[ . 1]" 1
787 15 19 PHE N 16 18 VAL C 4.000 3.900 4.100 4.063 3.945 4.132 0.032 1 0 "[ . 1]" 1
788 15 19 PHE O 16 20 PHE H 1.800 . 1.900 1.928 1.765 2.016 0.116 7 0 "[ . 1]" 1
789 15 21 ALA C 16 22 GLU N 4.000 3.900 4.100 4.255 4.170 4.387 0.287 6 0 "[ . 1]" 1
790 15 21 ALA CB 16 21 ALA CB 4.650 4.500 4.800 4.753 4.392 5.103 0.303 8 0 "[ . 1]" 1
791 15 21 ALA H 16 20 PHE O 1.800 . 1.900 1.935 1.803 2.037 0.137 9 0 "[ . 1]" 1
792 15 21 ALA N 16 20 PHE C 4.000 3.900 4.100 4.084 3.924 4.164 0.064 3 0 "[ . 1]" 1
793 15 21 ALA O 16 22 GLU H 1.800 . 1.900 2.122 2.002 2.278 0.378 6 0 "[ . 1]" 1
794 15 23 ASP C 15 24 VAL C 2.750 2.600 2.900 3.024 2.856 3.211 0.311 1 0 "[ . 1]" 1
795 15 23 ASP N 15 24 VAL N 2.950 2.800 3.100 2.906 2.807 3.060 . 0 0 "[ . 1]" 1
796 15 29 GLY C 15 30 ALA C 3.500 3.400 3.600 3.298 3.034 3.573 0.366 6 0 "[ . 1]" 1
797 15 29 GLY N 15 30 ALA N 3.450 3.300 3.600 3.143 2.744 3.384 0.556 2 1 "[ + . 1]" 1
798 15 30 ALA C 16 30 ALA C 4.650 4.500 4.800 4.887 4.722 5.039 0.239 5 0 "[ . 1]" 1
799 15 30 ALA C 16 31 ILE N 4.000 3.900 4.100 4.247 4.162 4.353 0.253 4 0 "[ . 1]" 1
800 15 30 ALA N 15 31 ILE N 3.450 3.400 3.500 3.495 3.296 3.660 0.160 4 0 "[ . 1]" 1
801 15 30 ALA O 16 31 ILE H 1.800 . 1.900 2.135 2.005 2.281 0.381 4 0 "[ . 1]" 1
802 15 32 ILE C 16 33 GLY N 4.000 3.900 4.100 3.923 3.834 3.999 0.066 7 0 "[ . 1]" 1
803 15 32 ILE CD1 17 17 LEU CB 5.500 3.000 8.000 8.341 8.219 8.490 0.490 1 0 "[ . 1]" 1
804 15 32 ILE CD1 17 19 PHE CZ 4.500 3.000 6.000 5.211 4.552 5.538 . 0 0 "[ . 1]" 1
805 15 32 ILE CG1 17 19 PHE CZ 4.500 3.000 6.000 6.031 5.421 6.251 0.251 5 0 "[ . 1]" 1
806 15 32 ILE CG2 17 17 LEU CB 5.500 3.000 8.000 8.133 7.952 8.342 0.342 2 0 "[ . 1]" 1
807 15 32 ILE CG2 17 19 PHE CZ 4.500 3.000 6.000 4.734 4.469 4.965 . 0 0 "[ . 1]" 1
808 15 32 ILE H 16 31 ILE O 1.800 . 1.900 1.975 1.857 2.072 0.172 1 0 "[ . 1]" 1
809 15 32 ILE N 16 31 ILE C 4.000 3.900 4.100 4.126 3.981 4.209 0.109 1 0 "[ . 1]" 1
810 15 32 ILE O 16 33 GLY H 1.800 . 1.900 1.806 1.720 1.872 . 0 0 "[ . 1]" 1
811 15 34 LEU C 16 35 MET N 4.000 3.900 4.100 4.231 4.188 4.283 0.183 3 0 "[ . 1]" 1
812 15 34 LEU CB 17 19 PHE CZ 4.500 3.000 6.000 5.287 4.434 6.029 0.029 2 0 "[ . 1]" 1
813 15 34 LEU CG 17 19 PHE CZ 4.500 3.000 6.000 5.082 3.892 5.857 . 0 0 "[ . 1]" 1
814 15 34 LEU H 16 33 GLY O 1.800 . 1.900 2.052 1.995 2.166 0.266 2 0 "[ . 1]" 1
815 15 34 LEU N 15 35 MET CE 6.000 5.000 7.000 7.218 7.132 7.319 0.319 10 0 "[ . 1]" 1
816 15 34 LEU N 16 33 GLY C 4.000 3.900 4.100 4.205 4.142 4.259 0.159 7 0 "[ . 1]" 1
817 15 34 LEU O 16 35 MET H 1.800 . 1.900 2.059 1.994 2.116 0.216 2 0 "[ . 1]" 1
818 15 35 MET C 16 35 MET C 4.650 4.500 4.800 4.929 4.860 5.017 0.217 10 0 "[ . 1]" 1
819 15 35 MET CE 15 37 GLY N 6.000 5.000 7.000 7.173 7.036 7.250 0.250 5 0 "[ . 1]" 1
820 15 35 MET CE 16 35 MET CE 4.650 4.500 4.800 4.896 4.805 4.972 0.172 9 0 "[ . 1]" 1
821 15 36 VAL C 15 37 GLY C 3.100 3.000 3.200 3.430 2.927 3.635 0.435 2 0 "[ . 1]" 1
822 15 36 VAL CB 17 19 PHE CZ 4.500 3.000 6.000 6.263 6.149 6.473 0.473 8 0 "[ . 1]" 1
823 15 36 VAL CG1 17 15 GLN CG 4.500 3.000 6.000 4.551 3.641 6.161 0.161 10 0 "[ . 1]" 1
824 15 36 VAL CG1 17 19 PHE CZ 4.500 3.000 6.000 6.168 5.511 6.447 0.447 5 0 "[ . 1]" 1
825 15 36 VAL CG2 17 15 GLN CG 4.500 3.000 6.000 5.869 4.926 6.329 0.329 5 0 "[ . 1]" 1
826 15 36 VAL CG2 17 19 PHE CZ 4.500 3.000 6.000 5.384 5.032 6.326 0.326 10 0 "[ . 1]" 1
827 15 36 VAL H 16 35 MET O 1.800 . 1.900 1.900 1.753 2.004 0.104 1 0 "[ . 1]" 1
828 15 36 VAL N 15 37 GLY N 3.450 3.300 3.600 3.408 3.243 3.547 0.057 4 0 "[ . 1]" 1
829 15 36 VAL N 16 35 MET C 4.000 3.900 4.100 4.058 3.907 4.137 0.037 4 0 "[ . 1]" 1
830 15 38 GLY C 15 39 VAL C 3.350 3.100 3.600 3.423 2.837 3.646 0.263 5 0 "[ . 1]" 1
831 15 38 GLY N 15 39 VAL N 3.400 3.300 3.500 3.019 2.900 3.147 0.400 1 0 "[ . 1]" 1
832 15 39 VAL C 16 39 VAL C 4.650 4.500 4.800 5.215 5.035 5.550 0.750 5 2 "[ + - 1]" 1
833 15 40 VAL C 17 13 HIS CB 4.500 3.000 6.000 5.496 4.195 5.990 . 0 0 "[ . 1]" 1
834 15 40 VAL CG1 17 13 HIS CE1 4.500 3.000 6.000 5.110 3.483 6.052 0.052 8 0 "[ . 1]" 1
835 15 40 VAL CG2 17 13 HIS CE1 4.500 3.000 6.000 5.563 3.161 6.230 0.230 8 0 "[ . 1]" 1
836 16 12 VAL C 17 12 VAL C 4.650 4.500 4.800 5.129 5.028 5.228 0.428 3 0 "[ . 1]" 1
837 16 15 GLN C 16 16 LYS C 3.100 2.900 3.300 3.598 3.557 3.663 0.363 6 0 "[ . 1]" 1
838 16 15 GLN N 16 16 LYS N 3.300 3.200 3.400 3.614 3.586 3.669 0.269 6 0 "[ . 1]" 1
839 16 17 LEU C 17 18 VAL N 4.000 3.900 4.100 4.111 4.061 4.185 0.085 6 0 "[ . 1]" 1
840 16 17 LEU H 17 16 LYS O 1.800 . 1.900 2.031 1.960 2.082 0.182 3 0 "[ . 1]" 1
841 16 17 LEU N 17 16 LYS C 4.000 3.900 4.100 4.204 4.149 4.247 0.147 9 0 "[ . 1]" 1
842 16 17 LEU O 17 18 VAL H 1.800 . 1.900 1.949 1.856 2.080 0.180 1 0 "[ . 1]" 1
843 16 18 VAL C 17 18 VAL C 4.650 4.500 4.800 4.829 4.675 4.950 0.150 3 0 "[ . 1]" 1
844 16 19 PHE C 17 20 PHE N 4.000 3.900 4.100 4.064 3.929 4.166 0.066 3 0 "[ . 1]" 1
845 16 19 PHE H 17 18 VAL O 1.800 . 1.900 1.866 1.809 1.961 0.061 9 0 "[ . 1]" 1
846 16 19 PHE N 17 18 VAL C 4.000 3.900 4.100 4.034 3.954 4.117 0.017 3 0 "[ . 1]" 1
847 16 19 PHE O 17 20 PHE H 1.800 . 1.900 1.916 1.749 2.052 0.152 9 0 "[ . 1]" 1
848 16 21 ALA C 17 22 GLU N 4.000 3.900 4.100 4.248 4.163 4.343 0.243 5 0 "[ . 1]" 1
849 16 21 ALA CB 17 21 ALA CB 4.650 4.500 4.800 4.641 4.364 4.855 0.136 5 0 "[ . 1]" 1
850 16 21 ALA H 17 20 PHE O 1.800 . 1.900 2.017 1.949 2.160 0.260 3 0 "[ . 1]" 1
851 16 21 ALA N 17 20 PHE C 4.000 3.900 4.100 4.142 4.053 4.280 0.180 3 0 "[ . 1]" 1
852 16 21 ALA O 17 22 GLU H 1.800 . 1.900 2.138 2.031 2.273 0.373 9 0 "[ . 1]" 1
853 16 23 ASP C 16 24 VAL C 2.750 2.600 2.900 3.069 2.872 3.274 0.374 3 0 "[ . 1]" 1
854 16 23 ASP N 16 24 VAL N 2.950 2.800 3.100 2.946 2.805 3.099 . 0 0 "[ . 1]" 1
855 16 29 GLY C 16 30 ALA C 3.500 3.400 3.600 3.345 2.958 3.688 0.442 3 0 "[ . 1]" 1
856 16 29 GLY N 16 30 ALA N 3.450 3.300 3.600 3.120 2.980 3.272 0.320 8 0 "[ . 1]" 1
857 16 30 ALA C 17 30 ALA C 4.650 4.500 4.800 4.916 4.735 5.095 0.295 4 0 "[ . 1]" 1
858 16 30 ALA C 17 31 ILE N 4.000 3.900 4.100 4.211 4.116 4.328 0.228 6 0 "[ . 1]" 1
859 16 30 ALA N 16 31 ILE N 3.450 3.400 3.500 3.549 3.328 3.725 0.225 6 0 "[ . 1]" 1
860 16 30 ALA O 17 31 ILE H 1.800 . 1.900 2.087 1.940 2.262 0.362 8 0 "[ . 1]" 1
861 16 32 ILE C 17 33 GLY N 4.000 3.900 4.100 3.971 3.836 4.083 0.064 2 0 "[ . 1]" 1
862 16 32 ILE CD1 18 17 LEU CB 5.500 3.000 8.000 8.277 8.135 8.428 0.428 5 0 "[ . 1]" 1
863 16 32 ILE CD1 18 19 PHE CZ 4.500 3.000 6.000 5.353 5.061 5.528 . 0 0 "[ . 1]" 1
864 16 32 ILE CG1 18 19 PHE CZ 4.500 3.000 6.000 6.216 6.050 6.351 0.351 1 0 "[ . 1]" 1
865 16 32 ILE CG2 18 17 LEU CB 5.500 3.000 8.000 8.051 7.704 8.199 0.199 8 0 "[ . 1]" 1
866 16 32 ILE CG2 18 19 PHE CZ 4.500 3.000 6.000 4.865 4.592 5.274 . 0 0 "[ . 1]" 1
867 16 32 ILE H 17 31 ILE O 1.800 . 1.900 1.972 1.872 2.094 0.194 8 0 "[ . 1]" 1
868 16 32 ILE N 17 31 ILE C 4.000 3.900 4.100 4.072 3.987 4.151 0.051 2 0 "[ . 1]" 1
869 16 32 ILE O 17 33 GLY H 1.800 . 1.900 1.797 1.684 1.939 0.039 1 0 "[ . 1]" 1
870 16 34 LEU C 17 35 MET N 4.000 3.900 4.100 4.222 4.139 4.284 0.184 5 0 "[ . 1]" 1
871 16 34 LEU CB 18 19 PHE CZ 4.500 3.000 6.000 4.890 4.220 6.018 0.018 2 0 "[ . 1]" 1
872 16 34 LEU CG 18 19 PHE CZ 4.500 3.000 6.000 4.625 4.155 4.784 . 0 0 "[ . 1]" 1
873 16 34 LEU H 17 33 GLY O 1.800 . 1.900 1.994 1.936 2.066 0.166 2 0 "[ . 1]" 1
874 16 34 LEU N 16 35 MET CE 6.000 5.000 7.000 7.173 7.026 7.403 0.403 6 0 "[ . 1]" 1
875 16 34 LEU N 17 33 GLY C 4.000 3.900 4.100 4.186 4.128 4.262 0.162 2 0 "[ . 1]" 1
876 16 34 LEU O 17 35 MET H 1.800 . 1.900 2.094 1.982 2.179 0.279 6 0 "[ . 1]" 1
877 16 35 MET C 17 35 MET C 4.650 4.500 4.800 4.703 4.487 4.833 0.033 9 0 "[ . 1]" 1
878 16 35 MET CE 16 37 GLY N 6.000 5.000 7.000 7.135 6.939 7.251 0.251 4 0 "[ . 1]" 1
879 16 35 MET CE 17 35 MET CE 4.650 4.500 4.800 4.880 4.781 4.934 0.134 5 0 "[ . 1]" 1
880 16 36 VAL C 16 37 GLY C 3.100 3.000 3.200 3.345 2.985 3.641 0.441 7 0 "[ . 1]" 1
881 16 36 VAL CB 18 19 PHE CZ 4.500 3.000 6.000 6.288 6.096 6.478 0.478 1 0 "[ . 1]" 1
882 16 36 VAL CG1 18 15 GLN CG 4.500 3.000 6.000 4.219 3.695 6.131 0.131 7 0 "[ . 1]" 1
883 16 36 VAL CG1 18 19 PHE CZ 4.500 3.000 6.000 6.095 5.452 6.275 0.275 1 0 "[ . 1]" 1
884 16 36 VAL CG2 18 15 GLN CG 4.500 3.000 6.000 5.603 4.491 6.194 0.194 1 0 "[ . 1]" 1
885 16 36 VAL CG2 18 19 PHE CZ 4.500 3.000 6.000 5.325 4.915 6.293 0.293 7 0 "[ . 1]" 1
886 16 36 VAL H 17 35 MET O 1.800 . 1.900 1.853 1.624 1.978 0.078 1 0 "[ . 1]" 1
887 16 36 VAL N 16 37 GLY N 3.450 3.300 3.600 3.299 3.217 3.366 0.083 4 0 "[ . 1]" 1
888 16 36 VAL N 17 35 MET C 4.000 3.900 4.100 3.896 3.754 4.024 0.146 4 0 "[ . 1]" 1
889 16 38 GLY C 16 39 VAL C 3.350 3.100 3.600 3.482 3.093 3.657 0.057 10 0 "[ . 1]" 1
890 16 38 GLY N 16 39 VAL N 3.400 3.300 3.500 2.972 2.915 3.023 0.385 5 0 "[ . 1]" 1
891 16 39 VAL C 17 39 VAL C 4.650 4.500 4.800 5.137 4.859 5.710 0.910 8 2 "[ .- + 1]" 1
892 16 40 VAL C 18 13 HIS CB 4.500 3.000 6.000 5.302 4.045 6.175 0.175 6 0 "[ . 1]" 1
893 16 40 VAL CG1 18 13 HIS CE1 4.500 3.000 6.000 4.712 3.404 6.078 0.078 2 0 "[ . 1]" 1
894 16 40 VAL CG2 18 13 HIS CE1 4.500 3.000 6.000 5.405 3.355 6.068 0.068 8 0 "[ . 1]" 1
895 17 12 VAL C 18 12 VAL C 4.650 4.500 4.800 5.078 5.023 5.176 0.376 1 0 "[ . 1]" 1
896 17 15 GLN C 17 16 LYS C 3.100 2.900 3.300 3.578 3.463 3.661 0.361 3 0 "[ . 1]" 1
897 17 15 GLN N 17 16 LYS N 3.300 3.200 3.400 3.601 3.572 3.617 0.217 3 0 "[ . 1]" 1
898 17 17 LEU C 18 18 VAL N 4.000 3.900 4.100 4.059 3.972 4.148 0.048 3 0 "[ . 1]" 1
899 17 17 LEU H 18 16 LYS O 1.800 . 1.900 2.057 2.015 2.093 0.193 1 0 "[ . 1]" 1
900 17 17 LEU N 18 16 LYS C 4.000 3.900 4.100 4.204 4.167 4.234 0.134 5 0 "[ . 1]" 1
901 17 17 LEU O 18 18 VAL H 1.800 . 1.900 1.913 1.806 1.999 0.099 5 0 "[ . 1]" 1
902 17 18 VAL C 18 18 VAL C 4.650 4.500 4.800 4.876 4.817 4.966 0.166 7 0 "[ . 1]" 1
903 17 19 PHE C 18 20 PHE N 4.000 3.900 4.100 4.103 3.944 4.195 0.095 2 0 "[ . 1]" 1
904 17 19 PHE H 18 18 VAL O 1.800 . 1.900 1.860 1.754 1.940 0.040 7 0 "[ . 1]" 1
905 17 19 PHE N 18 18 VAL C 4.000 3.900 4.100 4.042 3.939 4.127 0.027 10 0 "[ . 1]" 1
906 17 19 PHE O 18 20 PHE H 1.800 . 1.900 1.943 1.837 2.028 0.128 9 0 "[ . 1]" 1
907 17 21 ALA C 18 22 GLU N 4.000 3.900 4.100 4.164 4.039 4.336 0.236 8 0 "[ . 1]" 1
908 17 21 ALA CB 18 21 ALA CB 4.650 4.500 4.800 4.736 4.422 4.866 0.078 8 0 "[ . 1]" 1
909 17 21 ALA H 18 20 PHE O 1.800 . 1.900 2.051 1.938 2.213 0.313 2 0 "[ . 1]" 1
910 17 21 ALA N 18 20 PHE C 4.000 3.900 4.100 4.128 4.068 4.173 0.073 5 0 "[ . 1]" 1
911 17 21 ALA O 18 22 GLU H 1.800 . 1.900 2.093 1.969 2.248 0.348 5 0 "[ . 1]" 1
912 17 23 ASP C 17 24 VAL C 2.750 2.600 2.900 3.029 2.886 3.194 0.294 7 0 "[ . 1]" 1
913 17 23 ASP N 17 24 VAL N 2.950 2.800 3.100 2.938 2.861 3.015 . 0 0 "[ . 1]" 1
914 17 29 GLY C 17 30 ALA C 3.500 3.400 3.600 3.516 3.129 3.724 0.271 7 0 "[ . 1]" 1
915 17 29 GLY N 17 30 ALA N 3.450 3.300 3.600 3.069 2.953 3.158 0.347 8 0 "[ . 1]" 1
916 17 30 ALA C 18 30 ALA C 4.650 4.500 4.800 4.889 4.677 4.981 0.181 3 0 "[ . 1]" 1
917 17 30 ALA C 18 31 ILE N 4.000 3.900 4.100 4.154 4.110 4.205 0.105 5 0 "[ . 1]" 1
918 17 30 ALA N 17 31 ILE N 3.450 3.400 3.500 3.482 3.317 3.659 0.159 9 0 "[ . 1]" 1
919 17 30 ALA O 18 31 ILE H 1.800 . 1.900 2.006 1.921 2.082 0.182 8 0 "[ . 1]" 1
920 17 32 ILE C 18 33 GLY N 4.000 3.900 4.100 4.008 3.879 4.115 0.021 8 0 "[ . 1]" 1
921 17 32 ILE H 18 31 ILE O 1.800 . 1.900 1.870 1.656 2.014 0.114 5 0 "[ . 1]" 1
922 17 32 ILE N 18 31 ILE C 4.000 3.900 4.100 4.012 3.837 4.165 0.065 5 0 "[ . 1]" 1
923 17 32 ILE O 18 33 GLY H 1.800 . 1.900 1.879 1.745 1.985 0.085 4 0 "[ . 1]" 1
924 17 34 LEU C 18 35 MET N 4.000 3.900 4.100 4.163 4.050 4.254 0.154 5 0 "[ . 1]" 1
925 17 34 LEU H 18 33 GLY O 1.800 . 1.900 1.874 1.684 2.026 0.126 8 0 "[ . 1]" 1
926 17 34 LEU N 17 35 MET CE 6.000 5.000 7.000 7.173 7.074 7.291 0.291 6 0 "[ . 1]" 1
927 17 34 LEU N 18 33 GLY C 4.000 3.900 4.100 4.051 3.852 4.157 0.057 1 0 "[ . 1]" 1
928 17 34 LEU O 18 35 MET H 1.800 . 1.900 2.019 1.890 2.106 0.206 4 0 "[ . 1]" 1
929 17 35 MET C 18 35 MET C 4.650 4.500 4.800 4.776 4.596 4.857 0.057 4 0 "[ . 1]" 1
930 17 35 MET CE 17 37 GLY N 6.000 5.000 7.000 7.118 7.023 7.295 0.295 5 0 "[ . 1]" 1
931 17 35 MET CE 18 35 MET CE 4.650 4.500 4.800 4.780 4.425 4.964 0.164 1 0 "[ . 1]" 1
932 17 36 VAL C 17 37 GLY C 3.100 3.000 3.200 3.375 2.943 3.684 0.484 2 0 "[ . 1]" 1
933 17 36 VAL H 18 35 MET O 1.800 . 1.900 1.944 1.849 2.114 0.214 2 0 "[ . 1]" 1
934 17 36 VAL N 17 37 GLY N 3.450 3.300 3.600 3.583 3.485 3.655 0.055 5 0 "[ . 1]" 1
935 17 36 VAL N 18 35 MET C 4.000 3.900 4.100 4.019 3.862 4.180 0.080 7 0 "[ . 1]" 1
936 17 38 GLY C 17 39 VAL C 3.350 3.100 3.600 3.422 2.861 3.697 0.239 9 0 "[ . 1]" 1
937 17 38 GLY N 17 39 VAL N 3.400 3.300 3.500 3.128 3.038 3.208 0.262 6 0 "[ . 1]" 1
938 17 39 VAL C 18 39 VAL C 4.650 4.500 4.800 5.074 4.848 5.253 0.453 8 0 "[ . 1]" 1
939 18 15 GLN C 18 16 LYS C 3.100 2.900 3.300 3.593 3.579 3.639 0.339 1 0 "[ . 1]" 1
940 18 15 GLN N 18 16 LYS N 3.300 3.200 3.400 3.610 3.574 3.637 0.237 6 0 "[ . 1]" 1
941 18 23 ASP C 18 24 VAL C 2.750 2.600 2.900 3.069 2.869 3.555 0.655 10 1 "[ . +]" 1
942 18 23 ASP N 18 24 VAL N 2.950 2.800 3.100 2.884 2.789 3.070 0.011 5 0 "[ . 1]" 1
943 18 29 GLY C 18 30 ALA C 3.500 3.400 3.600 3.498 3.103 3.672 0.297 9 0 "[ . 1]" 1
944 18 29 GLY N 18 30 ALA N 3.450 3.300 3.600 2.989 2.937 3.056 0.363 3 0 "[ . 1]" 1
945 18 30 ALA N 18 31 ILE N 3.450 3.400 3.500 3.615 3.505 3.650 0.150 10 0 "[ . 1]" 1
946 18 34 LEU N 18 35 MET CE 6.000 5.000 7.000 7.140 6.977 7.220 0.220 6 0 "[ . 1]" 1
947 18 35 MET CE 18 37 GLY N 6.000 5.000 7.000 6.979 6.246 7.173 0.173 4 0 "[ . 1]" 1
948 18 36 VAL C 18 37 GLY C 3.100 3.000 3.200 3.258 2.919 3.660 0.460 1 0 "[ . 1]" 1
949 18 36 VAL N 18 37 GLY N 3.450 3.300 3.600 3.550 3.371 3.660 0.060 5 0 "[ . 1]" 1
950 18 38 GLY C 18 39 VAL C 3.350 3.100 3.600 3.264 2.839 3.662 0.261 6 0 "[ . 1]" 1
951 18 38 GLY N 18 39 VAL N 3.400 3.300 3.500 3.114 3.032 3.193 0.268 7 0 "[ . 1]" 1
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