NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
573486 |
2rtu   |
11532 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2rtu
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 1456
_Distance_constraint_stats_list.Viol_count 86
_Distance_constraint_stats_list.Viol_total 236.510
_Distance_constraint_stats_list.Viol_max 0.487
_Distance_constraint_stats_list.Viol_rms 0.0095
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0004
_Distance_constraint_stats_list.Viol_average_violations_only 0.1375
_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 7 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 PRO 0.076 0.076 6 0 "[ . 1 . 2]"
1 13 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 14 GLY 0.017 0.017 18 0 "[ . 1 . 2]"
1 15 LYS 0.229 0.097 8 0 "[ . 1 . 2]"
1 16 MET 0.436 0.241 12 0 "[ . 1 . 2]"
1 17 SER 0.342 0.220 11 0 "[ . 1 . 2]"
1 18 SER 0.043 0.043 17 0 "[ . 1 . 2]"
1 19 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 20 ALA 0.342 0.220 11 0 "[ . 1 . 2]"
1 21 PHE 0.561 0.184 4 0 "[ . 1 . 2]"
1 22 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 25 THR 0.317 0.197 10 0 "[ . 1 . 2]"
1 26 CYS 0.317 0.197 10 0 "[ . 1 . 2]"
1 27 ARG 0.635 0.349 13 0 "[ . 1 . 2]"
1 28 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 29 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 30 HIS 0.190 0.129 4 0 "[ . 1 . 2]"
1 31 LYS 0.292 0.133 2 0 "[ . 1 . 2]"
1 32 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 33 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 34 HIS 0.083 0.049 12 0 "[ . 1 . 2]"
1 35 PRO 0.145 0.133 2 0 "[ . 1 . 2]"
1 36 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 ALA 0.528 0.335 10 0 "[ . 1 . 2]"
1 38 SER 0.329 0.215 1 0 "[ . 1 . 2]"
1 39 VAL 1.745 0.355 13 0 "[ . 1 . 2]"
1 40 ASN 1.158 0.446 18 0 "[ . 1 . 2]"
1 41 PHE 0.979 0.241 17 0 "[ . 1 . 2]"
1 42 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 43 GLU 0.446 0.446 18 0 "[ . 1 . 2]"
1 44 PHE 2.251 0.355 13 0 "[ . 1 . 2]"
1 45 SER 0.979 0.241 17 0 "[ . 1 . 2]"
1 46 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 47 LYS 0.875 0.246 17 0 "[ . 1 . 2]"
1 48 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 49 SER 0.424 0.157 8 0 "[ . 1 . 2]"
1 50 GLU 0.206 0.206 8 0 "[ . 1 . 2]"
1 51 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 TRP 0.277 0.235 6 0 "[ . 1 . 2]"
1 53 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 54 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 MET 0.098 0.094 3 0 "[ . 1 . 2]"
1 56 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 57 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 58 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 59 GLU 0.004 0.004 14 0 "[ . 1 . 2]"
1 60 LYS 0.094 0.094 3 0 "[ . 1 . 2]"
1 61 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 62 LYS 0.155 0.102 3 0 "[ . 1 . 2]"
1 63 PHE 0.053 0.053 3 0 "[ . 1 . 2]"
1 64 GLU 0.235 0.235 6 0 "[ . 1 . 2]"
1 65 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 66 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 67 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 68 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 69 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 70 ASP 0.268 0.241 12 0 "[ . 1 . 2]"
1 71 LYS 0.405 0.184 4 0 "[ . 1 . 2]"
1 72 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 73 ARG 2.904 0.487 18 0 "[ . 1 . 2]"
1 74 TYR 2.580 0.487 18 0 "[ . 1 . 2]"
1 75 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 76 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 77 GLU 0.455 0.321 16 0 "[ . 1 . 2]"
1 78 MET 1.052 0.322 16 0 "[ . 1 . 2]"
1 79 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 80 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 81 TYR 0.076 0.076 6 0 "[ . 1 . 2]"
1 82 ILE 1.052 0.322 16 0 "[ . 1 . 2]"
1 83 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 84 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 85 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 86 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 87 GLU 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 7 GLY QA 1 8 ASP H 3.500 . 5.300 2.421 2.110 2.897 . 0 0 "[ . 1 . 2]" 1
2 1 8 ASP H 1 9 PRO QD 4.500 . 7.000 4.284 4.071 4.419 . 0 0 "[ . 1 . 2]" 1
3 1 8 ASP H 1 10 LYS QD 4.500 . 7.500 5.579 4.353 7.153 . 0 0 "[ . 1 . 2]" 1
4 1 8 ASP HA 1 9 PRO HA 4.500 . 6.000 4.441 4.358 4.501 . 0 0 "[ . 1 . 2]" 1
5 1 8 ASP HA 1 9 PRO QG 4.500 . 7.000 3.868 3.700 4.074 . 0 0 "[ . 1 . 2]" 1
6 1 8 ASP QB 1 9 PRO QD 4.500 . 8.000 2.725 1.972 3.497 . 0 0 "[ . 1 . 2]" 1
7 1 9 PRO HA 1 10 LYS H 3.500 . 4.300 2.476 2.150 3.446 . 0 0 "[ . 1 . 2]" 1
8 1 9 PRO HA 1 11 LYS H 4.500 . 6.000 4.269 3.456 5.220 . 0 0 "[ . 1 . 2]" 1
9 1 9 PRO QB 1 11 LYS H 4.500 . 7.000 3.086 2.031 4.315 . 0 0 "[ . 1 . 2]" 1
10 1 9 PRO QB 1 11 LYS HA 4.500 . 7.000 4.771 4.054 5.548 . 0 0 "[ . 1 . 2]" 1
11 1 9 PRO QB 1 81 TYR QE 4.500 . 9.400 3.381 2.316 5.068 . 0 0 "[ . 1 . 2]" 1
12 1 9 PRO QG 1 10 LYS H 4.500 . 7.000 4.276 2.700 4.868 . 0 0 "[ . 1 . 2]" 1
13 1 10 LYS H 1 10 LYS QB 3.500 . 5.300 2.640 2.281 3.435 . 0 0 "[ . 1 . 2]" 1
14 1 10 LYS H 1 10 LYS QD 4.500 . 7.500 3.098 1.980 4.847 . 0 0 "[ . 1 . 2]" 1
15 1 10 LYS H 1 10 LYS QG 3.500 . 5.800 2.944 2.254 3.634 . 0 0 "[ . 1 . 2]" 1
16 1 10 LYS H 1 11 LYS QB 4.500 . 7.000 4.454 3.940 4.983 . 0 0 "[ . 1 . 2]" 1
17 1 10 LYS H 1 81 TYR QE 4.500 . 8.400 3.935 2.788 5.962 . 0 0 "[ . 1 . 2]" 1
18 1 10 LYS HA 1 10 LYS QB 2.500 . 4.400 2.393 2.337 2.461 . 0 0 "[ . 1 . 2]" 1
19 1 10 LYS HA 1 10 LYS QD 3.500 . 5.800 2.492 1.916 4.026 . 0 0 "[ . 1 . 2]" 1
20 1 10 LYS HA 1 11 LYS H 3.500 . 4.300 2.767 2.143 3.253 . 0 0 "[ . 1 . 2]" 1
21 1 10 LYS QB 1 11 LYS HA 4.500 . 7.000 4.297 4.144 4.494 . 0 0 "[ . 1 . 2]" 1
22 1 10 LYS QB 1 12 PRO QD 4.500 . 8.000 4.463 3.834 4.960 . 0 0 "[ . 1 . 2]" 1
23 1 10 LYS QB 1 81 TYR QE 4.500 . 9.400 2.931 1.981 5.218 . 0 0 "[ . 1 . 2]" 1
24 1 10 LYS QE 1 81 TYR QE 4.500 . 9.900 5.331 2.162 8.109 . 0 0 "[ . 1 . 2]" 1
25 1 10 LYS QG 1 81 TYR QE 4.500 . 9.900 4.284 3.331 6.390 . 0 0 "[ . 1 . 2]" 1
26 1 11 LYS H 1 11 LYS QB 3.500 . 5.300 2.294 2.181 2.422 . 0 0 "[ . 1 . 2]" 1
27 1 11 LYS H 1 11 LYS QG 4.500 . 7.500 3.986 3.930 4.040 . 0 0 "[ . 1 . 2]" 1
28 1 11 LYS H 1 12 PRO QD 4.500 . 7.000 4.186 3.754 4.389 . 0 0 "[ . 1 . 2]" 1
29 1 11 LYS H 1 81 TYR QE 4.500 . 8.400 4.029 2.949 5.303 . 0 0 "[ . 1 . 2]" 1
30 1 11 LYS HA 1 12 PRO HA 4.500 . 6.000 4.489 4.455 4.548 . 0 0 "[ . 1 . 2]" 1
31 1 11 LYS HA 1 12 PRO QD 3.500 . 5.300 1.929 1.841 2.013 . 0 0 "[ . 1 . 2]" 1
32 1 11 LYS HA 1 12 PRO QG 4.500 . 7.000 3.830 3.739 3.916 . 0 0 "[ . 1 . 2]" 1
33 1 11 LYS HA 1 78 MET ME 4.500 . 7.500 4.703 2.673 5.869 . 0 0 "[ . 1 . 2]" 1
34 1 11 LYS HA 1 81 TYR QB 4.500 . 7.000 4.071 3.419 4.935 . 0 0 "[ . 1 . 2]" 1
35 1 11 LYS HA 1 81 TYR QD 4.500 . 8.400 3.398 2.376 4.650 . 0 0 "[ . 1 . 2]" 1
36 1 11 LYS HA 1 81 TYR QE 3.500 . 6.700 3.624 2.367 4.757 . 0 0 "[ . 1 . 2]" 1
37 1 11 LYS QB 1 12 PRO QD 4.500 . 8.000 3.533 3.321 3.760 . 0 0 "[ . 1 . 2]" 1
38 1 11 LYS QB 1 81 TYR QD 4.500 . 9.400 3.575 2.356 5.023 . 0 0 "[ . 1 . 2]" 1
39 1 11 LYS QB 1 81 TYR QE 3.500 . 7.700 2.775 2.082 4.330 . 0 0 "[ . 1 . 2]" 1
40 1 11 LYS QB 1 83 PRO QB 4.500 . 8.000 3.859 2.664 6.170 . 0 0 "[ . 1 . 2]" 1
41 1 11 LYS QB 1 83 PRO QD 4.500 . 8.000 5.504 3.841 7.174 . 0 0 "[ . 1 . 2]" 1
42 1 11 LYS QB 1 83 PRO QG 4.500 . 8.000 4.746 3.075 6.738 . 0 0 "[ . 1 . 2]" 1
43 1 11 LYS QD 1 83 PRO QD 4.500 . 8.500 5.490 3.247 7.676 . 0 0 "[ . 1 . 2]" 1
44 1 11 LYS QD 1 83 PRO QG 4.500 . 8.500 4.308 2.642 6.812 . 0 0 "[ . 1 . 2]" 1
45 1 11 LYS QE 1 78 MET ME 3.500 . 7.300 2.707 1.914 3.548 . 0 0 "[ . 1 . 2]" 1
46 1 11 LYS QE 1 81 TYR QE 4.500 . 9.900 4.712 2.611 6.999 . 0 0 "[ . 1 . 2]" 1
47 1 11 LYS QE 1 82 ILE MG 4.500 . 9.000 7.410 6.370 8.496 . 0 0 "[ . 1 . 2]" 1
48 1 11 LYS QE 1 83 PRO QD 4.500 . 8.500 5.095 3.843 6.341 . 0 0 "[ . 1 . 2]" 1
49 1 11 LYS QE 1 83 PRO QG 4.500 . 8.500 3.872 2.236 6.241 . 0 0 "[ . 1 . 2]" 1
50 1 11 LYS QG 1 12 PRO QD 4.500 . 8.500 2.502 1.977 3.175 . 0 0 "[ . 1 . 2]" 1
51 1 11 LYS QG 1 78 MET QB 4.500 . 8.500 4.214 3.068 5.399 . 0 0 "[ . 1 . 2]" 1
52 1 11 LYS QG 1 78 MET ME 4.500 . 9.000 2.793 2.047 3.507 . 0 0 "[ . 1 . 2]" 1
53 1 11 LYS QG 1 78 MET QG 4.500 . 9.000 3.932 2.218 5.536 . 0 0 "[ . 1 . 2]" 1
54 1 11 LYS QG 1 81 TYR QD 4.500 . 9.900 3.484 2.886 4.972 . 0 0 "[ . 1 . 2]" 1
55 1 11 LYS QG 1 81 TYR QE 4.500 . 9.900 3.939 2.817 5.352 . 0 0 "[ . 1 . 2]" 1
56 1 11 LYS QG 1 83 PRO QB 4.500 . 8.500 4.176 3.072 5.143 . 0 0 "[ . 1 . 2]" 1
57 1 11 LYS QG 1 83 PRO QD 4.500 . 8.500 5.136 3.534 6.660 . 0 0 "[ . 1 . 2]" 1
58 1 12 PRO HA 1 13 ARG H 2.500 . 3.400 2.171 2.121 2.494 . 0 0 "[ . 1 . 2]" 1
59 1 12 PRO HA 1 13 ARG QB 4.500 . 7.000 4.440 4.314 4.550 . 0 0 "[ . 1 . 2]" 1
60 1 12 PRO QB 1 13 ARG H 4.500 . 7.000 3.329 2.445 3.492 . 0 0 "[ . 1 . 2]" 1
61 1 12 PRO QB 1 14 GLY H 4.500 . 7.000 3.375 2.193 5.476 . 0 0 "[ . 1 . 2]" 1
62 1 12 PRO QB 1 74 TYR HA 4.500 . 7.000 3.571 2.544 4.949 . 0 0 "[ . 1 . 2]" 1
63 1 12 PRO QB 1 74 TYR QB 4.500 . 8.000 2.678 1.893 4.497 . 0 0 "[ . 1 . 2]" 1
64 1 12 PRO QB 1 74 TYR QD 3.500 . 7.700 3.070 1.945 4.629 . 0 0 "[ . 1 . 2]" 1
65 1 12 PRO QB 1 74 TYR QE 4.500 . 9.400 4.669 2.340 6.277 . 0 0 "[ . 1 . 2]" 1
66 1 12 PRO QB 1 77 GLU H 4.500 . 7.000 5.243 4.422 6.610 . 0 0 "[ . 1 . 2]" 1
67 1 12 PRO QB 1 78 MET H 4.500 . 7.000 4.452 3.190 6.183 . 0 0 "[ . 1 . 2]" 1
68 1 12 PRO QD 1 78 MET HA 4.500 . 7.000 3.022 2.134 4.172 . 0 0 "[ . 1 . 2]" 1
69 1 12 PRO QD 1 78 MET QB 4.500 . 8.000 3.339 2.397 4.800 . 0 0 "[ . 1 . 2]" 1
70 1 12 PRO QD 1 78 MET ME 4.500 . 8.500 3.826 2.149 5.283 . 0 0 "[ . 1 . 2]" 1
71 1 12 PRO QD 1 78 MET QG 4.500 . 8.500 3.933 2.141 5.670 . 0 0 "[ . 1 . 2]" 1
72 1 12 PRO QD 1 81 TYR QB 4.500 . 8.000 3.370 2.685 4.540 . 0 0 "[ . 1 . 2]" 1
73 1 12 PRO QD 1 81 TYR QD 3.500 . 7.700 3.586 2.136 4.581 . 0 0 "[ . 1 . 2]" 1
74 1 12 PRO QD 1 81 TYR QE 4.500 . 9.400 4.486 3.180 5.363 . 0 0 "[ . 1 . 2]" 1
75 1 12 PRO QG 1 13 ARG H 4.500 . 7.000 4.700 4.062 4.906 . 0 0 "[ . 1 . 2]" 1
76 1 12 PRO QG 1 78 MET H 4.500 . 7.000 3.234 2.502 4.738 . 0 0 "[ . 1 . 2]" 1
77 1 12 PRO QG 1 78 MET HA 4.500 . 5.300 3.282 2.353 5.057 . 0 0 "[ . 1 . 2]" 1
78 1 12 PRO QG 1 78 MET QG 4.500 . 8.500 4.210 2.145 6.816 . 0 0 "[ . 1 . 2]" 1
79 1 12 PRO QG 1 79 LYS H 4.500 . 7.000 5.311 4.545 6.852 . 0 0 "[ . 1 . 2]" 1
80 1 12 PRO QG 1 81 TYR H 4.500 . 7.000 5.702 4.371 7.076 0.076 6 0 "[ . 1 . 2]" 1
81 1 12 PRO QG 1 81 TYR QD 4.500 . 9.400 4.980 3.570 6.099 . 0 0 "[ . 1 . 2]" 1
82 1 13 ARG H 1 13 ARG QB 3.500 . 5.300 2.717 2.333 3.214 . 0 0 "[ . 1 . 2]" 1
83 1 13 ARG H 1 13 ARG QD 4.500 . 7.500 3.657 1.592 4.320 . 0 0 "[ . 1 . 2]" 1
84 1 13 ARG H 1 13 ARG QG 4.500 . 7.500 2.282 1.834 3.435 . 0 0 "[ . 1 . 2]" 1
85 1 13 ARG H 1 14 GLY H 4.500 . 6.000 2.320 1.839 2.909 . 0 0 "[ . 1 . 2]" 1
86 1 13 ARG HA 1 13 ARG QD 4.500 . 7.500 3.966 2.014 4.544 . 0 0 "[ . 1 . 2]" 1
87 1 13 ARG QB 1 13 ARG HE 4.500 . 7.000 3.315 1.832 4.083 . 0 0 "[ . 1 . 2]" 1
88 1 13 ARG QB 1 14 GLY H 3.500 . 5.300 3.514 2.412 4.038 . 0 0 "[ . 1 . 2]" 1
89 1 13 ARG QB 1 14 GLY QA 4.500 . 8.000 4.132 3.489 4.430 . 0 0 "[ . 1 . 2]" 1
90 1 13 ARG QD 1 14 GLY H 4.500 . 7.500 4.521 1.988 5.628 . 0 0 "[ . 1 . 2]" 1
91 1 13 ARG QG 1 14 GLY H 4.500 . 7.500 3.109 1.859 4.800 . 0 0 "[ . 1 . 2]" 1
92 1 14 GLY H 1 15 LYS H 4.500 . 6.000 4.140 3.419 4.514 . 0 0 "[ . 1 . 2]" 1
93 1 14 GLY H 1 74 TYR QB 4.500 . 7.000 4.068 2.998 6.582 . 0 0 "[ . 1 . 2]" 1
94 1 14 GLY H 1 74 TYR QD 4.500 . 8.400 4.508 3.179 7.348 . 0 0 "[ . 1 . 2]" 1
95 1 14 GLY H 1 74 TYR QE 4.500 . 8.400 5.500 3.321 8.110 . 0 0 "[ . 1 . 2]" 1
96 1 14 GLY QA 1 15 LYS H 3.500 . 5.300 2.202 2.056 2.494 . 0 0 "[ . 1 . 2]" 1
97 1 14 GLY QA 1 15 LYS QB 4.500 . 8.000 4.155 3.781 4.434 . 0 0 "[ . 1 . 2]" 1
98 1 14 GLY QA 1 15 LYS QE 4.500 . 8.500 5.207 4.351 6.800 . 0 0 "[ . 1 . 2]" 1
99 1 14 GLY QA 1 15 LYS QG 4.500 . 8.500 3.679 3.334 4.966 . 0 0 "[ . 1 . 2]" 1
100 1 14 GLY QA 1 74 TYR QD 4.500 . 9.400 3.729 2.224 7.420 . 0 0 "[ . 1 . 2]" 1
101 1 14 GLY QA 1 74 TYR QE 3.500 . 7.700 4.137 2.564 7.717 0.017 18 0 "[ . 1 . 2]" 1
102 1 15 LYS H 1 15 LYS QB 3.500 . 5.300 2.848 2.358 3.315 . 0 0 "[ . 1 . 2]" 1
103 1 15 LYS H 1 15 LYS QE 4.500 . 7.500 4.135 3.290 5.131 . 0 0 "[ . 1 . 2]" 1
104 1 15 LYS H 1 15 LYS QG 3.500 . 5.800 2.133 1.802 2.980 . 0 0 "[ . 1 . 2]" 1
105 1 15 LYS H 1 16 MET H 4.500 . 6.000 4.285 3.141 4.699 . 0 0 "[ . 1 . 2]" 1
106 1 15 LYS H 1 74 TYR QB 4.500 . 7.000 4.300 2.192 6.447 . 0 0 "[ . 1 . 2]" 1
107 1 15 LYS H 1 74 TYR QD 4.500 . 8.400 4.050 3.025 6.227 . 0 0 "[ . 1 . 2]" 1
108 1 15 LYS H 1 74 TYR QE 4.500 . 8.400 4.385 2.852 6.168 . 0 0 "[ . 1 . 2]" 1
109 1 15 LYS HA 1 15 LYS QB 2.500 . 4.400 2.183 2.157 2.206 . 0 0 "[ . 1 . 2]" 1
110 1 15 LYS HA 1 16 MET HA 4.500 . 6.000 4.406 4.297 4.685 . 0 0 "[ . 1 . 2]" 1
111 1 15 LYS HA 1 16 MET QB 4.500 . 7.000 4.799 4.421 5.157 . 0 0 "[ . 1 . 2]" 1
112 1 15 LYS HA 1 16 MET QG 4.500 . 7.500 3.780 3.371 4.570 . 0 0 "[ . 1 . 2]" 1
113 1 15 LYS HA 1 74 TYR QB 4.500 . 7.000 4.191 3.242 6.202 . 0 0 "[ . 1 . 2]" 1
114 1 15 LYS HA 1 74 TYR QD 4.500 . 8.400 4.515 3.132 5.524 . 0 0 "[ . 1 . 2]" 1
115 1 15 LYS QB 1 16 MET H 3.500 . 5.300 2.192 1.728 3.457 . 0 0 "[ . 1 . 2]" 1
116 1 15 LYS QB 1 16 MET HA 4.500 . 7.000 4.525 4.275 5.130 . 0 0 "[ . 1 . 2]" 1
117 1 15 LYS QB 1 70 ASP QB 4.500 . 8.000 3.759 1.836 6.152 . 0 0 "[ . 1 . 2]" 1
118 1 15 LYS QB 1 73 ARG QD 4.500 . 8.500 2.973 1.850 4.342 . 0 0 "[ . 1 . 2]" 1
119 1 15 LYS QB 1 74 TYR H 4.500 . 7.000 4.448 3.090 5.728 . 0 0 "[ . 1 . 2]" 1
120 1 15 LYS QB 1 74 TYR QB 4.500 . 8.000 3.379 2.140 4.388 . 0 0 "[ . 1 . 2]" 1
121 1 15 LYS QD 1 16 MET H 4.500 . 7.500 3.004 1.707 4.274 . 0 0 "[ . 1 . 2]" 1
122 1 15 LYS QD 1 70 ASP QB 3.500 . 6.800 3.219 1.906 4.350 . 0 0 "[ . 1 . 2]" 1
123 1 15 LYS QD 1 71 LYS HA 3.500 . 5.800 3.607 2.186 4.875 . 0 0 "[ . 1 . 2]" 1
124 1 15 LYS QD 1 71 LYS QB 4.500 . 8.500 3.863 1.834 5.123 . 0 0 "[ . 1 . 2]" 1
125 1 15 LYS QD 1 74 TYR H 4.500 . 7.500 5.829 3.888 7.544 0.044 2 0 "[ . 1 . 2]" 1
126 1 15 LYS QD 1 74 TYR QD 4.500 . 9.900 4.035 2.350 6.061 . 0 0 "[ . 1 . 2]" 1
127 1 15 LYS QE 1 67 ALA MB 4.500 . 9.000 3.309 2.037 4.211 . 0 0 "[ . 1 . 2]" 1
128 1 15 LYS QE 1 70 ASP QB 4.500 . 8.500 3.956 2.044 5.745 . 0 0 "[ . 1 . 2]" 1
129 1 15 LYS QE 1 71 LYS HA 4.500 . 5.800 3.850 2.078 5.832 0.032 8 0 "[ . 1 . 2]" 1
130 1 15 LYS QE 1 71 LYS QB 3.500 . 6.800 3.249 2.218 4.520 . 0 0 "[ . 1 . 2]" 1
131 1 15 LYS QE 1 74 TYR QD 4.500 . 9.900 4.681 3.142 7.054 . 0 0 "[ . 1 . 2]" 1
132 1 15 LYS QE 1 74 TYR QE 4.500 . 9.900 3.685 2.091 7.669 . 0 0 "[ . 1 . 2]" 1
133 1 15 LYS QG 1 16 MET H 4.500 . 7.500 3.325 1.661 4.265 . 0 0 "[ . 1 . 2]" 1
134 1 15 LYS QG 1 70 ASP QB 4.500 . 8.500 4.208 2.737 5.935 . 0 0 "[ . 1 . 2]" 1
135 1 15 LYS QG 1 71 LYS H 4.500 . 7.500 4.743 3.130 7.129 . 0 0 "[ . 1 . 2]" 1
136 1 15 LYS QG 1 71 LYS QB 4.500 . 8.500 3.663 2.079 5.906 . 0 0 "[ . 1 . 2]" 1
137 1 15 LYS QG 1 73 ARG QD 4.500 . 9.000 4.469 2.551 5.572 . 0 0 "[ . 1 . 2]" 1
138 1 15 LYS QG 1 73 ARG QG 4.500 . 9.000 4.774 2.689 7.300 . 0 0 "[ . 1 . 2]" 1
139 1 15 LYS QG 1 74 TYR H 4.500 . 7.500 5.277 4.119 6.896 . 0 0 "[ . 1 . 2]" 1
140 1 15 LYS QG 1 74 TYR HA 4.500 . 7.500 6.573 4.739 7.597 0.097 8 0 "[ . 1 . 2]" 1
141 1 15 LYS QG 1 74 TYR QB 4.500 . 8.500 4.216 2.705 5.267 . 0 0 "[ . 1 . 2]" 1
142 1 15 LYS QG 1 74 TYR QD 4.500 . 9.900 3.213 2.081 5.531 . 0 0 "[ . 1 . 2]" 1
143 1 15 LYS QG 1 74 TYR QE 4.500 . 9.900 3.083 2.035 6.365 . 0 0 "[ . 1 . 2]" 1
144 1 16 MET H 1 16 MET QB 3.500 . 5.300 2.464 2.262 2.614 . 0 0 "[ . 1 . 2]" 1
145 1 16 MET H 1 16 MET ME 4.500 . 7.500 4.416 2.473 5.042 . 0 0 "[ . 1 . 2]" 1
146 1 16 MET H 1 16 MET QG 4.500 . 7.500 2.544 1.958 3.252 . 0 0 "[ . 1 . 2]" 1
147 1 16 MET H 1 17 SER H 4.500 . 6.000 4.506 4.238 4.607 . 0 0 "[ . 1 . 2]" 1
148 1 16 MET H 1 21 PHE QE 4.500 . 8.400 3.779 2.622 5.332 . 0 0 "[ . 1 . 2]" 1
149 1 16 MET H 1 21 PHE HZ 4.500 . 6.500 4.390 3.069 6.546 0.046 18 0 "[ . 1 . 2]" 1
150 1 16 MET H 1 70 ASP QB 4.500 . 7.000 4.704 2.572 7.241 0.241 12 0 "[ . 1 . 2]" 1
151 1 16 MET HA 1 16 MET ME 4.500 . 7.500 4.125 3.907 4.360 . 0 0 "[ . 1 . 2]" 1
152 1 16 MET HA 1 16 MET QG 3.500 . 5.800 2.559 2.433 3.344 . 0 0 "[ . 1 . 2]" 1
153 1 16 MET HA 1 17 SER H 2.500 . 3.400 2.342 2.218 2.451 . 0 0 "[ . 1 . 2]" 1
154 1 16 MET HA 1 17 SER QB 4.500 . 7.000 4.512 4.136 4.662 . 0 0 "[ . 1 . 2]" 1
155 1 16 MET HA 1 20 ALA MB 3.500 . 5.800 3.715 3.218 4.420 . 0 0 "[ . 1 . 2]" 1
156 1 16 MET QB 1 16 MET ME 3.500 . 6.800 2.083 1.963 2.211 . 0 0 "[ . 1 . 2]" 1
157 1 16 MET QB 1 17 SER H 4.500 . 7.000 2.602 2.382 2.950 . 0 0 "[ . 1 . 2]" 1
158 1 16 MET QB 1 17 SER QB 4.500 . 8.000 4.382 3.909 4.697 . 0 0 "[ . 1 . 2]" 1
159 1 16 MET QB 1 20 ALA MB 4.500 . 8.500 2.002 1.736 2.520 . 0 0 "[ . 1 . 2]" 1
160 1 16 MET QB 1 21 PHE QD 4.500 . 9.400 3.633 2.686 4.763 . 0 0 "[ . 1 . 2]" 1
161 1 16 MET QB 1 21 PHE QE 3.500 . 7.700 2.920 1.986 4.432 . 0 0 "[ . 1 . 2]" 1
162 1 16 MET QB 1 21 PHE HZ 4.500 . 7.500 3.972 2.533 6.008 . 0 0 "[ . 1 . 2]" 1
163 1 16 MET QB 1 70 ASP QB 4.500 . 8.000 5.098 3.473 7.213 . 0 0 "[ . 1 . 2]" 1
164 1 16 MET ME 1 20 ALA H 4.500 . 7.500 4.678 4.450 5.263 . 0 0 "[ . 1 . 2]" 1
165 1 16 MET ME 1 20 ALA HA 3.500 . 5.800 3.907 3.364 5.030 . 0 0 "[ . 1 . 2]" 1
166 1 16 MET ME 1 21 PHE H 3.500 . 5.800 3.955 3.083 5.288 . 0 0 "[ . 1 . 2]" 1
167 1 16 MET ME 1 21 PHE HA 3.500 . 5.800 3.897 2.742 5.901 0.101 8 0 "[ . 1 . 2]" 1
168 1 16 MET ME 1 21 PHE QB 4.500 . 8.500 4.999 3.905 6.420 . 0 0 "[ . 1 . 2]" 1
169 1 16 MET ME 1 21 PHE QD 3.500 . 8.200 4.048 2.967 5.300 . 0 0 "[ . 1 . 2]" 1
170 1 16 MET ME 1 21 PHE QE 3.500 . 8.200 4.191 3.484 5.323 . 0 0 "[ . 1 . 2]" 1
171 1 16 MET ME 1 21 PHE HZ 4.500 . 8.000 5.151 4.140 6.240 . 0 0 "[ . 1 . 2]" 1
172 1 16 MET ME 1 23 VAL H 4.500 . 7.500 5.676 4.816 7.305 . 0 0 "[ . 1 . 2]" 1
173 1 16 MET ME 1 24 GLN HA 4.500 . 7.500 5.718 4.688 7.365 . 0 0 "[ . 1 . 2]" 1
174 1 16 MET ME 1 24 GLN QB 3.500 . 6.800 3.705 2.608 5.759 . 0 0 "[ . 1 . 2]" 1
175 1 16 MET ME 1 24 GLN QE 4.500 . 9.000 3.248 2.045 7.478 . 0 0 "[ . 1 . 2]" 1
176 1 16 MET ME 1 24 GLN QG 4.500 . 7.300 4.277 3.259 6.700 . 0 0 "[ . 1 . 2]" 1
177 1 16 MET QG 1 17 SER H 4.500 . 7.500 3.989 3.667 4.146 . 0 0 "[ . 1 . 2]" 1
178 1 16 MET QG 1 20 ALA H 4.500 . 7.500 5.889 4.769 6.488 . 0 0 "[ . 1 . 2]" 1
179 1 16 MET QG 1 20 ALA MB 3.500 . 7.300 3.202 2.487 3.995 . 0 0 "[ . 1 . 2]" 1
180 1 16 MET QG 1 21 PHE H 4.500 . 7.500 5.783 3.866 6.702 . 0 0 "[ . 1 . 2]" 1
181 1 16 MET QG 1 21 PHE QD 4.500 . 9.900 5.318 3.377 6.433 . 0 0 "[ . 1 . 2]" 1
182 1 16 MET QG 1 21 PHE QE 4.500 . 9.900 4.470 2.787 6.252 . 0 0 "[ . 1 . 2]" 1
183 1 16 MET QG 1 21 PHE HZ 4.500 . 8.000 5.206 3.325 7.874 . 0 0 "[ . 1 . 2]" 1
184 1 17 SER H 1 17 SER QB 3.500 . 5.300 2.462 2.230 2.585 . 0 0 "[ . 1 . 2]" 1
185 1 17 SER H 1 20 ALA H 4.500 . 6.000 3.792 3.562 4.355 . 0 0 "[ . 1 . 2]" 1
186 1 17 SER H 1 20 ALA HA 4.500 . 6.000 5.422 4.920 6.220 0.220 11 0 "[ . 1 . 2]" 1
187 1 17 SER H 1 20 ALA MB 3.500 . 5.800 2.782 2.222 3.790 . 0 0 "[ . 1 . 2]" 1
188 1 17 SER H 1 67 ALA MB 4.500 . 7.500 5.734 4.281 7.062 . 0 0 "[ . 1 . 2]" 1
189 1 17 SER HA 1 18 SER H 3.500 . 4.300 2.530 2.260 2.819 . 0 0 "[ . 1 . 2]" 1
190 1 17 SER HA 1 19 TYR H 4.500 . 6.000 4.570 3.867 5.052 . 0 0 "[ . 1 . 2]" 1
191 1 17 SER HA 1 20 ALA MB 4.500 . 7.500 4.434 4.053 4.899 . 0 0 "[ . 1 . 2]" 1
192 1 17 SER HA 1 67 ALA MB 3.500 . 5.800 3.944 2.305 5.270 . 0 0 "[ . 1 . 2]" 1
193 1 17 SER QB 1 18 SER H 4.500 . 7.000 2.425 1.835 3.521 . 0 0 "[ . 1 . 2]" 1
194 1 17 SER QB 1 19 TYR H 4.500 . 7.000 2.931 2.486 3.287 . 0 0 "[ . 1 . 2]" 1
195 1 17 SER QB 1 19 TYR QB 4.500 . 8.000 3.094 2.621 3.565 . 0 0 "[ . 1 . 2]" 1
196 1 17 SER QB 1 19 TYR QD 4.500 . 9.400 4.333 3.603 5.457 . 0 0 "[ . 1 . 2]" 1
197 1 17 SER QB 1 20 ALA H 4.500 . 7.000 3.009 2.406 4.132 . 0 0 "[ . 1 . 2]" 1
198 1 17 SER QB 1 20 ALA MB 4.500 . 8.500 3.408 2.702 4.733 . 0 0 "[ . 1 . 2]" 1
199 1 17 SER QB 1 21 PHE QD 4.500 . 9.400 5.056 4.712 5.766 . 0 0 "[ . 1 . 2]" 1
200 1 18 SER H 1 18 SER QB 3.500 . 5.300 2.576 2.484 2.674 . 0 0 "[ . 1 . 2]" 1
201 1 18 SER H 1 19 TYR H 3.500 . 4.300 2.799 2.635 2.970 . 0 0 "[ . 1 . 2]" 1
202 1 18 SER H 1 20 ALA H 4.500 . 6.000 4.259 3.940 4.657 . 0 0 "[ . 1 . 2]" 1
203 1 18 SER H 1 20 ALA MB 4.500 . 7.500 4.928 4.586 5.320 . 0 0 "[ . 1 . 2]" 1
204 1 18 SER H 1 21 PHE QB 4.500 . 7.000 5.207 4.762 6.076 . 0 0 "[ . 1 . 2]" 1
205 1 18 SER H 1 21 PHE QD 4.500 . 8.400 4.291 3.670 5.148 . 0 0 "[ . 1 . 2]" 1
206 1 18 SER H 1 64 GLU QG 4.500 . 7.500 5.189 4.154 6.695 . 0 0 "[ . 1 . 2]" 1
207 1 18 SER H 1 67 ALA MB 3.500 . 5.800 3.902 2.928 4.957 . 0 0 "[ . 1 . 2]" 1
208 1 18 SER HA 1 19 TYR HA 4.500 . 6.000 4.847 4.742 4.957 . 0 0 "[ . 1 . 2]" 1
209 1 18 SER HA 1 20 ALA H 4.500 . 6.000 4.223 3.799 4.572 . 0 0 "[ . 1 . 2]" 1
210 1 18 SER HA 1 21 PHE H 4.500 . 6.000 3.344 3.052 3.623 . 0 0 "[ . 1 . 2]" 1
211 1 18 SER HA 1 21 PHE QB 4.500 . 7.000 2.754 2.333 3.573 . 0 0 "[ . 1 . 2]" 1
212 1 18 SER HA 1 21 PHE QD 3.500 . 6.700 2.439 1.902 3.788 . 0 0 "[ . 1 . 2]" 1
213 1 18 SER HA 1 22 PHE H 4.500 . 6.000 4.438 4.053 4.968 . 0 0 "[ . 1 . 2]" 1
214 1 18 SER HA 1 52 TRP HZ2 4.500 . 6.500 5.747 4.977 6.543 0.043 17 0 "[ . 1 . 2]" 1
215 1 18 SER HA 1 64 GLU QG 4.500 . 7.500 4.913 4.011 6.065 . 0 0 "[ . 1 . 2]" 1
216 1 18 SER HA 1 67 ALA MB 3.500 . 5.800 3.114 2.108 4.145 . 0 0 "[ . 1 . 2]" 1
217 1 18 SER QB 1 19 TYR H 4.500 . 7.000 2.686 2.283 3.460 . 0 0 "[ . 1 . 2]" 1
218 1 18 SER QB 1 19 TYR QB 4.500 . 8.000 4.111 3.826 4.785 . 0 0 "[ . 1 . 2]" 1
219 1 18 SER QB 1 52 TRP HH2 3.500 . 5.800 2.257 1.838 2.743 . 0 0 "[ . 1 . 2]" 1
220 1 18 SER QB 1 52 TRP HZ2 4.500 . 7.500 3.032 2.172 4.051 . 0 0 "[ . 1 . 2]" 1
221 1 18 SER QB 1 63 PHE QB 4.500 . 8.000 2.526 1.930 3.288 . 0 0 "[ . 1 . 2]" 1
222 1 18 SER QB 1 64 GLU HA 3.500 . 5.300 3.233 2.237 4.425 . 0 0 "[ . 1 . 2]" 1
223 1 18 SER QB 1 64 GLU QB 4.500 . 8.000 4.361 3.644 5.324 . 0 0 "[ . 1 . 2]" 1
224 1 18 SER QB 1 64 GLU QG 3.500 . 6.800 2.919 2.063 4.104 . 0 0 "[ . 1 . 2]" 1
225 1 18 SER QB 1 67 ALA H 4.500 . 7.000 5.368 4.290 6.473 . 0 0 "[ . 1 . 2]" 1
226 1 18 SER QB 1 67 ALA MB 3.500 . 6.800 3.840 2.582 5.044 . 0 0 "[ . 1 . 2]" 1
227 1 19 TYR H 1 19 TYR QB 3.500 . 5.300 2.214 2.113 2.279 . 0 0 "[ . 1 . 2]" 1
228 1 19 TYR H 1 19 TYR QD 4.500 . 8.400 4.165 4.053 4.225 . 0 0 "[ . 1 . 2]" 1
229 1 19 TYR H 1 20 ALA HA 4.500 . 6.000 5.353 5.104 5.549 . 0 0 "[ . 1 . 2]" 1
230 1 19 TYR H 1 20 ALA MB 4.500 . 7.500 4.433 4.221 4.622 . 0 0 "[ . 1 . 2]" 1
231 1 19 TYR H 1 21 PHE H 4.500 . 6.000 4.362 4.259 4.529 . 0 0 "[ . 1 . 2]" 1
232 1 19 TYR H 1 21 PHE QB 4.500 . 7.000 5.115 4.889 5.525 . 0 0 "[ . 1 . 2]" 1
233 1 19 TYR H 1 52 TRP HE1 4.500 . 6.500 5.220 4.103 6.186 . 0 0 "[ . 1 . 2]" 1
234 1 19 TYR H 1 52 TRP HH2 4.500 . 6.500 4.319 3.643 5.356 . 0 0 "[ . 1 . 2]" 1
235 1 19 TYR H 1 52 TRP HZ2 4.500 . 6.500 3.965 3.298 4.793 . 0 0 "[ . 1 . 2]" 1
236 1 19 TYR H 1 64 GLU QG 4.500 . 7.500 6.036 5.075 7.443 . 0 0 "[ . 1 . 2]" 1
237 1 19 TYR HA 1 19 TYR QD 3.500 . 6.700 2.680 2.343 2.964 . 0 0 "[ . 1 . 2]" 1
238 1 19 TYR HA 1 19 TYR QE 4.500 . 8.400 4.687 4.511 4.824 . 0 0 "[ . 1 . 2]" 1
239 1 19 TYR HA 1 20 ALA HA 4.500 . 6.000 4.789 4.751 4.836 . 0 0 "[ . 1 . 2]" 1
240 1 19 TYR HA 1 20 ALA MB 4.500 . 7.500 5.014 4.960 5.054 . 0 0 "[ . 1 . 2]" 1
241 1 19 TYR HA 1 22 PHE H 4.500 . 6.000 3.405 3.197 3.638 . 0 0 "[ . 1 . 2]" 1
242 1 19 TYR HA 1 22 PHE QB 4.500 . 7.000 2.642 2.292 3.074 . 0 0 "[ . 1 . 2]" 1
243 1 19 TYR HA 1 22 PHE QD 4.500 . 8.400 4.004 3.537 4.547 . 0 0 "[ . 1 . 2]" 1
244 1 19 TYR HA 1 23 VAL H 4.500 . 6.000 4.269 3.979 4.546 . 0 0 "[ . 1 . 2]" 1
245 1 19 TYR HA 1 23 VAL MG2 4.500 . 7.500 3.974 3.634 4.287 . 0 0 "[ . 1 . 2]" 1
246 1 19 TYR HA 1 52 TRP QB 4.500 . 7.000 4.423 3.872 4.941 . 0 0 "[ . 1 . 2]" 1
247 1 19 TYR HA 1 52 TRP HE1 4.500 . 6.500 4.744 4.229 5.812 . 0 0 "[ . 1 . 2]" 1
248 1 19 TYR HA 1 52 TRP HH2 4.500 . 6.500 4.135 3.641 4.647 . 0 0 "[ . 1 . 2]" 1
249 1 19 TYR HA 1 52 TRP HZ2 4.500 . 6.500 4.169 3.671 4.657 . 0 0 "[ . 1 . 2]" 1
250 1 19 TYR HA 1 52 TRP HZ3 4.500 . 6.500 4.046 2.815 4.799 . 0 0 "[ . 1 . 2]" 1
251 1 19 TYR HA 1 63 PHE QB 4.500 . 7.000 4.878 4.325 5.613 . 0 0 "[ . 1 . 2]" 1
252 1 19 TYR QB 1 20 ALA H 4.500 . 5.300 2.626 2.262 3.019 . 0 0 "[ . 1 . 2]" 1
253 1 19 TYR QB 1 20 ALA HA 4.500 . 7.000 4.258 4.090 4.415 . 0 0 "[ . 1 . 2]" 1
254 1 19 TYR QB 1 20 ALA MB 4.500 . 8.500 3.940 3.748 4.204 . 0 0 "[ . 1 . 2]" 1
255 1 19 TYR QB 1 52 TRP HD1 4.500 . 7.500 4.502 3.370 5.561 . 0 0 "[ . 1 . 2]" 1
256 1 19 TYR QB 1 52 TRP HE1 4.500 . 7.500 3.565 2.784 4.513 . 0 0 "[ . 1 . 2]" 1
257 1 19 TYR QB 1 52 TRP HZ2 4.500 . 7.500 3.831 3.248 4.629 . 0 0 "[ . 1 . 2]" 1
258 1 19 TYR QD 1 20 ALA H 4.500 . 8.400 3.512 2.762 4.197 . 0 0 "[ . 1 . 2]" 1
259 1 19 TYR QD 1 20 ALA HA 4.500 . 8.400 3.678 3.021 4.294 . 0 0 "[ . 1 . 2]" 1
260 1 19 TYR QD 1 20 ALA MB 4.500 . 9.900 3.788 3.046 4.498 . 0 0 "[ . 1 . 2]" 1
261 1 19 TYR QD 1 22 PHE H 4.500 . 8.400 5.128 4.622 5.484 . 0 0 "[ . 1 . 2]" 1
262 1 19 TYR QD 1 22 PHE QB 4.500 . 9.400 3.678 2.795 4.603 . 0 0 "[ . 1 . 2]" 1
263 1 19 TYR QD 1 22 PHE QD 3.500 . 9.100 3.501 2.702 5.033 . 0 0 "[ . 1 . 2]" 1
264 1 19 TYR QD 1 23 VAL H 4.500 . 8.400 4.781 4.491 5.130 . 0 0 "[ . 1 . 2]" 1
265 1 19 TYR QD 1 23 VAL HB 4.500 . 8.400 5.181 4.274 5.704 . 0 0 "[ . 1 . 2]" 1
266 1 19 TYR QD 1 23 VAL MG1 4.500 . 9.900 5.226 4.653 5.610 . 0 0 "[ . 1 . 2]" 1
267 1 19 TYR QD 1 23 VAL MG2 4.500 . 9.900 3.234 3.080 3.454 . 0 0 "[ . 1 . 2]" 1
268 1 19 TYR QD 1 49 SER HA 4.500 . 8.400 4.015 3.166 4.960 . 0 0 "[ . 1 . 2]" 1
269 1 19 TYR QD 1 49 SER QB 4.500 . 9.400 4.674 3.915 6.085 . 0 0 "[ . 1 . 2]" 1
270 1 19 TYR QD 1 52 TRP H 4.500 . 8.400 5.541 4.762 6.759 . 0 0 "[ . 1 . 2]" 1
271 1 19 TYR QD 1 52 TRP HA 4.500 . 8.400 5.272 4.588 6.441 . 0 0 "[ . 1 . 2]" 1
272 1 19 TYR QD 1 52 TRP QB 4.500 . 9.400 2.994 2.299 4.101 . 0 0 "[ . 1 . 2]" 1
273 1 19 TYR QD 1 52 TRP HD1 4.500 . 8.900 3.504 2.539 4.706 . 0 0 "[ . 1 . 2]" 1
274 1 19 TYR QD 1 52 TRP HE1 4.500 . 8.900 3.978 2.953 5.195 . 0 0 "[ . 1 . 2]" 1
275 1 19 TYR QD 1 52 TRP HE3 4.500 . 8.900 4.275 3.017 5.569 . 0 0 "[ . 1 . 2]" 1
276 1 19 TYR QD 1 52 TRP HZ2 4.500 . 8.900 4.978 4.397 5.724 . 0 0 "[ . 1 . 2]" 1
277 1 19 TYR QE 1 20 ALA HA 4.500 . 8.400 4.666 4.031 5.217 . 0 0 "[ . 1 . 2]" 1
278 1 19 TYR QE 1 20 ALA MB 4.500 . 9.900 5.096 4.398 5.719 . 0 0 "[ . 1 . 2]" 1
279 1 19 TYR QE 1 22 PHE QE 4.500 . 10.800 4.454 3.219 6.098 . 0 0 "[ . 1 . 2]" 1
280 1 19 TYR QE 1 22 PHE HZ 4.500 . 8.900 6.787 5.582 8.213 . 0 0 "[ . 1 . 2]" 1
281 1 19 TYR QE 1 23 VAL HA 4.500 . 8.400 5.490 4.608 6.186 . 0 0 "[ . 1 . 2]" 1
282 1 19 TYR QE 1 23 VAL HB 4.500 . 8.400 5.104 4.378 5.796 . 0 0 "[ . 1 . 2]" 1
283 1 19 TYR QE 1 23 VAL MG1 4.500 . 9.900 4.407 3.889 5.045 . 0 0 "[ . 1 . 2]" 1
284 1 19 TYR QE 1 23 VAL MG2 3.500 . 8.200 2.828 2.632 3.219 . 0 0 "[ . 1 . 2]" 1
285 1 19 TYR QE 1 48 CYS HB2 4.500 . 8.400 4.810 2.743 6.944 . 0 0 "[ . 1 . 2]" 1
286 1 19 TYR QE 1 49 SER H 4.500 . 8.400 3.860 2.709 5.026 . 0 0 "[ . 1 . 2]" 1
287 1 19 TYR QE 1 49 SER HA 4.500 . 8.400 2.282 1.843 3.298 . 0 0 "[ . 1 . 2]" 1
288 1 19 TYR QE 1 49 SER QB 3.500 . 7.700 2.872 1.955 4.336 . 0 0 "[ . 1 . 2]" 1
289 1 19 TYR QE 1 52 TRP H 4.500 . 8.400 4.818 3.880 5.850 . 0 0 "[ . 1 . 2]" 1
290 1 19 TYR QE 1 52 TRP QB 4.500 . 7.700 3.021 2.314 3.592 . 0 0 "[ . 1 . 2]" 1
291 1 19 TYR QE 1 52 TRP HD1 4.500 . 8.900 4.234 3.161 5.558 . 0 0 "[ . 1 . 2]" 1
292 1 19 TYR QE 1 52 TRP HE1 4.500 . 8.900 5.672 4.709 6.766 . 0 0 "[ . 1 . 2]" 1
293 1 19 TYR QE 1 53 LYS H 4.500 . 8.400 5.633 5.131 6.034 . 0 0 "[ . 1 . 2]" 1
294 1 20 ALA H 1 21 PHE H 3.500 . 4.300 2.731 2.643 2.846 . 0 0 "[ . 1 . 2]" 1
295 1 20 ALA H 1 21 PHE HA 4.500 . 6.000 5.305 5.208 5.408 . 0 0 "[ . 1 . 2]" 1
296 1 20 ALA H 1 21 PHE QB 4.500 . 7.000 4.605 4.412 4.844 . 0 0 "[ . 1 . 2]" 1
297 1 20 ALA H 1 21 PHE QD 4.500 . 8.400 4.296 3.597 5.122 . 0 0 "[ . 1 . 2]" 1
298 1 20 ALA H 1 23 VAL H 4.500 . 6.000 4.668 4.487 4.763 . 0 0 "[ . 1 . 2]" 1
299 1 20 ALA H 1 23 VAL HB 4.500 . 6.000 5.335 4.995 5.654 . 0 0 "[ . 1 . 2]" 1
300 1 20 ALA H 1 23 VAL MG2 4.500 . 7.500 4.291 4.048 4.520 . 0 0 "[ . 1 . 2]" 1
301 1 20 ALA HA 1 23 VAL H 3.500 . 4.300 3.240 3.010 3.556 . 0 0 "[ . 1 . 2]" 1
302 1 20 ALA HA 1 23 VAL HA 4.500 . 6.000 5.238 4.804 5.670 . 0 0 "[ . 1 . 2]" 1
303 1 20 ALA HA 1 23 VAL HB 3.500 . 4.300 2.737 2.335 3.102 . 0 0 "[ . 1 . 2]" 1
304 1 20 ALA HA 1 23 VAL MG1 4.500 . 7.500 4.095 3.673 4.452 . 0 0 "[ . 1 . 2]" 1
305 1 20 ALA HA 1 23 VAL MG2 3.500 . 5.800 2.739 2.322 3.350 . 0 0 "[ . 1 . 2]" 1
306 1 20 ALA HA 1 24 GLN H 4.500 . 6.000 4.438 4.085 4.865 . 0 0 "[ . 1 . 2]" 1
307 1 20 ALA HA 1 24 GLN QB 4.500 . 7.000 5.231 4.361 5.799 . 0 0 "[ . 1 . 2]" 1
308 1 20 ALA MB 1 21 PHE H 3.500 . 5.800 2.450 2.307 2.609 . 0 0 "[ . 1 . 2]" 1
309 1 20 ALA MB 1 21 PHE HA 4.500 . 7.500 3.862 3.794 3.901 . 0 0 "[ . 1 . 2]" 1
310 1 20 ALA MB 1 21 PHE QB 4.500 . 8.500 4.253 4.073 4.399 . 0 0 "[ . 1 . 2]" 1
311 1 20 ALA MB 1 21 PHE QD 4.500 . 9.900 3.431 2.940 4.058 . 0 0 "[ . 1 . 2]" 1
312 1 20 ALA MB 1 22 PHE H 4.500 . 7.500 4.335 4.180 4.469 . 0 0 "[ . 1 . 2]" 1
313 1 20 ALA MB 1 23 VAL H 4.500 . 7.500 4.459 4.274 4.724 . 0 0 "[ . 1 . 2]" 1
314 1 20 ALA MB 1 23 VAL HB 4.500 . 7.500 3.992 3.528 4.447 . 0 0 "[ . 1 . 2]" 1
315 1 20 ALA MB 1 23 VAL MG1 4.500 . 9.000 4.768 4.213 5.217 . 0 0 "[ . 1 . 2]" 1
316 1 20 ALA MB 1 23 VAL MG2 4.500 . 9.000 4.003 3.598 4.497 . 0 0 "[ . 1 . 2]" 1
317 1 20 ALA MB 1 24 GLN H 4.500 . 7.500 4.824 4.517 5.201 . 0 0 "[ . 1 . 2]" 1
318 1 20 ALA MB 1 24 GLN QB 3.500 . 6.800 4.608 3.782 5.208 . 0 0 "[ . 1 . 2]" 1
319 1 21 PHE H 1 21 PHE QB 3.500 . 5.300 2.365 2.178 2.513 . 0 0 "[ . 1 . 2]" 1
320 1 21 PHE H 1 21 PHE QD 3.500 . 6.700 2.471 1.842 3.209 . 0 0 "[ . 1 . 2]" 1
321 1 21 PHE H 1 22 PHE QB 4.500 . 7.000 4.492 4.301 4.669 . 0 0 "[ . 1 . 2]" 1
322 1 21 PHE H 1 23 VAL H 4.500 . 6.000 4.228 4.108 4.343 . 0 0 "[ . 1 . 2]" 1
323 1 21 PHE H 1 23 VAL MG2 4.500 . 7.500 4.973 4.671 5.207 . 0 0 "[ . 1 . 2]" 1
324 1 21 PHE H 1 24 GLN QG 4.500 . 7.500 4.414 4.115 4.926 . 0 0 "[ . 1 . 2]" 1
325 1 21 PHE H 1 67 ALA MB 4.500 . 7.500 5.105 3.933 6.440 . 0 0 "[ . 1 . 2]" 1
326 1 21 PHE HA 1 21 PHE QD 3.500 . 6.700 2.775 2.079 3.079 . 0 0 "[ . 1 . 2]" 1
327 1 21 PHE HA 1 21 PHE QE 4.500 . 8.400 4.498 4.353 4.602 . 0 0 "[ . 1 . 2]" 1
328 1 21 PHE HA 1 23 VAL H 4.500 . 6.000 4.425 4.246 4.633 . 0 0 "[ . 1 . 2]" 1
329 1 21 PHE HA 1 24 GLN H 4.500 . 6.000 3.473 3.306 3.662 . 0 0 "[ . 1 . 2]" 1
330 1 21 PHE HA 1 24 GLN QB 4.500 . 7.000 3.694 3.336 4.147 . 0 0 "[ . 1 . 2]" 1
331 1 21 PHE HA 1 24 GLN QE 4.500 . 7.500 3.484 2.513 4.353 . 0 0 "[ . 1 . 2]" 1
332 1 21 PHE HA 1 24 GLN QG 4.500 . 7.500 2.060 1.916 2.642 . 0 0 "[ . 1 . 2]" 1
333 1 21 PHE HA 1 63 PHE QD 4.500 . 8.400 4.486 4.146 5.132 . 0 0 "[ . 1 . 2]" 1
334 1 21 PHE QB 1 22 PHE H 4.500 . 7.000 2.831 2.677 3.036 . 0 0 "[ . 1 . 2]" 1
335 1 21 PHE QB 1 22 PHE HA 4.500 . 7.000 3.967 3.904 4.082 . 0 0 "[ . 1 . 2]" 1
336 1 21 PHE QB 1 23 VAL H 4.500 . 7.000 4.838 4.663 5.001 . 0 0 "[ . 1 . 2]" 1
337 1 21 PHE QB 1 62 LYS QE 4.500 . 8.500 6.580 5.496 8.602 0.102 3 0 "[ . 1 . 2]" 1
338 1 21 PHE QB 1 63 PHE H 4.500 . 7.000 5.484 4.782 6.494 . 0 0 "[ . 1 . 2]" 1
339 1 21 PHE QB 1 63 PHE HA 4.500 . 7.000 3.453 2.794 4.459 . 0 0 "[ . 1 . 2]" 1
340 1 21 PHE QB 1 63 PHE QD 3.500 . 7.700 2.322 1.907 3.005 . 0 0 "[ . 1 . 2]" 1
341 1 21 PHE QB 1 66 MET QB 4.500 . 8.000 3.720 2.981 4.489 . 0 0 "[ . 1 . 2]" 1
342 1 21 PHE QB 1 66 MET ME 4.500 . 8.500 2.571 2.083 3.838 . 0 0 "[ . 1 . 2]" 1
343 1 21 PHE QB 1 67 ALA H 4.500 . 7.000 4.954 3.855 5.792 . 0 0 "[ . 1 . 2]" 1
344 1 21 PHE QB 1 67 ALA MB 4.500 . 8.500 4.053 2.892 5.062 . 0 0 "[ . 1 . 2]" 1
345 1 21 PHE QD 1 24 GLN QB 4.500 . 9.400 5.135 4.600 5.702 . 0 0 "[ . 1 . 2]" 1
346 1 21 PHE QD 1 24 GLN QE 4.500 . 9.900 3.758 1.939 4.835 . 0 0 "[ . 1 . 2]" 1
347 1 21 PHE QD 1 63 PHE QB 4.500 . 9.400 4.011 2.951 5.176 . 0 0 "[ . 1 . 2]" 1
348 1 21 PHE QD 1 64 GLU HA 4.500 . 8.400 5.576 4.727 6.792 . 0 0 "[ . 1 . 2]" 1
349 1 21 PHE QD 1 66 MET QB 4.500 . 9.400 3.398 2.410 4.302 . 0 0 "[ . 1 . 2]" 1
350 1 21 PHE QD 1 66 MET ME 3.500 . 8.200 3.030 2.283 4.297 . 0 0 "[ . 1 . 2]" 1
351 1 21 PHE QD 1 66 MET QG 4.500 . 9.900 5.097 4.173 6.211 . 0 0 "[ . 1 . 2]" 1
352 1 21 PHE QD 1 67 ALA MB 4.500 . 9.900 3.112 2.399 3.921 . 0 0 "[ . 1 . 2]" 1
353 1 21 PHE QE 1 67 ALA H 4.500 . 8.400 4.542 3.697 5.749 . 0 0 "[ . 1 . 2]" 1
354 1 21 PHE QE 1 67 ALA HA 3.500 . 6.700 2.830 2.052 3.837 . 0 0 "[ . 1 . 2]" 1
355 1 21 PHE QE 1 67 ALA MB 3.500 . 8.200 2.809 2.117 3.697 . 0 0 "[ . 1 . 2]" 1
356 1 21 PHE QE 1 70 ASP H 4.500 . 8.400 4.873 4.191 5.707 . 0 0 "[ . 1 . 2]" 1
357 1 21 PHE QE 1 70 ASP QB 3.500 . 7.700 2.830 2.204 3.380 . 0 0 "[ . 1 . 2]" 1
358 1 21 PHE HZ 1 66 MET QB 4.500 . 7.500 4.836 3.661 6.513 . 0 0 "[ . 1 . 2]" 1
359 1 21 PHE HZ 1 67 ALA HA 4.500 . 6.500 3.159 2.125 4.192 . 0 0 "[ . 1 . 2]" 1
360 1 21 PHE HZ 1 67 ALA MB 4.500 . 8.000 4.038 3.068 4.828 . 0 0 "[ . 1 . 2]" 1
361 1 21 PHE HZ 1 70 ASP H 4.500 . 6.500 4.628 3.767 5.960 . 0 0 "[ . 1 . 2]" 1
362 1 21 PHE HZ 1 70 ASP QB 3.500 . 5.800 2.290 1.852 3.437 . 0 0 "[ . 1 . 2]" 1
363 1 21 PHE HZ 1 71 LYS QB 4.500 . 7.500 6.770 5.495 7.684 0.184 4 0 "[ . 1 . 2]" 1
364 1 22 PHE H 1 22 PHE QB 3.500 . 5.300 2.263 2.204 2.308 . 0 0 "[ . 1 . 2]" 1
365 1 22 PHE H 1 22 PHE QD 4.500 . 8.400 4.181 4.149 4.212 . 0 0 "[ . 1 . 2]" 1
366 1 22 PHE H 1 23 VAL H 3.500 . 4.300 2.522 2.342 2.653 . 0 0 "[ . 1 . 2]" 1
367 1 22 PHE H 1 23 VAL HB 4.500 . 6.000 4.737 4.456 4.906 . 0 0 "[ . 1 . 2]" 1
368 1 22 PHE H 1 23 VAL MG2 4.500 . 7.500 3.915 3.694 4.066 . 0 0 "[ . 1 . 2]" 1
369 1 22 PHE H 1 24 GLN H 4.500 . 6.000 3.926 3.786 4.160 . 0 0 "[ . 1 . 2]" 1
370 1 22 PHE H 1 25 THR H 4.500 . 6.000 4.759 4.599 5.134 . 0 0 "[ . 1 . 2]" 1
371 1 22 PHE H 1 52 TRP HZ3 4.500 . 6.500 4.632 4.122 5.006 . 0 0 "[ . 1 . 2]" 1
372 1 22 PHE H 1 63 PHE QB 4.500 . 7.000 3.936 3.362 4.704 . 0 0 "[ . 1 . 2]" 1
373 1 22 PHE H 1 63 PHE QD 4.500 . 8.400 3.827 3.395 4.257 . 0 0 "[ . 1 . 2]" 1
374 1 22 PHE H 1 66 MET ME 4.500 . 7.500 5.306 4.896 6.047 . 0 0 "[ . 1 . 2]" 1
375 1 22 PHE HA 1 22 PHE QD 3.500 . 6.700 2.462 2.258 2.666 . 0 0 "[ . 1 . 2]" 1
376 1 22 PHE HA 1 23 VAL HA 4.500 . 6.000 4.800 4.721 4.865 . 0 0 "[ . 1 . 2]" 1
377 1 22 PHE HA 1 24 GLN H 4.500 . 6.000 4.018 3.683 4.265 . 0 0 "[ . 1 . 2]" 1
378 1 22 PHE HA 1 25 THR H 4.500 . 6.000 3.405 3.100 3.667 . 0 0 "[ . 1 . 2]" 1
379 1 22 PHE HA 1 25 THR HB 3.500 . 4.300 2.813 2.320 3.542 . 0 0 "[ . 1 . 2]" 1
380 1 22 PHE HA 1 25 THR MG 4.500 . 7.500 4.218 3.821 4.871 . 0 0 "[ . 1 . 2]" 1
381 1 22 PHE HA 1 63 PHE QD 3.500 . 6.700 3.291 2.689 3.966 . 0 0 "[ . 1 . 2]" 1
382 1 22 PHE HA 1 63 PHE QE 4.500 . 8.400 2.561 2.111 3.048 . 0 0 "[ . 1 . 2]" 1
383 1 22 PHE HA 1 63 PHE HZ 4.500 . 6.500 3.640 3.094 4.307 . 0 0 "[ . 1 . 2]" 1
384 1 22 PHE QB 1 23 VAL H 3.500 . 5.300 2.588 2.447 2.722 . 0 0 "[ . 1 . 2]" 1
385 1 22 PHE QB 1 23 VAL HA 4.500 . 7.000 4.207 4.138 4.274 . 0 0 "[ . 1 . 2]" 1
386 1 22 PHE QB 1 23 VAL MG2 4.500 . 8.500 3.204 2.983 3.510 . 0 0 "[ . 1 . 2]" 1
387 1 22 PHE QB 1 52 TRP HE3 4.500 . 7.500 2.648 2.312 2.933 . 0 0 "[ . 1 . 2]" 1
388 1 22 PHE QB 1 52 TRP HH2 4.500 . 7.500 4.261 3.932 4.732 . 0 0 "[ . 1 . 2]" 1
389 1 22 PHE QB 1 52 TRP HZ3 4.500 . 7.500 2.565 2.164 2.893 . 0 0 "[ . 1 . 2]" 1
390 1 22 PHE QB 1 55 MET ME 4.500 . 8.500 3.434 2.822 3.990 . 0 0 "[ . 1 . 2]" 1
391 1 22 PHE QB 1 60 LYS QG 4.500 . 8.500 5.180 4.694 5.764 . 0 0 "[ . 1 . 2]" 1
392 1 22 PHE QB 1 63 PHE QD 4.500 . 9.400 3.449 3.177 3.671 . 0 0 "[ . 1 . 2]" 1
393 1 22 PHE QD 1 23 VAL H 4.500 . 8.400 3.673 3.357 4.045 . 0 0 "[ . 1 . 2]" 1
394 1 22 PHE QD 1 23 VAL HA 4.500 . 8.400 3.883 3.457 4.292 . 0 0 "[ . 1 . 2]" 1
395 1 22 PHE QD 1 23 VAL HB 4.500 . 8.400 5.414 4.949 5.885 . 0 0 "[ . 1 . 2]" 1
396 1 22 PHE QD 1 23 VAL MG1 4.500 . 9.900 5.095 4.597 5.717 . 0 0 "[ . 1 . 2]" 1
397 1 22 PHE QD 1 23 VAL MG2 3.500 . 8.200 3.175 2.668 3.921 . 0 0 "[ . 1 . 2]" 1
398 1 22 PHE QD 1 25 THR H 4.500 . 8.400 5.073 4.658 5.404 . 0 0 "[ . 1 . 2]" 1
399 1 22 PHE QD 1 25 THR HB 4.500 . 8.400 3.667 2.783 4.396 . 0 0 "[ . 1 . 2]" 1
400 1 22 PHE QD 1 25 THR MG 4.500 . 9.900 4.328 3.426 4.959 . 0 0 "[ . 1 . 2]" 1
401 1 22 PHE QD 1 48 CYS HB2 4.500 . 8.400 4.424 3.536 6.364 . 0 0 "[ . 1 . 2]" 1
402 1 22 PHE QD 1 49 SER HA 4.500 . 8.400 4.152 3.672 5.053 . 0 0 "[ . 1 . 2]" 1
403 1 22 PHE QD 1 51 ARG QB 4.500 . 9.400 4.852 4.563 5.202 . 0 0 "[ . 1 . 2]" 1
404 1 22 PHE QD 1 52 TRP HA 4.500 . 8.400 4.214 3.804 4.506 . 0 0 "[ . 1 . 2]" 1
405 1 22 PHE QD 1 52 TRP QB 4.500 . 9.400 2.507 1.992 2.764 . 0 0 "[ . 1 . 2]" 1
406 1 22 PHE QD 1 55 MET ME 4.500 . 9.900 2.855 2.596 3.365 . 0 0 "[ . 1 . 2]" 1
407 1 22 PHE QD 1 62 LYS QD 4.500 . 9.900 6.491 5.348 8.579 . 0 0 "[ . 1 . 2]" 1
408 1 22 PHE QD 1 63 PHE QB 4.500 . 9.400 4.886 4.184 5.743 . 0 0 "[ . 1 . 2]" 1
409 1 22 PHE QD 1 63 PHE QE 3.500 . 9.100 2.796 2.296 3.098 . 0 0 "[ . 1 . 2]" 1
410 1 22 PHE QD 1 63 PHE HZ 4.500 . 8.900 2.442 1.984 3.185 . 0 0 "[ . 1 . 2]" 1
411 1 22 PHE QE 1 23 VAL HA 4.500 . 8.400 4.863 4.481 5.363 . 0 0 "[ . 1 . 2]" 1
412 1 22 PHE QE 1 23 VAL MG1 4.500 . 9.900 5.867 5.286 6.638 . 0 0 "[ . 1 . 2]" 1
413 1 22 PHE QE 1 23 VAL MG2 4.500 . 9.900 4.511 3.853 5.327 . 0 0 "[ . 1 . 2]" 1
414 1 22 PHE QE 1 26 CYS HB2 4.500 . 8.400 3.705 2.969 4.764 . 0 0 "[ . 1 . 2]" 1
415 1 22 PHE QE 1 48 CYS HA 4.500 . 8.400 3.182 2.486 4.254 . 0 0 "[ . 1 . 2]" 1
416 1 22 PHE QE 1 48 CYS HB2 4.500 . 8.400 3.928 3.337 5.187 . 0 0 "[ . 1 . 2]" 1
417 1 22 PHE QE 1 49 SER H 4.500 . 8.400 4.406 3.564 4.956 . 0 0 "[ . 1 . 2]" 1
418 1 22 PHE QE 1 51 ARG QB 4.500 . 9.400 2.789 2.351 3.356 . 0 0 "[ . 1 . 2]" 1
419 1 22 PHE QE 1 51 ARG QG 4.500 . 9.900 3.463 2.976 4.062 . 0 0 "[ . 1 . 2]" 1
420 1 22 PHE QE 1 52 TRP H 4.500 . 8.400 2.765 2.341 3.372 . 0 0 "[ . 1 . 2]" 1
421 1 22 PHE QE 1 52 TRP HA 4.500 . 8.400 3.694 3.312 4.036 . 0 0 "[ . 1 . 2]" 1
422 1 22 PHE QE 1 52 TRP QB 4.500 . 9.400 2.665 2.328 3.221 . 0 0 "[ . 1 . 2]" 1
423 1 22 PHE QE 1 55 MET QB 4.500 . 9.400 5.113 4.801 5.470 . 0 0 "[ . 1 . 2]" 1
424 1 22 PHE QE 1 55 MET ME 3.500 . 8.200 3.017 2.617 3.492 . 0 0 "[ . 1 . 2]" 1
425 1 22 PHE QE 1 55 MET QG 4.500 . 9.900 4.167 3.738 4.688 . 0 0 "[ . 1 . 2]" 1
426 1 22 PHE HZ 1 26 CYS HB2 4.500 . 6.500 3.938 2.939 4.810 . 0 0 "[ . 1 . 2]" 1
427 1 22 PHE HZ 1 48 CYS HA 4.500 . 6.500 4.014 3.196 4.813 . 0 0 "[ . 1 . 2]" 1
428 1 22 PHE HZ 1 51 ARG H 4.500 . 6.500 4.630 4.021 5.812 . 0 0 "[ . 1 . 2]" 1
429 1 22 PHE HZ 1 51 ARG QB 3.500 . 5.800 2.392 1.958 3.327 . 0 0 "[ . 1 . 2]" 1
430 1 22 PHE HZ 1 51 ARG QD 4.500 . 8.000 2.030 1.847 2.265 . 0 0 "[ . 1 . 2]" 1
431 1 22 PHE HZ 1 51 ARG QG 4.500 . 8.000 2.591 2.071 3.542 . 0 0 "[ . 1 . 2]" 1
432 1 22 PHE HZ 1 52 TRP H 4.500 . 6.500 3.856 3.004 5.117 . 0 0 "[ . 1 . 2]" 1
433 1 23 VAL H 1 23 VAL HB 3.500 . 4.300 2.548 2.439 2.647 . 0 0 "[ . 1 . 2]" 1
434 1 23 VAL H 1 23 VAL MG1 4.500 . 7.500 3.774 3.754 3.794 . 0 0 "[ . 1 . 2]" 1
435 1 23 VAL H 1 23 VAL MG2 3.500 . 5.800 2.073 1.916 2.209 . 0 0 "[ . 1 . 2]" 1
436 1 23 VAL H 1 24 GLN H 3.500 . 4.300 2.684 2.587 2.779 . 0 0 "[ . 1 . 2]" 1
437 1 23 VAL H 1 24 GLN HA 4.500 . 6.000 5.256 5.138 5.362 . 0 0 "[ . 1 . 2]" 1
438 1 23 VAL H 1 25 THR H 4.500 . 6.000 4.131 4.001 4.359 . 0 0 "[ . 1 . 2]" 1
439 1 23 VAL HA 1 23 VAL MG1 3.500 . 5.800 2.426 2.358 2.523 . 0 0 "[ . 1 . 2]" 1
440 1 23 VAL HA 1 23 VAL MG2 3.500 . 5.800 2.377 2.315 2.435 . 0 0 "[ . 1 . 2]" 1
441 1 23 VAL HA 1 25 THR H 4.500 . 6.000 4.331 3.916 4.798 . 0 0 "[ . 1 . 2]" 1
442 1 23 VAL HA 1 26 CYS HA 4.500 . 6.000 5.519 5.108 5.973 . 0 0 "[ . 1 . 2]" 1
443 1 23 VAL HA 1 48 CYS HB2 4.500 . 6.000 3.768 2.994 4.871 . 0 0 "[ . 1 . 2]" 1
444 1 23 VAL HB 1 24 GLN H 3.500 . 4.300 3.017 2.720 3.396 . 0 0 "[ . 1 . 2]" 1
445 1 23 VAL HB 1 24 GLN HA 4.500 . 6.000 4.377 4.193 4.509 . 0 0 "[ . 1 . 2]" 1
446 1 23 VAL HB 1 24 GLN QG 4.500 . 7.500 4.607 3.880 5.072 . 0 0 "[ . 1 . 2]" 1
447 1 23 VAL HB 1 41 PHE QE 4.500 . 8.400 3.935 2.457 5.401 . 0 0 "[ . 1 . 2]" 1
448 1 23 VAL MG1 1 24 GLN H 4.500 . 7.500 3.709 3.389 4.029 . 0 0 "[ . 1 . 2]" 1
449 1 23 VAL MG1 1 24 GLN HA 4.500 . 7.500 3.497 3.239 3.781 . 0 0 "[ . 1 . 2]" 1
450 1 23 VAL MG1 1 24 GLN QB 4.500 . 8.500 4.211 3.790 4.660 . 0 0 "[ . 1 . 2]" 1
451 1 23 VAL MG1 1 24 GLN QG 4.500 . 9.000 5.018 4.420 5.338 . 0 0 "[ . 1 . 2]" 1
452 1 23 VAL MG1 1 25 THR H 4.500 . 7.500 5.045 4.726 5.511 . 0 0 "[ . 1 . 2]" 1
453 1 23 VAL MG1 1 27 ARG H 4.500 . 7.500 4.318 3.578 5.251 . 0 0 "[ . 1 . 2]" 1
454 1 23 VAL MG1 1 27 ARG QB 4.500 . 8.500 3.755 2.519 5.263 . 0 0 "[ . 1 . 2]" 1
455 1 23 VAL MG1 1 27 ARG QD 3.500 . 7.300 3.115 2.078 4.523 . 0 0 "[ . 1 . 2]" 1
456 1 23 VAL MG1 1 27 ARG QG 4.500 . 9.000 3.868 2.410 5.088 . 0 0 "[ . 1 . 2]" 1
457 1 23 VAL MG1 1 41 PHE QD 4.500 . 9.900 3.632 2.864 4.563 . 0 0 "[ . 1 . 2]" 1
458 1 23 VAL MG1 1 41 PHE QE 3.500 . 8.200 2.775 2.333 3.164 . 0 0 "[ . 1 . 2]" 1
459 1 23 VAL MG1 1 41 PHE HZ 4.500 . 8.000 3.030 2.157 4.062 . 0 0 "[ . 1 . 2]" 1
460 1 23 VAL MG1 1 44 PHE QD 4.500 . 9.900 4.418 3.325 5.867 . 0 0 "[ . 1 . 2]" 1
461 1 23 VAL MG1 1 45 SER HA 4.500 . 7.500 2.853 2.026 4.504 . 0 0 "[ . 1 . 2]" 1
462 1 23 VAL MG1 1 45 SER QB 4.500 . 8.500 3.194 2.012 5.127 . 0 0 "[ . 1 . 2]" 1
463 1 23 VAL MG1 1 46 LYS H 4.500 . 7.500 5.677 4.547 7.429 . 0 0 "[ . 1 . 2]" 1
464 1 23 VAL MG1 1 48 CYS HA 4.500 . 7.500 6.005 4.870 7.068 . 0 0 "[ . 1 . 2]" 1
465 1 23 VAL MG1 1 48 CYS HB2 4.500 . 7.500 3.724 2.304 5.092 . 0 0 "[ . 1 . 2]" 1
466 1 23 VAL MG2 1 24 GLN H 4.500 . 7.500 3.983 3.865 4.055 . 0 0 "[ . 1 . 2]" 1
467 1 23 VAL MG2 1 24 GLN HA 4.500 . 7.500 5.403 5.339 5.461 . 0 0 "[ . 1 . 2]" 1
468 1 23 VAL MG2 1 27 ARG QB 4.500 . 8.500 5.769 4.631 7.084 . 0 0 "[ . 1 . 2]" 1
469 1 23 VAL MG2 1 45 SER HA 4.500 . 7.500 3.462 1.996 4.906 . 0 0 "[ . 1 . 2]" 1
470 1 23 VAL MG2 1 48 CYS HB2 4.500 . 7.500 3.364 2.124 5.327 . 0 0 "[ . 1 . 2]" 1
471 1 23 VAL MG2 1 49 SER H 4.500 . 7.500 4.410 3.550 5.427 . 0 0 "[ . 1 . 2]" 1
472 1 23 VAL MG2 1 49 SER HA 4.500 . 7.500 4.525 3.753 5.524 . 0 0 "[ . 1 . 2]" 1
473 1 23 VAL MG2 1 49 SER QB 4.500 . 8.500 4.679 3.592 5.956 . 0 0 "[ . 1 . 2]" 1
474 1 23 VAL MG2 1 52 TRP QB 4.500 . 8.500 4.570 3.658 5.296 . 0 0 "[ . 1 . 2]" 1
475 1 24 GLN H 1 24 GLN QB 3.500 . 5.300 2.682 2.478 2.930 . 0 0 "[ . 1 . 2]" 1
476 1 24 GLN H 1 24 GLN QG 3.500 . 5.800 2.153 1.904 2.327 . 0 0 "[ . 1 . 2]" 1
477 1 24 GLN H 1 25 THR H 3.500 . 4.300 2.274 2.139 2.522 . 0 0 "[ . 1 . 2]" 1
478 1 24 GLN H 1 25 THR HA 4.500 . 6.000 4.957 4.825 5.167 . 0 0 "[ . 1 . 2]" 1
479 1 24 GLN H 1 25 THR HB 4.500 . 6.000 4.550 4.381 4.836 . 0 0 "[ . 1 . 2]" 1
480 1 24 GLN H 1 25 THR MG 4.500 . 7.500 5.601 5.467 5.812 . 0 0 "[ . 1 . 2]" 1
481 1 24 GLN HA 1 24 GLN QB 2.500 . 4.400 2.182 2.173 2.189 . 0 0 "[ . 1 . 2]" 1
482 1 24 GLN HA 1 24 GLN QE 4.500 . 7.500 4.326 4.006 5.510 . 0 0 "[ . 1 . 2]" 1
483 1 24 GLN HA 1 24 GLN QG 3.500 . 5.800 3.347 3.332 3.363 . 0 0 "[ . 1 . 2]" 1
484 1 24 GLN HA 1 25 THR HA 4.500 . 6.000 4.708 4.601 4.797 . 0 0 "[ . 1 . 2]" 1
485 1 24 GLN HA 1 27 ARG H 4.500 . 6.000 3.689 3.135 4.245 . 0 0 "[ . 1 . 2]" 1
486 1 24 GLN HA 1 27 ARG QB 3.500 . 5.300 2.942 2.341 3.750 . 0 0 "[ . 1 . 2]" 1
487 1 24 GLN HA 1 27 ARG QD 3.500 . 5.800 3.658 2.247 5.490 . 0 0 "[ . 1 . 2]" 1
488 1 24 GLN HA 1 28 GLU H 4.500 . 6.000 4.329 3.845 5.146 . 0 0 "[ . 1 . 2]" 1
489 1 24 GLN QB 1 25 THR H 4.500 . 7.000 3.531 3.380 3.679 . 0 0 "[ . 1 . 2]" 1
490 1 24 GLN QB 1 27 ARG QD 4.500 . 8.500 4.935 3.456 6.665 . 0 0 "[ . 1 . 2]" 1
491 1 24 GLN QB 1 41 PHE QE 4.500 . 9.400 3.978 2.203 6.575 . 0 0 "[ . 1 . 2]" 1
492 1 24 GLN QG 1 25 THR H 4.500 . 7.500 2.354 2.025 2.674 . 0 0 "[ . 1 . 2]" 1
493 1 24 GLN QG 1 25 THR HA 3.500 . 5.800 3.439 3.242 3.676 . 0 0 "[ . 1 . 2]" 1
494 1 24 GLN QG 1 25 THR HB 4.500 . 7.500 4.092 3.780 4.280 . 0 0 "[ . 1 . 2]" 1
495 1 24 GLN QG 1 25 THR MG 4.500 . 9.000 4.363 4.090 4.488 . 0 0 "[ . 1 . 2]" 1
496 1 24 GLN QG 1 63 PHE QE 4.500 . 9.900 4.696 4.046 5.181 . 0 0 "[ . 1 . 2]" 1
497 1 25 THR H 1 25 THR HB 3.500 . 4.300 2.558 2.511 2.662 . 0 0 "[ . 1 . 2]" 1
498 1 25 THR H 1 25 THR MG 4.500 . 7.500 3.770 3.749 3.795 . 0 0 "[ . 1 . 2]" 1
499 1 25 THR H 1 26 CYS HB2 4.500 . 6.000 5.064 4.305 6.197 0.197 10 0 "[ . 1 . 2]" 1
500 1 25 THR H 1 27 ARG H 4.500 . 6.000 3.960 3.568 4.373 . 0 0 "[ . 1 . 2]" 1
501 1 25 THR H 1 27 ARG QB 4.500 . 7.000 4.846 4.100 5.457 . 0 0 "[ . 1 . 2]" 1
502 1 25 THR H 1 28 GLU H 4.500 . 6.000 4.752 4.433 5.136 . 0 0 "[ . 1 . 2]" 1
503 1 25 THR HA 1 25 THR MG 3.500 . 5.800 2.363 2.305 2.394 . 0 0 "[ . 1 . 2]" 1
504 1 25 THR HA 1 27 ARG H 4.500 . 6.000 4.253 3.771 4.574 . 0 0 "[ . 1 . 2]" 1
505 1 25 THR HA 1 28 GLU H 3.500 . 4.300 3.437 3.222 3.821 . 0 0 "[ . 1 . 2]" 1
506 1 25 THR HA 1 28 GLU QB 3.500 . 5.300 3.071 2.375 4.252 . 0 0 "[ . 1 . 2]" 1
507 1 25 THR HA 1 28 GLU QG 4.500 . 7.500 3.476 1.958 5.080 . 0 0 "[ . 1 . 2]" 1
508 1 25 THR HA 1 63 PHE QE 4.500 . 8.400 5.032 4.570 5.906 . 0 0 "[ . 1 . 2]" 1
509 1 25 THR HB 1 28 GLU QB 4.500 . 7.000 5.589 4.862 6.921 . 0 0 "[ . 1 . 2]" 1
510 1 25 THR HB 1 63 PHE QE 3.500 . 6.700 2.623 1.844 3.311 . 0 0 "[ . 1 . 2]" 1
511 1 25 THR HB 1 63 PHE HZ 4.500 . 6.500 3.586 2.868 4.113 . 0 0 "[ . 1 . 2]" 1
512 1 25 THR HB 1 66 MET ME 4.500 . 7.500 4.949 4.138 5.802 . 0 0 "[ . 1 . 2]" 1
513 1 25 THR MG 1 27 ARG H 4.500 . 7.500 4.992 4.439 5.423 . 0 0 "[ . 1 . 2]" 1
514 1 25 THR MG 1 28 GLU QB 4.500 . 8.500 3.956 3.078 5.213 . 0 0 "[ . 1 . 2]" 1
515 1 25 THR MG 1 28 GLU QG 4.500 . 7.300 3.913 2.909 5.159 . 0 0 "[ . 1 . 2]" 1
516 1 25 THR MG 1 29 GLU QG 4.500 . 9.000 2.855 2.267 3.976 . 0 0 "[ . 1 . 2]" 1
517 1 25 THR MG 1 62 LYS QE 4.500 . 9.000 4.642 2.884 6.743 . 0 0 "[ . 1 . 2]" 1
518 1 25 THR MG 1 63 PHE QD 4.500 . 9.900 4.718 3.660 5.532 . 0 0 "[ . 1 . 2]" 1
519 1 25 THR MG 1 63 PHE QE 3.500 . 8.200 2.865 1.970 3.778 . 0 0 "[ . 1 . 2]" 1
520 1 25 THR MG 1 63 PHE HZ 3.500 . 6.300 3.223 2.528 4.279 . 0 0 "[ . 1 . 2]" 1
521 1 25 THR MG 1 66 MET ME 4.500 . 9.000 4.150 3.106 4.837 . 0 0 "[ . 1 . 2]" 1
522 1 26 CYS HB2 1 27 ARG H 4.500 . 6.000 3.902 3.612 4.171 . 0 0 "[ . 1 . 2]" 1
523 1 27 ARG H 1 27 ARG QB 3.500 . 5.300 2.226 2.072 2.512 . 0 0 "[ . 1 . 2]" 1
524 1 27 ARG H 1 27 ARG QD 4.500 . 7.500 3.404 2.377 4.714 . 0 0 "[ . 1 . 2]" 1
525 1 27 ARG H 1 27 ARG QG 4.500 . 7.500 3.526 2.332 4.047 . 0 0 "[ . 1 . 2]" 1
526 1 27 ARG H 1 28 GLU H 3.500 . 4.300 2.607 2.267 2.834 . 0 0 "[ . 1 . 2]" 1
527 1 27 ARG H 1 28 GLU QB 4.500 . 7.000 4.518 4.111 5.113 . 0 0 "[ . 1 . 2]" 1
528 1 27 ARG H 1 29 GLU H 4.500 . 6.000 4.374 3.794 5.372 . 0 0 "[ . 1 . 2]" 1
529 1 27 ARG H 1 41 PHE QD 4.500 . 8.400 6.518 5.225 7.623 . 0 0 "[ . 1 . 2]" 1
530 1 27 ARG HA 1 27 ARG QD 4.500 . 7.500 3.225 2.011 4.241 . 0 0 "[ . 1 . 2]" 1
531 1 27 ARG HA 1 27 ARG QG 3.500 . 5.800 2.501 2.199 3.121 . 0 0 "[ . 1 . 2]" 1
532 1 27 ARG HA 1 30 HIS H 4.500 . 6.000 3.729 3.138 4.041 . 0 0 "[ . 1 . 2]" 1
533 1 27 ARG HA 1 30 HIS QB 4.500 . 7.000 3.081 2.583 3.545 . 0 0 "[ . 1 . 2]" 1
534 1 27 ARG HA 1 30 HIS HD2 4.500 . 6.500 5.645 4.835 6.401 . 0 0 "[ . 1 . 2]" 1
535 1 27 ARG HA 1 39 VAL MG2 4.500 . 7.500 4.576 2.995 6.438 . 0 0 "[ . 1 . 2]" 1
536 1 27 ARG HA 1 44 PHE QD 4.500 . 8.400 3.369 2.104 4.574 . 0 0 "[ . 1 . 2]" 1
537 1 27 ARG HA 1 44 PHE QE 3.500 . 6.700 3.035 2.100 5.459 . 0 0 "[ . 1 . 2]" 1
538 1 27 ARG HA 1 44 PHE HZ 4.500 . 6.500 4.682 2.990 6.849 0.349 13 0 "[ . 1 . 2]" 1
539 1 27 ARG QB 1 28 GLU H 3.500 . 5.300 2.628 2.106 3.424 . 0 0 "[ . 1 . 2]" 1
540 1 27 ARG QB 1 30 HIS H 4.500 . 7.000 5.053 4.717 5.320 . 0 0 "[ . 1 . 2]" 1
541 1 27 ARG QB 1 44 PHE QD 4.500 . 9.400 3.828 2.346 5.833 . 0 0 "[ . 1 . 2]" 1
542 1 27 ARG QB 1 44 PHE QE 4.500 . 9.400 4.377 2.326 6.763 . 0 0 "[ . 1 . 2]" 1
543 1 27 ARG QD 1 28 GLU H 4.500 . 7.500 4.440 2.165 5.260 . 0 0 "[ . 1 . 2]" 1
544 1 27 ARG QD 1 41 PHE QD 4.500 . 9.900 3.550 2.217 5.503 . 0 0 "[ . 1 . 2]" 1
545 1 27 ARG QD 1 41 PHE HZ 4.500 . 8.000 5.771 3.942 7.291 . 0 0 "[ . 1 . 2]" 1
546 1 27 ARG QD 1 45 SER QB 4.500 . 8.500 5.747 3.784 7.487 . 0 0 "[ . 1 . 2]" 1
547 1 27 ARG QG 1 28 GLU H 4.500 . 7.500 4.138 3.148 4.761 . 0 0 "[ . 1 . 2]" 1
548 1 27 ARG QG 1 30 HIS HD2 4.500 . 8.000 6.051 4.591 7.722 . 0 0 "[ . 1 . 2]" 1
549 1 27 ARG QG 1 44 PHE QB 4.500 . 8.500 3.434 1.965 5.454 . 0 0 "[ . 1 . 2]" 1
550 1 27 ARG QG 1 44 PHE QD 4.500 . 9.900 3.167 1.860 5.244 . 0 0 "[ . 1 . 2]" 1
551 1 27 ARG QG 1 44 PHE QE 4.500 . 9.900 4.094 2.506 5.929 . 0 0 "[ . 1 . 2]" 1
552 1 28 GLU H 1 28 GLU QB 3.500 . 5.300 2.356 2.186 2.640 . 0 0 "[ . 1 . 2]" 1
553 1 28 GLU H 1 28 GLU QG 4.500 . 5.800 3.266 2.002 4.052 . 0 0 "[ . 1 . 2]" 1
554 1 28 GLU QB 1 32 LYS H 4.500 . 7.000 5.038 4.356 5.891 . 0 0 "[ . 1 . 2]" 1
555 1 28 GLU QG 1 29 GLU H 4.500 . 5.800 2.870 1.679 3.711 . 0 0 "[ . 1 . 2]" 1
556 1 28 GLU QG 1 29 GLU HA 4.500 . 7.500 3.432 3.133 3.793 . 0 0 "[ . 1 . 2]" 1
557 1 28 GLU QG 1 30 HIS H 4.500 . 7.500 4.865 4.221 5.359 . 0 0 "[ . 1 . 2]" 1
558 1 28 GLU QG 1 32 LYS H 4.500 . 7.500 4.625 3.834 5.767 . 0 0 "[ . 1 . 2]" 1
559 1 28 GLU QG 1 32 LYS QB 4.500 . 8.500 4.538 2.994 5.794 . 0 0 "[ . 1 . 2]" 1
560 1 28 GLU QG 1 32 LYS QG 4.500 . 9.000 3.566 2.058 5.549 . 0 0 "[ . 1 . 2]" 1
561 1 29 GLU H 1 29 GLU QB 3.500 . 5.300 2.441 2.031 2.619 . 0 0 "[ . 1 . 2]" 1
562 1 29 GLU H 1 29 GLU QG 3.500 . 5.800 2.168 1.779 3.300 . 0 0 "[ . 1 . 2]" 1
563 1 29 GLU H 1 30 HIS H 3.500 . 4.300 2.754 2.617 2.972 . 0 0 "[ . 1 . 2]" 1
564 1 29 GLU H 1 30 HIS QB 4.500 . 7.000 4.539 4.400 4.754 . 0 0 "[ . 1 . 2]" 1
565 1 29 GLU HA 1 29 GLU QG 3.500 . 5.800 2.606 2.309 2.963 . 0 0 "[ . 1 . 2]" 1
566 1 29 GLU QB 1 30 HIS H 4.500 . 5.300 2.529 2.317 2.813 . 0 0 "[ . 1 . 2]" 1
567 1 29 GLU QB 1 30 HIS QB 4.500 . 8.000 3.749 3.512 4.100 . 0 0 "[ . 1 . 2]" 1
568 1 29 GLU QB 1 32 LYS QB 4.500 . 8.000 4.368 3.496 4.962 . 0 0 "[ . 1 . 2]" 1
569 1 29 GLU QG 1 30 HIS H 4.500 . 7.500 4.035 3.679 4.586 . 0 0 "[ . 1 . 2]" 1
570 1 30 HIS H 1 30 HIS QB 3.500 . 5.300 2.259 2.204 2.307 . 0 0 "[ . 1 . 2]" 1
571 1 30 HIS H 1 30 HIS HD2 4.500 . 6.500 5.205 5.020 5.327 . 0 0 "[ . 1 . 2]" 1
572 1 30 HIS H 1 44 PHE QE 4.500 . 8.400 4.665 3.532 6.133 . 0 0 "[ . 1 . 2]" 1
573 1 30 HIS HA 1 30 HIS HD2 4.500 . 6.500 4.097 3.829 4.351 . 0 0 "[ . 1 . 2]" 1
574 1 30 HIS HA 1 32 LYS H 4.500 . 6.000 4.329 3.937 4.569 . 0 0 "[ . 1 . 2]" 1
575 1 30 HIS HA 1 33 LYS H 4.500 . 6.000 3.579 3.250 3.994 . 0 0 "[ . 1 . 2]" 1
576 1 30 HIS HA 1 33 LYS QB 4.500 . 7.000 3.107 2.646 4.744 . 0 0 "[ . 1 . 2]" 1
577 1 30 HIS HA 1 33 LYS QG 4.500 . 7.500 3.690 2.668 5.476 . 0 0 "[ . 1 . 2]" 1
578 1 30 HIS HA 1 34 HIS H 4.500 . 6.000 4.111 3.756 4.408 . 0 0 "[ . 1 . 2]" 1
579 1 30 HIS HA 1 34 HIS HD2 3.500 . 4.800 4.197 3.120 4.732 . 0 0 "[ . 1 . 2]" 1
580 1 30 HIS QB 1 30 HIS HD2 3.500 . 5.800 2.794 2.707 2.865 . 0 0 "[ . 1 . 2]" 1
581 1 30 HIS QB 1 31 LYS H 3.500 . 5.300 2.724 2.515 2.913 . 0 0 "[ . 1 . 2]" 1
582 1 30 HIS QB 1 31 LYS HA 4.500 . 7.000 4.114 4.002 4.220 . 0 0 "[ . 1 . 2]" 1
583 1 30 HIS QB 1 44 PHE QD 4.500 . 9.400 4.394 3.864 4.820 . 0 0 "[ . 1 . 2]" 1
584 1 30 HIS QB 1 44 PHE QE 4.500 . 9.400 2.973 2.029 3.637 . 0 0 "[ . 1 . 2]" 1
585 1 30 HIS QB 1 44 PHE HZ 4.500 . 7.500 2.830 1.894 5.048 . 0 0 "[ . 1 . 2]" 1
586 1 30 HIS HD2 1 31 LYS H 4.500 . 6.500 4.317 4.051 4.622 . 0 0 "[ . 1 . 2]" 1
587 1 30 HIS HD2 1 31 LYS HA 4.500 . 6.500 3.682 3.372 4.044 . 0 0 "[ . 1 . 2]" 1
588 1 30 HIS HD2 1 31 LYS QB 4.500 . 7.500 4.962 3.978 5.713 . 0 0 "[ . 1 . 2]" 1
589 1 30 HIS HD2 1 37 ALA H 4.500 . 6.500 5.479 4.030 6.407 . 0 0 "[ . 1 . 2]" 1
590 1 30 HIS HD2 1 37 ALA MB 4.500 . 8.000 3.521 2.049 5.016 . 0 0 "[ . 1 . 2]" 1
591 1 30 HIS HD2 1 39 VAL MG1 4.500 . 8.000 3.751 2.323 5.657 . 0 0 "[ . 1 . 2]" 1
592 1 30 HIS HD2 1 39 VAL MG2 4.500 . 8.000 3.507 2.147 4.985 . 0 0 "[ . 1 . 2]" 1
593 1 30 HIS HD2 1 44 PHE QE 4.500 . 8.900 4.248 3.003 5.115 . 0 0 "[ . 1 . 2]" 1
594 1 30 HIS HD2 1 44 PHE HZ 4.500 . 7.000 4.293 2.515 5.428 . 0 0 "[ . 1 . 2]" 1
595 1 30 HIS HE1 1 37 ALA MB 4.500 . 8.000 5.881 3.911 7.373 . 0 0 "[ . 1 . 2]" 1
596 1 30 HIS HE1 1 39 VAL MG1 4.500 . 8.000 5.080 3.580 6.744 . 0 0 "[ . 1 . 2]" 1
597 1 30 HIS HE1 1 39 VAL MG2 4.500 . 8.000 5.817 4.113 8.129 0.129 4 0 "[ . 1 . 2]" 1
598 1 31 LYS H 1 31 LYS QB 3.500 . 5.300 2.297 2.083 2.511 . 0 0 "[ . 1 . 2]" 1
599 1 31 LYS H 1 31 LYS QG 4.500 . 7.500 3.137 2.162 4.064 . 0 0 "[ . 1 . 2]" 1
600 1 31 LYS H 1 44 PHE QE 4.500 . 8.400 5.617 4.324 6.484 . 0 0 "[ . 1 . 2]" 1
601 1 31 LYS HA 1 34 HIS QB 4.500 . 7.000 3.808 3.402 4.208 . 0 0 "[ . 1 . 2]" 1
602 1 31 LYS HA 1 34 HIS HD2 4.500 . 6.500 6.078 5.389 6.549 0.049 12 0 "[ . 1 . 2]" 1
603 1 31 LYS HA 1 35 PRO HA 4.500 . 6.000 3.612 2.663 5.012 . 0 0 "[ . 1 . 2]" 1
604 1 31 LYS HA 1 39 VAL MG2 4.500 . 7.500 4.848 2.086 6.406 . 0 0 "[ . 1 . 2]" 1
605 1 31 LYS QB 1 32 LYS H 4.500 . 7.000 2.657 2.447 2.959 . 0 0 "[ . 1 . 2]" 1
606 1 31 LYS QB 1 35 PRO QD 4.500 . 8.000 5.933 5.018 6.691 . 0 0 "[ . 1 . 2]" 1
607 1 31 LYS QB 1 37 ALA MB 4.500 . 8.500 5.147 2.830 7.628 . 0 0 "[ . 1 . 2]" 1
608 1 31 LYS QD 1 35 PRO HA 4.500 . 7.500 3.916 1.966 5.429 . 0 0 "[ . 1 . 2]" 1
609 1 31 LYS QE 1 35 PRO HA 4.500 . 7.500 4.183 2.227 6.391 . 0 0 "[ . 1 . 2]" 1
610 1 31 LYS QE 1 35 PRO QG 4.500 . 8.500 6.324 4.081 8.633 0.133 2 0 "[ . 1 . 2]" 1
611 1 31 LYS QE 1 39 VAL H 4.500 . 7.500 4.789 2.980 7.564 0.064 16 0 "[ . 1 . 2]" 1
612 1 31 LYS QE 1 39 VAL MG1 4.500 . 9.000 5.704 3.811 8.441 . 0 0 "[ . 1 . 2]" 1
613 1 31 LYS QG 1 35 PRO HA 4.500 . 7.500 4.077 2.711 5.753 . 0 0 "[ . 1 . 2]" 1
614 1 32 LYS H 1 32 LYS QE 4.500 . 7.500 4.491 2.697 5.862 . 0 0 "[ . 1 . 2]" 1
615 1 32 LYS H 1 32 LYS QG 3.500 . 5.800 2.447 1.966 3.954 . 0 0 "[ . 1 . 2]" 1
616 1 32 LYS H 1 33 LYS QD 4.500 . 7.500 5.530 5.169 5.905 . 0 0 "[ . 1 . 2]" 1
617 1 32 LYS HA 1 32 LYS QE 3.500 . 5.800 3.713 1.849 4.738 . 0 0 "[ . 1 . 2]" 1
618 1 32 LYS HA 1 32 LYS QG 3.500 . 5.800 2.590 2.299 3.124 . 0 0 "[ . 1 . 2]" 1
619 1 32 LYS HA 1 35 PRO QD 4.500 . 7.000 4.800 4.196 5.715 . 0 0 "[ . 1 . 2]" 1
620 1 32 LYS QB 1 32 LYS QE 3.500 . 6.800 2.515 1.901 3.694 . 0 0 "[ . 1 . 2]" 1
621 1 32 LYS QB 1 33 LYS H 3.500 . 5.300 2.679 2.201 3.404 . 0 0 "[ . 1 . 2]" 1
622 1 32 LYS QB 1 33 LYS QG 4.500 . 8.500 3.079 2.662 3.546 . 0 0 "[ . 1 . 2]" 1
623 1 32 LYS QB 1 34 HIS H 4.500 . 7.000 4.580 4.249 5.057 . 0 0 "[ . 1 . 2]" 1
624 1 32 LYS QB 1 34 HIS HD2 4.500 . 7.500 6.794 6.096 7.162 . 0 0 "[ . 1 . 2]" 1
625 1 32 LYS QE 1 33 LYS H 4.500 . 7.500 5.321 4.314 7.048 . 0 0 "[ . 1 . 2]" 1
626 1 33 LYS H 1 33 LYS QB 3.500 . 5.300 2.485 2.403 2.694 . 0 0 "[ . 1 . 2]" 1
627 1 33 LYS H 1 33 LYS QE 4.500 . 7.500 4.588 3.296 5.199 . 0 0 "[ . 1 . 2]" 1
628 1 33 LYS H 1 33 LYS QG 4.500 . 7.500 2.429 1.807 2.911 . 0 0 "[ . 1 . 2]" 1
629 1 33 LYS H 1 34 HIS H 3.500 . 4.300 2.344 1.867 2.678 . 0 0 "[ . 1 . 2]" 1
630 1 33 LYS H 1 34 HIS HA 4.500 . 6.000 5.015 4.540 5.283 . 0 0 "[ . 1 . 2]" 1
631 1 33 LYS H 1 34 HIS QB 4.500 . 7.000 4.575 4.219 4.911 . 0 0 "[ . 1 . 2]" 1
632 1 33 LYS H 1 34 HIS HD2 4.500 . 6.500 4.672 4.156 4.973 . 0 0 "[ . 1 . 2]" 1
633 1 33 LYS H 1 35 PRO QD 4.500 . 7.000 4.772 4.236 5.146 . 0 0 "[ . 1 . 2]" 1
634 1 33 LYS HA 1 33 LYS QE 4.500 . 7.500 3.621 2.101 4.461 . 0 0 "[ . 1 . 2]" 1
635 1 33 LYS HA 1 33 LYS QG 3.500 . 5.800 2.873 2.456 3.138 . 0 0 "[ . 1 . 2]" 1
636 1 33 LYS HA 1 34 HIS HA 4.500 . 6.000 4.514 4.384 4.602 . 0 0 "[ . 1 . 2]" 1
637 1 33 LYS HA 1 34 HIS HD2 4.500 . 6.500 4.732 4.147 5.213 . 0 0 "[ . 1 . 2]" 1
638 1 33 LYS HA 1 35 PRO QD 4.500 . 7.000 4.068 3.359 4.453 . 0 0 "[ . 1 . 2]" 1
639 1 33 LYS QB 1 34 HIS H 4.500 . 5.300 2.884 2.554 3.430 . 0 0 "[ . 1 . 2]" 1
640 1 33 LYS QB 1 34 HIS HD2 4.500 . 5.800 2.475 2.229 2.857 . 0 0 "[ . 1 . 2]" 1
641 1 33 LYS QG 1 34 HIS H 4.500 . 7.500 4.161 3.783 4.601 . 0 0 "[ . 1 . 2]" 1
642 1 33 LYS QG 1 34 HIS HD2 4.500 . 8.000 4.313 3.915 4.875 . 0 0 "[ . 1 . 2]" 1
643 1 34 HIS H 1 34 HIS HD2 4.500 . 6.500 3.665 3.346 4.097 . 0 0 "[ . 1 . 2]" 1
644 1 34 HIS H 1 35 PRO HA 4.500 . 6.000 4.451 4.270 4.606 . 0 0 "[ . 1 . 2]" 1
645 1 34 HIS H 1 35 PRO QD 4.500 . 7.000 3.330 2.703 3.687 . 0 0 "[ . 1 . 2]" 1
646 1 34 HIS H 1 35 PRO QG 4.500 . 7.000 4.785 4.014 5.502 . 0 0 "[ . 1 . 2]" 1
647 1 34 HIS H 1 36 ASP H 4.500 . 6.000 5.367 5.184 5.911 . 0 0 "[ . 1 . 2]" 1
648 1 34 HIS HA 1 34 HIS HD2 4.500 . 6.500 4.055 3.545 4.398 . 0 0 "[ . 1 . 2]" 1
649 1 34 HIS HA 1 35 PRO QD 3.500 . 5.300 2.010 1.894 2.284 . 0 0 "[ . 1 . 2]" 1
650 1 34 HIS HA 1 35 PRO QG 4.500 . 7.000 3.907 3.781 4.196 . 0 0 "[ . 1 . 2]" 1
651 1 34 HIS HA 1 36 ASP H 4.500 . 6.000 3.481 3.236 4.070 . 0 0 "[ . 1 . 2]" 1
652 1 34 HIS HA 1 37 ALA H 4.500 . 6.000 4.578 4.032 5.277 . 0 0 "[ . 1 . 2]" 1
653 1 34 HIS HA 1 37 ALA MB 4.500 . 7.500 4.942 3.442 6.708 . 0 0 "[ . 1 . 2]" 1
654 1 34 HIS QB 1 34 HIS HD2 3.500 . 5.800 2.775 2.671 2.938 . 0 0 "[ . 1 . 2]" 1
655 1 34 HIS QB 1 35 PRO QD 4.500 . 8.000 3.654 3.478 3.838 . 0 0 "[ . 1 . 2]" 1
656 1 34 HIS QB 1 36 ASP H 4.500 . 7.000 3.584 3.156 4.372 . 0 0 "[ . 1 . 2]" 1
657 1 34 HIS QB 1 37 ALA H 4.500 . 7.000 3.289 2.480 3.855 . 0 0 "[ . 1 . 2]" 1
658 1 34 HIS QB 1 37 ALA MB 3.500 . 6.800 3.028 1.868 5.189 . 0 0 "[ . 1 . 2]" 1
659 1 35 PRO HA 1 36 ASP H 3.500 . 4.300 3.514 3.435 3.620 . 0 0 "[ . 1 . 2]" 1
660 1 35 PRO HA 1 37 ALA H 4.500 . 6.000 3.960 3.349 4.703 . 0 0 "[ . 1 . 2]" 1
661 1 35 PRO QB 1 36 ASP H 4.500 . 7.000 3.225 2.886 3.664 . 0 0 "[ . 1 . 2]" 1
662 1 35 PRO QD 1 36 ASP H 4.500 . 7.000 2.549 2.045 2.844 . 0 0 "[ . 1 . 2]" 1
663 1 35 PRO QG 1 36 ASP H 3.500 . 5.300 3.302 2.171 4.018 . 0 0 "[ . 1 . 2]" 1
664 1 35 PRO QG 1 36 ASP QB 4.500 . 8.000 4.286 3.176 5.447 . 0 0 "[ . 1 . 2]" 1
665 1 36 ASP H 1 36 ASP QB 3.500 . 5.300 2.395 2.193 2.681 . 0 0 "[ . 1 . 2]" 1
666 1 36 ASP H 1 37 ALA H 3.500 . 4.300 2.581 2.205 2.957 . 0 0 "[ . 1 . 2]" 1
667 1 36 ASP H 1 37 ALA MB 4.500 . 7.500 4.278 3.632 4.729 . 0 0 "[ . 1 . 2]" 1
668 1 36 ASP HA 1 37 ALA H 3.500 . 4.300 3.246 2.914 3.541 . 0 0 "[ . 1 . 2]" 1
669 1 36 ASP HA 1 37 ALA MB 4.500 . 7.500 4.706 4.142 5.015 . 0 0 "[ . 1 . 2]" 1
670 1 36 ASP QB 1 37 ALA H 4.500 . 7.000 3.356 2.590 4.037 . 0 0 "[ . 1 . 2]" 1
671 1 36 ASP QB 1 37 ALA HA 4.500 . 7.000 4.451 3.855 5.098 . 0 0 "[ . 1 . 2]" 1
672 1 36 ASP QB 1 37 ALA MB 4.500 . 8.500 4.478 3.616 5.187 . 0 0 "[ . 1 . 2]" 1
673 1 37 ALA H 1 38 SER H 4.500 . 6.000 3.295 2.514 4.360 . 0 0 "[ . 1 . 2]" 1
674 1 37 ALA H 1 39 VAL MG1 4.500 . 7.500 5.666 3.317 7.028 . 0 0 "[ . 1 . 2]" 1
675 1 37 ALA HA 1 38 SER QB 4.500 . 7.000 4.437 4.090 4.650 . 0 0 "[ . 1 . 2]" 1
676 1 37 ALA HA 1 39 VAL MG1 4.500 . 7.500 4.682 2.913 7.102 . 0 0 "[ . 1 . 2]" 1
677 1 37 ALA MB 1 38 SER H 3.500 . 5.800 2.487 1.835 3.726 . 0 0 "[ . 1 . 2]" 1
678 1 37 ALA MB 1 38 SER HA 4.500 . 7.500 4.125 3.708 5.083 . 0 0 "[ . 1 . 2]" 1
679 1 37 ALA MB 1 38 SER QB 4.500 . 8.500 4.419 3.903 5.119 . 0 0 "[ . 1 . 2]" 1
680 1 37 ALA MB 1 39 VAL H 4.500 . 7.500 3.894 2.806 5.320 . 0 0 "[ . 1 . 2]" 1
681 1 37 ALA MB 1 39 VAL HA 4.500 . 7.500 5.006 3.872 6.125 . 0 0 "[ . 1 . 2]" 1
682 1 37 ALA MB 1 39 VAL HB 4.500 . 7.500 5.443 4.331 6.803 . 0 0 "[ . 1 . 2]" 1
683 1 37 ALA MB 1 39 VAL MG1 3.500 . 7.300 3.477 2.147 5.080 . 0 0 "[ . 1 . 2]" 1
684 1 37 ALA MB 1 39 VAL MG2 3.500 . 7.300 3.457 1.960 5.932 . 0 0 "[ . 1 . 2]" 1
685 1 37 ALA MB 1 44 PHE QE 4.500 . 9.900 5.631 3.655 7.222 . 0 0 "[ . 1 . 2]" 1
686 1 37 ALA MB 1 44 PHE HZ 4.500 . 8.000 6.315 4.402 8.335 0.335 10 0 "[ . 1 . 2]" 1
687 1 38 SER H 1 39 VAL H 3.500 . 4.300 3.450 2.552 4.515 0.215 1 0 "[ . 1 . 2]" 1
688 1 38 SER H 1 39 VAL MG1 4.500 . 7.500 4.372 3.650 6.661 . 0 0 "[ . 1 . 2]" 1
689 1 38 SER HA 1 39 VAL H 3.500 . 4.300 2.616 2.128 3.523 . 0 0 "[ . 1 . 2]" 1
690 1 38 SER HA 1 39 VAL MG1 4.500 . 7.500 4.370 3.373 5.455 . 0 0 "[ . 1 . 2]" 1
691 1 38 SER HA 1 39 VAL MG2 4.500 . 7.500 3.963 3.207 4.923 . 0 0 "[ . 1 . 2]" 1
692 1 38 SER QB 1 39 VAL H 4.500 . 7.000 3.536 2.456 3.970 . 0 0 "[ . 1 . 2]" 1
693 1 38 SER QB 1 39 VAL MG1 4.500 . 8.500 4.317 3.210 5.924 . 0 0 "[ . 1 . 2]" 1
694 1 38 SER QB 1 39 VAL MG2 4.500 . 8.500 4.591 3.953 5.145 . 0 0 "[ . 1 . 2]" 1
695 1 39 VAL H 1 39 VAL HB 3.500 . 4.300 3.666 2.754 3.799 . 0 0 "[ . 1 . 2]" 1
696 1 39 VAL H 1 39 VAL MG1 3.500 . 5.800 2.891 2.144 3.904 . 0 0 "[ . 1 . 2]" 1
697 1 39 VAL H 1 39 VAL MG2 3.500 . 5.800 2.065 1.846 2.444 . 0 0 "[ . 1 . 2]" 1
698 1 39 VAL H 1 40 ASN H 4.500 . 6.000 4.133 2.660 4.501 . 0 0 "[ . 1 . 2]" 1
699 1 39 VAL H 1 44 PHE QB 4.500 . 7.000 5.830 4.701 7.355 0.355 13 0 "[ . 1 . 2]" 1
700 1 39 VAL HA 1 39 VAL HB 2.500 . 3.400 2.560 2.476 3.038 . 0 0 "[ . 1 . 2]" 1
701 1 39 VAL HA 1 39 VAL MG1 3.500 . 5.800 2.287 2.230 2.347 . 0 0 "[ . 1 . 2]" 1
702 1 39 VAL HA 1 39 VAL MG2 3.500 . 5.800 3.170 2.532 3.225 . 0 0 "[ . 1 . 2]" 1
703 1 39 VAL HA 1 40 ASN H 3.500 . 4.300 2.432 2.089 3.132 . 0 0 "[ . 1 . 2]" 1
704 1 39 VAL HA 1 40 ASN QB 4.500 . 7.000 4.055 3.799 4.567 . 0 0 "[ . 1 . 2]" 1
705 1 39 VAL HA 1 44 PHE QD 4.500 . 8.400 5.089 3.247 6.474 . 0 0 "[ . 1 . 2]" 1
706 1 39 VAL HB 1 40 ASN H 3.500 . 4.300 2.891 1.614 4.161 0.186 6 0 "[ . 1 . 2]" 1
707 1 39 VAL HB 1 44 PHE QB 4.500 . 7.000 3.083 2.013 4.596 . 0 0 "[ . 1 . 2]" 1
708 1 39 VAL HB 1 44 PHE QD 4.500 . 8.400 3.379 2.479 5.344 . 0 0 "[ . 1 . 2]" 1
709 1 39 VAL HB 1 44 PHE QE 4.500 . 8.400 4.572 2.768 6.098 . 0 0 "[ . 1 . 2]" 1
710 1 39 VAL MG1 1 40 ASN H 4.500 . 7.500 3.724 3.332 4.221 . 0 0 "[ . 1 . 2]" 1
711 1 39 VAL MG1 1 43 GLU QG 4.500 . 9.000 4.224 2.233 7.038 . 0 0 "[ . 1 . 2]" 1
712 1 39 VAL MG1 1 44 PHE QB 4.500 . 8.500 4.020 2.459 5.130 . 0 0 "[ . 1 . 2]" 1
713 1 39 VAL MG1 1 44 PHE QD 4.500 . 9.900 3.285 2.644 4.145 . 0 0 "[ . 1 . 2]" 1
714 1 39 VAL MG1 1 44 PHE QE 4.500 . 9.900 3.404 2.338 5.047 . 0 0 "[ . 1 . 2]" 1
715 1 39 VAL MG2 1 40 ASN H 4.500 . 7.500 3.626 2.059 4.327 . 0 0 "[ . 1 . 2]" 1
716 1 39 VAL MG2 1 40 ASN QB 4.500 . 8.500 4.951 4.226 5.631 . 0 0 "[ . 1 . 2]" 1
717 1 39 VAL MG2 1 40 ASN QD 4.500 . 9.000 6.248 5.464 7.618 . 0 0 "[ . 1 . 2]" 1
718 1 39 VAL MG2 1 41 PHE HA 4.500 . 7.500 5.033 4.053 6.782 . 0 0 "[ . 1 . 2]" 1
719 1 39 VAL MG2 1 43 GLU QG 4.500 . 9.000 4.746 3.506 7.595 . 0 0 "[ . 1 . 2]" 1
720 1 39 VAL MG2 1 44 PHE H 4.500 . 7.500 5.211 4.239 6.845 . 0 0 "[ . 1 . 2]" 1
721 1 39 VAL MG2 1 44 PHE HA 4.500 . 7.500 5.153 3.873 7.599 0.099 13 0 "[ . 1 . 2]" 1
722 1 39 VAL MG2 1 44 PHE QB 4.500 . 8.500 3.328 2.172 5.457 . 0 0 "[ . 1 . 2]" 1
723 1 39 VAL MG2 1 44 PHE QD 4.500 . 9.900 3.319 2.333 4.847 . 0 0 "[ . 1 . 2]" 1
724 1 39 VAL MG2 1 44 PHE QE 4.500 . 9.900 3.655 2.778 4.870 . 0 0 "[ . 1 . 2]" 1
725 1 39 VAL MG2 1 44 PHE HZ 4.500 . 8.000 4.513 2.984 5.680 . 0 0 "[ . 1 . 2]" 1
726 1 40 ASN H 1 40 ASN QB 3.500 . 5.300 2.534 2.187 3.207 . 0 0 "[ . 1 . 2]" 1
727 1 40 ASN H 1 40 ASN QD 4.500 . 7.500 4.312 2.033 4.944 . 0 0 "[ . 1 . 2]" 1
728 1 40 ASN H 1 43 GLU QG 4.500 . 7.500 3.357 2.281 5.408 . 0 0 "[ . 1 . 2]" 1
729 1 40 ASN H 1 44 PHE QD 4.500 . 8.400 5.013 1.814 6.819 . 0 0 "[ . 1 . 2]" 1
730 1 40 ASN H 1 44 PHE QE 4.500 . 8.400 6.523 2.546 8.596 0.196 15 0 "[ . 1 . 2]" 1
731 1 40 ASN QB 1 41 PHE H 4.500 . 7.000 3.279 1.700 3.748 . 0 0 "[ . 1 . 2]" 1
732 1 40 ASN QB 1 42 SER QB 4.500 . 8.000 4.233 3.316 5.018 . 0 0 "[ . 1 . 2]" 1
733 1 40 ASN QB 1 43 GLU HA 4.500 . 7.000 5.444 4.611 7.446 0.446 18 0 "[ . 1 . 2]" 1
734 1 40 ASN QB 1 43 GLU QB 4.500 . 8.000 3.794 2.100 6.077 . 0 0 "[ . 1 . 2]" 1
735 1 40 ASN QB 1 43 GLU QG 4.500 . 8.500 2.387 1.836 5.034 . 0 0 "[ . 1 . 2]" 1
736 1 40 ASN QB 1 44 PHE H 4.500 . 7.000 4.229 2.949 5.872 . 0 0 "[ . 1 . 2]" 1
737 1 40 ASN QD 1 42 SER H 4.500 . 7.500 3.611 2.149 5.827 . 0 0 "[ . 1 . 2]" 1
738 1 40 ASN QD 1 42 SER QB 4.500 . 8.500 3.721 2.111 6.023 . 0 0 "[ . 1 . 2]" 1
739 1 40 ASN QD 1 43 GLU H 4.500 . 7.500 4.197 2.292 5.128 . 0 0 "[ . 1 . 2]" 1
740 1 40 ASN QD 1 43 GLU QB 4.500 . 8.500 4.908 2.912 6.132 . 0 0 "[ . 1 . 2]" 1
741 1 40 ASN QD 1 43 GLU QG 4.500 . 9.000 4.040 1.939 5.613 . 0 0 "[ . 1 . 2]" 1
742 1 41 PHE H 1 41 PHE QB 3.500 . 5.300 2.238 2.182 2.363 . 0 0 "[ . 1 . 2]" 1
743 1 41 PHE H 1 41 PHE QD 4.500 . 8.400 4.158 4.066 4.250 . 0 0 "[ . 1 . 2]" 1
744 1 41 PHE H 1 44 PHE QB 4.500 . 7.000 4.795 3.743 5.489 . 0 0 "[ . 1 . 2]" 1
745 1 41 PHE HA 1 41 PHE QD 3.500 . 6.700 2.797 2.448 3.088 . 0 0 "[ . 1 . 2]" 1
746 1 41 PHE HA 1 44 PHE QD 4.500 . 8.400 4.712 3.076 5.756 . 0 0 "[ . 1 . 2]" 1
747 1 41 PHE HA 1 45 SER H 4.500 . 6.000 4.533 3.615 5.335 . 0 0 "[ . 1 . 2]" 1
748 1 41 PHE QB 1 42 SER H 4.500 . 7.000 2.531 2.215 3.204 . 0 0 "[ . 1 . 2]" 1
749 1 41 PHE QD 1 42 SER H 4.500 . 8.400 3.533 2.964 4.566 . 0 0 "[ . 1 . 2]" 1
750 1 41 PHE QD 1 42 SER HA 4.500 . 8.400 3.299 2.689 4.303 . 0 0 "[ . 1 . 2]" 1
751 1 41 PHE QD 1 42 SER QB 4.500 . 9.400 4.283 3.314 5.270 . 0 0 "[ . 1 . 2]" 1
752 1 41 PHE QD 1 43 GLU H 4.500 . 8.400 5.742 5.148 6.613 . 0 0 "[ . 1 . 2]" 1
753 1 41 PHE QD 1 44 PHE H 4.500 . 8.400 5.678 5.314 6.192 . 0 0 "[ . 1 . 2]" 1
754 1 41 PHE QD 1 45 SER H 4.500 . 8.400 5.312 4.889 5.842 . 0 0 "[ . 1 . 2]" 1
755 1 41 PHE QD 1 45 SER QB 4.500 . 9.400 4.438 3.153 6.026 . 0 0 "[ . 1 . 2]" 1
756 1 41 PHE QE 1 42 SER HA 4.500 . 8.400 4.728 4.184 5.638 . 0 0 "[ . 1 . 2]" 1
757 1 41 PHE QE 1 45 SER QB 4.500 . 9.400 4.423 3.407 5.631 . 0 0 "[ . 1 . 2]" 1
758 1 41 PHE HZ 1 45 SER HA 4.500 . 6.500 6.355 5.659 6.741 0.241 17 0 "[ . 1 . 2]" 1
759 1 41 PHE HZ 1 45 SER QB 4.500 . 7.500 5.359 4.409 6.599 . 0 0 "[ . 1 . 2]" 1
760 1 42 SER H 1 42 SER QB 3.500 . 5.300 2.402 2.214 2.592 . 0 0 "[ . 1 . 2]" 1
761 1 42 SER H 1 43 GLU H 4.500 . 6.000 2.861 2.556 3.230 . 0 0 "[ . 1 . 2]" 1
762 1 42 SER HA 1 42 SER QB 2.500 . 4.400 2.363 2.315 2.427 . 0 0 "[ . 1 . 2]" 1
763 1 42 SER HA 1 45 SER H 4.500 . 6.000 3.690 3.304 4.439 . 0 0 "[ . 1 . 2]" 1
764 1 42 SER HA 1 45 SER QB 4.500 . 7.000 3.154 2.393 4.373 . 0 0 "[ . 1 . 2]" 1
765 1 42 SER QB 1 43 GLU H 3.500 . 5.300 2.393 2.094 2.655 . 0 0 "[ . 1 . 2]" 1
766 1 42 SER QB 1 43 GLU QG 4.500 . 8.500 4.059 3.450 5.478 . 0 0 "[ . 1 . 2]" 1
767 1 43 GLU H 1 43 GLU QB 3.500 . 5.300 2.570 2.218 2.765 . 0 0 "[ . 1 . 2]" 1
768 1 43 GLU H 1 43 GLU QG 4.500 . 7.500 2.226 1.758 4.078 . 0 0 "[ . 1 . 2]" 1
769 1 43 GLU H 1 44 PHE QB 4.500 . 7.000 4.432 3.870 4.757 . 0 0 "[ . 1 . 2]" 1
770 1 43 GLU H 1 44 PHE QD 4.500 . 8.400 5.884 4.193 6.592 . 0 0 "[ . 1 . 2]" 1
771 1 43 GLU QB 1 44 PHE H 4.500 . 7.000 3.558 2.895 3.782 . 0 0 "[ . 1 . 2]" 1
772 1 43 GLU QB 1 44 PHE QD 4.500 . 9.400 5.025 3.334 5.869 . 0 0 "[ . 1 . 2]" 1
773 1 43 GLU QG 1 44 PHE H 4.500 . 7.500 2.567 1.982 4.278 . 0 0 "[ . 1 . 2]" 1
774 1 43 GLU QG 1 44 PHE QB 4.500 . 8.500 3.300 2.740 5.349 . 0 0 "[ . 1 . 2]" 1
775 1 43 GLU QG 1 44 PHE QD 4.500 . 9.900 3.835 2.053 4.613 . 0 0 "[ . 1 . 2]" 1
776 1 43 GLU QG 1 44 PHE QE 4.500 . 9.900 5.642 3.021 6.619 . 0 0 "[ . 1 . 2]" 1
777 1 43 GLU QG 1 46 LYS QE 4.500 . 9.000 4.493 3.809 6.180 . 0 0 "[ . 1 . 2]" 1
778 1 44 PHE H 1 44 PHE QB 3.500 . 5.300 2.259 2.124 2.354 . 0 0 "[ . 1 . 2]" 1
779 1 44 PHE H 1 44 PHE QD 4.500 . 8.400 3.868 2.521 4.252 . 0 0 "[ . 1 . 2]" 1
780 1 44 PHE H 1 45 SER HA 4.500 . 6.000 5.020 4.853 5.287 . 0 0 "[ . 1 . 2]" 1
781 1 44 PHE H 1 45 SER QB 4.500 . 7.000 4.446 4.098 4.823 . 0 0 "[ . 1 . 2]" 1
782 1 44 PHE HA 1 44 PHE QD 3.500 . 6.700 2.459 1.969 3.011 . 0 0 "[ . 1 . 2]" 1
783 1 44 PHE QB 1 45 SER H 4.500 . 7.000 3.167 2.725 3.403 . 0 0 "[ . 1 . 2]" 1
784 1 44 PHE QB 1 45 SER HA 4.500 . 7.000 4.059 3.917 4.198 . 0 0 "[ . 1 . 2]" 1
785 1 44 PHE QB 1 45 SER QB 4.500 . 8.000 4.640 4.193 5.012 . 0 0 "[ . 1 . 2]" 1
786 1 44 PHE QD 1 45 SER H 4.500 . 8.400 4.649 4.318 4.861 . 0 0 "[ . 1 . 2]" 1
787 1 44 PHE QD 1 45 SER HA 4.500 . 8.400 4.760 3.785 5.815 . 0 0 "[ . 1 . 2]" 1
788 1 44 PHE QD 1 46 LYS QE 4.500 . 9.900 5.771 4.322 7.215 . 0 0 "[ . 1 . 2]" 1
789 1 44 PHE QD 1 47 LYS QB 4.500 . 9.400 3.654 2.647 5.629 . 0 0 "[ . 1 . 2]" 1
790 1 44 PHE QD 1 47 LYS QD 4.500 . 9.900 5.012 3.475 6.213 . 0 0 "[ . 1 . 2]" 1
791 1 44 PHE QE 1 47 LYS QB 4.500 . 9.400 4.052 3.079 6.108 . 0 0 "[ . 1 . 2]" 1
792 1 44 PHE QE 1 47 LYS QD 4.500 . 9.900 4.756 3.170 6.604 . 0 0 "[ . 1 . 2]" 1
793 1 44 PHE HZ 1 47 LYS QB 4.500 . 7.500 5.045 3.751 7.357 . 0 0 "[ . 1 . 2]" 1
794 1 44 PHE HZ 1 47 LYS QD 4.500 . 8.000 5.873 2.965 8.246 0.246 17 0 "[ . 1 . 2]" 1
795 1 45 SER H 1 45 SER QB 3.500 . 5.300 2.361 2.226 2.532 . 0 0 "[ . 1 . 2]" 1
796 1 45 SER H 1 46 LYS QB 4.500 . 7.000 4.907 4.356 5.295 . 0 0 "[ . 1 . 2]" 1
797 1 45 SER HA 1 46 LYS HA 4.500 . 6.000 4.704 4.538 4.817 . 0 0 "[ . 1 . 2]" 1
798 1 45 SER HA 1 46 LYS QG 4.500 . 7.500 5.138 4.987 5.275 . 0 0 "[ . 1 . 2]" 1
799 1 45 SER HA 1 47 LYS H 4.500 . 6.000 4.222 3.806 4.687 . 0 0 "[ . 1 . 2]" 1
800 1 45 SER HA 1 47 LYS QB 4.500 . 7.000 5.140 4.598 5.771 . 0 0 "[ . 1 . 2]" 1
801 1 45 SER HA 1 48 CYS HB2 4.500 . 6.000 3.196 2.559 4.390 . 0 0 "[ . 1 . 2]" 1
802 1 45 SER HA 1 49 SER H 4.500 . 6.000 4.045 3.576 4.575 . 0 0 "[ . 1 . 2]" 1
803 1 45 SER HA 1 49 SER QB 4.500 . 7.000 5.175 4.360 6.089 . 0 0 "[ . 1 . 2]" 1
804 1 45 SER QB 1 46 LYS H 4.500 . 7.000 2.757 2.451 3.311 . 0 0 "[ . 1 . 2]" 1
805 1 45 SER QB 1 46 LYS HA 4.500 . 7.000 4.006 3.846 4.278 . 0 0 "[ . 1 . 2]" 1
806 1 45 SER QB 1 46 LYS QB 4.500 . 8.000 4.112 3.923 4.459 . 0 0 "[ . 1 . 2]" 1
807 1 45 SER QB 1 47 LYS H 4.500 . 7.000 4.758 4.446 5.202 . 0 0 "[ . 1 . 2]" 1
808 1 46 LYS H 1 46 LYS QB 3.500 . 5.300 2.651 2.526 2.877 . 0 0 "[ . 1 . 2]" 1
809 1 46 LYS H 1 46 LYS QE 4.500 . 7.500 4.266 3.896 4.896 . 0 0 "[ . 1 . 2]" 1
810 1 46 LYS H 1 46 LYS QG 3.500 . 5.800 2.013 1.798 2.353 . 0 0 "[ . 1 . 2]" 1
811 1 46 LYS QD 1 47 LYS H 4.500 . 7.500 3.746 2.284 4.758 . 0 0 "[ . 1 . 2]" 1
812 1 46 LYS QE 1 47 LYS H 4.500 . 7.500 4.294 3.431 5.054 . 0 0 "[ . 1 . 2]" 1
813 1 46 LYS QG 1 47 LYS H 3.500 . 5.800 2.619 2.304 3.257 . 0 0 "[ . 1 . 2]" 1
814 1 47 LYS H 1 47 LYS QB 3.500 . 5.300 2.292 2.078 2.483 . 0 0 "[ . 1 . 2]" 1
815 1 47 LYS H 1 48 CYS HA 4.500 . 6.000 5.079 4.842 5.250 . 0 0 "[ . 1 . 2]" 1
816 1 47 LYS H 1 48 CYS HB2 4.500 . 6.000 4.697 4.356 4.995 . 0 0 "[ . 1 . 2]" 1
817 1 47 LYS H 1 49 SER H 4.500 . 6.000 4.065 3.654 4.406 . 0 0 "[ . 1 . 2]" 1
818 1 47 LYS HA 1 47 LYS QE 3.500 . 5.800 3.125 1.799 5.082 . 0 0 "[ . 1 . 2]" 1
819 1 47 LYS QB 1 49 SER H 4.500 . 7.000 4.849 4.460 5.202 . 0 0 "[ . 1 . 2]" 1
820 1 47 LYS QD 1 50 GLU QG 4.500 . 9.000 4.643 2.594 6.960 . 0 0 "[ . 1 . 2]" 1
821 1 47 LYS QE 1 49 SER H 4.500 . 7.500 6.512 5.196 7.657 0.157 8 0 "[ . 1 . 2]" 1
822 1 47 LYS QE 1 50 GLU H 4.500 . 7.500 5.896 4.388 7.706 0.206 8 0 "[ . 1 . 2]" 1
823 1 47 LYS QE 1 50 GLU QG 4.500 . 9.000 4.327 2.632 7.754 . 0 0 "[ . 1 . 2]" 1
824 1 48 CYS HA 1 51 ARG H 4.500 . 6.000 3.488 3.116 4.113 . 0 0 "[ . 1 . 2]" 1
825 1 48 CYS HA 1 51 ARG QB 4.500 . 7.000 3.011 2.129 4.213 . 0 0 "[ . 1 . 2]" 1
826 1 48 CYS HA 1 51 ARG QD 4.500 . 7.500 4.013 2.975 5.382 . 0 0 "[ . 1 . 2]" 1
827 1 48 CYS HA 1 51 ARG QG 4.500 . 7.500 5.024 4.035 6.342 . 0 0 "[ . 1 . 2]" 1
828 1 48 CYS HB2 1 49 SER H 3.500 . 4.300 2.933 2.363 4.206 . 0 0 "[ . 1 . 2]" 1
829 1 48 CYS HB2 1 50 GLU H 4.500 . 6.000 5.350 4.835 5.862 . 0 0 "[ . 1 . 2]" 1
830 1 49 SER H 1 49 SER QB 3.500 . 5.300 2.573 2.450 2.791 . 0 0 "[ . 1 . 2]" 1
831 1 49 SER H 1 50 GLU H 3.500 . 4.300 2.949 2.749 3.288 . 0 0 "[ . 1 . 2]" 1
832 1 49 SER H 1 50 GLU QB 4.500 . 7.000 5.115 4.804 5.549 . 0 0 "[ . 1 . 2]" 1
833 1 49 SER H 1 50 GLU QG 4.500 . 7.500 4.356 4.039 4.895 . 0 0 "[ . 1 . 2]" 1
834 1 49 SER H 1 51 ARG H 4.500 . 6.000 4.301 4.079 4.601 . 0 0 "[ . 1 . 2]" 1
835 1 49 SER H 1 51 ARG QB 4.500 . 7.000 5.167 4.718 5.719 . 0 0 "[ . 1 . 2]" 1
836 1 49 SER H 1 52 TRP QB 4.500 . 7.000 4.653 4.206 4.995 . 0 0 "[ . 1 . 2]" 1
837 1 49 SER HA 1 52 TRP H 4.500 . 6.000 3.399 3.065 3.858 . 0 0 "[ . 1 . 2]" 1
838 1 49 SER HA 1 52 TRP QB 4.500 . 7.000 2.492 1.885 3.087 . 0 0 "[ . 1 . 2]" 1
839 1 49 SER HA 1 53 LYS QG 4.500 . 7.500 4.219 3.716 5.146 . 0 0 "[ . 1 . 2]" 1
840 1 49 SER QB 1 50 GLU H 4.500 . 7.000 3.083 2.064 3.811 . 0 0 "[ . 1 . 2]" 1
841 1 49 SER QB 1 52 TRP QB 4.500 . 8.000 3.875 3.314 4.550 . 0 0 "[ . 1 . 2]" 1
842 1 50 GLU H 1 50 GLU QB 3.500 . 5.300 2.527 2.342 2.622 . 0 0 "[ . 1 . 2]" 1
843 1 50 GLU H 1 50 GLU QG 3.500 . 5.800 2.190 1.972 2.462 . 0 0 "[ . 1 . 2]" 1
844 1 50 GLU H 1 51 ARG H 3.500 . 4.300 2.669 2.510 2.822 . 0 0 "[ . 1 . 2]" 1
845 1 50 GLU H 1 52 TRP QB 4.500 . 7.000 4.787 4.476 5.027 . 0 0 "[ . 1 . 2]" 1
846 1 50 GLU QB 1 54 THR MG 4.500 . 8.500 4.335 3.746 5.378 . 0 0 "[ . 1 . 2]" 1
847 1 51 ARG H 1 51 ARG QB 3.500 . 5.300 2.273 2.163 2.363 . 0 0 "[ . 1 . 2]" 1
848 1 51 ARG H 1 51 ARG QD 4.500 . 7.500 4.413 4.278 4.526 . 0 0 "[ . 1 . 2]" 1
849 1 51 ARG H 1 51 ARG QG 4.500 . 7.500 3.973 3.904 4.011 . 0 0 "[ . 1 . 2]" 1
850 1 51 ARG H 1 52 TRP H 3.500 . 4.300 2.325 2.171 2.524 . 0 0 "[ . 1 . 2]" 1
851 1 51 ARG H 1 52 TRP QB 4.500 . 7.000 4.080 3.928 4.244 . 0 0 "[ . 1 . 2]" 1
852 1 51 ARG H 1 54 THR MG 4.500 . 7.500 5.406 4.875 6.039 . 0 0 "[ . 1 . 2]" 1
853 1 51 ARG HA 1 51 ARG QD 4.500 . 7.500 4.005 3.895 4.075 . 0 0 "[ . 1 . 2]" 1
854 1 51 ARG HA 1 51 ARG QG 3.500 . 5.800 2.500 2.376 2.654 . 0 0 "[ . 1 . 2]" 1
855 1 51 ARG HA 1 53 LYS H 4.500 . 6.000 4.153 3.728 4.493 . 0 0 "[ . 1 . 2]" 1
856 1 51 ARG HA 1 54 THR H 4.500 . 6.000 3.288 3.039 3.528 . 0 0 "[ . 1 . 2]" 1
857 1 51 ARG HA 1 54 THR HB 4.500 . 6.000 4.424 4.164 4.742 . 0 0 "[ . 1 . 2]" 1
858 1 51 ARG HA 1 54 THR MG 3.500 . 5.800 3.753 3.005 4.160 . 0 0 "[ . 1 . 2]" 1
859 1 51 ARG QB 1 51 ARG HE 4.500 . 7.000 3.952 3.903 4.005 . 0 0 "[ . 1 . 2]" 1
860 1 51 ARG QB 1 52 TRP H 3.500 . 5.300 2.598 2.401 2.845 . 0 0 "[ . 1 . 2]" 1
861 1 51 ARG QB 1 52 TRP HA 4.500 . 7.000 4.195 4.038 4.295 . 0 0 "[ . 1 . 2]" 1
862 1 51 ARG QB 1 52 TRP QB 4.500 . 8.000 4.105 3.976 4.219 . 0 0 "[ . 1 . 2]" 1
863 1 51 ARG QB 1 53 LYS H 4.500 . 7.000 4.760 4.640 4.896 . 0 0 "[ . 1 . 2]" 1
864 1 51 ARG QB 1 54 THR H 4.500 . 7.000 4.840 4.746 4.949 . 0 0 "[ . 1 . 2]" 1
865 1 51 ARG QB 1 55 MET QG 4.500 . 8.500 4.046 3.598 4.454 . 0 0 "[ . 1 . 2]" 1
866 1 51 ARG QD 1 52 TRP H 4.500 . 7.500 4.563 4.221 4.898 . 0 0 "[ . 1 . 2]" 1
867 1 51 ARG QD 1 54 THR MG 4.500 . 9.000 6.477 5.780 6.913 . 0 0 "[ . 1 . 2]" 1
868 1 51 ARG QG 1 52 TRP H 4.500 . 7.500 3.588 3.151 3.890 . 0 0 "[ . 1 . 2]" 1
869 1 51 ARG QG 1 52 TRP QB 4.500 . 8.500 4.621 4.234 4.882 . 0 0 "[ . 1 . 2]" 1
870 1 51 ARG QG 1 55 MET QG 4.500 . 9.000 2.377 1.859 2.776 . 0 0 "[ . 1 . 2]" 1
871 1 52 TRP H 1 52 TRP QB 3.500 . 5.300 2.284 2.253 2.335 . 0 0 "[ . 1 . 2]" 1
872 1 52 TRP H 1 52 TRP HD1 4.500 . 6.500 4.942 4.837 5.099 . 0 0 "[ . 1 . 2]" 1
873 1 52 TRP H 1 52 TRP HE3 4.500 . 6.500 4.839 4.655 4.947 . 0 0 "[ . 1 . 2]" 1
874 1 52 TRP H 1 53 LYS H 3.500 . 4.300 2.742 2.604 2.923 . 0 0 "[ . 1 . 2]" 1
875 1 52 TRP H 1 53 LYS QG 4.500 . 7.500 4.358 3.967 4.713 . 0 0 "[ . 1 . 2]" 1
876 1 52 TRP H 1 54 THR H 4.500 . 6.000 4.030 3.852 4.209 . 0 0 "[ . 1 . 2]" 1
877 1 52 TRP H 1 54 THR MG 4.500 . 7.500 5.660 5.156 5.998 . 0 0 "[ . 1 . 2]" 1
878 1 52 TRP H 1 55 MET QG 4.500 . 7.500 4.258 3.901 4.912 . 0 0 "[ . 1 . 2]" 1
879 1 52 TRP HA 1 52 TRP HD1 4.500 . 6.500 4.511 4.330 4.638 . 0 0 "[ . 1 . 2]" 1
880 1 52 TRP HA 1 52 TRP HE3 3.500 . 4.800 2.786 2.450 3.142 . 0 0 "[ . 1 . 2]" 1
881 1 52 TRP HA 1 52 TRP HZ3 4.500 . 6.500 4.984 4.692 5.285 . 0 0 "[ . 1 . 2]" 1
882 1 52 TRP HA 1 55 MET H 4.500 . 6.000 3.638 3.319 4.269 . 0 0 "[ . 1 . 2]" 1
883 1 52 TRP HA 1 55 MET QG 4.500 . 7.500 2.779 2.342 3.450 . 0 0 "[ . 1 . 2]" 1
884 1 52 TRP HA 1 60 LYS QE 4.500 . 7.500 3.921 3.199 5.562 . 0 0 "[ . 1 . 2]" 1
885 1 52 TRP QB 1 52 TRP HE1 4.500 . 7.500 4.418 4.396 4.445 . 0 0 "[ . 1 . 2]" 1
886 1 52 TRP QB 1 53 LYS H 3.500 . 5.300 2.640 2.436 2.929 . 0 0 "[ . 1 . 2]" 1
887 1 52 TRP QB 1 53 LYS HA 4.500 . 7.000 4.269 4.202 4.381 . 0 0 "[ . 1 . 2]" 1
888 1 52 TRP QB 1 53 LYS QB 4.500 . 8.000 4.491 4.341 4.658 . 0 0 "[ . 1 . 2]" 1
889 1 52 TRP QB 1 53 LYS QG 4.500 . 8.500 3.210 3.021 3.434 . 0 0 "[ . 1 . 2]" 1
890 1 52 TRP QB 1 54 THR H 4.500 . 7.000 4.617 4.445 4.833 . 0 0 "[ . 1 . 2]" 1
891 1 52 TRP QB 1 55 MET ME 4.500 . 8.500 3.617 2.771 4.990 . 0 0 "[ . 1 . 2]" 1
892 1 52 TRP QB 1 55 MET QG 4.500 . 8.500 4.565 4.214 5.100 . 0 0 "[ . 1 . 2]" 1
893 1 52 TRP HD1 1 53 LYS H 4.500 . 6.500 3.754 3.310 4.293 . 0 0 "[ . 1 . 2]" 1
894 1 52 TRP HD1 1 53 LYS HA 4.500 . 6.500 3.653 3.265 4.180 . 0 0 "[ . 1 . 2]" 1
895 1 52 TRP HD1 1 53 LYS QB 4.500 . 7.500 4.647 4.318 5.189 . 0 0 "[ . 1 . 2]" 1
896 1 52 TRP HD1 1 53 LYS QG 4.500 . 8.000 2.871 2.393 3.527 . 0 0 "[ . 1 . 2]" 1
897 1 52 TRP HE1 1 53 LYS HA 4.500 . 6.500 5.039 4.650 5.505 . 0 0 "[ . 1 . 2]" 1
898 1 52 TRP HE1 1 53 LYS QG 4.500 . 8.000 4.731 4.059 5.544 . 0 0 "[ . 1 . 2]" 1
899 1 52 TRP HE1 1 60 LYS QD 4.500 . 8.000 4.431 3.161 5.826 . 0 0 "[ . 1 . 2]" 1
900 1 52 TRP HE1 1 60 LYS QE 4.500 . 8.000 3.954 3.234 4.449 . 0 0 "[ . 1 . 2]" 1
901 1 52 TRP HE3 1 55 MET QB 4.500 . 7.500 4.245 3.674 4.786 . 0 0 "[ . 1 . 2]" 1
902 1 52 TRP HE3 1 55 MET ME 3.500 . 6.300 2.294 1.940 3.147 . 0 0 "[ . 1 . 2]" 1
903 1 52 TRP HE3 1 55 MET QG 4.500 . 8.000 4.615 3.926 5.165 . 0 0 "[ . 1 . 2]" 1
904 1 52 TRP HE3 1 60 LYS QG 4.500 . 8.000 3.847 3.569 4.404 . 0 0 "[ . 1 . 2]" 1
905 1 52 TRP HE3 1 63 PHE QD 4.500 . 8.900 4.487 3.976 5.013 . 0 0 "[ . 1 . 2]" 1
906 1 52 TRP HH2 1 55 MET ME 4.500 . 8.000 4.550 4.081 4.977 . 0 0 "[ . 1 . 2]" 1
907 1 52 TRP HH2 1 60 LYS QB 4.500 . 7.500 3.204 2.751 5.384 . 0 0 "[ . 1 . 2]" 1
908 1 52 TRP HH2 1 60 LYS QD 4.500 . 8.000 3.853 3.140 5.004 . 0 0 "[ . 1 . 2]" 1
909 1 52 TRP HH2 1 60 LYS QE 4.500 . 8.000 4.555 2.739 5.844 . 0 0 "[ . 1 . 2]" 1
910 1 52 TRP HH2 1 60 LYS QG 4.500 . 8.000 3.409 3.036 4.131 . 0 0 "[ . 1 . 2]" 1
911 1 52 TRP HH2 1 63 PHE H 4.500 . 6.500 5.109 4.502 5.999 . 0 0 "[ . 1 . 2]" 1
912 1 52 TRP HH2 1 63 PHE QB 4.500 . 7.500 2.903 2.228 3.684 . 0 0 "[ . 1 . 2]" 1
913 1 52 TRP HH2 1 63 PHE QD 4.500 . 8.900 3.936 2.995 4.833 . 0 0 "[ . 1 . 2]" 1
914 1 52 TRP HH2 1 64 GLU H 4.500 . 6.500 4.630 3.457 5.788 . 0 0 "[ . 1 . 2]" 1
915 1 52 TRP HH2 1 64 GLU HA 4.500 . 6.500 5.290 3.896 6.735 0.235 6 0 "[ . 1 . 2]" 1
916 1 52 TRP HH2 1 64 GLU QG 4.500 . 8.000 3.562 2.180 4.586 . 0 0 "[ . 1 . 2]" 1
917 1 52 TRP HZ2 1 55 MET ME 4.500 . 8.000 5.508 5.136 6.050 . 0 0 "[ . 1 . 2]" 1
918 1 52 TRP HZ2 1 60 LYS QD 4.500 . 8.000 3.416 2.960 4.893 . 0 0 "[ . 1 . 2]" 1
919 1 52 TRP HZ2 1 60 LYS QE 4.500 . 8.000 4.035 2.808 4.566 . 0 0 "[ . 1 . 2]" 1
920 1 52 TRP HZ2 1 60 LYS QG 4.500 . 8.000 4.102 3.590 4.743 . 0 0 "[ . 1 . 2]" 1
921 1 52 TRP HZ2 1 63 PHE QB 4.500 . 7.500 5.047 4.216 5.852 . 0 0 "[ . 1 . 2]" 1
922 1 52 TRP HZ2 1 64 GLU QG 4.500 . 8.000 4.694 2.892 6.158 . 0 0 "[ . 1 . 2]" 1
923 1 52 TRP HZ3 1 55 MET ME 3.500 . 6.300 2.886 2.507 3.247 . 0 0 "[ . 1 . 2]" 1
924 1 52 TRP HZ3 1 60 LYS HA 4.500 . 6.500 3.252 2.601 4.043 . 0 0 "[ . 1 . 2]" 1
925 1 52 TRP HZ3 1 60 LYS QG 4.500 . 8.000 3.241 2.583 4.494 . 0 0 "[ . 1 . 2]" 1
926 1 52 TRP HZ3 1 63 PHE H 4.500 . 6.500 4.762 4.138 5.202 . 0 0 "[ . 1 . 2]" 1
927 1 52 TRP HZ3 1 63 PHE QB 4.500 . 7.500 2.850 2.142 3.553 . 0 0 "[ . 1 . 2]" 1
928 1 52 TRP HZ3 1 63 PHE QD 4.500 . 8.900 2.686 2.048 3.474 . 0 0 "[ . 1 . 2]" 1
929 1 53 LYS H 1 53 LYS QB 2.500 . 4.400 2.415 2.347 2.488 . 0 0 "[ . 1 . 2]" 1
930 1 53 LYS H 1 53 LYS QE 4.500 . 7.500 4.499 3.220 5.091 . 0 0 "[ . 1 . 2]" 1
931 1 53 LYS H 1 53 LYS QG 3.500 . 5.800 2.283 2.109 2.409 . 0 0 "[ . 1 . 2]" 1
932 1 53 LYS H 1 54 THR H 3.500 . 4.300 2.576 2.412 2.660 . 0 0 "[ . 1 . 2]" 1
933 1 53 LYS H 1 54 THR HA 4.500 . 6.000 5.174 5.031 5.246 . 0 0 "[ . 1 . 2]" 1
934 1 53 LYS H 1 54 THR MG 4.500 . 7.500 4.358 4.013 4.610 . 0 0 "[ . 1 . 2]" 1
935 1 53 LYS H 1 55 MET H 4.500 . 6.000 4.091 3.838 4.296 . 0 0 "[ . 1 . 2]" 1
936 1 53 LYS H 1 55 MET QB 4.500 . 7.000 5.220 4.847 5.450 . 0 0 "[ . 1 . 2]" 1
937 1 53 LYS H 1 55 MET QG 4.500 . 7.500 4.832 4.476 5.242 . 0 0 "[ . 1 . 2]" 1
938 1 53 LYS HA 1 53 LYS QG 3.500 . 5.800 2.434 2.387 2.479 . 0 0 "[ . 1 . 2]" 1
939 1 53 LYS HA 1 55 MET H 4.500 . 6.000 3.944 3.694 4.500 . 0 0 "[ . 1 . 2]" 1
940 1 53 LYS HA 1 60 LYS QE 4.500 . 7.500 3.897 2.935 5.729 . 0 0 "[ . 1 . 2]" 1
941 1 53 LYS QB 1 53 LYS QD 2.500 . 5.900 2.217 2.109 2.343 . 0 0 "[ . 1 . 2]" 1
942 1 53 LYS QB 1 54 THR H 3.500 . 5.300 3.008 2.729 3.287 . 0 0 "[ . 1 . 2]" 1
943 1 53 LYS QB 1 54 THR MG 3.500 . 6.800 3.097 2.887 3.328 . 0 0 "[ . 1 . 2]" 1
944 1 53 LYS QD 1 54 THR H 4.500 . 7.500 5.175 4.845 5.533 . 0 0 "[ . 1 . 2]" 1
945 1 53 LYS QG 1 54 THR H 4.500 . 7.500 4.245 4.043 4.397 . 0 0 "[ . 1 . 2]" 1
946 1 53 LYS QG 1 54 THR MG 4.500 . 9.000 4.918 4.732 5.161 . 0 0 "[ . 1 . 2]" 1
947 1 54 THR H 1 54 THR MG 3.500 . 5.800 2.855 2.608 3.143 . 0 0 "[ . 1 . 2]" 1
948 1 54 THR H 1 55 MET H 3.500 . 4.300 2.355 2.185 2.696 . 0 0 "[ . 1 . 2]" 1
949 1 54 THR H 1 55 MET HA 4.500 . 6.000 4.791 4.505 5.038 . 0 0 "[ . 1 . 2]" 1
950 1 54 THR H 1 55 MET QB 4.500 . 7.000 4.326 4.057 4.496 . 0 0 "[ . 1 . 2]" 1
951 1 54 THR H 1 55 MET QG 4.500 . 7.500 3.738 3.221 4.257 . 0 0 "[ . 1 . 2]" 1
952 1 54 THR HA 1 54 THR MG 2.500 . 4.900 2.253 2.198 2.360 . 0 0 "[ . 1 . 2]" 1
953 1 54 THR HB 1 55 MET H 4.500 . 6.000 4.175 3.700 4.357 . 0 0 "[ . 1 . 2]" 1
954 1 54 THR HB 1 55 MET HA 4.500 . 6.000 4.522 4.282 4.690 . 0 0 "[ . 1 . 2]" 1
955 1 54 THR MG 1 55 MET H 4.500 . 7.500 4.330 4.140 4.422 . 0 0 "[ . 1 . 2]" 1
956 1 54 THR MG 1 55 MET QG 4.500 . 9.000 5.211 4.942 5.428 . 0 0 "[ . 1 . 2]" 1
957 1 55 MET H 1 55 MET QB 3.500 . 5.300 2.394 2.289 2.480 . 0 0 "[ . 1 . 2]" 1
958 1 55 MET H 1 55 MET ME 4.500 . 7.500 4.082 3.653 4.776 . 0 0 "[ . 1 . 2]" 1
959 1 55 MET H 1 55 MET QG 3.500 . 5.800 2.656 2.453 2.985 . 0 0 "[ . 1 . 2]" 1
960 1 55 MET H 1 56 SER H 4.500 . 6.000 4.566 4.508 4.619 . 0 0 "[ . 1 . 2]" 1
961 1 55 MET H 1 60 LYS QD 4.500 . 7.500 5.514 4.921 6.066 . 0 0 "[ . 1 . 2]" 1
962 1 55 MET H 1 60 LYS QE 4.500 . 7.500 3.591 3.109 6.221 . 0 0 "[ . 1 . 2]" 1
963 1 55 MET H 1 60 LYS QG 4.500 . 7.500 4.783 4.389 5.879 . 0 0 "[ . 1 . 2]" 1
964 1 55 MET HA 1 55 MET QG 3.500 . 5.800 2.332 2.191 2.390 . 0 0 "[ . 1 . 2]" 1
965 1 55 MET HA 1 56 SER H 2.500 . 3.400 2.208 2.102 2.315 . 0 0 "[ . 1 . 2]" 1
966 1 55 MET HA 1 59 GLU H 4.500 . 6.000 5.564 5.162 6.004 0.004 14 0 "[ . 1 . 2]" 1
967 1 55 MET HA 1 59 GLU QB 4.500 . 7.000 3.657 3.253 4.321 . 0 0 "[ . 1 . 2]" 1
968 1 55 MET HA 1 60 LYS QE 4.500 . 7.500 4.731 4.168 7.594 0.094 3 0 "[ . 1 . 2]" 1
969 1 55 MET QB 1 56 SER H 3.500 . 5.300 2.841 2.616 3.117 . 0 0 "[ . 1 . 2]" 1
970 1 55 MET QB 1 59 GLU H 4.500 . 7.000 4.185 3.864 4.743 . 0 0 "[ . 1 . 2]" 1
971 1 55 MET QB 1 59 GLU QB 4.500 . 8.000 2.027 1.770 3.098 . 0 0 "[ . 1 . 2]" 1
972 1 55 MET QB 1 60 LYS H 4.500 . 7.000 3.853 3.059 4.390 . 0 0 "[ . 1 . 2]" 1
973 1 55 MET QB 1 60 LYS QD 4.500 . 8.500 4.095 3.539 4.433 . 0 0 "[ . 1 . 2]" 1
974 1 55 MET QB 1 60 LYS QE 3.500 . 6.800 2.769 2.018 4.815 . 0 0 "[ . 1 . 2]" 1
975 1 55 MET QB 1 60 LYS QG 4.500 . 6.800 2.727 2.274 3.760 . 0 0 "[ . 1 . 2]" 1
976 1 55 MET ME 1 56 SER H 4.500 . 7.500 4.880 4.108 5.374 . 0 0 "[ . 1 . 2]" 1
977 1 55 MET ME 1 59 GLU QB 3.500 . 6.800 2.778 1.899 3.536 . 0 0 "[ . 1 . 2]" 1
978 1 55 MET ME 1 60 LYS H 3.500 . 5.800 4.039 2.902 5.062 . 0 0 "[ . 1 . 2]" 1
979 1 55 MET ME 1 60 LYS HA 3.500 . 5.800 3.181 2.403 3.918 . 0 0 "[ . 1 . 2]" 1
980 1 55 MET ME 1 60 LYS QD 4.500 . 9.000 4.314 3.588 4.617 . 0 0 "[ . 1 . 2]" 1
981 1 55 MET ME 1 60 LYS QG 3.500 . 7.300 2.582 2.189 2.785 . 0 0 "[ . 1 . 2]" 1
982 1 55 MET ME 1 63 PHE H 4.500 . 7.500 5.193 4.566 6.161 . 0 0 "[ . 1 . 2]" 1
983 1 55 MET ME 1 63 PHE QB 4.500 . 8.500 4.421 3.801 5.296 . 0 0 "[ . 1 . 2]" 1
984 1 55 MET ME 1 63 PHE QE 2.500 . 7.300 2.307 1.912 3.115 . 0 0 "[ . 1 . 2]" 1
985 1 55 MET ME 1 63 PHE HZ 4.500 . 8.000 3.694 2.598 4.425 . 0 0 "[ . 1 . 2]" 1
986 1 55 MET QG 1 56 SER H 4.500 . 7.500 3.864 3.531 4.095 . 0 0 "[ . 1 . 2]" 1
987 1 55 MET QG 1 59 GLU QB 4.500 . 8.500 3.333 2.949 3.802 . 0 0 "[ . 1 . 2]" 1
988 1 55 MET QG 1 60 LYS H 4.500 . 7.500 5.848 5.012 6.311 . 0 0 "[ . 1 . 2]" 1
989 1 55 MET QG 1 60 LYS QD 4.500 . 9.000 5.904 5.342 6.259 . 0 0 "[ . 1 . 2]" 1
990 1 55 MET QG 1 60 LYS QE 4.500 . 9.000 4.448 3.855 6.244 . 0 0 "[ . 1 . 2]" 1
991 1 55 MET QG 1 60 LYS QG 4.500 . 9.000 4.498 4.064 5.316 . 0 0 "[ . 1 . 2]" 1
992 1 56 SER H 1 57 ALA H 4.500 . 6.000 4.555 4.426 4.635 . 0 0 "[ . 1 . 2]" 1
993 1 56 SER H 1 59 GLU H 4.500 . 6.000 3.803 3.474 3.980 . 0 0 "[ . 1 . 2]" 1
994 1 56 SER H 1 59 GLU QB 3.500 . 5.300 2.902 2.624 3.498 . 0 0 "[ . 1 . 2]" 1
995 1 56 SER H 1 59 GLU QG 4.500 . 7.500 2.921 2.256 4.075 . 0 0 "[ . 1 . 2]" 1
996 1 56 SER H 1 60 LYS H 4.500 . 6.000 4.885 4.291 5.386 . 0 0 "[ . 1 . 2]" 1
997 1 56 SER H 1 60 LYS QG 4.500 . 7.500 4.628 4.183 6.553 . 0 0 "[ . 1 . 2]" 1
998 1 56 SER HA 1 57 ALA H 3.500 . 4.300 2.520 2.309 2.730 . 0 0 "[ . 1 . 2]" 1
999 1 56 SER HA 1 57 ALA HA 4.500 . 6.000 4.305 4.259 4.353 . 0 0 "[ . 1 . 2]" 1
1000 1 56 SER HA 1 57 ALA MB 4.500 . 7.500 4.214 4.106 4.325 . 0 0 "[ . 1 . 2]" 1
1001 1 56 SER HA 1 58 LYS H 4.500 . 6.000 4.400 4.009 4.863 . 0 0 "[ . 1 . 2]" 1
1002 1 56 SER HA 1 59 GLU QB 4.500 . 7.000 4.731 4.443 5.563 . 0 0 "[ . 1 . 2]" 1
1003 1 56 SER QB 1 57 ALA H 3.500 . 5.300 2.345 1.962 3.425 . 0 0 "[ . 1 . 2]" 1
1004 1 56 SER QB 1 57 ALA MB 4.500 . 8.500 3.759 3.495 4.600 . 0 0 "[ . 1 . 2]" 1
1005 1 56 SER QB 1 58 LYS H 3.500 . 5.300 2.796 2.541 3.148 . 0 0 "[ . 1 . 2]" 1
1006 1 56 SER QB 1 58 LYS QB 4.500 . 8.000 3.323 2.942 4.139 . 0 0 "[ . 1 . 2]" 1
1007 1 56 SER QB 1 59 GLU H 4.500 . 7.000 3.259 2.687 4.033 . 0 0 "[ . 1 . 2]" 1
1008 1 57 ALA H 1 58 LYS H 4.500 . 6.000 2.739 2.477 3.014 . 0 0 "[ . 1 . 2]" 1
1009 1 57 ALA H 1 58 LYS QB 4.500 . 7.000 4.611 4.243 5.115 . 0 0 "[ . 1 . 2]" 1
1010 1 57 ALA H 1 59 GLU H 4.500 . 6.000 4.283 3.954 4.902 . 0 0 "[ . 1 . 2]" 1
1011 1 57 ALA H 1 60 LYS QB 4.500 . 7.000 5.078 4.500 5.576 . 0 0 "[ . 1 . 2]" 1
1012 1 57 ALA HA 1 60 LYS H 3.500 . 4.300 3.457 3.204 3.902 . 0 0 "[ . 1 . 2]" 1
1013 1 57 ALA HA 1 60 LYS QB 3.500 . 5.300 2.720 2.347 3.246 . 0 0 "[ . 1 . 2]" 1
1014 1 57 ALA HA 1 60 LYS QD 4.500 . 7.500 3.011 2.493 3.805 . 0 0 "[ . 1 . 2]" 1
1015 1 57 ALA HA 1 60 LYS QG 4.500 . 7.500 3.640 3.084 4.621 . 0 0 "[ . 1 . 2]" 1
1016 1 57 ALA HA 1 61 GLY H 4.500 . 6.000 4.111 3.597 4.805 . 0 0 "[ . 1 . 2]" 1
1017 1 57 ALA MB 1 58 LYS H 3.500 . 5.800 2.712 2.483 3.029 . 0 0 "[ . 1 . 2]" 1
1018 1 57 ALA MB 1 58 LYS QB 4.500 . 8.500 4.176 3.839 4.543 . 0 0 "[ . 1 . 2]" 1
1019 1 57 ALA MB 1 59 GLU H 4.500 . 7.500 4.552 4.301 5.098 . 0 0 "[ . 1 . 2]" 1
1020 1 57 ALA MB 1 61 GLY H 4.500 . 7.500 4.579 4.065 5.156 . 0 0 "[ . 1 . 2]" 1
1021 1 58 LYS H 1 58 LYS QB 3.500 . 5.300 2.304 2.161 2.530 . 0 0 "[ . 1 . 2]" 1
1022 1 58 LYS H 1 58 LYS QD 4.500 . 7.500 3.704 1.961 4.464 . 0 0 "[ . 1 . 2]" 1
1023 1 58 LYS H 1 58 LYS QG 4.500 . 7.500 3.247 2.083 4.038 . 0 0 "[ . 1 . 2]" 1
1024 1 58 LYS H 1 59 GLU H 3.500 . 4.300 2.601 2.466 2.783 . 0 0 "[ . 1 . 2]" 1
1025 1 58 LYS H 1 59 GLU QB 4.500 . 7.000 4.633 4.507 4.800 . 0 0 "[ . 1 . 2]" 1
1026 1 58 LYS H 1 59 GLU QG 4.500 . 7.500 4.195 3.943 4.858 . 0 0 "[ . 1 . 2]" 1
1027 1 58 LYS H 1 61 GLY H 4.500 . 6.000 4.727 4.573 5.028 . 0 0 "[ . 1 . 2]" 1
1028 1 58 LYS HA 1 58 LYS QD 3.500 . 5.800 2.217 1.961 3.013 . 0 0 "[ . 1 . 2]" 1
1029 1 58 LYS HA 1 58 LYS QG 3.500 . 5.800 2.865 2.386 3.199 . 0 0 "[ . 1 . 2]" 1
1030 1 58 LYS QB 1 59 GLU H 2.500 . 4.400 2.690 2.295 3.063 . 0 0 "[ . 1 . 2]" 1
1031 1 58 LYS QB 1 59 GLU QG 3.500 . 6.800 3.216 2.889 3.606 . 0 0 "[ . 1 . 2]" 1
1032 1 58 LYS QG 1 59 GLU H 4.500 . 7.500 3.977 3.309 4.754 . 0 0 "[ . 1 . 2]" 1
1033 1 59 GLU H 1 59 GLU QB 3.500 . 5.300 2.399 2.316 2.485 . 0 0 "[ . 1 . 2]" 1
1034 1 59 GLU H 1 59 GLU QG 3.500 . 5.800 2.330 2.134 2.555 . 0 0 "[ . 1 . 2]" 1
1035 1 59 GLU H 1 60 LYS H 3.500 . 4.300 2.488 2.141 2.897 . 0 0 "[ . 1 . 2]" 1
1036 1 59 GLU H 1 60 LYS QG 4.500 . 7.500 4.220 3.848 6.089 . 0 0 "[ . 1 . 2]" 1
1037 1 59 GLU H 1 61 GLY H 4.500 . 6.000 3.892 3.741 4.080 . 0 0 "[ . 1 . 2]" 1
1038 1 59 GLU HA 1 59 GLU QG 2.500 . 4.900 2.754 2.287 3.035 . 0 0 "[ . 1 . 2]" 1
1039 1 59 GLU HA 1 63 PHE QE 4.500 . 8.400 4.655 3.934 5.418 . 0 0 "[ . 1 . 2]" 1
1040 1 59 GLU QB 1 60 LYS H 3.500 . 5.300 2.730 1.962 3.175 . 0 0 "[ . 1 . 2]" 1
1041 1 59 GLU QB 1 60 LYS QG 4.500 . 8.500 3.258 2.870 5.159 . 0 0 "[ . 1 . 2]" 1
1042 1 59 GLU QB 1 61 GLY H 4.500 . 7.000 4.620 4.283 5.074 . 0 0 "[ . 1 . 2]" 1
1043 1 59 GLU QG 1 60 LYS H 4.500 . 7.500 4.107 3.762 4.354 . 0 0 "[ . 1 . 2]" 1
1044 1 60 LYS H 1 60 LYS QB 3.500 . 5.300 2.419 2.190 2.562 . 0 0 "[ . 1 . 2]" 1
1045 1 60 LYS H 1 60 LYS QD 4.500 . 7.500 3.922 3.701 4.271 . 0 0 "[ . 1 . 2]" 1
1046 1 60 LYS H 1 60 LYS QE 4.500 . 7.500 4.603 4.067 5.845 . 0 0 "[ . 1 . 2]" 1
1047 1 60 LYS H 1 60 LYS QG 3.500 . 5.800 2.489 1.937 3.934 . 0 0 "[ . 1 . 2]" 1
1048 1 60 LYS H 1 61 GLY H 3.500 . 4.300 2.419 2.144 2.879 . 0 0 "[ . 1 . 2]" 1
1049 1 60 LYS H 1 61 GLY QA 4.500 . 7.000 4.295 4.062 4.700 . 0 0 "[ . 1 . 2]" 1
1050 1 60 LYS H 1 64 GLU QG 4.500 . 7.500 5.527 5.028 6.211 . 0 0 "[ . 1 . 2]" 1
1051 1 60 LYS HA 1 60 LYS QD 4.500 . 7.500 3.990 3.950 4.045 . 0 0 "[ . 1 . 2]" 1
1052 1 60 LYS HA 1 60 LYS QE 4.500 . 7.500 4.595 4.512 4.691 . 0 0 "[ . 1 . 2]" 1
1053 1 60 LYS HA 1 63 PHE QD 3.500 . 6.700 2.222 1.893 2.671 . 0 0 "[ . 1 . 2]" 1
1054 1 60 LYS HA 1 63 PHE QE 4.500 . 8.400 3.826 2.687 4.512 . 0 0 "[ . 1 . 2]" 1
1055 1 60 LYS HA 1 64 GLU H 4.500 . 6.000 4.267 3.894 4.859 . 0 0 "[ . 1 . 2]" 1
1056 1 60 LYS HA 1 64 GLU QG 4.500 . 7.500 4.135 3.580 4.774 . 0 0 "[ . 1 . 2]" 1
1057 1 60 LYS QB 1 61 GLY H 4.500 . 7.000 2.855 2.469 3.158 . 0 0 "[ . 1 . 2]" 1
1058 1 60 LYS QB 1 61 GLY QA 4.500 . 8.000 3.703 3.510 3.852 . 0 0 "[ . 1 . 2]" 1
1059 1 60 LYS QB 1 63 PHE QD 4.500 . 9.400 4.086 3.072 4.599 . 0 0 "[ . 1 . 2]" 1
1060 1 60 LYS QB 1 64 GLU QB 4.500 . 8.000 4.487 3.604 5.274 . 0 0 "[ . 1 . 2]" 1
1061 1 60 LYS QB 1 64 GLU QG 4.500 . 8.500 2.977 1.968 3.781 . 0 0 "[ . 1 . 2]" 1
1062 1 60 LYS QD 1 61 GLY H 4.500 . 7.500 4.957 4.538 5.254 . 0 0 "[ . 1 . 2]" 1
1063 1 60 LYS QD 1 64 GLU QG 4.500 . 9.000 4.433 3.227 5.499 . 0 0 "[ . 1 . 2]" 1
1064 1 60 LYS QG 1 61 GLY H 4.500 . 7.500 4.171 4.011 4.305 . 0 0 "[ . 1 . 2]" 1
1065 1 60 LYS QG 1 63 PHE QD 4.500 . 9.900 3.854 2.940 4.573 . 0 0 "[ . 1 . 2]" 1
1066 1 60 LYS QG 1 64 GLU QG 4.500 . 9.000 4.597 2.090 5.524 . 0 0 "[ . 1 . 2]" 1
1067 1 61 GLY H 1 64 GLU H 4.500 . 6.000 4.768 4.650 5.074 . 0 0 "[ . 1 . 2]" 1
1068 1 61 GLY H 1 64 GLU QB 4.500 . 7.000 4.807 4.142 5.475 . 0 0 "[ . 1 . 2]" 1
1069 1 61 GLY H 1 64 GLU QG 4.500 . 7.500 4.496 3.926 5.036 . 0 0 "[ . 1 . 2]" 1
1070 1 61 GLY QA 1 62 LYS H 3.500 . 5.300 2.771 2.652 2.842 . 0 0 "[ . 1 . 2]" 1
1071 1 61 GLY QA 1 62 LYS QB 4.500 . 8.000 4.315 4.217 4.623 . 0 0 "[ . 1 . 2]" 1
1072 1 61 GLY QA 1 63 PHE H 4.500 . 7.000 4.090 3.884 4.331 . 0 0 "[ . 1 . 2]" 1
1073 1 61 GLY QA 1 64 GLU H 4.500 . 7.000 3.350 3.083 3.720 . 0 0 "[ . 1 . 2]" 1
1074 1 61 GLY QA 1 64 GLU HA 4.500 . 7.000 5.110 4.741 5.589 . 0 0 "[ . 1 . 2]" 1
1075 1 61 GLY QA 1 64 GLU QB 4.500 . 6.300 2.470 2.084 2.937 . 0 0 "[ . 1 . 2]" 1
1076 1 61 GLY QA 1 64 GLU QG 4.500 . 8.500 3.112 2.296 3.976 . 0 0 "[ . 1 . 2]" 1
1077 1 61 GLY QA 1 65 ASP H 4.500 . 7.000 3.878 3.410 4.482 . 0 0 "[ . 1 . 2]" 1
1078 1 61 GLY QA 1 65 ASP QB 4.500 . 8.000 4.139 3.782 4.530 . 0 0 "[ . 1 . 2]" 1
1079 1 62 LYS H 1 62 LYS QB 3.500 . 5.300 2.264 2.176 2.607 . 0 0 "[ . 1 . 2]" 1
1080 1 62 LYS H 1 62 LYS QG 4.500 . 7.500 3.799 1.909 4.050 . 0 0 "[ . 1 . 2]" 1
1081 1 62 LYS H 1 63 PHE H 3.500 . 4.300 2.633 2.462 2.768 . 0 0 "[ . 1 . 2]" 1
1082 1 62 LYS H 1 63 PHE QB 4.500 . 7.000 4.700 4.442 4.870 . 0 0 "[ . 1 . 2]" 1
1083 1 62 LYS H 1 64 GLU H 4.500 . 6.000 3.969 3.786 4.197 . 0 0 "[ . 1 . 2]" 1
1084 1 62 LYS H 1 64 GLU QB 4.500 . 7.000 4.850 4.383 5.226 . 0 0 "[ . 1 . 2]" 1
1085 1 62 LYS H 1 64 GLU QG 4.500 . 7.500 5.058 4.565 5.380 . 0 0 "[ . 1 . 2]" 1
1086 1 62 LYS H 1 65 ASP QB 4.500 . 7.000 4.811 4.400 5.515 . 0 0 "[ . 1 . 2]" 1
1087 1 62 LYS HA 1 62 LYS QG 3.500 . 5.800 2.600 2.406 3.349 . 0 0 "[ . 1 . 2]" 1
1088 1 62 LYS HA 1 65 ASP H 3.500 . 4.300 3.913 3.579 4.281 . 0 0 "[ . 1 . 2]" 1
1089 1 62 LYS HA 1 65 ASP QB 3.500 . 5.300 2.861 2.212 4.049 . 0 0 "[ . 1 . 2]" 1
1090 1 62 LYS HA 1 66 MET H 4.500 . 6.000 4.312 3.737 4.913 . 0 0 "[ . 1 . 2]" 1
1091 1 62 LYS HA 1 66 MET QG 4.500 . 7.500 4.115 3.627 4.924 . 0 0 "[ . 1 . 2]" 1
1092 1 62 LYS QB 1 63 PHE H 4.500 . 5.300 2.552 2.205 3.405 . 0 0 "[ . 1 . 2]" 1
1093 1 62 LYS QB 1 63 PHE HA 4.500 . 7.000 4.135 3.732 4.333 . 0 0 "[ . 1 . 2]" 1
1094 1 62 LYS QB 1 63 PHE QD 4.500 . 9.400 3.515 2.943 4.468 . 0 0 "[ . 1 . 2]" 1
1095 1 62 LYS QB 1 63 PHE QE 4.500 . 9.400 3.904 3.496 4.804 . 0 0 "[ . 1 . 2]" 1
1096 1 62 LYS QB 1 64 GLU H 4.500 . 7.000 4.636 4.339 5.063 . 0 0 "[ . 1 . 2]" 1
1097 1 62 LYS QB 1 66 MET QG 4.500 . 8.500 4.651 3.919 5.575 . 0 0 "[ . 1 . 2]" 1
1098 1 62 LYS QD 1 63 PHE H 4.500 . 7.500 4.380 3.386 4.768 . 0 0 "[ . 1 . 2]" 1
1099 1 62 LYS QD 1 63 PHE QD 4.500 . 9.900 4.540 3.566 5.836 . 0 0 "[ . 1 . 2]" 1
1100 1 62 LYS QD 1 63 PHE QE 4.500 . 9.900 4.124 2.789 6.169 . 0 0 "[ . 1 . 2]" 1
1101 1 62 LYS QD 1 63 PHE HZ 4.500 . 8.000 4.653 3.315 7.139 . 0 0 "[ . 1 . 2]" 1
1102 1 62 LYS QD 1 66 MET ME 4.500 . 9.000 3.753 2.247 5.643 . 0 0 "[ . 1 . 2]" 1
1103 1 62 LYS QE 1 63 PHE H 4.500 . 7.500 5.590 4.489 6.343 . 0 0 "[ . 1 . 2]" 1
1104 1 62 LYS QE 1 63 PHE HA 4.500 . 7.500 5.368 4.376 7.553 0.053 3 0 "[ . 1 . 2]" 1
1105 1 62 LYS QE 1 63 PHE QB 4.500 . 8.500 6.312 5.431 7.839 . 0 0 "[ . 1 . 2]" 1
1106 1 62 LYS QE 1 63 PHE QD 4.500 . 9.900 5.240 4.271 7.037 . 0 0 "[ . 1 . 2]" 1
1107 1 62 LYS QE 1 63 PHE QE 4.500 . 9.900 4.816 3.431 6.698 . 0 0 "[ . 1 . 2]" 1
1108 1 62 LYS QE 1 63 PHE HZ 4.500 . 8.000 5.403 3.546 7.380 . 0 0 "[ . 1 . 2]" 1
1109 1 62 LYS QE 1 66 MET QB 4.500 . 8.500 5.529 4.496 7.403 . 0 0 "[ . 1 . 2]" 1
1110 1 62 LYS QE 1 66 MET ME 3.500 . 7.300 3.416 2.583 5.473 . 0 0 "[ . 1 . 2]" 1
1111 1 62 LYS QG 1 63 PHE H 4.500 . 7.500 3.569 2.213 4.311 . 0 0 "[ . 1 . 2]" 1
1112 1 62 LYS QG 1 63 PHE HA 4.500 . 7.500 3.746 3.272 5.699 . 0 0 "[ . 1 . 2]" 1
1113 1 62 LYS QG 1 63 PHE QD 4.500 . 9.900 4.205 2.610 4.886 . 0 0 "[ . 1 . 2]" 1
1114 1 62 LYS QG 1 63 PHE QE 4.500 . 9.900 4.521 3.061 5.078 . 0 0 "[ . 1 . 2]" 1
1115 1 62 LYS QG 1 65 ASP H 4.500 . 7.500 5.354 4.570 6.024 . 0 0 "[ . 1 . 2]" 1
1116 1 62 LYS QG 1 66 MET H 4.500 . 7.500 4.644 3.864 6.459 . 0 0 "[ . 1 . 2]" 1
1117 1 62 LYS QG 1 66 MET ME 3.500 . 7.300 2.670 2.045 4.253 . 0 0 "[ . 1 . 2]" 1
1118 1 62 LYS QG 1 66 MET QG 4.500 . 9.000 3.323 2.341 5.424 . 0 0 "[ . 1 . 2]" 1
1119 1 63 PHE H 1 63 PHE QB 3.500 . 5.300 2.449 2.317 2.571 . 0 0 "[ . 1 . 2]" 1
1120 1 63 PHE H 1 63 PHE QD 3.500 . 6.700 2.507 2.052 3.040 . 0 0 "[ . 1 . 2]" 1
1121 1 63 PHE H 1 63 PHE QE 4.500 . 8.400 4.267 3.951 4.445 . 0 0 "[ . 1 . 2]" 1
1122 1 63 PHE H 1 64 GLU H 3.500 . 4.300 2.492 2.280 2.637 . 0 0 "[ . 1 . 2]" 1
1123 1 63 PHE H 1 64 GLU QB 4.500 . 7.000 4.483 4.242 4.699 . 0 0 "[ . 1 . 2]" 1
1124 1 63 PHE H 1 64 GLU QG 4.500 . 7.500 4.195 3.880 4.501 . 0 0 "[ . 1 . 2]" 1
1125 1 63 PHE H 1 65 ASP H 4.500 . 6.000 4.279 3.612 4.781 . 0 0 "[ . 1 . 2]" 1
1126 1 63 PHE H 1 66 MET ME 4.500 . 7.500 3.824 3.462 4.321 . 0 0 "[ . 1 . 2]" 1
1127 1 63 PHE HA 1 63 PHE QD 3.500 . 6.700 2.713 2.254 3.029 . 0 0 "[ . 1 . 2]" 1
1128 1 63 PHE HA 1 63 PHE QE 4.500 . 8.400 4.560 4.419 4.656 . 0 0 "[ . 1 . 2]" 1
1129 1 63 PHE HA 1 66 MET H 3.500 . 4.300 3.457 3.249 3.759 . 0 0 "[ . 1 . 2]" 1
1130 1 63 PHE HA 1 66 MET QB 4.500 . 7.000 2.870 2.573 3.124 . 0 0 "[ . 1 . 2]" 1
1131 1 63 PHE HA 1 66 MET ME 3.500 . 5.800 2.003 1.895 2.276 . 0 0 "[ . 1 . 2]" 1
1132 1 63 PHE HA 1 66 MET QG 4.500 . 7.500 3.461 2.945 3.880 . 0 0 "[ . 1 . 2]" 1
1133 1 63 PHE QB 1 64 GLU H 4.500 . 7.000 2.698 2.554 2.977 . 0 0 "[ . 1 . 2]" 1
1134 1 63 PHE QB 1 64 GLU QB 4.500 . 8.000 4.516 4.274 4.742 . 0 0 "[ . 1 . 2]" 1
1135 1 63 PHE QB 1 64 GLU QG 4.500 . 8.500 3.442 3.196 4.015 . 0 0 "[ . 1 . 2]" 1
1136 1 63 PHE QB 1 65 ASP H 4.500 . 7.000 4.884 4.216 5.423 . 0 0 "[ . 1 . 2]" 1
1137 1 63 PHE QB 1 66 MET QB 4.500 . 8.000 4.370 4.178 4.672 . 0 0 "[ . 1 . 2]" 1
1138 1 63 PHE QB 1 66 MET ME 4.500 . 6.800 3.408 3.196 3.687 . 0 0 "[ . 1 . 2]" 1
1139 1 63 PHE QB 1 66 MET QG 4.500 . 8.500 5.240 4.822 5.563 . 0 0 "[ . 1 . 2]" 1
1140 1 63 PHE QB 1 67 ALA MB 4.500 . 8.500 4.356 3.928 4.951 . 0 0 "[ . 1 . 2]" 1
1141 1 63 PHE QD 1 64 GLU H 4.500 . 8.400 4.099 3.790 4.395 . 0 0 "[ . 1 . 2]" 1
1142 1 63 PHE QD 1 66 MET QB 4.500 . 9.400 4.402 3.956 4.898 . 0 0 "[ . 1 . 2]" 1
1143 1 63 PHE QD 1 66 MET ME 3.500 . 8.200 2.445 2.044 3.163 . 0 0 "[ . 1 . 2]" 1
1144 1 63 PHE QD 1 66 MET QG 4.500 . 9.900 5.082 4.620 5.666 . 0 0 "[ . 1 . 2]" 1
1145 1 64 GLU H 1 64 GLU QB 3.500 . 5.300 2.401 2.210 2.484 . 0 0 "[ . 1 . 2]" 1
1146 1 64 GLU H 1 64 GLU QG 3.500 . 5.800 2.340 2.155 2.687 . 0 0 "[ . 1 . 2]" 1
1147 1 64 GLU H 1 65 ASP H 3.500 . 4.300 2.810 2.534 3.065 . 0 0 "[ . 1 . 2]" 1
1148 1 64 GLU H 1 67 ALA H 4.500 . 6.000 4.826 4.458 5.235 . 0 0 "[ . 1 . 2]" 1
1149 1 64 GLU HA 1 64 GLU QG 3.500 . 5.800 2.567 2.286 2.916 . 0 0 "[ . 1 . 2]" 1
1150 1 64 GLU HA 1 66 MET H 4.500 . 6.000 4.522 4.239 4.925 . 0 0 "[ . 1 . 2]" 1
1151 1 64 GLU HA 1 67 ALA MB 3.500 . 5.800 2.766 2.243 3.671 . 0 0 "[ . 1 . 2]" 1
1152 1 64 GLU QB 1 65 ASP H 3.500 . 5.300 2.571 1.953 3.377 . 0 0 "[ . 1 . 2]" 1
1153 1 64 GLU QB 1 65 ASP HA 4.500 . 7.000 3.930 3.733 4.098 . 0 0 "[ . 1 . 2]" 1
1154 1 64 GLU QB 1 67 ALA MB 4.500 . 8.500 4.150 3.649 4.971 . 0 0 "[ . 1 . 2]" 1
1155 1 64 GLU QG 1 65 ASP H 4.500 . 7.500 4.116 3.754 4.641 . 0 0 "[ . 1 . 2]" 1
1156 1 64 GLU QG 1 67 ALA MB 4.500 . 9.000 4.530 3.787 5.443 . 0 0 "[ . 1 . 2]" 1
1157 1 65 ASP H 1 65 ASP QB 3.500 . 5.300 2.310 2.208 2.444 . 0 0 "[ . 1 . 2]" 1
1158 1 65 ASP H 1 66 MET H 3.500 . 4.300 2.752 1.965 3.258 . 0 0 "[ . 1 . 2]" 1
1159 1 65 ASP H 1 66 MET QB 4.500 . 7.000 4.742 3.980 5.254 . 0 0 "[ . 1 . 2]" 1
1160 1 65 ASP H 1 66 MET QG 4.500 . 7.500 4.539 3.652 5.244 . 0 0 "[ . 1 . 2]" 1
1161 1 65 ASP HA 1 66 MET HA 4.500 . 6.000 4.757 4.697 4.803 . 0 0 "[ . 1 . 2]" 1
1162 1 65 ASP HA 1 68 LYS H 4.500 . 6.000 3.584 3.160 4.094 . 0 0 "[ . 1 . 2]" 1
1163 1 65 ASP HA 1 68 LYS QB 3.500 . 5.300 3.291 2.453 4.302 . 0 0 "[ . 1 . 2]" 1
1164 1 65 ASP HA 1 68 LYS QD 3.500 . 5.800 2.699 1.862 3.973 . 0 0 "[ . 1 . 2]" 1
1165 1 65 ASP HA 1 68 LYS QE 4.500 . 7.500 3.102 1.805 4.534 . 0 0 "[ . 1 . 2]" 1
1166 1 65 ASP HA 1 68 LYS QG 4.500 . 7.500 3.030 2.321 4.031 . 0 0 "[ . 1 . 2]" 1
1167 1 65 ASP HA 1 69 ALA H 4.500 . 6.000 5.085 4.308 5.907 . 0 0 "[ . 1 . 2]" 1
1168 1 65 ASP QB 1 66 MET H 4.500 . 7.000 2.511 2.313 2.937 . 0 0 "[ . 1 . 2]" 1
1169 1 65 ASP QB 1 66 MET HA 4.500 . 7.000 4.178 4.071 4.283 . 0 0 "[ . 1 . 2]" 1
1170 1 65 ASP QB 1 66 MET QB 4.500 . 8.000 4.447 4.298 4.769 . 0 0 "[ . 1 . 2]" 1
1171 1 65 ASP QB 1 67 ALA H 4.500 . 7.000 4.621 4.408 4.800 . 0 0 "[ . 1 . 2]" 1
1172 1 65 ASP QB 1 68 LYS QB 4.500 . 8.000 4.857 4.302 5.766 . 0 0 "[ . 1 . 2]" 1
1173 1 65 ASP QB 1 68 LYS QD 4.500 . 8.500 4.260 3.201 5.641 . 0 0 "[ . 1 . 2]" 1
1174 1 65 ASP QB 1 68 LYS QG 4.500 . 8.500 4.790 4.321 5.723 . 0 0 "[ . 1 . 2]" 1
1175 1 66 MET H 1 66 MET QB 3.500 . 5.300 2.424 2.362 2.486 . 0 0 "[ . 1 . 2]" 1
1176 1 66 MET H 1 66 MET QG 3.500 . 5.800 2.343 2.174 2.534 . 0 0 "[ . 1 . 2]" 1
1177 1 66 MET H 1 67 ALA H 3.500 . 4.300 2.622 2.451 2.739 . 0 0 "[ . 1 . 2]" 1
1178 1 66 MET H 1 68 LYS H 4.500 . 6.000 4.104 3.981 4.475 . 0 0 "[ . 1 . 2]" 1
1179 1 66 MET H 1 69 ALA H 4.500 . 6.000 5.116 4.744 5.463 . 0 0 "[ . 1 . 2]" 1
1180 1 66 MET HA 1 66 MET ME 4.500 . 7.500 4.441 4.396 4.479 . 0 0 "[ . 1 . 2]" 1
1181 1 66 MET HA 1 66 MET QG 3.500 . 5.800 2.375 2.316 2.432 . 0 0 "[ . 1 . 2]" 1
1182 1 66 MET HA 1 67 ALA HA 4.500 . 6.000 4.786 4.709 4.881 . 0 0 "[ . 1 . 2]" 1
1183 1 66 MET HA 1 67 ALA MB 4.500 . 7.500 4.995 4.951 5.029 . 0 0 "[ . 1 . 2]" 1
1184 1 66 MET HA 1 69 ALA H 4.500 . 6.000 3.420 3.191 3.616 . 0 0 "[ . 1 . 2]" 1
1185 1 66 MET HA 1 69 ALA MB 3.500 . 5.800 3.035 2.549 3.455 . 0 0 "[ . 1 . 2]" 1
1186 1 66 MET HA 1 70 ASP H 4.500 . 6.000 4.676 4.134 5.145 . 0 0 "[ . 1 . 2]" 1
1187 1 66 MET HA 1 70 ASP QB 4.500 . 7.000 5.069 4.486 5.776 . 0 0 "[ . 1 . 2]" 1
1188 1 66 MET QB 1 66 MET ME 3.500 . 6.800 2.030 1.997 2.074 . 0 0 "[ . 1 . 2]" 1
1189 1 66 MET QB 1 67 ALA H 4.500 . 7.000 2.750 2.577 2.964 . 0 0 "[ . 1 . 2]" 1
1190 1 66 MET QB 1 67 ALA HA 4.500 . 7.000 3.928 3.858 3.977 . 0 0 "[ . 1 . 2]" 1
1191 1 66 MET QB 1 67 ALA MB 4.500 . 8.500 3.923 3.769 4.113 . 0 0 "[ . 1 . 2]" 1
1192 1 66 MET QB 1 68 LYS H 4.500 . 7.000 4.607 4.527 4.851 . 0 0 "[ . 1 . 2]" 1
1193 1 66 MET QG 1 67 ALA H 4.500 . 7.500 4.173 4.111 4.295 . 0 0 "[ . 1 . 2]" 1
1194 1 67 ALA H 1 67 ALA MB 2.500 . 4.900 2.235 2.213 2.258 . 0 0 "[ . 1 . 2]" 1
1195 1 67 ALA H 1 68 LYS H 3.500 . 4.300 2.609 2.465 2.785 . 0 0 "[ . 1 . 2]" 1
1196 1 67 ALA H 1 68 LYS HA 4.500 . 6.000 5.215 5.107 5.379 . 0 0 "[ . 1 . 2]" 1
1197 1 67 ALA H 1 68 LYS QB 4.500 . 7.000 4.693 4.513 4.915 . 0 0 "[ . 1 . 2]" 1
1198 1 67 ALA H 1 68 LYS QG 4.500 . 7.500 4.142 3.848 5.527 . 0 0 "[ . 1 . 2]" 1
1199 1 67 ALA H 1 70 ASP H 4.500 . 6.000 4.785 4.598 5.103 . 0 0 "[ . 1 . 2]" 1
1200 1 67 ALA H 1 70 ASP QB 4.500 . 7.000 4.645 4.288 5.236 . 0 0 "[ . 1 . 2]" 1
1201 1 67 ALA HA 1 70 ASP H 3.500 . 4.300 3.186 2.781 3.532 . 0 0 "[ . 1 . 2]" 1
1202 1 67 ALA HA 1 70 ASP QB 3.500 . 5.300 2.366 1.888 2.969 . 0 0 "[ . 1 . 2]" 1
1203 1 67 ALA MB 1 68 LYS H 3.500 . 5.800 2.786 2.565 2.985 . 0 0 "[ . 1 . 2]" 1
1204 1 67 ALA MB 1 69 ALA H 4.500 . 7.500 4.443 4.271 4.646 . 0 0 "[ . 1 . 2]" 1
1205 1 67 ALA MB 1 70 ASP H 4.500 . 7.500 4.339 4.111 4.611 . 0 0 "[ . 1 . 2]" 1
1206 1 67 ALA MB 1 70 ASP QB 4.500 . 8.500 3.605 2.967 4.210 . 0 0 "[ . 1 . 2]" 1
1207 1 67 ALA MB 1 71 LYS H 4.500 . 7.500 5.065 4.191 5.831 . 0 0 "[ . 1 . 2]" 1
1208 1 68 LYS H 1 68 LYS QB 2.500 . 4.400 2.447 2.244 2.560 . 0 0 "[ . 1 . 2]" 1
1209 1 68 LYS H 1 68 LYS QE 4.500 . 7.500 4.206 3.334 5.084 . 0 0 "[ . 1 . 2]" 1
1210 1 68 LYS H 1 68 LYS QG 3.500 . 5.800 2.290 2.012 3.545 . 0 0 "[ . 1 . 2]" 1
1211 1 68 LYS H 1 69 ALA H 3.500 . 4.300 2.520 2.412 2.699 . 0 0 "[ . 1 . 2]" 1
1212 1 68 LYS H 1 69 ALA MB 4.500 . 7.500 4.250 4.138 4.439 . 0 0 "[ . 1 . 2]" 1
1213 1 68 LYS H 1 70 ASP H 4.500 . 6.000 3.826 3.619 4.000 . 0 0 "[ . 1 . 2]" 1
1214 1 68 LYS H 1 71 LYS QB 4.500 . 7.000 5.762 4.626 6.434 . 0 0 "[ . 1 . 2]" 1
1215 1 68 LYS HA 1 68 LYS QG 3.500 . 5.800 2.463 2.379 2.611 . 0 0 "[ . 1 . 2]" 1
1216 1 68 LYS QB 1 68 LYS QD 2.500 . 5.900 2.221 2.080 2.412 . 0 0 "[ . 1 . 2]" 1
1217 1 68 LYS QB 1 69 ALA H 3.500 . 5.300 2.857 2.554 3.100 . 0 0 "[ . 1 . 2]" 1
1218 1 68 LYS QB 1 69 ALA MB 4.500 . 8.500 3.766 3.550 3.898 . 0 0 "[ . 1 . 2]" 1
1219 1 68 LYS QB 1 70 ASP H 4.500 . 7.000 4.561 4.385 4.800 . 0 0 "[ . 1 . 2]" 1
1220 1 68 LYS QD 1 69 ALA H 4.500 . 7.500 5.023 4.195 5.630 . 0 0 "[ . 1 . 2]" 1
1221 1 68 LYS QG 1 69 ALA H 4.500 . 7.500 4.149 3.863 4.659 . 0 0 "[ . 1 . 2]" 1
1222 1 69 ALA H 1 69 ALA MB 2.500 . 4.900 2.285 2.247 2.311 . 0 0 "[ . 1 . 2]" 1
1223 1 69 ALA H 1 70 ASP H 3.500 . 4.300 2.259 2.115 2.510 . 0 0 "[ . 1 . 2]" 1
1224 1 69 ALA H 1 70 ASP HA 4.500 . 6.000 4.873 4.741 5.130 . 0 0 "[ . 1 . 2]" 1
1225 1 69 ALA H 1 70 ASP QB 4.500 . 7.000 4.002 3.789 4.295 . 0 0 "[ . 1 . 2]" 1
1226 1 69 ALA H 1 71 LYS H 4.500 . 6.000 3.980 3.668 4.263 . 0 0 "[ . 1 . 2]" 1
1227 1 69 ALA H 1 71 LYS QB 4.500 . 7.000 5.459 4.622 5.827 . 0 0 "[ . 1 . 2]" 1
1228 1 69 ALA HA 1 71 LYS H 4.500 . 6.000 3.790 3.434 4.311 . 0 0 "[ . 1 . 2]" 1
1229 1 69 ALA MB 1 70 ASP H 3.500 . 5.800 2.951 2.604 3.125 . 0 0 "[ . 1 . 2]" 1
1230 1 69 ALA MB 1 70 ASP HA 4.500 . 7.500 3.921 3.846 3.972 . 0 0 "[ . 1 . 2]" 1
1231 1 69 ALA MB 1 70 ASP QB 4.500 . 8.500 3.980 3.742 4.365 . 0 0 "[ . 1 . 2]" 1
1232 1 70 ASP H 1 70 ASP QB 3.500 . 5.300 2.268 2.148 2.331 . 0 0 "[ . 1 . 2]" 1
1233 1 70 ASP H 1 71 LYS H 3.500 . 4.300 2.469 2.284 2.655 . 0 0 "[ . 1 . 2]" 1
1234 1 70 ASP H 1 71 LYS QD 4.500 . 7.500 5.524 5.083 6.598 . 0 0 "[ . 1 . 2]" 1
1235 1 70 ASP H 1 72 ALA H 4.500 . 6.000 4.214 3.823 4.524 . 0 0 "[ . 1 . 2]" 1
1236 1 70 ASP HA 1 72 ALA H 4.500 . 6.000 3.517 3.244 4.370 . 0 0 "[ . 1 . 2]" 1
1237 1 70 ASP HA 1 72 ALA MB 4.500 . 7.500 4.003 3.730 4.878 . 0 0 "[ . 1 . 2]" 1
1238 1 70 ASP HA 1 73 ARG H 4.500 . 6.000 4.190 3.708 4.538 . 0 0 "[ . 1 . 2]" 1
1239 1 70 ASP HA 1 73 ARG QB 4.500 . 7.000 4.556 3.706 5.504 . 0 0 "[ . 1 . 2]" 1
1240 1 70 ASP HA 1 73 ARG QG 4.500 . 7.500 3.601 2.048 4.985 . 0 0 "[ . 1 . 2]" 1
1241 1 70 ASP QB 1 71 LYS H 3.500 . 5.300 3.134 2.686 3.669 . 0 0 "[ . 1 . 2]" 1
1242 1 70 ASP QB 1 71 LYS HA 4.500 . 7.000 4.211 4.061 4.894 . 0 0 "[ . 1 . 2]" 1
1243 1 70 ASP QB 1 71 LYS QB 4.500 . 8.000 4.479 4.204 5.187 . 0 0 "[ . 1 . 2]" 1
1244 1 70 ASP QB 1 72 ALA H 4.500 . 7.000 4.634 4.481 5.039 . 0 0 "[ . 1 . 2]" 1
1245 1 71 LYS H 1 71 LYS QB 3.500 . 5.300 2.490 2.299 2.590 . 0 0 "[ . 1 . 2]" 1
1246 1 71 LYS H 1 71 LYS QD 4.500 . 7.500 3.901 3.568 4.756 . 0 0 "[ . 1 . 2]" 1
1247 1 71 LYS H 1 71 LYS QG 3.500 . 5.800 2.311 1.994 4.003 . 0 0 "[ . 1 . 2]" 1
1248 1 71 LYS H 1 72 ALA H 3.500 . 4.300 2.569 2.228 2.753 . 0 0 "[ . 1 . 2]" 1
1249 1 71 LYS H 1 72 ALA HA 4.500 . 6.000 5.113 4.911 5.292 . 0 0 "[ . 1 . 2]" 1
1250 1 71 LYS H 1 72 ALA MB 4.500 . 7.500 4.215 3.885 4.382 . 0 0 "[ . 1 . 2]" 1
1251 1 71 LYS H 1 73 ARG QB 4.500 . 7.000 6.240 5.471 7.082 0.082 20 0 "[ . 1 . 2]" 1
1252 1 71 LYS HA 1 74 TYR QD 4.500 . 8.400 2.623 1.927 4.619 . 0 0 "[ . 1 . 2]" 1
1253 1 71 LYS HA 1 75 GLU QG 4.500 . 7.500 4.032 3.439 5.790 . 0 0 "[ . 1 . 2]" 1
1254 1 71 LYS QB 1 72 ALA H 4.500 . 7.000 3.628 2.430 3.780 . 0 0 "[ . 1 . 2]" 1
1255 1 71 LYS QB 1 74 TYR QE 3.500 . 7.700 2.644 1.956 5.493 . 0 0 "[ . 1 . 2]" 1
1256 1 71 LYS QB 1 75 GLU QG 4.500 . 8.500 3.047 2.399 4.508 . 0 0 "[ . 1 . 2]" 1
1257 1 71 LYS QD 1 72 ALA H 4.500 . 7.500 4.734 4.455 5.025 . 0 0 "[ . 1 . 2]" 1
1258 1 71 LYS QD 1 74 TYR QE 4.500 . 9.900 4.297 3.094 6.325 . 0 0 "[ . 1 . 2]" 1
1259 1 71 LYS QD 1 75 GLU QG 4.500 . 9.000 3.894 3.088 5.244 . 0 0 "[ . 1 . 2]" 1
1260 1 71 LYS QG 1 72 ALA H 4.500 . 7.500 2.758 2.476 3.631 . 0 0 "[ . 1 . 2]" 1
1261 1 71 LYS QG 1 72 ALA HA 4.500 . 7.500 3.345 3.028 3.729 . 0 0 "[ . 1 . 2]" 1
1262 1 71 LYS QG 1 74 TYR QD 4.500 . 9.900 4.895 3.741 5.726 . 0 0 "[ . 1 . 2]" 1
1263 1 71 LYS QG 1 74 TYR QE 4.500 . 9.900 4.366 1.924 7.055 . 0 0 "[ . 1 . 2]" 1
1264 1 71 LYS QG 1 75 GLU QG 3.500 . 7.300 3.293 2.350 5.253 . 0 0 "[ . 1 . 2]" 1
1265 1 72 ALA H 1 72 ALA MB 2.500 . 4.900 2.241 2.210 2.306 . 0 0 "[ . 1 . 2]" 1
1266 1 72 ALA H 1 73 ARG H 3.500 . 4.300 2.806 2.512 3.243 . 0 0 "[ . 1 . 2]" 1
1267 1 72 ALA H 1 73 ARG QB 4.500 . 7.000 4.902 4.231 5.509 . 0 0 "[ . 1 . 2]" 1
1268 1 72 ALA H 1 73 ARG QG 4.500 . 7.500 4.053 3.664 4.611 . 0 0 "[ . 1 . 2]" 1
1269 1 72 ALA H 1 74 TYR H 4.500 . 6.000 4.427 3.975 4.704 . 0 0 "[ . 1 . 2]" 1
1270 1 72 ALA H 1 75 GLU QB 4.500 . 7.000 5.156 4.694 5.498 . 0 0 "[ . 1 . 2]" 1
1271 1 72 ALA HA 1 75 GLU H 4.500 . 6.000 3.755 3.306 4.262 . 0 0 "[ . 1 . 2]" 1
1272 1 72 ALA HA 1 75 GLU QB 3.500 . 5.300 2.953 2.538 3.345 . 0 0 "[ . 1 . 2]" 1
1273 1 72 ALA HA 1 75 GLU QG 4.500 . 7.500 3.495 1.946 5.274 . 0 0 "[ . 1 . 2]" 1
1274 1 72 ALA HA 1 76 ARG H 4.500 . 6.000 4.116 3.841 4.770 . 0 0 "[ . 1 . 2]" 1
1275 1 72 ALA MB 1 73 ARG H 3.500 . 5.800 3.038 1.900 3.319 . 0 0 "[ . 1 . 2]" 1
1276 1 72 ALA MB 1 73 ARG HA 4.500 . 7.500 3.932 3.706 4.065 . 0 0 "[ . 1 . 2]" 1
1277 1 72 ALA MB 1 73 ARG QB 4.500 . 8.500 4.093 3.892 4.229 . 0 0 "[ . 1 . 2]" 1
1278 1 72 ALA MB 1 75 GLU QB 4.500 . 8.500 4.285 3.797 4.709 . 0 0 "[ . 1 . 2]" 1
1279 1 73 ARG H 1 73 ARG QB 3.500 . 5.300 2.827 2.396 3.092 . 0 0 "[ . 1 . 2]" 1
1280 1 73 ARG H 1 73 ARG QD 4.500 . 7.500 3.637 2.673 4.314 . 0 0 "[ . 1 . 2]" 1
1281 1 73 ARG H 1 73 ARG HE 4.500 . 6.000 4.945 4.611 5.240 . 0 0 "[ . 1 . 2]" 1
1282 1 73 ARG H 1 73 ARG QG 4.500 . 7.500 2.188 1.967 2.540 . 0 0 "[ . 1 . 2]" 1
1283 1 73 ARG H 1 74 TYR H 3.500 . 4.300 2.353 1.903 3.474 . 0 0 "[ . 1 . 2]" 1
1284 1 73 ARG HA 1 73 ARG QD 4.500 . 7.500 4.196 3.772 4.600 . 0 0 "[ . 1 . 2]" 1
1285 1 73 ARG HA 1 73 ARG HE 4.500 . 6.000 4.432 3.956 4.745 . 0 0 "[ . 1 . 2]" 1
1286 1 73 ARG HA 1 73 ARG QG 3.500 . 5.800 3.398 3.310 3.508 . 0 0 "[ . 1 . 2]" 1
1287 1 73 ARG QB 1 73 ARG HE 4.500 . 7.000 2.101 1.809 2.378 . 0 0 "[ . 1 . 2]" 1
1288 1 73 ARG QB 1 74 TYR H 4.500 . 7.000 3.579 3.154 3.800 . 0 0 "[ . 1 . 2]" 1
1289 1 73 ARG QD 1 74 TYR H 3.500 . 5.800 3.211 1.971 4.264 . 0 0 "[ . 1 . 2]" 1
1290 1 73 ARG QD 1 74 TYR HA 4.500 . 5.800 3.931 2.822 5.493 . 0 0 "[ . 1 . 2]" 1
1291 1 73 ARG QD 1 74 TYR QD 4.500 . 9.900 3.674 2.119 5.053 . 0 0 "[ . 1 . 2]" 1
1292 1 73 ARG QD 1 74 TYR QE 4.500 . 9.900 5.506 3.806 6.946 . 0 0 "[ . 1 . 2]" 1
1293 1 73 ARG QD 1 77 GLU H 4.500 . 7.500 6.640 5.758 7.821 0.321 16 0 "[ . 1 . 2]" 1
1294 1 73 ARG QD 1 77 GLU QG 4.500 . 9.000 5.084 3.924 6.469 . 0 0 "[ . 1 . 2]" 1
1295 1 73 ARG HE 1 74 TYR H 4.500 . 6.000 5.045 3.780 5.823 . 0 0 "[ . 1 . 2]" 1
1296 1 73 ARG HE 1 74 TYR HA 4.500 . 6.000 5.374 3.693 6.487 0.487 18 0 "[ . 1 . 2]" 1
1297 1 73 ARG HE 1 74 TYR QD 4.500 . 8.400 6.009 4.467 7.511 . 0 0 "[ . 1 . 2]" 1
1298 1 73 ARG HE 1 77 GLU QG 4.500 . 7.500 5.576 4.134 7.056 . 0 0 "[ . 1 . 2]" 1
1299 1 73 ARG QG 1 74 TYR H 3.500 . 5.800 2.550 1.721 3.577 . 0 0 "[ . 1 . 2]" 1
1300 1 73 ARG QG 1 74 TYR QE 4.500 . 9.900 5.390 3.879 7.827 . 0 0 "[ . 1 . 2]" 1
1301 1 74 TYR H 1 74 TYR QD 4.500 . 8.400 2.818 2.299 4.163 . 0 0 "[ . 1 . 2]" 1
1302 1 74 TYR H 1 74 TYR QE 4.500 . 8.400 4.666 4.154 6.206 . 0 0 "[ . 1 . 2]" 1
1303 1 74 TYR HA 1 74 TYR QD 3.500 . 6.700 3.605 2.819 3.759 . 0 0 "[ . 1 . 2]" 1
1304 1 74 TYR HA 1 74 TYR QE 4.500 . 8.400 5.545 4.747 5.694 . 0 0 "[ . 1 . 2]" 1
1305 1 74 TYR HA 1 77 GLU QB 3.500 . 5.300 2.749 2.252 3.235 . 0 0 "[ . 1 . 2]" 1
1306 1 74 TYR HA 1 77 GLU QG 4.500 . 7.500 2.855 1.985 3.646 . 0 0 "[ . 1 . 2]" 1
1307 1 74 TYR QB 1 75 GLU H 4.500 . 7.000 3.435 2.432 3.790 . 0 0 "[ . 1 . 2]" 1
1308 1 74 TYR QB 1 75 GLU HA 4.500 . 7.000 4.554 4.128 4.784 . 0 0 "[ . 1 . 2]" 1
1309 1 74 TYR QB 1 77 GLU QB 4.500 . 8.000 3.806 2.921 4.700 . 0 0 "[ . 1 . 2]" 1
1310 1 74 TYR QD 1 75 GLU H 3.500 . 6.700 3.186 2.632 3.720 . 0 0 "[ . 1 . 2]" 1
1311 1 74 TYR QD 1 75 GLU HA 4.500 . 8.400 3.410 2.906 3.922 . 0 0 "[ . 1 . 2]" 1
1312 1 74 TYR QD 1 75 GLU QB 4.500 . 9.400 4.548 3.755 5.133 . 0 0 "[ . 1 . 2]" 1
1313 1 74 TYR QD 1 75 GLU QG 4.500 . 9.900 3.410 2.535 4.970 . 0 0 "[ . 1 . 2]" 1
1314 1 74 TYR QD 1 76 ARG H 4.500 . 8.400 5.621 5.170 5.855 . 0 0 "[ . 1 . 2]" 1
1315 1 74 TYR QD 1 77 GLU H 4.500 . 8.400 5.271 4.893 5.705 . 0 0 "[ . 1 . 2]" 1
1316 1 74 TYR QD 1 77 GLU QB 4.500 . 9.400 4.534 3.987 4.966 . 0 0 "[ . 1 . 2]" 1
1317 1 74 TYR QD 1 78 MET QB 4.500 . 9.400 3.377 2.603 4.187 . 0 0 "[ . 1 . 2]" 1
1318 1 74 TYR QE 1 75 GLU H 4.500 . 8.400 4.326 3.804 5.359 . 0 0 "[ . 1 . 2]" 1
1319 1 74 TYR QE 1 75 GLU HA 4.500 . 8.400 4.009 3.524 4.385 . 0 0 "[ . 1 . 2]" 1
1320 1 74 TYR QE 1 75 GLU QB 4.500 . 9.400 4.851 3.438 5.856 . 0 0 "[ . 1 . 2]" 1
1321 1 74 TYR QE 1 75 GLU QG 4.500 . 9.900 3.260 2.702 4.522 . 0 0 "[ . 1 . 2]" 1
1322 1 74 TYR QE 1 78 MET QG 4.500 . 9.900 4.551 3.435 6.794 . 0 0 "[ . 1 . 2]" 1
1323 1 75 GLU H 1 75 GLU QB 3.500 . 5.300 2.466 2.221 2.565 . 0 0 "[ . 1 . 2]" 1
1324 1 75 GLU H 1 75 GLU QG 3.500 . 5.800 2.302 1.983 3.947 . 0 0 "[ . 1 . 2]" 1
1325 1 75 GLU H 1 76 ARG H 3.500 . 4.300 3.102 2.888 3.209 . 0 0 "[ . 1 . 2]" 1
1326 1 75 GLU HA 1 75 GLU QG 3.500 . 5.800 2.417 2.313 2.887 . 0 0 "[ . 1 . 2]" 1
1327 1 75 GLU HA 1 77 GLU H 4.500 . 6.000 4.140 3.596 4.777 . 0 0 "[ . 1 . 2]" 1
1328 1 75 GLU HA 1 79 LYS H 4.500 . 6.000 3.924 3.674 4.134 . 0 0 "[ . 1 . 2]" 1
1329 1 75 GLU QB 1 76 ARG H 3.500 . 5.300 2.257 2.019 2.707 . 0 0 "[ . 1 . 2]" 1
1330 1 75 GLU QG 1 76 ARG H 4.500 . 7.500 4.023 3.870 4.193 . 0 0 "[ . 1 . 2]" 1
1331 1 76 ARG H 1 76 ARG QB 3.500 . 5.300 2.413 2.272 2.758 . 0 0 "[ . 1 . 2]" 1
1332 1 76 ARG H 1 76 ARG QD 4.500 . 7.500 3.953 3.687 4.276 . 0 0 "[ . 1 . 2]" 1
1333 1 76 ARG H 1 76 ARG QG 4.500 . 7.500 2.266 1.681 2.709 . 0 0 "[ . 1 . 2]" 1
1334 1 76 ARG H 1 77 GLU H 3.500 . 4.300 3.006 2.747 3.241 . 0 0 "[ . 1 . 2]" 1
1335 1 76 ARG H 1 77 GLU QG 4.500 . 7.500 4.594 3.899 4.879 . 0 0 "[ . 1 . 2]" 1
1336 1 76 ARG HA 1 76 ARG QB 2.500 . 4.400 2.175 2.160 2.268 . 0 0 "[ . 1 . 2]" 1
1337 1 76 ARG HA 1 76 ARG QD 4.500 . 7.500 4.443 4.230 4.566 . 0 0 "[ . 1 . 2]" 1
1338 1 76 ARG QB 1 76 ARG HE 4.500 . 7.000 2.550 1.684 3.969 . 0 0 "[ . 1 . 2]" 1
1339 1 76 ARG QD 1 77 GLU H 4.500 . 7.500 4.334 3.767 4.943 . 0 0 "[ . 1 . 2]" 1
1340 1 76 ARG QG 1 77 GLU H 4.500 . 7.500 2.380 1.671 3.475 . 0 0 "[ . 1 . 2]" 1
1341 1 76 ARG QG 1 77 GLU QG 4.500 . 9.000 2.426 2.028 4.300 . 0 0 "[ . 1 . 2]" 1
1342 1 77 GLU H 1 77 GLU QB 3.500 . 5.300 2.432 2.319 2.676 . 0 0 "[ . 1 . 2]" 1
1343 1 77 GLU H 1 77 GLU QG 3.500 . 5.800 2.390 1.915 2.772 . 0 0 "[ . 1 . 2]" 1
1344 1 77 GLU H 1 78 MET HA 4.500 . 6.000 5.144 4.749 5.502 . 0 0 "[ . 1 . 2]" 1
1345 1 77 GLU H 1 79 LYS H 4.500 . 6.000 4.074 3.731 4.780 . 0 0 "[ . 1 . 2]" 1
1346 1 77 GLU H 1 80 THR MG 4.500 . 7.500 4.819 3.938 6.612 . 0 0 "[ . 1 . 2]" 1
1347 1 77 GLU HA 1 77 GLU QG 3.500 . 5.800 2.908 2.348 3.140 . 0 0 "[ . 1 . 2]" 1
1348 1 77 GLU HA 1 80 THR H 4.500 . 6.000 3.802 3.525 4.271 . 0 0 "[ . 1 . 2]" 1
1349 1 77 GLU HA 1 80 THR MG 3.500 . 5.800 2.846 2.026 4.815 . 0 0 "[ . 1 . 2]" 1
1350 1 77 GLU HA 1 81 TYR H 4.500 . 6.000 4.669 4.108 5.369 . 0 0 "[ . 1 . 2]" 1
1351 1 77 GLU QB 1 78 MET HA 4.500 . 7.000 3.869 3.735 3.981 . 0 0 "[ . 1 . 2]" 1
1352 1 77 GLU QG 1 80 THR MG 4.500 . 9.000 4.918 3.751 6.553 . 0 0 "[ . 1 . 2]" 1
1353 1 78 MET H 1 78 MET QB 3.500 . 5.300 2.268 2.222 2.437 . 0 0 "[ . 1 . 2]" 1
1354 1 78 MET H 1 78 MET ME 4.500 . 7.500 5.168 3.976 5.884 . 0 0 "[ . 1 . 2]" 1
1355 1 78 MET H 1 78 MET QG 4.500 . 7.500 3.863 2.353 4.051 . 0 0 "[ . 1 . 2]" 1
1356 1 78 MET H 1 79 LYS H 3.500 . 4.300 2.583 2.391 2.856 . 0 0 "[ . 1 . 2]" 1
1357 1 78 MET H 1 79 LYS QE 4.500 . 7.500 5.786 5.340 6.988 . 0 0 "[ . 1 . 2]" 1
1358 1 78 MET H 1 79 LYS QG 4.500 . 7.500 4.006 3.634 4.286 . 0 0 "[ . 1 . 2]" 1
1359 1 78 MET H 1 80 THR H 4.500 . 6.000 3.986 3.763 4.191 . 0 0 "[ . 1 . 2]" 1
1360 1 78 MET H 1 80 THR MG 4.500 . 7.500 4.865 4.088 6.584 . 0 0 "[ . 1 . 2]" 1
1361 1 78 MET H 1 81 TYR QB 4.500 . 7.000 4.661 4.327 5.023 . 0 0 "[ . 1 . 2]" 1
1362 1 78 MET HA 1 78 MET ME 3.500 . 5.800 3.452 1.820 4.611 . 0 0 "[ . 1 . 2]" 1
1363 1 78 MET HA 1 78 MET QG 3.500 . 5.800 2.757 2.377 3.072 . 0 0 "[ . 1 . 2]" 1
1364 1 78 MET HA 1 81 TYR H 3.500 . 4.300 3.358 2.965 3.717 . 0 0 "[ . 1 . 2]" 1
1365 1 78 MET HA 1 81 TYR QB 3.500 . 5.300 2.596 1.983 3.396 . 0 0 "[ . 1 . 2]" 1
1366 1 78 MET HA 1 82 ILE MD 4.500 . 7.500 6.737 5.714 7.532 0.032 7 0 "[ . 1 . 2]" 1
1367 1 78 MET QB 1 79 LYS H 4.500 . 7.000 2.513 2.081 2.821 . 0 0 "[ . 1 . 2]" 1
1368 1 78 MET ME 1 79 LYS HA 4.500 . 7.500 4.939 3.983 6.402 . 0 0 "[ . 1 . 2]" 1
1369 1 78 MET ME 1 81 TYR H 4.500 . 7.500 5.121 3.417 6.515 . 0 0 "[ . 1 . 2]" 1
1370 1 78 MET ME 1 81 TYR QB 4.500 . 8.500 4.098 2.286 5.651 . 0 0 "[ . 1 . 2]" 1
1371 1 78 MET ME 1 81 TYR QD 3.500 . 8.200 3.781 2.100 5.343 . 0 0 "[ . 1 . 2]" 1
1372 1 78 MET ME 1 81 TYR QE 4.500 . 9.900 4.919 3.494 6.535 . 0 0 "[ . 1 . 2]" 1
1373 1 78 MET ME 1 82 ILE H 4.500 . 7.500 6.508 5.028 7.822 0.322 16 0 "[ . 1 . 2]" 1
1374 1 78 MET ME 1 82 ILE MD 4.500 . 9.000 6.046 4.491 8.107 . 0 0 "[ . 1 . 2]" 1
1375 1 78 MET ME 1 83 PRO QD 4.500 . 8.500 3.775 2.252 5.484 . 0 0 "[ . 1 . 2]" 1
1376 1 78 MET QG 1 80 THR MG 4.500 . 9.000 6.267 5.510 7.458 . 0 0 "[ . 1 . 2]" 1
1377 1 78 MET QG 1 81 TYR H 4.500 . 7.500 4.839 4.353 5.604 . 0 0 "[ . 1 . 2]" 1
1378 1 78 MET QG 1 81 TYR QD 4.500 . 9.900 4.785 2.788 5.898 . 0 0 "[ . 1 . 2]" 1
1379 1 79 LYS H 1 79 LYS QB 3.500 . 5.300 2.508 2.375 2.630 . 0 0 "[ . 1 . 2]" 1
1380 1 79 LYS H 1 79 LYS QD 3.500 . 5.800 3.891 3.661 4.082 . 0 0 "[ . 1 . 2]" 1
1381 1 79 LYS H 1 79 LYS QE 4.500 . 7.500 4.564 4.286 5.156 . 0 0 "[ . 1 . 2]" 1
1382 1 79 LYS H 1 79 LYS QG 4.500 . 7.500 2.306 2.072 2.503 . 0 0 "[ . 1 . 2]" 1
1383 1 79 LYS H 1 80 THR H 3.500 . 4.300 2.738 2.590 2.905 . 0 0 "[ . 1 . 2]" 1
1384 1 79 LYS H 1 80 THR MG 4.500 . 7.500 4.613 3.960 6.131 . 0 0 "[ . 1 . 2]" 1
1385 1 79 LYS HA 1 81 TYR H 4.500 . 6.000 4.083 3.582 4.664 . 0 0 "[ . 1 . 2]" 1
1386 1 79 LYS QB 1 80 THR H 3.500 . 5.300 3.724 3.589 3.902 . 0 0 "[ . 1 . 2]" 1
1387 1 79 LYS QB 1 80 THR HB 4.500 . 7.000 5.050 4.614 5.825 . 0 0 "[ . 1 . 2]" 1
1388 1 79 LYS QD 1 80 THR H 4.500 . 7.500 3.607 2.587 4.969 . 0 0 "[ . 1 . 2]" 1
1389 1 79 LYS QD 1 80 THR MG 3.500 . 7.300 4.305 3.314 5.971 . 0 0 "[ . 1 . 2]" 1
1390 1 79 LYS QE 1 80 THR MG 4.500 . 9.000 4.088 3.279 5.399 . 0 0 "[ . 1 . 2]" 1
1391 1 79 LYS QG 1 80 THR H 4.500 . 7.500 2.746 2.410 3.203 . 0 0 "[ . 1 . 2]" 1
1392 1 79 LYS QG 1 80 THR MG 4.500 . 9.000 3.877 2.942 5.035 . 0 0 "[ . 1 . 2]" 1
1393 1 79 LYS QG 1 81 TYR H 4.500 . 7.500 4.671 4.353 4.959 . 0 0 "[ . 1 . 2]" 1
1394 1 80 THR H 1 80 THR MG 3.500 . 5.800 2.597 2.087 3.906 . 0 0 "[ . 1 . 2]" 1
1395 1 80 THR H 1 81 TYR H 3.500 . 4.300 2.215 1.927 2.451 . 0 0 "[ . 1 . 2]" 1
1396 1 80 THR H 1 81 TYR QB 4.500 . 7.000 3.903 3.607 4.155 . 0 0 "[ . 1 . 2]" 1
1397 1 80 THR MG 1 81 TYR H 3.500 . 5.800 3.162 2.399 3.904 . 0 0 "[ . 1 . 2]" 1
1398 1 80 THR MG 1 81 TYR QB 4.500 . 8.500 3.441 2.916 4.531 . 0 0 "[ . 1 . 2]" 1
1399 1 81 TYR H 1 81 TYR QB 3.500 . 5.300 2.341 2.186 2.474 . 0 0 "[ . 1 . 2]" 1
1400 1 81 TYR H 1 81 TYR QD 4.500 . 8.400 4.225 4.098 4.319 . 0 0 "[ . 1 . 2]" 1
1401 1 81 TYR H 1 82 ILE H 4.500 . 6.000 4.431 4.154 4.584 . 0 0 "[ . 1 . 2]" 1
1402 1 81 TYR HA 1 81 TYR QD 3.500 . 6.700 2.747 2.486 3.029 . 0 0 "[ . 1 . 2]" 1
1403 1 81 TYR HA 1 81 TYR QE 4.500 . 8.400 4.650 4.508 4.819 . 0 0 "[ . 1 . 2]" 1
1404 1 81 TYR HA 1 82 ILE H 2.500 . 3.400 2.164 2.112 2.249 . 0 0 "[ . 1 . 2]" 1
1405 1 81 TYR HA 1 82 ILE HB 4.500 . 6.000 4.631 4.514 4.737 . 0 0 "[ . 1 . 2]" 1
1406 1 81 TYR HA 1 82 ILE QG 4.500 . 7.000 4.006 3.584 4.861 . 0 0 "[ . 1 . 2]" 1
1407 1 81 TYR QB 1 82 ILE H 4.500 . 7.000 3.708 3.532 3.937 . 0 0 "[ . 1 . 2]" 1
1408 1 81 TYR QB 1 82 ILE HA 4.500 . 7.000 4.700 4.573 4.875 . 0 0 "[ . 1 . 2]" 1
1409 1 81 TYR QD 1 82 ILE H 3.500 . 6.700 3.377 2.809 4.048 . 0 0 "[ . 1 . 2]" 1
1410 1 81 TYR QD 1 82 ILE HA 4.500 . 8.400 4.371 3.853 4.648 . 0 0 "[ . 1 . 2]" 1
1411 1 81 TYR QD 1 82 ILE MD 4.500 . 9.900 5.146 4.431 6.410 . 0 0 "[ . 1 . 2]" 1
1412 1 81 TYR QD 1 82 ILE QG 4.500 . 9.400 5.293 4.812 5.808 . 0 0 "[ . 1 . 2]" 1
1413 1 81 TYR QD 1 82 ILE MG 4.500 . 9.900 5.350 4.988 5.691 . 0 0 "[ . 1 . 2]" 1
1414 1 81 TYR QD 1 83 PRO QB 4.500 . 9.400 3.624 3.007 4.480 . 0 0 "[ . 1 . 2]" 1
1415 1 81 TYR QD 1 83 PRO QD 4.500 . 9.400 3.347 2.312 3.917 . 0 0 "[ . 1 . 2]" 1
1416 1 81 TYR QD 1 83 PRO QG 4.500 . 9.400 3.704 2.229 5.237 . 0 0 "[ . 1 . 2]" 1
1417 1 81 TYR QE 1 82 ILE H 4.500 . 8.400 4.411 3.856 5.210 . 0 0 "[ . 1 . 2]" 1
1418 1 81 TYR QE 1 82 ILE MD 4.500 . 9.900 6.146 5.563 7.196 . 0 0 "[ . 1 . 2]" 1
1419 1 81 TYR QE 1 83 PRO HA 3.500 . 6.700 2.594 2.053 3.705 . 0 0 "[ . 1 . 2]" 1
1420 1 81 TYR QE 1 83 PRO QB 4.500 . 7.700 3.011 1.960 4.114 . 0 0 "[ . 1 . 2]" 1
1421 1 81 TYR QE 1 83 PRO QD 4.500 . 9.400 4.328 3.495 5.145 . 0 0 "[ . 1 . 2]" 1
1422 1 81 TYR QE 1 83 PRO QG 4.500 . 9.400 4.147 2.284 5.672 . 0 0 "[ . 1 . 2]" 1
1423 1 81 TYR QE 1 84 PRO QD 4.500 . 9.400 3.030 2.122 4.433 . 0 0 "[ . 1 . 2]" 1
1424 1 82 ILE H 1 82 ILE HB 3.500 . 4.300 2.544 2.445 2.598 . 0 0 "[ . 1 . 2]" 1
1425 1 82 ILE H 1 82 ILE MD 4.500 . 7.500 3.092 2.093 3.671 . 0 0 "[ . 1 . 2]" 1
1426 1 82 ILE H 1 82 ILE QG 4.500 . 5.300 2.782 2.248 3.653 . 0 0 "[ . 1 . 2]" 1
1427 1 82 ILE H 1 82 ILE MG 4.500 . 7.500 3.805 3.757 3.837 . 0 0 "[ . 1 . 2]" 1
1428 1 82 ILE H 1 83 PRO QD 4.500 . 7.000 4.004 3.753 4.286 . 0 0 "[ . 1 . 2]" 1
1429 1 82 ILE HA 1 82 ILE QG 3.500 . 5.300 2.776 2.356 3.025 . 0 0 "[ . 1 . 2]" 1
1430 1 82 ILE HA 1 82 ILE MG 3.500 . 5.800 2.423 2.381 2.511 . 0 0 "[ . 1 . 2]" 1
1431 1 82 ILE HA 1 83 PRO QB 4.500 . 7.000 4.626 4.525 4.732 . 0 0 "[ . 1 . 2]" 1
1432 1 82 ILE HA 1 83 PRO QD 2.500 . 4.400 1.929 1.877 1.990 . 0 0 "[ . 1 . 2]" 1
1433 1 82 ILE HA 1 83 PRO QG 4.500 . 7.000 3.833 3.774 3.906 . 0 0 "[ . 1 . 2]" 1
1434 1 82 ILE HB 1 82 ILE MD 3.500 . 5.800 2.935 2.326 3.247 . 0 0 "[ . 1 . 2]" 1
1435 1 82 ILE HB 1 83 PRO QD 4.500 . 7.000 4.270 4.078 4.357 . 0 0 "[ . 1 . 2]" 1
1436 1 82 ILE QG 1 83 PRO QD 4.500 . 8.000 4.060 3.364 4.389 . 0 0 "[ . 1 . 2]" 1
1437 1 82 ILE MG 1 83 PRO HA 4.500 . 7.500 4.252 4.025 4.401 . 0 0 "[ . 1 . 2]" 1
1438 1 82 ILE MG 1 83 PRO QB 4.500 . 8.500 4.563 4.128 4.859 . 0 0 "[ . 1 . 2]" 1
1439 1 82 ILE MG 1 83 PRO QD 3.500 . 6.800 2.747 2.200 3.086 . 0 0 "[ . 1 . 2]" 1
1440 1 82 ILE MG 1 83 PRO QG 4.500 . 8.500 4.130 3.112 4.666 . 0 0 "[ . 1 . 2]" 1
1441 1 82 ILE MG 1 84 PRO HA 4.500 . 7.500 4.226 3.712 4.750 . 0 0 "[ . 1 . 2]" 1
1442 1 83 PRO HA 1 84 PRO QD 2.500 . 4.400 1.962 1.860 2.213 . 0 0 "[ . 1 . 2]" 1
1443 1 83 PRO QB 1 84 PRO QD 3.500 . 6.300 2.852 2.070 3.284 . 0 0 "[ . 1 . 2]" 1
1444 1 84 PRO HA 1 85 LYS H 2.500 . 3.400 2.226 2.139 2.583 . 0 0 "[ . 1 . 2]" 1
1445 1 84 PRO HA 1 85 LYS QG 4.500 . 7.500 3.962 3.490 5.068 . 0 0 "[ . 1 . 2]" 1
1446 1 84 PRO QB 1 85 LYS H 3.500 . 5.300 3.152 2.174 3.693 . 0 0 "[ . 1 . 2]" 1
1447 1 84 PRO QB 1 85 LYS HA 4.500 . 7.000 4.507 4.312 4.870 . 0 0 "[ . 1 . 2]" 1
1448 1 84 PRO QB 1 86 GLY H 4.500 . 7.000 4.016 2.245 5.646 . 0 0 "[ . 1 . 2]" 1
1449 1 84 PRO QD 1 85 LYS H 4.500 . 7.000 4.922 4.725 4.993 . 0 0 "[ . 1 . 2]" 1
1450 1 85 LYS H 1 85 LYS QB 3.500 . 5.300 2.615 2.231 3.389 . 0 0 "[ . 1 . 2]" 1
1451 1 85 LYS H 1 85 LYS QG 4.500 . 7.500 2.508 1.795 3.704 . 0 0 "[ . 1 . 2]" 1
1452 1 85 LYS HA 1 86 GLY H 3.500 . 4.300 2.633 2.120 3.467 . 0 0 "[ . 1 . 2]" 1
1453 1 85 LYS QB 1 86 GLY H 4.500 . 7.000 3.531 2.683 4.047 . 0 0 "[ . 1 . 2]" 1
1454 1 85 LYS QB 1 86 GLY QA 4.500 . 8.000 4.096 3.668 4.334 . 0 0 "[ . 1 . 2]" 1
1455 1 85 LYS QG 1 86 GLY H 4.500 . 7.500 4.249 2.576 4.945 . 0 0 "[ . 1 . 2]" 1
1456 1 86 GLY H 1 87 GLU H 4.500 . 6.000 3.026 2.027 4.566 . 0 0 "[ . 1 . 2]" 1
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