NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
524885 |
2lir   |
17903 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lir
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 1362
_Distance_constraint_stats_list.Viol_count 3900
_Distance_constraint_stats_list.Viol_total 5724.771
_Distance_constraint_stats_list.Viol_max 0.295
_Distance_constraint_stats_list.Viol_rms 0.0329
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0105
_Distance_constraint_stats_list.Viol_average_violations_only 0.0734
_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 2.358 0.123 19 0 "[ . 1 . 2]"
1 4 LYS 1.097 0.085 1 0 "[ . 1 . 2]"
1 5 ALA 2.760 0.099 5 0 "[ . 1 . 2]"
1 6 GLY 0.539 0.059 13 0 "[ . 1 . 2]"
1 7 SER 4.284 0.124 2 0 "[ . 1 . 2]"
1 8 ALA 1.416 0.088 15 0 "[ . 1 . 2]"
1 9 LYS 2.911 0.136 7 0 "[ . 1 . 2]"
1 10 LYS 5.422 0.123 9 0 "[ . 1 . 2]"
1 11 GLY 1.641 0.062 13 0 "[ . 1 . 2]"
1 12 ALA 1.978 0.072 2 0 "[ . 1 . 2]"
1 13 THR 6.379 0.242 4 0 "[ . 1 . 2]"
1 14 LEU 4.897 0.141 3 0 "[ . 1 . 2]"
1 15 PHE 5.618 0.142 14 0 "[ . 1 . 2]"
1 16 LYS 7.480 0.139 14 0 "[ . 1 . 2]"
1 17 THR 2.932 0.158 15 0 "[ . 1 . 2]"
1 18 ARG 0.718 0.086 4 0 "[ . 1 . 2]"
1 19 CYS 5.502 0.139 14 0 "[ . 1 . 2]"
1 20 LEU 1.487 0.085 13 0 "[ . 1 . 2]"
1 21 GLN 0.125 0.064 5 0 "[ . 1 . 2]"
1 22 CYS 5.388 0.248 5 0 "[ . 1 . 2]"
1 23 HIS 6.946 0.229 12 0 "[ . 1 . 2]"
1 24 THR 7.917 0.248 5 0 "[ . 1 . 2]"
1 25 VAL 6.273 0.232 10 0 "[ . 1 . 2]"
1 26 GLU 0.475 0.060 20 0 "[ . 1 . 2]"
1 27 LYS 0.431 0.060 20 0 "[ . 1 . 2]"
1 28 GLY 1.361 0.122 11 0 "[ . 1 . 2]"
1 29 GLY 1.042 0.147 11 0 "[ . 1 . 2]"
1 30 PRO 0.685 0.087 7 0 "[ . 1 . 2]"
1 31 HIS 8.476 0.262 19 0 "[ . 1 . 2]"
1 32 LYS 3.750 0.293 12 0 "[ . 1 . 2]"
1 33 VAL 5.691 0.293 12 0 "[ . 1 . 2]"
1 34 GLY 3.918 0.199 6 0 "[ . 1 . 2]"
1 35 PRO 3.420 0.288 10 0 "[ . 1 . 2]"
1 36 ASN 6.831 0.196 2 0 "[ . 1 . 2]"
1 37 LEU 8.042 0.288 10 0 "[ . 1 . 2]"
1 38 HIS 6.706 0.238 5 0 "[ . 1 . 2]"
1 39 GLY 0.473 0.148 7 0 "[ . 1 . 2]"
1 40 ILE 4.371 0.176 7 0 "[ . 1 . 2]"
1 41 PHE 9.766 0.238 5 0 "[ . 1 . 2]"
1 42 GLY 0.824 0.070 9 0 "[ . 1 . 2]"
1 43 ARG 4.602 0.134 12 0 "[ . 1 . 2]"
1 44 HIS 7.858 0.166 16 0 "[ . 1 . 2]"
1 45 SER 5.000 0.150 13 0 "[ . 1 . 2]"
1 46 GLY 5.660 0.232 3 0 "[ . 1 . 2]"
1 47 GLN 8.731 0.241 1 0 "[ . 1 . 2]"
1 48 ALA 2.914 0.114 20 0 "[ . 1 . 2]"
1 49 GLU 3.888 0.241 20 0 "[ . 1 . 2]"
1 50 GLY 0.907 0.194 13 0 "[ . 1 . 2]"
1 51 TYR 11.734 0.282 2 0 "[ . 1 . 2]"
1 52 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 TYR 9.746 0.282 2 0 "[ . 1 . 2]"
1 54 THR 0.155 0.048 7 0 "[ . 1 . 2]"
1 55 ASP 1.470 0.106 20 0 "[ . 1 . 2]"
1 56 ALA 1.618 0.077 19 0 "[ . 1 . 2]"
1 57 ASN 11.994 0.220 2 0 "[ . 1 . 2]"
1 58 ILE 6.461 0.164 13 0 "[ . 1 . 2]"
1 59 LYS 4.478 0.128 20 0 "[ . 1 . 2]"
1 60 LYS 3.850 0.150 10 0 "[ . 1 . 2]"
1 61 ASN 2.298 0.136 9 0 "[ . 1 . 2]"
1 62 VAL 9.916 0.166 16 0 "[ . 1 . 2]"
1 63 LEU 6.919 0.160 10 0 "[ . 1 . 2]"
1 64 TRP 20.783 0.232 3 0 "[ . 1 . 2]"
1 65 ASP 0.633 0.059 20 0 "[ . 1 . 2]"
1 66 GLU 2.497 0.062 5 0 "[ . 1 . 2]"
1 67 ASN 0.947 0.056 10 0 "[ . 1 . 2]"
1 68 ASN 3.299 0.103 4 0 "[ . 1 . 2]"
1 69 MET 14.004 0.229 10 0 "[ . 1 . 2]"
1 70 SER 0.113 0.061 10 0 "[ . 1 . 2]"
1 71 GLU 0.734 0.067 18 0 "[ . 1 . 2]"
1 72 TYR 1.630 0.112 12 0 "[ . 1 . 2]"
1 73 LEU 6.202 0.198 5 0 "[ . 1 . 2]"
1 74 THR 6.919 0.245 18 0 "[ . 1 . 2]"
1 75 ASN 2.027 0.165 1 0 "[ . 1 . 2]"
1 76 HIS 1.044 0.165 1 0 "[ . 1 . 2]"
1 77 ALA 4.641 0.200 6 0 "[ . 1 . 2]"
1 78 LYS 1.642 0.197 7 0 "[ . 1 . 2]"
1 79 TYR 0.813 0.094 1 0 "[ . 1 . 2]"
1 80 ILE 3.819 0.243 10 0 "[ . 1 . 2]"
1 81 PRO 2.560 0.196 15 0 "[ . 1 . 2]"
1 82 GLY 0.012 0.012 2 0 "[ . 1 . 2]"
1 83 THR 5.612 0.243 10 0 "[ . 1 . 2]"
1 84 LYS 1.337 0.099 16 0 "[ . 1 . 2]"
1 85 MET 0.494 0.114 20 0 "[ . 1 . 2]"
1 86 ALA 0.677 0.209 12 0 "[ . 1 . 2]"
1 87 PHE 5.908 0.295 10 0 "[ . 1 . 2]"
1 89 GLY 0.127 0.051 10 0 "[ . 1 . 2]"
1 90 LEU 12.912 0.295 10 0 "[ . 1 . 2]"
1 91 LYS 1.640 0.103 17 0 "[ . 1 . 2]"
1 92 LYS 0.486 0.041 4 0 "[ . 1 . 2]"
1 93 GLU 2.497 0.124 3 0 "[ . 1 . 2]"
1 94 LYS 4.492 0.188 3 0 "[ . 1 . 2]"
1 95 ASP 7.766 0.188 3 0 "[ . 1 . 2]"
1 96 ARG 5.369 0.247 19 0 "[ . 1 . 2]"
1 97 ASN 6.378 0.108 13 0 "[ . 1 . 2]"
1 98 ASP 2.644 0.082 18 0 "[ . 1 . 2]"
1 99 LEU 11.112 0.200 4 0 "[ . 1 . 2]"
1 100 ILE 15.798 0.246 4 0 "[ . 1 . 2]"
1 101 THR 6.440 0.239 3 0 "[ . 1 . 2]"
1 102 TYR 7.046 0.137 9 0 "[ . 1 . 2]"
1 103 LEU 11.945 0.209 17 0 "[ . 1 . 2]"
1 104 LYS 7.634 0.170 16 0 "[ . 1 . 2]"
1 105 LYS 5.138 0.198 1 0 "[ . 1 . 2]"
1 106 ALA 8.169 0.205 17 0 "[ . 1 . 2]"
1 107 THR 0.390 0.049 12 0 "[ . 1 . 2]"
1 108 GLU 4.238 0.205 17 0 "[ . 1 . 2]"
2 1 HEC 12.391 0.220 2 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 HA 1.800 . 2.900 2.965 2.900 2.979 0.079 2 0 "[ . 1 . 2]" 1
2 1 3 PHE HA 1 3 PHE HB2 1.800 . 2.900 2.449 2.427 2.494 . 0 0 "[ . 1 . 2]" 1
3 1 3 PHE HA 1 3 PHE HB3 1.800 . 2.900 2.599 2.481 3.023 0.123 19 0 "[ . 1 . 2]" 1
4 1 3 PHE HA 1 3 PHE QD 1.800 . 5.000 3.535 2.784 3.710 . 0 0 "[ . 1 . 2]" 1
5 1 3 PHE HA 1 4 LYS H 1.800 . 5.000 2.472 2.197 3.359 . 0 0 "[ . 1 . 2]" 1
6 1 3 PHE QB 1 70 SER QB 1.800 . 5.000 4.176 2.310 5.061 0.061 10 0 "[ . 1 . 2]" 1
7 1 3 PHE HB2 1 3 PHE QD 1.800 . 2.900 2.380 2.333 2.451 . 0 0 "[ . 1 . 2]" 1
8 1 3 PHE HB2 1 3 PHE QE 1.800 . 5.000 4.438 4.423 4.459 . 0 0 "[ . 1 . 2]" 1
9 1 3 PHE HB2 1 4 LYS H 1.800 . 5.000 3.084 2.528 4.292 . 0 0 "[ . 1 . 2]" 1
10 1 3 PHE HB3 1 3 PHE QD 1.800 . 2.900 2.452 2.377 2.514 . 0 0 "[ . 1 . 2]" 1
11 1 3 PHE HB3 1 3 PHE QE 1.800 . 5.000 4.457 4.436 4.474 . 0 0 "[ . 1 . 2]" 1
12 1 3 PHE HB3 1 4 LYS H 1.800 . 5.000 4.003 3.895 4.293 . 0 0 "[ . 1 . 2]" 1
13 1 3 PHE QD 1 66 GLU HB2 1.800 . 5.000 4.125 3.618 4.944 . 0 0 "[ . 1 . 2]" 1
14 1 3 PHE QD 1 66 GLU HB3 1.800 . 5.000 3.542 2.943 4.479 . 0 0 "[ . 1 . 2]" 1
15 1 3 PHE QD 1 66 GLU QG 1.800 . 5.000 4.992 4.567 5.052 0.052 10 0 "[ . 1 . 2]" 1
16 1 3 PHE QD 1 100 ILE HB 1.800 . 5.000 4.267 2.878 5.022 0.022 1 0 "[ . 1 . 2]" 1
17 1 3 PHE QD 1 100 ILE MD 1.800 . 5.000 3.837 2.668 4.604 . 0 0 "[ . 1 . 2]" 1
18 1 3 PHE QD 1 100 ILE MG 1.800 . 5.000 3.844 2.960 4.352 . 0 0 "[ . 1 . 2]" 1
19 1 3 PHE QE 1 100 ILE HB 1.800 . 5.000 3.353 2.277 4.042 . 0 0 "[ . 1 . 2]" 1
20 1 3 PHE QE 1 100 ILE MD 1.800 . 5.000 3.932 2.168 4.793 . 0 0 "[ . 1 . 2]" 1
21 1 3 PHE QE 1 100 ILE MG 1.800 . 5.000 3.132 2.116 3.665 . 0 0 "[ . 1 . 2]" 1
22 1 3 PHE HZ 1 5 ALA MB 1.800 . 5.000 3.820 3.025 4.928 . 0 0 "[ . 1 . 2]" 1
23 1 3 PHE HZ 1 100 ILE HB 1.800 . 5.000 4.154 2.276 5.010 0.010 17 0 "[ . 1 . 2]" 1
24 1 3 PHE HZ 1 100 ILE MG 1.800 . 5.000 3.305 2.255 4.033 . 0 0 "[ . 1 . 2]" 1
25 1 3 PHE HZ 1 101 THR HA 1.800 . 5.000 3.210 2.288 4.446 . 0 0 "[ . 1 . 2]" 1
26 1 3 PHE HZ 1 101 THR MG 1.800 . 5.000 4.027 2.741 4.729 . 0 0 "[ . 1 . 2]" 1
27 1 4 LYS H 1 4 LYS HA 1.800 . 2.900 2.870 2.342 2.985 0.085 1 0 "[ . 1 . 2]" 1
28 1 4 LYS H 1 4 LYS QB 1.800 . 3.500 2.491 2.268 2.955 . 0 0 "[ . 1 . 2]" 1
29 1 4 LYS H 1 4 LYS QD 1.800 . 5.000 3.800 3.281 4.227 . 0 0 "[ . 1 . 2]" 1
30 1 4 LYS H 1 4 LYS QG 1.800 . 5.000 3.092 1.948 4.416 . 0 0 "[ . 1 . 2]" 1
31 1 4 LYS HA 1 4 LYS QD 1.800 . 2.900 2.180 2.151 2.212 . 0 0 "[ . 1 . 2]" 1
32 1 4 LYS HA 1 4 LYS QG 1.800 . 2.900 2.820 2.661 2.947 0.047 5 0 "[ . 1 . 2]" 1
33 1 4 LYS HA 1 5 ALA H 1.800 . 3.500 2.245 2.189 2.337 . 0 0 "[ . 1 . 2]" 1
34 1 4 LYS QB 1 4 LYS QG 1.800 . 2.900 2.038 2.032 2.046 . 0 0 "[ . 1 . 2]" 1
35 1 4 LYS QB 1 97 ASN HD21 1.800 . 5.000 3.018 2.477 4.595 . 0 0 "[ . 1 . 2]" 1
36 1 4 LYS QB 1 97 ASN HD22 1.800 . 5.000 2.483 1.933 4.105 . 0 0 "[ . 1 . 2]" 1
37 1 4 LYS QG 1 97 ASN QD 1.800 . 3.500 3.173 2.323 3.525 0.025 15 0 "[ . 1 . 2]" 1
38 1 5 ALA H 1 5 ALA HA 1.800 . 2.900 2.972 2.883 2.989 0.089 2 0 "[ . 1 . 2]" 1
39 1 5 ALA H 1 5 ALA MB 1.800 . 2.900 2.408 2.142 2.628 . 0 0 "[ . 1 . 2]" 1
40 1 5 ALA HA 1 6 GLY H 1.800 . 3.500 2.826 2.495 3.059 . 0 0 "[ . 1 . 2]" 1
41 1 5 ALA MB 1 6 GLY H 1.800 . 3.500 1.957 1.795 2.306 0.005 16 0 "[ . 1 . 2]" 1
42 1 5 ALA MB 1 97 ASN QD 1.800 . 5.000 5.065 5.027 5.099 0.099 5 0 "[ . 1 . 2]" 1
43 1 6 GLY H 1 6 GLY HA2 1.800 . 2.900 2.871 2.764 2.959 0.059 13 0 "[ . 1 . 2]" 1
44 1 6 GLY H 1 6 GLY HA3 1.800 . 2.900 2.803 2.663 2.913 0.013 5 0 "[ . 1 . 2]" 1
45 1 6 GLY H 1 7 SER H 1.800 . 5.000 2.894 2.388 3.815 . 0 0 "[ . 1 . 2]" 1
46 1 6 GLY H 1 97 ASN QB 1.800 . 5.000 4.010 3.451 4.539 . 0 0 "[ . 1 . 2]" 1
47 1 6 GLY H 1 101 THR MG 1.800 . 5.000 3.528 3.230 4.365 . 0 0 "[ . 1 . 2]" 1
48 1 6 GLY QA 1 7 SER H 1.800 . 5.000 2.395 2.171 2.513 . 0 0 "[ . 1 . 2]" 1
49 1 6 GLY QA 1 97 ASN HB2 1.800 . 5.000 4.453 3.500 5.032 0.032 13 0 "[ . 1 . 2]" 1
50 1 6 GLY QA 1 97 ASN HB3 1.800 . 5.000 4.303 3.451 4.938 . 0 0 "[ . 1 . 2]" 1
51 1 6 GLY QA 1 101 THR MG 1.800 . 5.000 4.980 4.769 5.045 0.045 7 0 "[ . 1 . 2]" 1
52 1 7 SER H 1 7 SER HA 1.800 . 2.900 2.946 2.930 2.967 0.067 9 0 "[ . 1 . 2]" 1
53 1 7 SER H 1 7 SER HG 1.800 . 5.000 3.804 2.064 4.904 . 0 0 "[ . 1 . 2]" 1
54 1 7 SER H 1 8 ALA H 1.800 . 5.000 3.972 3.880 4.437 . 0 0 "[ . 1 . 2]" 1
55 1 7 SER H 1 8 ALA MB 1.800 . 5.000 5.051 5.019 5.086 0.086 20 0 "[ . 1 . 2]" 1
56 1 7 SER H 1 9 LYS QE 1.800 . 5.000 5.071 5.008 5.120 0.120 6 0 "[ . 1 . 2]" 1
57 1 7 SER H 1 97 ASN QB 1.800 . 5.000 4.665 4.128 5.024 0.024 7 0 "[ . 1 . 2]" 1
58 1 7 SER H 1 98 ASP HA 1.800 . 5.000 3.348 2.618 3.837 . 0 0 "[ . 1 . 2]" 1
59 1 7 SER H 1 98 ASP QB 1.800 . 5.000 3.805 2.275 4.367 . 0 0 "[ . 1 . 2]" 1
60 1 7 SER HA 1 7 SER HB2 1.800 . 2.900 2.688 2.327 2.984 0.084 18 0 "[ . 1 . 2]" 1
61 1 7 SER HA 1 7 SER HB3 1.800 . 2.900 2.638 2.260 3.024 0.124 2 0 "[ . 1 . 2]" 1
62 1 7 SER QB 1 8 ALA H 1.800 . 5.000 3.609 2.616 3.975 . 0 0 "[ . 1 . 2]" 1
63 1 8 ALA H 1 8 ALA HA 1.800 . 2.900 2.874 2.854 2.988 0.088 15 0 "[ . 1 . 2]" 1
64 1 8 ALA H 1 8 ALA MB 1.800 . 2.900 2.143 2.053 2.488 . 0 0 "[ . 1 . 2]" 1
65 1 8 ALA H 1 9 LYS H 1.800 . 5.000 2.570 1.855 2.634 . 0 0 "[ . 1 . 2]" 1
66 1 8 ALA H 1 10 LYS H 1.800 . 5.000 4.629 3.981 5.028 0.028 1 0 "[ . 1 . 2]" 1
67 1 8 ALA HA 1 9 LYS H 1.800 . 3.500 3.495 3.459 3.537 0.037 19 0 "[ . 1 . 2]" 1
68 1 8 ALA HA 1 10 LYS H 1.800 . 5.000 4.509 4.204 4.906 . 0 0 "[ . 1 . 2]" 1
69 1 8 ALA HA 1 11 GLY H 1.800 . 5.000 3.283 3.117 3.463 . 0 0 "[ . 1 . 2]" 1
70 1 8 ALA HA 1 12 ALA H 1.800 . 6.000 3.928 3.554 4.661 . 0 0 "[ . 1 . 2]" 1
71 1 8 ALA HA 1 101 THR MG 1.800 . 5.000 2.590 2.160 2.950 . 0 0 "[ . 1 . 2]" 1
72 1 8 ALA HA 1 102 TYR HB2 1.800 . 5.000 3.693 3.446 3.881 . 0 0 "[ . 1 . 2]" 1
73 1 8 ALA HA 1 102 TYR HB3 1.800 . 5.000 4.918 4.653 5.018 0.018 14 0 "[ . 1 . 2]" 1
74 1 8 ALA MB 1 9 LYS H 1.800 . 3.500 2.819 2.654 2.985 . 0 0 "[ . 1 . 2]" 1
75 1 9 LYS H 1 9 LYS QB 1.800 . 2.900 2.651 2.498 2.971 0.071 1 0 "[ . 1 . 2]" 1
76 1 9 LYS H 1 9 LYS HE2 1.800 . 2.900 2.481 1.745 2.944 0.055 7 0 "[ . 1 . 2]" 1
77 1 9 LYS H 1 9 LYS HE3 1.800 . 2.900 2.606 1.782 3.036 0.136 7 0 "[ . 1 . 2]" 1
78 1 9 LYS H 1 9 LYS QG 1.800 . 2.900 1.926 1.714 2.356 0.086 12 0 "[ . 1 . 2]" 1
79 1 9 LYS H 1 10 LYS H 1.800 . 3.500 2.893 2.760 3.246 . 0 0 "[ . 1 . 2]" 1
80 1 9 LYS H 1 11 GLY H 1.800 . 5.000 4.103 3.935 4.213 . 0 0 "[ . 1 . 2]" 1
81 1 9 LYS HA 1 10 LYS H 1.800 . 5.000 3.585 3.568 3.592 . 0 0 "[ . 1 . 2]" 1
82 1 9 LYS QB 1 10 LYS H 1.800 . 5.000 2.481 2.107 3.332 . 0 0 "[ . 1 . 2]" 1
83 1 10 LYS H 1 10 LYS HA 1.800 . 2.900 2.858 2.844 2.873 . 0 0 "[ . 1 . 2]" 1
84 1 10 LYS H 1 10 LYS HB2 1.800 . 3.500 2.457 2.441 2.481 . 0 0 "[ . 1 . 2]" 1
85 1 10 LYS H 1 10 LYS HB3 1.800 . 3.500 3.599 3.596 3.602 0.102 9 0 "[ . 1 . 2]" 1
86 1 10 LYS H 1 10 LYS QG 1.800 . 2.900 2.161 2.113 2.190 . 0 0 "[ . 1 . 2]" 1
87 1 10 LYS H 1 11 GLY H 1.800 . 5.000 2.662 2.619 2.708 . 0 0 "[ . 1 . 2]" 1
88 1 10 LYS H 1 12 ALA H 1.800 . 5.000 4.130 3.919 4.440 . 0 0 "[ . 1 . 2]" 1
89 1 10 LYS HA 1 10 LYS HB2 1.800 . 2.900 3.021 3.019 3.023 0.123 9 0 "[ . 1 . 2]" 1
90 1 10 LYS HA 1 10 LYS HB3 1.800 . 2.900 2.491 2.487 2.502 . 0 0 "[ . 1 . 2]" 1
91 1 10 LYS HA 1 11 GLY H 1.800 . 3.500 3.543 3.532 3.552 0.052 7 0 "[ . 1 . 2]" 1
92 1 10 LYS HA 1 12 ALA H 1.800 . 5.000 4.266 4.164 4.344 . 0 0 "[ . 1 . 2]" 1
93 1 10 LYS HA 1 13 THR H 1.800 . 5.000 3.526 3.200 3.778 . 0 0 "[ . 1 . 2]" 1
94 1 10 LYS HA 1 14 LEU H 1.800 . 5.000 4.210 3.777 4.543 . 0 0 "[ . 1 . 2]" 1
95 1 10 LYS HB2 1 11 GLY H 1.800 . 5.000 2.593 2.512 2.743 . 0 0 "[ . 1 . 2]" 1
96 1 10 LYS HB3 1 11 GLY H 1.800 . 5.000 3.620 3.545 3.732 . 0 0 "[ . 1 . 2]" 1
97 1 10 LYS QG 1 98 ASP QB 1.800 . 5.000 4.850 4.314 5.033 0.033 19 0 "[ . 1 . 2]" 1
98 1 11 GLY H 1 11 GLY HA2 1.800 . 2.900 2.851 2.816 2.882 . 0 0 "[ . 1 . 2]" 1
99 1 11 GLY H 1 11 GLY HA3 1.800 . 2.900 2.346 2.343 2.351 . 0 0 "[ . 1 . 2]" 1
100 1 11 GLY H 1 12 ALA H 1.800 . 3.500 2.690 2.572 2.841 . 0 0 "[ . 1 . 2]" 1
101 1 11 GLY H 1 13 THR H 1.800 . 5.000 4.358 4.148 4.483 . 0 0 "[ . 1 . 2]" 1
102 1 11 GLY H 1 98 ASP QB 1.800 . 5.000 2.305 1.957 2.582 . 0 0 "[ . 1 . 2]" 1
103 1 11 GLY QA 1 13 THR H 1.800 . 5.000 4.112 3.977 4.219 . 0 0 "[ . 1 . 2]" 1
104 1 11 GLY QA 1 14 LEU H 1.800 . 5.000 3.204 3.104 3.413 . 0 0 "[ . 1 . 2]" 1
105 1 11 GLY QA 1 15 PHE H 1.800 . 5.000 3.943 3.683 4.156 . 0 0 "[ . 1 . 2]" 1
106 1 11 GLY QA 1 99 LEU HA 1.800 . 5.000 2.744 2.317 2.990 . 0 0 "[ . 1 . 2]" 1
107 1 11 GLY QA 1 99 LEU QD 1.800 . 5.000 3.662 3.187 3.896 . 0 0 "[ . 1 . 2]" 1
108 1 11 GLY HA2 1 12 ALA H 1.800 . 3.500 3.538 3.514 3.562 0.062 13 0 "[ . 1 . 2]" 1
109 1 11 GLY HA2 1 14 LEU QB 1.800 . 5.000 2.406 2.149 2.942 . 0 0 "[ . 1 . 2]" 1
110 1 11 GLY HA2 1 14 LEU QD 1.800 . 5.000 3.008 2.070 3.819 . 0 0 "[ . 1 . 2]" 1
111 1 11 GLY HA2 1 98 ASP QB 1.800 . 5.000 2.589 2.197 2.905 . 0 0 "[ . 1 . 2]" 1
112 1 11 GLY HA3 1 12 ALA H 1.800 . 3.500 2.888 2.795 2.957 . 0 0 "[ . 1 . 2]" 1
113 1 11 GLY HA3 1 14 LEU QB 1.800 . 5.000 3.825 3.560 4.395 . 0 0 "[ . 1 . 2]" 1
114 1 11 GLY HA3 1 14 LEU QD 1.800 . 5.000 4.232 3.341 5.012 0.012 3 0 "[ . 1 . 2]" 1
115 1 11 GLY HA3 1 98 ASP QB 1.800 . 5.000 2.348 2.225 3.284 . 0 0 "[ . 1 . 2]" 1
116 1 12 ALA H 1 12 ALA HA 1.800 . 2.900 2.850 2.836 2.872 . 0 0 "[ . 1 . 2]" 1
117 1 12 ALA H 1 12 ALA MB 1.800 . 2.900 2.186 2.054 2.256 . 0 0 "[ . 1 . 2]" 1
118 1 12 ALA H 1 13 THR H 1.800 . 3.500 2.743 2.617 2.820 . 0 0 "[ . 1 . 2]" 1
119 1 12 ALA H 1 102 TYR HB2 1.800 . 5.000 3.053 2.609 3.877 . 0 0 "[ . 1 . 2]" 1
120 1 12 ALA H 1 102 TYR HB3 1.800 . 5.000 4.239 3.699 4.868 . 0 0 "[ . 1 . 2]" 1
121 1 12 ALA HA 1 13 THR H 1.800 . 3.500 3.561 3.537 3.572 0.072 2 0 "[ . 1 . 2]" 1
122 1 12 ALA HA 1 14 LEU H 1.800 . 5.000 4.395 4.336 4.519 . 0 0 "[ . 1 . 2]" 1
123 1 12 ALA HA 1 15 PHE H 1.800 . 5.000 3.860 3.371 4.021 . 0 0 "[ . 1 . 2]" 1
124 1 12 ALA HA 1 15 PHE QB 1.800 . 5.000 3.412 2.381 3.735 . 0 0 "[ . 1 . 2]" 1
125 1 12 ALA HA 1 16 LYS H 1.800 . 5.000 4.551 3.596 4.768 . 0 0 "[ . 1 . 2]" 1
126 1 12 ALA MB 1 13 THR H 1.800 . 2.900 2.467 2.332 2.691 . 0 0 "[ . 1 . 2]" 1
127 1 12 ALA MB 1 13 THR HA 1.800 . 5.000 3.798 3.706 3.864 . 0 0 "[ . 1 . 2]" 1
128 1 12 ALA MB 1 14 LEU H 1.800 . 5.000 4.383 4.269 4.611 . 0 0 "[ . 1 . 2]" 1
129 1 13 THR H 1 13 THR HA 1.800 . 2.900 2.892 2.840 2.909 0.009 11 0 "[ . 1 . 2]" 1
130 1 13 THR H 1 13 THR HB 1.800 . 3.500 3.465 2.585 3.622 0.122 11 0 "[ . 1 . 2]" 1
131 1 13 THR H 1 13 THR MG 1.800 . 3.500 2.343 1.938 3.742 0.242 4 0 "[ . 1 . 2]" 1
132 1 13 THR H 1 14 LEU H 1.800 . 2.900 2.531 2.456 2.733 . 0 0 "[ . 1 . 2]" 1
133 1 13 THR H 1 15 PHE H 1.800 . 5.000 4.333 4.008 4.467 . 0 0 "[ . 1 . 2]" 1
134 1 13 THR HA 1 13 THR HB 1.800 . 2.900 2.503 2.392 3.022 0.122 4 0 "[ . 1 . 2]" 1
135 1 13 THR HA 1 13 THR MG 1.800 . 3.500 2.381 2.225 2.470 . 0 0 "[ . 1 . 2]" 1
136 1 13 THR HA 1 14 LEU H 1.800 . 3.500 3.528 3.512 3.566 0.066 4 0 "[ . 1 . 2]" 1
137 1 13 THR HA 1 15 PHE H 1.800 . 5.000 4.345 4.229 4.839 . 0 0 "[ . 1 . 2]" 1
138 1 13 THR HA 1 16 LYS H 1.800 . 5.000 3.259 3.112 3.953 . 0 0 "[ . 1 . 2]" 1
139 1 13 THR HA 1 16 LYS HB2 1.800 . 5.000 2.760 2.276 5.076 0.076 4 0 "[ . 1 . 2]" 1
140 1 13 THR HA 1 16 LYS HB3 1.800 . 5.000 4.014 3.879 4.358 . 0 0 "[ . 1 . 2]" 1
141 1 13 THR HA 1 16 LYS QG 1.800 . 5.000 2.844 2.239 3.047 . 0 0 "[ . 1 . 2]" 1
142 1 13 THR HA 1 17 THR H 1.800 . 5.000 4.004 3.862 4.406 . 0 0 "[ . 1 . 2]" 1
143 1 13 THR HB 1 14 LEU H 1.800 . 5.000 3.737 2.483 3.994 . 0 0 "[ . 1 . 2]" 1
144 1 13 THR HB 1 16 LYS QG 1.800 . 5.000 5.023 4.702 5.133 0.133 16 0 "[ . 1 . 2]" 1
145 1 13 THR HB 1 17 THR MG 1.800 . 5.000 3.351 2.612 5.043 0.043 7 0 "[ . 1 . 2]" 1
146 1 13 THR MG 1 14 LEU H 1.800 . 5.000 3.766 3.519 3.847 . 0 0 "[ . 1 . 2]" 1
147 1 13 THR MG 1 16 LYS H 1.800 . 6.000 5.046 4.998 5.145 . 0 0 "[ . 1 . 2]" 1
148 1 14 LEU H 1 14 LEU HA 1.800 . 2.900 2.833 2.810 2.881 . 0 0 "[ . 1 . 2]" 1
149 1 14 LEU H 1 14 LEU QB 1.800 . 2.900 2.266 2.248 2.403 . 0 0 "[ . 1 . 2]" 1
150 1 14 LEU H 1 14 LEU QD 1.800 . 3.500 3.582 3.153 3.641 0.141 3 0 "[ . 1 . 2]" 1
151 1 14 LEU H 1 14 LEU HG 1.800 . 5.000 4.376 2.287 4.502 . 0 0 "[ . 1 . 2]" 1
152 1 14 LEU H 1 15 PHE H 1.800 . 3.500 2.765 2.563 2.855 . 0 0 "[ . 1 . 2]" 1
153 1 14 LEU H 1 16 LYS H 1.800 . 5.000 4.193 4.122 4.434 . 0 0 "[ . 1 . 2]" 1
154 1 14 LEU H 1 99 LEU QD 1.800 . 5.000 4.869 4.513 5.066 0.066 10 0 "[ . 1 . 2]" 1
155 1 14 LEU HA 1 14 LEU MD1 1.800 . 5.000 2.208 2.070 3.807 . 0 0 "[ . 1 . 2]" 1
156 1 14 LEU HA 1 14 LEU MD2 1.800 . 5.000 3.729 2.142 3.843 . 0 0 "[ . 1 . 2]" 1
157 1 14 LEU HA 1 14 LEU HG 1.800 . 3.500 2.854 2.614 2.947 . 0 0 "[ . 1 . 2]" 1
158 1 14 LEU HA 1 15 PHE H 1.800 . 3.500 3.554 3.533 3.572 0.072 13 0 "[ . 1 . 2]" 1
159 1 14 LEU HA 1 16 LYS H 1.800 . 5.000 4.588 4.509 4.764 . 0 0 "[ . 1 . 2]" 1
160 1 14 LEU HA 1 17 THR H 1.800 . 5.000 3.515 3.387 3.731 . 0 0 "[ . 1 . 2]" 1
161 1 14 LEU HA 1 17 THR HB 1.800 . 5.000 4.526 3.066 5.015 0.015 16 0 "[ . 1 . 2]" 1
162 1 14 LEU HA 1 18 ARG H 1.800 . 5.000 4.702 4.607 4.764 . 0 0 "[ . 1 . 2]" 1
163 1 14 LEU HA 1 99 LEU QD 1.800 . 5.000 4.970 4.749 5.100 0.100 6 0 "[ . 1 . 2]" 1
164 1 14 LEU QB 1 14 LEU MD1 1.800 . 2.900 2.159 2.051 2.181 . 0 0 "[ . 1 . 2]" 1
165 1 14 LEU QB 1 14 LEU MD2 1.800 . 2.900 2.066 2.046 2.154 . 0 0 "[ . 1 . 2]" 1
166 1 14 LEU QB 1 15 PHE H 1.800 . 2.900 2.420 2.328 2.594 . 0 0 "[ . 1 . 2]" 1
167 1 14 LEU QB 1 99 LEU QD 1.800 . 3.500 2.972 2.606 3.259 . 0 0 "[ . 1 . 2]" 1
168 1 14 LEU QD 1 90 LEU MD1 1.800 . 5.000 2.947 2.398 3.550 . 0 0 "[ . 1 . 2]" 1
169 1 14 LEU QD 1 95 ASP HA 1.800 . 5.000 2.640 2.115 3.261 . 0 0 "[ . 1 . 2]" 1
170 1 14 LEU QD 1 98 ASP QB 1.800 . 5.000 3.409 2.262 4.404 . 0 0 "[ . 1 . 2]" 1
171 1 14 LEU QD 1 99 LEU HA 1.800 . 5.000 3.485 2.963 4.161 . 0 0 "[ . 1 . 2]" 1
172 1 14 LEU QD 1 99 LEU QB 1.800 . 5.000 2.913 2.137 3.995 . 0 0 "[ . 1 . 2]" 1
173 1 14 LEU MD1 1 15 PHE H 1.800 . 5.000 4.526 4.399 4.648 . 0 0 "[ . 1 . 2]" 1
174 1 14 LEU MD1 1 18 ARG QG 1.800 . 5.000 2.803 2.204 4.613 . 0 0 "[ . 1 . 2]" 1
175 1 14 LEU MD1 1 90 LEU MD2 1.800 . 5.000 3.887 3.089 5.013 0.013 8 0 "[ . 1 . 2]" 1
176 1 14 LEU MD1 1 95 ASP HB2 1.800 . 5.000 4.722 4.045 5.028 0.028 9 0 "[ . 1 . 2]" 1
177 1 14 LEU MD1 1 95 ASP HB3 1.800 . 5.000 3.396 2.790 3.795 . 0 0 "[ . 1 . 2]" 1
178 1 14 LEU MD1 1 99 LEU MD1 1.800 . 5.000 4.349 3.532 5.019 0.019 4 0 "[ . 1 . 2]" 1
179 1 14 LEU MD1 1 99 LEU QD 1.800 . 5.000 4.050 3.333 4.251 . 0 0 "[ . 1 . 2]" 1
180 1 14 LEU MD1 1 99 LEU MD2 1.800 . 5.000 4.873 4.085 5.046 0.046 5 0 "[ . 1 . 2]" 1
181 1 14 LEU MD2 1 15 PHE H 1.800 . 5.000 4.193 3.838 4.660 . 0 0 "[ . 1 . 2]" 1
182 1 14 LEU MD2 1 18 ARG QG 1.800 . 5.000 4.514 2.842 5.086 0.086 4 0 "[ . 1 . 2]" 1
183 1 14 LEU MD2 1 90 LEU MD2 1.800 . 5.000 2.805 2.047 5.076 0.076 16 0 "[ . 1 . 2]" 1
184 1 14 LEU MD2 1 95 ASP HB2 1.800 . 5.000 3.613 3.420 4.816 . 0 0 "[ . 1 . 2]" 1
185 1 14 LEU MD2 1 95 ASP HB3 1.800 . 5.000 2.190 2.006 3.661 . 0 0 "[ . 1 . 2]" 1
186 1 14 LEU MD2 1 99 LEU MD1 1.800 . 5.000 2.512 2.032 4.370 . 0 0 "[ . 1 . 2]" 1
187 1 14 LEU MD2 1 99 LEU MD2 1.800 . 5.000 3.202 2.384 5.018 0.018 16 0 "[ . 1 . 2]" 1
188 1 14 LEU HG 1 15 PHE H 1.800 . 5.000 3.823 3.650 4.394 . 0 0 "[ . 1 . 2]" 1
189 1 14 LEU HG 1 99 LEU QD 1.800 . 5.000 3.365 3.084 5.029 0.029 16 0 "[ . 1 . 2]" 1
190 1 15 PHE H 1 15 PHE HA 1.800 . 2.900 2.861 2.825 2.874 . 0 0 "[ . 1 . 2]" 1
191 1 15 PHE H 1 15 PHE HB2 1.800 . 3.500 2.595 2.527 2.682 . 0 0 "[ . 1 . 2]" 1
192 1 15 PHE H 1 15 PHE HB3 1.800 . 3.500 2.519 2.422 2.613 . 0 0 "[ . 1 . 2]" 1
193 1 15 PHE H 1 16 LYS H 1.800 . 2.900 2.685 2.635 2.864 . 0 0 "[ . 1 . 2]" 1
194 1 15 PHE H 1 17 THR H 1.800 . 5.000 4.062 3.923 4.160 . 0 0 "[ . 1 . 2]" 1
195 1 15 PHE HA 1 16 LYS H 1.800 . 5.000 3.555 3.545 3.583 . 0 0 "[ . 1 . 2]" 1
196 1 15 PHE HA 1 17 THR H 1.800 . 5.000 4.290 4.081 4.395 . 0 0 "[ . 1 . 2]" 1
197 1 15 PHE HA 1 18 ARG H 1.800 . 5.000 3.549 3.452 3.735 . 0 0 "[ . 1 . 2]" 1
198 1 15 PHE HA 1 18 ARG QB 1.800 . 5.000 3.294 2.916 4.347 . 0 0 "[ . 1 . 2]" 1
199 1 15 PHE HA 1 19 CYS H 1.800 . 5.000 2.588 2.427 3.077 . 0 0 "[ . 1 . 2]" 1
200 1 15 PHE HA 1 20 LEU H 1.800 . 5.000 4.065 3.933 4.223 . 0 0 "[ . 1 . 2]" 1
201 1 15 PHE HA 1 99 LEU QD 1.800 . 5.000 2.942 2.707 3.146 . 0 0 "[ . 1 . 2]" 1
202 1 15 PHE QB 1 16 LYS H 1.800 . 2.900 2.437 2.328 2.485 . 0 0 "[ . 1 . 2]" 1
203 1 15 PHE QB 1 25 VAL QG 1.800 . 5.000 4.278 3.819 5.044 0.044 4 0 "[ . 1 . 2]" 1
204 1 15 PHE QB 1 102 TYR H 1.800 . 6.000 5.996 5.777 6.095 0.095 8 0 "[ . 1 . 2]" 1
205 1 15 PHE QB 1 102 TYR QE 1.800 . 5.000 3.816 3.254 4.433 . 0 0 "[ . 1 . 2]" 1
206 1 15 PHE QB 1 103 LEU MD1 1.800 . 5.000 4.287 3.694 5.026 0.026 4 0 "[ . 1 . 2]" 1
207 1 15 PHE QB 1 103 LEU MD2 1.800 . 5.000 3.351 3.003 4.278 . 0 0 "[ . 1 . 2]" 1
208 1 15 PHE HB2 1 99 LEU MD1 1.800 . 5.000 3.491 2.255 4.734 . 0 0 "[ . 1 . 2]" 1
209 1 15 PHE HB2 1 99 LEU MD2 1.800 . 5.000 3.405 2.143 4.719 . 0 0 "[ . 1 . 2]" 1
210 1 15 PHE HB3 1 99 LEU MD1 1.800 . 6.000 4.859 3.563 6.069 0.069 10 0 "[ . 1 . 2]" 1
211 1 15 PHE HB3 1 99 LEU MD2 1.800 . 6.000 4.863 3.612 6.066 0.066 4 0 "[ . 1 . 2]" 1
212 1 15 PHE QD 1 16 LYS H 1.800 . 5.000 3.036 2.694 3.399 . 0 0 "[ . 1 . 2]" 1
213 1 15 PHE QD 1 16 LYS HA 1.800 . 5.000 2.633 2.461 3.002 . 0 0 "[ . 1 . 2]" 1
214 1 15 PHE QD 1 19 CYS QB 1.800 . 5.000 2.958 2.744 3.059 . 0 0 "[ . 1 . 2]" 1
215 1 15 PHE QD 1 20 LEU H 1.800 . 5.000 3.851 3.283 4.088 . 0 0 "[ . 1 . 2]" 1
216 1 15 PHE QD 1 20 LEU HA 1.800 . 5.000 4.564 4.388 4.818 . 0 0 "[ . 1 . 2]" 1
217 1 15 PHE QD 1 20 LEU HB2 1.800 . 5.000 3.449 2.771 3.563 . 0 0 "[ . 1 . 2]" 1
218 1 15 PHE QD 1 20 LEU HB3 1.800 . 5.000 4.955 4.079 5.085 0.085 13 0 "[ . 1 . 2]" 1
219 1 15 PHE QD 1 20 LEU MD1 1.800 . 5.000 3.960 3.810 4.168 . 0 0 "[ . 1 . 2]" 1
220 1 15 PHE QD 1 20 LEU MD2 1.800 . 5.000 4.782 4.053 5.056 0.056 12 0 "[ . 1 . 2]" 1
221 1 15 PHE QD 1 99 LEU QD 1.800 . 5.000 2.511 2.213 2.818 . 0 0 "[ . 1 . 2]" 1
222 1 15 PHE QD 1 103 LEU MD1 1.800 . 5.000 3.329 2.530 4.073 . 0 0 "[ . 1 . 2]" 1
223 1 15 PHE QD 1 103 LEU MD2 1.800 . 5.000 2.494 2.237 2.806 . 0 0 "[ . 1 . 2]" 1
224 1 15 PHE QE 1 20 LEU QB 1.800 . 5.000 3.371 2.406 3.662 . 0 0 "[ . 1 . 2]" 1
225 1 15 PHE QE 1 24 THR HA 1.800 . 5.000 3.590 2.284 4.357 . 0 0 "[ . 1 . 2]" 1
226 1 15 PHE QE 1 24 THR MG 1.800 . 5.000 4.717 3.810 5.104 0.104 8 0 "[ . 1 . 2]" 1
227 1 15 PHE QE 1 25 VAL QG 1.800 . 5.000 2.161 1.975 2.743 . 0 0 "[ . 1 . 2]" 1
228 1 15 PHE QE 1 37 LEU QD 1.800 . 5.000 4.410 3.117 5.102 0.102 2 0 "[ . 1 . 2]" 1
229 1 15 PHE QE 1 103 LEU MD1 1.800 . 5.000 4.097 3.442 4.894 . 0 0 "[ . 1 . 2]" 1
230 1 15 PHE QE 1 103 LEU MD2 1.800 . 5.000 3.011 2.262 3.317 . 0 0 "[ . 1 . 2]" 1
231 1 15 PHE HZ 1 19 CYS QB 1.800 . 5.000 3.153 2.899 3.600 . 0 0 "[ . 1 . 2]" 1
232 1 15 PHE HZ 1 20 LEU QD 1.800 . 5.000 4.387 3.586 4.813 . 0 0 "[ . 1 . 2]" 1
233 1 15 PHE HZ 1 23 HIS QB 1.800 . 5.000 3.200 2.434 5.119 0.119 6 0 "[ . 1 . 2]" 1
234 1 15 PHE HZ 1 24 THR HA 1.800 . 5.000 3.702 2.524 4.107 . 0 0 "[ . 1 . 2]" 1
235 1 15 PHE HZ 1 24 THR HB 1.800 . 6.000 5.810 4.455 6.121 0.121 15 0 "[ . 1 . 2]" 1
236 1 15 PHE HZ 1 25 VAL HA 1.800 . 5.000 3.842 3.003 4.625 . 0 0 "[ . 1 . 2]" 1
237 1 15 PHE HZ 1 25 VAL HB 1.800 . 5.000 4.773 2.795 5.142 0.142 14 0 "[ . 1 . 2]" 1
238 1 15 PHE HZ 1 25 VAL QG 1.800 . 5.000 2.257 1.991 2.636 . 0 0 "[ . 1 . 2]" 1
239 1 16 LYS H 1 16 LYS HB2 1.800 . 3.500 2.656 2.467 3.607 0.107 4 0 "[ . 1 . 2]" 1
240 1 16 LYS H 1 16 LYS HB3 1.800 . 3.500 3.427 2.383 3.602 0.102 16 0 "[ . 1 . 2]" 1
241 1 16 LYS H 1 16 LYS QG 1.800 . 2.900 2.114 2.001 2.358 . 0 0 "[ . 1 . 2]" 1
242 1 16 LYS H 1 17 THR H 1.800 . 2.900 2.712 2.646 2.762 . 0 0 "[ . 1 . 2]" 1
243 1 16 LYS H 1 18 ARG H 1.800 . 5.000 4.109 4.038 4.290 . 0 0 "[ . 1 . 2]" 1
244 1 16 LYS HA 1 16 LYS QG 1.800 . 3.500 2.502 2.317 3.303 . 0 0 "[ . 1 . 2]" 1
245 1 16 LYS HA 1 17 THR H 1.800 . 3.500 3.527 3.466 3.546 0.046 16 0 "[ . 1 . 2]" 1
246 1 16 LYS HA 1 18 ARG H 1.800 . 5.000 3.934 3.837 4.003 . 0 0 "[ . 1 . 2]" 1
247 1 16 LYS HA 1 19 CYS H 1.800 . 5.000 5.106 5.010 5.139 0.139 14 0 "[ . 1 . 2]" 1
248 1 16 LYS HA 1 19 CYS QB 1.800 . 5.000 5.030 4.267 5.133 0.133 16 0 "[ . 1 . 2]" 1
249 1 16 LYS HA 1 20 LEU H 1.800 . 5.000 3.484 2.913 3.599 . 0 0 "[ . 1 . 2]" 1
250 1 16 LYS HA 1 20 LEU MD1 1.800 . 5.000 3.559 3.323 4.108 . 0 0 "[ . 1 . 2]" 1
251 1 16 LYS HA 1 20 LEU MD2 1.800 . 5.000 3.018 2.770 3.182 . 0 0 "[ . 1 . 2]" 1
252 1 16 LYS QG 1 20 LEU QB 1.800 . 5.000 3.982 3.719 4.659 . 0 0 "[ . 1 . 2]" 1
253 1 16 LYS QG 1 20 LEU QD 1.800 . 6.000 3.652 3.316 4.463 . 0 0 "[ . 1 . 2]" 1
254 1 17 THR H 1 17 THR HB 1.800 . 3.500 3.458 2.578 3.658 0.158 15 0 "[ . 1 . 2]" 1
255 1 17 THR H 1 17 THR MG 1.800 . 5.000 2.509 1.989 3.822 . 0 0 "[ . 1 . 2]" 1
256 1 17 THR H 1 18 ARG H 1.800 . 2.900 2.571 2.467 2.659 . 0 0 "[ . 1 . 2]" 1
257 1 17 THR H 1 19 CYS H 1.800 . 5.000 4.673 4.468 4.739 . 0 0 "[ . 1 . 2]" 1
258 1 17 THR HA 1 17 THR MG 1.800 . 3.500 2.412 2.199 3.181 . 0 0 "[ . 1 . 2]" 1
259 1 17 THR HA 1 18 ARG H 1.800 . 3.500 3.312 3.251 3.503 0.003 4 0 "[ . 1 . 2]" 1
260 1 17 THR HA 1 19 CYS H 1.800 . 6.000 5.771 5.675 5.838 . 0 0 "[ . 1 . 2]" 1
261 1 17 THR HB 1 18 ARG H 1.800 . 5.000 4.283 3.624 4.514 . 0 0 "[ . 1 . 2]" 1
262 1 18 ARG H 1 18 ARG HB2 1.800 . 3.500 2.764 2.705 2.837 . 0 0 "[ . 1 . 2]" 1
263 1 18 ARG H 1 18 ARG HG2 1.800 . 5.000 3.911 2.856 4.135 . 0 0 "[ . 1 . 2]" 1
264 1 18 ARG H 1 18 ARG HG3 1.800 . 5.000 3.333 3.062 4.160 . 0 0 "[ . 1 . 2]" 1
265 1 18 ARG H 1 19 CYS H 1.800 . 2.900 2.501 2.353 2.559 . 0 0 "[ . 1 . 2]" 1
266 1 18 ARG HA 1 18 ARG QG 1.800 . 3.500 2.382 2.261 2.883 . 0 0 "[ . 1 . 2]" 1
267 1 18 ARG HA 2 1 HEC HAB 1.800 . 5.000 4.448 4.271 4.986 . 0 0 "[ . 1 . 2]" 1
268 1 18 ARG QB 1 22 CYS H 1.800 . 6.000 5.971 5.007 6.073 0.073 17 0 "[ . 1 . 2]" 1
269 1 18 ARG HB2 1 19 CYS H 1.800 . 2.900 2.147 1.969 2.231 . 0 0 "[ . 1 . 2]" 1
270 1 18 ARG HB2 1 87 PHE QE 1.800 . 5.000 3.817 2.636 4.540 . 0 0 "[ . 1 . 2]" 1
271 1 18 ARG HB2 1 87 PHE HZ 1.800 . 6.000 4.822 4.152 5.139 . 0 0 "[ . 1 . 2]" 1
272 1 18 ARG HB2 2 1 HEC HAB 1.800 . 5.000 3.077 2.883 3.242 . 0 0 "[ . 1 . 2]" 1
273 1 18 ARG HB2 2 1 HEC HHC 1.800 . 5.000 4.794 3.479 5.022 0.022 5 0 "[ . 1 . 2]" 1
274 1 18 ARG HB3 1 19 CYS H 1.800 . 3.500 3.100 3.009 3.273 . 0 0 "[ . 1 . 2]" 1
275 1 18 ARG HB3 1 87 PHE QE 1.800 . 5.000 2.426 2.249 3.410 . 0 0 "[ . 1 . 2]" 1
276 1 18 ARG HB3 1 87 PHE HZ 1.800 . 6.000 3.988 3.734 4.890 . 0 0 "[ . 1 . 2]" 1
277 1 18 ARG HB3 2 1 HEC HAB 1.800 . 5.000 2.851 2.677 3.599 . 0 0 "[ . 1 . 2]" 1
278 1 18 ARG HB3 2 1 HEC HHC 1.800 . 5.000 3.900 2.961 4.137 . 0 0 "[ . 1 . 2]" 1
279 1 19 CYS H 1 19 CYS HA 1.800 . 2.900 2.866 2.769 2.887 . 0 0 "[ . 1 . 2]" 1
280 1 19 CYS H 1 20 LEU H 1.800 . 5.000 2.689 2.600 3.106 . 0 0 "[ . 1 . 2]" 1
281 1 19 CYS H 1 20 LEU QD 1.800 . 6.000 5.561 5.475 5.881 . 0 0 "[ . 1 . 2]" 1
282 1 19 CYS HA 1 19 CYS HB2 1.800 . 2.900 2.975 2.928 2.984 0.084 17 0 "[ . 1 . 2]" 1
283 1 19 CYS HA 1 19 CYS HB3 1.800 . 2.900 2.330 2.293 2.742 . 0 0 "[ . 1 . 2]" 1
284 1 19 CYS HA 1 20 LEU H 1.800 . 3.500 3.517 3.489 3.577 0.077 4 0 "[ . 1 . 2]" 1
285 1 19 CYS HA 2 1 HEC HAB 1.800 . 3.500 2.223 2.194 2.254 . 0 0 "[ . 1 . 2]" 1
286 1 19 CYS QB 2 1 HEC HAB 1.800 . 5.000 3.025 2.815 3.062 . 0 0 "[ . 1 . 2]" 1
287 1 19 CYS HB2 1 20 LEU H 1.800 . 5.000 2.911 2.634 3.055 . 0 0 "[ . 1 . 2]" 1
288 1 19 CYS HB2 2 1 HEC HHC 1.800 . 5.000 4.962 4.673 5.022 0.022 5 0 "[ . 1 . 2]" 1
289 1 19 CYS HB3 1 20 LEU H 1.800 . 5.000 4.076 2.667 4.224 . 0 0 "[ . 1 . 2]" 1
290 1 19 CYS HB3 2 1 HEC HHC 1.800 . 5.000 3.889 3.684 5.085 0.085 4 0 "[ . 1 . 2]" 1
291 1 20 LEU H 1 20 LEU MD1 1.800 . 5.000 3.957 3.899 4.002 . 0 0 "[ . 1 . 2]" 1
292 1 20 LEU H 1 20 LEU MD2 1.800 . 5.000 4.291 4.260 4.318 . 0 0 "[ . 1 . 2]" 1
293 1 20 LEU H 1 20 LEU HG 1.800 . 5.000 4.493 4.462 4.503 . 0 0 "[ . 1 . 2]" 1
294 1 20 LEU H 1 21 GLN H 1.800 . 5.000 2.779 2.729 2.808 . 0 0 "[ . 1 . 2]" 1
295 1 20 LEU H 1 22 CYS H 1.800 . 5.000 4.421 4.361 4.503 . 0 0 "[ . 1 . 2]" 1
296 1 20 LEU HA 1 20 LEU MD1 1.800 . 5.000 2.141 2.065 2.237 . 0 0 "[ . 1 . 2]" 1
297 1 20 LEU HA 1 20 LEU MD2 1.800 . 5.000 3.821 3.784 3.849 . 0 0 "[ . 1 . 2]" 1
298 1 20 LEU HA 1 21 GLN H 1.800 . 5.000 3.536 3.526 3.544 . 0 0 "[ . 1 . 2]" 1
299 1 20 LEU HA 1 22 CYS H 1.800 . 5.000 4.161 4.009 4.231 . 0 0 "[ . 1 . 2]" 1
300 1 20 LEU QB 1 21 GLN H 1.800 . 2.900 2.681 2.646 2.738 . 0 0 "[ . 1 . 2]" 1
301 1 20 LEU HB2 1 20 LEU QD 1.800 . 3.500 2.040 2.013 2.093 . 0 0 "[ . 1 . 2]" 1
302 1 20 LEU HB3 1 20 LEU QD 1.800 . 5.000 2.254 2.171 2.352 . 0 0 "[ . 1 . 2]" 1
303 1 20 LEU QD 1 24 THR HA 1.800 . 5.000 2.719 2.516 3.068 . 0 0 "[ . 1 . 2]" 1
304 1 20 LEU QD 1 24 THR HB 1.800 . 5.000 4.320 2.234 4.914 . 0 0 "[ . 1 . 2]" 1
305 1 20 LEU QD 1 24 THR MG 1.800 . 3.500 2.669 1.863 3.054 . 0 0 "[ . 1 . 2]" 1
306 1 20 LEU MD1 1 21 GLN QG 1.800 . 6.000 5.485 5.316 6.064 0.064 5 0 "[ . 1 . 2]" 1
307 1 20 LEU MD2 1 21 GLN QG 1.800 . 6.000 4.501 4.130 6.001 0.001 10 0 "[ . 1 . 2]" 1
308 1 20 LEU HG 1 24 THR HA 1.800 . 5.000 4.988 4.839 5.052 0.052 5 0 "[ . 1 . 2]" 1
309 1 21 GLN H 1 21 GLN QB 1.800 . 3.500 2.454 2.257 2.506 . 0 0 "[ . 1 . 2]" 1
310 1 21 GLN H 1 21 GLN QG 1.800 . 5.000 2.252 2.006 3.960 . 0 0 "[ . 1 . 2]" 1
311 1 21 GLN HA 1 22 CYS H 1.800 . 5.000 3.561 3.540 3.571 . 0 0 "[ . 1 . 2]" 1
312 1 21 GLN QB 1 22 CYS H 1.800 . 5.000 2.640 2.550 2.686 . 0 0 "[ . 1 . 2]" 1
313 1 21 GLN QG 1 22 CYS H 1.800 . 5.000 4.063 3.738 4.113 . 0 0 "[ . 1 . 2]" 1
314 1 22 CYS HA 1 23 HIS H 1.800 . 3.500 3.558 3.517 3.581 0.081 4 0 "[ . 1 . 2]" 1
315 1 22 CYS HA 1 24 THR H 1.800 . 6.300 6.413 6.101 6.548 0.248 5 0 "[ . 1 . 2]" 1
316 1 22 CYS HA 1 34 GLY H 1.800 . 5.000 3.333 2.605 4.683 . 0 0 "[ . 1 . 2]" 1
317 1 22 CYS QB 1 23 HIS QB 1.800 . 5.000 4.037 3.509 4.164 . 0 0 "[ . 1 . 2]" 1
318 1 22 CYS QB 1 33 VAL H 1.800 . 5.000 4.788 4.348 5.061 0.061 14 0 "[ . 1 . 2]" 1
319 1 22 CYS QB 1 33 VAL HB 1.800 . 5.000 2.967 2.274 4.995 . 0 0 "[ . 1 . 2]" 1
320 1 22 CYS QB 1 33 VAL QG 1.800 . 5.000 3.032 2.069 3.633 . 0 0 "[ . 1 . 2]" 1
321 1 22 CYS HB2 1 23 HIS H 1.800 . 3.500 2.454 1.997 2.644 . 0 0 "[ . 1 . 2]" 1
322 1 22 CYS HB2 1 34 GLY H 1.800 . 6.000 4.733 4.329 5.448 . 0 0 "[ . 1 . 2]" 1
323 1 22 CYS HB3 1 23 HIS H 1.800 . 3.500 3.389 2.334 3.610 0.110 5 0 "[ . 1 . 2]" 1
324 1 22 CYS HB3 1 34 GLY H 1.800 . 6.000 3.144 2.741 3.946 . 0 0 "[ . 1 . 2]" 1
325 1 23 HIS H 1 23 HIS HB2 1.800 . 3.500 2.705 2.442 3.729 0.229 12 0 "[ . 1 . 2]" 1
326 1 23 HIS H 2 1 HEC HHC 1.800 . 5.000 4.861 4.672 5.091 0.091 18 0 "[ . 1 . 2]" 1
327 1 23 HIS HA 1 24 THR H 1.800 . 5.000 2.279 2.232 2.313 . 0 0 "[ . 1 . 2]" 1
328 1 23 HIS HA 1 24 THR HA 1.800 . 5.000 4.469 4.416 4.507 . 0 0 "[ . 1 . 2]" 1
329 1 23 HIS HA 1 36 ASN HA 1.800 . 5.000 2.660 2.187 4.211 . 0 0 "[ . 1 . 2]" 1
330 1 23 HIS QB 1 37 LEU H 1.800 . 5.000 2.789 1.753 4.914 0.047 4 0 "[ . 1 . 2]" 1
331 1 23 HIS QB 1 37 LEU QB 1.800 . 6.000 3.633 2.402 5.790 . 0 0 "[ . 1 . 2]" 1
332 1 23 HIS HB2 1 24 THR H 1.800 . 6.000 3.646 2.889 4.068 . 0 0 "[ . 1 . 2]" 1
333 1 23 HIS HB3 1 24 THR H 1.800 . 6.000 2.884 2.415 4.023 . 0 0 "[ . 1 . 2]" 1
334 1 23 HIS HD1 1 36 ASN QD 1.800 . 3.500 3.507 2.865 3.693 0.193 11 0 "[ . 1 . 2]" 1
335 1 23 HIS HD1 1 37 LEU H 1.800 . 5.000 2.801 1.773 3.736 0.027 3 0 "[ . 1 . 2]" 1
336 1 23 HIS HD2 2 1 HEC HAC 1.800 . 6.000 5.837 4.089 6.163 0.163 7 0 "[ . 1 . 2]" 1
337 1 24 THR H 1 24 THR MG 1.800 . 5.000 3.552 2.056 3.971 . 0 0 "[ . 1 . 2]" 1
338 1 24 THR H 1 25 VAL H 1.800 . 6.000 4.248 2.026 4.576 . 0 0 "[ . 1 . 2]" 1
339 1 24 THR H 1 36 ASN H 1.800 . 6.000 4.875 3.761 5.317 . 0 0 "[ . 1 . 2]" 1
340 1 24 THR H 1 36 ASN HA 1.800 . 5.000 2.553 1.731 3.435 0.069 13 0 "[ . 1 . 2]" 1
341 1 24 THR H 1 37 LEU H 1.800 . 5.000 3.598 2.572 5.117 0.117 6 0 "[ . 1 . 2]" 1
342 1 24 THR HA 1 24 THR HB 1.800 . 2.900 2.857 2.350 3.022 0.122 16 0 "[ . 1 . 2]" 1
343 1 24 THR HA 1 24 THR MG 1.800 . 2.900 2.303 2.141 2.573 . 0 0 "[ . 1 . 2]" 1
344 1 24 THR HA 1 25 VAL H 1.800 . 5.000 2.326 2.209 3.380 . 0 0 "[ . 1 . 2]" 1
345 1 24 THR HA 1 25 VAL MG1 1.800 . 6.000 4.354 3.539 5.523 . 0 0 "[ . 1 . 2]" 1
346 1 24 THR HA 1 25 VAL MG2 1.800 . 5.000 3.750 3.394 4.202 . 0 0 "[ . 1 . 2]" 1
347 1 24 THR HB 1 25 VAL H 1.800 . 5.000 3.682 2.599 4.158 . 0 0 "[ . 1 . 2]" 1
348 1 24 THR HB 1 25 VAL MG1 1.800 . 6.000 5.542 4.849 6.073 0.073 1 0 "[ . 1 . 2]" 1
349 1 24 THR HB 1 25 VAL MG2 1.800 . 5.000 4.913 3.783 5.232 0.232 10 0 "[ . 1 . 2]" 1
350 1 24 THR HB 1 29 GLY H 1.800 . 6.000 4.740 3.692 6.051 0.051 12 0 "[ . 1 . 2]" 1
351 1 24 THR HB 1 29 GLY HA2 1.800 . 6.000 4.103 3.022 5.700 . 0 0 "[ . 1 . 2]" 1
352 1 24 THR HB 1 29 GLY QA 1.800 . 5.000 2.963 2.241 4.339 . 0 0 "[ . 1 . 2]" 1
353 1 24 THR HB 1 29 GLY HA3 1.800 . 6.000 3.214 2.266 5.933 . 0 0 "[ . 1 . 2]" 1
354 1 24 THR HB 1 36 ASN QD 1.800 . 5.000 4.060 3.376 4.982 . 0 0 "[ . 1 . 2]" 1
355 1 24 THR MG 1 25 VAL H 1.800 . 5.000 2.973 2.115 4.128 . 0 0 "[ . 1 . 2]" 1
356 1 24 THR MG 1 30 PRO QD 1.800 . 3.500 2.902 2.134 3.498 . 0 0 "[ . 1 . 2]" 1
357 1 24 THR MG 1 36 ASN QB 1.800 . 5.000 4.119 3.731 4.598 . 0 0 "[ . 1 . 2]" 1
358 1 24 THR MG 1 36 ASN QD 1.800 . 5.000 4.211 2.744 4.913 . 0 0 "[ . 1 . 2]" 1
359 1 25 VAL H 1 25 VAL MG1 1.800 . 5.000 2.888 2.135 4.055 . 0 0 "[ . 1 . 2]" 1
360 1 25 VAL H 1 25 VAL MG2 1.800 . 3.500 2.033 1.788 3.021 0.012 19 0 "[ . 1 . 2]" 1
361 1 25 VAL HA 1 25 VAL MG1 1.800 . 3.500 2.320 2.208 2.518 . 0 0 "[ . 1 . 2]" 1
362 1 25 VAL HA 1 25 VAL MG2 1.800 . 3.500 2.889 2.197 3.194 . 0 0 "[ . 1 . 2]" 1
363 1 25 VAL HA 1 37 LEU QB 1.800 . 5.000 4.956 4.550 5.098 0.098 8 0 "[ . 1 . 2]" 1
364 1 25 VAL HA 1 38 HIS H 1.800 . 5.000 5.084 4.832 5.223 0.223 5 0 "[ . 1 . 2]" 1
365 1 25 VAL HB 1 26 GLU H 1.800 . 5.000 3.583 1.778 4.401 0.022 4 0 "[ . 1 . 2]" 1
366 1 25 VAL QG 1 106 ALA MB 1.800 . 5.000 3.823 2.669 4.619 . 0 0 "[ . 1 . 2]" 1
367 1 25 VAL MG1 1 103 LEU QD 1.800 . 5.000 3.556 2.717 5.014 0.014 8 0 "[ . 1 . 2]" 1
368 1 25 VAL MG2 1 103 LEU QD 1.800 . 5.000 4.480 2.563 5.129 0.129 9 0 "[ . 1 . 2]" 1
369 1 26 GLU H 1 27 LYS H 1.800 . 5.000 4.663 4.587 4.684 . 0 0 "[ . 1 . 2]" 1
370 1 26 GLU HA 1 27 LYS H 1.800 . 5.000 2.290 2.244 2.607 . 0 0 "[ . 1 . 2]" 1
371 1 26 GLU QB 1 29 GLY H 1.800 . 5.000 4.035 2.295 5.022 0.022 15 0 "[ . 1 . 2]" 1
372 1 26 GLU HG2 1 27 LYS H 1.800 . 5.000 3.672 2.361 4.951 . 0 0 "[ . 1 . 2]" 1
373 1 26 GLU HG3 1 27 LYS H 1.800 . 5.000 4.286 2.865 5.060 0.060 20 0 "[ . 1 . 2]" 1
374 1 27 LYS H 1 27 LYS QD 1.800 . 5.000 4.176 3.819 4.445 . 0 0 "[ . 1 . 2]" 1
375 1 27 LYS H 1 27 LYS HG2 1.800 . 5.000 4.024 3.250 4.691 . 0 0 "[ . 1 . 2]" 1
376 1 27 LYS H 1 27 LYS HG3 1.800 . 5.000 3.456 2.093 4.470 . 0 0 "[ . 1 . 2]" 1
377 1 27 LYS HA 1 28 GLY H 1.800 . 5.000 2.537 2.186 3.523 . 0 0 "[ . 1 . 2]" 1
378 1 27 LYS HA 1 38 HIS QB 1.800 . 5.000 3.472 2.358 4.528 . 0 0 "[ . 1 . 2]" 1
379 1 28 GLY H 1 29 GLY H 1.800 . 5.000 2.890 2.374 4.369 . 0 0 "[ . 1 . 2]" 1
380 1 28 GLY H 1 38 HIS QB 1.800 . 5.000 4.930 4.324 5.122 0.122 11 0 "[ . 1 . 2]" 1
381 1 28 GLY HA2 1 29 GLY H 1.800 . 3.500 2.951 2.193 3.564 0.064 14 0 "[ . 1 . 2]" 1
382 1 28 GLY HA3 1 29 GLY H 1.800 . 3.500 3.284 2.200 3.569 0.069 6 0 "[ . 1 . 2]" 1
383 1 29 GLY QA 1 30 PRO QD 1.800 . 3.500 2.035 2.007 2.217 . 0 0 "[ . 1 . 2]" 1
384 1 29 GLY QA 1 36 ASN QB 1.800 . 3.500 3.019 1.973 3.518 0.018 10 0 "[ . 1 . 2]" 1
385 1 29 GLY QA 1 36 ASN HD21 1.800 . 5.000 4.813 4.418 5.147 0.147 11 0 "[ . 1 . 2]" 1
386 1 29 GLY QA 1 36 ASN HD22 1.800 . 5.000 4.439 3.673 4.894 . 0 0 "[ . 1 . 2]" 1
387 1 30 PRO HA 1 30 PRO QG 1.800 . 3.500 3.498 3.470 3.516 0.016 11 0 "[ . 1 . 2]" 1
388 1 30 PRO HB2 1 32 LYS H 1.800 . 5.000 3.123 2.397 3.485 . 0 0 "[ . 1 . 2]" 1
389 1 30 PRO HB3 1 32 LYS H 1.800 . 5.000 4.768 4.054 5.060 0.060 12 0 "[ . 1 . 2]" 1
390 1 30 PRO QG 1 32 LYS H 1.800 . 3.500 3.271 2.734 3.587 0.087 7 0 "[ . 1 . 2]" 1
391 1 31 HIS HA 1 31 HIS HD2 1.800 . 5.000 4.672 4.572 4.811 . 0 0 "[ . 1 . 2]" 1
392 1 31 HIS HA 1 32 LYS H 1.800 . 5.000 2.753 2.522 2.968 . 0 0 "[ . 1 . 2]" 1
393 1 31 HIS HA 1 35 PRO HA 1.800 . 6.000 3.781 3.252 4.236 . 0 0 "[ . 1 . 2]" 1
394 1 31 HIS HA 1 36 ASN H 1.800 . 5.000 3.995 3.317 4.320 . 0 0 "[ . 1 . 2]" 1
395 1 31 HIS HA 1 36 ASN HA 1.800 . 5.000 4.786 4.461 5.126 0.126 6 0 "[ . 1 . 2]" 1
396 1 31 HIS HA 1 36 ASN HB2 1.800 . 5.000 4.716 4.068 5.020 0.020 8 0 "[ . 1 . 2]" 1
397 1 31 HIS HA 1 36 ASN HB3 1.800 . 5.000 5.106 4.969 5.196 0.196 2 0 "[ . 1 . 2]" 1
398 1 31 HIS QB 1 35 PRO HA 1.800 . 6.000 2.937 2.382 3.902 . 0 0 "[ . 1 . 2]" 1
399 1 31 HIS QB 1 36 ASN QD 1.800 . 6.000 3.858 3.568 4.893 . 0 0 "[ . 1 . 2]" 1
400 1 31 HIS QB 1 51 TYR QB 1.800 . 6.000 3.100 2.110 3.550 . 0 0 "[ . 1 . 2]" 1
401 1 31 HIS QB 1 51 TYR QD 1.800 . 6.000 3.420 2.538 4.484 . 0 0 "[ . 1 . 2]" 1
402 1 31 HIS HB2 1 31 HIS HD2 1.800 . 3.500 2.724 2.714 2.753 . 0 0 "[ . 1 . 2]" 1
403 1 31 HIS HB2 1 32 LYS H 1.800 . 5.000 4.277 4.050 4.461 . 0 0 "[ . 1 . 2]" 1
404 1 31 HIS HB3 1 31 HIS HD2 1.800 . 3.500 3.693 3.593 3.762 0.262 19 0 "[ . 1 . 2]" 1
405 1 31 HIS HB3 1 32 LYS H 1.800 . 5.000 4.464 4.333 4.524 . 0 0 "[ . 1 . 2]" 1
406 1 31 HIS HD1 1 34 GLY QA 1.800 . 5.000 5.046 5.009 5.101 0.101 1 0 "[ . 1 . 2]" 1
407 1 31 HIS HD1 1 48 ALA MB 1.800 . 6.000 5.331 4.358 5.893 . 0 0 "[ . 1 . 2]" 1
408 1 31 HIS HD1 1 50 GLY QA 1.800 . 5.000 4.751 4.444 5.194 0.194 13 0 "[ . 1 . 2]" 1
409 1 31 HIS HD1 1 51 TYR QB 1.800 . 5.000 3.397 2.983 3.839 . 0 0 "[ . 1 . 2]" 1
410 1 31 HIS HD2 1 50 GLY QA 1.800 . 5.000 3.734 2.258 4.086 . 0 0 "[ . 1 . 2]" 1
411 1 31 HIS HD2 1 51 TYR HA 1.800 . 5.000 4.655 4.247 5.026 0.026 12 0 "[ . 1 . 2]" 1
412 1 31 HIS HD2 1 51 TYR HB2 1.800 . 5.000 2.958 2.411 3.539 . 0 0 "[ . 1 . 2]" 1
413 1 31 HIS HD2 1 51 TYR HB3 1.800 . 5.000 3.658 3.094 4.049 . 0 0 "[ . 1 . 2]" 1
414 1 31 HIS HD2 1 51 TYR QD 1.800 . 5.000 4.864 4.386 5.074 0.074 16 0 "[ . 1 . 2]" 1
415 1 31 HIS HE1 1 35 PRO HA 1.800 . 5.000 3.590 2.986 3.964 . 0 0 "[ . 1 . 2]" 1
416 1 31 HIS HE1 1 35 PRO HB2 1.800 . 5.000 4.732 4.216 5.024 0.024 10 0 "[ . 1 . 2]" 1
417 1 31 HIS HE1 1 35 PRO HB3 1.800 . 5.000 4.469 3.713 5.058 0.058 13 0 "[ . 1 . 2]" 1
418 1 31 HIS HE1 1 36 ASN HA 1.800 . 6.000 4.515 4.135 5.288 . 0 0 "[ . 1 . 2]" 1
419 1 31 HIS HE1 1 36 ASN HB2 1.800 . 6.000 2.376 2.259 2.769 . 0 0 "[ . 1 . 2]" 1
420 1 31 HIS HE1 1 36 ASN HB3 1.800 . 6.000 4.058 3.857 4.414 . 0 0 "[ . 1 . 2]" 1
421 1 31 HIS HE1 1 48 ALA MB 1.800 . 6.000 3.994 3.622 4.360 . 0 0 "[ . 1 . 2]" 1
422 1 31 HIS HE1 1 50 GLY QA 1.800 . 5.000 2.751 2.266 4.138 . 0 0 "[ . 1 . 2]" 1
423 1 31 HIS HE1 1 51 TYR QB 1.800 . 5.000 3.399 2.698 4.606 . 0 0 "[ . 1 . 2]" 1
424 1 32 LYS H 1 32 LYS HB2 1.800 . 3.500 2.526 2.411 2.710 . 0 0 "[ . 1 . 2]" 1
425 1 32 LYS H 1 32 LYS HB3 1.800 . 3.500 2.932 2.606 3.631 0.131 11 0 "[ . 1 . 2]" 1
426 1 32 LYS H 1 32 LYS QG 1.800 . 5.000 3.352 1.820 4.070 . 0 0 "[ . 1 . 2]" 1
427 1 32 LYS H 1 33 VAL HA 1.800 . 6.000 5.494 5.328 5.910 . 0 0 "[ . 1 . 2]" 1
428 1 32 LYS H 1 36 ASN QD 1.800 . 3.500 3.241 2.647 3.558 0.058 2 0 "[ . 1 . 2]" 1
429 1 32 LYS QB 1 33 VAL H 1.800 . 2.900 2.309 1.710 2.553 0.090 11 0 "[ . 1 . 2]" 1
430 1 32 LYS QB 1 33 VAL HA 1.800 . 6.000 4.273 3.856 4.600 . 0 0 "[ . 1 . 2]" 1
431 1 32 LYS QB 1 34 GLY H 1.800 . 5.000 4.501 3.762 5.006 0.006 17 0 "[ . 1 . 2]" 1
432 1 32 LYS QG 1 33 VAL H 1.800 . 3.500 3.568 2.678 3.793 0.293 12 0 "[ . 1 . 2]" 1
433 1 33 VAL H 1 33 VAL MG1 1.800 . 5.000 3.690 2.310 3.967 . 0 0 "[ . 1 . 2]" 1
434 1 33 VAL H 1 33 VAL MG2 1.800 . 5.000 2.386 1.889 4.020 . 0 0 "[ . 1 . 2]" 1
435 1 33 VAL HA 1 33 VAL HB 1.800 . 2.900 2.953 2.529 3.023 0.123 4 0 "[ . 1 . 2]" 1
436 1 33 VAL HA 1 33 VAL MG1 1.800 . 3.500 2.326 2.142 3.198 . 0 0 "[ . 1 . 2]" 1
437 1 33 VAL HA 1 33 VAL MG2 1.800 . 3.500 2.466 2.223 2.681 . 0 0 "[ . 1 . 2]" 1
438 1 33 VAL HB 1 34 GLY H 1.800 . 3.500 2.217 1.806 3.699 0.199 6 0 "[ . 1 . 2]" 1
439 1 33 VAL QG 2 1 HEC HAC 1.800 . 5.000 2.701 2.017 3.573 . 0 0 "[ . 1 . 2]" 1
440 1 33 VAL QG 2 1 HEC HHD 1.800 . 5.000 3.998 3.186 4.957 . 0 0 "[ . 1 . 2]" 1
441 1 33 VAL MG1 1 34 GLY H 1.800 . 3.500 3.128 1.698 3.543 0.102 12 0 "[ . 1 . 2]" 1
442 1 33 VAL MG2 1 34 GLY H 1.800 . 3.500 3.377 2.951 3.639 0.139 1 0 "[ . 1 . 2]" 1
443 1 34 GLY QA 1 36 ASN HD21 1.800 . 5.000 4.924 3.894 5.156 0.156 11 0 "[ . 1 . 2]" 1
444 1 34 GLY QA 1 36 ASN HD22 1.800 . 6.000 5.113 4.230 5.513 . 0 0 "[ . 1 . 2]" 1
445 1 34 GLY QA 1 51 TYR QB 1.800 . 6.000 5.656 5.310 5.917 . 0 0 "[ . 1 . 2]" 1
446 1 34 GLY HA2 1 35 PRO HD2 1.800 . 5.000 2.681 2.350 3.524 . 0 0 "[ . 1 . 2]" 1
447 1 34 GLY HA2 1 35 PRO HD3 1.800 . 5.000 2.396 2.227 2.633 . 0 0 "[ . 1 . 2]" 1
448 1 34 GLY HA2 1 51 TYR QE 1.800 . 6.000 4.453 3.954 4.986 . 0 0 "[ . 1 . 2]" 1
449 1 34 GLY HA2 2 1 HEC HHD 1.800 . 5.000 4.991 4.560 5.079 0.079 10 0 "[ . 1 . 2]" 1
450 1 34 GLY HA3 1 35 PRO HD2 1.800 . 5.000 2.447 2.277 2.747 . 0 0 "[ . 1 . 2]" 1
451 1 34 GLY HA3 1 35 PRO HD3 1.800 . 5.000 3.233 2.423 3.553 . 0 0 "[ . 1 . 2]" 1
452 1 34 GLY HA3 1 51 TYR QE 1.800 . 6.000 5.673 5.221 5.997 . 0 0 "[ . 1 . 2]" 1
453 1 34 GLY HA3 2 1 HEC HHD 1.800 . 5.000 3.784 3.462 4.672 . 0 0 "[ . 1 . 2]" 1
454 1 35 PRO HA 1 36 ASN H 1.800 . 5.000 2.483 2.235 3.307 . 0 0 "[ . 1 . 2]" 1
455 1 35 PRO HA 1 36 ASN HA 1.800 . 5.000 4.566 4.364 5.171 0.171 13 0 "[ . 1 . 2]" 1
456 1 35 PRO QB 1 37 LEU H 1.800 . 5.000 4.872 2.494 5.288 0.288 10 0 "[ . 1 . 2]" 1
457 1 35 PRO QB 1 51 TYR HA 1.800 . 5.000 5.020 4.544 5.150 0.150 1 0 "[ . 1 . 2]" 1
458 1 35 PRO QB 1 51 TYR QD 1.800 . 5.000 2.288 2.196 2.480 . 0 0 "[ . 1 . 2]" 1
459 1 35 PRO QB 2 1 HEC HAD1 1.800 . 5.000 4.226 3.544 5.014 0.014 13 0 "[ . 1 . 2]" 1
460 1 35 PRO HB2 1 36 ASN H 1.800 . 5.000 3.505 3.007 4.018 . 0 0 "[ . 1 . 2]" 1
461 1 35 PRO HB2 1 51 TYR QE 1.800 . 5.000 5.049 5.006 5.145 0.145 6 0 "[ . 1 . 2]" 1
462 1 35 PRO HB3 1 36 ASN H 1.800 . 5.000 3.650 3.142 4.653 . 0 0 "[ . 1 . 2]" 1
463 1 35 PRO HB3 1 51 TYR QE 1.800 . 5.000 3.832 3.516 4.120 . 0 0 "[ . 1 . 2]" 1
464 1 35 PRO QD 1 51 TYR QD 1.800 . 5.000 2.892 2.270 3.882 . 0 0 "[ . 1 . 2]" 1
465 1 35 PRO QD 2 1 HEC HAD1 1.800 . 5.000 3.160 2.349 4.116 . 0 0 "[ . 1 . 2]" 1
466 1 35 PRO QG 1 51 TYR QD 1.800 . 5.000 2.702 2.237 3.698 . 0 0 "[ . 1 . 2]" 1
467 1 35 PRO QG 1 51 TYR QE 1.800 . 5.000 2.643 2.232 3.415 . 0 0 "[ . 1 . 2]" 1
468 1 36 ASN HA 1 36 ASN HD21 1.800 . 5.000 1.921 1.748 2.142 0.052 17 0 "[ . 1 . 2]" 1
469 1 36 ASN HA 1 36 ASN HD22 1.800 . 5.000 3.507 3.343 3.718 . 0 0 "[ . 1 . 2]" 1
470 1 36 ASN HA 1 37 LEU H 1.800 . 5.000 2.300 2.149 3.156 . 0 0 "[ . 1 . 2]" 1
471 1 36 ASN QB 1 48 ALA MB 1.800 . 5.000 5.007 4.839 5.109 0.109 16 0 "[ . 1 . 2]" 1
472 1 37 LEU H 1 37 LEU HB2 1.800 . 3.500 2.697 2.202 3.561 0.061 12 0 "[ . 1 . 2]" 1
473 1 37 LEU H 1 37 LEU HB3 1.800 . 3.500 3.365 2.604 3.694 0.194 2 0 "[ . 1 . 2]" 1
474 1 37 LEU H 1 37 LEU MD1 1.800 . 5.000 3.510 2.649 4.153 . 0 0 "[ . 1 . 2]" 1
475 1 37 LEU H 1 37 LEU MD2 1.800 . 5.000 3.164 1.638 4.940 0.162 14 0 "[ . 1 . 2]" 1
476 1 37 LEU H 1 38 HIS H 1.800 . 5.000 4.354 3.733 4.607 . 0 0 "[ . 1 . 2]" 1
477 1 37 LEU HA 1 37 LEU MD1 1.800 . 5.000 2.731 2.003 4.118 . 0 0 "[ . 1 . 2]" 1
478 1 37 LEU HA 1 37 LEU MD2 1.800 . 5.000 3.140 2.021 3.802 . 0 0 "[ . 1 . 2]" 1
479 1 37 LEU QB 1 38 HIS HB3 1.800 . 5.000 4.868 4.436 5.218 0.218 6 0 "[ . 1 . 2]" 1
480 1 37 LEU HB2 1 40 ILE MD 1.800 . 5.000 4.209 3.167 5.153 0.153 1 0 "[ . 1 . 2]" 1
481 1 37 LEU HB2 1 40 ILE QG 1.800 . 6.000 4.092 2.139 5.305 . 0 0 "[ . 1 . 2]" 1
482 1 37 LEU HB2 1 40 ILE MG 1.800 . 5.000 4.010 2.020 5.176 0.176 7 0 "[ . 1 . 2]" 1
483 1 37 LEU HB3 1 40 ILE MD 1.800 . 5.000 3.702 2.075 5.105 0.105 3 0 "[ . 1 . 2]" 1
484 1 37 LEU HB3 1 40 ILE QG 1.800 . 6.000 3.463 2.034 4.670 . 0 0 "[ . 1 . 2]" 1
485 1 37 LEU HB3 1 40 ILE MG 1.800 . 5.000 3.389 2.016 5.102 0.102 9 0 "[ . 1 . 2]" 1
486 1 37 LEU QD 2 1 HEC HBA1 1.800 . 5.000 2.156 1.832 2.589 . 0 0 "[ . 1 . 2]" 1
487 1 37 LEU QD 2 1 HEC HHA 1.800 . 5.000 3.704 3.018 4.512 . 0 0 "[ . 1 . 2]" 1
488 1 37 LEU MD1 1 40 ILE H 1.800 . 5.000 4.606 3.576 5.123 0.123 15 0 "[ . 1 . 2]" 1
489 1 37 LEU MD1 1 40 ILE QG 1.800 . 5.000 2.772 1.994 4.218 . 0 0 "[ . 1 . 2]" 1
490 1 37 LEU MD1 1 47 GLN H 1.800 . 6.000 6.080 5.911 6.220 0.220 2 0 "[ . 1 . 2]" 1
491 1 37 LEU MD2 1 40 ILE QG 1.800 . 5.000 3.506 2.131 4.920 . 0 0 "[ . 1 . 2]" 1
492 1 38 HIS H 1 39 GLY QA 1.800 . 5.000 4.613 3.693 5.123 0.123 10 0 "[ . 1 . 2]" 1
493 1 38 HIS HA 1 39 GLY H 1.800 . 5.000 2.309 2.174 3.213 . 0 0 "[ . 1 . 2]" 1
494 1 38 HIS HA 1 40 ILE H 1.800 . 5.000 3.794 3.486 4.274 . 0 0 "[ . 1 . 2]" 1
495 1 38 HIS HA 1 41 PHE QD 1.800 . 5.000 5.077 4.696 5.238 0.238 5 0 "[ . 1 . 2]" 1
496 1 39 GLY H 1 40 ILE HG12 1.800 . 5.000 4.252 3.108 5.148 0.148 7 0 "[ . 1 . 2]" 1
497 1 39 GLY H 1 41 PHE QD 1.800 . 5.000 3.603 3.209 4.747 . 0 0 "[ . 1 . 2]" 1
498 1 39 GLY QA 1 40 ILE H 1.800 . 5.000 2.937 2.811 2.975 . 0 0 "[ . 1 . 2]" 1
499 1 40 ILE H 1 40 ILE HA 1.800 . 2.900 2.895 2.816 2.973 0.073 9 0 "[ . 1 . 2]" 1
500 1 40 ILE H 1 40 ILE MD 1.800 . 5.000 3.556 1.664 3.996 0.136 8 0 "[ . 1 . 2]" 1
501 1 40 ILE H 1 40 ILE QG 1.800 . 5.000 2.341 2.021 3.727 . 0 0 "[ . 1 . 2]" 1
502 1 40 ILE H 1 40 ILE MG 1.800 . 5.000 2.417 1.895 3.781 . 0 0 "[ . 1 . 2]" 1
503 1 40 ILE H 1 41 PHE H 1.800 . 5.000 2.611 2.233 3.712 . 0 0 "[ . 1 . 2]" 1
504 1 40 ILE HA 1 40 ILE HB 1.800 . 2.900 2.503 2.363 3.026 0.126 5 0 "[ . 1 . 2]" 1
505 1 40 ILE HA 1 40 ILE MD 1.800 . 5.000 3.619 2.018 4.131 . 0 0 "[ . 1 . 2]" 1
506 1 40 ILE HA 1 40 ILE QG 1.800 . 3.500 3.260 2.347 3.468 . 0 0 "[ . 1 . 2]" 1
507 1 40 ILE HA 1 40 ILE MG 1.800 . 3.500 2.378 2.236 2.871 . 0 0 "[ . 1 . 2]" 1
508 1 40 ILE HA 1 41 PHE H 1.800 . 5.000 3.406 3.305 3.562 . 0 0 "[ . 1 . 2]" 1
509 1 40 ILE HA 1 43 ARG H 1.800 . 6.000 3.640 3.153 4.375 . 0 0 "[ . 1 . 2]" 1
510 1 40 ILE HA 1 43 ARG QD 1.800 . 6.000 4.661 4.237 5.191 . 0 0 "[ . 1 . 2]" 1
511 1 40 ILE HA 1 43 ARG QG 1.800 . 5.000 2.748 2.171 3.616 . 0 0 "[ . 1 . 2]" 1
512 1 40 ILE HB 1 40 ILE MD 1.800 . 3.500 2.356 2.122 3.203 . 0 0 "[ . 1 . 2]" 1
513 1 40 ILE HB 1 41 PHE H 1.800 . 5.000 3.911 1.934 4.393 . 0 0 "[ . 1 . 2]" 1
514 1 40 ILE HB 1 64 TRP HD1 1.800 . 6.000 3.210 2.311 5.098 . 0 0 "[ . 1 . 2]" 1
515 1 40 ILE MD 1 41 PHE H 1.800 . 5.000 3.846 1.885 4.520 . 0 0 "[ . 1 . 2]" 1
516 1 40 ILE MD 1 64 TRP QB 1.800 . 5.000 3.574 2.314 5.036 0.036 7 0 "[ . 1 . 2]" 1
517 1 40 ILE MD 1 64 TRP HD1 1.800 . 5.000 3.380 2.310 5.034 0.034 8 0 "[ . 1 . 2]" 1
518 1 40 ILE QG 1 40 ILE MG 1.800 . 2.900 2.128 1.935 2.296 . 0 0 "[ . 1 . 2]" 1
519 1 40 ILE QG 1 64 TRP QB 1.800 . 6.000 3.914 3.308 5.343 . 0 0 "[ . 1 . 2]" 1
520 1 40 ILE QG 1 64 TRP HD1 1.800 . 5.000 4.182 2.683 4.866 . 0 0 "[ . 1 . 2]" 1
521 1 40 ILE QG 1 64 TRP HE1 1.800 . 5.000 4.903 3.155 5.099 0.099 4 0 "[ . 1 . 2]" 1
522 1 40 ILE QG 2 1 HEC HAA1 1.800 . 6.000 5.491 4.755 6.059 0.059 19 0 "[ . 1 . 2]" 1
523 1 40 ILE QG 2 1 HEC HBA1 1.800 . 5.000 3.593 2.792 4.144 . 0 0 "[ . 1 . 2]" 1
524 1 40 ILE MG 1 41 PHE H 1.800 . 5.000 3.832 2.429 4.082 . 0 0 "[ . 1 . 2]" 1
525 1 40 ILE MG 1 64 TRP QB 1.800 . 5.000 4.657 2.497 5.164 0.164 1 0 "[ . 1 . 2]" 1
526 1 40 ILE MG 1 64 TRP HD1 1.800 . 5.000 3.998 2.061 4.648 . 0 0 "[ . 1 . 2]" 1
527 1 41 PHE H 1 41 PHE HB2 1.800 . 3.500 2.378 2.144 3.327 . 0 0 "[ . 1 . 2]" 1
528 1 41 PHE HA 1 41 PHE QD 1.800 . 5.000 2.969 2.667 3.096 . 0 0 "[ . 1 . 2]" 1
529 1 41 PHE HA 1 42 GLY H 1.800 . 5.000 3.093 2.198 3.533 . 0 0 "[ . 1 . 2]" 1
530 1 41 PHE QB 1 41 PHE QD 1.800 . 2.900 2.161 2.154 2.186 . 0 0 "[ . 1 . 2]" 1
531 1 41 PHE HB2 1 41 PHE QE 1.800 . 5.000 4.498 4.444 4.526 . 0 0 "[ . 1 . 2]" 1
532 1 41 PHE HB2 1 42 GLY H 1.800 . 5.000 3.510 2.913 4.432 . 0 0 "[ . 1 . 2]" 1
533 1 41 PHE HB3 1 41 PHE QE 1.800 . 5.000 4.418 4.405 4.446 . 0 0 "[ . 1 . 2]" 1
534 1 41 PHE HB3 1 42 GLY H 1.800 . 5.000 3.638 3.373 4.072 . 0 0 "[ . 1 . 2]" 1
535 1 41 PHE QD 1 66 GLU H 1.800 . 5.000 3.868 3.588 4.618 . 0 0 "[ . 1 . 2]" 1
536 1 41 PHE QD 1 66 GLU HA 1.800 . 5.000 3.137 2.667 4.000 . 0 0 "[ . 1 . 2]" 1
537 1 41 PHE QD 1 66 GLU QG 1.800 . 3.500 2.464 2.212 3.361 . 0 0 "[ . 1 . 2]" 1
538 1 41 PHE QD 1 69 MET HB2 1.800 . 5.000 4.537 4.325 4.944 . 0 0 "[ . 1 . 2]" 1
539 1 41 PHE QD 1 69 MET HB3 1.800 . 5.000 5.159 5.102 5.209 0.209 9 0 "[ . 1 . 2]" 1
540 1 41 PHE QD 1 69 MET ME 1.800 . 3.500 3.462 2.815 3.592 0.092 7 0 "[ . 1 . 2]" 1
541 1 41 PHE QD 1 103 LEU MD1 1.800 . 5.000 4.652 4.284 4.967 . 0 0 "[ . 1 . 2]" 1
542 1 41 PHE QD 1 103 LEU MD2 1.800 . 5.000 4.922 4.546 5.087 0.087 10 0 "[ . 1 . 2]" 1
543 1 41 PHE QD 1 104 LYS HA 1.800 . 5.000 4.179 3.719 4.515 . 0 0 "[ . 1 . 2]" 1
544 1 41 PHE QD 1 104 LYS QG 1.800 . 5.000 4.455 4.057 4.914 . 0 0 "[ . 1 . 2]" 1
545 1 41 PHE QE 1 66 GLU H 1.800 . 5.000 4.999 4.821 5.062 0.062 5 0 "[ . 1 . 2]" 1
546 1 41 PHE QE 1 66 GLU HA 1.800 . 2.900 2.776 2.655 2.917 0.017 10 0 "[ . 1 . 2]" 1
547 1 41 PHE QE 1 66 GLU QB 1.800 . 5.000 3.265 3.100 3.334 . 0 0 "[ . 1 . 2]" 1
548 1 41 PHE QE 1 66 GLU QG 1.800 . 3.500 2.841 2.261 3.311 . 0 0 "[ . 1 . 2]" 1
549 1 41 PHE QE 1 69 MET HB2 1.800 . 5.000 3.648 3.303 4.142 . 0 0 "[ . 1 . 2]" 1
550 1 41 PHE QE 1 69 MET HB3 1.800 . 5.000 4.097 3.795 4.284 . 0 0 "[ . 1 . 2]" 1
551 1 41 PHE QE 1 69 MET ME 1.800 . 3.500 2.744 2.217 3.085 . 0 0 "[ . 1 . 2]" 1
552 1 41 PHE QE 1 69 MET QG 1.800 . 5.000 4.140 3.160 4.449 . 0 0 "[ . 1 . 2]" 1
553 1 41 PHE QE 1 100 ILE MG 1.800 . 5.000 2.362 2.014 2.876 . 0 0 "[ . 1 . 2]" 1
554 1 41 PHE QE 1 103 LEU H 1.800 . 6.000 5.394 5.186 5.675 . 0 0 "[ . 1 . 2]" 1
555 1 41 PHE QE 1 103 LEU MD1 1.800 . 5.000 2.662 2.249 3.102 . 0 0 "[ . 1 . 2]" 1
556 1 41 PHE QE 1 103 LEU MD2 1.800 . 5.000 3.315 3.130 3.757 . 0 0 "[ . 1 . 2]" 1
557 1 41 PHE QE 1 104 LYS H 1.800 . 6.000 4.157 3.916 4.269 . 0 0 "[ . 1 . 2]" 1
558 1 41 PHE QE 1 104 LYS HA 1.800 . 6.000 4.042 3.308 4.398 . 0 0 "[ . 1 . 2]" 1
559 1 41 PHE QE 1 104 LYS HB2 1.800 . 5.000 3.543 3.411 3.640 . 0 0 "[ . 1 . 2]" 1
560 1 41 PHE QE 1 104 LYS HB3 1.800 . 5.000 5.124 5.029 5.170 0.170 16 0 "[ . 1 . 2]" 1
561 1 41 PHE QE 1 104 LYS QD 1.800 . 6.000 4.906 4.409 5.114 . 0 0 "[ . 1 . 2]" 1
562 1 41 PHE HZ 1 66 GLU HA 1.800 . 5.000 4.936 4.354 5.053 0.053 13 0 "[ . 1 . 2]" 1
563 1 41 PHE HZ 1 69 MET HB2 1.800 . 5.000 4.452 3.696 4.727 . 0 0 "[ . 1 . 2]" 1
564 1 41 PHE HZ 1 69 MET HB3 1.800 . 5.000 4.131 3.233 4.439 . 0 0 "[ . 1 . 2]" 1
565 1 41 PHE HZ 1 69 MET ME 1.800 . 3.500 3.257 2.760 3.554 0.054 8 0 "[ . 1 . 2]" 1
566 1 41 PHE HZ 1 100 ILE QG 1.800 . 6.000 3.304 2.807 3.732 . 0 0 "[ . 1 . 2]" 1
567 1 41 PHE HZ 1 100 ILE MG 1.800 . 5.000 3.084 2.672 3.745 . 0 0 "[ . 1 . 2]" 1
568 1 41 PHE HZ 1 103 LEU QB 1.800 . 5.000 2.157 2.025 2.615 . 0 0 "[ . 1 . 2]" 1
569 1 41 PHE HZ 1 103 LEU MD1 1.800 . 5.000 2.241 2.028 2.492 . 0 0 "[ . 1 . 2]" 1
570 1 41 PHE HZ 1 103 LEU MD2 1.800 . 5.000 3.976 3.592 4.539 . 0 0 "[ . 1 . 2]" 1
571 1 41 PHE HZ 1 104 LYS H 1.800 . 6.000 4.189 3.962 4.433 . 0 0 "[ . 1 . 2]" 1
572 1 41 PHE HZ 1 104 LYS HA 1.800 . 6.000 4.958 4.624 5.256 . 0 0 "[ . 1 . 2]" 1
573 1 42 GLY H 1 43 ARG H 1.800 . 3.500 2.541 1.730 2.852 0.070 9 0 "[ . 1 . 2]" 1
574 1 42 GLY H 1 63 LEU QD 1.800 . 5.000 4.660 3.823 5.044 0.044 19 0 "[ . 1 . 2]" 1
575 1 42 GLY H 1 64 TRP HB2 1.800 . 5.000 3.653 2.449 4.373 . 0 0 "[ . 1 . 2]" 1
576 1 42 GLY H 1 64 TRP HB3 1.800 . 5.000 4.136 2.597 5.045 0.045 19 0 "[ . 1 . 2]" 1
577 1 42 GLY QA 1 44 HIS H 1.800 . 6.000 6.005 5.943 6.048 0.048 19 0 "[ . 1 . 2]" 1
578 1 42 GLY QA 1 63 LEU MD1 1.800 . 5.000 3.051 2.712 3.267 . 0 0 "[ . 1 . 2]" 1
579 1 42 GLY QA 1 63 LEU MD2 1.800 . 5.000 4.122 3.394 4.499 . 0 0 "[ . 1 . 2]" 1
580 1 42 GLY HA2 1 43 ARG H 1.800 . 3.500 3.010 2.890 3.210 . 0 0 "[ . 1 . 2]" 1
581 1 42 GLY HA3 1 43 ARG H 1.800 . 3.500 3.497 3.386 3.554 0.054 15 0 "[ . 1 . 2]" 1
582 1 43 ARG H 1 43 ARG QB 1.800 . 3.500 2.626 2.473 2.691 . 0 0 "[ . 1 . 2]" 1
583 1 43 ARG H 1 43 ARG QD 1.800 . 5.000 4.387 4.216 4.836 . 0 0 "[ . 1 . 2]" 1
584 1 43 ARG H 1 43 ARG QG 1.800 . 5.000 3.264 2.942 4.262 . 0 0 "[ . 1 . 2]" 1
585 1 43 ARG H 1 63 LEU QD 1.800 . 3.500 3.269 2.945 3.456 . 0 0 "[ . 1 . 2]" 1
586 1 43 ARG H 1 64 TRP QB 1.800 . 5.000 2.183 1.749 2.626 0.051 7 0 "[ . 1 . 2]" 1
587 1 43 ARG H 1 64 TRP HD1 1.800 . 3.500 3.472 3.004 3.631 0.131 13 0 "[ . 1 . 2]" 1
588 1 43 ARG QB 1 43 ARG QD 1.800 . 5.000 2.294 2.167 2.924 . 0 0 "[ . 1 . 2]" 1
589 1 43 ARG QB 1 43 ARG QG 1.800 . 3.500 2.039 2.021 2.045 . 0 0 "[ . 1 . 2]" 1
590 1 43 ARG QB 1 44 HIS H 1.800 . 3.500 2.463 2.170 3.314 . 0 0 "[ . 1 . 2]" 1
591 1 43 ARG QB 1 47 GLN H 1.800 . 6.000 4.466 4.098 5.318 . 0 0 "[ . 1 . 2]" 1
592 1 43 ARG QB 1 64 TRP HD1 1.800 . 6.000 3.201 2.931 3.347 . 0 0 "[ . 1 . 2]" 1
593 1 43 ARG QD 1 44 HIS HE1 1.800 . 6.000 6.037 5.582 6.134 0.134 12 0 "[ . 1 . 2]" 1
594 1 43 ARG QD 1 47 GLN HB2 1.800 . 3.500 3.542 3.441 3.582 0.082 8 0 "[ . 1 . 2]" 1
595 1 43 ARG QD 1 47 GLN HB3 1.800 . 3.500 3.464 3.233 3.549 0.049 17 0 "[ . 1 . 2]" 1
596 1 43 ARG QD 1 47 GLN QG 1.800 . 5.000 4.405 4.154 4.637 . 0 0 "[ . 1 . 2]" 1
597 1 43 ARG QG 1 47 GLN H 1.800 . 6.000 5.604 3.971 6.130 0.130 16 0 "[ . 1 . 2]" 1
598 1 43 ARG QG 1 64 TRP HD1 1.800 . 5.000 4.823 3.926 5.113 0.113 11 0 "[ . 1 . 2]" 1
599 1 44 HIS H 1 45 SER H 1.800 . 5.000 4.603 4.571 4.638 . 0 0 "[ . 1 . 2]" 1
600 1 44 HIS H 1 47 GLN QB 1.800 . 3.500 3.344 2.922 3.579 0.079 10 0 "[ . 1 . 2]" 1
601 1 44 HIS H 1 47 GLN QE 1.800 . 5.000 3.170 2.196 3.807 . 0 0 "[ . 1 . 2]" 1
602 1 44 HIS H 1 63 LEU QD 1.800 . 5.000 3.778 3.393 4.009 . 0 0 "[ . 1 . 2]" 1
603 1 44 HIS HA 1 63 LEU MD1 1.800 . 5.000 3.514 3.463 3.606 . 0 0 "[ . 1 . 2]" 1
604 1 44 HIS HA 1 63 LEU MD2 1.800 . 6.000 5.627 5.581 5.670 . 0 0 "[ . 1 . 2]" 1
605 1 44 HIS QB 1 45 SER H 1.800 . 5.000 2.861 2.483 3.040 . 0 0 "[ . 1 . 2]" 1
606 1 44 HIS QB 1 47 GLN QE 1.800 . 5.000 2.668 2.267 3.318 . 0 0 "[ . 1 . 2]" 1
607 1 44 HIS QB 1 61 ASN HA 1.800 . 5.000 3.832 3.314 4.487 . 0 0 "[ . 1 . 2]" 1
608 1 44 HIS QB 1 63 LEU QD 1.800 . 5.000 4.219 4.046 4.327 . 0 0 "[ . 1 . 2]" 1
609 1 44 HIS HB2 1 44 HIS HE1 1.800 . 5.000 4.878 4.821 4.927 . 0 0 "[ . 1 . 2]" 1
610 1 44 HIS HB2 1 47 GLN H 1.800 . 5.000 4.917 4.760 5.090 0.090 13 0 "[ . 1 . 2]" 1
611 1 44 HIS HB3 1 47 GLN H 1.800 . 5.000 5.084 4.970 5.156 0.156 6 0 "[ . 1 . 2]" 1
612 1 44 HIS HD1 1 62 VAL HA 1.800 . 6.000 6.134 6.094 6.166 0.166 16 0 "[ . 1 . 2]" 1
613 1 44 HIS HD1 1 63 LEU H 1.800 . 5.000 4.998 4.930 5.028 0.028 12 0 "[ . 1 . 2]" 1
614 1 44 HIS HD1 1 63 LEU QB 1.800 . 5.000 3.875 3.719 4.016 . 0 0 "[ . 1 . 2]" 1
615 1 44 HIS HD1 1 63 LEU MD1 1.800 . 5.000 2.453 2.309 2.754 . 0 0 "[ . 1 . 2]" 1
616 1 44 HIS HD1 1 63 LEU MD2 1.800 . 5.000 4.784 4.608 5.005 0.005 3 0 "[ . 1 . 2]" 1
617 1 44 HIS HD2 1 61 ASN HA 1.800 . 5.000 4.868 4.412 5.060 0.060 12 0 "[ . 1 . 2]" 1
618 1 44 HIS HD2 1 62 VAL HA 1.800 . 5.000 2.910 2.402 3.241 . 0 0 "[ . 1 . 2]" 1
619 1 44 HIS HD2 1 63 LEU H 1.800 . 3.500 3.249 2.537 3.516 0.016 1 0 "[ . 1 . 2]" 1
620 1 44 HIS HD2 1 63 LEU HA 1.800 . 5.000 4.120 3.792 4.419 . 0 0 "[ . 1 . 2]" 1
621 1 44 HIS HD2 1 63 LEU QB 1.800 . 5.000 4.192 3.736 4.325 . 0 0 "[ . 1 . 2]" 1
622 1 44 HIS HD2 1 63 LEU MD1 1.800 . 5.000 4.801 4.646 4.875 . 0 0 "[ . 1 . 2]" 1
623 1 44 HIS HD2 1 63 LEU MD2 1.800 . 6.000 6.025 5.668 6.094 0.094 6 0 "[ . 1 . 2]" 1
624 1 44 HIS HE1 1 63 LEU QB 1.800 . 5.000 2.718 2.575 2.859 . 0 0 "[ . 1 . 2]" 1
625 1 44 HIS HE1 1 63 LEU MD1 1.800 . 5.000 2.296 2.244 2.526 . 0 0 "[ . 1 . 2]" 1
626 1 44 HIS HE1 1 63 LEU MD2 1.800 . 5.000 3.541 3.365 3.732 . 0 0 "[ . 1 . 2]" 1
627 1 45 SER H 1 45 SER HB3 1.800 . 3.500 3.215 2.810 3.570 0.070 12 0 "[ . 1 . 2]" 1
628 1 45 SER H 1 61 ASN HA 1.800 . 5.000 3.306 2.959 3.628 . 0 0 "[ . 1 . 2]" 1
629 1 45 SER H 1 62 VAL H 1.800 . 5.000 1.922 1.756 2.157 0.044 19 0 "[ . 1 . 2]" 1
630 1 45 SER H 1 62 VAL MG1 1.800 . 5.000 4.686 4.487 4.954 . 0 0 "[ . 1 . 2]" 1
631 1 45 SER H 1 62 VAL MG2 1.800 . 5.000 4.443 4.184 4.779 . 0 0 "[ . 1 . 2]" 1
632 1 45 SER HA 1 46 GLY H 1.800 . 5.000 2.200 2.162 2.221 . 0 0 "[ . 1 . 2]" 1
633 1 45 SER HA 1 61 ASN QB 1.800 . 5.000 4.740 4.234 5.044 0.044 20 0 "[ . 1 . 2]" 1
634 1 45 SER HA 1 64 TRP HD1 1.800 . 5.000 3.367 3.100 3.692 . 0 0 "[ . 1 . 2]" 1
635 1 45 SER HA 1 64 TRP HE1 1.800 . 5.000 1.800 1.714 2.098 0.086 11 0 "[ . 1 . 2]" 1
636 1 45 SER HB2 1 46 GLY H 1.800 . 5.000 4.352 4.219 4.481 . 0 0 "[ . 1 . 2]" 1
637 1 45 SER HB2 1 57 ASN QD 1.800 . 5.000 5.071 4.885 5.150 0.150 13 0 "[ . 1 . 2]" 1
638 1 45 SER HB2 1 61 ASN HB2 1.800 . 5.000 4.517 3.626 5.136 0.136 9 0 "[ . 1 . 2]" 1
639 1 45 SER HB2 1 61 ASN HB3 1.800 . 5.000 4.763 4.408 5.077 0.077 10 0 "[ . 1 . 2]" 1
640 1 45 SER HB2 1 62 VAL H 1.800 . 5.000 2.048 1.758 2.827 0.042 16 0 "[ . 1 . 2]" 1
641 1 45 SER HB2 1 62 VAL QG 1.800 . 5.000 3.686 3.246 4.431 . 0 0 "[ . 1 . 2]" 1
642 1 45 SER HB2 1 64 TRP HE1 1.800 . 5.000 3.171 1.991 3.743 . 0 0 "[ . 1 . 2]" 1
643 1 45 SER HB2 1 64 TRP HZ2 1.800 . 5.000 3.533 2.473 4.235 . 0 0 "[ . 1 . 2]" 1
644 1 45 SER HB3 1 46 GLY H 1.800 . 5.000 3.534 3.128 3.796 . 0 0 "[ . 1 . 2]" 1
645 1 45 SER HB3 1 57 ASN QD 1.800 . 5.000 3.941 3.297 4.453 . 0 0 "[ . 1 . 2]" 1
646 1 45 SER HB3 1 61 ASN HB2 1.800 . 5.000 4.510 3.205 5.077 0.077 2 0 "[ . 1 . 2]" 1
647 1 45 SER HB3 1 61 ASN HB3 1.800 . 5.000 4.288 3.624 5.128 0.128 12 0 "[ . 1 . 2]" 1
648 1 45 SER HB3 1 62 VAL H 1.800 . 5.000 3.047 2.661 3.789 . 0 0 "[ . 1 . 2]" 1
649 1 45 SER HB3 1 62 VAL QG 1.800 . 5.000 4.378 3.902 5.037 0.037 7 0 "[ . 1 . 2]" 1
650 1 45 SER HB3 1 64 TRP HE1 1.800 . 5.000 3.794 3.307 4.355 . 0 0 "[ . 1 . 2]" 1
651 1 45 SER HB3 1 64 TRP HZ2 1.800 . 5.000 4.088 3.609 4.430 . 0 0 "[ . 1 . 2]" 1
652 1 46 GLY H 1 46 GLY HA2 1.800 . 2.900 2.428 2.392 2.459 . 0 0 "[ . 1 . 2]" 1
653 1 46 GLY H 1 46 GLY HA3 1.800 . 2.900 2.970 2.955 2.983 0.083 9 0 "[ . 1 . 2]" 1
654 1 46 GLY H 1 47 GLN H 1.800 . 5.000 2.371 2.272 2.491 . 0 0 "[ . 1 . 2]" 1
655 1 46 GLY H 1 57 ASN HD21 1.800 . 5.000 4.591 4.225 5.030 0.030 7 0 "[ . 1 . 2]" 1
656 1 46 GLY H 1 57 ASN HD22 1.800 . 5.000 3.369 2.908 4.123 . 0 0 "[ . 1 . 2]" 1
657 1 46 GLY H 1 64 TRP HD1 1.800 . 5.000 5.149 5.092 5.232 0.232 3 0 "[ . 1 . 2]" 1
658 1 46 GLY QA 1 47 GLN H 1.800 . 3.500 2.944 2.914 2.961 . 0 0 "[ . 1 . 2]" 1
659 1 46 GLY QA 1 48 ALA H 1.800 . 5.000 4.974 3.349 5.114 0.114 20 0 "[ . 1 . 2]" 1
660 1 46 GLY QA 1 53 TYR QB 1.800 . 5.000 2.200 2.139 2.490 . 0 0 "[ . 1 . 2]" 1
661 1 46 GLY QA 1 58 ILE HA 1.800 . 5.000 2.320 2.188 2.636 . 0 0 "[ . 1 . 2]" 1
662 1 46 GLY QA 1 58 ILE HG12 1.800 . 5.000 2.521 2.180 2.798 . 0 0 "[ . 1 . 2]" 1
663 1 46 GLY QA 1 58 ILE HG13 1.800 . 5.000 3.308 3.136 3.493 . 0 0 "[ . 1 . 2]" 1
664 1 46 GLY QA 1 58 ILE MG 1.800 . 5.000 3.149 2.702 3.556 . 0 0 "[ . 1 . 2]" 1
665 1 47 GLN H 1 47 GLN HG2 1.800 . 5.000 3.788 3.649 3.885 . 0 0 "[ . 1 . 2]" 1
666 1 47 GLN H 1 47 GLN HG3 1.800 . 5.000 2.631 2.553 2.799 . 0 0 "[ . 1 . 2]" 1
667 1 47 GLN H 1 48 ALA H 1.800 . 5.000 4.290 2.586 4.420 . 0 0 "[ . 1 . 2]" 1
668 1 47 GLN HA 1 47 GLN HG2 1.800 . 3.500 2.427 2.339 2.476 . 0 0 "[ . 1 . 2]" 1
669 1 47 GLN HA 1 47 GLN HG3 1.800 . 3.500 2.982 2.930 3.130 . 0 0 "[ . 1 . 2]" 1
670 1 47 GLN QG 1 53 TYR H 1.800 . 6.000 6.158 6.090 6.241 0.241 1 0 "[ . 1 . 2]" 1
671 1 48 ALA H 1 48 ALA HA 1.800 . 2.900 2.948 2.826 2.985 0.085 20 0 "[ . 1 . 2]" 1
672 1 48 ALA H 1 48 ALA MB 1.800 . 2.900 2.584 2.086 2.766 . 0 0 "[ . 1 . 2]" 1
673 1 48 ALA HA 1 49 GLU H 1.800 . 5.000 2.302 2.187 2.708 . 0 0 "[ . 1 . 2]" 1
674 1 48 ALA MB 1 49 GLU H 1.800 . 3.500 2.914 2.141 3.452 . 0 0 "[ . 1 . 2]" 1
675 1 48 ALA MB 1 53 TYR H 1.800 . 3.500 3.274 2.816 3.517 0.017 16 0 "[ . 1 . 2]" 1
676 1 49 GLU H 1 51 TYR HA 1.800 . 6.300 6.476 6.346 6.541 0.241 20 0 "[ . 1 . 2]" 1
677 1 49 GLU HA 1 49 GLU HG2 1.800 . 3.500 2.672 2.427 3.535 0.035 12 0 "[ . 1 . 2]" 1
678 1 49 GLU HA 1 49 GLU HG3 1.800 . 3.500 2.937 2.297 3.671 0.171 11 0 "[ . 1 . 2]" 1
679 1 49 GLU QB 1 50 GLY H 1.800 . 5.000 2.563 2.297 2.698 . 0 0 "[ . 1 . 2]" 1
680 1 50 GLY H 1 50 GLY HA2 1.800 . 2.900 2.857 2.352 2.986 0.086 14 0 "[ . 1 . 2]" 1
681 1 50 GLY H 1 50 GLY HA3 1.800 . 2.900 2.394 2.340 2.884 . 0 0 "[ . 1 . 2]" 1
682 1 50 GLY QA 1 51 TYR H 1.800 . 5.000 2.578 2.419 2.747 . 0 0 "[ . 1 . 2]" 1
683 1 51 TYR HA 1 51 TYR HD1 1.800 . 5.000 2.306 2.259 2.576 . 0 0 "[ . 1 . 2]" 1
684 1 51 TYR HA 1 51 TYR HD2 1.800 . 5.000 4.661 4.582 4.692 . 0 0 "[ . 1 . 2]" 1
685 1 51 TYR HA 1 51 TYR QE 1.800 . 5.000 4.560 4.495 4.728 . 0 0 "[ . 1 . 2]" 1
686 1 51 TYR HA 1 53 TYR H 1.800 . 6.000 6.171 6.070 6.282 0.282 2 0 "[ . 1 . 2]" 1
687 1 51 TYR QD 2 1 HEC HAD1 1.800 . 6.000 6.002 5.631 6.186 0.186 6 0 "[ . 1 . 2]" 1
688 1 51 TYR HD2 1 53 TYR H 1.800 . 6.000 5.950 5.516 6.196 0.196 20 0 "[ . 1 . 2]" 1
689 1 51 TYR QE 1 84 LYS HE3 1.800 . 5.000 4.935 3.798 5.067 0.067 9 0 "[ . 1 . 2]" 1
690 1 51 TYR HE1 1 53 TYR H 1.800 . 6.000 5.976 5.763 6.088 0.088 10 0 "[ . 1 . 2]" 1
691 1 51 TYR HE2 1 53 TYR H 1.800 . 6.000 5.859 5.507 6.019 0.019 20 0 "[ . 1 . 2]" 1
692 1 52 SER HA 1 53 TYR H 1.800 . 5.000 2.264 2.201 2.358 . 0 0 "[ . 1 . 2]" 1
693 1 52 SER QB 1 53 TYR H 1.800 . 5.000 2.986 2.636 3.707 . 0 0 "[ . 1 . 2]" 1
694 1 53 TYR H 1 53 TYR HB2 1.800 . 3.500 2.454 2.358 2.610 . 0 0 "[ . 1 . 2]" 1
695 1 53 TYR H 1 53 TYR HB3 1.800 . 3.500 3.601 3.583 3.624 0.124 7 0 "[ . 1 . 2]" 1
696 1 53 TYR H 1 54 THR H 1.800 . 5.000 4.568 4.466 4.644 . 0 0 "[ . 1 . 2]" 1
697 1 53 TYR HA 1 53 TYR QD 1.800 . 5.000 2.939 2.095 3.131 . 0 0 "[ . 1 . 2]" 1
698 1 53 TYR QB 1 58 ILE HB 1.800 . 5.000 4.559 4.447 4.842 . 0 0 "[ . 1 . 2]" 1
699 1 53 TYR QB 1 58 ILE HG12 1.800 . 3.500 2.611 2.353 2.947 . 0 0 "[ . 1 . 2]" 1
700 1 53 TYR QB 1 58 ILE HG13 1.800 . 3.500 2.294 2.211 2.655 . 0 0 "[ . 1 . 2]" 1
701 1 53 TYR QB 1 58 ILE MG 1.800 . 5.000 4.344 4.186 4.596 . 0 0 "[ . 1 . 2]" 1
702 1 53 TYR HB2 1 53 TYR QD 1.800 . 3.500 2.504 2.319 2.634 . 0 0 "[ . 1 . 2]" 1
703 1 53 TYR HB3 1 53 TYR QD 1.800 . 3.500 2.378 2.291 2.793 . 0 0 "[ . 1 . 2]" 1
704 1 53 TYR QD 1 54 THR H 1.800 . 5.000 3.609 3.371 4.145 . 0 0 "[ . 1 . 2]" 1
705 1 53 TYR QD 1 57 ASN QB 1.800 . 5.000 3.712 3.501 4.064 . 0 0 "[ . 1 . 2]" 1
706 1 53 TYR QD 1 57 ASN QD 1.800 . 5.000 2.031 1.744 2.857 0.056 2 0 "[ . 1 . 2]" 1
707 1 53 TYR QD 1 58 ILE MD 1.800 . 5.000 4.126 3.793 4.808 . 0 0 "[ . 1 . 2]" 1
708 1 53 TYR QD 1 58 ILE QG 1.800 . 5.000 3.435 3.262 3.832 . 0 0 "[ . 1 . 2]" 1
709 1 54 THR H 1 54 THR MG 1.800 . 5.000 3.771 3.754 3.782 . 0 0 "[ . 1 . 2]" 1
710 1 54 THR HA 1 54 THR MG 1.800 . 3.500 2.311 2.229 2.368 . 0 0 "[ . 1 . 2]" 1
711 1 54 THR HA 1 55 ASP H 1.800 . 3.500 2.297 2.275 2.330 . 0 0 "[ . 1 . 2]" 1
712 1 54 THR HB 1 56 ALA H 1.800 . 5.000 3.324 3.187 3.472 . 0 0 "[ . 1 . 2]" 1
713 1 54 THR HB 1 57 ASN QD 1.800 . 5.000 4.611 4.079 4.851 . 0 0 "[ . 1 . 2]" 1
714 1 54 THR MG 1 56 ALA H 1.800 . 5.000 1.935 1.795 2.218 0.005 2 0 "[ . 1 . 2]" 1
715 1 54 THR MG 1 83 THR HA 1.800 . 5.000 4.359 3.149 5.014 0.014 7 0 "[ . 1 . 2]" 1
716 1 54 THR MG 1 84 LYS H 1.800 . 5.000 4.374 3.425 5.048 0.048 7 0 "[ . 1 . 2]" 1
717 1 54 THR MG 1 84 LYS QE 1.800 . 5.000 2.330 1.957 3.369 . 0 0 "[ . 1 . 2]" 1
718 1 55 ASP H 1 55 ASP HA 1.800 . 2.900 2.792 2.780 2.804 . 0 0 "[ . 1 . 2]" 1
719 1 55 ASP H 1 55 ASP HB2 1.800 . 3.500 2.518 2.396 3.605 0.105 2 0 "[ . 1 . 2]" 1
720 1 55 ASP H 1 55 ASP HB3 1.800 . 3.500 3.286 2.440 3.606 0.106 20 0 "[ . 1 . 2]" 1
721 1 55 ASP H 1 56 ALA H 1.800 . 2.900 2.875 2.843 2.911 0.011 6 0 "[ . 1 . 2]" 1
722 1 55 ASP H 1 57 ASN H 1.800 . 5.000 4.591 4.364 4.764 . 0 0 "[ . 1 . 2]" 1
723 1 55 ASP HA 1 56 ALA H 1.800 . 5.000 3.563 3.554 3.574 . 0 0 "[ . 1 . 2]" 1
724 1 55 ASP HA 1 57 ASN H 1.800 . 5.000 4.762 4.600 4.880 . 0 0 "[ . 1 . 2]" 1
725 1 55 ASP HA 1 58 ILE H 1.800 . 5.000 3.498 3.423 3.559 . 0 0 "[ . 1 . 2]" 1
726 1 55 ASP HA 1 58 ILE HB 1.800 . 5.000 2.417 2.282 2.649 . 0 0 "[ . 1 . 2]" 1
727 1 55 ASP HA 1 58 ILE MG 1.800 . 5.000 3.785 3.643 4.004 . 0 0 "[ . 1 . 2]" 1
728 1 55 ASP HA 1 59 LYS H 1.800 . 5.000 3.907 3.675 4.227 . 0 0 "[ . 1 . 2]" 1
729 1 55 ASP HB2 1 56 ALA H 1.800 . 5.000 3.104 2.673 3.880 . 0 0 "[ . 1 . 2]" 1
730 1 55 ASP HB3 1 56 ALA H 1.800 . 5.000 3.356 2.575 3.891 . 0 0 "[ . 1 . 2]" 1
731 1 56 ALA H 1 56 ALA MB 1.800 . 2.900 2.145 2.050 2.257 . 0 0 "[ . 1 . 2]" 1
732 1 56 ALA H 1 58 ILE H 1.800 . 5.000 4.023 3.958 4.092 . 0 0 "[ . 1 . 2]" 1
733 1 56 ALA HA 1 57 ASN H 1.800 . 3.500 3.568 3.550 3.577 0.077 19 0 "[ . 1 . 2]" 1
734 1 56 ALA HA 1 58 ILE H 1.800 . 5.000 4.499 4.436 4.545 . 0 0 "[ . 1 . 2]" 1
735 1 56 ALA HA 1 59 LYS H 1.800 . 5.000 3.428 3.310 3.520 . 0 0 "[ . 1 . 2]" 1
736 1 56 ALA HA 1 59 LYS HB2 1.800 . 3.500 3.120 2.867 3.354 . 0 0 "[ . 1 . 2]" 1
737 1 56 ALA HA 1 59 LYS HB3 1.800 . 3.500 3.048 2.674 3.237 . 0 0 "[ . 1 . 2]" 1
738 1 56 ALA HA 1 60 LYS H 1.800 . 5.000 4.637 3.965 4.827 . 0 0 "[ . 1 . 2]" 1
739 1 56 ALA MB 1 57 ASN H 1.800 . 2.900 2.330 2.155 2.521 . 0 0 "[ . 1 . 2]" 1
740 1 56 ALA MB 1 80 ILE MG 1.800 . 5.000 4.758 4.078 5.067 0.067 4 0 "[ . 1 . 2]" 1
741 1 56 ALA MB 1 82 GLY QA 1.800 . 5.000 2.714 1.876 5.012 0.012 2 0 "[ . 1 . 2]" 1
742 1 56 ALA MB 1 83 THR H 1.800 . 6.000 4.222 3.636 5.338 . 0 0 "[ . 1 . 2]" 1
743 1 56 ALA MB 1 83 THR HA 1.800 . 5.000 3.400 2.295 4.313 . 0 0 "[ . 1 . 2]" 1
744 1 56 ALA MB 1 83 THR HB 1.800 . 6.000 5.280 4.250 6.034 0.034 11 0 "[ . 1 . 2]" 1
745 1 57 ASN H 1 57 ASN QB 1.800 . 2.900 2.264 2.244 2.282 . 0 0 "[ . 1 . 2]" 1
746 1 57 ASN H 1 58 ILE H 1.800 . 5.000 2.729 2.698 2.756 . 0 0 "[ . 1 . 2]" 1
747 1 57 ASN H 1 59 LYS H 1.800 . 5.000 4.083 3.990 4.153 . 0 0 "[ . 1 . 2]" 1
748 1 57 ASN H 1 80 ILE MG 1.800 . 5.000 4.857 4.090 5.068 0.068 3 0 "[ . 1 . 2]" 1
749 1 57 ASN HA 1 58 ILE H 1.800 . 3.500 3.552 3.546 3.557 0.057 16 0 "[ . 1 . 2]" 1
750 1 57 ASN HA 1 59 LYS H 1.800 . 5.000 4.286 4.171 4.572 . 0 0 "[ . 1 . 2]" 1
751 1 57 ASN HA 1 60 LYS HB2 1.800 . 5.000 4.311 3.342 5.077 0.077 5 0 "[ . 1 . 2]" 1
752 1 57 ASN HA 1 60 LYS HB3 1.800 . 5.000 4.438 3.852 5.099 0.099 10 0 "[ . 1 . 2]" 1
753 1 57 ASN HA 1 80 ILE MD 1.800 . 5.000 3.870 3.013 4.931 . 0 0 "[ . 1 . 2]" 1
754 1 57 ASN HA 1 80 ILE MG 1.800 . 5.000 2.555 2.237 2.767 . 0 0 "[ . 1 . 2]" 1
755 1 57 ASN HA 1 83 THR HB 1.800 . 5.000 4.912 3.861 5.134 0.134 20 0 "[ . 1 . 2]" 1
756 1 57 ASN QB 1 58 ILE QG 1.800 . 5.000 3.074 2.926 3.214 . 0 0 "[ . 1 . 2]" 1
757 1 57 ASN QB 1 80 ILE MG 1.800 . 5.000 3.622 2.635 4.089 . 0 0 "[ . 1 . 2]" 1
758 1 57 ASN QB 1 83 THR HA 1.800 . 5.000 3.089 2.229 4.143 . 0 0 "[ . 1 . 2]" 1
759 1 57 ASN QB 1 83 THR HB 1.800 . 5.000 4.134 3.000 4.760 . 0 0 "[ . 1 . 2]" 1
760 1 57 ASN QD 1 64 TRP HE1 1.800 . 5.000 4.857 4.662 5.050 0.050 10 0 "[ . 1 . 2]" 1
761 1 57 ASN QD 1 80 ILE MD 1.800 . 5.000 3.155 2.172 5.021 0.021 20 0 "[ . 1 . 2]" 1
762 1 57 ASN QD 2 1 HEC HAD1 1.800 . 3.500 3.595 3.265 3.720 0.220 2 0 "[ . 1 . 2]" 1
763 1 57 ASN QD 2 1 HEC HAD2 1.800 . 3.500 3.214 2.752 3.643 0.143 4 0 "[ . 1 . 2]" 1
764 1 57 ASN HD21 2 1 HEC HAA1 1.800 . 5.000 4.392 3.272 4.849 . 0 0 "[ . 1 . 2]" 1
765 1 57 ASN HD22 1 58 ILE QG 1.800 . 5.000 5.126 5.070 5.164 0.164 13 0 "[ . 1 . 2]" 1
766 1 57 ASN HD22 2 1 HEC HAA1 1.800 . 5.000 3.744 2.898 4.076 . 0 0 "[ . 1 . 2]" 1
767 1 58 ILE H 1 58 ILE HB 1.800 . 2.900 2.493 2.470 2.518 . 0 0 "[ . 1 . 2]" 1
768 1 58 ILE H 1 58 ILE MD 1.800 . 5.000 3.457 3.411 3.500 . 0 0 "[ . 1 . 2]" 1
769 1 58 ILE H 1 58 ILE HG12 1.800 . 5.000 3.443 3.372 3.508 . 0 0 "[ . 1 . 2]" 1
770 1 58 ILE H 1 58 ILE HG13 1.800 . 5.000 2.099 2.048 2.154 . 0 0 "[ . 1 . 2]" 1
771 1 58 ILE H 1 58 ILE MG 1.800 . 5.000 3.765 3.760 3.769 . 0 0 "[ . 1 . 2]" 1
772 1 58 ILE H 1 59 LYS H 1.800 . 2.900 2.658 2.618 2.715 . 0 0 "[ . 1 . 2]" 1
773 1 58 ILE H 1 60 LYS H 1.800 . 5.000 4.315 4.216 4.398 . 0 0 "[ . 1 . 2]" 1
774 1 58 ILE HA 1 58 ILE HB 1.800 . 2.900 3.021 3.018 3.022 0.122 20 0 "[ . 1 . 2]" 1
775 1 58 ILE HA 1 58 ILE MD 1.800 . 5.000 3.807 3.798 3.817 . 0 0 "[ . 1 . 2]" 1
776 1 58 ILE HA 1 58 ILE HG12 1.800 . 3.500 2.523 2.501 2.552 . 0 0 "[ . 1 . 2]" 1
777 1 58 ILE HA 1 58 ILE HG13 1.800 . 3.500 2.922 2.878 2.975 . 0 0 "[ . 1 . 2]" 1
778 1 58 ILE HA 1 58 ILE MG 1.800 . 5.000 2.366 2.351 2.380 . 0 0 "[ . 1 . 2]" 1
779 1 58 ILE HA 1 60 LYS H 1.800 . 5.000 4.232 4.125 4.439 . 0 0 "[ . 1 . 2]" 1
780 1 58 ILE HB 1 58 ILE MD 1.800 . 5.000 2.322 2.226 2.375 . 0 0 "[ . 1 . 2]" 1
781 1 58 ILE HB 1 59 LYS H 1.800 . 2.900 2.760 2.618 2.844 . 0 0 "[ . 1 . 2]" 1
782 1 58 ILE QG 1 58 ILE MG 1.800 . 2.900 2.276 2.260 2.291 . 0 0 "[ . 1 . 2]" 1
783 1 58 ILE QG 1 59 LYS H 1.800 . 5.000 4.072 4.002 4.120 . 0 0 "[ . 1 . 2]" 1
784 1 58 ILE MG 1 59 LYS H 1.800 . 5.000 3.539 3.478 3.583 . 0 0 "[ . 1 . 2]" 1
785 1 58 ILE MG 1 59 LYS HA 1.800 . 3.500 3.523 3.483 3.548 0.048 9 0 "[ . 1 . 2]" 1
786 1 59 LYS H 1 59 LYS HB2 1.800 . 3.500 2.516 2.505 2.523 . 0 0 "[ . 1 . 2]" 1
787 1 59 LYS H 1 59 LYS HB3 1.800 . 3.500 2.605 2.592 2.620 . 0 0 "[ . 1 . 2]" 1
788 1 59 LYS H 1 59 LYS QG 1.800 . 5.000 3.979 3.977 3.980 . 0 0 "[ . 1 . 2]" 1
789 1 59 LYS HA 1 59 LYS HB2 1.800 . 2.900 2.484 2.479 2.488 . 0 0 "[ . 1 . 2]" 1
790 1 59 LYS HA 1 59 LYS HB3 1.800 . 2.900 3.026 3.025 3.028 0.128 20 0 "[ . 1 . 2]" 1
791 1 59 LYS HA 1 59 LYS QG 1.800 . 5.000 2.378 2.357 2.384 . 0 0 "[ . 1 . 2]" 1
792 1 59 LYS HA 1 60 LYS H 1.800 . 5.000 3.546 3.537 3.556 . 0 0 "[ . 1 . 2]" 1
793 1 59 LYS HB2 1 60 LYS H 1.800 . 5.000 3.813 3.778 3.831 . 0 0 "[ . 1 . 2]" 1
794 1 59 LYS HB3 1 60 LYS H 1.800 . 3.500 2.502 2.450 2.530 . 0 0 "[ . 1 . 2]" 1
795 1 59 LYS QG 1 60 LYS H 1.800 . 3.500 3.574 3.551 3.591 0.091 20 0 "[ . 1 . 2]" 1
796 1 60 LYS H 1 60 LYS HB3 1.800 . 3.500 3.100 2.605 3.650 0.150 10 0 "[ . 1 . 2]" 1
797 1 60 LYS H 1 60 LYS QG 1.800 . 5.000 3.399 2.239 4.088 . 0 0 "[ . 1 . 2]" 1
798 1 60 LYS HA 1 60 LYS QG 1.800 . 5.000 2.368 2.287 2.965 . 0 0 "[ . 1 . 2]" 1
799 1 60 LYS HB2 1 80 ILE HA 1.800 . 5.000 4.481 3.543 5.062 0.062 13 0 "[ . 1 . 2]" 1
800 1 60 LYS HB3 1 80 ILE HA 1.800 . 5.000 3.947 3.295 4.741 . 0 0 "[ . 1 . 2]" 1
801 1 61 ASN H 1 61 ASN QB 1.800 . 3.500 3.043 2.829 3.231 . 0 0 "[ . 1 . 2]" 1
802 1 62 VAL H 1 62 VAL HA 1.800 . 2.900 2.972 2.955 2.982 0.082 18 0 "[ . 1 . 2]" 1
803 1 62 VAL H 1 62 VAL HB 1.800 . 3.500 2.750 2.676 2.851 . 0 0 "[ . 1 . 2]" 1
804 1 62 VAL H 1 62 VAL MG1 1.800 . 5.000 3.910 3.879 3.948 . 0 0 "[ . 1 . 2]" 1
805 1 62 VAL H 1 62 VAL MG2 1.800 . 5.000 2.890 2.731 3.005 . 0 0 "[ . 1 . 2]" 1
806 1 62 VAL H 1 63 LEU H 1.800 . 5.000 4.380 4.337 4.419 . 0 0 "[ . 1 . 2]" 1
807 1 62 VAL HA 1 62 VAL HB 1.800 . 2.900 3.024 3.021 3.027 0.127 10 0 "[ . 1 . 2]" 1
808 1 62 VAL HA 1 62 VAL QG 1.800 . 2.900 2.052 2.026 2.091 . 0 0 "[ . 1 . 2]" 1
809 1 62 VAL HA 1 63 LEU H 1.800 . 3.500 2.244 2.219 2.282 . 0 0 "[ . 1 . 2]" 1
810 1 62 VAL HB 1 63 LEU H 1.800 . 5.000 4.053 3.984 4.123 . 0 0 "[ . 1 . 2]" 1
811 1 62 VAL HB 1 64 TRP HZ2 1.800 . 5.000 5.049 4.922 5.103 0.103 3 0 "[ . 1 . 2]" 1
812 1 62 VAL QG 1 64 TRP HE3 1.800 . 5.000 4.970 4.904 5.017 0.017 17 0 "[ . 1 . 2]" 1
813 1 62 VAL QG 1 64 TRP HZ3 1.800 . 5.000 5.041 4.990 5.082 0.082 3 0 "[ . 1 . 2]" 1
814 1 62 VAL QG 1 68 ASN QD 1.800 . 3.500 3.133 1.797 3.524 0.024 4 0 "[ . 1 . 2]" 1
815 1 62 VAL QG 1 79 TYR QE 1.800 . 5.000 3.284 1.921 5.094 0.094 1 0 "[ . 1 . 2]" 1
816 1 62 VAL QG 1 80 ILE MD 1.800 . 5.000 4.383 3.149 5.125 0.125 12 0 "[ . 1 . 2]" 1
817 1 62 VAL MG1 1 63 LEU H 1.800 . 5.000 2.201 2.076 2.476 . 0 0 "[ . 1 . 2]" 1
818 1 62 VAL MG2 1 63 LEU H 1.800 . 5.000 4.017 3.955 4.078 . 0 0 "[ . 1 . 2]" 1
819 1 63 LEU H 1 63 LEU HA 1.800 . 2.900 2.821 2.800 2.831 . 0 0 "[ . 1 . 2]" 1
820 1 63 LEU H 1 63 LEU HB2 1.800 . 3.500 2.553 2.509 2.604 . 0 0 "[ . 1 . 2]" 1
821 1 63 LEU H 1 63 LEU HB3 1.800 . 3.500 2.593 2.540 2.656 . 0 0 "[ . 1 . 2]" 1
822 1 63 LEU H 1 63 LEU QD 1.800 . 5.000 3.668 3.631 3.699 . 0 0 "[ . 1 . 2]" 1
823 1 63 LEU H 1 63 LEU HG 1.800 . 5.000 4.487 4.466 4.508 . 0 0 "[ . 1 . 2]" 1
824 1 63 LEU H 1 64 TRP H 1.800 . 5.000 4.666 4.653 4.686 . 0 0 "[ . 1 . 2]" 1
825 1 63 LEU HA 1 63 LEU MD1 1.800 . 5.000 2.114 2.087 2.134 . 0 0 "[ . 1 . 2]" 1
826 1 63 LEU HA 1 63 LEU MD2 1.800 . 5.000 3.814 3.795 3.832 . 0 0 "[ . 1 . 2]" 1
827 1 63 LEU HA 1 64 TRP H 1.800 . 5.000 2.269 2.248 2.298 . 0 0 "[ . 1 . 2]" 1
828 1 63 LEU QB 1 63 LEU MD1 1.800 . 3.500 2.189 2.174 2.205 . 0 0 "[ . 1 . 2]" 1
829 1 63 LEU QB 1 63 LEU MD2 1.800 . 3.500 2.088 2.077 2.103 . 0 0 "[ . 1 . 2]" 1
830 1 63 LEU QB 1 64 TRP H 1.800 . 5.000 3.583 3.560 3.600 . 0 0 "[ . 1 . 2]" 1
831 1 63 LEU QB 1 64 TRP HD1 1.800 . 6.300 6.419 6.379 6.460 0.160 10 0 "[ . 1 . 2]" 1
832 1 63 LEU QD 1 64 TRP HD1 1.800 . 5.000 4.699 4.550 4.819 . 0 0 "[ . 1 . 2]" 1
833 1 63 LEU QD 1 64 TRP HE3 1.800 . 6.000 5.913 5.840 5.972 . 0 0 "[ . 1 . 2]" 1
834 1 63 LEU QD 1 68 ASN QD 1.800 . 5.000 4.090 3.760 4.801 . 0 0 "[ . 1 . 2]" 1
835 1 63 LEU MD1 1 64 TRP H 1.800 . 5.000 1.994 1.864 2.197 . 0 0 "[ . 1 . 2]" 1
836 1 63 LEU MD2 1 64 TRP H 1.800 . 5.000 4.019 3.967 4.053 . 0 0 "[ . 1 . 2]" 1
837 1 63 LEU HG 1 64 TRP H 1.800 . 5.000 2.442 2.356 2.512 . 0 0 "[ . 1 . 2]" 1
838 1 63 LEU HG 1 64 TRP HD1 1.800 . 6.000 6.053 6.014 6.100 0.100 15 0 "[ . 1 . 2]" 1
839 1 63 LEU HG 1 64 TRP HE3 1.800 . 6.000 6.109 6.068 6.149 0.149 5 0 "[ . 1 . 2]" 1
840 1 63 LEU HG 1 65 ASP H 1.800 . 5.000 4.832 4.726 4.945 . 0 0 "[ . 1 . 2]" 1
841 1 64 TRP H 1 64 TRP HB2 1.800 . 3.500 2.308 2.286 2.338 . 0 0 "[ . 1 . 2]" 1
842 1 64 TRP H 1 64 TRP HB3 1.800 . 3.500 3.579 3.562 3.600 0.100 5 0 "[ . 1 . 2]" 1
843 1 64 TRP H 1 64 TRP HD1 1.800 . 5.000 3.704 3.657 3.779 . 0 0 "[ . 1 . 2]" 1
844 1 64 TRP HA 1 64 TRP HD1 1.800 . 5.000 4.334 4.302 4.357 . 0 0 "[ . 1 . 2]" 1
845 1 64 TRP HA 1 64 TRP HH2 1.800 . 6.000 5.816 5.777 5.845 . 0 0 "[ . 1 . 2]" 1
846 1 64 TRP QB 1 65 ASP H 1.800 . 5.000 2.906 2.818 3.021 . 0 0 "[ . 1 . 2]" 1
847 1 64 TRP QB 1 68 ASN QD 1.800 . 5.000 4.887 4.392 5.028 0.028 19 0 "[ . 1 . 2]" 1
848 1 64 TRP HB2 1 64 TRP HD1 1.800 . 3.500 2.540 2.531 2.555 . 0 0 "[ . 1 . 2]" 1
849 1 64 TRP HE1 1 69 MET QG 1.800 . 6.000 5.455 5.098 6.070 0.070 7 0 "[ . 1 . 2]" 1
850 1 64 TRP HE1 2 1 HEC HAA1 1.800 . 5.000 4.707 4.289 5.005 0.005 20 0 "[ . 1 . 2]" 1
851 1 64 TRP HE3 1 65 ASP H 1.800 . 5.000 2.376 2.276 2.467 . 0 0 "[ . 1 . 2]" 1
852 1 64 TRP HE3 1 68 ASN QB 1.800 . 5.000 2.495 2.274 2.756 . 0 0 "[ . 1 . 2]" 1
853 1 64 TRP HE3 1 69 MET H 1.800 . 5.000 3.145 2.982 3.480 . 0 0 "[ . 1 . 2]" 1
854 1 64 TRP HE3 1 69 MET HA 1.800 . 5.000 3.034 2.867 3.232 . 0 0 "[ . 1 . 2]" 1
855 1 64 TRP HE3 1 69 MET HB2 1.800 . 5.000 4.379 4.277 4.580 . 0 0 "[ . 1 . 2]" 1
856 1 64 TRP HE3 1 69 MET QB 1.800 . 5.000 3.984 3.906 4.149 . 0 0 "[ . 1 . 2]" 1
857 1 64 TRP HE3 1 69 MET HB3 1.800 . 5.000 4.583 4.502 4.744 . 0 0 "[ . 1 . 2]" 1
858 1 64 TRP HE3 1 69 MET ME 1.800 . 5.000 4.176 4.001 4.370 . 0 0 "[ . 1 . 2]" 1
859 1 64 TRP HE3 1 69 MET HG2 1.800 . 5.000 2.344 2.237 2.449 . 0 0 "[ . 1 . 2]" 1
860 1 64 TRP HE3 1 69 MET HG3 1.800 . 5.000 2.700 2.464 3.812 . 0 0 "[ . 1 . 2]" 1
861 1 64 TRP HH2 1 69 MET HA 1.800 . 5.000 4.077 3.930 4.257 . 0 0 "[ . 1 . 2]" 1
862 1 64 TRP HH2 1 72 TYR QB 1.800 . 5.000 2.244 2.212 2.383 . 0 0 "[ . 1 . 2]" 1
863 1 64 TRP HH2 1 80 ILE MD 1.800 . 5.000 3.597 2.768 4.594 . 0 0 "[ . 1 . 2]" 1
864 1 64 TRP HZ2 1 69 MET HA 1.800 . 6.000 5.611 5.373 5.918 . 0 0 "[ . 1 . 2]" 1
865 1 64 TRP HZ2 1 69 MET ME 1.800 . 5.000 5.129 5.076 5.171 0.171 17 0 "[ . 1 . 2]" 1
866 1 64 TRP HZ2 1 69 MET QG 1.800 . 6.000 5.252 4.991 6.036 0.036 7 0 "[ . 1 . 2]" 1
867 1 64 TRP HZ2 1 72 TYR HB2 1.800 . 5.000 4.378 4.063 4.727 . 0 0 "[ . 1 . 2]" 1
868 1 64 TRP HZ2 1 72 TYR QB 1.800 . 5.000 4.195 3.934 4.459 . 0 0 "[ . 1 . 2]" 1
869 1 64 TRP HZ2 1 72 TYR HB3 1.800 . 6.000 5.391 5.250 5.551 . 0 0 "[ . 1 . 2]" 1
870 1 64 TRP HZ2 2 1 HEC HAA1 1.800 . 5.000 4.247 3.555 4.986 . 0 0 "[ . 1 . 2]" 1
871 1 64 TRP HZ2 2 1 HEC HAA2 1.800 . 5.000 3.668 3.215 4.154 . 0 0 "[ . 1 . 2]" 1
872 1 64 TRP HZ3 1 69 MET HA 1.800 . 5.000 2.335 2.262 2.429 . 0 0 "[ . 1 . 2]" 1
873 1 64 TRP HZ3 1 69 MET HB2 1.800 . 5.000 5.048 4.925 5.112 0.112 4 0 "[ . 1 . 2]" 1
874 1 64 TRP HZ3 1 69 MET HB3 1.800 . 5.000 4.798 4.665 4.912 . 0 0 "[ . 1 . 2]" 1
875 1 64 TRP HZ3 1 69 MET HG2 1.800 . 5.000 3.447 3.128 3.856 . 0 0 "[ . 1 . 2]" 1
876 1 64 TRP HZ3 1 69 MET HG3 1.800 . 5.000 4.377 4.143 5.229 0.229 10 0 "[ . 1 . 2]" 1
877 1 64 TRP HZ3 1 72 TYR HB2 1.800 . 5.000 2.816 2.287 3.158 . 0 0 "[ . 1 . 2]" 1
878 1 64 TRP HZ3 1 72 TYR HB3 1.800 . 5.000 3.748 3.022 4.132 . 0 0 "[ . 1 . 2]" 1
879 1 65 ASP H 1 65 ASP HB2 1.800 . 3.500 3.239 3.211 3.291 . 0 0 "[ . 1 . 2]" 1
880 1 65 ASP H 1 65 ASP HB3 1.800 . 3.500 2.941 2.883 3.027 . 0 0 "[ . 1 . 2]" 1
881 1 65 ASP H 1 66 GLU QG 1.800 . 6.000 5.812 5.646 6.059 0.059 20 0 "[ . 1 . 2]" 1
882 1 65 ASP H 1 67 ASN H 1.800 . 5.000 4.890 4.751 4.978 . 0 0 "[ . 1 . 2]" 1
883 1 65 ASP H 1 68 ASN H 1.800 . 3.500 3.506 3.419 3.551 0.051 9 0 "[ . 1 . 2]" 1
884 1 65 ASP H 1 68 ASN HB2 1.800 . 5.000 2.200 1.795 3.365 0.005 14 0 "[ . 1 . 2]" 1
885 1 65 ASP H 1 68 ASN HB3 1.800 . 5.000 3.129 1.898 3.558 . 0 0 "[ . 1 . 2]" 1
886 1 65 ASP H 1 68 ASN QD 1.800 . 5.000 3.272 3.094 3.726 . 0 0 "[ . 1 . 2]" 1
887 1 65 ASP HB2 1 66 GLU H 1.800 . 5.000 4.000 3.885 4.079 . 0 0 "[ . 1 . 2]" 1
888 1 65 ASP HB3 1 66 GLU H 1.800 . 5.000 3.562 3.363 3.682 . 0 0 "[ . 1 . 2]" 1
889 1 66 GLU H 1 66 GLU QG 1.800 . 5.000 2.322 1.940 2.946 . 0 0 "[ . 1 . 2]" 1
890 1 66 GLU H 1 67 ASN H 1.800 . 5.000 2.769 2.741 2.795 . 0 0 "[ . 1 . 2]" 1
891 1 66 GLU H 1 68 ASN H 1.800 . 5.000 4.299 4.214 4.408 . 0 0 "[ . 1 . 2]" 1
892 1 66 GLU H 1 100 ILE MG 1.800 . 6.000 5.385 5.000 5.909 . 0 0 "[ . 1 . 2]" 1
893 1 66 GLU HA 1 66 GLU QG 1.800 . 3.500 2.340 2.272 2.398 . 0 0 "[ . 1 . 2]" 1
894 1 66 GLU HA 1 67 ASN H 1.800 . 3.500 3.546 3.538 3.556 0.056 10 0 "[ . 1 . 2]" 1
895 1 66 GLU HA 1 67 ASN QB 1.800 . 6.000 5.386 5.212 5.517 . 0 0 "[ . 1 . 2]" 1
896 1 66 GLU HA 1 69 MET H 1.800 . 5.000 3.836 3.702 4.018 . 0 0 "[ . 1 . 2]" 1
897 1 66 GLU HA 1 69 MET HB2 1.800 . 5.000 2.977 2.696 3.192 . 0 0 "[ . 1 . 2]" 1
898 1 66 GLU HA 1 69 MET QB 1.800 . 5.000 2.940 2.669 3.148 . 0 0 "[ . 1 . 2]" 1
899 1 66 GLU HA 1 69 MET HB3 1.800 . 5.000 4.568 4.292 4.806 . 0 0 "[ . 1 . 2]" 1
900 1 66 GLU HA 1 69 MET QG 1.800 . 6.000 3.783 3.494 4.039 . 0 0 "[ . 1 . 2]" 1
901 1 66 GLU HA 1 70 SER H 1.800 . 5.000 4.365 3.963 4.594 . 0 0 "[ . 1 . 2]" 1
902 1 66 GLU HA 1 100 ILE MG 1.800 . 5.000 3.201 2.864 3.748 . 0 0 "[ . 1 . 2]" 1
903 1 66 GLU QB 1 69 MET QG 1.800 . 6.000 5.446 5.235 5.656 . 0 0 "[ . 1 . 2]" 1
904 1 66 GLU HB2 1 67 ASN H 1.800 . 5.000 2.636 2.564 2.683 . 0 0 "[ . 1 . 2]" 1
905 1 66 GLU HB2 1 100 ILE MG 1.800 . 5.000 4.493 4.099 4.991 . 0 0 "[ . 1 . 2]" 1
906 1 66 GLU HB3 1 67 ASN H 1.800 . 5.000 3.691 3.633 3.753 . 0 0 "[ . 1 . 2]" 1
907 1 66 GLU HB3 1 100 ILE MG 1.800 . 5.000 3.062 2.676 3.523 . 0 0 "[ . 1 . 2]" 1
908 1 66 GLU QG 1 100 ILE MG 1.800 . 6.000 3.353 2.634 3.772 . 0 0 "[ . 1 . 2]" 1
909 1 67 ASN H 1 68 ASN H 1.800 . 2.900 2.592 2.547 2.666 . 0 0 "[ . 1 . 2]" 1
910 1 67 ASN H 1 68 ASN QB 1.800 . 5.000 4.526 4.329 4.635 . 0 0 "[ . 1 . 2]" 1
911 1 67 ASN H 1 69 MET H 1.800 . 5.000 4.099 4.037 4.189 . 0 0 "[ . 1 . 2]" 1
912 1 67 ASN HA 1 67 ASN QD 1.800 . 5.000 3.478 1.945 4.048 . 0 0 "[ . 1 . 2]" 1
913 1 67 ASN HA 1 68 ASN H 1.800 . 5.000 3.575 3.566 3.583 . 0 0 "[ . 1 . 2]" 1
914 1 67 ASN HA 1 69 MET H 1.800 . 5.000 4.541 4.418 4.648 . 0 0 "[ . 1 . 2]" 1
915 1 67 ASN HA 1 70 SER H 1.800 . 5.000 3.552 3.487 3.660 . 0 0 "[ . 1 . 2]" 1
916 1 67 ASN HA 1 70 SER QB 1.800 . 5.000 3.164 2.822 3.537 . 0 0 "[ . 1 . 2]" 1
917 1 67 ASN HA 1 71 GLU H 1.800 . 5.000 4.893 4.707 5.012 0.012 9 0 "[ . 1 . 2]" 1
918 1 67 ASN HB2 1 68 ASN H 1.800 . 5.000 3.006 2.497 3.732 . 0 0 "[ . 1 . 2]" 1
919 1 67 ASN HB3 1 68 ASN H 1.800 . 5.000 3.140 2.412 3.636 . 0 0 "[ . 1 . 2]" 1
920 1 68 ASN H 1 68 ASN HB2 1.800 . 3.500 2.453 2.405 2.477 . 0 0 "[ . 1 . 2]" 1
921 1 68 ASN H 1 68 ASN HB3 1.800 . 3.500 3.421 2.696 3.603 0.103 4 0 "[ . 1 . 2]" 1
922 1 68 ASN H 1 69 MET H 1.800 . 2.900 2.728 2.683 2.782 . 0 0 "[ . 1 . 2]" 1
923 1 68 ASN H 1 70 SER H 1.800 . 5.000 4.144 4.038 4.287 . 0 0 "[ . 1 . 2]" 1
924 1 68 ASN HA 1 69 MET H 1.800 . 3.500 3.559 3.546 3.569 0.069 14 0 "[ . 1 . 2]" 1
925 1 68 ASN HA 1 70 SER H 1.800 . 5.000 4.256 4.167 4.331 . 0 0 "[ . 1 . 2]" 1
926 1 68 ASN HA 1 71 GLU H 1.800 . 5.000 3.566 3.478 3.671 . 0 0 "[ . 1 . 2]" 1
927 1 68 ASN HA 1 71 GLU QB 1.800 . 5.000 3.436 3.263 3.595 . 0 0 "[ . 1 . 2]" 1
928 1 68 ASN HA 1 72 TYR H 1.800 . 5.000 4.878 4.665 4.981 . 0 0 "[ . 1 . 2]" 1
929 1 68 ASN QB 1 69 MET H 1.800 . 5.000 2.520 2.475 2.614 . 0 0 "[ . 1 . 2]" 1
930 1 68 ASN QB 1 69 MET HA 1.800 . 5.000 3.910 3.872 4.020 . 0 0 "[ . 1 . 2]" 1
931 1 69 MET H 1 69 MET HB2 1.800 . 3.500 2.401 2.379 2.421 . 0 0 "[ . 1 . 2]" 1
932 1 69 MET H 1 69 MET HB3 1.800 . 3.500 3.599 3.590 3.606 0.106 14 0 "[ . 1 . 2]" 1
933 1 69 MET H 1 69 MET ME 1.800 . 5.000 4.723 4.580 4.769 . 0 0 "[ . 1 . 2]" 1
934 1 69 MET H 1 69 MET QG 1.800 . 3.500 2.350 2.275 2.416 . 0 0 "[ . 1 . 2]" 1
935 1 69 MET H 1 70 SER H 1.800 . 3.500 2.701 2.656 2.759 . 0 0 "[ . 1 . 2]" 1
936 1 69 MET H 1 71 GLU H 1.800 . 5.000 4.310 4.202 4.462 . 0 0 "[ . 1 . 2]" 1
937 1 69 MET HA 1 70 SER H 1.800 . 5.000 3.541 3.528 3.552 . 0 0 "[ . 1 . 2]" 1
938 1 69 MET HA 1 71 GLU H 1.800 . 5.000 4.135 3.974 4.281 . 0 0 "[ . 1 . 2]" 1
939 1 69 MET HA 1 72 TYR H 1.800 . 5.000 3.152 3.042 3.335 . 0 0 "[ . 1 . 2]" 1
940 1 69 MET HA 1 72 TYR HB2 1.800 . 5.000 3.242 2.949 3.466 . 0 0 "[ . 1 . 2]" 1
941 1 69 MET HA 1 72 TYR HB3 1.800 . 5.000 2.931 2.561 3.212 . 0 0 "[ . 1 . 2]" 1
942 1 69 MET HA 1 73 LEU H 1.800 . 5.000 4.226 3.994 4.543 . 0 0 "[ . 1 . 2]" 1
943 1 69 MET QB 1 69 MET ME 1.800 . 5.000 2.140 2.031 2.175 . 0 0 "[ . 1 . 2]" 1
944 1 69 MET QB 1 69 MET QG 1.800 . 3.500 2.090 2.025 2.099 . 0 0 "[ . 1 . 2]" 1
945 1 69 MET QB 1 100 ILE MD 1.800 . 5.000 3.002 2.391 3.627 . 0 0 "[ . 1 . 2]" 1
946 1 69 MET QB 1 100 ILE QG 1.800 . 5.000 3.646 3.390 4.024 . 0 0 "[ . 1 . 2]" 1
947 1 69 MET QB 1 100 ILE MG 1.800 . 5.000 3.646 3.244 4.149 . 0 0 "[ . 1 . 2]" 1
948 1 69 MET ME 1 72 TYR HB2 1.800 . 5.000 4.786 4.289 5.037 0.037 9 0 "[ . 1 . 2]" 1
949 1 69 MET ME 1 72 TYR HB3 1.800 . 5.000 3.956 3.376 4.170 . 0 0 "[ . 1 . 2]" 1
950 1 69 MET ME 1 73 LEU H 1.800 . 5.000 5.086 4.739 5.198 0.198 5 0 "[ . 1 . 2]" 1
951 1 69 MET ME 1 73 LEU HG 1.800 . 5.000 4.469 4.051 5.023 0.023 19 0 "[ . 1 . 2]" 1
952 1 69 MET ME 1 99 LEU MD1 1.800 . 6.000 6.006 5.774 6.096 0.096 3 0 "[ . 1 . 2]" 1
953 1 69 MET ME 1 99 LEU MD2 1.800 . 6.000 5.379 4.877 5.708 . 0 0 "[ . 1 . 2]" 1
954 1 69 MET QG 1 70 SER H 1.800 . 5.000 4.192 4.159 4.234 . 0 0 "[ . 1 . 2]" 1
955 1 70 SER H 1 70 SER HA 1.800 . 2.900 2.831 2.817 2.849 . 0 0 "[ . 1 . 2]" 1
956 1 70 SER H 1 70 SER QB 1.800 . 3.500 2.470 2.261 2.599 . 0 0 "[ . 1 . 2]" 1
957 1 70 SER H 1 71 GLU H 1.800 . 2.900 2.760 2.689 2.847 . 0 0 "[ . 1 . 2]" 1
958 1 70 SER H 1 72 TYR H 1.800 . 5.000 4.209 4.116 4.300 . 0 0 "[ . 1 . 2]" 1
959 1 70 SER H 1 100 ILE MG 1.800 . 6.000 4.642 4.315 5.008 . 0 0 "[ . 1 . 2]" 1
960 1 70 SER HA 1 71 GLU H 1.800 . 5.000 3.551 3.528 3.572 . 0 0 "[ . 1 . 2]" 1
961 1 70 SER HA 1 72 TYR H 1.800 . 5.000 4.357 4.283 4.464 . 0 0 "[ . 1 . 2]" 1
962 1 70 SER HA 1 73 LEU H 1.800 . 5.000 3.453 3.387 3.654 . 0 0 "[ . 1 . 2]" 1
963 1 70 SER HA 1 73 LEU QB 1.800 . 5.000 2.906 2.443 3.256 . 0 0 "[ . 1 . 2]" 1
964 1 70 SER HA 1 74 THR H 1.800 . 5.000 4.666 4.476 4.806 . 0 0 "[ . 1 . 2]" 1
965 1 70 SER HA 1 100 ILE QG 1.800 . 5.000 3.757 3.437 4.133 . 0 0 "[ . 1 . 2]" 1
966 1 70 SER QB 1 71 GLU H 1.800 . 3.500 2.824 2.453 3.474 . 0 0 "[ . 1 . 2]" 1
967 1 70 SER QB 1 100 ILE MD 1.800 . 5.000 2.608 1.976 3.299 . 0 0 "[ . 1 . 2]" 1
968 1 71 GLU H 1 71 GLU QB 1.800 . 3.500 2.438 2.428 2.467 . 0 0 "[ . 1 . 2]" 1
969 1 71 GLU H 1 71 GLU HG2 1.800 . 3.500 3.014 2.099 3.414 . 0 0 "[ . 1 . 2]" 1
970 1 71 GLU H 1 71 GLU HG3 1.800 . 3.500 2.607 2.175 3.567 0.067 18 0 "[ . 1 . 2]" 1
971 1 71 GLU H 1 72 TYR H 1.800 . 5.000 2.652 2.608 2.695 . 0 0 "[ . 1 . 2]" 1
972 1 71 GLU HA 1 72 TYR H 1.800 . 5.000 3.554 3.538 3.565 . 0 0 "[ . 1 . 2]" 1
973 1 71 GLU HA 1 73 LEU H 1.800 . 5.000 4.513 4.361 4.635 . 0 0 "[ . 1 . 2]" 1
974 1 71 GLU HA 1 74 THR H 1.800 . 5.000 3.620 3.512 3.818 . 0 0 "[ . 1 . 2]" 1
975 1 71 GLU HA 1 74 THR HB 1.800 . 5.000 3.912 3.088 4.885 . 0 0 "[ . 1 . 2]" 1
976 1 71 GLU HA 1 74 THR MG 1.800 . 5.000 4.316 2.267 4.820 . 0 0 "[ . 1 . 2]" 1
977 1 71 GLU HA 1 75 ASN H 1.800 . 6.000 5.252 4.353 5.707 . 0 0 "[ . 1 . 2]" 1
978 1 71 GLU QB 1 72 TYR H 1.800 . 3.500 2.580 2.507 2.622 . 0 0 "[ . 1 . 2]" 1
979 1 71 GLU QG 1 79 TYR QD 1.800 . 5.000 4.776 4.087 5.063 0.063 7 0 "[ . 1 . 2]" 1
980 1 71 GLU QG 1 79 TYR QE 1.800 . 5.000 4.401 2.827 5.034 0.034 13 0 "[ . 1 . 2]" 1
981 1 72 TYR H 1 72 TYR QD 1.800 . 5.000 4.206 4.182 4.217 . 0 0 "[ . 1 . 2]" 1
982 1 72 TYR H 1 73 LEU H 1.800 . 3.500 2.707 2.654 2.768 . 0 0 "[ . 1 . 2]" 1
983 1 72 TYR H 1 74 THR H 1.800 . 5.000 4.197 4.090 4.285 . 0 0 "[ . 1 . 2]" 1
984 1 72 TYR HA 1 73 LEU H 1.800 . 5.000 3.567 3.553 3.581 . 0 0 "[ . 1 . 2]" 1
985 1 72 TYR HA 1 74 THR H 1.800 . 5.000 4.116 3.975 4.378 . 0 0 "[ . 1 . 2]" 1
986 1 72 TYR HA 1 79 TYR QD 1.800 . 5.000 4.632 4.040 5.035 0.035 20 0 "[ . 1 . 2]" 1
987 1 72 TYR QB 1 73 LEU H 1.800 . 3.500 2.500 2.429 2.587 . 0 0 "[ . 1 . 2]" 1
988 1 72 TYR HB2 1 72 TYR QD 1.800 . 2.900 2.424 2.379 2.456 . 0 0 "[ . 1 . 2]" 1
989 1 72 TYR HB3 1 72 TYR QD 1.800 . 2.900 2.406 2.380 2.458 . 0 0 "[ . 1 . 2]" 1
990 1 72 TYR QD 1 73 LEU MD1 1.800 . 5.000 4.469 2.464 5.112 0.112 12 0 "[ . 1 . 2]" 1
991 1 72 TYR QD 1 73 LEU MD2 1.800 . 5.000 2.872 2.220 5.073 0.073 13 0 "[ . 1 . 2]" 1
992 1 72 TYR QD 1 76 HIS HA 1.800 . 5.000 3.737 2.976 4.284 . 0 0 "[ . 1 . 2]" 1
993 1 72 TYR QD 1 80 ILE MG 1.800 . 5.000 5.035 4.889 5.092 0.092 1 0 "[ . 1 . 2]" 1
994 1 72 TYR QE 1 73 LEU QD 1.800 . 5.000 4.014 3.386 4.742 . 0 0 "[ . 1 . 2]" 1
995 1 73 LEU H 1 73 LEU HA 1.800 . 2.900 2.804 2.762 2.827 . 0 0 "[ . 1 . 2]" 1
996 1 73 LEU H 1 73 LEU HB2 1.800 . 3.500 2.482 2.176 2.662 . 0 0 "[ . 1 . 2]" 1
997 1 73 LEU H 1 73 LEU HB3 1.800 . 3.500 3.586 3.505 3.615 0.115 12 0 "[ . 1 . 2]" 1
998 1 73 LEU H 1 73 LEU MD1 1.800 . 5.000 3.372 1.792 4.033 0.008 16 0 "[ . 1 . 2]" 1
999 1 73 LEU H 1 73 LEU MD2 1.800 . 5.000 2.964 1.870 3.939 . 0 0 "[ . 1 . 2]" 1
1000 1 73 LEU H 1 73 LEU HG 1.800 . 5.000 2.514 1.882 3.976 . 0 0 "[ . 1 . 2]" 1
1001 1 73 LEU H 1 74 THR H 1.800 . 2.900 2.821 2.759 2.891 . 0 0 "[ . 1 . 2]" 1
1002 1 73 LEU HA 1 73 LEU HG 1.800 . 3.500 3.030 2.232 3.587 0.087 3 0 "[ . 1 . 2]" 1
1003 1 73 LEU HA 1 74 THR H 1.800 . 3.500 3.543 3.521 3.563 0.063 18 0 "[ . 1 . 2]" 1
1004 1 73 LEU QB 1 90 LEU H 1.800 . 6.000 5.465 3.999 6.059 0.059 5 0 "[ . 1 . 2]" 1
1005 1 73 LEU QB 1 90 LEU QB 1.800 . 5.000 3.471 3.036 4.171 . 0 0 "[ . 1 . 2]" 1
1006 1 73 LEU HB2 1 73 LEU MD1 1.800 . 3.500 2.499 2.233 3.179 . 0 0 "[ . 1 . 2]" 1
1007 1 73 LEU HB2 1 73 LEU MD2 1.800 . 3.500 2.965 2.333 3.196 . 0 0 "[ . 1 . 2]" 1
1008 1 73 LEU HB2 1 74 THR H 1.800 . 5.000 2.769 2.555 2.992 . 0 0 "[ . 1 . 2]" 1
1009 1 73 LEU HB3 1 73 LEU MD1 1.800 . 3.500 2.424 2.198 3.206 . 0 0 "[ . 1 . 2]" 1
1010 1 73 LEU HB3 1 73 LEU MD2 1.800 . 3.500 2.417 2.191 3.192 . 0 0 "[ . 1 . 2]" 1
1011 1 73 LEU HB3 1 74 THR H 1.800 . 5.000 3.647 3.143 3.858 . 0 0 "[ . 1 . 2]" 1
1012 1 73 LEU QD 1 74 THR H 1.800 . 5.000 4.034 3.812 4.150 . 0 0 "[ . 1 . 2]" 1
1013 1 73 LEU QD 1 90 LEU QD 1.800 . 5.000 2.433 1.819 2.828 . 0 0 "[ . 1 . 2]" 1
1014 1 73 LEU QD 1 90 LEU HG 1.800 . 5.000 4.504 3.893 5.049 0.049 4 0 "[ . 1 . 2]" 1
1015 1 73 LEU QD 1 100 ILE MD 1.800 . 3.500 2.201 1.965 3.130 . 0 0 "[ . 1 . 2]" 1
1016 1 73 LEU QD 1 100 ILE QG 1.800 . 5.000 2.067 1.835 3.160 . 0 0 "[ . 1 . 2]" 1
1017 1 73 LEU MD1 1 99 LEU MD1 1.800 . 5.000 3.481 1.932 5.040 0.040 4 0 "[ . 1 . 2]" 1
1018 1 73 LEU MD1 1 99 LEU MD2 1.800 . 5.000 3.048 1.841 4.607 . 0 0 "[ . 1 . 2]" 1
1019 1 73 LEU MD2 1 99 LEU MD1 1.800 . 5.000 3.428 2.010 5.034 0.034 19 0 "[ . 1 . 2]" 1
1020 1 73 LEU MD2 1 99 LEU MD2 1.800 . 5.000 2.936 1.912 4.404 . 0 0 "[ . 1 . 2]" 1
1021 1 73 LEU HG 1 74 THR H 1.800 . 5.000 4.481 4.109 5.128 0.128 19 0 "[ . 1 . 2]" 1
1022 1 74 THR H 1 74 THR HB 1.800 . 3.500 2.794 2.628 3.609 0.109 5 0 "[ . 1 . 2]" 1
1023 1 74 THR H 1 74 THR MG 1.800 . 3.500 3.559 1.956 3.745 0.245 18 0 "[ . 1 . 2]" 1
1024 1 74 THR H 1 75 ASN H 1.800 . 3.500 2.798 2.604 3.189 . 0 0 "[ . 1 . 2]" 1
1025 1 74 THR HA 1 74 THR MG 1.800 . 5.000 2.264 2.160 2.361 . 0 0 "[ . 1 . 2]" 1
1026 1 74 THR HA 1 75 ASN H 1.800 . 3.500 3.540 3.410 3.579 0.079 9 0 "[ . 1 . 2]" 1
1027 1 74 THR HA 1 75 ASN QB 1.800 . 6.000 4.783 4.460 5.473 . 0 0 "[ . 1 . 2]" 1
1028 1 74 THR HA 1 90 LEU H 1.800 . 5.000 4.525 3.027 5.059 0.059 20 0 "[ . 1 . 2]" 1
1029 1 74 THR HB 1 75 ASN H 1.800 . 5.000 2.664 1.821 4.161 . 0 0 "[ . 1 . 2]" 1
1030 1 74 THR MG 1 75 ASN H 1.800 . 5.000 3.632 3.462 3.927 . 0 0 "[ . 1 . 2]" 1
1031 1 74 THR MG 1 75 ASN QB 1.800 . 5.000 3.462 2.858 4.918 . 0 0 "[ . 1 . 2]" 1
1032 1 74 THR MG 1 91 LYS HA 1.800 . 5.000 3.939 2.348 5.035 0.035 19 0 "[ . 1 . 2]" 1
1033 1 75 ASN QB 1 77 ALA H 1.800 . 6.000 3.162 2.322 5.713 . 0 0 "[ . 1 . 2]" 1
1034 1 75 ASN HB2 1 76 HIS HA 1.800 . 6.000 5.822 4.628 6.165 0.165 1 0 "[ . 1 . 2]" 1
1035 1 75 ASN HB3 1 76 HIS HA 1.800 . 6.000 4.923 4.336 5.911 . 0 0 "[ . 1 . 2]" 1
1036 1 75 ASN QD 1 77 ALA MB 1.800 . 5.000 3.797 2.539 5.066 0.066 9 0 "[ . 1 . 2]" 1
1037 1 76 HIS H 1 77 ALA H 1.800 . 5.000 3.012 1.906 4.641 . 0 0 "[ . 1 . 2]" 1
1038 1 76 HIS HA 1 76 HIS HD1 1.800 . 5.000 3.417 2.611 4.245 . 0 0 "[ . 1 . 2]" 1
1039 1 76 HIS QB 2 1 HEC HAA1 1.800 . 6.000 5.595 5.248 6.029 0.029 18 0 "[ . 1 . 2]" 1
1040 1 76 HIS HB2 1 77 ALA H 1.800 . 5.000 3.991 3.482 4.692 . 0 0 "[ . 1 . 2]" 1
1041 1 76 HIS HB3 1 77 ALA H 1.800 . 5.000 3.801 3.022 4.234 . 0 0 "[ . 1 . 2]" 1
1042 1 76 HIS HD1 2 1 HEC HHB 1.800 . 6.000 5.377 3.377 5.688 . 0 0 "[ . 1 . 2]" 1
1043 1 76 HIS HD1 1 85 MET HA 1.800 . 6.000 5.046 3.165 6.045 0.045 12 0 "[ . 1 . 2]" 1
1044 1 76 HIS HD2 2 1 HEC HHA 1.800 . 6.000 3.826 3.467 5.787 . 0 0 "[ . 1 . 2]" 1
1045 1 77 ALA H 1 77 ALA MB 1.800 . 5.000 2.819 2.599 2.959 . 0 0 "[ . 1 . 2]" 1
1046 1 77 ALA H 1 83 THR HB 1.800 . 6.000 5.359 4.676 6.121 0.121 12 0 "[ . 1 . 2]" 1
1047 1 77 ALA HA 1 78 LYS H 1.800 . 5.000 3.046 2.336 3.568 . 0 0 "[ . 1 . 2]" 1
1048 1 77 ALA HA 1 80 ILE H 1.800 . 5.000 3.017 2.766 4.030 . 0 0 "[ . 1 . 2]" 1
1049 1 77 ALA HA 1 80 ILE HB 1.800 . 5.000 3.424 2.655 5.002 0.002 18 0 "[ . 1 . 2]" 1
1050 1 77 ALA HA 1 83 THR HA 1.800 . 6.000 5.858 5.367 6.096 0.096 9 0 "[ . 1 . 2]" 1
1051 1 77 ALA MB 1 78 LYS H 1.800 . 3.500 3.457 2.727 3.697 0.197 7 0 "[ . 1 . 2]" 1
1052 1 77 ALA MB 2 1 HEC HAA2 1.800 . 6.300 6.422 6.309 6.500 0.200 6 0 "[ . 1 . 2]" 1
1053 1 78 LYS H 1 79 TYR H 1.800 . 5.000 2.730 1.820 2.872 . 0 0 "[ . 1 . 2]" 1
1054 1 78 LYS H 1 80 ILE QG 1.800 . 5.000 4.548 3.324 5.073 0.073 8 0 "[ . 1 . 2]" 1
1055 1 78 LYS QB 1 79 TYR H 1.800 . 5.000 2.429 1.792 2.704 0.008 2 0 "[ . 1 . 2]" 1
1056 1 79 TYR H 1 80 ILE H 1.800 . 5.000 2.418 2.160 2.750 . 0 0 "[ . 1 . 2]" 1
1057 1 79 TYR HB2 1 79 TYR QD 1.800 . 2.900 2.431 2.298 2.597 . 0 0 "[ . 1 . 2]" 1
1058 1 79 TYR HB2 1 80 ILE H 1.800 . 5.000 3.739 2.844 4.465 . 0 0 "[ . 1 . 2]" 1
1059 1 79 TYR HB3 1 79 TYR QD 1.800 . 2.900 2.422 2.305 2.678 . 0 0 "[ . 1 . 2]" 1
1060 1 79 TYR HB3 1 80 ILE H 1.800 . 5.000 3.381 2.602 4.415 . 0 0 "[ . 1 . 2]" 1
1061 1 80 ILE H 1 80 ILE MD 1.800 . 5.000 3.777 3.336 4.273 . 0 0 "[ . 1 . 2]" 1
1062 1 80 ILE H 1 80 ILE QG 1.800 . 5.000 2.145 1.752 2.793 0.048 18 0 "[ . 1 . 2]" 1
1063 1 80 ILE H 1 80 ILE MG 1.800 . 5.000 3.779 3.555 3.973 . 0 0 "[ . 1 . 2]" 1
1064 1 80 ILE HB 1 80 ILE MD 1.800 . 3.500 2.343 2.206 3.200 . 0 0 "[ . 1 . 2]" 1
1065 1 80 ILE HB 1 83 THR H 1.800 . 6.000 3.839 3.049 4.384 . 0 0 "[ . 1 . 2]" 1
1066 1 80 ILE MD 1 80 ILE MG 1.800 . 2.900 1.941 1.785 2.076 0.015 14 0 "[ . 1 . 2]" 1
1067 1 80 ILE MD 1 83 THR H 1.800 . 5.000 5.041 4.716 5.243 0.243 10 0 "[ . 1 . 2]" 1
1068 1 81 PRO HA 1 83 THR H 1.800 . 6.000 3.453 3.170 4.342 . 0 0 "[ . 1 . 2]" 1
1069 1 81 PRO HA 1 83 THR HA 1.800 . 6.000 6.128 5.998 6.196 0.196 15 0 "[ . 1 . 2]" 1
1070 1 82 GLY H 1 83 THR H 1.800 . 5.000 2.535 2.334 3.471 . 0 0 "[ . 1 . 2]" 1
1071 1 83 THR H 1 83 THR MG 1.800 . 5.000 3.380 1.896 3.797 . 0 0 "[ . 1 . 2]" 1
1072 1 83 THR H 1 84 LYS H 1.800 . 5.000 4.629 4.588 4.668 . 0 0 "[ . 1 . 2]" 1
1073 1 83 THR HA 1 83 THR MG 1.800 . 5.000 2.514 2.286 3.188 . 0 0 "[ . 1 . 2]" 1
1074 1 83 THR HA 1 84 LYS HG2 1.800 . 5.000 4.826 4.639 5.020 0.020 9 0 "[ . 1 . 2]" 1
1075 1 83 THR HA 1 84 LYS HG3 1.800 . 5.000 3.757 3.534 4.011 . 0 0 "[ . 1 . 2]" 1
1076 1 83 THR HA 2 1 HEC HAD1 1.800 . 6.000 5.135 3.768 6.145 0.145 3 0 "[ . 1 . 2]" 1
1077 1 84 LYS H 1 84 LYS QE 1.800 . 5.000 4.040 3.497 4.261 . 0 0 "[ . 1 . 2]" 1
1078 1 84 LYS H 1 84 LYS HG2 1.800 . 5.000 3.264 3.148 3.423 . 0 0 "[ . 1 . 2]" 1
1079 1 84 LYS H 1 84 LYS HG3 1.800 . 5.000 2.100 1.930 2.252 . 0 0 "[ . 1 . 2]" 1
1080 1 84 LYS HB2 1 85 MET H 1.800 . 5.000 3.777 2.466 4.141 . 0 0 "[ . 1 . 2]" 1
1081 1 84 LYS HB3 1 85 MET H 1.800 . 5.000 2.892 2.282 3.524 . 0 0 "[ . 1 . 2]" 1
1082 1 84 LYS QE 2 1 HEC HAD1 1.800 . 5.000 4.907 3.470 5.099 0.099 16 0 "[ . 1 . 2]" 1
1083 1 84 LYS QG 1 85 MET H 1.800 . 5.000 4.076 3.961 4.259 . 0 0 "[ . 1 . 2]" 1
1084 1 84 LYS QG 2 1 HEC HAD1 1.800 . 5.000 4.551 4.138 5.022 0.022 6 0 "[ . 1 . 2]" 1
1085 1 85 MET H 1 85 MET HB2 1.800 . 3.500 2.716 2.442 3.163 . 0 0 "[ . 1 . 2]" 1
1086 1 85 MET H 2 1 HEC HBD1 1.800 . 6.000 5.631 3.574 6.114 0.114 20 0 "[ . 1 . 2]" 1
1087 1 85 MET HA 1 86 ALA H 1.800 . 3.500 2.359 2.237 2.513 . 0 0 "[ . 1 . 2]" 1
1088 1 86 ALA H 1 86 ALA MB 1.800 . 3.500 2.816 2.457 2.977 . 0 0 "[ . 1 . 2]" 1
1089 1 86 ALA H 1 87 PHE H 1.800 . 3.500 2.106 1.734 3.709 0.209 12 0 "[ . 1 . 2]" 1
1090 1 86 ALA H 2 1 HEC HHD 1.800 . 6.000 5.844 5.529 6.049 0.049 14 0 "[ . 1 . 2]" 1
1091 1 86 ALA MB 1 87 PHE H 1.800 . 5.000 3.080 1.743 3.719 0.057 12 0 "[ . 1 . 2]" 1
1092 1 87 PHE H 1 87 PHE HB2 1.800 . 3.500 2.866 2.483 3.533 0.033 12 0 "[ . 1 . 2]" 1
1093 1 87 PHE H 1 87 PHE HB3 1.800 . 3.500 2.678 2.430 3.003 . 0 0 "[ . 1 . 2]" 1
1094 1 87 PHE HB2 1 90 LEU MD1 1.800 . 6.000 6.014 5.528 6.180 0.180 15 0 "[ . 1 . 2]" 1
1095 1 87 PHE HB2 1 90 LEU MD2 1.800 . 6.000 6.098 6.007 6.295 0.295 10 0 "[ . 1 . 2]" 1
1096 1 87 PHE HB3 1 90 LEU MD1 1.800 . 6.000 5.602 5.051 5.881 . 0 0 "[ . 1 . 2]" 1
1097 1 87 PHE HB3 1 90 LEU MD2 1.800 . 6.000 5.796 5.331 6.032 0.032 16 0 "[ . 1 . 2]" 1
1098 1 87 PHE QD 1 89 GLY QA 1.800 . 5.000 2.932 2.229 5.051 0.051 10 0 "[ . 1 . 2]" 1
1099 1 87 PHE QD 1 90 LEU MD1 1.800 . 5.000 4.163 3.285 4.568 . 0 0 "[ . 1 . 2]" 1
1100 1 87 PHE QD 1 90 LEU MD2 1.800 . 5.000 4.219 3.853 4.796 . 0 0 "[ . 1 . 2]" 1
1101 1 87 PHE QE 1 90 LEU MD1 1.800 . 5.000 3.086 2.073 3.859 . 0 0 "[ . 1 . 2]" 1
1102 1 87 PHE QE 1 90 LEU MD2 1.800 . 5.000 2.779 2.033 4.090 . 0 0 "[ . 1 . 2]" 1
1103 1 87 PHE HZ 1 89 GLY QA 1.800 . 6.000 5.190 3.294 6.032 0.032 9 0 "[ . 1 . 2]" 1
1104 1 87 PHE HZ 1 90 LEU HA 1.800 . 5.000 4.618 4.044 5.027 0.027 12 0 "[ . 1 . 2]" 1
1105 1 87 PHE HZ 1 90 LEU MD1 1.800 . 5.000 3.498 2.075 4.631 . 0 0 "[ . 1 . 2]" 1
1106 1 87 PHE HZ 1 90 LEU MD2 1.800 . 5.000 2.929 2.021 4.573 . 0 0 "[ . 1 . 2]" 1
1107 1 87 PHE HZ 1 90 LEU HG 1.800 . 5.000 4.324 3.616 5.151 0.151 8 0 "[ . 1 . 2]" 1
1108 1 87 PHE HZ 2 1 HEC HHC 1.800 . 6.000 6.030 5.735 6.163 0.163 7 0 "[ . 1 . 2]" 1
1109 1 89 GLY QA 1 90 LEU H 1.800 . 5.000 2.410 2.157 2.967 . 0 0 "[ . 1 . 2]" 1
1110 1 90 LEU H 1 90 LEU HB2 1.800 . 3.500 2.476 2.277 2.664 . 0 0 "[ . 1 . 2]" 1
1111 1 90 LEU H 1 90 LEU HB3 1.800 . 3.500 3.381 2.853 3.661 0.161 13 0 "[ . 1 . 2]" 1
1112 1 90 LEU H 1 90 LEU MD1 1.800 . 3.500 3.536 3.335 3.640 0.140 10 0 "[ . 1 . 2]" 1
1113 1 90 LEU H 1 90 LEU MD2 1.800 . 5.000 3.643 2.602 4.396 . 0 0 "[ . 1 . 2]" 1
1114 1 90 LEU H 1 90 LEU HG 1.800 . 5.000 2.984 1.930 4.558 . 0 0 "[ . 1 . 2]" 1
1115 1 90 LEU HA 1 90 LEU MD1 1.800 . 5.000 3.234 2.074 3.909 . 0 0 "[ . 1 . 2]" 1
1116 1 90 LEU HA 1 90 LEU MD2 1.800 . 5.000 2.689 2.038 3.741 . 0 0 "[ . 1 . 2]" 1
1117 1 90 LEU HA 1 96 ARG H 1.800 . 5.000 5.154 5.050 5.247 0.247 19 0 "[ . 1 . 2]" 1
1118 1 90 LEU HB2 1 90 LEU MD1 1.800 . 3.500 2.270 2.170 2.464 . 0 0 "[ . 1 . 2]" 1
1119 1 90 LEU HB2 1 90 LEU MD2 1.800 . 3.500 2.924 2.302 3.208 . 0 0 "[ . 1 . 2]" 1
1120 1 90 LEU HB3 1 90 LEU MD1 1.800 . 3.500 2.685 2.218 3.178 . 0 0 "[ . 1 . 2]" 1
1121 1 90 LEU HB3 1 90 LEU MD2 1.800 . 3.500 2.286 2.171 2.441 . 0 0 "[ . 1 . 2]" 1
1122 1 90 LEU MD1 1 95 ASP H 1.800 . 6.000 5.200 4.377 5.620 . 0 0 "[ . 1 . 2]" 1
1123 1 90 LEU MD1 1 95 ASP HA 1.800 . 5.000 4.722 4.143 5.077 0.077 17 0 "[ . 1 . 2]" 1
1124 1 90 LEU MD1 1 95 ASP HB2 1.800 . 3.500 3.224 2.231 3.629 0.129 13 0 "[ . 1 . 2]" 1
1125 1 90 LEU MD1 1 95 ASP HB3 1.800 . 3.500 2.939 2.070 3.535 0.035 11 0 "[ . 1 . 2]" 1
1126 1 90 LEU MD2 1 95 ASP H 1.800 . 6.000 5.045 4.665 5.523 . 0 0 "[ . 1 . 2]" 1
1127 1 90 LEU MD2 1 95 ASP HA 1.800 . 5.000 4.573 4.284 4.926 . 0 0 "[ . 1 . 2]" 1
1128 1 90 LEU MD2 1 95 ASP HB2 1.800 . 3.500 2.975 2.437 3.639 0.139 5 0 "[ . 1 . 2]" 1
1129 1 90 LEU MD2 1 95 ASP HB3 1.800 . 3.500 2.584 2.221 3.339 . 0 0 "[ . 1 . 2]" 1
1130 1 91 LYS H 1 91 LYS HA 1.800 . 2.900 2.823 2.803 2.842 . 0 0 "[ . 1 . 2]" 1
1131 1 91 LYS H 1 91 LYS HB2 1.800 . 3.500 2.481 2.448 2.517 . 0 0 "[ . 1 . 2]" 1
1132 1 91 LYS H 1 91 LYS HB3 1.800 . 3.500 3.175 2.632 3.603 0.103 17 0 "[ . 1 . 2]" 1
1133 1 91 LYS HA 1 92 LYS H 1.800 . 3.500 3.524 3.510 3.541 0.041 4 0 "[ . 1 . 2]" 1
1134 1 91 LYS QB 1 92 LYS H 1.800 . 5.000 2.727 2.625 2.813 . 0 0 "[ . 1 . 2]" 1
1135 1 92 LYS H 1 92 LYS HB2 1.800 . 3.500 2.483 2.442 2.557 . 0 0 "[ . 1 . 2]" 1
1136 1 92 LYS H 1 92 LYS QG 1.800 . 5.000 2.520 2.056 4.062 . 0 0 "[ . 1 . 2]" 1
1137 1 92 LYS QB 1 95 ASP H 1.800 . 5.000 2.779 2.644 2.984 . 0 0 "[ . 1 . 2]" 1
1138 1 93 GLU H 1 93 GLU HA 1.800 . 2.900 2.861 2.848 2.880 . 0 0 "[ . 1 . 2]" 1
1139 1 93 GLU H 1 93 GLU QB 1.800 . 3.500 2.411 2.261 2.446 . 0 0 "[ . 1 . 2]" 1
1140 1 93 GLU H 1 94 LYS H 1.800 . 3.500 2.633 2.559 2.682 . 0 0 "[ . 1 . 2]" 1
1141 1 93 GLU H 1 95 ASP H 1.800 . 5.000 4.595 4.436 4.764 . 0 0 "[ . 1 . 2]" 1
1142 1 93 GLU HA 1 93 GLU HB2 1.800 . 2.900 2.939 2.399 3.024 0.124 3 0 "[ . 1 . 2]" 1
1143 1 93 GLU HA 1 93 GLU HB3 1.800 . 2.900 2.549 2.485 3.020 0.120 10 0 "[ . 1 . 2]" 1
1144 1 93 GLU HA 1 94 LYS H 1.800 . 3.500 3.505 3.446 3.526 0.026 20 0 "[ . 1 . 2]" 1
1145 1 93 GLU HA 1 95 ASP H 1.800 . 5.000 4.389 4.211 4.610 . 0 0 "[ . 1 . 2]" 1
1146 1 93 GLU HA 1 96 ARG H 1.800 . 5.000 3.394 3.194 3.639 . 0 0 "[ . 1 . 2]" 1
1147 1 93 GLU HA 1 96 ARG QB 1.800 . 5.000 2.550 2.257 2.961 . 0 0 "[ . 1 . 2]" 1
1148 1 93 GLU HA 1 97 ASN H 1.800 . 5.000 3.775 3.379 4.364 . 0 0 "[ . 1 . 2]" 1
1149 1 93 GLU HB2 1 94 LYS H 1.800 . 5.000 3.045 2.771 4.166 . 0 0 "[ . 1 . 2]" 1
1150 1 93 GLU HB3 1 94 LYS H 1.800 . 5.000 3.756 2.868 4.052 . 0 0 "[ . 1 . 2]" 1
1151 1 94 LYS H 1 94 LYS HA 1.800 . 2.900 2.820 2.805 2.832 . 0 0 "[ . 1 . 2]" 1
1152 1 94 LYS H 1 94 LYS HB2 1.800 . 3.500 2.449 2.386 2.509 . 0 0 "[ . 1 . 2]" 1
1153 1 94 LYS H 1 94 LYS HB3 1.800 . 3.500 3.196 2.689 3.602 0.102 9 0 "[ . 1 . 2]" 1
1154 1 94 LYS H 1 94 LYS QG 1.800 . 5.000 2.938 2.070 4.066 . 0 0 "[ . 1 . 2]" 1
1155 1 94 LYS H 1 95 ASP H 1.800 . 2.900 2.860 2.797 2.917 0.017 18 0 "[ . 1 . 2]" 1
1156 1 94 LYS H 1 97 ASN QD 1.800 . 5.000 4.795 4.294 5.014 0.014 5 0 "[ . 1 . 2]" 1
1157 1 94 LYS HA 1 94 LYS QG 1.800 . 3.500 2.341 2.318 2.636 . 0 0 "[ . 1 . 2]" 1
1158 1 94 LYS HA 1 95 ASP H 1.800 . 3.500 3.571 3.558 3.586 0.086 16 0 "[ . 1 . 2]" 1
1159 1 94 LYS HA 1 96 ARG H 1.800 . 5.000 4.757 4.463 5.044 0.044 15 0 "[ . 1 . 2]" 1
1160 1 94 LYS HA 1 97 ASN H 1.800 . 5.000 3.690 3.432 3.920 . 0 0 "[ . 1 . 2]" 1
1161 1 94 LYS HA 1 97 ASN HB2 1.800 . 5.000 2.875 2.673 3.156 . 0 0 "[ . 1 . 2]" 1
1162 1 94 LYS HA 1 97 ASN HB3 1.800 . 5.000 4.492 4.272 4.793 . 0 0 "[ . 1 . 2]" 1
1163 1 94 LYS HA 1 98 ASP H 1.800 . 5.000 3.855 3.378 4.218 . 0 0 "[ . 1 . 2]" 1
1164 1 94 LYS HB2 1 95 ASP H 1.800 . 3.500 3.027 2.414 3.688 0.188 3 0 "[ . 1 . 2]" 1
1165 1 94 LYS HB3 1 95 ASP H 1.800 . 3.500 2.979 2.229 3.573 0.073 19 0 "[ . 1 . 2]" 1
1166 1 94 LYS QG 1 95 ASP H 1.800 . 5.000 3.830 3.483 4.060 . 0 0 "[ . 1 . 2]" 1
1167 1 95 ASP H 1 95 ASP HA 1.800 . 2.900 2.865 2.842 2.889 . 0 0 "[ . 1 . 2]" 1
1168 1 95 ASP H 1 95 ASP HB2 1.800 . 3.500 2.494 2.447 2.534 . 0 0 "[ . 1 . 2]" 1
1169 1 95 ASP H 1 95 ASP HB3 1.800 . 3.500 3.611 3.603 3.616 0.116 13 0 "[ . 1 . 2]" 1
1170 1 95 ASP H 1 96 ARG H 1.800 . 3.500 2.729 2.632 2.824 . 0 0 "[ . 1 . 2]" 1
1171 1 95 ASP H 1 97 ASN H 1.800 . 5.000 4.167 3.986 4.295 . 0 0 "[ . 1 . 2]" 1
1172 1 95 ASP HA 1 95 ASP HB3 1.800 . 2.900 2.483 2.462 2.504 . 0 0 "[ . 1 . 2]" 1
1173 1 95 ASP HA 1 96 ARG H 1.800 . 5.000 3.570 3.547 3.588 . 0 0 "[ . 1 . 2]" 1
1174 1 95 ASP HA 1 97 ASN H 1.800 . 5.000 4.502 4.329 4.651 . 0 0 "[ . 1 . 2]" 1
1175 1 95 ASP HA 1 98 ASP H 1.800 . 5.000 3.706 3.507 3.957 . 0 0 "[ . 1 . 2]" 1
1176 1 95 ASP HA 1 98 ASP QB 1.800 . 5.000 2.943 2.612 4.355 . 0 0 "[ . 1 . 2]" 1
1177 1 95 ASP HA 1 99 LEU H 1.800 . 5.000 3.757 3.395 4.153 . 0 0 "[ . 1 . 2]" 1
1178 1 95 ASP HB2 1 96 ARG H 1.800 . 3.500 2.399 2.208 2.543 . 0 0 "[ . 1 . 2]" 1
1179 1 95 ASP HB3 1 96 ARG H 1.800 . 3.500 3.463 3.315 3.576 0.076 17 0 "[ . 1 . 2]" 1
1180 1 96 ARG H 1 96 ARG QB 1.800 . 2.900 2.352 2.250 2.525 . 0 0 "[ . 1 . 2]" 1
1181 1 96 ARG H 1 96 ARG QG 1.800 . 5.000 3.208 1.954 3.977 . 0 0 "[ . 1 . 2]" 1
1182 1 96 ARG H 1 97 ASN H 1.800 . 3.500 2.809 2.742 2.855 . 0 0 "[ . 1 . 2]" 1
1183 1 96 ARG H 1 98 ASP H 1.800 . 5.000 4.459 4.222 4.839 . 0 0 "[ . 1 . 2]" 1
1184 1 96 ARG HA 1 97 ASN H 1.800 . 3.500 3.566 3.542 3.575 0.075 11 0 "[ . 1 . 2]" 1
1185 1 96 ARG HA 1 98 ASP H 1.800 . 5.000 4.818 4.547 5.062 0.062 9 0 "[ . 1 . 2]" 1
1186 1 96 ARG HA 1 99 LEU H 1.800 . 5.000 3.735 3.561 3.897 . 0 0 "[ . 1 . 2]" 1
1187 1 96 ARG HA 1 99 LEU HB2 1.800 . 5.000 3.032 2.512 3.557 . 0 0 "[ . 1 . 2]" 1
1188 1 96 ARG HA 1 99 LEU HB3 1.800 . 5.000 3.313 2.283 4.302 . 0 0 "[ . 1 . 2]" 1
1189 1 96 ARG HA 1 99 LEU QD 1.800 . 2.900 2.870 2.477 2.982 0.082 5 0 "[ . 1 . 2]" 1
1190 1 96 ARG HA 1 100 ILE H 1.800 . 5.000 4.068 3.651 4.467 . 0 0 "[ . 1 . 2]" 1
1191 1 96 ARG QB 1 97 ASN H 1.800 . 5.000 2.513 2.412 2.691 . 0 0 "[ . 1 . 2]" 1
1192 1 96 ARG QG 1 97 ASN H 1.800 . 5.000 3.723 3.267 4.140 . 0 0 "[ . 1 . 2]" 1
1193 1 97 ASN H 1 97 ASN HA 1.800 . 2.900 2.868 2.849 2.886 . 0 0 "[ . 1 . 2]" 1
1194 1 97 ASN H 1 97 ASN HB2 1.800 . 3.500 2.433 2.400 2.470 . 0 0 "[ . 1 . 2]" 1
1195 1 97 ASN H 1 97 ASN HB3 1.800 . 3.500 3.602 3.594 3.608 0.108 13 0 "[ . 1 . 2]" 1
1196 1 97 ASN H 1 97 ASN HD21 1.800 . 5.000 4.196 4.043 4.291 . 0 0 "[ . 1 . 2]" 1
1197 1 97 ASN H 1 97 ASN HD22 1.800 . 5.000 4.390 4.269 4.500 . 0 0 "[ . 1 . 2]" 1
1198 1 97 ASN H 1 98 ASP H 1.800 . 5.000 2.748 2.654 2.929 . 0 0 "[ . 1 . 2]" 1
1199 1 97 ASN H 1 99 LEU H 1.800 . 5.000 4.050 3.858 4.209 . 0 0 "[ . 1 . 2]" 1
1200 1 97 ASN HA 1 98 ASP H 1.800 . 3.500 3.567 3.549 3.582 0.082 18 0 "[ . 1 . 2]" 1
1201 1 97 ASN HA 1 99 LEU H 1.800 . 5.000 4.471 4.347 4.553 . 0 0 "[ . 1 . 2]" 1
1202 1 97 ASN HA 1 100 ILE H 1.800 . 5.000 3.995 3.806 4.170 . 0 0 "[ . 1 . 2]" 1
1203 1 97 ASN HA 1 100 ILE HB 1.800 . 5.000 3.528 3.253 3.794 . 0 0 "[ . 1 . 2]" 1
1204 1 97 ASN HA 1 101 THR H 1.800 . 5.000 4.299 4.129 4.553 . 0 0 "[ . 1 . 2]" 1
1205 1 97 ASN HB2 1 98 ASP H 1.800 . 3.500 2.421 2.164 2.581 . 0 0 "[ . 1 . 2]" 1
1206 1 97 ASN HB3 1 98 ASP H 1.800 . 3.500 3.392 3.117 3.541 0.041 2 0 "[ . 1 . 2]" 1
1207 1 98 ASP H 1 98 ASP QB 1.800 . 2.900 2.437 2.423 2.559 . 0 0 "[ . 1 . 2]" 1
1208 1 98 ASP H 1 99 LEU H 1.800 . 5.000 2.680 2.634 2.725 . 0 0 "[ . 1 . 2]" 1
1209 1 98 ASP H 1 100 ILE H 1.800 . 5.000 4.710 4.532 4.808 . 0 0 "[ . 1 . 2]" 1
1210 1 98 ASP HA 1 99 LEU H 1.800 . 3.500 3.538 3.513 3.554 0.054 16 0 "[ . 1 . 2]" 1
1211 1 98 ASP HA 1 100 ILE H 1.800 . 5.000 4.876 4.633 5.016 0.016 20 0 "[ . 1 . 2]" 1
1212 1 98 ASP HA 1 101 THR H 1.800 . 5.000 3.436 3.260 3.652 . 0 0 "[ . 1 . 2]" 1
1213 1 98 ASP HA 1 102 TYR H 1.800 . 5.000 4.436 4.226 4.591 . 0 0 "[ . 1 . 2]" 1
1214 1 98 ASP QB 1 99 LEU H 1.800 . 3.500 2.627 2.541 3.527 0.027 18 0 "[ . 1 . 2]" 1
1215 1 99 LEU H 1 99 LEU HA 1.800 . 2.900 2.814 2.794 2.834 . 0 0 "[ . 1 . 2]" 1
1216 1 99 LEU H 1 99 LEU QB 1.800 . 3.500 2.177 2.060 2.259 . 0 0 "[ . 1 . 2]" 1
1217 1 99 LEU H 1 99 LEU MD1 1.800 . 5.000 3.808 3.463 4.036 . 0 0 "[ . 1 . 2]" 1
1218 1 99 LEU H 1 99 LEU MD2 1.800 . 5.000 4.195 4.091 4.246 . 0 0 "[ . 1 . 2]" 1
1219 1 99 LEU H 1 99 LEU HG 1.800 . 5.000 3.822 3.111 4.462 . 0 0 "[ . 1 . 2]" 1
1220 1 99 LEU H 1 100 ILE H 1.800 . 5.000 2.993 2.880 3.061 . 0 0 "[ . 1 . 2]" 1
1221 1 99 LEU H 1 100 ILE QG 1.800 . 5.000 4.450 4.211 4.703 . 0 0 "[ . 1 . 2]" 1
1222 1 99 LEU H 1 100 ILE MG 1.800 . 6.000 6.077 6.021 6.117 0.117 1 0 "[ . 1 . 2]" 1
1223 1 99 LEU H 1 101 THR H 1.800 . 5.000 3.987 3.907 4.069 . 0 0 "[ . 1 . 2]" 1
1224 1 99 LEU HA 1 99 LEU MD1 1.800 . 5.000 2.870 2.021 3.686 . 0 0 "[ . 1 . 2]" 1
1225 1 99 LEU HA 1 99 LEU MD2 1.800 . 5.000 3.013 2.115 3.822 . 0 0 "[ . 1 . 2]" 1
1226 1 99 LEU HA 1 100 ILE H 1.800 . 3.500 3.556 3.551 3.562 0.062 10 0 "[ . 1 . 2]" 1
1227 1 99 LEU HA 1 101 THR H 1.800 . 5.000 4.356 4.292 4.420 . 0 0 "[ . 1 . 2]" 1
1228 1 99 LEU HA 1 102 TYR H 1.800 . 5.000 3.766 3.490 4.033 . 0 0 "[ . 1 . 2]" 1
1229 1 99 LEU HA 1 102 TYR QB 1.800 . 5.000 3.426 2.887 3.828 . 0 0 "[ . 1 . 2]" 1
1230 1 99 LEU HA 1 103 LEU H 1.800 . 5.000 4.333 3.887 4.796 . 0 0 "[ . 1 . 2]" 1
1231 1 99 LEU HA 1 103 LEU HG 1.800 . 5.000 4.025 3.613 4.542 . 0 0 "[ . 1 . 2]" 1
1232 1 99 LEU QB 1 99 LEU MD1 1.800 . 3.500 2.185 2.057 2.388 . 0 0 "[ . 1 . 2]" 1
1233 1 99 LEU QB 1 99 LEU MD2 1.800 . 3.500 2.124 2.039 2.230 . 0 0 "[ . 1 . 2]" 1
1234 1 99 LEU HB2 1 100 ILE H 1.800 . 3.500 3.115 2.531 3.700 0.200 4 0 "[ . 1 . 2]" 1
1235 1 99 LEU HB3 1 100 ILE H 1.800 . 3.500 2.315 2.064 2.576 . 0 0 "[ . 1 . 2]" 1
1236 1 99 LEU QD 1 100 ILE H 1.800 . 5.000 3.604 3.420 3.765 . 0 0 "[ . 1 . 2]" 1
1237 1 99 LEU QD 1 103 LEU H 1.800 . 5.000 3.906 3.537 4.282 . 0 0 "[ . 1 . 2]" 1
1238 1 99 LEU QD 1 103 LEU QB 1.800 . 5.000 4.212 3.865 4.411 . 0 0 "[ . 1 . 2]" 1
1239 1 99 LEU MD1 1 100 ILE HG12 1.800 . 5.000 5.101 5.033 5.147 0.147 17 0 "[ . 1 . 2]" 1
1240 1 99 LEU MD1 1 100 ILE HG13 1.800 . 5.000 4.605 4.401 4.873 . 0 0 "[ . 1 . 2]" 1
1241 1 99 LEU MD1 2 1 HEC HAB 1.800 . 5.000 4.787 4.422 5.078 0.078 18 0 "[ . 1 . 2]" 1
1242 1 99 LEU MD2 1 100 ILE HG12 1.800 . 5.000 4.660 3.967 5.089 0.089 10 0 "[ . 1 . 2]" 1
1243 1 99 LEU MD2 1 100 ILE HG13 1.800 . 5.000 4.285 3.309 5.017 0.017 3 0 "[ . 1 . 2]" 1
1244 1 99 LEU MD2 2 1 HEC HAB 1.800 . 5.000 4.809 4.323 5.043 0.043 6 0 "[ . 1 . 2]" 1
1245 1 99 LEU HG 1 103 LEU QD 1.800 . 5.000 3.270 2.151 4.399 . 0 0 "[ . 1 . 2]" 1
1246 1 99 LEU HG 1 103 LEU HG 1.800 . 5.000 4.319 3.286 5.123 0.123 12 0 "[ . 1 . 2]" 1
1247 1 100 ILE H 1 100 ILE HA 1.800 . 2.900 2.818 2.781 2.860 . 0 0 "[ . 1 . 2]" 1
1248 1 100 ILE H 1 100 ILE HB 1.800 . 2.900 2.524 2.421 2.620 . 0 0 "[ . 1 . 2]" 1
1249 1 100 ILE H 1 100 ILE MD 1.800 . 3.500 3.498 3.469 3.530 0.030 12 0 "[ . 1 . 2]" 1
1250 1 100 ILE H 1 100 ILE HG12 1.800 . 5.000 3.184 2.907 3.502 . 0 0 "[ . 1 . 2]" 1
1251 1 100 ILE H 1 100 ILE HG13 1.800 . 5.000 1.959 1.786 2.171 0.014 10 0 "[ . 1 . 2]" 1
1252 1 100 ILE H 1 100 ILE MG 1.800 . 3.500 3.728 3.713 3.746 0.246 4 0 "[ . 1 . 2]" 1
1253 1 100 ILE H 1 101 THR H 1.800 . 3.500 2.738 2.636 2.839 . 0 0 "[ . 1 . 2]" 1
1254 1 100 ILE H 1 102 TYR H 1.800 . 5.000 4.353 4.154 4.452 . 0 0 "[ . 1 . 2]" 1
1255 1 100 ILE HA 1 100 ILE MD 1.800 . 5.000 3.765 3.725 3.794 . 0 0 "[ . 1 . 2]" 1
1256 1 100 ILE HA 1 100 ILE MG 1.800 . 2.900 2.311 2.276 2.351 . 0 0 "[ . 1 . 2]" 1
1257 1 100 ILE HA 1 101 THR H 1.800 . 3.500 3.529 3.517 3.543 0.043 11 0 "[ . 1 . 2]" 1
1258 1 100 ILE HA 1 102 TYR H 1.800 . 5.000 4.090 4.014 4.143 . 0 0 "[ . 1 . 2]" 1
1259 1 100 ILE HA 1 103 LEU H 1.800 . 5.000 3.117 2.992 3.244 . 0 0 "[ . 1 . 2]" 1
1260 1 100 ILE HA 1 103 LEU QB 1.800 . 5.000 2.241 2.213 2.263 . 0 0 "[ . 1 . 2]" 1
1261 1 100 ILE HA 1 104 LYS H 1.800 . 5.000 3.281 3.064 3.523 . 0 0 "[ . 1 . 2]" 1
1262 1 100 ILE HB 1 101 THR H 1.800 . 3.500 2.789 2.678 2.909 . 0 0 "[ . 1 . 2]" 1
1263 1 100 ILE MD 1 100 ILE MG 1.800 . 2.900 1.911 1.800 2.017 . 0 0 "[ . 1 . 2]" 1
1264 1 100 ILE QG 1 100 ILE MG 1.800 . 2.900 2.299 2.253 2.338 . 0 0 "[ . 1 . 2]" 1
1265 1 100 ILE QG 1 103 LEU MD1 1.800 . 3.500 2.737 2.658 2.802 . 0 0 "[ . 1 . 2]" 1
1266 1 100 ILE QG 1 103 LEU MD2 1.800 . 5.000 5.152 5.063 5.209 0.209 17 0 "[ . 1 . 2]" 1
1267 1 100 ILE QG 1 104 LYS H 1.800 . 5.000 5.033 4.978 5.106 0.106 10 0 "[ . 1 . 2]" 1
1268 1 100 ILE MG 1 103 LEU H 1.800 . 5.000 4.387 4.060 4.678 . 0 0 "[ . 1 . 2]" 1
1269 1 100 ILE MG 1 104 LYS H 1.800 . 5.000 3.037 2.754 3.355 . 0 0 "[ . 1 . 2]" 1
1270 1 100 ILE MG 1 104 LYS HA 1.800 . 5.000 4.220 3.878 4.569 . 0 0 "[ . 1 . 2]" 1
1271 1 101 THR H 1 101 THR HB 1.800 . 3.500 2.689 2.634 2.727 . 0 0 "[ . 1 . 2]" 1
1272 1 101 THR H 1 101 THR MG 1.800 . 3.500 3.730 3.723 3.739 0.239 3 0 "[ . 1 . 2]" 1
1273 1 101 THR H 1 102 TYR H 1.800 . 3.500 2.759 2.655 2.833 . 0 0 "[ . 1 . 2]" 1
1274 1 101 THR H 1 103 LEU H 1.800 . 5.000 4.273 4.224 4.312 . 0 0 "[ . 1 . 2]" 1
1275 1 101 THR HA 1 101 THR MG 1.800 . 2.900 2.316 2.267 2.356 . 0 0 "[ . 1 . 2]" 1
1276 1 101 THR HA 1 102 TYR H 1.800 . 3.500 3.549 3.528 3.555 0.055 5 0 "[ . 1 . 2]" 1
1277 1 101 THR HA 1 103 LEU H 1.800 . 5.000 4.893 4.689 5.023 0.023 16 0 "[ . 1 . 2]" 1
1278 1 101 THR HA 1 104 LYS H 1.800 . 5.000 4.060 3.812 4.354 . 0 0 "[ . 1 . 2]" 1
1279 1 101 THR HA 1 104 LYS QB 1.800 . 5.000 3.139 2.923 3.564 . 0 0 "[ . 1 . 2]" 1
1280 1 101 THR HA 1 104 LYS QD 1.800 . 5.000 3.984 3.776 4.497 . 0 0 "[ . 1 . 2]" 1
1281 1 101 THR HA 1 105 LYS H 1.800 . 5.000 4.261 3.984 4.420 . 0 0 "[ . 1 . 2]" 1
1282 1 101 THR HB 1 102 TYR H 1.800 . 3.500 2.576 2.515 2.657 . 0 0 "[ . 1 . 2]" 1
1283 1 102 TYR H 1 102 TYR HA 1.800 . 2.900 2.915 2.894 2.930 0.030 20 0 "[ . 1 . 2]" 1
1284 1 102 TYR H 1 102 TYR HB2 1.800 . 3.500 2.775 2.719 2.847 . 0 0 "[ . 1 . 2]" 1
1285 1 102 TYR H 1 102 TYR HB3 1.800 . 3.500 2.403 2.377 2.425 . 0 0 "[ . 1 . 2]" 1
1286 1 102 TYR H 1 103 LEU H 1.800 . 3.500 2.545 2.506 2.581 . 0 0 "[ . 1 . 2]" 1
1287 1 102 TYR H 1 103 LEU MD1 1.800 . 5.000 4.949 4.839 5.030 0.030 1 0 "[ . 1 . 2]" 1
1288 1 102 TYR H 1 103 LEU MD2 1.800 . 5.000 5.105 5.066 5.137 0.137 9 0 "[ . 1 . 2]" 1
1289 1 102 TYR H 1 104 LYS H 1.800 . 5.000 4.111 3.991 4.224 . 0 0 "[ . 1 . 2]" 1
1290 1 102 TYR HA 1 103 LEU H 1.800 . 3.500 3.570 3.558 3.580 0.080 10 0 "[ . 1 . 2]" 1
1291 1 102 TYR HA 1 104 LYS H 1.800 . 5.000 4.575 4.452 4.694 . 0 0 "[ . 1 . 2]" 1
1292 1 102 TYR HA 1 105 LYS H 1.800 . 5.000 3.376 3.260 3.474 . 0 0 "[ . 1 . 2]" 1
1293 1 102 TYR HA 1 105 LYS HB2 1.800 . 5.000 2.944 2.780 3.109 . 0 0 "[ . 1 . 2]" 1
1294 1 102 TYR HA 1 105 LYS HB3 1.800 . 5.000 2.784 2.545 3.160 . 0 0 "[ . 1 . 2]" 1
1295 1 102 TYR HA 1 106 ALA H 1.800 . 5.000 4.198 3.892 4.529 . 0 0 "[ . 1 . 2]" 1
1296 1 102 TYR HB2 1 103 LEU H 1.800 . 5.000 3.881 3.847 3.911 . 0 0 "[ . 1 . 2]" 1
1297 1 102 TYR HB3 1 103 LEU H 1.800 . 5.000 2.492 2.438 2.550 . 0 0 "[ . 1 . 2]" 1
1298 1 102 TYR QE 1 103 LEU HG 1.800 . 5.000 5.075 5.057 5.107 0.107 5 0 "[ . 1 . 2]" 1
1299 1 103 LEU H 1 103 LEU HA 1.800 . 2.900 2.830 2.808 2.851 . 0 0 "[ . 1 . 2]" 1
1300 1 103 LEU H 1 103 LEU MD1 1.800 . 5.000 3.427 3.376 3.466 . 0 0 "[ . 1 . 2]" 1
1301 1 103 LEU H 1 103 LEU MD2 1.800 . 5.000 3.161 3.113 3.203 . 0 0 "[ . 1 . 2]" 1
1302 1 103 LEU H 1 103 LEU HG 1.800 . 5.000 1.918 1.849 1.962 . 0 0 "[ . 1 . 2]" 1
1303 1 103 LEU H 1 104 LYS H 1.800 . 3.500 2.823 2.737 2.941 . 0 0 "[ . 1 . 2]" 1
1304 1 103 LEU H 1 105 LYS H 1.800 . 5.000 4.095 4.035 4.151 . 0 0 "[ . 1 . 2]" 1
1305 1 103 LEU HA 1 103 LEU MD1 1.800 . 5.000 3.846 3.825 3.879 . 0 0 "[ . 1 . 2]" 1
1306 1 103 LEU HA 1 103 LEU MD2 1.800 . 5.000 2.143 2.113 2.182 . 0 0 "[ . 1 . 2]" 1
1307 1 103 LEU HA 1 104 LYS H 1.800 . 3.500 3.562 3.553 3.576 0.076 17 0 "[ . 1 . 2]" 1
1308 1 103 LEU HA 1 105 LYS H 1.800 . 5.000 4.377 4.295 4.512 . 0 0 "[ . 1 . 2]" 1
1309 1 103 LEU HA 1 106 ALA H 1.800 . 5.000 3.518 3.453 3.606 . 0 0 "[ . 1 . 2]" 1
1310 1 103 LEU HA 1 106 ALA MB 1.800 . 5.000 2.876 2.738 3.086 . 0 0 "[ . 1 . 2]" 1
1311 1 103 LEU HA 1 107 THR H 1.800 . 5.000 3.994 3.790 4.084 . 0 0 "[ . 1 . 2]" 1
1312 1 103 LEU QB 1 103 LEU MD1 1.800 . 5.000 2.097 2.073 2.111 . 0 0 "[ . 1 . 2]" 1
1313 1 103 LEU QB 1 103 LEU MD2 1.800 . 5.000 2.172 2.162 2.181 . 0 0 "[ . 1 . 2]" 1
1314 1 103 LEU QB 1 104 LYS H 1.800 . 3.500 2.350 2.240 2.458 . 0 0 "[ . 1 . 2]" 1
1315 1 103 LEU QD 1 107 THR H 1.800 . 5.000 5.013 4.863 5.049 0.049 12 0 "[ . 1 . 2]" 1
1316 1 103 LEU MD1 1 104 LYS H 1.800 . 5.000 4.267 4.145 4.381 . 0 0 "[ . 1 . 2]" 1
1317 1 103 LEU MD2 1 104 LYS H 1.800 . 5.000 4.578 4.549 4.611 . 0 0 "[ . 1 . 2]" 1
1318 1 104 LYS H 1 104 LYS HA 1.800 . 2.900 2.849 2.841 2.857 . 0 0 "[ . 1 . 2]" 1
1319 1 104 LYS H 1 104 LYS HB2 1.800 . 3.500 2.556 2.503 2.619 . 0 0 "[ . 1 . 2]" 1
1320 1 104 LYS H 1 104 LYS HB3 1.800 . 3.500 2.539 2.478 2.605 . 0 0 "[ . 1 . 2]" 1
1321 1 104 LYS H 1 104 LYS QD 1.800 . 5.000 4.421 4.395 4.580 . 0 0 "[ . 1 . 2]" 1
1322 1 104 LYS H 1 104 LYS QG 1.800 . 5.000 3.983 3.979 3.988 . 0 0 "[ . 1 . 2]" 1
1323 1 104 LYS H 1 105 LYS H 1.800 . 3.500 2.686 2.657 2.706 . 0 0 "[ . 1 . 2]" 1
1324 1 104 LYS H 1 106 ALA H 1.800 . 5.000 4.246 4.209 4.286 . 0 0 "[ . 1 . 2]" 1
1325 1 104 LYS HA 1 104 LYS HB2 1.800 . 2.900 2.463 2.436 2.495 . 0 0 "[ . 1 . 2]" 1
1326 1 104 LYS HA 1 104 LYS HB3 1.800 . 2.900 3.022 3.017 3.023 0.123 11 0 "[ . 1 . 2]" 1
1327 1 104 LYS HA 1 104 LYS QD 1.800 . 5.000 4.004 3.981 4.028 . 0 0 "[ . 1 . 2]" 1
1328 1 104 LYS HA 1 104 LYS QG 1.800 . 3.500 2.414 2.362 2.461 . 0 0 "[ . 1 . 2]" 1
1329 1 104 LYS HA 1 105 LYS H 1.800 . 3.500 3.540 3.532 3.546 0.046 17 0 "[ . 1 . 2]" 1
1330 1 104 LYS HA 1 107 THR H 1.800 . 5.000 3.368 3.303 3.482 . 0 0 "[ . 1 . 2]" 1
1331 1 104 LYS HA 1 107 THR HB 1.800 . 5.000 2.450 2.335 2.508 . 0 0 "[ . 1 . 2]" 1
1332 1 104 LYS HB2 1 105 LYS H 1.800 . 5.000 3.912 3.858 3.972 . 0 0 "[ . 1 . 2]" 1
1333 1 104 LYS HB3 1 105 LYS H 1.800 . 5.000 2.640 2.605 2.695 . 0 0 "[ . 1 . 2]" 1
1334 1 105 LYS H 1 105 LYS HA 1.800 . 2.900 2.844 2.842 2.848 . 0 0 "[ . 1 . 2]" 1
1335 1 105 LYS H 1 105 LYS HB2 1.800 . 2.900 2.400 2.388 2.425 . 0 0 "[ . 1 . 2]" 1
1336 1 105 LYS H 1 105 LYS HB3 1.800 . 2.900 2.692 2.662 2.707 . 0 0 "[ . 1 . 2]" 1
1337 1 105 LYS H 1 106 ALA H 1.800 . 2.900 2.707 2.690 2.721 . 0 0 "[ . 1 . 2]" 1
1338 1 105 LYS H 1 107 THR H 1.800 . 5.000 4.222 4.167 4.263 . 0 0 "[ . 1 . 2]" 1
1339 1 105 LYS HA 1 106 ALA H 1.800 . 3.500 3.533 3.527 3.537 0.037 10 0 "[ . 1 . 2]" 1
1340 1 105 LYS HA 1 108 GLU H 1.800 . 5.000 3.477 3.426 3.581 . 0 0 "[ . 1 . 2]" 1
1341 1 105 LYS HA 1 108 GLU QB 1.800 . 5.000 2.414 2.349 2.496 . 0 0 "[ . 1 . 2]" 1
1342 1 105 LYS HB2 1 106 ALA H 1.800 . 3.500 3.684 3.678 3.698 0.198 1 0 "[ . 1 . 2]" 1
1343 1 105 LYS HB3 1 106 ALA H 1.800 . 3.500 2.450 2.424 2.485 . 0 0 "[ . 1 . 2]" 1
1344 1 106 ALA H 1 106 ALA HA 1.800 . 2.900 2.889 2.884 2.895 . 0 0 "[ . 1 . 2]" 1
1345 1 106 ALA H 1 106 ALA MB 1.800 . 3.500 2.136 2.062 2.238 . 0 0 "[ . 1 . 2]" 1
1346 1 106 ALA H 1 107 THR H 1.800 . 2.900 2.637 2.608 2.655 . 0 0 "[ . 1 . 2]" 1
1347 1 106 ALA H 1 108 GLU H 1.800 . 3.500 3.691 3.676 3.705 0.205 17 0 "[ . 1 . 2]" 1
1348 1 106 ALA HA 1 108 GLU H 1.800 . 5.000 4.112 4.082 4.145 . 0 0 "[ . 1 . 2]" 1
1349 1 106 ALA MB 1 107 THR H 1.800 . 3.500 2.416 2.294 2.510 . 0 0 "[ . 1 . 2]" 1
1350 1 107 THR H 1 108 GLU H 1.800 . 2.900 2.571 2.558 2.587 . 0 0 "[ . 1 . 2]" 1
1351 1 107 THR HA 1 108 GLU H 1.800 . 5.000 3.507 3.505 3.512 . 0 0 "[ . 1 . 2]" 1
1352 1 107 THR HB 1 108 GLU H 1.800 . 2.900 2.799 2.787 2.810 . 0 0 "[ . 1 . 2]" 1
1353 1 108 GLU H 1 108 GLU HA 1.800 . 2.900 2.901 2.777 2.951 0.051 7 0 "[ . 1 . 2]" 1
1354 1 108 GLU H 1 108 GLU HB2 1.800 . 2.900 2.583 2.426 2.690 . 0 0 "[ . 1 . 2]" 1
1355 1 108 GLU H 1 108 GLU HB3 1.800 . 2.900 2.594 2.555 2.753 . 0 0 "[ . 1 . 2]" 1
1356 2 1 HEC HAA1 2 1 HEC HBA1 1.800 . 2.900 2.057 2.041 2.102 . 0 0 "[ . 1 . 2]" 1
1357 2 1 HEC HAA1 2 1 HEC HHA 1.800 . 2.900 2.119 2.081 2.204 . 0 0 "[ . 1 . 2]" 1
1358 2 1 HEC HAA1 2 1 HEC HHA 1.800 . 3.500 2.137 2.100 2.220 . 0 0 "[ . 1 . 2]" 1
1359 2 1 HEC HAB 2 1 HEC HHC 1.800 . 5.000 2.128 2.113 2.148 . 0 0 "[ . 1 . 2]" 1
1360 2 1 HEC HAC 2 1 HEC HHD 1.800 . 5.000 2.168 2.149 2.194 . 0 0 "[ . 1 . 2]" 1
1361 2 1 HEC HAD1 2 1 HEC HBD1 1.800 . 5.000 2.444 2.253 2.536 . 0 0 "[ . 1 . 2]" 1
1362 2 1 HEC HAD2 2 1 HEC HBD1 1.800 . 5.000 2.265 2.151 2.466 . 0 0 "[ . 1 . 2]" 1
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