NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
610966 |
5gow   |
36013 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_5gow
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 2566
_Distance_constraint_stats_list.Viol_count 2038
_Distance_constraint_stats_list.Viol_total 3953.825
_Distance_constraint_stats_list.Viol_max 0.652
_Distance_constraint_stats_list.Viol_rms 0.0264
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0039
_Distance_constraint_stats_list.Viol_average_violations_only 0.0970
_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 1 TYR 0.451 0.199 10 0 "[ . 1 . 2]"
1 2 VAL 0.149 0.078 2 0 "[ . 1 . 2]"
1 3 GLY 0.071 0.040 16 0 "[ . 1 . 2]"
1 4 GLU 0.989 0.481 17 0 "[ . 1 . 2]"
1 5 ASP 0.019 0.019 5 0 "[ . 1 . 2]"
1 6 ASP 0.933 0.481 17 0 "[ . 1 . 2]"
1 7 GLU 0.298 0.056 3 0 "[ . 1 . 2]"
1 8 GLU 0.524 0.077 16 0 "[ . 1 . 2]"
1 9 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 ASP 1.911 0.081 8 0 "[ . 1 . 2]"
1 11 ASP 1.482 0.081 8 0 "[ . 1 . 2]"
1 12 PHE 2.101 0.129 16 0 "[ . 1 . 2]"
1 13 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 14 GLU 1.022 0.129 16 0 "[ . 1 . 2]"
1 15 ASN 0.337 0.104 20 0 "[ . 1 . 2]"
1 16 ASP 0.114 0.045 13 0 "[ . 1 . 2]"
1 17 GLU 2.573 0.467 2 0 "[ . 1 . 2]"
1 18 ASP 2.552 0.467 2 0 "[ . 1 . 2]"
1 19 ASP 0.099 0.037 20 0 "[ . 1 . 2]"
2 3 MET 0.032 0.032 1 0 "[ . 1 . 2]"
2 4 ALA 0.188 0.156 3 0 "[ . 1 . 2]"
2 5 THR 0.156 0.156 3 0 "[ . 1 . 2]"
2 7 SER 0.851 0.496 11 0 "[ . 1 . 2]"
2 8 GLU 3.909 0.496 11 0 "[ . 1 . 2]"
2 9 GLU 1.840 0.285 14 0 "[ . 1 . 2]"
2 10 VAL 2.726 0.170 9 0 "[ . 1 . 2]"
2 11 LEU 1.566 0.090 12 0 "[ . 1 . 2]"
2 12 LEU 7.441 0.231 2 0 "[ . 1 . 2]"
2 13 ILE 0.111 0.080 12 0 "[ . 1 . 2]"
2 14 VAL 12.063 0.374 13 0 "[ . 1 . 2]"
2 15 LYS 2.253 0.133 17 0 "[ . 1 . 2]"
2 16 LYS 1.945 0.130 20 0 "[ . 1 . 2]"
2 17 VAL 1.297 0.114 15 0 "[ . 1 . 2]"
2 18 ARG 2.324 0.118 14 0 "[ . 1 . 2]"
2 19 GLN 0.448 0.106 9 0 "[ . 1 . 2]"
2 20 LYS 0.106 0.106 9 0 "[ . 1 . 2]"
2 21 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
2 22 GLN 2.626 0.387 8 0 "[ . 1 . 2]"
2 23 ASP 0.051 0.044 9 0 "[ . 1 . 2]"
2 24 GLY 0.310 0.068 15 0 "[ . 1 . 2]"
2 25 ALA 2.083 0.096 14 0 "[ . 1 . 2]"
2 26 LEU 27.939 0.425 15 0 "[ . 1 . 2]"
2 27 TYR 0.083 0.030 9 0 "[ . 1 . 2]"
2 28 LEU 6.953 0.223 3 0 "[ . 1 . 2]"
2 29 MET 3.817 0.234 11 0 "[ . 1 . 2]"
2 30 ALA 2.612 0.168 15 0 "[ . 1 . 2]"
2 31 GLU 0.765 0.652 15 1 "[ . 1 + 2]"
2 32 ARG 0.097 0.050 2 0 "[ . 1 . 2]"
2 33 ILE 2.766 0.295 7 0 "[ . 1 . 2]"
2 34 ALA 0.665 0.234 11 0 "[ . 1 . 2]"
2 35 TRP 20.792 0.425 15 0 "[ . 1 . 2]"
2 36 ALA 0.464 0.168 20 0 "[ . 1 . 2]"
2 37 PRO 0.383 0.130 12 0 "[ . 1 . 2]"
2 38 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
2 39 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
2 40 LYS 0.130 0.130 12 0 "[ . 1 . 2]"
2 41 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
2 42 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
2 43 PHE 0.204 0.168 20 0 "[ . 1 . 2]"
2 44 THR 0.023 0.011 20 0 "[ . 1 . 2]"
2 45 ILE 8.875 0.474 14 0 "[ . 1 . 2]"
2 46 SER 0.828 0.137 18 0 "[ . 1 . 2]"
2 47 HIS 0.290 0.054 18 0 "[ . 1 . 2]"
2 48 MET 0.812 0.081 2 0 "[ . 1 . 2]"
2 49 TYR 4.171 0.349 15 0 "[ . 1 . 2]"
2 50 ALA 0.198 0.059 10 0 "[ . 1 . 2]"
2 51 ASP 14.444 0.272 15 0 "[ . 1 . 2]"
2 52 ILE 2.591 0.252 6 0 "[ . 1 . 2]"
2 53 LYS 5.207 0.212 11 0 "[ . 1 . 2]"
2 54 CYS 4.779 0.166 19 0 "[ . 1 . 2]"
2 55 GLN 5.384 0.151 7 0 "[ . 1 . 2]"
2 56 LYS 1.982 0.151 7 0 "[ . 1 . 2]"
2 57 ILE 0.488 0.187 4 0 "[ . 1 . 2]"
2 58 SER 3.985 0.233 1 0 "[ . 1 . 2]"
2 59 PRO 0.373 0.065 13 0 "[ . 1 . 2]"
2 60 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
2 61 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
2 62 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
2 63 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
2 64 LYS 0.028 0.028 1 0 "[ . 1 . 2]"
2 65 ILE 2.661 0.178 17 0 "[ . 1 . 2]"
2 66 GLN 0.423 0.047 11 0 "[ . 1 . 2]"
2 67 LEU 7.696 0.368 4 0 "[ . 1 . 2]"
2 68 GLN 0.010 0.010 9 0 "[ . 1 . 2]"
2 69 LEU 4.499 0.147 13 0 "[ . 1 . 2]"
2 70 VAL 1.767 0.217 20 0 "[ . 1 . 2]"
2 71 LEU 5.607 0.252 6 0 "[ . 1 . 2]"
2 72 HIS 20.123 0.272 15 0 "[ . 1 . 2]"
2 73 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
2 74 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
2 75 ASP 3.479 0.205 20 0 "[ . 1 . 2]"
2 76 THR 1.782 0.217 20 0 "[ . 1 . 2]"
2 77 THR 2.782 0.147 13 0 "[ . 1 . 2]"
2 78 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
2 79 PHE 7.322 0.474 14 0 "[ . 1 . 2]"
2 80 HIS 1.848 0.118 14 0 "[ . 1 . 2]"
2 81 PHE 17.440 0.396 2 0 "[ . 1 . 2]"
2 82 SER 0.000 0.000 . 0 "[ . 1 . 2]"
2 83 ASN 0.290 0.084 10 0 "[ . 1 . 2]"
2 84 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
2 85 SER 0.000 0.000 . 0 "[ . 1 . 2]"
2 86 THR 0.000 0.000 . 0 "[ . 1 . 2]"
2 87 ALA 6.135 0.324 17 0 "[ . 1 . 2]"
2 88 VAL 2.711 0.114 4 0 "[ . 1 . 2]"
2 89 LYS 5.653 0.319 7 0 "[ . 1 . 2]"
2 90 GLU 5.580 0.387 3 0 "[ . 1 . 2]"
2 91 ARG 3.526 0.187 4 0 "[ . 1 . 2]"
2 92 ASP 7.823 0.319 7 0 "[ . 1 . 2]"
2 93 ALA 6.065 0.289 2 0 "[ . 1 . 2]"
2 94 VAL 7.253 0.396 2 0 "[ . 1 . 2]"
2 95 LYS 2.841 0.182 14 0 "[ . 1 . 2]"
2 96 ASP 6.686 0.289 2 0 "[ . 1 . 2]"
2 97 LEU 10.449 0.380 11 0 "[ . 1 . 2]"
2 98 LEU 7.225 0.345 16 0 "[ . 1 . 2]"
2 99 GLN 0.023 0.021 6 0 "[ . 1 . 2]"
2 100 GLN 7.460 0.256 15 0 "[ . 1 . 2]"
2 101 LEU 14.998 0.380 11 0 "[ . 1 . 2]"
2 102 LEU 10.308 0.288 10 0 "[ . 1 . 2]"
2 103 PRO 0.954 0.167 18 0 "[ . 1 . 2]"
2 104 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
2 105 PHE 2.791 0.652 15 1 "[ . 1 + 2]"
2 106 LYS 0.116 0.059 9 0 "[ . 1 . 2]"
2 107 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
2 108 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
2 109 ALA 1.240 0.189 1 0 "[ . 1 . 2]"
2 110 ASN 1.240 0.189 1 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 TYR HA 1 2 VAL QG 3.400 . 8.900 3.924 3.336 4.457 . 0 0 "[ . 1 . 2]" 1
2 1 1 TYR QB 1 2 VAL QG 3.900 . 10.900 3.272 2.512 4.411 . 0 0 "[ . 1 . 2]" 1
3 1 1 TYR QD 1 2 VAL HA 3.900 . 8.000 4.456 3.320 5.834 . 0 0 "[ . 1 . 2]" 1
4 1 1 TYR QD 1 2 VAL QG 3.900 . 11.900 3.500 1.722 4.612 0.078 2 0 "[ . 1 . 2]" 1
5 1 1 TYR QD 1 3 GLY QA 3.900 . 9.000 4.859 3.728 6.306 . 0 0 "[ . 1 . 2]" 1
6 1 1 TYR QD 1 4 GLU QB 3.900 . 9.000 4.223 2.744 5.934 . 0 0 "[ . 1 . 2]" 1
7 1 1 TYR QE 1 3 GLY QA 3.400 . 8.000 4.840 2.456 6.677 . 0 0 "[ . 1 . 2]" 1
8 1 1 TYR QE 1 4 GLU HA 3.400 . 7.000 5.151 2.145 6.455 . 0 0 "[ . 1 . 2]" 1
9 1 1 TYR QE 1 4 GLU QB 3.900 . 9.000 3.466 1.601 6.552 0.199 10 0 "[ . 1 . 2]" 1
10 1 1 TYR QE 1 4 GLU QG 3.900 . 9.000 4.440 2.790 6.367 . 0 0 "[ . 1 . 2]" 1
11 1 1 TYR QE 1 5 ASP QB 3.900 . 9.000 5.668 1.781 7.008 0.019 5 0 "[ . 1 . 2]" 1
12 1 1 TYR QE 1 2 VAL HA 3.900 . 8.000 5.955 4.235 6.947 . 0 0 "[ . 1 . 2]" 1
13 1 2 VAL HA 1 5 ASP QB 3.900 . 7.000 5.599 4.285 6.341 . 0 0 "[ . 1 . 2]" 1
14 1 2 VAL HB 1 3 GLY QA 3.900 . 7.000 4.530 3.541 5.255 . 0 0 "[ . 1 . 2]" 1
15 1 2 VAL QG 1 3 GLY QA 2.900 . 8.200 3.189 2.852 3.698 . 0 0 "[ . 1 . 2]" 1
16 1 2 VAL QG 1 5 ASP QB 3.400 . 9.900 5.737 4.681 6.321 . 0 0 "[ . 1 . 2]" 1
17 1 3 GLY QA 1 4 GLU QG 3.900 . 8.000 5.287 4.477 5.598 . 0 0 "[ . 1 . 2]" 1
18 1 1 TYR QD 1 4 GLU HA 3.900 . 8.000 5.415 3.382 6.384 . 0 0 "[ . 1 . 2]" 1
19 1 2 VAL QG 1 4 GLU HA 3.900 . 9.900 6.048 4.541 6.603 . 0 0 "[ . 1 . 2]" 1
20 1 4 GLU HA 1 5 ASP QB 3.400 . 6.000 4.129 3.871 4.497 . 0 0 "[ . 1 . 2]" 1
21 1 4 GLU QB 1 5 ASP HA 3.900 . 7.000 4.436 3.922 4.708 . 0 0 "[ . 1 . 2]" 1
22 1 4 GLU QB 1 5 ASP QB 3.900 . 8.000 5.088 4.458 5.468 . 0 0 "[ . 1 . 2]" 1
23 1 1 TYR QD 1 4 GLU QG 3.900 . 9.000 5.208 3.646 6.803 . 0 0 "[ . 1 . 2]" 1
24 1 4 GLU QG 1 6 ASP HA 3.900 . 7.000 4.875 3.394 6.248 . 0 0 "[ . 1 . 2]" 1
25 1 1 TYR QE 1 5 ASP HA 3.400 . 7.000 4.992 2.888 6.067 . 0 0 "[ . 1 . 2]" 1
26 1 6 ASP HA 1 7 GLU QB 3.400 . 6.000 4.142 3.824 4.356 . 0 0 "[ . 1 . 2]" 1
27 1 6 ASP HA 1 7 GLU QG 3.900 . 7.000 5.147 3.588 5.873 . 0 0 "[ . 1 . 2]" 1
28 1 8 GLU QB 1 9 ASP HA 3.400 . 6.000 4.322 3.681 4.608 . 0 0 "[ . 1 . 2]" 1
29 1 8 GLU QB 1 12 PHE QE 3.900 . 9.000 6.472 5.249 6.773 . 0 0 "[ . 1 . 2]" 1
30 1 8 GLU QG 1 12 PHE QE 3.900 . 9.000 6.588 5.852 6.882 . 0 0 "[ . 1 . 2]" 1
31 1 8 GLU QG 1 9 ASP HA 3.400 . 6.000 4.236 3.885 4.824 . 0 0 "[ . 1 . 2]" 1
32 1 8 GLU HA 1 9 ASP QB 3.400 . 6.000 4.598 4.399 4.779 . 0 0 "[ . 1 . 2]" 1
33 1 10 ASP HA 1 12 PHE QD 2.900 . 5.300 3.960 3.533 4.144 . 0 0 "[ . 1 . 2]" 1
34 1 10 ASP QB 1 12 PHE QD 3.400 . 8.000 5.285 5.023 5.413 . 0 0 "[ . 1 . 2]" 1
35 1 11 ASP HA 1 12 PHE HB3 3.900 . 6.000 5.800 5.742 5.885 . 0 0 "[ . 1 . 2]" 1
36 1 11 ASP HA 1 12 PHE QD 3.900 . 8.000 6.001 5.808 6.069 . 0 0 "[ . 1 . 2]" 1
37 1 11 ASP QB 1 12 PHE QD 3.900 . 9.000 5.994 5.898 6.050 . 0 0 "[ . 1 . 2]" 1
38 1 10 ASP HA 1 12 PHE QE 3.900 . 8.000 6.021 5.491 6.278 . 0 0 "[ . 1 . 2]" 1
39 1 12 PHE QD 1 13 ASN HA 3.900 . 8.000 5.104 5.003 5.195 . 0 0 "[ . 1 . 2]" 1
40 1 13 ASN HA 1 14 GLU HA 3.900 . 6.000 4.370 4.304 4.413 . 0 0 "[ . 1 . 2]" 1
41 1 13 ASN HA 1 14 GLU QB 3.400 . 6.000 4.276 3.824 4.713 . 0 0 "[ . 1 . 2]" 1
42 1 13 ASN HA 1 14 GLU QG 3.400 . 6.000 4.266 3.154 5.565 . 0 0 "[ . 1 . 2]" 1
43 1 12 PHE QD 1 13 ASN QB 3.900 . 9.000 4.659 4.379 4.908 . 0 0 "[ . 1 . 2]" 1
44 1 13 ASN QB 1 14 GLU HA 3.900 . 7.000 4.184 3.916 4.510 . 0 0 "[ . 1 . 2]" 1
45 1 14 GLU QB 1 15 ASN HA 3.400 . 6.000 4.049 3.607 4.971 . 0 0 "[ . 1 . 2]" 1
46 1 14 GLU QG 1 15 ASN HA 3.400 . 6.000 4.538 3.572 5.648 . 0 0 "[ . 1 . 2]" 1
47 1 14 GLU HA 1 15 ASN QB 3.900 . 7.000 4.058 3.735 4.538 . 0 0 "[ . 1 . 2]" 1
48 1 14 GLU QB 1 15 ASN QB 3.900 . 8.000 4.349 3.168 4.870 . 0 0 "[ . 1 . 2]" 1
49 1 14 GLU QG 1 15 ASN QB 3.900 . 8.000 4.867 3.847 5.563 . 0 0 "[ . 1 . 2]" 1
50 1 17 GLU QB 1 18 ASP HA 3.900 . 7.000 4.180 3.680 4.879 . 0 0 "[ . 1 . 2]" 1
51 1 15 ASN HA 1 17 GLU QG 3.400 . 6.000 4.571 3.147 5.528 . 0 0 "[ . 1 . 2]" 1
52 1 17 GLU QG 1 18 ASP HA 3.400 . 6.000 5.041 3.517 5.592 . 0 0 "[ . 1 . 2]" 1
53 1 17 GLU QB 1 19 ASP HA 3.400 . 6.000 5.133 4.033 5.535 . 0 0 "[ . 1 . 2]" 1
54 1 2 VAL HB 1 3 GLY H 3.900 . 6.000 3.831 1.760 4.348 0.040 16 0 "[ . 1 . 2]" 1
55 1 2 VAL QG 1 3 GLY H 3.400 . 8.900 2.719 1.956 3.376 . 0 0 "[ . 1 . 2]" 1
56 1 3 GLY H 1 4 GLU H 3.900 . 6.000 3.453 1.946 4.411 . 0 0 "[ . 1 . 2]" 1
57 1 1 TYR QD 1 4 GLU H 3.900 . 8.000 3.911 2.544 5.507 . 0 0 "[ . 1 . 2]" 1
58 1 1 TYR QE 1 4 GLU H 3.900 . 8.000 3.959 2.854 6.338 . 0 0 "[ . 1 . 2]" 1
59 1 2 VAL QG 1 4 GLU H 3.900 . 9.900 4.244 2.309 5.027 . 0 0 "[ . 1 . 2]" 1
60 1 3 GLY QA 1 4 GLU H 3.400 . 6.000 2.424 2.121 2.763 . 0 0 "[ . 1 . 2]" 1
61 1 4 GLU H 1 5 ASP QB 3.900 . 7.000 5.185 4.719 5.906 . 0 0 "[ . 1 . 2]" 1
62 1 2 VAL QG 1 5 ASP H 3.900 . 9.900 6.678 4.995 7.284 . 0 0 "[ . 1 . 2]" 1
63 1 3 GLY QA 1 5 ASP H 3.900 . 7.000 5.523 4.461 6.143 . 0 0 "[ . 1 . 2]" 1
64 1 4 GLU HA 1 5 ASP H 2.900 . 3.500 2.266 2.118 2.857 . 0 0 "[ . 1 . 2]" 1
65 1 4 GLU QB 1 5 ASP H 3.400 . 6.000 3.470 2.342 3.998 . 0 0 "[ . 1 . 2]" 1
66 1 4 GLU QG 1 5 ASP H 3.400 . 6.000 3.167 2.139 4.121 . 0 0 "[ . 1 . 2]" 1
67 1 5 ASP H 1 6 ASP H 2.900 . 3.500 2.514 2.045 3.298 . 0 0 "[ . 1 . 2]" 1
68 1 4 GLU QB 1 6 ASP H 3.900 . 7.000 3.521 2.475 4.421 . 0 0 "[ . 1 . 2]" 1
69 1 4 GLU QG 1 6 ASP H 3.900 . 7.000 2.698 1.319 4.339 0.481 17 0 "[ . 1 . 2]" 1
70 1 5 ASP HA 1 6 ASP H 2.900 . 3.500 2.982 2.886 3.328 . 0 0 "[ . 1 . 2]" 1
71 1 6 ASP H 1 7 GLU HA 3.900 . 6.000 5.116 4.554 5.365 . 0 0 "[ . 1 . 2]" 1
72 1 6 ASP HA 1 7 GLU H 2.900 . 3.500 3.334 3.010 3.556 0.056 3 0 "[ . 1 . 2]" 1
73 1 6 ASP QB 1 7 GLU H 3.400 . 6.000 3.079 2.553 3.697 . 0 0 "[ . 1 . 2]" 1
74 1 8 GLU HA 1 9 ASP H 2.900 . 3.500 2.175 2.103 2.245 . 0 0 "[ . 1 . 2]" 1
75 1 8 GLU QB 1 9 ASP H 3.400 . 6.000 3.686 2.948 3.994 . 0 0 "[ . 1 . 2]" 1
76 1 8 GLU QG 1 9 ASP H 3.400 . 6.000 3.700 2.962 4.554 . 0 0 "[ . 1 . 2]" 1
77 1 8 GLU HA 1 10 ASP H 3.400 . 5.000 5.006 4.842 5.077 0.077 16 0 "[ . 1 . 2]" 1
78 1 8 GLU QB 1 10 ASP H 3.400 . 6.000 4.842 4.078 5.405 . 0 0 "[ . 1 . 2]" 1
79 1 8 GLU QG 1 10 ASP H 3.900 . 7.000 4.353 3.578 5.634 . 0 0 "[ . 1 . 2]" 1
80 1 9 ASP HA 1 10 ASP H 2.900 . 3.500 2.274 2.191 2.391 . 0 0 "[ . 1 . 2]" 1
81 1 10 ASP HA 1 11 ASP H 2.900 . 3.500 3.569 3.561 3.581 0.081 8 0 "[ . 1 . 2]" 1
82 1 10 ASP QB 1 11 ASP H 2.900 . 4.500 3.190 2.566 3.400 . 0 0 "[ . 1 . 2]" 1
83 1 11 ASP H 1 12 PHE HB3 3.900 . 6.000 5.900 5.730 6.058 0.058 8 0 "[ . 1 . 2]" 1
84 1 11 ASP H 1 12 PHE HB2 3.900 . 6.000 4.386 4.186 4.583 . 0 0 "[ . 1 . 2]" 1
85 1 11 ASP H 1 12 PHE QD 3.900 . 8.000 4.922 4.711 5.082 . 0 0 "[ . 1 . 2]" 1
86 1 11 ASP HA 1 12 PHE H 2.900 . 3.500 3.057 2.957 3.121 . 0 0 "[ . 1 . 2]" 1
87 1 11 ASP QB 1 12 PHE H 3.400 . 6.000 3.897 3.858 3.940 . 0 0 "[ . 1 . 2]" 1
88 1 12 PHE H 1 13 ASN QD 3.900 . 7.000 4.801 4.509 4.946 . 0 0 "[ . 1 . 2]" 1
89 1 13 ASN QD 1 14 GLU H 3.900 . 7.000 4.800 4.115 5.301 . 0 0 "[ . 1 . 2]" 1
90 1 12 PHE HA 1 13 ASN H 2.900 . 3.500 2.157 2.121 2.191 . 0 0 "[ . 1 . 2]" 1
91 1 12 PHE HB3 1 13 ASN H 3.400 . 5.000 3.634 3.385 3.833 . 0 0 "[ . 1 . 2]" 1
92 1 12 PHE QD 1 13 ASN H 3.900 . 8.000 2.834 2.697 3.005 . 0 0 "[ . 1 . 2]" 1
93 1 12 PHE HA 1 14 GLU H 3.900 . 6.000 6.018 5.825 6.129 0.129 16 0 "[ . 1 . 2]" 1
94 1 12 PHE HB3 1 14 GLU H 3.900 . 6.000 5.361 4.985 5.675 . 0 0 "[ . 1 . 2]" 1
95 1 12 PHE QD 1 14 GLU H 3.900 . 8.000 5.991 5.832 6.224 . 0 0 "[ . 1 . 2]" 1
96 1 13 ASN HA 1 14 GLU H 3.400 . 5.000 2.160 2.106 2.246 . 0 0 "[ . 1 . 2]" 1
97 1 14 GLU H 1 15 ASN QB 3.400 . 6.000 4.808 4.008 5.409 . 0 0 "[ . 1 . 2]" 1
98 1 15 ASN QD 1 17 GLU H 3.900 . 7.000 4.437 1.793 6.252 0.007 14 0 "[ . 1 . 2]" 1
99 1 14 GLU HA 1 15 ASN H 2.900 . 3.500 2.634 2.134 3.552 0.052 3 0 "[ . 1 . 2]" 1
100 1 14 GLU QB 1 15 ASN H 3.900 . 7.000 2.555 1.696 3.605 0.104 20 0 "[ . 1 . 2]" 1
101 1 14 GLU QG 1 15 ASN H 3.900 . 7.000 3.192 1.821 4.412 . 0 0 "[ . 1 . 2]" 1
102 1 15 ASN QB 1 16 ASP H 3.400 . 6.000 3.297 1.863 4.024 . 0 0 "[ . 1 . 2]" 1
103 1 16 ASP HA 1 17 GLU H 2.900 . 3.500 3.360 3.077 3.545 0.045 13 0 "[ . 1 . 2]" 1
104 1 16 ASP QB 1 17 GLU H 3.400 . 6.000 3.119 2.123 3.841 . 0 0 "[ . 1 . 2]" 1
105 1 17 GLU HA 1 18 ASP H 2.900 . 3.500 2.757 2.013 3.518 0.018 19 0 "[ . 1 . 2]" 1
106 1 17 GLU QB 1 18 ASP H 3.400 . 6.000 2.277 1.333 3.995 0.467 2 0 "[ . 1 . 2]" 1
107 1 17 GLU QG 1 18 ASP H 3.900 . 7.000 3.621 2.959 4.767 . 0 0 "[ . 1 . 2]" 1
108 1 18 ASP H 1 19 ASP H 3.400 . 5.000 3.086 1.926 4.320 . 0 0 "[ . 1 . 2]" 1
109 1 17 GLU QB 1 19 ASP H 3.900 . 7.000 4.080 2.334 5.714 . 0 0 "[ . 1 . 2]" 1
110 1 18 ASP HA 1 19 ASP H 2.900 . 3.500 2.874 2.220 3.537 0.037 20 0 "[ . 1 . 2]" 1
111 1 18 ASP QB 1 19 ASP H 3.400 . 6.000 3.191 1.801 4.041 . 0 0 "[ . 1 . 2]" 1
112 1 12 PHE HA 1 12 PHE HB3 2.400 . 2.700 2.766 2.728 2.803 0.103 14 0 "[ . 1 . 2]" 1
113 1 12 PHE HA 1 12 PHE HB2 2.900 . 3.300 2.879 2.858 2.906 . 0 0 "[ . 1 . 2]" 1
114 1 12 PHE H 1 12 PHE HA 2.900 . 3.500 2.750 2.725 2.778 . 0 0 "[ . 1 . 2]" 1
115 1 12 PHE H 1 12 PHE HB3 3.400 . 5.000 3.219 3.121 3.294 . 0 0 "[ . 1 . 2]" 1
116 1 12 PHE H 1 12 PHE HB2 2.400 . 2.900 1.921 1.854 1.979 . 0 0 "[ . 1 . 2]" 1
117 2 10 VAL HA 2 29 MET HA 2.900 . 3.300 2.264 1.953 2.521 . 0 0 "[ . 1 . 2]" 1
118 2 10 VAL HA 2 29 MET QG 2.900 . 4.300 2.538 2.297 3.376 . 0 0 "[ . 1 . 2]" 1
119 2 10 VAL MG1 2 11 LEU HA 2.900 . 4.800 3.849 3.790 3.924 . 0 0 "[ . 1 . 2]" 1
120 2 10 VAL MG1 2 13 ILE HA 3.900 . 7.500 3.289 2.990 3.627 . 0 0 "[ . 1 . 2]" 1
121 2 10 VAL MG1 2 13 ILE MD 2.400 . 5.700 2.870 2.604 3.072 . 0 0 "[ . 1 . 2]" 1
122 2 10 VAL MG1 2 13 ILE QG 2.900 . 5.800 1.927 1.720 2.112 0.080 12 0 "[ . 1 . 2]" 1
123 2 10 VAL MG1 2 27 TYR HA 3.900 . 7.500 3.002 2.698 3.485 . 0 0 "[ . 1 . 2]" 1
124 2 10 VAL MG1 2 27 TYR HB3 3.400 . 6.500 2.317 2.066 2.828 . 0 0 "[ . 1 . 2]" 1
125 2 10 VAL MG1 2 27 TYR QD 2.900 . 6.800 2.189 1.796 2.718 0.004 12 0 "[ . 1 . 2]" 1
126 2 10 VAL MG1 2 27 TYR QE 2.900 . 6.800 4.066 3.591 4.614 . 0 0 "[ . 1 . 2]" 1
127 2 10 VAL MG1 2 29 MET HA 3.400 . 6.500 3.999 3.671 4.199 . 0 0 "[ . 1 . 2]" 1
128 2 10 VAL MG1 2 29 MET QG 3.900 . 8.500 3.645 3.383 3.964 . 0 0 "[ . 1 . 2]" 1
129 2 10 VAL MG2 2 27 TYR QE 2.900 . 6.800 4.531 4.118 4.952 . 0 0 "[ . 1 . 2]" 1
130 2 10 VAL MG2 2 29 MET HA 2.900 . 4.800 3.713 3.455 3.883 . 0 0 "[ . 1 . 2]" 1
131 2 11 LEU MD1 2 29 MET HA 3.400 . 6.500 4.132 3.912 4.409 . 0 0 "[ . 1 . 2]" 1
132 2 11 LEU MD1 2 30 ALA HA 2.400 . 4.200 2.141 1.980 2.328 . 0 0 "[ . 1 . 2]" 1
133 2 11 LEU MD1 2 49 TYR QE 2.900 . 6.800 4.129 3.672 4.306 . 0 0 "[ . 1 . 2]" 1
134 2 11 LEU MD1 2 101 LEU MD1 2.400 . 5.700 2.183 1.756 2.470 0.044 11 0 "[ . 1 . 2]" 1
135 2 9 GLU QB 2 11 LEU MD2 2.900 . 5.800 2.984 2.439 4.255 . 0 0 "[ . 1 . 2]" 1
136 2 9 GLU QG 2 11 LEU MD2 2.900 . 5.800 3.251 2.305 4.100 . 0 0 "[ . 1 . 2]" 1
137 2 11 LEU MD2 2 29 MET HA 3.400 . 6.500 4.289 3.885 4.604 . 0 0 "[ . 1 . 2]" 1
138 2 11 LEU MD2 2 30 ALA HA 2.900 . 4.800 3.822 3.640 3.923 . 0 0 "[ . 1 . 2]" 1
139 2 11 LEU MD2 2 30 ALA MB 2.900 . 6.300 2.824 2.409 3.465 . 0 0 "[ . 1 . 2]" 1
140 2 11 LEU MD2 2 49 TYR QE 3.900 . 9.500 6.293 6.083 6.524 . 0 0 "[ . 1 . 2]" 1
141 2 11 LEU HG 2 29 MET HA 3.400 . 5.000 3.054 2.774 3.427 . 0 0 "[ . 1 . 2]" 1
142 2 11 LEU HG 2 30 ALA HA 2.900 . 3.300 3.326 3.122 3.385 0.085 16 0 "[ . 1 . 2]" 1
143 2 12 LEU HB3 2 28 LEU QB 2.900 . 4.300 2.059 1.809 2.358 . 0 0 "[ . 1 . 2]" 1
144 2 12 LEU HB2 2 28 LEU QB 2.900 . 4.300 3.180 3.009 3.382 . 0 0 "[ . 1 . 2]" 1
145 2 12 LEU MD1 2 81 PHE QE 3.900 . 9.500 5.696 5.581 5.884 . 0 0 "[ . 1 . 2]" 1
146 2 12 LEU MD1 2 81 PHE HZ 3.900 . 7.500 6.307 6.280 6.339 . 0 0 "[ . 1 . 2]" 1
147 2 12 LEU MD1 2 94 VAL HA 3.400 . 6.500 4.066 3.810 4.339 . 0 0 "[ . 1 . 2]" 1
148 2 12 LEU MD2 2 13 ILE HA 3.900 . 7.500 4.591 4.450 4.736 . 0 0 "[ . 1 . 2]" 1
149 2 12 LEU MD2 2 81 PHE QE 3.900 . 9.500 4.312 4.125 4.490 . 0 0 "[ . 1 . 2]" 1
150 2 12 LEU MD2 2 90 GLU HA 3.900 . 7.500 4.011 3.648 4.469 . 0 0 "[ . 1 . 2]" 1
151 2 12 LEU MD2 2 93 ALA HA 3.900 . 7.500 4.531 4.337 4.680 . 0 0 "[ . 1 . 2]" 1
152 2 12 LEU MD2 2 94 VAL HA 2.900 . 4.800 2.214 2.047 2.420 . 0 0 "[ . 1 . 2]" 1
153 2 12 LEU MD2 2 94 VAL MG2 2.900 . 6.300 1.822 1.776 1.865 0.024 1 0 "[ . 1 . 2]" 1
154 2 12 LEU MD2 2 97 LEU QB 2.900 . 5.800 3.146 2.999 3.318 . 0 0 "[ . 1 . 2]" 1
155 2 12 LEU HG 2 13 ILE HA 3.900 . 6.000 3.912 3.821 4.009 . 0 0 "[ . 1 . 2]" 1
156 2 12 LEU MD1 2 13 ILE HA 3.400 . 6.500 5.148 5.083 5.197 . 0 0 "[ . 1 . 2]" 1
157 2 13 ILE HA 2 14 VAL HB 3.900 . 6.000 4.787 4.729 4.868 . 0 0 "[ . 1 . 2]" 1
158 2 13 ILE HA 2 14 VAL MG2 3.400 . 6.500 3.352 3.307 3.419 . 0 0 "[ . 1 . 2]" 1
159 2 13 ILE HA 2 27 TYR HA 2.900 . 3.300 2.497 2.439 2.544 . 0 0 "[ . 1 . 2]" 1
160 2 13 ILE HA 2 27 TYR HB3 3.900 . 6.000 4.117 3.840 4.418 . 0 0 "[ . 1 . 2]" 1
161 2 13 ILE HA 2 27 TYR QD 3.900 . 8.000 3.232 2.860 3.763 . 0 0 "[ . 1 . 2]" 1
162 2 13 ILE HA 2 27 TYR QE 3.900 . 8.000 4.438 4.328 4.606 . 0 0 "[ . 1 . 2]" 1
163 2 10 VAL MG1 2 13 ILE HB 3.400 . 6.500 4.290 4.153 4.431 . 0 0 "[ . 1 . 2]" 1
164 2 12 LEU HA 2 13 ILE HB 3.900 . 6.000 4.675 4.592 4.739 . 0 0 "[ . 1 . 2]" 1
165 2 13 ILE HB 2 15 LYS QE 3.900 . 7.000 4.293 3.418 4.580 . 0 0 "[ . 1 . 2]" 1
166 2 13 ILE HB 2 27 TYR QD 3.900 . 8.000 4.661 4.397 5.182 . 0 0 "[ . 1 . 2]" 1
167 2 13 ILE HB 2 27 TYR QE 3.900 . 8.000 4.810 4.726 5.179 . 0 0 "[ . 1 . 2]" 1
168 2 10 VAL HA 2 13 ILE MD 3.900 . 7.500 5.931 5.815 6.001 . 0 0 "[ . 1 . 2]" 1
169 2 10 VAL HB 2 13 ILE MD 3.900 . 7.500 3.821 3.676 4.139 . 0 0 "[ . 1 . 2]" 1
170 2 10 VAL MG2 2 13 ILE MD 2.900 . 6.300 4.108 3.900 4.173 . 0 0 "[ . 1 . 2]" 1
171 2 12 LEU HA 2 13 ILE MD 3.900 . 7.500 5.089 4.983 5.229 . 0 0 "[ . 1 . 2]" 1
172 2 13 ILE MD 2 15 LYS QE 3.400 . 7.500 5.280 4.419 5.547 . 0 0 "[ . 1 . 2]" 1
173 2 13 ILE MD 2 27 TYR HA 3.900 . 7.500 5.198 5.107 5.304 . 0 0 "[ . 1 . 2]" 1
174 2 13 ILE MD 2 27 TYR HB3 3.900 . 7.500 4.956 4.656 5.224 . 0 0 "[ . 1 . 2]" 1
175 2 13 ILE MD 2 27 TYR HB2 3.900 . 7.500 6.174 6.027 6.218 . 0 0 "[ . 1 . 2]" 1
176 2 13 ILE MD 2 27 TYR QD 2.900 . 6.800 3.214 3.098 3.377 . 0 0 "[ . 1 . 2]" 1
177 2 13 ILE MD 2 27 TYR QE 2.900 . 6.800 2.825 2.384 3.565 . 0 0 "[ . 1 . 2]" 1
178 2 13 ILE QG 2 27 TYR HA 3.400 . 6.000 3.635 3.525 3.773 . 0 0 "[ . 1 . 2]" 1
179 2 13 ILE QG 2 27 TYR QD 3.400 . 8.000 1.966 1.784 2.309 0.016 13 0 "[ . 1 . 2]" 1
180 2 13 ILE QG 2 27 TYR QE 3.900 . 9.000 3.107 2.694 3.768 . 0 0 "[ . 1 . 2]" 1
181 2 13 ILE MG 2 14 VAL HA 2.900 . 4.800 3.681 3.573 3.750 . 0 0 "[ . 1 . 2]" 1
182 2 13 ILE MG 2 15 LYS HA 3.400 . 6.500 4.260 4.225 4.308 . 0 0 "[ . 1 . 2]" 1
183 2 13 ILE MG 2 15 LYS QD 2.900 . 5.800 3.512 2.381 4.170 . 0 0 "[ . 1 . 2]" 1
184 2 13 ILE MG 2 15 LYS QE 2.900 . 5.800 3.405 2.218 3.902 . 0 0 "[ . 1 . 2]" 1
185 2 13 ILE MG 2 15 LYS QG 3.400 . 7.500 3.298 2.904 3.977 . 0 0 "[ . 1 . 2]" 1
186 2 13 ILE MG 2 25 ALA HA 3.900 . 7.500 5.075 4.983 5.154 . 0 0 "[ . 1 . 2]" 1
187 2 13 ILE MG 2 27 TYR HA 2.900 . 4.800 3.811 3.774 3.840 . 0 0 "[ . 1 . 2]" 1
188 2 13 ILE MG 2 27 TYR HB3 3.900 . 7.500 4.466 4.201 4.768 . 0 0 "[ . 1 . 2]" 1
189 2 13 ILE MG 2 27 TYR HB2 3.400 . 6.500 5.215 5.185 5.240 . 0 0 "[ . 1 . 2]" 1
190 2 13 ILE MG 2 27 TYR QD 3.400 . 8.500 2.675 2.123 3.343 . 0 0 "[ . 1 . 2]" 1
191 2 13 ILE MG 2 27 TYR QE 2.900 . 6.800 2.330 2.125 2.761 . 0 0 "[ . 1 . 2]" 1
192 2 13 ILE HA 2 14 VAL HA 3.900 . 6.000 4.375 4.367 4.388 . 0 0 "[ . 1 . 2]" 1
193 2 14 VAL HA 2 17 VAL MG2 3.400 . 6.500 4.452 4.357 4.546 . 0 0 "[ . 1 . 2]" 1
194 2 14 VAL HA 2 81 PHE QE 3.900 . 8.000 4.637 4.543 4.783 . 0 0 "[ . 1 . 2]" 1
195 2 14 VAL HB 2 17 VAL MG2 2.900 . 4.800 2.727 2.421 2.905 . 0 0 "[ . 1 . 2]" 1
196 2 14 VAL HB 2 26 LEU MD1 3.400 . 6.500 4.369 4.317 4.446 . 0 0 "[ . 1 . 2]" 1
197 2 14 VAL HB 2 81 PHE QE 3.900 . 8.000 4.054 3.767 4.295 . 0 0 "[ . 1 . 2]" 1
198 2 14 VAL MG1 2 17 VAL MG2 2.400 . 5.700 2.010 1.955 2.155 . 0 0 "[ . 1 . 2]" 1
199 2 14 VAL MG1 2 81 PHE HB3 3.900 . 7.500 4.589 4.450 4.783 . 0 0 "[ . 1 . 2]" 1
200 2 14 VAL MG1 2 81 PHE HB2 3.900 . 7.500 5.468 5.363 5.638 . 0 0 "[ . 1 . 2]" 1
201 2 14 VAL MG1 2 81 PHE QD 2.900 . 6.800 2.760 2.541 2.982 . 0 0 "[ . 1 . 2]" 1
202 2 14 VAL MG1 2 81 PHE QE 2.900 . 6.800 1.663 1.426 1.902 0.374 13 0 "[ . 1 . 2]" 1
203 2 14 VAL MG1 2 81 PHE HZ 3.400 . 6.500 3.147 2.943 3.384 . 0 0 "[ . 1 . 2]" 1
204 2 14 VAL MG1 2 90 GLU HA 2.900 . 4.800 3.807 3.772 3.840 . 0 0 "[ . 1 . 2]" 1
205 2 14 VAL MG1 2 90 GLU HB2 2.900 . 4.800 3.244 3.098 3.506 . 0 0 "[ . 1 . 2]" 1
206 2 14 VAL MG1 2 90 GLU QG 2.900 . 5.800 2.236 2.088 2.463 . 0 0 "[ . 1 . 2]" 1
207 2 12 LEU HA 2 14 VAL MG2 3.900 . 7.500 4.778 4.627 4.890 . 0 0 "[ . 1 . 2]" 1
208 2 12 LEU HB3 2 14 VAL MG2 3.400 . 6.500 3.805 3.736 3.882 . 0 0 "[ . 1 . 2]" 1
209 2 12 LEU MD1 2 14 VAL MG2 2.900 . 6.300 3.395 3.212 3.565 . 0 0 "[ . 1 . 2]" 1
210 2 12 LEU HG 2 14 VAL MG2 2.900 . 4.800 2.618 2.416 2.789 . 0 0 "[ . 1 . 2]" 1
211 2 14 VAL MG2 2 17 VAL MG2 2.900 . 6.300 3.514 3.390 3.644 . 0 0 "[ . 1 . 2]" 1
212 2 14 VAL MG2 2 26 LEU MD1 2.900 . 6.300 3.986 3.937 4.047 . 0 0 "[ . 1 . 2]" 1
213 2 14 VAL MG2 2 26 LEU MD2 2.900 . 6.300 1.587 1.504 1.703 0.296 6 0 "[ . 1 . 2]" 1
214 2 14 VAL MG2 2 81 PHE QD 3.400 . 8.500 4.700 4.509 4.923 . 0 0 "[ . 1 . 2]" 1
215 2 14 VAL MG2 2 81 PHE QE 2.900 . 6.800 2.956 2.771 3.142 . 0 0 "[ . 1 . 2]" 1
216 2 14 VAL MG2 2 81 PHE HZ 3.900 . 7.500 3.345 3.130 3.556 . 0 0 "[ . 1 . 2]" 1
217 2 14 VAL MG2 2 90 GLU HA 3.400 . 6.500 4.124 3.985 4.475 . 0 0 "[ . 1 . 2]" 1
218 2 14 VAL MG2 2 90 GLU HB2 3.400 . 6.500 4.876 4.706 5.250 . 0 0 "[ . 1 . 2]" 1
219 2 14 VAL MG2 2 90 GLU QG 2.900 . 5.800 3.081 2.888 3.675 . 0 0 "[ . 1 . 2]" 1
220 2 14 VAL MG2 2 94 VAL HA 3.900 . 7.500 4.279 4.192 4.413 . 0 0 "[ . 1 . 2]" 1
221 2 15 LYS HA 2 17 VAL MG2 3.900 . 7.500 4.081 3.887 4.226 . 0 0 "[ . 1 . 2]" 1
222 2 15 LYS HA 2 25 ALA HA 2.900 . 3.300 2.775 2.579 3.062 . 0 0 "[ . 1 . 2]" 1
223 2 15 LYS HA 2 25 ALA MB 2.900 . 4.800 2.766 2.655 2.961 . 0 0 "[ . 1 . 2]" 1
224 2 15 LYS QD 2 25 ALA HA 3.900 . 7.000 5.938 4.875 6.465 . 0 0 "[ . 1 . 2]" 1
225 2 16 LYS HA 2 17 VAL MG2 3.400 . 6.500 4.422 4.310 4.537 . 0 0 "[ . 1 . 2]" 1
226 2 16 LYS HA 2 25 ALA HA 3.900 . 6.000 4.491 4.394 4.702 . 0 0 "[ . 1 . 2]" 1
227 2 16 LYS HB3 2 83 ASN HA 3.900 . 6.000 3.127 2.904 3.355 . 0 0 "[ . 1 . 2]" 1
228 2 16 LYS HB2 2 83 ASN HA 3.900 . 6.000 2.578 2.341 2.855 . 0 0 "[ . 1 . 2]" 1
229 2 16 LYS QD 2 83 ASN HB2 3.400 . 6.000 4.284 3.044 4.754 . 0 0 "[ . 1 . 2]" 1
230 2 17 VAL HA 2 18 ARG HA 3.900 . 6.000 4.369 4.347 4.384 . 0 0 "[ . 1 . 2]" 1
231 2 17 VAL HA 2 18 ARG HB2 3.900 . 6.000 4.609 4.204 5.022 . 0 0 "[ . 1 . 2]" 1
232 2 17 VAL HA 2 18 ARG QG 3.900 . 7.000 3.881 3.375 4.831 . 0 0 "[ . 1 . 2]" 1
233 2 17 VAL HA 2 81 PHE HA 2.900 . 3.300 2.639 2.424 2.839 . 0 0 "[ . 1 . 2]" 1
234 2 17 VAL HA 2 81 PHE HB3 3.900 . 6.000 5.161 4.879 5.421 . 0 0 "[ . 1 . 2]" 1
235 2 17 VAL HB 2 25 ALA HA 2.900 . 3.300 3.324 3.223 3.391 0.091 5 0 "[ . 1 . 2]" 1
236 2 17 VAL HB 2 26 LEU MD1 3.400 . 6.500 4.355 4.148 4.515 . 0 0 "[ . 1 . 2]" 1
237 2 17 VAL HB 2 35 TRP HD1 2.900 . 3.300 2.885 2.615 3.004 . 0 0 "[ . 1 . 2]" 1
238 2 17 VAL MG1 2 18 ARG HA 3.900 . 7.500 3.724 3.607 3.860 . 0 0 "[ . 1 . 2]" 1
239 2 17 VAL MG1 2 26 LEU HB3 2.900 . 4.800 3.690 3.487 3.756 . 0 0 "[ . 1 . 2]" 1
240 2 17 VAL MG1 2 26 LEU HB2 2.900 . 4.800 2.581 2.282 2.705 . 0 0 "[ . 1 . 2]" 1
241 2 17 VAL MG1 2 26 LEU MD1 2.900 . 6.300 2.886 2.521 3.066 . 0 0 "[ . 1 . 2]" 1
242 2 17 VAL MG1 2 35 TRP HB3 3.400 . 6.500 4.979 4.762 5.119 . 0 0 "[ . 1 . 2]" 1
243 2 17 VAL MG1 2 35 TRP HD1 2.900 . 4.800 2.876 2.682 3.010 . 0 0 "[ . 1 . 2]" 1
244 2 17 VAL MG1 2 79 PHE HA 2.900 . 4.800 3.000 2.675 3.325 . 0 0 "[ . 1 . 2]" 1
245 2 17 VAL MG1 2 79 PHE HB3 2.900 . 4.800 2.214 2.041 2.437 . 0 0 "[ . 1 . 2]" 1
246 2 17 VAL MG1 2 79 PHE HB2 2.900 . 4.800 3.657 3.481 3.880 . 0 0 "[ . 1 . 2]" 1
247 2 17 VAL MG1 2 79 PHE QD 2.900 . 6.800 2.008 1.933 2.112 . 0 0 "[ . 1 . 2]" 1
248 2 17 VAL MG2 2 25 ALA HA 2.900 . 4.800 3.819 3.563 3.899 . 0 0 "[ . 1 . 2]" 1
249 2 17 VAL MG2 2 26 LEU HA 3.900 . 7.500 4.767 4.314 4.952 . 0 0 "[ . 1 . 2]" 1
250 2 17 VAL MG2 2 26 LEU HB3 2.400 . 4.200 2.810 2.296 2.985 . 0 0 "[ . 1 . 2]" 1
251 2 17 VAL MG2 2 26 LEU HB2 2.900 . 4.800 2.822 2.364 3.005 . 0 0 "[ . 1 . 2]" 1
252 2 17 VAL MG2 2 81 PHE HA 2.900 . 4.800 2.222 2.028 2.766 . 0 0 "[ . 1 . 2]" 1
253 2 17 VAL MG2 2 81 PHE HB3 3.400 . 6.500 3.895 3.718 4.292 . 0 0 "[ . 1 . 2]" 1
254 2 17 VAL MG2 2 81 PHE HB2 3.400 . 6.500 4.427 4.270 4.841 . 0 0 "[ . 1 . 2]" 1
255 2 17 VAL MG2 2 81 PHE QD 2.900 . 6.800 2.963 2.768 3.218 . 0 0 "[ . 1 . 2]" 1
256 2 17 VAL MG2 2 81 PHE QE 2.900 . 6.800 3.227 3.092 3.376 . 0 0 "[ . 1 . 2]" 1
257 2 18 ARG HA 2 23 ASP HA 2.900 . 3.300 2.141 1.907 2.496 . 0 0 "[ . 1 . 2]" 1
258 2 18 ARG HA 2 23 ASP QB 3.900 . 7.000 4.262 3.989 4.560 . 0 0 "[ . 1 . 2]" 1
259 2 18 ARG HA 2 35 TRP HZ2 2.900 . 3.300 2.861 2.604 3.193 . 0 0 "[ . 1 . 2]" 1
260 2 18 ARG QD 2 21 LYS HA 3.900 . 7.000 4.085 2.890 5.811 . 0 0 "[ . 1 . 2]" 1
261 2 18 ARG QD 2 23 ASP HA 3.900 . 7.000 4.036 3.483 4.444 . 0 0 "[ . 1 . 2]" 1
262 2 18 ARG QD 2 82 SER HA 3.900 . 7.000 5.003 4.311 5.713 . 0 0 "[ . 1 . 2]" 1
263 2 18 ARG QD 2 82 SER HB3 3.400 . 6.000 2.998 2.265 3.749 . 0 0 "[ . 1 . 2]" 1
264 2 18 ARG QD 2 82 SER HB2 3.400 . 6.000 3.919 3.344 4.629 . 0 0 "[ . 1 . 2]" 1
265 2 18 ARG QG 2 23 ASP HA 2.900 . 4.300 2.115 1.756 2.589 0.044 9 0 "[ . 1 . 2]" 1
266 2 18 ARG QG 2 82 SER HB2 3.900 . 7.000 4.177 3.644 5.632 . 0 0 "[ . 1 . 2]" 1
267 2 18 ARG HA 2 19 GLN HA 3.900 . 6.000 4.387 4.363 4.424 . 0 0 "[ . 1 . 2]" 1
268 2 19 GLN HA 2 79 PHE HA 3.400 . 5.000 3.181 2.731 3.534 . 0 0 "[ . 1 . 2]" 1
269 2 19 GLN HA 2 79 PHE QD 3.400 . 7.000 3.969 3.512 4.358 . 0 0 "[ . 1 . 2]" 1
270 2 19 GLN QB 2 35 TRP HH2 3.900 . 7.000 3.045 2.628 3.377 . 0 0 "[ . 1 . 2]" 1
271 2 19 GLN QB 2 35 TRP HZ2 3.900 . 7.000 3.378 3.132 3.605 . 0 0 "[ . 1 . 2]" 1
272 2 19 GLN QB 2 45 ILE MD 3.900 . 8.500 3.670 3.332 3.914 . 0 0 "[ . 1 . 2]" 1
273 2 19 GLN QB 2 79 PHE HA 3.900 . 7.000 3.910 3.417 4.207 . 0 0 "[ . 1 . 2]" 1
274 2 19 GLN QB 2 79 PHE QD 3.400 . 8.000 2.989 2.565 3.451 . 0 0 "[ . 1 . 2]" 1
275 2 19 GLN QG 2 45 ILE MD 2.900 . 5.800 2.524 2.084 2.986 . 0 0 "[ . 1 . 2]" 1
276 2 19 GLN QG 2 79 PHE HA 3.900 . 7.000 3.855 2.860 5.458 . 0 0 "[ . 1 . 2]" 1
277 2 19 GLN QG 2 79 PHE QD 3.400 . 8.000 3.534 2.668 5.127 . 0 0 "[ . 1 . 2]" 1
278 2 19 GLN QG 2 79 PHE QE 3.400 . 8.000 2.842 2.286 4.324 . 0 0 "[ . 1 . 2]" 1
279 2 19 GLN QG 2 79 PHE HZ 3.400 . 6.000 3.827 3.136 5.198 . 0 0 "[ . 1 . 2]" 1
280 2 19 GLN HA 2 20 LYS HA 3.900 . 6.000 4.341 4.272 4.377 . 0 0 "[ . 1 . 2]" 1
281 2 22 GLN HA 2 35 TRP HH2 3.400 . 5.000 4.776 4.179 5.061 0.061 2 0 "[ . 1 . 2]" 1
282 2 22 GLN QB 2 35 TRP HH2 2.900 . 4.300 2.654 1.756 3.675 0.044 4 0 "[ . 1 . 2]" 1
283 2 22 GLN QB 2 35 TRP HZ2 3.400 . 6.000 4.144 3.405 4.960 . 0 0 "[ . 1 . 2]" 1
284 2 22 GLN QG 2 35 TRP HH2 2.900 . 4.300 2.397 1.413 3.890 0.387 8 0 "[ . 1 . 2]" 1
285 2 22 GLN QG 2 35 TRP HZ2 3.900 . 7.000 3.839 3.180 5.554 . 0 0 "[ . 1 . 2]" 1
286 2 18 ARG HB2 2 23 ASP HA 3.900 . 6.000 4.281 4.108 4.579 . 0 0 "[ . 1 . 2]" 1
287 2 23 ASP HA 2 35 TRP HZ2 3.400 . 5.000 3.252 3.038 3.589 . 0 0 "[ . 1 . 2]" 1
288 2 18 ARG QG 2 23 ASP QB 3.400 . 7.000 2.955 2.414 3.728 . 0 0 "[ . 1 . 2]" 1
289 2 23 ASP QB 2 24 GLY QA 3.900 . 8.000 3.758 3.589 3.995 . 0 0 "[ . 1 . 2]" 1
290 2 23 ASP QB 2 35 TRP HZ2 3.900 . 7.000 4.749 4.588 4.863 . 0 0 "[ . 1 . 2]" 1
291 2 23 ASP QB 2 38 GLU QB 2.900 . 5.300 3.050 2.600 3.950 . 0 0 "[ . 1 . 2]" 1
292 2 23 ASP QB 2 38 GLU QG 3.900 . 8.000 4.205 3.384 5.379 . 0 0 "[ . 1 . 2]" 1
293 2 24 GLY QA 2 25 ALA MB 3.900 . 8.500 3.668 3.643 3.703 . 0 0 "[ . 1 . 2]" 1
294 2 24 GLY QA 2 35 TRP HH2 3.900 . 7.000 3.956 3.703 4.210 . 0 0 "[ . 1 . 2]" 1
295 2 24 GLY QA 2 35 TRP HZ2 2.900 . 4.300 2.563 2.284 2.846 . 0 0 "[ . 1 . 2]" 1
296 2 24 GLY QA 2 37 PRO QB 3.400 . 7.000 3.596 3.214 3.935 . 0 0 "[ . 1 . 2]" 1
297 2 24 GLY QA 2 37 PRO QG 3.900 . 8.000 4.583 4.311 5.003 . 0 0 "[ . 1 . 2]" 1
298 2 24 GLY QA 2 25 ALA HA 3.900 . 7.000 3.971 3.940 3.984 . 0 0 "[ . 1 . 2]" 1
299 2 25 ALA HA 2 26 LEU HB3 3.400 . 5.000 4.467 4.409 4.528 . 0 0 "[ . 1 . 2]" 1
300 2 25 ALA HA 2 26 LEU HB2 3.900 . 6.000 4.386 4.308 4.442 . 0 0 "[ . 1 . 2]" 1
301 2 25 ALA HA 2 27 TYR QE 3.900 . 8.000 4.839 4.518 5.172 . 0 0 "[ . 1 . 2]" 1
302 2 25 ALA HA 2 35 TRP HD1 3.900 . 6.000 3.981 3.808 4.163 . 0 0 "[ . 1 . 2]" 1
303 2 13 ILE MG 2 25 ALA MB 2.900 . 6.300 3.307 3.171 3.424 . 0 0 "[ . 1 . 2]" 1
304 2 15 LYS QE 2 25 ALA MB 3.400 . 7.500 5.249 4.272 5.611 . 0 0 "[ . 1 . 2]" 1
305 2 17 VAL HB 2 25 ALA MB 3.400 . 6.500 4.811 4.743 4.857 . 0 0 "[ . 1 . 2]" 1
306 2 17 VAL MG2 2 25 ALA MB 3.900 . 9.000 4.807 4.638 4.870 . 0 0 "[ . 1 . 2]" 1
307 2 25 ALA MB 2 27 TYR QD 2.900 . 6.800 3.851 3.420 4.132 . 0 0 "[ . 1 . 2]" 1
308 2 25 ALA MB 2 27 TYR QE 2.400 . 6.200 2.425 1.945 2.912 . 0 0 "[ . 1 . 2]" 1
309 2 25 ALA MB 2 35 TRP HZ2 3.900 . 7.500 6.108 5.929 6.227 . 0 0 "[ . 1 . 2]" 1
310 2 25 ALA HA 2 26 LEU HA 3.900 . 6.000 4.378 4.353 4.400 . 0 0 "[ . 1 . 2]" 1
311 2 26 LEU HA 2 27 TYR HB2 3.900 . 6.000 4.628 4.394 4.831 . 0 0 "[ . 1 . 2]" 1
312 2 26 LEU HA 2 27 TYR QD 3.400 . 7.000 3.404 3.191 3.762 . 0 0 "[ . 1 . 2]" 1
313 2 26 LEU HA 2 35 TRP HA 2.900 . 3.300 2.197 2.091 2.297 . 0 0 "[ . 1 . 2]" 1
314 2 26 LEU HA 2 35 TRP HB3 3.900 . 6.000 4.050 3.983 4.107 . 0 0 "[ . 1 . 2]" 1
315 2 26 LEU HA 2 35 TRP HB2 3.900 . 6.000 2.549 2.421 2.651 . 0 0 "[ . 1 . 2]" 1
316 2 26 LEU HA 2 35 TRP HD1 2.900 . 3.300 2.159 2.065 2.271 . 0 0 "[ . 1 . 2]" 1
317 2 26 LEU HA 2 79 PHE HZ 3.900 . 6.000 6.043 6.014 6.062 0.062 18 0 "[ . 1 . 2]" 1
318 2 26 LEU HB3 2 35 TRP HD1 3.900 . 6.000 3.276 3.240 3.334 . 0 0 "[ . 1 . 2]" 1
319 2 26 LEU HB3 2 94 VAL MG2 3.900 . 7.500 4.028 3.960 4.083 . 0 0 "[ . 1 . 2]" 1
320 2 14 VAL HA 2 26 LEU HB2 3.900 . 6.000 6.077 6.054 6.105 0.105 2 0 "[ . 1 . 2]" 1
321 2 17 VAL HB 2 26 LEU HB2 3.400 . 5.000 2.968 2.738 3.130 . 0 0 "[ . 1 . 2]" 1
322 2 26 LEU HB2 2 35 TRP HD1 3.400 . 5.000 1.754 1.710 1.784 0.090 8 0 "[ . 1 . 2]" 1
323 2 26 LEU MD1 2 27 TYR QD 3.900 . 9.500 4.924 4.825 5.050 . 0 0 "[ . 1 . 2]" 1
324 2 26 LEU MD1 2 33 ILE HA 3.900 . 7.500 4.625 4.473 4.948 . 0 0 "[ . 1 . 2]" 1
325 2 26 LEU MD1 2 33 ILE MG 3.900 . 9.000 4.306 4.193 4.414 . 0 0 "[ . 1 . 2]" 1
326 2 26 LEU MD1 2 35 TRP HA 3.900 . 7.500 3.144 3.052 3.258 . 0 0 "[ . 1 . 2]" 1
327 2 26 LEU MD1 2 35 TRP HB3 3.900 . 7.500 2.886 2.840 2.961 . 0 0 "[ . 1 . 2]" 1
328 2 26 LEU MD1 2 35 TRP HB2 3.900 . 7.500 1.420 1.375 1.492 0.425 15 0 "[ . 1 . 2]" 1
329 2 26 LEU MD1 2 35 TRP HD1 3.900 . 7.500 2.627 2.441 2.748 . 0 0 "[ . 1 . 2]" 1
330 2 26 LEU MD1 2 35 TRP HE3 3.900 . 7.500 5.064 4.988 5.138 . 0 0 "[ . 1 . 2]" 1
331 2 26 LEU MD1 2 79 PHE HB3 3.900 . 7.500 3.762 3.475 3.978 . 0 0 "[ . 1 . 2]" 1
332 2 26 LEU MD1 2 79 PHE HB2 3.900 . 7.500 4.386 4.164 4.620 . 0 0 "[ . 1 . 2]" 1
333 2 26 LEU MD1 2 79 PHE QD 3.900 . 9.500 3.010 2.879 3.156 . 0 0 "[ . 1 . 2]" 1
334 2 26 LEU MD1 2 79 PHE QE 3.900 . 9.500 2.709 2.536 2.914 . 0 0 "[ . 1 . 2]" 1
335 2 26 LEU MD1 2 81 PHE HZ 3.900 . 7.500 5.020 4.807 5.271 . 0 0 "[ . 1 . 2]" 1
336 2 25 ALA HA 2 26 LEU MD2 3.900 . 7.500 5.867 5.817 5.929 . 0 0 "[ . 1 . 2]" 1
337 2 26 LEU MD2 2 35 TRP HB2 3.900 . 7.500 4.284 4.223 4.370 . 0 0 "[ . 1 . 2]" 1
338 2 26 LEU MD2 2 35 TRP HD1 3.400 . 6.500 4.057 4.009 4.107 . 0 0 "[ . 1 . 2]" 1
339 2 26 LEU MD2 2 79 PHE HB3 3.400 . 6.500 3.924 3.652 4.230 . 0 0 "[ . 1 . 2]" 1
340 2 26 LEU MD2 2 79 PHE HB2 3.400 . 6.500 4.490 4.301 4.775 . 0 0 "[ . 1 . 2]" 1
341 2 26 LEU MD2 2 79 PHE QD 3.400 . 8.500 4.065 3.893 4.250 . 0 0 "[ . 1 . 2]" 1
342 2 26 LEU MD2 2 81 PHE HA 3.900 . 7.500 6.149 6.107 6.180 . 0 0 "[ . 1 . 2]" 1
343 2 26 LEU MD2 2 81 PHE QD 3.900 . 9.500 4.941 4.879 5.007 . 0 0 "[ . 1 . 2]" 1
344 2 26 LEU MD2 2 81 PHE QE 2.900 . 6.800 3.521 3.420 3.621 . 0 0 "[ . 1 . 2]" 1
345 2 26 LEU MD2 2 81 PHE HZ 2.900 . 4.800 3.037 2.828 3.276 . 0 0 "[ . 1 . 2]" 1
346 2 26 LEU MD2 2 94 VAL HA 3.900 . 7.500 4.215 4.147 4.312 . 0 0 "[ . 1 . 2]" 1
347 2 26 LEU MD2 2 94 VAL MG2 2.900 . 6.300 2.161 2.124 2.201 . 0 0 "[ . 1 . 2]" 1
348 2 26 LEU HG 2 35 TRP HB3 3.400 . 5.000 5.271 5.236 5.294 0.294 10 0 "[ . 1 . 2]" 1
349 2 26 LEU HG 2 35 TRP HB2 3.400 . 5.000 3.590 3.566 3.610 . 0 0 "[ . 1 . 2]" 1
350 2 26 LEU HG 2 35 TRP HD1 3.900 . 6.000 4.018 3.906 4.101 . 0 0 "[ . 1 . 2]" 1
351 2 27 TYR HA 2 28 LEU QB 3.400 . 6.000 4.563 4.505 4.622 . 0 0 "[ . 1 . 2]" 1
352 2 27 TYR HB3 2 29 MET ME 3.400 . 6.500 2.938 2.106 3.695 . 0 0 "[ . 1 . 2]" 1
353 2 27 TYR HB3 2 34 ALA MB 3.900 . 7.500 4.170 3.846 4.433 . 0 0 "[ . 1 . 2]" 1
354 2 27 TYR HB3 2 35 TRP HA 3.900 . 6.000 5.762 5.626 5.871 . 0 0 "[ . 1 . 2]" 1
355 2 27 TYR HB3 2 43 PHE QE 3.900 . 8.000 4.192 3.750 4.638 . 0 0 "[ . 1 . 2]" 1
356 2 27 TYR HB3 2 43 PHE HZ 3.900 . 6.000 5.198 4.547 5.695 . 0 0 "[ . 1 . 2]" 1
357 2 10 VAL MG1 2 27 TYR HB2 3.900 . 7.500 3.760 3.453 4.326 . 0 0 "[ . 1 . 2]" 1
358 2 10 VAL MG2 2 27 TYR HB2 3.900 . 7.500 3.374 2.940 4.148 . 0 0 "[ . 1 . 2]" 1
359 2 27 TYR HB2 2 34 ALA MB 3.900 . 7.500 2.896 2.697 3.049 . 0 0 "[ . 1 . 2]" 1
360 2 27 TYR HB2 2 35 TRP HA 3.900 . 6.000 4.234 3.957 4.432 . 0 0 "[ . 1 . 2]" 1
361 2 27 TYR HB2 2 43 PHE QE 3.900 . 8.000 3.134 2.373 3.878 . 0 0 "[ . 1 . 2]" 1
362 2 27 TYR HB2 2 43 PHE HZ 3.900 . 6.000 4.674 3.979 5.162 . 0 0 "[ . 1 . 2]" 1
363 2 10 VAL MG2 2 27 TYR QD 3.400 . 8.500 3.027 2.623 3.520 . 0 0 "[ . 1 . 2]" 1
364 2 27 TYR QD 2 35 TRP HA 3.900 . 8.000 2.866 2.699 3.235 . 0 0 "[ . 1 . 2]" 1
365 2 27 TYR QD 2 43 PHE QE 3.900 . 10.000 2.322 1.999 2.768 . 0 0 "[ . 1 . 2]" 1
366 2 26 LEU HA 2 27 TYR QE 3.900 . 8.000 4.601 4.473 4.897 . 0 0 "[ . 1 . 2]" 1
367 2 27 TYR QE 2 35 TRP HA 3.900 . 8.000 4.307 3.719 5.072 . 0 0 "[ . 1 . 2]" 1
368 2 27 TYR QE 2 36 ALA MB 2.900 . 6.800 2.670 2.140 3.833 . 0 0 "[ . 1 . 2]" 1
369 2 27 TYR QE 2 43 PHE QE 3.900 . 10.000 3.063 2.779 3.563 . 0 0 "[ . 1 . 2]" 1
370 2 27 TYR HA 2 28 LEU HA 3.900 . 6.000 4.389 4.370 4.417 . 0 0 "[ . 1 . 2]" 1
371 2 28 LEU HA 2 29 MET HA 3.900 . 6.000 4.386 4.365 4.421 . 0 0 "[ . 1 . 2]" 1
372 2 28 LEU HA 2 29 MET QG 3.900 . 7.000 4.242 3.341 4.820 . 0 0 "[ . 1 . 2]" 1
373 2 28 LEU HA 2 33 ILE HA 2.900 . 3.300 2.274 2.223 2.335 . 0 0 "[ . 1 . 2]" 1
374 2 28 LEU HA 2 49 TYR QE 3.900 . 8.000 4.592 4.402 4.783 . 0 0 "[ . 1 . 2]" 1
375 2 12 LEU HA 2 28 LEU MD1 3.900 . 7.500 5.107 4.762 5.372 . 0 0 "[ . 1 . 2]" 1
376 2 26 LEU MD1 2 28 LEU MD1 2.900 . 6.300 4.345 4.316 4.371 . 0 0 "[ . 1 . 2]" 1
377 2 27 TYR HA 2 28 LEU MD1 3.900 . 7.500 5.336 5.084 5.536 . 0 0 "[ . 1 . 2]" 1
378 2 28 LEU MD1 2 33 ILE HA 3.900 . 7.500 4.580 4.270 5.021 . 0 0 "[ . 1 . 2]" 1
379 2 28 LEU MD1 2 49 TYR QE 2.900 . 6.800 4.012 3.686 4.413 . 0 0 "[ . 1 . 2]" 1
380 2 28 LEU MD1 2 94 VAL HA 2.900 . 4.800 2.056 2.009 2.115 . 0 0 "[ . 1 . 2]" 1
381 2 28 LEU MD1 2 97 LEU HA 3.400 . 6.500 5.052 4.881 5.162 . 0 0 "[ . 1 . 2]" 1
382 2 28 LEU MD1 2 97 LEU QB 2.900 . 5.800 2.476 2.294 2.599 . 0 0 "[ . 1 . 2]" 1
383 2 28 LEU MD1 2 97 LEU QD 2.400 . 8.100 2.151 2.053 2.273 . 0 0 "[ . 1 . 2]" 1
384 2 28 LEU MD1 2 98 LEU HA 3.400 . 6.500 4.373 4.101 4.692 . 0 0 "[ . 1 . 2]" 1
385 2 28 LEU MD1 2 98 LEU MD2 2.400 . 5.700 3.304 3.027 3.604 . 0 0 "[ . 1 . 2]" 1
386 2 28 LEU MD1 2 101 LEU MD1 2.900 . 6.300 3.686 3.358 3.979 . 0 0 "[ . 1 . 2]" 1
387 2 12 LEU HA 2 28 LEU MD2 3.900 . 7.500 6.265 6.147 6.335 . 0 0 "[ . 1 . 2]" 1
388 2 26 LEU MD1 2 28 LEU MD2 2.900 . 6.300 2.583 2.517 2.669 . 0 0 "[ . 1 . 2]" 1
389 2 26 LEU MD2 2 28 LEU MD2 2.400 . 5.700 1.666 1.577 1.745 0.223 3 0 "[ . 1 . 2]" 1
390 2 27 TYR HA 2 28 LEU MD2 2.900 . 4.800 3.833 3.781 3.911 . 0 0 "[ . 1 . 2]" 1
391 2 28 LEU MD2 2 33 ILE HA 3.400 . 6.500 2.659 2.518 2.921 . 0 0 "[ . 1 . 2]" 1
392 2 28 LEU MD2 2 49 TYR QE 3.400 . 8.500 3.565 3.341 3.717 . 0 0 "[ . 1 . 2]" 1
393 2 28 LEU MD2 2 81 PHE QE 3.900 . 9.500 5.666 5.559 5.799 . 0 0 "[ . 1 . 2]" 1
394 2 28 LEU MD2 2 81 PHE HZ 3.900 . 7.500 5.187 5.026 5.351 . 0 0 "[ . 1 . 2]" 1
395 2 28 LEU MD2 2 94 VAL HA 2.900 . 4.800 4.132 4.106 4.161 . 0 0 "[ . 1 . 2]" 1
396 2 28 LEU MD2 2 97 LEU QD 2.400 . 8.100 4.040 3.885 4.248 . 0 0 "[ . 1 . 2]" 1
397 2 28 LEU MD2 2 98 LEU MD2 2.400 . 5.700 3.455 2.982 3.572 . 0 0 "[ . 1 . 2]" 1
398 2 12 LEU MD2 2 28 LEU HG 2.900 . 4.800 2.072 1.663 2.508 0.137 1 0 "[ . 1 . 2]" 1
399 2 26 LEU MD1 2 28 LEU HG 3.900 . 7.500 4.573 4.498 4.640 . 0 0 "[ . 1 . 2]" 1
400 2 28 LEU HG 2 33 ILE HA 3.400 . 5.000 5.110 5.023 5.206 0.206 9 0 "[ . 1 . 2]" 1
401 2 28 LEU HG 2 49 TYR QE 3.400 . 7.000 6.093 5.907 6.306 . 0 0 "[ . 1 . 2]" 1
402 2 10 VAL HA 2 29 MET HB3 3.400 . 5.000 4.045 3.784 4.277 . 0 0 "[ . 1 . 2]" 1
403 2 10 VAL MG2 2 29 MET HB3 3.900 . 7.500 4.358 3.875 4.642 . 0 0 "[ . 1 . 2]" 1
404 2 28 LEU HA 2 29 MET HB3 3.900 . 6.000 5.665 5.542 5.727 . 0 0 "[ . 1 . 2]" 1
405 2 28 LEU HA 2 29 MET HB2 3.900 . 6.000 4.579 4.316 4.919 . 0 0 "[ . 1 . 2]" 1
406 2 29 MET HB2 2 32 ARG QG 3.900 . 7.000 2.270 1.894 3.248 . 0 0 "[ . 1 . 2]" 1
407 2 10 VAL HA 2 29 MET ME 2.900 . 4.800 3.852 3.761 4.020 . 0 0 "[ . 1 . 2]" 1
408 2 10 VAL MG1 2 29 MET ME 2.900 . 6.300 3.657 3.256 4.129 . 0 0 "[ . 1 . 2]" 1
409 2 10 VAL MG2 2 29 MET ME 2.400 . 5.700 1.958 1.667 2.167 0.133 5 0 "[ . 1 . 2]" 1
410 2 27 TYR HA 2 29 MET ME 3.400 . 6.500 4.749 4.062 5.355 . 0 0 "[ . 1 . 2]" 1
411 2 27 TYR HB2 2 29 MET ME 2.900 . 4.800 2.642 2.246 3.264 . 0 0 "[ . 1 . 2]" 1
412 2 27 TYR QD 2 29 MET ME 2.900 . 6.800 3.922 3.535 4.479 . 0 0 "[ . 1 . 2]" 1
413 2 27 TYR QE 2 29 MET ME 3.400 . 8.500 5.393 5.046 5.852 . 0 0 "[ . 1 . 2]" 1
414 2 28 LEU HA 2 29 MET ME 3.900 . 7.500 4.679 3.946 5.219 . 0 0 "[ . 1 . 2]" 1
415 2 29 MET ME 2 32 ARG QG 2.400 . 5.200 3.917 3.692 4.059 . 0 0 "[ . 1 . 2]" 1
416 2 29 MET ME 2 33 ILE HA 3.900 . 7.500 5.067 4.488 5.544 . 0 0 "[ . 1 . 2]" 1
417 2 29 MET ME 2 34 ALA MB 2.400 . 5.700 1.964 1.566 2.339 0.234 11 0 "[ . 1 . 2]" 1
418 2 29 MET ME 2 43 PHE QD 2.900 . 6.800 3.990 3.737 4.295 . 0 0 "[ . 1 . 2]" 1
419 2 29 MET ME 2 43 PHE QE 2.900 . 6.800 3.456 3.015 3.809 . 0 0 "[ . 1 . 2]" 1
420 2 29 MET ME 2 43 PHE HZ 2.900 . 4.800 3.764 3.340 4.092 . 0 0 "[ . 1 . 2]" 1
421 2 10 VAL MG2 2 29 MET QG 2.900 . 5.800 2.218 1.939 2.629 . 0 0 "[ . 1 . 2]" 1
422 2 29 MET QG 2 32 ARG QG 3.900 . 8.000 3.442 2.491 4.815 . 0 0 "[ . 1 . 2]" 1
423 2 29 MET QG 2 34 ALA MB 3.900 . 8.500 3.724 2.532 4.124 . 0 0 "[ . 1 . 2]" 1
424 2 29 MET HA 2 30 ALA HA 3.900 . 6.000 4.264 4.230 4.285 . 0 0 "[ . 1 . 2]" 1
425 2 30 ALA HA 2 49 TYR QE 3.400 . 7.000 3.372 2.888 3.907 . 0 0 "[ . 1 . 2]" 1
426 2 30 ALA HA 2 101 LEU MD1 3.900 . 7.500 3.143 2.658 3.867 . 0 0 "[ . 1 . 2]" 1
427 2 30 ALA HA 2 105 PHE HZ 3.400 . 5.000 5.022 4.813 5.168 0.168 15 0 "[ . 1 . 2]" 1
428 2 9 GLU QB 2 30 ALA MB 2.400 . 5.200 2.962 2.084 3.872 . 0 0 "[ . 1 . 2]" 1
429 2 11 LEU MD1 2 30 ALA MB 2.900 . 6.300 2.574 2.115 3.257 . 0 0 "[ . 1 . 2]" 1
430 2 29 MET HA 2 30 ALA MB 3.400 . 6.500 4.136 4.076 4.202 . 0 0 "[ . 1 . 2]" 1
431 2 30 ALA MB 2 31 GLU QG 2.900 . 5.800 2.761 2.394 3.492 . 0 0 "[ . 1 . 2]" 1
432 2 30 ALA MB 2 49 TYR QE 3.400 . 8.500 4.476 4.230 4.704 . 0 0 "[ . 1 . 2]" 1
433 2 30 ALA MB 2 105 PHE QE 3.900 . 9.500 4.517 4.226 5.073 . 0 0 "[ . 1 . 2]" 1
434 2 31 GLU HA 2 49 TYR QD 2.400 . 4.700 2.859 2.457 3.438 . 0 0 "[ . 1 . 2]" 1
435 2 31 GLU HA 2 105 PHE QE 2.900 . 5.300 3.076 1.148 3.670 0.652 15 1 "[ . 1 + 2]" 1
436 2 31 GLU HB3 2 49 TYR QD 3.900 . 8.000 4.838 4.205 5.450 . 0 0 "[ . 1 . 2]" 1
437 2 31 GLU HB3 2 105 PHE QE 3.400 . 7.000 3.676 2.048 5.055 . 0 0 "[ . 1 . 2]" 1
438 2 31 GLU HB2 2 49 TYR QD 3.900 . 8.000 5.448 5.055 5.782 . 0 0 "[ . 1 . 2]" 1
439 2 31 GLU HB2 2 105 PHE QE 3.900 . 8.000 4.951 3.737 6.060 . 0 0 "[ . 1 . 2]" 1
440 2 31 GLU QG 2 49 TYR QD 3.900 . 9.000 5.032 4.071 5.628 . 0 0 "[ . 1 . 2]" 1
441 2 31 GLU QG 2 105 PHE QE 2.900 . 6.300 3.420 2.226 4.752 . 0 0 "[ . 1 . 2]" 1
442 2 32 ARG HA 2 33 ILE HA 3.900 . 6.000 4.384 4.348 4.413 . 0 0 "[ . 1 . 2]" 1
443 2 32 ARG HA 2 48 MET HA 2.900 . 3.300 2.356 2.043 2.612 . 0 0 "[ . 1 . 2]" 1
444 2 32 ARG HA 2 48 MET HB3 3.900 . 6.000 4.443 4.135 4.936 . 0 0 "[ . 1 . 2]" 1
445 2 32 ARG HA 2 49 TYR QE 3.400 . 7.000 3.647 3.408 3.842 . 0 0 "[ . 1 . 2]" 1
446 2 32 ARG HB2 2 48 MET HA 2.900 . 3.300 2.431 2.046 2.777 . 0 0 "[ . 1 . 2]" 1
447 2 32 ARG QD 2 34 ALA MB 3.400 . 7.500 3.564 2.394 5.203 . 0 0 "[ . 1 . 2]" 1
448 2 32 ARG QD 2 48 MET HA 3.900 . 7.000 4.336 3.929 5.097 . 0 0 "[ . 1 . 2]" 1
449 2 33 ILE HA 2 34 ALA MB 3.900 . 7.500 3.999 3.981 4.026 . 0 0 "[ . 1 . 2]" 1
450 2 33 ILE HA 2 49 TYR QE 3.400 . 7.000 3.578 3.297 3.930 . 0 0 "[ . 1 . 2]" 1
451 2 28 LEU HA 2 33 ILE HB 3.900 . 6.000 3.691 3.506 4.042 . 0 0 "[ . 1 . 2]" 1
452 2 33 ILE HB 2 49 TYR QE 2.900 . 5.300 2.108 1.505 2.397 0.295 7 0 "[ . 1 . 2]" 1
453 2 26 LEU MD1 2 33 ILE MD 2.900 . 6.300 1.937 1.819 2.161 . 0 0 "[ . 1 . 2]" 1
454 2 28 LEU HA 2 33 ILE MD 3.400 . 6.500 4.596 4.416 4.859 . 0 0 "[ . 1 . 2]" 1
455 2 33 ILE MD 2 47 HIS HD2 2.900 . 4.800 3.853 3.261 3.944 . 0 0 "[ . 1 . 2]" 1
456 2 26 LEU MD1 2 33 ILE QG 3.400 . 7.500 2.237 2.040 2.522 . 0 0 "[ . 1 . 2]" 1
457 2 28 LEU HA 2 33 ILE QG 3.400 . 6.000 3.534 3.303 3.709 . 0 0 "[ . 1 . 2]" 1
458 2 33 ILE QG 2 34 ALA HA 3.900 . 7.000 3.582 3.348 4.285 . 0 0 "[ . 1 . 2]" 1
459 2 28 LEU HA 2 33 ILE MG 3.900 . 7.500 4.854 4.746 5.015 . 0 0 "[ . 1 . 2]" 1
460 2 32 ARG HA 2 33 ILE MG 2.900 . 4.800 3.289 3.220 3.457 . 0 0 "[ . 1 . 2]" 1
461 2 33 ILE MG 2 34 ALA HA 3.900 . 7.500 4.447 4.192 4.541 . 0 0 "[ . 1 . 2]" 1
462 2 33 ILE MG 2 45 ILE MG 2.900 . 6.300 3.718 3.496 3.884 . 0 0 "[ . 1 . 2]" 1
463 2 33 ILE MG 2 46 SER HA 3.900 . 7.500 4.477 4.244 4.698 . 0 0 "[ . 1 . 2]" 1
464 2 33 ILE MG 2 47 HIS HB3 2.900 . 4.800 3.500 3.304 3.634 . 0 0 "[ . 1 . 2]" 1
465 2 33 ILE MG 2 47 HIS HB2 2.900 . 4.800 2.073 1.911 2.324 . 0 0 "[ . 1 . 2]" 1
466 2 33 ILE MG 2 47 HIS HD2 2.900 . 4.800 3.154 2.925 3.696 . 0 0 "[ . 1 . 2]" 1
467 2 33 ILE MG 2 49 TYR HA 2.900 . 4.800 3.880 3.828 3.937 . 0 0 "[ . 1 . 2]" 1
468 2 33 ILE MG 2 49 TYR QE 2.900 . 6.800 2.296 2.116 2.621 . 0 0 "[ . 1 . 2]" 1
469 2 33 ILE MG 2 52 ILE QG 2.900 . 5.800 3.109 2.816 3.295 . 0 0 "[ . 1 . 2]" 1
470 2 33 ILE MG 2 77 THR HB 3.900 . 7.500 5.273 5.069 5.450 . 0 0 "[ . 1 . 2]" 1
471 2 33 ILE MG 2 98 LEU MD2 2.900 . 6.300 2.788 2.574 3.060 . 0 0 "[ . 1 . 2]" 1
472 2 27 TYR HB2 2 34 ALA HA 3.900 . 6.000 5.365 5.163 5.515 . 0 0 "[ . 1 . 2]" 1
473 2 34 ALA HA 2 35 TRP HA 3.900 . 6.000 4.447 4.376 4.467 . 0 0 "[ . 1 . 2]" 1
474 2 34 ALA HA 2 35 TRP HB3 3.900 . 6.000 4.272 4.217 4.438 . 0 0 "[ . 1 . 2]" 1
475 2 34 ALA HA 2 45 ILE MG 3.400 . 6.500 2.618 2.407 3.400 . 0 0 "[ . 1 . 2]" 1
476 2 34 ALA HA 2 46 SER HA 2.900 . 3.300 2.529 2.406 2.737 . 0 0 "[ . 1 . 2]" 1
477 2 34 ALA HA 2 46 SER HB3 3.900 . 6.000 5.298 5.183 5.521 . 0 0 "[ . 1 . 2]" 1
478 2 34 ALA HA 2 46 SER HB2 3.900 . 6.000 4.160 3.943 4.420 . 0 0 "[ . 1 . 2]" 1
479 2 27 TYR QD 2 34 ALA MB 3.900 . 9.500 3.894 3.287 4.449 . 0 0 "[ . 1 . 2]" 1
480 2 34 ALA MB 2 35 TRP HA 3.900 . 7.500 3.909 3.884 4.166 . 0 0 "[ . 1 . 2]" 1
481 2 34 ALA MB 2 43 PHE HB3 2.900 . 4.800 2.682 2.444 2.983 . 0 0 "[ . 1 . 2]" 1
482 2 34 ALA MB 2 43 PHE QD 2.900 . 6.800 2.881 2.349 3.312 . 0 0 "[ . 1 . 2]" 1
483 2 34 ALA MB 2 43 PHE QE 3.400 . 8.500 3.703 3.134 4.056 . 0 0 "[ . 1 . 2]" 1
484 2 34 ALA MB 2 45 ILE HB 3.900 . 7.500 4.582 4.404 4.799 . 0 0 "[ . 1 . 2]" 1
485 2 34 ALA MB 2 46 SER HA 2.900 . 4.800 3.083 2.930 3.308 . 0 0 "[ . 1 . 2]" 1
486 2 34 ALA MB 2 46 SER HB3 3.400 . 6.500 4.902 4.742 5.161 . 0 0 "[ . 1 . 2]" 1
487 2 34 ALA MB 2 46 SER HB2 2.900 . 4.800 3.616 3.443 3.861 . 0 0 "[ . 1 . 2]" 1
488 2 34 ALA MB 2 47 HIS HD2 3.900 . 7.500 5.952 5.777 6.260 . 0 0 "[ . 1 . 2]" 1
489 2 26 LEU HB2 2 35 TRP HA 3.900 . 6.000 4.341 4.204 4.471 . 0 0 "[ . 1 . 2]" 1
490 2 35 TRP HA 2 36 ALA MB 3.400 . 6.500 3.911 3.864 3.941 . 0 0 "[ . 1 . 2]" 1
491 2 35 TRP HA 2 43 PHE QD 3.900 . 8.000 3.273 2.840 3.876 . 0 0 "[ . 1 . 2]" 1
492 2 35 TRP HA 2 45 ILE HB 3.900 . 6.000 3.988 3.937 4.129 . 0 0 "[ . 1 . 2]" 1
493 2 35 TRP HA 2 45 ILE MG 3.900 . 7.500 4.481 4.264 4.983 . 0 0 "[ . 1 . 2]" 1
494 2 35 TRP HA 2 79 PHE QE 3.900 . 8.000 4.860 4.734 5.039 . 0 0 "[ . 1 . 2]" 1
495 2 35 TRP HB3 2 45 ILE HA 3.900 . 6.000 4.672 4.621 4.774 . 0 0 "[ . 1 . 2]" 1
496 2 35 TRP HB3 2 45 ILE HB 2.900 . 3.300 1.743 1.708 1.796 0.092 18 0 "[ . 1 . 2]" 1
497 2 35 TRP HB3 2 45 ILE QG 3.900 . 7.000 2.643 2.572 2.724 . 0 0 "[ . 1 . 2]" 1
498 2 35 TRP HB3 2 45 ILE MG 2.900 . 4.800 2.404 2.147 2.855 . 0 0 "[ . 1 . 2]" 1
499 2 35 TRP HB3 2 77 THR MG 3.900 . 7.500 5.086 4.713 5.552 . 0 0 "[ . 1 . 2]" 1
500 2 35 TRP HB3 2 79 PHE QE 3.400 . 7.000 2.465 2.291 2.608 . 0 0 "[ . 1 . 2]" 1
501 2 35 TRP HB2 2 45 ILE HB 2.900 . 3.300 3.361 3.327 3.392 0.092 13 0 "[ . 1 . 2]" 1
502 2 35 TRP HB2 2 45 ILE MG 2.900 . 4.800 3.251 3.010 3.691 . 0 0 "[ . 1 . 2]" 1
503 2 35 TRP HB2 2 77 THR MG 3.900 . 7.500 5.810 5.429 6.228 . 0 0 "[ . 1 . 2]" 1
504 2 35 TRP HB2 2 79 PHE QE 3.400 . 7.000 2.777 2.604 3.016 . 0 0 "[ . 1 . 2]" 1
505 2 35 TRP HD1 2 79 PHE QE 3.400 . 7.000 3.678 3.459 3.917 . 0 0 "[ . 1 . 2]" 1
506 2 35 TRP HD1 2 79 PHE HZ 3.900 . 6.000 5.517 5.344 5.684 . 0 0 "[ . 1 . 2]" 1
507 2 19 GLN QB 2 35 TRP HE3 3.900 . 7.000 3.501 3.344 3.761 . 0 0 "[ . 1 . 2]" 1
508 2 35 TRP HE3 2 36 ALA HA 3.900 . 6.000 3.701 3.244 4.151 . 0 0 "[ . 1 . 2]" 1
509 2 35 TRP HE3 2 36 ALA MB 3.900 . 7.500 5.000 4.595 5.350 . 0 0 "[ . 1 . 2]" 1
510 2 35 TRP HE3 2 37 PRO QD 3.900 . 7.000 3.541 3.124 3.879 . 0 0 "[ . 1 . 2]" 1
511 2 35 TRP HE3 2 37 PRO QG 3.900 . 7.000 4.279 3.712 5.144 . 0 0 "[ . 1 . 2]" 1
512 2 35 TRP HE3 2 44 THR HB 3.900 . 6.000 4.373 4.013 4.781 . 0 0 "[ . 1 . 2]" 1
513 2 35 TRP HE3 2 45 ILE HB 3.400 . 5.000 2.468 2.238 2.887 . 0 0 "[ . 1 . 2]" 1
514 2 35 TRP HE3 2 45 ILE MD 2.900 . 4.800 3.643 3.515 3.782 . 0 0 "[ . 1 . 2]" 1
515 2 35 TRP HE3 2 45 ILE QG 3.400 . 6.000 1.893 1.737 2.044 0.063 18 0 "[ . 1 . 2]" 1
516 2 35 TRP HE3 2 79 PHE QE 3.900 . 8.000 3.825 3.528 4.120 . 0 0 "[ . 1 . 2]" 1
517 2 35 TRP HH2 2 37 PRO HA 3.400 . 5.000 3.198 2.748 3.636 . 0 0 "[ . 1 . 2]" 1
518 2 35 TRP HH2 2 37 PRO QB 2.900 . 4.300 2.726 2.033 3.331 . 0 0 "[ . 1 . 2]" 1
519 2 35 TRP HH2 2 37 PRO QG 3.400 . 6.000 3.121 2.586 4.082 . 0 0 "[ . 1 . 2]" 1
520 2 19 GLN QG 2 35 TRP HZ2 3.900 . 7.000 5.226 4.853 5.526 . 0 0 "[ . 1 . 2]" 1
521 2 35 TRP HZ2 2 37 PRO QB 3.400 . 6.000 3.998 3.535 4.522 . 0 0 "[ . 1 . 2]" 1
522 2 35 TRP HZ2 2 37 PRO QG 3.900 . 7.000 4.827 4.277 5.616 . 0 0 "[ . 1 . 2]" 1
523 2 19 GLN QB 2 35 TRP HZ3 3.900 . 7.000 3.037 2.768 3.406 . 0 0 "[ . 1 . 2]" 1
524 2 22 GLN QB 2 35 TRP HZ3 3.900 . 7.000 4.227 3.283 5.201 . 0 0 "[ . 1 . 2]" 1
525 2 22 GLN QG 2 35 TRP HZ3 3.900 . 7.000 4.024 2.978 4.870 . 0 0 "[ . 1 . 2]" 1
526 2 35 TRP HZ3 2 36 ALA HA 3.900 . 6.000 4.468 3.882 5.063 . 0 0 "[ . 1 . 2]" 1
527 2 35 TRP HZ3 2 37 PRO HA 3.900 . 6.000 4.372 3.774 4.918 . 0 0 "[ . 1 . 2]" 1
528 2 35 TRP HZ3 2 37 PRO QB 3.400 . 6.000 3.758 2.709 4.436 . 0 0 "[ . 1 . 2]" 1
529 2 35 TRP HZ3 2 37 PRO QD 3.400 . 6.000 3.184 2.285 3.527 . 0 0 "[ . 1 . 2]" 1
530 2 35 TRP HZ3 2 37 PRO QG 2.900 . 4.300 2.658 2.102 3.570 . 0 0 "[ . 1 . 2]" 1
531 2 35 TRP HZ3 2 44 THR HB 3.900 . 6.000 3.818 3.439 4.232 . 0 0 "[ . 1 . 2]" 1
532 2 35 TRP HZ3 2 44 THR MG 3.400 . 6.500 4.031 3.781 4.467 . 0 0 "[ . 1 . 2]" 1
533 2 35 TRP HZ3 2 45 ILE MD 3.900 . 7.500 4.242 4.018 4.459 . 0 0 "[ . 1 . 2]" 1
534 2 35 TRP HA 2 36 ALA HA 3.900 . 6.000 4.399 4.370 4.449 . 0 0 "[ . 1 . 2]" 1
535 2 36 ALA HA 2 37 PRO QB 3.400 . 6.000 4.666 4.536 4.726 . 0 0 "[ . 1 . 2]" 1
536 2 36 ALA HA 2 37 PRO QD 2.900 . 4.300 1.835 1.750 1.979 0.050 2 0 "[ . 1 . 2]" 1
537 2 36 ALA HA 2 37 PRO QG 3.400 . 6.000 3.736 3.642 3.877 . 0 0 "[ . 1 . 2]" 1
538 2 36 ALA HA 2 43 PHE HA 2.900 . 3.300 2.394 2.014 3.173 . 0 0 "[ . 1 . 2]" 1
539 2 36 ALA HA 2 43 PHE QD 3.900 . 8.000 3.774 3.378 4.195 . 0 0 "[ . 1 . 2]" 1
540 2 36 ALA HA 2 43 PHE QE 3.900 . 8.000 5.467 5.060 6.166 . 0 0 "[ . 1 . 2]" 1
541 2 36 ALA HA 2 44 THR MG 3.400 . 6.500 4.289 3.908 4.633 . 0 0 "[ . 1 . 2]" 1
542 2 27 TYR QD 2 36 ALA MB 2.900 . 6.800 3.622 3.181 4.053 . 0 0 "[ . 1 . 2]" 1
543 2 34 ALA MB 2 36 ALA MB 3.400 . 8.000 4.553 4.400 4.649 . 0 0 "[ . 1 . 2]" 1
544 2 36 ALA MB 2 37 PRO QD 2.900 . 5.800 2.632 2.456 2.817 . 0 0 "[ . 1 . 2]" 1
545 2 36 ALA MB 2 43 PHE HA 2.900 . 4.800 2.129 1.632 2.608 0.168 20 0 "[ . 1 . 2]" 1
546 2 36 ALA MB 2 43 PHE HB3 3.400 . 6.500 3.384 2.939 3.663 . 0 0 "[ . 1 . 2]" 1
547 2 36 ALA MB 2 43 PHE QD 2.900 . 6.800 2.316 1.931 2.776 . 0 0 "[ . 1 . 2]" 1
548 2 36 ALA MB 2 43 PHE QE 2.900 . 6.800 3.171 2.920 3.467 . 0 0 "[ . 1 . 2]" 1
549 2 35 TRP HZ2 2 37 PRO HA 3.400 . 5.000 3.114 2.988 3.299 . 0 0 "[ . 1 . 2]" 1
550 2 36 ALA HA 2 37 PRO HA 3.900 . 6.000 4.432 4.414 4.465 . 0 0 "[ . 1 . 2]" 1
551 2 37 PRO QB 2 44 THR MG 3.400 . 7.500 4.361 3.867 4.780 . 0 0 "[ . 1 . 2]" 1
552 2 37 PRO QD 2 40 LYS QG 3.900 . 8.000 2.981 2.026 4.391 . 0 0 "[ . 1 . 2]" 1
553 2 37 PRO QD 2 43 PHE HA 3.900 . 7.000 3.200 2.747 3.950 . 0 0 "[ . 1 . 2]" 1
554 2 37 PRO QD 2 44 THR MG 2.900 . 5.800 2.919 2.699 3.230 . 0 0 "[ . 1 . 2]" 1
555 2 36 ALA MB 2 37 PRO QG 3.900 . 8.500 4.259 3.922 4.417 . 0 0 "[ . 1 . 2]" 1
556 2 37 PRO QG 2 40 LYS QD 2.900 . 5.300 3.089 1.670 3.940 0.130 12 0 "[ . 1 . 2]" 1
557 2 37 PRO QG 2 40 LYS QG 2.900 . 5.300 2.590 2.037 4.055 . 0 0 "[ . 1 . 2]" 1
558 2 37 PRO QG 2 44 THR HA 3.900 . 7.000 5.255 4.852 6.007 . 0 0 "[ . 1 . 2]" 1
559 2 37 PRO QG 2 44 THR MG 2.900 . 5.800 2.741 2.318 3.181 . 0 0 "[ . 1 . 2]" 1
560 2 25 ALA MB 2 38 GLU HA 3.900 . 7.500 4.652 4.141 5.074 . 0 0 "[ . 1 . 2]" 1
561 2 38 GLU QB 2 39 GLY QA 3.900 . 8.000 3.945 3.718 4.215 . 0 0 "[ . 1 . 2]" 1
562 2 38 GLU QG 2 39 GLY QA 3.900 . 8.000 4.253 3.443 5.065 . 0 0 "[ . 1 . 2]" 1
563 2 39 GLY QA 2 40 LYS HA 3.900 . 7.000 4.004 3.984 4.074 . 0 0 "[ . 1 . 2]" 1
564 2 37 PRO QD 2 40 LYS QB 3.400 . 7.000 2.384 1.944 3.628 . 0 0 "[ . 1 . 2]" 1
565 2 36 ALA MB 2 41 ASP HA 3.400 . 6.500 4.940 4.323 5.511 . 0 0 "[ . 1 . 2]" 1
566 2 40 LYS QB 2 42 ARG HA 3.900 . 7.000 4.884 4.649 5.183 . 0 0 "[ . 1 . 2]" 1
567 2 42 ARG HA 2 43 PHE QD 3.900 . 8.000 3.576 3.119 4.224 . 0 0 "[ . 1 . 2]" 1
568 2 40 LYS HA 2 42 ARG QB 3.900 . 7.000 6.150 5.424 6.458 . 0 0 "[ . 1 . 2]" 1
569 2 42 ARG QD 2 44 THR MG 2.900 . 5.800 4.123 3.010 4.390 . 0 0 "[ . 1 . 2]" 1
570 2 41 ASP HA 2 42 ARG QG 3.900 . 7.000 5.114 4.735 6.250 . 0 0 "[ . 1 . 2]" 1
571 2 36 ALA HA 2 43 PHE HB3 3.900 . 6.000 4.001 3.673 4.523 . 0 0 "[ . 1 . 2]" 1
572 2 34 ALA MB 2 43 PHE HB2 2.900 . 4.800 3.387 2.805 3.762 . 0 0 "[ . 1 . 2]" 1
573 2 36 ALA HA 2 43 PHE HB2 3.900 . 6.000 5.188 4.859 5.826 . 0 0 "[ . 1 . 2]" 1
574 2 36 ALA MB 2 43 PHE HB2 3.900 . 7.500 4.162 3.955 4.448 . 0 0 "[ . 1 . 2]" 1
575 2 27 TYR QD 2 43 PHE QD 3.900 . 10.000 3.101 2.766 3.644 . 0 0 "[ . 1 . 2]" 1
576 2 10 VAL MG2 2 43 PHE HZ 3.900 . 7.500 4.399 4.046 4.827 . 0 0 "[ . 1 . 2]" 1
577 2 27 TYR QD 2 43 PHE HZ 3.900 . 8.000 4.354 3.731 4.745 . 0 0 "[ . 1 . 2]" 1
578 2 35 TRP HZ3 2 44 THR HA 3.900 . 6.000 5.780 5.536 6.011 0.011 20 0 "[ . 1 . 2]" 1
579 2 36 ALA HA 2 44 THR HB 3.900 . 6.000 5.445 4.934 6.007 0.007 6 0 "[ . 1 . 2]" 1
580 2 37 PRO QD 2 44 THR HB 3.900 . 7.000 4.175 3.900 4.463 . 0 0 "[ . 1 . 2]" 1
581 2 37 PRO QG 2 44 THR HB 3.900 . 7.000 4.166 3.877 4.766 . 0 0 "[ . 1 . 2]" 1
582 2 44 THR HB 2 45 ILE HB 3.900 . 6.000 5.339 5.058 5.620 . 0 0 "[ . 1 . 2]" 1
583 2 44 THR HB 2 45 ILE MD 3.900 . 7.500 3.868 3.480 4.184 . 0 0 "[ . 1 . 2]" 1
584 2 35 TRP HE3 2 44 THR MG 3.900 . 7.500 4.880 4.755 5.159 . 0 0 "[ . 1 . 2]" 1
585 2 34 ALA HA 2 45 ILE HA 3.900 . 6.000 4.947 4.833 5.063 . 0 0 "[ . 1 . 2]" 1
586 2 45 ILE HA 2 46 SER HA 3.900 . 6.000 4.385 4.368 4.407 . 0 0 "[ . 1 . 2]" 1
587 2 45 ILE HA 2 46 SER HB2 3.900 . 6.000 4.576 4.364 4.757 . 0 0 "[ . 1 . 2]" 1
588 2 26 LEU MD1 2 45 ILE HB 3.900 . 7.500 4.210 4.136 4.403 . 0 0 "[ . 1 . 2]" 1
589 2 35 TRP HZ3 2 45 ILE HB 3.900 . 6.000 4.812 4.584 5.223 . 0 0 "[ . 1 . 2]" 1
590 2 45 ILE HB 2 77 THR MG 3.900 . 7.500 4.937 4.561 5.289 . 0 0 "[ . 1 . 2]" 1
591 2 35 TRP HB3 2 45 ILE MD 2.900 . 4.800 4.090 4.070 4.134 . 0 0 "[ . 1 . 2]" 1
592 2 35 TRP HB2 2 45 ILE MD 3.400 . 6.500 5.371 5.309 5.467 . 0 0 "[ . 1 . 2]" 1
593 2 45 ILE MD 2 77 THR HB 3.900 . 7.500 4.724 4.390 5.001 . 0 0 "[ . 1 . 2]" 1
594 2 45 ILE MD 2 77 THR MG 2.400 . 5.700 2.333 2.071 2.585 . 0 0 "[ . 1 . 2]" 1
595 2 35 TRP HZ3 2 45 ILE QG 3.900 . 7.000 3.054 2.882 3.230 . 0 0 "[ . 1 . 2]" 1
596 2 44 THR HB 2 45 ILE QG 3.900 . 7.000 3.624 3.450 3.853 . 0 0 "[ . 1 . 2]" 1
597 2 45 ILE QG 2 77 THR MG 3.900 . 8.500 3.403 2.949 3.736 . 0 0 "[ . 1 . 2]" 1
598 2 35 TRP HE3 2 45 ILE MG 3.900 . 7.500 3.831 3.651 4.097 . 0 0 "[ . 1 . 2]" 1
599 2 44 THR HB 2 45 ILE MG 3.900 . 7.500 5.781 5.546 5.993 . 0 0 "[ . 1 . 2]" 1
600 2 45 ILE MG 2 46 SER HA 2.900 . 4.800 3.222 3.171 3.463 . 0 0 "[ . 1 . 2]" 1
601 2 45 ILE MG 2 47 HIS HA 3.900 . 7.500 5.102 5.002 5.165 . 0 0 "[ . 1 . 2]" 1
602 2 45 ILE MG 2 47 HIS HD2 2.900 . 4.800 2.006 1.851 2.183 . 0 0 "[ . 1 . 2]" 1
603 2 45 ILE MG 2 77 THR HB 3.400 . 6.500 4.575 4.053 4.827 . 0 0 "[ . 1 . 2]" 1
604 2 45 ILE MG 2 77 THR MG 2.400 . 5.700 2.739 2.301 3.049 . 0 0 "[ . 1 . 2]" 1
605 2 45 ILE MG 2 79 PHE HZ 2.900 . 4.800 1.479 1.326 1.718 0.474 14 0 "[ . 1 . 2]" 1
606 2 43 PHE HB2 2 46 SER HB3 3.900 . 6.000 5.543 5.255 5.821 . 0 0 "[ . 1 . 2]" 1
607 2 43 PHE QD 2 46 SER HB3 3.900 . 8.000 6.833 6.434 7.094 . 0 0 "[ . 1 . 2]" 1
608 2 43 PHE HB2 2 46 SER HB2 3.900 . 6.000 3.948 3.630 4.133 . 0 0 "[ . 1 . 2]" 1
609 2 43 PHE QD 2 46 SER HB2 3.900 . 8.000 5.372 4.997 5.635 . 0 0 "[ . 1 . 2]" 1
610 2 32 ARG HB3 2 47 HIS HA 3.900 . 6.000 5.882 5.673 6.050 0.050 2 0 "[ . 1 . 2]" 1
611 2 33 ILE MG 2 47 HIS HA 3.900 . 7.500 4.267 4.169 4.374 . 0 0 "[ . 1 . 2]" 1
612 2 46 SER HA 2 47 HIS HA 3.900 . 6.000 4.385 4.365 4.393 . 0 0 "[ . 1 . 2]" 1
613 2 46 SER HB3 2 47 HIS HA 3.900 . 6.000 4.783 4.564 4.948 . 0 0 "[ . 1 . 2]" 1
614 2 47 HIS HA 2 48 MET HA 3.900 . 6.000 4.351 4.329 4.364 . 0 0 "[ . 1 . 2]" 1
615 2 47 HIS HA 2 52 ILE MD 3.900 . 7.500 3.994 3.749 4.173 . 0 0 "[ . 1 . 2]" 1
616 2 47 HIS HA 2 71 LEU MD1 3.900 . 7.500 5.183 4.806 5.638 . 0 0 "[ . 1 . 2]" 1
617 2 47 HIS HA 2 71 LEU MD2 3.900 . 7.500 5.322 5.042 5.537 . 0 0 "[ . 1 . 2]" 1
618 2 47 HIS HB3 2 52 ILE MD 2.900 . 4.800 2.128 1.882 2.373 . 0 0 "[ . 1 . 2]" 1
619 2 47 HIS HB3 2 52 ILE MG 3.900 . 7.500 4.799 4.508 5.012 . 0 0 "[ . 1 . 2]" 1
620 2 47 HIS HB3 2 71 LEU MD1 3.900 . 7.500 3.814 3.472 4.180 . 0 0 "[ . 1 . 2]" 1
621 2 47 HIS HB3 2 71 LEU MD2 3.400 . 6.500 3.398 3.130 3.619 . 0 0 "[ . 1 . 2]" 1
622 2 47 HIS HB2 2 52 ILE MD 2.900 . 4.800 2.273 2.125 2.441 . 0 0 "[ . 1 . 2]" 1
623 2 47 HIS HB2 2 52 ILE MG 3.900 . 7.500 4.911 4.697 5.134 . 0 0 "[ . 1 . 2]" 1
624 2 47 HIS HB2 2 71 LEU MD1 3.900 . 7.500 4.881 4.547 5.233 . 0 0 "[ . 1 . 2]" 1
625 2 47 HIS HB2 2 71 LEU MD2 3.900 . 7.500 4.145 3.873 4.410 . 0 0 "[ . 1 . 2]" 1
626 2 47 HIS HD2 2 52 ILE MD 3.900 . 7.500 4.251 3.974 4.507 . 0 0 "[ . 1 . 2]" 1
627 2 32 ARG QG 2 48 MET HA 3.900 . 7.000 4.266 3.958 4.516 . 0 0 "[ . 1 . 2]" 1
628 2 48 MET HB3 2 50 ALA MB 3.400 . 6.500 2.970 2.718 3.198 . 0 0 "[ . 1 . 2]" 1
629 2 48 MET ME 2 49 TYR QD 3.400 . 8.500 5.181 4.190 6.507 . 0 0 "[ . 1 . 2]" 1
630 2 48 MET ME 2 105 PHE QD 3.900 . 9.500 4.561 2.844 6.803 . 0 0 "[ . 1 . 2]" 1
631 2 49 TYR HA 2 52 ILE HB 3.400 . 5.000 3.126 2.973 3.282 . 0 0 "[ . 1 . 2]" 1
632 2 49 TYR HA 2 52 ILE MD 2.900 . 4.800 3.385 3.259 3.473 . 0 0 "[ . 1 . 2]" 1
633 2 49 TYR HA 2 52 ILE MG 2.900 . 4.800 4.044 4.015 4.076 . 0 0 "[ . 1 . 2]" 1
634 2 49 TYR HA 2 105 PHE QD 3.900 . 8.000 5.086 4.410 5.701 . 0 0 "[ . 1 . 2]" 1
635 2 49 TYR HB3 2 102 LEU HA 3.400 . 5.000 1.995 1.728 2.289 0.072 10 0 "[ . 1 . 2]" 1
636 2 49 TYR HB3 2 102 LEU MD1 3.900 . 7.500 4.521 4.436 4.630 . 0 0 "[ . 1 . 2]" 1
637 2 49 TYR HB3 2 102 LEU MD2 2.900 . 4.800 1.667 1.543 1.878 0.257 12 0 "[ . 1 . 2]" 1
638 2 49 TYR HB3 2 105 PHE HB3 3.900 . 6.000 4.239 3.656 5.314 . 0 0 "[ . 1 . 2]" 1
639 2 49 TYR HB3 2 105 PHE HB2 3.400 . 5.000 2.869 2.406 4.043 . 0 0 "[ . 1 . 2]" 1
640 2 49 TYR HB3 2 105 PHE QD 3.400 . 7.000 2.959 2.261 3.654 . 0 0 "[ . 1 . 2]" 1
641 2 49 TYR HB2 2 102 LEU MD2 2.900 . 4.800 3.205 3.118 3.292 . 0 0 "[ . 1 . 2]" 1
642 2 49 TYR HB2 2 105 PHE QD 3.400 . 7.000 2.608 1.451 3.220 0.349 15 0 "[ . 1 . 2]" 1
643 2 33 ILE HB 2 49 TYR QD 3.400 . 7.000 4.165 3.659 4.435 . 0 0 "[ . 1 . 2]" 1
644 2 49 TYR QD 2 52 ILE MD 2.900 . 6.800 3.596 3.391 3.855 . 0 0 "[ . 1 . 2]" 1
645 2 49 TYR QD 2 101 LEU HB3 2.900 . 5.300 2.769 2.513 2.875 . 0 0 "[ . 1 . 2]" 1
646 2 49 TYR QD 2 101 LEU HB2 3.400 . 7.000 4.266 4.096 4.374 . 0 0 "[ . 1 . 2]" 1
647 2 49 TYR QD 2 101 LEU MD1 3.900 . 9.500 3.562 3.308 4.061 . 0 0 "[ . 1 . 2]" 1
648 2 49 TYR QD 2 105 PHE QE 2.900 . 7.300 2.553 1.600 3.159 0.200 5 0 "[ . 1 . 2]" 1
649 2 31 GLU HA 2 49 TYR QE 2.900 . 5.300 3.508 2.984 4.022 . 0 0 "[ . 1 . 2]" 1
650 2 33 ILE MD 2 49 TYR QE 2.900 . 6.800 3.795 3.559 4.256 . 0 0 "[ . 1 . 2]" 1
651 2 49 TYR QE 2 52 ILE QG 2.900 . 6.300 4.125 3.823 4.372 . 0 0 "[ . 1 . 2]" 1
652 2 49 TYR QE 2 98 LEU HA 3.900 . 8.000 4.388 4.170 4.586 . 0 0 "[ . 1 . 2]" 1
653 2 49 TYR QE 2 101 LEU HB3 2.900 . 5.300 3.002 2.259 3.298 . 0 0 "[ . 1 . 2]" 1
654 2 49 TYR QE 2 101 LEU HB2 2.900 . 5.300 3.964 3.607 4.118 . 0 0 "[ . 1 . 2]" 1
655 2 49 TYR QE 2 101 LEU MD1 2.900 . 6.800 1.943 1.683 2.212 0.117 12 0 "[ . 1 . 2]" 1
656 2 49 TYR QE 2 101 LEU HG 3.900 . 8.000 4.407 4.186 4.554 . 0 0 "[ . 1 . 2]" 1
657 2 49 TYR QE 2 105 PHE QE 3.400 . 9.000 3.747 3.210 4.205 . 0 0 "[ . 1 . 2]" 1
658 2 50 ALA HA 2 72 HIS HE1 3.900 . 6.000 4.098 3.743 4.424 . 0 0 "[ . 1 . 2]" 1
659 2 50 ALA HA 2 105 PHE HB3 2.900 . 3.300 2.965 2.280 3.359 0.059 10 0 "[ . 1 . 2]" 1
660 2 50 ALA HA 2 105 PHE QD 3.900 . 8.000 4.710 3.526 5.171 . 0 0 "[ . 1 . 2]" 1
661 2 49 TYR QD 2 50 ALA MB 3.900 . 9.500 5.440 5.268 5.532 . 0 0 "[ . 1 . 2]" 1
662 2 50 ALA MB 2 51 ASP HA 3.900 . 7.500 4.039 3.938 4.166 . 0 0 "[ . 1 . 2]" 1
663 2 50 ALA MB 2 72 HIS HE1 3.400 . 6.500 4.772 4.625 5.010 . 0 0 "[ . 1 . 2]" 1
664 2 50 ALA MB 2 105 PHE HA 3.400 . 6.500 4.166 3.634 5.171 . 0 0 "[ . 1 . 2]" 1
665 2 50 ALA MB 2 105 PHE HB3 2.900 . 4.800 2.467 2.000 3.159 . 0 0 "[ . 1 . 2]" 1
666 2 50 ALA MB 2 105 PHE HB2 2.900 . 4.800 3.673 3.086 3.856 . 0 0 "[ . 1 . 2]" 1
667 2 50 ALA MB 2 105 PHE QD 2.900 . 6.800 3.597 1.972 4.353 . 0 0 "[ . 1 . 2]" 1
668 2 51 ASP HA 2 71 LEU MD1 3.900 . 7.500 5.440 5.155 5.712 . 0 0 "[ . 1 . 2]" 1
669 2 51 ASP HA 2 71 LEU MD2 3.900 . 7.500 4.940 4.578 5.236 . 0 0 "[ . 1 . 2]" 1
670 2 51 ASP HA 2 72 HIS HD2 2.900 . 3.300 3.374 3.349 3.402 0.102 7 0 "[ . 1 . 2]" 1
671 2 51 ASP HA 2 72 HIS HE1 3.400 . 5.000 3.080 3.015 3.201 . 0 0 "[ . 1 . 2]" 1
672 2 51 ASP HB3 2 71 LEU MD1 3.400 . 6.500 4.000 3.572 4.410 . 0 0 "[ . 1 . 2]" 1
673 2 51 ASP HB3 2 71 LEU MD2 3.900 . 7.500 4.266 3.542 4.647 . 0 0 "[ . 1 . 2]" 1
674 2 51 ASP HB3 2 72 HIS HE1 3.400 . 5.000 5.138 5.091 5.197 0.197 12 0 "[ . 1 . 2]" 1
675 2 51 ASP HB2 2 72 HIS HE1 3.400 . 5.000 5.240 5.196 5.271 0.271 13 0 "[ . 1 . 2]" 1
676 2 52 ILE HA 2 71 LEU HA 2.400 . 2.700 2.256 1.910 2.441 . 0 0 "[ . 1 . 2]" 1
677 2 52 ILE HA 2 71 LEU MD2 2.900 . 4.800 2.027 1.845 2.223 . 0 0 "[ . 1 . 2]" 1
678 2 49 TYR HB3 2 52 ILE HB 3.900 . 6.000 4.408 4.254 4.539 . 0 0 "[ . 1 . 2]" 1
679 2 49 TYR QD 2 52 ILE HB 3.900 . 8.000 4.108 3.789 4.372 . 0 0 "[ . 1 . 2]" 1
680 2 52 ILE HB 2 69 LEU MD1 3.900 . 7.500 5.310 4.853 5.568 . 0 0 "[ . 1 . 2]" 1
681 2 52 ILE HB 2 71 LEU HA 3.900 . 6.000 4.969 4.676 5.209 . 0 0 "[ . 1 . 2]" 1
682 2 52 ILE HB 2 71 LEU MD2 3.900 . 7.500 4.046 3.946 4.155 . 0 0 "[ . 1 . 2]" 1
683 2 49 TYR HB3 2 52 ILE MD 3.400 . 6.500 5.396 5.251 5.480 . 0 0 "[ . 1 . 2]" 1
684 2 49 TYR HA 2 52 ILE QG 3.900 . 7.000 1.871 1.798 1.915 0.002 8 0 "[ . 1 . 2]" 1
685 2 52 ILE QG 2 71 LEU HA 3.900 . 7.000 5.111 4.822 5.242 . 0 0 "[ . 1 . 2]" 1
686 2 52 ILE QG 2 71 LEU MD2 3.400 . 7.500 3.375 3.261 3.445 . 0 0 "[ . 1 . 2]" 1
687 2 49 TYR QD 2 52 ILE MG 3.900 . 9.500 4.180 4.032 4.320 . 0 0 "[ . 1 . 2]" 1
688 2 52 ILE MG 2 54 CYS HA 3.400 . 6.500 3.692 3.386 4.060 . 0 0 "[ . 1 . 2]" 1
689 2 52 ILE MG 2 55 GLN HA 3.900 . 7.500 3.902 3.612 4.030 . 0 0 "[ . 1 . 2]" 1
690 2 52 ILE MG 2 69 LEU HA 3.400 . 6.500 2.998 2.889 3.144 . 0 0 "[ . 1 . 2]" 1
691 2 52 ILE MG 2 69 LEU HB3 2.900 . 4.800 2.309 2.116 2.557 . 0 0 "[ . 1 . 2]" 1
692 2 52 ILE MG 2 71 LEU HA 2.900 . 4.800 3.326 2.993 3.592 . 0 0 "[ . 1 . 2]" 1
693 2 52 ILE MG 2 71 LEU MD2 2.900 . 6.300 1.989 1.832 2.253 . 0 0 "[ . 1 . 2]" 1
694 2 53 LYS HA 2 72 HIS HD2 3.900 . 6.000 5.947 5.849 6.019 0.019 9 0 "[ . 1 . 2]" 1
695 2 53 LYS HA 2 72 HIS HE1 2.900 . 3.300 3.267 2.977 3.403 0.103 6 0 "[ . 1 . 2]" 1
696 2 52 ILE HA 2 53 LYS HB3 3.900 . 6.000 4.669 4.515 4.878 . 0 0 "[ . 1 . 2]" 1
697 2 53 LYS HB3 2 70 VAL HB 3.900 . 6.000 3.558 3.253 3.889 . 0 0 "[ . 1 . 2]" 1
698 2 53 LYS HB3 2 72 HIS HA 3.400 . 5.000 3.718 3.475 4.139 . 0 0 "[ . 1 . 2]" 1
699 2 53 LYS HB3 2 72 HIS HE1 3.900 . 6.000 5.599 5.362 5.853 . 0 0 "[ . 1 . 2]" 1
700 2 53 LYS HB2 2 70 VAL HB 3.900 . 6.000 5.256 4.892 5.593 . 0 0 "[ . 1 . 2]" 1
701 2 53 LYS HB2 2 72 HIS HA 2.900 . 3.300 2.769 2.692 2.864 . 0 0 "[ . 1 . 2]" 1
702 2 53 LYS HB2 2 72 HIS HE1 3.900 . 6.000 4.375 4.164 4.660 . 0 0 "[ . 1 . 2]" 1
703 2 53 LYS QD 2 72 HIS HA 2.900 . 4.300 3.138 2.490 3.874 . 0 0 "[ . 1 . 2]" 1
704 2 53 LYS QD 2 72 HIS HE1 3.900 . 7.000 6.337 5.834 6.450 . 0 0 "[ . 1 . 2]" 1
705 2 53 LYS QG 2 54 CYS HB2 3.400 . 6.000 4.826 4.312 5.221 . 0 0 "[ . 1 . 2]" 1
706 2 53 LYS QG 2 72 HIS HA 3.400 . 6.000 3.784 3.116 4.295 . 0 0 "[ . 1 . 2]" 1
707 2 53 LYS QG 2 72 HIS HE1 3.900 . 7.000 4.967 4.637 5.339 . 0 0 "[ . 1 . 2]" 1
708 2 54 CYS HA 2 55 GLN HA 3.400 . 5.000 4.491 4.439 4.525 . 0 0 "[ . 1 . 2]" 1
709 2 54 CYS HA 2 55 GLN QG 3.900 . 7.000 4.077 3.192 5.305 . 0 0 "[ . 1 . 2]" 1
710 2 54 CYS HA 2 102 LEU MD1 2.900 . 4.800 2.851 2.297 3.257 . 0 0 "[ . 1 . 2]" 1
711 2 54 CYS HA 2 102 LEU MD2 3.900 . 7.500 4.879 4.487 5.229 . 0 0 "[ . 1 . 2]" 1
712 2 53 LYS QG 2 54 CYS HB3 3.900 . 7.000 3.385 2.916 3.752 . 0 0 "[ . 1 . 2]" 1
713 2 54 CYS HB3 2 102 LEU MD1 3.900 . 7.500 4.846 4.230 5.232 . 0 0 "[ . 1 . 2]" 1
714 2 54 CYS HB2 2 102 LEU MD1 3.400 . 6.500 4.745 4.256 5.160 . 0 0 "[ . 1 . 2]" 1
715 2 55 GLN HA 2 69 LEU HA 2.900 . 3.300 2.756 2.672 2.817 . 0 0 "[ . 1 . 2]" 1
716 2 55 GLN HA 2 69 LEU HB3 3.400 . 5.000 5.086 5.039 5.123 0.123 13 0 "[ . 1 . 2]" 1
717 2 55 GLN HA 2 69 LEU MD2 2.900 . 4.800 3.622 3.319 3.764 . 0 0 "[ . 1 . 2]" 1
718 2 55 GLN HA 2 70 VAL MG2 3.900 . 7.500 2.523 2.300 2.825 . 0 0 "[ . 1 . 2]" 1
719 2 55 GLN HA 2 102 LEU MD1 2.900 . 4.800 4.230 4.165 4.293 . 0 0 "[ . 1 . 2]" 1
720 2 55 GLN HB3 2 69 LEU HA 3.900 . 6.000 3.362 2.812 3.840 . 0 0 "[ . 1 . 2]" 1
721 2 55 GLN HB3 2 69 LEU MD2 2.900 . 4.800 2.827 2.381 3.270 . 0 0 "[ . 1 . 2]" 1
722 2 55 GLN HB3 2 102 LEU MD1 2.900 . 4.800 2.675 2.484 2.903 . 0 0 "[ . 1 . 2]" 1
723 2 55 GLN HB2 2 69 LEU HA 3.900 . 6.000 3.557 3.174 4.027 . 0 0 "[ . 1 . 2]" 1
724 2 55 GLN QG 2 69 LEU HA 3.900 . 7.000 4.955 4.572 5.239 . 0 0 "[ . 1 . 2]" 1
725 2 55 GLN QG 2 69 LEU MD2 3.400 . 7.500 4.130 3.595 4.662 . 0 0 "[ . 1 . 2]" 1
726 2 55 GLN QG 2 102 LEU MD1 2.900 . 5.800 2.980 1.980 4.243 . 0 0 "[ . 1 . 2]" 1
727 2 56 LYS HB3 2 70 VAL MG2 3.900 . 7.500 4.462 4.320 4.631 . 0 0 "[ . 1 . 2]" 1
728 2 56 LYS HB2 2 57 ILE HA 3.900 . 6.000 4.521 4.294 4.672 . 0 0 "[ . 1 . 2]" 1
729 2 56 LYS HB2 2 70 VAL MG2 3.900 . 7.500 3.474 3.326 3.644 . 0 0 "[ . 1 . 2]" 1
730 2 56 LYS QD 2 70 VAL MG2 2.900 . 5.800 3.525 3.249 3.805 . 0 0 "[ . 1 . 2]" 1
731 2 56 LYS QE 2 70 VAL MG2 2.900 . 5.800 3.561 2.823 3.838 . 0 0 "[ . 1 . 2]" 1
732 2 55 GLN HA 2 56 LYS QG 3.900 . 7.000 4.090 3.926 4.258 . 0 0 "[ . 1 . 2]" 1
733 2 56 LYS QG 2 70 VAL MG2 2.900 . 5.800 2.106 1.938 2.254 . 0 0 "[ . 1 . 2]" 1
734 2 57 ILE HA 2 58 SER HA 3.900 . 6.000 4.333 4.317 4.341 . 0 0 "[ . 1 . 2]" 1
735 2 57 ILE HA 2 58 SER HB3 3.900 . 6.000 4.281 4.247 4.301 . 0 0 "[ . 1 . 2]" 1
736 2 57 ILE HA 2 58 SER HB2 3.900 . 6.000 5.585 5.559 5.604 . 0 0 "[ . 1 . 2]" 1
737 2 57 ILE HA 2 67 LEU HA 2.900 . 3.300 2.044 1.982 2.133 . 0 0 "[ . 1 . 2]" 1
738 2 57 ILE HA 2 67 LEU HB2 3.900 . 6.000 4.047 3.943 4.141 . 0 0 "[ . 1 . 2]" 1
739 2 57 ILE HA 2 67 LEU MD1 3.400 . 6.500 2.387 2.249 2.497 . 0 0 "[ . 1 . 2]" 1
740 2 57 ILE HA 2 67 LEU HG 3.400 . 5.000 3.429 3.236 3.619 . 0 0 "[ . 1 . 2]" 1
741 2 57 ILE HA 2 91 ARG QD 3.900 . 7.000 3.297 2.929 3.552 . 0 0 "[ . 1 . 2]" 1
742 2 57 ILE HB 2 91 ARG QD 3.900 . 7.000 1.914 1.613 2.092 0.187 4 0 "[ . 1 . 2]" 1
743 2 57 ILE MD 2 59 PRO HA 3.900 . 7.500 3.661 3.428 3.965 . 0 0 "[ . 1 . 2]" 1
744 2 57 ILE MD 2 59 PRO QD 3.900 . 8.500 4.318 4.122 4.582 . 0 0 "[ . 1 . 2]" 1
745 2 57 ILE MD 2 67 LEU HA 3.900 . 7.500 5.354 5.194 5.555 . 0 0 "[ . 1 . 2]" 1
746 2 57 ILE MD 2 91 ARG HB3 2.900 . 4.800 3.965 3.909 4.013 . 0 0 "[ . 1 . 2]" 1
747 2 57 ILE MD 2 91 ARG QD 3.400 . 7.500 1.868 1.696 2.077 0.104 9 0 "[ . 1 . 2]" 1
748 2 57 ILE MD 2 95 LYS HA 3.900 . 7.500 5.613 5.406 5.817 . 0 0 "[ . 1 . 2]" 1
749 2 57 ILE MD 2 95 LYS QD 2.900 . 5.800 2.992 1.762 4.067 0.038 13 0 "[ . 1 . 2]" 1
750 2 57 ILE MD 2 95 LYS QE 2.900 . 5.800 3.168 2.220 4.214 . 0 0 "[ . 1 . 2]" 1
751 2 57 ILE QG 2 91 ARG QD 3.900 . 8.000 2.913 2.754 3.115 . 0 0 "[ . 1 . 2]" 1
752 2 56 LYS HA 2 57 ILE MG 3.400 . 6.500 3.246 3.170 3.384 . 0 0 "[ . 1 . 2]" 1
753 2 57 ILE MG 2 67 LEU HA 2.900 . 4.800 3.635 3.575 3.723 . 0 0 "[ . 1 . 2]" 1
754 2 57 ILE MG 2 67 LEU HG 2.900 . 4.800 3.011 2.744 3.248 . 0 0 "[ . 1 . 2]" 1
755 2 57 ILE MG 2 91 ARG QD 2.900 . 5.800 3.516 3.040 3.686 . 0 0 "[ . 1 . 2]" 1
756 2 57 ILE MG 2 95 LYS HA 3.400 . 6.500 3.525 3.359 3.792 . 0 0 "[ . 1 . 2]" 1
757 2 58 SER HA 2 59 PRO QD 2.900 . 4.300 1.782 1.735 1.804 0.065 13 0 "[ . 1 . 2]" 1
758 2 58 SER HA 2 59 PRO QG 2.900 . 4.300 3.676 3.636 3.698 . 0 0 "[ . 1 . 2]" 1
759 2 58 SER HB3 2 59 PRO QD 3.400 . 6.000 3.874 3.798 3.933 . 0 0 "[ . 1 . 2]" 1
760 2 58 SER HB3 2 62 LYS QG 3.900 . 7.000 5.829 5.472 6.084 . 0 0 "[ . 1 . 2]" 1
761 2 58 SER HB3 2 66 GLN HA 3.900 . 6.000 4.653 4.552 4.775 . 0 0 "[ . 1 . 2]" 1
762 2 58 SER HB3 2 66 GLN HB3 3.900 . 6.000 3.537 3.177 3.729 . 0 0 "[ . 1 . 2]" 1
763 2 58 SER HB3 2 66 GLN HB2 2.900 . 3.300 1.942 1.809 2.111 . 0 0 "[ . 1 . 2]" 1
764 2 58 SER HB3 2 66 GLN QG 3.900 . 7.000 3.817 3.659 4.004 . 0 0 "[ . 1 . 2]" 1
765 2 58 SER HB2 2 59 PRO QD 2.900 . 4.300 2.831 2.694 2.961 . 0 0 "[ . 1 . 2]" 1
766 2 58 SER HB2 2 62 LYS QG 3.900 . 7.000 4.415 3.988 4.725 . 0 0 "[ . 1 . 2]" 1
767 2 58 SER HB2 2 66 GLN HB3 3.900 . 6.000 4.941 4.664 5.068 . 0 0 "[ . 1 . 2]" 1
768 2 58 SER HB2 2 66 GLN HB2 2.900 . 3.300 3.233 3.045 3.338 0.038 5 0 "[ . 1 . 2]" 1
769 2 58 SER HB2 2 66 GLN QG 3.900 . 7.000 4.282 4.064 4.527 . 0 0 "[ . 1 . 2]" 1
770 2 59 PRO HA 2 88 VAL MG1 3.900 . 7.500 5.955 5.168 6.091 . 0 0 "[ . 1 . 2]" 1
771 2 59 PRO QD 2 62 LYS QG 3.400 . 7.000 4.868 4.480 5.116 . 0 0 "[ . 1 . 2]" 1
772 2 59 PRO QG 2 62 LYS QG 3.400 . 7.000 4.705 4.343 4.925 . 0 0 "[ . 1 . 2]" 1
773 2 59 PRO HA 2 60 GLU HA 3.400 . 5.000 4.291 4.277 4.304 . 0 0 "[ . 1 . 2]" 1
774 2 59 PRO HA 2 60 GLU QB 3.900 . 7.000 4.573 4.474 4.895 . 0 0 "[ . 1 . 2]" 1
775 2 60 GLU QB 2 61 GLY QA 3.900 . 8.000 3.581 3.567 3.606 . 0 0 "[ . 1 . 2]" 1
776 2 60 GLU QG 2 61 GLY QA 3.900 . 8.000 5.102 5.015 5.270 . 0 0 "[ . 1 . 2]" 1
777 2 62 LYS HA 2 63 ALA HA 3.400 . 5.000 4.306 4.290 4.333 . 0 0 "[ . 1 . 2]" 1
778 2 63 ALA HA 2 65 ILE MD 3.400 . 6.500 5.357 5.321 5.415 . 0 0 "[ . 1 . 2]" 1
779 2 62 LYS HA 2 63 ALA MB 2.900 . 4.800 4.048 4.024 4.094 . 0 0 "[ . 1 . 2]" 1
780 2 63 ALA MB 2 64 LYS HA 2.900 . 4.800 4.162 4.121 4.216 . 0 0 "[ . 1 . 2]" 1
781 2 64 LYS HA 2 80 HIS HD2 3.900 . 6.000 4.732 3.616 5.477 . 0 0 "[ . 1 . 2]" 1
782 2 64 LYS QB 2 80 HIS HD2 3.900 . 7.000 2.890 2.265 3.516 . 0 0 "[ . 1 . 2]" 1
783 2 64 LYS QG 2 80 HIS HD2 3.900 . 7.000 4.294 2.922 5.322 . 0 0 "[ . 1 . 2]" 1
784 2 64 LYS HA 2 65 ILE HA 3.900 . 6.000 4.384 4.354 4.415 . 0 0 "[ . 1 . 2]" 1
785 2 65 ILE HB 2 81 PHE QD 3.900 . 8.000 4.402 4.060 4.617 . 0 0 "[ . 1 . 2]" 1
786 2 65 ILE HB 2 87 ALA MB 2.900 . 4.800 2.453 2.143 2.800 . 0 0 "[ . 1 . 2]" 1
787 2 64 LYS HA 2 65 ILE MD 3.400 . 6.500 3.161 2.844 3.524 . 0 0 "[ . 1 . 2]" 1
788 2 65 ILE MD 2 81 PHE QD 3.900 . 9.500 5.425 5.158 5.621 . 0 0 "[ . 1 . 2]" 1
789 2 65 ILE MD 2 87 ALA MB 2.900 . 6.300 2.257 1.925 2.629 . 0 0 "[ . 1 . 2]" 1
790 2 65 ILE MD 2 88 VAL HA 2.900 . 4.800 3.610 3.233 3.761 . 0 0 "[ . 1 . 2]" 1
791 2 65 ILE MD 2 88 VAL MG2 2.400 . 5.700 2.055 1.978 2.118 . 0 0 "[ . 1 . 2]" 1
792 2 65 ILE QG 2 88 VAL MG2 3.400 . 7.500 1.784 1.686 2.080 0.114 4 0 "[ . 1 . 2]" 1
793 2 57 ILE HA 2 65 ILE MG 3.900 . 7.500 5.302 5.106 5.501 . 0 0 "[ . 1 . 2]" 1
794 2 65 ILE MG 2 66 GLN HA 3.900 . 7.500 3.446 3.351 3.548 . 0 0 "[ . 1 . 2]" 1
795 2 65 ILE MG 2 80 HIS HA 3.900 . 7.500 5.399 5.059 5.743 . 0 0 "[ . 1 . 2]" 1
796 2 65 ILE MG 2 81 PHE HA 3.900 . 7.500 5.007 4.729 5.591 . 0 0 "[ . 1 . 2]" 1
797 2 65 ILE MG 2 81 PHE HB3 3.400 . 6.500 3.343 2.917 4.018 . 0 0 "[ . 1 . 2]" 1
798 2 65 ILE MG 2 81 PHE HB2 3.400 . 6.500 2.397 2.101 3.013 . 0 0 "[ . 1 . 2]" 1
799 2 65 ILE MG 2 81 PHE QD 2.900 . 6.800 3.121 2.881 3.447 . 0 0 "[ . 1 . 2]" 1
800 2 65 ILE MG 2 81 PHE QE 3.400 . 8.500 4.382 4.175 4.611 . 0 0 "[ . 1 . 2]" 1
801 2 65 ILE MG 2 81 PHE HZ 3.900 . 7.500 5.602 5.409 5.764 . 0 0 "[ . 1 . 2]" 1
802 2 65 ILE MG 2 87 ALA HA 3.900 . 7.500 4.290 4.070 4.619 . 0 0 "[ . 1 . 2]" 1
803 2 65 ILE MG 2 87 ALA MB 2.900 . 6.300 3.078 2.911 3.395 . 0 0 "[ . 1 . 2]" 1
804 2 65 ILE MG 2 88 VAL HA 2.900 . 4.800 1.980 1.823 2.199 . 0 0 "[ . 1 . 2]" 1
805 2 65 ILE MG 2 88 VAL MG2 2.900 . 6.300 2.859 2.683 3.043 . 0 0 "[ . 1 . 2]" 1
806 2 65 ILE MG 2 91 ARG HB3 3.400 . 6.500 2.692 2.589 2.795 . 0 0 "[ . 1 . 2]" 1
807 2 65 ILE MG 2 91 ARG QD 3.400 . 7.500 1.845 1.622 3.103 0.178 17 0 "[ . 1 . 2]" 1
808 2 65 ILE HA 2 66 GLN HA 3.900 . 6.000 4.425 4.405 4.454 . 0 0 "[ . 1 . 2]" 1
809 2 66 GLN HA 2 67 LEU HA 3.900 . 6.000 4.451 4.430 4.463 . 0 0 "[ . 1 . 2]" 1
810 2 66 GLN HA 2 80 HIS HA 2.900 . 3.300 2.808 2.393 3.152 . 0 0 "[ . 1 . 2]" 1
811 2 66 GLN HA 2 81 PHE QD 2.900 . 5.300 2.370 2.050 2.582 . 0 0 "[ . 1 . 2]" 1
812 2 66 GLN HB3 2 67 LEU HA 3.900 . 6.000 4.276 4.025 4.448 . 0 0 "[ . 1 . 2]" 1
813 2 66 GLN HB3 2 67 LEU HB2 3.900 . 6.000 5.062 4.970 5.169 . 0 0 "[ . 1 . 2]" 1
814 2 66 GLN HB3 2 80 HIS HA 3.900 . 6.000 3.281 2.787 3.667 . 0 0 "[ . 1 . 2]" 1
815 2 66 GLN HB2 2 80 HIS HA 3.900 . 6.000 4.571 4.248 5.041 . 0 0 "[ . 1 . 2]" 1
816 2 64 LYS QB 2 66 GLN QG 2.900 . 5.300 3.132 2.561 3.710 . 0 0 "[ . 1 . 2]" 1
817 2 64 LYS QG 2 66 GLN QG 2.900 . 5.300 2.834 1.772 4.300 0.028 1 0 "[ . 1 . 2]" 1
818 2 66 GLN QG 2 80 HIS HA 2.900 . 4.300 2.259 1.765 2.871 0.035 1 0 "[ . 1 . 2]" 1
819 2 66 GLN QG 2 80 HIS HB2 3.400 . 6.000 3.397 2.464 4.586 . 0 0 "[ . 1 . 2]" 1
820 2 66 GLN QG 2 80 HIS HD2 3.400 . 6.000 4.073 2.651 5.021 . 0 0 "[ . 1 . 2]" 1
821 2 58 SER HB2 2 67 LEU HA 3.900 . 6.000 6.172 6.123 6.233 0.233 1 0 "[ . 1 . 2]" 1
822 2 67 LEU HA 2 81 PHE QE 3.900 . 8.000 4.237 4.011 4.440 . 0 0 "[ . 1 . 2]" 1
823 2 67 LEU HA 2 91 ARG QD 3.900 . 7.000 4.278 3.936 4.443 . 0 0 "[ . 1 . 2]" 1
824 2 67 LEU HB3 2 79 PHE HA 3.900 . 6.000 5.273 5.006 5.383 . 0 0 "[ . 1 . 2]" 1
825 2 67 LEU HB3 2 79 PHE HB2 3.400 . 5.000 2.378 2.056 2.570 . 0 0 "[ . 1 . 2]" 1
826 2 67 LEU HB3 2 79 PHE QD 3.900 . 8.000 3.370 2.970 3.778 . 0 0 "[ . 1 . 2]" 1
827 2 67 LEU HB3 2 81 PHE QD 3.900 . 8.000 3.986 3.541 4.577 . 0 0 "[ . 1 . 2]" 1
828 2 67 LEU HB3 2 81 PHE QE 2.900 . 5.300 2.319 2.026 2.742 . 0 0 "[ . 1 . 2]" 1
829 2 67 LEU HB3 2 81 PHE HZ 3.900 . 6.000 4.211 3.975 4.379 . 0 0 "[ . 1 . 2]" 1
830 2 67 LEU HB3 2 91 ARG QD 3.900 . 7.000 5.790 5.469 5.938 . 0 0 "[ . 1 . 2]" 1
831 2 67 LEU HB3 2 91 ARG QG 3.900 . 7.000 4.217 4.044 4.358 . 0 0 "[ . 1 . 2]" 1
832 2 67 LEU HB2 2 79 PHE HB2 3.400 . 5.000 3.712 3.388 3.979 . 0 0 "[ . 1 . 2]" 1
833 2 67 LEU HB2 2 79 PHE QD 3.900 . 8.000 4.996 4.613 5.377 . 0 0 "[ . 1 . 2]" 1
834 2 67 LEU HB2 2 81 PHE QD 3.900 . 8.000 3.087 2.769 3.463 . 0 0 "[ . 1 . 2]" 1
835 2 67 LEU HB2 2 81 PHE QE 2.900 . 5.300 1.677 1.432 2.055 0.368 4 0 "[ . 1 . 2]" 1
836 2 67 LEU HB2 2 81 PHE HZ 3.900 . 6.000 3.761 3.569 3.945 . 0 0 "[ . 1 . 2]" 1
837 2 67 LEU HB2 2 91 ARG QD 3.900 . 7.000 4.350 4.091 4.485 . 0 0 "[ . 1 . 2]" 1
838 2 67 LEU HB2 2 91 ARG QG 3.400 . 6.000 2.641 2.512 2.770 . 0 0 "[ . 1 . 2]" 1
839 2 55 GLN HA 2 67 LEU MD1 3.900 . 7.500 5.867 5.455 6.197 . 0 0 "[ . 1 . 2]" 1
840 2 56 LYS HA 2 67 LEU MD1 3.900 . 7.500 5.117 4.857 5.344 . 0 0 "[ . 1 . 2]" 1
841 2 67 LEU MD1 2 81 PHE QD 3.900 . 9.500 4.326 4.078 4.540 . 0 0 "[ . 1 . 2]" 1
842 2 67 LEU MD1 2 81 PHE QE 2.900 . 6.800 2.999 2.680 3.372 . 0 0 "[ . 1 . 2]" 1
843 2 67 LEU MD1 2 81 PHE HZ 2.900 . 4.800 3.718 3.691 3.790 . 0 0 "[ . 1 . 2]" 1
844 2 67 LEU MD1 2 91 ARG HB2 2.900 . 4.800 3.885 3.840 3.959 . 0 0 "[ . 1 . 2]" 1
845 2 67 LEU MD1 2 91 ARG QD 3.400 . 7.500 3.077 2.453 3.293 . 0 0 "[ . 1 . 2]" 1
846 2 67 LEU MD1 2 92 ASP HA 3.400 . 6.500 4.178 4.041 4.307 . 0 0 "[ . 1 . 2]" 1
847 2 67 LEU MD1 2 94 VAL HB 2.900 . 4.800 2.851 2.715 2.996 . 0 0 "[ . 1 . 2]" 1
848 2 67 LEU MD1 2 95 LYS HA 2.900 . 4.800 2.799 2.618 2.928 . 0 0 "[ . 1 . 2]" 1
849 2 67 LEU MD1 2 98 LEU MD1 2.400 . 5.700 3.690 3.543 3.818 . 0 0 "[ . 1 . 2]" 1
850 2 55 GLN HA 2 67 LEU MD2 3.900 . 7.500 5.126 4.833 5.286 . 0 0 "[ . 1 . 2]" 1
851 2 57 ILE HA 2 67 LEU MD2 3.400 . 6.500 4.735 4.641 4.816 . 0 0 "[ . 1 . 2]" 1
852 2 67 LEU MD2 2 68 GLN HA 3.900 . 7.500 4.288 4.182 4.389 . 0 0 "[ . 1 . 2]" 1
853 2 67 LEU MD2 2 79 PHE QD 2.900 . 6.800 3.238 2.677 3.598 . 0 0 "[ . 1 . 2]" 1
854 2 67 LEU MD2 2 81 PHE QD 3.900 . 9.500 4.773 4.481 5.129 . 0 0 "[ . 1 . 2]" 1
855 2 67 LEU MD2 2 81 PHE QE 2.900 . 6.800 2.820 2.503 3.174 . 0 0 "[ . 1 . 2]" 1
856 2 67 LEU MD2 2 81 PHE HZ 2.900 . 4.800 3.055 2.933 3.244 . 0 0 "[ . 1 . 2]" 1
857 2 67 LEU MD2 2 94 VAL HB 2.900 . 4.800 2.210 2.061 2.325 . 0 0 "[ . 1 . 2]" 1
858 2 67 LEU MD2 2 95 LYS HA 3.400 . 6.500 3.071 2.710 3.401 . 0 0 "[ . 1 . 2]" 1
859 2 67 LEU HG 2 81 PHE QE 3.900 . 8.000 4.279 4.106 4.506 . 0 0 "[ . 1 . 2]" 1
860 2 68 GLN HA 2 76 THR HB 3.900 . 6.000 5.142 4.768 5.478 . 0 0 "[ . 1 . 2]" 1
861 2 68 GLN HA 2 78 ASN HA 2.900 . 3.300 2.073 1.892 2.286 . 0 0 "[ . 1 . 2]" 1
862 2 68 GLN HB3 2 78 ASN HA 3.900 . 6.000 2.926 2.772 3.126 . 0 0 "[ . 1 . 2]" 1
863 2 68 GLN HB2 2 78 ASN HA 3.900 . 6.000 2.364 2.050 2.678 . 0 0 "[ . 1 . 2]" 1
864 2 68 GLN QG 2 70 VAL HA 3.900 . 7.000 3.974 3.818 4.090 . 0 0 "[ . 1 . 2]" 1
865 2 68 GLN QG 2 70 VAL MG2 2.900 . 5.800 2.128 2.020 2.242 . 0 0 "[ . 1 . 2]" 1
866 2 68 GLN QG 2 76 THR HB 2.900 . 4.300 3.413 3.144 3.606 . 0 0 "[ . 1 . 2]" 1
867 2 68 GLN QG 2 76 THR MG 2.900 . 5.800 3.448 3.210 3.621 . 0 0 "[ . 1 . 2]" 1
868 2 68 GLN QG 2 78 ASN HA 3.900 . 7.000 4.274 4.056 4.500 . 0 0 "[ . 1 . 2]" 1
869 2 69 LEU HA 2 70 VAL HB 3.400 . 5.000 4.831 4.714 4.888 . 0 0 "[ . 1 . 2]" 1
870 2 69 LEU HA 2 70 VAL MG2 3.400 . 6.500 3.587 3.513 3.724 . 0 0 "[ . 1 . 2]" 1
871 2 69 LEU HA 2 77 THR HB 3.900 . 6.000 4.599 4.507 4.678 . 0 0 "[ . 1 . 2]" 1
872 2 47 HIS HD2 2 69 LEU HB3 3.900 . 6.000 5.448 5.102 5.936 . 0 0 "[ . 1 . 2]" 1
873 2 69 LEU HB3 2 71 LEU MD2 3.900 . 7.500 2.227 2.065 2.410 . 0 0 "[ . 1 . 2]" 1
874 2 69 LEU HB3 2 77 THR HB 2.900 . 3.300 3.413 3.381 3.447 0.147 13 0 "[ . 1 . 2]" 1
875 2 69 LEU HB3 2 77 THR MG 3.400 . 6.500 4.753 4.677 4.799 . 0 0 "[ . 1 . 2]" 1
876 2 47 HIS HD2 2 69 LEU HB2 3.900 . 6.000 5.046 4.704 5.628 . 0 0 "[ . 1 . 2]" 1
877 2 52 ILE MG 2 69 LEU HB2 3.400 . 6.500 3.820 3.628 4.069 . 0 0 "[ . 1 . 2]" 1
878 2 69 LEU HB2 2 71 LEU MD2 3.900 . 7.500 2.944 2.687 3.316 . 0 0 "[ . 1 . 2]" 1
879 2 69 LEU HB2 2 77 THR HB 2.900 . 3.300 1.774 1.744 1.798 0.056 18 0 "[ . 1 . 2]" 1
880 2 69 LEU HB2 2 77 THR MG 3.400 . 6.500 3.529 3.491 3.577 . 0 0 "[ . 1 . 2]" 1
881 2 69 LEU HB2 2 79 PHE QE 3.900 . 8.000 3.716 3.359 4.026 . 0 0 "[ . 1 . 2]" 1
882 2 47 HIS HB2 2 69 LEU MD1 3.400 . 6.500 2.703 2.512 3.015 . 0 0 "[ . 1 . 2]" 1
883 2 47 HIS HD2 2 69 LEU MD1 2.900 . 4.800 2.679 2.419 3.361 . 0 0 "[ . 1 . 2]" 1
884 2 69 LEU MD1 2 71 LEU MD2 2.900 . 6.300 3.111 2.913 3.343 . 0 0 "[ . 1 . 2]" 1
885 2 69 LEU MD1 2 77 THR HA 3.900 . 7.500 4.948 4.591 5.291 . 0 0 "[ . 1 . 2]" 1
886 2 69 LEU MD1 2 77 THR HB 2.900 . 4.800 2.285 1.917 2.628 . 0 0 "[ . 1 . 2]" 1
887 2 69 LEU MD1 2 77 THR MG 2.900 . 6.300 2.766 2.468 3.067 . 0 0 "[ . 1 . 2]" 1
888 2 69 LEU MD1 2 79 PHE QE 2.900 . 6.800 1.962 1.847 2.064 . 0 0 "[ . 1 . 2]" 1
889 2 69 LEU MD1 2 98 LEU MD2 2.900 . 6.300 3.765 3.377 4.141 . 0 0 "[ . 1 . 2]" 1
890 2 55 GLN HB2 2 69 LEU MD2 3.900 . 7.500 3.089 2.694 3.460 . 0 0 "[ . 1 . 2]" 1
891 2 69 LEU MD2 2 77 THR HB 3.900 . 7.500 4.257 4.030 4.465 . 0 0 "[ . 1 . 2]" 1
892 2 69 LEU MD2 2 79 PHE QD 3.900 . 9.500 3.947 3.770 4.073 . 0 0 "[ . 1 . 2]" 1
893 2 69 LEU MD2 2 79 PHE QE 3.900 . 9.500 3.483 3.244 3.702 . 0 0 "[ . 1 . 2]" 1
894 2 69 LEU HG 2 77 THR HB 3.400 . 5.000 3.037 2.731 3.385 . 0 0 "[ . 1 . 2]" 1
895 2 69 LEU HG 2 77 THR MG 3.400 . 6.500 4.026 3.783 4.296 . 0 0 "[ . 1 . 2]" 1
896 2 69 LEU HG 2 79 PHE QD 3.400 . 7.000 2.829 2.607 3.062 . 0 0 "[ . 1 . 2]" 1
897 2 69 LEU HG 2 79 PHE QE 3.400 . 7.000 2.299 2.078 2.543 . 0 0 "[ . 1 . 2]" 1
898 2 70 VAL HA 2 71 LEU MD2 3.400 . 6.500 3.716 3.465 3.866 . 0 0 "[ . 1 . 2]" 1
899 2 70 VAL HA 2 76 THR HA 2.900 . 3.300 2.402 2.350 2.427 . 0 0 "[ . 1 . 2]" 1
900 2 70 VAL HA 2 76 THR HB 3.400 . 5.000 3.587 3.322 3.667 . 0 0 "[ . 1 . 2]" 1
901 2 70 VAL HA 2 76 THR MG 2.900 . 4.800 1.740 1.583 1.834 0.217 20 0 "[ . 1 . 2]" 1
902 2 53 LYS QE 2 70 VAL HB 3.900 . 7.000 4.672 3.036 5.537 . 0 0 "[ . 1 . 2]" 1
903 2 70 VAL HB 2 76 THR HA 3.900 . 6.000 5.406 5.346 5.442 . 0 0 "[ . 1 . 2]" 1
904 2 70 VAL HB 2 76 THR MG 3.400 . 6.500 3.784 3.663 3.881 . 0 0 "[ . 1 . 2]" 1
905 2 53 LYS HB3 2 70 VAL MG1 2.900 . 4.800 3.194 2.837 3.448 . 0 0 "[ . 1 . 2]" 1
906 2 53 LYS QE 2 70 VAL MG1 2.900 . 5.800 3.863 2.606 4.332 . 0 0 "[ . 1 . 2]" 1
907 2 55 GLN HA 2 70 VAL MG1 3.900 . 7.500 4.999 4.846 5.126 . 0 0 "[ . 1 . 2]" 1
908 2 69 LEU HA 2 70 VAL MG1 3.900 . 7.500 5.481 5.454 5.503 . 0 0 "[ . 1 . 2]" 1
909 2 70 VAL MG1 2 71 LEU HA 3.900 . 7.500 4.237 3.964 4.408 . 0 0 "[ . 1 . 2]" 1
910 2 70 VAL MG1 2 74 GLY QA 3.900 . 8.500 4.923 4.738 5.147 . 0 0 "[ . 1 . 2]" 1
911 2 70 VAL MG1 2 76 THR HA 2.900 . 4.800 3.874 3.831 3.954 . 0 0 "[ . 1 . 2]" 1
912 2 70 VAL MG1 2 76 THR MG 2.900 . 6.300 1.884 1.788 2.062 0.012 13 0 "[ . 1 . 2]" 1
913 2 70 VAL MG2 2 76 THR HA 2.900 . 4.800 3.906 3.851 3.943 . 0 0 "[ . 1 . 2]" 1
914 2 70 VAL MG2 2 76 THR HB 2.900 . 4.800 3.367 3.175 3.489 . 0 0 "[ . 1 . 2]" 1
915 2 70 VAL MG2 2 76 THR MG 2.900 . 6.300 2.120 1.928 2.277 . 0 0 "[ . 1 . 2]" 1
916 2 71 LEU HA 2 72 HIS HA 3.400 . 5.000 4.317 4.303 4.331 . 0 0 "[ . 1 . 2]" 1
917 2 52 ILE HA 2 71 LEU HB3 3.900 . 6.000 3.152 2.964 3.444 . 0 0 "[ . 1 . 2]" 1
918 2 71 LEU HB3 2 75 ASP QB 3.900 . 7.000 4.740 4.000 6.022 . 0 0 "[ . 1 . 2]" 1
919 2 52 ILE HA 2 71 LEU HB2 3.900 . 6.000 4.545 4.340 4.770 . 0 0 "[ . 1 . 2]" 1
920 2 71 LEU HB2 2 75 ASP QB 3.900 . 7.000 3.420 2.731 4.647 . 0 0 "[ . 1 . 2]" 1
921 2 47 HIS HD2 2 71 LEU MD1 3.900 . 7.500 5.292 4.669 5.675 . 0 0 "[ . 1 . 2]" 1
922 2 51 ASP HB2 2 71 LEU MD1 3.900 . 7.500 3.716 3.288 4.765 . 0 0 "[ . 1 . 2]" 1
923 2 52 ILE HA 2 71 LEU MD1 2.900 . 4.800 4.141 4.064 4.181 . 0 0 "[ . 1 . 2]" 1
924 2 71 LEU MD1 2 75 ASP QB 2.900 . 5.800 2.372 1.779 3.812 0.021 4 0 "[ . 1 . 2]" 1
925 2 71 LEU MD1 2 76 THR HA 2.900 . 4.800 4.034 3.999 4.085 . 0 0 "[ . 1 . 2]" 1
926 2 47 HIS HD2 2 71 LEU MD2 3.400 . 6.500 5.048 4.411 5.292 . 0 0 "[ . 1 . 2]" 1
927 2 51 ASP HB2 2 71 LEU MD2 3.400 . 6.500 3.415 3.003 4.276 . 0 0 "[ . 1 . 2]" 1
928 2 52 ILE MD 2 71 LEU MD2 2.900 . 6.300 1.714 1.548 1.779 0.252 6 0 "[ . 1 . 2]" 1
929 2 71 LEU MD2 2 76 THR HA 2.900 . 4.800 3.892 3.614 3.958 . 0 0 "[ . 1 . 2]" 1
930 2 71 LEU MD2 2 77 THR HB 3.900 . 7.500 3.947 3.511 4.358 . 0 0 "[ . 1 . 2]" 1
931 2 52 ILE HA 2 71 LEU HG 3.400 . 5.000 4.384 4.258 4.505 . 0 0 "[ . 1 . 2]" 1
932 2 71 LEU HG 2 75 ASP QB 3.400 . 6.000 3.711 3.327 4.568 . 0 0 "[ . 1 . 2]" 1
933 2 71 LEU HG 2 76 THR HA 3.400 . 5.000 2.923 2.836 3.004 . 0 0 "[ . 1 . 2]" 1
934 2 53 LYS HA 2 72 HIS HA 3.400 . 5.000 5.127 5.050 5.212 0.212 11 0 "[ . 1 . 2]" 1
935 2 51 ASP HA 2 72 HIS QB 3.900 . 7.000 5.378 5.267 5.460 . 0 0 "[ . 1 . 2]" 1
936 2 53 LYS HB2 2 72 HIS QB 3.900 . 7.000 2.434 1.822 2.833 . 0 0 "[ . 1 . 2]" 1
937 2 53 LYS QG 2 72 HIS QB 3.900 . 8.000 2.788 2.419 3.442 . 0 0 "[ . 1 . 2]" 1
938 2 72 HIS QB 2 73 ALA MB 3.900 . 8.500 4.642 4.543 4.809 . 0 0 "[ . 1 . 2]" 1
939 2 52 ILE HA 2 72 HIS HD2 3.900 . 6.000 5.978 5.919 6.028 0.028 19 0 "[ . 1 . 2]" 1
940 2 53 LYS HB2 2 72 HIS HD2 3.900 . 6.000 5.069 4.839 5.388 . 0 0 "[ . 1 . 2]" 1
941 2 72 HIS QB 2 73 ALA HA 3.900 . 7.000 4.272 4.177 4.423 . 0 0 "[ . 1 . 2]" 1
942 2 71 LEU MD1 2 73 ALA MB 2.900 . 6.300 2.759 2.671 2.895 . 0 0 "[ . 1 . 2]" 1
943 2 71 LEU MD2 2 73 ALA MB 2.900 . 6.300 4.321 4.298 4.370 . 0 0 "[ . 1 . 2]" 1
944 2 73 ALA MB 2 75 ASP HA 3.400 . 6.500 5.030 4.947 5.147 . 0 0 "[ . 1 . 2]" 1
945 2 73 ALA MB 2 75 ASP QB 2.900 . 5.800 3.101 2.812 3.890 . 0 0 "[ . 1 . 2]" 1
946 2 73 ALA MB 2 74 GLY QA 3.900 . 8.500 4.001 3.878 4.045 . 0 0 "[ . 1 . 2]" 1
947 2 71 LEU HG 2 75 ASP HA 3.400 . 5.000 5.075 5.003 5.205 0.205 20 0 "[ . 1 . 2]" 1
948 2 75 ASP HA 2 76 THR HA 3.900 . 6.000 4.454 4.391 4.492 . 0 0 "[ . 1 . 2]" 1
949 2 75 ASP HA 2 76 THR MG 2.900 . 4.800 3.676 3.475 3.752 . 0 0 "[ . 1 . 2]" 1
950 2 71 LEU MD2 2 75 ASP QB 3.400 . 7.500 4.730 4.361 5.564 . 0 0 "[ . 1 . 2]" 1
951 2 75 ASP QB 2 76 THR HA 3.900 . 7.000 4.495 4.388 4.633 . 0 0 "[ . 1 . 2]" 1
952 2 68 GLN QG 2 76 THR HA 3.900 . 7.000 4.590 4.429 4.777 . 0 0 "[ . 1 . 2]" 1
953 2 76 THR HA 2 77 THR HB 3.900 . 6.000 4.805 4.707 4.913 . 0 0 "[ . 1 . 2]" 1
954 2 70 VAL MG1 2 76 THR HB 3.900 . 7.500 4.160 4.020 4.388 . 0 0 "[ . 1 . 2]" 1
955 2 71 LEU MD2 2 76 THR HB 3.900 . 7.500 5.786 5.442 5.935 . 0 0 "[ . 1 . 2]" 1
956 2 76 THR HB 2 77 THR MG 3.900 . 7.500 5.910 5.739 5.954 . 0 0 "[ . 1 . 2]" 1
957 2 77 THR HA 2 78 ASN HB3 3.900 . 6.000 5.767 5.685 5.823 . 0 0 "[ . 1 . 2]" 1
958 2 77 THR HA 2 79 PHE QD 3.900 . 8.000 5.842 5.683 6.213 . 0 0 "[ . 1 . 2]" 1
959 2 77 THR HA 2 79 PHE QE 3.900 . 8.000 5.453 5.270 5.891 . 0 0 "[ . 1 . 2]" 1
960 2 47 HIS HD2 2 77 THR HB 3.400 . 5.000 4.419 4.140 4.986 . 0 0 "[ . 1 . 2]" 1
961 2 77 THR HB 2 79 PHE QE 3.900 . 8.000 3.144 2.864 3.633 . 0 0 "[ . 1 . 2]" 1
962 2 47 HIS HD2 2 77 THR MG 3.400 . 6.500 3.086 2.790 3.482 . 0 0 "[ . 1 . 2]" 1
963 2 77 THR MG 2 79 PHE QE 2.900 . 6.800 2.917 2.750 3.288 . 0 0 "[ . 1 . 2]" 1
964 2 77 THR MG 2 79 PHE HZ 2.900 . 4.800 2.923 2.574 3.305 . 0 0 "[ . 1 . 2]" 1
965 2 77 THR HA 2 78 ASN HA 3.900 . 6.000 4.443 4.433 4.454 . 0 0 "[ . 1 . 2]" 1
966 2 77 THR MG 2 78 ASN HA 3.900 . 7.500 4.402 4.265 4.621 . 0 0 "[ . 1 . 2]" 1
967 2 78 ASN HA 2 79 PHE HB2 3.900 . 6.000 4.265 4.193 4.373 . 0 0 "[ . 1 . 2]" 1
968 2 78 ASN HA 2 79 PHE QD 3.900 . 8.000 4.079 3.837 4.383 . 0 0 "[ . 1 . 2]" 1
969 2 68 GLN HA 2 78 ASN HB3 3.400 . 5.000 4.482 4.193 4.897 . 0 0 "[ . 1 . 2]" 1
970 2 68 GLN HA 2 78 ASN HB2 3.900 . 6.000 5.044 4.836 5.195 . 0 0 "[ . 1 . 2]" 1
971 2 67 LEU MD2 2 79 PHE HA 3.900 . 7.500 6.079 5.802 6.186 . 0 0 "[ . 1 . 2]" 1
972 2 67 LEU HB3 2 79 PHE HB3 3.900 . 6.000 3.699 3.420 3.978 . 0 0 "[ . 1 . 2]" 1
973 2 79 PHE HB3 2 81 PHE QE 3.900 . 8.000 3.581 3.090 4.039 . 0 0 "[ . 1 . 2]" 1
974 2 79 PHE HB2 2 81 PHE QE 3.400 . 7.000 3.351 3.033 3.874 . 0 0 "[ . 1 . 2]" 1
975 2 33 ILE MD 2 79 PHE QE 2.900 . 6.800 2.356 2.102 2.680 . 0 0 "[ . 1 . 2]" 1
976 2 45 ILE MD 2 79 PHE QE 3.400 . 8.500 3.898 3.740 4.048 . 0 0 "[ . 1 . 2]" 1
977 2 26 LEU MD1 2 79 PHE HZ 3.900 . 7.500 3.077 2.960 3.221 . 0 0 "[ . 1 . 2]" 1
978 2 33 ILE MD 2 79 PHE HZ 3.900 . 7.500 3.040 2.311 3.408 . 0 0 "[ . 1 . 2]" 1
979 2 35 TRP HB3 2 79 PHE HZ 3.900 . 6.000 3.225 3.002 3.424 . 0 0 "[ . 1 . 2]" 1
980 2 35 TRP HB2 2 79 PHE HZ 3.900 . 6.000 3.625 3.466 3.812 . 0 0 "[ . 1 . 2]" 1
981 2 17 VAL MG1 2 80 HIS HA 3.900 . 7.500 4.377 4.125 4.617 . 0 0 "[ . 1 . 2]" 1
982 2 64 LYS QB 2 80 HIS HA 3.900 . 7.000 4.228 3.632 4.712 . 0 0 "[ . 1 . 2]" 1
983 2 80 HIS HA 2 81 PHE QD 3.400 . 7.000 3.880 3.551 4.177 . 0 0 "[ . 1 . 2]" 1
984 2 17 VAL MG1 2 80 HIS HB3 3.900 . 7.500 4.124 3.776 4.584 . 0 0 "[ . 1 . 2]" 1
985 2 18 ARG HB3 2 80 HIS HB3 3.900 . 6.000 3.155 2.455 3.609 . 0 0 "[ . 1 . 2]" 1
986 2 18 ARG HB2 2 80 HIS HB3 2.900 . 3.300 1.763 1.690 2.014 0.110 7 0 "[ . 1 . 2]" 1
987 2 17 VAL MG1 2 80 HIS HB2 3.900 . 7.500 4.991 4.185 5.524 . 0 0 "[ . 1 . 2]" 1
988 2 18 ARG HB3 2 80 HIS HB2 3.900 . 6.000 4.308 3.537 4.960 . 0 0 "[ . 1 . 2]" 1
989 2 18 ARG HB2 2 80 HIS HB2 2.900 . 3.300 3.063 2.105 3.418 0.118 14 0 "[ . 1 . 2]" 1
990 2 65 ILE HB 2 80 HIS HD2 3.900 . 6.000 5.565 4.353 6.053 0.053 12 0 "[ . 1 . 2]" 1
991 2 66 GLN HA 2 80 HIS HD2 3.900 . 6.000 5.121 3.685 5.786 . 0 0 "[ . 1 . 2]" 1
992 2 80 HIS HD2 2 81 PHE HA 3.900 . 6.000 4.003 3.622 4.825 . 0 0 "[ . 1 . 2]" 1
993 2 80 HIS HD2 2 81 PHE QD 3.900 . 8.000 5.386 4.756 6.159 . 0 0 "[ . 1 . 2]" 1
994 2 80 HIS HD2 2 82 SER HA 3.900 . 6.000 3.230 2.909 4.094 . 0 0 "[ . 1 . 2]" 1
995 2 64 LYS QB 2 80 HIS HE1 3.900 . 7.000 3.266 2.800 3.939 . 0 0 "[ . 1 . 2]" 1
996 2 81 PHE HA 2 87 ALA MB 2.900 . 4.800 3.703 3.531 3.844 . 0 0 "[ . 1 . 2]" 1
997 2 65 ILE QG 2 81 PHE HB3 3.900 . 7.000 5.101 4.765 5.538 . 0 0 "[ . 1 . 2]" 1
998 2 81 PHE HB3 2 87 ALA HA 2.900 . 3.300 2.670 2.337 3.033 . 0 0 "[ . 1 . 2]" 1
999 2 81 PHE HB3 2 87 ALA MB 2.900 . 4.800 1.656 1.476 1.821 0.324 17 0 "[ . 1 . 2]" 1
1000 2 65 ILE HB 2 81 PHE HB2 3.900 . 6.000 2.610 2.394 2.792 . 0 0 "[ . 1 . 2]" 1
1001 2 81 PHE HB2 2 87 ALA HA 3.400 . 5.000 4.223 3.724 4.667 . 0 0 "[ . 1 . 2]" 1
1002 2 81 PHE HB2 2 87 ALA MB 2.900 . 4.800 2.688 2.278 3.032 . 0 0 "[ . 1 . 2]" 1
1003 2 81 PHE QD 2 87 ALA HA 3.400 . 7.000 2.356 2.019 2.715 . 0 0 "[ . 1 . 2]" 1
1004 2 81 PHE QD 2 87 ALA MB 3.900 . 9.500 3.152 2.812 3.460 . 0 0 "[ . 1 . 2]" 1
1005 2 81 PHE QD 2 90 GLU HB3 3.400 . 7.000 2.593 2.395 2.876 . 0 0 "[ . 1 . 2]" 1
1006 2 81 PHE QD 2 90 GLU HB2 3.900 . 8.000 2.767 2.627 2.897 . 0 0 "[ . 1 . 2]" 1
1007 2 81 PHE QD 2 91 ARG HA 3.900 . 8.000 3.783 3.628 3.928 . 0 0 "[ . 1 . 2]" 1
1008 2 81 PHE QE 2 87 ALA HA 3.900 . 8.000 4.215 3.836 4.624 . 0 0 "[ . 1 . 2]" 1
1009 2 81 PHE QE 2 90 GLU HA 3.900 . 8.000 3.885 3.728 4.138 . 0 0 "[ . 1 . 2]" 1
1010 2 81 PHE QE 2 91 ARG HA 3.400 . 7.000 2.860 2.619 3.068 . 0 0 "[ . 1 . 2]" 1
1011 2 81 PHE HZ 2 91 ARG HA 3.400 . 5.000 2.715 2.583 2.892 . 0 0 "[ . 1 . 2]" 1
1012 2 81 PHE HZ 2 94 VAL HA 3.900 . 6.000 4.917 4.816 5.015 . 0 0 "[ . 1 . 2]" 1
1013 2 81 PHE HZ 2 94 VAL HB 3.400 . 5.000 2.630 2.424 2.834 . 0 0 "[ . 1 . 2]" 1
1014 2 81 PHE HZ 2 94 VAL MG1 2.900 . 4.800 2.915 2.692 3.076 . 0 0 "[ . 1 . 2]" 1
1015 2 81 PHE HZ 2 94 VAL MG2 2.900 . 4.800 1.509 1.404 1.583 0.396 2 0 "[ . 1 . 2]" 1
1016 2 82 SER HA 2 87 ALA MB 2.900 . 4.800 3.797 3.477 4.036 . 0 0 "[ . 1 . 2]" 1
1017 2 18 ARG QG 2 82 SER HB3 3.400 . 6.000 3.569 2.692 4.991 . 0 0 "[ . 1 . 2]" 1
1018 2 16 LYS QD 2 83 ASN HA 2.900 . 4.300 3.413 2.134 3.878 . 0 0 "[ . 1 . 2]" 1
1019 2 16 LYS QG 2 83 ASN HA 3.400 . 6.000 3.569 2.979 4.065 . 0 0 "[ . 1 . 2]" 1
1020 2 83 ASN HA 2 87 ALA MB 3.400 . 6.500 3.961 3.760 4.126 . 0 0 "[ . 1 . 2]" 1
1021 2 14 VAL MG1 2 83 ASN HB3 3.900 . 7.500 4.342 4.094 4.603 . 0 0 "[ . 1 . 2]" 1
1022 2 16 LYS HB3 2 83 ASN HB3 3.400 . 5.000 4.649 4.513 4.886 . 0 0 "[ . 1 . 2]" 1
1023 2 16 LYS HB2 2 83 ASN HB3 3.400 . 5.000 3.530 3.432 3.687 . 0 0 "[ . 1 . 2]" 1
1024 2 16 LYS QD 2 83 ASN HB3 3.900 . 7.000 5.544 4.424 5.947 . 0 0 "[ . 1 . 2]" 1
1025 2 16 LYS QG 2 83 ASN HB3 3.400 . 6.000 5.154 4.913 5.448 . 0 0 "[ . 1 . 2]" 1
1026 2 83 ASN HB3 2 87 ALA MB 3.400 . 6.500 2.852 2.556 3.145 . 0 0 "[ . 1 . 2]" 1
1027 2 14 VAL MG1 2 83 ASN HB2 3.900 . 7.500 4.419 4.137 4.732 . 0 0 "[ . 1 . 2]" 1
1028 2 16 LYS HB3 2 83 ASN HB2 2.900 . 3.300 3.169 2.926 3.329 0.029 8 0 "[ . 1 . 2]" 1
1029 2 16 LYS HB2 2 83 ASN HB2 2.900 . 3.300 1.857 1.716 2.066 0.084 10 0 "[ . 1 . 2]" 1
1030 2 16 LYS QG 2 83 ASN HB2 2.900 . 4.300 3.724 3.488 3.923 . 0 0 "[ . 1 . 2]" 1
1031 2 83 ASN HB2 2 87 ALA MB 3.900 . 7.500 3.978 3.541 4.303 . 0 0 "[ . 1 . 2]" 1
1032 2 83 ASN HA 2 84 GLU HA 3.900 . 6.000 4.480 4.432 4.507 . 0 0 "[ . 1 . 2]" 1
1033 2 84 GLU HA 2 87 ALA MB 2.900 . 4.800 3.400 3.137 3.779 . 0 0 "[ . 1 . 2]" 1
1034 2 83 ASN HA 2 84 GLU QB 3.900 . 7.000 4.476 4.279 4.769 . 0 0 "[ . 1 . 2]" 1
1035 2 84 GLU QB 2 85 SER HA 3.900 . 7.000 4.177 3.741 4.504 . 0 0 "[ . 1 . 2]" 1
1036 2 83 ASN HA 2 84 GLU QG 3.900 . 7.000 4.408 3.558 4.934 . 0 0 "[ . 1 . 2]" 1
1037 2 84 GLU QG 2 85 SER HA 3.900 . 7.000 4.137 3.221 5.850 . 0 0 "[ . 1 . 2]" 1
1038 2 84 GLU QG 2 87 ALA MB 3.900 . 8.500 5.432 4.727 5.886 . 0 0 "[ . 1 . 2]" 1
1039 2 85 SER HA 2 86 THR MG 2.900 . 4.800 3.922 3.889 3.944 . 0 0 "[ . 1 . 2]" 1
1040 2 84 GLU QB 2 85 SER QB 3.900 . 8.000 5.031 4.634 5.332 . 0 0 "[ . 1 . 2]" 1
1041 2 84 GLU QG 2 85 SER QB 3.900 . 8.000 4.614 3.626 6.326 . 0 0 "[ . 1 . 2]" 1
1042 2 85 SER QB 2 86 THR HA 3.900 . 7.000 4.076 4.031 4.110 . 0 0 "[ . 1 . 2]" 1
1043 2 85 SER QB 2 86 THR MG 2.900 . 5.800 2.520 2.332 2.698 . 0 0 "[ . 1 . 2]" 1
1044 2 86 THR HA 2 87 ALA HA 3.400 . 5.000 4.938 4.910 4.970 . 0 0 "[ . 1 . 2]" 1
1045 2 86 THR HA 2 89 LYS QB 2.900 . 4.300 3.549 3.496 3.586 . 0 0 "[ . 1 . 2]" 1
1046 2 86 THR HA 2 89 LYS QG 3.900 . 7.000 4.026 3.860 5.182 . 0 0 "[ . 1 . 2]" 1
1047 2 86 THR HA 2 90 GLU QG 3.900 . 7.000 4.615 4.519 4.719 . 0 0 "[ . 1 . 2]" 1
1048 2 86 THR HB 2 89 LYS QB 2.900 . 4.300 2.722 2.589 3.071 . 0 0 "[ . 1 . 2]" 1
1049 2 86 THR HB 2 89 LYS QG 3.900 . 7.000 4.468 4.326 4.901 . 0 0 "[ . 1 . 2]" 1
1050 2 86 THR HB 2 90 GLU HA 3.900 . 6.000 4.535 4.482 4.597 . 0 0 "[ . 1 . 2]" 1
1051 2 86 THR HB 2 90 GLU HB2 3.900 . 6.000 3.961 3.795 4.084 . 0 0 "[ . 1 . 2]" 1
1052 2 86 THR HB 2 90 GLU QG 2.900 . 4.300 2.543 2.447 2.641 . 0 0 "[ . 1 . 2]" 1
1053 2 86 THR MG 2 89 LYS QB 3.400 . 7.500 3.386 3.286 3.493 . 0 0 "[ . 1 . 2]" 1
1054 2 86 THR MG 2 90 GLU QG 3.900 . 8.500 3.918 3.863 3.973 . 0 0 "[ . 1 . 2]" 1
1055 2 87 ALA HA 2 90 GLU HB3 2.900 . 3.300 3.428 3.400 3.471 0.171 2 0 "[ . 1 . 2]" 1
1056 2 87 ALA HA 2 90 GLU HB2 2.900 . 3.300 2.192 2.142 2.306 . 0 0 "[ . 1 . 2]" 1
1057 2 87 ALA HA 2 90 GLU QG 3.400 . 6.000 4.025 3.904 4.206 . 0 0 "[ . 1 . 2]" 1
1058 2 87 ALA MB 2 88 VAL MG2 2.900 . 6.300 3.393 3.210 3.475 . 0 0 "[ . 1 . 2]" 1
1059 2 87 ALA MB 2 88 VAL HA 2.900 . 4.800 3.774 3.744 3.805 . 0 0 "[ . 1 . 2]" 1
1060 2 88 VAL HA 2 91 ARG HB3 2.900 . 3.300 2.995 2.875 3.279 . 0 0 "[ . 1 . 2]" 1
1061 2 88 VAL HA 2 91 ARG HB2 2.900 . 3.300 3.366 3.268 3.402 0.102 13 0 "[ . 1 . 2]" 1
1062 2 65 ILE MD 2 88 VAL HB 2.900 . 4.800 3.969 3.933 4.013 . 0 0 "[ . 1 . 2]" 1
1063 2 88 VAL MG1 2 89 LYS HA 2.900 . 4.800 2.955 2.914 3.017 . 0 0 "[ . 1 . 2]" 1
1064 2 88 VAL MG1 2 92 ASP HB3 3.400 . 6.500 5.083 4.952 5.269 . 0 0 "[ . 1 . 2]" 1
1065 2 88 VAL MG1 2 92 ASP HB2 3.900 . 7.500 3.911 3.789 4.291 . 0 0 "[ . 1 . 2]" 1
1066 2 88 VAL MG2 2 89 LYS QG 3.400 . 7.500 4.635 4.485 5.701 . 0 0 "[ . 1 . 2]" 1
1067 2 88 VAL MG2 2 89 LYS HA 3.400 . 6.500 5.352 5.329 5.394 . 0 0 "[ . 1 . 2]" 1
1068 2 89 LYS HA 2 92 ASP HB3 2.900 . 3.300 3.583 3.508 3.619 0.319 7 0 "[ . 1 . 2]" 1
1069 2 89 LYS HA 2 92 ASP HB2 2.900 . 3.300 2.218 1.973 2.276 . 0 0 "[ . 1 . 2]" 1
1070 2 86 THR MG 2 89 LYS QD 3.400 . 7.500 2.286 2.020 5.005 . 0 0 "[ . 1 . 2]" 1
1071 2 81 PHE QD 2 90 GLU HA 3.900 . 8.000 5.052 4.918 5.210 . 0 0 "[ . 1 . 2]" 1
1072 2 90 GLU HA 2 93 ALA MB 2.900 . 4.800 2.638 2.528 2.770 . 0 0 "[ . 1 . 2]" 1
1073 2 14 VAL MG1 2 90 GLU HB3 2.900 . 4.800 2.036 1.874 2.224 . 0 0 "[ . 1 . 2]" 1
1074 2 14 VAL MG2 2 90 GLU HB3 2.900 . 4.800 3.463 3.280 3.797 . 0 0 "[ . 1 . 2]" 1
1075 2 81 PHE QE 2 90 GLU HB3 3.900 . 8.000 1.667 1.413 2.089 0.387 3 0 "[ . 1 . 2]" 1
1076 2 90 GLU QG 2 93 ALA MB 2.900 . 5.800 3.861 3.742 3.989 . 0 0 "[ . 1 . 2]" 1
1077 2 65 ILE MG 2 91 ARG HA 3.400 . 6.500 3.994 3.851 4.112 . 0 0 "[ . 1 . 2]" 1
1078 2 91 ARG HA 2 94 VAL HA 3.900 . 6.000 5.811 5.723 5.888 . 0 0 "[ . 1 . 2]" 1
1079 2 91 ARG HA 2 94 VAL HB 2.900 . 3.300 3.153 3.049 3.237 . 0 0 "[ . 1 . 2]" 1
1080 2 91 ARG HA 2 94 VAL MG1 3.400 . 6.500 4.446 4.349 4.517 . 0 0 "[ . 1 . 2]" 1
1081 2 91 ARG HA 2 94 VAL MG2 2.900 . 4.800 3.215 3.085 3.387 . 0 0 "[ . 1 . 2]" 1
1082 2 81 PHE QD 2 91 ARG HB3 3.900 . 8.000 4.893 4.736 5.086 . 0 0 "[ . 1 . 2]" 1
1083 2 81 PHE QE 2 91 ARG HB3 3.900 . 8.000 4.976 4.808 5.160 . 0 0 "[ . 1 . 2]" 1
1084 2 81 PHE QD 2 91 ARG HB2 3.900 . 8.000 3.481 3.207 3.672 . 0 0 "[ . 1 . 2]" 1
1085 2 81 PHE QE 2 91 ARG HB2 3.900 . 8.000 3.934 3.726 4.182 . 0 0 "[ . 1 . 2]" 1
1086 2 81 PHE QD 2 91 ARG QD 3.900 . 9.000 4.643 4.306 5.132 . 0 0 "[ . 1 . 2]" 1
1087 2 81 PHE QE 2 91 ARG QD 3.900 . 9.000 5.042 4.668 5.471 . 0 0 "[ . 1 . 2]" 1
1088 2 91 ARG QD 2 92 ASP HA 3.900 . 7.000 4.724 3.614 4.918 . 0 0 "[ . 1 . 2]" 1
1089 2 81 PHE QD 2 91 ARG QG 3.900 . 9.000 3.436 3.116 3.834 . 0 0 "[ . 1 . 2]" 1
1090 2 81 PHE QE 2 91 ARG QG 3.900 . 9.000 3.338 2.859 3.897 . 0 0 "[ . 1 . 2]" 1
1091 2 92 ASP HA 2 95 LYS HB3 2.900 . 3.300 2.308 2.196 2.416 . 0 0 "[ . 1 . 2]" 1
1092 2 92 ASP HA 2 95 LYS HB2 2.900 . 3.300 3.349 3.312 3.392 0.092 13 0 "[ . 1 . 2]" 1
1093 2 92 ASP HA 2 95 LYS QE 2.900 . 4.300 2.774 1.618 3.918 0.182 14 0 "[ . 1 . 2]" 1
1094 2 92 ASP HA 2 95 LYS QG 3.400 . 6.000 4.074 3.917 4.208 . 0 0 "[ . 1 . 2]" 1
1095 2 92 ASP HB3 2 93 ALA MB 3.900 . 7.500 4.323 4.228 4.442 . 0 0 "[ . 1 . 2]" 1
1096 2 92 ASP HB2 2 93 ALA MB 3.400 . 6.500 4.354 4.119 4.402 . 0 0 "[ . 1 . 2]" 1
1097 2 93 ALA HA 2 96 ASP HB3 2.900 . 3.300 3.564 3.538 3.589 0.289 2 0 "[ . 1 . 2]" 1
1098 2 93 ALA HA 2 96 ASP HB2 2.900 . 3.300 2.166 2.105 2.240 . 0 0 "[ . 1 . 2]" 1
1099 2 12 LEU MD1 2 93 ALA MB 2.900 . 6.300 2.053 1.915 2.193 . 0 0 "[ . 1 . 2]" 1
1100 2 12 LEU MD2 2 93 ALA MB 2.400 . 5.700 2.665 2.472 2.877 . 0 0 "[ . 1 . 2]" 1
1101 2 93 ALA MB 2 94 VAL HA 3.400 . 6.500 3.894 3.868 3.912 . 0 0 "[ . 1 . 2]" 1
1102 2 93 ALA MB 2 94 VAL HB 3.900 . 7.500 4.809 4.770 4.849 . 0 0 "[ . 1 . 2]" 1
1103 2 93 ALA MB 2 94 VAL MG2 2.900 . 6.300 3.210 3.161 3.258 . 0 0 "[ . 1 . 2]" 1
1104 2 93 ALA MB 2 96 ASP HB3 3.400 . 6.500 4.784 4.751 4.823 . 0 0 "[ . 1 . 2]" 1
1105 2 93 ALA MB 2 96 ASP HB2 2.900 . 4.800 3.836 3.766 3.915 . 0 0 "[ . 1 . 2]" 1
1106 2 94 VAL HA 2 95 LYS HA 3.900 . 6.000 4.883 4.863 4.903 . 0 0 "[ . 1 . 2]" 1
1107 2 94 VAL HA 2 97 LEU HA 3.900 . 6.000 5.726 5.608 5.846 . 0 0 "[ . 1 . 2]" 1
1108 2 94 VAL HA 2 97 LEU QB 2.900 . 4.300 3.011 2.883 3.109 . 0 0 "[ . 1 . 2]" 1
1109 2 94 VAL HA 2 97 LEU QD 2.900 . 7.200 3.839 3.679 3.912 . 0 0 "[ . 1 . 2]" 1
1110 2 26 LEU MD2 2 94 VAL HB 3.900 . 7.500 3.956 3.843 4.044 . 0 0 "[ . 1 . 2]" 1
1111 2 81 PHE QE 2 94 VAL HB 3.900 . 8.000 3.693 3.548 3.850 . 0 0 "[ . 1 . 2]" 1
1112 2 94 VAL HB 2 95 LYS HA 3.900 . 6.000 4.152 4.077 4.198 . 0 0 "[ . 1 . 2]" 1
1113 2 26 LEU MD2 2 94 VAL MG1 2.400 . 5.700 2.193 2.065 2.275 . 0 0 "[ . 1 . 2]" 1
1114 2 81 PHE QE 2 94 VAL MG1 2.900 . 6.800 3.691 3.544 3.832 . 0 0 "[ . 1 . 2]" 1
1115 2 94 VAL MG1 2 98 LEU HG 2.900 . 4.800 2.881 2.685 3.024 . 0 0 "[ . 1 . 2]" 1
1116 2 14 VAL HA 2 94 VAL MG2 3.900 . 7.500 4.778 4.664 4.886 . 0 0 "[ . 1 . 2]" 1
1117 2 26 LEU MD1 2 94 VAL MG2 2.900 . 6.300 4.185 4.136 4.230 . 0 0 "[ . 1 . 2]" 1
1118 2 81 PHE QD 2 94 VAL MG2 3.900 . 9.500 4.316 4.227 4.439 . 0 0 "[ . 1 . 2]" 1
1119 2 81 PHE QE 2 94 VAL MG2 2.900 . 6.800 2.536 2.397 2.707 . 0 0 "[ . 1 . 2]" 1
1120 2 90 GLU HA 2 94 VAL MG2 3.900 . 7.500 3.557 3.451 3.788 . 0 0 "[ . 1 . 2]" 1
1121 2 93 ALA HA 2 94 VAL MG2 3.900 . 7.500 5.010 4.979 5.033 . 0 0 "[ . 1 . 2]" 1
1122 2 94 VAL MG2 2 95 LYS HA 3.900 . 7.500 5.378 5.337 5.401 . 0 0 "[ . 1 . 2]" 1
1123 2 95 LYS HA 2 98 LEU HB2 2.900 . 3.300 2.824 2.601 2.968 . 0 0 "[ . 1 . 2]" 1
1124 2 95 LYS HA 2 98 LEU MD1 2.900 . 4.800 3.021 2.791 3.251 . 0 0 "[ . 1 . 2]" 1
1125 2 57 ILE MD 2 95 LYS HB2 3.400 . 6.500 3.627 3.414 3.829 . 0 0 "[ . 1 . 2]" 1
1126 2 57 ILE MG 2 95 LYS HB2 3.400 . 6.500 2.238 1.987 2.593 . 0 0 "[ . 1 . 2]" 1
1127 2 67 LEU MD1 2 95 LYS HB2 2.900 . 4.800 2.020 1.828 2.212 . 0 0 "[ . 1 . 2]" 1
1128 2 57 ILE MG 2 95 LYS QD 2.900 . 5.800 2.834 1.968 3.725 . 0 0 "[ . 1 . 2]" 1
1129 2 96 ASP HA 2 99 GLN QB 2.900 . 4.300 2.984 2.393 3.929 . 0 0 "[ . 1 . 2]" 1
1130 2 96 ASP HA 2 99 GLN QG 2.900 . 4.300 3.251 1.876 3.943 . 0 0 "[ . 1 . 2]" 1
1131 2 96 ASP HB3 2 97 LEU QD 3.900 . 9.900 4.418 4.263 4.546 . 0 0 "[ . 1 . 2]" 1
1132 2 96 ASP HB2 2 97 LEU HA 3.900 . 6.000 4.765 4.717 4.792 . 0 0 "[ . 1 . 2]" 1
1133 2 97 LEU HA 2 100 GLN HB3 2.900 . 3.300 3.498 3.468 3.556 0.256 15 0 "[ . 1 . 2]" 1
1134 2 97 LEU HA 2 100 GLN QG 2.900 . 4.300 3.172 2.931 3.663 . 0 0 "[ . 1 . 2]" 1
1135 2 97 LEU HA 2 101 LEU MD1 3.400 . 6.500 3.686 3.548 3.853 . 0 0 "[ . 1 . 2]" 1
1136 2 97 LEU QB 2 98 LEU HA 3.900 . 7.000 4.007 3.945 4.054 . 0 0 "[ . 1 . 2]" 1
1137 2 97 LEU QB 2 101 LEU MD1 2.900 . 5.800 3.107 2.867 3.201 . 0 0 "[ . 1 . 2]" 1
1138 2 11 LEU HA 2 97 LEU QD 2.900 . 7.200 4.299 4.022 4.604 . 0 0 "[ . 1 . 2]" 1
1139 2 12 LEU HA 2 97 LEU QD 2.900 . 7.200 3.956 3.748 4.117 . 0 0 "[ . 1 . 2]" 1
1140 2 12 LEU HG 2 97 LEU QD 2.400 . 6.600 4.350 4.196 4.483 . 0 0 "[ . 1 . 2]" 1
1141 2 28 LEU HA 2 97 LEU QD 3.900 . 9.900 4.588 4.429 4.903 . 0 0 "[ . 1 . 2]" 1
1142 2 96 ASP HB2 2 97 LEU QD 3.900 . 9.900 4.896 4.793 5.011 . 0 0 "[ . 1 . 2]" 1
1143 2 97 LEU QD 2 100 GLN HB3 3.400 . 8.900 3.550 3.384 3.717 . 0 0 "[ . 1 . 2]" 1
1144 2 28 LEU MD1 2 97 LEU HG 2.900 . 4.800 3.836 3.678 3.897 . 0 0 "[ . 1 . 2]" 1
1145 2 97 LEU HG 2 101 LEU HB3 3.400 . 5.000 4.690 4.600 4.792 . 0 0 "[ . 1 . 2]" 1
1146 2 97 LEU HG 2 101 LEU MD1 2.900 . 4.800 1.547 1.420 1.711 0.380 11 0 "[ . 1 . 2]" 1
1147 2 98 LEU HA 2 101 LEU MD1 2.900 . 4.800 3.421 3.233 3.596 . 0 0 "[ . 1 . 2]" 1
1148 2 98 LEU HA 2 101 LEU HG 3.900 . 6.000 4.649 4.302 4.841 . 0 0 "[ . 1 . 2]" 1
1149 2 98 LEU HA 2 102 LEU MD2 2.900 . 4.800 3.955 3.684 4.007 . 0 0 "[ . 1 . 2]" 1
1150 2 98 LEU HA 2 102 LEU HG 3.900 . 6.000 2.780 2.694 2.841 . 0 0 "[ . 1 . 2]" 1
1151 2 95 LYS HA 2 98 LEU HB3 3.400 . 5.000 4.336 4.099 4.477 . 0 0 "[ . 1 . 2]" 1
1152 2 98 LEU HB3 2 99 GLN HA 3.900 . 6.000 4.149 4.098 4.215 . 0 0 "[ . 1 . 2]" 1
1153 2 98 LEU HB3 2 102 LEU HG 2.900 . 3.300 2.554 2.410 2.757 . 0 0 "[ . 1 . 2]" 1
1154 2 49 TYR QE 2 98 LEU MD1 3.400 . 8.500 4.109 3.997 4.283 . 0 0 "[ . 1 . 2]" 1
1155 2 55 GLN HA 2 98 LEU MD1 3.900 . 7.500 4.650 4.202 5.122 . 0 0 "[ . 1 . 2]" 1
1156 2 67 LEU MD2 2 98 LEU MD1 2.400 . 5.700 2.092 1.981 2.226 . 0 0 "[ . 1 . 2]" 1
1157 2 94 VAL HA 2 98 LEU MD1 3.900 . 7.500 3.947 3.847 4.090 . 0 0 "[ . 1 . 2]" 1
1158 2 98 LEU MD1 2 99 GLN HA 3.900 . 7.500 5.773 5.733 5.811 . 0 0 "[ . 1 . 2]" 1
1159 2 33 ILE HA 2 98 LEU MD2 3.900 . 7.500 4.690 4.365 4.923 . 0 0 "[ . 1 . 2]" 1
1160 2 49 TYR QE 2 98 LEU MD2 2.400 . 6.200 2.082 1.968 2.190 . 0 0 "[ . 1 . 2]" 1
1161 2 95 LYS HA 2 98 LEU HG 3.900 . 6.000 4.636 4.358 4.895 . 0 0 "[ . 1 . 2]" 1
1162 2 99 GLN HA 2 102 LEU MD1 2.900 . 4.800 3.721 3.561 3.800 . 0 0 "[ . 1 . 2]" 1
1163 2 99 GLN HA 2 103 PRO QD 3.400 . 6.000 2.954 2.727 3.158 . 0 0 "[ . 1 . 2]" 1
1164 2 95 LYS QG 2 99 GLN QB 3.900 . 8.000 3.389 2.885 4.145 . 0 0 "[ . 1 . 2]" 1
1165 2 95 LYS QG 2 99 GLN QG 3.900 . 8.000 3.414 2.154 4.674 . 0 0 "[ . 1 . 2]" 1
1166 2 100 GLN HA 2 103 PRO QD 3.900 . 7.000 3.767 3.592 3.987 . 0 0 "[ . 1 . 2]" 1
1167 2 100 GLN HB3 2 101 LEU MD1 3.900 . 7.500 4.532 4.366 4.717 . 0 0 "[ . 1 . 2]" 1
1168 2 97 LEU QD 2 100 GLN HB2 2.900 . 7.200 3.204 3.092 3.420 . 0 0 "[ . 1 . 2]" 1
1169 2 100 GLN HB2 2 101 LEU MD1 3.900 . 7.500 4.220 4.049 4.402 . 0 0 "[ . 1 . 2]" 1
1170 2 97 LEU QD 2 100 GLN QG 2.900 . 8.200 3.688 3.284 4.248 . 0 0 "[ . 1 . 2]" 1
1171 2 100 GLN QG 2 101 LEU HG 3.400 . 6.000 5.085 4.838 5.337 . 0 0 "[ . 1 . 2]" 1
1172 2 49 TYR QE 2 101 LEU HA 3.900 . 8.000 5.059 4.329 5.390 . 0 0 "[ . 1 . 2]" 1
1173 2 101 LEU HA 2 103 PRO QD 3.900 . 7.000 4.084 3.792 4.231 . 0 0 "[ . 1 . 2]" 1
1174 2 101 LEU HA 2 104 LYS QB 2.900 . 4.300 3.173 2.546 3.850 . 0 0 "[ . 1 . 2]" 1
1175 2 101 LEU HA 2 104 LYS QE 3.900 . 7.000 2.865 2.207 4.638 . 0 0 "[ . 1 . 2]" 1
1176 2 101 LEU HA 2 105 PHE QE 3.400 . 7.000 3.658 3.183 5.619 . 0 0 "[ . 1 . 2]" 1
1177 2 98 LEU HA 2 101 LEU HB3 2.900 . 3.300 3.615 3.586 3.645 0.345 16 0 "[ . 1 . 2]" 1
1178 2 101 LEU HB3 2 105 PHE QE 3.400 . 7.000 3.446 2.535 5.060 . 0 0 "[ . 1 . 2]" 1
1179 2 98 LEU HA 2 101 LEU HB2 2.900 . 3.300 2.340 2.179 2.455 . 0 0 "[ . 1 . 2]" 1
1180 2 101 LEU HB2 2 105 PHE QE 3.900 . 8.000 4.966 4.250 6.667 . 0 0 "[ . 1 . 2]" 1
1181 2 94 VAL HA 2 101 LEU MD1 3.900 . 7.500 5.737 5.411 5.875 . 0 0 "[ . 1 . 2]" 1
1182 2 101 LEU MD1 2 104 LYS QE 3.900 . 8.500 4.984 4.178 6.223 . 0 0 "[ . 1 . 2]" 1
1183 2 101 LEU MD1 2 105 PHE QE 3.400 . 8.500 4.152 3.785 5.501 . 0 0 "[ . 1 . 2]" 1
1184 2 49 TYR QE 2 101 LEU MD2 2.900 . 6.800 2.352 2.074 2.621 . 0 0 "[ . 1 . 2]" 1
1185 2 98 LEU HA 2 101 LEU MD2 3.900 . 7.500 5.058 4.967 5.141 . 0 0 "[ . 1 . 2]" 1
1186 2 100 GLN HB2 2 101 LEU MD2 3.400 . 6.500 5.047 4.646 5.253 . 0 0 "[ . 1 . 2]" 1
1187 2 101 LEU MD2 2 104 LYS QE 3.400 . 7.500 2.807 2.027 3.848 . 0 0 "[ . 1 . 2]" 1
1188 2 101 LEU MD2 2 105 PHE QE 2.900 . 6.800 2.075 1.650 4.182 0.150 4 0 "[ . 1 . 2]" 1
1189 2 49 TYR QD 2 101 LEU HG 3.900 . 8.000 5.138 4.945 5.426 . 0 0 "[ . 1 . 2]" 1
1190 2 100 GLN HB3 2 101 LEU HG 2.900 . 3.300 3.368 3.319 3.438 0.138 3 0 "[ . 1 . 2]" 1
1191 2 101 LEU HG 2 105 PHE QE 3.900 . 8.000 4.662 4.293 6.992 . 0 0 "[ . 1 . 2]" 1
1192 2 49 TYR HA 2 102 LEU HA 3.900 . 6.000 3.840 3.420 4.096 . 0 0 "[ . 1 . 2]" 1
1193 2 49 TYR QD 2 102 LEU HA 3.900 . 8.000 3.903 3.628 4.205 . 0 0 "[ . 1 . 2]" 1
1194 2 102 LEU HA 2 103 PRO QD 3.900 . 7.000 3.569 3.554 3.586 . 0 0 "[ . 1 . 2]" 1
1195 2 102 LEU HA 2 105 PHE QD 3.400 . 7.000 3.537 2.898 4.564 . 0 0 "[ . 1 . 2]" 1
1196 2 102 LEU HB3 2 103 PRO QD 2.900 . 4.300 2.941 2.763 3.147 . 0 0 "[ . 1 . 2]" 1
1197 2 102 LEU HB2 2 103 PRO QD 2.900 . 4.300 1.902 1.633 2.186 0.167 18 0 "[ . 1 . 2]" 1
1198 2 49 TYR HA 2 102 LEU MD1 2.900 . 4.800 4.222 4.164 4.268 . 0 0 "[ . 1 . 2]" 1
1199 2 102 LEU MD1 2 103 PRO QD 2.900 . 5.800 3.734 3.561 3.936 . 0 0 "[ . 1 . 2]" 1
1200 2 49 TYR HA 2 102 LEU MD2 2.900 . 4.800 2.059 1.990 2.132 . 0 0 "[ . 1 . 2]" 1
1201 2 49 TYR QD 2 102 LEU MD2 2.900 . 6.800 2.103 1.978 2.244 . 0 0 "[ . 1 . 2]" 1
1202 2 49 TYR HB3 2 102 LEU HG 3.900 . 6.000 3.872 3.642 4.101 . 0 0 "[ . 1 . 2]" 1
1203 2 49 TYR QD 2 102 LEU HG 3.900 . 8.000 3.872 3.636 4.150 . 0 0 "[ . 1 . 2]" 1
1204 2 102 LEU MD1 2 103 PRO HA 3.900 . 7.500 5.803 5.699 5.870 . 0 0 "[ . 1 . 2]" 1
1205 2 103 PRO HA 2 104 LYS QG 3.400 . 6.000 5.249 4.929 5.502 . 0 0 "[ . 1 . 2]" 1
1206 2 103 PRO HA 2 106 LYS QG 2.900 . 4.300 2.844 1.741 3.995 0.059 9 0 "[ . 1 . 2]" 1
1207 2 102 LEU MD2 2 103 PRO QD 3.400 . 7.500 4.184 4.137 4.241 . 0 0 "[ . 1 . 2]" 1
1208 2 104 LYS HA 2 105 PHE QD 3.900 . 8.000 5.086 4.539 5.475 . 0 0 "[ . 1 . 2]" 1
1209 2 104 LYS QB 2 105 PHE QD 2.900 . 6.300 3.429 2.633 4.617 . 0 0 "[ . 1 . 2]" 1
1210 2 101 LEU HA 2 104 LYS QD 3.400 . 6.000 3.712 1.804 4.554 . 0 0 "[ . 1 . 2]" 1
1211 2 104 LYS QD 2 105 PHE QE 3.400 . 8.000 4.335 2.649 5.491 . 0 0 "[ . 1 . 2]" 1
1212 2 104 LYS QE 2 105 PHE QE 2.900 . 6.300 3.907 2.106 5.274 . 0 0 "[ . 1 . 2]" 1
1213 2 104 LYS QG 2 105 PHE QE 3.900 . 9.000 4.595 2.464 5.438 . 0 0 "[ . 1 . 2]" 1
1214 2 49 TYR HB2 2 105 PHE HB3 3.400 . 5.000 3.320 2.606 4.679 . 0 0 "[ . 1 . 2]" 1
1215 2 49 TYR QD 2 105 PHE HB3 3.900 . 8.000 4.869 4.333 6.077 . 0 0 "[ . 1 . 2]" 1
1216 2 102 LEU HA 2 105 PHE HB3 3.900 . 6.000 5.179 4.558 5.916 . 0 0 "[ . 1 . 2]" 1
1217 2 102 LEU MD2 2 105 PHE HB3 3.900 . 7.500 5.178 4.634 5.813 . 0 0 "[ . 1 . 2]" 1
1218 2 49 TYR QD 2 105 PHE HB2 3.900 . 8.000 4.067 3.571 5.445 . 0 0 "[ . 1 . 2]" 1
1219 2 31 GLU HA 2 105 PHE QD 3.400 . 7.000 4.137 3.333 4.931 . 0 0 "[ . 1 . 2]" 1
1220 2 49 TYR QD 2 105 PHE QD 3.400 . 9.000 2.694 2.179 3.811 . 0 0 "[ . 1 . 2]" 1
1221 2 101 LEU HB3 2 105 PHE QD 3.900 . 8.000 3.584 3.031 5.077 . 0 0 "[ . 1 . 2]" 1
1222 2 101 LEU HB2 2 105 PHE QD 3.900 . 8.000 5.100 4.624 6.531 . 0 0 "[ . 1 . 2]" 1
1223 2 101 LEU MD2 2 105 PHE QD 3.400 . 8.500 3.508 2.751 4.990 . 0 0 "[ . 1 . 2]" 1
1224 2 49 TYR HB2 2 105 PHE QE 3.900 . 8.000 3.986 2.745 4.606 . 0 0 "[ . 1 . 2]" 1
1225 2 104 LYS QB 2 105 PHE QE 3.900 . 9.000 3.747 3.095 5.128 . 0 0 "[ . 1 . 2]" 1
1226 2 3 MET QB 2 4 ALA H 3.900 . 7.000 3.011 1.768 4.021 0.032 1 0 "[ . 1 . 2]" 1
1227 2 4 ALA MB 2 5 THR H 3.900 . 7.500 2.817 1.644 3.709 0.156 3 0 "[ . 1 . 2]" 1
1228 2 7 SER HA 2 8 GLU H 2.400 . 2.900 2.567 2.141 3.396 0.496 11 0 "[ . 1 . 2]" 1
1229 2 7 SER QB 2 8 GLU H 3.400 . 6.000 3.458 1.698 4.014 0.102 12 0 "[ . 1 . 2]" 1
1230 2 7 SER H 2 8 GLU H 3.900 . 6.000 3.278 1.794 4.512 0.006 11 0 "[ . 1 . 2]" 1
1231 2 8 GLU H 2 9 GLU H 3.400 . 5.000 2.708 1.749 4.534 0.051 8 0 "[ . 1 . 2]" 1
1232 2 8 GLU H 2 10 VAL MG2 3.900 . 7.500 5.543 4.212 6.266 . 0 0 "[ . 1 . 2]" 1
1233 2 8 GLU H 2 29 MET HA 3.900 . 6.000 6.040 5.669 6.182 0.182 8 0 "[ . 1 . 2]" 1
1234 2 8 GLU H 2 29 MET HB3 3.900 . 6.000 4.048 3.760 4.690 . 0 0 "[ . 1 . 2]" 1
1235 2 8 GLU H 2 30 ALA MB 3.900 . 7.500 5.190 4.010 6.222 . 0 0 "[ . 1 . 2]" 1
1236 2 8 GLU HA 2 9 GLU H 2.400 . 2.900 2.909 2.286 3.185 0.285 14 0 "[ . 1 . 2]" 1
1237 2 9 GLU H 2 10 VAL MG2 3.900 . 7.500 4.809 4.332 5.226 . 0 0 "[ . 1 . 2]" 1
1238 2 9 GLU H 2 11 LEU MD2 3.900 . 7.500 5.366 4.938 6.148 . 0 0 "[ . 1 . 2]" 1
1239 2 9 GLU H 2 29 MET HA 3.900 . 6.000 4.715 4.131 6.009 0.009 9 0 "[ . 1 . 2]" 1
1240 2 9 GLU H 2 29 MET HB3 3.900 . 6.000 3.402 2.670 4.621 . 0 0 "[ . 1 . 2]" 1
1241 2 9 GLU H 2 30 ALA MB 3.400 . 6.500 3.988 3.217 5.004 . 0 0 "[ . 1 . 2]" 1
1242 2 9 GLU HA 2 10 VAL H 2.400 . 2.900 2.165 2.086 2.296 . 0 0 "[ . 1 . 2]" 1
1243 2 9 GLU QG 2 10 VAL H 3.400 . 6.000 3.844 2.135 4.951 . 0 0 "[ . 1 . 2]" 1
1244 2 10 VAL H 2 11 LEU HG 3.900 . 6.000 5.225 5.092 5.366 . 0 0 "[ . 1 . 2]" 1
1245 2 10 VAL H 2 11 LEU H 3.400 . 5.000 4.341 4.190 4.437 . 0 0 "[ . 1 . 2]" 1
1246 2 10 VAL H 2 29 MET HA 3.900 . 6.000 4.482 4.212 5.002 . 0 0 "[ . 1 . 2]" 1
1247 2 10 VAL H 2 29 MET HB3 3.900 . 6.000 5.235 4.890 5.607 . 0 0 "[ . 1 . 2]" 1
1248 2 10 VAL H 2 30 ALA H 3.900 . 6.000 5.329 4.999 5.754 . 0 0 "[ . 1 . 2]" 1
1249 2 9 GLU QG 2 11 LEU H 3.900 . 7.000 5.404 3.908 6.380 . 0 0 "[ . 1 . 2]" 1
1250 2 10 VAL HA 2 11 LEU H 2.400 . 2.900 2.120 2.083 2.148 . 0 0 "[ . 1 . 2]" 1
1251 2 10 VAL HB 2 11 LEU H 3.400 . 5.000 4.332 4.216 4.426 . 0 0 "[ . 1 . 2]" 1
1252 2 10 VAL MG2 2 11 LEU H 3.400 . 6.500 4.041 3.878 4.123 . 0 0 "[ . 1 . 2]" 1
1253 2 11 LEU H 2 12 LEU H 2.400 . 2.900 2.248 2.127 2.414 . 0 0 "[ . 1 . 2]" 1
1254 2 11 LEU H 2 28 LEU QB 3.400 . 6.000 3.782 3.652 3.957 . 0 0 "[ . 1 . 2]" 1
1255 2 11 LEU H 2 29 MET HA 3.400 . 5.000 2.600 2.396 2.796 . 0 0 "[ . 1 . 2]" 1
1256 2 11 LEU H 2 29 MET HB3 3.400 . 5.000 4.990 4.639 5.075 0.075 8 0 "[ . 1 . 2]" 1
1257 2 11 LEU H 2 30 ALA H 3.900 . 6.000 4.184 4.043 4.399 . 0 0 "[ . 1 . 2]" 1
1258 2 10 VAL HA 2 12 LEU H 2.900 . 3.500 3.610 3.558 3.670 0.170 9 0 "[ . 1 . 2]" 1
1259 2 10 VAL HB 2 12 LEU H 3.400 . 5.000 4.950 4.823 5.023 0.023 6 0 "[ . 1 . 2]" 1
1260 2 10 VAL MG1 2 12 LEU H 2.400 . 4.400 2.576 2.370 2.677 . 0 0 "[ . 1 . 2]" 1
1261 2 10 VAL MG2 2 12 LEU H 3.400 . 6.500 4.663 4.431 4.780 . 0 0 "[ . 1 . 2]" 1
1262 2 10 VAL H 2 12 LEU H 3.900 . 6.000 5.921 5.753 6.007 0.007 19 0 "[ . 1 . 2]" 1
1263 2 12 LEU H 2 13 ILE HA 3.400 . 5.000 4.816 4.750 4.890 . 0 0 "[ . 1 . 2]" 1
1264 2 12 LEU H 2 13 ILE QG 3.900 . 7.000 4.225 4.151 4.334 . 0 0 "[ . 1 . 2]" 1
1265 2 12 LEU H 2 13 ILE H 3.400 . 5.000 4.290 4.218 4.362 . 0 0 "[ . 1 . 2]" 1
1266 2 12 LEU H 2 27 TYR HA 3.400 . 5.000 4.620 4.416 4.767 . 0 0 "[ . 1 . 2]" 1
1267 2 12 LEU H 2 28 LEU QB 2.400 . 3.900 2.776 2.668 2.921 . 0 0 "[ . 1 . 2]" 1
1268 2 12 LEU H 2 28 LEU H 3.400 . 5.000 3.015 2.895 3.133 . 0 0 "[ . 1 . 2]" 1
1269 2 12 LEU H 2 29 MET HA 3.400 . 5.000 4.384 4.143 4.590 . 0 0 "[ . 1 . 2]" 1
1270 2 12 LEU H 2 29 MET QG 3.900 . 7.000 5.314 4.804 5.670 . 0 0 "[ . 1 . 2]" 1
1271 2 12 LEU H 2 29 MET H 3.900 . 6.000 5.291 5.180 5.345 . 0 0 "[ . 1 . 2]" 1
1272 2 12 LEU HA 2 13 ILE H 2.400 . 2.900 2.148 2.127 2.170 . 0 0 "[ . 1 . 2]" 1
1273 2 12 LEU HB2 2 13 ILE H 3.400 . 5.000 4.210 4.111 4.314 . 0 0 "[ . 1 . 2]" 1
1274 2 12 LEU MD1 2 13 ILE H 2.400 . 4.400 3.179 3.005 3.364 . 0 0 "[ . 1 . 2]" 1
1275 2 13 ILE H 2 14 VAL H 3.400 . 5.000 4.278 4.185 4.336 . 0 0 "[ . 1 . 2]" 1
1276 2 13 ILE H 2 27 TYR HA 3.900 . 6.000 4.937 4.854 5.018 . 0 0 "[ . 1 . 2]" 1
1277 2 13 ILE HA 2 14 VAL H 2.400 . 2.900 2.119 2.104 2.155 . 0 0 "[ . 1 . 2]" 1
1278 2 13 ILE QG 2 14 VAL H 3.400 . 6.000 4.185 4.146 4.240 . 0 0 "[ . 1 . 2]" 1
1279 2 13 ILE MG 2 14 VAL H 2.400 . 4.400 2.719 2.637 2.833 . 0 0 "[ . 1 . 2]" 1
1280 2 14 VAL H 2 15 LYS H 3.400 . 5.000 4.460 4.446 4.490 . 0 0 "[ . 1 . 2]" 1
1281 2 14 VAL H 2 17 VAL MG2 3.400 . 6.500 5.004 4.737 5.156 . 0 0 "[ . 1 . 2]" 1
1282 2 14 VAL H 2 25 ALA HA 3.400 . 5.000 5.059 4.936 5.096 0.096 14 0 "[ . 1 . 2]" 1
1283 2 14 VAL H 2 26 LEU H 3.400 . 5.000 3.346 3.211 3.486 . 0 0 "[ . 1 . 2]" 1
1284 2 14 VAL H 2 27 TYR HA 3.400 . 5.000 3.218 3.065 3.360 . 0 0 "[ . 1 . 2]" 1
1285 2 14 VAL H 2 27 TYR HB2 3.900 . 6.000 5.746 5.653 5.858 . 0 0 "[ . 1 . 2]" 1
1286 2 14 VAL H 2 27 TYR QE 3.900 . 8.000 4.976 4.814 5.194 . 0 0 "[ . 1 . 2]" 1
1287 2 14 VAL H 2 27 TYR H 3.900 . 6.000 4.668 4.610 4.739 . 0 0 "[ . 1 . 2]" 1
1288 2 13 ILE MG 2 15 LYS H 3.400 . 6.500 4.576 4.495 4.641 . 0 0 "[ . 1 . 2]" 1
1289 2 14 VAL HA 2 15 LYS H 2.400 . 2.900 2.266 2.236 2.286 . 0 0 "[ . 1 . 2]" 1
1290 2 14 VAL HB 2 15 LYS H 2.900 . 3.500 3.607 3.571 3.633 0.133 17 0 "[ . 1 . 2]" 1
1291 2 14 VAL MG1 2 15 LYS H 2.400 . 4.400 2.096 2.044 2.159 . 0 0 "[ . 1 . 2]" 1
1292 2 14 VAL MG2 2 15 LYS H 3.400 . 6.500 4.035 4.008 4.082 . 0 0 "[ . 1 . 2]" 1
1293 2 15 LYS H 2 17 VAL MG2 3.400 . 6.500 3.559 3.466 3.678 . 0 0 "[ . 1 . 2]" 1
1294 2 15 LYS H 2 25 ALA HA 3.900 . 6.000 4.889 4.736 5.085 . 0 0 "[ . 1 . 2]" 1
1295 2 15 LYS H 2 26 LEU H 3.900 . 6.000 4.486 4.367 4.649 . 0 0 "[ . 1 . 2]" 1
1296 2 13 ILE MG 2 16 LYS H 3.900 . 7.500 6.279 6.231 6.332 . 0 0 "[ . 1 . 2]" 1
1297 2 15 LYS HA 2 16 LYS H 2.400 . 2.900 2.492 2.440 2.562 . 0 0 "[ . 1 . 2]" 1
1298 2 15 LYS HB3 2 16 LYS H 2.900 . 3.500 2.026 1.929 2.168 . 0 0 "[ . 1 . 2]" 1
1299 2 15 LYS HB2 2 16 LYS H 2.900 . 3.500 3.348 3.065 3.576 0.076 15 0 "[ . 1 . 2]" 1
1300 2 15 LYS QG 2 16 LYS H 2.400 . 3.900 3.498 3.289 3.653 . 0 0 "[ . 1 . 2]" 1
1301 2 16 LYS H 2 17 VAL MG2 3.400 . 6.500 4.465 4.365 4.541 . 0 0 "[ . 1 . 2]" 1
1302 2 16 LYS H 2 17 VAL H 2.900 . 3.500 3.528 3.443 3.614 0.114 15 0 "[ . 1 . 2]" 1
1303 2 16 LYS H 2 24 GLY H 3.900 . 6.000 5.150 4.879 5.442 . 0 0 "[ . 1 . 2]" 1
1304 2 16 LYS H 2 25 ALA HA 3.400 . 5.000 3.888 3.704 4.062 . 0 0 "[ . 1 . 2]" 1
1305 2 16 LYS H 2 26 LEU H 3.900 . 6.000 5.429 5.299 5.594 . 0 0 "[ . 1 . 2]" 1
1306 2 15 LYS HA 2 17 VAL H 3.400 . 5.000 4.295 4.052 4.540 . 0 0 "[ . 1 . 2]" 1
1307 2 16 LYS HA 2 17 VAL H 2.400 . 2.900 2.365 2.246 2.487 . 0 0 "[ . 1 . 2]" 1
1308 2 16 LYS HB3 2 17 VAL H 3.400 . 5.000 4.188 4.089 4.268 . 0 0 "[ . 1 . 2]" 1
1309 2 16 LYS HB2 2 17 VAL H 3.900 . 6.000 4.523 4.488 4.549 . 0 0 "[ . 1 . 2]" 1
1310 2 16 LYS QG 2 17 VAL H 3.400 . 6.000 4.383 4.177 4.559 . 0 0 "[ . 1 . 2]" 1
1311 2 17 VAL H 2 24 GLY QA 3.900 . 7.000 3.878 3.685 4.061 . 0 0 "[ . 1 . 2]" 1
1312 2 17 VAL H 2 24 GLY H 3.400 . 5.000 2.574 2.326 2.885 . 0 0 "[ . 1 . 2]" 1
1313 2 17 VAL H 2 25 ALA HA 3.400 . 5.000 3.225 3.021 3.382 . 0 0 "[ . 1 . 2]" 1
1314 2 17 VAL H 2 25 ALA MB 3.400 . 6.500 4.464 4.274 4.599 . 0 0 "[ . 1 . 2]" 1
1315 2 17 VAL H 2 26 LEU HB2 3.900 . 6.000 5.379 5.214 5.531 . 0 0 "[ . 1 . 2]" 1
1316 2 17 VAL H 2 26 LEU H 3.400 . 5.000 4.536 4.359 4.699 . 0 0 "[ . 1 . 2]" 1
1317 2 17 VAL H 2 35 TRP HD1 3.900 . 6.000 4.984 4.811 5.110 . 0 0 "[ . 1 . 2]" 1
1318 2 17 VAL H 2 35 TRP HE1 3.400 . 5.000 3.206 3.096 3.360 . 0 0 "[ . 1 . 2]" 1
1319 2 17 VAL H 2 83 ASN HB2 3.900 . 6.000 5.200 4.993 5.493 . 0 0 "[ . 1 . 2]" 1
1320 2 17 VAL HA 2 18 ARG H 2.400 . 2.900 2.152 2.124 2.192 . 0 0 "[ . 1 . 2]" 1
1321 2 17 VAL HB 2 18 ARG H 3.400 . 5.000 4.328 4.268 4.381 . 0 0 "[ . 1 . 2]" 1
1322 2 17 VAL MG1 2 18 ARG H 2.400 . 4.400 2.773 2.622 2.893 . 0 0 "[ . 1 . 2]" 1
1323 2 17 VAL H 2 18 ARG H 3.900 . 6.000 4.275 4.204 4.353 . 0 0 "[ . 1 . 2]" 1
1324 2 18 ARG H 2 19 GLN H 3.900 . 6.000 4.453 4.369 4.529 . 0 0 "[ . 1 . 2]" 1
1325 2 18 ARG H 2 24 GLY H 3.900 . 6.000 4.614 4.517 4.778 . 0 0 "[ . 1 . 2]" 1
1326 2 18 ARG H 2 79 PHE HA 3.900 . 6.000 4.710 4.319 5.134 . 0 0 "[ . 1 . 2]" 1
1327 2 18 ARG H 2 79 PHE HB3 3.900 . 6.000 5.160 4.738 5.498 . 0 0 "[ . 1 . 2]" 1
1328 2 18 ARG H 2 80 HIS HB2 3.400 . 5.000 4.133 3.015 4.659 . 0 0 "[ . 1 . 2]" 1
1329 2 18 ARG H 2 80 HIS H 3.400 . 5.000 3.138 2.626 3.482 . 0 0 "[ . 1 . 2]" 1
1330 2 18 ARG H 2 81 PHE HA 3.400 . 5.000 3.886 3.660 4.306 . 0 0 "[ . 1 . 2]" 1
1331 2 18 ARG H 2 82 SER HB3 3.900 . 6.000 4.693 4.303 5.155 . 0 0 "[ . 1 . 2]" 1
1332 2 19 GLN QE 2 20 LYS QB 3.900 . 8.000 3.430 2.084 5.057 . 0 0 "[ . 1 . 2]" 1
1333 2 19 GLN QE 2 20 LYS QE 3.900 . 8.000 4.153 2.381 5.382 . 0 0 "[ . 1 . 2]" 1
1334 2 19 GLN QE 2 20 LYS QG 3.900 . 8.000 4.121 1.694 6.066 0.106 9 0 "[ . 1 . 2]" 1
1335 2 19 GLN QE 2 20 LYS H 3.900 . 7.000 3.649 2.274 4.679 . 0 0 "[ . 1 . 2]" 1
1336 2 19 GLN QE 2 35 TRP HZ3 3.900 . 7.000 5.078 2.749 6.318 . 0 0 "[ . 1 . 2]" 1
1337 2 19 GLN QE 2 45 ILE MD 3.400 . 7.500 3.183 1.783 4.037 0.017 14 0 "[ . 1 . 2]" 1
1338 2 19 GLN QE 2 78 ASN H 3.900 . 7.000 3.847 2.254 6.257 . 0 0 "[ . 1 . 2]" 1
1339 2 18 ARG HA 2 19 GLN H 2.400 . 2.900 2.134 2.090 2.192 . 0 0 "[ . 1 . 2]" 1
1340 2 18 ARG HB2 2 19 GLN H 3.400 . 5.000 4.086 3.558 4.431 . 0 0 "[ . 1 . 2]" 1
1341 2 18 ARG QD 2 19 GLN H 3.900 . 7.000 5.354 4.793 5.817 . 0 0 "[ . 1 . 2]" 1
1342 2 19 GLN H 2 20 LYS H 3.900 . 6.000 4.040 3.876 4.293 . 0 0 "[ . 1 . 2]" 1
1343 2 19 GLN H 2 21 LYS HA 3.900 . 6.000 5.302 4.835 5.762 . 0 0 "[ . 1 . 2]" 1
1344 2 19 GLN H 2 22 GLN QB 3.400 . 6.000 3.387 2.750 4.344 . 0 0 "[ . 1 . 2]" 1
1345 2 19 GLN H 2 22 GLN QG 3.400 . 6.000 3.806 2.303 4.915 . 0 0 "[ . 1 . 2]" 1
1346 2 19 GLN H 2 22 GLN H 2.400 . 2.900 2.734 2.456 2.907 0.007 13 0 "[ . 1 . 2]" 1
1347 2 19 GLN H 2 23 ASP HA 3.400 . 5.000 3.846 3.621 4.244 . 0 0 "[ . 1 . 2]" 1
1348 2 19 GLN H 2 23 ASP H 3.400 . 5.000 4.809 4.685 4.915 . 0 0 "[ . 1 . 2]" 1
1349 2 19 GLN H 2 24 GLY QA 3.900 . 7.000 5.205 4.812 5.607 . 0 0 "[ . 1 . 2]" 1
1350 2 19 GLN H 2 35 TRP HE1 3.400 . 5.000 4.660 4.295 4.957 . 0 0 "[ . 1 . 2]" 1
1351 2 19 GLN H 2 35 TRP HH2 3.900 . 6.000 3.257 2.987 3.487 . 0 0 "[ . 1 . 2]" 1
1352 2 19 GLN H 2 79 PHE QE 3.900 . 8.000 5.693 5.305 6.044 . 0 0 "[ . 1 . 2]" 1
1353 2 19 GLN HA 2 20 LYS H 2.400 . 2.900 2.137 2.086 2.172 . 0 0 "[ . 1 . 2]" 1
1354 2 19 GLN QB 2 20 LYS H 3.400 . 6.000 3.877 3.752 3.966 . 0 0 "[ . 1 . 2]" 1
1355 2 20 LYS H 2 21 LYS H 3.400 . 5.000 2.654 2.377 2.974 . 0 0 "[ . 1 . 2]" 1
1356 2 20 LYS H 2 22 GLN H 3.900 . 6.000 3.904 3.743 4.061 . 0 0 "[ . 1 . 2]" 1
1357 2 20 LYS H 2 79 PHE HA 3.900 . 6.000 4.710 4.087 5.252 . 0 0 "[ . 1 . 2]" 1
1358 2 18 ARG HB2 2 21 LYS H 3.900 . 6.000 4.406 3.409 5.140 . 0 0 "[ . 1 . 2]" 1
1359 2 19 GLN HA 2 21 LYS H 3.900 . 6.000 4.093 3.530 4.587 . 0 0 "[ . 1 . 2]" 1
1360 2 19 GLN H 2 21 LYS H 3.900 . 6.000 4.319 3.906 4.707 . 0 0 "[ . 1 . 2]" 1
1361 2 21 LYS H 2 22 GLN QB 3.900 . 7.000 4.758 4.448 5.301 . 0 0 "[ . 1 . 2]" 1
1362 2 21 LYS H 2 22 GLN QG 3.900 . 7.000 5.595 4.091 6.371 . 0 0 "[ . 1 . 2]" 1
1363 2 21 LYS H 2 22 GLN H 3.900 . 6.000 2.631 2.504 2.774 . 0 0 "[ . 1 . 2]" 1
1364 2 20 LYS QB 2 22 GLN QE 3.400 . 7.000 3.634 2.021 5.063 . 0 0 "[ . 1 . 2]" 1
1365 2 20 LYS QG 2 22 GLN QE 3.900 . 8.000 5.145 3.151 6.283 . 0 0 "[ . 1 . 2]" 1
1366 2 22 GLN QE 2 23 ASP H 3.900 . 7.000 5.450 3.884 6.222 . 0 0 "[ . 1 . 2]" 1
1367 2 22 GLN QE 2 37 PRO QG 3.900 . 8.000 4.360 2.661 5.701 . 0 0 "[ . 1 . 2]" 1
1368 2 18 ARG HA 2 22 GLN H 3.400 . 5.000 3.740 3.571 3.901 . 0 0 "[ . 1 . 2]" 1
1369 2 18 ARG HB3 2 22 GLN H 3.400 . 5.000 2.949 2.459 3.304 . 0 0 "[ . 1 . 2]" 1
1370 2 18 ARG HB2 2 22 GLN H 3.400 . 5.000 4.454 3.710 4.944 . 0 0 "[ . 1 . 2]" 1
1371 2 18 ARG QD 2 22 GLN H 3.900 . 7.000 4.879 4.011 5.707 . 0 0 "[ . 1 . 2]" 1
1372 2 18 ARG H 2 22 GLN H 3.900 . 6.000 6.023 5.691 6.101 0.101 13 0 "[ . 1 . 2]" 1
1373 2 19 GLN HA 2 22 GLN H 3.900 . 6.000 4.278 4.085 4.535 . 0 0 "[ . 1 . 2]" 1
1374 2 19 GLN QB 2 22 GLN H 3.900 . 7.000 4.290 4.059 4.670 . 0 0 "[ . 1 . 2]" 1
1375 2 21 LYS HA 2 22 GLN H 3.400 . 5.000 3.045 2.925 3.231 . 0 0 "[ . 1 . 2]" 1
1376 2 21 LYS QB 2 22 GLN H 3.400 . 6.000 3.735 3.583 3.830 . 0 0 "[ . 1 . 2]" 1
1377 2 21 LYS QG 2 22 GLN H 3.400 . 6.000 4.807 4.509 4.967 . 0 0 "[ . 1 . 2]" 1
1378 2 22 GLN H 2 35 TRP HH2 3.400 . 5.000 4.562 4.199 4.850 . 0 0 "[ . 1 . 2]" 1
1379 2 18 ARG HA 2 23 ASP H 3.900 . 6.000 4.128 3.849 4.363 . 0 0 "[ . 1 . 2]" 1
1380 2 18 ARG QG 2 23 ASP H 3.400 . 6.000 3.408 2.732 4.654 . 0 0 "[ . 1 . 2]" 1
1381 2 22 GLN HA 2 23 ASP H 2.400 . 2.900 2.151 2.104 2.178 . 0 0 "[ . 1 . 2]" 1
1382 2 22 GLN QB 2 23 ASP H 3.400 . 6.000 3.568 3.024 3.857 . 0 0 "[ . 1 . 2]" 1
1383 2 23 ASP H 2 35 TRP HH2 3.900 . 6.000 4.946 4.452 5.300 . 0 0 "[ . 1 . 2]" 1
1384 2 23 ASP H 2 35 TRP HZ2 3.400 . 5.000 4.683 4.445 4.942 . 0 0 "[ . 1 . 2]" 1
1385 2 23 ASP H 2 37 PRO QB 3.900 . 7.000 4.913 4.092 5.904 . 0 0 "[ . 1 . 2]" 1
1386 2 17 VAL MG1 2 24 GLY H 3.400 . 6.500 4.526 4.416 4.701 . 0 0 "[ . 1 . 2]" 1
1387 2 18 ARG HA 2 24 GLY H 3.400 . 5.000 3.429 3.259 3.625 . 0 0 "[ . 1 . 2]" 1
1388 2 18 ARG QG 2 24 GLY H 3.400 . 6.000 3.779 3.403 4.071 . 0 0 "[ . 1 . 2]" 1
1389 2 19 GLN H 2 24 GLY H 3.400 . 5.000 4.951 4.716 5.068 0.068 15 0 "[ . 1 . 2]" 1
1390 2 23 ASP HA 2 24 GLY H 2.400 . 2.900 2.270 2.225 2.308 . 0 0 "[ . 1 . 2]" 1
1391 2 23 ASP QB 2 24 GLY H 2.900 . 4.500 3.108 2.643 3.479 . 0 0 "[ . 1 . 2]" 1
1392 2 23 ASP H 2 24 GLY H 3.400 . 5.000 4.620 4.587 4.650 . 0 0 "[ . 1 . 2]" 1
1393 2 24 GLY H 2 25 ALA HA 3.900 . 6.000 4.644 4.552 4.752 . 0 0 "[ . 1 . 2]" 1
1394 2 24 GLY H 2 25 ALA MB 3.900 . 7.500 5.134 5.044 5.214 . 0 0 "[ . 1 . 2]" 1
1395 2 24 GLY H 2 35 TRP HE1 3.400 . 5.000 3.394 3.195 3.628 . 0 0 "[ . 1 . 2]" 1
1396 2 24 GLY H 2 35 TRP HH2 3.900 . 6.000 5.227 5.060 5.401 . 0 0 "[ . 1 . 2]" 1
1397 2 24 GLY H 2 38 GLU QB 3.400 . 6.000 4.171 3.716 4.959 . 0 0 "[ . 1 . 2]" 1
1398 2 24 GLY H 2 38 GLU QG 3.900 . 7.000 4.857 3.399 5.886 . 0 0 "[ . 1 . 2]" 1
1399 2 15 LYS HA 2 25 ALA H 3.900 . 6.000 5.449 5.288 5.717 . 0 0 "[ . 1 . 2]" 1
1400 2 17 VAL HB 2 25 ALA H 3.900 . 6.000 4.823 4.560 4.957 . 0 0 "[ . 1 . 2]" 1
1401 2 17 VAL MG1 2 25 ALA H 3.900 . 7.500 5.527 5.428 5.615 . 0 0 "[ . 1 . 2]" 1
1402 2 24 GLY QA 2 25 ALA H 2.400 . 3.900 2.224 2.169 2.279 . 0 0 "[ . 1 . 2]" 1
1403 2 25 ALA H 2 26 LEU HA 3.900 . 6.000 4.801 4.754 4.865 . 0 0 "[ . 1 . 2]" 1
1404 2 25 ALA H 2 26 LEU MD1 3.900 . 7.500 6.143 6.100 6.180 . 0 0 "[ . 1 . 2]" 1
1405 2 25 ALA H 2 26 LEU H 3.400 . 5.000 4.356 4.314 4.395 . 0 0 "[ . 1 . 2]" 1
1406 2 25 ALA H 2 27 TYR QE 3.900 . 8.000 4.105 3.881 4.425 . 0 0 "[ . 1 . 2]" 1
1407 2 25 ALA H 2 35 TRP HA 3.400 . 5.000 4.973 4.868 5.088 0.088 10 0 "[ . 1 . 2]" 1
1408 2 25 ALA H 2 35 TRP HD1 3.900 . 6.000 4.347 4.213 4.482 . 0 0 "[ . 1 . 2]" 1
1409 2 25 ALA H 2 35 TRP HE1 3.400 . 5.000 3.613 3.479 3.747 . 0 0 "[ . 1 . 2]" 1
1410 2 25 ALA H 2 36 ALA MB 3.400 . 6.500 3.711 3.445 4.013 . 0 0 "[ . 1 . 2]" 1
1411 2 25 ALA H 2 36 ALA H 3.400 . 5.000 3.238 3.125 3.467 . 0 0 "[ . 1 . 2]" 1
1412 2 25 ALA H 2 38 GLU QB 3.400 . 6.000 5.071 4.578 5.411 . 0 0 "[ . 1 . 2]" 1
1413 2 25 ALA H 2 38 GLU QG 3.900 . 7.000 4.906 3.575 6.487 . 0 0 "[ . 1 . 2]" 1
1414 2 25 ALA H 2 38 GLU H 3.400 . 5.000 4.286 3.779 4.586 . 0 0 "[ . 1 . 2]" 1
1415 2 15 LYS HA 2 26 LEU H 3.400 . 5.000 3.621 3.468 3.830 . 0 0 "[ . 1 . 2]" 1
1416 2 17 VAL HB 2 26 LEU H 3.400 . 5.000 3.300 3.182 3.409 . 0 0 "[ . 1 . 2]" 1
1417 2 17 VAL MG2 2 26 LEU H 3.400 . 6.500 3.336 2.921 3.489 . 0 0 "[ . 1 . 2]" 1
1418 2 25 ALA HA 2 26 LEU H 2.400 . 2.900 2.169 2.139 2.198 . 0 0 "[ . 1 . 2]" 1
1419 2 25 ALA MB 2 26 LEU H 2.400 . 4.400 2.908 2.842 3.003 . 0 0 "[ . 1 . 2]" 1
1420 2 26 LEU H 2 27 TYR QD 3.900 . 8.000 4.799 4.276 5.059 . 0 0 "[ . 1 . 2]" 1
1421 2 26 LEU H 2 27 TYR H 3.900 . 6.000 4.533 4.495 4.551 . 0 0 "[ . 1 . 2]" 1
1422 2 26 LEU H 2 35 TRP HA 3.900 . 6.000 4.869 4.754 4.941 . 0 0 "[ . 1 . 2]" 1
1423 2 26 LEU H 2 35 TRP HD1 3.900 . 6.000 3.138 3.033 3.279 . 0 0 "[ . 1 . 2]" 1
1424 2 26 LEU HA 2 27 TYR H 2.400 . 2.900 2.229 2.195 2.271 . 0 0 "[ . 1 . 2]" 1
1425 2 26 LEU HB3 2 27 TYR H 3.400 . 5.000 4.067 4.009 4.181 . 0 0 "[ . 1 . 2]" 1
1426 2 26 LEU HB2 2 27 TYR H 3.400 . 5.000 4.115 4.056 4.243 . 0 0 "[ . 1 . 2]" 1
1427 2 26 LEU MD1 2 27 TYR H 2.400 . 4.400 2.989 2.850 3.213 . 0 0 "[ . 1 . 2]" 1
1428 2 26 LEU MD2 2 27 TYR H 3.400 . 6.500 4.067 3.949 4.259 . 0 0 "[ . 1 . 2]" 1
1429 2 26 LEU HG 2 27 TYR H 3.400 . 5.000 2.408 2.255 2.666 . 0 0 "[ . 1 . 2]" 1
1430 2 27 TYR H 2 29 MET ME 3.900 . 7.500 4.687 4.148 5.276 . 0 0 "[ . 1 . 2]" 1
1431 2 27 TYR H 2 33 ILE HA 3.900 . 6.000 5.254 5.059 5.423 . 0 0 "[ . 1 . 2]" 1
1432 2 27 TYR H 2 34 ALA H 3.400 . 5.000 3.613 3.496 3.737 . 0 0 "[ . 1 . 2]" 1
1433 2 27 TYR H 2 35 TRP HA 3.400 . 5.000 2.712 2.482 2.841 . 0 0 "[ . 1 . 2]" 1
1434 2 27 TYR H 2 35 TRP HB3 3.900 . 6.000 4.868 4.816 4.943 . 0 0 "[ . 1 . 2]" 1
1435 2 27 TYR H 2 35 TRP HB2 3.900 . 6.000 3.482 3.389 3.590 . 0 0 "[ . 1 . 2]" 1
1436 2 27 TYR H 2 35 TRP HD1 3.400 . 5.000 4.288 4.194 4.403 . 0 0 "[ . 1 . 2]" 1
1437 2 27 TYR H 2 36 ALA H 3.900 . 6.000 4.488 4.110 4.691 . 0 0 "[ . 1 . 2]" 1
1438 2 27 TYR H 2 79 PHE QE 3.900 . 8.000 5.961 5.789 6.102 . 0 0 "[ . 1 . 2]" 1
1439 2 12 LEU HA 2 28 LEU H 3.900 . 6.000 4.637 4.576 4.699 . 0 0 "[ . 1 . 2]" 1
1440 2 12 LEU HB2 2 28 LEU H 3.400 . 5.000 4.546 4.378 4.684 . 0 0 "[ . 1 . 2]" 1
1441 2 13 ILE HA 2 28 LEU H 3.400 . 5.000 3.646 3.548 3.732 . 0 0 "[ . 1 . 2]" 1
1442 2 13 ILE QG 2 28 LEU H 3.400 . 6.000 4.449 4.230 4.676 . 0 0 "[ . 1 . 2]" 1
1443 2 13 ILE H 2 28 LEU H 3.900 . 6.000 4.877 4.819 4.919 . 0 0 "[ . 1 . 2]" 1
1444 2 27 TYR HA 2 28 LEU H 2.400 . 2.900 2.176 2.159 2.196 . 0 0 "[ . 1 . 2]" 1
1445 2 27 TYR HB3 2 28 LEU H 3.400 . 5.000 3.510 3.266 3.711 . 0 0 "[ . 1 . 2]" 1
1446 2 27 TYR QD 2 28 LEU H 3.900 . 8.000 4.577 4.375 4.777 . 0 0 "[ . 1 . 2]" 1
1447 2 27 TYR H 2 28 LEU H 3.400 . 5.000 4.147 4.017 4.328 . 0 0 "[ . 1 . 2]" 1
1448 2 28 LEU H 2 29 MET H 3.900 . 6.000 4.406 4.244 4.529 . 0 0 "[ . 1 . 2]" 1
1449 2 10 VAL HA 2 29 MET H 3.400 . 5.000 4.411 4.085 4.838 . 0 0 "[ . 1 . 2]" 1
1450 2 11 LEU H 2 29 MET H 3.900 . 6.000 4.617 4.566 4.764 . 0 0 "[ . 1 . 2]" 1
1451 2 28 LEU HA 2 29 MET H 2.400 . 2.900 2.132 2.103 2.176 . 0 0 "[ . 1 . 2]" 1
1452 2 28 LEU QB 2 29 MET H 3.400 . 6.000 3.221 2.919 3.440 . 0 0 "[ . 1 . 2]" 1
1453 2 28 LEU MD2 2 29 MET H 3.400 . 6.500 3.819 3.662 3.980 . 0 0 "[ . 1 . 2]" 1
1454 2 29 MET H 2 30 ALA H 3.900 . 6.000 4.501 4.441 4.537 . 0 0 "[ . 1 . 2]" 1
1455 2 29 MET H 2 31 GLU H 3.900 . 6.000 4.858 4.360 5.268 . 0 0 "[ . 1 . 2]" 1
1456 2 29 MET H 2 32 ARG QG 3.900 . 7.000 3.558 3.344 4.006 . 0 0 "[ . 1 . 2]" 1
1457 2 29 MET H 2 32 ARG H 3.400 . 5.000 3.486 3.386 3.619 . 0 0 "[ . 1 . 2]" 1
1458 2 29 MET H 2 33 ILE HA 3.400 . 5.000 2.715 2.532 2.857 . 0 0 "[ . 1 . 2]" 1
1459 2 29 MET H 2 34 ALA H 3.400 . 5.000 3.520 3.200 3.761 . 0 0 "[ . 1 . 2]" 1
1460 2 10 VAL MG2 2 30 ALA H 3.900 . 7.500 5.306 5.091 5.609 . 0 0 "[ . 1 . 2]" 1
1461 2 11 LEU MD1 2 30 ALA H 3.400 . 6.500 3.542 3.270 3.961 . 0 0 "[ . 1 . 2]" 1
1462 2 11 LEU HG 2 30 ALA H 3.400 . 5.000 3.096 2.938 3.526 . 0 0 "[ . 1 . 2]" 1
1463 2 29 MET HA 2 30 ALA H 2.400 . 2.900 2.397 2.336 2.483 . 0 0 "[ . 1 . 2]" 1
1464 2 29 MET HB3 2 30 ALA H 2.400 . 2.900 2.382 2.102 2.618 . 0 0 "[ . 1 . 2]" 1
1465 2 29 MET HB2 2 30 ALA H 2.900 . 3.500 3.528 3.118 3.598 0.098 19 0 "[ . 1 . 2]" 1
1466 2 29 MET QG 2 30 ALA H 3.400 . 6.000 3.803 3.114 4.245 . 0 0 "[ . 1 . 2]" 1
1467 2 30 ALA H 2 31 GLU H 3.400 . 5.000 2.903 2.642 3.176 . 0 0 "[ . 1 . 2]" 1
1468 2 30 ALA H 2 32 ARG H 3.400 . 5.000 4.080 3.975 4.202 . 0 0 "[ . 1 . 2]" 1
1469 2 29 MET HA 2 31 GLU H 3.900 . 6.000 4.437 4.054 4.914 . 0 0 "[ . 1 . 2]" 1
1470 2 29 MET HB3 2 31 GLU H 3.400 . 5.000 3.079 2.670 3.976 . 0 0 "[ . 1 . 2]" 1
1471 2 30 ALA MB 2 31 GLU H 2.400 . 4.400 2.705 2.325 3.190 . 0 0 "[ . 1 . 2]" 1
1472 2 31 GLU H 2 32 ARG HA 3.900 . 6.000 4.849 4.616 5.012 . 0 0 "[ . 1 . 2]" 1
1473 2 31 GLU H 2 32 ARG QG 3.900 . 7.000 4.029 3.486 4.987 . 0 0 "[ . 1 . 2]" 1
1474 2 31 GLU H 2 32 ARG H 2.400 . 2.900 2.217 1.902 2.410 . 0 0 "[ . 1 . 2]" 1
1475 2 31 GLU H 2 105 PHE HZ 3.900 . 6.000 5.110 4.076 5.676 . 0 0 "[ . 1 . 2]" 1
1476 2 29 MET HA 2 32 ARG H 3.900 . 6.000 4.485 4.387 4.643 . 0 0 "[ . 1 . 2]" 1
1477 2 29 MET HB3 2 32 ARG H 3.400 . 5.000 3.520 3.339 4.085 . 0 0 "[ . 1 . 2]" 1
1478 2 29 MET HB2 2 32 ARG H 2.900 . 3.500 2.505 2.243 3.205 . 0 0 "[ . 1 . 2]" 1
1479 2 31 GLU HA 2 32 ARG H 3.400 . 5.000 3.356 3.172 3.501 . 0 0 "[ . 1 . 2]" 1
1480 2 31 GLU HB2 2 32 ARG H 3.400 . 5.000 3.519 3.136 3.845 . 0 0 "[ . 1 . 2]" 1
1481 2 31 GLU QG 2 32 ARG H 3.400 . 6.000 4.414 4.166 4.812 . 0 0 "[ . 1 . 2]" 1
1482 2 32 ARG H 2 33 ILE HA 3.900 . 6.000 4.718 4.699 4.748 . 0 0 "[ . 1 . 2]" 1
1483 2 32 ARG H 2 49 TYR H 3.900 . 6.000 4.728 4.573 4.853 . 0 0 "[ . 1 . 2]" 1
1484 2 32 ARG H 2 105 PHE QE 3.900 . 8.000 5.597 4.278 6.020 . 0 0 "[ . 1 . 2]" 1
1485 2 32 ARG HA 2 33 ILE H 2.400 . 2.900 2.321 2.232 2.429 . 0 0 "[ . 1 . 2]" 1
1486 2 32 ARG QG 2 33 ILE H 3.400 . 6.000 3.270 2.883 3.654 . 0 0 "[ . 1 . 2]" 1
1487 2 33 ILE H 2 46 SER HA 3.400 . 5.000 4.719 4.533 4.844 . 0 0 "[ . 1 . 2]" 1
1488 2 33 ILE H 2 47 HIS HB3 3.400 . 5.000 4.962 4.829 5.054 0.054 18 0 "[ . 1 . 2]" 1
1489 2 33 ILE H 2 47 HIS HB2 3.400 . 5.000 3.724 3.581 4.000 . 0 0 "[ . 1 . 2]" 1
1490 2 33 ILE H 2 47 HIS H 3.400 . 5.000 3.191 3.075 3.343 . 0 0 "[ . 1 . 2]" 1
1491 2 33 ILE H 2 48 MET HA 3.400 . 5.000 3.437 3.165 3.678 . 0 0 "[ . 1 . 2]" 1
1492 2 33 ILE H 2 48 MET H 3.400 . 5.000 4.929 4.816 5.008 0.008 13 0 "[ . 1 . 2]" 1
1493 2 33 ILE H 2 49 TYR QE 3.400 . 7.000 3.446 3.160 3.825 . 0 0 "[ . 1 . 2]" 1
1494 2 33 ILE H 2 49 TYR H 3.400 . 5.000 4.229 4.057 4.334 . 0 0 "[ . 1 . 2]" 1
1495 2 27 TYR HB3 2 34 ALA H 3.900 . 6.000 4.964 4.530 5.204 . 0 0 "[ . 1 . 2]" 1
1496 2 27 TYR HB2 2 34 ALA H 3.400 . 5.000 3.954 3.699 4.188 . 0 0 "[ . 1 . 2]" 1
1497 2 27 TYR QD 2 34 ALA H 3.900 . 8.000 5.287 4.991 5.640 . 0 0 "[ . 1 . 2]" 1
1498 2 28 LEU HA 2 34 ALA H 3.400 . 5.000 2.838 2.600 3.058 . 0 0 "[ . 1 . 2]" 1
1499 2 29 MET ME 2 34 ALA H 3.400 . 6.500 3.768 3.259 4.224 . 0 0 "[ . 1 . 2]" 1
1500 2 33 ILE HA 2 34 ALA H 2.400 . 2.900 2.155 2.141 2.179 . 0 0 "[ . 1 . 2]" 1
1501 2 33 ILE HB 2 34 ALA H 3.400 . 5.000 4.102 3.987 4.237 . 0 0 "[ . 1 . 2]" 1
1502 2 33 ILE QG 2 34 ALA H 2.400 . 3.900 2.828 2.607 2.976 . 0 0 "[ . 1 . 2]" 1
1503 2 34 ALA H 2 43 PHE QD 3.900 . 8.000 5.686 5.221 6.186 . 0 0 "[ . 1 . 2]" 1
1504 2 34 ALA H 2 49 TYR QE 3.900 . 8.000 5.569 5.279 5.885 . 0 0 "[ . 1 . 2]" 1
1505 2 17 VAL HA 2 35 TRP HE1 3.900 . 6.000 4.305 4.194 4.372 . 0 0 "[ . 1 . 2]" 1
1506 2 17 VAL HB 2 35 TRP HE1 2.900 . 3.300 2.185 1.908 2.325 . 0 0 "[ . 1 . 2]" 1
1507 2 17 VAL MG1 2 35 TRP HE1 2.400 . 4.200 2.478 2.397 2.573 . 0 0 "[ . 1 . 2]" 1
1508 2 18 ARG HA 2 35 TRP HE1 3.400 . 5.000 4.151 3.924 4.405 . 0 0 "[ . 1 . 2]" 1
1509 2 24 GLY QA 2 35 TRP HE1 3.400 . 6.000 3.160 2.909 3.369 . 0 0 "[ . 1 . 2]" 1
1510 2 25 ALA HA 2 35 TRP HE1 3.900 . 6.000 3.706 3.575 3.864 . 0 0 "[ . 1 . 2]" 1
1511 2 25 ALA MB 2 35 TRP HE1 3.900 . 7.500 4.777 4.725 4.841 . 0 0 "[ . 1 . 2]" 1
1512 2 26 LEU HA 2 35 TRP HE1 3.900 . 6.000 4.494 4.379 4.594 . 0 0 "[ . 1 . 2]" 1
1513 2 26 LEU HB3 2 35 TRP HE1 3.400 . 5.000 5.120 5.090 5.139 0.139 6 0 "[ . 1 . 2]" 1
1514 2 26 LEU HB2 2 35 TRP HE1 3.900 . 6.000 3.783 3.704 3.838 . 0 0 "[ . 1 . 2]" 1
1515 2 26 LEU MD1 2 35 TRP HE1 3.900 . 7.500 4.554 4.386 4.655 . 0 0 "[ . 1 . 2]" 1
1516 2 26 LEU H 2 35 TRP HE1 3.900 . 6.000 4.212 4.118 4.289 . 0 0 "[ . 1 . 2]" 1
1517 2 35 TRP HE1 2 79 PHE HB3 3.900 . 6.000 5.802 5.502 6.017 0.017 17 0 "[ . 1 . 2]" 1
1518 2 35 TRP HE1 2 79 PHE QE 3.900 . 8.000 4.646 4.445 4.851 . 0 0 "[ . 1 . 2]" 1
1519 2 34 ALA HA 2 35 TRP H 2.400 . 2.900 2.271 2.120 2.304 . 0 0 "[ . 1 . 2]" 1
1520 2 34 ALA MB 2 35 TRP H 2.400 . 4.400 2.655 2.506 3.206 . 0 0 "[ . 1 . 2]" 1
1521 2 34 ALA H 2 35 TRP H 3.900 . 6.000 4.442 4.194 4.486 . 0 0 "[ . 1 . 2]" 1
1522 2 35 TRP H 2 36 ALA H 3.400 . 5.000 4.267 4.183 4.418 . 0 0 "[ . 1 . 2]" 1
1523 2 35 TRP H 2 43 PHE HB2 3.400 . 5.000 4.516 4.209 4.918 . 0 0 "[ . 1 . 2]" 1
1524 2 35 TRP H 2 43 PHE QD 3.900 . 8.000 3.370 2.607 4.010 . 0 0 "[ . 1 . 2]" 1
1525 2 35 TRP H 2 45 ILE HB 3.400 . 5.000 2.309 2.047 2.452 . 0 0 "[ . 1 . 2]" 1
1526 2 35 TRP H 2 45 ILE QG 3.900 . 7.000 4.154 3.872 4.292 . 0 0 "[ . 1 . 2]" 1
1527 2 35 TRP H 2 45 ILE MG 3.400 . 6.500 2.826 2.649 3.038 . 0 0 "[ . 1 . 2]" 1
1528 2 35 TRP H 2 45 ILE H 3.400 . 5.000 3.006 2.788 3.145 . 0 0 "[ . 1 . 2]" 1
1529 2 35 TRP H 2 46 SER HA 3.400 . 5.000 4.087 3.957 4.257 . 0 0 "[ . 1 . 2]" 1
1530 2 35 TRP H 2 47 HIS H 3.900 . 6.000 5.459 5.216 5.571 . 0 0 "[ . 1 . 2]" 1
1531 2 35 TRP H 2 79 PHE QE 3.900 . 8.000 5.069 4.623 5.224 . 0 0 "[ . 1 . 2]" 1
1532 2 17 VAL MG1 2 36 ALA H 3.900 . 7.500 5.987 5.785 6.133 . 0 0 "[ . 1 . 2]" 1
1533 2 25 ALA MB 2 36 ALA H 3.400 . 6.500 3.853 3.701 4.020 . 0 0 "[ . 1 . 2]" 1
1534 2 26 LEU HA 2 36 ALA H 3.400 . 5.000 3.377 3.225 3.520 . 0 0 "[ . 1 . 2]" 1
1535 2 26 LEU MD1 2 36 ALA H 3.400 . 6.500 4.755 4.643 4.823 . 0 0 "[ . 1 . 2]" 1
1536 2 26 LEU H 2 36 ALA H 3.900 . 6.000 4.968 4.842 5.080 . 0 0 "[ . 1 . 2]" 1
1537 2 27 TYR QD 2 36 ALA H 3.400 . 7.000 3.247 2.800 3.655 . 0 0 "[ . 1 . 2]" 1
1538 2 27 TYR QE 2 36 ALA H 3.400 . 7.000 3.282 2.866 4.285 . 0 0 "[ . 1 . 2]" 1
1539 2 35 TRP HA 2 36 ALA H 2.400 . 2.900 2.192 2.138 2.266 . 0 0 "[ . 1 . 2]" 1
1540 2 35 TRP HB3 2 36 ALA H 3.400 . 5.000 4.189 4.073 4.287 . 0 0 "[ . 1 . 2]" 1
1541 2 35 TRP HB2 2 36 ALA H 3.400 . 5.000 4.002 3.948 4.083 . 0 0 "[ . 1 . 2]" 1
1542 2 35 TRP HD1 2 36 ALA H 3.400 . 5.000 3.895 3.743 4.063 . 0 0 "[ . 1 . 2]" 1
1543 2 35 TRP HE1 2 36 ALA H 3.900 . 6.000 4.777 4.578 4.993 . 0 0 "[ . 1 . 2]" 1
1544 2 35 TRP HE3 2 36 ALA H 3.900 . 6.000 4.425 4.096 4.750 . 0 0 "[ . 1 . 2]" 1
1545 2 36 ALA H 2 37 PRO QD 3.400 . 6.000 4.239 4.142 4.316 . 0 0 "[ . 1 . 2]" 1
1546 2 36 ALA H 2 43 PHE HA 3.900 . 6.000 4.426 4.155 4.851 . 0 0 "[ . 1 . 2]" 1
1547 2 36 ALA H 2 43 PHE QD 3.400 . 7.000 3.306 2.904 3.839 . 0 0 "[ . 1 . 2]" 1
1548 2 23 ASP QB 2 38 GLU H 3.400 . 6.000 3.945 3.435 4.442 . 0 0 "[ . 1 . 2]" 1
1549 2 23 ASP H 2 38 GLU H 3.900 . 6.000 4.968 4.631 5.821 . 0 0 "[ . 1 . 2]" 1
1550 2 24 GLY H 2 38 GLU H 3.400 . 5.000 4.110 3.819 4.561 . 0 0 "[ . 1 . 2]" 1
1551 2 35 TRP HH2 2 38 GLU H 3.900 . 6.000 4.859 4.247 5.504 . 0 0 "[ . 1 . 2]" 1
1552 2 37 PRO HA 2 38 GLU H 2.400 . 2.900 2.265 2.171 2.396 . 0 0 "[ . 1 . 2]" 1
1553 2 37 PRO QB 2 38 GLU H 3.400 . 6.000 2.930 2.569 3.266 . 0 0 "[ . 1 . 2]" 1
1554 2 38 GLU HA 2 39 GLY H 3.900 . 6.000 2.136 2.097 2.238 . 0 0 "[ . 1 . 2]" 1
1555 2 38 GLU HA 2 40 LYS H 3.400 . 5.000 3.422 3.052 3.727 . 0 0 "[ . 1 . 2]" 1
1556 2 38 GLU QG 2 40 LYS H 3.900 . 7.000 5.093 4.650 5.527 . 0 0 "[ . 1 . 2]" 1
1557 2 38 GLU H 2 40 LYS H 3.900 . 6.000 4.804 4.538 5.081 . 0 0 "[ . 1 . 2]" 1
1558 2 39 GLY QA 2 40 LYS H 3.400 . 6.000 2.882 2.798 2.930 . 0 0 "[ . 1 . 2]" 1
1559 2 39 GLY H 2 40 LYS H 3.900 . 6.000 2.461 2.032 2.778 . 0 0 "[ . 1 . 2]" 1
1560 2 40 LYS H 2 41 ASP H 3.900 . 6.000 4.490 4.428 4.569 . 0 0 "[ . 1 . 2]" 1
1561 2 40 LYS H 2 42 ARG H 3.900 . 6.000 5.258 4.958 5.590 . 0 0 "[ . 1 . 2]" 1
1562 2 40 LYS HA 2 41 ASP H 3.400 . 5.000 2.255 2.134 2.409 . 0 0 "[ . 1 . 2]" 1
1563 2 40 LYS QB 2 41 ASP H 3.400 . 6.000 2.751 2.219 3.105 . 0 0 "[ . 1 . 2]" 1
1564 2 40 LYS QD 2 41 ASP H 3.900 . 7.000 4.090 2.042 5.123 . 0 0 "[ . 1 . 2]" 1
1565 2 40 LYS QG 2 41 ASP H 3.900 . 7.000 3.701 2.986 4.416 . 0 0 "[ . 1 . 2]" 1
1566 2 41 ASP H 2 42 ARG H 3.900 . 6.000 2.259 1.821 2.474 . 0 0 "[ . 1 . 2]" 1
1567 2 40 LYS QB 2 42 ARG H 2.400 . 3.900 2.478 2.281 2.708 . 0 0 "[ . 1 . 2]" 1
1568 2 41 ASP HA 2 42 ARG H 2.900 . 3.500 3.345 3.202 3.453 . 0 0 "[ . 1 . 2]" 1
1569 2 42 ARG H 2 43 PHE H 3.400 . 5.000 4.429 4.371 4.491 . 0 0 "[ . 1 . 2]" 1
1570 2 34 ALA MB 2 43 PHE H 3.900 . 7.500 5.366 4.829 5.743 . 0 0 "[ . 1 . 2]" 1
1571 2 36 ALA HA 2 43 PHE H 3.900 . 6.000 5.191 4.745 6.028 0.028 20 0 "[ . 1 . 2]" 1
1572 2 36 ALA MB 2 43 PHE H 3.400 . 6.500 3.818 3.575 4.006 . 0 0 "[ . 1 . 2]" 1
1573 2 42 ARG HA 2 43 PHE H 2.400 . 2.900 2.241 2.112 2.421 . 0 0 "[ . 1 . 2]" 1
1574 2 42 ARG QB 2 43 PHE H 3.400 . 6.000 2.795 2.438 3.719 . 0 0 "[ . 1 . 2]" 1
1575 2 42 ARG QG 2 43 PHE H 3.400 . 6.000 3.816 2.387 4.583 . 0 0 "[ . 1 . 2]" 1
1576 2 43 PHE H 2 44 THR H 3.400 . 5.000 4.484 4.434 4.624 . 0 0 "[ . 1 . 2]" 1
1577 2 34 ALA MB 2 44 THR H 3.900 . 7.500 5.482 4.970 5.710 . 0 0 "[ . 1 . 2]" 1
1578 2 35 TRP HA 2 44 THR H 3.900 . 6.000 5.620 5.206 5.797 . 0 0 "[ . 1 . 2]" 1
1579 2 35 TRP HE3 2 44 THR H 3.900 . 6.000 3.676 3.467 3.971 . 0 0 "[ . 1 . 2]" 1
1580 2 35 TRP HZ3 2 44 THR H 3.900 . 6.000 4.405 4.110 4.974 . 0 0 "[ . 1 . 2]" 1
1581 2 36 ALA HA 2 44 THR H 3.400 . 5.000 2.463 2.262 2.653 . 0 0 "[ . 1 . 2]" 1
1582 2 36 ALA MB 2 44 THR H 3.400 . 6.500 3.539 2.823 4.030 . 0 0 "[ . 1 . 2]" 1
1583 2 36 ALA H 2 44 THR H 3.900 . 6.000 4.953 4.645 5.155 . 0 0 "[ . 1 . 2]" 1
1584 2 37 PRO QD 2 44 THR H 3.400 . 6.000 2.461 2.100 3.256 . 0 0 "[ . 1 . 2]" 1
1585 2 43 PHE HA 2 44 THR H 2.400 . 2.900 2.179 2.154 2.310 . 0 0 "[ . 1 . 2]" 1
1586 2 43 PHE HB3 2 44 THR H 3.400 . 5.000 3.356 2.671 3.485 . 0 0 "[ . 1 . 2]" 1
1587 2 43 PHE HB2 2 44 THR H 3.400 . 5.000 4.162 3.678 4.326 . 0 0 "[ . 1 . 2]" 1
1588 2 43 PHE QD 2 44 THR H 3.400 . 7.000 4.437 4.019 4.579 . 0 0 "[ . 1 . 2]" 1
1589 2 44 THR H 2 45 ILE HA 3.900 . 6.000 4.917 4.681 5.076 . 0 0 "[ . 1 . 2]" 1
1590 2 44 THR H 2 45 ILE HB 3.400 . 5.000 4.299 4.101 4.548 . 0 0 "[ . 1 . 2]" 1
1591 2 44 THR H 2 45 ILE QG 3.900 . 7.000 4.189 3.898 4.439 . 0 0 "[ . 1 . 2]" 1
1592 2 44 THR H 2 45 ILE MG 3.900 . 7.500 5.475 5.229 5.654 . 0 0 "[ . 1 . 2]" 1
1593 2 44 THR H 2 45 ILE H 2.400 . 2.900 2.211 1.980 2.387 . 0 0 "[ . 1 . 2]" 1
1594 2 34 ALA MB 2 45 ILE H 3.900 . 7.500 4.579 4.366 4.888 . 0 0 "[ . 1 . 2]" 1
1595 2 35 TRP HB2 2 45 ILE H 3.900 . 6.000 5.365 5.208 5.540 . 0 0 "[ . 1 . 2]" 1
1596 2 35 TRP HE3 2 45 ILE H 3.400 . 5.000 2.996 2.586 3.341 . 0 0 "[ . 1 . 2]" 1
1597 2 35 TRP HZ3 2 45 ILE H 3.900 . 6.000 4.628 4.174 4.957 . 0 0 "[ . 1 . 2]" 1
1598 2 36 ALA HA 2 45 ILE H 3.400 . 5.000 3.763 3.528 3.985 . 0 0 "[ . 1 . 2]" 1
1599 2 36 ALA MB 2 45 ILE H 3.400 . 6.500 4.636 4.071 5.019 . 0 0 "[ . 1 . 2]" 1
1600 2 37 PRO QD 2 45 ILE H 3.900 . 7.000 4.025 3.697 4.343 . 0 0 "[ . 1 . 2]" 1
1601 2 43 PHE HA 2 45 ILE H 3.400 . 5.000 3.583 3.390 4.151 . 0 0 "[ . 1 . 2]" 1
1602 2 43 PHE HB3 2 45 ILE H 3.400 . 5.000 3.124 2.886 3.524 . 0 0 "[ . 1 . 2]" 1
1603 2 43 PHE HB2 2 45 ILE H 3.400 . 5.000 4.267 3.843 4.733 . 0 0 "[ . 1 . 2]" 1
1604 2 43 PHE QD 2 45 ILE H 3.900 . 8.000 4.586 4.187 4.912 . 0 0 "[ . 1 . 2]" 1
1605 2 44 THR HB 2 45 ILE H 3.400 . 5.000 3.766 3.338 4.086 . 0 0 "[ . 1 . 2]" 1
1606 2 34 ALA HA 2 46 SER H 3.900 . 6.000 4.485 4.394 4.652 . 0 0 "[ . 1 . 2]" 1
1607 2 34 ALA MB 2 46 SER H 3.900 . 7.500 5.116 4.979 5.292 . 0 0 "[ . 1 . 2]" 1
1608 2 35 TRP H 2 46 SER H 3.900 . 6.000 4.875 4.779 4.986 . 0 0 "[ . 1 . 2]" 1
1609 2 45 ILE HA 2 46 SER H 2.400 . 2.900 2.133 2.112 2.160 . 0 0 "[ . 1 . 2]" 1
1610 2 45 ILE HB 2 46 SER H 3.400 . 5.000 4.362 4.325 4.404 . 0 0 "[ . 1 . 2]" 1
1611 2 45 ILE QG 2 46 SER H 3.400 . 6.000 4.601 4.523 4.773 . 0 0 "[ . 1 . 2]" 1
1612 2 45 ILE MG 2 46 SER H 2.400 . 4.400 2.892 2.784 3.063 . 0 0 "[ . 1 . 2]" 1
1613 2 45 ILE H 2 46 SER H 3.400 . 5.000 4.317 4.206 4.419 . 0 0 "[ . 1 . 2]" 1
1614 2 46 SER H 2 47 HIS HA 3.900 . 6.000 4.609 4.543 4.701 . 0 0 "[ . 1 . 2]" 1
1615 2 46 SER H 2 47 HIS H 3.400 . 5.000 3.765 3.745 3.852 . 0 0 "[ . 1 . 2]" 1
1616 2 33 ILE QG 2 47 HIS H 3.400 . 6.000 4.033 3.813 5.149 . 0 0 "[ . 1 . 2]" 1
1617 2 33 ILE MG 2 47 HIS H 3.400 . 6.500 2.812 2.660 2.990 . 0 0 "[ . 1 . 2]" 1
1618 2 34 ALA HA 2 47 HIS H 3.400 . 5.000 3.575 3.480 3.762 . 0 0 "[ . 1 . 2]" 1
1619 2 34 ALA MB 2 47 HIS H 3.400 . 6.500 4.272 4.159 4.553 . 0 0 "[ . 1 . 2]" 1
1620 2 45 ILE MG 2 47 HIS H 3.400 . 6.500 3.404 3.345 3.459 . 0 0 "[ . 1 . 2]" 1
1621 2 46 SER HA 2 47 HIS H 2.400 . 2.900 2.176 2.148 2.197 . 0 0 "[ . 1 . 2]" 1
1622 2 46 SER HB3 2 47 HIS H 3.900 . 6.000 4.410 4.273 4.494 . 0 0 "[ . 1 . 2]" 1
1623 2 46 SER HB2 2 47 HIS H 3.900 . 6.000 4.505 4.434 4.582 . 0 0 "[ . 1 . 2]" 1
1624 2 47 HIS H 2 48 MET HA 3.400 . 5.000 4.766 4.673 4.835 . 0 0 "[ . 1 . 2]" 1
1625 2 47 HIS H 2 48 MET H 3.400 . 5.000 4.383 4.337 4.411 . 0 0 "[ . 1 . 2]" 1
1626 2 32 ARG HA 2 48 MET H 3.900 . 6.000 5.000 4.766 5.221 . 0 0 "[ . 1 . 2]" 1
1627 2 33 ILE MG 2 48 MET H 3.900 . 7.500 4.629 4.528 4.786 . 0 0 "[ . 1 . 2]" 1
1628 2 46 SER HA 2 48 MET H 3.900 . 6.000 6.003 5.881 6.081 0.081 2 0 "[ . 1 . 2]" 1
1629 2 47 HIS HA 2 48 MET H 2.400 . 2.900 2.210 2.157 2.251 . 0 0 "[ . 1 . 2]" 1
1630 2 48 MET H 2 49 TYR QD 3.900 . 8.000 5.968 5.787 6.164 . 0 0 "[ . 1 . 2]" 1
1631 2 48 MET H 2 50 ALA MB 3.900 . 7.500 5.206 5.012 5.414 . 0 0 "[ . 1 . 2]" 1
1632 2 48 MET H 2 50 ALA H 3.900 . 6.000 4.850 4.728 5.018 . 0 0 "[ . 1 . 2]" 1
1633 2 48 MET H 2 51 ASP HA 3.900 . 6.000 5.963 5.773 6.065 0.065 5 0 "[ . 1 . 2]" 1
1634 2 48 MET H 2 51 ASP HB2 3.400 . 5.000 3.608 3.124 3.797 . 0 0 "[ . 1 . 2]" 1
1635 2 48 MET H 2 51 ASP H 3.400 . 5.000 4.081 3.889 4.360 . 0 0 "[ . 1 . 2]" 1
1636 2 48 MET H 2 52 ILE MD 3.900 . 7.500 3.807 3.622 4.015 . 0 0 "[ . 1 . 2]" 1
1637 2 48 MET H 2 52 ILE QG 3.900 . 7.000 4.452 4.341 4.587 . 0 0 "[ . 1 . 2]" 1
1638 2 48 MET H 2 71 LEU MD2 3.900 . 7.500 5.389 5.159 5.588 . 0 0 "[ . 1 . 2]" 1
1639 2 32 ARG HA 2 49 TYR H 2.900 . 3.500 2.532 2.429 2.612 . 0 0 "[ . 1 . 2]" 1
1640 2 32 ARG HB3 2 49 TYR H 3.400 . 5.000 4.007 3.751 4.286 . 0 0 "[ . 1 . 2]" 1
1641 2 32 ARG HB2 2 49 TYR H 3.400 . 5.000 4.137 3.702 4.520 . 0 0 "[ . 1 . 2]" 1
1642 2 32 ARG QG 2 49 TYR H 3.400 . 6.000 5.365 5.184 5.488 . 0 0 "[ . 1 . 2]" 1
1643 2 48 MET HA 2 49 TYR H 2.400 . 2.900 2.230 2.205 2.266 . 0 0 "[ . 1 . 2]" 1
1644 2 48 MET HB3 2 49 TYR H 3.400 . 5.000 2.948 2.781 3.100 . 0 0 "[ . 1 . 2]" 1
1645 2 48 MET H 2 49 TYR H 3.900 . 6.000 4.552 4.538 4.573 . 0 0 "[ . 1 . 2]" 1
1646 2 49 TYR H 2 50 ALA MB 3.400 . 6.500 4.298 4.207 4.358 . 0 0 "[ . 1 . 2]" 1
1647 2 49 TYR H 2 50 ALA H 3.400 . 5.000 2.651 2.588 2.706 . 0 0 "[ . 1 . 2]" 1
1648 2 49 TYR H 2 52 ILE MD 3.400 . 6.500 4.635 4.523 4.718 . 0 0 "[ . 1 . 2]" 1
1649 2 32 ARG HA 2 50 ALA H 3.900 . 6.000 5.102 4.976 5.222 . 0 0 "[ . 1 . 2]" 1
1650 2 48 MET HB3 2 50 ALA H 3.400 . 5.000 2.494 2.212 2.714 . 0 0 "[ . 1 . 2]" 1
1651 2 48 MET HB2 2 50 ALA H 3.400 . 5.000 3.290 2.923 3.785 . 0 0 "[ . 1 . 2]" 1
1652 2 49 TYR HB3 2 50 ALA H 3.400 . 5.000 3.988 3.914 4.060 . 0 0 "[ . 1 . 2]" 1
1653 2 49 TYR QD 2 50 ALA H 3.400 . 7.000 4.530 4.460 4.565 . 0 0 "[ . 1 . 2]" 1
1654 2 50 ALA H 2 51 ASP H 2.900 . 3.500 2.563 2.503 2.653 . 0 0 "[ . 1 . 2]" 1
1655 2 50 ALA H 2 52 ILE MD 3.900 . 7.500 5.151 4.994 5.273 . 0 0 "[ . 1 . 2]" 1
1656 2 50 ALA H 2 105 PHE HB3 3.400 . 5.000 3.450 2.755 4.648 . 0 0 "[ . 1 . 2]" 1
1657 2 50 ALA H 2 105 PHE QD 3.400 . 7.000 4.426 3.304 5.031 . 0 0 "[ . 1 . 2]" 1
1658 2 48 MET HB3 2 51 ASP H 3.400 . 5.000 3.749 3.339 4.105 . 0 0 "[ . 1 . 2]" 1
1659 2 48 MET HB2 2 51 ASP H 3.400 . 5.000 3.209 2.853 3.709 . 0 0 "[ . 1 . 2]" 1
1660 2 49 TYR QD 2 51 ASP H 3.900 . 8.000 5.402 5.168 5.602 . 0 0 "[ . 1 . 2]" 1
1661 2 50 ALA HA 2 51 ASP H 3.400 . 5.000 3.436 3.297 3.517 . 0 0 "[ . 1 . 2]" 1
1662 2 50 ALA MB 2 51 ASP H 2.900 . 5.000 2.981 2.745 3.235 . 0 0 "[ . 1 . 2]" 1
1663 2 51 ASP H 2 52 ILE HA 3.900 . 6.000 4.733 4.550 4.875 . 0 0 "[ . 1 . 2]" 1
1664 2 51 ASP H 2 52 ILE MD 3.400 . 6.500 3.952 3.705 4.131 . 0 0 "[ . 1 . 2]" 1
1665 2 51 ASP H 2 52 ILE QG 3.400 . 6.000 2.924 2.702 3.091 . 0 0 "[ . 1 . 2]" 1
1666 2 51 ASP H 2 52 ILE MG 3.400 . 6.500 5.369 5.164 5.502 . 0 0 "[ . 1 . 2]" 1
1667 2 51 ASP H 2 52 ILE H 2.400 . 2.900 2.155 1.867 2.348 . 0 0 "[ . 1 . 2]" 1
1668 2 51 ASP H 2 71 LEU MD2 3.900 . 7.500 4.960 4.769 5.139 . 0 0 "[ . 1 . 2]" 1
1669 2 51 ASP H 2 72 HIS HD2 3.900 . 6.000 6.256 6.202 6.272 0.272 15 0 "[ . 1 . 2]" 1
1670 2 48 MET HB3 2 52 ILE H 3.900 . 6.000 5.593 5.120 5.920 . 0 0 "[ . 1 . 2]" 1
1671 2 49 TYR HA 2 52 ILE H 3.400 . 5.000 3.248 3.077 3.472 . 0 0 "[ . 1 . 2]" 1
1672 2 49 TYR QD 2 52 ILE H 3.900 . 8.000 4.945 4.684 5.196 . 0 0 "[ . 1 . 2]" 1
1673 2 50 ALA MB 2 52 ILE H 3.400 . 6.500 4.414 4.296 4.563 . 0 0 "[ . 1 . 2]" 1
1674 2 50 ALA H 2 52 ILE H 3.900 . 6.000 3.893 3.837 3.948 . 0 0 "[ . 1 . 2]" 1
1675 2 51 ASP HA 2 52 ILE H 3.400 . 5.000 3.332 3.296 3.376 . 0 0 "[ . 1 . 2]" 1
1676 2 51 ASP HB3 2 52 ILE H 3.400 . 5.000 4.337 3.867 4.426 . 0 0 "[ . 1 . 2]" 1
1677 2 51 ASP HB2 2 52 ILE H 3.400 . 5.000 3.384 3.285 3.475 . 0 0 "[ . 1 . 2]" 1
1678 2 52 ILE H 2 53 LYS H 3.400 . 5.000 4.503 4.424 4.570 . 0 0 "[ . 1 . 2]" 1
1679 2 52 ILE H 2 71 LEU HA 3.400 . 5.000 4.892 4.653 5.019 0.019 14 0 "[ . 1 . 2]" 1
1680 2 52 ILE H 2 71 LEU MD2 3.900 . 7.500 3.940 3.768 4.098 . 0 0 "[ . 1 . 2]" 1
1681 2 52 ILE H 2 72 HIS HD2 3.900 . 6.000 6.039 5.997 6.093 0.093 5 0 "[ . 1 . 2]" 1
1682 2 52 ILE HA 2 53 LYS H 2.400 . 2.900 2.225 2.183 2.270 . 0 0 "[ . 1 . 2]" 1
1683 2 52 ILE QG 2 53 LYS H 3.400 . 6.000 4.771 4.730 4.821 . 0 0 "[ . 1 . 2]" 1
1684 2 52 ILE MG 2 53 LYS H 2.400 . 4.400 2.654 2.472 2.907 . 0 0 "[ . 1 . 2]" 1
1685 2 53 LYS H 2 54 CYS HB2 3.900 . 6.000 6.087 6.012 6.159 0.159 14 0 "[ . 1 . 2]" 1
1686 2 53 LYS H 2 54 CYS H 2.900 . 3.500 2.232 2.180 2.324 . 0 0 "[ . 1 . 2]" 1
1687 2 53 LYS H 2 70 VAL H 3.900 . 6.000 4.616 4.471 4.737 . 0 0 "[ . 1 . 2]" 1
1688 2 53 LYS H 2 71 LEU HA 3.400 . 5.000 1.797 1.770 1.877 0.030 19 0 "[ . 1 . 2]" 1
1689 2 53 LYS H 2 71 LEU MD2 3.400 . 6.500 3.061 2.849 3.407 . 0 0 "[ . 1 . 2]" 1
1690 2 53 LYS H 2 71 LEU H 3.900 . 6.000 4.160 4.114 4.206 . 0 0 "[ . 1 . 2]" 1
1691 2 53 LYS H 2 72 HIS HA 3.900 . 6.000 4.858 4.443 5.068 . 0 0 "[ . 1 . 2]" 1
1692 2 53 LYS H 2 72 HIS H 3.400 . 5.000 3.105 2.807 3.305 . 0 0 "[ . 1 . 2]" 1
1693 2 53 LYS H 2 102 LEU MD2 3.400 . 6.500 4.949 4.640 5.232 . 0 0 "[ . 1 . 2]" 1
1694 2 52 ILE HA 2 54 CYS H 3.400 . 5.000 3.982 3.663 4.281 . 0 0 "[ . 1 . 2]" 1
1695 2 52 ILE MG 2 54 CYS H 2.400 . 4.400 2.531 2.263 2.941 . 0 0 "[ . 1 . 2]" 1
1696 2 53 LYS HA 2 54 CYS H 3.400 . 5.000 3.500 3.456 3.523 . 0 0 "[ . 1 . 2]" 1
1697 2 53 LYS HB3 2 54 CYS H 2.400 . 2.900 2.553 2.276 2.793 . 0 0 "[ . 1 . 2]" 1
1698 2 53 LYS QE 2 54 CYS H 3.900 . 7.000 4.691 3.721 5.684 . 0 0 "[ . 1 . 2]" 1
1699 2 53 LYS QG 2 54 CYS H 3.400 . 6.000 3.709 3.291 4.035 . 0 0 "[ . 1 . 2]" 1
1700 2 54 CYS H 2 55 GLN HA 3.900 . 6.000 4.469 4.379 4.545 . 0 0 "[ . 1 . 2]" 1
1701 2 54 CYS H 2 55 GLN HB3 3.400 . 5.000 5.075 5.018 5.142 0.142 4 0 "[ . 1 . 2]" 1
1702 2 54 CYS H 2 69 LEU HA 3.900 . 6.000 5.074 4.910 5.329 . 0 0 "[ . 1 . 2]" 1
1703 2 54 CYS H 2 70 VAL HA 3.400 . 5.000 4.743 4.670 4.838 . 0 0 "[ . 1 . 2]" 1
1704 2 54 CYS H 2 70 VAL HB 2.400 . 2.900 2.866 2.771 2.960 0.060 2 0 "[ . 1 . 2]" 1
1705 2 54 CYS H 2 70 VAL H 3.400 . 5.000 3.536 3.444 3.628 . 0 0 "[ . 1 . 2]" 1
1706 2 54 CYS H 2 71 LEU MD2 3.900 . 7.500 4.159 3.975 4.466 . 0 0 "[ . 1 . 2]" 1
1707 2 54 CYS H 2 71 LEU H 3.900 . 6.000 4.939 4.844 5.050 . 0 0 "[ . 1 . 2]" 1
1708 2 54 CYS H 2 72 HIS H 3.900 . 6.000 5.126 4.935 5.301 . 0 0 "[ . 1 . 2]" 1
1709 2 54 CYS H 2 102 LEU MD2 3.400 . 6.500 5.083 4.792 5.310 . 0 0 "[ . 1 . 2]" 1
1710 2 55 GLN QE 2 95 LYS HA 3.400 . 6.000 2.986 1.933 3.850 . 0 0 "[ . 1 . 2]" 1
1711 2 55 GLN QE 2 95 LYS HB2 3.900 . 7.000 4.352 2.383 5.561 . 0 0 "[ . 1 . 2]" 1
1712 2 55 GLN QE 2 95 LYS QG 3.900 . 8.000 2.901 1.755 3.968 0.045 8 0 "[ . 1 . 2]" 1
1713 2 55 GLN QE 2 96 ASP HA 3.900 . 7.000 5.014 4.288 6.190 . 0 0 "[ . 1 . 2]" 1
1714 2 55 GLN QE 2 98 LEU HA 3.900 . 7.000 4.855 3.819 5.970 . 0 0 "[ . 1 . 2]" 1
1715 2 55 GLN QE 2 98 LEU HB3 3.400 . 6.000 3.137 2.073 4.149 . 0 0 "[ . 1 . 2]" 1
1716 2 55 GLN QE 2 98 LEU H 3.900 . 7.000 4.345 3.313 5.055 . 0 0 "[ . 1 . 2]" 1
1717 2 55 GLN QE 2 99 GLN HA 3.900 . 7.000 3.009 2.206 6.194 . 0 0 "[ . 1 . 2]" 1
1718 2 55 GLN QE 2 99 GLN QG 3.400 . 7.000 3.279 1.779 4.389 0.021 6 0 "[ . 1 . 2]" 1
1719 2 55 GLN QE 2 99 GLN H 3.400 . 6.000 2.941 2.024 4.906 . 0 0 "[ . 1 . 2]" 1
1720 2 55 GLN QE 2 102 LEU MD1 3.400 . 7.500 3.189 1.999 4.596 . 0 0 "[ . 1 . 2]" 1
1721 2 54 CYS HA 2 55 GLN H 2.400 . 2.900 2.634 2.540 2.662 . 0 0 "[ . 1 . 2]" 1
1722 2 54 CYS HB2 2 55 GLN H 2.400 . 2.900 2.087 2.014 2.257 . 0 0 "[ . 1 . 2]" 1
1723 2 54 CYS H 2 55 GLN H 3.900 . 6.000 4.307 4.287 4.325 . 0 0 "[ . 1 . 2]" 1
1724 2 55 GLN H 2 56 LYS QG 3.900 . 7.000 4.871 4.627 5.125 . 0 0 "[ . 1 . 2]" 1
1725 2 55 GLN H 2 56 LYS H 3.900 . 6.000 4.346 4.263 4.403 . 0 0 "[ . 1 . 2]" 1
1726 2 55 GLN H 2 102 LEU MD1 3.400 . 6.500 3.783 3.465 4.102 . 0 0 "[ . 1 . 2]" 1
1727 2 55 GLN HA 2 56 LYS H 2.400 . 2.900 2.259 2.180 2.320 . 0 0 "[ . 1 . 2]" 1
1728 2 55 GLN HB2 2 56 LYS H 2.400 . 2.900 2.999 2.923 3.051 0.151 7 0 "[ . 1 . 2]" 1
1729 2 56 LYS H 2 57 ILE H 3.900 . 6.000 4.504 4.450 4.532 . 0 0 "[ . 1 . 2]" 1
1730 2 56 LYS H 2 67 LEU HA 3.900 . 6.000 4.747 4.516 4.856 . 0 0 "[ . 1 . 2]" 1
1731 2 56 LYS H 2 68 GLN H 3.400 . 5.000 2.701 2.498 2.796 . 0 0 "[ . 1 . 2]" 1
1732 2 56 LYS H 2 69 LEU MD2 3.400 . 6.500 4.628 4.380 4.734 . 0 0 "[ . 1 . 2]" 1
1733 2 56 LYS H 2 70 VAL MG1 3.400 . 6.500 5.535 5.496 5.625 . 0 0 "[ . 1 . 2]" 1
1734 2 56 LYS HA 2 57 ILE H 2.400 . 2.900 2.281 2.226 2.333 . 0 0 "[ . 1 . 2]" 1
1735 2 57 ILE H 2 58 SER H 3.900 . 6.000 4.287 4.245 4.320 . 0 0 "[ . 1 . 2]" 1
1736 2 57 ILE H 2 68 GLN H 3.900 . 6.000 4.833 4.758 4.896 . 0 0 "[ . 1 . 2]" 1
1737 2 57 ILE HA 2 58 SER H 2.400 . 2.900 2.194 2.160 2.214 . 0 0 "[ . 1 . 2]" 1
1738 2 57 ILE HB 2 58 SER H 3.400 . 5.000 3.373 3.301 3.445 . 0 0 "[ . 1 . 2]" 1
1739 2 57 ILE QG 2 58 SER H 3.400 . 6.000 3.623 3.557 3.707 . 0 0 "[ . 1 . 2]" 1
1740 2 57 ILE MG 2 58 SER H 3.400 . 6.500 4.318 4.295 4.334 . 0 0 "[ . 1 . 2]" 1
1741 2 58 SER H 2 59 PRO QD 3.900 . 7.000 4.116 4.069 4.146 . 0 0 "[ . 1 . 2]" 1
1742 2 58 SER H 2 65 ILE MG 3.400 . 6.500 4.271 4.076 4.448 . 0 0 "[ . 1 . 2]" 1
1743 2 58 SER H 2 66 GLN H 3.400 . 5.000 3.075 2.957 3.213 . 0 0 "[ . 1 . 2]" 1
1744 2 58 SER H 2 67 LEU HA 3.400 . 5.000 3.016 2.897 3.154 . 0 0 "[ . 1 . 2]" 1
1745 2 58 SER H 2 67 LEU H 3.900 . 6.000 4.308 4.244 4.370 . 0 0 "[ . 1 . 2]" 1
1746 2 58 SER H 2 68 GLN H 3.900 . 6.000 5.045 4.887 5.230 . 0 0 "[ . 1 . 2]" 1
1747 2 58 SER H 2 91 ARG QD 3.900 . 7.000 3.006 2.819 3.163 . 0 0 "[ . 1 . 2]" 1
1748 2 59 PRO HA 2 60 GLU H 2.400 . 2.900 2.359 2.342 2.375 . 0 0 "[ . 1 . 2]" 1
1749 2 59 PRO QD 2 60 GLU H 3.900 . 7.000 4.869 4.856 4.880 . 0 0 "[ . 1 . 2]" 1
1750 2 60 GLU H 2 65 ILE MD 3.900 . 7.500 6.074 5.791 6.205 . 0 0 "[ . 1 . 2]" 1
1751 2 60 GLU H 2 65 ILE QG 3.900 . 7.000 4.935 4.583 5.092 . 0 0 "[ . 1 . 2]" 1
1752 2 60 GLU HA 2 61 GLY H 2.400 . 2.900 2.365 2.335 2.375 . 0 0 "[ . 1 . 2]" 1
1753 2 60 GLU QB 2 61 GLY H 3.400 . 6.000 2.477 2.445 2.610 . 0 0 "[ . 1 . 2]" 1
1754 2 60 GLU QG 2 61 GLY H 3.900 . 7.000 3.805 3.581 4.478 . 0 0 "[ . 1 . 2]" 1
1755 2 60 GLU H 2 61 GLY H 3.900 . 6.000 4.607 4.595 4.613 . 0 0 "[ . 1 . 2]" 1
1756 2 61 GLY H 2 62 LYS HA 3.900 . 6.000 4.812 4.767 4.854 . 0 0 "[ . 1 . 2]" 1
1757 2 61 GLY H 2 62 LYS QG 3.900 . 7.000 5.367 5.317 5.399 . 0 0 "[ . 1 . 2]" 1
1758 2 61 GLY H 2 62 LYS H 3.400 . 5.000 2.552 2.531 2.580 . 0 0 "[ . 1 . 2]" 1
1759 2 59 PRO QD 2 62 LYS H 3.900 . 7.000 5.846 5.759 5.919 . 0 0 "[ . 1 . 2]" 1
1760 2 60 GLU HA 2 62 LYS H 3.400 . 5.000 3.152 3.097 3.198 . 0 0 "[ . 1 . 2]" 1
1761 2 60 GLU QG 2 62 LYS H 3.900 . 7.000 5.350 5.137 5.844 . 0 0 "[ . 1 . 2]" 1
1762 2 61 GLY QA 2 62 LYS H 3.400 . 6.000 2.756 2.748 2.769 . 0 0 "[ . 1 . 2]" 1
1763 2 62 LYS H 2 64 LYS H 3.900 . 6.000 4.581 4.304 4.806 . 0 0 "[ . 1 . 2]" 1
1764 2 62 LYS H 2 65 ILE MD 3.900 . 7.500 5.728 5.490 5.984 . 0 0 "[ . 1 . 2]" 1
1765 2 62 LYS HA 2 63 ALA H 3.400 . 5.000 2.323 2.262 2.420 . 0 0 "[ . 1 . 2]" 1
1766 2 63 ALA H 2 64 LYS H 3.900 . 6.000 2.491 2.293 2.605 . 0 0 "[ . 1 . 2]" 1
1767 2 62 LYS HA 2 64 LYS H 3.400 . 5.000 3.782 3.633 3.930 . 0 0 "[ . 1 . 2]" 1
1768 2 62 LYS HB3 2 64 LYS H 3.400 . 5.000 2.070 1.969 2.166 . 0 0 "[ . 1 . 2]" 1
1769 2 62 LYS HB2 2 64 LYS H 3.400 . 5.000 3.335 3.171 3.492 . 0 0 "[ . 1 . 2]" 1
1770 2 63 ALA HA 2 64 LYS H 2.900 . 3.500 3.322 3.199 3.399 . 0 0 "[ . 1 . 2]" 1
1771 2 63 ALA MB 2 64 LYS H 2.400 . 4.400 3.060 2.900 3.279 . 0 0 "[ . 1 . 2]" 1
1772 2 64 LYS H 2 65 ILE H 3.400 . 5.000 4.282 4.154 4.335 . 0 0 "[ . 1 . 2]" 1
1773 2 64 LYS HA 2 65 ILE H 2.400 . 2.900 2.212 2.157 2.335 . 0 0 "[ . 1 . 2]" 1
1774 2 64 LYS QB 2 65 ILE H 3.400 . 6.000 2.939 2.594 3.343 . 0 0 "[ . 1 . 2]" 1
1775 2 65 ILE H 2 66 GLN H 3.900 . 6.000 4.582 4.533 4.633 . 0 0 "[ . 1 . 2]" 1
1776 2 65 ILE H 2 80 HIS HA 3.900 . 6.000 5.597 5.162 5.974 . 0 0 "[ . 1 . 2]" 1
1777 2 65 ILE H 2 80 HIS HD2 3.400 . 5.000 4.431 3.392 5.003 0.003 12 0 "[ . 1 . 2]" 1
1778 2 65 ILE H 2 81 PHE HB3 3.900 . 6.000 4.633 4.301 5.196 . 0 0 "[ . 1 . 2]" 1
1779 2 65 ILE H 2 81 PHE HB2 3.900 . 6.000 3.838 3.498 4.258 . 0 0 "[ . 1 . 2]" 1
1780 2 65 ILE H 2 81 PHE H 3.900 . 6.000 4.413 4.175 4.615 . 0 0 "[ . 1 . 2]" 1
1781 2 58 SER HB3 2 66 GLN QE 3.900 . 7.000 2.164 1.940 2.536 . 0 0 "[ . 1 . 2]" 1
1782 2 64 LYS QB 2 66 GLN QE 3.400 . 7.000 5.403 4.420 5.700 . 0 0 "[ . 1 . 2]" 1
1783 2 64 LYS QG 2 66 GLN QE 3.900 . 8.000 4.310 3.903 6.074 . 0 0 "[ . 1 . 2]" 1
1784 2 66 GLN QE 2 80 HIS HA 3.900 . 7.000 4.994 4.657 5.471 . 0 0 "[ . 1 . 2]" 1
1785 2 57 ILE HA 2 66 GLN H 3.900 . 6.000 5.007 4.864 5.150 . 0 0 "[ . 1 . 2]" 1
1786 2 58 SER HB3 2 66 GLN H 3.400 . 5.000 3.408 3.298 3.511 . 0 0 "[ . 1 . 2]" 1
1787 2 65 ILE HA 2 66 GLN H 2.400 . 2.900 2.304 2.260 2.348 . 0 0 "[ . 1 . 2]" 1
1788 2 65 ILE HB 2 66 GLN H 3.900 . 6.000 4.270 4.175 4.378 . 0 0 "[ . 1 . 2]" 1
1789 2 65 ILE QG 2 66 GLN H 3.900 . 7.000 4.034 3.959 4.116 . 0 0 "[ . 1 . 2]" 1
1790 2 65 ILE MG 2 66 GLN H 3.400 . 6.500 2.616 2.447 2.831 . 0 0 "[ . 1 . 2]" 1
1791 2 66 GLN H 2 67 LEU H 3.900 . 6.000 4.451 4.428 4.467 . 0 0 "[ . 1 . 2]" 1
1792 2 66 GLN H 2 80 HIS HA 3.900 . 6.000 5.322 4.925 5.676 . 0 0 "[ . 1 . 2]" 1
1793 2 66 GLN H 2 81 PHE QD 3.900 . 8.000 4.467 4.201 4.787 . 0 0 "[ . 1 . 2]" 1
1794 2 17 VAL MG1 2 67 LEU H 3.900 . 7.500 5.217 5.045 5.437 . 0 0 "[ . 1 . 2]" 1
1795 2 65 ILE MG 2 67 LEU H 3.900 . 7.500 4.849 4.755 4.943 . 0 0 "[ . 1 . 2]" 1
1796 2 66 GLN HA 2 67 LEU H 2.400 . 2.900 2.262 2.232 2.288 . 0 0 "[ . 1 . 2]" 1
1797 2 66 GLN HB3 2 67 LEU H 3.400 . 5.000 2.312 2.267 2.401 . 0 0 "[ . 1 . 2]" 1
1798 2 67 LEU H 2 68 GLN H 3.900 . 6.000 4.372 4.354 4.388 . 0 0 "[ . 1 . 2]" 1
1799 2 67 LEU H 2 79 PHE HA 3.900 . 6.000 4.713 4.610 4.807 . 0 0 "[ . 1 . 2]" 1
1800 2 67 LEU H 2 79 PHE HB3 3.400 . 5.000 4.177 3.984 4.360 . 0 0 "[ . 1 . 2]" 1
1801 2 67 LEU H 2 79 PHE HB2 3.900 . 6.000 3.295 3.116 3.588 . 0 0 "[ . 1 . 2]" 1
1802 2 67 LEU H 2 79 PHE QD 3.900 . 8.000 4.951 4.723 5.252 . 0 0 "[ . 1 . 2]" 1
1803 2 67 LEU H 2 80 HIS HA 3.900 . 6.000 3.795 3.385 4.110 . 0 0 "[ . 1 . 2]" 1
1804 2 67 LEU H 2 80 HIS HB2 3.900 . 6.000 5.683 5.294 6.036 0.036 7 0 "[ . 1 . 2]" 1
1805 2 67 LEU H 2 81 PHE QD 3.400 . 7.000 3.052 2.782 3.472 . 0 0 "[ . 1 . 2]" 1
1806 2 68 GLN QE 2 69 LEU H 3.900 . 7.000 5.183 5.066 5.313 . 0 0 "[ . 1 . 2]" 1
1807 2 68 GLN QE 2 76 THR HB 3.900 . 7.000 3.661 3.290 3.879 . 0 0 "[ . 1 . 2]" 1
1808 2 68 GLN QE 2 76 THR MG 3.400 . 7.500 3.789 3.533 4.014 . 0 0 "[ . 1 . 2]" 1
1809 2 68 GLN QE 2 78 ASN QD 3.900 . 8.000 2.418 1.937 3.086 . 0 0 "[ . 1 . 2]" 1
1810 2 55 GLN HA 2 68 GLN H 3.900 . 6.000 4.407 4.197 4.537 . 0 0 "[ . 1 . 2]" 1
1811 2 55 GLN HB2 2 68 GLN H 3.900 . 6.000 3.804 3.599 4.108 . 0 0 "[ . 1 . 2]" 1
1812 2 56 LYS HA 2 68 GLN H 3.900 . 6.000 4.532 4.441 4.635 . 0 0 "[ . 1 . 2]" 1
1813 2 56 LYS HB2 2 68 GLN H 2.900 . 3.500 3.291 3.127 3.510 0.010 9 0 "[ . 1 . 2]" 1
1814 2 57 ILE HA 2 68 GLN H 3.400 . 5.000 3.591 3.438 3.787 . 0 0 "[ . 1 . 2]" 1
1815 2 67 LEU HA 2 68 GLN H 2.400 . 2.900 2.415 2.387 2.434 . 0 0 "[ . 1 . 2]" 1
1816 2 67 LEU MD2 2 68 GLN H 3.400 . 6.500 3.498 3.456 3.544 . 0 0 "[ . 1 . 2]" 1
1817 2 67 LEU HG 2 68 GLN H 3.400 . 5.000 2.224 2.121 2.320 . 0 0 "[ . 1 . 2]" 1
1818 2 68 GLN H 2 69 LEU H 3.400 . 5.000 4.296 4.245 4.331 . 0 0 "[ . 1 . 2]" 1
1819 2 68 GLN H 2 79 PHE HB2 3.900 . 6.000 4.976 4.796 5.305 . 0 0 "[ . 1 . 2]" 1
1820 2 55 GLN HA 2 69 LEU H 3.900 . 6.000 4.951 4.872 5.050 . 0 0 "[ . 1 . 2]" 1
1821 2 68 GLN HA 2 69 LEU H 2.400 . 2.900 2.161 2.116 2.211 . 0 0 "[ . 1 . 2]" 1
1822 2 68 GLN HB3 2 69 LEU H 3.400 . 5.000 4.194 4.144 4.271 . 0 0 "[ . 1 . 2]" 1
1823 2 68 GLN QG 2 69 LEU H 3.400 . 6.000 3.382 3.257 3.546 . 0 0 "[ . 1 . 2]" 1
1824 2 69 LEU H 2 70 VAL HA 3.900 . 6.000 4.979 4.946 5.036 . 0 0 "[ . 1 . 2]" 1
1825 2 69 LEU H 2 70 VAL MG2 3.900 . 7.500 4.416 4.352 4.480 . 0 0 "[ . 1 . 2]" 1
1826 2 69 LEU H 2 76 THR HB 3.900 . 6.000 4.396 4.167 4.620 . 0 0 "[ . 1 . 2]" 1
1827 2 69 LEU H 2 77 THR HB 3.400 . 5.000 2.858 2.744 3.002 . 0 0 "[ . 1 . 2]" 1
1828 2 69 LEU H 2 77 THR H 3.400 . 5.000 2.705 2.555 2.845 . 0 0 "[ . 1 . 2]" 1
1829 2 69 LEU H 2 78 ASN HA 3.400 . 5.000 3.385 3.190 3.660 . 0 0 "[ . 1 . 2]" 1
1830 2 69 LEU H 2 79 PHE QE 3.900 . 8.000 4.183 3.882 4.360 . 0 0 "[ . 1 . 2]" 1
1831 2 54 CYS HB3 2 70 VAL H 3.900 . 6.000 5.887 5.773 6.037 0.037 5 0 "[ . 1 . 2]" 1
1832 2 55 GLN HA 2 70 VAL H 3.400 . 5.000 2.291 2.173 2.394 . 0 0 "[ . 1 . 2]" 1
1833 2 55 GLN HB3 2 70 VAL H 3.400 . 5.000 3.948 3.519 4.307 . 0 0 "[ . 1 . 2]" 1
1834 2 56 LYS H 2 70 VAL H 3.900 . 6.000 3.782 3.635 3.871 . 0 0 "[ . 1 . 2]" 1
1835 2 69 LEU HA 2 70 VAL H 2.400 . 2.900 2.180 2.156 2.199 . 0 0 "[ . 1 . 2]" 1
1836 2 69 LEU MD2 2 70 VAL H 3.400 . 6.500 3.748 3.580 3.953 . 0 0 "[ . 1 . 2]" 1
1837 2 69 LEU H 2 70 VAL H 3.900 . 6.000 4.237 4.149 4.314 . 0 0 "[ . 1 . 2]" 1
1838 2 70 VAL H 2 71 LEU HA 3.900 . 6.000 4.984 4.853 5.052 . 0 0 "[ . 1 . 2]" 1
1839 2 70 VAL H 2 71 LEU MD2 3.900 . 7.500 3.805 3.556 4.013 . 0 0 "[ . 1 . 2]" 1
1840 2 70 VAL H 2 71 LEU H 3.900 . 6.000 4.313 4.180 4.441 . 0 0 "[ . 1 . 2]" 1
1841 2 70 VAL H 2 76 THR HA 3.400 . 5.000 4.616 4.489 4.700 . 0 0 "[ . 1 . 2]" 1
1842 2 70 VAL HA 2 71 LEU H 2.400 . 2.900 2.142 2.129 2.167 . 0 0 "[ . 1 . 2]" 1
1843 2 70 VAL HB 2 71 LEU H 3.400 . 5.000 4.236 4.124 4.320 . 0 0 "[ . 1 . 2]" 1
1844 2 70 VAL MG1 2 71 LEU H 2.400 . 4.400 3.035 2.775 3.230 . 0 0 "[ . 1 . 2]" 1
1845 2 71 LEU H 2 72 HIS H 3.400 . 5.000 4.569 4.535 4.596 . 0 0 "[ . 1 . 2]" 1
1846 2 71 LEU H 2 74 GLY H 3.900 . 6.000 4.544 4.405 4.652 . 0 0 "[ . 1 . 2]" 1
1847 2 71 LEU H 2 75 ASP QB 3.900 . 7.000 4.500 4.194 5.186 . 0 0 "[ . 1 . 2]" 1
1848 2 71 LEU H 2 75 ASP H 3.400 . 5.000 3.628 3.469 3.893 . 0 0 "[ . 1 . 2]" 1
1849 2 71 LEU H 2 76 THR HA 3.400 . 5.000 2.826 2.690 2.984 . 0 0 "[ . 1 . 2]" 1
1850 2 71 LEU H 2 76 THR HB 3.400 . 5.000 4.992 4.803 5.050 0.050 13 0 "[ . 1 . 2]" 1
1851 2 71 LEU H 2 76 THR MG 3.400 . 6.500 3.069 2.907 3.196 . 0 0 "[ . 1 . 2]" 1
1852 2 71 LEU H 2 77 THR H 3.400 . 5.000 4.372 4.110 4.650 . 0 0 "[ . 1 . 2]" 1
1853 2 51 ASP HA 2 72 HIS H 3.400 . 5.000 4.445 4.279 4.546 . 0 0 "[ . 1 . 2]" 1
1854 2 52 ILE HA 2 72 HIS H 3.400 . 5.000 3.655 3.246 3.884 . 0 0 "[ . 1 . 2]" 1
1855 2 53 LYS HB3 2 72 HIS H 3.400 . 5.000 3.706 3.389 4.081 . 0 0 "[ . 1 . 2]" 1
1856 2 53 LYS HB2 2 72 HIS H 3.400 . 5.000 2.585 2.347 2.846 . 0 0 "[ . 1 . 2]" 1
1857 2 71 LEU HA 2 72 HIS H 2.400 . 2.900 2.306 2.261 2.339 . 0 0 "[ . 1 . 2]" 1
1858 2 71 LEU HB3 2 72 HIS H 2.900 . 3.500 2.728 2.679 2.813 . 0 0 "[ . 1 . 2]" 1
1859 2 71 LEU MD1 2 72 HIS H 3.400 . 6.500 4.658 4.612 4.715 . 0 0 "[ . 1 . 2]" 1
1860 2 71 LEU MD2 2 72 HIS H 3.400 . 6.500 3.995 3.887 4.071 . 0 0 "[ . 1 . 2]" 1
1861 2 72 HIS H 2 73 ALA MB 3.400 . 6.500 3.926 3.892 3.972 . 0 0 "[ . 1 . 2]" 1
1862 2 72 HIS H 2 73 ALA H 3.900 . 6.000 2.399 2.361 2.457 . 0 0 "[ . 1 . 2]" 1
1863 2 72 HIS H 2 74 GLY H 3.900 . 6.000 4.246 4.210 4.308 . 0 0 "[ . 1 . 2]" 1
1864 2 71 LEU HB3 2 73 ALA H 3.900 . 6.000 2.672 2.573 2.738 . 0 0 "[ . 1 . 2]" 1
1865 2 71 LEU H 2 73 ALA H 3.900 . 6.000 4.498 4.446 4.586 . 0 0 "[ . 1 . 2]" 1
1866 2 72 HIS QB 2 73 ALA H 3.900 . 7.000 3.719 3.620 3.833 . 0 0 "[ . 1 . 2]" 1
1867 2 73 ALA H 2 74 GLY H 3.900 . 6.000 2.445 2.313 2.548 . 0 0 "[ . 1 . 2]" 1
1868 2 70 VAL MG1 2 74 GLY H 3.400 . 6.500 4.997 4.871 5.213 . 0 0 "[ . 1 . 2]" 1
1869 2 71 LEU HB2 2 74 GLY H 3.400 . 5.000 3.287 3.095 3.384 . 0 0 "[ . 1 . 2]" 1
1870 2 71 LEU MD1 2 74 GLY H 3.900 . 7.500 4.825 4.702 4.962 . 0 0 "[ . 1 . 2]" 1
1871 2 71 LEU MD2 2 74 GLY H 3.900 . 7.500 5.737 5.572 5.833 . 0 0 "[ . 1 . 2]" 1
1872 2 72 HIS QB 2 74 GLY H 3.900 . 7.000 4.546 4.461 4.735 . 0 0 "[ . 1 . 2]" 1
1873 2 73 ALA HA 2 74 GLY H 3.400 . 5.000 3.337 3.294 3.430 . 0 0 "[ . 1 . 2]" 1
1874 2 73 ALA MB 2 74 GLY H 2.900 . 5.000 3.136 2.877 3.222 . 0 0 "[ . 1 . 2]" 1
1875 2 74 GLY H 2 75 ASP QB 3.900 . 7.000 4.402 4.257 4.753 . 0 0 "[ . 1 . 2]" 1
1876 2 74 GLY H 2 75 ASP H 2.400 . 2.900 2.230 2.064 2.289 . 0 0 "[ . 1 . 2]" 1
1877 2 70 VAL MG1 2 75 ASP H 3.900 . 7.500 4.888 4.706 5.092 . 0 0 "[ . 1 . 2]" 1
1878 2 71 LEU HB2 2 75 ASP H 2.900 . 3.500 2.646 2.428 2.829 . 0 0 "[ . 1 . 2]" 1
1879 2 71 LEU MD1 2 75 ASP H 3.400 . 6.500 3.573 3.440 3.843 . 0 0 "[ . 1 . 2]" 1
1880 2 71 LEU MD2 2 75 ASP H 3.400 . 6.500 5.079 5.012 5.167 . 0 0 "[ . 1 . 2]" 1
1881 2 72 HIS HA 2 75 ASP H 3.400 . 5.000 5.098 5.048 5.167 0.167 6 0 "[ . 1 . 2]" 1
1882 2 73 ALA MB 2 75 ASP H 2.400 . 4.400 2.959 2.796 3.057 . 0 0 "[ . 1 . 2]" 1
1883 2 73 ALA H 2 75 ASP H 3.900 . 6.000 3.448 3.318 3.564 . 0 0 "[ . 1 . 2]" 1
1884 2 74 GLY QA 2 75 ASP H 2.900 . 4.500 2.866 2.827 2.918 . 0 0 "[ . 1 . 2]" 1
1885 2 75 ASP H 2 76 THR HA 3.900 . 6.000 4.893 4.853 4.931 . 0 0 "[ . 1 . 2]" 1
1886 2 75 ASP H 2 76 THR MG 3.900 . 7.500 4.357 4.195 4.583 . 0 0 "[ . 1 . 2]" 1
1887 2 70 VAL HA 2 76 THR H 3.400 . 5.000 4.992 4.875 5.037 0.037 5 0 "[ . 1 . 2]" 1
1888 2 70 VAL MG2 2 76 THR H 3.900 . 7.500 5.937 5.816 6.026 . 0 0 "[ . 1 . 2]" 1
1889 2 71 LEU HB2 2 76 THR H 3.900 . 6.000 5.624 5.273 5.855 . 0 0 "[ . 1 . 2]" 1
1890 2 71 LEU MD1 2 76 THR H 3.900 . 7.500 4.483 4.227 4.794 . 0 0 "[ . 1 . 2]" 1
1891 2 71 LEU MD2 2 76 THR H 3.900 . 7.500 5.664 5.496 5.812 . 0 0 "[ . 1 . 2]" 1
1892 2 71 LEU HG 2 76 THR H 3.900 . 6.000 4.537 4.380 4.707 . 0 0 "[ . 1 . 2]" 1
1893 2 71 LEU H 2 76 THR H 3.900 . 6.000 4.747 4.681 4.820 . 0 0 "[ . 1 . 2]" 1
1894 2 75 ASP HA 2 76 THR H 2.400 . 2.900 2.362 2.252 2.526 . 0 0 "[ . 1 . 2]" 1
1895 2 75 ASP QB 2 76 THR H 2.400 . 3.900 3.142 2.182 3.425 . 0 0 "[ . 1 . 2]" 1
1896 2 75 ASP H 2 76 THR H 3.400 . 5.000 4.451 4.435 4.461 . 0 0 "[ . 1 . 2]" 1
1897 2 76 THR H 2 77 THR H 3.400 . 5.000 4.266 4.210 4.372 . 0 0 "[ . 1 . 2]" 1
1898 2 68 GLN QG 2 77 THR H 3.400 . 6.000 4.347 4.064 4.602 . 0 0 "[ . 1 . 2]" 1
1899 2 69 LEU HA 2 77 THR H 3.900 . 6.000 4.234 4.130 4.328 . 0 0 "[ . 1 . 2]" 1
1900 2 69 LEU HB2 2 77 THR H 3.400 . 5.000 2.494 2.329 2.678 . 0 0 "[ . 1 . 2]" 1
1901 2 70 VAL MG2 2 77 THR H 3.400 . 6.500 4.544 4.422 4.662 . 0 0 "[ . 1 . 2]" 1
1902 2 71 LEU MD2 2 77 THR H 3.400 . 6.500 3.686 3.481 3.927 . 0 0 "[ . 1 . 2]" 1
1903 2 71 LEU HG 2 77 THR H 3.400 . 5.000 3.708 3.482 3.942 . 0 0 "[ . 1 . 2]" 1
1904 2 76 THR HA 2 77 THR H 2.400 . 2.900 2.186 2.166 2.250 . 0 0 "[ . 1 . 2]" 1
1905 2 76 THR HB 2 77 THR H 3.400 . 5.000 3.199 2.857 3.273 . 0 0 "[ . 1 . 2]" 1
1906 2 76 THR MG 2 77 THR H 2.900 . 5.000 3.790 3.603 3.871 . 0 0 "[ . 1 . 2]" 1
1907 2 66 GLN QE 2 78 ASN QD 3.900 . 8.000 3.540 2.975 4.008 . 0 0 "[ . 1 . 2]" 1
1908 2 20 LYS QB 2 78 ASN H 3.900 . 7.000 5.973 5.272 6.241 . 0 0 "[ . 1 . 2]" 1
1909 2 68 GLN HA 2 78 ASN H 3.900 . 6.000 4.459 4.261 4.571 . 0 0 "[ . 1 . 2]" 1
1910 2 77 THR HA 2 78 ASN H 2.400 . 2.900 2.224 2.194 2.242 . 0 0 "[ . 1 . 2]" 1
1911 2 77 THR HB 2 78 ASN H 3.900 . 6.000 4.329 4.252 4.378 . 0 0 "[ . 1 . 2]" 1
1912 2 77 THR MG 2 78 ASN H 2.400 . 4.400 3.281 3.070 3.422 . 0 0 "[ . 1 . 2]" 1
1913 2 77 THR H 2 78 ASN H 3.400 . 5.000 4.188 4.063 4.347 . 0 0 "[ . 1 . 2]" 1
1914 2 78 ASN H 2 79 PHE QE 3.900 . 8.000 5.832 5.689 5.999 . 0 0 "[ . 1 . 2]" 1
1915 2 78 ASN H 2 79 PHE H 3.400 . 5.000 4.557 4.443 4.594 . 0 0 "[ . 1 . 2]" 1
1916 2 19 GLN HA 2 79 PHE H 3.900 . 6.000 5.462 5.061 5.733 . 0 0 "[ . 1 . 2]" 1
1917 2 66 GLN HA 2 79 PHE H 3.900 . 6.000 4.770 4.391 5.241 . 0 0 "[ . 1 . 2]" 1
1918 2 67 LEU HB3 2 79 PHE H 3.900 . 6.000 3.809 3.359 4.099 . 0 0 "[ . 1 . 2]" 1
1919 2 67 LEU HB2 2 79 PHE H 3.900 . 6.000 4.935 4.663 5.235 . 0 0 "[ . 1 . 2]" 1
1920 2 67 LEU MD2 2 79 PHE H 3.900 . 7.500 5.003 4.528 5.312 . 0 0 "[ . 1 . 2]" 1
1921 2 67 LEU HG 2 79 PHE H 3.900 . 6.000 5.578 5.218 5.889 . 0 0 "[ . 1 . 2]" 1
1922 2 68 GLN HA 2 79 PHE H 3.400 . 5.000 2.947 2.511 3.229 . 0 0 "[ . 1 . 2]" 1
1923 2 68 GLN H 2 79 PHE H 3.900 . 6.000 4.633 4.408 4.846 . 0 0 "[ . 1 . 2]" 1
1924 2 77 THR MG 2 79 PHE H 3.400 . 6.500 5.122 4.873 5.207 . 0 0 "[ . 1 . 2]" 1
1925 2 78 ASN HA 2 79 PHE H 2.400 . 2.900 2.175 2.079 2.248 . 0 0 "[ . 1 . 2]" 1
1926 2 17 VAL HA 2 80 HIS H 3.900 . 6.000 4.557 4.055 4.887 . 0 0 "[ . 1 . 2]" 1
1927 2 17 VAL MG1 2 80 HIS H 3.400 . 6.500 2.955 2.477 3.322 . 0 0 "[ . 1 . 2]" 1
1928 2 18 ARG HB3 2 80 HIS H 3.400 . 5.000 4.528 3.659 4.980 . 0 0 "[ . 1 . 2]" 1
1929 2 18 ARG HB2 2 80 HIS H 3.400 . 5.000 3.505 3.206 3.848 . 0 0 "[ . 1 . 2]" 1
1930 2 19 GLN HA 2 80 HIS H 3.900 . 6.000 3.513 3.099 3.817 . 0 0 "[ . 1 . 2]" 1
1931 2 20 LYS H 2 80 HIS H 3.900 . 6.000 4.648 3.895 5.212 . 0 0 "[ . 1 . 2]" 1
1932 2 66 GLN HB3 2 80 HIS H 3.900 . 6.000 5.110 4.826 5.455 . 0 0 "[ . 1 . 2]" 1
1933 2 66 GLN QG 2 80 HIS H 3.900 . 7.000 4.697 4.171 5.233 . 0 0 "[ . 1 . 2]" 1
1934 2 79 PHE HA 2 80 HIS H 2.400 . 2.900 2.103 2.058 2.150 . 0 0 "[ . 1 . 2]" 1
1935 2 79 PHE HB3 2 80 HIS H 3.400 . 5.000 3.620 3.291 3.806 . 0 0 "[ . 1 . 2]" 1
1936 2 79 PHE HB2 2 80 HIS H 3.400 . 5.000 4.422 4.295 4.484 . 0 0 "[ . 1 . 2]" 1
1937 2 79 PHE QD 2 80 HIS H 3.400 . 7.000 3.872 3.550 4.066 . 0 0 "[ . 1 . 2]" 1
1938 2 17 VAL HA 2 81 PHE H 3.900 . 6.000 4.712 4.528 4.877 . 0 0 "[ . 1 . 2]" 1
1939 2 17 VAL MG1 2 81 PHE H 3.900 . 7.500 4.282 4.129 4.664 . 0 0 "[ . 1 . 2]" 1
1940 2 64 LYS QB 2 81 PHE H 3.900 . 7.000 4.293 3.835 4.754 . 0 0 "[ . 1 . 2]" 1
1941 2 65 ILE HB 2 81 PHE H 3.900 . 6.000 4.294 3.820 4.644 . 0 0 "[ . 1 . 2]" 1
1942 2 65 ILE MG 2 81 PHE H 3.400 . 6.500 3.868 3.614 4.347 . 0 0 "[ . 1 . 2]" 1
1943 2 66 GLN HA 2 81 PHE H 3.400 . 5.000 2.361 2.102 2.663 . 0 0 "[ . 1 . 2]" 1
1944 2 66 GLN HB3 2 81 PHE H 3.900 . 6.000 4.244 3.890 4.741 . 0 0 "[ . 1 . 2]" 1
1945 2 66 GLN QG 2 81 PHE H 3.400 . 6.000 3.258 2.920 3.626 . 0 0 "[ . 1 . 2]" 1
1946 2 79 PHE HB2 2 81 PHE H 3.900 . 6.000 5.509 5.243 5.860 . 0 0 "[ . 1 . 2]" 1
1947 2 80 HIS HA 2 81 PHE H 2.900 . 3.500 2.180 2.116 2.246 . 0 0 "[ . 1 . 2]" 1
1948 2 80 HIS HD2 2 81 PHE H 3.400 . 5.000 3.252 2.393 4.019 . 0 0 "[ . 1 . 2]" 1
1949 2 81 PHE H 2 82 SER H 3.900 . 6.000 4.194 4.074 4.363 . 0 0 "[ . 1 . 2]" 1
1950 2 81 PHE H 2 87 ALA MB 3.400 . 6.500 4.436 4.130 4.643 . 0 0 "[ . 1 . 2]" 1
1951 2 16 LYS HB3 2 82 SER H 3.900 . 6.000 3.546 3.159 3.933 . 0 0 "[ . 1 . 2]" 1
1952 2 17 VAL HA 2 82 SER H 3.400 . 5.000 2.558 2.309 2.769 . 0 0 "[ . 1 . 2]" 1
1953 2 17 VAL MG2 2 82 SER H 3.400 . 6.500 3.506 3.311 3.942 . 0 0 "[ . 1 . 2]" 1
1954 2 17 VAL H 2 82 SER H 3.900 . 6.000 4.652 4.500 4.746 . 0 0 "[ . 1 . 2]" 1
1955 2 18 ARG QD 2 82 SER H 3.400 . 6.000 4.803 3.748 5.407 . 0 0 "[ . 1 . 2]" 1
1956 2 18 ARG QG 2 82 SER H 3.900 . 7.000 4.148 3.271 5.895 . 0 0 "[ . 1 . 2]" 1
1957 2 18 ARG H 2 82 SER H 3.900 . 6.000 3.498 2.993 4.056 . 0 0 "[ . 1 . 2]" 1
1958 2 80 HIS HD2 2 82 SER H 3.900 . 6.000 3.348 2.811 4.397 . 0 0 "[ . 1 . 2]" 1
1959 2 81 PHE HA 2 82 SER H 2.400 . 2.900 2.237 2.213 2.283 . 0 0 "[ . 1 . 2]" 1
1960 2 81 PHE HB3 2 82 SER H 3.400 . 5.000 3.937 3.735 4.054 . 0 0 "[ . 1 . 2]" 1
1961 2 81 PHE QD 2 82 SER H 3.900 . 8.000 4.643 4.534 4.728 . 0 0 "[ . 1 . 2]" 1
1962 2 82 SER H 2 83 ASN HA 3.400 . 5.000 4.804 4.604 4.925 . 0 0 "[ . 1 . 2]" 1
1963 2 82 SER H 2 83 ASN HB2 3.900 . 6.000 4.341 4.138 4.547 . 0 0 "[ . 1 . 2]" 1
1964 2 82 SER H 2 83 ASN H 3.400 . 5.000 2.507 2.248 2.814 . 0 0 "[ . 1 . 2]" 1
1965 2 16 LYS QD 2 83 ASN QD 3.900 . 8.000 4.209 2.666 6.255 . 0 0 "[ . 1 . 2]" 1
1966 2 83 ASN QD 2 84 GLU H 3.900 . 7.000 3.355 2.607 5.202 . 0 0 "[ . 1 . 2]" 1
1967 2 83 ASN QD 2 85 SER QB 3.400 . 7.000 3.037 2.275 3.815 . 0 0 "[ . 1 . 2]" 1
1968 2 83 ASN QD 2 86 THR MG 3.400 . 7.500 4.793 3.503 5.423 . 0 0 "[ . 1 . 2]" 1
1969 2 83 ASN QD 2 86 THR H 3.900 . 7.000 3.399 2.397 3.931 . 0 0 "[ . 1 . 2]" 1
1970 2 83 ASN QD 2 87 ALA HA 3.900 . 7.000 5.444 3.893 6.085 . 0 0 "[ . 1 . 2]" 1
1971 2 16 LYS HB3 2 83 ASN H 3.400 . 5.000 3.458 2.935 3.907 . 0 0 "[ . 1 . 2]" 1
1972 2 16 LYS HB2 2 83 ASN H 3.400 . 5.000 3.456 3.153 4.017 . 0 0 "[ . 1 . 2]" 1
1973 2 16 LYS QG 2 83 ASN H 3.900 . 7.000 5.067 4.586 5.649 . 0 0 "[ . 1 . 2]" 1
1974 2 17 VAL MG2 2 83 ASN H 3.900 . 7.500 4.165 3.911 4.533 . 0 0 "[ . 1 . 2]" 1
1975 2 81 PHE HA 2 83 ASN H 3.400 . 5.000 3.369 3.257 3.560 . 0 0 "[ . 1 . 2]" 1
1976 2 81 PHE HB2 2 83 ASN H 3.900 . 6.000 4.784 4.503 5.067 . 0 0 "[ . 1 . 2]" 1
1977 2 82 SER HA 2 83 ASN H 3.400 . 5.000 3.191 2.976 3.309 . 0 0 "[ . 1 . 2]" 1
1978 2 82 SER HB3 2 83 ASN H 3.900 . 6.000 4.622 4.575 4.688 . 0 0 "[ . 1 . 2]" 1
1979 2 83 ASN H 2 84 GLU H 3.900 . 6.000 4.084 3.936 4.136 . 0 0 "[ . 1 . 2]" 1
1980 2 83 ASN H 2 87 ALA MB 3.400 . 6.500 2.496 2.047 2.866 . 0 0 "[ . 1 . 2]" 1
1981 2 83 ASN H 2 87 ALA H 3.900 . 6.000 4.456 4.156 4.770 . 0 0 "[ . 1 . 2]" 1
1982 2 16 LYS QD 2 84 GLU H 3.900 . 7.000 4.533 3.243 5.333 . 0 0 "[ . 1 . 2]" 1
1983 2 83 ASN HB3 2 84 GLU H 3.400 . 5.000 4.392 4.282 4.459 . 0 0 "[ . 1 . 2]" 1
1984 2 83 ASN HB2 2 84 GLU H 3.400 . 5.000 4.533 4.485 4.602 . 0 0 "[ . 1 . 2]" 1
1985 2 84 GLU H 2 87 ALA MB 3.900 . 7.500 4.049 3.897 4.171 . 0 0 "[ . 1 . 2]" 1
1986 2 83 ASN QD 2 85 SER H 3.900 . 7.000 2.947 2.294 3.927 . 0 0 "[ . 1 . 2]" 1
1987 2 84 GLU QB 2 85 SER H 3.900 . 7.000 3.300 2.748 3.637 . 0 0 "[ . 1 . 2]" 1
1988 2 84 GLU QG 2 85 SER H 3.900 . 7.000 3.098 2.377 4.448 . 0 0 "[ . 1 . 2]" 1
1989 2 85 SER H 2 86 THR H 3.900 . 6.000 2.990 2.827 3.109 . 0 0 "[ . 1 . 2]" 1
1990 2 83 ASN HB3 2 86 THR H 3.900 . 6.000 3.339 3.118 3.524 . 0 0 "[ . 1 . 2]" 1
1991 2 83 ASN HB2 2 86 THR H 3.900 . 6.000 4.748 4.626 4.899 . 0 0 "[ . 1 . 2]" 1
1992 2 83 ASN H 2 86 THR H 3.900 . 6.000 5.514 5.394 5.712 . 0 0 "[ . 1 . 2]" 1
1993 2 84 GLU QB 2 86 THR H 3.900 . 7.000 5.536 5.257 5.757 . 0 0 "[ . 1 . 2]" 1
1994 2 85 SER HA 2 86 THR H 3.400 . 5.000 3.597 3.588 3.605 . 0 0 "[ . 1 . 2]" 1
1995 2 85 SER QB 2 86 THR H 3.400 . 6.000 2.413 2.189 2.763 . 0 0 "[ . 1 . 2]" 1
1996 2 86 THR H 2 87 ALA HA 3.400 . 5.000 4.377 4.314 4.426 . 0 0 "[ . 1 . 2]" 1
1997 2 86 THR H 2 87 ALA MB 3.400 . 6.500 3.960 3.907 4.021 . 0 0 "[ . 1 . 2]" 1
1998 2 86 THR H 2 87 ALA H 2.400 . 2.900 2.261 2.194 2.320 . 0 0 "[ . 1 . 2]" 1
1999 2 86 THR H 2 89 LYS QB 3.900 . 7.000 5.774 5.734 5.900 . 0 0 "[ . 1 . 2]" 1
2000 2 65 ILE MD 2 87 ALA H 3.400 . 6.500 4.636 4.248 5.075 . 0 0 "[ . 1 . 2]" 1
2001 2 83 ASN HB3 2 87 ALA H 3.400 . 5.000 3.115 2.722 3.409 . 0 0 "[ . 1 . 2]" 1
2002 2 83 ASN QD 2 87 ALA H 3.900 . 7.000 4.424 3.523 4.856 . 0 0 "[ . 1 . 2]" 1
2003 2 84 GLU HA 2 87 ALA H 3.400 . 5.000 4.086 3.866 4.372 . 0 0 "[ . 1 . 2]" 1
2004 2 84 GLU QB 2 87 ALA H 3.900 . 7.000 5.404 5.197 5.649 . 0 0 "[ . 1 . 2]" 1
2005 2 85 SER HA 2 87 ALA H 3.400 . 5.000 4.832 4.761 4.890 . 0 0 "[ . 1 . 2]" 1
2006 2 86 THR HA 2 87 ALA H 3.400 . 5.000 3.196 3.121 3.240 . 0 0 "[ . 1 . 2]" 1
2007 2 86 THR MG 2 87 ALA H 3.400 . 6.500 4.380 4.359 4.398 . 0 0 "[ . 1 . 2]" 1
2008 2 87 ALA H 2 88 VAL HB 3.400 . 5.000 5.034 4.997 5.059 0.059 6 0 "[ . 1 . 2]" 1
2009 2 87 ALA H 2 88 VAL H 3.400 . 5.000 3.094 3.033 3.164 . 0 0 "[ . 1 . 2]" 1
2010 2 87 ALA H 2 90 GLU HB2 3.900 . 6.000 4.124 4.088 4.165 . 0 0 "[ . 1 . 2]" 1
2011 2 87 ALA H 2 90 GLU QG 3.400 . 6.000 4.919 4.720 5.085 . 0 0 "[ . 1 . 2]" 1
2012 2 87 ALA H 2 90 GLU H 3.900 . 6.000 4.543 4.495 4.576 . 0 0 "[ . 1 . 2]" 1
2013 2 65 ILE HB 2 88 VAL H 3.900 . 6.000 4.404 4.014 4.664 . 0 0 "[ . 1 . 2]" 1
2014 2 65 ILE MD 2 88 VAL H 3.400 . 6.500 3.181 2.805 3.422 . 0 0 "[ . 1 . 2]" 1
2015 2 84 GLU HA 2 88 VAL H 3.900 . 6.000 5.394 5.086 5.703 . 0 0 "[ . 1 . 2]" 1
2016 2 86 THR HA 2 88 VAL H 3.400 . 5.000 3.959 3.818 4.103 . 0 0 "[ . 1 . 2]" 1
2017 2 86 THR H 2 88 VAL H 3.900 . 6.000 5.042 4.980 5.136 . 0 0 "[ . 1 . 2]" 1
2018 2 87 ALA HA 2 88 VAL H 3.400 . 5.000 3.573 3.551 3.583 . 0 0 "[ . 1 . 2]" 1
2019 2 87 ALA MB 2 88 VAL H 2.400 . 4.400 2.415 2.300 2.510 . 0 0 "[ . 1 . 2]" 1
2020 2 88 VAL H 2 89 LYS QD 3.400 . 6.000 4.001 3.291 4.546 . 0 0 "[ . 1 . 2]" 1
2021 2 88 VAL H 2 89 LYS H 2.400 . 2.900 2.828 2.794 2.852 . 0 0 "[ . 1 . 2]" 1
2022 2 65 ILE MG 2 89 LYS H 3.900 . 7.500 4.970 4.831 5.246 . 0 0 "[ . 1 . 2]" 1
2023 2 86 THR HA 2 89 LYS H 3.400 . 5.000 3.513 3.464 3.587 . 0 0 "[ . 1 . 2]" 1
2024 2 88 VAL HA 2 89 LYS H 3.400 . 5.000 3.557 3.548 3.565 . 0 0 "[ . 1 . 2]" 1
2025 2 88 VAL MG1 2 89 LYS H 2.400 . 4.400 2.648 2.565 2.874 . 0 0 "[ . 1 . 2]" 1
2026 2 88 VAL MG2 2 89 LYS H 3.400 . 6.500 4.013 3.896 4.079 . 0 0 "[ . 1 . 2]" 1
2027 2 89 LYS H 2 90 GLU QG 3.400 . 6.000 4.865 4.692 4.952 . 0 0 "[ . 1 . 2]" 1
2028 2 89 LYS H 2 90 GLU H 2.400 . 2.900 2.518 2.413 2.575 . 0 0 "[ . 1 . 2]" 1
2029 2 89 LYS H 2 92 ASP HB2 3.900 . 6.000 4.662 4.617 4.720 . 0 0 "[ . 1 . 2]" 1
2030 2 86 THR HB 2 90 GLU H 3.400 . 5.000 3.356 3.226 3.441 . 0 0 "[ . 1 . 2]" 1
2031 2 86 THR MG 2 90 GLU H 3.400 . 6.500 4.735 4.633 4.819 . 0 0 "[ . 1 . 2]" 1
2032 2 88 VAL HA 2 90 GLU H 3.900 . 6.000 4.397 4.329 4.470 . 0 0 "[ . 1 . 2]" 1
2033 2 88 VAL MG1 2 90 GLU H 3.900 . 7.500 4.517 4.480 4.597 . 0 0 "[ . 1 . 2]" 1
2034 2 89 LYS QB 2 90 GLU H 2.400 . 3.900 2.664 2.574 2.971 . 0 0 "[ . 1 . 2]" 1
2035 2 89 LYS QG 2 90 GLU H 3.400 . 6.000 4.067 3.950 4.739 . 0 0 "[ . 1 . 2]" 1
2036 2 90 GLU H 2 91 ARG HA 3.900 . 6.000 5.248 5.160 5.278 . 0 0 "[ . 1 . 2]" 1
2037 2 90 GLU H 2 91 ARG HB2 3.900 . 6.000 4.939 4.740 5.017 . 0 0 "[ . 1 . 2]" 1
2038 2 90 GLU H 2 91 ARG H 2.900 . 3.500 2.621 2.499 2.662 . 0 0 "[ . 1 . 2]" 1
2039 2 90 GLU H 2 93 ALA H 3.900 . 6.000 4.507 4.462 4.616 . 0 0 "[ . 1 . 2]" 1
2040 2 14 VAL MG1 2 91 ARG H 3.400 . 6.500 4.655 4.498 4.865 . 0 0 "[ . 1 . 2]" 1
2041 2 81 PHE QD 2 91 ARG H 3.400 . 7.000 3.681 3.376 4.036 . 0 0 "[ . 1 . 2]" 1
2042 2 81 PHE QE 2 91 ARG H 3.400 . 7.000 3.684 3.333 4.012 . 0 0 "[ . 1 . 2]" 1
2043 2 88 VAL HA 2 91 ARG H 3.400 . 5.000 3.578 3.514 3.683 . 0 0 "[ . 1 . 2]" 1
2044 2 90 GLU HA 2 91 ARG H 3.400 . 5.000 3.546 3.514 3.554 . 0 0 "[ . 1 . 2]" 1
2045 2 90 GLU HB3 2 91 ARG H 3.400 . 5.000 3.225 3.153 3.312 . 0 0 "[ . 1 . 2]" 1
2046 2 90 GLU HB2 2 91 ARG H 3.400 . 5.000 2.764 2.699 2.824 . 0 0 "[ . 1 . 2]" 1
2047 2 88 VAL MG1 2 92 ASP H 3.400 . 6.500 4.252 4.194 4.333 . 0 0 "[ . 1 . 2]" 1
2048 2 89 LYS HA 2 92 ASP H 3.400 . 5.000 3.330 2.973 3.419 . 0 0 "[ . 1 . 2]" 1
2049 2 89 LYS H 2 92 ASP H 3.400 . 5.000 4.655 4.577 4.692 . 0 0 "[ . 1 . 2]" 1
2050 2 91 ARG HB2 2 92 ASP H 3.400 . 5.000 3.613 3.528 3.656 . 0 0 "[ . 1 . 2]" 1
2051 2 91 ARG QG 2 92 ASP H 3.900 . 7.000 3.624 3.483 4.169 . 0 0 "[ . 1 . 2]" 1
2052 2 92 ASP H 2 93 ALA MB 3.400 . 6.500 4.496 4.461 4.526 . 0 0 "[ . 1 . 2]" 1
2053 2 92 ASP H 2 93 ALA H 2.400 . 2.900 2.796 2.758 2.842 . 0 0 "[ . 1 . 2]" 1
2054 2 92 ASP H 2 94 VAL H 3.400 . 5.000 4.288 4.233 4.337 . 0 0 "[ . 1 . 2]" 1
2055 2 12 LEU MD2 2 93 ALA H 3.400 . 6.500 4.674 4.482 4.875 . 0 0 "[ . 1 . 2]" 1
2056 2 89 LYS QB 2 93 ALA H 3.400 . 6.000 4.478 4.380 4.559 . 0 0 "[ . 1 . 2]" 1
2057 2 90 GLU HA 2 93 ALA H 3.400 . 5.000 3.213 3.123 3.298 . 0 0 "[ . 1 . 2]" 1
2058 2 91 ARG HB2 2 93 ALA H 3.900 . 6.000 5.862 5.792 5.919 . 0 0 "[ . 1 . 2]" 1
2059 2 92 ASP HA 2 93 ALA H 3.400 . 5.000 3.567 3.551 3.579 . 0 0 "[ . 1 . 2]" 1
2060 2 92 ASP HB3 2 93 ALA H 3.400 . 5.000 3.236 3.163 3.300 . 0 0 "[ . 1 . 2]" 1
2061 2 92 ASP HB2 2 93 ALA H 2.400 . 2.900 2.898 2.630 2.947 0.047 8 0 "[ . 1 . 2]" 1
2062 2 93 ALA H 2 94 VAL HA 3.900 . 6.000 5.331 5.311 5.355 . 0 0 "[ . 1 . 2]" 1
2063 2 93 ALA H 2 94 VAL HB 3.400 . 5.000 5.022 4.964 5.047 0.047 3 0 "[ . 1 . 2]" 1
2064 2 93 ALA H 2 94 VAL MG2 3.400 . 6.500 4.042 3.981 4.102 . 0 0 "[ . 1 . 2]" 1
2065 2 93 ALA H 2 94 VAL H 2.400 . 2.900 2.702 2.680 2.731 . 0 0 "[ . 1 . 2]" 1
2066 2 93 ALA H 2 95 LYS H 3.400 . 5.000 4.010 3.943 4.071 . 0 0 "[ . 1 . 2]" 1
2067 2 12 LEU MD2 2 94 VAL H 3.400 . 6.500 3.055 2.960 3.174 . 0 0 "[ . 1 . 2]" 1
2068 2 26 LEU MD2 2 94 VAL H 3.900 . 7.500 5.049 4.969 5.104 . 0 0 "[ . 1 . 2]" 1
2069 2 81 PHE QE 2 94 VAL H 3.900 . 8.000 4.495 4.396 4.600 . 0 0 "[ . 1 . 2]" 1
2070 2 81 PHE HZ 2 94 VAL H 3.900 . 6.000 4.067 3.956 4.200 . 0 0 "[ . 1 . 2]" 1
2071 2 90 GLU HA 2 94 VAL H 3.900 . 6.000 3.798 3.705 4.033 . 0 0 "[ . 1 . 2]" 1
2072 2 90 GLU QG 2 94 VAL H 3.900 . 7.000 5.190 5.078 5.443 . 0 0 "[ . 1 . 2]" 1
2073 2 91 ARG HA 2 94 VAL H 3.400 . 5.000 3.801 3.705 3.880 . 0 0 "[ . 1 . 2]" 1
2074 2 93 ALA HA 2 94 VAL H 3.400 . 5.000 3.585 3.578 3.593 . 0 0 "[ . 1 . 2]" 1
2075 2 93 ALA MB 2 94 VAL H 2.400 . 4.400 2.551 2.499 2.601 . 0 0 "[ . 1 . 2]" 1
2076 2 94 VAL H 2 95 LYS HA 3.900 . 6.000 5.212 5.179 5.246 . 0 0 "[ . 1 . 2]" 1
2077 2 94 VAL H 2 95 LYS HB3 3.400 . 5.000 4.455 4.295 4.553 . 0 0 "[ . 1 . 2]" 1
2078 2 94 VAL H 2 95 LYS HB2 3.400 . 5.000 5.046 5.026 5.068 0.068 8 0 "[ . 1 . 2]" 1
2079 2 94 VAL H 2 95 LYS H 2.400 . 2.900 2.559 2.514 2.602 . 0 0 "[ . 1 . 2]" 1
2080 2 94 VAL H 2 96 ASP H 3.400 . 5.000 4.170 4.076 4.274 . 0 0 "[ . 1 . 2]" 1
2081 2 94 VAL H 2 97 LEU H 3.900 . 6.000 4.709 4.646 4.791 . 0 0 "[ . 1 . 2]" 1
2082 2 55 GLN QE 2 95 LYS H 3.900 . 7.000 5.366 3.779 6.254 . 0 0 "[ . 1 . 2]" 1
2083 2 91 ARG HA 2 95 LYS H 3.400 . 5.000 4.000 3.921 4.095 . 0 0 "[ . 1 . 2]" 1
2084 2 92 ASP HA 2 95 LYS H 3.400 . 5.000 3.579 3.507 3.637 . 0 0 "[ . 1 . 2]" 1
2085 2 92 ASP H 2 95 LYS H 3.900 . 6.000 4.619 4.582 4.661 . 0 0 "[ . 1 . 2]" 1
2086 2 94 VAL HA 2 95 LYS H 3.400 . 5.000 3.522 3.513 3.533 . 0 0 "[ . 1 . 2]" 1
2087 2 94 VAL HB 2 95 LYS H 2.400 . 2.900 2.485 2.418 2.593 . 0 0 "[ . 1 . 2]" 1
2088 2 94 VAL MG1 2 95 LYS H 2.400 . 4.400 3.533 3.462 3.604 . 0 0 "[ . 1 . 2]" 1
2089 2 94 VAL MG2 2 95 LYS H 3.400 . 6.500 3.626 3.546 3.672 . 0 0 "[ . 1 . 2]" 1
2090 2 95 LYS H 2 96 ASP HB3 3.900 . 6.000 5.980 5.921 6.007 0.007 20 0 "[ . 1 . 2]" 1
2091 2 95 LYS H 2 96 ASP H 2.900 . 3.500 2.759 2.711 2.809 . 0 0 "[ . 1 . 2]" 1
2092 2 95 LYS H 2 97 LEU H 3.900 . 6.000 4.316 4.248 4.377 . 0 0 "[ . 1 . 2]" 1
2093 2 95 LYS H 2 98 LEU MD1 3.400 . 6.500 4.205 4.026 4.340 . 0 0 "[ . 1 . 2]" 1
2094 2 55 GLN QE 2 96 ASP H 3.900 . 7.000 5.210 4.375 6.108 . 0 0 "[ . 1 . 2]" 1
2095 2 57 ILE MD 2 96 ASP H 3.900 . 7.500 5.903 5.666 6.116 . 0 0 "[ . 1 . 2]" 1
2096 2 93 ALA HA 2 96 ASP H 3.400 . 5.000 3.282 3.217 3.344 . 0 0 "[ . 1 . 2]" 1
2097 2 93 ALA H 2 96 ASP H 3.900 . 6.000 4.477 4.423 4.524 . 0 0 "[ . 1 . 2]" 1
2098 2 94 VAL HA 2 96 ASP H 3.900 . 6.000 4.730 4.610 4.847 . 0 0 "[ . 1 . 2]" 1
2099 2 94 VAL MG1 2 96 ASP H 3.900 . 7.500 5.297 5.196 5.383 . 0 0 "[ . 1 . 2]" 1
2100 2 95 LYS HA 2 96 ASP H 3.400 . 5.000 3.527 3.513 3.537 . 0 0 "[ . 1 . 2]" 1
2101 2 95 LYS HB3 2 96 ASP H 2.400 . 2.900 2.251 2.173 2.328 . 0 0 "[ . 1 . 2]" 1
2102 2 95 LYS HB2 2 96 ASP H 3.400 . 5.000 3.699 3.648 3.751 . 0 0 "[ . 1 . 2]" 1
2103 2 95 LYS QD 2 96 ASP H 3.400 . 6.000 3.389 2.397 4.393 . 0 0 "[ . 1 . 2]" 1
2104 2 95 LYS QE 2 96 ASP H 3.400 . 6.000 3.325 2.212 3.800 . 0 0 "[ . 1 . 2]" 1
2105 2 96 ASP H 2 97 LEU H 2.400 . 2.900 2.893 2.844 2.954 0.054 16 0 "[ . 1 . 2]" 1
2106 2 96 ASP H 2 98 LEU HB2 3.900 . 6.000 5.093 4.922 5.222 . 0 0 "[ . 1 . 2]" 1
2107 2 96 ASP H 2 98 LEU H 3.400 . 5.000 4.137 3.998 4.292 . 0 0 "[ . 1 . 2]" 1
2108 2 96 ASP H 2 99 GLN H 3.400 . 5.000 4.615 4.534 4.719 . 0 0 "[ . 1 . 2]" 1
2109 2 28 LEU MD1 2 97 LEU H 3.400 . 6.500 4.360 4.215 4.473 . 0 0 "[ . 1 . 2]" 1
2110 2 55 GLN QE 2 97 LEU H 3.900 . 7.000 5.968 5.058 6.405 . 0 0 "[ . 1 . 2]" 1
2111 2 94 VAL HA 2 97 LEU H 3.400 . 5.000 3.750 3.684 3.824 . 0 0 "[ . 1 . 2]" 1
2112 2 95 LYS HA 2 97 LEU H 3.900 . 6.000 4.832 4.765 4.904 . 0 0 "[ . 1 . 2]" 1
2113 2 95 LYS HB3 2 97 LEU H 3.400 . 5.000 4.986 4.917 5.037 0.037 18 0 "[ . 1 . 2]" 1
2114 2 96 ASP HA 2 97 LEU H 3.400 . 5.000 3.553 3.539 3.565 . 0 0 "[ . 1 . 2]" 1
2115 2 96 ASP HB3 2 97 LEU H 2.400 . 2.900 2.952 2.911 2.997 0.097 7 0 "[ . 1 . 2]" 1
2116 2 96 ASP HB2 2 97 LEU H 2.400 . 2.900 2.637 2.582 2.686 . 0 0 "[ . 1 . 2]" 1
2117 2 97 LEU H 2 98 LEU HA 3.900 . 6.000 5.321 5.215 5.379 . 0 0 "[ . 1 . 2]" 1
2118 2 97 LEU H 2 98 LEU HB2 3.400 . 5.000 4.763 4.678 4.825 . 0 0 "[ . 1 . 2]" 1
2119 2 97 LEU H 2 98 LEU H 2.400 . 2.900 2.713 2.600 2.779 . 0 0 "[ . 1 . 2]" 1
2120 2 97 LEU H 2 99 GLN H 3.400 . 5.000 4.269 4.077 4.398 . 0 0 "[ . 1 . 2]" 1
2121 2 97 LEU H 2 100 GLN QG 3.400 . 6.000 4.662 4.437 5.087 . 0 0 "[ . 1 . 2]" 1
2122 2 97 LEU H 2 100 GLN H 3.900 . 6.000 4.704 4.553 4.808 . 0 0 "[ . 1 . 2]" 1
2123 2 97 LEU H 2 101 LEU MD1 3.400 . 6.500 5.221 5.114 5.246 . 0 0 "[ . 1 . 2]" 1
2124 2 94 VAL HA 2 98 LEU H 3.400 . 5.000 3.942 3.771 4.172 . 0 0 "[ . 1 . 2]" 1
2125 2 95 LYS HA 2 98 LEU H 3.400 . 5.000 3.741 3.615 3.856 . 0 0 "[ . 1 . 2]" 1
2126 2 96 ASP HA 2 98 LEU H 3.900 . 6.000 4.436 4.170 4.605 . 0 0 "[ . 1 . 2]" 1
2127 2 96 ASP HB2 2 98 LEU H 3.900 . 6.000 4.976 4.819 5.111 . 0 0 "[ . 1 . 2]" 1
2128 2 97 LEU HA 2 98 LEU H 3.400 . 5.000 3.547 3.484 3.581 . 0 0 "[ . 1 . 2]" 1
2129 2 97 LEU QB 2 98 LEU H 3.400 . 6.000 2.673 2.548 2.869 . 0 0 "[ . 1 . 2]" 1
2130 2 98 LEU H 2 99 GLN H 2.400 . 2.900 2.593 2.433 2.679 . 0 0 "[ . 1 . 2]" 1
2131 2 98 LEU H 2 100 GLN QG 3.400 . 6.000 5.262 5.143 5.382 . 0 0 "[ . 1 . 2]" 1
2132 2 98 LEU H 2 100 GLN H 3.400 . 5.000 3.664 3.540 3.717 . 0 0 "[ . 1 . 2]" 1
2133 2 98 LEU H 2 101 LEU MD1 3.400 . 6.500 4.392 4.226 4.596 . 0 0 "[ . 1 . 2]" 1
2134 2 98 LEU H 2 101 LEU H 3.400 . 5.000 4.364 4.301 4.428 . 0 0 "[ . 1 . 2]" 1
2135 2 95 LYS QE 2 99 GLN QE 3.900 . 8.000 4.917 2.205 6.350 . 0 0 "[ . 1 . 2]" 1
2136 2 95 LYS QG 2 99 GLN QE 3.900 . 8.000 4.109 2.550 5.208 . 0 0 "[ . 1 . 2]" 1
2137 2 96 ASP HA 2 99 GLN QE 3.900 . 7.000 4.720 1.799 6.056 0.001 20 0 "[ . 1 . 2]" 1
2138 2 95 LYS HA 2 99 GLN H 3.400 . 5.000 3.861 3.733 4.116 . 0 0 "[ . 1 . 2]" 1
2139 2 95 LYS QG 2 99 GLN H 3.400 . 6.000 3.984 3.878 4.067 . 0 0 "[ . 1 . 2]" 1
2140 2 96 ASP HA 2 99 GLN H 3.400 . 5.000 3.636 3.460 3.778 . 0 0 "[ . 1 . 2]" 1
2141 2 98 LEU HA 2 99 GLN H 3.400 . 5.000 3.579 3.528 3.606 . 0 0 "[ . 1 . 2]" 1
2142 2 98 LEU HB3 2 99 GLN H 3.400 . 5.000 3.357 3.272 3.437 . 0 0 "[ . 1 . 2]" 1
2143 2 98 LEU MD2 2 99 GLN H 3.400 . 6.500 4.723 4.670 4.755 . 0 0 "[ . 1 . 2]" 1
2144 2 98 LEU HG 2 99 GLN H 3.400 . 5.000 4.664 4.584 4.744 . 0 0 "[ . 1 . 2]" 1
2145 2 99 GLN H 2 100 GLN H 2.400 . 2.900 2.480 2.404 2.520 . 0 0 "[ . 1 . 2]" 1
2146 2 99 GLN H 2 101 LEU H 3.400 . 5.000 4.144 4.076 4.193 . 0 0 "[ . 1 . 2]" 1
2147 2 99 GLN H 2 102 LEU H 3.400 . 5.000 4.643 4.595 4.695 . 0 0 "[ . 1 . 2]" 1
2148 2 96 ASP HB2 2 100 GLN QE 3.900 . 7.000 5.588 4.223 6.063 . 0 0 "[ . 1 . 2]" 1
2149 2 97 LEU HA 2 100 GLN QE 3.400 . 6.000 4.603 3.469 5.270 . 0 0 "[ . 1 . 2]" 1
2150 2 97 LEU QD 2 100 GLN QE 3.400 . 9.900 4.613 3.414 5.510 . 0 0 "[ . 1 . 2]" 1
2151 2 97 LEU QD 2 100 GLN H 3.400 . 8.900 4.663 4.554 4.809 . 0 0 "[ . 1 . 2]" 1
2152 2 98 LEU HA 2 100 GLN H 3.400 . 5.000 3.767 3.634 3.863 . 0 0 "[ . 1 . 2]" 1
2153 2 99 GLN HA 2 100 GLN H 3.400 . 5.000 3.368 3.337 3.399 . 0 0 "[ . 1 . 2]" 1
2154 2 100 GLN H 2 101 LEU HB2 3.400 . 5.000 4.034 3.976 4.109 . 0 0 "[ . 1 . 2]" 1
2155 2 100 GLN H 2 101 LEU MD1 3.900 . 7.500 4.933 4.800 5.046 . 0 0 "[ . 1 . 2]" 1
2156 2 100 GLN H 2 101 LEU HG 3.400 . 5.000 4.876 4.514 5.018 0.018 6 0 "[ . 1 . 2]" 1
2157 2 100 GLN H 2 101 LEU H 2.400 . 2.900 2.313 2.258 2.355 . 0 0 "[ . 1 . 2]" 1
2158 2 100 GLN H 2 102 LEU H 3.400 . 5.000 3.865 3.615 3.989 . 0 0 "[ . 1 . 2]" 1
2159 2 100 GLN H 2 103 PRO QD 3.900 . 7.000 3.996 3.838 4.183 . 0 0 "[ . 1 . 2]" 1
2160 2 49 TYR QE 2 101 LEU H 3.900 . 8.000 5.695 5.349 5.821 . 0 0 "[ . 1 . 2]" 1
2161 2 98 LEU HA 2 101 LEU H 3.400 . 5.000 3.045 2.928 3.140 . 0 0 "[ . 1 . 2]" 1
2162 2 100 GLN HA 2 101 LEU H 3.400 . 5.000 3.480 3.469 3.493 . 0 0 "[ . 1 . 2]" 1
2163 2 100 GLN HB3 2 101 LEU H 2.400 . 2.900 2.983 2.935 3.038 0.138 4 0 "[ . 1 . 2]" 1
2164 2 100 GLN QG 2 101 LEU H 3.400 . 6.000 4.124 4.045 4.254 . 0 0 "[ . 1 . 2]" 1
2165 2 101 LEU H 2 102 LEU HG 3.400 . 5.000 4.535 4.378 4.710 . 0 0 "[ . 1 . 2]" 1
2166 2 101 LEU H 2 102 LEU H 3.400 . 5.000 2.634 2.549 2.698 . 0 0 "[ . 1 . 2]" 1
2167 2 101 LEU H 2 103 PRO QD 3.400 . 6.000 3.613 3.413 3.742 . 0 0 "[ . 1 . 2]" 1
2168 2 49 TYR HB3 2 102 LEU H 3.900 . 6.000 4.172 3.899 4.493 . 0 0 "[ . 1 . 2]" 1
2169 2 98 LEU HA 2 102 LEU H 3.400 . 5.000 2.960 2.838 3.192 . 0 0 "[ . 1 . 2]" 1
2170 2 100 GLN HA 2 102 LEU H 3.400 . 5.000 4.965 4.581 5.052 0.052 7 0 "[ . 1 . 2]" 1
2171 2 101 LEU HB2 2 102 LEU H 2.900 . 3.500 2.809 2.623 3.137 . 0 0 "[ . 1 . 2]" 1
2172 2 101 LEU MD1 2 102 LEU H 3.400 . 6.500 4.608 4.437 4.877 . 0 0 "[ . 1 . 2]" 1
2173 2 102 LEU H 2 103 PRO QD 2.900 . 4.500 2.412 2.012 2.605 . 0 0 "[ . 1 . 2]" 1
2174 2 102 LEU H 2 105 PHE QE 3.900 . 8.000 5.848 4.853 7.341 . 0 0 "[ . 1 . 2]" 1
2175 2 101 LEU HA 2 104 LYS H 3.400 . 5.000 3.871 3.685 4.110 . 0 0 "[ . 1 . 2]" 1
2176 2 101 LEU H 2 104 LYS H 3.900 . 6.000 5.327 5.158 5.466 . 0 0 "[ . 1 . 2]" 1
2177 2 102 LEU H 2 104 LYS H 3.900 . 6.000 4.167 4.000 4.391 . 0 0 "[ . 1 . 2]" 1
2178 2 103 PRO HA 2 104 LYS H 3.400 . 5.000 3.458 3.394 3.514 . 0 0 "[ . 1 . 2]" 1
2179 2 103 PRO QB 2 104 LYS H 3.400 . 6.000 3.264 2.966 3.615 . 0 0 "[ . 1 . 2]" 1
2180 2 103 PRO QD 2 104 LYS H 3.400 . 6.000 2.925 2.680 3.170 . 0 0 "[ . 1 . 2]" 1
2181 2 103 PRO QG 2 104 LYS H 3.400 . 6.000 3.491 2.596 4.175 . 0 0 "[ . 1 . 2]" 1
2182 2 104 LYS H 2 105 PHE HA 3.900 . 6.000 5.055 4.995 5.260 . 0 0 "[ . 1 . 2]" 1
2183 2 104 LYS H 2 105 PHE QD 3.400 . 7.000 3.963 3.146 4.987 . 0 0 "[ . 1 . 2]" 1
2184 2 104 LYS H 2 105 PHE H 2.400 . 2.900 2.406 2.260 2.696 . 0 0 "[ . 1 . 2]" 1
2185 2 49 TYR HB2 2 105 PHE H 3.900 . 6.000 4.740 4.021 5.394 . 0 0 "[ . 1 . 2]" 1
2186 2 49 TYR QD 2 105 PHE H 3.900 . 8.000 5.484 4.875 6.146 . 0 0 "[ . 1 . 2]" 1
2187 2 102 LEU H 2 105 PHE H 3.900 . 6.000 5.319 5.107 5.963 . 0 0 "[ . 1 . 2]" 1
2188 2 103 PRO HA 2 105 PHE H 3.400 . 5.000 3.847 3.427 4.114 . 0 0 "[ . 1 . 2]" 1
2189 2 103 PRO QG 2 105 PHE H 3.900 . 7.000 5.269 4.874 5.626 . 0 0 "[ . 1 . 2]" 1
2190 2 104 LYS HA 2 105 PHE H 3.400 . 5.000 3.375 3.235 3.486 . 0 0 "[ . 1 . 2]" 1
2191 2 104 LYS QB 2 105 PHE H 2.900 . 4.500 3.303 2.769 3.921 . 0 0 "[ . 1 . 2]" 1
2192 2 104 LYS QE 2 105 PHE H 3.900 . 7.000 5.621 5.105 6.151 . 0 0 "[ . 1 . 2]" 1
2193 2 104 LYS QG 2 105 PHE H 3.400 . 6.000 4.015 2.600 4.606 . 0 0 "[ . 1 . 2]" 1
2194 2 105 PHE H 2 106 LYS H 2.400 . 2.900 2.015 1.750 2.586 0.050 11 0 "[ . 1 . 2]" 1
2195 2 104 LYS HA 2 106 LYS H 3.900 . 6.000 4.385 3.492 4.836 . 0 0 "[ . 1 . 2]" 1
2196 2 104 LYS QG 2 106 LYS H 3.900 . 7.000 5.403 4.469 6.034 . 0 0 "[ . 1 . 2]" 1
2197 2 105 PHE HA 2 106 LYS H 3.400 . 5.000 3.365 2.984 3.538 . 0 0 "[ . 1 . 2]" 1
2198 2 105 PHE HB3 2 106 LYS H 3.400 . 5.000 3.996 3.434 4.473 . 0 0 "[ . 1 . 2]" 1
2199 2 105 PHE HB2 2 106 LYS H 3.400 . 5.000 3.249 2.757 3.924 . 0 0 "[ . 1 . 2]" 1
2200 2 105 PHE QD 2 106 LYS H 3.400 . 7.000 4.461 4.025 4.821 . 0 0 "[ . 1 . 2]" 1
2201 2 106 LYS H 2 107 ARG H 3.900 . 6.000 4.436 4.234 4.625 . 0 0 "[ . 1 . 2]" 1
2202 2 106 LYS HA 2 107 ARG H 2.400 . 2.900 2.261 2.074 2.678 . 0 0 "[ . 1 . 2]" 1
2203 2 106 LYS QG 2 107 ARG H 3.400 . 6.000 3.832 2.822 4.755 . 0 0 "[ . 1 . 2]" 1
2204 2 108 LYS QB 2 109 ALA H 3.900 . 7.000 2.951 1.811 4.004 . 0 0 "[ . 1 . 2]" 1
2205 2 109 ALA H 2 110 ASN QB 3.900 . 7.000 4.346 3.475 6.230 . 0 0 "[ . 1 . 2]" 1
2206 2 108 LYS QB 2 110 ASN H 3.900 . 7.000 4.179 1.984 6.357 . 0 0 "[ . 1 . 2]" 1
2207 2 109 ALA HA 2 110 ASN H 2.400 . 2.900 2.785 2.138 3.089 0.189 1 0 "[ . 1 . 2]" 1
2208 2 109 ALA MB 2 110 ASN H 3.400 . 6.500 3.317 1.946 3.714 . 0 0 "[ . 1 . 2]" 1
2209 2 11 LEU HA 2 11 LEU HB3 2.400 . 2.700 2.395 2.346 2.468 . 0 0 "[ . 1 . 2]" 1
2210 2 11 LEU HA 2 11 LEU HB2 2.900 . 3.300 3.012 2.996 3.022 . 0 0 "[ . 1 . 2]" 1
2211 2 11 LEU H 2 11 LEU HA 2.900 . 3.500 2.904 2.873 2.925 . 0 0 "[ . 1 . 2]" 1
2212 2 11 LEU H 2 11 LEU HB3 3.400 . 5.000 3.657 3.622 3.686 . 0 0 "[ . 1 . 2]" 1
2213 2 11 LEU H 2 11 LEU HB2 2.400 . 2.900 2.629 2.475 2.738 . 0 0 "[ . 1 . 2]" 1
2214 2 12 LEU HA 2 12 LEU HB3 2.900 . 3.300 3.007 3.005 3.010 . 0 0 "[ . 1 . 2]" 1
2215 2 12 LEU HA 2 12 LEU HB2 2.400 . 2.700 2.461 2.440 2.490 . 0 0 "[ . 1 . 2]" 1
2216 2 12 LEU H 2 12 LEU HA 2.900 . 3.500 2.938 2.924 2.944 . 0 0 "[ . 1 . 2]" 1
2217 2 12 LEU H 2 12 LEU HB3 2.400 . 2.900 2.721 2.650 2.843 . 0 0 "[ . 1 . 2]" 1
2218 2 12 LEU H 2 12 LEU HB2 2.400 . 2.900 3.097 3.073 3.131 0.231 2 0 "[ . 1 . 2]" 1
2219 2 15 LYS HA 2 15 LYS HB3 2.400 . 2.700 2.528 2.443 2.622 . 0 0 "[ . 1 . 2]" 1
2220 2 15 LYS HA 2 15 LYS HB2 2.900 . 3.300 3.013 2.997 3.022 . 0 0 "[ . 1 . 2]" 1
2221 2 15 LYS H 2 15 LYS HA 2.900 . 3.500 2.948 2.942 2.952 . 0 0 "[ . 1 . 2]" 1
2222 2 15 LYS H 2 15 LYS HB3 3.400 . 5.000 3.696 3.607 3.755 . 0 0 "[ . 1 . 2]" 1
2223 2 15 LYS H 2 15 LYS HB2 2.400 . 2.900 2.508 2.401 2.628 . 0 0 "[ . 1 . 2]" 1
2224 2 16 LYS HA 2 16 LYS HB3 2.400 . 2.700 2.633 2.564 2.682 . 0 0 "[ . 1 . 2]" 1
2225 2 16 LYS HA 2 16 LYS HB2 2.900 . 3.300 2.974 2.956 2.991 . 0 0 "[ . 1 . 2]" 1
2226 2 16 LYS H 2 16 LYS HA 2.900 . 3.500 2.351 2.344 2.362 . 0 0 "[ . 1 . 2]" 1
2227 2 16 LYS H 2 16 LYS HB3 3.400 . 5.000 3.868 3.849 3.898 . 0 0 "[ . 1 . 2]" 1
2228 2 16 LYS H 2 16 LYS HB2 2.400 . 2.900 2.943 2.893 3.030 0.130 20 0 "[ . 1 . 2]" 1
2229 2 18 ARG HA 2 18 ARG HB3 2.400 . 2.700 2.474 2.297 2.669 . 0 0 "[ . 1 . 2]" 1
2230 2 18 ARG HA 2 18 ARG HB2 2.900 . 3.300 3.002 2.968 3.021 . 0 0 "[ . 1 . 2]" 1
2231 2 18 ARG H 2 18 ARG HA 2.900 . 3.500 2.917 2.901 2.928 . 0 0 "[ . 1 . 2]" 1
2232 2 18 ARG H 2 18 ARG HB3 3.400 . 5.000 3.627 3.469 3.712 . 0 0 "[ . 1 . 2]" 1
2233 2 18 ARG H 2 18 ARG HB2 2.400 . 2.900 2.516 2.207 2.874 . 0 0 "[ . 1 . 2]" 1
2234 2 26 LEU HA 2 26 LEU HB3 2.900 . 3.300 3.012 3.008 3.017 . 0 0 "[ . 1 . 2]" 1
2235 2 26 LEU HA 2 26 LEU HB2 2.400 . 2.700 2.438 2.420 2.455 . 0 0 "[ . 1 . 2]" 1
2236 2 26 LEU H 2 26 LEU HA 2.900 . 3.500 2.937 2.931 2.945 . 0 0 "[ . 1 . 2]" 1
2237 2 26 LEU H 2 26 LEU HB3 2.400 . 2.900 2.422 2.385 2.448 . 0 0 "[ . 1 . 2]" 1
2238 2 26 LEU H 2 26 LEU HB2 2.400 . 2.900 2.816 2.763 2.877 . 0 0 "[ . 1 . 2]" 1
2239 2 27 TYR HA 2 27 TYR HB3 2.400 . 2.700 2.446 2.359 2.555 . 0 0 "[ . 1 . 2]" 1
2240 2 27 TYR HA 2 27 TYR HB2 2.900 . 3.300 3.025 3.006 3.032 . 0 0 "[ . 1 . 2]" 1
2241 2 27 TYR H 2 27 TYR HA 2.900 . 3.500 2.942 2.934 2.949 . 0 0 "[ . 1 . 2]" 1
2242 2 27 TYR H 2 27 TYR HB3 3.400 . 5.000 3.857 3.772 3.913 . 0 0 "[ . 1 . 2]" 1
2243 2 27 TYR H 2 27 TYR HB2 2.400 . 2.900 2.795 2.628 2.930 0.030 9 0 "[ . 1 . 2]" 1
2244 2 28 LEU H 2 28 LEU HA 2.900 . 3.500 2.924 2.896 2.944 . 0 0 "[ . 1 . 2]" 1
2245 2 29 MET HA 2 29 MET HB3 2.400 . 2.700 2.464 2.298 2.635 . 0 0 "[ . 1 . 2]" 1
2246 2 29 MET HA 2 29 MET HB2 2.900 . 3.300 3.016 2.970 3.026 . 0 0 "[ . 1 . 2]" 1
2247 2 29 MET H 2 29 MET HA 2.900 . 3.500 2.935 2.912 2.955 . 0 0 "[ . 1 . 2]" 1
2248 2 29 MET H 2 29 MET HB3 3.400 . 5.000 3.674 3.567 3.759 . 0 0 "[ . 1 . 2]" 1
2249 2 29 MET H 2 29 MET HB2 2.400 . 2.900 2.532 2.364 2.844 . 0 0 "[ . 1 . 2]" 1
2250 2 31 GLU HA 2 31 GLU HB3 2.400 . 2.700 2.365 2.294 2.647 . 0 0 "[ . 1 . 2]" 1
2251 2 31 GLU HA 2 31 GLU HB2 2.900 . 3.300 2.988 2.972 3.017 . 0 0 "[ . 1 . 2]" 1
2252 2 31 GLU H 2 31 GLU HA 2.900 . 3.500 2.946 2.932 2.953 . 0 0 "[ . 1 . 2]" 1
2253 2 31 GLU H 2 31 GLU HB3 3.400 . 5.000 3.734 3.594 3.853 . 0 0 "[ . 1 . 2]" 1
2254 2 31 GLU H 2 31 GLU HB2 2.400 . 2.900 2.796 2.411 2.944 0.044 10 0 "[ . 1 . 2]" 1
2255 2 32 ARG HA 2 32 ARG HB3 2.400 . 2.700 2.550 2.452 2.631 . 0 0 "[ . 1 . 2]" 1
2256 2 32 ARG HA 2 32 ARG HB2 2.400 . 2.700 2.354 2.290 2.436 . 0 0 "[ . 1 . 2]" 1
2257 2 32 ARG H 2 32 ARG HA 2.900 . 3.500 2.881 2.868 2.903 . 0 0 "[ . 1 . 2]" 1
2258 2 32 ARG H 2 32 ARG HB3 2.900 . 3.500 3.295 3.176 3.458 . 0 0 "[ . 1 . 2]" 1
2259 2 32 ARG H 2 32 ARG HB2 3.400 . 5.000 4.035 3.994 4.069 . 0 0 "[ . 1 . 2]" 1
2260 2 35 TRP HA 2 35 TRP HB3 2.900 . 3.300 3.014 3.009 3.019 . 0 0 "[ . 1 . 2]" 1
2261 2 35 TRP HA 2 35 TRP HB2 2.400 . 2.700 2.369 2.355 2.380 . 0 0 "[ . 1 . 2]" 1
2262 2 35 TRP H 2 35 TRP HA 2.900 . 3.500 2.905 2.901 2.944 . 0 0 "[ . 1 . 2]" 1
2263 2 35 TRP H 2 35 TRP HB3 2.400 . 2.900 2.781 2.482 2.815 . 0 0 "[ . 1 . 2]" 1
2264 2 35 TRP H 2 35 TRP HB2 2.900 . 3.500 3.441 3.134 3.474 . 0 0 "[ . 1 . 2]" 1
2265 2 43 PHE HA 2 43 PHE HB3 2.400 . 2.700 2.443 2.375 2.532 . 0 0 "[ . 1 . 2]" 1
2266 2 43 PHE HA 2 43 PHE HB2 2.900 . 3.300 3.029 3.016 3.038 . 0 0 "[ . 1 . 2]" 1
2267 2 43 PHE H 2 43 PHE HA 2.900 . 3.500 2.881 2.817 2.906 . 0 0 "[ . 1 . 2]" 1
2268 2 43 PHE H 2 43 PHE HB3 3.400 . 5.000 3.621 3.588 3.654 . 0 0 "[ . 1 . 2]" 1
2269 2 43 PHE H 2 43 PHE HB2 2.400 . 2.900 2.549 2.369 2.682 . 0 0 "[ . 1 . 2]" 1
2270 2 47 HIS HA 2 47 HIS HB3 2.400 . 2.700 2.417 2.383 2.487 . 0 0 "[ . 1 . 2]" 1
2271 2 47 HIS HA 2 47 HIS HB2 2.900 . 3.300 3.026 3.020 3.031 . 0 0 "[ . 1 . 2]" 1
2272 2 47 HIS H 2 47 HIS HA 2.900 . 3.500 2.950 2.942 2.954 . 0 0 "[ . 1 . 2]" 1
2273 2 47 HIS H 2 47 HIS HB3 3.400 . 5.000 3.833 3.803 3.877 . 0 0 "[ . 1 . 2]" 1
2274 2 47 HIS H 2 47 HIS HB2 2.400 . 2.900 2.772 2.684 2.866 . 0 0 "[ . 1 . 2]" 1
2275 2 48 MET HA 2 48 MET HB3 2.400 . 2.700 2.517 2.396 2.679 . 0 0 "[ . 1 . 2]" 1
2276 2 48 MET HA 2 48 MET HB2 2.900 . 3.300 3.019 2.978 3.032 . 0 0 "[ . 1 . 2]" 1
2277 2 48 MET H 2 48 MET HA 2.900 . 3.500 2.909 2.880 2.930 . 0 0 "[ . 1 . 2]" 1
2278 2 48 MET H 2 48 MET HB3 3.400 . 5.000 3.615 3.486 3.668 . 0 0 "[ . 1 . 2]" 1
2279 2 48 MET H 2 48 MET HB2 2.400 . 2.900 2.433 2.201 2.635 . 0 0 "[ . 1 . 2]" 1
2280 2 49 TYR HA 2 49 TYR HB3 2.400 . 2.700 2.475 2.437 2.504 . 0 0 "[ . 1 . 2]" 1
2281 2 49 TYR HA 2 49 TYR HB2 2.900 . 3.300 3.038 3.032 3.042 . 0 0 "[ . 1 . 2]" 1
2282 2 49 TYR H 2 49 TYR HA 2.900 . 3.500 2.827 2.815 2.843 . 0 0 "[ . 1 . 2]" 1
2283 2 49 TYR H 2 49 TYR HB3 3.400 . 5.000 3.577 3.567 3.590 . 0 0 "[ . 1 . 2]" 1
2284 2 49 TYR H 2 49 TYR HB2 2.400 . 2.900 2.502 2.422 2.584 . 0 0 "[ . 1 . 2]" 1
2285 2 51 ASP HA 2 51 ASP HB3 2.400 . 2.700 2.313 2.272 2.646 . 0 0 "[ . 1 . 2]" 1
2286 2 51 ASP HA 2 51 ASP HB2 2.900 . 3.300 2.960 2.949 3.008 . 0 0 "[ . 1 . 2]" 1
2287 2 51 ASP H 2 51 ASP HA 2.900 . 3.500 2.924 2.902 2.941 . 0 0 "[ . 1 . 2]" 1
2288 2 51 ASP H 2 51 ASP HB3 3.400 . 5.000 3.661 3.517 3.716 . 0 0 "[ . 1 . 2]" 1
2289 2 51 ASP H 2 51 ASP HB2 2.400 . 2.900 2.822 2.309 2.903 0.003 7 0 "[ . 1 . 2]" 1
2290 2 53 LYS HA 2 53 LYS HB3 2.900 . 3.300 3.020 3.009 3.030 . 0 0 "[ . 1 . 2]" 1
2291 2 53 LYS HA 2 53 LYS HB2 2.400 . 2.700 2.449 2.376 2.520 . 0 0 "[ . 1 . 2]" 1
2292 2 53 LYS H 2 53 LYS HA 2.900 . 3.500 2.907 2.884 2.919 . 0 0 "[ . 1 . 2]" 1
2293 2 53 LYS H 2 53 LYS HB3 2.400 . 2.900 2.482 2.339 2.648 . 0 0 "[ . 1 . 2]" 1
2294 2 53 LYS H 2 53 LYS HB2 2.400 . 2.900 2.774 2.619 2.921 0.021 8 0 "[ . 1 . 2]" 1
2295 2 54 CYS HA 2 54 CYS HB3 2.400 . 2.700 2.379 2.300 2.505 . 0 0 "[ . 1 . 2]" 1
2296 2 54 CYS HA 2 54 CYS HB2 2.400 . 2.700 2.540 2.416 2.646 . 0 0 "[ . 1 . 2]" 1
2297 2 54 CYS H 2 54 CYS HA 2.900 . 3.500 2.843 2.796 2.895 . 0 0 "[ . 1 . 2]" 1
2298 2 54 CYS H 2 54 CYS HB3 2.900 . 3.500 3.562 3.474 3.666 0.166 19 0 "[ . 1 . 2]" 1
2299 2 54 CYS H 2 54 CYS HB2 3.400 . 5.000 3.893 3.727 4.042 . 0 0 "[ . 1 . 2]" 1
2300 2 55 GLN HA 2 55 GLN HB3 2.400 . 2.700 2.440 2.286 2.608 . 0 0 "[ . 1 . 2]" 1
2301 2 55 GLN HA 2 55 GLN HB2 2.400 . 2.700 2.435 2.288 2.593 . 0 0 "[ . 1 . 2]" 1
2302 2 55 GLN H 2 55 GLN HA 2.900 . 3.500 2.914 2.900 2.935 . 0 0 "[ . 1 . 2]" 1
2303 2 55 GLN H 2 55 GLN HB3 2.900 . 3.500 3.261 3.002 3.539 0.039 17 0 "[ . 1 . 2]" 1
2304 2 55 GLN H 2 55 GLN HB2 3.400 . 5.000 3.861 3.785 3.936 . 0 0 "[ . 1 . 2]" 1
2305 2 56 LYS HA 2 56 LYS HB3 2.400 . 2.700 2.505 2.437 2.557 . 0 0 "[ . 1 . 2]" 1
2306 2 56 LYS HA 2 56 LYS HB2 2.900 . 3.300 3.022 3.016 3.027 . 0 0 "[ . 1 . 2]" 1
2307 2 56 LYS H 2 56 LYS HA 2.900 . 3.500 2.955 2.948 2.966 . 0 0 "[ . 1 . 2]" 1
2308 2 56 LYS H 2 56 LYS HB3 3.400 . 5.000 3.698 3.645 3.740 . 0 0 "[ . 1 . 2]" 1
2309 2 56 LYS H 2 56 LYS HB2 2.400 . 2.900 2.523 2.438 2.615 . 0 0 "[ . 1 . 2]" 1
2310 2 62 LYS HA 2 62 LYS HB3 2.400 . 2.700 2.674 2.669 2.678 . 0 0 "[ . 1 . 2]" 1
2311 2 62 LYS HA 2 62 LYS HB2 2.900 . 3.300 2.994 2.988 3.000 . 0 0 "[ . 1 . 2]" 1
2312 2 62 LYS H 2 62 LYS HA 2.900 . 3.500 2.908 2.893 2.917 . 0 0 "[ . 1 . 2]" 1
2313 2 62 LYS H 2 62 LYS HB3 3.400 . 5.000 3.496 3.482 3.507 . 0 0 "[ . 1 . 2]" 1
2314 2 62 LYS H 2 62 LYS HB2 2.400 . 2.900 2.229 2.205 2.249 . 0 0 "[ . 1 . 2]" 1
2315 2 66 GLN HA 2 66 GLN HB3 2.400 . 2.700 2.398 2.348 2.484 . 0 0 "[ . 1 . 2]" 1
2316 2 66 GLN HA 2 66 GLN HB2 2.900 . 3.300 3.004 2.993 3.009 . 0 0 "[ . 1 . 2]" 1
2317 2 66 GLN H 2 66 GLN HA 2.900 . 3.500 2.957 2.951 2.963 . 0 0 "[ . 1 . 2]" 1
2318 2 66 GLN H 2 66 GLN HB3 3.400 . 5.000 3.904 3.826 3.930 . 0 0 "[ . 1 . 2]" 1
2319 2 66 GLN H 2 66 GLN HB2 2.400 . 2.900 2.870 2.702 2.947 0.047 11 0 "[ . 1 . 2]" 1
2320 2 67 LEU HA 2 67 LEU HB3 2.900 . 3.300 2.993 2.982 3.002 . 0 0 "[ . 1 . 2]" 1
2321 2 67 LEU HA 2 67 LEU HB2 2.400 . 2.700 2.659 2.632 2.686 . 0 0 "[ . 1 . 2]" 1
2322 2 67 LEU H 2 67 LEU HA 2.900 . 3.500 2.925 2.918 2.933 . 0 0 "[ . 1 . 2]" 1
2323 2 67 LEU H 2 67 LEU HB3 2.400 . 2.900 2.953 2.927 2.983 0.083 16 0 "[ . 1 . 2]" 1
2324 2 67 LEU H 2 67 LEU HB2 2.400 . 2.900 2.913 2.858 2.959 0.059 12 0 "[ . 1 . 2]" 1
2325 2 68 GLN HA 2 68 GLN HB3 2.400 . 2.700 2.633 2.616 2.645 . 0 0 "[ . 1 . 2]" 1
2326 2 68 GLN HA 2 68 GLN HB2 2.400 . 2.700 2.289 2.285 2.292 . 0 0 "[ . 1 . 2]" 1
2327 2 68 GLN H 2 68 GLN HA 2.900 . 3.500 2.912 2.909 2.916 . 0 0 "[ . 1 . 2]" 1
2328 2 68 GLN H 2 68 GLN HB3 2.900 . 3.500 3.092 3.067 3.113 . 0 0 "[ . 1 . 2]" 1
2329 2 68 GLN H 2 68 GLN HB2 3.400 . 5.000 3.993 3.977 4.002 . 0 0 "[ . 1 . 2]" 1
2330 2 69 LEU HA 2 69 LEU HB3 2.400 . 2.700 2.497 2.446 2.544 . 0 0 "[ . 1 . 2]" 1
2331 2 69 LEU HA 2 69 LEU HB2 2.900 . 3.300 3.014 3.008 3.019 . 0 0 "[ . 1 . 2]" 1
2332 2 69 LEU H 2 69 LEU HA 2.900 . 3.500 2.920 2.915 2.925 . 0 0 "[ . 1 . 2]" 1
2333 2 69 LEU H 2 69 LEU HB3 3.400 . 5.000 3.600 3.566 3.631 . 0 0 "[ . 1 . 2]" 1
2334 2 69 LEU H 2 69 LEU HB2 2.400 . 2.900 2.398 2.321 2.495 . 0 0 "[ . 1 . 2]" 1
2335 2 71 LEU HA 2 71 LEU HB3 2.400 . 2.700 2.300 2.284 2.333 . 0 0 "[ . 1 . 2]" 1
2336 2 71 LEU HA 2 71 LEU HB2 2.900 . 3.300 2.975 2.964 2.993 . 0 0 "[ . 1 . 2]" 1
2337 2 71 LEU H 2 71 LEU HA 2.900 . 3.500 2.919 2.884 2.943 . 0 0 "[ . 1 . 2]" 1
2338 2 71 LEU H 2 71 LEU HB3 3.400 . 5.000 3.647 3.589 3.715 . 0 0 "[ . 1 . 2]" 1
2339 2 71 LEU H 2 71 LEU HB2 2.400 . 2.900 2.802 2.734 2.843 . 0 0 "[ . 1 . 2]" 1
2340 2 78 ASN HA 2 78 ASN HB3 2.400 . 2.700 2.573 2.492 2.677 . 0 0 "[ . 1 . 2]" 1
2341 2 78 ASN HA 2 78 ASN HB2 2.900 . 3.300 3.000 2.962 3.020 . 0 0 "[ . 1 . 2]" 1
2342 2 78 ASN H 2 78 ASN HA 2.900 . 3.500 2.896 2.887 2.909 . 0 0 "[ . 1 . 2]" 1
2343 2 78 ASN H 2 78 ASN HB3 3.400 . 5.000 3.594 3.515 3.648 . 0 0 "[ . 1 . 2]" 1
2344 2 78 ASN H 2 78 ASN HB2 2.400 . 2.900 2.359 2.228 2.477 . 0 0 "[ . 1 . 2]" 1
2345 2 79 PHE HA 2 79 PHE HB3 2.400 . 2.700 2.573 2.535 2.613 . 0 0 "[ . 1 . 2]" 1
2346 2 79 PHE HA 2 79 PHE HB2 2.900 . 3.300 3.014 3.005 3.022 . 0 0 "[ . 1 . 2]" 1
2347 2 79 PHE H 2 79 PHE HA 2.900 . 3.500 2.932 2.917 2.941 . 0 0 "[ . 1 . 2]" 1
2348 2 79 PHE H 2 79 PHE HB3 3.400 . 5.000 3.719 3.633 3.782 . 0 0 "[ . 1 . 2]" 1
2349 2 79 PHE H 2 79 PHE HB2 2.400 . 2.900 2.583 2.408 2.697 . 0 0 "[ . 1 . 2]" 1
2350 2 80 HIS HA 2 80 HIS HB3 2.900 . 3.300 3.012 2.978 3.028 . 0 0 "[ . 1 . 2]" 1
2351 2 80 HIS HA 2 80 HIS HB2 2.400 . 2.700 2.443 2.329 2.661 . 0 0 "[ . 1 . 2]" 1
2352 2 80 HIS H 2 80 HIS HA 2.900 . 3.500 2.902 2.893 2.915 . 0 0 "[ . 1 . 2]" 1
2353 2 80 HIS H 2 80 HIS HB3 2.400 . 2.900 2.358 2.149 2.755 . 0 0 "[ . 1 . 2]" 1
2354 2 80 HIS H 2 80 HIS HB2 2.400 . 2.900 2.694 2.209 2.957 0.057 13 0 "[ . 1 . 2]" 1
2355 2 81 PHE HA 2 81 PHE HB3 2.400 . 2.700 2.596 2.544 2.647 . 0 0 "[ . 1 . 2]" 1
2356 2 81 PHE HA 2 81 PHE HB2 2.900 . 3.300 3.011 2.994 3.023 . 0 0 "[ . 1 . 2]" 1
2357 2 81 PHE H 2 81 PHE HA 2.900 . 3.500 2.885 2.872 2.903 . 0 0 "[ . 1 . 2]" 1
2358 2 81 PHE H 2 81 PHE HB3 3.400 . 5.000 3.546 3.506 3.597 . 0 0 "[ . 1 . 2]" 1
2359 2 81 PHE H 2 81 PHE HB2 2.400 . 2.900 2.274 2.208 2.360 . 0 0 "[ . 1 . 2]" 1
2360 2 83 ASN HA 2 83 ASN HB3 2.900 . 3.300 3.022 2.991 3.031 . 0 0 "[ . 1 . 2]" 1
2361 2 83 ASN HA 2 83 ASN HB2 2.400 . 2.700 2.523 2.445 2.661 . 0 0 "[ . 1 . 2]" 1
2362 2 83 ASN H 2 83 ASN HA 2.900 . 3.500 2.899 2.880 2.943 . 0 0 "[ . 1 . 2]" 1
2363 2 83 ASN H 2 83 ASN HB3 2.400 . 2.900 2.632 2.486 2.875 . 0 0 "[ . 1 . 2]" 1
2364 2 83 ASN H 2 83 ASN HB2 2.400 . 2.900 2.624 2.335 2.851 . 0 0 "[ . 1 . 2]" 1
2365 2 90 GLU HA 2 90 GLU HB3 2.400 . 2.700 2.690 2.684 2.699 . 0 0 "[ . 1 . 2]" 1
2366 2 90 GLU HA 2 90 GLU HB2 2.900 . 3.300 2.971 2.965 2.980 . 0 0 "[ . 1 . 2]" 1
2367 2 90 GLU H 2 90 GLU HA 2.900 . 3.500 2.819 2.811 2.831 . 0 0 "[ . 1 . 2]" 1
2368 2 90 GLU H 2 90 GLU HB3 3.400 . 5.000 3.465 3.457 3.481 . 0 0 "[ . 1 . 2]" 1
2369 2 90 GLU H 2 90 GLU HB2 2.400 . 2.900 2.148 2.137 2.170 . 0 0 "[ . 1 . 2]" 1
2370 2 91 ARG HA 2 91 ARG HB3 2.900 . 3.300 3.035 3.022 3.039 . 0 0 "[ . 1 . 2]" 1
2371 2 91 ARG HA 2 91 ARG HB2 2.400 . 2.700 2.500 2.475 2.586 . 0 0 "[ . 1 . 2]" 1
2372 2 91 ARG H 2 91 ARG HA 2.900 . 3.500 2.790 2.780 2.802 . 0 0 "[ . 1 . 2]" 1
2373 2 91 ARG H 2 91 ARG HB3 2.400 . 2.900 2.588 2.535 2.772 . 0 0 "[ . 1 . 2]" 1
2374 2 91 ARG H 2 91 ARG HB2 2.400 . 2.900 2.473 2.308 2.518 . 0 0 "[ . 1 . 2]" 1
2375 2 92 ASP HA 2 92 ASP HB3 2.400 . 2.700 2.706 2.617 2.716 0.016 7 0 "[ . 1 . 2]" 1
2376 2 92 ASP HA 2 92 ASP HB2 2.900 . 3.300 2.949 2.939 3.003 . 0 0 "[ . 1 . 2]" 1
2377 2 92 ASP H 2 92 ASP HA 2.900 . 3.500 2.788 2.775 2.809 . 0 0 "[ . 1 . 2]" 1
2378 2 92 ASP H 2 92 ASP HB3 3.400 . 5.000 3.425 3.412 3.492 . 0 0 "[ . 1 . 2]" 1
2379 2 92 ASP H 2 92 ASP HB2 2.400 . 2.900 2.095 2.072 2.230 . 0 0 "[ . 1 . 2]" 1
2380 2 95 LYS HA 2 95 LYS HB3 2.900 . 3.300 3.020 3.009 3.026 . 0 0 "[ . 1 . 2]" 1
2381 2 95 LYS HA 2 95 LYS HB2 2.400 . 2.700 2.401 2.363 2.428 . 0 0 "[ . 1 . 2]" 1
2382 2 95 LYS H 2 95 LYS HA 2.900 . 3.500 2.795 2.785 2.811 . 0 0 "[ . 1 . 2]" 1
2383 2 95 LYS H 2 95 LYS HB3 2.400 . 2.900 2.341 2.250 2.400 . 0 0 "[ . 1 . 2]" 1
2384 2 95 LYS H 2 95 LYS HB2 2.400 . 2.900 2.629 2.569 2.690 . 0 0 "[ . 1 . 2]" 1
2385 2 96 ASP HA 2 96 ASP HB3 2.400 . 2.700 2.706 2.698 2.718 0.018 15 0 "[ . 1 . 2]" 1
2386 2 96 ASP HA 2 96 ASP HB2 2.900 . 3.300 2.956 2.948 2.967 . 0 0 "[ . 1 . 2]" 1
2387 2 96 ASP H 2 96 ASP HA 2.900 . 3.500 2.765 2.739 2.787 . 0 0 "[ . 1 . 2]" 1
2388 2 96 ASP H 2 96 ASP HB3 3.400 . 5.000 3.452 3.438 3.464 . 0 0 "[ . 1 . 2]" 1
2389 2 96 ASP H 2 96 ASP HB2 2.400 . 2.900 2.129 2.107 2.147 . 0 0 "[ . 1 . 2]" 1
2390 2 98 LEU HA 2 98 LEU HB3 2.400 . 2.700 2.610 2.592 2.629 . 0 0 "[ . 1 . 2]" 1
2391 2 98 LEU HA 2 98 LEU HB2 2.900 . 3.300 3.013 3.004 3.021 . 0 0 "[ . 1 . 2]" 1
2392 2 98 LEU H 2 98 LEU HA 2.900 . 3.500 2.875 2.862 2.902 . 0 0 "[ . 1 . 2]" 1
2393 2 98 LEU H 2 98 LEU HB3 3.400 . 5.000 3.558 3.544 3.574 . 0 0 "[ . 1 . 2]" 1
2394 2 98 LEU H 2 98 LEU HB2 2.400 . 2.900 2.288 2.266 2.315 . 0 0 "[ . 1 . 2]" 1
2395 2 100 GLN HA 2 100 GLN HB3 2.400 . 2.700 2.689 2.651 2.712 0.012 3 0 "[ . 1 . 2]" 1
2396 2 100 GLN HA 2 100 GLN HB2 2.900 . 3.300 2.977 2.961 2.994 . 0 0 "[ . 1 . 2]" 1
2397 2 100 GLN H 2 100 GLN HA 2.900 . 3.500 2.888 2.878 2.907 . 0 0 "[ . 1 . 2]" 1
2398 2 100 GLN H 2 100 GLN HB3 3.400 . 5.000 3.405 3.366 3.435 . 0 0 "[ . 1 . 2]" 1
2399 2 100 GLN H 2 100 GLN HB2 2.400 . 2.900 2.082 2.029 2.121 . 0 0 "[ . 1 . 2]" 1
2400 2 101 LEU HA 2 101 LEU HB3 2.400 . 2.700 2.670 2.611 2.698 . 0 0 "[ . 1 . 2]" 1
2401 2 101 LEU HA 2 101 LEU HB2 2.900 . 3.300 2.952 2.937 2.982 . 0 0 "[ . 1 . 2]" 1
2402 2 101 LEU H 2 101 LEU HA 2.900 . 3.500 2.852 2.833 2.878 . 0 0 "[ . 1 . 2]" 1
2403 2 101 LEU H 2 101 LEU HB3 3.400 . 5.000 3.381 3.341 3.429 . 0 0 "[ . 1 . 2]" 1
2404 2 101 LEU H 2 101 LEU HB2 2.400 . 2.900 2.037 1.984 2.115 . 0 0 "[ . 1 . 2]" 1
2405 2 102 LEU HA 2 102 LEU HB3 2.400 . 2.700 2.546 2.517 2.575 . 0 0 "[ . 1 . 2]" 1
2406 2 102 LEU HA 2 102 LEU HB2 2.900 . 3.300 2.987 2.978 2.995 . 0 0 "[ . 1 . 2]" 1
2407 2 102 LEU H 2 102 LEU HA 2.900 . 3.500 2.760 2.737 2.837 . 0 0 "[ . 1 . 2]" 1
2408 2 102 LEU H 2 102 LEU HB3 3.400 . 5.000 3.593 3.580 3.606 . 0 0 "[ . 1 . 2]" 1
2409 2 102 LEU H 2 102 LEU HB2 2.400 . 2.900 2.404 2.350 2.445 . 0 0 "[ . 1 . 2]" 1
2410 2 105 PHE HA 2 105 PHE HB3 2.400 . 2.700 2.512 2.384 2.661 . 0 0 "[ . 1 . 2]" 1
2411 2 105 PHE HA 2 105 PHE HB2 2.900 . 3.300 3.016 2.965 3.033 . 0 0 "[ . 1 . 2]" 1
2412 2 105 PHE H 2 105 PHE HA 2.900 . 3.500 2.947 2.911 2.959 . 0 0 "[ . 1 . 2]" 1
2413 2 105 PHE H 2 105 PHE HB3 3.400 . 5.000 3.732 3.636 3.846 . 0 0 "[ . 1 . 2]" 1
2414 2 105 PHE H 2 105 PHE HB2 2.400 . 2.900 2.590 2.429 2.818 . 0 0 "[ . 1 . 2]" 1
2415 2 46 SER HA 2 46 SER HB3 2.900 . 3.300 3.029 2.996 3.035 . 0 0 "[ . 1 . 2]" 1
2416 2 46 SER HA 2 46 SER HB2 2.400 . 2.700 2.494 2.411 2.623 . 0 0 "[ . 1 . 2]" 1
2417 2 46 SER H 2 46 SER HA 2.900 . 3.500 2.904 2.898 2.928 . 0 0 "[ . 1 . 2]" 1
2418 2 46 SER H 2 46 SER HB3 2.400 . 2.900 2.903 2.824 3.037 0.137 18 0 "[ . 1 . 2]" 1
2419 2 46 SER H 2 46 SER HB2 2.900 . 3.500 3.291 3.058 3.447 . 0 0 "[ . 1 . 2]" 1
2420 2 58 SER HA 2 58 SER HB3 2.400 . 2.700 2.650 2.644 2.655 . 0 0 "[ . 1 . 2]" 1
2421 2 58 SER HA 2 58 SER HB2 2.400 . 2.700 2.293 2.289 2.298 . 0 0 "[ . 1 . 2]" 1
2422 2 58 SER H 2 58 SER HA 2.900 . 3.500 2.909 2.894 2.916 . 0 0 "[ . 1 . 2]" 1
2423 2 58 SER H 2 58 SER HB3 2.900 . 3.500 2.482 2.439 2.511 . 0 0 "[ . 1 . 2]" 1
2424 2 58 SER H 2 58 SER HB2 3.400 . 5.000 3.657 3.636 3.674 . 0 0 "[ . 1 . 2]" 1
2425 2 82 SER HA 2 82 SER HB3 2.400 . 2.700 2.286 2.271 2.342 . 0 0 "[ . 1 . 2]" 1
2426 2 82 SER HA 2 82 SER HB2 2.400 . 2.700 2.668 2.581 2.685 . 0 0 "[ . 1 . 2]" 1
2427 2 82 SER H 2 82 SER HA 2.900 . 3.500 2.923 2.897 2.948 . 0 0 "[ . 1 . 2]" 1
2428 2 82 SER H 2 82 SER HB3 2.900 . 3.500 3.222 3.089 3.337 . 0 0 "[ . 1 . 2]" 1
2429 2 82 SER H 2 82 SER HB2 3.400 . 5.000 3.517 3.470 3.665 . 0 0 "[ . 1 . 2]" 1
2430 2 44 THR HA 2 44 THR HB 2.400 . 2.700 2.621 2.563 2.674 . 0 0 "[ . 1 . 2]" 1
2431 2 44 THR HA 2 44 THR MG 2.400 . 4.200 2.219 2.175 2.258 . 0 0 "[ . 1 . 2]" 1
2432 2 44 THR H 2 44 THR HA 2.900 . 3.500 2.911 2.878 2.947 . 0 0 "[ . 1 . 2]" 1
2433 2 44 THR H 2 44 THR HB 3.400 . 5.000 3.554 3.490 3.636 . 0 0 "[ . 1 . 2]" 1
2434 2 44 THR H 2 44 THR MG 2.400 . 4.200 2.916 2.756 3.195 . 0 0 "[ . 1 . 2]" 1
2435 2 76 THR HA 2 76 THR HB 2.400 . 2.700 2.555 2.524 2.580 . 0 0 "[ . 1 . 2]" 1
2436 2 76 THR HA 2 76 THR MG 2.400 . 4.200 2.286 2.226 2.320 . 0 0 "[ . 1 . 2]" 1
2437 2 76 THR H 2 76 THR HA 2.900 . 3.500 2.941 2.933 2.951 . 0 0 "[ . 1 . 2]" 1
2438 2 76 THR H 2 76 THR HB 3.400 . 5.000 3.784 3.714 3.824 . 0 0 "[ . 1 . 2]" 1
2439 2 76 THR H 2 76 THR MG 2.400 . 4.200 3.183 3.007 3.296 . 0 0 "[ . 1 . 2]" 1
2440 2 77 THR HA 2 77 THR MG 2.400 . 4.200 2.284 2.213 2.352 . 0 0 "[ . 1 . 2]" 1
2441 2 77 THR H 2 77 THR HA 2.900 . 3.500 2.943 2.928 2.953 . 0 0 "[ . 1 . 2]" 1
2442 2 77 THR H 2 77 THR MG 3.400 . 6.500 3.843 3.816 3.891 . 0 0 "[ . 1 . 2]" 1
2443 2 77 THR H 2 77 THR HB 2.400 . 2.900 2.709 2.635 2.813 . 0 0 "[ . 1 . 2]" 1
2444 2 86 THR HA 2 86 THR HB 2.400 . 2.700 2.540 2.530 2.550 . 0 0 "[ . 1 . 2]" 1
2445 2 86 THR HA 2 86 THR MG 2.400 . 4.200 2.214 2.182 2.249 . 0 0 "[ . 1 . 2]" 1
2446 2 86 THR H 2 86 THR HA 2.900 . 3.500 2.942 2.938 2.946 . 0 0 "[ . 1 . 2]" 1
2447 2 86 THR H 2 86 THR HB 3.400 . 5.000 3.753 3.745 3.766 . 0 0 "[ . 1 . 2]" 1
2448 2 86 THR H 2 86 THR MG 2.400 . 4.200 3.022 2.981 3.056 . 0 0 "[ . 1 . 2]" 1
2449 2 10 VAL HA 2 10 VAL MG1 2.400 . 4.200 2.417 2.357 2.506 . 0 0 "[ . 1 . 2]" 1
2450 2 10 VAL HA 2 10 VAL MG2 2.400 . 4.200 2.345 2.278 2.386 . 0 0 "[ . 1 . 2]" 1
2451 2 10 VAL HA 2 10 VAL HB 2.900 . 3.300 3.022 3.015 3.028 . 0 0 "[ . 1 . 2]" 1
2452 2 10 VAL H 2 10 VAL HA 2.900 . 3.500 2.903 2.886 2.950 . 0 0 "[ . 1 . 2]" 1
2453 2 10 VAL H 2 10 VAL HB 2.400 . 2.900 2.480 2.423 2.605 . 0 0 "[ . 1 . 2]" 1
2454 2 10 VAL H 2 10 VAL MG2 2.400 . 4.400 2.446 2.170 3.015 . 0 0 "[ . 1 . 2]" 1
2455 2 10 VAL H 2 10 VAL MG1 3.400 . 6.500 3.762 3.733 3.782 . 0 0 "[ . 1 . 2]" 1
2456 2 14 VAL HA 2 14 VAL MG1 2.400 . 4.200 2.261 2.221 2.292 . 0 0 "[ . 1 . 2]" 1
2457 2 14 VAL HA 2 14 VAL MG2 2.400 . 4.200 2.532 2.504 2.584 . 0 0 "[ . 1 . 2]" 1
2458 2 14 VAL HA 2 14 VAL HB 2.900 . 3.300 2.999 2.994 3.007 . 0 0 "[ . 1 . 2]" 1
2459 2 14 VAL H 2 14 VAL HA 2.900 . 3.500 2.940 2.933 2.946 . 0 0 "[ . 1 . 2]" 1
2460 2 14 VAL H 2 14 VAL HB 2.400 . 2.900 2.755 2.725 2.822 . 0 0 "[ . 1 . 2]" 1
2461 2 14 VAL H 2 14 VAL MG2 2.400 . 4.400 2.305 2.189 2.387 . 0 0 "[ . 1 . 2]" 1
2462 2 14 VAL H 2 14 VAL MG1 3.400 . 6.500 3.867 3.848 3.895 . 0 0 "[ . 1 . 2]" 1
2463 2 17 VAL HA 2 17 VAL MG1 2.400 . 4.200 2.540 2.496 2.586 . 0 0 "[ . 1 . 2]" 1
2464 2 17 VAL HA 2 17 VAL MG2 2.400 . 4.200 2.293 2.255 2.338 . 0 0 "[ . 1 . 2]" 1
2465 2 17 VAL HA 2 17 VAL HB 2.900 . 3.300 3.023 3.017 3.030 . 0 0 "[ . 1 . 2]" 1
2466 2 17 VAL H 2 17 VAL HA 2.900 . 3.500 2.948 2.944 2.952 . 0 0 "[ . 1 . 2]" 1
2467 2 17 VAL H 2 17 VAL HB 2.400 . 2.900 2.565 2.461 2.647 . 0 0 "[ . 1 . 2]" 1
2468 2 17 VAL H 2 17 VAL MG2 2.400 . 4.400 3.046 2.933 3.142 . 0 0 "[ . 1 . 2]" 1
2469 2 17 VAL H 2 17 VAL MG1 3.400 . 6.500 3.756 3.697 3.791 . 0 0 "[ . 1 . 2]" 1
2470 2 70 VAL HA 2 70 VAL MG1 2.400 . 4.200 2.287 2.253 2.337 . 0 0 "[ . 1 . 2]" 1
2471 2 70 VAL HA 2 70 VAL MG2 2.400 . 4.200 2.485 2.418 2.510 . 0 0 "[ . 1 . 2]" 1
2472 2 70 VAL HA 2 70 VAL HB 2.900 . 3.300 3.016 3.011 3.024 . 0 0 "[ . 1 . 2]" 1
2473 2 70 VAL H 2 70 VAL HA 2.900 . 3.500 2.916 2.900 2.930 . 0 0 "[ . 1 . 2]" 1
2474 2 70 VAL H 2 70 VAL HB 2.400 . 2.900 2.659 2.550 2.701 . 0 0 "[ . 1 . 2]" 1
2475 2 70 VAL H 2 70 VAL MG2 2.400 . 4.400 2.090 1.958 2.235 . 0 0 "[ . 1 . 2]" 1
2476 2 70 VAL H 2 70 VAL MG1 3.400 . 6.500 3.801 3.780 3.827 . 0 0 "[ . 1 . 2]" 1
2477 2 88 VAL HA 2 88 VAL MG1 2.400 . 4.200 2.691 2.571 2.727 . 0 0 "[ . 1 . 2]" 1
2478 2 88 VAL HA 2 88 VAL MG2 2.400 . 4.200 2.205 2.175 2.274 . 0 0 "[ . 1 . 2]" 1
2479 2 88 VAL HA 2 88 VAL HB 2.900 . 3.300 2.982 2.969 3.006 . 0 0 "[ . 1 . 2]" 1
2480 2 88 VAL H 2 88 VAL HA 2.900 . 3.500 2.797 2.787 2.808 . 0 0 "[ . 1 . 2]" 1
2481 2 88 VAL H 2 88 VAL HB 2.400 . 2.900 2.237 2.202 2.344 . 0 0 "[ . 1 . 2]" 1
2482 2 88 VAL H 2 88 VAL MG2 2.400 . 4.400 2.599 2.321 2.673 . 0 0 "[ . 1 . 2]" 1
2483 2 88 VAL H 2 88 VAL MG1 3.400 . 6.500 3.663 3.640 3.720 . 0 0 "[ . 1 . 2]" 1
2484 2 94 VAL HA 2 94 VAL MG1 2.400 . 4.200 2.350 2.327 2.385 . 0 0 "[ . 1 . 2]" 1
2485 2 94 VAL HA 2 94 VAL MG2 2.400 . 4.200 2.447 2.405 2.477 . 0 0 "[ . 1 . 2]" 1
2486 2 94 VAL HA 2 94 VAL HB 2.900 . 3.300 3.035 3.032 3.039 . 0 0 "[ . 1 . 2]" 1
2487 2 94 VAL H 2 94 VAL HA 2.900 . 3.500 2.844 2.836 2.852 . 0 0 "[ . 1 . 2]" 1
2488 2 94 VAL H 2 94 VAL HB 2.400 . 2.900 2.653 2.605 2.686 . 0 0 "[ . 1 . 2]" 1
2489 2 94 VAL H 2 94 VAL MG2 2.400 . 4.400 1.991 1.941 2.038 . 0 0 "[ . 1 . 2]" 1
2490 2 94 VAL H 2 94 VAL MG1 3.400 . 6.500 3.788 3.784 3.794 . 0 0 "[ . 1 . 2]" 1
2491 2 13 ILE HA 2 13 ILE MG 2.400 . 4.200 2.361 2.316 2.406 . 0 0 "[ . 1 . 2]" 1
2492 2 13 ILE HA 2 13 ILE MD 2.900 . 4.800 3.861 3.840 3.890 . 0 0 "[ . 1 . 2]" 1
2493 2 13 ILE HA 2 13 ILE QG 2.400 . 3.700 2.453 2.431 2.491 . 0 0 "[ . 1 . 2]" 1
2494 2 13 ILE HA 2 13 ILE HB 2.900 . 3.300 3.026 3.021 3.027 . 0 0 "[ . 1 . 2]" 1
2495 2 13 ILE H 2 13 ILE HB 2.400 . 2.900 2.669 2.617 2.715 . 0 0 "[ . 1 . 2]" 1
2496 2 13 ILE H 2 13 ILE QG 2.900 . 4.500 2.720 2.596 2.845 . 0 0 "[ . 1 . 2]" 1
2497 2 33 ILE HA 2 33 ILE MG 2.900 . 4.800 3.170 3.152 3.215 . 0 0 "[ . 1 . 2]" 1
2498 2 33 ILE HA 2 33 ILE MD 2.900 . 4.800 3.803 3.465 3.877 . 0 0 "[ . 1 . 2]" 1
2499 2 33 ILE HA 2 33 ILE QG 2.400 . 4.200 2.609 2.449 2.661 . 0 0 "[ . 1 . 2]" 1
2500 2 33 ILE HA 2 33 ILE HB 2.400 . 2.700 2.318 2.300 2.387 . 0 0 "[ . 1 . 2]" 1
2501 2 33 ILE H 2 33 ILE HB 2.900 . 3.500 3.264 3.031 3.371 . 0 0 "[ . 1 . 2]" 1
2502 2 33 ILE H 2 33 ILE MG 2.400 . 4.400 1.893 1.787 1.962 0.013 10 0 "[ . 1 . 2]" 1
2503 2 45 ILE HA 2 45 ILE MG 2.400 . 4.200 2.540 2.404 2.582 . 0 0 "[ . 1 . 2]" 1
2504 2 45 ILE HA 2 45 ILE MD 2.900 . 4.800 1.871 1.797 2.017 0.003 11 0 "[ . 1 . 2]" 1
2505 2 45 ILE HA 2 45 ILE QG 2.400 . 3.700 2.819 2.765 2.940 . 0 0 "[ . 1 . 2]" 1
2506 2 45 ILE HA 2 45 ILE HB 2.900 . 3.300 3.014 3.006 3.029 . 0 0 "[ . 1 . 2]" 1
2507 2 45 ILE H 2 45 ILE HB 2.400 . 2.900 2.446 2.346 2.580 . 0 0 "[ . 1 . 2]" 1
2508 2 45 ILE H 2 45 ILE QG 2.900 . 4.500 2.917 2.653 3.163 . 0 0 "[ . 1 . 2]" 1
2509 2 52 ILE HA 2 52 ILE MG 2.400 . 4.200 2.234 2.182 2.273 . 0 0 "[ . 1 . 2]" 1
2510 2 52 ILE HA 2 52 ILE MD 2.900 . 4.800 2.517 2.405 2.649 . 0 0 "[ . 1 . 2]" 1
2511 2 52 ILE HA 2 52 ILE QG 2.400 . 3.700 3.096 3.022 3.140 . 0 0 "[ . 1 . 2]" 1
2512 2 52 ILE HA 2 52 ILE HB 2.900 . 3.300 3.003 2.990 3.018 . 0 0 "[ . 1 . 2]" 1
2513 2 52 ILE H 2 52 ILE HB 2.400 . 2.900 2.830 2.769 2.894 . 0 0 "[ . 1 . 2]" 1
2514 2 52 ILE H 2 52 ILE MD 2.400 . 4.400 3.199 3.065 3.364 . 0 0 "[ . 1 . 2]" 1
2515 2 57 ILE HA 2 57 ILE MG 2.400 . 4.200 2.645 2.622 2.664 . 0 0 "[ . 1 . 2]" 1
2516 2 57 ILE HA 2 57 ILE MD 3.400 . 6.500 3.970 3.910 4.022 . 0 0 "[ . 1 . 2]" 1
2517 2 57 ILE HA 2 57 ILE QG 2.900 . 4.300 3.288 3.281 3.295 . 0 0 "[ . 1 . 2]" 1
2518 2 57 ILE HA 2 57 ILE HB 2.400 . 2.700 2.292 2.287 2.296 . 0 0 "[ . 1 . 2]" 1
2519 2 57 ILE H 2 57 ILE QG 2.400 . 3.900 2.873 2.832 2.906 . 0 0 "[ . 1 . 2]" 1
2520 2 57 ILE H 2 57 ILE MG 2.900 . 5.000 2.446 2.339 2.499 . 0 0 "[ . 1 . 2]" 1
2521 2 65 ILE HA 2 65 ILE MG 2.400 . 4.200 2.528 2.444 2.597 . 0 0 "[ . 1 . 2]" 1
2522 2 65 ILE HA 2 65 ILE MD 2.900 . 4.800 3.348 3.141 3.563 . 0 0 "[ . 1 . 2]" 1
2523 2 65 ILE HA 2 65 ILE QG 2.400 . 3.700 2.194 2.147 2.269 . 0 0 "[ . 1 . 2]" 1
2524 2 65 ILE HA 2 65 ILE HB 2.900 . 3.300 3.024 3.017 3.030 . 0 0 "[ . 1 . 2]" 1
2525 2 65 ILE H 2 65 ILE HB 2.400 . 2.900 2.346 2.296 2.454 . 0 0 "[ . 1 . 2]" 1
2526 2 65 ILE H 2 65 ILE QG 2.900 . 4.500 3.197 2.785 3.454 . 0 0 "[ . 1 . 2]" 1
2527 2 11 LEU H 2 11 LEU HG 2.400 . 2.900 2.302 2.139 2.510 . 0 0 "[ . 1 . 2]" 1
2528 2 11 LEU HA 2 11 LEU HG 2.900 . 3.300 3.272 3.164 3.390 0.090 12 0 "[ . 1 . 2]" 1
2529 2 11 LEU HA 2 11 LEU MD1 2.900 . 4.800 3.911 3.851 3.944 . 0 0 "[ . 1 . 2]" 1
2530 2 11 LEU HA 2 11 LEU MD2 2.400 . 4.200 2.184 2.052 2.288 . 0 0 "[ . 1 . 2]" 1
2531 2 12 LEU H 2 12 LEU HG 3.400 . 5.000 4.488 4.437 4.559 . 0 0 "[ . 1 . 2]" 1
2532 2 12 LEU HA 2 12 LEU HG 2.400 . 2.700 2.752 2.697 2.785 0.085 13 0 "[ . 1 . 2]" 1
2533 2 12 LEU HA 2 12 LEU MD1 2.400 . 4.200 2.453 2.377 2.481 . 0 0 "[ . 1 . 2]" 1
2534 2 12 LEU HA 2 12 LEU MD2 2.900 . 4.800 3.887 3.870 3.901 . 0 0 "[ . 1 . 2]" 1
2535 2 26 LEU H 2 26 LEU HG 3.400 . 5.000 4.385 4.352 4.408 . 0 0 "[ . 1 . 2]" 1
2536 2 26 LEU HA 2 26 LEU HG 2.400 . 2.700 2.813 2.781 2.835 0.135 18 0 "[ . 1 . 2]" 1
2537 2 26 LEU HA 2 26 LEU MD1 2.400 . 4.200 2.502 2.464 2.535 . 0 0 "[ . 1 . 2]" 1
2538 2 26 LEU HA 2 26 LEU MD2 2.900 . 4.800 3.925 3.916 3.932 . 0 0 "[ . 1 . 2]" 1
2539 2 28 LEU H 2 28 LEU HG 2.400 . 2.900 2.515 2.317 2.648 . 0 0 "[ . 1 . 2]" 1
2540 2 28 LEU HA 2 28 LEU HG 2.900 . 3.300 3.397 3.317 3.462 0.162 10 0 "[ . 1 . 2]" 1
2541 2 28 LEU HA 2 28 LEU MD1 2.900 . 4.800 3.754 3.643 3.863 . 0 0 "[ . 1 . 2]" 1
2542 2 28 LEU HA 2 28 LEU MD2 2.400 . 4.200 2.100 2.032 2.198 . 0 0 "[ . 1 . 2]" 1
2543 2 67 LEU H 2 67 LEU HG 3.400 . 5.000 4.599 4.586 4.612 . 0 0 "[ . 1 . 2]" 1
2544 2 67 LEU HA 2 67 LEU HG 2.400 . 2.700 2.452 2.410 2.483 . 0 0 "[ . 1 . 2]" 1
2545 2 67 LEU HA 2 67 LEU MD1 2.400 . 4.200 2.498 2.483 2.519 . 0 0 "[ . 1 . 2]" 1
2546 2 67 LEU HA 2 67 LEU MD2 2.900 . 4.800 3.772 3.753 3.787 . 0 0 "[ . 1 . 2]" 1
2547 2 69 LEU H 2 69 LEU HG 2.400 . 2.900 2.721 2.515 2.901 0.001 18 0 "[ . 1 . 2]" 1
2548 2 69 LEU HA 2 69 LEU HG 2.900 . 3.300 3.095 3.049 3.151 . 0 0 "[ . 1 . 2]" 1
2549 2 69 LEU HA 2 69 LEU MD1 2.900 . 4.800 3.847 3.775 3.894 . 0 0 "[ . 1 . 2]" 1
2550 2 69 LEU HA 2 69 LEU MD2 2.400 . 4.200 2.009 1.873 2.135 . 0 0 "[ . 1 . 2]" 1
2551 2 71 LEU H 2 71 LEU HG 2.400 . 2.900 2.012 1.855 2.201 . 0 0 "[ . 1 . 2]" 1
2552 2 71 LEU HA 2 71 LEU HG 2.900 . 3.300 3.391 3.361 3.479 0.179 6 0 "[ . 1 . 2]" 1
2553 2 71 LEU HA 2 71 LEU MD1 2.900 . 4.800 3.910 3.851 3.944 . 0 0 "[ . 1 . 2]" 1
2554 2 71 LEU HA 2 71 LEU MD2 2.400 . 4.200 2.309 2.154 2.401 . 0 0 "[ . 1 . 2]" 1
2555 2 98 LEU H 2 98 LEU HG 2.900 . 3.500 2.828 2.755 2.957 . 0 0 "[ . 1 . 2]" 1
2556 2 98 LEU HA 2 98 LEU HG 2.400 . 2.700 2.747 2.721 2.786 0.086 8 0 "[ . 1 . 2]" 1
2557 2 98 LEU HA 2 98 LEU MD1 2.900 . 4.800 3.849 3.831 3.867 . 0 0 "[ . 1 . 2]" 1
2558 2 98 LEU HA 2 98 LEU MD2 2.400 . 4.200 2.096 1.984 2.209 . 0 0 "[ . 1 . 2]" 1
2559 2 101 LEU H 2 101 LEU HG 2.900 . 3.500 2.924 2.622 3.085 . 0 0 "[ . 1 . 2]" 1
2560 2 101 LEU HA 2 101 LEU HG 2.400 . 2.700 2.606 2.514 2.784 0.084 15 0 "[ . 1 . 2]" 1
2561 2 101 LEU HA 2 101 LEU MD1 2.900 . 4.800 3.783 3.764 3.821 . 0 0 "[ . 1 . 2]" 1
2562 2 101 LEU HA 2 101 LEU MD2 2.400 . 4.200 2.041 1.962 2.143 . 0 0 "[ . 1 . 2]" 1
2563 2 102 LEU H 2 102 LEU HG 2.900 . 3.500 2.451 2.334 2.659 . 0 0 "[ . 1 . 2]" 1
2564 2 102 LEU HA 2 102 LEU HG 2.400 . 2.700 2.927 2.904 2.988 0.288 10 0 "[ . 1 . 2]" 1
2565 2 102 LEU HA 2 102 LEU MD1 2.900 . 4.800 3.733 3.707 3.757 . 0 0 "[ . 1 . 2]" 1
2566 2 102 LEU HA 2 102 LEU MD2 2.400 . 4.200 1.721 1.631 1.792 0.169 3 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 174
_Distance_constraint_stats_list.Viol_count 108
_Distance_constraint_stats_list.Viol_total 371.362
_Distance_constraint_stats_list.Viol_max 0.579
_Distance_constraint_stats_list.Viol_rms 0.0421
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0053
_Distance_constraint_stats_list.Viol_average_violations_only 0.1719
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 4 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 5 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 6 ASP 0.012 0.012 5 0 "[ . 1 . 2]"
1 7 GLU 0.445 0.209 16 0 "[ . 1 . 2]"
1 8 GLU 5.159 0.480 12 0 "[ . 1 . 2]"
1 9 ASP 2.560 0.486 15 0 "[ . 1 . 2]"
1 10 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 ASP 0.034 0.026 1 0 "[ . 1 . 2]"
1 12 PHE 9.777 0.579 7 2 "[ - . + 1 . 2]"
1 13 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 14 GLU 0.119 0.119 12 0 "[ . 1 . 2]"
1 17 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 18 ASP 0.341 0.341 14 0 "[ . 1 . 2]"
1 19 ASP 0.123 0.123 1 0 "[ . 1 . 2]"
2 20 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
2 21 LYS 0.192 0.180 17 0 "[ . 1 . 2]"
2 53 LYS 0.464 0.341 14 0 "[ . 1 . 2]"
2 56 LYS 8.394 0.579 7 2 "[ - . + 1 . 2]"
2 57 ILE 0.035 0.019 5 0 "[ . 1 . 2]"
2 58 SER 0.285 0.040 14 0 "[ . 1 . 2]"
2 59 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
2 62 LYS 5.159 0.480 12 0 "[ . 1 . 2]"
2 64 LYS 0.265 0.209 16 0 "[ . 1 . 2]"
2 66 GLN 0.037 0.037 7 0 "[ . 1 . 2]"
2 67 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
2 68 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
2 78 ASN 3.738 0.486 15 0 "[ . 1 . 2]"
2 79 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 4 GLU QG 2 20 LYS QE 2.900 . 5.300 4.007 3.228 4.360 . 0 0 "[ . 1 . 2]" 2
2 1 4 GLU QG 2 78 ASN QD 3.400 . 7.000 2.810 2.157 4.265 . 0 0 "[ . 1 . 2]" 2
3 1 4 GLU QB 2 78 ASN QD 3.400 . 7.000 3.391 2.181 4.368 . 0 0 "[ . 1 . 2]" 2
4 1 5 ASP QB 2 21 LYS QD 2.900 . 5.300 3.955 3.544 4.335 . 0 0 "[ . 1 . 2]" 2
5 1 5 ASP QB 2 21 LYS QE 2.900 . 5.300 3.798 2.404 4.321 . 0 0 "[ . 1 . 2]" 2
6 1 6 ASP H 2 21 LYS QD 3.400 . 6.000 4.427 3.591 5.163 . 0 0 "[ . 1 . 2]" 2
7 1 6 ASP HA 2 20 LYS QG 3.900 . 7.000 4.276 2.924 6.042 . 0 0 "[ . 1 . 2]" 2
8 1 6 ASP HA 2 20 LYS QE 3.400 . 6.000 4.525 2.116 5.255 . 0 0 "[ . 1 . 2]" 2
9 1 6 ASP HA 2 21 LYS QD 3.400 . 6.000 2.414 1.788 3.334 0.012 5 0 "[ . 1 . 2]" 2
10 1 6 ASP HA 2 21 LYS QE 2.900 . 4.300 3.738 3.553 4.132 . 0 0 "[ . 1 . 2]" 2
11 1 7 GLU H 2 21 LYS QE 3.400 . 6.000 3.734 2.704 5.092 . 0 0 "[ . 1 . 2]" 2
12 1 7 GLU QB 2 21 LYS QG 3.900 . 8.000 4.435 2.358 5.847 . 0 0 "[ . 1 . 2]" 2
13 1 7 GLU HA 2 21 LYS QD 2.900 . 4.300 3.743 2.729 4.004 . 0 0 "[ . 1 . 2]" 2
14 1 7 GLU QG 2 21 LYS QD 2.900 . 5.300 3.447 1.620 4.042 0.180 17 0 "[ . 1 . 2]" 2
15 1 7 GLU QB 2 21 LYS QD 2.900 . 5.300 3.369 2.078 3.887 . 0 0 "[ . 1 . 2]" 2
16 1 7 GLU HA 2 21 LYS QE 2.900 . 4.300 2.978 2.198 3.979 . 0 0 "[ . 1 . 2]" 2
17 1 7 GLU QG 2 21 LYS QE 2.900 . 5.300 3.165 2.187 4.264 . 0 0 "[ . 1 . 2]" 2
18 1 7 GLU QB 2 21 LYS QE 2.900 . 5.300 3.788 2.450 4.416 . 0 0 "[ . 1 . 2]" 2
19 1 7 GLU QG 2 64 LYS QD 3.900 . 8.000 4.402 2.920 5.398 . 0 0 "[ . 1 . 2]" 2
20 1 7 GLU QB 2 64 LYS QD 3.900 . 8.000 3.633 1.855 5.901 . 0 0 "[ . 1 . 2]" 2
21 1 7 GLU HA 2 64 LYS QE 3.900 . 7.000 4.939 4.242 6.019 . 0 0 "[ . 1 . 2]" 2
22 1 7 GLU QG 2 64 LYS QE 3.400 . 7.000 3.740 2.750 4.531 . 0 0 "[ . 1 . 2]" 2
23 1 7 GLU QB 2 64 LYS QE 3.400 . 7.000 2.472 1.591 4.647 0.209 16 0 "[ . 1 . 2]" 2
24 1 8 GLU QG 2 62 LYS QG 3.400 . 7.000 3.513 2.987 3.991 . 0 0 "[ . 1 . 2]" 2
25 1 8 GLU QB 2 62 LYS QG 3.900 . 8.000 3.817 3.172 4.232 . 0 0 "[ . 1 . 2]" 2
26 1 8 GLU HA 2 62 LYS QD 3.400 . 6.000 5.235 4.744 5.313 . 0 0 "[ . 1 . 2]" 2
27 1 8 GLU QG 2 62 LYS QD 3.400 . 7.000 3.088 1.845 3.617 . 0 0 "[ . 1 . 2]" 2
28 1 8 GLU QB 2 62 LYS QD 3.900 . 8.000 3.145 2.165 3.516 . 0 0 "[ . 1 . 2]" 2
29 1 8 GLU HA 2 62 LYS QE 2.900 . 4.300 3.706 3.411 3.831 . 0 0 "[ . 1 . 2]" 2
30 1 8 GLU QG 2 62 LYS QE 2.900 . 5.300 1.851 1.320 2.862 0.480 12 0 "[ . 1 . 2]" 2
31 1 8 GLU QB 2 62 LYS QE 2.900 . 5.300 2.293 1.529 2.918 0.271 17 0 "[ . 1 . 2]" 2
32 1 8 GLU HA 2 66 GLN QE 3.900 . 7.000 4.888 4.531 5.242 . 0 0 "[ . 1 . 2]" 2
33 1 8 GLU QG 2 66 GLN QE 3.400 . 7.000 4.147 3.434 4.511 . 0 0 "[ . 1 . 2]" 2
34 1 8 GLU QB 2 66 GLN QE 3.400 . 7.000 4.033 2.827 4.642 . 0 0 "[ . 1 . 2]" 2
35 1 9 ASP H 2 66 GLN QE 3.400 . 6.000 4.117 3.655 4.397 . 0 0 "[ . 1 . 2]" 2
36 1 9 ASP HA 2 62 LYS QD 2.900 . 4.300 3.952 3.711 4.073 . 0 0 "[ . 1 . 2]" 2
37 1 9 ASP QB 2 62 LYS QD 3.400 . 7.000 5.235 5.042 5.453 . 0 0 "[ . 1 . 2]" 2
38 1 9 ASP HA 2 62 LYS QE 2.900 . 4.300 2.762 2.633 2.960 . 0 0 "[ . 1 . 2]" 2
39 1 9 ASP QB 2 62 LYS QE 2.900 . 5.300 4.346 4.284 4.416 . 0 0 "[ . 1 . 2]" 2
40 1 9 ASP HA 2 64 LYS QE 3.400 . 6.000 5.231 4.134 5.498 . 0 0 "[ . 1 . 2]" 2
41 1 9 ASP QB 2 64 LYS QE 3.900 . 8.000 5.497 4.659 6.206 . 0 0 "[ . 1 . 2]" 2
42 1 9 ASP HA 2 66 GLN QE 3.400 . 6.000 1.973 1.763 2.394 0.037 7 0 "[ . 1 . 2]" 2
43 1 9 ASP QB 2 66 GLN QE 2.900 . 5.500 2.738 2.187 3.293 . 0 0 "[ . 1 . 2]" 2
44 1 9 ASP QB 2 68 GLN QE 3.400 . 7.000 2.925 2.507 3.194 . 0 0 "[ . 1 . 2]" 2
45 1 9 ASP HA 2 78 ASN QD 3.400 . 6.000 3.802 3.187 4.087 . 0 0 "[ . 1 . 2]" 2
46 1 9 ASP QB 2 78 ASN QD 2.900 . 5.500 1.763 1.314 2.034 0.486 15 0 "[ . 1 . 2]" 2
47 1 10 ASP HA 2 56 LYS QD 3.400 . 7.000 5.396 5.279 5.507 . 0 0 "[ . 1 . 2]" 2
48 1 10 ASP HA 2 56 LYS QE 3.400 . 6.000 5.365 5.229 5.517 . 0 0 "[ . 1 . 2]" 2
49 1 10 ASP H 2 78 ASN QD 3.400 . 6.000 5.534 5.340 5.633 . 0 0 "[ . 1 . 2]" 2
50 1 11 ASP H 2 58 SER HB3 3.900 . 6.000 5.872 5.734 6.026 0.026 1 0 "[ . 1 . 2]" 2
51 1 11 ASP H 2 59 PRO QG 3.400 . 6.000 5.432 5.393 5.478 . 0 0 "[ . 1 . 2]" 2
52 1 11 ASP H 2 62 LYS QD 3.400 . 6.000 4.203 3.947 4.380 . 0 0 "[ . 1 . 2]" 2
53 1 11 ASP QB 2 62 LYS QE 3.400 . 7.000 4.172 4.082 4.293 . 0 0 "[ . 1 . 2]" 2
54 1 11 ASP QB 2 58 SER HB2 3.900 . 7.000 4.736 4.468 5.057 . 0 0 "[ . 1 . 2]" 2
55 1 11 ASP QB 2 59 PRO QG 3.400 . 7.000 2.693 2.503 3.036 . 0 0 "[ . 1 . 2]" 2
56 1 11 ASP QB 2 59 PRO QD 3.900 . 8.000 3.065 2.786 3.519 . 0 0 "[ . 1 . 2]" 2
57 1 12 PHE H 2 58 SER HA 3.400 . 5.000 4.428 4.303 4.644 . 0 0 "[ . 1 . 2]" 2
58 1 12 PHE H 2 59 PRO QD 3.900 . 7.000 4.164 4.058 4.272 . 0 0 "[ . 1 . 2]" 2
59 1 12 PHE H 2 58 SER HB3 3.400 . 5.000 4.880 4.636 5.035 0.035 8 0 "[ . 1 . 2]" 2
60 1 12 PHE H 2 59 PRO QG 3.400 . 6.000 5.409 5.288 5.442 . 0 0 "[ . 1 . 2]" 2
61 1 12 PHE H 2 56 LYS QD 2.900 . 4.500 4.152 4.052 4.246 . 0 0 "[ . 1 . 2]" 2
62 1 12 PHE HB3 2 68 GLN QG 3.900 . 7.000 4.079 3.947 4.237 . 0 0 "[ . 1 . 2]" 2
63 1 12 PHE HB2 2 58 SER HA 3.900 . 6.000 4.932 4.846 5.031 . 0 0 "[ . 1 . 2]" 2
64 1 12 PHE HB2 2 59 PRO QD 3.900 . 7.000 5.137 5.039 5.209 . 0 0 "[ . 1 . 2]" 2
65 1 12 PHE HB2 2 68 GLN QG 3.900 . 7.000 5.146 5.020 5.286 . 0 0 "[ . 1 . 2]" 2
66 1 12 PHE HB2 2 56 LYS QG 3.400 . 6.000 4.861 4.693 5.031 . 0 0 "[ . 1 . 2]" 2
67 1 12 PHE QD 2 58 SER HB3 3.400 . 7.000 3.244 3.083 3.361 . 0 0 "[ . 1 . 2]" 2
68 1 12 PHE QD 2 66 GLN HB3 3.400 . 7.000 5.040 4.749 5.260 . 0 0 "[ . 1 . 2]" 2
69 1 12 PHE QD 2 68 GLN QG 3.900 . 9.000 3.651 3.435 3.793 . 0 0 "[ . 1 . 2]" 2
70 1 12 PHE QE 2 67 LEU HA 2.900 . 5.300 1.950 1.855 2.094 . 0 0 "[ . 1 . 2]" 2
71 1 12 PHE QE 2 57 ILE HA 2.900 . 5.300 2.472 2.330 2.618 . 0 0 "[ . 1 . 2]" 2
72 1 12 PHE QE 2 58 SER HA 3.400 . 7.000 4.388 4.271 4.462 . 0 0 "[ . 1 . 2]" 2
73 1 12 PHE QE 2 56 LYS HB3 2.900 . 5.300 3.660 3.583 3.786 . 0 0 "[ . 1 . 2]" 2
74 1 12 PHE QE 2 56 LYS QD 2.900 . 6.300 4.316 4.272 4.349 . 0 0 "[ . 1 . 2]" 2
75 1 12 PHE QE 2 56 LYS QG 3.400 . 8.000 5.059 4.950 5.168 . 0 0 "[ . 1 . 2]" 2
76 1 12 PHE HZ 2 67 LEU HA 3.400 . 5.000 3.583 3.389 3.701 . 0 0 "[ . 1 . 2]" 2
77 1 12 PHE HZ 2 57 ILE HA 3.400 . 5.000 4.829 4.666 5.019 0.019 5 0 "[ . 1 . 2]" 2
78 1 12 PHE HZ 2 58 SER HA 3.900 . 6.000 5.922 5.761 6.032 0.032 10 0 "[ . 1 . 2]" 2
79 1 12 PHE HZ 2 58 SER HB3 3.900 . 6.000 3.654 3.488 3.758 . 0 0 "[ . 1 . 2]" 2
80 1 12 PHE HZ 2 78 ASN HB3 3.400 . 5.000 3.575 3.336 3.941 . 0 0 "[ . 1 . 2]" 2
81 1 12 PHE HZ 2 66 GLN HB3 2.900 . 3.300 2.363 2.060 2.695 . 0 0 "[ . 1 . 2]" 2
82 1 12 PHE HZ 2 66 GLN QG 3.400 . 6.000 4.239 3.947 4.530 . 0 0 "[ . 1 . 2]" 2
83 1 12 PHE HZ 2 66 GLN HB2 2.900 . 3.300 2.948 2.658 3.197 . 0 0 "[ . 1 . 2]" 2
84 1 12 PHE HZ 2 56 LYS QD 3.400 . 6.000 5.401 5.351 5.444 . 0 0 "[ . 1 . 2]" 2
85 1 12 PHE HZ 2 56 LYS QG 3.900 . 7.000 6.333 6.198 6.405 . 0 0 "[ . 1 . 2]" 2
86 1 12 PHE QE 2 56 LYS H 2.900 . 5.500 4.628 4.472 4.772 . 0 0 "[ . 1 . 2]" 2
87 1 12 PHE QD 2 56 LYS HA 3.900 . 8.000 3.930 3.855 4.036 . 0 0 "[ . 1 . 2]" 2
88 1 12 PHE QD 2 56 LYS HB3 2.900 . 5.300 1.957 1.861 2.064 . 0 0 "[ . 1 . 2]" 2
89 1 12 PHE HA 2 56 LYS HB3 3.400 . 5.000 3.544 3.330 3.780 . 0 0 "[ . 1 . 2]" 2
90 1 12 PHE HB3 2 56 LYS HB3 2.900 . 3.300 2.441 2.240 2.813 . 0 0 "[ . 1 . 2]" 2
91 1 12 PHE HB2 2 56 LYS HB3 3.400 . 5.000 4.037 3.865 4.390 . 0 0 "[ . 1 . 2]" 2
92 1 12 PHE QD 2 56 LYS HB2 2.900 . 5.300 2.876 2.484 3.186 . 0 0 "[ . 1 . 2]" 2
93 1 12 PHE HA 2 56 LYS HB2 3.400 . 5.000 4.859 4.518 4.999 . 0 0 "[ . 1 . 2]" 2
94 1 12 PHE HB3 2 56 LYS HB2 2.900 . 3.300 3.354 3.260 3.429 0.129 12 0 "[ . 1 . 2]" 2
95 1 12 PHE HB2 2 56 LYS HB2 3.900 . 6.000 4.737 4.603 4.817 . 0 0 "[ . 1 . 2]" 2
96 1 12 PHE QD 2 56 LYS QG 3.400 . 8.000 4.008 3.925 4.101 . 0 0 "[ . 1 . 2]" 2
97 1 12 PHE HA 2 56 LYS QG 3.400 . 6.000 5.202 4.965 5.426 . 0 0 "[ . 1 . 2]" 2
98 1 12 PHE HB3 2 56 LYS QG 3.900 . 7.000 3.413 3.296 3.544 . 0 0 "[ . 1 . 2]" 2
99 1 12 PHE QD 2 56 LYS QD 2.900 . 6.300 3.040 2.898 3.079 . 0 0 "[ . 1 . 2]" 2
100 1 12 PHE HA 2 56 LYS QD 2.900 . 4.300 3.718 3.514 3.929 . 0 0 "[ . 1 . 2]" 2
101 1 12 PHE HB3 2 56 LYS QD 2.900 . 4.300 1.442 1.221 1.641 0.579 7 2 "[ - . + 1 . 2]" 2
102 1 12 PHE HB2 2 56 LYS QD 2.900 . 4.300 2.769 2.575 2.919 . 0 0 "[ . 1 . 2]" 2
103 1 12 PHE QD 2 56 LYS QE 3.400 . 8.000 4.433 4.336 4.524 . 0 0 "[ . 1 . 2]" 2
104 1 12 PHE HB3 2 56 LYS QE 3.400 . 6.000 3.058 2.817 3.236 . 0 0 "[ . 1 . 2]" 2
105 1 12 PHE QD 2 57 ILE H 2.900 . 5.500 2.889 2.713 3.244 . 0 0 "[ . 1 . 2]" 2
106 1 12 PHE HB3 2 57 ILE H 3.400 . 5.000 4.642 4.356 4.987 . 0 0 "[ . 1 . 2]" 2
107 1 12 PHE QD 2 57 ILE HA 2.900 . 5.300 3.172 3.087 3.333 . 0 0 "[ . 1 . 2]" 2
108 1 12 PHE QD 2 57 ILE MG 3.400 . 8.500 4.527 4.426 4.652 . 0 0 "[ . 1 . 2]" 2
109 1 12 PHE QD 2 58 SER H 2.900 . 5.500 3.278 3.130 3.475 . 0 0 "[ . 1 . 2]" 2
110 1 12 PHE QE 2 58 SER H 2.900 . 5.500 2.635 2.513 2.754 . 0 0 "[ . 1 . 2]" 2
111 1 12 PHE QD 2 58 SER HA 2.900 . 5.300 3.288 3.142 3.373 . 0 0 "[ . 1 . 2]" 2
112 1 12 PHE HA 2 58 SER HA 2.900 . 3.300 2.228 2.082 2.319 . 0 0 "[ . 1 . 2]" 2
113 1 12 PHE HB3 2 58 SER HA 3.400 . 5.000 4.903 4.706 5.040 0.040 14 0 "[ . 1 . 2]" 2
114 1 12 PHE QE 2 58 SER HB2 2.900 . 5.300 4.459 4.377 4.522 . 0 0 "[ . 1 . 2]" 2
115 1 12 PHE HB3 2 58 SER HB2 3.900 . 6.000 5.530 5.377 5.615 . 0 0 "[ . 1 . 2]" 2
116 1 12 PHE QE 2 58 SER HB3 2.900 . 5.300 3.069 2.984 3.173 . 0 0 "[ . 1 . 2]" 2
117 1 12 PHE HA 2 59 PRO QG 3.400 . 6.000 4.621 4.452 4.751 . 0 0 "[ . 1 . 2]" 2
118 1 12 PHE QD 2 59 PRO QD 2.900 . 6.300 4.216 4.100 4.317 . 0 0 "[ . 1 . 2]" 2
119 1 12 PHE HA 2 59 PRO QD 2.900 . 4.300 2.866 2.689 2.961 . 0 0 "[ . 1 . 2]" 2
120 1 12 PHE HB3 2 59 PRO QD 3.400 . 6.000 5.217 4.991 5.369 . 0 0 "[ . 1 . 2]" 2
121 1 12 PHE HB3 2 66 GLN QE 3.400 . 6.000 5.582 5.517 5.639 . 0 0 "[ . 1 . 2]" 2
122 1 12 PHE QE 2 66 GLN HA 3.400 . 7.000 4.660 4.436 4.896 . 0 0 "[ . 1 . 2]" 2
123 1 12 PHE QE 2 66 GLN HB3 2.900 . 5.300 3.368 3.121 3.605 . 0 0 "[ . 1 . 2]" 2
124 1 12 PHE QE 2 66 GLN HB2 2.900 . 5.300 3.244 3.004 3.403 . 0 0 "[ . 1 . 2]" 2
125 1 12 PHE QE 2 66 GLN QG 3.400 . 8.000 4.487 4.296 4.690 . 0 0 "[ . 1 . 2]" 2
126 1 12 PHE QE 2 67 LEU H 2.900 . 5.500 3.467 3.269 3.647 . 0 0 "[ . 1 . 2]" 2
127 1 12 PHE QD 2 68 GLN H 2.900 . 5.500 4.362 4.259 4.432 . 0 0 "[ . 1 . 2]" 2
128 1 12 PHE QE 2 68 GLN H 2.900 . 5.500 2.896 2.763 3.072 . 0 0 "[ . 1 . 2]" 2
129 1 12 PHE QE 2 68 GLN QE 2.900 . 6.500 2.545 2.401 2.692 . 0 0 "[ . 1 . 2]" 2
130 1 12 PHE HA 2 68 GLN QE 3.400 . 6.000 5.404 5.344 5.468 . 0 0 "[ . 1 . 2]" 2
131 1 12 PHE HB2 2 68 GLN QE 3.400 . 6.000 3.854 3.810 3.899 . 0 0 "[ . 1 . 2]" 2
132 1 12 PHE H 2 68 GLN QE 3.400 . 6.000 5.441 5.354 5.487 . 0 0 "[ . 1 . 2]" 2
133 1 12 PHE HB3 2 68 GLN QE 3.400 . 6.000 3.799 3.602 4.091 . 0 0 "[ . 1 . 2]" 2
134 1 12 PHE QE 2 68 GLN HA 3.400 . 7.000 4.372 4.261 4.454 . 0 0 "[ . 1 . 2]" 2
135 1 12 PHE QD 2 68 GLN HB2 2.900 . 5.300 5.055 4.960 5.112 . 0 0 "[ . 1 . 2]" 2
136 1 12 PHE QE 2 68 GLN HB2 2.900 . 5.300 4.022 3.926 4.113 . 0 0 "[ . 1 . 2]" 2
137 1 12 PHE QD 2 68 GLN HB3 2.900 . 5.300 3.891 3.816 3.968 . 0 0 "[ . 1 . 2]" 2
138 1 12 PHE QE 2 68 GLN HB3 2.900 . 5.300 2.863 2.756 2.958 . 0 0 "[ . 1 . 2]" 2
139 1 12 PHE QE 2 68 GLN QG 3.400 . 8.000 3.581 3.386 3.793 . 0 0 "[ . 1 . 2]" 2
140 1 12 PHE QE 2 78 ASN H 3.400 . 7.000 6.023 5.828 6.253 . 0 0 "[ . 1 . 2]" 2
141 1 12 PHE HB2 2 78 ASN QD 3.900 . 7.000 5.221 4.900 5.755 . 0 0 "[ . 1 . 2]" 2
142 1 12 PHE QE 2 78 ASN HA 3.900 . 8.000 4.280 4.057 4.552 . 0 0 "[ . 1 . 2]" 2
143 1 12 PHE HZ 2 78 ASN HB2 3.400 . 5.000 5.061 5.013 5.108 0.108 10 0 "[ . 1 . 2]" 2
144 1 12 PHE QE 2 78 ASN HB2 3.400 . 7.000 4.631 4.355 4.995 . 0 0 "[ . 1 . 2]" 2
145 1 12 PHE QE 2 78 ASN HB3 3.400 . 7.000 3.585 3.110 4.369 . 0 0 "[ . 1 . 2]" 2
146 1 12 PHE QE 2 79 PHE H 2.900 . 5.500 4.386 4.110 4.707 . 0 0 "[ . 1 . 2]" 2
147 1 13 ASN H 2 57 ILE H 3.400 . 3.500 2.833 2.554 3.036 . 0 0 "[ . 1 . 2]" 2
148 1 13 ASN H 2 58 SER HA 3.400 . 5.000 2.912 2.691 3.191 . 0 0 "[ . 1 . 2]" 2
149 1 13 ASN H 2 59 PRO QD 3.400 . 6.000 2.709 2.417 2.989 . 0 0 "[ . 1 . 2]" 2
150 1 13 ASN H 2 59 PRO QG 3.400 . 6.000 4.396 4.130 4.720 . 0 0 "[ . 1 . 2]" 2
151 1 13 ASN H 2 56 LYS QD 2.900 . 4.500 3.939 3.793 4.186 . 0 0 "[ . 1 . 2]" 2
152 1 13 ASN QD 2 59 PRO HA 3.400 . 6.000 5.265 5.098 5.427 . 0 0 "[ . 1 . 2]" 2
153 1 13 ASN QD 2 59 PRO QB 3.400 . 7.000 3.524 3.218 3.649 . 0 0 "[ . 1 . 2]" 2
154 1 13 ASN QD 2 57 ILE QG 3.400 . 7.000 4.428 4.168 4.674 . 0 0 "[ . 1 . 2]" 2
155 1 13 ASN HA 2 56 LYS QG 3.900 . 7.000 4.514 3.831 5.234 . 0 0 "[ . 1 . 2]" 2
156 1 13 ASN HA 2 56 LYS QD 3.900 . 7.000 4.062 3.695 4.362 . 0 0 "[ . 1 . 2]" 2
157 1 13 ASN QB 2 57 ILE H 2.900 . 4.500 3.373 2.838 3.662 . 0 0 "[ . 1 . 2]" 2
158 1 13 ASN QB 2 57 ILE QG 3.400 . 7.000 2.818 2.352 3.235 . 0 0 "[ . 1 . 2]" 2
159 1 13 ASN QB 2 57 ILE MG 3.900 . 8.500 4.133 3.626 4.429 . 0 0 "[ . 1 . 2]" 2
160 1 13 ASN HA 2 59 PRO QD 3.900 . 7.000 4.585 4.100 5.042 . 0 0 "[ . 1 . 2]" 2
161 1 14 GLU QG 2 56 LYS HB3 3.400 . 5.000 4.215 4.080 4.383 . 0 0 "[ . 1 . 2]" 2
162 1 14 GLU QG 2 56 LYS QD 3.400 . 6.000 3.362 2.417 4.130 . 0 0 "[ . 1 . 2]" 2
163 1 14 GLU HA 2 56 LYS QG 3.400 . 6.000 2.854 1.880 3.658 . 0 0 "[ . 1 . 2]" 2
164 1 14 GLU HA 2 56 LYS QD 3.400 . 6.000 4.505 3.578 5.265 . 0 0 "[ . 1 . 2]" 2
165 1 14 GLU HA 2 56 LYS QE 3.400 . 6.000 4.943 3.783 5.460 . 0 0 "[ . 1 . 2]" 2
166 1 14 GLU QG 2 56 LYS QE 3.400 . 7.000 2.804 1.681 4.092 0.119 12 0 "[ . 1 . 2]" 2
167 1 14 GLU HA 2 57 ILE H 3.400 . 5.000 3.742 3.332 4.338 . 0 0 "[ . 1 . 2]" 2
168 1 18 ASP HA 2 53 LYS QE 3.400 . 6.000 2.961 1.459 5.315 0.341 14 0 "[ . 1 . 2]" 2
169 1 18 ASP HA 2 53 LYS QG 3.400 . 6.000 3.814 1.983 5.509 . 0 0 "[ . 1 . 2]" 2
170 1 18 ASP QB 2 53 LYS QE 3.900 . 8.000 3.642 2.117 4.951 . 0 0 "[ . 1 . 2]" 2
171 1 18 ASP QB 2 53 LYS QD 3.400 . 7.000 4.919 3.596 5.698 . 0 0 "[ . 1 . 2]" 2
172 1 17 GLU H 2 53 LYS QE 3.400 . 6.000 5.183 3.935 5.600 . 0 0 "[ . 1 . 2]" 2
173 1 18 ASP H 2 53 LYS QE 3.400 . 6.000 4.279 2.757 5.434 . 0 0 "[ . 1 . 2]" 2
174 1 19 ASP H 2 53 LYS QE 3.400 . 6.000 3.972 1.677 5.350 0.123 1 0 "[ . 1 . 2]" 2
stop_
save_
save_distance_constraint_statistics_3
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 3
_Distance_constraint_stats_list.Constraint_count 96
_Distance_constraint_stats_list.Viol_count 149
_Distance_constraint_stats_list.Viol_total 331.425
_Distance_constraint_stats_list.Viol_max 0.283
_Distance_constraint_stats_list.Viol_rms 0.0380
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0086
_Distance_constraint_stats_list.Viol_average_violations_only 0.1112
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
2 11 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
2 12 LEU 0.368 0.076 8 0 "[ . 1 . 2]"
2 14 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
2 17 VAL 0.262 0.066 7 0 "[ . 1 . 2]"
2 18 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
2 19 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
2 22 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
2 24 GLY 0.262 0.066 7 0 "[ . 1 . 2]"
2 25 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
2 26 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
2 27 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
2 28 LEU 0.368 0.076 8 0 "[ . 1 . 2]"
2 29 MET 3.042 0.201 7 0 "[ . 1 . 2]"
2 31 GLU 1.638 0.100 19 0 "[ . 1 . 2]"
2 32 ARG 3.042 0.201 7 0 "[ . 1 . 2]"
2 33 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
2 34 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
2 35 TRP 0.001 0.001 10 0 "[ . 1 . 2]"
2 36 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
2 45 ILE 0.001 0.001 10 0 "[ . 1 . 2]"
2 47 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
2 48 MET 0.000 0.000 . 0 "[ . 1 . 2]"
2 49 TYR 3.489 0.109 17 0 "[ . 1 . 2]"
2 51 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
2 52 ILE 1.851 0.109 17 0 "[ . 1 . 2]"
2 53 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
2 54 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
2 56 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
2 58 SER 9.257 0.283 11 0 "[ . 1 . 2]"
2 65 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
2 66 GLN 9.257 0.283 11 0 "[ . 1 . 2]"
2 67 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
2 68 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
2 69 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
2 70 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
2 71 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
2 75 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
2 77 THR 0.000 0.000 . 0 "[ . 1 . 2]"
2 79 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
2 80 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
2 81 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
2 86 THR 0.000 0.000 . 0 "[ . 1 . 2]"
2 87 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
2 88 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
2 89 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
2 90 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
2 91 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
2 92 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
2 93 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
2 94 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
2 95 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
2 96 ASP 0.152 0.050 6 0 "[ . 1 . 2]"
2 97 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
2 98 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
2 99 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
2 100 GLN 0.152 0.050 6 0 "[ . 1 . 2]"
2 101 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
2 102 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 2 11 LEU H 2 28 LEU O 2.000 . 2.300 1.815 1.743 1.997 . 0 0 "[ . 1 . 2]" 3
2 2 11 LEU N 2 28 LEU O 3.000 2.500 3.300 2.695 2.642 2.784 . 0 0 "[ . 1 . 2]" 3
3 2 12 LEU H 2 28 LEU O 2.000 . 2.300 2.299 2.220 2.376 0.076 8 0 "[ . 1 . 2]" 3
4 2 12 LEU N 2 28 LEU O 3.000 2.500 3.300 3.256 3.182 3.329 0.029 8 0 "[ . 1 . 2]" 3
5 2 14 VAL H 2 26 LEU O 2.000 . 2.300 1.623 1.604 1.644 . 0 0 "[ . 1 . 2]" 3
6 2 14 VAL N 2 26 LEU O 3.000 2.500 3.300 2.600 2.583 2.626 . 0 0 "[ . 1 . 2]" 3
7 2 17 VAL H 2 24 GLY O 2.000 . 2.300 1.720 1.631 1.765 . 0 0 "[ . 1 . 2]" 3
8 2 17 VAL N 2 24 GLY O 3.000 2.500 3.300 2.696 2.617 2.738 . 0 0 "[ . 1 . 2]" 3
9 2 18 ARG H 2 80 HIS O 2.000 . 2.300 1.708 1.603 1.964 . 0 0 "[ . 1 . 2]" 3
10 2 18 ARG N 2 80 HIS O 3.000 2.500 3.300 2.650 2.552 2.845 . 0 0 "[ . 1 . 2]" 3
11 2 19 GLN H 2 22 GLN O 2.000 . 2.300 1.783 1.684 1.899 . 0 0 "[ . 1 . 2]" 3
12 2 19 GLN N 2 22 GLN O 3.000 2.500 3.300 2.695 2.614 2.785 . 0 0 "[ . 1 . 2]" 3
13 2 17 VAL O 2 24 GLY H 2.000 . 2.300 2.249 2.055 2.366 0.066 7 0 "[ . 1 . 2]" 3
14 2 17 VAL O 2 24 GLY N 3.000 2.500 3.300 2.804 2.749 2.875 . 0 0 "[ . 1 . 2]" 3
15 2 25 ALA H 2 36 ALA O 2.000 . 2.300 1.772 1.718 1.883 . 0 0 "[ . 1 . 2]" 3
16 2 25 ALA N 2 36 ALA O 3.000 2.500 3.300 2.737 2.694 2.860 . 0 0 "[ . 1 . 2]" 3
17 2 14 VAL O 2 26 LEU H 2.000 . 2.300 2.173 2.005 2.273 . 0 0 "[ . 1 . 2]" 3
18 2 14 VAL O 2 26 LEU N 3.000 2.500 3.300 2.935 2.825 3.048 . 0 0 "[ . 1 . 2]" 3
19 2 27 TYR H 2 34 ALA O 2.000 . 2.300 1.698 1.652 1.969 . 0 0 "[ . 1 . 2]" 3
20 2 27 TYR N 2 34 ALA O 3.000 2.500 3.300 2.650 2.608 2.805 . 0 0 "[ . 1 . 2]" 3
21 2 12 LEU O 2 28 LEU H 2.000 . 2.300 1.811 1.753 1.876 . 0 0 "[ . 1 . 2]" 3
22 2 12 LEU O 2 28 LEU N 3.000 2.500 3.300 2.763 2.714 2.809 . 0 0 "[ . 1 . 2]" 3
23 2 29 MET H 2 32 ARG O 2.000 . 2.300 1.784 1.708 1.857 . 0 0 "[ . 1 . 2]" 3
24 2 29 MET N 2 32 ARG O 3.000 2.500 3.300 2.645 2.601 2.696 . 0 0 "[ . 1 . 2]" 3
25 2 29 MET O 2 32 ARG H 2.000 . 2.300 2.447 2.407 2.501 0.201 7 0 "[ . 1 . 2]" 3
26 2 29 MET O 2 32 ARG N 3.000 2.500 3.300 3.265 3.166 3.336 0.036 16 0 "[ . 1 . 2]" 3
27 2 33 ILE H 2 47 HIS O 2.000 . 2.300 1.839 1.736 1.925 . 0 0 "[ . 1 . 2]" 3
28 2 33 ILE N 2 47 HIS O 3.000 2.500 3.300 2.793 2.696 2.885 . 0 0 "[ . 1 . 2]" 3
29 2 27 TYR O 2 34 ALA H 2.000 . 2.300 1.914 1.782 2.075 . 0 0 "[ . 1 . 2]" 3
30 2 27 TYR O 2 34 ALA N 3.000 2.500 3.300 2.835 2.720 2.952 . 0 0 "[ . 1 . 2]" 3
31 2 35 TRP H 2 45 ILE O 2.000 . 2.300 1.998 1.882 2.169 . 0 0 "[ . 1 . 2]" 3
32 2 35 TRP N 2 45 ILE O 3.000 2.500 3.300 2.904 2.799 3.076 . 0 0 "[ . 1 . 2]" 3
33 2 25 ALA O 2 36 ALA H 2.000 . 2.300 1.918 1.794 2.049 . 0 0 "[ . 1 . 2]" 3
34 2 25 ALA O 2 36 ALA N 3.000 2.500 3.300 2.884 2.750 3.022 . 0 0 "[ . 1 . 2]" 3
35 2 35 TRP O 2 45 ILE H 2.000 . 2.300 2.093 1.947 2.301 0.001 10 0 "[ . 1 . 2]" 3
36 2 35 TRP O 2 45 ILE N 3.000 2.500 3.300 3.015 2.884 3.162 . 0 0 "[ . 1 . 2]" 3
37 2 33 ILE O 2 47 HIS H 2.000 . 2.300 2.017 1.940 2.122 . 0 0 "[ . 1 . 2]" 3
38 2 33 ILE O 2 47 HIS N 3.000 2.500 3.300 2.996 2.922 3.091 . 0 0 "[ . 1 . 2]" 3
39 2 31 GLU O 2 49 TYR H 2.000 . 2.300 2.351 2.208 2.400 0.100 19 0 "[ . 1 . 2]" 3
40 2 31 GLU O 2 49 TYR N 3.000 2.500 3.300 3.318 3.173 3.373 0.073 19 0 "[ . 1 . 2]" 3
41 2 48 MET O 2 51 ASP H 2.000 . 2.300 1.952 1.862 2.035 . 0 0 "[ . 1 . 2]" 3
42 2 48 MET O 2 51 ASP N 3.000 2.500 3.300 2.858 2.798 2.925 . 0 0 "[ . 1 . 2]" 3
43 2 49 TYR O 2 52 ILE H 2.000 . 2.300 2.392 2.358 2.409 0.109 17 0 "[ . 1 . 2]" 3
44 2 49 TYR O 2 52 ILE N 3.000 2.500 3.300 3.255 3.216 3.305 0.005 18 0 "[ . 1 . 2]" 3
45 2 53 LYS H 2 70 VAL O 2.000 . 2.300 1.875 1.739 1.979 . 0 0 "[ . 1 . 2]" 3
46 2 53 LYS N 2 70 VAL O 3.000 2.500 3.300 2.693 2.592 2.791 . 0 0 "[ . 1 . 2]" 3
47 2 54 CYS H 2 70 VAL O 2.000 . 2.300 1.848 1.744 1.977 . 0 0 "[ . 1 . 2]" 3
48 2 54 CYS N 2 70 VAL O 3.000 2.500 3.300 2.795 2.705 2.901 . 0 0 "[ . 1 . 2]" 3
49 2 56 LYS H 2 68 GLN O 2.000 . 2.300 1.814 1.767 1.884 . 0 0 "[ . 1 . 2]" 3
50 2 56 LYS N 2 68 GLN O 3.000 2.500 3.300 2.743 2.694 2.813 . 0 0 "[ . 1 . 2]" 3
51 2 58 SER O 2 66 GLN H 2.000 . 2.300 2.541 2.490 2.583 0.283 11 0 "[ . 1 . 2]" 3
52 2 58 SER O 2 66 GLN N 3.000 2.500 3.300 3.521 3.459 3.562 0.262 11 0 "[ . 1 . 2]" 3
53 2 67 LEU H 2 79 PHE O 2.000 . 2.300 1.923 1.791 2.078 . 0 0 "[ . 1 . 2]" 3
54 2 67 LEU N 2 79 PHE O 3.000 2.500 3.300 2.859 2.738 2.974 . 0 0 "[ . 1 . 2]" 3
55 2 56 LYS O 2 68 GLN H 2.000 . 2.300 1.812 1.758 1.890 . 0 0 "[ . 1 . 2]" 3
56 2 56 LYS O 2 68 GLN N 3.000 2.500 3.300 2.702 2.650 2.761 . 0 0 "[ . 1 . 2]" 3
57 2 69 LEU H 2 77 THR O 2.000 . 2.300 1.658 1.603 1.723 . 0 0 "[ . 1 . 2]" 3
58 2 69 LEU N 2 77 THR O 3.000 2.500 3.300 2.622 2.580 2.679 . 0 0 "[ . 1 . 2]" 3
59 2 54 CYS O 2 70 VAL H 2.000 . 2.300 1.965 1.907 2.037 . 0 0 "[ . 1 . 2]" 3
60 2 54 CYS O 2 70 VAL N 3.000 2.500 3.300 2.769 2.714 2.837 . 0 0 "[ . 1 . 2]" 3
61 2 71 LEU H 2 75 ASP O 2.000 . 2.300 1.831 1.747 1.992 . 0 0 "[ . 1 . 2]" 3
62 2 71 LEU N 2 75 ASP O 3.000 2.500 3.300 2.778 2.704 2.871 . 0 0 "[ . 1 . 2]" 3
63 2 69 LEU O 2 77 THR H 2.000 . 2.300 1.768 1.733 1.823 . 0 0 "[ . 1 . 2]" 3
64 2 69 LEU O 2 77 THR N 3.000 2.500 3.300 2.705 2.676 2.752 . 0 0 "[ . 1 . 2]" 3
65 2 67 LEU O 2 79 PHE H 2.000 . 2.300 1.643 1.563 1.782 . 0 0 "[ . 1 . 2]" 3
66 2 67 LEU O 2 79 PHE N 3.000 2.500 3.300 2.561 2.528 2.605 . 0 0 "[ . 1 . 2]" 3
67 2 18 ARG O 2 80 HIS H 2.000 . 2.300 1.735 1.657 1.832 . 0 0 "[ . 1 . 2]" 3
68 2 18 ARG O 2 80 HIS N 3.000 2.500 3.300 2.695 2.622 2.784 . 0 0 "[ . 1 . 2]" 3
69 2 65 ILE O 2 81 PHE H 2.000 . 2.300 1.925 1.786 2.052 . 0 0 "[ . 1 . 2]" 3
70 2 65 ILE O 2 81 PHE N 3.000 2.500 3.300 2.724 2.662 2.821 . 0 0 "[ . 1 . 2]" 3
71 2 86 THR O 2 90 GLU H 2.000 . 2.300 1.636 1.609 1.686 . 0 0 "[ . 1 . 2]" 3
72 2 86 THR O 2 90 GLU N 3.000 2.500 3.300 2.574 2.559 2.597 . 0 0 "[ . 1 . 2]" 3
73 2 87 ALA O 2 91 ARG H 2.000 . 2.300 1.723 1.684 1.832 . 0 0 "[ . 1 . 2]" 3
74 2 87 ALA O 2 91 ARG N 3.000 2.500 3.300 2.661 2.628 2.739 . 0 0 "[ . 1 . 2]" 3
75 2 88 VAL O 2 92 ASP H 2.000 . 2.300 2.037 1.948 2.177 . 0 0 "[ . 1 . 2]" 3
76 2 88 VAL O 2 92 ASP N 3.000 2.500 3.300 2.978 2.894 3.084 . 0 0 "[ . 1 . 2]" 3
77 2 89 LYS O 2 93 ALA H 2.000 . 2.300 1.809 1.757 1.895 . 0 0 "[ . 1 . 2]" 3
78 2 89 LYS O 2 93 ALA N 3.000 2.500 3.300 2.724 2.677 2.829 . 0 0 "[ . 1 . 2]" 3
79 2 90 GLU O 2 94 VAL H 2.000 . 2.300 1.832 1.772 2.005 . 0 0 "[ . 1 . 2]" 3
80 2 90 GLU O 2 94 VAL N 3.000 2.500 3.300 2.807 2.745 2.967 . 0 0 "[ . 1 . 2]" 3
81 2 91 ARG O 2 95 LYS H 2.000 . 2.300 1.914 1.851 2.012 . 0 0 "[ . 1 . 2]" 3
82 2 91 ARG O 2 95 LYS N 3.000 2.500 3.300 2.828 2.766 2.894 . 0 0 "[ . 1 . 2]" 3
83 2 92 ASP O 2 96 ASP H 2.000 . 2.300 1.676 1.636 1.702 . 0 0 "[ . 1 . 2]" 3
84 2 92 ASP O 2 96 ASP N 3.000 2.500 3.300 2.636 2.589 2.674 . 0 0 "[ . 1 . 2]" 3
85 2 93 ALA O 2 97 LEU H 2.000 . 2.300 1.771 1.728 1.850 . 0 0 "[ . 1 . 2]" 3
86 2 93 ALA O 2 97 LEU N 3.000 2.500 3.300 2.744 2.698 2.831 . 0 0 "[ . 1 . 2]" 3
87 2 94 VAL O 2 98 LEU H 2.000 . 2.300 1.955 1.863 2.167 . 0 0 "[ . 1 . 2]" 3
88 2 94 VAL O 2 98 LEU N 3.000 2.500 3.300 2.835 2.762 2.955 . 0 0 "[ . 1 . 2]" 3
89 2 95 LYS O 2 99 GLN H 2.000 . 2.300 1.716 1.651 1.834 . 0 0 "[ . 1 . 2]" 3
90 2 95 LYS O 2 99 GLN N 3.000 2.500 3.300 2.675 2.606 2.777 . 0 0 "[ . 1 . 2]" 3
91 2 96 ASP O 2 100 GLN H 2.000 . 2.300 2.206 2.048 2.350 0.050 6 0 "[ . 1 . 2]" 3
92 2 96 ASP O 2 100 GLN N 3.000 2.500 3.300 2.906 2.739 3.105 . 0 0 "[ . 1 . 2]" 3
93 2 97 LEU O 2 101 LEU H 2.000 . 2.300 1.718 1.632 1.841 . 0 0 "[ . 1 . 2]" 3
94 2 97 LEU O 2 101 LEU N 3.000 2.500 3.300 2.622 2.569 2.705 . 0 0 "[ . 1 . 2]" 3
95 2 98 LEU O 2 102 LEU H 2.000 . 2.300 1.622 1.588 1.683 . 0 0 "[ . 1 . 2]" 3
96 2 98 LEU O 2 102 LEU N 3.000 2.500 3.300 2.561 2.529 2.604 . 0 0 "[ . 1 . 2]" 3
stop_
save_
Contact the webmaster for help, if required. Sunday, May 19, 2024 1:19:12 PM GMT (wattos1)