NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
527427 |
2lmn   |
18127 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lmn
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 540
_Distance_constraint_stats_list.Viol_count 3622
_Distance_constraint_stats_list.Viol_total 6914.108
_Distance_constraint_stats_list.Viol_max 1.822
_Distance_constraint_stats_list.Viol_rms 0.1722
_Distance_constraint_stats_list.Viol_average_all_restraints 0.1280
_Distance_constraint_stats_list.Viol_average_violations_only 0.1909
_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 1.213 0.266 8 0 "[ . 1]"
1 14 HIS 3.465 0.369 5 0 "[ . 1]"
1 15 GLN 3.465 0.369 5 0 "[ . 1]"
1 16 LYS 0.000 0.000 . 0 "[ . 1]"
1 17 LEU 1.867 0.191 7 0 "[ . 1]"
1 19 PHE 11.698 0.821 1 6 "[+* -* **1]"
1 21 ALA 3.377 0.214 2 0 "[ . 1]"
1 23 ASP 5.094 0.593 10 4 "[ ** . -+]"
1 24 VAL 4.226 0.593 10 3 "[ * . -+]"
1 26 SER 4.245 0.442 2 0 "[ . 1]"
1 27 ASN 4.245 0.442 2 0 "[ . 1]"
1 29 GLY 8.176 1.373 10 1 "[ . +]"
1 30 ALA 7.649 0.781 10 2 "[ . - +]"
1 31 ILE 10.794 1.373 10 2 "[ . - +]"
1 32 ILE 2.981 0.280 4 0 "[ . 1]"
1 33 GLY 0.312 0.212 8 0 "[ . 1]"
1 34 LEU 2.404 0.246 4 0 "[ . 1]"
1 35 MET 0.911 0.187 3 0 "[ . 1]"
1 36 VAL 3.004 0.217 9 0 "[ . 1]"
1 37 GLY 6.346 0.623 3 3 "[- + . * 1]"
1 38 GLY 0.342 0.047 3 0 "[ . 1]"
1 39 VAL 0.342 0.047 3 0 "[ . 1]"
2 12 VAL 3.221 0.321 6 0 "[ . 1]"
2 14 HIS 3.456 0.374 7 0 "[ . 1]"
2 15 GLN 3.456 0.374 7 0 "[ . 1]"
2 16 LYS 0.211 0.065 10 0 "[ . 1]"
2 17 LEU 1.884 0.241 7 0 "[ . 1]"
2 18 VAL 1.870 0.191 7 0 "[ . 1]"
2 19 PHE 10.918 0.663 3 6 "[-*+*.* *]"
2 20 PHE 1.545 0.166 8 0 "[ . 1]"
2 21 ALA 4.509 0.410 3 0 "[ . 1]"
2 22 GLU 2.367 0.214 2 0 "[ . 1]"
2 23 ASP 3.625 0.592 4 2 "[ -+. 1]"
2 24 VAL 3.124 0.592 4 2 "[ -+. 1]"
2 26 SER 4.380 0.474 8 0 "[ . 1]"
2 27 ASN 4.380 0.474 8 0 "[ . 1]"
2 29 GLY 9.201 0.895 10 6 "[* * .- **+]"
2 30 ALA 12.547 0.781 10 3 "[ . * -+]"
2 31 ILE 17.343 0.895 10 7 "[* * .*-**+]"
2 32 ILE 3.835 0.265 3 0 "[ . 1]"
2 33 GLY 2.464 0.246 4 0 "[ . 1]"
2 34 LEU 3.279 0.348 7 0 "[ . 1]"
2 35 MET 4.283 0.187 8 0 "[ . 1]"
2 36 VAL 3.322 0.241 1 0 "[ . 1]"
2 37 GLY 4.588 0.453 3 0 "[ . 1]"
2 38 GLY 0.327 0.047 5 0 "[ . 1]"
2 39 VAL 0.327 0.047 5 0 "[ . 1]"
3 12 VAL 4.483 0.446 2 0 "[ . 1]"
3 14 HIS 3.410 0.366 6 0 "[ . 1]"
3 15 GLN 3.410 0.366 6 0 "[ . 1]"
3 16 LYS 0.247 0.077 7 0 "[ . 1]"
3 17 LEU 1.373 0.138 7 0 "[ . 1]"
3 18 VAL 1.902 0.241 7 0 "[ . 1]"
3 19 PHE 10.579 0.723 3 5 "[ *+-. * *]"
3 20 PHE 2.137 0.410 3 0 "[ . 1]"
3 21 ALA 4.809 0.377 1 0 "[ . 1]"
3 22 GLU 2.578 0.243 1 0 "[ . 1]"
3 23 ASP 5.037 0.658 4 5 "[ +.** -*]"
3 24 VAL 4.286 0.658 4 5 "[ +.** -*]"
3 26 SER 4.235 0.448 2 0 "[ . 1]"
3 27 ASN 4.235 0.448 2 0 "[ . 1]"
3 28 LYS 0.868 0.566 3 1 "[ + . 1]"
3 29 GLY 10.386 1.225 10 9 "[****-*** +]"
3 30 ALA 10.798 0.560 10 3 "[ * -+]"
3 31 ILE 23.276 1.225 10 10 [-********+]
3 32 ILE 9.783 0.821 1 4 "[+* - *1]"
3 33 GLY 3.685 0.348 7 0 "[ . 1]"
3 34 LEU 3.868 0.305 1 0 "[ . 1]"
3 35 MET 6.044 0.302 7 0 "[ . 1]"
3 36 VAL 8.462 0.717 6 4 "[* -+ * 1]"
3 37 GLY 8.458 0.698 9 6 "[** .* *+-]"
3 38 GLY 0.172 0.038 10 0 "[ . 1]"
3 39 VAL 0.172 0.038 10 0 "[ . 1]"
4 12 VAL 4.968 0.650 7 1 "[ . + 1]"
4 14 HIS 3.512 0.390 2 0 "[ . 1]"
4 15 GLN 3.512 0.390 2 0 "[ . 1]"
4 16 LYS 0.337 0.094 10 0 "[ . 1]"
4 17 LEU 1.704 0.260 7 0 "[ . 1]"
4 18 VAL 1.196 0.138 7 0 "[ . 1]"
4 19 PHE 7.988 0.577 1 2 "[+ - 1]"
4 20 PHE 2.101 0.243 8 0 "[ . 1]"
4 21 ALA 4.584 0.321 1 0 "[ . 1]"
4 22 GLU 2.865 0.377 1 0 "[ . 1]"
4 23 ASP 5.115 0.650 3 2 "[ +-. 1]"
4 24 VAL 3.953 0.650 3 2 "[ +-. 1]"
4 26 SER 4.276 0.438 8 0 "[ . 1]"
4 27 ASN 4.276 0.438 8 0 "[ . 1]"
4 28 LYS 0.501 0.169 3 0 "[ . 1]"
4 29 GLY 10.914 1.177 1 8 "[+***.** **]"
4 30 ALA 11.427 0.708 1 2 "[+ * 1]"
4 31 ILE 20.062 1.177 1 9 [+***.****-]
4 32 ILE 8.978 0.521 1 1 "[+ . 1]"
4 33 GLY 2.602 0.217 3 0 "[ . 1]"
4 34 LEU 3.724 0.281 7 0 "[ . 1]"
4 35 MET 6.710 0.351 7 0 "[ . 1]"
4 36 VAL 9.704 0.663 3 6 "[-*+*.* *]"
4 37 GLY 7.757 0.651 4 4 "[ +- ** 1]"
4 38 GLY 0.188 0.036 5 0 "[ . 1]"
4 39 VAL 0.188 0.036 5 0 "[ . 1]"
5 12 VAL 3.935 0.650 7 1 "[ . + 1]"
5 14 HIS 3.525 0.363 7 0 "[ . 1]"
5 15 GLN 3.525 0.363 7 0 "[ . 1]"
5 16 LYS 0.865 0.260 7 0 "[ . 1]"
5 17 LEU 1.156 0.163 10 0 "[ . 1]"
5 18 VAL 1.001 0.111 3 0 "[ . 1]"
5 19 PHE 1.936 0.577 10 1 "[ . +]"
5 20 PHE 1.893 0.170 5 0 "[ . 1]"
5 21 ALA 6.726 1.192 10 1 "[ . +]"
5 22 GLU 3.095 0.321 1 0 "[ . 1]"
5 23 ASP 2.448 0.525 1 1 "[+ . 1]"
5 24 VAL 2.448 0.525 1 1 "[+ . 1]"
5 26 SER 4.183 0.456 5 0 "[ . 1]"
5 27 ASN 4.183 0.456 5 0 "[ . 1]"
5 28 LYS 0.752 0.175 10 0 "[ . 1]"
5 29 GLY 9.439 0.783 8 5 "[-** .* + 1]"
5 30 ALA 11.056 0.708 1 3 "[+ - *1]"
5 31 ILE 19.930 0.783 8 7 "[-** .**+*1]"
5 32 ILE 8.355 0.723 3 2 "[ -+ . 1]"
5 33 GLY 1.595 0.152 5 0 "[ . 1]"
5 34 LEU 4.708 0.371 10 0 "[ . 1]"
5 35 MET 8.147 0.298 6 0 "[ . 1]"
5 36 VAL 8.581 0.644 3 4 "[ +-. * *]"
5 37 GLY 7.788 0.668 8 5 "[* * . *+ -]"
5 38 GLY 0.149 0.034 10 0 "[ . 1]"
5 39 VAL 0.149 0.034 10 0 "[ . 1]"
6 12 VAL 1.443 0.262 2 0 "[ . 1]"
6 14 HIS 3.470 0.357 6 0 "[ . 1]"
6 15 GLN 3.470 0.357 6 0 "[ . 1]"
6 16 LYS 0.433 0.086 6 0 "[ . 1]"
6 18 VAL 1.563 0.170 6 0 "[ . 1]"
6 20 PHE 3.904 1.192 10 1 "[ . +]"
6 22 GLU 3.920 1.115 10 1 "[ . +]"
6 23 ASP 3.200 0.555 9 1 "[ . +1]"
6 24 VAL 3.200 0.555 9 1 "[ . +1]"
6 26 SER 4.116 0.437 8 0 "[ . 1]"
6 27 ASN 4.116 0.437 8 0 "[ . 1]"
6 28 LYS 1.163 0.243 8 0 "[ . 1]"
6 29 GLY 13.116 0.967 4 6 "[** +.* -*]"
6 30 ALA 6.613 0.666 9 2 "[ - +1]"
6 31 ILE 19.324 0.967 4 6 "[** +.* **]"
6 32 ILE 3.364 0.577 1 1 "[+ . 1]"
6 33 GLY 2.714 0.292 7 0 "[ . 1]"
6 34 LEU 0.002 0.002 6 0 "[ . 1]"
6 35 MET 7.562 0.371 10 0 "[ . 1]"
6 36 VAL 5.797 0.574 5 1 "[ + 1]"
6 37 GLY 6.946 0.614 8 3 "[ - *+ 1]"
6 38 GLY 0.206 0.044 5 0 "[ . 1]"
6 39 VAL 0.206 0.044 5 0 "[ . 1]"
7 12 VAL 1.230 0.272 2 0 "[ . 1]"
7 14 HIS 3.441 0.361 6 0 "[ . 1]"
7 15 GLN 3.441 0.361 6 0 "[ . 1]"
7 16 LYS 0.000 0.000 . 0 "[ . 1]"
7 17 LEU 1.893 0.184 6 0 "[ . 1]"
7 19 PHE 11.710 0.617 7 8 "[** *.*+-**]"
7 21 ALA 3.317 0.340 8 0 "[ . 1]"
7 23 ASP 3.726 0.564 8 1 "[ . + 1]"
7 24 VAL 3.173 0.564 8 1 "[ . + 1]"
7 26 SER 4.320 0.451 9 0 "[ . 1]"
7 27 ASN 4.320 0.451 9 0 "[ . 1]"
7 29 GLY 8.939 1.822 6 1 "[ .+ 1]"
7 30 ALA 6.887 0.554 6 1 "[ .+ 1]"
7 31 ILE 12.140 1.822 6 4 "[- * .+* 1]"
7 32 ILE 2.520 0.191 2 0 "[ . 1]"
7 33 GLY 0.486 0.187 3 0 "[ . 1]"
7 34 LEU 2.955 0.261 2 0 "[ . 1]"
7 35 MET 1.000 0.212 8 0 "[ . 1]"
7 36 VAL 2.662 0.244 2 0 "[ . 1]"
7 37 GLY 5.561 0.672 10 2 "[ . - +]"
7 38 GLY 0.315 0.047 3 0 "[ . 1]"
7 39 VAL 0.315 0.047 3 0 "[ . 1]"
8 12 VAL 3.381 0.288 9 0 "[ . 1]"
8 14 HIS 3.423 0.357 1 0 "[ . 1]"
8 15 GLN 3.423 0.357 1 0 "[ . 1]"
8 16 LYS 0.184 0.120 9 0 "[ . 1]"
8 17 LEU 1.840 0.167 10 0 "[ . 1]"
8 18 VAL 1.860 0.184 6 0 "[ . 1]"
8 19 PHE 10.099 0.637 10 3 "[ *-. +]"
8 20 PHE 1.696 0.211 8 0 "[ . 1]"
8 21 ALA 3.656 0.216 8 0 "[ . 1]"
8 22 GLU 2.045 0.340 8 0 "[ . 1]"
8 23 ASP 4.945 0.627 5 4 "[ -* +* 1]"
8 24 VAL 4.384 0.627 5 4 "[ -* +* 1]"
8 26 SER 4.322 0.462 2 0 "[ . 1]"
8 27 ASN 4.322 0.462 2 0 "[ . 1]"
8 29 GLY 8.898 1.019 7 8 "[** ** +-**]"
8 30 ALA 11.245 0.626 8 2 "[ .- + 1]"
8 31 ILE 15.217 1.019 7 8 "[** ** +-**]"
8 32 ILE 3.501 0.248 5 0 "[ . 1]"
8 33 GLY 2.467 0.261 2 0 "[ . 1]"
8 34 LEU 3.467 0.212 7 0 "[ . 1]"
8 35 MET 4.353 0.184 2 0 "[ . 1]"
8 36 VAL 3.419 0.215 10 0 "[ . 1]"
8 37 GLY 4.697 0.462 6 0 "[ . 1]"
8 38 GLY 0.260 0.042 4 0 "[ . 1]"
8 39 VAL 0.260 0.042 4 0 "[ . 1]"
9 12 VAL 4.533 0.664 10 1 "[ . +]"
9 14 HIS 3.501 0.362 10 0 "[ . 1]"
9 15 GLN 3.501 0.362 10 0 "[ . 1]"
9 16 LYS 0.153 0.064 6 0 "[ . 1]"
9 17 LEU 1.706 0.152 2 0 "[ . 1]"
9 18 VAL 1.880 0.167 10 0 "[ . 1]"
9 19 PHE 10.148 0.619 1 4 "[+ * . -*1]"
9 20 PHE 1.664 0.186 2 0 "[ . 1]"
9 21 ALA 4.166 0.207 1 0 "[ . 1]"
9 22 GLU 2.211 0.216 8 0 "[ . 1]"
9 23 ASP 4.118 0.665 7 2 "[ - + 1]"
9 24 VAL 3.333 0.665 7 2 "[ - + 1]"
9 26 SER 4.289 0.460 6 0 "[ . 1]"
9 27 ASN 4.289 0.460 6 0 "[ . 1]"
9 28 LYS 0.553 0.153 8 0 "[ . 1]"
9 29 GLY 11.320 1.081 6 10 [*****+***-]
9 30 ALA 10.680 0.617 6 1 "[ .+ 1]"
9 31 ILE 23.475 1.081 6 10 [*****+***-]
9 32 ILE 10.472 0.617 7 5 "[- .*+**1]"
9 33 GLY 3.043 0.302 7 0 "[ . 1]"
9 34 LEU 5.479 0.349 6 0 "[ . 1]"
9 35 MET 6.525 0.219 8 0 "[ . 1]"
9 36 VAL 9.354 0.588 10 6 "[ * *.**- +]"
9 37 GLY 8.615 0.900 2 7 "[-+* .****1]"
9 38 GLY 0.283 0.042 6 0 "[ . 1]"
9 39 VAL 0.283 0.042 6 0 "[ . 1]"
10 12 VAL 5.597 0.664 10 2 "[ . * +]"
10 14 HIS 3.408 0.371 6 0 "[ . 1]"
10 15 GLN 3.408 0.371 6 0 "[ . 1]"
10 16 LYS 0.137 0.036 9 0 "[ . 1]"
10 17 LEU 1.664 0.147 4 0 "[ . 1]"
10 18 VAL 1.885 0.152 2 0 "[ . 1]"
10 19 PHE 9.349 0.643 3 3 "[ +*. - 1]"
10 20 PHE 1.816 0.207 1 0 "[ . 1]"
10 21 ALA 4.282 0.231 1 0 "[ . 1]"
10 22 GLU 2.365 0.199 5 0 "[ . 1]"
10 23 ASP 5.273 0.690 5 3 "[- + * 1]"
10 24 VAL 3.279 0.690 5 3 "[- + * 1]"
10 26 SER 4.193 0.434 1 0 "[ . 1]"
10 27 ASN 4.193 0.434 1 0 "[ . 1]"
10 28 LYS 0.561 0.229 8 0 "[ . 1]"
10 29 GLY 9.366 0.906 4 9 "[ **+-*****]"
10 30 ALA 10.926 0.617 6 2 "[ - .+ 1]"
10 31 ILE 21.333 0.906 4 9 "[ **+-*****]"
10 32 ILE 8.796 0.637 10 2 "[ -. +]"
10 33 GLY 3.604 0.328 8 0 "[ . 1]"
10 34 LEU 4.691 0.311 1 0 "[ . 1]"
10 35 MET 7.344 0.349 6 0 "[ . 1]"
10 36 VAL 8.038 0.548 3 2 "[ +-. 1]"
10 37 GLY 7.139 0.631 8 4 "[ * .* + -]"
10 38 GLY 0.205 0.047 3 0 "[ . 1]"
10 39 VAL 0.205 0.047 3 0 "[ . 1]"
11 12 VAL 4.714 0.551 7 2 "[ . + -]"
11 14 HIS 3.469 0.362 10 0 "[ . 1]"
11 15 GLN 3.469 0.362 10 0 "[ . 1]"
11 16 LYS 0.463 0.095 7 0 "[ . 1]"
11 17 LEU 4.598 1.393 4 1 "[ +. 1]"
11 18 VAL 1.758 0.185 4 0 "[ . 1]"
11 19 PHE 2.912 1.188 9 1 "[ . +1]"
11 20 PHE 2.015 0.219 9 0 "[ . 1]"
11 21 ALA 5.043 1.020 9 1 "[ . +1]"
11 22 GLU 2.487 0.231 1 0 "[ . 1]"
11 23 ASP 3.851 0.697 10 3 "[ - . * +]"
11 24 VAL 3.851 0.697 10 3 "[ - . * +]"
11 26 SER 4.153 0.439 6 0 "[ . 1]"
11 27 ASN 4.153 0.439 6 0 "[ . 1]"
11 28 LYS 0.785 0.266 10 0 "[ . 1]"
11 29 GLY 8.461 0.724 6 3 "[* .+ -]"
11 30 ALA 12.178 0.734 8 2 "[ - . + 1]"
11 31 ILE 17.994 0.724 6 6 "[* * .+** -]"
11 32 ILE 8.450 0.594 3 2 "[ + . - 1]"
11 33 GLY 2.628 0.232 7 0 "[ . 1]"
11 34 LEU 3.757 0.344 5 0 "[ . 1]"
11 35 MET 7.788 0.311 1 0 "[ . 1]"
11 36 VAL 8.621 0.619 1 4 "[+ * . -*1]"
11 37 GLY 8.192 0.669 9 4 "[ .**-+1]"
11 38 GLY 0.134 0.037 10 0 "[ . 1]"
11 39 VAL 0.134 0.037 10 0 "[ . 1]"
12 12 VAL 1.499 0.318 2 0 "[ . 1]"
12 14 HIS 3.560 0.367 9 0 "[ . 1]"
12 15 GLN 3.560 0.367 9 0 "[ . 1]"
12 16 LYS 2.460 1.393 4 1 "[ +. 1]"
12 18 VAL 3.181 1.325 4 1 "[ +. 1]"
12 20 PHE 4.773 1.188 9 1 "[ . +1]"
12 22 GLU 2.139 0.265 9 0 "[ . 1]"
12 23 ASP 3.972 0.603 9 2 "[ . - +1]"
12 24 VAL 3.972 0.603 9 2 "[ . - +1]"
12 26 SER 4.140 0.433 5 0 "[ . 1]"
12 27 ASN 4.140 0.433 5 0 "[ . 1]"
12 28 LYS 1.994 0.465 8 0 "[ . 1]"
12 29 GLY 11.027 0.900 4 5 "[*- +. ** 1]"
12 30 ALA 5.982 0.401 5 0 "[ . 1]"
12 31 ILE 19.165 0.900 4 6 "[** +- ** 1]"
12 32 ILE 3.809 0.522 7 1 "[ . + 1]"
12 33 GLY 2.273 0.322 6 0 "[ . 1]"
12 34 LEU 0.000 0.000 . 0 "[ . 1]"
12 35 MET 7.407 0.344 5 0 "[ . 1]"
12 36 VAL 6.595 0.643 3 2 "[ +-. 1]"
12 37 GLY 6.320 0.514 6 2 "[ -.+ 1]"
12 38 GLY 0.290 0.048 1 0 "[ . 1]"
12 39 VAL 0.290 0.048 1 0 "[ . 1]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 12 VAL C 2 12 VAL C 4.650 4.500 4.800 4.921 4.842 5.066 0.266 8 0 "[ . 1]" 1
2 1 14 HIS N 1 15 GLN N 3.220 3.180 3.260 3.606 3.595 3.629 0.369 5 0 "[ . 1]" 1
3 1 15 GLN N 1 16 LYS N 4.240 3.490 4.990 3.666 3.653 3.682 . 0 0 "[ . 1]" 1
4 1 17 LEU C 2 18 VAL N 4.000 3.900 4.100 4.139 4.042 4.197 0.097 7 0 "[ . 1]" 1
5 1 17 LEU N 2 16 LYS C 4.000 3.900 4.100 4.094 3.955 4.165 0.065 10 0 "[ . 1]" 1
6 1 17 LEU O 2 18 VAL H 1.800 . 1.900 2.018 1.931 2.091 0.191 7 0 "[ . 1]" 1
7 1 19 PHE C 2 20 PHE N 4.000 3.900 4.100 4.050 3.946 4.187 0.087 3 0 "[ . 1]" 1
8 1 19 PHE CZ 3 32 ILE CD1 4.500 3.000 6.000 5.711 5.178 6.195 0.195 1 0 "[ . 1]" 1
9 1 19 PHE CZ 3 32 ILE CG1 4.500 3.000 6.000 6.248 5.823 6.821 0.821 1 2 "[+ - 1]" 1
10 1 19 PHE CZ 3 32 ILE CG2 4.500 3.000 6.000 6.107 5.477 6.658 0.658 2 2 "[ + . -1]" 1
11 1 19 PHE CZ 3 34 LEU CD1 4.500 3.000 6.000 3.756 2.981 5.564 0.019 9 0 "[ . 1]" 1
12 1 19 PHE CZ 3 34 LEU CD2 4.500 3.000 6.000 3.857 2.947 5.742 0.053 6 0 "[ . 1]" 1
13 1 19 PHE CZ 3 34 LEU CG 4.500 3.000 6.000 4.094 3.495 4.852 . 0 0 "[ . 1]" 1
14 1 19 PHE CZ 3 36 VAL CB 4.500 3.000 6.000 6.404 6.040 6.717 0.717 6 4 "[* -+ * 1]" 1
15 1 19 PHE CZ 3 36 VAL CG1 4.500 3.000 6.000 6.085 5.838 6.423 0.423 10 0 "[ . 1]" 1
16 1 19 PHE CZ 3 36 VAL CG2 4.500 3.000 6.000 5.384 4.871 6.124 0.124 6 0 "[ . 1]" 1
17 1 19 PHE H 2 18 VAL O 1.800 . 1.900 1.789 1.680 1.946 0.046 6 0 "[ . 1]" 1
18 1 19 PHE N 2 18 VAL C 4.000 3.900 4.100 3.979 3.881 4.150 0.050 6 0 "[ . 1]" 1
19 1 19 PHE O 2 20 PHE H 1.800 . 1.900 1.895 1.742 2.060 0.160 8 0 "[ . 1]" 1
20 1 21 ALA C 2 22 GLU N 4.000 3.900 4.100 4.142 3.840 4.264 0.164 1 0 "[ . 1]" 1
21 1 21 ALA H 2 20 PHE O 1.800 . 1.900 1.972 1.899 2.066 0.166 8 0 "[ . 1]" 1
22 1 21 ALA N 2 20 PHE C 4.000 3.900 4.100 4.110 3.954 4.194 0.094 8 0 "[ . 1]" 1
23 1 21 ALA O 2 22 GLU H 1.800 . 1.900 2.044 1.994 2.114 0.214 2 0 "[ . 1]" 1
24 1 23 ASP C 1 24 VAL C 2.450 . 2.900 3.314 3.116 3.493 0.593 10 3 "[ * . -+]" 1
25 1 23 ASP CG 3 28 LYS NZ 3.700 3.500 3.900 3.958 3.708 4.466 0.566 3 1 "[ + . 1]" 1
26 1 23 ASP N 1 24 VAL N 3.310 3.180 3.440 3.423 3.373 3.473 0.033 8 0 "[ . 1]" 1
27 1 26 SER N 1 27 ASN N 3.090 3.000 3.180 3.604 3.593 3.622 0.442 2 0 "[ . 1]" 1
28 1 29 GLY C 1 30 ALA C 3.320 3.230 3.410 3.227 2.757 3.376 0.473 10 0 "[ . 1]" 1
29 1 29 GLY CA 1 31 ILE CD1 4.500 3.000 6.000 6.249 5.643 6.641 0.641 10 1 "[ . +]" 1
30 1 29 GLY CA 1 31 ILE CG2 4.500 3.000 6.000 6.388 6.054 7.373 1.373 10 1 "[ . +]" 1
31 1 29 GLY N 1 30 ALA N 4.180 3.350 5.010 3.264 3.231 3.310 0.119 10 0 "[ . 1]" 1
32 1 30 ALA C 2 31 ILE N 4.000 3.900 4.100 4.152 3.844 4.318 0.218 5 0 "[ . 1]" 1
33 1 30 ALA CB 2 30 ALA CB 4.650 4.500 4.800 5.006 4.854 5.581 0.781 10 1 "[ . +]" 1
34 1 30 ALA O 2 31 ILE H 1.800 . 1.900 2.226 2.002 2.405 0.505 7 1 "[ . + 1]" 1
35 1 31 ILE CD1 7 37 GLY CA 4.500 3.000 6.000 4.147 3.381 5.291 . 0 0 "[ . 1]" 1
36 1 31 ILE CG2 7 37 GLY CA 4.500 3.000 6.000 3.304 3.141 3.687 . 0 0 "[ . 1]" 1
37 1 31 ILE CG2 7 37 GLY N 3.000 . 4.000 4.406 4.243 4.672 0.672 10 2 "[ . - +]" 1
38 1 32 ILE C 2 33 GLY N 4.000 3.900 4.100 3.962 3.809 4.109 0.091 8 0 "[ . 1]" 1
39 1 32 ILE H 2 31 ILE O 1.800 . 1.900 2.074 1.983 2.180 0.280 4 0 "[ . 1]" 1
40 1 32 ILE N 2 31 ILE C 4.000 3.900 4.100 4.182 4.089 4.316 0.216 4 0 "[ . 1]" 1
41 1 32 ILE O 2 33 GLY H 1.800 . 1.900 1.807 1.670 1.968 0.068 3 0 "[ . 1]" 1
42 1 33 GLY N 7 35 MET CE 3.000 . 4.000 3.622 3.107 4.212 0.212 8 0 "[ . 1]" 1
43 1 34 LEU C 2 35 MET N 4.000 3.900 4.100 4.042 3.891 4.184 0.084 1 0 "[ . 1]" 1
44 1 34 LEU H 2 33 GLY O 1.800 . 1.900 2.012 1.750 2.146 0.246 4 0 "[ . 1]" 1
45 1 34 LEU N 2 33 GLY C 4.000 3.900 4.100 4.126 3.932 4.214 0.114 5 0 "[ . 1]" 1
46 1 34 LEU O 2 35 MET H 1.800 . 1.900 1.926 1.772 2.072 0.172 1 0 "[ . 1]" 1
47 1 35 MET CE 1 37 GLY CA 4.500 3.000 6.000 5.153 4.418 6.091 0.091 10 0 "[ . 1]" 1
48 1 35 MET CE 2 35 MET CE 4.650 4.500 4.800 4.809 4.662 4.941 0.141 8 0 "[ . 1]" 1
49 1 35 MET CE 7 33 GLY N 3.000 . 4.000 3.839 3.124 4.187 0.187 3 0 "[ . 1]" 1
50 1 36 VAL H 2 35 MET O 1.800 . 1.900 2.004 1.919 2.068 0.168 2 0 "[ . 1]" 1
51 1 36 VAL N 1 37 GLY N 3.350 3.270 3.430 3.117 3.053 3.192 0.217 9 0 "[ . 1]" 1
52 1 36 VAL N 2 35 MET C 4.000 3.900 4.100 4.128 4.025 4.231 0.131 5 0 "[ . 1]" 1
53 1 37 GLY CA 7 31 ILE CD1 4.500 3.000 6.000 4.568 3.372 6.259 0.259 6 0 "[ . 1]" 1
54 1 37 GLY CA 7 31 ILE CG2 4.500 3.000 6.000 3.419 3.099 3.883 . 0 0 "[ . 1]" 1
55 1 37 GLY N 7 31 ILE CG2 3.000 . 4.000 4.446 4.301 4.623 0.623 3 3 "[- + . * 1]" 1
56 1 38 GLY N 1 39 VAL N 3.590 3.550 3.630 3.664 3.627 3.677 0.047 3 0 "[ . 1]" 1
57 2 12 VAL C 3 12 VAL C 4.650 4.500 4.800 5.001 4.916 5.121 0.321 6 0 "[ . 1]" 1
58 2 14 HIS N 2 15 GLN N 3.220 3.180 3.260 3.606 3.580 3.634 0.374 7 0 "[ . 1]" 1
59 2 15 GLN N 2 16 LYS N 4.240 3.490 4.990 3.666 3.650 3.689 . 0 0 "[ . 1]" 1
60 2 17 LEU C 3 18 VAL N 4.000 3.900 4.100 4.153 4.068 4.261 0.161 7 0 "[ . 1]" 1
61 2 17 LEU H 3 16 LYS O 1.800 . 1.900 1.892 1.763 1.977 0.077 7 0 "[ . 1]" 1
62 2 17 LEU N 3 16 LYS C 4.000 3.900 4.100 4.047 3.918 4.149 0.049 6 0 "[ . 1]" 1
63 2 17 LEU O 3 18 VAL H 1.800 . 1.900 2.006 1.932 2.141 0.241 7 0 "[ . 1]" 1
64 2 19 PHE C 3 20 PHE N 4.000 3.900 4.100 4.030 3.941 4.107 0.007 3 0 "[ . 1]" 1
65 2 19 PHE CZ 4 32 ILE CD1 4.500 3.000 6.000 5.719 4.473 6.101 0.101 9 0 "[ . 1]" 1
66 2 19 PHE CZ 4 32 ILE CG1 4.500 3.000 6.000 6.135 5.461 6.449 0.449 2 0 "[ . 1]" 1
67 2 19 PHE CZ 4 32 ILE CG2 4.500 3.000 6.000 5.761 4.940 6.521 0.521 1 1 "[+ . 1]" 1
68 2 19 PHE CZ 4 34 LEU CD1 4.500 3.000 6.000 4.085 3.327 5.632 . 0 0 "[ . 1]" 1
69 2 19 PHE CZ 4 34 LEU CD2 4.500 3.000 6.000 3.677 2.961 5.898 0.039 6 0 "[ . 1]" 1
70 2 19 PHE CZ 4 34 LEU CG 4.500 3.000 6.000 4.067 3.571 4.930 . 0 0 "[ . 1]" 1
71 2 19 PHE CZ 4 36 VAL CB 4.500 3.000 6.000 6.432 6.072 6.663 0.663 3 5 "[-*+ .* *]" 1
72 2 19 PHE CZ 4 36 VAL CG1 4.500 3.000 6.000 5.996 5.470 6.429 0.429 7 0 "[ . 1]" 1
73 2 19 PHE CZ 4 36 VAL CG2 4.500 3.000 6.000 5.613 4.937 6.549 0.549 4 1 "[ +. 1]" 1
74 2 19 PHE H 3 18 VAL O 1.800 . 1.900 1.859 1.726 1.969 0.069 3 0 "[ . 1]" 1
75 2 19 PHE N 3 18 VAL C 4.000 3.900 4.100 4.035 3.913 4.152 0.052 8 0 "[ . 1]" 1
76 2 19 PHE O 3 20 PHE H 1.800 . 1.900 1.884 1.734 1.996 0.096 3 0 "[ . 1]" 1
77 2 21 ALA C 3 22 GLU N 4.000 3.900 4.100 4.211 4.122 4.278 0.178 1 0 "[ . 1]" 1
78 2 21 ALA H 3 20 PHE O 1.800 . 1.900 2.030 1.923 2.310 0.410 3 0 "[ . 1]" 1
79 2 21 ALA N 3 20 PHE C 4.000 3.900 4.100 4.163 4.093 4.287 0.187 3 0 "[ . 1]" 1
80 2 21 ALA O 3 22 GLU H 1.800 . 1.900 2.047 1.946 2.143 0.243 1 0 "[ . 1]" 1
81 2 23 ASP C 2 24 VAL C 2.450 . 2.900 3.179 2.937 3.492 0.592 4 2 "[ -+. 1]" 1
82 2 23 ASP CG 4 28 LYS NZ 3.700 3.500 3.900 3.742 3.401 4.069 0.169 3 0 "[ . 1]" 1
83 2 23 ASP N 2 24 VAL N 3.310 3.180 3.440 3.453 3.350 3.549 0.109 7 0 "[ . 1]" 1
84 2 26 SER N 2 27 ASN N 3.090 3.000 3.180 3.618 3.564 3.654 0.474 8 0 "[ . 1]" 1
85 2 29 GLY C 2 30 ALA C 3.320 3.230 3.410 3.178 2.924 3.477 0.306 3 0 "[ . 1]" 1
86 2 29 GLY CA 2 31 ILE CD1 4.500 3.000 6.000 5.963 5.615 6.326 0.326 5 0 "[ . 1]" 1
87 2 29 GLY CA 2 31 ILE CG2 4.500 3.000 6.000 6.631 6.259 6.895 0.895 10 6 "[* * .- **+]" 1
88 2 29 GLY N 2 30 ALA N 4.180 3.350 5.010 3.288 3.182 3.357 0.168 10 0 "[ . 1]" 1
89 2 30 ALA C 3 31 ILE N 4.000 3.900 4.100 4.302 4.178 4.429 0.329 9 0 "[ . 1]" 1
90 2 30 ALA CB 3 30 ALA CB 4.650 4.500 4.800 5.048 4.747 5.360 0.560 10 2 "[ . -+]" 1
91 2 30 ALA O 3 31 ILE H 1.800 . 1.900 2.304 2.172 2.511 0.611 7 1 "[ . + 1]" 1
92 2 31 ILE CD1 8 37 GLY CA 4.500 3.000 6.000 4.247 3.750 5.340 . 0 0 "[ . 1]" 1
93 2 31 ILE CG2 8 37 GLY CA 4.500 3.000 6.000 3.635 3.320 3.864 . 0 0 "[ . 1]" 1
94 2 31 ILE CG2 8 37 GLY N 3.000 . 4.000 4.331 4.192 4.462 0.462 6 0 "[ . 1]" 1
95 2 32 ILE C 3 33 GLY N 4.000 3.900 4.100 4.083 3.896 4.213 0.113 9 0 "[ . 1]" 1
96 2 32 ILE H 3 31 ILE O 1.800 . 1.900 2.046 1.875 2.165 0.265 3 0 "[ . 1]" 1
97 2 32 ILE N 3 31 ILE C 4.000 3.900 4.100 4.212 4.076 4.314 0.214 9 0 "[ . 1]" 1
98 2 32 ILE O 3 33 GLY H 1.800 . 1.900 1.949 1.721 2.121 0.221 9 0 "[ . 1]" 1
99 2 33 GLY N 8 35 MET CE 3.000 . 4.000 3.818 3.304 4.111 0.111 3 0 "[ . 1]" 1
100 2 34 LEU C 3 35 MET N 4.000 3.900 4.100 4.108 3.945 4.207 0.107 6 0 "[ . 1]" 1
101 2 34 LEU H 3 33 GLY O 1.800 . 1.900 2.066 1.921 2.248 0.348 7 0 "[ . 1]" 1
102 2 34 LEU N 3 33 GLY C 4.000 3.900 4.100 4.134 4.013 4.195 0.095 9 0 "[ . 1]" 1
103 2 34 LEU O 3 35 MET H 1.800 . 1.900 1.963 1.766 2.090 0.190 6 0 "[ . 1]" 1
104 2 35 MET CE 2 37 GLY CA 4.500 3.000 6.000 5.780 4.381 6.130 0.130 10 0 "[ . 1]" 1
105 2 35 MET CE 3 35 MET CE 4.650 4.500 4.800 4.866 4.733 4.987 0.187 8 0 "[ . 1]" 1
106 2 35 MET CE 8 33 GLY N 3.000 . 4.000 3.834 3.036 4.128 0.128 3 0 "[ . 1]" 1
107 2 36 VAL H 3 35 MET O 1.800 . 1.900 2.000 1.777 2.141 0.241 1 0 "[ . 1]" 1
108 2 36 VAL N 2 37 GLY N 3.350 3.270 3.430 3.132 3.068 3.195 0.202 10 0 "[ . 1]" 1
109 2 36 VAL N 3 35 MET C 4.000 3.900 4.100 4.163 3.924 4.340 0.240 1 0 "[ . 1]" 1
110 2 37 GLY CA 8 31 ILE CD1 4.500 3.000 6.000 4.002 3.391 4.969 . 0 0 "[ . 1]" 1
111 2 37 GLY CA 8 31 ILE CG2 4.500 3.000 6.000 3.585 3.159 3.950 . 0 0 "[ . 1]" 1
112 2 37 GLY N 8 31 ILE CG2 3.000 . 4.000 4.264 4.112 4.453 0.453 3 0 "[ . 1]" 1
113 2 38 GLY N 2 39 VAL N 3.590 3.550 3.630 3.663 3.635 3.677 0.047 5 0 "[ . 1]" 1
114 3 12 VAL C 4 12 VAL C 4.650 4.500 4.800 5.048 4.913 5.246 0.446 2 0 "[ . 1]" 1
115 3 14 HIS N 3 15 GLN N 3.220 3.180 3.260 3.601 3.572 3.626 0.366 6 0 "[ . 1]" 1
116 3 15 GLN N 3 16 LYS N 4.240 3.490 4.990 3.667 3.646 3.689 . 0 0 "[ . 1]" 1
117 3 17 LEU C 4 18 VAL N 4.000 3.900 4.100 4.112 4.021 4.178 0.078 2 0 "[ . 1]" 1
118 3 17 LEU H 4 16 LYS O 1.800 . 1.900 1.908 1.838 1.994 0.094 10 0 "[ . 1]" 1
119 3 17 LEU N 4 16 LYS C 4.000 3.900 4.100 4.083 4.040 4.162 0.062 8 0 "[ . 1]" 1
120 3 17 LEU O 4 18 VAL H 1.800 . 1.900 1.967 1.863 2.038 0.138 7 0 "[ . 1]" 1
121 3 19 PHE C 4 20 PHE N 4.000 3.900 4.100 4.019 3.931 4.103 0.003 4 0 "[ . 1]" 1
122 3 19 PHE CZ 5 32 ILE CD1 4.500 3.000 6.000 5.641 4.878 6.244 0.244 8 0 "[ . 1]" 1
123 3 19 PHE CZ 5 32 ILE CG1 4.500 3.000 6.000 6.167 5.450 6.723 0.723 3 1 "[ + . 1]" 1
124 3 19 PHE CZ 5 32 ILE CG2 4.500 3.000 6.000 5.671 4.808 6.507 0.507 2 1 "[ + . 1]" 1
125 3 19 PHE CZ 5 34 LEU CD1 4.500 3.000 6.000 4.078 2.870 5.730 0.130 9 0 "[ . 1]" 1
126 3 19 PHE CZ 5 34 LEU CD2 4.500 3.000 6.000 3.653 3.095 4.393 . 0 0 "[ . 1]" 1
127 3 19 PHE CZ 5 34 LEU CG 4.500 3.000 6.000 3.952 3.194 4.598 . 0 0 "[ . 1]" 1
128 3 19 PHE CZ 5 36 VAL CB 4.500 3.000 6.000 6.391 6.033 6.644 0.644 3 4 "[ +-. * *]" 1
129 3 19 PHE CZ 5 36 VAL CG1 4.500 3.000 6.000 6.131 5.932 6.451 0.451 5 0 "[ . 1]" 1
130 3 19 PHE CZ 5 36 VAL CG2 4.500 3.000 6.000 5.396 4.899 5.954 . 0 0 "[ . 1]" 1
131 3 19 PHE H 4 18 VAL O 1.800 . 1.900 1.861 1.735 1.975 0.075 9 0 "[ . 1]" 1
132 3 19 PHE N 4 18 VAL C 4.000 3.900 4.100 4.018 3.931 4.109 0.009 9 0 "[ . 1]" 1
133 3 19 PHE O 4 20 PHE H 1.800 . 1.900 1.865 1.753 1.978 0.078 4 0 "[ . 1]" 1
134 3 21 ALA C 4 22 GLU N 4.000 3.900 4.100 4.233 4.146 4.477 0.377 1 0 "[ . 1]" 1
135 3 21 ALA H 4 20 PHE O 1.800 . 1.900 2.030 1.968 2.143 0.243 8 0 "[ . 1]" 1
136 3 21 ALA N 4 20 PHE C 4.000 3.900 4.100 4.162 4.071 4.212 0.112 8 0 "[ . 1]" 1
137 3 21 ALA O 4 22 GLU H 1.800 . 1.900 2.053 1.970 2.261 0.361 1 0 "[ . 1]" 1
138 3 23 ASP C 3 24 VAL C 2.450 . 2.900 3.306 2.827 3.558 0.658 4 5 "[ +.** -*]" 1
139 3 23 ASP CG 5 28 LYS NZ 3.700 3.500 3.900 3.722 3.387 4.075 0.175 10 0 "[ . 1]" 1
140 3 23 ASP N 3 24 VAL N 3.310 3.180 3.440 3.438 3.363 3.510 0.070 2 0 "[ . 1]" 1
141 3 26 SER N 3 27 ASN N 3.090 3.000 3.180 3.603 3.566 3.628 0.448 2 0 "[ . 1]" 1
142 3 29 GLY C 3 30 ALA C 3.320 3.230 3.410 3.251 3.039 3.452 0.191 8 0 "[ . 1]" 1
143 3 29 GLY CA 3 31 ILE CD1 4.500 3.000 6.000 5.970 5.431 6.260 0.260 3 0 "[ . 1]" 1
144 3 29 GLY CA 3 31 ILE CG2 4.500 3.000 6.000 6.780 6.467 7.225 1.225 10 9 "[****-*** +]" 1
145 3 29 GLY N 3 30 ALA N 4.180 3.350 5.010 3.246 3.139 3.327 0.211 7 0 "[ . 1]" 1
146 3 30 ALA C 4 31 ILE N 4.000 3.900 4.100 4.207 3.993 4.330 0.230 5 0 "[ . 1]" 1
147 3 30 ALA CB 4 30 ALA CB 4.650 4.500 4.800 5.006 4.353 5.355 0.555 5 1 "[ + 1]" 1
148 3 30 ALA O 4 31 ILE H 1.800 . 1.900 2.166 2.015 2.340 0.440 2 0 "[ . 1]" 1
149 3 31 ILE CD1 9 37 GLY CA 4.500 3.000 6.000 4.761 3.865 5.680 . 0 0 "[ . 1]" 1
150 3 31 ILE CG2 9 37 GLY CA 4.500 3.000 6.000 4.034 3.846 4.338 . 0 0 "[ . 1]" 1
151 3 31 ILE CG2 9 37 GLY N 3.000 . 4.000 4.591 4.433 4.900 0.900 2 7 "[-+* .****1]" 1
152 3 32 ILE C 4 33 GLY N 4.000 3.900 4.100 4.071 3.827 4.200 0.100 6 0 "[ . 1]" 1
153 3 32 ILE H 4 31 ILE O 1.800 . 1.900 2.086 2.024 2.169 0.269 3 0 "[ . 1]" 1
154 3 32 ILE N 4 31 ILE C 4.000 3.900 4.100 4.241 4.133 4.324 0.224 7 0 "[ . 1]" 1
155 3 32 ILE O 4 33 GLY H 1.800 . 1.900 1.918 1.681 2.113 0.213 6 0 "[ . 1]" 1
156 3 33 GLY N 9 35 MET CE 3.000 . 4.000 3.791 3.466 4.171 0.171 6 0 "[ . 1]" 1
157 3 34 LEU C 4 35 MET N 4.000 3.900 4.100 4.195 4.067 4.324 0.224 1 0 "[ . 1]" 1
158 3 34 LEU H 4 33 GLY O 1.800 . 1.900 1.970 1.815 2.108 0.208 5 0 "[ . 1]" 1
159 3 34 LEU N 4 33 GLY C 4.000 3.900 4.100 4.117 3.972 4.282 0.182 5 0 "[ . 1]" 1
160 3 34 LEU O 4 35 MET H 1.800 . 1.900 2.050 1.919 2.205 0.305 1 0 "[ . 1]" 1
161 3 35 MET CE 3 37 GLY CA 4.500 3.000 6.000 6.036 5.732 6.185 0.185 5 0 "[ . 1]" 1
162 3 35 MET CE 4 35 MET CE 4.650 4.500 4.800 4.887 4.748 5.001 0.201 4 0 "[ . 1]" 1
163 3 35 MET CE 9 33 GLY N 3.000 . 4.000 3.869 3.113 4.302 0.302 7 0 "[ . 1]" 1
164 3 36 VAL H 4 35 MET O 1.800 . 1.900 1.951 1.907 2.008 0.108 6 0 "[ . 1]" 1
165 3 36 VAL N 3 37 GLY N 3.350 3.270 3.430 3.043 2.975 3.104 0.295 10 0 "[ . 1]" 1
166 3 36 VAL N 4 35 MET C 4.000 3.900 4.100 4.134 4.065 4.222 0.122 6 0 "[ . 1]" 1
167 3 37 GLY CA 9 31 ILE CD1 4.500 3.000 6.000 5.102 3.892 6.014 0.014 7 0 "[ . 1]" 1
168 3 37 GLY CA 9 31 ILE CG2 4.500 3.000 6.000 4.056 3.757 4.400 . 0 0 "[ . 1]" 1
169 3 37 GLY N 9 31 ILE CG2 3.000 . 4.000 4.549 4.301 4.698 0.698 9 6 "[** .* *+-]" 1
170 3 38 GLY N 3 39 VAL N 3.590 3.550 3.630 3.643 3.594 3.668 0.038 10 0 "[ . 1]" 1
171 4 12 VAL C 5 12 VAL C 4.650 4.500 4.800 5.049 4.901 5.450 0.650 7 1 "[ . + 1]" 1
172 4 14 HIS N 4 15 GLN N 3.220 3.180 3.260 3.611 3.588 3.650 0.390 2 0 "[ . 1]" 1
173 4 15 GLN N 4 16 LYS N 4.240 3.490 4.990 3.669 3.644 3.685 . 0 0 "[ . 1]" 1
174 4 17 LEU C 5 18 VAL N 4.000 3.900 4.100 4.117 4.048 4.185 0.085 8 0 "[ . 1]" 1
175 4 17 LEU H 5 16 LYS O 1.800 . 1.900 1.916 1.697 2.160 0.260 7 0 "[ . 1]" 1
176 4 17 LEU N 5 16 LYS C 4.000 3.900 4.100 4.090 3.872 4.272 0.172 7 0 "[ . 1]" 1
177 4 17 LEU O 5 18 VAL H 1.800 . 1.900 1.958 1.886 2.011 0.111 3 0 "[ . 1]" 1
178 4 19 PHE C 5 20 PHE N 4.000 3.900 4.100 4.032 3.863 4.160 0.060 10 0 "[ . 1]" 1
179 4 19 PHE CZ 6 32 ILE CD1 4.500 3.000 6.000 5.618 5.059 5.999 . 0 0 "[ . 1]" 1
180 4 19 PHE CZ 6 32 ILE CG1 4.500 3.000 6.000 6.167 5.431 6.577 0.577 1 1 "[+ . 1]" 1
181 4 19 PHE CZ 6 32 ILE CG2 4.500 3.000 6.000 5.295 4.464 6.285 0.285 9 0 "[ . 1]" 1
182 4 19 PHE CZ 6 34 LEU CD1 4.500 3.000 6.000 4.187 3.274 5.533 . 0 0 "[ . 1]" 1
183 4 19 PHE CZ 6 34 LEU CD2 4.500 3.000 6.000 3.651 2.998 4.561 0.002 6 0 "[ . 1]" 1
184 4 19 PHE CZ 6 34 LEU CG 4.500 3.000 6.000 3.915 3.382 4.346 . 0 0 "[ . 1]" 1
185 4 19 PHE CZ 6 36 VAL CB 4.500 3.000 6.000 6.283 5.967 6.494 0.494 1 0 "[ . 1]" 1
186 4 19 PHE CZ 6 36 VAL CG1 4.500 3.000 6.000 5.552 5.037 6.110 0.110 9 0 "[ . 1]" 1
187 4 19 PHE CZ 6 36 VAL CG2 4.500 3.000 6.000 5.877 5.261 6.574 0.574 5 1 "[ + 1]" 1
188 4 19 PHE H 5 18 VAL O 1.800 . 1.900 1.811 1.713 1.969 0.069 1 0 "[ . 1]" 1
189 4 19 PHE N 5 18 VAL C 4.000 3.900 4.100 3.988 3.851 4.137 0.049 10 0 "[ . 1]" 1
190 4 19 PHE O 5 20 PHE H 1.800 . 1.900 1.861 1.685 1.987 0.087 7 0 "[ . 1]" 1
191 4 21 ALA C 5 22 GLU N 4.000 3.900 4.100 4.222 4.088 4.282 0.182 9 0 "[ . 1]" 1
192 4 21 ALA H 5 20 PHE O 1.800 . 1.900 1.996 1.888 2.070 0.170 5 0 "[ . 1]" 1
193 4 21 ALA N 5 20 PHE C 4.000 3.900 4.100 4.145 4.069 4.222 0.122 10 0 "[ . 1]" 1
194 4 21 ALA O 5 22 GLU H 1.800 . 1.900 2.086 1.994 2.221 0.321 1 0 "[ . 1]" 1
195 4 23 ASP C 4 24 VAL C 2.450 . 2.900 3.254 2.953 3.550 0.650 3 2 "[ +-. 1]" 1
196 4 23 ASP CG 6 28 LYS NZ 3.700 3.500 3.900 3.965 3.473 4.143 0.243 8 0 "[ . 1]" 1
197 4 23 ASP N 4 24 VAL N 3.310 3.180 3.440 3.433 3.197 3.652 0.212 1 0 "[ . 1]" 1
198 4 26 SER N 4 27 ASN N 3.090 3.000 3.180 3.608 3.580 3.618 0.438 8 0 "[ . 1]" 1
199 4 29 GLY C 4 30 ALA C 3.320 3.230 3.410 3.167 2.702 3.466 0.528 1 1 "[+ . 1]" 1
200 4 29 GLY CA 4 31 ILE CD1 4.500 3.000 6.000 5.947 5.288 6.453 0.453 1 0 "[ . 1]" 1
201 4 29 GLY CA 4 31 ILE CG2 4.500 3.000 6.000 6.724 6.381 7.177 1.177 1 8 "[+***.*- **]" 1
202 4 29 GLY N 4 30 ALA N 4.180 3.350 5.010 3.251 3.188 3.348 0.162 1 0 "[ . 1]" 1
203 4 30 ALA C 5 31 ILE N 4.000 3.900 4.100 4.249 3.991 4.482 0.382 9 0 "[ . 1]" 1
204 4 30 ALA CB 5 30 ALA CB 4.650 4.500 4.800 4.990 4.787 5.508 0.708 1 1 "[+ . 1]" 1
205 4 30 ALA O 5 31 ILE H 1.800 . 1.900 2.179 1.932 2.375 0.475 9 0 "[ . 1]" 1
206 4 31 ILE CD1 10 37 GLY CA 4.500 3.000 6.000 4.691 3.994 5.850 . 0 0 "[ . 1]" 1
207 4 31 ILE CG2 10 37 GLY CA 4.500 3.000 6.000 3.907 3.689 4.243 . 0 0 "[ . 1]" 1
208 4 31 ILE CG2 10 37 GLY N 3.000 . 4.000 4.446 4.246 4.631 0.631 8 4 "[ * .* + -]" 1
209 4 32 ILE C 5 33 GLY N 4.000 3.900 4.100 3.967 3.769 4.235 0.135 6 0 "[ . 1]" 1
210 4 32 ILE H 5 31 ILE O 1.800 . 1.900 2.116 1.965 2.252 0.352 1 0 "[ . 1]" 1
211 4 32 ILE N 5 31 ILE C 4.000 3.900 4.100 4.264 4.117 4.447 0.347 1 0 "[ . 1]" 1
212 4 32 ILE O 5 33 GLY H 1.800 . 1.900 1.833 1.673 2.023 0.123 6 0 "[ . 1]" 1
213 4 33 GLY N 10 35 MET CE 3.000 . 4.000 3.743 3.238 4.217 0.217 3 0 "[ . 1]" 1
214 4 34 LEU C 5 35 MET N 4.000 3.900 4.100 4.222 4.065 4.301 0.201 1 0 "[ . 1]" 1
215 4 34 LEU H 5 33 GLY O 1.800 . 1.900 1.946 1.866 2.052 0.152 5 0 "[ . 1]" 1
216 4 34 LEU N 5 33 GLY C 4.000 3.900 4.100 4.082 4.011 4.157 0.057 5 0 "[ . 1]" 1
217 4 34 LEU O 5 35 MET H 1.800 . 1.900 2.079 1.922 2.181 0.281 7 0 "[ . 1]" 1
218 4 35 MET CE 4 37 GLY CA 4.500 3.000 6.000 5.997 5.665 6.351 0.351 7 0 "[ . 1]" 1
219 4 35 MET CE 5 35 MET CE 4.650 4.500 4.800 4.908 4.607 5.098 0.298 6 0 "[ . 1]" 1
220 4 35 MET CE 10 33 GLY N 3.000 . 4.000 3.834 3.034 4.158 0.158 9 0 "[ . 1]" 1
221 4 36 VAL H 5 35 MET O 1.800 . 1.900 1.968 1.727 2.091 0.191 1 0 "[ . 1]" 1
222 4 36 VAL N 4 37 GLY N 3.350 3.270 3.430 3.056 2.994 3.148 0.276 7 0 "[ . 1]" 1
223 4 36 VAL N 5 35 MET C 4.000 3.900 4.100 4.113 3.906 4.307 0.207 1 0 "[ . 1]" 1
224 4 37 GLY CA 10 31 ILE CD1 4.500 3.000 6.000 4.978 4.299 5.836 . 0 0 "[ . 1]" 1
225 4 37 GLY CA 10 31 ILE CG2 4.500 3.000 6.000 3.944 3.708 4.271 . 0 0 "[ . 1]" 1
226 4 37 GLY N 10 31 ILE CG2 3.000 . 4.000 4.497 4.348 4.651 0.651 4 4 "[ +- ** 1]" 1
227 4 38 GLY N 4 39 VAL N 3.590 3.550 3.630 3.643 3.599 3.666 0.036 5 0 "[ . 1]" 1
228 5 12 VAL C 6 12 VAL C 4.650 4.500 4.800 4.944 4.846 5.062 0.262 2 0 "[ . 1]" 1
229 5 14 HIS N 5 15 GLN N 3.220 3.180 3.260 3.613 3.599 3.623 0.363 7 0 "[ . 1]" 1
230 5 15 GLN N 5 16 LYS N 4.240 3.490 4.990 3.653 3.632 3.675 . 0 0 "[ . 1]" 1
231 5 17 LEU C 6 18 VAL N 4.000 3.900 4.100 4.107 4.034 4.206 0.106 8 0 "[ . 1]" 1
232 5 17 LEU H 6 16 LYS O 1.800 . 1.900 1.918 1.841 1.986 0.086 6 0 "[ . 1]" 1
233 5 17 LEU N 6 16 LYS C 4.000 3.900 4.100 4.092 4.030 4.154 0.054 7 0 "[ . 1]" 1
234 5 17 LEU O 6 18 VAL H 1.800 . 1.900 1.942 1.835 2.063 0.163 10 0 "[ . 1]" 1
235 5 19 PHE C 6 20 PHE N 4.000 3.900 4.100 3.901 3.323 4.057 0.577 10 1 "[ . +]" 1
236 5 19 PHE H 6 18 VAL O 1.800 . 1.900 1.966 1.891 2.070 0.170 6 0 "[ . 1]" 1
237 5 19 PHE N 6 18 VAL C 4.000 3.900 4.100 4.043 3.781 4.141 0.119 10 0 "[ . 1]" 1
238 5 19 PHE O 6 20 PHE H 1.800 . 1.900 1.867 1.695 2.374 0.474 10 0 "[ . 1]" 1
239 5 21 ALA C 6 22 GLU N 4.000 3.900 4.100 4.123 3.735 4.218 0.165 10 0 "[ . 1]" 1
240 5 21 ALA H 6 20 PHE O 1.800 . 1.900 2.124 1.951 3.092 1.192 10 1 "[ . +]" 1
241 5 21 ALA N 6 20 PHE C 4.000 3.900 4.100 4.031 3.470 4.182 0.430 10 0 "[ . 1]" 1
242 5 21 ALA O 6 22 GLU H 1.800 . 1.900 2.207 1.997 3.015 1.115 10 1 "[ . +]" 1
243 5 23 ASP C 5 24 VAL C 2.450 . 2.900 3.123 2.779 3.425 0.525 1 1 "[+ . 1]" 1
244 5 23 ASP N 5 24 VAL N 3.310 3.180 3.440 3.430 3.377 3.471 0.031 8 0 "[ . 1]" 1
245 5 26 SER N 5 27 ASN N 3.090 3.000 3.180 3.598 3.530 3.636 0.456 5 0 "[ . 1]" 1
246 5 29 GLY C 5 30 ALA C 3.320 3.230 3.410 3.344 2.933 3.626 0.297 7 0 "[ . 1]" 1
247 5 29 GLY CA 5 31 ILE CD1 4.500 3.000 6.000 6.100 5.578 6.386 0.386 5 0 "[ . 1]" 1
248 5 29 GLY CA 5 31 ILE CG2 4.500 3.000 6.000 6.543 6.427 6.783 0.783 8 5 "[-** .* + 1]" 1
249 5 29 GLY N 5 30 ALA N 4.180 3.350 5.010 3.255 3.190 3.339 0.160 8 0 "[ . 1]" 1
250 5 30 ALA C 6 31 ILE N 4.000 3.900 4.100 4.193 4.063 4.327 0.227 9 0 "[ . 1]" 1
251 5 30 ALA CB 6 30 ALA CB 4.650 4.500 4.800 4.505 3.834 5.364 0.666 9 2 "[ - +1]" 1
252 5 30 ALA O 6 31 ILE H 1.800 . 1.900 2.184 2.081 2.300 0.400 5 0 "[ . 1]" 1
253 5 31 ILE CD1 11 37 GLY CA 4.500 3.000 6.000 4.337 3.819 5.379 . 0 0 "[ . 1]" 1
254 5 31 ILE CG2 11 37 GLY CA 4.500 3.000 6.000 3.862 3.670 4.047 . 0 0 "[ . 1]" 1
255 5 31 ILE CG2 11 37 GLY N 3.000 . 4.000 4.490 4.288 4.669 0.669 9 4 "[ .**-+1]" 1
256 5 32 ILE C 6 33 GLY N 4.000 3.900 4.100 3.956 3.765 4.208 0.135 8 0 "[ . 1]" 1
257 5 32 ILE H 6 31 ILE O 1.800 . 1.900 2.057 1.966 2.116 0.216 5 0 "[ . 1]" 1
258 5 32 ILE N 6 31 ILE C 4.000 3.900 4.100 4.194 4.126 4.280 0.180 5 0 "[ . 1]" 1
259 5 32 ILE O 6 33 GLY H 1.800 . 1.900 1.835 1.649 2.091 0.191 6 0 "[ . 1]" 1
260 5 33 GLY N 11 35 MET CE 3.000 . 4.000 3.654 3.250 4.040 0.040 5 0 "[ . 1]" 1
261 5 34 LEU C 6 35 MET N 4.000 3.900 4.100 4.254 4.172 4.369 0.269 10 0 "[ . 1]" 1
262 5 34 LEU H 6 33 GLY O 1.800 . 1.900 1.942 1.791 2.043 0.143 7 0 "[ . 1]" 1
263 5 34 LEU N 6 33 GLY C 4.000 3.900 4.100 4.026 3.767 4.173 0.133 6 0 "[ . 1]" 1
264 5 34 LEU O 6 35 MET H 1.800 . 1.900 2.119 2.032 2.271 0.371 10 0 "[ . 1]" 1
265 5 35 MET CE 5 37 GLY CA 4.500 3.000 6.000 6.100 5.990 6.194 0.194 8 0 "[ . 1]" 1
266 5 35 MET CE 6 35 MET CE 4.650 4.500 4.800 4.819 4.393 4.924 0.124 7 0 "[ . 1]" 1
267 5 35 MET CE 11 33 GLY N 3.000 . 4.000 3.791 3.133 4.224 0.224 3 0 "[ . 1]" 1
268 5 36 VAL H 6 35 MET O 1.800 . 1.900 1.967 1.765 2.086 0.186 9 0 "[ . 1]" 1
269 5 36 VAL N 5 37 GLY N 3.350 3.270 3.430 3.069 2.963 3.126 0.307 5 0 "[ . 1]" 1
270 5 36 VAL N 6 35 MET C 4.000 3.900 4.100 4.113 3.964 4.255 0.155 9 0 "[ . 1]" 1
271 5 37 GLY CA 11 31 ILE CD1 4.500 3.000 6.000 4.426 3.765 5.058 . 0 0 "[ . 1]" 1
272 5 37 GLY CA 11 31 ILE CG2 4.500 3.000 6.000 3.851 3.639 4.105 . 0 0 "[ . 1]" 1
273 5 37 GLY N 11 31 ILE CG2 3.000 . 4.000 4.476 4.284 4.668 0.668 8 5 "[* * . *+ -]" 1
274 5 38 GLY N 5 39 VAL N 3.590 3.550 3.630 3.634 3.580 3.664 0.034 10 0 "[ . 1]" 1
275 6 14 HIS N 6 15 GLN N 3.220 3.180 3.260 3.607 3.598 3.617 0.357 6 0 "[ . 1]" 1
276 6 15 GLN N 6 16 LYS N 4.240 3.490 4.990 3.670 3.656 3.685 . 0 0 "[ . 1]" 1
277 6 23 ASP C 6 24 VAL C 2.450 . 2.900 3.175 2.879 3.455 0.555 9 1 "[ . +1]" 1
278 6 23 ASP N 6 24 VAL N 3.310 3.180 3.440 3.464 3.398 3.580 0.140 3 0 "[ . 1]" 1
279 6 26 SER N 6 27 ASN N 3.090 3.000 3.180 3.592 3.569 3.617 0.437 8 0 "[ . 1]" 1
280 6 29 GLY C 6 30 ALA C 3.320 3.230 3.410 3.002 2.838 3.497 0.392 4 0 "[ . 1]" 1
281 6 29 GLY CA 6 31 ILE CD1 4.500 3.000 6.000 6.354 6.109 6.526 0.526 9 1 "[ . +1]" 1
282 6 29 GLY CA 6 31 ILE CG2 4.500 3.000 6.000 6.572 6.137 6.967 0.967 4 6 "[** +.* *-]" 1
283 6 29 GLY N 6 30 ALA N 4.180 3.350 5.010 3.228 3.085 3.297 0.265 1 0 "[ . 1]" 1
284 6 31 ILE CD1 12 37 GLY CA 4.500 3.000 6.000 4.206 3.529 5.896 . 0 0 "[ . 1]" 1
285 6 31 ILE CG2 12 37 GLY CA 4.500 3.000 6.000 3.939 3.743 4.178 . 0 0 "[ . 1]" 1
286 6 31 ILE CG2 12 37 GLY N 3.000 . 4.000 4.374 4.226 4.514 0.514 6 2 "[ -.+ 1]" 1
287 6 33 GLY N 12 35 MET CE 3.000 . 4.000 3.689 2.915 4.292 0.292 7 0 "[ . 1]" 1
288 6 35 MET CE 6 37 GLY CA 4.500 3.000 6.000 6.037 5.657 6.231 0.231 6 0 "[ . 1]" 1
289 6 35 MET CE 12 33 GLY N 3.000 . 4.000 3.853 3.391 4.322 0.322 6 0 "[ . 1]" 1
290 6 36 VAL N 6 37 GLY N 3.350 3.270 3.430 3.096 2.984 3.189 0.286 5 0 "[ . 1]" 1
291 6 37 GLY CA 12 31 ILE CD1 4.500 3.000 6.000 4.452 3.603 5.369 . 0 0 "[ . 1]" 1
292 6 37 GLY CA 12 31 ILE CG2 4.500 3.000 6.000 3.924 3.650 4.245 . 0 0 "[ . 1]" 1
293 6 37 GLY N 12 31 ILE CG2 3.000 . 4.000 4.409 4.282 4.614 0.614 8 3 "[ - *+ 1]" 1
294 6 38 GLY N 6 39 VAL N 3.590 3.550 3.630 3.645 3.601 3.674 0.044 5 0 "[ . 1]" 1
295 7 12 VAL C 8 12 VAL C 4.650 4.500 4.800 4.923 4.813 5.072 0.272 2 0 "[ . 1]" 1
296 7 14 HIS N 7 15 GLN N 3.220 3.180 3.260 3.604 3.582 3.621 0.361 6 0 "[ . 1]" 1
297 7 15 GLN N 7 16 LYS N 4.240 3.490 4.990 3.669 3.648 3.680 . 0 0 "[ . 1]" 1
298 7 17 LEU C 8 18 VAL N 4.000 3.900 4.100 4.145 4.085 4.205 0.105 6 0 "[ . 1]" 1
299 7 17 LEU N 8 16 LYS C 4.000 3.900 4.100 4.052 3.922 4.220 0.120 9 0 "[ . 1]" 1
300 7 17 LEU O 8 18 VAL H 1.800 . 1.900 2.024 1.914 2.084 0.184 6 0 "[ . 1]" 1
301 7 19 PHE C 8 20 PHE N 4.000 3.900 4.100 4.017 3.879 4.204 0.104 10 0 "[ . 1]" 1
302 7 19 PHE CZ 9 32 ILE CD1 4.500 3.000 6.000 5.803 5.216 6.106 0.106 3 0 "[ . 1]" 1
303 7 19 PHE CZ 9 32 ILE CG1 4.500 3.000 6.000 6.376 6.078 6.617 0.617 7 3 "[ .-+ *1]" 1
304 7 19 PHE CZ 9 32 ILE CG2 4.500 3.000 6.000 5.798 4.943 6.554 0.554 8 2 "[- . + 1]" 1
305 7 19 PHE CZ 9 34 LEU CD1 4.500 3.000 6.000 3.971 3.234 5.769 . 0 0 "[ . 1]" 1
306 7 19 PHE CZ 9 34 LEU CD2 4.500 3.000 6.000 3.914 2.993 5.570 0.007 10 0 "[ . 1]" 1
307 7 19 PHE CZ 9 34 LEU CG 4.500 3.000 6.000 4.050 3.618 4.475 . 0 0 "[ . 1]" 1
308 7 19 PHE CZ 9 36 VAL CB 4.500 3.000 6.000 6.448 6.151 6.588 0.588 10 6 "[ * *.**- +]" 1
309 7 19 PHE CZ 9 36 VAL CG1 4.500 3.000 6.000 5.963 5.543 6.282 0.282 9 0 "[ . 1]" 1
310 7 19 PHE CZ 9 36 VAL CG2 4.500 3.000 6.000 5.659 4.893 6.380 0.380 3 0 "[ . 1]" 1
311 7 19 PHE H 8 18 VAL O 1.800 . 1.900 1.768 1.669 1.948 0.048 8 0 "[ . 1]" 1
312 7 19 PHE N 8 18 VAL C 4.000 3.900 4.100 3.948 3.868 4.099 0.032 2 0 "[ . 1]" 1
313 7 19 PHE O 8 20 PHE H 1.800 . 1.900 1.838 1.684 2.002 0.102 10 0 "[ . 1]" 1
314 7 21 ALA C 8 22 GLU N 4.000 3.900 4.100 4.158 3.971 4.243 0.143 9 0 "[ . 1]" 1
315 7 21 ALA H 8 20 PHE O 1.800 . 1.900 1.998 1.945 2.111 0.211 8 0 "[ . 1]" 1
316 7 21 ALA N 8 20 PHE C 4.000 3.900 4.100 4.127 4.078 4.169 0.069 1 0 "[ . 1]" 1
317 7 21 ALA O 8 22 GLU H 1.800 . 1.900 2.034 1.936 2.240 0.340 8 0 "[ . 1]" 1
318 7 23 ASP C 7 24 VAL C 2.450 . 2.900 3.182 2.822 3.464 0.564 8 1 "[ . + 1]" 1
319 7 23 ASP CG 9 28 LYS NZ 3.700 3.500 3.900 3.643 3.413 4.053 0.153 8 0 "[ . 1]" 1
320 7 23 ASP N 7 24 VAL N 3.310 3.180 3.440 3.430 3.323 3.604 0.164 3 0 "[ . 1]" 1
321 7 26 SER N 7 27 ASN N 3.090 3.000 3.180 3.612 3.596 3.631 0.451 9 0 "[ . 1]" 1
322 7 29 GLY C 7 30 ALA C 3.320 3.230 3.410 3.245 2.811 3.405 0.419 6 0 "[ . 1]" 1
323 7 29 GLY CA 7 31 ILE CD1 4.500 3.000 6.000 6.230 5.681 6.849 0.849 6 1 "[ .+ 1]" 1
324 7 29 GLY CA 7 31 ILE CG2 4.500 3.000 6.000 6.460 6.205 7.822 1.822 6 1 "[ .+ 1]" 1
325 7 29 GLY N 7 30 ALA N 4.180 3.350 5.010 3.260 3.069 3.305 0.281 6 0 "[ . 1]" 1
326 7 30 ALA C 8 31 ILE N 4.000 3.900 4.100 4.114 4.011 4.231 0.131 3 0 "[ . 1]" 1
327 7 30 ALA CB 8 30 ALA CB 4.650 4.500 4.800 5.029 4.954 5.354 0.554 6 1 "[ .+ 1]" 1
328 7 30 ALA O 8 31 ILE H 1.800 . 1.900 2.170 2.093 2.298 0.398 2 0 "[ . 1]" 1
329 7 32 ILE C 8 33 GLY N 4.000 3.900 4.100 4.001 3.881 4.135 0.035 6 0 "[ . 1]" 1
330 7 32 ILE H 8 31 ILE O 1.800 . 1.900 2.038 1.927 2.091 0.191 2 0 "[ . 1]" 1
331 7 32 ILE N 8 31 ILE C 4.000 3.900 4.100 4.179 4.086 4.276 0.176 6 0 "[ . 1]" 1
332 7 32 ILE O 8 33 GLY H 1.800 . 1.900 1.845 1.683 2.015 0.115 2 0 "[ . 1]" 1
333 7 34 LEU C 8 35 MET N 4.000 3.900 4.100 4.118 4.000 4.189 0.089 7 0 "[ . 1]" 1
334 7 34 LEU H 8 33 GLY O 1.800 . 1.900 2.034 1.962 2.161 0.261 2 0 "[ . 1]" 1
335 7 34 LEU N 8 33 GLY C 4.000 3.900 4.100 4.127 4.088 4.193 0.093 7 0 "[ . 1]" 1
336 7 34 LEU O 8 35 MET H 1.800 . 1.900 1.991 1.828 2.081 0.181 6 0 "[ . 1]" 1
337 7 35 MET CE 7 37 GLY CA 4.500 3.000 6.000 5.086 4.279 5.955 . 0 0 "[ . 1]" 1
338 7 35 MET CE 8 35 MET CE 4.650 4.500 4.800 4.855 4.716 4.984 0.184 2 0 "[ . 1]" 1
339 7 36 VAL H 8 35 MET O 1.800 . 1.900 1.992 1.945 2.039 0.139 8 0 "[ . 1]" 1
340 7 36 VAL N 7 37 GLY N 3.350 3.270 3.430 3.120 3.026 3.179 0.244 2 0 "[ . 1]" 1
341 7 36 VAL N 8 35 MET C 4.000 3.900 4.100 4.115 4.055 4.187 0.087 4 0 "[ . 1]" 1
342 7 38 GLY N 7 39 VAL N 3.590 3.550 3.630 3.662 3.639 3.677 0.047 3 0 "[ . 1]" 1
343 8 12 VAL C 9 12 VAL C 4.650 4.500 4.800 5.015 4.810 5.088 0.288 9 0 "[ . 1]" 1
344 8 14 HIS N 8 15 GLN N 3.220 3.180 3.260 3.602 3.568 3.617 0.357 1 0 "[ . 1]" 1
345 8 15 GLN N 8 16 LYS N 4.240 3.490 4.990 3.665 3.654 3.677 . 0 0 "[ . 1]" 1
346 8 17 LEU C 9 18 VAL N 4.000 3.900 4.100 4.158 4.027 4.243 0.143 2 0 "[ . 1]" 1
347 8 17 LEU H 9 16 LYS O 1.800 . 1.900 1.852 1.692 1.951 0.051 1 0 "[ . 1]" 1
348 8 17 LEU N 9 16 LYS C 4.000 3.900 4.100 4.030 3.836 4.097 0.064 6 0 "[ . 1]" 1
349 8 17 LEU O 9 18 VAL H 1.800 . 1.900 2.001 1.873 2.067 0.167 10 0 "[ . 1]" 1
350 8 19 PHE C 9 20 PHE N 4.000 3.900 4.100 4.019 3.912 4.126 0.026 1 0 "[ . 1]" 1
351 8 19 PHE CZ 10 32 ILE CD1 4.500 3.000 6.000 5.960 5.767 6.086 0.086 3 0 "[ . 1]" 1
352 8 19 PHE CZ 10 32 ILE CG1 4.500 3.000 6.000 6.381 6.272 6.540 0.540 4 1 "[ +. 1]" 1
353 8 19 PHE CZ 10 32 ILE CG2 4.500 3.000 6.000 5.788 5.105 6.637 0.637 10 1 "[ . +]" 1
354 8 19 PHE CZ 10 34 LEU CD1 4.500 3.000 6.000 4.086 3.213 5.361 . 0 0 "[ . 1]" 1
355 8 19 PHE CZ 10 34 LEU CD2 4.500 3.000 6.000 3.788 3.008 4.615 . 0 0 "[ . 1]" 1
356 8 19 PHE CZ 10 34 LEU CG 4.500 3.000 6.000 4.222 3.543 4.493 . 0 0 "[ . 1]" 1
357 8 19 PHE CZ 10 36 VAL CB 4.500 3.000 6.000 6.281 5.991 6.548 0.548 3 2 "[ +-. 1]" 1
358 8 19 PHE CZ 10 36 VAL CG1 4.500 3.000 6.000 6.205 6.003 6.464 0.464 9 0 "[ . 1]" 1
359 8 19 PHE CZ 10 36 VAL CG2 4.500 3.000 6.000 5.107 4.750 5.535 . 0 0 "[ . 1]" 1
360 8 19 PHE H 9 18 VAL O 1.800 . 1.900 1.870 1.736 1.972 0.072 2 0 "[ . 1]" 1
361 8 19 PHE N 9 18 VAL C 4.000 3.900 4.100 4.035 3.916 4.141 0.041 2 0 "[ . 1]" 1
362 8 19 PHE O 9 20 PHE H 1.800 . 1.900 1.854 1.712 1.969 0.069 10 0 "[ . 1]" 1
363 8 21 ALA C 9 22 GLU N 4.000 3.900 4.100 4.186 4.095 4.293 0.193 8 0 "[ . 1]" 1
364 8 21 ALA H 9 20 PHE O 1.800 . 1.900 2.003 1.946 2.086 0.186 2 0 "[ . 1]" 1
365 8 21 ALA N 9 20 PHE C 4.000 3.900 4.100 4.141 4.104 4.246 0.146 1 0 "[ . 1]" 1
366 8 21 ALA O 9 22 GLU H 1.800 . 1.900 2.035 1.966 2.116 0.216 8 0 "[ . 1]" 1
367 8 23 ASP C 8 24 VAL C 2.450 . 2.900 3.303 2.907 3.527 0.627 5 4 "[ -* +* 1]" 1
368 8 23 ASP CG 10 28 LYS NZ 3.700 3.500 3.900 3.743 3.466 4.129 0.229 8 0 "[ . 1]" 1
369 8 23 ASP N 8 24 VAL N 3.310 3.180 3.440 3.452 3.344 3.570 0.130 7 0 "[ . 1]" 1
370 8 26 SER N 8 27 ASN N 3.090 3.000 3.180 3.612 3.583 3.642 0.462 2 0 "[ . 1]" 1
371 8 29 GLY C 8 30 ALA C 3.320 3.230 3.410 3.166 2.876 3.400 0.354 8 0 "[ . 1]" 1
372 8 29 GLY CA 8 31 ILE CD1 4.500 3.000 6.000 5.884 5.078 6.495 0.495 8 0 "[ . 1]" 1
373 8 29 GLY CA 8 31 ILE CG2 4.500 3.000 6.000 6.630 6.108 7.019 1.019 7 8 "[** ** +-**]" 1
374 8 29 GLY N 8 30 ALA N 4.180 3.350 5.010 3.310 3.221 3.373 0.129 8 0 "[ . 1]" 1
375 8 30 ALA C 9 31 ILE N 4.000 3.900 4.100 4.280 4.169 4.444 0.344 2 0 "[ . 1]" 1
376 8 30 ALA CB 9 30 ALA CB 4.650 4.500 4.800 4.945 4.805 5.173 0.373 8 0 "[ . 1]" 1
377 8 30 ALA O 9 31 ILE H 1.800 . 1.900 2.312 2.219 2.526 0.626 8 1 "[ . + 1]" 1
378 8 32 ILE C 9 33 GLY N 4.000 3.900 4.100 4.091 3.983 4.178 0.078 7 0 "[ . 1]" 1
379 8 32 ILE H 9 31 ILE O 1.800 . 1.900 2.055 1.907 2.148 0.248 5 0 "[ . 1]" 1
380 8 32 ILE N 9 31 ILE C 4.000 3.900 4.100 4.223 4.092 4.339 0.239 5 0 "[ . 1]" 1
381 8 32 ILE O 9 33 GLY H 1.800 . 1.900 1.937 1.791 2.065 0.165 3 0 "[ . 1]" 1
382 8 34 LEU C 9 35 MET N 4.000 3.900 4.100 4.155 4.068 4.204 0.104 6 0 "[ . 1]" 1
383 8 34 LEU H 9 33 GLY O 1.800 . 1.900 2.036 1.987 2.112 0.212 7 0 "[ . 1]" 1
384 8 34 LEU N 9 33 GLY C 4.000 3.900 4.100 4.138 4.053 4.221 0.121 8 0 "[ . 1]" 1
385 8 34 LEU O 9 35 MET H 1.800 . 1.900 2.007 1.906 2.071 0.171 6 0 "[ . 1]" 1
386 8 35 MET CE 8 37 GLY CA 4.500 3.000 6.000 5.628 4.840 6.125 0.125 2 0 "[ . 1]" 1
387 8 35 MET CE 9 35 MET CE 4.650 4.500 4.800 4.816 4.480 4.982 0.182 3 0 "[ . 1]" 1
388 8 36 VAL H 9 35 MET O 1.800 . 1.900 2.028 1.950 2.115 0.215 10 0 "[ . 1]" 1
389 8 36 VAL N 8 37 GLY N 3.350 3.270 3.430 3.155 3.115 3.207 0.155 2 0 "[ . 1]" 1
390 8 36 VAL N 9 35 MET C 4.000 3.900 4.100 4.199 4.135 4.248 0.148 10 0 "[ . 1]" 1
391 8 38 GLY N 8 39 VAL N 3.590 3.550 3.630 3.656 3.643 3.672 0.042 4 0 "[ . 1]" 1
392 9 12 VAL C 10 12 VAL C 4.650 4.500 4.800 5.038 4.870 5.464 0.664 10 1 "[ . +]" 1
393 9 14 HIS N 9 15 GLN N 3.220 3.180 3.260 3.610 3.595 3.622 0.362 10 0 "[ . 1]" 1
394 9 15 GLN N 9 16 LYS N 4.240 3.490 4.990 3.668 3.653 3.685 . 0 0 "[ . 1]" 1
395 9 17 LEU C 10 18 VAL N 4.000 3.900 4.100 4.149 4.030 4.222 0.122 8 0 "[ . 1]" 1
396 9 17 LEU H 10 16 LYS O 1.800 . 1.900 1.860 1.691 1.936 0.036 9 0 "[ . 1]" 1
397 9 17 LEU N 10 16 LYS C 4.000 3.900 4.100 4.050 3.874 4.133 0.033 9 0 "[ . 1]" 1
398 9 17 LEU O 10 18 VAL H 1.800 . 1.900 2.001 1.941 2.052 0.152 2 0 "[ . 1]" 1
399 9 19 PHE C 10 20 PHE N 4.000 3.900 4.100 4.011 3.905 4.080 . 0 0 "[ . 1]" 1
400 9 19 PHE CZ 11 32 ILE CD1 4.500 3.000 6.000 5.993 5.886 6.162 0.162 3 0 "[ . 1]" 1
401 9 19 PHE CZ 11 32 ILE CG1 4.500 3.000 6.000 6.418 6.143 6.594 0.594 3 2 "[ + . - 1]" 1
402 9 19 PHE CZ 11 32 ILE CG2 4.500 3.000 6.000 5.425 4.605 6.193 0.193 10 0 "[ . 1]" 1
403 9 19 PHE CZ 11 34 LEU CD1 4.500 3.000 6.000 3.826 3.005 5.627 . 0 0 "[ . 1]" 1
404 9 19 PHE CZ 11 34 LEU CD2 4.500 3.000 6.000 3.916 3.200 5.157 . 0 0 "[ . 1]" 1
405 9 19 PHE CZ 11 34 LEU CG 4.500 3.000 6.000 4.040 3.607 4.690 . 0 0 "[ . 1]" 1
406 9 19 PHE CZ 11 36 VAL CB 4.500 3.000 6.000 6.442 6.213 6.619 0.619 1 4 "[+ * . -*1]" 1
407 9 19 PHE CZ 11 36 VAL CG1 4.500 3.000 6.000 5.866 5.555 6.152 0.152 7 0 "[ . 1]" 1
408 9 19 PHE CZ 11 36 VAL CG2 4.500 3.000 6.000 5.561 5.049 6.067 0.067 1 0 "[ . 1]" 1
409 9 19 PHE H 10 18 VAL O 1.800 . 1.900 1.881 1.774 1.983 0.083 8 0 "[ . 1]" 1
410 9 19 PHE N 10 18 VAL C 4.000 3.900 4.100 4.050 3.959 4.171 0.071 8 0 "[ . 1]" 1
411 9 19 PHE O 10 20 PHE H 1.800 . 1.900 1.849 1.752 1.915 0.015 1 0 "[ . 1]" 1
412 9 21 ALA C 10 22 GLU N 4.000 3.900 4.100 4.198 4.056 4.290 0.190 5 0 "[ . 1]" 1
413 9 21 ALA H 10 20 PHE O 1.800 . 1.900 2.024 1.969 2.107 0.207 1 0 "[ . 1]" 1
414 9 21 ALA N 10 20 PHE C 4.000 3.900 4.100 4.156 4.120 4.223 0.123 1 0 "[ . 1]" 1
415 9 21 ALA O 10 22 GLU H 1.800 . 1.900 2.031 1.928 2.099 0.199 5 0 "[ . 1]" 1
416 9 23 ASP C 9 24 VAL C 2.450 . 2.900 3.215 2.871 3.565 0.665 7 2 "[ - + 1]" 1
417 9 23 ASP CG 11 28 LYS NZ 3.700 3.500 3.900 3.813 3.318 4.166 0.266 10 0 "[ . 1]" 1
418 9 23 ASP N 9 24 VAL N 3.310 3.180 3.440 3.414 3.286 3.496 0.056 3 0 "[ . 1]" 1
419 9 26 SER N 9 27 ASN N 3.090 3.000 3.180 3.609 3.580 3.640 0.460 6 0 "[ . 1]" 1
420 9 29 GLY C 9 30 ALA C 3.320 3.230 3.410 3.360 3.068 3.506 0.162 1 0 "[ . 1]" 1
421 9 29 GLY CA 9 31 ILE CD1 4.500 3.000 6.000 5.720 4.270 6.392 0.392 6 0 "[ . 1]" 1
422 9 29 GLY CA 9 31 ILE CG2 4.500 3.000 6.000 6.807 6.515 7.081 1.081 6 10 [*****+***-] 1
423 9 29 GLY N 9 30 ALA N 4.180 3.350 5.010 3.197 3.055 3.313 0.295 2 0 "[ . 1]" 1
424 9 30 ALA C 10 31 ILE N 4.000 3.900 4.100 4.254 4.148 4.369 0.269 1 0 "[ . 1]" 1
425 9 30 ALA CB 10 30 ALA CB 4.650 4.500 4.800 5.106 4.922 5.417 0.617 6 1 "[ .+ 1]" 1
426 9 30 ALA O 10 31 ILE H 1.800 . 1.900 2.158 2.011 2.282 0.382 4 0 "[ . 1]" 1
427 9 32 ILE C 10 33 GLY N 4.000 3.900 4.100 4.021 3.861 4.139 0.039 7 0 "[ . 1]" 1
428 9 32 ILE H 10 31 ILE O 1.800 . 1.900 2.167 2.048 2.288 0.388 1 0 "[ . 1]" 1
429 9 32 ILE N 10 31 ILE C 4.000 3.900 4.100 4.301 4.153 4.480 0.380 1 0 "[ . 1]" 1
430 9 32 ILE O 10 33 GLY H 1.800 . 1.900 1.862 1.709 1.982 0.082 8 0 "[ . 1]" 1
431 9 34 LEU C 10 35 MET N 4.000 3.900 4.100 4.201 4.111 4.365 0.265 6 0 "[ . 1]" 1
432 9 34 LEU H 10 33 GLY O 1.800 . 1.900 2.085 1.912 2.228 0.328 8 0 "[ . 1]" 1
433 9 34 LEU N 10 33 GLY C 4.000 3.900 4.100 4.201 4.111 4.290 0.190 2 0 "[ . 1]" 1
434 9 34 LEU O 10 35 MET H 1.800 . 1.900 2.060 1.920 2.249 0.349 6 0 "[ . 1]" 1
435 9 35 MET CE 9 37 GLY CA 4.500 3.000 6.000 5.899 5.479 6.202 0.202 9 0 "[ . 1]" 1
436 9 35 MET CE 10 35 MET CE 4.650 4.500 4.800 4.877 4.702 5.019 0.219 8 0 "[ . 1]" 1
437 9 36 VAL H 10 35 MET O 1.800 . 1.900 1.992 1.931 2.034 0.134 1 0 "[ . 1]" 1
438 9 36 VAL N 9 37 GLY N 3.350 3.270 3.430 3.069 3.018 3.116 0.252 9 0 "[ . 1]" 1
439 9 36 VAL N 10 35 MET C 4.000 3.900 4.100 4.170 4.000 4.250 0.150 7 0 "[ . 1]" 1
440 9 38 GLY N 9 39 VAL N 3.590 3.550 3.630 3.658 3.630 3.672 0.042 6 0 "[ . 1]" 1
441 10 12 VAL C 11 12 VAL C 4.650 4.500 4.800 5.121 4.869 5.351 0.551 7 2 "[ . + -]" 1
442 10 14 HIS N 10 15 GLN N 3.220 3.180 3.260 3.601 3.575 3.631 0.371 6 0 "[ . 1]" 1
443 10 15 GLN N 10 16 LYS N 4.240 3.490 4.990 3.663 3.637 3.695 . 0 0 "[ . 1]" 1
444 10 17 LEU C 11 18 VAL N 4.000 3.900 4.100 4.138 4.045 4.215 0.115 4 0 "[ . 1]" 1
445 10 17 LEU H 11 16 LYS O 1.800 . 1.900 1.894 1.684 1.995 0.095 7 0 "[ . 1]" 1
446 10 17 LEU N 11 16 LYS C 4.000 3.900 4.100 4.061 3.884 4.155 0.055 5 0 "[ . 1]" 1
447 10 17 LEU O 11 18 VAL H 1.800 . 1.900 1.977 1.916 2.047 0.147 4 0 "[ . 1]" 1
448 10 19 PHE C 11 20 PHE N 4.000 3.900 4.100 3.991 3.838 4.107 0.062 4 0 "[ . 1]" 1
449 10 19 PHE CZ 12 32 ILE CD1 4.500 3.000 6.000 5.709 4.902 6.071 0.071 6 0 "[ . 1]" 1
450 10 19 PHE CZ 12 32 ILE CG1 4.500 3.000 6.000 6.203 5.460 6.522 0.522 7 1 "[ . + 1]" 1
451 10 19 PHE CZ 12 32 ILE CG2 4.500 3.000 6.000 5.367 4.517 6.307 0.307 2 0 "[ . 1]" 1
452 10 19 PHE CZ 12 34 LEU CD1 4.500 3.000 6.000 4.037 3.358 5.408 . 0 0 "[ . 1]" 1
453 10 19 PHE CZ 12 34 LEU CD2 4.500 3.000 6.000 3.447 3.043 3.937 . 0 0 "[ . 1]" 1
454 10 19 PHE CZ 12 34 LEU CG 4.500 3.000 6.000 3.807 3.498 4.040 . 0 0 "[ . 1]" 1
455 10 19 PHE CZ 12 36 VAL CB 4.500 3.000 6.000 6.437 6.205 6.643 0.643 3 2 "[ +-. 1]" 1
456 10 19 PHE CZ 12 36 VAL CG1 4.500 3.000 6.000 5.734 5.330 6.247 0.247 2 0 "[ . 1]" 1
457 10 19 PHE CZ 12 36 VAL CG2 4.500 3.000 6.000 5.701 4.955 6.093 0.093 3 0 "[ . 1]" 1
458 10 19 PHE H 11 18 VAL O 1.800 . 1.900 1.892 1.735 2.085 0.185 4 0 "[ . 1]" 1
459 10 19 PHE N 11 18 VAL C 4.000 3.900 4.100 4.046 3.922 4.172 0.072 4 0 "[ . 1]" 1
460 10 19 PHE O 11 20 PHE H 1.800 . 1.900 1.828 1.668 1.950 0.050 1 0 "[ . 1]" 1
461 10 21 ALA C 11 22 GLU N 4.000 3.900 4.100 4.194 4.044 4.300 0.200 6 0 "[ . 1]" 1
462 10 21 ALA H 11 20 PHE O 1.800 . 1.900 2.016 1.966 2.119 0.219 9 0 "[ . 1]" 1
463 10 21 ALA N 11 20 PHE C 4.000 3.900 4.100 4.163 4.116 4.271 0.171 9 0 "[ . 1]" 1
464 10 21 ALA O 11 22 GLU H 1.800 . 1.900 2.049 1.926 2.131 0.231 1 0 "[ . 1]" 1
465 10 23 ASP C 10 24 VAL C 2.450 . 2.900 3.202 2.883 3.590 0.690 5 3 "[- + * 1]" 1
466 10 23 ASP CG 12 28 LYS NZ 3.700 3.500 3.900 4.012 3.398 4.365 0.465 8 0 "[ . 1]" 1
467 10 23 ASP N 10 24 VAL N 3.310 3.180 3.440 3.412 3.285 3.645 0.205 3 0 "[ . 1]" 1
468 10 26 SER N 10 27 ASN N 3.090 3.000 3.180 3.599 3.577 3.614 0.434 1 0 "[ . 1]" 1
469 10 29 GLY C 10 30 ALA C 3.320 3.230 3.410 3.397 2.930 3.569 0.300 8 0 "[ . 1]" 1
470 10 29 GLY CA 10 31 ILE CD1 4.500 3.000 6.000 5.749 4.703 6.495 0.495 4 0 "[ . 1]" 1
471 10 29 GLY CA 10 31 ILE CG2 4.500 3.000 6.000 6.664 6.376 6.906 0.906 4 9 "[ **+-*****]" 1
472 10 29 GLY N 10 30 ALA N 4.180 3.350 5.010 3.250 3.127 3.369 0.223 10 0 "[ . 1]" 1
473 10 30 ALA C 11 31 ILE N 4.000 3.900 4.100 4.214 4.003 4.342 0.242 5 0 "[ . 1]" 1
474 10 30 ALA CB 11 30 ALA CB 4.650 4.500 4.800 5.031 4.870 5.322 0.522 2 1 "[ + . 1]" 1
475 10 30 ALA O 11 31 ILE H 1.800 . 1.900 2.151 2.014 2.243 0.343 5 0 "[ . 1]" 1
476 10 32 ILE C 11 33 GLY N 4.000 3.900 4.100 3.936 3.825 4.098 0.075 1 0 "[ . 1]" 1
477 10 32 ILE H 11 31 ILE O 1.800 . 1.900 2.120 1.934 2.296 0.396 10 0 "[ . 1]" 1
478 10 32 ILE N 11 31 ILE C 4.000 3.900 4.100 4.255 4.091 4.440 0.340 10 0 "[ . 1]" 1
479 10 32 ILE O 11 33 GLY H 1.800 . 1.900 1.801 1.707 1.918 0.018 10 0 "[ . 1]" 1
480 10 34 LEU C 11 35 MET N 4.000 3.900 4.100 4.224 4.095 4.343 0.243 1 0 "[ . 1]" 1
481 10 34 LEU H 11 33 GLY O 1.800 . 1.900 2.008 1.869 2.132 0.232 7 0 "[ . 1]" 1
482 10 34 LEU N 11 33 GLY C 4.000 3.900 4.100 4.161 4.034 4.249 0.149 2 0 "[ . 1]" 1
483 10 34 LEU O 11 35 MET H 1.800 . 1.900 2.062 1.893 2.211 0.311 1 0 "[ . 1]" 1
484 10 35 MET CE 10 37 GLY CA 4.500 3.000 6.000 5.933 5.185 6.257 0.257 9 0 "[ . 1]" 1
485 10 35 MET CE 11 35 MET CE 4.650 4.500 4.800 4.899 4.693 5.029 0.229 2 0 "[ . 1]" 1
486 10 36 VAL H 11 35 MET O 1.800 . 1.900 1.940 1.682 2.043 0.143 1 0 "[ . 1]" 1
487 10 36 VAL N 10 37 GLY N 3.350 3.270 3.430 3.069 2.936 3.138 0.334 5 0 "[ . 1]" 1
488 10 36 VAL N 11 35 MET C 4.000 3.900 4.100 4.100 3.877 4.243 0.143 3 0 "[ . 1]" 1
489 10 38 GLY N 10 39 VAL N 3.590 3.550 3.630 3.644 3.585 3.677 0.047 3 0 "[ . 1]" 1
490 11 12 VAL C 12 12 VAL C 4.650 4.500 4.800 4.914 4.469 5.118 0.318 2 0 "[ . 1]" 1
491 11 14 HIS N 11 15 GLN N 3.220 3.180 3.260 3.607 3.585 3.622 0.362 10 0 "[ . 1]" 1
492 11 15 GLN N 11 16 LYS N 4.240 3.490 4.990 3.663 3.643 3.684 . 0 0 "[ . 1]" 1
493 11 17 LEU C 12 18 VAL N 4.000 3.900 4.100 4.077 3.865 4.188 0.088 8 0 "[ . 1]" 1
494 11 17 LEU H 12 16 LYS O 1.800 . 1.900 2.077 1.880 3.293 1.393 4 1 "[ +. 1]" 1
495 11 17 LEU N 12 16 LYS C 4.000 3.900 4.100 4.032 3.412 4.158 0.488 4 0 "[ . 1]" 1
496 11 17 LEU O 12 18 VAL H 1.800 . 1.900 2.084 1.878 3.225 1.325 4 1 "[ +. 1]" 1
497 11 19 PHE C 12 20 PHE N 4.000 3.900 4.100 3.882 3.529 4.084 0.371 9 0 "[ . 1]" 1
498 11 19 PHE H 12 18 VAL O 1.800 . 1.900 2.001 1.872 2.275 0.375 4 0 "[ . 1]" 1
499 11 19 PHE N 12 18 VAL C 4.000 3.900 4.100 4.037 3.918 4.101 0.001 8 0 "[ . 1]" 1
500 11 19 PHE O 12 20 PHE H 1.800 . 1.900 1.925 1.678 3.088 1.188 9 1 "[ . +1]" 1
501 11 21 ALA C 12 22 GLU N 4.000 3.900 4.100 4.124 4.018 4.199 0.099 6 0 "[ . 1]" 1
502 11 21 ALA H 12 20 PHE O 1.800 . 1.900 2.133 1.957 2.920 1.020 9 1 "[ . +1]" 1
503 11 21 ALA N 12 20 PHE C 4.000 3.900 4.100 4.059 3.572 4.215 0.328 9 0 "[ . 1]" 1
504 11 21 ALA O 12 22 GLU H 1.800 . 1.900 2.077 2.021 2.165 0.265 9 0 "[ . 1]" 1
505 11 23 ASP C 11 24 VAL C 2.450 . 2.900 3.243 2.872 3.597 0.697 10 3 "[ - . * +]" 1
506 11 23 ASP N 11 24 VAL N 3.310 3.180 3.440 3.464 3.377 3.547 0.107 9 0 "[ . 1]" 1
507 11 26 SER N 11 27 ASN N 3.090 3.000 3.180 3.595 3.573 3.619 0.439 6 0 "[ . 1]" 1
508 11 29 GLY C 11 30 ALA C 3.320 3.230 3.410 3.268 2.897 3.611 0.333 10 0 "[ . 1]" 1
509 11 29 GLY CA 11 31 ILE CD1 4.500 3.000 6.000 6.019 5.195 6.447 0.447 5 0 "[ . 1]" 1
510 11 29 GLY CA 11 31 ILE CG2 4.500 3.000 6.000 6.437 6.228 6.724 0.724 6 3 "[* .+ -]" 1
511 11 29 GLY N 11 30 ALA N 4.180 3.350 5.010 3.254 3.215 3.295 0.135 3 0 "[ . 1]" 1
512 11 30 ALA C 12 31 ILE N 4.000 3.900 4.100 4.222 3.920 4.402 0.302 7 0 "[ . 1]" 1
513 11 30 ALA CB 12 30 ALA CB 4.650 4.500 4.800 4.631 4.232 5.142 0.342 10 0 "[ . 1]" 1
514 11 30 ALA O 12 31 ILE H 1.800 . 1.900 2.268 2.114 2.634 0.734 8 1 "[ . + 1]" 1
515 11 32 ILE C 12 33 GLY N 4.000 3.900 4.100 3.891 3.780 4.050 0.120 6 0 "[ . 1]" 1
516 11 32 ILE H 12 31 ILE O 1.800 . 1.900 2.088 1.926 2.201 0.301 2 0 "[ . 1]" 1
517 11 32 ILE N 12 31 ILE C 4.000 3.900 4.100 4.202 4.117 4.305 0.205 9 0 "[ . 1]" 1
518 11 32 ILE O 12 33 GLY H 1.800 . 1.900 1.772 1.667 1.925 0.033 7 0 "[ . 1]" 1
519 11 34 LEU C 12 35 MET N 4.000 3.900 4.100 4.199 4.029 4.342 0.242 5 0 "[ . 1]" 1
520 11 34 LEU H 12 33 GLY O 1.800 . 1.900 1.914 1.646 2.055 0.155 2 0 "[ . 1]" 1
521 11 34 LEU N 12 33 GLY C 4.000 3.900 4.100 4.052 3.806 4.261 0.161 2 0 "[ . 1]" 1
522 11 34 LEU O 12 35 MET H 1.800 . 1.900 2.062 1.875 2.244 0.344 5 0 "[ . 1]" 1
523 11 35 MET CE 11 37 GLY CA 4.500 3.000 6.000 6.033 5.207 6.206 0.206 10 0 "[ . 1]" 1
524 11 35 MET CE 12 35 MET CE 4.650 4.500 4.800 4.949 4.826 5.070 0.270 10 0 "[ . 1]" 1
525 11 36 VAL H 12 35 MET O 1.800 . 1.900 1.978 1.734 2.076 0.176 1 0 "[ . 1]" 1
526 11 36 VAL N 11 37 GLY N 3.350 3.270 3.430 3.054 2.967 3.119 0.303 6 0 "[ . 1]" 1
527 11 36 VAL N 12 35 MET C 4.000 3.900 4.100 4.134 3.926 4.225 0.125 10 0 "[ . 1]" 1
528 11 38 GLY N 11 39 VAL N 3.590 3.550 3.630 3.632 3.584 3.667 0.037 10 0 "[ . 1]" 1
529 12 14 HIS N 12 15 GLN N 3.220 3.180 3.260 3.616 3.609 3.627 0.367 9 0 "[ . 1]" 1
530 12 15 GLN N 12 16 LYS N 4.240 3.490 4.990 3.673 3.656 3.686 . 0 0 "[ . 1]" 1
531 12 23 ASP C 12 24 VAL C 2.450 . 2.900 3.276 2.980 3.503 0.603 9 2 "[ . - +1]" 1
532 12 23 ASP N 12 24 VAL N 3.310 3.180 3.440 3.441 3.370 3.544 0.104 3 0 "[ . 1]" 1
533 12 26 SER N 12 27 ASN N 3.090 3.000 3.180 3.594 3.573 3.613 0.433 5 0 "[ . 1]" 1
534 12 29 GLY C 12 30 ALA C 3.320 3.230 3.410 2.965 2.829 3.543 0.401 5 0 "[ . 1]" 1
535 12 29 GLY CA 12 31 ILE CD1 4.500 3.000 6.000 6.155 5.285 6.643 0.643 1 1 "[+ . 1]" 1
536 12 29 GLY CA 12 31 ILE CG2 4.500 3.000 6.000 6.472 6.096 6.900 0.900 4 4 "[ - +. ** 1]" 1
537 12 29 GLY N 12 30 ALA N 4.180 3.350 5.010 3.255 3.169 3.327 0.181 6 0 "[ . 1]" 1
538 12 35 MET CE 12 37 GLY CA 4.500 3.000 6.000 5.965 4.941 6.180 0.180 6 0 "[ . 1]" 1
539 12 36 VAL N 12 37 GLY N 3.350 3.270 3.430 3.087 3.034 3.124 0.236 9 0 "[ . 1]" 1
540 12 38 GLY N 12 39 VAL N 3.590 3.550 3.630 3.653 3.578 3.678 0.048 1 0 "[ . 1]" 1
stop_
save_
Contact the webmaster for help, if required. Saturday, May 18, 2024 11:14:41 PM GMT (wattos1)