NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
642250 |
6prp   |
30636 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6prp
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 1521
_Distance_constraint_stats_list.Viol_count 1065
_Distance_constraint_stats_list.Viol_total 1565.879
_Distance_constraint_stats_list.Viol_max 0.349
_Distance_constraint_stats_list.Viol_rms 0.0178
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0026
_Distance_constraint_stats_list.Viol_average_violations_only 0.0735
_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 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 2 ASP 0.583 0.246 10 0 "[ . 1 . 2]"
1 3 ASP 1.610 0.246 10 0 "[ . 1 . 2]"
1 4 VAL 8.053 0.309 4 0 "[ . 1 . 2]"
1 5 ILE 2.523 0.184 10 0 "[ . 1 . 2]"
1 6 ASP 1.765 0.184 10 0 "[ . 1 . 2]"
1 7 ALA 5.403 0.207 15 0 "[ . 1 . 2]"
1 8 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 TYR 4.773 0.177 12 0 "[ . 1 . 2]"
1 10 LYS 9.450 0.327 20 0 "[ . 1 . 2]"
1 11 PRO 5.453 0.310 7 0 "[ . 1 . 2]"
1 12 ALA 2.136 0.138 15 0 "[ . 1 . 2]"
1 13 ASP 0.400 0.064 13 0 "[ . 1 . 2]"
1 24 SER 0.545 0.216 4 0 "[ . 1 . 2]"
1 25 GLN 0.253 0.087 11 0 "[ . 1 . 2]"
1 26 ASP 0.565 0.216 4 0 "[ . 1 . 2]"
1 27 LEU 6.903 0.265 1 0 "[ . 1 . 2]"
1 28 TYR 0.795 0.218 15 0 "[ . 1 . 2]"
1 29 ALA 1.195 0.138 2 0 "[ . 1 . 2]"
1 30 THR 3.175 0.211 7 0 "[ . 1 . 2]"
1 31 LEU 2.953 0.163 9 0 "[ . 1 . 2]"
1 32 ASP 0.106 0.106 1 0 "[ . 1 . 2]"
1 33 VAL 1.549 0.126 18 0 "[ . 1 . 2]"
1 34 PRO 1.160 0.128 4 0 "[ . 1 . 2]"
1 35 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 36 PRO 1.442 0.159 11 0 "[ . 1 . 2]"
1 37 ILE 1.334 0.128 4 0 "[ . 1 . 2]"
1 38 ALA 0.549 0.116 17 0 "[ . 1 . 2]"
1 39 VAL 3.571 0.175 2 0 "[ . 1 . 2]"
1 40 VAL 2.810 0.175 2 0 "[ . 1 . 2]"
1 41 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 42 GLY 0.961 0.126 17 0 "[ . 1 . 2]"
1 43 LYS 1.157 0.133 19 0 "[ . 1 . 2]"
1 44 VAL 1.632 0.163 9 0 "[ . 1 . 2]"
1 45 ARG 3.041 0.179 18 0 "[ . 1 . 2]"
1 46 ALA 1.361 0.174 20 0 "[ . 1 . 2]"
1 47 MET 2.959 0.200 2 0 "[ . 1 . 2]"
1 48 THR 3.017 0.207 1 0 "[ . 1 . 2]"
1 49 LEU 4.538 0.265 1 0 "[ . 1 . 2]"
1 50 GLU 0.019 0.019 15 0 "[ . 1 . 2]"
1 51 GLY 0.116 0.116 16 0 "[ . 1 . 2]"
1 52 PRO 1.013 0.200 2 0 "[ . 1 . 2]"
1 53 VAL 5.965 0.327 20 0 "[ . 1 . 2]"
1 54 GLU 1.151 0.098 8 0 "[ . 1 . 2]"
1 55 VAL 1.362 0.175 13 0 "[ . 1 . 2]"
1 56 ALA 0.761 0.086 3 0 "[ . 1 . 2]"
1 57 VAL 3.057 0.133 19 0 "[ . 1 . 2]"
1 58 PRO 0.399 0.088 4 0 "[ . 1 . 2]"
1 59 PRO 0.257 0.068 10 0 "[ . 1 . 2]"
1 60 ARG 0.660 0.149 2 0 "[ . 1 . 2]"
1 61 THR 3.751 0.238 14 0 "[ . 1 . 2]"
1 62 GLN 2.677 0.238 14 0 "[ . 1 . 2]"
1 63 ALA 0.230 0.110 10 0 "[ . 1 . 2]"
1 64 GLY 0.006 0.006 20 0 "[ . 1 . 2]"
1 65 ARG 0.682 0.073 9 0 "[ . 1 . 2]"
1 66 LYS 0.733 0.221 1 0 "[ . 1 . 2]"
1 67 LEU 3.297 0.143 15 0 "[ . 1 . 2]"
1 68 ARG 1.752 0.175 5 0 "[ . 1 . 2]"
1 69 LEU 8.808 0.274 18 0 "[ . 1 . 2]"
1 70 LYS 2.774 0.349 4 0 "[ . 1 . 2]"
1 71 GLY 3.478 0.349 4 0 "[ . 1 . 2]"
1 72 LYS 0.097 0.060 17 0 "[ . 1 . 2]"
1 73 GLY 3.583 0.274 18 0 "[ . 1 . 2]"
1 74 PHE 1.783 0.136 10 0 "[ . 1 . 2]"
1 75 PRO 0.939 0.211 4 0 "[ . 1 . 2]"
1 76 GLY 0.668 0.231 7 0 "[ . 1 . 2]"
1 77 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 78 ALA 0.117 0.061 20 0 "[ . 1 . 2]"
1 79 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 80 ARG 1.840 0.231 7 0 "[ . 1 . 2]"
1 81 GLY 0.022 0.012 20 0 "[ . 1 . 2]"
1 82 ASP 0.175 0.093 17 0 "[ . 1 . 2]"
1 83 LEU 0.343 0.077 18 0 "[ . 1 . 2]"
1 84 TYR 4.734 0.309 4 0 "[ . 1 . 2]"
1 85 LEU 1.368 0.192 11 0 "[ . 1 . 2]"
1 86 GLU 1.367 0.143 15 0 "[ . 1 . 2]"
1 87 VAL 1.402 0.139 8 0 "[ . 1 . 2]"
1 88 ARG 2.220 0.211 7 0 "[ . 1 . 2]"
1 89 ILE 0.926 0.116 9 0 "[ . 1 . 2]"
1 90 THR 1.520 0.164 1 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 9 TYR HD1 1 69 LEU MD1 3.110 . 4.420 1.792 1.663 2.146 0.137 20 0 "[ . 1 . 2]" 1
2 1 27 LEU MD1 1 74 PHE HD1 3.150 . 4.510 2.668 1.947 3.181 . 0 0 "[ . 1 . 2]" 1
3 1 27 LEU MD1 1 74 PHE HZ 3.270 . 4.740 4.458 3.651 4.861 0.121 6 0 "[ . 1 . 2]" 1
4 1 49 LEU MD1 1 74 PHE HD1 3.230 . 4.660 4.033 3.512 4.626 . 0 0 "[ . 1 . 2]" 1
5 1 49 LEU MD2 1 74 PHE HE1 3.220 . 4.640 4.475 4.155 4.755 0.115 8 0 "[ . 1 . 2]" 1
6 1 49 LEU MD2 1 74 PHE HZ 3.620 . 5.440 5.011 4.296 5.519 0.079 1 0 "[ . 1 . 2]" 1
7 1 7 ALA MB 1 9 TYR HD1 3.680 . 5.560 5.506 4.758 5.708 0.148 10 0 "[ . 1 . 2]" 1
8 1 4 VAL MG2 1 84 TYR HD1 3.410 . 5.020 4.419 3.955 4.720 . 0 0 "[ . 1 . 2]" 1
9 1 4 VAL MG1 1 84 TYR HD1 3.050 . 4.290 3.285 2.865 3.592 . 0 0 "[ . 1 . 2]" 1
10 1 9 TYR HE2 1 53 VAL MG2 3.190 . 4.580 3.852 3.163 4.499 . 0 0 "[ . 1 . 2]" 1
11 1 27 LEU MD2 1 74 PHE HZ 3.390 . 4.980 3.976 3.325 5.012 0.032 5 0 "[ . 1 . 2]" 1
12 1 29 ALA MB 1 83 LEU MD2 3.330 . 4.860 4.099 3.137 4.817 . 0 0 "[ . 1 . 2]" 1
13 1 5 ILE MD 1 5 ILE MG 2.700 . 3.600 2.022 1.989 2.059 . 0 0 "[ . 1 . 2]" 1
14 1 5 ILE MD 1 61 THR MG 3.660 . 5.520 4.395 3.282 5.456 . 0 0 "[ . 1 . 2]" 1
15 1 5 ILE MD 1 58 PRO HG3 3.010 . 4.220 2.465 2.065 2.790 . 0 0 "[ . 1 . 2]" 1
16 1 5 ILE MD 1 67 LEU MD1 3.950 . 6.100 5.646 5.300 5.901 . 0 0 "[ . 1 . 2]" 1
17 1 7 ALA MB 1 56 ALA MB 3.640 . 5.480 4.134 3.695 4.693 . 0 0 "[ . 1 . 2]" 1
18 1 7 ALA MB 1 69 LEU HG 3.620 . 5.440 3.609 3.273 4.180 . 0 0 "[ . 1 . 2]" 1
19 1 7 ALA MB 1 67 LEU HG 3.540 . 5.280 4.092 3.951 4.255 . 0 0 "[ . 1 . 2]" 1
20 1 7 ALA MB 1 55 VAL MG2 3.660 . 5.520 4.834 4.341 5.106 . 0 0 "[ . 1 . 2]" 1
21 1 83 LEU HG 1 85 LEU MD1 3.620 . 5.440 3.123 2.630 3.570 . 0 0 "[ . 1 . 2]" 1
22 1 31 LEU MD2 1 85 LEU MD1 2.890 . 3.980 2.157 1.780 2.654 0.020 15 0 "[ . 1 . 2]" 1
23 1 83 LEU MD2 1 85 LEU MD1 3.120 . 4.440 2.554 2.022 2.931 . 0 0 "[ . 1 . 2]" 1
24 1 31 LEU MD1 1 85 LEU MD1 2.890 . 3.980 1.911 1.747 2.623 0.053 18 0 "[ . 1 . 2]" 1
25 1 46 ALA MB 1 85 LEU MD1 2.930 . 4.070 2.477 2.186 3.044 . 0 0 "[ . 1 . 2]" 1
26 1 53 VAL MG1 1 85 LEU MD1 3.920 . 6.040 5.723 5.129 6.054 0.014 4 0 "[ . 1 . 2]" 1
27 1 55 VAL MG1 1 85 LEU MD1 3.050 . 4.290 2.425 2.024 2.900 . 0 0 "[ . 1 . 2]" 1
28 1 31 LEU MD2 1 67 LEU MD1 2.220 . 2.640 2.060 1.946 2.188 . 0 0 "[ . 1 . 2]" 1
29 1 67 LEU MD1 1 69 LEU MD2 3.230 . 4.660 3.339 2.893 3.825 . 0 0 "[ . 1 . 2]" 1
30 1 7 ALA MB 1 67 LEU MD1 2.800 . 3.800 2.403 2.129 2.786 . 0 0 "[ . 1 . 2]" 1
31 1 55 VAL MG1 1 67 LEU MD1 2.940 . 4.080 2.484 2.269 2.862 . 0 0 "[ . 1 . 2]" 1
32 1 83 LEU MD2 1 85 LEU MD2 3.030 . 4.260 2.821 2.171 3.384 . 0 0 "[ . 1 . 2]" 1
33 1 53 VAL MG2 1 83 LEU MD2 3.570 . 5.340 2.982 2.679 3.459 . 0 0 "[ . 1 . 2]" 1
34 1 31 LEU MD2 1 85 LEU HG 3.830 . 5.860 4.457 4.267 4.725 . 0 0 "[ . 1 . 2]" 1
35 1 31 LEU MD2 1 69 LEU MD2 3.670 . 5.540 4.539 4.130 4.965 . 0 0 "[ . 1 . 2]" 1
36 1 31 LEU MD2 1 69 LEU MD1 3.910 . 6.020 4.083 3.464 4.533 . 0 0 "[ . 1 . 2]" 1
37 1 31 LEU MD2 1 55 VAL MG2 3.080 . 4.360 3.036 2.714 3.495 . 0 0 "[ . 1 . 2]" 1
38 1 69 LEU MD1 1 85 LEU MD2 3.090 . 4.380 3.689 3.355 3.956 . 0 0 "[ . 1 . 2]" 1
39 1 48 THR MG 1 69 LEU MD1 3.230 . 4.660 4.266 4.057 4.551 . 0 0 "[ . 1 . 2]" 1
40 1 55 VAL MG1 1 69 LEU MD1 2.790 . 3.780 2.676 2.342 2.972 . 0 0 "[ . 1 . 2]" 1
41 1 53 VAL MG2 1 69 LEU MD1 3.120 . 4.440 3.906 3.561 4.302 . 0 0 "[ . 1 . 2]" 1
42 1 69 LEU MD2 1 83 LEU HG 3.630 . 5.460 4.982 4.844 5.221 . 0 0 "[ . 1 . 2]" 1
43 1 67 LEU MD2 1 69 LEU MD2 3.010 . 4.220 4.150 3.965 4.280 0.060 11 0 "[ . 1 . 2]" 1
44 1 53 VAL MG2 1 69 LEU MD2 3.850 . 5.900 5.289 4.908 5.655 . 0 0 "[ . 1 . 2]" 1
45 1 56 ALA MB 1 69 LEU MD2 4.060 . 6.320 4.886 4.475 5.340 . 0 0 "[ . 1 . 2]" 1
46 1 27 LEU MD1 1 83 LEU MD1 2.870 . 3.940 2.571 2.130 2.836 . 0 0 "[ . 1 . 2]" 1
47 1 27 LEU MD2 1 49 LEU MD1 2.220 . 2.640 2.198 2.024 2.609 . 0 0 "[ . 1 . 2]" 1
48 1 49 LEU HB2 1 49 LEU MD1 3.070 . 4.340 2.497 2.437 2.572 . 0 0 "[ . 1 . 2]" 1
49 1 27 LEU MD1 1 49 LEU MD2 2.470 . 3.140 3.279 3.131 3.405 0.265 1 0 "[ . 1 . 2]" 1
50 1 31 LEU MD1 1 44 VAL MG2 2.770 . 3.740 1.836 1.761 1.928 0.039 9 0 "[ . 1 . 2]" 1
51 1 31 LEU MD1 1 53 VAL MG2 3.540 . 5.280 4.404 4.195 4.597 . 0 0 "[ . 1 . 2]" 1
52 1 31 LEU MD2 1 46 ALA MB 3.400 . 5.000 3.689 3.275 4.071 . 0 0 "[ . 1 . 2]" 1
53 1 46 ALA MB 1 83 LEU MD2 3.600 . 5.400 3.318 2.807 4.076 . 0 0 "[ . 1 . 2]" 1
54 1 46 ALA MB 1 69 LEU MD1 3.260 . 4.730 4.159 3.711 4.615 . 0 0 "[ . 1 . 2]" 1
55 1 12 ALA MB 1 46 ALA MB 4.210 . 6.620 5.989 5.652 6.562 . 0 0 "[ . 1 . 2]" 1
56 1 45 ARG HG2 1 47 MET ME 3.550 . 5.300 4.488 2.795 5.479 0.179 18 0 "[ . 1 . 2]" 1
57 1 12 ALA MB 1 47 MET ME 4.000 . 6.200 5.148 4.703 5.636 . 0 0 "[ . 1 . 2]" 1
58 1 47 MET ME 1 47 MET HG3 2.930 . 4.070 3.100 2.521 3.464 . 0 0 "[ . 1 . 2]" 1
59 1 31 LEU MD1 1 85 LEU MD2 2.550 . 3.300 2.953 2.658 3.162 . 0 0 "[ . 1 . 2]" 1
60 1 46 ALA MB 1 85 LEU MD2 2.850 . 3.900 2.879 2.383 3.339 . 0 0 "[ . 1 . 2]" 1
61 1 7 ALA MB 1 67 LEU MD2 2.700 . 3.600 1.824 1.781 1.881 0.019 7 0 "[ . 1 . 2]" 1
62 1 53 VAL MG2 1 85 LEU MD2 3.670 . 5.540 4.701 4.321 5.101 . 0 0 "[ . 1 . 2]" 1
63 1 5 ILE MG 1 67 LEU MD2 2.800 . 3.800 2.000 1.843 2.141 . 0 0 "[ . 1 . 2]" 1
64 1 5 ILE MD 1 67 LEU MD2 3.130 . 4.460 3.878 3.507 4.178 . 0 0 "[ . 1 . 2]" 1
65 1 53 VAL MG1 1 83 LEU MD1 4.120 . 6.440 5.823 5.294 6.458 0.018 17 0 "[ . 1 . 2]" 1
66 1 55 VAL MG2 1 85 LEU MD1 3.030 . 4.260 2.056 1.854 2.254 . 0 0 "[ . 1 . 2]" 1
67 1 46 ALA MB 1 55 VAL MG2 2.220 . 2.640 2.172 2.011 2.438 . 0 0 "[ . 1 . 2]" 1
68 1 31 LEU MD2 1 57 VAL MG1 3.340 . 4.880 3.973 3.390 4.408 . 0 0 "[ . 1 . 2]" 1
69 1 48 THR MG 1 49 LEU HG 3.550 . 5.300 4.935 4.599 5.319 0.019 9 0 "[ . 1 . 2]" 1
70 1 48 THR MG 1 83 LEU HG 3.700 . 5.600 4.146 3.894 4.518 . 0 0 "[ . 1 . 2]" 1
71 1 48 THR MG 1 83 LEU MD2 2.910 . 4.020 1.945 1.795 2.088 0.005 6 0 "[ . 1 . 2]" 1
72 1 27 LEU MD2 1 48 THR MG 3.420 . 5.040 5.145 5.064 5.247 0.207 1 0 "[ . 1 . 2]" 1
73 1 48 THR MG 1 53 VAL MG1 2.670 . 3.540 2.957 2.400 3.527 . 0 0 "[ . 1 . 2]" 1
74 1 89 ILE MD 1 90 THR MG 4.640 . 7.480 6.214 5.754 7.145 . 0 0 "[ . 1 . 2]" 1
75 1 34 PRO HG2 1 44 VAL MG1 3.900 . 6.000 3.583 3.433 3.781 . 0 0 "[ . 1 . 2]" 1
76 1 34 PRO HG3 1 44 VAL MG1 3.900 . 6.000 4.300 4.110 4.449 . 0 0 "[ . 1 . 2]" 1
77 1 31 LEU MD2 1 44 VAL MG1 3.370 . 4.940 4.153 3.912 4.401 . 0 0 "[ . 1 . 2]" 1
78 1 31 LEU MD1 1 44 VAL MG1 3.110 . 4.420 4.103 3.861 4.291 . 0 0 "[ . 1 . 2]" 1
79 1 31 LEU MD2 1 57 VAL MG2 3.340 . 4.880 2.677 2.091 3.195 . 0 0 "[ . 1 . 2]" 1
80 1 43 LYS HG2 1 44 VAL MG2 3.710 . 5.620 5.427 5.256 5.617 . 0 0 "[ . 1 . 2]" 1
81 1 44 VAL MG2 1 53 VAL MG2 3.940 . 6.080 5.299 4.868 5.849 . 0 0 "[ . 1 . 2]" 1
82 1 44 VAL MG2 1 56 ALA MB 4.140 . 6.490 5.745 5.438 5.935 . 0 0 "[ . 1 . 2]" 1
83 1 37 ILE MG 1 44 VAL MG2 3.060 . 4.320 3.748 3.401 3.947 . 0 0 "[ . 1 . 2]" 1
84 1 37 ILE MD 1 44 VAL MG2 3.490 . 5.180 4.607 4.433 4.909 . 0 0 "[ . 1 . 2]" 1
85 1 31 LEU MD2 1 55 VAL MG1 2.800 . 3.800 2.344 2.106 2.680 . 0 0 "[ . 1 . 2]" 1
86 1 55 VAL MG1 1 69 LEU MD2 2.950 . 4.100 2.353 2.081 2.734 . 0 0 "[ . 1 . 2]" 1
87 1 31 LEU MD1 1 55 VAL MG1 3.140 . 4.480 3.444 3.138 3.829 . 0 0 "[ . 1 . 2]" 1
88 1 55 VAL MG1 1 67 LEU MD2 3.440 . 5.080 4.231 4.006 4.547 . 0 0 "[ . 1 . 2]" 1
89 1 4 VAL MG2 1 5 ILE MG 3.710 . 5.620 4.240 3.806 4.760 . 0 0 "[ . 1 . 2]" 1
90 1 4 VAL MG2 1 66 LYS HB2 3.580 . 5.360 4.935 4.634 5.278 . 0 0 "[ . 1 . 2]" 1
91 1 63 ALA MB 1 89 ILE HG13 2.940 . 4.080 2.593 2.205 3.013 . 0 0 "[ . 1 . 2]" 1
92 1 43 LYS HD3 1 56 ALA MB 3.390 . 4.980 3.822 3.190 5.003 0.023 2 0 "[ . 1 . 2]" 1
93 1 43 LYS HG3 1 56 ALA MB 3.610 . 5.420 3.577 3.070 4.204 . 0 0 "[ . 1 . 2]" 1
94 1 43 LYS HG2 1 56 ALA MB 3.770 . 5.740 2.933 2.602 3.354 . 0 0 "[ . 1 . 2]" 1
95 1 38 ALA MB 1 89 ILE HG12 3.580 . 5.360 2.414 2.225 2.641 . 0 0 "[ . 1 . 2]" 1
96 1 35 ALA MB 1 38 ALA MB 3.350 . 4.900 3.787 3.538 4.006 . 0 0 "[ . 1 . 2]" 1
97 1 37 ILE MG 1 38 ALA MB 3.500 . 5.200 4.290 4.166 4.435 . 0 0 "[ . 1 . 2]" 1
98 1 35 ALA MB 1 89 ILE HG12 3.840 . 5.880 4.781 4.451 5.018 . 0 0 "[ . 1 . 2]" 1
99 1 37 ILE MD 1 44 VAL MG1 2.810 . 3.820 2.336 2.144 2.658 . 0 0 "[ . 1 . 2]" 1
100 1 61 THR MG 1 89 ILE MD 3.260 . 4.720 3.445 2.000 4.297 . 0 0 "[ . 1 . 2]" 1
101 1 62 GLN HB2 1 89 ILE MD 3.970 . 6.140 4.594 4.287 4.757 . 0 0 "[ . 1 . 2]" 1
102 1 37 ILE MG 1 57 VAL HB 3.260 . 4.720 2.825 2.571 3.170 . 0 0 "[ . 1 . 2]" 1
103 1 53 VAL MG2 1 55 VAL MG1 3.340 . 4.880 4.497 4.264 4.671 . 0 0 "[ . 1 . 2]" 1
104 1 12 ALA MB 1 53 VAL MG2 3.540 . 5.280 4.668 4.392 5.151 . 0 0 "[ . 1 . 2]" 1
105 1 89 ILE MG 1 90 THR MG 3.750 . 5.700 4.369 3.716 5.003 . 0 0 "[ . 1 . 2]" 1
106 1 5 ILE MG 1 58 PRO HG3 2.990 . 4.180 2.653 2.126 3.184 . 0 0 "[ . 1 . 2]" 1
107 1 5 ILE MG 1 67 LEU MD1 3.440 . 5.080 4.127 4.005 4.236 . 0 0 "[ . 1 . 2]" 1
108 1 5 ILE MG 1 7 ALA MB 3.000 . 4.200 3.517 2.724 3.973 . 0 0 "[ . 1 . 2]" 1
109 1 27 LEU MD2 1 49 LEU HG 3.730 . 5.660 2.830 2.352 3.423 . 0 0 "[ . 1 . 2]" 1
110 1 27 LEU MD2 1 83 LEU MD1 2.960 . 4.120 3.976 3.705 4.196 0.076 1 0 "[ . 1 . 2]" 1
111 1 12 ALA MB 1 54 GLU HB2 3.260 . 4.720 3.770 3.099 4.791 0.071 5 0 "[ . 1 . 2]" 1
112 1 12 ALA MB 1 54 GLU HB3 3.600 . 5.400 4.530 4.176 5.420 0.020 5 0 "[ . 1 . 2]" 1
113 1 30 THR HB 1 88 ARG HG2 3.280 . 4.760 3.407 2.265 4.971 0.211 7 0 "[ . 1 . 2]" 1
114 1 58 PRO HG2 1 61 THR HB 3.330 . 4.860 4.215 3.713 4.857 . 0 0 "[ . 1 . 2]" 1
115 1 39 VAL HA 1 61 THR H 3.330 . 4.860 3.354 2.723 3.804 . 0 0 "[ . 1 . 2]" 1
116 1 39 VAL HA 1 39 VAL MG1 2.670 . 3.540 2.496 2.451 2.561 . 0 0 "[ . 1 . 2]" 1
117 1 36 PRO HA 1 39 VAL H 3.240 . 4.680 3.745 3.585 3.900 . 0 0 "[ . 1 . 2]" 1
118 1 36 PRO HA 1 40 VAL H 3.440 . 5.080 4.112 3.978 4.259 . 0 0 "[ . 1 . 2]" 1
119 1 35 ALA MB 1 36 PRO HA 3.220 . 4.640 4.091 4.006 4.145 . 0 0 "[ . 1 . 2]" 1
120 1 58 PRO HG2 1 61 THR HA 3.750 . 5.700 4.226 3.749 4.769 . 0 0 "[ . 1 . 2]" 1
121 1 33 VAL HB 1 87 VAL HA 3.690 . 5.580 4.762 4.275 5.186 . 0 0 "[ . 1 . 2]" 1
122 1 87 VAL HA 1 88 ARG HG2 3.290 . 4.780 4.212 3.914 4.498 . 0 0 "[ . 1 . 2]" 1
123 1 31 LEU HB2 1 87 VAL HA 3.240 . 4.680 4.181 3.808 4.571 . 0 0 "[ . 1 . 2]" 1
124 1 87 VAL HA 1 87 VAL MG2 2.870 . 3.940 2.420 2.367 2.477 . 0 0 "[ . 1 . 2]" 1
125 1 11 PRO HA 1 53 VAL HB 3.170 . 4.540 3.252 2.518 3.715 . 0 0 "[ . 1 . 2]" 1
126 1 11 PRO HA 1 12 ALA MB 3.300 . 4.800 4.079 3.996 4.163 . 0 0 "[ . 1 . 2]" 1
127 1 75 PRO HA 1 80 ARG HG2 3.250 . 4.700 2.044 1.729 3.247 0.071 19 0 "[ . 1 . 2]" 1
128 1 34 PRO HA 1 35 ALA MB 3.230 . 4.660 4.069 4.020 4.107 . 0 0 "[ . 1 . 2]" 1
129 1 34 PRO HA 1 89 ILE MG 3.650 . 5.500 3.932 3.616 4.154 . 0 0 "[ . 1 . 2]" 1
130 1 34 PRO HA 1 90 THR MG 3.750 . 5.700 3.466 1.883 4.601 . 0 0 "[ . 1 . 2]" 1
131 1 30 THR HA 1 86 GLU HB2 3.120 . 4.440 2.596 2.250 2.929 . 0 0 "[ . 1 . 2]" 1
132 1 47 MET HA 1 52 PRO HA 3.010 . 4.220 2.949 2.636 3.364 . 0 0 "[ . 1 . 2]" 1
133 1 52 PRO HA 1 53 VAL MG1 3.290 . 4.780 3.784 3.503 4.021 . 0 0 "[ . 1 . 2]" 1
134 1 89 ILE MG 1 90 THR HA 3.050 . 4.290 3.654 3.277 4.052 . 0 0 "[ . 1 . 2]" 1
135 1 90 THR HA 1 90 THR MG 3.110 . 4.420 2.770 2.346 3.279 . 0 0 "[ . 1 . 2]" 1
136 1 39 VAL HB 1 40 VAL HA 3.240 . 4.680 4.371 4.221 4.520 . 0 0 "[ . 1 . 2]" 1
137 1 40 VAL HA 1 59 PRO HA 3.300 . 4.800 4.280 4.072 4.536 . 0 0 "[ . 1 . 2]" 1
138 1 39 VAL HA 1 59 PRO HA 3.400 . 5.000 4.640 4.173 5.068 0.068 10 0 "[ . 1 . 2]" 1
139 1 37 ILE HA 1 41 GLY H 3.260 . 4.720 3.654 3.407 3.879 . 0 0 "[ . 1 . 2]" 1
140 1 37 ILE HA 1 37 ILE MD 3.050 . 4.300 3.844 3.815 3.876 . 0 0 "[ . 1 . 2]" 1
141 1 9 TYR HA 1 55 VAL HA 3.150 . 4.510 2.260 1.786 2.859 0.014 11 0 "[ . 1 . 2]" 1
142 1 9 TYR HB2 1 55 VAL HA 3.330 . 4.860 2.675 2.356 2.970 . 0 0 "[ . 1 . 2]" 1
143 1 55 VAL HA 1 56 ALA MB 3.140 . 4.480 4.004 3.950 4.050 . 0 0 "[ . 1 . 2]" 1
144 1 37 ILE MD 1 44 VAL HA 3.190 . 4.580 3.708 3.133 4.392 . 0 0 "[ . 1 . 2]" 1
145 1 57 VAL HA 1 57 VAL MG1 2.900 . 4.000 2.460 2.406 2.489 . 0 0 "[ . 1 . 2]" 1
146 1 89 ILE HA 1 89 ILE HG13 3.150 . 4.510 3.046 2.982 3.103 . 0 0 "[ . 1 . 2]" 1
147 1 89 ILE HA 1 89 ILE HG12 3.240 . 4.680 2.438 2.374 2.504 . 0 0 "[ . 1 . 2]" 1
148 1 89 ILE HA 1 89 ILE MD 2.920 . 4.040 3.801 3.765 3.839 . 0 0 "[ . 1 . 2]" 1
149 1 11 PRO HA 1 53 VAL HA 3.010 . 4.220 2.738 2.193 3.158 . 0 0 "[ . 1 . 2]" 1
150 1 5 ILE HA 1 6 ASP HB2 4.010 . 6.220 4.524 4.350 4.677 . 0 0 "[ . 1 . 2]" 1
151 1 5 ILE HA 1 6 ASP HB3 4.010 . 6.220 4.715 4.575 4.889 . 0 0 "[ . 1 . 2]" 1
152 1 33 VAL HA 1 44 VAL HB 3.300 . 4.800 3.493 3.206 3.678 . 0 0 "[ . 1 . 2]" 1
153 1 50 GLU HA 1 50 GLU HG3 3.110 . 4.420 3.185 2.491 3.952 . 0 0 "[ . 1 . 2]" 1
154 1 50 GLU HA 1 50 GLU HG2 3.110 . 4.420 3.332 2.468 3.831 . 0 0 "[ . 1 . 2]" 1
155 1 35 ALA HA 1 89 ILE HB 3.770 . 5.740 4.912 4.793 5.121 . 0 0 "[ . 1 . 2]" 1
156 1 70 LYS HA 1 70 LYS HG2 3.230 . 4.660 2.513 2.417 2.578 . 0 0 "[ . 1 . 2]" 1
157 1 38 ALA HA 1 61 THR HB 3.020 . 4.240 2.864 2.419 3.378 . 0 0 "[ . 1 . 2]" 1
158 1 62 GLN HA 1 63 ALA HA 3.530 . 5.260 4.387 4.318 4.463 . 0 0 "[ . 1 . 2]" 1
159 1 63 ALA HA 1 65 ARG HB2 3.390 . 4.980 4.620 4.174 4.931 . 0 0 "[ . 1 . 2]" 1
160 1 63 ALA HA 1 89 ILE HG13 2.950 . 4.100 2.583 2.320 2.893 . 0 0 "[ . 1 . 2]" 1
161 1 63 ALA HA 1 89 ILE HG12 3.280 . 4.760 4.312 4.078 4.608 . 0 0 "[ . 1 . 2]" 1
162 1 62 GLN HA 1 89 ILE HG13 2.990 . 4.180 4.000 3.518 4.257 0.077 15 0 "[ . 1 . 2]" 1
163 1 3 ASP HA 1 4 VAL MG1 3.630 . 5.460 4.660 4.385 4.958 . 0 0 "[ . 1 . 2]" 1
164 1 54 GLU HA 1 55 VAL MG2 3.210 . 4.620 3.647 3.329 3.905 . 0 0 "[ . 1 . 2]" 1
165 1 27 LEU HA 1 27 LEU MD1 3.010 . 4.220 3.922 3.886 3.963 . 0 0 "[ . 1 . 2]" 1
166 1 27 LEU HB2 1 83 LEU HA 3.270 . 4.740 2.700 2.370 3.024 . 0 0 "[ . 1 . 2]" 1
167 1 32 ASP HA 1 88 ARG HB2 3.120 . 4.440 2.933 2.520 3.370 . 0 0 "[ . 1 . 2]" 1
168 1 43 LYS HA 1 57 VAL H 3.200 . 4.600 2.558 2.227 2.784 . 0 0 "[ . 1 . 2]" 1
169 1 43 LYS HA 1 56 ALA HA 2.970 . 4.140 2.592 2.298 2.840 . 0 0 "[ . 1 . 2]" 1
170 1 43 LYS HA 1 56 ALA MB 3.080 . 4.360 4.206 3.960 4.444 0.084 5 0 "[ . 1 . 2]" 1
171 1 66 LYS HA 1 86 GLU HA 3.220 . 4.640 2.583 1.926 3.127 . 0 0 "[ . 1 . 2]" 1
172 1 66 LYS HA 1 66 LYS HG2 2.920 . 4.040 3.721 3.675 3.792 . 0 0 "[ . 1 . 2]" 1
173 1 45 ARG HA 1 54 GLU HA 3.100 . 4.400 2.551 2.097 3.008 . 0 0 "[ . 1 . 2]" 1
174 1 46 ALA HA 1 47 MET H 2.810 . 3.820 2.276 2.165 2.414 . 0 0 "[ . 1 . 2]" 1
175 1 46 ALA HA 1 55 VAL MG2 3.310 . 4.820 4.386 4.182 4.683 . 0 0 "[ . 1 . 2]" 1
176 1 43 LYS HB3 1 56 ALA HA 3.470 . 5.140 4.222 3.892 4.413 . 0 0 "[ . 1 . 2]" 1
177 1 33 VAL HA 1 34 PRO HD3 2.920 . 4.040 2.222 2.107 2.326 . 0 0 "[ . 1 . 2]" 1
178 1 10 LYS HA 1 11 PRO HD3 2.770 . 3.740 2.389 1.927 2.620 . 0 0 "[ . 1 . 2]" 1
179 1 10 LYS HB2 1 11 PRO HD3 3.510 . 5.220 5.003 4.534 5.186 . 0 0 "[ . 1 . 2]" 1
180 1 10 LYS HA 1 11 PRO HD2 2.830 . 3.860 2.325 2.052 2.857 . 0 0 "[ . 1 . 2]" 1
181 1 10 LYS HB2 1 11 PRO HD2 2.970 . 4.140 4.147 3.764 4.450 0.310 7 0 "[ . 1 . 2]" 1
182 1 33 VAL HA 1 34 PRO HD2 2.950 . 4.100 2.477 2.404 2.540 . 0 0 "[ . 1 . 2]" 1
183 1 58 PRO HA 1 59 PRO HD3 2.800 . 3.800 2.206 1.995 2.598 . 0 0 "[ . 1 . 2]" 1
184 1 58 PRO HB2 1 59 PRO HD3 3.240 . 4.680 3.938 3.480 4.419 . 0 0 "[ . 1 . 2]" 1
185 1 34 PRO HB3 1 36 PRO HD2 3.180 . 4.560 2.942 2.730 3.149 . 0 0 "[ . 1 . 2]" 1
186 1 58 PRO HB3 1 59 PRO HD3 3.240 . 4.680 3.968 3.572 4.383 . 0 0 "[ . 1 . 2]" 1
187 1 76 GLY HA3 1 77 PRO HD3 3.100 . 4.400 3.899 3.420 4.166 . 0 0 "[ . 1 . 2]" 1
188 1 76 GLY HA2 1 77 PRO HD3 2.760 . 3.720 2.489 2.326 2.665 . 0 0 "[ . 1 . 2]" 1
189 1 76 GLY HA3 1 77 PRO HD2 2.740 . 3.680 3.115 2.638 3.417 . 0 0 "[ . 1 . 2]" 1
190 1 76 GLY HA2 1 77 PRO HD2 2.770 . 3.740 2.270 2.004 2.706 . 0 0 "[ . 1 . 2]" 1
191 1 58 PRO HA 1 59 PRO HD2 2.800 . 3.800 2.754 2.289 3.122 . 0 0 "[ . 1 . 2]" 1
192 1 71 GLY HA3 1 80 ARG HB2 3.540 . 5.280 3.943 3.284 5.098 . 0 0 "[ . 1 . 2]" 1
193 1 71 GLY HA2 1 80 ARG HB2 3.660 . 5.520 3.133 2.186 4.411 . 0 0 "[ . 1 . 2]" 1
194 1 37 ILE MG 1 42 GLY HA3 3.060 . 4.320 2.412 2.045 2.945 . 0 0 "[ . 1 . 2]" 1
195 1 75 PRO HB2 1 76 GLY HA3 3.850 . 5.900 5.246 4.922 5.497 . 0 0 "[ . 1 . 2]" 1
196 1 76 GLY HA3 1 77 PRO HG2 4.030 . 6.270 5.040 4.716 5.351 . 0 0 "[ . 1 . 2]" 1
197 1 69 LEU MD1 1 73 GLY HA2 3.400 . 5.000 5.037 4.499 5.243 0.243 17 0 "[ . 1 . 2]" 1
198 1 65 ARG HA 1 65 ARG HD3 3.200 . 4.600 4.227 4.120 4.338 . 0 0 "[ . 1 . 2]" 1
199 1 5 ILE MG 1 65 ARG HD3 3.060 . 4.320 2.489 1.866 3.297 . 0 0 "[ . 1 . 2]" 1
200 1 65 ARG HA 1 65 ARG HD2 3.470 . 5.140 4.690 4.644 4.729 . 0 0 "[ . 1 . 2]" 1
201 1 61 THR MG 1 65 ARG HD2 3.050 . 4.290 1.859 1.728 2.064 0.072 18 0 "[ . 1 . 2]" 1
202 1 5 ILE MG 1 65 ARG HD2 3.220 . 4.640 3.716 3.050 4.595 . 0 0 "[ . 1 . 2]" 1
203 1 5 ILE MD 1 65 ARG HD2 3.530 . 5.260 4.405 3.699 5.287 0.027 10 0 "[ . 1 . 2]" 1
204 1 45 ARG HA 1 45 ARG HD2 3.780 . 5.760 4.647 4.432 4.880 . 0 0 "[ . 1 . 2]" 1
205 1 45 ARG HA 1 45 ARG HD3 3.780 . 5.760 4.700 4.327 4.887 . 0 0 "[ . 1 . 2]" 1
206 1 60 ARG H 1 60 ARG HD3 3.780 . 5.760 5.408 5.065 5.653 . 0 0 "[ . 1 . 2]" 1
207 1 60 ARG HA 1 60 ARG HD3 3.480 . 5.160 4.757 4.414 4.976 . 0 0 "[ . 1 . 2]" 1
208 1 60 ARG H 1 60 ARG HD2 3.780 . 5.760 5.417 5.062 5.643 . 0 0 "[ . 1 . 2]" 1
209 1 60 ARG HA 1 60 ARG HD2 3.480 . 5.160 4.639 4.317 4.911 . 0 0 "[ . 1 . 2]" 1
210 1 70 LYS HE3 1 70 LYS HG3 3.140 . 4.480 3.043 2.435 4.276 . 0 0 "[ . 1 . 2]" 1
211 1 32 ASP HB3 1 90 THR MG 3.080 . 4.360 2.637 2.155 3.507 . 0 0 "[ . 1 . 2]" 1
212 1 3 ASP HB3 1 4 VAL MG2 3.090 . 4.380 3.514 2.903 3.855 . 0 0 "[ . 1 . 2]" 1
213 1 8 ASP HB2 1 9 TYR H 3.260 . 4.730 4.008 3.908 4.376 . 0 0 "[ . 1 . 2]" 1
214 1 27 LEU HB2 1 48 THR MG 3.390 . 4.980 4.621 4.156 5.021 0.041 20 0 "[ . 1 . 2]" 1
215 1 27 LEU HB2 1 27 LEU MD2 3.010 . 4.220 3.240 3.225 3.250 . 0 0 "[ . 1 . 2]" 1
216 1 31 LEU HB3 1 86 GLU HA 3.750 . 5.700 5.158 4.890 5.434 . 0 0 "[ . 1 . 2]" 1
217 1 31 LEU HB3 1 33 VAL HB 3.750 . 5.700 5.246 4.565 5.717 0.017 12 0 "[ . 1 . 2]" 1
218 1 67 LEU HB3 1 67 LEU MD2 3.230 . 4.660 2.456 2.419 2.499 . 0 0 "[ . 1 . 2]" 1
219 1 67 LEU HB2 1 67 LEU MD2 3.230 . 4.660 3.251 3.245 3.259 . 0 0 "[ . 1 . 2]" 1
220 1 25 GLN HA 1 25 GLN HG2 3.140 . 4.480 2.871 2.441 3.796 . 0 0 "[ . 1 . 2]" 1
221 1 25 GLN HA 1 25 GLN HG3 3.140 . 4.480 3.404 2.609 3.836 . 0 0 "[ . 1 . 2]" 1
222 1 9 TYR HD2 1 53 VAL HB 3.310 . 4.820 2.190 1.779 2.846 0.021 12 0 "[ . 1 . 2]" 1
223 1 53 VAL HB 1 54 GLU HB2 3.910 . 6.020 5.288 4.952 5.522 . 0 0 "[ . 1 . 2]" 1
224 1 44 VAL HB 1 55 VAL HB 4.110 . 6.420 5.203 4.821 5.702 . 0 0 "[ . 1 . 2]" 1
225 1 88 ARG HA 1 89 ILE HB 3.440 . 5.080 4.592 4.450 4.695 . 0 0 "[ . 1 . 2]" 1
226 1 54 GLU HA 1 54 GLU HG3 3.190 . 4.580 3.148 2.885 3.501 . 0 0 "[ . 1 . 2]" 1
227 1 54 GLU HA 1 54 GLU HG2 3.190 . 4.580 2.599 2.419 2.722 . 0 0 "[ . 1 . 2]" 1
228 1 10 LYS HB3 1 11 PRO HD3 3.270 . 4.740 3.987 3.433 4.390 . 0 0 "[ . 1 . 2]" 1
229 1 10 LYS HB3 1 11 PRO HD2 3.140 . 4.480 2.722 2.232 3.131 . 0 0 "[ . 1 . 2]" 1
230 1 33 VAL HB 1 38 ALA MB 3.420 . 5.040 3.771 2.966 4.667 . 0 0 "[ . 1 . 2]" 1
231 1 4 VAL H 1 4 VAL HB 3.040 . 4.280 3.704 3.599 3.793 . 0 0 "[ . 1 . 2]" 1
232 1 62 GLN HG3 1 63 ALA H 3.300 . 4.800 4.208 3.929 4.455 . 0 0 "[ . 1 . 2]" 1
233 1 62 GLN HA 1 62 GLN HG3 2.800 . 3.800 2.527 2.389 2.690 . 0 0 "[ . 1 . 2]" 1
234 1 61 THR HA 1 62 GLN HG3 3.310 . 4.820 4.888 4.644 5.058 0.238 14 0 "[ . 1 . 2]" 1
235 1 34 PRO HB2 1 36 PRO HD2 3.180 . 4.560 3.044 2.705 3.275 . 0 0 "[ . 1 . 2]" 1
236 1 58 PRO HB2 1 59 PRO HD2 3.240 . 4.680 3.061 2.646 3.573 . 0 0 "[ . 1 . 2]" 1
237 1 58 PRO HB3 1 59 PRO HD2 3.240 . 4.680 3.486 2.983 3.901 . 0 0 "[ . 1 . 2]" 1
238 1 36 PRO HB3 1 37 ILE H 3.300 . 4.800 4.088 3.990 4.160 . 0 0 "[ . 1 . 2]" 1
239 1 54 GLU H 1 54 GLU HB3 3.150 . 4.510 3.677 3.608 3.753 . 0 0 "[ . 1 . 2]" 1
240 1 45 ARG HB2 1 46 ALA H 3.400 . 5.000 4.405 4.112 4.543 . 0 0 "[ . 1 . 2]" 1
241 1 44 VAL HA 1 45 ARG HB2 3.290 . 4.780 4.424 4.061 4.747 . 0 0 "[ . 1 . 2]" 1
242 1 69 LEU HA 1 70 LYS HB2 3.480 . 5.160 4.651 4.529 4.787 . 0 0 "[ . 1 . 2]" 1
243 1 70 LYS HB3 1 71 GLY HA3 3.300 . 4.800 4.326 4.173 4.499 . 0 0 "[ . 1 . 2]" 1
244 1 88 ARG HB3 1 89 ILE H 3.270 . 4.740 3.770 3.566 3.918 . 0 0 "[ . 1 . 2]" 1
245 1 12 ALA MB 1 52 PRO HB2 2.850 . 3.900 2.515 2.088 2.970 . 0 0 "[ . 1 . 2]" 1
246 1 47 MET ME 1 52 PRO HB2 2.770 . 3.740 3.676 3.406 3.940 0.200 2 0 "[ . 1 . 2]" 1
247 1 71 GLY HA2 1 80 ARG HB3 3.310 . 4.820 3.222 2.061 3.850 . 0 0 "[ . 1 . 2]" 1
248 1 71 GLY HA3 1 80 ARG HB3 3.240 . 4.680 4.391 3.172 4.822 0.142 1 0 "[ . 1 . 2]" 1
249 1 30 THR MG 1 88 ARG HB2 3.140 . 4.480 3.986 2.910 4.567 0.087 11 0 "[ . 1 . 2]" 1
250 1 77 PRO HB3 1 78 ALA MB 3.910 . 6.020 5.349 5.078 5.673 . 0 0 "[ . 1 . 2]" 1
251 1 36 PRO HB2 1 37 ILE HA 3.520 . 5.240 4.051 3.962 4.181 . 0 0 "[ . 1 . 2]" 1
252 1 40 VAL HA 1 59 PRO HB3 3.440 . 5.080 3.995 3.216 4.858 . 0 0 "[ . 1 . 2]" 1
253 1 57 VAL H 1 57 VAL HB 3.090 . 4.380 2.549 2.495 2.655 . 0 0 "[ . 1 . 2]" 1
254 1 56 ALA HA 1 57 VAL HB 3.770 . 5.740 4.617 4.547 4.767 . 0 0 "[ . 1 . 2]" 1
255 1 41 GLY HA2 1 57 VAL HB 3.410 . 5.020 3.179 2.624 3.663 . 0 0 "[ . 1 . 2]" 1
256 1 39 VAL HB 1 40 VAL H 2.980 . 4.160 2.473 2.385 2.663 . 0 0 "[ . 1 . 2]" 1
257 1 36 PRO HA 1 39 VAL HB 3.690 . 5.580 3.183 2.864 3.387 . 0 0 "[ . 1 . 2]" 1
258 1 9 TYR HD1 1 69 LEU HG 3.330 . 4.860 4.431 4.162 4.890 0.030 4 0 "[ . 1 . 2]" 1
259 1 69 LEU HA 1 69 LEU HG 3.230 . 4.660 3.070 2.890 3.216 . 0 0 "[ . 1 . 2]" 1
260 1 69 LEU HG 1 83 LEU MD2 3.380 . 4.950 4.339 4.121 4.646 . 0 0 "[ . 1 . 2]" 1
261 1 45 ARG H 1 45 ARG HG2 3.470 . 5.140 4.306 3.719 4.643 . 0 0 "[ . 1 . 2]" 1
262 1 45 ARG HA 1 45 ARG HG2 3.170 . 4.540 2.838 2.516 3.234 . 0 0 "[ . 1 . 2]" 1
263 1 45 ARG H 1 45 ARG HG3 3.150 . 4.510 3.749 2.466 4.554 0.044 8 0 "[ . 1 . 2]" 1
264 1 45 ARG HA 1 45 ARG HG3 3.170 . 4.540 2.668 2.401 2.964 . 0 0 "[ . 1 . 2]" 1
265 1 5 ILE MG 1 58 PRO HG2 3.120 . 4.440 3.335 2.771 4.214 . 0 0 "[ . 1 . 2]" 1
266 1 27 LEU HG 1 83 LEU MD1 3.240 . 4.680 4.000 3.649 4.251 . 0 0 "[ . 1 . 2]" 1
267 1 5 ILE H 1 5 ILE HG12 3.460 . 5.120 4.537 4.480 4.593 . 0 0 "[ . 1 . 2]" 1
268 1 5 ILE HG12 1 6 ASP HA 3.400 . 5.000 4.519 4.376 4.716 . 0 0 "[ . 1 . 2]" 1
269 1 5 ILE HA 1 5 ILE HG12 3.100 . 4.400 3.154 3.073 3.233 . 0 0 "[ . 1 . 2]" 1
270 1 89 ILE H 1 89 ILE HG13 3.040 . 4.280 2.596 2.472 2.733 . 0 0 "[ . 1 . 2]" 1
271 1 5 ILE HA 1 5 ILE HG13 3.110 . 4.420 2.530 2.470 2.609 . 0 0 "[ . 1 . 2]" 1
272 1 88 ARG HA 1 88 ARG HG3 3.220 . 4.640 3.830 3.763 3.900 . 0 0 "[ . 1 . 2]" 1
273 1 88 ARG HG2 1 89 ILE H 3.730 . 5.660 5.304 5.169 5.475 . 0 0 "[ . 1 . 2]" 1
274 1 30 THR MG 1 88 ARG HG2 3.190 . 4.580 2.594 1.958 2.952 . 0 0 "[ . 1 . 2]" 1
275 1 80 ARG HA 1 80 ARG HG3 3.140 . 4.480 2.943 2.450 3.298 . 0 0 "[ . 1 . 2]" 1
276 1 48 THR HB 1 49 LEU HG 3.260 . 4.730 4.075 3.660 4.479 . 0 0 "[ . 1 . 2]" 1
277 1 67 LEU H 1 67 LEU HG 3.180 . 4.560 2.859 2.489 3.098 . 0 0 "[ . 1 . 2]" 1
278 1 83 LEU HG 1 85 LEU HG 3.390 . 4.980 2.140 1.819 2.496 . 0 0 "[ . 1 . 2]" 1
279 1 80 ARG HA 1 80 ARG HG2 3.080 . 4.360 2.427 2.222 2.957 . 0 0 "[ . 1 . 2]" 1
280 1 85 LEU H 1 85 LEU MD1 3.270 . 4.740 4.104 3.918 4.302 . 0 0 "[ . 1 . 2]" 1
281 1 85 LEU HA 1 85 LEU MD1 3.250 . 4.700 3.882 3.856 3.905 . 0 0 "[ . 1 . 2]" 1
282 1 31 LEU HA 1 85 LEU MD1 3.410 . 5.020 3.944 3.605 4.336 . 0 0 "[ . 1 . 2]" 1
283 1 46 ALA HA 1 85 LEU MD1 3.690 . 5.580 4.650 4.190 5.394 . 0 0 "[ . 1 . 2]" 1
284 1 85 LEU HB2 1 85 LEU MD1 2.910 . 4.020 2.375 2.346 2.408 . 0 0 "[ . 1 . 2]" 1
285 1 29 ALA MB 1 85 LEU MD1 3.450 . 5.100 4.260 4.168 4.488 . 0 0 "[ . 1 . 2]" 1
286 1 31 LEU HB3 1 85 LEU MD1 3.570 . 5.340 3.830 3.390 4.383 . 0 0 "[ . 1 . 2]" 1
287 1 85 LEU HB3 1 85 LEU MD1 2.910 . 4.020 2.413 2.388 2.434 . 0 0 "[ . 1 . 2]" 1
288 1 69 LEU MD1 1 85 LEU MD1 2.790 . 3.780 1.920 1.799 2.020 0.001 19 0 "[ . 1 . 2]" 1
289 1 69 LEU MD2 1 85 LEU MD1 3.140 . 4.480 3.389 2.842 3.775 . 0 0 "[ . 1 . 2]" 1
290 1 67 LEU MD1 1 87 VAL H 3.220 . 4.640 4.567 4.407 4.659 0.019 14 0 "[ . 1 . 2]" 1
291 1 67 LEU HA 1 67 LEU MD1 3.090 . 4.380 3.982 3.946 4.016 . 0 0 "[ . 1 . 2]" 1
292 1 67 LEU MD1 1 86 GLU HA 3.590 . 5.380 5.409 5.178 5.523 0.143 15 0 "[ . 1 . 2]" 1
293 1 57 VAL HA 1 67 LEU MD1 3.100 . 4.400 3.415 2.881 3.910 . 0 0 "[ . 1 . 2]" 1
294 1 58 PRO HD3 1 67 LEU MD1 3.300 . 4.800 3.811 3.376 4.459 . 0 0 "[ . 1 . 2]" 1
295 1 58 PRO HD2 1 67 LEU MD1 3.200 . 4.600 3.252 2.639 3.968 . 0 0 "[ . 1 . 2]" 1
296 1 83 LEU HA 1 83 LEU MD2 3.150 . 4.510 3.967 3.937 3.998 . 0 0 "[ . 1 . 2]" 1
297 1 48 THR HB 1 83 LEU MD2 3.280 . 4.760 3.846 3.441 4.298 . 0 0 "[ . 1 . 2]" 1
298 1 48 THR HA 1 83 LEU MD2 3.500 . 5.200 4.418 3.654 4.786 . 0 0 "[ . 1 . 2]" 1
299 1 83 LEU HB2 1 83 LEU MD2 2.720 . 3.640 2.445 2.414 2.488 . 0 0 "[ . 1 . 2]" 1
300 1 83 LEU HB3 1 83 LEU MD2 2.810 . 3.820 2.360 2.332 2.382 . 0 0 "[ . 1 . 2]" 1
301 1 69 LEU MD1 1 83 LEU MD2 2.700 . 3.600 2.007 1.856 2.147 . 0 0 "[ . 1 . 2]" 1
302 1 69 LEU MD2 1 83 LEU MD2 3.170 . 4.540 4.211 4.087 4.343 . 0 0 "[ . 1 . 2]" 1
303 1 31 LEU MD2 1 44 VAL H 3.870 . 5.940 4.622 4.265 4.859 . 0 0 "[ . 1 . 2]" 1
304 1 31 LEU HA 1 31 LEU MD2 3.120 . 4.440 3.932 3.899 3.960 . 0 0 "[ . 1 . 2]" 1
305 1 31 LEU MD2 1 44 VAL HB 3.380 . 4.960 4.651 4.345 5.045 0.085 3 0 "[ . 1 . 2]" 1
306 1 31 LEU MD2 1 87 VAL HB 3.570 . 5.340 5.251 4.907 5.479 0.139 8 0 "[ . 1 . 2]" 1
307 1 31 LEU MD2 1 55 VAL HB 2.960 . 4.120 2.699 2.339 3.108 . 0 0 "[ . 1 . 2]" 1
308 1 31 LEU HB3 1 31 LEU MD2 2.780 . 3.760 2.364 2.325 2.398 . 0 0 "[ . 1 . 2]" 1
309 1 69 LEU MD1 1 85 LEU H 3.180 . 4.560 4.106 3.492 4.584 0.024 9 0 "[ . 1 . 2]" 1
310 1 9 TYR HE1 1 69 LEU MD1 3.310 . 4.820 2.830 1.841 3.678 . 0 0 "[ . 1 . 2]" 1
311 1 69 LEU MD1 1 85 LEU HA 3.440 . 5.080 5.079 4.697 5.272 0.192 11 0 "[ . 1 . 2]" 1
312 1 69 LEU HA 1 69 LEU MD1 3.090 . 4.380 3.990 3.953 4.026 . 0 0 "[ . 1 . 2]" 1
313 1 68 ARG HA 1 69 LEU MD1 3.690 . 5.580 4.791 4.411 5.129 . 0 0 "[ . 1 . 2]" 1
314 1 9 TYR HB2 1 69 LEU MD1 3.370 . 4.940 4.357 3.900 5.032 0.092 17 0 "[ . 1 . 2]" 1
315 1 9 TYR HB3 1 69 LEU MD1 3.300 . 4.800 3.106 2.550 3.925 . 0 0 "[ . 1 . 2]" 1
316 1 55 VAL MG2 1 69 LEU MD1 2.310 . 2.820 2.721 2.483 2.929 0.109 17 0 "[ . 1 . 2]" 1
317 1 9 TYR HD1 1 69 LEU MD2 2.820 . 3.840 2.659 2.105 3.117 . 0 0 "[ . 1 . 2]" 1
318 1 69 LEU HA 1 69 LEU MD2 2.840 . 3.880 2.283 2.155 2.370 . 0 0 "[ . 1 . 2]" 1
319 1 9 TYR HB2 1 69 LEU MD2 3.390 . 4.980 4.742 4.083 5.058 0.078 4 0 "[ . 1 . 2]" 1
320 1 9 TYR HB3 1 69 LEU MD2 3.150 . 4.500 3.273 2.577 3.717 . 0 0 "[ . 1 . 2]" 1
321 1 7 ALA MB 1 69 LEU MD2 2.610 . 3.420 2.134 1.965 2.456 . 0 0 "[ . 1 . 2]" 1
322 1 55 VAL MG2 1 69 LEU MD2 2.710 . 3.620 3.576 3.340 3.795 0.175 13 0 "[ . 1 . 2]" 1
323 1 27 LEU H 1 27 LEU MD1 3.480 . 5.160 4.278 3.998 4.610 . 0 0 "[ . 1 . 2]" 1
324 1 27 LEU MD1 1 74 PHE HE1 2.900 . 4.000 2.596 1.813 3.239 . 0 0 "[ . 1 . 2]" 1
325 1 27 LEU MD1 1 73 GLY HA2 3.250 . 4.700 3.686 2.856 4.423 . 0 0 "[ . 1 . 2]" 1
326 1 27 LEU MD1 1 83 LEU HB2 2.920 . 4.040 3.661 3.146 4.071 0.031 1 0 "[ . 1 . 2]" 1
327 1 27 LEU HB3 1 27 LEU MD1 2.780 . 3.760 2.435 2.363 2.480 . 0 0 "[ . 1 . 2]" 1
328 1 27 LEU HB2 1 27 LEU MD1 2.740 . 3.680 2.373 2.329 2.427 . 0 0 "[ . 1 . 2]" 1
329 1 27 LEU MD1 1 48 THR MG 2.800 . 3.800 3.173 2.884 3.445 . 0 0 "[ . 1 . 2]" 1
330 1 49 LEU H 1 49 LEU MD1 3.130 . 4.460 3.836 3.709 3.984 . 0 0 "[ . 1 . 2]" 1
331 1 49 LEU MD1 1 74 PHE HE1 2.690 . 3.580 2.244 1.749 2.879 0.051 1 0 "[ . 1 . 2]" 1
332 1 49 LEU HA 1 49 LEU MD1 3.050 . 4.290 3.857 3.783 3.930 . 0 0 "[ . 1 . 2]" 1
333 1 49 LEU HB3 1 49 LEU MD1 3.070 . 4.340 2.344 2.302 2.398 . 0 0 "[ . 1 . 2]" 1
334 1 48 THR HB 1 49 LEU MD2 3.280 . 4.760 4.428 4.267 4.643 . 0 0 "[ . 1 . 2]" 1
335 1 48 THR HA 1 49 LEU MD2 3.300 . 4.800 3.437 3.305 3.593 . 0 0 "[ . 1 . 2]" 1
336 1 49 LEU HA 1 49 LEU MD2 2.630 . 3.460 2.224 2.154 2.340 . 0 0 "[ . 1 . 2]" 1
337 1 48 THR MG 1 49 LEU MD2 3.300 . 4.800 4.814 4.630 4.965 0.165 8 0 "[ . 1 . 2]" 1
338 1 27 LEU MD2 1 49 LEU MD2 2.730 . 3.660 3.172 2.728 3.665 0.005 1 0 "[ . 1 . 2]" 1
339 1 31 LEU H 1 31 LEU MD1 3.260 . 4.720 4.325 4.292 4.352 . 0 0 "[ . 1 . 2]" 1
340 1 31 LEU MD1 1 45 ARG HA 3.380 . 4.950 4.724 4.119 5.066 0.116 2 0 "[ . 1 . 2]" 1
341 1 30 THR HA 1 31 LEU MD1 4.240 . 6.680 5.604 5.477 5.736 . 0 0 "[ . 1 . 2]" 1
342 1 31 LEU MD1 1 54 GLU HA 4.430 . 7.060 5.452 4.867 5.949 . 0 0 "[ . 1 . 2]" 1
343 1 31 LEU HA 1 31 LEU MD1 2.550 . 3.300 2.097 2.046 2.146 . 0 0 "[ . 1 . 2]" 1
344 1 31 LEU MD1 1 44 VAL HB 3.010 . 4.220 3.512 3.110 3.850 . 0 0 "[ . 1 . 2]" 1
345 1 31 LEU MD1 1 55 VAL HB 2.940 . 4.080 2.921 2.379 3.271 . 0 0 "[ . 1 . 2]" 1
346 1 31 LEU HB3 1 31 LEU MD1 2.740 . 3.680 3.244 3.234 3.253 . 0 0 "[ . 1 . 2]" 1
347 1 31 LEU MD1 1 55 VAL MG2 2.530 . 3.260 2.610 2.282 2.809 . 0 0 "[ . 1 . 2]" 1
348 1 43 LYS HG2 1 56 ALA H 3.220 . 4.640 3.511 2.902 4.058 . 0 0 "[ . 1 . 2]" 1
349 1 43 LYS HA 1 43 LYS HG2 3.180 . 4.560 2.512 2.432 2.591 . 0 0 "[ . 1 . 2]" 1
350 1 43 LYS HG2 1 56 ALA HA 3.270 . 4.740 2.222 1.971 2.582 . 0 0 "[ . 1 . 2]" 1
351 1 70 LYS HA 1 70 LYS HG3 3.210 . 4.620 3.206 3.053 3.388 . 0 0 "[ . 1 . 2]" 1
352 1 70 LYS HE2 1 70 LYS HG3 3.140 . 4.480 3.241 2.510 4.283 . 0 0 "[ . 1 . 2]" 1
353 1 43 LYS H 1 43 LYS HG3 3.190 . 4.580 3.426 2.777 3.623 . 0 0 "[ . 1 . 2]" 1
354 1 43 LYS HA 1 43 LYS HG3 3.180 . 4.560 3.039 2.915 3.153 . 0 0 "[ . 1 . 2]" 1
355 1 61 THR MG 1 65 ARG H 3.140 . 4.480 4.231 3.848 4.549 0.069 6 0 "[ . 1 . 2]" 1
356 1 61 THR MG 1 62 GLN HA 3.150 . 4.500 4.023 3.475 4.378 . 0 0 "[ . 1 . 2]" 1
357 1 61 THR HA 1 61 THR MG 2.650 . 3.500 2.526 2.426 2.679 . 0 0 "[ . 1 . 2]" 1
358 1 38 ALA HA 1 61 THR MG 3.130 . 4.460 3.981 3.358 4.449 . 0 0 "[ . 1 . 2]" 1
359 1 58 PRO HD2 1 61 THR MG 3.340 . 4.880 3.520 2.985 4.173 . 0 0 "[ . 1 . 2]" 1
360 1 61 THR MG 1 62 GLN HG3 3.700 . 5.600 5.517 5.164 5.745 0.145 6 0 "[ . 1 . 2]" 1
361 1 61 THR MG 1 65 ARG HB2 2.730 . 3.660 2.681 2.357 2.980 . 0 0 "[ . 1 . 2]" 1
362 1 58 PRO HG2 1 61 THR MG 2.860 . 3.920 3.255 2.838 3.751 . 0 0 "[ . 1 . 2]" 1
363 1 38 ALA MB 1 61 THR MG 2.720 . 3.640 3.266 2.563 3.756 0.116 17 0 "[ . 1 . 2]" 1
364 1 31 LEU MD1 1 46 ALA MB 2.390 . 2.980 1.925 1.750 2.031 0.050 15 0 "[ . 1 . 2]" 1
365 1 45 ARG HA 1 46 ALA MB 3.120 . 4.440 4.030 3.935 4.110 . 0 0 "[ . 1 . 2]" 1
366 1 46 ALA MB 1 53 VAL MG2 2.580 . 3.360 2.108 1.956 2.549 . 0 0 "[ . 1 . 2]" 1
367 1 47 MET ME 1 53 VAL H 3.180 . 4.560 3.966 3.459 4.447 . 0 0 "[ . 1 . 2]" 1
368 1 47 MET ME 1 48 THR H 2.870 . 3.940 3.235 2.859 3.844 . 0 0 "[ . 1 . 2]" 1
369 1 47 MET ME 1 52 PRO HA 2.900 . 4.000 2.352 2.068 2.669 . 0 0 "[ . 1 . 2]" 1
370 1 47 MET HA 1 47 MET ME 2.620 . 3.440 2.032 1.792 2.389 0.008 6 0 "[ . 1 . 2]" 1
371 1 47 MET ME 1 52 PRO HD3 2.560 . 3.320 2.901 2.463 3.337 0.017 6 0 "[ . 1 . 2]" 1
372 1 47 MET ME 1 52 PRO HD2 3.050 . 4.300 4.126 3.750 4.448 0.148 6 0 "[ . 1 . 2]" 1
373 1 47 MET ME 1 47 MET HG2 2.930 . 4.070 2.897 2.410 3.471 . 0 0 "[ . 1 . 2]" 1
374 1 47 MET ME 1 52 PRO HB3 2.570 . 3.340 2.336 2.030 2.716 . 0 0 "[ . 1 . 2]" 1
375 1 46 ALA MB 1 47 MET ME 3.580 . 5.360 5.012 4.508 5.514 0.154 7 0 "[ . 1 . 2]" 1
376 1 47 MET ME 1 53 VAL MG1 3.380 . 4.960 4.922 4.530 5.093 0.133 11 0 "[ . 1 . 2]" 1
377 1 67 LEU MD2 1 68 ARG H 3.100 . 4.400 4.013 3.703 4.292 . 0 0 "[ . 1 . 2]" 1
378 1 85 LEU MD2 1 86 GLU H 2.780 . 3.760 3.517 3.223 3.635 . 0 0 "[ . 1 . 2]" 1
379 1 29 ALA H 1 85 LEU MD2 3.000 . 4.200 3.140 2.827 3.410 . 0 0 "[ . 1 . 2]" 1
380 1 5 ILE H 1 67 LEU MD2 3.030 . 4.260 3.512 3.136 4.038 . 0 0 "[ . 1 . 2]" 1
381 1 67 LEU HA 1 67 LEU MD2 2.600 . 3.400 2.232 2.144 2.345 . 0 0 "[ . 1 . 2]" 1
382 1 85 LEU HA 1 85 LEU MD2 2.620 . 3.440 1.991 1.970 2.011 . 0 0 "[ . 1 . 2]" 1
383 1 31 LEU HA 1 85 LEU MD2 3.000 . 4.200 3.245 3.050 3.480 . 0 0 "[ . 1 . 2]" 1
384 1 7 ALA HA 1 67 LEU MD2 2.900 . 4.000 4.038 3.873 4.141 0.141 3 0 "[ . 1 . 2]" 1
385 1 58 PRO HD3 1 67 LEU MD2 3.030 . 4.260 3.271 2.859 3.746 . 0 0 "[ . 1 . 2]" 1
386 1 58 PRO HD2 1 67 LEU MD2 2.900 . 4.000 3.028 2.601 3.638 . 0 0 "[ . 1 . 2]" 1
387 1 65 ARG HD3 1 67 LEU MD2 3.480 . 5.160 4.037 3.229 4.610 . 0 0 "[ . 1 . 2]" 1
388 1 29 ALA MB 1 85 LEU MD2 2.470 . 3.140 2.057 1.928 2.243 . 0 0 "[ . 1 . 2]" 1
389 1 28 TYR H 1 83 LEU MD1 3.320 . 4.840 4.155 3.612 4.582 . 0 0 "[ . 1 . 2]" 1
390 1 28 TYR HA 1 83 LEU MD1 3.240 . 4.680 3.668 3.148 4.269 . 0 0 "[ . 1 . 2]" 1
391 1 83 LEU HA 1 83 LEU MD1 2.750 . 3.700 2.266 2.205 2.337 . 0 0 "[ . 1 . 2]" 1
392 1 48 THR HB 1 83 LEU MD1 3.640 . 5.480 4.252 3.633 5.060 . 0 0 "[ . 1 . 2]" 1
393 1 83 LEU MD1 1 84 TYR HA 3.830 . 5.860 4.597 4.371 4.741 . 0 0 "[ . 1 . 2]" 1
394 1 27 LEU HB3 1 83 LEU MD1 2.760 . 3.720 2.482 2.046 2.835 . 0 0 "[ . 1 . 2]" 1
395 1 27 LEU HB2 1 83 LEU MD1 2.610 . 3.420 2.119 1.861 2.422 . 0 0 "[ . 1 . 2]" 1
396 1 69 LEU MD1 1 83 LEU MD1 2.880 . 3.960 3.630 3.524 3.769 . 0 0 "[ . 1 . 2]" 1
397 1 55 VAL MG2 1 56 ALA H 3.090 . 4.380 4.220 4.178 4.311 . 0 0 "[ . 1 . 2]" 1
398 1 9 TYR HD1 1 55 VAL MG2 3.280 . 4.760 3.344 2.365 4.033 . 0 0 "[ . 1 . 2]" 1
399 1 9 TYR HD2 1 55 VAL MG2 3.600 . 5.400 4.427 4.106 4.772 . 0 0 "[ . 1 . 2]" 1
400 1 9 TYR HA 1 55 VAL MG2 3.130 . 4.460 3.803 3.401 4.374 . 0 0 "[ . 1 . 2]" 1
401 1 45 ARG HA 1 55 VAL MG2 3.480 . 5.160 4.128 3.637 4.618 . 0 0 "[ . 1 . 2]" 1
402 1 31 LEU HA 1 55 VAL MG2 3.800 . 5.800 5.425 5.040 5.623 . 0 0 "[ . 1 . 2]" 1
403 1 55 VAL HA 1 55 VAL MG2 2.740 . 3.680 2.508 2.468 2.555 . 0 0 "[ . 1 . 2]" 1
404 1 9 TYR HB2 1 55 VAL MG2 2.980 . 4.160 2.611 2.298 2.826 . 0 0 "[ . 1 . 2]" 1
405 1 9 TYR HB3 1 55 VAL MG2 3.040 . 4.280 2.026 1.803 2.378 . 0 0 "[ . 1 . 2]" 1
406 1 53 VAL HB 1 55 VAL MG2 3.070 . 4.340 3.864 3.551 4.145 . 0 0 "[ . 1 . 2]" 1
407 1 33 VAL HA 1 33 VAL MG1 2.760 . 3.720 2.802 2.368 3.278 . 0 0 "[ . 1 . 2]" 1
408 1 33 VAL MG1 1 34 PRO HD3 3.590 . 5.380 4.262 3.683 4.815 . 0 0 "[ . 1 . 2]" 1
409 1 33 VAL MG1 1 34 PRO HD2 3.310 . 4.820 3.783 2.780 4.801 . 0 0 "[ . 1 . 2]" 1
410 1 57 VAL MG1 1 58 PRO HD2 3.390 . 4.980 2.603 2.390 2.864 . 0 0 "[ . 1 . 2]" 1
411 1 37 ILE MG 1 57 VAL MG1 2.790 . 3.780 3.066 2.727 3.501 . 0 0 "[ . 1 . 2]" 1
412 1 9 TYR HE2 1 53 VAL MG1 2.620 . 3.440 2.498 1.958 2.943 . 0 0 "[ . 1 . 2]" 1
413 1 53 VAL HA 1 53 VAL MG1 2.700 . 3.600 2.436 2.374 2.505 . 0 0 "[ . 1 . 2]" 1
414 1 11 PRO HA 1 53 VAL MG1 2.670 . 3.540 1.898 1.752 2.196 0.048 2 0 "[ . 1 . 2]" 1
415 1 48 THR HA 1 48 THR MG 2.810 . 3.820 2.410 2.360 2.498 . 0 0 "[ . 1 . 2]" 1
416 1 12 ALA MB 1 53 VAL MG1 3.000 . 4.200 4.043 3.790 4.288 0.088 7 0 "[ . 1 . 2]" 1
417 1 33 VAL H 1 33 VAL MG2 3.190 . 4.580 3.167 2.417 3.969 . 0 0 "[ . 1 . 2]" 1
418 1 33 VAL HA 1 33 VAL MG2 2.760 . 3.720 2.483 2.435 2.557 . 0 0 "[ . 1 . 2]" 1
419 1 33 VAL MG2 1 34 PRO HD3 3.590 . 5.380 4.055 3.554 4.451 . 0 0 "[ . 1 . 2]" 1
420 1 33 VAL MG2 1 34 PRO HD2 3.310 . 4.820 3.624 2.585 4.468 . 0 0 "[ . 1 . 2]" 1
421 1 90 THR H 1 90 THR MG 2.700 . 3.600 2.624 1.978 3.764 0.164 1 0 "[ . 1 . 2]" 1
422 1 65 ARG H 1 87 VAL MG2 3.150 . 4.500 4.087 3.718 4.522 0.022 18 0 "[ . 1 . 2]" 1
423 1 32 ASP HA 1 90 THR MG 3.020 . 4.240 3.234 2.548 4.346 0.106 1 0 "[ . 1 . 2]" 1
424 1 65 ARG HB2 1 87 VAL MG2 2.670 . 3.540 2.604 2.207 3.180 . 0 0 "[ . 1 . 2]" 1
425 1 61 THR MG 1 87 VAL MG2 2.520 . 3.240 2.340 1.975 3.101 . 0 0 "[ . 1 . 2]" 1
426 1 44 VAL MG1 1 57 VAL H 3.640 . 5.480 4.584 4.286 4.984 . 0 0 "[ . 1 . 2]" 1
427 1 40 VAL MG2 1 41 GLY H 3.350 . 4.900 3.163 2.414 4.215 . 0 0 "[ . 1 . 2]" 1
428 1 43 LYS H 1 44 VAL MG1 3.420 . 5.040 4.258 3.925 4.786 . 0 0 "[ . 1 . 2]" 1
429 1 39 VAL H 1 39 VAL MG1 3.080 . 4.360 3.810 3.772 3.837 . 0 0 "[ . 1 . 2]" 1
430 1 39 VAL MG1 1 40 VAL H 2.750 . 3.700 3.303 3.102 3.508 . 0 0 "[ . 1 . 2]" 1
431 1 43 LYS HA 1 44 VAL MG1 3.350 . 4.900 3.885 3.690 4.120 . 0 0 "[ . 1 . 2]" 1
432 1 33 VAL HA 1 44 VAL MG1 2.600 . 3.400 1.814 1.756 1.949 0.044 3 0 "[ . 1 . 2]" 1
433 1 44 VAL HA 1 44 VAL MG1 2.730 . 3.660 2.380 2.326 2.427 . 0 0 "[ . 1 . 2]" 1
434 1 34 PRO HD3 1 44 VAL MG1 2.780 . 3.760 2.670 2.466 2.804 . 0 0 "[ . 1 . 2]" 1
435 1 34 PRO HD2 1 44 VAL MG1 2.860 . 3.920 2.131 2.001 2.286 . 0 0 "[ . 1 . 2]" 1
436 1 37 ILE HB 1 44 VAL MG1 2.910 . 4.020 3.152 2.973 3.363 . 0 0 "[ . 1 . 2]" 1
437 1 31 LEU HG 1 44 VAL MG1 3.020 . 4.240 4.228 4.008 4.403 0.163 9 0 "[ . 1 . 2]" 1
438 1 37 ILE MG 1 44 VAL MG1 2.630 . 3.460 1.932 1.756 2.162 0.044 7 0 "[ . 1 . 2]" 1
439 1 30 THR MG 1 31 LEU H 2.690 . 3.580 3.176 2.268 3.691 0.111 19 0 "[ . 1 . 2]" 1
440 1 30 THR HA 1 30 THR MG 2.680 . 3.560 2.332 2.281 2.495 . 0 0 "[ . 1 . 2]" 1
441 1 30 THR MG 1 86 GLU HA 3.410 . 5.020 4.760 4.347 5.063 0.043 18 0 "[ . 1 . 2]" 1
442 1 30 THR MG 1 88 ARG HA 3.610 . 5.420 5.182 4.650 5.488 0.068 4 0 "[ . 1 . 2]" 1
443 1 30 THR MG 1 87 VAL HA 3.780 . 5.760 5.313 4.432 5.881 0.121 11 0 "[ . 1 . 2]" 1
444 1 30 THR MG 1 86 GLU HB2 2.680 . 3.560 2.244 1.774 2.799 0.026 2 0 "[ . 1 . 2]" 1
445 1 30 THR MG 1 88 ARG HG3 2.870 . 3.940 2.570 2.201 3.078 . 0 0 "[ . 1 . 2]" 1
446 1 7 ALA MB 1 68 ARG H 3.070 . 4.340 4.148 3.446 4.491 0.151 12 0 "[ . 1 . 2]" 1
447 1 7 ALA MB 1 56 ALA H 3.660 . 5.520 4.586 4.003 4.985 . 0 0 "[ . 1 . 2]" 1
448 1 6 ASP HA 1 7 ALA MB 3.150 . 4.500 4.010 3.900 4.163 . 0 0 "[ . 1 . 2]" 1
449 1 7 ALA MB 1 69 LEU MD1 3.060 . 4.320 3.954 3.552 4.307 . 0 0 "[ . 1 . 2]" 1
450 1 12 ALA MB 1 53 VAL HA 2.790 . 3.780 2.649 2.296 3.118 . 0 0 "[ . 1 . 2]" 1
451 1 12 ALA MB 1 54 GLU HG2 2.700 . 3.600 3.153 2.341 3.576 . 0 0 "[ . 1 . 2]" 1
452 1 12 ALA MB 1 54 GLU HG3 2.700 . 3.600 1.939 1.727 2.806 0.073 12 0 "[ . 1 . 2]" 1
453 1 12 ALA MB 1 45 ARG HG3 3.360 . 4.920 3.695 2.768 4.905 . 0 0 "[ . 1 . 2]" 1
454 1 12 ALA MB 1 45 ARG HG2 3.170 . 4.540 3.775 2.512 4.614 0.074 1 0 "[ . 1 . 2]" 1
455 1 57 VAL H 1 57 VAL MG2 3.130 . 4.460 2.111 1.982 2.281 . 0 0 "[ . 1 . 2]" 1
456 1 42 GLY H 1 57 VAL MG2 3.040 . 4.280 3.896 3.488 4.406 0.126 17 0 "[ . 1 . 2]" 1
457 1 57 VAL HA 1 57 VAL MG2 2.900 . 4.000 2.492 2.442 2.550 . 0 0 "[ . 1 . 2]" 1
458 1 57 VAL MG2 1 58 PRO HD2 3.390 . 4.980 3.857 3.771 3.934 . 0 0 "[ . 1 . 2]" 1
459 1 37 ILE MG 1 57 VAL MG2 2.790 . 3.780 2.607 2.111 2.971 . 0 0 "[ . 1 . 2]" 1
460 1 44 VAL MG2 1 57 VAL H 3.310 . 4.820 4.031 3.803 4.178 . 0 0 "[ . 1 . 2]" 1
461 1 43 LYS HA 1 44 VAL MG2 3.060 . 4.320 3.685 3.564 3.821 . 0 0 "[ . 1 . 2]" 1
462 1 44 VAL HA 1 44 VAL MG2 2.650 . 3.500 3.262 3.250 3.272 . 0 0 "[ . 1 . 2]" 1
463 1 44 VAL MG2 1 57 VAL HA 3.420 . 5.040 4.627 4.272 4.917 . 0 0 "[ . 1 . 2]" 1
464 1 34 PRO HD2 1 44 VAL MG2 3.790 . 5.780 4.442 4.215 4.702 . 0 0 "[ . 1 . 2]" 1
465 1 44 VAL MG2 1 55 VAL HB 2.710 . 3.620 2.575 2.234 3.058 . 0 0 "[ . 1 . 2]" 1
466 1 31 LEU HB3 1 44 VAL MG2 3.270 . 4.740 4.516 4.366 4.695 . 0 0 "[ . 1 . 2]" 1
467 1 31 LEU HG 1 44 VAL MG2 2.860 . 3.920 2.436 2.268 2.628 . 0 0 "[ . 1 . 2]" 1
468 1 31 LEU MD2 1 44 VAL MG2 2.540 . 3.280 2.301 2.111 2.571 . 0 0 "[ . 1 . 2]" 1
469 1 55 VAL H 1 55 VAL MG1 3.050 . 4.290 3.843 3.812 3.874 . 0 0 "[ . 1 . 2]" 1
470 1 64 GLY H 1 87 VAL MG1 3.590 . 5.380 3.535 2.950 3.997 . 0 0 "[ . 1 . 2]" 1
471 1 44 VAL H 1 55 VAL MG1 3.500 . 5.200 4.510 4.333 4.688 . 0 0 "[ . 1 . 2]" 1
472 1 65 ARG H 1 87 VAL MG1 3.150 . 4.500 3.638 3.085 4.201 . 0 0 "[ . 1 . 2]" 1
473 1 9 TYR HA 1 55 VAL MG1 3.280 . 4.760 3.806 3.366 4.377 . 0 0 "[ . 1 . 2]" 1
474 1 55 VAL MG1 1 56 ALA HA 3.070 . 4.340 4.260 4.146 4.359 0.019 18 0 "[ . 1 . 2]" 1
475 1 55 VAL HA 1 55 VAL MG1 2.700 . 3.600 2.440 2.399 2.467 . 0 0 "[ . 1 . 2]" 1
476 1 87 VAL HA 1 87 VAL MG1 2.870 . 3.940 2.488 2.391 2.568 . 0 0 "[ . 1 . 2]" 1
477 1 9 TYR HB2 1 55 VAL MG1 3.120 . 4.440 3.983 3.504 4.388 . 0 0 "[ . 1 . 2]" 1
478 1 9 TYR HB3 1 55 VAL MG1 3.150 . 4.500 2.767 2.476 3.043 . 0 0 "[ . 1 . 2]" 1
479 1 65 ARG HB2 1 87 VAL MG1 2.670 . 3.540 2.987 2.344 3.499 . 0 0 "[ . 1 . 2]" 1
480 1 7 ALA MB 1 55 VAL MG1 2.590 . 3.380 2.816 2.330 3.131 . 0 0 "[ . 1 . 2]" 1
481 1 61 THR MG 1 87 VAL MG1 2.520 . 3.240 1.817 1.716 1.962 0.084 10 0 "[ . 1 . 2]" 1
482 1 39 VAL MG2 1 60 ARG H 3.590 . 5.380 4.786 4.415 5.223 . 0 0 "[ . 1 . 2]" 1
483 1 39 VAL HA 1 39 VAL MG2 2.670 . 3.540 2.425 2.378 2.464 . 0 0 "[ . 1 . 2]" 1
484 1 4 VAL MG2 1 5 ILE H 3.090 . 4.380 3.356 2.912 3.953 . 0 0 "[ . 1 . 2]" 1
485 1 4 VAL MG2 1 84 TYR HE1 2.880 . 3.960 3.923 3.781 4.010 0.050 4 0 "[ . 1 . 2]" 1
486 1 4 VAL MG2 1 67 LEU HA 3.110 . 4.420 3.373 2.691 4.031 . 0 0 "[ . 1 . 2]" 1
487 1 4 VAL HA 1 4 VAL MG2 2.720 . 3.640 3.263 3.250 3.278 . 0 0 "[ . 1 . 2]" 1
488 1 4 VAL MG2 1 68 ARG HA 3.090 . 4.380 3.878 3.658 4.095 . 0 0 "[ . 1 . 2]" 1
489 1 3 ASP HB2 1 4 VAL MG2 3.460 . 5.120 5.005 4.488 5.250 0.130 15 0 "[ . 1 . 2]" 1
490 1 4 VAL MG2 1 66 LYS HG3 3.460 . 5.120 4.401 4.178 4.628 . 0 0 "[ . 1 . 2]" 1
491 1 4 VAL MG2 1 7 ALA MB 3.240 . 4.680 4.702 4.380 4.887 0.207 15 0 "[ . 1 . 2]" 1
492 1 40 VAL HA 1 40 VAL MG2 2.680 . 3.560 2.893 2.305 3.271 . 0 0 "[ . 1 . 2]" 1
493 1 4 VAL MG1 1 84 TYR HE1 2.780 . 3.760 1.913 1.819 2.156 . 0 0 "[ . 1 . 2]" 1
494 1 4 VAL HA 1 4 VAL MG1 2.690 . 3.580 2.440 2.361 2.486 . 0 0 "[ . 1 . 2]" 1
495 1 4 VAL MG1 1 68 ARG HA 3.050 . 4.300 3.923 3.576 4.327 0.027 5 0 "[ . 1 . 2]" 1
496 1 3 ASP HB2 1 4 VAL MG1 3.580 . 5.360 4.444 4.169 4.760 . 0 0 "[ . 1 . 2]" 1
497 1 3 ASP HB3 1 4 VAL MG1 3.080 . 4.360 3.031 2.671 3.581 . 0 0 "[ . 1 . 2]" 1
498 1 4 VAL MG1 1 66 LYS HB2 2.640 . 3.480 2.515 2.254 2.879 . 0 0 "[ . 1 . 2]" 1
499 1 4 VAL MG1 1 66 LYS HG2 2.870 . 3.940 3.520 3.366 3.682 . 0 0 "[ . 1 . 2]" 1
500 1 4 VAL MG1 1 66 LYS HG3 2.970 . 4.140 1.984 1.723 2.256 0.077 6 0 "[ . 1 . 2]" 1
501 1 40 VAL MG1 1 41 GLY H 3.350 . 4.900 3.428 2.414 4.140 . 0 0 "[ . 1 . 2]" 1
502 1 40 VAL HA 1 40 VAL MG1 2.680 . 3.560 2.769 2.388 3.283 . 0 0 "[ . 1 . 2]" 1
503 1 63 ALA MB 1 65 ARG H 3.400 . 5.000 4.499 4.201 4.635 . 0 0 "[ . 1 . 2]" 1
504 1 62 GLN HA 1 63 ALA MB 3.360 . 4.920 4.089 4.016 4.148 . 0 0 "[ . 1 . 2]" 1
505 1 63 ALA MB 1 64 GLY HA2 3.550 . 5.300 4.391 4.215 4.530 . 0 0 "[ . 1 . 2]" 1
506 1 63 ALA MB 1 64 GLY HA3 3.550 . 5.300 4.196 4.071 4.285 . 0 0 "[ . 1 . 2]" 1
507 1 62 GLN HB3 1 63 ALA MB 3.220 . 4.640 4.078 3.799 4.377 . 0 0 "[ . 1 . 2]" 1
508 1 63 ALA MB 1 89 ILE HB 2.710 . 3.620 1.973 1.795 2.145 0.005 2 0 "[ . 1 . 2]" 1
509 1 63 ALA MB 1 89 ILE HG12 3.020 . 4.240 3.921 3.658 4.186 . 0 0 "[ . 1 . 2]" 1
510 1 63 ALA MB 1 89 ILE MG 3.050 . 4.290 3.454 3.212 3.652 . 0 0 "[ . 1 . 2]" 1
511 1 63 ALA MB 1 89 ILE MD 2.630 . 3.460 2.624 2.401 2.827 . 0 0 "[ . 1 . 2]" 1
512 1 8 ASP H 1 56 ALA MB 2.800 . 3.800 2.890 2.012 3.461 . 0 0 "[ . 1 . 2]" 1
513 1 8 ASP HA 1 56 ALA MB 3.710 . 5.620 4.892 4.297 5.291 . 0 0 "[ . 1 . 2]" 1
514 1 7 ALA HA 1 56 ALA MB 3.340 . 4.880 4.090 3.237 4.588 . 0 0 "[ . 1 . 2]" 1
515 1 56 ALA MB 1 58 PRO HD3 3.630 . 5.460 4.639 4.221 5.054 . 0 0 "[ . 1 . 2]" 1
516 1 55 VAL MG1 1 56 ALA MB 2.880 . 3.960 3.883 3.730 3.994 0.034 16 0 "[ . 1 . 2]" 1
517 1 76 GLY HA3 1 78 ALA MB 3.750 . 5.700 4.962 4.529 5.420 . 0 0 "[ . 1 . 2]" 1
518 1 76 GLY HA2 1 78 ALA MB 3.830 . 5.860 5.532 4.879 5.921 0.061 20 0 "[ . 1 . 2]" 1
519 1 77 PRO HD2 1 78 ALA MB 3.280 . 4.760 4.346 4.003 4.727 . 0 0 "[ . 1 . 2]" 1
520 1 77 PRO HB2 1 78 ALA MB 3.260 . 4.730 4.108 3.732 4.614 . 0 0 "[ . 1 . 2]" 1
521 1 77 PRO HG2 1 78 ALA MB 2.790 . 3.780 3.474 3.200 3.755 . 0 0 "[ . 1 . 2]" 1
522 1 37 ILE H 1 38 ALA MB 3.190 . 4.580 4.248 4.188 4.349 . 0 0 "[ . 1 . 2]" 1
523 1 38 ALA MB 1 62 GLN HA 3.270 . 4.740 4.099 3.635 4.688 . 0 0 "[ . 1 . 2]" 1
524 1 35 ALA HA 1 38 ALA MB 2.750 . 3.700 2.541 2.272 2.784 . 0 0 "[ . 1 . 2]" 1
525 1 38 ALA MB 1 61 THR HB 2.760 . 3.720 2.730 1.948 3.429 . 0 0 "[ . 1 . 2]" 1
526 1 36 PRO HD2 1 38 ALA MB 3.840 . 5.880 5.162 4.990 5.258 . 0 0 "[ . 1 . 2]" 1
527 1 37 ILE HA 1 38 ALA MB 4.100 . 6.400 5.037 5.016 5.063 . 0 0 "[ . 1 . 2]" 1
528 1 38 ALA MB 1 39 VAL HB 3.590 . 5.380 4.552 4.401 4.673 . 0 0 "[ . 1 . 2]" 1
529 1 38 ALA MB 1 89 ILE MG 2.590 . 3.380 3.077 2.911 3.317 . 0 0 "[ . 1 . 2]" 1
530 1 35 ALA H 1 35 ALA MB 2.460 . 3.120 2.250 2.213 2.268 . 0 0 "[ . 1 . 2]" 1
531 1 35 ALA MB 1 38 ALA H 3.610 . 5.420 4.643 4.533 4.725 . 0 0 "[ . 1 . 2]" 1
532 1 35 ALA MB 1 37 ILE H 3.430 . 5.060 4.704 4.610 4.871 . 0 0 "[ . 1 . 2]" 1
533 1 35 ALA MB 1 89 ILE HA 3.790 . 5.780 4.902 4.639 5.158 . 0 0 "[ . 1 . 2]" 1
534 1 35 ALA MB 1 36 PRO HD3 2.470 . 3.140 2.412 2.220 2.505 . 0 0 "[ . 1 . 2]" 1
535 1 35 ALA MB 1 36 PRO HD2 2.630 . 3.460 2.675 2.590 2.806 . 0 0 "[ . 1 . 2]" 1
536 1 35 ALA MB 1 36 PRO HB3 3.390 . 4.980 4.722 4.508 4.827 . 0 0 "[ . 1 . 2]" 1
537 1 35 ALA MB 1 89 ILE MG 2.340 . 2.880 2.291 2.126 2.429 . 0 0 "[ . 1 . 2]" 1
538 1 35 ALA MB 1 89 ILE MD 3.020 . 4.240 3.678 3.388 3.977 . 0 0 "[ . 1 . 2]" 1
539 1 5 ILE MD 1 58 PRO HA 3.400 . 5.000 4.681 4.163 5.067 0.067 10 0 "[ . 1 . 2]" 1
540 1 5 ILE HA 1 5 ILE MD 3.050 . 4.290 3.847 3.810 3.898 . 0 0 "[ . 1 . 2]" 1
541 1 5 ILE MD 1 58 PRO HD3 3.210 . 4.620 4.384 3.789 4.692 0.072 2 0 "[ . 1 . 2]" 1
542 1 5 ILE MD 1 58 PRO HD2 3.540 . 5.280 4.573 4.219 4.955 . 0 0 "[ . 1 . 2]" 1
543 1 5 ILE MD 1 65 ARG HD3 3.130 . 4.460 3.554 2.515 4.292 . 0 0 "[ . 1 . 2]" 1
544 1 5 ILE MD 1 58 PRO HG2 2.810 . 3.820 2.900 2.370 3.642 . 0 0 "[ . 1 . 2]" 1
545 1 5 ILE HB 1 5 ILE MD 2.630 . 3.460 2.481 2.456 2.522 . 0 0 "[ . 1 . 2]" 1
546 1 37 ILE MD 1 38 ALA H 3.640 . 5.480 4.966 4.877 5.121 . 0 0 "[ . 1 . 2]" 1
547 1 37 ILE H 1 37 ILE MD 3.130 . 4.460 3.755 3.687 3.827 . 0 0 "[ . 1 . 2]" 1
548 1 33 VAL HA 1 37 ILE MD 3.060 . 4.320 4.231 4.020 4.370 0.050 5 0 "[ . 1 . 2]" 1
549 1 34 PRO HD3 1 37 ILE MD 2.710 . 3.620 3.390 3.226 3.548 . 0 0 "[ . 1 . 2]" 1
550 1 34 PRO HD2 1 37 ILE MD 2.740 . 3.680 2.120 1.885 2.274 . 0 0 "[ . 1 . 2]" 1
551 1 37 ILE HB 1 37 ILE MD 2.560 . 3.320 2.544 2.499 2.575 . 0 0 "[ . 1 . 2]" 1
552 1 38 ALA H 1 89 ILE MD 3.340 . 4.880 4.772 4.611 4.944 0.064 1 0 "[ . 1 . 2]" 1
553 1 62 GLN HA 1 89 ILE MD 2.780 . 3.760 2.180 1.870 2.414 . 0 0 "[ . 1 . 2]" 1
554 1 35 ALA HA 1 89 ILE MD 2.790 . 3.780 3.079 2.782 3.327 . 0 0 "[ . 1 . 2]" 1
555 1 63 ALA HA 1 89 ILE MD 2.860 . 3.920 3.470 3.181 3.855 . 0 0 "[ . 1 . 2]" 1
556 1 62 GLN HG3 1 89 ILE MD 3.280 . 4.760 4.062 3.587 4.438 . 0 0 "[ . 1 . 2]" 1
557 1 62 GLN HB3 1 89 ILE MD 3.130 . 4.460 3.885 3.305 4.281 . 0 0 "[ . 1 . 2]" 1
558 1 89 ILE HB 1 89 ILE MD 2.540 . 3.280 2.527 2.489 2.556 . 0 0 "[ . 1 . 2]" 1
559 1 38 ALA MB 1 89 ILE MD 2.270 . 2.740 2.261 2.103 2.502 . 0 0 "[ . 1 . 2]" 1
560 1 37 ILE MG 1 40 VAL H 4.190 . 6.580 5.185 4.991 5.386 . 0 0 "[ . 1 . 2]" 1
561 1 33 VAL HA 1 37 ILE MG 3.130 . 4.460 4.172 3.955 4.389 . 0 0 "[ . 1 . 2]" 1
562 1 37 ILE MG 1 44 VAL HA 3.410 . 5.020 3.986 3.697 4.338 . 0 0 "[ . 1 . 2]" 1
563 1 37 ILE MG 1 41 GLY HA2 3.120 . 4.440 3.924 3.780 4.203 . 0 0 "[ . 1 . 2]" 1
564 1 34 PRO HD3 1 37 ILE MG 3.170 . 4.540 4.593 4.460 4.668 0.128 4 0 "[ . 1 . 2]" 1
565 1 37 ILE HA 1 37 ILE MG 2.560 . 3.320 2.508 2.459 2.554 . 0 0 "[ . 1 . 2]" 1
566 1 34 PRO HD2 1 37 ILE MG 3.030 . 4.260 3.190 3.078 3.293 . 0 0 "[ . 1 . 2]" 1
567 1 9 TYR HD2 1 53 VAL MG2 2.990 . 4.180 3.389 2.886 3.895 . 0 0 "[ . 1 . 2]" 1
568 1 47 MET HA 1 53 VAL MG2 3.490 . 5.180 4.214 3.904 4.660 . 0 0 "[ . 1 . 2]" 1
569 1 9 TYR HB2 1 53 VAL MG2 3.140 . 4.480 3.035 2.796 3.268 . 0 0 "[ . 1 . 2]" 1
570 1 9 TYR HB3 1 53 VAL MG2 3.200 . 4.600 3.614 3.262 3.929 . 0 0 "[ . 1 . 2]" 1
571 1 53 VAL MG2 1 55 VAL HB 3.420 . 5.040 4.691 4.332 4.981 . 0 0 "[ . 1 . 2]" 1
572 1 53 VAL MG2 1 55 VAL MG2 2.430 . 3.060 2.291 2.048 2.492 . 0 0 "[ . 1 . 2]" 1
573 1 35 ALA H 1 89 ILE MG 2.780 . 3.760 2.966 2.727 3.149 . 0 0 "[ . 1 . 2]" 1
574 1 89 ILE MG 1 90 THR H 2.540 . 3.280 2.729 2.359 2.956 . 0 0 "[ . 1 . 2]" 1
575 1 89 ILE HA 1 89 ILE MG 2.630 . 3.460 2.583 2.534 2.660 . 0 0 "[ . 1 . 2]" 1
576 1 35 ALA HA 1 89 ILE MG 2.510 . 3.220 2.051 1.808 2.247 . 0 0 "[ . 1 . 2]" 1
577 1 63 ALA HA 1 89 ILE MG 3.510 . 5.220 5.028 4.633 5.330 0.110 10 0 "[ . 1 . 2]" 1
578 1 89 ILE HG12 1 89 ILE MG 2.670 . 3.540 2.536 2.499 2.568 . 0 0 "[ . 1 . 2]" 1
579 1 5 ILE MG 1 68 ARG H 3.580 . 5.360 4.929 4.218 5.245 . 0 0 "[ . 1 . 2]" 1
580 1 5 ILE MG 1 67 LEU HA 2.960 . 4.120 3.521 2.999 3.823 . 0 0 "[ . 1 . 2]" 1
581 1 5 ILE HA 1 5 ILE MG 2.740 . 3.680 3.262 3.253 3.275 . 0 0 "[ . 1 . 2]" 1
582 1 5 ILE MG 1 58 PRO HD3 3.090 . 4.380 4.178 3.700 4.468 0.088 4 0 "[ . 1 . 2]" 1
583 1 5 ILE MG 1 58 PRO HD2 3.250 . 4.700 4.208 3.799 4.649 . 0 0 "[ . 1 . 2]" 1
584 1 5 ILE HG13 1 5 ILE MG 2.740 . 3.680 3.255 3.248 3.262 . 0 0 "[ . 1 . 2]" 1
585 1 5 ILE HG12 1 5 ILE MG 2.570 . 3.340 2.473 2.448 2.514 . 0 0 "[ . 1 . 2]" 1
586 1 27 LEU MD2 1 74 PHE HE1 2.900 . 4.000 2.314 1.775 4.017 0.025 14 0 "[ . 1 . 2]" 1
587 1 27 LEU HA 1 27 LEU MD2 2.930 . 4.070 2.032 1.909 2.169 . 0 0 "[ . 1 . 2]" 1
588 1 27 LEU MD2 1 29 ALA MB 3.410 . 5.020 4.773 3.992 5.158 0.138 2 0 "[ . 1 . 2]" 1
589 1 65 ARG H 1 65 ARG HB3 3.170 . 4.540 3.613 3.525 3.665 . 0 0 "[ . 1 . 2]" 1
590 1 61 THR MG 1 65 ARG HB3 3.260 . 4.720 3.314 2.846 3.857 . 0 0 "[ . 1 . 2]" 1
591 1 9 TYR HA 1 9 TYR HD1 3.650 . 5.500 4.462 4.278 4.635 . 0 0 "[ . 1 . 2]" 1
592 1 9 TYR HA 1 9 TYR HD2 3.770 . 5.740 4.092 3.957 4.273 . 0 0 "[ . 1 . 2]" 1
593 1 25 GLN HA 1 74 PHE HB2 3.600 . 5.400 2.034 1.725 2.625 0.075 11 0 "[ . 1 . 2]" 1
594 1 25 GLN HB3 1 74 PHE HB2 3.950 . 6.100 3.514 2.158 4.389 . 0 0 "[ . 1 . 2]" 1
595 1 69 LEU MD1 1 73 GLY HA3 4.020 . 6.240 6.067 5.631 6.301 0.061 12 0 "[ . 1 . 2]" 1
596 1 25 GLN HB3 1 81 GLY HA2 3.610 . 5.420 2.921 2.382 3.910 . 0 0 "[ . 1 . 2]" 1
597 1 25 GLN HB3 1 81 GLY HA3 3.610 . 5.420 2.250 1.831 2.787 . 0 0 "[ . 1 . 2]" 1
598 1 25 GLN HB3 1 74 PHE HB3 3.950 . 6.100 4.079 2.404 4.878 . 0 0 "[ . 1 . 2]" 1
599 1 69 LEU HA 1 70 LYS HA 3.610 . 5.420 4.537 4.449 4.606 . 0 0 "[ . 1 . 2]" 1
600 1 70 LYS HA 1 71 GLY HA3 3.560 . 5.320 4.474 4.378 4.543 . 0 0 "[ . 1 . 2]" 1
601 1 70 LYS HA 1 82 ASP HA 3.390 . 4.980 3.073 2.345 3.929 . 0 0 "[ . 1 . 2]" 1
602 1 80 ARG HB3 1 82 ASP HA 3.970 . 6.140 5.446 4.954 6.048 . 0 0 "[ . 1 . 2]" 1
603 1 82 ASP HA 1 83 LEU HB2 3.520 . 5.240 4.673 4.441 4.844 . 0 0 "[ . 1 . 2]" 1
604 1 69 LEU HB2 1 82 ASP HA 3.710 . 5.620 4.280 3.894 4.681 . 0 0 "[ . 1 . 2]" 1
605 1 69 LEU HB3 1 82 ASP HA 3.710 . 5.620 5.157 4.667 5.515 . 0 0 "[ . 1 . 2]" 1
606 1 69 LEU MD1 1 82 ASP HA 3.910 . 6.020 5.741 5.487 6.010 . 0 0 "[ . 1 . 2]" 1
607 1 49 LEU MD1 1 50 GLU H 3.620 . 5.440 5.089 4.695 5.356 . 0 0 "[ . 1 . 2]" 1
608 1 48 THR HA 1 49 LEU MD1 3.970 . 6.140 5.426 5.175 5.649 . 0 0 "[ . 1 . 2]" 1
609 1 27 LEU HB3 1 49 LEU MD1 3.780 . 5.760 4.951 4.470 5.364 . 0 0 "[ . 1 . 2]" 1
610 1 27 LEU HG 1 49 LEU MD1 3.350 . 4.900 4.135 3.826 4.700 . 0 0 "[ . 1 . 2]" 1
611 1 35 ALA MB 1 39 VAL H 3.710 . 5.620 4.788 4.631 4.901 . 0 0 "[ . 1 . 2]" 1
612 1 88 ARG H 1 88 ARG HG2 3.460 . 5.120 2.860 2.608 3.269 . 0 0 "[ . 1 . 2]" 1
613 1 9 TYR HD1 1 55 VAL MG1 3.560 . 5.320 3.902 3.235 4.445 . 0 0 "[ . 1 . 2]" 1
614 1 43 LYS HA 1 55 VAL MG1 3.850 . 5.900 4.915 4.780 5.133 . 0 0 "[ . 1 . 2]" 1
615 1 35 ALA H 1 38 ALA MB 3.460 . 5.120 4.490 4.275 4.638 . 0 0 "[ . 1 . 2]" 1
616 1 38 ALA MB 1 89 ILE HA 3.460 . 5.120 3.930 3.654 4.243 . 0 0 "[ . 1 . 2]" 1
617 1 38 ALA MB 1 62 GLN HG3 4.080 . 6.360 5.573 4.990 6.231 . 0 0 "[ . 1 . 2]" 1
618 1 36 PRO HD3 1 89 ILE MG 3.820 . 5.840 5.422 5.333 5.573 . 0 0 "[ . 1 . 2]" 1
619 1 10 LYS H 1 54 GLU HA 3.630 . 5.460 4.773 4.441 5.078 . 0 0 "[ . 1 . 2]" 1
620 1 43 LYS HA 1 54 GLU HA 4.290 . 6.780 5.316 4.948 5.661 . 0 0 "[ . 1 . 2]" 1
621 1 45 ARG HG2 1 54 GLU HA 3.500 . 5.200 4.502 3.038 5.298 0.098 12 0 "[ . 1 . 2]" 1
622 1 46 ALA MB 1 54 GLU HA 3.510 . 5.220 4.762 4.199 5.046 . 0 0 "[ . 1 . 2]" 1
623 1 2 ASP HA 1 4 VAL H 3.530 . 5.260 4.166 3.564 4.943 . 0 0 "[ . 1 . 2]" 1
624 1 87 VAL HA 1 88 ARG HA 3.510 . 5.220 4.461 4.440 4.491 . 0 0 "[ . 1 . 2]" 1
625 1 44 VAL H 1 56 ALA MB 3.840 . 5.880 5.464 5.216 5.641 . 0 0 "[ . 1 . 2]" 1
626 1 9 TYR HA 1 56 ALA MB 3.380 . 4.960 3.899 3.593 4.157 . 0 0 "[ . 1 . 2]" 1
627 1 44 VAL H 1 56 ALA HA 3.350 . 4.900 4.258 3.964 4.469 . 0 0 "[ . 1 . 2]" 1
628 1 56 ALA HA 1 57 VAL HA 3.450 . 5.100 4.505 4.469 4.525 . 0 0 "[ . 1 . 2]" 1
629 1 9 TYR HB2 1 53 VAL HB 3.580 . 5.360 2.855 2.381 3.421 . 0 0 "[ . 1 . 2]" 1
630 1 32 ASP HB3 1 33 VAL HA 4.020 . 6.240 4.765 4.375 4.990 . 0 0 "[ . 1 . 2]" 1
631 1 69 LEU MD1 1 70 LYS H 4.630 . 7.460 5.661 5.577 5.745 . 0 0 "[ . 1 . 2]" 1
632 1 55 VAL HA 1 69 LEU MD1 3.630 . 5.460 4.571 4.298 4.850 . 0 0 "[ . 1 . 2]" 1
633 1 5 ILE HA 1 6 ASP HA 3.480 . 5.160 4.316 4.262 4.385 . 0 0 "[ . 1 . 2]" 1
634 1 40 VAL H 1 59 PRO HA 3.770 . 5.740 4.872 4.523 5.302 . 0 0 "[ . 1 . 2]" 1
635 1 39 VAL MG1 1 59 PRO HA 4.420 . 7.040 5.379 5.079 5.653 . 0 0 "[ . 1 . 2]" 1
636 1 39 VAL MG2 1 59 PRO HA 4.420 . 7.040 6.234 5.849 6.621 . 0 0 "[ . 1 . 2]" 1
637 1 43 LYS HD3 1 56 ALA H 3.750 . 5.700 4.984 4.173 5.735 0.035 10 0 "[ . 1 . 2]" 1
638 1 43 LYS HA 1 43 LYS HD3 3.420 . 5.040 4.714 4.312 4.861 . 0 0 "[ . 1 . 2]" 1
639 1 43 LYS HD3 1 56 ALA HA 3.530 . 5.260 4.383 3.860 5.071 . 0 0 "[ . 1 . 2]" 1
640 1 36 PRO HD2 1 89 ILE MD 4.210 . 6.620 6.481 6.217 6.736 0.116 9 0 "[ . 1 . 2]" 1
641 1 77 PRO HB3 1 78 ALA H 3.380 . 4.950 4.188 3.946 4.445 . 0 0 "[ . 1 . 2]" 1
642 1 76 GLY HA2 1 77 PRO HB3 3.630 . 5.460 5.020 4.849 5.153 . 0 0 "[ . 1 . 2]" 1
643 1 32 ASP HB2 1 34 PRO HD3 3.860 . 5.920 4.831 4.386 5.280 . 0 0 "[ . 1 . 2]" 1
644 1 36 PRO HD2 1 90 THR H 3.780 . 5.760 5.801 5.554 5.919 0.159 11 0 "[ . 1 . 2]" 1
645 1 47 MET ME 1 53 VAL MG2 3.600 . 5.400 4.816 4.246 5.255 . 0 0 "[ . 1 . 2]" 1
646 1 27 LEU HB2 1 73 GLY HA2 3.370 . 4.940 4.147 3.297 4.989 0.049 11 0 "[ . 1 . 2]" 1
647 1 77 PRO HA 1 78 ALA HA 3.650 . 5.500 4.731 4.624 4.799 . 0 0 "[ . 1 . 2]" 1
648 1 76 GLY HA2 1 77 PRO HA 3.440 . 5.080 4.509 4.408 4.610 . 0 0 "[ . 1 . 2]" 1
649 1 77 PRO HA 1 78 ALA MB 3.720 . 5.640 5.035 4.867 5.099 . 0 0 "[ . 1 . 2]" 1
650 1 25 GLN HB2 1 26 ASP H 3.570 . 5.340 2.960 2.340 3.929 . 0 0 "[ . 1 . 2]" 1
651 1 25 GLN HB2 1 81 GLY HA2 3.610 . 5.420 3.754 2.976 4.435 . 0 0 "[ . 1 . 2]" 1
652 1 25 GLN HB2 1 81 GLY HA3 3.610 . 5.420 3.350 2.279 4.025 . 0 0 "[ . 1 . 2]" 1
653 1 25 GLN HB2 1 74 PHE HB2 3.950 . 6.100 4.558 3.712 5.183 . 0 0 "[ . 1 . 2]" 1
654 1 25 GLN HB2 1 74 PHE HB3 3.950 . 6.100 5.266 4.121 5.950 . 0 0 "[ . 1 . 2]" 1
655 1 27 LEU MD1 1 74 PHE H 3.480 . 5.160 4.209 3.588 5.022 . 0 0 "[ . 1 . 2]" 1
656 1 27 LEU MD1 1 48 THR HB 3.410 . 5.020 3.062 2.703 3.387 . 0 0 "[ . 1 . 2]" 1
657 1 27 LEU MD1 1 73 GLY HA3 3.500 . 5.200 4.327 3.474 4.899 . 0 0 "[ . 1 . 2]" 1
658 1 30 THR HB 1 86 GLU HB2 3.700 . 5.600 4.315 3.744 5.115 . 0 0 "[ . 1 . 2]" 1
659 1 30 THR HB 1 88 ARG HG3 3.540 . 5.280 3.254 1.970 4.888 . 0 0 "[ . 1 . 2]" 1
660 1 31 LEU MD1 1 46 ALA HA 3.360 . 4.920 3.047 2.672 3.495 . 0 0 "[ . 1 . 2]" 1
661 1 31 LEU MD2 1 46 ALA HA 4.090 . 6.380 5.548 5.005 6.113 . 0 0 "[ . 1 . 2]" 1
662 1 77 PRO HD3 1 78 ALA MB 3.830 . 5.860 5.510 5.298 5.711 . 0 0 "[ . 1 . 2]" 1
663 1 35 ALA MB 1 36 PRO HB2 3.900 . 6.000 5.455 5.362 5.509 . 0 0 "[ . 1 . 2]" 1
664 1 75 PRO HB3 1 80 ARG HG2 3.450 . 5.100 4.178 2.967 5.311 0.211 4 0 "[ . 1 . 2]" 1
665 1 51 GLY H 1 52 PRO HD3 3.710 . 5.620 5.036 4.663 5.209 . 0 0 "[ . 1 . 2]" 1
666 1 63 ALA HA 1 65 ARG H 3.380 . 4.960 3.323 2.995 3.545 . 0 0 "[ . 1 . 2]" 1
667 1 63 ALA HA 1 89 ILE HB 3.340 . 4.880 3.819 3.231 4.260 . 0 0 "[ . 1 . 2]" 1
668 1 61 THR HA 1 62 GLN HB2 3.620 . 5.440 4.660 4.470 4.940 . 0 0 "[ . 1 . 2]" 1
669 1 39 VAL HA 1 40 VAL HA 3.510 . 5.220 4.730 4.675 4.768 . 0 0 "[ . 1 . 2]" 1
670 1 40 VAL HA 1 59 PRO HB2 3.840 . 5.880 5.256 4.069 5.931 0.051 14 0 "[ . 1 . 2]" 1
671 1 25 GLN HA 1 74 PHE HB3 3.600 . 5.400 2.712 1.847 3.377 . 0 0 "[ . 1 . 2]" 1
672 1 4 VAL H 1 4 VAL MG1 2.550 . 3.300 2.485 2.189 2.828 . 0 0 "[ . 1 . 2]" 1
673 1 4 VAL H 1 4 VAL MG2 2.760 . 3.720 2.112 1.833 2.223 . 0 0 "[ . 1 . 2]" 1
674 1 3 ASP HB2 1 4 VAL H 2.960 . 4.120 3.702 3.480 3.862 . 0 0 "[ . 1 . 2]" 1
675 1 3 ASP HB3 1 4 VAL H 2.810 . 3.820 2.270 1.944 2.597 . 0 0 "[ . 1 . 2]" 1
676 1 4 VAL H 1 5 ILE H 3.420 . 5.040 4.571 4.487 4.637 . 0 0 "[ . 1 . 2]" 1
677 1 3 ASP H 1 4 VAL H 2.730 . 3.660 2.739 2.384 3.057 . 0 0 "[ . 1 . 2]" 1
678 1 26 ASP H 1 27 LEU H 3.500 . 5.200 4.523 4.393 4.598 . 0 0 "[ . 1 . 2]" 1
679 1 54 GLU H 1 55 VAL H 3.290 . 4.780 4.303 4.219 4.423 . 0 0 "[ . 1 . 2]" 1
680 1 46 ALA H 1 55 VAL H 3.190 . 4.580 3.771 3.506 4.234 . 0 0 "[ . 1 . 2]" 1
681 1 55 VAL H 1 56 ALA H 3.540 . 5.280 4.384 4.283 4.529 . 0 0 "[ . 1 . 2]" 1
682 1 44 VAL HA 1 55 VAL H 3.660 . 5.520 4.813 4.640 4.974 . 0 0 "[ . 1 . 2]" 1
683 1 45 ARG HA 1 55 VAL H 3.040 . 4.280 3.547 3.191 3.875 . 0 0 "[ . 1 . 2]" 1
684 1 54 GLU HA 1 55 VAL H 2.710 . 3.620 2.166 2.092 2.234 . 0 0 "[ . 1 . 2]" 1
685 1 43 LYS HA 1 55 VAL H 3.600 . 5.400 4.389 4.140 4.655 . 0 0 "[ . 1 . 2]" 1
686 1 53 VAL MG2 1 55 VAL H 3.220 . 4.640 3.957 3.482 4.262 . 0 0 "[ . 1 . 2]" 1
687 1 44 VAL MG2 1 55 VAL H 3.020 . 4.240 3.338 2.987 3.659 . 0 0 "[ . 1 . 2]" 1
688 1 55 VAL H 1 55 VAL MG2 2.580 . 3.360 2.318 2.184 2.407 . 0 0 "[ . 1 . 2]" 1
689 1 46 ALA MB 1 55 VAL H 3.130 . 4.460 4.040 3.670 4.351 . 0 0 "[ . 1 . 2]" 1
690 1 43 LYS HB3 1 55 VAL H 3.750 . 5.700 3.953 3.619 4.298 . 0 0 "[ . 1 . 2]" 1
691 1 55 VAL H 1 55 VAL HB 2.620 . 3.440 2.568 2.525 2.615 . 0 0 "[ . 1 . 2]" 1
692 1 12 ALA H 1 54 GLU H 3.080 . 4.360 3.217 2.849 3.576 . 0 0 "[ . 1 . 2]" 1
693 1 12 ALA H 1 53 VAL HA 2.730 . 3.660 1.835 1.662 2.105 0.138 15 0 "[ . 1 . 2]" 1
694 1 11 PRO HA 1 12 ALA H 2.520 . 3.240 2.194 2.131 2.282 . 0 0 "[ . 1 . 2]" 1
695 1 11 PRO HB2 1 12 ALA H 3.410 . 5.020 3.981 3.335 4.228 . 0 0 "[ . 1 . 2]" 1
696 1 12 ALA H 1 53 VAL HB 2.950 . 4.100 3.857 3.491 4.142 0.042 10 0 "[ . 1 . 2]" 1
697 1 11 PRO HB3 1 12 ALA H 3.410 . 5.020 4.173 3.621 4.483 . 0 0 "[ . 1 . 2]" 1
698 1 12 ALA H 1 12 ALA MB 2.560 . 3.320 2.277 2.232 2.350 . 0 0 "[ . 1 . 2]" 1
699 1 12 ALA H 1 53 VAL MG1 2.740 . 3.680 2.926 2.538 3.177 . 0 0 "[ . 1 . 2]" 1
700 1 12 ALA H 1 53 VAL MG2 3.460 . 5.120 4.682 4.524 4.897 . 0 0 "[ . 1 . 2]" 1
701 1 31 LEU H 1 88 ARG H 3.240 . 4.680 3.418 3.024 3.869 . 0 0 "[ . 1 . 2]" 1
702 1 88 ARG H 1 89 ILE H 3.310 . 4.820 4.157 4.076 4.245 . 0 0 "[ . 1 . 2]" 1
703 1 32 ASP HA 1 88 ARG H 3.340 . 4.880 3.705 3.089 4.031 . 0 0 "[ . 1 . 2]" 1
704 1 87 VAL HA 1 88 ARG H 2.580 . 3.360 2.124 2.076 2.147 . 0 0 "[ . 1 . 2]" 1
705 1 88 ARG H 1 88 ARG HB2 2.820 . 3.850 2.575 2.409 2.716 . 0 0 "[ . 1 . 2]" 1
706 1 88 ARG H 1 88 ARG HB3 3.020 . 4.240 3.720 3.629 3.824 . 0 0 "[ . 1 . 2]" 1
707 1 88 ARG H 1 88 ARG HG3 3.280 . 4.760 4.136 3.922 4.479 . 0 0 "[ . 1 . 2]" 1
708 1 30 THR MG 1 88 ARG H 3.380 . 4.960 4.594 3.713 5.043 0.083 3 0 "[ . 1 . 2]" 1
709 1 87 VAL MG2 1 88 ARG H 3.250 . 4.700 4.146 4.039 4.258 . 0 0 "[ . 1 . 2]" 1
710 1 87 VAL MG1 1 88 ARG H 3.250 . 4.700 3.093 2.802 3.318 . 0 0 "[ . 1 . 2]" 1
711 1 29 ALA H 1 84 TYR H 3.390 . 4.980 4.238 4.046 4.432 . 0 0 "[ . 1 . 2]" 1
712 1 29 ALA H 1 86 GLU H 3.310 . 4.820 4.114 3.709 4.404 . 0 0 "[ . 1 . 2]" 1
713 1 28 TYR HD2 1 29 ALA H 3.400 . 5.000 4.405 4.095 4.726 . 0 0 "[ . 1 . 2]" 1
714 1 28 TYR HA 1 29 ALA H 2.750 . 3.700 2.164 2.121 2.244 . 0 0 "[ . 1 . 2]" 1
715 1 29 ALA H 1 29 ALA MB 2.840 . 3.880 2.753 2.658 2.837 . 0 0 "[ . 1 . 2]" 1
716 1 29 ALA H 1 83 LEU MD1 2.980 . 4.160 3.690 3.131 4.237 0.077 18 0 "[ . 1 . 2]" 1
717 1 27 LEU H 1 82 ASP H 3.390 . 4.980 4.027 3.646 4.443 . 0 0 "[ . 1 . 2]" 1
718 1 81 GLY H 1 82 ASP H 3.470 . 5.140 4.372 4.257 4.513 . 0 0 "[ . 1 . 2]" 1
719 1 72 LYS H 1 82 ASP H 3.730 . 5.660 5.029 4.756 5.470 . 0 0 "[ . 1 . 2]" 1
720 1 26 ASP HA 1 82 ASP H 2.970 . 4.140 2.363 1.972 2.830 . 0 0 "[ . 1 . 2]" 1
721 1 81 GLY HA2 1 82 ASP H 2.840 . 3.880 2.832 2.662 2.937 . 0 0 "[ . 1 . 2]" 1
722 1 81 GLY HA3 1 82 ASP H 2.840 . 3.880 2.374 2.288 2.502 . 0 0 "[ . 1 . 2]" 1
723 1 73 GLY HA3 1 82 ASP H 3.380 . 4.960 3.359 3.078 3.738 . 0 0 "[ . 1 . 2]" 1
724 1 25 GLN HB2 1 82 ASP H 3.510 . 5.220 4.488 4.115 4.939 . 0 0 "[ . 1 . 2]" 1
725 1 82 ASP H 1 82 ASP HB3 3.080 . 4.360 3.406 2.642 3.818 . 0 0 "[ . 1 . 2]" 1
726 1 82 ASP H 1 82 ASP HB2 3.080 . 4.360 3.142 2.538 3.903 . 0 0 "[ . 1 . 2]" 1
727 1 28 TYR H 1 28 TYR HD1 3.060 . 4.320 3.082 2.658 3.480 . 0 0 "[ . 1 . 2]" 1
728 1 27 LEU HA 1 28 TYR H 2.820 . 3.850 2.246 2.148 2.344 . 0 0 "[ . 1 . 2]" 1
729 1 27 LEU HB2 1 28 TYR H 3.150 . 4.500 4.076 3.815 4.332 . 0 0 "[ . 1 . 2]" 1
730 1 27 LEU MD1 1 28 TYR H 3.310 . 4.820 4.791 4.527 5.038 0.218 15 0 "[ . 1 . 2]" 1
731 1 43 LYS H 1 44 VAL H 3.290 . 4.780 4.409 4.277 4.617 . 0 0 "[ . 1 . 2]" 1
732 1 12 ALA H 1 13 ASP H 3.200 . 4.600 2.954 2.191 4.264 . 0 0 "[ . 1 . 2]" 1
733 1 12 ALA HA 1 13 ASP H 2.630 . 3.460 3.111 2.148 3.524 0.064 13 0 "[ . 1 . 2]" 1
734 1 42 GLY HA3 1 43 LYS H 2.560 . 3.320 2.279 2.159 2.592 . 0 0 "[ . 1 . 2]" 1
735 1 42 GLY HA2 1 43 LYS H 2.790 . 3.780 3.003 2.568 3.223 . 0 0 "[ . 1 . 2]" 1
736 1 43 LYS H 1 43 LYS HB2 2.600 . 3.400 2.632 2.323 2.766 . 0 0 "[ . 1 . 2]" 1
737 1 43 LYS H 1 43 LYS HB3 2.980 . 4.160 3.765 3.586 3.839 . 0 0 "[ . 1 . 2]" 1
738 1 12 ALA MB 1 13 ASP H 2.960 . 4.120 3.038 2.368 3.754 . 0 0 "[ . 1 . 2]" 1
739 1 37 ILE MD 1 43 LYS H 3.250 . 4.700 3.939 3.491 4.637 . 0 0 "[ . 1 . 2]" 1
740 1 37 ILE MG 1 43 LYS H 2.980 . 4.160 3.006 2.660 3.750 . 0 0 "[ . 1 . 2]" 1
741 1 46 ALA H 1 47 MET H 3.420 . 5.040 4.482 4.281 4.554 . 0 0 "[ . 1 . 2]" 1
742 1 2 ASP H 1 3 ASP H 2.900 . 4.000 3.582 2.148 4.246 0.246 10 0 "[ . 1 . 2]" 1
743 1 47 MET H 1 52 PRO HA 3.680 . 5.560 5.145 4.899 5.397 . 0 0 "[ . 1 . 2]" 1
744 1 3 ASP H 1 3 ASP HB2 2.800 . 3.800 2.662 2.471 3.416 . 0 0 "[ . 1 . 2]" 1
745 1 3 ASP H 1 3 ASP HB3 2.590 . 3.380 2.499 2.348 3.005 . 0 0 "[ . 1 . 2]" 1
746 1 47 MET H 1 47 MET HG3 3.650 . 5.500 4.052 3.575 4.559 . 0 0 "[ . 1 . 2]" 1
747 1 47 MET H 1 47 MET HB2 2.920 . 4.040 2.585 2.429 2.882 . 0 0 "[ . 1 . 2]" 1
748 1 46 ALA MB 1 47 MET H 2.570 . 3.340 2.751 2.382 3.253 . 0 0 "[ . 1 . 2]" 1
749 1 31 LEU MD1 1 47 MET H 3.570 . 5.340 4.450 4.116 4.854 . 0 0 "[ . 1 . 2]" 1
750 1 47 MET H 1 48 THR MG 3.300 . 4.800 4.339 4.060 4.614 . 0 0 "[ . 1 . 2]" 1
751 1 47 MET H 1 85 LEU MD2 3.410 . 5.020 4.711 4.160 5.073 0.053 4 0 "[ . 1 . 2]" 1
752 1 47 MET H 1 53 VAL MG2 3.340 . 4.880 4.567 4.302 4.882 0.002 11 0 "[ . 1 . 2]" 1
753 1 1 MET HA 1 2 ASP H 2.680 . 3.560 2.515 2.156 3.548 . 0 0 "[ . 1 . 2]" 1
754 1 62 GLN H 1 63 ALA H 3.530 . 5.260 4.556 4.439 4.613 . 0 0 "[ . 1 . 2]" 1
755 1 62 GLN HA 1 63 ALA H 2.460 . 3.120 2.325 2.243 2.403 . 0 0 "[ . 1 . 2]" 1
756 1 62 GLN HB3 1 63 ALA H 2.670 . 3.540 2.574 2.267 2.936 . 0 0 "[ . 1 . 2]" 1
757 1 62 GLN HB2 1 63 ALA H 3.110 . 4.420 3.701 3.384 3.955 . 0 0 "[ . 1 . 2]" 1
758 1 63 ALA H 1 89 ILE HB 3.280 . 4.760 3.873 3.586 4.170 . 0 0 "[ . 1 . 2]" 1
759 1 63 ALA H 1 63 ALA MB 2.360 . 2.920 2.246 2.195 2.267 . 0 0 "[ . 1 . 2]" 1
760 1 63 ALA H 1 89 ILE HG12 3.470 . 5.140 4.631 4.282 4.979 . 0 0 "[ . 1 . 2]" 1
761 1 63 ALA H 1 89 ILE MG 3.400 . 5.000 4.505 4.225 4.734 . 0 0 "[ . 1 . 2]" 1
762 1 63 ALA H 1 89 ILE MD 2.760 . 3.720 2.229 2.046 2.429 . 0 0 "[ . 1 . 2]" 1
763 1 79 GLY H 1 80 ARG H 3.290 . 4.780 4.011 3.518 4.370 . 0 0 "[ . 1 . 2]" 1
764 1 79 GLY HA2 1 80 ARG H 2.620 . 3.440 2.285 2.143 2.953 . 0 0 "[ . 1 . 2]" 1
765 1 79 GLY HA3 1 80 ARG H 2.620 . 3.440 3.042 2.331 3.416 . 0 0 "[ . 1 . 2]" 1
766 1 60 ARG HB3 1 61 THR H 3.410 . 5.020 4.362 4.112 4.531 . 0 0 "[ . 1 . 2]" 1
767 1 80 ARG H 1 80 ARG HG3 3.000 . 4.200 3.329 2.985 4.299 0.099 11 0 "[ . 1 . 2]" 1
768 1 80 ARG H 1 80 ARG HB2 2.630 . 3.460 2.290 2.181 2.612 . 0 0 "[ . 1 . 2]" 1
769 1 38 ALA MB 1 61 THR H 2.920 . 4.040 3.401 3.013 3.749 . 0 0 "[ . 1 . 2]" 1
770 1 60 ARG H 1 61 THR H 2.740 . 3.680 2.799 2.513 3.119 . 0 0 "[ . 1 . 2]" 1
771 1 61 THR H 1 62 GLN H 3.510 . 5.220 4.394 4.123 4.610 . 0 0 "[ . 1 . 2]" 1
772 1 61 THR H 1 61 THR HB 2.420 . 3.040 2.454 2.309 2.687 . 0 0 "[ . 1 . 2]" 1
773 1 60 ARG HB2 1 61 THR H 3.410 . 5.020 4.365 4.092 4.532 . 0 0 "[ . 1 . 2]" 1
774 1 61 THR H 1 61 THR MG 3.020 . 4.240 3.792 3.733 3.905 . 0 0 "[ . 1 . 2]" 1
775 1 76 GLY HA3 1 78 ALA H 3.120 . 4.440 3.938 3.471 4.360 . 0 0 "[ . 1 . 2]" 1
776 1 77 PRO HD3 1 78 ALA H 3.190 . 4.580 4.050 3.893 4.223 . 0 0 "[ . 1 . 2]" 1
777 1 77 PRO HG2 1 78 ALA H 2.780 . 3.760 2.482 2.156 3.031 . 0 0 "[ . 1 . 2]" 1
778 1 78 ALA H 1 78 ALA MB 2.540 . 3.280 2.328 2.279 2.492 . 0 0 "[ . 1 . 2]" 1
779 1 73 GLY H 1 74 PHE H 3.130 . 4.460 3.758 3.259 4.238 . 0 0 "[ . 1 . 2]" 1
780 1 74 PHE H 1 74 PHE HD1 3.050 . 4.290 3.108 2.431 3.810 . 0 0 "[ . 1 . 2]" 1
781 1 73 GLY HA3 1 74 PHE H 2.730 . 3.660 2.193 2.142 2.260 . 0 0 "[ . 1 . 2]" 1
782 1 25 GLN H 1 26 ASP H 2.780 . 3.760 2.350 1.780 2.731 0.020 4 0 "[ . 1 . 2]" 1
783 1 24 SER HA 1 26 ASP H 3.050 . 4.290 3.524 2.928 4.332 0.042 18 0 "[ . 1 . 2]" 1
784 1 25 GLN HB3 1 26 ASP H 3.570 . 5.340 3.868 3.420 4.432 . 0 0 "[ . 1 . 2]" 1
785 1 61 THR HA 1 62 GLN H 2.460 . 3.120 2.165 2.119 2.223 . 0 0 "[ . 1 . 2]" 1
786 1 62 GLN H 1 65 ARG HD2 3.130 . 4.460 2.494 1.948 3.867 . 0 0 "[ . 1 . 2]" 1
787 1 62 GLN H 1 65 ARG HD3 3.630 . 5.460 3.933 3.557 4.769 . 0 0 "[ . 1 . 2]" 1
788 1 62 GLN H 1 62 GLN HG3 2.920 . 4.040 3.532 3.177 3.928 . 0 0 "[ . 1 . 2]" 1
789 1 62 GLN H 1 62 GLN HB3 3.100 . 4.400 3.700 3.650 3.776 . 0 0 "[ . 1 . 2]" 1
790 1 62 GLN H 1 65 ARG HB2 3.290 . 4.780 4.008 3.316 4.709 . 0 0 "[ . 1 . 2]" 1
791 1 62 GLN H 1 62 GLN HB2 2.730 . 3.660 2.570 2.464 2.734 . 0 0 "[ . 1 . 2]" 1
792 1 61 THR MG 1 62 GLN H 2.690 . 3.580 2.905 2.396 3.443 . 0 0 "[ . 1 . 2]" 1
793 1 33 VAL H 1 90 THR H 3.250 . 4.700 3.805 3.212 4.190 . 0 0 "[ . 1 . 2]" 1
794 1 89 ILE HA 1 90 THR H 2.490 . 3.180 2.143 2.077 2.230 . 0 0 "[ . 1 . 2]" 1
795 1 34 PRO HA 1 90 THR H 3.050 . 4.300 2.911 2.751 3.079 . 0 0 "[ . 1 . 2]" 1
796 1 35 ALA HA 1 90 THR H 3.420 . 5.040 4.490 4.041 4.726 . 0 0 "[ . 1 . 2]" 1
797 1 89 ILE HB 1 90 THR H 3.350 . 4.900 4.271 4.043 4.389 . 0 0 "[ . 1 . 2]" 1
798 1 35 ALA MB 1 90 THR H 3.390 . 4.980 4.303 3.822 4.508 . 0 0 "[ . 1 . 2]" 1
799 1 89 ILE HG12 1 90 THR H 3.270 . 4.740 4.198 4.004 4.409 . 0 0 "[ . 1 . 2]" 1
800 1 88 ARG HA 1 89 ILE H 2.510 . 3.220 2.193 2.128 2.251 . 0 0 "[ . 1 . 2]" 1
801 1 63 ALA HA 1 89 ILE H 3.370 . 4.940 2.934 2.545 3.241 . 0 0 "[ . 1 . 2]" 1
802 1 89 ILE H 1 89 ILE HB 2.530 . 3.260 2.431 2.360 2.473 . 0 0 "[ . 1 . 2]" 1
803 1 63 ALA MB 1 89 ILE H 2.580 . 3.360 2.324 1.876 2.720 . 0 0 "[ . 1 . 2]" 1
804 1 89 ILE H 1 89 ILE HG12 2.770 . 3.740 3.676 3.582 3.767 0.027 7 0 "[ . 1 . 2]" 1
805 1 89 ILE H 1 89 ILE MG 3.000 . 4.200 3.796 3.757 3.831 . 0 0 "[ . 1 . 2]" 1
806 1 89 ILE H 1 89 ILE MD 3.220 . 4.640 3.915 3.829 4.018 . 0 0 "[ . 1 . 2]" 1
807 1 32 ASP H 1 33 VAL H 3.340 . 4.880 4.265 4.144 4.530 . 0 0 "[ . 1 . 2]" 1
808 1 31 LEU HA 1 32 ASP H 2.650 . 3.500 2.176 2.126 2.207 . 0 0 "[ . 1 . 2]" 1
809 1 32 ASP H 1 32 ASP HB2 2.650 . 3.500 2.468 2.309 2.538 . 0 0 "[ . 1 . 2]" 1
810 1 32 ASP H 1 32 ASP HB3 2.950 . 4.100 3.639 3.578 3.683 . 0 0 "[ . 1 . 2]" 1
811 1 32 ASP H 1 88 ARG HB2 3.990 . 6.180 4.800 4.376 5.138 . 0 0 "[ . 1 . 2]" 1
812 1 31 LEU HB3 1 32 ASP H 3.330 . 4.860 4.349 4.268 4.412 . 0 0 "[ . 1 . 2]" 1
813 1 31 LEU HB2 1 32 ASP H 3.380 . 4.960 4.437 4.373 4.518 . 0 0 "[ . 1 . 2]" 1
814 1 31 LEU MD1 1 32 ASP H 2.580 . 3.360 2.729 2.491 3.008 . 0 0 "[ . 1 . 2]" 1
815 1 31 LEU MD2 1 32 ASP H 3.690 . 5.580 4.867 4.694 4.998 . 0 0 "[ . 1 . 2]" 1
816 1 9 TYR HA 1 56 ALA H 3.050 . 4.300 2.750 2.385 3.237 . 0 0 "[ . 1 . 2]" 1
817 1 55 VAL HA 1 56 ALA H 2.530 . 3.260 2.157 2.118 2.216 . 0 0 "[ . 1 . 2]" 1
818 1 8 ASP HB3 1 56 ALA H 3.520 . 5.240 4.700 4.324 5.181 . 0 0 "[ . 1 . 2]" 1
819 1 9 TYR HB3 1 56 ALA H 3.080 . 4.360 4.013 3.352 4.431 0.071 11 0 "[ . 1 . 2]" 1
820 1 55 VAL HB 1 56 ALA H 3.070 . 4.340 4.272 4.037 4.357 0.017 2 0 "[ . 1 . 2]" 1
821 1 56 ALA H 1 56 ALA MB 2.410 . 3.020 2.229 2.191 2.259 . 0 0 "[ . 1 . 2]" 1
822 1 44 VAL MG2 1 56 ALA H 3.740 . 5.680 5.448 5.093 5.766 0.086 3 0 "[ . 1 . 2]" 1
823 1 55 VAL MG1 1 56 ALA H 2.520 . 3.240 2.953 2.591 3.121 . 0 0 "[ . 1 . 2]" 1
824 1 7 ALA H 1 8 ASP H 3.400 . 5.000 4.368 4.216 4.561 . 0 0 "[ . 1 . 2]" 1
825 1 6 ASP HA 1 7 ALA H 2.590 . 3.380 2.163 2.099 2.239 . 0 0 "[ . 1 . 2]" 1
826 1 7 ALA H 1 8 ASP HB2 3.770 . 5.740 4.935 4.444 5.724 . 0 0 "[ . 1 . 2]" 1
827 1 7 ALA H 1 7 ALA MB 2.550 . 3.300 2.662 2.349 2.838 . 0 0 "[ . 1 . 2]" 1
828 1 5 ILE MG 1 7 ALA H 3.550 . 5.300 5.053 3.812 5.426 0.126 12 0 "[ . 1 . 2]" 1
829 1 7 ALA H 1 67 LEU MD2 3.260 . 4.720 4.276 3.844 4.731 0.011 15 0 "[ . 1 . 2]" 1
830 1 5 ILE HA 1 6 ASP H 2.490 . 3.180 2.253 2.198 2.308 . 0 0 "[ . 1 . 2]" 1
831 1 5 ILE HB 1 6 ASP H 3.180 . 4.560 4.035 3.955 4.139 . 0 0 "[ . 1 . 2]" 1
832 1 5 ILE HG13 1 6 ASP H 3.110 . 4.420 2.632 2.402 2.864 . 0 0 "[ . 1 . 2]" 1
833 1 5 ILE HG12 1 6 ASP H 3.090 . 4.380 2.549 2.231 2.727 . 0 0 "[ . 1 . 2]" 1
834 1 5 ILE MG 1 6 ASP H 2.810 . 3.820 3.816 3.645 3.895 0.075 10 0 "[ . 1 . 2]" 1
835 1 87 VAL H 1 88 ARG H 3.520 . 5.240 4.369 4.255 4.533 . 0 0 "[ . 1 . 2]" 1
836 1 86 GLU H 1 87 VAL H 3.400 . 5.000 4.368 4.161 4.487 . 0 0 "[ . 1 . 2]" 1
837 1 65 ARG H 1 87 VAL H 3.620 . 5.440 4.437 4.251 4.653 . 0 0 "[ . 1 . 2]" 1
838 1 86 GLU HA 1 87 VAL H 2.860 . 3.920 2.162 2.115 2.214 . 0 0 "[ . 1 . 2]" 1
839 1 67 LEU HG 1 87 VAL H 3.370 . 4.940 3.932 3.529 4.309 . 0 0 "[ . 1 . 2]" 1
840 1 35 ALA H 1 90 THR H 2.870 . 3.940 3.518 3.251 3.637 . 0 0 "[ . 1 . 2]" 1
841 1 35 ALA H 1 89 ILE HA 3.730 . 5.660 4.766 4.613 5.002 . 0 0 "[ . 1 . 2]" 1
842 1 34 PRO HA 1 35 ALA H 2.680 . 3.560 2.204 2.171 2.233 . 0 0 "[ . 1 . 2]" 1
843 1 35 ALA H 1 90 THR HA 3.750 . 5.700 5.049 4.286 5.279 . 0 0 "[ . 1 . 2]" 1
844 1 35 ALA H 1 36 PRO HD3 2.900 . 4.000 3.685 3.514 3.773 . 0 0 "[ . 1 . 2]" 1
845 1 35 ALA H 1 36 PRO HD2 2.980 . 4.160 2.414 2.312 2.499 . 0 0 "[ . 1 . 2]" 1
846 1 34 PRO HB2 1 35 ALA H 3.040 . 4.280 3.799 3.679 3.880 . 0 0 "[ . 1 . 2]" 1
847 1 34 PRO HB3 1 35 ALA H 3.040 . 4.280 3.353 3.233 3.425 . 0 0 "[ . 1 . 2]" 1
848 1 35 ALA H 1 89 ILE MD 3.780 . 5.760 5.177 4.831 5.497 . 0 0 "[ . 1 . 2]" 1
849 1 30 THR HA 1 31 LEU H 2.700 . 3.600 2.253 2.170 2.323 . 0 0 "[ . 1 . 2]" 1
850 1 31 LEU H 1 87 VAL HA 3.250 . 4.700 3.569 3.122 4.008 . 0 0 "[ . 1 . 2]" 1
851 1 30 THR HB 1 31 LEU H 2.880 . 3.960 3.240 2.679 4.009 0.049 7 0 "[ . 1 . 2]" 1
852 1 31 LEU H 1 86 GLU HB2 3.140 . 4.480 3.791 3.323 4.059 . 0 0 "[ . 1 . 2]" 1
853 1 31 LEU H 1 31 LEU HB3 2.970 . 4.140 2.579 2.484 2.656 . 0 0 "[ . 1 . 2]" 1
854 1 31 LEU H 1 31 LEU HB2 2.950 . 4.100 2.937 2.868 3.065 . 0 0 "[ . 1 . 2]" 1
855 1 31 LEU H 1 85 LEU MD1 3.670 . 5.540 4.999 4.627 5.370 . 0 0 "[ . 1 . 2]" 1
856 1 70 LYS H 1 71 GLY H 3.450 . 5.100 4.563 4.435 4.629 . 0 0 "[ . 1 . 2]" 1
857 1 69 LEU HA 1 70 LYS H 2.750 . 3.700 2.262 2.152 2.404 . 0 0 "[ . 1 . 2]" 1
858 1 70 LYS H 1 70 LYS HB2 2.540 . 3.280 2.472 2.363 2.596 . 0 0 "[ . 1 . 2]" 1
859 1 70 LYS H 1 70 LYS HG2 2.940 . 4.080 3.458 3.248 3.713 . 0 0 "[ . 1 . 2]" 1
860 1 70 LYS H 1 70 LYS HG3 2.930 . 4.070 2.442 2.196 2.774 . 0 0 "[ . 1 . 2]" 1
861 1 69 LEU MD2 1 70 LYS H 3.330 . 4.860 4.229 3.975 4.356 . 0 0 "[ . 1 . 2]" 1
862 1 69 LEU H 1 85 LEU H 3.290 . 4.780 4.034 3.709 4.548 . 0 0 "[ . 1 . 2]" 1
863 1 69 LEU H 1 70 LYS H 3.380 . 4.960 3.999 3.677 4.193 . 0 0 "[ . 1 . 2]" 1
864 1 68 ARG HA 1 69 LEU H 2.730 . 3.660 2.109 2.055 2.193 . 0 0 "[ . 1 . 2]" 1
865 1 69 LEU H 1 69 LEU HB2 3.070 . 4.340 2.477 2.357 2.575 . 0 0 "[ . 1 . 2]" 1
866 1 69 LEU H 1 69 LEU HG 3.080 . 4.360 2.281 2.022 3.046 . 0 0 "[ . 1 . 2]" 1
867 1 69 LEU H 1 69 LEU HB3 3.070 . 4.340 3.579 3.516 3.732 . 0 0 "[ . 1 . 2]" 1
868 1 69 LEU H 1 69 LEU MD1 2.930 . 4.060 3.401 3.201 3.811 . 0 0 "[ . 1 . 2]" 1
869 1 69 LEU H 1 69 LEU MD2 3.300 . 4.800 3.548 3.276 4.100 . 0 0 "[ . 1 . 2]" 1
870 1 84 TYR H 1 84 TYR HD1 3.430 . 5.060 4.687 4.496 4.893 . 0 0 "[ . 1 . 2]" 1
871 1 28 TYR HA 1 84 TYR H 3.260 . 4.730 3.150 2.878 3.524 . 0 0 "[ . 1 . 2]" 1
872 1 83 LEU HB2 1 84 TYR H 3.340 . 4.880 4.347 4.228 4.416 . 0 0 "[ . 1 . 2]" 1
873 1 83 LEU HG 1 84 TYR H 3.130 . 4.460 3.763 3.583 4.027 . 0 0 "[ . 1 . 2]" 1
874 1 83 LEU HB3 1 84 TYR H 3.420 . 5.040 4.419 4.359 4.487 . 0 0 "[ . 1 . 2]" 1
875 1 83 LEU MD1 1 84 TYR H 2.830 . 3.860 2.670 2.401 2.883 . 0 0 "[ . 1 . 2]" 1
876 1 31 LEU H 1 86 GLU H 3.110 . 4.420 3.417 2.851 3.726 . 0 0 "[ . 1 . 2]" 1
877 1 85 LEU HA 1 86 GLU H 2.740 . 3.680 2.156 2.100 2.190 . 0 0 "[ . 1 . 2]" 1
878 1 30 THR HA 1 86 GLU H 2.930 . 4.070 2.388 2.134 2.645 . 0 0 "[ . 1 . 2]" 1
879 1 86 GLU H 1 86 GLU HB2 2.710 . 3.620 2.458 2.227 2.629 . 0 0 "[ . 1 . 2]" 1
880 1 31 LEU HB3 1 86 GLU H 3.320 . 4.840 4.599 4.238 4.878 0.038 4 0 "[ . 1 . 2]" 1
881 1 30 THR MG 1 86 GLU H 3.180 . 4.560 3.715 3.393 4.021 . 0 0 "[ . 1 . 2]" 1
882 1 85 LEU MD1 1 86 GLU H 3.580 . 5.360 5.195 4.745 5.378 0.018 19 0 "[ . 1 . 2]" 1
883 1 32 ASP HA 1 33 VAL H 2.490 . 3.190 2.170 2.087 2.222 . 0 0 "[ . 1 . 2]" 1
884 1 33 VAL H 1 87 VAL HA 3.800 . 5.800 4.758 4.434 5.484 . 0 0 "[ . 1 . 2]" 1
885 1 33 VAL H 1 34 PRO HD3 3.360 . 4.920 4.261 4.088 4.516 . 0 0 "[ . 1 . 2]" 1
886 1 32 ASP HB2 1 33 VAL H 3.300 . 4.800 4.433 4.178 4.523 . 0 0 "[ . 1 . 2]" 1
887 1 32 ASP HB3 1 33 VAL H 3.120 . 4.440 3.781 3.206 3.933 . 0 0 "[ . 1 . 2]" 1
888 1 33 VAL H 1 33 VAL HB 2.960 . 4.120 2.900 2.602 3.411 . 0 0 "[ . 1 . 2]" 1
889 1 33 VAL H 1 88 ARG HB2 3.220 . 4.640 3.987 3.723 4.258 . 0 0 "[ . 1 . 2]" 1
890 1 33 VAL H 1 33 VAL MG1 3.190 . 4.580 3.098 1.982 3.917 . 0 0 "[ . 1 . 2]" 1
891 1 5 ILE H 1 68 ARG H 3.450 . 5.100 4.753 4.163 5.139 0.039 17 0 "[ . 1 . 2]" 1
892 1 67 LEU HA 1 68 ARG H 2.740 . 3.680 2.256 2.182 2.349 . 0 0 "[ . 1 . 2]" 1
893 1 4 VAL MG2 1 68 ARG H 2.930 . 4.060 1.986 1.764 2.599 0.036 13 0 "[ . 1 . 2]" 1
894 1 66 LYS HA 1 67 LEU H 2.690 . 3.580 2.156 2.104 2.207 . 0 0 "[ . 1 . 2]" 1
895 1 67 LEU H 1 86 GLU HA 3.330 . 4.860 3.498 2.894 3.929 . 0 0 "[ . 1 . 2]" 1
896 1 66 LYS HG3 1 67 LEU H 3.600 . 5.400 4.663 4.494 4.921 . 0 0 "[ . 1 . 2]" 1
897 1 67 LEU H 1 67 LEU MD1 3.160 . 4.520 4.020 3.782 4.177 . 0 0 "[ . 1 . 2]" 1
898 1 45 ARG H 1 46 ALA H 3.460 . 5.120 4.387 4.284 4.541 . 0 0 "[ . 1 . 2]" 1
899 1 45 ARG HA 1 46 ALA H 2.510 . 3.220 2.127 2.066 2.216 . 0 0 "[ . 1 . 2]" 1
900 1 46 ALA H 1 54 GLU HA 3.090 . 4.380 3.604 2.985 4.009 . 0 0 "[ . 1 . 2]" 1
901 1 46 ALA H 1 53 VAL HB 3.860 . 5.920 5.035 4.906 5.287 . 0 0 "[ . 1 . 2]" 1
902 1 45 ARG HG3 1 46 ALA H 3.270 . 4.740 4.214 3.343 4.914 0.174 20 0 "[ . 1 . 2]" 1
903 1 45 ARG HG2 1 46 ALA H 3.060 . 4.320 3.832 2.563 4.354 0.034 17 0 "[ . 1 . 2]" 1
904 1 46 ALA H 1 46 ALA MB 2.640 . 3.480 2.367 2.297 2.553 . 0 0 "[ . 1 . 2]" 1
905 1 46 ALA H 1 55 VAL MG2 2.890 . 3.980 3.117 2.697 3.582 . 0 0 "[ . 1 . 2]" 1
906 1 46 ALA H 1 53 VAL MG2 2.890 . 3.980 2.906 2.686 3.453 . 0 0 "[ . 1 . 2]" 1
907 1 8 ASP H 1 8 ASP HB3 2.780 . 3.760 2.958 2.782 3.097 . 0 0 "[ . 1 . 2]" 1
908 1 8 ASP H 1 8 ASP HB2 2.910 . 4.020 3.383 3.154 3.533 . 0 0 "[ . 1 . 2]" 1
909 1 7 ALA MB 1 8 ASP H 2.640 . 3.480 2.473 2.085 2.861 . 0 0 "[ . 1 . 2]" 1
910 1 84 TYR H 1 85 LEU H 3.390 . 4.980 4.312 4.235 4.463 . 0 0 "[ . 1 . 2]" 1
911 1 68 ARG HA 1 85 LEU H 3.390 . 4.980 3.484 3.228 3.780 . 0 0 "[ . 1 . 2]" 1
912 1 84 TYR HB2 1 85 LEU H 3.530 . 5.260 4.512 4.402 4.571 . 0 0 "[ . 1 . 2]" 1
913 1 84 TYR HB3 1 85 LEU H 3.530 . 5.260 4.318 4.111 4.443 . 0 0 "[ . 1 . 2]" 1
914 1 85 LEU H 1 85 LEU HB2 3.020 . 4.240 2.475 2.395 2.594 . 0 0 "[ . 1 . 2]" 1
915 1 85 LEU H 1 85 LEU HB3 3.020 . 4.240 3.680 3.634 3.745 . 0 0 "[ . 1 . 2]" 1
916 1 49 LEU H 1 74 PHE HE1 3.700 . 5.600 4.966 3.169 5.736 0.136 10 0 "[ . 1 . 2]" 1
917 1 49 LEU H 1 49 LEU HG 2.890 . 3.980 2.287 2.117 2.488 . 0 0 "[ . 1 . 2]" 1
918 1 49 LEU H 1 49 LEU MD2 2.960 . 4.120 2.713 2.480 2.907 . 0 0 "[ . 1 . 2]" 1
919 1 48 THR MG 1 49 LEU H 3.020 . 4.240 3.604 3.499 3.808 . 0 0 "[ . 1 . 2]" 1
920 1 5 ILE H 1 66 LYS H 3.690 . 5.580 4.192 3.668 4.847 . 0 0 "[ . 1 . 2]" 1
921 1 5 ILE H 1 67 LEU HA 3.180 . 4.560 3.819 3.566 4.245 . 0 0 "[ . 1 . 2]" 1
922 1 4 VAL HA 1 5 ILE H 2.760 . 3.720 2.449 2.271 2.638 . 0 0 "[ . 1 . 2]" 1
923 1 5 ILE H 1 5 ILE HB 2.890 . 3.980 2.852 2.716 3.003 . 0 0 "[ . 1 . 2]" 1
924 1 5 ILE H 1 66 LYS HG2 3.970 . 6.140 4.872 4.304 5.771 . 0 0 "[ . 1 . 2]" 1
925 1 5 ILE H 1 67 LEU HG 4.090 . 6.380 5.736 5.476 6.345 . 0 0 "[ . 1 . 2]" 1
926 1 5 ILE H 1 5 ILE HG13 3.440 . 5.080 4.640 4.570 4.691 . 0 0 "[ . 1 . 2]" 1
927 1 4 VAL MG1 1 5 ILE H 2.900 . 4.000 3.829 3.689 4.007 0.007 8 0 "[ . 1 . 2]" 1
928 1 4 VAL HA 1 66 LYS H 3.510 . 5.220 4.386 3.694 4.966 . 0 0 "[ . 1 . 2]" 1
929 1 65 ARG HA 1 66 LYS H 2.640 . 3.480 2.340 2.232 2.425 . 0 0 "[ . 1 . 2]" 1
930 1 65 ARG HD2 1 66 LYS H 3.800 . 5.800 5.321 5.020 5.612 . 0 0 "[ . 1 . 2]" 1
931 1 65 ARG HD3 1 66 LYS H 3.220 . 4.640 4.341 4.060 4.608 . 0 0 "[ . 1 . 2]" 1
932 1 65 ARG HB2 1 66 LYS H 3.290 . 4.780 3.814 3.645 4.107 . 0 0 "[ . 1 . 2]" 1
933 1 66 LYS H 1 66 LYS HB2 3.000 . 4.200 3.751 3.699 3.800 . 0 0 "[ . 1 . 2]" 1
934 1 66 LYS H 1 66 LYS HG2 2.590 . 3.380 2.235 2.004 2.412 . 0 0 "[ . 1 . 2]" 1
935 1 66 LYS H 1 66 LYS HG3 3.130 . 4.460 2.879 2.678 3.055 . 0 0 "[ . 1 . 2]" 1
936 1 4 VAL MG1 1 66 LYS H 3.210 . 4.620 4.337 3.841 4.637 0.017 11 0 "[ . 1 . 2]" 1
937 1 24 SER HA 1 25 GLN H 2.680 . 3.560 2.282 2.148 2.675 . 0 0 "[ . 1 . 2]" 1
938 1 35 ALA HA 1 38 ALA H 3.070 . 4.340 3.511 3.381 3.680 . 0 0 "[ . 1 . 2]" 1
939 1 37 ILE HB 1 38 ALA H 2.760 . 3.720 2.938 2.820 3.119 . 0 0 "[ . 1 . 2]" 1
940 1 38 ALA H 1 38 ALA MB 2.440 . 3.080 2.239 2.222 2.261 . 0 0 "[ . 1 . 2]" 1
941 1 37 ILE MG 1 38 ALA H 2.910 . 4.020 3.677 3.553 3.809 . 0 0 "[ . 1 . 2]" 1
942 1 64 GLY H 1 65 ARG H 2.760 . 3.720 2.390 2.233 2.556 . 0 0 "[ . 1 . 2]" 1
943 1 65 ARG H 1 66 LYS H 3.460 . 5.120 4.602 4.548 4.639 . 0 0 "[ . 1 . 2]" 1
944 1 65 ARG H 1 65 ARG HD2 3.820 . 5.840 4.565 4.269 4.767 . 0 0 "[ . 1 . 2]" 1
945 1 65 ARG H 1 65 ARG HD3 3.940 . 6.080 5.142 4.928 5.281 . 0 0 "[ . 1 . 2]" 1
946 1 65 ARG H 1 65 ARG HB2 2.520 . 3.240 2.378 2.245 2.474 . 0 0 "[ . 1 . 2]" 1
947 1 9 TYR HD2 1 54 GLU H 3.200 . 4.600 4.043 3.553 4.621 0.021 17 0 "[ . 1 . 2]" 1
948 1 53 VAL HA 1 54 GLU H 2.780 . 3.760 2.276 2.167 2.419 . 0 0 "[ . 1 . 2]" 1
949 1 11 PRO HA 1 54 GLU H 3.730 . 5.660 4.024 3.246 4.380 . 0 0 "[ . 1 . 2]" 1
950 1 12 ALA HA 1 54 GLU H 3.940 . 6.080 4.264 3.523 4.955 . 0 0 "[ . 1 . 2]" 1
951 1 53 VAL HB 1 54 GLU H 2.800 . 3.800 2.999 2.517 3.380 . 0 0 "[ . 1 . 2]" 1
952 1 54 GLU H 1 54 GLU HB2 2.800 . 3.800 2.515 2.391 2.671 . 0 0 "[ . 1 . 2]" 1
953 1 12 ALA MB 1 54 GLU H 3.030 . 4.260 2.875 2.461 3.817 . 0 0 "[ . 1 . 2]" 1
954 1 53 VAL MG1 1 54 GLU H 3.260 . 4.730 3.985 3.843 4.099 . 0 0 "[ . 1 . 2]" 1
955 1 54 GLU H 1 55 VAL MG2 3.470 . 5.140 4.509 4.284 4.653 . 0 0 "[ . 1 . 2]" 1
956 1 53 VAL MG2 1 54 GLU H 3.000 . 4.200 3.772 3.325 4.120 . 0 0 "[ . 1 . 2]" 1
957 1 10 LYS H 1 54 GLU H 2.980 . 4.160 3.061 2.763 3.520 . 0 0 "[ . 1 . 2]" 1
958 1 9 TYR HD2 1 10 LYS H 2.910 . 4.020 2.722 2.326 3.121 . 0 0 "[ . 1 . 2]" 1
959 1 9 TYR HA 1 10 LYS H 2.730 . 3.660 2.450 2.354 2.561 . 0 0 "[ . 1 . 2]" 1
960 1 10 LYS H 1 55 VAL HA 3.240 . 4.680 3.791 3.446 4.261 . 0 0 "[ . 1 . 2]" 1
961 1 9 TYR HB2 1 10 LYS H 2.940 . 4.080 2.262 2.047 2.602 . 0 0 "[ . 1 . 2]" 1
962 1 9 TYR HB3 1 10 LYS H 3.020 . 4.240 3.699 3.551 3.956 . 0 0 "[ . 1 . 2]" 1
963 1 10 LYS H 1 53 VAL HB 3.010 . 4.220 3.514 3.313 3.909 . 0 0 "[ . 1 . 2]" 1
964 1 10 LYS H 1 10 LYS HB3 3.060 . 4.320 3.868 3.795 3.917 . 0 0 "[ . 1 . 2]" 1
965 1 10 LYS H 1 55 VAL MG2 3.260 . 4.720 4.405 4.162 4.709 . 0 0 "[ . 1 . 2]" 1
966 1 10 LYS H 1 53 VAL MG2 3.200 . 4.600 4.436 4.270 4.612 0.012 6 0 "[ . 1 . 2]" 1
967 1 69 LEU H 1 83 LEU H 3.250 . 4.700 3.293 2.630 3.699 . 0 0 "[ . 1 . 2]" 1
968 1 73 GLY H 1 83 LEU H 3.390 . 4.980 3.962 3.036 4.817 . 0 0 "[ . 1 . 2]" 1
969 1 69 LEU HA 1 83 LEU H 3.410 . 5.020 4.627 4.355 4.926 . 0 0 "[ . 1 . 2]" 1
970 1 82 ASP HB3 1 83 LEU H 3.300 . 4.800 3.505 2.426 4.224 . 0 0 "[ . 1 . 2]" 1
971 1 82 ASP HB2 1 83 LEU H 3.300 . 4.800 3.612 2.695 4.354 . 0 0 "[ . 1 . 2]" 1
972 1 83 LEU H 1 83 LEU HB2 2.960 . 4.120 3.140 2.911 3.399 . 0 0 "[ . 1 . 2]" 1
973 1 69 LEU HG 1 83 LEU H 3.570 . 5.340 4.649 4.333 5.020 . 0 0 "[ . 1 . 2]" 1
974 1 83 LEU H 1 83 LEU HG 3.420 . 5.040 4.436 4.348 4.554 . 0 0 "[ . 1 . 2]" 1
975 1 83 LEU H 1 83 LEU HB3 3.030 . 4.260 2.565 2.376 2.801 . 0 0 "[ . 1 . 2]" 1
976 1 83 LEU H 1 83 LEU MD2 3.480 . 5.160 4.519 4.361 4.730 . 0 0 "[ . 1 . 2]" 1
977 1 69 LEU MD1 1 83 LEU H 3.240 . 4.680 4.006 3.755 4.382 . 0 0 "[ . 1 . 2]" 1
978 1 71 GLY H 1 72 LYS H 3.010 . 4.220 2.590 2.511 2.693 . 0 0 "[ . 1 . 2]" 1
979 1 72 LYS H 1 83 LEU H 3.170 . 4.540 3.885 3.544 4.600 0.060 17 0 "[ . 1 . 2]" 1
980 1 72 LYS H 1 82 ASP HA 2.950 . 4.100 2.783 2.352 3.481 . 0 0 "[ . 1 . 2]" 1
981 1 70 LYS HA 1 72 LYS H 3.050 . 4.300 3.503 3.141 3.900 . 0 0 "[ . 1 . 2]" 1
982 1 72 LYS H 1 72 LYS HB3 3.010 . 4.220 3.840 3.768 3.924 . 0 0 "[ . 1 . 2]" 1
983 1 72 LYS H 1 80 ARG HB3 3.170 . 4.540 3.784 3.148 4.477 . 0 0 "[ . 1 . 2]" 1
984 1 72 LYS H 1 72 LYS HB2 3.010 . 4.220 2.751 2.623 2.909 . 0 0 "[ . 1 . 2]" 1
985 1 69 LEU MD1 1 72 LYS H 4.040 . 6.280 5.871 5.541 6.294 0.014 17 0 "[ . 1 . 2]" 1
986 1 37 ILE H 1 38 ALA H 2.620 . 3.440 2.577 2.520 2.668 . 0 0 "[ . 1 . 2]" 1
987 1 37 ILE H 1 39 VAL H 3.280 . 4.760 4.253 4.114 4.402 . 0 0 "[ . 1 . 2]" 1
988 1 35 ALA HA 1 37 ILE H 3.510 . 5.220 4.565 4.421 4.774 . 0 0 "[ . 1 . 2]" 1
989 1 36 PRO HD3 1 37 ILE H 3.070 . 4.340 4.192 4.088 4.326 . 0 0 "[ . 1 . 2]" 1
990 1 36 PRO HD2 1 37 ILE H 2.830 . 3.860 3.258 3.029 3.471 . 0 0 "[ . 1 . 2]" 1
991 1 34 PRO HD2 1 37 ILE H 3.350 . 4.900 4.449 4.220 4.631 . 0 0 "[ . 1 . 2]" 1
992 1 36 PRO HB2 1 37 ILE H 3.130 . 4.460 3.052 2.796 3.235 . 0 0 "[ . 1 . 2]" 1
993 1 37 ILE H 1 37 ILE HB 2.610 . 3.420 2.523 2.436 2.585 . 0 0 "[ . 1 . 2]" 1
994 1 37 ILE H 1 37 ILE MG 2.950 . 4.100 3.821 3.792 3.843 . 0 0 "[ . 1 . 2]" 1
995 1 40 VAL H 1 41 GLY HA2 3.820 . 5.840 4.818 4.747 4.904 . 0 0 "[ . 1 . 2]" 1
996 1 40 VAL H 1 41 GLY HA3 4.100 . 6.400 5.209 5.155 5.280 . 0 0 "[ . 1 . 2]" 1
997 1 37 ILE HA 1 40 VAL H 3.280 . 4.760 3.765 3.541 3.979 . 0 0 "[ . 1 . 2]" 1
998 1 40 VAL H 1 40 VAL HB 2.900 . 4.000 3.265 2.545 3.733 . 0 0 "[ . 1 . 2]" 1
999 1 39 VAL MG2 1 40 VAL H 2.750 . 3.700 3.824 3.778 3.875 0.175 2 0 "[ . 1 . 2]" 1
1000 1 39 VAL H 1 41 GLY H 3.230 . 4.660 3.898 3.749 4.043 . 0 0 "[ . 1 . 2]" 1
1001 1 38 ALA H 1 39 VAL H 2.740 . 3.680 2.616 2.530 2.723 . 0 0 "[ . 1 . 2]" 1
1002 1 39 VAL H 1 60 ARG HA 3.930 . 6.050 5.050 4.490 5.590 . 0 0 "[ . 1 . 2]" 1
1003 1 37 ILE HA 1 39 VAL H 3.450 . 5.100 4.477 4.344 4.596 . 0 0 "[ . 1 . 2]" 1
1004 1 39 VAL H 1 39 VAL HB 2.540 . 3.280 2.507 2.392 2.583 . 0 0 "[ . 1 . 2]" 1
1005 1 38 ALA MB 1 39 VAL H 2.590 . 3.380 2.524 2.370 2.656 . 0 0 "[ . 1 . 2]" 1
1006 1 39 VAL H 1 39 VAL MG2 3.080 . 4.360 2.147 2.054 2.280 . 0 0 "[ . 1 . 2]" 1
1007 1 39 VAL H 1 89 ILE MD 3.390 . 4.980 4.740 4.526 4.903 . 0 0 "[ . 1 . 2]" 1
1008 1 37 ILE MG 1 39 VAL H 3.700 . 5.600 5.243 5.135 5.342 . 0 0 "[ . 1 . 2]" 1
1009 1 47 MET H 1 48 THR H 3.510 . 5.220 4.302 4.171 4.470 . 0 0 "[ . 1 . 2]" 1
1010 1 48 THR H 1 52 PRO HA 3.090 . 4.380 3.649 3.277 3.954 . 0 0 "[ . 1 . 2]" 1
1011 1 47 MET HA 1 48 THR H 2.770 . 3.740 2.155 2.119 2.194 . 0 0 "[ . 1 . 2]" 1
1012 1 47 MET HB2 1 48 THR H 3.400 . 5.000 4.408 4.297 4.565 . 0 0 "[ . 1 . 2]" 1
1013 1 47 MET HB3 1 48 THR H 3.400 . 5.000 3.907 3.365 4.387 . 0 0 "[ . 1 . 2]" 1
1014 1 48 THR H 1 48 THR MG 2.840 . 3.880 2.846 2.586 3.155 . 0 0 "[ . 1 . 2]" 1
1015 1 48 THR H 1 53 VAL MG2 3.640 . 5.480 3.802 3.438 4.289 . 0 0 "[ . 1 . 2]" 1
1016 1 49 LEU H 1 50 GLU H 2.890 . 3.980 2.549 2.454 2.702 . 0 0 "[ . 1 . 2]" 1
1017 1 48 THR HB 1 50 GLU H 2.930 . 4.070 2.783 2.429 3.319 . 0 0 "[ . 1 . 2]" 1
1018 1 50 GLU H 1 50 GLU HB2 2.930 . 4.060 2.906 2.426 3.700 . 0 0 "[ . 1 . 2]" 1
1019 1 50 GLU H 1 50 GLU HB3 2.930 . 4.060 2.961 2.303 3.773 . 0 0 "[ . 1 . 2]" 1
1020 1 49 LEU MD2 1 50 GLU H 3.360 . 4.920 4.441 4.316 4.544 . 0 0 "[ . 1 . 2]" 1
1021 1 48 THR MG 1 50 GLU H 3.460 . 5.120 4.221 3.881 4.689 . 0 0 "[ . 1 . 2]" 1
1022 1 50 GLU H 1 53 VAL MG1 3.720 . 5.640 4.862 4.472 5.234 . 0 0 "[ . 1 . 2]" 1
1023 1 8 ASP H 1 9 TYR H 3.430 . 5.060 4.359 4.085 4.456 . 0 0 "[ . 1 . 2]" 1
1024 1 9 TYR H 1 9 TYR HD1 2.740 . 3.680 3.197 2.341 3.725 0.045 6 0 "[ . 1 . 2]" 1
1025 1 8 ASP HA 1 9 TYR H 2.520 . 3.240 2.373 2.212 2.607 . 0 0 "[ . 1 . 2]" 1
1026 1 9 TYR H 1 55 VAL HA 3.560 . 5.320 4.486 4.012 4.743 . 0 0 "[ . 1 . 2]" 1
1027 1 8 ASP HB3 1 9 TYR H 3.190 . 4.580 3.814 3.246 4.386 . 0 0 "[ . 1 . 2]" 1
1028 1 9 TYR H 1 9 TYR HB3 2.740 . 3.680 3.128 2.683 3.316 . 0 0 "[ . 1 . 2]" 1
1029 1 9 TYR H 1 55 VAL MG1 3.290 . 4.780 4.473 3.862 4.853 0.073 2 0 "[ . 1 . 2]" 1
1030 1 44 VAL H 1 55 VAL H 2.910 . 4.020 2.923 2.596 3.238 . 0 0 "[ . 1 . 2]" 1
1031 1 43 LYS HA 1 44 VAL H 2.500 . 3.200 2.227 2.160 2.350 . 0 0 "[ . 1 . 2]" 1
1032 1 44 VAL H 1 44 VAL HB 3.000 . 4.200 3.866 3.794 3.915 . 0 0 "[ . 1 . 2]" 1
1033 1 44 VAL H 1 55 VAL HB 2.980 . 4.160 3.492 3.322 3.707 . 0 0 "[ . 1 . 2]" 1
1034 1 43 LYS HB2 1 44 VAL H 3.420 . 5.040 4.107 3.897 4.251 . 0 0 "[ . 1 . 2]" 1
1035 1 43 LYS HB3 1 44 VAL H 2.810 . 3.820 2.957 2.628 3.231 . 0 0 "[ . 1 . 2]" 1
1036 1 43 LYS HG3 1 44 VAL H 3.570 . 5.340 4.929 4.766 5.069 . 0 0 "[ . 1 . 2]" 1
1037 1 43 LYS HG2 1 44 VAL H 3.060 . 4.320 3.973 3.819 4.204 . 0 0 "[ . 1 . 2]" 1
1038 1 44 VAL H 1 44 VAL MG1 2.960 . 4.120 3.102 2.875 3.323 . 0 0 "[ . 1 . 2]" 1
1039 1 44 VAL H 1 44 VAL MG2 2.620 . 3.440 2.254 2.112 2.342 . 0 0 "[ . 1 . 2]" 1
1040 1 44 VAL H 1 55 VAL MG2 3.720 . 5.640 4.478 4.248 4.625 . 0 0 "[ . 1 . 2]" 1
1041 1 39 VAL H 1 60 ARG H 3.800 . 5.800 4.807 4.485 5.499 . 0 0 "[ . 1 . 2]" 1
1042 1 40 VAL H 1 60 ARG H 3.950 . 6.100 4.527 4.357 4.946 . 0 0 "[ . 1 . 2]" 1
1043 1 40 VAL HA 1 60 ARG H 3.290 . 4.780 4.411 4.178 4.641 . 0 0 "[ . 1 . 2]" 1
1044 1 59 PRO HA 1 60 ARG H 2.570 . 3.340 2.198 2.118 2.350 . 0 0 "[ . 1 . 2]" 1
1045 1 39 VAL HA 1 60 ARG H 2.760 . 3.720 2.813 2.389 3.356 . 0 0 "[ . 1 . 2]" 1
1046 1 59 PRO HB3 1 60 ARG H 2.970 . 4.140 3.596 3.154 4.048 . 0 0 "[ . 1 . 2]" 1
1047 1 60 ARG H 1 60 ARG HB3 3.200 . 4.600 4.092 4.018 4.129 . 0 0 "[ . 1 . 2]" 1
1048 1 60 ARG H 1 60 ARG HB2 3.200 . 4.600 3.646 3.502 3.729 . 0 0 "[ . 1 . 2]" 1
1049 1 39 VAL MG1 1 60 ARG H 3.590 . 5.380 4.084 3.847 4.330 . 0 0 "[ . 1 . 2]" 1
1050 1 24 SER H 1 25 GLN H 3.220 . 4.640 4.013 2.543 4.623 . 0 0 "[ . 1 . 2]" 1
1051 1 40 VAL H 1 41 GLY H 2.590 . 3.380 2.515 2.432 2.621 . 0 0 "[ . 1 . 2]" 1
1052 1 41 GLY H 1 59 PRO HA 2.940 . 4.080 3.227 2.885 3.539 . 0 0 "[ . 1 . 2]" 1
1053 1 40 VAL HB 1 41 GLY H 3.240 . 4.680 4.123 4.022 4.244 . 0 0 "[ . 1 . 2]" 1
1054 1 41 GLY H 1 59 PRO HB3 3.730 . 5.660 4.636 3.977 5.234 . 0 0 "[ . 1 . 2]" 1
1055 1 41 GLY H 1 57 VAL MG2 4.200 . 6.600 5.825 5.201 6.226 . 0 0 "[ . 1 . 2]" 1
1056 1 41 GLY H 1 57 VAL MG1 4.200 . 6.600 4.200 3.714 4.932 . 0 0 "[ . 1 . 2]" 1
1057 1 37 ILE MG 1 41 GLY H 3.060 . 4.320 4.104 3.896 4.242 . 0 0 "[ . 1 . 2]" 1
1058 1 29 ALA HA 1 30 THR H 2.690 . 3.580 2.398 2.223 2.486 . 0 0 "[ . 1 . 2]" 1
1059 1 30 THR H 1 30 THR HB 2.850 . 3.900 3.289 2.422 3.664 . 0 0 "[ . 1 . 2]" 1
1060 1 29 ALA MB 1 30 THR H 2.660 . 3.520 2.453 2.215 2.991 . 0 0 "[ . 1 . 2]" 1
1061 1 30 THR H 1 30 THR MG 2.990 . 4.180 3.235 2.754 3.913 . 0 0 "[ . 1 . 2]" 1
1062 1 30 THR H 1 85 LEU MD2 3.410 . 5.020 3.926 3.495 4.419 . 0 0 "[ . 1 . 2]" 1
1063 1 48 THR H 1 53 VAL H 3.420 . 5.040 4.373 4.227 4.697 . 0 0 "[ . 1 . 2]" 1
1064 1 52 PRO HA 1 53 VAL H 2.590 . 3.380 2.197 2.135 2.248 . 0 0 "[ . 1 . 2]" 1
1065 1 47 MET HA 1 53 VAL H 3.150 . 4.510 3.995 3.626 4.425 . 0 0 "[ . 1 . 2]" 1
1066 1 52 PRO HB2 1 53 VAL H 2.970 . 4.140 3.497 3.142 3.945 . 0 0 "[ . 1 . 2]" 1
1067 1 46 ALA MB 1 53 VAL H 2.980 . 4.160 3.709 3.350 3.972 . 0 0 "[ . 1 . 2]" 1
1068 1 53 VAL H 1 53 VAL MG1 2.730 . 3.660 3.027 2.881 3.161 . 0 0 "[ . 1 . 2]" 1
1069 1 53 VAL H 1 53 VAL MG2 2.640 . 3.480 2.388 2.294 2.502 . 0 0 "[ . 1 . 2]" 1
1070 1 71 GLY H 1 83 LEU H 3.730 . 5.660 5.017 4.313 5.643 . 0 0 "[ . 1 . 2]" 1
1071 1 71 GLY H 1 82 ASP HA 3.060 . 4.320 3.190 2.797 3.884 . 0 0 "[ . 1 . 2]" 1
1072 1 70 LYS HA 1 71 GLY H 2.710 . 3.620 2.179 2.128 2.244 . 0 0 "[ . 1 . 2]" 1
1073 1 70 LYS HB3 1 71 GLY H 2.870 . 3.940 3.197 2.800 3.590 . 0 0 "[ . 1 . 2]" 1
1074 1 70 LYS HG2 1 71 GLY H 3.200 . 4.600 4.302 3.958 4.509 . 0 0 "[ . 1 . 2]" 1
1075 1 70 LYS HG3 1 71 GLY H 3.750 . 5.700 5.168 4.974 5.351 . 0 0 "[ . 1 . 2]" 1
1076 1 63 ALA H 1 64 GLY H 3.470 . 5.140 4.543 4.415 4.644 . 0 0 "[ . 1 . 2]" 1
1077 1 63 ALA HA 1 64 GLY H 2.610 . 3.410 2.194 2.149 2.300 . 0 0 "[ . 1 . 2]" 1
1078 1 64 GLY H 1 65 ARG HB2 3.250 . 4.700 4.347 4.126 4.581 . 0 0 "[ . 1 . 2]" 1
1079 1 63 ALA MB 1 64 GLY H 2.680 . 3.560 3.083 2.654 3.339 . 0 0 "[ . 1 . 2]" 1
1080 1 64 GLY H 1 87 VAL MG2 3.590 . 5.380 4.864 4.384 5.150 . 0 0 "[ . 1 . 2]" 1
1081 1 71 GLY H 1 73 GLY H 3.310 . 4.820 4.127 3.690 4.698 . 0 0 "[ . 1 . 2]" 1
1082 1 72 LYS H 1 73 GLY H 2.810 . 3.820 2.200 1.777 2.879 0.023 19 0 "[ . 1 . 2]" 1
1083 1 73 GLY H 1 82 ASP HA 3.000 . 4.200 3.027 2.251 3.546 . 0 0 "[ . 1 . 2]" 1
1084 1 72 LYS HB2 1 73 GLY H 3.460 . 5.120 3.817 2.586 4.399 . 0 0 "[ . 1 . 2]" 1
1085 1 69 LEU MD1 1 73 GLY H 3.930 . 6.060 6.056 5.679 6.334 0.274 18 0 "[ . 1 . 2]" 1
1086 1 74 PHE H 1 81 GLY H 3.430 . 5.060 3.183 2.437 3.831 . 0 0 "[ . 1 . 2]" 1
1087 1 72 LYS H 1 81 GLY H 3.940 . 6.080 5.095 4.317 5.605 . 0 0 "[ . 1 . 2]" 1
1088 1 80 ARG HA 1 81 GLY H 2.840 . 3.880 2.345 2.163 2.453 . 0 0 "[ . 1 . 2]" 1
1089 1 73 GLY HA2 1 81 GLY H 3.860 . 5.920 5.291 4.862 5.802 . 0 0 "[ . 1 . 2]" 1
1090 1 73 GLY HA3 1 81 GLY H 3.200 . 4.600 3.972 3.516 4.392 . 0 0 "[ . 1 . 2]" 1
1091 1 80 ARG HG3 1 81 GLY H 3.480 . 5.160 4.553 3.254 4.932 . 0 0 "[ . 1 . 2]" 1
1092 1 80 ARG HB3 1 81 GLY H 2.880 . 3.960 2.822 2.413 3.923 . 0 0 "[ . 1 . 2]" 1
1093 1 80 ARG HG2 1 81 GLY H 3.240 . 4.680 3.472 2.609 4.060 . 0 0 "[ . 1 . 2]" 1
1094 1 76 GLY H 1 78 ALA H 4.040 . 6.280 5.542 4.935 5.893 . 0 0 "[ . 1 . 2]" 1
1095 1 75 PRO HA 1 76 GLY H 2.540 . 3.280 2.207 2.128 2.360 . 0 0 "[ . 1 . 2]" 1
1096 1 76 GLY H 1 77 PRO HD2 3.610 . 5.420 4.779 4.561 4.956 . 0 0 "[ . 1 . 2]" 1
1097 1 75 PRO HB3 1 76 GLY H 3.120 . 4.440 3.527 2.985 4.078 . 0 0 "[ . 1 . 2]" 1
1098 1 75 PRO HB2 1 76 GLY H 2.840 . 3.880 3.619 2.949 3.944 0.064 7 0 "[ . 1 . 2]" 1
1099 1 76 GLY H 1 80 ARG HG3 3.120 . 4.440 2.850 2.310 3.491 . 0 0 "[ . 1 . 2]" 1
1100 1 76 GLY H 1 80 ARG HB2 3.830 . 5.860 4.645 2.840 5.329 . 0 0 "[ . 1 . 2]" 1
1101 1 76 GLY H 1 80 ARG HB3 4.060 . 6.320 4.792 4.316 5.402 . 0 0 "[ . 1 . 2]" 1
1102 1 76 GLY H 1 80 ARG HG2 2.970 . 4.140 2.672 1.990 4.147 0.007 11 0 "[ . 1 . 2]" 1
1103 1 78 ALA H 1 79 GLY H 2.500 . 3.200 2.323 1.917 2.696 . 0 0 "[ . 1 . 2]" 1
1104 1 76 GLY H 1 79 GLY H 3.640 . 5.480 4.676 3.807 5.170 . 0 0 "[ . 1 . 2]" 1
1105 1 78 ALA HA 1 79 GLY H 2.820 . 3.850 3.412 3.124 3.514 . 0 0 "[ . 1 . 2]" 1
1106 1 76 GLY HA2 1 79 GLY H 3.740 . 5.680 4.430 4.064 5.019 . 0 0 "[ . 1 . 2]" 1
1107 1 77 PRO HG2 1 79 GLY H 3.710 . 5.620 4.659 4.232 5.255 . 0 0 "[ . 1 . 2]" 1
1108 1 78 ALA MB 1 79 GLY H 2.980 . 4.160 3.025 2.766 3.518 . 0 0 "[ . 1 . 2]" 1
1109 1 42 GLY H 1 57 VAL H 3.010 . 4.220 3.787 3.275 4.324 0.104 16 0 "[ . 1 . 2]" 1
1110 1 41 GLY H 1 42 GLY H 3.130 . 4.460 3.624 2.818 4.423 . 0 0 "[ . 1 . 2]" 1
1111 1 42 GLY H 1 43 LYS H 3.300 . 4.800 4.162 3.888 4.403 . 0 0 "[ . 1 . 2]" 1
1112 1 41 GLY HA2 1 42 GLY H 2.650 . 3.500 2.323 2.168 2.483 . 0 0 "[ . 1 . 2]" 1
1113 1 42 GLY H 1 57 VAL HB 2.700 . 3.600 2.520 1.869 2.920 . 0 0 "[ . 1 . 2]" 1
1114 1 42 GLY H 1 57 VAL MG1 3.040 . 4.280 3.581 3.053 3.941 . 0 0 "[ . 1 . 2]" 1
1115 1 37 ILE MG 1 42 GLY H 2.860 . 3.920 2.874 2.236 3.790 . 0 0 "[ . 1 . 2]" 1
1116 1 49 LEU H 1 51 GLY H 3.330 . 4.860 4.037 3.893 4.204 . 0 0 "[ . 1 . 2]" 1
1117 1 50 GLU H 1 51 GLY H 2.630 . 3.460 2.300 2.050 2.451 . 0 0 "[ . 1 . 2]" 1
1118 1 48 THR H 1 51 GLY H 3.030 . 4.260 3.322 3.018 3.596 . 0 0 "[ . 1 . 2]" 1
1119 1 48 THR HB 1 51 GLY H 3.030 . 4.260 3.938 3.706 4.103 . 0 0 "[ . 1 . 2]" 1
1120 1 51 GLY H 1 52 PRO HD2 3.610 . 5.420 4.952 4.809 5.352 . 0 0 "[ . 1 . 2]" 1
1121 1 51 GLY H 1 53 VAL MG1 3.210 . 4.620 4.216 3.775 4.559 . 0 0 "[ . 1 . 2]" 1
1122 1 44 VAL HA 1 45 ARG H 2.410 . 3.020 2.317 2.159 2.485 . 0 0 "[ . 1 . 2]" 1
1123 1 44 VAL HB 1 45 ARG H 2.570 . 3.340 2.765 2.332 3.228 . 0 0 "[ . 1 . 2]" 1
1124 1 45 ARG H 1 45 ARG HB2 2.430 . 3.060 2.490 2.274 2.648 . 0 0 "[ . 1 . 2]" 1
1125 1 44 VAL MG1 1 45 ARG H 2.880 . 3.960 3.777 3.585 3.902 . 0 0 "[ . 1 . 2]" 1
1126 1 44 VAL MG2 1 45 ARG H 3.130 . 4.460 3.729 3.419 4.071 . 0 0 "[ . 1 . 2]" 1
1127 1 44 VAL H 1 57 VAL H 3.340 . 4.880 3.914 3.699 4.075 . 0 0 "[ . 1 . 2]" 1
1128 1 43 LYS H 1 57 VAL H 3.620 . 5.440 4.551 4.325 4.812 . 0 0 "[ . 1 . 2]" 1
1129 1 56 ALA H 1 57 VAL H 3.840 . 5.880 4.244 4.180 4.329 . 0 0 "[ . 1 . 2]" 1
1130 1 56 ALA HA 1 57 VAL H 2.520 . 3.240 2.156 2.115 2.189 . 0 0 "[ . 1 . 2]" 1
1131 1 42 GLY HA2 1 57 VAL H 3.420 . 5.040 4.748 4.266 4.906 . 0 0 "[ . 1 . 2]" 1
1132 1 56 ALA MB 1 57 VAL H 2.650 . 3.500 3.483 3.390 3.553 0.053 20 0 "[ . 1 . 2]" 1
1133 1 57 VAL H 1 57 VAL MG1 3.130 . 4.460 3.810 3.785 3.844 . 0 0 "[ . 1 . 2]" 1
1134 1 37 ILE MG 1 57 VAL H 3.500 . 5.200 4.250 3.957 4.736 . 0 0 "[ . 1 . 2]" 1
1135 1 47 MET H 1 47 MET HG2 3.650 . 5.500 3.574 2.527 4.788 . 0 0 "[ . 1 . 2]" 1
1136 1 47 MET H 1 47 MET ME 3.250 . 4.700 4.071 3.600 4.579 . 0 0 "[ . 1 . 2]" 1
1137 1 47 MET H 1 47 MET HB3 2.920 . 4.040 3.242 2.506 3.731 . 0 0 "[ . 1 . 2]" 1
1138 1 47 MET ME 1 51 GLY H 3.530 . 5.260 4.616 3.712 5.376 0.116 16 0 "[ . 1 . 2]" 1
1139 1 51 GLY H 1 53 VAL MG2 4.370 . 6.940 5.507 4.955 6.087 . 0 0 "[ . 1 . 2]" 1
1140 1 77 PRO HD3 1 79 GLY H 3.930 . 6.050 5.278 4.998 5.711 . 0 0 "[ . 1 . 2]" 1
1141 1 79 GLY H 1 80 ARG HB2 4.060 . 6.320 5.859 5.060 6.269 . 0 0 "[ . 1 . 2]" 1
1142 1 76 GLY HA3 1 79 GLY H 3.220 . 4.640 3.343 3.043 3.979 . 0 0 "[ . 1 . 2]" 1
1143 1 77 PRO HA 1 79 GLY H 3.500 . 5.200 4.264 3.510 4.905 . 0 0 "[ . 1 . 2]" 1
1144 1 76 GLY H 1 77 PRO HD3 3.510 . 5.220 4.573 4.134 5.125 . 0 0 "[ . 1 . 2]" 1
1145 1 76 GLY H 1 80 ARG H 3.910 . 6.020 4.722 3.841 5.857 . 0 0 "[ . 1 . 2]" 1
1146 1 76 GLY H 1 81 GLY H 3.830 . 5.860 5.004 4.385 5.872 0.012 20 0 "[ . 1 . 2]" 1
1147 1 80 ARG H 1 81 GLY H 3.460 . 5.120 4.580 4.302 4.654 . 0 0 "[ . 1 . 2]" 1
1148 1 72 LYS HB3 1 73 GLY H 3.460 . 5.120 4.320 3.639 4.508 . 0 0 "[ . 1 . 2]" 1
1149 1 73 GLY H 1 82 ASP H 3.670 . 5.540 4.226 3.902 4.730 . 0 0 "[ . 1 . 2]" 1
1150 1 35 ALA H 1 37 ILE H 3.470 . 5.140 4.540 4.433 4.670 . 0 0 "[ . 1 . 2]" 1
1151 1 37 ILE H 1 41 GLY H 3.960 . 6.120 5.711 5.555 5.850 . 0 0 "[ . 1 . 2]" 1
1152 1 33 VAL HA 1 37 ILE H 4.120 . 6.440 6.213 6.097 6.329 . 0 0 "[ . 1 . 2]" 1
1153 1 9 TYR H 1 10 LYS HB2 4.130 . 6.460 6.360 6.057 6.620 0.160 9 0 "[ . 1 . 2]" 1
1154 1 9 TYR H 1 69 LEU MD1 3.590 . 5.380 4.283 3.464 4.932 . 0 0 "[ . 1 . 2]" 1
1155 1 9 TYR H 1 69 LEU MD2 3.610 . 5.420 3.171 2.269 3.548 . 0 0 "[ . 1 . 2]" 1
1156 1 38 ALA MB 1 60 ARG H 4.080 . 6.360 5.026 4.746 5.696 . 0 0 "[ . 1 . 2]" 1
1157 1 37 ILE MG 1 44 VAL H 3.520 . 5.240 4.251 3.929 4.622 . 0 0 "[ . 1 . 2]" 1
1158 1 44 VAL H 1 55 VAL HA 3.680 . 5.560 4.767 4.559 5.041 . 0 0 "[ . 1 . 2]" 1
1159 1 44 VAL H 1 54 GLU HA 3.510 . 5.220 3.998 3.589 4.503 . 0 0 "[ . 1 . 2]" 1
1160 1 47 MET H 1 53 VAL H 3.590 . 5.380 5.174 4.988 5.291 . 0 0 "[ . 1 . 2]" 1
1161 1 12 ALA H 1 53 VAL H 3.650 . 5.500 4.356 4.188 4.581 . 0 0 "[ . 1 . 2]" 1
1162 1 45 ARG HG2 1 53 VAL H 3.530 . 5.260 3.866 2.813 4.809 . 0 0 "[ . 1 . 2]" 1
1163 1 10 LYS H 1 69 LEU MD2 4.380 . 6.960 6.118 5.561 6.401 . 0 0 "[ . 1 . 2]" 1
1164 1 10 LYS H 1 11 PRO HD2 3.720 . 5.640 4.884 4.717 5.264 . 0 0 "[ . 1 . 2]" 1
1165 1 10 LYS H 1 53 VAL HA 3.690 . 5.580 4.580 4.109 5.038 . 0 0 "[ . 1 . 2]" 1
1166 1 9 TYR H 1 10 LYS H 3.420 . 5.040 4.423 4.384 4.565 . 0 0 "[ . 1 . 2]" 1
1167 1 82 ASP H 1 83 LEU H 3.580 . 5.360 4.452 4.322 4.591 . 0 0 "[ . 1 . 2]" 1
1168 1 73 GLY HA2 1 82 ASP H 3.570 . 5.340 4.974 4.663 5.433 0.093 17 0 "[ . 1 . 2]" 1
1169 1 25 GLN HB3 1 82 ASP H 3.510 . 5.220 4.100 3.427 4.835 . 0 0 "[ . 1 . 2]" 1
1170 1 28 TYR H 1 28 TYR HE1 3.810 . 5.820 5.239 4.768 5.625 . 0 0 "[ . 1 . 2]" 1
1171 1 27 LEU MD2 1 28 TYR H 3.080 . 4.360 3.327 2.979 3.738 . 0 0 "[ . 1 . 2]" 1
1172 1 27 LEU HB3 1 28 TYR H 3.360 . 4.920 2.967 2.644 3.269 . 0 0 "[ . 1 . 2]" 1
1173 1 28 TYR H 1 29 ALA MB 3.340 . 4.880 4.247 3.893 4.637 . 0 0 "[ . 1 . 2]" 1
1174 1 27 LEU MD2 1 49 LEU H 3.670 . 5.540 4.433 4.009 4.963 . 0 0 "[ . 1 . 2]" 1
1175 1 84 TYR HD1 1 85 LEU H 3.450 . 5.100 3.989 3.231 4.475 . 0 0 "[ . 1 . 2]" 1
1176 1 8 ASP H 1 55 VAL MG1 3.190 . 4.580 3.561 3.212 4.030 . 0 0 "[ . 1 . 2]" 1
1177 1 29 ALA H 1 69 LEU MD1 4.160 . 6.520 6.509 6.266 6.628 0.108 8 0 "[ . 1 . 2]" 1
1178 1 29 ALA H 1 86 GLU HB2 3.950 . 6.100 5.666 5.004 6.135 0.035 14 0 "[ . 1 . 2]" 1
1179 1 26 ASP H 1 82 ASP H 3.690 . 5.580 4.285 3.870 4.849 . 0 0 "[ . 1 . 2]" 1
1180 1 70 LYS HA 1 83 LEU H 3.400 . 5.000 4.264 3.895 4.720 . 0 0 "[ . 1 . 2]" 1
1181 1 67 LEU H 1 87 VAL H 3.450 . 5.100 3.965 3.566 4.260 . 0 0 "[ . 1 . 2]" 1
1182 1 45 ARG H 1 55 VAL H 3.720 . 5.640 4.960 4.718 5.078 . 0 0 "[ . 1 . 2]" 1
1183 1 64 GLY H 1 89 ILE H 3.670 . 5.540 4.267 3.759 4.727 . 0 0 "[ . 1 . 2]" 1
1184 1 56 ALA H 1 69 LEU MD1 4.120 . 6.440 5.697 5.378 6.023 . 0 0 "[ . 1 . 2]" 1
1185 1 53 VAL MG2 1 56 ALA H 4.460 . 7.120 6.267 5.866 6.510 . 0 0 "[ . 1 . 2]" 1
1186 1 8 ASP H 1 56 ALA H 3.120 . 4.440 3.662 3.004 4.032 . 0 0 "[ . 1 . 2]" 1
1187 1 31 LEU H 1 31 LEU MD2 3.350 . 4.900 4.492 4.403 4.577 . 0 0 "[ . 1 . 2]" 1
1188 1 32 ASP H 1 88 ARG H 3.870 . 5.940 5.027 4.715 5.209 . 0 0 "[ . 1 . 2]" 1
1189 1 10 LYS H 1 10 LYS HB2 2.940 . 4.080 2.809 2.710 2.894 . 0 0 "[ . 1 . 2]" 1
1190 1 27 LEU H 1 27 LEU HB2 2.950 . 4.100 2.627 2.395 2.779 . 0 0 "[ . 1 . 2]" 1
1191 1 27 LEU H 1 27 LEU MD2 3.330 . 4.860 4.001 3.534 4.288 . 0 0 "[ . 1 . 2]" 1
1192 1 26 ASP HA 1 27 LEU H 2.850 . 3.900 2.221 2.133 2.356 . 0 0 "[ . 1 . 2]" 1
1193 1 77 PRO HD2 1 78 ALA H 3.040 . 4.280 2.958 2.706 3.308 . 0 0 "[ . 1 . 2]" 1
1194 1 77 PRO HB2 1 78 ALA H 3.130 . 4.460 3.322 2.804 3.747 . 0 0 "[ . 1 . 2]" 1
1195 1 49 LEU HG 1 50 GLU H 3.560 . 5.320 4.413 4.153 4.703 . 0 0 "[ . 1 . 2]" 1
1196 1 1 MET HA 1 2 ASP QB 3.560 . 5.320 4.538 4.093 5.262 . 0 0 "[ . 1 . 2]" 1
1197 1 2 ASP H 1 2 ASP QB 2.690 . 3.580 2.696 2.261 3.367 . 0 0 "[ . 1 . 2]" 1
1198 1 3 ASP HB3 1 66 LYS QD 3.580 . 5.360 5.187 4.801 5.450 0.090 1 0 "[ . 1 . 2]" 1
1199 1 3 ASP HB3 1 68 ARG QB 3.720 . 5.640 5.093 3.977 5.641 0.001 5 0 "[ . 1 . 2]" 1
1200 1 3 ASP HB3 1 68 ARG QD 3.570 . 5.340 4.916 3.191 5.471 0.131 8 0 "[ . 1 . 2]" 1
1201 1 4 VAL MG1 1 66 LYS QD 3.310 . 4.820 2.343 1.970 2.954 . 0 0 "[ . 1 . 2]" 1
1202 1 4 VAL MG1 1 66 LYS QE 2.990 . 4.180 2.933 2.363 3.563 . 0 0 "[ . 1 . 2]" 1
1203 1 4 VAL MG2 1 66 LYS QE 3.510 . 5.220 4.917 4.578 5.441 0.221 1 0 "[ . 1 . 2]" 1
1204 1 4 VAL MG2 1 68 ARG QB 3.330 . 4.860 1.849 1.625 2.041 0.175 5 0 "[ . 1 . 2]" 1
1205 1 4 VAL MG2 1 68 ARG QG 3.070 . 4.340 3.752 3.612 3.911 . 0 0 "[ . 1 . 2]" 1
1206 1 5 ILE HA 1 6 ASP QB 3.580 . 5.360 4.107 3.991 4.201 . 0 0 "[ . 1 . 2]" 1
1207 1 5 ILE MG 1 6 ASP QB 3.330 . 4.860 4.901 4.600 5.044 0.184 10 0 "[ . 1 . 2]" 1
1208 1 5 ILE MG 1 58 PRO QB 3.150 . 4.510 3.836 3.071 4.484 . 0 0 "[ . 1 . 2]" 1
1209 1 5 ILE MG 1 87 VAL QG 3.520 . 5.240 3.907 3.330 4.329 . 0 0 "[ . 1 . 2]" 1
1210 1 5 ILE MD 1 58 PRO QB 3.280 . 4.760 2.428 2.110 2.973 . 0 0 "[ . 1 . 2]" 1
1211 1 5 ILE MD 1 59 PRO QD 3.570 . 5.340 4.403 3.844 5.026 . 0 0 "[ . 1 . 2]" 1
1212 1 6 ASP H 1 6 ASP QB 2.580 . 3.360 2.247 2.208 2.278 . 0 0 "[ . 1 . 2]" 1
1213 1 7 ALA MB 1 67 LEU QB 2.800 . 3.800 2.292 1.986 2.625 . 0 0 "[ . 1 . 2]" 1
1214 1 9 TYR H 1 10 LYS QG 3.630 . 5.460 4.784 4.377 5.254 . 0 0 "[ . 1 . 2]" 1
1215 1 9 TYR H 1 72 LYS QB 3.580 . 5.360 4.056 3.361 4.626 . 0 0 "[ . 1 . 2]" 1
1216 1 9 TYR HA 1 10 LYS QG 3.500 . 5.200 3.856 3.626 4.214 . 0 0 "[ . 1 . 2]" 1
1217 1 10 LYS H 1 10 LYS QG 3.050 . 4.300 3.345 3.132 3.557 . 0 0 "[ . 1 . 2]" 1
1218 1 10 LYS HA 1 10 LYS QG 2.900 . 4.000 2.745 2.302 3.030 . 0 0 "[ . 1 . 2]" 1
1219 1 10 LYS HA 1 10 LYS QE 3.440 . 5.080 3.797 1.794 5.157 0.077 12 0 "[ . 1 . 2]" 1
1220 1 10 LYS HA 1 11 PRO QG 3.380 . 4.950 3.953 3.788 4.146 . 0 0 "[ . 1 . 2]" 1
1221 1 10 LYS QE 1 10 LYS QG 2.530 . 3.260 2.414 2.161 2.917 . 0 0 "[ . 1 . 2]" 1
1222 1 10 LYS QG 1 11 PRO HD2 3.230 . 4.660 3.964 2.995 4.621 . 0 0 "[ . 1 . 2]" 1
1223 1 10 LYS QG 1 11 PRO HD3 3.410 . 5.020 4.695 4.068 5.129 0.109 11 0 "[ . 1 . 2]" 1
1224 1 10 LYS QD 1 11 PRO QG 3.170 . 4.540 4.647 4.375 4.769 0.229 12 0 "[ . 1 . 2]" 1
1225 1 10 LYS QD 1 11 PRO HD2 3.310 . 4.820 3.386 2.866 3.837 . 0 0 "[ . 1 . 2]" 1
1226 1 10 LYS QD 1 11 PRO HD3 3.510 . 5.220 4.206 3.128 5.351 0.131 19 0 "[ . 1 . 2]" 1
1227 1 11 PRO QB 1 12 ALA H 3.060 . 4.320 3.614 3.157 3.851 . 0 0 "[ . 1 . 2]" 1
1228 1 11 PRO QB 1 53 VAL MG1 3.250 . 4.700 3.062 2.575 3.527 . 0 0 "[ . 1 . 2]" 1
1229 1 12 ALA HA 1 54 GLU QG 3.150 . 4.510 3.429 2.557 4.112 . 0 0 "[ . 1 . 2]" 1
1230 1 12 ALA MB 1 13 ASP QB 3.390 . 4.980 4.007 3.560 4.839 . 0 0 "[ . 1 . 2]" 1
1231 1 12 ALA MB 1 45 ARG QD 3.350 . 4.900 3.581 2.672 4.866 . 0 0 "[ . 1 . 2]" 1
1232 1 12 ALA MB 1 54 GLU QG 2.390 . 2.980 1.912 1.718 2.710 0.082 12 0 "[ . 1 . 2]" 1
1233 1 13 ASP H 1 13 ASP QB 2.610 . 3.410 2.616 2.211 3.426 0.016 16 0 "[ . 1 . 2]" 1
1234 1 24 SER HA 1 25 GLN QB 3.500 . 5.200 4.502 4.364 4.775 . 0 0 "[ . 1 . 2]" 1
1235 1 24 SER QB 1 25 GLN H 3.040 . 4.280 3.482 2.247 3.933 . 0 0 "[ . 1 . 2]" 1
1236 1 24 SER QB 1 26 ASP H 3.010 . 4.220 3.771 2.600 4.436 0.216 4 0 "[ . 1 . 2]" 1
1237 1 25 GLN H 1 25 GLN QB 2.920 . 4.040 2.518 2.334 3.428 . 0 0 "[ . 1 . 2]" 1
1238 1 25 GLN H 1 25 GLN QG 3.100 . 4.400 2.628 2.142 3.307 . 0 0 "[ . 1 . 2]" 1
1239 1 25 GLN HA 1 74 PHE QB 3.250 . 4.700 1.935 1.713 2.467 0.087 11 0 "[ . 1 . 2]" 1
1240 1 25 GLN QB 1 26 ASP H 3.110 . 4.420 2.864 2.309 3.679 . 0 0 "[ . 1 . 2]" 1
1241 1 25 GLN QB 1 74 PHE H 3.800 . 5.800 3.947 3.087 4.672 . 0 0 "[ . 1 . 2]" 1
1242 1 25 GLN QB 1 74 PHE QB 3.070 . 4.340 3.148 2.106 3.667 . 0 0 "[ . 1 . 2]" 1
1243 1 25 GLN QB 1 81 GLY H 3.120 . 4.440 3.233 2.488 4.114 . 0 0 "[ . 1 . 2]" 1
1244 1 25 GLN QB 1 81 GLY QA 2.970 . 4.140 2.101 1.790 2.515 0.010 17 0 "[ . 1 . 2]" 1
1245 1 25 GLN QB 1 82 ASP H 3.170 . 4.540 3.775 3.319 4.222 . 0 0 "[ . 1 . 2]" 1
1246 1 25 GLN QG 1 26 ASP H 3.240 . 4.680 4.227 3.854 4.543 . 0 0 "[ . 1 . 2]" 1
1247 1 25 GLN QG 1 74 PHE QB 3.290 . 4.780 3.516 2.505 4.197 . 0 0 "[ . 1 . 2]" 1
1248 1 26 ASP H 1 26 ASP QB 2.730 . 3.660 2.596 2.280 3.015 . 0 0 "[ . 1 . 2]" 1
1249 1 26 ASP QB 1 27 LEU H 3.170 . 4.540 3.087 2.603 3.671 . 0 0 "[ . 1 . 2]" 1
1250 1 26 ASP QB 1 82 ASP H 3.500 . 5.200 3.397 2.054 4.623 . 0 0 "[ . 1 . 2]" 1
1251 1 27 LEU MD1 1 74 PHE QB 3.750 . 5.700 4.439 3.296 5.281 . 0 0 "[ . 1 . 2]" 1
1252 1 29 ALA H 1 84 TYR QB 3.530 . 5.260 3.728 3.449 3.962 . 0 0 "[ . 1 . 2]" 1
1253 1 30 THR HB 1 88 ARG QD 3.840 . 5.880 4.679 3.601 5.988 0.108 1 0 "[ . 1 . 2]" 1
1254 1 30 THR MG 1 88 ARG QD 2.790 . 3.780 3.113 2.519 3.872 0.092 4 0 "[ . 1 . 2]" 1
1255 1 31 LEU HB3 1 33 VAL QG 3.070 . 4.340 3.561 2.991 4.412 0.072 15 0 "[ . 1 . 2]" 1
1256 1 31 LEU HG 1 33 VAL QG 2.730 . 3.660 2.744 1.993 3.661 0.001 15 0 "[ . 1 . 2]" 1
1257 1 31 LEU MD1 1 57 VAL QG 3.440 . 5.080 3.960 3.432 4.207 . 0 0 "[ . 1 . 2]" 1
1258 1 31 LEU MD2 1 33 VAL QG 2.850 . 3.900 2.872 2.371 3.653 . 0 0 "[ . 1 . 2]" 1
1259 1 31 LEU MD2 1 57 VAL QG 2.910 . 4.020 2.636 2.073 3.119 . 0 0 "[ . 1 . 2]" 1
1260 1 31 LEU MD2 1 87 VAL QG 3.240 . 4.680 2.567 2.158 2.874 . 0 0 "[ . 1 . 2]" 1
1261 1 32 ASP HA 1 33 VAL QG 3.130 . 4.460 3.747 3.397 3.895 . 0 0 "[ . 1 . 2]" 1
1262 1 33 VAL H 1 33 VAL QG 2.580 . 3.360 2.344 1.976 2.727 . 0 0 "[ . 1 . 2]" 1
1263 1 33 VAL HA 1 57 VAL QG 3.720 . 5.640 3.832 3.659 4.159 . 0 0 "[ . 1 . 2]" 1
1264 1 33 VAL HB 1 87 VAL QG 2.920 . 4.040 3.029 2.302 3.811 . 0 0 "[ . 1 . 2]" 1
1265 1 33 VAL QG 1 34 PRO QB 3.550 . 5.300 3.957 3.761 4.237 . 0 0 "[ . 1 . 2]" 1
1266 1 33 VAL QG 1 34 PRO HD2 2.890 . 3.980 2.857 2.573 3.173 . 0 0 "[ . 1 . 2]" 1
1267 1 33 VAL QG 1 34 PRO HD3 2.950 . 4.100 3.584 3.463 3.713 . 0 0 "[ . 1 . 2]" 1
1268 1 33 VAL QG 1 37 ILE H 3.120 . 4.440 4.041 3.817 4.295 . 0 0 "[ . 1 . 2]" 1
1269 1 33 VAL QG 1 37 ILE HA 3.320 . 4.840 4.475 4.256 4.662 . 0 0 "[ . 1 . 2]" 1
1270 1 33 VAL QG 1 37 ILE HB 3.420 . 5.040 2.574 2.260 2.850 . 0 0 "[ . 1 . 2]" 1
1271 1 33 VAL QG 1 37 ILE MG 2.340 . 2.880 2.434 2.247 2.623 . 0 0 "[ . 1 . 2]" 1
1272 1 33 VAL QG 1 38 ALA H 2.580 . 3.360 2.788 2.678 2.882 . 0 0 "[ . 1 . 2]" 1
1273 1 33 VAL QG 1 38 ALA HA 2.890 . 3.980 2.482 2.320 2.714 . 0 0 "[ . 1 . 2]" 1
1274 1 33 VAL QG 1 38 ALA MB 2.500 . 3.200 2.088 1.983 2.207 . 0 0 "[ . 1 . 2]" 1
1275 1 33 VAL QG 1 39 VAL H 3.520 . 5.240 4.622 4.521 4.721 . 0 0 "[ . 1 . 2]" 1
1276 1 33 VAL QG 1 41 GLY H 3.940 . 6.080 5.159 5.007 5.463 . 0 0 "[ . 1 . 2]" 1
1277 1 33 VAL QG 1 44 VAL HB 3.480 . 5.160 3.862 3.434 4.225 . 0 0 "[ . 1 . 2]" 1
1278 1 33 VAL QG 1 44 VAL MG1 2.350 . 2.900 2.034 1.926 2.252 . 0 0 "[ . 1 . 2]" 1
1279 1 33 VAL QG 1 44 VAL MG2 2.830 . 3.860 2.394 1.726 3.130 0.074 11 0 "[ . 1 . 2]" 1
1280 1 33 VAL QG 1 57 VAL QG 3.110 . 4.420 1.764 1.674 1.912 0.126 18 0 "[ . 1 . 2]" 1
1281 1 33 VAL QG 1 67 LEU MD1 3.220 . 4.640 3.916 3.281 4.517 . 0 0 "[ . 1 . 2]" 1
1282 1 33 VAL QG 1 87 VAL HA 3.090 . 4.380 3.170 2.845 3.534 . 0 0 "[ . 1 . 2]" 1
1283 1 33 VAL QG 1 87 VAL QG 2.690 . 3.580 1.958 1.839 2.325 . 0 0 "[ . 1 . 2]" 1
1284 1 33 VAL QG 1 89 ILE MG 3.220 . 4.640 3.802 3.196 4.377 . 0 0 "[ . 1 . 2]" 1
1285 1 33 VAL QG 1 89 ILE MD 3.080 . 4.360 3.802 3.248 4.215 . 0 0 "[ . 1 . 2]" 1
1286 1 33 VAL QG 1 90 THR H 3.290 . 4.780 4.029 3.482 4.515 . 0 0 "[ . 1 . 2]" 1
1287 1 33 VAL QG 1 90 THR MG 3.650 . 5.500 4.423 3.736 5.206 . 0 0 "[ . 1 . 2]" 1
1288 1 34 PRO QB 1 36 PRO HD2 2.770 . 3.740 2.662 2.421 2.858 . 0 0 "[ . 1 . 2]" 1
1289 1 34 PRO QB 1 37 ILE H 3.120 . 4.440 2.638 2.410 2.772 . 0 0 "[ . 1 . 2]" 1
1290 1 34 PRO QB 1 37 ILE MD 3.220 . 4.640 2.782 2.563 2.946 . 0 0 "[ . 1 . 2]" 1
1291 1 34 PRO QG 1 37 ILE MD 2.690 . 3.580 2.116 2.012 2.249 . 0 0 "[ . 1 . 2]" 1
1292 1 34 PRO QG 1 44 VAL MG1 3.460 . 5.120 3.414 3.284 3.571 . 0 0 "[ . 1 . 2]" 1
1293 1 35 ALA MB 1 39 VAL QG 3.350 . 4.900 3.439 3.283 3.592 . 0 0 "[ . 1 . 2]" 1
1294 1 36 PRO HA 1 39 VAL QG 2.940 . 4.080 3.324 3.085 3.622 . 0 0 "[ . 1 . 2]" 1
1295 1 36 PRO HB2 1 39 VAL QG 3.970 . 6.140 5.352 5.142 5.608 . 0 0 "[ . 1 . 2]" 1
1296 1 37 ILE H 1 37 ILE QG 2.810 . 3.820 2.216 2.133 2.344 . 0 0 "[ . 1 . 2]" 1
1297 1 37 ILE H 1 39 VAL QG 3.510 . 5.220 4.985 4.839 5.217 . 0 0 "[ . 1 . 2]" 1
1298 1 37 ILE HA 1 37 ILE QG 2.860 . 3.920 2.419 2.369 2.455 . 0 0 "[ . 1 . 2]" 1
1299 1 37 ILE HA 1 40 VAL QG 2.640 . 3.480 2.179 1.914 2.565 . 0 0 "[ . 1 . 2]" 1
1300 1 37 ILE MG 1 40 VAL QG 2.900 . 4.000 3.503 3.173 3.920 . 0 0 "[ . 1 . 2]" 1
1301 1 37 ILE MG 1 57 VAL QG 2.510 . 3.220 2.456 2.065 2.817 . 0 0 "[ . 1 . 2]" 1
1302 1 37 ILE QG 1 44 VAL MG1 3.490 . 5.180 3.900 3.746 4.174 . 0 0 "[ . 1 . 2]" 1
1303 1 37 ILE MD 1 40 VAL QG 3.450 . 5.100 4.695 4.474 5.006 . 0 0 "[ . 1 . 2]" 1
1304 1 38 ALA H 1 39 VAL QG 3.160 . 4.520 3.961 3.877 4.076 . 0 0 "[ . 1 . 2]" 1
1305 1 38 ALA H 1 40 VAL QG 3.490 . 5.180 4.299 4.091 4.612 . 0 0 "[ . 1 . 2]" 1
1306 1 38 ALA HA 1 57 VAL QG 2.860 . 3.920 2.202 1.920 2.832 . 0 0 "[ . 1 . 2]" 1
1307 1 38 ALA MB 1 39 VAL QG 2.970 . 4.140 2.904 2.723 3.081 . 0 0 "[ . 1 . 2]" 1
1308 1 38 ALA MB 1 40 VAL QG 3.820 . 5.840 4.963 4.762 5.275 . 0 0 "[ . 1 . 2]" 1
1309 1 38 ALA MB 1 57 VAL QG 2.970 . 4.140 3.221 2.895 3.518 . 0 0 "[ . 1 . 2]" 1
1310 1 38 ALA MB 1 87 VAL QG 3.140 . 4.480 3.529 3.223 3.889 . 0 0 "[ . 1 . 2]" 1
1311 1 39 VAL H 1 39 VAL QG 2.360 . 2.920 2.135 2.046 2.262 . 0 0 "[ . 1 . 2]" 1
1312 1 39 VAL HA 1 39 VAL QG 2.360 . 2.920 2.190 2.178 2.205 . 0 0 "[ . 1 . 2]" 1
1313 1 39 VAL QG 1 40 VAL H 2.470 . 3.140 3.116 2.984 3.257 0.117 11 0 "[ . 1 . 2]" 1
1314 1 39 VAL QG 1 40 VAL HA 2.780 . 3.760 3.333 3.141 3.554 . 0 0 "[ . 1 . 2]" 1
1315 1 39 VAL QG 1 41 GLY H 3.730 . 5.660 4.535 4.434 4.616 . 0 0 "[ . 1 . 2]" 1
1316 1 39 VAL QG 1 59 PRO HA 3.840 . 5.880 5.077 4.786 5.343 . 0 0 "[ . 1 . 2]" 1
1317 1 39 VAL QG 1 59 PRO HB3 4.170 . 6.540 5.461 4.914 6.206 . 0 0 "[ . 1 . 2]" 1
1318 1 39 VAL QG 1 60 ARG H 2.910 . 4.020 3.866 3.645 4.089 0.069 10 0 "[ . 1 . 2]" 1
1319 1 39 VAL QG 1 60 ARG QG 2.930 . 4.060 3.160 2.536 3.864 . 0 0 "[ . 1 . 2]" 1
1320 1 39 VAL QG 1 60 ARG QD 3.450 . 5.100 4.514 3.634 5.249 0.149 2 0 "[ . 1 . 2]" 1
1321 1 39 VAL QG 1 89 ILE MG 3.620 . 5.440 4.414 4.191 4.732 . 0 0 "[ . 1 . 2]" 1
1322 1 39 VAL QG 1 89 ILE MD 3.630 . 5.460 3.817 3.530 4.098 . 0 0 "[ . 1 . 2]" 1
1323 1 40 VAL H 1 40 VAL QG 2.380 . 2.960 2.080 1.967 2.294 . 0 0 "[ . 1 . 2]" 1
1324 1 40 VAL HA 1 40 VAL QG 2.350 . 2.900 2.338 2.261 2.392 . 0 0 "[ . 1 . 2]" 1
1325 1 40 VAL QG 1 41 GLY H 2.600 . 3.400 2.525 2.393 2.777 . 0 0 "[ . 1 . 2]" 1
1326 1 40 VAL QG 1 59 PRO HA 3.650 . 5.500 4.625 4.420 4.818 . 0 0 "[ . 1 . 2]" 1
1327 1 41 GLY H 1 57 VAL QG 3.690 . 5.580 4.105 3.664 4.745 . 0 0 "[ . 1 . 2]" 1
1328 1 41 GLY HA2 1 57 VAL QG 2.900 . 4.000 2.931 2.420 3.573 . 0 0 "[ . 1 . 2]" 1
1329 1 41 GLY HA3 1 59 PRO QG 3.620 . 5.440 3.211 2.155 4.520 . 0 0 "[ . 1 . 2]" 1
1330 1 42 GLY H 1 57 VAL QG 2.650 . 3.500 3.297 2.891 3.564 0.064 3 0 "[ . 1 . 2]" 1
1331 1 42 GLY HA3 1 57 VAL QG 3.260 . 4.720 4.498 4.177 4.817 0.097 18 0 "[ . 1 . 2]" 1
1332 1 43 LYS H 1 57 VAL QG 3.240 . 4.680 4.362 3.995 4.795 0.115 19 0 "[ . 1 . 2]" 1
1333 1 43 LYS HA 1 57 VAL QG 3.150 . 4.500 2.854 2.589 3.112 . 0 0 "[ . 1 . 2]" 1
1334 1 43 LYS HB2 1 57 VAL QG 3.600 . 5.400 5.317 5.038 5.533 0.133 19 0 "[ . 1 . 2]" 1
1335 1 43 LYS QE 1 43 LYS HG3 2.740 . 3.680 2.742 2.422 3.101 . 0 0 "[ . 1 . 2]" 1
1336 1 44 VAL H 1 57 VAL QG 3.110 . 4.420 2.892 2.622 3.169 . 0 0 "[ . 1 . 2]" 1
1337 1 44 VAL MG1 1 57 VAL QG 2.220 . 2.640 2.286 1.989 2.710 0.070 15 0 "[ . 1 . 2]" 1
1338 1 44 VAL MG2 1 57 VAL QG 2.660 . 3.520 2.026 1.931 2.104 . 0 0 "[ . 1 . 2]" 1
1339 1 45 ARG HA 1 45 ARG QD 3.350 . 4.900 4.153 4.034 4.282 . 0 0 "[ . 1 . 2]" 1
1340 1 45 ARG HA 1 54 GLU QG 3.410 . 5.020 3.437 2.657 4.135 . 0 0 "[ . 1 . 2]" 1
1341 1 45 ARG HB2 1 45 ARG QD 2.870 . 3.940 2.723 2.364 2.968 . 0 0 "[ . 1 . 2]" 1
1342 1 45 ARG HG2 1 54 GLU QG 3.360 . 4.920 3.842 1.915 5.018 0.098 8 0 "[ . 1 . 2]" 1
1343 1 45 ARG QD 1 53 VAL H 4.350 . 6.900 5.056 4.147 6.407 . 0 0 "[ . 1 . 2]" 1
1344 1 45 ARG QD 1 54 GLU QG 3.770 . 5.740 4.008 2.696 4.814 . 0 0 "[ . 1 . 2]" 1
1345 1 46 ALA H 1 54 GLU QG 4.030 . 6.260 4.903 4.281 5.408 . 0 0 "[ . 1 . 2]" 1
1346 1 46 ALA HA 1 47 MET QB 3.560 . 5.320 4.286 4.005 4.493 . 0 0 "[ . 1 . 2]" 1
1347 1 47 MET H 1 47 MET QB 2.650 . 3.500 2.420 2.303 2.557 . 0 0 "[ . 1 . 2]" 1
1348 1 47 MET H 1 47 MET QG 3.250 . 4.700 3.278 2.486 4.144 . 0 0 "[ . 1 . 2]" 1
1349 1 47 MET QB 1 47 MET ME 3.070 . 4.340 2.664 2.169 3.167 . 0 0 "[ . 1 . 2]" 1
1350 1 47 MET QB 1 48 THR H 3.020 . 4.240 3.639 3.251 3.960 . 0 0 "[ . 1 . 2]" 1
1351 1 47 MET ME 1 47 MET QG 2.610 . 3.410 2.481 2.364 2.556 . 0 0 "[ . 1 . 2]" 1
1352 1 47 MET QG 1 48 THR H 3.400 . 5.000 4.116 3.096 4.832 . 0 0 "[ . 1 . 2]" 1
1353 1 47 MET ME 1 51 GLY QA 3.050 . 4.290 3.338 2.725 4.221 . 0 0 "[ . 1 . 2]" 1
1354 1 48 THR HB 1 49 LEU QB 3.870 . 5.940 4.178 4.030 4.341 . 0 0 "[ . 1 . 2]" 1
1355 1 49 LEU H 1 49 LEU QB 2.870 . 3.940 2.602 2.549 2.665 . 0 0 "[ . 1 . 2]" 1
1356 1 49 LEU QB 1 49 LEU MD1 2.610 . 3.410 2.148 2.128 2.165 . 0 0 "[ . 1 . 2]" 1
1357 1 49 LEU QB 1 49 LEU MD2 2.620 . 3.440 2.516 2.465 2.579 . 0 0 "[ . 1 . 2]" 1
1358 1 49 LEU QB 1 50 GLU H 2.790 . 3.780 3.094 2.672 3.402 . 0 0 "[ . 1 . 2]" 1
1359 1 49 LEU QB 1 74 PHE HE1 3.610 . 5.420 3.499 1.875 4.741 . 0 0 "[ . 1 . 2]" 1
1360 1 50 GLU H 1 50 GLU QB 2.590 . 3.380 2.485 2.197 2.857 . 0 0 "[ . 1 . 2]" 1
1361 1 50 GLU H 1 50 GLU QG 3.310 . 4.820 3.013 1.781 4.113 0.019 15 0 "[ . 1 . 2]" 1
1362 1 50 GLU H 1 51 GLY QA 3.630 . 5.460 4.352 4.173 4.466 . 0 0 "[ . 1 . 2]" 1
1363 1 50 GLU HA 1 50 GLU QG 2.780 . 3.760 2.800 2.381 3.393 . 0 0 "[ . 1 . 2]" 1
1364 1 50 GLU QB 1 51 GLY H 3.190 . 4.580 3.302 3.011 3.862 . 0 0 "[ . 1 . 2]" 1
1365 1 54 GLU H 1 54 GLU QG 3.000 . 4.200 2.605 2.216 3.058 . 0 0 "[ . 1 . 2]" 1
1366 1 54 GLU QG 1 55 VAL H 3.750 . 5.700 4.332 3.940 4.542 . 0 0 "[ . 1 . 2]" 1
1367 1 56 ALA H 1 57 VAL QG 3.930 . 6.060 4.800 4.663 4.930 . 0 0 "[ . 1 . 2]" 1
1368 1 56 ALA HA 1 57 VAL QG 2.850 . 3.900 3.696 3.554 3.845 . 0 0 "[ . 1 . 2]" 1
1369 1 56 ALA MB 1 57 VAL QG 3.500 . 5.200 4.437 4.380 4.506 . 0 0 "[ . 1 . 2]" 1
1370 1 57 VAL H 1 57 VAL QG 2.490 . 3.190 2.101 1.975 2.264 . 0 0 "[ . 1 . 2]" 1
1371 1 57 VAL HA 1 57 VAL QG 2.510 . 3.220 2.205 2.193 2.215 . 0 0 "[ . 1 . 2]" 1
1372 1 57 VAL QG 1 58 PRO HG2 3.510 . 5.220 3.476 3.172 3.737 . 0 0 "[ . 1 . 2]" 1
1373 1 57 VAL QG 1 58 PRO HD2 2.740 . 3.680 2.563 2.366 2.797 . 0 0 "[ . 1 . 2]" 1
1374 1 57 VAL QG 1 59 PRO HA 4.220 . 6.640 4.378 4.026 4.777 . 0 0 "[ . 1 . 2]" 1
1375 1 57 VAL QG 1 61 THR HB 2.820 . 3.850 2.687 2.426 3.131 . 0 0 "[ . 1 . 2]" 1
1376 1 57 VAL QG 1 61 THR MG 2.920 . 4.040 2.555 2.300 2.846 . 0 0 "[ . 1 . 2]" 1
1377 1 57 VAL QG 1 67 LEU MD1 2.740 . 3.680 3.146 2.523 3.627 . 0 0 "[ . 1 . 2]" 1
1378 1 57 VAL QG 1 67 LEU MD2 3.250 . 4.700 4.014 3.407 4.427 . 0 0 "[ . 1 . 2]" 1
1379 1 57 VAL QG 1 87 VAL QG 3.180 . 4.560 3.072 2.387 3.455 . 0 0 "[ . 1 . 2]" 1
1380 1 58 PRO HA 1 59 PRO QG 3.310 . 4.820 3.974 3.845 4.159 . 0 0 "[ . 1 . 2]" 1
1381 1 58 PRO QB 1 59 PRO QD 2.590 . 3.380 2.730 2.428 3.087 . 0 0 "[ . 1 . 2]" 1
1382 1 60 ARG H 1 60 ARG QB 2.870 . 3.940 3.407 3.308 3.465 . 0 0 "[ . 1 . 2]" 1
1383 1 60 ARG H 1 60 ARG QG 2.670 . 3.540 2.839 2.664 2.971 . 0 0 "[ . 1 . 2]" 1
1384 1 60 ARG HA 1 60 ARG QG 2.760 . 3.720 2.512 2.429 2.583 . 0 0 "[ . 1 . 2]" 1
1385 1 60 ARG HA 1 60 ARG QD 3.090 . 4.380 4.164 4.062 4.305 . 0 0 "[ . 1 . 2]" 1
1386 1 60 ARG QB 1 60 ARG QD 2.530 . 3.260 2.343 2.154 2.468 . 0 0 "[ . 1 . 2]" 1
1387 1 60 ARG QB 1 61 THR HA 4.030 . 6.270 4.472 4.313 4.577 . 0 0 "[ . 1 . 2]" 1
1388 1 61 THR MG 1 65 ARG QG 2.630 . 3.460 3.247 2.342 3.533 0.073 9 0 "[ . 1 . 2]" 1
1389 1 62 GLN H 1 65 ARG QG 2.910 . 4.020 2.628 1.985 3.150 . 0 0 "[ . 1 . 2]" 1
1390 1 62 GLN H 1 87 VAL QG 3.500 . 5.200 4.182 3.870 4.457 . 0 0 "[ . 1 . 2]" 1
1391 1 63 ALA HA 1 64 GLY QA 3.260 . 4.720 3.991 3.945 4.048 . 0 0 "[ . 1 . 2]" 1
1392 1 63 ALA HA 1 87 VAL QG 2.730 . 3.660 2.696 2.250 3.439 . 0 0 "[ . 1 . 2]" 1
1393 1 63 ALA MB 1 64 GLY QA 3.140 . 4.480 3.817 3.687 3.895 . 0 0 "[ . 1 . 2]" 1
1394 1 63 ALA MB 1 87 VAL QG 3.250 . 4.700 3.798 3.444 4.449 . 0 0 "[ . 1 . 2]" 1
1395 1 64 GLY H 1 87 VAL QG 2.810 . 3.820 3.449 2.918 3.826 0.006 20 0 "[ . 1 . 2]" 1
1396 1 64 GLY QA 1 87 VAL QG 3.820 . 5.840 4.665 4.264 4.981 . 0 0 "[ . 1 . 2]" 1
1397 1 65 ARG H 1 65 ARG QG 2.680 . 3.560 2.787 2.463 3.135 . 0 0 "[ . 1 . 2]" 1
1398 1 65 ARG H 1 87 VAL QG 2.870 . 3.940 3.390 2.987 3.786 . 0 0 "[ . 1 . 2]" 1
1399 1 65 ARG HA 1 65 ARG QG 2.900 . 4.000 2.338 2.245 2.375 . 0 0 "[ . 1 . 2]" 1
1400 1 65 ARG HB2 1 87 VAL QG 2.400 . 3.000 2.437 2.098 2.922 . 0 0 "[ . 1 . 2]" 1
1401 1 65 ARG HB3 1 87 VAL QG 3.270 . 4.740 2.893 2.593 3.453 . 0 0 "[ . 1 . 2]" 1
1402 1 65 ARG QG 1 66 LYS H 3.540 . 5.280 3.572 3.232 3.818 . 0 0 "[ . 1 . 2]" 1
1403 1 65 ARG QG 1 87 VAL QG 2.960 . 4.120 3.737 3.291 4.151 0.031 18 0 "[ . 1 . 2]" 1
1404 1 65 ARG HD3 1 87 VAL QG 3.160 . 4.520 3.983 3.527 4.477 . 0 0 "[ . 1 . 2]" 1
1405 1 66 LYS H 1 66 LYS QE 3.640 . 5.480 4.635 4.244 4.789 . 0 0 "[ . 1 . 2]" 1
1406 1 66 LYS H 1 87 VAL QG 3.250 . 4.700 4.036 3.843 4.370 . 0 0 "[ . 1 . 2]" 1
1407 1 66 LYS HB2 1 66 LYS QD 2.890 . 3.980 2.477 2.400 2.539 . 0 0 "[ . 1 . 2]" 1
1408 1 67 LEU H 1 67 LEU QB 2.840 . 3.880 2.599 2.463 2.687 . 0 0 "[ . 1 . 2]" 1
1409 1 67 LEU H 1 87 VAL QG 3.140 . 4.480 3.590 3.239 3.909 . 0 0 "[ . 1 . 2]" 1
1410 1 67 LEU QB 1 67 LEU MD1 2.540 . 3.280 2.134 2.125 2.145 . 0 0 "[ . 1 . 2]" 1
1411 1 67 LEU HG 1 87 VAL QG 2.530 . 3.260 2.137 2.019 2.303 . 0 0 "[ . 1 . 2]" 1
1412 1 67 LEU MD1 1 87 VAL QG 2.340 . 2.880 2.331 2.192 2.532 . 0 0 "[ . 1 . 2]" 1
1413 1 67 LEU MD2 1 87 VAL QG 2.920 . 4.040 2.783 2.514 3.182 . 0 0 "[ . 1 . 2]" 1
1414 1 69 LEU H 1 69 LEU QB 2.800 . 3.800 2.434 2.325 2.519 . 0 0 "[ . 1 . 2]" 1
1415 1 69 LEU QB 1 69 LEU MD1 2.590 . 3.380 2.150 2.125 2.172 . 0 0 "[ . 1 . 2]" 1
1416 1 69 LEU QB 1 69 LEU MD2 2.740 . 3.680 2.309 2.263 2.352 . 0 0 "[ . 1 . 2]" 1
1417 1 69 LEU QB 1 72 LYS H 3.200 . 4.600 4.084 3.833 4.442 . 0 0 "[ . 1 . 2]" 1
1418 1 69 LEU QB 1 72 LYS QG 3.220 . 4.640 2.882 1.863 3.668 . 0 0 "[ . 1 . 2]" 1
1419 1 69 LEU QB 1 73 GLY H 3.580 . 5.360 4.757 4.131 5.146 . 0 0 "[ . 1 . 2]" 1
1420 1 69 LEU QB 1 73 GLY HA2 3.680 . 5.560 4.577 4.094 4.932 . 0 0 "[ . 1 . 2]" 1
1421 1 69 LEU QB 1 82 ASP HA 3.260 . 4.720 4.081 3.710 4.440 . 0 0 "[ . 1 . 2]" 1
1422 1 69 LEU QB 1 83 LEU H 3.000 . 4.200 2.476 2.223 2.887 . 0 0 "[ . 1 . 2]" 1
1423 1 69 LEU MD1 1 72 LYS QB 3.150 . 4.510 3.479 3.087 4.085 . 0 0 "[ . 1 . 2]" 1
1424 1 69 LEU MD2 1 72 LYS QB 3.170 . 4.540 3.657 3.317 3.991 . 0 0 "[ . 1 . 2]" 1
1425 1 70 LYS H 1 70 LYS QD 3.640 . 5.480 4.152 3.886 4.468 . 0 0 "[ . 1 . 2]" 1
1426 1 70 LYS H 1 70 LYS QE 3.900 . 6.000 4.548 3.528 5.319 . 0 0 "[ . 1 . 2]" 1
1427 1 70 LYS HA 1 70 LYS QD 3.140 . 4.480 4.011 3.936 4.230 . 0 0 "[ . 1 . 2]" 1
1428 1 70 LYS HB2 1 70 LYS QE 3.550 . 5.300 3.611 2.041 4.318 . 0 0 "[ . 1 . 2]" 1
1429 1 70 LYS HB3 1 70 LYS QE 3.700 . 5.600 3.656 2.014 4.195 . 0 0 "[ . 1 . 2]" 1
1430 1 70 LYS QD 1 70 LYS HG2 2.350 . 2.900 2.332 2.174 2.501 . 0 0 "[ . 1 . 2]" 1
1431 1 70 LYS QE 1 70 LYS HG2 2.950 . 4.100 2.822 2.399 3.558 . 0 0 "[ . 1 . 2]" 1
1432 1 70 LYS QE 1 70 LYS HG3 2.860 . 3.920 2.669 2.391 3.569 . 0 0 "[ . 1 . 2]" 1
1433 1 70 LYS QD 1 71 GLY HA3 3.940 . 6.080 6.200 5.873 6.429 0.349 4 0 "[ . 1 . 2]" 1
1434 1 72 LYS H 1 72 LYS QG 2.870 . 3.940 3.163 2.919 3.537 . 0 0 "[ . 1 . 2]" 1
1435 1 72 LYS QB 1 73 GLY H 3.070 . 4.340 3.555 2.534 3.961 . 0 0 "[ . 1 . 2]" 1
1436 1 72 LYS QB 1 83 LEU H 3.220 . 4.640 3.709 3.107 4.342 . 0 0 "[ . 1 . 2]" 1
1437 1 72 LYS QG 1 73 GLY H 3.580 . 5.360 4.625 4.068 4.938 . 0 0 "[ . 1 . 2]" 1
1438 1 72 LYS QG 1 82 ASP HA 4.050 . 6.300 5.238 4.750 6.161 . 0 0 "[ . 1 . 2]" 1
1439 1 73 GLY H 1 81 GLY QA 3.170 . 4.540 3.823 3.463 4.136 . 0 0 "[ . 1 . 2]" 1
1440 1 73 GLY H 1 82 ASP QB 3.570 . 5.340 4.852 4.251 5.400 0.060 18 0 "[ . 1 . 2]" 1
1441 1 74 PHE H 1 74 PHE QB 2.810 . 3.820 2.171 2.074 2.303 . 0 0 "[ . 1 . 2]" 1
1442 1 74 PHE QB 1 75 PRO QD 3.140 . 4.480 3.139 2.673 3.554 . 0 0 "[ . 1 . 2]" 1
1443 1 74 PHE QB 1 81 GLY QA 3.210 . 4.620 3.485 2.917 4.139 . 0 0 "[ . 1 . 2]" 1
1444 1 74 PHE HD1 1 75 PRO QD 3.200 . 4.600 4.255 3.402 4.678 0.078 20 0 "[ . 1 . 2]" 1
1445 1 75 PRO HA 1 80 ARG QD 3.390 . 4.980 3.037 2.100 3.673 . 0 0 "[ . 1 . 2]" 1
1446 1 75 PRO HB3 1 80 ARG QD 3.520 . 5.240 4.284 3.035 5.314 0.074 13 0 "[ . 1 . 2]" 1
1447 1 76 GLY H 1 80 ARG QD 3.200 . 4.600 4.085 3.413 4.831 0.231 7 0 "[ . 1 . 2]" 1
1448 1 78 ALA MB 1 79 GLY QA 3.170 . 4.540 3.796 3.632 4.069 . 0 0 "[ . 1 . 2]" 1
1449 1 79 GLY H 1 79 GLY QA 2.310 . 2.820 2.478 2.346 2.510 . 0 0 "[ . 1 . 2]" 1
1450 1 79 GLY QA 1 80 ARG H 2.400 . 3.000 2.181 2.117 2.257 . 0 0 "[ . 1 . 2]" 1
1451 1 80 ARG HB3 1 80 ARG QD 2.650 . 3.500 2.376 2.241 2.507 . 0 0 "[ . 1 . 2]" 1
1452 1 81 GLY QA 1 82 ASP HA 3.360 . 4.920 3.998 3.959 4.018 . 0 0 "[ . 1 . 2]" 1
1453 1 82 ASP H 1 82 ASP QB 2.780 . 3.760 2.756 2.408 3.237 . 0 0 "[ . 1 . 2]" 1
1454 1 82 ASP QB 1 83 LEU H 2.930 . 4.060 2.982 2.392 3.419 . 0 0 "[ . 1 . 2]" 1
1455 1 84 TYR QB 1 85 LEU H 3.160 . 4.520 3.926 3.786 3.988 . 0 0 "[ . 1 . 2]" 1
1456 1 85 LEU QB 1 85 LEU MD1 2.550 . 3.300 2.132 2.114 2.147 . 0 0 "[ . 1 . 2]" 1
1457 1 85 LEU QB 1 86 GLU H 3.310 . 4.820 3.398 2.941 3.610 . 0 0 "[ . 1 . 2]" 1
1458 1 86 GLU HA 1 87 VAL QG 3.060 . 4.320 3.688 3.523 3.898 . 0 0 "[ . 1 . 2]" 1
1459 1 87 VAL H 1 87 VAL QG 2.580 . 3.360 2.117 1.989 2.288 . 0 0 "[ . 1 . 2]" 1
1460 1 87 VAL HA 1 87 VAL QG 2.580 . 3.360 2.183 2.154 2.202 . 0 0 "[ . 1 . 2]" 1
1461 1 87 VAL QG 1 88 ARG H 2.680 . 3.560 3.010 2.755 3.206 . 0 0 "[ . 1 . 2]" 1
1462 1 87 VAL QG 1 89 ILE HA 3.220 . 4.640 3.842 3.634 4.122 . 0 0 "[ . 1 . 2]" 1
1463 1 87 VAL QG 1 89 ILE MG 3.610 . 5.420 4.621 4.366 4.883 . 0 0 "[ . 1 . 2]" 1
1464 1 87 VAL QG 1 89 ILE HG12 3.360 . 4.920 3.218 2.864 3.642 . 0 0 "[ . 1 . 2]" 1
1465 1 87 VAL QG 1 89 ILE HG13 3.510 . 5.220 2.614 2.193 2.926 . 0 0 "[ . 1 . 2]" 1
1466 1 87 VAL QG 1 89 ILE MD 3.070 . 4.340 3.415 2.985 3.750 . 0 0 "[ . 1 . 2]" 1
1467 1 88 ARG H 1 88 ARG QD 3.290 . 4.780 3.788 3.313 4.156 . 0 0 "[ . 1 . 2]" 1
1468 1 88 ARG HA 1 88 ARG QD 3.020 . 4.240 2.211 2.076 2.469 . 0 0 "[ . 1 . 2]" 1
1469 1 88 ARG HB3 1 88 ARG QD 2.930 . 4.070 2.895 2.474 3.203 . 0 0 "[ . 1 . 2]" 1
1470 1 4 VAL H 1 68 ARG H 3.650 . 5.500 5.438 5.237 5.642 0.142 5 0 "[ . 1 . 2]" 1
1471 1 9 TYR QD 1 69 LEU CD1 3.100 . 4.400 2.788 2.648 3.216 . 0 0 "[ . 1 . 2]" 1
1472 1 9 TYR QD 1 55 VAL CG1 3.650 . 5.500 4.885 4.143 5.389 . 0 0 "[ . 1 . 2]" 1
1473 1 4 VAL CG2 1 84 TYR QE 3.100 . 4.400 4.624 4.514 4.709 0.309 4 0 "[ . 1 . 2]" 1
1474 1 7 ALA MB 1 67 LEU QD 2.510 . 3.220 1.767 1.713 1.845 0.087 16 0 "[ . 1 . 2]" 1
1475 1 7 ALA MB 1 69 LEU QD 2.370 . 2.940 2.125 1.958 2.442 . 0 0 "[ . 1 . 2]" 1
1476 1 7 ALA MB 1 9 TYR QD 3.650 . 5.500 5.429 4.721 5.604 0.104 10 0 "[ . 1 . 2]" 1
1477 1 5 ILE MG 1 58 PRO QD 3.080 . 4.360 3.724 3.401 4.015 . 0 0 "[ . 1 . 2]" 1
1478 1 5 ILE MG 1 65 ARG QD 2.950 . 4.100 2.449 1.856 3.228 . 0 0 "[ . 1 . 2]" 1
1479 1 5 ILE MG 1 66 LYS QG 3.740 . 5.680 4.253 3.593 5.056 . 0 0 "[ . 1 . 2]" 1
1480 1 5 ILE MG 1 67 LEU QD 2.750 . 3.700 1.995 1.840 2.135 . 0 0 "[ . 1 . 2]" 1
1481 1 5 ILE MD 1 65 ARG QD 3.680 . 5.560 3.406 2.476 4.092 . 0 0 "[ . 1 . 2]" 1
1482 1 5 ILE MD 1 67 LEU QD 2.970 . 4.140 3.813 3.460 4.093 . 0 0 "[ . 1 . 2]" 1
1483 1 7 ALA H 1 67 LEU QD 3.510 . 5.220 4.136 3.751 4.560 . 0 0 "[ . 1 . 2]" 1
1484 1 7 ALA H 1 69 LEU QD 3.330 . 4.860 3.670 3.202 4.118 . 0 0 "[ . 1 . 2]" 1
1485 1 7 ALA MB 1 8 ASP QB 3.690 . 5.580 4.356 4.173 4.500 . 0 0 "[ . 1 . 2]" 1
1486 1 7 ALA MB 1 55 VAL QG 2.460 . 3.120 2.798 2.321 3.104 . 0 0 "[ . 1 . 2]" 1
1487 1 8 ASP H 1 8 ASP QB 2.590 . 3.380 2.778 2.628 2.874 . 0 0 "[ . 1 . 2]" 1
1488 1 8 ASP H 1 55 VAL QG 3.180 . 4.560 3.523 3.187 3.979 . 0 0 "[ . 1 . 2]" 1
1489 1 8 ASP H 1 67 LEU QD 3.810 . 5.820 4.477 4.163 4.786 . 0 0 "[ . 1 . 2]" 1
1490 1 8 ASP QB 1 9 TYR H 3.060 . 4.320 3.469 3.098 3.903 . 0 0 "[ . 1 . 2]" 1
1491 1 8 ASP QB 1 56 ALA MB 3.290 . 4.780 3.359 2.749 4.088 . 0 0 "[ . 1 . 2]" 1
1492 1 9 TYR H 1 53 VAL QG 4.240 . 6.680 5.449 5.107 5.769 . 0 0 "[ . 1 . 2]" 1
1493 1 9 TYR H 1 55 VAL QG 3.140 . 4.480 4.111 3.630 4.485 0.005 2 0 "[ . 1 . 2]" 1
1494 1 9 TYR H 1 69 LEU QD 3.530 . 5.260 3.086 2.240 3.408 . 0 0 "[ . 1 . 2]" 1
1495 1 9 TYR HA 1 55 VAL QG 2.950 . 4.100 3.385 3.043 3.879 . 0 0 "[ . 1 . 2]" 1
1496 1 9 TYR HB2 1 53 VAL QG 2.730 . 3.660 2.975 2.769 3.174 . 0 0 "[ . 1 . 2]" 1
1497 1 9 TYR HB2 1 55 VAL QG 2.810 . 3.820 2.577 2.279 2.794 . 0 0 "[ . 1 . 2]" 1
1498 1 9 TYR HB2 1 69 LEU QD 3.240 . 4.680 4.016 3.550 4.487 . 0 0 "[ . 1 . 2]" 1
1499 1 9 TYR HB3 1 53 VAL QG 3.190 . 4.580 3.551 3.217 3.859 . 0 0 "[ . 1 . 2]" 1
1500 1 9 TYR HB3 1 55 VAL QG 2.850 . 3.900 1.967 1.790 2.211 0.010 9 0 "[ . 1 . 2]" 1
1501 1 9 TYR HB3 1 69 LEU QD 3.010 . 4.220 2.808 2.344 3.395 . 0 0 "[ . 1 . 2]" 1
1502 1 9 TYR HD1 1 53 VAL QG 3.030 . 4.260 3.922 2.931 4.437 0.177 12 0 "[ . 1 . 2]" 1
1503 1 9 TYR HD1 1 55 VAL QG 3.070 . 4.340 3.144 2.331 3.665 . 0 0 "[ . 1 . 2]" 1
1504 1 9 TYR HD1 1 69 LEU QD 2.690 . 3.580 1.759 1.641 2.093 0.159 20 0 "[ . 1 . 2]" 1
1505 1 9 TYR HE1 1 53 VAL QG 3.590 . 5.380 4.107 3.107 4.798 . 0 0 "[ . 1 . 2]" 1
1506 1 9 TYR HE2 1 53 VAL QG 2.810 . 3.820 2.467 1.940 2.907 . 0 0 "[ . 1 . 2]" 1
1507 1 9 TYR HD2 1 53 VAL QG 2.600 . 3.400 2.816 2.398 3.218 . 0 0 "[ . 1 . 2]" 1
1508 1 10 LYS H 1 10 LYS QB 2.780 . 3.760 2.746 2.654 2.823 . 0 0 "[ . 1 . 2]" 1
1509 1 10 LYS H 1 53 VAL QG 2.840 . 3.880 4.068 3.968 4.207 0.327 20 0 "[ . 1 . 2]" 1
1510 1 10 LYS H 1 54 GLU QB 3.220 . 4.640 3.460 3.140 3.913 . 0 0 "[ . 1 . 2]" 1
1511 1 10 LYS H 1 69 LEU QD 3.990 . 6.180 5.446 5.046 5.864 . 0 0 "[ . 1 . 2]" 1
1512 1 10 LYS QB 1 11 PRO HD2 2.810 . 3.820 2.686 2.216 3.067 . 0 0 "[ . 1 . 2]" 1
1513 1 10 LYS QB 1 11 PRO HD3 3.100 . 4.400 3.835 3.335 4.162 . 0 0 "[ . 1 . 2]" 1
1514 1 10 LYS QD 1 10 LYS QE 2.190 . 2.580 2.073 2.010 2.117 . 0 0 "[ . 1 . 2]" 1
1515 1 11 PRO HA 1 53 VAL QG 2.780 . 3.760 1.896 1.751 2.187 0.049 2 0 "[ . 1 . 2]" 1
1516 1 11 PRO QB 1 53 VAL QG 3.750 . 5.700 3.046 2.565 3.502 . 0 0 "[ . 1 . 2]" 1
1517 1 12 ALA H 1 53 VAL QG 2.710 . 3.620 2.896 2.526 3.133 . 0 0 "[ . 1 . 2]" 1
1518 1 12 ALA H 1 54 GLU QG 3.030 . 4.260 3.983 3.513 4.322 0.062 9 0 "[ . 1 . 2]" 1
1519 1 12 ALA MB 1 45 ARG QG 2.890 . 3.980 3.085 2.477 3.650 . 0 0 "[ . 1 . 2]" 1
1520 1 12 ALA MB 1 53 VAL QG 2.950 . 4.100 3.811 3.596 4.038 . 0 0 "[ . 1 . 2]" 1
1521 1 12 ALA MB 1 54 GLU QB 3.120 . 4.440 3.586 3.020 4.489 0.049 5 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 54
_Distance_constraint_stats_list.Viol_count 138
_Distance_constraint_stats_list.Viol_total 82.902
_Distance_constraint_stats_list.Viol_max 0.136
_Distance_constraint_stats_list.Viol_rms 0.0138
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0038
_Distance_constraint_stats_list.Viol_average_violations_only 0.0300
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 25 GLN 0.414 0.102 6 0 "[ . 1 . 2]"
1 27 LEU 0.108 0.050 4 0 "[ . 1 . 2]"
1 29 ALA 0.539 0.105 9 0 "[ . 1 . 2]"
1 31 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 33 VAL 0.035 0.018 20 0 "[ . 1 . 2]"
1 34 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 35 ALA 0.558 0.096 18 0 "[ . 1 . 2]"
1 36 PRO 0.017 0.017 11 0 "[ . 1 . 2]"
1 37 ILE 0.110 0.050 2 0 "[ . 1 . 2]"
1 38 ALA 0.007 0.007 15 0 "[ . 1 . 2]"
1 39 VAL 0.587 0.096 18 0 "[ . 1 . 2]"
1 40 VAL 0.017 0.017 11 0 "[ . 1 . 2]"
1 41 GLY 0.110 0.050 2 0 "[ . 1 . 2]"
1 42 GLY 0.273 0.035 11 0 "[ . 1 . 2]"
1 44 VAL 0.315 0.050 20 0 "[ . 1 . 2]"
1 46 ALA 0.175 0.032 20 0 "[ . 1 . 2]"
1 53 VAL 0.175 0.032 20 0 "[ . 1 . 2]"
1 55 VAL 0.315 0.050 20 0 "[ . 1 . 2]"
1 57 VAL 0.273 0.035 11 0 "[ . 1 . 2]"
1 60 ARG 0.029 0.025 9 0 "[ . 1 . 2]"
1 61 THR 0.007 0.007 15 0 "[ . 1 . 2]"
1 64 GLY 0.075 0.037 1 0 "[ . 1 . 2]"
1 65 ARG 0.110 0.050 19 0 "[ . 1 . 2]"
1 67 LEU 0.013 0.007 10 0 "[ . 1 . 2]"
1 69 LEU 0.908 0.136 18 0 "[ . 1 . 2]"
1 73 GLY 0.198 0.061 6 0 "[ . 1 . 2]"
1 74 PHE 0.675 0.102 6 0 "[ . 1 . 2]"
1 81 GLY 0.459 0.066 3 0 "[ . 1 . 2]"
1 82 ASP 0.102 0.050 4 0 "[ . 1 . 2]"
1 83 LEU 0.908 0.136 18 0 "[ . 1 . 2]"
1 84 TYR 0.005 0.005 4 0 "[ . 1 . 2]"
1 85 LEU 0.013 0.007 10 0 "[ . 1 . 2]"
1 86 GLU 0.539 0.105 9 0 "[ . 1 . 2]"
1 87 VAL 0.185 0.050 19 0 "[ . 1 . 2]"
1 88 ARG 0.031 0.018 20 0 "[ . 1 . 2]"
1 90 THR 0.004 0.004 5 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 27 LEU H 1 82 ASP O 2.000 . 2.200 2.077 1.923 2.250 0.050 4 0 "[ . 1 . 2]" 2
2 1 29 ALA H 1 84 TYR O 2.000 . 2.200 2.081 1.991 2.194 . 0 0 "[ . 1 . 2]" 2
3 1 31 LEU H 1 86 GLU O 2.000 . 2.200 1.980 1.930 2.029 . 0 0 "[ . 1 . 2]" 2
4 1 33 VAL H 1 88 ARG O 2.000 . 2.200 2.123 1.988 2.218 0.018 20 0 "[ . 1 . 2]" 2
5 1 34 PRO O 1 38 ALA H 2.000 . 2.200 2.090 2.008 2.159 . 0 0 "[ . 1 . 2]" 2
6 1 35 ALA O 1 39 VAL H 2.000 . 2.200 2.215 2.119 2.296 0.096 18 0 "[ . 1 . 2]" 2
7 1 36 PRO O 1 40 VAL H 2.000 . 2.200 2.084 2.005 2.217 0.017 11 0 "[ . 1 . 2]" 2
8 1 37 ILE O 1 41 GLY H 2.000 . 2.200 2.179 2.064 2.250 0.050 2 0 "[ . 1 . 2]" 2
9 1 44 VAL H 1 55 VAL O 2.000 . 2.200 2.182 2.093 2.250 0.050 20 0 "[ . 1 . 2]" 2
10 1 46 ALA H 1 53 VAL O 2.000 . 2.200 1.965 1.910 2.114 . 0 0 "[ . 1 . 2]" 2
11 1 46 ALA O 1 53 VAL H 2.000 . 2.200 2.126 1.975 2.232 0.032 20 0 "[ . 1 . 2]" 2
12 1 44 VAL O 1 55 VAL H 2.000 . 2.200 1.948 1.896 2.010 . 0 0 "[ . 1 . 2]" 2
13 1 42 GLY O 1 57 VAL H 2.000 . 2.200 2.084 1.960 2.219 0.019 4 0 "[ . 1 . 2]" 2
14 1 39 VAL O 1 60 ARG H 2.000 . 2.200 2.099 1.964 2.204 0.004 14 0 "[ . 1 . 2]" 2
15 1 38 ALA O 1 61 THR H 2.000 . 2.200 2.084 2.009 2.207 0.007 15 0 "[ . 1 . 2]" 2
16 1 64 GLY H 1 87 VAL O 2.000 . 2.200 2.111 1.965 2.237 0.037 1 0 "[ . 1 . 2]" 2
17 1 69 LEU H 1 83 LEU O 2.000 . 2.200 2.017 1.926 2.149 . 0 0 "[ . 1 . 2]" 2
18 1 73 GLY H 1 81 GLY O 2.000 . 2.200 2.106 1.960 2.258 0.058 6 0 "[ . 1 . 2]" 2
19 1 25 GLN O 1 74 PHE H 2.000 . 2.200 2.140 1.929 2.302 0.102 6 0 "[ . 1 . 2]" 2
20 1 74 PHE O 1 81 GLY H 2.000 . 2.200 2.110 1.941 2.266 0.066 3 0 "[ . 1 . 2]" 2
21 1 69 LEU O 1 83 LEU H 2.000 . 2.200 2.222 2.065 2.336 0.136 18 0 "[ . 1 . 2]" 2
22 1 27 LEU O 1 84 TYR H 2.000 . 2.200 1.969 1.893 2.041 . 0 0 "[ . 1 . 2]" 2
23 1 67 LEU O 1 85 LEU H 2.000 . 2.200 2.018 1.922 2.167 . 0 0 "[ . 1 . 2]" 2
24 1 29 ALA O 1 86 GLU H 2.000 . 2.200 2.202 2.037 2.305 0.105 9 0 "[ . 1 . 2]" 2
25 1 65 ARG O 1 87 VAL H 2.000 . 2.200 2.089 1.960 2.204 0.004 18 0 "[ . 1 . 2]" 2
26 1 31 LEU O 1 88 ARG H 2.000 . 2.200 1.993 1.922 2.088 . 0 0 "[ . 1 . 2]" 2
27 1 33 VAL O 1 90 THR H 2.000 . 2.200 2.067 1.955 2.204 0.004 5 0 "[ . 1 . 2]" 2
28 1 27 LEU N 1 82 ASP O 3.050 2.850 3.410 2.972 2.841 3.131 0.009 14 0 "[ . 1 . 2]" 2
29 1 29 ALA N 1 84 TYR O 3.050 2.850 3.410 3.041 2.943 3.151 . 0 0 "[ . 1 . 2]" 2
30 1 31 LEU N 1 86 GLU O 3.050 2.850 3.410 2.939 2.854 2.994 . 0 0 "[ . 1 . 2]" 2
31 1 33 VAL N 1 88 ARG O 3.050 2.850 3.410 3.057 2.917 3.200 . 0 0 "[ . 1 . 2]" 2
32 1 34 PRO O 1 38 ALA N 3.050 2.850 3.410 2.945 2.855 3.028 . 0 0 "[ . 1 . 2]" 2
33 1 35 ALA O 1 39 VAL N 3.050 2.850 3.410 3.136 3.039 3.223 . 0 0 "[ . 1 . 2]" 2
34 1 36 PRO O 1 40 VAL N 3.050 2.850 3.410 3.059 2.989 3.159 . 0 0 "[ . 1 . 2]" 2
35 1 37 ILE O 1 41 GLY N 3.050 2.850 3.410 2.900 2.850 2.942 0.000 18 0 "[ . 1 . 2]" 2
36 1 44 VAL N 1 55 VAL O 3.050 2.850 3.410 3.106 2.981 3.201 . 0 0 "[ . 1 . 2]" 2
37 1 46 ALA N 1 53 VAL O 3.050 2.850 3.410 2.875 2.826 2.959 0.024 15 0 "[ . 1 . 2]" 2
38 1 46 ALA O 1 53 VAL N 3.050 2.850 3.410 3.048 2.939 3.131 . 0 0 "[ . 1 . 2]" 2
39 1 44 VAL O 1 55 VAL N 3.050 2.850 3.410 2.886 2.814 2.947 0.036 11 0 "[ . 1 . 2]" 2
40 1 42 GLY O 1 57 VAL N 3.050 2.850 3.410 2.850 2.815 2.962 0.035 11 0 "[ . 1 . 2]" 2
41 1 39 VAL O 1 60 ARG N 3.050 2.850 3.410 2.927 2.825 3.111 0.025 9 0 "[ . 1 . 2]" 2
42 1 38 ALA O 1 61 THR N 3.050 2.850 3.410 2.992 2.928 3.112 . 0 0 "[ . 1 . 2]" 2
43 1 64 GLY N 1 87 VAL O 3.050 2.850 3.410 3.064 2.894 3.181 . 0 0 "[ . 1 . 2]" 2
44 1 69 LEU N 1 83 LEU O 3.050 2.850 3.410 2.933 2.838 3.064 0.012 5 0 "[ . 1 . 2]" 2
45 1 73 GLY N 1 81 GLY O 3.050 2.850 3.410 2.931 2.789 3.037 0.061 6 0 "[ . 1 . 2]" 2
46 1 25 GLN O 1 74 PHE N 3.050 2.850 3.410 3.072 2.808 3.245 0.042 12 0 "[ . 1 . 2]" 2
47 1 74 PHE O 1 81 GLY N 3.050 2.850 3.410 3.054 2.906 3.196 . 0 0 "[ . 1 . 2]" 2
48 1 69 LEU O 1 83 LEU N 3.050 2.850 3.410 3.134 2.913 3.259 . 0 0 "[ . 1 . 2]" 2
49 1 27 LEU O 1 84 TYR N 3.050 2.850 3.410 2.920 2.845 3.007 0.005 4 0 "[ . 1 . 2]" 2
50 1 67 LEU O 1 85 LEU N 3.050 2.850 3.410 2.911 2.843 2.965 0.007 10 0 "[ . 1 . 2]" 2
51 1 29 ALA O 1 86 GLU N 3.050 2.850 3.410 3.125 2.990 3.233 . 0 0 "[ . 1 . 2]" 2
52 1 65 ARG O 1 87 VAL N 3.050 2.850 3.410 2.918 2.800 3.069 0.050 19 0 "[ . 1 . 2]" 2
53 1 31 LEU O 1 88 ARG N 3.050 2.850 3.410 2.925 2.857 3.019 . 0 0 "[ . 1 . 2]" 2
54 1 33 VAL O 1 90 THR N 3.050 2.850 3.410 2.991 2.893 3.132 . 0 0 "[ . 1 . 2]" 2
stop_
save_
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