NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
642219 |
6pri   |
30634 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6pri
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 1127
_Distance_constraint_stats_list.Viol_count 840
_Distance_constraint_stats_list.Viol_total 1534.735
_Distance_constraint_stats_list.Viol_max 0.787
_Distance_constraint_stats_list.Viol_rms 0.0246
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0034
_Distance_constraint_stats_list.Viol_average_violations_only 0.0914
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 3 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 4 LEU 0.174 0.058 7 0 "[ . 1 . 2]"
1 5 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 6 ILE 1.351 0.224 1 0 "[ . 1 . 2]"
1 7 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 ALA 0.363 0.159 10 0 "[ . 1 . 2]"
1 9 TYR 24.317 0.787 15 2 "[ . 1 +- 2]"
1 10 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 GLN 0.607 0.167 12 0 "[ . 1 . 2]"
1 25 ASP 0.021 0.021 18 0 "[ . 1 . 2]"
1 26 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 27 TYR 0.261 0.080 5 0 "[ . 1 . 2]"
1 28 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 29 THR 3.195 0.252 11 0 "[ . 1 . 2]"
1 30 LEU 7.942 0.252 11 0 "[ . 1 . 2]"
1 31 ASP 1.954 0.137 5 0 "[ . 1 . 2]"
1 32 VAL 2.171 0.176 20 0 "[ . 1 . 2]"
1 33 PRO 6.072 0.173 5 0 "[ . 1 . 2]"
1 34 ALA 0.080 0.054 2 0 "[ . 1 . 2]"
1 35 PRO 2.199 0.180 13 0 "[ . 1 . 2]"
1 36 ILE 4.326 0.173 5 0 "[ . 1 . 2]"
1 37 ALA 0.999 0.159 9 0 "[ . 1 . 2]"
1 38 VAL 0.242 0.139 13 0 "[ . 1 . 2]"
1 39 VAL 0.495 0.150 4 0 "[ . 1 . 2]"
1 40 GLY 0.231 0.054 7 0 "[ . 1 . 2]"
1 41 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 42 LYS 0.882 0.108 6 0 "[ . 1 . 2]"
1 43 VAL 0.861 0.184 19 0 "[ . 1 . 2]"
1 44 ARG 0.128 0.092 20 0 "[ . 1 . 2]"
1 45 ALA 0.767 0.159 4 0 "[ . 1 . 2]"
1 46 MET 0.591 0.120 11 0 "[ . 1 . 2]"
1 47 THR 0.588 0.146 18 0 "[ . 1 . 2]"
1 48 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 49 GLU 0.153 0.054 12 0 "[ . 1 . 2]"
1 50 GLY 0.030 0.030 6 0 "[ . 1 . 2]"
1 51 PRO 0.227 0.090 2 0 "[ . 1 . 2]"
1 52 VAL 1.246 0.159 4 0 "[ . 1 . 2]"
1 53 GLU 1.644 0.163 7 0 "[ . 1 . 2]"
1 54 VAL 2.819 0.184 19 0 "[ . 1 . 2]"
1 55 ALA 0.175 0.071 8 0 "[ . 1 . 2]"
1 56 VAL 1.808 0.250 2 0 "[ . 1 . 2]"
1 57 PRO 0.313 0.086 20 0 "[ . 1 . 2]"
1 58 PRO 0.966 0.150 4 0 "[ . 1 . 2]"
1 59 ARG 3.909 0.402 15 0 "[ . 1 . 2]"
1 60 THR 2.163 0.176 13 0 "[ . 1 . 2]"
1 61 GLN 3.121 0.219 12 0 "[ . 1 . 2]"
1 62 ALA 0.020 0.020 5 0 "[ . 1 . 2]"
1 63 GLY 2.591 0.194 6 0 "[ . 1 . 2]"
1 64 ARG 4.112 0.236 9 0 "[ . 1 . 2]"
1 65 LYS 11.405 0.787 15 2 "[ . 1 +- 2]"
1 66 LEU 9.648 0.493 18 0 "[ . 1 . 2]"
1 67 ARG 2.521 0.164 4 0 "[ . 1 . 2]"
1 68 LEU 2.870 0.224 1 0 "[ . 1 . 2]"
1 69 LYS 6.091 0.360 1 0 "[ . 1 . 2]"
1 70 GLY 0.834 0.361 13 0 "[ . 1 . 2]"
1 71 LYS 0.287 0.056 4 0 "[ . 1 . 2]"
1 72 GLY 1.866 0.160 20 0 "[ . 1 . 2]"
1 74 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 75 GLY 0.831 0.167 12 0 "[ . 1 . 2]"
1 76 PRO 0.498 0.163 10 0 "[ . 1 . 2]"
1 77 ALA 0.498 0.163 10 0 "[ . 1 . 2]"
1 78 GLY 0.092 0.028 15 0 "[ . 1 . 2]"
1 79 ARG 1.707 0.279 7 0 "[ . 1 . 2]"
1 80 GLY 0.741 0.164 1 0 "[ . 1 . 2]"
1 81 ASP 4.396 0.361 13 0 "[ . 1 . 2]"
1 82 LEU 2.614 0.160 20 0 "[ . 1 . 2]"
1 83 TYR 1.764 0.208 8 0 "[ . 1 . 2]"
1 84 LEU 0.895 0.120 11 0 "[ . 1 . 2]"
1 85 GLU 0.829 0.163 2 0 "[ . 1 . 2]"
1 86 VAL 3.755 0.250 2 0 "[ . 1 . 2]"
1 87 ARG 0.660 0.201 4 0 "[ . 1 . 2]"
1 88 ILE 2.983 0.194 6 0 "[ . 1 . 2]"
1 89 THR 0.857 0.201 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 67 ARG HA 1 83 TYR HE1 3.630 . 5.460 4.727 3.217 5.278 . 0 0 "[ . 1 . 2]" 1
2 1 83 TYR HA 1 83 TYR HD2 2.920 . 4.040 3.582 3.227 4.153 0.113 5 0 "[ . 1 . 2]" 1
3 1 65 LYS HB2 1 83 TYR HD2 3.050 . 4.290 2.612 2.214 3.149 . 0 0 "[ . 1 . 2]" 1
4 1 27 TYR HA 1 27 TYR HE1 3.770 . 5.740 5.349 5.174 5.673 . 0 0 "[ . 1 . 2]" 1
5 1 9 TYR HD1 1 66 LEU MD2 3.240 . 4.680 4.812 4.425 5.118 0.438 16 0 "[ . 1 . 2]" 1
6 1 27 TYR HD2 1 65 LYS HD2 3.340 . 4.880 4.305 3.438 4.960 0.080 5 0 "[ . 1 . 2]" 1
7 1 8 ALA MB 1 9 TYR HD2 3.100 . 4.400 3.407 2.075 4.232 . 0 0 "[ . 1 . 2]" 1
8 1 27 TYR HD2 1 83 TYR HB3 2.920 . 4.040 3.355 2.774 3.585 . 0 0 "[ . 1 . 2]" 1
9 1 9 TYR HB3 1 9 TYR HD1 2.930 . 4.070 2.590 2.319 3.169 . 0 0 "[ . 1 . 2]" 1
10 1 9 TYR HA 1 9 TYR HD2 2.710 . 3.620 3.224 1.984 4.094 0.474 20 0 "[ . 1 . 2]" 1
11 1 27 TYR HA 1 27 TYR HD2 2.860 . 3.920 3.492 2.994 3.637 . 0 0 "[ . 1 . 2]" 1
12 1 9 TYR H 1 9 TYR HE2 3.640 . 5.480 5.074 4.477 5.513 0.033 20 0 "[ . 1 . 2]" 1
13 1 9 TYR HE2 1 66 LEU MD2 3.020 . 4.240 2.105 1.730 2.657 0.070 8 0 "[ . 1 . 2]" 1
14 1 9 TYR HE2 1 64 ARG HB2 3.320 . 4.840 4.110 3.337 4.870 0.030 16 0 "[ . 1 . 2]" 1
15 1 36 ILE MG 1 37 ALA MB 3.500 . 5.200 4.366 4.242 4.579 . 0 0 "[ . 1 . 2]" 1
16 1 32 VAL MG2 1 36 ILE MG 2.570 . 3.340 2.364 2.101 2.820 . 0 0 "[ . 1 . 2]" 1
17 1 36 ILE MG 1 56 VAL HB 3.210 . 4.620 2.819 2.385 3.431 . 0 0 "[ . 1 . 2]" 1
18 1 6 ILE MD 1 66 LEU MD1 3.440 . 5.080 2.086 1.704 3.892 0.096 12 0 "[ . 1 . 2]" 1
19 1 8 ALA MB 1 68 LEU HG 3.990 . 6.180 4.226 3.653 4.899 . 0 0 "[ . 1 . 2]" 1
20 1 8 ALA MB 1 66 LEU HG 3.700 . 5.600 4.464 4.115 4.935 . 0 0 "[ . 1 . 2]" 1
21 1 6 ILE MG 1 30 LEU MD2 3.580 . 5.360 4.328 3.709 5.199 . 0 0 "[ . 1 . 2]" 1
22 1 4 LEU HB3 1 4 LEU MD2 3.190 . 4.580 2.406 2.203 2.550 . 0 0 "[ . 1 . 2]" 1
23 1 30 LEU MD2 1 54 VAL MG1 3.260 . 4.720 3.435 2.305 3.855 . 0 0 "[ . 1 . 2]" 1
24 1 32 VAL MG1 1 86 VAL MG1 2.580 . 3.360 1.912 1.682 2.118 0.118 6 0 "[ . 1 . 2]" 1
25 1 60 THR MG 1 86 VAL MG1 2.800 . 3.800 1.882 1.821 1.954 . 0 0 "[ . 1 . 2]" 1
26 1 86 VAL MG1 1 88 ILE HG12 3.150 . 4.510 2.845 2.662 3.034 . 0 0 "[ . 1 . 2]" 1
27 1 37 ALA MB 1 86 VAL MG1 3.180 . 4.560 3.430 3.111 3.795 . 0 0 "[ . 1 . 2]" 1
28 1 30 LEU MD2 1 54 VAL MG2 3.260 . 4.720 4.558 3.547 4.890 0.170 9 0 "[ . 1 . 2]" 1
29 1 64 ARG HB2 1 86 VAL MG1 3.290 . 4.780 3.902 3.577 4.260 . 0 0 "[ . 1 . 2]" 1
30 1 30 LEU MD1 1 54 VAL MG1 3.070 . 4.340 3.024 1.958 3.603 . 0 0 "[ . 1 . 2]" 1
31 1 30 LEU MD1 1 54 VAL MG2 3.070 . 4.340 3.150 2.459 3.663 . 0 0 "[ . 1 . 2]" 1
32 1 6 ILE MD 1 30 LEU MD2 2.960 . 4.120 2.813 2.158 4.129 0.009 16 0 "[ . 1 . 2]" 1
33 1 30 LEU MD2 1 84 LEU MD1 2.820 . 3.850 2.318 2.034 2.587 . 0 0 "[ . 1 . 2]" 1
34 1 30 LEU MD2 1 84 LEU HB3 3.470 . 5.140 2.147 1.869 2.564 . 0 0 "[ . 1 . 2]" 1
35 1 6 ILE MG 1 68 LEU MD2 2.640 . 3.480 1.887 1.690 2.191 0.110 11 0 "[ . 1 . 2]" 1
36 1 66 LEU HB3 1 68 LEU MD2 3.290 . 4.780 2.703 2.118 3.331 . 0 0 "[ . 1 . 2]" 1
37 1 66 LEU HB2 1 68 LEU MD2 3.140 . 4.480 3.235 2.612 4.057 . 0 0 "[ . 1 . 2]" 1
38 1 8 ALA MB 1 68 LEU MD2 3.230 . 4.660 2.340 1.950 2.822 . 0 0 "[ . 1 . 2]" 1
39 1 6 ILE MG 1 68 LEU MD1 2.670 . 3.540 3.189 2.299 3.764 0.224 1 0 "[ . 1 . 2]" 1
40 1 68 LEU MD1 1 82 LEU MD2 3.060 . 4.320 2.845 2.151 3.662 . 0 0 "[ . 1 . 2]" 1
41 1 68 LEU HB2 1 68 LEU MD1 3.090 . 4.380 2.465 2.419 2.536 . 0 0 "[ . 1 . 2]" 1
42 1 8 ALA MB 1 68 LEU MD1 3.360 . 4.920 4.440 3.934 4.953 0.033 1 0 "[ . 1 . 2]" 1
43 1 68 LEU HB3 1 68 LEU MD1 3.090 . 4.380 2.339 2.288 2.395 . 0 0 "[ . 1 . 2]" 1
44 1 32 VAL MG2 1 43 VAL HB 3.940 . 6.080 4.223 3.961 4.505 . 0 0 "[ . 1 . 2]" 1
45 1 32 VAL MG2 1 56 VAL HB 3.240 . 4.680 3.699 3.374 4.114 . 0 0 "[ . 1 . 2]" 1
46 1 30 LEU HG 1 32 VAL MG2 4.020 . 6.240 4.500 4.243 4.762 . 0 0 "[ . 1 . 2]" 1
47 1 45 ALA MB 1 52 VAL MG1 3.530 . 5.260 4.633 4.139 4.989 . 0 0 "[ . 1 . 2]" 1
48 1 32 VAL MG2 1 60 THR MG 3.180 . 4.560 2.797 2.359 3.342 . 0 0 "[ . 1 . 2]" 1
49 1 64 ARG HB2 1 86 VAL MG2 3.020 . 4.240 2.868 2.374 3.411 . 0 0 "[ . 1 . 2]" 1
50 1 66 LEU HG 1 86 VAL MG2 3.160 . 4.520 2.474 2.175 2.841 . 0 0 "[ . 1 . 2]" 1
51 1 66 LEU HB2 1 86 VAL MG2 3.310 . 4.820 4.425 4.124 4.755 . 0 0 "[ . 1 . 2]" 1
52 1 30 LEU HG 1 86 VAL MG2 3.790 . 5.780 4.582 4.123 5.016 . 0 0 "[ . 1 . 2]" 1
53 1 66 LEU MD2 1 86 VAL MG2 2.750 . 3.700 2.428 2.012 2.780 . 0 0 "[ . 1 . 2]" 1
54 1 66 LEU MD1 1 86 VAL MG2 2.780 . 3.760 2.396 2.047 2.864 . 0 0 "[ . 1 . 2]" 1
55 1 86 VAL MG2 1 88 ILE MD 3.670 . 5.540 4.845 4.616 5.037 . 0 0 "[ . 1 . 2]" 1
56 1 30 LEU MD2 1 86 VAL MG2 3.080 . 4.360 2.576 1.911 2.916 . 0 0 "[ . 1 . 2]" 1
57 1 34 ALA MB 1 38 VAL MG2 3.120 . 4.440 3.513 3.182 3.830 . 0 0 "[ . 1 . 2]" 1
58 1 37 ALA MB 1 38 VAL MG2 2.980 . 4.160 2.865 2.534 3.062 . 0 0 "[ . 1 . 2]" 1
59 1 42 LYS HG3 1 55 ALA MB 2.860 . 3.920 3.467 2.896 3.899 . 0 0 "[ . 1 . 2]" 1
60 1 84 LEU HB3 1 84 LEU MD2 3.050 . 4.300 2.482 2.435 2.528 . 0 0 "[ . 1 . 2]" 1
61 1 68 LEU MD1 1 84 LEU HB3 3.560 . 5.320 4.621 4.383 4.961 . 0 0 "[ . 1 . 2]" 1
62 1 68 LEU MD1 1 82 LEU HB2 3.610 . 5.420 4.719 3.965 5.282 . 0 0 "[ . 1 . 2]" 1
63 1 30 LEU MD2 1 68 LEU MD1 3.380 . 4.950 4.584 4.248 4.916 . 0 0 "[ . 1 . 2]" 1
64 1 34 ALA MB 1 37 ALA MB 3.110 . 4.420 3.748 3.519 3.948 . 0 0 "[ . 1 . 2]" 1
65 1 34 ALA MB 1 88 ILE MG 2.580 . 3.360 2.420 2.156 2.761 . 0 0 "[ . 1 . 2]" 1
66 1 34 ALA MB 1 88 ILE MD 3.390 . 4.980 3.946 3.406 4.464 . 0 0 "[ . 1 . 2]" 1
67 1 36 ILE MD 1 36 ILE MG 2.670 . 3.540 1.998 1.965 2.026 . 0 0 "[ . 1 . 2]" 1
68 1 29 THR MG 1 87 ARG HG3 3.420 . 5.040 2.154 1.748 2.427 0.052 5 0 "[ . 1 . 2]" 1
69 1 29 THR MG 1 30 LEU HB2 3.740 . 5.680 5.036 4.813 5.197 . 0 0 "[ . 1 . 2]" 1
70 1 45 ALA MB 1 52 VAL HB 3.420 . 5.040 4.922 4.507 5.199 0.159 4 0 "[ . 1 . 2]" 1
71 1 45 ALA MB 1 54 VAL HB 3.410 . 5.020 3.047 2.095 3.554 . 0 0 "[ . 1 . 2]" 1
72 1 45 ALA MB 1 52 VAL MG2 2.620 . 3.440 2.461 2.029 2.785 . 0 0 "[ . 1 . 2]" 1
73 1 30 LEU MD2 1 45 ALA MB 3.450 . 5.100 4.200 3.973 4.849 . 0 0 "[ . 1 . 2]" 1
74 1 82 LEU HB3 1 84 LEU MD1 3.570 . 5.340 4.945 4.651 5.227 . 0 0 "[ . 1 . 2]" 1
75 1 68 LEU HG 1 84 LEU MD1 3.260 . 4.720 3.505 3.302 3.709 . 0 0 "[ . 1 . 2]" 1
76 1 66 LEU HB2 1 84 LEU MD1 3.400 . 5.000 3.318 3.024 3.709 . 0 0 "[ . 1 . 2]" 1
77 1 84 LEU HB3 1 84 LEU MD1 2.890 . 3.980 2.411 2.380 2.458 . 0 0 "[ . 1 . 2]" 1
78 1 60 THR MG 1 64 ARG HB3 3.960 . 6.120 5.431 4.900 5.899 . 0 0 "[ . 1 . 2]" 1
79 1 60 THR MG 1 64 ARG HB2 3.250 . 4.700 4.461 4.047 4.799 0.099 4 0 "[ . 1 . 2]" 1
80 1 60 THR MG 1 86 VAL MG2 2.700 . 3.600 2.090 1.948 2.586 . 0 0 "[ . 1 . 2]" 1
81 1 32 VAL MG1 1 60 THR MG 3.110 . 4.420 2.398 2.024 2.978 . 0 0 "[ . 1 . 2]" 1
82 1 60 THR MG 1 66 LEU MD2 3.290 . 4.780 3.220 2.227 4.126 . 0 0 "[ . 1 . 2]" 1
83 1 60 THR MG 1 88 ILE MD 3.180 . 4.560 3.602 2.926 4.447 . 0 0 "[ . 1 . 2]" 1
84 1 30 LEU MD1 1 43 VAL HB 3.410 . 5.020 4.114 3.487 4.397 . 0 0 "[ . 1 . 2]" 1
85 1 30 LEU MD1 1 45 ALA MB 2.670 . 3.540 2.132 1.806 2.784 . 0 0 "[ . 1 . 2]" 1
86 1 30 LEU MD1 1 84 LEU MD2 2.750 . 3.700 2.460 2.022 2.893 . 0 0 "[ . 1 . 2]" 1
87 1 30 LEU MD1 1 84 LEU MD1 2.920 . 4.040 1.950 1.759 2.156 0.041 13 0 "[ . 1 . 2]" 1
88 1 28 ALA MB 1 82 LEU MD1 3.070 . 4.340 2.209 1.847 2.732 . 0 0 "[ . 1 . 2]" 1
89 1 26 LEU HB2 1 82 LEU MD1 3.070 . 4.340 2.247 1.970 2.695 . 0 0 "[ . 1 . 2]" 1
90 1 26 LEU HG 1 82 LEU MD1 3.260 . 4.720 4.174 3.908 4.626 . 0 0 "[ . 1 . 2]" 1
91 1 26 LEU HB3 1 82 LEU MD1 3.070 . 4.340 3.015 2.505 3.606 . 0 0 "[ . 1 . 2]" 1
92 1 30 LEU MD2 1 43 VAL MG2 3.200 . 4.600 2.908 2.164 3.270 . 0 0 "[ . 1 . 2]" 1
93 1 64 ARG HB2 1 66 LEU MD2 3.080 . 4.360 3.681 2.887 4.198 . 0 0 "[ . 1 . 2]" 1
94 1 66 LEU HB3 1 66 LEU MD2 3.100 . 4.400 2.536 2.396 2.666 . 0 0 "[ . 1 . 2]" 1
95 1 66 LEU HB2 1 66 LEU MD2 3.010 . 4.220 3.252 3.241 3.268 . 0 0 "[ . 1 . 2]" 1
96 1 8 ALA MB 1 66 LEU MD2 3.450 . 5.100 2.651 2.099 3.266 . 0 0 "[ . 1 . 2]" 1
97 1 28 ALA MB 1 84 LEU MD2 3.000 . 4.200 2.052 1.828 2.434 . 0 0 "[ . 1 . 2]" 1
98 1 47 THR MG 1 52 VAL HB 3.750 . 5.700 4.973 4.685 5.303 . 0 0 "[ . 1 . 2]" 1
99 1 37 ALA MB 1 38 VAL MG1 3.730 . 5.660 4.919 4.705 5.049 . 0 0 "[ . 1 . 2]" 1
100 1 47 THR MG 1 52 VAL MG1 2.600 . 3.400 3.012 2.560 3.448 0.048 7 0 "[ . 1 . 2]" 1
101 1 88 ILE HG12 1 88 ILE MG 2.920 . 4.040 2.538 2.469 2.612 . 0 0 "[ . 1 . 2]" 1
102 1 88 ILE HG13 1 88 ILE MG 3.040 . 4.280 3.258 3.245 3.274 . 0 0 "[ . 1 . 2]" 1
103 1 38 VAL MG2 1 88 ILE MG 3.220 . 4.640 4.333 4.007 4.637 . 0 0 "[ . 1 . 2]" 1
104 1 32 VAL MG1 1 88 ILE MG 3.020 . 4.240 3.769 3.132 4.242 0.002 9 0 "[ . 1 . 2]" 1
105 1 30 LEU HG 1 32 VAL MG1 3.380 . 4.960 3.343 2.680 3.853 . 0 0 "[ . 1 . 2]" 1
106 1 32 VAL MG1 1 86 VAL MG2 2.860 . 3.920 3.308 3.071 3.528 . 0 0 "[ . 1 . 2]" 1
107 1 30 LEU MD2 1 32 VAL MG1 3.080 . 4.360 3.197 2.650 3.593 . 0 0 "[ . 1 . 2]" 1
108 1 37 ALA MB 1 88 ILE HB 3.750 . 5.700 4.592 4.335 4.868 . 0 0 "[ . 1 . 2]" 1
109 1 37 ALA MB 1 88 ILE HG12 2.870 . 3.940 2.393 2.199 2.616 . 0 0 "[ . 1 . 2]" 1
110 1 37 ALA MB 1 60 THR MG 2.930 . 4.070 2.962 2.633 3.705 . 0 0 "[ . 1 . 2]" 1
111 1 37 ALA MB 1 88 ILE MG 2.920 . 4.040 2.827 2.417 3.275 . 0 0 "[ . 1 . 2]" 1
112 1 32 VAL MG2 1 37 ALA MB 2.690 . 3.580 2.179 2.005 2.371 . 0 0 "[ . 1 . 2]" 1
113 1 33 PRO HD3 1 36 ILE MG 3.200 . 4.600 4.527 4.344 4.659 0.059 8 0 "[ . 1 . 2]" 1
114 1 36 ILE MG 1 86 VAL MG1 4.600 . 7.400 6.237 5.923 6.535 . 0 0 "[ . 1 . 2]" 1
115 1 30 LEU MD2 1 43 VAL MG1 3.200 . 4.600 4.195 3.398 4.680 0.080 19 0 "[ . 1 . 2]" 1
116 1 60 THR MG 1 66 LEU MD1 3.470 . 5.140 2.861 2.405 3.255 . 0 0 "[ . 1 . 2]" 1
117 1 30 LEU MD2 1 66 LEU MD1 2.930 . 4.060 2.212 1.973 2.892 . 0 0 "[ . 1 . 2]" 1
118 1 37 ALA MB 1 88 ILE MD 2.640 . 3.480 2.317 2.094 2.517 . 0 0 "[ . 1 . 2]" 1
119 1 88 ILE MD 1 88 ILE MG 2.650 . 3.500 1.973 1.945 1.993 . 0 0 "[ . 1 . 2]" 1
120 1 32 VAL MG1 1 88 ILE MD 3.130 . 4.460 3.814 3.437 4.202 . 0 0 "[ . 1 . 2]" 1
121 1 32 VAL MG2 1 88 ILE MD 3.450 . 5.100 4.530 4.075 4.809 . 0 0 "[ . 1 . 2]" 1
122 1 62 ALA MB 1 88 ILE HG13 3.130 . 4.460 2.306 1.941 2.623 . 0 0 "[ . 1 . 2]" 1
123 1 62 ALA MB 1 88 ILE MG 3.250 . 4.700 3.516 3.321 3.799 . 0 0 "[ . 1 . 2]" 1
124 1 32 VAL MG1 1 62 ALA MB 3.730 . 5.660 4.766 4.433 5.036 . 0 0 "[ . 1 . 2]" 1
125 1 62 ALA MB 1 86 VAL MG1 3.310 . 4.820 3.298 3.062 3.553 . 0 0 "[ . 1 . 2]" 1
126 1 62 ALA MB 1 88 ILE MD 3.050 . 4.290 2.366 2.024 2.540 . 0 0 "[ . 1 . 2]" 1
127 1 30 LEU MD1 1 84 LEU HB2 3.140 . 4.480 4.198 3.779 4.423 . 0 0 "[ . 1 . 2]" 1
128 1 47 THR MG 1 52 VAL MG2 2.640 . 3.480 3.178 2.878 3.626 0.146 18 0 "[ . 1 . 2]" 1
129 1 49 GLU H 1 49 GLU HG2 3.370 . 4.940 3.140 2.049 4.538 . 0 0 "[ . 1 . 2]" 1
130 1 49 GLU HA 1 49 GLU HG2 3.000 . 4.200 3.222 2.568 3.864 . 0 0 "[ . 1 . 2]" 1
131 1 42 LYS HA 1 42 LYS HD3 3.600 . 5.400 4.731 4.382 4.873 . 0 0 "[ . 1 . 2]" 1
132 1 56 VAL HA 1 57 PRO HD2 2.670 . 3.540 2.299 1.974 2.950 . 0 0 "[ . 1 . 2]" 1
133 1 6 ILE MD 1 57 PRO HD2 2.790 . 3.780 2.764 2.193 3.866 0.086 20 0 "[ . 1 . 2]" 1
134 1 70 GLY HA2 1 71 LYS HG2 3.780 . 5.760 4.890 4.680 5.310 . 0 0 "[ . 1 . 2]" 1
135 1 44 ARG HB3 1 45 ALA H 3.360 . 4.920 4.367 4.181 4.492 . 0 0 "[ . 1 . 2]" 1
136 1 69 LYS HB3 1 70 GLY H 3.220 . 4.640 2.948 2.646 3.219 . 0 0 "[ . 1 . 2]" 1
137 1 69 LYS H 1 69 LYS HB2 2.900 . 4.000 2.505 2.244 2.658 . 0 0 "[ . 1 . 2]" 1
138 1 68 LEU HA 1 69 LYS HB2 3.420 . 5.040 4.632 4.327 4.815 . 0 0 "[ . 1 . 2]" 1
139 1 65 LYS HB3 1 66 LEU H 3.340 . 4.880 3.023 2.702 3.485 . 0 0 "[ . 1 . 2]" 1
140 1 65 LYS H 1 65 LYS HB3 3.120 . 4.440 3.774 3.604 3.896 . 0 0 "[ . 1 . 2]" 1
141 1 65 LYS HB3 1 83 TYR HD2 3.310 . 4.820 2.176 1.755 2.699 0.045 15 0 "[ . 1 . 2]" 1
142 1 38 VAL HA 1 38 VAL MG2 2.570 . 3.340 2.421 2.365 2.484 . 0 0 "[ . 1 . 2]" 1
143 1 38 VAL HA 1 38 VAL MG1 2.610 . 3.410 2.500 2.430 2.562 . 0 0 "[ . 1 . 2]" 1
144 1 87 ARG HB2 1 88 ILE H 3.440 . 5.080 4.459 4.387 4.550 . 0 0 "[ . 1 . 2]" 1
145 1 86 VAL HA 1 87 ARG HB2 3.500 . 5.200 4.723 4.489 4.890 . 0 0 "[ . 1 . 2]" 1
146 1 29 THR MG 1 87 ARG HB2 3.180 . 4.560 3.353 2.879 3.784 . 0 0 "[ . 1 . 2]" 1
147 1 87 ARG HB2 1 89 THR MG 3.370 . 4.940 3.804 3.507 4.165 . 0 0 "[ . 1 . 2]" 1
148 1 52 VAL H 1 52 VAL HB 3.020 . 4.240 3.836 3.788 3.892 . 0 0 "[ . 1 . 2]" 1
149 1 52 VAL HB 1 53 GLU HA 3.540 . 5.280 4.758 4.658 4.931 . 0 0 "[ . 1 . 2]" 1
150 1 76 PRO HB2 1 77 ALA MB 3.210 . 4.620 3.891 3.223 4.484 . 0 0 "[ . 1 . 2]" 1
151 1 61 GLN HB3 1 62 ALA H 3.150 . 4.500 4.081 3.968 4.287 . 0 0 "[ . 1 . 2]" 1
152 1 71 LYS HA 1 71 LYS HG2 2.900 . 4.000 3.078 2.741 3.250 . 0 0 "[ . 1 . 2]" 1
153 1 67 ARG HA 1 68 LEU HG 3.500 . 5.200 4.187 3.975 4.347 . 0 0 "[ . 1 . 2]" 1
154 1 43 VAL HA 1 54 VAL H 3.600 . 5.400 4.823 4.544 5.097 . 0 0 "[ . 1 . 2]" 1
155 1 43 VAL HA 1 44 ARG HB3 3.530 . 5.260 4.775 4.625 4.988 . 0 0 "[ . 1 . 2]" 1
156 1 43 VAL HA 1 43 VAL MG2 2.800 . 3.800 3.264 3.249 3.275 . 0 0 "[ . 1 . 2]" 1
157 1 43 VAL HA 1 43 VAL MG1 2.800 . 3.800 2.423 2.349 2.474 . 0 0 "[ . 1 . 2]" 1
158 1 32 VAL HA 1 33 PRO HD3 2.710 . 3.620 2.427 2.369 2.508 . 0 0 "[ . 1 . 2]" 1
159 1 32 VAL MG2 1 33 PRO HD3 2.940 . 4.080 3.678 3.495 3.869 . 0 0 "[ . 1 . 2]" 1
160 1 33 PRO HD3 1 36 ILE MD 3.010 . 4.220 3.292 3.153 3.430 . 0 0 "[ . 1 . 2]" 1
161 1 38 VAL HB 1 40 GLY H 3.500 . 5.200 4.827 4.725 4.932 . 0 0 "[ . 1 . 2]" 1
162 1 64 ARG H 1 86 VAL HB 3.070 . 4.340 2.844 2.211 3.158 . 0 0 "[ . 1 . 2]" 1
163 1 35 PRO HA 1 38 VAL HB 3.000 . 4.200 3.483 3.093 3.728 . 0 0 "[ . 1 . 2]" 1
164 1 44 ARG HB2 1 51 PRO HB2 3.330 . 4.860 4.521 3.963 4.878 0.018 13 0 "[ . 1 . 2]" 1
165 1 48 LEU H 1 48 LEU HG 3.150 . 4.510 2.200 2.098 2.293 . 0 0 "[ . 1 . 2]" 1
166 1 31 ASP HA 1 32 VAL HB 3.550 . 5.300 4.748 4.610 4.953 . 0 0 "[ . 1 . 2]" 1
167 1 32 VAL HB 1 88 ILE HA 3.940 . 6.080 5.281 4.982 5.480 . 0 0 "[ . 1 . 2]" 1
168 1 32 VAL HB 1 37 ALA MB 3.310 . 4.820 4.556 4.370 4.767 . 0 0 "[ . 1 . 2]" 1
169 1 32 VAL HB 1 86 VAL MG1 3.160 . 4.520 4.135 3.783 4.350 . 0 0 "[ . 1 . 2]" 1
170 1 84 LEU HB3 1 85 GLU H 3.510 . 5.220 3.698 3.557 3.792 . 0 0 "[ . 1 . 2]" 1
171 1 29 THR HA 1 85 GLU H 2.880 . 3.960 3.046 2.658 3.658 . 0 0 "[ . 1 . 2]" 1
172 1 29 THR HA 1 85 GLU HA 3.560 . 5.320 4.881 4.486 5.215 . 0 0 "[ . 1 . 2]" 1
173 1 29 THR HA 1 30 LEU HA 3.410 . 5.020 4.482 4.458 4.516 . 0 0 "[ . 1 . 2]" 1
174 1 29 THR HA 1 29 THR MG 2.710 . 3.620 2.453 2.396 2.535 . 0 0 "[ . 1 . 2]" 1
175 1 29 THR HA 1 84 LEU MD2 3.350 . 4.900 4.621 4.192 4.925 0.025 16 0 "[ . 1 . 2]" 1
176 1 30 LEU HB2 1 84 LEU HB2 3.220 . 4.640 3.707 3.361 4.099 . 0 0 "[ . 1 . 2]" 1
177 1 30 LEU HB2 1 30 LEU MD1 2.870 . 3.940 2.393 2.340 2.436 . 0 0 "[ . 1 . 2]" 1
178 1 30 LEU HB2 1 30 LEU MD2 2.870 . 3.940 2.509 2.445 2.570 . 0 0 "[ . 1 . 2]" 1
179 1 48 LEU HB3 1 49 GLU H 3.520 . 5.240 3.958 3.668 4.181 . 0 0 "[ . 1 . 2]" 1
180 1 48 LEU HB3 1 48 LEU MD1 2.910 . 4.020 2.444 2.386 2.498 . 0 0 "[ . 1 . 2]" 1
181 1 35 PRO HD3 1 36 ILE H 3.120 . 4.440 4.177 4.002 4.346 . 0 0 "[ . 1 . 2]" 1
182 1 66 LEU HA 1 66 LEU MD2 2.610 . 3.410 2.172 2.026 2.357 . 0 0 "[ . 1 . 2]" 1
183 1 31 ASP HA 1 86 VAL HA 3.940 . 6.080 5.259 4.715 5.867 . 0 0 "[ . 1 . 2]" 1
184 1 31 ASP HA 1 87 ARG HB2 3.140 . 4.480 2.558 2.136 3.038 . 0 0 "[ . 1 . 2]" 1
185 1 31 ASP HA 1 87 ARG HG2 3.470 . 5.140 4.395 3.612 5.088 . 0 0 "[ . 1 . 2]" 1
186 1 30 LEU HB3 1 31 ASP HA 3.390 . 4.980 4.958 4.798 5.065 0.085 9 0 "[ . 1 . 2]" 1
187 1 31 ASP HA 1 89 THR MG 3.310 . 4.820 4.047 3.288 4.789 . 0 0 "[ . 1 . 2]" 1
188 1 31 ASP HA 1 86 VAL MG1 3.890 . 5.980 5.552 5.084 6.107 0.127 9 0 "[ . 1 . 2]" 1
189 1 87 ARG HA 1 88 ILE HA 3.440 . 5.080 4.488 4.435 4.516 . 0 0 "[ . 1 . 2]" 1
190 1 62 ALA HA 1 87 ARG HA 3.460 . 5.120 3.854 3.613 4.155 . 0 0 "[ . 1 . 2]" 1
191 1 62 ALA MB 1 87 ARG HA 2.960 . 4.120 3.513 2.983 3.900 . 0 0 "[ . 1 . 2]" 1
192 1 87 ARG HA 1 89 THR MG 3.290 . 4.780 4.639 4.328 4.981 0.201 4 0 "[ . 1 . 2]" 1
193 1 86 VAL MG1 1 87 ARG HA 3.190 . 4.580 3.698 3.556 3.835 . 0 0 "[ . 1 . 2]" 1
194 1 34 ALA HA 1 88 ILE HA 3.440 . 5.080 4.471 4.156 4.983 . 0 0 "[ . 1 . 2]" 1
195 1 34 ALA HA 1 88 ILE MG 2.570 . 3.340 2.030 1.807 2.331 . 0 0 "[ . 1 . 2]" 1
196 1 32 VAL MG2 1 34 ALA HA 3.460 . 5.120 4.520 4.209 4.770 . 0 0 "[ . 1 . 2]" 1
197 1 34 ALA HA 1 88 ILE MD 2.950 . 4.100 3.288 2.861 3.881 . 0 0 "[ . 1 . 2]" 1
198 1 87 ARG HA 1 88 ILE HG13 3.340 . 4.880 4.291 3.966 4.488 . 0 0 "[ . 1 . 2]" 1
199 1 33 PRO HD2 1 36 ILE HA 3.620 . 5.440 5.395 5.287 5.470 0.030 9 0 "[ . 1 . 2]" 1
200 1 32 VAL HB 1 33 PRO HD2 2.920 . 4.040 4.060 4.025 4.109 0.069 17 0 "[ . 1 . 2]" 1
201 1 33 PRO HD2 1 36 ILE HG12 3.420 . 5.040 4.811 4.681 4.885 . 0 0 "[ . 1 . 2]" 1
202 1 32 VAL MG2 1 33 PRO HD2 2.780 . 3.760 2.399 2.230 2.603 . 0 0 "[ . 1 . 2]" 1
203 1 33 PRO HD2 1 36 ILE MG 3.440 . 5.080 3.167 2.992 3.420 . 0 0 "[ . 1 . 2]" 1
204 1 65 LYS HA 1 85 GLU HA 2.920 . 4.040 2.566 2.365 3.168 . 0 0 "[ . 1 . 2]" 1
205 1 65 LYS HA 1 65 LYS HD3 2.980 . 4.160 3.263 2.575 4.167 0.007 8 0 "[ . 1 . 2]" 1
206 1 65 LYS HA 1 65 LYS HG3 3.130 . 4.460 2.496 2.397 2.608 . 0 0 "[ . 1 . 2]" 1
207 1 65 LYS HA 1 86 VAL MG2 3.460 . 5.120 3.300 2.825 3.746 . 0 0 "[ . 1 . 2]" 1
208 1 65 LYS HA 1 66 LEU MD1 3.800 . 5.800 4.796 4.323 5.299 . 0 0 "[ . 1 . 2]" 1
209 1 67 ARG HA 1 83 TYR HA 3.060 . 4.320 2.748 2.464 3.101 . 0 0 "[ . 1 . 2]" 1
210 1 83 TYR HA 1 84 LEU HB2 3.450 . 5.100 4.534 4.433 4.666 . 0 0 "[ . 1 . 2]" 1
211 1 66 LEU HB2 1 83 TYR HA 3.580 . 5.360 4.247 4.052 4.451 . 0 0 "[ . 1 . 2]" 1
212 1 82 LEU HG 1 83 TYR HA 3.740 . 5.680 4.642 4.489 4.804 . 0 0 "[ . 1 . 2]" 1
213 1 68 LEU MD2 1 83 TYR HA 3.490 . 5.180 4.956 4.445 5.325 0.145 11 0 "[ . 1 . 2]" 1
214 1 36 ILE HG12 1 37 ALA H 3.820 . 5.840 5.121 5.070 5.178 . 0 0 "[ . 1 . 2]" 1
215 1 33 PRO HD3 1 36 ILE HG12 3.900 . 6.000 6.076 5.934 6.173 0.173 5 0 "[ . 1 . 2]" 1
216 1 33 PRO HB2 1 36 ILE HG12 3.960 . 6.120 5.735 5.591 5.994 . 0 0 "[ . 1 . 2]" 1
217 1 36 ILE HG12 1 36 ILE MG 2.860 . 3.920 2.520 2.489 2.558 . 0 0 "[ . 1 . 2]" 1
218 1 65 LYS HG2 1 66 LEU H 3.480 . 5.160 4.943 4.560 5.243 0.083 6 0 "[ . 1 . 2]" 1
219 1 65 LYS H 1 65 LYS HG2 3.410 . 5.020 4.642 4.271 4.916 . 0 0 "[ . 1 . 2]" 1
220 1 65 LYS HA 1 65 LYS HG2 3.130 . 4.460 3.719 3.649 3.795 . 0 0 "[ . 1 . 2]" 1
221 1 65 LYS HG2 1 85 GLU HA 3.370 . 4.940 3.852 3.360 4.346 . 0 0 "[ . 1 . 2]" 1
222 1 39 VAL HA 1 58 PRO HB3 3.110 . 4.420 3.274 2.815 3.808 . 0 0 "[ . 1 . 2]" 1
223 1 36 ILE HA 1 40 GLY H 3.180 . 4.560 3.314 2.786 3.626 . 0 0 "[ . 1 . 2]" 1
224 1 36 ILE HA 1 39 VAL HB 3.770 . 5.740 5.128 4.699 5.878 0.138 10 0 "[ . 1 . 2]" 1
225 1 36 ILE HA 1 36 ILE HG12 2.950 . 4.100 2.526 2.450 2.640 . 0 0 "[ . 1 . 2]" 1
226 1 36 ILE HA 1 37 ALA MB 3.670 . 5.540 5.021 4.993 5.039 . 0 0 "[ . 1 . 2]" 1
227 1 32 VAL MG2 1 36 ILE HA 3.190 . 4.580 4.445 4.291 4.608 0.028 16 0 "[ . 1 . 2]" 1
228 1 36 ILE HA 1 36 ILE MD 3.340 . 4.880 3.857 3.816 3.917 . 0 0 "[ . 1 . 2]" 1
229 1 36 ILE HA 1 36 ILE MG 2.650 . 3.500 2.514 2.440 2.576 . 0 0 "[ . 1 . 2]" 1
230 1 42 LYS HA 1 42 LYS HG3 3.100 . 4.400 2.993 2.859 3.149 . 0 0 "[ . 1 . 2]" 1
231 1 42 LYS HG3 1 55 ALA HA 3.270 . 4.740 3.027 2.838 3.517 . 0 0 "[ . 1 . 2]" 1
232 1 49 GLU H 1 49 GLU HG3 3.370 . 4.940 3.334 2.282 4.556 . 0 0 "[ . 1 . 2]" 1
233 1 49 GLU HA 1 49 GLU HG3 3.000 . 4.200 3.323 2.557 3.854 . 0 0 "[ . 1 . 2]" 1
234 1 34 ALA MB 1 35 PRO HA 3.180 . 4.560 4.061 3.963 4.133 . 0 0 "[ . 1 . 2]" 1
235 1 35 PRO HA 1 38 VAL MG2 3.010 . 4.220 3.717 3.291 4.044 . 0 0 "[ . 1 . 2]" 1
236 1 42 LYS HB2 1 43 VAL H 3.220 . 4.640 4.166 4.026 4.342 . 0 0 "[ . 1 . 2]" 1
237 1 42 LYS HB2 1 55 ALA HA 3.480 . 5.160 4.646 4.392 5.205 0.045 6 0 "[ . 1 . 2]" 1
238 1 42 LYS HB2 1 43 VAL HA 3.880 . 5.960 4.952 4.773 5.203 . 0 0 "[ . 1 . 2]" 1
239 1 69 LYS HA 1 81 ASP HB2 3.480 . 5.160 4.167 2.933 4.773 . 0 0 "[ . 1 . 2]" 1
240 1 65 LYS HG3 1 66 LEU H 3.480 . 5.160 4.031 3.686 4.307 . 0 0 "[ . 1 . 2]" 1
241 1 65 LYS HG3 1 85 GLU HA 3.370 . 4.940 2.168 1.820 2.969 . 0 0 "[ . 1 . 2]" 1
242 1 43 VAL H 1 55 ALA HA 3.170 . 4.540 4.213 3.971 4.590 0.050 15 0 "[ . 1 . 2]" 1
243 1 41 GLY H 1 55 ALA HA 4.060 . 6.320 5.075 4.428 6.068 . 0 0 "[ . 1 . 2]" 1
244 1 55 ALA HA 1 56 VAL HB 3.550 . 5.300 4.594 4.489 4.694 . 0 0 "[ . 1 . 2]" 1
245 1 42 LYS HB3 1 55 ALA HA 3.370 . 4.940 4.210 3.874 4.802 . 0 0 "[ . 1 . 2]" 1
246 1 53 GLU HA 1 54 VAL HA 3.420 . 5.040 4.472 4.442 4.497 . 0 0 "[ . 1 . 2]" 1
247 1 54 VAL HA 1 55 ALA HA 3.340 . 4.880 4.443 4.384 4.484 . 0 0 "[ . 1 . 2]" 1
248 1 54 VAL HA 1 55 ALA MB 3.140 . 4.480 4.017 3.973 4.101 . 0 0 "[ . 1 . 2]" 1
249 1 29 THR MG 1 87 ARG HG2 2.820 . 3.850 2.447 2.026 2.852 . 0 0 "[ . 1 . 2]" 1
250 1 33 PRO HA 1 89 THR HA 3.390 . 4.980 4.409 4.187 4.782 . 0 0 "[ . 1 . 2]" 1
251 1 33 PRO HA 1 34 ALA HA 3.330 . 4.860 4.311 4.267 4.390 . 0 0 "[ . 1 . 2]" 1
252 1 33 PRO HA 1 35 PRO HD2 3.220 . 4.640 3.814 3.664 4.068 . 0 0 "[ . 1 . 2]" 1
253 1 33 PRO HA 1 35 PRO HD3 3.530 . 5.260 5.130 4.795 5.317 0.057 10 0 "[ . 1 . 2]" 1
254 1 33 PRO HA 1 34 ALA MB 3.270 . 4.740 4.116 4.069 4.185 . 0 0 "[ . 1 . 2]" 1
255 1 33 PRO HA 1 88 ILE MG 3.080 . 4.360 3.701 3.214 4.048 . 0 0 "[ . 1 . 2]" 1
256 1 32 VAL MG2 1 33 PRO HA 3.450 . 5.100 4.273 4.130 4.456 . 0 0 "[ . 1 . 2]" 1
257 1 47 THR HB 1 52 VAL MG1 3.170 . 4.540 2.504 2.152 3.087 . 0 0 "[ . 1 . 2]" 1
258 1 64 ARG HA 1 65 LYS HA 3.400 . 5.000 4.479 4.434 4.523 . 0 0 "[ . 1 . 2]" 1
259 1 64 ARG HA 1 65 LYS HB2 3.330 . 4.860 4.467 4.192 4.606 . 0 0 "[ . 1 . 2]" 1
260 1 64 ARG HA 1 64 ARG HB2 2.550 . 3.300 3.052 3.041 3.066 . 0 0 "[ . 1 . 2]" 1
261 1 30 LEU HA 1 30 LEU MD1 2.630 . 3.460 2.096 1.986 2.186 . 0 0 "[ . 1 . 2]" 1
262 1 30 LEU HA 1 30 LEU MD2 3.140 . 4.480 3.948 3.900 3.991 . 0 0 "[ . 1 . 2]" 1
263 1 52 VAL HA 1 53 GLU HA 3.300 . 4.800 4.437 4.393 4.468 . 0 0 "[ . 1 . 2]" 1
264 1 52 VAL HA 1 52 VAL MG1 2.580 . 3.360 2.420 2.397 2.447 . 0 0 "[ . 1 . 2]" 1
265 1 89 THR H 1 89 THR HB 3.180 . 4.560 3.721 3.623 3.815 . 0 0 "[ . 1 . 2]" 1
266 1 64 ARG HB3 1 86 VAL MG1 3.820 . 5.840 5.295 4.868 5.725 . 0 0 "[ . 1 . 2]" 1
267 1 69 LYS H 1 81 ASP HA 3.460 . 5.120 4.276 3.755 4.564 . 0 0 "[ . 1 . 2]" 1
268 1 71 LYS HG2 1 81 ASP HA 3.610 . 5.420 4.955 4.076 5.476 0.056 4 0 "[ . 1 . 2]" 1
269 1 81 ASP HA 1 82 LEU MD1 3.740 . 5.680 5.639 5.483 5.698 0.018 2 0 "[ . 1 . 2]" 1
270 1 27 TYR HD2 1 65 LYS HD3 4.120 . 6.440 5.319 4.699 6.088 . 0 0 "[ . 1 . 2]" 1
271 1 65 LYS HD3 1 85 GLU HA 3.280 . 4.760 3.545 2.299 4.870 0.110 5 0 "[ . 1 . 2]" 1
272 1 65 LYS HB2 1 65 LYS HD3 2.850 . 3.900 2.917 2.334 3.176 . 0 0 "[ . 1 . 2]" 1
273 1 61 GLN HB2 1 62 ALA H 3.150 . 4.500 4.065 3.959 4.166 . 0 0 "[ . 1 . 2]" 1
274 1 68 LEU HG 1 82 LEU HB3 3.150 . 4.510 3.730 3.041 4.355 . 0 0 "[ . 1 . 2]" 1
275 1 68 LEU MD1 1 82 LEU HB3 2.900 . 4.000 3.292 2.573 3.811 . 0 0 "[ . 1 . 2]" 1
276 1 4 LEU HA 1 4 LEU HG 2.800 . 3.800 2.936 2.493 3.705 . 0 0 "[ . 1 . 2]" 1
277 1 30 LEU MD1 1 45 ALA HA 2.950 . 4.100 3.102 2.373 3.660 . 0 0 "[ . 1 . 2]" 1
278 1 45 ALA HA 1 84 LEU MD2 3.500 . 5.200 4.727 3.339 5.212 0.012 12 0 "[ . 1 . 2]" 1
279 1 40 GLY HA3 1 58 PRO HB2 3.620 . 5.440 5.069 4.485 5.472 0.032 6 0 "[ . 1 . 2]" 1
280 1 32 VAL HA 1 33 PRO HD2 2.460 . 3.120 2.272 2.183 2.373 . 0 0 "[ . 1 . 2]" 1
281 1 32 VAL HA 1 32 VAL MG2 2.540 . 3.280 2.476 2.426 2.539 . 0 0 "[ . 1 . 2]" 1
282 1 34 ALA H 1 88 ILE HA 3.640 . 5.480 4.643 4.276 4.987 . 0 0 "[ . 1 . 2]" 1
283 1 31 ASP HA 1 88 ILE HA 4.010 . 6.220 5.275 4.460 5.830 . 0 0 "[ . 1 . 2]" 1
284 1 33 PRO HA 1 88 ILE HA 3.310 . 4.820 3.971 3.704 4.202 . 0 0 "[ . 1 . 2]" 1
285 1 32 VAL HA 1 88 ILE HA 3.800 . 5.800 5.159 4.859 5.334 . 0 0 "[ . 1 . 2]" 1
286 1 88 ILE HA 1 88 ILE HG12 3.000 . 4.200 2.470 2.358 2.572 . 0 0 "[ . 1 . 2]" 1
287 1 88 ILE HA 1 88 ILE HG13 3.070 . 4.340 3.112 3.037 3.189 . 0 0 "[ . 1 . 2]" 1
288 1 88 ILE HA 1 88 ILE MG 2.680 . 3.560 2.526 2.435 2.615 . 0 0 "[ . 1 . 2]" 1
289 1 32 VAL MG2 1 88 ILE HA 3.240 . 4.680 4.084 3.641 4.410 . 0 0 "[ . 1 . 2]" 1
290 1 88 ILE HA 1 88 ILE MD 3.030 . 4.260 3.808 3.756 3.863 . 0 0 "[ . 1 . 2]" 1
291 1 57 PRO HB2 1 58 PRO HB3 4.030 . 6.260 5.636 5.441 5.976 . 0 0 "[ . 1 . 2]" 1
292 1 6 ILE MG 1 57 PRO HB2 3.870 . 5.940 4.914 4.446 5.476 . 0 0 "[ . 1 . 2]" 1
293 1 56 VAL HA 1 57 PRO HG2 3.640 . 5.480 4.443 4.184 4.653 . 0 0 "[ . 1 . 2]" 1
294 1 56 VAL HA 1 57 PRO HG3 3.640 . 5.480 4.476 3.948 4.623 . 0 0 "[ . 1 . 2]" 1
295 1 9 TYR HB2 1 9 TYR HD1 2.930 . 4.070 3.331 2.459 3.768 . 0 0 "[ . 1 . 2]" 1
296 1 4 LEU HB3 1 4 LEU MD1 3.190 . 4.580 2.841 2.376 3.270 . 0 0 "[ . 1 . 2]" 1
297 1 5 ARG HA 1 6 ILE H 2.850 . 3.900 2.204 2.115 2.351 . 0 0 "[ . 1 . 2]" 1
298 1 5 ARG HA 1 5 ARG HG2 3.110 . 4.420 3.275 2.527 3.888 . 0 0 "[ . 1 . 2]" 1
299 1 87 ARG HG2 1 88 ILE H 3.800 . 5.800 5.347 5.143 5.472 . 0 0 "[ . 1 . 2]" 1
300 1 87 ARG HA 1 87 ARG HG2 3.070 . 4.340 3.302 2.972 3.476 . 0 0 "[ . 1 . 2]" 1
301 1 6 ILE HA 1 6 ILE HG13 3.170 . 4.540 3.094 2.891 3.844 . 0 0 "[ . 1 . 2]" 1
302 1 6 ILE HA 1 6 ILE HG12 3.170 . 4.540 2.559 2.379 3.095 . 0 0 "[ . 1 . 2]" 1
303 1 6 ILE HA 1 6 ILE MG 2.780 . 3.760 2.510 2.408 2.622 . 0 0 "[ . 1 . 2]" 1
304 1 59 ARG HA 1 60 THR H 2.850 . 3.900 3.080 2.964 3.235 . 0 0 "[ . 1 . 2]" 1
305 1 38 VAL HA 1 59 ARG HA 2.990 . 4.180 3.456 2.868 3.880 . 0 0 "[ . 1 . 2]" 1
306 1 38 VAL MG2 1 59 ARG HA 3.750 . 5.700 4.734 4.147 5.284 . 0 0 "[ . 1 . 2]" 1
307 1 38 VAL MG1 1 59 ARG HA 3.400 . 5.000 4.228 3.423 4.786 . 0 0 "[ . 1 . 2]" 1
308 1 30 LEU HB2 1 86 VAL HA 3.120 . 4.440 4.248 3.760 4.493 0.053 3 0 "[ . 1 . 2]" 1
309 1 30 LEU HB3 1 86 VAL HA 3.090 . 4.380 2.575 2.158 2.788 . 0 0 "[ . 1 . 2]" 1
310 1 86 VAL HA 1 86 VAL MG2 2.700 . 3.600 2.449 2.384 2.490 . 0 0 "[ . 1 . 2]" 1
311 1 86 VAL HA 1 86 VAL MG1 2.750 . 3.700 2.460 2.405 2.551 . 0 0 "[ . 1 . 2]" 1
312 1 29 THR HB 1 30 LEU H 2.910 . 4.020 4.167 4.045 4.272 0.252 11 0 "[ . 1 . 2]" 1
313 1 54 VAL HB 1 55 ALA H 3.200 . 4.600 4.298 4.140 4.609 0.009 16 0 "[ . 1 . 2]" 1
314 1 45 ALA HA 1 54 VAL HB 3.910 . 6.020 5.508 4.339 5.971 . 0 0 "[ . 1 . 2]" 1
315 1 53 GLU HA 1 54 VAL HB 4.040 . 6.280 4.597 4.427 4.730 . 0 0 "[ . 1 . 2]" 1
316 1 30 LEU MD2 1 54 VAL HB 3.620 . 5.440 4.305 3.587 5.459 0.019 16 0 "[ . 1 . 2]" 1
317 1 33 PRO HD2 1 36 ILE HB 3.400 . 5.000 2.350 2.248 2.452 . 0 0 "[ . 1 . 2]" 1
318 1 33 PRO HD3 1 36 ILE HB 3.310 . 4.820 4.001 3.901 4.122 . 0 0 "[ . 1 . 2]" 1
319 1 33 PRO HG2 1 36 ILE HB 2.980 . 4.160 2.330 2.124 2.536 . 0 0 "[ . 1 . 2]" 1
320 1 32 VAL MG2 1 36 ILE HB 2.800 . 3.800 2.542 2.361 2.690 . 0 0 "[ . 1 . 2]" 1
321 1 48 LEU HB2 1 49 GLU H 3.520 . 5.240 3.004 2.620 3.288 . 0 0 "[ . 1 . 2]" 1
322 1 48 LEU HB2 1 48 LEU MD1 2.910 . 4.020 2.382 2.330 2.429 . 0 0 "[ . 1 . 2]" 1
323 1 88 ILE HA 1 89 THR HA 3.350 . 4.900 4.468 4.446 4.494 . 0 0 "[ . 1 . 2]" 1
324 1 34 ALA MB 1 89 THR HA 3.590 . 5.380 4.995 4.483 5.434 0.054 2 0 "[ . 1 . 2]" 1
325 1 89 THR HA 1 89 THR MG 2.530 . 3.260 2.362 2.329 2.411 . 0 0 "[ . 1 . 2]" 1
326 1 42 LYS HA 1 54 VAL H 3.370 . 4.940 4.245 3.782 4.735 . 0 0 "[ . 1 . 2]" 1
327 1 42 LYS HA 1 55 ALA HA 2.760 . 3.720 2.542 2.176 2.976 . 0 0 "[ . 1 . 2]" 1
328 1 42 LYS HA 1 54 VAL HA 4.030 . 6.260 5.153 4.708 5.500 . 0 0 "[ . 1 . 2]" 1
329 1 42 LYS HA 1 43 VAL MG2 3.440 . 5.080 3.854 3.663 4.004 . 0 0 "[ . 1 . 2]" 1
330 1 42 LYS HA 1 43 VAL MG1 3.440 . 5.080 3.733 3.430 3.914 . 0 0 "[ . 1 . 2]" 1
331 1 26 LEU HA 1 27 TYR HA 3.630 . 5.460 4.500 4.429 4.546 . 0 0 "[ . 1 . 2]" 1
332 1 27 TYR HA 1 82 LEU HA 3.740 . 5.680 4.324 3.705 4.705 . 0 0 "[ . 1 . 2]" 1
333 1 27 TYR HA 1 83 TYR HB3 3.320 . 4.840 3.844 3.480 4.153 . 0 0 "[ . 1 . 2]" 1
334 1 27 TYR HA 1 28 ALA MB 3.420 . 5.040 3.983 3.850 4.059 . 0 0 "[ . 1 . 2]" 1
335 1 27 TYR HA 1 82 LEU MD1 3.140 . 4.480 3.619 3.152 4.139 . 0 0 "[ . 1 . 2]" 1
336 1 53 GLU HA 1 53 GLU HG2 3.120 . 4.440 2.976 2.479 3.827 . 0 0 "[ . 1 . 2]" 1
337 1 39 VAL HB 1 40 GLY H 3.180 . 4.560 4.135 3.989 4.236 . 0 0 "[ . 1 . 2]" 1
338 1 39 VAL H 1 39 VAL HB 2.910 . 4.020 3.000 2.505 3.767 . 0 0 "[ . 1 . 2]" 1
339 1 25 ASP HA 1 80 GLY H 3.660 . 5.520 5.062 4.604 5.541 0.021 18 0 "[ . 1 . 2]" 1
340 1 25 ASP HA 1 81 ASP HA 3.370 . 4.940 4.524 4.205 4.804 . 0 0 "[ . 1 . 2]" 1
341 1 25 ASP HA 1 80 GLY HA2 3.530 . 5.260 4.274 3.646 4.764 . 0 0 "[ . 1 . 2]" 1
342 1 25 ASP HA 1 80 GLY HA3 3.530 . 5.260 3.091 2.778 3.633 . 0 0 "[ . 1 . 2]" 1
343 1 68 LEU HA 1 68 LEU MD1 3.080 . 4.360 3.885 3.837 3.944 . 0 0 "[ . 1 . 2]" 1
344 1 60 THR HA 1 61 GLN HA 3.360 . 4.920 4.462 4.428 4.525 . 0 0 "[ . 1 . 2]" 1
345 1 59 ARG HB2 1 60 THR HA 3.420 . 5.040 4.504 4.172 4.759 . 0 0 "[ . 1 . 2]" 1
346 1 60 THR HA 1 64 ARG HB2 3.500 . 5.200 4.852 4.455 5.173 . 0 0 "[ . 1 . 2]" 1
347 1 37 ALA MB 1 60 THR HA 3.530 . 5.260 4.623 4.401 4.779 . 0 0 "[ . 1 . 2]" 1
348 1 60 THR HA 1 60 THR MG 2.670 . 3.540 2.461 2.270 2.539 . 0 0 "[ . 1 . 2]" 1
349 1 60 THR HA 1 66 LEU MD1 3.680 . 5.560 4.812 4.159 5.678 0.118 1 0 "[ . 1 . 2]" 1
350 1 60 THR HA 1 86 VAL MG1 3.450 . 5.100 3.878 3.560 4.186 . 0 0 "[ . 1 . 2]" 1
351 1 57 PRO HB2 1 58 PRO HD2 3.010 . 4.220 2.517 2.294 3.304 . 0 0 "[ . 1 . 2]" 1
352 1 33 PRO HB3 1 35 PRO HD2 2.790 . 3.780 3.593 3.517 3.724 . 0 0 "[ . 1 . 2]" 1
353 1 34 ALA MB 1 35 PRO HD2 2.550 . 3.300 2.993 2.792 3.293 . 0 0 "[ . 1 . 2]" 1
354 1 35 PRO HD2 1 88 ILE MG 3.460 . 5.120 4.919 4.582 5.300 0.180 13 0 "[ . 1 . 2]" 1
355 1 66 LEU HB2 1 66 LEU MD1 2.770 . 3.740 2.438 2.328 2.543 . 0 0 "[ . 1 . 2]" 1
356 1 6 ILE HB 1 7 ALA HA 3.840 . 5.880 4.685 4.070 5.501 . 0 0 "[ . 1 . 2]" 1
357 1 6 ILE MG 1 7 ALA HA 3.410 . 5.020 3.907 3.320 4.306 . 0 0 "[ . 1 . 2]" 1
358 1 84 LEU HA 1 85 GLU H 2.740 . 3.680 2.106 2.045 2.145 . 0 0 "[ . 1 . 2]" 1
359 1 30 LEU MD1 1 84 LEU HA 3.480 . 5.160 4.617 4.175 5.048 . 0 0 "[ . 1 . 2]" 1
360 1 84 LEU HA 1 84 LEU MD2 2.670 . 3.540 1.972 1.924 2.013 . 0 0 "[ . 1 . 2]" 1
361 1 24 GLN HG3 1 80 GLY H 3.680 . 5.560 4.620 3.497 5.724 0.164 1 0 "[ . 1 . 2]" 1
362 1 33 PRO HB3 1 34 ALA H 3.410 . 5.020 3.641 3.561 3.726 . 0 0 "[ . 1 . 2]" 1
363 1 33 PRO HB3 1 36 ILE H 3.350 . 4.900 4.973 4.898 5.027 0.127 15 0 "[ . 1 . 2]" 1
364 1 33 PRO HB3 1 35 PRO HD3 3.400 . 5.000 5.072 4.925 5.140 0.140 18 0 "[ . 1 . 2]" 1
365 1 33 PRO HB3 1 36 ILE MD 3.150 . 4.510 4.511 4.434 4.565 0.055 9 0 "[ . 1 . 2]" 1
366 1 68 LEU HG 1 84 LEU HB2 3.640 . 5.480 4.001 3.751 4.245 . 0 0 "[ . 1 . 2]" 1
367 1 66 LEU HB2 1 84 LEU HB2 2.950 . 4.100 1.981 1.774 2.193 0.026 3 0 "[ . 1 . 2]" 1
368 1 84 LEU HB2 1 86 VAL MG2 3.490 . 5.180 4.411 3.953 4.869 . 0 0 "[ . 1 . 2]" 1
369 1 84 LEU HB2 1 84 LEU MD1 2.760 . 3.720 2.404 2.369 2.450 . 0 0 "[ . 1 . 2]" 1
370 1 30 LEU MD2 1 84 LEU HB2 3.290 . 4.780 2.951 2.722 3.184 . 0 0 "[ . 1 . 2]" 1
371 1 42 LYS HA 1 42 LYS HD2 3.600 . 5.400 4.492 4.344 4.708 . 0 0 "[ . 1 . 2]" 1
372 1 87 ARG HA 1 88 ILE HB 3.490 . 5.180 4.665 4.525 4.787 . 0 0 "[ . 1 . 2]" 1
373 1 34 ALA HA 1 88 ILE HB 3.680 . 5.560 4.928 4.791 5.121 . 0 0 "[ . 1 . 2]" 1
374 1 62 ALA MB 1 88 ILE HB 2.710 . 3.620 2.147 1.886 2.512 . 0 0 "[ . 1 . 2]" 1
375 1 88 ILE HB 1 88 ILE MD 2.930 . 4.060 2.529 2.465 2.617 . 0 0 "[ . 1 . 2]" 1
376 1 82 LEU HA 1 82 LEU HG 2.980 . 4.160 3.069 3.020 3.143 . 0 0 "[ . 1 . 2]" 1
377 1 82 LEU HA 1 82 LEU MD1 2.750 . 3.700 2.131 2.097 2.188 . 0 0 "[ . 1 . 2]" 1
378 1 46 MET H 1 51 PRO HA 3.690 . 5.580 4.926 4.197 5.235 . 0 0 "[ . 1 . 2]" 1
379 1 51 PRO HA 1 52 VAL HA 3.340 . 4.880 4.504 4.482 4.519 . 0 0 "[ . 1 . 2]" 1
380 1 47 THR MG 1 51 PRO HA 4.030 . 6.260 5.974 5.442 6.350 0.090 2 0 "[ . 1 . 2]" 1
381 1 51 PRO HA 1 52 VAL MG2 3.090 . 4.380 3.802 3.571 3.969 . 0 0 "[ . 1 . 2]" 1
382 1 70 GLY HA3 1 72 GLY H 3.860 . 5.920 5.175 4.685 5.451 . 0 0 "[ . 1 . 2]" 1
383 1 70 GLY HA3 1 71 LYS HG2 3.250 . 4.700 4.115 3.769 4.388 . 0 0 "[ . 1 . 2]" 1
384 1 58 PRO HA 1 59 ARG H 2.580 . 3.360 2.437 2.324 2.548 . 0 0 "[ . 1 . 2]" 1
385 1 39 VAL HA 1 58 PRO HA 3.250 . 4.700 3.990 3.516 4.412 . 0 0 "[ . 1 . 2]" 1
386 1 40 GLY HA3 1 58 PRO HA 3.070 . 4.340 3.074 2.509 3.494 . 0 0 "[ . 1 . 2]" 1
387 1 58 PRO HA 1 60 THR MG 3.760 . 5.720 5.685 5.474 5.802 0.082 2 0 "[ . 1 . 2]" 1
388 1 60 THR HB 1 61 GLN HA 3.780 . 5.760 5.220 5.002 5.350 . 0 0 "[ . 1 . 2]" 1
389 1 61 GLN HA 1 62 ALA MB 3.130 . 4.460 4.017 3.949 4.088 . 0 0 "[ . 1 . 2]" 1
390 1 61 GLN HA 1 88 ILE HG13 3.220 . 4.640 4.001 3.546 4.474 . 0 0 "[ . 1 . 2]" 1
391 1 61 GLN HA 1 88 ILE MD 2.920 . 4.040 2.091 1.817 2.427 . 0 0 "[ . 1 . 2]" 1
392 1 42 LYS HB3 1 43 VAL HA 3.570 . 5.340 4.349 4.169 4.589 . 0 0 "[ . 1 . 2]" 1
393 1 65 LYS H 1 65 LYS HD2 3.510 . 5.220 4.459 3.096 5.190 . 0 0 "[ . 1 . 2]" 1
394 1 65 LYS HA 1 65 LYS HD2 3.390 . 4.980 4.149 3.339 4.645 . 0 0 "[ . 1 . 2]" 1
395 1 65 LYS HD2 1 85 GLU HA 3.330 . 4.860 3.607 2.769 4.160 . 0 0 "[ . 1 . 2]" 1
396 1 65 LYS HB2 1 65 LYS HD2 3.060 . 4.320 3.698 3.123 3.818 . 0 0 "[ . 1 . 2]" 1
397 1 74 PRO HA 1 80 GLY H 3.320 . 4.840 3.775 3.279 4.126 . 0 0 "[ . 1 . 2]" 1
398 1 74 PRO HA 1 79 ARG HG3 3.130 . 4.460 2.825 2.327 3.389 . 0 0 "[ . 1 . 2]" 1
399 1 56 VAL HA 1 57 PRO HD3 2.670 . 3.540 2.416 1.873 2.710 . 0 0 "[ . 1 . 2]" 1
400 1 6 ILE MD 1 57 PRO HD3 2.790 . 3.780 2.597 1.844 3.829 0.049 16 0 "[ . 1 . 2]" 1
401 1 43 VAL H 1 53 GLU HA 3.460 . 5.120 3.927 3.559 4.640 . 0 0 "[ . 1 . 2]" 1
402 1 44 ARG HB2 1 45 ALA H 3.240 . 4.680 4.393 4.062 4.539 . 0 0 "[ . 1 . 2]" 1
403 1 44 ARG H 1 44 ARG HB2 2.790 . 3.780 2.696 2.561 2.852 . 0 0 "[ . 1 . 2]" 1
404 1 43 VAL HA 1 44 ARG HB2 3.530 . 5.260 4.576 4.358 4.713 . 0 0 "[ . 1 . 2]" 1
405 1 37 ALA HA 1 60 THR H 3.320 . 4.840 4.004 3.505 4.215 . 0 0 "[ . 1 . 2]" 1
406 1 36 ILE H 1 37 ALA HA 3.840 . 5.880 5.219 5.137 5.315 . 0 0 "[ . 1 . 2]" 1
407 1 34 ALA HA 1 37 ALA HA 4.070 . 6.340 5.303 5.021 5.570 . 0 0 "[ . 1 . 2]" 1
408 1 37 ALA HA 1 60 THR HB 2.820 . 3.850 2.177 1.972 2.434 . 0 0 "[ . 1 . 2]" 1
409 1 36 ILE HA 1 37 ALA HA 3.520 . 5.240 4.850 4.812 4.871 . 0 0 "[ . 1 . 2]" 1
410 1 32 VAL HB 1 37 ALA HA 3.420 . 5.040 5.000 4.850 5.106 0.066 13 0 "[ . 1 . 2]" 1
411 1 37 ALA HA 1 60 THR MG 3.020 . 4.240 3.119 2.935 3.432 . 0 0 "[ . 1 . 2]" 1
412 1 37 ALA HA 1 88 ILE MD 3.380 . 4.950 4.577 4.230 4.837 . 0 0 "[ . 1 . 2]" 1
413 1 36 ILE MG 1 37 ALA HA 3.330 . 4.860 3.712 3.574 3.923 . 0 0 "[ . 1 . 2]" 1
414 1 6 ILE H 1 6 ILE HG13 3.420 . 5.040 2.455 2.069 3.710 . 0 0 "[ . 1 . 2]" 1
415 1 36 ILE HG13 1 37 ALA H 3.420 . 5.040 4.456 4.348 4.553 . 0 0 "[ . 1 . 2]" 1
416 1 33 PRO HD2 1 36 ILE HG13 3.480 . 5.160 3.880 3.679 4.046 . 0 0 "[ . 1 . 2]" 1
417 1 36 ILE HA 1 36 ILE HG13 2.850 . 3.900 3.127 3.065 3.198 . 0 0 "[ . 1 . 2]" 1
418 1 33 PRO HB2 1 36 ILE HG13 3.500 . 5.200 3.994 3.842 4.245 . 0 0 "[ . 1 . 2]" 1
419 1 36 ILE HG13 1 36 ILE MG 2.820 . 3.840 3.252 3.241 3.260 . 0 0 "[ . 1 . 2]" 1
420 1 57 PRO HB2 1 58 PRO HD3 3.010 . 4.220 3.778 3.297 4.012 . 0 0 "[ . 1 . 2]" 1
421 1 48 LEU HA 1 50 GLY H 3.240 . 4.680 3.734 3.417 4.305 . 0 0 "[ . 1 . 2]" 1
422 1 48 LEU HA 1 48 LEU MD2 2.540 . 3.280 2.105 2.026 2.185 . 0 0 "[ . 1 . 2]" 1
423 1 69 LYS HA 1 81 ASP HA 3.080 . 4.360 2.122 1.909 2.436 . 0 0 "[ . 1 . 2]" 1
424 1 68 LEU HA 1 69 LYS HA 3.500 . 5.200 4.497 4.421 4.530 . 0 0 "[ . 1 . 2]" 1
425 1 69 LYS HA 1 70 GLY HA3 3.480 . 5.160 4.515 4.465 4.572 . 0 0 "[ . 1 . 2]" 1
426 1 69 LYS HA 1 70 GLY HA2 3.480 . 5.160 4.458 4.380 4.557 . 0 0 "[ . 1 . 2]" 1
427 1 69 LYS HA 1 81 ASP HB3 3.480 . 5.160 3.206 2.010 4.671 . 0 0 "[ . 1 . 2]" 1
428 1 69 LYS HA 1 69 LYS HG2 3.070 . 4.340 2.465 2.263 2.640 . 0 0 "[ . 1 . 2]" 1
429 1 69 LYS HA 1 69 LYS HG3 3.060 . 4.320 3.247 2.734 3.783 . 0 0 "[ . 1 . 2]" 1
430 1 33 PRO HB2 1 35 PRO HD2 3.060 . 4.320 1.921 1.801 2.012 . 0 0 "[ . 1 . 2]" 1
431 1 33 PRO HB2 1 35 PRO HD3 3.020 . 4.240 3.526 3.414 3.674 . 0 0 "[ . 1 . 2]" 1
432 1 33 PRO HB2 1 36 ILE MD 3.250 . 4.700 4.297 4.173 4.507 . 0 0 "[ . 1 . 2]" 1
433 1 62 ALA HA 1 63 GLY HA2 3.380 . 4.950 4.445 4.376 4.496 . 0 0 "[ . 1 . 2]" 1
434 1 62 ALA HA 1 63 GLY HA3 3.380 . 4.950 4.499 4.460 4.531 . 0 0 "[ . 1 . 2]" 1
435 1 62 ALA HA 1 86 VAL HB 3.070 . 4.340 2.895 2.538 3.233 . 0 0 "[ . 1 . 2]" 1
436 1 62 ALA HA 1 88 ILE HB 3.230 . 4.660 4.134 3.836 4.680 0.020 5 0 "[ . 1 . 2]" 1
437 1 62 ALA HA 1 88 ILE HG13 3.030 . 4.260 2.630 2.462 2.700 . 0 0 "[ . 1 . 2]" 1
438 1 62 ALA HA 1 86 VAL MG2 3.810 . 5.820 4.317 4.037 4.595 . 0 0 "[ . 1 . 2]" 1
439 1 62 ALA HA 1 88 ILE MG 3.970 . 6.140 5.200 4.981 5.452 . 0 0 "[ . 1 . 2]" 1
440 1 62 ALA HA 1 86 VAL MG1 2.790 . 3.780 2.196 1.967 2.450 . 0 0 "[ . 1 . 2]" 1
441 1 34 ALA MB 1 35 PRO HD3 2.710 . 3.620 2.239 1.938 2.565 . 0 0 "[ . 1 . 2]" 1
442 1 87 ARG HB3 1 88 ILE H 3.260 . 4.720 3.966 3.841 4.075 . 0 0 "[ . 1 . 2]" 1
443 1 31 ASP HA 1 87 ARG HB3 3.130 . 4.460 4.074 3.564 4.458 . 0 0 "[ . 1 . 2]" 1
444 1 29 THR MG 1 87 ARG HB3 3.310 . 4.820 3.995 3.498 4.312 . 0 0 "[ . 1 . 2]" 1
445 1 53 GLU HA 1 53 GLU HG3 3.120 . 4.440 3.341 2.593 3.909 . 0 0 "[ . 1 . 2]" 1
446 1 38 VAL HA 1 39 VAL HA 3.600 . 5.400 4.698 4.650 4.753 . 0 0 "[ . 1 . 2]" 1
447 1 39 VAL HA 1 39 VAL HB 2.560 . 3.320 2.486 2.406 2.550 . 0 0 "[ . 1 . 2]" 1
448 1 38 VAL HB 1 39 VAL HA 3.420 . 5.040 4.414 4.292 4.558 . 0 0 "[ . 1 . 2]" 1
449 1 39 VAL HA 1 58 PRO HB2 3.280 . 4.760 4.457 4.058 4.910 0.150 4 0 "[ . 1 . 2]" 1
450 1 4 LEU HB2 1 4 LEU MD1 3.190 . 4.580 2.413 2.326 2.653 . 0 0 "[ . 1 . 2]" 1
451 1 4 LEU HB2 1 4 LEU MD2 3.190 . 4.580 2.904 2.288 3.287 . 0 0 "[ . 1 . 2]" 1
452 1 66 LEU HB3 1 66 LEU MD1 2.810 . 3.820 2.418 2.332 2.507 . 0 0 "[ . 1 . 2]" 1
453 1 67 ARG HA 1 68 LEU MD2 3.110 . 4.420 4.094 3.680 4.279 . 0 0 "[ . 1 . 2]" 1
454 1 66 LEU HG 1 84 LEU H 3.490 . 5.180 4.040 3.639 4.476 . 0 0 "[ . 1 . 2]" 1
455 1 65 LYS HA 1 66 LEU HG 3.330 . 4.860 3.347 2.778 3.896 . 0 0 "[ . 1 . 2]" 1
456 1 66 LEU HG 1 85 GLU HA 3.800 . 5.800 4.754 4.372 5.178 . 0 0 "[ . 1 . 2]" 1
457 1 5 ARG HA 1 5 ARG HG3 3.110 . 4.420 3.527 2.675 3.897 . 0 0 "[ . 1 . 2]" 1
458 1 68 LEU H 1 69 LYS H 3.210 . 4.620 4.031 3.912 4.210 . 0 0 "[ . 1 . 2]" 1
459 1 68 LEU H 1 82 LEU H 3.050 . 4.300 2.603 2.257 2.967 . 0 0 "[ . 1 . 2]" 1
460 1 68 LEU H 1 83 TYR HE1 3.960 . 6.120 5.829 4.701 6.180 0.060 18 0 "[ . 1 . 2]" 1
461 1 68 LEU H 1 83 TYR HA 3.090 . 4.380 3.485 3.279 3.744 . 0 0 "[ . 1 . 2]" 1
462 1 67 ARG HA 1 68 LEU H 2.560 . 3.320 2.184 2.147 2.256 . 0 0 "[ . 1 . 2]" 1
463 1 68 LEU H 1 69 LYS HA 3.540 . 5.280 4.812 4.671 5.021 . 0 0 "[ . 1 . 2]" 1
464 1 68 LEU H 1 68 LEU HG 2.670 . 3.540 2.714 2.511 2.945 . 0 0 "[ . 1 . 2]" 1
465 1 68 LEU H 1 82 LEU HB2 3.510 . 5.220 4.885 4.566 5.051 . 0 0 "[ . 1 . 2]" 1
466 1 68 LEU H 1 68 LEU MD2 2.610 . 3.420 3.171 2.845 3.429 0.009 11 0 "[ . 1 . 2]" 1
467 1 65 LYS H 1 66 LEU H 3.540 . 5.280 4.387 4.185 4.566 . 0 0 "[ . 1 . 2]" 1
468 1 66 LEU H 1 84 LEU H 2.910 . 4.020 2.473 2.173 2.929 . 0 0 "[ . 1 . 2]" 1
469 1 65 LYS HA 1 66 LEU H 2.500 . 3.200 2.188 2.092 2.278 . 0 0 "[ . 1 . 2]" 1
470 1 66 LEU H 1 85 GLU HA 3.080 . 4.360 4.019 3.650 4.429 0.069 15 0 "[ . 1 . 2]" 1
471 1 66 LEU H 1 83 TYR HB3 3.550 . 5.300 3.857 3.398 4.662 . 0 0 "[ . 1 . 2]" 1
472 1 65 LYS HB2 1 66 LEU H 3.380 . 4.960 4.129 3.869 4.452 . 0 0 "[ . 1 . 2]" 1
473 1 66 LEU H 1 66 LEU HG 2.460 . 3.120 2.481 2.226 2.740 . 0 0 "[ . 1 . 2]" 1
474 1 66 LEU H 1 66 LEU HB2 2.740 . 3.680 2.629 2.512 2.732 . 0 0 "[ . 1 . 2]" 1
475 1 66 LEU H 1 86 VAL MG2 3.100 . 4.400 3.875 3.033 4.475 0.075 5 0 "[ . 1 . 2]" 1
476 1 66 LEU H 1 84 LEU HB3 3.300 . 4.800 4.355 4.082 4.670 . 0 0 "[ . 1 . 2]" 1
477 1 66 LEU H 1 66 LEU MD1 3.170 . 4.540 3.878 3.684 4.086 . 0 0 "[ . 1 . 2]" 1
478 1 66 LEU H 1 66 LEU MD2 2.810 . 3.820 3.180 2.524 3.718 . 0 0 "[ . 1 . 2]" 1
479 1 66 LEU H 1 83 TYR HA 3.350 . 4.900 3.378 2.902 4.123 . 0 0 "[ . 1 . 2]" 1
480 1 30 LEU MD2 1 66 LEU H 3.700 . 5.600 5.014 4.496 5.505 . 0 0 "[ . 1 . 2]" 1
481 1 69 LYS H 1 70 GLY H 3.510 . 5.220 4.616 4.560 4.656 . 0 0 "[ . 1 . 2]" 1
482 1 70 GLY H 1 82 LEU H 3.680 . 5.560 4.987 4.305 5.344 . 0 0 "[ . 1 . 2]" 1
483 1 70 GLY H 1 81 ASP HA 2.930 . 4.070 3.111 2.644 3.492 . 0 0 "[ . 1 . 2]" 1
484 1 69 LYS HA 1 70 GLY H 2.480 . 3.160 2.222 2.108 2.338 . 0 0 "[ . 1 . 2]" 1
485 1 69 LYS HG2 1 70 GLY H 3.320 . 4.840 4.184 3.238 4.716 . 0 0 "[ . 1 . 2]" 1
486 1 70 GLY H 1 71 LYS HG2 3.400 . 5.000 4.563 4.071 4.992 . 0 0 "[ . 1 . 2]" 1
487 1 62 ALA H 1 63 GLY H 3.440 . 5.080 4.577 4.494 4.636 . 0 0 "[ . 1 . 2]" 1
488 1 63 GLY H 1 87 ARG HA 3.220 . 4.640 3.969 3.644 4.417 . 0 0 "[ . 1 . 2]" 1
489 1 63 GLY H 1 64 ARG HA 3.770 . 5.740 5.156 5.002 5.305 . 0 0 "[ . 1 . 2]" 1
490 1 62 ALA HA 1 63 GLY H 2.460 . 3.120 2.177 2.134 2.226 . 0 0 "[ . 1 . 2]" 1
491 1 63 GLY H 1 86 VAL HB 2.870 . 3.940 2.926 2.154 3.349 . 0 0 "[ . 1 . 2]" 1
492 1 62 ALA MB 1 63 GLY H 2.790 . 3.780 2.976 2.706 3.235 . 0 0 "[ . 1 . 2]" 1
493 1 63 GLY H 1 88 ILE HG13 3.190 . 4.580 4.692 4.413 4.774 0.194 6 0 "[ . 1 . 2]" 1
494 1 63 GLY H 1 86 VAL MG2 3.560 . 5.320 4.492 3.791 4.859 . 0 0 "[ . 1 . 2]" 1
495 1 32 VAL MG1 1 63 GLY H 4.130 . 6.460 5.818 5.461 6.049 . 0 0 "[ . 1 . 2]" 1
496 1 63 GLY H 1 86 VAL MG1 3.110 . 4.420 3.491 3.172 3.787 . 0 0 "[ . 1 . 2]" 1
497 1 40 GLY H 1 41 GLY H 3.290 . 4.780 3.890 2.894 4.509 . 0 0 "[ . 1 . 2]" 1
498 1 41 GLY H 1 42 LYS HA 3.490 . 5.180 4.721 4.482 4.945 . 0 0 "[ . 1 . 2]" 1
499 1 40 GLY HA2 1 41 GLY H 2.590 . 3.380 2.296 2.171 2.593 . 0 0 "[ . 1 . 2]" 1
500 1 40 GLY HA3 1 41 GLY H 2.780 . 3.760 3.093 2.544 3.544 . 0 0 "[ . 1 . 2]" 1
501 1 41 GLY H 1 56 VAL HB 2.640 . 3.480 2.690 2.000 3.309 . 0 0 "[ . 1 . 2]" 1
502 1 36 ILE HG12 1 41 GLY H 4.130 . 6.460 5.309 4.127 6.362 . 0 0 "[ . 1 . 2]" 1
503 1 36 ILE MG 1 41 GLY H 2.860 . 3.920 2.656 1.873 3.457 . 0 0 "[ . 1 . 2]" 1
504 1 70 GLY H 1 72 GLY H 3.250 . 4.700 3.746 3.337 4.020 . 0 0 "[ . 1 . 2]" 1
505 1 72 GLY H 1 81 ASP H 3.550 . 5.300 4.155 3.816 4.505 . 0 0 "[ . 1 . 2]" 1
506 1 71 LYS H 1 72 GLY H 2.700 . 3.600 2.021 1.857 2.474 . 0 0 "[ . 1 . 2]" 1
507 1 72 GLY H 1 81 ASP HA 3.020 . 4.240 3.352 2.797 3.751 . 0 0 "[ . 1 . 2]" 1
508 1 70 GLY HA2 1 72 GLY H 3.380 . 4.960 4.256 3.920 4.663 . 0 0 "[ . 1 . 2]" 1
509 1 72 GLY H 1 82 LEU MD1 3.190 . 4.580 4.673 4.613 4.740 0.160 20 0 "[ . 1 . 2]" 1
510 1 24 GLN HG2 1 80 GLY H 3.680 . 5.560 4.436 2.941 5.616 0.056 16 0 "[ . 1 . 2]" 1
511 1 9 TYR HA 1 10 GLY H 2.850 . 3.900 2.902 2.114 3.597 . 0 0 "[ . 1 . 2]" 1
512 1 9 TYR HB2 1 10 GLY H 3.400 . 5.000 3.960 2.386 4.580 . 0 0 "[ . 1 . 2]" 1
513 1 9 TYR HB3 1 10 GLY H 3.400 . 5.000 4.062 2.811 4.511 . 0 0 "[ . 1 . 2]" 1
514 1 75 GLY H 1 80 GLY H 3.420 . 5.040 4.608 3.693 5.150 0.110 3 0 "[ . 1 . 2]" 1
515 1 75 GLY H 1 78 GLY H 3.010 . 4.220 3.680 3.238 3.996 . 0 0 "[ . 1 . 2]" 1
516 1 74 PRO HA 1 75 GLY H 2.430 . 3.060 2.225 2.130 2.323 . 0 0 "[ . 1 . 2]" 1
517 1 74 PRO HB3 1 75 GLY H 3.140 . 4.480 3.678 3.327 4.050 . 0 0 "[ . 1 . 2]" 1
518 1 74 PRO HB2 1 75 GLY H 3.140 . 4.480 3.450 2.814 4.046 . 0 0 "[ . 1 . 2]" 1
519 1 75 GLY H 1 79 ARG HG3 3.160 . 4.520 4.339 3.510 4.630 0.110 18 0 "[ . 1 . 2]" 1
520 1 47 THR HB 1 50 GLY H 2.960 . 4.120 3.465 2.932 4.150 0.030 6 0 "[ . 1 . 2]" 1
521 1 47 THR MG 1 50 GLY H 3.610 . 5.420 3.893 3.268 4.488 . 0 0 "[ . 1 . 2]" 1
522 1 77 ALA H 1 78 GLY H 2.540 . 3.280 2.590 1.894 2.894 . 0 0 "[ . 1 . 2]" 1
523 1 77 ALA HA 1 78 GLY H 2.820 . 3.840 3.118 3.000 3.498 . 0 0 "[ . 1 . 2]" 1
524 1 77 ALA MB 1 78 GLY H 2.810 . 3.820 3.511 2.956 3.657 . 0 0 "[ . 1 . 2]" 1
525 1 37 ALA H 1 38 VAL H 2.640 . 3.480 2.674 2.615 2.761 . 0 0 "[ . 1 . 2]" 1
526 1 38 VAL H 1 39 VAL H 2.640 . 3.480 2.735 2.577 2.799 . 0 0 "[ . 1 . 2]" 1
527 1 35 PRO HA 1 38 VAL H 2.930 . 4.060 3.847 3.640 4.055 . 0 0 "[ . 1 . 2]" 1
528 1 34 ALA HA 1 38 VAL H 3.310 . 4.820 4.198 3.890 4.423 . 0 0 "[ . 1 . 2]" 1
529 1 38 VAL H 1 60 THR HB 3.830 . 5.860 4.831 4.618 5.224 . 0 0 "[ . 1 . 2]" 1
530 1 36 ILE HA 1 38 VAL H 3.340 . 4.880 4.529 4.271 4.747 . 0 0 "[ . 1 . 2]" 1
531 1 38 VAL H 1 38 VAL HB 2.480 . 3.160 2.509 2.439 2.585 . 0 0 "[ . 1 . 2]" 1
532 1 37 ALA MB 1 38 VAL H 2.570 . 3.340 2.458 2.309 2.623 . 0 0 "[ . 1 . 2]" 1
533 1 38 VAL H 1 38 VAL MG2 2.380 . 2.970 2.164 2.078 2.265 . 0 0 "[ . 1 . 2]" 1
534 1 38 VAL H 1 38 VAL MG1 2.970 . 4.140 3.813 3.785 3.845 . 0 0 "[ . 1 . 2]" 1
535 1 32 VAL MG2 1 38 VAL H 3.360 . 4.920 4.743 4.652 4.835 . 0 0 "[ . 1 . 2]" 1
536 1 38 VAL H 1 88 ILE MD 3.460 . 5.120 4.788 4.440 5.154 0.034 8 0 "[ . 1 . 2]" 1
537 1 36 ILE MG 1 38 VAL H 3.840 . 5.880 5.315 5.149 5.492 . 0 0 "[ . 1 . 2]" 1
538 1 48 LEU H 1 49 GLU H 2.740 . 3.680 2.759 2.613 2.842 . 0 0 "[ . 1 . 2]" 1
539 1 49 GLU H 1 50 GLY H 2.600 . 3.400 2.553 2.323 2.803 . 0 0 "[ . 1 . 2]" 1
540 1 47 THR HB 1 49 GLU H 2.790 . 3.780 3.091 2.765 3.426 . 0 0 "[ . 1 . 2]" 1
541 1 47 THR MG 1 49 GLU H 2.900 . 4.000 2.139 1.746 3.072 0.054 12 0 "[ . 1 . 2]" 1
542 1 38 VAL H 1 40 GLY H 3.150 . 4.510 3.983 3.814 4.095 . 0 0 "[ . 1 . 2]" 1
543 1 39 VAL H 1 40 GLY H 2.530 . 3.260 2.409 2.229 2.531 . 0 0 "[ . 1 . 2]" 1
544 1 40 GLY H 1 58 PRO HB2 3.940 . 6.080 5.598 5.138 6.115 0.035 4 0 "[ . 1 . 2]" 1
545 1 37 ALA MB 1 40 GLY H 3.620 . 5.440 4.970 4.784 5.248 . 0 0 "[ . 1 . 2]" 1
546 1 32 VAL MG2 1 40 GLY H 3.540 . 5.280 5.188 4.906 5.334 0.054 7 0 "[ . 1 . 2]" 1
547 1 36 ILE MG 1 40 GLY H 3.060 . 4.320 3.914 3.565 4.166 . 0 0 "[ . 1 . 2]" 1
548 1 43 VAL H 1 54 VAL H 2.740 . 3.680 2.829 2.412 3.358 . 0 0 "[ . 1 . 2]" 1
549 1 42 LYS HA 1 43 VAL H 2.410 . 3.020 2.230 2.156 2.292 . 0 0 "[ . 1 . 2]" 1
550 1 43 VAL H 1 43 VAL HB 3.080 . 4.360 3.912 3.812 3.961 . 0 0 "[ . 1 . 2]" 1
551 1 43 VAL H 1 54 VAL HB 3.340 . 4.880 3.623 3.156 3.930 . 0 0 "[ . 1 . 2]" 1
552 1 42 LYS HB3 1 43 VAL H 2.710 . 3.620 3.042 2.807 3.322 . 0 0 "[ . 1 . 2]" 1
553 1 42 LYS HG2 1 43 VAL H 3.090 . 4.380 4.026 3.740 4.203 . 0 0 "[ . 1 . 2]" 1
554 1 43 VAL H 1 43 VAL MG2 2.900 . 4.000 2.358 2.239 2.449 . 0 0 "[ . 1 . 2]" 1
555 1 43 VAL H 1 43 VAL MG1 2.900 . 4.000 3.008 2.655 3.191 . 0 0 "[ . 1 . 2]" 1
556 1 39 VAL H 1 59 ARG H 3.790 . 5.780 4.966 4.688 5.177 . 0 0 "[ . 1 . 2]" 1
557 1 39 VAL HA 1 59 ARG H 3.420 . 5.040 4.508 4.182 4.936 . 0 0 "[ . 1 . 2]" 1
558 1 59 ARG H 1 59 ARG HA 2.450 . 3.100 2.263 2.240 2.280 . 0 0 "[ . 1 . 2]" 1
559 1 38 VAL HA 1 59 ARG H 2.710 . 3.620 3.026 2.490 3.393 . 0 0 "[ . 1 . 2]" 1
560 1 58 PRO HB3 1 59 ARG H 2.940 . 4.080 3.312 2.782 3.629 . 0 0 "[ . 1 . 2]" 1
561 1 59 ARG H 1 59 ARG HB3 3.060 . 4.320 4.097 4.031 4.145 . 0 0 "[ . 1 . 2]" 1
562 1 59 ARG H 1 59 ARG HB2 3.060 . 4.320 3.753 3.668 3.884 . 0 0 "[ . 1 . 2]" 1
563 1 58 PRO HB2 1 59 ARG H 2.960 . 4.120 2.683 2.323 3.237 . 0 0 "[ . 1 . 2]" 1
564 1 37 ALA MB 1 59 ARG H 4.080 . 6.360 5.493 5.084 5.732 . 0 0 "[ . 1 . 2]" 1
565 1 38 VAL MG1 1 59 ARG H 3.110 . 4.420 4.012 3.593 4.385 . 0 0 "[ . 1 . 2]" 1
566 1 9 TYR H 1 9 TYR HD2 3.300 . 4.800 3.127 2.184 4.015 . 0 0 "[ . 1 . 2]" 1
567 1 9 TYR H 1 9 TYR HB2 3.190 . 4.580 2.992 2.185 3.746 . 0 0 "[ . 1 . 2]" 1
568 1 9 TYR H 1 9 TYR HB3 3.190 . 4.580 3.903 3.491 4.207 . 0 0 "[ . 1 . 2]" 1
569 1 8 ALA MB 1 9 TYR H 2.980 . 4.160 2.560 1.934 3.459 . 0 0 "[ . 1 . 2]" 1
570 1 69 LYS H 1 82 LEU H 3.580 . 5.360 4.586 4.426 4.709 . 0 0 "[ . 1 . 2]" 1
571 1 72 GLY H 1 82 LEU H 3.300 . 4.800 4.061 3.305 4.806 0.006 7 0 "[ . 1 . 2]" 1
572 1 81 ASP HA 1 82 LEU H 2.740 . 3.680 2.316 2.059 2.490 . 0 0 "[ . 1 . 2]" 1
573 1 69 LYS HA 1 82 LEU H 3.170 . 4.540 3.759 3.553 4.074 . 0 0 "[ . 1 . 2]" 1
574 1 81 ASP HB3 1 82 LEU H 2.960 . 4.120 3.099 2.427 4.085 . 0 0 "[ . 1 . 2]" 1
575 1 81 ASP HB2 1 82 LEU H 2.960 . 4.120 3.483 2.233 4.142 0.022 10 0 "[ . 1 . 2]" 1
576 1 82 LEU H 1 82 LEU HB3 2.690 . 3.580 2.708 2.476 2.892 . 0 0 "[ . 1 . 2]" 1
577 1 68 LEU HG 1 82 LEU H 3.290 . 4.780 4.522 4.098 4.936 0.156 11 0 "[ . 1 . 2]" 1
578 1 71 LYS HG2 1 82 LEU H 3.660 . 5.520 4.715 3.877 5.321 . 0 0 "[ . 1 . 2]" 1
579 1 82 LEU H 1 82 LEU HG 3.880 . 5.960 4.579 4.470 4.644 . 0 0 "[ . 1 . 2]" 1
580 1 82 LEU H 1 82 LEU HB2 2.880 . 3.960 3.001 2.704 3.233 . 0 0 "[ . 1 . 2]" 1
581 1 82 LEU H 1 82 LEU MD1 3.180 . 4.560 4.365 4.243 4.473 . 0 0 "[ . 1 . 2]" 1
582 1 63 GLY H 1 64 ARG H 2.710 . 3.620 2.676 2.312 2.936 . 0 0 "[ . 1 . 2]" 1
583 1 64 ARG H 1 86 VAL H 3.380 . 4.960 4.305 3.638 4.636 . 0 0 "[ . 1 . 2]" 1
584 1 62 ALA H 1 64 ARG H 3.590 . 5.380 4.731 4.583 5.011 . 0 0 "[ . 1 . 2]" 1
585 1 61 GLN H 1 64 ARG H 3.500 . 5.200 4.926 4.483 5.270 0.070 15 0 "[ . 1 . 2]" 1
586 1 62 ALA HA 1 64 ARG H 3.020 . 4.240 3.486 3.268 3.672 . 0 0 "[ . 1 . 2]" 1
587 1 64 ARG H 1 64 ARG HB3 2.850 . 3.900 3.625 3.568 3.662 . 0 0 "[ . 1 . 2]" 1
588 1 64 ARG H 1 64 ARG HB2 2.410 . 3.020 2.422 2.297 2.488 . 0 0 "[ . 1 . 2]" 1
589 1 62 ALA MB 1 64 ARG H 3.420 . 5.040 4.435 4.318 4.659 . 0 0 "[ . 1 . 2]" 1
590 1 64 ARG H 1 86 VAL MG2 3.350 . 4.900 3.803 3.182 4.217 . 0 0 "[ . 1 . 2]" 1
591 1 64 ARG H 1 86 VAL MG1 3.420 . 5.040 3.946 3.558 4.247 . 0 0 "[ . 1 . 2]" 1
592 1 35 PRO HA 1 37 ALA H 3.190 . 4.580 4.342 4.222 4.456 . 0 0 "[ . 1 . 2]" 1
593 1 34 ALA HA 1 37 ALA H 3.090 . 4.380 3.626 3.405 3.817 . 0 0 "[ . 1 . 2]" 1
594 1 33 PRO HD2 1 37 ALA H 3.340 . 4.880 4.572 4.336 4.773 . 0 0 "[ . 1 . 2]" 1
595 1 37 ALA H 1 38 VAL HB 3.500 . 5.200 4.898 4.774 5.147 . 0 0 "[ . 1 . 2]" 1
596 1 36 ILE HB 1 37 ALA H 2.710 . 3.620 3.045 2.943 3.180 . 0 0 "[ . 1 . 2]" 1
597 1 33 PRO HG2 1 37 ALA H 3.070 . 4.340 4.218 3.886 4.373 0.033 18 0 "[ . 1 . 2]" 1
598 1 37 ALA H 1 37 ALA MB 2.400 . 3.000 2.241 2.219 2.260 . 0 0 "[ . 1 . 2]" 1
599 1 37 ALA H 1 38 VAL MG2 3.210 . 4.620 4.127 4.009 4.328 . 0 0 "[ . 1 . 2]" 1
600 1 32 VAL MG2 1 37 ALA H 2.550 . 3.300 2.836 2.694 2.969 . 0 0 "[ . 1 . 2]" 1
601 1 37 ALA H 1 88 ILE MD 3.620 . 5.440 4.989 4.749 5.312 . 0 0 "[ . 1 . 2]" 1
602 1 36 ILE MG 1 37 ALA H 3.050 . 4.300 3.732 3.643 3.920 . 0 0 "[ . 1 . 2]" 1
603 1 4 LEU H 1 4 LEU HG 3.070 . 4.340 3.169 1.876 4.332 . 0 0 "[ . 1 . 2]" 1
604 1 7 ALA HA 1 8 ALA H 2.860 . 3.920 3.013 2.214 3.484 . 0 0 "[ . 1 . 2]" 1
605 1 8 ALA H 1 8 ALA MB 2.820 . 3.840 2.360 2.245 2.782 . 0 0 "[ . 1 . 2]" 1
606 1 6 ILE H 1 6 ILE HB 3.070 . 4.340 2.499 2.320 2.603 . 0 0 "[ . 1 . 2]" 1
607 1 6 ILE H 1 6 ILE HG12 3.420 . 5.040 3.509 2.328 3.778 . 0 0 "[ . 1 . 2]" 1
608 1 61 GLN HA 1 62 ALA H 2.370 . 2.940 2.218 2.178 2.252 . 0 0 "[ . 1 . 2]" 1
609 1 62 ALA H 1 62 ALA MB 2.280 . 2.760 2.232 2.201 2.277 . 0 0 "[ . 1 . 2]" 1
610 1 62 ALA H 1 88 ILE HG13 2.900 . 4.000 3.084 2.776 3.585 . 0 0 "[ . 1 . 2]" 1
611 1 62 ALA H 1 88 ILE MD 2.700 . 3.600 2.058 1.896 2.200 . 0 0 "[ . 1 . 2]" 1
612 1 4 LEU HA 1 5 ARG H 2.740 . 3.680 2.357 2.118 3.134 . 0 0 "[ . 1 . 2]" 1
613 1 4 LEU HG 1 5 ARG H 3.800 . 5.800 5.015 4.190 5.607 . 0 0 "[ . 1 . 2]" 1
614 1 42 LYS H 1 56 VAL H 3.400 . 5.000 4.537 4.276 4.797 . 0 0 "[ . 1 . 2]" 1
615 1 42 LYS H 1 43 VAL H 3.360 . 4.920 4.436 4.316 4.597 . 0 0 "[ . 1 . 2]" 1
616 1 41 GLY H 1 42 LYS H 3.220 . 4.640 4.160 3.756 4.405 . 0 0 "[ . 1 . 2]" 1
617 1 42 LYS H 1 42 LYS HB2 2.580 . 3.360 2.589 2.290 2.775 . 0 0 "[ . 1 . 2]" 1
618 1 42 LYS H 1 42 LYS HB3 2.970 . 4.140 3.741 3.572 3.840 . 0 0 "[ . 1 . 2]" 1
619 1 42 LYS H 1 42 LYS HG3 3.010 . 4.220 3.334 2.785 3.631 . 0 0 "[ . 1 . 2]" 1
620 1 36 ILE MD 1 42 LYS H 2.920 . 4.040 3.339 2.648 4.145 0.105 12 0 "[ . 1 . 2]" 1
621 1 36 ILE MG 1 42 LYS H 2.890 . 3.980 2.999 2.386 3.863 . 0 0 "[ . 1 . 2]" 1
622 1 77 ALA H 1 78 GLY HA2 3.660 . 5.520 4.893 4.582 5.039 . 0 0 "[ . 1 . 2]" 1
623 1 77 ALA H 1 78 GLY HA3 3.660 . 5.520 5.012 4.299 5.292 . 0 0 "[ . 1 . 2]" 1
624 1 77 ALA H 1 77 ALA MB 2.600 . 3.400 2.342 2.242 2.484 . 0 0 "[ . 1 . 2]" 1
625 1 24 GLN H 1 24 GLN HG3 3.300 . 4.800 3.573 2.055 4.529 . 0 0 "[ . 1 . 2]" 1
626 1 51 PRO HA 1 52 VAL H 2.430 . 3.060 2.188 2.157 2.223 . 0 0 "[ . 1 . 2]" 1
627 1 51 PRO HB2 1 52 VAL H 2.820 . 3.840 3.721 3.239 3.873 0.033 20 0 "[ . 1 . 2]" 1
628 1 51 PRO HB3 1 52 VAL H 3.140 . 4.480 4.118 3.677 4.247 . 0 0 "[ . 1 . 2]" 1
629 1 44 ARG HB2 1 52 VAL H 4.030 . 6.270 5.724 5.272 6.003 . 0 0 "[ . 1 . 2]" 1
630 1 45 ALA MB 1 52 VAL H 2.980 . 4.160 3.705 3.281 4.001 . 0 0 "[ . 1 . 2]" 1
631 1 52 VAL H 1 52 VAL MG2 2.510 . 3.220 2.207 2.117 2.312 . 0 0 "[ . 1 . 2]" 1
632 1 80 GLY H 1 81 ASP H 3.440 . 5.080 4.426 4.259 4.589 . 0 0 "[ . 1 . 2]" 1
633 1 81 ASP H 1 82 LEU H 3.560 . 5.320 4.508 4.377 4.582 . 0 0 "[ . 1 . 2]" 1
634 1 81 ASP H 1 83 TYR HE1 3.770 . 5.740 4.658 3.861 5.520 . 0 0 "[ . 1 . 2]" 1
635 1 25 ASP HA 1 81 ASP H 2.910 . 4.020 2.318 1.999 2.681 . 0 0 "[ . 1 . 2]" 1
636 1 80 GLY HA2 1 81 ASP H 2.760 . 3.720 2.671 2.390 2.873 . 0 0 "[ . 1 . 2]" 1
637 1 69 LYS HA 1 81 ASP H 3.450 . 5.100 4.478 4.159 4.788 . 0 0 "[ . 1 . 2]" 1
638 1 80 GLY HA3 1 81 ASP H 2.760 . 3.720 2.437 2.262 2.676 . 0 0 "[ . 1 . 2]" 1
639 1 81 ASP H 1 81 ASP HB3 3.010 . 4.220 3.506 2.847 3.750 . 0 0 "[ . 1 . 2]" 1
640 1 81 ASP H 1 81 ASP HB2 3.010 . 4.220 2.937 2.451 3.719 . 0 0 "[ . 1 . 2]" 1
641 1 81 ASP H 1 82 LEU MD1 3.950 . 6.100 6.074 5.953 6.192 0.092 19 0 "[ . 1 . 2]" 1
642 1 68 LEU H 1 84 LEU H 3.500 . 5.200 4.358 4.170 4.532 . 0 0 "[ . 1 . 2]" 1
643 1 83 TYR HD2 1 84 LEU H 3.770 . 5.740 5.167 4.656 5.683 . 0 0 "[ . 1 . 2]" 1
644 1 65 LYS HA 1 84 LEU H 3.380 . 4.960 4.242 3.853 4.584 . 0 0 "[ . 1 . 2]" 1
645 1 83 TYR HA 1 84 LEU H 2.610 . 3.410 2.188 2.138 2.261 . 0 0 "[ . 1 . 2]" 1
646 1 66 LEU HA 1 84 LEU H 3.540 . 5.280 4.376 4.268 4.520 . 0 0 "[ . 1 . 2]" 1
647 1 67 ARG HA 1 84 LEU H 3.180 . 4.560 4.288 3.932 4.622 0.062 19 0 "[ . 1 . 2]" 1
648 1 65 LYS HB2 1 84 LEU H 4.220 . 6.640 5.739 5.062 6.117 . 0 0 "[ . 1 . 2]" 1
649 1 84 LEU H 1 84 LEU HB2 2.680 . 3.560 2.369 2.308 2.417 . 0 0 "[ . 1 . 2]" 1
650 1 66 LEU HB2 1 84 LEU H 2.780 . 3.760 2.632 2.409 2.739 . 0 0 "[ . 1 . 2]" 1
651 1 84 LEU H 1 84 LEU HB3 2.980 . 4.160 3.612 3.572 3.648 . 0 0 "[ . 1 . 2]" 1
652 1 84 LEU H 1 84 LEU MD1 2.960 . 4.120 3.943 3.856 4.068 . 0 0 "[ . 1 . 2]" 1
653 1 30 LEU MD2 1 84 LEU H 3.910 . 6.020 4.988 4.751 5.270 . 0 0 "[ . 1 . 2]" 1
654 1 28 ALA H 1 83 TYR H 3.410 . 5.020 4.009 3.680 4.321 . 0 0 "[ . 1 . 2]" 1
655 1 27 TYR HD2 1 28 ALA H 3.300 . 4.800 4.325 3.808 4.794 . 0 0 "[ . 1 . 2]" 1
656 1 27 TYR HA 1 28 ALA H 2.630 . 3.460 2.209 2.114 2.344 . 0 0 "[ . 1 . 2]" 1
657 1 27 TYR HB2 1 28 ALA H 3.170 . 4.540 4.180 3.734 4.413 . 0 0 "[ . 1 . 2]" 1
658 1 27 TYR HB3 1 28 ALA H 3.170 . 4.540 3.133 2.492 3.522 . 0 0 "[ . 1 . 2]" 1
659 1 28 ALA H 1 28 ALA MB 2.820 . 3.840 2.627 2.475 2.857 . 0 0 "[ . 1 . 2]" 1
660 1 43 VAL H 1 56 VAL H 3.170 . 4.540 3.885 3.617 4.244 . 0 0 "[ . 1 . 2]" 1
661 1 41 GLY H 1 56 VAL H 3.130 . 4.460 3.676 3.129 4.437 . 0 0 "[ . 1 . 2]" 1
662 1 42 LYS HA 1 56 VAL H 2.790 . 3.780 2.593 2.280 3.087 . 0 0 "[ . 1 . 2]" 1
663 1 55 ALA HA 1 56 VAL H 2.400 . 3.000 2.160 2.122 2.183 . 0 0 "[ . 1 . 2]" 1
664 1 56 VAL H 1 57 PRO HD3 3.630 . 5.460 4.882 4.585 5.060 . 0 0 "[ . 1 . 2]" 1
665 1 56 VAL H 1 57 PRO HD2 3.630 . 5.460 5.015 4.774 5.531 0.071 8 0 "[ . 1 . 2]" 1
666 1 56 VAL H 1 56 VAL HB 2.610 . 3.410 2.494 2.374 2.573 . 0 0 "[ . 1 . 2]" 1
667 1 42 LYS HG3 1 56 VAL H 3.300 . 4.800 4.426 4.047 4.908 0.108 6 0 "[ . 1 . 2]" 1
668 1 55 ALA MB 1 56 VAL H 2.870 . 3.940 3.500 3.469 3.521 . 0 0 "[ . 1 . 2]" 1
669 1 36 ILE MG 1 56 VAL H 3.520 . 5.240 4.197 3.856 4.762 . 0 0 "[ . 1 . 2]" 1
670 1 82 LEU H 1 83 TYR H 3.730 . 5.660 4.092 3.868 4.367 . 0 0 "[ . 1 . 2]" 1
671 1 27 TYR HD2 1 83 TYR H 3.770 . 5.740 5.337 4.713 5.772 0.032 10 0 "[ . 1 . 2]" 1
672 1 83 TYR H 1 83 TYR HE1 3.600 . 5.400 4.631 4.308 5.119 . 0 0 "[ . 1 . 2]" 1
673 1 27 TYR HA 1 83 TYR H 3.080 . 4.360 2.822 2.252 3.092 . 0 0 "[ . 1 . 2]" 1
674 1 82 LEU HA 1 83 TYR H 2.730 . 3.660 2.158 2.096 2.207 . 0 0 "[ . 1 . 2]" 1
675 1 67 ARG HA 1 83 TYR H 3.770 . 5.740 4.545 4.217 4.801 . 0 0 "[ . 1 . 2]" 1
676 1 27 TYR HB2 1 83 TYR H 3.890 . 5.980 5.660 5.225 5.871 . 0 0 "[ . 1 . 2]" 1
677 1 27 TYR HB3 1 83 TYR H 3.890 . 5.980 5.311 4.712 5.618 . 0 0 "[ . 1 . 2]" 1
678 1 83 TYR H 1 83 TYR HB3 3.020 . 4.240 3.609 3.531 3.660 . 0 0 "[ . 1 . 2]" 1
679 1 82 LEU HB3 1 83 TYR H 3.230 . 4.660 4.333 4.239 4.392 . 0 0 "[ . 1 . 2]" 1
680 1 28 ALA MB 1 83 TYR H 4.060 . 6.320 4.710 4.335 5.025 . 0 0 "[ . 1 . 2]" 1
681 1 82 LEU HG 1 83 TYR H 3.030 . 4.260 3.558 3.253 3.700 . 0 0 "[ . 1 . 2]" 1
682 1 82 LEU HB2 1 83 TYR H 3.440 . 5.080 4.468 4.371 4.528 . 0 0 "[ . 1 . 2]" 1
683 1 82 LEU MD1 1 83 TYR H 2.950 . 4.100 3.033 2.761 3.216 . 0 0 "[ . 1 . 2]" 1
684 1 53 GLU HA 1 54 VAL H 2.470 . 3.140 2.144 2.080 2.204 . 0 0 "[ . 1 . 2]" 1
685 1 54 VAL H 1 55 ALA HA 3.940 . 6.080 5.092 4.716 5.300 . 0 0 "[ . 1 . 2]" 1
686 1 54 VAL H 1 54 VAL HB 2.790 . 3.780 2.542 2.408 2.701 . 0 0 "[ . 1 . 2]" 1
687 1 42 LYS HB3 1 54 VAL H 3.110 . 4.420 3.957 3.306 4.443 0.023 6 0 "[ . 1 . 2]" 1
688 1 45 ALA MB 1 54 VAL H 3.490 . 5.180 3.951 3.519 4.650 . 0 0 "[ . 1 . 2]" 1
689 1 32 VAL H 1 87 ARG H 2.920 . 4.040 3.585 3.355 3.813 . 0 0 "[ . 1 . 2]" 1
690 1 31 ASP H 1 32 VAL H 3.360 . 4.920 4.364 4.188 4.482 . 0 0 "[ . 1 . 2]" 1
691 1 32 VAL H 1 89 THR H 3.280 . 4.760 3.841 3.389 4.447 . 0 0 "[ . 1 . 2]" 1
692 1 31 ASP HA 1 32 VAL H 2.410 . 3.020 2.158 2.079 2.255 . 0 0 "[ . 1 . 2]" 1
693 1 32 VAL H 1 88 ILE HA 3.050 . 4.300 3.571 2.873 3.918 . 0 0 "[ . 1 . 2]" 1
694 1 32 VAL H 1 33 PRO HA 3.660 . 5.520 4.832 4.693 5.004 . 0 0 "[ . 1 . 2]" 1
695 1 32 VAL H 1 86 VAL HA 3.830 . 5.860 4.990 4.712 5.143 . 0 0 "[ . 1 . 2]" 1
696 1 32 VAL H 1 33 PRO HD2 3.620 . 5.440 4.909 4.849 4.997 . 0 0 "[ . 1 . 2]" 1
697 1 32 VAL H 1 33 PRO HD3 3.530 . 5.260 4.561 4.387 4.680 . 0 0 "[ . 1 . 2]" 1
698 1 32 VAL H 1 32 VAL HB 2.780 . 3.760 3.333 3.200 3.450 . 0 0 "[ . 1 . 2]" 1
699 1 32 VAL H 1 87 ARG HB2 3.200 . 4.600 3.591 3.042 4.231 . 0 0 "[ . 1 . 2]" 1
700 1 32 VAL H 1 37 ALA MB 3.590 . 5.380 5.325 5.086 5.539 0.159 9 0 "[ . 1 . 2]" 1
701 1 30 LEU HB3 1 32 VAL H 3.670 . 5.540 5.354 4.962 5.634 0.094 18 0 "[ . 1 . 2]" 1
702 1 32 VAL H 1 89 THR MG 3.100 . 4.400 3.991 3.305 4.576 0.176 20 0 "[ . 1 . 2]" 1
703 1 32 VAL H 1 32 VAL MG1 2.570 . 3.340 2.251 2.074 2.360 . 0 0 "[ . 1 . 2]" 1
704 1 32 VAL H 1 86 VAL MG1 3.330 . 4.860 4.549 4.230 4.796 . 0 0 "[ . 1 . 2]" 1
705 1 64 ARG H 1 65 LYS H 3.440 . 5.080 4.596 4.501 4.650 . 0 0 "[ . 1 . 2]" 1
706 1 65 LYS H 1 83 TYR HD2 3.910 . 6.020 4.933 4.521 5.325 . 0 0 "[ . 1 . 2]" 1
707 1 65 LYS H 1 85 GLU HA 3.650 . 5.500 4.932 4.668 5.520 0.020 2 0 "[ . 1 . 2]" 1
708 1 64 ARG HA 1 65 LYS H 2.380 . 2.970 2.314 2.174 2.437 . 0 0 "[ . 1 . 2]" 1
709 1 64 ARG HB3 1 65 LYS H 2.910 . 4.020 2.767 2.458 3.481 . 0 0 "[ . 1 . 2]" 1
710 1 65 LYS H 1 65 LYS HB2 2.600 . 3.400 2.662 2.359 2.835 . 0 0 "[ . 1 . 2]" 1
711 1 65 LYS H 1 65 LYS HD3 2.610 . 3.410 3.020 2.600 3.587 0.177 15 0 "[ . 1 . 2]" 1
712 1 65 LYS H 1 65 LYS HG3 3.410 . 5.020 4.225 3.968 4.649 . 0 0 "[ . 1 . 2]" 1
713 1 65 LYS H 1 86 VAL MG2 3.740 . 5.680 4.470 4.231 4.884 . 0 0 "[ . 1 . 2]" 1
714 1 44 ARG H 1 45 ALA H 3.550 . 5.300 4.391 4.248 4.588 . 0 0 "[ . 1 . 2]" 1
715 1 43 VAL HA 1 44 ARG H 2.360 . 2.920 2.394 2.334 2.476 . 0 0 "[ . 1 . 2]" 1
716 1 43 VAL HB 1 44 ARG H 2.520 . 3.240 2.349 2.183 2.483 . 0 0 "[ . 1 . 2]" 1
717 1 44 ARG H 1 44 ARG HB3 2.450 . 3.100 2.440 2.321 2.662 . 0 0 "[ . 1 . 2]" 1
718 1 44 ARG H 1 45 ALA MB 3.900 . 6.000 5.201 4.994 5.399 . 0 0 "[ . 1 . 2]" 1
719 1 43 VAL MG2 1 44 ARG H 3.050 . 4.290 3.308 3.135 3.542 . 0 0 "[ . 1 . 2]" 1
720 1 43 VAL MG1 1 44 ARG H 3.050 . 4.290 3.690 3.536 3.831 . 0 0 "[ . 1 . 2]" 1
721 1 67 ARG H 1 68 LEU H 3.400 . 5.000 4.303 4.220 4.415 . 0 0 "[ . 1 . 2]" 1
722 1 66 LEU H 1 67 ARG H 3.360 . 4.920 4.159 4.069 4.287 . 0 0 "[ . 1 . 2]" 1
723 1 66 LEU HA 1 67 ARG H 2.470 . 3.140 2.183 2.107 2.257 . 0 0 "[ . 1 . 2]" 1
724 1 67 ARG H 1 67 ARG HB3 2.650 . 3.500 2.478 2.413 2.572 . 0 0 "[ . 1 . 2]" 1
725 1 67 ARG H 1 67 ARG HB2 2.650 . 3.500 2.621 2.476 2.707 . 0 0 "[ . 1 . 2]" 1
726 1 66 LEU MD2 1 67 ARG H 3.160 . 4.520 4.009 3.818 4.233 . 0 0 "[ . 1 . 2]" 1
727 1 67 ARG H 1 68 LEU MD2 2.870 . 3.940 3.945 3.641 4.104 0.164 4 0 "[ . 1 . 2]" 1
728 1 53 GLU H 1 54 VAL H 3.430 . 5.060 4.302 4.152 4.556 . 0 0 "[ . 1 . 2]" 1
729 1 52 VAL H 1 53 GLU H 3.360 . 4.920 4.501 4.433 4.561 . 0 0 "[ . 1 . 2]" 1
730 1 52 VAL HA 1 53 GLU H 2.310 . 2.820 2.356 2.242 2.438 . 0 0 "[ . 1 . 2]" 1
731 1 53 GLU H 1 53 GLU HG2 2.840 . 3.880 3.234 1.980 3.933 0.053 7 0 "[ . 1 . 2]" 1
732 1 52 VAL HB 1 53 GLU H 2.380 . 2.970 2.582 2.321 2.831 . 0 0 "[ . 1 . 2]" 1
733 1 53 GLU H 1 53 GLU HG3 2.840 . 3.880 2.749 2.365 3.553 . 0 0 "[ . 1 . 2]" 1
734 1 52 VAL MG1 1 53 GLU H 2.930 . 4.070 3.792 3.665 3.913 . 0 0 "[ . 1 . 2]" 1
735 1 34 ALA H 1 89 THR H 2.970 . 4.140 3.574 3.131 3.958 . 0 0 "[ . 1 . 2]" 1
736 1 88 ILE HA 1 89 THR H 2.410 . 3.020 2.123 2.065 2.194 . 0 0 "[ . 1 . 2]" 1
737 1 33 PRO HA 1 89 THR H 2.870 . 3.940 2.455 2.169 2.779 . 0 0 "[ . 1 . 2]" 1
738 1 34 ALA HA 1 89 THR H 3.450 . 5.100 4.670 4.072 5.103 0.003 5 0 "[ . 1 . 2]" 1
739 1 33 PRO HB2 1 89 THR H 3.800 . 5.800 5.166 4.874 5.519 . 0 0 "[ . 1 . 2]" 1
740 1 33 PRO HB3 1 89 THR H 3.610 . 5.420 4.637 4.263 4.915 . 0 0 "[ . 1 . 2]" 1
741 1 88 ILE MG 1 89 THR H 2.650 . 3.500 2.889 2.542 3.294 . 0 0 "[ . 1 . 2]" 1
742 1 89 THR H 1 89 THR MG 2.780 . 3.760 3.015 2.518 3.344 . 0 0 "[ . 1 . 2]" 1
743 1 32 VAL MG1 1 89 THR H 3.170 . 4.540 3.826 3.684 3.983 . 0 0 "[ . 1 . 2]" 1
744 1 68 LEU HA 1 69 LYS H 2.430 . 3.060 2.219 2.173 2.270 . 0 0 "[ . 1 . 2]" 1
745 1 69 LYS H 1 69 LYS HG2 2.820 . 3.850 3.304 2.486 3.932 0.082 13 0 "[ . 1 . 2]" 1
746 1 69 LYS H 1 69 LYS HG3 2.970 . 4.140 2.442 2.186 2.962 . 0 0 "[ . 1 . 2]" 1
747 1 87 ARG H 1 88 ILE H 3.290 . 4.780 3.977 3.896 4.070 . 0 0 "[ . 1 . 2]" 1
748 1 63 GLY H 1 88 ILE H 3.390 . 4.980 4.441 4.186 4.742 . 0 0 "[ . 1 . 2]" 1
749 1 87 ARG HA 1 88 ILE H 2.420 . 3.040 2.213 2.141 2.271 . 0 0 "[ . 1 . 2]" 1
750 1 62 ALA HA 1 88 ILE H 3.230 . 4.660 3.209 3.047 3.423 . 0 0 "[ . 1 . 2]" 1
751 1 88 ILE H 1 88 ILE HB 2.460 . 3.120 2.496 2.397 2.597 . 0 0 "[ . 1 . 2]" 1
752 1 62 ALA MB 1 88 ILE H 2.550 . 3.300 2.510 2.207 2.795 . 0 0 "[ . 1 . 2]" 1
753 1 88 ILE H 1 88 ILE HG13 2.730 . 3.660 2.493 2.332 2.677 . 0 0 "[ . 1 . 2]" 1
754 1 88 ILE H 1 88 ILE MG 2.980 . 4.160 3.822 3.779 3.867 . 0 0 "[ . 1 . 2]" 1
755 1 32 VAL MG1 1 88 ILE H 3.450 . 5.100 3.856 3.447 4.123 . 0 0 "[ . 1 . 2]" 1
756 1 88 ILE H 1 88 ILE MD 3.130 . 4.460 3.887 3.776 4.035 . 0 0 "[ . 1 . 2]" 1
757 1 60 THR H 1 61 GLN H 3.610 . 5.420 4.363 4.140 4.611 . 0 0 "[ . 1 . 2]" 1
758 1 61 GLN H 1 62 ALA H 3.820 . 5.840 4.491 4.367 4.581 . 0 0 "[ . 1 . 2]" 1
759 1 60 THR HA 1 61 GLN H 2.360 . 2.920 2.150 2.109 2.254 . 0 0 "[ . 1 . 2]" 1
760 1 61 GLN H 1 61 GLN HB2 2.670 . 3.540 2.977 2.748 3.266 . 0 0 "[ . 1 . 2]" 1
761 1 61 GLN H 1 61 GLN HB3 2.670 . 3.540 2.484 2.297 2.772 . 0 0 "[ . 1 . 2]" 1
762 1 61 GLN H 1 64 ARG HB2 2.850 . 3.900 3.503 3.044 3.948 0.048 5 0 "[ . 1 . 2]" 1
763 1 37 ALA MB 1 61 GLN H 3.750 . 5.700 4.867 4.343 5.187 . 0 0 "[ . 1 . 2]" 1
764 1 60 THR MG 1 61 GLN H 2.580 . 3.360 3.189 2.543 3.536 0.176 13 0 "[ . 1 . 2]" 1
765 1 61 GLN H 1 86 VAL MG1 3.300 . 4.800 3.276 2.756 4.043 . 0 0 "[ . 1 . 2]" 1
766 1 30 LEU H 1 85 GLU H 3.030 . 4.260 3.190 2.813 3.565 . 0 0 "[ . 1 . 2]" 1
767 1 29 THR HA 1 30 LEU H 2.470 . 3.140 2.163 2.120 2.212 . 0 0 "[ . 1 . 2]" 1
768 1 30 LEU H 1 86 VAL HA 3.140 . 4.480 4.084 3.870 4.312 . 0 0 "[ . 1 . 2]" 1
769 1 30 LEU H 1 30 LEU HB2 2.780 . 3.760 2.912 2.836 3.008 . 0 0 "[ . 1 . 2]" 1
770 1 30 LEU H 1 87 ARG HG2 3.320 . 4.840 3.173 2.802 3.601 . 0 0 "[ . 1 . 2]" 1
771 1 29 THR MG 1 30 LEU H 2.570 . 3.340 2.763 2.518 3.010 . 0 0 "[ . 1 . 2]" 1
772 1 30 LEU H 1 30 LEU HB3 2.800 . 3.800 2.626 2.514 2.755 . 0 0 "[ . 1 . 2]" 1
773 1 30 LEU H 1 30 LEU MD1 3.020 . 4.240 4.320 4.257 4.358 0.118 19 0 "[ . 1 . 2]" 1
774 1 30 LEU H 1 84 LEU MD2 3.090 . 4.380 4.198 3.841 4.439 0.059 6 0 "[ . 1 . 2]" 1
775 1 30 LEU H 1 30 LEU MD2 3.460 . 5.120 4.516 4.419 4.611 . 0 0 "[ . 1 . 2]" 1
776 1 54 VAL H 1 55 ALA H 3.490 . 5.180 4.395 4.204 4.503 . 0 0 "[ . 1 . 2]" 1
777 1 55 ALA H 1 56 VAL H 3.280 . 4.760 4.218 4.176 4.287 . 0 0 "[ . 1 . 2]" 1
778 1 42 LYS HA 1 55 ALA H 3.680 . 5.560 4.570 4.188 4.856 . 0 0 "[ . 1 . 2]" 1
779 1 54 VAL HA 1 55 ALA H 2.310 . 2.820 2.182 2.108 2.235 . 0 0 "[ . 1 . 2]" 1
780 1 55 ALA H 1 55 ALA MB 2.320 . 2.840 2.245 2.215 2.285 . 0 0 "[ . 1 . 2]" 1
781 1 6 ILE H 1 7 ALA H 3.360 . 4.920 3.611 2.764 4.552 . 0 0 "[ . 1 . 2]" 1
782 1 6 ILE HB 1 7 ALA H 3.310 . 4.820 3.261 1.964 4.536 . 0 0 "[ . 1 . 2]" 1
783 1 7 ALA H 1 7 ALA MB 2.850 . 3.900 2.573 2.229 2.918 . 0 0 "[ . 1 . 2]" 1
784 1 6 ILE MG 1 7 ALA H 3.240 . 4.680 2.985 2.486 3.522 . 0 0 "[ . 1 . 2]" 1
785 1 30 LEU HA 1 31 ASP H 2.510 . 3.220 2.174 2.134 2.228 . 0 0 "[ . 1 . 2]" 1
786 1 29 THR HB 1 31 ASP H 4.010 . 6.220 5.407 5.168 5.705 . 0 0 "[ . 1 . 2]" 1
787 1 31 ASP H 1 32 VAL HB 3.740 . 5.680 5.169 4.951 5.329 . 0 0 "[ . 1 . 2]" 1
788 1 30 LEU HB2 1 31 ASP H 3.380 . 4.960 4.472 4.325 4.580 . 0 0 "[ . 1 . 2]" 1
789 1 30 LEU HB3 1 31 ASP H 3.020 . 4.240 4.315 4.225 4.377 0.137 5 0 "[ . 1 . 2]" 1
790 1 30 LEU MD1 1 31 ASP H 2.820 . 3.840 2.967 2.549 3.383 . 0 0 "[ . 1 . 2]" 1
791 1 30 LEU MD2 1 31 ASP H 3.520 . 5.240 4.867 4.626 5.019 . 0 0 "[ . 1 . 2]" 1
792 1 66 LEU H 1 86 VAL H 3.520 . 5.240 4.385 3.746 4.908 . 0 0 "[ . 1 . 2]" 1
793 1 63 GLY H 1 86 VAL H 3.140 . 4.480 4.246 3.587 4.574 0.094 18 0 "[ . 1 . 2]" 1
794 1 30 LEU H 1 86 VAL H 3.830 . 5.860 4.839 4.638 5.048 . 0 0 "[ . 1 . 2]" 1
795 1 65 LYS H 1 86 VAL H 4.050 . 6.300 4.947 4.815 5.142 . 0 0 "[ . 1 . 2]" 1
796 1 65 LYS HA 1 86 VAL H 3.000 . 4.200 3.048 2.686 3.557 . 0 0 "[ . 1 . 2]" 1
797 1 85 GLU HA 1 86 VAL H 2.630 . 3.460 2.170 2.098 2.245 . 0 0 "[ . 1 . 2]" 1
798 1 62 ALA HA 1 86 VAL H 3.960 . 6.120 5.103 4.875 5.480 . 0 0 "[ . 1 . 2]" 1
799 1 86 VAL H 1 86 VAL HB 2.610 . 3.410 2.572 2.434 2.672 . 0 0 "[ . 1 . 2]" 1
800 1 86 VAL H 1 86 VAL MG2 2.540 . 3.280 2.018 1.916 2.139 . 0 0 "[ . 1 . 2]" 1
801 1 66 LEU MD2 1 86 VAL H 3.120 . 4.440 4.481 3.840 4.611 0.171 9 0 "[ . 1 . 2]" 1
802 1 86 VAL H 1 86 VAL MG1 3.060 . 4.320 3.791 3.759 3.848 . 0 0 "[ . 1 . 2]" 1
803 1 45 ALA H 1 46 MET H 3.800 . 5.800 4.452 4.141 4.561 . 0 0 "[ . 1 . 2]" 1
804 1 34 ALA H 1 36 ILE H 3.560 . 5.320 4.769 4.605 4.898 . 0 0 "[ . 1 . 2]" 1
805 1 45 ALA H 1 51 PRO HA 3.320 . 4.840 4.198 3.555 4.867 0.027 13 0 "[ . 1 . 2]" 1
806 1 33 PRO HA 1 34 ALA H 2.420 . 3.040 2.287 2.249 2.353 . 0 0 "[ . 1 . 2]" 1
807 1 34 ALA H 1 35 PRO HD2 2.820 . 3.840 2.652 2.425 2.979 . 0 0 "[ . 1 . 2]" 1
808 1 34 ALA H 1 35 PRO HD3 2.890 . 3.980 3.361 2.933 3.644 . 0 0 "[ . 1 . 2]" 1
809 1 33 PRO HB2 1 34 ALA H 2.930 . 4.060 2.938 2.831 3.039 . 0 0 "[ . 1 . 2]" 1
810 1 34 ALA H 1 34 ALA MB 2.410 . 3.020 2.249 2.220 2.279 . 0 0 "[ . 1 . 2]" 1
811 1 45 ALA H 1 45 ALA MB 2.510 . 3.220 2.454 2.342 2.669 . 0 0 "[ . 1 . 2]" 1
812 1 34 ALA H 1 88 ILE MG 2.860 . 3.920 2.960 2.600 3.322 . 0 0 "[ . 1 . 2]" 1
813 1 45 ALA H 1 52 VAL MG2 2.850 . 3.900 3.145 2.877 3.388 . 0 0 "[ . 1 . 2]" 1
814 1 86 VAL H 1 87 ARG H 3.470 . 5.140 4.374 4.280 4.483 . 0 0 "[ . 1 . 2]" 1
815 1 30 LEU H 1 87 ARG H 3.090 . 4.380 3.892 3.564 4.133 . 0 0 "[ . 1 . 2]" 1
816 1 31 ASP HA 1 87 ARG H 3.010 . 4.220 3.568 3.057 4.238 0.018 9 0 "[ . 1 . 2]" 1
817 1 87 ARG H 1 88 ILE HA 3.710 . 5.620 4.698 4.416 4.903 . 0 0 "[ . 1 . 2]" 1
818 1 29 THR HA 1 87 ARG H 4.150 . 6.500 5.635 5.400 5.887 . 0 0 "[ . 1 . 2]" 1
819 1 86 VAL HA 1 87 ARG H 2.470 . 3.140 2.139 2.093 2.174 . 0 0 "[ . 1 . 2]" 1
820 1 86 VAL HB 1 87 ARG H 3.360 . 4.920 4.375 4.293 4.473 . 0 0 "[ . 1 . 2]" 1
821 1 87 ARG H 1 87 ARG HB3 2.960 . 4.120 3.750 3.675 3.792 . 0 0 "[ . 1 . 2]" 1
822 1 87 ARG H 1 87 ARG HB2 2.810 . 3.820 2.635 2.464 2.786 . 0 0 "[ . 1 . 2]" 1
823 1 87 ARG H 1 87 ARG HG2 3.100 . 4.400 2.829 2.509 3.166 . 0 0 "[ . 1 . 2]" 1
824 1 30 LEU HB3 1 87 ARG H 2.960 . 4.120 3.417 3.033 3.746 . 0 0 "[ . 1 . 2]" 1
825 1 86 VAL MG2 1 87 ARG H 3.250 . 4.700 4.200 4.089 4.267 . 0 0 "[ . 1 . 2]" 1
826 1 32 VAL MG1 1 87 ARG H 2.860 . 3.920 2.671 2.289 3.093 . 0 0 "[ . 1 . 2]" 1
827 1 86 VAL MG1 1 87 ARG H 2.670 . 3.540 3.119 2.954 3.301 . 0 0 "[ . 1 . 2]" 1
828 1 36 ILE H 1 37 ALA H 2.530 . 3.260 2.585 2.485 2.680 . 0 0 "[ . 1 . 2]" 1
829 1 36 ILE H 1 38 VAL H 3.280 . 4.760 4.412 4.186 4.575 . 0 0 "[ . 1 . 2]" 1
830 1 33 PRO HA 1 36 ILE H 3.740 . 5.680 5.176 5.107 5.316 . 0 0 "[ . 1 . 2]" 1
831 1 32 VAL HA 1 36 ILE H 4.280 . 6.760 6.199 5.968 6.346 . 0 0 "[ . 1 . 2]" 1
832 1 34 ALA HA 1 36 ILE H 3.700 . 5.600 4.823 4.652 5.019 . 0 0 "[ . 1 . 2]" 1
833 1 35 PRO HD2 1 36 ILE H 3.030 . 4.260 3.061 2.857 3.269 . 0 0 "[ . 1 . 2]" 1
834 1 33 PRO HD3 1 36 ILE H 3.640 . 5.480 5.431 5.195 5.541 0.061 9 0 "[ . 1 . 2]" 1
835 1 33 PRO HB2 1 36 ILE H 3.150 . 4.510 3.480 3.319 3.696 . 0 0 "[ . 1 . 2]" 1
836 1 36 ILE H 1 36 ILE HB 2.510 . 3.220 2.520 2.431 2.602 . 0 0 "[ . 1 . 2]" 1
837 1 36 ILE H 1 36 ILE HG12 2.750 . 3.700 3.409 3.323 3.487 . 0 0 "[ . 1 . 2]" 1
838 1 36 ILE H 1 37 ALA MB 3.360 . 4.920 4.251 4.157 4.332 . 0 0 "[ . 1 . 2]" 1
839 1 36 ILE H 1 36 ILE HG13 2.780 . 3.760 2.270 2.152 2.408 . 0 0 "[ . 1 . 2]" 1
840 1 32 VAL MG2 1 36 ILE H 3.150 . 4.510 4.073 3.950 4.232 . 0 0 "[ . 1 . 2]" 1
841 1 36 ILE H 1 36 ILE MD 3.310 . 4.820 3.754 3.676 3.894 . 0 0 "[ . 1 . 2]" 1
842 1 36 ILE H 1 36 ILE MG 3.050 . 4.300 3.823 3.790 3.856 . 0 0 "[ . 1 . 2]" 1
843 1 39 VAL H 1 58 PRO HA 3.480 . 5.160 4.536 4.240 4.818 . 0 0 "[ . 1 . 2]" 1
844 1 36 ILE HA 1 39 VAL H 3.010 . 4.220 3.759 3.535 4.048 . 0 0 "[ . 1 . 2]" 1
845 1 38 VAL HB 1 39 VAL H 2.560 . 3.320 2.559 2.423 2.744 . 0 0 "[ . 1 . 2]" 1
846 1 37 ALA MB 1 39 VAL H 3.570 . 5.340 4.706 4.560 4.859 . 0 0 "[ . 1 . 2]" 1
847 1 38 VAL MG1 1 39 VAL H 2.760 . 3.720 3.346 3.138 3.674 . 0 0 "[ . 1 . 2]" 1
848 1 32 VAL MG2 1 39 VAL H 4.010 . 6.220 5.955 5.776 6.083 . 0 0 "[ . 1 . 2]" 1
849 1 36 ILE MG 1 39 VAL H 3.790 . 5.780 5.174 4.920 5.456 . 0 0 "[ . 1 . 2]" 1
850 1 48 LEU H 1 50 GLY H 3.530 . 5.260 4.205 3.930 4.527 . 0 0 "[ . 1 . 2]" 1
851 1 47 THR HB 1 48 LEU H 2.850 . 3.900 3.627 3.190 3.888 . 0 0 "[ . 1 . 2]" 1
852 1 48 LEU H 1 48 LEU HB3 3.110 . 4.420 3.609 3.587 3.639 . 0 0 "[ . 1 . 2]" 1
853 1 48 LEU H 1 48 LEU HB2 3.110 . 4.420 2.556 2.513 2.612 . 0 0 "[ . 1 . 2]" 1
854 1 48 LEU H 1 48 LEU MD2 2.970 . 4.140 3.181 3.023 3.321 . 0 0 "[ . 1 . 2]" 1
855 1 59 ARG H 1 60 THR H 2.680 . 3.560 2.672 2.616 2.769 . 0 0 "[ . 1 . 2]" 1
856 1 78 GLY H 1 79 ARG H 3.350 . 4.900 4.271 3.629 4.587 . 0 0 "[ . 1 . 2]" 1
857 1 45 ALA HA 1 46 MET H 2.600 . 3.400 2.272 2.143 2.460 . 0 0 "[ . 1 . 2]" 1
858 1 78 GLY HA2 1 79 ARG H 2.650 . 3.500 3.037 2.230 3.528 0.028 15 0 "[ . 1 . 2]" 1
859 1 60 THR H 1 60 THR HB 2.820 . 3.840 2.474 2.354 2.915 . 0 0 "[ . 1 . 2]" 1
860 1 78 GLY HA3 1 79 ARG H 2.650 . 3.500 2.415 2.193 2.994 . 0 0 "[ . 1 . 2]" 1
861 1 38 VAL HA 1 60 THR H 2.830 . 3.860 3.625 3.116 3.999 0.139 13 0 "[ . 1 . 2]" 1
862 1 79 ARG H 1 79 ARG HG3 2.670 . 3.540 3.379 2.898 3.819 0.279 7 0 "[ . 1 . 2]" 1
863 1 37 ALA MB 1 60 THR H 3.200 . 4.600 4.015 3.647 4.254 . 0 0 "[ . 1 . 2]" 1
864 1 60 THR H 1 60 THR MG 2.980 . 4.160 3.760 3.724 3.806 . 0 0 "[ . 1 . 2]" 1
865 1 46 MET H 1 84 LEU MD2 3.320 . 4.840 4.717 3.993 4.960 0.120 11 0 "[ . 1 . 2]" 1
866 1 70 GLY H 1 71 LYS H 2.880 . 3.960 2.517 2.429 2.663 . 0 0 "[ . 1 . 2]" 1
867 1 69 LYS H 1 71 LYS H 3.900 . 6.000 5.256 4.592 5.609 . 0 0 "[ . 1 . 2]" 1
868 1 71 LYS H 1 82 LEU H 3.150 . 4.500 4.042 3.396 4.545 0.045 12 0 "[ . 1 . 2]" 1
869 1 71 LYS H 1 81 ASP HA 2.910 . 4.020 3.182 2.578 3.492 . 0 0 "[ . 1 . 2]" 1
870 1 69 LYS HA 1 71 LYS H 3.000 . 4.200 3.467 3.217 3.687 . 0 0 "[ . 1 . 2]" 1
871 1 71 LYS H 1 71 LYS HB3 3.050 . 4.290 3.784 3.640 3.881 . 0 0 "[ . 1 . 2]" 1
872 1 71 LYS H 1 71 LYS HB2 3.050 . 4.290 2.655 2.472 2.784 . 0 0 "[ . 1 . 2]" 1
873 1 71 LYS H 1 71 LYS HG2 2.700 . 3.600 2.942 2.530 3.398 . 0 0 "[ . 1 . 2]" 1
874 1 71 LYS H 1 82 LEU HB2 3.340 . 4.880 4.187 3.975 4.449 . 0 0 "[ . 1 . 2]" 1
875 1 24 GLN H 1 24 GLN HG2 3.300 . 4.800 3.250 1.960 4.092 . 0 0 "[ . 1 . 2]" 1
876 1 3 GLN HA 1 3 GLN QG 2.850 . 3.900 2.734 2.386 3.560 . 0 0 "[ . 1 . 2]" 1
877 1 4 LEU H 1 4 LEU QB 2.730 . 3.660 2.528 2.213 3.359 . 0 0 "[ . 1 . 2]" 1
878 1 4 LEU HA 1 4 LEU QD 2.850 . 3.900 2.522 2.011 3.517 . 0 0 "[ . 1 . 2]" 1
879 1 4 LEU QB 1 45 ALA MB 3.580 . 5.360 4.808 4.167 5.382 0.022 7 0 "[ . 1 . 2]" 1
880 1 4 LEU QB 1 54 VAL QG 3.880 . 5.960 2.219 1.755 3.602 0.045 13 0 "[ . 1 . 2]" 1
881 1 4 LEU QD 1 5 ARG H 3.630 . 5.460 4.135 2.795 4.509 . 0 0 "[ . 1 . 2]" 1
882 1 4 LEU QD 1 45 ALA MB 3.550 . 5.300 3.611 2.681 4.925 . 0 0 "[ . 1 . 2]" 1
883 1 5 ARG H 1 5 ARG QB 2.900 . 4.000 2.503 2.244 2.996 . 0 0 "[ . 1 . 2]" 1
884 1 5 ARG H 1 5 ARG QG 3.810 . 5.820 2.777 2.004 4.128 . 0 0 "[ . 1 . 2]" 1
885 1 5 ARG HA 1 5 ARG QG 2.790 . 3.780 2.953 2.449 3.423 . 0 0 "[ . 1 . 2]" 1
886 1 5 ARG HA 1 5 ARG QD 3.290 . 4.780 3.457 1.978 4.636 . 0 0 "[ . 1 . 2]" 1
887 1 5 ARG QB 1 5 ARG QD 2.720 . 3.640 2.475 2.166 2.965 . 0 0 "[ . 1 . 2]" 1
888 1 5 ARG QB 1 6 ILE H 2.960 . 4.120 3.371 2.741 4.001 . 0 0 "[ . 1 . 2]" 1
889 1 6 ILE HA 1 68 LEU QB 3.190 . 4.580 4.087 3.092 4.562 . 0 0 "[ . 1 . 2]" 1
890 1 6 ILE MG 1 57 PRO QG 2.900 . 4.000 2.648 2.205 3.112 . 0 0 "[ . 1 . 2]" 1
891 1 6 ILE QG 1 7 ALA H 3.400 . 5.000 4.134 3.847 4.840 . 0 0 "[ . 1 . 2]" 1
892 1 6 ILE QG 1 57 PRO QD 3.270 . 4.740 3.531 2.068 4.667 . 0 0 "[ . 1 . 2]" 1
893 1 6 ILE QG 1 68 LEU MD2 3.220 . 4.640 2.813 2.209 3.650 . 0 0 "[ . 1 . 2]" 1
894 1 6 ILE QG 1 84 LEU MD1 3.220 . 4.640 2.789 1.984 3.770 . 0 0 "[ . 1 . 2]" 1
895 1 6 ILE MD 1 56 VAL QG 2.710 . 3.620 2.509 1.844 3.684 0.064 18 0 "[ . 1 . 2]" 1
896 1 8 ALA MB 1 67 ARG QB 3.610 . 5.420 3.431 2.695 4.096 . 0 0 "[ . 1 . 2]" 1
897 1 8 ALA MB 1 67 ARG QG 3.600 . 5.400 4.759 4.201 5.303 . 0 0 "[ . 1 . 2]" 1
898 1 9 TYR H 1 9 TYR QB 2.800 . 3.800 2.882 2.164 3.476 . 0 0 "[ . 1 . 2]" 1
899 1 9 TYR QB 1 9 TYR HD1 2.600 . 3.400 2.411 2.275 2.634 . 0 0 "[ . 1 . 2]" 1
900 1 10 GLY QA 1 11 PRO QG 3.260 . 4.730 3.845 3.617 4.302 . 0 0 "[ . 1 . 2]" 1
901 1 10 GLY QA 1 11 PRO QD 2.310 . 2.820 2.131 1.890 2.540 . 0 0 "[ . 1 . 2]" 1
902 1 23 SER QB 1 24 GLN H 3.140 . 4.480 3.252 1.912 3.969 . 0 0 "[ . 1 . 2]" 1
903 1 23 SER QB 1 24 GLN HA 3.400 . 5.000 4.377 3.872 4.992 . 0 0 "[ . 1 . 2]" 1
904 1 24 GLN H 1 24 GLN QG 2.860 . 3.920 2.833 1.945 3.469 . 0 0 "[ . 1 . 2]" 1
905 1 24 GLN HA 1 24 GLN QG 2.810 . 3.820 2.900 2.353 3.580 . 0 0 "[ . 1 . 2]" 1
906 1 24 GLN QG 1 75 GLY H 3.420 . 5.040 4.144 3.381 5.207 0.167 12 0 "[ . 1 . 2]" 1
907 1 24 GLN QG 1 80 GLY H 3.320 . 4.840 3.925 2.848 4.857 0.017 16 0 "[ . 1 . 2]" 1
908 1 24 GLN QG 1 80 GLY QA 3.110 . 4.420 3.572 1.892 4.500 0.080 14 0 "[ . 1 . 2]" 1
909 1 25 ASP HA 1 80 GLY QA 3.210 . 4.620 3.018 2.696 3.526 . 0 0 "[ . 1 . 2]" 1
910 1 26 LEU QB 1 27 TYR HA 3.410 . 5.020 4.133 3.981 4.401 . 0 0 "[ . 1 . 2]" 1
911 1 26 LEU QB 1 72 GLY QA 3.240 . 4.680 3.366 2.622 4.135 . 0 0 "[ . 1 . 2]" 1
912 1 26 LEU QB 1 83 TYR H 3.830 . 5.860 4.269 3.634 4.682 . 0 0 "[ . 1 . 2]" 1
913 1 26 LEU HG 1 72 GLY QA 3.720 . 5.640 3.288 2.737 4.080 . 0 0 "[ . 1 . 2]" 1
914 1 26 LEU QD 1 82 LEU MD1 3.240 . 4.680 2.987 2.411 3.687 . 0 0 "[ . 1 . 2]" 1
915 1 27 TYR QB 1 28 ALA H 2.870 . 3.940 3.044 2.457 3.390 . 0 0 "[ . 1 . 2]" 1
916 1 27 TYR QB 1 83 TYR H 3.520 . 5.240 4.869 4.386 5.072 . 0 0 "[ . 1 . 2]" 1
917 1 29 THR HA 1 85 GLU QB 2.870 . 3.940 2.237 1.873 2.630 . 0 0 "[ . 1 . 2]" 1
918 1 29 THR HB 1 85 GLU QB 3.530 . 5.260 4.966 4.477 5.331 0.071 17 0 "[ . 1 . 2]" 1
919 1 29 THR MG 1 85 GLU QB 3.310 . 4.820 3.367 2.792 4.050 . 0 0 "[ . 1 . 2]" 1
920 1 29 THR MG 1 87 ARG QD 3.300 . 4.800 3.268 2.582 3.830 . 0 0 "[ . 1 . 2]" 1
921 1 30 LEU H 1 85 GLU QB 2.970 . 4.140 3.059 2.575 3.437 . 0 0 "[ . 1 . 2]" 1
922 1 30 LEU HB3 1 43 VAL QG 3.530 . 5.260 4.693 4.317 4.997 . 0 0 "[ . 1 . 2]" 1
923 1 30 LEU HG 1 43 VAL QG 3.400 . 5.000 2.656 2.264 2.992 . 0 0 "[ . 1 . 2]" 1
924 1 30 LEU HG 1 54 VAL QG 3.990 . 6.180 4.822 4.053 5.327 . 0 0 "[ . 1 . 2]" 1
925 1 30 LEU MD1 1 43 VAL QG 2.540 . 3.280 2.072 1.877 2.183 . 0 0 "[ . 1 . 2]" 1
926 1 30 LEU MD1 1 54 VAL QG 2.760 . 3.720 2.712 1.947 3.189 . 0 0 "[ . 1 . 2]" 1
927 1 30 LEU MD2 1 43 VAL QG 2.790 . 3.780 2.854 2.141 3.198 . 0 0 "[ . 1 . 2]" 1
928 1 30 LEU MD2 1 54 VAL QG 2.740 . 3.680 3.333 2.278 3.706 0.026 4 0 "[ . 1 . 2]" 1
929 1 32 VAL MG2 1 43 VAL QG 2.750 . 3.700 1.965 1.800 2.113 0.000 15 0 "[ . 1 . 2]" 1
930 1 32 VAL MG2 1 56 VAL QG 2.570 . 3.340 2.180 1.851 2.635 . 0 0 "[ . 1 . 2]" 1
931 1 33 PRO HD2 1 43 VAL QG 3.100 . 4.400 2.262 1.999 2.545 . 0 0 "[ . 1 . 2]" 1
932 1 33 PRO HD3 1 43 VAL QG 3.200 . 4.600 2.972 2.756 3.397 . 0 0 "[ . 1 . 2]" 1
933 1 34 ALA MB 1 35 PRO QB 3.360 . 4.920 4.472 4.205 4.672 . 0 0 "[ . 1 . 2]" 1
934 1 34 ALA MB 1 35 PRO QG 3.350 . 4.900 3.906 3.519 4.183 . 0 0 "[ . 1 . 2]" 1
935 1 35 PRO QB 1 36 ILE H 2.950 . 4.100 2.699 2.279 3.240 . 0 0 "[ . 1 . 2]" 1
936 1 35 PRO QG 1 36 ILE H 2.870 . 3.940 2.761 2.159 3.818 . 0 0 "[ . 1 . 2]" 1
937 1 36 ILE HA 1 39 VAL QG 2.680 . 3.560 2.427 2.014 3.019 . 0 0 "[ . 1 . 2]" 1
938 1 36 ILE MG 1 43 VAL QG 2.810 . 3.820 2.000 1.897 2.156 . 0 0 "[ . 1 . 2]" 1
939 1 36 ILE MG 1 54 VAL QG 4.390 . 6.980 5.836 5.184 6.347 . 0 0 "[ . 1 . 2]" 1
940 1 36 ILE MG 1 56 VAL QG 3.050 . 4.290 2.752 2.101 3.427 . 0 0 "[ . 1 . 2]" 1
941 1 36 ILE HG12 1 41 GLY QA 3.690 . 5.580 3.591 2.978 4.021 . 0 0 "[ . 1 . 2]" 1
942 1 36 ILE MD 1 39 VAL QG 3.680 . 5.560 4.844 4.533 5.296 . 0 0 "[ . 1 . 2]" 1
943 1 36 ILE MD 1 43 VAL QG 2.990 . 4.180 2.481 2.134 3.003 . 0 0 "[ . 1 . 2]" 1
944 1 37 ALA HA 1 56 VAL QG 2.820 . 3.840 2.972 2.394 3.749 . 0 0 "[ . 1 . 2]" 1
945 1 37 ALA MB 1 43 VAL QG 3.820 . 5.840 4.714 4.482 4.927 . 0 0 "[ . 1 . 2]" 1
946 1 37 ALA MB 1 56 VAL QG 3.200 . 4.600 3.924 3.550 4.473 . 0 0 "[ . 1 . 2]" 1
947 1 39 VAL H 1 39 VAL QG 2.410 . 3.020 2.094 1.980 2.256 . 0 0 "[ . 1 . 2]" 1
948 1 39 VAL HA 1 39 VAL QG 2.500 . 3.200 2.320 2.259 2.386 . 0 0 "[ . 1 . 2]" 1
949 1 39 VAL QG 1 40 GLY H 2.630 . 3.460 2.528 2.312 2.715 . 0 0 "[ . 1 . 2]" 1
950 1 39 VAL QG 1 40 GLY HA2 3.270 . 4.740 3.873 3.652 4.085 . 0 0 "[ . 1 . 2]" 1
951 1 40 GLY HA3 1 56 VAL QG 3.460 . 5.120 4.173 3.561 4.859 . 0 0 "[ . 1 . 2]" 1
952 1 41 GLY H 1 56 VAL QG 2.990 . 4.180 3.374 2.915 3.849 . 0 0 "[ . 1 . 2]" 1
953 1 41 GLY QA 1 42 LYS H 2.480 . 3.160 2.207 2.115 2.342 . 0 0 "[ . 1 . 2]" 1
954 1 42 LYS H 1 42 LYS QD 4.250 . 6.700 4.781 4.052 5.197 . 0 0 "[ . 1 . 2]" 1
955 1 42 LYS H 1 42 LYS QE 3.580 . 5.360 4.529 3.650 5.454 0.094 19 0 "[ . 1 . 2]" 1
956 1 42 LYS HA 1 43 VAL QG 2.910 . 4.020 3.372 3.204 3.525 . 0 0 "[ . 1 . 2]" 1
957 1 42 LYS HB2 1 42 LYS QE 3.470 . 5.140 2.753 1.960 4.081 . 0 0 "[ . 1 . 2]" 1
958 1 42 LYS HB3 1 42 LYS QE 3.460 . 5.120 3.337 2.685 4.322 . 0 0 "[ . 1 . 2]" 1
959 1 42 LYS HB3 1 53 GLU QB 3.230 . 4.660 2.578 1.695 3.776 0.105 9 0 "[ . 1 . 2]" 1
960 1 42 LYS HB3 1 54 VAL QG 4.310 . 6.820 5.321 5.078 5.734 . 0 0 "[ . 1 . 2]" 1
961 1 42 LYS QE 1 42 LYS HG3 2.870 . 3.940 2.604 2.386 3.138 . 0 0 "[ . 1 . 2]" 1
962 1 42 LYS QD 1 53 GLU QB 3.000 . 4.200 2.385 1.878 3.128 . 0 0 "[ . 1 . 2]" 1
963 1 42 LYS QD 1 55 ALA H 4.570 . 7.340 4.805 4.274 6.238 . 0 0 "[ . 1 . 2]" 1
964 1 42 LYS QD 1 55 ALA HA 3.610 . 5.420 4.103 3.527 5.187 . 0 0 "[ . 1 . 2]" 1
965 1 42 LYS QD 1 55 ALA MB 3.570 . 5.340 3.615 3.104 4.976 . 0 0 "[ . 1 . 2]" 1
966 1 42 LYS QE 1 55 ALA MB 3.460 . 5.120 4.361 2.257 5.191 0.071 8 0 "[ . 1 . 2]" 1
967 1 43 VAL H 1 43 VAL QG 2.470 . 3.140 2.276 2.128 2.346 . 0 0 "[ . 1 . 2]" 1
968 1 43 VAL HA 1 43 VAL QG 2.570 . 3.340 2.361 2.298 2.403 . 0 0 "[ . 1 . 2]" 1
969 1 43 VAL QG 1 44 ARG H 2.640 . 3.480 3.080 3.001 3.190 . 0 0 "[ . 1 . 2]" 1
970 1 43 VAL QG 1 45 ALA MB 3.000 . 4.200 3.059 2.610 3.497 . 0 0 "[ . 1 . 2]" 1
971 1 43 VAL QG 1 54 VAL HB 3.100 . 4.400 2.765 1.997 3.277 . 0 0 "[ . 1 . 2]" 1
972 1 43 VAL QG 1 54 VAL QG 2.600 . 3.400 3.125 1.856 3.584 0.184 19 0 "[ . 1 . 2]" 1
973 1 43 VAL QG 1 56 VAL H 3.450 . 5.100 3.735 3.400 4.001 . 0 0 "[ . 1 . 2]" 1
974 1 43 VAL QG 1 56 VAL QG 3.100 . 4.400 1.838 1.773 1.915 0.027 19 0 "[ . 1 . 2]" 1
975 1 44 ARG H 1 44 ARG QG 3.290 . 4.780 4.006 3.961 4.072 . 0 0 "[ . 1 . 2]" 1
976 1 44 ARG HB2 1 44 ARG QD 2.880 . 3.960 2.757 2.511 3.143 . 0 0 "[ . 1 . 2]" 1
977 1 44 ARG HB3 1 44 ARG QD 2.860 . 3.920 2.690 2.360 2.988 . 0 0 "[ . 1 . 2]" 1
978 1 44 ARG QG 1 45 ALA H 3.140 . 4.480 3.155 2.644 3.502 . 0 0 "[ . 1 . 2]" 1
979 1 44 ARG QG 1 45 ALA HA 3.180 . 4.560 3.855 3.283 4.319 . 0 0 "[ . 1 . 2]" 1
980 1 44 ARG QG 1 45 ALA MB 3.500 . 5.200 4.472 4.187 4.717 . 0 0 "[ . 1 . 2]" 1
981 1 44 ARG QG 1 46 MET H 3.720 . 5.640 4.665 3.620 5.292 . 0 0 "[ . 1 . 2]" 1
982 1 44 ARG QG 1 51 PRO HB2 3.100 . 4.400 2.333 1.989 2.816 . 0 0 "[ . 1 . 2]" 1
983 1 44 ARG QG 1 51 PRO HB3 3.130 . 4.460 2.736 2.062 3.260 . 0 0 "[ . 1 . 2]" 1
984 1 44 ARG QG 1 52 VAL H 3.250 . 4.700 3.590 2.933 3.912 . 0 0 "[ . 1 . 2]" 1
985 1 44 ARG QD 1 45 ALA H 3.730 . 5.660 5.135 4.697 5.510 . 0 0 "[ . 1 . 2]" 1
986 1 44 ARG QD 1 51 PRO HB2 2.810 . 3.820 2.902 1.970 3.552 . 0 0 "[ . 1 . 2]" 1
987 1 44 ARG QD 1 51 PRO HB3 3.120 . 4.440 2.759 2.266 3.760 . 0 0 "[ . 1 . 2]" 1
988 1 44 ARG QD 1 52 VAL H 3.710 . 5.620 5.325 4.470 5.712 0.092 20 0 "[ . 1 . 2]" 1
989 1 45 ALA H 1 54 VAL QG 3.050 . 4.300 3.242 2.642 3.973 . 0 0 "[ . 1 . 2]" 1
990 1 45 ALA HA 1 54 VAL QG 3.340 . 4.880 4.240 3.908 4.377 . 0 0 "[ . 1 . 2]" 1
991 1 45 ALA MB 1 54 VAL QG 2.700 . 3.600 1.955 1.854 2.092 . 0 0 "[ . 1 . 2]" 1
992 1 48 LEU H 1 48 LEU QB 2.810 . 3.820 2.506 2.468 2.554 . 0 0 "[ . 1 . 2]" 1
993 1 48 LEU QB 1 48 LEU MD1 2.610 . 3.410 2.148 2.131 2.168 . 0 0 "[ . 1 . 2]" 1
994 1 48 LEU QB 1 49 GLU H 3.180 . 4.560 2.917 2.566 3.174 . 0 0 "[ . 1 . 2]" 1
995 1 49 GLU H 1 49 GLU QB 2.660 . 3.520 2.477 2.273 2.662 . 0 0 "[ . 1 . 2]" 1
996 1 49 GLU H 1 49 GLU QG 3.030 . 4.260 2.642 2.018 4.044 . 0 0 "[ . 1 . 2]" 1
997 1 52 VAL HA 1 53 GLU QB 3.640 . 5.480 4.547 4.418 4.649 . 0 0 "[ . 1 . 2]" 1
998 1 52 VAL HA 1 53 GLU QG 3.150 . 4.500 3.788 3.504 4.577 0.077 7 0 "[ . 1 . 2]" 1
999 1 52 VAL HB 1 53 GLU QB 3.650 . 5.500 4.710 4.152 5.294 . 0 0 "[ . 1 . 2]" 1
1000 1 53 GLU H 1 53 GLU QB 2.570 . 3.340 2.582 2.405 3.023 . 0 0 "[ . 1 . 2]" 1
1001 1 53 GLU H 1 53 GLU QG 2.450 . 3.100 2.431 1.953 3.263 0.163 7 0 "[ . 1 . 2]" 1
1002 1 53 GLU HA 1 53 GLU QG 2.850 . 3.900 2.738 2.407 3.406 . 0 0 "[ . 1 . 2]" 1
1003 1 53 GLU QB 1 54 VAL H 2.620 . 3.440 3.455 2.658 3.569 0.129 19 0 "[ . 1 . 2]" 1
1004 1 53 GLU QB 1 54 VAL QG 3.620 . 5.440 4.544 4.226 4.695 . 0 0 "[ . 1 . 2]" 1
1005 1 53 GLU QG 1 54 VAL H 3.240 . 4.680 4.381 3.915 4.839 0.159 16 0 "[ . 1 . 2]" 1
1006 1 54 VAL H 1 54 VAL QG 2.440 . 3.080 2.548 2.281 3.148 0.068 16 0 "[ . 1 . 2]" 1
1007 1 54 VAL HA 1 54 VAL QG 2.600 . 3.400 2.185 2.163 2.208 . 0 0 "[ . 1 . 2]" 1
1008 1 54 VAL QG 1 55 ALA H 2.480 . 3.160 2.819 2.619 3.135 . 0 0 "[ . 1 . 2]" 1
1009 1 54 VAL QG 1 55 ALA MB 3.210 . 4.620 3.817 3.632 4.080 . 0 0 "[ . 1 . 2]" 1
1010 1 56 VAL H 1 56 VAL QG 2.980 . 4.160 2.189 1.939 2.409 . 0 0 "[ . 1 . 2]" 1
1011 1 56 VAL HA 1 57 PRO QG 3.240 . 4.680 3.965 3.712 4.132 . 0 0 "[ . 1 . 2]" 1
1012 1 56 VAL QG 1 58 PRO HA 3.560 . 5.320 4.402 4.154 4.745 . 0 0 "[ . 1 . 2]" 1
1013 1 56 VAL QG 1 60 THR MG 2.760 . 3.720 2.146 1.955 2.370 . 0 0 "[ . 1 . 2]" 1
1014 1 56 VAL QG 1 66 LEU MD1 2.890 . 3.980 3.028 2.234 3.784 . 0 0 "[ . 1 . 2]" 1
1015 1 56 VAL QG 1 86 VAL MG1 2.900 . 4.000 4.061 3.859 4.250 0.250 2 0 "[ . 1 . 2]" 1
1016 1 57 PRO HB2 1 58 PRO QD 2.640 . 3.480 2.471 2.275 3.140 . 0 0 "[ . 1 . 2]" 1
1017 1 57 PRO HB3 1 58 PRO QD 3.190 . 4.580 3.058 2.776 3.390 . 0 0 "[ . 1 . 2]" 1
1018 1 57 PRO QD 1 60 THR MG 3.800 . 5.800 3.879 3.181 4.594 . 0 0 "[ . 1 . 2]" 1
1019 1 58 PRO HA 1 59 ARG QG 3.280 . 4.760 4.241 4.105 4.344 . 0 0 "[ . 1 . 2]" 1
1020 1 58 PRO HB2 1 59 ARG QG 2.730 . 3.660 2.426 2.238 2.639 . 0 0 "[ . 1 . 2]" 1
1021 1 59 ARG H 1 59 ARG QG 2.750 . 3.700 2.876 2.764 2.991 . 0 0 "[ . 1 . 2]" 1
1022 1 59 ARG H 1 59 ARG QD 3.740 . 5.680 4.856 4.723 4.973 . 0 0 "[ . 1 . 2]" 1
1023 1 59 ARG HA 1 59 ARG QG 2.810 . 3.820 2.592 2.518 2.748 . 0 0 "[ . 1 . 2]" 1
1024 1 59 ARG QG 1 60 THR H 3.540 . 5.280 4.453 4.362 4.523 . 0 0 "[ . 1 . 2]" 1
1025 1 60 THR HA 1 61 GLN QB 3.410 . 5.020 3.992 3.732 4.120 . 0 0 "[ . 1 . 2]" 1
1026 1 60 THR HA 1 64 ARG QD 3.560 . 5.320 4.089 3.532 4.753 . 0 0 "[ . 1 . 2]" 1
1027 1 60 THR MG 1 61 GLN QB 3.740 . 5.680 4.711 4.386 4.945 . 0 0 "[ . 1 . 2]" 1
1028 1 61 GLN H 1 64 ARG QD 3.030 . 4.260 2.765 2.272 3.278 . 0 0 "[ . 1 . 2]" 1
1029 1 61 GLN HA 1 61 GLN QG 2.630 . 3.460 2.831 2.495 3.185 . 0 0 "[ . 1 . 2]" 1
1030 1 61 GLN QB 1 61 GLN QG 2.150 . 2.500 2.058 2.006 2.110 . 0 0 "[ . 1 . 2]" 1
1031 1 61 GLN QG 1 62 ALA H 2.700 . 3.600 2.661 2.417 3.153 . 0 0 "[ . 1 . 2]" 1
1032 1 61 GLN QG 1 64 ARG H 3.330 . 4.860 4.083 3.753 4.470 . 0 0 "[ . 1 . 2]" 1
1033 1 61 GLN QG 1 64 ARG HB2 3.110 . 4.420 4.534 4.362 4.639 0.219 12 0 "[ . 1 . 2]" 1
1034 1 61 GLN QG 1 88 ILE MD 3.300 . 4.800 3.805 3.246 4.379 . 0 0 "[ . 1 . 2]" 1
1035 1 62 ALA MB 1 63 GLY QA 3.290 . 4.780 3.705 3.638 3.766 . 0 0 "[ . 1 . 2]" 1
1036 1 63 GLY QA 1 86 VAL H 3.580 . 5.360 4.954 4.355 5.363 0.003 18 0 "[ . 1 . 2]" 1
1037 1 64 ARG H 1 64 ARG QD 3.570 . 5.340 4.101 3.988 4.355 . 0 0 "[ . 1 . 2]" 1
1038 1 64 ARG HA 1 64 ARG QD 3.260 . 4.720 4.032 3.938 4.263 . 0 0 "[ . 1 . 2]" 1
1039 1 64 ARG HB2 1 64 ARG QD 2.540 . 3.280 2.497 2.404 2.655 . 0 0 "[ . 1 . 2]" 1
1040 1 64 ARG HB3 1 64 ARG QD 2.850 . 3.900 2.446 2.341 2.920 . 0 0 "[ . 1 . 2]" 1
1041 1 64 ARG QD 1 66 LEU MD2 3.220 . 4.640 4.103 3.492 4.751 0.111 1 0 "[ . 1 . 2]" 1
1042 1 65 LYS H 1 65 LYS QG 3.020 . 4.240 3.916 3.685 4.249 0.009 15 0 "[ . 1 . 2]" 1
1043 1 65 LYS H 1 65 LYS QE 3.300 . 4.800 3.320 2.280 4.955 0.155 8 0 "[ . 1 . 2]" 1
1044 1 65 LYS HA 1 65 LYS QG 2.810 . 3.820 2.460 2.367 2.564 . 0 0 "[ . 1 . 2]" 1
1045 1 65 LYS HB3 1 65 LYS QE 3.340 . 4.880 3.593 3.350 4.438 . 0 0 "[ . 1 . 2]" 1
1046 1 65 LYS QE 1 65 LYS QG 2.690 . 3.580 2.418 2.148 2.642 . 0 0 "[ . 1 . 2]" 1
1047 1 65 LYS QG 1 83 TYR HB3 3.470 . 5.140 2.644 2.216 3.183 . 0 0 "[ . 1 . 2]" 1
1048 1 65 LYS QG 1 85 GLU H 3.530 . 5.260 3.841 3.624 4.109 . 0 0 "[ . 1 . 2]" 1
1049 1 65 LYS QG 1 85 GLU HA 3.000 . 4.200 2.156 1.812 2.921 . 0 0 "[ . 1 . 2]" 1
1050 1 65 LYS QG 1 86 VAL H 3.770 . 5.740 3.908 3.307 4.592 . 0 0 "[ . 1 . 2]" 1
1051 1 65 LYS HD2 1 85 GLU QB 3.080 . 4.360 3.656 2.525 4.343 . 0 0 "[ . 1 . 2]" 1
1052 1 65 LYS HD2 1 85 GLU QG 2.680 . 3.560 2.923 1.988 3.723 0.163 2 0 "[ . 1 . 2]" 1
1053 1 65 LYS QE 1 83 TYR HD2 3.130 . 4.460 4.062 2.297 4.668 0.208 8 0 "[ . 1 . 2]" 1
1054 1 67 ARG H 1 67 ARG QB 2.420 . 3.040 2.264 2.179 2.329 . 0 0 "[ . 1 . 2]" 1
1055 1 67 ARG H 1 67 ARG QD 3.850 . 5.900 4.741 4.485 4.895 . 0 0 "[ . 1 . 2]" 1
1056 1 67 ARG HA 1 67 ARG QD 3.460 . 5.120 4.248 4.087 4.341 . 0 0 "[ . 1 . 2]" 1
1057 1 67 ARG QB 1 67 ARG QG 2.190 . 2.580 2.109 2.099 2.116 . 0 0 "[ . 1 . 2]" 1
1058 1 67 ARG QB 1 67 ARG QD 2.520 . 3.240 2.369 2.192 2.452 . 0 0 "[ . 1 . 2]" 1
1059 1 67 ARG QB 1 68 LEU MD2 3.640 . 5.480 4.391 4.142 4.609 . 0 0 "[ . 1 . 2]" 1
1060 1 67 ARG QB 1 83 TYR HE1 3.540 . 5.280 4.731 3.173 5.377 0.097 10 0 "[ . 1 . 2]" 1
1061 1 67 ARG QD 1 67 ARG QG 2.180 . 2.560 2.021 2.003 2.107 . 0 0 "[ . 1 . 2]" 1
1062 1 67 ARG QG 1 83 TYR HE1 2.870 . 3.940 3.482 1.996 4.057 0.117 12 0 "[ . 1 . 2]" 1
1063 1 67 ARG QD 1 68 LEU H 3.740 . 5.680 5.327 4.866 5.459 . 0 0 "[ . 1 . 2]" 1
1064 1 67 ARG QD 1 69 LYS H 3.530 . 5.260 5.026 4.301 5.417 0.157 13 0 "[ . 1 . 2]" 1
1065 1 68 LEU H 1 68 LEU QB 2.780 . 3.760 2.632 2.570 2.721 . 0 0 "[ . 1 . 2]" 1
1066 1 68 LEU H 1 81 ASP QB 3.400 . 5.000 3.465 2.940 4.707 . 0 0 "[ . 1 . 2]" 1
1067 1 68 LEU QB 1 82 LEU H 3.040 . 4.280 3.007 2.517 3.275 . 0 0 "[ . 1 . 2]" 1
1068 1 69 LYS H 1 69 LYS QE 3.910 . 6.020 4.626 3.730 5.593 . 0 0 "[ . 1 . 2]" 1
1069 1 69 LYS HA 1 69 LYS QD 2.840 . 3.880 3.970 3.383 4.197 0.317 10 0 "[ . 1 . 2]" 1
1070 1 69 LYS HB2 1 69 LYS QE 3.590 . 5.380 3.071 2.046 4.361 . 0 0 "[ . 1 . 2]" 1
1071 1 69 LYS HB2 1 81 ASP QB 3.770 . 5.740 5.227 4.073 5.842 0.102 12 0 "[ . 1 . 2]" 1
1072 1 69 LYS HB3 1 69 LYS QE 3.670 . 5.540 2.923 1.860 4.162 . 0 0 "[ . 1 . 2]" 1
1073 1 69 LYS HB3 1 81 ASP QB 3.930 . 6.050 4.766 3.452 6.009 . 0 0 "[ . 1 . 2]" 1
1074 1 69 LYS QD 1 69 LYS HG2 2.250 . 2.700 2.278 2.175 2.486 . 0 0 "[ . 1 . 2]" 1
1075 1 69 LYS QE 1 69 LYS HG2 2.860 . 3.920 3.114 2.467 3.561 . 0 0 "[ . 1 . 2]" 1
1076 1 69 LYS QD 1 81 ASP HA 3.570 . 5.340 5.415 4.928 5.700 0.360 1 0 "[ . 1 . 2]" 1
1077 1 69 LYS QE 1 70 GLY H 3.990 . 6.180 5.285 4.035 6.271 0.091 4 0 "[ . 1 . 2]" 1
1078 1 70 GLY H 1 81 ASP QB 3.350 . 4.900 4.573 3.490 5.261 0.361 13 0 "[ . 1 . 2]" 1
1079 1 71 LYS H 1 71 LYS QB 2.710 . 3.620 2.605 2.434 2.725 . 0 0 "[ . 1 . 2]" 1
1080 1 71 LYS H 1 71 LYS QE 3.670 . 5.540 4.526 3.316 5.489 . 0 0 "[ . 1 . 2]" 1
1081 1 71 LYS H 1 81 ASP QB 3.730 . 5.660 5.033 4.222 5.423 . 0 0 "[ . 1 . 2]" 1
1082 1 71 LYS QB 1 72 GLY H 3.230 . 4.660 2.946 2.439 3.325 . 0 0 "[ . 1 . 2]" 1
1083 1 71 LYS QB 1 82 LEU MD1 3.400 . 5.000 3.659 3.454 3.905 . 0 0 "[ . 1 . 2]" 1
1084 1 71 LYS QE 1 71 LYS HG2 2.760 . 3.720 2.641 2.334 3.381 . 0 0 "[ . 1 . 2]" 1
1085 1 72 GLY H 1 80 GLY QA 3.580 . 5.360 3.748 3.321 4.207 . 0 0 "[ . 1 . 2]" 1
1086 1 72 GLY QA 1 82 LEU MD1 3.010 . 4.220 3.272 2.665 3.654 . 0 0 "[ . 1 . 2]" 1
1087 1 74 PRO HA 1 79 ARG QD 3.290 . 4.780 4.243 3.548 4.763 . 0 0 "[ . 1 . 2]" 1
1088 1 74 PRO QB 1 75 GLY H 2.760 . 3.720 3.116 2.715 3.411 . 0 0 "[ . 1 . 2]" 1
1089 1 75 GLY H 1 78 GLY QA 3.180 . 4.560 3.714 3.154 4.322 . 0 0 "[ . 1 . 2]" 1
1090 1 76 PRO QG 1 77 ALA H 2.910 . 4.020 3.200 2.207 3.926 . 0 0 "[ . 1 . 2]" 1
1091 1 76 PRO QG 1 77 ALA MB 3.230 . 4.660 3.971 3.101 4.823 0.163 10 0 "[ . 1 . 2]" 1
1092 1 77 ALA MB 1 78 GLY QA 3.360 . 4.920 4.093 3.727 4.195 . 0 0 "[ . 1 . 2]" 1
1093 1 81 ASP H 1 81 ASP QB 2.710 . 3.620 2.688 2.315 3.103 . 0 0 "[ . 1 . 2]" 1
1094 1 81 ASP QB 1 82 LEU MD1 4.060 . 6.320 5.524 5.233 5.986 . 0 0 "[ . 1 . 2]" 1
1095 1 81 ASP QB 1 83 TYR HE1 2.880 . 3.960 2.709 1.923 4.089 0.129 20 0 "[ . 1 . 2]" 1
1096 1 84 LEU HA 1 85 GLU QB 3.580 . 5.360 4.235 3.931 4.543 . 0 0 "[ . 1 . 2]" 1
1097 1 85 GLU H 1 85 GLU QB 2.860 . 3.920 2.379 2.175 2.582 . 0 0 "[ . 1 . 2]" 1
1098 1 85 GLU H 1 85 GLU QG 3.250 . 4.700 3.084 2.099 4.033 . 0 0 "[ . 1 . 2]" 1
1099 1 85 GLU HA 1 85 GLU QG 2.950 . 4.100 2.579 2.387 3.215 . 0 0 "[ . 1 . 2]" 1
1100 1 85 GLU QB 1 86 VAL H 2.950 . 4.100 3.808 3.561 4.034 . 0 0 "[ . 1 . 2]" 1
1101 1 87 ARG H 1 87 ARG QD 3.300 . 4.800 3.670 3.286 4.283 . 0 0 "[ . 1 . 2]" 1
1102 1 87 ARG HA 1 87 ARG QD 3.220 . 4.640 2.283 2.081 2.464 . 0 0 "[ . 1 . 2]" 1
1103 1 87 ARG HB2 1 87 ARG QD 2.850 . 3.900 3.502 3.350 3.568 . 0 0 "[ . 1 . 2]" 1
1104 1 87 ARG HB3 1 87 ARG QD 2.890 . 3.980 2.938 2.444 3.245 . 0 0 "[ . 1 . 2]" 1
1105 1 87 ARG QD 1 88 ILE H 3.300 . 4.800 4.267 4.025 4.541 . 0 0 "[ . 1 . 2]" 1
1106 1 6 ILE MG 1 57 PRO QD 2.920 . 4.040 2.501 2.020 2.840 . 0 0 "[ . 1 . 2]" 1
1107 1 6 ILE QG 1 66 LEU MD1 3.640 . 5.480 3.483 2.825 5.474 . 0 0 "[ . 1 . 2]" 1
1108 1 6 ILE MD 1 30 LEU QD 3.250 . 4.700 2.708 2.109 3.852 . 0 0 "[ . 1 . 2]" 1
1109 1 6 ILE MD 1 57 PRO QD 2.670 . 3.540 2.299 1.832 3.422 . 0 0 "[ . 1 . 2]" 1
1110 1 9 TYR HE1 1 64 ARG QB 3.270 . 4.740 4.471 3.594 4.976 0.236 9 0 "[ . 1 . 2]" 1
1111 1 9 TYR HE1 1 64 ARG QD 3.060 . 4.320 3.110 2.059 4.362 0.042 1 0 "[ . 1 . 2]" 1
1112 1 4 LEU QB 1 47 THR MG 3.980 . 6.160 5.364 3.618 6.209 0.049 6 0 "[ . 1 . 2]" 1
1113 1 4 LEU QD 1 47 THR MG 2.690 . 3.580 2.885 2.000 3.553 . 0 0 "[ . 1 . 2]" 1
1114 1 4 LEU QD 1 52 VAL MG2 2.810 . 3.820 2.200 1.742 3.023 0.058 7 0 "[ . 1 . 2]" 1
1115 1 9 TYR HE1 1 66 LEU MD2 3.000 . 4.200 4.299 3.673 4.693 0.493 18 0 "[ . 1 . 2]" 1
1116 1 8 ALA MB 1 67 ARG HB2 3.880 . 5.960 4.522 3.780 5.190 . 0 0 "[ . 1 . 2]" 1
1117 1 8 ALA MB 1 67 ARG HG2 4.000 . 6.200 5.063 4.452 5.678 . 0 0 "[ . 1 . 2]" 1
1118 1 8 ALA MB 1 67 ARG HG3 4.000 . 6.200 5.786 5.154 6.359 0.159 10 0 "[ . 1 . 2]" 1
1119 1 9 TYR HD1 1 59 ARG HG3 3.610 . 5.420 5.130 4.388 5.504 0.084 12 0 "[ . 1 . 2]" 1
1120 1 9 TYR HE1 1 60 THR HA 3.250 . 4.700 2.751 1.724 4.208 0.076 12 0 "[ . 1 . 2]" 1
1121 1 9 TYR HE1 1 59 ARG HG3 3.770 . 5.740 5.909 5.548 6.142 0.402 15 0 "[ . 1 . 2]" 1
1122 1 9 TYR QE 1 65 LYS HA 3.650 . 5.500 5.782 5.366 6.287 0.787 15 2 "[ . 1 +- 2]" 1
1123 1 9 TYR QE 1 65 LYS H 3.650 . 5.500 5.362 4.405 5.907 0.407 5 0 "[ . 1 . 2]" 1
1124 1 9 TYR QE 1 64 ARG HD2 3.650 . 5.500 3.233 2.375 4.664 . 0 0 "[ . 1 . 2]" 1
1125 1 9 TYR QE 1 60 THR HA 3.650 . 5.500 2.371 1.723 3.116 0.077 12 0 "[ . 1 . 2]" 1
1126 1 9 TYR QE 1 61 GLN HB3 3.650 . 5.500 4.143 3.252 4.911 . 0 0 "[ . 1 . 2]" 1
1127 1 9 TYR QE 1 64 ARG HB2 3.650 . 5.500 3.846 3.298 4.247 . 0 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 54
_Distance_constraint_stats_list.Viol_count 153
_Distance_constraint_stats_list.Viol_total 99.011
_Distance_constraint_stats_list.Viol_max 0.149
_Distance_constraint_stats_list.Viol_rms 0.0147
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0046
_Distance_constraint_stats_list.Viol_average_violations_only 0.0324
_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 24 GLN 0.508 0.096 16 0 "[ . 1 . 2]"
1 26 LEU 0.130 0.067 6 0 "[ . 1 . 2]"
1 28 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 30 LEU 0.007 0.007 9 0 "[ . 1 . 2]"
1 32 VAL 0.241 0.090 9 0 "[ . 1 . 2]"
1 33 PRO 0.086 0.041 5 0 "[ . 1 . 2]"
1 34 ALA 0.789 0.149 20 0 "[ . 1 . 2]"
1 35 PRO 0.302 0.085 4 0 "[ . 1 . 2]"
1 36 ILE 0.402 0.072 2 0 "[ . 1 . 2]"
1 37 ALA 0.358 0.054 13 0 "[ . 1 . 2]"
1 38 VAL 1.272 0.149 20 0 "[ . 1 . 2]"
1 39 VAL 0.302 0.085 4 0 "[ . 1 . 2]"
1 40 GLY 0.402 0.072 2 0 "[ . 1 . 2]"
1 41 GLY 0.276 0.055 2 0 "[ . 1 . 2]"
1 43 VAL 0.439 0.098 15 0 "[ . 1 . 2]"
1 45 ALA 0.203 0.055 16 0 "[ . 1 . 2]"
1 52 VAL 0.203 0.055 16 0 "[ . 1 . 2]"
1 54 VAL 0.439 0.098 15 0 "[ . 1 . 2]"
1 56 VAL 0.276 0.055 2 0 "[ . 1 . 2]"
1 59 ARG 0.484 0.084 8 0 "[ . 1 . 2]"
1 60 THR 0.272 0.054 13 0 "[ . 1 . 2]"
1 63 GLY 0.114 0.050 9 0 "[ . 1 . 2]"
1 64 ARG 0.033 0.032 1 0 "[ . 1 . 2]"
1 66 LEU 0.224 0.060 19 0 "[ . 1 . 2]"
1 68 LEU 0.114 0.036 7 0 "[ . 1 . 2]"
1 72 GLY 0.040 0.032 18 0 "[ . 1 . 2]"
1 73 PHE 0.796 0.096 16 0 "[ . 1 . 2]"
1 80 GLY 0.328 0.070 2 0 "[ . 1 . 2]"
1 81 ASP 0.130 0.067 6 0 "[ . 1 . 2]"
1 82 LEU 0.114 0.036 7 0 "[ . 1 . 2]"
1 83 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 84 LEU 0.224 0.060 19 0 "[ . 1 . 2]"
1 85 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 86 VAL 0.147 0.050 9 0 "[ . 1 . 2]"
1 87 ARG 0.248 0.090 9 0 "[ . 1 . 2]"
1 89 THR 0.000 0.000 . 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 26 LEU H 1 81 ASP O 2.000 . 2.200 2.131 2.015 2.267 0.067 6 0 "[ . 1 . 2]" 2
2 1 28 ALA H 1 83 TYR O 2.000 . 2.200 2.020 1.939 2.129 . 0 0 "[ . 1 . 2]" 2
3 1 30 LEU H 1 85 GLU O 2.000 . 2.200 2.056 2.007 2.137 . 0 0 "[ . 1 . 2]" 2
4 1 32 VAL H 1 87 ARG O 2.000 . 2.200 2.173 2.039 2.290 0.090 9 0 "[ . 1 . 2]" 2
5 1 33 PRO O 1 37 ALA H 2.000 . 2.200 2.082 1.995 2.198 . 0 0 "[ . 1 . 2]" 2
6 1 34 ALA O 1 38 VAL H 2.000 . 2.200 2.231 2.085 2.349 0.149 20 0 "[ . 1 . 2]" 2
7 1 35 PRO O 1 39 VAL H 2.000 . 2.200 2.163 2.004 2.285 0.085 4 0 "[ . 1 . 2]" 2
8 1 36 ILE O 1 40 GLY H 2.000 . 2.200 2.193 2.059 2.272 0.072 2 0 "[ . 1 . 2]" 2
9 1 43 VAL H 1 54 VAL O 2.000 . 2.200 2.197 2.039 2.298 0.098 15 0 "[ . 1 . 2]" 2
10 1 45 ALA H 1 52 VAL O 2.000 . 2.200 2.095 1.949 2.255 0.055 16 0 "[ . 1 . 2]" 2
11 1 45 ALA O 1 52 VAL H 2.000 . 2.200 2.111 2.002 2.237 0.037 11 0 "[ . 1 . 2]" 2
12 1 43 VAL O 1 54 VAL H 2.000 . 2.200 2.067 1.976 2.258 0.058 16 0 "[ . 1 . 2]" 2
13 1 41 GLY O 1 56 VAL H 2.000 . 2.200 2.105 1.968 2.202 0.002 10 0 "[ . 1 . 2]" 2
14 1 38 VAL O 1 59 ARG H 2.000 . 2.200 2.194 2.005 2.284 0.084 8 0 "[ . 1 . 2]" 2
15 1 37 ALA O 1 60 THR H 2.000 . 2.200 2.158 1.968 2.252 0.052 19 0 "[ . 1 . 2]" 2
16 1 63 GLY H 1 86 VAL O 2.000 . 2.200 2.115 2.013 2.250 0.050 9 0 "[ . 1 . 2]" 2
17 1 68 LEU H 1 82 LEU O 2.000 . 2.200 2.062 1.942 2.209 0.009 13 0 "[ . 1 . 2]" 2
18 1 72 GLY H 1 80 GLY O 2.000 . 2.200 2.119 2.007 2.232 0.032 18 0 "[ . 1 . 2]" 2
19 1 24 GLN O 1 73 PHE H 2.000 . 2.200 2.186 1.978 2.296 0.096 16 0 "[ . 1 . 2]" 2
20 1 73 PHE O 1 80 GLY H 2.000 . 2.200 2.063 1.908 2.264 0.064 18 0 "[ . 1 . 2]" 2
21 1 68 LEU O 1 82 LEU H 2.000 . 2.200 2.075 1.936 2.215 0.015 2 0 "[ . 1 . 2]" 2
22 1 26 LEU O 1 83 TYR H 2.000 . 2.200 1.987 1.942 2.106 . 0 0 "[ . 1 . 2]" 2
23 1 66 LEU O 1 84 LEU H 2.000 . 2.200 2.156 2.003 2.260 0.060 19 0 "[ . 1 . 2]" 2
24 1 28 ALA O 1 85 GLU H 2.000 . 2.200 2.011 1.923 2.076 . 0 0 "[ . 1 . 2]" 2
25 1 64 ARG O 1 86 VAL H 2.000 . 2.200 2.056 1.954 2.232 0.032 1 0 "[ . 1 . 2]" 2
26 1 30 LEU O 1 87 ARG H 2.000 . 2.200 2.041 1.933 2.207 0.007 9 0 "[ . 1 . 2]" 2
27 1 32 VAL O 1 89 THR H 2.000 . 2.200 2.075 1.980 2.193 . 0 0 "[ . 1 . 2]" 2
28 1 26 LEU N 1 81 ASP O 3.050 2.850 3.410 3.036 2.854 3.186 . 0 0 "[ . 1 . 2]" 2
29 1 28 ALA N 1 83 TYR O 3.050 2.850 3.410 2.947 2.884 3.083 . 0 0 "[ . 1 . 2]" 2
30 1 30 LEU N 1 85 GLU O 3.050 2.850 3.410 2.980 2.929 3.059 . 0 0 "[ . 1 . 2]" 2
31 1 32 VAL N 1 87 ARG O 3.050 2.850 3.410 3.135 2.983 3.245 . 0 0 "[ . 1 . 2]" 2
32 1 33 PRO O 1 37 ALA N 3.050 2.850 3.410 2.907 2.809 3.039 0.041 5 0 "[ . 1 . 2]" 2
33 1 34 ALA O 1 38 VAL N 3.050 2.850 3.410 3.165 3.038 3.296 . 0 0 "[ . 1 . 2]" 2
34 1 35 PRO O 1 39 VAL N 3.050 2.850 3.410 3.138 2.978 3.273 . 0 0 "[ . 1 . 2]" 2
35 1 36 ILE O 1 40 GLY N 3.050 2.850 3.410 2.905 2.842 2.968 0.008 9 0 "[ . 1 . 2]" 2
36 1 43 VAL N 1 54 VAL O 3.050 2.850 3.410 3.116 2.922 3.208 . 0 0 "[ . 1 . 2]" 2
37 1 45 ALA N 1 52 VAL O 3.050 2.850 3.410 3.012 2.911 3.212 . 0 0 "[ . 1 . 2]" 2
38 1 45 ALA O 1 52 VAL N 3.050 2.850 3.410 3.061 2.942 3.161 . 0 0 "[ . 1 . 2]" 2
39 1 43 VAL O 1 54 VAL N 3.050 2.850 3.410 3.005 2.911 3.177 . 0 0 "[ . 1 . 2]" 2
40 1 41 GLY O 1 56 VAL N 3.050 2.850 3.410 2.866 2.795 3.009 0.055 2 0 "[ . 1 . 2]" 2
41 1 38 VAL O 1 59 ARG N 3.050 2.850 3.410 3.152 2.967 3.225 . 0 0 "[ . 1 . 2]" 2
42 1 37 ALA O 1 60 THR N 3.050 2.850 3.410 2.957 2.796 3.029 0.054 13 0 "[ . 1 . 2]" 2
43 1 63 GLY N 1 86 VAL O 3.050 2.850 3.410 3.080 2.980 3.213 . 0 0 "[ . 1 . 2]" 2
44 1 68 LEU N 1 82 LEU O 3.050 2.850 3.410 2.966 2.890 3.070 . 0 0 "[ . 1 . 2]" 2
45 1 72 GLY N 1 80 GLY O 3.050 2.850 3.410 3.016 2.891 3.154 . 0 0 "[ . 1 . 2]" 2
46 1 24 GLN O 1 73 PHE N 3.050 2.850 3.410 3.008 2.866 3.170 . 0 0 "[ . 1 . 2]" 2
47 1 73 PHE O 1 80 GLY N 3.050 2.850 3.410 2.906 2.780 3.040 0.070 2 0 "[ . 1 . 2]" 2
48 1 68 LEU O 1 82 LEU N 3.050 2.850 3.410 2.894 2.814 2.992 0.036 7 0 "[ . 1 . 2]" 2
49 1 26 LEU O 1 83 TYR N 3.050 2.850 3.410 2.932 2.874 3.026 . 0 0 "[ . 1 . 2]" 2
50 1 66 LEU O 1 84 LEU N 3.050 2.850 3.410 3.098 2.955 3.190 . 0 0 "[ . 1 . 2]" 2
51 1 28 ALA O 1 85 GLU N 3.050 2.850 3.410 2.958 2.884 3.028 . 0 0 "[ . 1 . 2]" 2
52 1 64 ARG O 1 86 VAL N 3.050 2.850 3.410 2.960 2.849 3.123 0.001 17 0 "[ . 1 . 2]" 2
53 1 30 LEU O 1 87 ARG N 3.050 2.850 3.410 2.941 2.854 3.129 . 0 0 "[ . 1 . 2]" 2
54 1 32 VAL O 1 89 THR N 3.050 2.850 3.410 2.980 2.896 3.057 . 0 0 "[ . 1 . 2]" 2
stop_
save_
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