NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
412407 |
2b87   |
6806 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2b87
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 882
_Distance_constraint_stats_list.Viol_count 1839
_Distance_constraint_stats_list.Viol_total 9166.361
_Distance_constraint_stats_list.Viol_max 0.414
_Distance_constraint_stats_list.Viol_rms 0.0325
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0065
_Distance_constraint_stats_list.Viol_average_violations_only 0.1246
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 3 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 4 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 5 PHE 3.857 0.121 7 0 "[ . 1 . 2 . 3 . 4]"
1 6 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 7 LYS 7.253 0.211 7 0 "[ . 1 . 2 . 3 . 4]"
1 8 GLU 17.486 0.211 7 0 "[ . 1 . 2 . 3 . 4]"
1 9 LEU 7.378 0.196 31 0 "[ . 1 . 2 . 3 . 4]"
1 10 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 11 TRP 21.743 0.414 32 0 "[ . 1 . 2 . 3 . 4]"
1 12 ALA 18.888 0.414 32 0 "[ . 1 . 2 . 3 . 4]"
1 13 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 14 TRP 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 15 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 16 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 17 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 18 ASN 0.046 0.030 26 0 "[ . 1 . 2 . 3 . 4]"
1 19 LEU 5.869 0.178 2 0 "[ . 1 . 2 . 3 . 4]"
1 20 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 21 ASN 7.972 0.178 2 0 "[ . 1 . 2 . 3 . 4]"
1 22 LEU 0.809 0.044 1 0 "[ . 1 . 2 . 3 . 4]"
1 23 ASN 6.871 0.205 14 0 "[ . 1 . 2 . 3 . 4]"
1 24 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 25 VAL 3.557 0.119 26 0 "[ . 1 . 2 . 3 . 4]"
1 26 GLN 8.874 0.205 14 0 "[ . 1 . 2 . 3 . 4]"
1 27 VAL 3.529 0.119 26 0 "[ . 1 . 2 . 3 . 4]"
1 28 LYS 5.105 0.204 30 0 "[ . 1 . 2 . 3 . 4]"
1 29 ALA 14.510 0.227 11 0 "[ . 1 . 2 . 3 . 4]"
1 30 PHE 18.239 0.227 11 0 "[ . 1 . 2 . 3 . 4]"
1 31 ILE 5.105 0.204 30 0 "[ . 1 . 2 . 3 . 4]"
1 32 ASP 7.363 0.200 18 0 "[ . 1 . 2 . 3 . 4]"
1 33 SER 8.148 0.200 18 0 "[ . 1 . 2 . 3 . 4]"
1 34 LEU 7.656 0.223 24 0 "[ . 1 . 2 . 3 . 4]"
1 35 ARG 3.011 0.255 17 0 "[ . 1 . 2 . 3 . 4]"
1 36 ASP 18.918 0.293 14 0 "[ . 1 . 2 . 3 . 4]"
1 37 ASP 5.809 0.159 9 0 "[ . 1 . 2 . 3 . 4]"
1 38 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 39 SER 5.707 0.185 37 0 "[ . 1 . 2 . 3 . 4]"
1 40 GLN 5.770 0.185 37 0 "[ . 1 . 2 . 3 . 4]"
1 41 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 42 ALA 5.244 0.159 31 0 "[ . 1 . 2 . 3 . 4]"
1 43 ASN 9.547 0.159 31 0 "[ . 1 . 2 . 3 . 4]"
1 44 LEU 0.144 0.034 37 0 "[ . 1 . 2 . 3 . 4]"
1 45 LEU 1.413 0.057 14 0 "[ . 1 . 2 . 3 . 4]"
1 46 ALA 12.100 0.194 24 0 "[ . 1 . 2 . 3 . 4]"
1 47 GLU 18.614 0.194 24 0 "[ . 1 . 2 . 3 . 4]"
1 48 ALA 9.807 0.146 26 0 "[ . 1 . 2 . 3 . 4]"
1 49 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 50 LYS 23.155 0.307 16 0 "[ . 1 . 2 . 3 . 4]"
1 51 LEU 21.565 0.199 35 0 "[ . 1 . 2 . 3 . 4]"
1 52 ASN 12.526 0.210 5 0 "[ . 1 . 2 . 3 . 4]"
1 53 ASP 23.398 0.307 16 0 "[ . 1 . 2 . 3 . 4]"
1 54 ALA 4.700 0.133 18 0 "[ . 1 . 2 . 3 . 4]"
1 55 GLN 4.546 0.107 21 0 "[ . 1 . 2 . 3 . 4]"
1 56 ALA 2.107 0.161 16 0 "[ . 1 . 2 . 3 . 4]"
1 57 PRO 1.835 0.254 5 0 "[ . 1 . 2 . 3 . 4]"
1 58 LYS 13.508 0.296 1 0 "[ . 1 . 2 . 3 . 4]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 3 ASN HA 1 4 LYS H 5.000 . 5.000 2.941 2.195 3.548 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2 1 3 ASN HA 1 6 ASN QB 5.000 . 5.000 3.237 2.415 4.146 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
3 1 3 ASN HA 1 6 ASN H 5.000 . 5.000 3.370 3.013 4.134 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
4 1 3 ASN QB 1 4 LYS H 5.000 . 5.000 3.690 2.675 3.989 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
5 1 4 LYS HA 1 4 LYS QB 2.700 . 2.700 2.354 2.173 2.418 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
6 1 4 LYS HA 1 4 LYS QD 5.000 . 5.000 3.575 2.076 4.425 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
7 1 4 LYS HA 1 4 LYS QE 5.000 . 5.000 4.282 2.656 4.547 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
8 1 4 LYS HA 1 5 PHE H 5.000 . 5.000 3.561 3.531 3.588 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
9 1 4 LYS HA 1 6 ASN H 5.000 . 5.000 4.392 4.225 4.723 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
10 1 4 LYS HA 1 7 LYS H 5.000 . 5.000 3.415 3.248 3.666 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
11 1 4 LYS QB 1 4 LYS QD 2.700 . 2.700 2.174 2.021 2.233 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
12 1 4 LYS QB 1 5 PHE H 5.000 . 5.000 2.613 2.420 3.384 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
13 1 4 LYS H 1 4 LYS QD 5.000 . 5.000 4.252 3.452 4.583 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
14 1 4 LYS H 1 4 LYS QG 5.000 . 5.000 3.685 1.846 4.063 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
15 1 4 LYS QG 1 5 PHE HA 5.000 . 5.000 3.735 3.159 4.058 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
16 1 4 LYS QG 1 5 PHE H 5.000 . 5.000 3.411 1.747 3.852 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
17 1 4 LYS H 1 5 PHE H 5.000 . 5.000 2.784 2.630 2.962 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
18 1 5 PHE H 1 5 PHE HA 2.700 . 2.700 2.796 2.775 2.821 0.121 7 0 "[ . 1 . 2 . 3 . 4]" 1
19 1 5 PHE HA 1 8 GLU QB 5.000 . 5.000 2.360 2.246 2.439 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
20 1 5 PHE HA 1 8 GLU QG 5.000 . 5.000 3.976 3.212 4.480 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
21 1 5 PHE HA 1 8 GLU H 5.000 . 5.000 3.379 3.287 3.589 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
22 1 5 PHE H 1 5 PHE QB 2.700 . 2.700 2.260 2.008 2.363 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
23 1 5 PHE QB 1 6 ASN H 5.000 . 5.000 3.333 2.340 3.498 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
24 1 5 PHE QB 1 8 GLU QB 5.000 . 5.000 3.998 3.828 4.347 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
25 1 5 PHE H 1 5 PHE QD 5.000 . 5.000 2.288 1.948 3.572 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
26 1 5 PHE QD 1 6 ASN HA 5.000 . 5.000 3.758 3.549 4.507 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
27 1 5 PHE QD 1 6 ASN H 5.000 . 5.000 2.866 2.585 4.347 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
28 1 5 PHE QD 1 38 PRO QB 5.000 . 5.000 1.995 1.901 2.129 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
29 1 5 PHE QD 1 38 PRO QG 5.000 . 5.000 3.089 2.743 3.381 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
30 1 5 PHE QD 1 39 SER HA 5.000 . 5.000 4.495 4.458 4.537 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
31 1 5 PHE QD 1 39 SER H 5.000 . 5.000 4.534 4.490 4.598 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
32 1 5 PHE QD 1 9 LEU MD2 5.000 . 5.000 3.768 3.720 3.898 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
33 1 5 PHE H 1 8 GLU QB 5.000 . 5.000 4.561 4.335 4.644 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
34 1 6 ASN HA 1 7 LYS H 5.000 . 5.000 3.532 3.510 3.555 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
35 1 6 ASN HA 1 9 LEU QB 3.300 . 3.300 2.140 2.057 2.271 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
36 1 6 ASN HA 1 9 LEU QD 5.000 . 5.000 2.901 2.797 3.038 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
37 1 6 ASN HA 1 9 LEU MD2 5.000 . 5.000 2.931 2.823 3.070 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
38 1 6 ASN HA 1 9 LEU HG 5.000 . 5.000 4.564 4.406 4.676 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
39 1 6 ASN HA 1 9 LEU H 5.000 . 5.000 3.256 3.161 3.403 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
40 1 6 ASN HA 1 10 GLY H 5.000 . 5.000 3.888 3.743 4.027 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
41 1 6 ASN QB 1 7 LYS HA 5.000 . 5.000 4.007 3.924 4.244 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
42 1 6 ASN QB 1 7 LYS H 5.000 . 5.000 2.381 2.316 2.499 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
43 1 6 ASN QB 1 8 GLU H 5.000 . 5.000 4.517 4.481 4.547 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
44 1 6 ASN QB 1 9 LEU QB 5.000 . 5.000 4.057 3.972 4.180 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
45 1 6 ASN H 1 6 ASN QD 5.000 . 5.000 4.557 4.227 4.619 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
46 1 6 ASN H 1 7 LYS QB 5.000 . 5.000 4.278 4.138 4.417 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
47 1 6 ASN H 1 9 LEU QB 5.000 . 5.000 4.296 4.243 4.360 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
48 1 7 LYS HA 1 7 LYS QD 5.000 . 5.000 3.710 2.113 4.118 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
49 1 7 LYS HA 1 8 GLU H 5.000 . 5.000 3.522 3.507 3.538 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
50 1 7 LYS HA 1 10 GLY H 5.000 . 5.000 3.571 3.415 3.831 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
51 1 7 LYS HA 1 11 TRP H 5.000 . 5.000 3.980 3.763 4.304 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
52 1 7 LYS QB 1 7 LYS QD 3.300 . 3.300 2.180 2.026 2.478 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
53 1 7 LYS H 1 7 LYS QB 3.300 . 3.300 2.194 2.131 2.244 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
54 1 7 LYS QB 1 8 GLU H 5.000 . 5.000 2.498 2.379 2.613 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
55 1 7 LYS H 1 7 LYS QD 5.000 . 5.000 4.337 3.694 4.471 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
56 1 7 LYS H 1 7 LYS QG 5.000 . 5.000 3.924 3.853 4.037 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
57 1 7 LYS QG 1 8 GLU HA 5.000 . 5.000 4.024 3.525 4.309 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
58 1 7 LYS H 1 8 GLU HA 5.000 . 5.000 5.181 5.157 5.211 0.211 7 0 "[ . 1 . 2 . 3 . 4]" 1
59 1 7 LYS H 1 8 GLU QB 5.000 . 5.000 4.409 4.250 4.519 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
60 1 8 GLU HA 1 8 GLU QG 3.300 . 3.300 2.517 2.105 3.006 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
61 1 8 GLU HA 1 9 LEU H 3.300 . 3.300 3.484 3.472 3.496 0.196 31 0 "[ . 1 . 2 . 3 . 4]" 1
62 1 8 GLU HA 1 11 TRP QB 5.000 . 5.000 2.443 2.292 2.529 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
63 1 8 GLU HA 1 11 TRP HE3 6.000 . 6.000 6.068 5.921 6.171 0.171 14 0 "[ . 1 . 2 . 3 . 4]" 1
64 1 8 GLU HA 1 11 TRP H 5.000 . 5.000 2.972 2.857 3.208 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
65 1 8 GLU H 1 8 GLU QB 3.300 . 3.300 2.272 2.128 2.333 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
66 1 8 GLU QB 1 11 TRP QB 5.000 . 5.000 4.117 3.988 4.215 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
67 1 8 GLU QB 1 9 LEU H 5.000 . 5.000 2.647 2.445 2.798 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
68 1 8 GLU H 1 8 GLU QG 5.000 . 5.000 3.168 2.353 4.052 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
69 1 8 GLU H 1 9 LEU H 2.700 . 2.700 2.511 2.474 2.605 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
70 1 9 LEU HA 1 10 GLY H 5.000 . 5.000 3.523 3.503 3.556 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
71 1 9 LEU HA 1 12 ALA MB 5.000 . 5.000 3.224 3.051 3.515 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
72 1 9 LEU HA 1 12 ALA H 5.000 . 5.000 3.940 3.703 4.082 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
73 1 9 LEU HA 1 34 LEU MD2 5.000 . 5.000 2.112 1.977 2.330 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
74 1 9 LEU HA 1 41 SER QB 5.000 . 5.000 2.166 2.018 2.326 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
75 1 9 LEU QB 1 10 GLY QA 5.000 . 5.000 3.852 3.808 3.929 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
76 1 9 LEU QB 1 10 GLY H 5.000 . 5.000 2.584 2.536 2.665 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
77 1 9 LEU QD 1 10 GLY H 5.000 . 5.000 3.759 3.719 3.862 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
78 1 9 LEU QD 1 34 LEU HA 5.000 . 5.000 2.931 2.857 3.020 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
79 1 9 LEU QD 1 34 LEU HB2 5.000 . 5.000 3.366 3.337 3.392 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
80 1 9 LEU QD 1 35 ARG HA 5.000 . 5.000 2.849 2.629 3.014 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
81 1 9 LEU QD 1 38 PRO QB 5.000 . 5.000 1.725 1.706 1.744 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
82 1 9 LEU QD 1 38 PRO QG 5.000 . 5.000 2.528 2.338 2.671 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
83 1 9 LEU QD 1 39 SER H 6.000 . 6.000 4.502 4.466 4.564 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
84 1 9 LEU QD 1 41 SER HA 5.000 . 5.000 3.812 3.761 3.870 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
85 1 9 LEU QD 1 41 SER H 5.000 . 5.000 3.899 3.855 3.952 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
86 1 9 LEU MD1 1 34 LEU MD2 5.000 . 5.000 1.641 1.602 1.685 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
87 1 9 LEU MD1 1 38 PRO HA 5.000 . 5.000 1.874 1.821 1.955 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
88 1 9 LEU MD1 1 38 PRO QB 5.000 . 5.000 1.837 1.801 1.876 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
89 1 9 LEU MD1 1 38 PRO QG 5.000 . 5.000 2.815 2.685 2.924 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
90 1 9 LEU MD2 1 34 LEU MD2 5.000 . 5.000 3.643 3.605 3.692 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
91 1 9 LEU H 1 9 LEU HG 5.000 . 5.000 4.350 4.323 4.376 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
92 1 9 LEU HG 1 10 GLY H 5.000 . 5.000 3.602 3.539 3.666 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
93 1 9 LEU H 1 10 GLY H 3.300 . 3.300 2.580 2.541 2.671 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
94 1 9 LEU H 1 11 TRP H 5.000 . 5.000 3.850 3.782 3.920 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
95 1 10 GLY QA 1 11 TRP H 5.000 . 5.000 2.705 2.655 2.758 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
96 1 10 GLY QA 1 12 ALA H 5.000 . 5.000 4.430 4.257 4.498 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
97 1 10 GLY QA 1 13 THR MG 5.000 . 5.000 3.436 3.095 3.593 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
98 1 10 GLY QA 1 13 THR H 5.000 . 5.000 3.633 3.399 3.748 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
99 1 10 GLY H 1 11 TRP H 3.300 . 3.300 2.440 2.331 2.470 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
100 1 10 GLY H 1 12 ALA H 5.000 . 5.000 4.295 4.134 4.423 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
101 1 11 TRP HA 1 11 TRP HE3 5.000 . 5.000 1.696 1.680 1.728 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
102 1 11 TRP HA 1 14 TRP QB 3.300 . 3.300 2.575 2.395 2.720 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
103 1 11 TRP HA 1 14 TRP H 5.000 . 5.000 3.075 2.922 3.190 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
104 1 11 TRP HA 1 15 GLU QG 5.000 . 5.000 3.786 3.510 3.906 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
105 1 11 TRP H 1 11 TRP QB 3.300 . 3.300 2.219 2.102 2.266 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
106 1 11 TRP QB 1 12 ALA MB 5.000 . 5.000 3.815 3.753 3.857 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
107 1 11 TRP QB 1 12 ALA H 5.000 . 5.000 2.531 2.480 2.578 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
108 1 11 TRP HD1 1 12 ALA HA 5.000 . 5.000 5.274 5.206 5.414 0.414 32 0 "[ . 1 . 2 . 3 . 4]" 1
109 1 11 TRP HD1 1 15 GLU QG 5.000 . 5.000 3.900 3.554 4.201 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
110 1 11 TRP HE1 1 15 GLU QG 5.000 . 5.000 3.854 3.679 4.102 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
111 1 11 TRP H 1 11 TRP HE3 5.000 . 5.000 3.865 3.635 3.949 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
112 1 11 TRP HE3 1 12 ALA HA 6.000 . 6.000 6.198 6.153 6.240 0.240 17 0 "[ . 1 . 2 . 3 . 4]" 1
113 1 11 TRP HE3 1 15 GLU QG 5.000 . 5.000 4.532 4.391 4.583 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
114 1 11 TRP HZ2 1 15 GLU QG 5.000 . 5.000 4.547 4.486 4.742 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
115 1 11 TRP H 1 12 ALA H 3.300 . 3.300 2.777 2.739 2.825 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
116 1 11 TRP H 1 13 THR H 5.000 . 5.000 3.949 3.841 4.012 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
117 1 12 ALA HA 1 13 THR H 5.000 . 5.000 3.532 3.518 3.553 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
118 1 12 ALA HA 1 14 TRP H 5.000 . 5.000 4.361 4.283 4.429 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
119 1 12 ALA HA 1 15 GLU QB 5.000 . 5.000 2.396 2.213 2.554 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
120 1 12 ALA HA 1 15 GLU QG 5.000 . 5.000 3.460 3.252 3.809 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
121 1 12 ALA HA 1 15 GLU H 5.000 . 5.000 3.281 3.127 3.434 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
122 1 12 ALA HA 1 16 ILE MD 5.000 . 5.000 4.079 3.761 4.183 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
123 1 12 ALA HA 1 16 ILE H 5.000 . 5.000 3.878 3.779 4.056 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
124 1 12 ALA HA 1 45 LEU QB 5.000 . 5.000 2.753 2.437 2.891 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
125 1 12 ALA HA 1 45 LEU MD2 5.000 . 5.000 2.160 2.082 2.254 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
126 1 12 ALA H 1 12 ALA MB 3.300 . 3.300 2.080 2.007 2.187 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
127 1 12 ALA MB 1 13 THR HA 5.000 . 5.000 3.915 3.863 3.962 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
128 1 12 ALA MB 1 13 THR H 5.000 . 5.000 2.715 2.601 2.797 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
129 1 12 ALA MB 1 16 ILE MD 5.000 . 5.000 2.633 2.417 2.832 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
130 1 12 ALA MB 1 34 LEU MD2 5.000 . 5.000 2.281 2.106 2.471 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
131 1 12 ALA MB 1 41 SER HA 5.000 . 5.000 3.305 3.061 3.469 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
132 1 12 ALA MB 1 41 SER QB 5.000 . 5.000 2.114 1.876 3.154 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
133 1 12 ALA MB 1 45 LEU QB 5.000 . 5.000 1.970 1.824 2.043 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
134 1 12 ALA MB 1 45 LEU MD2 5.000 . 5.000 2.505 2.288 2.713 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
135 1 12 ALA H 1 13 THR H 3.300 . 3.300 2.647 2.583 2.675 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
136 1 12 ALA H 1 34 LEU MD2 5.000 . 5.000 3.773 3.519 3.894 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
137 1 12 ALA H 1 45 LEU MD2 5.000 . 5.000 4.224 4.196 4.273 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
138 1 13 THR HA 1 14 TRP H 5.000 . 5.000 3.538 3.521 3.551 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
139 1 13 THR HA 1 16 ILE HB 5.000 . 5.000 2.890 2.811 3.021 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
140 1 13 THR HA 1 16 ILE MD 5.000 . 5.000 2.773 2.586 3.006 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
141 1 13 THR HA 1 16 ILE H 5.000 . 5.000 3.772 3.701 3.897 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
142 1 13 THR HA 1 17 PHE H 5.000 . 5.000 4.134 4.036 4.183 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
143 1 13 THR HA 1 34 LEU MD1 5.000 . 5.000 2.310 2.158 2.412 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
144 1 13 THR HB 1 14 TRP H 5.000 . 5.000 2.531 2.459 2.741 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
145 1 13 THR MG 1 14 TRP HA 5.000 . 5.000 3.118 2.826 3.256 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
146 1 13 THR MG 1 14 TRP H 5.000 . 5.000 2.873 2.498 3.024 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
147 1 13 THR MG 1 16 ILE H 6.000 . 6.000 4.835 4.778 4.900 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
148 1 13 THR MG 1 17 PHE QD 5.000 . 5.000 3.145 3.002 3.249 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
149 1 13 THR MG 1 17 PHE H 5.000 . 5.000 4.156 4.056 4.194 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
150 1 13 THR H 1 14 TRP H 3.300 . 3.300 2.719 2.679 2.760 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
151 1 14 TRP HA 1 14 TRP HE3 3.300 . 3.300 2.774 2.587 2.866 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
152 1 14 TRP HA 1 14 TRP HZ3 5.000 . 5.000 4.909 4.749 4.991 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
153 1 14 TRP HA 1 15 GLU H 5.000 . 5.000 3.548 3.533 3.566 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
154 1 14 TRP HA 1 16 ILE H 5.000 . 5.000 4.359 4.273 4.564 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
155 1 14 TRP HA 1 17 PHE QB 5.000 . 5.000 2.113 1.994 2.420 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
156 1 14 TRP HA 1 17 PHE QD 5.000 . 5.000 3.954 3.852 4.150 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
157 1 14 TRP HA 1 17 PHE H 5.000 . 5.000 3.260 3.141 3.599 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
158 1 14 TRP QB 1 15 GLU H 5.000 . 5.000 2.306 2.247 2.366 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
159 1 14 TRP HD1 1 15 GLU HA 5.000 . 5.000 3.595 3.299 3.973 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
160 1 14 TRP HD1 1 15 GLU H 5.000 . 5.000 3.939 3.727 4.167 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
161 1 14 TRP HE3 1 17 PHE QB 5.000 . 5.000 3.787 3.605 4.183 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
162 1 15 GLU HA 1 16 ILE H 5.000 . 5.000 3.527 3.509 3.557 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
163 1 15 GLU HA 1 17 PHE H 5.000 . 5.000 4.259 4.199 4.404 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
164 1 15 GLU HA 1 18 ASN HB3 5.000 . 5.000 4.234 3.631 4.683 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
165 1 15 GLU HA 1 18 ASN HB2 3.300 . 3.300 2.595 2.310 2.986 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
166 1 15 GLU HA 1 18 ASN QD 5.000 . 5.000 3.932 3.175 4.505 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
167 1 15 GLU HA 1 18 ASN H 5.000 . 5.000 3.283 3.188 3.480 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
168 1 15 GLU HA 1 19 LEU H 5.000 . 5.000 4.832 4.663 4.980 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
169 1 15 GLU H 1 15 GLU QB 3.300 . 3.300 2.380 2.366 2.390 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
170 1 15 GLU QB 1 45 LEU MD1 5.000 . 5.000 1.852 1.796 1.894 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
171 1 15 GLU H 1 15 GLU QG 3.300 . 3.300 2.096 2.060 2.225 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
172 1 15 GLU QG 1 16 ILE H 5.000 . 5.000 4.098 4.072 4.164 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
173 1 15 GLU QG 1 45 LEU MD1 5.000 . 5.000 3.627 3.245 3.712 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
174 1 15 GLU H 1 16 ILE H 3.300 . 3.300 2.655 2.603 2.714 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
175 1 16 ILE HA 1 17 PHE H 5.000 . 5.000 3.503 3.491 3.514 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
176 1 16 ILE HA 1 18 ASN H 5.000 . 5.000 4.257 4.122 4.395 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
177 1 16 ILE HA 1 19 LEU MD1 5.000 . 5.000 2.325 2.119 2.543 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
178 1 16 ILE HA 1 19 LEU MD2 5.000 . 5.000 4.361 4.325 4.393 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
179 1 16 ILE HA 1 19 LEU HG 5.000 . 5.000 2.859 2.794 2.946 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
180 1 16 ILE HA 1 19 LEU H 5.000 . 5.000 3.554 3.470 3.701 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
181 1 16 ILE HA 1 45 LEU MD1 5.000 . 5.000 3.269 3.135 3.480 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
182 1 16 ILE HA 1 48 ALA MB 5.000 . 5.000 2.620 2.469 2.727 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
183 1 16 ILE H 1 16 ILE HB 3.300 . 3.300 2.417 2.371 2.463 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
184 1 16 ILE HB 1 17 PHE H 5.000 . 5.000 2.608 2.462 2.671 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
185 1 16 ILE H 1 16 ILE MD 5.000 . 5.000 3.473 3.420 3.613 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
186 1 16 ILE MD 1 30 PHE HA 5.000 . 5.000 3.735 3.689 3.781 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
187 1 16 ILE MD 1 30 PHE QB 5.000 . 5.000 1.733 1.717 1.747 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
188 1 16 ILE MD 1 30 PHE QD 5.000 . 5.000 3.369 3.165 3.428 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
189 1 16 ILE MD 1 30 PHE H 5.000 . 5.000 4.461 4.434 4.485 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
190 1 16 ILE MD 1 31 ILE H 5.000 . 5.000 3.987 3.911 4.101 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
191 1 16 ILE MD 1 34 LEU MD1 5.000 . 5.000 1.876 1.826 1.971 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
192 1 16 ILE MD 1 34 LEU MD2 5.000 . 5.000 3.411 3.336 3.475 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
193 1 16 ILE MD 1 34 LEU HG 5.000 . 5.000 3.690 3.505 3.787 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
194 1 16 ILE MD 1 44 LEU HA 5.000 . 5.000 3.845 3.780 3.912 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
195 1 16 ILE MD 1 44 LEU QB 5.000 . 5.000 2.423 2.291 2.529 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
196 1 16 ILE MD 1 44 LEU H 5.000 . 5.000 4.347 4.299 4.378 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
197 1 16 ILE MD 1 45 LEU HA 5.000 . 5.000 2.413 2.282 2.549 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
198 1 16 ILE MD 1 45 LEU QB 5.000 . 5.000 2.978 2.851 3.091 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
199 1 16 ILE MD 1 45 LEU MD1 5.000 . 5.000 3.411 3.322 3.480 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
200 1 16 ILE MD 1 45 LEU H 5.000 . 5.000 3.121 3.054 3.175 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
201 1 16 ILE H 1 16 ILE QG 3.300 . 3.300 2.252 2.190 2.321 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
202 1 16 ILE QG 1 17 PHE H 5.000 . 5.000 3.996 3.940 4.051 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
203 1 16 ILE QG 1 19 LEU MD1 5.000 . 5.000 3.224 3.105 3.353 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
204 1 16 ILE QG 1 45 LEU HA 5.000 . 5.000 1.920 1.865 2.001 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
205 1 16 ILE QG 1 45 LEU MD1 5.000 . 5.000 2.101 2.007 2.216 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
206 1 16 ILE QG 1 48 ALA MB 5.000 . 5.000 1.782 1.755 1.812 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
207 1 16 ILE MG 1 17 PHE HA 5.000 . 5.000 3.743 3.600 3.889 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
208 1 16 ILE MG 1 17 PHE H 5.000 . 5.000 3.526 3.411 3.616 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
209 1 16 ILE MG 1 27 VAL HA 5.000 . 5.000 2.140 2.027 2.253 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
210 1 16 ILE MG 1 27 VAL MG2 5.000 . 5.000 2.519 2.326 2.736 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
211 1 16 ILE MG 1 30 PHE HA 5.000 . 5.000 4.343 4.313 4.404 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
212 1 16 ILE MG 1 30 PHE QB 5.000 . 5.000 1.894 1.832 1.946 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
213 1 16 ILE MG 1 30 PHE QD 5.000 . 5.000 1.919 1.873 1.968 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
214 1 16 ILE MG 1 30 PHE H 5.000 . 5.000 3.830 3.759 3.908 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
215 1 16 ILE MG 1 31 ILE QG 5.000 . 5.000 3.432 3.058 3.723 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
216 1 16 ILE MG 1 31 ILE H 5.000 . 5.000 3.900 3.741 4.055 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
217 1 16 ILE MG 1 45 LEU HA 5.000 . 5.000 3.915 3.822 3.997 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
218 1 16 ILE H 1 17 PHE QB 5.000 . 5.000 3.977 3.933 4.024 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
219 1 16 ILE H 1 17 PHE H 3.300 . 3.300 2.377 2.344 2.461 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
220 1 16 ILE H 1 18 ASN H 5.000 . 5.000 3.869 3.781 4.052 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
221 1 16 ILE H 1 45 LEU MD1 5.000 . 5.000 3.005 2.879 3.111 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
222 1 17 PHE HA 1 17 PHE QE 5.000 . 5.000 4.501 4.465 4.558 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
223 1 17 PHE HA 1 18 ASN H 5.000 . 5.000 3.518 3.510 3.531 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
224 1 17 PHE HA 1 19 LEU H 5.000 . 5.000 3.957 3.849 4.049 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
225 1 17 PHE HA 1 27 VAL MG1 5.000 . 5.000 2.083 1.951 2.220 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
226 1 17 PHE H 1 17 PHE QB 3.300 . 3.300 2.058 2.027 2.086 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
227 1 17 PHE QB 1 18 ASN H 5.000 . 5.000 2.552 2.371 2.685 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
228 1 17 PHE QB 1 19 LEU H 5.000 . 5.000 4.483 4.416 4.524 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
229 1 17 PHE QB 1 27 VAL MG1 5.000 . 5.000 3.491 3.327 3.620 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
230 1 17 PHE QD 1 18 ASN HA 5.000 . 5.000 4.109 3.570 4.320 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
231 1 17 PHE QD 1 27 VAL MG1 5.000 . 5.000 2.662 2.361 2.803 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
232 1 17 PHE QD 1 31 ILE MD 5.000 . 5.000 2.180 1.970 2.432 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
233 1 17 PHE QE 1 27 VAL MG1 5.000 . 5.000 3.600 3.298 3.739 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
234 1 17 PHE QE 1 31 ILE MD 5.000 . 5.000 2.750 2.639 2.862 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
235 1 17 PHE H 1 18 ASN H 3.300 . 3.300 2.568 2.500 2.701 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
236 1 17 PHE H 1 19 LEU H 5.000 . 5.000 4.021 3.975 4.114 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
237 1 18 ASN HA 1 19 LEU H 5.000 . 5.000 3.309 3.269 3.361 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
238 1 18 ASN HB3 1 19 LEU H 5.000 . 5.000 4.292 3.966 4.396 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
239 1 18 ASN H 1 18 ASN HB2 3.300 . 3.300 2.340 2.152 2.442 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
240 1 18 ASN H 1 18 ASN QD 5.000 . 5.000 2.567 1.984 4.353 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
241 1 18 ASN H 1 19 LEU H 2.700 . 2.700 2.666 2.609 2.730 0.030 26 0 "[ . 1 . 2 . 3 . 4]" 1
242 1 19 LEU HA 1 20 PRO QD 5.000 . 5.000 1.785 1.767 1.810 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
243 1 19 LEU HA 1 20 PRO QG 5.000 . 5.000 3.567 3.490 3.628 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
244 1 19 LEU HA 1 21 ASN H 5.000 . 5.000 4.102 4.030 4.189 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
245 1 19 LEU HA 1 52 ASN QD 5.000 . 5.000 4.405 4.137 4.507 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
246 1 19 LEU QB 1 20 PRO QD 5.000 . 5.000 3.011 2.871 3.090 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
247 1 19 LEU QB 1 21 ASN H 5.000 . 5.000 2.538 2.456 2.576 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
248 1 19 LEU QB 1 22 LEU MD1 5.000 . 5.000 1.882 1.845 1.921 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
249 1 19 LEU QB 1 22 LEU HG 5.000 . 5.000 2.201 2.138 2.354 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
250 1 19 LEU QB 1 22 LEU H 5.000 . 5.000 2.854 2.778 2.908 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
251 1 19 LEU QB 1 52 ASN QB 5.000 . 5.000 2.220 2.061 2.393 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
252 1 19 LEU QB 1 52 ASN H 5.000 . 5.000 4.602 4.525 4.642 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
253 1 19 LEU H 1 19 LEU MD1 5.000 . 5.000 3.916 3.787 3.990 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
254 1 19 LEU MD1 1 20 PRO QD 5.000 . 5.000 3.957 3.851 4.022 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
255 1 19 LEU MD1 1 21 ASN H 5.000 . 5.000 4.256 4.168 4.307 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
256 1 19 LEU MD1 1 22 LEU HB2 5.000 . 5.000 4.062 3.973 4.129 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
257 1 19 LEU MD1 1 22 LEU MD1 5.000 . 5.000 1.763 1.714 1.799 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
258 1 19 LEU MD1 1 22 LEU HG 5.000 . 5.000 2.445 2.322 2.586 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
259 1 19 LEU MD1 1 22 LEU H 5.000 . 5.000 4.221 4.184 4.256 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
260 1 19 LEU MD1 1 49 LYS HA 5.000 . 5.000 1.969 1.873 2.113 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
261 1 19 LEU MD1 1 49 LYS H 5.000 . 5.000 2.932 2.789 3.065 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
262 1 19 LEU MD1 1 50 LYS H 5.000 . 5.000 4.263 4.214 4.284 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
263 1 19 LEU MD1 1 52 ASN HA 5.000 . 5.000 3.898 3.754 4.061 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
264 1 19 LEU MD1 1 52 ASN QB 5.000 . 5.000 1.784 1.732 1.831 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
265 1 19 LEU MD1 1 52 ASN QD 5.000 . 5.000 3.652 3.312 3.807 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
266 1 19 LEU MD1 1 52 ASN H 5.000 . 5.000 3.058 2.994 3.105 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
267 1 19 LEU MD1 1 53 ASP H 5.000 . 5.000 4.227 4.109 4.303 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
268 1 19 LEU H 1 19 LEU MD2 5.000 . 5.000 4.017 3.949 4.058 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
269 1 19 LEU MD2 1 20 PRO QD 5.000 . 5.000 1.856 1.819 1.907 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
270 1 19 LEU MD2 1 49 LYS HA 5.000 . 5.000 2.408 2.177 2.580 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
271 1 19 LEU MD2 1 49 LYS QE 5.000 . 5.000 3.162 2.172 3.754 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
272 1 19 LEU MD2 1 49 LYS QG 5.000 . 5.000 3.016 2.435 3.708 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
273 1 19 LEU MD2 1 52 ASN QB 5.000 . 5.000 2.219 2.161 2.354 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
274 1 19 LEU MD2 1 52 ASN QD 5.000 . 5.000 2.351 2.069 2.505 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
275 1 19 LEU MD2 1 52 ASN H 5.000 . 5.000 4.227 4.191 4.262 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
276 1 19 LEU MD2 1 53 ASP H 5.000 . 5.000 4.320 4.260 4.365 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
277 1 19 LEU H 1 19 LEU HG 5.000 . 5.000 3.132 3.013 3.243 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
278 1 19 LEU HG 1 22 LEU MD1 5.000 . 5.000 3.462 3.385 3.537 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
279 1 19 LEU H 1 20 PRO QD 5.000 . 5.000 4.358 4.322 4.398 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
280 1 19 LEU H 1 21 ASN H 5.000 . 5.000 5.146 5.107 5.178 0.178 2 0 "[ . 1 . 2 . 3 . 4]" 1
281 1 19 LEU H 1 22 LEU MD1 5.000 . 5.000 3.684 3.523 3.758 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
282 1 20 PRO HA 1 21 ASN H 5.000 . 5.000 3.317 3.271 3.385 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
283 1 20 PRO HA 1 22 LEU H 5.000 . 5.000 4.539 4.454 4.618 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
284 1 20 PRO QB 1 20 PRO QD 3.300 . 3.300 2.791 2.757 2.823 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
285 1 20 PRO QB 1 21 ASN HA 5.000 . 5.000 4.329 4.309 4.356 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
286 1 20 PRO QB 1 21 ASN H 5.000 . 5.000 3.821 3.764 3.852 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
287 1 20 PRO QD 1 21 ASN H 5.000 . 5.000 3.016 2.872 3.080 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
288 1 20 PRO QD 1 52 ASN QD 5.000 . 5.000 2.153 1.861 2.501 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
289 1 20 PRO QG 1 21 ASN QD 5.000 . 5.000 3.448 3.147 3.965 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
290 1 20 PRO QG 1 21 ASN H 5.000 . 5.000 4.443 4.381 4.480 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
291 1 20 PRO QG 1 52 ASN QD 5.000 . 5.000 3.364 3.197 3.471 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
292 1 21 ASN HA 1 21 ASN HB3 2.700 . 2.700 2.466 2.249 2.561 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
293 1 21 ASN HA 1 22 LEU H 3.300 . 3.300 3.320 3.290 3.344 0.044 1 0 "[ . 1 . 2 . 3 . 4]" 1
294 1 21 ASN HA 1 52 ASN HA 5.000 . 5.000 4.496 4.335 4.578 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
295 1 21 ASN HA 1 55 GLN HB3 5.000 . 5.000 3.966 3.854 4.076 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
296 1 21 ASN HA 1 56 ALA HA 5.000 . 5.000 5.016 4.858 5.161 0.161 16 0 "[ . 1 . 2 . 3 . 4]" 1
297 1 21 ASN HB3 1 52 ASN HA 5.000 . 5.000 3.045 2.575 3.618 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
298 1 21 ASN HB3 1 55 GLN HA 5.000 . 5.000 4.159 4.054 4.381 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
299 1 21 ASN HB3 1 55 GLN HB2 5.000 . 5.000 2.175 2.005 2.762 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
300 1 21 ASN HB3 1 56 ALA HA 5.000 . 5.000 3.488 3.172 3.722 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
301 1 21 ASN H 1 21 ASN HB2 3.300 . 3.300 2.898 2.738 3.305 0.005 30 0 "[ . 1 . 2 . 3 . 4]" 1
302 1 21 ASN HB2 1 22 LEU H 5.000 . 5.000 3.597 3.514 3.704 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
303 1 21 ASN HB2 1 52 ASN HA 5.000 . 5.000 2.029 1.830 2.213 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
304 1 21 ASN HB2 1 55 GLN HB3 5.000 . 5.000 3.770 2.972 4.305 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
305 1 21 ASN HB2 1 55 GLN HB2 5.000 . 5.000 2.825 2.043 3.307 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
306 1 21 ASN HB2 1 55 GLN H 5.000 . 5.000 4.080 3.584 4.408 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
307 1 21 ASN HB2 1 56 ALA H 5.000 . 5.000 4.106 3.763 4.550 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
308 1 21 ASN H 1 21 ASN QD 5.000 . 5.000 3.558 3.128 4.360 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
309 1 21 ASN QD 1 52 ASN HA 5.000 . 5.000 3.903 3.581 4.596 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
310 1 21 ASN QD 1 52 ASN QD 5.000 . 5.000 2.149 1.520 3.282 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
311 1 21 ASN QD 1 53 ASP HA 5.000 . 5.000 4.099 3.529 4.510 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
312 1 21 ASN QD 1 56 ALA HA 5.000 . 5.000 2.696 1.809 3.399 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
313 1 21 ASN QD 1 56 ALA MB 5.000 . 5.000 2.394 2.111 3.026 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
314 1 21 ASN QD 1 56 ALA H 5.000 . 5.000 4.160 3.712 4.477 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
315 1 21 ASN QD 1 57 PRO QD 5.000 . 5.000 2.817 2.269 3.684 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
316 1 21 ASN H 1 22 LEU HA 5.000 . 5.000 4.497 4.431 4.523 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
317 1 21 ASN H 1 22 LEU MD1 5.000 . 5.000 4.383 4.358 4.416 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
318 1 21 ASN H 1 22 LEU HG 5.000 . 5.000 3.146 3.076 3.214 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
319 1 21 ASN H 1 22 LEU H 2.700 . 2.700 1.842 1.804 1.891 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
320 1 21 ASN H 1 52 ASN HA 5.000 . 5.000 3.770 3.653 3.881 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
321 1 21 ASN H 1 52 ASN QB 5.000 . 5.000 3.128 2.460 3.660 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
322 1 21 ASN H 1 52 ASN QD 5.000 . 5.000 3.826 2.691 4.476 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
323 1 22 LEU HA 1 22 LEU HB3 2.700 . 2.700 2.452 2.440 2.485 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
324 1 22 LEU HA 1 23 ASN H 2.700 . 2.700 2.264 2.181 2.289 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
325 1 22 LEU HA 1 26 GLN QB 5.000 . 5.000 3.415 3.183 3.612 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
326 1 22 LEU HA 1 27 VAL MG2 5.000 . 5.000 3.970 3.856 4.170 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
327 1 22 LEU HA 1 52 ASN HA 5.000 . 5.000 3.774 3.537 3.891 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
328 1 22 LEU HA 1 55 GLN QE 5.000 . 5.000 1.787 1.737 2.407 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
329 1 22 LEU HB3 1 23 ASN H 3.300 . 3.300 2.763 2.677 3.005 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
330 1 22 LEU HB3 1 26 GLN QB 5.000 . 5.000 2.620 2.315 2.806 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
331 1 22 LEU H 1 22 LEU MD1 5.000 . 5.000 3.628 3.583 3.679 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
332 1 22 LEU MD1 1 48 ALA HA 5.000 . 5.000 2.366 2.305 2.428 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
333 1 22 LEU MD1 1 48 ALA MB 5.000 . 5.000 1.816 1.779 1.848 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
334 1 22 LEU MD1 1 48 ALA H 5.000 . 5.000 4.330 4.302 4.363 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
335 1 22 LEU MD1 1 52 ASN HA 5.000 . 5.000 4.253 4.211 4.315 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
336 1 22 LEU MD1 1 52 ASN QB 5.000 . 5.000 2.883 2.732 2.972 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
337 1 22 LEU H 1 22 LEU MD2 5.000 . 5.000 3.374 3.244 3.478 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
338 1 22 LEU MD2 1 23 ASN H 5.000 . 5.000 3.290 3.011 3.435 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
339 1 22 LEU MD2 1 26 GLN QE 5.000 . 5.000 2.162 1.877 3.468 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
340 1 22 LEU MD2 1 30 PHE QD 5.000 . 5.000 3.841 3.790 3.876 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
341 1 22 LEU MD2 1 30 PHE QE 5.000 . 5.000 2.177 2.106 2.246 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
342 1 22 LEU MD2 1 48 ALA HA 5.000 . 5.000 2.531 2.426 2.708 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
343 1 22 LEU MD2 1 51 LEU HA 5.000 . 5.000 3.694 3.655 3.717 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
344 1 22 LEU MD2 1 51 LEU HG 5.000 . 5.000 3.354 3.307 3.385 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
345 1 22 LEU MD2 1 51 LEU H 5.000 . 5.000 3.384 3.266 3.484 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
346 1 22 LEU MD2 1 52 ASN HA 5.000 . 5.000 2.251 2.186 2.344 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
347 1 22 LEU MD2 1 52 ASN QB 5.000 . 5.000 2.642 2.538 2.731 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
348 1 22 LEU MD2 1 52 ASN H 5.000 . 5.000 2.298 2.193 2.485 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
349 1 22 LEU MD2 1 55 GLN QE 5.000 . 5.000 1.747 1.690 1.893 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
350 1 22 LEU MD2 1 55 GLN H 5.000 . 5.000 4.320 4.178 4.354 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
351 1 22 LEU H 1 22 LEU HG 3.300 . 3.300 2.280 2.197 2.402 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
352 1 22 LEU HG 1 52 ASN QB 5.000 . 5.000 2.139 1.946 2.362 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
353 1 22 LEU H 1 23 ASN H 5.000 . 5.000 4.626 4.602 4.642 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
354 1 22 LEU H 1 52 ASN HA 5.000 . 5.000 3.753 3.625 3.853 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
355 1 23 ASN HA 1 24 GLY H 2.700 . 2.700 2.394 2.289 2.462 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
356 1 23 ASN HA 1 25 VAL H 5.000 . 5.000 4.389 4.288 4.507 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
357 1 23 ASN QB 1 24 GLY H 5.000 . 5.000 2.609 2.402 3.541 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
358 1 23 ASN QB 1 25 VAL H 5.000 . 5.000 3.403 3.172 3.769 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
359 1 23 ASN H 1 23 ASN QD 5.000 . 5.000 3.882 2.565 4.557 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
360 1 23 ASN QD 1 25 VAL HB 5.000 . 5.000 2.002 1.709 3.991 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
361 1 23 ASN QD 1 25 VAL MG2 5.000 . 5.000 2.960 2.029 3.782 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
362 1 23 ASN QD 1 25 VAL H 5.000 . 5.000 2.908 1.853 3.490 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
363 1 23 ASN QD 1 26 GLN H 5.000 . 5.000 2.830 1.971 4.355 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
364 1 23 ASN H 1 26 GLN HA 5.000 . 5.000 5.172 5.124 5.205 0.205 14 0 "[ . 1 . 2 . 3 . 4]" 1
365 1 23 ASN H 1 26 GLN QB 5.000 . 5.000 2.253 2.174 2.348 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
366 1 23 ASN H 1 26 GLN QG 5.000 . 5.000 4.240 3.879 4.336 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
367 1 23 ASN H 1 26 GLN H 5.000 . 5.000 3.459 3.312 3.790 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
368 1 23 ASN H 1 27 VAL MG2 5.000 . 5.000 3.541 3.475 3.745 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
369 1 23 ASN H 1 55 GLN QE 5.000 . 5.000 2.879 2.408 2.990 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
370 1 24 GLY QA 1 25 VAL H 5.000 . 5.000 2.758 2.665 2.800 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
371 1 24 GLY QA 1 27 VAL HB 5.000 . 5.000 3.023 2.897 3.214 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
372 1 24 GLY QA 1 27 VAL MG2 5.000 . 5.000 3.452 3.229 3.562 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
373 1 24 GLY QA 1 27 VAL H 5.000 . 5.000 3.813 3.654 3.927 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
374 1 24 GLY QA 1 28 LYS H 5.000 . 5.000 3.813 3.739 4.084 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
375 1 24 GLY H 1 25 VAL H 5.000 . 5.000 2.934 2.883 2.996 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
376 1 25 VAL HA 1 25 VAL MG1 2.700 . 2.700 2.320 2.284 2.346 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
377 1 25 VAL HA 1 25 VAL MG2 3.300 . 3.300 2.197 2.137 2.258 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
378 1 25 VAL HA 1 26 GLN H 5.000 . 5.000 3.612 3.602 3.619 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
379 1 25 VAL HA 1 27 VAL H 5.000 . 5.000 4.540 4.354 4.634 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
380 1 25 VAL HA 1 28 LYS QB 3.300 . 3.300 2.271 2.141 2.382 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
381 1 25 VAL HA 1 28 LYS QG 5.000 . 5.000 4.081 3.350 4.388 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
382 1 25 VAL H 1 25 VAL HB 2.700 . 2.700 2.449 2.400 2.528 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
383 1 25 VAL HB 1 26 GLN HA 5.000 . 5.000 4.361 4.238 4.452 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
384 1 25 VAL HB 1 26 GLN QG 5.000 . 5.000 4.113 3.877 4.314 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
385 1 25 VAL HB 1 26 GLN H 3.300 . 3.300 2.589 2.534 2.719 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
386 1 25 VAL HB 1 27 VAL H 5.000 . 5.000 5.064 5.033 5.119 0.119 26 0 "[ . 1 . 2 . 3 . 4]" 1
387 1 25 VAL MG1 1 26 GLN HA 5.000 . 5.000 3.349 3.284 3.436 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
388 1 25 VAL MG1 1 26 GLN QG 5.000 . 5.000 3.525 3.349 3.745 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
389 1 25 VAL MG1 1 29 ALA MB 5.000 . 5.000 2.972 2.841 3.078 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
390 1 25 VAL MG2 1 26 GLN H 5.000 . 5.000 3.918 3.834 3.984 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
391 1 25 VAL MG2 1 28 LYS QB 5.000 . 5.000 3.834 3.797 3.864 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
392 1 25 VAL H 1 26 GLN QB 5.000 . 5.000 4.495 4.449 4.535 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
393 1 25 VAL H 1 26 GLN H 2.700 . 2.700 2.725 2.674 2.759 0.059 3 0 "[ . 1 . 2 . 3 . 4]" 1
394 1 25 VAL H 1 27 VAL H 5.000 . 5.000 4.156 4.072 4.252 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
395 1 26 GLN HA 1 26 GLN QE 5.000 . 5.000 4.420 2.280 4.522 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
396 1 26 GLN HA 1 27 VAL H 5.000 . 5.000 3.546 3.532 3.552 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
397 1 26 GLN HA 1 29 ALA MB 5.000 . 5.000 2.384 2.237 2.449 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
398 1 26 GLN HA 1 29 ALA H 5.000 . 5.000 3.234 3.082 3.400 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
399 1 26 GLN HA 1 30 PHE QD 5.000 . 5.000 4.474 4.319 4.523 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
400 1 26 GLN H 1 26 GLN QB 3.300 . 3.300 2.157 2.106 2.193 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
401 1 26 GLN QB 1 27 VAL H 3.300 . 3.300 2.692 2.484 2.760 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
402 1 26 GLN QB 1 30 PHE QD 5.000 . 5.000 3.340 3.125 3.429 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
403 1 26 GLN H 1 26 GLN QE 5.000 . 5.000 4.648 4.385 4.826 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
404 1 26 GLN QE 1 51 LEU QD 5.000 . 5.000 2.218 1.837 3.323 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
405 1 26 GLN QE 1 51 LEU MD2 5.000 . 5.000 3.777 3.563 3.825 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
406 1 26 GLN QE 1 55 GLN QE 5.000 . 5.000 1.886 1.739 4.079 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
407 1 26 GLN H 1 26 GLN QG 5.000 . 5.000 3.018 2.708 3.178 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
408 1 26 GLN QG 1 27 VAL H 5.000 . 5.000 4.410 4.262 4.537 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
409 1 26 GLN QG 1 29 ALA MB 5.000 . 5.000 3.539 3.378 3.880 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
410 1 26 GLN QG 1 51 LEU QD 5.000 . 5.000 3.039 2.442 3.178 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
411 1 26 GLN QG 1 51 LEU MD2 5.000 . 5.000 3.814 3.789 3.933 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
412 1 26 GLN H 1 27 VAL MG2 5.000 . 5.000 4.163 4.137 4.185 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
413 1 26 GLN H 1 27 VAL H 2.700 . 2.700 2.725 2.704 2.800 0.100 23 0 "[ . 1 . 2 . 3 . 4]" 1
414 1 27 VAL HA 1 28 LYS H 5.000 . 5.000 3.533 3.513 3.563 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
415 1 27 VAL HA 1 29 ALA H 5.000 . 5.000 4.202 4.165 4.238 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
416 1 27 VAL HA 1 30 PHE QB 5.000 . 5.000 2.768 2.671 2.878 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
417 1 27 VAL HA 1 30 PHE QD 5.000 . 5.000 2.102 2.038 2.203 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
418 1 27 VAL HA 1 30 PHE H 5.000 . 5.000 3.417 3.376 3.466 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
419 1 27 VAL HA 1 31 ILE H 5.000 . 5.000 4.047 3.904 4.179 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
420 1 27 VAL H 1 27 VAL HB 2.700 . 2.700 2.551 2.523 2.616 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
421 1 27 VAL MG1 1 28 LYS H 5.000 . 5.000 3.421 3.340 3.493 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
422 1 27 VAL MG1 1 30 PHE QD 5.000 . 5.000 3.805 3.780 3.845 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
423 1 27 VAL MG1 1 31 ILE QG 5.000 . 5.000 2.844 2.665 3.005 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
424 1 27 VAL MG1 1 31 ILE H 5.000 . 5.000 4.058 3.959 4.141 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
425 1 27 VAL H 1 27 VAL MG2 3.300 . 3.300 2.085 2.012 2.110 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
426 1 27 VAL H 1 28 LYS H 3.300 . 3.300 2.619 2.573 2.684 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
427 1 27 VAL H 1 29 ALA H 5.000 . 5.000 3.881 3.812 3.930 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
428 1 28 LYS HA 1 29 ALA H 5.000 . 5.000 3.505 3.494 3.512 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
429 1 28 LYS HA 1 30 PHE H 5.000 . 5.000 4.535 4.466 4.577 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
430 1 28 LYS HA 1 31 ILE HB 3.300 . 3.300 2.371 2.168 2.560 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
431 1 28 LYS HA 1 31 ILE MD 5.000 . 5.000 2.614 2.487 2.806 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
432 1 28 LYS HA 1 31 ILE QG 5.000 . 5.000 3.627 3.383 3.818 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
433 1 28 LYS HA 1 31 ILE H 3.300 . 3.300 3.428 3.337 3.504 0.204 30 0 "[ . 1 . 2 . 3 . 4]" 1
434 1 28 LYS HA 1 32 ASP H 5.000 . 5.000 3.878 3.704 3.973 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
435 1 28 LYS H 1 28 LYS QB 2.700 . 2.700 2.257 2.190 2.346 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
436 1 28 LYS QB 1 29 ALA HA 5.000 . 5.000 4.060 3.921 4.209 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
437 1 28 LYS QB 1 29 ALA H 3.300 . 3.300 2.726 2.645 2.847 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
438 1 28 LYS H 1 28 LYS QD 5.000 . 5.000 4.144 3.420 4.562 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
439 1 28 LYS H 1 28 LYS QG 5.000 . 5.000 3.294 2.423 3.966 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
440 1 28 LYS H 1 30 PHE H 5.000 . 5.000 4.196 4.160 4.259 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
441 1 29 ALA HA 1 30 PHE H 3.300 . 3.300 3.523 3.519 3.527 0.227 11 0 "[ . 1 . 2 . 3 . 4]" 1
442 1 29 ALA HA 1 31 ILE H 5.000 . 5.000 4.229 4.168 4.343 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
443 1 29 ALA HA 1 32 ASP QB 5.000 . 5.000 2.269 2.109 2.462 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
444 1 29 ALA HA 1 32 ASP H 5.000 . 5.000 3.158 3.112 3.281 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
445 1 29 ALA H 1 29 ALA MB 3.300 . 3.300 2.214 2.195 2.225 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
446 1 29 ALA MB 1 30 PHE HA 5.000 . 5.000 3.699 3.669 3.724 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
447 1 29 ALA MB 1 30 PHE QD 5.000 . 5.000 3.767 3.745 3.794 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
448 1 29 ALA MB 1 30 PHE H 5.000 . 5.000 2.381 2.341 2.397 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
449 1 29 ALA MB 1 31 ILE H 5.000 . 5.000 4.272 4.244 4.316 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
450 1 29 ALA MB 1 32 ASP QB 5.000 . 5.000 3.648 3.567 3.775 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
451 1 29 ALA MB 1 32 ASP H 5.000 . 5.000 4.356 4.323 4.409 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
452 1 29 ALA H 1 30 PHE HA 5.000 . 5.000 5.140 5.128 5.157 0.157 18 0 "[ . 1 . 2 . 3 . 4]" 1
453 1 29 ALA H 1 30 PHE QB 5.000 . 5.000 4.509 4.483 4.526 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
454 1 29 ALA H 1 30 PHE H 2.700 . 2.700 2.545 2.534 2.567 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
455 1 29 ALA H 1 31 ILE H 5.000 . 5.000 3.767 3.709 3.838 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
456 1 29 ALA H 1 32 ASP QB 5.000 . 5.000 4.537 4.466 4.618 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
457 1 29 ALA H 1 32 ASP H 5.000 . 5.000 4.319 4.281 4.353 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
458 1 30 PHE HA 1 30 PHE QD 3.300 . 3.300 2.057 2.020 2.129 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
459 1 30 PHE H 1 30 PHE HA 2.700 . 2.700 2.793 2.785 2.803 0.103 14 0 "[ . 1 . 2 . 3 . 4]" 1
460 1 30 PHE HA 1 31 ILE H 5.000 . 5.000 3.518 3.505 3.530 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
461 1 30 PHE HA 1 32 ASP H 5.000 . 5.000 4.449 4.370 4.522 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
462 1 30 PHE HA 1 33 SER QB 2.700 . 2.700 2.516 2.484 2.603 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
463 1 30 PHE HA 1 34 LEU MD1 5.000 . 5.000 3.679 3.519 3.829 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
464 1 30 PHE HA 1 34 LEU H 5.000 . 5.000 3.958 3.830 4.023 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
465 1 30 PHE HA 1 44 LEU MD1 5.000 . 5.000 3.777 3.492 3.921 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
466 1 30 PHE H 1 30 PHE QB 3.300 . 3.300 2.398 2.366 2.412 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
467 1 30 PHE QB 1 31 ILE H 5.000 . 5.000 2.626 2.555 2.680 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
468 1 30 PHE H 1 30 PHE QD 5.000 . 5.000 3.146 3.069 3.185 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
469 1 30 PHE QD 1 31 ILE H 5.000 . 5.000 4.377 4.302 4.422 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
470 1 30 PHE QD 1 33 SER QB 5.000 . 5.000 3.626 3.484 3.692 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
471 1 30 PHE QD 1 44 LEU HA 5.000 . 5.000 3.224 3.084 3.382 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
472 1 30 PHE QD 1 44 LEU QB 5.000 . 5.000 2.912 2.570 3.009 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
473 1 30 PHE QD 1 44 LEU MD2 5.000 . 5.000 2.654 2.355 2.945 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
474 1 30 PHE QD 1 47 GLU QB 5.000 . 5.000 3.082 3.036 3.143 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
475 1 30 PHE QD 1 47 GLU QG 5.000 . 5.000 4.085 4.059 4.172 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
476 1 30 PHE QD 1 48 ALA HA 5.000 . 5.000 3.686 3.566 3.821 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
477 1 30 PHE QD 1 48 ALA MB 5.000 . 5.000 2.729 2.587 2.896 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
478 1 30 PHE QD 1 48 ALA H 5.000 . 5.000 4.327 4.260 4.418 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
479 1 30 PHE QE 1 47 GLU QB 5.000 . 5.000 1.990 1.809 2.029 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
480 1 30 PHE QE 1 47 GLU QG 5.000 . 5.000 3.366 3.219 3.486 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
481 1 30 PHE QE 1 48 ALA HA 5.000 . 5.000 2.560 2.401 2.699 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
482 1 30 PHE QE 1 48 ALA MB 5.000 . 5.000 3.102 2.963 3.251 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
483 1 30 PHE QE 1 48 ALA H 5.000 . 5.000 4.129 3.888 4.220 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
484 1 30 PHE QE 1 51 LEU QD 5.000 . 5.000 2.746 2.620 2.897 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
485 1 30 PHE QE 1 51 LEU HG 5.000 . 5.000 3.234 3.133 3.284 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
486 1 30 PHE H 1 31 ILE H 2.700 . 2.700 2.502 2.458 2.559 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
487 1 31 ILE HA 1 32 ASP H 5.000 . 5.000 3.520 3.504 3.533 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
488 1 31 ILE HA 1 33 SER H 5.000 . 5.000 4.357 4.287 4.421 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
489 1 31 ILE HA 1 34 LEU HB2 3.300 . 3.300 2.058 1.983 2.121 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
490 1 31 ILE HA 1 34 LEU MD1 5.000 . 5.000 1.886 1.848 1.917 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
491 1 31 ILE HA 1 34 LEU HG 5.000 . 5.000 4.265 4.015 4.371 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
492 1 31 ILE HA 1 34 LEU H 5.000 . 5.000 3.294 3.178 3.391 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
493 1 31 ILE HA 1 35 ARG H 5.000 . 5.000 3.926 3.843 4.132 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
494 1 31 ILE H 1 31 ILE HB 3.300 . 3.300 2.339 2.285 2.429 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
495 1 31 ILE HB 1 32 ASP H 5.000 . 5.000 2.611 2.540 2.669 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
496 1 31 ILE H 1 31 ILE MD 5.000 . 5.000 3.701 3.611 3.773 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
497 1 31 ILE H 1 31 ILE QG 3.300 . 3.300 2.529 2.359 2.656 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
498 1 31 ILE QG 1 32 ASP H 5.000 . 5.000 4.168 4.090 4.238 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
499 1 31 ILE MG 1 32 ASP HA 5.000 . 5.000 3.243 3.017 3.465 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
500 1 31 ILE MG 1 32 ASP H 5.000 . 5.000 3.134 2.908 3.400 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
501 1 31 ILE MG 1 35 ARG QD 5.000 . 5.000 2.270 1.971 2.766 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
502 1 31 ILE MG 1 35 ARG HE 5.000 . 5.000 3.699 2.530 4.356 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
503 1 31 ILE H 1 32 ASP QB 5.000 . 5.000 4.358 4.291 4.477 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
504 1 31 ILE H 1 32 ASP H 3.300 . 3.300 2.571 2.514 2.622 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
505 1 32 ASP HA 1 33 SER H 3.300 . 3.300 3.482 3.474 3.500 0.200 18 0 "[ . 1 . 2 . 3 . 4]" 1
506 1 32 ASP HA 1 35 ARG QB 5.000 . 5.000 3.176 2.363 3.948 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
507 1 32 ASP HA 1 35 ARG QD 5.000 . 5.000 2.186 1.933 2.661 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
508 1 32 ASP HA 1 35 ARG HE 5.000 . 5.000 4.251 3.863 5.076 0.076 17 0 "[ . 1 . 2 . 3 . 4]" 1
509 1 32 ASP HA 1 35 ARG QG 3.300 . 3.300 2.434 1.909 3.198 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
510 1 32 ASP HA 1 35 ARG H 5.000 . 5.000 3.425 3.217 3.611 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
511 1 32 ASP HA 1 36 ASP H 5.000 . 5.000 3.956 3.803 4.186 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
512 1 32 ASP H 1 32 ASP QB 3.300 . 3.300 2.263 2.196 2.355 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
513 1 32 ASP QB 1 33 SER H 3.300 . 3.300 2.578 2.482 2.686 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
514 1 32 ASP H 1 33 SER H 3.300 . 3.300 2.677 2.624 2.737 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
515 1 33 SER HA 1 34 LEU H 5.000 . 5.000 3.486 3.471 3.496 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
516 1 33 SER HA 1 36 ASP HB3 3.300 . 3.300 2.510 2.401 2.607 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
517 1 33 SER HA 1 36 ASP HB2 3.300 . 3.300 3.316 3.204 3.376 0.076 29 0 "[ . 1 . 2 . 3 . 4]" 1
518 1 33 SER HA 1 36 ASP H 5.000 . 5.000 3.457 3.303 3.576 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
519 1 33 SER HA 1 37 ASP H 5.000 . 5.000 3.849 3.706 3.955 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
520 1 33 SER HA 1 44 LEU MD1 5.000 . 5.000 3.681 3.547 3.808 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
521 1 33 SER QB 1 34 LEU H 5.000 . 5.000 2.582 2.530 2.675 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
522 1 33 SER QB 1 36 ASP HB3 5.000 . 5.000 4.241 4.149 4.474 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
523 1 33 SER QB 1 44 LEU MD1 5.000 . 5.000 2.102 2.015 2.305 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
524 1 33 SER QB 1 44 LEU MD2 5.000 . 5.000 1.756 1.722 1.910 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
525 1 33 SER H 1 34 LEU H 2.700 . 2.700 2.465 2.406 2.522 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
526 1 33 SER H 1 44 LEU MD2 5.000 . 5.000 4.128 4.000 4.215 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
527 1 34 LEU HA 1 34 LEU MD2 3.300 . 3.300 2.817 2.667 2.894 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
528 1 34 LEU HA 1 35 ARG H 5.000 . 5.000 3.537 3.507 3.562 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
529 1 34 LEU HA 1 36 ASP H 5.000 . 5.000 4.597 4.519 4.659 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
530 1 34 LEU HA 1 37 ASP H 5.000 . 5.000 3.545 3.470 3.612 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
531 1 34 LEU HA 1 38 PRO HA 5.000 . 5.000 3.062 2.947 3.131 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
532 1 34 LEU HA 1 38 PRO QB 5.000 . 5.000 4.707 4.627 4.762 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
533 1 34 LEU HA 1 44 LEU MD1 5.000 . 5.000 2.143 2.051 2.256 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
534 1 34 LEU HB3 1 34 LEU MD1 3.300 . 3.300 2.772 2.684 2.809 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
535 1 34 LEU HB3 1 34 LEU HG 2.700 . 2.700 2.891 2.865 2.923 0.223 24 0 "[ . 1 . 2 . 3 . 4]" 1
536 1 34 LEU HB2 1 35 ARG H 5.000 . 5.000 2.610 2.560 2.655 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
537 1 34 LEU H 1 34 LEU MD1 5.000 . 5.000 3.143 3.092 3.226 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
538 1 34 LEU MD1 1 35 ARG H 5.000 . 5.000 4.292 4.254 4.334 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
539 1 34 LEU MD2 1 38 PRO HA 5.000 . 5.000 3.028 2.849 3.153 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
540 1 34 LEU MD2 1 35 ARG H 5.000 . 5.000 4.323 4.290 4.362 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
541 1 34 LEU MD2 1 41 SER HA 5.000 . 5.000 2.596 2.402 2.701 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
542 1 34 LEU MD2 1 41 SER QB 5.000 . 5.000 1.737 1.666 1.923 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
543 1 34 LEU MD2 1 41 SER H 5.000 . 5.000 3.798 3.602 3.907 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
544 1 34 LEU MD2 1 44 LEU QB 5.000 . 5.000 3.765 3.712 3.795 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
545 1 34 LEU H 1 34 LEU HG 5.000 . 5.000 3.343 3.249 3.405 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
546 1 34 LEU H 1 35 ARG H 3.300 . 3.300 2.693 2.608 2.772 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
547 1 34 LEU H 1 36 ASP H 5.000 . 5.000 4.010 3.913 4.107 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
548 1 34 LEU H 1 44 LEU MD1 5.000 . 5.000 2.540 2.462 2.623 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
549 1 35 ARG HA 1 35 ARG QD 5.000 . 5.000 4.299 4.006 4.469 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
550 1 35 ARG HA 1 35 ARG HE 5.000 . 5.000 5.034 4.100 5.255 0.255 17 0 "[ . 1 . 2 . 3 . 4]" 1
551 1 35 ARG HA 1 35 ARG QG 3.300 . 3.300 2.676 2.308 2.939 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
552 1 35 ARG HA 1 36 ASP H 5.000 . 5.000 3.536 3.528 3.542 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
553 1 35 ARG QB 1 35 ARG HE 5.000 . 5.000 2.945 1.995 4.037 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
554 1 35 ARG QB 1 36 ASP H 3.300 . 3.300 2.513 2.308 2.690 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
555 1 35 ARG QB 1 37 ASP H 5.000 . 5.000 4.563 4.497 4.612 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
556 1 35 ARG H 1 35 ARG QD 5.000 . 5.000 3.607 3.463 3.782 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
557 1 35 ARG QD 1 36 ASP H 5.000 . 5.000 4.460 4.091 4.534 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
558 1 35 ARG H 1 35 ARG QG 3.300 . 3.300 1.874 1.665 2.088 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
559 1 35 ARG QG 1 36 ASP H 5.000 . 5.000 3.307 2.741 3.996 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
560 1 35 ARG H 1 36 ASP H 2.700 . 2.700 2.700 2.644 2.732 0.032 30 0 "[ . 1 . 2 . 3 . 4]" 1
561 1 35 ARG H 1 36 ASP HB3 5.000 . 5.000 4.926 4.853 5.014 0.014 29 0 "[ . 1 . 2 . 3 . 4]" 1
562 1 35 ARG H 1 36 ASP HB2 5.000 . 5.000 4.976 4.899 5.017 0.017 11 0 "[ . 1 . 2 . 3 . 4]" 1
563 1 35 ARG H 1 37 ASP H 5.000 . 5.000 3.974 3.865 4.055 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
564 1 36 ASP HA 1 36 ASP HB3 2.700 . 2.700 2.991 2.985 2.993 0.293 14 0 "[ . 1 . 2 . 3 . 4]" 1
565 1 36 ASP HA 1 37 ASP H 5.000 . 5.000 3.489 3.468 3.508 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
566 1 36 ASP H 1 36 ASP HB3 2.700 . 2.700 2.573 2.530 2.638 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
567 1 36 ASP HB3 1 37 ASP H 3.300 . 3.300 2.632 2.568 2.711 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
568 1 36 ASP H 1 36 ASP HB2 2.700 . 2.700 2.439 2.356 2.481 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
569 1 36 ASP H 1 37 ASP HA 5.000 . 5.000 5.145 5.124 5.159 0.159 9 0 "[ . 1 . 2 . 3 . 4]" 1
570 1 36 ASP H 1 37 ASP H 2.700 . 2.700 2.558 2.517 2.596 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
571 1 37 ASP HA 1 38 PRO QB 5.000 . 5.000 4.704 4.697 4.728 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
572 1 37 ASP HA 1 38 PRO QD 2.700 . 2.700 1.952 1.927 1.996 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
573 1 37 ASP HA 1 38 PRO QG 5.000 . 5.000 3.863 3.839 3.905 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
574 1 37 ASP HA 1 39 SER H 5.000 . 5.000 3.546 3.423 3.669 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
575 1 37 ASP QB 1 38 PRO QD 5.000 . 5.000 3.757 3.568 3.781 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
576 1 37 ASP QB 1 39 SER H 5.000 . 5.000 4.339 3.962 4.457 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
577 1 37 ASP QB 1 40 GLN QB 5.000 . 5.000 2.166 1.879 2.608 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
578 1 37 ASP QB 1 40 GLN QG 5.000 . 5.000 3.746 3.435 3.999 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
579 1 37 ASP QB 1 40 GLN H 5.000 . 5.000 3.343 2.972 3.487 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
580 1 37 ASP H 1 38 PRO HA 5.000 . 5.000 4.378 4.292 4.428 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
581 1 37 ASP H 1 38 PRO QD 5.000 . 5.000 3.351 3.205 3.459 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
582 1 37 ASP H 1 40 GLN QB 5.000 . 5.000 4.413 4.243 4.492 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
583 1 38 PRO HA 1 39 SER H 5.000 . 5.000 3.499 3.461 3.531 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
584 1 38 PRO HA 1 40 GLN H 5.000 . 5.000 3.798 3.501 3.907 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
585 1 38 PRO HA 1 41 SER H 5.000 . 5.000 3.210 3.088 3.307 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
586 1 38 PRO QB 1 39 SER HA 5.000 . 5.000 3.898 3.853 3.952 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
587 1 38 PRO QB 1 39 SER H 5.000 . 5.000 3.026 2.904 3.156 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
588 1 38 PRO QD 1 39 SER H 5.000 . 5.000 2.356 2.292 2.469 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
589 1 38 PRO QG 1 39 SER H 5.000 . 5.000 3.506 3.416 3.630 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
590 1 39 SER HA 1 39 SER QB 2.700 . 2.700 2.330 2.182 2.449 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
591 1 39 SER HA 1 40 GLN H 5.000 . 5.000 3.446 3.367 3.469 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
592 1 39 SER HA 1 41 SER H 5.000 . 5.000 3.709 3.613 3.877 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
593 1 39 SER H 1 40 GLN HA 5.000 . 5.000 5.143 5.077 5.185 0.185 37 0 "[ . 1 . 2 . 3 . 4]" 1
594 1 39 SER H 1 40 GLN QB 5.000 . 5.000 4.175 3.987 4.339 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
595 1 39 SER H 1 40 GLN H 2.700 . 2.700 2.457 2.395 2.523 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
596 1 39 SER H 1 41 SER H 5.000 . 5.000 3.918 3.852 4.040 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
597 1 40 GLN HA 1 40 GLN QE 5.000 . 5.000 3.980 2.026 4.504 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
598 1 40 GLN HA 1 41 SER H 5.000 . 5.000 3.321 3.274 3.350 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
599 1 40 GLN HA 1 42 ALA H 5.000 . 5.000 3.796 3.677 4.002 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
600 1 40 GLN HA 1 43 ASN QB 5.000 . 5.000 2.625 2.333 2.971 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
601 1 40 GLN HA 1 43 ASN QD 5.000 . 5.000 3.074 1.934 4.485 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
602 1 40 GLN HA 1 43 ASN H 5.000 . 5.000 3.183 2.958 3.394 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
603 1 40 GLN HA 1 44 LEU MD1 5.000 . 5.000 4.138 3.877 4.275 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
604 1 40 GLN HA 1 44 LEU HG 5.000 . 5.000 4.339 4.026 4.547 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
605 1 40 GLN HA 1 44 LEU H 5.000 . 5.000 4.517 4.164 4.826 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
606 1 40 GLN H 1 40 GLN QB 3.300 . 3.300 2.195 2.102 2.321 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
607 1 40 GLN QB 1 41 SER H 5.000 . 5.000 3.371 3.276 3.435 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
608 1 40 GLN QB 1 43 ASN QB 5.000 . 5.000 3.229 2.680 3.584 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
609 1 40 GLN QB 1 44 LEU MD1 5.000 . 5.000 2.334 2.017 2.479 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
610 1 40 GLN QB 1 44 LEU HG 5.000 . 5.000 2.985 2.218 3.378 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
611 1 40 GLN QB 1 44 LEU H 5.000 . 5.000 4.210 3.544 4.554 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
612 1 40 GLN H 1 40 GLN QG 5.000 . 5.000 3.889 2.893 4.072 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
613 1 40 GLN QG 1 43 ASN QB 5.000 . 5.000 2.070 1.824 2.678 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
614 1 40 GLN QG 1 44 LEU MD1 5.000 . 5.000 3.340 2.870 3.834 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
615 1 40 GLN QG 1 44 LEU HG 5.000 . 5.000 2.977 2.140 4.025 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
616 1 40 GLN H 1 41 SER H 2.700 . 2.700 2.506 2.366 2.572 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
617 1 40 GLN H 1 42 ALA H 5.000 . 5.000 4.903 4.746 5.025 0.025 10 0 "[ . 1 . 2 . 3 . 4]" 1
618 1 40 GLN H 1 44 LEU MD1 5.000 . 5.000 3.883 3.679 4.003 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
619 1 41 SER HA 1 42 ALA H 5.000 . 5.000 3.543 3.523 3.568 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
620 1 41 SER HA 1 43 ASN H 5.000 . 5.000 4.289 4.202 4.396 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
621 1 41 SER HA 1 44 LEU QB 5.000 . 5.000 2.547 2.405 2.659 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
622 1 41 SER HA 1 44 LEU MD1 5.000 . 5.000 1.999 1.966 2.031 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
623 1 41 SER HA 1 44 LEU MD2 5.000 . 5.000 4.456 4.358 4.526 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
624 1 41 SER HA 1 44 LEU HG 5.000 . 5.000 3.448 3.218 3.707 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
625 1 41 SER HA 1 44 LEU H 5.000 . 5.000 3.383 3.340 3.443 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
626 1 41 SER HA 1 45 LEU H 5.000 . 5.000 4.011 3.919 4.121 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
627 1 41 SER H 1 41 SER QB 3.300 . 3.300 2.379 2.196 2.730 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
628 1 41 SER QB 1 42 ALA H 5.000 . 5.000 3.141 2.480 3.409 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
629 1 41 SER H 1 42 ALA H 3.300 . 3.300 2.916 2.831 3.015 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
630 1 41 SER H 1 43 ASN QB 5.000 . 5.000 4.688 4.633 4.786 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
631 1 41 SER H 1 44 LEU H 5.000 . 5.000 4.713 4.579 4.834 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
632 1 42 ALA HA 1 43 ASN H 5.000 . 5.000 3.480 3.470 3.485 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
633 1 42 ALA HA 1 44 LEU H 5.000 . 5.000 4.266 4.187 4.305 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
634 1 42 ALA HA 1 45 LEU QB 5.000 . 5.000 2.329 2.242 2.367 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
635 1 42 ALA HA 1 45 LEU MD2 5.000 . 5.000 2.962 2.896 3.008 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
636 1 42 ALA HA 1 45 LEU H 5.000 . 5.000 3.493 3.396 3.528 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
637 1 42 ALA HA 1 46 ALA H 5.000 . 5.000 4.113 4.029 4.196 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
638 1 42 ALA H 1 42 ALA MB 3.300 . 3.300 2.191 2.180 2.212 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
639 1 42 ALA MB 1 43 ASN HA 5.000 . 5.000 3.717 3.674 3.794 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
640 1 42 ALA MB 1 43 ASN QB 5.000 . 5.000 3.785 3.623 3.857 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
641 1 42 ALA MB 1 43 ASN H 5.000 . 5.000 2.422 2.329 2.571 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
642 1 42 ALA MB 1 44 LEU H 5.000 . 5.000 4.326 4.272 4.401 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
643 1 42 ALA MB 1 45 LEU QB 5.000 . 5.000 3.726 3.640 3.759 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
644 1 42 ALA H 1 43 ASN HA 5.000 . 5.000 5.126 5.094 5.159 0.159 31 0 "[ . 1 . 2 . 3 . 4]" 1
645 1 42 ALA H 1 43 ASN QB 5.000 . 5.000 4.094 4.033 4.152 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
646 1 42 ALA H 1 43 ASN H 2.700 . 2.700 2.475 2.426 2.522 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
647 1 42 ALA H 1 44 LEU HG 5.000 . 5.000 4.966 4.833 5.034 0.034 37 0 "[ . 1 . 2 . 3 . 4]" 1
648 1 42 ALA H 1 45 LEU QB 5.000 . 5.000 4.487 4.423 4.552 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
649 1 43 ASN H 1 43 ASN HA 2.700 . 2.700 2.813 2.805 2.821 0.121 10 0 "[ . 1 . 2 . 3 . 4]" 1
650 1 43 ASN HA 1 44 LEU H 5.000 . 5.000 3.455 3.441 3.463 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
651 1 43 ASN HA 1 45 LEU H 5.000 . 5.000 4.273 4.226 4.304 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
652 1 43 ASN HA 1 46 ALA HA 5.000 . 5.000 4.849 4.744 4.937 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
653 1 43 ASN HA 1 46 ALA MB 5.000 . 5.000 2.199 2.070 2.290 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
654 1 43 ASN HA 1 46 ALA H 5.000 . 5.000 3.206 3.148 3.253 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
655 1 43 ASN HA 1 47 GLU H 5.000 . 5.000 3.971 3.920 4.061 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
656 1 43 ASN H 1 43 ASN QB 3.300 . 3.300 2.056 1.953 2.169 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
657 1 43 ASN QB 1 44 LEU HA 5.000 . 5.000 3.908 3.819 4.089 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
658 1 43 ASN QB 1 44 LEU MD1 5.000 . 5.000 3.823 3.743 3.883 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
659 1 43 ASN QB 1 44 LEU MD2 5.000 . 5.000 3.358 3.076 3.572 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
660 1 43 ASN QB 1 44 LEU HG 5.000 . 5.000 2.769 2.492 2.879 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
661 1 43 ASN QB 1 44 LEU H 5.000 . 5.000 2.640 2.504 2.716 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
662 1 43 ASN QB 1 45 LEU H 5.000 . 5.000 4.447 4.403 4.469 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
663 1 43 ASN QB 1 46 ALA MB 5.000 . 5.000 3.780 3.744 3.843 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
664 1 43 ASN QB 1 46 ALA H 5.000 . 5.000 4.543 4.515 4.581 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
665 1 43 ASN H 1 43 ASN QD 5.000 . 5.000 3.411 2.458 4.507 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
666 1 43 ASN H 1 44 LEU MD1 5.000 . 5.000 4.315 4.289 4.329 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
667 1 43 ASN H 1 44 LEU H 2.700 . 2.700 2.486 2.448 2.518 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
668 1 43 ASN H 1 45 LEU H 5.000 . 5.000 3.818 3.772 3.847 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
669 1 43 ASN H 1 46 ALA H 5.000 . 5.000 4.322 4.251 4.383 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
670 1 44 LEU HA 1 44 LEU MD2 3.300 . 3.300 1.900 1.842 1.942 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
671 1 44 LEU HA 1 44 LEU HG 3.300 . 3.300 2.796 2.703 2.896 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
672 1 44 LEU HA 1 45 LEU H 5.000 . 5.000 3.397 3.384 3.409 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
673 1 44 LEU HA 1 46 ALA H 5.000 . 5.000 4.021 3.984 4.050 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
674 1 44 LEU HA 1 47 GLU QB 5.000 . 5.000 2.098 2.064 2.142 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
675 1 44 LEU HA 1 47 GLU QG 3.300 . 3.300 2.886 2.818 2.955 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
676 1 44 LEU HA 1 47 GLU H 3.300 . 3.300 3.035 3.004 3.060 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
677 1 44 LEU HA 1 48 ALA H 5.000 . 5.000 3.811 3.738 3.859 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
678 1 44 LEU H 1 44 LEU QB 3.300 . 3.300 2.362 2.303 2.417 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
679 1 44 LEU QB 1 45 LEU H 5.000 . 5.000 2.499 2.464 2.540 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
680 1 44 LEU QB 1 47 GLU QB 5.000 . 5.000 3.797 3.745 3.837 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
681 1 44 LEU H 1 44 LEU MD1 5.000 . 5.000 3.116 3.086 3.169 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
682 1 44 LEU MD1 1 45 LEU H 5.000 . 5.000 4.267 4.248 4.297 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
683 1 44 LEU H 1 44 LEU MD2 5.000 . 5.000 3.257 3.119 3.382 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
684 1 44 LEU MD2 1 45 LEU H 5.000 . 5.000 4.412 4.358 4.446 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
685 1 44 LEU MD2 1 47 GLU QB 5.000 . 5.000 3.147 3.041 3.260 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
686 1 44 LEU MD2 1 47 GLU QG 5.000 . 5.000 2.910 2.823 2.979 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
687 1 44 LEU MD2 1 47 GLU H 5.000 . 5.000 4.371 4.322 4.410 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
688 1 44 LEU H 1 44 LEU HG 3.300 . 3.300 1.887 1.789 2.001 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
689 1 44 LEU H 1 45 LEU H 3.300 . 3.300 2.253 2.220 2.293 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
690 1 44 LEU H 1 46 ALA H 5.000 . 5.000 3.505 3.425 3.572 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
691 1 44 LEU H 1 47 GLU QB 5.000 . 5.000 4.541 4.510 4.577 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
692 1 44 LEU H 1 47 GLU QG 5.000 . 5.000 4.566 4.514 4.600 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
693 1 45 LEU HA 1 45 LEU MD1 3.300 . 3.300 2.214 2.174 2.264 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
694 1 45 LEU HA 1 45 LEU HG 3.300 . 3.300 3.311 3.300 3.323 0.023 18 0 "[ . 1 . 2 . 3 . 4]" 1
695 1 45 LEU HA 1 46 ALA H 5.000 . 5.000 3.468 3.460 3.477 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
696 1 45 LEU HA 1 47 GLU H 5.000 . 5.000 4.447 4.396 4.482 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
697 1 45 LEU HA 1 48 ALA MB 5.000 . 5.000 2.276 2.140 2.360 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
698 1 45 LEU HA 1 48 ALA H 3.300 . 3.300 3.320 3.251 3.357 0.057 14 0 "[ . 1 . 2 . 3 . 4]" 1
699 1 45 LEU H 1 45 LEU QB 3.300 . 3.300 2.179 2.159 2.191 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
700 1 45 LEU QB 1 46 ALA H 5.000 . 5.000 2.633 2.602 2.692 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
701 1 45 LEU H 1 45 LEU MD1 5.000 . 5.000 4.167 4.132 4.192 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
702 1 45 LEU MD1 1 46 ALA HA 5.000 . 5.000 4.260 4.241 4.277 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
703 1 45 LEU MD1 1 48 ALA H 5.000 . 5.000 4.235 4.206 4.270 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
704 1 45 LEU MD1 1 49 LYS QE 5.000 . 5.000 2.132 1.980 2.704 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
705 1 45 LEU MD1 1 49 LYS QG 5.000 . 5.000 2.278 2.060 3.731 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
706 1 45 LEU MD2 1 46 ALA H 5.000 . 5.000 4.288 4.261 4.327 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
707 1 45 LEU H 1 45 LEU HG 5.000 . 5.000 4.232 4.190 4.255 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
708 1 45 LEU HG 1 46 ALA HA 5.000 . 5.000 3.450 3.406 3.514 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
709 1 45 LEU HG 1 49 LYS QE 5.000 . 5.000 3.298 2.271 4.229 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
710 1 45 LEU H 1 46 ALA H 3.300 . 3.300 2.372 2.331 2.419 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
711 1 45 LEU H 1 47 GLU QB 5.000 . 5.000 4.505 4.483 4.529 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
712 1 46 ALA H 1 46 ALA HA 2.700 . 2.700 2.816 2.811 2.821 0.121 37 0 "[ . 1 . 2 . 3 . 4]" 1
713 1 46 ALA HA 1 47 GLU H 3.300 . 3.300 3.487 3.478 3.494 0.194 24 0 "[ . 1 . 2 . 3 . 4]" 1
714 1 46 ALA HA 1 48 ALA H 5.000 . 5.000 4.250 4.187 4.313 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
715 1 46 ALA HA 1 49 LYS QB 3.300 . 3.300 2.683 2.507 2.942 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
716 1 46 ALA HA 1 49 LYS QG 5.000 . 5.000 3.454 2.790 4.184 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
717 1 46 ALA HA 1 49 LYS H 5.000 . 5.000 3.424 3.350 3.565 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
718 1 46 ALA HA 1 50 LYS H 5.000 . 5.000 4.224 4.156 4.411 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
719 1 46 ALA H 1 46 ALA MB 2.700 . 2.700 2.157 2.118 2.183 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
720 1 46 ALA MB 1 47 GLU QB 5.000 . 5.000 3.907 3.885 3.923 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
721 1 46 ALA MB 1 47 GLU QG 5.000 . 5.000 3.192 3.128 3.235 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
722 1 46 ALA MB 1 47 GLU H 5.000 . 5.000 2.292 2.276 2.317 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
723 1 46 ALA MB 1 48 ALA H 5.000 . 5.000 4.229 4.198 4.245 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
724 1 46 ALA H 1 47 GLU QB 5.000 . 5.000 4.175 4.148 4.215 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
725 1 46 ALA H 1 47 GLU QG 5.000 . 5.000 4.505 4.473 4.520 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
726 1 46 ALA H 1 47 GLU H 3.300 . 3.300 2.525 2.510 2.542 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
727 1 46 ALA H 1 48 ALA MB 5.000 . 5.000 4.340 4.293 4.372 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
728 1 46 ALA H 1 48 ALA H 5.000 . 5.000 3.758 3.726 3.780 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
729 1 47 GLU HA 1 47 GLU QG 3.300 . 3.300 2.835 2.719 2.888 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
730 1 47 GLU H 1 47 GLU HA 2.700 . 2.700 2.799 2.790 2.806 0.106 14 0 "[ . 1 . 2 . 3 . 4]" 1
731 1 47 GLU HA 1 48 ALA H 5.000 . 5.000 3.488 3.483 3.494 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
732 1 47 GLU HA 1 50 LYS QB 2.700 . 2.700 2.329 2.202 2.413 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
733 1 47 GLU HA 1 50 LYS QD 5.000 . 5.000 3.406 2.157 4.380 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
734 1 47 GLU HA 1 50 LYS QE 5.000 . 5.000 2.753 2.025 4.094 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
735 1 47 GLU HA 1 50 LYS H 3.300 . 3.300 3.346 3.311 3.382 0.082 1 0 "[ . 1 . 2 . 3 . 4]" 1
736 1 47 GLU H 1 47 GLU QB 3.300 . 3.300 2.139 2.124 2.171 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
737 1 47 GLU QB 1 48 ALA HA 5.000 . 5.000 3.771 3.732 3.800 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
738 1 47 GLU QB 1 48 ALA MB 5.000 . 5.000 3.629 3.573 3.694 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
739 1 47 GLU QB 1 48 ALA H 5.000 . 5.000 2.517 2.457 2.580 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
740 1 47 GLU QB 1 50 LYS QB 5.000 . 5.000 3.942 3.813 4.005 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
741 1 47 GLU QB 1 50 LYS H 5.000 . 5.000 4.570 4.542 4.592 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
742 1 47 GLU H 1 47 GLU QG 3.300 . 3.300 2.530 2.502 2.548 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
743 1 47 GLU QG 1 48 ALA H 5.000 . 5.000 4.179 4.138 4.219 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
744 1 47 GLU QG 1 51 LEU QD 6.000 . 6.000 4.069 4.041 4.095 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
745 1 47 GLU H 1 48 ALA HA 5.000 . 5.000 5.133 5.119 5.146 0.146 26 0 "[ . 1 . 2 . 3 . 4]" 1
746 1 47 GLU H 1 48 ALA MB 5.000 . 5.000 4.050 3.999 4.094 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
747 1 47 GLU H 1 48 ALA H 2.700 . 2.700 2.517 2.497 2.535 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
748 1 47 GLU H 1 50 LYS QB 5.000 . 5.000 4.507 4.466 4.587 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
749 1 48 ALA HA 1 49 LYS H 5.000 . 5.000 3.550 3.540 3.562 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
750 1 48 ALA HA 1 50 LYS H 5.000 . 5.000 3.989 3.953 4.038 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
751 1 48 ALA HA 1 51 LEU HA 5.000 . 5.000 5.088 5.057 5.110 0.110 14 0 "[ . 1 . 2 . 3 . 4]" 1
752 1 48 ALA HA 1 51 LEU QB 5.000 . 5.000 2.258 2.231 2.284 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
753 1 48 ALA HA 1 51 LEU MD1 6.000 . 6.000 5.033 5.013 5.055 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
754 1 48 ALA HA 1 51 LEU MD2 5.000 . 5.000 3.435 3.350 3.553 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
755 1 48 ALA HA 1 51 LEU HG 5.000 . 5.000 4.180 4.120 4.226 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
756 1 48 ALA HA 1 51 LEU H 5.000 . 5.000 3.079 3.049 3.113 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
757 1 48 ALA HA 1 52 ASN H 5.000 . 5.000 3.568 3.481 3.662 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
758 1 48 ALA H 1 48 ALA MB 3.300 . 3.300 2.043 1.941 2.124 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
759 1 48 ALA MB 1 49 LYS H 5.000 . 5.000 2.401 2.316 2.469 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
760 1 48 ALA MB 1 50 LYS H 5.000 . 5.000 4.153 4.131 4.173 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
761 1 48 ALA MB 1 51 LEU QB 5.000 . 5.000 3.783 3.753 3.800 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
762 1 48 ALA MB 1 51 LEU H 5.000 . 5.000 4.320 4.301 4.340 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
763 1 48 ALA H 1 49 LYS H 2.700 . 2.700 2.597 2.542 2.650 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
764 1 48 ALA H 1 50 LYS H 5.000 . 5.000 3.680 3.636 3.717 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
765 1 49 LYS HA 1 49 LYS QB 2.700 . 2.700 2.417 2.391 2.526 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
766 1 49 LYS HA 1 50 LYS H 5.000 . 5.000 3.497 3.475 3.516 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
767 1 49 LYS HA 1 52 ASN QB 5.000 . 5.000 2.479 2.228 3.192 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
768 1 49 LYS HA 1 52 ASN QD 5.000 . 5.000 3.732 2.630 4.518 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
769 1 49 LYS HA 1 52 ASN H 5.000 . 5.000 3.515 3.393 3.647 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
770 1 49 LYS HA 1 53 ASP H 5.000 . 5.000 3.622 3.550 3.763 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
771 1 49 LYS H 1 49 LYS QB 3.300 . 3.300 2.360 2.079 2.425 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
772 1 49 LYS QB 1 50 LYS H 5.000 . 5.000 2.798 2.716 2.841 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
773 1 49 LYS H 1 49 LYS QE 5.000 . 5.000 4.453 4.246 4.549 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
774 1 49 LYS H 1 49 LYS QG 5.000 . 5.000 2.385 2.193 3.690 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
775 1 49 LYS QG 1 50 LYS H 5.000 . 5.000 4.194 4.061 4.573 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
776 1 49 LYS H 1 50 LYS H 2.700 . 2.700 2.551 2.522 2.585 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
777 1 49 LYS H 1 51 LEU H 5.000 . 5.000 4.062 4.030 4.092 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
778 1 50 LYS HA 1 50 LYS QB 2.700 . 2.700 2.412 2.366 2.526 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
779 1 50 LYS HA 1 50 LYS QD 5.000 . 5.000 3.925 2.629 4.144 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
780 1 50 LYS HA 1 50 LYS QE 5.000 . 5.000 4.427 4.124 4.548 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
781 1 50 LYS H 1 50 LYS HA 2.700 . 2.700 2.846 2.835 2.852 0.152 30 0 "[ . 1 . 2 . 3 . 4]" 1
782 1 50 LYS HA 1 51 LEU H 3.300 . 3.300 3.492 3.484 3.499 0.199 35 0 "[ . 1 . 2 . 3 . 4]" 1
783 1 50 LYS HA 1 52 ASN H 5.000 . 5.000 4.481 4.420 4.573 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
784 1 50 LYS HA 1 53 ASP QB 3.300 . 3.300 2.521 2.361 2.711 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
785 1 50 LYS HA 1 53 ASP H 3.300 . 3.300 3.495 3.440 3.607 0.307 16 0 "[ . 1 . 2 . 3 . 4]" 1
786 1 50 LYS QB 1 50 LYS QD 3.300 . 3.300 2.220 2.095 2.500 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
787 1 50 LYS H 1 50 LYS QB 2.700 . 2.700 2.231 2.090 2.273 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
788 1 50 LYS QB 1 51 LEU HA 5.000 . 5.000 4.011 3.786 4.147 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
789 1 50 LYS QB 1 51 LEU H 3.300 . 3.300 2.562 2.475 2.716 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
790 1 50 LYS H 1 50 LYS QD 5.000 . 5.000 4.281 2.677 4.611 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
791 1 50 LYS H 1 50 LYS QE 5.000 . 5.000 4.273 3.636 4.482 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
792 1 50 LYS H 1 50 LYS QG 5.000 . 5.000 3.512 2.550 4.014 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
793 1 50 LYS H 1 51 LEU QD 5.000 . 5.000 3.833 3.807 3.861 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
794 1 50 LYS H 1 51 LEU H 2.700 . 2.700 2.436 2.411 2.467 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
795 1 50 LYS H 1 52 ASN H 5.000 . 5.000 3.861 3.786 3.947 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
796 1 50 LYS H 1 53 ASP H 5.000 . 5.000 4.397 4.333 4.500 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
797 1 51 LEU H 1 51 LEU HA 2.700 . 2.700 2.833 2.827 2.838 0.138 24 0 "[ . 1 . 2 . 3 . 4]" 1
798 1 51 LEU HA 1 52 ASN H 5.000 . 5.000 3.500 3.486 3.528 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
799 1 51 LEU HA 1 53 ASP H 5.000 . 5.000 4.448 4.403 4.488 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
800 1 51 LEU HA 1 54 ALA MB 3.300 . 3.300 2.268 2.203 2.332 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
801 1 51 LEU HA 1 55 GLN H 5.000 . 5.000 3.938 3.770 4.024 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
802 1 51 LEU H 1 51 LEU QB 3.300 . 3.300 2.153 2.139 2.162 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
803 1 51 LEU QB 1 52 ASN H 3.300 . 3.300 2.654 2.611 2.680 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
804 1 51 LEU QD 1 52 ASN H 5.000 . 5.000 3.824 3.810 3.847 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
805 1 51 LEU QD 1 54 ALA MB 5.000 . 5.000 2.739 2.653 2.817 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
806 1 51 LEU QD 1 55 GLN QE 5.000 . 5.000 2.905 1.847 3.084 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
807 1 51 LEU QD 1 55 GLN QG 5.000 . 5.000 3.147 2.805 3.289 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
808 1 51 LEU H 1 51 LEU MD1 5.000 . 5.000 3.859 3.814 3.938 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
809 1 51 LEU MD1 1 55 GLN QG 5.000 . 5.000 3.167 2.817 3.313 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
810 1 51 LEU H 1 51 LEU MD2 5.000 . 5.000 2.258 2.226 2.300 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
811 1 51 LEU MD2 1 52 ASN H 5.000 . 5.000 4.140 4.110 4.178 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
812 1 51 LEU H 1 51 LEU HG 5.000 . 5.000 4.161 4.127 4.184 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
813 1 51 LEU HG 1 52 ASN H 5.000 . 5.000 5.125 5.086 5.153 0.153 15 0 "[ . 1 . 2 . 3 . 4]" 1
814 1 51 LEU H 1 52 ASN QB 5.000 . 5.000 4.182 4.057 4.416 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
815 1 51 LEU H 1 52 ASN H 2.700 . 2.700 2.505 2.474 2.581 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
816 1 52 ASN HA 1 53 ASP HA 5.000 . 5.000 4.767 4.737 4.796 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
817 1 52 ASN HA 1 53 ASP H 5.000 . 5.000 3.542 3.533 3.562 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
818 1 52 ASN HA 1 54 ALA H 5.000 . 5.000 4.412 4.328 4.497 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
819 1 52 ASN HA 1 55 GLN HB2 3.300 . 3.300 2.560 2.433 2.631 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
820 1 52 ASN HA 1 55 GLN QE 5.000 . 5.000 2.619 2.449 3.659 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
821 1 52 ASN HA 1 55 GLN H 5.000 . 5.000 3.358 3.258 3.429 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
822 1 52 ASN HA 1 56 ALA H 5.000 . 5.000 4.442 4.276 4.677 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
823 1 52 ASN H 1 52 ASN QB 3.300 . 3.300 2.136 1.974 2.208 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
824 1 52 ASN QB 1 53 ASP H 5.000 . 5.000 2.641 2.357 3.239 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
825 1 52 ASN H 1 52 ASN QD 5.000 . 5.000 4.356 4.046 4.626 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
826 1 52 ASN QD 1 53 ASP HA 5.000 . 5.000 3.256 2.928 3.798 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
827 1 52 ASN QD 1 53 ASP H 5.000 . 5.000 3.314 2.923 4.068 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
828 1 52 ASN H 1 53 ASP HA 5.000 . 5.000 5.188 5.163 5.210 0.210 5 0 "[ . 1 . 2 . 3 . 4]" 1
829 1 52 ASN H 1 53 ASP QB 5.000 . 5.000 4.412 4.319 4.520 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
830 1 52 ASN H 1 53 ASP H 3.300 . 3.300 2.583 2.551 2.618 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
831 1 53 ASP HA 1 53 ASP QB 2.700 . 2.700 2.362 2.302 2.422 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
832 1 53 ASP H 1 53 ASP HA 2.700 . 2.700 2.808 2.802 2.815 0.115 29 0 "[ . 1 . 2 . 3 . 4]" 1
833 1 53 ASP HA 1 54 ALA H 5.000 . 5.000 3.512 3.503 3.522 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
834 1 53 ASP HA 1 55 GLN H 5.000 . 5.000 4.251 4.184 4.349 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
835 1 53 ASP HA 1 56 ALA MB 5.000 . 5.000 2.091 1.979 2.239 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
836 1 53 ASP HA 1 56 ALA H 5.000 . 5.000 3.231 3.095 3.394 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
837 1 53 ASP H 1 53 ASP QB 2.700 . 2.700 2.304 2.245 2.389 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
838 1 53 ASP QB 1 54 ALA H 3.300 . 3.300 2.596 2.549 2.635 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
839 1 53 ASP QB 1 56 ALA MB 5.000 . 5.000 3.766 3.713 3.855 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
840 1 53 ASP H 1 54 ALA MB 5.000 . 5.000 4.229 4.221 4.245 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
841 1 53 ASP H 1 54 ALA H 2.700 . 2.700 2.615 2.593 2.652 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
842 1 53 ASP H 1 55 GLN HB2 5.000 . 5.000 5.094 5.037 5.107 0.107 21 0 "[ . 1 . 2 . 3 . 4]" 1
843 1 53 ASP H 1 55 GLN H 5.000 . 5.000 3.954 3.920 3.977 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
844 1 54 ALA H 1 54 ALA HA 2.700 . 2.700 2.817 2.807 2.833 0.133 18 0 "[ . 1 . 2 . 3 . 4]" 1
845 1 54 ALA HA 1 55 GLN H 5.000 . 5.000 3.524 3.514 3.533 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
846 1 54 ALA HA 1 56 ALA H 5.000 . 5.000 3.812 3.670 3.904 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
847 1 54 ALA H 1 54 ALA MB 2.700 . 2.700 2.183 2.164 2.199 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
848 1 54 ALA MB 1 55 GLN HA 5.000 . 5.000 3.924 3.893 3.950 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
849 1 54 ALA MB 1 55 GLN QG 5.000 . 5.000 2.995 2.914 3.136 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
850 1 54 ALA MB 1 55 GLN H 5.000 . 5.000 2.576 2.564 2.589 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
851 1 54 ALA MB 1 56 ALA H 5.000 . 5.000 4.172 4.135 4.190 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
852 1 54 ALA H 1 55 GLN H 2.700 . 2.700 2.556 2.510 2.590 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
853 1 54 ALA H 1 56 ALA H 5.000 . 5.000 3.708 3.662 3.773 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
854 1 55 GLN HA 1 55 GLN QE 5.000 . 5.000 4.471 4.455 4.595 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
855 1 55 GLN HA 1 55 GLN QG 3.300 . 3.300 2.321 2.269 2.347 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
856 1 55 GLN HA 1 56 ALA MB 6.000 . 6.000 4.910 4.806 4.957 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
857 1 55 GLN HA 1 56 ALA H 3.300 . 3.300 3.309 3.203 3.360 0.060 29 0 "[ . 1 . 2 . 3 . 4]" 1
858 1 55 GLN HB3 1 56 ALA H 5.000 . 5.000 4.167 4.050 4.315 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
859 1 55 GLN H 1 55 GLN HB2 3.300 . 3.300 2.281 2.265 2.301 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
860 1 55 GLN HB2 1 56 ALA H 5.000 . 5.000 3.501 3.338 3.735 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
861 1 55 GLN H 1 55 GLN QE 5.000 . 5.000 3.212 3.146 3.695 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
862 1 55 GLN H 1 55 GLN QG 5.000 . 5.000 2.603 2.567 2.650 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
863 1 55 GLN QG 1 56 ALA H 5.000 . 5.000 4.384 4.350 4.417 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
864 1 55 GLN H 1 56 ALA HA 5.000 . 5.000 4.900 4.755 4.976 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
865 1 55 GLN H 1 56 ALA MB 5.000 . 5.000 4.031 3.998 4.095 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
866 1 55 GLN H 1 56 ALA H 2.700 . 2.700 2.441 2.359 2.558 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
867 1 56 ALA HA 1 57 PRO QB 5.000 . 5.000 4.693 4.662 4.724 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
868 1 56 ALA HA 1 57 PRO QD 5.000 . 5.000 1.911 1.844 1.967 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
869 1 56 ALA HA 1 57 PRO QG 5.000 . 5.000 3.656 3.472 3.824 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
870 1 56 ALA H 1 56 ALA MB 3.300 . 3.300 2.275 2.212 2.316 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
871 1 56 ALA MB 1 57 PRO QD 5.000 . 5.000 2.254 2.009 2.737 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
872 1 56 ALA MB 1 57 PRO QG 5.000 . 5.000 3.557 3.184 3.794 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
873 1 56 ALA H 1 57 PRO QD 5.000 . 5.000 4.364 4.335 4.382 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
874 1 57 PRO HA 1 58 LYS H 2.700 . 2.700 2.390 2.026 2.954 0.254 5 0 "[ . 1 . 2 . 3 . 4]" 1
875 1 57 PRO QB 1 57 PRO QD 3.300 . 3.300 2.753 2.736 2.773 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
876 1 57 PRO QB 1 58 LYS H 5.000 . 5.000 3.276 2.363 3.933 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
877 1 57 PRO QD 1 58 LYS H 5.000 . 5.000 4.277 3.079 4.752 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
878 1 57 PRO QG 1 58 LYS H 5.000 . 5.000 4.585 4.252 4.834 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
879 1 58 LYS HA 1 58 LYS HB2 2.700 . 2.700 2.989 2.959 2.996 0.296 1 0 "[ . 1 . 2 . 3 . 4]" 1
880 1 58 LYS H 1 58 LYS HB2 3.300 . 3.300 2.680 2.335 3.410 0.110 5 0 "[ . 1 . 2 . 3 . 4]" 1
881 1 58 LYS H 1 58 LYS QD 5.000 . 5.000 4.014 2.342 4.530 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
882 1 58 LYS H 1 58 LYS QG 5.000 . 5.000 2.869 2.016 3.914 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 1135
_Distance_constraint_stats_list.Viol_count 1652
_Distance_constraint_stats_list.Viol_total 8647.109
_Distance_constraint_stats_list.Viol_max 0.451
_Distance_constraint_stats_list.Viol_rms 0.0314
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0048
_Distance_constraint_stats_list.Viol_average_violations_only 0.1309
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 3 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 5 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 6 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 7 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 8 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 9 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 10 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 11 TRP 7.175 0.340 26 0 "[ . 1 . 2 . 3 . 4]"
1 13 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 14 TRP 20.310 0.451 24 0 "[ . 1 . 2 . 3 . 4]"
1 17 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 27 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 28 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 31 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 32 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 34 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 35 ARG 1.862 0.100 3 0 "[ . 1 . 2 . 3 . 4]"
2 1 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
2 2 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
2 3 ASN 5.337 0.206 21 0 "[ . 1 . 2 . 3 . 4]"
2 4 LYS 0.066 0.040 20 0 "[ . 1 . 2 . 3 . 4]"
2 5 PHE 0.303 0.043 18 0 "[ . 1 . 2 . 3 . 4]"
2 6 ASN 0.004 0.004 17 0 "[ . 1 . 2 . 3 . 4]"
2 7 LYS 0.064 0.046 17 0 "[ . 1 . 2 . 3 . 4]"
2 8 GLU 0.405 0.057 21 0 "[ . 1 . 2 . 3 . 4]"
2 9 ARG 15.186 0.293 15 0 "[ . 1 . 2 . 3 . 4]"
2 10 VAL 9.568 0.340 26 0 "[ . 1 . 2 . 3 . 4]"
2 11 ILE 2.263 0.135 10 0 "[ . 1 . 2 . 3 . 4]"
2 12 ALA 13.627 0.420 23 0 "[ . 1 . 2 . 3 . 4]"
2 13 ILE 0.505 0.036 40 0 "[ . 1 . 2 . 3 . 4]"
2 14 GLY 0.505 0.036 40 0 "[ . 1 . 2 . 3 . 4]"
2 15 GLU 15.259 0.275 24 0 "[ . 1 . 2 . 3 . 4]"
2 16 ILE 28.886 0.420 23 0 "[ . 1 . 2 . 3 . 4]"
2 17 MET 1.862 0.100 3 0 "[ . 1 . 2 . 3 . 4]"
2 18 ARG 13.775 0.289 2 0 "[ . 1 . 2 . 3 . 4]"
2 19 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
2 20 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
2 21 ASN 2.126 0.125 30 0 "[ . 1 . 2 . 3 . 4]"
2 22 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
2 23 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
2 24 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
2 25 LEU 17.436 0.293 1 0 "[ . 1 . 2 . 3 . 4]"
2 26 GLN 14.397 0.212 5 0 "[ . 1 . 2 . 3 . 4]"
2 27 VAL 6.050 0.212 5 0 "[ . 1 . 2 . 3 . 4]"
2 28 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
2 29 ALA 9.926 0.278 24 0 "[ . 1 . 2 . 3 . 4]"
2 30 PHE 15.499 0.278 24 0 "[ . 1 . 2 . 3 . 4]"
2 31 ILE 5.060 0.196 35 0 "[ . 1 . 2 . 3 . 4]"
2 32 ASN 4.056 0.266 22 0 "[ . 1 . 2 . 3 . 4]"
2 33 SER 2.716 0.170 3 0 "[ . 1 . 2 . 3 . 4]"
2 34 LEU 2.716 0.170 3 0 "[ . 1 . 2 . 3 . 4]"
2 35 ARG 24.366 0.451 24 0 "[ . 1 . 2 . 3 . 4]"
2 36 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
2 37 ASP 0.818 0.081 12 0 "[ . 1 . 2 . 3 . 4]"
2 38 PRO 0.237 0.043 18 0 "[ . 1 . 2 . 3 . 4]"
2 39 SER 7.683 0.245 10 0 "[ . 1 . 2 . 3 . 4]"
2 40 GLN 6.865 0.245 10 0 "[ . 1 . 2 . 3 . 4]"
2 41 SER 9.424 0.293 15 0 "[ . 1 . 2 . 3 . 4]"
2 42 ALA 2.211 0.087 3 0 "[ . 1 . 2 . 3 . 4]"
2 43 ASN 12.022 0.272 2 0 "[ . 1 . 2 . 3 . 4]"
2 44 LEU 9.811 0.272 2 0 "[ . 1 . 2 . 3 . 4]"
2 45 LEU 0.365 0.200 37 0 "[ . 1 . 2 . 3 . 4]"
2 46 ALA 0.942 0.200 37 0 "[ . 1 . 2 . 3 . 4]"
2 47 GLU 4.976 0.122 13 0 "[ . 1 . 2 . 3 . 4]"
2 48 ALA 1.106 0.036 31 0 "[ . 1 . 2 . 3 . 4]"
2 49 LYS 1.149 0.036 31 0 "[ . 1 . 2 . 3 . 4]"
2 50 LYS 1.551 0.048 5 0 "[ . 1 . 2 . 3 . 4]"
2 51 LEU 5.532 0.154 25 0 "[ . 1 . 2 . 3 . 4]"
2 52 ASN 8.662 0.154 25 0 "[ . 1 . 2 . 3 . 4]"
2 53 ASP 4.682 0.130 37 0 "[ . 1 . 2 . 3 . 4]"
2 54 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
2 55 GLN 14.445 0.288 25 0 "[ . 1 . 2 . 3 . 4]"
2 56 ALA 2.165 0.125 30 0 "[ . 1 . 2 . 3 . 4]"
2 57 PRO 1.318 0.169 12 0 "[ . 1 . 2 . 3 . 4]"
2 58 LYS 15.118 0.293 6 0 "[ . 1 . 2 . 3 . 4]"
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 2 1 VAL QG 2 2 ASP HA 5.000 . 5.000 3.479 3.039 3.881 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
2 2 3 ASN H 2 3 ASN HA 2.700 . 2.700 2.833 2.782 2.906 0.206 21 0 "[ . 1 . 2 . 3 . 4]" 2
3 2 3 ASN HA 2 4 LYS HA 5.000 . 5.000 4.343 4.324 4.367 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
4 2 3 ASN HA 2 4 LYS QG 5.000 . 5.000 4.179 3.710 4.500 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
5 2 3 ASN HA 2 4 LYS H 5.000 . 5.000 2.484 2.256 2.781 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
6 2 3 ASN QB 2 4 LYS QG 5.000 . 5.000 3.409 2.639 4.013 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
7 2 3 ASN QB 2 4 LYS H 5.000 . 5.000 2.740 1.887 3.333 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
8 2 3 ASN QB 2 5 PHE QD 5.000 . 5.000 3.104 2.262 4.031 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
9 2 4 LYS HA 2 4 LYS HB2 2.700 . 2.700 2.507 2.407 2.665 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
10 2 4 LYS HA 2 4 LYS QD 5.000 . 5.000 4.424 3.828 4.495 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
11 2 4 LYS HA 2 4 LYS QE 5.000 . 5.000 4.095 3.772 4.335 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
12 2 4 LYS HA 2 5 PHE QD 5.000 . 5.000 4.619 4.563 4.694 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
13 2 4 LYS HA 2 5 PHE H 3.500 . 3.500 3.371 3.308 3.496 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
14 2 4 LYS HA 2 6 ASN H 5.000 . 5.000 3.264 3.137 3.563 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
15 2 4 LYS HB3 2 4 LYS QE 5.000 . 5.000 3.026 2.107 4.058 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
16 2 4 LYS HB3 2 5 PHE H 5.000 . 5.000 4.205 3.995 4.370 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
17 2 4 LYS HB2 2 4 LYS QD 2.700 . 2.700 2.344 2.195 2.518 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
18 2 4 LYS HB2 2 4 LYS QE 3.500 . 3.500 2.614 1.998 3.174 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
19 2 4 LYS HB2 2 5 PHE H 5.000 . 5.000 3.994 3.224 4.169 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
20 2 4 LYS H 2 4 LYS QD 5.000 . 5.000 4.027 3.443 4.171 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
21 2 4 LYS QD 2 5 PHE QE 5.000 . 5.000 2.506 1.960 2.965 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
22 2 4 LYS QD 2 5 PHE H 5.000 . 5.000 4.261 2.776 4.523 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
23 2 4 LYS H 2 4 LYS QE 5.000 . 5.000 3.781 3.006 4.519 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
24 2 4 LYS QE 2 5 PHE QE 5.000 . 5.000 3.521 2.883 4.050 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
25 2 4 LYS QE 2 5 PHE H 5.000 . 5.000 3.829 2.973 4.711 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
26 2 4 LYS H 2 4 LYS QG 5.000 . 5.000 2.061 1.732 2.262 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
27 2 4 LYS QG 2 5 PHE HA 5.000 . 5.000 3.721 3.168 4.432 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
28 2 4 LYS QG 2 5 PHE QD 5.000 . 5.000 1.965 1.804 2.453 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
29 2 4 LYS QG 2 5 PHE QE 5.000 . 5.000 2.923 2.596 3.698 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
30 2 4 LYS QG 2 5 PHE H 5.000 . 5.000 2.401 1.815 2.818 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
31 2 4 LYS H 2 5 PHE H 2.700 . 2.700 2.611 2.396 2.740 0.040 20 0 "[ . 1 . 2 . 3 . 4]" 2
32 2 5 PHE HA 2 5 PHE QE 5.000 . 5.000 4.391 4.274 4.467 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
33 2 5 PHE HA 2 6 ASN H 5.000 . 5.000 3.229 3.055 3.357 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
34 2 5 PHE HA 2 8 GLU QB 5.000 . 5.000 2.190 1.996 2.516 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
35 2 5 PHE HA 2 8 GLU QG 5.000 . 5.000 2.544 2.126 3.682 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
36 2 5 PHE HA 2 8 GLU H 5.000 . 5.000 2.713 2.488 2.910 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
37 2 5 PHE HB3 2 6 ASN H 5.000 . 5.000 4.263 4.078 4.378 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
38 2 5 PHE HB3 2 38 PRO HA 5.000 . 5.000 4.572 4.184 5.043 0.043 18 0 "[ . 1 . 2 . 3 . 4]" 2
39 2 5 PHE HB3 2 38 PRO QB 5.000 . 5.000 3.507 2.886 4.283 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
40 2 5 PHE HB2 2 5 PHE QE 5.000 . 5.000 4.497 4.477 4.528 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
41 2 5 PHE HB2 2 6 ASN H 5.000 . 5.000 3.856 3.625 4.135 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
42 2 5 PHE HB2 2 38 PRO HA 5.000 . 5.000 4.736 3.911 5.040 0.040 35 0 "[ . 1 . 2 . 3 . 4]" 2
43 2 5 PHE HB2 2 38 PRO QB 5.000 . 5.000 2.818 2.079 3.558 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
44 2 5 PHE H 2 5 PHE QD 5.000 . 5.000 1.985 1.812 2.310 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
45 2 5 PHE QD 2 6 ASN H 5.000 . 5.000 4.520 4.463 4.584 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
46 2 5 PHE QD 2 8 GLU QB 5.000 . 5.000 2.488 2.127 3.124 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
47 2 5 PHE QD 2 8 GLU QG 5.000 . 5.000 3.320 2.802 3.991 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
48 2 5 PHE H 2 6 ASN H 5.000 . 5.000 2.890 2.614 3.229 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
49 2 5 PHE H 2 8 GLU QB 5.000 . 5.000 4.625 4.563 4.702 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
50 2 5 PHE HZ 2 8 GLU QG 5.000 . 5.000 4.528 4.457 4.586 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
51 2 6 ASN HA 2 7 LYS H 5.000 . 5.000 3.532 3.460 3.558 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
52 2 6 ASN HA 2 9 ARG QB 5.000 . 5.000 2.510 2.065 2.932 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
53 2 6 ASN HA 2 9 ARG HE 5.000 . 5.000 3.429 2.102 5.004 0.004 17 0 "[ . 1 . 2 . 3 . 4]" 2
54 2 6 ASN HA 2 9 ARG H 5.000 . 5.000 3.428 3.155 3.903 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
55 2 6 ASN HA 2 10 VAL QG 5.000 . 5.000 3.868 3.810 3.988 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
56 2 6 ASN HA 2 10 VAL H 5.000 . 5.000 4.178 3.687 4.442 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
57 2 6 ASN QB 2 7 LYS H 5.000 . 5.000 2.627 2.348 3.465 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
58 2 6 ASN QD 2 9 ARG H 5.000 . 5.000 4.521 4.266 4.668 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
59 2 6 ASN H 2 7 LYS QB 5.000 . 5.000 4.417 4.279 4.607 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
60 2 6 ASN H 2 7 LYS H 5.000 . 5.000 2.687 2.493 2.785 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
61 2 7 LYS HA 2 8 GLU H 5.000 . 5.000 3.524 3.499 3.543 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
62 2 7 LYS HA 2 9 ARG H 0.000 . 5.000 4.354 4.105 4.842 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
63 2 7 LYS HA 2 10 VAL QG 5.000 . 5.000 2.334 2.123 2.615 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
64 2 7 LYS HA 2 10 VAL H 5.000 . 5.000 3.756 3.493 4.239 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
65 2 7 LYS HA 2 11 ILE H 5.000 . 5.000 4.816 4.537 5.046 0.046 17 0 "[ . 1 . 2 . 3 . 4]" 2
66 2 7 LYS QB 2 8 GLU QG 5.000 . 5.000 3.239 2.959 4.042 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
67 2 7 LYS QB 2 8 GLU H 5.000 . 5.000 2.496 2.316 3.380 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
68 2 7 LYS H 2 7 LYS QG 5.000 . 5.000 3.796 1.983 4.006 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
69 2 7 LYS QG 2 8 GLU HA 5.000 . 5.000 3.477 2.999 3.829 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
70 2 7 LYS QG 2 8 GLU QG 5.000 . 5.000 3.810 2.017 4.093 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
71 2 7 LYS QG 2 8 GLU H 5.000 . 5.000 3.306 1.877 3.641 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
72 2 7 LYS H 2 8 GLU H 2.700 . 2.700 2.540 2.388 2.638 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
73 2 8 GLU HA 2 8 GLU QG 3.500 . 3.500 2.890 2.164 3.059 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
74 2 8 GLU HA 2 9 ARG H 3.500 . 3.500 3.505 3.468 3.538 0.038 30 0 "[ . 1 . 2 . 3 . 4]" 2
75 2 8 GLU HA 2 10 VAL H 5.000 . 5.000 4.491 4.355 4.787 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
76 2 8 GLU HA 2 11 ILE HB 3.500 . 3.500 3.248 2.812 3.557 0.057 21 0 "[ . 1 . 2 . 3 . 4]" 2
77 2 8 GLU HA 2 11 ILE MD 5.000 . 5.000 3.736 3.179 4.240 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
78 2 8 GLU HA 2 11 ILE QG 5.000 . 5.000 2.722 2.030 3.563 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
79 2 8 GLU HA 2 11 ILE H 5.000 . 5.000 3.601 3.303 3.879 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
80 2 8 GLU HA 2 12 ALA H 5.000 . 5.000 4.530 4.342 4.704 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
81 2 8 GLU QB 2 9 ARG H 5.000 . 5.000 2.650 2.412 2.798 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
82 2 8 GLU QB 2 41 SER QB 5.000 . 5.000 3.919 3.521 4.055 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
83 2 8 GLU H 2 8 GLU QG 5.000 . 5.000 2.239 2.025 3.140 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
84 2 8 GLU QG 2 9 ARG H 5.000 . 5.000 4.092 3.918 4.487 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
85 2 8 GLU H 2 9 ARG H 5.000 . 5.000 2.595 2.493 2.670 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
86 2 8 GLU H 2 10 VAL H 5.000 . 5.000 4.291 4.113 4.515 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
87 2 9 ARG HA 2 9 ARG QD 5.000 . 5.000 4.006 3.760 4.171 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
88 2 9 ARG H 2 9 ARG HA 2.700 . 2.700 2.808 2.781 2.840 0.140 29 0 "[ . 1 . 2 . 3 . 4]" 2
89 2 9 ARG HA 2 10 VAL H 5.000 . 5.000 3.565 3.532 3.618 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
90 2 9 ARG HA 2 34 LEU MD2 5.000 . 5.000 3.821 2.655 4.189 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
91 2 9 ARG HA 2 41 SER HA 5.000 . 5.000 4.959 4.469 5.061 0.061 10 0 "[ . 1 . 2 . 3 . 4]" 2
92 2 9 ARG HA 2 41 SER QB 5.000 . 5.000 2.517 2.125 2.793 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
93 2 9 ARG HA 2 41 SER H 5.000 . 5.000 5.223 5.157 5.293 0.293 15 0 "[ . 1 . 2 . 3 . 4]" 2
94 2 9 ARG QB 2 9 ARG HE 5.000 . 5.000 2.406 1.917 2.658 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
95 2 9 ARG QB 2 10 VAL H 5.000 . 5.000 2.480 2.348 2.633 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
96 2 9 ARG QB 2 13 ILE MD 5.000 . 5.000 3.478 3.001 3.716 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
97 2 9 ARG QB 2 38 PRO HA 5.000 . 5.000 3.691 3.357 4.077 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
98 2 9 ARG QD 2 13 ILE MD 5.000 . 5.000 2.703 1.933 3.429 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
99 2 9 ARG H 2 9 ARG HE 5.000 . 5.000 4.836 4.051 5.140 0.140 27 0 "[ . 1 . 2 . 3 . 4]" 2
100 2 9 ARG HE 2 13 ILE MD 5.000 . 5.000 3.235 1.869 4.371 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
101 2 9 ARG H 2 9 ARG QG 5.000 . 5.000 3.922 3.873 3.961 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
102 2 9 ARG QG 2 13 ILE MD 5.000 . 5.000 2.116 1.914 2.534 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
103 2 9 ARG H 2 10 VAL QG 5.000 . 5.000 3.748 3.556 3.838 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
104 2 9 ARG H 2 10 VAL H 5.000 . 5.000 2.660 2.518 2.828 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
105 2 10 VAL HA 2 11 ILE H 5.000 . 5.000 3.521 3.500 3.536 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
106 2 10 VAL HA 2 13 ILE H 5.000 . 5.000 3.402 3.051 3.679 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
107 2 10 VAL H 2 10 VAL HB 3.500 . 3.500 2.948 2.620 3.534 0.034 35 0 "[ . 1 . 2 . 3 . 4]" 2
108 2 10 VAL HB 2 11 ILE H 5.000 . 5.000 3.318 2.535 4.293 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
109 2 10 VAL QG 2 11 ILE HA 5.000 . 5.000 3.418 2.937 3.722 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
110 2 10 VAL QG 2 11 ILE QG 5.000 . 5.000 3.031 2.379 3.415 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
111 2 10 VAL H 2 11 ILE HB 5.000 . 5.000 5.053 5.001 5.135 0.135 10 0 "[ . 1 . 2 . 3 . 4]" 2
112 2 10 VAL H 2 11 ILE QG 0.000 . 5.000 4.099 3.797 4.485 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
113 2 10 VAL H 2 11 ILE H 3.500 . 3.500 2.706 2.636 2.795 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
114 2 10 VAL H 2 12 ALA H 5.000 . 5.000 4.163 4.063 4.383 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
115 2 11 ILE HA 2 12 ALA H 5.000 . 5.000 3.566 3.539 3.604 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
116 2 11 ILE HA 2 14 GLY H 5.000 . 5.000 3.345 3.169 3.492 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
117 2 11 ILE H 2 11 ILE HB 3.500 . 3.500 2.603 2.493 2.726 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
118 2 11 ILE HB 2 12 ALA H 3.500 . 3.500 2.701 2.566 2.805 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
119 2 11 ILE MD 2 11 ILE MG 2.700 . 2.700 1.764 1.678 1.897 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
120 2 11 ILE H 2 11 ILE MD 5.000 . 5.000 3.808 3.359 4.023 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
121 2 11 ILE H 2 11 ILE QG 5.000 . 5.000 2.151 1.949 2.414 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
122 2 11 ILE QG 2 12 ALA H 5.000 . 5.000 3.906 3.692 4.061 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
123 2 11 ILE MG 2 12 ALA HA 5.000 . 5.000 3.757 3.445 4.078 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
124 2 11 ILE MG 2 12 ALA H 5.000 . 5.000 3.664 3.407 3.840 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
125 2 11 ILE H 2 12 ALA MB 5.000 . 5.000 4.249 4.223 4.284 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
126 2 11 ILE H 2 12 ALA H 3.500 . 3.500 2.611 2.553 2.693 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
127 2 11 ILE H 2 13 ILE H 5.000 . 5.000 4.091 3.914 4.213 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
128 2 12 ALA HA 2 13 ILE H 5.000 . 5.000 3.538 3.520 3.554 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
129 2 12 ALA HA 2 14 GLY H 0.000 . 5.000 4.200 3.800 4.421 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
130 2 12 ALA HA 2 15 GLU HB2 3.500 . 3.500 2.683 2.200 3.244 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
131 2 12 ALA HA 2 15 GLU QG 5.000 . 5.000 4.240 3.709 4.505 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
132 2 12 ALA HA 2 15 GLU H 5.000 . 5.000 2.972 2.651 3.076 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
133 2 12 ALA HA 2 16 ILE MD 5.000 . 5.000 4.216 3.981 4.339 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
134 2 12 ALA HA 2 16 ILE QG 5.000 . 5.000 4.057 3.511 4.281 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
135 2 12 ALA HA 2 16 ILE H 3.500 . 3.500 3.841 3.756 3.920 0.420 23 0 "[ . 1 . 2 . 3 . 4]" 2
136 2 12 ALA HA 2 45 LEU QD 5.000 . 5.000 1.898 1.723 1.977 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
137 2 12 ALA MB 2 13 ILE HA 5.000 . 5.000 3.795 3.736 3.848 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
138 2 12 ALA MB 2 13 ILE H 5.000 . 5.000 2.445 2.346 2.587 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
139 2 12 ALA MB 2 16 ILE MD 5.000 . 5.000 3.140 2.780 3.343 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
140 2 12 ALA MB 2 16 ILE H 0.000 . 5.000 4.303 4.272 4.355 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
141 2 12 ALA MB 2 34 LEU MD2 5.000 . 5.000 2.575 2.024 2.839 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
142 2 12 ALA MB 2 45 LEU H 5.000 . 5.000 4.161 3.955 4.305 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
143 2 12 ALA H 2 13 ILE H 3.500 . 3.500 2.593 2.519 2.674 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
144 2 12 ALA H 2 34 LEU MD1 5.000 . 5.000 4.322 4.249 4.412 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
145 2 12 ALA H 2 45 LEU QD 5.000 . 5.000 3.796 3.734 4.015 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
146 2 13 ILE HA 2 14 GLY H 3.500 . 3.500 3.508 3.461 3.536 0.036 40 0 "[ . 1 . 2 . 3 . 4]" 2
147 2 13 ILE HA 2 16 ILE HB 5.000 . 5.000 3.541 3.078 4.054 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
148 2 13 ILE HA 2 16 ILE MD 5.000 . 5.000 3.716 3.309 4.078 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
149 2 13 ILE HA 2 16 ILE H 5.000 . 5.000 3.510 3.276 3.747 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
150 2 13 ILE H 2 13 ILE HB 3.500 . 3.500 2.534 2.493 2.578 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
151 2 13 ILE HB 2 14 GLY H 5.000 . 5.000 2.525 2.346 2.703 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
152 2 13 ILE H 2 13 ILE MD 5.000 . 5.000 3.268 3.161 3.444 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
153 2 13 ILE MD 2 14 GLY H 5.000 . 5.000 4.247 4.117 4.330 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
154 2 13 ILE MD 2 31 ILE MG 5.000 . 5.000 3.120 2.829 3.493 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
155 2 13 ILE H 2 13 ILE QG 5.000 . 5.000 2.002 1.852 2.242 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
156 2 13 ILE QG 2 14 GLY H 5.000 . 5.000 3.905 3.819 4.042 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
157 2 13 ILE QG 2 34 LEU MD1 5.000 . 5.000 1.630 1.603 1.690 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
158 2 13 ILE MG 2 14 GLY QA 5.000 . 5.000 3.576 3.374 3.729 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
159 2 13 ILE MG 2 14 GLY H 5.000 . 5.000 3.519 3.341 3.740 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
160 2 13 ILE MG 2 17 MET QG 5.000 . 5.000 2.653 2.243 3.062 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
161 2 13 ILE MG 2 31 ILE MG 5.000 . 5.000 2.700 2.170 2.998 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
162 2 13 ILE H 2 14 GLY H 5.000 . 5.000 2.572 2.432 2.651 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
163 2 13 ILE H 2 15 GLU H 5.000 . 5.000 3.978 3.822 4.194 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
164 2 13 ILE H 2 34 LEU MD1 5.000 . 5.000 2.864 2.606 3.050 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
165 2 14 GLY QA 2 15 GLU HB2 5.000 . 5.000 4.492 4.411 4.561 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
166 2 14 GLY QA 2 15 GLU H 5.000 . 5.000 2.716 2.668 2.754 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
167 2 14 GLY QA 2 17 MET H 5.000 . 5.000 3.575 3.189 3.894 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
168 2 14 GLY H 2 15 GLU H 5.000 . 5.000 2.668 2.550 2.762 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
169 2 14 GLY H 2 16 ILE H 5.000 . 5.000 4.179 4.113 4.240 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
170 2 15 GLU HA 2 15 GLU QG 3.500 . 3.500 2.397 2.071 3.071 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
171 2 15 GLU HA 2 16 ILE H 5.000 . 5.000 3.567 3.524 3.605 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
172 2 15 GLU HA 2 17 MET H 0.000 . 5.000 4.541 4.294 4.731 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
173 2 15 GLU HA 2 18 ARG HB3 5.000 . 5.000 3.777 3.553 3.988 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
174 2 15 GLU HA 2 18 ARG HB2 2.700 . 2.700 2.269 2.108 2.471 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
175 2 15 GLU HA 2 18 ARG QD 5.000 . 5.000 4.450 3.551 4.605 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
176 2 15 GLU HA 2 18 ARG H 5.000 . 5.000 3.154 2.957 3.402 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
177 2 15 GLU HB3 2 15 GLU QG 2.700 . 2.700 2.224 2.174 2.379 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
178 2 15 GLU HB3 2 45 LEU QD 5.000 . 5.000 1.747 1.676 1.855 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
179 2 15 GLU HB2 2 15 GLU QG 2.700 . 2.700 2.438 2.197 2.555 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
180 2 15 GLU H 2 15 GLU HB2 3.500 . 3.500 2.278 2.192 2.375 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
181 2 15 GLU HB2 2 16 ILE H 3.500 . 3.500 3.639 3.523 3.736 0.236 26 0 "[ . 1 . 2 . 3 . 4]" 2
182 2 15 GLU HB2 2 45 LEU QD 5.000 . 5.000 2.480 2.093 2.748 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
183 2 15 GLU H 2 15 GLU QG 5.000 . 5.000 3.980 3.841 4.068 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
184 2 15 GLU QG 2 16 ILE H 5.000 . 5.000 4.018 3.821 4.491 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
185 2 15 GLU QG 2 45 LEU QD 5.000 . 5.000 2.071 1.791 2.798 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
186 2 15 GLU QG 2 49 LYS QB 5.000 . 5.000 4.198 3.883 4.308 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
187 2 15 GLU H 2 16 ILE HA 5.000 . 5.000 5.242 5.184 5.275 0.275 24 0 "[ . 1 . 2 . 3 . 4]" 2
188 2 15 GLU H 2 16 ILE MD 0.000 . 6.000 4.809 4.563 5.164 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
189 2 15 GLU H 2 16 ILE H 3.500 . 3.500 2.618 2.528 2.676 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
190 2 15 GLU H 2 17 MET H 5.000 . 5.000 4.193 4.030 4.285 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
191 2 15 GLU H 2 45 LEU QD 5.000 . 5.000 3.452 3.181 3.641 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
192 2 16 ILE HA 2 17 MET H 5.000 . 5.000 3.504 3.487 3.521 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
193 2 16 ILE HA 2 18 ARG H 5.000 . 5.000 4.188 3.922 4.311 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
194 2 16 ILE HA 2 19 LEU MD2 5.000 . 5.000 4.362 4.196 4.440 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
195 2 16 ILE HA 2 19 LEU HG 5.000 . 5.000 3.035 2.816 3.149 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
196 2 16 ILE HA 2 19 LEU H 5.000 . 5.000 3.528 3.259 3.670 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
197 2 16 ILE HA 2 48 ALA MB 5.000 . 5.000 2.891 2.745 2.988 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
198 2 16 ILE H 2 16 ILE HB 3.500 . 3.500 2.990 2.838 3.164 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
199 2 16 ILE HB 2 17 MET H 5.000 . 5.000 2.245 2.150 2.389 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
200 2 16 ILE H 2 16 ILE MD 5.000 . 5.000 2.944 2.662 3.486 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
201 2 16 ILE MD 2 17 MET H 5.000 . 5.000 4.385 4.320 4.547 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
202 2 16 ILE MD 2 22 LEU MD1 5.000 . 5.000 3.172 3.091 3.394 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
203 2 16 ILE MD 2 27 VAL HA 5.000 . 5.000 3.941 3.587 4.099 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
204 2 16 ILE MD 2 30 PHE HA 5.000 . 5.000 4.042 3.827 4.145 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
205 2 16 ILE MD 2 30 PHE HB3 5.000 . 5.000 1.902 1.832 1.945 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
206 2 16 ILE MD 2 30 PHE HB2 5.000 . 5.000 2.277 2.100 2.383 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
207 2 16 ILE MD 2 30 PHE QD 5.000 . 5.000 3.056 2.971 3.203 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
208 2 16 ILE MD 2 30 PHE H 5.000 . 5.000 4.344 4.192 4.424 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
209 2 16 ILE MD 2 31 ILE H 5.000 . 5.000 4.144 3.688 4.289 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
210 2 16 ILE MD 2 34 LEU MD1 5.000 . 5.000 3.245 2.351 3.513 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
211 2 16 ILE MD 2 34 LEU MD2 5.000 . 5.000 3.146 2.742 3.509 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
212 2 16 ILE MD 2 44 LEU MD2 5.000 . 5.000 2.495 2.135 2.728 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
213 2 16 ILE MD 2 45 LEU HA 5.000 . 5.000 2.011 1.908 2.113 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
214 2 16 ILE MD 2 45 LEU QB 5.000 . 5.000 2.530 2.331 2.947 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
215 2 16 ILE MD 2 45 LEU QD 5.000 . 5.000 2.157 1.850 2.788 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
216 2 16 ILE MD 2 45 LEU H 5.000 . 5.000 3.914 3.765 4.181 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
217 2 16 ILE MD 2 48 ALA HA 5.000 . 5.000 4.071 3.958 4.183 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
218 2 16 ILE MD 2 48 ALA MB 5.000 . 5.000 1.903 1.826 1.968 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
219 2 16 ILE MD 2 48 ALA H 5.000 . 5.000 3.817 3.720 3.890 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
220 2 16 ILE MD 2 49 LYS H 5.000 . 5.000 4.227 4.128 4.359 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
221 2 16 ILE H 2 16 ILE QG 5.000 . 5.000 1.866 1.742 2.032 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
222 2 16 ILE QG 2 34 LEU MD1 5.000 . 5.000 2.925 2.286 3.622 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
223 2 16 ILE QG 2 45 LEU QD 5.000 . 5.000 2.820 1.916 3.358 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
224 2 16 ILE QG 2 48 ALA MB 5.000 . 5.000 3.532 3.027 3.691 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
225 2 16 ILE MG 2 17 MET H 5.000 . 5.000 3.625 3.536 3.803 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
226 2 16 ILE MG 2 19 LEU HB2 5.000 . 5.000 3.743 3.575 3.865 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
227 2 16 ILE MG 2 22 LEU MD1 5.000 . 5.000 1.868 1.753 1.964 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
228 2 16 ILE MG 2 27 VAL HA 5.000 . 5.000 1.934 1.833 2.168 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
229 2 16 ILE MG 2 27 VAL H 5.000 . 5.000 4.100 4.004 4.259 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
230 2 16 ILE MG 2 30 PHE HB3 5.000 . 5.000 3.036 2.832 3.121 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
231 2 16 ILE MG 2 30 PHE HB2 5.000 . 5.000 2.034 1.920 2.232 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
232 2 16 ILE MG 2 30 PHE QD 5.000 . 5.000 2.189 2.072 2.325 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
233 2 16 ILE MG 2 30 PHE QE 5.000 . 5.000 3.789 3.747 3.840 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
234 2 16 ILE MG 2 30 PHE H 5.000 . 5.000 3.640 3.445 3.981 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
235 2 16 ILE MG 2 45 LEU HA 5.000 . 5.000 4.110 3.822 4.246 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
236 2 16 ILE MG 2 48 ALA MB 5.000 . 5.000 1.971 1.780 2.108 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
237 2 16 ILE H 2 17 MET H 3.500 . 3.500 2.707 2.618 2.780 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
238 2 16 ILE H 2 18 ARG H 5.000 . 5.000 3.892 3.776 4.030 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
239 2 16 ILE H 2 45 LEU QD 5.000 . 5.000 2.851 2.700 3.194 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
240 2 17 MET HA 2 17 MET ME 5.000 . 5.000 3.106 2.881 3.287 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
241 2 17 MET HA 2 18 ARG H 5.000 . 5.000 3.527 3.479 3.551 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
242 2 17 MET HA 2 19 LEU H 5.000 . 5.000 4.310 4.225 4.464 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
243 2 17 MET QB 2 18 ARG H 5.000 . 5.000 2.810 2.681 2.971 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
244 2 17 MET H 2 17 MET ME 5.000 . 5.000 4.342 4.287 4.399 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
245 2 17 MET ME 2 31 ILE MD 5.000 . 5.000 3.632 3.578 3.693 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
246 2 17 MET H 2 17 MET QG 5.000 . 5.000 1.820 1.717 1.998 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
247 2 17 MET QG 2 27 VAL MG1 5.000 . 5.000 2.885 2.440 3.248 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
248 2 17 MET H 2 18 ARG H 5.000 . 5.000 2.701 2.655 2.779 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
249 2 17 MET H 2 19 LEU H 5.000 . 5.000 4.221 4.085 4.324 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
250 2 18 ARG HA 2 18 ARG HB2 2.700 . 2.700 2.969 2.904 2.989 0.289 2 0 "[ . 1 . 2 . 3 . 4]" 2
251 2 18 ARG HA 2 18 ARG QD 3.500 . 3.500 2.830 1.995 3.407 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
252 2 18 ARG HA 2 18 ARG HE 5.000 . 5.000 4.616 2.410 5.172 0.172 3 0 "[ . 1 . 2 . 3 . 4]" 2
253 2 18 ARG HA 2 18 ARG QG 3.500 . 3.500 2.287 1.890 2.814 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
254 2 18 ARG HA 2 19 LEU H 5.000 . 5.000 3.530 3.508 3.571 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
255 2 18 ARG HB3 2 18 ARG HE 5.000 . 5.000 3.100 1.999 4.518 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
256 2 18 ARG H 2 18 ARG HB3 3.500 . 3.500 3.550 3.399 3.591 0.091 2 0 "[ . 1 . 2 . 3 . 4]" 2
257 2 18 ARG HB3 2 19 LEU H 5.000 . 5.000 3.529 3.143 3.655 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
258 2 18 ARG HB2 2 18 ARG QG 2.700 . 2.700 2.180 2.148 2.535 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
259 2 18 ARG H 2 18 ARG HB2 3.500 . 3.500 2.294 2.093 2.408 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
260 2 18 ARG HB2 2 19 LEU H 5.000 . 5.000 2.782 2.620 3.116 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
261 2 18 ARG H 2 18 ARG QD 5.000 . 5.000 4.294 3.116 4.651 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
262 2 18 ARG H 2 18 ARG QG 5.000 . 5.000 2.683 2.400 3.635 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
263 2 18 ARG QG 2 19 LEU H 5.000 . 5.000 4.234 4.103 4.487 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
264 2 18 ARG H 2 19 LEU H 3.500 . 3.500 2.547 2.367 2.619 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
265 2 19 LEU HA 2 19 LEU HG 3.500 . 3.500 2.959 2.800 3.044 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
266 2 19 LEU HA 2 20 PRO QB 5.000 . 5.000 4.702 4.695 4.709 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
267 2 19 LEU HA 2 20 PRO QD 3.500 . 3.500 1.836 1.823 1.858 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
268 2 19 LEU HA 2 20 PRO QG 5.000 . 5.000 3.739 3.726 3.766 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
269 2 19 LEU HA 2 21 ASN H 5.000 . 5.000 3.573 3.401 3.719 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
270 2 19 LEU HA 2 52 ASN QD 5.000 . 5.000 3.792 2.630 4.350 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
271 2 19 LEU HB3 2 20 PRO QD 5.000 . 5.000 3.467 3.363 3.568 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
272 2 19 LEU HB3 2 21 ASN H 5.000 . 5.000 2.930 2.677 3.159 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
273 2 19 LEU HB3 2 22 LEU MD1 5.000 . 5.000 3.327 3.156 3.477 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
274 2 19 LEU HB3 2 22 LEU HG 5.000 . 5.000 2.131 1.951 2.361 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
275 2 19 LEU HB3 2 22 LEU H 5.000 . 5.000 2.912 2.782 3.152 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
276 2 19 LEU HB3 2 52 ASN QB 5.000 . 5.000 1.914 1.859 1.982 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
277 2 19 LEU HB3 2 52 ASN H 5.000 . 5.000 4.562 4.469 4.702 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
278 2 19 LEU HB2 2 19 LEU MD2 3.500 . 3.500 3.162 3.153 3.173 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
279 2 19 LEU MD1 2 22 LEU H 5.000 . 5.000 4.274 4.172 4.310 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
280 2 19 LEU MD1 2 49 LYS QG 5.000 . 5.000 2.441 2.013 3.715 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
281 2 19 LEU MD1 2 49 LYS H 5.000 . 5.000 2.873 2.645 2.992 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
282 2 19 LEU MD1 2 50 LYS H 0.000 . 6.000 4.236 4.136 4.290 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
283 2 19 LEU MD1 2 52 ASN HA 5.000 . 5.000 4.023 3.737 4.162 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
284 2 19 LEU MD1 2 52 ASN QB 5.000 . 5.000 1.901 1.856 2.004 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
285 2 19 LEU MD1 2 53 ASP H 5.000 . 5.000 4.390 4.332 4.438 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
286 2 19 LEU H 2 19 LEU MD2 5.000 . 5.000 3.413 3.277 3.610 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
287 2 19 LEU MD2 2 20 PRO QD 5.000 . 5.000 2.994 2.759 3.244 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
288 2 19 LEU MD2 2 21 ASN H 5.000 . 5.000 4.012 3.781 4.230 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
289 2 19 LEU MD2 2 49 LYS HA 5.000 . 5.000 1.993 1.915 2.096 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
290 2 19 LEU MD2 2 49 LYS QG 5.000 . 5.000 2.633 2.057 3.983 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
291 2 19 LEU MD2 2 50 LYS H 0.000 . 6.000 5.044 4.857 5.137 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
292 2 19 LEU MD2 2 52 ASN QD 5.000 . 5.000 2.713 2.269 2.991 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
293 2 19 LEU MD2 2 52 ASN H 5.000 . 5.000 3.991 3.919 4.123 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
294 2 19 LEU MD2 2 53 ASP H 5.000 . 5.000 4.230 4.193 4.340 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
295 2 19 LEU H 2 19 LEU HG 5.000 . 5.000 2.139 1.975 2.360 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
296 2 19 LEU HG 2 49 LYS HA 5.000 . 5.000 4.017 3.872 4.178 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
297 2 19 LEU H 2 20 PRO QD 5.000 . 5.000 4.065 4.016 4.125 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
298 2 19 LEU H 2 22 LEU MD1 5.000 . 5.000 4.174 4.143 4.193 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
299 2 20 PRO HA 2 21 ASN H 5.000 . 5.000 3.415 3.283 3.471 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
300 2 20 PRO HA 2 22 LEU H 5.000 . 5.000 4.171 4.035 4.415 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
301 2 20 PRO QB 2 20 PRO QD 3.500 . 3.500 2.845 2.830 2.869 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
302 2 20 PRO QB 2 21 ASN H 5.000 . 5.000 3.493 3.348 3.770 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
303 2 20 PRO QD 2 21 ASN H 5.000 . 5.000 2.526 2.273 2.994 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
304 2 20 PRO QD 2 52 ASN QD 5.000 . 5.000 2.761 1.768 3.514 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
305 2 20 PRO QG 2 21 ASN H 5.000 . 5.000 4.011 3.831 4.366 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
306 2 21 ASN HA 2 22 LEU H 5.000 . 5.000 3.474 3.435 3.520 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
307 2 21 ASN HA 2 52 ASN HA 5.000 . 5.000 4.590 4.459 4.788 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
308 2 21 ASN HA 2 56 ALA HA 5.000 . 5.000 5.049 4.850 5.125 0.125 30 0 "[ . 1 . 2 . 3 . 4]" 2
309 2 21 ASN QB 2 22 LEU H 5.000 . 5.000 3.113 2.947 3.232 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
310 2 21 ASN QB 2 52 ASN HA 5.000 . 5.000 1.946 1.896 2.118 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
311 2 21 ASN QB 2 55 GLN HB3 5.000 . 5.000 2.678 2.540 2.973 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
312 2 21 ASN QB 2 55 GLN H 5.000 . 5.000 3.497 3.346 3.612 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
313 2 21 ASN QB 2 56 ALA HA 5.000 . 5.000 3.339 3.142 3.548 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
314 2 21 ASN QB 2 56 ALA MB 5.000 . 5.000 3.540 3.275 3.715 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
315 2 21 ASN QB 2 56 ALA H 5.000 . 5.000 3.459 3.014 3.551 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
316 2 21 ASN H 2 21 ASN QD 5.000 . 5.000 3.604 3.450 3.932 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
317 2 21 ASN QD 2 52 ASN HA 5.000 . 5.000 3.482 3.374 3.850 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
318 2 21 ASN QD 2 53 ASP HA 5.000 . 5.000 3.452 3.193 4.204 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
319 2 21 ASN QD 2 55 GLN H 5.000 . 5.000 4.472 4.432 4.532 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
320 2 21 ASN QD 2 56 ALA HA 5.000 . 5.000 2.498 1.757 3.188 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
321 2 21 ASN QD 2 56 ALA MB 5.000 . 5.000 1.967 1.814 2.096 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
322 2 21 ASN QD 2 56 ALA H 5.000 . 5.000 3.375 3.027 3.452 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
323 2 21 ASN QD 2 57 PRO QD 5.000 . 5.000 2.768 2.524 3.673 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
324 2 21 ASN H 2 22 LEU MD2 5.000 . 5.000 4.305 4.256 4.370 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
325 2 21 ASN H 2 22 LEU HG 5.000 . 5.000 3.847 3.612 3.954 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
326 2 21 ASN H 2 22 LEU H 3.500 . 3.500 2.250 1.970 2.386 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
327 2 21 ASN H 2 52 ASN HA 5.000 . 5.000 3.905 3.794 3.974 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
328 2 21 ASN H 2 52 ASN QD 5.000 . 5.000 3.198 1.437 3.887 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
329 2 22 LEU HA 2 23 ASN H 2.700 . 2.700 2.234 2.142 2.286 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
330 2 22 LEU HA 2 51 LEU QD 0.000 . 6.000 4.457 4.278 4.510 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
331 2 22 LEU HA 2 52 ASN HA 5.000 . 5.000 3.696 3.342 4.089 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
332 2 22 LEU HA 2 55 GLN QE 5.000 . 5.000 1.854 1.727 4.181 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
333 2 22 LEU HB2 2 22 LEU MD1 3.500 . 3.500 2.515 2.465 2.557 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
334 2 22 LEU HB2 2 22 LEU MD2 0.000 . 3.500 3.140 3.127 3.146 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
335 2 22 LEU HB2 2 23 ASN H 5.000 . 5.000 3.718 3.619 3.936 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
336 2 22 LEU H 2 22 LEU MD1 5.000 . 5.000 3.895 3.821 3.985 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
337 2 22 LEU MD1 2 30 PHE QD 5.000 . 5.000 2.193 2.059 2.339 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
338 2 22 LEU MD1 2 48 ALA MB 5.000 . 5.000 1.891 1.835 1.966 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
339 2 22 LEU MD1 2 48 ALA H 5.000 . 5.000 4.374 4.331 4.402 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
340 2 22 LEU MD1 2 52 ASN QB 5.000 . 5.000 3.115 3.044 3.370 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
341 2 22 LEU H 2 22 LEU MD2 5.000 . 5.000 3.012 2.856 3.177 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
342 2 22 LEU MD2 2 23 ASN H 5.000 . 5.000 3.121 2.943 3.227 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
343 2 22 LEU MD2 2 30 PHE QD 5.000 . 5.000 3.917 3.837 3.959 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
344 2 22 LEU MD2 2 30 PHE QE 5.000 . 5.000 2.550 2.362 2.680 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
345 2 22 LEU MD2 2 48 ALA HA 5.000 . 5.000 2.807 2.640 2.928 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
346 2 22 LEU MD2 2 51 LEU HA 5.000 . 5.000 3.828 3.747 3.897 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
347 2 22 LEU MD2 2 51 LEU H 5.000 . 5.000 3.418 3.352 3.461 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
348 2 22 LEU MD2 2 52 ASN HA 5.000 . 5.000 2.020 1.888 2.159 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
349 2 22 LEU MD2 2 52 ASN QB 5.000 . 5.000 2.407 2.283 2.726 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
350 2 22 LEU MD2 2 52 ASN QD 0.000 . 6.000 4.380 3.655 4.608 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
351 2 22 LEU MD2 2 52 ASN H 5.000 . 5.000 2.178 2.075 2.334 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
352 2 22 LEU MD2 2 55 GLN QE 5.000 . 5.000 1.783 1.657 3.302 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
353 2 22 LEU MD2 2 55 GLN H 5.000 . 5.000 4.263 3.847 4.307 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
354 2 22 LEU H 2 22 LEU HG 5.000 . 5.000 2.414 2.322 2.605 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
355 2 22 LEU H 2 23 ASN H 0.000 . 5.000 4.597 4.574 4.608 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
356 2 22 LEU H 2 52 ASN HA 5.000 . 5.000 3.584 3.262 3.746 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
357 2 23 ASN HA 2 24 SER H 5.000 . 5.000 2.373 2.348 2.401 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
358 2 23 ASN HA 2 25 LEU H 5.000 . 5.000 4.295 4.251 4.342 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
359 2 23 ASN HB2 2 24 SER H 5.000 . 5.000 3.681 3.568 4.051 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
360 2 23 ASN HB2 2 25 LEU H 5.000 . 5.000 4.391 4.330 4.625 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
361 2 23 ASN HB3 2 24 SER H 5.000 . 5.000 4.172 3.849 4.266 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
362 2 23 ASN HB3 2 25 LEU H 5.000 . 5.000 4.255 3.653 4.441 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
363 2 23 ASN HB3 2 26 GLN H 3.500 . 3.500 2.739 2.029 2.981 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
364 2 23 ASN H 2 23 ASN QD 5.000 . 5.000 4.236 3.897 4.565 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
365 2 23 ASN QD 2 25 LEU MD1 5.000 . 5.000 3.445 3.179 3.769 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
366 2 23 ASN QD 2 26 GLN HB2 5.000 . 5.000 3.728 2.752 4.730 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
367 2 23 ASN QD 2 26 GLN QG 5.000 . 5.000 2.905 1.732 4.172 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
368 2 23 ASN QD 2 26 GLN H 5.000 . 5.000 2.821 2.213 4.126 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
369 2 23 ASN H 2 26 GLN HA 5.000 . 5.000 4.801 4.701 4.972 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
370 2 23 ASN H 2 26 GLN HB3 5.000 . 5.000 2.925 2.699 3.226 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
371 2 23 ASN H 2 26 GLN HB2 3.500 . 3.500 1.869 1.803 2.036 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
372 2 23 ASN H 2 26 GLN QG 5.000 . 5.000 3.403 2.837 3.530 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
373 2 23 ASN H 2 26 GLN H 5.000 . 5.000 3.661 3.600 3.828 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
374 2 23 ASN H 2 27 VAL H 5.000 . 5.000 3.881 3.751 4.160 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
375 2 23 ASN H 2 55 GLN QE 5.000 . 5.000 3.275 3.022 4.717 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
376 2 24 SER HA 2 24 SER QB 2.700 . 2.700 2.239 2.151 2.427 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
377 2 24 SER HA 2 25 LEU H 5.000 . 5.000 3.518 3.499 3.531 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
378 2 24 SER HA 2 27 VAL HB 3.500 . 3.500 2.688 2.390 3.094 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
379 2 24 SER HA 2 27 VAL MG2 5.000 . 5.000 3.037 2.728 3.426 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
380 2 24 SER HA 2 27 VAL H 5.000 . 5.000 3.568 3.398 3.823 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
381 2 24 SER HA 2 28 VAL MG2 5.000 . 5.000 4.005 3.840 4.145 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
382 2 24 SER HA 2 28 VAL H 5.000 . 5.000 4.216 4.063 4.339 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
383 2 24 SER QB 2 25 LEU H 5.000 . 5.000 3.007 2.419 3.354 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
384 2 24 SER H 2 25 LEU H 5.000 . 5.000 2.656 2.590 2.719 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
385 2 25 LEU HA 2 25 LEU HB3 2.700 . 2.700 2.792 2.714 2.835 0.135 10 0 "[ . 1 . 2 . 3 . 4]" 2
386 2 25 LEU HA 2 25 LEU HG 3.500 . 3.500 2.440 2.248 2.649 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
387 2 25 LEU HA 2 26 GLN H 3.500 . 3.500 3.540 3.497 3.558 0.058 10 0 "[ . 1 . 2 . 3 . 4]" 2
388 2 25 LEU HA 2 28 VAL HB 3.500 . 3.500 2.466 2.322 2.642 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
389 2 25 LEU HA 2 28 VAL MG1 5.000 . 5.000 3.869 3.712 4.009 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
390 2 25 LEU HA 2 28 VAL MG2 5.000 . 5.000 2.444 2.231 2.653 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
391 2 25 LEU HA 2 28 VAL H 5.000 . 5.000 3.205 3.100 3.342 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
392 2 25 LEU HA 2 29 ALA H 5.000 . 5.000 4.081 3.945 4.259 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
393 2 25 LEU HB3 2 25 LEU HG 2.700 . 2.700 2.986 2.972 2.993 0.293 1 0 "[ . 1 . 2 . 3 . 4]" 2
394 2 25 LEU HB2 2 25 LEU MD1 3.500 . 3.500 2.330 2.168 2.392 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
395 2 25 LEU HB2 2 25 LEU MD2 3.500 . 3.500 3.135 3.106 3.149 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
396 2 25 LEU H 2 25 LEU HB2 3.500 . 3.500 2.107 2.085 2.148 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
397 2 25 LEU HB2 2 26 GLN H 3.500 . 3.500 3.193 2.999 3.315 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
398 2 25 LEU H 2 25 LEU MD2 5.000 . 5.000 4.054 3.839 4.192 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
399 2 25 LEU MD2 2 26 GLN H 5.000 . 5.000 4.323 4.252 4.460 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
400 2 25 LEU MD2 2 29 ALA H 5.000 . 5.000 4.006 3.735 4.208 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
401 2 25 LEU H 2 25 LEU HG 3.500 . 3.500 3.415 3.074 3.592 0.092 10 0 "[ . 1 . 2 . 3 . 4]" 2
402 2 25 LEU H 2 26 GLN HB2 5.000 . 5.000 4.487 4.338 4.600 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
403 2 25 LEU H 2 26 GLN H 2.700 . 2.700 2.541 2.471 2.602 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
404 2 25 LEU H 2 27 VAL H 5.000 . 5.000 3.986 3.864 4.177 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
405 2 25 LEU H 2 28 VAL MG2 5.000 . 5.000 4.231 4.188 4.273 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
406 2 26 GLN HA 2 26 GLN QG 3.500 . 3.500 2.271 2.056 2.323 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
407 2 26 GLN H 2 26 GLN HA 2.700 . 2.700 2.838 2.821 2.851 0.151 6 0 "[ . 1 . 2 . 3 . 4]" 2
408 2 26 GLN HA 2 27 VAL H 5.000 . 5.000 3.484 3.457 3.507 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
409 2 26 GLN HA 2 29 ALA MB 3.500 . 3.500 2.113 2.038 2.201 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
410 2 26 GLN HA 2 29 ALA H 5.000 . 5.000 3.230 3.168 3.276 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
411 2 26 GLN HA 2 30 PHE H 5.000 . 5.000 4.391 4.170 4.571 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
412 2 26 GLN H 2 26 GLN HB3 3.500 . 3.500 3.514 3.422 3.560 0.060 20 0 "[ . 1 . 2 . 3 . 4]" 2
413 2 26 GLN HB3 2 27 VAL H 3.500 . 3.500 3.253 2.992 3.415 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
414 2 26 GLN HB3 2 30 PHE QD 5.000 . 5.000 3.539 3.453 3.644 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
415 2 26 GLN HB3 2 30 PHE H 0.000 . 5.000 4.980 4.902 5.037 0.037 24 0 "[ . 1 . 2 . 3 . 4]" 2
416 2 26 GLN H 2 26 GLN HB2 2.700 . 2.700 2.226 2.142 2.305 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
417 2 26 GLN HB2 2 27 VAL MG2 5.000 . 5.000 3.496 3.244 3.665 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
418 2 26 GLN HB2 2 27 VAL H 5.000 . 5.000 2.677 2.507 2.820 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
419 2 26 GLN QE 2 27 VAL MG2 5.000 . 5.000 3.804 3.766 3.861 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
420 2 26 GLN QE 2 51 LEU QD 5.000 . 5.000 2.847 2.300 2.974 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
421 2 26 GLN QE 2 55 GLN QE 5.000 . 5.000 1.484 1.406 2.523 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
422 2 26 GLN H 2 26 GLN QG 5.000 . 5.000 2.814 2.508 3.234 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
423 2 26 GLN QG 2 29 ALA MB 5.000 . 5.000 3.567 3.374 3.735 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
424 2 26 GLN QG 2 30 PHE QE 5.000 . 5.000 3.809 3.494 4.040 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
425 2 26 GLN QG 2 51 LEU QD 5.000 . 5.000 3.396 3.331 3.424 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
426 2 26 GLN H 2 27 VAL HA 5.000 . 5.000 5.151 5.107 5.212 0.212 5 0 "[ . 1 . 2 . 3 . 4]" 2
427 2 26 GLN H 2 27 VAL MG2 5.000 . 5.000 4.217 4.118 4.267 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
428 2 26 GLN H 2 27 VAL H 3.500 . 3.500 2.507 2.447 2.589 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
429 2 27 VAL HA 2 28 VAL H 5.000 . 5.000 3.513 3.496 3.530 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
430 2 27 VAL HA 2 29 ALA H 5.000 . 5.000 4.005 3.953 4.125 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
431 2 27 VAL HA 2 30 PHE HB2 5.000 . 5.000 2.824 2.579 2.940 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
432 2 27 VAL HA 2 30 PHE QD 5.000 . 5.000 2.157 2.064 2.265 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
433 2 27 VAL HA 2 30 PHE H 5.000 . 5.000 3.222 3.157 3.334 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
434 2 27 VAL HA 2 31 ILE MD 5.000 . 5.000 4.295 4.218 4.341 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
435 2 27 VAL HA 2 31 ILE H 5.000 . 5.000 3.947 3.888 4.010 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
436 2 27 VAL HB 2 28 VAL H 3.500 . 3.500 2.635 2.543 2.706 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
437 2 27 VAL MG1 2 31 ILE MD 5.000 . 5.000 1.980 1.908 2.038 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
438 2 27 VAL MG1 2 31 ILE QG 5.000 . 5.000 2.468 2.249 2.797 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
439 2 27 VAL MG2 2 30 PHE HB2 5.000 . 5.000 4.351 4.277 4.413 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
440 2 27 VAL H 2 28 VAL HB 5.000 . 5.000 4.700 4.624 4.745 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
441 2 27 VAL H 2 28 VAL MG2 5.000 . 5.000 4.176 4.108 4.213 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
442 2 27 VAL H 2 28 VAL H 5.000 . 5.000 2.591 2.545 2.632 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
443 2 27 VAL H 2 29 ALA MB 5.000 . 5.000 4.280 4.250 4.325 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
444 2 27 VAL H 2 29 ALA H 5.000 . 5.000 3.714 3.643 3.797 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
445 2 28 VAL HA 2 28 VAL MG1 3.500 . 3.500 2.350 2.311 2.435 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
446 2 28 VAL HA 2 28 VAL MG2 3.500 . 3.500 2.376 2.334 2.411 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
447 2 28 VAL HA 2 29 ALA H 5.000 . 5.000 3.513 3.503 3.520 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
448 2 28 VAL HA 2 30 PHE H 5.000 . 5.000 4.345 4.309 4.387 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
449 2 28 VAL HA 2 31 ILE HB 5.000 . 5.000 2.249 2.189 2.469 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
450 2 28 VAL HA 2 31 ILE MD 5.000 . 5.000 2.097 2.005 2.206 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
451 2 28 VAL HA 2 31 ILE QG 5.000 . 5.000 3.311 3.201 3.402 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
452 2 28 VAL HA 2 31 ILE MG 5.000 . 5.000 3.744 3.676 3.949 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
453 2 28 VAL HA 2 31 ILE H 5.000 . 5.000 3.201 3.137 3.253 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
454 2 28 VAL HA 2 32 ASN H 5.000 . 5.000 3.476 3.366 3.646 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
455 2 28 VAL H 2 28 VAL HB 3.500 . 3.500 2.488 2.438 2.526 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
456 2 28 VAL HB 2 29 ALA H 3.500 . 3.500 2.784 2.737 2.827 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
457 2 28 VAL MG1 2 28 VAL MG2 2.700 . 2.700 1.882 1.874 1.896 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
458 2 28 VAL MG1 2 29 ALA HA 5.000 . 5.000 3.807 3.713 3.850 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
459 2 28 VAL MG1 2 29 ALA H 5.000 . 5.000 3.653 3.599 3.685 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
460 2 28 VAL MG1 2 31 ILE H 5.000 . 5.000 4.454 4.404 4.514 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
461 2 28 VAL MG1 2 32 ASN H 5.000 . 5.000 3.286 3.179 3.504 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
462 2 28 VAL H 2 29 ALA H 3.500 . 3.500 2.546 2.511 2.577 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
463 2 28 VAL H 2 30 PHE H 5.000 . 5.000 4.201 4.115 4.259 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
464 2 29 ALA HA 2 30 PHE H 5.000 . 5.000 3.551 3.515 3.568 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
465 2 29 ALA HA 2 31 ILE H 5.000 . 5.000 4.718 4.593 4.837 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
466 2 29 ALA HA 2 32 ASN QB 3.500 . 3.500 2.893 2.659 3.093 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
467 2 29 ALA HA 2 32 ASN QD 5.000 . 5.000 3.664 2.654 4.373 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
468 2 29 ALA HA 2 32 ASN H 5.000 . 5.000 3.882 3.751 4.009 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
469 2 29 ALA MB 2 30 PHE HA 5.000 . 5.000 3.682 3.619 3.719 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
470 2 29 ALA MB 2 30 PHE QD 5.000 . 5.000 3.625 3.581 3.653 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
471 2 29 ALA MB 2 30 PHE QE 5.000 . 5.000 3.828 3.785 3.891 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
472 2 29 ALA MB 2 30 PHE H 5.000 . 5.000 2.482 2.428 2.513 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
473 2 29 ALA H 2 30 PHE HA 5.000 . 5.000 5.248 5.206 5.278 0.278 24 0 "[ . 1 . 2 . 3 . 4]" 2
474 2 29 ALA H 2 30 PHE HB2 5.000 . 5.000 4.712 4.589 4.781 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
475 2 29 ALA H 2 30 PHE H 3.500 . 3.500 2.663 2.579 2.694 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
476 2 29 ALA H 2 31 ILE H 5.000 . 5.000 4.028 3.905 4.142 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
477 2 29 ALA H 2 32 ASN H 5.000 . 5.000 4.592 4.506 4.662 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
478 2 30 PHE HA 2 30 PHE QD 3.500 . 3.500 2.193 2.028 2.357 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
479 2 30 PHE HA 2 31 ILE H 5.000 . 5.000 3.580 3.559 3.598 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
480 2 30 PHE HA 2 32 ASN H 5.000 . 5.000 4.516 4.304 4.592 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
481 2 30 PHE HA 2 33 SER HB2 3.500 . 3.500 2.447 2.142 3.275 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
482 2 30 PHE HA 2 44 LEU MD1 5.000 . 5.000 4.315 4.154 4.436 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
483 2 30 PHE HA 2 44 LEU MD2 5.000 . 5.000 2.443 2.349 2.579 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
484 2 30 PHE HB3 2 30 PHE QE 5.000 . 5.000 4.549 4.531 4.562 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
485 2 30 PHE H 2 30 PHE HB3 3.500 . 3.500 3.503 3.482 3.521 0.021 37 0 "[ . 1 . 2 . 3 . 4]" 2
486 2 30 PHE HB3 2 31 ILE H 3.500 . 3.500 3.627 3.599 3.696 0.196 35 0 "[ . 1 . 2 . 3 . 4]" 2
487 2 30 PHE HB3 2 34 LEU MD1 5.000 . 5.000 4.152 3.426 4.295 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
488 2 30 PHE HB3 2 44 LEU MD2 5.000 . 5.000 1.897 1.831 1.959 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
489 2 30 PHE H 2 30 PHE HB2 3.500 . 3.500 2.340 2.314 2.366 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
490 2 30 PHE HB2 2 31 ILE H 5.000 . 5.000 2.632 2.571 2.718 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
491 2 30 PHE H 2 30 PHE QD 5.000 . 5.000 2.987 2.872 3.128 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
492 2 30 PHE QD 2 31 ILE H 5.000 . 5.000 4.347 4.228 4.434 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
493 2 30 PHE QD 2 44 LEU HA 5.000 . 5.000 3.545 3.410 3.780 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
494 2 30 PHE QD 2 44 LEU QB 5.000 . 5.000 2.039 1.958 2.148 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
495 2 30 PHE QD 2 44 LEU MD2 5.000 . 5.000 2.255 2.003 2.569 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
496 2 30 PHE QD 2 47 GLU QB 5.000 . 5.000 2.908 2.737 3.050 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
497 2 30 PHE QD 2 47 GLU QG 5.000 . 5.000 4.201 4.107 4.284 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
498 2 30 PHE QD 2 48 ALA HA 5.000 . 5.000 3.529 3.397 3.664 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
499 2 30 PHE QD 2 48 ALA MB 5.000 . 5.000 2.561 2.394 2.685 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
500 2 30 PHE QD 2 48 ALA H 5.000 . 5.000 3.972 3.864 4.167 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
501 2 30 PHE H 2 30 PHE QE 5.000 . 5.000 4.436 4.357 4.507 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
502 2 30 PHE QE 2 44 LEU HA 5.000 . 5.000 3.984 3.825 4.099 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
503 2 30 PHE QE 2 47 GLU QB 5.000 . 5.000 1.966 1.918 2.078 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
504 2 30 PHE QE 2 47 GLU QG 5.000 . 5.000 3.414 3.310 3.559 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
505 2 30 PHE QE 2 48 ALA HA 5.000 . 5.000 2.674 2.488 2.780 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
506 2 30 PHE QE 2 48 ALA MB 5.000 . 5.000 3.170 3.012 3.370 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
507 2 30 PHE QE 2 48 ALA H 5.000 . 5.000 3.868 3.734 4.085 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
508 2 30 PHE QE 2 51 LEU QD 5.000 . 5.000 3.340 3.244 3.372 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
509 2 30 PHE H 2 31 ILE MD 0.000 . 6.900 4.950 4.833 5.027 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
510 2 30 PHE H 2 31 ILE QG 5.000 . 5.000 4.180 4.055 4.311 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
511 2 30 PHE H 2 31 ILE H 3.500 . 3.500 2.579 2.536 2.637 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
512 2 30 PHE H 2 32 ASN H 5.000 . 5.000 4.112 3.947 4.189 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
513 2 30 PHE H 2 44 LEU MD2 5.000 . 5.000 4.347 4.288 4.412 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
514 2 31 ILE HA 2 32 ASN H 5.000 . 5.000 3.535 3.505 3.549 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
515 2 31 ILE HA 2 33 SER H 5.000 . 5.000 4.083 4.010 4.168 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
516 2 31 ILE HA 2 34 LEU QB 5.000 . 5.000 3.218 2.522 3.614 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
517 2 31 ILE HA 2 34 LEU MD1 5.000 . 5.000 2.101 1.941 2.201 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
518 2 31 ILE HA 2 34 LEU H 5.000 . 5.000 3.284 3.045 3.490 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
519 2 31 ILE HA 2 35 ARG H 5.000 . 5.000 4.375 4.101 4.573 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
520 2 31 ILE H 2 31 ILE HB 3.500 . 3.500 2.518 2.441 2.651 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
521 2 31 ILE HB 2 32 ASN H 5.000 . 5.000 2.455 2.390 2.584 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
522 2 31 ILE H 2 31 ILE MD 5.000 . 5.000 3.365 3.303 3.412 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
523 2 31 ILE MD 2 32 ASN H 5.000 . 5.000 4.270 4.141 4.351 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
524 2 31 ILE H 2 31 ILE QG 5.000 . 5.000 2.116 1.966 2.233 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
525 2 31 ILE MG 2 32 ASN HA 5.000 . 5.000 3.443 3.316 3.793 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
526 2 31 ILE MG 2 32 ASN H 5.000 . 5.000 3.316 3.195 3.557 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
527 2 31 ILE MG 2 34 LEU MD1 5.000 . 5.000 2.905 2.562 3.078 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
528 2 31 ILE MG 2 35 ARG H 5.000 . 5.000 4.114 3.958 4.203 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
529 2 31 ILE H 2 32 ASN QB 5.000 . 5.000 4.416 4.262 4.467 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
530 2 31 ILE H 2 32 ASN H 3.500 . 3.500 2.707 2.543 2.767 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
531 2 31 ILE H 2 33 SER H 5.000 . 5.000 3.939 3.780 4.050 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
532 2 31 ILE H 2 34 LEU MD1 5.000 . 5.000 4.176 3.834 4.281 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
533 2 31 ILE H 2 44 LEU MD2 5.000 . 5.000 4.117 4.065 4.158 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
534 2 32 ASN HA 2 33 SER H 5.000 . 5.000 3.545 3.531 3.564 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
535 2 32 ASN HA 2 35 ARG QB 5.000 . 5.000 2.376 2.116 3.201 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
536 2 32 ASN HA 2 35 ARG QD 5.000 . 5.000 2.752 2.503 3.430 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
537 2 32 ASN HA 2 35 ARG HE 5.000 . 5.000 5.098 4.897 5.266 0.266 22 0 "[ . 1 . 2 . 3 . 4]" 2
538 2 32 ASN HA 2 35 ARG QG 5.000 . 5.000 3.878 1.852 4.272 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
539 2 32 ASN HA 2 35 ARG H 5.000 . 5.000 3.373 3.209 3.494 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
540 2 32 ASN HA 2 36 ASP H 5.000 . 5.000 4.196 4.025 4.453 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
541 2 32 ASN H 2 32 ASN QB 3.500 . 3.500 2.212 2.142 2.259 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
542 2 32 ASN QB 2 33 SER H 3.500 . 3.500 2.841 2.761 2.976 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
543 2 32 ASN H 2 32 ASN QD 5.000 . 5.000 4.170 3.237 4.594 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
544 2 32 ASN H 2 33 SER H 5.000 . 5.000 2.709 2.644 2.781 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
545 2 32 ASN H 2 34 LEU H 5.000 . 5.000 4.068 3.932 4.283 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
546 2 33 SER HA 2 34 LEU H 5.000 . 5.000 3.493 3.463 3.516 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
547 2 33 SER HA 2 36 ASP QB 5.000 . 5.000 2.024 1.917 2.207 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
548 2 33 SER HA 2 36 ASP H 5.000 . 5.000 2.788 2.650 3.012 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
549 2 33 SER HA 2 44 LEU MD2 0.000 . 6.000 5.171 5.077 5.261 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
550 2 33 SER HB3 2 34 LEU H 5.000 . 5.000 3.718 3.542 3.815 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
551 2 33 SER HB3 2 44 LEU MD1 5.000 . 5.000 2.614 2.325 2.852 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
552 2 33 SER H 2 33 SER HB2 3.500 . 3.500 2.203 2.104 2.622 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
553 2 33 SER HB2 2 34 LEU H 5.000 . 5.000 3.111 2.513 3.186 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
554 2 33 SER HB2 2 36 ASP QB 5.000 . 5.000 4.567 4.511 4.616 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
555 2 33 SER HB2 2 44 LEU MD2 3.500 . 3.500 3.002 2.709 3.075 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
556 2 33 SER H 2 34 LEU HA 5.000 . 5.000 5.068 5.010 5.170 0.170 3 0 "[ . 1 . 2 . 3 . 4]" 2
557 2 33 SER H 2 34 LEU H 2.700 . 2.700 2.412 2.314 2.531 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
558 2 33 SER H 2 35 ARG H 5.000 . 5.000 3.880 3.746 4.015 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
559 2 33 SER H 2 36 ASP H 5.000 . 5.000 4.364 4.242 4.521 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
560 2 33 SER H 2 44 LEU MD1 5.000 . 5.000 4.499 4.359 4.547 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
561 2 33 SER H 2 44 LEU MD2 5.000 . 5.000 3.923 3.862 4.019 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
562 2 34 LEU HA 2 34 LEU MD2 3.500 . 3.500 2.132 1.936 2.356 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
563 2 34 LEU HA 2 34 LEU HG 3.500 . 3.500 3.290 2.608 3.447 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
564 2 34 LEU HA 2 35 ARG H 5.000 . 5.000 3.486 3.444 3.539 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
565 2 34 LEU HA 2 36 ASP H 5.000 . 5.000 4.390 4.274 4.564 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
566 2 34 LEU HA 2 37 ASP H 5.000 . 5.000 3.317 3.124 3.558 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
567 2 34 LEU HA 2 38 PRO HA 5.000 . 5.000 3.119 2.536 3.621 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
568 2 34 LEU HA 2 44 LEU MD1 5.000 . 5.000 2.535 2.001 3.189 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
569 2 34 LEU H 2 34 LEU QB 3.500 . 3.500 2.656 2.282 2.799 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
570 2 34 LEU QB 2 35 ARG H 5.000 . 5.000 2.432 2.304 2.578 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
571 2 34 LEU H 2 34 LEU MD1 5.000 . 5.000 3.583 3.352 3.737 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
572 2 34 LEU H 2 34 LEU MD2 5.000 . 5.000 2.784 2.436 3.758 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
573 2 34 LEU MD2 2 35 ARG H 5.000 . 5.000 4.281 4.167 4.498 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
574 2 34 LEU MD2 2 38 PRO HA 5.000 . 5.000 3.909 3.384 4.185 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
575 2 34 LEU MD2 2 41 SER HA 5.000 . 5.000 1.775 1.716 1.847 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
576 2 34 LEU MD2 2 41 SER QB 5.000 . 5.000 2.175 1.897 2.669 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
577 2 34 LEU MD2 2 41 SER H 5.000 . 5.000 3.945 3.715 4.089 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
578 2 34 LEU MD2 2 42 ALA H 5.000 . 5.000 4.265 4.176 4.366 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
579 2 34 LEU MD2 2 44 LEU H 5.000 . 5.000 3.952 3.837 4.220 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
580 2 34 LEU MD2 2 45 LEU H 5.000 . 5.000 3.520 3.318 3.816 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
581 2 34 LEU H 2 34 LEU HG 5.000 . 5.000 1.979 1.725 2.438 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
582 2 34 LEU H 2 35 ARG H 3.500 . 3.500 2.396 2.318 2.491 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
583 2 34 LEU H 2 36 ASP H 5.000 . 5.000 3.810 3.714 3.902 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
584 2 34 LEU H 2 44 LEU MD1 5.000 . 5.000 3.376 3.169 3.512 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
585 2 34 LEU H 2 44 LEU MD2 5.000 . 5.000 3.383 3.145 3.738 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
586 2 35 ARG HA 2 35 ARG QD 5.000 . 5.000 3.674 3.523 3.973 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
587 2 35 ARG HA 2 35 ARG HE 5.000 . 5.000 4.544 3.842 4.839 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
588 2 35 ARG HA 2 36 ASP H 5.000 . 5.000 3.530 3.516 3.552 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
589 2 35 ARG HA 2 37 ASP H 5.000 . 5.000 4.390 4.189 4.513 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
590 2 35 ARG QB 2 35 ARG HE 5.000 . 5.000 3.926 3.258 4.095 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
591 2 35 ARG QB 2 36 ASP H 5.000 . 5.000 2.468 2.282 2.536 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
592 2 35 ARG QB 2 37 ASP H 5.000 . 5.000 4.515 4.471 4.579 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
593 2 35 ARG H 2 35 ARG QD 5.000 . 5.000 3.489 2.750 4.299 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
594 2 35 ARG H 2 35 ARG QG 5.000 . 5.000 3.390 2.116 3.849 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
595 2 35 ARG QG 2 36 ASP H 5.000 . 5.000 4.194 3.544 4.370 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
596 2 35 ARG H 2 36 ASP QB 5.000 . 5.000 4.496 4.341 4.561 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
597 2 35 ARG H 2 36 ASP H 5.000 . 5.000 2.659 2.589 2.731 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
598 2 35 ARG H 2 37 ASP H 5.000 . 5.000 3.996 3.906 4.174 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
599 2 35 ARG H 2 44 LEU MD1 0.000 . 6.000 4.965 4.621 5.205 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
600 2 36 ASP HA 2 36 ASP QB 2.700 . 2.700 2.389 2.374 2.408 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
601 2 36 ASP HA 2 37 ASP H 5.000 . 5.000 3.523 3.505 3.539 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
602 2 36 ASP H 2 36 ASP QB 3.500 . 3.500 2.336 2.228 2.412 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
603 2 36 ASP QB 2 37 ASP H 5.000 . 5.000 2.585 2.512 2.672 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
604 2 37 ASP HA 2 38 PRO QB 5.000 . 5.000 4.715 4.686 4.729 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
605 2 37 ASP HA 2 38 PRO QD 3.500 . 3.500 1.968 1.864 2.027 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
606 2 37 ASP HA 2 39 SER H 5.000 . 5.000 3.398 3.269 3.590 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
607 2 37 ASP HB3 2 38 PRO QD 5.000 . 5.000 3.825 3.517 4.019 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
608 2 37 ASP HB3 2 39 SER H 5.000 . 5.000 3.516 2.568 4.146 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
609 2 37 ASP HB2 2 38 PRO QD 5.000 . 5.000 4.333 4.127 4.392 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
610 2 37 ASP HB2 2 39 SER H 5.000 . 5.000 4.696 4.101 5.081 0.081 12 0 "[ . 1 . 2 . 3 . 4]" 2
611 2 37 ASP H 2 38 PRO HA 5.000 . 5.000 4.395 4.289 4.530 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
612 2 37 ASP H 2 38 PRO QD 5.000 . 5.000 3.342 3.185 3.578 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
613 2 38 PRO HA 2 39 SER H 5.000 . 5.000 3.468 3.328 3.533 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
614 2 38 PRO HA 2 40 GLN H 5.000 . 5.000 4.208 3.985 4.451 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
615 2 38 PRO HA 2 41 SER H 5.000 . 5.000 3.417 3.189 3.534 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
616 2 38 PRO QB 2 39 SER HA 5.000 . 5.000 3.925 3.831 4.124 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
617 2 38 PRO QB 2 39 SER H 5.000 . 5.000 3.135 2.886 3.521 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
618 2 38 PRO QB 2 41 SER H 5.000 . 5.000 4.572 4.369 4.668 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
619 2 38 PRO QD 2 39 SER H 5.000 . 5.000 2.421 2.270 2.811 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
620 2 38 PRO QG 2 39 SER H 5.000 . 5.000 3.562 3.324 3.998 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
621 2 39 SER HA 2 40 GLN H 5.000 . 5.000 3.530 3.505 3.560 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
622 2 39 SER HA 2 41 SER H 5.000 . 5.000 3.796 3.673 4.060 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
623 2 39 SER QB 2 40 GLN H 5.000 . 5.000 2.753 2.379 3.454 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
624 2 39 SER H 2 40 GLN HA 5.000 . 5.000 5.172 5.124 5.245 0.245 10 0 "[ . 1 . 2 . 3 . 4]" 2
625 2 39 SER H 2 40 GLN QG 5.000 . 5.000 3.735 3.525 4.275 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
626 2 39 SER H 2 40 GLN H 3.500 . 3.500 2.547 2.470 2.681 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
627 2 39 SER H 2 41 SER H 5.000 . 5.000 3.935 3.791 4.167 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
628 2 40 GLN HA 2 40 GLN QE 5.000 . 5.000 4.176 2.982 4.547 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
629 2 40 GLN HA 2 40 GLN QG 3.500 . 3.500 2.956 2.789 3.246 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
630 2 40 GLN HA 2 41 SER H 5.000 . 5.000 3.018 2.932 3.081 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
631 2 40 GLN HA 2 42 ALA H 5.000 . 5.000 3.222 3.145 3.317 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
632 2 40 GLN HA 2 43 ASN QB 3.500 . 3.500 2.766 2.569 2.908 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
633 2 40 GLN HA 2 43 ASN H 5.000 . 5.000 2.899 2.792 3.015 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
634 2 40 GLN HA 2 44 LEU MD1 5.000 . 5.000 4.403 4.374 4.453 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
635 2 40 GLN HA 2 44 LEU H 5.000 . 5.000 4.851 4.666 4.945 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
636 2 40 GLN H 2 40 GLN HB2 3.500 . 3.500 3.062 2.963 3.126 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
637 2 40 GLN HB2 2 43 ASN QB 5.000 . 5.000 2.448 2.299 2.559 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
638 2 40 GLN HB2 2 44 LEU MD1 5.000 . 5.000 3.028 2.900 3.176 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
639 2 40 GLN HB2 2 44 LEU H 5.000 . 5.000 3.765 3.494 3.931 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
640 2 40 GLN HB3 2 41 SER H 5.000 . 5.000 4.669 4.638 4.693 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
641 2 40 GLN HB3 2 43 ASN HA 5.000 . 5.000 4.543 4.417 4.650 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
642 2 40 GLN HB3 2 43 ASN H 5.000 . 5.000 3.494 3.370 3.611 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
643 2 40 GLN HB3 2 44 LEU MD1 5.000 . 5.000 4.158 4.046 4.206 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
644 2 40 GLN H 2 40 GLN QE 5.000 . 5.000 3.564 1.893 4.550 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
645 2 40 GLN H 2 40 GLN QG 5.000 . 5.000 1.941 1.785 2.355 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
646 2 40 GLN QG 2 41 SER H 5.000 . 5.000 4.219 4.051 4.475 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
647 2 40 GLN QG 2 43 ASN QB 5.000 . 5.000 3.742 3.561 3.870 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
648 2 40 GLN H 2 41 SER HA 5.000 . 5.000 4.567 4.450 4.709 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
649 2 40 GLN H 2 41 SER H 3.500 . 3.500 2.719 2.619 2.831 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
650 2 40 GLN H 2 42 ALA H 5.000 . 5.000 4.807 4.685 4.976 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
651 2 41 SER HA 2 41 SER QB 2.700 . 2.700 2.409 2.331 2.478 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
652 2 41 SER HA 2 42 ALA MB 0.000 . 6.000 4.936 4.916 4.950 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
653 2 41 SER HA 2 42 ALA H 5.000 . 5.000 3.436 3.407 3.457 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
654 2 41 SER HA 2 43 ASN H 5.000 . 5.000 3.998 3.949 4.042 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
655 2 41 SER HA 2 44 LEU QB 5.000 . 5.000 4.809 4.730 4.849 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
656 2 41 SER HA 2 44 LEU MD2 5.000 . 5.000 3.322 3.192 3.595 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
657 2 41 SER HA 2 44 LEU H 5.000 . 5.000 3.837 3.756 3.890 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
658 2 41 SER HA 2 45 LEU H 5.000 . 5.000 4.132 3.971 4.217 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
659 2 41 SER QB 2 42 ALA MB 5.000 . 5.000 3.751 3.719 3.785 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
660 2 41 SER QB 2 42 ALA H 5.000 . 5.000 2.675 2.599 2.718 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
661 2 41 SER H 2 42 ALA MB 5.000 . 5.000 4.191 4.119 4.237 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
662 2 41 SER H 2 42 ALA H 5.000 . 5.000 2.583 2.527 2.621 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
663 2 41 SER H 2 43 ASN H 5.000 . 5.000 3.931 3.862 3.985 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
664 2 42 ALA HA 2 43 ASN HA 5.000 . 5.000 4.850 4.840 4.861 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
665 2 42 ALA HA 2 43 ASN H 5.000 . 5.000 3.479 3.473 3.488 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
666 2 42 ALA HA 2 44 LEU H 5.000 . 5.000 4.893 4.848 4.939 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
667 2 42 ALA HA 2 45 LEU QB 3.500 . 3.500 2.012 1.942 2.111 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
668 2 42 ALA HA 2 45 LEU H 5.000 . 5.000 3.621 3.554 3.714 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
669 2 42 ALA H 2 42 ALA MB 3.500 . 3.500 2.178 2.161 2.193 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
670 2 42 ALA MB 2 43 ASN HA 5.000 . 5.000 3.803 3.794 3.818 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
671 2 42 ALA MB 2 43 ASN QB 5.000 . 5.000 3.795 3.775 3.805 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
672 2 42 ALA MB 2 43 ASN H 5.000 . 5.000 2.752 2.709 2.773 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
673 2 42 ALA MB 2 45 LEU QB 5.000 . 5.000 3.565 3.456 3.653 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
674 2 42 ALA H 2 43 ASN HA 5.000 . 5.000 5.055 5.039 5.087 0.087 3 0 "[ . 1 . 2 . 3 . 4]" 2
675 2 42 ALA H 2 43 ASN QB 5.000 . 5.000 4.091 4.044 4.131 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
676 2 42 ALA H 2 43 ASN H 3.500 . 3.500 2.452 2.429 2.473 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
677 2 42 ALA H 2 44 LEU MD1 5.000 . 5.000 3.887 3.835 4.005 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
678 2 42 ALA H 2 44 LEU H 5.000 . 5.000 4.568 4.519 4.626 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
679 2 43 ASN HA 2 43 ASN QD 3.500 . 3.500 2.911 2.258 3.152 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
680 2 43 ASN HA 2 44 LEU H 5.000 . 5.000 3.558 3.548 3.570 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
681 2 43 ASN HA 2 45 LEU H 5.000 . 5.000 4.202 4.172 4.252 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
682 2 43 ASN HA 2 46 ALA MB 5.000 . 5.000 2.154 2.097 2.237 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
683 2 43 ASN HA 2 46 ALA H 5.000 . 5.000 3.318 3.274 3.387 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
684 2 43 ASN HA 2 47 GLU H 0.000 . 5.000 4.292 4.156 4.389 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
685 2 43 ASN H 2 43 ASN QB 3.500 . 3.500 2.144 2.111 2.166 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
686 2 43 ASN QB 2 44 LEU HA 5.000 . 5.000 3.903 3.800 3.968 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
687 2 43 ASN QB 2 44 LEU MD2 0.000 . 6.000 4.669 4.638 4.760 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
688 2 43 ASN QB 2 44 LEU HG 0.000 . 6.000 5.266 5.205 5.352 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
689 2 43 ASN QB 2 44 LEU H 5.000 . 5.000 2.145 2.078 2.164 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
690 2 43 ASN QB 2 45 LEU H 5.000 . 5.000 4.059 4.007 4.099 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
691 2 43 ASN QB 2 46 ALA MB 5.000 . 5.000 3.940 3.913 3.982 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
692 2 43 ASN QB 2 46 ALA H 5.000 . 5.000 4.467 4.438 4.505 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
693 2 43 ASN H 2 44 LEU HA 0.000 . 5.000 5.245 5.214 5.272 0.272 2 0 "[ . 1 . 2 . 3 . 4]" 2
694 2 43 ASN H 2 44 LEU QB 0.000 . 6.000 5.045 4.978 5.083 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
695 2 43 ASN H 2 44 LEU MD1 5.000 . 5.000 3.235 3.158 3.408 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
696 2 43 ASN H 2 44 LEU H 3.500 . 3.500 2.749 2.723 2.767 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
697 2 43 ASN H 2 45 LEU H 5.000 . 5.000 3.526 3.500 3.563 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
698 2 43 ASN H 2 46 ALA MB 5.000 . 5.000 4.114 4.073 4.166 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
699 2 43 ASN H 2 46 ALA H 5.000 . 5.000 4.117 4.065 4.168 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
700 2 44 LEU HA 2 45 LEU H 5.000 . 5.000 3.409 3.373 3.429 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
701 2 44 LEU HA 2 46 ALA H 5.000 . 5.000 3.733 3.578 3.897 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
702 2 44 LEU HA 2 47 GLU QB 5.000 . 5.000 2.154 2.066 2.236 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
703 2 44 LEU HA 2 47 GLU QG 3.500 . 3.500 1.933 1.884 2.089 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
704 2 44 LEU HA 2 47 GLU H 5.000 . 5.000 2.539 2.352 2.717 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
705 2 44 LEU HA 2 48 ALA H 5.000 . 5.000 3.952 3.883 4.080 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
706 2 44 LEU QB 2 45 LEU H 5.000 . 5.000 3.694 3.659 3.729 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
707 2 44 LEU QB 2 47 GLU QB 5.000 . 5.000 2.995 2.752 3.185 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
708 2 44 LEU QB 2 47 GLU QG 5.000 . 5.000 3.196 2.985 3.355 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
709 2 44 LEU H 2 44 LEU MD1 5.000 . 5.000 1.782 1.707 1.946 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
710 2 44 LEU MD1 2 45 LEU H 5.000 . 5.000 2.477 2.260 2.575 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
711 2 44 LEU MD1 2 46 ALA H 5.000 . 5.000 4.332 4.229 4.426 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
712 2 44 LEU MD2 2 45 LEU HA 5.000 . 5.000 2.596 2.539 2.670 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
713 2 44 LEU MD2 2 45 LEU H 5.000 . 5.000 2.088 2.001 2.238 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
714 2 44 LEU MD2 2 46 ALA H 5.000 . 5.000 3.914 3.881 4.014 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
715 2 44 LEU MD2 2 47 GLU QB 5.000 . 5.000 3.705 3.537 3.794 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
716 2 44 LEU MD2 2 47 GLU QG 0.000 . 6.000 4.504 4.428 4.571 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
717 2 44 LEU H 2 44 LEU HG 5.000 . 5.000 3.811 3.769 3.921 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
718 2 44 LEU H 2 45 LEU H 3.500 . 3.500 2.320 2.288 2.352 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
719 2 44 LEU H 2 46 ALA MB 5.000 . 5.000 4.225 4.214 4.242 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
720 2 44 LEU H 2 46 ALA H 5.000 . 5.000 3.609 3.569 3.660 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
721 2 44 LEU H 2 47 GLU QB 5.000 . 5.000 4.729 4.657 4.780 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
722 2 45 LEU HA 2 46 ALA H 5.000 . 5.000 3.453 3.437 3.473 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
723 2 45 LEU HA 2 47 GLU H 5.000 . 5.000 4.249 4.139 4.387 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
724 2 45 LEU HA 2 48 ALA MB 5.000 . 5.000 2.035 1.951 2.215 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
725 2 45 LEU HA 2 48 ALA H 5.000 . 5.000 3.034 2.877 3.246 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
726 2 45 LEU H 2 45 LEU QB 3.500 . 3.500 2.151 2.045 2.220 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
727 2 45 LEU QB 2 46 ALA H 5.000 . 5.000 2.614 2.449 2.702 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
728 2 45 LEU H 2 45 LEU QD 5.000 . 5.000 3.705 3.473 3.755 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
729 2 45 LEU QD 2 46 ALA HA 5.000 . 5.000 3.635 2.379 3.893 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
730 2 45 LEU QD 2 46 ALA H 5.000 . 5.000 3.552 2.489 3.727 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
731 2 45 LEU QD 2 48 ALA MB 5.000 . 5.000 2.404 2.159 3.176 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
732 2 45 LEU QD 2 48 ALA H 5.000 . 5.000 3.769 3.711 3.933 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
733 2 45 LEU QD 2 49 LYS QE 5.000 . 5.000 2.508 1.762 3.335 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
734 2 45 LEU H 2 45 LEU HG 5.000 . 5.000 4.164 4.048 4.497 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
735 2 45 LEU HG 2 46 ALA HA 5.000 . 5.000 3.489 3.161 5.200 0.200 37 0 "[ . 1 . 2 . 3 . 4]" 2
736 2 45 LEU HG 2 46 ALA H 5.000 . 5.000 3.433 3.142 4.485 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
737 2 45 LEU HG 2 49 LYS QE 5.000 . 5.000 2.514 2.012 4.498 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
738 2 45 LEU H 2 46 ALA MB 5.000 . 5.000 3.839 3.816 3.867 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
739 2 45 LEU H 2 46 ALA H 3.500 . 3.500 2.260 2.237 2.299 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
740 2 45 LEU H 2 48 ALA MB 5.000 . 5.000 4.229 4.206 4.289 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
741 2 45 LEU H 2 48 ALA H 5.000 . 5.000 4.311 4.248 4.365 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
742 2 46 ALA HA 2 47 GLU H 3.500 . 3.500 3.513 3.495 3.526 0.026 37 0 "[ . 1 . 2 . 3 . 4]" 2
743 2 46 ALA HA 2 49 LYS QD 5.000 . 5.000 4.024 2.421 4.592 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
744 2 46 ALA HA 2 49 LYS QG 5.000 . 5.000 3.486 2.020 4.021 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
745 2 46 ALA HA 2 49 LYS H 3.500 . 3.500 3.434 3.339 3.523 0.023 13 0 "[ . 1 . 2 . 3 . 4]" 2
746 2 46 ALA HA 2 50 LYS H 5.000 . 5.000 4.031 3.894 4.237 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
747 2 46 ALA H 2 46 ALA MB 3.500 . 3.500 2.050 2.026 2.071 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
748 2 46 ALA MB 2 47 GLU QG 5.000 . 5.000 3.396 3.319 3.521 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
749 2 46 ALA MB 2 47 GLU H 5.000 . 5.000 2.576 2.537 2.615 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
750 2 46 ALA MB 2 48 ALA H 5.000 . 5.000 4.274 4.242 4.293 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
751 2 46 ALA H 2 47 GLU QB 5.000 . 5.000 4.405 4.381 4.445 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
752 2 46 ALA H 2 47 GLU QG 5.000 . 5.000 4.143 4.109 4.212 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
753 2 46 ALA H 2 47 GLU H 3.500 . 3.500 2.490 2.457 2.527 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
754 2 46 ALA H 2 48 ALA MB 5.000 . 5.000 4.292 4.245 4.317 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
755 2 46 ALA H 2 48 ALA H 5.000 . 5.000 3.680 3.635 3.725 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
756 2 46 ALA H 2 49 LYS H 5.000 . 5.000 4.631 4.556 4.733 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
757 2 47 GLU HA 2 47 GLU QG 3.500 . 3.500 2.962 2.882 3.026 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
758 2 47 GLU H 2 47 GLU HA 2.700 . 2.700 2.811 2.798 2.822 0.122 13 0 "[ . 1 . 2 . 3 . 4]" 2
759 2 47 GLU HA 2 48 ALA H 5.000 . 5.000 3.497 3.486 3.513 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
760 2 47 GLU HA 2 50 LYS QB 3.500 . 3.500 2.316 2.202 2.440 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
761 2 47 GLU HA 2 50 LYS QD 5.000 . 5.000 3.359 2.105 4.103 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
762 2 47 GLU HA 2 50 LYS QE 5.000 . 5.000 2.512 2.000 4.154 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
763 2 47 GLU HA 2 50 LYS H 5.000 . 5.000 3.598 3.521 3.684 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
764 2 47 GLU HA 2 51 LEU H 5.000 . 5.000 3.998 3.937 4.089 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
765 2 47 GLU H 2 47 GLU QB 3.500 . 3.500 2.420 2.394 2.441 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
766 2 47 GLU QB 2 48 ALA HA 5.000 . 5.000 3.874 3.836 3.906 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
767 2 47 GLU QB 2 48 ALA MB 5.000 . 5.000 3.703 3.668 3.740 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
768 2 47 GLU QB 2 48 ALA H 5.000 . 5.000 2.698 2.641 2.776 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
769 2 47 GLU QB 2 50 LYS QB 5.000 . 5.000 3.954 3.794 4.044 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
770 2 47 GLU QB 2 51 LEU H 5.000 . 5.000 4.506 4.436 4.553 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
771 2 47 GLU H 2 47 GLU QG 5.000 . 5.000 2.244 2.192 2.302 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
772 2 47 GLU QG 2 48 ALA H 5.000 . 5.000 4.085 4.035 4.139 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
773 2 47 GLU H 2 48 ALA MB 5.000 . 5.000 4.032 3.966 4.077 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
774 2 47 GLU H 2 48 ALA H 3.500 . 3.500 2.541 2.497 2.595 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
775 2 47 GLU H 2 49 LYS H 5.000 . 5.000 4.304 4.243 4.347 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
776 2 47 GLU H 2 50 LYS H 5.000 . 5.000 4.618 4.513 4.713 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
777 2 48 ALA HA 2 49 LYS H 3.500 . 3.500 3.528 3.512 3.536 0.036 31 0 "[ . 1 . 2 . 3 . 4]" 2
778 2 48 ALA HA 2 50 LYS H 5.000 . 5.000 4.146 4.049 4.260 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
779 2 48 ALA HA 2 51 LEU QB 5.000 . 5.000 2.216 2.163 2.286 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
780 2 48 ALA HA 2 51 LEU QD 5.000 . 5.000 3.768 3.733 3.797 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
781 2 48 ALA HA 2 51 LEU HG 5.000 . 5.000 4.012 3.921 4.125 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
782 2 48 ALA HA 2 51 LEU H 5.000 . 5.000 3.085 3.050 3.130 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
783 2 48 ALA MB 2 49 LYS HA 5.000 . 5.000 3.569 3.520 3.617 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
784 2 48 ALA MB 2 49 LYS QB 5.000 . 5.000 3.855 3.599 3.949 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
785 2 48 ALA MB 2 49 LYS QG 5.000 . 5.000 3.140 2.863 3.814 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
786 2 48 ALA MB 2 49 LYS H 5.000 . 5.000 2.295 2.188 2.397 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
787 2 48 ALA MB 2 50 LYS H 5.000 . 5.000 4.096 4.017 4.157 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
788 2 48 ALA MB 2 51 LEU QB 5.000 . 5.000 3.738 3.706 3.782 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
789 2 48 ALA MB 2 51 LEU H 5.000 . 5.000 4.227 4.200 4.257 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
790 2 48 ALA MB 2 52 ASN H 5.000 . 5.000 4.335 4.315 4.349 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
791 2 48 ALA H 2 49 LYS QB 5.000 . 5.000 4.446 4.252 4.796 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
792 2 48 ALA H 2 49 LYS QG 5.000 . 5.000 4.308 3.610 4.554 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
793 2 48 ALA H 2 49 LYS H 3.500 . 3.500 2.576 2.515 2.618 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
794 2 48 ALA H 2 50 LYS H 5.000 . 5.000 3.660 3.546 3.764 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
795 2 49 LYS HA 2 49 LYS QD 5.000 . 5.000 3.999 3.682 4.482 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
796 2 49 LYS HA 2 49 LYS QE 5.000 . 5.000 4.395 4.230 4.605 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
797 2 49 LYS HA 2 50 LYS H 5.000 . 5.000 3.470 3.444 3.490 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
798 2 49 LYS HA 2 52 ASN QB 5.000 . 5.000 2.307 1.966 2.557 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
799 2 49 LYS HA 2 52 ASN QD 5.000 . 5.000 4.280 3.943 4.615 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
800 2 49 LYS HA 2 52 ASN H 5.000 . 5.000 3.368 3.171 3.524 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
801 2 49 LYS HA 2 53 ASP H 5.000 . 5.000 3.894 3.644 4.106 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
802 2 49 LYS QB 2 49 LYS QD 3.500 . 3.500 2.249 2.051 2.366 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
803 2 49 LYS H 2 49 LYS QB 3.500 . 3.500 2.284 2.207 2.502 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
804 2 49 LYS QB 2 50 LYS H 5.000 . 5.000 2.885 2.632 3.561 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
805 2 49 LYS H 2 49 LYS QD 5.000 . 5.000 4.238 3.348 4.382 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
806 2 49 LYS H 2 49 LYS QE 5.000 . 5.000 3.406 3.104 4.568 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
807 2 49 LYS H 2 49 LYS QG 3.500 . 3.500 2.319 1.908 2.500 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
808 2 49 LYS QG 2 50 LYS H 5.000 . 5.000 3.792 2.207 4.214 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
809 2 49 LYS H 2 50 LYS H 3.500 . 3.500 2.488 2.414 2.553 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
810 2 49 LYS H 2 51 LEU H 0.000 . 5.000 3.906 3.844 3.962 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
811 2 50 LYS HA 2 50 LYS QB 2.700 . 2.700 2.414 2.372 2.432 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
812 2 50 LYS HA 2 50 LYS QD 5.000 . 5.000 3.925 3.804 4.147 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
813 2 50 LYS HA 2 50 LYS QG 3.500 . 3.500 2.271 2.178 2.440 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
814 2 50 LYS HA 2 51 LEU QD 0.000 . 6.000 4.537 4.489 4.570 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
815 2 50 LYS HA 2 51 LEU H 3.500 . 3.500 3.539 3.525 3.548 0.048 5 0 "[ . 1 . 2 . 3 . 4]" 2
816 2 50 LYS HA 2 52 ASN H 5.000 . 5.000 4.390 4.302 4.472 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
817 2 50 LYS HA 2 53 ASP QB 5.000 . 5.000 2.214 2.080 2.374 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
818 2 50 LYS HA 2 53 ASP H 5.000 . 5.000 3.246 3.182 3.325 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
819 2 50 LYS HA 2 54 ALA H 5.000 . 5.000 3.989 3.918 4.165 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
820 2 50 LYS QB 2 50 LYS QD 3.500 . 3.500 2.248 2.109 2.363 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
821 2 50 LYS H 2 50 LYS QB 3.500 . 3.500 2.255 2.202 2.300 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
822 2 50 LYS QB 2 51 LEU QD 5.000 . 5.000 2.880 2.774 2.972 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
823 2 50 LYS QB 2 51 LEU H 5.000 . 5.000 2.589 2.443 2.670 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
824 2 50 LYS QB 2 52 ASN H 5.000 . 5.000 4.563 4.493 4.603 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
825 2 50 LYS QB 2 53 ASP H 5.000 . 5.000 4.584 4.537 4.656 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
826 2 50 LYS H 2 50 LYS QD 5.000 . 5.000 4.239 3.502 4.588 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
827 2 50 LYS H 2 50 LYS QE 5.000 . 5.000 4.104 3.689 4.482 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
828 2 50 LYS H 2 50 LYS QG 5.000 . 5.000 2.870 2.459 3.952 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
829 2 50 LYS QG 2 51 LEU H 5.000 . 5.000 4.135 3.693 4.260 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
830 2 50 LYS H 2 51 LEU QD 0.000 . 6.000 4.250 4.178 4.315 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
831 2 50 LYS H 2 51 LEU H 3.500 . 3.500 2.492 2.434 2.554 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
832 2 50 LYS H 2 52 ASN H 5.000 . 5.000 3.869 3.773 3.963 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
833 2 50 LYS H 2 53 ASP QB 5.000 . 5.000 4.461 4.347 4.561 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
834 2 50 LYS H 2 53 ASP H 5.000 . 5.000 4.300 4.223 4.399 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
835 2 51 LEU HA 2 51 LEU QD 3.500 . 3.500 1.824 1.773 1.863 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
836 2 51 LEU HA 2 52 ASN H 5.000 . 5.000 3.464 3.448 3.473 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
837 2 51 LEU HA 2 53 ASP H 5.000 . 5.000 4.108 4.049 4.197 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
838 2 51 LEU HA 2 54 ALA H 3.500 . 3.500 2.872 2.809 2.912 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
839 2 51 LEU HA 2 55 GLN H 5.000 . 5.000 3.973 3.830 4.067 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
840 2 51 LEU QB 2 51 LEU HG 2.700 . 2.700 2.181 2.178 2.185 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
841 2 51 LEU H 2 51 LEU QB 3.500 . 3.500 2.104 2.094 2.117 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
842 2 51 LEU QB 2 52 ASN H 5.000 . 5.000 2.667 2.650 2.722 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
843 2 51 LEU QB 2 53 ASP H 5.000 . 5.000 4.442 4.414 4.487 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
844 2 51 LEU QB 2 54 ALA MB 5.000 . 5.000 3.730 3.689 3.740 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
845 2 51 LEU H 2 51 LEU QD 5.000 . 5.000 2.477 2.397 2.569 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
846 2 51 LEU QD 2 52 ASN H 5.000 . 5.000 3.770 3.736 3.817 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
847 2 51 LEU QD 2 53 ASP H 0.000 . 6.000 4.593 4.562 4.644 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
848 2 51 LEU QD 2 54 ALA HA 0.000 . 6.000 4.573 4.488 4.589 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
849 2 51 LEU QD 2 54 ALA MB 5.000 . 5.000 2.175 2.017 2.211 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
850 2 51 LEU QD 2 54 ALA H 5.000 . 5.000 3.694 3.648 3.716 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
851 2 51 LEU QD 2 55 GLN QE 5.000 . 5.000 2.678 1.797 2.758 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
852 2 51 LEU QD 2 55 GLN H 5.000 . 5.000 3.753 3.706 3.776 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
853 2 51 LEU H 2 51 LEU HG 5.000 . 5.000 4.183 4.122 4.238 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
854 2 51 LEU HG 2 52 ASN H 5.000 . 5.000 5.100 5.084 5.154 0.154 25 0 "[ . 1 . 2 . 3 . 4]" 2
855 2 51 LEU HG 2 55 GLN QE 5.000 . 5.000 4.303 4.001 4.405 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
856 2 51 LEU H 2 52 ASN QB 5.000 . 5.000 4.117 3.937 4.211 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
857 2 51 LEU H 2 52 ASN H 3.500 . 3.500 2.443 2.387 2.492 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
858 2 51 LEU H 2 53 ASP H 5.000 . 5.000 3.672 3.625 3.713 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
859 2 51 LEU H 2 54 ALA MB 5.000 . 5.000 4.199 4.189 4.247 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
860 2 51 LEU H 2 54 ALA H 0.000 . 5.000 4.206 4.180 4.261 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
861 2 52 ASN HA 2 53 ASP H 5.000 . 5.000 3.477 3.455 3.494 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
862 2 52 ASN HA 2 54 ALA H 5.000 . 5.000 4.186 4.119 4.266 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
863 2 52 ASN HA 2 55 GLN H 5.000 . 5.000 3.351 3.187 3.478 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
864 2 52 ASN HA 2 56 ALA H 5.000 . 5.000 4.326 4.021 4.484 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
865 2 52 ASN QB 2 53 ASP H 5.000 . 5.000 2.509 2.314 2.958 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
866 2 52 ASN H 2 52 ASN QD 5.000 . 5.000 4.315 4.100 4.595 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
867 2 52 ASN QD 2 53 ASP H 5.000 . 5.000 3.485 2.854 4.664 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
868 2 52 ASN H 2 53 ASP HA 5.000 . 5.000 5.117 5.099 5.130 0.130 37 0 "[ . 1 . 2 . 3 . 4]" 2
869 2 52 ASN H 2 53 ASP QB 5.000 . 5.000 4.289 4.185 4.399 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
870 2 52 ASN H 2 53 ASP H 3.500 . 3.500 2.421 2.387 2.445 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
871 2 52 ASN H 2 54 ALA H 5.000 . 5.000 3.693 3.662 3.725 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
872 2 53 ASP HA 2 54 ALA H 5.000 . 5.000 3.495 3.486 3.506 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
873 2 53 ASP HA 2 55 GLN H 5.000 . 5.000 4.322 4.250 4.485 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
874 2 53 ASP HA 2 56 ALA MB 5.000 . 5.000 2.162 2.026 2.345 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
875 2 53 ASP HA 2 56 ALA H 5.000 . 5.000 3.254 3.119 3.526 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
876 2 53 ASP H 2 53 ASP QB 3.500 . 3.500 2.320 2.204 2.407 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
877 2 53 ASP QB 2 54 ALA HA 5.000 . 5.000 3.982 3.872 4.084 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
878 2 53 ASP QB 2 54 ALA MB 5.000 . 5.000 3.781 3.728 3.796 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
879 2 53 ASP QB 2 54 ALA H 5.000 . 5.000 2.652 2.607 2.682 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
880 2 53 ASP H 2 54 ALA MB 5.000 . 5.000 4.111 4.073 4.165 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
881 2 53 ASP H 2 54 ALA H 2.700 . 2.700 2.495 2.455 2.566 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
882 2 53 ASP H 2 55 GLN H 5.000 . 5.000 4.055 4.014 4.146 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
883 2 54 ALA HA 2 55 GLN H 5.000 . 5.000 3.535 3.526 3.561 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
884 2 54 ALA HA 2 56 ALA H 5.000 . 5.000 3.999 3.909 4.093 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
885 2 54 ALA H 2 54 ALA MB 3.500 . 3.500 2.145 2.119 2.166 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
886 2 54 ALA MB 2 55 GLN HA 5.000 . 5.000 3.885 3.798 3.899 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
887 2 54 ALA MB 2 55 GLN QE 5.000 . 5.000 3.351 2.039 3.503 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
888 2 54 ALA MB 2 55 GLN QG 5.000 . 5.000 2.684 2.614 3.717 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
889 2 54 ALA MB 2 55 GLN H 5.000 . 5.000 2.555 2.541 2.573 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
890 2 54 ALA MB 2 56 ALA H 5.000 . 5.000 4.199 4.180 4.227 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
891 2 54 ALA H 2 55 GLN HB2 0.000 . 5.000 4.740 4.690 4.796 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
892 2 54 ALA H 2 55 GLN QG 5.000 . 5.000 4.484 4.472 4.511 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
893 2 54 ALA H 2 55 GLN H 3.500 . 3.500 2.602 2.576 2.631 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
894 2 54 ALA H 2 56 ALA MB 0.000 . 6.000 4.364 4.225 4.407 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
895 2 54 ALA H 2 56 ALA H 5.000 . 5.000 3.693 3.636 3.743 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
896 2 55 GLN HA 2 55 GLN HB2 2.700 . 2.700 2.979 2.977 2.988 0.288 25 0 "[ . 1 . 2 . 3 . 4]" 2
897 2 55 GLN HA 2 55 GLN QE 5.000 . 5.000 4.248 3.185 4.307 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
898 2 55 GLN HA 2 55 GLN QG 3.500 . 3.500 2.398 2.346 3.134 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
899 2 55 GLN HA 2 56 ALA MB 0.000 . 6.000 4.908 4.860 4.970 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
900 2 55 GLN HA 2 56 ALA H 3.500 . 3.500 3.343 3.302 3.431 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
901 2 55 GLN H 2 55 GLN HB3 3.500 . 3.500 3.581 3.567 3.598 0.098 25 0 "[ . 1 . 2 . 3 . 4]" 2
902 2 55 GLN HB2 2 55 GLN QG 2.700 . 2.700 2.464 2.144 2.478 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
903 2 55 GLN HB2 2 56 ALA HA 5.000 . 5.000 4.474 4.187 4.532 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
904 2 55 GLN HB2 2 56 ALA H 5.000 . 5.000 3.347 2.730 3.448 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
905 2 55 GLN H 2 55 GLN QE 5.000 . 5.000 2.623 2.531 2.707 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
906 2 55 GLN QE 2 56 ALA H 5.000 . 5.000 4.498 4.462 4.649 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
907 2 55 GLN H 2 55 GLN QG 5.000 . 5.000 2.539 2.515 2.579 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
908 2 55 GLN QG 2 56 ALA H 5.000 . 5.000 4.294 4.139 4.326 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
909 2 55 GLN H 2 56 ALA HA 5.000 . 5.000 4.817 4.761 5.039 0.039 25 0 "[ . 1 . 2 . 3 . 4]" 2
910 2 55 GLN H 2 56 ALA MB 5.000 . 5.000 4.001 3.890 4.048 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
911 2 55 GLN H 2 56 ALA H 3.500 . 3.500 2.345 2.300 2.390 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
912 2 56 ALA HA 2 57 PRO QB 5.000 . 5.000 4.693 4.659 4.721 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
913 2 56 ALA HA 2 57 PRO QD 2.700 . 2.700 1.934 1.896 1.993 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
914 2 56 ALA HA 2 57 PRO QG 5.000 . 5.000 3.571 3.481 3.637 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
915 2 56 ALA H 2 56 ALA MB 3.500 . 3.500 2.228 2.054 2.271 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
916 2 56 ALA MB 2 57 PRO HA 5.000 . 5.000 4.271 4.226 4.290 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
917 2 56 ALA MB 2 57 PRO QD 5.000 . 5.000 2.013 1.965 2.102 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
918 2 56 ALA MB 2 57 PRO QG 5.000 . 5.000 3.762 3.719 3.782 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
919 2 56 ALA H 2 57 PRO QD 5.000 . 5.000 4.353 4.320 4.370 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
920 2 57 PRO HA 2 58 LYS HA 5.000 . 5.000 4.542 4.357 4.799 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
921 2 57 PRO HA 2 58 LYS QD 5.000 . 5.000 3.822 2.857 4.579 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
922 2 57 PRO HA 2 58 LYS H 2.700 . 2.700 2.588 2.358 2.869 0.169 12 0 "[ . 1 . 2 . 3 . 4]" 2
923 2 57 PRO QB 2 58 LYS H 5.000 . 5.000 2.969 2.291 3.945 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
924 2 57 PRO QD 2 58 LYS H 5.000 . 5.000 4.222 3.328 4.659 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
925 2 57 PRO QG 2 58 LYS H 5.000 . 5.000 4.432 4.195 4.642 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
926 2 58 LYS HA 2 58 LYS HB2 2.700 . 2.700 2.959 2.920 2.993 0.293 6 0 "[ . 1 . 2 . 3 . 4]" 2
927 2 58 LYS H 2 58 LYS HB3 3.500 . 3.500 3.577 3.421 3.691 0.191 24 0 "[ . 1 . 2 . 3 . 4]" 2
928 2 58 LYS H 2 58 LYS HB2 3.500 . 3.500 2.502 2.119 3.145 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
929 2 58 LYS H 2 58 LYS QG 5.000 . 5.000 3.218 1.764 4.015 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
930 1 3 ASN QB 2 11 ILE MD 5.000 . 5.000 3.516 2.556 3.767 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
931 1 3 ASN QB 2 11 ILE MG 5.000 . 5.000 3.597 2.957 3.763 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
932 1 5 PHE QD 2 18 ARG QD 5.000 . 5.000 3.982 3.739 4.065 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
933 1 6 ASN HA 2 14 GLY QA 5.000 . 5.000 3.462 3.191 3.645 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
934 1 6 ASN QB 2 11 ILE HA 5.000 . 5.000 4.454 4.080 4.562 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
935 1 6 ASN QB 2 11 ILE MG 5.000 . 5.000 3.636 3.230 3.795 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
936 1 6 ASN QB 2 14 GLY QA 5.000 . 5.000 4.031 3.752 4.184 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
937 1 6 ASN QD 2 11 ILE MD 5.000 . 5.000 3.740 3.425 3.824 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
938 1 6 ASN QD 2 11 ILE MG 5.000 . 5.000 2.207 1.712 2.915 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
939 1 6 ASN QD 2 15 GLU HA 5.000 . 5.000 3.108 2.697 3.608 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
940 1 6 ASN QD 2 15 GLU QG 5.000 . 5.000 4.015 3.425 4.154 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
941 1 7 LYS HA 2 10 VAL QG 5.000 . 5.000 2.384 1.969 2.809 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
942 1 7 LYS HA 2 11 ILE HA 5.000 . 5.000 2.624 2.121 3.061 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
943 1 7 LYS HA 2 11 ILE MD 5.000 . 5.000 4.019 2.352 4.335 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
944 1 7 LYS HA 2 11 ILE QG 5.000 . 5.000 3.227 2.566 3.838 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
945 1 7 LYS HA 2 11 ILE MG 5.000 . 5.000 3.922 3.580 4.114 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
946 1 7 LYS QB 2 10 VAL QG 5.000 . 5.000 3.322 3.181 3.432 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
947 1 7 LYS QB 2 11 ILE MD 5.000 . 5.000 3.238 2.222 3.708 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
948 1 7 LYS QD 2 10 VAL QG 5.000 . 5.000 2.978 1.727 3.337 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
949 1 7 LYS QD 2 11 ILE MD 5.000 . 5.000 3.325 1.998 3.768 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
950 1 7 LYS QE 2 8 GLU HA 5.000 . 5.000 4.504 4.212 4.591 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
951 1 7 LYS QE 2 10 VAL QG 5.000 . 5.000 3.071 2.024 3.380 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
952 1 7 LYS QE 2 11 ILE MD 5.000 . 5.000 1.927 1.716 2.098 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
953 1 7 LYS QE 2 11 ILE QG 5.000 . 5.000 2.002 1.761 2.632 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
954 1 7 LYS QE 2 11 ILE MG 5.000 . 5.000 3.803 3.624 4.003 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
955 1 7 LYS QG 2 10 VAL QG 5.000 . 5.000 1.817 1.705 2.136 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
956 1 7 LYS QG 2 11 ILE MD 5.000 . 5.000 3.478 1.930 3.804 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
957 1 8 GLU HA 2 10 VAL QG 5.000 . 5.000 3.801 3.747 3.851 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
958 1 9 LEU HA 2 17 MET ME 5.000 . 5.000 4.466 4.391 4.544 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
959 1 9 LEU QD 2 17 MET H 5.000 . 5.000 3.725 3.680 3.769 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
960 1 9 LEU QD 2 18 ARG H 5.000 . 5.000 2.793 2.588 3.011 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
961 1 9 LEU MD1 2 17 MET HA 5.000 . 5.000 4.451 4.393 4.504 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
962 1 9 LEU MD1 2 17 MET QB 5.000 . 5.000 2.392 2.351 2.434 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
963 1 9 LEU MD1 2 17 MET QG 5.000 . 5.000 3.549 3.303 3.713 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
964 1 9 LEU MD2 2 14 GLY QA 5.000 . 5.000 2.650 2.456 3.094 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
965 1 9 LEU MD2 2 17 MET HA 5.000 . 5.000 3.724 3.616 3.822 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
966 1 9 LEU MD2 2 17 MET QB 5.000 . 5.000 1.908 1.822 2.066 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
967 1 9 LEU MD2 2 17 MET ME 5.000 . 5.000 3.568 3.518 3.590 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
968 1 9 LEU MD2 2 17 MET QG 5.000 . 5.000 3.526 3.372 3.733 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
969 1 9 LEU MD2 2 18 ARG HA 5.000 . 5.000 2.731 2.509 2.888 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
970 1 9 LEU MD2 2 18 ARG QB 5.000 . 5.000 3.511 2.991 3.711 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
971 1 9 LEU MD2 2 18 ARG QD 5.000 . 5.000 2.915 1.932 3.438 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
972 1 9 LEU MD2 2 18 ARG QG 5.000 . 5.000 1.973 1.800 2.827 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
973 1 9 LEU HG 2 14 GLY QA 5.000 . 5.000 2.807 2.508 3.114 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
974 1 9 LEU HG 2 17 MET QB 5.000 . 5.000 2.010 1.880 2.110 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
975 1 9 LEU HG 2 17 MET ME 5.000 . 5.000 2.969 2.903 3.033 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
976 1 10 GLY QA 2 10 VAL QG 5.000 . 5.000 3.202 3.031 3.341 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
977 1 10 GLY QA 2 13 ILE HA 5.000 . 5.000 3.876 3.745 3.990 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
978 1 10 GLY QA 2 13 ILE HB 5.000 . 5.000 2.256 2.124 2.429 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
979 1 10 GLY QA 2 13 ILE MG 5.000 . 5.000 1.798 1.763 1.852 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
980 1 10 GLY QA 2 14 GLY QA 5.000 . 5.000 2.127 2.005 2.227 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
981 1 10 GLY QA 2 14 GLY H 5.000 . 5.000 2.130 1.881 2.426 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
982 1 10 GLY H 2 10 VAL QG 5.000 . 5.000 3.834 3.788 3.927 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
983 1 10 GLY H 2 13 ILE MG 5.000 . 5.000 4.353 4.326 4.376 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
984 1 10 GLY H 2 14 GLY QA 5.000 . 5.000 2.452 2.269 2.553 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
985 1 10 GLY H 2 14 GLY H 5.000 . 5.000 3.882 3.602 4.143 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
986 1 11 TRP HA 2 10 VAL HA 5.000 . 5.000 3.830 3.664 4.349 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
987 1 11 TRP HA 2 10 VAL HB 5.000 . 5.000 4.317 2.511 5.340 0.340 26 0 "[ . 1 . 2 . 3 . 4]" 2
988 1 11 TRP HA 2 10 VAL QG 5.000 . 5.000 2.720 2.304 3.389 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
989 1 11 TRP QB 2 10 VAL QG 5.000 . 5.000 2.114 1.904 2.415 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
990 1 11 TRP HD1 2 10 VAL QG 5.000 . 5.000 3.775 3.677 3.901 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
991 1 11 TRP HE1 2 10 VAL QG 5.000 . 5.000 3.872 3.812 3.959 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
992 1 11 TRP HE3 2 10 VAL QG 5.000 . 5.000 2.284 1.957 2.731 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
993 1 11 TRP H 2 10 VAL QG 5.000 . 5.000 2.712 2.423 3.107 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
994 1 11 TRP HZ2 2 10 VAL QG 5.000 . 5.000 3.709 3.560 4.016 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
995 1 11 TRP HZ3 2 10 VAL QG 5.000 . 5.000 2.795 2.585 3.552 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
996 1 11 TRP HZ3 2 13 ILE MG 5.000 . 5.000 4.447 4.305 4.513 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
997 1 13 THR HA 2 13 ILE MG 5.000 . 5.000 4.298 4.254 4.384 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
998 1 13 THR HA 2 17 MET ME 5.000 . 5.000 3.562 3.427 3.744 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
999 1 13 THR HA 2 31 ILE MD 5.000 . 5.000 4.393 4.343 4.485 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1000 1 13 THR HB 2 13 ILE HB 5.000 . 5.000 4.152 4.020 4.502 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1001 1 13 THR HB 2 13 ILE MG 5.000 . 5.000 2.043 1.960 2.282 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1002 1 13 THR HB 2 17 MET ME 5.000 . 5.000 3.676 3.556 3.733 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1003 1 13 THR MG 2 13 ILE HA 5.000 . 5.000 4.077 3.788 4.213 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1004 1 13 THR MG 2 13 ILE HB 5.000 . 5.000 4.165 3.932 4.226 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1005 1 13 THR MG 2 13 ILE MD 5.000 . 5.000 3.535 3.392 3.665 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1006 1 13 THR MG 2 13 ILE MG 5.000 . 5.000 1.857 1.709 1.914 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1007 1 13 THR MG 2 17 MET ME 5.000 . 5.000 2.912 2.657 3.429 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1008 1 13 THR MG 2 17 MET QG 5.000 . 5.000 2.501 2.268 2.892 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1009 1 13 THR MG 2 31 ILE MD 5.000 . 5.000 1.742 1.703 1.788 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1010 1 13 THR MG 2 31 ILE MG 5.000 . 5.000 2.584 2.316 2.771 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1011 1 13 THR H 2 13 ILE MG 5.000 . 5.000 3.740 3.683 3.887 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1012 1 13 THR H 2 17 MET ME 5.000 . 5.000 4.308 4.268 4.358 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1013 1 14 TRP HA 2 13 ILE MD 5.000 . 5.000 3.373 3.148 3.764 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1014 1 14 TRP HA 2 13 ILE MG 5.000 . 5.000 3.391 3.159 3.564 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1015 1 14 TRP HA 2 31 ILE MG 5.000 . 5.000 3.168 3.047 3.296 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1016 1 14 TRP QB 2 10 VAL QG 6.000 . 6.000 3.771 3.574 4.037 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1017 1 14 TRP QB 2 13 ILE MD 5.000 . 5.000 1.825 1.779 1.876 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1018 1 14 TRP QB 2 13 ILE MG 5.000 . 5.000 2.523 2.128 2.762 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1019 1 14 TRP HD1 2 35 ARG HE 5.000 . 5.000 5.112 5.008 5.271 0.271 29 0 "[ . 1 . 2 . 3 . 4]" 2
1020 1 14 TRP HE3 2 13 ILE MD 5.000 . 5.000 1.998 1.823 2.393 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1021 1 14 TRP HE3 2 13 ILE MG 5.000 . 5.000 2.815 2.412 3.093 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1022 1 14 TRP HE3 2 31 ILE MD 5.000 . 5.000 4.278 4.228 4.357 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1023 1 14 TRP HE3 2 31 ILE MG 5.000 . 5.000 1.988 1.938 2.111 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1024 1 14 TRP HE3 2 35 ARG H 5.000 . 5.000 5.395 5.314 5.451 0.451 24 0 "[ . 1 . 2 . 3 . 4]" 2
1025 1 14 TRP HH2 2 13 ILE MD 5.000 . 5.000 4.301 4.210 4.392 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1026 1 14 TRP HH2 2 31 ILE MG 5.000 . 5.000 4.110 3.895 4.235 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1027 1 14 TRP HH2 2 35 ARG HA 5.000 . 5.000 1.984 1.848 2.204 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1028 1 14 TRP HH2 2 35 ARG QB 5.000 . 5.000 2.891 2.450 3.387 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1029 1 14 TRP HH2 2 35 ARG QD 5.000 . 5.000 3.084 2.582 4.134 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1030 1 14 TRP HH2 2 35 ARG QG 5.000 . 5.000 2.210 1.969 2.885 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1031 1 14 TRP HH2 2 35 ARG HE 5.000 . 5.000 3.387 2.971 4.048 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1032 1 14 TRP HH2 2 35 ARG H 5.000 . 5.000 2.574 2.406 2.766 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1033 1 14 TRP H 2 13 ILE MD 5.000 . 5.000 3.419 3.241 3.667 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1034 1 14 TRP H 2 13 ILE MG 5.000 . 5.000 2.718 2.580 2.849 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1035 1 14 TRP HZ2 2 35 ARG HA 5.000 . 5.000 3.140 2.943 3.262 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1036 1 14 TRP HZ2 2 35 ARG QB 5.000 . 5.000 4.396 4.197 4.520 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1037 1 14 TRP HZ2 2 35 ARG QD 5.000 . 5.000 4.048 3.793 4.500 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1038 1 14 TRP HZ2 2 35 ARG QG 5.000 . 5.000 2.521 2.288 3.771 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1039 1 14 TRP HZ3 2 9 ARG QD 5.000 . 5.000 3.232 2.962 3.676 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1040 1 14 TRP HZ3 2 13 ILE MD 5.000 . 5.000 3.177 2.962 3.400 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1041 1 14 TRP HZ3 2 31 ILE MG 5.000 . 5.000 2.246 2.025 2.388 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1042 1 14 TRP HZ3 2 35 ARG HA 5.000 . 5.000 4.257 4.077 4.489 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1043 1 14 TRP HZ3 2 35 ARG QB 5.000 . 5.000 3.735 3.154 4.509 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1044 1 14 TRP HZ3 2 35 ARG QD 5.000 . 5.000 3.355 2.755 4.545 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1045 1 14 TRP HZ3 2 35 ARG QG 5.000 . 5.000 3.834 2.329 4.526 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1046 1 14 TRP HZ3 2 35 ARG HE 5.000 . 5.000 3.769 2.878 4.500 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1047 1 14 TRP HZ3 2 35 ARG H 5.000 . 5.000 2.987 2.903 3.058 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1048 1 17 PHE QB 2 31 ILE MG 5.000 . 5.000 2.853 2.703 3.024 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1049 1 17 PHE QD 2 28 VAL MG1 5.000 . 5.000 3.765 3.737 3.786 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1050 1 17 PHE QD 2 28 VAL MG2 5.000 . 5.000 3.722 3.666 3.761 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1051 1 17 PHE QD 2 31 ILE HB 5.000 . 5.000 3.897 3.729 4.019 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1052 1 17 PHE QD 2 31 ILE MD 5.000 . 5.000 2.683 2.526 2.823 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1053 1 17 PHE QD 2 31 ILE MG 5.000 . 5.000 2.649 2.552 2.817 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1054 1 17 PHE QD 2 35 ARG QD 5.000 . 5.000 2.393 1.947 2.787 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1055 1 17 PHE QD 2 35 ARG HE 5.000 . 5.000 2.620 2.330 3.646 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1056 1 17 PHE QE 2 28 VAL HA 5.000 . 5.000 2.179 2.098 2.277 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1057 1 17 PHE QE 2 28 VAL HB 5.000 . 5.000 4.030 3.997 4.081 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1058 1 17 PHE QE 2 28 VAL MG1 5.000 . 5.000 1.987 1.950 2.018 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1059 1 17 PHE QE 2 28 VAL MG2 5.000 . 5.000 2.493 2.392 2.599 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1060 1 17 PHE QE 2 28 VAL H 5.000 . 5.000 4.609 4.544 4.680 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1061 1 17 PHE QE 2 31 ILE HB 5.000 . 5.000 2.669 2.582 2.730 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1062 1 17 PHE QE 2 31 ILE MD 5.000 . 5.000 2.640 2.514 2.712 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1063 1 17 PHE QE 2 31 ILE MG 5.000 . 5.000 2.843 2.750 3.193 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1064 1 17 PHE QE 2 32 ASN HA 5.000 . 5.000 2.541 2.323 3.172 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1065 1 17 PHE QE 2 32 ASN QB 5.000 . 5.000 3.441 2.901 4.044 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1066 1 17 PHE QE 2 32 ASN H 5.000 . 5.000 3.724 3.597 3.885 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1067 1 17 PHE QE 2 35 ARG QB 5.000 . 5.000 3.587 3.299 4.069 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1068 1 17 PHE QE 2 35 ARG QD 5.000 . 5.000 2.079 2.014 2.182 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1069 1 17 PHE QE 2 35 ARG QG 5.000 . 5.000 3.930 2.403 4.272 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1070 1 17 PHE QE 2 35 ARG HE 5.000 . 5.000 4.073 3.813 4.561 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1071 1 17 PHE HZ 2 28 VAL HA 5.000 . 5.000 3.404 3.213 3.686 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1072 1 17 PHE HZ 2 28 VAL MG1 5.000 . 5.000 1.899 1.850 1.950 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1073 1 17 PHE HZ 2 28 VAL MG2 5.000 . 5.000 4.140 3.960 4.208 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1074 1 17 PHE HZ 2 31 ILE MD 5.000 . 5.000 4.249 4.171 4.436 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1075 1 17 PHE HZ 2 31 ILE HB 5.000 . 5.000 3.081 2.904 3.458 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1076 1 17 PHE HZ 2 31 ILE MG 5.000 . 5.000 3.295 3.159 3.917 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1077 1 17 PHE HZ 2 32 ASN HA 5.000 . 5.000 3.136 2.925 3.380 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1078 1 17 PHE HZ 2 32 ASN QB 5.000 . 5.000 2.489 1.932 3.508 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1079 1 17 PHE HZ 2 32 ASN QD 5.000 . 5.000 3.685 2.296 4.579 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1080 1 17 PHE HZ 2 32 ASN H 5.000 . 5.000 2.873 2.707 3.226 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1081 1 17 PHE HZ 2 35 ARG QD 5.000 . 5.000 4.128 3.987 4.467 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1082 1 27 VAL MG1 2 28 VAL MG2 5.000 . 5.000 3.192 2.917 3.397 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1083 1 28 LYS HA 2 28 VAL MG2 5.000 . 5.000 3.025 2.725 3.195 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1084 1 28 LYS QB 2 28 VAL MG2 5.000 . 5.000 3.527 3.087 3.786 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1085 1 28 LYS QE 2 24 SER QB 5.000 . 5.000 3.124 1.979 4.028 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1086 1 28 LYS QE 2 25 LEU MD1 5.000 . 5.000 2.969 2.357 3.519 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1087 1 28 LYS QE 2 25 LEU MD2 5.000 . 5.000 3.380 1.957 3.744 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1088 1 28 LYS QE 2 25 LEU HG 5.000 . 5.000 2.222 1.938 2.711 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1089 1 28 LYS QG 2 24 SER QB 5.000 . 5.000 2.475 1.908 3.481 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1090 1 28 LYS QG 2 25 LEU MD2 5.000 . 5.000 3.748 3.729 3.804 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1091 1 28 LYS QG 2 28 VAL MG2 5.000 . 5.000 2.429 1.867 3.049 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1092 1 31 ILE HA 2 17 MET ME 5.000 . 5.000 1.844 1.818 1.880 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1093 1 31 ILE HB 2 17 MET ME 5.000 . 5.000 3.767 3.679 3.824 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1094 1 31 ILE HB 2 24 SER QB 5.000 . 5.000 3.784 3.212 4.460 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1095 1 31 ILE HB 2 28 VAL MG2 5.000 . 5.000 3.674 3.360 3.866 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1096 1 31 ILE MD 2 17 MET ME 5.000 . 5.000 3.520 3.495 3.555 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1097 1 31 ILE MD 2 28 VAL HA 5.000 . 5.000 3.142 3.052 3.196 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1098 1 31 ILE MD 2 28 VAL MG1 5.000 . 5.000 3.389 3.269 3.481 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1099 1 31 ILE MD 2 28 VAL MG2 5.000 . 5.000 1.920 1.860 1.987 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1100 1 31 ILE MD 2 31 ILE MG 5.000 . 5.000 3.511 3.362 3.582 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1101 1 31 ILE QG 2 17 MET ME 5.000 . 5.000 2.238 2.041 2.547 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1102 1 31 ILE QG 2 28 VAL MG2 5.000 . 5.000 3.763 3.710 3.815 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1103 1 31 ILE MG 2 17 MET QB 5.000 . 5.000 3.909 3.864 3.953 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1104 1 31 ILE MG 2 17 MET ME 5.000 . 5.000 1.882 1.821 1.927 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1105 1 31 ILE MG 2 24 SER HA 5.000 . 5.000 2.806 2.383 3.275 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1106 1 31 ILE MG 2 24 SER QB 5.000 . 5.000 3.185 2.441 3.724 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1107 1 31 ILE MG 2 27 VAL HB 5.000 . 5.000 2.814 2.585 3.146 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1108 1 31 ILE MG 2 28 VAL MG2 5.000 . 5.000 3.088 2.850 3.238 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1109 1 31 ILE MG 2 31 ILE MD 5.000 . 5.000 2.889 2.488 3.154 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1110 1 31 ILE H 2 17 MET ME 5.000 . 5.000 4.274 4.233 4.321 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1111 1 32 ASP HA 2 17 MET ME 5.000 . 5.000 4.309 4.237 4.372 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1112 1 32 ASP H 2 17 MET ME 5.000 . 5.000 4.387 4.356 4.417 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1113 1 34 LEU HA 2 17 MET ME 5.000 . 5.000 4.019 3.978 4.102 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1114 1 34 LEU HB3 2 17 MET ME 5.000 . 5.000 1.834 1.797 1.888 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1115 1 34 LEU HB2 2 17 MET ME 5.000 . 5.000 2.180 2.126 2.281 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1116 1 34 LEU MD1 2 17 MET ME 5.000 . 5.000 2.194 2.041 2.338 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1117 1 34 LEU MD2 2 17 MET ME 5.000 . 5.000 2.071 1.973 2.171 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1118 1 34 LEU HG 2 17 MET ME 5.000 . 5.000 3.817 3.783 3.877 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1119 1 34 LEU H 2 17 MET ME 5.000 . 5.000 3.630 3.558 3.718 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1120 1 35 ARG HA 2 17 MET ME 5.000 . 5.000 3.571 3.258 3.832 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1121 1 35 ARG QB 2 17 MET ME 5.000 . 5.000 3.760 3.686 3.805 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1122 1 35 ARG QD 2 17 MET HA 5.000 . 5.000 3.803 3.287 4.451 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1123 1 35 ARG QD 2 17 MET ME 5.000 . 5.000 3.376 3.129 3.729 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1124 1 35 ARG QD 2 24 SER HA 5.000 . 5.000 2.862 2.175 3.688 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1125 1 35 ARG QD 2 27 VAL MG1 5.000 . 5.000 3.423 2.945 3.841 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1126 1 35 ARG QD 2 27 VAL MG2 5.000 . 5.000 2.995 2.546 3.870 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1127 1 35 ARG HE 2 17 MET HA 5.000 . 5.000 4.255 2.834 5.100 0.100 3 0 "[ . 1 . 2 . 3 . 4]" 2
1128 1 35 ARG HE 2 27 VAL MG2 5.000 . 5.000 3.107 1.739 4.055 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1129 1 35 ARG QG 2 17 MET ME 5.000 . 5.000 1.901 1.844 1.993 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1130 1 35 ARG QH 2 17 MET ME 5.000 . 5.000 3.412 3.365 3.448 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1131 1 35 ARG QH 2 20 PRO HA 5.000 . 5.000 3.208 2.969 3.441 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1132 1 35 ARG QH 2 22 LEU H 5.000 . 5.000 2.414 2.060 3.035 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1133 1 35 ARG QH 2 23 ASN HA 5.000 . 5.000 3.860 3.466 4.036 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1134 1 35 ARG QH 2 27 VAL MG2 5.000 . 5.000 2.036 1.517 2.397 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
1135 1 35 ARG H 2 17 MET ME 5.000 . 5.000 2.574 2.491 2.723 . 0 0 "[ . 1 . 2 . 3 . 4]" 2
stop_
save_
save_distance_constraint_statistics_3
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 3
_Distance_constraint_stats_list.Constraint_count 38
_Distance_constraint_stats_list.Viol_count 352
_Distance_constraint_stats_list.Viol_total 507.583
_Distance_constraint_stats_list.Viol_max 0.116
_Distance_constraint_stats_list.Viol_rms 0.0197
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0083
_Distance_constraint_stats_list.Viol_average_violations_only 0.0360
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 12 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 13 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 16 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 17 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 23 ASN 2.165 0.116 26 0 "[ . 1 . 2 . 3 . 4]"
1 24 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 25 VAL 0.935 0.057 3 0 "[ . 1 . 2 . 3 . 4]"
1 26 GLN 2.227 0.116 26 0 "[ . 1 . 2 . 3 . 4]"
1 27 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 28 LYS 1.440 0.105 14 0 "[ . 1 . 2 . 3 . 4]"
1 29 ALA 3.193 0.087 28 0 "[ . 1 . 2 . 3 . 4]"
1 30 PHE 0.103 0.041 18 0 "[ . 1 . 2 . 3 . 4]"
1 31 ILE 1.281 0.105 37 0 "[ . 1 . 2 . 3 . 4]"
1 32 ASP 1.440 0.105 14 0 "[ . 1 . 2 . 3 . 4]"
1 33 SER 2.258 0.087 28 0 "[ . 1 . 2 . 3 . 4]"
1 34 LEU 0.041 0.041 18 0 "[ . 1 . 2 . 3 . 4]"
1 35 ARG 1.281 0.105 37 0 "[ . 1 . 2 . 3 . 4]"
1 41 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 42 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 43 ASN 0.878 0.062 10 0 "[ . 1 . 2 . 3 . 4]"
1 44 LEU 1.021 0.050 14 0 "[ . 1 . 2 . 3 . 4]"
1 45 LEU 0.375 0.042 21 0 "[ . 1 . 2 . 3 . 4]"
1 46 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 47 GLU 3.112 0.075 25 0 "[ . 1 . 2 . 3 . 4]"
1 48 ALA 1.021 0.050 14 0 "[ . 1 . 2 . 3 . 4]"
1 49 LYS 0.375 0.042 21 0 "[ . 1 . 2 . 3 . 4]"
1 50 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 51 LEU 2.234 0.075 25 0 "[ . 1 . 2 . 3 . 4]"
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 23 ASN OD1 1 26 GLN H 2.000 . 2.400 1.945 1.740 2.450 0.060 23 0 "[ . 1 . 2 . 3 . 4]" 3
2 1 23 ASN OD1 1 26 GLN N 2.800 2.600 3.200 2.866 2.697 3.316 0.116 26 0 "[ . 1 . 2 . 3 . 4]" 3
3 1 12 ALA O 1 16 ILE H 2.000 . 2.400 1.872 1.809 1.996 . 0 0 "[ . 1 . 2 . 3 . 4]" 3
4 1 12 ALA O 1 16 ILE N 2.800 2.600 3.200 2.786 2.725 2.897 . 0 0 "[ . 1 . 2 . 3 . 4]" 3
5 1 13 THR O 1 17 PHE H 2.000 . 2.400 1.942 1.846 1.989 . 0 0 "[ . 1 . 2 . 3 . 4]" 3
6 1 13 THR O 1 17 PHE N 2.800 2.600 3.200 2.762 2.691 2.872 . 0 0 "[ . 1 . 2 . 3 . 4]" 3
7 1 23 ASN O 1 27 VAL H 2.000 . 2.400 1.950 1.831 2.088 . 0 0 "[ . 1 . 2 . 3 . 4]" 3
8 1 23 ASN O 1 27 VAL N 2.800 2.600 3.200 2.930 2.794 3.071 . 0 0 "[ . 1 . 2 . 3 . 4]" 3
9 1 24 GLY O 1 28 LYS H 2.000 . 2.400 2.074 1.901 2.248 . 0 0 "[ . 1 . 2 . 3 . 4]" 3
10 1 24 GLY O 1 28 LYS N 2.800 2.600 3.200 2.951 2.793 3.082 . 0 0 "[ . 1 . 2 . 3 . 4]" 3
11 1 25 VAL O 1 29 ALA H 2.000 . 2.400 1.786 1.743 1.822 0.057 3 0 "[ . 1 . 2 . 3 . 4]" 3
12 1 25 VAL O 1 29 ALA N 2.800 2.600 3.200 2.599 2.578 2.636 0.022 36 0 "[ . 1 . 2 . 3 . 4]" 3
13 1 26 GLN O 1 30 PHE H 2.000 . 2.400 1.831 1.773 1.890 0.027 3 0 "[ . 1 . 2 . 3 . 4]" 3
14 1 26 GLN O 1 30 PHE N 2.800 2.600 3.200 2.752 2.694 2.805 . 0 0 "[ . 1 . 2 . 3 . 4]" 3
15 1 27 VAL O 1 31 ILE H 2.000 . 2.400 1.903 1.802 2.005 . 0 0 "[ . 1 . 2 . 3 . 4]" 3
16 1 27 VAL O 1 31 ILE N 2.800 2.600 3.200 2.803 2.709 2.897 . 0 0 "[ . 1 . 2 . 3 . 4]" 3
17 1 28 LYS O 1 32 ASP H 2.000 . 2.400 1.766 1.695 1.826 0.105 14 0 "[ . 1 . 2 . 3 . 4]" 3
18 1 28 LYS O 1 32 ASP N 2.800 2.600 3.200 2.661 2.605 2.716 . 0 0 "[ . 1 . 2 . 3 . 4]" 3
19 1 29 ALA O 1 33 SER H 2.000 . 2.400 1.744 1.713 1.776 0.087 28 0 "[ . 1 . 2 . 3 . 4]" 3
20 1 29 ALA O 1 33 SER N 2.800 2.600 3.200 2.656 2.606 2.703 . 0 0 "[ . 1 . 2 . 3 . 4]" 3
21 1 30 PHE O 1 34 LEU H 2.000 . 2.400 1.896 1.759 1.961 0.041 18 0 "[ . 1 . 2 . 3 . 4]" 3
22 1 30 PHE O 1 34 LEU N 2.800 2.600 3.200 2.738 2.622 2.781 . 0 0 "[ . 1 . 2 . 3 . 4]" 3
23 1 31 ILE O 1 35 ARG H 2.000 . 2.400 1.797 1.695 2.060 0.105 37 0 "[ . 1 . 2 . 3 . 4]" 3
24 1 31 ILE O 1 35 ARG N 2.800 2.600 3.200 2.758 2.651 3.020 . 0 0 "[ . 1 . 2 . 3 . 4]" 3
25 1 41 SER O 1 45 LEU H 2.000 . 2.400 1.979 1.893 2.069 . 0 0 "[ . 1 . 2 . 3 . 4]" 3
26 1 41 SER O 1 45 LEU N 2.800 2.600 3.200 2.833 2.737 2.924 . 0 0 "[ . 1 . 2 . 3 . 4]" 3
27 1 42 ALA O 1 46 ALA H 2.000 . 2.400 1.966 1.912 2.044 . 0 0 "[ . 1 . 2 . 3 . 4]" 3
28 1 42 ALA O 1 46 ALA N 2.800 2.600 3.200 2.731 2.666 2.829 . 0 0 "[ . 1 . 2 . 3 . 4]" 3
29 1 43 ASN O 1 47 GLU H 2.000 . 2.400 1.779 1.738 1.854 0.062 10 0 "[ . 1 . 2 . 3 . 4]" 3
30 1 43 ASN O 1 47 GLU N 2.800 2.600 3.200 2.653 2.611 2.722 . 0 0 "[ . 1 . 2 . 3 . 4]" 3
31 1 44 LEU O 1 48 ALA H 2.000 . 2.400 1.775 1.750 1.787 0.050 14 0 "[ . 1 . 2 . 3 . 4]" 3
32 1 44 LEU O 1 48 ALA N 2.800 2.600 3.200 2.625 2.584 2.644 0.016 18 0 "[ . 1 . 2 . 3 . 4]" 3
33 1 45 LEU O 1 49 LYS H 2.000 . 2.400 1.807 1.758 1.958 0.042 21 0 "[ . 1 . 2 . 3 . 4]" 3
34 1 45 LEU O 1 49 LYS N 2.800 2.600 3.200 2.740 2.685 2.891 . 0 0 "[ . 1 . 2 . 3 . 4]" 3
35 1 46 ALA O 1 50 LYS H 2.000 . 2.400 2.016 1.949 2.154 . 0 0 "[ . 1 . 2 . 3 . 4]" 3
36 1 46 ALA O 1 50 LYS N 2.800 2.600 3.200 2.807 2.745 2.955 . 0 0 "[ . 1 . 2 . 3 . 4]" 3
37 1 47 GLU O 1 51 LEU H 2.000 . 2.400 1.745 1.725 1.764 0.075 25 0 "[ . 1 . 2 . 3 . 4]" 3
38 1 47 GLU O 1 51 LEU N 2.800 2.600 3.200 2.611 2.591 2.625 0.009 18 0 "[ . 1 . 2 . 3 . 4]" 3
stop_
save_
save_distance_constraint_statistics_4
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 4
_Distance_constraint_stats_list.Constraint_count 42
_Distance_constraint_stats_list.Viol_count 419
_Distance_constraint_stats_list.Viol_total 1186.529
_Distance_constraint_stats_list.Viol_max 0.236
_Distance_constraint_stats_list.Viol_rms 0.0421
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0177
_Distance_constraint_stats_list.Viol_average_violations_only 0.0708
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
2 9 ARG 0.765 0.108 9 0 "[ . 1 . 2 . 3 . 4]"
2 10 VAL 0.587 0.069 8 0 "[ . 1 . 2 . 3 . 4]"
2 11 ILE 0.424 0.047 24 0 "[ . 1 . 2 . 3 . 4]"
2 12 ALA 1.380 0.088 31 0 "[ . 1 . 2 . 3 . 4]"
2 13 ILE 0.765 0.108 9 0 "[ . 1 . 2 . 3 . 4]"
2 14 GLY 0.587 0.069 8 0 "[ . 1 . 2 . 3 . 4]"
2 15 GLU 0.424 0.047 24 0 "[ . 1 . 2 . 3 . 4]"
2 16 ILE 1.380 0.088 31 0 "[ . 1 . 2 . 3 . 4]"
2 23 ASN 8.892 0.236 34 0 "[ . 1 . 2 . 3 . 4]"
2 25 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
2 26 GLN 8.892 0.236 34 0 "[ . 1 . 2 . 3 . 4]"
2 27 VAL 2.751 0.132 35 0 "[ . 1 . 2 . 3 . 4]"
2 28 VAL 3.901 0.127 9 0 "[ . 1 . 2 . 3 . 4]"
2 29 ALA 1.382 0.087 32 0 "[ . 1 . 2 . 3 . 4]"
2 30 PHE 0.166 0.087 3 0 "[ . 1 . 2 . 3 . 4]"
2 31 ILE 2.751 0.132 35 0 "[ . 1 . 2 . 3 . 4]"
2 32 ASN 3.901 0.127 9 0 "[ . 1 . 2 . 3 . 4]"
2 33 SER 1.382 0.087 32 0 "[ . 1 . 2 . 3 . 4]"
2 34 LEU 0.166 0.087 3 0 "[ . 1 . 2 . 3 . 4]"
2 35 ARG 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
2 41 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
2 42 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
2 43 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
2 44 LEU 1.170 0.056 10 0 "[ . 1 . 2 . 3 . 4]"
2 45 LEU 2.178 0.113 20 0 "[ . 1 . 2 . 3 . 4]"
2 46 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
2 47 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
2 48 ALA 7.164 0.164 34 0 "[ . 1 . 2 . 3 . 4]"
2 49 LYS 2.251 0.113 20 0 "[ . 1 . 2 . 3 . 4]"
2 50 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
2 51 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
2 52 ASN 5.994 0.164 34 0 "[ . 1 . 2 . 3 . 4]"
2 53 ASP 0.074 0.023 24 0 "[ . 1 . 2 . 3 . 4]"
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 2 23 ASN OD1 2 26 GLN H 2.000 . 2.400 2.309 1.883 2.544 0.144 38 0 "[ . 1 . 2 . 3 . 4]" 4
2 2 23 ASN OD1 2 26 GLN N 2.800 2.600 3.200 3.129 2.593 3.436 0.236 34 0 "[ . 1 . 2 . 3 . 4]" 4
3 2 9 ARG O 2 13 ILE H 2.000 . 2.400 1.826 1.692 2.052 0.108 9 0 "[ . 1 . 2 . 3 . 4]" 4
4 2 9 ARG O 2 13 ILE N 2.800 2.600 3.200 2.783 2.640 3.028 . 0 0 "[ . 1 . 2 . 3 . 4]" 4
5 2 10 VAL O 2 14 GLY H 2.000 . 2.400 1.964 1.731 2.286 0.069 8 0 "[ . 1 . 2 . 3 . 4]" 4
6 2 10 VAL O 2 14 GLY N 2.800 2.600 3.200 2.842 2.596 3.152 0.004 7 0 "[ . 1 . 2 . 3 . 4]" 4
7 2 11 ILE O 2 15 GLU H 2.000 . 2.400 1.831 1.753 2.009 0.047 24 0 "[ . 1 . 2 . 3 . 4]" 4
8 2 11 ILE O 2 15 GLU N 2.800 2.600 3.200 2.650 2.560 2.787 0.040 9 0 "[ . 1 . 2 . 3 . 4]" 4
9 2 12 ALA O 2 16 ILE H 2.000 . 2.400 1.781 1.712 1.941 0.088 31 0 "[ . 1 . 2 . 3 . 4]" 4
10 2 12 ALA O 2 16 ILE N 2.800 2.600 3.200 2.750 2.664 2.926 . 0 0 "[ . 1 . 2 . 3 . 4]" 4
11 2 25 LEU O 2 29 ALA H 2.000 . 2.400 1.959 1.832 2.110 . 0 0 "[ . 1 . 2 . 3 . 4]" 4
12 2 25 LEU O 2 29 ALA N 2.800 2.600 3.200 2.744 2.623 2.897 . 0 0 "[ . 1 . 2 . 3 . 4]" 4
13 2 26 GLN O 2 30 PHE H 2.000 . 2.400 2.103 1.922 2.244 . 0 0 "[ . 1 . 2 . 3 . 4]" 4
14 2 26 GLN O 2 30 PHE N 2.800 2.600 3.200 2.971 2.818 3.099 . 0 0 "[ . 1 . 2 . 3 . 4]" 4
15 2 27 VAL O 2 31 ILE H 2.000 . 2.400 1.731 1.668 1.787 0.132 35 0 "[ . 1 . 2 . 3 . 4]" 4
16 2 27 VAL O 2 31 ILE N 2.800 2.600 3.200 2.694 2.596 2.751 0.004 35 0 "[ . 1 . 2 . 3 . 4]" 4
17 2 28 VAL O 2 32 ASN H 2.000 . 2.400 1.702 1.673 1.754 0.127 9 0 "[ . 1 . 2 . 3 . 4]" 4
18 2 28 VAL O 2 32 ASN N 2.800 2.600 3.200 2.648 2.617 2.714 . 0 0 "[ . 1 . 2 . 3 . 4]" 4
19 2 29 ALA O 2 33 SER H 2.000 . 2.400 2.420 2.240 2.487 0.087 32 0 "[ . 1 . 2 . 3 . 4]" 4
20 2 29 ALA O 2 33 SER N 2.800 2.600 3.200 3.135 2.888 3.261 0.061 32 0 "[ . 1 . 2 . 3 . 4]" 4
21 2 30 PHE O 2 34 LEU H 2.000 . 2.400 2.139 1.906 2.424 0.024 3 0 "[ . 1 . 2 . 3 . 4]" 4
22 2 30 PHE O 2 34 LEU N 2.800 2.600 3.200 2.934 2.692 3.287 0.087 3 0 "[ . 1 . 2 . 3 . 4]" 4
23 2 31 ILE O 2 35 ARG H 2.000 . 2.400 2.104 1.916 2.247 . 0 0 "[ . 1 . 2 . 3 . 4]" 4
24 2 31 ILE O 2 35 ARG N 2.800 2.600 3.200 3.049 2.874 3.195 . 0 0 "[ . 1 . 2 . 3 . 4]" 4
25 2 41 SER O 2 45 LEU H 2.000 . 2.400 2.302 2.151 2.396 . 0 0 "[ . 1 . 2 . 3 . 4]" 4
26 2 41 SER O 2 45 LEU N 2.800 2.600 3.200 3.051 2.890 3.154 . 0 0 "[ . 1 . 2 . 3 . 4]" 4
27 2 42 ALA O 2 46 ALA H 2.000 . 2.400 2.035 1.935 2.117 . 0 0 "[ . 1 . 2 . 3 . 4]" 4
28 2 42 ALA O 2 46 ALA N 2.800 2.600 3.200 2.683 2.614 2.777 . 0 0 "[ . 1 . 2 . 3 . 4]" 4
29 2 43 ASN O 2 47 GLU H 2.000 . 2.400 1.951 1.838 2.017 . 0 0 "[ . 1 . 2 . 3 . 4]" 4
30 2 43 ASN O 2 47 GLU N 2.800 2.600 3.200 2.782 2.708 2.845 . 0 0 "[ . 1 . 2 . 3 . 4]" 4
31 2 44 LEU O 2 48 ALA H 2.000 . 2.400 1.818 1.760 1.932 0.040 3 0 "[ . 1 . 2 . 3 . 4]" 4
32 2 44 LEU O 2 48 ALA N 2.800 2.600 3.200 2.577 2.544 2.641 0.056 10 0 "[ . 1 . 2 . 3 . 4]" 4
33 2 45 LEU O 2 49 LYS H 2.000 . 2.400 1.754 1.687 1.913 0.113 20 0 "[ . 1 . 2 . 3 . 4]" 4
34 2 45 LEU O 2 49 LYS N 2.800 2.600 3.200 2.708 2.634 2.857 . 0 0 "[ . 1 . 2 . 3 . 4]" 4
35 2 46 ALA O 2 50 LYS H 2.000 . 2.400 1.978 1.849 2.137 . 0 0 "[ . 1 . 2 . 3 . 4]" 4
36 2 46 ALA O 2 50 LYS N 2.800 2.600 3.200 2.831 2.704 2.986 . 0 0 "[ . 1 . 2 . 3 . 4]" 4
37 2 47 GLU O 2 51 LEU H 2.000 . 2.400 1.874 1.812 1.970 . 0 0 "[ . 1 . 2 . 3 . 4]" 4
38 2 47 GLU O 2 51 LEU N 2.800 2.600 3.200 2.655 2.601 2.752 . 0 0 "[ . 1 . 2 . 3 . 4]" 4
39 2 48 ALA O 2 52 ASN H 2.000 . 2.400 1.661 1.636 1.684 0.164 34 0 "[ . 1 . 2 . 3 . 4]" 4
40 2 48 ALA O 2 52 ASN N 2.800 2.600 3.200 2.596 2.552 2.634 0.048 34 0 "[ . 1 . 2 . 3 . 4]" 4
41 2 49 LYS O 2 53 ASP H 2.000 . 2.400 1.928 1.777 2.133 0.023 24 0 "[ . 1 . 2 . 3 . 4]" 4
42 2 49 LYS O 2 53 ASP N 2.800 2.600 3.200 2.754 2.617 2.960 . 0 0 "[ . 1 . 2 . 3 . 4]" 4
stop_
save_
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