NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
642313 |
6prq   |
30637 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6prq
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 1069
_Distance_constraint_stats_list.Viol_count 2276
_Distance_constraint_stats_list.Viol_total 4915.924
_Distance_constraint_stats_list.Viol_max 0.629
_Distance_constraint_stats_list.Viol_rms 0.0455
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0115
_Distance_constraint_stats_list.Viol_average_violations_only 0.1080
_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 ALA 1.100 0.188 12 0 "[ . 1 . 2]"
1 2 ALA 0.954 0.271 17 0 "[ . 1 . 2]"
1 3 LEU 4.768 0.442 15 0 "[ . 1 . 2]"
1 4 VAL 5.822 0.302 5 0 "[ . 1 . 2]"
1 5 ALA 1.631 0.279 13 0 "[ . 1 . 2]"
1 6 HIS 1.953 0.224 14 0 "[ . 1 . 2]"
1 7 VAL 1.510 0.211 14 0 "[ . 1 . 2]"
1 8 THR 1.038 0.186 12 0 "[ . 1 . 2]"
1 24 LEU 6.615 0.366 11 0 "[ . 1 . 2]"
1 25 ARG 3.971 0.366 11 0 "[ . 1 . 2]"
1 26 ALA 0.140 0.127 3 0 "[ . 1 . 2]"
1 27 GLU 0.244 0.087 6 0 "[ . 1 . 2]"
1 28 LEU 6.730 0.302 5 0 "[ . 1 . 2]"
1 30 LEU 6.731 0.381 11 0 "[ . 1 . 2]"
1 31 THR 4.380 0.348 13 0 "[ . 1 . 2]"
1 32 LEU 11.173 0.306 17 0 "[ . 1 . 2]"
1 33 GLU 10.091 0.306 17 0 "[ . 1 . 2]"
1 34 GLU 0.312 0.050 4 0 "[ . 1 . 2]"
1 35 ALA 9.455 0.629 8 1 "[ . + 1 . 2]"
1 36 PHE 6.404 0.298 4 0 "[ . 1 . 2]"
1 37 HIS 5.081 0.360 14 0 "[ . 1 . 2]"
1 42 VAL 2.623 0.271 17 0 "[ . 1 . 2]"
1 43 VAL 3.642 0.257 8 0 "[ . 1 . 2]"
1 45 VAL 1.939 0.225 8 0 "[ . 1 . 2]"
1 46 ALA 0.018 0.018 9 0 "[ . 1 . 2]"
1 47 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 48 ARG 0.013 0.013 3 0 "[ . 1 . 2]"
1 49 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 50 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 51 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 VAL 2.302 0.442 15 0 "[ . 1 . 2]"
1 53 ARG 1.679 0.192 12 0 "[ . 1 . 2]"
1 54 ILE 7.867 0.305 8 0 "[ . 1 . 2]"
1 57 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 58 VAL 19.053 0.629 8 1 "[ . + 1 . 2]"
1 59 ARG 4.124 0.254 1 0 "[ . 1 . 2]"
1 60 GLU 3.526 0.278 13 0 "[ . 1 . 2]"
1 61 GLY 1.023 0.122 7 0 "[ . 1 . 2]"
1 62 SER 0.117 0.094 16 0 "[ . 1 . 2]"
1 63 VAL 4.747 0.224 8 0 "[ . 1 . 2]"
1 64 ILE 20.619 0.341 5 0 "[ . 1 . 2]"
1 65 ARG 0.060 0.033 11 0 "[ . 1 . 2]"
1 66 VAL 14.321 0.592 4 1 "[ +. 1 . 2]"
1 68 GLY 0.536 0.124 5 0 "[ . 1 . 2]"
1 69 MET 3.700 0.257 8 0 "[ . 1 . 2]"
1 70 GLY 2.758 0.301 10 0 "[ . 1 . 2]"
1 72 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 73 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 77 GLY 0.135 0.085 4 0 "[ . 1 . 2]"
1 78 ASP 5.177 0.332 3 0 "[ . 1 . 2]"
1 79 LEU 18.741 0.468 1 0 "[ . 1 . 2]"
1 80 LEU 7.250 0.341 5 0 "[ . 1 . 2]"
1 81 LEU 6.445 0.226 14 0 "[ . 1 . 2]"
1 82 VAL 1.757 0.156 14 0 "[ . 1 . 2]"
1 83 VAL 5.582 0.213 2 0 "[ . 1 . 2]"
1 84 ARG 0.830 0.118 3 0 "[ . 1 . 2]"
1 85 LEU 5.163 0.278 13 0 "[ . 1 . 2]"
1 86 LEU 4.961 0.348 13 0 "[ . 1 . 2]"
1 88 HIS 2.553 0.217 11 0 "[ . 1 . 2]"
1 90 VAL 10.264 0.309 6 0 "[ . 1 . 2]"
1 91 PHE 7.107 0.309 6 0 "[ . 1 . 2]"
1 92 ARG 0.189 0.129 14 0 "[ . 1 . 2]"
1 93 LEU 4.877 0.253 1 0 "[ . 1 . 2]"
1 94 GLU 0.365 0.076 1 0 "[ . 1 . 2]"
1 97 ASP 0.154 0.046 7 0 "[ . 1 . 2]"
1 98 LEU 10.955 0.253 1 0 "[ . 1 . 2]"
1 99 TYR 3.813 0.278 10 0 "[ . 1 . 2]"
1 100 ALA 1.835 0.209 5 0 "[ . 1 . 2]"
1 101 THR 4.764 0.295 5 0 "[ . 1 . 2]"
1 102 LEU 3.861 0.293 10 0 "[ . 1 . 2]"
1 103 ASP 0.296 0.077 7 0 "[ . 1 . 2]"
1 104 VAL 4.628 0.309 20 0 "[ . 1 . 2]"
1 106 ALA 0.719 0.102 18 0 "[ . 1 . 2]"
1 108 ILE 10.764 0.434 2 0 "[ . 1 . 2]"
1 109 ALA 2.864 0.135 8 0 "[ . 1 . 2]"
1 110 VAL 0.777 0.167 3 0 "[ . 1 . 2]"
1 111 VAL 1.587 0.388 13 0 "[ . 1 . 2]"
1 112 GLY 0.230 0.062 11 0 "[ . 1 . 2]"
1 113 GLY 4.815 0.434 2 0 "[ . 1 . 2]"
1 114 LYS 1.725 0.370 11 0 "[ . 1 . 2]"
1 115 VAL 1.527 0.170 18 0 "[ . 1 . 2]"
1 116 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 117 ALA 0.565 0.125 16 0 "[ . 1 . 2]"
1 118 MET 3.614 0.442 16 0 "[ . 1 . 2]"
1 119 THR 0.669 0.138 13 0 "[ . 1 . 2]"
1 120 LEU 13.576 0.360 14 0 "[ . 1 . 2]"
1 121 GLU 0.004 0.004 6 0 "[ . 1 . 2]"
1 122 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 124 VAL 6.297 0.442 16 0 "[ . 1 . 2]"
1 125 GLU 2.067 0.238 2 0 "[ . 1 . 2]"
1 126 VAL 7.644 0.219 2 0 "[ . 1 . 2]"
1 127 ALA 2.504 0.170 18 0 "[ . 1 . 2]"
1 128 VAL 1.400 0.589 15 1 "[ . 1 + 2]"
1 131 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 132 THR 3.817 0.196 9 0 "[ . 1 . 2]"
1 133 GLN 3.852 0.196 9 0 "[ . 1 . 2]"
1 134 ALA 0.522 0.073 15 0 "[ . 1 . 2]"
1 135 GLY 0.293 0.110 20 0 "[ . 1 . 2]"
1 136 ARG 3.292 0.403 13 0 "[ . 1 . 2]"
1 137 LYS 0.160 0.053 4 0 "[ . 1 . 2]"
1 138 LEU 8.180 0.506 9 1 "[ . +1 . 2]"
1 139 ARG 1.966 0.219 2 0 "[ . 1 . 2]"
1 140 LEU 9.841 0.248 19 0 "[ . 1 . 2]"
1 141 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 142 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 143 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 144 GLY 0.147 0.064 5 0 "[ . 1 . 2]"
1 145 PHE 3.560 0.211 9 0 "[ . 1 . 2]"
1 147 GLY 0.102 0.049 6 0 "[ . 1 . 2]"
1 149 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 150 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 151 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 152 GLY 0.102 0.049 6 0 "[ . 1 . 2]"
1 153 ASP 3.155 0.185 1 0 "[ . 1 . 2]"
1 154 LEU 7.779 0.278 10 0 "[ . 1 . 2]"
1 155 TYR 0.240 0.070 6 0 "[ . 1 . 2]"
1 156 LEU 29.597 0.506 9 1 "[ . +1 . 2]"
1 157 GLU 3.443 0.295 5 0 "[ . 1 . 2]"
1 158 VAL 7.846 0.403 13 0 "[ . 1 . 2]"
1 159 ARG 0.738 0.153 16 0 "[ . 1 . 2]"
1 160 ILE 6.610 0.266 7 0 "[ . 1 . 2]"
1 161 THR 0.307 0.102 18 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 54 ILE MD 1 58 VAL MG2 3.310 . 4.820 3.222 2.901 3.772 . 0 0 "[ . 1 . 2]" 1
2 1 54 ILE MD 1 58 VAL MG1 3.200 . 4.600 2.875 2.630 3.286 . 0 0 "[ . 1 . 2]" 1
3 1 3 LEU MD2 1 54 ILE MD 3.050 . 4.300 2.912 1.917 4.366 0.066 10 0 "[ . 1 . 2]" 1
4 1 28 LEU MD1 1 54 ILE MD 2.750 . 3.700 2.884 2.297 3.256 . 0 0 "[ . 1 . 2]" 1
5 1 54 ILE MD 1 81 LEU MD1 3.430 . 5.060 3.238 2.621 3.873 . 0 0 "[ . 1 . 2]" 1
6 1 3 LEU MD1 1 54 ILE MD 3.050 . 4.300 3.166 1.762 4.404 0.104 15 0 "[ . 1 . 2]" 1
7 1 28 LEU MD2 1 54 ILE MD 2.750 . 3.700 3.783 3.658 3.882 0.182 14 0 "[ . 1 . 2]" 1
8 1 45 VAL MG1 1 79 LEU MD1 3.000 . 4.200 2.523 1.996 3.526 . 0 0 "[ . 1 . 2]" 1
9 1 24 LEU MD1 1 45 VAL MG1 3.110 . 4.420 3.194 1.774 4.522 0.102 13 0 "[ . 1 . 2]" 1
10 1 24 LEU MD2 1 45 VAL MG1 3.110 . 4.420 3.139 1.772 4.366 0.028 9 0 "[ . 1 . 2]" 1
11 1 45 VAL MG1 1 79 LEU MD2 2.960 . 4.120 2.607 1.995 4.227 0.107 9 0 "[ . 1 . 2]" 1
12 1 24 LEU MD1 1 45 VAL MG2 3.110 . 4.420 3.231 1.796 4.417 0.004 14 0 "[ . 1 . 2]" 1
13 1 24 LEU MD2 1 45 VAL MG2 3.110 . 4.420 3.386 1.957 4.645 0.225 8 0 "[ . 1 . 2]" 1
14 1 45 VAL MG2 1 79 LEU MD2 2.960 . 4.120 2.215 1.798 3.528 0.002 2 0 "[ . 1 . 2]" 1
15 1 66 VAL MG1 1 69 MET ME 3.070 . 4.340 3.684 1.943 4.022 . 0 0 "[ . 1 . 2]" 1
16 1 66 VAL MG1 1 79 LEU MD2 3.020 . 4.240 4.037 2.457 4.317 0.077 11 0 "[ . 1 . 2]" 1
17 1 24 LEU MD1 1 46 ALA MB 3.270 . 4.740 2.827 1.896 4.066 . 0 0 "[ . 1 . 2]" 1
18 1 124 VAL MG2 1 140 LEU MD1 2.840 . 3.880 2.136 1.997 2.357 . 0 0 "[ . 1 . 2]" 1
19 1 124 VAL MG1 1 140 LEU MD1 2.840 . 3.880 3.147 2.897 3.494 . 0 0 "[ . 1 . 2]" 1
20 1 7 VAL MG1 1 26 ALA MB 3.420 . 5.040 3.499 1.824 4.342 . 0 0 "[ . 1 . 2]" 1
21 1 8 THR MG 1 26 ALA MB 3.720 . 5.640 3.723 3.220 4.185 . 0 0 "[ . 1 . 2]" 1
22 1 26 ALA MB 1 81 LEU MD1 3.280 . 4.760 4.287 4.101 4.468 . 0 0 "[ . 1 . 2]" 1
23 1 66 VAL MG2 1 79 LEU MD2 3.020 . 4.240 2.663 2.404 3.169 . 0 0 "[ . 1 . 2]" 1
24 1 66 VAL MG2 1 81 LEU MD1 3.480 . 5.160 3.316 2.245 3.784 . 0 0 "[ . 1 . 2]" 1
25 1 83 VAL MG1 1 85 LEU MD2 3.240 . 4.680 4.031 3.632 4.431 . 0 0 "[ . 1 . 2]" 1
26 1 63 VAL MG1 1 80 LEU MD2 3.070 . 4.340 2.283 1.809 3.602 . 0 0 "[ . 1 . 2]" 1
27 1 24 LEU MD1 1 79 LEU MD1 3.090 . 4.380 3.116 1.796 3.615 0.004 10 0 "[ . 1 . 2]" 1
28 1 45 VAL MG2 1 79 LEU MD1 3.000 . 4.200 2.907 2.166 3.607 . 0 0 "[ . 1 . 2]" 1
29 1 30 LEU MD2 1 35 ALA MB 3.320 . 4.840 2.599 2.246 3.083 . 0 0 "[ . 1 . 2]" 1
30 1 30 LEU MD2 1 83 VAL MG1 2.940 . 4.080 1.916 1.811 2.109 . 0 0 "[ . 1 . 2]" 1
31 1 30 LEU MD2 1 58 VAL MG1 2.770 . 3.740 2.296 2.088 2.544 . 0 0 "[ . 1 . 2]" 1
32 1 30 LEU MD2 1 85 LEU MD2 3.010 . 4.220 2.208 1.889 2.783 . 0 0 "[ . 1 . 2]" 1
33 1 30 LEU MD2 1 85 LEU MD1 3.330 . 4.860 4.068 3.795 4.659 . 0 0 "[ . 1 . 2]" 1
34 1 126 VAL MG1 1 156 LEU MD2 2.980 . 4.160 3.829 3.413 4.239 0.079 13 0 "[ . 1 . 2]" 1
35 1 102 LEU MD2 1 156 LEU MD2 2.900 . 4.000 3.124 2.812 3.394 . 0 0 "[ . 1 . 2]" 1
36 1 98 LEU MD1 1 154 LEU MD1 2.630 . 3.460 2.623 2.351 2.812 . 0 0 "[ . 1 . 2]" 1
37 1 79 LEU MD1 1 81 LEU MD1 3.140 . 4.480 4.116 3.660 4.426 . 0 0 "[ . 1 . 2]" 1
38 1 43 VAL MG2 1 81 LEU MD1 3.050 . 4.290 3.043 2.397 4.015 . 0 0 "[ . 1 . 2]" 1
39 1 66 VAL MG1 1 81 LEU MD1 3.480 . 5.160 3.066 2.365 3.509 . 0 0 "[ . 1 . 2]" 1
40 1 32 LEU MD2 1 85 LEU MD2 2.790 . 3.780 2.952 2.599 3.420 . 0 0 "[ . 1 . 2]" 1
41 1 31 THR MG 1 85 LEU MD2 3.420 . 5.040 4.734 4.537 5.024 . 0 0 "[ . 1 . 2]" 1
42 1 58 VAL MG1 1 85 LEU MD2 2.950 . 4.100 3.603 3.263 3.756 . 0 0 "[ . 1 . 2]" 1
43 1 35 ALA MB 1 85 LEU MD2 3.020 . 4.240 2.029 1.903 2.396 . 0 0 "[ . 1 . 2]" 1
44 1 63 VAL MG2 1 80 LEU MD1 3.040 . 4.280 3.567 2.078 4.338 0.058 3 0 "[ . 1 . 2]" 1
45 1 63 VAL MG2 1 80 LEU MD2 3.070 . 4.340 3.403 1.803 4.357 0.017 20 0 "[ . 1 . 2]" 1
46 1 102 LEU MD1 1 115 VAL MG1 2.960 . 4.120 2.887 2.101 3.960 . 0 0 "[ . 1 . 2]" 1
47 1 43 VAL MG1 1 79 LEU MD2 2.850 . 3.900 2.633 1.971 3.371 . 0 0 "[ . 1 . 2]" 1
48 1 102 LEU MD2 1 115 VAL MG1 3.100 . 4.400 3.387 2.028 4.455 0.055 19 0 "[ . 1 . 2]" 1
49 1 43 VAL MG1 1 81 LEU MD2 3.050 . 4.290 3.859 2.773 4.405 0.115 2 0 "[ . 1 . 2]" 1
50 1 102 LEU MD2 1 115 VAL MG2 3.100 . 4.400 2.994 1.903 4.336 . 0 0 "[ . 1 . 2]" 1
51 1 102 LEU MD1 1 115 VAL MG2 2.960 . 4.120 2.659 1.949 3.585 . 0 0 "[ . 1 . 2]" 1
52 1 24 LEU MD2 1 46 ALA MB 3.270 . 4.740 2.872 2.010 4.132 . 0 0 "[ . 1 . 2]" 1
53 1 24 LEU MD2 1 79 LEU MD1 3.090 . 4.380 2.968 1.801 4.058 . 0 0 "[ . 1 . 2]" 1
54 1 93 LEU MD1 1 98 LEU MD2 2.660 . 3.520 2.128 1.811 2.427 . 0 0 "[ . 1 . 2]" 1
55 1 138 LEU MD1 1 156 LEU MD1 3.770 . 5.740 3.061 2.680 3.352 . 0 0 "[ . 1 . 2]" 1
56 1 108 ILE MD 1 115 VAL MG2 3.000 . 4.200 3.267 2.088 4.262 0.062 20 0 "[ . 1 . 2]" 1
57 1 119 THR MG 1 156 LEU MD1 4.030 . 6.270 6.065 5.670 6.408 0.138 13 0 "[ . 1 . 2]" 1
58 1 119 THR MG 1 154 LEU MD2 2.920 . 4.040 3.571 3.154 3.911 . 0 0 "[ . 1 . 2]" 1
59 1 117 ALA MB 1 119 THR MG 3.520 . 5.240 4.456 3.834 5.007 . 0 0 "[ . 1 . 2]" 1
60 1 119 THR MG 1 124 VAL MG1 2.790 . 3.780 1.878 1.793 2.009 0.007 8 0 "[ . 1 . 2]" 1
61 1 43 VAL MG1 1 81 LEU MD1 3.050 . 4.290 3.438 1.911 3.929 . 0 0 "[ . 1 . 2]" 1
62 1 83 VAL MG2 1 85 LEU MD2 3.240 . 4.680 2.457 2.176 2.852 . 0 0 "[ . 1 . 2]" 1
63 1 126 VAL MG1 1 140 LEU MD1 2.850 . 3.900 3.208 2.759 3.587 . 0 0 "[ . 1 . 2]" 1
64 1 124 VAL MG1 1 156 LEU MD1 3.630 . 5.460 5.290 5.008 5.544 0.084 2 0 "[ . 1 . 2]" 1
65 1 124 VAL MG1 1 154 LEU MD2 3.280 . 4.760 3.478 2.948 3.781 . 0 0 "[ . 1 . 2]" 1
66 1 117 ALA MB 1 124 VAL MG1 3.150 . 4.510 4.278 4.007 4.635 0.125 16 0 "[ . 1 . 2]" 1
67 1 102 LEU MD2 1 126 VAL MG1 2.790 . 3.780 2.074 1.903 2.294 . 0 0 "[ . 1 . 2]" 1
68 1 117 ALA MB 1 126 VAL MG1 3.190 . 4.580 3.034 2.014 4.215 . 0 0 "[ . 1 . 2]" 1
69 1 30 LEU MD2 1 83 VAL MG2 2.940 . 4.080 2.264 2.065 2.782 . 0 0 "[ . 1 . 2]" 1
70 1 7 VAL MG2 1 46 ALA MB 3.510 . 5.220 3.459 2.435 4.620 . 0 0 "[ . 1 . 2]" 1
71 1 45 VAL MG2 1 46 ALA MB 3.510 . 5.220 3.877 2.798 4.836 . 0 0 "[ . 1 . 2]" 1
72 1 45 VAL MG1 1 46 ALA MB 3.510 . 5.220 3.987 2.376 4.781 . 0 0 "[ . 1 . 2]" 1
73 1 109 ALA MB 1 132 THR MG 3.390 . 4.980 2.326 2.186 2.500 . 0 0 "[ . 1 . 2]" 1
74 1 109 ALA MB 1 110 VAL MG1 3.030 . 4.260 2.830 2.669 3.035 . 0 0 "[ . 1 . 2]" 1
75 1 26 ALA MB 1 79 LEU MD2 3.990 . 6.180 3.281 2.797 3.576 . 0 0 "[ . 1 . 2]" 1
76 1 26 ALA MB 1 81 LEU MD2 3.990 . 6.180 1.985 1.802 2.181 . 0 0 "[ . 1 . 2]" 1
77 1 7 VAL MG2 1 26 ALA MB 3.420 . 5.040 2.930 1.954 4.168 . 0 0 "[ . 1 . 2]" 1
78 1 127 ALA MB 1 128 VAL MG1 3.890 . 5.980 4.721 4.558 5.499 . 0 0 "[ . 1 . 2]" 1
79 1 140 LEU MD2 1 156 LEU MD1 2.710 . 3.620 2.662 2.429 2.959 . 0 0 "[ . 1 . 2]" 1
80 1 126 VAL MG2 1 140 LEU MD2 2.850 . 3.900 2.248 1.802 3.011 . 0 0 "[ . 1 . 2]" 1
81 1 30 LEU MD2 1 54 ILE MD 2.950 . 4.100 2.722 2.353 3.129 . 0 0 "[ . 1 . 2]" 1
82 1 79 LEU MD2 1 81 LEU MD1 2.860 . 3.920 2.780 2.327 3.194 . 0 0 "[ . 1 . 2]" 1
83 1 126 VAL MG1 1 140 LEU MD2 2.850 . 3.900 3.058 1.880 3.910 0.010 10 0 "[ . 1 . 2]" 1
84 1 127 ALA MB 1 140 LEU MD2 3.970 . 6.140 4.899 4.486 5.325 . 0 0 "[ . 1 . 2]" 1
85 1 104 VAL MG1 1 108 ILE MD 3.410 . 5.020 4.615 3.643 5.329 0.309 20 0 "[ . 1 . 2]" 1
86 1 127 ALA MB 1 128 VAL MG2 3.890 . 5.980 4.646 4.324 4.895 . 0 0 "[ . 1 . 2]" 1
87 1 124 VAL MG2 1 156 LEU MD1 3.630 . 5.460 3.448 3.211 3.690 . 0 0 "[ . 1 . 2]" 1
88 1 124 VAL MG2 1 154 LEU MD2 3.280 . 4.760 2.626 2.214 2.890 . 0 0 "[ . 1 . 2]" 1
89 1 119 THR MG 1 124 VAL MG2 2.790 . 3.780 2.707 2.260 3.169 . 0 0 "[ . 1 . 2]" 1
90 1 43 VAL MG1 1 69 MET ME 2.810 . 3.820 2.694 1.938 4.077 0.257 8 0 "[ . 1 . 2]" 1
91 1 69 MET ME 1 81 LEU MD2 3.810 . 5.820 4.944 4.400 5.336 . 0 0 "[ . 1 . 2]" 1
92 1 69 MET ME 1 79 LEU MD2 3.140 . 4.480 2.589 1.931 3.249 . 0 0 "[ . 1 . 2]" 1
93 1 69 MET ME 1 81 LEU MD1 3.770 . 5.740 4.070 3.501 4.885 . 0 0 "[ . 1 . 2]" 1
94 1 69 MET ME 1 79 LEU MD1 3.630 . 5.460 4.834 4.182 5.486 0.026 7 0 "[ . 1 . 2]" 1
95 1 66 VAL MG2 1 69 MET ME 3.070 . 4.340 2.385 1.930 4.059 . 0 0 "[ . 1 . 2]" 1
96 1 1 ALA MB 1 3 LEU MD1 4.300 . 6.800 5.719 3.444 6.986 0.186 13 0 "[ . 1 . 2]" 1
97 1 102 LEU MD1 1 140 LEU MD2 3.970 . 6.140 5.667 5.354 6.014 . 0 0 "[ . 1 . 2]" 1
98 1 102 LEU MD1 1 126 VAL MG2 3.220 . 4.640 3.445 2.192 4.362 . 0 0 "[ . 1 . 2]" 1
99 1 102 LEU MD1 1 126 VAL MG1 3.220 . 4.640 2.905 2.091 4.119 . 0 0 "[ . 1 . 2]" 1
100 1 1 ALA MB 1 3 LEU MD2 4.300 . 6.800 6.057 3.686 6.943 0.143 11 0 "[ . 1 . 2]" 1
101 1 1 ALA MB 1 5 ALA MB 4.160 . 6.520 4.377 1.962 5.738 . 0 0 "[ . 1 . 2]" 1
102 1 30 LEU MD2 1 58 VAL MG2 2.930 . 4.070 2.699 2.509 2.971 . 0 0 "[ . 1 . 2]" 1
103 1 58 VAL MG2 1 81 LEU MD1 4.390 . 6.980 5.835 5.455 6.241 . 0 0 "[ . 1 . 2]" 1
104 1 30 LEU MD1 1 58 VAL MG2 3.330 . 4.860 4.587 4.172 4.898 0.038 5 0 "[ . 1 . 2]" 1
105 1 58 VAL MG2 1 85 LEU MD2 3.220 . 4.640 3.429 3.092 3.774 . 0 0 "[ . 1 . 2]" 1
106 1 58 VAL MG2 1 83 VAL MG2 2.820 . 3.850 1.826 1.763 1.909 0.037 20 0 "[ . 1 . 2]" 1
107 1 35 ALA MB 1 58 VAL MG2 3.230 . 4.660 3.507 3.223 3.848 . 0 0 "[ . 1 . 2]" 1
108 1 64 ILE MD 1 85 LEU MD2 4.260 . 6.720 5.446 5.135 5.801 . 0 0 "[ . 1 . 2]" 1
109 1 54 ILE MD 1 85 LEU MD2 4.600 . 7.400 5.379 4.907 5.724 . 0 0 "[ . 1 . 2]" 1
110 1 43 VAL MG2 1 69 MET ME 2.810 . 3.820 3.524 2.276 4.022 0.202 4 0 "[ . 1 . 2]" 1
111 1 31 THR MG 1 86 LEU MD2 2.670 . 3.540 3.723 3.562 3.888 0.348 13 0 "[ . 1 . 2]" 1
112 1 30 LEU MD1 1 31 THR MG 3.770 . 5.740 5.336 4.278 5.588 . 0 0 "[ . 1 . 2]" 1
113 1 30 LEU MD2 1 31 THR MG 4.160 . 6.520 5.733 5.093 5.913 . 0 0 "[ . 1 . 2]" 1
114 1 31 THR MG 1 32 LEU MD1 3.640 . 5.480 4.210 3.939 5.314 . 0 0 "[ . 1 . 2]" 1
115 1 35 ALA MB 1 120 LEU MD1 3.690 . 5.580 3.123 2.835 3.455 . 0 0 "[ . 1 . 2]" 1
116 1 35 ALA MB 1 58 VAL MG1 3.260 . 4.730 2.505 2.233 2.861 . 0 0 "[ . 1 . 2]" 1
117 1 30 LEU MD1 1 35 ALA MB 3.810 . 5.820 4.639 4.214 4.994 . 0 0 "[ . 1 . 2]" 1
118 1 66 VAL MG1 1 79 LEU MD1 3.510 . 5.220 5.298 4.622 5.424 0.204 1 0 "[ . 1 . 2]" 1
119 1 90 VAL MG1 1 120 LEU MD2 3.820 . 5.840 2.766 2.425 3.096 . 0 0 "[ . 1 . 2]" 1
120 1 138 LEU MD2 1 156 LEU MD1 3.770 . 5.740 4.570 4.320 4.874 . 0 0 "[ . 1 . 2]" 1
121 1 119 THR MG 1 120 LEU MD1 4.260 . 6.720 5.760 5.583 5.967 . 0 0 "[ . 1 . 2]" 1
122 1 118 MET ME 1 119 THR MG 3.980 . 6.160 3.751 3.467 4.152 . 0 0 "[ . 1 . 2]" 1
123 1 7 VAL MG1 1 46 ALA MB 3.510 . 5.220 3.949 2.505 5.128 . 0 0 "[ . 1 . 2]" 1
124 1 43 VAL MG2 1 81 LEU MD2 3.050 . 4.290 2.963 2.018 4.008 . 0 0 "[ . 1 . 2]" 1
125 1 43 VAL MG2 1 79 LEU MD2 2.850 . 3.900 2.301 1.770 3.441 0.030 1 0 "[ . 1 . 2]" 1
126 1 32 LEU MD1 1 90 VAL MG1 3.680 . 5.560 1.939 1.785 2.129 0.015 15 0 "[ . 1 . 2]" 1
127 1 32 LEU MD1 1 90 VAL MG2 3.680 . 5.560 4.241 4.043 4.370 . 0 0 "[ . 1 . 2]" 1
128 1 32 LEU MD2 1 90 VAL MG2 3.980 . 6.160 5.922 5.714 6.072 . 0 0 "[ . 1 . 2]" 1
129 1 90 VAL MG2 1 100 ALA MB 3.470 . 5.140 2.807 2.422 3.544 . 0 0 "[ . 1 . 2]" 1
130 1 32 LEU MD1 1 120 LEU MD2 2.770 . 3.740 2.966 2.778 3.194 . 0 0 "[ . 1 . 2]" 1
131 1 32 LEU MD1 1 35 ALA MB 3.740 . 5.680 5.338 5.110 5.600 . 0 0 "[ . 1 . 2]" 1
132 1 32 LEU MD1 1 86 LEU MD1 4.090 . 6.380 4.627 3.691 5.567 . 0 0 "[ . 1 . 2]" 1
133 1 31 THR MG 1 85 LEU MD1 4.000 . 6.200 5.623 5.170 6.116 . 0 0 "[ . 1 . 2]" 1
134 1 83 VAL MG1 1 85 LEU MD1 4.030 . 6.260 5.725 5.325 6.022 . 0 0 "[ . 1 . 2]" 1
135 1 58 VAL MG1 1 85 LEU MD1 3.180 . 4.560 4.489 4.204 4.612 0.052 1 0 "[ . 1 . 2]" 1
136 1 83 VAL MG2 1 85 LEU MD1 4.030 . 6.260 3.773 3.534 4.133 . 0 0 "[ . 1 . 2]" 1
137 1 58 VAL MG2 1 85 LEU MD1 3.360 . 4.920 4.283 3.953 4.560 . 0 0 "[ . 1 . 2]" 1
138 1 35 ALA MB 1 85 LEU MD1 3.350 . 4.900 2.521 2.206 3.070 . 0 0 "[ . 1 . 2]" 1
139 1 32 LEU MD2 1 35 ALA MB 3.570 . 5.340 3.743 3.573 3.944 . 0 0 "[ . 1 . 2]" 1
140 1 32 LEU MD2 1 90 VAL MG1 3.980 . 6.160 3.898 3.627 4.174 . 0 0 "[ . 1 . 2]" 1
141 1 31 THR MG 1 32 LEU MD2 3.780 . 5.760 4.407 4.051 5.131 . 0 0 "[ . 1 . 2]" 1
142 1 32 LEU MD2 1 86 LEU MD1 4.200 . 6.600 4.914 3.809 5.807 . 0 0 "[ . 1 . 2]" 1
143 1 32 LEU MD2 1 85 LEU MD1 2.570 . 3.340 1.994 1.786 2.224 0.014 8 0 "[ . 1 . 2]" 1
144 1 58 VAL MG2 1 83 VAL MG1 2.820 . 3.850 2.326 2.086 2.559 . 0 0 "[ . 1 . 2]" 1
145 1 66 VAL MG2 1 79 LEU MD1 3.510 . 5.220 4.042 3.884 4.398 . 0 0 "[ . 1 . 2]" 1
146 1 54 ILE MD 1 64 ILE MD 2.850 . 3.900 2.177 1.992 2.359 . 0 0 "[ . 1 . 2]" 1
147 1 64 ILE MD 1 81 LEU MD2 3.380 . 4.960 4.601 4.329 4.750 . 0 0 "[ . 1 . 2]" 1
148 1 28 LEU MD2 1 64 ILE MD 3.080 . 4.360 3.293 2.889 3.570 . 0 0 "[ . 1 . 2]" 1
149 1 64 ILE MD 1 81 LEU MD1 3.440 . 5.080 3.358 2.913 3.762 . 0 0 "[ . 1 . 2]" 1
150 1 28 LEU MD1 1 64 ILE MD 3.080 . 4.360 3.903 3.233 4.425 0.065 17 0 "[ . 1 . 2]" 1
151 1 64 ILE MD 1 79 LEU MD1 4.360 . 6.920 6.652 6.304 6.998 0.078 4 0 "[ . 1 . 2]" 1
152 1 64 ILE MD 1 83 VAL MG1 3.140 . 4.480 1.992 1.899 2.178 . 0 0 "[ . 1 . 2]" 1
153 1 58 VAL MG1 1 64 ILE MD 2.920 . 4.040 3.104 2.794 3.704 . 0 0 "[ . 1 . 2]" 1
154 1 64 ILE MD 1 83 VAL MG2 3.140 . 4.480 3.226 2.961 3.496 . 0 0 "[ . 1 . 2]" 1
155 1 58 VAL MG2 1 64 ILE MD 2.860 . 3.920 1.780 1.682 2.061 0.118 19 0 "[ . 1 . 2]" 1
156 1 35 ALA MB 1 64 ILE MD 4.180 . 6.560 5.669 5.297 6.125 . 0 0 "[ . 1 . 2]" 1
157 1 30 LEU MD2 1 64 ILE MD 3.140 . 4.480 3.501 3.160 3.976 . 0 0 "[ . 1 . 2]" 1
158 1 140 LEU MD1 1 156 LEU MD1 2.810 . 3.820 2.009 1.859 2.398 . 0 0 "[ . 1 . 2]" 1
159 1 140 LEU MD1 1 154 LEU MD2 2.740 . 3.680 1.922 1.782 2.262 0.018 16 0 "[ . 1 . 2]" 1
160 1 127 ALA MB 1 140 LEU MD1 4.160 . 6.520 6.207 5.956 6.348 . 0 0 "[ . 1 . 2]" 1
161 1 126 VAL MG2 1 140 LEU MD1 2.850 . 3.900 2.610 1.799 3.333 0.001 6 0 "[ . 1 . 2]" 1
162 1 100 ALA MB 1 154 LEU MD1 2.220 . 2.640 1.902 1.802 2.056 . 0 0 "[ . 1 . 2]" 1
163 1 31 THR MG 1 86 LEU MD1 2.220 . 2.640 1.960 1.794 2.903 0.263 8 0 "[ . 1 . 2]" 1
164 1 106 ALA MB 1 109 ALA MB 4.030 . 6.270 3.565 3.425 3.696 . 0 0 "[ . 1 . 2]" 1
165 1 64 ILE MD 1 80 LEU MD2 4.100 . 6.400 5.953 5.788 6.080 . 0 0 "[ . 1 . 2]" 1
166 1 63 VAL MG1 1 80 LEU MD1 3.040 . 4.280 2.851 2.131 4.011 . 0 0 "[ . 1 . 2]" 1
167 1 93 LEU MD2 1 98 LEU MD2 2.790 . 3.780 3.568 3.093 3.881 0.101 16 0 "[ . 1 . 2]" 1
168 1 58 VAL MG1 1 93 LEU MD2 4.120 . 6.440 4.815 4.445 5.397 . 0 0 "[ . 1 . 2]" 1
169 1 35 ALA MB 1 93 LEU MD2 4.000 . 6.200 4.345 3.837 5.205 . 0 0 "[ . 1 . 2]" 1
170 1 32 LEU MD2 1 120 LEU MD1 2.920 . 4.040 3.917 3.550 4.134 0.094 7 0 "[ . 1 . 2]" 1
171 1 32 LEU MD2 1 120 LEU MD2 3.010 . 4.220 3.994 3.651 4.224 0.004 7 0 "[ . 1 . 2]" 1
172 1 86 LEU MD1 1 120 LEU MD2 4.020 . 6.240 6.127 5.511 6.467 0.227 13 0 "[ . 1 . 2]" 1
173 1 31 THR MG 1 120 LEU MD2 3.790 . 5.780 4.196 4.015 4.630 . 0 0 "[ . 1 . 2]" 1
174 1 90 VAL MG2 1 120 LEU MD2 3.820 . 5.840 4.328 3.844 4.730 . 0 0 "[ . 1 . 2]" 1
175 1 35 ALA MB 1 120 LEU MD2 4.040 . 6.280 4.533 4.282 4.796 . 0 0 "[ . 1 . 2]" 1
176 1 102 LEU MD2 1 156 LEU MD1 2.900 . 4.000 1.902 1.774 2.100 0.026 6 0 "[ . 1 . 2]" 1
177 1 102 LEU MD2 1 140 LEU MD2 3.780 . 5.760 4.660 4.419 4.955 . 0 0 "[ . 1 . 2]" 1
178 1 102 LEU MD2 1 126 VAL MG2 2.790 . 3.780 2.528 2.133 2.821 . 0 0 "[ . 1 . 2]" 1
179 1 102 LEU MD2 1 160 ILE MD 4.600 . 7.400 6.580 6.213 6.790 . 0 0 "[ . 1 . 2]" 1
180 1 35 ALA MB 1 54 ILE MD 4.050 . 6.300 5.414 4.892 5.893 . 0 0 "[ . 1 . 2]" 1
181 1 54 ILE MD 1 79 LEU MD1 4.910 . 8.020 7.476 7.070 7.903 . 0 0 "[ . 1 . 2]" 1
182 1 132 THR MG 1 160 ILE MD 2.830 . 3.860 2.023 1.812 2.282 . 0 0 "[ . 1 . 2]" 1
183 1 110 VAL MG1 1 160 ILE MD 2.990 . 4.180 3.957 3.718 4.190 0.010 10 0 "[ . 1 . 2]" 1
184 1 111 VAL MG1 1 160 ILE MD 4.790 . 7.780 7.726 7.547 7.801 0.021 2 0 "[ . 1 . 2]" 1
185 1 134 ALA MB 1 160 ILE MD 2.990 . 4.180 2.767 2.499 3.140 . 0 0 "[ . 1 . 2]" 1
186 1 109 ALA MB 1 160 ILE MD 2.760 . 3.720 2.016 1.919 2.093 . 0 0 "[ . 1 . 2]" 1
187 1 106 ALA MB 1 160 ILE MD 3.380 . 4.960 4.571 4.298 4.927 . 0 0 "[ . 1 . 2]" 1
188 1 98 LEU MD1 1 156 LEU MD1 4.150 . 6.500 6.496 6.269 6.645 0.145 3 0 "[ . 1 . 2]" 1
189 1 98 LEU MD1 1 154 LEU MD2 3.190 . 4.580 3.191 2.958 3.441 . 0 0 "[ . 1 . 2]" 1
190 1 118 MET ME 1 124 VAL MG1 4.140 . 6.490 5.306 4.821 5.831 . 0 0 "[ . 1 . 2]" 1
191 1 79 LEU MD1 1 80 LEU MD2 3.670 . 5.540 5.167 4.954 5.359 . 0 0 "[ . 1 . 2]" 1
192 1 126 VAL MG2 1 127 ALA MB 3.900 . 6.000 4.562 3.739 5.538 . 0 0 "[ . 1 . 2]" 1
193 1 126 VAL MG2 1 156 LEU MD2 2.980 . 4.160 3.848 3.040 4.362 0.202 11 0 "[ . 1 . 2]" 1
194 1 117 ALA MB 1 126 VAL MG2 3.190 . 4.580 3.349 1.986 4.671 0.091 12 0 "[ . 1 . 2]" 1
195 1 46 ALA MB 1 79 LEU MD1 4.400 . 7.000 5.502 4.657 6.170 . 0 0 "[ . 1 . 2]" 1
196 1 79 LEU MD2 1 81 LEU MD2 2.740 . 3.680 2.090 1.914 2.411 . 0 0 "[ . 1 . 2]" 1
197 1 154 LEU MD2 1 156 LEU MD1 3.000 . 4.200 3.023 2.849 3.188 . 0 0 "[ . 1 . 2]" 1
198 1 102 LEU MD1 1 156 LEU MD1 2.850 . 3.900 2.921 2.238 3.550 . 0 0 "[ . 1 . 2]" 1
199 1 79 LEU MD1 1 81 LEU MD2 2.920 . 4.040 2.378 2.163 2.690 . 0 0 "[ . 1 . 2]" 1
200 1 126 VAL MG2 1 156 LEU MD1 2.620 . 3.440 1.983 1.892 2.061 . 0 0 "[ . 1 . 2]" 1
201 1 126 VAL MG1 1 156 LEU MD1 2.620 . 3.440 2.090 1.909 2.480 . 0 0 "[ . 1 . 2]" 1
202 1 54 ILE MD 1 81 LEU MD2 3.580 . 5.360 4.984 4.609 5.181 . 0 0 "[ . 1 . 2]" 1
203 1 102 LEU MD2 1 108 ILE MD 4.250 . 6.700 6.211 5.755 6.511 . 0 0 "[ . 1 . 2]" 1
204 1 102 LEU MD1 1 108 ILE MD 4.280 . 6.760 6.008 5.649 6.203 . 0 0 "[ . 1 . 2]" 1
205 1 104 VAL MG2 1 108 ILE MD 3.410 . 5.020 4.563 2.956 5.300 0.280 17 0 "[ . 1 . 2]" 1
206 1 108 ILE MD 1 115 VAL MG1 3.000 . 4.200 3.137 2.082 4.211 0.011 17 0 "[ . 1 . 2]" 1
207 1 110 VAL MG2 1 111 VAL MG1 2.720 . 3.640 2.051 1.763 2.230 0.037 20 0 "[ . 1 . 2]" 1
208 1 109 ALA MB 1 111 VAL MG1 4.120 . 6.440 5.755 5.548 6.062 . 0 0 "[ . 1 . 2]" 1
209 1 117 ALA MB 1 156 LEU MD1 3.190 . 4.580 2.818 2.268 3.214 . 0 0 "[ . 1 . 2]" 1
210 1 117 ALA MB 1 154 LEU MD2 3.600 . 5.400 3.283 2.805 3.741 . 0 0 "[ . 1 . 2]" 1
211 1 102 LEU MD2 1 117 ALA MB 3.400 . 5.000 3.368 2.820 3.708 . 0 0 "[ . 1 . 2]" 1
212 1 117 ALA MB 1 140 LEU MD2 3.690 . 5.580 4.840 4.393 5.378 . 0 0 "[ . 1 . 2]" 1
213 1 117 ALA MB 1 156 LEU MD2 3.180 . 4.560 2.504 2.110 2.850 . 0 0 "[ . 1 . 2]" 1
214 1 102 LEU MD1 1 117 ALA MB 3.010 . 4.220 1.898 1.791 2.104 0.009 11 0 "[ . 1 . 2]" 1
215 1 117 ALA MB 1 124 VAL MG2 3.150 . 4.510 2.002 1.878 2.321 . 0 0 "[ . 1 . 2]" 1
216 1 126 VAL MG1 1 127 ALA MB 3.900 . 6.000 4.676 3.962 5.110 . 0 0 "[ . 1 . 2]" 1
217 1 100 ALA MB 1 156 LEU MD1 3.560 . 5.320 4.564 4.270 4.820 . 0 0 "[ . 1 . 2]" 1
218 1 100 ALA MB 1 154 LEU MD2 3.450 . 5.100 3.112 2.834 3.427 . 0 0 "[ . 1 . 2]" 1
219 1 98 LEU MD1 1 100 ALA MB 3.750 . 5.700 4.504 4.120 4.871 . 0 0 "[ . 1 . 2]" 1
220 1 100 ALA MB 1 101 THR MG 3.740 . 5.680 5.154 4.872 5.404 . 0 0 "[ . 1 . 2]" 1
221 1 90 VAL MG1 1 100 ALA MB 3.470 . 5.140 4.366 4.012 4.918 . 0 0 "[ . 1 . 2]" 1
222 1 106 ALA MB 1 110 VAL MG2 3.820 . 5.840 4.035 3.841 4.304 . 0 0 "[ . 1 . 2]" 1
223 1 106 ALA MB 1 110 VAL MG1 3.330 . 4.860 3.469 3.169 3.902 . 0 0 "[ . 1 . 2]" 1
224 1 100 ALA MB 1 118 MET ME 4.280 . 6.760 6.812 6.643 6.969 0.209 5 0 "[ . 1 . 2]" 1
225 1 118 MET ME 1 156 LEU MD2 5.010 . 8.220 7.254 6.910 7.637 . 0 0 "[ . 1 . 2]" 1
226 1 118 MET ME 1 120 LEU MD2 3.610 . 5.420 4.567 3.232 5.155 . 0 0 "[ . 1 . 2]" 1
227 1 90 VAL MG1 1 118 MET ME 3.990 . 6.180 5.422 4.432 5.842 . 0 0 "[ . 1 . 2]" 1
228 1 118 MET ME 1 124 VAL MG2 4.140 . 6.490 5.208 4.856 5.689 . 0 0 "[ . 1 . 2]" 1
229 1 90 VAL MG2 1 118 MET ME 3.990 . 6.180 5.593 4.952 6.135 . 0 0 "[ . 1 . 2]" 1
230 1 64 ILE H 1 80 LEU MD2 3.020 . 4.240 3.846 3.681 3.973 . 0 0 "[ . 1 . 2]" 1
231 1 64 ILE H 1 64 ILE MD 2.520 . 3.240 3.490 3.439 3.531 0.291 11 0 "[ . 1 . 2]" 1
232 1 25 ARG H 1 79 LEU MD1 2.780 . 3.760 3.495 3.162 3.841 0.081 18 0 "[ . 1 . 2]" 1
233 1 7 VAL MG1 1 25 ARG H 3.220 . 4.640 3.373 2.465 4.851 0.211 14 0 "[ . 1 . 2]" 1
234 1 7 VAL MG2 1 25 ARG H 3.220 . 4.640 4.032 1.994 4.744 0.104 17 0 "[ . 1 . 2]" 1
235 1 45 VAL H 1 79 LEU MD2 3.570 . 5.340 4.905 4.235 5.250 . 0 0 "[ . 1 . 2]" 1
236 1 26 ALA H 1 81 LEU MD2 2.960 . 4.120 3.241 2.928 3.544 . 0 0 "[ . 1 . 2]" 1
237 1 26 ALA H 1 79 LEU MD2 3.700 . 5.600 5.138 4.491 5.583 . 0 0 "[ . 1 . 2]" 1
238 1 26 ALA H 1 79 LEU MD1 2.650 . 3.500 2.949 2.358 3.330 . 0 0 "[ . 1 . 2]" 1
239 1 85 LEU H 1 85 LEU MD2 2.370 . 2.940 3.014 2.942 3.069 0.129 1 0 "[ . 1 . 2]" 1
240 1 8 THR MG 1 27 GLU H 2.470 . 3.140 2.510 1.912 3.221 0.081 18 0 "[ . 1 . 2]" 1
241 1 50 VAL H 1 69 MET ME 3.620 . 5.440 4.653 4.189 5.352 . 0 0 "[ . 1 . 2]" 1
242 1 6 HIS H 1 26 ALA MB 3.120 . 4.440 3.593 3.120 3.998 . 0 0 "[ . 1 . 2]" 1
243 1 58 VAL MG2 1 62 SER H 3.090 . 4.380 3.907 3.752 4.126 . 0 0 "[ . 1 . 2]" 1
244 1 90 VAL MG1 1 91 PHE H 2.490 . 3.180 2.062 1.942 2.167 . 0 0 "[ . 1 . 2]" 1
245 1 90 VAL MG2 1 91 PHE H 2.490 . 3.180 3.418 3.345 3.489 0.309 6 0 "[ . 1 . 2]" 1
246 1 32 LEU MD1 1 91 PHE H 2.660 . 3.520 2.643 1.786 3.121 0.014 8 0 "[ . 1 . 2]" 1
247 1 32 LEU MD2 1 91 PHE H 2.840 . 3.880 3.878 3.688 4.021 0.141 19 0 "[ . 1 . 2]" 1
248 1 91 PHE H 1 120 LEU MD2 3.180 . 4.560 3.814 3.452 4.087 . 0 0 "[ . 1 . 2]" 1
249 1 124 VAL H 1 124 VAL MG2 2.250 . 2.700 2.110 2.050 2.239 . 0 0 "[ . 1 . 2]" 1
250 1 124 VAL H 1 124 VAL MG1 2.250 . 2.700 2.784 2.706 2.872 0.172 8 0 "[ . 1 . 2]" 1
251 1 100 ALA MB 1 101 THR H 2.760 . 3.720 2.598 2.206 3.038 . 0 0 "[ . 1 . 2]" 1
252 1 2 ALA MB 1 3 LEU H 3.040 . 4.280 2.192 1.901 3.045 . 0 0 "[ . 1 . 2]" 1
253 1 31 THR MG 1 35 ALA H 3.470 . 5.140 4.660 4.096 4.874 . 0 0 "[ . 1 . 2]" 1
254 1 32 LEU MD2 1 35 ALA H 3.740 . 5.680 5.063 4.884 5.300 . 0 0 "[ . 1 . 2]" 1
255 1 30 LEU MD1 1 35 ALA H 3.120 . 4.440 4.342 3.872 4.577 0.137 8 0 "[ . 1 . 2]" 1
256 1 35 ALA H 1 85 LEU MD2 3.180 . 4.560 3.440 3.181 3.712 . 0 0 "[ . 1 . 2]" 1
257 1 30 LEU MD2 1 35 ALA H 2.820 . 3.850 3.196 3.009 3.452 . 0 0 "[ . 1 . 2]" 1
258 1 35 ALA H 1 120 LEU MD1 3.170 . 4.540 4.341 4.190 4.565 0.025 5 0 "[ . 1 . 2]" 1
259 1 80 LEU MD2 1 81 LEU H 2.830 . 3.860 3.711 3.568 3.845 . 0 0 "[ . 1 . 2]" 1
260 1 79 LEU MD1 1 81 LEU H 3.120 . 4.440 4.294 4.011 4.487 0.047 17 0 "[ . 1 . 2]" 1
261 1 81 LEU H 1 81 LEU MD2 2.800 . 3.800 3.572 3.347 3.837 0.037 15 0 "[ . 1 . 2]" 1
262 1 64 ILE MD 1 81 LEU H 3.100 . 4.400 4.222 3.986 4.394 . 0 0 "[ . 1 . 2]" 1
263 1 100 ALA H 1 100 ALA MB 2.520 . 3.240 2.658 2.572 2.765 . 0 0 "[ . 1 . 2]" 1
264 1 66 VAL MG2 1 79 LEU H 2.900 . 4.000 2.486 2.226 3.942 . 0 0 "[ . 1 . 2]" 1
265 1 66 VAL MG1 1 79 LEU H 2.900 . 4.000 4.307 3.878 4.468 0.468 1 0 "[ . 1 . 2]" 1
266 1 93 LEU MD1 1 97 ASP H 2.580 . 3.360 3.022 2.707 3.225 . 0 0 "[ . 1 . 2]" 1
267 1 125 GLU H 1 140 LEU MD1 3.150 . 4.500 4.248 4.141 4.435 . 0 0 "[ . 1 . 2]" 1
268 1 120 LEU H 1 120 LEU MD2 2.710 . 3.620 3.169 2.967 3.328 . 0 0 "[ . 1 . 2]" 1
269 1 2 ALA MB 1 42 VAL H 3.220 . 4.640 3.211 2.081 4.560 . 0 0 "[ . 1 . 2]" 1
270 1 98 LEU MD2 1 145 PHE H 2.690 . 3.580 3.559 3.318 3.699 0.119 11 0 "[ . 1 . 2]" 1
271 1 93 LEU MD1 1 145 PHE H 2.530 . 3.260 3.219 2.659 3.471 0.211 9 0 "[ . 1 . 2]" 1
272 1 80 LEU H 1 81 LEU MD2 3.290 . 4.780 4.741 4.368 4.900 0.120 1 0 "[ . 1 . 2]" 1
273 1 79 LEU MD1 1 80 LEU H 2.240 . 2.680 2.449 2.118 2.693 0.013 4 0 "[ . 1 . 2]" 1
274 1 66 VAL H 1 66 VAL MG2 2.480 . 3.160 2.337 2.168 2.594 . 0 0 "[ . 1 . 2]" 1
275 1 66 VAL H 1 66 VAL MG1 2.480 . 3.160 2.706 2.463 3.752 0.592 4 1 "[ +. 1 . 2]" 1
276 1 45 VAL MG2 1 46 ALA H 3.140 . 4.480 4.052 2.446 4.380 . 0 0 "[ . 1 . 2]" 1
277 1 1 ALA MB 1 5 ALA H 3.620 . 5.440 4.580 3.161 5.411 . 0 0 "[ . 1 . 2]" 1
278 1 5 ALA H 1 5 ALA MB 2.640 . 3.480 2.388 2.251 2.908 . 0 0 "[ . 1 . 2]" 1
279 1 106 ALA H 1 161 THR MG 2.950 . 4.100 3.741 3.221 4.202 0.102 18 0 "[ . 1 . 2]" 1
280 1 3 LEU H 1 3 LEU MD2 3.250 . 4.700 3.983 1.978 4.671 . 0 0 "[ . 1 . 2]" 1
281 1 3 LEU H 1 3 LEU MD1 3.250 . 4.700 3.740 1.814 4.460 . 0 0 "[ . 1 . 2]" 1
282 1 30 LEU MD1 1 31 THR H 3.020 . 4.240 2.740 2.382 3.273 . 0 0 "[ . 1 . 2]" 1
283 1 1 ALA MB 1 4 VAL H 3.090 . 4.380 3.752 2.923 4.429 0.049 13 0 "[ . 1 . 2]" 1
284 1 118 MET ME 1 120 LEU H 3.420 . 5.040 5.004 4.349 5.226 0.186 1 0 "[ . 1 . 2]" 1
285 1 127 ALA H 1 140 LEU MD2 3.070 . 4.340 3.842 3.402 4.241 . 0 0 "[ . 1 . 2]" 1
286 1 1 ALA MB 1 2 ALA H 2.610 . 3.420 2.641 1.870 3.446 0.026 16 0 "[ . 1 . 2]" 1
287 1 25 ARG H 1 26 ALA MB 3.300 . 4.800 4.308 3.986 4.624 . 0 0 "[ . 1 . 2]" 1
288 1 134 ALA MB 1 160 ILE H 2.470 . 3.140 2.079 1.770 2.423 0.030 9 0 "[ . 1 . 2]" 1
289 1 109 ALA MB 1 160 ILE H 3.640 . 5.480 5.067 4.980 5.267 . 0 0 "[ . 1 . 2]" 1
290 1 5 ALA H 1 81 LEU MD2 3.970 . 6.140 5.021 4.168 5.776 . 0 0 "[ . 1 . 2]" 1
291 1 1 ALA MB 1 6 HIS H 3.950 . 6.100 5.343 4.519 6.288 0.188 12 0 "[ . 1 . 2]" 1
292 1 117 ALA H 1 140 LEU MD1 3.780 . 5.760 4.794 4.473 5.239 . 0 0 "[ . 1 . 2]" 1
293 1 102 LEU MD1 1 117 ALA H 3.070 . 4.340 4.046 3.859 4.389 0.049 13 0 "[ . 1 . 2]" 1
294 1 86 LEU H 1 86 LEU MD2 2.750 . 3.700 2.838 2.737 2.968 . 0 0 "[ . 1 . 2]" 1
295 1 32 LEU MD2 1 86 LEU H 2.900 . 4.000 3.441 2.770 4.063 0.063 9 0 "[ . 1 . 2]" 1
296 1 81 LEU MD2 1 82 VAL H 3.110 . 4.420 3.712 3.557 4.028 . 0 0 "[ . 1 . 2]" 1
297 1 32 LEU MD2 1 90 VAL H 3.080 . 4.360 3.608 3.245 3.861 . 0 0 "[ . 1 . 2]" 1
298 1 32 LEU H 1 32 LEU MD1 2.850 . 3.900 3.627 3.543 3.770 . 0 0 "[ . 1 . 2]" 1
299 1 32 LEU H 1 32 LEU MD2 2.670 . 3.540 2.966 2.719 3.330 . 0 0 "[ . 1 . 2]" 1
300 1 32 LEU H 1 85 LEU MD2 2.940 . 4.080 3.792 3.378 3.972 . 0 0 "[ . 1 . 2]" 1
301 1 31 THR MG 1 32 LEU H 2.760 . 3.720 2.225 1.978 3.344 . 0 0 "[ . 1 . 2]" 1
302 1 33 GLU H 1 120 LEU MD2 2.560 . 3.320 2.748 2.601 2.904 . 0 0 "[ . 1 . 2]" 1
303 1 31 THR MG 1 33 GLU H 2.810 . 3.820 2.074 1.816 2.623 . 0 0 "[ . 1 . 2]" 1
304 1 33 GLU H 1 35 ALA MB 3.350 . 4.900 4.694 4.554 4.801 . 0 0 "[ . 1 . 2]" 1
305 1 61 GLY H 1 83 VAL MG1 3.680 . 5.560 5.462 5.106 5.601 0.041 15 0 "[ . 1 . 2]" 1
306 1 61 GLY H 1 83 VAL MG2 3.680 . 5.560 3.238 2.629 3.529 . 0 0 "[ . 1 . 2]" 1
307 1 58 VAL MG2 1 64 ILE H 3.680 . 5.560 5.125 4.828 5.617 0.057 4 0 "[ . 1 . 2]" 1
308 1 140 LEU H 1 156 LEU MD1 3.180 . 4.560 4.157 3.865 4.480 . 0 0 "[ . 1 . 2]" 1
309 1 140 LEU H 1 140 LEU MD2 2.690 . 3.580 3.107 2.894 3.310 . 0 0 "[ . 1 . 2]" 1
310 1 102 LEU MD2 1 159 ARG H 3.220 . 4.640 4.532 4.173 4.793 0.153 16 0 "[ . 1 . 2]" 1
311 1 134 ALA MB 1 159 ARG H 3.860 . 5.920 4.733 4.348 5.178 . 0 0 "[ . 1 . 2]" 1
312 1 140 LEU MD2 1 141 LYS H 3.010 . 4.220 3.951 3.746 4.197 . 0 0 "[ . 1 . 2]" 1
313 1 109 ALA MB 1 133 GLN H 3.580 . 5.360 5.334 5.126 5.490 0.130 16 0 "[ . 1 . 2]" 1
314 1 133 GLN H 1 160 ILE MD 2.890 . 3.980 3.569 3.400 3.853 . 0 0 "[ . 1 . 2]" 1
315 1 106 ALA MB 1 161 THR H 3.130 . 4.460 4.086 3.412 4.463 0.003 15 0 "[ . 1 . 2]" 1
316 1 139 ARG H 1 140 LEU MD2 3.110 . 4.420 4.140 3.645 4.450 0.030 15 0 "[ . 1 . 2]" 1
317 1 64 ILE MD 1 82 VAL H 3.500 . 5.200 5.203 5.089 5.305 0.105 2 0 "[ . 1 . 2]" 1
318 1 136 ARG H 1 158 VAL MG1 2.800 . 3.800 3.133 1.948 3.909 0.109 1 0 "[ . 1 . 2]" 1
319 1 134 ALA H 1 160 ILE MD 2.360 . 2.920 2.339 2.121 2.580 . 0 0 "[ . 1 . 2]" 1
320 1 109 ALA H 1 160 ILE MD 3.350 . 4.900 4.957 4.885 5.003 0.103 17 0 "[ . 1 . 2]" 1
321 1 108 ILE MD 1 114 LYS H 2.450 . 3.100 3.164 2.908 3.470 0.370 11 0 "[ . 1 . 2]" 1
322 1 98 LEU MD1 1 154 LEU H 3.250 . 4.700 4.333 4.260 4.434 . 0 0 "[ . 1 . 2]" 1
323 1 109 ALA MB 1 132 THR H 3.410 . 5.020 3.758 3.508 3.974 . 0 0 "[ . 1 . 2]" 1
324 1 60 GLU H 1 85 LEU MD1 2.230 . 2.660 2.173 2.053 2.278 . 0 0 "[ . 1 . 2]" 1
325 1 60 GLU H 1 85 LEU MD2 2.850 . 3.900 3.956 3.820 4.016 0.116 4 0 "[ . 1 . 2]" 1
326 1 58 VAL MG2 1 60 GLU H 3.590 . 5.380 5.073 4.885 5.210 . 0 0 "[ . 1 . 2]" 1
327 1 35 ALA MB 1 60 GLU H 3.890 . 5.980 4.762 4.277 5.221 . 0 0 "[ . 1 . 2]" 1
328 1 8 THR H 1 8 THR MG 3.440 . 5.080 2.331 2.017 3.160 . 0 0 "[ . 1 . 2]" 1
329 1 30 LEU MD1 1 34 GLU H 3.280 . 4.760 4.698 4.489 4.810 0.050 4 0 "[ . 1 . 2]" 1
330 1 31 THR MG 1 34 GLU H 2.780 . 3.760 3.007 2.174 3.300 . 0 0 "[ . 1 . 2]" 1
331 1 34 GLU H 1 35 ALA MB 3.150 . 4.500 4.126 4.036 4.203 . 0 0 "[ . 1 . 2]" 1
332 1 118 MET H 1 119 THR MG 3.690 . 5.580 5.486 5.203 5.672 0.092 14 0 "[ . 1 . 2]" 1
333 1 36 PHE H 1 120 LEU MD1 2.560 . 3.320 2.964 2.841 3.079 . 0 0 "[ . 1 . 2]" 1
334 1 35 ALA MB 1 36 PHE H 2.530 . 3.260 2.573 2.392 2.813 . 0 0 "[ . 1 . 2]" 1
335 1 115 VAL H 1 127 ALA MB 3.490 . 5.180 4.983 4.418 5.350 0.170 18 0 "[ . 1 . 2]" 1
336 1 106 ALA MB 1 108 ILE H 3.400 . 5.000 4.787 4.697 4.882 . 0 0 "[ . 1 . 2]" 1
337 1 58 VAL H 1 58 VAL MG1 2.220 . 2.640 2.065 1.843 2.417 . 0 0 "[ . 1 . 2]" 1
338 1 35 ALA MB 1 58 VAL H 2.890 . 3.980 3.227 2.657 3.571 . 0 0 "[ . 1 . 2]" 1
339 1 119 THR MG 1 121 GLU H 2.690 . 3.580 2.109 1.796 2.582 0.004 6 0 "[ . 1 . 2]" 1
340 1 118 MET ME 1 121 GLU H 3.550 . 5.300 4.877 4.557 5.258 . 0 0 "[ . 1 . 2]" 1
341 1 59 ARG H 1 85 LEU MD2 3.500 . 5.200 4.419 4.164 4.768 . 0 0 "[ . 1 . 2]" 1
342 1 58 VAL MG1 1 59 ARG H 2.650 . 3.500 3.690 3.606 3.754 0.254 1 0 "[ . 1 . 2]" 1
343 1 58 VAL MG2 1 59 ARG H 2.440 . 3.080 1.964 1.891 2.060 . 0 0 "[ . 1 . 2]" 1
344 1 35 ALA MB 1 59 ARG H 3.460 . 5.120 4.210 3.878 4.509 . 0 0 "[ . 1 . 2]" 1
345 1 111 VAL MG2 1 112 GLY H 2.560 . 3.320 2.603 2.342 2.716 . 0 0 "[ . 1 . 2]" 1
346 1 110 VAL MG2 1 112 GLY H 3.030 . 4.260 4.149 3.766 4.295 0.035 4 0 "[ . 1 . 2]" 1
347 1 37 HIS H 1 120 LEU MD1 3.380 . 4.960 4.909 4.780 5.042 0.082 14 0 "[ . 1 . 2]" 1
348 1 35 ALA MB 1 37 HIS H 3.430 . 5.060 4.671 4.503 4.873 . 0 0 "[ . 1 . 2]" 1
349 1 111 VAL H 1 111 VAL MG2 2.220 . 2.640 2.270 2.155 2.361 . 0 0 "[ . 1 . 2]" 1
350 1 110 VAL MG2 1 111 VAL H 2.380 . 2.960 2.192 1.867 2.355 . 0 0 "[ . 1 . 2]" 1
351 1 111 VAL H 1 111 VAL MG1 2.220 . 2.640 2.361 2.242 2.628 . 0 0 "[ . 1 . 2]" 1
352 1 110 VAL H 1 132 THR MG 3.330 . 4.860 4.745 4.571 5.027 0.167 3 0 "[ . 1 . 2]" 1
353 1 110 VAL H 1 110 VAL MG1 2.380 . 2.970 2.445 2.294 2.666 . 0 0 "[ . 1 . 2]" 1
354 1 110 VAL H 1 110 VAL MG2 2.340 . 2.880 2.080 1.952 2.132 . 0 0 "[ . 1 . 2]" 1
355 1 109 ALA MB 1 110 VAL H 2.580 . 3.360 2.546 2.242 2.720 . 0 0 "[ . 1 . 2]" 1
356 1 106 ALA MB 1 110 VAL H 3.720 . 5.640 4.673 4.523 4.827 . 0 0 "[ . 1 . 2]" 1
357 1 118 MET ME 1 119 THR H 3.300 . 4.800 2.438 2.026 2.855 . 0 0 "[ . 1 . 2]" 1
358 1 57 GLY H 1 58 VAL MG1 3.060 . 4.320 2.737 2.464 3.100 . 0 0 "[ . 1 . 2]" 1
359 1 70 GLY H 1 79 LEU MD2 3.810 . 5.820 5.419 4.792 5.840 0.020 20 0 "[ . 1 . 2]" 1
360 1 149 ALA MB 1 150 GLY H 3.150 . 4.500 3.571 2.943 3.634 . 0 0 "[ . 1 . 2]" 1
361 1 119 THR MG 1 122 GLY H 3.140 . 4.480 2.191 1.907 2.984 . 0 0 "[ . 1 . 2]" 1
362 1 45 VAL MG2 1 47 GLY H 3.920 . 6.040 4.963 4.518 5.517 . 0 0 "[ . 1 . 2]" 1
363 1 46 ALA MB 1 47 GLY H 3.340 . 4.880 3.653 3.621 3.694 . 0 0 "[ . 1 . 2]" 1
364 1 83 VAL H 1 83 VAL MG1 2.340 . 2.880 2.248 2.143 2.415 . 0 0 "[ . 1 . 2]" 1
365 1 83 VAL H 1 83 VAL MG2 2.340 . 2.880 2.329 2.136 2.537 . 0 0 "[ . 1 . 2]" 1
366 1 58 VAL MG2 1 83 VAL H 2.960 . 4.120 3.850 3.613 4.021 . 0 0 "[ . 1 . 2]" 1
367 1 64 ILE MD 1 83 VAL H 2.700 . 3.600 3.688 3.550 3.813 0.213 2 0 "[ . 1 . 2]" 1
368 1 102 LEU MD1 1 103 ASP H 2.470 . 3.140 2.911 2.637 3.085 . 0 0 "[ . 1 . 2]" 1
369 1 84 ARG H 1 85 LEU MD2 3.040 . 4.280 4.047 3.793 4.261 . 0 0 "[ . 1 . 2]" 1
370 1 93 LEU MD1 1 94 GLU H 2.230 . 2.660 2.318 1.886 2.736 0.076 1 0 "[ . 1 . 2]" 1
371 1 101 THR MG 1 102 LEU H 2.380 . 2.970 2.827 2.565 3.263 0.293 10 0 "[ . 1 . 2]" 1
372 1 65 ARG H 1 80 LEU MD2 2.670 . 3.540 3.401 3.193 3.573 0.033 11 0 "[ . 1 . 2]" 1
373 1 127 ALA H 1 156 LEU MD1 3.920 . 6.040 5.473 5.209 5.813 . 0 0 "[ . 1 . 2]" 1
374 1 5 ALA H 1 26 ALA MB 3.410 . 5.020 4.374 3.695 4.935 . 0 0 "[ . 1 . 2]" 1
375 1 138 LEU H 1 156 LEU MD1 3.240 . 4.680 3.964 3.768 4.176 . 0 0 "[ . 1 . 2]" 1
376 1 106 ALA H 1 109 ALA MB 3.550 . 5.300 4.384 4.178 4.525 . 0 0 "[ . 1 . 2]" 1
377 1 128 VAL H 1 128 VAL MG1 2.470 . 3.140 2.344 2.085 3.729 0.589 15 1 "[ . 1 + 2]" 1
378 1 154 LEU MD1 1 155 TYR H 2.220 . 2.640 2.300 1.917 2.543 . 0 0 "[ . 1 . 2]" 1
379 1 126 VAL H 1 140 LEU MD1 3.250 . 4.700 4.312 3.975 4.641 . 0 0 "[ . 1 . 2]" 1
380 1 104 VAL H 1 109 ALA MB 3.830 . 5.860 5.214 4.881 5.576 . 0 0 "[ . 1 . 2]" 1
381 1 101 THR MG 1 157 GLU H 2.900 . 4.000 4.154 3.856 4.295 0.295 5 0 "[ . 1 . 2]" 1
382 1 156 LEU H 1 156 LEU MD1 2.570 . 3.340 3.367 3.194 3.465 0.125 7 0 "[ . 1 . 2]" 1
383 1 90 VAL H 1 120 LEU MD2 3.510 . 5.220 4.817 4.552 5.054 . 0 0 "[ . 1 . 2]" 1
384 1 99 TYR H 1 154 LEU MD1 2.620 . 3.440 3.610 3.487 3.718 0.278 10 0 "[ . 1 . 2]" 1
385 1 61 GLY H 1 85 LEU MD1 3.980 . 6.160 5.258 4.971 5.391 . 0 0 "[ . 1 . 2]" 1
386 1 31 THR H 1 85 LEU MD2 3.330 . 4.860 3.983 3.607 4.449 . 0 0 "[ . 1 . 2]" 1
387 1 135 GLY H 1 158 VAL MG2 3.170 . 4.540 4.095 3.538 4.592 0.052 20 0 "[ . 1 . 2]" 1
388 1 135 GLY H 1 158 VAL MG1 3.170 . 4.540 3.090 1.976 3.722 . 0 0 "[ . 1 . 2]" 1
389 1 134 ALA MB 1 135 GLY H 2.950 . 4.100 3.074 2.704 3.354 . 0 0 "[ . 1 . 2]" 1
390 1 135 GLY H 1 160 ILE MD 3.770 . 5.740 5.188 4.868 5.499 . 0 0 "[ . 1 . 2]" 1
391 1 109 ALA MB 1 159 ARG H 4.070 . 6.340 6.159 5.908 6.350 0.010 2 0 "[ . 1 . 2]" 1
392 1 118 MET H 1 118 MET ME 3.410 . 5.020 4.590 4.404 4.882 . 0 0 "[ . 1 . 2]" 1
393 1 25 ARG H 1 80 LEU H 3.480 . 5.160 4.634 4.362 4.952 . 0 0 "[ . 1 . 2]" 1
394 1 2 ALA H 1 3 LEU H 3.400 . 5.000 2.731 2.153 3.555 . 0 0 "[ . 1 . 2]" 1
395 1 49 ARG H 1 50 VAL H 3.350 . 4.900 4.265 4.148 4.393 . 0 0 "[ . 1 . 2]" 1
396 1 24 LEU H 1 79 LEU H 3.400 . 5.000 4.921 4.567 5.188 0.188 12 0 "[ . 1 . 2]" 1
397 1 25 ARG H 1 26 ALA H 3.220 . 4.640 4.283 4.071 4.415 . 0 0 "[ . 1 . 2]" 1
398 1 119 THR H 1 124 VAL H 3.120 . 4.440 3.828 3.430 4.325 . 0 0 "[ . 1 . 2]" 1
399 1 78 ASP H 1 79 LEU H 3.000 . 4.200 4.387 3.911 4.532 0.332 3 0 "[ . 1 . 2]" 1
400 1 24 LEU H 1 78 ASP H 3.030 . 4.260 3.919 3.557 4.294 0.034 3 0 "[ . 1 . 2]" 1
401 1 70 GLY H 1 78 ASP H 2.820 . 3.850 3.612 2.286 4.069 0.219 15 0 "[ . 1 . 2]" 1
402 1 68 GLY H 1 78 ASP H 3.360 . 4.920 4.722 4.387 5.016 0.096 20 0 "[ . 1 . 2]" 1
403 1 2 ALA H 1 2 ALA MB 2.900 . 4.000 2.424 2.221 2.980 . 0 0 "[ . 1 . 2]" 1
404 1 3 LEU H 1 4 VAL H 3.040 . 4.280 2.794 2.135 4.355 0.075 6 0 "[ . 1 . 2]" 1
405 1 72 GLN H 1 73 GLY H 3.460 . 5.120 4.493 4.260 4.656 . 0 0 "[ . 1 . 2]" 1
406 1 119 THR H 1 120 LEU H 3.380 . 4.950 4.427 4.321 4.495 . 0 0 "[ . 1 . 2]" 1
407 1 120 LEU H 1 122 GLY H 3.200 . 4.600 4.141 4.009 4.284 . 0 0 "[ . 1 . 2]" 1
408 1 119 THR MG 1 120 LEU H 3.030 . 4.260 3.337 3.133 3.532 . 0 0 "[ . 1 . 2]" 1
409 1 120 LEU H 1 120 LEU MD1 3.010 . 4.220 3.657 3.493 3.754 . 0 0 "[ . 1 . 2]" 1
410 1 8 THR MG 1 25 ARG H 3.670 . 5.540 5.244 4.234 5.726 0.186 12 0 "[ . 1 . 2]" 1
411 1 94 GLU H 1 97 ASP H 2.850 . 3.900 3.524 3.208 3.942 0.042 12 0 "[ . 1 . 2]" 1
412 1 50 VAL H 1 51 SER H 3.350 . 4.900 4.378 4.239 4.455 . 0 0 "[ . 1 . 2]" 1
413 1 51 SER H 1 52 VAL H 3.390 . 4.980 4.436 4.279 4.557 . 0 0 "[ . 1 . 2]" 1
414 1 43 VAL H 1 52 VAL H 2.790 . 3.780 3.441 2.832 3.920 0.140 16 0 "[ . 1 . 2]" 1
415 1 42 VAL H 1 43 VAL H 3.470 . 5.140 4.528 4.274 4.617 . 0 0 "[ . 1 . 2]" 1
416 1 43 VAL H 1 51 SER H 3.580 . 5.360 4.801 4.398 5.035 . 0 0 "[ . 1 . 2]" 1
417 1 24 LEU H 1 80 LEU H 2.900 . 4.000 3.878 3.378 4.249 0.249 14 0 "[ . 1 . 2]" 1
418 1 79 LEU H 1 80 LEU H 3.350 . 4.900 4.186 4.023 4.331 . 0 0 "[ . 1 . 2]" 1
419 1 66 VAL H 1 80 LEU H 3.600 . 5.400 4.916 4.595 5.113 . 0 0 "[ . 1 . 2]" 1
420 1 26 ALA H 1 80 LEU H 3.330 . 4.860 4.091 3.714 4.382 . 0 0 "[ . 1 . 2]" 1
421 1 64 ILE H 1 82 VAL H 3.500 . 5.200 4.476 4.260 4.608 . 0 0 "[ . 1 . 2]" 1
422 1 64 ILE H 1 81 LEU H 2.350 . 2.900 2.763 2.536 2.925 0.025 1 0 "[ . 1 . 2]" 1
423 1 80 LEU H 1 81 LEU H 3.350 . 4.900 4.153 4.037 4.270 . 0 0 "[ . 1 . 2]" 1
424 1 45 VAL H 1 47 GLY H 3.410 . 5.020 4.023 3.761 4.266 . 0 0 "[ . 1 . 2]" 1
425 1 46 ALA H 1 47 GLY H 2.870 . 3.940 2.667 2.612 2.752 . 0 0 "[ . 1 . 2]" 1
426 1 68 GLY H 1 70 GLY H 3.390 . 4.980 4.086 3.358 4.884 . 0 0 "[ . 1 . 2]" 1
427 1 70 GLY H 1 77 GLY H 3.450 . 5.100 4.453 3.860 5.185 0.085 4 0 "[ . 1 . 2]" 1
428 1 59 ARG H 1 62 SER H 3.000 . 4.200 3.746 3.616 3.967 . 0 0 "[ . 1 . 2]" 1
429 1 61 GLY H 1 62 SER H 2.480 . 3.160 2.634 2.510 2.756 . 0 0 "[ . 1 . 2]" 1
430 1 62 SER H 1 83 VAL H 3.050 . 4.290 3.936 3.742 4.227 . 0 0 "[ . 1 . 2]" 1
431 1 5 ALA H 1 6 HIS H 3.480 . 5.160 2.594 1.744 3.150 0.056 19 0 "[ . 1 . 2]" 1
432 1 26 ALA H 1 27 GLU H 3.350 . 4.900 4.239 3.974 4.397 . 0 0 "[ . 1 . 2]" 1
433 1 3 LEU H 1 42 VAL H 3.390 . 4.980 4.664 3.802 5.129 0.149 17 0 "[ . 1 . 2]" 1
434 1 46 ALA H 1 46 ALA MB 3.200 . 4.600 2.914 2.874 2.946 . 0 0 "[ . 1 . 2]" 1
435 1 46 ALA H 1 48 ARG H 3.260 . 4.720 4.185 4.007 4.354 . 0 0 "[ . 1 . 2]" 1
436 1 5 ALA H 1 27 GLU H 4.000 . 6.200 5.334 4.303 6.287 0.087 6 0 "[ . 1 . 2]" 1
437 1 93 LEU MD1 1 98 LEU H 3.190 . 4.580 4.280 4.147 4.395 . 0 0 "[ . 1 . 2]" 1
438 1 64 ILE H 1 65 ARG H 3.270 . 4.740 4.315 4.189 4.393 . 0 0 "[ . 1 . 2]" 1
439 1 102 LEU H 1 157 GLU H 2.540 . 3.280 2.878 2.412 3.351 0.071 10 0 "[ . 1 . 2]" 1
440 1 102 LEU H 1 156 LEU MD2 2.920 . 4.040 3.900 3.653 4.075 0.035 10 0 "[ . 1 . 2]" 1
441 1 97 ASP H 1 98 LEU H 3.400 . 5.000 4.535 4.502 4.561 . 0 0 "[ . 1 . 2]" 1
442 1 99 TYR H 1 100 ALA H 3.200 . 4.600 4.106 4.047 4.233 . 0 0 "[ . 1 . 2]" 1
443 1 99 TYR H 1 100 ALA MB 3.200 . 4.600 4.184 3.983 4.439 . 0 0 "[ . 1 . 2]" 1
444 1 61 GLY H 1 85 LEU H 3.070 . 4.340 3.767 3.370 4.275 . 0 0 "[ . 1 . 2]" 1
445 1 60 GLU H 1 85 LEU H 3.110 . 4.420 4.526 4.357 4.698 0.278 13 0 "[ . 1 . 2]" 1
446 1 32 LEU MD1 1 90 VAL H 2.460 . 3.120 2.323 1.786 2.828 0.014 7 0 "[ . 1 . 2]" 1
447 1 32 LEU H 1 120 LEU MD2 3.340 . 4.880 4.464 4.264 4.554 . 0 0 "[ . 1 . 2]" 1
448 1 32 LEU H 1 120 LEU MD1 3.760 . 5.720 5.240 4.952 5.477 . 0 0 "[ . 1 . 2]" 1
449 1 32 LEU H 1 35 ALA H 3.550 . 5.300 4.698 4.608 4.852 . 0 0 "[ . 1 . 2]" 1
450 1 32 LEU H 1 34 GLU H 3.280 . 4.760 4.032 3.889 4.136 . 0 0 "[ . 1 . 2]" 1
451 1 33 GLU H 1 35 ALA H 3.140 . 4.480 4.212 4.078 4.343 . 0 0 "[ . 1 . 2]" 1
452 1 66 VAL H 1 78 ASP H 4.270 . 6.740 6.328 5.792 6.774 0.034 16 0 "[ . 1 . 2]" 1
453 1 68 GLY H 1 79 LEU H 3.860 . 5.920 5.352 4.932 5.889 . 0 0 "[ . 1 . 2]" 1
454 1 142 GLY H 1 144 GLY H 3.140 . 4.480 3.781 3.448 4.165 . 0 0 "[ . 1 . 2]" 1
455 1 98 LEU H 1 153 ASP H 3.090 . 4.380 3.460 3.031 3.830 . 0 0 "[ . 1 . 2]" 1
456 1 97 ASP H 1 153 ASP H 3.640 . 5.480 4.782 4.111 5.397 . 0 0 "[ . 1 . 2]" 1
457 1 153 ASP H 1 154 LEU H 3.350 . 4.900 4.416 4.352 4.506 . 0 0 "[ . 1 . 2]" 1
458 1 93 LEU MD1 1 153 ASP H 3.740 . 5.680 5.428 4.913 5.712 0.032 16 0 "[ . 1 . 2]" 1
459 1 61 GLY H 1 85 LEU MD2 3.660 . 5.520 4.992 4.609 5.282 . 0 0 "[ . 1 . 2]" 1
460 1 140 LEU H 1 156 LEU H 3.520 . 5.240 4.349 4.096 4.611 . 0 0 "[ . 1 . 2]" 1
461 1 158 VAL H 1 159 ARG H 3.480 . 5.160 4.486 4.392 4.601 . 0 0 "[ . 1 . 2]" 1
462 1 159 ARG H 1 160 ILE H 3.120 . 4.440 3.857 3.776 4.021 . 0 0 "[ . 1 . 2]" 1
463 1 45 VAL H 1 46 ALA H 3.350 . 4.900 4.272 4.073 4.448 . 0 0 "[ . 1 . 2]" 1
464 1 45 VAL MG1 1 46 ALA H 3.140 . 4.480 3.531 2.408 3.974 . 0 0 "[ . 1 . 2]" 1
465 1 64 ILE H 1 83 VAL H 3.460 . 5.120 4.686 4.509 4.870 . 0 0 "[ . 1 . 2]" 1
466 1 63 VAL H 1 64 ILE H 3.420 . 5.040 4.421 4.357 4.526 . 0 0 "[ . 1 . 2]" 1
467 1 63 VAL H 1 83 VAL H 3.720 . 5.640 5.307 5.203 5.397 . 0 0 "[ . 1 . 2]" 1
468 1 61 GLY H 1 83 VAL H 3.140 . 4.480 4.449 4.138 4.580 0.100 5 0 "[ . 1 . 2]" 1
469 1 59 ARG H 1 83 VAL H 4.140 . 6.490 5.624 5.276 5.919 . 0 0 "[ . 1 . 2]" 1
470 1 61 GLY H 1 84 ARG H 3.730 . 5.660 5.011 4.755 5.230 . 0 0 "[ . 1 . 2]" 1
471 1 53 ARG H 1 54 ILE H 3.140 . 4.480 4.107 3.947 4.359 . 0 0 "[ . 1 . 2]" 1
472 1 127 ALA H 1 127 ALA MB 2.610 . 3.410 2.306 2.260 2.394 . 0 0 "[ . 1 . 2]" 1
473 1 115 VAL H 1 127 ALA H 3.740 . 5.680 5.079 4.809 5.269 . 0 0 "[ . 1 . 2]" 1
474 1 85 LEU MD2 1 86 LEU H 2.920 . 4.040 3.580 3.416 3.776 . 0 0 "[ . 1 . 2]" 1
475 1 32 LEU H 1 86 LEU H 3.150 . 4.500 3.534 2.989 4.048 . 0 0 "[ . 1 . 2]" 1
476 1 127 ALA H 1 128 VAL H 3.320 . 4.840 4.304 4.048 4.490 . 0 0 "[ . 1 . 2]" 1
477 1 106 ALA H 1 106 ALA MB 2.640 . 3.480 2.261 2.242 2.287 . 0 0 "[ . 1 . 2]" 1
478 1 138 LEU H 1 139 ARG H 3.440 . 5.080 4.296 4.088 4.521 . 0 0 "[ . 1 . 2]" 1
479 1 161 THR H 1 161 THR MG 2.890 . 3.980 2.204 1.931 3.788 . 0 0 "[ . 1 . 2]" 1
480 1 141 LYS H 1 142 GLY H 3.490 . 5.180 4.593 4.487 4.664 . 0 0 "[ . 1 . 2]" 1
481 1 106 ALA H 1 161 THR H 2.810 . 3.820 3.619 3.184 3.871 0.051 15 0 "[ . 1 . 2]" 1
482 1 140 LEU H 1 141 LYS H 3.360 . 4.920 4.287 4.145 4.526 . 0 0 "[ . 1 . 2]" 1
483 1 141 LYS H 1 154 LEU H 3.730 . 5.660 4.931 4.696 5.232 . 0 0 "[ . 1 . 2]" 1
484 1 128 VAL H 1 128 VAL MG2 2.470 . 3.140 2.283 2.091 2.481 . 0 0 "[ . 1 . 2]" 1
485 1 127 ALA MB 1 128 VAL H 2.820 . 3.850 3.425 3.223 3.558 . 0 0 "[ . 1 . 2]" 1
486 1 99 TYR H 1 155 TYR H 3.240 . 4.680 4.503 4.333 4.695 0.015 12 0 "[ . 1 . 2]" 1
487 1 155 TYR H 1 156 LEU H 3.250 . 4.700 4.188 4.042 4.246 . 0 0 "[ . 1 . 2]" 1
488 1 98 LEU H 1 155 TYR H 2.910 . 4.020 3.548 3.151 3.971 . 0 0 "[ . 1 . 2]" 1
489 1 154 LEU H 1 155 TYR H 3.470 . 5.140 4.319 4.158 4.444 . 0 0 "[ . 1 . 2]" 1
490 1 100 ALA MB 1 155 TYR H 3.530 . 5.260 4.876 4.495 5.276 0.016 12 0 "[ . 1 . 2]" 1
491 1 132 THR MG 1 133 GLN H 2.320 . 2.840 2.974 2.653 3.036 0.196 9 0 "[ . 1 . 2]" 1
492 1 104 VAL H 1 159 ARG H 2.630 . 3.460 3.147 2.842 3.451 . 0 0 "[ . 1 . 2]" 1
493 1 103 ASP H 1 104 VAL H 3.240 . 4.680 4.370 4.211 4.546 . 0 0 "[ . 1 . 2]" 1
494 1 117 ALA MB 1 126 VAL H 3.100 . 4.400 4.078 3.625 4.439 0.039 8 0 "[ . 1 . 2]" 1
495 1 45 VAL H 1 46 ALA MB 3.590 . 5.380 4.770 4.528 4.982 . 0 0 "[ . 1 . 2]" 1
496 1 137 LYS H 1 138 LEU H 3.290 . 4.780 4.225 4.038 4.378 . 0 0 "[ . 1 . 2]" 1
497 1 48 ARG H 1 50 VAL H 4.230 . 6.660 6.259 5.903 6.659 . 0 0 "[ . 1 . 2]" 1
498 1 100 ALA H 1 154 LEU MD1 2.530 . 3.260 2.952 2.566 3.341 0.081 9 0 "[ . 1 . 2]" 1
499 1 100 ALA H 1 155 TYR H 3.090 . 4.380 4.147 3.770 4.450 0.070 6 0 "[ . 1 . 2]" 1
500 1 138 LEU H 1 156 LEU H 2.640 . 3.480 2.820 2.362 3.272 . 0 0 "[ . 1 . 2]" 1
501 1 154 LEU H 1 156 LEU H 4.230 . 6.660 6.064 5.867 6.386 . 0 0 "[ . 1 . 2]" 1
502 1 62 SER H 1 63 VAL H 3.440 . 5.080 4.496 4.436 4.553 . 0 0 "[ . 1 . 2]" 1
503 1 35 ALA H 1 120 LEU MD2 3.570 . 5.340 5.181 5.056 5.344 0.004 13 0 "[ . 1 . 2]" 1
504 1 48 ARG H 1 49 ARG H 3.310 . 4.820 4.345 4.151 4.432 . 0 0 "[ . 1 . 2]" 1
505 1 136 ARG H 1 137 LYS H 3.460 . 5.120 4.607 4.566 4.646 . 0 0 "[ . 1 . 2]" 1
506 1 136 ARG H 1 158 VAL MG2 2.800 . 3.800 3.749 3.276 4.203 0.403 13 0 "[ . 1 . 2]" 1
507 1 134 ALA H 1 135 GLY H 3.460 . 5.120 4.541 4.403 4.630 . 0 0 "[ . 1 . 2]" 1
508 1 135 GLY H 1 136 ARG H 2.320 . 2.840 2.296 2.086 2.580 . 0 0 "[ . 1 . 2]" 1
509 1 133 GLN H 1 136 ARG H 3.350 . 4.900 4.712 4.330 4.972 0.072 20 0 "[ . 1 . 2]" 1
510 1 132 THR MG 1 134 ALA H 3.250 . 4.700 4.671 4.451 4.773 0.073 15 0 "[ . 1 . 2]" 1
511 1 109 ALA H 1 110 VAL MG2 2.900 . 4.000 4.006 3.903 4.053 0.053 13 0 "[ . 1 . 2]" 1
512 1 109 ALA H 1 112 GLY H 3.380 . 4.950 4.628 4.405 4.739 . 0 0 "[ . 1 . 2]" 1
513 1 133 GLN H 1 134 ALA H 3.270 . 4.740 4.418 4.371 4.513 . 0 0 "[ . 1 . 2]" 1
514 1 2 ALA MB 1 4 VAL H 3.670 . 5.540 4.415 3.603 5.725 0.185 6 0 "[ . 1 . 2]" 1
515 1 134 ALA H 1 136 ARG H 3.760 . 5.720 4.877 4.657 5.124 . 0 0 "[ . 1 . 2]" 1
516 1 66 VAL H 1 79 LEU H 2.410 . 3.020 2.572 2.076 2.897 . 0 0 "[ . 1 . 2]" 1
517 1 106 ALA H 1 109 ALA H 3.500 . 5.200 4.754 4.624 4.835 . 0 0 "[ . 1 . 2]" 1
518 1 70 GLY H 1 79 LEU H 3.130 . 4.460 3.943 3.446 4.466 0.006 19 0 "[ . 1 . 2]" 1
519 1 69 MET ME 1 79 LEU H 3.370 . 4.940 4.992 4.643 5.186 0.246 3 0 "[ . 1 . 2]" 1
520 1 46 ALA MB 1 48 ARG H 2.970 . 4.140 3.478 3.218 3.804 . 0 0 "[ . 1 . 2]" 1
521 1 45 VAL H 1 48 ARG H 2.680 . 3.560 3.242 2.780 3.573 0.013 3 0 "[ . 1 . 2]" 1
522 1 47 GLY H 1 48 ARG H 2.420 . 3.040 2.531 2.348 2.680 . 0 0 "[ . 1 . 2]" 1
523 1 26 ALA MB 1 27 GLU H 2.610 . 3.410 2.921 2.432 3.345 . 0 0 "[ . 1 . 2]" 1
524 1 113 GLY H 1 114 LYS H 3.220 . 4.640 3.812 1.733 4.402 0.067 17 0 "[ . 1 . 2]" 1
525 1 140 LEU H 1 154 LEU H 2.410 . 3.020 2.948 2.682 3.121 0.101 7 0 "[ . 1 . 2]" 1
526 1 98 LEU H 1 154 LEU H 3.420 . 5.040 4.758 4.365 4.903 . 0 0 "[ . 1 . 2]" 1
527 1 144 GLY H 1 154 LEU H 3.140 . 4.480 4.310 3.917 4.544 0.064 5 0 "[ . 1 . 2]" 1
528 1 92 ARG H 1 99 TYR H 2.320 . 2.840 2.665 2.446 2.969 0.129 14 0 "[ . 1 . 2]" 1
529 1 92 ARG H 1 100 ALA MB 3.310 . 4.820 4.193 3.676 4.599 . 0 0 "[ . 1 . 2]" 1
530 1 110 VAL MG1 1 132 THR H 3.670 . 5.540 4.707 4.158 5.077 . 0 0 "[ . 1 . 2]" 1
531 1 32 LEU H 1 35 ALA MB 3.340 . 4.880 4.693 4.460 4.844 . 0 0 "[ . 1 . 2]" 1
532 1 60 GLU H 1 61 GLY H 3.450 . 5.100 4.515 4.458 4.571 . 0 0 "[ . 1 . 2]" 1
533 1 60 GLU H 1 62 SER H 3.490 . 5.180 4.550 4.415 4.658 . 0 0 "[ . 1 . 2]" 1
534 1 147 GLY H 1 149 ALA H 3.390 . 4.980 4.254 3.736 4.867 . 0 0 "[ . 1 . 2]" 1
535 1 149 ALA H 1 150 GLY H 2.850 . 3.900 2.730 2.359 2.880 . 0 0 "[ . 1 . 2]" 1
536 1 117 ALA MB 1 118 MET H 3.220 . 4.640 2.985 2.429 3.342 . 0 0 "[ . 1 . 2]" 1
537 1 117 ALA H 1 118 MET H 3.610 . 5.420 4.430 4.200 4.545 . 0 0 "[ . 1 . 2]" 1
538 1 34 GLU H 1 120 LEU MD1 3.820 . 5.840 4.921 4.761 5.045 . 0 0 "[ . 1 . 2]" 1
539 1 33 GLU H 1 34 GLU H 2.520 . 3.240 2.831 2.748 2.904 . 0 0 "[ . 1 . 2]" 1
540 1 31 THR H 1 34 GLU H 3.020 . 4.240 3.814 3.448 4.083 . 0 0 "[ . 1 . 2]" 1
541 1 34 GLU H 1 35 ALA H 2.570 . 3.340 2.488 2.381 2.572 . 0 0 "[ . 1 . 2]" 1
542 1 147 GLY H 1 151 ARG H 3.540 . 5.280 4.677 4.257 5.220 . 0 0 "[ . 1 . 2]" 1
543 1 150 GLY H 1 151 ARG H 3.420 . 5.040 4.179 3.797 4.653 . 0 0 "[ . 1 . 2]" 1
544 1 5 ALA MB 1 6 HIS H 2.900 . 4.000 2.482 1.897 3.719 . 0 0 "[ . 1 . 2]" 1
545 1 117 ALA MB 1 124 VAL H 3.080 . 4.360 3.810 3.487 3.978 . 0 0 "[ . 1 . 2]" 1
546 1 119 THR MG 1 124 VAL H 2.710 . 3.620 3.108 2.604 3.685 0.065 18 0 "[ . 1 . 2]" 1
547 1 91 PHE H 1 100 ALA MB 3.520 . 5.240 4.895 4.512 5.271 0.031 15 0 "[ . 1 . 2]" 1
548 1 91 PHE H 1 92 ARG H 3.340 . 4.880 4.372 4.317 4.447 . 0 0 "[ . 1 . 2]" 1
549 1 90 VAL H 1 91 PHE H 2.350 . 2.900 1.899 1.763 2.076 0.037 3 0 "[ . 1 . 2]" 1
550 1 32 LEU MD1 1 33 GLU H 3.020 . 4.240 4.159 4.022 4.285 0.045 13 0 "[ . 1 . 2]" 1
551 1 33 GLU H 1 120 LEU MD1 3.130 . 4.460 4.016 3.857 4.272 . 0 0 "[ . 1 . 2]" 1
552 1 131 ARG H 1 132 THR H 2.530 . 3.260 2.770 2.566 3.111 . 0 0 "[ . 1 . 2]" 1
553 1 36 PHE H 1 58 VAL H 3.450 . 5.100 5.295 5.120 5.398 0.298 4 0 "[ . 1 . 2]" 1
554 1 101 THR H 1 156 LEU MD2 3.230 . 4.660 4.473 4.130 4.693 0.033 1 0 "[ . 1 . 2]" 1
555 1 101 THR H 1 157 GLU H 3.390 . 4.980 4.568 4.364 4.802 . 0 0 "[ . 1 . 2]" 1
556 1 115 VAL H 1 128 VAL H 3.010 . 4.220 4.034 3.684 4.256 0.036 13 0 "[ . 1 . 2]" 1
557 1 106 ALA H 1 108 ILE H 3.180 . 4.560 4.544 4.391 4.644 0.084 18 0 "[ . 1 . 2]" 1
558 1 108 ILE H 1 109 ALA H 2.320 . 2.840 2.632 2.546 2.733 . 0 0 "[ . 1 . 2]" 1
559 1 57 GLY H 1 58 VAL H 2.320 . 2.840 2.117 1.816 2.437 . 0 0 "[ . 1 . 2]" 1
560 1 58 VAL H 1 120 LEU MD1 4.130 . 6.460 6.154 5.750 6.531 0.071 3 0 "[ . 1 . 2]" 1
561 1 120 LEU MD2 1 121 GLU H 3.510 . 5.220 4.692 4.569 4.810 . 0 0 "[ . 1 . 2]" 1
562 1 120 LEU H 1 121 GLU H 2.580 . 3.360 2.619 2.510 2.746 . 0 0 "[ . 1 . 2]" 1
563 1 121 GLU H 1 122 GLY H 2.620 . 3.440 2.275 2.070 2.464 . 0 0 "[ . 1 . 2]" 1
564 1 59 ARG H 1 60 GLU H 3.390 . 4.980 4.411 4.358 4.457 . 0 0 "[ . 1 . 2]" 1
565 1 58 VAL H 1 59 ARG H 3.380 . 4.960 4.491 4.411 4.556 . 0 0 "[ . 1 . 2]" 1
566 1 142 GLY H 1 143 LYS H 2.500 . 3.200 2.584 2.399 2.682 . 0 0 "[ . 1 . 2]" 1
567 1 143 LYS H 1 144 GLY H 2.450 . 3.100 2.139 1.807 2.535 . 0 0 "[ . 1 . 2]" 1
568 1 111 VAL MG1 1 112 GLY H 2.950 . 4.100 4.036 3.906 4.162 0.062 11 0 "[ . 1 . 2]" 1
569 1 112 GLY H 1 113 GLY H 3.290 . 4.780 2.929 2.578 4.155 . 0 0 "[ . 1 . 2]" 1
570 1 111 VAL H 1 112 GLY H 2.360 . 2.920 2.370 2.222 2.436 . 0 0 "[ . 1 . 2]" 1
571 1 109 ALA H 1 111 VAL H 3.340 . 4.880 4.335 4.143 4.700 . 0 0 "[ . 1 . 2]" 1
572 1 110 VAL H 1 111 VAL H 2.570 . 3.340 2.568 2.482 2.705 . 0 0 "[ . 1 . 2]" 1
573 1 109 ALA MB 1 111 VAL H 3.600 . 5.400 4.663 4.478 4.896 . 0 0 "[ . 1 . 2]" 1
574 1 36 PHE H 1 37 HIS H 2.530 . 3.260 2.690 2.511 2.818 . 0 0 "[ . 1 . 2]" 1
575 1 110 VAL H 1 112 GLY H 2.960 . 4.120 3.781 3.685 3.923 . 0 0 "[ . 1 . 2]" 1
576 1 110 VAL H 1 113 GLY H 4.370 . 6.940 5.655 5.297 7.027 0.087 17 0 "[ . 1 . 2]" 1
577 1 109 ALA H 1 110 VAL H 2.490 . 3.190 2.735 2.615 2.872 . 0 0 "[ . 1 . 2]" 1
578 1 31 THR H 1 35 ALA H 3.600 . 5.400 4.412 4.090 4.838 . 0 0 "[ . 1 . 2]" 1
579 1 35 ALA MB 1 57 GLY H 3.630 . 5.460 4.405 4.065 4.754 . 0 0 "[ . 1 . 2]" 1
580 1 135 GLY H 1 159 ARG H 3.660 . 5.520 5.044 4.888 5.266 . 0 0 "[ . 1 . 2]" 1
581 1 135 GLY H 1 158 VAL H 3.100 . 4.400 3.995 3.707 4.340 . 0 0 "[ . 1 . 2]" 1
582 1 132 THR MG 1 135 GLY H 3.950 . 6.100 5.943 5.430 6.210 0.110 20 0 "[ . 1 . 2]" 1
583 1 147 GLY H 1 152 GLY H 3.550 . 5.300 4.804 4.294 5.349 0.049 6 0 "[ . 1 . 2]" 1
584 1 147 GLY H 1 150 GLY H 3.200 . 4.600 3.637 2.954 3.877 . 0 0 "[ . 1 . 2]" 1
585 1 118 MET ME 1 122 GLY H 3.580 . 5.360 3.494 3.159 3.745 . 0 0 "[ . 1 . 2]" 1
586 1 119 THR H 1 122 GLY H 3.250 . 4.700 3.535 3.230 3.811 . 0 0 "[ . 1 . 2]" 1
587 1 144 GLY H 1 153 ASP H 3.420 . 5.040 3.861 3.448 4.326 . 0 0 "[ . 1 . 2]" 1
588 1 144 GLY H 1 145 PHE H 3.400 . 5.000 4.402 4.254 4.551 . 0 0 "[ . 1 . 2]" 1
589 1 152 GLY H 1 153 ASP H 3.400 . 5.000 4.348 4.220 4.546 . 0 0 "[ . 1 . 2]" 1
590 1 108 ILE MD 1 113 GLY H 2.960 . 4.120 4.331 3.779 4.554 0.434 2 0 "[ . 1 . 2]" 1
591 1 45 VAL MG1 1 47 GLY H 3.920 . 6.040 5.051 4.413 5.409 . 0 0 "[ . 1 . 2]" 1
592 1 1 ALA MB 1 4 VAL QG 3.430 . 5.060 2.899 1.824 4.353 . 0 0 "[ . 1 . 2]" 1
593 1 1 ALA MB 1 42 VAL QG 3.800 . 5.800 3.981 2.204 5.912 0.112 17 0 "[ . 1 . 2]" 1
594 1 2 ALA H 1 42 VAL QG 3.060 . 4.320 3.157 1.786 4.591 0.271 17 0 "[ . 1 . 2]" 1
595 1 2 ALA MB 1 3 LEU QD 3.760 . 5.720 3.724 2.501 4.702 . 0 0 "[ . 1 . 2]" 1
596 1 2 ALA MB 1 42 VAL QG 3.010 . 4.220 2.233 1.742 4.412 0.192 20 0 "[ . 1 . 2]" 1
597 1 3 LEU H 1 42 VAL QG 3.010 . 4.220 3.872 3.006 4.363 0.143 15 0 "[ . 1 . 2]" 1
598 1 3 LEU QD 1 4 VAL H 3.120 . 4.440 3.138 1.719 3.965 0.081 10 0 "[ . 1 . 2]" 1
599 1 3 LEU QD 1 4 VAL QG 3.210 . 4.620 3.524 1.977 4.670 0.050 14 0 "[ . 1 . 2]" 1
600 1 3 LEU QD 1 28 LEU QD 2.570 . 3.340 2.109 1.685 2.602 0.115 20 0 "[ . 1 . 2]" 1
601 1 3 LEU QD 1 42 VAL H 3.340 . 4.880 4.610 3.237 5.126 0.246 15 0 "[ . 1 . 2]" 1
602 1 3 LEU QD 1 43 VAL QG 3.680 . 5.560 3.726 1.863 5.345 . 0 0 "[ . 1 . 2]" 1
603 1 3 LEU QD 1 45 VAL QG 4.500 . 7.200 5.837 4.613 7.021 . 0 0 "[ . 1 . 2]" 1
604 1 3 LEU QD 1 52 VAL QG 2.610 . 3.410 2.766 1.854 3.852 0.442 15 0 "[ . 1 . 2]" 1
605 1 3 LEU QD 1 54 ILE H 3.470 . 5.140 4.607 3.179 5.297 0.157 9 0 "[ . 1 . 2]" 1
606 1 3 LEU QD 1 54 ILE MD 2.660 . 3.520 2.400 1.740 3.133 0.060 17 0 "[ . 1 . 2]" 1
607 1 3 LEU QD 1 64 ILE MD 3.850 . 5.900 4.429 3.253 5.214 . 0 0 "[ . 1 . 2]" 1
608 1 3 LEU QD 1 81 LEU MD2 3.600 . 5.400 4.277 1.950 5.467 0.067 15 0 "[ . 1 . 2]" 1
609 1 4 VAL H 1 4 VAL QG 2.300 . 2.800 2.186 1.871 2.886 0.086 6 0 "[ . 1 . 2]" 1
610 1 4 VAL H 1 28 LEU QD 2.410 . 3.020 3.197 2.985 3.322 0.302 5 0 "[ . 1 . 2]" 1
611 1 4 VAL QG 1 5 ALA H 2.320 . 2.840 2.512 1.681 3.080 0.240 18 0 "[ . 1 . 2]" 1
612 1 4 VAL QG 1 6 HIS H 3.010 . 4.220 2.558 1.768 3.556 0.032 20 0 "[ . 1 . 2]" 1
613 1 4 VAL QG 1 26 ALA MB 2.990 . 4.180 2.327 1.790 4.307 0.127 3 0 "[ . 1 . 2]" 1
614 1 4 VAL QG 1 28 LEU QD 3.070 . 4.340 2.612 1.700 3.625 0.100 8 0 "[ . 1 . 2]" 1
615 1 4 VAL QG 1 43 VAL QG 3.260 . 4.720 2.202 1.668 4.849 0.132 1 0 "[ . 1 . 2]" 1
616 1 4 VAL QG 1 45 VAL QG 3.620 . 5.440 2.772 1.765 5.441 0.035 17 0 "[ . 1 . 2]" 1
617 1 4 VAL QG 1 81 LEU MD2 3.920 . 6.040 2.543 1.801 4.930 . 0 0 "[ . 1 . 2]" 1
618 1 6 HIS H 1 45 VAL QG 3.560 . 5.320 4.948 3.518 5.433 0.113 10 0 "[ . 1 . 2]" 1
619 1 7 VAL QG 1 24 LEU QD 2.450 . 3.100 2.050 1.761 2.753 0.039 3 0 "[ . 1 . 2]" 1
620 1 7 VAL QG 1 25 ARG H 2.460 . 3.120 2.832 1.992 3.194 0.074 8 0 "[ . 1 . 2]" 1
621 1 7 VAL QG 1 26 ALA MB 3.090 . 4.380 2.619 1.821 3.134 . 0 0 "[ . 1 . 2]" 1
622 1 7 VAL QG 1 45 VAL QG 2.430 . 3.060 2.182 1.819 3.028 . 0 0 "[ . 1 . 2]" 1
623 1 7 VAL QG 1 46 ALA H 2.890 . 3.980 2.671 1.916 3.891 . 0 0 "[ . 1 . 2]" 1
624 1 7 VAL QG 1 46 ALA MB 2.920 . 4.040 3.176 2.305 4.058 0.018 9 0 "[ . 1 . 2]" 1
625 1 7 VAL QG 1 79 LEU MD1 3.560 . 5.320 3.360 2.312 4.049 . 0 0 "[ . 1 . 2]" 1
626 1 7 VAL QG 1 81 LEU MD2 4.120 . 6.440 4.803 4.075 5.265 . 0 0 "[ . 1 . 2]" 1
627 1 8 THR MG 1 24 LEU QD 3.950 . 6.100 5.699 4.833 6.269 0.169 14 0 "[ . 1 . 2]" 1
628 1 8 THR MG 1 45 VAL QG 4.240 . 6.680 5.664 4.961 6.125 . 0 0 "[ . 1 . 2]" 1
629 1 24 LEU QD 1 25 ARG H 2.240 . 2.680 2.479 1.787 3.046 0.366 11 0 "[ . 1 . 2]" 1
630 1 24 LEU QD 1 45 VAL QG 2.560 . 3.320 2.067 1.709 2.492 0.091 11 0 "[ . 1 . 2]" 1
631 1 24 LEU QD 1 46 ALA H 3.280 . 4.760 3.962 3.310 4.592 . 0 0 "[ . 1 . 2]" 1
632 1 24 LEU QD 1 46 ALA MB 2.930 . 4.070 2.473 1.813 3.217 . 0 0 "[ . 1 . 2]" 1
633 1 24 LEU QD 1 79 LEU MD1 2.780 . 3.760 2.491 1.788 3.344 0.012 9 0 "[ . 1 . 2]" 1
634 1 24 LEU QD 1 79 LEU MD2 3.440 . 5.080 3.279 2.564 4.428 . 0 0 "[ . 1 . 2]" 1
635 1 25 ARG H 1 45 VAL QG 3.660 . 5.520 4.759 3.971 5.431 . 0 0 "[ . 1 . 2]" 1
636 1 26 ALA H 1 45 VAL QG 3.690 . 5.580 4.956 4.419 5.583 0.003 8 0 "[ . 1 . 2]" 1
637 1 26 ALA MB 1 45 VAL QG 3.670 . 5.540 2.471 1.916 3.216 . 0 0 "[ . 1 . 2]" 1
638 1 28 LEU QD 1 30 LEU MD2 3.330 . 4.860 3.668 3.231 4.182 . 0 0 "[ . 1 . 2]" 1
639 1 28 LEU QD 1 43 VAL QG 3.150 . 4.510 3.881 3.125 4.401 . 0 0 "[ . 1 . 2]" 1
640 1 28 LEU QD 1 58 VAL MG2 3.770 . 5.740 4.471 4.198 4.713 . 0 0 "[ . 1 . 2]" 1
641 1 28 LEU QD 1 64 ILE MD 2.700 . 3.600 3.123 2.700 3.402 . 0 0 "[ . 1 . 2]" 1
642 1 28 LEU QD 1 81 LEU MD2 3.010 . 4.220 2.132 1.861 2.625 . 0 0 "[ . 1 . 2]" 1
643 1 28 LEU QD 1 82 VAL H 3.100 . 4.400 3.254 2.842 3.680 . 0 0 "[ . 1 . 2]" 1
644 1 28 LEU QD 1 83 VAL H 2.850 . 3.900 3.521 3.231 3.961 0.061 17 0 "[ . 1 . 2]" 1
645 1 28 LEU QD 1 83 VAL QG 2.690 . 3.580 1.867 1.742 1.946 0.058 20 0 "[ . 1 . 2]" 1
646 1 28 LEU QD 1 84 ARG H 3.110 . 4.420 3.908 3.716 4.076 . 0 0 "[ . 1 . 2]" 1
647 1 30 LEU MD1 1 83 VAL QG 3.460 . 5.120 3.026 2.633 3.306 . 0 0 "[ . 1 . 2]" 1
648 1 30 LEU MD2 1 82 VAL QG 4.540 . 7.280 6.371 6.150 6.515 . 0 0 "[ . 1 . 2]" 1
649 1 31 THR MG 1 90 VAL QG 3.750 . 5.700 5.555 5.226 5.820 0.120 8 0 "[ . 1 . 2]" 1
650 1 32 LEU MD1 1 90 VAL QG 3.300 . 4.800 1.936 1.784 2.124 0.016 15 0 "[ . 1 . 2]" 1
651 1 32 LEU MD2 1 90 VAL QG 3.530 . 5.260 3.847 3.589 4.105 . 0 0 "[ . 1 . 2]" 1
652 1 35 ALA MB 1 83 VAL QG 3.570 . 5.340 3.632 3.221 3.979 . 0 0 "[ . 1 . 2]" 1
653 1 42 VAL H 1 42 VAL QG 2.240 . 2.680 1.998 1.877 2.191 . 0 0 "[ . 1 . 2]" 1
654 1 43 VAL H 1 43 VAL QG 2.510 . 3.220 2.323 1.969 2.939 . 0 0 "[ . 1 . 2]" 1
655 1 43 VAL QG 1 45 VAL H 2.860 . 3.920 3.250 2.671 3.928 0.008 14 0 "[ . 1 . 2]" 1
656 1 43 VAL QG 1 45 VAL QG 2.760 . 3.720 1.932 1.750 2.810 0.050 2 0 "[ . 1 . 2]" 1
657 1 43 VAL QG 1 52 VAL H 2.400 . 3.000 2.917 2.540 3.121 0.121 20 0 "[ . 1 . 2]" 1
658 1 43 VAL QG 1 52 VAL QG 2.300 . 2.800 2.207 1.795 2.542 0.005 8 0 "[ . 1 . 2]" 1
659 1 43 VAL QG 1 54 ILE MD 3.870 . 5.940 5.494 4.718 6.040 0.100 7 0 "[ . 1 . 2]" 1
660 1 43 VAL QG 1 64 ILE MD 4.110 . 6.420 6.147 5.562 6.532 0.112 16 0 "[ . 1 . 2]" 1
661 1 43 VAL QG 1 69 MET ME 2.530 . 3.260 2.416 1.928 3.012 . 0 0 "[ . 1 . 2]" 1
662 1 43 VAL QG 1 79 LEU MD1 3.690 . 5.580 3.662 3.142 4.389 . 0 0 "[ . 1 . 2]" 1
663 1 43 VAL QG 1 81 LEU MD1 2.810 . 3.820 2.743 1.897 3.531 . 0 0 "[ . 1 . 2]" 1
664 1 43 VAL QG 1 81 LEU MD2 2.910 . 4.020 2.736 2.011 3.479 . 0 0 "[ . 1 . 2]" 1
665 1 45 VAL H 1 45 VAL QG 2.440 . 3.080 2.368 2.024 3.073 . 0 0 "[ . 1 . 2]" 1
666 1 45 VAL QG 1 46 ALA MB 2.950 . 4.100 3.155 2.368 3.707 . 0 0 "[ . 1 . 2]" 1
667 1 45 VAL QG 1 47 GLY H 3.470 . 5.140 4.412 4.160 4.512 . 0 0 "[ . 1 . 2]" 1
668 1 45 VAL QG 1 66 VAL QG 3.860 . 5.920 4.550 4.120 5.735 . 0 0 "[ . 1 . 2]" 1
669 1 45 VAL QG 1 69 MET ME 3.500 . 5.200 3.899 2.072 4.950 . 0 0 "[ . 1 . 2]" 1
670 1 45 VAL QG 1 79 LEU MD1 2.730 . 3.660 2.293 1.843 3.075 . 0 0 "[ . 1 . 2]" 1
671 1 45 VAL QG 1 81 LEU MD1 3.500 . 5.200 4.442 4.039 5.071 . 0 0 "[ . 1 . 2]" 1
672 1 45 VAL QG 1 81 LEU MD2 3.420 . 5.040 3.282 2.779 3.829 . 0 0 "[ . 1 . 2]" 1
673 1 50 VAL H 1 50 VAL QG 2.460 . 3.120 2.518 2.196 2.876 . 0 0 "[ . 1 . 2]" 1
674 1 52 VAL H 1 52 VAL QG 2.220 . 2.640 2.111 2.001 2.510 . 0 0 "[ . 1 . 2]" 1
675 1 52 VAL QG 1 54 ILE H 2.760 . 3.720 3.178 2.530 3.628 . 0 0 "[ . 1 . 2]" 1
676 1 52 VAL QG 1 54 ILE MD 2.750 . 3.700 3.638 3.369 3.836 0.136 17 0 "[ . 1 . 2]" 1
677 1 52 VAL QG 1 69 MET ME 3.200 . 4.600 2.433 1.766 3.729 0.034 8 0 "[ . 1 . 2]" 1
678 1 52 VAL QG 1 81 LEU MD1 3.090 . 4.380 1.964 1.772 2.361 0.028 8 0 "[ . 1 . 2]" 1
679 1 54 ILE MD 1 66 VAL QG 3.580 . 5.360 4.827 4.336 5.386 0.026 20 0 "[ . 1 . 2]" 1
680 1 54 ILE MD 1 83 VAL QG 3.110 . 4.420 2.576 2.271 3.022 . 0 0 "[ . 1 . 2]" 1
681 1 58 VAL MG1 1 83 VAL QG 2.300 . 2.800 2.897 2.692 3.003 0.203 16 0 "[ . 1 . 2]" 1
682 1 59 ARG H 1 83 VAL QG 2.450 . 3.100 3.082 2.954 3.183 0.083 5 0 "[ . 1 . 2]" 1
683 1 60 GLU H 1 83 VAL QG 3.090 . 4.380 4.228 3.859 4.429 0.049 5 0 "[ . 1 . 2]" 1
684 1 61 GLY H 1 82 VAL QG 2.810 . 3.820 3.677 3.393 3.942 0.122 7 0 "[ . 1 . 2]" 1
685 1 61 GLY H 1 83 VAL QG 2.950 . 4.100 3.214 2.621 3.493 . 0 0 "[ . 1 . 2]" 1
686 1 62 SER H 1 82 VAL QG 3.000 . 4.200 3.947 3.631 4.294 0.094 16 0 "[ . 1 . 2]" 1
687 1 62 SER H 1 83 VAL QG 2.590 . 3.380 2.906 2.689 3.158 . 0 0 "[ . 1 . 2]" 1
688 1 63 VAL H 1 63 VAL QG 2.380 . 2.970 2.157 1.928 2.312 . 0 0 "[ . 1 . 2]" 1
689 1 63 VAL QG 1 64 ILE H 2.220 . 2.640 2.784 2.590 2.864 0.224 8 0 "[ . 1 . 2]" 1
690 1 63 VAL QG 1 80 LEU MD1 2.550 . 3.300 2.379 2.069 2.652 . 0 0 "[ . 1 . 2]" 1
691 1 63 VAL QG 1 80 LEU MD2 2.500 . 3.200 1.840 1.796 1.975 0.004 11 0 "[ . 1 . 2]" 1
692 1 63 VAL QG 1 82 VAL QG 2.710 . 3.620 1.876 1.644 2.258 0.156 14 0 "[ . 1 . 2]" 1
693 1 64 ILE MD 1 66 VAL QG 3.390 . 4.980 4.168 3.716 4.679 . 0 0 "[ . 1 . 2]" 1
694 1 64 ILE MD 1 83 VAL QG 2.610 . 3.420 1.974 1.877 2.153 . 0 0 "[ . 1 . 2]" 1
695 1 66 VAL H 1 66 VAL QG 2.240 . 2.680 2.197 2.053 2.549 . 0 0 "[ . 1 . 2]" 1
696 1 66 VAL QG 1 68 GLY H 3.580 . 5.360 5.228 4.946 5.484 0.124 5 0 "[ . 1 . 2]" 1
697 1 66 VAL QG 1 69 MET ME 2.680 . 3.560 2.261 1.910 2.527 . 0 0 "[ . 1 . 2]" 1
698 1 66 VAL QG 1 70 GLY H 3.170 . 4.540 4.547 4.072 4.841 0.301 10 0 "[ . 1 . 2]" 1
699 1 66 VAL QG 1 79 LEU H 2.410 . 3.020 2.451 2.220 3.483 0.463 4 0 "[ . 1 . 2]" 1
700 1 66 VAL QG 1 79 LEU MD1 3.200 . 4.600 3.915 3.793 4.023 . 0 0 "[ . 1 . 2]" 1
701 1 66 VAL QG 1 80 LEU MD2 3.410 . 5.020 4.356 4.159 4.546 . 0 0 "[ . 1 . 2]" 1
702 1 66 VAL QG 1 81 LEU MD1 2.980 . 4.160 2.792 2.219 3.203 . 0 0 "[ . 1 . 2]" 1
703 1 66 VAL QG 1 81 LEU MD2 3.060 . 4.320 3.976 3.400 4.352 0.032 3 0 "[ . 1 . 2]" 1
704 1 81 LEU MD1 1 83 VAL QG 3.730 . 5.660 4.041 3.702 4.578 . 0 0 "[ . 1 . 2]" 1
705 1 82 VAL QG 1 83 VAL H 2.650 . 3.500 3.194 3.003 3.327 . 0 0 "[ . 1 . 2]" 1
706 1 82 VAL QG 1 85 LEU MD2 4.330 . 6.860 6.314 5.965 6.498 . 0 0 "[ . 1 . 2]" 1
707 1 83 VAL H 1 83 VAL QG 2.130 . 2.460 2.029 1.943 2.090 . 0 0 "[ . 1 . 2]" 1
708 1 83 VAL QG 1 85 LEU MD1 3.300 . 4.800 3.724 3.493 4.065 . 0 0 "[ . 1 . 2]" 1
709 1 83 VAL QG 1 85 LEU MD2 2.750 . 3.700 2.434 2.163 2.814 . 0 0 "[ . 1 . 2]" 1
710 1 90 VAL H 1 90 VAL QG 2.280 . 2.760 2.275 2.074 2.577 . 0 0 "[ . 1 . 2]" 1
711 1 90 VAL QG 1 100 ALA MB 2.820 . 3.850 2.774 2.403 3.468 . 0 0 "[ . 1 . 2]" 1
712 1 90 VAL QG 1 101 THR H 2.910 . 4.020 3.244 2.756 3.655 . 0 0 "[ . 1 . 2]" 1
713 1 90 VAL QG 1 101 THR MG 4.060 . 6.320 5.085 4.660 5.426 . 0 0 "[ . 1 . 2]" 1
714 1 90 VAL QG 1 118 MET ME 3.590 . 5.380 4.891 4.172 5.299 . 0 0 "[ . 1 . 2]" 1
715 1 90 VAL QG 1 120 LEU MD2 3.380 . 4.950 2.736 2.401 3.052 . 0 0 "[ . 1 . 2]" 1
716 1 90 VAL QG 1 154 LEU MD1 4.010 . 6.220 4.846 4.672 5.308 . 0 0 "[ . 1 . 2]" 1
717 1 90 VAL QG 1 154 LEU MD2 4.020 . 6.240 5.320 5.120 5.712 . 0 0 "[ . 1 . 2]" 1
718 1 90 VAL QG 1 156 LEU MD2 4.440 . 7.080 4.936 4.672 5.232 . 0 0 "[ . 1 . 2]" 1
719 1 98 LEU MD1 1 124 VAL QG 4.390 . 6.980 4.932 4.418 5.348 . 0 0 "[ . 1 . 2]" 1
720 1 100 ALA MB 1 126 VAL QG 4.180 . 6.560 5.621 5.202 6.071 . 0 0 "[ . 1 . 2]" 1
721 1 102 LEU MD1 1 115 VAL QG 2.590 . 3.380 2.152 1.944 2.509 . 0 0 "[ . 1 . 2]" 1
722 1 102 LEU MD1 1 124 VAL QG 3.520 . 5.240 4.433 4.106 4.796 . 0 0 "[ . 1 . 2]" 1
723 1 102 LEU MD1 1 126 VAL QG 2.640 . 3.480 2.435 2.080 3.032 . 0 0 "[ . 1 . 2]" 1
724 1 102 LEU MD1 1 128 VAL QG 3.280 . 4.760 4.043 3.489 4.593 . 0 0 "[ . 1 . 2]" 1
725 1 102 LEU MD2 1 104 VAL QG 2.840 . 3.880 2.557 2.277 3.384 . 0 0 "[ . 1 . 2]" 1
726 1 102 LEU MD2 1 115 VAL QG 2.670 . 3.540 2.448 1.898 3.496 . 0 0 "[ . 1 . 2]" 1
727 1 102 LEU MD2 1 126 VAL QG 2.520 . 3.240 1.967 1.865 2.114 . 0 0 "[ . 1 . 2]" 1
728 1 102 LEU MD2 1 128 VAL QG 2.900 . 4.000 2.540 2.135 2.876 . 0 0 "[ . 1 . 2]" 1
729 1 104 VAL H 1 104 VAL QG 2.490 . 3.190 2.269 1.991 2.858 . 0 0 "[ . 1 . 2]" 1
730 1 104 VAL QG 1 108 ILE MD 3.080 . 4.360 3.836 2.941 4.461 0.101 4 0 "[ . 1 . 2]" 1
731 1 104 VAL QG 1 109 ALA H 2.490 . 3.190 3.106 2.774 3.325 0.135 8 0 "[ . 1 . 2]" 1
732 1 104 VAL QG 1 109 ALA MB 3.000 . 4.200 2.136 1.903 2.577 . 0 0 "[ . 1 . 2]" 1
733 1 104 VAL QG 1 115 VAL QG 2.570 . 3.340 1.853 1.716 2.080 0.084 11 0 "[ . 1 . 2]" 1
734 1 104 VAL QG 1 128 VAL QG 2.780 . 3.760 1.873 1.717 2.353 0.083 11 0 "[ . 1 . 2]" 1
735 1 104 VAL QG 1 158 VAL QG 2.720 . 3.640 2.071 1.764 2.334 0.036 19 0 "[ . 1 . 2]" 1
736 1 104 VAL QG 1 159 ARG H 2.810 . 3.820 2.922 2.388 3.208 . 0 0 "[ . 1 . 2]" 1
737 1 104 VAL QG 1 160 ILE MD 2.850 . 3.900 3.512 3.220 3.992 0.092 16 0 "[ . 1 . 2]" 1
738 1 108 ILE MD 1 115 VAL QG 2.610 . 3.420 2.424 2.076 3.249 . 0 0 "[ . 1 . 2]" 1
739 1 108 ILE MD 1 128 VAL QG 3.310 . 4.820 3.997 3.807 4.619 . 0 0 "[ . 1 . 2]" 1
740 1 109 ALA MB 1 115 VAL QG 3.830 . 5.860 5.084 4.778 5.577 . 0 0 "[ . 1 . 2]" 1
741 1 109 ALA MB 1 128 VAL QG 3.390 . 4.980 3.528 3.277 3.764 . 0 0 "[ . 1 . 2]" 1
742 1 109 ALA MB 1 158 VAL QG 3.370 . 4.940 3.595 3.314 3.930 . 0 0 "[ . 1 . 2]" 1
743 1 113 GLY H 1 128 VAL QG 2.960 . 4.120 2.636 2.253 3.402 . 0 0 "[ . 1 . 2]" 1
744 1 115 VAL H 1 115 VAL QG 2.220 . 2.640 2.356 2.034 2.745 0.105 1 0 "[ . 1 . 2]" 1
745 1 115 VAL QG 1 116 ARG H 2.770 . 3.740 2.843 2.144 3.529 . 0 0 "[ . 1 . 2]" 1
746 1 115 VAL QG 1 117 ALA MB 3.400 . 5.000 3.628 3.061 4.059 . 0 0 "[ . 1 . 2]" 1
747 1 115 VAL QG 1 126 VAL QG 2.650 . 3.500 2.515 1.743 3.312 0.057 8 0 "[ . 1 . 2]" 1
748 1 115 VAL QG 1 127 ALA MB 3.840 . 5.880 5.275 4.806 5.942 0.062 15 0 "[ . 1 . 2]" 1
749 1 115 VAL QG 1 128 VAL H 2.920 . 4.040 3.696 3.090 4.171 0.131 3 0 "[ . 1 . 2]" 1
750 1 115 VAL QG 1 128 VAL QG 2.760 . 3.720 2.143 1.858 2.675 . 0 0 "[ . 1 . 2]" 1
751 1 115 VAL QG 1 156 LEU MD2 3.690 . 5.580 5.086 4.766 5.561 . 0 0 "[ . 1 . 2]" 1
752 1 117 ALA H 1 124 VAL QG 2.460 . 3.120 2.706 2.418 3.120 . 0 0 "[ . 1 . 2]" 1
753 1 117 ALA H 1 126 VAL QG 2.530 . 3.260 2.991 2.644 3.296 0.036 10 0 "[ . 1 . 2]" 1
754 1 117 ALA MB 1 124 VAL QG 2.990 . 4.180 1.998 1.875 2.315 . 0 0 "[ . 1 . 2]" 1
755 1 117 ALA MB 1 126 VAL QG 2.760 . 3.720 2.254 1.981 2.786 . 0 0 "[ . 1 . 2]" 1
756 1 118 MET ME 1 124 VAL QG 3.470 . 5.140 4.677 4.311 5.127 . 0 0 "[ . 1 . 2]" 1
757 1 119 THR H 1 124 VAL QG 3.570 . 5.340 3.528 3.120 4.011 . 0 0 "[ . 1 . 2]" 1
758 1 119 THR MG 1 124 VAL QG 2.200 . 2.600 1.840 1.749 1.988 0.051 1 0 "[ . 1 . 2]" 1
759 1 122 GLY H 1 124 VAL QG 3.440 . 5.080 4.477 4.119 4.829 . 0 0 "[ . 1 . 2]" 1
760 1 124 VAL QG 1 126 VAL H 2.810 . 3.820 3.887 3.706 3.970 0.150 14 0 "[ . 1 . 2]" 1
761 1 124 VAL QG 1 126 VAL QG 2.720 . 3.640 2.971 2.357 3.648 0.008 15 0 "[ . 1 . 2]" 1
762 1 124 VAL QG 1 140 LEU MD1 2.590 . 3.380 2.100 1.978 2.274 . 0 0 "[ . 1 . 2]" 1
763 1 124 VAL QG 1 140 LEU MD2 3.040 . 4.280 3.991 3.796 4.187 . 0 0 "[ . 1 . 2]" 1
764 1 124 VAL QG 1 154 LEU MD2 2.970 . 4.140 2.549 2.162 2.774 . 0 0 "[ . 1 . 2]" 1
765 1 124 VAL QG 1 156 LEU MD1 3.170 . 4.540 3.405 3.175 3.636 . 0 0 "[ . 1 . 2]" 1
766 1 124 VAL QG 1 156 LEU MD2 3.250 . 4.700 3.697 3.355 4.017 . 0 0 "[ . 1 . 2]" 1
767 1 126 VAL H 1 126 VAL QG 2.220 . 2.640 2.039 1.861 2.295 . 0 0 "[ . 1 . 2]" 1
768 1 126 VAL QG 1 127 ALA H 2.350 . 2.900 2.793 2.438 3.012 0.112 2 0 "[ . 1 . 2]" 1
769 1 126 VAL QG 1 127 ALA MB 3.210 . 4.620 3.897 3.628 4.137 . 0 0 "[ . 1 . 2]" 1
770 1 126 VAL QG 1 138 LEU QD 2.530 . 3.260 2.058 1.908 2.208 . 0 0 "[ . 1 . 2]" 1
771 1 126 VAL QG 1 140 LEU MD1 2.530 . 3.260 2.430 1.791 3.068 0.009 6 0 "[ . 1 . 2]" 1
772 1 126 VAL QG 1 140 LEU MD2 2.510 . 3.220 1.941 1.799 2.052 0.001 10 0 "[ . 1 . 2]" 1
773 1 126 VAL QG 1 156 LEU MD1 2.370 . 2.940 1.802 1.751 1.933 0.049 14 0 "[ . 1 . 2]" 1
774 1 126 VAL QG 1 156 LEU MD2 2.780 . 3.760 3.310 2.957 3.588 . 0 0 "[ . 1 . 2]" 1
775 1 127 ALA H 1 138 LEU QD 3.360 . 4.920 4.657 4.240 5.068 0.148 13 0 "[ . 1 . 2]" 1
776 1 127 ALA MB 1 128 VAL QG 3.420 . 5.040 4.165 3.981 4.431 . 0 0 "[ . 1 . 2]" 1
777 1 127 ALA MB 1 138 LEU QD 4.010 . 6.220 4.746 4.289 5.376 . 0 0 "[ . 1 . 2]" 1
778 1 128 VAL H 1 128 VAL QG 2.260 . 2.720 2.028 1.940 2.116 . 0 0 "[ . 1 . 2]" 1
779 1 128 VAL H 1 138 LEU QD 3.180 . 4.560 4.082 3.862 4.359 . 0 0 "[ . 1 . 2]" 1
780 1 128 VAL QG 1 132 THR H 3.190 . 4.580 4.193 3.590 4.484 . 0 0 "[ . 1 . 2]" 1
781 1 128 VAL QG 1 132 THR MG 2.850 . 3.900 2.728 2.170 3.070 . 0 0 "[ . 1 . 2]" 1
782 1 128 VAL QG 1 138 LEU QD 2.650 . 3.500 1.995 1.767 2.207 0.033 13 0 "[ . 1 . 2]" 1
783 1 128 VAL QG 1 160 ILE MD 3.580 . 5.360 4.744 4.454 4.982 . 0 0 "[ . 1 . 2]" 1
784 1 133 GLN H 1 158 VAL QG 2.730 . 3.660 3.479 3.124 3.765 0.105 3 0 "[ . 1 . 2]" 1
785 1 134 ALA H 1 158 VAL QG 3.170 . 4.540 3.949 3.733 4.217 . 0 0 "[ . 1 . 2]" 1
786 1 134 ALA MB 1 158 VAL QG 3.140 . 4.480 3.303 3.049 3.580 . 0 0 "[ . 1 . 2]" 1
787 1 135 GLY H 1 158 VAL QG 2.840 . 3.880 2.974 1.966 3.524 . 0 0 "[ . 1 . 2]" 1
788 1 136 ARG H 1 158 VAL QG 2.530 . 3.260 2.790 1.944 3.367 0.107 15 0 "[ . 1 . 2]" 1
789 1 137 LYS H 1 138 LEU QD 2.980 . 4.160 3.960 3.606 4.199 0.039 13 0 "[ . 1 . 2]" 1
790 1 137 LYS H 1 158 VAL QG 3.010 . 4.220 4.067 3.794 4.273 0.053 4 0 "[ . 1 . 2]" 1
791 1 138 LEU H 1 138 LEU QD 2.490 . 3.180 3.134 2.953 3.296 0.116 20 0 "[ . 1 . 2]" 1
792 1 138 LEU H 1 158 VAL QG 2.900 . 4.000 3.543 3.014 4.042 0.042 6 0 "[ . 1 . 2]" 1
793 1 138 LEU QD 1 140 LEU MD2 3.470 . 5.140 3.993 3.654 4.176 . 0 0 "[ . 1 . 2]" 1
794 1 138 LEU QD 1 156 LEU MD1 3.320 . 4.840 3.016 2.656 3.297 . 0 0 "[ . 1 . 2]" 1
795 1 138 LEU QD 1 158 VAL QG 2.780 . 3.760 2.244 2.018 2.814 . 0 0 "[ . 1 . 2]" 1
796 1 138 LEU QD 1 160 ILE MD 4.100 . 6.400 5.399 4.764 5.824 . 0 0 "[ . 1 . 2]" 1
797 1 158 VAL H 1 158 VAL QG 2.220 . 2.640 1.938 1.871 2.123 . 0 0 "[ . 1 . 2]" 1
798 1 158 VAL QG 1 159 ARG H 2.360 . 2.920 2.806 2.515 2.978 0.058 19 0 "[ . 1 . 2]" 1
799 1 158 VAL QG 1 160 ILE H 2.700 . 3.600 3.173 2.894 3.460 . 0 0 "[ . 1 . 2]" 1
800 1 158 VAL QG 1 160 ILE MD 2.550 . 3.300 2.738 2.574 3.013 . 0 0 "[ . 1 . 2]" 1
801 1 26 ALA MB 1 45 VAL MG2 3.690 . 5.580 3.766 1.932 4.882 . 0 0 "[ . 1 . 2]" 1
802 1 35 ALA MB 1 83 VAL MG1 3.620 . 5.440 4.950 4.455 5.286 . 0 0 "[ . 1 . 2]" 1
803 1 24 LEU MD2 1 79 LEU MD2 3.310 . 4.820 4.055 2.577 4.988 0.168 7 0 "[ . 1 . 2]" 1
804 1 26 ALA MB 1 45 VAL MG1 3.690 . 5.580 2.759 2.005 4.522 . 0 0 "[ . 1 . 2]" 1
805 1 124 VAL MG1 1 154 LEU MD1 3.760 . 5.720 5.633 5.089 5.915 0.195 2 0 "[ . 1 . 2]" 1
806 1 134 ALA MB 1 158 VAL MG1 3.820 . 5.840 3.532 3.107 3.957 . 0 0 "[ . 1 . 2]" 1
807 1 124 VAL MG1 1 140 LEU MD2 3.480 . 5.160 5.117 4.833 5.331 0.171 8 0 "[ . 1 . 2]" 1
808 1 108 ILE MD 1 128 VAL MG2 4.010 . 6.220 4.307 4.026 5.060 . 0 0 "[ . 1 . 2]" 1
809 1 124 VAL MG2 1 154 LEU MD1 3.760 . 5.720 4.863 4.373 5.149 . 0 0 "[ . 1 . 2]" 1
810 1 124 VAL MG2 1 140 LEU MD2 3.480 . 5.160 4.170 3.953 4.443 . 0 0 "[ . 1 . 2]" 1
811 1 35 ALA MB 1 83 VAL MG2 3.620 . 5.440 3.740 3.288 4.140 . 0 0 "[ . 1 . 2]" 1
812 1 90 VAL MG1 1 120 LEU MD1 4.020 . 6.240 4.063 3.704 4.343 . 0 0 "[ . 1 . 2]" 1
813 1 90 VAL MG2 1 120 LEU MD1 4.020 . 6.240 5.450 5.117 5.715 . 0 0 "[ . 1 . 2]" 1
814 1 24 LEU MD1 1 79 LEU MD2 3.310 . 4.820 4.042 2.705 5.079 0.259 8 0 "[ . 1 . 2]" 1
815 1 108 ILE MD 1 128 VAL MG1 4.010 . 6.220 4.758 4.438 5.334 . 0 0 "[ . 1 . 2]" 1
816 1 108 ILE MD 1 111 VAL MG2 3.510 . 5.220 4.728 4.337 5.608 0.388 13 0 "[ . 1 . 2]" 1
817 1 100 ALA MB 1 117 ALA MB 3.400 . 5.000 4.189 3.842 4.729 . 0 0 "[ . 1 . 2]" 1
818 1 134 ALA MB 1 158 VAL MG2 3.820 . 5.840 4.688 3.231 5.594 . 0 0 "[ . 1 . 2]" 1
819 1 91 PHE H 1 120 LEU MD1 3.320 . 4.840 4.212 4.038 4.376 . 0 0 "[ . 1 . 2]" 1
820 1 90 VAL MG2 1 101 THR H 3.730 . 5.660 3.265 2.765 3.696 . 0 0 "[ . 1 . 2]" 1
821 1 35 ALA H 1 58 VAL MG2 3.520 . 5.240 5.643 5.588 5.869 0.629 8 1 "[ . + 1 . 2]" 1
822 1 66 VAL H 1 69 MET ME 3.730 . 5.660 5.573 5.142 5.879 0.219 5 0 "[ . 1 . 2]" 1
823 1 24 LEU MD1 1 46 ALA H 3.990 . 6.180 4.472 3.676 5.239 . 0 0 "[ . 1 . 2]" 1
824 1 24 LEU MD2 1 46 ALA H 3.990 . 6.180 4.499 3.757 5.865 . 0 0 "[ . 1 . 2]" 1
825 1 127 ALA H 1 140 LEU MD1 3.470 . 5.140 5.159 4.855 5.287 0.147 6 0 "[ . 1 . 2]" 1
826 1 98 LEU H 1 98 LEU MD1 2.820 . 3.840 3.896 3.806 3.969 0.129 14 0 "[ . 1 . 2]" 1
827 1 98 LEU H 1 98 LEU MD2 2.820 . 3.840 3.671 3.552 3.812 . 0 0 "[ . 1 . 2]" 1
828 1 102 LEU MD2 1 117 ALA H 3.830 . 5.860 5.513 4.952 5.957 0.097 10 0 "[ . 1 . 2]" 1
829 1 86 LEU H 1 86 LEU MD1 3.480 . 5.160 3.787 3.645 3.918 . 0 0 "[ . 1 . 2]" 1
830 1 90 VAL H 1 120 LEU MD1 3.570 . 5.340 5.500 5.266 5.606 0.266 3 0 "[ . 1 . 2]" 1
831 1 98 LEU MD1 1 153 ASP H 3.640 . 5.480 5.067 4.774 5.312 . 0 0 "[ . 1 . 2]" 1
832 1 98 LEU MD2 1 153 ASP H 3.640 . 5.480 5.563 5.481 5.665 0.185 1 0 "[ . 1 . 2]" 1
833 1 133 GLN H 1 158 VAL MG2 3.180 . 4.560 4.323 4.022 4.694 0.134 3 0 "[ . 1 . 2]" 1
834 1 54 ILE MD 1 64 ILE H 3.830 . 5.860 6.098 6.039 6.165 0.305 8 0 "[ . 1 . 2]" 1
835 1 160 ILE H 1 160 ILE MD 2.630 . 3.460 3.616 3.570 3.670 0.210 2 0 "[ . 1 . 2]" 1
836 1 36 PHE H 1 120 LEU MD2 3.110 . 4.420 4.544 4.429 4.654 0.234 5 0 "[ . 1 . 2]" 1
837 1 90 VAL MG1 1 101 THR H 3.730 . 5.660 5.659 5.307 5.819 0.159 10 0 "[ . 1 . 2]" 1
838 1 108 ILE MD 1 115 VAL H 3.450 . 5.100 4.540 4.180 4.863 . 0 0 "[ . 1 . 2]" 1
839 1 57 GLY H 1 58 VAL MG2 4.030 . 6.270 5.229 5.037 5.545 . 0 0 "[ . 1 . 2]" 1
840 1 54 ILE MD 1 83 VAL H 4.040 . 6.280 5.601 5.319 5.991 . 0 0 "[ . 1 . 2]" 1
841 1 156 LEU H 1 156 LEU MD2 2.570 . 3.340 3.605 3.530 3.667 0.327 18 0 "[ . 1 . 2]" 1
842 1 24 LEU H 1 70 GLY H 3.560 . 5.320 4.831 3.889 5.425 0.105 9 0 "[ . 1 . 2]" 1
843 1 30 LEU H 1 84 ARG H 4.140 . 6.480 2.551 2.320 3.237 . 0 0 "[ . 1 . 2]" 1
844 1 145 PHE H 1 153 ASP H 3.310 . 4.820 4.664 3.836 4.959 0.139 12 0 "[ . 1 . 2]" 1
845 1 102 LEU H 1 103 ASP H 3.310 . 4.820 4.224 4.123 4.304 . 0 0 "[ . 1 . 2]" 1
846 1 137 LYS H 1 158 VAL H 3.720 . 5.640 5.053 4.813 5.306 . 0 0 "[ . 1 . 2]" 1
847 1 136 ARG H 1 158 VAL H 3.240 . 4.680 3.985 3.718 4.417 . 0 0 "[ . 1 . 2]" 1
848 1 133 GLN H 1 158 VAL MG1 3.180 . 4.560 3.673 3.256 3.964 . 0 0 "[ . 1 . 2]" 1
849 1 143 LYS H 1 153 ASP H 3.690 . 5.580 5.029 4.634 5.468 . 0 0 "[ . 1 . 2]" 1
850 1 118 MET ME 1 124 VAL H 3.380 . 4.960 4.785 4.148 5.402 0.442 16 0 "[ . 1 . 2]" 1
851 1 32 LEU MD2 1 33 GLU H 3.020 . 4.240 4.484 4.422 4.546 0.306 17 0 "[ . 1 . 2]" 1
852 1 33 GLU H 1 37 HIS H 4.210 . 6.620 6.165 6.098 6.246 . 0 0 "[ . 1 . 2]" 1
853 1 145 PHE H 1 152 GLY H 3.300 . 4.800 3.429 2.973 4.023 . 0 0 "[ . 1 . 2]" 1
854 1 111 VAL MG2 1 113 GLY H 3.880 . 5.960 3.168 2.391 5.299 . 0 0 "[ . 1 . 2]" 1
855 1 1 ALA MB 1 3 LEU QD 3.860 . 5.920 5.085 3.419 6.000 0.080 13 0 "[ . 1 . 2]" 1
856 1 3 LEU H 1 3 LEU QD 2.850 . 3.900 3.226 1.811 4.026 0.126 6 0 "[ . 1 . 2]" 1
857 1 3 LEU QD 1 30 LEU QD 3.040 . 4.280 2.280 1.689 3.568 0.111 9 0 "[ . 1 . 2]" 1
858 1 3 LEU QD 1 58 VAL MG2 4.390 . 6.980 5.567 4.952 5.909 . 0 0 "[ . 1 . 2]" 1
859 1 3 LEU QD 1 81 LEU QD 3.580 . 5.360 3.075 1.748 4.634 0.052 20 0 "[ . 1 . 2]" 1
860 1 4 VAL QG 1 81 LEU QD 4.060 . 6.320 2.475 1.723 4.781 0.077 8 0 "[ . 1 . 2]" 1
861 1 5 ALA H 1 28 LEU QD 3.190 . 4.580 4.140 3.475 4.859 0.279 13 0 "[ . 1 . 2]" 1
862 1 5 ALA H 1 81 LEU QD 3.590 . 5.380 4.849 4.060 5.502 0.122 19 0 "[ . 1 . 2]" 1
863 1 6 HIS H 1 81 LEU QD 3.610 . 5.420 5.395 4.637 5.644 0.224 14 0 "[ . 1 . 2]" 1
864 1 7 VAL QG 1 8 THR H 3.690 . 5.580 2.641 1.878 3.257 . 0 0 "[ . 1 . 2]" 1
865 1 7 VAL QG 1 79 LEU QD 3.680 . 5.560 3.264 2.273 3.930 . 0 0 "[ . 1 . 2]" 1
866 1 8 THR MG 1 81 LEU QD 3.900 . 6.000 5.237 4.854 5.972 . 0 0 "[ . 1 . 2]" 1
867 1 8 THR MG 1 82 VAL QG 3.830 . 5.860 3.802 2.548 5.127 . 0 0 "[ . 1 . 2]" 1
868 1 24 LEU QD 1 43 VAL QG 4.020 . 6.240 4.411 3.572 5.596 . 0 0 "[ . 1 . 2]" 1
869 1 24 LEU QD 1 66 VAL QG 4.320 . 6.840 4.996 4.522 5.396 . 0 0 "[ . 1 . 2]" 1
870 1 24 LEU QD 1 69 MET ME 3.900 . 6.000 5.073 4.143 6.106 0.106 3 0 "[ . 1 . 2]" 1
871 1 24 LEU QD 1 70 GLY H 3.440 . 5.080 4.132 3.523 4.828 . 0 0 "[ . 1 . 2]" 1
872 1 24 LEU QD 1 79 LEU QD 2.570 . 3.340 2.391 1.761 3.250 0.039 9 0 "[ . 1 . 2]" 1
873 1 25 ARG H 1 79 LEU QD 2.790 . 3.780 3.472 3.147 3.809 0.029 18 0 "[ . 1 . 2]" 1
874 1 26 ALA H 1 79 LEU QD 2.630 . 3.460 2.931 2.350 3.306 . 0 0 "[ . 1 . 2]" 1
875 1 26 ALA H 1 81 LEU QD 3.000 . 4.200 3.226 2.918 3.519 . 0 0 "[ . 1 . 2]" 1
876 1 26 ALA MB 1 79 LEU QD 3.960 . 6.120 2.081 1.927 2.291 . 0 0 "[ . 1 . 2]" 1
877 1 26 ALA MB 1 81 LEU QD 3.090 . 4.380 1.982 1.801 2.176 . 0 0 "[ . 1 . 2]" 1
878 1 26 ALA MB 1 82 VAL QG 4.490 . 7.180 4.952 4.527 5.130 . 0 0 "[ . 1 . 2]" 1
879 1 28 LEU QD 1 30 LEU QD 2.950 . 4.100 2.664 2.034 3.386 . 0 0 "[ . 1 . 2]" 1
880 1 28 LEU QD 1 54 ILE MD 2.510 . 3.220 2.787 2.276 3.086 . 0 0 "[ . 1 . 2]" 1
881 1 28 LEU QD 1 64 ILE H 3.630 . 5.460 4.998 4.650 5.416 . 0 0 "[ . 1 . 2]" 1
882 1 28 LEU QD 1 81 LEU QD 2.960 . 4.120 2.015 1.746 2.561 0.054 12 0 "[ . 1 . 2]" 1
883 1 30 LEU H 1 30 LEU QD 2.730 . 3.660 3.879 3.843 4.041 0.381 11 0 "[ . 1 . 2]" 1
884 1 30 LEU QD 1 31 THR H 3.010 . 4.220 2.690 2.361 3.160 . 0 0 "[ . 1 . 2]" 1
885 1 30 LEU QD 1 31 THR MG 3.400 . 5.000 4.905 4.068 5.081 0.081 20 0 "[ . 1 . 2]" 1
886 1 30 LEU QD 1 32 LEU QD 3.900 . 6.000 5.050 4.718 5.289 . 0 0 "[ . 1 . 2]" 1
887 1 30 LEU QD 1 34 GLU H 3.020 . 4.240 4.181 4.107 4.289 0.049 4 0 "[ . 1 . 2]" 1
888 1 30 LEU QD 1 35 ALA H 2.870 . 3.940 3.116 2.917 3.356 . 0 0 "[ . 1 . 2]" 1
889 1 30 LEU QD 1 35 ALA MB 3.210 . 4.620 2.586 2.238 3.055 . 0 0 "[ . 1 . 2]" 1
890 1 30 LEU QD 1 36 PHE H 3.390 . 4.980 4.721 4.565 4.998 0.018 8 0 "[ . 1 . 2]" 1
891 1 30 LEU QD 1 54 ILE MD 3.060 . 4.320 2.353 2.042 2.703 . 0 0 "[ . 1 . 2]" 1
892 1 30 LEU QD 1 58 VAL MG2 2.840 . 3.880 2.681 2.490 2.947 . 0 0 "[ . 1 . 2]" 1
893 1 30 LEU QD 1 64 ILE MD 3.510 . 5.220 3.388 2.993 3.834 . 0 0 "[ . 1 . 2]" 1
894 1 30 LEU QD 1 82 VAL QG 4.130 . 6.460 5.974 5.774 6.112 . 0 0 "[ . 1 . 2]" 1
895 1 30 LEU QD 1 83 VAL QG 2.640 . 3.480 1.796 1.721 1.912 0.079 2 0 "[ . 1 . 2]" 1
896 1 30 LEU QD 1 84 ARG H 3.080 . 4.360 4.388 4.223 4.478 0.118 3 0 "[ . 1 . 2]" 1
897 1 30 LEU QD 1 85 LEU QD 3.050 . 4.300 2.189 1.880 2.737 . 0 0 "[ . 1 . 2]" 1
898 1 31 THR H 1 85 LEU QD 3.610 . 5.420 3.938 3.572 4.392 . 0 0 "[ . 1 . 2]" 1
899 1 31 THR H 1 86 LEU QD 3.570 . 5.340 4.051 3.588 4.413 . 0 0 "[ . 1 . 2]" 1
900 1 31 THR MG 1 32 LEU QD 3.410 . 5.020 3.828 3.610 4.648 . 0 0 "[ . 1 . 2]" 1
901 1 31 THR MG 1 85 LEU QD 3.720 . 5.640 4.496 4.261 4.804 . 0 0 "[ . 1 . 2]" 1
902 1 31 THR MG 1 86 LEU QD 2.290 . 2.780 1.949 1.791 2.814 0.034 8 0 "[ . 1 . 2]" 1
903 1 31 THR MG 1 120 LEU QD 3.770 . 5.740 4.046 3.884 4.404 . 0 0 "[ . 1 . 2]" 1
904 1 32 LEU H 1 32 LEU QD 2.490 . 3.180 2.835 2.653 3.064 . 0 0 "[ . 1 . 2]" 1
905 1 32 LEU H 1 85 LEU QD 3.150 . 4.510 3.584 3.256 3.819 . 0 0 "[ . 1 . 2]" 1
906 1 32 LEU QD 1 33 GLU H 2.710 . 3.620 3.830 3.752 3.902 0.282 13 0 "[ . 1 . 2]" 1
907 1 32 LEU QD 1 85 LEU QD 2.450 . 3.100 1.953 1.759 2.122 0.041 8 0 "[ . 1 . 2]" 1
908 1 32 LEU QD 1 86 LEU H 2.900 . 4.000 3.375 2.752 3.947 . 0 0 "[ . 1 . 2]" 1
909 1 32 LEU QD 1 86 LEU QD 4.020 . 6.240 3.987 3.233 4.659 . 0 0 "[ . 1 . 2]" 1
910 1 32 LEU QD 1 88 HIS H 2.980 . 4.160 3.637 2.861 4.375 0.215 1 0 "[ . 1 . 2]" 1
911 1 32 LEU QD 1 90 VAL QG 3.130 . 4.460 1.930 1.780 2.116 0.020 15 0 "[ . 1 . 2]" 1
912 1 32 LEU QD 1 91 PHE H 2.950 . 4.100 2.591 1.783 3.015 0.017 8 0 "[ . 1 . 2]" 1
913 1 32 LEU QD 1 120 LEU QD 2.590 . 3.380 2.757 2.591 2.910 . 0 0 "[ . 1 . 2]" 1
914 1 33 GLU H 1 120 LEU QD 2.800 . 3.800 2.704 2.565 2.847 . 0 0 "[ . 1 . 2]" 1
915 1 35 ALA H 1 120 LEU QD 3.410 . 5.020 4.131 3.999 4.317 . 0 0 "[ . 1 . 2]" 1
916 1 35 ALA MB 1 85 LEU QD 2.900 . 4.000 1.946 1.814 2.316 . 0 0 "[ . 1 . 2]" 1
917 1 35 ALA MB 1 120 LEU QD 4.000 . 6.200 3.069 2.797 3.380 . 0 0 "[ . 1 . 2]" 1
918 1 36 PHE H 1 120 LEU QD 2.800 . 3.800 2.927 2.814 3.038 . 0 0 "[ . 1 . 2]" 1
919 1 37 HIS H 1 120 LEU QD 3.120 . 4.440 4.686 4.587 4.800 0.360 14 0 "[ . 1 . 2]" 1
920 1 43 VAL QG 1 79 LEU QD 2.540 . 3.280 2.029 1.733 2.907 0.067 15 0 "[ . 1 . 2]" 1
921 1 43 VAL QG 1 81 LEU QD 2.450 . 3.100 2.401 1.864 3.122 0.022 6 0 "[ . 1 . 2]" 1
922 1 45 VAL H 1 79 LEU QD 3.420 . 5.040 4.696 4.083 5.003 . 0 0 "[ . 1 . 2]" 1
923 1 45 VAL QG 1 46 ALA H 2.830 . 3.860 3.243 2.392 3.690 . 0 0 "[ . 1 . 2]" 1
924 1 45 VAL QG 1 79 LEU QD 2.540 . 3.280 1.863 1.663 2.807 0.137 2 0 "[ . 1 . 2]" 1
925 1 45 VAL QG 1 81 LEU QD 2.970 . 4.140 3.199 2.737 3.722 . 0 0 "[ . 1 . 2]" 1
926 1 46 ALA MB 1 79 LEU QD 4.350 . 6.900 5.031 4.299 5.599 . 0 0 "[ . 1 . 2]" 1
927 1 52 VAL QG 1 53 ARG H 2.540 . 3.280 2.568 2.341 2.873 . 0 0 "[ . 1 . 2]" 1
928 1 52 VAL QG 1 66 VAL QG 2.460 . 3.120 1.823 1.687 1.918 0.113 8 0 "[ . 1 . 2]" 1
929 1 52 VAL QG 1 81 LEU QD 2.650 . 3.500 1.955 1.762 2.348 0.038 8 0 "[ . 1 . 2]" 1
930 1 53 ARG H 1 66 VAL QG 2.790 . 3.780 3.807 3.255 3.972 0.192 12 0 "[ . 1 . 2]" 1
931 1 54 ILE MD 1 79 LEU QD 4.450 . 7.100 6.131 5.649 6.533 . 0 0 "[ . 1 . 2]" 1
932 1 54 ILE MD 1 81 LEU QD 3.090 . 4.380 3.194 2.607 3.748 . 0 0 "[ . 1 . 2]" 1
933 1 54 ILE MD 1 85 LEU QD 4.350 . 6.900 5.218 4.773 5.527 . 0 0 "[ . 1 . 2]" 1
934 1 58 VAL H 1 120 LEU QD 4.260 . 6.710 6.007 5.632 6.351 . 0 0 "[ . 1 . 2]" 1
935 1 58 VAL MG2 1 85 LEU QD 3.020 . 4.240 3.297 2.988 3.599 . 0 0 "[ . 1 . 2]" 1
936 1 59 ARG H 1 85 LEU QD 3.480 . 5.160 3.886 3.647 4.064 . 0 0 "[ . 1 . 2]" 1
937 1 60 GLU H 1 85 LEU QD 2.200 . 2.600 2.163 2.047 2.265 . 0 0 "[ . 1 . 2]" 1
938 1 63 VAL QG 1 64 ILE MD 3.610 . 5.420 4.920 4.790 4.986 . 0 0 "[ . 1 . 2]" 1
939 1 63 VAL QG 1 80 LEU QD 2.450 . 3.100 1.778 1.711 1.921 0.089 4 0 "[ . 1 . 2]" 1
940 1 64 ILE H 1 80 LEU QD 2.680 . 3.560 3.784 3.638 3.901 0.341 5 0 "[ . 1 . 2]" 1
941 1 64 ILE MD 1 79 LEU QD 4.120 . 6.440 5.761 5.354 6.102 . 0 0 "[ . 1 . 2]" 1
942 1 64 ILE MD 1 80 LEU QD 4.060 . 6.320 5.752 5.623 5.858 . 0 0 "[ . 1 . 2]" 1
943 1 64 ILE MD 1 81 LEU QD 3.070 . 4.340 3.279 2.870 3.618 . 0 0 "[ . 1 . 2]" 1
944 1 64 ILE MD 1 82 VAL QG 3.880 . 5.960 5.024 4.842 5.150 . 0 0 "[ . 1 . 2]" 1
945 1 64 ILE MD 1 85 LEU QD 4.220 . 6.640 5.229 4.936 5.525 . 0 0 "[ . 1 . 2]" 1
946 1 65 ARG H 1 80 LEU QD 2.780 . 3.760 3.382 3.179 3.551 . 0 0 "[ . 1 . 2]" 1
947 1 66 VAL QG 1 79 LEU QD 2.700 . 3.600 2.559 2.361 2.745 . 0 0 "[ . 1 . 2]" 1
948 1 66 VAL QG 1 80 LEU QD 3.730 . 5.660 4.261 4.082 4.425 . 0 0 "[ . 1 . 2]" 1
949 1 66 VAL QG 1 81 LEU QD 2.870 . 3.940 2.734 2.191 3.074 . 0 0 "[ . 1 . 2]" 1
950 1 69 MET ME 1 79 LEU QD 3.050 . 4.290 2.578 1.929 3.227 . 0 0 "[ . 1 . 2]" 1
951 1 69 MET ME 1 81 LEU QD 3.610 . 5.420 3.880 3.431 4.512 . 0 0 "[ . 1 . 2]" 1
952 1 79 LEU QD 1 80 LEU H 2.220 . 2.640 2.442 2.114 2.682 0.042 4 0 "[ . 1 . 2]" 1
953 1 79 LEU QD 1 80 LEU QD 3.780 . 5.760 4.523 4.378 4.618 . 0 0 "[ . 1 . 2]" 1
954 1 79 LEU QD 1 81 LEU H 2.990 . 4.180 4.057 3.832 4.209 0.029 4 0 "[ . 1 . 2]" 1
955 1 79 LEU QD 1 81 LEU QD 2.480 . 3.160 1.906 1.796 2.183 0.004 6 0 "[ . 1 . 2]" 1
956 1 80 LEU H 1 81 LEU QD 3.530 . 5.260 4.585 4.294 4.733 . 0 0 "[ . 1 . 2]" 1
957 1 81 LEU H 1 81 LEU QD 2.460 . 3.120 3.274 3.139 3.346 0.226 14 0 "[ . 1 . 2]" 1
958 1 81 LEU QD 1 82 VAL H 3.090 . 4.380 3.652 3.510 3.942 . 0 0 "[ . 1 . 2]" 1
959 1 81 LEU QD 1 83 VAL QG 4.700 . 7.600 3.755 3.514 4.069 . 0 0 "[ . 1 . 2]" 1
960 1 82 VAL QG 1 85 LEU QD 4.270 . 6.740 5.893 5.624 6.030 . 0 0 "[ . 1 . 2]" 1
961 1 83 VAL QG 1 85 LEU QD 2.610 . 3.410 2.403 2.145 2.765 . 0 0 "[ . 1 . 2]" 1
962 1 84 ARG H 1 85 LEU QD 3.030 . 4.260 4.003 3.760 4.210 . 0 0 "[ . 1 . 2]" 1
963 1 85 LEU H 1 85 LEU QD 2.460 . 3.120 2.915 2.849 2.961 . 0 0 "[ . 1 . 2]" 1
964 1 85 LEU QD 1 86 LEU QD 3.830 . 5.860 4.381 4.159 4.673 . 0 0 "[ . 1 . 2]" 1
965 1 86 LEU QD 1 88 HIS H 3.670 . 5.540 4.747 3.748 5.551 0.011 4 0 "[ . 1 . 2]" 1
966 1 90 VAL H 1 120 LEU QD 3.190 . 4.580 4.525 4.342 4.649 0.069 10 0 "[ . 1 . 2]" 1
967 1 90 VAL QG 1 91 PHE H 2.490 . 3.180 2.046 1.930 2.147 . 0 0 "[ . 1 . 2]" 1
968 1 90 VAL QG 1 100 ALA H 3.990 . 6.180 5.632 5.411 6.218 0.038 8 0 "[ . 1 . 2]" 1
969 1 90 VAL QG 1 120 LEU QD 3.180 . 4.560 2.687 2.373 2.984 . 0 0 "[ . 1 . 2]" 1
970 1 90 VAL QG 1 154 LEU QD 4.170 . 6.540 4.493 4.342 4.886 . 0 0 "[ . 1 . 2]" 1
971 1 91 PHE H 1 120 LEU QD 2.800 . 3.800 3.539 3.299 3.698 . 0 0 "[ . 1 . 2]" 1
972 1 93 LEU QD 1 94 GLU H 2.230 . 2.660 2.311 1.883 2.723 0.063 1 0 "[ . 1 . 2]" 1
973 1 93 LEU QD 1 97 ASP H 2.480 . 3.160 3.006 2.696 3.206 0.046 7 0 "[ . 1 . 2]" 1
974 1 93 LEU QD 1 98 LEU H 2.950 . 4.100 4.238 4.111 4.353 0.253 1 0 "[ . 1 . 2]" 1
975 1 93 LEU QD 1 98 LEU QD 2.590 . 3.380 2.105 1.796 2.395 0.004 3 0 "[ . 1 . 2]" 1
976 1 93 LEU QD 1 145 PHE H 2.730 . 3.660 3.169 2.633 3.407 . 0 0 "[ . 1 . 2]" 1
977 1 98 LEU H 1 98 LEU QD 2.570 . 3.340 3.359 3.296 3.428 0.088 18 0 "[ . 1 . 2]" 1
978 1 98 LEU QD 1 100 ALA MB 3.900 . 6.000 4.203 3.847 4.593 . 0 0 "[ . 1 . 2]" 1
979 1 98 LEU QD 1 117 ALA MB 4.730 . 7.660 6.414 5.981 6.893 . 0 0 "[ . 1 . 2]" 1
980 1 98 LEU QD 1 124 VAL QG 4.170 . 6.540 4.818 4.333 5.203 . 0 0 "[ . 1 . 2]" 1
981 1 98 LEU QD 1 143 LYS H 3.540 . 5.280 4.830 4.556 5.139 . 0 0 "[ . 1 . 2]" 1
982 1 98 LEU QD 1 145 PHE H 2.730 . 3.660 3.313 3.079 3.543 . 0 0 "[ . 1 . 2]" 1
983 1 98 LEU QD 1 153 ASP H 3.230 . 4.660 4.696 4.515 4.812 0.152 7 0 "[ . 1 . 2]" 1
984 1 98 LEU QD 1 154 LEU H 2.980 . 4.160 4.269 4.195 4.362 0.202 10 0 "[ . 1 . 2]" 1
985 1 98 LEU QD 1 154 LEU QD 2.640 . 3.480 2.470 2.263 2.629 . 0 0 "[ . 1 . 2]" 1
986 1 98 LEU QD 1 155 TYR H 3.820 . 5.840 4.532 4.323 4.882 . 0 0 "[ . 1 . 2]" 1
987 1 98 LEU QD 1 156 LEU QD 3.890 . 5.980 5.035 4.873 5.159 . 0 0 "[ . 1 . 2]" 1
988 1 99 TYR H 1 154 LEU QD 2.710 . 3.620 3.583 3.464 3.690 0.070 10 0 "[ . 1 . 2]" 1
989 1 100 ALA H 1 154 LEU QD 3.230 . 4.660 2.935 2.555 3.318 . 0 0 "[ . 1 . 2]" 1
990 1 100 ALA MB 1 154 LEU QD 2.370 . 2.940 1.886 1.789 2.033 0.011 5 0 "[ . 1 . 2]" 1
991 1 100 ALA MB 1 156 LEU QD 3.540 . 5.280 2.138 1.802 2.464 . 0 0 "[ . 1 . 2]" 1
992 1 102 LEU QD 1 103 ASP H 2.390 . 2.980 2.891 2.627 3.057 0.077 7 0 "[ . 1 . 2]" 1
993 1 102 LEU QD 1 104 VAL QG 2.820 . 3.850 2.451 2.192 3.231 . 0 0 "[ . 1 . 2]" 1
994 1 102 LEU QD 1 108 ILE MD 3.970 . 6.140 5.435 5.079 5.607 . 0 0 "[ . 1 . 2]" 1
995 1 102 LEU QD 1 115 VAL QG 2.420 . 3.040 1.975 1.768 2.456 0.032 2 0 "[ . 1 . 2]" 1
996 1 102 LEU QD 1 117 ALA H 3.110 . 4.420 3.945 3.755 4.225 . 0 0 "[ . 1 . 2]" 1
997 1 102 LEU QD 1 117 ALA MB 2.900 . 4.000 1.885 1.787 2.090 0.013 11 0 "[ . 1 . 2]" 1
998 1 102 LEU QD 1 119 THR MG 4.700 . 7.590 6.516 6.184 6.913 . 0 0 "[ . 1 . 2]" 1
999 1 102 LEU QD 1 124 VAL QG 3.500 . 5.200 4.176 3.936 4.384 . 0 0 "[ . 1 . 2]" 1
1000 1 102 LEU QD 1 126 VAL QG 2.400 . 3.000 1.875 1.775 2.016 0.025 19 0 "[ . 1 . 2]" 1
1001 1 102 LEU QD 1 128 VAL QG 2.900 . 4.000 2.515 2.117 2.848 . 0 0 "[ . 1 . 2]" 1
1002 1 102 LEU QD 1 140 LEU QD 3.420 . 5.040 3.801 3.627 4.057 . 0 0 "[ . 1 . 2]" 1
1003 1 102 LEU QD 1 156 LEU QD 2.610 . 3.410 1.823 1.744 1.937 0.056 6 0 "[ . 1 . 2]" 1
1004 1 102 LEU QD 1 159 ARG H 3.320 . 4.840 4.299 3.961 4.468 . 0 0 "[ . 1 . 2]" 1
1005 1 102 LEU QD 1 160 ILE MD 4.010 . 6.220 6.298 6.002 6.486 0.266 7 0 "[ . 1 . 2]" 1
1006 1 106 ALA MB 1 110 VAL QG 3.180 . 4.560 3.266 3.038 3.568 . 0 0 "[ . 1 . 2]" 1
1007 1 109 ALA H 1 110 VAL QG 3.000 . 4.200 3.697 3.600 3.820 . 0 0 "[ . 1 . 2]" 1
1008 1 109 ALA MB 1 110 VAL QG 3.020 . 4.240 2.753 2.610 2.913 . 0 0 "[ . 1 . 2]" 1
1009 1 110 VAL QG 1 111 VAL H 2.380 . 2.960 2.182 1.864 2.340 . 0 0 "[ . 1 . 2]" 1
1010 1 110 VAL QG 1 111 VAL MG2 2.710 . 3.620 3.308 2.560 3.543 . 0 0 "[ . 1 . 2]" 1
1011 1 110 VAL QG 1 112 GLY H 3.140 . 4.480 4.011 3.704 4.149 . 0 0 "[ . 1 . 2]" 1
1012 1 110 VAL QG 1 132 THR H 3.380 . 4.950 4.537 4.064 4.845 . 0 0 "[ . 1 . 2]" 1
1013 1 110 VAL QG 1 160 ILE MD 3.530 . 5.260 3.883 3.657 4.104 . 0 0 "[ . 1 . 2]" 1
1014 1 111 VAL MG2 1 128 VAL QG 4.340 . 6.880 4.502 3.950 6.249 . 0 0 "[ . 1 . 2]" 1
1015 1 115 VAL QG 1 156 LEU QD 3.450 . 5.100 4.102 3.730 4.722 . 0 0 "[ . 1 . 2]" 1
1016 1 117 ALA H 1 140 LEU QD 3.750 . 5.700 4.671 4.365 5.064 . 0 0 "[ . 1 . 2]" 1
1017 1 117 ALA MB 1 138 LEU QD 4.880 . 7.960 5.152 4.840 5.499 . 0 0 "[ . 1 . 2]" 1
1018 1 117 ALA MB 1 140 LEU QD 3.510 . 5.220 3.191 2.841 3.669 . 0 0 "[ . 1 . 2]" 1
1019 1 117 ALA MB 1 154 LEU QD 3.570 . 5.340 3.225 2.772 3.658 . 0 0 "[ . 1 . 2]" 1
1020 1 117 ALA MB 1 156 LEU QD 3.060 . 4.320 2.336 1.988 2.594 . 0 0 "[ . 1 . 2]" 1
1021 1 118 MET ME 1 120 LEU QD 3.590 . 5.380 4.484 3.211 5.020 . 0 0 "[ . 1 . 2]" 1
1022 1 119 THR MG 1 120 LEU QD 4.470 . 7.140 4.837 4.686 5.001 . 0 0 "[ . 1 . 2]" 1
1023 1 119 THR MG 1 154 LEU QD 2.910 . 4.020 3.513 3.115 3.832 . 0 0 "[ . 1 . 2]" 1
1024 1 119 THR MG 1 156 LEU QD 3.680 . 5.560 5.138 4.816 5.412 . 0 0 "[ . 1 . 2]" 1
1025 1 120 LEU H 1 120 LEU QD 2.560 . 3.320 2.985 2.813 3.100 . 0 0 "[ . 1 . 2]" 1
1026 1 120 LEU QD 1 121 GLU H 3.490 . 5.180 4.340 4.160 4.449 . 0 0 "[ . 1 . 2]" 1
1027 1 124 VAL H 1 124 VAL QG 2.160 . 2.520 2.049 1.998 2.138 . 0 0 "[ . 1 . 2]" 1
1028 1 124 VAL QG 1 140 LEU QD 2.520 . 3.240 2.092 1.972 2.264 . 0 0 "[ . 1 . 2]" 1
1029 1 124 VAL QG 1 154 LEU QD 2.840 . 3.880 2.537 2.155 2.757 . 0 0 "[ . 1 . 2]" 1
1030 1 124 VAL QG 1 156 LEU QD 3.070 . 4.340 3.141 2.936 3.310 . 0 0 "[ . 1 . 2]" 1
1031 1 125 GLU H 1 140 LEU QD 2.900 . 4.000 4.103 4.036 4.238 0.238 2 0 "[ . 1 . 2]" 1
1032 1 126 VAL H 1 140 LEU QD 3.000 . 4.200 4.026 3.728 4.282 0.082 20 0 "[ . 1 . 2]" 1
1033 1 126 VAL QG 1 139 ARG H 3.420 . 5.040 5.127 4.955 5.259 0.219 2 0 "[ . 1 . 2]" 1
1034 1 126 VAL QG 1 140 LEU QD 2.320 . 2.840 1.812 1.631 1.989 0.169 2 0 "[ . 1 . 2]" 1
1035 1 126 VAL QG 1 156 LEU QD 2.430 . 3.060 1.794 1.745 1.924 0.055 14 0 "[ . 1 . 2]" 1
1036 1 127 ALA H 1 140 LEU QD 3.130 . 4.460 3.738 3.339 4.062 . 0 0 "[ . 1 . 2]" 1
1037 1 127 ALA MB 1 140 LEU QD 3.610 . 5.420 4.722 4.362 5.054 . 0 0 "[ . 1 . 2]" 1
1038 1 138 LEU H 1 156 LEU QD 2.660 . 3.520 3.823 3.664 4.026 0.506 9 1 "[ . +1 . 2]" 1
1039 1 138 LEU QD 1 140 LEU QD 3.450 . 5.100 3.835 3.514 4.014 . 0 0 "[ . 1 . 2]" 1
1040 1 138 LEU QD 1 156 LEU QD 2.850 . 3.900 2.977 2.629 3.251 . 0 0 "[ . 1 . 2]" 1
1041 1 138 LEU QD 1 158 VAL H 3.000 . 4.200 4.134 3.674 4.362 0.162 7 0 "[ . 1 . 2]" 1
1042 1 140 LEU H 1 140 LEU QD 2.410 . 3.020 2.996 2.827 3.154 0.134 12 0 "[ . 1 . 2]" 1
1043 1 140 LEU H 1 156 LEU QD 3.050 . 4.290 4.035 3.778 4.324 0.034 12 0 "[ . 1 . 2]" 1
1044 1 140 LEU QD 1 154 LEU QD 2.560 . 3.320 1.917 1.778 2.251 0.022 16 0 "[ . 1 . 2]" 1
1045 1 140 LEU QD 1 156 LEU H 3.130 . 4.460 4.640 4.535 4.708 0.248 19 0 "[ . 1 . 2]" 1
1046 1 140 LEU QD 1 156 LEU QD 2.660 . 3.520 1.934 1.796 2.205 0.004 13 0 "[ . 1 . 2]" 1
1047 1 154 LEU H 1 156 LEU QD 3.690 . 5.580 5.485 5.295 5.617 0.037 14 0 "[ . 1 . 2]" 1
1048 1 154 LEU QD 1 155 TYR H 2.220 . 2.640 2.295 1.915 2.536 . 0 0 "[ . 1 . 2]" 1
1049 1 154 LEU QD 1 156 LEU H 3.260 . 4.720 3.907 3.718 4.071 . 0 0 "[ . 1 . 2]" 1
1050 1 154 LEU QD 1 156 LEU QD 2.950 . 4.100 1.992 1.883 2.140 . 0 0 "[ . 1 . 2]" 1
1051 1 155 TYR H 1 156 LEU QD 3.390 . 4.980 4.795 4.503 5.016 0.036 19 0 "[ . 1 . 2]" 1
1052 1 156 LEU H 1 156 LEU QD 2.270 . 2.740 3.091 3.007 3.130 0.390 7 0 "[ . 1 . 2]" 1
1053 1 156 LEU QD 1 158 VAL H 3.400 . 5.000 5.144 5.046 5.251 0.251 2 0 "[ . 1 . 2]" 1
1054 1 32 LEU H 1 88 HIS HD2 4.200 . 6.600 4.784 3.252 5.518 . 0 0 "[ . 1 . 2]" 1
1055 1 32 LEU QB 1 88 HIS HE1 4.200 . 6.600 4.884 3.078 6.646 0.046 14 0 "[ . 1 . 2]" 1
1056 1 32 LEU QD 1 88 HIS HE1 4.200 . 6.600 3.292 2.686 4.154 . 0 0 "[ . 1 . 2]" 1
1057 1 33 GLU H 1 88 HIS HD2 4.200 . 6.600 6.342 4.119 6.817 0.217 11 0 "[ . 1 . 2]" 1
1058 1 35 ALA H 1 145 PHE QE 4.200 . 6.600 6.237 4.985 6.784 0.184 7 0 "[ . 1 . 2]" 1
1059 1 36 PHE QD 1 145 PHE QD 4.200 . 6.600 4.021 2.699 4.796 . 0 0 "[ . 1 . 2]" 1
1060 1 88 HIS HE1 1 91 PHE QD 4.200 . 6.600 6.568 6.251 6.722 0.122 4 0 "[ . 1 . 2]" 1
1061 1 90 VAL QG 1 91 PHE QD 4.200 . 6.600 1.779 1.711 1.894 0.089 14 0 "[ . 1 . 2]" 1
1062 1 88 HIS HE1 1 90 VAL QG 4.200 . 6.600 3.274 2.637 3.802 . 0 0 "[ . 1 . 2]" 1
1063 1 91 PHE QD 1 100 ALA MB 4.200 . 6.600 3.143 2.919 3.343 . 0 0 "[ . 1 . 2]" 1
1064 1 36 PHE QD 1 120 LEU QD 4.200 . 6.600 2.909 2.156 3.643 . 0 0 "[ . 1 . 2]" 1
1065 1 91 PHE QD 1 120 LEU QD 4.200 . 6.600 2.892 2.667 3.101 . 0 0 "[ . 1 . 2]" 1
1066 1 36 PHE QD 1 145 PHE QE 4.200 . 6.600 2.992 2.557 3.413 . 0 0 "[ . 1 . 2]" 1
1067 1 93 LEU QD 1 145 PHE QB 4.200 . 6.600 2.459 1.946 3.008 . 0 0 "[ . 1 . 2]" 1
1068 1 36 PHE QB 1 120 LEU QD 4.200 . 6.600 2.164 1.900 2.514 . 0 0 "[ . 1 . 2]" 1
1069 1 93 LEU QD 1 145 PHE QD 4.200 . 6.600 2.011 1.652 2.564 0.148 20 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 110
_Distance_constraint_stats_list.Viol_count 292
_Distance_constraint_stats_list.Viol_total 255.512
_Distance_constraint_stats_list.Viol_max 0.171
_Distance_constraint_stats_list.Viol_rms 0.0183
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0058
_Distance_constraint_stats_list.Viol_average_violations_only 0.0438
_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 22 ARG 0.461 0.092 12 0 "[ . 1 . 2]"
1 24 LEU 0.081 0.036 13 0 "[ . 1 . 2]"
1 26 ALA 0.304 0.051 2 0 "[ . 1 . 2]"
1 28 LEU 0.941 0.084 6 0 "[ . 1 . 2]"
1 30 LEU 0.015 0.015 8 0 "[ . 1 . 2]"
1 31 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 32 LEU 1.441 0.171 2 0 "[ . 1 . 2]"
1 33 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 34 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 35 ALA 0.990 0.128 6 0 "[ . 1 . 2]"
1 36 PHE 1.441 0.171 2 0 "[ . 1 . 2]"
1 37 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 38 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 41 ARG 0.115 0.080 10 0 "[ . 1 . 2]"
1 43 VAL 0.326 0.117 2 0 "[ . 1 . 2]"
1 50 VAL 0.326 0.117 2 0 "[ . 1 . 2]"
1 52 VAL 0.115 0.080 10 0 "[ . 1 . 2]"
1 57 GLY 0.990 0.128 6 0 "[ . 1 . 2]"
1 61 GLY 0.123 0.087 16 0 "[ . 1 . 2]"
1 62 SER 1.126 0.097 14 0 "[ . 1 . 2]"
1 64 ILE 0.034 0.019 4 0 "[ . 1 . 2]"
1 66 VAL 0.788 0.092 8 0 "[ . 1 . 2]"
1 71 GLY 0.808 0.092 12 0 "[ . 1 . 2]"
1 77 GLY 0.347 0.073 4 0 "[ . 1 . 2]"
1 78 ASP 0.081 0.036 13 0 "[ . 1 . 2]"
1 79 LEU 0.788 0.092 8 0 "[ . 1 . 2]"
1 80 LEU 0.113 0.051 2 0 "[ . 1 . 2]"
1 81 LEU 0.034 0.019 4 0 "[ . 1 . 2]"
1 82 VAL 1.132 0.084 6 0 "[ . 1 . 2]"
1 83 VAL 1.249 0.097 14 0 "[ . 1 . 2]"
1 84 ARG 0.015 0.015 8 0 "[ . 1 . 2]"
1 92 ARG 0.490 0.075 14 0 "[ . 1 . 2]"
1 94 GLU 0.627 0.107 19 0 "[ . 1 . 2]"
1 96 GLN 0.471 0.105 14 0 "[ . 1 . 2]"
1 97 ASP 0.627 0.107 19 0 "[ . 1 . 2]"
1 98 LEU 0.034 0.023 19 0 "[ . 1 . 2]"
1 99 TYR 0.490 0.075 14 0 "[ . 1 . 2]"
1 100 ALA 0.055 0.042 13 0 "[ . 1 . 2]"
1 102 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 104 VAL 0.132 0.049 4 0 "[ . 1 . 2]"
1 105 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 106 ALA 0.415 0.097 14 0 "[ . 1 . 2]"
1 107 PRO 0.147 0.038 2 0 "[ . 1 . 2]"
1 108 ILE 0.317 0.098 11 0 "[ . 1 . 2]"
1 109 ALA 0.226 0.040 18 0 "[ . 1 . 2]"
1 110 VAL 1.178 0.097 14 0 "[ . 1 . 2]"
1 111 VAL 0.147 0.038 2 0 "[ . 1 . 2]"
1 112 GLY 0.317 0.098 11 0 "[ . 1 . 2]"
1 113 GLY 0.443 0.064 10 0 "[ . 1 . 2]"
1 115 VAL 0.019 0.019 20 0 "[ . 1 . 2]"
1 117 ALA 0.247 0.062 7 0 "[ . 1 . 2]"
1 124 VAL 0.247 0.062 7 0 "[ . 1 . 2]"
1 126 VAL 0.019 0.019 20 0 "[ . 1 . 2]"
1 128 VAL 0.443 0.064 10 0 "[ . 1 . 2]"
1 131 ARG 0.763 0.086 13 0 "[ . 1 . 2]"
1 132 THR 0.226 0.040 18 0 "[ . 1 . 2]"
1 135 GLY 0.032 0.032 5 0 "[ . 1 . 2]"
1 136 ARG 0.270 0.080 9 0 "[ . 1 . 2]"
1 138 LEU 0.370 0.068 16 0 "[ . 1 . 2]"
1 140 LEU 0.119 0.077 18 0 "[ . 1 . 2]"
1 144 GLY 0.494 0.070 3 0 "[ . 1 . 2]"
1 145 PHE 0.483 0.105 14 0 "[ . 1 . 2]"
1 152 GLY 0.505 0.070 3 0 "[ . 1 . 2]"
1 153 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 154 LEU 0.119 0.077 18 0 "[ . 1 . 2]"
1 155 TYR 0.085 0.042 13 0 "[ . 1 . 2]"
1 156 LEU 0.370 0.068 16 0 "[ . 1 . 2]"
1 157 GLU 0.003 0.003 20 0 "[ . 1 . 2]"
1 158 VAL 0.302 0.080 9 0 "[ . 1 . 2]"
1 159 ARG 0.049 0.026 15 0 "[ . 1 . 2]"
1 161 THR 0.083 0.049 4 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 24 LEU H 1 78 ASP O 2.000 . 2.200 2.097 1.927 2.236 0.036 13 0 "[ . 1 . 2]" 2
2 1 26 ALA H 1 80 LEU O 2.000 . 2.200 2.069 1.950 2.251 0.051 2 0 "[ . 1 . 2]" 2
3 1 28 LEU H 1 82 VAL O 2.000 . 2.200 2.242 2.120 2.284 0.084 6 0 "[ . 1 . 2]" 2
4 1 30 LEU H 1 84 ARG O 2.000 . 2.200 2.045 1.978 2.215 0.015 8 0 "[ . 1 . 2]" 2
5 1 31 THR O 1 35 ALA H 2.000 . 2.200 2.056 1.971 2.114 . 0 0 "[ . 1 . 2]" 2
6 1 32 LEU O 1 36 PHE H 2.000 . 2.200 2.269 2.147 2.371 0.171 2 0 "[ . 1 . 2]" 2
7 1 33 GLU O 1 37 HIS H 2.000 . 2.200 2.018 1.926 2.102 . 0 0 "[ . 1 . 2]" 2
8 1 34 GLU O 1 38 GLY H 2.000 . 2.200 2.016 1.928 2.130 . 0 0 "[ . 1 . 2]" 2
9 1 41 ARG H 1 52 VAL O 2.000 . 2.200 2.050 1.911 2.280 0.080 10 0 "[ . 1 . 2]" 2
10 1 43 VAL H 1 50 VAL O 2.000 . 2.200 2.040 1.938 2.293 0.093 9 0 "[ . 1 . 2]" 2
11 1 43 VAL O 1 50 VAL H 2.000 . 2.200 2.102 1.962 2.317 0.117 2 0 "[ . 1 . 2]" 2
12 1 41 ARG O 1 52 VAL H 2.000 . 2.200 2.013 1.948 2.214 0.014 18 0 "[ . 1 . 2]" 2
13 1 35 ALA O 1 57 GLY H 2.000 . 2.200 2.234 2.062 2.328 0.128 6 0 "[ . 1 . 2]" 2
14 1 61 GLY H 1 83 VAL O 2.000 . 2.200 2.134 2.012 2.287 0.087 16 0 "[ . 1 . 2]" 2
15 1 64 ILE H 1 81 LEU O 2.000 . 2.200 2.083 2.021 2.219 0.019 4 0 "[ . 1 . 2]" 2
16 1 66 VAL H 1 79 LEU O 2.000 . 2.200 2.197 2.103 2.253 0.053 17 0 "[ . 1 . 2]" 2
17 1 22 ARG O 1 71 GLY H 2.000 . 2.200 2.166 1.948 2.292 0.092 12 0 "[ . 1 . 2]" 2
18 1 71 GLY O 1 77 GLY H 2.000 . 2.200 2.151 1.937 2.273 0.073 4 0 "[ . 1 . 2]" 2
19 1 66 VAL O 1 79 LEU H 2.000 . 2.200 2.174 2.015 2.292 0.092 8 0 "[ . 1 . 2]" 2
20 1 24 LEU O 1 80 LEU H 2.000 . 2.200 1.939 1.882 2.015 . 0 0 "[ . 1 . 2]" 2
21 1 64 ILE O 1 81 LEU H 2.000 . 2.200 2.067 1.955 2.160 . 0 0 "[ . 1 . 2]" 2
22 1 26 ALA O 1 82 VAL H 2.000 . 2.200 2.159 2.011 2.248 0.048 11 0 "[ . 1 . 2]" 2
23 1 62 SER O 1 83 VAL H 2.000 . 2.200 2.256 2.222 2.297 0.097 14 0 "[ . 1 . 2]" 2
24 1 28 LEU O 1 84 ARG H 2.000 . 2.200 2.018 1.950 2.109 . 0 0 "[ . 1 . 2]" 2
25 1 92 ARG H 1 99 TYR O 2.000 . 2.200 2.027 1.917 2.232 0.032 8 0 "[ . 1 . 2]" 2
26 1 94 GLU H 1 97 ASP O 2.000 . 2.200 1.995 1.914 2.120 . 0 0 "[ . 1 . 2]" 2
27 1 94 GLU O 1 97 ASP H 2.000 . 2.200 2.202 1.994 2.307 0.107 19 0 "[ . 1 . 2]" 2
28 1 98 LEU H 1 153 ASP O 2.000 . 2.200 1.954 1.902 2.136 . 0 0 "[ . 1 . 2]" 2
29 1 92 ARG O 1 99 TYR H 2.000 . 2.200 2.203 2.059 2.275 0.075 14 0 "[ . 1 . 2]" 2
30 1 100 ALA H 1 155 TYR O 2.000 . 2.200 2.092 1.985 2.242 0.042 13 0 "[ . 1 . 2]" 2
31 1 102 LEU H 1 157 GLU O 2.000 . 2.200 2.059 1.931 2.146 . 0 0 "[ . 1 . 2]" 2
32 1 104 VAL H 1 159 ARG O 2.000 . 2.200 2.129 2.024 2.226 0.026 15 0 "[ . 1 . 2]" 2
33 1 105 PRO O 1 109 ALA H 2.000 . 2.200 2.053 1.964 2.134 . 0 0 "[ . 1 . 2]" 2
34 1 106 ALA O 1 110 VAL H 2.000 . 2.200 2.197 2.114 2.297 0.097 14 0 "[ . 1 . 2]" 2
35 1 107 PRO O 1 111 VAL H 2.000 . 2.200 2.138 1.969 2.238 0.038 2 0 "[ . 1 . 2]" 2
36 1 108 ILE O 1 112 GLY H 2.000 . 2.200 2.094 1.986 2.298 0.098 11 0 "[ . 1 . 2]" 2
37 1 115 VAL H 1 126 VAL O 2.000 . 2.200 2.064 1.969 2.219 0.019 20 0 "[ . 1 . 2]" 2
38 1 117 ALA H 1 124 VAL O 2.000 . 2.200 2.095 1.985 2.262 0.062 7 0 "[ . 1 . 2]" 2
39 1 117 ALA O 1 124 VAL H 2.000 . 2.200 2.101 1.945 2.257 0.057 15 0 "[ . 1 . 2]" 2
40 1 115 VAL O 1 126 VAL H 2.000 . 2.200 2.065 1.946 2.195 . 0 0 "[ . 1 . 2]" 2
41 1 113 GLY O 1 128 VAL H 2.000 . 2.200 2.199 2.036 2.264 0.064 10 0 "[ . 1 . 2]" 2
42 1 110 VAL O 1 131 ARG H 2.000 . 2.200 2.237 2.184 2.286 0.086 13 0 "[ . 1 . 2]" 2
43 1 109 ALA O 1 132 THR H 2.000 . 2.200 2.153 2.016 2.240 0.040 18 0 "[ . 1 . 2]" 2
44 1 135 GLY H 1 158 VAL O 2.000 . 2.200 2.021 1.890 2.232 0.032 5 0 "[ . 1 . 2]" 2
45 1 140 LEU H 1 154 LEU O 2.000 . 2.200 2.014 1.905 2.217 0.017 19 0 "[ . 1 . 2]" 2
46 1 144 GLY H 1 152 GLY O 2.000 . 2.200 2.195 2.057 2.270 0.070 3 0 "[ . 1 . 2]" 2
47 1 96 GLN O 1 145 PHE H 2.000 . 2.200 2.177 2.055 2.305 0.105 14 0 "[ . 1 . 2]" 2
48 1 145 PHE O 1 152 GLY H 2.000 . 2.200 2.102 2.023 2.212 0.012 15 0 "[ . 1 . 2]" 2
49 1 140 LEU O 1 154 LEU H 2.000 . 2.200 2.098 1.977 2.277 0.077 18 0 "[ . 1 . 2]" 2
50 1 98 LEU O 1 155 TYR H 2.000 . 2.200 2.089 1.993 2.223 0.023 19 0 "[ . 1 . 2]" 2
51 1 138 LEU O 1 156 LEU H 2.000 . 2.200 2.192 2.015 2.268 0.068 16 0 "[ . 1 . 2]" 2
52 1 100 ALA O 1 157 GLU H 2.000 . 2.200 2.045 1.965 2.203 0.003 20 0 "[ . 1 . 2]" 2
53 1 136 ARG O 1 158 VAL H 2.000 . 2.200 2.113 1.966 2.280 0.080 9 0 "[ . 1 . 2]" 2
54 1 102 LEU O 1 159 ARG H 2.000 . 2.200 1.974 1.917 2.035 . 0 0 "[ . 1 . 2]" 2
55 1 104 VAL O 1 161 THR H 2.000 . 2.200 2.067 1.974 2.249 0.049 4 0 "[ . 1 . 2]" 2
56 1 24 LEU N 1 78 ASP O 3.050 . 3.410 2.997 2.866 3.157 . 0 0 "[ . 1 . 2]" 2
57 1 26 ALA N 1 80 LEU O 3.050 . 3.410 3.029 2.915 3.230 . 0 0 "[ . 1 . 2]" 2
58 1 28 LEU N 1 82 VAL O 3.050 . 3.410 3.177 3.075 3.228 . 0 0 "[ . 1 . 2]" 2
59 1 30 LEU N 1 84 ARG O 3.050 . 3.410 2.901 2.833 3.115 . 0 0 "[ . 1 . 2]" 2
60 1 31 THR O 1 35 ALA N 3.050 . 3.410 2.910 2.849 2.985 . 0 0 "[ . 1 . 2]" 2
61 1 32 LEU O 1 36 PHE N 3.050 . 3.410 3.172 3.020 3.313 . 0 0 "[ . 1 . 2]" 2
62 1 33 GLU O 1 37 HIS N 3.050 . 3.410 2.896 2.774 3.021 . 0 0 "[ . 1 . 2]" 2
63 1 34 GLU O 1 38 GLY N 3.050 . 3.410 2.873 2.706 3.073 . 0 0 "[ . 1 . 2]" 2
64 1 41 ARG N 1 52 VAL O 3.050 . 3.410 2.973 2.834 3.154 . 0 0 "[ . 1 . 2]" 2
65 1 43 VAL N 1 50 VAL O 3.050 . 3.410 2.946 2.800 3.107 . 0 0 "[ . 1 . 2]" 2
66 1 43 VAL O 1 50 VAL N 3.050 . 3.410 3.029 2.805 3.308 . 0 0 "[ . 1 . 2]" 2
67 1 41 ARG O 1 52 VAL N 3.050 . 3.410 2.865 2.732 3.134 . 0 0 "[ . 1 . 2]" 2
68 1 35 ALA O 1 57 GLY N 3.050 . 3.410 3.168 2.957 3.300 . 0 0 "[ . 1 . 2]" 2
69 1 61 GLY N 1 83 VAL O 3.050 . 3.410 3.030 2.852 3.259 . 0 0 "[ . 1 . 2]" 2
70 1 64 ILE N 1 81 LEU O 3.050 . 3.410 2.949 2.895 3.071 . 0 0 "[ . 1 . 2]" 2
71 1 66 VAL N 1 79 LEU O 3.050 . 3.410 3.110 2.944 3.184 . 0 0 "[ . 1 . 2]" 2
72 1 22 ARG O 1 71 GLY N 3.050 . 3.410 2.879 2.628 3.130 . 0 0 "[ . 1 . 2]" 2
73 1 71 GLY O 1 77 GLY N 3.050 . 3.410 3.021 2.805 3.249 . 0 0 "[ . 1 . 2]" 2
74 1 66 VAL O 1 79 LEU N 3.050 . 3.410 3.060 2.859 3.195 . 0 0 "[ . 1 . 2]" 2
75 1 24 LEU O 1 80 LEU N 3.050 . 3.410 2.873 2.765 2.951 . 0 0 "[ . 1 . 2]" 2
76 1 64 ILE O 1 81 LEU N 3.050 . 3.410 2.989 2.888 3.071 . 0 0 "[ . 1 . 2]" 2
77 1 26 ALA O 1 82 VAL N 3.050 . 3.410 3.058 2.976 3.141 . 0 0 "[ . 1 . 2]" 2
78 1 62 SER O 1 83 VAL N 3.050 . 3.410 3.194 3.135 3.253 . 0 0 "[ . 1 . 2]" 2
79 1 28 LEU O 1 84 ARG N 3.050 . 3.410 2.826 2.761 2.958 . 0 0 "[ . 1 . 2]" 2
80 1 92 ARG N 1 99 TYR O 3.050 . 3.410 2.943 2.852 3.099 . 0 0 "[ . 1 . 2]" 2
81 1 94 GLU N 1 97 ASP O 3.050 . 3.410 2.924 2.719 3.089 . 0 0 "[ . 1 . 2]" 2
82 1 94 GLU O 1 97 ASP N 3.050 . 3.410 3.085 2.874 3.204 . 0 0 "[ . 1 . 2]" 2
83 1 98 LEU N 1 153 ASP O 3.050 . 3.410 2.853 2.776 2.938 . 0 0 "[ . 1 . 2]" 2
84 1 92 ARG O 1 99 TYR N 3.050 . 3.410 2.913 2.797 3.072 . 0 0 "[ . 1 . 2]" 2
85 1 100 ALA N 1 155 TYR O 3.050 . 3.410 3.020 2.792 3.161 . 0 0 "[ . 1 . 2]" 2
86 1 102 LEU N 1 157 GLU O 3.050 . 3.410 2.955 2.895 3.019 . 0 0 "[ . 1 . 2]" 2
87 1 104 VAL N 1 159 ARG O 3.050 . 3.410 3.030 2.915 3.185 . 0 0 "[ . 1 . 2]" 2
88 1 105 PRO O 1 109 ALA N 3.050 . 3.410 2.950 2.872 3.028 . 0 0 "[ . 1 . 2]" 2
89 1 106 ALA O 1 110 VAL N 3.050 . 3.410 3.104 3.009 3.239 . 0 0 "[ . 1 . 2]" 2
90 1 107 PRO O 1 111 VAL N 3.050 . 3.410 3.082 2.879 3.194 . 0 0 "[ . 1 . 2]" 2
91 1 108 ILE O 1 112 GLY N 3.050 . 3.410 2.807 2.734 2.971 . 0 0 "[ . 1 . 2]" 2
92 1 115 VAL N 1 126 VAL O 3.050 . 3.410 3.009 2.906 3.154 . 0 0 "[ . 1 . 2]" 2
93 1 117 ALA N 1 124 VAL O 3.050 . 3.410 2.955 2.766 3.197 . 0 0 "[ . 1 . 2]" 2
94 1 117 ALA O 1 124 VAL N 3.050 . 3.410 3.051 2.871 3.238 . 0 0 "[ . 1 . 2]" 2
95 1 115 VAL O 1 126 VAL N 3.050 . 3.410 2.964 2.802 3.172 . 0 0 "[ . 1 . 2]" 2
96 1 113 GLY O 1 128 VAL N 3.050 . 3.410 2.993 2.828 3.200 . 0 0 "[ . 1 . 2]" 2
97 1 110 VAL O 1 131 ARG N 3.050 . 3.410 2.922 2.834 3.006 . 0 0 "[ . 1 . 2]" 2
98 1 109 ALA O 1 132 THR N 3.050 . 3.410 3.068 2.938 3.172 . 0 0 "[ . 1 . 2]" 2
99 1 135 GLY N 1 158 VAL O 3.050 . 3.410 2.916 2.719 3.096 . 0 0 "[ . 1 . 2]" 2
100 1 140 LEU N 1 154 LEU O 3.050 . 3.410 2.930 2.835 3.158 . 0 0 "[ . 1 . 2]" 2
101 1 144 GLY N 1 152 GLY O 3.050 . 3.410 3.074 2.984 3.140 . 0 0 "[ . 1 . 2]" 2
102 1 96 GLN O 1 145 PHE N 3.050 . 3.410 3.006 2.739 3.200 . 0 0 "[ . 1 . 2]" 2
103 1 145 PHE O 1 152 GLY N 3.050 . 3.410 2.889 2.728 2.991 . 0 0 "[ . 1 . 2]" 2
104 1 140 LEU O 1 154 LEU N 3.050 . 3.410 3.036 2.908 3.190 . 0 0 "[ . 1 . 2]" 2
105 1 98 LEU O 1 155 TYR N 3.050 . 3.410 3.007 2.910 3.163 . 0 0 "[ . 1 . 2]" 2
106 1 138 LEU O 1 156 LEU N 3.050 . 3.410 3.158 2.990 3.223 . 0 0 "[ . 1 . 2]" 2
107 1 100 ALA O 1 157 GLU N 3.050 . 3.410 2.930 2.794 3.035 . 0 0 "[ . 1 . 2]" 2
108 1 136 ARG O 1 158 VAL N 3.050 . 3.410 2.993 2.802 3.210 . 0 0 "[ . 1 . 2]" 2
109 1 102 LEU O 1 159 ARG N 3.050 . 3.410 2.790 2.686 2.862 . 0 0 "[ . 1 . 2]" 2
110 1 104 VAL O 1 161 THR N 3.050 . 3.410 3.006 2.919 3.161 . 0 0 "[ . 1 . 2]" 2
stop_
save_
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