NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
412328 |
2b89   |
6805 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2b89
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 988
_Distance_constraint_stats_list.Viol_count 1537
_Distance_constraint_stats_list.Viol_total 7547.291
_Distance_constraint_stats_list.Viol_max 0.349
_Distance_constraint_stats_list.Viol_rms 0.0287
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0048
_Distance_constraint_stats_list.Viol_average_violations_only 0.1228
_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 3.992 0.349 14 0 "[ . 1 . 2 . 3 . 4]"
1 5 PHE 19.854 0.348 20 0 "[ . 1 . 2 . 3 . 4]"
1 6 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 7 LYS 1.472 0.100 4 0 "[ . 1 . 2 . 3 . 4]"
1 8 GLU 20.828 0.349 14 0 "[ . 1 . 2 . 3 . 4]"
1 9 ARG 11.019 0.219 15 0 "[ . 1 . 2 . 3 . 4]"
1 10 VAL 15.379 0.219 15 0 "[ . 1 . 2 . 3 . 4]"
1 11 ILE 6.009 0.165 23 0 "[ . 1 . 2 . 3 . 4]"
1 12 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 13 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 14 GLY 7.158 0.197 20 0 "[ . 1 . 2 . 3 . 4]"
1 15 GLU 12.718 0.197 20 0 "[ . 1 . 2 . 3 . 4]"
1 16 ILE 5.559 0.166 40 0 "[ . 1 . 2 . 3 . 4]"
1 17 MET 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 18 ARG 1.950 0.100 29 0 "[ . 1 . 2 . 3 . 4]"
1 19 LEU 1.950 0.100 29 0 "[ . 1 . 2 . 3 . 4]"
1 20 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 21 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 22 LEU 4.768 0.168 28 0 "[ . 1 . 2 . 3 . 4]"
1 23 ASN 9.564 0.286 16 0 "[ . 1 . 2 . 3 . 4]"
1 24 SER 0.039 0.020 27 0 "[ . 1 . 2 . 3 . 4]"
1 25 LEU 9.100 0.263 17 0 "[ . 1 . 2 . 3 . 4]"
1 26 GLN 35.547 0.312 27 0 "[ . 1 . 2 . 3 . 4]"
1 27 VAL 5.859 0.163 35 0 "[ . 1 . 2 . 3 . 4]"
1 28 VAL 19.783 0.312 27 0 "[ . 1 . 2 . 3 . 4]"
1 29 ALA 6.286 0.170 37 0 "[ . 1 . 2 . 3 . 4]"
1 30 PHE 6.286 0.170 37 0 "[ . 1 . 2 . 3 . 4]"
1 31 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 32 ASN 9.604 0.213 37 0 "[ . 1 . 2 . 3 . 4]"
1 33 SER 3.224 0.070 14 0 "[ . 1 . 2 . 3 . 4]"
1 34 LEU 7.719 0.109 1 0 "[ . 1 . 2 . 3 . 4]"
1 35 ARG 32.369 0.290 22 0 "[ . 1 . 2 . 3 . 4]"
1 36 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 37 ASP 9.438 0.290 22 0 "[ . 1 . 2 . 3 . 4]"
1 38 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 39 SER 6.853 0.185 25 0 "[ . 1 . 2 . 3 . 4]"
1 40 GLN 9.475 0.185 25 0 "[ . 1 . 2 . 3 . 4]"
1 41 SER 8.757 0.244 31 0 "[ . 1 . 2 . 3 . 4]"
1 42 ALA 11.742 0.244 31 0 "[ . 1 . 2 . 3 . 4]"
1 43 ASN 0.810 0.057 35 0 "[ . 1 . 2 . 3 . 4]"
1 44 LEU 0.669 0.052 26 0 "[ . 1 . 2 . 3 . 4]"
1 45 LEU 2.285 0.132 21 0 "[ . 1 . 2 . 3 . 4]"
1 46 ALA 0.536 0.045 4 0 "[ . 1 . 2 . 3 . 4]"
1 47 GLU 4.919 0.130 12 0 "[ . 1 . 2 . 3 . 4]"
1 48 ALA 3.978 0.130 12 0 "[ . 1 . 2 . 3 . 4]"
1 49 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 50 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 51 LEU 9.108 0.159 35 0 "[ . 1 . 2 . 3 . 4]"
1 52 ASN 13.946 0.237 19 0 "[ . 1 . 2 . 3 . 4]"
1 53 ASP 13.863 0.237 19 0 "[ . 1 . 2 . 3 . 4]"
1 54 ALA 0.852 0.047 27 0 "[ . 1 . 2 . 3 . 4]"
1 55 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 56 ALA 0.208 0.047 27 0 "[ . 1 . 2 . 3 . 4]"
1 57 PRO 0.084 0.084 33 0 "[ . 1 . 2 . 3 . 4]"
1 58 LYS 0.084 0.084 33 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 3.500 . 3.500 2.388 2.140 3.044 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2 1 3 ASN QB 1 4 LYS H 5.000 . 5.000 2.702 1.817 3.737 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
3 1 3 ASN QB 1 4 LYS HA 5.000 . 5.000 4.424 4.156 4.595 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
4 1 3 ASN QB 1 5 PHE QD 5.000 . 5.000 2.618 2.109 3.972 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
5 1 4 LYS H 1 4 LYS QD 5.000 . 5.000 3.798 3.043 4.310 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
6 1 4 LYS H 1 4 LYS QE 5.000 . 5.000 4.232 2.804 4.596 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
7 1 4 LYS H 1 4 LYS QG 5.000 . 5.000 2.143 1.876 2.351 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
8 1 4 LYS HA 1 4 LYS QD 5.000 . 5.000 3.397 2.026 4.152 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
9 1 4 LYS HA 1 5 PHE H 5.000 . 5.000 3.213 3.156 3.486 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
10 1 4 LYS HA 1 5 PHE QD 5.000 . 5.000 4.682 4.616 4.776 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
11 1 4 LYS HA 1 7 LYS QB 5.000 . 5.000 3.169 2.494 3.694 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
12 1 4 LYS HB2 1 4 LYS QE 5.000 . 5.000 3.915 2.214 4.475 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
13 1 4 LYS HB2 1 8 GLU H 5.000 . 5.000 5.100 5.008 5.349 0.349 14 0 "[ . 1 . 2 . 3 . 4]" 1
14 1 4 LYS HB3 1 4 LYS QD 2.700 . 2.700 2.382 2.222 2.456 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
15 1 4 LYS HB3 1 4 LYS QE 5.000 . 5.000 3.803 2.218 4.221 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
16 1 4 LYS HB3 1 5 PHE H 5.000 . 5.000 4.307 3.664 4.417 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
17 1 5 PHE H 1 5 PHE QD 5.000 . 5.000 1.930 1.822 2.106 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
18 1 5 PHE HA 1 5 PHE QE 5.000 . 5.000 4.464 4.383 4.528 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
19 1 5 PHE HA 1 6 ASN H 5.000 . 5.000 3.563 3.538 3.586 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
20 1 5 PHE HA 1 8 GLU HB2 5.000 . 5.000 3.887 3.159 4.127 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
21 1 5 PHE HA 1 8 GLU HB3 5.000 . 5.000 3.015 2.771 3.330 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
22 1 5 PHE HA 1 8 GLU QG 5.000 . 5.000 4.485 4.247 4.557 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
23 1 5 PHE HB2 1 38 PRO QG 5.000 . 5.000 4.482 4.356 4.561 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
24 1 5 PHE HB3 1 5 PHE QE 5.000 . 5.000 4.399 4.388 4.422 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
25 1 5 PHE HB3 1 6 ASN H 5.000 . 5.000 2.892 2.806 3.187 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
26 1 5 PHE HB3 1 8 GLU H 5.000 . 5.000 5.303 5.251 5.348 0.348 20 0 "[ . 1 . 2 . 3 . 4]" 1
27 1 5 PHE QD 1 35 ARG HA 5.000 . 5.000 2.663 2.436 3.045 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
28 1 5 PHE QD 1 38 PRO QG 5.000 . 5.000 2.803 2.738 2.866 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
29 1 5 PHE QE 1 35 ARG HA 5.000 . 5.000 3.054 2.941 3.208 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
30 1 5 PHE QE 1 38 PRO QG 5.000 . 5.000 2.540 2.455 2.620 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
31 1 5 PHE HZ 1 35 ARG HA 5.000 . 5.000 5.193 5.163 5.269 0.269 14 0 "[ . 1 . 2 . 3 . 4]" 1
32 1 5 PHE HZ 1 38 PRO QG 5.000 . 5.000 2.946 2.799 3.090 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
33 1 6 ASN H 1 7 LYS H 5.000 . 5.000 2.915 2.763 3.037 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
34 1 6 ASN HA 1 7 LYS H 5.000 . 5.000 3.573 3.556 3.605 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
35 1 6 ASN HA 1 8 GLU H 5.000 . 5.000 4.445 4.347 4.588 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
36 1 6 ASN HA 1 9 ARG H 5.000 . 5.000 3.343 3.253 3.452 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
37 1 6 ASN QB 1 7 LYS H 5.000 . 5.000 2.458 2.341 3.224 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
38 1 6 ASN QB 1 9 ARG H 5.000 . 5.000 4.659 4.616 4.711 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
39 1 7 LYS H 1 7 LYS QD 5.000 . 5.000 4.323 4.147 4.521 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
40 1 7 LYS H 1 7 LYS QE 5.000 . 5.000 4.521 4.463 4.577 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
41 1 7 LYS H 1 7 LYS QG 5.000 . 5.000 3.995 3.742 4.037 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
42 1 7 LYS H 1 8 GLU H 5.000 . 5.000 2.709 2.661 2.766 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
43 1 7 LYS H 1 8 GLU HB2 5.000 . 5.000 4.981 4.528 5.100 0.100 4 0 "[ . 1 . 2 . 3 . 4]" 1
44 1 7 LYS H 1 9 ARG H 5.000 . 5.000 3.920 3.857 3.987 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
45 1 7 LYS HA 1 7 LYS QB 2.700 . 2.700 2.333 2.264 2.486 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
46 1 7 LYS HA 1 7 LYS QD 3.500 . 3.500 2.579 1.993 3.318 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
47 1 7 LYS HA 1 7 LYS QE 5.000 . 5.000 2.715 1.937 4.482 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
48 1 7 LYS HA 1 10 VAL H 5.000 . 5.000 3.407 3.254 3.495 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
49 1 7 LYS HA 1 10 VAL HB 0.000 . 5.000 3.343 3.031 3.492 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
50 1 7 LYS HA 1 10 VAL MG2 5.000 . 5.000 2.003 1.930 2.099 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
51 1 7 LYS QB 1 7 LYS QD 3.500 . 3.500 2.410 2.084 2.831 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
52 1 7 LYS QB 1 8 GLU H 5.000 . 5.000 2.583 2.481 2.677 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
53 1 7 LYS QB 1 10 VAL MG2 5.000 . 5.000 3.849 3.806 3.908 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
54 1 7 LYS QE 1 11 ILE MD 5.000 . 5.000 3.265 2.383 3.832 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
55 1 7 LYS QG 1 8 GLU H 5.000 . 5.000 3.681 3.246 4.466 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
56 1 7 LYS QG 1 11 ILE MD 5.000 . 5.000 2.804 2.289 3.836 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
57 1 8 GLU H 1 8 GLU HB3 3.500 . 3.500 2.570 2.399 3.022 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
58 1 8 GLU H 1 8 GLU QG 5.000 . 5.000 3.985 3.911 4.030 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
59 1 8 GLU H 1 9 ARG H 5.000 . 5.000 2.414 2.376 2.484 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
60 1 8 GLU H 1 9 ARG HA 5.000 . 5.000 5.072 5.038 5.135 0.135 14 0 "[ . 1 . 2 . 3 . 4]" 1
61 1 8 GLU H 1 10 VAL H 5.000 . 5.000 3.965 3.900 4.050 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
62 1 8 GLU H 1 11 ILE MD 5.000 . 5.000 4.241 4.202 4.262 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
63 1 8 GLU HA 1 8 GLU QG 3.500 . 3.500 2.613 2.172 2.963 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
64 1 8 GLU HA 1 9 ARG H 5.000 . 5.000 3.482 3.470 3.504 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
65 1 8 GLU HA 1 11 ILE H 5.000 . 5.000 3.881 3.728 4.111 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
66 1 8 GLU HA 1 11 ILE HB 3.500 . 3.500 3.151 3.068 3.243 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
67 1 8 GLU HA 1 11 ILE MD 5.000 . 5.000 2.290 2.121 2.608 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
68 1 8 GLU HA 1 11 ILE QG 5.000 . 5.000 3.779 3.546 4.123 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
69 1 8 GLU HA 1 11 ILE MG 5.000 . 5.000 4.289 4.260 4.318 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
70 1 8 GLU HB2 1 9 ARG H 5.000 . 5.000 3.757 3.315 3.880 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
71 1 8 GLU HB3 1 8 GLU QG 2.700 . 2.700 2.193 2.155 2.313 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
72 1 8 GLU HB3 1 9 ARG H 2.700 . 2.700 2.667 2.595 2.783 0.083 16 0 "[ . 1 . 2 . 3 . 4]" 1
73 1 8 GLU QG 1 9 ARG H 5.000 . 5.000 3.849 3.675 4.301 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
74 1 9 ARG H 1 9 ARG QB 3.500 . 3.500 2.259 2.123 2.303 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
75 1 9 ARG H 1 9 ARG QD 5.000 . 5.000 3.755 3.434 4.346 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
76 1 9 ARG H 1 9 ARG QG 5.000 . 5.000 2.538 2.397 3.076 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
77 1 9 ARG H 1 10 VAL H 5.000 . 5.000 2.602 2.550 2.637 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
78 1 9 ARG H 1 10 VAL HA 5.000 . 5.000 5.195 5.162 5.219 0.219 15 0 "[ . 1 . 2 . 3 . 4]" 1
79 1 9 ARG H 1 10 VAL MG2 5.000 . 5.000 4.031 3.977 4.083 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
80 1 9 ARG H 1 11 ILE H 5.000 . 5.000 4.260 4.217 4.292 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
81 1 9 ARG H 1 12 ALA MB 5.000 . 5.000 4.225 4.164 4.338 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
82 1 9 ARG H 1 41 SER QB 5.000 . 5.000 4.712 4.601 4.772 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
83 1 9 ARG HA 1 9 ARG QD 5.000 . 5.000 4.030 3.855 4.103 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
84 1 9 ARG HA 1 10 VAL H 5.000 . 5.000 3.525 3.516 3.538 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
85 1 9 ARG HA 1 11 ILE H 5.000 . 5.000 4.442 4.306 4.538 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
86 1 9 ARG HA 1 12 ALA H 5.000 . 5.000 3.263 3.114 3.434 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
87 1 9 ARG HA 1 12 ALA MB 5.000 . 5.000 2.096 1.990 2.319 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
88 1 9 ARG HA 1 13 ILE H 5.000 . 5.000 3.146 3.055 3.281 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
89 1 9 ARG HA 1 34 LEU MD2 5.000 . 5.000 4.015 3.924 4.159 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
90 1 9 ARG HA 1 41 SER QB 5.000 . 5.000 3.402 3.243 3.612 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
91 1 9 ARG QB 1 10 VAL H 5.000 . 5.000 2.867 2.808 2.902 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
92 1 9 ARG QB 1 10 VAL MG2 5.000 . 5.000 3.556 3.482 3.622 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
93 1 9 ARG QD 1 34 LEU QB 5.000 . 5.000 2.915 2.414 3.369 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
94 1 9 ARG QD 1 38 PRO HA 5.000 . 5.000 4.528 4.472 4.587 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
95 1 9 ARG QD 1 38 PRO QB 5.000 . 5.000 3.718 3.368 3.996 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
96 1 10 VAL H 1 10 VAL HB 2.700 . 2.700 2.739 2.722 2.754 0.054 40 0 "[ . 1 . 2 . 3 . 4]" 1
97 1 10 VAL H 1 10 VAL MG2 3.500 . 3.500 2.262 2.216 2.307 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
98 1 10 VAL H 1 11 ILE H 3.500 . 3.500 2.506 2.474 2.522 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
99 1 10 VAL H 1 11 ILE HA 5.000 . 5.000 5.150 5.125 5.165 0.165 23 0 "[ . 1 . 2 . 3 . 4]" 1
100 1 10 VAL H 1 11 ILE QG 5.000 . 5.000 3.866 3.821 3.924 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
101 1 10 VAL H 1 12 ALA MB 5.000 . 5.000 4.448 4.407 4.518 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
102 1 10 VAL H 1 13 ILE MG 5.000 . 5.000 3.902 3.856 3.946 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
103 1 10 VAL HA 1 10 VAL MG1 3.500 . 3.500 2.364 2.349 2.383 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
104 1 10 VAL HA 1 11 ILE H 5.000 . 5.000 3.452 3.437 3.460 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
105 1 10 VAL HA 1 13 ILE H 5.000 . 5.000 3.741 3.646 3.811 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
106 1 10 VAL HA 1 13 ILE MD 5.000 . 5.000 4.010 3.946 4.091 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
107 1 10 VAL HA 1 13 ILE MG 5.000 . 5.000 2.011 1.948 2.079 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
108 1 10 VAL HB 1 11 ILE H 3.500 . 3.500 2.211 2.179 2.264 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
109 1 10 VAL HB 1 11 ILE HA 5.000 . 5.000 3.821 3.788 3.855 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
110 1 10 VAL HB 1 11 ILE HB 5.000 . 5.000 4.453 4.358 4.519 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
111 1 10 VAL MG1 1 11 ILE H 5.000 . 5.000 3.448 3.394 3.497 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
112 1 10 VAL MG1 1 11 ILE HA 5.000 . 5.000 3.594 3.459 3.663 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
113 1 10 VAL MG1 1 11 ILE QG 5.000 . 5.000 3.636 3.506 3.703 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
114 1 10 VAL MG1 1 14 GLY H 5.000 . 5.000 4.061 3.992 4.117 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
115 1 10 VAL MG1 1 14 GLY QA 5.000 . 5.000 3.884 3.840 3.931 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
116 1 10 VAL MG2 1 11 ILE H 5.000 . 5.000 3.460 3.428 3.487 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
117 1 10 VAL MG2 1 11 ILE QG 5.000 . 5.000 3.857 3.826 3.896 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
118 1 11 ILE H 1 11 ILE HB 2.700 . 2.700 2.410 2.356 2.446 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
119 1 11 ILE H 1 11 ILE MD 5.000 . 5.000 3.228 3.196 3.257 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
120 1 11 ILE H 1 11 ILE QG 3.500 . 3.500 1.912 1.889 1.955 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
121 1 11 ILE H 1 12 ALA H 3.500 . 3.500 2.625 2.605 2.664 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
122 1 11 ILE H 1 12 ALA MB 5.000 . 5.000 4.129 4.096 4.182 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
123 1 11 ILE H 1 13 ILE H 5.000 . 5.000 4.232 4.185 4.268 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
124 1 11 ILE HA 1 11 ILE QG 3.500 . 3.500 2.447 2.409 2.471 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
125 1 11 ILE HA 1 12 ALA H 5.000 . 5.000 3.508 3.500 3.525 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
126 1 11 ILE HA 1 12 ALA MB 0.000 . 6.000 4.927 4.913 4.961 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
127 1 11 ILE HA 1 13 ILE H 5.000 . 5.000 4.947 4.885 4.986 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
128 1 11 ILE HA 1 14 GLY H 5.000 . 5.000 4.003 3.893 4.078 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
129 1 11 ILE HA 1 15 GLU H 5.000 . 5.000 4.355 4.289 4.482 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
130 1 11 ILE HB 1 11 ILE MD 3.500 . 3.500 2.328 2.313 2.351 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
131 1 11 ILE HB 1 12 ALA H 3.500 . 3.500 2.269 2.202 2.396 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
132 1 11 ILE HB 1 12 ALA MB 5.000 . 5.000 3.585 3.522 3.683 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
133 1 11 ILE MD 1 11 ILE MG 2.700 . 2.700 1.930 1.915 1.957 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
134 1 11 ILE MG 1 12 ALA H 5.000 . 5.000 3.255 3.179 3.315 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
135 1 11 ILE MG 1 12 ALA HA 5.000 . 5.000 3.411 3.354 3.468 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
136 1 11 ILE MG 1 15 GLU H 5.000 . 5.000 4.349 4.310 4.421 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
137 1 11 ILE MG 1 15 GLU QG 5.000 . 5.000 2.562 2.462 2.763 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
138 1 12 ALA H 1 13 ILE H 5.000 . 5.000 2.761 2.720 2.792 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
139 1 12 ALA H 1 14 GLY H 5.000 . 5.000 3.904 3.859 3.939 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
140 1 12 ALA HA 1 13 ILE H 5.000 . 5.000 3.596 3.584 3.613 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
141 1 12 ALA HA 1 15 GLU H 5.000 . 5.000 3.087 3.040 3.124 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
142 1 12 ALA HA 1 15 GLU QG 5.000 . 5.000 2.450 2.365 2.537 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
143 1 12 ALA HA 1 16 ILE MD 5.000 . 5.000 4.009 3.838 4.315 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
144 1 12 ALA MB 1 13 ILE H 5.000 . 5.000 2.457 2.403 2.486 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
145 1 12 ALA MB 1 13 ILE HA 5.000 . 5.000 3.747 3.720 3.772 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
146 1 12 ALA MB 1 13 ILE HB 5.000 . 5.000 4.023 3.986 4.064 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
147 1 12 ALA MB 1 14 GLY H 5.000 . 5.000 4.220 4.199 4.234 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
148 1 12 ALA MB 1 15 GLU H 5.000 . 5.000 4.216 4.191 4.245 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
149 1 12 ALA MB 1 15 GLU QB 5.000 . 5.000 3.724 3.674 3.808 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
150 1 12 ALA MB 1 15 GLU QG 5.000 . 5.000 3.892 3.864 3.923 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
151 1 12 ALA MB 1 16 ILE H 5.000 . 5.000 4.238 4.188 4.278 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
152 1 12 ALA MB 1 16 ILE MD 5.000 . 5.000 2.902 2.577 3.246 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
153 1 12 ALA MB 1 34 LEU MD1 5.000 . 5.000 2.011 1.899 2.171 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
154 1 12 ALA MB 1 41 SER HA 5.000 . 5.000 3.361 3.138 3.615 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
155 1 12 ALA MB 1 41 SER QB 5.000 . 5.000 1.951 1.870 2.184 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
156 1 12 ALA MB 1 45 LEU QD 5.000 . 5.000 2.276 1.902 3.175 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
157 1 13 ILE H 1 13 ILE HB 3.500 . 3.500 2.434 2.414 2.474 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
158 1 13 ILE H 1 13 ILE MD 5.000 . 5.000 4.364 4.354 4.379 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
159 1 13 ILE H 1 13 ILE QG 5.000 . 5.000 3.927 3.914 3.950 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
160 1 13 ILE H 1 14 GLY H 5.000 . 5.000 2.508 2.482 2.567 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
161 1 13 ILE H 1 14 GLY QA 5.000 . 5.000 4.384 4.357 4.434 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
162 1 13 ILE H 1 15 GLU H 5.000 . 5.000 3.891 3.840 3.974 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
163 1 13 ILE HA 1 14 GLY H 5.000 . 5.000 3.476 3.466 3.482 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
164 1 13 ILE HA 1 15 GLU H 5.000 . 5.000 4.200 4.146 4.281 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
165 1 13 ILE HA 1 16 ILE H 5.000 . 5.000 3.342 3.196 3.426 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
166 1 13 ILE HA 1 16 ILE MD 5.000 . 5.000 3.559 3.199 4.085 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
167 1 13 ILE HA 1 16 ILE QG 5.000 . 5.000 3.902 2.296 4.458 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
168 1 13 ILE HA 1 16 ILE MG 5.000 . 5.000 3.726 3.550 3.940 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
169 1 13 ILE HA 1 17 MET H 5.000 . 5.000 3.482 3.396 3.594 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
170 1 13 ILE HA 1 34 LEU MD1 5.000 . 5.000 2.685 2.534 2.769 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
171 1 13 ILE HA 1 34 LEU MD2 5.000 . 5.000 4.195 4.082 4.252 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
172 1 13 ILE HB 1 13 ILE QG 2.700 . 2.700 2.204 2.198 2.209 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
173 1 13 ILE HB 1 14 GLY H 0.000 . 5.000 3.764 3.734 3.796 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
174 1 13 ILE MD 1 14 GLY H 5.000 . 5.000 4.035 3.998 4.079 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
175 1 13 ILE MD 1 14 GLY QA 5.000 . 5.000 3.792 3.758 3.809 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
176 1 13 ILE MD 1 17 MET QG 5.000 . 5.000 2.347 2.253 2.432 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
177 1 13 ILE QG 1 14 GLY H 5.000 . 5.000 3.998 3.982 4.016 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
178 1 13 ILE QG 1 14 GLY QA 5.000 . 5.000 4.072 4.043 4.091 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
179 1 13 ILE MG 1 14 GLY H 5.000 . 5.000 1.865 1.813 1.929 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
180 1 13 ILE MG 1 14 GLY QA 5.000 . 5.000 2.818 2.769 2.854 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
181 1 13 ILE MG 1 17 MET QG 5.000 . 5.000 3.385 3.311 3.476 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
182 1 14 GLY H 1 15 GLU HA 5.000 . 5.000 5.179 5.167 5.197 0.197 20 0 "[ . 1 . 2 . 3 . 4]" 1
183 1 14 GLY H 1 15 GLU QB 5.000 . 5.000 4.528 4.493 4.595 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
184 1 14 GLY H 1 16 ILE H 5.000 . 5.000 4.084 3.992 4.141 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
185 1 14 GLY H 1 17 MET QB 5.000 . 5.000 4.653 4.595 4.703 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
186 1 14 GLY QA 1 15 GLU H 5.000 . 5.000 2.777 2.760 2.795 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
187 1 14 GLY QA 1 16 ILE H 5.000 . 5.000 4.234 4.146 4.281 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
188 1 14 GLY QA 1 17 MET H 5.000 . 5.000 3.600 3.509 3.728 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
189 1 14 GLY QA 1 17 MET QB 5.000 . 5.000 2.714 2.614 2.839 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
190 1 14 GLY QA 1 18 ARG H 5.000 . 5.000 4.231 4.110 4.407 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
191 1 15 GLU H 1 15 GLU QB 3.500 . 3.500 2.352 2.317 2.418 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
192 1 15 GLU H 1 15 GLU QG 5.000 . 5.000 2.493 2.323 2.656 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
193 1 15 GLU H 1 16 ILE H 3.500 . 3.500 2.526 2.490 2.555 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
194 1 15 GLU H 1 16 ILE HA 5.000 . 5.000 5.139 5.116 5.166 0.166 40 0 "[ . 1 . 2 . 3 . 4]" 1
195 1 15 GLU H 1 16 ILE HB 5.000 . 5.000 4.526 4.410 4.825 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
196 1 15 GLU H 1 16 ILE QG 5.000 . 5.000 4.222 3.658 4.501 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
197 1 15 GLU H 1 45 LEU QD 5.000 . 5.000 3.731 3.670 3.999 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
198 1 15 GLU HA 1 15 GLU QG 3.500 . 3.500 2.492 2.384 3.132 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
199 1 15 GLU HA 1 16 ILE H 5.000 . 5.000 3.521 3.504 3.540 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
200 1 15 GLU HA 1 17 MET H 5.000 . 5.000 4.673 4.509 4.771 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
201 1 15 GLU HA 1 18 ARG H 5.000 . 5.000 3.881 3.671 4.001 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
202 1 15 GLU HA 1 18 ARG QD 5.000 . 5.000 3.793 3.484 4.250 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
203 1 15 GLU QB 1 16 ILE H 3.500 . 3.500 2.308 2.268 2.356 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
204 1 15 GLU QB 1 16 ILE MD 5.000 . 5.000 3.786 3.731 3.845 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
205 1 15 GLU QB 1 45 LEU QD 5.000 . 5.000 1.937 1.695 2.093 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
206 1 15 GLU QG 1 16 ILE H 5.000 . 5.000 3.935 3.844 4.031 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
207 1 15 GLU QG 1 45 LEU QD 5.000 . 5.000 2.606 1.841 2.973 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
208 1 16 ILE H 1 16 ILE HB 3.500 . 3.500 2.313 2.203 2.633 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
209 1 16 ILE H 1 16 ILE MD 5.000 . 5.000 3.489 3.406 3.651 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
210 1 16 ILE H 1 16 ILE QG 5.000 . 5.000 2.264 1.896 2.465 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
211 1 16 ILE H 1 17 MET H 3.500 . 3.500 2.655 2.603 2.687 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
212 1 16 ILE H 1 18 ARG H 5.000 . 5.000 3.953 3.850 4.023 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
213 1 16 ILE H 1 19 LEU MD1 5.000 . 5.000 4.259 4.129 4.351 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
214 1 16 ILE H 1 45 LEU QD 5.000 . 5.000 3.116 2.832 3.696 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
215 1 16 ILE HA 1 17 MET H 5.000 . 5.000 3.513 3.495 3.529 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
216 1 16 ILE HA 1 18 ARG H 5.000 . 5.000 3.857 3.705 4.151 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
217 1 16 ILE HA 1 19 LEU H 5.000 . 5.000 3.488 3.320 3.860 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
218 1 16 ILE HA 1 19 LEU HB2 5.000 . 5.000 4.021 3.716 4.280 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
219 1 16 ILE HA 1 19 LEU MD1 5.000 . 5.000 1.893 1.850 2.020 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
220 1 16 ILE HA 1 19 LEU MD2 0.000 . 5.000 3.382 3.172 3.721 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
221 1 16 ILE HA 1 19 LEU HG 5.000 . 5.000 2.285 2.042 2.713 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
222 1 16 ILE HA 1 22 LEU MD1 5.000 . 5.000 4.059 3.819 4.196 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
223 1 16 ILE HA 1 45 LEU QD 5.000 . 5.000 3.828 3.475 3.931 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
224 1 16 ILE HA 1 48 ALA MB 5.000 . 5.000 2.996 2.710 3.161 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
225 1 16 ILE HB 1 17 MET H 3.500 . 3.500 2.784 2.351 2.990 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
226 1 16 ILE MD 1 17 MET H 6.000 . 6.000 4.752 4.658 4.918 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
227 1 16 ILE MD 1 19 LEU MD1 5.000 . 5.000 3.602 3.223 3.710 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
228 1 16 ILE MD 1 30 PHE H 5.000 . 5.000 4.450 4.388 4.495 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
229 1 16 ILE MD 1 30 PHE HA 5.000 . 5.000 3.493 3.394 3.621 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
230 1 16 ILE MD 1 30 PHE HB3 5.000 . 5.000 1.667 1.646 1.700 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
231 1 16 ILE MD 1 30 PHE QD 5.000 . 5.000 2.407 2.185 2.735 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
232 1 16 ILE MD 1 30 PHE QE 5.000 . 5.000 3.790 3.729 3.906 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
233 1 16 ILE MD 1 31 ILE H 5.000 . 5.000 4.267 4.201 4.348 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
234 1 16 ILE MD 1 31 ILE HA 5.000 . 5.000 4.095 3.938 4.270 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
235 1 16 ILE MD 1 34 LEU MD1 5.000 . 5.000 2.830 2.657 3.122 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
236 1 16 ILE MD 1 41 SER HA 5.000 . 5.000 4.225 4.136 4.319 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
237 1 16 ILE MD 1 44 LEU MD2 0.000 . 6.000 3.964 3.754 4.289 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
238 1 16 ILE MD 1 45 LEU H 5.000 . 5.000 3.139 2.701 3.391 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
239 1 16 ILE MD 1 45 LEU HA 5.000 . 5.000 2.500 1.846 2.864 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
240 1 16 ILE MD 1 45 LEU QB 5.000 . 5.000 3.087 1.941 3.507 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
241 1 16 ILE MD 1 45 LEU QD 5.000 . 5.000 2.321 1.781 3.335 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
242 1 16 ILE MD 1 45 LEU HG 5.000 . 5.000 4.002 2.448 4.325 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
243 1 16 ILE MD 1 48 ALA H 5.000 . 5.000 4.010 3.734 4.181 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
244 1 16 ILE MD 1 48 ALA MB 5.000 . 5.000 2.441 2.096 2.651 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
245 1 16 ILE QG 1 17 MET H 5.000 . 5.000 4.112 3.630 4.280 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
246 1 16 ILE QG 1 19 LEU MD1 5.000 . 5.000 2.595 2.172 3.752 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
247 1 16 ILE QG 1 45 LEU HA 5.000 . 5.000 2.366 1.997 3.316 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
248 1 16 ILE QG 1 45 LEU QD 5.000 . 5.000 2.140 1.795 3.078 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
249 1 16 ILE MG 1 17 MET H 5.000 . 5.000 3.407 3.258 3.621 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
250 1 16 ILE MG 1 17 MET HA 5.000 . 5.000 3.468 3.277 3.839 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
251 1 16 ILE MG 1 17 MET ME 5.000 . 5.000 3.044 2.919 3.241 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
252 1 16 ILE MG 1 19 LEU MD1 5.000 . 5.000 2.392 2.212 2.578 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
253 1 16 ILE MG 1 27 VAL HA 5.000 . 5.000 2.409 2.309 2.478 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
254 1 16 ILE MG 1 30 PHE H 5.000 . 5.000 3.498 3.444 3.536 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
255 1 16 ILE MG 1 30 PHE HA 5.000 . 5.000 4.062 3.927 4.164 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
256 1 16 ILE MG 1 30 PHE HB2 5.000 . 5.000 1.812 1.754 1.850 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
257 1 16 ILE MG 1 30 PHE HB3 5.000 . 5.000 2.204 1.948 2.393 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
258 1 16 ILE MG 1 30 PHE QD 5.000 . 5.000 2.460 2.284 2.677 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
259 1 16 ILE MG 1 30 PHE QE 5.000 . 5.000 3.900 3.832 3.989 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
260 1 16 ILE MG 1 31 ILE H 5.000 . 5.000 3.419 3.284 3.467 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
261 1 16 ILE MG 1 31 ILE HA 5.000 . 5.000 4.347 4.267 4.417 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
262 1 16 ILE MG 1 45 LEU HA 5.000 . 5.000 4.030 3.319 4.242 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
263 1 16 ILE MG 1 48 ALA MB 5.000 . 5.000 2.439 2.143 2.599 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
264 1 17 MET H 1 17 MET ME 5.000 . 5.000 4.004 3.878 4.228 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
265 1 17 MET H 1 17 MET QG 5.000 . 5.000 2.414 2.255 3.302 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
266 1 17 MET H 1 18 ARG H 3.500 . 3.500 2.592 2.455 2.674 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
267 1 17 MET H 1 19 LEU H 5.000 . 5.000 4.246 4.139 4.310 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
268 1 17 MET H 1 27 VAL MG1 5.000 . 5.000 4.092 3.960 4.188 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
269 1 17 MET HA 1 17 MET ME 5.000 . 5.000 3.372 3.234 3.470 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
270 1 17 MET HA 1 18 ARG H 5.000 . 5.000 3.452 3.433 3.486 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
271 1 17 MET HA 1 27 VAL MG1 5.000 . 5.000 2.280 2.116 2.391 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
272 1 17 MET HA 1 27 VAL MG2 5.000 . 5.000 3.353 3.172 3.466 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
273 1 17 MET QB 1 18 ARG H 3.500 . 3.500 3.038 2.902 3.098 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
274 1 17 MET ME 1 27 VAL MG1 5.000 . 5.000 1.826 1.804 1.871 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
275 1 17 MET ME 1 28 VAL HA 5.000 . 5.000 2.691 2.476 2.760 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
276 1 17 MET ME 1 28 VAL MG1 5.000 . 5.000 3.680 3.646 3.754 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
277 1 17 MET ME 1 28 VAL MG2 5.000 . 5.000 2.478 2.384 2.782 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
278 1 17 MET ME 1 30 PHE HB2 5.000 . 5.000 4.234 4.217 4.253 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
279 1 17 MET ME 1 31 ILE HA 5.000 . 5.000 4.228 4.174 4.271 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
280 1 17 MET ME 1 31 ILE MD 5.000 . 5.000 1.697 1.680 1.754 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
281 1 17 MET ME 1 31 ILE QG 5.000 . 5.000 1.951 1.791 1.980 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
282 1 17 MET ME 1 31 ILE MG 5.000 . 5.000 3.530 3.499 3.569 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
283 1 17 MET QG 1 18 ARG H 5.000 . 5.000 4.362 4.280 4.658 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
284 1 17 MET QG 1 27 VAL MG1 5.000 . 5.000 3.075 2.851 3.131 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
285 1 17 MET QG 1 31 ILE MD 5.000 . 5.000 3.771 3.746 3.799 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
286 1 18 ARG H 1 18 ARG HB2 2.700 . 2.700 2.561 2.466 2.635 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
287 1 18 ARG H 1 18 ARG HB3 3.500 . 3.500 2.419 2.363 2.476 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
288 1 18 ARG H 1 18 ARG QD 5.000 . 5.000 4.437 4.343 4.586 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
289 1 18 ARG H 1 18 ARG QG 5.000 . 5.000 3.942 3.928 3.953 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
290 1 18 ARG H 1 19 LEU HA 5.000 . 5.000 5.048 5.016 5.100 0.100 29 0 "[ . 1 . 2 . 3 . 4]" 1
291 1 18 ARG H 1 19 LEU MD2 5.000 . 5.000 4.346 4.294 4.376 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
292 1 18 ARG HA 1 18 ARG HB2 2.700 . 2.700 2.454 2.435 2.471 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
293 1 18 ARG HA 1 18 ARG QD 5.000 . 5.000 4.113 4.002 4.244 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
294 1 18 ARG HA 1 18 ARG QG 3.500 . 3.500 2.468 2.434 2.501 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
295 1 18 ARG HA 1 19 LEU H 3.500 . 3.500 3.490 3.462 3.511 0.011 20 0 "[ . 1 . 2 . 3 . 4]" 1
296 1 18 ARG HB2 1 18 ARG QG 2.700 . 2.700 2.343 2.319 2.367 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
297 1 18 ARG HB3 1 18 ARG QD 3.500 . 3.500 2.350 2.306 2.380 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
298 1 18 ARG HB3 1 18 ARG QG 2.700 . 2.700 2.392 2.371 2.414 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
299 1 18 ARG HB3 1 19 LEU H 3.500 . 3.500 2.679 2.636 2.715 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
300 1 18 ARG QD 1 19 LEU H 5.000 . 5.000 4.503 4.449 4.530 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
301 1 18 ARG QG 1 19 LEU H 5.000 . 5.000 3.674 3.575 3.729 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
302 1 18 ARG QG 1 19 LEU MD2 5.000 . 5.000 3.745 3.720 3.780 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
303 1 19 LEU H 1 19 LEU HB2 3.500 . 3.500 2.657 2.611 2.713 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
304 1 19 LEU H 1 19 LEU MD2 5.000 . 5.000 2.726 2.653 2.784 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
305 1 19 LEU H 1 19 LEU HG 3.500 . 3.500 1.658 1.632 1.706 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
306 1 19 LEU H 1 20 PRO QD 5.000 . 5.000 3.911 3.829 3.974 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
307 1 19 LEU H 1 22 LEU MD1 5.000 . 5.000 4.248 4.181 4.316 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
308 1 19 LEU H 1 48 ALA MB 0.000 . 6.000 5.108 5.083 5.138 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
309 1 19 LEU HA 1 20 PRO QD 3.500 . 3.500 1.894 1.873 1.957 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
310 1 19 LEU HA 1 20 PRO QG 5.000 . 5.000 3.820 3.795 3.878 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
311 1 19 LEU HA 1 21 ASN H 5.000 . 5.000 3.545 3.321 3.676 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
312 1 19 LEU HB2 1 22 LEU H 5.000 . 5.000 4.170 3.881 4.450 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
313 1 19 LEU HB2 1 22 LEU MD1 5.000 . 5.000 2.080 1.918 2.382 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
314 1 19 LEU HB3 1 20 PRO QD 5.000 . 5.000 3.529 3.450 3.612 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
315 1 19 LEU HB3 1 21 ASN H 5.000 . 5.000 3.282 3.056 3.513 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
316 1 19 LEU HB3 1 22 LEU HG 5.000 . 5.000 3.223 3.009 3.415 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
317 1 19 LEU HB3 1 52 ASN H 5.000 . 5.000 4.622 4.464 4.741 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
318 1 19 LEU HB3 1 52 ASN QB 5.000 . 5.000 2.344 2.084 2.642 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
319 1 19 LEU MD1 1 22 LEU MD1 5.000 . 5.000 1.707 1.672 1.739 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
320 1 19 LEU MD1 1 22 LEU MD2 5.000 . 5.000 3.653 3.611 3.704 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
321 1 19 LEU MD1 1 22 LEU HG 5.000 . 5.000 3.735 3.555 3.832 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
322 1 19 LEU MD1 1 45 LEU HA 5.000 . 5.000 3.399 3.037 3.971 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
323 1 19 LEU MD1 1 48 ALA H 5.000 . 5.000 4.163 4.073 4.278 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
324 1 19 LEU MD1 1 48 ALA HA 5.000 . 5.000 3.126 2.938 3.219 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
325 1 19 LEU MD1 1 48 ALA MB 5.000 . 5.000 1.657 1.615 1.698 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
326 1 19 LEU MD1 1 49 LYS H 5.000 . 5.000 3.402 3.186 3.773 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
327 1 19 LEU MD1 1 49 LYS HA 5.000 . 5.000 3.221 2.904 3.729 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
328 1 19 LEU MD1 1 49 LYS QG 5.000 . 5.000 3.247 2.979 3.730 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
329 1 19 LEU MD1 1 52 ASN QB 5.000 . 5.000 2.702 2.224 3.167 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
330 1 19 LEU MD2 1 20 PRO QD 5.000 . 5.000 3.073 2.983 3.215 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
331 1 19 LEU MD2 1 21 ASN H 5.000 . 5.000 4.291 4.210 4.342 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
332 1 19 LEU MD2 1 49 LYS H 5.000 . 5.000 3.706 3.542 3.975 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
333 1 19 LEU MD2 1 49 LYS HA 5.000 . 5.000 2.468 2.234 2.945 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
334 1 19 LEU MD2 1 49 LYS QE 5.000 . 5.000 3.353 3.083 3.719 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
335 1 19 LEU MD2 1 49 LYS QG 5.000 . 5.000 2.189 1.978 2.708 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
336 1 19 LEU MD2 1 52 ASN H 5.000 . 5.000 4.205 4.108 4.266 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
337 1 19 LEU MD2 1 52 ASN QB 5.000 . 5.000 2.422 2.320 2.586 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
338 1 19 LEU MD2 1 52 ASN QD 5.000 . 5.000 2.919 1.794 3.722 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
339 1 20 PRO HA 1 21 ASN H 5.000 . 5.000 3.470 3.388 3.521 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
340 1 20 PRO QB 1 21 ASN H 5.000 . 5.000 3.376 3.201 3.543 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
341 1 20 PRO QD 1 21 ASN H 5.000 . 5.000 2.441 2.186 2.648 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
342 1 20 PRO QD 1 52 ASN QD 5.000 . 5.000 2.298 1.899 2.929 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
343 1 20 PRO QG 1 21 ASN H 5.000 . 5.000 3.781 3.519 3.988 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
344 1 20 PRO QG 1 21 ASN QD 5.000 . 5.000 4.037 3.978 4.107 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
345 1 20 PRO QG 1 52 ASN QD 5.000 . 5.000 3.558 3.032 4.040 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
346 1 21 ASN H 1 21 ASN QB 3.500 . 3.500 2.434 2.250 2.591 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
347 1 21 ASN H 1 21 ASN QD 5.000 . 5.000 3.511 3.149 4.009 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
348 1 21 ASN H 1 22 LEU H 3.500 . 3.500 2.680 2.457 2.925 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
349 1 21 ASN H 1 22 LEU HB2 5.000 . 5.000 4.378 4.223 4.490 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
350 1 21 ASN H 1 22 LEU MD1 5.000 . 5.000 4.277 4.210 4.332 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
351 1 21 ASN H 1 22 LEU HG 5.000 . 5.000 3.998 3.647 4.266 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
352 1 21 ASN H 1 52 ASN HA 5.000 . 5.000 4.014 3.696 4.173 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
353 1 21 ASN H 1 52 ASN QB 5.000 . 5.000 3.654 2.809 4.146 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
354 1 21 ASN H 1 52 ASN QD 5.000 . 5.000 3.275 1.927 3.954 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
355 1 21 ASN QB 1 22 LEU H 5.000 . 5.000 2.803 2.061 3.825 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
356 1 21 ASN QB 1 52 ASN HA 5.000 . 5.000 2.177 1.916 2.363 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
357 1 21 ASN QB 1 55 GLN H 5.000 . 5.000 4.425 4.023 4.656 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
358 1 21 ASN QB 1 55 GLN HB3 5.000 . 5.000 4.536 4.379 4.630 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
359 1 21 ASN QB 1 55 GLN QE 5.000 . 5.000 4.022 3.801 4.078 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
360 1 21 ASN QB 1 56 ALA H 5.000 . 5.000 2.810 2.415 3.108 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
361 1 21 ASN QB 1 56 ALA HA 5.000 . 5.000 2.290 2.115 2.438 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
362 1 21 ASN QB 1 56 ALA MB 5.000 . 5.000 3.750 3.702 3.806 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
363 1 21 ASN QB 1 57 PRO QD 5.000 . 5.000 1.813 1.742 1.895 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
364 1 21 ASN QD 1 52 ASN HA 5.000 . 5.000 3.593 3.009 4.523 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
365 1 21 ASN QD 1 52 ASN QD 5.000 . 5.000 2.309 1.608 3.994 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
366 1 21 ASN QD 1 53 ASP HA 5.000 . 5.000 3.322 2.754 4.461 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
367 1 21 ASN QD 1 56 ALA H 5.000 . 5.000 4.062 3.617 4.478 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
368 1 21 ASN QD 1 56 ALA HA 5.000 . 5.000 3.229 1.958 3.455 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
369 1 21 ASN QD 1 56 ALA MB 5.000 . 5.000 3.588 2.960 3.754 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
370 1 21 ASN QD 1 57 PRO QD 5.000 . 5.000 4.009 2.981 4.134 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
371 1 22 LEU H 1 22 LEU MD1 5.000 . 5.000 3.424 3.008 4.032 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
372 1 22 LEU H 1 22 LEU MD2 5.000 . 5.000 3.738 3.341 4.200 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
373 1 22 LEU H 1 22 LEU HG 5.000 . 5.000 2.410 1.834 3.274 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
374 1 22 LEU H 1 23 ASN H 5.000 . 5.000 4.518 4.370 4.632 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
375 1 22 LEU H 1 27 VAL MG2 5.000 . 5.000 3.964 3.620 4.178 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
376 1 22 LEU H 1 52 ASN HA 5.000 . 5.000 3.484 2.624 4.692 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
377 1 22 LEU H 1 52 ASN QB 5.000 . 5.000 3.967 3.508 4.644 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
378 1 22 LEU H 1 55 GLN QE 5.000 . 5.000 4.390 4.111 4.650 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
379 1 22 LEU H 1 57 PRO QD 5.000 . 5.000 4.017 3.466 4.472 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
380 1 22 LEU HA 1 23 ASN H 3.500 . 3.500 2.214 2.182 2.278 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
381 1 22 LEU HA 1 23 ASN HA 5.000 . 5.000 4.368 4.351 4.386 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
382 1 22 LEU HA 1 26 GLN HB2 5.000 . 5.000 3.437 3.296 3.567 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
383 1 22 LEU HA 1 27 VAL MG2 5.000 . 5.000 3.965 3.830 4.077 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
384 1 22 LEU HA 1 52 ASN HA 5.000 . 5.000 4.170 3.946 4.449 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
385 1 22 LEU HB2 1 27 VAL MG2 5.000 . 5.000 2.054 1.992 2.127 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
386 1 22 LEU HB3 1 23 ASN H 5.000 . 5.000 2.791 2.572 3.030 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
387 1 22 LEU HB3 1 26 GLN HB2 5.000 . 5.000 2.227 2.111 2.355 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
388 1 22 LEU HB3 1 26 GLN HB3 2.700 . 2.700 2.819 2.785 2.868 0.168 28 0 "[ . 1 . 2 . 3 . 4]" 1
389 1 22 LEU HB3 1 27 VAL H 5.000 . 5.000 2.934 2.880 3.039 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
390 1 22 LEU HB3 1 27 VAL MG2 5.000 . 5.000 2.271 2.111 2.390 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
391 1 22 LEU MD1 1 27 VAL H 5.000 . 5.000 4.196 4.065 4.250 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
392 1 22 LEU MD1 1 27 VAL HA 5.000 . 5.000 3.089 2.921 3.205 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
393 1 22 LEU MD1 1 48 ALA MB 5.000 . 5.000 2.455 2.229 2.782 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
394 1 22 LEU MD1 1 52 ASN HA 5.000 . 5.000 3.339 3.059 3.740 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
395 1 22 LEU MD2 1 23 ASN H 5.000 . 5.000 3.054 2.866 3.267 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
396 1 22 LEU MD2 1 26 GLN H 5.000 . 5.000 4.372 4.299 4.501 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
397 1 22 LEU MD2 1 26 GLN HB2 5.000 . 5.000 2.314 2.254 2.420 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
398 1 22 LEU MD2 1 26 GLN QE 5.000 . 5.000 2.952 2.032 3.762 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
399 1 22 LEU MD2 1 30 PHE QD 5.000 . 5.000 3.719 3.496 3.798 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
400 1 22 LEU MD2 1 30 PHE QE 5.000 . 5.000 2.250 2.146 2.346 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
401 1 22 LEU MD2 1 30 PHE HZ 5.000 . 5.000 3.984 3.901 4.086 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
402 1 22 LEU MD2 1 48 ALA HA 5.000 . 5.000 3.397 3.116 3.601 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
403 1 22 LEU MD2 1 51 LEU QB 5.000 . 5.000 1.716 1.684 1.778 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
404 1 22 LEU MD2 1 51 LEU HG 5.000 . 5.000 3.055 2.849 3.663 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
405 1 22 LEU MD2 1 52 ASN H 5.000 . 5.000 3.458 3.405 3.515 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
406 1 22 LEU MD2 1 52 ASN HA 5.000 . 5.000 3.026 2.960 3.094 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
407 1 22 LEU MD2 1 52 ASN QB 5.000 . 5.000 3.755 3.702 3.804 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
408 1 22 LEU MD2 1 55 GLN H 5.000 . 5.000 4.304 4.221 4.438 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
409 1 22 LEU MD2 1 55 GLN QE 5.000 . 5.000 2.148 1.824 2.404 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
410 1 22 LEU HG 1 52 ASN QB 5.000 . 5.000 2.841 2.709 3.033 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
411 1 23 ASN H 1 23 ASN QD 5.000 . 5.000 2.526 2.049 2.961 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
412 1 23 ASN H 1 24 SER H 5.000 . 5.000 4.566 4.540 4.599 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
413 1 23 ASN H 1 26 GLN H 5.000 . 5.000 3.480 3.422 3.525 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
414 1 23 ASN H 1 26 GLN HA 5.000 . 5.000 5.239 5.207 5.286 0.286 16 0 "[ . 1 . 2 . 3 . 4]" 1
415 1 23 ASN H 1 26 GLN HB2 5.000 . 5.000 2.425 2.356 2.495 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
416 1 23 ASN H 1 26 GLN QG 5.000 . 5.000 3.260 2.951 3.695 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
417 1 23 ASN H 1 27 VAL H 5.000 . 5.000 3.915 3.848 3.985 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
418 1 23 ASN H 1 27 VAL MG2 5.000 . 5.000 3.689 3.620 3.815 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
419 1 23 ASN H 1 55 GLN QE 5.000 . 5.000 2.842 2.446 3.363 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
420 1 23 ASN HA 1 24 SER H 5.000 . 5.000 2.377 2.308 2.418 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
421 1 23 ASN HA 1 24 SER HA 5.000 . 5.000 4.250 4.211 4.265 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
422 1 23 ASN HA 1 24 SER QB 5.000 . 5.000 4.585 4.545 4.691 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
423 1 23 ASN HA 1 25 LEU H 5.000 . 5.000 4.276 4.155 4.349 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
424 1 23 ASN HB2 1 24 SER H 5.000 . 5.000 2.630 2.524 2.770 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
425 1 23 ASN HB2 1 25 LEU H 5.000 . 5.000 2.746 2.578 2.929 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
426 1 23 ASN HB2 1 26 GLN H 5.000 . 5.000 3.748 3.470 3.968 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
427 1 23 ASN QD 1 26 GLN H 5.000 . 5.000 3.763 3.579 4.330 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
428 1 23 ASN QD 1 26 GLN QG 5.000 . 5.000 2.387 1.855 3.292 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
429 1 23 ASN QD 1 57 PRO QB 5.000 . 5.000 3.849 2.869 4.025 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
430 1 24 SER H 1 25 LEU H 5.000 . 5.000 2.863 2.812 2.887 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
431 1 24 SER HA 1 25 LEU H 5.000 . 5.000 3.527 3.508 3.539 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
432 1 24 SER HA 1 27 VAL H 5.000 . 5.000 3.441 3.375 3.534 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
433 1 24 SER HA 1 27 VAL HA 5.000 . 5.000 4.956 4.905 5.020 0.020 27 0 "[ . 1 . 2 . 3 . 4]" 1
434 1 24 SER HA 1 27 VAL HB 5.000 . 5.000 1.968 1.930 2.031 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
435 1 24 SER HA 1 27 VAL MG2 5.000 . 5.000 2.924 2.652 3.009 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
436 1 24 SER HA 1 28 VAL H 5.000 . 5.000 3.622 3.591 3.716 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
437 1 24 SER HA 1 28 VAL MG2 5.000 . 5.000 3.298 3.212 3.377 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
438 1 24 SER QB 1 25 LEU H 5.000 . 5.000 3.291 2.549 3.455 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
439 1 24 SER QB 1 25 LEU MD1 5.000 . 5.000 3.380 2.336 3.649 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
440 1 24 SER QB 1 25 LEU HG 5.000 . 5.000 4.573 4.475 4.724 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
441 1 24 SER QB 1 27 VAL HB 5.000 . 5.000 3.701 3.646 3.804 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
442 1 24 SER QB 1 27 VAL MG1 5.000 . 5.000 3.892 3.877 3.928 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
443 1 24 SER QB 1 28 VAL H 5.000 . 5.000 4.302 4.252 4.331 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
444 1 24 SER QB 1 28 VAL HB 5.000 . 5.000 4.532 4.473 4.565 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
445 1 24 SER QB 1 28 VAL MG2 5.000 . 5.000 2.641 2.585 2.756 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
446 1 25 LEU H 1 25 LEU QB 3.500 . 3.500 2.526 2.368 2.564 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
447 1 25 LEU H 1 25 LEU MD1 5.000 . 5.000 1.741 1.689 2.530 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
448 1 25 LEU H 1 25 LEU MD2 5.000 . 5.000 3.635 1.669 3.756 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
449 1 25 LEU H 1 25 LEU HG 5.000 . 5.000 2.958 2.783 3.606 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
450 1 25 LEU H 1 26 GLN H 3.500 . 3.500 2.742 2.692 2.788 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
451 1 25 LEU H 1 26 GLN HB2 5.000 . 5.000 4.713 4.655 4.802 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
452 1 25 LEU H 1 26 GLN QG 5.000 . 5.000 4.662 4.542 4.733 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
453 1 25 LEU H 1 28 VAL HB 5.000 . 5.000 4.752 4.688 4.805 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
454 1 25 LEU H 1 28 VAL MG2 5.000 . 5.000 4.265 4.232 4.281 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
455 1 25 LEU HA 1 26 GLN H 5.000 . 5.000 3.568 3.554 3.583 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
456 1 25 LEU HA 1 28 VAL H 5.000 . 5.000 3.363 3.242 3.396 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
457 1 25 LEU HA 1 28 VAL HA 5.000 . 5.000 5.224 5.111 5.263 0.263 17 0 "[ . 1 . 2 . 3 . 4]" 1
458 1 25 LEU HA 1 28 VAL HB 3.500 . 3.500 2.437 2.336 2.501 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
459 1 25 LEU HA 1 28 VAL MG2 5.000 . 5.000 3.214 3.096 3.264 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
460 1 25 LEU HA 1 29 ALA H 5.000 . 5.000 3.741 3.664 3.779 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
461 1 25 LEU HA 1 29 ALA MB 5.000 . 5.000 4.285 4.247 4.318 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
462 1 25 LEU QB 1 25 LEU HG 2.700 . 2.700 2.440 2.191 2.474 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
463 1 25 LEU QB 1 26 GLN H 5.000 . 5.000 2.344 2.293 2.632 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
464 1 25 LEU QB 1 28 VAL H 5.000 . 5.000 4.622 4.607 4.653 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
465 1 25 LEU QB 1 29 ALA H 5.000 . 5.000 4.405 4.372 4.478 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
466 1 25 LEU MD1 1 25 LEU MD2 2.700 . 2.700 1.926 1.920 1.951 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
467 1 25 LEU MD2 1 26 GLN H 5.000 . 5.000 4.400 3.343 4.482 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
468 1 25 LEU HG 1 26 GLN H 5.000 . 5.000 4.721 4.642 5.082 0.082 2 0 "[ . 1 . 2 . 3 . 4]" 1
469 1 26 GLN H 1 26 GLN HA 2.700 . 2.700 2.811 2.803 2.834 0.134 2 0 "[ . 1 . 2 . 3 . 4]" 1
470 1 26 GLN H 1 26 GLN HB2 2.700 . 2.700 2.291 2.248 2.337 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
471 1 26 GLN H 1 26 GLN QG 3.500 . 3.500 2.388 2.242 2.529 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
472 1 26 GLN H 1 27 VAL H 2.700 . 2.700 2.498 2.396 2.522 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
473 1 26 GLN H 1 27 VAL HA 5.000 . 5.000 5.146 5.065 5.163 0.163 35 0 "[ . 1 . 2 . 3 . 4]" 1
474 1 26 GLN H 1 27 VAL HB 5.000 . 5.000 4.258 4.084 4.303 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
475 1 26 GLN H 1 27 VAL MG2 5.000 . 5.000 4.185 4.154 4.196 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
476 1 26 GLN H 1 28 VAL H 5.000 . 5.000 3.832 3.764 3.863 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
477 1 26 GLN H 1 29 ALA H 5.000 . 5.000 4.207 4.168 4.250 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
478 1 26 GLN H 1 29 ALA MB 5.000 . 5.000 3.980 3.949 4.054 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
479 1 26 GLN HA 1 26 GLN QE 5.000 . 5.000 3.902 2.845 4.589 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
480 1 26 GLN HA 1 26 GLN QG 3.500 . 3.500 2.459 2.226 2.658 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
481 1 26 GLN HA 1 27 VAL H 5.000 . 5.000 3.476 3.467 3.481 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
482 1 26 GLN HA 1 29 ALA H 5.000 . 5.000 3.072 2.969 3.155 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
483 1 26 GLN HA 1 29 ALA MB 5.000 . 5.000 1.968 1.899 2.036 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
484 1 26 GLN HB2 1 27 VAL H 3.500 . 3.500 2.447 2.376 2.506 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
485 1 26 GLN HB2 1 27 VAL MG2 5.000 . 5.000 3.436 3.361 3.549 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
486 1 26 GLN HB2 1 29 ALA MB 5.000 . 5.000 4.390 4.325 4.438 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
487 1 26 GLN HB2 1 30 PHE QE 5.000 . 5.000 4.523 4.461 4.582 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
488 1 26 GLN HB3 1 27 VAL HA 5.000 . 5.000 4.209 4.126 4.313 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
489 1 26 GLN HB3 1 28 VAL H 5.000 . 5.000 5.271 5.226 5.312 0.312 27 0 "[ . 1 . 2 . 3 . 4]" 1
490 1 26 GLN HB3 1 51 LEU QD 5.000 . 5.000 3.629 2.965 3.774 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
491 1 26 GLN QE 1 51 LEU QD 5.000 . 5.000 2.420 1.686 3.364 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
492 1 26 GLN QE 1 55 GLN QE 5.000 . 5.000 3.038 1.802 3.773 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
493 1 26 GLN QG 1 27 VAL H 5.000 . 5.000 4.018 3.979 4.043 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
494 1 26 GLN QG 1 29 ALA MB 5.000 . 5.000 3.690 3.380 3.836 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
495 1 26 GLN QG 1 51 LEU QD 5.000 . 5.000 3.382 3.287 3.412 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
496 1 27 VAL H 1 27 VAL HB 3.500 . 3.500 2.211 2.160 2.254 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
497 1 27 VAL H 1 28 VAL H 3.500 . 3.500 2.576 2.547 2.599 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
498 1 27 VAL H 1 28 VAL HB 0.000 . 5.000 4.822 4.770 4.871 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
499 1 27 VAL H 1 28 VAL MG2 5.000 . 5.000 4.206 4.193 4.225 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
500 1 27 VAL H 1 29 ALA H 5.000 . 5.000 3.778 3.757 3.808 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
501 1 27 VAL H 1 30 PHE QD 5.000 . 5.000 4.230 4.185 4.295 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
502 1 27 VAL HA 1 28 VAL H 5.000 . 5.000 3.492 3.485 3.501 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
503 1 27 VAL HA 1 29 ALA H 5.000 . 5.000 4.376 4.356 4.395 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
504 1 27 VAL HA 1 30 PHE H 5.000 . 5.000 3.797 3.749 3.840 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
505 1 27 VAL HA 1 30 PHE HB2 5.000 . 5.000 3.204 3.066 3.339 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
506 1 27 VAL HA 1 30 PHE QD 5.000 . 5.000 2.592 2.496 2.753 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
507 1 27 VAL HA 1 31 ILE H 5.000 . 5.000 4.793 4.731 4.877 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
508 1 27 VAL HB 1 28 VAL H 3.500 . 3.500 2.482 2.449 2.502 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
509 1 27 VAL HB 1 28 VAL HA 5.000 . 5.000 4.518 4.460 4.574 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
510 1 27 VAL HB 1 28 VAL MG2 3.500 . 3.500 3.049 3.007 3.098 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
511 1 27 VAL HB 1 29 ALA H 5.000 . 5.000 4.682 4.658 4.703 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
512 1 27 VAL MG1 1 27 VAL MG2 2.700 . 2.700 1.929 1.911 1.946 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
513 1 27 VAL MG1 1 28 VAL HA 5.000 . 5.000 3.429 3.357 3.522 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
514 1 27 VAL MG1 1 30 PHE HB2 5.000 . 5.000 4.162 4.089 4.211 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
515 1 27 VAL MG1 1 31 ILE MD 5.000 . 5.000 3.323 3.159 3.396 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
516 1 27 VAL MG1 1 31 ILE QG 5.000 . 5.000 3.384 3.342 3.431 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
517 1 27 VAL MG2 1 28 VAL H 0.000 . 5.000 3.884 3.845 3.917 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
518 1 28 VAL H 1 28 VAL HB 2.700 . 2.700 2.501 2.480 2.541 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
519 1 28 VAL H 1 28 VAL MG2 3.500 . 3.500 2.290 2.262 2.315 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
520 1 28 VAL H 1 29 ALA H 3.500 . 3.500 2.398 2.390 2.409 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
521 1 28 VAL H 1 29 ALA MB 5.000 . 5.000 3.959 3.941 3.983 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
522 1 28 VAL H 1 30 PHE H 5.000 . 5.000 3.945 3.914 3.977 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
523 1 28 VAL H 1 31 ILE MD 5.000 . 5.000 4.156 4.136 4.171 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
524 1 28 VAL HA 1 28 VAL MG2 3.500 . 3.500 2.271 2.257 2.283 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
525 1 28 VAL HA 1 29 ALA H 5.000 . 5.000 3.428 3.422 3.437 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
526 1 28 VAL HA 1 29 ALA HA 5.000 . 5.000 4.889 4.877 4.906 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
527 1 28 VAL HA 1 31 ILE H 5.000 . 5.000 2.709 2.654 2.745 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
528 1 28 VAL HA 1 31 ILE HB 5.000 . 5.000 2.862 2.773 2.923 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
529 1 28 VAL HA 1 31 ILE MD 5.000 . 5.000 1.973 1.947 2.057 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
530 1 28 VAL HA 1 31 ILE QG 5.000 . 5.000 1.955 1.893 2.045 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
531 1 28 VAL HA 1 31 ILE MG 5.000 . 5.000 4.075 4.013 4.103 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
532 1 28 VAL HA 1 32 ASN H 5.000 . 5.000 4.052 3.966 4.171 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
533 1 28 VAL HB 1 29 ALA H 3.500 . 3.500 2.863 2.849 2.883 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
534 1 28 VAL HB 1 29 ALA HA 5.000 . 5.000 4.377 4.352 4.418 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
535 1 28 VAL HB 1 29 ALA MB 5.000 . 5.000 4.242 4.224 4.270 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
536 1 28 VAL MG1 1 29 ALA H 5.000 . 5.000 3.615 3.577 3.664 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
537 1 28 VAL MG1 1 29 ALA HA 5.000 . 5.000 3.719 3.650 3.807 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
538 1 28 VAL MG1 1 32 ASN H 5.000 . 5.000 3.571 3.415 3.752 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
539 1 28 VAL MG1 1 32 ASN QB 5.000 . 5.000 3.767 3.524 3.856 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
540 1 28 VAL MG1 1 32 ASN QD 5.000 . 5.000 2.351 1.856 3.728 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
541 1 28 VAL MG2 1 29 ALA H 5.000 . 5.000 3.875 3.859 3.893 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
542 1 28 VAL MG2 1 31 ILE H 5.000 . 5.000 4.528 4.497 4.551 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
543 1 28 VAL MG2 1 31 ILE HB 5.000 . 5.000 4.171 4.080 4.221 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
544 1 28 VAL MG2 1 31 ILE MD 5.000 . 5.000 2.141 2.076 2.203 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
545 1 28 VAL MG2 1 31 ILE QG 5.000 . 5.000 3.442 3.397 3.511 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
546 1 29 ALA H 1 29 ALA MB 3.500 . 3.500 2.111 2.089 2.131 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
547 1 29 ALA H 1 30 PHE H 2.700 . 2.700 2.557 2.535 2.585 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
548 1 29 ALA H 1 30 PHE HA 5.000 . 5.000 5.157 5.141 5.170 0.170 37 0 "[ . 1 . 2 . 3 . 4]" 1
549 1 29 ALA H 1 30 PHE HB2 5.000 . 5.000 4.379 4.249 4.480 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
550 1 29 ALA H 1 30 PHE QD 5.000 . 5.000 4.372 4.299 4.461 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
551 1 29 ALA H 1 31 ILE H 5.000 . 5.000 3.870 3.839 3.895 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
552 1 29 ALA H 1 32 ASN H 5.000 . 5.000 4.584 4.551 4.630 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
553 1 29 ALA HA 1 30 PHE H 5.000 . 5.000 3.476 3.455 3.492 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
554 1 29 ALA HA 1 31 ILE H 5.000 . 5.000 4.388 4.329 4.453 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
555 1 29 ALA HA 1 32 ASN H 5.000 . 5.000 3.488 3.455 3.528 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
556 1 29 ALA HA 1 32 ASN QB 3.500 . 3.500 2.512 2.448 2.681 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
557 1 29 ALA HA 1 32 ASN QD 5.000 . 5.000 3.261 2.130 4.480 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
558 1 29 ALA HA 1 33 SER H 5.000 . 5.000 4.358 4.231 4.453 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
559 1 29 ALA MB 1 30 PHE H 5.000 . 5.000 2.384 2.332 2.426 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
560 1 29 ALA MB 1 30 PHE HA 5.000 . 5.000 3.639 3.616 3.666 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
561 1 29 ALA MB 1 30 PHE HB2 5.000 . 5.000 4.009 3.875 4.104 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
562 1 29 ALA MB 1 30 PHE QD 5.000 . 5.000 3.397 3.309 3.485 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
563 1 29 ALA MB 1 30 PHE QE 5.000 . 5.000 3.978 3.946 4.033 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
564 1 29 ALA MB 1 31 ILE H 5.000 . 5.000 4.344 4.325 4.358 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
565 1 29 ALA MB 1 32 ASN H 5.000 . 5.000 4.480 4.445 4.499 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
566 1 29 ALA MB 1 32 ASN QB 5.000 . 5.000 3.801 3.770 3.834 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
567 1 30 PHE H 1 30 PHE HB2 3.500 . 3.500 2.116 2.028 2.184 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
568 1 30 PHE H 1 30 PHE QD 5.000 . 5.000 2.797 2.732 2.875 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
569 1 30 PHE H 1 31 ILE H 3.500 . 3.500 2.494 2.465 2.531 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
570 1 30 PHE H 1 31 ILE QG 5.000 . 5.000 4.038 3.978 4.095 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
571 1 30 PHE H 1 32 ASN H 5.000 . 5.000 3.808 3.764 3.844 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
572 1 30 PHE HA 1 31 ILE H 5.000 . 5.000 3.579 3.571 3.583 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
573 1 30 PHE HA 1 33 SER H 5.000 . 5.000 2.805 2.744 2.894 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
574 1 30 PHE HA 1 33 SER HB2 5.000 . 5.000 2.573 2.411 2.666 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
575 1 30 PHE HA 1 44 LEU MD2 5.000 . 5.000 3.333 3.219 3.475 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
576 1 30 PHE HB2 1 31 ILE H 5.000 . 5.000 2.739 2.644 2.805 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
577 1 30 PHE HB2 1 32 ASN H 5.000 . 5.000 4.833 4.767 4.892 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
578 1 30 PHE HB2 1 48 ALA MB 5.000 . 5.000 3.972 3.730 4.165 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
579 1 30 PHE HB3 1 34 LEU MD1 5.000 . 5.000 3.987 3.818 4.132 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
580 1 30 PHE QD 1 31 ILE H 5.000 . 5.000 4.414 4.351 4.484 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
581 1 30 PHE QD 1 33 SER H 5.000 . 5.000 4.629 4.594 4.705 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
582 1 30 PHE QD 1 33 SER HB2 5.000 . 5.000 3.034 2.957 3.157 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
583 1 30 PHE QD 1 44 LEU HA 5.000 . 5.000 3.431 3.245 3.549 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
584 1 30 PHE QD 1 44 LEU HB3 5.000 . 5.000 1.918 1.835 1.969 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
585 1 30 PHE QD 1 44 LEU MD2 5.000 . 5.000 2.437 2.284 2.724 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
586 1 30 PHE QD 1 44 LEU HG 5.000 . 5.000 4.573 4.505 4.681 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
587 1 30 PHE QD 1 45 LEU HA 5.000 . 5.000 4.408 4.022 4.516 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
588 1 30 PHE QD 1 48 ALA H 5.000 . 5.000 4.223 4.078 4.285 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
589 1 30 PHE QD 1 48 ALA MB 5.000 . 5.000 2.932 2.833 3.143 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
590 1 30 PHE QE 1 44 LEU HB3 5.000 . 5.000 3.320 3.174 3.392 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
591 1 30 PHE QE 1 44 LEU MD2 5.000 . 5.000 2.690 2.493 3.020 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
592 1 30 PHE QE 1 45 LEU HA 5.000 . 5.000 4.642 4.606 4.749 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
593 1 30 PHE QE 1 47 GLU QB 5.000 . 5.000 2.017 1.902 2.122 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
594 1 30 PHE QE 1 47 GLU QG 5.000 . 5.000 3.824 3.403 3.949 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
595 1 30 PHE QE 1 48 ALA HA 5.000 . 5.000 2.609 2.512 2.684 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
596 1 30 PHE QE 1 48 ALA MB 5.000 . 5.000 2.839 2.733 3.034 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
597 1 30 PHE QE 1 51 LEU QB 5.000 . 5.000 2.832 2.725 2.939 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
598 1 30 PHE QE 1 51 LEU QD 5.000 . 5.000 3.002 2.105 3.202 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
599 1 30 PHE QE 1 51 LEU HG 5.000 . 5.000 2.853 2.406 4.694 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
600 1 30 PHE HZ 1 47 GLU HA 5.000 . 5.000 4.605 4.355 4.732 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
601 1 30 PHE HZ 1 47 GLU QB 5.000 . 5.000 2.539 2.384 2.656 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
602 1 30 PHE HZ 1 47 GLU QG 5.000 . 5.000 4.448 4.259 4.528 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
603 1 30 PHE HZ 1 48 ALA H 5.000 . 5.000 3.389 3.315 3.509 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
604 1 30 PHE HZ 1 48 ALA HA 5.000 . 5.000 2.302 2.168 2.492 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
605 1 30 PHE HZ 1 48 ALA MB 5.000 . 5.000 3.313 3.166 3.494 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
606 1 30 PHE HZ 1 51 LEU H 5.000 . 5.000 4.145 3.996 4.260 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
607 1 30 PHE HZ 1 51 LEU QB 5.000 . 5.000 2.870 2.662 2.997 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
608 1 30 PHE HZ 1 51 LEU QD 5.000 . 5.000 2.117 1.799 2.296 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
609 1 30 PHE HZ 1 51 LEU HG 5.000 . 5.000 2.483 1.985 4.507 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
610 1 31 ILE H 1 31 ILE HB 3.500 . 3.500 2.712 2.670 2.749 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
611 1 31 ILE H 1 31 ILE MD 5.000 . 5.000 3.580 3.562 3.600 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
612 1 31 ILE H 1 31 ILE QG 5.000 . 5.000 2.058 2.023 2.090 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
613 1 31 ILE H 1 32 ASN H 5.000 . 5.000 2.519 2.497 2.554 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
614 1 31 ILE H 1 33 SER H 5.000 . 5.000 4.061 3.997 4.149 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
615 1 31 ILE HA 1 32 ASN H 5.000 . 5.000 3.493 3.485 3.502 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
616 1 31 ILE HA 1 33 SER H 5.000 . 5.000 4.470 4.328 4.592 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
617 1 31 ILE HA 1 34 LEU H 5.000 . 5.000 3.671 3.541 3.771 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
618 1 31 ILE HA 1 34 LEU QB 5.000 . 5.000 3.679 3.508 3.842 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
619 1 31 ILE HA 1 34 LEU MD1 5.000 . 5.000 2.393 2.252 2.575 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
620 1 31 ILE HA 1 34 LEU HG 5.000 . 5.000 2.177 2.018 2.309 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
621 1 31 ILE HA 1 35 ARG H 5.000 . 5.000 4.819 4.638 4.977 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
622 1 31 ILE HB 1 32 ASN H 5.000 . 5.000 2.498 2.441 2.555 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
623 1 31 ILE MD 1 31 ILE MG 2.700 . 2.700 1.886 1.874 1.907 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
624 1 31 ILE MD 1 32 ASN H 5.000 . 5.000 4.291 4.259 4.338 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
625 1 31 ILE QG 1 32 ASN H 5.000 . 5.000 3.788 3.741 3.838 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
626 1 31 ILE MG 1 32 ASN H 5.000 . 5.000 3.580 3.526 3.626 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
627 1 31 ILE MG 1 35 ARG QD 5.000 . 5.000 3.710 3.566 3.772 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
628 1 32 ASN H 1 32 ASN QB 3.500 . 3.500 2.117 2.048 2.232 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
629 1 32 ASN H 1 32 ASN QD 5.000 . 5.000 2.874 2.117 4.047 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
630 1 32 ASN H 1 33 SER H 3.500 . 3.500 2.672 2.643 2.705 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
631 1 32 ASN H 1 34 LEU H 5.000 . 5.000 4.111 4.071 4.154 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
632 1 32 ASN HA 1 33 SER H 3.500 . 3.500 3.557 3.541 3.570 0.070 14 0 "[ . 1 . 2 . 3 . 4]" 1
633 1 32 ASN HA 1 34 LEU H 5.000 . 5.000 4.268 4.210 4.354 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
634 1 32 ASN HA 1 34 LEU HG 5.000 . 5.000 5.023 4.944 5.070 0.070 20 0 "[ . 1 . 2 . 3 . 4]" 1
635 1 32 ASN HA 1 35 ARG H 3.500 . 3.500 3.656 3.582 3.713 0.213 37 0 "[ . 1 . 2 . 3 . 4]" 1
636 1 32 ASN HA 1 35 ARG HB3 5.000 . 5.000 4.241 3.623 4.595 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
637 1 32 ASN HA 1 35 ARG QG 5.000 . 5.000 2.620 2.216 3.328 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
638 1 32 ASN HA 1 36 ASP H 5.000 . 5.000 4.254 4.157 4.409 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
639 1 32 ASN QB 1 33 SER H 3.500 . 3.500 2.680 2.452 2.805 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
640 1 32 ASN QB 1 34 LEU H 5.000 . 5.000 4.639 4.585 4.683 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
641 1 33 SER H 1 33 SER HB2 3.500 . 3.500 2.596 2.545 2.644 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
642 1 33 SER H 1 34 LEU MD2 5.000 . 5.000 3.891 3.801 4.004 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
643 1 33 SER H 1 34 LEU HG 5.000 . 5.000 3.940 3.809 4.054 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
644 1 33 SER H 1 36 ASP QB 5.000 . 5.000 4.553 4.500 4.602 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
645 1 33 SER H 1 44 LEU MD2 5.000 . 5.000 4.233 4.202 4.262 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
646 1 33 SER HA 1 34 LEU H 3.500 . 3.500 3.524 3.512 3.539 0.039 28 0 "[ . 1 . 2 . 3 . 4]" 1
647 1 33 SER HA 1 36 ASP H 5.000 . 5.000 3.289 3.162 3.389 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
648 1 33 SER HA 1 36 ASP QB 5.000 . 5.000 2.089 2.034 2.320 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
649 1 33 SER HA 1 37 ASP H 5.000 . 5.000 4.186 4.039 4.299 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
650 1 33 SER HA 1 44 LEU MD1 5.000 . 5.000 3.455 3.310 3.637 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
651 1 33 SER HA 1 44 LEU MD2 5.000 . 5.000 3.859 3.768 3.940 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
652 1 33 SER HB2 1 34 LEU H 3.500 . 3.500 2.734 2.694 2.793 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
653 1 33 SER HB2 1 44 LEU MD1 3.500 . 3.500 2.133 2.057 2.221 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
654 1 33 SER HB2 1 44 LEU MD2 5.000 . 5.000 2.074 2.040 2.108 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
655 1 33 SER HB3 1 44 LEU MD1 5.000 . 5.000 2.133 2.006 2.322 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
656 1 34 LEU H 1 34 LEU QB 3.500 . 3.500 2.855 2.812 2.936 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
657 1 34 LEU H 1 34 LEU MD2 5.000 . 5.000 2.242 2.125 2.319 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
658 1 34 LEU H 1 34 LEU HG 3.500 . 3.500 2.009 1.936 2.096 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
659 1 34 LEU H 1 36 ASP H 5.000 . 5.000 3.944 3.914 3.983 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
660 1 34 LEU H 1 44 LEU MD2 5.000 . 5.000 4.383 4.329 4.455 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
661 1 34 LEU HA 1 34 LEU HG 3.500 . 3.500 3.515 3.487 3.552 0.052 14 0 "[ . 1 . 2 . 3 . 4]" 1
662 1 34 LEU HA 1 35 ARG H 3.500 . 3.500 3.557 3.542 3.566 0.066 8 0 "[ . 1 . 2 . 3 . 4]" 1
663 1 34 LEU HA 1 37 ASP H 5.000 . 5.000 3.495 3.384 3.587 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
664 1 34 LEU HA 1 38 PRO HA 5.000 . 5.000 3.138 2.979 3.339 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
665 1 34 LEU HA 1 40 GLN H 5.000 . 5.000 5.069 5.021 5.109 0.109 1 0 "[ . 1 . 2 . 3 . 4]" 1
666 1 34 LEU QB 1 35 ARG H 3.500 . 3.500 2.431 2.377 2.527 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
667 1 34 LEU QB 1 38 PRO HA 5.000 . 5.000 3.347 3.119 3.532 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
668 1 34 LEU MD1 1 34 LEU MD2 2.700 . 2.700 1.953 1.926 1.986 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
669 1 34 LEU MD1 1 41 SER QB 5.000 . 5.000 3.192 2.804 3.500 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
670 1 34 LEU MD2 1 35 ARG H 5.000 . 5.000 4.272 4.235 4.299 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
671 1 34 LEU MD2 1 38 PRO HA 0.000 . 6.000 4.267 4.051 4.474 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
672 1 34 LEU MD2 1 41 SER QB 5.000 . 5.000 2.564 2.228 3.026 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
673 1 35 ARG H 1 35 ARG HA 2.700 . 2.700 2.867 2.851 2.874 0.174 13 0 "[ . 1 . 2 . 3 . 4]" 1
674 1 35 ARG H 1 35 ARG HB3 3.500 . 3.500 2.516 2.175 2.786 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
675 1 35 ARG H 1 35 ARG QD 5.000 . 5.000 3.663 3.397 3.772 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
676 1 35 ARG H 1 35 ARG QG 3.500 . 3.500 2.225 1.811 2.889 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
677 1 35 ARG H 1 36 ASP H 3.500 . 3.500 2.466 2.450 2.501 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
678 1 35 ARG H 1 37 ASP H 5.000 . 5.000 3.666 3.638 3.722 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
679 1 35 ARG HA 1 35 ARG QD 5.000 . 5.000 4.269 4.248 4.449 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
680 1 35 ARG HA 1 36 ASP H 5.000 . 5.000 3.485 3.477 3.493 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
681 1 35 ARG HB2 1 35 ARG QG 2.700 . 2.700 2.337 2.250 2.398 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
682 1 35 ARG HB2 1 36 ASP H 5.000 . 5.000 3.940 3.744 4.181 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
683 1 35 ARG HB3 1 35 ARG QD 3.500 . 3.500 2.353 2.095 2.449 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
684 1 35 ARG HB3 1 35 ARG QG 2.700 . 2.700 2.391 2.330 2.478 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
685 1 35 ARG HB3 1 37 ASP H 5.000 . 5.000 5.236 5.158 5.290 0.290 22 0 "[ . 1 . 2 . 3 . 4]" 1
686 1 35 ARG QD 1 36 ASP H 5.000 . 5.000 4.242 4.074 4.349 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
687 1 35 ARG QG 1 36 ASP H 5.000 . 5.000 2.171 2.025 2.241 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
688 1 35 ARG QG 1 36 ASP HA 5.000 . 5.000 3.325 3.109 3.539 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
689 1 36 ASP H 1 36 ASP QB 3.500 . 3.500 2.344 2.117 2.398 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
690 1 36 ASP H 1 37 ASP QB 5.000 . 5.000 4.593 4.547 4.625 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
691 1 36 ASP HA 1 37 ASP H 3.500 . 3.500 3.420 3.411 3.436 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
692 1 36 ASP QB 1 37 ASP H 3.500 . 3.500 2.962 2.910 2.994 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
693 1 37 ASP H 1 38 PRO HA 5.000 . 5.000 4.287 4.251 4.316 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
694 1 37 ASP H 1 38 PRO QD 5.000 . 5.000 3.141 2.985 3.281 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
695 1 37 ASP HA 1 38 PRO QD 3.500 . 3.500 2.054 2.016 2.093 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
696 1 37 ASP HA 1 38 PRO QG 5.000 . 5.000 3.973 3.937 4.010 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
697 1 37 ASP HA 1 39 SER H 5.000 . 5.000 3.575 3.459 3.725 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
698 1 37 ASP QB 1 38 PRO QD 5.000 . 5.000 3.822 3.798 3.838 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
699 1 37 ASP QB 1 39 SER H 5.000 . 5.000 4.409 4.305 4.523 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
700 1 37 ASP QB 1 40 GLN H 5.000 . 5.000 3.254 3.170 3.437 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
701 1 37 ASP QB 1 40 GLN HB2 5.000 . 5.000 2.088 1.982 2.245 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
702 1 37 ASP QB 1 40 GLN QG 5.000 . 5.000 3.225 2.912 3.711 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
703 1 38 PRO HA 1 39 SER H 5.000 . 5.000 3.524 3.502 3.555 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
704 1 38 PRO HA 1 40 GLN H 5.000 . 5.000 3.917 3.837 4.016 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
705 1 38 PRO HA 1 41 SER H 5.000 . 5.000 3.200 3.088 3.272 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
706 1 38 PRO QD 1 39 SER H 5.000 . 5.000 2.291 2.201 2.369 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
707 1 39 SER H 1 40 GLN H 5.000 . 5.000 2.500 2.462 2.530 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
708 1 39 SER H 1 40 GLN HA 5.000 . 5.000 5.168 5.143 5.185 0.185 25 0 "[ . 1 . 2 . 3 . 4]" 1
709 1 39 SER H 1 40 GLN HB2 5.000 . 5.000 4.675 4.568 4.786 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
710 1 39 SER H 1 40 GLN QG 5.000 . 5.000 4.332 4.188 4.444 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
711 1 39 SER H 1 41 SER H 5.000 . 5.000 3.868 3.800 3.939 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
712 1 39 SER HA 1 40 GLN H 5.000 . 5.000 3.472 3.443 3.486 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
713 1 39 SER HA 1 41 SER H 5.000 . 5.000 3.730 3.650 3.847 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
714 1 39 SER HA 1 42 ALA H 5.000 . 5.000 4.812 4.446 5.030 0.030 35 0 "[ . 1 . 2 . 3 . 4]" 1
715 1 40 GLN H 1 40 GLN QG 5.000 . 5.000 2.631 2.558 2.749 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
716 1 40 GLN H 1 44 LEU MD1 5.000 . 5.000 3.819 3.701 3.901 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
717 1 40 GLN HA 1 40 GLN QE 5.000 . 5.000 3.509 2.669 4.522 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
718 1 40 GLN HA 1 41 SER H 5.000 . 5.000 3.231 3.154 3.347 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
719 1 40 GLN HA 1 42 ALA H 5.000 . 5.000 3.450 3.368 3.636 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
720 1 40 GLN HA 1 43 ASN H 5.000 . 5.000 2.714 2.600 2.799 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
721 1 40 GLN HA 1 43 ASN QB 5.000 . 5.000 2.607 2.437 2.837 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
722 1 40 GLN HA 1 44 LEU MD1 5.000 . 5.000 4.141 4.005 4.198 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
723 1 40 GLN HB2 1 41 SER H 5.000 . 5.000 3.748 3.531 3.864 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
724 1 40 GLN HB2 1 44 LEU MD1 3.500 . 3.500 2.698 2.461 2.828 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
725 1 40 GLN HB3 1 43 ASN QB 5.000 . 5.000 2.303 2.066 2.587 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
726 1 40 GLN HB3 1 44 LEU H 5.000 . 5.000 3.662 3.448 3.806 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
727 1 40 GLN HB3 1 44 LEU MD1 5.000 . 5.000 2.995 2.773 3.195 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
728 1 40 GLN HB3 1 44 LEU HG 3.500 . 3.500 2.682 2.378 2.946 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
729 1 40 GLN QG 1 41 SER H 5.000 . 5.000 4.489 4.445 4.524 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
730 1 41 SER H 1 42 ALA H 5.000 . 5.000 2.567 2.534 2.608 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
731 1 41 SER H 1 42 ALA HA 5.000 . 5.000 5.219 5.168 5.244 0.244 31 0 "[ . 1 . 2 . 3 . 4]" 1
732 1 41 SER H 1 42 ALA MB 5.000 . 5.000 4.156 4.082 4.196 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
733 1 41 SER H 1 44 LEU MD1 5.000 . 5.000 3.322 3.051 3.514 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
734 1 41 SER HA 1 41 SER QB 2.700 . 2.700 2.257 2.206 2.417 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
735 1 41 SER HA 1 42 ALA H 5.000 . 5.000 3.465 3.438 3.500 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
736 1 41 SER HA 1 44 LEU H 5.000 . 5.000 3.473 3.201 3.647 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
737 1 41 SER HA 1 44 LEU MD1 0.000 . 5.000 2.162 2.006 2.529 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
738 1 41 SER HA 1 45 LEU H 5.000 . 5.000 4.239 3.409 4.547 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
739 1 41 SER QB 1 42 ALA H 5.000 . 5.000 3.235 2.693 3.446 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
740 1 42 ALA H 1 43 ASN H 2.700 . 2.700 2.560 2.480 2.679 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
741 1 42 ALA H 1 43 ASN QB 5.000 . 5.000 4.253 4.136 4.419 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
742 1 42 ALA H 1 44 LEU H 5.000 . 5.000 3.848 3.768 3.953 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
743 1 42 ALA H 1 45 LEU H 5.000 . 5.000 4.847 4.224 5.132 0.132 21 0 "[ . 1 . 2 . 3 . 4]" 1
744 1 42 ALA H 1 45 LEU QD 5.000 . 5.000 3.810 3.697 3.990 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
745 1 42 ALA HA 1 43 ASN H 3.500 . 3.500 3.512 3.491 3.557 0.057 35 0 "[ . 1 . 2 . 3 . 4]" 1
746 1 42 ALA HA 1 44 LEU H 5.000 . 5.000 4.313 4.216 4.481 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
747 1 42 ALA HA 1 45 LEU H 5.000 . 5.000 3.763 3.191 4.098 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
748 1 42 ALA HA 1 45 LEU QD 5.000 . 5.000 2.023 1.853 2.182 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
749 1 42 ALA HA 1 46 ALA H 5.000 . 5.000 4.448 3.698 4.974 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
750 1 42 ALA MB 1 43 ASN H 5.000 . 5.000 2.460 2.279 2.593 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
751 1 42 ALA MB 1 43 ASN HA 5.000 . 5.000 3.796 3.711 3.885 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
752 1 42 ALA MB 1 43 ASN QB 5.000 . 5.000 3.779 3.585 3.923 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
753 1 42 ALA MB 1 44 LEU H 5.000 . 5.000 4.270 4.209 4.317 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
754 1 43 ASN H 1 43 ASN QB 3.500 . 3.500 2.138 2.085 2.194 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
755 1 43 ASN H 1 43 ASN QD 5.000 . 5.000 3.898 1.862 4.566 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
756 1 43 ASN H 1 44 LEU H 3.500 . 3.500 2.325 2.260 2.380 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
757 1 43 ASN H 1 44 LEU HA 5.000 . 5.000 4.970 4.876 5.043 0.043 20 0 "[ . 1 . 2 . 3 . 4]" 1
758 1 43 ASN H 1 44 LEU MD1 0.000 . 6.000 4.320 4.235 4.448 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
759 1 43 ASN H 1 44 LEU MD2 0.000 . 6.000 5.245 5.226 5.299 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
760 1 43 ASN H 1 45 LEU H 5.000 . 5.000 4.145 3.530 4.375 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
761 1 43 ASN HA 1 44 LEU H 5.000 . 5.000 3.438 3.413 3.464 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
762 1 43 ASN HA 1 45 LEU H 5.000 . 5.000 4.513 4.152 4.741 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
763 1 43 ASN HA 1 46 ALA H 5.000 . 5.000 3.449 3.086 3.582 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
764 1 43 ASN HA 1 46 ALA MB 5.000 . 5.000 2.169 1.998 2.325 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
765 1 43 ASN HA 1 47 GLU H 5.000 . 5.000 4.084 3.787 4.291 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
766 1 43 ASN QB 1 44 LEU H 5.000 . 5.000 2.415 2.363 2.454 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
767 1 43 ASN QB 1 44 LEU HA 5.000 . 5.000 3.686 3.487 3.897 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
768 1 43 ASN QB 1 44 LEU MD1 5.000 . 5.000 3.836 3.786 3.864 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
769 1 43 ASN QB 1 44 LEU MD2 5.000 . 5.000 3.739 3.671 3.800 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
770 1 43 ASN QB 1 44 LEU HG 5.000 . 5.000 2.711 2.606 2.829 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
771 1 43 ASN QB 1 45 LEU H 5.000 . 5.000 4.660 4.310 4.772 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
772 1 43 ASN QB 1 46 ALA H 5.000 . 5.000 4.628 4.522 4.712 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
773 1 43 ASN QB 1 46 ALA MB 5.000 . 5.000 3.726 3.574 3.875 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
774 1 44 LEU H 1 44 LEU HB2 3.500 . 3.500 2.282 2.237 2.322 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
775 1 44 LEU H 1 44 LEU MD1 5.000 . 5.000 3.186 3.139 3.241 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
776 1 44 LEU H 1 44 LEU HG 3.500 . 3.500 2.197 2.116 2.275 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
777 1 44 LEU H 1 45 LEU H 3.500 . 3.500 2.695 2.274 2.915 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
778 1 44 LEU H 1 46 ALA H 5.000 . 5.000 3.680 3.399 3.886 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
779 1 44 LEU H 1 46 ALA MB 5.000 . 5.000 4.144 3.944 4.254 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
780 1 44 LEU H 1 47 GLU H 5.000 . 5.000 4.291 4.061 4.427 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
781 1 44 LEU H 1 47 GLU QB 5.000 . 5.000 4.368 4.199 4.449 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
782 1 44 LEU HA 1 45 LEU H 5.000 . 5.000 3.524 3.413 3.572 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
783 1 44 LEU HA 1 46 ALA H 5.000 . 5.000 4.003 3.930 4.084 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
784 1 44 LEU HA 1 47 GLU H 3.500 . 3.500 2.976 2.925 3.069 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
785 1 44 LEU HA 1 47 GLU QB 3.500 . 3.500 1.998 1.914 2.081 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
786 1 44 LEU HA 1 47 GLU QG 5.000 . 5.000 3.631 3.302 3.893 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
787 1 44 LEU HA 1 48 ALA H 5.000 . 5.000 3.621 3.513 3.797 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
788 1 44 LEU HB2 1 44 LEU MD1 3.500 . 3.500 2.338 2.304 2.351 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
789 1 44 LEU HB2 1 44 LEU HG 2.700 . 2.700 2.577 2.550 2.600 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
790 1 44 LEU HB2 1 47 GLU QB 5.000 . 5.000 4.689 4.607 4.775 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
791 1 44 LEU HB3 1 44 LEU MD1 3.500 . 3.500 2.534 2.479 2.599 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
792 1 44 LEU HB3 1 45 LEU H 5.000 . 5.000 3.574 3.321 3.666 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
793 1 44 LEU HB3 1 47 GLU H 5.000 . 5.000 5.000 4.943 5.052 0.052 26 0 "[ . 1 . 2 . 3 . 4]" 1
794 1 44 LEU HB3 1 47 GLU QB 5.000 . 5.000 3.965 3.890 4.131 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
795 1 44 LEU MD2 1 45 LEU H 6.000 . 6.000 4.640 4.451 4.744 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
796 1 44 LEU MD2 1 47 GLU H 5.000 . 5.000 4.374 4.303 4.501 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
797 1 44 LEU MD2 1 47 GLU QB 5.000 . 5.000 2.863 2.728 3.102 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
798 1 44 LEU MD2 1 47 GLU QG 5.000 . 5.000 3.690 3.113 3.846 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
799 1 45 LEU H 1 45 LEU QB 3.500 . 3.500 2.749 1.911 3.163 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
800 1 45 LEU H 1 45 LEU QD 5.000 . 5.000 2.138 1.500 3.439 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
801 1 45 LEU H 1 45 LEU HG 5.000 . 5.000 3.609 2.971 4.271 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
802 1 45 LEU H 1 46 ALA H 3.500 . 3.500 2.311 2.253 2.391 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
803 1 45 LEU H 1 46 ALA MB 5.000 . 5.000 3.924 3.849 4.065 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
804 1 45 LEU H 1 47 GLU H 5.000 . 5.000 3.857 3.770 3.920 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
805 1 45 LEU H 1 47 GLU QB 5.000 . 5.000 4.474 4.334 4.598 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
806 1 45 LEU H 1 48 ALA MB 5.000 . 5.000 4.127 4.066 4.266 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
807 1 45 LEU HA 1 45 LEU QD 3.500 . 3.500 2.660 2.548 2.817 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
808 1 45 LEU HA 1 46 ALA H 5.000 . 5.000 3.445 3.416 3.480 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
809 1 45 LEU HA 1 47 GLU H 5.000 . 5.000 4.173 3.989 4.418 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
810 1 45 LEU HA 1 48 ALA H 5.000 . 5.000 3.009 2.834 3.331 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
811 1 45 LEU HA 1 48 ALA MB 5.000 . 5.000 1.982 1.855 2.207 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
812 1 45 LEU QB 1 45 LEU HG 2.700 . 2.700 2.229 2.139 2.422 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
813 1 45 LEU QB 1 46 ALA H 3.500 . 3.500 3.101 2.450 3.321 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
814 1 45 LEU QD 1 46 ALA H 5.000 . 5.000 2.569 1.891 3.687 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
815 1 45 LEU QD 1 46 ALA HA 0.000 . 5.000 3.556 2.512 3.872 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
816 1 45 LEU QD 1 48 ALA H 0.000 . 6.000 4.393 4.144 4.546 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
817 1 45 LEU QD 1 49 LYS H 0.000 . 6.000 4.309 3.430 4.697 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
818 1 45 LEU QD 1 49 LYS QE 5.000 . 5.000 2.876 1.883 3.384 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
819 1 45 LEU HG 1 49 LYS QE 5.000 . 5.000 3.825 3.363 4.526 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
820 1 46 ALA H 1 46 ALA MB 3.500 . 3.500 2.101 2.045 2.248 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
821 1 46 ALA H 1 47 GLU H 2.700 . 2.700 2.517 2.432 2.560 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
822 1 46 ALA H 1 47 GLU QB 5.000 . 5.000 4.055 3.970 4.122 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
823 1 46 ALA H 1 48 ALA H 5.000 . 5.000 3.799 3.698 3.869 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
824 1 46 ALA H 1 48 ALA MB 5.000 . 5.000 4.319 4.242 4.376 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
825 1 46 ALA HA 1 47 GLU H 3.500 . 3.500 3.513 3.490 3.545 0.045 4 0 "[ . 1 . 2 . 3 . 4]" 1
826 1 46 ALA HA 1 49 LYS H 5.000 . 5.000 3.519 3.267 3.719 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
827 1 46 ALA HA 1 49 LYS HB2 3.500 . 3.500 2.735 2.435 2.862 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
828 1 46 ALA HA 1 49 LYS QD 5.000 . 5.000 2.859 2.533 3.124 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
829 1 46 ALA HA 1 49 LYS QG 5.000 . 5.000 3.780 3.396 4.044 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
830 1 46 ALA HA 1 50 LYS H 5.000 . 5.000 4.163 4.005 4.298 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
831 1 46 ALA MB 1 47 GLU H 5.000 . 5.000 2.409 2.363 2.485 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
832 1 46 ALA MB 1 47 GLU QB 5.000 . 5.000 3.815 3.740 3.883 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
833 1 46 ALA MB 1 47 GLU QG 5.000 . 5.000 3.519 3.120 3.832 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
834 1 46 ALA MB 1 48 ALA H 5.000 . 5.000 4.323 4.255 4.392 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
835 1 46 ALA MB 1 50 LYS QE 5.000 . 5.000 3.403 2.599 3.830 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
836 1 47 GLU H 1 47 GLU QB 3.500 . 3.500 1.987 1.961 2.032 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
837 1 47 GLU H 1 47 GLU QG 5.000 . 5.000 2.971 2.619 3.324 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
838 1 47 GLU H 1 48 ALA H 2.700 . 2.700 2.448 2.385 2.492 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
839 1 47 GLU H 1 48 ALA HA 5.000 . 5.000 5.099 5.053 5.130 0.130 12 0 "[ . 1 . 2 . 3 . 4]" 1
840 1 47 GLU H 1 48 ALA MB 5.000 . 5.000 4.006 3.966 4.049 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
841 1 47 GLU H 1 49 LYS H 5.000 . 5.000 3.985 3.873 4.091 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
842 1 47 GLU H 1 50 LYS QB 5.000 . 5.000 4.486 4.272 4.613 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
843 1 47 GLU HA 1 47 GLU QG 3.500 . 3.500 2.291 1.993 2.779 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
844 1 47 GLU HA 1 48 ALA H 5.000 . 5.000 3.473 3.456 3.492 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
845 1 47 GLU HA 1 50 LYS H 5.000 . 5.000 3.366 3.178 3.486 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
846 1 47 GLU HA 1 50 LYS QB 3.500 . 3.500 2.302 2.090 2.543 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
847 1 47 GLU HA 1 50 LYS QE 5.000 . 5.000 3.113 1.999 4.490 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
848 1 47 GLU HA 1 51 LEU H 5.000 . 5.000 4.018 3.782 4.176 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
849 1 47 GLU QB 1 48 ALA H 5.000 . 5.000 2.378 2.278 2.559 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
850 1 47 GLU QB 1 48 ALA HA 5.000 . 5.000 3.701 3.564 3.813 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
851 1 47 GLU QB 1 48 ALA MB 5.000 . 5.000 3.579 3.492 3.735 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
852 1 47 GLU QB 1 49 LYS H 5.000 . 5.000 4.548 4.472 4.627 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
853 1 47 GLU QB 1 50 LYS H 5.000 . 5.000 4.575 4.517 4.614 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
854 1 47 GLU QB 1 51 LEU QD 5.000 . 5.000 2.459 2.162 2.634 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
855 1 47 GLU QG 1 48 ALA H 5.000 . 5.000 4.200 4.133 4.344 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
856 1 47 GLU QG 1 51 LEU QD 5.000 . 5.000 3.381 3.317 3.517 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
857 1 48 ALA H 1 49 LYS H 3.500 . 3.500 2.722 2.670 2.787 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
858 1 48 ALA H 1 49 LYS HB2 5.000 . 5.000 4.767 4.696 4.862 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
859 1 48 ALA H 1 50 LYS H 5.000 . 5.000 3.808 3.751 3.853 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
860 1 48 ALA H 1 51 LEU H 5.000 . 5.000 4.266 4.234 4.307 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
861 1 48 ALA H 1 51 LEU QB 5.000 . 5.000 4.232 4.072 4.468 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
862 1 48 ALA H 1 51 LEU QD 5.000 . 5.000 3.863 3.777 3.923 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
863 1 48 ALA HA 1 49 LYS H 5.000 . 5.000 3.528 3.509 3.546 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
864 1 48 ALA HA 1 50 LYS H 5.000 . 5.000 4.145 4.068 4.235 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
865 1 48 ALA HA 1 51 LEU H 5.000 . 5.000 3.077 2.982 3.193 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
866 1 48 ALA HA 1 51 LEU QB 5.000 . 5.000 1.950 1.862 2.174 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
867 1 48 ALA HA 1 51 LEU QD 5.000 . 5.000 3.043 2.755 3.302 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
868 1 48 ALA HA 1 51 LEU HG 5.000 . 5.000 3.422 3.023 5.007 0.007 20 0 "[ . 1 . 2 . 3 . 4]" 1
869 1 48 ALA HA 1 52 ASN H 5.000 . 5.000 3.697 3.581 3.818 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
870 1 48 ALA MB 1 49 LYS H 5.000 . 5.000 2.370 2.302 2.465 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
871 1 48 ALA MB 1 49 LYS HA 5.000 . 5.000 3.731 3.629 3.792 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
872 1 48 ALA MB 1 50 LYS H 5.000 . 5.000 4.208 4.167 4.249 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
873 1 48 ALA MB 1 51 LEU H 5.000 . 5.000 4.237 4.176 4.311 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
874 1 48 ALA MB 1 51 LEU QB 5.000 . 5.000 3.470 3.353 3.698 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
875 1 48 ALA MB 1 52 ASN H 5.000 . 5.000 4.282 4.222 4.357 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
876 1 49 LYS H 1 49 LYS HB2 3.500 . 3.500 2.377 2.341 2.412 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
877 1 49 LYS H 1 49 LYS QD 5.000 . 5.000 3.798 3.708 3.913 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
878 1 49 LYS H 1 49 LYS QE 5.000 . 5.000 4.363 4.238 4.545 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
879 1 49 LYS H 1 49 LYS QG 5.000 . 5.000 2.389 2.281 2.465 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
880 1 49 LYS H 1 50 LYS H 2.700 . 2.700 2.510 2.457 2.544 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
881 1 49 LYS H 1 51 LEU H 5.000 . 5.000 3.829 3.747 3.974 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
882 1 49 LYS H 1 52 ASN QB 5.000 . 5.000 4.452 4.304 4.530 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
883 1 49 LYS HA 1 49 LYS QD 5.000 . 5.000 3.977 3.932 4.007 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
884 1 49 LYS HA 1 49 LYS QG 3.500 . 3.500 2.312 2.263 2.337 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
885 1 49 LYS HA 1 50 LYS H 5.000 . 5.000 3.520 3.502 3.538 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
886 1 49 LYS HA 1 51 LEU H 5.000 . 5.000 4.232 4.129 4.376 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
887 1 49 LYS HA 1 52 ASN H 5.000 . 5.000 3.331 3.219 3.485 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
888 1 49 LYS HA 1 52 ASN QB 5.000 . 5.000 2.346 2.104 2.549 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
889 1 49 LYS HA 1 52 ASN QD 5.000 . 5.000 3.784 2.815 4.499 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
890 1 49 LYS HA 1 53 ASP H 5.000 . 5.000 3.888 3.747 4.021 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
891 1 49 LYS HB2 1 49 LYS QG 2.700 . 2.700 2.396 2.361 2.423 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
892 1 49 LYS HB2 1 50 LYS H 3.500 . 3.500 2.803 2.748 2.828 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
893 1 49 LYS HB3 1 49 LYS QE 5.000 . 5.000 4.079 3.950 4.259 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
894 1 49 LYS HB3 1 49 LYS QG 2.700 . 2.700 2.352 2.324 2.380 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
895 1 49 LYS QG 1 50 LYS H 5.000 . 5.000 4.183 4.099 4.229 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
896 1 50 LYS H 1 50 LYS QB 3.500 . 3.500 2.192 2.075 2.336 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
897 1 50 LYS H 1 50 LYS QD 5.000 . 5.000 3.752 2.800 4.587 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
898 1 50 LYS H 1 50 LYS QE 5.000 . 5.000 4.021 2.605 4.515 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
899 1 50 LYS H 1 50 LYS QG 5.000 . 5.000 3.317 2.430 4.052 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
900 1 50 LYS H 1 51 LEU H 2.700 . 2.700 2.408 2.352 2.509 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
901 1 50 LYS H 1 51 LEU QB 5.000 . 5.000 4.061 3.928 4.280 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
902 1 50 LYS H 1 51 LEU QD 5.000 . 5.000 3.847 3.811 3.884 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
903 1 50 LYS H 1 52 ASN H 5.000 . 5.000 3.931 3.837 4.016 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
904 1 50 LYS HA 1 50 LYS QD 5.000 . 5.000 3.329 1.889 4.105 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
905 1 50 LYS HA 1 51 LEU H 5.000 . 5.000 3.499 3.473 3.552 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
906 1 50 LYS HA 1 53 ASP H 5.000 . 5.000 3.598 3.451 3.771 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
907 1 50 LYS HA 1 53 ASP QB 5.000 . 5.000 2.707 2.554 2.889 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
908 1 50 LYS QB 1 51 LEU H 3.500 . 3.500 2.703 2.572 2.788 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
909 1 50 LYS QG 1 51 LEU H 5.000 . 5.000 4.268 3.821 4.510 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
910 1 51 LEU H 1 51 LEU QB 3.500 . 3.500 2.063 1.987 2.152 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
911 1 51 LEU H 1 51 LEU QD 5.000 . 5.000 2.339 2.263 2.414 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
912 1 51 LEU H 1 51 LEU HG 5.000 . 5.000 3.959 3.849 4.032 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
913 1 51 LEU H 1 52 ASN H 3.500 . 3.500 2.489 2.454 2.529 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
914 1 51 LEU H 1 52 ASN HA 5.000 . 5.000 5.130 5.097 5.159 0.159 35 0 "[ . 1 . 2 . 3 . 4]" 1
915 1 51 LEU H 1 52 ASN QB 5.000 . 5.000 4.077 3.939 4.172 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
916 1 51 LEU HA 1 51 LEU HG 3.500 . 3.500 3.404 2.183 3.651 0.151 19 0 "[ . 1 . 2 . 3 . 4]" 1
917 1 51 LEU HA 1 52 ASN H 5.000 . 5.000 3.499 3.480 3.520 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
918 1 51 LEU HA 1 54 ALA H 3.500 . 3.500 3.291 3.027 3.437 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
919 1 51 LEU HA 1 54 ALA MB 3.500 . 3.500 2.168 1.871 2.385 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
920 1 51 LEU HA 1 55 GLN H 5.000 . 5.000 3.465 2.990 3.741 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
921 1 51 LEU QB 1 51 LEU HG 2.700 . 2.700 2.192 2.151 2.386 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
922 1 51 LEU QB 1 52 ASN H 5.000 . 5.000 2.474 2.383 2.663 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
923 1 51 LEU QB 1 54 ALA H 5.000 . 5.000 4.598 4.529 4.666 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
924 1 51 LEU QD 1 52 ASN H 5.000 . 5.000 3.800 3.771 3.853 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
925 1 51 LEU QD 1 54 ALA H 0.000 . 6.000 4.278 4.150 4.517 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
926 1 51 LEU QD 1 54 ALA MB 5.000 . 5.000 2.956 2.744 3.250 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
927 1 51 LEU QD 1 55 GLN QE 5.000 . 5.000 3.438 3.399 3.497 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
928 1 51 LEU QD 1 55 GLN QG 5.000 . 5.000 2.537 2.229 3.366 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
929 1 51 LEU HG 1 52 ASN H 5.000 . 5.000 4.869 4.778 4.953 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
930 1 52 ASN H 1 52 ASN QD 5.000 . 5.000 4.424 4.198 4.648 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
931 1 52 ASN H 1 53 ASP H 3.500 . 3.500 2.619 2.594 2.650 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
932 1 52 ASN H 1 53 ASP HA 5.000 . 5.000 5.219 5.200 5.237 0.237 19 0 "[ . 1 . 2 . 3 . 4]" 1
933 1 52 ASN H 1 53 ASP QB 5.000 . 5.000 4.479 4.345 4.532 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
934 1 52 ASN H 1 54 ALA H 5.000 . 5.000 3.815 3.754 3.879 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
935 1 52 ASN HA 1 53 ASP H 0.000 . 5.000 3.502 3.491 3.518 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
936 1 52 ASN HA 1 55 GLN H 5.000 . 5.000 3.917 3.722 4.096 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
937 1 52 ASN HA 1 55 GLN QE 5.000 . 5.000 4.154 3.805 4.413 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
938 1 52 ASN HA 1 56 ALA H 5.000 . 5.000 3.635 3.420 3.871 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
939 1 52 ASN QB 1 53 ASP H 5.000 . 5.000 2.423 2.268 2.703 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
940 1 52 ASN QB 1 54 ALA H 5.000 . 5.000 4.522 4.454 4.629 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
941 1 52 ASN QD 1 53 ASP H 5.000 . 5.000 3.606 2.797 4.460 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
942 1 52 ASN QD 1 53 ASP HA 5.000 . 5.000 3.828 2.915 4.630 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
943 1 53 ASP H 1 53 ASP HA 2.700 . 2.700 2.812 2.787 2.826 0.126 33 0 "[ . 1 . 2 . 3 . 4]" 1
944 1 53 ASP H 1 53 ASP QB 2.700 . 2.700 2.317 2.225 2.384 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
945 1 53 ASP H 1 54 ALA MB 5.000 . 5.000 4.175 4.136 4.210 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
946 1 53 ASP H 1 55 GLN H 0.000 . 5.000 4.275 4.219 4.333 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
947 1 53 ASP HA 1 54 ALA H 3.500 . 3.500 3.516 3.499 3.531 0.031 33 0 "[ . 1 . 2 . 3 . 4]" 1
948 1 53 ASP HA 1 55 GLN H 5.000 . 5.000 4.695 4.659 4.745 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
949 1 53 ASP HA 1 56 ALA H 5.000 . 5.000 4.249 4.117 4.352 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
950 1 53 ASP HA 1 56 ALA MB 5.000 . 5.000 3.594 3.426 3.823 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
951 1 53 ASP QB 1 54 ALA H 3.500 . 3.500 2.610 2.559 2.682 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
952 1 53 ASP QB 1 54 ALA MB 5.000 . 5.000 3.731 3.686 3.775 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
953 1 54 ALA H 1 54 ALA MB 3.500 . 3.500 2.184 2.168 2.201 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
954 1 54 ALA H 1 55 GLN H 2.700 . 2.700 2.663 2.624 2.690 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
955 1 54 ALA H 1 55 GLN QG 5.000 . 5.000 4.375 4.222 4.476 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
956 1 54 ALA H 1 56 ALA H 5.000 . 5.000 4.198 4.110 4.325 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
957 1 54 ALA HA 1 55 GLN H 5.000 . 5.000 3.559 3.547 3.581 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
958 1 54 ALA HA 1 56 ALA H 5.000 . 5.000 4.941 4.815 5.047 0.047 27 0 "[ . 1 . 2 . 3 . 4]" 1
959 1 54 ALA MB 1 55 GLN H 5.000 . 5.000 2.444 2.407 2.494 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
960 1 54 ALA MB 1 55 GLN HA 5.000 . 5.000 3.726 3.678 3.760 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
961 1 54 ALA MB 1 55 GLN HB3 0.000 . 6.000 5.019 4.983 5.053 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
962 1 54 ALA MB 1 55 GLN QG 5.000 . 5.000 2.857 2.756 2.997 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
963 1 54 ALA MB 1 56 ALA H 5.000 . 5.000 4.466 4.420 4.522 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
964 1 55 GLN H 1 55 GLN HB2 3.500 . 3.500 2.347 2.287 2.380 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
965 1 55 GLN H 1 55 GLN QE 5.000 . 5.000 4.111 3.965 4.208 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
966 1 55 GLN H 1 55 GLN QG 5.000 . 5.000 2.416 2.282 2.513 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
967 1 55 GLN H 1 56 ALA H 3.500 . 3.500 2.393 2.304 2.493 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
968 1 55 GLN H 1 56 ALA MB 5.000 . 5.000 4.204 4.144 4.253 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
969 1 55 GLN HA 1 55 GLN QE 5.000 . 5.000 4.161 4.111 4.243 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
970 1 55 GLN HA 1 55 GLN QG 3.500 . 3.500 2.343 2.263 2.410 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
971 1 55 GLN HA 1 56 ALA H 5.000 . 5.000 3.508 3.498 3.523 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
972 1 55 GLN HB2 1 55 GLN QE 3.500 . 3.500 1.996 1.894 2.067 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
973 1 55 GLN HB2 1 56 ALA H 5.000 . 5.000 2.334 2.234 2.411 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
974 1 55 GLN QE 1 57 PRO HA 5.000 . 5.000 4.730 4.672 4.835 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
975 1 55 GLN QG 1 56 ALA H 5.000 . 5.000 3.948 3.875 4.010 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
976 1 56 ALA H 1 57 PRO QD 5.000 . 5.000 2.427 2.193 2.643 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
977 1 56 ALA HA 1 57 PRO QD 2.700 . 2.700 2.212 2.012 2.393 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
978 1 56 ALA HA 1 57 PRO QG 5.000 . 5.000 3.796 3.609 4.295 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
979 1 56 ALA MB 1 57 PRO QD 5.000 . 5.000 3.557 3.518 3.592 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
980 1 57 PRO HA 1 58 LYS H 2.700 . 2.700 2.230 2.109 2.784 0.084 33 0 "[ . 1 . 2 . 3 . 4]" 1
981 1 57 PRO HA 1 58 LYS HB2 5.000 . 5.000 4.595 4.389 4.964 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
982 1 57 PRO HA 1 58 LYS QG 5.000 . 5.000 3.974 3.409 4.482 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
983 1 57 PRO QB 1 58 LYS H 5.000 . 5.000 3.644 2.132 3.993 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
984 1 57 PRO QD 1 58 LYS H 5.000 . 5.000 4.512 3.648 4.672 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
985 1 58 LYS H 1 58 LYS QE 5.000 . 5.000 4.300 2.257 4.538 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
986 1 58 LYS H 1 58 LYS QG 5.000 . 5.000 2.551 2.024 3.417 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
987 1 58 LYS HA 1 58 LYS QD 5.000 . 5.000 3.938 3.485 4.195 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
988 1 58 LYS HB2 1 58 LYS QD 2.700 . 2.700 2.388 2.205 2.488 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
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