NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
426595 |
2hc5   |
7170 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2hc5
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 2589
_Distance_constraint_stats_list.Viol_count 1126
_Distance_constraint_stats_list.Viol_total 1694.848
_Distance_constraint_stats_list.Viol_max 1.370
_Distance_constraint_stats_list.Viol_rms 0.0169
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0016
_Distance_constraint_stats_list.Viol_average_violations_only 0.0753
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 LEU 0.007 0.007 12 0 "[ . 1 . 2]"
1 2 ASN 1.305 0.353 4 0 "[ . 1 . 2]"
1 3 ILE 4.815 0.854 2 4 "[*+*-. 1 . 2]"
1 4 GLU 0.555 0.092 16 0 "[ . 1 . 2]"
1 5 ARG 2.294 0.216 20 0 "[ . 1 . 2]"
1 6 LEU 2.715 0.216 20 0 "[ . 1 . 2]"
1 7 THR 2.266 0.179 2 0 "[ . 1 . 2]"
1 8 THR 0.228 0.068 3 0 "[ . 1 . 2]"
1 9 LEU 0.427 0.089 11 0 "[ . 1 . 2]"
1 10 GLN 0.097 0.048 18 0 "[ . 1 . 2]"
1 11 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 VAL 0.612 0.078 7 0 "[ . 1 . 2]"
1 13 TRP 2.440 0.261 20 0 "[ . 1 . 2]"
1 14 ASP 0.266 0.058 16 0 "[ . 1 . 2]"
1 15 ARG 0.921 0.273 10 0 "[ . 1 . 2]"
1 16 TYR 1.947 0.216 5 0 "[ . 1 . 2]"
1 17 ASP 0.371 0.083 18 0 "[ . 1 . 2]"
1 18 THR 1.831 0.179 17 0 "[ . 1 . 2]"
1 19 GLN 3.737 0.214 16 0 "[ . 1 . 2]"
1 20 ILE 4.978 0.219 7 0 "[ . 1 . 2]"
1 21 HIS 1.181 0.179 17 0 "[ . 1 . 2]"
1 22 ASN 0.194 0.105 6 0 "[ . 1 . 2]"
1 23 GLN 0.180 0.092 7 0 "[ . 1 . 2]"
1 24 LYS 0.301 0.104 7 0 "[ . 1 . 2]"
1 25 ASP 0.207 0.104 7 0 "[ . 1 . 2]"
1 27 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 28 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 29 GLU 1.375 0.322 3 0 "[ . 1 . 2]"
1 30 VAL 2.758 0.322 3 0 "[ . 1 . 2]"
1 31 PRO 1.860 0.171 4 0 "[ . 1 . 2]"
1 32 VAL 6.433 0.240 5 0 "[ . 1 . 2]"
1 33 HIS 4.787 0.240 5 0 "[ . 1 . 2]"
1 34 GLN 0.579 0.346 9 0 "[ . 1 . 2]"
1 35 VAL 1.518 0.346 9 0 "[ . 1 . 2]"
1 36 SER 0.236 0.110 10 0 "[ . 1 . 2]"
1 37 TYR 0.196 0.068 13 0 "[ . 1 . 2]"
1 38 THR 0.934 0.244 10 0 "[ . 1 . 2]"
1 39 ASN 3.167 0.244 10 0 "[ . 1 . 2]"
1 40 LEU 0.287 0.073 12 0 "[ . 1 . 2]"
1 41 ALA 0.517 0.196 10 0 "[ . 1 . 2]"
1 42 GLU 1.441 0.104 12 0 "[ . 1 . 2]"
1 43 MET 0.670 0.149 12 0 "[ . 1 . 2]"
1 44 VAL 0.363 0.196 10 0 "[ . 1 . 2]"
1 45 GLY 0.235 0.127 9 0 "[ . 1 . 2]"
1 46 GLU 0.995 0.118 2 0 "[ . 1 . 2]"
1 47 MET 0.841 0.085 19 0 "[ . 1 . 2]"
1 48 ASN 0.350 0.127 9 0 "[ . 1 . 2]"
1 49 LYS 0.965 0.118 2 0 "[ . 1 . 2]"
1 50 LEU 1.015 0.111 10 0 "[ . 1 . 2]"
1 51 LEU 3.219 1.370 4 1 "[ +. 1 . 2]"
1 52 GLU 3.840 0.268 7 0 "[ . 1 . 2]"
1 53 PRO 1.015 0.224 6 0 "[ . 1 . 2]"
1 54 SER 4.865 0.854 2 4 "[*+*-. 1 . 2]"
1 55 GLN 1.975 0.179 2 0 "[ . 1 . 2]"
1 56 VAL 1.953 0.143 8 0 "[ . 1 . 2]"
1 57 HIS 0.029 0.029 5 0 "[ . 1 . 2]"
1 58 LEU 0.997 0.154 2 0 "[ . 1 . 2]"
1 59 LYS 0.960 0.223 7 0 "[ . 1 . 2]"
1 60 PHE 2.199 1.370 4 1 "[ +. 1 . 2]"
1 61 GLU 1.703 0.157 6 0 "[ . 1 . 2]"
1 62 LEU 1.680 0.178 9 0 "[ . 1 . 2]"
1 63 HIS 0.104 0.043 20 0 "[ . 1 . 2]"
1 64 ASP 1.867 0.178 9 0 "[ . 1 . 2]"
1 65 LYS 1.499 0.190 19 0 "[ . 1 . 2]"
1 66 LEU 1.583 0.209 18 0 "[ . 1 . 2]"
1 67 ASN 0.137 0.067 6 0 "[ . 1 . 2]"
1 68 GLU 1.952 0.203 15 0 "[ . 1 . 2]"
1 69 TYR 0.883 0.159 2 0 "[ . 1 . 2]"
1 70 TYR 0.800 0.520 15 1 "[ . 1 + 2]"
1 71 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 72 LYS 4.287 0.212 11 0 "[ . 1 . 2]"
1 73 VAL 0.413 0.261 20 0 "[ . 1 . 2]"
1 74 ILE 0.431 0.223 7 0 "[ . 1 . 2]"
1 75 GLU 1.184 0.252 16 0 "[ . 1 . 2]"
1 76 ASP 0.251 0.052 19 0 "[ . 1 . 2]"
1 77 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 78 THR 0.026 0.026 3 0 "[ . 1 . 2]"
1 79 ASN 0.341 0.252 16 0 "[ . 1 . 2]"
1 80 GLU 0.143 0.048 16 0 "[ . 1 . 2]"
1 81 VAL 0.169 0.048 16 0 "[ . 1 . 2]"
1 82 ILE 0.856 0.086 7 0 "[ . 1 . 2]"
1 83 ARG 2.537 0.188 4 0 "[ . 1 . 2]"
1 84 GLU 1.114 0.520 15 1 "[ . 1 + 2]"
1 85 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 86 PRO 0.571 0.166 5 0 "[ . 1 . 2]"
1 87 PRO 0.113 0.043 10 0 "[ . 1 . 2]"
1 88 LYS 0.002 0.002 5 0 "[ . 1 . 2]"
1 89 ARG 2.062 0.166 5 0 "[ . 1 . 2]"
1 90 TRP 1.127 0.150 20 0 "[ . 1 . 2]"
1 91 LEU 1.717 0.354 3 0 "[ . 1 . 2]"
1 92 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 93 PHE 0.640 0.080 4 0 "[ . 1 . 2]"
1 94 TYR 0.181 0.076 12 0 "[ . 1 . 2]"
1 95 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 96 ALA 0.100 0.033 11 0 "[ . 1 . 2]"
1 97 MET 0.198 0.063 19 0 "[ . 1 . 2]"
1 98 THR 2.926 0.222 1 0 "[ . 1 . 2]"
1 99 GLU 0.947 0.160 11 0 "[ . 1 . 2]"
1 100 PHE 0.551 0.098 1 0 "[ . 1 . 2]"
1 101 LEU 0.255 0.174 15 0 "[ . 1 . 2]"
1 102 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 103 LEU 2.781 0.222 1 0 "[ . 1 . 2]"
1 104 PHE 0.074 0.041 3 0 "[ . 1 . 2]"
1 105 VAL 2.461 0.402 3 0 "[ . 1 . 2]"
1 106 ASP 2.495 0.309 18 0 "[ . 1 . 2]"
1 107 GLU 5.339 0.402 3 0 "[ . 1 . 2]"
1 108 LYS 1.726 0.202 13 0 "[ . 1 . 2]"
1 109 LYS 0.412 0.174 9 0 "[ . 1 . 2]"
1 110 LEU 4.148 0.195 1 0 "[ . 1 . 2]"
1 111 GLU 4.298 0.411 4 0 "[ . 1 . 2]"
1 112 HIS 3.401 0.242 9 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 LEU QB 1 2 ASN H . . 5.140 2.793 1.765 3.836 . 0 0 "[ . 1 . 2]" 1
2 1 1 LEU QB 1 104 PHE HA . . 6.030 3.688 1.735 5.013 . 0 0 "[ . 1 . 2]" 1
3 1 1 LEU QB 1 104 PHE QE . . 7.990 2.821 1.862 4.740 . 0 0 "[ . 1 . 2]" 1
4 1 1 LEU HB2 1 2 ASN H . . 5.120 3.464 1.859 4.500 . 0 0 "[ . 1 . 2]" 1
5 1 1 LEU HB2 1 104 PHE QD . . 7.730 3.763 2.670 5.534 . 0 0 "[ . 1 . 2]" 1
6 1 1 LEU HB2 1 104 PHE QE . . 7.820 3.898 2.315 5.448 . 0 0 "[ . 1 . 2]" 1
7 1 1 LEU HB3 1 2 ASN H . . 5.120 3.221 1.777 4.416 . 0 0 "[ . 1 . 2]" 1
8 1 1 LEU HB3 1 104 PHE QD . . 7.730 3.328 2.360 5.586 . 0 0 "[ . 1 . 2]" 1
9 1 1 LEU HB3 1 104 PHE QE . . 7.820 3.084 1.869 5.226 . 0 0 "[ . 1 . 2]" 1
10 1 1 LEU QD 1 2 ASN H . . 6.780 3.604 2.599 4.431 . 0 0 "[ . 1 . 2]" 1
11 1 1 LEU QD 1 2 ASN QB . . 9.010 5.054 4.416 5.665 . 0 0 "[ . 1 . 2]" 1
12 1 1 LEU QD 1 3 ILE H . . 8.500 5.638 5.063 6.140 . 0 0 "[ . 1 . 2]" 1
13 1 1 LEU QD 1 103 LEU H . . 8.470 5.220 4.319 6.319 . 0 0 "[ . 1 . 2]" 1
14 1 1 LEU QD 1 104 PHE HA . . 7.300 3.544 2.253 5.505 . 0 0 "[ . 1 . 2]" 1
15 1 1 LEU QD 1 104 PHE QB . . 8.100 4.399 3.645 5.558 . 0 0 "[ . 1 . 2]" 1
16 1 1 LEU QD 1 104 PHE QD . . 9.370 3.347 2.208 4.376 . 0 0 "[ . 1 . 2]" 1
17 1 1 LEU QD 1 104 PHE HZ . . 7.150 3.117 2.403 4.434 . 0 0 "[ . 1 . 2]" 1
18 1 1 LEU MD1 1 2 ASN H . . 6.500 4.385 2.616 5.570 . 0 0 "[ . 1 . 2]" 1
19 1 1 LEU MD1 1 100 PHE QE . . 9.260 5.705 3.078 7.546 . 0 0 "[ . 1 . 2]" 1
20 1 1 LEU MD1 1 104 PHE QD . . 9.330 3.710 2.226 4.848 . 0 0 "[ . 1 . 2]" 1
21 1 1 LEU MD1 1 104 PHE QE . . 8.650 3.308 1.895 4.894 . 0 0 "[ . 1 . 2]" 1
22 1 1 LEU MD1 1 104 PHE HZ . . 7.520 3.975 2.520 5.720 . 0 0 "[ . 1 . 2]" 1
23 1 1 LEU MD2 1 2 ASN H . . 6.500 4.132 3.285 4.958 . 0 0 "[ . 1 . 2]" 1
24 1 1 LEU MD2 1 100 PHE QE . . 9.260 5.819 3.574 8.225 . 0 0 "[ . 1 . 2]" 1
25 1 1 LEU MD2 1 104 PHE QD . . 9.330 4.173 3.264 5.687 . 0 0 "[ . 1 . 2]" 1
26 1 1 LEU MD2 1 104 PHE QE . . 8.650 3.437 2.040 4.759 . 0 0 "[ . 1 . 2]" 1
27 1 1 LEU MD2 1 104 PHE HZ . . 7.520 4.070 2.427 5.885 . 0 0 "[ . 1 . 2]" 1
28 1 1 LEU HG 1 2 ASN H . . 5.210 4.466 2.987 5.217 0.007 12 0 "[ . 1 . 2]" 1
29 1 1 LEU HG 1 104 PHE QD . . 7.580 4.738 2.570 6.236 . 0 0 "[ . 1 . 2]" 1
30 1 2 ASN H 1 2 ASN HD21 . . 5.930 4.551 2.213 5.605 . 0 0 "[ . 1 . 2]" 1
31 1 2 ASN H 1 2 ASN HD22 . . 5.930 5.311 3.138 6.283 0.353 4 0 "[ . 1 . 2]" 1
32 1 2 ASN H 1 3 ILE H . . 5.100 4.116 3.360 4.618 . 0 0 "[ . 1 . 2]" 1
33 1 2 ASN HA 1 3 ILE H . . 3.530 2.163 2.105 2.337 . 0 0 "[ . 1 . 2]" 1
34 1 2 ASN HA 1 3 ILE HA . . 5.290 4.381 4.301 4.481 . 0 0 "[ . 1 . 2]" 1
35 1 2 ASN HA 1 3 ILE HB . . 4.750 4.506 4.305 4.750 0.000 2 0 "[ . 1 . 2]" 1
36 1 2 ASN HA 1 3 ILE MG . . 6.070 3.751 3.636 4.070 . 0 0 "[ . 1 . 2]" 1
37 1 2 ASN HA 1 4 GLU H . . 4.810 3.556 2.954 3.945 . 0 0 "[ . 1 . 2]" 1
38 1 2 ASN HB2 1 3 ILE H . . 5.430 4.107 2.616 4.576 . 0 0 "[ . 1 . 2]" 1
39 1 2 ASN HB3 1 3 ILE H . . 5.430 4.038 3.448 4.411 . 0 0 "[ . 1 . 2]" 1
40 1 2 ASN QD 1 4 GLU QB . . 6.300 3.179 1.851 4.998 . 0 0 "[ . 1 . 2]" 1
41 1 2 ASN QD 1 4 GLU QG . . 7.070 3.940 2.420 6.294 . 0 0 "[ . 1 . 2]" 1
42 1 2 ASN QD 1 5 ARG QD . . 6.520 3.941 2.515 5.110 . 0 0 "[ . 1 . 2]" 1
43 1 2 ASN QD 1 5 ARG QG . . 6.290 3.385 1.785 4.524 . 0 0 "[ . 1 . 2]" 1
44 1 2 ASN HD21 1 4 GLU QB . . 6.180 3.927 2.663 5.727 . 0 0 "[ . 1 . 2]" 1
45 1 2 ASN HD21 1 4 GLU QG . . 7.040 4.691 3.652 7.094 0.054 20 0 "[ . 1 . 2]" 1
46 1 2 ASN HD22 1 4 GLU QB . . 6.180 3.749 1.868 6.006 . 0 0 "[ . 1 . 2]" 1
47 1 2 ASN HD22 1 4 GLU QG . . 7.040 4.624 2.456 7.037 . 0 0 "[ . 1 . 2]" 1
48 1 3 ILE H 1 3 ILE HB . . 3.820 2.652 2.380 3.017 . 0 0 "[ . 1 . 2]" 1
49 1 3 ILE H 1 3 ILE HG12 . . 4.860 4.503 4.451 4.673 . 0 0 "[ . 1 . 2]" 1
50 1 3 ILE H 1 3 ILE QG . . 5.110 4.007 3.927 4.069 . 0 0 "[ . 1 . 2]" 1
51 1 3 ILE H 1 3 ILE HG13 . . 4.860 4.497 4.288 4.662 . 0 0 "[ . 1 . 2]" 1
52 1 3 ILE H 1 4 GLU H . . 3.880 2.391 1.935 2.773 . 0 0 "[ . 1 . 2]" 1
53 1 3 ILE H 1 6 LEU H . . 5.890 5.295 4.970 5.611 . 0 0 "[ . 1 . 2]" 1
54 1 3 ILE H 1 104 PHE QD . . 8.280 3.417 2.663 4.370 . 0 0 "[ . 1 . 2]" 1
55 1 3 ILE HA 1 3 ILE MD . . 4.770 3.603 2.015 3.811 . 0 0 "[ . 1 . 2]" 1
56 1 3 ILE HA 1 5 ARG H . . 5.500 3.469 3.074 3.793 . 0 0 "[ . 1 . 2]" 1
57 1 3 ILE HA 1 6 LEU H . . 4.650 3.341 3.186 3.564 . 0 0 "[ . 1 . 2]" 1
58 1 3 ILE HA 1 6 LEU HA . . 4.630 4.557 4.140 4.791 0.161 10 0 "[ . 1 . 2]" 1
59 1 3 ILE HA 1 6 LEU HB2 . . 4.460 2.456 2.105 2.973 . 0 0 "[ . 1 . 2]" 1
60 1 3 ILE HA 1 6 LEU HB3 . . 4.460 3.337 2.680 4.076 . 0 0 "[ . 1 . 2]" 1
61 1 3 ILE HA 1 6 LEU MD1 . . 6.180 4.036 3.550 4.631 . 0 0 "[ . 1 . 2]" 1
62 1 3 ILE HA 1 6 LEU QD . . 6.370 3.225 2.923 3.871 . 0 0 "[ . 1 . 2]" 1
63 1 3 ILE HA 1 6 LEU MD2 . . 6.180 3.425 3.015 4.149 . 0 0 "[ . 1 . 2]" 1
64 1 3 ILE HA 1 104 PHE HB2 . . 5.340 4.803 3.662 5.381 0.041 3 0 "[ . 1 . 2]" 1
65 1 3 ILE HA 1 104 PHE QB . . 5.450 3.686 2.431 4.441 . 0 0 "[ . 1 . 2]" 1
66 1 3 ILE HA 1 104 PHE HB3 . . 5.340 3.842 2.468 4.731 . 0 0 "[ . 1 . 2]" 1
67 1 3 ILE HA 1 104 PHE QD . . 6.710 3.215 2.102 4.457 . 0 0 "[ . 1 . 2]" 1
68 1 3 ILE HA 1 104 PHE QE . . 7.630 3.830 2.501 4.844 . 0 0 "[ . 1 . 2]" 1
69 1 3 ILE HB 1 4 GLU H . . 4.610 4.152 4.049 4.279 . 0 0 "[ . 1 . 2]" 1
70 1 3 ILE HB 1 6 LEU QD . . 6.880 4.078 3.685 4.665 . 0 0 "[ . 1 . 2]" 1
71 1 3 ILE HB 1 104 PHE HB2 . . 5.190 3.077 2.123 4.264 . 0 0 "[ . 1 . 2]" 1
72 1 3 ILE HB 1 104 PHE QB . . 5.280 2.004 1.748 2.785 . 0 0 "[ . 1 . 2]" 1
73 1 3 ILE HB 1 104 PHE HB3 . . 5.190 2.044 1.759 2.832 . 0 0 "[ . 1 . 2]" 1
74 1 3 ILE HB 1 104 PHE QD . . 7.720 2.925 1.800 3.712 . 0 0 "[ . 1 . 2]" 1
75 1 3 ILE MD 1 4 GLU H . . 6.190 5.002 4.635 5.227 . 0 0 "[ . 1 . 2]" 1
76 1 3 ILE MD 1 6 LEU H . . 6.160 5.343 3.912 5.797 . 0 0 "[ . 1 . 2]" 1
77 1 3 ILE MD 1 51 LEU HA . . 5.400 3.205 1.847 4.411 . 0 0 "[ . 1 . 2]" 1
78 1 3 ILE MD 1 53 PRO HD2 . . 6.670 3.361 2.086 5.605 . 0 0 "[ . 1 . 2]" 1
79 1 3 ILE MD 1 53 PRO QD . . 6.770 3.268 2.067 5.337 . 0 0 "[ . 1 . 2]" 1
80 1 3 ILE MD 1 53 PRO HD3 . . 6.670 4.534 3.368 6.703 0.033 10 0 "[ . 1 . 2]" 1
81 1 3 ILE MD 1 54 SER H . . 6.010 4.267 3.256 4.964 . 0 0 "[ . 1 . 2]" 1
82 1 3 ILE MD 1 54 SER HA . . 6.490 4.355 3.782 4.885 . 0 0 "[ . 1 . 2]" 1
83 1 3 ILE MD 1 54 SER HB2 . . 5.800 3.865 2.332 4.739 . 0 0 "[ . 1 . 2]" 1
84 1 3 ILE MD 1 54 SER QB . . 6.060 2.936 2.304 4.230 . 0 0 "[ . 1 . 2]" 1
85 1 3 ILE MD 1 54 SER HB3 . . 5.800 3.295 2.464 4.796 . 0 0 "[ . 1 . 2]" 1
86 1 3 ILE MD 1 55 GLN H . . 6.680 5.753 4.822 6.309 . 0 0 "[ . 1 . 2]" 1
87 1 3 ILE MD 1 104 PHE HA . . 6.550 4.982 4.447 5.556 . 0 0 "[ . 1 . 2]" 1
88 1 3 ILE MD 1 104 PHE HB2 . . 5.910 2.691 2.295 3.714 . 0 0 "[ . 1 . 2]" 1
89 1 3 ILE MD 1 104 PHE HB3 . . 5.910 3.006 2.277 3.675 . 0 0 "[ . 1 . 2]" 1
90 1 3 ILE MD 1 104 PHE QD . . 8.080 3.613 3.036 4.585 . 0 0 "[ . 1 . 2]" 1
91 1 3 ILE QG 1 4 GLU H . . 6.100 4.073 3.879 4.244 . 0 0 "[ . 1 . 2]" 1
92 1 3 ILE QG 1 6 LEU QD . . 7.360 2.427 1.950 3.495 . 0 0 "[ . 1 . 2]" 1
93 1 3 ILE QG 1 53 PRO QD . . 6.630 4.084 3.006 4.957 . 0 0 "[ . 1 . 2]" 1
94 1 3 ILE QG 1 54 SER QB . . 6.470 2.285 1.762 3.578 . 0 0 "[ . 1 . 2]" 1
95 1 3 ILE HG12 1 4 GLU H . . 5.980 4.400 4.080 5.220 . 0 0 "[ . 1 . 2]" 1
96 1 3 ILE HG12 1 54 SER H . . 5.500 4.193 3.144 4.858 . 0 0 "[ . 1 . 2]" 1
97 1 3 ILE HG12 1 54 SER HA . . 5.520 3.247 2.416 5.040 . 0 0 "[ . 1 . 2]" 1
98 1 3 ILE HG13 1 4 GLU H . . 5.980 4.934 4.177 5.094 . 0 0 "[ . 1 . 2]" 1
99 1 3 ILE HG13 1 54 SER H . . 5.500 5.438 3.969 6.354 0.854 2 4 "[*+*-. 1 . 2]" 1
100 1 3 ILE HG13 1 54 SER HA . . 5.520 4.319 2.605 5.373 . 0 0 "[ . 1 . 2]" 1
101 1 3 ILE MG 1 4 GLU H . . 4.960 2.581 2.308 2.879 . 0 0 "[ . 1 . 2]" 1
102 1 3 ILE MG 1 4 GLU HA . . 5.460 3.215 2.970 3.416 . 0 0 "[ . 1 . 2]" 1
103 1 3 ILE MG 1 4 GLU QG . . 5.870 2.939 2.297 4.986 . 0 0 "[ . 1 . 2]" 1
104 1 3 ILE MG 1 5 ARG H . . 6.520 4.372 4.229 4.567 . 0 0 "[ . 1 . 2]" 1
105 1 3 ILE MG 1 6 LEU H . . 6.520 4.768 4.571 4.944 . 0 0 "[ . 1 . 2]" 1
106 1 3 ILE MG 1 53 PRO HB2 . . 5.240 2.822 1.893 3.482 . 0 0 "[ . 1 . 2]" 1
107 1 3 ILE MG 1 53 PRO QB . . 5.560 2.771 1.883 3.380 . 0 0 "[ . 1 . 2]" 1
108 1 3 ILE MG 1 53 PRO HB3 . . 5.240 4.076 2.815 4.728 . 0 0 "[ . 1 . 2]" 1
109 1 3 ILE MG 1 53 PRO QD . . 6.700 4.032 2.706 5.057 . 0 0 "[ . 1 . 2]" 1
110 1 3 ILE MG 1 53 PRO QG . . 6.240 2.790 1.799 4.102 . 0 0 "[ . 1 . 2]" 1
111 1 3 ILE MG 1 54 SER H . . 6.080 4.711 4.070 5.111 . 0 0 "[ . 1 . 2]" 1
112 1 3 ILE MG 1 54 SER HA . . 6.120 3.886 3.182 4.401 . 0 0 "[ . 1 . 2]" 1
113 1 3 ILE MG 1 54 SER HB2 . . 6.630 4.846 2.807 5.985 . 0 0 "[ . 1 . 2]" 1
114 1 3 ILE MG 1 54 SER QB . . 6.700 3.976 2.773 5.169 . 0 0 "[ . 1 . 2]" 1
115 1 3 ILE MG 1 54 SER HB3 . . 6.630 4.446 3.171 5.652 . 0 0 "[ . 1 . 2]" 1
116 1 3 ILE MG 1 104 PHE H . . 7.130 6.008 5.430 6.957 . 0 0 "[ . 1 . 2]" 1
117 1 3 ILE MG 1 104 PHE HA . . 5.900 4.984 4.352 5.826 . 0 0 "[ . 1 . 2]" 1
118 1 3 ILE MG 1 104 PHE HB2 . . 6.520 4.139 3.355 5.478 . 0 0 "[ . 1 . 2]" 1
119 1 3 ILE MG 1 104 PHE HB3 . . 6.520 3.247 2.638 4.399 . 0 0 "[ . 1 . 2]" 1
120 1 3 ILE MG 1 104 PHE QD . . 8.990 4.032 3.140 4.918 . 0 0 "[ . 1 . 2]" 1
121 1 4 GLU H 1 4 GLU QG . . 4.500 2.495 1.779 3.999 . 0 0 "[ . 1 . 2]" 1
122 1 4 GLU H 1 5 ARG H . . 3.810 2.656 2.477 2.771 . 0 0 "[ . 1 . 2]" 1
123 1 4 GLU H 1 5 ARG QG . . 6.680 4.015 3.438 4.617 . 0 0 "[ . 1 . 2]" 1
124 1 4 GLU H 1 6 LEU H . . 5.370 4.097 3.946 4.249 . 0 0 "[ . 1 . 2]" 1
125 1 4 GLU H 1 54 SER HA . . 5.450 4.784 4.096 5.542 0.092 16 0 "[ . 1 . 2]" 1
126 1 4 GLU HA 1 54 SER H . . 5.000 4.905 4.473 5.073 0.073 18 0 "[ . 1 . 2]" 1
127 1 4 GLU HA 1 54 SER HA . . 3.890 2.771 1.858 3.702 . 0 0 "[ . 1 . 2]" 1
128 1 4 GLU QB 1 5 ARG H . . 5.340 3.202 2.862 3.410 . 0 0 "[ . 1 . 2]" 1
129 1 4 GLU QB 1 54 SER HA . . 6.240 4.716 4.133 5.541 . 0 0 "[ . 1 . 2]" 1
130 1 4 GLU QB 1 55 GLN QE . . 6.870 4.569 3.603 6.222 . 0 0 "[ . 1 . 2]" 1
131 1 4 GLU QG 1 5 ARG H . . 5.620 4.299 3.910 4.820 . 0 0 "[ . 1 . 2]" 1
132 1 4 GLU QG 1 5 ARG HG2 . . 6.140 5.466 3.250 6.171 0.031 7 0 "[ . 1 . 2]" 1
133 1 4 GLU QG 1 5 ARG HG3 . . 6.140 5.010 2.836 6.181 0.041 17 0 "[ . 1 . 2]" 1
134 1 4 GLU QG 1 53 PRO QB . . 5.580 3.305 2.237 5.538 . 0 0 "[ . 1 . 2]" 1
135 1 4 GLU QG 1 54 SER HA . . 6.170 4.653 3.614 5.638 . 0 0 "[ . 1 . 2]" 1
136 1 5 ARG H 1 5 ARG QD . . 5.300 4.341 3.957 4.771 . 0 0 "[ . 1 . 2]" 1
137 1 5 ARG H 1 5 ARG HG2 . . 4.310 3.626 2.243 4.218 . 0 0 "[ . 1 . 2]" 1
138 1 5 ARG H 1 5 ARG QG . . 4.650 2.720 2.121 3.196 . 0 0 "[ . 1 . 2]" 1
139 1 5 ARG H 1 5 ARG HG3 . . 4.310 2.919 2.478 4.131 . 0 0 "[ . 1 . 2]" 1
140 1 5 ARG H 1 6 LEU QB . . 7.040 3.646 3.517 3.758 . 0 0 "[ . 1 . 2]" 1
141 1 5 ARG H 1 6 LEU HG . . 6.260 6.365 6.290 6.476 0.216 20 0 "[ . 1 . 2]" 1
142 1 5 ARG HA 1 5 ARG QD . . 4.450 3.963 2.153 4.456 0.006 15 0 "[ . 1 . 2]" 1
143 1 5 ARG HA 1 5 ARG HG2 . . 4.020 2.774 2.446 3.746 . 0 0 "[ . 1 . 2]" 1
144 1 5 ARG HA 1 5 ARG HG3 . . 4.020 3.289 3.005 3.852 . 0 0 "[ . 1 . 2]" 1
145 1 5 ARG HA 1 55 GLN HE21 . . 4.470 2.740 2.003 4.478 0.008 3 0 "[ . 1 . 2]" 1
146 1 5 ARG HA 1 55 GLN QE . . 4.720 2.518 1.785 4.006 . 0 0 "[ . 1 . 2]" 1
147 1 5 ARG HA 1 55 GLN HE22 . . 4.470 3.501 1.791 4.516 0.046 3 0 "[ . 1 . 2]" 1
148 1 5 ARG QB 1 55 GLN QE . . 6.640 3.861 2.940 4.479 . 0 0 "[ . 1 . 2]" 1
149 1 5 ARG HB2 1 6 LEU H . . 5.290 3.824 3.443 4.357 . 0 0 "[ . 1 . 2]" 1
150 1 5 ARG HB3 1 6 LEU H . . 5.290 4.399 4.264 4.611 . 0 0 "[ . 1 . 2]" 1
151 1 5 ARG QG 1 55 GLN QE . . 6.350 3.742 2.272 5.265 . 0 0 "[ . 1 . 2]" 1
152 1 6 LEU H 1 6 LEU HB2 . . 4.020 2.594 2.412 2.734 . 0 0 "[ . 1 . 2]" 1
153 1 6 LEU H 1 6 LEU HB3 . . 4.020 2.456 2.344 2.577 . 0 0 "[ . 1 . 2]" 1
154 1 6 LEU H 1 6 LEU MD1 . . 5.770 4.127 3.988 4.226 . 0 0 "[ . 1 . 2]" 1
155 1 6 LEU H 1 6 LEU MD2 . . 5.770 4.249 4.217 4.300 . 0 0 "[ . 1 . 2]" 1
156 1 6 LEU H 1 6 LEU HG . . 4.910 4.416 4.325 4.494 . 0 0 "[ . 1 . 2]" 1
157 1 6 LEU H 1 7 THR H . . 5.760 4.138 2.868 4.548 . 0 0 "[ . 1 . 2]" 1
158 1 6 LEU H 1 54 SER HA . . 5.470 3.639 3.058 4.215 . 0 0 "[ . 1 . 2]" 1
159 1 6 LEU H 1 55 GLN H . . 4.810 3.490 2.755 4.057 . 0 0 "[ . 1 . 2]" 1
160 1 6 LEU HA 1 7 THR H . . 3.530 2.384 2.132 3.545 0.015 5 0 "[ . 1 . 2]" 1
161 1 6 LEU HA 1 8 THR H . . 4.600 3.794 3.167 4.658 0.058 11 0 "[ . 1 . 2]" 1
162 1 6 LEU QB 1 8 THR H . . 6.520 4.471 3.290 5.160 . 0 0 "[ . 1 . 2]" 1
163 1 6 LEU QB 1 54 SER QB . . 6.640 2.510 1.855 3.364 . 0 0 "[ . 1 . 2]" 1
164 1 6 LEU QB 1 55 GLN H . . 6.210 3.347 2.868 3.758 . 0 0 "[ . 1 . 2]" 1
165 1 6 LEU QD 1 7 THR H . . 6.260 2.883 2.350 3.528 . 0 0 "[ . 1 . 2]" 1
166 1 6 LEU QD 1 8 THR H . . 6.070 2.851 2.487 3.249 . 0 0 "[ . 1 . 2]" 1
167 1 6 LEU QD 1 10 GLN H . . 8.070 4.948 4.266 5.492 . 0 0 "[ . 1 . 2]" 1
168 1 6 LEU QD 1 54 SER HA . . 8.330 4.556 3.793 5.328 . 0 0 "[ . 1 . 2]" 1
169 1 6 LEU QD 1 54 SER QB . . 8.320 2.864 2.291 3.562 . 0 0 "[ . 1 . 2]" 1
170 1 6 LEU QD 1 55 GLN H . . 7.460 4.431 4.110 4.795 . 0 0 "[ . 1 . 2]" 1
171 1 6 LEU QD 1 56 VAL QG . . 7.750 2.798 2.066 3.470 . 0 0 "[ . 1 . 2]" 1
172 1 6 LEU QD 1 100 PHE QD . . 9.670 3.327 3.018 3.741 . 0 0 "[ . 1 . 2]" 1
173 1 6 LEU QD 1 100 PHE QE . . 8.160 1.886 1.707 2.285 . 0 0 "[ . 1 . 2]" 1
174 1 6 LEU QD 1 100 PHE HZ . . 6.660 2.453 1.748 2.891 . 0 0 "[ . 1 . 2]" 1
175 1 6 LEU QD 1 104 PHE QD . . 8.940 3.479 2.267 4.296 . 0 0 "[ . 1 . 2]" 1
176 1 6 LEU QD 1 104 PHE QE . . 9.500 2.947 2.360 3.736 . 0 0 "[ . 1 . 2]" 1
177 1 6 LEU QD 1 104 PHE HZ . . 6.430 2.994 2.039 3.913 . 0 0 "[ . 1 . 2]" 1
178 1 6 LEU MD1 1 7 THR H . . 6.480 3.024 2.358 4.298 . 0 0 "[ . 1 . 2]" 1
179 1 6 LEU MD1 1 8 THR H . . 6.140 2.953 2.501 3.897 . 0 0 "[ . 1 . 2]" 1
180 1 6 LEU MD1 1 9 LEU HA . . 6.320 4.059 3.159 5.091 . 0 0 "[ . 1 . 2]" 1
181 1 6 LEU MD1 1 55 GLN H . . 7.360 5.449 5.018 6.104 . 0 0 "[ . 1 . 2]" 1
182 1 6 LEU MD1 1 100 PHE QE . . 8.030 2.294 1.787 2.967 . 0 0 "[ . 1 . 2]" 1
183 1 6 LEU MD1 1 100 PHE HZ . . 6.380 2.494 1.757 3.010 . 0 0 "[ . 1 . 2]" 1
184 1 6 LEU MD1 1 104 PHE QD . . 8.650 4.432 3.633 5.192 . 0 0 "[ . 1 . 2]" 1
185 1 6 LEU MD1 1 104 PHE HZ . . 6.520 3.115 2.078 4.074 . 0 0 "[ . 1 . 2]" 1
186 1 6 LEU MD2 1 7 THR H . . 6.480 4.677 3.285 5.188 . 0 0 "[ . 1 . 2]" 1
187 1 6 LEU MD2 1 8 THR H . . 6.140 4.400 3.276 5.307 . 0 0 "[ . 1 . 2]" 1
188 1 6 LEU MD2 1 9 LEU HA . . 6.320 4.407 3.527 5.321 . 0 0 "[ . 1 . 2]" 1
189 1 6 LEU MD2 1 55 GLN H . . 7.360 4.700 4.272 5.082 . 0 0 "[ . 1 . 2]" 1
190 1 6 LEU MD2 1 100 PHE QE . . 8.030 2.201 1.759 2.872 . 0 0 "[ . 1 . 2]" 1
191 1 6 LEU MD2 1 100 PHE HZ . . 6.380 3.804 2.958 4.734 . 0 0 "[ . 1 . 2]" 1
192 1 6 LEU MD2 1 104 PHE QD . . 8.650 3.687 2.287 4.820 . 0 0 "[ . 1 . 2]" 1
193 1 6 LEU MD2 1 104 PHE HZ . . 6.520 4.081 2.965 5.217 . 0 0 "[ . 1 . 2]" 1
194 1 6 LEU HG 1 7 THR H . . 5.100 3.513 2.765 3.950 . 0 0 "[ . 1 . 2]" 1
195 1 6 LEU HG 1 8 THR H . . 4.390 3.056 1.947 4.171 . 0 0 "[ . 1 . 2]" 1
196 1 6 LEU HG 1 56 VAL MG1 . . 5.420 4.314 2.776 5.421 0.001 18 0 "[ . 1 . 2]" 1
197 1 6 LEU HG 1 56 VAL QG . . 5.900 2.701 2.007 3.693 . 0 0 "[ . 1 . 2]" 1
198 1 6 LEU HG 1 56 VAL MG2 . . 5.420 2.877 2.011 4.281 . 0 0 "[ . 1 . 2]" 1
199 1 7 THR H 1 8 THR H . . 3.680 2.436 1.913 3.463 . 0 0 "[ . 1 . 2]" 1
200 1 7 THR H 1 8 THR MG . . 6.020 3.522 2.725 5.755 . 0 0 "[ . 1 . 2]" 1
201 1 7 THR H 1 56 VAL MG1 . . 6.580 5.079 2.922 6.553 . 0 0 "[ . 1 . 2]" 1
202 1 7 THR H 1 56 VAL MG2 . . 6.580 4.106 2.482 6.055 . 0 0 "[ . 1 . 2]" 1
203 1 7 THR HA 1 55 GLN H . . 4.600 3.666 2.739 4.437 . 0 0 "[ . 1 . 2]" 1
204 1 7 THR HA 1 55 GLN HB2 . . 4.520 2.713 1.865 4.460 . 0 0 "[ . 1 . 2]" 1
205 1 7 THR HA 1 55 GLN QB . . 4.840 2.348 1.855 2.959 . 0 0 "[ . 1 . 2]" 1
206 1 7 THR HA 1 55 GLN HB3 . . 4.520 3.369 2.251 4.551 0.031 11 0 "[ . 1 . 2]" 1
207 1 7 THR HA 1 55 GLN HG2 . . 4.810 4.578 3.401 4.989 0.179 2 0 "[ . 1 . 2]" 1
208 1 7 THR HA 1 55 GLN HG3 . . 4.810 4.496 4.035 4.945 0.135 1 0 "[ . 1 . 2]" 1
209 1 7 THR HA 1 56 VAL H . . 5.020 3.361 2.699 3.996 . 0 0 "[ . 1 . 2]" 1
210 1 7 THR HA 1 56 VAL HA . . 4.470 3.508 2.331 4.400 . 0 0 "[ . 1 . 2]" 1
211 1 7 THR HA 1 56 VAL MG1 . . 5.690 3.511 1.763 4.867 . 0 0 "[ . 1 . 2]" 1
212 1 7 THR HA 1 56 VAL QG . . 6.070 2.353 1.627 3.275 . 0 0 "[ . 1 . 2]" 1
213 1 7 THR HA 1 56 VAL MG2 . . 5.690 2.845 1.779 4.635 . 0 0 "[ . 1 . 2]" 1
214 1 7 THR HB 1 8 THR H . . 5.370 4.091 2.941 4.691 . 0 0 "[ . 1 . 2]" 1
215 1 7 THR HB 1 55 GLN QB . . 5.760 2.745 1.723 3.842 . 0 0 "[ . 1 . 2]" 1
216 1 7 THR HB 1 56 VAL HA . . 5.000 5.015 4.356 5.143 0.143 8 0 "[ . 1 . 2]" 1
217 1 7 THR HB 1 56 VAL QG . . 7.370 4.040 2.836 4.704 . 0 0 "[ . 1 . 2]" 1
218 1 7 THR MG 1 8 THR H . . 6.070 3.866 3.073 4.294 . 0 0 "[ . 1 . 2]" 1
219 1 7 THR MG 1 55 GLN H . . 6.140 4.700 3.768 5.555 . 0 0 "[ . 1 . 2]" 1
220 1 7 THR MG 1 55 GLN HB2 . . 5.380 3.057 1.776 4.633 . 0 0 "[ . 1 . 2]" 1
221 1 7 THR MG 1 55 GLN HB3 . . 5.380 3.301 2.023 4.474 . 0 0 "[ . 1 . 2]" 1
222 1 7 THR MG 1 55 GLN HE21 . . 6.770 4.334 2.531 5.665 . 0 0 "[ . 1 . 2]" 1
223 1 7 THR MG 1 55 GLN QE . . 6.770 4.028 2.358 5.235 . 0 0 "[ . 1 . 2]" 1
224 1 7 THR MG 1 55 GLN HE22 . . 6.770 5.031 2.814 6.560 . 0 0 "[ . 1 . 2]" 1
225 1 7 THR MG 1 55 GLN HG2 . . 5.720 3.911 1.788 5.043 . 0 0 "[ . 1 . 2]" 1
226 1 7 THR MG 1 55 GLN QG . . 5.950 3.213 1.776 3.868 . 0 0 "[ . 1 . 2]" 1
227 1 7 THR MG 1 55 GLN HG3 . . 5.720 3.715 2.897 5.109 . 0 0 "[ . 1 . 2]" 1
228 1 8 THR H 1 9 LEU H . . 5.100 4.258 2.507 4.527 . 0 0 "[ . 1 . 2]" 1
229 1 8 THR H 1 10 GLN H . . 6.500 4.984 4.138 5.406 . 0 0 "[ . 1 . 2]" 1
230 1 8 THR H 1 56 VAL HA . . 6.210 5.586 4.198 6.278 0.068 3 0 "[ . 1 . 2]" 1
231 1 8 THR H 1 56 VAL MG1 . . 5.850 4.135 2.551 5.505 . 0 0 "[ . 1 . 2]" 1
232 1 8 THR H 1 56 VAL QG . . 6.250 3.020 2.305 3.754 . 0 0 "[ . 1 . 2]" 1
233 1 8 THR H 1 56 VAL MG2 . . 5.850 3.443 2.313 5.091 . 0 0 "[ . 1 . 2]" 1
234 1 8 THR HA 1 9 LEU H . . 3.560 2.321 2.123 3.567 0.007 11 0 "[ . 1 . 2]" 1
235 1 8 THR HA 1 10 GLN H . . 5.010 3.785 3.375 4.467 . 0 0 "[ . 1 . 2]" 1
236 1 8 THR HA 1 56 VAL MG1 . . 5.850 3.611 2.036 5.080 . 0 0 "[ . 1 . 2]" 1
237 1 8 THR HA 1 56 VAL QG . . 6.200 3.112 1.919 3.828 . 0 0 "[ . 1 . 2]" 1
238 1 8 THR HA 1 56 VAL MG2 . . 5.850 3.915 2.348 5.543 . 0 0 "[ . 1 . 2]" 1
239 1 8 THR HB 1 9 LEU H . . 4.430 3.936 3.646 4.139 . 0 0 "[ . 1 . 2]" 1
240 1 8 THR HB 1 10 GLN H . . 5.490 4.121 2.677 4.725 . 0 0 "[ . 1 . 2]" 1
241 1 8 THR MG 1 9 LEU H . . 5.910 3.534 1.723 4.123 . 0 0 "[ . 1 . 2]" 1
242 1 8 THR MG 1 10 GLN H . . 5.430 2.925 1.994 3.696 . 0 0 "[ . 1 . 2]" 1
243 1 8 THR MG 1 10 GLN HB2 . . 6.350 3.787 2.396 4.890 . 0 0 "[ . 1 . 2]" 1
244 1 8 THR MG 1 10 GLN QB . . 6.580 3.221 2.326 3.951 . 0 0 "[ . 1 . 2]" 1
245 1 8 THR MG 1 10 GLN HB3 . . 6.350 3.576 2.698 4.348 . 0 0 "[ . 1 . 2]" 1
246 1 8 THR MG 1 10 GLN QG . . 7.300 4.698 3.883 5.462 . 0 0 "[ . 1 . 2]" 1
247 1 8 THR MG 1 11 PRO HD2 . . 5.870 3.459 2.526 4.758 . 0 0 "[ . 1 . 2]" 1
248 1 8 THR MG 1 11 PRO QD . . 6.060 2.983 2.343 4.058 . 0 0 "[ . 1 . 2]" 1
249 1 8 THR MG 1 11 PRO HD3 . . 5.870 3.294 2.524 4.401 . 0 0 "[ . 1 . 2]" 1
250 1 8 THR MG 1 11 PRO HG2 . . 6.520 4.227 2.823 6.411 . 0 0 "[ . 1 . 2]" 1
251 1 8 THR MG 1 11 PRO HG3 . . 6.520 4.660 3.562 6.357 . 0 0 "[ . 1 . 2]" 1
252 1 8 THR MG 1 100 PHE HZ . . 7.230 4.352 2.718 7.180 . 0 0 "[ . 1 . 2]" 1
253 1 9 LEU H 1 9 LEU HG . . 4.810 3.399 2.717 4.629 . 0 0 "[ . 1 . 2]" 1
254 1 9 LEU H 1 10 GLN HA . . 6.130 4.343 3.990 5.262 . 0 0 "[ . 1 . 2]" 1
255 1 9 LEU H 1 10 GLN HB2 . . 6.130 4.308 3.842 5.109 . 0 0 "[ . 1 . 2]" 1
256 1 9 LEU H 1 10 GLN HB3 . . 6.130 4.949 4.589 5.513 . 0 0 "[ . 1 . 2]" 1
257 1 9 LEU H 1 11 PRO HD2 . . 6.500 4.556 3.202 5.330 . 0 0 "[ . 1 . 2]" 1
258 1 9 LEU H 1 11 PRO QD . . 6.600 4.231 3.118 4.885 . 0 0 "[ . 1 . 2]" 1
259 1 9 LEU H 1 11 PRO HD3 . . 6.500 5.040 4.297 5.675 . 0 0 "[ . 1 . 2]" 1
260 1 9 LEU H 1 13 TRP HD1 . . 5.500 4.400 3.719 5.586 0.086 11 0 "[ . 1 . 2]" 1
261 1 9 LEU H 1 13 TRP HE1 . . 5.990 4.417 2.998 6.079 0.089 11 0 "[ . 1 . 2]" 1
262 1 9 LEU H 1 56 VAL MG1 . . 6.430 4.065 3.143 5.116 . 0 0 "[ . 1 . 2]" 1
263 1 9 LEU H 1 56 VAL MG2 . . 6.430 4.520 3.744 5.752 . 0 0 "[ . 1 . 2]" 1
264 1 9 LEU HA 1 11 PRO HD2 . . 5.540 3.015 2.791 3.264 . 0 0 "[ . 1 . 2]" 1
265 1 9 LEU HA 1 11 PRO QD . . 5.580 2.966 2.756 3.209 . 0 0 "[ . 1 . 2]" 1
266 1 9 LEU HA 1 11 PRO HD3 . . 5.540 4.410 4.202 4.740 . 0 0 "[ . 1 . 2]" 1
267 1 9 LEU HA 1 12 VAL H . . 5.420 3.484 3.272 3.873 . 0 0 "[ . 1 . 2]" 1
268 1 9 LEU HA 1 12 VAL HB . . 5.280 3.598 3.177 4.245 . 0 0 "[ . 1 . 2]" 1
269 1 9 LEU HA 1 12 VAL MG1 . . 7.520 4.759 4.341 5.442 . 0 0 "[ . 1 . 2]" 1
270 1 9 LEU HA 1 12 VAL QG . . 7.110 2.781 2.454 3.578 . 0 0 "[ . 1 . 2]" 1
271 1 9 LEU HA 1 12 VAL MG2 . . 7.520 2.800 2.467 3.629 . 0 0 "[ . 1 . 2]" 1
272 1 9 LEU HA 1 13 TRP H . . 5.920 4.734 4.381 5.176 . 0 0 "[ . 1 . 2]" 1
273 1 9 LEU HA 1 97 MET ME . . 6.690 6.063 4.839 6.743 0.053 9 0 "[ . 1 . 2]" 1
274 1 9 LEU HA 1 100 PHE QE . . 7.370 3.927 3.364 4.596 . 0 0 "[ . 1 . 2]" 1
275 1 9 LEU QB 1 12 VAL HB . . 5.530 2.485 1.755 3.791 . 0 0 "[ . 1 . 2]" 1
276 1 9 LEU QB 1 12 VAL QG . . 7.470 2.843 2.357 3.730 . 0 0 "[ . 1 . 2]" 1
277 1 9 LEU QB 1 13 TRP HD1 . . 6.620 3.404 2.586 4.181 . 0 0 "[ . 1 . 2]" 1
278 1 9 LEU QB 1 13 TRP HE1 . . 4.920 2.737 2.227 3.286 . 0 0 "[ . 1 . 2]" 1
279 1 9 LEU HB2 1 10 GLN H . . 5.770 3.994 3.713 4.412 . 0 0 "[ . 1 . 2]" 1
280 1 9 LEU HB2 1 12 VAL H . . 5.500 5.066 4.706 5.578 0.078 7 0 "[ . 1 . 2]" 1
281 1 9 LEU HB2 1 12 VAL HB . . 5.320 4.001 3.306 4.820 . 0 0 "[ . 1 . 2]" 1
282 1 9 LEU HB2 1 13 TRP H . . 6.130 4.791 4.259 6.137 0.007 4 0 "[ . 1 . 2]" 1
283 1 9 LEU HB2 1 13 TRP HE1 . . 4.830 2.981 2.459 4.290 . 0 0 "[ . 1 . 2]" 1
284 1 9 LEU HB2 1 13 TRP HZ2 . . 5.500 4.585 3.056 5.508 0.008 4 0 "[ . 1 . 2]" 1
285 1 9 LEU HB3 1 10 GLN H . . 5.770 4.310 3.759 4.431 . 0 0 "[ . 1 . 2]" 1
286 1 9 LEU HB3 1 12 VAL H . . 5.500 3.985 3.547 4.797 . 0 0 "[ . 1 . 2]" 1
287 1 9 LEU HB3 1 12 VAL HB . . 5.320 2.519 1.761 3.970 . 0 0 "[ . 1 . 2]" 1
288 1 9 LEU HB3 1 13 TRP H . . 6.130 3.873 3.399 4.782 . 0 0 "[ . 1 . 2]" 1
289 1 9 LEU HB3 1 13 TRP HE1 . . 4.830 3.719 2.250 4.295 . 0 0 "[ . 1 . 2]" 1
290 1 9 LEU HB3 1 13 TRP HZ2 . . 5.500 4.906 4.188 5.503 0.003 20 0 "[ . 1 . 2]" 1
291 1 9 LEU QD 1 10 GLN H . . 7.320 4.262 3.889 4.462 . 0 0 "[ . 1 . 2]" 1
292 1 9 LEU QD 1 12 VAL HB . . 7.180 3.066 2.103 3.667 . 0 0 "[ . 1 . 2]" 1
293 1 9 LEU QD 1 12 VAL QG . . 7.820 2.062 1.730 2.593 . 0 0 "[ . 1 . 2]" 1
294 1 9 LEU QD 1 13 TRP HE1 . . 6.840 3.515 2.625 4.192 . 0 0 "[ . 1 . 2]" 1
295 1 9 LEU QD 1 13 TRP HZ2 . . 6.700 3.609 2.703 4.601 . 0 0 "[ . 1 . 2]" 1
296 1 9 LEU QD 1 60 PHE QE . . 9.670 4.345 3.054 5.031 . 0 0 "[ . 1 . 2]" 1
297 1 9 LEU QD 1 60 PHE HZ . . 6.970 3.796 2.083 4.629 . 0 0 "[ . 1 . 2]" 1
298 1 9 LEU QD 1 93 PHE HZ . . 6.800 3.616 2.715 4.537 . 0 0 "[ . 1 . 2]" 1
299 1 9 LEU QD 1 97 MET ME . . 6.310 2.882 2.092 3.899 . 0 0 "[ . 1 . 2]" 1
300 1 9 LEU QD 1 100 PHE QD . . 8.620 3.555 2.891 4.552 . 0 0 "[ . 1 . 2]" 1
301 1 9 LEU QD 1 100 PHE QE . . 8.580 3.275 2.272 4.314 . 0 0 "[ . 1 . 2]" 1
302 1 9 LEU QD 1 100 PHE HZ . . 7.150 4.849 3.622 5.753 . 0 0 "[ . 1 . 2]" 1
303 1 9 LEU MD1 1 10 GLN H . . 7.520 5.219 4.269 5.639 . 0 0 "[ . 1 . 2]" 1
304 1 9 LEU MD1 1 12 VAL HB . . 7.220 3.699 2.108 4.965 . 0 0 "[ . 1 . 2]" 1
305 1 9 LEU MD1 1 12 VAL MG1 . . 8.540 3.519 2.427 5.165 . 0 0 "[ . 1 . 2]" 1
306 1 9 LEU MD1 1 12 VAL MG2 . . 8.540 3.226 1.811 4.555 . 0 0 "[ . 1 . 2]" 1
307 1 9 LEU MD1 1 13 TRP HE1 . . 6.520 3.932 2.804 5.310 . 0 0 "[ . 1 . 2]" 1
308 1 9 LEU MD1 1 93 PHE HZ . . 6.690 4.030 2.767 5.601 . 0 0 "[ . 1 . 2]" 1
309 1 9 LEU MD1 1 97 MET ME . . 6.140 3.354 2.103 5.377 . 0 0 "[ . 1 . 2]" 1
310 1 9 LEU MD1 1 100 PHE QD . . 8.720 5.192 2.915 6.760 . 0 0 "[ . 1 . 2]" 1
311 1 9 LEU MD2 1 10 GLN H . . 7.520 4.619 4.346 5.518 . 0 0 "[ . 1 . 2]" 1
312 1 9 LEU MD2 1 12 VAL HB . . 7.220 3.520 2.590 4.818 . 0 0 "[ . 1 . 2]" 1
313 1 9 LEU MD2 1 12 VAL MG1 . . 8.540 3.515 2.459 4.991 . 0 0 "[ . 1 . 2]" 1
314 1 9 LEU MD2 1 12 VAL MG2 . . 8.540 2.508 1.778 4.337 . 0 0 "[ . 1 . 2]" 1
315 1 9 LEU MD2 1 13 TRP HE1 . . 6.520 4.877 2.638 5.872 . 0 0 "[ . 1 . 2]" 1
316 1 9 LEU MD2 1 93 PHE HZ . . 6.690 4.890 2.733 6.099 . 0 0 "[ . 1 . 2]" 1
317 1 9 LEU MD2 1 97 MET ME . . 6.140 3.372 2.711 4.661 . 0 0 "[ . 1 . 2]" 1
318 1 9 LEU MD2 1 100 PHE QD . . 8.720 4.071 3.133 5.835 . 0 0 "[ . 1 . 2]" 1
319 1 9 LEU HG 1 13 TRP HE1 . . 5.860 4.875 3.740 5.726 . 0 0 "[ . 1 . 2]" 1
320 1 10 GLN H 1 11 PRO HD2 . . 5.080 2.783 2.558 3.067 . 0 0 "[ . 1 . 2]" 1
321 1 10 GLN H 1 11 PRO QD . . 5.340 2.468 2.356 2.610 . 0 0 "[ . 1 . 2]" 1
322 1 10 GLN H 1 11 PRO HD3 . . 5.080 2.769 2.683 2.940 . 0 0 "[ . 1 . 2]" 1
323 1 10 GLN H 1 11 PRO QG . . 6.260 4.410 4.300 4.555 . 0 0 "[ . 1 . 2]" 1
324 1 10 GLN H 1 13 TRP HD1 . . 5.500 4.152 3.709 4.624 . 0 0 "[ . 1 . 2]" 1
325 1 10 GLN HA 1 10 GLN HE21 . . 5.750 2.663 2.236 4.178 . 0 0 "[ . 1 . 2]" 1
326 1 10 GLN HA 1 10 GLN QE . . 5.780 2.545 2.181 3.690 . 0 0 "[ . 1 . 2]" 1
327 1 10 GLN HA 1 10 GLN HE22 . . 5.750 3.303 3.037 4.108 . 0 0 "[ . 1 . 2]" 1
328 1 10 GLN HA 1 12 VAL H . . 5.190 4.063 3.848 4.240 . 0 0 "[ . 1 . 2]" 1
329 1 10 GLN HA 1 13 TRP H . . 5.000 3.433 3.221 3.722 . 0 0 "[ . 1 . 2]" 1
330 1 10 GLN HA 1 13 TRP HB2 . . 5.070 2.848 2.588 3.286 . 0 0 "[ . 1 . 2]" 1
331 1 10 GLN HA 1 13 TRP QB . . 5.190 2.818 2.568 3.241 . 0 0 "[ . 1 . 2]" 1
332 1 10 GLN HA 1 13 TRP HB3 . . 5.070 4.497 4.248 4.948 . 0 0 "[ . 1 . 2]" 1
333 1 10 GLN HA 1 13 TRP HD1 . . 3.860 2.484 1.793 3.015 . 0 0 "[ . 1 . 2]" 1
334 1 10 GLN HA 1 13 TRP HE1 . . 5.280 4.802 3.936 5.328 0.048 18 0 "[ . 1 . 2]" 1
335 1 10 GLN HA 1 14 ASP H . . 5.380 4.081 3.507 4.731 . 0 0 "[ . 1 . 2]" 1
336 1 10 GLN QB 1 11 PRO QD . . 5.800 1.762 1.691 1.870 . 0 0 "[ . 1 . 2]" 1
337 1 10 GLN HB2 1 11 PRO HD2 . . 5.500 4.388 3.931 4.582 . 0 0 "[ . 1 . 2]" 1
338 1 10 GLN HB2 1 11 PRO HD3 . . 5.500 3.312 2.886 3.452 . 0 0 "[ . 1 . 2]" 1
339 1 10 GLN HB3 1 11 PRO HD2 . . 5.500 3.258 3.146 3.310 . 0 0 "[ . 1 . 2]" 1
340 1 10 GLN HB3 1 11 PRO HD3 . . 5.500 1.778 1.702 1.892 . 0 0 "[ . 1 . 2]" 1
341 1 10 GLN QE 1 13 TRP QB . . 6.120 2.623 1.907 3.420 . 0 0 "[ . 1 . 2]" 1
342 1 10 GLN QE 1 14 ASP H . . 5.550 3.157 2.559 4.601 . 0 0 "[ . 1 . 2]" 1
343 1 10 GLN HE21 1 13 TRP HB2 . . 5.690 2.978 2.240 4.448 . 0 0 "[ . 1 . 2]" 1
344 1 10 GLN HE21 1 13 TRP HB3 . . 5.690 4.273 3.591 5.390 . 0 0 "[ . 1 . 2]" 1
345 1 10 GLN HE21 1 14 ASP H . . 5.380 3.294 2.607 5.265 . 0 0 "[ . 1 . 2]" 1
346 1 10 GLN HE22 1 13 TRP HB2 . . 5.690 3.151 2.116 3.915 . 0 0 "[ . 1 . 2]" 1
347 1 10 GLN HE22 1 13 TRP HB3 . . 5.690 3.941 2.987 4.661 . 0 0 "[ . 1 . 2]" 1
348 1 10 GLN HE22 1 14 ASP H . . 5.380 4.290 3.211 5.329 . 0 0 "[ . 1 . 2]" 1
349 1 10 GLN QG 1 11 PRO QD . . 6.820 3.263 2.991 3.792 . 0 0 "[ . 1 . 2]" 1
350 1 10 GLN QG 1 13 TRP HD1 . . 6.790 4.997 4.333 5.582 . 0 0 "[ . 1 . 2]" 1
351 1 10 GLN QG 1 14 ASP H . . 6.170 4.409 3.986 4.972 . 0 0 "[ . 1 . 2]" 1
352 1 11 PRO HA 1 14 ASP H . . 4.690 3.564 3.383 3.885 . 0 0 "[ . 1 . 2]" 1
353 1 11 PRO HA 1 14 ASP QB . . 4.990 2.537 2.244 2.785 . 0 0 "[ . 1 . 2]" 1
354 1 11 PRO HA 1 15 ARG H . . 5.190 4.125 3.884 4.515 . 0 0 "[ . 1 . 2]" 1
355 1 11 PRO QB 1 12 VAL QG . . 8.300 3.147 2.990 3.310 . 0 0 "[ . 1 . 2]" 1
356 1 11 PRO QB 1 13 TRP H . . 7.150 4.989 4.876 5.102 . 0 0 "[ . 1 . 2]" 1
357 1 11 PRO QB 1 100 PHE QE . . 7.730 2.866 1.974 3.364 . 0 0 "[ . 1 . 2]" 1
358 1 11 PRO HB2 1 100 PHE QD . . 7.630 3.292 2.731 3.821 . 0 0 "[ . 1 . 2]" 1
359 1 11 PRO HB2 1 100 PHE QE . . 7.510 3.043 2.006 3.644 . 0 0 "[ . 1 . 2]" 1
360 1 11 PRO HB2 1 100 PHE HZ . . 6.020 4.023 3.294 4.440 . 0 0 "[ . 1 . 2]" 1
361 1 11 PRO HB3 1 100 PHE QD . . 7.630 4.060 3.560 5.009 . 0 0 "[ . 1 . 2]" 1
362 1 11 PRO HB3 1 100 PHE QE . . 7.510 3.549 2.934 4.040 . 0 0 "[ . 1 . 2]" 1
363 1 11 PRO HB3 1 100 PHE HZ . . 6.020 4.984 4.219 5.598 . 0 0 "[ . 1 . 2]" 1
364 1 11 PRO QD 1 12 VAL H . . 5.480 2.676 2.476 2.895 . 0 0 "[ . 1 . 2]" 1
365 1 11 PRO QD 1 13 TRP H . . 7.060 4.475 4.369 4.608 . 0 0 "[ . 1 . 2]" 1
366 1 11 PRO QD 1 100 PHE QE . . 8.310 3.764 3.278 4.142 . 0 0 "[ . 1 . 2]" 1
367 1 11 PRO QD 1 100 PHE HZ . . 6.140 3.676 3.096 4.362 . 0 0 "[ . 1 . 2]" 1
368 1 11 PRO HD2 1 12 VAL H . . 5.410 2.725 2.513 2.962 . 0 0 "[ . 1 . 2]" 1
369 1 11 PRO HD3 1 12 VAL H . . 5.410 3.924 3.720 4.109 . 0 0 "[ . 1 . 2]" 1
370 1 11 PRO QG 1 12 VAL H . . 5.920 3.910 3.841 4.042 . 0 0 "[ . 1 . 2]" 1
371 1 11 PRO QG 1 100 PHE QE . . 7.630 2.629 1.893 3.156 . 0 0 "[ . 1 . 2]" 1
372 1 11 PRO HG2 1 100 PHE QE . . 7.420 2.672 1.900 3.227 . 0 0 "[ . 1 . 2]" 1
373 1 11 PRO HG2 1 100 PHE HZ . . 5.500 2.852 2.408 3.355 . 0 0 "[ . 1 . 2]" 1
374 1 11 PRO HG3 1 100 PHE QE . . 7.420 3.988 3.571 4.471 . 0 0 "[ . 1 . 2]" 1
375 1 11 PRO HG3 1 100 PHE HZ . . 5.500 4.539 4.080 5.105 . 0 0 "[ . 1 . 2]" 1
376 1 12 VAL H 1 12 VAL HB . . 3.870 2.537 2.476 2.571 . 0 0 "[ . 1 . 2]" 1
377 1 12 VAL H 1 13 TRP H . . 3.800 2.509 2.415 2.582 . 0 0 "[ . 1 . 2]" 1
378 1 12 VAL H 1 13 TRP HB2 . . 5.500 4.577 4.428 4.645 . 0 0 "[ . 1 . 2]" 1
379 1 12 VAL H 1 13 TRP HB3 . . 6.000 6.006 5.899 6.045 0.045 16 0 "[ . 1 . 2]" 1
380 1 12 VAL H 1 14 ASP H . . 4.970 3.831 3.621 4.011 . 0 0 "[ . 1 . 2]" 1
381 1 12 VAL HA 1 15 ARG H . . 4.720 3.472 3.182 3.624 . 0 0 "[ . 1 . 2]" 1
382 1 12 VAL HA 1 15 ARG QB . . 5.240 2.864 2.525 3.356 . 0 0 "[ . 1 . 2]" 1
383 1 12 VAL HA 1 15 ARG HG2 . . 5.850 5.122 3.317 5.585 . 0 0 "[ . 1 . 2]" 1
384 1 12 VAL HA 1 15 ARG QG . . 5.900 4.375 2.548 5.099 . 0 0 "[ . 1 . 2]" 1
385 1 12 VAL HA 1 15 ARG HG3 . . 5.850 4.992 2.647 5.907 0.057 1 0 "[ . 1 . 2]" 1
386 1 12 VAL HA 1 16 TYR H . . 5.280 4.038 3.794 4.471 . 0 0 "[ . 1 . 2]" 1
387 1 12 VAL HA 1 96 ALA HA . . 5.610 5.141 4.469 5.616 0.006 4 0 "[ . 1 . 2]" 1
388 1 12 VAL HA 1 96 ALA MB . . 5.520 3.165 2.337 3.766 . 0 0 "[ . 1 . 2]" 1
389 1 12 VAL HB 1 13 TRP H . . 4.230 2.481 2.377 2.579 . 0 0 "[ . 1 . 2]" 1
390 1 12 VAL HB 1 14 ASP H . . 6.340 4.886 4.673 5.051 . 0 0 "[ . 1 . 2]" 1
391 1 12 VAL HB 1 15 ARG H . . 6.140 5.549 5.349 5.785 . 0 0 "[ . 1 . 2]" 1
392 1 12 VAL QG 1 13 TRP H . . 6.420 3.153 3.069 3.215 . 0 0 "[ . 1 . 2]" 1
393 1 12 VAL QG 1 13 TRP HA . . 8.350 3.459 3.337 3.553 . 0 0 "[ . 1 . 2]" 1
394 1 12 VAL QG 1 13 TRP QB . . 9.030 4.446 4.348 4.567 . 0 0 "[ . 1 . 2]" 1
395 1 12 VAL QG 1 15 ARG H . . 7.170 4.376 4.165 4.501 . 0 0 "[ . 1 . 2]" 1
396 1 12 VAL QG 1 15 ARG QB . . 8.090 3.584 3.107 3.896 . 0 0 "[ . 1 . 2]" 1
397 1 12 VAL QG 1 15 ARG QD . . 7.800 3.989 3.296 4.693 . 0 0 "[ . 1 . 2]" 1
398 1 12 VAL QG 1 16 TYR QB . . 8.580 3.105 2.790 3.581 . 0 0 "[ . 1 . 2]" 1
399 1 12 VAL QG 1 93 PHE HA . . 7.750 4.125 3.334 4.889 . 0 0 "[ . 1 . 2]" 1
400 1 12 VAL QG 1 93 PHE QD . . 9.320 3.393 2.753 4.087 . 0 0 "[ . 1 . 2]" 1
401 1 12 VAL QG 1 93 PHE QE . . 8.670 2.833 2.203 3.465 . 0 0 "[ . 1 . 2]" 1
402 1 12 VAL QG 1 93 PHE HZ . . 7.460 3.863 3.273 4.471 . 0 0 "[ . 1 . 2]" 1
403 1 12 VAL QG 1 96 ALA H . . 7.320 4.691 4.012 5.379 . 0 0 "[ . 1 . 2]" 1
404 1 12 VAL QG 1 96 ALA MB . . 6.690 2.390 1.875 2.969 . 0 0 "[ . 1 . 2]" 1
405 1 12 VAL QG 1 97 MET H . . 6.540 3.489 2.977 4.011 . 0 0 "[ . 1 . 2]" 1
406 1 12 VAL QG 1 97 MET HA . . 5.780 2.626 2.087 3.129 . 0 0 "[ . 1 . 2]" 1
407 1 12 VAL QG 1 97 MET QB . . 8.060 3.408 2.301 4.188 . 0 0 "[ . 1 . 2]" 1
408 1 12 VAL QG 1 97 MET QG . . 7.290 2.597 1.877 3.558 . 0 0 "[ . 1 . 2]" 1
409 1 12 VAL QG 1 100 PHE H . . 7.110 4.179 3.732 4.471 . 0 0 "[ . 1 . 2]" 1
410 1 12 VAL QG 1 100 PHE HA . . 7.210 4.695 4.403 5.055 . 0 0 "[ . 1 . 2]" 1
411 1 12 VAL QG 1 100 PHE QB . . 6.970 2.424 2.094 2.612 . 0 0 "[ . 1 . 2]" 1
412 1 12 VAL QG 1 100 PHE QD . . 8.780 2.616 2.319 2.963 . 0 0 "[ . 1 . 2]" 1
413 1 12 VAL QG 1 100 PHE QE . . 9.260 3.355 2.993 3.709 . 0 0 "[ . 1 . 2]" 1
414 1 12 VAL QG 1 100 PHE HZ . . 7.730 4.383 3.540 5.050 . 0 0 "[ . 1 . 2]" 1
415 1 12 VAL QG 1 101 LEU H . . 8.200 4.246 3.910 4.660 . 0 0 "[ . 1 . 2]" 1
416 1 12 VAL MG1 1 13 TRP H . . 5.930 3.404 3.261 3.523 . 0 0 "[ . 1 . 2]" 1
417 1 12 VAL MG1 1 14 ASP H . . 6.520 4.987 4.757 5.162 . 0 0 "[ . 1 . 2]" 1
418 1 12 VAL MG1 1 15 ARG H . . 6.950 4.699 4.463 4.851 . 0 0 "[ . 1 . 2]" 1
419 1 12 VAL MG1 1 15 ARG QB . . 7.980 3.773 3.200 4.116 . 0 0 "[ . 1 . 2]" 1
420 1 12 VAL MG1 1 15 ARG HD2 . . 7.350 5.265 3.858 6.296 . 0 0 "[ . 1 . 2]" 1
421 1 12 VAL MG1 1 15 ARG HD3 . . 7.350 4.968 3.761 6.369 . 0 0 "[ . 1 . 2]" 1
422 1 12 VAL MG1 1 16 TYR H . . 6.520 3.955 3.716 4.253 . 0 0 "[ . 1 . 2]" 1
423 1 12 VAL MG1 1 96 ALA H . . 7.520 4.820 4.106 5.559 . 0 0 "[ . 1 . 2]" 1
424 1 12 VAL MG1 1 96 ALA MB . . 6.770 2.414 1.887 3.010 . 0 0 "[ . 1 . 2]" 1
425 1 12 VAL MG1 1 97 MET H . . 6.570 3.578 3.055 4.129 . 0 0 "[ . 1 . 2]" 1
426 1 12 VAL MG1 1 97 MET HA . . 5.330 2.937 2.154 3.479 . 0 0 "[ . 1 . 2]" 1
427 1 12 VAL MG1 1 97 MET QB . . 7.880 3.614 2.352 4.478 . 0 0 "[ . 1 . 2]" 1
428 1 12 VAL MG1 1 97 MET ME . . 6.480 3.844 2.741 4.632 . 0 0 "[ . 1 . 2]" 1
429 1 12 VAL MG1 1 97 MET HG2 . . 7.240 3.112 2.003 5.291 . 0 0 "[ . 1 . 2]" 1
430 1 12 VAL MG1 1 97 MET HG3 . . 7.240 3.505 2.167 4.483 . 0 0 "[ . 1 . 2]" 1
431 1 12 VAL MG1 1 100 PHE H . . 7.520 5.154 4.600 5.594 . 0 0 "[ . 1 . 2]" 1
432 1 12 VAL MG1 1 100 PHE QD . . 8.650 4.542 4.280 4.785 . 0 0 "[ . 1 . 2]" 1
433 1 12 VAL MG2 1 13 TRP H . . 5.930 3.729 3.659 3.843 . 0 0 "[ . 1 . 2]" 1
434 1 12 VAL MG2 1 14 ASP H . . 6.520 5.251 5.109 5.419 . 0 0 "[ . 1 . 2]" 1
435 1 12 VAL MG2 1 15 ARG H . . 6.950 5.224 4.987 5.361 . 0 0 "[ . 1 . 2]" 1
436 1 12 VAL MG2 1 15 ARG QB . . 7.980 4.485 4.050 4.962 . 0 0 "[ . 1 . 2]" 1
437 1 12 VAL MG2 1 15 ARG HD2 . . 7.350 5.277 3.788 6.211 . 0 0 "[ . 1 . 2]" 1
438 1 12 VAL MG2 1 15 ARG HD3 . . 7.350 5.360 4.536 6.585 . 0 0 "[ . 1 . 2]" 1
439 1 12 VAL MG2 1 16 TYR H . . 6.520 5.640 5.418 5.974 . 0 0 "[ . 1 . 2]" 1
440 1 12 VAL MG2 1 96 ALA H . . 7.520 6.451 5.640 7.158 . 0 0 "[ . 1 . 2]" 1
441 1 12 VAL MG2 1 96 ALA MB . . 6.770 3.861 3.116 4.533 . 0 0 "[ . 1 . 2]" 1
442 1 12 VAL MG2 1 97 MET H . . 6.570 4.865 4.109 5.446 . 0 0 "[ . 1 . 2]" 1
443 1 12 VAL MG2 1 97 MET HA . . 5.330 3.023 2.459 3.693 . 0 0 "[ . 1 . 2]" 1
444 1 12 VAL MG2 1 97 MET QB . . 7.880 4.284 3.259 5.037 . 0 0 "[ . 1 . 2]" 1
445 1 12 VAL MG2 1 97 MET ME . . 6.480 3.872 3.235 4.492 . 0 0 "[ . 1 . 2]" 1
446 1 12 VAL MG2 1 97 MET HG2 . . 7.240 3.934 2.358 5.433 . 0 0 "[ . 1 . 2]" 1
447 1 12 VAL MG2 1 97 MET HG3 . . 7.240 4.395 2.204 5.661 . 0 0 "[ . 1 . 2]" 1
448 1 12 VAL MG2 1 100 PHE H . . 7.520 4.426 3.947 4.755 . 0 0 "[ . 1 . 2]" 1
449 1 12 VAL MG2 1 100 PHE QD . . 8.650 2.633 2.329 2.997 . 0 0 "[ . 1 . 2]" 1
450 1 13 TRP H 1 13 TRP HD1 . . 5.120 3.464 3.091 3.810 . 0 0 "[ . 1 . 2]" 1
451 1 13 TRP H 1 13 TRP HE1 . . 6.180 5.004 4.709 5.234 . 0 0 "[ . 1 . 2]" 1
452 1 13 TRP H 1 14 ASP H . . 4.160 2.648 2.560 2.731 . 0 0 "[ . 1 . 2]" 1
453 1 13 TRP H 1 14 ASP QB . . 7.380 4.402 4.265 4.541 . 0 0 "[ . 1 . 2]" 1
454 1 13 TRP HA 1 13 TRP HE3 . . 4.120 2.007 1.758 2.438 . 0 0 "[ . 1 . 2]" 1
455 1 13 TRP HA 1 15 ARG H . . 6.070 4.459 4.202 4.688 . 0 0 "[ . 1 . 2]" 1
456 1 13 TRP HA 1 16 TYR H . . 5.060 3.305 3.050 3.463 . 0 0 "[ . 1 . 2]" 1
457 1 13 TRP HA 1 16 TYR HB2 . . 5.480 3.062 2.484 3.586 . 0 0 "[ . 1 . 2]" 1
458 1 13 TRP HA 1 16 TYR QB . . 5.680 2.316 2.046 2.598 . 0 0 "[ . 1 . 2]" 1
459 1 13 TRP HA 1 16 TYR HB3 . . 5.480 2.412 2.177 2.704 . 0 0 "[ . 1 . 2]" 1
460 1 13 TRP HA 1 16 TYR QD . . 7.690 3.754 3.302 4.099 . 0 0 "[ . 1 . 2]" 1
461 1 13 TRP HA 1 17 ASP H . . 5.420 3.897 3.414 4.342 . 0 0 "[ . 1 . 2]" 1
462 1 13 TRP QB 1 14 ASP H . . 5.000 2.629 2.469 2.859 . 0 0 "[ . 1 . 2]" 1
463 1 13 TRP QB 1 15 ARG H . . 6.830 4.816 4.616 5.058 . 0 0 "[ . 1 . 2]" 1
464 1 13 TRP HB2 1 14 ASP H . . 4.840 2.698 2.526 2.946 . 0 0 "[ . 1 . 2]" 1
465 1 13 TRP HB3 1 14 ASP H . . 4.840 3.639 3.475 3.859 . 0 0 "[ . 1 . 2]" 1
466 1 13 TRP HD1 1 14 ASP H . . 6.140 4.943 4.681 5.221 . 0 0 "[ . 1 . 2]" 1
467 1 13 TRP HE1 1 58 LEU QD . . 6.600 4.118 2.378 5.124 . 0 0 "[ . 1 . 2]" 1
468 1 13 TRP HE1 1 73 VAL QG . . 7.950 4.890 3.963 5.974 . 0 0 "[ . 1 . 2]" 1
469 1 13 TRP HE1 1 82 ILE MD . . 6.420 3.568 2.679 4.596 . 0 0 "[ . 1 . 2]" 1
470 1 13 TRP HE1 1 82 ILE MG . . 6.520 5.918 5.105 6.567 0.047 4 0 "[ . 1 . 2]" 1
471 1 13 TRP HE3 1 14 ASP H . . 5.500 5.398 5.226 5.545 0.045 4 0 "[ . 1 . 2]" 1
472 1 13 TRP HE3 1 16 TYR H . . 5.500 4.737 4.332 5.312 . 0 0 "[ . 1 . 2]" 1
473 1 13 TRP HE3 1 16 TYR HB2 . . 6.040 3.480 2.756 4.216 . 0 0 "[ . 1 . 2]" 1
474 1 13 TRP HE3 1 16 TYR QB . . 6.200 2.686 2.315 3.130 . 0 0 "[ . 1 . 2]" 1
475 1 13 TRP HE3 1 16 TYR HB3 . . 6.040 2.820 2.445 3.231 . 0 0 "[ . 1 . 2]" 1
476 1 13 TRP HE3 1 17 ASP H . . 5.980 4.760 4.247 5.353 . 0 0 "[ . 1 . 2]" 1
477 1 13 TRP HE3 1 83 ARG QD . . 5.900 4.570 3.440 5.760 . 0 0 "[ . 1 . 2]" 1
478 1 13 TRP HH2 1 58 LEU QD . . 8.500 4.679 4.043 5.753 . 0 0 "[ . 1 . 2]" 1
479 1 13 TRP HH2 1 73 VAL MG1 . . 5.870 3.399 2.303 4.626 . 0 0 "[ . 1 . 2]" 1
480 1 13 TRP HH2 1 73 VAL QG . . 6.140 2.645 1.752 3.984 . 0 0 "[ . 1 . 2]" 1
481 1 13 TRP HH2 1 73 VAL MG2 . . 5.870 2.855 1.782 4.601 . 0 0 "[ . 1 . 2]" 1
482 1 13 TRP HH2 1 83 ARG HB2 . . 5.900 3.297 2.329 4.934 . 0 0 "[ . 1 . 2]" 1
483 1 13 TRP HH2 1 83 ARG HB3 . . 5.900 3.056 2.481 3.973 . 0 0 "[ . 1 . 2]" 1
484 1 13 TRP HH2 1 83 ARG HD2 . . 5.930 4.632 3.199 5.503 . 0 0 "[ . 1 . 2]" 1
485 1 13 TRP HH2 1 83 ARG QD . . 6.100 3.461 1.838 4.464 . 0 0 "[ . 1 . 2]" 1
486 1 13 TRP HH2 1 83 ARG HD3 . . 5.930 3.641 1.849 5.121 . 0 0 "[ . 1 . 2]" 1
487 1 13 TRP HH2 1 83 ARG QG . . 5.710 2.699 1.751 5.238 . 0 0 "[ . 1 . 2]" 1
488 1 13 TRP HH2 1 85 ILE MD . . 5.420 2.896 1.905 4.970 . 0 0 "[ . 1 . 2]" 1
489 1 13 TRP HH2 1 85 ILE QG . . 6.450 4.162 3.333 5.585 . 0 0 "[ . 1 . 2]" 1
490 1 13 TRP HZ2 1 58 LEU MD1 . . 6.520 4.361 2.397 5.714 . 0 0 "[ . 1 . 2]" 1
491 1 13 TRP HZ2 1 58 LEU QD . . 6.500 3.485 2.348 4.494 . 0 0 "[ . 1 . 2]" 1
492 1 13 TRP HZ2 1 58 LEU MD2 . . 6.520 4.098 2.609 5.583 . 0 0 "[ . 1 . 2]" 1
493 1 13 TRP HZ2 1 73 VAL MG1 . . 5.490 3.011 1.904 4.160 . 0 0 "[ . 1 . 2]" 1
494 1 13 TRP HZ2 1 73 VAL QG . . 5.940 2.904 1.889 4.068 . 0 0 "[ . 1 . 2]" 1
495 1 13 TRP HZ2 1 73 VAL MG2 . . 5.490 4.009 2.924 5.751 0.261 20 0 "[ . 1 . 2]" 1
496 1 13 TRP HZ2 1 82 ILE MD . . 6.070 3.021 2.529 3.794 . 0 0 "[ . 1 . 2]" 1
497 1 13 TRP HZ2 1 82 ILE MG . . 6.790 5.604 4.951 6.447 . 0 0 "[ . 1 . 2]" 1
498 1 13 TRP HZ2 1 83 ARG HD2 . . 5.550 5.524 4.837 5.694 0.144 19 0 "[ . 1 . 2]" 1
499 1 13 TRP HZ2 1 83 ARG HD3 . . 5.550 4.364 3.153 5.688 0.138 11 0 "[ . 1 . 2]" 1
500 1 13 TRP HZ3 1 83 ARG HD2 . . 5.510 4.872 3.268 5.530 0.020 7 0 "[ . 1 . 2]" 1
501 1 13 TRP HZ3 1 83 ARG QD . . 5.740 3.713 2.188 4.384 . 0 0 "[ . 1 . 2]" 1
502 1 13 TRP HZ3 1 83 ARG HD3 . . 5.510 3.932 2.218 5.195 . 0 0 "[ . 1 . 2]" 1
503 1 13 TRP HZ3 1 85 ILE MD . . 5.590 3.150 2.174 5.027 . 0 0 "[ . 1 . 2]" 1
504 1 14 ASP H 1 15 ARG H . . 4.090 2.736 2.546 2.921 . 0 0 "[ . 1 . 2]" 1
505 1 14 ASP H 1 15 ARG HA . . 5.500 5.334 5.201 5.469 . 0 0 "[ . 1 . 2]" 1
506 1 14 ASP H 1 15 ARG QB . . 6.270 4.534 4.258 4.807 . 0 0 "[ . 1 . 2]" 1
507 1 14 ASP H 1 17 ASP H . . 5.470 4.813 4.631 5.109 . 0 0 "[ . 1 . 2]" 1
508 1 14 ASP HA 1 17 ASP H . . 5.110 3.764 3.289 4.285 . 0 0 "[ . 1 . 2]" 1
509 1 14 ASP HA 1 17 ASP QB . . 5.320 3.212 2.744 3.871 . 0 0 "[ . 1 . 2]" 1
510 1 14 ASP HA 1 18 THR MG . . 6.550 5.375 3.769 6.608 0.058 16 0 "[ . 1 . 2]" 1
511 1 14 ASP QB 1 15 ARG H . . 5.000 2.448 2.295 2.658 . 0 0 "[ . 1 . 2]" 1
512 1 15 ARG H 1 15 ARG HD2 . . 5.500 4.665 4.033 5.177 . 0 0 "[ . 1 . 2]" 1
513 1 15 ARG H 1 15 ARG HD3 . . 5.500 4.899 4.176 5.773 0.273 10 0 "[ . 1 . 2]" 1
514 1 15 ARG H 1 15 ARG HG2 . . 4.760 4.089 2.299 4.566 . 0 0 "[ . 1 . 2]" 1
515 1 15 ARG H 1 15 ARG QG . . 5.000 3.415 2.261 3.975 . 0 0 "[ . 1 . 2]" 1
516 1 15 ARG H 1 15 ARG HG3 . . 4.760 3.782 2.330 4.525 . 0 0 "[ . 1 . 2]" 1
517 1 15 ARG H 1 16 TYR H . . 4.060 2.582 2.427 2.751 . 0 0 "[ . 1 . 2]" 1
518 1 15 ARG H 1 16 TYR HB2 . . 6.500 4.882 4.612 5.088 . 0 0 "[ . 1 . 2]" 1
519 1 15 ARG H 1 16 TYR QB . . 6.560 4.298 4.134 4.503 . 0 0 "[ . 1 . 2]" 1
520 1 15 ARG H 1 16 TYR HB3 . . 6.500 4.784 4.497 5.140 . 0 0 "[ . 1 . 2]" 1
521 1 15 ARG H 1 17 ASP H . . 5.500 4.314 4.079 4.549 . 0 0 "[ . 1 . 2]" 1
522 1 15 ARG H 1 96 ALA MB . . 6.360 4.433 3.913 5.133 . 0 0 "[ . 1 . 2]" 1
523 1 15 ARG HA 1 15 ARG HD2 . . 4.680 4.373 3.490 4.673 . 0 0 "[ . 1 . 2]" 1
524 1 15 ARG HA 1 15 ARG HD3 . . 4.680 4.461 2.560 4.692 0.012 12 0 "[ . 1 . 2]" 1
525 1 15 ARG HA 1 15 ARG HG2 . . 4.190 2.893 2.287 3.239 . 0 0 "[ . 1 . 2]" 1
526 1 15 ARG HA 1 15 ARG HG3 . . 4.190 2.749 2.365 3.787 . 0 0 "[ . 1 . 2]" 1
527 1 15 ARG HA 1 18 THR H . . 5.040 3.453 3.146 3.988 . 0 0 "[ . 1 . 2]" 1
528 1 15 ARG HA 1 18 THR HB . . 4.180 3.344 2.061 4.287 0.107 19 0 "[ . 1 . 2]" 1
529 1 15 ARG HA 1 18 THR MG . . 6.010 3.666 1.781 5.143 . 0 0 "[ . 1 . 2]" 1
530 1 15 ARG HA 1 19 GLN H . . 5.310 4.093 3.502 4.758 . 0 0 "[ . 1 . 2]" 1
531 1 15 ARG HA 1 96 ALA MB . . 6.270 4.723 4.143 5.523 . 0 0 "[ . 1 . 2]" 1
532 1 15 ARG QB 1 16 TYR H . . 5.030 2.627 2.306 2.946 . 0 0 "[ . 1 . 2]" 1
533 1 15 ARG QB 1 17 ASP H . . 7.150 4.895 4.693 5.116 . 0 0 "[ . 1 . 2]" 1
534 1 15 ARG QB 1 96 ALA MB . . 6.100 2.424 1.869 3.185 . 0 0 "[ . 1 . 2]" 1
535 1 15 ARG QD 1 96 ALA HA . . 5.190 2.608 1.876 3.422 . 0 0 "[ . 1 . 2]" 1
536 1 15 ARG HD2 1 96 ALA HA . . 4.910 3.680 2.813 4.574 . 0 0 "[ . 1 . 2]" 1
537 1 15 ARG HD2 1 96 ALA MB . . 5.130 3.619 2.441 4.533 . 0 0 "[ . 1 . 2]" 1
538 1 15 ARG HD3 1 96 ALA HA . . 4.910 2.878 1.889 4.928 0.018 4 0 "[ . 1 . 2]" 1
539 1 15 ARG HD3 1 96 ALA MB . . 5.130 3.012 1.884 4.577 . 0 0 "[ . 1 . 2]" 1
540 1 15 ARG QG 1 16 TYR H . . 5.400 3.923 3.242 4.281 . 0 0 "[ . 1 . 2]" 1
541 1 15 ARG QG 1 96 ALA HA . . 5.530 3.880 2.820 4.711 . 0 0 "[ . 1 . 2]" 1
542 1 15 ARG QG 1 96 ALA MB . . 5.550 3.123 2.396 3.936 . 0 0 "[ . 1 . 2]" 1
543 1 15 ARG HG2 1 16 TYR H . . 5.270 4.315 3.329 5.155 . 0 0 "[ . 1 . 2]" 1
544 1 15 ARG HG2 1 96 ALA HA . . 5.380 4.206 2.856 5.413 0.033 11 0 "[ . 1 . 2]" 1
545 1 15 ARG HG2 1 96 ALA MB . . 5.530 3.432 2.591 4.686 . 0 0 "[ . 1 . 2]" 1
546 1 15 ARG HG3 1 16 TYR H . . 5.270 4.705 4.360 5.043 . 0 0 "[ . 1 . 2]" 1
547 1 15 ARG HG3 1 96 ALA HA . . 5.380 4.909 3.917 5.392 0.012 15 0 "[ . 1 . 2]" 1
548 1 15 ARG HG3 1 96 ALA MB . . 5.530 4.094 2.424 4.833 . 0 0 "[ . 1 . 2]" 1
549 1 16 TYR H 1 16 TYR HB2 . . 4.190 2.485 2.332 2.659 . 0 0 "[ . 1 . 2]" 1
550 1 16 TYR H 1 16 TYR HB3 . . 4.190 2.530 2.346 2.694 . 0 0 "[ . 1 . 2]" 1
551 1 16 TYR H 1 17 ASP H . . 4.270 2.775 2.627 2.913 . 0 0 "[ . 1 . 2]" 1
552 1 16 TYR H 1 19 GLN H . . 5.650 4.715 4.483 5.016 . 0 0 "[ . 1 . 2]" 1
553 1 16 TYR H 1 96 ALA MB . . 6.410 3.508 3.038 3.929 . 0 0 "[ . 1 . 2]" 1
554 1 16 TYR HA 1 20 ILE HB . . 5.020 5.058 4.392 5.236 0.216 5 0 "[ . 1 . 2]" 1
555 1 16 TYR HA 1 96 ALA MB . . 6.540 3.258 2.674 4.176 . 0 0 "[ . 1 . 2]" 1
556 1 16 TYR QB 1 96 ALA MB . . 7.060 3.245 2.583 4.079 . 0 0 "[ . 1 . 2]" 1
557 1 16 TYR HB2 1 17 ASP H . . 4.630 3.799 3.633 3.957 . 0 0 "[ . 1 . 2]" 1
558 1 16 TYR HB3 1 17 ASP H . . 4.630 2.462 2.268 2.676 . 0 0 "[ . 1 . 2]" 1
559 1 16 TYR QD 1 17 ASP H . . 7.360 3.574 3.227 4.207 . 0 0 "[ . 1 . 2]" 1
560 1 16 TYR QD 1 17 ASP HA . . 7.450 3.826 3.119 4.684 . 0 0 "[ . 1 . 2]" 1
561 1 16 TYR QD 1 17 ASP HB2 . . 8.110 4.337 3.643 5.219 . 0 0 "[ . 1 . 2]" 1
562 1 16 TYR QD 1 17 ASP HB3 . . 8.110 5.387 4.888 6.059 . 0 0 "[ . 1 . 2]" 1
563 1 16 TYR QD 1 20 ILE MD . . 8.630 3.779 3.095 5.279 . 0 0 "[ . 1 . 2]" 1
564 1 16 TYR QD 1 20 ILE MG . . 9.330 5.026 4.071 5.749 . 0 0 "[ . 1 . 2]" 1
565 1 16 TYR QD 1 83 ARG HD2 . . 7.760 6.271 4.626 7.734 . 0 0 "[ . 1 . 2]" 1
566 1 16 TYR QD 1 83 ARG QD . . 7.880 5.244 4.048 6.396 . 0 0 "[ . 1 . 2]" 1
567 1 16 TYR QD 1 83 ARG HD3 . . 7.760 5.696 4.471 6.860 . 0 0 "[ . 1 . 2]" 1
568 1 16 TYR QD 1 92 ASP HB2 . . 7.630 3.867 2.004 5.494 . 0 0 "[ . 1 . 2]" 1
569 1 16 TYR QD 1 92 ASP QB . . 7.740 3.321 1.882 4.399 . 0 0 "[ . 1 . 2]" 1
570 1 16 TYR QD 1 92 ASP HB3 . . 7.630 3.744 2.281 5.736 . 0 0 "[ . 1 . 2]" 1
571 1 16 TYR QD 1 93 PHE HA . . 6.980 2.496 2.060 3.888 . 0 0 "[ . 1 . 2]" 1
572 1 16 TYR QD 1 93 PHE QB . . 8.700 3.197 2.509 3.769 . 0 0 "[ . 1 . 2]" 1
573 1 16 TYR QD 1 93 PHE QD . . 10.300 3.128 2.316 4.778 . 0 0 "[ . 1 . 2]" 1
574 1 16 TYR QE 1 20 ILE MD . . 8.090 3.015 2.504 4.364 . 0 0 "[ . 1 . 2]" 1
575 1 16 TYR QE 1 20 ILE MG . . 9.200 4.548 3.362 5.728 . 0 0 "[ . 1 . 2]" 1
576 1 16 TYR QE 1 83 ARG HD2 . . 7.840 5.530 4.034 7.256 . 0 0 "[ . 1 . 2]" 1
577 1 16 TYR QE 1 83 ARG QD . . 8.040 4.811 3.518 6.225 . 0 0 "[ . 1 . 2]" 1
578 1 16 TYR QE 1 83 ARG HD3 . . 7.840 5.378 3.664 6.895 . 0 0 "[ . 1 . 2]" 1
579 1 16 TYR QE 1 85 ILE MD . . 8.590 3.946 3.066 4.960 . 0 0 "[ . 1 . 2]" 1
580 1 16 TYR QE 1 85 ILE MG . . 7.600 3.357 2.594 3.904 . 0 0 "[ . 1 . 2]" 1
581 1 16 TYR QE 1 89 ARG HB2 . . 6.830 4.593 4.102 5.412 . 0 0 "[ . 1 . 2]" 1
582 1 16 TYR QE 1 89 ARG QB . . 6.950 3.340 2.808 4.249 . 0 0 "[ . 1 . 2]" 1
583 1 16 TYR QE 1 89 ARG HB3 . . 6.830 3.446 2.852 4.442 . 0 0 "[ . 1 . 2]" 1
584 1 16 TYR QE 1 89 ARG HD2 . . 8.170 4.498 3.286 6.761 . 0 0 "[ . 1 . 2]" 1
585 1 16 TYR QE 1 89 ARG QD . . 8.240 4.055 3.190 5.317 . 0 0 "[ . 1 . 2]" 1
586 1 16 TYR QE 1 89 ARG HD3 . . 8.170 4.918 3.445 5.671 . 0 0 "[ . 1 . 2]" 1
587 1 16 TYR QE 1 89 ARG HG2 . . 7.660 5.341 2.000 7.048 . 0 0 "[ . 1 . 2]" 1
588 1 16 TYR QE 1 89 ARG HG3 . . 7.660 5.450 2.526 6.500 . 0 0 "[ . 1 . 2]" 1
589 1 16 TYR QE 1 92 ASP QB . . 7.500 2.842 1.813 4.807 . 0 0 "[ . 1 . 2]" 1
590 1 16 TYR QE 1 93 PHE H . . 7.210 3.005 2.301 4.413 . 0 0 "[ . 1 . 2]" 1
591 1 16 TYR QE 1 93 PHE HA . . 7.350 3.491 2.664 5.500 . 0 0 "[ . 1 . 2]" 1
592 1 16 TYR QE 1 93 PHE QB . . 7.500 2.416 1.767 4.264 . 0 0 "[ . 1 . 2]" 1
593 1 17 ASP H 1 18 THR H . . 4.170 2.659 2.525 2.856 . 0 0 "[ . 1 . 2]" 1
594 1 17 ASP H 1 18 THR MG . . 6.770 5.245 4.145 6.132 . 0 0 "[ . 1 . 2]" 1
595 1 17 ASP H 1 19 GLN H . . 5.670 4.109 3.944 4.232 . 0 0 "[ . 1 . 2]" 1
596 1 17 ASP HA 1 19 GLN H . . 5.690 4.268 3.635 4.764 . 0 0 "[ . 1 . 2]" 1
597 1 17 ASP HA 1 20 ILE HB . . 4.880 2.636 2.296 3.667 . 0 0 "[ . 1 . 2]" 1
598 1 17 ASP HA 1 20 ILE MD . . 5.890 4.237 2.463 5.346 . 0 0 "[ . 1 . 2]" 1
599 1 17 ASP HA 1 20 ILE HG12 . . 5.040 4.332 3.743 5.093 0.053 3 0 "[ . 1 . 2]" 1
600 1 17 ASP HA 1 20 ILE QG . . 5.320 3.670 3.232 4.230 . 0 0 "[ . 1 . 2]" 1
601 1 17 ASP HA 1 20 ILE HG13 . . 5.040 4.108 3.534 5.123 0.083 18 0 "[ . 1 . 2]" 1
602 1 17 ASP HA 1 20 ILE MG . . 6.390 3.672 2.353 4.639 . 0 0 "[ . 1 . 2]" 1
603 1 17 ASP QB 1 18 THR H . . 5.080 2.671 2.270 3.070 . 0 0 "[ . 1 . 2]" 1
604 1 17 ASP QB 1 18 THR MG . . 6.810 4.405 3.071 5.390 . 0 0 "[ . 1 . 2]" 1
605 1 17 ASP HB2 1 18 THR H . . 4.920 3.643 2.898 4.012 . 0 0 "[ . 1 . 2]" 1
606 1 17 ASP HB2 1 18 THR MG . . 6.620 5.674 3.640 6.703 0.083 15 0 "[ . 1 . 2]" 1
607 1 17 ASP HB3 1 18 THR H . . 4.920 2.914 2.292 3.840 . 0 0 "[ . 1 . 2]" 1
608 1 17 ASP HB3 1 18 THR MG . . 6.620 4.672 3.113 6.048 . 0 0 "[ . 1 . 2]" 1
609 1 18 THR H 1 18 THR HB . . 3.900 2.910 2.390 3.616 . 0 0 "[ . 1 . 2]" 1
610 1 18 THR H 1 19 GLN H . . 3.730 2.585 2.310 2.892 . 0 0 "[ . 1 . 2]" 1
611 1 18 THR HA 1 21 HIS HB2 . . 5.140 4.387 3.325 5.319 0.179 17 0 "[ . 1 . 2]" 1
612 1 18 THR HA 1 21 HIS QB . . 5.330 3.812 3.280 4.458 . 0 0 "[ . 1 . 2]" 1
613 1 18 THR HA 1 21 HIS HB3 . . 5.140 4.728 3.695 5.223 0.083 6 0 "[ . 1 . 2]" 1
614 1 18 THR HA 1 21 HIS HD2 . . 5.290 2.947 1.767 5.134 . 0 0 "[ . 1 . 2]" 1
615 1 18 THR HB 1 19 GLN H . . 4.190 3.265 2.466 4.209 0.019 13 0 "[ . 1 . 2]" 1
616 1 18 THR MG 1 19 GLN H . . 5.720 3.711 2.236 4.373 . 0 0 "[ . 1 . 2]" 1
617 1 19 GLN H 1 19 GLN HB2 . . 3.850 2.312 2.008 2.572 . 0 0 "[ . 1 . 2]" 1
618 1 19 GLN H 1 19 GLN HB3 . . 3.850 3.174 2.352 3.696 . 0 0 "[ . 1 . 2]" 1
619 1 19 GLN H 1 19 GLN HG2 . . 4.260 3.902 2.421 4.474 0.214 16 0 "[ . 1 . 2]" 1
620 1 19 GLN H 1 19 GLN QG . . 4.600 3.278 2.308 3.953 . 0 0 "[ . 1 . 2]" 1
621 1 19 GLN H 1 19 GLN HG3 . . 4.260 3.758 2.339 4.432 0.172 11 0 "[ . 1 . 2]" 1
622 1 19 GLN H 1 20 ILE HB . . 5.590 4.286 3.789 4.814 . 0 0 "[ . 1 . 2]" 1
623 1 19 GLN H 1 20 ILE QG . . 6.850 4.571 3.966 5.926 . 0 0 "[ . 1 . 2]" 1
624 1 19 GLN H 1 20 ILE MG . . 6.880 5.449 4.573 5.952 . 0 0 "[ . 1 . 2]" 1
625 1 19 GLN HA 1 19 GLN HG2 . . 3.880 2.825 2.389 3.777 . 0 0 "[ . 1 . 2]" 1
626 1 19 GLN HA 1 19 GLN HG3 . . 3.880 3.145 2.409 3.774 . 0 0 "[ . 1 . 2]" 1
627 1 19 GLN HA 1 20 ILE H . . 3.510 3.502 3.376 3.530 0.020 7 0 "[ . 1 . 2]" 1
628 1 19 GLN HA 1 20 ILE HB . . 5.500 5.565 5.459 5.708 0.208 4 0 "[ . 1 . 2]" 1
629 1 19 GLN HA 1 22 ASN HB2 . . 5.350 4.411 2.944 5.455 0.105 6 0 "[ . 1 . 2]" 1
630 1 19 GLN HA 1 22 ASN QB . . 5.480 3.362 2.144 4.171 . 0 0 "[ . 1 . 2]" 1
631 1 19 GLN HA 1 22 ASN HB3 . . 5.350 3.573 2.202 5.040 . 0 0 "[ . 1 . 2]" 1
632 1 19 GLN QB 1 20 ILE H . . 4.700 2.489 2.177 3.150 . 0 0 "[ . 1 . 2]" 1
633 1 19 GLN QB 1 20 ILE HA . . 5.260 3.827 3.357 4.156 . 0 0 "[ . 1 . 2]" 1
634 1 19 GLN QB 1 21 HIS HD2 . . 6.490 5.307 4.928 5.668 . 0 0 "[ . 1 . 2]" 1
635 1 19 GLN HB2 1 20 ILE H . . 4.370 3.056 2.310 3.895 . 0 0 "[ . 1 . 2]" 1
636 1 19 GLN HB3 1 20 ILE H . . 4.370 2.969 2.287 4.021 . 0 0 "[ . 1 . 2]" 1
637 1 19 GLN QE 1 96 ALA MB . . 8.150 4.502 1.892 6.833 . 0 0 "[ . 1 . 2]" 1
638 1 19 GLN QG 1 20 ILE H . . 5.680 4.048 3.437 4.451 . 0 0 "[ . 1 . 2]" 1
639 1 19 GLN HG2 1 20 ILE H . . 5.640 4.705 3.564 5.207 . 0 0 "[ . 1 . 2]" 1
640 1 19 GLN HG3 1 20 ILE H . . 5.640 4.524 3.591 4.983 . 0 0 "[ . 1 . 2]" 1
641 1 20 ILE H 1 20 ILE HB . . 3.640 2.213 1.973 2.377 . 0 0 "[ . 1 . 2]" 1
642 1 20 ILE H 1 20 ILE HG12 . . 4.040 3.045 2.150 4.141 0.101 7 0 "[ . 1 . 2]" 1
643 1 20 ILE H 1 20 ILE HG13 . . 4.040 3.477 2.345 4.259 0.219 7 0 "[ . 1 . 2]" 1
644 1 20 ILE H 1 21 HIS H . . 4.230 2.772 2.519 2.909 . 0 0 "[ . 1 . 2]" 1
645 1 20 ILE HA 1 20 ILE HG12 . . 4.130 2.763 2.328 3.526 . 0 0 "[ . 1 . 2]" 1
646 1 20 ILE HA 1 20 ILE HG13 . . 4.130 3.211 2.375 3.640 . 0 0 "[ . 1 . 2]" 1
647 1 20 ILE HA 1 21 HIS HA . . 5.390 4.687 4.548 4.867 . 0 0 "[ . 1 . 2]" 1
648 1 20 ILE HA 1 23 GLN QG . . 5.380 3.819 2.129 5.433 0.053 17 0 "[ . 1 . 2]" 1
649 1 20 ILE HA 1 89 ARG HD2 . . 5.560 5.038 3.834 5.635 0.075 20 0 "[ . 1 . 2]" 1
650 1 20 ILE HA 1 89 ARG HD3 . . 5.560 4.649 3.892 5.621 0.061 2 0 "[ . 1 . 2]" 1
651 1 20 ILE HB 1 21 HIS H . . 4.890 3.097 2.581 3.641 . 0 0 "[ . 1 . 2]" 1
652 1 20 ILE HB 1 21 HIS HD2 . . 5.990 4.023 1.999 5.900 . 0 0 "[ . 1 . 2]" 1
653 1 20 ILE MD 1 21 HIS H . . 6.910 4.731 4.492 5.160 . 0 0 "[ . 1 . 2]" 1
654 1 20 ILE MD 1 21 HIS QB . . 8.170 5.999 5.344 6.529 . 0 0 "[ . 1 . 2]" 1
655 1 20 ILE MD 1 89 ARG HD2 . . 6.140 2.559 1.746 3.790 . 0 0 "[ . 1 . 2]" 1
656 1 20 ILE MD 1 89 ARG HD3 . . 6.140 2.683 1.688 4.026 . 0 0 "[ . 1 . 2]" 1
657 1 20 ILE QG 1 21 HIS H . . 5.960 4.443 4.173 4.865 . 0 0 "[ . 1 . 2]" 1
658 1 20 ILE HG12 1 89 ARG HD2 . . 5.500 4.124 2.271 5.601 0.101 20 0 "[ . 1 . 2]" 1
659 1 20 ILE HG12 1 89 ARG HD3 . . 5.500 4.204 2.200 5.528 0.028 16 0 "[ . 1 . 2]" 1
660 1 20 ILE HG13 1 89 ARG HD2 . . 5.500 3.927 2.720 5.519 0.019 10 0 "[ . 1 . 2]" 1
661 1 20 ILE HG13 1 89 ARG HD3 . . 5.500 4.150 2.082 5.106 . 0 0 "[ . 1 . 2]" 1
662 1 20 ILE MG 1 21 HIS H . . 5.930 3.221 2.863 3.582 . 0 0 "[ . 1 . 2]" 1
663 1 20 ILE MG 1 21 HIS HA . . 5.430 3.196 2.933 3.478 . 0 0 "[ . 1 . 2]" 1
664 1 20 ILE MG 1 21 HIS HB2 . . 6.520 4.703 4.285 5.228 . 0 0 "[ . 1 . 2]" 1
665 1 20 ILE MG 1 21 HIS QB . . 6.670 3.975 3.164 4.765 . 0 0 "[ . 1 . 2]" 1
666 1 20 ILE MG 1 21 HIS HB3 . . 6.520 4.395 3.238 5.525 . 0 0 "[ . 1 . 2]" 1
667 1 20 ILE MG 1 21 HIS HD2 . . 6.010 4.024 2.459 5.831 . 0 0 "[ . 1 . 2]" 1
668 1 20 ILE MG 1 89 ARG HD2 . . 6.520 3.910 2.419 5.173 . 0 0 "[ . 1 . 2]" 1
669 1 20 ILE MG 1 89 ARG HD3 . . 6.520 3.907 2.209 5.860 . 0 0 "[ . 1 . 2]" 1
670 1 21 HIS H 1 21 HIS HD2 . . 4.780 2.432 2.163 2.871 . 0 0 "[ . 1 . 2]" 1
671 1 21 HIS HA 1 21 HIS HD2 . . 4.680 3.868 3.285 4.612 . 0 0 "[ . 1 . 2]" 1
672 1 22 ASN HB2 1 23 GLN H . . 5.500 4.131 3.441 4.631 . 0 0 "[ . 1 . 2]" 1
673 1 22 ASN HB3 1 23 GLN H . . 5.500 3.449 1.848 4.474 . 0 0 "[ . 1 . 2]" 1
674 1 23 GLN H 1 23 GLN QE . . 5.530 4.106 2.326 5.622 0.092 7 0 "[ . 1 . 2]" 1
675 1 23 GLN HB2 1 24 LYS H . . 4.590 4.105 2.926 4.625 0.035 15 0 "[ . 1 . 2]" 1
676 1 23 GLN HB3 1 24 LYS H . . 4.590 3.988 1.777 4.474 . 0 0 "[ . 1 . 2]" 1
677 1 23 GLN QG 1 24 LYS H . . 5.650 4.375 3.205 4.943 . 0 0 "[ . 1 . 2]" 1
678 1 24 LYS H 1 24 LYS HB2 . . 3.950 2.924 2.239 4.009 0.059 18 0 "[ . 1 . 2]" 1
679 1 24 LYS H 1 24 LYS HB3 . . 3.950 3.319 2.453 3.841 . 0 0 "[ . 1 . 2]" 1
680 1 24 LYS H 1 24 LYS QG . . 4.890 3.157 1.755 4.150 . 0 0 "[ . 1 . 2]" 1
681 1 24 LYS HA 1 25 ASP H . . 3.190 2.523 2.101 3.265 0.075 17 0 "[ . 1 . 2]" 1
682 1 24 LYS QB 1 25 ASP H . . 4.820 3.201 1.750 3.982 . 0 0 "[ . 1 . 2]" 1
683 1 24 LYS HB2 1 25 ASP H . . 4.500 3.824 1.756 4.604 0.104 7 0 "[ . 1 . 2]" 1
684 1 24 LYS HB3 1 25 ASP H . . 4.500 3.661 1.831 4.435 . 0 0 "[ . 1 . 2]" 1
685 1 27 ASP HA 1 30 VAL QG . . 7.130 4.312 2.269 6.388 . 0 0 "[ . 1 . 2]" 1
686 1 28 ASN H 1 30 VAL QG . . 7.230 3.505 2.138 5.275 . 0 0 "[ . 1 . 2]" 1
687 1 28 ASN HB2 1 29 GLU H . . 5.500 3.578 2.061 4.554 . 0 0 "[ . 1 . 2]" 1
688 1 28 ASN HB3 1 29 GLU H . . 5.500 3.170 1.785 4.602 . 0 0 "[ . 1 . 2]" 1
689 1 29 GLU H 1 29 GLU HG2 . . 4.410 3.392 1.928 4.419 0.009 6 0 "[ . 1 . 2]" 1
690 1 29 GLU H 1 29 GLU HG3 . . 4.410 2.928 2.273 3.887 . 0 0 "[ . 1 . 2]" 1
691 1 29 GLU H 1 30 VAL H . . 3.440 2.789 1.863 3.586 0.146 6 0 "[ . 1 . 2]" 1
692 1 29 GLU HA 1 29 GLU HG2 . . 3.870 2.817 2.271 3.816 . 0 0 "[ . 1 . 2]" 1
693 1 29 GLU HA 1 29 GLU HG3 . . 3.870 3.238 2.301 3.819 . 0 0 "[ . 1 . 2]" 1
694 1 29 GLU HA 1 30 VAL H . . 3.000 2.792 2.198 3.322 0.322 3 0 "[ . 1 . 2]" 1
695 1 29 GLU HA 1 30 VAL QG . . 6.590 4.111 3.258 4.543 . 0 0 "[ . 1 . 2]" 1
696 1 29 GLU QB 1 30 VAL H . . 4.810 3.757 2.983 4.043 . 0 0 "[ . 1 . 2]" 1
697 1 29 GLU HB2 1 30 VAL H . . 4.620 4.158 3.084 4.566 . 0 0 "[ . 1 . 2]" 1
698 1 29 GLU HB3 1 30 VAL H . . 4.620 4.351 3.957 4.626 0.006 12 0 "[ . 1 . 2]" 1
699 1 29 GLU HG2 1 30 VAL H . . 5.330 4.896 4.112 5.396 0.066 17 0 "[ . 1 . 2]" 1
700 1 29 GLU HG3 1 30 VAL H . . 5.330 4.741 3.989 5.218 . 0 0 "[ . 1 . 2]" 1
701 1 30 VAL H 1 30 VAL HB . . 3.480 3.256 2.625 3.687 0.207 17 0 "[ . 1 . 2]" 1
702 1 30 VAL H 1 31 PRO HD2 . . 5.400 4.964 4.684 5.351 . 0 0 "[ . 1 . 2]" 1
703 1 30 VAL H 1 31 PRO QD . . 5.650 4.210 3.656 4.416 . 0 0 "[ . 1 . 2]" 1
704 1 30 VAL H 1 31 PRO HD3 . . 5.400 4.603 3.816 5.329 . 0 0 "[ . 1 . 2]" 1
705 1 30 VAL HA 1 31 PRO HD2 . . 3.050 2.423 2.126 3.040 . 0 0 "[ . 1 . 2]" 1
706 1 30 VAL HA 1 31 PRO QD . . 3.560 1.973 1.773 2.306 . 0 0 "[ . 1 . 2]" 1
707 1 30 VAL HA 1 31 PRO HD3 . . 3.050 2.138 1.794 2.768 . 0 0 "[ . 1 . 2]" 1
708 1 30 VAL HB 1 31 PRO HD2 . . 4.420 3.427 1.720 4.160 . 0 0 "[ . 1 . 2]" 1
709 1 30 VAL HB 1 31 PRO QD . . 4.630 3.215 1.715 3.793 . 0 0 "[ . 1 . 2]" 1
710 1 30 VAL HB 1 31 PRO HD3 . . 4.420 4.101 2.878 4.499 0.079 4 0 "[ . 1 . 2]" 1
711 1 30 VAL QG 1 31 PRO HA . . 6.320 4.034 3.808 4.444 . 0 0 "[ . 1 . 2]" 1
712 1 30 VAL QG 1 31 PRO HD2 . . 6.320 2.399 1.786 3.186 . 0 0 "[ . 1 . 2]" 1
713 1 30 VAL QG 1 31 PRO QD . . 6.520 2.327 1.773 2.889 . 0 0 "[ . 1 . 2]" 1
714 1 30 VAL QG 1 31 PRO HD3 . . 6.320 3.310 2.695 3.793 . 0 0 "[ . 1 . 2]" 1
715 1 30 VAL QG 1 33 HIS HD2 . . 8.210 5.640 3.495 7.774 . 0 0 "[ . 1 . 2]" 1
716 1 31 PRO HA 1 32 VAL H . . 2.780 2.347 2.137 2.951 0.171 4 0 "[ . 1 . 2]" 1
717 1 31 PRO HA 1 32 VAL HA . . 4.770 4.404 4.273 4.919 0.149 4 0 "[ . 1 . 2]" 1
718 1 31 PRO HA 1 32 VAL HB . . 4.880 4.777 4.402 5.003 0.123 15 0 "[ . 1 . 2]" 1
719 1 31 PRO HB2 1 32 VAL H . . 4.430 4.052 2.904 4.302 . 0 0 "[ . 1 . 2]" 1
720 1 31 PRO HB3 1 32 VAL H . . 4.430 4.258 3.330 4.588 0.158 11 0 "[ . 1 . 2]" 1
721 1 32 VAL H 1 32 VAL HB . . 3.470 3.054 2.462 3.595 0.125 9 0 "[ . 1 . 2]" 1
722 1 32 VAL H 1 33 HIS H . . 4.100 3.935 2.440 4.304 0.204 17 0 "[ . 1 . 2]" 1
723 1 32 VAL HA 1 33 HIS H . . 3.400 2.346 2.030 3.530 0.130 19 0 "[ . 1 . 2]" 1
724 1 32 VAL HA 1 33 HIS HB2 . . 5.500 5.027 4.174 5.694 0.194 12 0 "[ . 1 . 2]" 1
725 1 32 VAL HA 1 33 HIS HB3 . . 5.500 5.129 4.572 5.740 0.240 5 0 "[ . 1 . 2]" 1
726 1 32 VAL HA 1 33 HIS HD2 . . 5.720 4.261 3.119 5.834 0.114 6 0 "[ . 1 . 2]" 1
727 1 32 VAL HA 1 35 VAL QG . . 7.540 4.837 3.203 6.375 . 0 0 "[ . 1 . 2]" 1
728 1 32 VAL HB 1 33 HIS H . . 4.290 3.877 1.843 4.355 0.065 20 0 "[ . 1 . 2]" 1
729 1 32 VAL HB 1 33 HIS HD2 . . 5.420 5.251 4.121 5.564 0.144 13 0 "[ . 1 . 2]" 1
730 1 32 VAL QG 1 33 HIS H . . 6.530 2.729 1.958 3.677 . 0 0 "[ . 1 . 2]" 1
731 1 32 VAL QG 1 33 HIS HD2 . . 7.540 4.006 1.731 5.241 . 0 0 "[ . 1 . 2]" 1
732 1 32 VAL MG1 1 33 HIS H . . 6.170 3.456 2.457 4.209 . 0 0 "[ . 1 . 2]" 1
733 1 32 VAL MG2 1 33 HIS H . . 6.170 3.251 1.971 4.326 . 0 0 "[ . 1 . 2]" 1
734 1 33 HIS QB 1 91 LEU QD . . 7.180 3.553 1.899 4.869 . 0 0 "[ . 1 . 2]" 1
735 1 33 HIS HB2 1 34 GLN H . . 4.960 3.408 2.159 4.623 . 0 0 "[ . 1 . 2]" 1
736 1 33 HIS HB3 1 34 GLN H . . 4.960 3.633 2.338 4.616 . 0 0 "[ . 1 . 2]" 1
737 1 33 HIS HD2 1 91 LEU QD . . 7.400 4.635 2.274 6.577 . 0 0 "[ . 1 . 2]" 1
738 1 34 GLN HA 1 35 VAL H . . 3.130 2.552 2.077 3.476 0.346 9 0 "[ . 1 . 2]" 1
739 1 34 GLN HA 1 35 VAL MG1 . . 7.520 5.366 4.233 5.868 . 0 0 "[ . 1 . 2]" 1
740 1 34 GLN HA 1 35 VAL MG2 . . 7.520 3.771 3.090 4.667 . 0 0 "[ . 1 . 2]" 1
741 1 34 GLN HB2 1 35 VAL H . . 4.590 3.915 2.089 4.594 0.004 19 0 "[ . 1 . 2]" 1
742 1 34 GLN HB3 1 35 VAL H . . 4.590 3.902 1.716 4.455 . 0 0 "[ . 1 . 2]" 1
743 1 34 GLN QG 1 35 VAL H . . 5.520 4.093 2.736 4.831 . 0 0 "[ . 1 . 2]" 1
744 1 35 VAL H 1 35 VAL HB . . 3.690 3.059 2.540 3.769 0.079 16 0 "[ . 1 . 2]" 1
745 1 35 VAL H 1 36 SER H . . 4.880 4.189 3.217 4.539 . 0 0 "[ . 1 . 2]" 1
746 1 35 VAL H 1 36 SER QB . . 6.300 5.034 4.083 5.519 . 0 0 "[ . 1 . 2]" 1
747 1 35 VAL H 1 91 LEU MD1 . . 7.200 4.734 3.503 5.707 . 0 0 "[ . 1 . 2]" 1
748 1 35 VAL H 1 91 LEU QD . . 7.520 4.152 3.131 5.085 . 0 0 "[ . 1 . 2]" 1
749 1 35 VAL H 1 91 LEU MD2 . . 7.200 4.677 3.526 5.821 . 0 0 "[ . 1 . 2]" 1
750 1 35 VAL HA 1 36 SER H . . 3.340 2.270 2.042 3.450 0.110 10 0 "[ . 1 . 2]" 1
751 1 35 VAL HA 1 43 MET ME . . 5.720 4.215 3.155 5.546 . 0 0 "[ . 1 . 2]" 1
752 1 35 VAL HA 1 91 LEU QD . . 7.540 4.468 3.865 5.174 . 0 0 "[ . 1 . 2]" 1
753 1 35 VAL HB 1 36 SER H . . 4.720 3.802 1.823 4.474 . 0 0 "[ . 1 . 2]" 1
754 1 35 VAL HB 1 39 ASN QB . . 6.090 4.298 1.781 5.074 . 0 0 "[ . 1 . 2]" 1
755 1 35 VAL HB 1 40 LEU MD1 . . 6.400 4.736 2.610 6.146 . 0 0 "[ . 1 . 2]" 1
756 1 35 VAL HB 1 40 LEU MD2 . . 6.400 4.433 2.538 6.305 . 0 0 "[ . 1 . 2]" 1
757 1 35 VAL QG 1 36 SER H . . 6.160 2.784 1.907 3.518 . 0 0 "[ . 1 . 2]" 1
758 1 35 VAL QG 1 36 SER HA . . 6.900 3.677 3.227 4.230 . 0 0 "[ . 1 . 2]" 1
759 1 35 VAL QG 1 36 SER QB . . 8.920 4.197 2.778 4.782 . 0 0 "[ . 1 . 2]" 1
760 1 35 VAL QG 1 39 ASN H . . 6.950 4.412 3.644 4.977 . 0 0 "[ . 1 . 2]" 1
761 1 35 VAL QG 1 39 ASN QB . . 6.870 2.496 1.675 3.206 . 0 0 "[ . 1 . 2]" 1
762 1 35 VAL QG 1 40 LEU H . . 6.190 3.567 2.836 4.433 . 0 0 "[ . 1 . 2]" 1
763 1 35 VAL QG 1 40 LEU HA . . 6.480 3.760 2.923 4.627 . 0 0 "[ . 1 . 2]" 1
764 1 35 VAL QG 1 40 LEU QD . . 7.520 2.132 1.773 2.563 . 0 0 "[ . 1 . 2]" 1
765 1 35 VAL QG 1 43 MET ME . . 6.860 2.696 1.712 3.932 . 0 0 "[ . 1 . 2]" 1
766 1 35 VAL QG 1 69 TYR QE . . 9.310 4.181 2.180 7.448 . 0 0 "[ . 1 . 2]" 1
767 1 35 VAL QG 1 88 LYS HA . . 7.180 4.291 3.062 5.052 . 0 0 "[ . 1 . 2]" 1
768 1 35 VAL QG 1 90 TRP QB . . 7.440 3.363 2.094 4.624 . 0 0 "[ . 1 . 2]" 1
769 1 35 VAL QG 1 90 TRP HD1 . . 6.510 3.118 2.229 4.161 . 0 0 "[ . 1 . 2]" 1
770 1 35 VAL QG 1 90 TRP HE1 . . 7.460 4.518 3.524 5.757 . 0 0 "[ . 1 . 2]" 1
771 1 35 VAL QG 1 91 LEU H . . 7.460 4.301 3.167 5.189 . 0 0 "[ . 1 . 2]" 1
772 1 35 VAL QG 1 91 LEU HA . . 8.370 4.605 3.666 5.709 . 0 0 "[ . 1 . 2]" 1
773 1 35 VAL QG 1 91 LEU QB . . 8.640 4.356 3.909 4.971 . 0 0 "[ . 1 . 2]" 1
774 1 35 VAL QG 1 91 LEU HG . . 6.810 3.184 2.329 4.148 . 0 0 "[ . 1 . 2]" 1
775 1 35 VAL MG1 1 36 SER H . . 5.910 2.917 1.911 3.827 . 0 0 "[ . 1 . 2]" 1
776 1 35 VAL MG1 1 36 SER HA . . 6.480 3.989 3.252 5.568 . 0 0 "[ . 1 . 2]" 1
777 1 35 VAL MG1 1 39 ASN H . . 6.520 4.584 3.667 5.545 . 0 0 "[ . 1 . 2]" 1
778 1 35 VAL MG1 1 39 ASN HB2 . . 6.250 3.247 2.017 4.394 . 0 0 "[ . 1 . 2]" 1
779 1 35 VAL MG1 1 39 ASN HB3 . . 6.250 2.763 1.687 3.465 . 0 0 "[ . 1 . 2]" 1
780 1 35 VAL MG1 1 39 ASN HD21 . . 6.520 5.340 4.246 6.123 . 0 0 "[ . 1 . 2]" 1
781 1 35 VAL MG1 1 39 ASN HD22 . . 6.520 5.666 4.568 6.668 0.148 17 0 "[ . 1 . 2]" 1
782 1 35 VAL MG1 1 40 LEU H . . 5.830 3.710 2.848 5.143 . 0 0 "[ . 1 . 2]" 1
783 1 35 VAL MG1 1 40 LEU HA . . 6.140 3.912 2.954 5.053 . 0 0 "[ . 1 . 2]" 1
784 1 35 VAL MG1 1 40 LEU MD1 . . 6.440 3.042 2.154 4.280 . 0 0 "[ . 1 . 2]" 1
785 1 35 VAL MG1 1 40 LEU MD2 . . 6.440 2.705 1.787 5.881 . 0 0 "[ . 1 . 2]" 1
786 1 35 VAL MG1 1 43 MET ME . . 6.400 3.034 2.116 4.614 . 0 0 "[ . 1 . 2]" 1
787 1 35 VAL MG1 1 90 TRP HB2 . . 6.910 5.050 3.214 6.731 . 0 0 "[ . 1 . 2]" 1
788 1 35 VAL MG1 1 90 TRP HB3 . . 6.910 4.150 2.489 5.478 . 0 0 "[ . 1 . 2]" 1
789 1 35 VAL MG1 1 90 TRP HD1 . . 6.520 3.658 2.630 4.536 . 0 0 "[ . 1 . 2]" 1
790 1 35 VAL MG1 1 90 TRP HE1 . . 7.210 4.948 3.957 6.256 . 0 0 "[ . 1 . 2]" 1
791 1 35 VAL MG2 1 36 SER H . . 5.910 3.956 2.918 4.302 . 0 0 "[ . 1 . 2]" 1
792 1 35 VAL MG2 1 36 SER HA . . 6.480 5.280 3.458 5.643 . 0 0 "[ . 1 . 2]" 1
793 1 35 VAL MG2 1 39 ASN H . . 6.520 6.090 5.047 6.533 0.013 4 0 "[ . 1 . 2]" 1
794 1 35 VAL MG2 1 39 ASN HB2 . . 6.250 4.476 3.493 5.337 . 0 0 "[ . 1 . 2]" 1
795 1 35 VAL MG2 1 39 ASN HB3 . . 6.250 3.921 3.350 4.311 . 0 0 "[ . 1 . 2]" 1
796 1 35 VAL MG2 1 39 ASN HD21 . . 6.520 6.207 4.866 6.689 0.169 10 0 "[ . 1 . 2]" 1
797 1 35 VAL MG2 1 39 ASN HD22 . . 6.520 6.163 5.231 6.579 0.059 16 0 "[ . 1 . 2]" 1
798 1 35 VAL MG2 1 40 LEU H . . 5.830 5.444 4.033 5.873 0.043 18 0 "[ . 1 . 2]" 1
799 1 35 VAL MG2 1 40 LEU HA . . 6.140 5.316 4.044 6.025 . 0 0 "[ . 1 . 2]" 1
800 1 35 VAL MG2 1 40 LEU MD1 . . 6.440 4.332 2.052 5.500 . 0 0 "[ . 1 . 2]" 1
801 1 35 VAL MG2 1 40 LEU MD2 . . 6.440 3.924 2.598 5.789 . 0 0 "[ . 1 . 2]" 1
802 1 35 VAL MG2 1 43 MET ME . . 6.400 3.178 1.794 4.582 . 0 0 "[ . 1 . 2]" 1
803 1 35 VAL MG2 1 90 TRP HB2 . . 6.910 5.174 3.847 6.795 . 0 0 "[ . 1 . 2]" 1
804 1 35 VAL MG2 1 90 TRP HB3 . . 6.910 3.855 2.318 5.491 . 0 0 "[ . 1 . 2]" 1
805 1 35 VAL MG2 1 90 TRP HD1 . . 6.520 3.521 2.258 5.067 . 0 0 "[ . 1 . 2]" 1
806 1 35 VAL MG2 1 90 TRP HE1 . . 7.210 5.299 3.955 6.729 . 0 0 "[ . 1 . 2]" 1
807 1 36 SER H 1 39 ASN H . . 5.330 3.355 2.741 4.515 . 0 0 "[ . 1 . 2]" 1
808 1 36 SER H 1 39 ASN HB2 . . 5.000 2.193 1.714 4.229 . 0 0 "[ . 1 . 2]" 1
809 1 36 SER H 1 39 ASN QB . . 5.270 2.088 1.708 3.344 . 0 0 "[ . 1 . 2]" 1
810 1 36 SER H 1 39 ASN HB3 . . 5.000 3.084 2.241 3.976 . 0 0 "[ . 1 . 2]" 1
811 1 36 SER H 1 40 LEU H . . 4.850 4.049 3.016 4.923 0.073 12 0 "[ . 1 . 2]" 1
812 1 36 SER H 1 40 LEU MD1 . . 7.520 5.143 3.394 6.440 . 0 0 "[ . 1 . 2]" 1
813 1 36 SER H 1 40 LEU MD2 . . 7.520 4.733 2.890 6.821 . 0 0 "[ . 1 . 2]" 1
814 1 36 SER HA 1 37 TYR HA . . 5.520 4.354 4.262 4.859 . 0 0 "[ . 1 . 2]" 1
815 1 36 SER HA 1 38 THR H . . 5.470 4.573 4.129 5.085 . 0 0 "[ . 1 . 2]" 1
816 1 36 SER QB 1 37 TYR H . . 5.060 3.122 1.957 4.040 . 0 0 "[ . 1 . 2]" 1
817 1 36 SER QB 1 38 THR H . . 5.450 3.248 2.662 4.203 . 0 0 "[ . 1 . 2]" 1
818 1 36 SER QB 1 39 ASN H . . 5.880 2.975 2.055 4.137 . 0 0 "[ . 1 . 2]" 1
819 1 36 SER QB 1 39 ASN QD . . 6.900 4.042 3.402 4.832 . 0 0 "[ . 1 . 2]" 1
820 1 36 SER HB2 1 37 TYR H . . 4.830 3.792 2.360 4.632 . 0 0 "[ . 1 . 2]" 1
821 1 36 SER HB2 1 38 THR H . . 5.430 4.461 3.191 5.477 0.047 12 0 "[ . 1 . 2]" 1
822 1 36 SER HB2 1 39 ASN H . . 5.670 4.251 2.591 5.413 . 0 0 "[ . 1 . 2]" 1
823 1 36 SER HB3 1 37 TYR H . . 4.830 3.410 1.981 4.569 . 0 0 "[ . 1 . 2]" 1
824 1 36 SER HB3 1 38 THR H . . 5.430 3.466 2.693 4.985 . 0 0 "[ . 1 . 2]" 1
825 1 36 SER HB3 1 39 ASN H . . 5.670 3.197 2.064 5.119 . 0 0 "[ . 1 . 2]" 1
826 1 37 TYR H 1 38 THR H . . 4.490 2.931 2.525 4.132 . 0 0 "[ . 1 . 2]" 1
827 1 37 TYR HA 1 39 ASN H . . 5.420 4.379 4.065 4.692 . 0 0 "[ . 1 . 2]" 1
828 1 37 TYR HA 1 40 LEU H . . 5.500 3.735 3.491 4.255 . 0 0 "[ . 1 . 2]" 1
829 1 37 TYR HA 1 40 LEU QB . . 5.010 3.243 2.852 4.454 . 0 0 "[ . 1 . 2]" 1
830 1 37 TYR HA 1 40 LEU MD1 . . 6.340 3.811 2.099 5.508 . 0 0 "[ . 1 . 2]" 1
831 1 37 TYR HA 1 40 LEU QD . . 6.640 2.771 1.913 4.227 . 0 0 "[ . 1 . 2]" 1
832 1 37 TYR HA 1 40 LEU MD2 . . 6.340 3.893 1.914 5.687 . 0 0 "[ . 1 . 2]" 1
833 1 37 TYR HA 1 40 LEU HG . . 5.330 4.374 3.588 5.378 0.048 17 0 "[ . 1 . 2]" 1
834 1 37 TYR HA 1 41 ALA H . . 5.500 4.724 4.054 5.568 0.068 13 0 "[ . 1 . 2]" 1
835 1 37 TYR HA 1 69 TYR QD . . 7.810 4.001 3.014 5.535 . 0 0 "[ . 1 . 2]" 1
836 1 37 TYR HA 1 69 TYR QE . . 7.280 3.192 2.146 4.805 . 0 0 "[ . 1 . 2]" 1
837 1 37 TYR QB 1 38 THR H . . 4.780 2.459 1.920 2.731 . 0 0 "[ . 1 . 2]" 1
838 1 37 TYR QB 1 69 TYR QE . . 8.550 3.600 2.904 4.389 . 0 0 "[ . 1 . 2]" 1
839 1 37 TYR HB2 1 38 THR H . . 4.620 3.782 3.409 3.945 . 0 0 "[ . 1 . 2]" 1
840 1 37 TYR HB3 1 38 THR H . . 4.620 2.495 1.929 2.822 . 0 0 "[ . 1 . 2]" 1
841 1 37 TYR QD 1 38 THR H . . 6.950 3.462 2.515 4.378 . 0 0 "[ . 1 . 2]" 1
842 1 37 TYR QD 1 38 THR HA . . 6.700 3.526 2.829 4.280 . 0 0 "[ . 1 . 2]" 1
843 1 37 TYR QD 1 38 THR HB . . 7.740 5.353 4.274 6.233 . 0 0 "[ . 1 . 2]" 1
844 1 37 TYR QD 1 38 THR MG . . 7.850 4.284 2.713 5.592 . 0 0 "[ . 1 . 2]" 1
845 1 37 TYR QD 1 41 ALA MB . . 8.380 4.617 3.773 5.378 . 0 0 "[ . 1 . 2]" 1
846 1 37 TYR QD 1 62 LEU MD1 . . 8.390 4.589 3.918 5.731 . 0 0 "[ . 1 . 2]" 1
847 1 37 TYR QD 1 62 LEU QD . . 8.710 3.432 2.688 4.367 . 0 0 "[ . 1 . 2]" 1
848 1 37 TYR QD 1 62 LEU MD2 . . 8.390 3.556 2.709 4.528 . 0 0 "[ . 1 . 2]" 1
849 1 37 TYR QD 1 62 LEU HG . . 7.890 5.382 3.950 6.713 . 0 0 "[ . 1 . 2]" 1
850 1 37 TYR QD 1 69 TYR HB2 . . 7.410 4.306 3.312 6.319 . 0 0 "[ . 1 . 2]" 1
851 1 37 TYR QD 1 69 TYR HB3 . . 7.410 4.305 3.376 6.019 . 0 0 "[ . 1 . 2]" 1
852 1 37 TYR QD 1 69 TYR QD . . 9.140 3.354 2.720 4.285 . 0 0 "[ . 1 . 2]" 1
853 1 37 TYR QE 1 38 THR H . . 8.060 5.565 4.487 6.461 . 0 0 "[ . 1 . 2]" 1
854 1 37 TYR QE 1 38 THR HA . . 7.520 4.860 4.146 6.196 . 0 0 "[ . 1 . 2]" 1
855 1 37 TYR QE 1 38 THR MG . . 8.170 5.361 4.015 7.177 . 0 0 "[ . 1 . 2]" 1
856 1 37 TYR QE 1 41 ALA MB . . 7.530 4.526 3.490 5.323 . 0 0 "[ . 1 . 2]" 1
857 1 37 TYR QE 1 62 LEU QB . . 8.250 5.238 4.257 6.305 . 0 0 "[ . 1 . 2]" 1
858 1 37 TYR QE 1 62 LEU MD1 . . 7.530 4.455 3.616 5.611 . 0 0 "[ . 1 . 2]" 1
859 1 37 TYR QE 1 62 LEU QD . . 7.940 2.972 2.123 4.027 . 0 0 "[ . 1 . 2]" 1
860 1 37 TYR QE 1 62 LEU MD2 . . 7.530 3.029 2.135 4.127 . 0 0 "[ . 1 . 2]" 1
861 1 37 TYR QE 1 62 LEU HG . . 6.600 4.269 3.265 5.674 . 0 0 "[ . 1 . 2]" 1
862 1 37 TYR QE 1 64 ASP HB2 . . 7.410 5.227 3.546 6.994 . 0 0 "[ . 1 . 2]" 1
863 1 37 TYR QE 1 64 ASP QB . . 7.660 3.998 2.265 5.574 . 0 0 "[ . 1 . 2]" 1
864 1 37 TYR QE 1 64 ASP HB3 . . 7.410 4.204 2.283 5.990 . 0 0 "[ . 1 . 2]" 1
865 1 37 TYR QE 1 69 TYR HB2 . . 7.410 4.275 2.961 6.716 . 0 0 "[ . 1 . 2]" 1
866 1 37 TYR QE 1 69 TYR QB . . 7.560 3.652 2.248 5.293 . 0 0 "[ . 1 . 2]" 1
867 1 37 TYR QE 1 69 TYR HB3 . . 7.410 4.016 2.329 5.540 . 0 0 "[ . 1 . 2]" 1
868 1 38 THR H 1 38 THR HB . . 3.760 2.887 2.569 3.611 . 0 0 "[ . 1 . 2]" 1
869 1 38 THR H 1 39 ASN H . . 4.130 2.653 2.508 2.781 . 0 0 "[ . 1 . 2]" 1
870 1 38 THR H 1 40 LEU QB . . 6.790 5.181 4.819 5.789 . 0 0 "[ . 1 . 2]" 1
871 1 38 THR H 1 41 ALA MB . . 6.410 5.195 4.539 5.622 . 0 0 "[ . 1 . 2]" 1
872 1 38 THR HA 1 41 ALA H . . 4.520 3.673 3.429 3.913 . 0 0 "[ . 1 . 2]" 1
873 1 38 THR HA 1 41 ALA MB . . 4.800 3.065 2.551 3.459 . 0 0 "[ . 1 . 2]" 1
874 1 38 THR HB 1 39 ASN H . . 3.980 2.811 2.236 3.747 . 0 0 "[ . 1 . 2]" 1
875 1 38 THR HB 1 39 ASN HA . . 5.200 3.996 3.664 4.307 . 0 0 "[ . 1 . 2]" 1
876 1 38 THR HB 1 39 ASN HD21 . . 5.500 4.007 3.040 5.552 0.052 11 0 "[ . 1 . 2]" 1
877 1 38 THR HB 1 39 ASN HD22 . . 5.500 5.129 4.110 5.744 0.244 10 0 "[ . 1 . 2]" 1
878 1 38 THR MG 1 39 ASN H . . 5.640 3.831 3.457 4.177 . 0 0 "[ . 1 . 2]" 1
879 1 38 THR MG 1 39 ASN HD21 . . 7.160 4.488 3.526 6.553 . 0 0 "[ . 1 . 2]" 1
880 1 38 THR MG 1 39 ASN QD . . 7.240 4.258 3.434 5.629 . 0 0 "[ . 1 . 2]" 1
881 1 38 THR MG 1 39 ASN HD22 . . 7.160 5.458 4.458 6.295 . 0 0 "[ . 1 . 2]" 1
882 1 38 THR MG 1 40 LEU H . . 6.610 5.266 4.998 5.638 . 0 0 "[ . 1 . 2]" 1
883 1 38 THR MG 1 42 GLU HG2 . . 5.760 3.320 2.172 5.808 0.048 8 0 "[ . 1 . 2]" 1
884 1 38 THR MG 1 42 GLU QG . . 5.850 2.929 2.043 4.681 . 0 0 "[ . 1 . 2]" 1
885 1 38 THR MG 1 42 GLU HG3 . . 5.760 3.455 2.093 5.770 0.010 3 0 "[ . 1 . 2]" 1
886 1 39 ASN H 1 39 ASN HB2 . . 4.100 2.214 2.058 2.513 . 0 0 "[ . 1 . 2]" 1
887 1 39 ASN H 1 39 ASN HB3 . . 4.100 3.354 2.946 3.619 . 0 0 "[ . 1 . 2]" 1
888 1 39 ASN H 1 40 LEU H . . 3.850 2.687 2.539 2.909 . 0 0 "[ . 1 . 2]" 1
889 1 39 ASN H 1 40 LEU QB . . 6.150 4.547 4.266 4.897 . 0 0 "[ . 1 . 2]" 1
890 1 39 ASN H 1 41 ALA MB . . 6.520 5.044 4.727 5.229 . 0 0 "[ . 1 . 2]" 1
891 1 39 ASN H 1 43 MET ME . . 6.580 5.434 4.685 6.729 0.149 12 0 "[ . 1 . 2]" 1
892 1 39 ASN HA 1 39 ASN HD21 . . 4.710 2.069 1.727 2.928 . 0 0 "[ . 1 . 2]" 1
893 1 39 ASN HA 1 39 ASN HD22 . . 4.710 3.358 3.134 3.739 . 0 0 "[ . 1 . 2]" 1
894 1 39 ASN HA 1 41 ALA MB . . 7.190 4.982 4.786 5.262 . 0 0 "[ . 1 . 2]" 1
895 1 39 ASN HA 1 42 GLU H . . 4.580 3.395 3.083 3.880 . 0 0 "[ . 1 . 2]" 1
896 1 39 ASN HA 1 42 GLU HB2 . . 4.150 2.546 2.213 2.901 . 0 0 "[ . 1 . 2]" 1
897 1 39 ASN HA 1 42 GLU HB3 . . 4.150 4.039 3.484 4.248 0.098 15 0 "[ . 1 . 2]" 1
898 1 39 ASN HA 1 42 GLU HG2 . . 4.730 3.649 2.646 4.752 0.022 19 0 "[ . 1 . 2]" 1
899 1 39 ASN HA 1 42 GLU QG . . 4.880 2.953 2.140 4.062 . 0 0 "[ . 1 . 2]" 1
900 1 39 ASN HA 1 42 GLU HG3 . . 4.730 3.216 2.260 4.411 . 0 0 "[ . 1 . 2]" 1
901 1 39 ASN HA 1 43 MET ME . . 5.950 4.110 3.339 5.803 . 0 0 "[ . 1 . 2]" 1
902 1 39 ASN QB 1 42 GLU QB . . 6.540 4.179 3.751 4.720 . 0 0 "[ . 1 . 2]" 1
903 1 39 ASN QB 1 43 MET ME . . 5.760 2.756 1.784 4.156 . 0 0 "[ . 1 . 2]" 1
904 1 39 ASN HB2 1 40 LEU H . . 4.640 3.074 2.706 3.644 . 0 0 "[ . 1 . 2]" 1
905 1 39 ASN HB3 1 40 LEU H . . 4.640 3.170 2.656 3.797 . 0 0 "[ . 1 . 2]" 1
906 1 39 ASN QD 1 42 GLU QB . . 6.390 3.678 2.631 4.244 . 0 0 "[ . 1 . 2]" 1
907 1 39 ASN QD 1 43 MET ME . . 6.740 4.179 2.399 5.892 . 0 0 "[ . 1 . 2]" 1
908 1 39 ASN HD21 1 42 GLU HB2 . . 5.940 4.030 2.805 5.096 . 0 0 "[ . 1 . 2]" 1
909 1 39 ASN HD21 1 42 GLU HB3 . . 5.940 5.070 3.850 5.999 0.059 6 0 "[ . 1 . 2]" 1
910 1 39 ASN HD22 1 42 GLU HB2 . . 5.940 5.025 3.558 5.546 . 0 0 "[ . 1 . 2]" 1
911 1 39 ASN HD22 1 42 GLU HB3 . . 5.940 5.816 4.279 6.044 0.104 12 0 "[ . 1 . 2]" 1
912 1 40 LEU H 1 40 LEU HG . . 4.650 3.397 2.319 4.506 . 0 0 "[ . 1 . 2]" 1
913 1 40 LEU H 1 43 MET ME . . 5.940 4.505 3.549 5.782 . 0 0 "[ . 1 . 2]" 1
914 1 40 LEU HA 1 42 GLU H . . 5.880 4.377 3.926 4.552 . 0 0 "[ . 1 . 2]" 1
915 1 40 LEU HA 1 43 MET H . . 4.990 3.612 3.364 3.945 . 0 0 "[ . 1 . 2]" 1
916 1 40 LEU HA 1 43 MET QB . . 5.300 3.061 2.666 3.712 . 0 0 "[ . 1 . 2]" 1
917 1 40 LEU HA 1 43 MET ME . . 4.750 3.365 2.147 4.750 0.000 2 0 "[ . 1 . 2]" 1
918 1 40 LEU HA 1 43 MET QG . . 6.100 4.555 3.736 5.561 . 0 0 "[ . 1 . 2]" 1
919 1 40 LEU HA 1 44 VAL H . . 5.460 3.920 3.541 4.299 . 0 0 "[ . 1 . 2]" 1
920 1 40 LEU HA 1 90 TRP HE1 . . 5.950 3.957 3.125 4.753 . 0 0 "[ . 1 . 2]" 1
921 1 40 LEU QB 1 41 ALA H . . 4.700 2.451 2.300 2.595 . 0 0 "[ . 1 . 2]" 1
922 1 40 LEU QB 1 42 GLU H . . 6.380 4.545 4.473 4.704 . 0 0 "[ . 1 . 2]" 1
923 1 40 LEU QB 1 62 LEU QD . . 7.000 2.281 1.721 3.012 . 0 0 "[ . 1 . 2]" 1
924 1 40 LEU QB 1 71 VAL QG . . 8.180 3.376 2.649 4.221 . 0 0 "[ . 1 . 2]" 1
925 1 40 LEU QD 1 41 ALA H . . 7.540 3.880 3.593 4.126 . 0 0 "[ . 1 . 2]" 1
926 1 40 LEU QD 1 43 MET H . . 8.060 4.779 4.147 5.236 . 0 0 "[ . 1 . 2]" 1
927 1 40 LEU QD 1 43 MET QB . . 8.410 3.803 3.081 4.677 . 0 0 "[ . 1 . 2]" 1
928 1 40 LEU QD 1 43 MET ME . . 6.930 3.411 2.123 4.649 . 0 0 "[ . 1 . 2]" 1
929 1 40 LEU QD 1 44 VAL H . . 8.170 4.671 3.394 5.447 . 0 0 "[ . 1 . 2]" 1
930 1 40 LEU QD 1 44 VAL QG . . 8.540 3.235 2.088 3.858 . 0 0 "[ . 1 . 2]" 1
931 1 40 LEU QD 1 62 LEU QD . . 9.170 2.299 1.816 2.938 . 0 0 "[ . 1 . 2]" 1
932 1 40 LEU QD 1 69 TYR H . . 8.070 4.869 3.897 5.797 . 0 0 "[ . 1 . 2]" 1
933 1 40 LEU QD 1 69 TYR QB . . 7.680 3.617 2.522 4.745 . 0 0 "[ . 1 . 2]" 1
934 1 40 LEU QD 1 69 TYR QD . . 8.420 2.567 1.741 4.805 . 0 0 "[ . 1 . 2]" 1
935 1 40 LEU QD 1 69 TYR QE . . 8.070 2.700 1.714 6.107 . 0 0 "[ . 1 . 2]" 1
936 1 40 LEU QD 1 71 VAL H . . 7.300 4.199 3.751 4.997 . 0 0 "[ . 1 . 2]" 1
937 1 40 LEU QD 1 71 VAL QG . . 8.190 2.287 1.768 2.933 . 0 0 "[ . 1 . 2]" 1
938 1 40 LEU QD 1 87 PRO QB . . 7.300 2.363 1.712 3.452 . 0 0 "[ . 1 . 2]" 1
939 1 40 LEU QD 1 87 PRO QG . . 7.520 3.527 2.409 4.443 . 0 0 "[ . 1 . 2]" 1
940 1 40 LEU QD 1 90 TRP QB . . 7.640 3.098 2.794 3.771 . 0 0 "[ . 1 . 2]" 1
941 1 40 LEU QD 1 90 TRP HD1 . . 7.090 3.304 2.422 4.447 . 0 0 "[ . 1 . 2]" 1
942 1 40 LEU QD 1 90 TRP HE1 . . 6.900 3.705 3.092 5.046 . 0 0 "[ . 1 . 2]" 1
943 1 40 LEU QD 1 90 TRP HE3 . . 8.500 4.543 3.893 5.188 . 0 0 "[ . 1 . 2]" 1
944 1 40 LEU QD 1 90 TRP HZ2 . . 8.080 4.751 3.983 5.900 . 0 0 "[ . 1 . 2]" 1
945 1 40 LEU MD1 1 43 MET ME . . 6.390 4.398 2.698 6.322 . 0 0 "[ . 1 . 2]" 1
946 1 40 LEU MD1 1 69 TYR HB2 . . 7.520 4.470 2.558 6.193 . 0 0 "[ . 1 . 2]" 1
947 1 40 LEU MD1 1 69 TYR HB3 . . 7.520 5.629 4.008 7.232 . 0 0 "[ . 1 . 2]" 1
948 1 40 LEU MD1 1 69 TYR QD . . 8.710 3.355 1.743 5.664 . 0 0 "[ . 1 . 2]" 1
949 1 40 LEU MD1 1 69 TYR QE . . 8.230 3.585 1.789 7.162 . 0 0 "[ . 1 . 2]" 1
950 1 40 LEU MD1 1 71 VAL H . . 7.430 4.951 3.792 6.526 . 0 0 "[ . 1 . 2]" 1
951 1 40 LEU MD1 1 87 PRO HA . . 6.340 3.500 2.722 4.405 . 0 0 "[ . 1 . 2]" 1
952 1 40 LEU MD1 1 87 PRO HB2 . . 6.760 4.021 3.133 5.242 . 0 0 "[ . 1 . 2]" 1
953 1 40 LEU MD1 1 87 PRO HB3 . . 6.760 2.864 1.788 4.187 . 0 0 "[ . 1 . 2]" 1
954 1 40 LEU MD1 1 87 PRO HG2 . . 7.370 5.090 3.147 6.646 . 0 0 "[ . 1 . 2]" 1
955 1 40 LEU MD1 1 87 PRO HG3 . . 7.370 4.235 2.645 6.112 . 0 0 "[ . 1 . 2]" 1
956 1 40 LEU MD1 1 90 TRP HB2 . . 7.520 4.392 3.215 5.473 . 0 0 "[ . 1 . 2]" 1
957 1 40 LEU MD1 1 90 TRP HB3 . . 7.520 4.503 3.050 5.748 . 0 0 "[ . 1 . 2]" 1
958 1 40 LEU MD1 1 90 TRP HE1 . . 6.520 4.904 3.111 6.383 . 0 0 "[ . 1 . 2]" 1
959 1 40 LEU MD2 1 43 MET ME . . 6.390 3.989 2.127 5.054 . 0 0 "[ . 1 . 2]" 1
960 1 40 LEU MD2 1 69 TYR HB2 . . 7.520 4.746 2.868 5.684 . 0 0 "[ . 1 . 2]" 1
961 1 40 LEU MD2 1 69 TYR HB3 . . 7.520 5.947 4.044 6.842 . 0 0 "[ . 1 . 2]" 1
962 1 40 LEU MD2 1 69 TYR QD . . 8.710 3.480 1.775 5.357 . 0 0 "[ . 1 . 2]" 1
963 1 40 LEU MD2 1 69 TYR QE . . 8.230 3.607 1.855 6.706 . 0 0 "[ . 1 . 2]" 1
964 1 40 LEU MD2 1 71 VAL H . . 7.430 5.181 3.932 7.140 . 0 0 "[ . 1 . 2]" 1
965 1 40 LEU MD2 1 87 PRO HA . . 6.340 3.388 2.561 4.695 . 0 0 "[ . 1 . 2]" 1
966 1 40 LEU MD2 1 87 PRO HB2 . . 6.760 3.949 2.683 5.372 . 0 0 "[ . 1 . 2]" 1
967 1 40 LEU MD2 1 87 PRO HB3 . . 6.760 2.838 1.786 3.997 . 0 0 "[ . 1 . 2]" 1
968 1 40 LEU MD2 1 87 PRO HG2 . . 7.370 5.139 3.780 6.109 . 0 0 "[ . 1 . 2]" 1
969 1 40 LEU MD2 1 87 PRO HG3 . . 7.370 4.339 2.745 5.533 . 0 0 "[ . 1 . 2]" 1
970 1 40 LEU MD2 1 90 TRP HB2 . . 7.520 4.232 3.098 6.009 . 0 0 "[ . 1 . 2]" 1
971 1 40 LEU MD2 1 90 TRP HB3 . . 7.520 4.250 3.048 5.498 . 0 0 "[ . 1 . 2]" 1
972 1 40 LEU MD2 1 90 TRP HE1 . . 6.520 4.615 3.107 6.103 . 0 0 "[ . 1 . 2]" 1
973 1 41 ALA H 1 42 GLU H . . 3.850 2.680 2.537 2.771 . 0 0 "[ . 1 . 2]" 1
974 1 41 ALA H 1 42 GLU HA . . 5.560 5.287 5.173 5.373 . 0 0 "[ . 1 . 2]" 1
975 1 41 ALA H 1 44 VAL H . . 4.770 4.736 4.580 4.822 0.052 14 0 "[ . 1 . 2]" 1
976 1 41 ALA H 1 62 LEU MD1 . . 6.000 4.868 4.289 5.428 . 0 0 "[ . 1 . 2]" 1
977 1 41 ALA H 1 62 LEU QD . . 6.170 3.465 2.602 3.975 . 0 0 "[ . 1 . 2]" 1
978 1 41 ALA H 1 62 LEU MD2 . . 6.000 3.564 2.624 4.135 . 0 0 "[ . 1 . 2]" 1
979 1 41 ALA HA 1 43 MET H . . 5.500 4.619 4.205 4.863 . 0 0 "[ . 1 . 2]" 1
980 1 41 ALA HA 1 44 VAL H . . 4.800 3.612 3.341 3.967 . 0 0 "[ . 1 . 2]" 1
981 1 41 ALA HA 1 44 VAL HB . . 4.260 2.774 2.197 4.456 0.196 10 0 "[ . 1 . 2]" 1
982 1 41 ALA HA 1 44 VAL MG1 . . 6.030 3.947 3.440 4.485 . 0 0 "[ . 1 . 2]" 1
983 1 41 ALA HA 1 44 VAL QG . . 5.880 3.063 1.697 3.634 . 0 0 "[ . 1 . 2]" 1
984 1 41 ALA HA 1 44 VAL MG2 . . 6.030 3.218 1.701 3.886 . 0 0 "[ . 1 . 2]" 1
985 1 41 ALA HA 1 45 GLY H . . 5.450 4.040 3.437 4.600 . 0 0 "[ . 1 . 2]" 1
986 1 41 ALA HA 1 62 LEU MD1 . . 5.250 4.917 4.324 5.294 0.044 1 0 "[ . 1 . 2]" 1
987 1 41 ALA HA 1 62 LEU QD . . 5.720 3.462 2.349 4.159 . 0 0 "[ . 1 . 2]" 1
988 1 41 ALA HA 1 62 LEU MD2 . . 5.250 3.551 2.359 4.350 . 0 0 "[ . 1 . 2]" 1
989 1 41 ALA MB 1 42 GLU H . . 4.770 2.601 2.439 2.881 . 0 0 "[ . 1 . 2]" 1
990 1 41 ALA MB 1 42 GLU HA . . 5.810 3.867 3.821 3.978 . 0 0 "[ . 1 . 2]" 1
991 1 41 ALA MB 1 42 GLU QB . . 7.070 4.326 3.993 4.566 . 0 0 "[ . 1 . 2]" 1
992 1 41 ALA MB 1 42 GLU HG2 . . 5.740 3.687 3.290 4.373 . 0 0 "[ . 1 . 2]" 1
993 1 41 ALA MB 1 42 GLU QG . . 5.920 3.400 3.195 4.067 . 0 0 "[ . 1 . 2]" 1
994 1 41 ALA MB 1 42 GLU HG3 . . 5.740 4.612 3.320 5.267 . 0 0 "[ . 1 . 2]" 1
995 1 41 ALA MB 1 43 MET H . . 6.490 4.705 4.442 4.970 . 0 0 "[ . 1 . 2]" 1
996 1 41 ALA MB 1 44 VAL H . . 6.550 4.735 4.513 4.978 . 0 0 "[ . 1 . 2]" 1
997 1 41 ALA MB 1 62 LEU MD1 . . 6.320 4.872 4.543 5.277 . 0 0 "[ . 1 . 2]" 1
998 1 41 ALA MB 1 62 LEU QD . . 6.630 3.070 2.443 3.716 . 0 0 "[ . 1 . 2]" 1
999 1 41 ALA MB 1 62 LEU MD2 . . 6.320 3.109 2.453 3.803 . 0 0 "[ . 1 . 2]" 1
1000 1 42 GLU H 1 42 GLU HB2 . . 3.810 2.392 2.043 2.544 . 0 0 "[ . 1 . 2]" 1
1001 1 42 GLU H 1 42 GLU HB3 . . 3.810 3.559 3.345 3.607 . 0 0 "[ . 1 . 2]" 1
1002 1 42 GLU H 1 42 GLU HG2 . . 4.030 2.679 2.153 3.416 . 0 0 "[ . 1 . 2]" 1
1003 1 42 GLU H 1 42 GLU HG3 . . 4.030 3.348 2.110 3.968 . 0 0 "[ . 1 . 2]" 1
1004 1 42 GLU H 1 43 MET H . . 4.000 2.740 2.569 2.920 . 0 0 "[ . 1 . 2]" 1
1005 1 42 GLU H 1 44 VAL H . . 5.170 4.094 3.897 4.335 . 0 0 "[ . 1 . 2]" 1
1006 1 42 GLU HA 1 42 GLU HG2 . . 3.790 2.825 2.362 3.157 . 0 0 "[ . 1 . 2]" 1
1007 1 42 GLU HA 1 42 GLU HG3 . . 3.790 3.550 3.062 3.764 . 0 0 "[ . 1 . 2]" 1
1008 1 42 GLU HA 1 44 VAL H . . 5.250 4.593 4.303 4.868 . 0 0 "[ . 1 . 2]" 1
1009 1 42 GLU HA 1 45 GLY H . . 4.660 3.768 3.317 4.249 . 0 0 "[ . 1 . 2]" 1
1010 1 42 GLU HA 1 46 GLU H . . 5.020 4.570 4.095 5.047 0.027 5 0 "[ . 1 . 2]" 1
1011 1 42 GLU QB 1 43 MET H . . 4.860 2.432 2.272 2.645 . 0 0 "[ . 1 . 2]" 1
1012 1 42 GLU HB2 1 43 MET H . . 4.680 2.507 2.311 2.867 . 0 0 "[ . 1 . 2]" 1
1013 1 42 GLU HB3 1 43 MET H . . 4.680 3.383 2.802 3.781 . 0 0 "[ . 1 . 2]" 1
1014 1 42 GLU QG 1 43 MET H . . 5.160 4.068 3.927 4.363 . 0 0 "[ . 1 . 2]" 1
1015 1 42 GLU HG2 1 43 MET H . . 4.920 4.540 4.211 4.942 0.022 10 0 "[ . 1 . 2]" 1
1016 1 42 GLU HG3 1 43 MET H . . 4.920 4.693 4.181 4.959 0.039 16 0 "[ . 1 . 2]" 1
1017 1 43 MET H 1 43 MET ME . . 5.680 3.713 2.813 4.729 . 0 0 "[ . 1 . 2]" 1
1018 1 43 MET H 1 43 MET QG . . 4.860 2.879 2.219 4.043 . 0 0 "[ . 1 . 2]" 1
1019 1 43 MET H 1 44 VAL H . . 4.210 2.615 2.477 2.742 . 0 0 "[ . 1 . 2]" 1
1020 1 43 MET H 1 44 VAL MG1 . . 7.430 5.791 4.443 5.960 . 0 0 "[ . 1 . 2]" 1
1021 1 43 MET H 1 44 VAL QG . . 7.240 4.088 3.494 4.229 . 0 0 "[ . 1 . 2]" 1
1022 1 43 MET H 1 44 VAL MG2 . . 7.430 4.181 3.654 4.339 . 0 0 "[ . 1 . 2]" 1
1023 1 43 MET H 1 90 TRP HE1 . . 6.160 4.693 3.699 5.310 . 0 0 "[ . 1 . 2]" 1
1024 1 43 MET HA 1 46 GLU H . . 4.490 3.385 3.099 3.826 . 0 0 "[ . 1 . 2]" 1
1025 1 43 MET HA 1 46 GLU HG2 . . 4.650 2.080 1.749 3.154 . 0 0 "[ . 1 . 2]" 1
1026 1 43 MET HA 1 46 GLU HG3 . . 4.650 3.277 2.675 4.718 0.068 5 0 "[ . 1 . 2]" 1
1027 1 43 MET HA 1 47 MET H . . 5.500 4.055 3.547 4.279 . 0 0 "[ . 1 . 2]" 1
1028 1 43 MET HA 1 90 TRP HE1 . . 5.860 4.765 4.283 5.077 . 0 0 "[ . 1 . 2]" 1
1029 1 43 MET HA 1 94 TYR QD . . 8.280 5.065 4.639 5.570 . 0 0 "[ . 1 . 2]" 1
1030 1 43 MET HA 1 94 TYR QE . . 6.830 4.092 3.659 4.811 . 0 0 "[ . 1 . 2]" 1
1031 1 43 MET QB 1 44 VAL H . . 5.380 2.749 2.362 3.065 . 0 0 "[ . 1 . 2]" 1
1032 1 43 MET QB 1 90 TRP HE1 . . 5.070 2.157 1.740 2.666 . 0 0 "[ . 1 . 2]" 1
1033 1 43 MET QB 1 90 TRP HZ2 . . 7.010 2.610 1.776 4.282 . 0 0 "[ . 1 . 2]" 1
1034 1 43 MET ME 1 44 VAL H . . 6.460 4.884 4.121 6.158 . 0 0 "[ . 1 . 2]" 1
1035 1 43 MET ME 1 90 TRP HD1 . . 5.100 2.826 1.778 4.088 . 0 0 "[ . 1 . 2]" 1
1036 1 43 MET ME 1 90 TRP HE1 . . 5.350 2.598 1.735 3.951 . 0 0 "[ . 1 . 2]" 1
1037 1 43 MET ME 1 90 TRP HZ2 . . 6.290 4.682 3.831 5.996 . 0 0 "[ . 1 . 2]" 1
1038 1 43 MET ME 1 91 LEU HA . . 6.320 4.586 3.230 5.683 . 0 0 "[ . 1 . 2]" 1
1039 1 43 MET ME 1 91 LEU QD . . 6.560 3.174 1.971 4.184 . 0 0 "[ . 1 . 2]" 1
1040 1 43 MET ME 1 94 TYR QD . . 7.800 4.198 3.067 5.102 . 0 0 "[ . 1 . 2]" 1
1041 1 43 MET ME 1 94 TYR QE . . 8.430 4.460 3.338 5.486 . 0 0 "[ . 1 . 2]" 1
1042 1 43 MET QG 1 44 VAL H . . 6.650 4.367 3.979 4.733 . 0 0 "[ . 1 . 2]" 1
1043 1 43 MET QG 1 90 TRP HE1 . . 6.420 3.226 1.786 4.228 . 0 0 "[ . 1 . 2]" 1
1044 1 43 MET QG 1 94 TYR QD . . 7.820 3.871 2.817 5.043 . 0 0 "[ . 1 . 2]" 1
1045 1 43 MET QG 1 94 TYR QE . . 7.740 3.414 2.980 4.795 . 0 0 "[ . 1 . 2]" 1
1046 1 43 MET HG2 1 90 TRP HE1 . . 6.360 3.455 1.792 4.534 . 0 0 "[ . 1 . 2]" 1
1047 1 43 MET HG2 1 94 TYR QE . . 7.600 3.702 3.107 4.981 . 0 0 "[ . 1 . 2]" 1
1048 1 43 MET HG3 1 90 TRP HE1 . . 6.360 4.116 3.500 5.055 . 0 0 "[ . 1 . 2]" 1
1049 1 43 MET HG3 1 94 TYR QE . . 7.600 4.447 3.178 6.250 . 0 0 "[ . 1 . 2]" 1
1050 1 44 VAL H 1 44 VAL HB . . 3.820 2.529 2.418 3.651 . 0 0 "[ . 1 . 2]" 1
1051 1 44 VAL H 1 45 GLY H . . 4.120 2.655 2.500 2.785 . 0 0 "[ . 1 . 2]" 1
1052 1 44 VAL H 1 46 GLU H . . 5.120 4.349 4.085 4.650 . 0 0 "[ . 1 . 2]" 1
1053 1 44 VAL HA 1 46 GLU H . . 6.000 4.555 4.278 4.805 . 0 0 "[ . 1 . 2]" 1
1054 1 44 VAL HA 1 47 MET H . . 4.880 3.500 3.220 3.990 . 0 0 "[ . 1 . 2]" 1
1055 1 44 VAL HA 1 47 MET HB2 . . 4.950 2.726 2.027 3.766 . 0 0 "[ . 1 . 2]" 1
1056 1 44 VAL HA 1 47 MET QB . . 5.180 2.531 1.968 3.033 . 0 0 "[ . 1 . 2]" 1
1057 1 44 VAL HA 1 47 MET HB3 . . 4.950 3.696 2.336 4.647 . 0 0 "[ . 1 . 2]" 1
1058 1 44 VAL HA 1 47 MET HG2 . . 5.830 3.682 2.987 4.994 . 0 0 "[ . 1 . 2]" 1
1059 1 44 VAL HA 1 47 MET QG . . 6.020 3.235 2.442 4.685 . 0 0 "[ . 1 . 2]" 1
1060 1 44 VAL HA 1 47 MET HG3 . . 5.830 3.786 2.555 5.670 . 0 0 "[ . 1 . 2]" 1
1061 1 44 VAL HA 1 90 TRP HH2 . . 5.210 3.511 2.559 4.848 . 0 0 "[ . 1 . 2]" 1
1062 1 44 VAL HA 1 90 TRP HZ2 . . 5.080 3.120 2.146 4.109 . 0 0 "[ . 1 . 2]" 1
1063 1 44 VAL HB 1 45 GLY H . . 4.290 2.767 2.539 3.676 . 0 0 "[ . 1 . 2]" 1
1064 1 44 VAL HB 1 62 LEU QD . . 7.930 4.576 3.658 5.179 . 0 0 "[ . 1 . 2]" 1
1065 1 44 VAL QG 1 45 GLY H . . 6.380 3.128 2.170 3.349 . 0 0 "[ . 1 . 2]" 1
1066 1 44 VAL QG 1 46 GLU H . . 7.320 4.697 4.276 4.869 . 0 0 "[ . 1 . 2]" 1
1067 1 44 VAL QG 1 47 MET H . . 8.060 4.363 4.187 4.733 . 0 0 "[ . 1 . 2]" 1
1068 1 44 VAL QG 1 48 ASN H . . 7.320 4.067 3.748 4.688 . 0 0 "[ . 1 . 2]" 1
1069 1 44 VAL QG 1 48 ASN QD . . 6.800 2.382 1.890 3.702 . 0 0 "[ . 1 . 2]" 1
1070 1 44 VAL QG 1 60 PHE H . . 7.010 4.122 3.702 4.786 . 0 0 "[ . 1 . 2]" 1
1071 1 44 VAL QG 1 60 PHE QB . . 6.650 2.087 1.809 2.433 . 0 0 "[ . 1 . 2]" 1
1072 1 44 VAL QG 1 60 PHE QD . . 9.380 3.337 2.600 3.970 . 0 0 "[ . 1 . 2]" 1
1073 1 44 VAL QG 1 61 GLU HA . . 6.640 3.839 2.429 4.625 . 0 0 "[ . 1 . 2]" 1
1074 1 44 VAL QG 1 62 LEU H . . 6.530 3.885 2.645 4.599 . 0 0 "[ . 1 . 2]" 1
1075 1 44 VAL QG 1 62 LEU HA . . 7.540 4.140 3.572 4.730 . 0 0 "[ . 1 . 2]" 1
1076 1 44 VAL QG 1 62 LEU QB . . 7.190 2.927 2.135 3.531 . 0 0 "[ . 1 . 2]" 1
1077 1 44 VAL QG 1 62 LEU HG . . 6.950 5.232 4.573 5.704 . 0 0 "[ . 1 . 2]" 1
1078 1 44 VAL QG 1 90 TRP HE1 . . 7.540 4.261 3.092 5.282 . 0 0 "[ . 1 . 2]" 1
1079 1 44 VAL QG 1 90 TRP HH2 . . 7.280 3.104 2.500 4.636 . 0 0 "[ . 1 . 2]" 1
1080 1 44 VAL QG 1 90 TRP HZ2 . . 7.150 3.121 2.308 4.266 . 0 0 "[ . 1 . 2]" 1
1081 1 44 VAL QG 1 90 TRP HZ3 . . 7.840 4.175 3.288 5.795 . 0 0 "[ . 1 . 2]" 1
1082 1 44 VAL MG1 1 45 GLY H . . 5.880 3.390 3.190 4.054 . 0 0 "[ . 1 . 2]" 1
1083 1 44 VAL MG1 1 46 GLU H . . 7.520 5.095 4.828 5.557 . 0 0 "[ . 1 . 2]" 1
1084 1 44 VAL MG1 1 48 ASN H . . 7.270 4.181 3.808 5.295 . 0 0 "[ . 1 . 2]" 1
1085 1 44 VAL MG1 1 60 PHE HA . . 6.520 4.439 4.018 4.757 . 0 0 "[ . 1 . 2]" 1
1086 1 44 VAL MG1 1 60 PHE HB2 . . 6.730 2.300 1.857 3.106 . 0 0 "[ . 1 . 2]" 1
1087 1 44 VAL MG1 1 60 PHE HB3 . . 6.730 2.696 2.076 3.326 . 0 0 "[ . 1 . 2]" 1
1088 1 44 VAL MG1 1 60 PHE QD . . 9.650 3.462 2.625 4.257 . 0 0 "[ . 1 . 2]" 1
1089 1 44 VAL MG1 1 61 GLU H . . 6.520 4.676 4.109 5.163 . 0 0 "[ . 1 . 2]" 1
1090 1 44 VAL MG1 1 62 LEU H . . 6.520 4.202 2.865 5.044 . 0 0 "[ . 1 . 2]" 1
1091 1 44 VAL MG1 1 62 LEU HB2 . . 6.920 3.863 2.990 4.661 . 0 0 "[ . 1 . 2]" 1
1092 1 44 VAL MG1 1 62 LEU HB3 . . 6.920 4.840 3.981 5.842 . 0 0 "[ . 1 . 2]" 1
1093 1 44 VAL MG1 1 90 TRP HH2 . . 7.330 4.195 2.887 5.909 . 0 0 "[ . 1 . 2]" 1
1094 1 44 VAL MG1 1 90 TRP HZ2 . . 7.520 4.670 3.459 5.820 . 0 0 "[ . 1 . 2]" 1
1095 1 44 VAL MG2 1 45 GLY H . . 5.880 3.857 2.179 4.060 . 0 0 "[ . 1 . 2]" 1
1096 1 44 VAL MG2 1 46 GLU H . . 7.520 5.566 4.445 5.809 . 0 0 "[ . 1 . 2]" 1
1097 1 44 VAL MG2 1 48 ASN H . . 7.270 5.709 5.231 6.246 . 0 0 "[ . 1 . 2]" 1
1098 1 44 VAL MG2 1 60 PHE HA . . 6.520 5.399 4.780 6.114 . 0 0 "[ . 1 . 2]" 1
1099 1 44 VAL MG2 1 60 PHE HB2 . . 6.730 3.900 3.242 4.804 . 0 0 "[ . 1 . 2]" 1
1100 1 44 VAL MG2 1 60 PHE HB3 . . 6.730 3.435 2.908 4.307 . 0 0 "[ . 1 . 2]" 1
1101 1 44 VAL MG2 1 60 PHE QD . . 9.650 4.479 4.080 5.168 . 0 0 "[ . 1 . 2]" 1
1102 1 44 VAL MG2 1 61 GLU H . . 6.520 5.366 4.607 6.008 . 0 0 "[ . 1 . 2]" 1
1103 1 44 VAL MG2 1 62 LEU H . . 6.520 4.648 3.105 5.495 . 0 0 "[ . 1 . 2]" 1
1104 1 44 VAL MG2 1 62 LEU HB2 . . 6.920 3.177 2.180 3.779 . 0 0 "[ . 1 . 2]" 1
1105 1 44 VAL MG2 1 62 LEU HB3 . . 6.920 4.571 3.542 5.261 . 0 0 "[ . 1 . 2]" 1
1106 1 44 VAL MG2 1 90 TRP HH2 . . 7.330 3.325 2.539 5.359 . 0 0 "[ . 1 . 2]" 1
1107 1 44 VAL MG2 1 90 TRP HZ2 . . 7.520 3.255 2.326 5.169 . 0 0 "[ . 1 . 2]" 1
1108 1 45 GLY H 1 46 GLU H . . 3.970 2.788 2.657 2.943 . 0 0 "[ . 1 . 2]" 1
1109 1 45 GLY H 1 46 GLU QG . . 6.100 4.115 3.836 5.419 . 0 0 "[ . 1 . 2]" 1
1110 1 45 GLY H 1 48 ASN HD21 . . 6.320 4.992 4.374 6.447 0.127 9 0 "[ . 1 . 2]" 1
1111 1 45 GLY H 1 48 ASN QD . . 6.420 4.639 4.240 5.352 . 0 0 "[ . 1 . 2]" 1
1112 1 45 GLY H 1 48 ASN HD22 . . 6.320 5.782 5.463 6.282 . 0 0 "[ . 1 . 2]" 1
1113 1 45 GLY QA 1 48 ASN H . . 6.080 3.601 3.224 4.055 . 0 0 "[ . 1 . 2]" 1
1114 1 45 GLY QA 1 48 ASN QB . . 7.090 3.101 2.612 3.975 . 0 0 "[ . 1 . 2]" 1
1115 1 45 GLY QA 1 48 ASN HD21 . . 6.290 3.414 2.567 4.852 . 0 0 "[ . 1 . 2]" 1
1116 1 45 GLY QA 1 48 ASN QD . . 6.510 3.225 2.531 4.085 . 0 0 "[ . 1 . 2]" 1
1117 1 45 GLY QA 1 48 ASN HD22 . . 6.290 4.385 3.799 4.866 . 0 0 "[ . 1 . 2]" 1
1118 1 45 GLY QA 1 49 LYS H . . 6.140 4.520 4.190 5.062 . 0 0 "[ . 1 . 2]" 1
1119 1 46 GLU H 1 46 GLU HG2 . . 4.100 2.133 1.848 3.512 . 0 0 "[ . 1 . 2]" 1
1120 1 46 GLU H 1 46 GLU HG3 . . 4.100 3.290 2.982 4.188 0.088 5 0 "[ . 1 . 2]" 1
1121 1 46 GLU H 1 47 MET QB . . 6.220 4.416 4.018 4.638 . 0 0 "[ . 1 . 2]" 1
1122 1 46 GLU H 1 49 LYS QB . . 6.240 5.433 4.652 6.326 0.086 18 0 "[ . 1 . 2]" 1
1123 1 46 GLU HA 1 46 GLU HG2 . . 3.960 3.748 3.678 3.872 . 0 0 "[ . 1 . 2]" 1
1124 1 46 GLU HA 1 46 GLU HG3 . . 3.960 3.755 3.193 3.847 . 0 0 "[ . 1 . 2]" 1
1125 1 46 GLU HA 1 49 LYS H . . 4.380 3.209 2.963 3.583 . 0 0 "[ . 1 . 2]" 1
1126 1 46 GLU HA 1 49 LYS QB . . 4.440 2.980 2.130 4.227 . 0 0 "[ . 1 . 2]" 1
1127 1 46 GLU HA 1 49 LYS QD . . 5.030 3.249 1.783 4.931 . 0 0 "[ . 1 . 2]" 1
1128 1 46 GLU HA 1 49 LYS HG2 . . 5.090 3.810 2.279 5.192 0.102 11 0 "[ . 1 . 2]" 1
1129 1 46 GLU HA 1 49 LYS QG . . 5.360 2.749 1.737 4.370 . 0 0 "[ . 1 . 2]" 1
1130 1 46 GLU HA 1 49 LYS HG3 . . 5.090 2.912 1.770 5.208 0.118 2 0 "[ . 1 . 2]" 1
1131 1 46 GLU HA 1 50 LEU H . . 4.800 4.566 3.991 4.893 0.093 5 0 "[ . 1 . 2]" 1
1132 1 46 GLU HA 1 50 LEU MD1 . . 6.520 5.083 4.598 5.639 . 0 0 "[ . 1 . 2]" 1
1133 1 46 GLU HA 1 50 LEU MD2 . . 6.520 5.069 4.724 5.720 . 0 0 "[ . 1 . 2]" 1
1134 1 46 GLU QB 1 47 MET H . . 7.380 3.552 3.219 3.693 . 0 0 "[ . 1 . 2]" 1
1135 1 46 GLU QB 1 49 LYS H . . 6.980 4.672 4.296 5.125 . 0 0 "[ . 1 . 2]" 1
1136 1 46 GLU QB 1 50 LEU MD1 . . 7.400 3.877 3.191 4.838 . 0 0 "[ . 1 . 2]" 1
1137 1 46 GLU QB 1 50 LEU MD2 . . 7.400 4.159 3.580 4.845 . 0 0 "[ . 1 . 2]" 1
1138 1 46 GLU QB 1 94 TYR QE . . 9.050 4.607 4.170 6.511 . 0 0 "[ . 1 . 2]" 1
1139 1 46 GLU QG 1 47 MET ME . . 6.020 3.397 2.257 4.933 . 0 0 "[ . 1 . 2]" 1
1140 1 46 GLU QG 1 49 LYS H . . 6.250 5.130 4.649 5.560 . 0 0 "[ . 1 . 2]" 1
1141 1 46 GLU QG 1 50 LEU QD . . 6.800 3.503 2.704 3.845 . 0 0 "[ . 1 . 2]" 1
1142 1 46 GLU QG 1 94 TYR QE . . 7.340 2.959 2.524 4.596 . 0 0 "[ . 1 . 2]" 1
1143 1 46 GLU HG2 1 47 MET ME . . 5.900 4.637 3.482 5.985 0.085 19 0 "[ . 1 . 2]" 1
1144 1 46 GLU HG2 1 94 TYR QE . . 7.140 4.030 2.573 5.504 . 0 0 "[ . 1 . 2]" 1
1145 1 46 GLU HG3 1 47 MET ME . . 5.900 3.537 2.287 5.731 . 0 0 "[ . 1 . 2]" 1
1146 1 46 GLU HG3 1 94 TYR QE . . 7.140 3.114 2.576 4.924 . 0 0 "[ . 1 . 2]" 1
1147 1 47 MET H 1 47 MET ME . . 5.450 3.935 2.872 5.296 . 0 0 "[ . 1 . 2]" 1
1148 1 47 MET H 1 47 MET HG2 . . 4.720 3.148 2.301 4.602 . 0 0 "[ . 1 . 2]" 1
1149 1 47 MET H 1 47 MET QG . . 4.960 2.947 2.276 4.028 . 0 0 "[ . 1 . 2]" 1
1150 1 47 MET H 1 47 MET HG3 . . 4.720 3.926 3.475 4.518 . 0 0 "[ . 1 . 2]" 1
1151 1 47 MET H 1 49 LYS QB . . 6.910 5.337 4.627 6.189 . 0 0 "[ . 1 . 2]" 1
1152 1 47 MET H 1 50 LEU QD . . 7.540 4.370 3.744 4.679 . 0 0 "[ . 1 . 2]" 1
1153 1 47 MET HA 1 47 MET ME . . 4.940 2.528 1.720 3.859 . 0 0 "[ . 1 . 2]" 1
1154 1 47 MET HA 1 50 LEU H . . 4.910 3.517 3.214 3.920 . 0 0 "[ . 1 . 2]" 1
1155 1 47 MET HA 1 50 LEU HB2 . . 4.690 3.006 2.446 3.347 . 0 0 "[ . 1 . 2]" 1
1156 1 47 MET HA 1 50 LEU QB . . 4.930 2.965 2.424 3.280 . 0 0 "[ . 1 . 2]" 1
1157 1 47 MET HA 1 50 LEU HB3 . . 4.690 4.530 3.983 4.726 0.036 8 0 "[ . 1 . 2]" 1
1158 1 47 MET HA 1 50 LEU MD1 . . 5.760 2.463 1.915 2.931 . 0 0 "[ . 1 . 2]" 1
1159 1 47 MET HA 1 50 LEU QD . . 6.040 2.452 1.912 2.913 . 0 0 "[ . 1 . 2]" 1
1160 1 47 MET HA 1 50 LEU MD2 . . 5.760 4.593 4.017 5.036 . 0 0 "[ . 1 . 2]" 1
1161 1 47 MET HA 1 97 MET ME . . 5.960 3.935 2.954 5.557 . 0 0 "[ . 1 . 2]" 1
1162 1 47 MET QB 1 60 PHE QE . . 8.350 3.356 2.517 4.279 . 0 0 "[ . 1 . 2]" 1
1163 1 47 MET QB 1 60 PHE HZ . . 6.220 4.257 3.221 5.741 . 0 0 "[ . 1 . 2]" 1
1164 1 47 MET QB 1 90 TRP HZ2 . . 6.030 3.778 2.794 4.713 . 0 0 "[ . 1 . 2]" 1
1165 1 47 MET HB2 1 48 ASN H . . 4.640 2.984 2.434 3.972 . 0 0 "[ . 1 . 2]" 1
1166 1 47 MET HB3 1 48 ASN H . . 4.640 3.248 2.567 3.662 . 0 0 "[ . 1 . 2]" 1
1167 1 47 MET ME 1 50 LEU H . . 6.520 5.156 3.877 6.355 . 0 0 "[ . 1 . 2]" 1
1168 1 47 MET ME 1 50 LEU MD1 . . 6.390 2.394 1.785 3.606 . 0 0 "[ . 1 . 2]" 1
1169 1 47 MET ME 1 50 LEU QD . . 6.400 2.383 1.783 3.575 . 0 0 "[ . 1 . 2]" 1
1170 1 47 MET ME 1 50 LEU MD2 . . 6.390 4.645 4.070 5.862 . 0 0 "[ . 1 . 2]" 1
1171 1 47 MET ME 1 60 PHE QD . . 8.930 5.874 4.592 7.083 . 0 0 "[ . 1 . 2]" 1
1172 1 47 MET ME 1 60 PHE QE . . 8.650 5.050 3.749 6.200 . 0 0 "[ . 1 . 2]" 1
1173 1 47 MET ME 1 60 PHE HZ . . 6.520 5.344 3.769 6.526 0.006 4 0 "[ . 1 . 2]" 1
1174 1 47 MET ME 1 90 TRP HE1 . . 7.440 5.384 3.427 6.979 . 0 0 "[ . 1 . 2]" 1
1175 1 47 MET ME 1 90 TRP HZ2 . . 5.890 4.126 2.742 5.531 . 0 0 "[ . 1 . 2]" 1
1176 1 47 MET ME 1 93 PHE QD . . 8.540 4.433 2.200 5.356 . 0 0 "[ . 1 . 2]" 1
1177 1 47 MET ME 1 93 PHE QE . . 8.060 4.170 2.286 4.793 . 0 0 "[ . 1 . 2]" 1
1178 1 47 MET ME 1 93 PHE HZ . . 5.690 5.443 3.751 5.748 0.058 4 0 "[ . 1 . 2]" 1
1179 1 47 MET ME 1 94 TYR H . . 7.520 5.333 3.602 6.547 . 0 0 "[ . 1 . 2]" 1
1180 1 47 MET ME 1 94 TYR HA . . 5.430 3.165 1.768 4.269 . 0 0 "[ . 1 . 2]" 1
1181 1 47 MET ME 1 94 TYR QD . . 6.900 2.479 1.793 3.687 . 0 0 "[ . 1 . 2]" 1
1182 1 47 MET ME 1 94 TYR QE . . 7.170 2.730 1.894 4.827 . 0 0 "[ . 1 . 2]" 1
1183 1 47 MET ME 1 97 MET HA . . 6.130 4.774 4.155 5.668 . 0 0 "[ . 1 . 2]" 1
1184 1 47 MET ME 1 97 MET QB . . 6.780 2.388 1.862 3.250 . 0 0 "[ . 1 . 2]" 1
1185 1 47 MET ME 1 97 MET ME . . 5.830 2.797 2.258 3.868 . 0 0 "[ . 1 . 2]" 1
1186 1 47 MET ME 1 98 THR H . . 6.230 4.043 2.876 4.823 . 0 0 "[ . 1 . 2]" 1
1187 1 47 MET ME 1 98 THR HA . . 5.970 4.347 2.507 5.878 . 0 0 "[ . 1 . 2]" 1
1188 1 47 MET ME 1 98 THR MG . . 5.490 4.104 2.182 5.505 0.015 18 0 "[ . 1 . 2]" 1
1189 1 47 MET QG 1 48 ASN H . . 6.330 4.088 3.581 4.476 . 0 0 "[ . 1 . 2]" 1
1190 1 47 MET QG 1 50 LEU QD . . 8.610 3.783 2.848 4.320 . 0 0 "[ . 1 . 2]" 1
1191 1 47 MET QG 1 51 LEU QD . . 8.310 4.430 2.620 5.973 . 0 0 "[ . 1 . 2]" 1
1192 1 47 MET QG 1 90 TRP HH2 . . 5.540 2.638 1.789 4.238 . 0 0 "[ . 1 . 2]" 1
1193 1 47 MET QG 1 90 TRP HZ2 . . 5.400 2.881 1.782 4.540 . 0 0 "[ . 1 . 2]" 1
1194 1 47 MET HG2 1 60 PHE QD . . 8.090 5.315 3.611 6.732 . 0 0 "[ . 1 . 2]" 1
1195 1 47 MET HG2 1 90 TRP HH2 . . 5.350 3.692 1.921 4.977 . 0 0 "[ . 1 . 2]" 1
1196 1 47 MET HG2 1 90 TRP HZ2 . . 5.130 3.444 2.740 5.019 . 0 0 "[ . 1 . 2]" 1
1197 1 47 MET HG2 1 94 TYR QD . . 7.630 4.051 3.169 5.622 . 0 0 "[ . 1 . 2]" 1
1198 1 47 MET HG3 1 60 PHE QD . . 8.090 4.884 3.663 5.920 . 0 0 "[ . 1 . 2]" 1
1199 1 47 MET HG3 1 90 TRP HH2 . . 5.350 3.182 1.802 5.365 0.015 18 0 "[ . 1 . 2]" 1
1200 1 47 MET HG3 1 90 TRP HZ2 . . 5.130 3.447 1.800 5.183 0.053 17 0 "[ . 1 . 2]" 1
1201 1 47 MET HG3 1 94 TYR QD . . 7.630 4.322 3.487 5.359 . 0 0 "[ . 1 . 2]" 1
1202 1 48 ASN H 1 48 ASN QD . . 5.660 2.583 2.010 3.642 . 0 0 "[ . 1 . 2]" 1
1203 1 48 ASN H 1 49 LYS H . . 3.620 2.654 2.494 2.909 . 0 0 "[ . 1 . 2]" 1
1204 1 48 ASN H 1 49 LYS HA . . 6.050 5.254 5.108 5.459 . 0 0 "[ . 1 . 2]" 1
1205 1 48 ASN H 1 49 LYS QB . . 6.170 4.765 4.294 5.293 . 0 0 "[ . 1 . 2]" 1
1206 1 48 ASN HA 1 51 LEU MD1 . . 6.160 3.557 2.378 4.426 . 0 0 "[ . 1 . 2]" 1
1207 1 48 ASN HA 1 51 LEU QD . . 6.620 3.508 2.366 4.319 . 0 0 "[ . 1 . 2]" 1
1208 1 48 ASN HA 1 51 LEU MD2 . . 6.160 5.489 4.246 6.015 . 0 0 "[ . 1 . 2]" 1
1209 1 48 ASN HA 1 97 MET ME . . 7.410 5.583 4.700 7.023 . 0 0 "[ . 1 . 2]" 1
1210 1 48 ASN QB 1 49 LYS H . . 4.980 2.740 2.288 3.027 . 0 0 "[ . 1 . 2]" 1
1211 1 48 ASN QD 1 59 LYS QB . . 6.960 5.308 4.120 6.012 . 0 0 "[ . 1 . 2]" 1
1212 1 48 ASN QD 1 60 PHE H . . 5.020 3.026 2.283 3.521 . 0 0 "[ . 1 . 2]" 1
1213 1 48 ASN QD 1 60 PHE QB . . 6.060 2.356 1.771 3.221 . 0 0 "[ . 1 . 2]" 1
1214 1 48 ASN QD 1 60 PHE QD . . 7.780 2.503 1.763 4.048 . 0 0 "[ . 1 . 2]" 1
1215 1 48 ASN HD21 1 59 LYS HA . . 6.330 5.634 3.864 6.345 0.015 16 0 "[ . 1 . 2]" 1
1216 1 48 ASN HD21 1 60 PHE H . . 4.960 4.522 3.895 5.017 0.057 6 0 "[ . 1 . 2]" 1
1217 1 48 ASN HD22 1 59 LYS HA . . 6.330 4.498 3.259 5.175 . 0 0 "[ . 1 . 2]" 1
1218 1 48 ASN HD22 1 60 PHE H . . 4.960 3.079 2.299 3.600 . 0 0 "[ . 1 . 2]" 1
1219 1 49 LYS H 1 49 LYS QD . . 5.560 3.877 3.338 4.354 . 0 0 "[ . 1 . 2]" 1
1220 1 49 LYS H 1 49 LYS QE . . 6.290 4.612 3.817 5.855 . 0 0 "[ . 1 . 2]" 1
1221 1 49 LYS H 1 49 LYS HG2 . . 4.440 3.245 2.121 4.513 0.073 2 0 "[ . 1 . 2]" 1
1222 1 49 LYS H 1 49 LYS HG3 . . 4.440 2.592 1.969 4.368 . 0 0 "[ . 1 . 2]" 1
1223 1 49 LYS H 1 50 LEU H . . 3.720 2.527 2.230 2.712 . 0 0 "[ . 1 . 2]" 1
1224 1 49 LYS H 1 50 LEU HG . . 5.500 4.189 3.745 4.452 . 0 0 "[ . 1 . 2]" 1
1225 1 49 LYS H 1 51 LEU H . . 4.970 4.143 3.874 4.536 . 0 0 "[ . 1 . 2]" 1
1226 1 49 LYS HA 1 49 LYS QD . . 4.840 3.736 1.948 4.407 . 0 0 "[ . 1 . 2]" 1
1227 1 49 LYS HA 1 49 LYS QE . . 5.770 4.416 1.788 5.309 . 0 0 "[ . 1 . 2]" 1
1228 1 49 LYS HA 1 49 LYS HG2 . . 4.210 3.001 2.294 4.239 0.029 6 0 "[ . 1 . 2]" 1
1229 1 49 LYS HA 1 49 LYS HG3 . . 4.210 3.332 2.354 3.782 . 0 0 "[ . 1 . 2]" 1
1230 1 49 LYS HA 1 51 LEU H . . 5.380 3.894 3.534 4.612 . 0 0 "[ . 1 . 2]" 1
1231 1 49 LYS HA 1 52 GLU H . . 4.840 3.448 2.938 4.210 . 0 0 "[ . 1 . 2]" 1
1232 1 49 LYS HA 1 52 GLU HB2 . . 6.490 2.962 1.772 4.799 . 0 0 "[ . 1 . 2]" 1
1233 1 49 LYS HA 1 52 GLU HB3 . . 6.490 4.121 2.875 5.276 . 0 0 "[ . 1 . 2]" 1
1234 1 49 LYS HA 1 52 GLU QG . . 5.260 2.576 1.788 3.631 . 0 0 "[ . 1 . 2]" 1
1235 1 49 LYS QB 1 50 LEU H . . 4.480 3.198 2.487 3.860 . 0 0 "[ . 1 . 2]" 1
1236 1 49 LYS QD 1 50 LEU H . . 6.380 4.754 2.878 5.774 . 0 0 "[ . 1 . 2]" 1
1237 1 49 LYS QG 1 50 LEU H . . 5.280 3.871 2.657 4.477 . 0 0 "[ . 1 . 2]" 1
1238 1 49 LYS QG 1 52 GLU H . . 6.750 5.508 4.548 6.412 . 0 0 "[ . 1 . 2]" 1
1239 1 49 LYS HG2 1 50 LEU H . . 5.030 4.775 3.876 5.141 0.111 10 0 "[ . 1 . 2]" 1
1240 1 49 LYS HG3 1 50 LEU H . . 5.030 4.222 2.706 5.070 0.040 9 0 "[ . 1 . 2]" 1
1241 1 50 LEU H 1 50 LEU HB2 . . 4.000 2.423 2.349 2.541 . 0 0 "[ . 1 . 2]" 1
1242 1 50 LEU H 1 50 LEU HB3 . . 4.000 3.605 3.573 3.673 . 0 0 "[ . 1 . 2]" 1
1243 1 50 LEU H 1 50 LEU HG . . 3.930 2.580 2.131 2.996 . 0 0 "[ . 1 . 2]" 1
1244 1 50 LEU H 1 51 LEU H . . 4.130 2.419 1.924 2.790 . 0 0 "[ . 1 . 2]" 1
1245 1 50 LEU H 1 52 GLU H . . 5.280 3.902 3.339 4.430 . 0 0 "[ . 1 . 2]" 1
1246 1 50 LEU H 1 101 LEU QD . . 8.400 4.983 4.161 5.809 . 0 0 "[ . 1 . 2]" 1
1247 1 50 LEU HA 1 50 LEU HG . . 4.170 3.063 2.948 3.127 . 0 0 "[ . 1 . 2]" 1
1248 1 50 LEU HA 1 52 GLU H . . 4.960 4.044 3.656 4.435 . 0 0 "[ . 1 . 2]" 1
1249 1 50 LEU HA 1 97 MET ME . . 7.090 5.987 4.539 7.153 0.063 19 0 "[ . 1 . 2]" 1
1250 1 50 LEU HA 1 101 LEU QD . . 6.810 4.145 3.180 5.218 . 0 0 "[ . 1 . 2]" 1
1251 1 50 LEU QB 1 51 LEU H . . 5.020 2.956 2.600 3.410 . 0 0 "[ . 1 . 2]" 1
1252 1 50 LEU QB 1 101 LEU QB . . 6.140 2.830 2.077 3.860 . 0 0 "[ . 1 . 2]" 1
1253 1 50 LEU HB2 1 51 LEU H . . 4.730 3.062 2.670 3.586 . 0 0 "[ . 1 . 2]" 1
1254 1 50 LEU HB3 1 51 LEU H . . 4.730 3.910 3.581 4.267 . 0 0 "[ . 1 . 2]" 1
1255 1 50 LEU QD 1 51 LEU H . . 7.100 4.261 4.121 4.376 . 0 0 "[ . 1 . 2]" 1
1256 1 50 LEU QD 1 94 TYR HA . . 7.840 5.646 4.526 6.469 . 0 0 "[ . 1 . 2]" 1
1257 1 50 LEU QD 1 94 TYR QE . . 10.630 3.891 3.214 4.691 . 0 0 "[ . 1 . 2]" 1
1258 1 50 LEU QD 1 97 MET QG . . 7.700 4.428 2.073 5.355 . 0 0 "[ . 1 . 2]" 1
1259 1 50 LEU MD1 1 51 LEU H . . 6.760 4.898 4.547 5.254 . 0 0 "[ . 1 . 2]" 1
1260 1 50 LEU MD1 1 101 LEU H . . 6.520 4.910 4.010 5.677 . 0 0 "[ . 1 . 2]" 1
1261 1 50 LEU MD2 1 51 LEU H . . 6.760 4.693 4.637 4.774 . 0 0 "[ . 1 . 2]" 1
1262 1 50 LEU MD2 1 101 LEU H . . 6.520 5.983 5.052 6.567 0.047 15 0 "[ . 1 . 2]" 1
1263 1 50 LEU HG 1 51 LEU H . . 4.790 4.582 4.344 4.732 . 0 0 "[ . 1 . 2]" 1
1264 1 51 LEU H 1 51 LEU HG . . 4.530 2.974 2.036 3.975 . 0 0 "[ . 1 . 2]" 1
1265 1 51 LEU H 1 52 GLU H . . 3.930 2.247 1.921 2.547 . 0 0 "[ . 1 . 2]" 1
1266 1 51 LEU H 1 52 GLU HB2 . . 5.620 4.264 3.576 5.654 0.034 6 0 "[ . 1 . 2]" 1
1267 1 51 LEU H 1 52 GLU HB3 . . 5.620 5.423 4.255 5.773 0.153 4 0 "[ . 1 . 2]" 1
1268 1 51 LEU H 1 52 GLU HG2 . . 5.880 4.782 3.738 6.089 0.209 7 0 "[ . 1 . 2]" 1
1269 1 51 LEU H 1 52 GLU QG . . 5.980 4.115 3.250 5.210 . 0 0 "[ . 1 . 2]" 1
1270 1 51 LEU H 1 52 GLU HG3 . . 5.880 4.910 3.339 5.948 0.068 8 0 "[ . 1 . 2]" 1
1271 1 51 LEU H 1 53 PRO QD . . 6.060 3.784 2.965 4.411 . 0 0 "[ . 1 . 2]" 1
1272 1 51 LEU H 1 54 SER H . . 5.690 5.502 4.999 5.724 0.034 2 0 "[ . 1 . 2]" 1
1273 1 51 LEU H 1 97 MET ME . . 7.270 5.045 3.482 5.951 . 0 0 "[ . 1 . 2]" 1
1274 1 51 LEU H 1 101 LEU QD . . 7.540 4.392 3.876 5.215 . 0 0 "[ . 1 . 2]" 1
1275 1 51 LEU HA 1 53 PRO QD . . 6.240 3.176 2.761 3.595 . 0 0 "[ . 1 . 2]" 1
1276 1 51 LEU HA 1 54 SER H . . 4.470 3.651 3.206 4.003 . 0 0 "[ . 1 . 2]" 1
1277 1 51 LEU HA 1 54 SER QB . . 5.670 3.069 2.376 3.666 . 0 0 "[ . 1 . 2]" 1
1278 1 51 LEU HA 1 101 LEU QD . . 7.430 3.398 2.955 3.831 . 0 0 "[ . 1 . 2]" 1
1279 1 51 LEU QB 1 52 GLU H . . 5.270 3.509 3.012 3.984 . 0 0 "[ . 1 . 2]" 1
1280 1 51 LEU QB 1 54 SER H . . 6.020 4.341 3.693 4.855 . 0 0 "[ . 1 . 2]" 1
1281 1 51 LEU HB2 1 52 GLU H . . 5.100 3.735 3.136 4.350 . 0 0 "[ . 1 . 2]" 1
1282 1 51 LEU HB2 1 54 SER H . . 5.970 5.318 3.795 5.856 . 0 0 "[ . 1 . 2]" 1
1283 1 51 LEU HB3 1 52 GLU H . . 5.100 4.281 3.891 4.623 . 0 0 "[ . 1 . 2]" 1
1284 1 51 LEU HB3 1 54 SER H . . 5.970 4.722 4.054 5.260 . 0 0 "[ . 1 . 2]" 1
1285 1 51 LEU QD 1 52 GLU H . . 7.010 4.168 2.938 4.460 . 0 0 "[ . 1 . 2]" 1
1286 1 51 LEU QD 1 54 SER HA . . 8.500 5.393 4.676 6.345 . 0 0 "[ . 1 . 2]" 1
1287 1 51 LEU QD 1 54 SER HG . . 7.820 3.434 2.442 5.719 . 0 0 "[ . 1 . 2]" 1
1288 1 51 LEU QD 1 55 GLN H . . 7.540 5.326 4.733 6.314 . 0 0 "[ . 1 . 2]" 1
1289 1 51 LEU QD 1 56 VAL H . . 7.540 4.228 3.614 5.010 . 0 0 "[ . 1 . 2]" 1
1290 1 51 LEU QD 1 58 LEU H . . 7.540 3.308 2.213 4.606 . 0 0 "[ . 1 . 2]" 1
1291 1 51 LEU QD 1 60 PHE QD . . 9.570 4.066 2.962 4.713 . 0 0 "[ . 1 . 2]" 1
1292 1 51 LEU QD 1 60 PHE QE . . 8.500 2.226 1.777 2.939 . 0 0 "[ . 1 . 2]" 1
1293 1 51 LEU QD 1 60 PHE HZ . . 6.750 2.679 2.175 3.864 . 0 0 "[ . 1 . 2]" 1
1294 1 51 LEU QD 1 97 MET ME . . 6.430 2.052 1.731 2.550 . 0 0 "[ . 1 . 2]" 1
1295 1 51 LEU MD1 1 52 GLU H . . 7.060 4.819 2.955 5.501 . 0 0 "[ . 1 . 2]" 1
1296 1 51 LEU MD1 1 60 PHE QE . . 8.650 2.326 1.778 3.678 . 0 0 "[ . 1 . 2]" 1
1297 1 51 LEU MD1 1 60 PHE HZ . . 6.520 2.926 2.179 5.721 . 0 0 "[ . 1 . 2]" 1
1298 1 51 LEU MD1 1 97 MET ME . . 6.280 2.413 1.774 4.459 . 0 0 "[ . 1 . 2]" 1
1299 1 51 LEU MD2 1 52 GLU H . . 7.060 4.884 4.598 5.594 . 0 0 "[ . 1 . 2]" 1
1300 1 51 LEU MD2 1 60 PHE QE . . 8.650 4.363 2.121 5.346 . 0 0 "[ . 1 . 2]" 1
1301 1 51 LEU MD2 1 60 PHE HZ . . 6.520 4.431 2.522 5.275 . 0 0 "[ . 1 . 2]" 1
1302 1 51 LEU MD2 1 97 MET ME . . 6.280 2.597 2.066 3.452 . 0 0 "[ . 1 . 2]" 1
1303 1 51 LEU HG 1 52 GLU H . . 5.500 4.748 4.169 5.127 . 0 0 "[ . 1 . 2]" 1
1304 1 51 LEU HG 1 60 PHE QE . . 7.630 4.387 3.788 5.814 . 0 0 "[ . 1 . 2]" 1
1305 1 51 LEU HG 1 60 PHE HZ . . 5.500 5.087 4.276 6.870 1.370 4 1 "[ +. 1 . 2]" 1
1306 1 51 LEU HG 1 101 LEU QB . . 6.410 4.964 4.690 5.199 . 0 0 "[ . 1 . 2]" 1
1307 1 52 GLU H 1 52 GLU HB2 . . 3.830 2.331 2.021 3.656 . 0 0 "[ . 1 . 2]" 1
1308 1 52 GLU H 1 52 GLU HB3 . . 3.830 3.339 2.519 3.622 . 0 0 "[ . 1 . 2]" 1
1309 1 52 GLU H 1 52 GLU HG2 . . 4.050 3.356 2.061 4.318 0.268 7 0 "[ . 1 . 2]" 1
1310 1 52 GLU H 1 52 GLU HG3 . . 4.050 3.449 2.018 4.256 0.206 19 0 "[ . 1 . 2]" 1
1311 1 52 GLU H 1 53 PRO HD2 . . 4.150 2.537 1.843 3.073 . 0 0 "[ . 1 . 2]" 1
1312 1 52 GLU H 1 53 PRO HD3 . . 4.150 2.757 2.117 3.247 . 0 0 "[ . 1 . 2]" 1
1313 1 52 GLU H 1 53 PRO QG . . 5.420 4.208 3.772 4.474 . 0 0 "[ . 1 . 2]" 1
1314 1 52 GLU HA 1 52 GLU HG2 . . 3.560 2.549 2.136 3.698 0.138 6 0 "[ . 1 . 2]" 1
1315 1 52 GLU HA 1 52 GLU HG3 . . 3.560 3.331 2.465 3.725 0.165 6 0 "[ . 1 . 2]" 1
1316 1 52 GLU QB 1 53 PRO QD . . 4.970 1.995 1.757 3.304 . 0 0 "[ . 1 . 2]" 1
1317 1 52 GLU QB 1 54 SER H . . 7.080 4.391 4.207 4.633 . 0 0 "[ . 1 . 2]" 1
1318 1 52 GLU HB2 1 53 PRO HD2 . . 4.320 3.429 2.746 4.544 0.224 6 0 "[ . 1 . 2]" 1
1319 1 52 GLU HB2 1 53 PRO HD3 . . 4.320 2.333 1.775 3.864 . 0 0 "[ . 1 . 2]" 1
1320 1 52 GLU HB3 1 53 PRO HD2 . . 4.320 3.981 3.106 4.490 0.170 13 0 "[ . 1 . 2]" 1
1321 1 52 GLU HB3 1 53 PRO HD3 . . 4.320 2.812 1.806 4.076 . 0 0 "[ . 1 . 2]" 1
1322 1 52 GLU QG 1 53 PRO QD . . 5.590 3.572 1.706 3.876 . 0 0 "[ . 1 . 2]" 1
1323 1 53 PRO QD 1 54 SER H . . 4.950 2.918 2.466 3.331 . 0 0 "[ . 1 . 2]" 1
1324 1 53 PRO HD2 1 54 SER H . . 4.620 2.998 2.512 3.485 . 0 0 "[ . 1 . 2]" 1
1325 1 53 PRO HD3 1 54 SER H . . 4.620 4.025 3.590 4.263 . 0 0 "[ . 1 . 2]" 1
1326 1 53 PRO QG 1 54 SER H . . 5.570 3.703 2.738 4.565 . 0 0 "[ . 1 . 2]" 1
1327 1 53 PRO QG 1 104 PHE QB . . 7.000 5.555 4.291 6.794 . 0 0 "[ . 1 . 2]" 1
1328 1 53 PRO HG2 1 54 SER H . . 5.500 3.904 2.774 5.124 . 0 0 "[ . 1 . 2]" 1
1329 1 53 PRO HG3 1 54 SER H . . 5.500 4.783 4.216 5.124 . 0 0 "[ . 1 . 2]" 1
1330 1 54 SER H 1 54 SER HG . . 4.420 2.838 2.030 4.474 0.054 12 0 "[ . 1 . 2]" 1
1331 1 54 SER HA 1 56 VAL H . . 5.510 4.172 3.763 4.539 . 0 0 "[ . 1 . 2]" 1
1332 1 54 SER HA 1 56 VAL QG . . 7.540 4.481 3.882 5.014 . 0 0 "[ . 1 . 2]" 1
1333 1 54 SER QB 1 55 GLN H . . 5.040 2.393 1.904 3.409 . 0 0 "[ . 1 . 2]" 1
1334 1 54 SER QB 1 56 VAL H . . 5.910 2.751 2.384 3.339 . 0 0 "[ . 1 . 2]" 1
1335 1 54 SER QB 1 56 VAL QG . . 7.180 2.563 1.905 3.298 . 0 0 "[ . 1 . 2]" 1
1336 1 54 SER HB2 1 55 GLN H . . 4.820 2.676 1.915 3.897 . 0 0 "[ . 1 . 2]" 1
1337 1 54 SER HB3 1 55 GLN H . . 4.820 3.415 2.054 4.035 . 0 0 "[ . 1 . 2]" 1
1338 1 54 SER HG 1 55 GLN H . . 6.500 3.821 2.536 4.863 . 0 0 "[ . 1 . 2]" 1
1339 1 54 SER HG 1 56 VAL H . . 5.590 3.619 2.786 5.043 . 0 0 "[ . 1 . 2]" 1
1340 1 54 SER HG 1 56 VAL HB . . 6.070 4.774 3.077 6.107 0.037 16 0 "[ . 1 . 2]" 1
1341 1 54 SER HG 1 56 VAL QG . . 7.850 3.383 2.423 4.311 . 0 0 "[ . 1 . 2]" 1
1342 1 55 GLN H 1 55 GLN HG2 . . 4.400 3.382 2.258 4.575 0.175 20 0 "[ . 1 . 2]" 1
1343 1 55 GLN H 1 55 GLN HG3 . . 4.400 3.647 2.409 4.458 0.058 7 0 "[ . 1 . 2]" 1
1344 1 55 GLN H 1 56 VAL HB . . 6.040 5.160 4.439 6.078 0.038 3 0 "[ . 1 . 2]" 1
1345 1 55 GLN H 1 56 VAL MG1 . . 6.240 4.922 3.605 5.677 . 0 0 "[ . 1 . 2]" 1
1346 1 55 GLN H 1 56 VAL QG . . 6.540 3.154 2.788 3.744 . 0 0 "[ . 1 . 2]" 1
1347 1 55 GLN H 1 56 VAL MG2 . . 6.240 3.326 2.799 5.729 . 0 0 "[ . 1 . 2]" 1
1348 1 55 GLN H 1 57 HIS H . . 6.210 5.328 4.249 6.239 0.029 5 0 "[ . 1 . 2]" 1
1349 1 55 GLN HA 1 55 GLN HG2 . . 4.020 3.108 2.516 3.723 . 0 0 "[ . 1 . 2]" 1
1350 1 55 GLN HA 1 55 GLN HG3 . . 4.020 3.238 2.354 3.844 . 0 0 "[ . 1 . 2]" 1
1351 1 55 GLN HA 1 57 HIS HD2 . . 4.500 3.362 2.817 3.880 . 0 0 "[ . 1 . 2]" 1
1352 1 55 GLN QB 1 56 VAL HA . . 6.210 3.988 3.770 4.207 . 0 0 "[ . 1 . 2]" 1
1353 1 55 GLN QB 1 57 HIS HD2 . . 6.000 4.446 3.174 5.125 . 0 0 "[ . 1 . 2]" 1
1354 1 55 GLN HB2 1 56 VAL H . . 5.500 3.478 2.723 4.081 . 0 0 "[ . 1 . 2]" 1
1355 1 55 GLN HB3 1 56 VAL H . . 5.500 3.889 2.521 4.488 . 0 0 "[ . 1 . 2]" 1
1356 1 56 VAL H 1 56 VAL HB . . 3.900 2.976 2.552 3.637 . 0 0 "[ . 1 . 2]" 1
1357 1 56 VAL H 1 57 HIS H . . 4.450 3.435 2.391 4.368 . 0 0 "[ . 1 . 2]" 1
1358 1 56 VAL H 1 58 LEU H . . 5.700 5.448 4.359 5.749 0.049 5 0 "[ . 1 . 2]" 1
1359 1 56 VAL HA 1 57 HIS HD2 . . 5.500 4.575 3.362 5.388 . 0 0 "[ . 1 . 2]" 1
1360 1 56 VAL HA 1 58 LEU H . . 5.500 4.850 4.340 5.591 0.091 20 0 "[ . 1 . 2]" 1
1361 1 56 VAL HB 1 57 HIS H . . 4.960 3.690 2.130 4.437 . 0 0 "[ . 1 . 2]" 1
1362 1 56 VAL HB 1 58 LEU H . . 5.500 3.906 2.747 5.536 0.036 8 0 "[ . 1 . 2]" 1
1363 1 56 VAL HB 1 58 LEU QD . . 7.950 3.300 1.692 4.444 . 0 0 "[ . 1 . 2]" 1
1364 1 56 VAL QG 1 57 HIS H . . 6.380 3.132 2.165 3.723 . 0 0 "[ . 1 . 2]" 1
1365 1 56 VAL QG 1 57 HIS HD2 . . 7.780 4.961 4.084 5.819 . 0 0 "[ . 1 . 2]" 1
1366 1 56 VAL MG1 1 57 HIS H . . 5.890 3.608 2.315 4.105 . 0 0 "[ . 1 . 2]" 1
1367 1 56 VAL MG1 1 58 LEU H . . 5.350 3.822 2.670 5.339 . 0 0 "[ . 1 . 2]" 1
1368 1 56 VAL MG2 1 57 HIS H . . 5.890 3.802 2.173 4.417 . 0 0 "[ . 1 . 2]" 1
1369 1 56 VAL MG2 1 58 LEU H . . 5.350 4.386 2.326 5.431 0.081 18 0 "[ . 1 . 2]" 1
1370 1 57 HIS H 1 57 HIS HD2 . . 5.100 3.256 2.388 4.225 . 0 0 "[ . 1 . 2]" 1
1371 1 57 HIS H 1 58 LEU H . . 4.390 3.477 2.642 3.957 . 0 0 "[ . 1 . 2]" 1
1372 1 57 HIS HA 1 57 HIS HD2 . . 4.890 3.866 2.692 4.572 . 0 0 "[ . 1 . 2]" 1
1373 1 57 HIS QB 1 75 GLU QG . . 7.590 4.829 3.437 6.668 . 0 0 "[ . 1 . 2]" 1
1374 1 57 HIS QB 1 76 ASP H . . 5.840 3.480 2.382 4.804 . 0 0 "[ . 1 . 2]" 1
1375 1 57 HIS QB 1 76 ASP QB . . 5.930 2.067 1.688 3.256 . 0 0 "[ . 1 . 2]" 1
1376 1 57 HIS HB2 1 58 LEU H . . 5.500 4.369 2.094 4.578 . 0 0 "[ . 1 . 2]" 1
1377 1 57 HIS HB2 1 76 ASP H . . 5.680 3.965 2.925 5.212 . 0 0 "[ . 1 . 2]" 1
1378 1 57 HIS HB2 1 76 ASP HB2 . . 5.800 3.650 2.635 4.764 . 0 0 "[ . 1 . 2]" 1
1379 1 57 HIS HB2 1 76 ASP HB3 . . 5.800 2.711 1.935 3.719 . 0 0 "[ . 1 . 2]" 1
1380 1 57 HIS HB3 1 58 LEU H . . 5.500 4.150 3.017 4.346 . 0 0 "[ . 1 . 2]" 1
1381 1 57 HIS HB3 1 76 ASP H . . 5.680 3.998 2.412 5.627 . 0 0 "[ . 1 . 2]" 1
1382 1 57 HIS HB3 1 76 ASP HB2 . . 5.800 2.891 2.458 4.270 . 0 0 "[ . 1 . 2]" 1
1383 1 57 HIS HB3 1 76 ASP HB3 . . 5.800 2.631 1.750 4.454 . 0 0 "[ . 1 . 2]" 1
1384 1 57 HIS HD2 1 76 ASP QB . . 6.650 4.903 4.182 5.950 . 0 0 "[ . 1 . 2]" 1
1385 1 58 LEU H 1 58 LEU HG . . 4.560 3.741 2.525 4.714 0.154 2 0 "[ . 1 . 2]" 1
1386 1 58 LEU H 1 59 LYS H . . 5.330 4.405 4.200 4.560 . 0 0 "[ . 1 . 2]" 1
1387 1 58 LEU H 1 76 ASP H . . 5.730 4.827 2.905 5.242 . 0 0 "[ . 1 . 2]" 1
1388 1 58 LEU HA 1 59 LYS H . . 3.540 2.134 2.076 2.250 . 0 0 "[ . 1 . 2]" 1
1389 1 58 LEU HA 1 59 LYS QB . . 6.380 4.375 4.220 4.709 . 0 0 "[ . 1 . 2]" 1
1390 1 58 LEU HA 1 59 LYS QD . . 6.280 5.199 3.431 6.159 . 0 0 "[ . 1 . 2]" 1
1391 1 58 LEU HA 1 59 LYS QG . . 5.680 3.643 3.200 4.132 . 0 0 "[ . 1 . 2]" 1
1392 1 58 LEU HA 1 73 VAL QG . . 7.540 4.018 3.322 4.800 . 0 0 "[ . 1 . 2]" 1
1393 1 58 LEU HA 1 74 ILE HB . . 5.830 5.154 4.874 5.640 . 0 0 "[ . 1 . 2]" 1
1394 1 58 LEU HA 1 74 ILE MG . . 6.840 5.048 4.788 5.367 . 0 0 "[ . 1 . 2]" 1
1395 1 58 LEU HA 1 75 GLU H . . 6.190 4.989 4.585 5.283 . 0 0 "[ . 1 . 2]" 1
1396 1 58 LEU HA 1 75 GLU HB2 . . 6.000 4.869 4.319 5.360 . 0 0 "[ . 1 . 2]" 1
1397 1 58 LEU HA 1 75 GLU QB . . 6.170 4.604 4.155 4.979 . 0 0 "[ . 1 . 2]" 1
1398 1 58 LEU HA 1 75 GLU HB3 . . 6.000 5.686 5.244 5.933 . 0 0 "[ . 1 . 2]" 1
1399 1 58 LEU HA 1 75 GLU QG . . 6.200 4.310 3.606 5.328 . 0 0 "[ . 1 . 2]" 1
1400 1 58 LEU HA 1 76 ASP H . . 4.350 3.090 2.545 3.609 . 0 0 "[ . 1 . 2]" 1
1401 1 58 LEU HA 1 76 ASP QB . . 6.220 3.931 3.088 4.665 . 0 0 "[ . 1 . 2]" 1
1402 1 58 LEU HA 1 82 ILE MD . . 6.900 4.819 4.431 5.437 . 0 0 "[ . 1 . 2]" 1
1403 1 58 LEU QB 1 59 LYS H . . 5.020 3.241 2.769 3.735 . 0 0 "[ . 1 . 2]" 1
1404 1 58 LEU QB 1 60 PHE HZ . . 6.230 3.155 2.710 3.832 . 0 0 "[ . 1 . 2]" 1
1405 1 58 LEU QB 1 73 VAL QG . . 7.290 2.721 1.843 4.259 . 0 0 "[ . 1 . 2]" 1
1406 1 58 LEU QD 1 59 LYS H . . 6.290 3.420 2.157 4.169 . 0 0 "[ . 1 . 2]" 1
1407 1 58 LEU QD 1 60 PHE QE . . 9.670 3.318 2.708 4.097 . 0 0 "[ . 1 . 2]" 1
1408 1 58 LEU QD 1 73 VAL HA . . 7.100 4.182 3.038 4.704 . 0 0 "[ . 1 . 2]" 1
1409 1 58 LEU QD 1 74 ILE H . . 7.010 4.062 2.613 4.809 . 0 0 "[ . 1 . 2]" 1
1410 1 58 LEU QD 1 75 GLU H . . 7.060 3.936 3.292 4.808 . 0 0 "[ . 1 . 2]" 1
1411 1 58 LEU QD 1 75 GLU HA . . 5.910 2.286 1.751 3.194 . 0 0 "[ . 1 . 2]" 1
1412 1 58 LEU QD 1 75 GLU QB . . 7.230 2.934 2.435 3.757 . 0 0 "[ . 1 . 2]" 1
1413 1 58 LEU QD 1 75 GLU QG . . 6.700 2.650 2.008 4.064 . 0 0 "[ . 1 . 2]" 1
1414 1 58 LEU QD 1 76 ASP H . . 6.380 3.271 2.676 3.929 . 0 0 "[ . 1 . 2]" 1
1415 1 58 LEU QD 1 93 PHE HZ . . 8.410 4.082 2.965 5.219 . 0 0 "[ . 1 . 2]" 1
1416 1 58 LEU MD1 1 75 GLU H . . 7.520 5.049 3.315 6.474 . 0 0 "[ . 1 . 2]" 1
1417 1 58 LEU MD2 1 75 GLU H . . 7.520 4.694 3.536 6.190 . 0 0 "[ . 1 . 2]" 1
1418 1 58 LEU HG 1 73 VAL QG . . 7.540 3.342 2.217 4.742 . 0 0 "[ . 1 . 2]" 1
1419 1 59 LYS H 1 59 LYS QG . . 5.000 2.590 2.101 3.029 . 0 0 "[ . 1 . 2]" 1
1420 1 59 LYS H 1 60 PHE H . . 5.050 4.354 4.141 4.529 . 0 0 "[ . 1 . 2]" 1
1421 1 59 LYS H 1 73 VAL HA . . 5.260 4.794 4.520 5.193 . 0 0 "[ . 1 . 2]" 1
1422 1 59 LYS H 1 73 VAL QG . . 6.990 4.048 3.367 4.545 . 0 0 "[ . 1 . 2]" 1
1423 1 59 LYS H 1 74 ILE H . . 4.070 3.208 2.894 3.448 . 0 0 "[ . 1 . 2]" 1
1424 1 59 LYS H 1 74 ILE HB . . 4.800 3.315 2.961 3.762 . 0 0 "[ . 1 . 2]" 1
1425 1 59 LYS H 1 74 ILE MD . . 6.250 5.117 4.773 5.566 . 0 0 "[ . 1 . 2]" 1
1426 1 59 LYS H 1 75 GLU H . . 5.800 4.807 4.541 4.978 . 0 0 "[ . 1 . 2]" 1
1427 1 59 LYS H 1 75 GLU HA . . 5.110 3.563 3.088 3.920 . 0 0 "[ . 1 . 2]" 1
1428 1 59 LYS H 1 75 GLU QG . . 6.080 5.572 5.009 6.158 0.078 8 0 "[ . 1 . 2]" 1
1429 1 59 LYS H 1 76 ASP H . . 4.950 3.911 3.555 4.290 . 0 0 "[ . 1 . 2]" 1
1430 1 59 LYS H 1 76 ASP QB . . 6.070 4.139 3.631 4.638 . 0 0 "[ . 1 . 2]" 1
1431 1 59 LYS HA 1 59 LYS QD . . 5.070 4.031 2.682 4.322 . 0 0 "[ . 1 . 2]" 1
1432 1 59 LYS HA 1 59 LYS HE2 . . 5.630 5.116 4.684 5.778 0.148 19 0 "[ . 1 . 2]" 1
1433 1 59 LYS HA 1 59 LYS QE . . 5.680 4.324 3.414 4.699 . 0 0 "[ . 1 . 2]" 1
1434 1 59 LYS HA 1 59 LYS HE3 . . 5.630 4.747 3.499 5.298 . 0 0 "[ . 1 . 2]" 1
1435 1 59 LYS HA 1 60 PHE H . . 3.510 2.176 2.107 2.294 . 0 0 "[ . 1 . 2]" 1
1436 1 59 LYS HA 1 60 PHE QD . . 7.530 3.842 3.518 4.221 . 0 0 "[ . 1 . 2]" 1
1437 1 59 LYS QB 1 60 PHE H . . 5.010 3.233 2.499 3.581 . 0 0 "[ . 1 . 2]" 1
1438 1 59 LYS QB 1 60 PHE HA . . 6.320 4.327 3.970 4.581 . 0 0 "[ . 1 . 2]" 1
1439 1 59 LYS QB 1 74 ILE H . . 5.880 3.604 3.330 3.932 . 0 0 "[ . 1 . 2]" 1
1440 1 59 LYS QB 1 74 ILE MD . . 5.920 3.273 2.609 3.918 . 0 0 "[ . 1 . 2]" 1
1441 1 59 LYS QB 1 74 ILE MG . . 6.680 3.156 2.665 3.549 . 0 0 "[ . 1 . 2]" 1
1442 1 59 LYS QB 1 76 ASP H . . 6.530 5.053 4.718 5.551 . 0 0 "[ . 1 . 2]" 1
1443 1 59 LYS QD 1 74 ILE MG . . 7.400 3.638 2.219 4.866 . 0 0 "[ . 1 . 2]" 1
1444 1 59 LYS QD 1 76 ASP HB2 . . 5.720 3.114 1.783 4.532 . 0 0 "[ . 1 . 2]" 1
1445 1 59 LYS QD 1 76 ASP QB . . 5.880 3.053 1.777 4.376 . 0 0 "[ . 1 . 2]" 1
1446 1 59 LYS QD 1 76 ASP HB3 . . 5.720 4.567 3.281 5.772 0.052 19 0 "[ . 1 . 2]" 1
1447 1 59 LYS QE 1 74 ILE MD . . 6.580 3.973 3.042 5.587 . 0 0 "[ . 1 . 2]" 1
1448 1 59 LYS QE 1 74 ILE MG . . 5.770 3.267 2.320 4.507 . 0 0 "[ . 1 . 2]" 1
1449 1 59 LYS QE 1 76 ASP HA . . 5.220 3.418 2.132 4.575 . 0 0 "[ . 1 . 2]" 1
1450 1 59 LYS HE2 1 74 ILE MD . . 6.320 4.863 3.407 6.543 0.223 7 0 "[ . 1 . 2]" 1
1451 1 59 LYS HE2 1 74 ILE MG . . 5.520 3.812 2.853 5.526 0.006 7 0 "[ . 1 . 2]" 1
1452 1 59 LYS HE2 1 76 ASP HA . . 5.120 3.738 2.149 5.156 0.036 19 0 "[ . 1 . 2]" 1
1453 1 59 LYS HE3 1 74 ILE MD . . 6.320 4.554 3.099 6.440 0.120 10 0 "[ . 1 . 2]" 1
1454 1 59 LYS HE3 1 74 ILE MG . . 5.520 3.818 2.413 5.528 0.008 10 0 "[ . 1 . 2]" 1
1455 1 59 LYS HE3 1 76 ASP HA . . 5.120 4.311 2.537 5.160 0.040 16 0 "[ . 1 . 2]" 1
1456 1 59 LYS QG 1 60 PHE H . . 5.260 4.214 3.837 4.662 . 0 0 "[ . 1 . 2]" 1
1457 1 59 LYS QG 1 74 ILE H . . 5.920 5.085 4.214 5.584 . 0 0 "[ . 1 . 2]" 1
1458 1 59 LYS QG 1 74 ILE MD . . 7.400 4.980 3.785 5.716 . 0 0 "[ . 1 . 2]" 1
1459 1 59 LYS QG 1 74 ILE MG . . 7.400 4.118 2.599 4.991 . 0 0 "[ . 1 . 2]" 1
1460 1 59 LYS QG 1 76 ASP H . . 5.930 4.023 3.199 4.717 . 0 0 "[ . 1 . 2]" 1
1461 1 59 LYS QG 1 76 ASP HB2 . . 5.660 2.866 2.223 3.623 . 0 0 "[ . 1 . 2]" 1
1462 1 59 LYS QG 1 76 ASP HB3 . . 5.660 4.364 3.700 5.243 . 0 0 "[ . 1 . 2]" 1
1463 1 60 PHE H 1 71 VAL QG . . 7.830 5.024 4.638 5.612 . 0 0 "[ . 1 . 2]" 1
1464 1 60 PHE H 1 73 VAL QG . . 7.540 5.084 4.341 5.686 . 0 0 "[ . 1 . 2]" 1
1465 1 60 PHE H 1 74 ILE MD . . 6.520 5.587 4.995 6.225 . 0 0 "[ . 1 . 2]" 1
1466 1 60 PHE HA 1 61 GLU H . . 3.520 2.164 2.122 2.209 . 0 0 "[ . 1 . 2]" 1
1467 1 60 PHE HA 1 61 GLU QB . . 6.320 4.217 3.999 4.468 . 0 0 "[ . 1 . 2]" 1
1468 1 60 PHE HA 1 71 VAL MG1 . . 6.520 3.305 2.908 4.016 . 0 0 "[ . 1 . 2]" 1
1469 1 60 PHE HA 1 71 VAL QG . . 6.540 3.285 2.895 3.981 . 0 0 "[ . 1 . 2]" 1
1470 1 60 PHE HA 1 71 VAL MG2 . . 6.520 5.755 5.345 6.512 . 0 0 "[ . 1 . 2]" 1
1471 1 60 PHE HA 1 72 LYS H . . 5.920 4.487 4.242 4.994 . 0 0 "[ . 1 . 2]" 1
1472 1 60 PHE HA 1 73 VAL HA . . 4.500 2.861 2.478 3.144 . 0 0 "[ . 1 . 2]" 1
1473 1 60 PHE HA 1 73 VAL MG1 . . 6.360 4.322 3.630 4.851 . 0 0 "[ . 1 . 2]" 1
1474 1 60 PHE HA 1 73 VAL QG . . 6.740 3.694 3.234 4.053 . 0 0 "[ . 1 . 2]" 1
1475 1 60 PHE HA 1 73 VAL MG2 . . 6.360 4.019 3.629 4.408 . 0 0 "[ . 1 . 2]" 1
1476 1 60 PHE HA 1 74 ILE H . . 4.890 3.328 3.080 3.642 . 0 0 "[ . 1 . 2]" 1
1477 1 60 PHE HA 1 74 ILE MD . . 6.520 4.757 4.283 5.191 . 0 0 "[ . 1 . 2]" 1
1478 1 60 PHE QB 1 71 VAL QG . . 6.990 2.191 1.806 2.780 . 0 0 "[ . 1 . 2]" 1
1479 1 60 PHE HB2 1 61 GLU H . . 5.400 4.227 4.079 4.335 . 0 0 "[ . 1 . 2]" 1
1480 1 60 PHE HB3 1 61 GLU H . . 5.400 3.383 3.171 3.580 . 0 0 "[ . 1 . 2]" 1
1481 1 60 PHE QD 1 61 GLU H . . 7.950 4.234 4.074 4.370 . 0 0 "[ . 1 . 2]" 1
1482 1 60 PHE QD 1 71 VAL QG . . 8.400 2.411 1.925 2.827 . 0 0 "[ . 1 . 2]" 1
1483 1 60 PHE QD 1 73 VAL HA . . 8.040 2.968 2.378 3.786 . 0 0 "[ . 1 . 2]" 1
1484 1 60 PHE QD 1 73 VAL MG1 . . 8.650 3.461 3.003 4.050 . 0 0 "[ . 1 . 2]" 1
1485 1 60 PHE QD 1 73 VAL QG . . 8.410 2.191 1.843 2.551 . 0 0 "[ . 1 . 2]" 1
1486 1 60 PHE QD 1 73 VAL MG2 . . 8.650 2.217 1.860 2.596 . 0 0 "[ . 1 . 2]" 1
1487 1 60 PHE QD 1 85 ILE MD . . 8.130 4.409 3.804 5.661 . 0 0 "[ . 1 . 2]" 1
1488 1 60 PHE QD 1 97 MET ME . . 8.650 5.228 3.932 6.419 . 0 0 "[ . 1 . 2]" 1
1489 1 60 PHE QE 1 73 VAL MG1 . . 8.520 2.688 2.188 3.455 . 0 0 "[ . 1 . 2]" 1
1490 1 60 PHE QE 1 73 VAL QG . . 8.520 2.008 1.828 2.281 . 0 0 "[ . 1 . 2]" 1
1491 1 60 PHE QE 1 73 VAL MG2 . . 8.520 2.102 1.952 2.363 . 0 0 "[ . 1 . 2]" 1
1492 1 60 PHE QE 1 85 ILE MD . . 7.880 4.007 2.862 5.118 . 0 0 "[ . 1 . 2]" 1
1493 1 60 PHE QE 1 90 TRP HH2 . . 7.900 4.286 2.862 5.634 . 0 0 "[ . 1 . 2]" 1
1494 1 60 PHE QE 1 97 MET ME . . 8.690 3.613 2.701 4.686 . 0 0 "[ . 1 . 2]" 1
1495 1 60 PHE HZ 1 93 PHE QE . . 7.810 3.688 2.630 4.473 . 0 0 "[ . 1 . 2]" 1
1496 1 60 PHE HZ 1 93 PHE HZ . . 4.530 3.307 1.890 4.504 . 0 0 "[ . 1 . 2]" 1
1497 1 60 PHE HZ 1 97 MET ME . . 5.360 3.127 1.946 3.967 . 0 0 "[ . 1 . 2]" 1
1498 1 61 GLU H 1 71 VAL MG1 . . 6.520 3.212 2.826 3.663 . 0 0 "[ . 1 . 2]" 1
1499 1 61 GLU H 1 71 VAL QG . . 6.260 3.185 2.810 3.623 . 0 0 "[ . 1 . 2]" 1
1500 1 61 GLU H 1 71 VAL MG2 . . 6.520 5.288 4.894 5.729 . 0 0 "[ . 1 . 2]" 1
1501 1 61 GLU H 1 72 LYS H . . 4.360 2.956 2.617 3.312 . 0 0 "[ . 1 . 2]" 1
1502 1 61 GLU H 1 72 LYS QB . . 5.660 3.291 2.508 4.723 . 0 0 "[ . 1 . 2]" 1
1503 1 61 GLU H 1 72 LYS HD2 . . 5.880 5.873 5.118 6.037 0.157 6 0 "[ . 1 . 2]" 1
1504 1 61 GLU H 1 72 LYS HD3 . . 5.880 4.965 4.545 5.922 0.042 5 0 "[ . 1 . 2]" 1
1505 1 61 GLU H 1 73 VAL HA . . 5.150 4.059 3.482 4.421 . 0 0 "[ . 1 . 2]" 1
1506 1 61 GLU H 1 73 VAL QG . . 7.540 4.689 4.269 5.041 . 0 0 "[ . 1 . 2]" 1
1507 1 61 GLU H 1 74 ILE MD . . 6.350 4.138 3.349 4.571 . 0 0 "[ . 1 . 2]" 1
1508 1 61 GLU HA 1 62 LEU H . . 3.430 2.177 2.148 2.302 . 0 0 "[ . 1 . 2]" 1
1509 1 61 GLU HA 1 74 ILE MD . . 6.170 5.085 4.532 5.611 . 0 0 "[ . 1 . 2]" 1
1510 1 61 GLU QB 1 63 HIS HD2 . . 5.050 2.072 1.707 2.829 . 0 0 "[ . 1 . 2]" 1
1511 1 61 GLU QB 1 72 LYS H . . 5.780 3.613 3.166 4.080 . 0 0 "[ . 1 . 2]" 1
1512 1 61 GLU QB 1 72 LYS QD . . 5.990 2.944 2.477 3.824 . 0 0 "[ . 1 . 2]" 1
1513 1 61 GLU QB 1 74 ILE MD . . 5.580 2.964 2.161 3.624 . 0 0 "[ . 1 . 2]" 1
1514 1 61 GLU HB2 1 62 LEU H . . 4.820 4.237 3.968 4.378 . 0 0 "[ . 1 . 2]" 1
1515 1 61 GLU HB2 1 63 HIS HD2 . . 4.900 3.034 2.113 4.157 . 0 0 "[ . 1 . 2]" 1
1516 1 61 GLU HB2 1 72 LYS HD2 . . 5.780 4.619 3.389 5.287 . 0 0 "[ . 1 . 2]" 1
1517 1 61 GLU HB2 1 72 LYS HD3 . . 5.780 3.432 2.555 4.364 . 0 0 "[ . 1 . 2]" 1
1518 1 61 GLU HB2 1 74 ILE MD . . 5.450 3.051 2.185 3.749 . 0 0 "[ . 1 . 2]" 1
1519 1 61 GLU HB3 1 62 LEU H . . 4.820 3.223 2.756 3.880 . 0 0 "[ . 1 . 2]" 1
1520 1 61 GLU HB3 1 63 HIS HD2 . . 4.900 2.170 1.734 3.256 . 0 0 "[ . 1 . 2]" 1
1521 1 61 GLU HB3 1 72 LYS HD2 . . 5.780 4.647 3.266 5.934 0.154 5 0 "[ . 1 . 2]" 1
1522 1 61 GLU HB3 1 72 LYS HD3 . . 5.780 3.767 2.902 4.973 . 0 0 "[ . 1 . 2]" 1
1523 1 61 GLU HB3 1 74 ILE MD . . 5.450 4.078 2.996 4.807 . 0 0 "[ . 1 . 2]" 1
1524 1 61 GLU QG 1 62 LEU H . . 5.490 3.916 2.736 4.507 . 0 0 "[ . 1 . 2]" 1
1525 1 61 GLU QG 1 63 HIS HD2 . . 6.110 3.860 2.756 4.683 . 0 0 "[ . 1 . 2]" 1
1526 1 61 GLU QG 1 74 ILE MD . . 6.120 2.755 1.906 3.552 . 0 0 "[ . 1 . 2]" 1
1527 1 62 LEU H 1 62 LEU HB2 . . 4.110 2.809 2.641 2.968 . 0 0 "[ . 1 . 2]" 1
1528 1 62 LEU H 1 62 LEU HB3 . . 4.110 2.484 2.410 2.554 . 0 0 "[ . 1 . 2]" 1
1529 1 62 LEU H 1 62 LEU HG . . 4.930 4.434 4.372 4.497 . 0 0 "[ . 1 . 2]" 1
1530 1 62 LEU H 1 71 VAL MG1 . . 7.520 4.588 3.999 5.379 . 0 0 "[ . 1 . 2]" 1
1531 1 62 LEU H 1 71 VAL QG . . 7.750 4.262 3.752 4.969 . 0 0 "[ . 1 . 2]" 1
1532 1 62 LEU H 1 71 VAL MG2 . . 7.520 5.067 4.413 5.843 . 0 0 "[ . 1 . 2]" 1
1533 1 62 LEU HA 1 71 VAL QG . . 6.720 3.139 2.649 3.704 . 0 0 "[ . 1 . 2]" 1
1534 1 62 LEU QB 1 63 HIS H . . 5.180 3.906 3.771 3.998 . 0 0 "[ . 1 . 2]" 1
1535 1 62 LEU QB 1 71 VAL QG . . 7.770 3.227 2.749 3.988 . 0 0 "[ . 1 . 2]" 1
1536 1 62 LEU HB2 1 63 HIS H . . 5.010 4.406 4.221 4.518 . 0 0 "[ . 1 . 2]" 1
1537 1 62 LEU HB3 1 63 HIS H . . 5.010 4.364 4.245 4.461 . 0 0 "[ . 1 . 2]" 1
1538 1 62 LEU QD 1 63 HIS H . . 6.170 2.837 2.283 3.271 . 0 0 "[ . 1 . 2]" 1
1539 1 62 LEU QD 1 63 HIS HA . . 7.190 4.288 3.968 4.493 . 0 0 "[ . 1 . 2]" 1
1540 1 62 LEU QD 1 64 ASP QB . . 7.830 4.158 3.719 4.832 . 0 0 "[ . 1 . 2]" 1
1541 1 62 LEU QD 1 69 TYR HA . . 7.170 3.828 3.427 4.291 . 0 0 "[ . 1 . 2]" 1
1542 1 62 LEU QD 1 69 TYR QB . . 6.960 2.207 1.767 2.631 . 0 0 "[ . 1 . 2]" 1
1543 1 62 LEU QD 1 69 TYR QD . . 8.450 2.766 1.753 3.619 . 0 0 "[ . 1 . 2]" 1
1544 1 62 LEU QD 1 69 TYR QE . . 9.150 4.225 3.082 4.932 . 0 0 "[ . 1 . 2]" 1
1545 1 62 LEU QD 1 70 TYR H . . 6.650 3.199 2.619 3.716 . 0 0 "[ . 1 . 2]" 1
1546 1 62 LEU QD 1 71 VAL H . . 8.500 3.963 3.681 4.330 . 0 0 "[ . 1 . 2]" 1
1547 1 62 LEU MD1 1 63 HIS H . . 6.300 2.857 2.289 3.308 . 0 0 "[ . 1 . 2]" 1
1548 1 62 LEU MD1 1 69 TYR HA . . 6.950 3.911 3.497 4.379 . 0 0 "[ . 1 . 2]" 1
1549 1 62 LEU MD1 1 69 TYR HB2 . . 6.520 2.325 1.785 2.784 . 0 0 "[ . 1 . 2]" 1
1550 1 62 LEU MD1 1 69 TYR HB3 . . 6.520 3.576 1.940 4.274 . 0 0 "[ . 1 . 2]" 1
1551 1 62 LEU MD1 1 69 TYR QD . . 8.430 2.889 1.798 4.016 . 0 0 "[ . 1 . 2]" 1
1552 1 62 LEU MD1 1 69 TYR QE . . 8.990 4.642 3.559 5.717 . 0 0 "[ . 1 . 2]" 1
1553 1 62 LEU MD1 1 70 TYR H . . 6.710 3.222 2.627 3.754 . 0 0 "[ . 1 . 2]" 1
1554 1 62 LEU MD2 1 63 HIS H . . 6.300 4.882 4.577 5.157 . 0 0 "[ . 1 . 2]" 1
1555 1 62 LEU MD2 1 69 TYR HA . . 6.950 5.469 4.884 6.161 . 0 0 "[ . 1 . 2]" 1
1556 1 62 LEU MD2 1 69 TYR HB2 . . 6.520 3.490 2.823 3.992 . 0 0 "[ . 1 . 2]" 1
1557 1 62 LEU MD2 1 69 TYR HB3 . . 6.520 4.283 3.021 4.909 . 0 0 "[ . 1 . 2]" 1
1558 1 62 LEU MD2 1 69 TYR QD . . 8.430 3.746 2.326 4.368 . 0 0 "[ . 1 . 2]" 1
1559 1 62 LEU MD2 1 69 TYR QE . . 8.990 4.902 3.376 5.715 . 0 0 "[ . 1 . 2]" 1
1560 1 62 LEU MD2 1 70 TYR H . . 6.710 5.496 5.038 5.961 . 0 0 "[ . 1 . 2]" 1
1561 1 62 LEU HG 1 63 HIS H . . 5.180 3.574 3.221 3.941 . 0 0 "[ . 1 . 2]" 1
1562 1 62 LEU HG 1 64 ASP HB2 . . 5.880 5.957 5.887 6.058 0.178 9 0 "[ . 1 . 2]" 1
1563 1 62 LEU HG 1 64 ASP QB . . 5.970 4.320 4.099 5.295 . 0 0 "[ . 1 . 2]" 1
1564 1 62 LEU HG 1 64 ASP HB3 . . 5.880 4.454 4.181 5.943 0.063 10 0 "[ . 1 . 2]" 1
1565 1 62 LEU HG 1 69 TYR QD . . 8.030 4.576 3.218 5.377 . 0 0 "[ . 1 . 2]" 1
1566 1 63 HIS H 1 63 HIS HD2 . . 5.530 3.719 3.218 4.247 . 0 0 "[ . 1 . 2]" 1
1567 1 63 HIS H 1 64 ASP H . . 5.200 4.332 4.130 4.485 . 0 0 "[ . 1 . 2]" 1
1568 1 63 HIS H 1 69 TYR HA . . 6.150 4.850 4.481 5.241 . 0 0 "[ . 1 . 2]" 1
1569 1 63 HIS H 1 70 TYR H . . 4.830 3.449 3.196 3.911 . 0 0 "[ . 1 . 2]" 1
1570 1 63 HIS H 1 71 VAL QG . . 7.540 4.362 3.897 4.772 . 0 0 "[ . 1 . 2]" 1
1571 1 63 HIS H 1 72 LYS H . . 5.580 3.901 3.533 4.266 . 0 0 "[ . 1 . 2]" 1
1572 1 63 HIS HA 1 64 ASP H . . 3.370 2.165 2.049 2.756 . 0 0 "[ . 1 . 2]" 1
1573 1 63 HIS QB 1 64 ASP H . . 5.080 3.038 1.836 3.553 . 0 0 "[ . 1 . 2]" 1
1574 1 63 HIS QB 1 70 TYR H . . 5.640 4.312 3.964 4.759 . 0 0 "[ . 1 . 2]" 1
1575 1 63 HIS QB 1 70 TYR QE . . 8.910 3.766 2.615 6.572 . 0 0 "[ . 1 . 2]" 1
1576 1 63 HIS QB 1 72 LYS QD . . 6.260 2.510 1.783 3.989 . 0 0 "[ . 1 . 2]" 1
1577 1 63 HIS HB2 1 64 ASP H . . 4.780 4.198 3.179 4.512 . 0 0 "[ . 1 . 2]" 1
1578 1 63 HIS HB2 1 70 TYR H . . 5.500 4.640 4.250 5.183 . 0 0 "[ . 1 . 2]" 1
1579 1 63 HIS HB3 1 64 ASP H . . 4.780 3.124 1.848 3.718 . 0 0 "[ . 1 . 2]" 1
1580 1 63 HIS HB3 1 70 TYR H . . 5.500 5.142 4.741 5.543 0.043 20 0 "[ . 1 . 2]" 1
1581 1 63 HIS HD2 1 72 LYS H . . 5.480 4.448 4.016 5.299 . 0 0 "[ . 1 . 2]" 1
1582 1 63 HIS HD2 1 72 LYS HD2 . . 5.560 3.058 1.960 3.713 . 0 0 "[ . 1 . 2]" 1
1583 1 63 HIS HD2 1 72 LYS HD3 . . 5.560 2.706 1.977 4.670 . 0 0 "[ . 1 . 2]" 1
1584 1 63 HIS HD2 1 72 LYS HE2 . . 5.850 4.620 3.488 5.230 . 0 0 "[ . 1 . 2]" 1
1585 1 63 HIS HD2 1 72 LYS QE . . 5.890 4.195 3.262 4.857 . 0 0 "[ . 1 . 2]" 1
1586 1 63 HIS HD2 1 72 LYS HE3 . . 5.850 4.971 3.336 5.831 . 0 0 "[ . 1 . 2]" 1
1587 1 63 HIS HD2 1 72 LYS QG . . 6.380 3.040 2.213 3.907 . 0 0 "[ . 1 . 2]" 1
1588 1 63 HIS HD2 1 74 ILE MD . . 7.480 4.587 3.706 5.571 . 0 0 "[ . 1 . 2]" 1
1589 1 64 ASP H 1 64 ASP HB2 . . 4.190 3.670 3.571 3.766 . 0 0 "[ . 1 . 2]" 1
1590 1 64 ASP H 1 64 ASP HB3 . . 4.190 2.745 2.556 2.987 . 0 0 "[ . 1 . 2]" 1
1591 1 64 ASP HA 1 65 LYS HB2 . . 5.960 5.140 4.103 5.733 . 0 0 "[ . 1 . 2]" 1
1592 1 64 ASP HA 1 65 LYS HB3 . . 5.960 4.411 4.089 4.881 . 0 0 "[ . 1 . 2]" 1
1593 1 64 ASP HA 1 68 GLU H . . 5.580 5.256 4.836 5.642 0.062 9 0 "[ . 1 . 2]" 1
1594 1 64 ASP HA 1 69 TYR H . . 5.850 4.522 4.194 4.868 . 0 0 "[ . 1 . 2]" 1
1595 1 64 ASP HA 1 69 TYR HA . . 4.150 1.946 1.743 2.683 . 0 0 "[ . 1 . 2]" 1
1596 1 64 ASP HA 1 69 TYR QD . . 7.220 4.203 2.947 4.927 . 0 0 "[ . 1 . 2]" 1
1597 1 64 ASP HA 1 70 TYR H . . 5.300 3.291 2.432 4.286 . 0 0 "[ . 1 . 2]" 1
1598 1 64 ASP QB 1 65 LYS H . . 5.120 2.700 2.058 3.333 . 0 0 "[ . 1 . 2]" 1
1599 1 64 ASP QB 1 69 TYR QD . . 7.690 3.295 1.974 4.349 . 0 0 "[ . 1 . 2]" 1
1600 1 64 ASP QB 1 70 TYR H . . 6.220 4.694 4.181 5.790 . 0 0 "[ . 1 . 2]" 1
1601 1 64 ASP HB2 1 65 LYS H . . 4.900 2.752 2.071 3.461 . 0 0 "[ . 1 . 2]" 1
1602 1 64 ASP HB2 1 69 TYR HA . . 5.400 3.670 2.950 4.996 . 0 0 "[ . 1 . 2]" 1
1603 1 64 ASP HB2 1 69 TYR QD . . 7.470 3.620 2.276 4.983 . 0 0 "[ . 1 . 2]" 1
1604 1 64 ASP HB2 1 69 TYR QE . . 7.400 5.564 3.085 6.979 . 0 0 "[ . 1 . 2]" 1
1605 1 64 ASP HB3 1 65 LYS H . . 4.900 3.974 3.567 4.349 . 0 0 "[ . 1 . 2]" 1
1606 1 64 ASP HB3 1 69 TYR HA . . 5.400 3.710 2.950 4.750 . 0 0 "[ . 1 . 2]" 1
1607 1 64 ASP HB3 1 69 TYR QD . . 7.470 3.868 2.065 4.929 . 0 0 "[ . 1 . 2]" 1
1608 1 64 ASP HB3 1 69 TYR QE . . 7.400 5.813 3.530 6.824 . 0 0 "[ . 1 . 2]" 1
1609 1 65 LYS H 1 65 LYS QD . . 6.190 4.484 3.585 5.290 . 0 0 "[ . 1 . 2]" 1
1610 1 65 LYS H 1 65 LYS HG2 . . 5.390 3.328 1.939 4.765 . 0 0 "[ . 1 . 2]" 1
1611 1 65 LYS H 1 65 LYS HG3 . . 5.390 3.908 3.024 4.912 . 0 0 "[ . 1 . 2]" 1
1612 1 65 LYS H 1 66 LEU H . . 5.530 3.688 2.189 4.208 . 0 0 "[ . 1 . 2]" 1
1613 1 65 LYS H 1 68 GLU H . . 4.470 3.443 2.912 4.342 . 0 0 "[ . 1 . 2]" 1
1614 1 65 LYS H 1 69 TYR HA . . 5.140 3.241 2.852 3.732 . 0 0 "[ . 1 . 2]" 1
1615 1 65 LYS H 1 69 TYR QD . . 8.350 4.778 4.225 5.844 . 0 0 "[ . 1 . 2]" 1
1616 1 65 LYS H 1 70 TYR QD . . 8.060 4.860 3.865 6.218 . 0 0 "[ . 1 . 2]" 1
1617 1 65 LYS H 1 70 TYR QE . . 7.730 4.898 3.595 6.158 . 0 0 "[ . 1 . 2]" 1
1618 1 65 LYS HA 1 65 LYS QE . . 6.080 4.629 1.819 5.689 . 0 0 "[ . 1 . 2]" 1
1619 1 65 LYS HA 1 65 LYS HG2 . . 4.220 3.581 2.821 3.861 . 0 0 "[ . 1 . 2]" 1
1620 1 65 LYS HA 1 65 LYS HG3 . . 4.220 3.316 2.474 3.925 . 0 0 "[ . 1 . 2]" 1
1621 1 65 LYS QB 1 66 LEU H . . 5.060 2.930 1.780 4.051 . 0 0 "[ . 1 . 2]" 1
1622 1 65 LYS QB 1 67 ASN H . . 6.080 4.392 2.881 5.161 . 0 0 "[ . 1 . 2]" 1
1623 1 65 LYS QB 1 68 GLU H . . 5.570 4.087 2.534 4.829 . 0 0 "[ . 1 . 2]" 1
1624 1 65 LYS QB 1 70 TYR QD . . 8.000 4.273 2.399 6.334 . 0 0 "[ . 1 . 2]" 1
1625 1 65 LYS HB2 1 66 LEU H . . 4.900 3.402 1.800 4.617 . 0 0 "[ . 1 . 2]" 1
1626 1 65 LYS HB2 1 67 ASN H . . 6.010 5.199 4.373 5.913 . 0 0 "[ . 1 . 2]" 1
1627 1 65 LYS HB2 1 68 GLU H . . 5.400 5.012 3.958 5.434 0.034 6 0 "[ . 1 . 2]" 1
1628 1 65 LYS HB2 1 70 TYR QD . . 7.850 5.296 2.475 7.590 . 0 0 "[ . 1 . 2]" 1
1629 1 65 LYS HB2 1 70 TYR QE . . 6.610 4.083 2.122 6.324 . 0 0 "[ . 1 . 2]" 1
1630 1 65 LYS HB3 1 66 LEU H . . 4.900 3.705 1.787 4.573 . 0 0 "[ . 1 . 2]" 1
1631 1 65 LYS HB3 1 67 ASN H . . 6.010 5.063 2.910 6.077 0.067 6 0 "[ . 1 . 2]" 1
1632 1 65 LYS HB3 1 68 GLU H . . 5.400 4.523 2.565 5.539 0.139 15 0 "[ . 1 . 2]" 1
1633 1 65 LYS HB3 1 70 TYR QD . . 7.850 4.662 3.220 6.784 . 0 0 "[ . 1 . 2]" 1
1634 1 65 LYS HB3 1 70 TYR QE . . 6.610 3.643 2.122 5.665 . 0 0 "[ . 1 . 2]" 1
1635 1 65 LYS QD 1 66 LEU H . . 6.930 4.707 3.344 5.723 . 0 0 "[ . 1 . 2]" 1
1636 1 65 LYS QD 1 68 GLU H . . 6.360 4.653 2.652 5.890 . 0 0 "[ . 1 . 2]" 1
1637 1 65 LYS QD 1 70 TYR QD . . 9.120 4.029 2.793 5.638 . 0 0 "[ . 1 . 2]" 1
1638 1 65 LYS QD 1 70 TYR QE . . 8.530 2.780 1.761 3.930 . 0 0 "[ . 1 . 2]" 1
1639 1 65 LYS QE 1 66 LEU H . . 6.700 5.042 2.734 6.551 . 0 0 "[ . 1 . 2]" 1
1640 1 65 LYS QE 1 66 LEU QD . . 7.150 4.421 2.660 5.833 . 0 0 "[ . 1 . 2]" 1
1641 1 65 LYS QE 1 68 GLU H . . 6.650 5.053 2.907 6.220 . 0 0 "[ . 1 . 2]" 1
1642 1 65 LYS QE 1 70 TYR QD . . 8.300 4.600 2.885 6.519 . 0 0 "[ . 1 . 2]" 1
1643 1 65 LYS QE 1 70 TYR QE . . 8.170 3.434 1.732 5.166 . 0 0 "[ . 1 . 2]" 1
1644 1 65 LYS QG 1 66 LEU QB . . 5.890 2.884 2.314 3.247 . 0 0 "[ . 1 . 2]" 1
1645 1 65 LYS QG 1 67 ASN H . . 7.150 3.543 2.040 4.521 . 0 0 "[ . 1 . 2]" 1
1646 1 65 LYS QG 1 68 GLU H . . 6.250 3.416 2.194 4.581 . 0 0 "[ . 1 . 2]" 1
1647 1 65 LYS QG 1 70 TYR QD . . 8.330 4.277 2.694 6.036 . 0 0 "[ . 1 . 2]" 1
1648 1 65 LYS HG2 1 66 LEU H . . 5.230 4.016 2.336 5.233 0.003 15 0 "[ . 1 . 2]" 1
1649 1 65 LYS HG2 1 66 LEU HB2 . . 5.320 4.192 2.723 5.293 . 0 0 "[ . 1 . 2]" 1
1650 1 65 LYS HG2 1 66 LEU HB3 . . 5.320 4.668 2.879 5.510 0.190 19 0 "[ . 1 . 2]" 1
1651 1 65 LYS HG2 1 68 GLU H . . 6.110 3.834 2.462 4.782 . 0 0 "[ . 1 . 2]" 1
1652 1 65 LYS HG2 1 70 TYR QD . . 8.170 4.592 2.729 6.857 . 0 0 "[ . 1 . 2]" 1
1653 1 65 LYS HG3 1 66 LEU H . . 5.230 3.656 2.063 4.888 . 0 0 "[ . 1 . 2]" 1
1654 1 65 LYS HG3 1 66 LEU HB2 . . 5.320 3.628 2.350 4.935 . 0 0 "[ . 1 . 2]" 1
1655 1 65 LYS HG3 1 66 LEU HB3 . . 5.320 4.208 3.151 5.417 0.097 13 0 "[ . 1 . 2]" 1
1656 1 65 LYS HG3 1 68 GLU H . . 6.110 4.113 2.463 5.937 . 0 0 "[ . 1 . 2]" 1
1657 1 65 LYS HG3 1 70 TYR QD . . 8.170 5.482 4.150 6.699 . 0 0 "[ . 1 . 2]" 1
1658 1 66 LEU H 1 66 LEU HG . . 4.470 4.265 2.219 4.679 0.209 18 0 "[ . 1 . 2]" 1
1659 1 66 LEU H 1 67 ASN H . . 4.380 3.475 2.204 4.147 . 0 0 "[ . 1 . 2]" 1
1660 1 66 LEU HA 1 66 LEU HG . . 4.050 2.741 2.358 3.666 . 0 0 "[ . 1 . 2]" 1
1661 1 66 LEU HA 1 68 GLU H . . 5.310 4.903 4.366 5.283 . 0 0 "[ . 1 . 2]" 1
1662 1 66 LEU QB 1 67 ASN HA . . 6.080 4.256 4.026 4.538 . 0 0 "[ . 1 . 2]" 1
1663 1 66 LEU QB 1 67 ASN QB . . 6.780 3.358 2.987 3.986 . 0 0 "[ . 1 . 2]" 1
1664 1 66 LEU QB 1 68 GLU H . . 5.480 3.384 2.975 3.827 . 0 0 "[ . 1 . 2]" 1
1665 1 66 LEU HB2 1 67 ASN H . . 4.220 3.067 2.088 3.665 . 0 0 "[ . 1 . 2]" 1
1666 1 66 LEU HB2 1 67 ASN HA . . 5.950 5.499 4.726 5.866 . 0 0 "[ . 1 . 2]" 1
1667 1 66 LEU HB2 1 67 ASN QB . . 6.770 4.694 3.730 5.340 . 0 0 "[ . 1 . 2]" 1
1668 1 66 LEU HB2 1 68 GLU H . . 5.320 4.399 3.098 5.137 . 0 0 "[ . 1 . 2]" 1
1669 1 66 LEU HB3 1 67 ASN H . . 4.220 2.099 1.725 2.872 . 0 0 "[ . 1 . 2]" 1
1670 1 66 LEU HB3 1 67 ASN HA . . 5.950 4.452 4.190 4.724 . 0 0 "[ . 1 . 2]" 1
1671 1 66 LEU HB3 1 67 ASN QB . . 6.770 3.451 3.085 4.114 . 0 0 "[ . 1 . 2]" 1
1672 1 66 LEU HB3 1 68 GLU H . . 5.320 3.699 3.142 4.548 . 0 0 "[ . 1 . 2]" 1
1673 1 66 LEU QD 1 67 ASN H . . 6.690 3.250 2.332 3.840 . 0 0 "[ . 1 . 2]" 1
1674 1 66 LEU MD1 1 67 ASN H . . 6.310 4.119 3.763 4.457 . 0 0 "[ . 1 . 2]" 1
1675 1 66 LEU MD2 1 67 ASN H . . 6.310 3.474 2.345 4.456 . 0 0 "[ . 1 . 2]" 1
1676 1 66 LEU HG 1 67 ASN H . . 5.020 4.123 3.088 4.716 . 0 0 "[ . 1 . 2]" 1
1677 1 67 ASN H 1 68 GLU H . . 3.810 1.800 1.719 2.029 . 0 0 "[ . 1 . 2]" 1
1678 1 67 ASN H 1 68 GLU QG . . 6.800 3.534 2.650 4.132 . 0 0 "[ . 1 . 2]" 1
1679 1 67 ASN QB 1 68 GLU H . . 5.430 3.171 2.544 3.966 . 0 0 "[ . 1 . 2]" 1
1680 1 68 GLU H 1 68 GLU HG2 . . 4.410 3.269 2.001 4.204 . 0 0 "[ . 1 . 2]" 1
1681 1 68 GLU H 1 68 GLU HG3 . . 4.410 3.364 2.243 4.207 . 0 0 "[ . 1 . 2]" 1
1682 1 68 GLU HA 1 68 GLU HG2 . . 3.980 3.133 2.466 3.807 . 0 0 "[ . 1 . 2]" 1
1683 1 68 GLU HA 1 68 GLU HG3 . . 3.980 3.319 2.422 4.183 0.203 15 0 "[ . 1 . 2]" 1
1684 1 68 GLU HA 1 69 TYR H . . 3.390 2.302 2.139 2.506 . 0 0 "[ . 1 . 2]" 1
1685 1 68 GLU HA 1 69 TYR QD . . 7.720 3.715 2.906 4.277 . 0 0 "[ . 1 . 2]" 1
1686 1 68 GLU HA 1 69 TYR QE . . 7.620 4.538 4.201 4.976 . 0 0 "[ . 1 . 2]" 1
1687 1 68 GLU QB 1 70 TYR QD . . 7.850 3.317 2.434 4.368 . 0 0 "[ . 1 . 2]" 1
1688 1 68 GLU HB2 1 69 TYR H . . 4.310 3.641 2.536 4.393 0.083 2 0 "[ . 1 . 2]" 1
1689 1 68 GLU HB2 1 69 TYR QE . . 8.350 6.876 5.726 7.344 . 0 0 "[ . 1 . 2]" 1
1690 1 68 GLU HB2 1 70 TYR QD . . 7.630 3.811 2.988 4.917 . 0 0 "[ . 1 . 2]" 1
1691 1 68 GLU HB2 1 70 TYR QE . . 7.380 4.667 3.389 6.466 . 0 0 "[ . 1 . 2]" 1
1692 1 68 GLU HB3 1 69 TYR H . . 4.310 2.860 2.072 4.017 . 0 0 "[ . 1 . 2]" 1
1693 1 68 GLU HB3 1 69 TYR QE . . 8.350 6.264 5.412 6.945 . 0 0 "[ . 1 . 2]" 1
1694 1 68 GLU HB3 1 70 TYR QD . . 7.630 3.845 2.578 5.300 . 0 0 "[ . 1 . 2]" 1
1695 1 68 GLU HB3 1 70 TYR QE . . 7.380 5.286 3.357 6.850 . 0 0 "[ . 1 . 2]" 1
1696 1 68 GLU QG 1 70 TYR QE . . 8.360 5.619 3.030 7.896 . 0 0 "[ . 1 . 2]" 1
1697 1 68 GLU HG2 1 69 TYR H . . 4.860 4.673 3.954 4.946 0.086 16 0 "[ . 1 . 2]" 1
1698 1 68 GLU HG3 1 69 TYR H . . 4.860 4.684 4.090 5.019 0.159 2 0 "[ . 1 . 2]" 1
1699 1 69 TYR H 1 69 TYR QE . . 7.250 4.208 3.760 4.546 . 0 0 "[ . 1 . 2]" 1
1700 1 69 TYR H 1 70 TYR H . . 4.880 4.202 3.852 4.391 . 0 0 "[ . 1 . 2]" 1
1701 1 69 TYR H 1 87 PRO HG2 . . 5.930 4.393 3.300 5.401 . 0 0 "[ . 1 . 2]" 1
1702 1 69 TYR H 1 87 PRO QG . . 6.000 3.115 1.774 4.011 . 0 0 "[ . 1 . 2]" 1
1703 1 69 TYR H 1 87 PRO HG3 . . 5.930 3.318 1.782 5.159 . 0 0 "[ . 1 . 2]" 1
1704 1 69 TYR HA 1 70 TYR QD . . 7.600 3.743 3.036 4.687 . 0 0 "[ . 1 . 2]" 1
1705 1 69 TYR HB2 1 70 TYR H . . 5.110 3.456 2.592 4.318 . 0 0 "[ . 1 . 2]" 1
1706 1 69 TYR HB3 1 70 TYR H . . 5.110 3.987 3.450 4.288 . 0 0 "[ . 1 . 2]" 1
1707 1 69 TYR QD 1 70 TYR H . . 7.360 4.571 3.984 4.991 . 0 0 "[ . 1 . 2]" 1
1708 1 69 TYR QD 1 87 PRO HA . . 7.010 5.754 4.659 6.906 . 0 0 "[ . 1 . 2]" 1
1709 1 69 TYR QD 1 87 PRO HG2 . . 7.450 5.088 2.109 6.238 . 0 0 "[ . 1 . 2]" 1
1710 1 69 TYR QD 1 87 PRO HG3 . . 7.450 3.862 2.666 4.780 . 0 0 "[ . 1 . 2]" 1
1711 1 69 TYR QE 1 87 PRO HB2 . . 6.980 4.931 3.481 6.697 . 0 0 "[ . 1 . 2]" 1
1712 1 69 TYR QE 1 87 PRO QB . . 7.220 4.023 2.935 5.861 . 0 0 "[ . 1 . 2]" 1
1713 1 69 TYR QE 1 87 PRO HB3 . . 6.980 4.299 3.118 6.475 . 0 0 "[ . 1 . 2]" 1
1714 1 69 TYR QE 1 87 PRO QG . . 7.890 4.163 2.384 5.923 . 0 0 "[ . 1 . 2]" 1
1715 1 70 TYR HA 1 87 PRO HD2 . . 5.210 4.049 3.535 4.741 . 0 0 "[ . 1 . 2]" 1
1716 1 70 TYR HA 1 87 PRO HD3 . . 5.210 2.428 1.886 3.049 . 0 0 "[ . 1 . 2]" 1
1717 1 70 TYR HA 1 87 PRO QG . . 5.890 3.836 2.711 4.599 . 0 0 "[ . 1 . 2]" 1
1718 1 70 TYR QB 1 71 VAL H . . 5.090 2.343 2.007 3.650 . 0 0 "[ . 1 . 2]" 1
1719 1 70 TYR QB 1 87 PRO QD . . 7.390 2.388 1.767 4.677 . 0 0 "[ . 1 . 2]" 1
1720 1 70 TYR HB2 1 71 VAL H . . 4.910 2.412 2.020 4.548 . 0 0 "[ . 1 . 2]" 1
1721 1 70 TYR HB3 1 71 VAL H . . 4.910 3.652 3.437 3.846 . 0 0 "[ . 1 . 2]" 1
1722 1 70 TYR QD 1 71 VAL H . . 7.270 3.298 2.729 4.116 . 0 0 "[ . 1 . 2]" 1
1723 1 70 TYR QD 1 72 LYS QD . . 8.350 4.515 3.733 5.562 . 0 0 "[ . 1 . 2]" 1
1724 1 70 TYR QD 1 72 LYS QE . . 8.350 5.001 2.601 5.723 . 0 0 "[ . 1 . 2]" 1
1725 1 70 TYR QD 1 72 LYS QG . . 8.510 3.457 2.357 5.311 . 0 0 "[ . 1 . 2]" 1
1726 1 70 TYR QD 1 84 GLU HA . . 8.180 3.844 3.316 5.109 . 0 0 "[ . 1 . 2]" 1
1727 1 70 TYR QD 1 84 GLU HB2 . . 7.460 4.689 4.112 5.625 . 0 0 "[ . 1 . 2]" 1
1728 1 70 TYR QD 1 84 GLU HB3 . . 7.460 3.234 2.487 5.772 . 0 0 "[ . 1 . 2]" 1
1729 1 70 TYR QD 1 84 GLU HG2 . . 7.630 4.030 2.973 5.060 . 0 0 "[ . 1 . 2]" 1
1730 1 70 TYR QD 1 84 GLU HG3 . . 7.630 5.053 2.709 6.390 . 0 0 "[ . 1 . 2]" 1
1731 1 70 TYR QD 1 85 ILE H . . 7.990 3.683 2.879 5.270 . 0 0 "[ . 1 . 2]" 1
1732 1 70 TYR QD 1 86 PRO HB2 . . 8.290 5.808 5.192 6.062 . 0 0 "[ . 1 . 2]" 1
1733 1 70 TYR QD 1 86 PRO HB3 . . 8.290 4.758 3.810 5.170 . 0 0 "[ . 1 . 2]" 1
1734 1 70 TYR QE 1 72 LYS H . . 8.310 4.926 4.135 6.698 . 0 0 "[ . 1 . 2]" 1
1735 1 70 TYR QE 1 72 LYS HA . . 6.930 4.171 3.464 6.016 . 0 0 "[ . 1 . 2]" 1
1736 1 70 TYR QE 1 72 LYS HD2 . . 6.930 3.516 2.256 7.107 0.177 10 0 "[ . 1 . 2]" 1
1737 1 70 TYR QE 1 72 LYS HD3 . . 6.930 4.668 3.431 6.562 . 0 0 "[ . 1 . 2]" 1
1738 1 70 TYR QE 1 72 LYS HE2 . . 7.110 4.706 2.514 5.892 . 0 0 "[ . 1 . 2]" 1
1739 1 70 TYR QE 1 72 LYS QE . . 7.370 3.682 2.379 4.996 . 0 0 "[ . 1 . 2]" 1
1740 1 70 TYR QE 1 72 LYS HE3 . . 7.110 3.931 2.606 5.605 . 0 0 "[ . 1 . 2]" 1
1741 1 70 TYR QE 1 72 LYS QG . . 7.380 2.932 1.806 6.098 . 0 0 "[ . 1 . 2]" 1
1742 1 70 TYR QE 1 81 VAL MG1 . . 8.760 4.584 3.831 6.141 . 0 0 "[ . 1 . 2]" 1
1743 1 70 TYR QE 1 81 VAL QG . . 9.100 4.339 3.696 5.718 . 0 0 "[ . 1 . 2]" 1
1744 1 70 TYR QE 1 81 VAL MG2 . . 8.760 5.537 4.480 7.020 . 0 0 "[ . 1 . 2]" 1
1745 1 70 TYR QE 1 84 GLU HA . . 7.720 4.335 3.477 6.761 . 0 0 "[ . 1 . 2]" 1
1746 1 70 TYR QE 1 84 GLU HB2 . . 8.300 4.341 2.975 6.664 . 0 0 "[ . 1 . 2]" 1
1747 1 70 TYR QE 1 84 GLU QB . . 8.400 2.996 1.841 5.096 . 0 0 "[ . 1 . 2]" 1
1748 1 70 TYR QE 1 84 GLU HB3 . . 8.300 3.130 1.859 5.376 . 0 0 "[ . 1 . 2]" 1
1749 1 70 TYR QE 1 84 GLU HG2 . . 6.600 3.131 2.273 5.899 . 0 0 "[ . 1 . 2]" 1
1750 1 70 TYR QE 1 84 GLU QG . . 6.830 2.966 2.258 5.629 . 0 0 "[ . 1 . 2]" 1
1751 1 70 TYR QE 1 84 GLU HG3 . . 6.600 4.218 2.583 7.120 0.520 15 1 "[ . 1 + 2]" 1
1752 1 70 TYR QE 1 86 PRO HB2 . . 7.940 7.463 5.199 7.702 . 0 0 "[ . 1 . 2]" 1
1753 1 70 TYR QE 1 86 PRO QB . . 8.040 5.890 3.557 6.258 . 0 0 "[ . 1 . 2]" 1
1754 1 70 TYR QE 1 86 PRO HB3 . . 7.940 6.174 3.621 6.630 . 0 0 "[ . 1 . 2]" 1
1755 1 71 VAL H 1 84 GLU HA . . 6.460 5.242 4.866 5.986 . 0 0 "[ . 1 . 2]" 1
1756 1 71 VAL H 1 85 ILE H . . 5.200 3.665 3.340 4.322 . 0 0 "[ . 1 . 2]" 1
1757 1 71 VAL H 1 85 ILE HB . . 5.120 3.755 3.270 4.339 . 0 0 "[ . 1 . 2]" 1
1758 1 71 VAL H 1 85 ILE MD . . 7.520 5.208 4.554 5.926 . 0 0 "[ . 1 . 2]" 1
1759 1 71 VAL H 1 85 ILE MG . . 6.520 4.170 3.880 4.673 . 0 0 "[ . 1 . 2]" 1
1760 1 71 VAL H 1 87 PRO HD2 . . 6.500 5.521 4.869 6.164 . 0 0 "[ . 1 . 2]" 1
1761 1 71 VAL H 1 87 PRO HD3 . . 6.500 4.148 3.402 4.669 . 0 0 "[ . 1 . 2]" 1
1762 1 71 VAL HB 1 72 LYS H . . 5.500 4.206 4.053 4.350 . 0 0 "[ . 1 . 2]" 1
1763 1 71 VAL HB 1 85 ILE H . . 5.500 3.793 2.995 4.727 . 0 0 "[ . 1 . 2]" 1
1764 1 71 VAL HB 1 85 ILE MD . . 6.120 3.962 3.150 4.865 . 0 0 "[ . 1 . 2]" 1
1765 1 71 VAL HB 1 85 ILE MG . . 7.160 3.915 3.319 4.663 . 0 0 "[ . 1 . 2]" 1
1766 1 71 VAL HB 1 90 TRP HE3 . . 6.030 3.243 2.857 4.017 . 0 0 "[ . 1 . 2]" 1
1767 1 71 VAL QG 1 72 LYS H . . 6.120 2.779 2.513 3.205 . 0 0 "[ . 1 . 2]" 1
1768 1 71 VAL QG 1 85 ILE H . . 7.630 4.096 3.631 4.725 . 0 0 "[ . 1 . 2]" 1
1769 1 71 VAL QG 1 85 ILE HB . . 6.800 3.611 2.855 4.341 . 0 0 "[ . 1 . 2]" 1
1770 1 71 VAL QG 1 85 ILE MG . . 8.080 3.911 3.210 4.619 . 0 0 "[ . 1 . 2]" 1
1771 1 71 VAL QG 1 90 TRP HE3 . . 6.650 3.168 2.707 3.737 . 0 0 "[ . 1 . 2]" 1
1772 1 71 VAL QG 1 90 TRP HH2 . . 6.920 2.824 2.363 3.329 . 0 0 "[ . 1 . 2]" 1
1773 1 71 VAL QG 1 90 TRP HZ3 . . 6.440 2.515 2.087 3.079 . 0 0 "[ . 1 . 2]" 1
1774 1 71 VAL MG1 1 72 LYS H . . 6.090 2.828 2.538 3.301 . 0 0 "[ . 1 . 2]" 1
1775 1 71 VAL MG1 1 85 ILE H . . 7.380 4.363 3.874 5.029 . 0 0 "[ . 1 . 2]" 1
1776 1 71 VAL MG1 1 90 TRP HE3 . . 6.360 3.984 3.135 4.461 . 0 0 "[ . 1 . 2]" 1
1777 1 71 VAL MG1 1 90 TRP HH2 . . 6.520 2.933 2.428 3.558 . 0 0 "[ . 1 . 2]" 1
1778 1 71 VAL MG1 1 90 TRP HZ3 . . 6.280 2.613 2.128 3.162 . 0 0 "[ . 1 . 2]" 1
1779 1 71 VAL MG2 1 72 LYS H . . 6.090 4.117 4.011 4.341 . 0 0 "[ . 1 . 2]" 1
1780 1 71 VAL MG2 1 85 ILE H . . 7.380 4.969 4.385 5.736 . 0 0 "[ . 1 . 2]" 1
1781 1 71 VAL MG2 1 90 TRP HE3 . . 6.360 3.353 2.775 4.093 . 0 0 "[ . 1 . 2]" 1
1782 1 71 VAL MG2 1 90 TRP HH2 . . 6.520 3.805 3.247 5.129 . 0 0 "[ . 1 . 2]" 1
1783 1 71 VAL MG2 1 90 TRP HZ3 . . 6.280 3.404 2.483 4.248 . 0 0 "[ . 1 . 2]" 1
1784 1 72 LYS H 1 72 LYS HD2 . . 5.550 4.467 3.855 4.808 . 0 0 "[ . 1 . 2]" 1
1785 1 72 LYS H 1 72 LYS HD3 . . 5.550 4.324 3.865 4.768 . 0 0 "[ . 1 . 2]" 1
1786 1 72 LYS H 1 73 VAL H . . 5.790 4.446 4.203 4.541 . 0 0 "[ . 1 . 2]" 1
1787 1 72 LYS H 1 73 VAL MG1 . . 7.520 6.535 6.291 6.632 . 0 0 "[ . 1 . 2]" 1
1788 1 72 LYS H 1 73 VAL QG . . 7.290 4.710 4.367 4.856 . 0 0 "[ . 1 . 2]" 1
1789 1 72 LYS H 1 73 VAL MG2 . . 7.520 4.831 4.455 4.994 . 0 0 "[ . 1 . 2]" 1
1790 1 72 LYS H 1 74 ILE MD . . 6.870 5.476 4.802 5.829 . 0 0 "[ . 1 . 2]" 1
1791 1 72 LYS H 1 84 GLU HA . . 6.330 4.969 4.506 5.632 . 0 0 "[ . 1 . 2]" 1
1792 1 72 LYS H 1 84 GLU QG . . 6.220 5.195 4.812 5.997 . 0 0 "[ . 1 . 2]" 1
1793 1 72 LYS HA 1 72 LYS HE2 . . 5.170 5.130 4.200 5.382 0.212 11 0 "[ . 1 . 2]" 1
1794 1 72 LYS HA 1 72 LYS QE . . 5.360 3.843 3.676 4.170 . 0 0 "[ . 1 . 2]" 1
1795 1 72 LYS HA 1 72 LYS HE3 . . 5.170 4.076 3.746 5.110 . 0 0 "[ . 1 . 2]" 1
1796 1 72 LYS HA 1 73 VAL QG . . 6.920 3.538 3.229 3.772 . 0 0 "[ . 1 . 2]" 1
1797 1 72 LYS HA 1 81 VAL QG . . 6.860 3.275 2.843 4.093 . 0 0 "[ . 1 . 2]" 1
1798 1 72 LYS HA 1 83 ARG H . . 5.650 5.122 4.729 5.467 . 0 0 "[ . 1 . 2]" 1
1799 1 72 LYS HA 1 84 GLU HA . . 4.740 2.422 2.009 3.205 . 0 0 "[ . 1 . 2]" 1
1800 1 72 LYS HA 1 84 GLU HG2 . . 5.240 3.329 2.311 5.078 . 0 0 "[ . 1 . 2]" 1
1801 1 72 LYS HA 1 84 GLU QG . . 5.500 2.992 2.294 3.987 . 0 0 "[ . 1 . 2]" 1
1802 1 72 LYS HA 1 84 GLU HG3 . . 5.240 4.142 2.913 5.047 . 0 0 "[ . 1 . 2]" 1
1803 1 72 LYS HA 1 85 ILE H . . 5.220 3.328 2.496 4.046 . 0 0 "[ . 1 . 2]" 1
1804 1 72 LYS HA 1 85 ILE MD . . 7.360 4.778 3.343 6.058 . 0 0 "[ . 1 . 2]" 1
1805 1 72 LYS QB 1 73 VAL H . . 5.280 3.172 2.664 3.932 . 0 0 "[ . 1 . 2]" 1
1806 1 72 LYS QB 1 74 ILE MD . . 6.350 3.465 2.591 4.458 . 0 0 "[ . 1 . 2]" 1
1807 1 72 LYS QB 1 81 VAL QG . . 6.850 2.264 1.767 3.749 . 0 0 "[ . 1 . 2]" 1
1808 1 72 LYS HB2 1 72 LYS HE2 . . 4.570 3.560 2.646 4.251 . 0 0 "[ . 1 . 2]" 1
1809 1 72 LYS HB2 1 72 LYS HE3 . . 4.570 3.169 2.104 4.420 . 0 0 "[ . 1 . 2]" 1
1810 1 72 LYS HB2 1 73 VAL H . . 5.030 3.821 2.714 4.635 . 0 0 "[ . 1 . 2]" 1
1811 1 72 LYS HB2 1 74 ILE MD . . 6.100 3.791 2.756 4.683 . 0 0 "[ . 1 . 2]" 1
1812 1 72 LYS HB2 1 81 VAL MG1 . . 7.290 3.409 1.810 5.343 . 0 0 "[ . 1 . 2]" 1
1813 1 72 LYS HB2 1 81 VAL MG2 . . 7.290 3.867 2.733 5.064 . 0 0 "[ . 1 . 2]" 1
1814 1 72 LYS HB3 1 72 LYS HE2 . . 4.570 3.207 1.833 4.608 0.038 5 0 "[ . 1 . 2]" 1
1815 1 72 LYS HB3 1 72 LYS HE3 . . 4.570 2.294 1.785 4.683 0.113 5 0 "[ . 1 . 2]" 1
1816 1 72 LYS HB3 1 73 VAL H . . 5.030 3.613 3.174 4.250 . 0 0 "[ . 1 . 2]" 1
1817 1 72 LYS HB3 1 74 ILE MD . . 6.100 4.122 3.150 5.635 . 0 0 "[ . 1 . 2]" 1
1818 1 72 LYS HB3 1 81 VAL MG1 . . 7.290 2.847 1.997 4.526 . 0 0 "[ . 1 . 2]" 1
1819 1 72 LYS HB3 1 81 VAL MG2 . . 7.290 3.484 2.210 4.839 . 0 0 "[ . 1 . 2]" 1
1820 1 72 LYS QD 1 74 ILE MD . . 6.260 3.397 2.280 4.329 . 0 0 "[ . 1 . 2]" 1
1821 1 72 LYS QD 1 81 VAL QG . . 6.580 3.200 1.774 3.679 . 0 0 "[ . 1 . 2]" 1
1822 1 72 LYS HD2 1 74 ILE MD . . 6.130 4.764 3.430 5.343 . 0 0 "[ . 1 . 2]" 1
1823 1 72 LYS HD3 1 74 ILE MD . . 6.130 3.506 2.297 4.689 . 0 0 "[ . 1 . 2]" 1
1824 1 72 LYS QE 1 81 VAL QG . . 6.360 1.931 1.639 3.082 . 0 0 "[ . 1 . 2]" 1
1825 1 72 LYS HE2 1 74 ILE MD . . 5.510 3.745 2.709 5.544 0.034 10 0 "[ . 1 . 2]" 1
1826 1 72 LYS HE2 1 81 VAL MG1 . . 5.550 3.235 2.374 3.897 . 0 0 "[ . 1 . 2]" 1
1827 1 72 LYS HE2 1 81 VAL MG2 . . 5.550 2.483 1.826 4.072 . 0 0 "[ . 1 . 2]" 1
1828 1 72 LYS HE3 1 74 ILE MD . . 5.510 4.252 3.129 5.527 0.017 1 0 "[ . 1 . 2]" 1
1829 1 72 LYS HE3 1 81 VAL MG1 . . 5.550 2.523 1.785 4.597 . 0 0 "[ . 1 . 2]" 1
1830 1 72 LYS HE3 1 81 VAL MG2 . . 5.550 2.575 1.772 4.799 . 0 0 "[ . 1 . 2]" 1
1831 1 72 LYS QG 1 84 GLU HG2 . . 5.760 3.544 2.382 5.666 . 0 0 "[ . 1 . 2]" 1
1832 1 72 LYS QG 1 84 GLU HG3 . . 5.760 4.566 2.905 5.772 0.012 1 0 "[ . 1 . 2]" 1
1833 1 73 VAL H 1 74 ILE H . . 5.740 4.329 4.273 4.391 . 0 0 "[ . 1 . 2]" 1
1834 1 73 VAL H 1 74 ILE MD . . 7.140 5.615 5.318 5.993 . 0 0 "[ . 1 . 2]" 1
1835 1 73 VAL H 1 81 VAL MG1 . . 5.800 3.048 2.390 5.429 . 0 0 "[ . 1 . 2]" 1
1836 1 73 VAL H 1 81 VAL QG . . 6.260 2.893 2.380 3.230 . 0 0 "[ . 1 . 2]" 1
1837 1 73 VAL H 1 81 VAL MG2 . . 5.800 4.756 2.777 5.219 . 0 0 "[ . 1 . 2]" 1
1838 1 73 VAL H 1 82 ILE H . . 5.800 4.742 4.211 5.376 . 0 0 "[ . 1 . 2]" 1
1839 1 73 VAL H 1 83 ARG H . . 4.680 3.441 3.110 3.918 . 0 0 "[ . 1 . 2]" 1
1840 1 73 VAL H 1 83 ARG HB2 . . 5.390 4.893 3.691 5.479 0.089 16 0 "[ . 1 . 2]" 1
1841 1 73 VAL H 1 83 ARG QB . . 5.470 3.654 2.875 4.490 . 0 0 "[ . 1 . 2]" 1
1842 1 73 VAL H 1 83 ARG HB3 . . 5.390 3.829 2.910 5.243 . 0 0 "[ . 1 . 2]" 1
1843 1 73 VAL H 1 84 GLU HA . . 4.910 3.000 2.747 3.472 . 0 0 "[ . 1 . 2]" 1
1844 1 73 VAL H 1 84 GLU HG2 . . 5.950 4.282 3.287 5.954 0.004 10 0 "[ . 1 . 2]" 1
1845 1 73 VAL H 1 84 GLU HG3 . . 5.950 4.558 4.058 5.114 . 0 0 "[ . 1 . 2]" 1
1846 1 73 VAL H 1 85 ILE H . . 6.120 4.064 3.684 4.521 . 0 0 "[ . 1 . 2]" 1
1847 1 73 VAL H 1 85 ILE MD . . 7.520 4.217 3.312 5.234 . 0 0 "[ . 1 . 2]" 1
1848 1 73 VAL HA 1 74 ILE H . . 3.570 2.133 2.106 2.149 . 0 0 "[ . 1 . 2]" 1
1849 1 73 VAL HA 1 74 ILE HB . . 4.930 4.639 4.573 4.694 . 0 0 "[ . 1 . 2]" 1
1850 1 73 VAL HA 1 74 ILE MD . . 6.310 5.106 4.975 5.194 . 0 0 "[ . 1 . 2]" 1
1851 1 73 VAL HA 1 85 ILE MD . . 7.310 5.047 4.435 6.163 . 0 0 "[ . 1 . 2]" 1
1852 1 73 VAL HB 1 74 ILE H . . 5.870 4.294 4.261 4.395 . 0 0 "[ . 1 . 2]" 1
1853 1 73 VAL HB 1 82 ILE QG . . 5.430 2.804 2.479 3.225 . 0 0 "[ . 1 . 2]" 1
1854 1 73 VAL HB 1 83 ARG H . . 4.120 2.833 2.463 3.253 . 0 0 "[ . 1 . 2]" 1
1855 1 73 VAL HB 1 83 ARG HB2 . . 4.940 3.186 1.759 4.409 . 0 0 "[ . 1 . 2]" 1
1856 1 73 VAL HB 1 83 ARG QB . . 5.130 2.335 1.749 3.830 . 0 0 "[ . 1 . 2]" 1
1857 1 73 VAL HB 1 83 ARG HB3 . . 4.940 2.527 1.776 4.206 . 0 0 "[ . 1 . 2]" 1
1858 1 73 VAL QG 1 74 ILE H . . 6.190 2.926 2.864 2.958 . 0 0 "[ . 1 . 2]" 1
1859 1 73 VAL QG 1 82 ILE H . . 7.260 3.757 3.299 4.053 . 0 0 "[ . 1 . 2]" 1
1860 1 73 VAL QG 1 82 ILE HB . . 6.620 4.610 4.275 4.899 . 0 0 "[ . 1 . 2]" 1
1861 1 73 VAL QG 1 82 ILE QG . . 7.240 2.428 2.133 2.678 . 0 0 "[ . 1 . 2]" 1
1862 1 73 VAL QG 1 83 ARG H . . 6.480 3.583 3.354 3.910 . 0 0 "[ . 1 . 2]" 1
1863 1 73 VAL QG 1 83 ARG QB . . 6.730 2.484 2.171 3.809 . 0 0 "[ . 1 . 2]" 1
1864 1 73 VAL QG 1 83 ARG QD . . 7.090 4.201 3.084 4.646 . 0 0 "[ . 1 . 2]" 1
1865 1 73 VAL QG 1 84 GLU HA . . 7.250 3.697 3.262 4.271 . 0 0 "[ . 1 . 2]" 1
1866 1 73 VAL QG 1 85 ILE H . . 7.590 3.591 2.991 4.048 . 0 0 "[ . 1 . 2]" 1
1867 1 73 VAL QG 1 85 ILE MD . . 6.790 2.172 1.890 2.902 . 0 0 "[ . 1 . 2]" 1
1868 1 73 VAL QG 1 90 TRP HZ3 . . 7.760 3.697 2.609 5.114 . 0 0 "[ . 1 . 2]" 1
1869 1 73 VAL MG1 1 74 ILE H . . 6.210 2.990 2.927 3.020 . 0 0 "[ . 1 . 2]" 1
1870 1 73 VAL MG1 1 82 ILE H . . 7.270 3.847 3.332 4.166 . 0 0 "[ . 1 . 2]" 1
1871 1 73 VAL MG1 1 83 ARG H . . 6.170 3.914 3.551 4.397 . 0 0 "[ . 1 . 2]" 1
1872 1 73 VAL MG1 1 83 ARG HB2 . . 6.390 3.809 2.893 5.429 . 0 0 "[ . 1 . 2]" 1
1873 1 73 VAL MG1 1 83 ARG HB3 . . 6.390 3.597 2.708 5.012 . 0 0 "[ . 1 . 2]" 1
1874 1 73 VAL MG2 1 74 ILE H . . 6.210 4.159 3.977 4.229 . 0 0 "[ . 1 . 2]" 1
1875 1 73 VAL MG2 1 82 ILE H . . 7.270 5.298 5.036 5.721 . 0 0 "[ . 1 . 2]" 1
1876 1 73 VAL MG2 1 83 ARG H . . 6.170 4.193 3.897 4.551 . 0 0 "[ . 1 . 2]" 1
1877 1 73 VAL MG2 1 83 ARG HB2 . . 6.390 3.712 2.600 4.465 . 0 0 "[ . 1 . 2]" 1
1878 1 73 VAL MG2 1 83 ARG HB3 . . 6.390 2.706 2.273 4.776 . 0 0 "[ . 1 . 2]" 1
1879 1 74 ILE H 1 74 ILE HB . . 4.040 2.596 2.516 2.659 . 0 0 "[ . 1 . 2]" 1
1880 1 74 ILE H 1 74 ILE HG12 . . 4.560 3.829 3.734 3.964 . 0 0 "[ . 1 . 2]" 1
1881 1 74 ILE H 1 74 ILE QG . . 4.890 2.614 2.485 2.786 . 0 0 "[ . 1 . 2]" 1
1882 1 74 ILE H 1 74 ILE HG13 . . 4.560 2.662 2.522 2.846 . 0 0 "[ . 1 . 2]" 1
1883 1 74 ILE H 1 75 GLU H . . 5.010 4.286 4.187 4.408 . 0 0 "[ . 1 . 2]" 1
1884 1 74 ILE H 1 82 ILE H . . 5.030 4.911 4.672 5.048 0.018 3 0 "[ . 1 . 2]" 1
1885 1 74 ILE H 1 82 ILE MD . . 7.170 5.144 4.760 5.550 . 0 0 "[ . 1 . 2]" 1
1886 1 74 ILE HA 1 75 GLU H . . 3.560 2.144 2.115 2.196 . 0 0 "[ . 1 . 2]" 1
1887 1 74 ILE HA 1 81 VAL HA . . 4.190 2.218 1.770 2.484 . 0 0 "[ . 1 . 2]" 1
1888 1 74 ILE HA 1 83 ARG H . . 5.720 4.527 4.061 4.879 . 0 0 "[ . 1 . 2]" 1
1889 1 74 ILE HB 1 75 GLU H . . 5.320 4.268 4.110 4.340 . 0 0 "[ . 1 . 2]" 1
1890 1 74 ILE HB 1 82 ILE H . . 6.500 5.815 5.496 6.121 . 0 0 "[ . 1 . 2]" 1
1891 1 74 ILE MD 1 75 GLU H . . 6.770 5.250 5.061 5.364 . 0 0 "[ . 1 . 2]" 1
1892 1 74 ILE MD 1 76 ASP H . . 7.420 6.917 6.508 7.363 . 0 0 "[ . 1 . 2]" 1
1893 1 74 ILE MD 1 79 ASN HA . . 6.520 5.204 4.559 5.858 . 0 0 "[ . 1 . 2]" 1
1894 1 74 ILE MD 1 79 ASN QB . . 7.560 5.859 5.027 6.769 . 0 0 "[ . 1 . 2]" 1
1895 1 74 ILE MD 1 81 VAL H . . 6.980 4.919 4.270 5.526 . 0 0 "[ . 1 . 2]" 1
1896 1 74 ILE MD 1 81 VAL HA . . 5.920 4.211 3.866 4.685 . 0 0 "[ . 1 . 2]" 1
1897 1 74 ILE MD 1 81 VAL QG . . 7.150 2.651 2.317 3.382 . 0 0 "[ . 1 . 2]" 1
1898 1 74 ILE QG 1 81 VAL HA . . 5.770 2.563 2.221 3.053 . 0 0 "[ . 1 . 2]" 1
1899 1 74 ILE QG 1 82 ILE H . . 5.730 4.210 3.849 4.724 . 0 0 "[ . 1 . 2]" 1
1900 1 74 ILE HG12 1 75 GLU H . . 5.680 4.521 4.395 4.640 . 0 0 "[ . 1 . 2]" 1
1901 1 74 ILE HG12 1 81 VAL HA . . 5.570 2.612 2.245 3.156 . 0 0 "[ . 1 . 2]" 1
1902 1 74 ILE HG12 1 82 ILE H . . 5.720 4.476 4.031 5.086 . 0 0 "[ . 1 . 2]" 1
1903 1 74 ILE HG13 1 75 GLU H . . 5.680 5.090 5.050 5.128 . 0 0 "[ . 1 . 2]" 1
1904 1 74 ILE HG13 1 81 VAL HA . . 5.570 3.742 3.422 4.086 . 0 0 "[ . 1 . 2]" 1
1905 1 74 ILE HG13 1 82 ILE H . . 5.720 5.129 4.876 5.606 . 0 0 "[ . 1 . 2]" 1
1906 1 74 ILE MG 1 75 GLU H . . 4.990 2.895 2.561 3.071 . 0 0 "[ . 1 . 2]" 1
1907 1 74 ILE MG 1 75 GLU QB . . 6.980 4.087 3.863 4.272 . 0 0 "[ . 1 . 2]" 1
1908 1 74 ILE MG 1 75 GLU QG . . 7.400 5.145 4.784 5.539 . 0 0 "[ . 1 . 2]" 1
1909 1 74 ILE MG 1 76 ASP H . . 6.410 4.289 3.878 4.734 . 0 0 "[ . 1 . 2]" 1
1910 1 74 ILE MG 1 76 ASP HA . . 5.400 3.391 2.898 3.843 . 0 0 "[ . 1 . 2]" 1
1911 1 74 ILE MG 1 78 THR H . . 6.850 5.306 4.800 6.084 . 0 0 "[ . 1 . 2]" 1
1912 1 74 ILE MG 1 79 ASN H . . 5.420 3.927 3.492 4.522 . 0 0 "[ . 1 . 2]" 1
1913 1 74 ILE MG 1 79 ASN HA . . 4.650 2.881 2.358 3.576 . 0 0 "[ . 1 . 2]" 1
1914 1 74 ILE MG 1 79 ASN HB2 . . 5.560 5.098 4.651 5.542 . 0 0 "[ . 1 . 2]" 1
1915 1 74 ILE MG 1 79 ASN QB . . 5.860 4.235 3.686 4.718 . 0 0 "[ . 1 . 2]" 1
1916 1 74 ILE MG 1 79 ASN HB3 . . 5.560 4.554 3.865 5.399 . 0 0 "[ . 1 . 2]" 1
1917 1 74 ILE MG 1 80 GLU H . . 5.590 3.228 2.763 3.713 . 0 0 "[ . 1 . 2]" 1
1918 1 74 ILE MG 1 80 GLU QB . . 7.020 4.476 4.211 4.793 . 0 0 "[ . 1 . 2]" 1
1919 1 74 ILE MG 1 81 VAL H . . 6.490 3.903 3.327 4.381 . 0 0 "[ . 1 . 2]" 1
1920 1 74 ILE MG 1 81 VAL HA . . 5.600 3.243 2.727 3.641 . 0 0 "[ . 1 . 2]" 1
1921 1 74 ILE MG 1 81 VAL QG . . 7.480 3.189 2.805 3.722 . 0 0 "[ . 1 . 2]" 1
1922 1 74 ILE MG 1 82 ILE H . . 6.520 4.445 3.984 4.834 . 0 0 "[ . 1 . 2]" 1
1923 1 75 GLU H 1 75 GLU HB2 . . 4.020 2.579 2.391 2.806 . 0 0 "[ . 1 . 2]" 1
1924 1 75 GLU H 1 75 GLU HB3 . . 4.020 2.532 2.355 2.675 . 0 0 "[ . 1 . 2]" 1
1925 1 75 GLU H 1 76 ASP H . . 5.500 4.489 4.363 4.602 . 0 0 "[ . 1 . 2]" 1
1926 1 75 GLU H 1 76 ASP HA . . 5.690 5.222 5.051 5.384 . 0 0 "[ . 1 . 2]" 1
1927 1 75 GLU H 1 79 ASN H . . 5.500 4.649 4.310 5.020 . 0 0 "[ . 1 . 2]" 1
1928 1 75 GLU H 1 80 GLU H . . 4.610 3.665 3.156 4.020 . 0 0 "[ . 1 . 2]" 1
1929 1 75 GLU H 1 80 GLU QB . . 5.830 5.351 4.986 5.669 . 0 0 "[ . 1 . 2]" 1
1930 1 75 GLU H 1 81 VAL HA . . 4.870 3.593 3.180 4.075 . 0 0 "[ . 1 . 2]" 1
1931 1 75 GLU H 1 82 ILE H . . 5.020 3.223 2.872 3.676 . 0 0 "[ . 1 . 2]" 1
1932 1 75 GLU H 1 82 ILE MD . . 6.430 3.501 3.058 3.832 . 0 0 "[ . 1 . 2]" 1
1933 1 75 GLU H 1 82 ILE HG12 . . 5.710 2.787 2.466 2.999 . 0 0 "[ . 1 . 2]" 1
1934 1 75 GLU H 1 82 ILE QG . . 5.770 2.762 2.450 2.968 . 0 0 "[ . 1 . 2]" 1
1935 1 75 GLU H 1 82 ILE HG13 . . 5.710 4.525 4.223 4.740 . 0 0 "[ . 1 . 2]" 1
1936 1 75 GLU H 1 82 ILE MG . . 5.760 2.904 2.458 3.366 . 0 0 "[ . 1 . 2]" 1
1937 1 75 GLU HA 1 76 ASP H . . 3.430 2.175 2.105 2.225 . 0 0 "[ . 1 . 2]" 1
1938 1 75 GLU HA 1 82 ILE MD . . 6.010 3.629 3.308 3.938 . 0 0 "[ . 1 . 2]" 1
1939 1 75 GLU HA 1 82 ILE MG . . 6.600 4.491 4.142 4.791 . 0 0 "[ . 1 . 2]" 1
1940 1 75 GLU QB 1 78 THR H . . 5.640 3.158 2.923 3.321 . 0 0 "[ . 1 . 2]" 1
1941 1 75 GLU QB 1 78 THR MG . . 7.240 3.892 3.611 4.197 . 0 0 "[ . 1 . 2]" 1
1942 1 75 GLU QB 1 80 GLU H . . 5.040 3.493 3.037 3.801 . 0 0 "[ . 1 . 2]" 1
1943 1 75 GLU QB 1 82 ILE MD . . 6.080 1.910 1.769 2.145 . 0 0 "[ . 1 . 2]" 1
1944 1 75 GLU QB 1 82 ILE QG . . 5.740 2.812 2.395 3.233 . 0 0 "[ . 1 . 2]" 1
1945 1 75 GLU QB 1 82 ILE MG . . 5.960 2.317 1.960 2.599 . 0 0 "[ . 1 . 2]" 1
1946 1 75 GLU HB2 1 76 ASP H . . 5.060 4.315 4.083 4.478 . 0 0 "[ . 1 . 2]" 1
1947 1 75 GLU HB2 1 78 THR H . . 5.500 4.702 4.446 4.979 . 0 0 "[ . 1 . 2]" 1
1948 1 75 GLU HB2 1 79 ASN H . . 5.500 5.317 4.969 5.752 0.252 16 0 "[ . 1 . 2]" 1
1949 1 75 GLU HB2 1 82 ILE HG12 . . 5.500 2.947 2.442 3.511 . 0 0 "[ . 1 . 2]" 1
1950 1 75 GLU HB2 1 82 ILE HG13 . . 5.500 4.283 3.947 4.697 . 0 0 "[ . 1 . 2]" 1
1951 1 75 GLU HB2 1 82 ILE MG . . 5.850 2.532 2.062 3.024 . 0 0 "[ . 1 . 2]" 1
1952 1 75 GLU HB3 1 76 ASP H . . 5.060 4.177 3.966 4.327 . 0 0 "[ . 1 . 2]" 1
1953 1 75 GLU HB3 1 78 THR H . . 5.500 3.210 2.962 3.395 . 0 0 "[ . 1 . 2]" 1
1954 1 75 GLU HB3 1 79 ASN H . . 5.500 3.730 3.300 4.162 . 0 0 "[ . 1 . 2]" 1
1955 1 75 GLU HB3 1 82 ILE HG12 . . 5.500 3.974 3.837 4.089 . 0 0 "[ . 1 . 2]" 1
1956 1 75 GLU HB3 1 82 ILE HG13 . . 5.500 5.525 5.338 5.586 0.086 7 0 "[ . 1 . 2]" 1
1957 1 75 GLU HB3 1 82 ILE MG . . 5.850 2.713 2.357 3.005 . 0 0 "[ . 1 . 2]" 1
1958 1 75 GLU QG 1 76 ASP H . . 5.180 3.016 2.456 3.531 . 0 0 "[ . 1 . 2]" 1
1959 1 75 GLU QG 1 77 SER H . . 5.750 2.634 1.787 3.908 . 0 0 "[ . 1 . 2]" 1
1960 1 75 GLU QG 1 77 SER QB . . 7.030 3.207 2.212 4.391 . 0 0 "[ . 1 . 2]" 1
1961 1 75 GLU QG 1 78 THR H . . 5.310 2.988 1.717 4.136 . 0 0 "[ . 1 . 2]" 1
1962 1 75 GLU QG 1 78 THR MG . . 6.130 4.013 2.949 4.898 . 0 0 "[ . 1 . 2]" 1
1963 1 75 GLU QG 1 79 ASN H . . 6.380 4.255 3.125 5.413 . 0 0 "[ . 1 . 2]" 1
1964 1 75 GLU QG 1 80 GLU H . . 5.770 5.114 4.183 5.776 0.006 16 0 "[ . 1 . 2]" 1
1965 1 75 GLU QG 1 82 ILE MD . . 6.460 3.126 2.443 3.726 . 0 0 "[ . 1 . 2]" 1
1966 1 75 GLU QG 1 82 ILE QG . . 6.280 4.559 3.874 5.136 . 0 0 "[ . 1 . 2]" 1
1967 1 75 GLU QG 1 82 ILE MG . . 6.280 3.619 2.930 4.241 . 0 0 "[ . 1 . 2]" 1
1968 1 76 ASP H 1 76 ASP HB2 . . 3.890 2.548 2.415 2.749 . 0 0 "[ . 1 . 2]" 1
1969 1 76 ASP H 1 76 ASP HB3 . . 3.890 2.537 2.417 2.688 . 0 0 "[ . 1 . 2]" 1
1970 1 76 ASP H 1 77 SER H . . 4.220 2.635 2.341 2.948 . 0 0 "[ . 1 . 2]" 1
1971 1 76 ASP HB2 1 77 SER H . . 4.860 4.025 3.868 4.222 . 0 0 "[ . 1 . 2]" 1
1972 1 76 ASP HB3 1 77 SER H . . 4.860 2.879 2.529 3.275 . 0 0 "[ . 1 . 2]" 1
1973 1 77 SER H 1 78 THR H . . 3.790 2.653 2.442 2.990 . 0 0 "[ . 1 . 2]" 1
1974 1 77 SER H 1 78 THR MG . . 6.420 4.908 4.567 5.927 . 0 0 "[ . 1 . 2]" 1
1975 1 77 SER H 1 79 ASN H . . 4.620 3.690 3.399 3.930 . 0 0 "[ . 1 . 2]" 1
1976 1 77 SER HA 1 79 ASN H . . 5.510 4.387 3.974 4.630 . 0 0 "[ . 1 . 2]" 1
1977 1 77 SER QB 1 78 THR H . . 5.430 2.680 2.061 3.547 . 0 0 "[ . 1 . 2]" 1
1978 1 77 SER QB 1 78 THR MG . . 6.350 3.358 2.937 4.915 . 0 0 "[ . 1 . 2]" 1
1979 1 77 SER QB 1 79 ASN H . . 6.610 4.505 4.067 5.142 . 0 0 "[ . 1 . 2]" 1
1980 1 78 THR H 1 79 ASN H . . 3.520 2.197 1.893 2.559 . 0 0 "[ . 1 . 2]" 1
1981 1 78 THR HB 1 80 GLU H . . 4.500 3.232 2.530 4.439 . 0 0 "[ . 1 . 2]" 1
1982 1 78 THR HB 1 80 GLU QB . . 5.120 3.611 3.102 4.515 . 0 0 "[ . 1 . 2]" 1
1983 1 78 THR HB 1 80 GLU HG2 . . 3.950 2.052 1.790 2.564 . 0 0 "[ . 1 . 2]" 1
1984 1 78 THR HB 1 80 GLU QG . . 4.260 2.039 1.783 2.494 . 0 0 "[ . 1 . 2]" 1
1985 1 78 THR HB 1 80 GLU HG3 . . 3.950 3.638 3.257 3.976 0.026 3 0 "[ . 1 . 2]" 1
1986 1 78 THR MG 1 79 ASN H . . 6.050 4.183 4.029 4.294 . 0 0 "[ . 1 . 2]" 1
1987 1 78 THR MG 1 80 GLU H . . 6.400 4.430 3.346 5.310 . 0 0 "[ . 1 . 2]" 1
1988 1 78 THR MG 1 80 GLU QG . . 5.940 3.236 2.052 3.626 . 0 0 "[ . 1 . 2]" 1
1989 1 79 ASN H 1 80 GLU H . . 3.740 2.614 2.507 2.893 . 0 0 "[ . 1 . 2]" 1
1990 1 79 ASN H 1 80 GLU QB . . 6.080 5.008 4.920 5.149 . 0 0 "[ . 1 . 2]" 1
1991 1 79 ASN QB 1 80 GLU H . . 5.350 3.765 3.497 4.014 . 0 0 "[ . 1 . 2]" 1
1992 1 79 ASN HB2 1 80 GLU H . . 5.090 4.205 3.708 4.630 . 0 0 "[ . 1 . 2]" 1
1993 1 79 ASN HB3 1 80 GLU H . . 5.090 4.285 3.918 4.417 . 0 0 "[ . 1 . 2]" 1
1994 1 80 GLU H 1 80 GLU HG2 . . 4.200 2.353 2.100 2.760 . 0 0 "[ . 1 . 2]" 1
1995 1 80 GLU H 1 80 GLU HG3 . . 4.200 3.111 2.957 3.382 . 0 0 "[ . 1 . 2]" 1
1996 1 80 GLU H 1 81 VAL H . . 4.800 4.456 4.316 4.520 . 0 0 "[ . 1 . 2]" 1
1997 1 80 GLU H 1 82 ILE MG . . 6.500 4.029 3.695 4.384 . 0 0 "[ . 1 . 2]" 1
1998 1 80 GLU HA 1 81 VAL H . . 3.190 2.381 2.221 2.527 . 0 0 "[ . 1 . 2]" 1
1999 1 80 GLU HA 1 81 VAL QG . . 6.440 3.423 3.238 3.667 . 0 0 "[ . 1 . 2]" 1
2000 1 80 GLU QB 1 81 VAL H . . 4.880 2.445 2.154 2.685 . 0 0 "[ . 1 . 2]" 1
2001 1 80 GLU QB 1 82 ILE H . . 6.840 5.199 4.896 5.639 . 0 0 "[ . 1 . 2]" 1
2002 1 80 GLU QB 1 82 ILE MG . . 6.290 4.101 3.830 4.521 . 0 0 "[ . 1 . 2]" 1
2003 1 80 GLU QG 1 81 VAL H . . 4.940 3.541 3.296 3.779 . 0 0 "[ . 1 . 2]" 1
2004 1 80 GLU QG 1 82 ILE H . . 6.740 4.056 3.580 4.906 . 0 0 "[ . 1 . 2]" 1
2005 1 80 GLU QG 1 82 ILE QG . . 6.090 4.483 3.920 5.102 . 0 0 "[ . 1 . 2]" 1
2006 1 80 GLU QG 1 82 ILE MG . . 5.650 2.389 2.027 2.983 . 0 0 "[ . 1 . 2]" 1
2007 1 80 GLU HG2 1 81 VAL H . . 4.800 4.694 4.459 4.848 0.048 16 0 "[ . 1 . 2]" 1
2008 1 80 GLU HG2 1 82 ILE MG . . 5.450 3.405 3.010 4.168 . 0 0 "[ . 1 . 2]" 1
2009 1 80 GLU HG3 1 81 VAL H . . 4.800 3.665 3.379 3.947 . 0 0 "[ . 1 . 2]" 1
2010 1 80 GLU HG3 1 82 ILE MG . . 5.450 2.443 2.055 3.055 . 0 0 "[ . 1 . 2]" 1
2011 1 81 VAL H 1 81 VAL HB . . 3.620 2.593 2.563 2.764 . 0 0 "[ . 1 . 2]" 1
2012 1 81 VAL H 1 82 ILE H . . 4.730 4.338 4.216 4.529 . 0 0 "[ . 1 . 2]" 1
2013 1 81 VAL HA 1 82 ILE HG12 . . 4.890 3.821 3.698 3.983 . 0 0 "[ . 1 . 2]" 1
2014 1 81 VAL HA 1 82 ILE HG13 . . 4.890 4.837 4.663 4.912 0.022 10 0 "[ . 1 . 2]" 1
2015 1 81 VAL HA 1 83 ARG H . . 4.700 3.567 3.321 3.844 . 0 0 "[ . 1 . 2]" 1
2016 1 81 VAL HB 1 82 ILE H . . 5.470 4.297 4.096 4.392 . 0 0 "[ . 1 . 2]" 1
2017 1 81 VAL QG 1 82 ILE H . . 6.150 2.986 2.593 3.189 . 0 0 "[ . 1 . 2]" 1
2018 1 81 VAL QG 1 83 ARG H . . 5.880 2.440 2.039 2.937 . 0 0 "[ . 1 . 2]" 1
2019 1 81 VAL QG 1 83 ARG HA . . 7.300 3.832 3.644 4.052 . 0 0 "[ . 1 . 2]" 1
2020 1 81 VAL QG 1 84 GLU H . . 6.700 4.123 3.761 4.504 . 0 0 "[ . 1 . 2]" 1
2021 1 81 VAL QG 1 84 GLU HA . . 7.130 3.653 3.160 3.919 . 0 0 "[ . 1 . 2]" 1
2022 1 81 VAL QG 1 84 GLU QB . . 7.070 3.770 2.424 4.295 . 0 0 "[ . 1 . 2]" 1
2023 1 81 VAL QG 1 84 GLU QG . . 6.870 2.315 1.964 3.805 . 0 0 "[ . 1 . 2]" 1
2024 1 81 VAL MG1 1 82 ILE H . . 5.740 3.115 2.621 4.211 . 0 0 "[ . 1 . 2]" 1
2025 1 81 VAL MG1 1 84 GLU HA . . 7.130 3.793 3.185 5.470 . 0 0 "[ . 1 . 2]" 1
2026 1 81 VAL MG1 1 84 GLU HB2 . . 7.510 4.361 2.459 5.580 . 0 0 "[ . 1 . 2]" 1
2027 1 81 VAL MG1 1 84 GLU HB3 . . 7.510 4.465 3.917 5.633 . 0 0 "[ . 1 . 2]" 1
2028 1 81 VAL MG2 1 82 ILE H . . 5.740 4.159 3.069 4.297 . 0 0 "[ . 1 . 2]" 1
2029 1 81 VAL MG2 1 84 GLU HA . . 7.130 5.754 3.427 6.246 . 0 0 "[ . 1 . 2]" 1
2030 1 81 VAL MG2 1 84 GLU HB2 . . 7.510 6.368 4.399 7.307 . 0 0 "[ . 1 . 2]" 1
2031 1 81 VAL MG2 1 84 GLU HB3 . . 7.510 6.255 4.215 6.876 . 0 0 "[ . 1 . 2]" 1
2032 1 82 ILE H 1 82 ILE MD . . 5.810 3.665 3.584 3.815 . 0 0 "[ . 1 . 2]" 1
2033 1 82 ILE H 1 82 ILE HG12 . . 4.320 1.975 1.867 2.166 . 0 0 "[ . 1 . 2]" 1
2034 1 82 ILE H 1 82 ILE QG . . 4.660 1.937 1.838 2.100 . 0 0 "[ . 1 . 2]" 1
2035 1 82 ILE H 1 82 ILE HG13 . . 4.320 2.808 2.631 2.915 . 0 0 "[ . 1 . 2]" 1
2036 1 82 ILE H 1 83 ARG H . . 3.880 2.327 2.066 2.537 . 0 0 "[ . 1 . 2]" 1
2037 1 82 ILE H 1 83 ARG QB . . 6.850 4.406 4.032 4.983 . 0 0 "[ . 1 . 2]" 1
2038 1 82 ILE HB 1 83 ARG H . . 4.500 4.027 3.671 4.221 . 0 0 "[ . 1 . 2]" 1
2039 1 82 ILE MD 1 83 ARG H . . 6.430 4.294 3.870 4.594 . 0 0 "[ . 1 . 2]" 1
2040 1 82 ILE MD 1 83 ARG HA . . 6.650 5.572 5.314 5.840 . 0 0 "[ . 1 . 2]" 1
2041 1 82 ILE QG 1 83 ARG H . . 4.810 2.601 2.126 2.931 . 0 0 "[ . 1 . 2]" 1
2042 1 82 ILE HG12 1 83 ARG H . . 4.520 3.299 2.940 3.605 . 0 0 "[ . 1 . 2]" 1
2043 1 82 ILE HG13 1 83 ARG H . . 4.520 2.728 2.174 3.108 . 0 0 "[ . 1 . 2]" 1
2044 1 82 ILE MG 1 83 ARG H . . 5.870 4.178 4.088 4.286 . 0 0 "[ . 1 . 2]" 1
2045 1 83 ARG H 1 83 ARG HD2 . . 5.310 4.711 3.621 5.396 0.086 16 0 "[ . 1 . 2]" 1
2046 1 83 ARG H 1 83 ARG QD . . 5.550 4.307 3.422 4.831 . 0 0 "[ . 1 . 2]" 1
2047 1 83 ARG H 1 83 ARG HD3 . . 5.310 5.069 4.210 5.498 0.188 4 0 "[ . 1 . 2]" 1
2048 1 83 ARG H 1 83 ARG HG2 . . 5.730 4.912 2.636 5.265 . 0 0 "[ . 1 . 2]" 1
2049 1 83 ARG H 1 83 ARG HG3 . . 5.730 4.654 3.619 4.815 . 0 0 "[ . 1 . 2]" 1
2050 1 83 ARG H 1 84 GLU H . . 5.620 4.229 4.069 4.362 . 0 0 "[ . 1 . 2]" 1
2051 1 83 ARG HA 1 83 ARG HD2 . . 4.650 2.544 1.946 4.776 0.126 20 0 "[ . 1 . 2]" 1
2052 1 83 ARG HA 1 83 ARG QD . . 4.920 2.408 1.932 4.199 . 0 0 "[ . 1 . 2]" 1
2053 1 83 ARG HA 1 83 ARG HD3 . . 4.650 3.464 2.005 4.656 0.006 20 0 "[ . 1 . 2]" 1
2054 1 83 ARG HA 1 84 GLU H . . 3.330 2.223 2.163 2.307 . 0 0 "[ . 1 . 2]" 1
2055 1 83 ARG QB 1 84 GLU H . . 4.680 3.393 2.545 3.682 . 0 0 "[ . 1 . 2]" 1
2056 1 83 ARG QB 1 85 ILE MD . . 6.650 2.958 1.872 4.453 . 0 0 "[ . 1 . 2]" 1
2057 1 83 ARG HB2 1 84 GLU H . . 4.460 4.179 2.604 4.459 . 0 0 "[ . 1 . 2]" 1
2058 1 83 ARG HB2 1 85 ILE MD . . 6.550 4.130 3.104 5.338 . 0 0 "[ . 1 . 2]" 1
2059 1 83 ARG HB3 1 84 GLU H . . 4.460 3.658 2.581 4.018 . 0 0 "[ . 1 . 2]" 1
2060 1 83 ARG HB3 1 85 ILE MD . . 6.550 3.073 1.888 5.451 . 0 0 "[ . 1 . 2]" 1
2061 1 83 ARG QD 1 84 GLU H . . 5.920 3.529 2.503 4.638 . 0 0 "[ . 1 . 2]" 1
2062 1 83 ARG QD 1 85 ILE MD . . 6.970 4.048 2.266 4.845 . 0 0 "[ . 1 . 2]" 1
2063 1 83 ARG QD 1 85 ILE QG . . 6.730 4.461 2.972 5.755 . 0 0 "[ . 1 . 2]" 1
2064 1 83 ARG HD2 1 84 GLU H . . 5.770 3.709 2.524 5.288 . 0 0 "[ . 1 . 2]" 1
2065 1 83 ARG HD2 1 85 ILE MD . . 6.810 4.722 3.186 5.768 . 0 0 "[ . 1 . 2]" 1
2066 1 83 ARG HD3 1 84 GLU H . . 5.770 4.776 3.377 5.681 . 0 0 "[ . 1 . 2]" 1
2067 1 83 ARG HD3 1 85 ILE MD . . 6.810 4.531 2.287 5.253 . 0 0 "[ . 1 . 2]" 1
2068 1 83 ARG HG2 1 84 GLU H . . 4.520 4.125 2.362 4.608 0.088 20 0 "[ . 1 . 2]" 1
2069 1 83 ARG HG3 1 84 GLU H . . 4.520 2.875 2.257 4.635 0.115 11 0 "[ . 1 . 2]" 1
2070 1 84 GLU H 1 84 GLU HG2 . . 4.510 4.048 3.698 4.543 0.033 6 0 "[ . 1 . 2]" 1
2071 1 84 GLU H 1 84 GLU QG . . 4.820 3.042 2.659 4.079 . 0 0 "[ . 1 . 2]" 1
2072 1 84 GLU H 1 84 GLU HG3 . . 4.510 3.176 2.726 4.625 0.115 2 0 "[ . 1 . 2]" 1
2073 1 84 GLU H 1 85 ILE H . . 5.590 4.211 4.052 4.505 . 0 0 "[ . 1 . 2]" 1
2074 1 84 GLU H 1 85 ILE MD . . 7.150 4.369 3.112 5.855 . 0 0 "[ . 1 . 2]" 1
2075 1 84 GLU HA 1 85 ILE MD . . 7.520 3.919 2.785 5.183 . 0 0 "[ . 1 . 2]" 1
2076 1 84 GLU HB2 1 85 ILE H . . 5.270 4.300 4.057 4.399 . 0 0 "[ . 1 . 2]" 1
2077 1 84 GLU HB3 1 85 ILE H . . 5.270 3.583 2.985 4.211 . 0 0 "[ . 1 . 2]" 1
2078 1 84 GLU HG2 1 85 ILE H . . 5.560 4.476 3.301 5.376 . 0 0 "[ . 1 . 2]" 1
2079 1 84 GLU HG3 1 85 ILE H . . 5.560 4.922 3.096 5.314 . 0 0 "[ . 1 . 2]" 1
2080 1 85 ILE H 1 85 ILE HG12 . . 4.950 3.977 2.796 4.369 . 0 0 "[ . 1 . 2]" 1
2081 1 85 ILE H 1 85 ILE HG13 . . 4.950 3.228 2.392 4.125 . 0 0 "[ . 1 . 2]" 1
2082 1 85 ILE HB 1 90 TRP HE3 . . 5.200 2.827 2.183 3.706 . 0 0 "[ . 1 . 2]" 1
2083 1 85 ILE MD 1 86 PRO HD2 . . 7.510 4.702 3.122 4.953 . 0 0 "[ . 1 . 2]" 1
2084 1 85 ILE MD 1 86 PRO HD3 . . 7.510 5.324 3.957 5.874 . 0 0 "[ . 1 . 2]" 1
2085 1 85 ILE MD 1 90 TRP HA . . 6.480 4.614 3.554 6.062 . 0 0 "[ . 1 . 2]" 1
2086 1 85 ILE MD 1 90 TRP HE3 . . 5.590 3.659 2.833 5.122 . 0 0 "[ . 1 . 2]" 1
2087 1 85 ILE MD 1 90 TRP HZ3 . . 5.470 3.213 2.369 5.078 . 0 0 "[ . 1 . 2]" 1
2088 1 85 ILE MD 1 93 PHE H . . 7.520 5.511 4.195 6.693 . 0 0 "[ . 1 . 2]" 1
2089 1 85 ILE MD 1 93 PHE HA . . 7.520 5.232 4.181 6.224 . 0 0 "[ . 1 . 2]" 1
2090 1 85 ILE MD 1 93 PHE HB2 . . 6.620 3.488 2.149 4.658 . 0 0 "[ . 1 . 2]" 1
2091 1 85 ILE MD 1 93 PHE HB3 . . 6.620 4.034 2.810 5.198 . 0 0 "[ . 1 . 2]" 1
2092 1 85 ILE MD 1 93 PHE QD . . 8.210 3.360 2.812 4.003 . 0 0 "[ . 1 . 2]" 1
2093 1 85 ILE MD 1 93 PHE QE . . 9.350 3.497 3.183 4.113 . 0 0 "[ . 1 . 2]" 1
2094 1 85 ILE MD 1 93 PHE HZ . . 7.160 4.111 3.534 4.783 . 0 0 "[ . 1 . 2]" 1
2095 1 85 ILE MG 1 86 PRO HD2 . . 5.980 2.519 2.296 2.734 . 0 0 "[ . 1 . 2]" 1
2096 1 85 ILE MG 1 86 PRO QD . . 6.220 2.485 2.272 2.691 . 0 0 "[ . 1 . 2]" 1
2097 1 85 ILE MG 1 86 PRO HD3 . . 5.980 3.808 3.634 4.006 . 0 0 "[ . 1 . 2]" 1
2098 1 85 ILE MG 1 86 PRO HG2 . . 6.770 3.664 3.435 3.953 . 0 0 "[ . 1 . 2]" 1
2099 1 85 ILE MG 1 86 PRO QG . . 6.980 3.534 3.333 3.789 . 0 0 "[ . 1 . 2]" 1
2100 1 85 ILE MG 1 86 PRO HG3 . . 6.770 4.649 4.474 4.863 . 0 0 "[ . 1 . 2]" 1
2101 1 85 ILE MG 1 89 ARG H . . 6.310 3.633 3.424 3.999 . 0 0 "[ . 1 . 2]" 1
2102 1 85 ILE MG 1 89 ARG HA . . 6.720 4.469 4.054 4.957 . 0 0 "[ . 1 . 2]" 1
2103 1 85 ILE MG 1 89 ARG QB . . 6.970 2.627 2.092 3.074 . 0 0 "[ . 1 . 2]" 1
2104 1 85 ILE MG 1 89 ARG HD2 . . 6.520 4.783 3.815 6.458 . 0 0 "[ . 1 . 2]" 1
2105 1 85 ILE MG 1 89 ARG HD3 . . 6.520 5.283 4.133 6.080 . 0 0 "[ . 1 . 2]" 1
2106 1 85 ILE MG 1 90 TRP H . . 5.900 3.380 2.926 4.153 . 0 0 "[ . 1 . 2]" 1
2107 1 85 ILE MG 1 90 TRP HA . . 5.050 2.211 1.900 2.631 . 0 0 "[ . 1 . 2]" 1
2108 1 85 ILE MG 1 90 TRP HB2 . . 6.390 2.917 2.430 3.567 . 0 0 "[ . 1 . 2]" 1
2109 1 85 ILE MG 1 90 TRP QB . . 6.540 2.860 2.399 3.471 . 0 0 "[ . 1 . 2]" 1
2110 1 85 ILE MG 1 90 TRP HB3 . . 6.390 4.141 3.707 4.757 . 0 0 "[ . 1 . 2]" 1
2111 1 85 ILE MG 1 90 TRP HE3 . . 5.270 2.265 1.892 2.594 . 0 0 "[ . 1 . 2]" 1
2112 1 85 ILE MG 1 90 TRP HZ3 . . 6.580 3.787 3.351 4.159 . 0 0 "[ . 1 . 2]" 1
2113 1 85 ILE MG 1 91 LEU H . . 6.520 4.803 4.458 5.375 . 0 0 "[ . 1 . 2]" 1
2114 1 85 ILE MG 1 93 PHE H . . 6.520 3.978 3.572 4.513 . 0 0 "[ . 1 . 2]" 1
2115 1 85 ILE MG 1 93 PHE HA . . 7.450 4.982 4.616 5.251 . 0 0 "[ . 1 . 2]" 1
2116 1 85 ILE MG 1 93 PHE HB2 . . 6.450 2.907 2.475 3.243 . 0 0 "[ . 1 . 2]" 1
2117 1 85 ILE MG 1 93 PHE HB3 . . 6.450 2.980 2.625 3.569 . 0 0 "[ . 1 . 2]" 1
2118 1 85 ILE MG 1 93 PHE QD . . 9.240 3.697 3.007 4.065 . 0 0 "[ . 1 . 2]" 1
2119 1 85 ILE MG 1 94 TYR H . . 7.520 4.915 4.532 5.509 . 0 0 "[ . 1 . 2]" 1
2120 1 86 PRO QB 1 87 PRO QD . . 5.570 2.404 2.152 2.739 . 0 0 "[ . 1 . 2]" 1
2121 1 86 PRO QB 1 88 LYS H . . 5.590 2.764 2.494 3.138 . 0 0 "[ . 1 . 2]" 1
2122 1 86 PRO QB 1 88 LYS QD . . 6.370 3.467 1.939 4.574 . 0 0 "[ . 1 . 2]" 1
2123 1 86 PRO QB 1 88 LYS QG . . 7.020 2.456 1.809 3.228 . 0 0 "[ . 1 . 2]" 1
2124 1 86 PRO QB 1 89 ARG H . . 6.230 3.518 3.241 3.804 . 0 0 "[ . 1 . 2]" 1
2125 1 86 PRO HB2 1 88 LYS QD . . 6.310 3.585 1.963 4.751 . 0 0 "[ . 1 . 2]" 1
2126 1 86 PRO HB2 1 89 ARG H . . 6.200 3.589 3.290 3.898 . 0 0 "[ . 1 . 2]" 1
2127 1 86 PRO HB3 1 88 LYS QD . . 6.310 4.633 3.028 5.966 . 0 0 "[ . 1 . 2]" 1
2128 1 86 PRO HB3 1 89 ARG H . . 6.200 5.066 4.849 5.299 . 0 0 "[ . 1 . 2]" 1
2129 1 86 PRO QD 1 89 ARG H . . 6.530 4.272 3.936 4.576 . 0 0 "[ . 1 . 2]" 1
2130 1 86 PRO QD 1 89 ARG QG . . 6.220 3.702 2.719 4.586 . 0 0 "[ . 1 . 2]" 1
2131 1 86 PRO HD2 1 89 ARG H . . 6.500 4.436 4.070 4.798 . 0 0 "[ . 1 . 2]" 1
2132 1 86 PRO HD3 1 89 ARG H . . 6.500 5.583 5.225 5.776 . 0 0 "[ . 1 . 2]" 1
2133 1 86 PRO QG 1 88 LYS H . . 6.280 3.826 3.515 4.224 . 0 0 "[ . 1 . 2]" 1
2134 1 86 PRO QG 1 89 ARG H . . 5.560 3.008 2.502 3.221 . 0 0 "[ . 1 . 2]" 1
2135 1 86 PRO QG 1 89 ARG QD . . 5.740 3.513 2.509 4.031 . 0 0 "[ . 1 . 2]" 1
2136 1 86 PRO QG 1 89 ARG QG . . 6.750 2.582 1.916 3.855 . 0 0 "[ . 1 . 2]" 1
2137 1 86 PRO HG2 1 88 LYS H . . 6.110 3.953 3.616 4.387 . 0 0 "[ . 1 . 2]" 1
2138 1 86 PRO HG2 1 89 ARG H . . 5.340 3.042 2.519 3.266 . 0 0 "[ . 1 . 2]" 1
2139 1 86 PRO HG2 1 89 ARG HD2 . . 5.650 4.117 2.673 5.242 . 0 0 "[ . 1 . 2]" 1
2140 1 86 PRO HG2 1 89 ARG HD3 . . 5.650 4.540 4.152 4.963 . 0 0 "[ . 1 . 2]" 1
2141 1 86 PRO HG3 1 88 LYS H . . 6.110 5.111 4.787 5.512 . 0 0 "[ . 1 . 2]" 1
2142 1 86 PRO HG3 1 89 ARG H . . 5.340 4.753 4.253 4.941 . 0 0 "[ . 1 . 2]" 1
2143 1 86 PRO HG3 1 89 ARG HD2 . . 5.650 4.784 3.164 5.816 0.166 5 0 "[ . 1 . 2]" 1
2144 1 86 PRO HG3 1 89 ARG HD3 . . 5.650 5.351 4.581 5.735 0.085 15 0 "[ . 1 . 2]" 1
2145 1 87 PRO HA 1 90 TRP H . . 4.930 3.422 3.128 3.826 . 0 0 "[ . 1 . 2]" 1
2146 1 87 PRO HA 1 90 TRP HB2 . . 5.360 2.534 1.734 3.405 . 0 0 "[ . 1 . 2]" 1
2147 1 87 PRO HA 1 90 TRP HB3 . . 5.360 2.987 2.486 3.408 . 0 0 "[ . 1 . 2]" 1
2148 1 87 PRO HA 1 90 TRP HD1 . . 5.710 4.906 4.354 5.446 . 0 0 "[ . 1 . 2]" 1
2149 1 87 PRO HA 1 91 LEU H . . 5.500 5.260 4.675 5.543 0.043 10 0 "[ . 1 . 2]" 1
2150 1 87 PRO QD 1 88 LYS H . . 5.720 2.960 2.664 3.139 . 0 0 "[ . 1 . 2]" 1
2151 1 87 PRO HD2 1 88 LYS H . . 5.500 3.040 2.706 3.244 . 0 0 "[ . 1 . 2]" 1
2152 1 87 PRO HD3 1 88 LYS H . . 5.500 4.084 3.898 4.321 . 0 0 "[ . 1 . 2]" 1
2153 1 87 PRO QG 1 88 LYS H . . 5.900 2.821 2.363 3.986 . 0 0 "[ . 1 . 2]" 1
2154 1 88 LYS H 1 88 LYS QD . . 5.950 3.401 1.877 3.915 . 0 0 "[ . 1 . 2]" 1
2155 1 88 LYS H 1 88 LYS QE . . 6.760 4.345 3.317 4.993 . 0 0 "[ . 1 . 2]" 1
2156 1 88 LYS H 1 89 ARG H . . 4.660 2.560 2.443 2.715 . 0 0 "[ . 1 . 2]" 1
2157 1 88 LYS H 1 90 TRP H . . 5.500 3.929 3.705 4.195 . 0 0 "[ . 1 . 2]" 1
2158 1 88 LYS HA 1 90 TRP H . . 5.100 3.807 3.466 4.135 . 0 0 "[ . 1 . 2]" 1
2159 1 88 LYS HA 1 91 LEU H . . 5.500 4.647 3.752 5.450 . 0 0 "[ . 1 . 2]" 1
2160 1 88 LYS HA 1 91 LEU QD . . 6.710 3.772 2.967 5.003 . 0 0 "[ . 1 . 2]" 1
2161 1 88 LYS HB2 1 88 LYS QE . . 4.690 2.420 1.843 3.990 . 0 0 "[ . 1 . 2]" 1
2162 1 88 LYS HB3 1 88 LYS QE . . 4.690 2.684 1.847 3.961 . 0 0 "[ . 1 . 2]" 1
2163 1 88 LYS QG 1 89 ARG H . . 6.080 2.918 2.346 3.324 . 0 0 "[ . 1 . 2]" 1
2164 1 88 LYS QG 1 89 ARG HD2 . . 6.140 4.946 4.203 6.142 0.002 5 0 "[ . 1 . 2]" 1
2165 1 88 LYS QG 1 89 ARG QD . . 6.390 4.167 3.727 4.673 . 0 0 "[ . 1 . 2]" 1
2166 1 88 LYS QG 1 89 ARG HD3 . . 6.140 4.669 3.830 5.659 . 0 0 "[ . 1 . 2]" 1
2167 1 88 LYS QG 1 90 TRP H . . 6.640 4.610 4.353 4.830 . 0 0 "[ . 1 . 2]" 1
2168 1 89 ARG H 1 89 ARG HD2 . . 6.170 5.201 4.724 6.287 0.117 11 0 "[ . 1 . 2]" 1
2169 1 89 ARG H 1 89 ARG QD . . 6.230 4.536 4.042 5.056 . 0 0 "[ . 1 . 2]" 1
2170 1 89 ARG H 1 89 ARG HD3 . . 6.170 5.119 4.236 5.633 . 0 0 "[ . 1 . 2]" 1
2171 1 89 ARG H 1 89 ARG HG2 . . 4.970 3.788 3.033 4.854 . 0 0 "[ . 1 . 2]" 1
2172 1 89 ARG H 1 89 ARG HG3 . . 4.970 3.644 2.887 4.648 . 0 0 "[ . 1 . 2]" 1
2173 1 89 ARG H 1 90 TRP H . . 3.780 2.026 1.808 2.335 . 0 0 "[ . 1 . 2]" 1
2174 1 89 ARG H 1 90 TRP HA . . 5.020 4.361 4.002 4.783 . 0 0 "[ . 1 . 2]" 1
2175 1 89 ARG H 1 90 TRP HB2 . . 6.420 4.030 3.737 4.548 . 0 0 "[ . 1 . 2]" 1
2176 1 89 ARG H 1 90 TRP QB . . 6.540 3.662 3.436 4.057 . 0 0 "[ . 1 . 2]" 1
2177 1 89 ARG H 1 90 TRP HB3 . . 6.420 4.213 4.011 4.560 . 0 0 "[ . 1 . 2]" 1
2178 1 89 ARG HA 1 89 ARG HD2 . . 4.590 4.025 2.860 4.651 0.061 7 0 "[ . 1 . 2]" 1
2179 1 89 ARG HA 1 89 ARG QD . . 4.910 3.259 1.782 3.971 . 0 0 "[ . 1 . 2]" 1
2180 1 89 ARG HA 1 89 ARG HD3 . . 4.590 3.559 1.796 4.637 0.047 18 0 "[ . 1 . 2]" 1
2181 1 89 ARG HA 1 92 ASP H . . 4.980 3.404 2.910 3.867 . 0 0 "[ . 1 . 2]" 1
2182 1 89 ARG HA 1 92 ASP QB . . 5.410 3.707 2.403 4.831 . 0 0 "[ . 1 . 2]" 1
2183 1 89 ARG QG 1 90 TRP H . . 5.640 4.445 4.273 4.607 . 0 0 "[ . 1 . 2]" 1
2184 1 89 ARG HG2 1 90 TRP H . . 5.490 4.984 4.564 5.453 . 0 0 "[ . 1 . 2]" 1
2185 1 89 ARG HG3 1 90 TRP H . . 5.490 5.089 4.623 5.618 0.128 10 0 "[ . 1 . 2]" 1
2186 1 90 TRP H 1 90 TRP HD1 . . 5.690 4.872 4.709 5.002 . 0 0 "[ . 1 . 2]" 1
2187 1 90 TRP H 1 90 TRP HE3 . . 6.120 4.773 4.614 4.969 . 0 0 "[ . 1 . 2]" 1
2188 1 90 TRP H 1 91 LEU H . . 4.550 2.533 2.414 2.685 . 0 0 "[ . 1 . 2]" 1
2189 1 90 TRP HA 1 90 TRP HE3 . . 4.420 2.556 2.109 2.741 . 0 0 "[ . 1 . 2]" 1
2190 1 90 TRP HA 1 93 PHE H . . 5.500 3.424 3.273 3.556 . 0 0 "[ . 1 . 2]" 1
2191 1 90 TRP HA 1 93 PHE HB2 . . 5.210 3.612 3.163 4.025 . 0 0 "[ . 1 . 2]" 1
2192 1 90 TRP HA 1 93 PHE QB . . 5.430 2.661 2.355 3.139 . 0 0 "[ . 1 . 2]" 1
2193 1 90 TRP HA 1 93 PHE HB3 . . 5.210 2.743 2.409 3.275 . 0 0 "[ . 1 . 2]" 1
2194 1 90 TRP HA 1 94 TYR H . . 5.620 3.930 3.683 4.268 . 0 0 "[ . 1 . 2]" 1
2195 1 90 TRP QB 1 91 LEU QB . . 7.000 4.667 4.449 4.783 . 0 0 "[ . 1 . 2]" 1
2196 1 90 TRP QB 1 91 LEU QD . . 9.150 3.250 2.295 3.960 . 0 0 "[ . 1 . 2]" 1
2197 1 90 TRP HB2 1 91 LEU H . . 5.760 4.041 3.939 4.157 . 0 0 "[ . 1 . 2]" 1
2198 1 90 TRP HB3 1 91 LEU H . . 5.760 2.842 2.648 2.984 . 0 0 "[ . 1 . 2]" 1
2199 1 90 TRP HD1 1 91 LEU H . . 5.310 4.176 3.712 4.713 . 0 0 "[ . 1 . 2]" 1
2200 1 90 TRP HD1 1 91 LEU HA . . 5.260 3.905 3.362 4.678 . 0 0 "[ . 1 . 2]" 1
2201 1 90 TRP HD1 1 91 LEU MD1 . . 6.440 4.480 2.292 5.692 . 0 0 "[ . 1 . 2]" 1
2202 1 90 TRP HD1 1 91 LEU QD . . 6.080 3.086 2.254 3.745 . 0 0 "[ . 1 . 2]" 1
2203 1 90 TRP HD1 1 91 LEU MD2 . . 6.440 3.612 2.480 4.780 . 0 0 "[ . 1 . 2]" 1
2204 1 90 TRP HD1 1 91 LEU HG . . 5.070 4.283 3.332 5.220 0.150 20 0 "[ . 1 . 2]" 1
2205 1 90 TRP HE1 1 91 LEU HA . . 6.500 5.338 4.665 5.991 . 0 0 "[ . 1 . 2]" 1
2206 1 90 TRP HE1 1 91 LEU MD1 . . 7.520 6.374 3.833 7.568 0.048 18 0 "[ . 1 . 2]" 1
2207 1 90 TRP HE1 1 91 LEU QD . . 7.090 4.765 3.761 5.481 . 0 0 "[ . 1 . 2]" 1
2208 1 90 TRP HE1 1 91 LEU MD2 . . 7.520 5.316 4.467 6.297 . 0 0 "[ . 1 . 2]" 1
2209 1 90 TRP HE1 1 94 TYR QB . . 6.220 3.500 2.909 4.500 . 0 0 "[ . 1 . 2]" 1
2210 1 90 TRP HE1 1 94 TYR QD . . 6.990 4.096 3.012 5.180 . 0 0 "[ . 1 . 2]" 1
2211 1 90 TRP HE1 1 94 TYR QE . . 7.530 5.212 3.826 6.229 . 0 0 "[ . 1 . 2]" 1
2212 1 90 TRP HE3 1 93 PHE H . . 5.580 5.424 4.675 5.660 0.080 4 0 "[ . 1 . 2]" 1
2213 1 90 TRP HH2 1 93 PHE QE . . 7.960 3.285 2.841 3.836 . 0 0 "[ . 1 . 2]" 1
2214 1 90 TRP HZ2 1 94 TYR QB . . 6.080 4.345 3.583 5.235 . 0 0 "[ . 1 . 2]" 1
2215 1 90 TRP HZ2 1 94 TYR QD . . 6.410 3.910 2.782 4.999 . 0 0 "[ . 1 . 2]" 1
2216 1 91 LEU H 1 91 LEU MD1 . . 5.600 3.083 1.790 3.674 . 0 0 "[ . 1 . 2]" 1
2217 1 91 LEU H 1 91 LEU MD2 . . 5.600 3.250 1.763 4.031 . 0 0 "[ . 1 . 2]" 1
2218 1 91 LEU H 1 91 LEU HG . . 3.560 2.741 2.069 3.914 0.354 3 0 "[ . 1 . 2]" 1
2219 1 91 LEU H 1 92 ASP H . . 4.020 2.655 2.449 2.848 . 0 0 "[ . 1 . 2]" 1
2220 1 91 LEU HA 1 94 TYR H . . 5.010 3.452 3.080 3.633 . 0 0 "[ . 1 . 2]" 1
2221 1 91 LEU HA 1 94 TYR HA . . 5.500 5.319 4.782 5.576 0.076 12 0 "[ . 1 . 2]" 1
2222 1 91 LEU HA 1 94 TYR HB2 . . 4.380 3.479 2.785 3.862 . 0 0 "[ . 1 . 2]" 1
2223 1 91 LEU HA 1 94 TYR HB3 . . 4.380 2.615 2.181 2.984 . 0 0 "[ . 1 . 2]" 1
2224 1 91 LEU HA 1 94 TYR QD . . 7.380 3.886 3.392 4.500 . 0 0 "[ . 1 . 2]" 1
2225 1 91 LEU HA 1 95 ALA H . . 5.720 3.944 3.632 4.305 . 0 0 "[ . 1 . 2]" 1
2226 1 91 LEU QB 1 92 ASP H . . 4.870 2.557 2.273 2.874 . 0 0 "[ . 1 . 2]" 1
2227 1 91 LEU HB2 1 92 ASP H . . 4.740 2.616 2.304 2.968 . 0 0 "[ . 1 . 2]" 1
2228 1 91 LEU HB3 1 92 ASP H . . 4.740 3.614 3.353 3.845 . 0 0 "[ . 1 . 2]" 1
2229 1 91 LEU QD 1 94 TYR H . . 7.690 4.860 4.431 5.311 . 0 0 "[ . 1 . 2]" 1
2230 1 91 LEU QD 1 94 TYR QB . . 7.670 3.669 3.142 4.381 . 0 0 "[ . 1 . 2]" 1
2231 1 91 LEU QD 1 94 TYR QD . . 8.910 4.097 3.302 4.796 . 0 0 "[ . 1 . 2]" 1
2232 1 91 LEU QD 1 94 TYR QE . . 10.100 5.255 4.511 6.020 . 0 0 "[ . 1 . 2]" 1
2233 1 91 LEU QD 1 95 ALA H . . 7.470 5.116 4.629 5.605 . 0 0 "[ . 1 . 2]" 1
2234 1 91 LEU MD1 1 92 ASP H . . 6.590 4.302 3.748 4.687 . 0 0 "[ . 1 . 2]" 1
2235 1 91 LEU MD1 1 94 TYR QD . . 9.270 5.658 3.328 6.822 . 0 0 "[ . 1 . 2]" 1
2236 1 91 LEU MD1 1 95 ALA H . . 7.420 6.276 4.883 6.735 . 0 0 "[ . 1 . 2]" 1
2237 1 91 LEU MD2 1 92 ASP H . . 6.590 4.573 3.798 4.993 . 0 0 "[ . 1 . 2]" 1
2238 1 91 LEU MD2 1 94 TYR QD . . 9.270 4.491 3.496 6.305 . 0 0 "[ . 1 . 2]" 1
2239 1 91 LEU MD2 1 95 ALA H . . 7.420 5.580 4.769 6.539 . 0 0 "[ . 1 . 2]" 1
2240 1 92 ASP H 1 93 PHE H . . 3.760 2.664 2.484 2.803 . 0 0 "[ . 1 . 2]" 1
2241 1 92 ASP H 1 94 TYR H . . 5.690 4.119 3.820 4.379 . 0 0 "[ . 1 . 2]" 1
2242 1 92 ASP H 1 95 ALA MB . . 6.520 4.819 4.623 5.128 . 0 0 "[ . 1 . 2]" 1
2243 1 92 ASP HA 1 95 ALA H . . 4.770 3.671 3.185 4.155 . 0 0 "[ . 1 . 2]" 1
2244 1 92 ASP HA 1 95 ALA MB . . 4.880 2.912 2.379 3.447 . 0 0 "[ . 1 . 2]" 1
2245 1 92 ASP HA 1 96 ALA H . . 5.190 4.210 3.823 4.622 . 0 0 "[ . 1 . 2]" 1
2246 1 92 ASP QB 1 95 ALA MB . . 7.180 4.374 3.932 4.852 . 0 0 "[ . 1 . 2]" 1
2247 1 92 ASP HB2 1 93 PHE H . . 4.600 2.728 2.301 3.965 . 0 0 "[ . 1 . 2]" 1
2248 1 92 ASP HB3 1 93 PHE H . . 4.600 3.477 2.270 4.112 . 0 0 "[ . 1 . 2]" 1
2249 1 93 PHE H 1 94 TYR H . . 4.340 2.659 2.544 2.794 . 0 0 "[ . 1 . 2]" 1
2250 1 93 PHE H 1 95 ALA MB . . 7.520 4.881 4.658 5.086 . 0 0 "[ . 1 . 2]" 1
2251 1 93 PHE H 1 96 ALA H . . 5.510 4.811 4.572 5.040 . 0 0 "[ . 1 . 2]" 1
2252 1 93 PHE HA 1 96 ALA H . . 4.790 3.560 3.394 3.814 . 0 0 "[ . 1 . 2]" 1
2253 1 93 PHE HA 1 96 ALA MB . . 5.220 2.757 2.308 3.014 . 0 0 "[ . 1 . 2]" 1
2254 1 93 PHE HA 1 97 MET H . . 5.520 4.148 3.810 4.569 . 0 0 "[ . 1 . 2]" 1
2255 1 93 PHE QB 1 94 TYR H . . 5.060 2.492 2.341 2.602 . 0 0 "[ . 1 . 2]" 1
2256 1 93 PHE HB2 1 94 TYR H . . 4.950 3.845 3.752 3.925 . 0 0 "[ . 1 . 2]" 1
2257 1 93 PHE HB3 1 94 TYR H . . 4.950 2.525 2.364 2.645 . 0 0 "[ . 1 . 2]" 1
2258 1 93 PHE QD 1 94 TYR H . . 7.320 3.533 3.215 4.021 . 0 0 "[ . 1 . 2]" 1
2259 1 93 PHE QD 1 94 TYR HA . . 7.660 3.639 3.276 4.324 . 0 0 "[ . 1 . 2]" 1
2260 1 93 PHE QD 1 96 ALA MB . . 9.120 3.886 3.352 4.386 . 0 0 "[ . 1 . 2]" 1
2261 1 93 PHE QD 1 97 MET ME . . 9.380 4.927 3.895 5.801 . 0 0 "[ . 1 . 2]" 1
2262 1 93 PHE QE 1 97 MET ME . . 7.950 3.589 2.545 4.364 . 0 0 "[ . 1 . 2]" 1
2263 1 93 PHE QE 1 97 MET HG2 . . 7.650 4.286 3.105 6.143 . 0 0 "[ . 1 . 2]" 1
2264 1 93 PHE QE 1 97 MET HG3 . . 7.650 3.785 2.837 5.824 . 0 0 "[ . 1 . 2]" 1
2265 1 93 PHE HZ 1 97 MET ME . . 5.380 3.563 2.120 4.382 . 0 0 "[ . 1 . 2]" 1
2266 1 93 PHE HZ 1 97 MET QG . . 6.180 3.882 3.174 5.688 . 0 0 "[ . 1 . 2]" 1
2267 1 94 TYR H 1 94 TYR HB2 . . 4.120 2.532 2.345 2.700 . 0 0 "[ . 1 . 2]" 1
2268 1 94 TYR H 1 94 TYR HB3 . . 4.120 2.523 2.399 2.714 . 0 0 "[ . 1 . 2]" 1
2269 1 94 TYR H 1 95 ALA H . . 4.330 2.751 2.677 2.901 . 0 0 "[ . 1 . 2]" 1
2270 1 94 TYR H 1 95 ALA MB . . 6.440 4.409 4.322 4.552 . 0 0 "[ . 1 . 2]" 1
2271 1 94 TYR H 1 96 ALA H . . 5.690 4.279 4.081 4.450 . 0 0 "[ . 1 . 2]" 1
2272 1 94 TYR H 1 96 ALA MB . . 7.210 4.903 4.640 5.115 . 0 0 "[ . 1 . 2]" 1
2273 1 94 TYR HA 1 95 ALA HA . . 5.500 4.793 4.748 4.831 . 0 0 "[ . 1 . 2]" 1
2274 1 94 TYR HA 1 96 ALA H . . 6.030 4.583 4.245 4.820 . 0 0 "[ . 1 . 2]" 1
2275 1 94 TYR HA 1 97 MET H . . 5.160 3.583 3.328 3.999 . 0 0 "[ . 1 . 2]" 1
2276 1 94 TYR HA 1 97 MET QB . . 5.060 2.823 2.292 3.803 . 0 0 "[ . 1 . 2]" 1
2277 1 94 TYR HA 1 97 MET ME . . 6.750 5.096 4.173 6.378 . 0 0 "[ . 1 . 2]" 1
2278 1 94 TYR HA 1 97 MET QG . . 6.180 3.847 2.818 5.744 . 0 0 "[ . 1 . 2]" 1
2279 1 94 TYR HA 1 98 THR H . . 5.640 4.085 3.886 4.326 . 0 0 "[ . 1 . 2]" 1
2280 1 94 TYR QB 1 95 ALA H . . 4.950 2.536 2.276 2.687 . 0 0 "[ . 1 . 2]" 1
2281 1 94 TYR QB 1 95 ALA MB . . 7.900 3.868 3.724 3.992 . 0 0 "[ . 1 . 2]" 1
2282 1 94 TYR HB2 1 95 ALA H . . 4.860 3.876 3.716 3.965 . 0 0 "[ . 1 . 2]" 1
2283 1 94 TYR HB3 1 95 ALA H . . 4.860 2.571 2.297 2.732 . 0 0 "[ . 1 . 2]" 1
2284 1 94 TYR QD 1 95 ALA H . . 7.170 3.661 3.108 4.017 . 0 0 "[ . 1 . 2]" 1
2285 1 94 TYR QD 1 95 ALA HA . . 7.190 3.825 3.202 4.256 . 0 0 "[ . 1 . 2]" 1
2286 1 94 TYR QD 1 95 ALA MB . . 8.650 3.972 3.451 4.354 . 0 0 "[ . 1 . 2]" 1
2287 1 94 TYR QD 1 98 THR MG . . 8.300 3.906 3.215 5.277 . 0 0 "[ . 1 . 2]" 1
2288 1 94 TYR QE 1 95 ALA H . . 7.500 5.640 5.268 6.056 . 0 0 "[ . 1 . 2]" 1
2289 1 94 TYR QE 1 95 ALA MB . . 8.930 5.379 4.778 5.934 . 0 0 "[ . 1 . 2]" 1
2290 1 94 TYR QE 1 98 THR H . . 8.090 5.467 4.972 5.914 . 0 0 "[ . 1 . 2]" 1
2291 1 94 TYR QE 1 98 THR MG . . 7.380 3.508 2.767 4.612 . 0 0 "[ . 1 . 2]" 1
2292 1 95 ALA H 1 96 ALA H . . 4.060 2.725 2.613 2.826 . 0 0 "[ . 1 . 2]" 1
2293 1 95 ALA HA 1 98 THR H . . 5.030 3.605 3.348 3.880 . 0 0 "[ . 1 . 2]" 1
2294 1 95 ALA HA 1 98 THR MG . . 6.480 3.163 1.798 4.443 . 0 0 "[ . 1 . 2]" 1
2295 1 95 ALA HA 1 99 GLU H . . 5.370 4.142 3.749 4.484 . 0 0 "[ . 1 . 2]" 1
2296 1 95 ALA MB 1 96 ALA H . . 4.720 2.426 2.304 2.720 . 0 0 "[ . 1 . 2]" 1
2297 1 95 ALA MB 1 98 THR H . . 6.420 4.720 4.541 5.027 . 0 0 "[ . 1 . 2]" 1
2298 1 95 ALA MB 1 99 GLU H . . 6.520 4.706 4.350 5.107 . 0 0 "[ . 1 . 2]" 1
2299 1 96 ALA H 1 97 MET H . . 3.940 2.720 2.598 2.909 . 0 0 "[ . 1 . 2]" 1
2300 1 96 ALA H 1 97 MET HA . . 5.940 5.313 5.212 5.428 . 0 0 "[ . 1 . 2]" 1
2301 1 96 ALA H 1 98 THR H . . 5.830 4.305 4.070 4.533 . 0 0 "[ . 1 . 2]" 1
2302 1 96 ALA HA 1 98 THR H . . 5.740 4.627 4.452 4.836 . 0 0 "[ . 1 . 2]" 1
2303 1 96 ALA HA 1 99 GLU H . . 4.780 3.838 3.393 4.135 . 0 0 "[ . 1 . 2]" 1
2304 1 96 ALA HA 1 99 GLU QB . . 4.980 3.132 2.580 3.659 . 0 0 "[ . 1 . 2]" 1
2305 1 96 ALA MB 1 97 MET H . . 5.150 2.544 2.393 2.663 . 0 0 "[ . 1 . 2]" 1
2306 1 96 ALA MB 1 99 GLU H . . 6.510 4.840 4.540 5.050 . 0 0 "[ . 1 . 2]" 1
2307 1 96 ALA MB 1 100 PHE H . . 7.070 4.878 4.430 5.281 . 0 0 "[ . 1 . 2]" 1
2308 1 97 MET H 1 97 MET ME . . 6.330 4.904 4.329 5.874 . 0 0 "[ . 1 . 2]" 1
2309 1 97 MET H 1 97 MET HG2 . . 4.690 3.341 2.269 4.605 . 0 0 "[ . 1 . 2]" 1
2310 1 97 MET H 1 97 MET QG . . 5.000 2.915 2.247 4.042 . 0 0 "[ . 1 . 2]" 1
2311 1 97 MET H 1 97 MET HG3 . . 4.690 3.643 2.578 4.535 . 0 0 "[ . 1 . 2]" 1
2312 1 97 MET H 1 98 THR H . . 4.120 2.664 2.447 2.783 . 0 0 "[ . 1 . 2]" 1
2313 1 97 MET H 1 98 THR HA . . 5.720 5.254 5.070 5.357 . 0 0 "[ . 1 . 2]" 1
2314 1 97 MET H 1 98 THR MG . . 6.730 4.575 3.910 6.009 . 0 0 "[ . 1 . 2]" 1
2315 1 97 MET HA 1 97 MET ME . . 5.420 3.713 3.181 4.613 . 0 0 "[ . 1 . 2]" 1
2316 1 97 MET HA 1 100 PHE H . . 5.050 3.532 3.105 3.766 . 0 0 "[ . 1 . 2]" 1
2317 1 97 MET HA 1 100 PHE QB . . 5.210 2.857 1.997 3.231 . 0 0 "[ . 1 . 2]" 1
2318 1 97 MET HA 1 100 PHE QD . . 7.140 4.159 3.476 4.695 . 0 0 "[ . 1 . 2]" 1
2319 1 97 MET HA 1 101 LEU H . . 5.440 3.532 3.176 3.909 . 0 0 "[ . 1 . 2]" 1
2320 1 97 MET HA 1 101 LEU QD . . 7.430 3.063 1.904 5.333 . 0 0 "[ . 1 . 2]" 1
2321 1 97 MET QB 1 98 THR H . . 5.010 2.612 2.444 2.941 . 0 0 "[ . 1 . 2]" 1
2322 1 97 MET QB 1 98 THR HB . . 6.250 4.689 3.806 5.559 . 0 0 "[ . 1 . 2]" 1
2323 1 97 MET ME 1 98 THR H . . 7.150 5.168 4.748 5.755 . 0 0 "[ . 1 . 2]" 1
2324 1 97 MET ME 1 98 THR HA . . 6.310 5.286 4.500 6.130 . 0 0 "[ . 1 . 2]" 1
2325 1 97 MET ME 1 100 PHE HB2 . . 7.050 6.512 5.800 7.067 0.017 20 0 "[ . 1 . 2]" 1
2326 1 97 MET ME 1 100 PHE QB . . 7.180 5.003 4.287 5.551 . 0 0 "[ . 1 . 2]" 1
2327 1 97 MET ME 1 100 PHE HB3 . . 7.050 5.201 4.416 5.804 . 0 0 "[ . 1 . 2]" 1
2328 1 97 MET ME 1 100 PHE QE . . 8.650 5.903 3.898 6.520 . 0 0 "[ . 1 . 2]" 1
2329 1 97 MET ME 1 101 LEU H . . 7.130 4.897 3.968 5.786 . 0 0 "[ . 1 . 2]" 1
2330 1 97 MET ME 1 101 LEU QD . . 6.410 2.235 1.801 3.115 . 0 0 "[ . 1 . 2]" 1
2331 1 97 MET QG 1 98 THR H . . 6.500 4.053 3.154 4.332 . 0 0 "[ . 1 . 2]" 1
2332 1 97 MET QG 1 101 LEU QD . . 7.430 3.105 1.737 4.163 . 0 0 "[ . 1 . 2]" 1
2333 1 98 THR H 1 99 GLU H . . 4.150 2.629 2.550 2.786 . 0 0 "[ . 1 . 2]" 1
2334 1 98 THR H 1 99 GLU QB . . 6.370 4.633 4.333 4.803 . 0 0 "[ . 1 . 2]" 1
2335 1 98 THR H 1 101 LEU H . . 5.240 4.733 4.543 4.854 . 0 0 "[ . 1 . 2]" 1
2336 1 98 THR HA 1 99 GLU QB . . 6.740 5.398 5.112 5.462 . 0 0 "[ . 1 . 2]" 1
2337 1 98 THR HA 1 100 PHE H . . 5.470 4.241 3.931 4.709 . 0 0 "[ . 1 . 2]" 1
2338 1 98 THR HA 1 101 LEU H . . 4.890 3.661 3.229 4.132 . 0 0 "[ . 1 . 2]" 1
2339 1 98 THR HA 1 101 LEU QB . . 5.210 3.272 2.700 4.103 . 0 0 "[ . 1 . 2]" 1
2340 1 98 THR HA 1 101 LEU MD1 . . 7.230 4.932 3.598 6.171 . 0 0 "[ . 1 . 2]" 1
2341 1 98 THR HA 1 101 LEU QD . . 7.030 4.186 3.540 4.895 . 0 0 "[ . 1 . 2]" 1
2342 1 98 THR HA 1 101 LEU MD2 . . 7.230 5.072 3.955 6.141 . 0 0 "[ . 1 . 2]" 1
2343 1 98 THR HA 1 102 GLY H . . 5.240 3.198 3.081 3.433 . 0 0 "[ . 1 . 2]" 1
2344 1 98 THR HA 1 103 LEU H . . 5.580 5.719 5.646 5.802 0.222 1 0 "[ . 1 . 2]" 1
2345 1 98 THR HB 1 99 GLU H . . 4.530 3.664 2.607 4.178 . 0 0 "[ . 1 . 2]" 1
2346 1 98 THR MG 1 99 GLU H . . 5.840 3.234 2.267 4.174 . 0 0 "[ . 1 . 2]" 1
2347 1 98 THR MG 1 99 GLU HA . . 6.520 4.160 3.283 5.487 . 0 0 "[ . 1 . 2]" 1
2348 1 98 THR MG 1 99 GLU HG2 . . 5.970 4.590 3.091 6.035 0.065 9 0 "[ . 1 . 2]" 1
2349 1 98 THR MG 1 99 GLU QG . . 6.170 3.878 2.538 5.083 . 0 0 "[ . 1 . 2]" 1
2350 1 98 THR MG 1 99 GLU HG3 . . 5.970 4.296 2.654 5.849 . 0 0 "[ . 1 . 2]" 1
2351 1 98 THR MG 1 100 PHE H . . 7.520 4.912 4.243 5.745 . 0 0 "[ . 1 . 2]" 1
2352 1 99 GLU H 1 99 GLU HG2 . . 4.330 3.400 2.478 4.490 0.160 11 0 "[ . 1 . 2]" 1
2353 1 99 GLU H 1 99 GLU QG . . 4.610 2.533 2.262 3.983 . 0 0 "[ . 1 . 2]" 1
2354 1 99 GLU H 1 99 GLU HG3 . . 4.330 2.733 2.293 4.452 0.122 11 0 "[ . 1 . 2]" 1
2355 1 99 GLU H 1 100 PHE H . . 3.780 2.565 2.438 2.729 . 0 0 "[ . 1 . 2]" 1
2356 1 99 GLU H 1 101 LEU H . . 5.770 4.380 4.159 4.541 . 0 0 "[ . 1 . 2]" 1
2357 1 99 GLU H 1 101 LEU QD . . 8.500 5.423 4.725 6.510 . 0 0 "[ . 1 . 2]" 1
2358 1 99 GLU HA 1 99 GLU HG2 . . 3.760 2.585 2.331 3.645 . 0 0 "[ . 1 . 2]" 1
2359 1 99 GLU HA 1 99 GLU HG3 . . 3.760 3.181 2.312 3.733 . 0 0 "[ . 1 . 2]" 1
2360 1 99 GLU HA 1 101 LEU H . . 5.960 5.111 4.891 5.310 . 0 0 "[ . 1 . 2]" 1
2361 1 99 GLU HA 1 102 GLY H . . 4.550 4.122 3.843 4.365 . 0 0 "[ . 1 . 2]" 1
2362 1 99 GLU HA 1 103 LEU QD . . 7.130 4.211 3.705 5.082 . 0 0 "[ . 1 . 2]" 1
2363 1 99 GLU QB 1 100 PHE H . . 5.150 2.656 2.355 2.895 . 0 0 "[ . 1 . 2]" 1
2364 1 99 GLU QG 1 100 PHE H . . 5.210 4.134 3.937 4.449 . 0 0 "[ . 1 . 2]" 1
2365 1 99 GLU HG2 1 100 PHE H . . 4.940 4.914 4.510 5.038 0.098 1 0 "[ . 1 . 2]" 1
2366 1 99 GLU HG3 1 100 PHE H . . 4.940 4.473 4.185 5.005 0.065 3 0 "[ . 1 . 2]" 1
2367 1 100 PHE H 1 100 PHE HB2 . . 4.150 2.636 2.402 2.779 . 0 0 "[ . 1 . 2]" 1
2368 1 100 PHE H 1 100 PHE HB3 . . 4.150 2.502 2.364 2.585 . 0 0 "[ . 1 . 2]" 1
2369 1 100 PHE H 1 101 LEU H . . 4.380 2.646 2.550 2.995 . 0 0 "[ . 1 . 2]" 1
2370 1 100 PHE H 1 101 LEU QD . . 8.320 4.205 3.543 5.444 . 0 0 "[ . 1 . 2]" 1
2371 1 100 PHE H 1 103 LEU QD . . 7.540 4.729 4.329 5.220 . 0 0 "[ . 1 . 2]" 1
2372 1 100 PHE HA 1 102 GLY H . . 6.340 4.360 3.949 4.686 . 0 0 "[ . 1 . 2]" 1
2373 1 100 PHE HA 1 103 LEU H . . 5.610 4.064 3.760 4.515 . 0 0 "[ . 1 . 2]" 1
2374 1 100 PHE HA 1 103 LEU MD1 . . 5.890 2.890 2.470 3.781 . 0 0 "[ . 1 . 2]" 1
2375 1 100 PHE HA 1 103 LEU QD . . 6.300 2.777 2.402 3.150 . 0 0 "[ . 1 . 2]" 1
2376 1 100 PHE HA 1 103 LEU MD2 . . 5.890 4.551 2.447 5.224 . 0 0 "[ . 1 . 2]" 1
2377 1 100 PHE QB 1 101 LEU QD . . 8.550 2.761 1.983 4.446 . 0 0 "[ . 1 . 2]" 1
2378 1 100 PHE QB 1 103 LEU QD . . 8.920 4.328 3.917 4.677 . 0 0 "[ . 1 . 2]" 1
2379 1 100 PHE HB2 1 101 LEU H . . 5.340 3.755 3.681 3.813 . 0 0 "[ . 1 . 2]" 1
2380 1 100 PHE HB3 1 101 LEU H . . 5.340 2.346 2.260 2.509 . 0 0 "[ . 1 . 2]" 1
2381 1 100 PHE QD 1 101 LEU H . . 7.390 3.325 3.029 3.703 . 0 0 "[ . 1 . 2]" 1
2382 1 100 PHE QD 1 101 LEU QD . . 8.610 2.042 1.653 3.228 . 0 0 "[ . 1 . 2]" 1
2383 1 100 PHE QD 1 101 LEU HG . . 7.250 3.461 2.247 4.865 . 0 0 "[ . 1 . 2]" 1
2384 1 100 PHE QD 1 103 LEU MD1 . . 8.510 3.668 2.771 4.471 . 0 0 "[ . 1 . 2]" 1
2385 1 100 PHE QD 1 103 LEU QD . . 8.580 3.568 2.761 4.363 . 0 0 "[ . 1 . 2]" 1
2386 1 100 PHE QD 1 103 LEU MD2 . . 8.510 5.746 3.296 6.716 . 0 0 "[ . 1 . 2]" 1
2387 1 100 PHE QE 1 101 LEU QD . . 9.070 3.076 2.513 3.551 . 0 0 "[ . 1 . 2]" 1
2388 1 100 PHE QE 1 103 LEU MD1 . . 9.450 4.600 3.590 5.730 . 0 0 "[ . 1 . 2]" 1
2389 1 100 PHE QE 1 103 LEU QD . . 9.250 4.503 3.566 5.602 . 0 0 "[ . 1 . 2]" 1
2390 1 100 PHE QE 1 103 LEU MD2 . . 9.450 6.737 4.375 7.903 . 0 0 "[ . 1 . 2]" 1
2391 1 100 PHE HZ 1 101 LEU QD . . 7.540 4.792 4.247 5.298 . 0 0 "[ . 1 . 2]" 1
2392 1 100 PHE HZ 1 103 LEU QD . . 8.220 5.946 4.839 7.080 . 0 0 "[ . 1 . 2]" 1
2393 1 101 LEU H 1 101 LEU HG . . 4.290 3.456 2.359 4.464 0.174 15 0 "[ . 1 . 2]" 1
2394 1 101 LEU H 1 102 GLY H . . 4.150 2.520 2.390 2.705 . 0 0 "[ . 1 . 2]" 1
2395 1 101 LEU H 1 103 LEU H . . 5.320 4.080 3.977 4.313 . 0 0 "[ . 1 . 2]" 1
2396 1 101 LEU HA 1 103 LEU H . . 5.650 3.532 3.027 4.018 . 0 0 "[ . 1 . 2]" 1
2397 1 101 LEU HA 1 103 LEU QD . . 7.160 5.084 3.825 5.570 . 0 0 "[ . 1 . 2]" 1
2398 1 101 LEU HA 1 104 PHE H . . 4.880 3.381 2.921 3.786 . 0 0 "[ . 1 . 2]" 1
2399 1 101 LEU HA 1 104 PHE HB2 . . 5.550 3.242 2.638 3.960 . 0 0 "[ . 1 . 2]" 1
2400 1 101 LEU HA 1 104 PHE HB3 . . 5.550 4.839 4.323 5.336 . 0 0 "[ . 1 . 2]" 1
2401 1 101 LEU HA 1 104 PHE QD . . 6.220 2.075 1.741 3.335 . 0 0 "[ . 1 . 2]" 1
2402 1 101 LEU HA 1 104 PHE QE . . 7.630 3.536 2.279 5.161 . 0 0 "[ . 1 . 2]" 1
2403 1 101 LEU QB 1 103 LEU H . . 5.910 4.446 4.277 4.631 . 0 0 "[ . 1 . 2]" 1
2404 1 101 LEU HB2 1 102 GLY H . . 5.210 3.135 2.797 3.781 . 0 0 "[ . 1 . 2]" 1
2405 1 101 LEU HB3 1 102 GLY H . . 5.210 3.788 2.760 4.128 . 0 0 "[ . 1 . 2]" 1
2406 1 101 LEU QD 1 102 GLY H . . 7.150 3.991 3.543 4.356 . 0 0 "[ . 1 . 2]" 1
2407 1 101 LEU QD 1 103 LEU H . . 7.540 4.724 4.167 5.196 . 0 0 "[ . 1 . 2]" 1
2408 1 101 LEU QD 1 104 PHE H . . 7.540 4.568 3.401 5.293 . 0 0 "[ . 1 . 2]" 1
2409 1 101 LEU QD 1 104 PHE QB . . 7.830 3.531 2.464 4.573 . 0 0 "[ . 1 . 2]" 1
2410 1 101 LEU QD 1 104 PHE QD . . 9.440 3.169 2.414 4.056 . 0 0 "[ . 1 . 2]" 1
2411 1 101 LEU MD1 1 102 GLY H . . 6.890 4.575 3.696 5.172 . 0 0 "[ . 1 . 2]" 1
2412 1 101 LEU MD2 1 102 GLY H . . 6.890 4.568 3.887 5.276 . 0 0 "[ . 1 . 2]" 1
2413 1 101 LEU HG 1 102 GLY H . . 5.870 5.039 4.500 5.460 . 0 0 "[ . 1 . 2]" 1
2414 1 102 GLY H 1 103 LEU H . . 3.640 2.585 2.472 2.665 . 0 0 "[ . 1 . 2]" 1
2415 1 102 GLY H 1 103 LEU HA . . 5.330 5.151 5.060 5.216 . 0 0 "[ . 1 . 2]" 1
2416 1 102 GLY H 1 103 LEU MD1 . . 7.480 5.208 4.794 5.467 . 0 0 "[ . 1 . 2]" 1
2417 1 102 GLY H 1 103 LEU QD . . 7.310 4.579 4.332 4.832 . 0 0 "[ . 1 . 2]" 1
2418 1 102 GLY H 1 103 LEU MD2 . . 7.480 5.083 4.824 5.499 . 0 0 "[ . 1 . 2]" 1
2419 1 102 GLY H 1 103 LEU HG . . 5.980 4.194 3.838 4.584 . 0 0 "[ . 1 . 2]" 1
2420 1 102 GLY H 1 104 PHE H . . 5.320 4.110 3.910 4.257 . 0 0 "[ . 1 . 2]" 1
2421 1 102 GLY H 1 105 VAL QG . . 7.380 3.938 3.595 4.855 . 0 0 "[ . 1 . 2]" 1
2422 1 102 GLY QA 1 103 LEU QD . . 8.920 4.211 3.911 4.606 . 0 0 "[ . 1 . 2]" 1
2423 1 102 GLY QA 1 104 PHE H . . 6.680 3.494 3.229 4.006 . 0 0 "[ . 1 . 2]" 1
2424 1 102 GLY QA 1 105 VAL HB . . 5.690 4.139 2.893 4.499 . 0 0 "[ . 1 . 2]" 1
2425 1 102 GLY QA 1 105 VAL QG . . 6.870 1.837 1.671 3.468 . 0 0 "[ . 1 . 2]" 1
2426 1 102 GLY HA2 1 105 VAL H . . 5.550 3.375 2.940 4.018 . 0 0 "[ . 1 . 2]" 1
2427 1 102 GLY HA3 1 105 VAL H . . 5.550 4.708 4.414 5.200 . 0 0 "[ . 1 . 2]" 1
2428 1 103 LEU H 1 103 LEU HG . . 3.790 2.557 1.970 2.813 . 0 0 "[ . 1 . 2]" 1
2429 1 103 LEU H 1 104 PHE H . . 3.880 2.307 2.060 2.533 . 0 0 "[ . 1 . 2]" 1
2430 1 103 LEU H 1 104 PHE HA . . 5.290 4.974 4.798 5.168 . 0 0 "[ . 1 . 2]" 1
2431 1 103 LEU H 1 104 PHE QB . . 7.030 4.329 4.107 4.644 . 0 0 "[ . 1 . 2]" 1
2432 1 103 LEU H 1 104 PHE QD . . 7.300 3.447 2.899 4.858 . 0 0 "[ . 1 . 2]" 1
2433 1 103 LEU H 1 105 VAL H . . 4.510 3.961 3.537 4.208 . 0 0 "[ . 1 . 2]" 1
2434 1 103 LEU H 1 105 VAL QG . . 7.410 3.799 3.380 5.050 . 0 0 "[ . 1 . 2]" 1
2435 1 103 LEU HA 1 104 PHE QD . . 8.060 5.139 4.536 5.614 . 0 0 "[ . 1 . 2]" 1
2436 1 103 LEU HA 1 105 VAL H . . 5.450 4.034 3.465 4.938 . 0 0 "[ . 1 . 2]" 1
2437 1 103 LEU QB 1 104 PHE H . . 5.290 3.104 2.537 3.852 . 0 0 "[ . 1 . 2]" 1
2438 1 103 LEU QB 1 104 PHE QD . . 7.840 3.406 2.331 5.079 . 0 0 "[ . 1 . 2]" 1
2439 1 103 LEU QB 1 104 PHE QE . . 8.380 3.796 3.134 5.656 . 0 0 "[ . 1 . 2]" 1
2440 1 103 LEU HB2 1 104 PHE H . . 5.080 3.240 2.597 4.242 . 0 0 "[ . 1 . 2]" 1
2441 1 103 LEU HB2 1 104 PHE QD . . 7.630 3.540 2.362 5.525 . 0 0 "[ . 1 . 2]" 1
2442 1 103 LEU HB3 1 104 PHE H . . 5.080 4.028 3.558 4.448 . 0 0 "[ . 1 . 2]" 1
2443 1 103 LEU HB3 1 104 PHE QD . . 7.630 4.631 3.578 5.924 . 0 0 "[ . 1 . 2]" 1
2444 1 103 LEU QD 1 104 PHE H . . 6.920 4.120 2.665 4.343 . 0 0 "[ . 1 . 2]" 1
2445 1 103 LEU QD 1 104 PHE QB . . 8.560 5.258 3.656 5.530 . 0 0 "[ . 1 . 2]" 1
2446 1 103 LEU QD 1 104 PHE QE . . 9.350 3.971 2.651 4.814 . 0 0 "[ . 1 . 2]" 1
2447 1 103 LEU QD 1 105 VAL H . . 7.540 5.108 4.343 5.708 . 0 0 "[ . 1 . 2]" 1
2448 1 103 LEU MD1 1 104 PHE H . . 6.520 4.726 2.679 5.182 . 0 0 "[ . 1 . 2]" 1
2449 1 103 LEU MD1 1 104 PHE QE . . 9.520 4.051 2.674 4.978 . 0 0 "[ . 1 . 2]" 1
2450 1 103 LEU MD2 1 104 PHE H . . 6.520 4.688 4.626 4.794 . 0 0 "[ . 1 . 2]" 1
2451 1 103 LEU MD2 1 104 PHE QE . . 9.520 5.772 4.349 6.397 . 0 0 "[ . 1 . 2]" 1
2452 1 103 LEU HG 1 104 PHE H . . 5.980 4.452 3.406 4.774 . 0 0 "[ . 1 . 2]" 1
2453 1 104 PHE H 1 105 VAL H . . 3.730 2.328 2.088 2.625 . 0 0 "[ . 1 . 2]" 1
2454 1 104 PHE H 1 105 VAL HA . . 5.490 4.726 4.434 5.031 . 0 0 "[ . 1 . 2]" 1
2455 1 104 PHE H 1 105 VAL MG1 . . 6.490 3.717 2.990 5.562 . 0 0 "[ . 1 . 2]" 1
2456 1 104 PHE H 1 105 VAL QG . . 6.730 3.129 2.852 3.693 . 0 0 "[ . 1 . 2]" 1
2457 1 104 PHE H 1 105 VAL MG2 . . 6.490 3.637 2.995 5.401 . 0 0 "[ . 1 . 2]" 1
2458 1 104 PHE HA 1 105 VAL MG1 . . 6.400 4.950 4.372 6.025 . 0 0 "[ . 1 . 2]" 1
2459 1 104 PHE HA 1 105 VAL QG . . 6.840 4.250 3.557 5.006 . 0 0 "[ . 1 . 2]" 1
2460 1 104 PHE HA 1 105 VAL MG2 . . 6.400 4.684 3.766 5.969 . 0 0 "[ . 1 . 2]" 1
2461 1 104 PHE QB 1 105 VAL H . . 5.210 3.110 2.295 3.704 . 0 0 "[ . 1 . 2]" 1
2462 1 104 PHE QB 1 105 VAL QG . . 7.500 3.388 2.554 3.995 . 0 0 "[ . 1 . 2]" 1
2463 1 104 PHE HB2 1 105 VAL H . . 4.970 3.253 2.332 3.965 . 0 0 "[ . 1 . 2]" 1
2464 1 104 PHE HB2 1 105 VAL MG1 . . 7.520 3.915 2.702 5.172 . 0 0 "[ . 1 . 2]" 1
2465 1 104 PHE HB2 1 105 VAL MG2 . . 7.520 4.500 2.635 5.396 . 0 0 "[ . 1 . 2]" 1
2466 1 104 PHE HB3 1 105 VAL H . . 4.970 4.023 3.372 4.459 . 0 0 "[ . 1 . 2]" 1
2467 1 104 PHE HB3 1 105 VAL MG1 . . 7.520 4.728 3.712 5.599 . 0 0 "[ . 1 . 2]" 1
2468 1 104 PHE HB3 1 105 VAL MG2 . . 7.520 5.215 3.514 5.837 . 0 0 "[ . 1 . 2]" 1
2469 1 104 PHE QD 1 105 VAL H . . 7.420 4.376 3.809 4.799 . 0 0 "[ . 1 . 2]" 1
2470 1 104 PHE QD 1 105 VAL MG1 . . 8.650 4.984 4.103 6.323 . 0 0 "[ . 1 . 2]" 1
2471 1 104 PHE QD 1 105 VAL MG2 . . 8.650 5.241 4.160 6.234 . 0 0 "[ . 1 . 2]" 1
2472 1 105 VAL H 1 105 VAL HB . . 3.840 3.532 2.334 3.960 0.120 14 0 "[ . 1 . 2]" 1
2473 1 105 VAL H 1 106 ASP H . . 4.560 4.431 4.035 4.621 0.061 2 0 "[ . 1 . 2]" 1
2474 1 105 VAL HA 1 106 ASP H . . 3.170 2.212 2.026 2.459 . 0 0 "[ . 1 . 2]" 1
2475 1 105 VAL HA 1 106 ASP HA . . 4.650 4.350 4.255 4.477 . 0 0 "[ . 1 . 2]" 1
2476 1 105 VAL HA 1 106 ASP HB2 . . 5.010 4.484 4.160 4.901 . 0 0 "[ . 1 . 2]" 1
2477 1 105 VAL HA 1 106 ASP QB . . 5.250 4.022 3.865 4.191 . 0 0 "[ . 1 . 2]" 1
2478 1 105 VAL HA 1 106 ASP HB3 . . 5.010 4.592 4.214 4.982 . 0 0 "[ . 1 . 2]" 1
2479 1 105 VAL HA 1 107 GLU H . . 5.010 4.681 3.166 5.412 0.402 3 0 "[ . 1 . 2]" 1
2480 1 105 VAL HB 1 106 ASP H . . 4.000 3.086 2.234 4.259 0.259 17 0 "[ . 1 . 2]" 1
2481 1 105 VAL HB 1 106 ASP HA . . 5.180 4.716 4.229 5.366 0.186 6 0 "[ . 1 . 2]" 1
2482 1 105 VAL QG 1 106 ASP H . . 5.890 3.252 2.011 3.709 . 0 0 "[ . 1 . 2]" 1
2483 1 105 VAL QG 1 107 GLU H . . 6.920 3.435 1.732 4.659 . 0 0 "[ . 1 . 2]" 1
2484 1 105 VAL QG 1 109 LYS H . . 6.910 4.592 3.683 5.601 . 0 0 "[ . 1 . 2]" 1
2485 1 105 VAL QG 1 109 LYS QB . . 6.910 3.505 2.217 4.680 . 0 0 "[ . 1 . 2]" 1
2486 1 105 VAL MG1 1 106 ASP H . . 5.550 3.632 3.002 4.106 . 0 0 "[ . 1 . 2]" 1
2487 1 105 VAL MG1 1 106 ASP HA . . 6.520 5.308 2.811 5.749 . 0 0 "[ . 1 . 2]" 1
2488 1 105 VAL MG1 1 107 GLU H . . 6.520 5.030 2.494 6.154 . 0 0 "[ . 1 . 2]" 1
2489 1 105 VAL MG1 1 109 LYS H . . 6.520 5.383 3.817 6.407 . 0 0 "[ . 1 . 2]" 1
2490 1 105 VAL MG2 1 106 ASP H . . 5.550 3.776 2.043 4.417 . 0 0 "[ . 1 . 2]" 1
2491 1 105 VAL MG2 1 106 ASP HA . . 6.520 4.373 3.566 5.538 . 0 0 "[ . 1 . 2]" 1
2492 1 105 VAL MG2 1 107 GLU H . . 6.520 3.646 1.751 5.347 . 0 0 "[ . 1 . 2]" 1
2493 1 105 VAL MG2 1 109 LYS H . . 6.520 5.292 3.807 6.406 . 0 0 "[ . 1 . 2]" 1
2494 1 106 ASP H 1 106 ASP HB2 . . 3.740 2.865 2.386 3.403 . 0 0 "[ . 1 . 2]" 1
2495 1 106 ASP H 1 106 ASP HB3 . . 3.740 2.601 2.264 3.674 . 0 0 "[ . 1 . 2]" 1
2496 1 106 ASP H 1 107 GLU H . . 3.940 3.435 1.772 4.175 0.235 19 0 "[ . 1 . 2]" 1
2497 1 106 ASP H 1 109 LYS QD . . 5.690 4.112 2.404 5.690 0.000 2 0 "[ . 1 . 2]" 1
2498 1 106 ASP HA 1 107 GLU H . . 3.130 2.495 1.963 3.439 0.309 18 0 "[ . 1 . 2]" 1
2499 1 106 ASP HA 1 107 GLU HA . . 5.500 4.566 4.317 5.098 . 0 0 "[ . 1 . 2]" 1
2500 1 106 ASP HA 1 107 GLU HB2 . . 5.280 4.353 3.775 5.453 0.173 17 0 "[ . 1 . 2]" 1
2501 1 106 ASP HA 1 107 GLU QB . . 5.480 3.964 3.583 4.786 . 0 0 "[ . 1 . 2]" 1
2502 1 106 ASP HA 1 107 GLU HB3 . . 5.280 4.622 4.028 5.477 0.197 3 0 "[ . 1 . 2]" 1
2503 1 106 ASP QB 1 107 GLU H . . 4.950 3.767 2.071 4.044 . 0 0 "[ . 1 . 2]" 1
2504 1 106 ASP QB 1 109 LYS H . . 6.030 3.810 2.890 5.104 . 0 0 "[ . 1 . 2]" 1
2505 1 106 ASP QB 1 109 LYS QB . . 6.110 3.369 2.288 4.589 . 0 0 "[ . 1 . 2]" 1
2506 1 106 ASP QB 1 109 LYS QG . . 6.460 3.872 1.814 6.190 . 0 0 "[ . 1 . 2]" 1
2507 1 106 ASP HB2 1 107 GLU H . . 4.670 4.414 3.533 4.617 . 0 0 "[ . 1 . 2]" 1
2508 1 106 ASP HB2 1 109 LYS H . . 6.000 5.304 4.560 6.011 0.011 7 0 "[ . 1 . 2]" 1
2509 1 106 ASP HB3 1 107 GLU H . . 4.670 4.138 2.085 4.508 . 0 0 "[ . 1 . 2]" 1
2510 1 106 ASP HB3 1 109 LYS H . . 6.000 3.938 2.921 5.571 . 0 0 "[ . 1 . 2]" 1
2511 1 107 GLU H 1 107 GLU HB2 . . 4.000 2.880 2.312 3.653 . 0 0 "[ . 1 . 2]" 1
2512 1 107 GLU H 1 107 GLU HB3 . . 4.000 3.316 2.475 3.714 . 0 0 "[ . 1 . 2]" 1
2513 1 107 GLU HA 1 109 LYS H . . 4.580 4.138 3.461 4.552 . 0 0 "[ . 1 . 2]" 1
2514 1 107 GLU HA 1 110 LEU H . . 4.660 3.896 3.538 4.295 . 0 0 "[ . 1 . 2]" 1
2515 1 107 GLU HA 1 110 LEU HB2 . . 4.480 3.944 3.196 4.675 0.195 1 0 "[ . 1 . 2]" 1
2516 1 107 GLU HA 1 110 LEU QB . . 4.720 3.187 2.738 3.914 . 0 0 "[ . 1 . 2]" 1
2517 1 107 GLU HA 1 110 LEU HB3 . . 4.480 3.820 2.766 4.665 0.185 4 0 "[ . 1 . 2]" 1
2518 1 107 GLU HA 1 110 LEU QD . . 6.150 2.359 1.368 3.703 . 0 0 "[ . 1 . 2]" 1
2519 1 107 GLU QB 1 108 LYS H . . 5.100 2.334 1.801 3.901 . 0 0 "[ . 1 . 2]" 1
2520 1 107 GLU QG 1 110 LEU QD . . 6.640 3.096 2.037 4.201 . 0 0 "[ . 1 . 2]" 1
2521 1 107 GLU HG2 1 108 LYS H . . 4.820 3.774 2.866 4.837 0.017 3 0 "[ . 1 . 2]" 1
2522 1 107 GLU HG3 1 108 LYS H . . 4.820 3.988 1.840 5.011 0.191 19 0 "[ . 1 . 2]" 1
2523 1 108 LYS H 1 108 LYS QD . . 6.100 3.896 1.699 4.870 . 0 0 "[ . 1 . 2]" 1
2524 1 108 LYS H 1 108 LYS HG2 . . 4.180 3.280 2.020 4.382 0.202 13 0 "[ . 1 . 2]" 1
2525 1 108 LYS H 1 108 LYS HG3 . . 4.180 3.182 1.872 4.332 0.152 13 0 "[ . 1 . 2]" 1
2526 1 108 LYS H 1 109 LYS H . . 3.490 2.582 1.783 3.226 . 0 0 "[ . 1 . 2]" 1
2527 1 108 LYS HA 1 108 LYS QD . . 4.740 3.302 1.784 4.214 . 0 0 "[ . 1 . 2]" 1
2528 1 108 LYS HA 1 108 LYS HG2 . . 4.060 2.843 2.300 4.193 0.133 15 0 "[ . 1 . 2]" 1
2529 1 108 LYS HA 1 108 LYS HG3 . . 4.060 3.272 2.467 3.786 . 0 0 "[ . 1 . 2]" 1
2530 1 108 LYS HA 1 109 LYS H . . 3.490 3.424 3.287 3.519 0.029 16 0 "[ . 1 . 2]" 1
2531 1 108 LYS HA 1 110 LEU QD . . 7.340 4.171 2.374 5.230 . 0 0 "[ . 1 . 2]" 1
2532 1 108 LYS HA 1 111 GLU H . . 4.770 4.400 3.491 4.844 0.074 16 0 "[ . 1 . 2]" 1
2533 1 108 LYS QB 1 109 LYS H . . 5.140 3.009 2.375 3.660 . 0 0 "[ . 1 . 2]" 1
2534 1 109 LYS H 1 109 LYS HB2 . . 3.870 2.408 2.214 2.553 . 0 0 "[ . 1 . 2]" 1
2535 1 109 LYS H 1 109 LYS HB3 . . 3.870 3.570 2.765 3.682 . 0 0 "[ . 1 . 2]" 1
2536 1 109 LYS H 1 109 LYS QD . . 5.390 3.283 1.852 4.601 . 0 0 "[ . 1 . 2]" 1
2537 1 109 LYS H 1 109 LYS QE . . 6.180 4.475 3.531 6.118 . 0 0 "[ . 1 . 2]" 1
2538 1 109 LYS H 1 109 LYS HG2 . . 4.360 3.885 2.471 4.534 0.174 9 0 "[ . 1 . 2]" 1
2539 1 109 LYS H 1 109 LYS QG . . 4.580 3.094 2.233 3.943 . 0 0 "[ . 1 . 2]" 1
2540 1 109 LYS H 1 109 LYS HG3 . . 4.360 3.393 2.269 4.334 . 0 0 "[ . 1 . 2]" 1
2541 1 109 LYS H 1 110 LEU HG . . 6.500 4.772 2.819 6.585 0.085 16 0 "[ . 1 . 2]" 1
2542 1 109 LYS HA 1 109 LYS QD . . 4.580 3.396 1.875 4.194 . 0 0 "[ . 1 . 2]" 1
2543 1 109 LYS HA 1 109 LYS HG2 . . 3.850 3.048 2.157 3.755 . 0 0 "[ . 1 . 2]" 1
2544 1 109 LYS HA 1 109 LYS HG3 . . 3.850 2.805 2.249 3.842 . 0 0 "[ . 1 . 2]" 1
2545 1 109 LYS HA 1 110 LEU QD . . 7.250 4.935 3.981 5.775 . 0 0 "[ . 1 . 2]" 1
2546 1 109 LYS QB 1 110 LEU H . . 4.980 3.498 3.226 3.808 . 0 0 "[ . 1 . 2]" 1
2547 1 109 LYS HB2 1 110 LEU H . . 4.700 3.750 3.376 4.162 . 0 0 "[ . 1 . 2]" 1
2548 1 109 LYS HB3 1 110 LEU H . . 4.700 4.236 3.671 4.482 . 0 0 "[ . 1 . 2]" 1
2549 1 109 LYS QG 1 110 LEU H . . 5.910 4.625 4.193 4.913 . 0 0 "[ . 1 . 2]" 1
2550 1 110 LEU H 1 110 LEU HB2 . . 3.930 2.985 2.257 3.706 . 0 0 "[ . 1 . 2]" 1
2551 1 110 LEU H 1 110 LEU HB3 . . 3.930 2.988 2.069 3.645 . 0 0 "[ . 1 . 2]" 1
2552 1 110 LEU H 1 110 LEU MD1 . . 5.810 3.734 1.741 4.376 . 0 0 "[ . 1 . 2]" 1
2553 1 110 LEU H 1 110 LEU MD2 . . 5.810 3.228 1.892 4.028 . 0 0 "[ . 1 . 2]" 1
2554 1 110 LEU H 1 110 LEU HG . . 3.910 3.061 1.922 4.013 0.103 12 0 "[ . 1 . 2]" 1
2555 1 110 LEU H 1 111 GLU H . . 3.710 2.460 1.908 2.901 . 0 0 "[ . 1 . 2]" 1
2556 1 110 LEU HA 1 110 LEU HG . . 4.090 3.313 2.829 3.755 . 0 0 "[ . 1 . 2]" 1
2557 1 110 LEU HA 1 111 GLU H . . 3.350 3.403 3.151 3.523 0.173 3 0 "[ . 1 . 2]" 1
2558 1 110 LEU HA 1 112 HIS H . . 4.430 4.087 3.455 4.439 0.009 7 0 "[ . 1 . 2]" 1
2559 1 110 LEU HA 1 112 HIS HD2 . . 5.190 4.593 3.052 5.352 0.162 7 0 "[ . 1 . 2]" 1
2560 1 110 LEU QB 1 112 HIS HD2 . . 6.460 3.691 1.808 5.358 . 0 0 "[ . 1 . 2]" 1
2561 1 110 LEU HB2 1 111 GLU H . . 4.370 3.513 2.015 4.438 0.068 13 0 "[ . 1 . 2]" 1
2562 1 110 LEU HB3 1 111 GLU H . . 4.370 3.712 2.335 4.393 0.023 13 0 "[ . 1 . 2]" 1
2563 1 110 LEU QD 1 111 GLU H . . 6.640 3.121 1.689 4.431 . 0 0 "[ . 1 . 2]" 1
2564 1 110 LEU QD 1 112 HIS HA . . 7.210 4.529 2.269 5.696 . 0 0 "[ . 1 . 2]" 1
2565 1 110 LEU QD 1 112 HIS QB . . 7.010 3.419 2.584 4.027 . 0 0 "[ . 1 . 2]" 1
2566 1 110 LEU QD 1 112 HIS HD2 . . 7.050 3.684 1.700 5.033 . 0 0 "[ . 1 . 2]" 1
2567 1 110 LEU MD1 1 111 GLU H . . 6.460 4.148 1.752 5.210 . 0 0 "[ . 1 . 2]" 1
2568 1 110 LEU MD1 1 112 HIS HB2 . . 6.200 4.136 2.660 6.128 . 0 0 "[ . 1 . 2]" 1
2569 1 110 LEU MD1 1 112 HIS HB3 . . 6.200 4.587 3.662 5.946 . 0 0 "[ . 1 . 2]" 1
2570 1 110 LEU MD1 1 112 HIS HD2 . . 6.920 4.316 1.707 5.765 . 0 0 "[ . 1 . 2]" 1
2571 1 110 LEU MD2 1 111 GLU H . . 6.460 3.735 1.690 4.850 . 0 0 "[ . 1 . 2]" 1
2572 1 110 LEU MD2 1 112 HIS HB2 . . 6.200 4.892 3.623 6.319 0.119 1 0 "[ . 1 . 2]" 1
2573 1 110 LEU MD2 1 112 HIS HB3 . . 6.200 5.194 3.238 6.143 . 0 0 "[ . 1 . 2]" 1
2574 1 110 LEU MD2 1 112 HIS HD2 . . 6.920 4.352 1.787 5.609 . 0 0 "[ . 1 . 2]" 1
2575 1 110 LEU HG 1 111 GLU H . . 5.440 3.847 2.600 4.940 . 0 0 "[ . 1 . 2]" 1
2576 1 111 GLU H 1 111 GLU HG2 . . 4.670 4.079 2.825 5.081 0.411 4 0 "[ . 1 . 2]" 1
2577 1 111 GLU H 1 111 GLU QG . . 4.930 3.636 2.786 4.387 . 0 0 "[ . 1 . 2]" 1
2578 1 111 GLU H 1 111 GLU HG3 . . 4.670 4.301 3.049 4.864 0.194 16 0 "[ . 1 . 2]" 1
2579 1 111 GLU H 1 112 HIS HA . . 5.520 5.362 4.642 5.593 0.073 6 0 "[ . 1 . 2]" 1
2580 1 111 GLU HA 1 111 GLU HG2 . . 4.190 2.906 2.212 3.769 . 0 0 "[ . 1 . 2]" 1
2581 1 111 GLU HA 1 111 GLU HG3 . . 4.190 3.051 2.459 3.782 . 0 0 "[ . 1 . 2]" 1
2582 1 111 GLU HA 1 112 HIS HD2 . . 5.140 4.629 3.432 5.174 0.034 2 0 "[ . 1 . 2]" 1
2583 1 111 GLU QB 1 112 HIS H . . 5.860 3.255 2.355 4.063 . 0 0 "[ . 1 . 2]" 1
2584 1 111 GLU QB 1 112 HIS HA . . 5.830 4.318 3.833 5.129 . 0 0 "[ . 1 . 2]" 1
2585 1 111 GLU QB 1 112 HIS HD2 . . 6.320 3.886 2.006 5.436 . 0 0 "[ . 1 . 2]" 1
2586 1 111 GLU QG 1 112 HIS H . . 6.300 4.211 3.551 4.840 . 0 0 "[ . 1 . 2]" 1
2587 1 112 HIS HA 1 112 HIS HD2 . . 3.930 3.514 2.478 4.172 0.242 9 0 "[ . 1 . 2]" 1
2588 1 112 HIS HB2 1 112 HIS HD2 . . 3.830 3.387 2.862 3.920 0.090 20 0 "[ . 1 . 2]" 1
2589 1 112 HIS HB3 1 112 HIS HD2 . . 3.830 3.736 3.075 3.956 0.126 18 0 "[ . 1 . 2]" 1
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