NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
652549 |
6xr6   |
30770 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6xr6
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 867
_Distance_constraint_stats_list.Viol_count 298
_Distance_constraint_stats_list.Viol_total 575.969
_Distance_constraint_stats_list.Viol_max 0.426
_Distance_constraint_stats_list.Viol_rms 0.0165
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0017
_Distance_constraint_stats_list.Viol_average_violations_only 0.0966
_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 9 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 14 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 15 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 16 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 20 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 28 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 32 VAL 2.608 0.210 15 0 "[ . 1 . 2]"
1 38 LEU 7.192 0.259 2 0 "[ . 1 . 2]"
1 39 THR 4.584 0.259 2 0 "[ . 1 . 2]"
1 40 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 41 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 42 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 45 LEU 0.063 0.046 14 0 "[ . 1 . 2]"
1 49 THR 0.050 0.045 11 0 "[ . 1 . 2]"
1 50 MET 0.113 0.046 14 0 "[ . 1 . 2]"
1 52 VAL 0.045 0.026 4 0 "[ . 1 . 2]"
1 56 LEU 0.045 0.026 4 0 "[ . 1 . 2]"
1 59 ALA 0.083 0.072 15 0 "[ . 1 . 2]"
1 60 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 61 VAL 2.805 0.312 13 0 "[ . 1 . 2]"
1 62 MET 0.048 0.028 4 0 "[ . 1 . 2]"
1 65 ILE 0.374 0.074 14 0 "[ . 1 . 2]"
1 70 LEU 0.772 0.101 6 0 "[ . 1 . 2]"
1 71 VAL 6.084 0.205 5 0 "[ . 1 . 2]"
1 73 LEU 0.311 0.072 17 0 "[ . 1 . 2]"
1 74 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 76 VAL 0.263 0.072 17 0 "[ . 1 . 2]"
1 83 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 85 ILE 0.083 0.072 15 0 "[ . 1 . 2]"
1 86 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 89 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 90 MET 0.291 0.197 2 0 "[ . 1 . 2]"
1 95 LEU 0.214 0.059 10 0 "[ . 1 . 2]"
1 96 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 99 LEU 0.010 0.010 15 0 "[ . 1 . 2]"
1 107 VAL 2.275 0.239 10 0 "[ . 1 . 2]"
1 109 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 110 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 111 VAL 2.409 0.239 10 0 "[ . 1 . 2]"
1 112 LEU 0.268 0.070 10 0 "[ . 1 . 2]"
1 113 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 115 MET 0.017 0.010 15 0 "[ . 1 . 2]"
1 116 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 119 ILE 0.641 0.078 1 0 "[ . 1 . 2]"
1 122 ALA 2.274 0.293 12 0 "[ . 1 . 2]"
1 123 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 126 LEU 2.686 0.293 12 0 "[ . 1 . 2]"
1 131 PHE 2.805 0.312 13 0 "[ . 1 . 2]"
1 132 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 136 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 137 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 138 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 142 LEU 8.670 0.426 5 0 "[ . 1 . 2]"
1 143 VAL 0.877 0.083 13 0 "[ . 1 . 2]"
1 148 LEU 3.304 0.426 5 0 "[ . 1 . 2]"
1 149 VAL 1.091 0.083 13 0 "[ . 1 . 2]"
1 151 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 152 ALA 1.008 0.143 17 0 "[ . 1 . 2]"
1 154 PHE 0.014 0.014 11 0 "[ . 1 . 2]"
1 159 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 160 MET 0.034 0.034 5 0 "[ . 1 . 2]"
1 161 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 164 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 166 THR 0.019 0.019 14 0 "[ . 1 . 2]"
1 167 ALA 0.019 0.019 14 0 "[ . 1 . 2]"
1 171 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 175 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 178 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 183 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 190 ILE 0.034 0.034 5 0 "[ . 1 . 2]"
1 194 VAL 0.497 0.088 15 0 "[ . 1 . 2]"
1 196 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 199 VAL 0.059 0.036 9 0 "[ . 1 . 2]"
1 200 LEU 0.641 0.078 1 0 "[ . 1 . 2]"
1 201 LEU 0.038 0.021 6 0 "[ . 1 . 2]"
1 204 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 205 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 206 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 209 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 215 ILE 0.485 0.074 15 0 "[ . 1 . 2]"
1 217 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 220 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 223 LEU 0.485 0.074 15 0 "[ . 1 . 2]"
1 224 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 230 MET 0.059 0.036 9 0 "[ . 1 . 2]"
1 240 VAL 0.158 0.054 17 0 "[ . 1 . 2]"
1 243 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 244 MET 0.192 0.054 17 0 "[ . 1 . 2]"
1 246 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 261 ILE 0.497 0.088 15 0 "[ . 1 . 2]"
1 264 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 265 PHE 0.003 0.003 3 0 "[ . 1 . 2]"
1 267 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 268 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 274 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 278 VAL 0.000 0.000 1 0 "[ . 1 . 2]"
1 282 LEU 0.000 0.000 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 59 ALA MB 1 85 ILE CD1 3.580 . 5.360 2.732 2.504 3.541 . 0 0 "[ . 1 . 2]" 1
2 1 56 LEU CD1 1 59 ALA MB 3.690 . 5.580 4.500 3.946 5.087 . 0 0 "[ . 1 . 2]" 1
3 1 59 ALA MB 1 76 VAL CG1 3.610 . 5.420 2.985 2.730 3.482 . 0 0 "[ . 1 . 2]" 1
4 1 20 LEU CD1 1 41 ALA MB 3.430 . 5.060 3.411 3.024 4.713 . 0 0 "[ . 1 . 2]" 1
5 1 71 VAL CG2 1 152 ALA MB 3.350 . 4.900 2.608 2.458 2.779 . 0 0 "[ . 1 . 2]" 1
6 1 71 VAL CG1 1 152 ALA MB 3.440 . 5.080 3.741 3.393 4.150 . 0 0 "[ . 1 . 2]" 1
7 1 142 LEU CD2 1 152 ALA MB 3.560 . 5.320 3.606 3.301 4.265 . 0 0 "[ . 1 . 2]" 1
8 1 70 LEU CD1 1 126 LEU MD1 3.110 . 4.420 2.952 2.518 3.586 . 0 0 "[ . 1 . 2]" 1
9 1 65 ILE CD1 1 126 LEU MD1 3.440 . 5.080 2.906 2.637 4.836 . 0 0 "[ . 1 . 2]" 1
10 1 122 ALA CB 1 126 LEU MD1 3.610 . 5.420 5.257 3.490 5.713 0.293 12 0 "[ . 1 . 2]" 1
11 1 123 MET CE 1 151 VAL MG2 3.440 . 5.080 4.466 4.118 4.797 . 0 0 "[ . 1 . 2]" 1
12 1 122 ALA CB 1 151 VAL MG2 3.370 . 4.940 3.076 2.854 3.386 . 0 0 "[ . 1 . 2]" 1
13 1 70 LEU CD1 1 151 VAL MG1 3.770 . 5.740 5.530 5.463 5.584 . 0 0 "[ . 1 . 2]" 1
14 1 70 LEU CD2 1 151 VAL MG1 3.250 . 4.700 3.613 3.479 3.802 . 0 0 "[ . 1 . 2]" 1
15 1 70 LEU CD2 1 151 VAL MG2 3.110 . 4.420 3.966 3.804 4.201 . 0 0 "[ . 1 . 2]" 1
16 1 123 MET CE 1 136 LEU MD1 3.280 . 4.760 3.959 3.571 4.495 . 0 0 "[ . 1 . 2]" 1
17 1 136 LEU CD1 1 151 VAL MG1 3.050 . 4.300 2.980 2.748 3.467 . 0 0 "[ . 1 . 2]" 1
18 1 136 LEU CD1 1 151 VAL MG2 3.030 . 4.260 3.123 2.802 3.395 . 0 0 "[ . 1 . 2]" 1
19 1 136 LEU MD1 1 200 LEU CD1 3.340 . 4.880 4.765 4.710 4.813 . 0 0 "[ . 1 . 2]" 1
20 1 45 LEU MD1 1 49 THR CG2 2.890 . 3.980 3.136 2.621 3.816 . 0 0 "[ . 1 . 2]" 1
21 1 45 LEU MD1 1 50 MET CE 3.050 . 4.300 3.437 2.668 4.181 . 0 0 "[ . 1 . 2]" 1
22 1 206 THR MG 1 209 MET CE 3.240 . 4.680 3.528 2.918 4.263 . 0 0 "[ . 1 . 2]" 1
23 1 15 THR MG 1 32 VAL CG2 3.420 . 5.040 4.278 3.579 4.863 . 0 0 "[ . 1 . 2]" 1
24 1 45 LEU CD2 1 49 THR MG 3.440 . 5.080 4.495 3.253 5.007 . 0 0 "[ . 1 . 2]" 1
25 1 45 LEU CD1 1 49 THR MG 3.320 . 4.840 3.174 2.748 3.888 . 0 0 "[ . 1 . 2]" 1
26 1 159 LEU CD1 1 161 THR MG 3.310 . 4.820 4.022 2.935 4.728 . 0 0 "[ . 1 . 2]" 1
27 1 159 LEU CD2 1 161 THR MG 3.700 . 5.600 4.016 3.054 5.282 . 0 0 "[ . 1 . 2]" 1
28 1 267 THR MG 1 268 MET CE 3.690 . 5.580 5.169 4.796 5.446 . 0 0 "[ . 1 . 2]" 1
29 1 39 THR MG 1 40 VAL CG2 3.590 . 5.380 4.884 4.763 4.990 . 0 0 "[ . 1 . 2]" 1
30 1 38 LEU CD2 1 39 THR MG 3.900 . 6.000 5.801 5.743 5.842 . 0 0 "[ . 1 . 2]" 1
31 1 39 THR MG 1 40 VAL CG1 4.110 . 6.420 5.132 5.077 5.220 . 0 0 "[ . 1 . 2]" 1
32 1 274 ILE CD1 1 278 VAL MG2 3.290 . 4.780 3.646 2.647 4.560 . 0 0 "[ . 1 . 2]" 1
33 1 278 VAL MG2 1 282 LEU CD1 3.450 . 5.100 4.056 2.837 5.062 . 0 0 "[ . 1 . 2]" 1
34 1 278 VAL MG2 1 282 LEU CD2 3.420 . 5.040 4.224 3.157 4.940 . 0 0 "[ . 1 . 2]" 1
35 1 278 VAL MG1 1 282 LEU CD1 2.610 . 3.420 3.013 2.743 3.420 0.000 1 0 "[ . 1 . 2]" 1
36 1 278 VAL MG1 1 282 LEU CD2 2.720 . 3.640 3.055 2.633 3.553 . 0 0 "[ . 1 . 2]" 1
37 1 274 ILE CD1 1 278 VAL MG1 3.500 . 5.200 3.923 2.845 4.980 . 0 0 "[ . 1 . 2]" 1
38 1 65 ILE MD 1 126 LEU CD2 3.180 . 4.560 4.037 3.097 4.278 . 0 0 "[ . 1 . 2]" 1
39 1 65 ILE MD 1 70 LEU CD2 3.250 . 4.700 3.630 2.986 4.242 . 0 0 "[ . 1 . 2]" 1
40 1 65 ILE MD 1 126 LEU CD1 3.430 . 5.060 2.961 2.597 4.476 . 0 0 "[ . 1 . 2]" 1
41 1 65 ILE MD 1 70 LEU CD1 3.130 . 4.460 2.940 2.709 3.492 . 0 0 "[ . 1 . 2]" 1
42 1 61 VAL CG1 1 65 ILE MD 3.340 . 4.880 2.842 2.625 3.098 . 0 0 "[ . 1 . 2]" 1
43 1 61 VAL CG2 1 65 ILE MD 3.680 . 5.560 5.039 4.852 5.305 . 0 0 "[ . 1 . 2]" 1
44 1 59 ALA CB 1 85 ILE MD 3.630 . 5.460 2.914 2.587 3.698 . 0 0 "[ . 1 . 2]" 1
45 1 62 MET CE 1 85 ILE MD 3.510 . 5.220 4.114 3.461 4.508 . 0 0 "[ . 1 . 2]" 1
46 1 56 LEU CD1 1 85 ILE MD 4.030 . 6.260 4.808 3.327 5.715 . 0 0 "[ . 1 . 2]" 1
47 1 56 LEU CD2 1 85 ILE MD 3.740 . 5.680 4.826 3.976 5.460 . 0 0 "[ . 1 . 2]" 1
48 1 14 ILE MD 1 42 VAL CG1 3.200 . 4.600 4.105 3.833 4.299 . 0 0 "[ . 1 . 2]" 1
49 1 14 ILE MD 1 42 VAL CG2 3.100 . 4.400 2.734 2.579 2.897 . 0 0 "[ . 1 . 2]" 1
50 1 14 ILE MD 1 40 VAL CG1 3.530 . 5.260 4.375 4.213 4.722 . 0 0 "[ . 1 . 2]" 1
51 1 14 ILE MD 1 40 VAL CG2 2.880 . 3.960 2.703 2.562 3.012 . 0 0 "[ . 1 . 2]" 1
52 1 14 ILE MD 1 86 ILE CD1 2.800 . 3.800 2.906 2.791 2.988 . 0 0 "[ . 1 . 2]" 1
53 1 9 MET CE 1 14 ILE MD 3.020 . 4.240 3.789 3.361 4.068 . 0 0 "[ . 1 . 2]" 1
54 1 14 ILE CD1 1 86 ILE MD 2.850 . 3.900 2.779 2.697 2.885 . 0 0 "[ . 1 . 2]" 1
55 1 42 VAL CG2 1 86 ILE MD 3.190 . 4.580 3.931 3.551 4.246 . 0 0 "[ . 1 . 2]" 1
56 1 42 VAL CG1 1 86 ILE MD 3.360 . 4.920 4.011 3.549 4.420 . 0 0 "[ . 1 . 2]" 1
57 1 9 MET CE 1 86 ILE MD 2.740 . 3.680 2.805 2.681 2.960 . 0 0 "[ . 1 . 2]" 1
58 1 40 VAL CG2 1 86 ILE MD 3.680 . 5.560 4.825 4.505 5.109 . 0 0 "[ . 1 . 2]" 1
59 1 119 ILE MD 1 204 ILE CD1 3.140 . 4.480 2.700 2.619 2.781 . 0 0 "[ . 1 . 2]" 1
60 1 119 ILE MD 1 149 VAL CG1 2.870 . 3.940 2.759 2.567 2.941 . 0 0 "[ . 1 . 2]" 1
61 1 119 ILE MD 1 200 LEU CD1 2.870 . 3.940 3.535 3.374 3.780 . 0 0 "[ . 1 . 2]" 1
62 1 119 ILE MD 1 200 LEU CD2 3.010 . 4.220 2.743 2.651 3.026 . 0 0 "[ . 1 . 2]" 1
63 1 95 LEU CD1 1 119 ILE MD 3.620 . 5.440 4.497 4.285 4.681 . 0 0 "[ . 1 . 2]" 1
64 1 132 ILE MD 1 160 MET CE 3.360 . 4.920 3.746 2.577 4.729 . 0 0 "[ . 1 . 2]" 1
65 1 160 MET CE 1 190 ILE MD 3.120 . 4.440 3.787 3.186 4.260 . 0 0 "[ . 1 . 2]" 1
66 1 175 ILE MD 1 217 LEU CD1 2.650 . 3.510 2.733 2.548 3.002 . 0 0 "[ . 1 . 2]" 1
67 1 175 ILE MD 1 217 LEU CD2 3.020 . 4.240 3.451 2.801 3.902 . 0 0 "[ . 1 . 2]" 1
68 1 175 ILE MD 1 220 VAL CG2 3.510 . 5.220 4.309 3.684 5.101 . 0 0 "[ . 1 . 2]" 1
69 1 119 ILE CD1 1 204 ILE MD 3.140 . 4.480 2.681 2.609 2.767 . 0 0 "[ . 1 . 2]" 1
70 1 116 ALA CB 1 204 ILE MD 3.450 . 5.100 3.077 2.888 3.487 . 0 0 "[ . 1 . 2]" 1
71 1 115 MET CE 1 204 ILE MD 3.790 . 5.780 5.174 4.805 5.354 . 0 0 "[ . 1 . 2]" 1
72 1 99 LEU CD1 1 204 ILE MD 3.570 . 5.340 5.002 4.785 5.124 . 0 0 "[ . 1 . 2]" 1
73 1 95 LEU CD1 1 204 ILE MD 3.410 . 5.020 4.458 4.351 4.618 . 0 0 "[ . 1 . 2]" 1
74 1 200 LEU CD2 1 204 ILE MD 2.950 . 4.100 3.753 3.553 3.910 . 0 0 "[ . 1 . 2]" 1
75 1 200 LEU CD1 1 204 ILE MD 2.930 . 4.050 3.210 3.021 3.558 . 0 0 "[ . 1 . 2]" 1
76 1 201 LEU CD1 1 204 ILE MD 4.160 . 6.520 5.685 5.458 6.037 . 0 0 "[ . 1 . 2]" 1
77 1 215 ILE MD 1 223 LEU CD1 2.470 . 3.140 2.886 2.756 3.052 . 0 0 "[ . 1 . 2]" 1
78 1 215 ILE MD 1 223 LEU CD2 2.650 . 3.500 2.697 2.597 2.881 . 0 0 "[ . 1 . 2]" 1
79 1 215 ILE MD 1 220 VAL CG1 3.140 . 4.480 3.739 3.369 4.109 . 0 0 "[ . 1 . 2]" 1
80 1 215 ILE MD 1 220 VAL CG2 3.230 . 4.660 2.896 2.837 3.113 . 0 0 "[ . 1 . 2]" 1
81 1 194 VAL CG2 1 261 ILE MD 2.970 . 4.140 3.606 3.086 4.047 . 0 0 "[ . 1 . 2]" 1
82 1 194 VAL CG1 1 261 ILE MD 2.640 . 3.480 2.711 2.533 2.983 . 0 0 "[ . 1 . 2]" 1
83 1 9 MET ME 1 14 ILE CD1 3.100 . 4.400 3.912 3.482 4.226 . 0 0 "[ . 1 . 2]" 1
84 1 9 MET ME 1 74 LEU CD2 3.120 . 4.440 2.867 2.710 3.056 . 0 0 "[ . 1 . 2]" 1
85 1 9 MET ME 1 74 LEU CD1 3.600 . 5.400 4.978 4.763 5.176 . 0 0 "[ . 1 . 2]" 1
86 1 9 MET ME 1 40 VAL CG2 3.620 . 5.440 5.086 4.771 5.275 . 0 0 "[ . 1 . 2]" 1
87 1 9 MET ME 1 86 ILE CD1 2.680 . 3.560 2.854 2.615 3.270 . 0 0 "[ . 1 . 2]" 1
88 1 16 MET ME 1 42 VAL CG1 2.770 . 3.740 2.888 2.585 3.235 . 0 0 "[ . 1 . 2]" 1
89 1 16 MET ME 1 42 VAL CG2 2.670 . 3.540 3.304 3.168 3.426 . 0 0 "[ . 1 . 2]" 1
90 1 14 ILE CD1 1 16 MET ME 3.580 . 5.360 4.551 3.365 5.072 . 0 0 "[ . 1 . 2]" 1
91 1 45 LEU CD1 1 50 MET ME 3.000 . 4.200 3.376 2.617 4.085 . 0 0 "[ . 1 . 2]" 1
92 1 45 LEU CD2 1 50 MET ME 3.100 . 4.400 3.785 2.783 4.446 0.046 14 0 "[ . 1 . 2]" 1
93 1 62 MET ME 1 73 LEU CD1 3.410 . 5.020 3.532 2.798 4.755 . 0 0 "[ . 1 . 2]" 1
94 1 90 MET ME 1 148 LEU CD1 2.720 . 3.640 2.890 2.780 3.069 . 0 0 "[ . 1 . 2]" 1
95 1 90 MET ME 1 142 LEU CD1 2.900 . 4.000 3.932 3.687 4.197 0.197 2 0 "[ . 1 . 2]" 1
96 1 90 MET ME 1 143 VAL CG1 3.380 . 4.960 4.570 4.433 4.701 . 0 0 "[ . 1 . 2]" 1
97 1 99 LEU CD1 1 115 MET ME 3.200 . 4.590 4.209 3.915 4.376 . 0 0 "[ . 1 . 2]" 1
98 1 95 LEU CD1 1 115 MET ME 3.100 . 4.400 3.622 2.894 3.848 . 0 0 "[ . 1 . 2]" 1
99 1 112 LEU CD2 1 115 MET ME 2.940 . 4.080 2.929 2.836 3.001 . 0 0 "[ . 1 . 2]" 1
100 1 115 MET ME 1 143 VAL CG1 3.540 . 5.280 4.856 3.999 5.108 . 0 0 "[ . 1 . 2]" 1
101 1 115 MET ME 1 204 ILE CD1 3.820 . 5.840 5.168 4.664 5.753 . 0 0 "[ . 1 . 2]" 1
102 1 123 MET ME 1 126 LEU CD2 3.210 . 4.620 3.587 3.338 4.043 . 0 0 "[ . 1 . 2]" 1
103 1 122 ALA CB 1 123 MET ME 4.090 . 6.380 5.862 5.641 6.058 . 0 0 "[ . 1 . 2]" 1
104 1 123 MET ME 1 151 VAL CG1 3.570 . 5.340 4.726 4.427 5.119 . 0 0 "[ . 1 . 2]" 1
105 1 160 MET ME 1 190 ILE CD1 3.000 . 4.200 3.712 2.988 4.234 0.034 5 0 "[ . 1 . 2]" 1
106 1 132 ILE CD1 1 160 MET ME 3.460 . 5.120 3.987 2.836 4.888 . 0 0 "[ . 1 . 2]" 1
107 1 206 THR CG2 1 209 MET ME 3.190 . 4.580 3.377 2.659 4.338 . 0 0 "[ . 1 . 2]" 1
108 1 199 VAL CG1 1 230 MET ME 3.060 . 4.320 3.202 2.766 4.126 . 0 0 "[ . 1 . 2]" 1
109 1 199 VAL CG2 1 230 MET ME 3.120 . 4.440 3.410 2.907 4.008 . 0 0 "[ . 1 . 2]" 1
110 1 201 LEU CD1 1 244 MET ME 2.730 . 3.660 3.111 2.831 3.452 . 0 0 "[ . 1 . 2]" 1
111 1 201 LEU CD2 1 244 MET ME 2.820 . 3.840 2.829 2.679 2.967 . 0 0 "[ . 1 . 2]" 1
112 1 240 VAL CG1 1 244 MET ME 2.940 . 4.080 2.887 2.550 3.140 . 0 0 "[ . 1 . 2]" 1
113 1 205 ALA CB 1 244 MET ME 2.900 . 4.000 3.359 2.901 3.587 . 0 0 "[ . 1 . 2]" 1
114 1 240 VAL CG1 1 268 MET ME 2.950 . 4.100 3.865 3.652 3.971 . 0 0 "[ . 1 . 2]" 1
115 1 240 VAL CG2 1 268 MET ME 2.870 . 3.940 3.077 2.997 3.196 . 0 0 "[ . 1 . 2]" 1
116 1 264 ALA CB 1 268 MET ME 3.420 . 5.040 4.551 4.227 4.799 . 0 0 "[ . 1 . 2]" 1
117 1 60 ALA MB 1 61 VAL CG2 3.550 . 5.300 4.157 3.961 4.343 . 0 0 "[ . 1 . 2]" 1
118 1 109 ALA MB 1 112 LEU CD1 3.610 . 5.420 4.849 4.527 5.155 . 0 0 "[ . 1 . 2]" 1
119 1 109 ALA MB 1 112 LEU CD2 4.450 . 7.100 6.420 6.188 6.671 . 0 0 "[ . 1 . 2]" 1
120 1 116 ALA MB 1 201 LEU CD2 3.580 . 5.360 2.946 2.763 3.339 . 0 0 "[ . 1 . 2]" 1
121 1 70 LEU CD1 1 122 ALA MB 3.510 . 5.220 3.508 3.339 3.581 . 0 0 "[ . 1 . 2]" 1
122 1 122 ALA MB 1 151 VAL CG1 3.220 . 4.640 4.317 4.028 4.467 . 0 0 "[ . 1 . 2]" 1
123 1 122 ALA MB 1 123 MET CE 3.880 . 5.960 5.438 5.239 5.626 . 0 0 "[ . 1 . 2]" 1
124 1 96 LEU CD2 1 138 ALA MB 3.570 . 5.340 3.432 3.256 3.686 . 0 0 "[ . 1 . 2]" 1
125 1 138 ALA MB 1 200 LEU CD2 3.660 . 5.520 4.927 4.818 5.062 . 0 0 "[ . 1 . 2]" 1
126 1 95 LEU CD1 1 138 ALA MB 3.710 . 5.620 4.319 4.059 4.546 . 0 0 "[ . 1 . 2]" 1
127 1 166 THR CG2 1 167 ALA MB 3.910 . 6.020 4.748 3.835 5.427 . 0 0 "[ . 1 . 2]" 1
128 1 196 ALA MB 1 200 LEU CD2 4.490 . 7.180 5.941 5.702 6.187 . 0 0 "[ . 1 . 2]" 1
129 1 205 ALA MB 1 244 MET CE 2.990 . 4.180 3.492 3.035 3.749 . 0 0 "[ . 1 . 2]" 1
130 1 205 ALA MB 1 240 VAL CG2 4.080 . 6.360 5.904 5.689 6.085 . 0 0 "[ . 1 . 2]" 1
131 1 243 LEU CD2 1 246 ALA MB 3.300 . 4.800 4.513 4.275 4.620 . 0 0 "[ . 1 . 2]" 1
132 1 246 ALA MB 1 261 ILE CD1 3.900 . 6.000 5.684 5.554 5.756 . 0 0 "[ . 1 . 2]" 1
133 1 243 LEU CD2 1 264 ALA MB 2.860 . 3.920 3.551 3.372 3.738 . 0 0 "[ . 1 . 2]" 1
134 1 243 LEU CD1 1 264 ALA MB 2.890 . 3.980 2.857 2.760 3.065 . 0 0 "[ . 1 . 2]" 1
135 1 264 ALA MB 1 268 MET CE 3.480 . 5.160 4.760 4.419 4.998 . 0 0 "[ . 1 . 2]" 1
136 1 38 LEU MD1 1 74 LEU CD1 2.940 . 4.080 3.268 2.814 3.788 . 0 0 "[ . 1 . 2]" 1
137 1 38 LEU MD1 1 74 LEU CD2 3.140 . 4.480 4.020 3.749 4.299 . 0 0 "[ . 1 . 2]" 1
138 1 38 LEU MD1 1 40 VAL CG2 3.410 . 5.020 4.733 4.597 4.797 . 0 0 "[ . 1 . 2]" 1
139 1 38 LEU MD2 1 74 LEU CD1 3.040 . 4.280 2.982 2.772 3.732 . 0 0 "[ . 1 . 2]" 1
140 1 38 LEU MD2 1 40 VAL CG2 3.360 . 4.920 4.700 4.637 4.744 . 0 0 "[ . 1 . 2]" 1
141 1 45 LEU MD2 1 50 MET CE 3.280 . 4.760 3.966 3.030 4.777 0.017 14 0 "[ . 1 . 2]" 1
142 1 95 LEU MD2 1 138 ALA CB 3.590 . 5.380 3.266 2.981 3.592 . 0 0 "[ . 1 . 2]" 1
143 1 95 LEU MD2 1 119 ILE CD1 3.270 . 4.740 2.988 2.838 3.133 . 0 0 "[ . 1 . 2]" 1
144 1 95 LEU MD2 1 204 ILE CD1 3.270 . 4.740 2.850 2.766 2.964 . 0 0 "[ . 1 . 2]" 1
145 1 95 LEU MD2 1 115 MET CE 3.650 . 5.500 5.104 4.769 5.246 . 0 0 "[ . 1 . 2]" 1
146 1 95 LEU MD2 1 99 LEU CD1 3.110 . 4.420 4.017 3.908 4.213 . 0 0 "[ . 1 . 2]" 1
147 1 95 LEU MD2 1 200 LEU CD1 3.090 . 4.380 3.023 2.866 3.258 . 0 0 "[ . 1 . 2]" 1
148 1 95 LEU MD2 1 149 VAL CG1 2.730 . 3.660 2.702 2.614 2.830 . 0 0 "[ . 1 . 2]" 1
149 1 95 LEU MD2 1 143 VAL CG1 4.110 . 6.420 5.965 5.876 5.997 . 0 0 "[ . 1 . 2]" 1
150 1 95 LEU MD1 1 115 MET CE 2.990 . 4.180 3.435 3.027 3.610 . 0 0 "[ . 1 . 2]" 1
151 1 95 LEU MD1 1 204 ILE CD1 3.370 . 4.940 4.360 4.226 4.520 . 0 0 "[ . 1 . 2]" 1
152 1 95 LEU MD1 1 99 LEU CD1 3.130 . 4.460 2.915 2.844 2.970 . 0 0 "[ . 1 . 2]" 1
153 1 95 LEU MD1 1 200 LEU CD1 3.940 . 6.080 5.570 5.417 5.738 . 0 0 "[ . 1 . 2]" 1
154 1 95 LEU MD1 1 143 VAL CG1 3.200 . 4.590 4.075 4.001 4.134 . 0 0 "[ . 1 . 2]" 1
155 1 95 LEU MD1 1 119 ILE CD1 3.750 . 5.700 4.873 4.630 5.058 . 0 0 "[ . 1 . 2]" 1
156 1 95 LEU MD1 1 138 ALA CB 3.880 . 5.960 4.905 4.689 5.103 . 0 0 "[ . 1 . 2]" 1
157 1 52 VAL CG2 1 56 LEU MD2 2.910 . 4.020 3.726 2.782 3.890 . 0 0 "[ . 1 . 2]" 1
158 1 56 LEU MD2 1 59 ALA CB 3.850 . 5.900 5.574 5.233 5.789 . 0 0 "[ . 1 . 2]" 1
159 1 56 LEU MD2 1 85 ILE CD1 3.790 . 5.780 4.829 4.030 5.451 . 0 0 "[ . 1 . 2]" 1
160 1 52 VAL CG1 1 56 LEU MD1 3.110 . 4.420 4.210 4.047 4.300 . 0 0 "[ . 1 . 2]" 1
161 1 56 LEU MD1 1 85 ILE CD1 4.090 . 6.380 4.830 3.262 5.850 . 0 0 "[ . 1 . 2]" 1
162 1 56 LEU MD1 1 59 ALA CB 3.600 . 5.400 4.499 3.958 5.129 . 0 0 "[ . 1 . 2]" 1
163 1 70 LEU MD1 1 122 ALA CB 2.920 . 4.040 3.852 3.603 3.941 . 0 0 "[ . 1 . 2]" 1
164 1 65 ILE CD1 1 70 LEU MD1 3.110 . 4.420 2.894 2.621 3.451 . 0 0 "[ . 1 . 2]" 1
165 1 70 LEU MD1 1 123 MET CE 4.370 . 6.940 6.548 6.385 6.647 . 0 0 "[ . 1 . 2]" 1
166 1 65 ILE CD1 1 70 LEU MD2 3.410 . 5.020 3.773 3.066 4.446 . 0 0 "[ . 1 . 2]" 1
167 1 70 LEU MD2 1 122 ALA CB 3.270 . 4.740 3.022 2.853 3.201 . 0 0 "[ . 1 . 2]" 1
168 1 70 LEU MD2 1 126 LEU CD2 3.160 . 4.520 2.927 2.567 3.535 . 0 0 "[ . 1 . 2]" 1
169 1 70 LEU MD2 1 151 VAL CG2 3.410 . 5.020 3.513 3.370 3.737 . 0 0 "[ . 1 . 2]" 1
170 1 70 LEU MD2 1 151 VAL CG1 3.230 . 4.660 3.314 3.183 3.486 . 0 0 "[ . 1 . 2]" 1
171 1 99 LEU MD1 1 204 ILE CD1 3.240 . 4.680 4.412 4.199 4.542 . 0 0 "[ . 1 . 2]" 1
172 1 95 LEU CD1 1 99 LEU MD1 3.000 . 4.200 2.871 2.811 2.955 . 0 0 "[ . 1 . 2]" 1
173 1 95 LEU CD2 1 99 LEU MD1 2.890 . 3.980 3.649 3.556 3.777 . 0 0 "[ . 1 . 2]" 1
174 1 99 LEU MD2 1 115 MET CE 2.960 . 4.120 2.807 2.645 2.982 . 0 0 "[ . 1 . 2]" 1
175 1 99 LEU MD2 1 204 ILE CD1 4.040 . 6.280 5.823 5.547 5.983 . 0 0 "[ . 1 . 2]" 1
176 1 99 LEU MD2 1 112 LEU CD1 3.380 . 4.960 4.511 4.326 4.688 . 0 0 "[ . 1 . 2]" 1
177 1 99 LEU MD2 1 112 LEU CD2 2.930 . 4.050 2.784 2.567 3.067 . 0 0 "[ . 1 . 2]" 1
178 1 95 LEU CD1 1 99 LEU MD2 3.250 . 4.700 3.198 2.965 3.310 . 0 0 "[ . 1 . 2]" 1
179 1 95 LEU CD2 1 99 LEU MD2 3.560 . 5.320 4.987 4.807 5.072 . 0 0 "[ . 1 . 2]" 1
180 1 99 LEU MD2 1 143 VAL CG1 3.990 . 6.180 5.610 5.340 5.754 . 0 0 "[ . 1 . 2]" 1
181 1 136 LEU MD1 1 151 VAL CG1 3.070 . 4.340 2.961 2.787 3.346 . 0 0 "[ . 1 . 2]" 1
182 1 62 MET CE 1 73 LEU MD1 3.650 . 5.500 3.132 2.530 4.091 . 0 0 "[ . 1 . 2]" 1
183 1 73 LEU MD1 1 76 VAL CG2 3.750 . 5.700 4.794 4.276 5.029 . 0 0 "[ . 1 . 2]" 1
184 1 73 LEU MD2 1 76 VAL CG2 3.750 . 5.700 4.059 3.288 4.551 . 0 0 "[ . 1 . 2]" 1
185 1 62 MET CE 1 73 LEU MD2 3.650 . 5.500 4.281 2.927 5.281 . 0 0 "[ . 1 . 2]" 1
186 1 73 LEU CD1 1 76 VAL MG2 3.830 . 5.860 5.114 4.436 5.384 . 0 0 "[ . 1 . 2]" 1
187 1 59 ALA CB 1 76 VAL MG2 3.640 . 5.480 4.171 3.671 5.007 . 0 0 "[ . 1 . 2]" 1
188 1 73 LEU CD1 1 76 VAL MG1 3.100 . 4.400 2.950 2.744 3.132 . 0 0 "[ . 1 . 2]" 1
189 1 123 MET CE 1 136 LEU MD2 2.980 . 4.160 2.740 2.579 2.912 . 0 0 "[ . 1 . 2]" 1
190 1 119 ILE CD1 1 136 LEU MD2 4.330 . 6.860 5.811 5.579 6.044 . 0 0 "[ . 1 . 2]" 1
191 1 136 LEU MD2 1 151 VAL CG2 3.270 . 4.740 4.483 4.282 4.592 . 0 0 "[ . 1 . 2]" 1
192 1 136 LEU MD2 1 200 LEU CD2 3.200 . 4.600 3.669 3.492 4.056 . 0 0 "[ . 1 . 2]" 1
193 1 122 ALA CB 1 136 LEU MD2 4.310 . 6.820 6.443 6.200 6.572 . 0 0 "[ . 1 . 2]" 1
194 1 136 LEU MD1 1 200 LEU CD2 2.770 . 3.740 2.946 2.845 3.069 . 0 0 "[ . 1 . 2]" 1
195 1 122 ALA CB 1 136 LEU MD1 4.290 . 6.780 5.999 5.574 6.335 . 0 0 "[ . 1 . 2]" 1
196 1 122 ALA CB 1 151 VAL MG1 3.540 . 5.280 4.783 4.515 4.911 . 0 0 "[ . 1 . 2]" 1
197 1 38 LEU CD1 1 74 LEU MD1 3.230 . 4.660 3.191 2.814 3.624 . 0 0 "[ . 1 . 2]" 1
198 1 40 VAL CG2 1 74 LEU MD1 3.250 . 4.700 4.339 4.222 4.485 . 0 0 "[ . 1 . 2]" 1
199 1 38 LEU CD1 1 74 LEU MD2 3.230 . 4.660 4.157 3.829 4.427 . 0 0 "[ . 1 . 2]" 1
200 1 40 VAL CG2 1 74 LEU MD2 3.250 . 4.700 3.761 3.096 4.245 . 0 0 "[ . 1 . 2]" 1
201 1 96 LEU MD2 1 138 ALA CB 3.580 . 5.360 3.698 3.472 3.998 . 0 0 "[ . 1 . 2]" 1
202 1 96 LEU MD2 1 137 ALA CB 3.600 . 5.400 4.856 4.590 5.032 . 0 0 "[ . 1 . 2]" 1
203 1 96 LEU MD1 1 99 LEU CD1 3.370 . 4.940 4.699 4.571 4.793 . 0 0 "[ . 1 . 2]" 1
204 1 113 LEU MD1 1 244 MET CE 3.910 . 6.020 5.734 5.457 5.815 . 0 0 "[ . 1 . 2]" 1
205 1 113 LEU MD1 1 116 ALA CB 3.490 . 5.180 3.794 3.486 3.975 . 0 0 "[ . 1 . 2]" 1
206 1 113 LEU MD1 1 268 MET CE 2.750 . 3.700 2.759 2.573 3.216 . 0 0 "[ . 1 . 2]" 1
207 1 113 LEU MD1 1 240 VAL CG1 3.000 . 4.200 2.813 2.699 3.139 . 0 0 "[ . 1 . 2]" 1
208 1 113 LEU MD2 1 240 VAL CG1 3.510 . 5.220 4.533 4.273 4.881 . 0 0 "[ . 1 . 2]" 1
209 1 113 LEU MD2 1 268 MET CE 2.850 . 3.900 3.184 2.901 3.675 . 0 0 "[ . 1 . 2]" 1
210 1 99 LEU CD1 1 112 LEU MD1 3.640 . 5.480 5.150 4.904 5.244 . 0 0 "[ . 1 . 2]" 1
211 1 109 ALA CB 1 112 LEU MD1 3.550 . 5.300 4.326 3.966 4.647 . 0 0 "[ . 1 . 2]" 1
212 1 99 LEU CD1 1 112 LEU MD2 3.060 . 4.320 3.601 3.437 3.755 . 0 0 "[ . 1 . 2]" 1
213 1 95 LEU CD1 1 112 LEU MD2 3.590 . 5.380 5.047 4.858 5.144 . 0 0 "[ . 1 . 2]" 1
214 1 99 LEU CD2 1 112 LEU MD2 2.710 . 3.620 2.909 2.770 3.109 . 0 0 "[ . 1 . 2]" 1
215 1 112 LEU MD2 1 115 MET CE 3.000 . 4.200 2.671 2.573 2.795 . 0 0 "[ . 1 . 2]" 1
216 1 112 LEU MD2 1 204 ILE CD1 3.840 . 5.880 5.372 5.128 5.576 . 0 0 "[ . 1 . 2]" 1
217 1 70 LEU CD1 1 126 LEU MD2 3.030 . 4.260 3.397 2.863 3.943 . 0 0 "[ . 1 . 2]" 1
218 1 65 ILE CD1 1 126 LEU MD2 3.240 . 4.680 4.249 3.101 4.634 . 0 0 "[ . 1 . 2]" 1
219 1 122 ALA CB 1 126 LEU MD2 3.640 . 5.480 4.118 3.467 5.385 . 0 0 "[ . 1 . 2]" 1
220 1 123 MET CE 1 126 LEU MD2 3.620 . 5.440 3.239 2.989 3.912 . 0 0 "[ . 1 . 2]" 1
221 1 126 LEU MD2 1 151 VAL CG1 3.410 . 5.020 3.901 3.591 4.323 . 0 0 "[ . 1 . 2]" 1
222 1 142 LEU MD1 1 152 ALA CB 3.220 . 4.640 3.572 3.355 3.924 . 0 0 "[ . 1 . 2]" 1
223 1 90 MET CE 1 142 LEU MD1 3.000 . 4.200 3.858 3.747 4.037 . 0 0 "[ . 1 . 2]" 1
224 1 71 VAL CG2 1 142 LEU MD1 3.020 . 4.240 2.572 2.509 2.763 . 0 0 "[ . 1 . 2]" 1
225 1 71 VAL CG1 1 142 LEU MD1 3.040 . 4.280 2.887 2.702 3.113 . 0 0 "[ . 1 . 2]" 1
226 1 71 VAL CG2 1 142 LEU MD2 3.280 . 4.760 4.841 4.718 4.932 0.172 5 0 "[ . 1 . 2]" 1
227 1 142 LEU MD2 1 152 ALA CB 3.380 . 4.960 3.934 3.551 4.613 . 0 0 "[ . 1 . 2]" 1
228 1 90 MET CE 1 142 LEU MD2 3.550 . 5.300 5.122 5.034 5.280 . 0 0 "[ . 1 . 2]" 1
229 1 90 MET CE 1 148 LEU MD1 2.710 . 3.620 2.988 2.902 3.100 . 0 0 "[ . 1 . 2]" 1
230 1 175 ILE CD1 1 183 LEU MD1 3.200 . 4.600 3.557 3.124 4.219 . 0 0 "[ . 1 . 2]" 1
231 1 183 LEU MD1 1 224 LEU CD1 3.350 . 4.900 3.183 2.784 3.429 . 0 0 "[ . 1 . 2]" 1
232 1 183 LEU MD1 1 224 LEU CD2 3.760 . 5.720 5.232 4.832 5.498 . 0 0 "[ . 1 . 2]" 1
233 1 175 ILE CD1 1 183 LEU MD2 2.930 . 4.050 3.342 2.993 3.560 . 0 0 "[ . 1 . 2]" 1
234 1 138 ALA CB 1 200 LEU MD1 3.300 . 4.800 2.873 2.811 2.942 . 0 0 "[ . 1 . 2]" 1
235 1 119 ILE CD1 1 200 LEU MD1 3.030 . 4.260 3.657 3.421 3.944 . 0 0 "[ . 1 . 2]" 1
236 1 200 LEU MD1 1 204 ILE CD1 2.970 . 4.140 3.313 3.150 3.631 . 0 0 "[ . 1 . 2]" 1
237 1 200 LEU MD2 1 204 ILE CD1 3.250 . 4.700 4.185 3.980 4.330 . 0 0 "[ . 1 . 2]" 1
238 1 119 ILE CD1 1 200 LEU MD2 2.820 . 3.840 2.782 2.672 3.071 . 0 0 "[ . 1 . 2]" 1
239 1 138 ALA CB 1 200 LEU MD2 3.550 . 5.300 4.997 4.901 5.106 . 0 0 "[ . 1 . 2]" 1
240 1 201 LEU MD1 1 244 MET CE 2.840 . 3.880 3.150 2.911 3.451 . 0 0 "[ . 1 . 2]" 1
241 1 116 ALA CB 1 201 LEU MD1 3.440 . 5.080 4.381 4.157 4.697 . 0 0 "[ . 1 . 2]" 1
242 1 201 LEU MD1 1 268 MET CE 3.810 . 5.820 5.187 4.901 5.349 . 0 0 "[ . 1 . 2]" 1
243 1 201 LEU MD1 1 261 ILE CD1 4.330 . 6.860 6.111 5.758 6.509 . 0 0 "[ . 1 . 2]" 1
244 1 201 LEU MD1 1 240 VAL CG1 3.040 . 4.280 3.359 3.059 3.609 . 0 0 "[ . 1 . 2]" 1
245 1 201 LEU MD1 1 243 LEU CD1 3.040 . 4.280 3.564 3.166 3.832 . 0 0 "[ . 1 . 2]" 1
246 1 201 LEU MD1 1 243 LEU CD2 2.850 . 3.900 3.062 2.879 3.238 . 0 0 "[ . 1 . 2]" 1
247 1 113 LEU CD1 1 201 LEU MD2 3.210 . 4.620 3.681 3.209 3.930 . 0 0 "[ . 1 . 2]" 1
248 1 201 LEU MD2 1 240 VAL CG1 3.300 . 4.800 2.832 2.719 3.053 . 0 0 "[ . 1 . 2]" 1
249 1 201 LEU MD2 1 240 VAL CG2 3.570 . 5.340 4.689 4.457 4.826 . 0 0 "[ . 1 . 2]" 1
250 1 201 LEU MD2 1 244 MET CE 2.940 . 4.080 2.754 2.595 2.943 . 0 0 "[ . 1 . 2]" 1
251 1 116 ALA CB 1 201 LEU MD2 3.210 . 4.620 3.009 2.819 3.411 . 0 0 "[ . 1 . 2]" 1
252 1 201 LEU MD2 1 268 MET CE 4.130 . 6.460 5.761 5.469 6.083 . 0 0 "[ . 1 . 2]" 1
253 1 201 LEU MD2 1 204 ILE CD1 3.370 . 4.940 4.197 3.947 4.482 . 0 0 "[ . 1 . 2]" 1
254 1 175 ILE CD1 1 217 LEU MD1 2.720 . 3.640 2.774 2.562 2.982 . 0 0 "[ . 1 . 2]" 1
255 1 217 LEU MD1 1 220 VAL CG1 3.140 . 4.480 4.351 4.241 4.427 . 0 0 "[ . 1 . 2]" 1
256 1 217 LEU MD1 1 220 VAL CG2 3.160 . 4.520 3.905 3.770 4.034 . 0 0 "[ . 1 . 2]" 1
257 1 217 LEU MD2 1 220 VAL CG1 3.020 . 4.240 3.974 3.795 4.121 . 0 0 "[ . 1 . 2]" 1
258 1 217 LEU MD2 1 220 VAL CG2 3.080 . 4.360 2.874 2.752 2.965 . 0 0 "[ . 1 . 2]" 1
259 1 175 ILE CD1 1 217 LEU MD2 2.960 . 4.120 3.665 2.799 4.088 . 0 0 "[ . 1 . 2]" 1
260 1 215 ILE CD1 1 223 LEU MD1 2.570 . 3.340 2.838 2.675 3.026 . 0 0 "[ . 1 . 2]" 1
261 1 220 VAL CG1 1 223 LEU MD1 2.960 . 4.120 3.833 3.665 3.936 . 0 0 "[ . 1 . 2]" 1
262 1 215 ILE CD1 1 223 LEU MD2 2.740 . 3.680 2.664 2.563 2.871 . 0 0 "[ . 1 . 2]" 1
263 1 220 VAL CG2 1 223 LEU MD2 3.490 . 5.180 4.029 3.736 4.367 . 0 0 "[ . 1 . 2]" 1
264 1 220 VAL CG2 1 224 LEU MD1 3.450 . 5.100 4.855 4.830 4.889 . 0 0 "[ . 1 . 2]" 1
265 1 183 LEU CD1 1 224 LEU MD1 3.190 . 4.580 3.119 2.779 3.367 . 0 0 "[ . 1 . 2]" 1
266 1 243 LEU MD1 1 264 ALA CB 2.750 . 3.700 2.974 2.793 3.079 . 0 0 "[ . 1 . 2]" 1
267 1 243 LEU MD1 1 268 MET CE 2.460 . 3.120 2.728 2.624 2.889 . 0 0 "[ . 1 . 2]" 1
268 1 240 VAL CG1 1 243 LEU MD1 3.490 . 5.180 4.403 3.889 4.678 . 0 0 "[ . 1 . 2]" 1
269 1 240 VAL CG2 1 243 LEU MD1 3.490 . 5.180 4.767 4.464 4.955 . 0 0 "[ . 1 . 2]" 1
270 1 201 LEU CD1 1 243 LEU MD1 2.980 . 4.160 3.662 3.196 3.974 . 0 0 "[ . 1 . 2]" 1
271 1 243 LEU MD2 1 261 ILE CD1 3.240 . 4.680 4.149 3.709 4.474 . 0 0 "[ . 1 . 2]" 1
272 1 243 LEU MD2 1 264 ALA CB 2.940 . 4.080 3.913 3.697 4.041 . 0 0 "[ . 1 . 2]" 1
273 1 201 LEU CD1 1 243 LEU MD2 2.710 . 3.620 2.843 2.638 3.025 . 0 0 "[ . 1 . 2]" 1
274 1 20 LEU CD1 1 28 VAL MG1 2.890 . 3.980 2.956 2.687 3.545 . 0 0 "[ . 1 . 2]" 1
275 1 20 LEU CD2 1 28 VAL MG1 3.260 . 4.720 4.516 3.771 4.630 . 0 0 "[ . 1 . 2]" 1
276 1 32 VAL MG2 1 39 THR CG2 2.850 . 3.900 3.559 3.340 3.752 . 0 0 "[ . 1 . 2]" 1
277 1 32 VAL MG1 1 38 LEU CD1 3.490 . 5.180 4.805 4.696 4.884 . 0 0 "[ . 1 . 2]" 1
278 1 9 MET CE 1 40 VAL MG2 3.630 . 5.460 5.023 4.717 5.210 . 0 0 "[ . 1 . 2]" 1
279 1 14 ILE CD1 1 40 VAL MG2 3.160 . 4.520 2.751 2.626 3.118 . 0 0 "[ . 1 . 2]" 1
280 1 40 VAL MG2 1 86 ILE CD1 3.580 . 5.360 4.681 4.418 4.963 . 0 0 "[ . 1 . 2]" 1
281 1 38 LEU CD1 1 40 VAL MG2 3.610 . 5.420 5.081 4.914 5.151 . 0 0 "[ . 1 . 2]" 1
282 1 40 VAL MG2 1 74 LEU CD1 3.340 . 4.880 4.728 4.619 4.788 . 0 0 "[ . 1 . 2]" 1
283 1 40 VAL MG2 1 74 LEU CD2 3.270 . 4.740 3.978 3.207 4.443 . 0 0 "[ . 1 . 2]" 1
284 1 40 VAL MG2 1 42 VAL CG2 3.200 . 4.590 3.070 2.885 3.331 . 0 0 "[ . 1 . 2]" 1
285 1 16 MET CE 1 42 VAL MG2 2.830 . 3.860 3.495 3.037 3.764 . 0 0 "[ . 1 . 2]" 1
286 1 42 VAL MG2 1 86 ILE CD1 3.240 . 4.680 3.586 3.281 3.856 . 0 0 "[ . 1 . 2]" 1
287 1 14 ILE CD1 1 42 VAL MG2 3.110 . 4.420 2.750 2.596 2.937 . 0 0 "[ . 1 . 2]" 1
288 1 16 MET CE 1 42 VAL MG1 2.800 . 3.800 2.912 2.682 3.375 . 0 0 "[ . 1 . 2]" 1
289 1 42 VAL MG1 1 86 ILE CD1 3.230 . 4.660 3.617 3.204 3.991 . 0 0 "[ . 1 . 2]" 1
290 1 52 VAL MG1 1 56 LEU CD2 2.840 . 3.880 2.649 2.490 3.272 . 0 0 "[ . 1 . 2]" 1
291 1 45 LEU CD2 1 52 VAL MG1 3.790 . 5.780 4.681 3.736 5.322 . 0 0 "[ . 1 . 2]" 1
292 1 45 LEU CD2 1 52 VAL MG2 3.200 . 4.600 2.969 2.490 3.744 . 0 0 "[ . 1 . 2]" 1
293 1 61 VAL MG1 1 65 ILE CD1 3.170 . 4.540 2.804 2.634 3.113 . 0 0 "[ . 1 . 2]" 1
294 1 71 VAL MG1 1 152 ALA CB 3.230 . 4.660 3.911 3.589 4.313 . 0 0 "[ . 1 . 2]" 1
295 1 71 VAL MG1 1 142 LEU CD1 3.170 . 4.540 2.979 2.800 3.198 . 0 0 "[ . 1 . 2]" 1
296 1 71 VAL MG1 1 142 LEU CD2 3.530 . 5.260 4.950 4.823 5.030 . 0 0 "[ . 1 . 2]" 1
297 1 71 VAL MG2 1 142 LEU CD1 3.080 . 4.360 2.654 2.606 2.789 . 0 0 "[ . 1 . 2]" 1
298 1 71 VAL MG2 1 90 MET CE 3.570 . 5.340 4.006 3.418 4.909 . 0 0 "[ . 1 . 2]" 1
299 1 71 VAL MG2 1 152 ALA CB 3.010 . 4.220 2.660 2.466 2.856 . 0 0 "[ . 1 . 2]" 1
300 1 107 VAL MG2 1 115 MET CE 3.270 . 4.740 4.472 3.963 4.627 . 0 0 "[ . 1 . 2]" 1
301 1 111 VAL MG2 1 115 MET CE 3.080 . 4.360 2.787 2.712 3.171 . 0 0 "[ . 1 . 2]" 1
302 1 111 VAL MG2 1 112 LEU CD2 3.140 . 4.480 4.448 4.331 4.550 0.070 10 0 "[ . 1 . 2]" 1
303 1 111 VAL MG1 1 112 LEU CD2 3.350 . 4.900 3.704 3.035 3.833 . 0 0 "[ . 1 . 2]" 1
304 1 111 VAL MG1 1 112 LEU CD1 3.420 . 5.040 4.608 4.187 4.734 . 0 0 "[ . 1 . 2]" 1
305 1 111 VAL MG1 1 115 MET CE 3.090 . 4.380 4.081 3.747 4.166 . 0 0 "[ . 1 . 2]" 1
306 1 115 MET CE 1 143 VAL MG1 3.380 . 4.960 4.503 4.093 4.659 . 0 0 "[ . 1 . 2]" 1
307 1 90 MET CE 1 143 VAL MG1 3.600 . 5.400 4.939 4.790 5.079 . 0 0 "[ . 1 . 2]" 1
308 1 95 LEU CD1 1 143 VAL MG1 3.560 . 5.320 4.381 4.297 4.463 . 0 0 "[ . 1 . 2]" 1
309 1 143 VAL MG1 1 148 LEU CD1 3.650 . 5.500 5.296 5.123 5.409 . 0 0 "[ . 1 . 2]" 1
310 1 143 VAL MG1 1 148 LEU CD2 4.030 . 6.260 5.934 5.895 5.993 . 0 0 "[ . 1 . 2]" 1
311 1 115 MET CE 1 143 VAL MG2 3.490 . 5.180 4.649 4.203 4.869 . 0 0 "[ . 1 . 2]" 1
312 1 90 MET CE 1 143 VAL MG2 3.570 . 5.340 5.141 5.009 5.198 . 0 0 "[ . 1 . 2]" 1
313 1 95 LEU CD1 1 143 VAL MG2 3.140 . 4.480 2.609 2.576 2.639 . 0 0 "[ . 1 . 2]" 1
314 1 95 LEU CD2 1 143 VAL MG2 2.960 . 4.120 3.962 3.926 4.010 . 0 0 "[ . 1 . 2]" 1
315 1 99 LEU CD1 1 143 VAL MG2 3.850 . 5.900 5.333 5.242 5.438 . 0 0 "[ . 1 . 2]" 1
316 1 143 VAL MG2 1 148 LEU CD1 4.330 . 6.860 6.497 6.416 6.613 . 0 0 "[ . 1 . 2]" 1
317 1 119 ILE CD1 1 149 VAL MG1 3.150 . 4.500 2.789 2.732 2.920 . 0 0 "[ . 1 . 2]" 1
318 1 149 VAL MG1 1 204 ILE CD1 3.640 . 5.480 4.748 4.368 4.955 . 0 0 "[ . 1 . 2]" 1
319 1 90 MET CE 1 149 VAL MG1 3.630 . 5.460 5.233 4.775 5.389 . 0 0 "[ . 1 . 2]" 1
320 1 143 VAL CG1 1 149 VAL MG1 3.360 . 4.920 4.635 4.530 4.688 . 0 0 "[ . 1 . 2]" 1
321 1 95 LEU CD1 1 149 VAL MG1 2.940 . 4.080 3.491 3.370 3.655 . 0 0 "[ . 1 . 2]" 1
322 1 95 LEU CD2 1 149 VAL MG1 2.870 . 3.940 2.807 2.720 2.943 . 0 0 "[ . 1 . 2]" 1
323 1 149 VAL MG1 1 200 LEU CD1 3.850 . 5.900 5.443 5.226 5.661 . 0 0 "[ . 1 . 2]" 1
324 1 149 VAL MG1 1 200 LEU CD2 3.650 . 5.500 5.370 5.226 5.482 . 0 0 "[ . 1 . 2]" 1
325 1 115 MET CE 1 149 VAL MG2 3.280 . 4.760 3.618 3.009 3.889 . 0 0 "[ . 1 . 2]" 1
326 1 119 ILE CD1 1 149 VAL MG2 3.230 . 4.660 4.401 4.098 4.551 . 0 0 "[ . 1 . 2]" 1
327 1 149 VAL MG2 1 204 ILE CD1 3.720 . 5.640 5.153 4.918 5.325 . 0 0 "[ . 1 . 2]" 1
328 1 90 MET CE 1 149 VAL MG2 3.970 . 6.140 5.650 5.305 5.820 . 0 0 "[ . 1 . 2]" 1
329 1 95 LEU CD1 1 149 VAL MG2 2.910 . 4.020 3.110 2.905 3.295 . 0 0 "[ . 1 . 2]" 1
330 1 95 LEU CD2 1 149 VAL MG2 2.900 . 4.000 3.768 3.619 3.864 . 0 0 "[ . 1 . 2]" 1
331 1 143 VAL CG1 1 149 VAL MG2 3.070 . 4.340 2.865 2.739 2.993 . 0 0 "[ . 1 . 2]" 1
332 1 194 VAL MG2 1 261 ILE CD1 3.180 . 4.560 3.709 3.077 4.327 . 0 0 "[ . 1 . 2]" 1
333 1 194 VAL MG1 1 261 ILE CD1 3.180 . 4.560 2.644 2.490 2.899 . 0 0 "[ . 1 . 2]" 1
334 1 199 VAL MG1 1 230 MET CE 3.210 . 4.620 3.171 2.703 4.202 . 0 0 "[ . 1 . 2]" 1
335 1 199 VAL MG2 1 230 MET CE 3.210 . 4.620 3.362 2.720 4.020 . 0 0 "[ . 1 . 2]" 1
336 1 215 ILE CD1 1 220 VAL MG1 3.310 . 4.820 3.885 3.438 4.284 . 0 0 "[ . 1 . 2]" 1
337 1 175 ILE CD1 1 220 VAL MG1 3.270 . 4.740 3.477 2.918 4.590 . 0 0 "[ . 1 . 2]" 1
338 1 183 LEU CD1 1 220 VAL MG1 3.420 . 5.040 4.008 3.171 4.464 . 0 0 "[ . 1 . 2]" 1
339 1 217 LEU CD2 1 220 VAL MG1 3.210 . 4.620 4.261 4.052 4.416 . 0 0 "[ . 1 . 2]" 1
340 1 220 VAL MG1 1 224 LEU CD1 3.160 . 4.520 2.788 2.676 2.861 . 0 0 "[ . 1 . 2]" 1
341 1 220 VAL MG1 1 224 LEU CD2 3.280 . 4.760 3.883 3.467 4.058 . 0 0 "[ . 1 . 2]" 1
342 1 220 VAL MG1 1 223 LEU CD2 3.570 . 5.340 4.914 4.834 5.014 . 0 0 "[ . 1 . 2]" 1
343 1 215 ILE CD1 1 220 VAL MG2 3.330 . 4.860 2.590 2.492 2.823 . 0 0 "[ . 1 . 2]" 1
344 1 220 VAL MG2 1 224 LEU CD1 3.640 . 5.480 5.199 5.139 5.258 . 0 0 "[ . 1 . 2]" 1
345 1 217 LEU CD1 1 220 VAL MG2 3.270 . 4.740 3.989 3.845 4.116 . 0 0 "[ . 1 . 2]" 1
346 1 217 LEU CD2 1 220 VAL MG2 3.250 . 4.700 2.978 2.875 3.058 . 0 0 "[ . 1 . 2]" 1
347 1 220 VAL MG2 1 223 LEU CD2 3.400 . 5.000 4.228 3.920 4.545 . 0 0 "[ . 1 . 2]" 1
348 1 175 ILE CD1 1 220 VAL MG2 3.720 . 5.640 4.602 4.141 5.285 . 0 0 "[ . 1 . 2]" 1
349 1 240 VAL MG2 1 268 MET CE 2.880 . 3.960 2.800 2.690 2.929 . 0 0 "[ . 1 . 2]" 1
350 1 113 LEU CD2 1 240 VAL MG2 2.940 . 4.080 2.980 2.801 3.244 . 0 0 "[ . 1 . 2]" 1
351 1 201 LEU CD1 1 240 VAL MG2 3.860 . 5.920 5.439 5.181 5.546 . 0 0 "[ . 1 . 2]" 1
352 1 113 LEU CD1 1 240 VAL MG1 3.160 . 4.520 2.974 2.848 3.243 . 0 0 "[ . 1 . 2]" 1
353 1 201 LEU CD1 1 240 VAL MG1 3.190 . 4.580 3.255 2.996 3.470 . 0 0 "[ . 1 . 2]" 1
354 1 113 LEU CD2 1 240 VAL MG1 3.580 . 5.360 4.519 4.290 4.862 . 0 0 "[ . 1 . 2]" 1
355 1 201 LEU CD2 1 240 VAL MG1 3.190 . 4.580 2.895 2.794 3.084 . 0 0 "[ . 1 . 2]" 1
356 1 201 LEU CD2 1 240 VAL MG2 3.640 . 5.480 5.062 4.767 5.203 . 0 0 "[ . 1 . 2]" 1
357 1 240 VAL MG1 1 244 MET CE 2.860 . 3.920 2.736 2.633 2.886 . 0 0 "[ . 1 . 2]" 1
358 1 240 VAL MG1 1 268 MET CE 3.160 . 4.520 4.127 3.863 4.282 . 0 0 "[ . 1 . 2]" 1
359 1 178 THR MG 1 183 LEU CD1 3.350 . 4.900 4.022 3.667 4.343 . 0 0 "[ . 1 . 2]" 1
360 1 178 THR MG 1 183 LEU CD2 3.070 . 4.340 2.910 2.836 3.009 . 0 0 "[ . 1 . 2]" 1
361 1 175 ILE CD1 1 178 THR MG 4.150 . 6.500 6.080 5.678 6.351 . 0 0 "[ . 1 . 2]" 1
362 1 167 ALA CB 1 171 ALA MB 3.680 . 5.560 4.031 2.736 5.299 . 0 0 "[ . 1 . 2]" 1
363 1 45 LEU CD2 1 56 LEU MD2 3.280 . 4.760 3.909 2.787 4.555 . 0 0 "[ . 1 . 2]" 1
364 1 45 LEU MD2 1 56 LEU CD2 3.230 . 4.660 3.821 2.757 4.531 . 0 0 "[ . 1 . 2]" 1
365 1 119 ILE MD 1 149 VAL CG2 3.100 . 4.400 4.099 3.830 4.177 . 0 0 "[ . 1 . 2]" 1
366 1 119 ILE MD 1 151 VAL CG2 3.810 . 5.820 4.619 4.356 4.975 . 0 0 "[ . 1 . 2]" 1
367 1 175 ILE MD 1 183 LEU CD1 3.030 . 4.260 3.717 3.210 4.176 . 0 0 "[ . 1 . 2]" 1
368 1 112 LEU CD2 1 204 ILE MD 4.040 . 6.280 5.663 5.412 5.860 . 0 0 "[ . 1 . 2]" 1
369 1 246 ALA CB 1 261 ILE MD 4.000 . 6.200 5.853 5.716 5.915 . 0 0 "[ . 1 . 2]" 1
370 1 274 ILE MD 1 278 VAL CG1 3.570 . 5.340 3.706 2.699 4.773 . 0 0 "[ . 1 . 2]" 1
371 1 274 ILE MD 1 278 VAL CG2 3.710 . 5.620 3.546 2.816 4.629 . 0 0 "[ . 1 . 2]" 1
372 1 49 THR CG2 1 50 MET ME 3.590 . 5.380 4.711 2.699 5.425 0.045 11 0 "[ . 1 . 2]" 1
373 1 62 MET ME 1 85 ILE CD1 3.160 . 4.520 4.151 3.546 4.474 . 0 0 "[ . 1 . 2]" 1
374 1 90 MET ME 1 143 VAL CG2 3.380 . 4.960 4.764 4.630 4.848 . 0 0 "[ . 1 . 2]" 1
375 1 123 MET ME 1 136 LEU CD2 2.890 . 3.980 2.999 2.822 3.230 . 0 0 "[ . 1 . 2]" 1
376 1 123 MET ME 1 136 LEU CD1 3.340 . 4.880 4.183 3.827 4.629 . 0 0 "[ . 1 . 2]" 1
377 1 113 LEU CD2 1 268 MET ME 2.840 . 3.880 3.340 2.901 3.876 . 0 0 "[ . 1 . 2]" 1
378 1 201 LEU CD1 1 268 MET ME 3.670 . 5.540 5.204 4.921 5.352 . 0 0 "[ . 1 . 2]" 1
379 1 243 LEU CD1 1 268 MET ME 2.460 . 3.120 2.782 2.639 2.940 . 0 0 "[ . 1 . 2]" 1
380 1 40 VAL CG2 1 41 ALA MB 3.750 . 5.700 5.279 5.212 5.343 . 0 0 "[ . 1 . 2]" 1
381 1 28 VAL CG2 1 41 ALA MB 3.760 . 5.720 5.121 4.569 5.517 . 0 0 "[ . 1 . 2]" 1
382 1 28 VAL CG1 1 41 ALA MB 3.270 . 4.740 3.265 2.724 3.748 . 0 0 "[ . 1 . 2]" 1
383 1 20 LEU CD2 1 41 ALA MB 3.770 . 5.740 5.222 3.965 5.469 . 0 0 "[ . 1 . 2]" 1
384 1 59 ALA MB 1 60 ALA CB 3.680 . 5.560 4.373 4.268 4.538 . 0 0 "[ . 1 . 2]" 1
385 1 56 LEU CD2 1 59 ALA MB 3.820 . 5.840 5.354 5.054 5.511 . 0 0 "[ . 1 . 2]" 1
386 1 59 ALA CB 1 60 ALA MB 3.480 . 5.160 4.519 4.420 4.655 . 0 0 "[ . 1 . 2]" 1
387 1 116 ALA MB 1 119 ILE CD1 3.810 . 5.820 4.730 4.412 5.018 . 0 0 "[ . 1 . 2]" 1
388 1 113 LEU CD2 1 116 ALA MB 4.050 . 6.300 5.747 5.495 5.875 . 0 0 "[ . 1 . 2]" 1
389 1 116 ALA MB 1 201 LEU CD1 3.790 . 5.780 3.909 3.685 4.261 . 0 0 "[ . 1 . 2]" 1
390 1 113 LEU CD1 1 116 ALA MB 3.770 . 5.740 3.818 3.524 3.997 . 0 0 "[ . 1 . 2]" 1
391 1 122 ALA MB 1 151 VAL CG2 3.360 . 4.920 2.986 2.752 3.269 . 0 0 "[ . 1 . 2]" 1
392 1 122 ALA MB 1 126 LEU CD1 3.690 . 5.580 5.197 3.558 5.502 . 0 0 "[ . 1 . 2]" 1
393 1 70 LEU CD2 1 122 ALA MB 3.260 . 4.720 2.612 2.490 2.734 . 0 0 "[ . 1 . 2]" 1
394 1 96 LEU CD2 1 137 ALA MB 3.740 . 5.670 4.905 4.647 5.097 . 0 0 "[ . 1 . 2]" 1
395 1 137 ALA MB 1 200 LEU CD2 3.790 . 5.780 5.352 5.087 5.507 . 0 0 "[ . 1 . 2]" 1
396 1 99 LEU CD2 1 138 ALA MB 4.610 . 7.420 6.035 5.764 6.264 . 0 0 "[ . 1 . 2]" 1
397 1 138 ALA MB 1 149 VAL CG1 4.960 . 8.120 6.364 6.089 6.776 . 0 0 "[ . 1 . 2]" 1
398 1 99 LEU CD1 1 138 ALA MB 3.780 . 5.760 4.204 3.930 4.368 . 0 0 "[ . 1 . 2]" 1
399 1 138 ALA MB 1 200 LEU CD1 3.780 . 5.760 2.839 2.732 2.988 . 0 0 "[ . 1 . 2]" 1
400 1 142 LEU CD1 1 152 ALA MB 3.840 . 5.880 3.255 3.062 3.663 . 0 0 "[ . 1 . 2]" 1
401 1 151 VAL CG1 1 152 ALA MB 3.700 . 5.600 5.036 4.950 5.100 . 0 0 "[ . 1 . 2]" 1
402 1 151 VAL CG2 1 152 ALA MB 4.180 . 6.560 6.064 5.997 6.168 . 0 0 "[ . 1 . 2]" 1
403 1 136 LEU CD2 1 196 ALA MB 3.570 . 5.340 3.904 3.486 4.385 . 0 0 "[ . 1 . 2]" 1
404 1 136 LEU CD1 1 196 ALA MB 3.700 . 5.600 4.945 4.742 5.160 . 0 0 "[ . 1 . 2]" 1
405 1 205 ALA MB 1 206 THR CG2 3.110 . 4.420 4.104 3.934 4.216 . 0 0 "[ . 1 . 2]" 1
406 1 201 LEU CD1 1 205 ALA MB 4.020 . 6.240 5.743 5.560 5.927 . 0 0 "[ . 1 . 2]" 1
407 1 32 VAL CG2 1 39 THR MG 3.350 . 4.900 3.720 3.427 4.021 . 0 0 "[ . 1 . 2]" 1
408 1 166 THR MG 1 167 ALA CB 3.470 . 5.140 4.475 3.792 5.159 0.019 14 0 "[ . 1 . 2]" 1
409 1 205 ALA CB 1 206 THR MG 3.040 . 4.280 3.975 3.806 4.083 . 0 0 "[ . 1 . 2]" 1
410 1 264 ALA CB 1 267 THR MG 3.540 . 5.280 3.928 3.698 4.692 . 0 0 "[ . 1 . 2]" 1
411 1 32 VAL CG1 1 38 LEU MD1 3.480 . 5.160 4.805 4.702 4.885 . 0 0 "[ . 1 . 2]" 1
412 1 45 LEU MD2 1 52 VAL CG2 2.910 . 4.020 3.023 2.547 3.773 . 0 0 "[ . 1 . 2]" 1
413 1 38 LEU MD1 1 40 VAL CG1 2.460 . 3.120 2.975 2.859 3.078 . 0 0 "[ . 1 . 2]" 1
414 1 52 VAL CG1 1 56 LEU MD2 2.780 . 3.760 2.998 2.852 3.509 . 0 0 "[ . 1 . 2]" 1
415 1 40 VAL CG1 1 74 LEU MD1 2.750 . 3.700 2.623 2.547 2.767 . 0 0 "[ . 1 . 2]" 1
416 1 40 VAL CG1 1 74 LEU MD2 2.750 . 3.700 3.057 2.726 3.422 . 0 0 "[ . 1 . 2]" 1
417 1 95 LEU MD2 1 200 LEU CD2 3.180 . 4.560 4.125 3.927 4.289 . 0 0 "[ . 1 . 2]" 1
418 1 95 LEU MD2 1 149 VAL CG2 3.020 . 4.240 3.738 3.625 3.818 . 0 0 "[ . 1 . 2]" 1
419 1 95 LEU MD2 1 143 VAL CG2 3.150 . 4.500 4.308 4.252 4.373 . 0 0 "[ . 1 . 2]" 1
420 1 95 LEU MD1 1 149 VAL CG2 2.850 . 3.900 2.945 2.743 3.131 . 0 0 "[ . 1 . 2]" 1
421 1 95 LEU MD1 1 99 LEU CD2 2.710 . 3.620 3.060 2.909 3.137 . 0 0 "[ . 1 . 2]" 1
422 1 95 LEU MD1 1 143 VAL CG2 3.080 . 4.360 2.581 2.546 2.623 . 0 0 "[ . 1 . 2]" 1
423 1 95 LEU MD1 1 112 LEU CD2 3.620 . 5.440 4.986 4.785 5.086 . 0 0 "[ . 1 . 2]" 1
424 1 96 LEU MD1 1 200 LEU CD1 4.270 . 6.740 5.614 5.441 5.788 . 0 0 "[ . 1 . 2]" 1
425 1 96 LEU MD2 1 200 LEU CD1 4.180 . 6.560 6.380 6.332 6.451 . 0 0 "[ . 1 . 2]" 1
426 1 99 LEU MD2 1 107 VAL CG1 2.720 . 3.640 3.189 2.871 3.399 . 0 0 "[ . 1 . 2]" 1
427 1 96 LEU CD1 1 99 LEU MD1 3.490 . 5.180 4.653 4.506 4.760 . 0 0 "[ . 1 . 2]" 1
428 1 70 LEU MD1 1 126 LEU CD2 2.730 . 3.660 3.275 2.709 3.761 0.101 6 0 "[ . 1 . 2]" 1
429 1 99 LEU MD1 1 112 LEU CD2 2.980 . 4.160 3.777 3.591 3.963 . 0 0 "[ . 1 . 2]" 1
430 1 107 VAL CG1 1 112 LEU MD1 3.100 . 4.400 4.148 3.859 4.254 . 0 0 "[ . 1 . 2]" 1
431 1 111 VAL CG1 1 112 LEU MD1 3.690 . 5.580 5.186 4.749 5.323 . 0 0 "[ . 1 . 2]" 1
432 1 111 VAL CG2 1 112 LEU MD2 3.160 . 4.520 4.382 4.286 4.463 . 0 0 "[ . 1 . 2]" 1
433 1 111 VAL CG1 1 112 LEU MD2 3.040 . 4.280 4.008 3.297 4.130 . 0 0 "[ . 1 . 2]" 1
434 1 107 VAL CG1 1 112 LEU MD2 2.750 . 3.700 2.590 2.527 2.633 . 0 0 "[ . 1 . 2]" 1
435 1 113 LEU MD2 1 240 VAL CG2 3.010 . 4.220 2.995 2.779 3.345 . 0 0 "[ . 1 . 2]" 1
436 1 113 LEU MD2 1 116 ALA CB 4.320 . 6.840 6.403 6.160 6.531 . 0 0 "[ . 1 . 2]" 1
437 1 113 LEU MD1 1 201 LEU CD1 3.660 . 5.520 4.551 4.107 4.786 . 0 0 "[ . 1 . 2]" 1
438 1 113 LEU MD1 1 240 VAL CG2 2.970 . 4.140 2.601 2.475 2.695 . 0 0 "[ . 1 . 2]" 1
439 1 70 LEU CD2 1 126 LEU MD2 3.010 . 4.220 2.964 2.546 3.594 . 0 0 "[ . 1 . 2]" 1
440 1 136 LEU MD2 1 196 ALA CB 3.720 . 5.640 3.971 3.492 4.522 . 0 0 "[ . 1 . 2]" 1
441 1 136 LEU MD1 1 151 VAL CG2 3.010 . 4.220 3.112 2.879 3.336 . 0 0 "[ . 1 . 2]" 1
442 1 136 LEU MD1 1 196 ALA CB 3.900 . 6.000 5.501 5.338 5.672 . 0 0 "[ . 1 . 2]" 1
443 1 71 VAL CG1 1 142 LEU MD2 3.620 . 5.440 5.368 5.301 5.419 . 0 0 "[ . 1 . 2]" 1
444 1 278 VAL CG1 1 282 LEU MD1 2.580 . 3.360 2.889 2.559 3.215 . 0 0 "[ . 1 . 2]" 1
445 1 278 VAL CG1 1 282 LEU MD2 2.580 . 3.360 2.990 2.664 3.229 . 0 0 "[ . 1 . 2]" 1
446 1 95 LEU CD2 1 200 LEU MD1 2.710 . 3.620 2.943 2.797 3.147 . 0 0 "[ . 1 . 2]" 1
447 1 137 ALA CB 1 200 LEU MD1 3.340 . 4.880 4.175 3.964 4.436 . 0 0 "[ . 1 . 2]" 1
448 1 136 LEU CD1 1 200 LEU MD2 2.640 . 3.480 2.844 2.762 2.970 . 0 0 "[ . 1 . 2]" 1
449 1 136 LEU CD2 1 200 LEU MD2 2.900 . 4.000 3.381 3.234 3.657 . 0 0 "[ . 1 . 2]" 1
450 1 151 VAL CG2 1 200 LEU MD2 3.300 . 4.800 4.525 4.227 4.657 . 0 0 "[ . 1 . 2]" 1
451 1 137 ALA CB 1 200 LEU MD2 3.560 . 5.320 4.795 4.489 4.958 . 0 0 "[ . 1 . 2]" 1
452 1 201 LEU MD1 1 205 ALA CB 4.310 . 6.820 6.150 5.905 6.370 . 0 0 "[ . 1 . 2]" 1
453 1 220 VAL CG2 1 223 LEU MD1 3.350 . 4.900 4.183 3.838 4.321 . 0 0 "[ . 1 . 2]" 1
454 1 220 VAL CG1 1 223 LEU MD2 3.400 . 5.000 4.806 4.702 4.909 . 0 0 "[ . 1 . 2]" 1
455 1 220 VAL CG1 1 224 LEU MD1 3.140 . 4.480 2.832 2.754 2.902 . 0 0 "[ . 1 . 2]" 1
456 1 220 VAL CG1 1 224 LEU MD2 3.250 . 4.700 4.298 3.863 4.517 . 0 0 "[ . 1 . 2]" 1
457 1 39 THR CG2 1 40 VAL MG2 3.720 . 5.640 4.978 4.864 5.084 . 0 0 "[ . 1 . 2]" 1
458 1 40 VAL MG2 1 41 ALA CB 3.460 . 5.120 4.907 4.802 4.998 . 0 0 "[ . 1 . 2]" 1
459 1 40 VAL CG2 1 42 VAL MG2 2.950 . 4.100 3.182 2.971 3.444 . 0 0 "[ . 1 . 2]" 1
460 1 14 ILE CD1 1 42 VAL MG1 3.320 . 4.840 4.384 4.108 4.580 . 0 0 "[ . 1 . 2]" 1
461 1 52 VAL MG1 1 56 LEU CD1 2.810 . 3.820 3.661 3.589 3.736 . 0 0 "[ . 1 . 2]" 1
462 1 61 VAL MG2 1 159 LEU CD2 3.890 . 5.980 5.368 3.482 5.979 . 0 0 "[ . 1 . 2]" 1
463 1 60 ALA CB 1 61 VAL MG2 3.140 . 4.480 4.086 3.896 4.248 . 0 0 "[ . 1 . 2]" 1
464 1 71 VAL MG2 1 142 LEU CD2 3.120 . 4.440 4.182 4.081 4.248 . 0 0 "[ . 1 . 2]" 1
465 1 107 VAL MG1 1 111 VAL CG2 2.840 . 3.880 3.723 3.602 3.801 . 0 0 "[ . 1 . 2]" 1
466 1 107 VAL MG2 1 111 VAL CG2 3.130 . 4.460 4.144 3.784 4.292 . 0 0 "[ . 1 . 2]" 1
467 1 107 VAL MG1 1 112 LEU CD1 2.960 . 4.120 3.767 3.528 3.872 . 0 0 "[ . 1 . 2]" 1
468 1 107 VAL MG1 1 112 LEU CD2 2.630 . 3.460 2.672 2.594 2.737 . 0 0 "[ . 1 . 2]" 1
469 1 107 VAL MG1 1 111 VAL CG1 2.800 . 3.800 3.101 2.675 3.286 . 0 0 "[ . 1 . 2]" 1
470 1 107 VAL MG2 1 111 VAL CG1 3.210 . 4.620 4.082 3.731 4.271 . 0 0 "[ . 1 . 2]" 1
471 1 107 VAL MG1 1 115 MET CE 2.880 . 3.960 3.327 3.064 3.533 . 0 0 "[ . 1 . 2]" 1
472 1 107 VAL CG1 1 111 VAL MG1 2.980 . 4.160 3.068 2.711 3.208 . 0 0 "[ . 1 . 2]" 1
473 1 107 VAL CG1 1 111 VAL MG2 2.820 . 3.840 3.950 3.840 4.079 0.239 10 0 "[ . 1 . 2]" 1
474 1 143 VAL MG1 1 149 VAL CG2 2.700 . 3.600 2.938 2.776 3.068 . 0 0 "[ . 1 . 2]" 1
475 1 143 VAL CG2 1 149 VAL MG1 2.690 . 3.580 3.349 3.192 3.454 . 0 0 "[ . 1 . 2]" 1
476 1 148 LEU CD1 1 149 VAL MG2 3.830 . 5.860 5.584 5.512 5.671 . 0 0 "[ . 1 . 2]" 1
477 1 143 VAL CG2 1 149 VAL MG2 2.610 . 3.420 2.612 2.531 2.672 . 0 0 "[ . 1 . 2]" 1
478 1 136 LEU CD2 1 151 VAL MG2 3.160 . 4.520 4.301 4.119 4.368 . 0 0 "[ . 1 . 2]" 1
479 1 151 VAL MG1 1 152 ALA CB 3.300 . 4.800 4.614 4.521 4.676 . 0 0 "[ . 1 . 2]" 1
480 1 220 VAL MG1 1 223 LEU CD1 2.970 . 4.140 3.908 3.741 4.003 . 0 0 "[ . 1 . 2]" 1
481 1 220 VAL MG2 1 223 LEU CD1 3.240 . 4.680 4.366 4.052 4.553 . 0 0 "[ . 1 . 2]" 1
482 1 113 LEU CD1 1 240 VAL MG2 2.910 . 4.020 2.627 2.525 2.769 . 0 0 "[ . 1 . 2]" 1
483 1 14 ILE MD 1 74 LEU CD2 3.490 . 5.180 4.594 4.126 4.835 . 0 0 "[ . 1 . 2]" 1
484 1 76 VAL CG1 1 85 ILE MD 3.320 . 4.840 3.204 2.808 4.504 . 0 0 "[ . 1 . 2]" 1
485 1 73 LEU CD1 1 85 ILE MD 3.720 . 5.640 4.501 3.906 5.344 . 0 0 "[ . 1 . 2]" 1
486 1 76 VAL CG2 1 85 ILE MD 4.200 . 6.600 4.863 4.403 6.199 . 0 0 "[ . 1 . 2]" 1
487 1 95 LEU CD2 1 119 ILE MD 3.100 . 4.400 2.887 2.720 3.060 . 0 0 "[ . 1 . 2]" 1
488 1 175 ILE MD 1 183 LEU CD2 3.250 . 4.700 3.669 3.270 3.903 . 0 0 "[ . 1 . 2]" 1
489 1 175 ILE MD 1 220 VAL CG1 3.430 . 5.060 3.536 2.969 4.664 . 0 0 "[ . 1 . 2]" 1
490 1 95 LEU CD2 1 204 ILE MD 3.080 . 4.360 3.182 3.085 3.267 . 0 0 "[ . 1 . 2]" 1
491 1 111 VAL CG2 1 115 MET ME 2.810 . 3.820 2.987 2.877 3.705 . 0 0 "[ . 1 . 2]" 1
492 1 111 VAL CG1 1 115 MET ME 2.920 . 4.040 3.867 3.740 4.047 0.007 10 0 "[ . 1 . 2]" 1
493 1 99 LEU CD2 1 115 MET ME 2.490 . 3.180 2.827 2.634 3.022 . 0 0 "[ . 1 . 2]" 1
494 1 119 ILE CD1 1 136 LEU MD1 3.740 . 5.670 4.865 4.490 5.314 . 0 0 "[ . 1 . 2]" 1
495 1 59 ALA CB 1 76 VAL MG1 3.310 . 4.820 2.819 2.581 3.345 . 0 0 "[ . 1 . 2]" 1
496 1 56 LEU MD2 1 59 ALA MB 3.520 . 5.240 4.416 4.129 4.589 . 0 0 "[ . 1 . 2]" 1
497 1 142 LEU MD2 1 152 ALA MB 3.670 . 5.540 3.082 2.781 3.630 . 0 0 "[ . 1 . 2]" 1
498 1 123 MET ME 1 126 LEU MD1 3.410 . 5.020 4.383 2.754 4.765 . 0 0 "[ . 1 . 2]" 1
499 1 123 MET ME 1 151 VAL MG2 3.410 . 5.020 4.040 3.752 4.313 . 0 0 "[ . 1 . 2]" 1
500 1 206 THR MG 1 244 MET ME 3.700 . 5.600 4.933 4.597 5.226 . 0 0 "[ . 1 . 2]" 1
501 1 205 ALA MB 1 206 THR MG 3.710 . 5.620 3.103 2.940 3.211 . 0 0 "[ . 1 . 2]" 1
502 1 15 THR MG 1 32 VAL MG2 2.950 . 4.100 3.630 3.112 4.050 . 0 0 "[ . 1 . 2]" 1
503 1 45 LEU MD2 1 49 THR MG 3.230 . 4.660 3.792 2.425 4.448 . 0 0 "[ . 1 . 2]" 1
504 1 45 LEU MD1 1 49 THR MG 3.130 . 4.460 2.339 1.845 2.909 . 0 0 "[ . 1 . 2]" 1
505 1 159 LEU MD2 1 161 THR MG 3.310 . 4.820 3.370 2.448 4.424 . 0 0 "[ . 1 . 2]" 1
506 1 159 LEU MD1 1 161 THR MG 3.310 . 4.820 3.393 2.254 4.051 . 0 0 "[ . 1 . 2]" 1
507 1 267 THR MG 1 268 MET ME 3.310 . 4.820 4.215 3.897 4.436 . 0 0 "[ . 1 . 2]" 1
508 1 65 ILE MD 1 126 LEU MD2 3.250 . 4.700 3.278 2.329 3.591 . 0 0 "[ . 1 . 2]" 1
509 1 65 ILE MD 1 126 LEU MD1 3.300 . 4.800 2.147 1.810 3.721 . 0 0 "[ . 1 . 2]" 1
510 1 65 ILE MD 1 70 LEU MD1 3.120 . 4.440 1.958 1.726 2.465 0.074 14 0 "[ . 1 . 2]" 1
511 1 65 ILE MD 1 70 LEU MD2 3.310 . 4.820 2.834 2.179 3.412 . 0 0 "[ . 1 . 2]" 1
512 1 61 VAL MG1 1 65 ILE MD 3.130 . 4.460 2.034 1.831 2.237 . 0 0 "[ . 1 . 2]" 1
513 1 59 ALA MB 1 85 ILE MD 3.560 . 5.320 2.065 1.728 2.849 0.072 15 0 "[ . 1 . 2]" 1
514 1 62 MET ME 1 85 ILE MD 3.700 . 5.600 3.250 2.596 3.572 . 0 0 "[ . 1 . 2]" 1
515 1 56 LEU MD2 1 85 ILE MD 3.280 . 4.760 3.759 3.010 4.329 . 0 0 "[ . 1 . 2]" 1
516 1 76 VAL MG1 1 85 ILE MD 3.300 . 4.800 2.401 2.066 3.520 . 0 0 "[ . 1 . 2]" 1
517 1 14 ILE MD 1 42 VAL MG1 3.110 . 4.420 3.381 3.128 3.562 . 0 0 "[ . 1 . 2]" 1
518 1 115 MET ME 1 119 ILE MD 3.860 . 5.920 5.124 4.702 5.643 . 0 0 "[ . 1 . 2]" 1
519 1 123 MET ME 1 190 ILE MD 3.770 . 5.740 4.477 3.080 5.446 . 0 0 "[ . 1 . 2]" 1
520 1 175 ILE MD 1 220 VAL MG1 3.120 . 4.440 2.805 2.344 3.686 . 0 0 "[ . 1 . 2]" 1
521 1 175 ILE MD 1 220 VAL MG2 3.350 . 4.900 3.619 3.172 4.224 . 0 0 "[ . 1 . 2]" 1
522 1 119 ILE MD 1 204 ILE MD 2.910 . 4.020 1.952 1.860 2.070 . 0 0 "[ . 1 . 2]" 1
523 1 115 MET ME 1 204 ILE MD 3.410 . 5.020 4.151 3.675 4.668 . 0 0 "[ . 1 . 2]" 1
524 1 95 LEU MD1 1 204 ILE MD 3.410 . 5.020 3.629 3.531 3.779 . 0 0 "[ . 1 . 2]" 1
525 1 194 VAL MG2 1 261 ILE MD 2.760 . 3.720 2.845 2.268 3.344 . 0 0 "[ . 1 . 2]" 1
526 1 243 LEU MD2 1 261 ILE MD 2.940 . 4.080 3.451 3.014 3.733 . 0 0 "[ . 1 . 2]" 1
527 1 9 MET ME 1 42 VAL MG1 3.960 . 6.120 5.366 5.079 5.755 . 0 0 "[ . 1 . 2]" 1
528 1 16 MET ME 1 42 VAL MG1 2.760 . 3.720 2.136 1.811 2.617 . 0 0 "[ . 1 . 2]" 1
529 1 16 MET ME 1 42 VAL MG2 2.810 . 3.820 2.612 2.309 2.828 . 0 0 "[ . 1 . 2]" 1
530 1 16 MET ME 1 40 VAL MG2 3.680 . 5.560 5.055 4.541 5.357 . 0 0 "[ . 1 . 2]" 1
531 1 45 LEU MD1 1 50 MET ME 2.850 . 3.900 2.675 1.976 3.244 . 0 0 "[ . 1 . 2]" 1
532 1 45 LEU MD2 1 50 MET ME 3.090 . 4.380 3.058 2.165 3.779 . 0 0 "[ . 1 . 2]" 1
533 1 50 MET ME 1 52 VAL MG2 3.510 . 5.220 4.049 2.059 4.701 . 0 0 "[ . 1 . 2]" 1
534 1 62 MET ME 1 73 LEU MD1 3.320 . 4.840 2.533 1.788 3.669 0.012 4 0 "[ . 1 . 2]" 1
535 1 62 MET ME 1 65 ILE MD 3.770 . 5.740 4.934 4.224 5.450 . 0 0 "[ . 1 . 2]" 1
536 1 62 MET ME 1 73 LEU MD2 3.320 . 4.840 3.427 2.026 4.624 . 0 0 "[ . 1 . 2]" 1
537 1 61 VAL MG1 1 62 MET ME 3.430 . 5.060 4.623 4.240 4.843 . 0 0 "[ . 1 . 2]" 1
538 1 90 MET ME 1 142 LEU MD2 3.190 . 4.580 4.200 4.149 4.318 . 0 0 "[ . 1 . 2]" 1
539 1 90 MET ME 1 143 VAL MG1 3.280 . 4.760 3.849 3.708 3.966 . 0 0 "[ . 1 . 2]" 1
540 1 90 MET ME 1 143 VAL MG2 3.420 . 5.040 4.061 3.934 4.124 . 0 0 "[ . 1 . 2]" 1
541 1 99 LEU MD2 1 115 MET ME 2.780 . 3.760 1.987 1.790 2.146 0.010 15 0 "[ . 1 . 2]" 1
542 1 95 LEU MD1 1 115 MET ME 2.750 . 3.700 2.763 2.149 2.989 . 0 0 "[ . 1 . 2]" 1
543 1 111 VAL MG1 1 115 MET ME 2.870 . 3.940 3.068 2.953 3.157 . 0 0 "[ . 1 . 2]" 1
544 1 112 LEU MD1 1 115 MET ME 3.210 . 4.620 4.375 4.273 4.545 . 0 0 "[ . 1 . 2]" 1
545 1 115 MET ME 1 143 VAL MG1 3.040 . 4.280 3.811 3.098 4.025 . 0 0 "[ . 1 . 2]" 1
546 1 123 MET ME 1 126 LEU MD2 3.470 . 5.130 2.726 2.497 3.114 . 0 0 "[ . 1 . 2]" 1
547 1 122 ALA MB 1 123 MET ME 3.710 . 5.620 4.793 4.618 4.955 . 0 0 "[ . 1 . 2]" 1
548 1 123 MET ME 1 136 LEU MD1 3.000 . 4.200 3.410 3.071 3.847 . 0 0 "[ . 1 . 2]" 1
549 1 160 MET ME 1 190 ILE MD 3.100 . 4.400 2.992 2.426 3.421 . 0 0 "[ . 1 . 2]" 1
550 1 160 MET ME 1 164 THR MG 3.890 . 5.980 4.877 3.739 5.895 . 0 0 "[ . 1 . 2]" 1
551 1 206 THR MG 1 209 MET ME 2.810 . 3.820 2.769 2.100 3.664 . 0 0 "[ . 1 . 2]" 1
552 1 199 VAL MG1 1 230 MET ME 3.010 . 4.220 2.283 1.821 3.196 . 0 0 "[ . 1 . 2]" 1
553 1 199 VAL MG2 1 230 MET ME 3.010 . 4.220 2.535 2.053 3.110 . 0 0 "[ . 1 . 2]" 1
554 1 201 LEU MD1 1 244 MET ME 2.750 . 3.700 2.331 2.007 2.719 . 0 0 "[ . 1 . 2]" 1
555 1 201 LEU MD2 1 244 MET ME 2.830 . 3.860 1.970 1.779 2.144 0.021 6 0 "[ . 1 . 2]" 1
556 1 113 LEU MD1 1 244 MET ME 3.310 . 4.820 4.558 4.275 4.634 . 0 0 "[ . 1 . 2]" 1
557 1 240 VAL MG1 1 244 MET ME 2.760 . 3.720 1.959 1.746 2.211 0.054 17 0 "[ . 1 . 2]" 1
558 1 205 ALA MB 1 244 MET ME 2.980 . 4.160 2.587 2.216 2.773 . 0 0 "[ . 1 . 2]" 1
559 1 240 VAL MG2 1 268 MET ME 2.730 . 3.660 2.130 2.016 2.363 . 0 0 "[ . 1 . 2]" 1
560 1 240 VAL MG1 1 268 MET ME 2.830 . 3.860 3.084 2.815 3.245 . 0 0 "[ . 1 . 2]" 1
561 1 60 ALA MB 1 61 VAL MG1 3.630 . 5.460 5.097 4.974 5.214 . 0 0 "[ . 1 . 2]" 1
562 1 116 ALA MB 1 201 LEU MD2 3.490 . 5.180 2.314 2.154 2.644 . 0 0 "[ . 1 . 2]" 1
563 1 116 ALA MB 1 201 LEU MD1 3.430 . 5.060 3.392 3.196 3.656 . 0 0 "[ . 1 . 2]" 1
564 1 70 LEU MD2 1 122 ALA MB 3.240 . 4.680 2.076 1.898 2.262 . 0 0 "[ . 1 . 2]" 1
565 1 122 ALA MB 1 151 VAL MG1 3.420 . 5.040 3.754 3.526 3.860 . 0 0 "[ . 1 . 2]" 1
566 1 122 ALA MB 1 151 VAL MG2 3.220 . 4.640 2.296 2.112 2.561 . 0 0 "[ . 1 . 2]" 1
567 1 70 LEU MD1 1 122 ALA MB 3.210 . 4.620 3.025 2.840 3.112 . 0 0 "[ . 1 . 2]" 1
568 1 122 ALA MB 1 126 LEU MD1 3.340 . 4.880 4.260 2.693 4.611 . 0 0 "[ . 1 . 2]" 1
569 1 122 ALA MB 1 126 LEU MD2 3.710 . 5.620 3.268 2.697 4.258 . 0 0 "[ . 1 . 2]" 1
570 1 96 LEU MD1 1 138 ALA MB 3.810 . 5.820 1.997 1.857 2.195 . 0 0 "[ . 1 . 2]" 1
571 1 95 LEU MD2 1 138 ALA MB 3.560 . 5.320 2.685 2.428 2.969 . 0 0 "[ . 1 . 2]" 1
572 1 167 ALA MB 1 171 ALA MB 3.770 . 5.740 3.130 1.958 4.443 . 0 0 "[ . 1 . 2]" 1
573 1 196 ALA MB 1 200 LEU MD2 3.920 . 6.040 4.811 4.597 5.024 . 0 0 "[ . 1 . 2]" 1
574 1 205 ALA MB 1 240 VAL MG1 3.470 . 5.130 3.441 3.228 3.740 . 0 0 "[ . 1 . 2]" 1
575 1 246 ALA MB 1 261 ILE MD 3.410 . 5.020 4.728 4.619 4.781 . 0 0 "[ . 1 . 2]" 1
576 1 243 LEU MD2 1 246 ALA MB 3.080 . 4.360 3.494 3.286 3.587 . 0 0 "[ . 1 . 2]" 1
577 1 95 LEU MD2 1 115 MET ME 3.220 . 4.640 4.166 3.662 4.550 . 0 0 "[ . 1 . 2]" 1
578 1 95 LEU MD2 1 119 ILE MD 2.600 . 3.400 2.150 1.994 2.303 . 0 0 "[ . 1 . 2]" 1
579 1 95 LEU MD2 1 149 VAL MG1 2.540 . 3.280 1.818 1.741 1.961 0.059 10 0 "[ . 1 . 2]" 1
580 1 95 LEU MD2 1 143 VAL MG1 3.500 . 5.200 5.001 4.909 5.034 . 0 0 "[ . 1 . 2]" 1
581 1 95 LEU MD2 1 143 VAL MG2 3.130 . 4.460 3.357 3.309 3.405 . 0 0 "[ . 1 . 2]" 1
582 1 52 VAL MG2 1 56 LEU MD1 3.260 . 4.720 4.546 3.527 4.746 0.026 4 0 "[ . 1 . 2]" 1
583 1 70 LEU MD1 1 126 LEU MD2 2.940 . 4.080 2.556 2.024 3.084 . 0 0 "[ . 1 . 2]" 1
584 1 70 LEU MD2 1 151 VAL MG2 3.170 . 4.540 3.064 2.927 3.270 . 0 0 "[ . 1 . 2]" 1
585 1 99 LEU MD1 1 112 LEU MD1 3.030 . 4.260 4.067 3.851 4.166 . 0 0 "[ . 1 . 2]" 1
586 1 99 LEU MD2 1 204 ILE MD 3.580 . 5.360 4.931 4.682 5.084 . 0 0 "[ . 1 . 2]" 1
587 1 136 LEU MD2 1 151 VAL MG2 2.800 . 3.800 3.511 3.342 3.591 . 0 0 "[ . 1 . 2]" 1
588 1 136 LEU MD2 1 151 VAL MG1 3.160 . 4.520 3.811 3.437 4.247 . 0 0 "[ . 1 . 2]" 1
589 1 113 LEU MD2 1 243 LEU MD1 3.520 . 5.240 4.733 4.496 4.945 . 0 0 "[ . 1 . 2]" 1
590 1 112 LEU MD2 1 115 MET ME 3.140 . 4.480 2.057 1.975 2.198 . 0 0 "[ . 1 . 2]" 1
591 1 99 LEU MD1 1 112 LEU MD2 2.950 . 4.100 2.854 2.691 3.024 . 0 0 "[ . 1 . 2]" 1
592 1 99 LEU MD2 1 112 LEU MD2 2.940 . 4.080 2.123 1.980 2.324 . 0 0 "[ . 1 . 2]" 1
593 1 126 LEU MD2 1 151 VAL MG1 3.270 . 4.740 3.029 2.762 3.369 . 0 0 "[ . 1 . 2]" 1
594 1 126 LEU MD2 1 151 VAL MG2 3.220 . 4.640 3.699 3.240 4.539 . 0 0 "[ . 1 . 2]" 1
595 1 70 LEU MD2 1 126 LEU MD2 3.270 . 4.740 2.102 1.756 2.717 0.044 13 0 "[ . 1 . 2]" 1
596 1 90 MET ME 1 142 LEU MD1 3.060 . 4.320 3.211 2.964 3.449 . 0 0 "[ . 1 . 2]" 1
597 1 142 LEU MD1 1 152 ALA MB 3.430 . 5.060 2.714 2.556 2.992 . 0 0 "[ . 1 . 2]" 1
598 1 71 VAL MG1 1 142 LEU MD1 2.940 . 4.080 2.219 2.036 2.427 . 0 0 "[ . 1 . 2]" 1
599 1 71 VAL MG2 1 142 LEU MD1 3.040 . 4.280 1.892 1.780 2.091 0.020 15 0 "[ . 1 . 2]" 1
600 1 142 LEU MD1 1 143 VAL MG1 4.350 . 6.900 6.700 6.555 6.780 . 0 0 "[ . 1 . 2]" 1
601 1 90 MET ME 1 148 LEU MD2 3.040 . 4.280 4.071 3.772 4.234 . 0 0 "[ . 1 . 2]" 1
602 1 183 LEU MD1 1 220 VAL MG1 3.380 . 4.960 3.122 2.424 3.487 . 0 0 "[ . 1 . 2]" 1
603 1 183 LEU MD2 1 220 VAL MG1 3.340 . 4.880 4.456 3.993 4.693 . 0 0 "[ . 1 . 2]" 1
604 1 200 LEU MD1 1 204 ILE MD 2.830 . 3.860 2.584 2.392 2.914 . 0 0 "[ . 1 . 2]" 1
605 1 119 ILE MD 1 200 LEU MD1 2.610 . 3.420 2.805 2.603 3.021 . 0 0 "[ . 1 . 2]" 1
606 1 138 ALA MB 1 200 LEU MD1 3.440 . 5.080 2.200 2.130 2.298 . 0 0 "[ . 1 . 2]" 1
607 1 95 LEU MD1 1 200 LEU MD1 3.340 . 4.880 4.393 4.256 4.532 . 0 0 "[ . 1 . 2]" 1
608 1 138 ALA MB 1 200 LEU MD2 3.230 . 4.660 4.228 4.121 4.347 . 0 0 "[ . 1 . 2]" 1
609 1 119 ILE MD 1 200 LEU MD2 2.540 . 3.280 1.785 1.722 2.058 0.078 1 0 "[ . 1 . 2]" 1
610 1 201 LEU MD2 1 268 MET ME 3.610 . 5.420 4.531 4.267 4.796 . 0 0 "[ . 1 . 2]" 1
611 1 201 LEU MD2 1 204 ILE MD 2.940 . 4.080 3.191 2.977 3.489 . 0 0 "[ . 1 . 2]" 1
612 1 201 LEU MD2 1 243 LEU MD2 3.340 . 4.880 4.347 4.136 4.472 . 0 0 "[ . 1 . 2]" 1
613 1 220 VAL MG2 1 223 LEU MD2 3.110 . 4.420 3.214 2.928 3.510 . 0 0 "[ . 1 . 2]" 1
614 1 220 VAL MG1 1 224 LEU MD2 3.380 . 4.960 3.278 2.853 3.453 . 0 0 "[ . 1 . 2]" 1
615 1 220 VAL MG2 1 224 LEU MD2 3.380 . 4.960 4.738 4.176 4.841 . 0 0 "[ . 1 . 2]" 1
616 1 240 VAL MG2 1 243 LEU MD1 2.920 . 4.040 3.831 3.565 4.000 . 0 0 "[ . 1 . 2]" 1
617 1 240 VAL MG1 1 243 LEU MD1 3.030 . 4.260 3.404 2.880 3.690 . 0 0 "[ . 1 . 2]" 1
618 1 243 LEU MD1 1 244 MET ME 3.500 . 5.200 5.020 4.919 5.144 . 0 0 "[ . 1 . 2]" 1
619 1 201 LEU MD1 1 243 LEU MD2 2.740 . 3.680 2.133 1.943 2.301 . 0 0 "[ . 1 . 2]" 1
620 1 243 LEU MD2 1 244 MET ME 3.380 . 4.960 4.744 4.596 4.885 . 0 0 "[ . 1 . 2]" 1
621 1 15 THR MG 1 32 VAL MG1 3.250 . 4.700 3.774 2.842 4.575 . 0 0 "[ . 1 . 2]" 1
622 1 32 VAL MG2 1 40 VAL MG2 3.270 . 4.740 4.274 4.137 4.389 . 0 0 "[ . 1 . 2]" 1
623 1 32 VAL MG1 1 40 VAL MG1 3.320 . 4.840 4.362 4.145 4.562 . 0 0 "[ . 1 . 2]" 1
624 1 40 VAL MG2 1 42 VAL MG2 2.910 . 4.020 2.301 2.125 2.531 . 0 0 "[ . 1 . 2]" 1
625 1 40 VAL MG2 1 42 VAL MG1 3.410 . 5.020 4.480 4.302 4.696 . 0 0 "[ . 1 . 2]" 1
626 1 32 VAL MG1 1 40 VAL MG2 3.560 . 5.320 4.678 4.405 4.931 . 0 0 "[ . 1 . 2]" 1
627 1 39 THR MG 1 40 VAL MG2 3.270 . 4.740 4.021 3.913 4.115 . 0 0 "[ . 1 . 2]" 1
628 1 42 VAL MG2 1 86 ILE MD 2.930 . 4.060 3.029 2.672 3.305 . 0 0 "[ . 1 . 2]" 1
629 1 42 VAL MG1 1 86 ILE MD 3.050 . 4.300 3.125 2.711 3.484 . 0 0 "[ . 1 . 2]" 1
630 1 45 LEU MD2 1 52 VAL MG2 2.660 . 3.520 2.230 1.833 2.915 . 0 0 "[ . 1 . 2]" 1
631 1 71 VAL MG1 1 142 LEU MD2 2.960 . 4.120 4.289 4.220 4.325 0.205 5 0 "[ . 1 . 2]" 1
632 1 71 VAL MG1 1 152 ALA MB 3.320 . 4.840 3.045 2.731 3.401 . 0 0 "[ . 1 . 2]" 1
633 1 71 VAL MG2 1 142 LEU MD2 2.980 . 4.160 3.765 3.657 3.841 . 0 0 "[ . 1 . 2]" 1
634 1 107 VAL MG1 1 115 MET ME 2.890 . 3.980 2.521 2.294 2.698 . 0 0 "[ . 1 . 2]" 1
635 1 107 VAL MG1 1 112 LEU MD2 2.840 . 3.880 1.962 1.889 2.005 . 0 0 "[ . 1 . 2]" 1
636 1 109 ALA MB 1 110 VAL MG2 3.520 . 5.240 4.845 4.628 4.985 . 0 0 "[ . 1 . 2]" 1
637 1 111 VAL MG2 1 115 MET ME 3.210 . 4.620 1.975 1.839 2.813 . 0 0 "[ . 1 . 2]" 1
638 1 111 VAL MG1 1 112 LEU MD2 3.270 . 4.740 2.973 2.309 3.084 . 0 0 "[ . 1 . 2]" 1
639 1 95 LEU MD1 1 143 VAL MG1 2.950 . 4.100 3.395 3.320 3.460 . 0 0 "[ . 1 . 2]" 1
640 1 99 LEU MD2 1 143 VAL MG1 3.290 . 4.780 4.496 4.258 4.628 . 0 0 "[ . 1 . 2]" 1
641 1 95 LEU MD1 1 143 VAL MG2 2.900 . 4.000 1.921 1.905 1.944 . 0 0 "[ . 1 . 2]" 1
642 1 99 LEU MD2 1 143 VAL MG2 3.040 . 4.280 3.884 3.681 4.065 . 0 0 "[ . 1 . 2]" 1
643 1 115 MET ME 1 143 VAL MG2 3.090 . 4.380 3.891 3.289 4.118 . 0 0 "[ . 1 . 2]" 1
644 1 90 MET ME 1 149 VAL MG1 3.440 . 5.080 4.126 3.719 4.250 . 0 0 "[ . 1 . 2]" 1
645 1 149 VAL MG1 1 204 ILE MD 2.960 . 4.120 3.757 3.433 3.928 . 0 0 "[ . 1 . 2]" 1
646 1 95 LEU MD1 1 149 VAL MG1 2.670 . 3.540 2.717 2.598 2.859 . 0 0 "[ . 1 . 2]" 1
647 1 149 VAL MG2 1 204 ILE MD 3.100 . 4.400 4.084 3.867 4.257 . 0 0 "[ . 1 . 2]" 1
648 1 90 MET ME 1 149 VAL MG2 3.330 . 4.860 4.482 4.205 4.617 . 0 0 "[ . 1 . 2]" 1
649 1 95 LEU MD1 1 149 VAL MG2 2.770 . 3.740 2.208 2.034 2.370 . 0 0 "[ . 1 . 2]" 1
650 1 217 LEU MD1 1 220 VAL MG1 2.900 . 4.000 3.686 3.588 3.753 . 0 0 "[ . 1 . 2]" 1
651 1 220 VAL MG1 1 224 LEU MD1 3.120 . 4.440 2.121 2.041 2.177 . 0 0 "[ . 1 . 2]" 1
652 1 217 LEU MD1 1 220 VAL MG2 3.270 . 4.740 3.208 3.059 3.325 . 0 0 "[ . 1 . 2]" 1
653 1 220 VAL MG2 1 224 LEU MD1 3.080 . 4.360 4.197 4.160 4.234 . 0 0 "[ . 1 . 2]" 1
654 1 240 VAL MG2 1 244 MET ME 3.310 . 4.820 4.320 4.115 4.503 . 0 0 "[ . 1 . 2]" 1
655 1 201 LEU MD2 1 240 VAL MG2 3.280 . 4.760 3.980 3.735 4.097 . 0 0 "[ . 1 . 2]" 1
656 1 240 VAL MG1 1 243 LEU MD2 3.440 . 5.080 4.299 3.915 4.728 . 0 0 "[ . 1 . 2]" 1
657 1 243 LEU MD1 1 268 MET ME 2.460 . 3.120 2.048 1.921 2.138 . 0 0 "[ . 1 . 2]" 1
658 1 61 VAL MG2 1 159 LEU MD2 3.850 . 5.900 4.325 2.640 4.895 . 0 0 "[ . 1 . 2]" 1
659 1 61 VAL MG2 1 159 LEU MD1 3.850 . 5.900 4.544 3.624 4.976 . 0 0 "[ . 1 . 2]" 1
660 1 61 VAL MG2 1 65 ILE MD 3.380 . 4.960 4.423 4.231 4.665 . 0 0 "[ . 1 . 2]" 1
661 1 65 ILE MD 1 122 ALA MB 3.950 . 6.100 5.164 4.825 5.520 . 0 0 "[ . 1 . 2]" 1
662 1 73 LEU MD1 1 85 ILE MD 3.740 . 5.670 3.505 3.004 4.220 . 0 0 "[ . 1 . 2]" 1
663 1 56 LEU MD1 1 85 ILE MD 3.440 . 5.080 3.738 2.303 4.627 . 0 0 "[ . 1 . 2]" 1
664 1 40 VAL MG2 1 86 ILE MD 2.990 . 4.180 3.728 3.450 3.987 . 0 0 "[ . 1 . 2]" 1
665 1 16 MET ME 1 86 ILE MD 3.560 . 5.320 4.363 2.941 5.076 . 0 0 "[ . 1 . 2]" 1
666 1 95 LEU MD1 1 119 ILE MD 3.220 . 4.640 3.767 3.550 3.930 . 0 0 "[ . 1 . 2]" 1
667 1 119 ILE MD 1 143 VAL MG1 4.100 . 6.400 5.939 5.729 6.052 . 0 0 "[ . 1 . 2]" 1
668 1 119 ILE MD 1 143 VAL MG2 3.430 . 5.060 4.683 4.533 4.803 . 0 0 "[ . 1 . 2]" 1
669 1 200 LEU MD2 1 204 ILE MD 2.740 . 3.680 3.154 2.975 3.284 . 0 0 "[ . 1 . 2]" 1
670 1 99 LEU MD1 1 204 ILE MD 3.140 . 4.480 3.889 3.705 3.988 . 0 0 "[ . 1 . 2]" 1
671 1 201 LEU MD1 1 204 ILE MD 3.780 . 5.760 5.034 4.853 5.312 . 0 0 "[ . 1 . 2]" 1
672 1 116 ALA MB 1 204 ILE MD 2.780 . 3.760 2.323 2.179 2.710 . 0 0 "[ . 1 . 2]" 1
673 1 215 ILE MD 1 217 LEU MD1 3.930 . 6.060 5.799 5.671 5.934 . 0 0 "[ . 1 . 2]" 1
674 1 215 ILE MD 1 217 LEU MD2 3.340 . 4.880 4.641 4.500 4.718 . 0 0 "[ . 1 . 2]" 1
675 1 201 LEU MD1 1 261 ILE MD 3.800 . 5.800 4.923 4.607 5.253 . 0 0 "[ . 1 . 2]" 1
676 1 274 ILE MD 1 278 VAL MG2 2.770 . 3.740 2.792 1.902 3.598 . 0 0 "[ . 1 . 2]" 1
677 1 14 ILE MD 1 16 MET ME 3.010 . 4.220 3.565 2.463 4.046 . 0 0 "[ . 1 . 2]" 1
678 1 49 THR MG 1 50 MET ME 3.290 . 4.780 3.696 1.902 4.263 . 0 0 "[ . 1 . 2]" 1
679 1 71 VAL MG2 1 90 MET ME 3.210 . 4.620 3.209 2.535 3.992 . 0 0 "[ . 1 . 2]" 1
680 1 71 VAL MG1 1 90 MET ME 3.660 . 5.520 4.413 3.993 5.002 . 0 0 "[ . 1 . 2]" 1
681 1 90 MET ME 1 148 LEU MD1 2.790 . 3.780 2.199 2.012 2.352 . 0 0 "[ . 1 . 2]" 1
682 1 123 MET ME 1 151 VAL MG1 3.330 . 4.860 3.639 3.380 3.983 . 0 0 "[ . 1 . 2]" 1
683 1 123 MET ME 1 136 LEU MD2 2.910 . 4.020 2.028 1.819 2.295 . 0 0 "[ . 1 . 2]" 1
684 1 132 ILE MD 1 160 MET ME 2.870 . 3.940 3.018 1.935 3.923 . 0 0 "[ . 1 . 2]" 1
685 1 113 LEU MD2 1 268 MET ME 2.480 . 3.160 2.450 1.965 3.064 . 0 0 "[ . 1 . 2]" 1
686 1 113 LEU MD1 1 268 MET ME 2.500 . 3.200 2.068 1.872 2.593 . 0 0 "[ . 1 . 2]" 1
687 1 201 LEU MD1 1 268 MET ME 3.120 . 4.440 4.045 3.795 4.173 . 0 0 "[ . 1 . 2]" 1
688 1 28 VAL MG2 1 41 ALA MB 3.340 . 4.880 4.322 3.856 4.640 . 0 0 "[ . 1 . 2]" 1
689 1 28 VAL MG1 1 41 ALA MB 3.080 . 4.360 2.532 2.103 2.923 . 0 0 "[ . 1 . 2]" 1
690 1 20 LEU MD1 1 41 ALA MB 3.380 . 4.960 2.610 2.283 3.715 . 0 0 "[ . 1 . 2]" 1
691 1 40 VAL MG2 1 41 ALA MB 3.700 . 5.600 4.382 4.302 4.450 . 0 0 "[ . 1 . 2]" 1
692 1 109 ALA MB 1 110 VAL MG1 3.520 . 5.240 4.062 3.917 4.233 . 0 0 "[ . 1 . 2]" 1
693 1 109 ALA MB 1 112 LEU MD1 3.630 . 5.460 3.779 3.478 4.060 . 0 0 "[ . 1 . 2]" 1
694 1 109 ALA MB 1 112 LEU MD2 3.980 . 6.160 5.634 5.441 5.844 . 0 0 "[ . 1 . 2]" 1
695 1 113 LEU MD2 1 116 ALA MB 3.680 . 5.560 5.085 4.875 5.194 . 0 0 "[ . 1 . 2]" 1
696 1 113 LEU MD1 1 116 ALA MB 3.490 . 5.180 2.778 2.492 2.960 . 0 0 "[ . 1 . 2]" 1
697 1 99 LEU MD1 1 138 ALA MB 3.430 . 5.060 3.231 3.009 3.367 . 0 0 "[ . 1 . 2]" 1
698 1 71 VAL MG2 1 152 ALA MB 3.530 . 5.260 1.762 1.657 1.886 0.143 17 0 "[ . 1 . 2]" 1
699 1 136 LEU MD1 1 196 ALA MB 3.650 . 5.500 4.393 4.249 4.539 . 0 0 "[ . 1 . 2]" 1
700 1 113 LEU MD1 1 205 ALA MB 3.700 . 5.600 4.993 4.629 5.334 . 0 0 "[ . 1 . 2]" 1
701 1 205 ALA MB 1 240 VAL MG2 3.900 . 6.000 4.980 4.682 5.111 . 0 0 "[ . 1 . 2]" 1
702 1 151 VAL MG1 1 152 ALA MB 4.160 . 6.520 4.101 4.015 4.157 . 0 0 "[ . 1 . 2]" 1
703 1 264 ALA MB 1 267 THR MG 3.120 . 4.440 3.494 3.285 4.036 . 0 0 "[ . 1 . 2]" 1
704 1 243 LEU MD1 1 267 THR MG 3.630 . 5.460 4.594 4.286 5.244 . 0 0 "[ . 1 . 2]" 1
705 1 20 LEU MD2 1 41 ALA MB 3.380 . 4.960 4.451 3.137 4.702 . 0 0 "[ . 1 . 2]" 1
706 1 38 LEU MD2 1 74 LEU MD2 3.080 . 4.360 3.924 3.560 4.114 . 0 0 "[ . 1 . 2]" 1
707 1 38 LEU MD2 1 40 VAL MG2 3.090 . 4.380 4.122 4.062 4.169 . 0 0 "[ . 1 . 2]" 1
708 1 38 LEU MD2 1 40 VAL MG1 2.420 . 3.040 1.967 1.924 2.054 . 0 0 "[ . 1 . 2]" 1
709 1 38 LEU MD2 1 39 THR MG 3.070 . 4.340 4.569 4.524 4.599 0.259 2 0 "[ . 1 . 2]" 1
710 1 38 LEU MD1 1 40 VAL MG1 2.380 . 2.960 2.265 2.194 2.317 . 0 0 "[ . 1 . 2]" 1
711 1 38 LEU MD1 1 74 LEU MD1 2.670 . 3.540 2.259 1.856 2.762 . 0 0 "[ . 1 . 2]" 1
712 1 32 VAL MG1 1 38 LEU MD1 2.990 . 4.180 3.785 3.682 3.845 . 0 0 "[ . 1 . 2]" 1
713 1 38 LEU MD1 1 39 THR MG 3.770 . 5.740 5.603 5.551 5.645 . 0 0 "[ . 1 . 2]" 1
714 1 45 LEU MD1 1 52 VAL MG2 3.200 . 4.600 3.901 2.777 4.401 . 0 0 "[ . 1 . 2]" 1
715 1 20 LEU MD1 1 39 THR MG 3.480 . 5.160 4.487 3.869 4.903 . 0 0 "[ . 1 . 2]" 1
716 1 20 LEU MD2 1 39 THR MG 3.480 . 5.160 4.520 4.014 4.906 . 0 0 "[ . 1 . 2]" 1
717 1 52 VAL MG1 1 56 LEU MD1 2.760 . 3.720 3.227 3.078 3.312 . 0 0 "[ . 1 . 2]" 1
718 1 73 LEU MD1 1 76 VAL MG2 3.550 . 5.300 4.125 3.580 4.338 . 0 0 "[ . 1 . 2]" 1
719 1 38 LEU MD2 1 74 LEU MD1 3.080 . 4.360 2.263 1.996 2.875 . 0 0 "[ . 1 . 2]" 1
720 1 38 LEU MD1 1 74 LEU MD2 2.670 . 3.540 3.158 2.837 3.404 . 0 0 "[ . 1 . 2]" 1
721 1 95 LEU MD2 1 112 LEU MD2 3.620 . 5.440 5.027 4.831 5.176 . 0 0 "[ . 1 . 2]" 1
722 1 95 LEU MD1 1 99 LEU MD1 2.700 . 3.600 2.138 2.060 2.205 . 0 0 "[ . 1 . 2]" 1
723 1 96 LEU MD1 1 99 LEU MD2 4.160 . 6.520 5.682 5.537 5.806 . 0 0 "[ . 1 . 2]" 1
724 1 96 LEU MD1 1 137 ALA MB 4.400 . 7.000 4.813 4.508 4.987 . 0 0 "[ . 1 . 2]" 1
725 1 96 LEU MD1 1 200 LEU MD1 3.620 . 5.440 4.454 4.313 4.596 . 0 0 "[ . 1 . 2]" 1
726 1 96 LEU MD2 1 200 LEU MD1 3.550 . 5.300 5.079 5.041 5.137 . 0 0 "[ . 1 . 2]" 1
727 1 95 LEU MD2 1 99 LEU MD2 3.150 . 4.500 4.250 4.107 4.318 . 0 0 "[ . 1 . 2]" 1
728 1 95 LEU MD1 1 99 LEU MD2 2.760 . 3.720 2.401 2.202 2.485 . 0 0 "[ . 1 . 2]" 1
729 1 99 LEU MD2 1 111 VAL MG2 3.310 . 4.820 4.451 4.202 4.559 . 0 0 "[ . 1 . 2]" 1
730 1 96 LEU MD1 1 99 LEU MD1 3.050 . 4.300 3.620 3.479 3.702 . 0 0 "[ . 1 . 2]" 1
731 1 95 LEU MD2 1 99 LEU MD1 2.590 . 3.380 3.041 2.960 3.183 . 0 0 "[ . 1 . 2]" 1
732 1 99 LEU MD1 1 143 VAL MG2 3.270 . 4.740 4.476 4.403 4.566 . 0 0 "[ . 1 . 2]" 1
733 1 99 LEU MD2 1 112 LEU MD1 2.950 . 4.100 3.796 3.645 3.923 . 0 0 "[ . 1 . 2]" 1
734 1 107 VAL MG1 1 112 LEU MD1 2.910 . 4.020 3.118 2.869 3.211 . 0 0 "[ . 1 . 2]" 1
735 1 111 VAL MG2 1 112 LEU MD2 3.200 . 4.590 3.386 3.287 3.483 . 0 0 "[ . 1 . 2]" 1
736 1 95 LEU MD1 1 112 LEU MD2 3.090 . 4.380 3.929 3.762 4.013 . 0 0 "[ . 1 . 2]" 1
737 1 113 LEU MD2 1 240 VAL MG1 3.100 . 4.400 3.777 3.549 4.073 . 0 0 "[ . 1 . 2]" 1
738 1 113 LEU MD1 1 240 VAL MG1 2.590 . 3.380 2.180 2.069 2.467 . 0 0 "[ . 1 . 2]" 1
739 1 113 LEU MD1 1 243 LEU MD1 3.200 . 4.590 3.386 3.210 3.529 . 0 0 "[ . 1 . 2]" 1
740 1 70 LEU MD2 1 126 LEU MD1 2.970 . 4.140 2.845 1.728 3.156 0.072 17 0 "[ . 1 . 2]" 1
741 1 122 ALA MB 1 136 LEU MD2 3.750 . 5.700 5.159 4.948 5.262 . 0 0 "[ . 1 . 2]" 1
742 1 136 LEU MD1 1 151 VAL MG1 2.910 . 4.020 2.217 2.049 2.613 . 0 0 "[ . 1 . 2]" 1
743 1 142 LEU MD1 1 148 LEU MD1 3.560 . 5.320 5.470 5.193 5.746 0.426 5 0 "[ . 1 . 2]" 1
744 1 178 THR MG 1 183 LEU MD1 3.410 . 5.020 3.524 3.223 3.777 . 0 0 "[ . 1 . 2]" 1
745 1 95 LEU MD2 1 200 LEU MD1 2.460 . 3.120 2.083 1.907 2.293 . 0 0 "[ . 1 . 2]" 1
746 1 151 VAL MG2 1 200 LEU MD2 2.800 . 3.800 3.476 3.222 3.588 . 0 0 "[ . 1 . 2]" 1
747 1 136 LEU MD1 1 200 LEU MD2 2.500 . 3.200 2.245 2.170 2.327 . 0 0 "[ . 1 . 2]" 1
748 1 201 LEU MD1 1 205 ALA MB 3.670 . 5.540 4.876 4.666 5.064 . 0 0 "[ . 1 . 2]" 1
749 1 201 LEU MD1 1 240 VAL MG2 3.190 . 4.580 4.342 4.133 4.427 . 0 0 "[ . 1 . 2]" 1
750 1 201 LEU MD1 1 240 VAL MG1 2.970 . 4.140 2.529 2.284 2.754 . 0 0 "[ . 1 . 2]" 1
751 1 113 LEU MD1 1 201 LEU MD1 3.040 . 4.280 3.609 3.226 3.805 . 0 0 "[ . 1 . 2]" 1
752 1 201 LEU MD1 1 243 LEU MD1 2.960 . 4.120 2.698 2.274 2.968 . 0 0 "[ . 1 . 2]" 1
753 1 201 LEU MD2 1 205 ALA MB 3.590 . 5.380 3.051 2.919 3.191 . 0 0 "[ . 1 . 2]" 1
754 1 113 LEU MD1 1 201 LEU MD2 3.100 . 4.400 2.818 2.386 3.006 . 0 0 "[ . 1 . 2]" 1
755 1 201 LEU MD2 1 240 VAL MG1 3.090 . 4.380 2.174 2.068 2.355 . 0 0 "[ . 1 . 2]" 1
756 1 220 VAL MG2 1 223 LEU MD1 2.870 . 3.940 3.346 3.020 3.506 . 0 0 "[ . 1 . 2]" 1
757 1 220 VAL MG1 1 223 LEU MD1 2.480 . 3.160 2.946 2.787 3.025 . 0 0 "[ . 1 . 2]" 1
758 1 215 ILE MD 1 223 LEU MD1 2.360 . 2.920 2.138 1.998 2.334 . 0 0 "[ . 1 . 2]" 1
759 1 215 ILE MD 1 223 LEU MD2 2.460 . 3.120 1.822 1.726 2.060 0.074 15 0 "[ . 1 . 2]" 1
760 1 183 LEU MD2 1 224 LEU MD1 3.310 . 4.820 4.312 3.837 4.635 . 0 0 "[ . 1 . 2]" 1
761 1 183 LEU MD1 1 224 LEU MD2 3.560 . 5.320 4.562 4.220 4.785 . 0 0 "[ . 1 . 2]" 1
762 1 243 LEU MD1 1 264 ALA MB 2.550 . 3.300 2.234 2.062 2.335 . 0 0 "[ . 1 . 2]" 1
763 1 243 LEU MD2 1 264 ALA MB 2.600 . 3.400 2.962 2.779 3.090 . 0 0 "[ . 1 . 2]" 1
764 1 32 VAL MG2 1 38 LEU MD1 3.480 . 5.160 4.958 4.756 5.096 . 0 0 "[ . 1 . 2]" 1
765 1 32 VAL MG2 1 38 LEU MD2 3.400 . 5.000 5.130 4.987 5.210 0.210 15 0 "[ . 1 . 2]" 1
766 1 32 VAL MG2 1 39 THR MG 2.780 . 3.760 2.849 2.609 3.111 . 0 0 "[ . 1 . 2]" 1
767 1 32 VAL MG1 1 38 LEU MD2 3.460 . 5.120 4.811 4.596 4.910 . 0 0 "[ . 1 . 2]" 1
768 1 38 LEU MD1 1 40 VAL MG2 2.980 . 4.160 3.994 3.850 4.055 . 0 0 "[ . 1 . 2]" 1
769 1 9 MET ME 1 40 VAL MG2 3.090 . 4.380 3.961 3.682 4.117 . 0 0 "[ . 1 . 2]" 1
770 1 40 VAL MG2 1 74 LEU MD1 2.880 . 3.960 3.793 3.749 3.848 . 0 0 "[ . 1 . 2]" 1
771 1 40 VAL MG2 1 74 LEU MD2 2.880 . 3.960 2.988 2.283 3.403 . 0 0 "[ . 1 . 2]" 1
772 1 40 VAL MG1 1 42 VAL MG2 3.600 . 5.400 4.493 4.327 4.714 . 0 0 "[ . 1 . 2]" 1
773 1 45 LEU MD2 1 52 VAL MG1 3.210 . 4.620 3.668 2.887 4.219 . 0 0 "[ . 1 . 2]" 1
774 1 52 VAL MG2 1 56 LEU MD2 2.480 . 3.160 2.975 1.878 3.132 . 0 0 "[ . 1 . 2]" 1
775 1 56 LEU MD1 1 76 VAL MG2 3.760 . 5.720 5.107 4.353 5.415 . 0 0 "[ . 1 . 2]" 1
776 1 73 LEU MD2 1 76 VAL MG2 3.550 . 5.300 3.325 2.532 3.789 . 0 0 "[ . 1 . 2]" 1
777 1 59 ALA MB 1 76 VAL MG2 4.000 . 6.200 3.128 2.652 3.873 . 0 0 "[ . 1 . 2]" 1
778 1 107 VAL MG2 1 112 LEU MD2 2.910 . 4.020 3.995 3.913 4.072 0.052 2 0 "[ . 1 . 2]" 1
779 1 107 VAL MG2 1 115 MET ME 2.940 . 4.080 3.544 3.108 3.674 . 0 0 "[ . 1 . 2]" 1
780 1 107 VAL MG1 1 111 VAL MG1 2.950 . 4.100 2.311 1.977 2.464 . 0 0 "[ . 1 . 2]" 1
781 1 107 VAL MG2 1 111 VAL MG1 3.000 . 4.200 3.130 2.820 3.314 . 0 0 "[ . 1 . 2]" 1
782 1 111 VAL MG1 1 112 LEU MD1 3.080 . 4.360 4.061 3.727 4.171 . 0 0 "[ . 1 . 2]" 1
783 1 107 VAL MG1 1 111 VAL MG2 2.850 . 3.900 2.948 2.860 3.080 . 0 0 "[ . 1 . 2]" 1
784 1 107 VAL MG2 1 111 VAL MG2 2.910 . 4.020 3.191 2.874 3.326 . 0 0 "[ . 1 . 2]" 1
785 1 111 VAL MG2 1 149 VAL MG2 3.450 . 5.100 4.472 4.144 4.691 . 0 0 "[ . 1 . 2]" 1
786 1 143 VAL MG1 1 149 VAL MG2 2.880 . 3.960 2.099 1.985 2.217 . 0 0 "[ . 1 . 2]" 1
787 1 143 VAL MG1 1 149 VAL MG1 2.950 . 4.100 3.836 3.758 3.881 . 0 0 "[ . 1 . 2]" 1
788 1 143 VAL MG1 1 148 LEU MD2 3.460 . 5.120 4.937 4.897 4.978 . 0 0 "[ . 1 . 2]" 1
789 1 143 VAL MG2 1 149 VAL MG2 2.780 . 3.760 1.756 1.717 1.795 0.083 13 0 "[ . 1 . 2]" 1
790 1 143 VAL MG2 1 149 VAL MG1 2.720 . 3.640 2.374 2.233 2.460 . 0 0 "[ . 1 . 2]" 1
791 1 119 ILE MD 1 149 VAL MG1 2.660 . 3.520 1.886 1.800 2.027 . 0 0 "[ . 1 . 2]" 1
792 1 70 LEU MD2 1 151 VAL MG1 3.270 . 4.740 2.821 2.706 2.969 . 0 0 "[ . 1 . 2]" 1
793 1 126 LEU MD1 1 151 VAL MG1 3.620 . 5.440 4.468 3.605 4.906 . 0 0 "[ . 1 . 2]" 1
794 1 70 LEU MD1 1 151 VAL MG1 3.400 . 5.000 4.699 4.628 4.740 . 0 0 "[ . 1 . 2]" 1
795 1 194 VAL MG1 1 261 ILE MD 2.760 . 3.720 1.880 1.768 2.182 0.032 10 0 "[ . 1 . 2]" 1
796 1 217 LEU MD2 1 220 VAL MG2 3.020 . 4.240 1.973 1.882 2.058 . 0 0 "[ . 1 . 2]" 1
797 1 217 LEU MD2 1 220 VAL MG1 2.740 . 3.680 3.251 3.065 3.384 . 0 0 "[ . 1 . 2]" 1
798 1 14 ILE MD 1 40 VAL MG1 3.010 . 4.220 3.649 3.496 3.976 . 0 0 "[ . 1 . 2]" 1
799 1 9 MET ME 1 14 ILE MD 2.580 . 3.360 2.987 2.632 3.193 . 0 0 "[ . 1 . 2]" 1
800 1 14 ILE MD 1 86 ILE MD 2.600 . 3.400 2.050 1.862 2.122 . 0 0 "[ . 1 . 2]" 1
801 1 14 ILE MD 1 40 VAL MG2 2.800 . 3.800 2.032 1.934 2.304 . 0 0 "[ . 1 . 2]" 1
802 1 73 LEU MD2 1 85 ILE MD 3.740 . 5.670 4.195 3.613 5.032 . 0 0 "[ . 1 . 2]" 1
803 1 119 ILE MD 1 151 VAL MG2 3.150 . 4.500 3.590 3.367 3.893 . 0 0 "[ . 1 . 2]" 1
804 1 95 LEU MD2 1 204 ILE MD 2.820 . 3.840 2.340 2.228 2.422 . 0 0 "[ . 1 . 2]" 1
805 1 215 ILE MD 1 220 VAL MG2 2.810 . 3.820 1.994 1.925 2.175 . 0 0 "[ . 1 . 2]" 1
806 1 274 ILE MD 1 278 VAL MG1 2.880 . 3.960 2.975 2.101 3.845 . 0 0 "[ . 1 . 2]" 1
807 1 115 MET ME 1 149 VAL MG2 2.980 . 4.160 3.123 2.312 3.405 . 0 0 "[ . 1 . 2]" 1
808 1 99 LEU MD1 1 115 MET ME 2.810 . 3.820 3.438 3.116 3.632 . 0 0 "[ . 1 . 2]" 1
809 1 65 ILE MD 1 154 PHE HE1 3.720 . 5.640 2.837 2.435 3.292 . 0 0 "[ . 1 . 2]" 1
810 1 126 LEU MD2 1 154 PHE HE1 3.550 . 5.300 2.535 1.786 3.394 0.014 11 0 "[ . 1 . 2]" 1
811 1 151 VAL MG1 1 154 PHE HE1 3.340 . 4.880 3.208 2.475 3.923 . 0 0 "[ . 1 . 2]" 1
812 1 70 LEU MD1 1 154 PHE HE1 3.280 . 4.760 3.696 2.870 4.325 . 0 0 "[ . 1 . 2]" 1
813 1 151 VAL MG2 1 154 PHE HE1 3.820 . 5.840 5.225 4.480 5.676 . 0 0 "[ . 1 . 2]" 1
814 1 126 LEU MD1 1 154 PHE HE1 3.160 . 4.520 2.851 1.830 3.758 . 0 0 "[ . 1 . 2]" 1
815 1 71 VAL MG1 1 154 PHE HE2 3.180 . 4.560 4.152 3.520 4.356 . 0 0 "[ . 1 . 2]" 1
816 1 70 LEU MD2 1 154 PHE HE1 3.090 . 4.380 2.433 1.896 3.046 . 0 0 "[ . 1 . 2]" 1
817 1 52 VAL MG1 1 83 PHE HE2 2.740 . 3.680 2.620 2.017 3.291 . 0 0 "[ . 1 . 2]" 1
818 1 52 VAL MG2 1 83 PHE HE2 2.860 . 3.920 2.533 2.079 3.378 . 0 0 "[ . 1 . 2]" 1
819 1 56 LEU MD2 1 83 PHE HE2 2.970 . 4.140 3.584 3.128 3.980 . 0 0 "[ . 1 . 2]" 1
820 1 56 LEU MD1 1 83 PHE HE2 3.030 . 4.260 4.095 3.679 4.258 . 0 0 "[ . 1 . 2]" 1
821 1 131 PHE HE1 1 159 LEU MD1 2.950 . 4.100 2.818 2.166 3.764 . 0 0 "[ . 1 . 2]" 1
822 1 131 PHE HE1 1 159 LEU MD2 2.950 . 4.100 3.068 1.860 4.004 . 0 0 "[ . 1 . 2]" 1
823 1 61 VAL MG1 1 131 PHE HE2 2.810 . 3.820 2.954 2.035 3.534 . 0 0 "[ . 1 . 2]" 1
824 1 61 VAL MG2 1 131 PHE HE2 2.690 . 3.580 3.456 1.920 3.892 0.312 13 0 "[ . 1 . 2]" 1
825 1 71 VAL H 1 154 PHE HE2 3.530 . 5.260 3.986 3.218 4.756 . 0 0 "[ . 1 . 2]" 1
826 1 265 PHE HE1 1 268 MET ME 2.880 . 3.960 3.306 3.018 3.735 . 0 0 "[ . 1 . 2]" 1
827 1 240 VAL MG2 1 265 PHE HE1 2.950 . 4.100 4.016 3.919 4.103 0.003 3 0 "[ . 1 . 2]" 1
828 1 113 LEU MD1 1 265 PHE HE1 2.850 . 3.900 2.061 1.824 2.377 . 0 0 "[ . 1 . 2]" 1
829 1 240 VAL MG1 1 265 PHE HE1 2.870 . 3.940 3.000 2.755 3.376 . 0 0 "[ . 1 . 2]" 1
830 1 201 LEU MD1 1 265 PHE HE1 3.130 . 4.460 2.563 2.170 3.155 . 0 0 "[ . 1 . 2]" 1
831 1 201 LEU MD2 1 265 PHE HE1 3.210 . 4.620 2.628 2.314 3.141 . 0 0 "[ . 1 . 2]" 1
832 1 243 LEU MD2 1 265 PHE HE1 3.420 . 5.040 4.097 3.652 4.563 . 0 0 "[ . 1 . 2]" 1
833 1 243 LEU MD1 1 265 PHE HE1 3.210 . 4.620 2.894 2.547 3.142 . 0 0 "[ . 1 . 2]" 1
834 1 20 LEU MD2 1 89 PHE HE1 2.830 . 3.860 2.265 1.862 2.879 . 0 0 "[ . 1 . 2]" 1
835 1 20 LEU MD1 1 89 PHE HE1 2.830 . 3.860 2.293 1.804 2.998 . 0 0 "[ . 1 . 2]" 1
836 1 123 MET ME 1 154 PHE HE1 4.080 . 6.360 5.468 4.932 6.020 . 0 0 "[ . 1 . 2]" 1
837 1 9 MET ME 1 74 LEU QD 3.290 . 4.780 2.147 1.936 2.330 . 0 0 "[ . 1 . 2]" 1
838 1 9 MET CE 1 74 LEU QD 3.000 . 4.200 2.883 2.695 3.078 . 0 0 "[ . 1 . 2]" 1
839 1 14 ILE MD 1 74 LEU QD 2.830 . 3.860 3.522 3.203 3.715 . 0 0 "[ . 1 . 2]" 1
840 1 14 ILE CD1 1 74 LEU QD 3.350 . 4.900 4.543 4.200 4.713 . 0 0 "[ . 1 . 2]" 1
841 1 20 LEU QD 1 28 VAL CG1 2.650 . 3.500 2.864 2.534 3.301 . 0 0 "[ . 1 . 2]" 1
842 1 20 LEU QD 1 39 THR MG 3.120 . 4.440 3.999 3.527 4.192 . 0 0 "[ . 1 . 2]" 1
843 1 20 LEU QD 1 41 ALA MB 2.990 . 4.180 2.563 2.276 3.149 . 0 0 "[ . 1 . 2]" 1
844 1 20 LEU QD 1 41 ALA CB 3.080 . 4.360 3.267 2.895 3.958 . 0 0 "[ . 1 . 2]" 1
845 1 38 LEU MD1 1 74 LEU QD 2.380 . 2.970 2.196 1.843 2.590 . 0 0 "[ . 1 . 2]" 1
846 1 38 LEU MD2 1 74 LEU QD 2.480 . 3.160 2.249 1.986 2.822 . 0 0 "[ . 1 . 2]" 1
847 1 38 LEU CD1 1 74 LEU QD 2.790 . 3.780 3.083 2.769 3.417 . 0 0 "[ . 1 . 2]" 1
848 1 40 VAL MG2 1 74 LEU QD 2.610 . 3.420 2.873 2.266 3.167 . 0 0 "[ . 1 . 2]" 1
849 1 42 VAL MG2 1 74 LEU QD 3.220 . 4.640 4.392 4.264 4.492 . 0 0 "[ . 1 . 2]" 1
850 1 59 ALA MB 1 73 LEU QD 3.430 . 5.060 3.204 2.686 3.540 . 0 0 "[ . 1 . 2]" 1
851 1 61 VAL MG2 1 159 LEU QD 3.210 . 4.620 3.900 2.579 4.396 . 0 0 "[ . 1 . 2]" 1
852 1 62 MET ME 1 73 LEU QD 2.940 . 4.080 2.450 1.772 3.535 0.028 4 0 "[ . 1 . 2]" 1
853 1 62 MET CE 1 73 LEU QD 3.140 . 4.480 3.050 2.430 3.960 . 0 0 "[ . 1 . 2]" 1
854 1 73 LEU QD 1 76 VAL MG1 3.210 . 4.620 1.818 1.728 1.965 0.072 17 0 "[ . 1 . 2]" 1
855 1 73 LEU QD 1 76 VAL MG2 3.040 . 4.280 3.190 2.483 3.560 . 0 0 "[ . 1 . 2]" 1
856 1 73 LEU QD 1 76 VAL CG2 3.320 . 4.840 3.848 3.186 4.218 . 0 0 "[ . 1 . 2]" 1
857 1 73 LEU QD 1 85 ILE MD 3.180 . 4.560 3.335 2.864 4.011 . 0 0 "[ . 1 . 2]" 1
858 1 74 LEU QD 1 86 ILE CD1 3.520 . 5.240 4.380 4.086 4.592 . 0 0 "[ . 1 . 2]" 1
859 1 109 ALA MB 1 110 VAL QG 3.140 . 4.480 3.862 3.750 3.969 . 0 0 "[ . 1 . 2]" 1
860 1 131 PHE HE1 1 159 LEU QD 2.680 . 3.560 2.481 1.836 3.207 . 0 0 "[ . 1 . 2]" 1
861 1 159 LEU QD 1 161 THR MG 3.010 . 4.220 2.917 2.140 3.593 . 0 0 "[ . 1 . 2]" 1
862 1 159 LEU QD 1 161 THR CG2 3.370 . 4.940 3.742 2.830 4.582 . 0 0 "[ . 1 . 2]" 1
863 1 194 VAL QG 1 261 ILE MD 2.530 . 3.260 1.850 1.712 2.148 0.088 15 0 "[ . 1 . 2]" 1
864 1 194 VAL QG 1 261 ILE CD1 2.640 . 3.480 2.581 2.424 2.845 . 0 0 "[ . 1 . 2]" 1
865 1 199 VAL QG 1 230 MET ME 2.730 . 3.660 2.095 1.764 2.730 0.036 9 0 "[ . 1 . 2]" 1
866 1 199 VAL QG 1 230 MET CE 2.880 . 3.960 2.874 2.521 3.574 . 0 0 "[ . 1 . 2]" 1
867 1 278 VAL CG1 1 282 LEU QD 2.310 . 2.820 2.592 2.415 2.743 . 0 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 24
_Distance_constraint_stats_list.Viol_count 212
_Distance_constraint_stats_list.Viol_total 594.545
_Distance_constraint_stats_list.Viol_max 1.021
_Distance_constraint_stats_list.Viol_rms 0.1175
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0619
_Distance_constraint_stats_list.Viol_average_violations_only 0.1402
_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
1 109 ALA 0.981 0.220 10 0 "[ . 1 . 2]"
1 110 VAL 2.484 0.467 10 0 "[ . 1 . 2]"
1 111 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 112 LEU 4.653 0.448 5 0 "[ . 1 . 2]"
1 113 LEU 4.051 0.558 7 1 "[ . + 1 . 2]"
1 114 TYR 6.997 1.021 7 1 "[ . + 1 . 2]"
1 115 MET 3.497 0.335 7 0 "[ . 1 . 2]"
1 116 ALA 5.423 0.448 5 0 "[ . 1 . 2]"
1 117 THR 6.948 0.558 7 2 "[ . + 1 -. 2]"
1 118 GLN 8.721 1.021 7 2 "[ . + 1 -. 2]"
1 119 ILE 3.580 0.335 7 0 "[ . 1 . 2]"
1 120 SER 2.359 0.545 16 1 "[ . 1 .+ 2]"
1 121 SER 3.879 0.539 14 1 "[ . 1 +. 2]"
1 122 ALA 4.208 0.582 14 1 "[ . 1 +. 2]"
1 123 MET 0.083 0.079 16 0 "[ . 1 . 2]"
1 124 GLU 1.590 0.545 16 1 "[ . 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 1 109 ALA O 1 113 LEU N 2.930 2.780 3.150 3.055 2.912 3.277 0.127 10 0 "[ . 1 . 2]" 2
2 1 109 ALA O 1 113 LEU H 1.950 . 2.100 2.109 1.973 2.320 0.220 10 0 "[ . 1 . 2]" 2
3 1 110 VAL O 1 114 TYR N 2.930 2.780 3.150 3.048 2.848 3.466 0.316 10 0 "[ . 1 . 2]" 2
4 1 110 VAL O 1 114 TYR H 1.950 . 2.100 2.200 2.027 2.567 0.467 10 0 "[ . 1 . 2]" 2
5 1 111 VAL O 1 115 MET N 2.930 2.780 3.150 2.847 2.793 2.923 . 0 0 "[ . 1 . 2]" 2
6 1 111 VAL O 1 115 MET H 1.950 . 2.100 1.986 1.932 2.090 . 0 0 "[ . 1 . 2]" 2
7 1 112 LEU O 1 116 ALA N 2.930 2.780 3.150 3.179 3.004 3.480 0.330 5 0 "[ . 1 . 2]" 2
8 1 112 LEU O 1 116 ALA H 1.950 . 2.100 2.271 2.084 2.548 0.448 5 0 "[ . 1 . 2]" 2
9 1 113 LEU O 1 117 THR N 2.930 2.780 3.150 3.047 2.898 3.400 0.250 7 0 "[ . 1 . 2]" 2
10 1 113 LEU O 1 117 THR H 1.950 . 2.100 2.236 2.063 2.658 0.558 7 1 "[ . + 1 . 2]" 2
11 1 114 TYR O 1 118 GLN N 2.930 2.780 3.150 3.138 2.905 4.048 0.898 7 1 "[ . + 1 . 2]" 2
12 1 114 TYR O 1 118 GLN H 1.950 . 2.100 2.237 2.023 3.121 1.021 7 1 "[ . + 1 . 2]" 2
13 1 115 MET O 1 119 ILE N 2.930 2.780 3.150 3.142 2.926 3.372 0.222 7 0 "[ . 1 . 2]" 2
14 1 115 MET O 1 119 ILE H 1.950 . 2.100 2.210 1.989 2.435 0.335 7 0 "[ . 1 . 2]" 2
15 1 116 ALA O 1 120 SER N 2.930 2.780 3.150 3.056 2.916 3.157 0.007 14 0 "[ . 1 . 2]" 2
16 1 116 ALA O 1 120 SER H 1.950 . 2.100 2.125 2.012 2.265 0.165 14 0 "[ . 1 . 2]" 2
17 1 117 THR O 1 121 SER N 2.930 2.780 3.150 3.092 2.938 3.388 0.238 14 0 "[ . 1 . 2]" 2
18 1 117 THR O 1 121 SER H 1.950 . 2.100 2.261 2.102 2.639 0.539 14 1 "[ . 1 +. 2]" 2
19 1 118 GLN O 1 122 ALA N 2.930 2.780 3.150 3.143 2.878 3.615 0.465 14 0 "[ . 1 . 2]" 2
20 1 118 GLN O 1 122 ALA H 1.950 . 2.100 2.262 2.014 2.682 0.582 14 1 "[ . 1 +. 2]" 2
21 1 119 ILE O 1 123 MET N 2.930 2.780 3.150 2.950 2.864 3.016 . 0 0 "[ . 1 . 2]" 2
22 1 119 ILE O 1 123 MET H 1.950 . 2.100 2.040 1.978 2.179 0.079 16 0 "[ . 1 . 2]" 2
23 1 120 SER O 1 124 GLU N 2.930 2.780 3.150 2.989 2.843 3.424 0.274 16 0 "[ . 1 . 2]" 2
24 1 120 SER O 1 124 GLU H 1.950 . 2.100 2.155 2.018 2.645 0.545 16 1 "[ . 1 .+ 2]" 2
stop_
save_
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