NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
524899 |
2lit   |
17904 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lit
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 1389
_Distance_constraint_stats_list.Viol_count 3191
_Distance_constraint_stats_list.Viol_total 4010.449
_Distance_constraint_stats_list.Viol_max 0.289
_Distance_constraint_stats_list.Viol_rms 0.0262
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0072
_Distance_constraint_stats_list.Viol_average_violations_only 0.0628
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 3 PHE 2.337 0.124 3 0 "[ . 1 . 2]"
1 4 LYS 1.751 0.088 4 0 "[ . 1 . 2]"
1 5 ALA 2.060 0.086 11 0 "[ . 1 . 2]"
1 6 GLY 0.780 0.069 8 0 "[ . 1 . 2]"
1 7 SER 0.381 0.033 3 0 "[ . 1 . 2]"
1 8 ALA 0.513 0.039 9 0 "[ . 1 . 2]"
1 9 LYS 8.589 0.235 10 0 "[ . 1 . 2]"
1 10 LYS 8.752 0.235 10 0 "[ . 1 . 2]"
1 11 GLY 2.520 0.216 6 0 "[ . 1 . 2]"
1 12 ALA 1.798 0.095 18 0 "[ . 1 . 2]"
1 13 THR 7.798 0.181 3 0 "[ . 1 . 2]"
1 14 LEU 13.859 0.289 19 0 "[ . 1 . 2]"
1 15 PHE 4.977 0.141 6 0 "[ . 1 . 2]"
1 16 LYS 2.725 0.106 10 0 "[ . 1 . 2]"
1 17 THR 1.686 0.074 19 0 "[ . 1 . 2]"
1 18 ARG 4.781 0.185 3 0 "[ . 1 . 2]"
1 19 CYS 0.857 0.178 10 0 "[ . 1 . 2]"
1 20 LEU 4.005 0.185 3 0 "[ . 1 . 2]"
1 21 GLN 0.895 0.117 5 0 "[ . 1 . 2]"
1 22 CYS 1.103 0.148 7 0 "[ . 1 . 2]"
1 23 HIS 5.155 0.178 10 0 "[ . 1 . 2]"
1 24 THR 1.751 0.165 8 0 "[ . 1 . 2]"
1 25 VAL 5.893 0.184 14 0 "[ . 1 . 2]"
1 26 GLU 0.899 0.165 8 0 "[ . 1 . 2]"
1 27 LYS 5.491 0.265 20 0 "[ . 1 . 2]"
1 28 GLY 1.461 0.202 12 0 "[ . 1 . 2]"
1 29 GLY 1.199 0.153 12 0 "[ . 1 . 2]"
1 30 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 31 HIS 1.589 0.097 8 0 "[ . 1 . 2]"
1 32 LYS 0.977 0.133 3 0 "[ . 1 . 2]"
1 33 VAL 3.099 0.115 3 0 "[ . 1 . 2]"
1 34 GLY 3.018 0.156 16 0 "[ . 1 . 2]"
1 35 PRO 0.799 0.080 17 0 "[ . 1 . 2]"
1 36 ASN 0.374 0.062 11 0 "[ . 1 . 2]"
1 37 LEU 12.115 0.236 13 0 "[ . 1 . 2]"
1 38 HIS 4.240 0.203 16 0 "[ . 1 . 2]"
1 39 GLY 2.032 0.232 7 0 "[ . 1 . 2]"
1 40 ILE 5.951 0.255 14 0 "[ . 1 . 2]"
1 41 PHE 3.983 0.158 7 0 "[ . 1 . 2]"
1 42 GLY 0.233 0.198 6 0 "[ . 1 . 2]"
1 43 ARG 2.595 0.192 18 0 "[ . 1 . 2]"
1 44 HIS 5.901 0.192 18 0 "[ . 1 . 2]"
1 45 SER 3.487 0.191 18 0 "[ . 1 . 2]"
1 46 GLY 2.719 0.148 9 0 "[ . 1 . 2]"
1 47 GLN 5.860 0.285 17 0 "[ . 1 . 2]"
1 48 ALA 1.935 0.218 20 0 "[ . 1 . 2]"
1 49 GLU 0.219 0.053 3 0 "[ . 1 . 2]"
1 50 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 51 TYR 7.047 0.218 20 0 "[ . 1 . 2]"
1 52 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 TYR 1.762 0.088 13 0 "[ . 1 . 2]"
1 54 THR 3.914 0.190 3 0 "[ . 1 . 2]"
1 55 ASP 0.274 0.032 11 0 "[ . 1 . 2]"
1 56 ALA 4.102 0.178 10 0 "[ . 1 . 2]"
1 57 ASN 13.388 0.230 9 0 "[ . 1 . 2]"
1 58 ILE 1.500 0.090 9 0 "[ . 1 . 2]"
1 59 LYS 3.367 0.107 19 0 "[ . 1 . 2]"
1 60 LYS 2.010 0.074 5 0 "[ . 1 . 2]"
1 61 ASN 2.201 0.115 17 0 "[ . 1 . 2]"
1 62 VAL 3.709 0.169 14 0 "[ . 1 . 2]"
1 63 LEU 4.400 0.198 6 0 "[ . 1 . 2]"
1 64 TRP 13.405 0.230 9 0 "[ . 1 . 2]"
1 65 ASP 4.496 0.224 20 0 "[ . 1 . 2]"
1 66 GLU 3.803 0.224 20 0 "[ . 1 . 2]"
1 67 ASN 3.007 0.095 1 0 "[ . 1 . 2]"
1 68 ASN 5.058 0.161 6 0 "[ . 1 . 2]"
1 69 MET 4.216 0.170 9 0 "[ . 1 . 2]"
1 70 SER 0.970 0.057 14 0 "[ . 1 . 2]"
1 71 GLU 3.248 0.103 19 0 "[ . 1 . 2]"
1 72 TYR 1.249 0.104 6 0 "[ . 1 . 2]"
1 73 LEU 5.634 0.130 14 0 "[ . 1 . 2]"
1 74 THR 2.649 0.130 14 0 "[ . 1 . 2]"
1 75 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 76 HIS 3.801 0.143 16 0 "[ . 1 . 2]"
1 77 ALA 1.644 0.119 12 0 "[ . 1 . 2]"
1 78 LYS 1.593 0.119 13 0 "[ . 1 . 2]"
1 79 TYR 5.096 0.236 11 0 "[ . 1 . 2]"
1 80 ILE 5.437 0.236 11 0 "[ . 1 . 2]"
1 81 PRO 2.351 0.105 5 0 "[ . 1 . 2]"
1 82 GLY 0.508 0.175 3 0 "[ . 1 . 2]"
1 83 THR 3.288 0.178 10 0 "[ . 1 . 2]"
1 84 LYS 0.014 0.014 13 0 "[ . 1 . 2]"
1 85 MET 2.406 0.110 20 0 "[ . 1 . 2]"
1 86 ALA 0.235 0.041 13 0 "[ . 1 . 2]"
1 87 PHE 4.605 0.230 15 0 "[ . 1 . 2]"
1 89 GLY 0.787 0.115 2 0 "[ . 1 . 2]"
1 90 LEU 5.073 0.230 15 0 "[ . 1 . 2]"
1 91 LYS 0.028 0.028 15 0 "[ . 1 . 2]"
1 92 LYS 0.280 0.139 6 0 "[ . 1 . 2]"
1 93 GLU 1.528 0.174 11 0 "[ . 1 . 2]"
1 94 LYS 2.227 0.107 11 0 "[ . 1 . 2]"
1 95 ASP 3.590 0.139 6 0 "[ . 1 . 2]"
1 96 ARG 1.202 0.064 11 0 "[ . 1 . 2]"
1 97 ASN 4.458 0.118 6 0 "[ . 1 . 2]"
1 98 ASP 4.454 0.105 10 0 "[ . 1 . 2]"
1 99 LEU 4.533 0.226 13 0 "[ . 1 . 2]"
1 100 ILE 9.317 0.262 11 0 "[ . 1 . 2]"
1 101 THR 2.953 0.115 16 0 "[ . 1 . 2]"
1 102 TYR 1.386 0.095 18 0 "[ . 1 . 2]"
1 103 LEU 6.294 0.236 13 0 "[ . 1 . 2]"
1 104 LYS 1.631 0.072 7 0 "[ . 1 . 2]"
1 105 LYS 1.614 0.126 7 0 "[ . 1 . 2]"
1 106 ALA 4.854 0.184 14 0 "[ . 1 . 2]"
1 107 THR 0.546 0.121 2 0 "[ . 1 . 2]"
1 108 GLU 0.238 0.058 14 0 "[ . 1 . 2]"
2 1 HEC 9.799 0.255 14 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 3 PHE H 1 3 PHE HB2 1.800 . 3.500 3.144 2.911 3.247 . 0 0 "[ . 1 . 2]" 1
2 1 3 PHE H 1 3 PHE HB3 1.800 . 3.500 2.335 2.285 2.441 . 0 0 "[ . 1 . 2]" 1
3 1 3 PHE HA 1 3 PHE QD 1.800 . 2.900 2.267 2.231 2.386 . 0 0 "[ . 1 . 2]" 1
4 1 3 PHE HA 1 4 LYS H 1.800 . 5.000 2.195 2.181 2.208 . 0 0 "[ . 1 . 2]" 1
5 1 3 PHE HA 1 97 ASN HD21 1.800 . 5.000 4.185 2.936 4.882 . 0 0 "[ . 1 . 2]" 1
6 1 3 PHE HA 1 97 ASN HD22 1.800 . 5.000 3.878 2.681 4.739 . 0 0 "[ . 1 . 2]" 1
7 1 3 PHE HB2 1 3 PHE QD 1.800 . 2.900 2.759 2.712 2.779 . 0 0 "[ . 1 . 2]" 1
8 1 3 PHE HB2 1 4 LYS H 1.800 . 5.000 4.103 4.024 4.406 . 0 0 "[ . 1 . 2]" 1
9 1 3 PHE HB3 1 3 PHE QD 1.800 . 2.900 2.329 2.293 2.352 . 0 0 "[ . 1 . 2]" 1
10 1 3 PHE HB3 1 4 LYS H 1.800 . 5.000 4.367 4.293 4.444 . 0 0 "[ . 1 . 2]" 1
11 1 3 PHE QD 1 5 ALA MB 1.800 . 5.000 4.942 3.823 5.086 0.086 11 0 "[ . 1 . 2]" 1
12 1 3 PHE QD 1 66 GLU QB 1.800 . 5.000 2.559 2.256 3.476 . 0 0 "[ . 1 . 2]" 1
13 1 3 PHE QD 1 100 ILE H 1.800 . 6.000 5.320 5.047 5.471 . 0 0 "[ . 1 . 2]" 1
14 1 3 PHE QD 1 100 ILE HA 1.800 . 6.000 5.988 5.853 6.072 0.072 3 0 "[ . 1 . 2]" 1
15 1 3 PHE QD 1 100 ILE HB 1.800 . 5.000 3.630 3.434 3.762 . 0 0 "[ . 1 . 2]" 1
16 1 3 PHE QD 1 100 ILE MD 1.800 . 5.000 3.282 2.421 5.027 0.027 14 0 "[ . 1 . 2]" 1
17 1 3 PHE QD 1 100 ILE MG 1.800 . 3.500 2.950 2.704 3.335 . 0 0 "[ . 1 . 2]" 1
18 1 3 PHE QD 1 101 THR H 1.800 . 5.000 5.053 5.010 5.115 0.115 16 0 "[ . 1 . 2]" 1
19 1 3 PHE QE 1 100 ILE H 1.800 . 5.000 4.359 3.964 4.747 . 0 0 "[ . 1 . 2]" 1
20 1 3 PHE QE 1 100 ILE HB 1.800 . 3.500 2.799 2.271 3.176 . 0 0 "[ . 1 . 2]" 1
21 1 3 PHE QE 1 100 ILE MG 1.800 . 3.500 2.447 2.096 2.922 . 0 0 "[ . 1 . 2]" 1
22 1 3 PHE QE 1 101 THR H 1.800 . 3.500 3.184 2.861 3.454 . 0 0 "[ . 1 . 2]" 1
23 1 3 PHE HZ 1 5 ALA HA 1.800 . 5.000 2.724 2.353 3.032 . 0 0 "[ . 1 . 2]" 1
24 1 3 PHE HZ 1 5 ALA MB 1.800 . 5.000 3.441 3.011 3.822 . 0 0 "[ . 1 . 2]" 1
25 1 3 PHE HZ 1 100 ILE H 1.800 . 5.000 5.029 4.997 5.124 0.124 3 0 "[ . 1 . 2]" 1
26 1 3 PHE HZ 1 100 ILE HB 1.800 . 6.000 3.025 2.857 3.249 . 0 0 "[ . 1 . 2]" 1
27 1 3 PHE HZ 1 100 ILE MG 1.800 . 5.000 2.931 2.642 3.221 . 0 0 "[ . 1 . 2]" 1
28 1 3 PHE HZ 1 101 THR H 1.800 . 5.000 2.872 2.781 3.167 . 0 0 "[ . 1 . 2]" 1
29 1 3 PHE HZ 1 101 THR HA 1.800 . 6.000 2.572 2.284 2.999 . 0 0 "[ . 1 . 2]" 1
30 1 4 LYS H 1 4 LYS HA 1.800 . 2.900 2.982 2.957 2.988 0.088 4 0 "[ . 1 . 2]" 1
31 1 4 LYS H 1 4 LYS HG2 1.800 . 5.000 4.169 3.648 4.494 . 0 0 "[ . 1 . 2]" 1
32 1 4 LYS H 1 4 LYS HG3 1.800 . 5.000 3.805 2.534 4.725 . 0 0 "[ . 1 . 2]" 1
33 1 4 LYS H 1 97 ASN HB2 1.800 . 5.000 4.417 3.800 5.054 0.054 3 0 "[ . 1 . 2]" 1
34 1 4 LYS H 1 97 ASN HB3 1.800 . 5.000 2.911 2.343 3.705 . 0 0 "[ . 1 . 2]" 1
35 1 4 LYS H 1 97 ASN HD21 1.800 . 5.000 3.827 3.248 4.402 . 0 0 "[ . 1 . 2]" 1
36 1 4 LYS H 1 97 ASN HD22 1.800 . 5.000 4.218 3.584 4.948 . 0 0 "[ . 1 . 2]" 1
37 1 4 LYS HA 1 4 LYS QE 1.800 . 5.000 4.537 4.406 4.761 . 0 0 "[ . 1 . 2]" 1
38 1 4 LYS HA 1 5 ALA H 1.800 . 3.500 2.348 2.201 3.555 0.055 19 0 "[ . 1 . 2]" 1
39 1 4 LYS HB2 1 4 LYS QE 1.800 . 5.000 3.854 2.193 4.225 . 0 0 "[ . 1 . 2]" 1
40 1 4 LYS HB2 1 5 ALA H 1.800 . 5.000 4.071 1.933 4.352 . 0 0 "[ . 1 . 2]" 1
41 1 4 LYS HB3 1 4 LYS QE 1.800 . 5.000 3.880 2.163 4.144 . 0 0 "[ . 1 . 2]" 1
42 1 4 LYS HB3 1 5 ALA H 1.800 . 5.000 3.694 2.861 4.274 . 0 0 "[ . 1 . 2]" 1
43 1 4 LYS QE 1 4 LYS HG2 1.800 . 5.000 2.483 2.241 3.300 . 0 0 "[ . 1 . 2]" 1
44 1 4 LYS QE 1 4 LYS HG3 1.800 . 5.000 2.442 2.250 3.299 . 0 0 "[ . 1 . 2]" 1
45 1 5 ALA H 1 5 ALA HA 1.800 . 2.900 2.855 2.344 2.943 0.043 20 0 "[ . 1 . 2]" 1
46 1 5 ALA H 1 5 ALA MB 1.800 . 2.900 2.238 2.053 2.873 . 0 0 "[ . 1 . 2]" 1
47 1 5 ALA H 1 6 GLY H 1.800 . 5.000 4.195 3.487 4.409 . 0 0 "[ . 1 . 2]" 1
48 1 5 ALA H 1 101 THR MG 1.800 . 5.000 4.996 4.300 5.059 0.059 12 0 "[ . 1 . 2]" 1
49 1 5 ALA HA 1 6 GLY H 1.800 . 3.500 2.308 2.205 3.442 . 0 0 "[ . 1 . 2]" 1
50 1 5 ALA HA 1 97 ASN QB 1.800 . 5.000 4.747 4.247 5.008 0.008 2 0 "[ . 1 . 2]" 1
51 1 5 ALA HA 1 101 THR MG 1.800 . 5.000 2.868 1.995 3.104 . 0 0 "[ . 1 . 2]" 1
52 1 5 ALA MB 1 6 GLY H 1.800 . 3.500 3.449 1.805 3.569 0.069 8 0 "[ . 1 . 2]" 1
53 1 6 GLY H 1 98 ASP HA 1.800 . 5.000 3.364 2.994 5.030 0.030 19 0 "[ . 1 . 2]" 1
54 1 6 GLY H 1 101 THR MG 1.800 . 5.000 3.541 2.006 4.025 . 0 0 "[ . 1 . 2]" 1
55 1 6 GLY QA 1 7 SER H 1.800 . 5.000 2.178 2.159 2.257 . 0 0 "[ . 1 . 2]" 1
56 1 6 GLY QA 1 101 THR MG 1.800 . 5.000 4.373 3.445 4.898 . 0 0 "[ . 1 . 2]" 1
57 1 7 SER H 1 7 SER QB 1.800 . 2.900 2.581 2.451 2.917 0.017 3 0 "[ . 1 . 2]" 1
58 1 7 SER H 1 98 ASP HB2 1.800 . 5.000 5.009 4.829 5.033 0.033 3 0 "[ . 1 . 2]" 1
59 1 7 SER H 1 98 ASP HB3 1.800 . 5.000 3.763 3.326 3.982 . 0 0 "[ . 1 . 2]" 1
60 1 7 SER QB 1 8 ALA H 1.800 . 5.000 3.477 2.958 3.851 . 0 0 "[ . 1 . 2]" 1
61 1 8 ALA H 1 8 ALA MB 1.800 . 3.500 2.158 2.051 2.265 . 0 0 "[ . 1 . 2]" 1
62 1 8 ALA HA 1 9 LYS H 1.800 . 3.500 3.526 3.507 3.539 0.039 9 0 "[ . 1 . 2]" 1
63 1 8 ALA HA 1 10 LYS H 1.800 . 5.000 4.514 4.453 4.596 . 0 0 "[ . 1 . 2]" 1
64 1 8 ALA HA 1 11 GLY H 1.800 . 5.000 3.406 3.308 3.480 . 0 0 "[ . 1 . 2]" 1
65 1 8 ALA HA 1 12 ALA H 1.800 . 5.000 3.862 3.616 4.114 . 0 0 "[ . 1 . 2]" 1
66 1 8 ALA HA 1 101 THR MG 1.800 . 6.000 3.392 2.980 4.283 . 0 0 "[ . 1 . 2]" 1
67 1 8 ALA MB 1 102 TYR QE 1.800 . 5.000 4.153 3.677 4.849 . 0 0 "[ . 1 . 2]" 1
68 1 9 LYS H 1 9 LYS HB2 1.800 . 3.500 2.622 2.614 2.633 . 0 0 "[ . 1 . 2]" 1
69 1 9 LYS H 1 9 LYS HB3 1.800 . 3.500 3.589 3.586 3.594 0.094 19 0 "[ . 1 . 2]" 1
70 1 9 LYS H 1 9 LYS HG2 1.800 . 3.500 2.994 2.911 3.049 . 0 0 "[ . 1 . 2]" 1
71 1 9 LYS H 1 9 LYS HG3 1.800 . 3.500 1.864 1.823 1.915 . 0 0 "[ . 1 . 2]" 1
72 1 9 LYS H 1 10 LYS H 1.800 . 3.500 2.773 2.757 2.810 . 0 0 "[ . 1 . 2]" 1
73 1 9 LYS H 1 11 GLY H 1.800 . 5.000 4.209 4.098 4.350 . 0 0 "[ . 1 . 2]" 1
74 1 9 LYS H 1 102 TYR QB 1.800 . 6.000 5.895 5.716 6.036 0.036 13 0 "[ . 1 . 2]" 1
75 1 9 LYS HA 1 9 LYS QE 1.800 . 5.000 4.032 3.659 4.679 . 0 0 "[ . 1 . 2]" 1
76 1 9 LYS HA 1 9 LYS HG2 1.800 . 3.500 2.512 2.469 2.544 . 0 0 "[ . 1 . 2]" 1
77 1 9 LYS HA 1 9 LYS HG3 1.800 . 3.500 3.182 3.136 3.246 . 0 0 "[ . 1 . 2]" 1
78 1 9 LYS HA 1 10 LYS H 1.800 . 3.500 3.552 3.544 3.558 0.058 11 0 "[ . 1 . 2]" 1
79 1 9 LYS HA 1 11 GLY H 1.800 . 5.000 4.610 4.496 4.716 . 0 0 "[ . 1 . 2]" 1
80 1 9 LYS HA 1 12 ALA H 1.800 . 5.000 3.482 3.423 3.556 . 0 0 "[ . 1 . 2]" 1
81 1 9 LYS HA 1 12 ALA MB 1.800 . 5.000 2.525 2.226 2.688 . 0 0 "[ . 1 . 2]" 1
82 1 9 LYS HA 1 13 THR H 1.800 . 5.000 4.421 4.065 4.633 . 0 0 "[ . 1 . 2]" 1
83 1 9 LYS HB2 1 9 LYS QE 1.800 . 3.500 2.764 2.152 3.478 . 0 0 "[ . 1 . 2]" 1
84 1 9 LYS HB2 1 10 LYS H 1.800 . 3.500 2.303 2.255 2.337 . 0 0 "[ . 1 . 2]" 1
85 1 9 LYS HB3 1 9 LYS QE 1.800 . 3.500 2.494 2.129 3.320 . 0 0 "[ . 1 . 2]" 1
86 1 9 LYS HB3 1 10 LYS H 1.800 . 3.500 3.538 3.503 3.565 0.065 6 0 "[ . 1 . 2]" 1
87 1 9 LYS QE 1 9 LYS HG2 1.800 . 3.500 2.677 2.225 3.373 . 0 0 "[ . 1 . 2]" 1
88 1 9 LYS QE 1 9 LYS HG3 1.800 . 3.500 2.893 2.257 3.362 . 0 0 "[ . 1 . 2]" 1
89 1 9 LYS QG 1 10 LYS H 1.800 . 3.500 3.721 3.700 3.735 0.235 10 0 "[ . 1 . 2]" 1
90 1 10 LYS H 1 10 LYS HB2 1.800 . 3.500 2.481 2.459 2.494 . 0 0 "[ . 1 . 2]" 1
91 1 10 LYS H 1 10 LYS HB3 1.800 . 3.500 3.607 3.605 3.609 0.109 18 0 "[ . 1 . 2]" 1
92 1 10 LYS H 1 10 LYS QE 1.800 . 5.000 4.306 4.184 4.663 . 0 0 "[ . 1 . 2]" 1
93 1 10 LYS H 1 10 LYS HG2 1.800 . 3.500 3.329 3.305 3.405 . 0 0 "[ . 1 . 2]" 1
94 1 10 LYS H 1 10 LYS HG3 1.800 . 3.500 2.161 2.141 2.204 . 0 0 "[ . 1 . 2]" 1
95 1 10 LYS H 1 11 GLY H 1.800 . 5.000 2.773 2.710 2.849 . 0 0 "[ . 1 . 2]" 1
96 1 10 LYS H 1 12 ALA H 1.800 . 5.000 4.018 3.877 4.136 . 0 0 "[ . 1 . 2]" 1
97 1 10 LYS HA 1 10 LYS QG 1.800 . 5.000 2.328 2.318 2.339 . 0 0 "[ . 1 . 2]" 1
98 1 10 LYS HA 1 11 GLY H 1.800 . 5.000 3.574 3.560 3.591 . 0 0 "[ . 1 . 2]" 1
99 1 10 LYS HA 1 12 ALA H 1.800 . 5.000 4.335 4.223 4.487 . 0 0 "[ . 1 . 2]" 1
100 1 10 LYS HA 1 13 THR H 1.800 . 5.000 3.638 3.524 3.879 . 0 0 "[ . 1 . 2]" 1
101 1 10 LYS HA 1 13 THR HB 1.800 . 5.000 4.813 3.248 5.054 0.054 16 0 "[ . 1 . 2]" 1
102 1 10 LYS HA 1 14 LEU H 1.800 . 5.000 4.585 4.238 4.834 . 0 0 "[ . 1 . 2]" 1
103 1 10 LYS HB2 1 11 GLY H 1.800 . 5.000 2.512 2.428 2.571 . 0 0 "[ . 1 . 2]" 1
104 1 10 LYS HB3 1 11 GLY H 1.800 . 5.000 3.535 3.458 3.593 . 0 0 "[ . 1 . 2]" 1
105 1 11 GLY H 1 12 ALA H 1.800 . 3.500 2.599 2.499 2.653 . 0 0 "[ . 1 . 2]" 1
106 1 11 GLY H 1 12 ALA MB 1.800 . 5.000 4.270 4.205 4.308 . 0 0 "[ . 1 . 2]" 1
107 1 11 GLY H 1 13 THR H 1.800 . 5.000 4.279 4.195 4.351 . 0 0 "[ . 1 . 2]" 1
108 1 11 GLY H 1 98 ASP QB 1.800 . 5.000 2.711 1.994 3.398 . 0 0 "[ . 1 . 2]" 1
109 1 11 GLY H 1 102 TYR QB 1.800 . 5.000 4.220 4.046 4.603 . 0 0 "[ . 1 . 2]" 1
110 1 11 GLY QA 1 98 ASP HB2 1.800 . 5.000 3.030 2.621 3.506 . 0 0 "[ . 1 . 2]" 1
111 1 11 GLY QA 1 98 ASP HB3 1.800 . 5.000 2.538 2.142 3.064 . 0 0 "[ . 1 . 2]" 1
112 1 11 GLY HA2 1 12 ALA H 1.800 . 5.000 3.533 3.511 3.552 . 0 0 "[ . 1 . 2]" 1
113 1 11 GLY HA2 1 13 THR H 1.800 . 5.000 4.235 4.131 4.353 . 0 0 "[ . 1 . 2]" 1
114 1 11 GLY HA2 1 14 LEU H 1.800 . 5.000 3.233 3.015 3.443 . 0 0 "[ . 1 . 2]" 1
115 1 11 GLY HA2 1 14 LEU HB2 1.800 . 5.000 2.745 2.244 3.364 . 0 0 "[ . 1 . 2]" 1
116 1 11 GLY HA2 1 14 LEU HB3 1.800 . 5.000 3.435 2.798 3.825 . 0 0 "[ . 1 . 2]" 1
117 1 11 GLY HA2 1 15 PHE H 1.800 . 5.000 3.818 3.631 4.177 . 0 0 "[ . 1 . 2]" 1
118 1 11 GLY HA2 1 102 TYR QB 1.800 . 5.000 4.298 3.906 4.882 . 0 0 "[ . 1 . 2]" 1
119 1 11 GLY HA3 1 12 ALA H 1.800 . 5.000 2.921 2.869 2.966 . 0 0 "[ . 1 . 2]" 1
120 1 11 GLY HA3 1 13 THR H 1.800 . 5.000 4.736 4.694 4.821 . 0 0 "[ . 1 . 2]" 1
121 1 11 GLY HA3 1 14 LEU H 1.800 . 5.000 4.531 4.298 4.731 . 0 0 "[ . 1 . 2]" 1
122 1 11 GLY HA3 1 14 LEU HB2 1.800 . 5.000 4.266 3.556 5.059 0.059 5 0 "[ . 1 . 2]" 1
123 1 11 GLY HA3 1 14 LEU HB3 1.800 . 5.000 4.844 4.344 5.216 0.216 6 0 "[ . 1 . 2]" 1
124 1 11 GLY HA3 1 15 PHE H 1.800 . 5.000 4.503 4.372 4.860 . 0 0 "[ . 1 . 2]" 1
125 1 11 GLY HA3 1 102 TYR QB 1.800 . 5.000 2.859 2.484 3.479 . 0 0 "[ . 1 . 2]" 1
126 1 12 ALA H 1 12 ALA HA 1.800 . 2.900 2.835 2.817 2.855 . 0 0 "[ . 1 . 2]" 1
127 1 12 ALA H 1 12 ALA MB 1.800 . 2.900 2.197 2.044 2.260 . 0 0 "[ . 1 . 2]" 1
128 1 12 ALA H 1 13 THR H 1.800 . 2.900 2.750 2.699 2.815 . 0 0 "[ . 1 . 2]" 1
129 1 12 ALA H 1 14 LEU H 1.800 . 5.000 4.201 4.042 4.345 . 0 0 "[ . 1 . 2]" 1
130 1 12 ALA H 1 102 TYR HB2 1.800 . 5.000 3.582 3.485 3.694 . 0 0 "[ . 1 . 2]" 1
131 1 12 ALA H 1 102 TYR HB3 1.800 . 5.000 5.035 4.963 5.095 0.095 18 0 "[ . 1 . 2]" 1
132 1 12 ALA HA 1 13 THR H 1.800 . 3.500 3.553 3.544 3.564 0.064 12 0 "[ . 1 . 2]" 1
133 1 12 ALA HA 1 14 LEU H 1.800 . 5.000 4.517 4.371 4.672 . 0 0 "[ . 1 . 2]" 1
134 1 12 ALA HA 1 15 PHE H 1.800 . 3.500 3.404 3.307 3.503 0.003 10 0 "[ . 1 . 2]" 1
135 1 12 ALA HA 1 15 PHE QB 1.800 . 5.000 2.481 2.302 2.725 . 0 0 "[ . 1 . 2]" 1
136 1 12 ALA HA 1 16 LYS H 1.800 . 5.000 3.658 3.353 4.042 . 0 0 "[ . 1 . 2]" 1
137 1 12 ALA MB 1 13 THR H 1.800 . 3.500 2.529 2.443 2.708 . 0 0 "[ . 1 . 2]" 1
138 1 12 ALA MB 1 102 TYR QD 1.800 . 5.000 2.416 2.224 2.742 . 0 0 "[ . 1 . 2]" 1
139 1 12 ALA MB 1 102 TYR QE 1.800 . 5.000 2.153 2.025 2.556 . 0 0 "[ . 1 . 2]" 1
140 1 13 THR H 1 13 THR HA 1.800 . 2.900 2.868 2.845 2.889 . 0 0 "[ . 1 . 2]" 1
141 1 13 THR H 1 13 THR HB 1.800 . 3.500 3.449 2.159 3.599 0.099 20 0 "[ . 1 . 2]" 1
142 1 13 THR H 1 13 THR MG 1.800 . 2.900 2.084 1.871 2.967 0.067 7 0 "[ . 1 . 2]" 1
143 1 13 THR H 1 14 LEU H 1.800 . 2.900 2.620 2.517 2.724 . 0 0 "[ . 1 . 2]" 1
144 1 13 THR H 1 15 PHE H 1.800 . 5.000 4.028 3.920 4.118 . 0 0 "[ . 1 . 2]" 1
145 1 13 THR HA 1 13 THR MG 1.800 . 2.900 2.470 2.348 3.081 0.181 3 0 "[ . 1 . 2]" 1
146 1 13 THR HA 1 14 LEU H 1.800 . 3.500 3.534 3.521 3.549 0.049 10 0 "[ . 1 . 2]" 1
147 1 13 THR HA 1 15 PHE H 1.800 . 5.000 4.498 4.404 4.597 . 0 0 "[ . 1 . 2]" 1
148 1 13 THR HA 1 16 LYS H 1.800 . 5.000 3.650 3.524 3.822 . 0 0 "[ . 1 . 2]" 1
149 1 13 THR HA 1 16 LYS HB2 1.800 . 5.000 3.089 2.663 3.961 . 0 0 "[ . 1 . 2]" 1
150 1 13 THR HA 1 16 LYS HB3 1.800 . 5.000 4.013 2.579 4.690 . 0 0 "[ . 1 . 2]" 1
151 1 13 THR HA 1 17 THR H 1.800 . 5.000 3.997 3.575 4.586 . 0 0 "[ . 1 . 2]" 1
152 1 13 THR HB 1 14 LEU H 1.800 . 3.500 3.588 3.422 3.634 0.134 11 0 "[ . 1 . 2]" 1
153 1 13 THR MG 1 14 LEU H 1.800 . 3.500 3.436 1.978 3.611 0.111 12 0 "[ . 1 . 2]" 1
154 1 14 LEU H 1 14 LEU HB2 1.800 . 3.500 2.389 2.197 2.501 . 0 0 "[ . 1 . 2]" 1
155 1 14 LEU H 1 14 LEU HB3 1.800 . 3.500 3.198 2.716 3.582 0.082 4 0 "[ . 1 . 2]" 1
156 1 14 LEU H 1 14 LEU MD1 1.800 . 5.000 3.695 3.121 4.139 . 0 0 "[ . 1 . 2]" 1
157 1 14 LEU H 1 14 LEU MD2 1.800 . 5.000 3.735 3.044 4.337 . 0 0 "[ . 1 . 2]" 1
158 1 14 LEU H 1 14 LEU HG 1.800 . 5.000 3.194 2.041 4.493 . 0 0 "[ . 1 . 2]" 1
159 1 14 LEU H 1 15 PHE H 1.800 . 3.500 2.666 2.554 2.754 . 0 0 "[ . 1 . 2]" 1
160 1 14 LEU H 1 16 LYS H 1.800 . 5.000 4.305 4.070 4.476 . 0 0 "[ . 1 . 2]" 1
161 1 14 LEU HA 1 14 LEU MD1 1.800 . 3.500 3.262 2.144 3.759 0.259 15 0 "[ . 1 . 2]" 1
162 1 14 LEU HA 1 14 LEU MD2 1.800 . 3.500 2.741 2.020 3.789 0.289 19 0 "[ . 1 . 2]" 1
163 1 14 LEU HA 1 14 LEU HG 1.800 . 3.500 2.722 2.219 3.134 . 0 0 "[ . 1 . 2]" 1
164 1 14 LEU HA 1 15 PHE H 1.800 . 5.000 3.542 3.527 3.567 . 0 0 "[ . 1 . 2]" 1
165 1 14 LEU HA 1 16 LYS H 1.800 . 5.000 4.773 4.550 5.018 0.018 6 0 "[ . 1 . 2]" 1
166 1 14 LEU HA 1 17 THR H 1.800 . 5.000 3.623 3.489 3.812 . 0 0 "[ . 1 . 2]" 1
167 1 14 LEU HA 1 18 ARG H 1.800 . 5.000 4.330 4.146 4.649 . 0 0 "[ . 1 . 2]" 1
168 1 14 LEU QB 1 99 LEU QD 1.800 . 5.000 2.096 1.862 2.429 . 0 0 "[ . 1 . 2]" 1
169 1 14 LEU HB2 1 14 LEU MD1 1.800 . 3.500 2.278 2.157 2.445 . 0 0 "[ . 1 . 2]" 1
170 1 14 LEU HB2 1 14 LEU MD2 1.800 . 3.500 2.980 2.421 3.200 . 0 0 "[ . 1 . 2]" 1
171 1 14 LEU HB2 1 15 PHE H 1.800 . 3.500 3.000 2.409 3.626 0.126 2 0 "[ . 1 . 2]" 1
172 1 14 LEU HB3 1 14 LEU MD1 1.800 . 3.500 2.608 2.214 3.177 . 0 0 "[ . 1 . 2]" 1
173 1 14 LEU HB3 1 14 LEU MD2 1.800 . 3.500 2.250 2.148 2.357 . 0 0 "[ . 1 . 2]" 1
174 1 14 LEU HB3 1 15 PHE H 1.800 . 3.500 3.033 2.386 3.588 0.088 16 0 "[ . 1 . 2]" 1
175 1 14 LEU QD 1 95 ASP HA 1.800 . 5.000 3.258 2.401 3.820 . 0 0 "[ . 1 . 2]" 1
176 1 14 LEU QD 1 98 ASP H 1.800 . 5.000 4.722 3.996 5.075 0.075 13 0 "[ . 1 . 2]" 1
177 1 14 LEU QD 1 99 LEU H 1.800 . 5.000 3.947 3.380 4.386 . 0 0 "[ . 1 . 2]" 1
178 1 14 LEU MD1 1 15 PHE H 1.800 . 5.000 4.564 4.312 4.759 . 0 0 "[ . 1 . 2]" 1
179 1 14 LEU MD1 1 95 ASP HB2 1.800 . 3.500 3.427 2.878 3.537 0.037 5 0 "[ . 1 . 2]" 1
180 1 14 LEU MD1 1 95 ASP HB3 1.800 . 3.500 2.201 1.980 2.716 . 0 0 "[ . 1 . 2]" 1
181 1 14 LEU MD2 1 15 PHE H 1.800 . 5.000 4.248 3.369 4.670 . 0 0 "[ . 1 . 2]" 1
182 1 15 PHE H 1 15 PHE HB2 1.800 . 3.500 2.449 2.386 2.524 . 0 0 "[ . 1 . 2]" 1
183 1 15 PHE H 1 15 PHE HB3 1.800 . 3.500 2.603 2.538 2.656 . 0 0 "[ . 1 . 2]" 1
184 1 15 PHE H 1 16 LYS H 1.800 . 3.500 2.758 2.605 2.825 . 0 0 "[ . 1 . 2]" 1
185 1 15 PHE H 1 17 THR H 1.800 . 5.000 4.001 3.804 4.180 . 0 0 "[ . 1 . 2]" 1
186 1 15 PHE H 1 99 LEU MD1 1.800 . 5.000 4.021 2.659 4.995 . 0 0 "[ . 1 . 2]" 1
187 1 15 PHE H 1 99 LEU MD2 1.800 . 5.000 3.525 2.549 5.053 0.053 19 0 "[ . 1 . 2]" 1
188 1 15 PHE HA 1 15 PHE QD 1.800 . 5.000 2.959 2.856 3.101 . 0 0 "[ . 1 . 2]" 1
189 1 15 PHE HA 1 16 LYS H 1.800 . 5.000 3.574 3.544 3.587 . 0 0 "[ . 1 . 2]" 1
190 1 15 PHE HA 1 17 THR H 1.800 . 5.000 4.323 3.667 4.488 . 0 0 "[ . 1 . 2]" 1
191 1 15 PHE HA 1 18 ARG H 1.800 . 5.000 3.415 3.330 3.474 . 0 0 "[ . 1 . 2]" 1
192 1 15 PHE HA 1 18 ARG HB2 1.800 . 5.000 3.769 3.624 3.935 . 0 0 "[ . 1 . 2]" 1
193 1 15 PHE HA 1 18 ARG HB3 1.800 . 5.000 5.093 5.014 5.141 0.141 6 0 "[ . 1 . 2]" 1
194 1 15 PHE HA 1 19 CYS H 1.800 . 5.000 4.162 3.539 4.587 . 0 0 "[ . 1 . 2]" 1
195 1 15 PHE HA 1 99 LEU MD1 1.800 . 5.000 3.388 2.354 4.262 . 0 0 "[ . 1 . 2]" 1
196 1 15 PHE HA 1 99 LEU MD2 1.800 . 5.000 3.332 2.621 4.521 . 0 0 "[ . 1 . 2]" 1
197 1 15 PHE QB 1 102 TYR QD 1.800 . 5.000 3.472 2.971 3.911 . 0 0 "[ . 1 . 2]" 1
198 1 15 PHE QB 1 102 TYR QE 1.800 . 5.000 3.742 3.301 4.235 . 0 0 "[ . 1 . 2]" 1
199 1 15 PHE HB2 1 16 LYS H 1.800 . 5.000 3.673 3.587 3.746 . 0 0 "[ . 1 . 2]" 1
200 1 15 PHE HB2 1 99 LEU QD 1.800 . 5.000 2.306 2.115 2.729 . 0 0 "[ . 1 . 2]" 1
201 1 15 PHE HB3 1 16 LYS H 1.800 . 5.000 2.315 2.186 2.470 . 0 0 "[ . 1 . 2]" 1
202 1 15 PHE HB3 1 99 LEU QD 1.800 . 5.000 3.672 3.506 4.055 . 0 0 "[ . 1 . 2]" 1
203 1 15 PHE QD 1 16 LYS H 1.800 . 3.500 3.219 2.950 3.502 0.002 1 0 "[ . 1 . 2]" 1
204 1 15 PHE QD 1 16 LYS HA 1.800 . 3.500 2.955 2.712 3.160 . 0 0 "[ . 1 . 2]" 1
205 1 15 PHE QD 1 20 LEU QB 1.800 . 6.000 4.917 3.493 5.985 . 0 0 "[ . 1 . 2]" 1
206 1 15 PHE QD 1 20 LEU MD1 1.800 . 5.000 4.661 2.331 5.028 0.028 19 0 "[ . 1 . 2]" 1
207 1 15 PHE QD 1 20 LEU MD2 1.800 . 5.000 3.677 2.649 4.690 . 0 0 "[ . 1 . 2]" 1
208 1 15 PHE QD 1 25 VAL MG1 1.800 . 5.000 4.608 3.070 5.042 0.042 3 0 "[ . 1 . 2]" 1
209 1 15 PHE QD 1 25 VAL MG2 1.800 . 5.000 3.994 3.524 5.100 0.100 12 0 "[ . 1 . 2]" 1
210 1 15 PHE QD 1 37 LEU MD1 1.800 . 6.000 4.606 4.244 4.899 . 0 0 "[ . 1 . 2]" 1
211 1 15 PHE QD 1 37 LEU MD2 1.800 . 6.000 4.098 3.837 4.813 . 0 0 "[ . 1 . 2]" 1
212 1 15 PHE QD 1 99 LEU QD 1.800 . 2.900 2.500 2.026 2.933 0.033 17 0 "[ . 1 . 2]" 1
213 1 15 PHE QD 1 102 TYR QB 1.800 . 5.000 4.086 3.714 4.533 . 0 0 "[ . 1 . 2]" 1
214 1 15 PHE QD 1 103 LEU QD 1.800 . 5.000 3.036 2.749 3.452 . 0 0 "[ . 1 . 2]" 1
215 1 15 PHE QE 1 20 LEU MD1 1.800 . 6.000 5.157 2.440 5.604 . 0 0 "[ . 1 . 2]" 1
216 1 15 PHE QE 1 20 LEU MD2 1.800 . 5.000 3.806 2.256 5.064 0.064 4 0 "[ . 1 . 2]" 1
217 1 15 PHE QE 1 25 VAL MG1 1.800 . 5.000 3.781 2.192 4.220 . 0 0 "[ . 1 . 2]" 1
218 1 15 PHE QE 1 25 VAL QG 1.800 . 5.000 2.353 2.043 2.697 . 0 0 "[ . 1 . 2]" 1
219 1 15 PHE QE 1 25 VAL MG2 1.800 . 5.000 2.474 2.049 4.090 . 0 0 "[ . 1 . 2]" 1
220 1 15 PHE QE 1 37 LEU MD1 1.800 . 6.000 4.629 3.489 5.128 . 0 0 "[ . 1 . 2]" 1
221 1 15 PHE QE 1 37 LEU MD2 1.800 . 6.000 2.405 2.137 3.251 . 0 0 "[ . 1 . 2]" 1
222 1 15 PHE QE 1 37 LEU HG 1.800 . 6.000 4.740 3.160 5.627 . 0 0 "[ . 1 . 2]" 1
223 1 15 PHE QE 1 103 LEU MD1 1.800 . 5.000 3.484 2.201 4.486 . 0 0 "[ . 1 . 2]" 1
224 1 15 PHE QE 1 103 LEU MD2 1.800 . 5.000 2.919 2.174 4.606 . 0 0 "[ . 1 . 2]" 1
225 1 15 PHE HZ 1 23 HIS HB2 1.800 . 5.000 2.405 2.245 2.876 . 0 0 "[ . 1 . 2]" 1
226 1 15 PHE HZ 1 23 HIS HB3 1.800 . 5.000 2.835 2.587 3.270 . 0 0 "[ . 1 . 2]" 1
227 1 15 PHE HZ 1 23 HIS HD1 1.800 . 5.000 5.025 4.888 5.103 0.103 1 0 "[ . 1 . 2]" 1
228 1 15 PHE HZ 1 23 HIS HD2 1.800 . 5.000 4.507 4.124 4.871 . 0 0 "[ . 1 . 2]" 1
229 1 15 PHE HZ 1 25 VAL MG1 1.800 . 5.000 4.337 2.709 4.691 . 0 0 "[ . 1 . 2]" 1
230 1 15 PHE HZ 1 25 VAL MG2 1.800 . 5.000 2.226 2.015 3.891 . 0 0 "[ . 1 . 2]" 1
231 1 15 PHE HZ 1 37 LEU HG 1.800 . 6.000 4.974 3.436 6.012 0.012 20 0 "[ . 1 . 2]" 1
232 1 16 LYS H 1 16 LYS HB2 1.800 . 3.500 2.455 2.414 2.491 . 0 0 "[ . 1 . 2]" 1
233 1 16 LYS H 1 16 LYS HB3 1.800 . 3.500 3.300 2.597 3.606 0.106 10 0 "[ . 1 . 2]" 1
234 1 16 LYS H 1 17 THR H 1.800 . 3.500 2.710 2.609 2.805 . 0 0 "[ . 1 . 2]" 1
235 1 16 LYS H 1 18 ARG H 1.800 . 5.000 3.972 3.896 4.125 . 0 0 "[ . 1 . 2]" 1
236 1 16 LYS H 1 20 LEU MD1 1.800 . 5.000 4.837 3.981 5.089 0.089 19 0 "[ . 1 . 2]" 1
237 1 16 LYS H 1 20 LEU MD2 1.800 . 5.000 4.541 4.250 4.869 . 0 0 "[ . 1 . 2]" 1
238 1 16 LYS HA 1 16 LYS QE 1.800 . 5.000 4.637 4.494 4.989 . 0 0 "[ . 1 . 2]" 1
239 1 16 LYS HA 1 17 THR H 1.800 . 3.500 3.523 3.281 3.557 0.057 4 0 "[ . 1 . 2]" 1
240 1 16 LYS HA 1 18 ARG H 1.800 . 5.000 4.019 3.896 4.196 . 0 0 "[ . 1 . 2]" 1
241 1 16 LYS HA 1 19 CYS H 1.800 . 5.000 4.099 3.893 4.632 . 0 0 "[ . 1 . 2]" 1
242 1 16 LYS HA 1 19 CYS QB 1.800 . 5.000 4.314 3.770 5.008 0.008 8 0 "[ . 1 . 2]" 1
243 1 16 LYS HA 1 20 LEU H 1.800 . 5.000 4.373 3.550 5.064 0.064 8 0 "[ . 1 . 2]" 1
244 1 16 LYS HA 1 20 LEU QB 1.800 . 5.000 3.576 2.222 4.631 . 0 0 "[ . 1 . 2]" 1
245 1 16 LYS HA 1 20 LEU MD1 1.800 . 5.000 2.607 2.152 3.427 . 0 0 "[ . 1 . 2]" 1
246 1 16 LYS HA 1 20 LEU MD2 1.800 . 5.000 2.485 2.126 3.104 . 0 0 "[ . 1 . 2]" 1
247 1 16 LYS HB2 1 17 THR H 1.800 . 5.000 3.158 2.736 3.941 . 0 0 "[ . 1 . 2]" 1
248 1 16 LYS HB3 1 17 THR H 1.800 . 5.000 3.446 2.610 4.261 . 0 0 "[ . 1 . 2]" 1
249 1 17 THR H 1 17 THR MG 1.800 . 2.900 2.291 1.919 2.729 . 0 0 "[ . 1 . 2]" 1
250 1 17 THR H 1 18 ARG H 1.800 . 3.500 2.424 1.967 2.487 . 0 0 "[ . 1 . 2]" 1
251 1 17 THR H 1 19 CYS H 1.800 . 5.000 4.407 3.836 4.799 . 0 0 "[ . 1 . 2]" 1
252 1 17 THR HA 1 17 THR MG 1.800 . 3.500 2.453 2.310 3.175 . 0 0 "[ . 1 . 2]" 1
253 1 17 THR HA 1 18 ARG H 1.800 . 3.500 3.374 3.281 3.429 . 0 0 "[ . 1 . 2]" 1
254 1 17 THR HA 1 18 ARG HG2 1.800 . 5.000 5.036 5.011 5.074 0.074 19 0 "[ . 1 . 2]" 1
255 1 17 THR HA 1 18 ARG HG3 1.800 . 5.000 4.364 4.286 4.557 . 0 0 "[ . 1 . 2]" 1
256 1 17 THR HA 1 19 CYS H 1.800 . 5.000 4.517 4.216 4.769 . 0 0 "[ . 1 . 2]" 1
257 1 17 THR HA 1 20 LEU H 1.800 . 6.000 5.560 4.997 6.059 0.059 19 0 "[ . 1 . 2]" 1
258 1 17 THR MG 1 18 ARG H 1.800 . 5.000 4.005 2.511 4.224 . 0 0 "[ . 1 . 2]" 1
259 1 17 THR MG 1 18 ARG HA 1.800 . 6.000 5.552 4.068 5.674 . 0 0 "[ . 1 . 2]" 1
260 1 18 ARG H 1 18 ARG HG2 1.800 . 5.000 4.106 3.935 4.189 . 0 0 "[ . 1 . 2]" 1
261 1 18 ARG H 1 18 ARG HG3 1.800 . 5.000 3.275 3.065 3.466 . 0 0 "[ . 1 . 2]" 1
262 1 18 ARG H 1 19 CYS H 1.800 . 3.500 2.385 1.940 2.782 . 0 0 "[ . 1 . 2]" 1
263 1 18 ARG H 1 20 LEU H 1.800 . 5.000 4.267 3.643 5.005 0.005 19 0 "[ . 1 . 2]" 1
264 1 18 ARG HA 1 18 ARG HD2 1.800 . 5.000 4.602 4.567 4.769 . 0 0 "[ . 1 . 2]" 1
265 1 18 ARG HA 1 18 ARG HD3 1.800 . 5.000 4.254 4.159 4.581 . 0 0 "[ . 1 . 2]" 1
266 1 18 ARG HA 1 19 CYS H 1.800 . 5.000 2.943 2.729 3.204 . 0 0 "[ . 1 . 2]" 1
267 1 18 ARG HA 1 20 LEU H 1.800 . 6.000 4.492 4.064 5.144 . 0 0 "[ . 1 . 2]" 1
268 1 18 ARG HA 1 20 LEU MD1 1.800 . 6.000 5.602 3.543 6.018 0.018 7 0 "[ . 1 . 2]" 1
269 1 18 ARG HA 1 20 LEU MD2 1.800 . 6.000 5.274 3.591 6.185 0.185 3 0 "[ . 1 . 2]" 1
270 1 18 ARG QB 1 19 CYS H 1.800 . 5.000 3.796 3.562 3.919 . 0 0 "[ . 1 . 2]" 1
271 1 18 ARG QB 1 90 LEU MD1 1.800 . 5.000 4.491 3.543 5.052 0.052 7 0 "[ . 1 . 2]" 1
272 1 18 ARG QB 1 90 LEU MD2 1.800 . 5.000 4.639 3.519 5.060 0.060 4 0 "[ . 1 . 2]" 1
273 1 18 ARG HB2 1 87 PHE QD 1.800 . 6.000 5.231 4.395 6.012 0.012 1 0 "[ . 1 . 2]" 1
274 1 18 ARG HB3 1 87 PHE QD 1.800 . 6.000 4.086 3.352 4.763 . 0 0 "[ . 1 . 2]" 1
275 1 18 ARG QG 1 87 PHE QE 1.800 . 5.000 4.806 3.857 5.058 0.058 15 0 "[ . 1 . 2]" 1
276 1 19 CYS HA 1 20 LEU QD 1.800 . 5.000 4.109 3.249 4.740 . 0 0 "[ . 1 . 2]" 1
277 1 19 CYS HA 1 20 LEU HG 1.800 . 6.300 5.404 4.719 6.455 0.155 1 0 "[ . 1 . 2]" 1
278 1 19 CYS HA 1 23 HIS QB 1.800 . 5.000 4.866 4.392 5.178 0.178 10 0 "[ . 1 . 2]" 1
279 1 19 CYS HA 1 23 HIS HD2 1.800 . 5.000 4.621 4.212 5.024 0.024 20 0 "[ . 1 . 2]" 1
280 1 19 CYS QB 1 23 HIS HD2 1.800 . 6.000 4.947 4.680 5.534 . 0 0 "[ . 1 . 2]" 1
281 1 19 CYS QB 1 87 PHE QD 1.800 . 6.000 4.841 3.639 5.860 . 0 0 "[ . 1 . 2]" 1
282 1 19 CYS QB 2 1 HEC HHC 1.800 . 5.000 4.282 3.749 4.682 . 0 0 "[ . 1 . 2]" 1
283 1 19 CYS HB2 1 20 LEU H 1.800 . 5.000 4.277 3.838 4.693 . 0 0 "[ . 1 . 2]" 1
284 1 19 CYS HB2 1 20 LEU HA 1.800 . 6.000 5.682 5.487 5.869 . 0 0 "[ . 1 . 2]" 1
285 1 19 CYS HB2 2 1 HEC HAB 1.800 . 5.000 2.759 2.343 3.016 . 0 0 "[ . 1 . 2]" 1
286 1 19 CYS HB3 1 20 LEU H 1.800 . 5.000 3.772 3.166 4.387 . 0 0 "[ . 1 . 2]" 1
287 1 19 CYS HB3 1 20 LEU HA 1.800 . 5.000 4.339 4.021 4.698 . 0 0 "[ . 1 . 2]" 1
288 1 19 CYS HB3 2 1 HEC HAB 1.800 . 5.000 3.864 3.587 4.017 . 0 0 "[ . 1 . 2]" 1
289 1 20 LEU H 1 20 LEU MD1 1.800 . 5.000 3.521 1.683 4.102 0.117 12 0 "[ . 1 . 2]" 1
290 1 20 LEU H 1 20 LEU MD2 1.800 . 5.000 2.588 1.704 4.049 0.096 18 0 "[ . 1 . 2]" 1
291 1 20 LEU H 1 20 LEU HG 1.800 . 5.000 2.577 1.884 4.153 . 0 0 "[ . 1 . 2]" 1
292 1 20 LEU H 1 21 GLN H 1.800 . 5.000 2.365 1.767 4.196 0.033 18 0 "[ . 1 . 2]" 1
293 1 20 LEU HA 1 20 LEU MD1 1.800 . 5.000 3.780 2.195 4.119 . 0 0 "[ . 1 . 2]" 1
294 1 20 LEU HA 1 20 LEU MD2 1.800 . 5.000 2.769 2.038 3.874 . 0 0 "[ . 1 . 2]" 1
295 1 20 LEU HA 1 21 GLN H 1.800 . 5.000 3.459 2.952 3.531 . 0 0 "[ . 1 . 2]" 1
296 1 20 LEU HA 1 22 CYS H 1.800 . 6.000 3.485 3.017 4.090 . 0 0 "[ . 1 . 2]" 1
297 1 20 LEU HA 1 23 HIS H 1.800 . 6.000 4.498 3.726 5.121 . 0 0 "[ . 1 . 2]" 1
298 1 21 GLN H 1 21 GLN QG 1.800 . 5.000 2.189 1.865 3.243 . 0 0 "[ . 1 . 2]" 1
299 1 21 GLN H 1 22 CYS H 1.800 . 5.000 2.802 2.527 2.987 . 0 0 "[ . 1 . 2]" 1
300 1 21 GLN QB 1 21 GLN HE22 1.800 . 5.000 3.852 3.670 4.097 . 0 0 "[ . 1 . 2]" 1
301 1 21 GLN HB2 1 21 GLN HE21 1.800 . 5.000 3.576 3.069 4.434 . 0 0 "[ . 1 . 2]" 1
302 1 21 GLN HB3 1 21 GLN HE21 1.800 . 5.000 4.230 4.013 4.416 . 0 0 "[ . 1 . 2]" 1
303 1 21 GLN HG2 1 22 CYS H 1.800 . 5.000 2.939 2.125 4.097 . 0 0 "[ . 1 . 2]" 1
304 1 21 GLN HG2 1 23 HIS H 1.800 . 6.000 5.085 4.552 5.715 . 0 0 "[ . 1 . 2]" 1
305 1 21 GLN HG3 1 22 CYS H 1.800 . 5.000 3.071 2.255 3.670 . 0 0 "[ . 1 . 2]" 1
306 1 21 GLN HG3 1 23 HIS H 1.800 . 5.000 5.013 4.881 5.117 0.117 5 0 "[ . 1 . 2]" 1
307 1 22 CYS H 1 23 HIS H 1.800 . 5.000 2.892 2.391 3.193 . 0 0 "[ . 1 . 2]" 1
308 1 22 CYS H 1 23 HIS QB 1.800 . 5.000 4.521 4.304 4.793 . 0 0 "[ . 1 . 2]" 1
309 1 22 CYS H 1 24 THR HA 1.800 . 5.000 4.849 4.362 5.148 0.148 7 0 "[ . 1 . 2]" 1
310 1 22 CYS HA 1 33 VAL H 1.800 . 5.000 3.566 2.770 4.051 . 0 0 "[ . 1 . 2]" 1
311 1 22 CYS HA 1 34 GLY H 1.800 . 5.000 3.382 2.598 3.925 . 0 0 "[ . 1 . 2]" 1
312 1 22 CYS QB 1 23 HIS HD2 1.800 . 3.500 2.951 2.688 3.199 . 0 0 "[ . 1 . 2]" 1
313 1 22 CYS QB 1 33 VAL H 1.800 . 5.000 4.598 4.394 4.857 . 0 0 "[ . 1 . 2]" 1
314 1 22 CYS QB 2 1 HEC HAB 1.800 . 6.000 5.320 4.859 5.986 . 0 0 "[ . 1 . 2]" 1
315 1 22 CYS QB 2 1 HEC HAC 1.800 . 5.000 2.347 2.296 2.402 . 0 0 "[ . 1 . 2]" 1
316 1 22 CYS HB2 1 23 HIS H 1.800 . 5.000 2.005 1.874 2.300 . 0 0 "[ . 1 . 2]" 1
317 1 22 CYS HB2 1 34 GLY H 1.800 . 5.000 4.691 4.219 4.944 . 0 0 "[ . 1 . 2]" 1
318 1 22 CYS HB2 2 1 HEC HHC 1.800 . 5.000 3.707 3.518 4.058 . 0 0 "[ . 1 . 2]" 1
319 1 22 CYS HB2 2 1 HEC HHD 1.800 . 5.000 4.975 4.855 5.057 0.057 8 0 "[ . 1 . 2]" 1
320 1 22 CYS HB3 1 23 HIS H 1.800 . 5.000 2.587 2.290 3.086 . 0 0 "[ . 1 . 2]" 1
321 1 22 CYS HB3 1 34 GLY H 1.800 . 5.000 3.033 2.496 3.353 . 0 0 "[ . 1 . 2]" 1
322 1 22 CYS HB3 2 1 HEC HHC 1.800 . 5.000 4.972 4.740 5.041 0.041 10 0 "[ . 1 . 2]" 1
323 1 22 CYS HB3 2 1 HEC HHD 1.800 . 5.000 3.751 3.516 3.860 . 0 0 "[ . 1 . 2]" 1
324 1 23 HIS H 1 23 HIS HD1 1.800 . 5.000 4.617 4.376 4.956 . 0 0 "[ . 1 . 2]" 1
325 1 23 HIS HA 1 24 THR H 1.800 . 3.500 3.033 2.192 3.561 0.061 10 0 "[ . 1 . 2]" 1
326 1 23 HIS HA 1 37 LEU MD1 1.800 . 6.000 5.435 4.939 6.061 0.061 7 0 "[ . 1 . 2]" 1
327 1 23 HIS HA 1 37 LEU MD2 1.800 . 6.000 4.849 3.773 5.455 . 0 0 "[ . 1 . 2]" 1
328 1 23 HIS QB 1 37 LEU H 1.800 . 5.000 4.455 2.219 5.062 0.062 3 0 "[ . 1 . 2]" 1
329 1 23 HIS HB2 1 24 THR H 1.800 . 5.000 3.401 2.592 4.474 . 0 0 "[ . 1 . 2]" 1
330 1 23 HIS HB2 1 37 LEU MD1 1.800 . 5.000 5.049 4.727 5.161 0.161 8 0 "[ . 1 . 2]" 1
331 1 23 HIS HB2 1 37 LEU MD2 1.800 . 6.000 3.350 2.901 3.956 . 0 0 "[ . 1 . 2]" 1
332 1 23 HIS HB3 1 24 THR H 1.800 . 5.000 3.710 3.409 4.259 . 0 0 "[ . 1 . 2]" 1
333 1 23 HIS HB3 1 37 LEU MD1 1.800 . 5.000 4.261 3.981 4.366 . 0 0 "[ . 1 . 2]" 1
334 1 23 HIS HB3 1 37 LEU MD2 1.800 . 5.000 2.988 2.054 3.773 . 0 0 "[ . 1 . 2]" 1
335 1 23 HIS HD1 1 24 THR H 1.800 . 6.000 5.419 4.496 5.859 . 0 0 "[ . 1 . 2]" 1
336 1 23 HIS HD1 1 25 VAL QG 1.800 . 5.000 4.387 3.842 5.117 0.117 7 0 "[ . 1 . 2]" 1
337 1 23 HIS HD1 1 34 GLY QA 1.800 . 6.000 3.992 3.716 4.398 . 0 0 "[ . 1 . 2]" 1
338 1 23 HIS HD1 1 35 PRO QB 1.800 . 6.000 3.740 3.335 4.340 . 0 0 "[ . 1 . 2]" 1
339 1 23 HIS HD1 1 35 PRO QG 1.800 . 6.000 3.114 2.770 4.027 . 0 0 "[ . 1 . 2]" 1
340 1 23 HIS HD1 1 37 LEU QB 1.800 . 5.000 2.035 1.747 4.852 0.053 16 0 "[ . 1 . 2]" 1
341 1 23 HIS HD1 1 37 LEU MD1 1.800 . 5.000 2.883 2.384 3.890 . 0 0 "[ . 1 . 2]" 1
342 1 23 HIS HD1 1 37 LEU MD2 1.800 . 5.000 3.225 2.008 3.649 . 0 0 "[ . 1 . 2]" 1
343 1 23 HIS HD1 1 37 LEU HG 1.800 . 5.000 4.761 4.463 5.016 0.016 8 0 "[ . 1 . 2]" 1
344 1 23 HIS HD2 1 37 LEU MD1 1.800 . 5.000 4.956 4.351 5.120 0.120 7 0 "[ . 1 . 2]" 1
345 1 23 HIS HD2 1 37 LEU MD2 1.800 . 5.000 3.784 3.517 4.137 . 0 0 "[ . 1 . 2]" 1
346 1 23 HIS HD2 1 85 MET ME 1.800 . 6.000 5.150 4.966 5.451 . 0 0 "[ . 1 . 2]" 1
347 1 23 HIS HD2 2 1 HEC HHB 1.800 . 6.000 5.518 5.290 5.846 . 0 0 "[ . 1 . 2]" 1
348 1 23 HIS HD2 2 1 HEC HHC 1.800 . 5.000 3.262 3.200 3.331 . 0 0 "[ . 1 . 2]" 1
349 1 23 HIS HE1 1 35 PRO HD2 1.800 . 5.000 2.390 2.273 2.838 . 0 0 "[ . 1 . 2]" 1
350 1 23 HIS HE1 1 35 PRO HD3 1.800 . 5.000 4.042 3.929 4.498 . 0 0 "[ . 1 . 2]" 1
351 1 23 HIS HE1 1 37 LEU MD1 1.800 . 6.000 2.841 2.301 4.167 . 0 0 "[ . 1 . 2]" 1
352 1 23 HIS HE1 1 37 LEU MD2 1.800 . 6.000 3.829 3.278 4.064 . 0 0 "[ . 1 . 2]" 1
353 1 24 THR HA 1 24 THR MG 1.800 . 3.500 2.289 2.125 3.138 . 0 0 "[ . 1 . 2]" 1
354 1 24 THR HA 1 25 VAL H 1.800 . 5.000 2.698 2.215 3.560 . 0 0 "[ . 1 . 2]" 1
355 1 24 THR HA 1 26 GLU H 1.800 . 5.000 3.971 3.253 4.760 . 0 0 "[ . 1 . 2]" 1
356 1 24 THR HB 1 25 VAL H 1.800 . 5.000 4.052 2.559 4.419 . 0 0 "[ . 1 . 2]" 1
357 1 24 THR MG 1 25 VAL H 1.800 . 5.000 3.567 1.859 4.109 . 0 0 "[ . 1 . 2]" 1
358 1 24 THR MG 1 26 GLU H 1.800 . 3.500 3.029 1.891 3.665 0.165 8 0 "[ . 1 . 2]" 1
359 1 25 VAL H 1 25 VAL MG1 1.800 . 5.000 3.741 2.429 4.032 . 0 0 "[ . 1 . 2]" 1
360 1 25 VAL H 1 25 VAL MG2 1.800 . 5.000 2.437 2.089 3.723 . 0 0 "[ . 1 . 2]" 1
361 1 25 VAL H 1 26 GLU H 1.800 . 3.500 3.147 2.812 3.629 0.129 4 0 "[ . 1 . 2]" 1
362 1 25 VAL H 1 106 ALA MB 1.800 . 6.000 6.040 5.674 6.184 0.184 14 0 "[ . 1 . 2]" 1
363 1 25 VAL HA 1 25 VAL HB 1.800 . 2.900 2.996 2.583 3.023 0.123 3 0 "[ . 1 . 2]" 1
364 1 25 VAL HA 1 25 VAL MG1 1.800 . 5.000 2.398 2.201 3.163 . 0 0 "[ . 1 . 2]" 1
365 1 25 VAL HA 1 25 VAL MG2 1.800 . 5.000 2.307 2.196 2.404 . 0 0 "[ . 1 . 2]" 1
366 1 25 VAL HA 1 27 LYS H 1.800 . 5.000 3.189 2.822 3.929 . 0 0 "[ . 1 . 2]" 1
367 1 25 VAL HB 1 26 GLU H 1.800 . 5.000 3.761 2.383 4.543 . 0 0 "[ . 1 . 2]" 1
368 1 25 VAL HB 1 37 LEU QD 1.800 . 6.000 5.082 3.395 5.771 . 0 0 "[ . 1 . 2]" 1
369 1 25 VAL HB 1 106 ALA MB 1.800 . 5.000 4.644 4.174 5.041 0.041 6 0 "[ . 1 . 2]" 1
370 1 25 VAL QG 1 37 LEU H 1.800 . 5.000 4.533 2.951 5.063 0.063 16 0 "[ . 1 . 2]" 1
371 1 25 VAL QG 1 102 TYR QE 1.800 . 5.000 2.514 2.081 3.121 . 0 0 "[ . 1 . 2]" 1
372 1 25 VAL QG 1 103 LEU MD1 1.800 . 6.000 4.578 3.337 5.532 . 0 0 "[ . 1 . 2]" 1
373 1 25 VAL QG 1 103 LEU MD2 1.800 . 6.000 4.063 3.317 5.259 . 0 0 "[ . 1 . 2]" 1
374 1 25 VAL MG1 1 26 GLU H 1.800 . 5.000 3.677 3.038 4.168 . 0 0 "[ . 1 . 2]" 1
375 1 25 VAL MG1 1 29 GLY H 1.800 . 6.000 5.201 3.984 6.153 0.153 12 0 "[ . 1 . 2]" 1
376 1 25 VAL MG1 1 37 LEU MD1 1.800 . 6.000 5.876 5.444 6.073 0.073 14 0 "[ . 1 . 2]" 1
377 1 25 VAL MG1 1 37 LEU MD2 1.800 . 6.000 4.495 3.754 5.161 . 0 0 "[ . 1 . 2]" 1
378 1 25 VAL MG1 1 102 TYR QD 1.800 . 5.000 4.575 3.784 5.008 0.008 1 0 "[ . 1 . 2]" 1
379 1 25 VAL MG1 1 106 ALA MB 1.800 . 3.500 2.388 2.169 3.467 . 0 0 "[ . 1 . 2]" 1
380 1 25 VAL MG2 1 26 GLU H 1.800 . 5.000 4.177 3.816 4.353 . 0 0 "[ . 1 . 2]" 1
381 1 25 VAL MG2 1 29 GLY H 1.800 . 6.000 5.875 4.974 6.127 0.127 20 0 "[ . 1 . 2]" 1
382 1 25 VAL MG2 1 37 LEU QD 1.800 . 3.500 2.883 2.393 3.434 . 0 0 "[ . 1 . 2]" 1
383 1 25 VAL MG2 1 102 TYR QD 1.800 . 5.000 4.345 4.005 4.662 . 0 0 "[ . 1 . 2]" 1
384 1 25 VAL MG2 1 106 ALA MB 1.800 . 3.500 2.894 2.111 3.534 0.034 5 0 "[ . 1 . 2]" 1
385 1 26 GLU H 1 26 GLU QB 1.800 . 3.500 2.506 2.257 3.127 . 0 0 "[ . 1 . 2]" 1
386 1 26 GLU HA 1 27 LYS H 1.800 . 5.000 3.066 2.913 3.334 . 0 0 "[ . 1 . 2]" 1
387 1 26 GLU QB 1 29 GLY QA 1.800 . 5.000 2.422 2.180 3.148 . 0 0 "[ . 1 . 2]" 1
388 1 26 GLU HB2 1 27 LYS H 1.800 . 5.000 4.245 3.717 4.570 . 0 0 "[ . 1 . 2]" 1
389 1 26 GLU HB3 1 27 LYS H 1.800 . 5.000 4.098 3.389 4.418 . 0 0 "[ . 1 . 2]" 1
390 1 27 LYS H 1 27 LYS QD 1.800 . 5.000 3.315 2.539 4.749 . 0 0 "[ . 1 . 2]" 1
391 1 27 LYS H 1 27 LYS QE 1.800 . 5.000 4.526 4.037 5.066 0.066 9 0 "[ . 1 . 2]" 1
392 1 27 LYS H 1 27 LYS HG2 1.800 . 5.000 3.636 2.760 5.265 0.265 20 0 "[ . 1 . 2]" 1
393 1 27 LYS H 1 27 LYS HG3 1.800 . 5.000 3.898 2.508 4.529 . 0 0 "[ . 1 . 2]" 1
394 1 27 LYS H 1 38 HIS HE1 1.800 . 5.000 3.874 3.218 4.390 . 0 0 "[ . 1 . 2]" 1
395 1 27 LYS HA 1 27 LYS QD 1.800 . 5.000 2.671 2.092 3.969 . 0 0 "[ . 1 . 2]" 1
396 1 27 LYS HA 1 27 LYS HG2 1.800 . 3.500 3.112 2.280 3.546 0.046 15 0 "[ . 1 . 2]" 1
397 1 27 LYS HA 1 27 LYS HG3 1.800 . 3.500 3.146 2.276 3.748 0.248 2 0 "[ . 1 . 2]" 1
398 1 27 LYS HA 1 28 GLY H 1.800 . 5.000 2.642 2.145 3.500 . 0 0 "[ . 1 . 2]" 1
399 1 27 LYS HA 1 29 GLY H 1.800 . 6.000 4.527 3.476 5.568 . 0 0 "[ . 1 . 2]" 1
400 1 27 LYS HA 1 38 HIS HD2 1.800 . 5.000 4.109 2.884 5.028 0.028 19 0 "[ . 1 . 2]" 1
401 1 27 LYS QB 1 28 GLY H 1.800 . 5.000 3.778 2.906 4.005 . 0 0 "[ . 1 . 2]" 1
402 1 27 LYS QB 1 38 HIS HD2 1.800 . 6.000 5.354 4.178 6.014 0.014 3 0 "[ . 1 . 2]" 1
403 1 27 LYS QB 1 38 HIS HE1 1.800 . 5.000 4.812 4.106 5.067 0.067 7 0 "[ . 1 . 2]" 1
404 1 27 LYS HB2 1 27 LYS QE 1.800 . 5.000 3.748 2.237 4.540 . 0 0 "[ . 1 . 2]" 1
405 1 27 LYS HB3 1 27 LYS QE 1.800 . 5.000 3.848 2.611 4.580 . 0 0 "[ . 1 . 2]" 1
406 1 27 LYS QD 1 28 GLY H 1.800 . 5.000 4.577 4.193 5.202 0.202 12 0 "[ . 1 . 2]" 1
407 1 27 LYS QD 1 38 HIS HE1 1.800 . 5.000 3.336 2.292 5.060 0.060 10 0 "[ . 1 . 2]" 1
408 1 27 LYS QE 1 27 LYS HG2 1.800 . 5.000 2.647 2.254 3.305 . 0 0 "[ . 1 . 2]" 1
409 1 27 LYS QE 1 27 LYS HG3 1.800 . 5.000 2.538 2.240 3.368 . 0 0 "[ . 1 . 2]" 1
410 1 27 LYS QE 1 28 GLY H 1.800 . 6.000 5.895 4.920 6.104 0.104 3 0 "[ . 1 . 2]" 1
411 1 27 LYS QE 1 38 HIS HE1 1.800 . 6.000 4.013 2.274 6.037 0.037 8 0 "[ . 1 . 2]" 1
412 1 27 LYS QG 1 38 HIS HE1 1.800 . 5.000 4.152 2.924 5.033 0.033 13 0 "[ . 1 . 2]" 1
413 1 27 LYS HG2 1 28 GLY H 1.800 . 6.000 5.142 4.292 5.741 . 0 0 "[ . 1 . 2]" 1
414 1 27 LYS HG3 1 28 GLY H 1.800 . 6.000 5.144 3.938 5.962 . 0 0 "[ . 1 . 2]" 1
415 1 28 GLY H 1 29 GLY H 1.800 . 5.000 2.380 1.790 3.361 0.010 2 0 "[ . 1 . 2]" 1
416 1 28 GLY HA2 1 29 GLY H 1.800 . 5.000 2.909 2.382 3.257 . 0 0 "[ . 1 . 2]" 1
417 1 28 GLY HA3 1 29 GLY H 1.800 . 5.000 3.488 3.354 3.586 . 0 0 "[ . 1 . 2]" 1
418 1 29 GLY QA 1 36 ASN QD 1.800 . 5.000 4.113 3.099 5.000 0.000 1 0 "[ . 1 . 2]" 1
419 1 30 PRO HA 1 31 HIS H 1.800 . 3.500 2.347 2.223 2.498 . 0 0 "[ . 1 . 2]" 1
420 1 30 PRO QB 1 31 HIS H 1.800 . 3.500 2.905 2.538 3.260 . 0 0 "[ . 1 . 2]" 1
421 1 31 HIS HA 1 32 LYS H 1.800 . 5.000 2.626 2.195 3.574 . 0 0 "[ . 1 . 2]" 1
422 1 31 HIS HA 1 35 PRO HA 1.800 . 5.000 4.067 3.534 4.729 . 0 0 "[ . 1 . 2]" 1
423 1 31 HIS HA 1 36 ASN H 1.800 . 6.000 3.764 3.244 4.647 . 0 0 "[ . 1 . 2]" 1
424 1 31 HIS HA 1 36 ASN QB 1.800 . 5.000 3.816 3.454 4.763 . 0 0 "[ . 1 . 2]" 1
425 1 31 HIS QB 1 36 ASN H 1.800 . 6.000 3.679 3.410 4.324 . 0 0 "[ . 1 . 2]" 1
426 1 31 HIS QB 1 51 TYR QD 1.800 . 5.000 2.868 2.579 3.351 . 0 0 "[ . 1 . 2]" 1
427 1 31 HIS HB2 1 32 LYS H 1.800 . 5.000 3.664 2.450 4.450 . 0 0 "[ . 1 . 2]" 1
428 1 31 HIS HB2 1 51 TYR QE 1.800 . 6.000 6.029 5.663 6.097 0.097 8 0 "[ . 1 . 2]" 1
429 1 31 HIS HB3 1 32 LYS H 1.800 . 5.000 3.369 3.025 4.211 . 0 0 "[ . 1 . 2]" 1
430 1 31 HIS HB3 1 51 TYR QE 1.800 . 6.000 5.063 4.868 5.544 . 0 0 "[ . 1 . 2]" 1
431 1 31 HIS HD2 1 51 TYR H 1.800 . 3.500 3.492 3.241 3.567 0.067 20 0 "[ . 1 . 2]" 1
432 1 31 HIS HD2 1 51 TYR HA 1.800 . 5.000 4.629 4.085 4.993 . 0 0 "[ . 1 . 2]" 1
433 1 31 HIS HD2 1 51 TYR QB 1.800 . 5.000 3.998 3.474 4.400 . 0 0 "[ . 1 . 2]" 1
434 1 31 HIS HE1 1 35 PRO HA 1.800 . 5.000 4.290 3.697 4.483 . 0 0 "[ . 1 . 2]" 1
435 1 31 HIS HE1 1 35 PRO HB2 1.800 . 5.000 4.736 4.094 5.020 0.020 17 0 "[ . 1 . 2]" 1
436 1 31 HIS HE1 1 35 PRO HB3 1.800 . 5.000 4.941 4.367 5.023 0.023 14 0 "[ . 1 . 2]" 1
437 1 31 HIS HE1 1 36 ASN H 1.800 . 5.000 2.558 2.137 2.762 . 0 0 "[ . 1 . 2]" 1
438 1 31 HIS HE1 1 36 ASN HB2 1.800 . 5.000 2.381 2.276 2.576 . 0 0 "[ . 1 . 2]" 1
439 1 31 HIS HE1 1 36 ASN HB3 1.800 . 5.000 2.754 2.279 3.124 . 0 0 "[ . 1 . 2]" 1
440 1 31 HIS HE1 1 48 ALA MB 1.800 . 5.000 3.089 2.343 3.528 . 0 0 "[ . 1 . 2]" 1
441 1 31 HIS HE1 1 51 TYR H 1.800 . 5.000 3.619 2.909 4.406 . 0 0 "[ . 1 . 2]" 1
442 1 31 HIS HE1 1 51 TYR QB 1.800 . 6.000 3.653 3.063 4.182 . 0 0 "[ . 1 . 2]" 1
443 1 32 LYS H 1 32 LYS QD 1.800 . 6.000 4.356 3.842 5.190 . 0 0 "[ . 1 . 2]" 1
444 1 32 LYS H 1 32 LYS QE 1.800 . 5.000 4.724 4.173 5.133 0.133 3 0 "[ . 1 . 2]" 1
445 1 32 LYS HA 1 32 LYS QD 1.800 . 5.000 3.840 2.232 3.956 . 0 0 "[ . 1 . 2]" 1
446 1 32 LYS HA 1 32 LYS QE 1.800 . 5.000 4.599 3.998 4.983 . 0 0 "[ . 1 . 2]" 1
447 1 32 LYS HA 1 32 LYS QG 1.800 . 5.000 2.355 2.261 2.536 . 0 0 "[ . 1 . 2]" 1
448 1 32 LYS QB 1 33 VAL H 1.800 . 2.900 1.846 1.718 2.639 0.082 12 0 "[ . 1 . 2]" 1
449 1 32 LYS QB 1 34 GLY H 1.800 . 6.000 3.103 2.831 4.334 . 0 0 "[ . 1 . 2]" 1
450 1 32 LYS HB2 1 32 LYS QE 1.800 . 5.000 3.678 2.172 4.013 . 0 0 "[ . 1 . 2]" 1
451 1 32 LYS HB3 1 32 LYS QE 1.800 . 5.000 3.780 2.057 4.189 . 0 0 "[ . 1 . 2]" 1
452 1 32 LYS QD 1 32 LYS QE 1.800 . 5.000 2.070 2.022 2.108 . 0 0 "[ . 1 . 2]" 1
453 1 32 LYS QE 1 32 LYS QG 1.800 . 5.000 2.167 2.091 2.334 . 0 0 "[ . 1 . 2]" 1
454 1 32 LYS QE 1 33 VAL H 1.800 . 6.000 5.207 2.320 6.007 0.007 18 0 "[ . 1 . 2]" 1
455 1 33 VAL H 1 33 VAL HB 1.800 . 2.900 2.505 2.427 2.909 0.009 18 0 "[ . 1 . 2]" 1
456 1 33 VAL H 1 33 VAL MG1 1.800 . 5.000 3.703 2.277 3.915 . 0 0 "[ . 1 . 2]" 1
457 1 33 VAL H 1 33 VAL MG2 1.800 . 5.000 2.446 2.123 3.789 . 0 0 "[ . 1 . 2]" 1
458 1 33 VAL HA 1 33 VAL MG1 1.800 . 5.000 2.411 2.326 3.173 . 0 0 "[ . 1 . 2]" 1
459 1 33 VAL HA 1 33 VAL MG2 1.800 . 5.000 2.294 2.198 2.375 . 0 0 "[ . 1 . 2]" 1
460 1 33 VAL HA 1 51 TYR QD 1.800 . 5.000 5.063 5.013 5.109 0.109 16 0 "[ . 1 . 2]" 1
461 1 33 VAL HB 1 34 GLY H 1.800 . 5.000 2.641 1.964 3.734 . 0 0 "[ . 1 . 2]" 1
462 1 33 VAL HB 2 1 HEC HAC 1.800 . 5.000 2.668 2.430 4.725 . 0 0 "[ . 1 . 2]" 1
463 1 33 VAL HB 2 1 HEC HHD 1.800 . 6.000 4.181 3.872 6.022 0.022 19 0 "[ . 1 . 2]" 1
464 1 33 VAL MG1 1 34 GLY H 1.800 . 5.000 3.190 1.773 3.492 0.027 19 0 "[ . 1 . 2]" 1
465 1 33 VAL MG1 1 34 GLY QA 1.800 . 5.000 3.258 2.768 3.468 . 0 0 "[ . 1 . 2]" 1
466 1 33 VAL MG1 2 1 HEC HAC 1.800 . 5.000 2.400 2.057 2.773 . 0 0 "[ . 1 . 2]" 1
467 1 33 VAL MG1 2 1 HEC HHD 1.800 . 5.000 2.547 2.416 2.971 . 0 0 "[ . 1 . 2]" 1
468 1 33 VAL MG2 1 34 GLY H 1.800 . 5.000 3.900 3.647 3.974 . 0 0 "[ . 1 . 2]" 1
469 1 33 VAL MG2 1 34 GLY QA 1.800 . 5.000 4.871 3.820 4.951 . 0 0 "[ . 1 . 2]" 1
470 1 33 VAL MG2 2 1 HEC HAC 1.800 . 5.000 3.873 3.727 4.053 . 0 0 "[ . 1 . 2]" 1
471 1 33 VAL MG2 2 1 HEC HHD 1.800 . 5.000 5.003 4.082 5.115 0.115 3 0 "[ . 1 . 2]" 1
472 1 34 GLY QA 1 35 PRO HD2 1.800 . 6.000 2.189 2.150 2.220 . 0 0 "[ . 1 . 2]" 1
473 1 34 GLY QA 1 35 PRO HD3 1.800 . 6.000 2.349 2.293 2.383 . 0 0 "[ . 1 . 2]" 1
474 1 34 GLY QA 1 51 TYR QB 1.800 . 5.000 5.062 5.011 5.103 0.103 13 0 "[ . 1 . 2]" 1
475 1 34 GLY QA 2 1 HEC HAC 1.800 . 3.500 3.588 3.523 3.656 0.156 16 0 "[ . 1 . 2]" 1
476 1 34 GLY HA2 1 51 TYR QD 1.800 . 6.000 4.307 4.196 4.536 . 0 0 "[ . 1 . 2]" 1
477 1 34 GLY HA2 1 51 TYR QE 1.800 . 6.000 3.378 3.011 3.858 . 0 0 "[ . 1 . 2]" 1
478 1 34 GLY HA2 2 1 HEC HHD 1.800 . 5.000 3.760 3.487 4.068 . 0 0 "[ . 1 . 2]" 1
479 1 34 GLY HA3 1 51 TYR QD 1.800 . 6.000 5.514 5.324 5.721 . 0 0 "[ . 1 . 2]" 1
480 1 34 GLY HA3 1 51 TYR QE 1.800 . 6.000 4.976 4.585 5.498 . 0 0 "[ . 1 . 2]" 1
481 1 34 GLY HA3 2 1 HEC HHD 1.800 . 5.000 3.405 3.198 3.769 . 0 0 "[ . 1 . 2]" 1
482 1 35 PRO HA 1 36 ASN H 1.800 . 5.000 2.325 2.281 2.375 . 0 0 "[ . 1 . 2]" 1
483 1 35 PRO HA 1 48 ALA MB 1.800 . 5.000 3.779 3.305 4.023 . 0 0 "[ . 1 . 2]" 1
484 1 35 PRO HA 1 51 TYR QD 1.800 . 5.000 3.268 3.045 3.547 . 0 0 "[ . 1 . 2]" 1
485 1 35 PRO QB 1 37 LEU MD1 1.800 . 6.000 3.922 3.614 5.499 . 0 0 "[ . 1 . 2]" 1
486 1 35 PRO QB 1 37 LEU MD2 1.800 . 6.000 5.531 4.485 6.076 0.076 9 0 "[ . 1 . 2]" 1
487 1 35 PRO QB 1 51 TYR QD 1.800 . 5.000 2.433 2.317 2.689 . 0 0 "[ . 1 . 2]" 1
488 1 35 PRO HB2 1 36 ASN H 1.800 . 5.000 3.031 2.895 3.147 . 0 0 "[ . 1 . 2]" 1
489 1 35 PRO HB2 1 48 ALA MB 1.800 . 3.500 3.157 2.609 3.518 0.018 1 0 "[ . 1 . 2]" 1
490 1 35 PRO HB3 1 36 ASN H 1.800 . 5.000 3.541 3.440 3.724 . 0 0 "[ . 1 . 2]" 1
491 1 35 PRO HB3 1 48 ALA MB 1.800 . 3.500 2.711 2.261 2.967 . 0 0 "[ . 1 . 2]" 1
492 1 35 PRO QD 1 51 TYR QD 1.800 . 5.000 3.510 3.335 3.705 . 0 0 "[ . 1 . 2]" 1
493 1 35 PRO QD 1 53 TYR QE 1.800 . 5.000 4.002 3.687 4.641 . 0 0 "[ . 1 . 2]" 1
494 1 35 PRO HD2 2 1 HEC HHA 1.800 . 5.000 3.968 3.499 4.294 . 0 0 "[ . 1 . 2]" 1
495 1 35 PRO HD3 2 1 HEC HHA 1.800 . 5.000 4.735 4.354 5.033 0.033 19 0 "[ . 1 . 2]" 1
496 1 35 PRO QG 1 37 LEU MD1 1.800 . 5.000 3.118 2.811 5.026 0.026 7 0 "[ . 1 . 2]" 1
497 1 35 PRO QG 1 37 LEU QD 1.800 . 6.000 3.044 2.790 4.086 . 0 0 "[ . 1 . 2]" 1
498 1 35 PRO QG 1 37 LEU MD2 1.800 . 5.000 4.832 4.324 5.068 0.068 9 0 "[ . 1 . 2]" 1
499 1 35 PRO QG 1 51 TYR QD 1.800 . 5.000 3.405 3.028 3.861 . 0 0 "[ . 1 . 2]" 1
500 1 35 PRO QG 1 53 TYR HE1 1.800 . 5.000 4.688 4.057 5.080 0.080 17 0 "[ . 1 . 2]" 1
501 1 35 PRO QG 1 53 TYR HE2 1.800 . 5.000 2.442 2.215 3.338 . 0 0 "[ . 1 . 2]" 1
502 1 36 ASN H 1 37 LEU H 1.800 . 6.000 2.905 2.674 4.653 . 0 0 "[ . 1 . 2]" 1
503 1 36 ASN H 1 48 ALA MB 1.800 . 5.000 3.689 3.190 3.953 . 0 0 "[ . 1 . 2]" 1
504 1 36 ASN H 1 51 TYR QD 1.800 . 5.000 4.869 4.640 5.062 0.062 11 0 "[ . 1 . 2]" 1
505 1 36 ASN HA 1 36 ASN QD 1.800 . 5.000 3.592 1.798 3.994 0.002 3 0 "[ . 1 . 2]" 1
506 1 36 ASN HA 1 37 LEU H 1.800 . 5.000 3.342 2.210 3.518 . 0 0 "[ . 1 . 2]" 1
507 1 36 ASN HB2 1 37 LEU H 1.800 . 5.000 3.998 3.865 4.559 . 0 0 "[ . 1 . 2]" 1
508 1 36 ASN HB2 1 48 ALA MB 1.800 . 5.000 4.869 4.355 5.039 0.039 20 0 "[ . 1 . 2]" 1
509 1 36 ASN HB3 1 37 LEU H 1.800 . 5.000 3.102 2.839 4.304 . 0 0 "[ . 1 . 2]" 1
510 1 36 ASN HB3 1 48 ALA MB 1.800 . 5.000 4.636 4.315 4.858 . 0 0 "[ . 1 . 2]" 1
511 1 37 LEU H 1 37 LEU QB 1.800 . 3.500 2.970 2.217 3.143 . 0 0 "[ . 1 . 2]" 1
512 1 37 LEU H 1 37 LEU MD1 1.800 . 5.000 3.635 3.538 3.825 . 0 0 "[ . 1 . 2]" 1
513 1 37 LEU H 1 37 LEU MD2 1.800 . 5.000 4.737 1.665 5.000 0.135 7 0 "[ . 1 . 2]" 1
514 1 37 LEU H 1 37 LEU HG 1.800 . 5.000 4.799 3.513 4.939 . 0 0 "[ . 1 . 2]" 1
515 1 37 LEU H 1 38 HIS H 1.800 . 3.500 2.654 2.346 3.568 0.068 9 0 "[ . 1 . 2]" 1
516 1 37 LEU H 1 103 LEU QD 1.800 . 6.300 6.197 5.031 6.536 0.236 13 0 "[ . 1 . 2]" 1
517 1 37 LEU HA 1 37 LEU MD1 1.800 . 5.000 2.035 1.998 2.227 . 0 0 "[ . 1 . 2]" 1
518 1 37 LEU HA 1 37 LEU MD2 1.800 . 5.000 3.673 2.211 3.770 . 0 0 "[ . 1 . 2]" 1
519 1 37 LEU HA 1 38 HIS H 1.800 . 3.500 2.878 2.499 3.508 0.008 7 0 "[ . 1 . 2]" 1
520 1 37 LEU HA 1 39 GLY H 1.800 . 3.500 3.513 3.362 3.732 0.232 7 0 "[ . 1 . 2]" 1
521 1 37 LEU QB 1 37 LEU MD1 1.800 . 5.000 2.234 2.183 2.306 . 0 0 "[ . 1 . 2]" 1
522 1 37 LEU QB 1 37 LEU MD2 1.800 . 5.000 2.100 2.039 2.501 . 0 0 "[ . 1 . 2]" 1
523 1 37 LEU QB 1 38 HIS H 1.800 . 5.000 3.767 2.703 4.005 . 0 0 "[ . 1 . 2]" 1
524 1 37 LEU QB 1 39 GLY H 1.800 . 6.000 5.033 4.466 5.237 . 0 0 "[ . 1 . 2]" 1
525 1 37 LEU QB 1 40 ILE MD 1.800 . 5.000 4.146 3.666 4.894 . 0 0 "[ . 1 . 2]" 1
526 1 37 LEU QB 2 1 HEC HHB 1.800 . 6.000 5.823 5.478 6.091 0.091 7 0 "[ . 1 . 2]" 1
527 1 37 LEU MD1 1 38 HIS H 1.800 . 6.000 4.345 3.955 4.837 . 0 0 "[ . 1 . 2]" 1
528 1 37 LEU MD1 1 40 ILE MD 1.800 . 5.000 1.947 1.780 2.671 0.020 9 0 "[ . 1 . 2]" 1
529 1 37 LEU MD1 1 40 ILE MG 1.800 . 5.000 3.120 2.120 3.714 . 0 0 "[ . 1 . 2]" 1
530 1 37 LEU MD1 1 41 PHE HZ 1.800 . 6.000 4.913 3.725 5.727 . 0 0 "[ . 1 . 2]" 1
531 1 37 LEU MD1 1 69 MET ME 1.800 . 5.000 3.600 3.104 4.093 . 0 0 "[ . 1 . 2]" 1
532 1 37 LEU MD1 1 103 LEU MD1 1.800 . 5.000 3.247 2.098 3.932 . 0 0 "[ . 1 . 2]" 1
533 1 37 LEU MD1 1 103 LEU MD2 1.800 . 5.000 3.184 2.137 4.335 . 0 0 "[ . 1 . 2]" 1
534 1 37 LEU MD1 2 1 HEC HAA1 1.800 . 6.000 3.743 3.447 4.470 . 0 0 "[ . 1 . 2]" 1
535 1 37 LEU MD1 2 1 HEC HHA 1.800 . 6.000 4.677 4.201 5.936 . 0 0 "[ . 1 . 2]" 1
536 1 37 LEU MD1 2 1 HEC HHB 1.800 . 5.000 3.585 2.955 3.951 . 0 0 "[ . 1 . 2]" 1
537 1 37 LEU MD2 1 38 HIS H 1.800 . 6.000 5.410 3.804 5.558 . 0 0 "[ . 1 . 2]" 1
538 1 37 LEU MD2 1 40 ILE MD 1.800 . 5.000 3.853 2.668 4.688 . 0 0 "[ . 1 . 2]" 1
539 1 37 LEU MD2 1 40 ILE MG 1.800 . 5.000 4.990 4.220 5.187 0.187 16 0 "[ . 1 . 2]" 1
540 1 37 LEU MD2 1 41 PHE HZ 1.800 . 6.000 5.612 4.380 6.158 0.158 7 0 "[ . 1 . 2]" 1
541 1 37 LEU MD2 1 69 MET ME 1.800 . 5.000 4.740 4.482 5.026 0.026 7 0 "[ . 1 . 2]" 1
542 1 37 LEU MD2 1 103 LEU MD1 1.800 . 5.000 2.352 1.862 4.208 . 0 0 "[ . 1 . 2]" 1
543 1 37 LEU MD2 1 103 LEU MD2 1.800 . 5.000 2.108 1.787 3.507 0.013 9 0 "[ . 1 . 2]" 1
544 1 37 LEU MD2 2 1 HEC HAA1 1.800 . 6.000 5.237 5.107 5.476 . 0 0 "[ . 1 . 2]" 1
545 1 37 LEU MD2 2 1 HEC HHA 1.800 . 6.000 6.147 6.032 6.216 0.216 8 0 "[ . 1 . 2]" 1
546 1 37 LEU MD2 2 1 HEC HHB 1.800 . 5.000 3.258 2.846 4.304 . 0 0 "[ . 1 . 2]" 1
547 1 37 LEU HG 1 38 HIS H 1.800 . 5.000 4.717 4.515 4.972 . 0 0 "[ . 1 . 2]" 1
548 1 37 LEU HG 1 41 PHE QE 1.800 . 6.000 3.967 2.620 4.458 . 0 0 "[ . 1 . 2]" 1
549 1 37 LEU HG 1 106 ALA H 1.800 . 6.000 6.117 6.051 6.177 0.177 5 0 "[ . 1 . 2]" 1
550 1 38 HIS H 1 40 ILE H 1.800 . 5.000 3.573 2.965 4.235 . 0 0 "[ . 1 . 2]" 1
551 1 38 HIS HA 1 38 HIS HD2 1.800 . 5.000 4.106 3.709 4.690 . 0 0 "[ . 1 . 2]" 1
552 1 38 HIS HA 1 39 GLY H 1.800 . 3.500 3.351 3.219 3.487 . 0 0 "[ . 1 . 2]" 1
553 1 38 HIS HA 1 107 THR HA 1.800 . 3.500 3.335 2.726 3.557 0.057 5 0 "[ . 1 . 2]" 1
554 1 38 HIS QB 1 39 GLY H 1.800 . 3.500 3.273 2.683 3.510 0.010 10 0 "[ . 1 . 2]" 1
555 1 38 HIS HD2 1 39 GLY H 1.800 . 6.000 6.026 5.664 6.171 0.171 18 0 "[ . 1 . 2]" 1
556 1 38 HIS HE1 1 103 LEU QD 1.800 . 6.000 6.113 6.017 6.203 0.203 16 0 "[ . 1 . 2]" 1
557 1 39 GLY H 1 40 ILE H 1.800 . 5.000 2.060 1.857 2.540 . 0 0 "[ . 1 . 2]" 1
558 1 39 GLY H 1 40 ILE MD 1.800 . 6.000 5.129 4.848 5.608 . 0 0 "[ . 1 . 2]" 1
559 1 39 GLY H 1 40 ILE MG 1.800 . 6.000 5.197 3.826 5.831 . 0 0 "[ . 1 . 2]" 1
560 1 40 ILE H 1 40 ILE MD 1.800 . 5.000 3.979 3.626 4.345 . 0 0 "[ . 1 . 2]" 1
561 1 40 ILE H 1 40 ILE HG12 1.800 . 5.000 3.417 2.525 4.580 . 0 0 "[ . 1 . 2]" 1
562 1 40 ILE H 1 40 ILE HG13 1.800 . 5.000 2.749 2.040 4.394 . 0 0 "[ . 1 . 2]" 1
563 1 40 ILE H 1 40 ILE MG 1.800 . 5.000 3.554 2.311 3.798 . 0 0 "[ . 1 . 2]" 1
564 1 40 ILE HA 1 40 ILE MD 1.800 . 5.000 3.589 3.384 3.763 . 0 0 "[ . 1 . 2]" 1
565 1 40 ILE HA 1 40 ILE QG 1.800 . 3.500 2.223 2.128 2.373 . 0 0 "[ . 1 . 2]" 1
566 1 40 ILE HA 1 40 ILE MG 1.800 . 3.500 2.633 2.309 3.218 . 0 0 "[ . 1 . 2]" 1
567 1 40 ILE HA 1 41 PHE H 1.800 . 3.500 3.448 2.413 3.551 0.051 7 0 "[ . 1 . 2]" 1
568 1 40 ILE HB 1 40 ILE MD 1.800 . 3.500 2.521 2.299 2.738 . 0 0 "[ . 1 . 2]" 1
569 1 40 ILE MD 1 41 PHE H 1.800 . 5.000 4.943 4.205 5.082 0.082 11 0 "[ . 1 . 2]" 1
570 1 40 ILE MD 1 41 PHE HZ 1.800 . 5.000 5.000 4.500 5.112 0.112 16 0 "[ . 1 . 2]" 1
571 1 40 ILE MD 1 64 TRP HB2 1.800 . 5.000 4.738 3.786 5.093 0.093 7 0 "[ . 1 . 2]" 1
572 1 40 ILE MD 1 64 TRP HB3 1.800 . 5.000 4.388 3.379 4.762 . 0 0 "[ . 1 . 2]" 1
573 1 40 ILE MD 1 64 TRP HH2 1.800 . 6.000 5.936 5.197 6.126 0.126 9 0 "[ . 1 . 2]" 1
574 1 40 ILE QG 1 41 PHE H 1.800 . 5.000 4.208 4.012 4.427 . 0 0 "[ . 1 . 2]" 1
575 1 40 ILE QG 1 41 PHE QE 1.800 . 5.000 4.922 4.390 5.111 0.111 14 0 "[ . 1 . 2]" 1
576 1 40 ILE QG 1 64 TRP QB 1.800 . 5.000 4.439 2.289 4.937 . 0 0 "[ . 1 . 2]" 1
577 1 40 ILE MG 1 41 PHE H 1.800 . 5.000 3.232 1.831 3.719 . 0 0 "[ . 1 . 2]" 1
578 1 40 ILE MG 1 41 PHE QE 1.800 . 5.000 3.410 2.449 3.936 . 0 0 "[ . 1 . 2]" 1
579 1 40 ILE MG 1 41 PHE HZ 1.800 . 5.000 3.981 3.529 4.366 . 0 0 "[ . 1 . 2]" 1
580 1 40 ILE MG 1 64 TRP HD1 1.800 . 5.000 2.816 2.300 4.384 . 0 0 "[ . 1 . 2]" 1
581 1 40 ILE MG 1 69 MET ME 1.800 . 2.900 2.156 1.883 2.543 . 0 0 "[ . 1 . 2]" 1
582 1 40 ILE MG 2 1 HEC HAA1 1.800 . 3.500 3.442 3.104 3.755 0.255 14 0 "[ . 1 . 2]" 1
583 1 40 ILE MG 2 1 HEC HAA2 1.800 . 5.000 3.841 3.227 4.812 . 0 0 "[ . 1 . 2]" 1
584 1 41 PHE H 1 42 GLY H 1.800 . 5.000 4.430 2.512 4.622 . 0 0 "[ . 1 . 2]" 1
585 1 41 PHE H 1 107 THR MG 1.800 . 5.000 4.880 4.211 5.121 0.121 2 0 "[ . 1 . 2]" 1
586 1 41 PHE HA 1 41 PHE QD 1.800 . 5.000 2.856 2.612 3.024 . 0 0 "[ . 1 . 2]" 1
587 1 41 PHE HA 1 42 GLY H 1.800 . 3.500 2.243 2.170 3.003 . 0 0 "[ . 1 . 2]" 1
588 1 41 PHE QB 1 65 ASP HA 1.800 . 5.000 4.458 3.880 4.997 . 0 0 "[ . 1 . 2]" 1
589 1 41 PHE HB2 1 41 PHE QD 1.800 . 2.900 2.409 2.338 2.489 . 0 0 "[ . 1 . 2]" 1
590 1 41 PHE HB2 1 42 GLY H 1.800 . 5.000 4.177 4.022 4.230 . 0 0 "[ . 1 . 2]" 1
591 1 41 PHE HB3 1 41 PHE QD 1.800 . 2.900 2.422 2.348 2.533 . 0 0 "[ . 1 . 2]" 1
592 1 41 PHE HB3 1 42 GLY H 1.800 . 5.000 3.373 3.101 4.492 . 0 0 "[ . 1 . 2]" 1
593 1 41 PHE QD 1 42 GLY H 1.800 . 5.000 4.253 3.995 4.723 . 0 0 "[ . 1 . 2]" 1
594 1 41 PHE QD 1 65 ASP HA 1.800 . 5.000 2.437 2.257 2.844 . 0 0 "[ . 1 . 2]" 1
595 1 41 PHE QD 1 66 GLU H 1.800 . 5.000 4.295 3.846 4.904 . 0 0 "[ . 1 . 2]" 1
596 1 41 PHE QD 1 66 GLU HA 1.800 . 6.000 5.398 4.727 6.037 0.037 7 0 "[ . 1 . 2]" 1
597 1 41 PHE QD 1 69 MET ME 1.800 . 5.000 4.123 3.527 4.858 . 0 0 "[ . 1 . 2]" 1
598 1 41 PHE QD 1 103 LEU HA 1.800 . 6.000 5.837 5.296 6.084 0.084 14 0 "[ . 1 . 2]" 1
599 1 41 PHE QD 1 103 LEU QB 1.800 . 5.000 4.473 4.073 4.723 . 0 0 "[ . 1 . 2]" 1
600 1 41 PHE QD 1 104 LYS HA 1.800 . 5.000 4.379 3.866 5.021 0.021 7 0 "[ . 1 . 2]" 1
601 1 41 PHE QE 1 65 ASP HA 1.800 . 5.000 2.724 2.275 3.468 . 0 0 "[ . 1 . 2]" 1
602 1 41 PHE QE 1 66 GLU H 1.800 . 5.000 3.567 3.061 4.171 . 0 0 "[ . 1 . 2]" 1
603 1 41 PHE QE 1 66 GLU HA 1.800 . 5.000 3.434 2.944 3.940 . 0 0 "[ . 1 . 2]" 1
604 1 41 PHE QE 1 66 GLU QB 1.800 . 6.000 4.879 4.554 5.202 . 0 0 "[ . 1 . 2]" 1
605 1 41 PHE QE 1 66 GLU HG2 1.800 . 5.000 4.170 3.464 5.034 0.034 13 0 "[ . 1 . 2]" 1
606 1 41 PHE QE 1 66 GLU HG3 1.800 . 5.000 4.100 3.390 5.011 0.011 9 0 "[ . 1 . 2]" 1
607 1 41 PHE QE 1 69 MET QB 1.800 . 6.000 4.370 3.445 5.068 . 0 0 "[ . 1 . 2]" 1
608 1 41 PHE QE 1 69 MET ME 1.800 . 5.000 2.929 2.400 3.874 . 0 0 "[ . 1 . 2]" 1
609 1 41 PHE QE 1 100 ILE MG 1.800 . 5.000 4.710 4.043 5.051 0.051 9 0 "[ . 1 . 2]" 1
610 1 41 PHE QE 1 103 LEU HA 1.800 . 5.000 4.263 3.861 4.595 . 0 0 "[ . 1 . 2]" 1
611 1 41 PHE QE 1 103 LEU QB 1.800 . 3.500 2.513 2.240 2.889 . 0 0 "[ . 1 . 2]" 1
612 1 41 PHE QE 1 103 LEU MD1 1.800 . 5.000 3.696 2.179 4.874 . 0 0 "[ . 1 . 2]" 1
613 1 41 PHE QE 1 103 LEU MD2 1.800 . 6.000 3.801 2.589 4.782 . 0 0 "[ . 1 . 2]" 1
614 1 41 PHE QE 1 104 LYS H 1.800 . 5.000 4.883 4.700 5.072 0.072 7 0 "[ . 1 . 2]" 1
615 1 41 PHE QE 1 104 LYS HA 1.800 . 5.000 4.178 3.887 4.391 . 0 0 "[ . 1 . 2]" 1
616 1 41 PHE QE 1 106 ALA MB 1.800 . 6.000 4.183 3.723 4.593 . 0 0 "[ . 1 . 2]" 1
617 1 41 PHE HZ 1 66 GLU HA 1.800 . 6.000 4.409 3.968 4.646 . 0 0 "[ . 1 . 2]" 1
618 1 41 PHE HZ 1 66 GLU QB 1.800 . 6.000 5.984 5.483 6.061 0.061 7 0 "[ . 1 . 2]" 1
619 1 41 PHE HZ 1 69 MET HB2 1.800 . 6.000 4.804 3.844 5.680 . 0 0 "[ . 1 . 2]" 1
620 1 41 PHE HZ 1 69 MET HB3 1.800 . 6.000 4.961 4.531 5.911 . 0 0 "[ . 1 . 2]" 1
621 1 41 PHE HZ 1 69 MET ME 1.800 . 5.000 2.620 2.150 3.642 . 0 0 "[ . 1 . 2]" 1
622 1 41 PHE HZ 1 103 LEU QB 1.800 . 3.500 2.798 2.278 3.243 . 0 0 "[ . 1 . 2]" 1
623 1 41 PHE HZ 1 103 LEU MD1 1.800 . 6.000 3.793 2.744 5.658 . 0 0 "[ . 1 . 2]" 1
624 1 41 PHE HZ 1 103 LEU MD2 1.800 . 6.000 4.284 2.027 5.298 . 0 0 "[ . 1 . 2]" 1
625 1 41 PHE HZ 1 104 LYS HA 1.800 . 5.000 4.845 4.135 5.060 0.060 16 0 "[ . 1 . 2]" 1
626 1 42 GLY H 1 43 ARG H 1.800 . 5.000 3.841 2.921 4.477 . 0 0 "[ . 1 . 2]" 1
627 1 42 GLY H 1 63 LEU MD1 1.800 . 6.000 3.364 2.105 5.438 . 0 0 "[ . 1 . 2]" 1
628 1 42 GLY H 1 63 LEU MD2 1.800 . 6.000 4.047 1.910 5.973 . 0 0 "[ . 1 . 2]" 1
629 1 42 GLY H 1 63 LEU HG 1.800 . 6.000 4.688 3.849 6.198 0.198 6 0 "[ . 1 . 2]" 1
630 1 42 GLY H 1 64 TRP H 1.800 . 6.000 4.131 3.302 4.540 . 0 0 "[ . 1 . 2]" 1
631 1 42 GLY QA 1 43 ARG H 1.800 . 5.000 2.305 2.164 2.645 . 0 0 "[ . 1 . 2]" 1
632 1 42 GLY QA 1 63 LEU QD 1.800 . 5.000 3.632 2.562 4.873 . 0 0 "[ . 1 . 2]" 1
633 1 43 ARG H 1 43 ARG HD2 1.800 . 5.000 4.652 4.082 5.074 0.074 19 0 "[ . 1 . 2]" 1
634 1 43 ARG H 1 43 ARG HD3 1.800 . 5.000 4.352 3.283 5.055 0.055 1 0 "[ . 1 . 2]" 1
635 1 43 ARG H 1 43 ARG QG 1.800 . 5.000 2.493 1.744 4.482 0.056 7 0 "[ . 1 . 2]" 1
636 1 43 ARG H 1 63 LEU QD 1.800 . 5.000 3.895 3.120 5.028 0.028 6 0 "[ . 1 . 2]" 1
637 1 43 ARG HA 1 44 HIS H 1.800 . 5.000 2.905 2.189 3.592 . 0 0 "[ . 1 . 2]" 1
638 1 43 ARG QB 1 44 HIS HD2 1.800 . 5.000 3.942 2.282 5.033 0.033 1 0 "[ . 1 . 2]" 1
639 1 43 ARG HB2 1 44 HIS H 1.800 . 5.000 3.108 1.783 4.306 0.017 20 0 "[ . 1 . 2]" 1
640 1 43 ARG HB3 1 44 HIS H 1.800 . 5.000 3.008 1.766 4.319 0.034 15 0 "[ . 1 . 2]" 1
641 1 43 ARG HD2 1 44 HIS HD2 1.800 . 5.000 4.510 2.735 5.065 0.065 14 0 "[ . 1 . 2]" 1
642 1 43 ARG HD3 1 44 HIS HD2 1.800 . 5.000 5.015 4.482 5.102 0.102 5 0 "[ . 1 . 2]" 1
643 1 43 ARG QG 1 47 GLN QG 1.800 . 3.500 3.271 2.500 3.622 0.122 1 0 "[ . 1 . 2]" 1
644 1 43 ARG HG2 1 44 HIS H 1.800 . 5.000 4.102 1.829 5.192 0.192 18 0 "[ . 1 . 2]" 1
645 1 43 ARG HG3 1 44 HIS H 1.800 . 5.000 3.379 1.763 4.623 0.037 7 0 "[ . 1 . 2]" 1
646 1 44 HIS H 1 45 SER H 1.800 . 5.000 4.597 4.456 4.712 . 0 0 "[ . 1 . 2]" 1
647 1 44 HIS H 1 47 GLN QE 1.800 . 5.000 4.827 3.819 5.189 0.189 9 0 "[ . 1 . 2]" 1
648 1 44 HIS HA 1 44 HIS HD2 1.800 . 3.500 2.546 2.297 3.391 . 0 0 "[ . 1 . 2]" 1
649 1 44 HIS HA 1 45 SER H 1.800 . 5.000 2.547 2.302 2.815 . 0 0 "[ . 1 . 2]" 1
650 1 44 HIS HA 1 45 SER QB 1.800 . 5.000 4.614 4.360 5.099 0.099 9 0 "[ . 1 . 2]" 1
651 1 44 HIS HA 1 62 VAL MG1 1.800 . 6.000 4.953 4.425 6.141 0.141 3 0 "[ . 1 . 2]" 1
652 1 44 HIS HA 1 62 VAL MG2 1.800 . 6.000 5.367 4.769 6.101 0.101 14 0 "[ . 1 . 2]" 1
653 1 44 HIS HA 1 63 LEU HA 1.800 . 5.000 2.747 2.253 3.084 . 0 0 "[ . 1 . 2]" 1
654 1 44 HIS HA 1 63 LEU HB2 1.800 . 6.000 3.642 3.007 4.715 . 0 0 "[ . 1 . 2]" 1
655 1 44 HIS HA 1 63 LEU HB3 1.800 . 5.000 4.662 3.098 5.116 0.116 2 0 "[ . 1 . 2]" 1
656 1 44 HIS HA 1 63 LEU MD1 1.800 . 6.000 3.706 2.311 5.189 . 0 0 "[ . 1 . 2]" 1
657 1 44 HIS HA 1 63 LEU MD2 1.800 . 6.000 4.582 3.426 5.148 . 0 0 "[ . 1 . 2]" 1
658 1 44 HIS HA 1 63 LEU HG 1.800 . 6.000 4.847 2.820 6.003 0.003 14 0 "[ . 1 . 2]" 1
659 1 44 HIS HA 1 64 TRP H 1.800 . 5.000 4.597 4.058 5.026 0.026 11 0 "[ . 1 . 2]" 1
660 1 44 HIS HA 1 64 TRP HD1 1.800 . 6.000 6.017 5.621 6.146 0.146 5 0 "[ . 1 . 2]" 1
661 1 44 HIS QB 1 61 ASN H 1.800 . 5.000 4.448 3.920 5.037 0.037 8 0 "[ . 1 . 2]" 1
662 1 44 HIS QB 1 61 ASN QD 1.800 . 5.000 2.411 1.781 4.094 0.019 5 0 "[ . 1 . 2]" 1
663 1 44 HIS HB2 1 45 SER H 1.800 . 5.000 3.281 2.168 3.986 . 0 0 "[ . 1 . 2]" 1
664 1 44 HIS HB3 1 45 SER H 1.800 . 5.000 2.386 2.015 3.024 . 0 0 "[ . 1 . 2]" 1
665 1 44 HIS HD2 1 61 ASN QB 1.800 . 6.000 5.695 4.922 6.039 0.039 9 0 "[ . 1 . 2]" 1
666 1 44 HIS HD2 1 61 ASN HD21 1.800 . 3.500 3.486 3.128 3.615 0.115 17 0 "[ . 1 . 2]" 1
667 1 44 HIS HD2 1 61 ASN HD22 1.800 . 3.500 2.938 2.234 3.303 . 0 0 "[ . 1 . 2]" 1
668 1 44 HIS HD2 1 63 LEU H 1.800 . 6.000 5.238 4.130 6.006 0.006 19 0 "[ . 1 . 2]" 1
669 1 44 HIS HD2 1 63 LEU HA 1.800 . 6.000 4.651 3.990 5.376 . 0 0 "[ . 1 . 2]" 1
670 1 44 HIS HD2 1 63 LEU QB 1.800 . 6.000 3.885 3.046 4.728 . 0 0 "[ . 1 . 2]" 1
671 1 44 HIS HD2 1 63 LEU MD1 1.800 . 5.000 4.137 3.357 5.090 0.090 15 0 "[ . 1 . 2]" 1
672 1 44 HIS HD2 1 63 LEU MD2 1.800 . 5.000 4.829 3.391 5.094 0.094 8 0 "[ . 1 . 2]" 1
673 1 45 SER H 1 45 SER HB2 1.800 . 3.500 3.515 3.052 3.691 0.191 18 0 "[ . 1 . 2]" 1
674 1 45 SER H 1 61 ASN HA 1.800 . 5.000 3.222 2.590 3.819 . 0 0 "[ . 1 . 2]" 1
675 1 45 SER H 1 62 VAL H 1.800 . 5.000 2.962 2.538 3.696 . 0 0 "[ . 1 . 2]" 1
676 1 45 SER H 1 62 VAL MG1 1.800 . 5.000 3.533 3.204 4.972 . 0 0 "[ . 1 . 2]" 1
677 1 45 SER H 1 62 VAL MG2 1.800 . 5.000 4.954 3.594 5.169 0.169 14 0 "[ . 1 . 2]" 1
678 1 45 SER H 1 64 TRP HD1 1.800 . 5.000 4.816 4.431 5.083 0.083 11 0 "[ . 1 . 2]" 1
679 1 45 SER HA 1 64 TRP HD1 1.800 . 5.000 2.215 2.173 2.253 . 0 0 "[ . 1 . 2]" 1
680 1 45 SER HA 1 64 TRP HE1 1.800 . 5.000 3.355 2.824 3.869 . 0 0 "[ . 1 . 2]" 1
681 1 45 SER QB 1 62 VAL MG2 1.800 . 5.000 4.085 2.225 4.551 . 0 0 "[ . 1 . 2]" 1
682 1 45 SER HB2 1 46 GLY H 1.800 . 5.000 2.745 2.295 3.570 . 0 0 "[ . 1 . 2]" 1
683 1 45 SER HB2 1 64 TRP HE1 1.800 . 5.000 2.334 1.783 3.512 0.017 12 0 "[ . 1 . 2]" 1
684 1 45 SER HB2 1 64 TRP HZ2 1.800 . 5.000 4.475 4.113 5.043 0.043 7 0 "[ . 1 . 2]" 1
685 1 45 SER HB3 1 46 GLY H 1.800 . 5.000 3.753 3.151 4.025 . 0 0 "[ . 1 . 2]" 1
686 1 45 SER HB3 1 62 VAL MG1 1.800 . 5.000 2.300 2.019 4.021 . 0 0 "[ . 1 . 2]" 1
687 1 45 SER HB3 1 62 VAL MG2 1.800 . 5.000 4.224 2.250 4.771 . 0 0 "[ . 1 . 2]" 1
688 1 45 SER HB3 1 64 TRP HE1 1.800 . 5.000 3.048 2.385 3.604 . 0 0 "[ . 1 . 2]" 1
689 1 45 SER HB3 1 64 TRP HZ2 1.800 . 5.000 4.762 3.707 5.099 0.099 2 0 "[ . 1 . 2]" 1
690 1 46 GLY H 1 53 TYR QE 1.800 . 5.000 4.339 3.839 4.732 . 0 0 "[ . 1 . 2]" 1
691 1 46 GLY H 1 64 TRP HE1 1.800 . 5.000 2.884 2.057 3.320 . 0 0 "[ . 1 . 2]" 1
692 1 46 GLY H 1 64 TRP HZ2 1.800 . 6.000 5.656 4.821 6.080 0.080 20 0 "[ . 1 . 2]" 1
693 1 46 GLY QA 1 47 GLN QG 1.800 . 5.000 3.983 3.428 5.016 0.016 20 0 "[ . 1 . 2]" 1
694 1 46 GLY QA 1 48 ALA H 1.800 . 5.000 3.550 3.259 4.480 . 0 0 "[ . 1 . 2]" 1
695 1 46 GLY QA 1 53 TYR QE 1.800 . 5.000 2.857 2.754 3.093 . 0 0 "[ . 1 . 2]" 1
696 1 46 GLY QA 1 58 ILE H 1.800 . 5.000 4.740 3.720 5.090 0.090 9 0 "[ . 1 . 2]" 1
697 1 46 GLY HA2 1 47 GLN QE 1.800 . 3.500 3.369 2.764 3.648 0.148 9 0 "[ . 1 . 2]" 1
698 1 46 GLY HA2 1 57 ASN HD21 1.800 . 3.500 2.803 2.307 3.521 0.021 3 0 "[ . 1 . 2]" 1
699 1 46 GLY HA2 1 57 ASN HD22 1.800 . 3.500 2.994 2.044 3.423 . 0 0 "[ . 1 . 2]" 1
700 1 46 GLY HA3 1 47 GLN QE 1.800 . 3.500 3.306 2.204 3.583 0.083 3 0 "[ . 1 . 2]" 1
701 1 46 GLY HA3 1 57 ASN HD21 1.800 . 3.500 2.762 1.832 3.592 0.092 3 0 "[ . 1 . 2]" 1
702 1 46 GLY HA3 1 57 ASN HD22 1.800 . 3.500 3.200 2.096 3.585 0.085 10 0 "[ . 1 . 2]" 1
703 1 47 GLN H 1 47 GLN HB2 1.800 . 3.500 2.911 2.683 3.785 0.285 17 0 "[ . 1 . 2]" 1
704 1 47 GLN H 1 48 ALA H 1.800 . 5.000 2.115 1.765 3.364 0.035 16 0 "[ . 1 . 2]" 1
705 1 47 GLN H 1 51 TYR QE 1.800 . 6.000 6.116 6.031 6.161 0.161 6 0 "[ . 1 . 2]" 1
706 1 47 GLN QB 1 47 GLN QG 1.800 . 3.500 2.037 1.969 2.056 . 0 0 "[ . 1 . 2]" 1
707 1 47 GLN QG 1 48 ALA H 1.800 . 5.000 4.545 4.329 5.009 0.009 17 0 "[ . 1 . 2]" 1
708 1 48 ALA H 1 48 ALA HA 1.800 . 2.900 2.872 2.731 2.984 0.084 8 0 "[ . 1 . 2]" 1
709 1 48 ALA H 1 48 ALA MB 1.800 . 2.900 2.248 2.158 2.396 . 0 0 "[ . 1 . 2]" 1
710 1 48 ALA H 1 53 TYR HE1 1.800 . 6.000 1.847 1.758 2.215 0.042 3 0 "[ . 1 . 2]" 1
711 1 48 ALA H 1 53 TYR HE2 1.800 . 6.000 5.419 4.272 6.049 0.049 8 0 "[ . 1 . 2]" 1
712 1 48 ALA H 1 53 TYR HH 1.800 . 5.000 3.245 2.121 4.444 . 0 0 "[ . 1 . 2]" 1
713 1 48 ALA MB 1 49 GLU H 1.800 . 3.500 3.097 2.580 3.506 0.006 11 0 "[ . 1 . 2]" 1
714 1 48 ALA MB 1 51 TYR H 1.800 . 2.900 2.577 2.269 2.783 . 0 0 "[ . 1 . 2]" 1
715 1 48 ALA MB 1 51 TYR HD2 1.800 . 5.000 3.442 2.185 5.218 0.218 20 0 "[ . 1 . 2]" 1
716 1 48 ALA MB 1 53 TYR H 1.800 . 5.000 4.983 4.692 5.062 0.062 11 0 "[ . 1 . 2]" 1
717 1 48 ALA MB 1 53 TYR HD1 1.800 . 5.000 3.791 3.491 4.122 . 0 0 "[ . 1 . 2]" 1
718 1 48 ALA MB 1 53 TYR HE1 1.800 . 5.000 2.107 2.011 2.508 . 0 0 "[ . 1 . 2]" 1
719 1 48 ALA MB 1 53 TYR HE2 1.800 . 5.000 4.551 3.772 5.029 0.029 13 0 "[ . 1 . 2]" 1
720 1 48 ALA MB 1 53 TYR HH 1.800 . 3.500 2.449 1.796 3.428 0.004 4 0 "[ . 1 . 2]" 1
721 1 49 GLU H 1 49 GLU HA 1.800 . 2.900 2.887 2.829 2.953 0.053 3 0 "[ . 1 . 2]" 1
722 1 49 GLU H 1 49 GLU QG 1.800 . 2.900 2.265 2.082 2.928 0.028 13 0 "[ . 1 . 2]" 1
723 1 49 GLU HA 1 49 GLU QG 1.800 . 5.000 2.364 2.281 2.848 . 0 0 "[ . 1 . 2]" 1
724 1 49 GLU HA 1 51 TYR H 1.800 . 6.000 5.202 4.334 5.753 . 0 0 "[ . 1 . 2]" 1
725 1 49 GLU HB2 1 50 GLY H 1.800 . 5.000 2.593 2.171 2.780 . 0 0 "[ . 1 . 2]" 1
726 1 49 GLU HB3 1 50 GLY H 1.800 . 5.000 3.609 3.231 3.764 . 0 0 "[ . 1 . 2]" 1
727 1 49 GLU QG 1 50 GLY H 1.800 . 5.000 4.061 3.905 4.422 . 0 0 "[ . 1 . 2]" 1
728 1 51 TYR H 1 51 TYR QB 1.800 . 3.500 2.290 2.236 2.355 . 0 0 "[ . 1 . 2]" 1
729 1 51 TYR HA 1 51 TYR QD 1.800 . 5.000 2.903 2.800 3.052 . 0 0 "[ . 1 . 2]" 1
730 1 51 TYR HA 1 52 SER H 1.800 . 5.000 2.274 2.197 2.324 . 0 0 "[ . 1 . 2]" 1
731 1 51 TYR QD 1 52 SER H 1.800 . 5.000 3.215 3.046 3.666 . 0 0 "[ . 1 . 2]" 1
732 1 51 TYR QD 1 53 TYR QD 1.800 . 5.000 3.514 3.220 3.933 . 0 0 "[ . 1 . 2]" 1
733 1 51 TYR QD 1 53 TYR HE1 1.800 . 5.000 2.885 2.471 3.868 . 0 0 "[ . 1 . 2]" 1
734 1 51 TYR QD 1 53 TYR HE2 1.800 . 5.000 4.236 3.846 4.617 . 0 0 "[ . 1 . 2]" 1
735 1 52 SER HA 1 53 TYR H 1.800 . 3.500 2.300 2.255 2.350 . 0 0 "[ . 1 . 2]" 1
736 1 52 SER HB2 1 53 TYR H 1.800 . 5.000 3.444 2.725 4.187 . 0 0 "[ . 1 . 2]" 1
737 1 52 SER HB3 1 53 TYR H 1.800 . 5.000 3.600 2.811 4.125 . 0 0 "[ . 1 . 2]" 1
738 1 53 TYR H 1 53 TYR QD 1.800 . 5.000 2.164 1.871 2.437 . 0 0 "[ . 1 . 2]" 1
739 1 53 TYR H 1 54 THR H 1.800 . 5.000 4.565 4.547 4.576 . 0 0 "[ . 1 . 2]" 1
740 1 53 TYR QB 1 58 ILE MD 1.800 . 5.000 3.098 2.427 3.541 . 0 0 "[ . 1 . 2]" 1
741 1 53 TYR HB2 1 54 THR H 1.800 . 5.000 3.675 3.452 3.886 . 0 0 "[ . 1 . 2]" 1
742 1 53 TYR HB2 1 57 ASN H 1.800 . 5.000 4.908 4.530 5.088 0.088 13 0 "[ . 1 . 2]" 1
743 1 53 TYR HB3 1 54 THR H 1.800 . 5.000 2.586 2.438 2.787 . 0 0 "[ . 1 . 2]" 1
744 1 53 TYR HB3 1 57 ASN H 1.800 . 5.000 4.081 3.472 4.472 . 0 0 "[ . 1 . 2]" 1
745 1 53 TYR QD 1 54 THR H 1.800 . 5.000 3.972 3.724 4.224 . 0 0 "[ . 1 . 2]" 1
746 1 53 TYR QD 1 57 ASN H 1.800 . 6.000 5.426 4.448 6.049 0.049 20 0 "[ . 1 . 2]" 1
747 1 53 TYR QD 1 58 ILE MD 1.800 . 5.000 3.991 2.987 4.637 . 0 0 "[ . 1 . 2]" 1
748 1 53 TYR HD1 1 57 ASN QD 1.800 . 5.000 4.182 3.661 4.719 . 0 0 "[ . 1 . 2]" 1
749 1 53 TYR HD2 1 57 ASN HD21 1.800 . 5.000 2.992 1.949 3.873 . 0 0 "[ . 1 . 2]" 1
750 1 53 TYR HD2 1 57 ASN HD22 1.800 . 5.000 3.889 3.289 4.565 . 0 0 "[ . 1 . 2]" 1
751 1 53 TYR QE 2 1 HEC HAA1 1.800 . 6.000 3.909 3.317 4.266 . 0 0 "[ . 1 . 2]" 1
752 1 53 TYR HE2 1 57 ASN QD 1.800 . 5.000 3.752 2.830 4.589 . 0 0 "[ . 1 . 2]" 1
753 1 54 THR H 1 54 THR HG1 1.800 . 5.000 3.621 1.975 4.317 . 0 0 "[ . 1 . 2]" 1
754 1 54 THR H 1 54 THR MG 1.800 . 5.000 1.914 1.627 3.765 0.173 3 0 "[ . 1 . 2]" 1
755 1 54 THR H 1 55 ASP H 1.800 . 5.000 4.216 2.741 4.683 . 0 0 "[ . 1 . 2]" 1
756 1 54 THR H 1 56 ALA MB 1.800 . 5.000 4.715 4.174 5.026 0.026 11 0 "[ . 1 . 2]" 1
757 1 54 THR H 1 81 PRO QG 1.800 . 5.000 3.398 3.046 4.131 . 0 0 "[ . 1 . 2]" 1
758 1 54 THR HA 1 54 THR MG 1.800 . 5.000 2.742 2.277 3.169 . 0 0 "[ . 1 . 2]" 1
759 1 54 THR HA 1 56 ALA MB 1.800 . 5.000 4.998 4.850 5.047 0.047 8 0 "[ . 1 . 2]" 1
760 1 54 THR HG1 1 57 ASN H 1.800 . 5.000 3.487 1.794 5.006 0.006 20 0 "[ . 1 . 2]" 1
761 1 54 THR MG 1 55 ASP H 1.800 . 5.000 3.825 2.170 4.201 . 0 0 "[ . 1 . 2]" 1
762 1 54 THR MG 1 57 ASN H 1.800 . 3.500 3.581 3.287 3.690 0.190 3 0 "[ . 1 . 2]" 1
763 1 54 THR MG 1 83 THR H 1.800 . 5.000 3.995 3.397 5.021 0.021 13 0 "[ . 1 . 2]" 1
764 1 55 ASP H 1 55 ASP QB 1.800 . 3.500 2.642 2.427 3.385 . 0 0 "[ . 1 . 2]" 1
765 1 55 ASP H 1 56 ALA H 1.800 . 5.000 2.781 2.668 3.183 . 0 0 "[ . 1 . 2]" 1
766 1 55 ASP H 1 57 ASN H 1.800 . 5.000 4.558 3.540 4.961 . 0 0 "[ . 1 . 2]" 1
767 1 55 ASP HA 1 56 ALA H 1.800 . 3.500 3.501 3.344 3.532 0.032 11 0 "[ . 1 . 2]" 1
768 1 55 ASP HA 1 57 ASN H 1.800 . 5.000 4.509 4.015 4.762 . 0 0 "[ . 1 . 2]" 1
769 1 55 ASP HA 1 58 ILE H 1.800 . 5.000 3.305 2.946 3.535 . 0 0 "[ . 1 . 2]" 1
770 1 55 ASP HA 1 58 ILE HB 1.800 . 5.000 2.553 2.284 3.118 . 0 0 "[ . 1 . 2]" 1
771 1 55 ASP HA 1 59 LYS H 1.800 . 5.000 3.711 3.285 4.356 . 0 0 "[ . 1 . 2]" 1
772 1 55 ASP QB 1 56 ALA H 1.800 . 5.000 2.893 2.682 3.609 . 0 0 "[ . 1 . 2]" 1
773 1 56 ALA H 1 56 ALA MB 1.800 . 2.900 2.217 2.052 2.259 . 0 0 "[ . 1 . 2]" 1
774 1 56 ALA H 1 57 ASN H 1.800 . 5.000 2.938 2.674 3.190 . 0 0 "[ . 1 . 2]" 1
775 1 56 ALA H 1 58 ILE H 1.800 . 5.000 4.185 3.960 4.292 . 0 0 "[ . 1 . 2]" 1
776 1 56 ALA HA 1 57 ASN H 1.800 . 3.500 3.588 3.552 3.609 0.109 9 0 "[ . 1 . 2]" 1
777 1 56 ALA HA 1 58 ILE H 1.800 . 5.000 4.486 4.164 4.692 . 0 0 "[ . 1 . 2]" 1
778 1 56 ALA HA 1 59 LYS H 1.800 . 5.000 3.640 3.256 3.950 . 0 0 "[ . 1 . 2]" 1
779 1 56 ALA HA 1 59 LYS HB2 1.800 . 5.000 2.898 2.730 3.344 . 0 0 "[ . 1 . 2]" 1
780 1 56 ALA HA 1 59 LYS HB3 1.800 . 5.000 4.522 4.337 4.997 . 0 0 "[ . 1 . 2]" 1
781 1 56 ALA HA 1 60 LYS H 1.800 . 5.000 4.155 3.578 4.411 . 0 0 "[ . 1 . 2]" 1
782 1 56 ALA MB 1 57 ASN H 1.800 . 3.500 2.355 2.115 2.613 . 0 0 "[ . 1 . 2]" 1
783 1 56 ALA MB 1 80 ILE MG 1.800 . 5.000 4.549 3.934 5.043 0.043 12 0 "[ . 1 . 2]" 1
784 1 56 ALA MB 1 82 GLY HA2 1.800 . 6.000 5.870 5.558 6.175 0.175 3 0 "[ . 1 . 2]" 1
785 1 56 ALA MB 1 82 GLY HA3 1.800 . 6.000 5.755 5.484 6.000 0.000 20 0 "[ . 1 . 2]" 1
786 1 56 ALA MB 1 83 THR H 1.800 . 5.000 5.055 4.974 5.178 0.178 10 0 "[ . 1 . 2]" 1
787 1 56 ALA MB 1 83 THR HB 1.800 . 6.000 5.744 5.555 6.091 0.091 10 0 "[ . 1 . 2]" 1
788 1 57 ASN H 1 58 ILE H 1.800 . 3.500 2.735 2.456 2.828 . 0 0 "[ . 1 . 2]" 1
789 1 57 ASN H 1 59 LYS H 1.800 . 5.000 4.386 4.274 4.535 . 0 0 "[ . 1 . 2]" 1
790 1 57 ASN HA 1 57 ASN HD21 1.800 . 6.000 4.426 4.230 4.577 . 0 0 "[ . 1 . 2]" 1
791 1 57 ASN HA 1 58 ILE H 1.800 . 3.500 3.554 3.540 3.566 0.066 5 0 "[ . 1 . 2]" 1
792 1 57 ASN HA 1 59 LYS H 1.800 . 5.000 4.755 4.575 5.033 0.033 5 0 "[ . 1 . 2]" 1
793 1 57 ASN HA 1 60 LYS H 1.800 . 5.000 3.838 3.449 4.107 . 0 0 "[ . 1 . 2]" 1
794 1 57 ASN HA 1 60 LYS HB2 1.800 . 5.000 3.436 3.028 3.705 . 0 0 "[ . 1 . 2]" 1
795 1 57 ASN HA 1 60 LYS QB 1.800 . 5.000 3.229 2.598 3.508 . 0 0 "[ . 1 . 2]" 1
796 1 57 ASN HA 1 60 LYS HB3 1.800 . 5.000 4.351 2.828 5.025 0.025 17 0 "[ . 1 . 2]" 1
797 1 57 ASN HA 1 64 TRP HE1 1.800 . 5.000 5.139 5.069 5.230 0.230 9 0 "[ . 1 . 2]" 1
798 1 57 ASN HA 1 80 ILE MD 1.800 . 6.000 6.062 5.956 6.139 0.139 5 0 "[ . 1 . 2]" 1
799 1 57 ASN HA 1 80 ILE MG 1.800 . 3.500 3.306 3.096 3.514 0.014 12 0 "[ . 1 . 2]" 1
800 1 57 ASN QB 1 80 ILE MG 1.800 . 3.500 3.545 2.986 3.629 0.129 1 0 "[ . 1 . 2]" 1
801 1 57 ASN HB2 1 58 ILE H 1.800 . 5.000 3.816 3.710 3.925 . 0 0 "[ . 1 . 2]" 1
802 1 57 ASN HB3 1 58 ILE H 1.800 . 5.000 2.697 2.462 3.899 . 0 0 "[ . 1 . 2]" 1
803 1 57 ASN QD 1 64 TRP HD1 1.800 . 3.500 3.476 3.298 3.596 0.096 19 0 "[ . 1 . 2]" 1
804 1 57 ASN HD21 1 64 TRP HE1 1.800 . 3.500 3.388 2.027 3.646 0.146 20 0 "[ . 1 . 2]" 1
805 1 57 ASN HD22 1 64 TRP HE1 1.800 . 3.500 2.132 1.778 3.654 0.154 12 0 "[ . 1 . 2]" 1
806 1 58 ILE H 1 58 ILE HB 1.800 . 3.500 2.536 2.511 2.631 . 0 0 "[ . 1 . 2]" 1
807 1 58 ILE H 1 58 ILE MD 1.800 . 3.500 3.419 2.662 3.526 0.026 12 0 "[ . 1 . 2]" 1
808 1 58 ILE H 1 58 ILE QG 1.800 . 5.000 2.047 2.007 2.091 . 0 0 "[ . 1 . 2]" 1
809 1 58 ILE H 1 58 ILE MG 1.800 . 5.000 3.771 3.767 3.780 . 0 0 "[ . 1 . 2]" 1
810 1 58 ILE H 1 59 LYS H 1.800 . 3.500 2.747 2.661 2.821 . 0 0 "[ . 1 . 2]" 1
811 1 58 ILE H 1 60 LYS H 1.800 . 5.000 4.209 3.988 4.294 . 0 0 "[ . 1 . 2]" 1
812 1 58 ILE HA 1 58 ILE MD 1.800 . 5.000 3.640 2.019 3.825 . 0 0 "[ . 1 . 2]" 1
813 1 58 ILE HA 1 58 ILE MG 1.800 . 3.500 2.299 2.251 2.344 . 0 0 "[ . 1 . 2]" 1
814 1 58 ILE HA 1 59 LYS H 1.800 . 5.000 3.585 3.570 3.597 . 0 0 "[ . 1 . 2]" 1
815 1 58 ILE HA 1 60 LYS H 1.800 . 5.000 4.368 4.226 4.671 . 0 0 "[ . 1 . 2]" 1
816 1 58 ILE HB 1 58 ILE MD 1.800 . 3.500 2.366 2.234 3.197 . 0 0 "[ . 1 . 2]" 1
817 1 58 ILE HB 1 59 LYS H 1.800 . 5.000 2.488 2.320 2.613 . 0 0 "[ . 1 . 2]" 1
818 1 58 ILE MD 1 58 ILE QG 1.800 . 5.000 1.890 1.877 1.916 . 0 0 "[ . 1 . 2]" 1
819 1 58 ILE MD 1 59 LYS H 1.800 . 5.000 4.388 4.262 4.479 . 0 0 "[ . 1 . 2]" 1
820 1 58 ILE QG 1 58 ILE MG 1.800 . 5.000 2.250 2.165 2.299 . 0 0 "[ . 1 . 2]" 1
821 1 58 ILE MG 1 59 LYS H 1.800 . 5.000 3.418 3.270 3.629 . 0 0 "[ . 1 . 2]" 1
822 1 58 ILE MG 1 61 ASN H 1.800 . 6.000 4.326 4.129 4.516 . 0 0 "[ . 1 . 2]" 1
823 1 59 LYS H 1 59 LYS HA 1.800 . 2.900 2.828 2.821 2.839 . 0 0 "[ . 1 . 2]" 1
824 1 59 LYS H 1 59 LYS HB2 1.800 . 3.500 2.448 2.417 2.492 . 0 0 "[ . 1 . 2]" 1
825 1 59 LYS H 1 59 LYS HB3 1.800 . 3.500 3.604 3.601 3.607 0.107 19 0 "[ . 1 . 2]" 1
826 1 59 LYS H 1 59 LYS QD 1.800 . 5.000 3.848 3.705 3.897 . 0 0 "[ . 1 . 2]" 1
827 1 59 LYS H 1 59 LYS HG2 1.800 . 3.500 3.405 3.302 3.479 . 0 0 "[ . 1 . 2]" 1
828 1 59 LYS H 1 59 LYS HG3 1.800 . 3.500 2.238 2.138 2.307 . 0 0 "[ . 1 . 2]" 1
829 1 59 LYS H 1 60 LYS H 1.800 . 3.500 2.788 2.709 2.835 . 0 0 "[ . 1 . 2]" 1
830 1 59 LYS H 1 61 ASN H 1.800 . 5.000 4.223 4.080 4.359 . 0 0 "[ . 1 . 2]" 1
831 1 59 LYS HA 1 59 LYS HG2 1.800 . 3.500 2.378 2.339 2.429 . 0 0 "[ . 1 . 2]" 1
832 1 59 LYS HA 1 59 LYS QG 1.800 . 3.500 2.290 2.259 2.318 . 0 0 "[ . 1 . 2]" 1
833 1 59 LYS HA 1 59 LYS HG3 1.800 . 3.500 2.991 2.930 3.040 . 0 0 "[ . 1 . 2]" 1
834 1 59 LYS HA 1 60 LYS H 1.800 . 3.500 3.547 3.523 3.569 0.069 8 0 "[ . 1 . 2]" 1
835 1 59 LYS HB2 1 60 LYS H 1.800 . 5.000 2.713 2.548 2.841 . 0 0 "[ . 1 . 2]" 1
836 1 59 LYS HB3 1 60 LYS H 1.800 . 5.000 3.628 3.482 3.748 . 0 0 "[ . 1 . 2]" 1
837 1 59 LYS QD 1 60 LYS H 1.800 . 6.000 4.839 4.746 4.973 . 0 0 "[ . 1 . 2]" 1
838 1 59 LYS HG2 1 60 LYS H 1.800 . 5.000 5.008 4.952 5.039 0.039 9 0 "[ . 1 . 2]" 1
839 1 59 LYS HG3 1 60 LYS H 1.800 . 5.000 4.428 4.320 4.508 . 0 0 "[ . 1 . 2]" 1
840 1 60 LYS H 1 60 LYS HA 1.800 . 2.900 2.845 2.830 2.857 . 0 0 "[ . 1 . 2]" 1
841 1 60 LYS H 1 60 LYS QD 1.800 . 5.000 3.686 3.221 4.137 . 0 0 "[ . 1 . 2]" 1
842 1 60 LYS H 1 60 LYS HG2 1.800 . 6.000 3.162 1.949 4.690 . 0 0 "[ . 1 . 2]" 1
843 1 60 LYS H 1 60 LYS HG3 1.800 . 6.000 3.636 2.166 4.487 . 0 0 "[ . 1 . 2]" 1
844 1 60 LYS H 1 61 ASN H 1.800 . 3.500 2.694 2.662 2.736 . 0 0 "[ . 1 . 2]" 1
845 1 60 LYS H 1 61 ASN HA 1.800 . 5.000 5.031 5.002 5.074 0.074 5 0 "[ . 1 . 2]" 1
846 1 60 LYS H 1 62 VAL MG1 1.800 . 6.000 4.867 4.389 5.958 . 0 0 "[ . 1 . 2]" 1
847 1 60 LYS HA 1 61 ASN H 1.800 . 5.000 3.527 3.509 3.544 . 0 0 "[ . 1 . 2]" 1
848 1 60 LYS QB 1 62 VAL QG 1.800 . 5.000 2.513 2.112 3.319 . 0 0 "[ . 1 . 2]" 1
849 1 60 LYS HB2 1 61 ASN H 1.800 . 5.000 3.185 2.727 3.955 . 0 0 "[ . 1 . 2]" 1
850 1 60 LYS HB2 1 79 TYR QE 1.800 . 6.000 4.841 3.868 5.929 . 0 0 "[ . 1 . 2]" 1
851 1 60 LYS HB2 1 80 ILE MG 1.800 . 5.000 4.566 4.268 4.837 . 0 0 "[ . 1 . 2]" 1
852 1 60 LYS HB3 1 61 ASN H 1.800 . 5.000 3.449 2.678 3.896 . 0 0 "[ . 1 . 2]" 1
853 1 60 LYS HB3 1 79 TYR QE 1.800 . 6.000 4.289 3.043 5.568 . 0 0 "[ . 1 . 2]" 1
854 1 60 LYS HB3 1 80 ILE MG 1.800 . 5.000 4.834 4.249 5.027 0.027 9 0 "[ . 1 . 2]" 1
855 1 61 ASN H 1 62 VAL QG 1.800 . 5.000 3.869 3.452 4.590 . 0 0 "[ . 1 . 2]" 1
856 1 61 ASN HA 1 61 ASN QD 1.800 . 5.000 2.383 1.812 3.546 . 0 0 "[ . 1 . 2]" 1
857 1 61 ASN HA 1 62 VAL H 1.800 . 5.000 2.737 2.663 2.852 . 0 0 "[ . 1 . 2]" 1
858 1 61 ASN QD 1 63 LEU QD 1.800 . 5.000 4.921 3.956 5.114 0.114 1 0 "[ . 1 . 2]" 1
859 1 62 VAL H 1 62 VAL HA 1.800 . 2.900 2.967 2.887 2.989 0.089 15 0 "[ . 1 . 2]" 1
860 1 62 VAL H 1 62 VAL MG1 1.800 . 5.000 1.988 1.762 2.588 0.038 14 0 "[ . 1 . 2]" 1
861 1 62 VAL H 1 62 VAL MG2 1.800 . 5.000 3.740 2.194 3.883 . 0 0 "[ . 1 . 2]" 1
862 1 62 VAL H 1 63 LEU H 1.800 . 5.000 4.214 2.484 4.624 . 0 0 "[ . 1 . 2]" 1
863 1 62 VAL HA 1 62 VAL MG1 1.800 . 5.000 3.149 2.448 3.210 . 0 0 "[ . 1 . 2]" 1
864 1 62 VAL HA 1 62 VAL MG2 1.800 . 5.000 2.359 2.151 3.177 . 0 0 "[ . 1 . 2]" 1
865 1 62 VAL HA 1 63 LEU H 1.800 . 5.000 2.445 2.232 3.510 . 0 0 "[ . 1 . 2]" 1
866 1 62 VAL HB 1 63 LEU H 1.800 . 5.000 4.151 4.006 4.420 . 0 0 "[ . 1 . 2]" 1
867 1 62 VAL QG 1 63 LEU HG 1.800 . 6.000 4.729 2.982 5.493 . 0 0 "[ . 1 . 2]" 1
868 1 62 VAL QG 1 80 ILE MG 1.800 . 5.000 3.421 2.737 3.999 . 0 0 "[ . 1 . 2]" 1
869 1 62 VAL MG1 1 63 LEU H 1.800 . 5.000 3.526 1.959 3.872 . 0 0 "[ . 1 . 2]" 1
870 1 62 VAL MG1 1 64 TRP HE1 1.800 . 6.000 4.030 3.570 5.420 . 0 0 "[ . 1 . 2]" 1
871 1 62 VAL MG1 1 64 TRP HE3 1.800 . 6.000 5.063 4.464 6.008 0.008 3 0 "[ . 1 . 2]" 1
872 1 62 VAL MG1 1 64 TRP HH2 1.800 . 6.000 4.886 4.379 5.297 . 0 0 "[ . 1 . 2]" 1
873 1 62 VAL MG1 1 64 TRP HZ3 1.800 . 6.000 5.306 4.768 5.770 . 0 0 "[ . 1 . 2]" 1
874 1 62 VAL MG1 1 68 ASN HD21 1.800 . 5.000 4.681 4.072 5.079 0.079 3 0 "[ . 1 . 2]" 1
875 1 62 VAL MG1 1 68 ASN HD22 1.800 . 5.000 4.992 4.297 5.086 0.086 10 0 "[ . 1 . 2]" 1
876 1 62 VAL MG1 1 79 TYR QD 1.800 . 6.000 4.334 2.231 5.288 . 0 0 "[ . 1 . 2]" 1
877 1 62 VAL MG1 1 79 TYR QE 1.800 . 5.000 2.788 2.218 3.833 . 0 0 "[ . 1 . 2]" 1
878 1 62 VAL MG2 1 63 LEU H 1.800 . 6.000 2.230 1.877 3.531 . 0 0 "[ . 1 . 2]" 1
879 1 62 VAL MG2 1 64 TRP H 1.800 . 6.000 4.568 3.125 5.306 . 0 0 "[ . 1 . 2]" 1
880 1 62 VAL MG2 1 64 TRP HE1 1.800 . 6.000 5.751 3.907 6.047 0.047 10 0 "[ . 1 . 2]" 1
881 1 62 VAL MG2 1 64 TRP HE3 1.800 . 6.000 5.112 3.809 5.566 . 0 0 "[ . 1 . 2]" 1
882 1 62 VAL MG2 1 64 TRP HH2 1.800 . 6.000 5.775 4.294 6.035 0.035 16 0 "[ . 1 . 2]" 1
883 1 62 VAL MG2 1 64 TRP HZ3 1.800 . 6.000 5.500 4.300 5.829 . 0 0 "[ . 1 . 2]" 1
884 1 62 VAL MG2 1 68 ASN HD21 1.800 . 5.000 3.564 2.611 4.631 . 0 0 "[ . 1 . 2]" 1
885 1 62 VAL MG2 1 68 ASN HD22 1.800 . 5.000 3.320 2.520 4.420 . 0 0 "[ . 1 . 2]" 1
886 1 62 VAL MG2 1 79 TYR QD 1.800 . 6.000 4.897 3.129 6.027 0.027 6 0 "[ . 1 . 2]" 1
887 1 62 VAL MG2 1 79 TYR QE 1.800 . 5.000 3.275 2.244 4.260 . 0 0 "[ . 1 . 2]" 1
888 1 63 LEU H 1 63 LEU QD 1.800 . 6.000 3.482 1.679 3.960 0.121 16 0 "[ . 1 . 2]" 1
889 1 63 LEU H 1 68 ASN QD 1.800 . 6.000 4.119 3.633 4.924 . 0 0 "[ . 1 . 2]" 1
890 1 63 LEU HA 1 63 LEU MD1 1.800 . 5.000 2.766 2.045 4.110 . 0 0 "[ . 1 . 2]" 1
891 1 63 LEU HA 1 63 LEU MD2 1.800 . 5.000 3.402 2.175 4.029 . 0 0 "[ . 1 . 2]" 1
892 1 63 LEU HA 1 64 TRP H 1.800 . 3.500 2.215 2.179 2.309 . 0 0 "[ . 1 . 2]" 1
893 1 63 LEU QB 1 64 TRP H 1.800 . 5.000 3.693 3.026 4.027 . 0 0 "[ . 1 . 2]" 1
894 1 63 LEU HB2 1 63 LEU MD1 1.800 . 5.000 2.310 2.207 2.490 . 0 0 "[ . 1 . 2]" 1
895 1 63 LEU HB2 1 63 LEU MD2 1.800 . 5.000 2.619 2.234 3.206 . 0 0 "[ . 1 . 2]" 1
896 1 63 LEU HB2 1 68 ASN QD 1.800 . 5.000 4.811 3.887 5.077 0.077 7 0 "[ . 1 . 2]" 1
897 1 63 LEU HB3 1 63 LEU MD1 1.800 . 5.000 2.888 2.201 3.196 . 0 0 "[ . 1 . 2]" 1
898 1 63 LEU HB3 1 63 LEU MD2 1.800 . 5.000 2.347 2.160 2.471 . 0 0 "[ . 1 . 2]" 1
899 1 63 LEU HB3 1 68 ASN QD 1.800 . 5.000 3.751 3.064 5.161 0.161 6 0 "[ . 1 . 2]" 1
900 1 63 LEU QD 1 66 GLU H 1.800 . 6.000 5.892 5.325 6.094 0.094 6 0 "[ . 1 . 2]" 1
901 1 63 LEU MD1 1 64 TRP H 1.800 . 5.000 3.127 1.846 5.104 0.104 3 0 "[ . 1 . 2]" 1
902 1 63 LEU MD1 1 68 ASN HD21 1.800 . 5.000 4.908 3.228 5.075 0.075 1 0 "[ . 1 . 2]" 1
903 1 63 LEU MD2 1 64 TRP H 1.800 . 5.000 3.925 1.816 5.058 0.058 14 0 "[ . 1 . 2]" 1
904 1 63 LEU MD2 1 68 ASN HD22 1.800 . 5.000 4.480 2.583 5.007 0.007 9 0 "[ . 1 . 2]" 1
905 1 63 LEU HG 1 64 TRP H 1.800 . 6.000 3.507 2.840 5.173 . 0 0 "[ . 1 . 2]" 1
906 1 64 TRP H 1 65 ASP H 1.800 . 6.000 4.587 4.534 4.624 . 0 0 "[ . 1 . 2]" 1
907 1 64 TRP HA 1 69 MET ME 1.800 . 5.000 3.898 3.565 4.733 . 0 0 "[ . 1 . 2]" 1
908 1 64 TRP HB2 1 64 TRP HD1 1.800 . 3.500 2.525 2.512 2.541 . 0 0 "[ . 1 . 2]" 1
909 1 64 TRP HB2 1 65 ASP H 1.800 . 5.000 4.289 4.164 4.374 . 0 0 "[ . 1 . 2]" 1
910 1 64 TRP HB3 1 64 TRP HD1 1.800 . 3.500 3.641 3.589 3.683 0.183 11 0 "[ . 1 . 2]" 1
911 1 64 TRP HB3 1 65 ASP H 1.800 . 5.000 3.246 2.980 3.437 . 0 0 "[ . 1 . 2]" 1
912 1 64 TRP HD1 1 69 MET ME 1.800 . 5.000 4.620 4.385 4.941 . 0 0 "[ . 1 . 2]" 1
913 1 64 TRP HE1 1 81 PRO QG 1.800 . 6.000 5.946 4.714 6.104 0.104 17 0 "[ . 1 . 2]" 1
914 1 64 TRP HE3 1 65 ASP H 1.800 . 5.000 2.902 2.546 3.045 . 0 0 "[ . 1 . 2]" 1
915 1 64 TRP HE3 1 69 MET H 1.800 . 6.000 3.923 3.752 4.147 . 0 0 "[ . 1 . 2]" 1
916 1 64 TRP HE3 1 69 MET HB2 1.800 . 6.000 5.395 5.004 5.615 . 0 0 "[ . 1 . 2]" 1
917 1 64 TRP HE3 1 69 MET HB3 1.800 . 6.000 5.688 5.295 6.030 0.030 20 0 "[ . 1 . 2]" 1
918 1 64 TRP HH2 1 69 MET ME 1.800 . 5.000 4.741 4.401 4.933 . 0 0 "[ . 1 . 2]" 1
919 1 64 TRP HH2 1 72 TYR HB2 1.800 . 6.000 3.230 2.702 3.671 . 0 0 "[ . 1 . 2]" 1
920 1 64 TRP HH2 1 72 TYR HB3 1.800 . 6.000 4.853 4.082 5.193 . 0 0 "[ . 1 . 2]" 1
921 1 64 TRP HH2 1 72 TYR QD 1.800 . 3.500 2.920 2.273 3.527 0.027 14 0 "[ . 1 . 2]" 1
922 1 64 TRP HH2 1 79 TYR QD 1.800 . 6.000 4.593 3.844 5.972 . 0 0 "[ . 1 . 2]" 1
923 1 64 TRP HH2 1 80 ILE MD 1.800 . 3.500 2.549 2.122 3.524 0.024 12 0 "[ . 1 . 2]" 1
924 1 64 TRP HZ2 1 69 MET ME 1.800 . 5.000 5.010 4.773 5.102 0.102 7 0 "[ . 1 . 2]" 1
925 1 64 TRP HZ3 1 65 ASP H 1.800 . 5.000 4.971 4.698 5.072 0.072 3 0 "[ . 1 . 2]" 1
926 1 64 TRP HZ3 1 69 MET H 1.800 . 5.000 4.521 4.304 4.797 . 0 0 "[ . 1 . 2]" 1
927 1 64 TRP HZ3 1 69 MET HB2 1.800 . 6.000 5.845 5.354 6.078 0.078 9 0 "[ . 1 . 2]" 1
928 1 64 TRP HZ3 1 69 MET HB3 1.800 . 6.000 5.675 5.000 6.054 0.054 16 0 "[ . 1 . 2]" 1
929 1 64 TRP HZ3 1 69 MET ME 1.800 . 5.000 3.656 3.280 3.918 . 0 0 "[ . 1 . 2]" 1
930 1 64 TRP HZ3 1 72 TYR H 1.800 . 6.000 4.025 3.681 4.375 . 0 0 "[ . 1 . 2]" 1
931 1 64 TRP HZ3 1 72 TYR HB2 1.800 . 5.000 2.350 2.248 2.788 . 0 0 "[ . 1 . 2]" 1
932 1 64 TRP HZ3 1 72 TYR HB3 1.800 . 5.000 3.685 2.901 4.256 . 0 0 "[ . 1 . 2]" 1
933 1 64 TRP HZ3 2 1 HEC HAA1 1.800 . 5.000 4.574 4.127 4.896 . 0 0 "[ . 1 . 2]" 1
934 1 65 ASP H 1 66 GLU H 1.800 . 5.000 4.414 4.377 4.443 . 0 0 "[ . 1 . 2]" 1
935 1 65 ASP H 1 68 ASN QD 1.800 . 5.000 2.036 1.832 2.239 . 0 0 "[ . 1 . 2]" 1
936 1 65 ASP H 1 68 ASN HD22 1.800 . 3.500 3.531 3.419 3.634 0.134 3 0 "[ . 1 . 2]" 1
937 1 65 ASP H 1 69 MET H 1.800 . 5.000 3.517 3.398 3.680 . 0 0 "[ . 1 . 2]" 1
938 1 65 ASP H 1 69 MET QB 1.800 . 5.000 5.080 4.873 5.170 0.170 9 0 "[ . 1 . 2]" 1
939 1 65 ASP H 1 69 MET ME 1.800 . 5.000 3.794 3.089 4.785 . 0 0 "[ . 1 . 2]" 1
940 1 65 ASP HB2 1 66 GLU H 1.800 . 3.500 3.288 2.095 3.724 0.224 20 0 "[ . 1 . 2]" 1
941 1 65 ASP HB3 1 66 GLU H 1.800 . 3.500 2.807 2.240 3.642 0.142 7 0 "[ . 1 . 2]" 1
942 1 66 GLU H 1 67 ASN H 1.800 . 5.000 2.708 2.657 2.785 . 0 0 "[ . 1 . 2]" 1
943 1 66 GLU H 1 68 ASN H 1.800 . 5.000 4.264 4.139 4.428 . 0 0 "[ . 1 . 2]" 1
944 1 66 GLU HA 1 67 ASN H 1.800 . 3.500 3.546 3.536 3.554 0.054 12 0 "[ . 1 . 2]" 1
945 1 66 GLU HA 1 68 ASN H 1.800 . 5.000 4.543 4.461 4.623 . 0 0 "[ . 1 . 2]" 1
946 1 66 GLU HA 1 69 MET H 1.800 . 5.000 3.480 3.374 3.701 . 0 0 "[ . 1 . 2]" 1
947 1 66 GLU HA 1 69 MET HB2 1.800 . 5.000 2.717 2.531 3.154 . 0 0 "[ . 1 . 2]" 1
948 1 66 GLU HA 1 69 MET HB3 1.800 . 5.000 4.249 4.015 4.693 . 0 0 "[ . 1 . 2]" 1
949 1 66 GLU HA 1 70 SER H 1.800 . 5.000 4.532 4.240 4.928 . 0 0 "[ . 1 . 2]" 1
950 1 66 GLU HA 1 100 ILE MG 1.800 . 5.000 3.076 2.485 4.116 . 0 0 "[ . 1 . 2]" 1
951 1 66 GLU HB2 1 67 ASN H 1.800 . 5.000 2.655 2.624 2.713 . 0 0 "[ . 1 . 2]" 1
952 1 66 GLU HB2 1 100 ILE MG 1.800 . 6.000 4.480 3.559 5.719 . 0 0 "[ . 1 . 2]" 1
953 1 66 GLU HB3 1 67 ASN H 1.800 . 5.000 3.685 3.659 3.735 . 0 0 "[ . 1 . 2]" 1
954 1 66 GLU HB3 1 100 ILE MG 1.800 . 5.000 3.107 2.130 4.345 . 0 0 "[ . 1 . 2]" 1
955 1 67 ASN H 1 67 ASN HB2 1.800 . 3.500 2.451 2.366 2.489 . 0 0 "[ . 1 . 2]" 1
956 1 67 ASN H 1 68 ASN H 1.800 . 5.000 2.662 2.606 2.719 . 0 0 "[ . 1 . 2]" 1
957 1 67 ASN H 1 69 MET H 1.800 . 5.000 4.050 3.967 4.139 . 0 0 "[ . 1 . 2]" 1
958 1 67 ASN HA 1 68 ASN H 1.800 . 3.500 3.553 3.547 3.558 0.058 8 0 "[ . 1 . 2]" 1
959 1 67 ASN HA 1 69 MET H 1.800 . 5.000 4.320 4.197 4.421 . 0 0 "[ . 1 . 2]" 1
960 1 67 ASN HA 1 70 SER H 1.800 . 5.000 3.479 3.385 3.580 . 0 0 "[ . 1 . 2]" 1
961 1 67 ASN HA 1 71 GLU H 1.800 . 5.000 4.762 4.589 4.879 . 0 0 "[ . 1 . 2]" 1
962 1 67 ASN HB2 1 68 ASN H 1.800 . 3.500 2.629 2.485 3.595 0.095 1 0 "[ . 1 . 2]" 1
963 1 67 ASN HB3 1 68 ASN H 1.800 . 3.500 3.430 2.369 3.566 0.066 20 0 "[ . 1 . 2]" 1
964 1 68 ASN H 1 69 MET H 1.800 . 3.500 2.684 2.630 2.754 . 0 0 "[ . 1 . 2]" 1
965 1 68 ASN H 1 70 SER H 1.800 . 6.000 4.234 4.144 4.341 . 0 0 "[ . 1 . 2]" 1
966 1 68 ASN HA 1 69 MET H 1.800 . 5.000 3.543 3.530 3.552 . 0 0 "[ . 1 . 2]" 1
967 1 68 ASN HA 1 70 SER H 1.800 . 5.000 4.256 4.174 4.316 . 0 0 "[ . 1 . 2]" 1
968 1 68 ASN HA 1 71 GLU H 1.800 . 5.000 3.407 3.198 3.573 . 0 0 "[ . 1 . 2]" 1
969 1 68 ASN HA 1 71 GLU HB2 1.800 . 5.000 3.056 2.804 3.863 . 0 0 "[ . 1 . 2]" 1
970 1 68 ASN HA 1 71 GLU HB3 1.800 . 5.000 4.395 3.033 4.797 . 0 0 "[ . 1 . 2]" 1
971 1 68 ASN HA 1 72 TYR H 1.800 . 5.000 4.318 4.158 4.602 . 0 0 "[ . 1 . 2]" 1
972 1 68 ASN QB 1 69 MET H 1.800 . 5.000 2.594 2.538 2.655 . 0 0 "[ . 1 . 2]" 1
973 1 69 MET H 1 70 SER H 1.800 . 5.000 2.732 2.701 2.757 . 0 0 "[ . 1 . 2]" 1
974 1 69 MET H 1 71 GLU H 1.800 . 6.000 4.275 4.077 4.378 . 0 0 "[ . 1 . 2]" 1
975 1 69 MET QB 1 73 LEU MD1 1.800 . 5.000 3.605 3.281 4.024 . 0 0 "[ . 1 . 2]" 1
976 1 69 MET QB 1 73 LEU MD2 1.800 . 5.000 4.695 3.821 5.071 0.071 20 0 "[ . 1 . 2]" 1
977 1 69 MET QB 1 100 ILE MG 1.800 . 5.000 2.696 2.173 3.118 . 0 0 "[ . 1 . 2]" 1
978 1 69 MET HB2 1 70 SER H 1.800 . 5.000 2.751 2.670 3.092 . 0 0 "[ . 1 . 2]" 1
979 1 69 MET HB3 1 70 SER H 1.800 . 5.000 3.564 3.080 3.653 . 0 0 "[ . 1 . 2]" 1
980 1 69 MET ME 1 100 ILE MG 1.800 . 5.000 4.911 4.501 5.038 0.038 7 0 "[ . 1 . 2]" 1
981 1 69 MET ME 1 103 LEU MD1 1.800 . 5.000 3.860 2.912 5.083 0.083 8 0 "[ . 1 . 2]" 1
982 1 69 MET ME 1 103 LEU MD2 1.800 . 5.000 4.300 2.638 5.098 0.098 9 0 "[ . 1 . 2]" 1
983 1 69 MET ME 2 1 HEC HAA1 1.800 . 3.500 2.628 2.247 3.183 . 0 0 "[ . 1 . 2]" 1
984 1 69 MET ME 2 1 HEC HAA2 1.800 . 5.000 3.938 3.608 4.237 . 0 0 "[ . 1 . 2]" 1
985 1 69 MET ME 2 1 HEC HBA1 1.800 . 6.000 4.072 3.051 4.868 . 0 0 "[ . 1 . 2]" 1
986 1 69 MET ME 2 1 HEC HHB 1.800 . 5.000 4.754 4.397 5.014 0.014 11 0 "[ . 1 . 2]" 1
987 1 70 SER HA 1 71 GLU H 1.800 . 3.500 3.548 3.519 3.557 0.057 14 0 "[ . 1 . 2]" 1
988 1 70 SER HA 1 72 TYR H 1.800 . 5.000 4.284 4.227 4.357 . 0 0 "[ . 1 . 2]" 1
989 1 70 SER HA 1 73 LEU H 1.800 . 5.000 3.752 3.621 3.895 . 0 0 "[ . 1 . 2]" 1
990 1 71 GLU H 1 71 GLU HA 1.800 . 2.900 2.883 2.866 2.903 0.003 11 0 "[ . 1 . 2]" 1
991 1 71 GLU H 1 71 GLU HB2 1.800 . 3.500 2.453 2.424 2.578 . 0 0 "[ . 1 . 2]" 1
992 1 71 GLU H 1 71 GLU HB3 1.800 . 3.500 3.450 2.572 3.603 0.103 19 0 "[ . 1 . 2]" 1
993 1 71 GLU H 1 72 TYR H 1.800 . 3.500 2.541 2.464 2.641 . 0 0 "[ . 1 . 2]" 1
994 1 71 GLU HA 1 72 TYR H 1.800 . 3.500 3.518 3.503 3.541 0.041 6 0 "[ . 1 . 2]" 1
995 1 71 GLU HB2 1 72 TYR H 1.800 . 5.000 2.945 2.722 3.964 . 0 0 "[ . 1 . 2]" 1
996 1 71 GLU HB2 1 79 TYR QD 1.800 . 6.000 5.697 4.494 6.069 0.069 20 0 "[ . 1 . 2]" 1
997 1 71 GLU HB2 1 79 TYR QE 1.800 . 6.000 4.700 3.511 5.701 . 0 0 "[ . 1 . 2]" 1
998 1 71 GLU HB3 1 72 TYR H 1.800 . 5.000 3.613 2.653 3.834 . 0 0 "[ . 1 . 2]" 1
999 1 71 GLU HB3 1 79 TYR QD 1.800 . 6.000 5.204 4.177 5.971 . 0 0 "[ . 1 . 2]" 1
1000 1 71 GLU HB3 1 79 TYR QE 1.800 . 6.000 4.698 3.397 5.961 . 0 0 "[ . 1 . 2]" 1
1001 1 72 TYR H 1 72 TYR HA 1.800 . 2.900 2.839 2.809 2.864 . 0 0 "[ . 1 . 2]" 1
1002 1 72 TYR H 1 73 LEU H 1.800 . 3.500 2.834 2.786 2.872 . 0 0 "[ . 1 . 2]" 1
1003 1 72 TYR H 1 79 TYR QE 1.800 . 6.000 4.894 4.101 5.949 . 0 0 "[ . 1 . 2]" 1
1004 1 72 TYR HA 1 72 TYR QD 1.800 . 5.000 2.551 2.191 3.120 . 0 0 "[ . 1 . 2]" 1
1005 1 72 TYR HA 1 75 ASN H 1.800 . 6.000 3.780 3.513 4.371 . 0 0 "[ . 1 . 2]" 1
1006 1 72 TYR HA 1 76 HIS HD2 1.800 . 6.000 4.683 3.345 5.858 . 0 0 "[ . 1 . 2]" 1
1007 1 72 TYR HA 1 79 TYR QE 1.800 . 5.000 3.854 2.986 4.811 . 0 0 "[ . 1 . 2]" 1
1008 1 72 TYR QB 1 76 HIS HD2 1.800 . 6.000 5.773 5.235 6.039 0.039 8 0 "[ . 1 . 2]" 1
1009 1 72 TYR HB2 1 72 TYR QD 1.800 . 3.500 2.573 2.322 2.757 . 0 0 "[ . 1 . 2]" 1
1010 1 72 TYR HB2 1 73 LEU H 1.800 . 5.000 3.866 3.592 3.965 . 0 0 "[ . 1 . 2]" 1
1011 1 72 TYR HB3 1 72 TYR QD 1.800 . 3.500 2.345 2.286 2.560 . 0 0 "[ . 1 . 2]" 1
1012 1 72 TYR HB3 1 73 LEU H 1.800 . 5.000 2.477 2.149 2.609 . 0 0 "[ . 1 . 2]" 1
1013 1 72 TYR QD 1 76 HIS HB2 1.800 . 3.500 3.250 2.376 3.604 0.104 6 0 "[ . 1 . 2]" 1
1014 1 72 TYR QD 1 76 HIS HB3 1.800 . 3.500 2.604 2.250 3.037 . 0 0 "[ . 1 . 2]" 1
1015 1 72 TYR QE 1 76 HIS HB2 1.800 . 3.500 2.942 2.283 3.339 . 0 0 "[ . 1 . 2]" 1
1016 1 72 TYR QE 1 76 HIS HB3 1.800 . 3.500 3.330 2.278 3.601 0.101 16 0 "[ . 1 . 2]" 1
1017 1 73 LEU H 1 73 LEU HB2 1.800 . 3.500 2.355 2.205 2.518 . 0 0 "[ . 1 . 2]" 1
1018 1 73 LEU H 1 73 LEU HB3 1.800 . 3.500 3.575 3.527 3.598 0.098 9 0 "[ . 1 . 2]" 1
1019 1 73 LEU H 1 73 LEU MD1 1.800 . 5.000 2.910 1.848 3.610 . 0 0 "[ . 1 . 2]" 1
1020 1 73 LEU H 1 73 LEU MD2 1.800 . 5.000 3.528 3.164 3.849 . 0 0 "[ . 1 . 2]" 1
1021 1 73 LEU H 1 73 LEU HG 1.800 . 5.000 2.911 2.027 4.082 . 0 0 "[ . 1 . 2]" 1
1022 1 73 LEU H 1 74 THR H 1.800 . 3.500 2.622 2.528 2.759 . 0 0 "[ . 1 . 2]" 1
1023 1 73 LEU H 1 75 ASN H 1.800 . 5.000 4.098 3.942 4.750 . 0 0 "[ . 1 . 2]" 1
1024 1 73 LEU HA 1 73 LEU MD1 1.800 . 5.000 3.180 2.199 3.825 . 0 0 "[ . 1 . 2]" 1
1025 1 73 LEU HA 1 73 LEU MD2 1.800 . 5.000 2.748 2.063 3.779 . 0 0 "[ . 1 . 2]" 1
1026 1 73 LEU HA 1 74 THR H 1.800 . 3.500 3.550 3.528 3.559 0.059 17 0 "[ . 1 . 2]" 1
1027 1 73 LEU HA 1 75 ASN H 1.800 . 5.000 4.573 4.315 4.741 . 0 0 "[ . 1 . 2]" 1
1028 1 73 LEU HA 1 76 HIS HD2 1.800 . 6.000 4.361 3.300 6.043 0.043 13 0 "[ . 1 . 2]" 1
1029 1 73 LEU HB2 1 74 THR H 1.800 . 3.500 2.661 2.534 2.823 . 0 0 "[ . 1 . 2]" 1
1030 1 73 LEU HB3 1 74 THR H 1.800 . 3.500 3.511 3.306 3.630 0.130 14 0 "[ . 1 . 2]" 1
1031 1 73 LEU QD 1 76 HIS HD1 1.800 . 6.000 5.743 5.030 6.045 0.045 7 0 "[ . 1 . 2]" 1
1032 1 73 LEU QD 1 76 HIS HD2 1.800 . 6.000 5.144 4.510 5.979 . 0 0 "[ . 1 . 2]" 1
1033 1 73 LEU MD1 1 74 THR H 1.800 . 5.000 4.281 3.855 4.528 . 0 0 "[ . 1 . 2]" 1
1034 1 73 LEU MD1 1 85 MET ME 1.800 . 5.000 4.396 3.192 5.073 0.073 10 0 "[ . 1 . 2]" 1
1035 1 73 LEU MD1 1 87 PHE QD 1.800 . 5.000 4.963 4.710 5.087 0.087 9 0 "[ . 1 . 2]" 1
1036 1 73 LEU MD1 1 87 PHE QE 1.800 . 5.000 4.614 3.925 5.066 0.066 11 0 "[ . 1 . 2]" 1
1037 1 73 LEU MD2 1 74 THR H 1.800 . 5.000 4.629 4.533 4.722 . 0 0 "[ . 1 . 2]" 1
1038 1 73 LEU MD2 1 85 MET ME 1.800 . 5.000 3.803 2.788 5.037 0.037 15 0 "[ . 1 . 2]" 1
1039 1 73 LEU MD2 1 87 PHE QD 1.800 . 5.000 3.922 3.304 5.022 0.022 5 0 "[ . 1 . 2]" 1
1040 1 73 LEU MD2 1 87 PHE QE 1.800 . 5.000 3.661 2.985 4.287 . 0 0 "[ . 1 . 2]" 1
1041 1 73 LEU HG 1 74 THR H 1.800 . 5.000 4.615 4.198 5.106 0.106 13 0 "[ . 1 . 2]" 1
1042 1 74 THR H 1 74 THR MG 1.800 . 2.900 2.097 1.955 2.218 . 0 0 "[ . 1 . 2]" 1
1043 1 74 THR H 1 75 ASN H 1.800 . 5.000 2.609 2.519 3.117 . 0 0 "[ . 1 . 2]" 1
1044 1 74 THR HA 1 74 THR HB 1.800 . 2.900 2.439 2.425 2.500 . 0 0 "[ . 1 . 2]" 1
1045 1 74 THR HA 1 74 THR MG 1.800 . 3.500 2.426 2.368 2.465 . 0 0 "[ . 1 . 2]" 1
1046 1 74 THR HA 1 75 ASN H 1.800 . 5.000 3.556 3.533 3.604 . 0 0 "[ . 1 . 2]" 1
1047 1 74 THR HB 1 75 ASN H 1.800 . 5.000 3.748 3.250 3.908 . 0 0 "[ . 1 . 2]" 1
1048 1 74 THR MG 1 75 ASN H 1.800 . 5.000 3.778 3.699 3.846 . 0 0 "[ . 1 . 2]" 1
1049 1 75 ASN H 1 76 HIS H 1.800 . 5.000 4.094 3.397 4.367 . 0 0 "[ . 1 . 2]" 1
1050 1 75 ASN HB2 1 76 HIS H 1.800 . 5.000 4.363 3.956 4.649 . 0 0 "[ . 1 . 2]" 1
1051 1 75 ASN HB3 1 76 HIS H 1.800 . 5.000 3.774 2.948 4.377 . 0 0 "[ . 1 . 2]" 1
1052 1 76 HIS H 1 76 HIS HB3 1.800 . 3.500 3.524 3.286 3.643 0.143 16 0 "[ . 1 . 2]" 1
1053 1 76 HIS H 1 77 ALA H 1.800 . 5.000 4.115 2.677 4.483 . 0 0 "[ . 1 . 2]" 1
1054 1 76 HIS H 1 78 LYS H 1.800 . 6.000 5.471 3.900 6.119 0.119 13 0 "[ . 1 . 2]" 1
1055 1 76 HIS H 1 79 TYR QD 1.800 . 6.000 5.756 5.428 6.101 0.101 13 0 "[ . 1 . 2]" 1
1056 1 76 HIS HA 1 77 ALA H 1.800 . 5.000 2.339 2.182 2.701 . 0 0 "[ . 1 . 2]" 1
1057 1 76 HIS HA 1 78 LYS H 1.800 . 6.000 4.858 3.180 5.746 . 0 0 "[ . 1 . 2]" 1
1058 1 76 HIS HA 1 79 TYR H 1.800 . 5.000 4.393 3.953 4.756 . 0 0 "[ . 1 . 2]" 1
1059 1 76 HIS HA 1 79 TYR QB 1.800 . 6.000 3.919 3.033 6.031 0.031 3 0 "[ . 1 . 2]" 1
1060 1 76 HIS HA 1 80 ILE H 1.800 . 5.000 4.339 3.554 5.019 0.019 19 0 "[ . 1 . 2]" 1
1061 1 76 HIS QB 1 77 ALA H 1.800 . 5.000 3.024 2.189 4.025 . 0 0 "[ . 1 . 2]" 1
1062 1 76 HIS QB 1 79 TYR QE 1.800 . 5.000 4.815 4.065 5.134 0.134 16 0 "[ . 1 . 2]" 1
1063 1 76 HIS HD1 1 80 ILE MD 1.800 . 5.000 4.209 1.773 5.038 0.038 8 0 "[ . 1 . 2]" 1
1064 1 77 ALA H 1 77 ALA MB 1.800 . 3.500 2.907 2.339 3.033 . 0 0 "[ . 1 . 2]" 1
1065 1 77 ALA H 1 78 LYS H 1.800 . 5.000 3.420 2.892 3.777 . 0 0 "[ . 1 . 2]" 1
1066 1 77 ALA H 1 79 TYR H 1.800 . 5.000 3.179 2.578 3.728 . 0 0 "[ . 1 . 2]" 1
1067 1 77 ALA HA 1 78 LYS H 1.800 . 3.500 3.468 3.398 3.566 0.066 13 0 "[ . 1 . 2]" 1
1068 1 77 ALA HA 1 79 TYR H 1.800 . 5.000 4.490 3.968 4.709 . 0 0 "[ . 1 . 2]" 1
1069 1 77 ALA HA 1 80 ILE H 1.800 . 5.000 3.918 2.863 4.333 . 0 0 "[ . 1 . 2]" 1
1070 1 77 ALA HA 1 83 THR MG 1.800 . 5.000 4.973 4.500 5.119 0.119 12 0 "[ . 1 . 2]" 1
1071 1 77 ALA MB 1 78 LYS H 1.800 . 3.500 2.050 1.715 2.876 0.085 10 0 "[ . 1 . 2]" 1
1072 1 78 LYS H 1 80 ILE H 1.800 . 5.000 4.272 3.603 4.534 . 0 0 "[ . 1 . 2]" 1
1073 1 78 LYS HA 1 79 TYR H 1.800 . 3.500 3.524 3.493 3.556 0.056 8 0 "[ . 1 . 2]" 1
1074 1 78 LYS HA 1 80 ILE H 1.800 . 5.000 4.351 4.116 4.561 . 0 0 "[ . 1 . 2]" 1
1075 1 78 LYS QB 1 79 TYR H 1.800 . 5.000 2.672 2.531 2.730 . 0 0 "[ . 1 . 2]" 1
1076 1 79 TYR H 1 79 TYR QB 1.800 . 3.500 2.351 2.095 2.933 . 0 0 "[ . 1 . 2]" 1
1077 1 79 TYR HA 1 79 TYR QD 1.800 . 3.500 2.667 2.244 3.684 0.184 8 0 "[ . 1 . 2]" 1
1078 1 79 TYR HA 1 79 TYR QE 1.800 . 6.000 4.863 4.553 5.588 . 0 0 "[ . 1 . 2]" 1
1079 1 79 TYR HA 1 80 ILE H 1.800 . 5.000 3.478 3.150 3.577 . 0 0 "[ . 1 . 2]" 1
1080 1 79 TYR QB 1 79 TYR QD 1.800 . 2.900 2.175 2.142 2.222 . 0 0 "[ . 1 . 2]" 1
1081 1 79 TYR QB 1 80 ILE H 1.800 . 5.000 2.974 2.592 3.969 . 0 0 "[ . 1 . 2]" 1
1082 1 79 TYR QD 1 80 ILE H 1.800 . 3.500 3.612 3.422 3.736 0.236 11 0 "[ . 1 . 2]" 1
1083 1 79 TYR QD 1 80 ILE MD 1.800 . 5.000 3.348 2.768 4.172 . 0 0 "[ . 1 . 2]" 1
1084 1 79 TYR QE 1 80 ILE H 1.800 . 6.000 5.037 4.531 5.407 . 0 0 "[ . 1 . 2]" 1
1085 1 79 TYR QE 1 80 ILE HB 1.800 . 6.000 5.313 4.845 5.877 . 0 0 "[ . 1 . 2]" 1
1086 1 79 TYR QE 1 80 ILE MD 1.800 . 5.000 3.317 2.640 4.497 . 0 0 "[ . 1 . 2]" 1
1087 1 79 TYR QE 1 80 ILE MG 1.800 . 6.000 2.854 2.536 3.549 . 0 0 "[ . 1 . 2]" 1
1088 1 80 ILE H 1 80 ILE MD 1.800 . 5.000 3.527 2.280 3.679 . 0 0 "[ . 1 . 2]" 1
1089 1 80 ILE H 1 80 ILE MG 1.800 . 6.000 3.462 3.292 3.715 . 0 0 "[ . 1 . 2]" 1
1090 1 80 ILE HA 1 80 ILE MD 1.800 . 5.000 4.065 3.528 4.127 . 0 0 "[ . 1 . 2]" 1
1091 1 80 ILE HA 1 80 ILE MG 1.800 . 6.000 2.145 2.108 2.216 . 0 0 "[ . 1 . 2]" 1
1092 1 80 ILE HB 1 80 ILE MD 1.800 . 5.000 2.243 2.169 2.382 . 0 0 "[ . 1 . 2]" 1
1093 1 81 PRO HB2 1 82 GLY H 1.800 . 5.000 3.386 2.779 3.912 . 0 0 "[ . 1 . 2]" 1
1094 1 81 PRO HB3 1 82 GLY H 1.800 . 5.000 3.437 3.032 4.427 . 0 0 "[ . 1 . 2]" 1
1095 1 81 PRO QD 1 82 GLY H 1.800 . 5.000 4.726 3.453 5.042 0.042 16 0 "[ . 1 . 2]" 1
1096 1 81 PRO QG 1 82 GLY H 1.800 . 5.000 4.535 3.514 4.894 . 0 0 "[ . 1 . 2]" 1
1097 1 81 PRO QG 2 1 HEC HHA 1.800 . 6.000 6.071 6.007 6.105 0.105 5 0 "[ . 1 . 2]" 1
1098 1 82 GLY H 1 83 THR H 1.800 . 5.000 2.820 2.181 3.182 . 0 0 "[ . 1 . 2]" 1
1099 1 82 GLY QA 1 83 THR H 1.800 . 5.000 2.889 2.778 2.932 . 0 0 "[ . 1 . 2]" 1
1100 1 83 THR H 1 83 THR MG 1.800 . 5.000 2.419 2.033 2.696 . 0 0 "[ . 1 . 2]" 1
1101 1 83 THR H 1 84 LYS H 1.800 . 5.000 4.509 2.997 4.670 . 0 0 "[ . 1 . 2]" 1
1102 1 83 THR HA 1 83 THR MG 1.800 . 5.000 3.179 3.170 3.185 . 0 0 "[ . 1 . 2]" 1
1103 1 83 THR MG 1 84 LYS H 1.800 . 5.000 3.689 1.786 4.106 0.014 13 0 "[ . 1 . 2]" 1
1104 1 83 THR MG 1 85 MET H 1.800 . 5.000 4.168 2.434 4.858 . 0 0 "[ . 1 . 2]" 1
1105 1 83 THR MG 1 85 MET ME 1.800 . 5.000 4.997 4.231 5.097 0.097 1 0 "[ . 1 . 2]" 1
1106 1 84 LYS HA 1 85 MET H 1.800 . 5.000 2.401 2.193 3.560 . 0 0 "[ . 1 . 2]" 1
1107 1 85 MET H 1 85 MET QG 1.800 . 5.000 3.795 2.420 4.131 . 0 0 "[ . 1 . 2]" 1
1108 1 85 MET H 1 86 ALA H 1.800 . 5.000 4.313 2.715 4.570 . 0 0 "[ . 1 . 2]" 1
1109 1 85 MET HA 1 85 MET ME 1.800 . 5.000 4.394 3.690 4.626 . 0 0 "[ . 1 . 2]" 1
1110 1 85 MET HA 1 85 MET QG 1.800 . 5.000 2.237 2.114 2.434 . 0 0 "[ . 1 . 2]" 1
1111 1 85 MET HA 1 86 ALA H 1.800 . 5.000 2.295 2.179 3.565 . 0 0 "[ . 1 . 2]" 1
1112 1 85 MET HA 2 1 HEC HAC 1.800 . 6.000 5.347 4.404 5.944 . 0 0 "[ . 1 . 2]" 1
1113 1 85 MET HA 2 1 HEC HHD 1.800 . 5.000 4.014 3.345 4.438 . 0 0 "[ . 1 . 2]" 1
1114 1 85 MET HB2 1 85 MET ME 1.800 . 5.000 2.947 2.009 3.499 . 0 0 "[ . 1 . 2]" 1
1115 1 85 MET HB3 1 85 MET ME 1.800 . 5.000 2.471 2.217 2.991 . 0 0 "[ . 1 . 2]" 1
1116 1 85 MET ME 1 85 MET QG 1.800 . 5.000 2.229 2.118 2.577 . 0 0 "[ . 1 . 2]" 1
1117 1 85 MET ME 1 87 PHE H 1.800 . 5.000 3.576 3.191 4.029 . 0 0 "[ . 1 . 2]" 1
1118 1 85 MET ME 1 87 PHE HA 1.800 . 5.000 4.651 4.344 5.046 0.046 6 0 "[ . 1 . 2]" 1
1119 1 85 MET ME 1 87 PHE HB2 1.800 . 5.000 3.009 2.444 3.916 . 0 0 "[ . 1 . 2]" 1
1120 1 85 MET ME 1 87 PHE HB3 1.800 . 5.000 2.267 2.014 3.061 . 0 0 "[ . 1 . 2]" 1
1121 1 85 MET ME 1 87 PHE QD 1.800 . 5.000 3.238 2.729 3.748 . 0 0 "[ . 1 . 2]" 1
1122 1 85 MET ME 1 87 PHE QE 1.800 . 5.000 4.807 4.554 5.110 0.110 20 0 "[ . 1 . 2]" 1
1123 1 85 MET ME 2 1 HEC HAB 1.800 . 5.000 4.846 4.357 5.099 0.099 14 0 "[ . 1 . 2]" 1
1124 1 85 MET ME 2 1 HEC HBA1 1.800 . 5.000 3.966 3.287 4.847 . 0 0 "[ . 1 . 2]" 1
1125 1 85 MET ME 2 1 HEC HHA 1.800 . 6.000 5.377 4.927 5.969 . 0 0 "[ . 1 . 2]" 1
1126 1 85 MET ME 2 1 HEC HHB 1.800 . 5.000 3.540 3.347 4.035 . 0 0 "[ . 1 . 2]" 1
1127 1 85 MET ME 2 1 HEC HHD 1.800 . 6.000 5.972 5.515 6.078 0.078 6 0 "[ . 1 . 2]" 1
1128 1 85 MET QG 1 86 ALA H 1.800 . 5.000 3.066 2.345 4.501 . 0 0 "[ . 1 . 2]" 1
1129 1 85 MET QG 1 86 ALA MB 1.800 . 6.000 4.206 3.623 5.724 . 0 0 "[ . 1 . 2]" 1
1130 1 85 MET QG 1 87 PHE QB 1.800 . 5.000 2.888 1.975 4.655 . 0 0 "[ . 1 . 2]" 1
1131 1 85 MET QG 2 1 HEC HHD 1.800 . 5.000 3.784 3.383 4.560 . 0 0 "[ . 1 . 2]" 1
1132 1 86 ALA H 1 86 ALA MB 1.800 . 5.000 2.158 2.036 2.925 . 0 0 "[ . 1 . 2]" 1
1133 1 86 ALA H 1 87 PHE QB 1.800 . 5.000 4.425 4.115 4.567 . 0 0 "[ . 1 . 2]" 1
1134 1 86 ALA HA 1 87 PHE H 1.800 . 5.000 3.447 2.986 3.540 . 0 0 "[ . 1 . 2]" 1
1135 1 86 ALA MB 1 87 PHE H 1.800 . 5.000 2.974 2.724 3.600 . 0 0 "[ . 1 . 2]" 1
1136 1 86 ALA MB 2 1 HEC HAC 1.800 . 5.000 4.875 4.467 5.041 0.041 13 0 "[ . 1 . 2]" 1
1137 1 86 ALA MB 2 1 HEC HHD 1.800 . 6.000 5.303 4.663 5.670 . 0 0 "[ . 1 . 2]" 1
1138 1 87 PHE H 1 87 PHE HB2 1.800 . 3.500 2.506 2.273 2.823 . 0 0 "[ . 1 . 2]" 1
1139 1 87 PHE H 1 87 PHE HB3 1.800 . 3.500 2.682 2.327 2.909 . 0 0 "[ . 1 . 2]" 1
1140 1 87 PHE HA 1 87 PHE QD 1.800 . 5.000 2.744 2.232 3.063 . 0 0 "[ . 1 . 2]" 1
1141 1 87 PHE HA 1 87 PHE QE 1.800 . 5.000 4.489 4.305 4.615 . 0 0 "[ . 1 . 2]" 1
1142 1 87 PHE QB 1 87 PHE QD 1.800 . 2.900 2.157 2.150 2.228 . 0 0 "[ . 1 . 2]" 1
1143 1 87 PHE QB 2 1 HEC HHC 1.800 . 6.000 3.050 2.589 3.571 . 0 0 "[ . 1 . 2]" 1
1144 1 87 PHE QD 1 89 GLY HA2 1.800 . 5.000 3.496 2.462 3.970 . 0 0 "[ . 1 . 2]" 1
1145 1 87 PHE QD 1 89 GLY HA3 1.800 . 5.000 4.959 3.952 5.115 0.115 2 0 "[ . 1 . 2]" 1
1146 1 87 PHE QD 2 1 HEC HHC 1.800 . 5.000 3.665 2.635 4.492 . 0 0 "[ . 1 . 2]" 1
1147 1 87 PHE QE 1 89 GLY QA 1.800 . 5.000 3.123 2.251 3.564 . 0 0 "[ . 1 . 2]" 1
1148 1 87 PHE QE 1 90 LEU H 1.800 . 5.000 3.510 3.128 4.219 . 0 0 "[ . 1 . 2]" 1
1149 1 87 PHE QE 1 90 LEU HB2 1.800 . 5.000 3.117 2.243 4.648 . 0 0 "[ . 1 . 2]" 1
1150 1 87 PHE QE 1 90 LEU HB3 1.800 . 5.000 4.158 3.347 5.096 0.096 17 0 "[ . 1 . 2]" 1
1151 1 87 PHE QE 1 90 LEU MD1 1.800 . 3.500 3.097 2.209 3.637 0.137 15 0 "[ . 1 . 2]" 1
1152 1 87 PHE QE 1 90 LEU MD2 1.800 . 3.500 3.409 2.246 3.607 0.107 11 0 "[ . 1 . 2]" 1
1153 1 87 PHE QE 1 90 LEU HG 1.800 . 5.000 4.129 2.283 5.097 0.097 1 0 "[ . 1 . 2]" 1
1154 1 87 PHE HZ 1 90 LEU H 1.800 . 5.000 4.799 3.334 5.051 0.051 19 0 "[ . 1 . 2]" 1
1155 1 87 PHE HZ 1 90 LEU MD1 1.800 . 3.500 2.455 2.022 3.578 0.078 11 0 "[ . 1 . 2]" 1
1156 1 87 PHE HZ 1 90 LEU MD2 1.800 . 3.500 2.635 2.172 3.730 0.230 15 0 "[ . 1 . 2]" 1
1157 1 89 GLY H 1 90 LEU H 1.800 . 5.000 4.509 4.302 4.692 . 0 0 "[ . 1 . 2]" 1
1158 1 89 GLY HA2 1 90 LEU H 1.800 . 5.000 2.451 2.246 2.717 . 0 0 "[ . 1 . 2]" 1
1159 1 89 GLY HA3 1 90 LEU H 1.800 . 5.000 2.791 2.488 3.088 . 0 0 "[ . 1 . 2]" 1
1160 1 90 LEU H 1 90 LEU HB3 1.800 . 3.500 3.025 2.530 3.671 0.171 16 0 "[ . 1 . 2]" 1
1161 1 90 LEU H 1 90 LEU MD1 1.800 . 5.000 3.942 2.428 4.438 . 0 0 "[ . 1 . 2]" 1
1162 1 90 LEU H 1 90 LEU MD2 1.800 . 5.000 4.179 1.777 4.805 0.023 4 0 "[ . 1 . 2]" 1
1163 1 90 LEU H 1 90 LEU HG 1.800 . 5.000 3.948 2.354 4.695 . 0 0 "[ . 1 . 2]" 1
1164 1 90 LEU HB2 1 90 LEU MD1 1.800 . 5.000 2.282 2.163 2.390 . 0 0 "[ . 1 . 2]" 1
1165 1 90 LEU HB2 1 90 LEU MD2 1.800 . 5.000 2.638 2.214 3.194 . 0 0 "[ . 1 . 2]" 1
1166 1 90 LEU HB3 1 90 LEU MD1 1.800 . 5.000 2.897 2.227 3.196 . 0 0 "[ . 1 . 2]" 1
1167 1 90 LEU HB3 1 90 LEU MD2 1.800 . 5.000 2.316 2.160 2.495 . 0 0 "[ . 1 . 2]" 1
1168 1 90 LEU QD 1 91 LYS H 1.800 . 5.000 2.627 1.772 4.047 0.028 15 0 "[ . 1 . 2]" 1
1169 1 90 LEU QD 1 95 ASP H 1.800 . 5.000 4.041 3.589 4.717 . 0 0 "[ . 1 . 2]" 1
1170 1 90 LEU QD 1 95 ASP QB 1.800 . 2.900 2.278 1.920 2.723 . 0 0 "[ . 1 . 2]" 1
1171 1 90 LEU QD 1 96 ARG HA 1.800 . 2.900 2.467 2.120 2.958 0.058 8 0 "[ . 1 . 2]" 1
1172 1 90 LEU QD 1 99 LEU QD 1.800 . 2.900 2.450 1.793 2.957 0.057 18 0 "[ . 1 . 2]" 1
1173 1 90 LEU MD1 1 92 LYS H 1.800 . 5.000 3.638 2.637 5.045 0.045 17 0 "[ . 1 . 2]" 1
1174 1 90 LEU MD1 1 93 GLU H 1.800 . 6.000 5.782 4.205 6.074 0.074 3 0 "[ . 1 . 2]" 1
1175 1 90 LEU MD2 1 92 LYS H 1.800 . 5.000 3.464 1.857 4.842 . 0 0 "[ . 1 . 2]" 1
1176 1 90 LEU MD2 1 93 GLU H 1.800 . 6.000 5.202 3.790 6.174 0.174 11 0 "[ . 1 . 2]" 1
1177 1 91 LYS HA 1 92 LYS H 1.800 . 5.000 3.537 3.455 3.554 . 0 0 "[ . 1 . 2]" 1
1178 1 91 LYS HA 1 92 LYS QB 1.800 . 6.000 5.423 4.143 5.558 . 0 0 "[ . 1 . 2]" 1
1179 1 91 LYS QB 1 92 LYS H 1.800 . 5.000 2.666 2.575 2.992 . 0 0 "[ . 1 . 2]" 1
1180 1 92 LYS H 1 92 LYS HD2 1.800 . 5.000 4.312 4.023 5.079 0.079 6 0 "[ . 1 . 2]" 1
1181 1 92 LYS H 1 92 LYS HD3 1.800 . 6.000 4.892 3.630 5.500 . 0 0 "[ . 1 . 2]" 1
1182 1 92 LYS H 1 92 LYS QG 1.800 . 5.000 2.463 2.107 2.780 . 0 0 "[ . 1 . 2]" 1
1183 1 92 LYS HA 1 93 GLU H 1.800 . 5.000 2.430 2.165 3.525 . 0 0 "[ . 1 . 2]" 1
1184 1 92 LYS QB 1 95 ASP QB 1.800 . 6.000 2.627 2.178 6.139 0.139 6 0 "[ . 1 . 2]" 1
1185 1 92 LYS HB2 1 93 GLU H 1.800 . 5.000 4.177 2.708 4.495 . 0 0 "[ . 1 . 2]" 1
1186 1 92 LYS HB3 1 93 GLU H 1.800 . 5.000 3.822 3.465 4.403 . 0 0 "[ . 1 . 2]" 1
1187 1 93 GLU H 1 93 GLU HG2 1.800 . 5.000 3.678 2.203 4.825 . 0 0 "[ . 1 . 2]" 1
1188 1 93 GLU H 1 93 GLU HG3 1.800 . 5.000 2.951 2.181 4.508 . 0 0 "[ . 1 . 2]" 1
1189 1 93 GLU H 1 94 LYS H 1.800 . 5.000 2.878 2.636 4.099 . 0 0 "[ . 1 . 2]" 1
1190 1 93 GLU H 1 95 ASP H 1.800 . 5.000 4.330 3.495 4.547 . 0 0 "[ . 1 . 2]" 1
1191 1 93 GLU HA 1 94 LYS H 1.800 . 5.000 3.528 3.039 3.606 . 0 0 "[ . 1 . 2]" 1
1192 1 93 GLU HA 1 95 ASP H 1.800 . 5.000 4.466 4.146 4.643 . 0 0 "[ . 1 . 2]" 1
1193 1 93 GLU HA 1 96 ARG H 1.800 . 5.000 3.335 3.171 4.371 . 0 0 "[ . 1 . 2]" 1
1194 1 93 GLU HA 1 96 ARG HB2 1.800 . 5.000 2.986 2.681 4.890 . 0 0 "[ . 1 . 2]" 1
1195 1 93 GLU HA 1 96 ARG QB 1.800 . 5.000 2.567 2.199 4.015 . 0 0 "[ . 1 . 2]" 1
1196 1 93 GLU HA 1 96 ARG HB3 1.800 . 5.000 2.851 2.335 4.423 . 0 0 "[ . 1 . 2]" 1
1197 1 93 GLU HA 1 97 ASN H 1.800 . 5.000 4.406 4.090 5.118 0.118 6 0 "[ . 1 . 2]" 1
1198 1 93 GLU HB2 1 94 LYS H 1.800 . 5.000 2.998 2.259 3.962 . 0 0 "[ . 1 . 2]" 1
1199 1 93 GLU HB3 1 94 LYS H 1.800 . 5.000 3.337 1.774 3.883 0.026 6 0 "[ . 1 . 2]" 1
1200 1 94 LYS H 1 94 LYS HB2 1.800 . 3.500 2.488 2.460 2.522 . 0 0 "[ . 1 . 2]" 1
1201 1 94 LYS H 1 94 LYS HB3 1.800 . 3.500 3.076 2.621 3.607 0.107 11 0 "[ . 1 . 2]" 1
1202 1 94 LYS H 1 95 ASP H 1.800 . 5.000 2.799 2.742 2.890 . 0 0 "[ . 1 . 2]" 1
1203 1 94 LYS HA 1 95 ASP H 1.800 . 3.500 3.563 3.522 3.572 0.072 14 0 "[ . 1 . 2]" 1
1204 1 94 LYS HA 1 96 ARG H 1.800 . 5.000 4.337 4.183 4.446 . 0 0 "[ . 1 . 2]" 1
1205 1 94 LYS HA 1 97 ASN H 1.800 . 5.000 3.533 3.285 3.616 . 0 0 "[ . 1 . 2]" 1
1206 1 94 LYS HA 1 97 ASN HB2 1.800 . 5.000 3.331 2.873 3.512 . 0 0 "[ . 1 . 2]" 1
1207 1 94 LYS HA 1 97 ASN HB3 1.800 . 5.000 4.807 4.388 5.012 0.012 13 0 "[ . 1 . 2]" 1
1208 1 94 LYS HA 1 97 ASN QD 1.800 . 5.000 3.185 2.406 4.551 . 0 0 "[ . 1 . 2]" 1
1209 1 94 LYS HA 1 98 ASP H 1.800 . 5.000 4.793 4.397 4.924 . 0 0 "[ . 1 . 2]" 1
1210 1 94 LYS HB2 1 95 ASP H 1.800 . 5.000 3.205 2.430 3.914 . 0 0 "[ . 1 . 2]" 1
1211 1 94 LYS HB3 1 95 ASP H 1.800 . 5.000 2.943 2.328 3.645 . 0 0 "[ . 1 . 2]" 1
1212 1 94 LYS HG2 1 95 ASP H 1.800 . 5.000 4.253 3.612 4.940 . 0 0 "[ . 1 . 2]" 1
1213 1 94 LYS HG3 1 95 ASP H 1.800 . 5.000 4.507 4.191 4.900 . 0 0 "[ . 1 . 2]" 1
1214 1 95 ASP H 1 95 ASP HB2 1.800 . 3.500 2.440 2.410 2.465 . 0 0 "[ . 1 . 2]" 1
1215 1 95 ASP H 1 95 ASP HB3 1.800 . 3.500 3.599 3.592 3.606 0.106 16 0 "[ . 1 . 2]" 1
1216 1 95 ASP H 1 96 ARG H 1.800 . 3.500 2.643 2.597 2.758 . 0 0 "[ . 1 . 2]" 1
1217 1 95 ASP H 1 97 ASN H 1.800 . 5.000 4.272 4.168 4.327 . 0 0 "[ . 1 . 2]" 1
1218 1 95 ASP HA 1 96 ARG H 1.800 . 5.000 3.539 3.528 3.561 . 0 0 "[ . 1 . 2]" 1
1219 1 95 ASP HA 1 97 ASN H 1.800 . 5.000 4.291 4.166 4.506 . 0 0 "[ . 1 . 2]" 1
1220 1 95 ASP HA 1 98 ASP H 1.800 . 5.000 3.376 3.226 3.580 . 0 0 "[ . 1 . 2]" 1
1221 1 95 ASP HA 1 98 ASP HB2 1.800 . 5.000 3.015 2.783 3.243 . 0 0 "[ . 1 . 2]" 1
1222 1 95 ASP HA 1 98 ASP HB3 1.800 . 5.000 4.561 4.342 4.821 . 0 0 "[ . 1 . 2]" 1
1223 1 95 ASP HA 1 99 LEU H 1.800 . 5.000 4.534 4.128 4.892 . 0 0 "[ . 1 . 2]" 1
1224 1 95 ASP HB2 1 96 ARG H 1.800 . 5.000 2.673 2.535 2.751 . 0 0 "[ . 1 . 2]" 1
1225 1 95 ASP HB3 1 96 ARG H 1.800 . 5.000 3.655 3.527 3.715 . 0 0 "[ . 1 . 2]" 1
1226 1 96 ARG H 1 96 ARG QB 1.800 . 3.500 2.273 2.254 2.486 . 0 0 "[ . 1 . 2]" 1
1227 1 96 ARG H 1 96 ARG HG2 1.800 . 5.000 4.441 3.264 4.522 . 0 0 "[ . 1 . 2]" 1
1228 1 96 ARG H 1 96 ARG HG3 1.800 . 5.000 4.299 2.092 4.465 . 0 0 "[ . 1 . 2]" 1
1229 1 96 ARG H 1 97 ASN H 1.800 . 3.500 2.774 2.723 2.825 . 0 0 "[ . 1 . 2]" 1
1230 1 96 ARG H 1 98 ASP H 1.800 . 5.000 4.283 4.199 4.429 . 0 0 "[ . 1 . 2]" 1
1231 1 96 ARG HA 1 97 ASN H 1.800 . 3.500 3.556 3.545 3.564 0.064 11 0 "[ . 1 . 2]" 1
1232 1 96 ARG HA 1 98 ASP H 1.800 . 5.000 4.376 4.196 4.614 . 0 0 "[ . 1 . 2]" 1
1233 1 96 ARG HA 1 99 LEU H 1.800 . 5.000 3.369 3.176 3.475 . 0 0 "[ . 1 . 2]" 1
1234 1 96 ARG HA 1 99 LEU HB2 1.800 . 5.000 2.996 2.590 3.314 . 0 0 "[ . 1 . 2]" 1
1235 1 96 ARG HA 1 99 LEU HB3 1.800 . 5.000 3.959 2.392 4.784 . 0 0 "[ . 1 . 2]" 1
1236 1 96 ARG HA 1 100 ILE H 1.800 . 5.000 4.517 3.575 4.847 . 0 0 "[ . 1 . 2]" 1
1237 1 96 ARG HB2 1 97 ASN H 1.800 . 5.000 3.773 2.569 3.858 . 0 0 "[ . 1 . 2]" 1
1238 1 96 ARG HB3 1 97 ASN H 1.800 . 5.000 2.618 2.523 3.635 . 0 0 "[ . 1 . 2]" 1
1239 1 97 ASN H 1 97 ASN HB2 1.800 . 3.500 2.494 2.472 2.547 . 0 0 "[ . 1 . 2]" 1
1240 1 97 ASN H 1 97 ASN HB3 1.800 . 3.500 3.602 3.598 3.609 0.109 3 0 "[ . 1 . 2]" 1
1241 1 97 ASN H 1 98 ASP H 1.800 . 3.500 2.745 2.695 2.823 . 0 0 "[ . 1 . 2]" 1
1242 1 97 ASN H 1 99 LEU H 1.800 . 5.000 4.147 3.981 4.268 . 0 0 "[ . 1 . 2]" 1
1243 1 97 ASN HA 1 98 ASP H 1.800 . 3.500 3.555 3.545 3.569 0.069 4 0 "[ . 1 . 2]" 1
1244 1 97 ASN HA 1 99 LEU H 1.800 . 5.000 4.280 4.138 4.432 . 0 0 "[ . 1 . 2]" 1
1245 1 97 ASN HA 1 100 ILE H 1.800 . 5.000 3.506 3.338 3.873 . 0 0 "[ . 1 . 2]" 1
1246 1 97 ASN HA 1 100 ILE HB 1.800 . 5.000 3.336 3.137 3.477 . 0 0 "[ . 1 . 2]" 1
1247 1 97 ASN HA 1 101 THR H 1.800 . 5.000 4.612 4.225 4.798 . 0 0 "[ . 1 . 2]" 1
1248 1 97 ASN HB2 1 98 ASP H 1.800 . 5.000 2.577 2.437 2.676 . 0 0 "[ . 1 . 2]" 1
1249 1 97 ASN HB3 1 98 ASP H 1.800 . 5.000 3.611 3.460 3.701 . 0 0 "[ . 1 . 2]" 1
1250 1 98 ASP H 1 98 ASP HB2 1.800 . 3.500 2.448 2.425 2.466 . 0 0 "[ . 1 . 2]" 1
1251 1 98 ASP H 1 98 ASP HB3 1.800 . 3.500 3.601 3.599 3.605 0.105 10 0 "[ . 1 . 2]" 1
1252 1 98 ASP H 1 99 LEU H 1.800 . 3.500 2.676 2.550 2.742 . 0 0 "[ . 1 . 2]" 1
1253 1 98 ASP H 1 100 ILE H 1.800 . 5.000 4.351 4.317 4.444 . 0 0 "[ . 1 . 2]" 1
1254 1 98 ASP HA 1 99 LEU H 1.800 . 3.500 3.537 3.512 3.551 0.051 6 0 "[ . 1 . 2]" 1
1255 1 98 ASP HA 1 100 ILE H 1.800 . 5.000 4.439 4.301 4.809 . 0 0 "[ . 1 . 2]" 1
1256 1 98 ASP HA 1 101 THR H 1.800 . 5.000 3.522 3.370 3.752 . 0 0 "[ . 1 . 2]" 1
1257 1 98 ASP HA 1 101 THR HB 1.800 . 5.000 3.300 2.987 4.759 . 0 0 "[ . 1 . 2]" 1
1258 1 98 ASP HA 1 102 TYR H 1.800 . 5.000 4.428 4.048 4.639 . 0 0 "[ . 1 . 2]" 1
1259 1 98 ASP HB2 1 99 LEU H 1.800 . 3.500 2.691 2.657 2.731 . 0 0 "[ . 1 . 2]" 1
1260 1 98 ASP HB3 1 99 LEU H 1.800 . 5.000 3.665 3.634 3.714 . 0 0 "[ . 1 . 2]" 1
1261 1 99 LEU H 1 99 LEU HB2 1.800 . 3.500 2.437 2.183 2.529 . 0 0 "[ . 1 . 2]" 1
1262 1 99 LEU H 1 99 LEU HB3 1.800 . 3.500 3.307 2.631 3.600 0.100 10 0 "[ . 1 . 2]" 1
1263 1 99 LEU H 1 99 LEU MD1 1.800 . 5.000 3.680 3.540 3.966 . 0 0 "[ . 1 . 2]" 1
1264 1 99 LEU H 1 99 LEU MD2 1.800 . 5.000 3.386 1.810 4.246 . 0 0 "[ . 1 . 2]" 1
1265 1 99 LEU H 1 100 ILE H 1.800 . 5.000 2.771 2.751 2.801 . 0 0 "[ . 1 . 2]" 1
1266 1 99 LEU H 1 101 THR H 1.800 . 5.000 4.312 4.168 4.431 . 0 0 "[ . 1 . 2]" 1
1267 1 99 LEU HA 1 99 LEU QD 1.800 . 5.000 2.043 1.938 2.074 . 0 0 "[ . 1 . 2]" 1
1268 1 99 LEU HA 1 100 ILE H 1.800 . 5.000 3.567 3.555 3.586 . 0 0 "[ . 1 . 2]" 1
1269 1 99 LEU HA 1 101 THR H 1.800 . 5.000 4.479 4.374 4.606 . 0 0 "[ . 1 . 2]" 1
1270 1 99 LEU HA 1 102 TYR H 1.800 . 5.000 3.418 3.314 3.580 . 0 0 "[ . 1 . 2]" 1
1271 1 99 LEU HA 1 102 TYR QB 1.800 . 5.000 2.737 2.546 3.166 . 0 0 "[ . 1 . 2]" 1
1272 1 99 LEU HA 1 103 LEU H 1.800 . 5.000 4.388 4.091 4.801 . 0 0 "[ . 1 . 2]" 1
1273 1 99 LEU HB2 1 100 ILE H 1.800 . 3.500 2.918 2.487 3.726 0.226 13 0 "[ . 1 . 2]" 1
1274 1 99 LEU HB3 1 100 ILE H 1.800 . 3.500 3.202 2.324 3.613 0.113 15 0 "[ . 1 . 2]" 1
1275 1 99 LEU QD 1 103 LEU H 1.800 . 6.000 4.775 4.161 5.257 . 0 0 "[ . 1 . 2]" 1
1276 1 99 LEU MD1 1 100 ILE H 1.800 . 5.000 4.491 4.438 4.651 . 0 0 "[ . 1 . 2]" 1
1277 1 99 LEU MD2 1 100 ILE H 1.800 . 5.000 4.436 4.009 4.620 . 0 0 "[ . 1 . 2]" 1
1278 1 100 ILE H 1 100 ILE HB 1.800 . 3.500 2.567 2.503 2.665 . 0 0 "[ . 1 . 2]" 1
1279 1 100 ILE H 1 100 ILE MD 1.800 . 5.000 3.264 2.560 3.468 . 0 0 "[ . 1 . 2]" 1
1280 1 100 ILE H 1 100 ILE QG 1.800 . 5.000 1.955 1.883 2.055 . 0 0 "[ . 1 . 2]" 1
1281 1 100 ILE H 1 100 ILE MG 1.800 . 3.500 3.746 3.731 3.762 0.262 11 0 "[ . 1 . 2]" 1
1282 1 100 ILE H 1 101 THR H 1.800 . 5.000 2.787 2.711 2.864 . 0 0 "[ . 1 . 2]" 1
1283 1 100 ILE H 1 102 TYR H 1.800 . 5.000 4.203 4.125 4.293 . 0 0 "[ . 1 . 2]" 1
1284 1 100 ILE HA 1 100 ILE QG 1.800 . 5.000 2.570 2.390 3.085 . 0 0 "[ . 1 . 2]" 1
1285 1 100 ILE HA 1 100 ILE MG 1.800 . 3.500 2.313 2.218 2.360 . 0 0 "[ . 1 . 2]" 1
1286 1 100 ILE HA 1 101 THR H 1.800 . 3.500 3.560 3.543 3.567 0.067 12 0 "[ . 1 . 2]" 1
1287 1 100 ILE HA 1 102 TYR H 1.800 . 5.000 4.385 4.290 4.482 . 0 0 "[ . 1 . 2]" 1
1288 1 100 ILE HA 1 103 LEU H 1.800 . 5.000 3.432 3.334 3.563 . 0 0 "[ . 1 . 2]" 1
1289 1 100 ILE HA 1 103 LEU HB2 1.800 . 5.000 2.980 2.622 3.337 . 0 0 "[ . 1 . 2]" 1
1290 1 100 ILE HA 1 103 LEU HB3 1.800 . 5.000 4.453 3.998 4.769 . 0 0 "[ . 1 . 2]" 1
1291 1 100 ILE HA 1 104 LYS H 1.800 . 5.000 4.689 4.449 4.814 . 0 0 "[ . 1 . 2]" 1
1292 1 100 ILE HB 1 100 ILE MD 1.800 . 5.000 2.508 2.229 3.206 . 0 0 "[ . 1 . 2]" 1
1293 1 100 ILE HB 1 101 THR H 1.800 . 5.000 2.483 2.400 2.637 . 0 0 "[ . 1 . 2]" 1
1294 1 100 ILE MD 1 101 THR H 1.800 . 5.000 4.390 4.311 4.527 . 0 0 "[ . 1 . 2]" 1
1295 1 100 ILE MG 1 101 THR H 1.800 . 5.000 3.405 3.286 3.586 . 0 0 "[ . 1 . 2]" 1
1296 1 100 ILE MG 1 103 LEU H 1.800 . 5.000 4.537 4.405 4.695 . 0 0 "[ . 1 . 2]" 1
1297 1 100 ILE MG 1 104 LYS H 1.800 . 5.000 4.363 4.129 4.499 . 0 0 "[ . 1 . 2]" 1
1298 1 101 THR H 1 102 TYR H 1.800 . 3.500 2.739 2.697 2.790 . 0 0 "[ . 1 . 2]" 1
1299 1 101 THR H 1 103 LEU H 1.800 . 5.000 4.264 4.157 4.391 . 0 0 "[ . 1 . 2]" 1
1300 1 101 THR HA 1 101 THR MG 1.800 . 3.500 2.261 2.213 2.357 . 0 0 "[ . 1 . 2]" 1
1301 1 101 THR HA 1 102 TYR H 1.800 . 5.000 3.557 3.548 3.564 . 0 0 "[ . 1 . 2]" 1
1302 1 101 THR HA 1 103 LEU H 1.800 . 5.000 4.398 4.315 4.491 . 0 0 "[ . 1 . 2]" 1
1303 1 101 THR HA 1 104 LYS H 1.800 . 5.000 3.531 3.478 3.650 . 0 0 "[ . 1 . 2]" 1
1304 1 101 THR HA 1 104 LYS HB2 1.800 . 5.000 3.476 3.225 3.847 . 0 0 "[ . 1 . 2]" 1
1305 1 101 THR HA 1 104 LYS HB3 1.800 . 5.000 3.502 3.361 3.682 . 0 0 "[ . 1 . 2]" 1
1306 1 101 THR HA 1 105 LYS H 1.800 . 5.000 4.855 4.745 4.916 . 0 0 "[ . 1 . 2]" 1
1307 1 101 THR HB 1 102 TYR H 1.800 . 3.500 2.614 2.517 3.587 0.087 16 0 "[ . 1 . 2]" 1
1308 1 102 TYR H 1 102 TYR QB 1.800 . 3.500 2.280 2.271 2.288 . 0 0 "[ . 1 . 2]" 1
1309 1 102 TYR H 1 102 TYR QD 1.800 . 5.000 4.202 4.199 4.207 . 0 0 "[ . 1 . 2]" 1
1310 1 102 TYR H 1 103 LEU H 1.800 . 5.000 2.758 2.704 2.798 . 0 0 "[ . 1 . 2]" 1
1311 1 102 TYR H 1 104 LYS H 1.800 . 5.000 4.266 4.171 4.395 . 0 0 "[ . 1 . 2]" 1
1312 1 102 TYR HA 1 103 LEU H 1.800 . 5.000 3.568 3.550 3.577 . 0 0 "[ . 1 . 2]" 1
1313 1 102 TYR HA 1 104 LYS H 1.800 . 5.000 4.239 4.193 4.303 . 0 0 "[ . 1 . 2]" 1
1314 1 102 TYR HA 1 105 LYS H 1.800 . 5.000 3.296 3.235 3.358 . 0 0 "[ . 1 . 2]" 1
1315 1 102 TYR HA 1 105 LYS HB2 1.800 . 5.000 3.304 3.193 3.413 . 0 0 "[ . 1 . 2]" 1
1316 1 102 TYR HA 1 105 LYS HB3 1.800 . 5.000 3.105 2.862 3.296 . 0 0 "[ . 1 . 2]" 1
1317 1 102 TYR HA 1 106 ALA H 1.800 . 5.000 4.599 4.280 4.805 . 0 0 "[ . 1 . 2]" 1
1318 1 102 TYR HB2 1 103 LEU H 1.800 . 5.000 3.913 3.877 3.958 . 0 0 "[ . 1 . 2]" 1
1319 1 102 TYR HB3 1 103 LEU H 1.800 . 5.000 2.625 2.564 2.690 . 0 0 "[ . 1 . 2]" 1
1320 1 102 TYR QE 1 105 LYS H 1.800 . 6.000 6.022 5.976 6.046 0.046 14 0 "[ . 1 . 2]" 1
1321 1 103 LEU H 1 103 LEU HB2 1.800 . 3.500 2.387 2.093 2.665 . 0 0 "[ . 1 . 2]" 1
1322 1 103 LEU H 1 103 LEU HB3 1.800 . 3.500 3.547 3.350 3.620 0.120 7 0 "[ . 1 . 2]" 1
1323 1 103 LEU H 1 103 LEU MD1 1.800 . 5.000 3.269 2.078 4.107 . 0 0 "[ . 1 . 2]" 1
1324 1 103 LEU H 1 103 LEU MD2 1.800 . 5.000 3.095 1.974 4.076 . 0 0 "[ . 1 . 2]" 1
1325 1 103 LEU H 1 103 LEU HG 1.800 . 5.000 2.969 1.959 4.293 . 0 0 "[ . 1 . 2]" 1
1326 1 103 LEU H 1 104 LYS H 1.800 . 3.500 2.767 2.721 2.848 . 0 0 "[ . 1 . 2]" 1
1327 1 103 LEU H 1 105 LYS H 1.800 . 5.000 4.218 4.175 4.270 . 0 0 "[ . 1 . 2]" 1
1328 1 103 LEU HA 1 103 LEU MD1 1.800 . 5.000 3.042 2.101 3.788 . 0 0 "[ . 1 . 2]" 1
1329 1 103 LEU HA 1 103 LEU MD2 1.800 . 5.000 2.545 2.019 3.707 . 0 0 "[ . 1 . 2]" 1
1330 1 103 LEU HA 1 104 LYS H 1.800 . 3.500 3.547 3.536 3.561 0.061 18 0 "[ . 1 . 2]" 1
1331 1 103 LEU HA 1 105 LYS H 1.800 . 5.000 4.222 4.135 4.405 . 0 0 "[ . 1 . 2]" 1
1332 1 103 LEU HA 1 106 ALA H 1.800 . 5.000 3.134 2.894 3.329 . 0 0 "[ . 1 . 2]" 1
1333 1 103 LEU HA 1 106 ALA MB 1.800 . 5.000 2.428 2.229 2.769 . 0 0 "[ . 1 . 2]" 1
1334 1 103 LEU HA 1 107 THR H 1.800 . 5.000 4.617 3.987 4.816 . 0 0 "[ . 1 . 2]" 1
1335 1 103 LEU HB2 1 103 LEU MD1 1.800 . 5.000 2.486 2.230 3.174 . 0 0 "[ . 1 . 2]" 1
1336 1 103 LEU HB2 1 103 LEU MD2 1.800 . 5.000 2.802 2.210 3.196 . 0 0 "[ . 1 . 2]" 1
1337 1 103 LEU HB2 1 104 LYS H 1.800 . 5.000 2.805 2.587 3.165 . 0 0 "[ . 1 . 2]" 1
1338 1 103 LEU HB3 1 103 LEU MD1 1.800 . 5.000 2.567 2.210 3.187 . 0 0 "[ . 1 . 2]" 1
1339 1 103 LEU HB3 1 103 LEU MD2 1.800 . 5.000 2.482 2.276 3.189 . 0 0 "[ . 1 . 2]" 1
1340 1 103 LEU HB3 1 104 LYS H 1.800 . 5.000 3.477 2.976 3.777 . 0 0 "[ . 1 . 2]" 1
1341 1 103 LEU MD1 1 104 LYS H 1.800 . 5.000 4.506 4.172 4.670 . 0 0 "[ . 1 . 2]" 1
1342 1 103 LEU MD1 2 1 HEC HHB 1.800 . 5.000 3.295 2.587 4.338 . 0 0 "[ . 1 . 2]" 1
1343 1 103 LEU MD2 1 104 LYS H 1.800 . 5.000 4.539 4.127 4.768 . 0 0 "[ . 1 . 2]" 1
1344 1 103 LEU MD2 2 1 HEC HHB 1.800 . 5.000 3.502 2.484 4.128 . 0 0 "[ . 1 . 2]" 1
1345 1 104 LYS H 1 104 LYS HA 1.800 . 2.900 2.843 2.838 2.849 . 0 0 "[ . 1 . 2]" 1
1346 1 104 LYS H 1 104 LYS HB2 1.800 . 3.500 2.490 2.424 2.535 . 0 0 "[ . 1 . 2]" 1
1347 1 104 LYS H 1 104 LYS HB3 1.800 . 3.500 2.645 2.614 2.712 . 0 0 "[ . 1 . 2]" 1
1348 1 104 LYS H 1 104 LYS QE 1.800 . 5.000 4.422 4.218 4.899 . 0 0 "[ . 1 . 2]" 1
1349 1 104 LYS H 1 105 LYS H 1.800 . 3.500 2.698 2.677 2.739 . 0 0 "[ . 1 . 2]" 1
1350 1 104 LYS H 1 106 ALA H 1.800 . 5.000 4.088 3.967 4.313 . 0 0 "[ . 1 . 2]" 1
1351 1 104 LYS H 1 106 ALA MB 1.800 . 5.000 4.754 4.649 4.967 . 0 0 "[ . 1 . 2]" 1
1352 1 104 LYS HA 1 105 LYS H 1.800 . 5.000 3.546 3.538 3.560 . 0 0 "[ . 1 . 2]" 1
1353 1 104 LYS HA 1 106 ALA H 1.800 . 5.000 4.240 4.119 4.415 . 0 0 "[ . 1 . 2]" 1
1354 1 104 LYS HA 1 107 THR H 1.800 . 5.000 3.506 3.316 3.576 . 0 0 "[ . 1 . 2]" 1
1355 1 104 LYS HA 1 107 THR HB 1.800 . 5.000 3.434 2.721 4.266 . 0 0 "[ . 1 . 2]" 1
1356 1 104 LYS HA 1 108 GLU H 1.800 . 5.000 4.783 4.235 5.058 0.058 14 0 "[ . 1 . 2]" 1
1357 1 104 LYS HB2 1 105 LYS H 1.800 . 5.000 3.810 3.728 3.895 . 0 0 "[ . 1 . 2]" 1
1358 1 104 LYS HB3 1 105 LYS H 1.800 . 3.500 2.558 2.503 2.643 . 0 0 "[ . 1 . 2]" 1
1359 1 104 LYS QE 1 105 LYS H 1.800 . 5.000 4.233 3.798 5.018 0.018 20 0 "[ . 1 . 2]" 1
1360 1 105 LYS H 1 105 LYS HA 1.800 . 2.900 2.856 2.833 2.881 . 0 0 "[ . 1 . 2]" 1
1361 1 105 LYS H 1 105 LYS HB2 1.800 . 3.500 2.513 2.494 2.608 . 0 0 "[ . 1 . 2]" 1
1362 1 105 LYS H 1 105 LYS HB3 1.800 . 3.500 2.599 2.470 2.642 . 0 0 "[ . 1 . 2]" 1
1363 1 105 LYS H 1 105 LYS QE 1.800 . 5.000 4.391 4.335 4.741 . 0 0 "[ . 1 . 2]" 1
1364 1 105 LYS H 1 106 ALA H 1.800 . 2.900 2.675 2.594 2.787 . 0 0 "[ . 1 . 2]" 1
1365 1 105 LYS H 1 107 THR H 1.800 . 5.000 4.253 3.971 4.393 . 0 0 "[ . 1 . 2]" 1
1366 1 105 LYS HA 1 106 ALA H 1.800 . 3.500 3.543 3.531 3.563 0.063 7 0 "[ . 1 . 2]" 1
1367 1 105 LYS HA 1 107 THR H 1.800 . 5.000 4.183 4.093 4.345 . 0 0 "[ . 1 . 2]" 1
1368 1 105 LYS HA 1 108 GLU H 1.800 . 5.000 3.248 2.993 3.648 . 0 0 "[ . 1 . 2]" 1
1369 1 105 LYS HB2 1 106 ALA H 1.800 . 5.000 3.935 3.879 3.974 . 0 0 "[ . 1 . 2]" 1
1370 1 105 LYS HB3 1 106 ALA H 1.800 . 5.000 2.728 2.624 2.808 . 0 0 "[ . 1 . 2]" 1
1371 1 105 LYS HE2 1 106 ALA H 1.800 . 5.000 4.855 4.654 5.126 0.126 7 0 "[ . 1 . 2]" 1
1372 1 105 LYS HE3 1 106 ALA H 1.800 . 5.000 4.609 4.284 4.872 . 0 0 "[ . 1 . 2]" 1
1373 1 106 ALA H 1 106 ALA MB 1.800 . 3.500 2.089 2.043 2.223 . 0 0 "[ . 1 . 2]" 1
1374 1 106 ALA H 1 107 THR H 1.800 . 3.500 2.714 2.594 2.771 . 0 0 "[ . 1 . 2]" 1
1375 1 106 ALA H 1 107 THR HB 1.800 . 5.000 4.776 4.529 5.008 0.008 2 0 "[ . 1 . 2]" 1
1376 1 106 ALA H 1 108 GLU H 1.800 . 5.000 4.064 3.732 4.331 . 0 0 "[ . 1 . 2]" 1
1377 1 106 ALA HA 1 107 THR H 1.800 . 5.000 3.543 3.502 3.565 . 0 0 "[ . 1 . 2]" 1
1378 1 106 ALA MB 1 107 THR H 1.800 . 3.500 2.727 2.615 2.804 . 0 0 "[ . 1 . 2]" 1
1379 1 106 ALA MB 1 108 GLU H 1.800 . 5.000 4.427 4.213 4.551 . 0 0 "[ . 1 . 2]" 1
1380 1 107 THR H 1 107 THR MG 1.800 . 2.900 2.747 2.375 2.894 . 0 0 "[ . 1 . 2]" 1
1381 1 107 THR H 1 108 GLU H 1.800 . 2.900 2.526 2.241 2.725 . 0 0 "[ . 1 . 2]" 1
1382 1 107 THR HA 1 107 THR MG 1.800 . 3.500 3.119 3.094 3.152 . 0 0 "[ . 1 . 2]" 1
1383 1 107 THR HA 1 108 GLU H 1.800 . 5.000 3.480 3.255 3.537 . 0 0 "[ . 1 . 2]" 1
1384 1 107 THR HB 1 108 GLU H 1.800 . 5.000 3.716 3.560 4.178 . 0 0 "[ . 1 . 2]" 1
1385 1 108 GLU H 1 108 GLU HA 1.800 . 2.900 2.538 2.347 2.938 0.038 5 0 "[ . 1 . 2]" 1
1386 2 1 HEC HAA1 2 1 HEC HHA 1.800 . 5.000 3.807 3.734 3.855 . 0 0 "[ . 1 . 2]" 1
1387 2 1 HEC HAA2 2 1 HEC HHA 1.800 . 5.000 2.369 2.192 2.611 . 0 0 "[ . 1 . 2]" 1
1388 2 1 HEC HAC 2 1 HEC HHD 1.800 . 2.900 2.246 2.205 2.267 . 0 0 "[ . 1 . 2]" 1
1389 2 1 HEC HBA1 2 1 HEC HHA 1.800 . 5.000 2.941 2.366 3.845 . 0 0 "[ . 1 . 2]" 1
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