NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
642238 |
6pq2   |
30628 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6pq2
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 1281
_Distance_constraint_stats_list.Viol_count 1051
_Distance_constraint_stats_list.Viol_total 1935.382
_Distance_constraint_stats_list.Viol_max 0.535
_Distance_constraint_stats_list.Viol_rms 0.0250
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0038
_Distance_constraint_stats_list.Viol_average_violations_only 0.0921
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 MET 1.284 0.317 5 0 "[ . 1 . 2]"
1 2 LEU 2.877 0.317 5 0 "[ . 1 . 2]"
1 3 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 4 LEU 18.732 0.535 18 2 "[ . 1 -. + 2]"
1 5 LEU 14.598 0.535 18 2 "[ . 1 -. + 2]"
1 6 PHE 3.657 0.271 20 0 "[ . 1 . 2]"
1 7 THR 5.908 0.416 19 0 "[ . 1 . 2]"
1 8 PRO 4.686 0.285 7 0 "[ . 1 . 2]"
1 9 VAL 5.165 0.374 3 0 "[ . 1 . 2]"
1 10 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 22 SER 0.944 0.363 7 0 "[ . 1 . 2]"
1 23 GLY 1.658 0.363 7 0 "[ . 1 . 2]"
1 24 ARG 3.665 0.229 12 0 "[ . 1 . 2]"
1 25 ASP 6.958 0.416 19 0 "[ . 1 . 2]"
1 26 LEU 6.267 0.374 3 0 "[ . 1 . 2]"
1 27 ARG 0.482 0.089 16 0 "[ . 1 . 2]"
1 28 ALA 3.241 0.271 20 0 "[ . 1 . 2]"
1 29 GLU 0.298 0.146 2 0 "[ . 1 . 2]"
1 30 LEU 5.946 0.453 7 0 "[ . 1 . 2]"
1 31 PRO 0.917 0.103 20 0 "[ . 1 . 2]"
1 32 LEU 5.538 0.188 17 0 "[ . 1 . 2]"
1 33 THR 2.612 0.382 11 0 "[ . 1 . 2]"
1 34 LEU 0.103 0.074 20 0 "[ . 1 . 2]"
1 35 GLU 0.103 0.074 20 0 "[ . 1 . 2]"
1 36 GLU 2.476 0.160 1 0 "[ . 1 . 2]"
1 37 ALA 0.271 0.092 4 0 "[ . 1 . 2]"
1 38 PHE 0.110 0.110 6 0 "[ . 1 . 2]"
1 39 HIS 0.098 0.098 13 0 "[ . 1 . 2]"
1 40 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 41 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 42 GLU 1.404 0.157 13 0 "[ . 1 . 2]"
1 43 ARG 3.746 0.270 9 0 "[ . 1 . 2]"
1 44 VAL 3.815 0.277 9 0 "[ . 1 . 2]"
1 45 VAL 13.187 0.419 6 0 "[ . 1 . 2]"
1 46 GLU 0.233 0.146 13 0 "[ . 1 . 2]"
1 47 VAL 3.365 0.419 6 0 "[ . 1 . 2]"
1 48 ALA 0.499 0.071 10 0 "[ . 1 . 2]"
1 49 GLY 0.077 0.077 11 0 "[ . 1 . 2]"
1 50 ARG 0.067 0.065 6 0 "[ . 1 . 2]"
1 51 ARG 4.231 0.277 9 0 "[ . 1 . 2]"
1 52 VAL 0.052 0.037 16 0 "[ . 1 . 2]"
1 53 SER 0.467 0.101 5 0 "[ . 1 . 2]"
1 54 VAL 2.207 0.270 9 0 "[ . 1 . 2]"
1 55 ARG 2.282 0.157 13 0 "[ . 1 . 2]"
1 56 ILE 4.615 0.188 17 0 "[ . 1 . 2]"
1 57 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 58 PRO 0.208 0.110 6 0 "[ . 1 . 2]"
1 59 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 60 VAL 1.422 0.150 1 0 "[ . 1 . 2]"
1 61 ARG 2.929 0.222 11 0 "[ . 1 . 2]"
1 62 GLU 3.149 0.222 11 0 "[ . 1 . 2]"
1 63 GLY 0.159 0.069 8 0 "[ . 1 . 2]"
1 64 SER 2.932 0.210 7 0 "[ . 1 . 2]"
1 65 VAL 2.773 0.329 12 0 "[ . 1 . 2]"
1 66 ILE 6.317 0.225 16 0 "[ . 1 . 2]"
1 67 ARG 2.080 0.283 10 0 "[ . 1 . 2]"
1 68 VAL 0.186 0.092 2 0 "[ . 1 . 2]"
1 69 PRO 0.753 0.220 2 0 "[ . 1 . 2]"
1 70 GLY 0.661 0.220 2 0 "[ . 1 . 2]"
1 71 MET 0.012 0.012 2 0 "[ . 1 . 2]"
1 72 GLY 0.045 0.045 14 0 "[ . 1 . 2]"
1 73 GLY 0.596 0.109 18 0 "[ . 1 . 2]"
1 74 GLN 0.085 0.085 9 0 "[ . 1 . 2]"
1 75 GLY 0.085 0.085 9 0 "[ . 1 . 2]"
1 76 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 78 PRO 0.129 0.129 19 0 "[ . 1 . 2]"
1 79 GLY 0.807 0.112 6 0 "[ . 1 . 2]"
1 80 ASP 1.830 0.195 11 0 "[ . 1 . 2]"
1 81 LEU 0.475 0.094 4 0 "[ . 1 . 2]"
1 82 LEU 1.940 0.283 10 0 "[ . 1 . 2]"
1 83 LEU 1.925 0.208 13 0 "[ . 1 . 2]"
1 84 VAL 3.842 0.206 11 0 "[ . 1 . 2]"
1 85 VAL 6.345 0.329 12 0 "[ . 1 . 2]"
1 86 ARG 0.858 0.120 5 0 "[ . 1 . 2]"
1 87 LEU 0.802 0.120 5 0 "[ . 1 . 2]"
1 88 LEU 3.131 0.293 13 0 "[ . 1 . 2]"
1 89 PRO 2.910 0.293 13 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 2 LEU MD1 1 7 THR MG 3.640 . 5.480 2.592 1.885 4.065 . 0 0 "[ . 1 . 2]" 1
2 1 37 ALA MB 1 87 LEU MD2 2.850 . 3.900 2.091 1.881 2.467 . 0 0 "[ . 1 . 2]" 1
3 1 37 ALA MB 1 85 VAL MG1 3.020 . 4.240 3.377 3.093 3.726 . 0 0 "[ . 1 . 2]" 1
4 1 34 LEU MD2 1 37 ALA MB 3.520 . 5.240 3.463 3.073 3.718 . 0 0 "[ . 1 . 2]" 1
5 1 28 ALA MB 1 45 VAL MG2 4.210 . 6.620 5.494 4.970 5.961 . 0 0 "[ . 1 . 2]" 1
6 1 7 THR MG 1 28 ALA MB 3.490 . 5.180 4.023 3.768 4.594 . 0 0 "[ . 1 . 2]" 1
7 1 4 LEU MD1 1 45 VAL MG1 3.190 . 4.580 2.702 2.288 3.017 . 0 0 "[ . 1 . 2]" 1
8 1 4 LEU MD1 1 45 VAL MG2 3.190 . 4.580 3.815 2.957 4.309 . 0 0 "[ . 1 . 2]" 1
9 1 68 VAL MG2 1 81 LEU MD2 3.110 . 4.420 2.336 2.185 2.580 . 0 0 "[ . 1 . 2]" 1
10 1 68 VAL MG2 1 83 LEU MD2 3.900 . 6.000 5.202 4.858 5.643 . 0 0 "[ . 1 . 2]" 1
11 1 45 VAL MG1 1 83 LEU MD1 3.960 . 6.120 3.374 2.760 4.402 . 0 0 "[ . 1 . 2]" 1
12 1 43 ARG HG3 1 45 VAL MG1 3.660 . 5.520 2.029 1.824 2.424 . 0 0 "[ . 1 . 2]" 1
13 1 45 VAL MG1 1 83 LEU MD2 3.900 . 6.000 3.727 3.278 4.494 . 0 0 "[ . 1 . 2]" 1
14 1 54 VAL MG2 1 83 LEU MD1 2.830 . 3.860 1.942 1.737 2.080 0.063 6 0 "[ . 1 . 2]" 1
15 1 7 THR MG 1 26 LEU MD2 3.610 . 5.420 3.785 3.644 4.032 . 0 0 "[ . 1 . 2]" 1
16 1 26 LEU MD2 1 48 ALA MB 3.960 . 6.120 5.713 5.102 6.129 0.009 5 0 "[ . 1 . 2]" 1
17 1 32 LEU MD2 1 85 VAL MG2 2.890 . 3.980 2.736 2.393 3.094 . 0 0 "[ . 1 . 2]" 1
18 1 60 VAL MG1 1 85 VAL MG2 2.800 . 3.800 2.731 2.575 3.144 . 0 0 "[ . 1 . 2]" 1
19 1 56 ILE MG 1 85 VAL MG2 3.340 . 4.880 3.480 3.197 3.723 . 0 0 "[ . 1 . 2]" 1
20 1 68 VAL MG1 1 71 MET ME 3.570 . 5.340 3.606 2.184 4.493 . 0 0 "[ . 1 . 2]" 1
21 1 32 LEU MD1 1 56 ILE MG 3.380 . 4.960 2.842 2.297 3.696 . 0 0 "[ . 1 . 2]" 1
22 1 65 VAL MG1 1 82 LEU MD2 3.100 . 4.400 3.191 2.220 3.556 . 0 0 "[ . 1 . 2]" 1
23 1 5 LEU MD2 1 83 LEU MD2 3.030 . 4.260 4.133 3.277 4.346 0.086 1 0 "[ . 1 . 2]" 1
24 1 2 LEU MD2 1 7 THR MG 3.640 . 5.480 2.623 1.807 3.543 . 0 0 "[ . 1 . 2]" 1
25 1 65 VAL MG1 1 82 LEU MD1 3.610 . 5.420 4.358 3.393 4.779 . 0 0 "[ . 1 . 2]" 1
26 1 30 LEU MD1 1 83 LEU MD2 3.080 . 4.360 2.951 2.074 4.111 . 0 0 "[ . 1 . 2]" 1
27 1 4 LEU MD1 1 83 LEU MD2 3.190 . 4.580 2.488 2.132 2.794 . 0 0 "[ . 1 . 2]" 1
28 1 30 LEU MD2 1 83 LEU MD2 3.080 . 4.360 4.077 3.175 4.428 0.068 11 0 "[ . 1 . 2]" 1
29 1 54 VAL MG1 1 83 LEU MD2 3.210 . 4.620 3.758 3.382 4.347 . 0 0 "[ . 1 . 2]" 1
30 1 54 VAL MG2 1 83 LEU MD2 3.210 . 4.620 4.214 3.800 4.490 . 0 0 "[ . 1 . 2]" 1
31 1 45 VAL MG2 1 83 LEU MD2 3.900 . 6.000 3.677 3.326 3.954 . 0 0 "[ . 1 . 2]" 1
32 1 26 LEU MD1 1 81 LEU MD1 3.020 . 4.240 3.076 2.338 3.434 . 0 0 "[ . 1 . 2]" 1
33 1 7 THR MG 1 26 LEU MD1 3.790 . 5.780 5.155 4.833 5.662 . 0 0 "[ . 1 . 2]" 1
34 1 34 LEU MD2 1 87 LEU MD1 3.050 . 4.290 2.228 1.986 2.868 . 0 0 "[ . 1 . 2]" 1
35 1 85 VAL MG1 1 87 LEU MD1 3.490 . 5.180 3.973 3.552 4.320 . 0 0 "[ . 1 . 2]" 1
36 1 37 ALA MB 1 87 LEU MD1 3.730 . 5.660 3.390 2.738 4.111 . 0 0 "[ . 1 . 2]" 1
37 1 84 VAL MG1 1 86 ARG HG3 4.130 . 6.460 4.718 4.389 5.088 . 0 0 "[ . 1 . 2]" 1
38 1 84 VAL MG2 1 86 ARG HG3 4.130 . 6.460 6.244 5.899 6.546 0.086 8 0 "[ . 1 . 2]" 1
39 1 55 ARG HG3 1 56 ILE MG 3.610 . 5.420 5.361 5.010 5.554 0.134 14 0 "[ . 1 . 2]" 1
40 1 28 ALA MB 1 45 VAL MG1 4.210 . 6.620 5.569 5.045 6.039 . 0 0 "[ . 1 . 2]" 1
41 1 68 VAL MG1 1 81 LEU MD2 3.000 . 4.200 3.090 2.881 3.488 . 0 0 "[ . 1 . 2]" 1
42 1 32 LEU MD2 1 56 ILE HG13 2.550 . 3.300 3.411 3.353 3.488 0.188 17 0 "[ . 1 . 2]" 1
43 1 32 LEU MD2 1 85 VAL MG1 2.750 . 3.700 2.165 2.044 2.294 . 0 0 "[ . 1 . 2]" 1
44 1 43 ARG HG3 1 45 VAL MG2 3.660 . 5.520 4.102 3.595 4.573 . 0 0 "[ . 1 . 2]" 1
45 1 32 LEU MD2 1 56 ILE MD 2.820 . 3.850 1.785 1.728 1.879 0.072 7 0 "[ . 1 . 2]" 1
46 1 30 LEU MD1 1 56 ILE MD 3.620 . 5.440 4.081 3.496 4.728 . 0 0 "[ . 1 . 2]" 1
47 1 30 LEU MD2 1 56 ILE MD 3.620 . 5.440 3.924 2.814 4.746 . 0 0 "[ . 1 . 2]" 1
48 1 32 LEU MD1 1 56 ILE MD 3.080 . 4.360 2.011 1.883 2.284 . 0 0 "[ . 1 . 2]" 1
49 1 56 ILE MD 1 56 ILE MG 2.830 . 3.860 2.006 1.980 2.038 . 0 0 "[ . 1 . 2]" 1
50 1 56 ILE MG 1 60 VAL MG1 3.250 . 4.700 3.758 3.379 4.232 . 0 0 "[ . 1 . 2]" 1
51 1 32 LEU MD2 1 60 VAL MG2 3.250 . 4.700 3.559 3.181 3.751 . 0 0 "[ . 1 . 2]" 1
52 1 56 ILE MG 1 60 VAL MG2 3.470 . 5.140 4.493 4.130 4.833 . 0 0 "[ . 1 . 2]" 1
53 1 65 VAL MG2 1 82 LEU MD1 3.610 . 5.420 3.380 2.787 5.028 . 0 0 "[ . 1 . 2]" 1
54 1 66 ILE MD 1 85 VAL MG2 2.920 . 4.040 2.096 2.055 2.133 . 0 0 "[ . 1 . 2]" 1
55 1 60 VAL MG2 1 66 ILE MD 3.010 . 4.220 2.732 2.389 3.016 . 0 0 "[ . 1 . 2]" 1
56 1 60 VAL MG1 1 66 ILE MD 3.390 . 4.980 3.413 3.096 4.103 . 0 0 "[ . 1 . 2]" 1
57 1 56 ILE MG 1 66 ILE MD 2.830 . 3.860 2.235 1.980 2.581 . 0 0 "[ . 1 . 2]" 1
58 1 66 ILE MG 1 68 VAL MG1 3.600 . 5.400 4.425 4.112 4.795 . 0 0 "[ . 1 . 2]" 1
59 1 66 ILE MG 1 85 VAL MG2 3.950 . 6.100 4.447 4.331 4.526 . 0 0 "[ . 1 . 2]" 1
60 1 66 ILE MG 1 68 VAL MG2 2.890 . 3.980 2.252 1.992 2.580 . 0 0 "[ . 1 . 2]" 1
61 1 66 ILE MD 1 66 ILE MG 2.730 . 3.660 2.075 2.024 2.146 . 0 0 "[ . 1 . 2]" 1
62 1 5 LEU MD1 1 83 LEU MD1 3.400 . 5.000 2.020 1.753 3.035 0.047 14 0 "[ . 1 . 2]" 1
63 1 5 LEU MD2 1 83 LEU MD1 3.400 . 5.000 3.974 3.499 4.401 . 0 0 "[ . 1 . 2]" 1
64 1 81 LEU MD1 1 83 LEU MD1 3.290 . 4.780 3.321 3.028 4.415 . 0 0 "[ . 1 . 2]" 1
65 1 54 VAL MG1 1 83 LEU MD1 2.830 . 3.860 2.007 1.773 2.352 0.027 9 0 "[ . 1 . 2]" 1
66 1 68 VAL MG2 1 83 LEU MD1 2.950 . 4.100 3.411 2.979 3.923 . 0 0 "[ . 1 . 2]" 1
67 1 45 VAL MG2 1 83 LEU MD1 3.960 . 6.120 3.202 2.783 3.661 . 0 0 "[ . 1 . 2]" 1
68 1 66 ILE MG 1 83 LEU MD1 3.350 . 4.900 3.296 2.663 3.828 . 0 0 "[ . 1 . 2]" 1
69 1 32 LEU HG 1 85 VAL MG1 3.880 . 5.960 3.879 3.704 4.042 . 0 0 "[ . 1 . 2]" 1
70 1 85 VAL MG1 1 86 ARG HG2 4.270 . 6.740 5.033 4.800 5.253 . 0 0 "[ . 1 . 2]" 1
71 1 85 VAL MG1 1 87 LEU MD2 2.830 . 3.860 2.303 2.034 2.621 . 0 0 "[ . 1 . 2]" 1
72 1 60 VAL MG2 1 85 VAL MG1 2.220 . 2.640 2.550 2.277 2.702 0.062 19 0 "[ . 1 . 2]" 1
73 1 87 LEU MD2 1 88 LEU MD1 4.160 . 6.520 5.739 5.435 6.139 . 0 0 "[ . 1 . 2]" 1
74 1 60 VAL MG1 1 87 LEU MD2 3.110 . 4.420 3.183 2.618 3.638 . 0 0 "[ . 1 . 2]" 1
75 1 5 LEU MD1 1 83 LEU MD2 3.030 . 4.260 2.019 1.749 3.347 0.051 5 0 "[ . 1 . 2]" 1
76 1 56 ILE H 1 56 ILE MD 3.000 . 4.200 3.484 3.313 3.705 . 0 0 "[ . 1 . 2]" 1
77 1 42 GLU H 1 56 ILE MD 3.690 . 5.580 4.827 4.388 5.504 . 0 0 "[ . 1 . 2]" 1
78 1 41 GLY HA3 1 56 ILE MD 3.730 . 5.660 4.384 3.642 4.952 . 0 0 "[ . 1 . 2]" 1
79 1 55 ARG HA 1 56 ILE MD 3.970 . 6.140 4.862 4.554 5.097 . 0 0 "[ . 1 . 2]" 1
80 1 56 ILE HA 1 56 ILE MD 3.290 . 4.780 4.286 4.274 4.305 . 0 0 "[ . 1 . 2]" 1
81 1 37 ALA HA 1 56 ILE MD 3.310 . 4.820 3.367 2.874 3.812 . 0 0 "[ . 1 . 2]" 1
82 1 40 GLY HA2 1 56 ILE MD 3.580 . 5.360 2.888 2.643 3.204 . 0 0 "[ . 1 . 2]" 1
83 1 40 GLY HA3 1 56 ILE MD 3.580 . 5.360 4.307 4.092 4.616 . 0 0 "[ . 1 . 2]" 1
84 1 56 ILE HB 1 56 ILE MD 2.690 . 3.580 2.658 2.576 2.726 . 0 0 "[ . 1 . 2]" 1
85 1 56 ILE HA 1 66 ILE MD 2.850 . 3.900 2.366 2.076 2.555 . 0 0 "[ . 1 . 2]" 1
86 1 66 ILE MD 1 85 VAL HA 3.060 . 4.320 4.467 4.371 4.545 0.225 16 0 "[ . 1 . 2]" 1
87 1 64 SER HB3 1 66 ILE MD 3.420 . 5.040 5.136 5.055 5.250 0.210 7 0 "[ . 1 . 2]" 1
88 1 66 ILE MD 1 85 VAL HB 3.240 . 4.680 4.402 4.300 4.503 . 0 0 "[ . 1 . 2]" 1
89 1 66 ILE MD 1 83 LEU HB2 2.890 . 3.980 2.882 2.570 3.377 . 0 0 "[ . 1 . 2]" 1
90 1 66 ILE HB 1 66 ILE MD 2.590 . 3.380 2.433 2.398 2.457 . 0 0 "[ . 1 . 2]" 1
91 1 56 ILE MD 1 66 ILE MD 3.250 . 4.700 4.360 3.941 4.727 0.027 4 0 "[ . 1 . 2]" 1
92 1 36 GLU H 1 37 ALA MB 3.410 . 5.020 4.243 4.110 4.346 . 0 0 "[ . 1 . 2]" 1
93 1 34 LEU HA 1 37 ALA MB 2.750 . 3.700 2.508 2.243 2.734 . 0 0 "[ . 1 . 2]" 1
94 1 36 GLU HB2 1 37 ALA MB 3.260 . 4.720 4.167 3.747 4.522 . 0 0 "[ . 1 . 2]" 1
95 1 32 LEU HG 1 37 ALA MB 3.070 . 4.340 3.010 2.637 3.635 . 0 0 "[ . 1 . 2]" 1
96 1 32 LEU HB3 1 37 ALA MB 2.830 . 3.860 3.682 3.369 3.952 0.092 4 0 "[ . 1 . 2]" 1
97 1 37 ALA MB 1 60 VAL MG1 2.480 . 3.160 2.430 2.204 2.706 . 0 0 "[ . 1 . 2]" 1
98 1 32 LEU MD2 1 37 ALA MB 2.420 . 3.040 2.645 2.384 2.993 . 0 0 "[ . 1 . 2]" 1
99 1 66 ILE H 1 66 ILE MG 3.080 . 4.360 3.832 3.773 3.874 . 0 0 "[ . 1 . 2]" 1
100 1 66 ILE MG 1 67 ARG HA 3.230 . 4.660 4.210 4.104 4.300 . 0 0 "[ . 1 . 2]" 1
101 1 66 ILE HA 1 66 ILE MG 2.550 . 3.300 2.444 2.414 2.552 . 0 0 "[ . 1 . 2]" 1
102 1 66 ILE MG 1 83 LEU HB2 3.070 . 4.340 3.481 3.164 3.674 . 0 0 "[ . 1 . 2]" 1
103 1 55 ARG H 1 56 ILE MG 3.390 . 4.980 4.748 4.387 5.050 0.070 6 0 "[ . 1 . 2]" 1
104 1 56 ILE HA 1 56 ILE MG 2.750 . 3.700 2.423 2.397 2.460 . 0 0 "[ . 1 . 2]" 1
105 1 56 ILE MG 1 60 VAL HB 3.840 . 5.880 5.467 5.052 5.868 . 0 0 "[ . 1 . 2]" 1
106 1 56 ILE HG12 1 56 ILE MG 2.780 . 3.760 2.636 2.526 2.719 . 0 0 "[ . 1 . 2]" 1
107 1 32 LEU MD2 1 56 ILE MG 2.690 . 3.580 2.665 2.246 3.190 . 0 0 "[ . 1 . 2]" 1
108 1 37 ALA H 1 60 VAL MG1 3.410 . 5.020 4.465 4.293 4.622 . 0 0 "[ . 1 . 2]" 1
109 1 60 VAL HA 1 60 VAL MG1 2.900 . 4.000 3.272 3.259 3.283 . 0 0 "[ . 1 . 2]" 1
110 1 37 ALA HA 1 60 VAL MG1 2.640 . 3.480 2.186 1.990 2.355 . 0 0 "[ . 1 . 2]" 1
111 1 32 LEU MD2 1 60 VAL MG1 2.710 . 3.620 2.108 2.027 2.229 . 0 0 "[ . 1 . 2]" 1
112 1 45 VAL HA 1 45 VAL MG2 2.950 . 4.100 3.262 3.251 3.274 . 0 0 "[ . 1 . 2]" 1
113 1 67 ARG HA 1 68 VAL MG2 3.060 . 4.320 3.736 3.616 3.879 . 0 0 "[ . 1 . 2]" 1
114 1 68 VAL HA 1 68 VAL MG2 2.700 . 3.600 2.599 2.532 2.641 . 0 0 "[ . 1 . 2]" 1
115 1 84 VAL HA 1 84 VAL MG2 2.950 . 4.100 2.550 2.505 2.628 . 0 0 "[ . 1 . 2]" 1
116 1 68 VAL MG2 1 69 PRO HD3 3.510 . 5.220 4.621 4.260 4.849 . 0 0 "[ . 1 . 2]" 1
117 1 68 VAL MG2 1 69 PRO HD2 3.260 . 4.720 4.309 4.036 4.812 0.092 2 0 "[ . 1 . 2]" 1
118 1 68 VAL MG2 1 81 LEU HG 3.050 . 4.300 3.460 3.181 3.778 . 0 0 "[ . 1 . 2]" 1
119 1 84 VAL H 1 84 VAL MG1 3.080 . 4.360 3.850 3.824 3.878 . 0 0 "[ . 1 . 2]" 1
120 1 84 VAL HA 1 84 VAL MG1 2.950 . 4.100 2.394 2.337 2.441 . 0 0 "[ . 1 . 2]" 1
121 1 44 VAL H 1 44 VAL MG2 3.050 . 4.290 2.759 2.158 3.886 . 0 0 "[ . 1 . 2]" 1
122 1 65 VAL HA 1 65 VAL MG1 2.650 . 3.500 3.182 2.424 3.283 . 0 0 "[ . 1 . 2]" 1
123 1 65 VAL MG1 1 84 VAL HA 3.070 . 4.340 4.310 3.011 4.546 0.206 11 0 "[ . 1 . 2]" 1
124 1 45 VAL HA 1 45 VAL MG1 2.950 . 4.100 2.439 2.370 2.505 . 0 0 "[ . 1 . 2]" 1
125 1 54 VAL HA 1 54 VAL MG2 2.670 . 3.540 2.416 2.378 2.460 . 0 0 "[ . 1 . 2]" 1
126 1 61 ARG HA 1 85 VAL MG1 3.230 . 4.660 4.018 3.600 4.675 0.015 9 0 "[ . 1 . 2]" 1
127 1 85 VAL HA 1 85 VAL MG1 2.700 . 3.600 2.494 2.443 2.542 . 0 0 "[ . 1 . 2]" 1
128 1 62 GLU HA 1 85 VAL MG1 2.850 . 3.900 3.278 2.971 3.532 . 0 0 "[ . 1 . 2]" 1
129 1 64 SER HB2 1 85 VAL MG1 3.110 . 4.420 3.750 3.582 3.872 . 0 0 "[ . 1 . 2]" 1
130 1 85 VAL MG1 1 87 LEU HG 2.920 . 4.040 3.045 2.652 3.426 . 0 0 "[ . 1 . 2]" 1
131 1 60 VAL MG1 1 85 VAL MG1 2.480 . 3.160 2.276 1.994 2.806 . 0 0 "[ . 1 . 2]" 1
132 1 44 VAL H 1 44 VAL MG1 3.050 . 4.290 3.289 1.993 3.870 . 0 0 "[ . 1 . 2]" 1
133 1 60 VAL H 1 60 VAL MG2 3.060 . 4.320 3.835 3.815 3.854 . 0 0 "[ . 1 . 2]" 1
134 1 60 VAL MG2 1 64 SER HA 3.310 . 4.820 4.573 4.403 4.788 . 0 0 "[ . 1 . 2]" 1
135 1 60 VAL HA 1 60 VAL MG2 2.620 . 3.440 2.370 2.315 2.411 . 0 0 "[ . 1 . 2]" 1
136 1 60 VAL MG2 1 64 SER HB3 3.010 . 4.220 2.648 2.400 2.990 . 0 0 "[ . 1 . 2]" 1
137 1 60 VAL MG2 1 64 SER HB2 3.070 . 4.340 2.234 2.091 2.356 . 0 0 "[ . 1 . 2]" 1
138 1 60 VAL MG2 1 85 VAL HB 2.880 . 3.960 2.880 2.698 3.107 . 0 0 "[ . 1 . 2]" 1
139 1 57 PRO HG2 1 60 VAL MG2 2.870 . 3.940 2.581 2.205 3.069 . 0 0 "[ . 1 . 2]" 1
140 1 37 ALA MB 1 60 VAL MG2 3.250 . 4.700 4.223 4.017 4.416 . 0 0 "[ . 1 . 2]" 1
141 1 65 VAL HA 1 65 VAL MG2 2.650 . 3.500 2.430 2.371 2.531 . 0 0 "[ . 1 . 2]" 1
142 1 65 VAL MG2 1 84 VAL HA 3.070 . 4.340 3.055 2.266 3.311 . 0 0 "[ . 1 . 2]" 1
143 1 7 THR HA 1 7 THR MG 2.760 . 3.720 2.507 2.429 2.572 . 0 0 "[ . 1 . 2]" 1
144 1 10 THR HA 1 10 THR MG 2.700 . 3.600 3.095 2.369 3.287 . 0 0 "[ . 1 . 2]" 1
145 1 33 THR HA 1 33 THR MG 2.760 . 3.720 2.421 2.340 2.489 . 0 0 "[ . 1 . 2]" 1
146 1 28 ALA MB 1 83 LEU HA 3.100 . 4.400 3.899 3.519 4.250 . 0 0 "[ . 1 . 2]" 1
147 1 88 LEU HA 1 88 LEU MD2 2.500 . 3.200 2.116 2.012 2.211 . 0 0 "[ . 1 . 2]" 1
148 1 88 LEU MD2 1 89 PRO HD3 2.840 . 3.880 3.533 3.092 3.950 0.070 19 0 "[ . 1 . 2]" 1
149 1 88 LEU MD2 1 89 PRO HD2 2.780 . 3.760 3.141 2.604 3.613 . 0 0 "[ . 1 . 2]" 1
150 1 31 PRO HB3 1 88 LEU MD2 2.820 . 3.840 2.447 2.184 3.309 . 0 0 "[ . 1 . 2]" 1
151 1 31 PRO HB2 1 88 LEU MD2 2.820 . 3.840 2.656 2.196 3.927 0.087 18 0 "[ . 1 . 2]" 1
152 1 4 LEU HB2 1 4 LEU MD2 2.370 . 2.940 2.287 2.261 2.324 . 0 0 "[ . 1 . 2]" 1
153 1 26 LEU H 1 26 LEU MD2 3.110 . 4.420 2.976 2.892 3.144 . 0 0 "[ . 1 . 2]" 1
154 1 6 PHE HE1 1 26 LEU MD2 3.090 . 4.380 4.193 3.326 4.455 0.075 9 0 "[ . 1 . 2]" 1
155 1 6 PHE HD1 1 26 LEU MD2 3.060 . 4.320 3.963 3.016 4.366 0.046 19 0 "[ . 1 . 2]" 1
156 1 26 LEU HA 1 26 LEU MD2 2.610 . 3.420 2.306 2.249 2.366 . 0 0 "[ . 1 . 2]" 1
157 1 8 PRO HA 1 26 LEU MD2 2.990 . 4.180 3.298 2.890 3.533 . 0 0 "[ . 1 . 2]" 1
158 1 7 THR HB 1 26 LEU MD2 3.250 . 4.700 3.120 2.794 3.454 . 0 0 "[ . 1 . 2]" 1
159 1 26 LEU MD2 1 73 GLY HA2 3.070 . 4.340 2.970 2.266 3.789 . 0 0 "[ . 1 . 2]" 1
160 1 26 LEU HB2 1 26 LEU MD2 2.750 . 3.700 3.253 3.234 3.263 . 0 0 "[ . 1 . 2]" 1
161 1 68 VAL H 1 68 VAL MG1 3.270 . 4.740 3.923 3.863 3.960 . 0 0 "[ . 1 . 2]" 1
162 1 32 LEU H 1 85 VAL MG2 4.000 . 6.200 5.774 5.640 5.912 . 0 0 "[ . 1 . 2]" 1
163 1 84 VAL H 1 85 VAL MG2 4.280 . 6.760 5.026 4.855 5.191 . 0 0 "[ . 1 . 2]" 1
164 1 85 VAL MG2 1 86 ARG H 3.070 . 4.340 4.028 3.862 4.190 . 0 0 "[ . 1 . 2]" 1
165 1 65 VAL HA 1 85 VAL MG2 3.570 . 5.340 3.783 3.533 3.960 . 0 0 "[ . 1 . 2]" 1
166 1 68 VAL MG1 1 71 MET HA 3.890 . 5.980 4.502 4.171 4.748 . 0 0 "[ . 1 . 2]" 1
167 1 68 VAL HA 1 68 VAL MG1 2.580 . 3.360 2.366 2.326 2.407 . 0 0 "[ . 1 . 2]" 1
168 1 85 VAL HA 1 85 VAL MG2 2.610 . 3.410 2.381 2.333 2.416 . 0 0 "[ . 1 . 2]" 1
169 1 64 SER HB2 1 85 VAL MG2 2.780 . 3.760 3.159 2.928 3.394 . 0 0 "[ . 1 . 2]" 1
170 1 32 LEU HA 1 32 LEU MD1 2.520 . 3.240 2.033 1.987 2.133 . 0 0 "[ . 1 . 2]" 1
171 1 32 LEU MD1 1 36 GLU HB3 2.840 . 3.880 2.214 2.015 2.354 . 0 0 "[ . 1 . 2]" 1
172 1 32 LEU HB2 1 32 LEU MD1 2.680 . 3.560 2.397 2.366 2.416 . 0 0 "[ . 1 . 2]" 1
173 1 87 LEU H 1 87 LEU MD2 3.190 . 4.580 3.278 2.895 3.589 . 0 0 "[ . 1 . 2]" 1
174 1 32 LEU H 1 87 LEU MD2 3.480 . 5.160 4.231 3.715 4.581 . 0 0 "[ . 1 . 2]" 1
175 1 34 LEU H 1 87 LEU MD2 3.720 . 5.640 4.399 3.859 4.883 . 0 0 "[ . 1 . 2]" 1
176 1 62 GLU H 1 87 LEU MD2 3.080 . 4.360 3.789 3.466 4.357 . 0 0 "[ . 1 . 2]" 1
177 1 87 LEU HA 1 87 LEU MD2 2.540 . 3.280 2.024 1.973 2.124 . 0 0 "[ . 1 . 2]" 1
178 1 61 ARG HA 1 87 LEU MD2 2.990 . 4.180 2.846 2.073 3.776 . 0 0 "[ . 1 . 2]" 1
179 1 62 GLU HB2 1 87 LEU MD2 3.050 . 4.300 4.172 3.866 4.320 0.020 6 0 "[ . 1 . 2]" 1
180 1 87 LEU HB2 1 87 LEU MD2 2.750 . 3.700 3.252 3.239 3.266 . 0 0 "[ . 1 . 2]" 1
181 1 87 LEU HB3 1 87 LEU MD2 2.370 . 2.940 2.536 2.489 2.617 . 0 0 "[ . 1 . 2]" 1
182 1 82 LEU MD2 1 83 LEU H 3.020 . 4.240 3.914 3.636 4.207 . 0 0 "[ . 1 . 2]" 1
183 1 65 VAL MG2 1 82 LEU MD2 3.100 . 4.400 2.356 2.035 4.309 . 0 0 "[ . 1 . 2]" 1
184 1 34 LEU HA 1 34 LEU MD2 2.790 . 3.780 2.075 1.967 2.141 . 0 0 "[ . 1 . 2]" 1
185 1 5 LEU H 1 5 LEU MD2 3.340 . 4.880 4.914 4.400 5.075 0.195 1 0 "[ . 1 . 2]" 1
186 1 5 LEU HA 1 5 LEU MD2 3.000 . 4.200 3.723 2.486 3.948 . 0 0 "[ . 1 . 2]" 1
187 1 2 LEU HA 1 2 LEU MD2 3.250 . 4.700 3.675 2.714 4.140 . 0 0 "[ . 1 . 2]" 1
188 1 2 LEU MD2 1 7 THR HA 3.510 . 5.220 3.829 3.092 4.494 . 0 0 "[ . 1 . 2]" 1
189 1 4 LEU MD2 1 31 PRO HD2 3.000 . 4.200 2.150 1.918 2.428 . 0 0 "[ . 1 . 2]" 1
190 1 2 LEU HA 1 2 LEU MD1 3.250 . 4.700 4.073 3.760 4.200 . 0 0 "[ . 1 . 2]" 1
191 1 2 LEU MD1 1 7 THR HA 3.510 . 5.220 3.888 2.896 5.100 . 0 0 "[ . 1 . 2]" 1
192 1 82 LEU H 1 82 LEU MD1 3.180 . 4.560 4.120 3.972 4.228 . 0 0 "[ . 1 . 2]" 1
193 1 26 LEU H 1 82 LEU MD1 3.790 . 5.780 5.224 4.230 5.751 . 0 0 "[ . 1 . 2]" 1
194 1 27 ARG HA 1 82 LEU MD1 3.250 . 4.700 3.720 3.328 4.185 . 0 0 "[ . 1 . 2]" 1
195 1 34 LEU HA 1 34 LEU MD1 3.200 . 4.600 3.919 3.862 3.949 . 0 0 "[ . 1 . 2]" 1
196 1 27 ARG HB2 1 82 LEU MD1 2.730 . 3.660 2.313 2.015 2.810 . 0 0 "[ . 1 . 2]" 1
197 1 82 LEU HB3 1 82 LEU MD1 2.610 . 3.420 2.504 2.413 2.581 . 0 0 "[ . 1 . 2]" 1
198 1 83 LEU HA 1 83 LEU MD2 2.630 . 3.460 2.003 1.948 2.117 . 0 0 "[ . 1 . 2]" 1
199 1 28 ALA HA 1 83 LEU MD2 3.620 . 5.440 4.580 4.305 4.982 . 0 0 "[ . 1 . 2]" 1
200 1 83 LEU HB2 1 83 LEU MD2 2.820 . 3.840 3.252 3.240 3.261 . 0 0 "[ . 1 . 2]" 1
201 1 30 LEU HB3 1 83 LEU MD2 3.180 . 4.560 4.148 3.602 4.506 . 0 0 "[ . 1 . 2]" 1
202 1 28 ALA MB 1 83 LEU MD2 2.450 . 3.100 2.497 2.234 2.855 . 0 0 "[ . 1 . 2]" 1
203 1 26 LEU HA 1 26 LEU MD1 3.440 . 5.080 3.874 3.818 3.936 . 0 0 "[ . 1 . 2]" 1
204 1 26 LEU MD1 1 81 LEU HA 3.560 . 5.320 4.767 4.206 5.145 . 0 0 "[ . 1 . 2]" 1
205 1 26 LEU HB3 1 26 LEU MD1 2.870 . 3.940 2.336 2.291 2.394 . 0 0 "[ . 1 . 2]" 1
206 1 26 LEU HB2 1 26 LEU MD1 2.870 . 3.940 2.487 2.423 2.525 . 0 0 "[ . 1 . 2]" 1
207 1 26 LEU MD1 1 48 ALA MB 3.350 . 4.900 4.565 4.215 4.910 0.010 5 0 "[ . 1 . 2]" 1
208 1 26 LEU MD1 1 81 LEU HB2 3.480 . 5.160 4.799 4.384 5.172 0.012 12 0 "[ . 1 . 2]" 1
209 1 4 LEU MD1 1 5 LEU H 3.290 . 4.780 1.993 1.601 3.915 0.199 16 0 "[ . 1 . 2]" 1
210 1 32 LEU HA 1 88 LEU MD1 3.400 . 5.000 3.645 3.418 4.002 . 0 0 "[ . 1 . 2]" 1
211 1 4 LEU HA 1 4 LEU MD1 3.380 . 4.960 2.197 2.038 2.572 . 0 0 "[ . 1 . 2]" 1
212 1 4 LEU MD1 1 5 LEU HA 3.580 . 5.360 3.494 3.216 4.020 . 0 0 "[ . 1 . 2]" 1
213 1 88 LEU MD1 1 89 PRO HD2 3.260 . 4.720 4.327 3.798 4.660 . 0 0 "[ . 1 . 2]" 1
214 1 4 LEU MD1 1 28 ALA MB 3.010 . 4.220 2.857 2.297 3.743 . 0 0 "[ . 1 . 2]" 1
215 1 88 LEU H 1 88 LEU MD1 3.120 . 4.440 3.728 3.604 4.003 . 0 0 "[ . 1 . 2]" 1
216 1 33 THR HA 1 88 LEU MD1 3.070 . 4.340 3.492 3.060 4.090 . 0 0 "[ . 1 . 2]" 1
217 1 88 LEU HA 1 88 LEU MD1 3.140 . 4.480 3.929 3.868 3.967 . 0 0 "[ . 1 . 2]" 1
218 1 31 PRO HB3 1 88 LEU MD1 3.130 . 4.460 3.232 2.439 3.722 . 0 0 "[ . 1 . 2]" 1
219 1 31 PRO HB2 1 88 LEU MD1 3.130 . 4.460 2.053 1.776 2.417 0.024 8 0 "[ . 1 . 2]" 1
220 1 88 LEU HB2 1 88 LEU MD1 2.330 . 2.860 2.398 2.369 2.426 . 0 0 "[ . 1 . 2]" 1
221 1 33 THR MG 1 88 LEU MD1 2.630 . 3.460 2.391 1.919 3.516 0.056 1 0 "[ . 1 . 2]" 1
222 1 87 LEU HA 1 87 LEU MD1 3.150 . 4.510 3.868 3.825 3.898 . 0 0 "[ . 1 . 2]" 1
223 1 61 ARG HA 1 87 LEU MD1 2.880 . 3.960 2.042 1.783 2.383 0.017 13 0 "[ . 1 . 2]" 1
224 1 62 GLU HA 1 87 LEU MD1 3.070 . 4.340 3.624 3.124 3.921 . 0 0 "[ . 1 . 2]" 1
225 1 62 GLU HG2 1 87 LEU MD1 3.460 . 5.120 4.439 4.115 4.710 . 0 0 "[ . 1 . 2]" 1
226 1 62 GLU HB2 1 87 LEU MD1 2.860 . 3.920 2.466 2.120 2.787 . 0 0 "[ . 1 . 2]" 1
227 1 87 LEU HB2 1 87 LEU MD1 2.670 . 3.540 2.447 2.405 2.513 . 0 0 "[ . 1 . 2]" 1
228 1 87 LEU HB3 1 87 LEU MD1 2.630 . 3.460 2.379 2.341 2.431 . 0 0 "[ . 1 . 2]" 1
229 1 32 LEU HA 1 32 LEU MD2 3.170 . 4.540 3.929 3.913 3.944 . 0 0 "[ . 1 . 2]" 1
230 1 32 LEU MD2 1 85 VAL HA 3.690 . 5.580 4.205 3.892 4.496 . 0 0 "[ . 1 . 2]" 1
231 1 32 LEU MD2 1 37 ALA HA 2.710 . 3.620 2.342 2.003 2.602 . 0 0 "[ . 1 . 2]" 1
232 1 32 LEU MD2 1 36 GLU HB3 3.190 . 4.580 3.765 3.103 4.141 . 0 0 "[ . 1 . 2]" 1
233 1 32 LEU MD2 1 60 VAL HB 3.140 . 4.480 4.390 4.224 4.499 0.019 3 0 "[ . 1 . 2]" 1
234 1 83 LEU H 1 83 LEU MD1 3.260 . 4.720 4.011 3.785 4.212 . 0 0 "[ . 1 . 2]" 1
235 1 83 LEU HA 1 83 LEU MD1 3.210 . 4.620 3.889 3.853 3.928 . 0 0 "[ . 1 . 2]" 1
236 1 83 LEU HB2 1 83 LEU MD1 2.760 . 3.720 2.343 2.305 2.434 . 0 0 "[ . 1 . 2]" 1
237 1 66 ILE HB 1 83 LEU MD1 2.910 . 4.020 3.186 2.572 3.754 . 0 0 "[ . 1 . 2]" 1
238 1 83 LEU HB3 1 83 LEU MD1 2.750 . 3.700 2.451 2.378 2.490 . 0 0 "[ . 1 . 2]" 1
239 1 30 LEU HB2 1 83 LEU MD1 3.190 . 4.580 3.475 3.063 3.780 . 0 0 "[ . 1 . 2]" 1
240 1 30 LEU H 1 30 LEU MD1 3.470 . 5.140 4.418 4.303 4.465 . 0 0 "[ . 1 . 2]" 1
241 1 81 LEU HA 1 81 LEU MD2 3.190 . 4.580 3.944 3.903 3.983 . 0 0 "[ . 1 . 2]" 1
242 1 30 LEU HB3 1 30 LEU MD1 2.730 . 3.660 2.641 2.378 3.273 . 0 0 "[ . 1 . 2]" 1
243 1 81 LEU HB3 1 81 LEU MD2 2.830 . 3.860 2.325 2.274 2.379 . 0 0 "[ . 1 . 2]" 1
244 1 30 LEU MD1 1 43 ARG HG2 2.850 . 3.900 2.490 1.777 3.563 0.023 13 0 "[ . 1 . 2]" 1
245 1 81 LEU HB2 1 81 LEU MD2 2.700 . 3.600 2.448 2.400 2.490 . 0 0 "[ . 1 . 2]" 1
246 1 30 LEU H 1 30 LEU MD2 3.470 . 5.140 4.343 4.261 4.449 . 0 0 "[ . 1 . 2]" 1
247 1 30 LEU HB3 1 30 LEU MD2 2.730 . 3.660 2.506 2.373 2.619 . 0 0 "[ . 1 . 2]" 1
248 1 30 LEU MD2 1 43 ARG HG2 2.850 . 3.900 2.173 1.765 3.344 0.035 15 0 "[ . 1 . 2]" 1
249 1 4 LEU H 1 4 LEU HG 3.910 . 6.020 4.708 4.359 4.946 . 0 0 "[ . 1 . 2]" 1
250 1 4 LEU HG 1 5 LEU H 4.090 . 6.380 3.081 2.733 3.603 . 0 0 "[ . 1 . 2]" 1
251 1 61 ARG HA 1 87 LEU HG 3.030 . 4.260 3.411 2.857 4.270 0.010 6 0 "[ . 1 . 2]" 1
252 1 62 GLU HB2 1 87 LEU HG 3.250 . 4.700 2.571 2.142 2.834 . 0 0 "[ . 1 . 2]" 1
253 1 55 ARG HG2 1 56 ILE H 3.230 . 4.660 3.522 3.182 3.998 . 0 0 "[ . 1 . 2]" 1
254 1 55 ARG HA 1 55 ARG HG2 3.030 . 4.260 3.244 3.088 3.374 . 0 0 "[ . 1 . 2]" 1
255 1 55 ARG HA 1 55 ARG HG3 3.140 . 4.480 2.566 2.452 2.647 . 0 0 "[ . 1 . 2]" 1
256 1 4 LEU MD2 1 31 PRO HG2 3.330 . 4.860 2.707 2.167 3.361 . 0 0 "[ . 1 . 2]" 1
257 1 61 ARG HG2 1 62 GLU HB3 3.400 . 5.000 5.142 5.048 5.222 0.222 11 0 "[ . 1 . 2]" 1
258 1 74 GLN H 1 74 GLN HB3 2.920 . 4.040 3.638 3.605 3.669 . 0 0 "[ . 1 . 2]" 1
259 1 74 GLN HB2 1 75 GLY H 3.230 . 4.660 3.883 3.432 4.376 . 0 0 "[ . 1 . 2]" 1
260 1 36 GLU H 1 36 GLU HB2 3.180 . 4.560 2.432 2.322 2.505 . 0 0 "[ . 1 . 2]" 1
261 1 32 LEU MD1 1 36 GLU HB2 3.010 . 4.220 2.647 2.372 3.072 . 0 0 "[ . 1 . 2]" 1
262 1 33 THR HA 1 36 GLU HB2 3.460 . 5.120 4.753 4.402 4.943 . 0 0 "[ . 1 . 2]" 1
263 1 51 ARG H 1 51 ARG HB2 3.000 . 4.200 2.711 2.329 3.662 . 0 0 "[ . 1 . 2]" 1
264 1 24 ARG H 1 24 ARG HB3 3.060 . 4.320 3.467 2.619 3.741 . 0 0 "[ . 1 . 2]" 1
265 1 51 ARG H 1 51 ARG HB3 3.000 . 4.200 2.589 2.384 2.944 . 0 0 "[ . 1 . 2]" 1
266 1 36 GLU H 1 36 GLU HB3 3.070 . 4.340 3.587 3.555 3.625 . 0 0 "[ . 1 . 2]" 1
267 1 68 VAL HB 1 69 PRO HD2 3.480 . 5.160 4.708 4.426 5.102 . 0 0 "[ . 1 . 2]" 1
268 1 60 VAL HB 1 61 ARG H 3.230 . 4.660 4.068 3.977 4.156 . 0 0 "[ . 1 . 2]" 1
269 1 37 ALA HA 1 60 VAL HB 3.310 . 4.820 4.730 4.510 4.874 0.054 15 0 "[ . 1 . 2]" 1
270 1 42 GLU H 1 42 GLU HB3 3.030 . 4.260 3.668 3.609 3.778 . 0 0 "[ . 1 . 2]" 1
271 1 5 LEU HG 1 47 VAL HB 3.180 . 4.560 3.289 2.108 4.496 . 0 0 "[ . 1 . 2]" 1
272 1 62 GLU HA 1 62 GLU HG3 3.230 . 4.660 3.363 3.295 3.449 . 0 0 "[ . 1 . 2]" 1
273 1 52 VAL H 1 52 VAL HB 3.200 . 4.600 3.167 2.543 3.899 . 0 0 "[ . 1 . 2]" 1
274 1 52 VAL HB 1 53 SER H 3.250 . 4.700 3.671 2.610 4.344 . 0 0 "[ . 1 . 2]" 1
275 1 54 VAL HB 1 55 ARG H 3.430 . 5.060 4.240 4.020 4.487 . 0 0 "[ . 1 . 2]" 1
276 1 42 GLU HA 1 42 GLU HG2 3.130 . 4.460 3.736 3.675 3.785 . 0 0 "[ . 1 . 2]" 1
277 1 42 GLU HG3 1 43 ARG H 3.230 . 4.660 3.969 3.789 4.217 . 0 0 "[ . 1 . 2]" 1
278 1 46 GLU HG2 1 47 VAL H 3.720 . 5.640 3.502 2.764 5.279 . 0 0 "[ . 1 . 2]" 1
279 1 66 ILE HB 1 83 LEU HB2 3.000 . 4.200 1.973 1.715 2.336 0.085 5 0 "[ . 1 . 2]" 1
280 1 25 ASP H 1 25 ASP HB2 3.090 . 4.380 2.678 2.477 3.525 . 0 0 "[ . 1 . 2]" 1
281 1 4 LEU H 1 4 LEU HB3 3.090 . 4.380 2.831 2.221 3.334 . 0 0 "[ . 1 . 2]" 1
282 1 4 LEU H 1 4 LEU HB2 3.080 . 4.360 3.072 2.450 3.607 . 0 0 "[ . 1 . 2]" 1
283 1 82 LEU HB2 1 82 LEU MD1 2.820 . 3.840 2.351 2.297 2.405 . 0 0 "[ . 1 . 2]" 1
284 1 33 THR HA 1 88 LEU HB2 3.150 . 4.500 2.408 1.912 2.853 . 0 0 "[ . 1 . 2]" 1
285 1 34 LEU H 1 34 LEU HB3 3.150 . 4.500 3.609 3.573 3.629 . 0 0 "[ . 1 . 2]" 1
286 1 30 LEU H 1 83 LEU HB3 3.500 . 5.200 4.234 3.921 4.563 . 0 0 "[ . 1 . 2]" 1
287 1 30 LEU HB3 1 83 LEU HB3 3.250 . 4.700 3.394 2.952 3.614 . 0 0 "[ . 1 . 2]" 1
288 1 66 ILE HB 1 83 LEU HB3 3.410 . 5.020 3.497 3.104 3.716 . 0 0 "[ . 1 . 2]" 1
289 1 30 LEU HB2 1 83 LEU HB3 3.240 . 4.680 2.308 2.020 2.739 . 0 0 "[ . 1 . 2]" 1
290 1 83 LEU HB3 1 83 LEU MD2 2.830 . 3.860 2.433 2.383 2.524 . 0 0 "[ . 1 . 2]" 1
291 1 26 LEU HB3 1 26 LEU MD2 2.750 . 3.700 2.638 2.545 2.682 . 0 0 "[ . 1 . 2]" 1
292 1 81 LEU H 1 81 LEU HB3 3.180 . 4.560 2.529 2.403 2.640 . 0 0 "[ . 1 . 2]" 1
293 1 68 VAL HB 1 81 LEU HB3 2.920 . 4.040 2.072 1.871 2.248 . 0 0 "[ . 1 . 2]" 1
294 1 68 VAL HB 1 81 LEU HB2 3.030 . 4.260 3.357 3.051 3.613 . 0 0 "[ . 1 . 2]" 1
295 1 32 LEU HB3 1 32 LEU MD2 2.810 . 3.820 2.333 2.307 2.370 . 0 0 "[ . 1 . 2]" 1
296 1 32 LEU HB2 1 32 LEU MD2 2.810 . 3.820 2.479 2.430 2.533 . 0 0 "[ . 1 . 2]" 1
297 1 25 ASP HA 1 79 GLY HA2 3.440 . 5.080 4.416 3.714 5.048 . 0 0 "[ . 1 . 2]" 1
298 1 69 PRO HB2 1 70 GLY HA2 3.470 . 5.140 4.929 4.649 5.228 0.088 2 0 "[ . 1 . 2]" 1
299 1 43 ARG HD2 1 45 VAL HA 3.560 . 5.320 5.279 4.396 5.493 0.173 9 0 "[ . 1 . 2]" 1
300 1 80 ASP HB3 1 81 LEU H 3.290 . 4.780 3.351 2.529 3.988 . 0 0 "[ . 1 . 2]" 1
301 1 68 VAL HA 1 69 PRO HD3 2.580 . 3.360 2.506 2.042 2.858 . 0 0 "[ . 1 . 2]" 1
302 1 68 VAL MG1 1 69 PRO HD3 3.180 . 4.560 4.085 3.698 4.473 . 0 0 "[ . 1 . 2]" 1
303 1 68 VAL HA 1 69 PRO HD2 2.590 . 3.380 2.189 2.000 2.662 . 0 0 "[ . 1 . 2]" 1
304 1 68 VAL MG1 1 69 PRO HD2 2.890 . 3.980 3.045 2.550 3.464 . 0 0 "[ . 1 . 2]" 1
305 1 4 LEU MD2 1 31 PRO HD3 3.000 . 4.200 3.388 3.170 3.644 . 0 0 "[ . 1 . 2]" 1
306 1 7 THR HA 1 8 PRO HD2 2.690 . 3.580 2.244 2.074 2.497 . 0 0 "[ . 1 . 2]" 1
307 1 7 THR HA 1 8 PRO HD3 2.690 . 3.580 2.456 2.260 2.697 . 0 0 "[ . 1 . 2]" 1
308 1 88 LEU HA 1 89 PRO HD3 2.630 . 3.460 2.296 1.942 2.665 . 0 0 "[ . 1 . 2]" 1
309 1 88 LEU HB2 1 89 PRO HD3 3.470 . 5.140 4.779 4.155 5.142 0.002 12 0 "[ . 1 . 2]" 1
310 1 88 LEU HA 1 89 PRO HD2 2.670 . 3.540 2.497 2.053 3.139 . 0 0 "[ . 1 . 2]" 1
311 1 88 LEU HB2 1 89 PRO HD2 2.880 . 3.960 3.988 3.840 4.203 0.243 12 0 "[ . 1 . 2]" 1
312 1 26 LEU H 1 81 LEU HA 3.400 . 5.000 3.065 2.910 3.248 . 0 0 "[ . 1 . 2]" 1
313 1 81 LEU HA 1 81 LEU MD1 2.630 . 3.460 2.135 1.971 2.249 . 0 0 "[ . 1 . 2]" 1
314 1 87 LEU HA 1 87 LEU HG 2.900 . 4.000 3.228 3.098 3.411 . 0 0 "[ . 1 . 2]" 1
315 1 87 LEU HA 1 88 LEU MD2 3.470 . 5.140 4.462 4.236 4.827 . 0 0 "[ . 1 . 2]" 1
316 1 72 GLY H 1 80 ASP HA 3.100 . 4.400 3.378 2.876 3.621 . 0 0 "[ . 1 . 2]" 1
317 1 71 MET H 1 80 ASP HA 3.240 . 4.680 3.554 2.783 4.180 . 0 0 "[ . 1 . 2]" 1
318 1 42 GLU HA 1 55 ARG HA 2.800 . 3.800 2.098 1.856 2.274 . 0 0 "[ . 1 . 2]" 1
319 1 42 GLU HA 1 42 GLU HG3 3.020 . 4.240 2.525 2.434 2.603 . 0 0 "[ . 1 . 2]" 1
320 1 27 ARG HA 1 82 LEU HB2 3.170 . 4.540 2.112 1.826 2.427 . 0 0 "[ . 1 . 2]" 1
321 1 27 ARG HA 1 82 LEU HB3 3.200 . 4.600 3.502 3.116 3.734 . 0 0 "[ . 1 . 2]" 1
322 1 27 ARG HA 1 82 LEU MD2 3.900 . 6.000 4.929 4.707 5.150 . 0 0 "[ . 1 . 2]" 1
323 1 51 ARG HA 1 52 VAL H 2.780 . 3.760 2.189 2.140 2.240 . 0 0 "[ . 1 . 2]" 1
324 1 46 GLU HA 1 51 ARG HA 3.010 . 4.220 2.572 1.934 3.130 . 0 0 "[ . 1 . 2]" 1
325 1 51 ARG HA 1 52 VAL HB 4.040 . 6.280 5.086 4.485 5.928 . 0 0 "[ . 1 . 2]" 1
326 1 67 ARG HA 1 82 LEU MD2 2.900 . 4.000 2.387 1.971 2.703 . 0 0 "[ . 1 . 2]" 1
327 1 54 VAL HA 1 55 ARG HA 3.560 . 5.320 4.409 4.354 4.480 . 0 0 "[ . 1 . 2]" 1
328 1 55 ARG HA 1 56 ILE HA 3.760 . 5.720 4.465 4.443 4.490 . 0 0 "[ . 1 . 2]" 1
329 1 50 ARG HA 1 51 ARG H 2.570 . 3.340 2.220 2.154 2.365 . 0 0 "[ . 1 . 2]" 1
330 1 5 LEU HA 1 5 LEU MD1 3.000 . 4.200 2.350 1.957 3.865 . 0 0 "[ . 1 . 2]" 1
331 1 4 LEU HA 1 4 LEU MD2 2.810 . 3.820 3.819 3.779 3.851 0.031 20 0 "[ . 1 . 2]" 1
332 1 73 GLY HA2 1 74 GLN HA 3.460 . 5.120 4.490 4.386 4.540 . 0 0 "[ . 1 . 2]" 1
333 1 55 ARG HG3 1 56 ILE HA 3.580 . 5.360 5.286 4.960 5.480 0.120 1 0 "[ . 1 . 2]" 1
334 1 38 PHE HB3 1 39 HIS HA 3.240 . 4.680 4.351 4.189 4.483 . 0 0 "[ . 1 . 2]" 1
335 1 36 GLU HA 1 36 GLU HG3 3.150 . 4.510 3.769 3.688 3.876 . 0 0 "[ . 1 . 2]" 1
336 1 34 LEU HA 1 87 LEU MD2 3.280 . 4.760 2.910 2.610 3.296 . 0 0 "[ . 1 . 2]" 1
337 1 62 GLU HA 1 63 GLY HA3 3.350 . 4.900 4.494 4.476 4.517 . 0 0 "[ . 1 . 2]" 1
338 1 62 GLU HA 1 62 GLU HG2 3.230 . 4.660 3.891 3.843 3.944 . 0 0 "[ . 1 . 2]" 1
339 1 62 GLU HA 1 87 LEU HG 3.080 . 4.360 2.524 2.209 2.773 . 0 0 "[ . 1 . 2]" 1
340 1 53 SER HA 1 54 VAL H 2.650 . 3.500 2.165 2.113 2.216 . 0 0 "[ . 1 . 2]" 1
341 1 42 GLU HB3 1 53 SER HA 3.730 . 5.660 4.002 3.544 5.383 . 0 0 "[ . 1 . 2]" 1
342 1 53 SER HA 1 54 VAL HB 4.120 . 6.440 4.726 4.477 4.913 . 0 0 "[ . 1 . 2]" 1
343 1 68 VAL HA 1 69 PRO HG2 3.280 . 4.760 4.370 4.162 4.615 . 0 0 "[ . 1 . 2]" 1
344 1 31 PRO HA 1 86 ARG HB2 2.950 . 4.100 2.494 1.922 2.930 . 0 0 "[ . 1 . 2]" 1
345 1 65 VAL HA 1 84 VAL HA 2.910 . 4.020 2.082 1.935 2.346 . 0 0 "[ . 1 . 2]" 1
346 1 84 VAL HA 1 85 VAL HB 3.480 . 5.160 4.625 4.503 4.703 . 0 0 "[ . 1 . 2]" 1
347 1 65 VAL HB 1 84 VAL HA 3.440 . 5.080 3.242 2.955 4.635 . 0 0 "[ . 1 . 2]" 1
348 1 38 PHE HA 1 59 GLY H 3.180 . 4.560 2.804 2.045 3.341 . 0 0 "[ . 1 . 2]" 1
349 1 38 PHE HA 1 38 PHE HD1 3.270 . 4.740 3.070 3.009 3.174 . 0 0 "[ . 1 . 2]" 1
350 1 51 ARG HA 1 52 VAL HA 3.600 . 5.400 4.493 4.456 4.532 . 0 0 "[ . 1 . 2]" 1
351 1 54 VAL HA 1 54 VAL MG1 2.670 . 3.540 3.208 2.547 3.298 . 0 0 "[ . 1 . 2]" 1
352 1 35 GLU HA 1 38 PHE HB2 3.260 . 4.720 3.622 3.154 4.304 . 0 0 "[ . 1 . 2]" 1
353 1 69 PRO HA 1 80 ASP HA 3.110 . 4.420 2.602 2.003 3.421 . 0 0 "[ . 1 . 2]" 1
354 1 60 VAL HA 1 64 SER HB3 3.590 . 5.380 4.711 4.077 5.094 . 0 0 "[ . 1 . 2]" 1
355 1 53 SER H 1 53 SER HB2 2.730 . 3.660 3.311 2.489 3.683 0.023 7 0 "[ . 1 . 2]" 1
356 1 64 SER HB2 1 65 VAL H 3.350 . 4.900 4.324 4.255 4.376 . 0 0 "[ . 1 . 2]" 1
357 1 64 SER H 1 64 SER HB2 3.020 . 4.240 2.464 2.407 2.515 . 0 0 "[ . 1 . 2]" 1
358 1 64 SER HB2 1 85 VAL HB 2.910 . 4.020 2.641 2.526 2.784 . 0 0 "[ . 1 . 2]" 1
359 1 30 LEU HB3 1 85 VAL HA 3.060 . 4.320 2.405 2.003 2.745 . 0 0 "[ . 1 . 2]" 1
360 1 64 SER H 1 64 SER HB3 3.000 . 4.200 3.599 3.567 3.624 . 0 0 "[ . 1 . 2]" 1
361 1 64 SER HB3 1 85 VAL HB 3.020 . 4.240 4.241 4.123 4.308 0.068 15 0 "[ . 1 . 2]" 1
362 1 64 SER HB3 1 85 VAL MG2 2.900 . 4.000 3.992 3.767 4.111 0.111 17 0 "[ . 1 . 2]" 1
363 1 43 ARG HB3 1 44 VAL H 3.360 . 4.920 4.379 4.316 4.490 . 0 0 "[ . 1 . 2]" 1
364 1 43 ARG HB2 1 44 VAL H 3.360 . 4.920 4.307 4.043 4.380 . 0 0 "[ . 1 . 2]" 1
365 1 42 GLU HA 1 56 ILE MD 3.330 . 4.860 4.426 3.981 4.863 0.003 6 0 "[ . 1 . 2]" 1
366 1 32 LEU HA 1 56 ILE MD 3.680 . 5.560 4.995 4.856 5.183 . 0 0 "[ . 1 . 2]" 1
367 1 36 GLU HB3 1 56 ILE MD 3.520 . 5.240 2.963 2.534 3.918 . 0 0 "[ . 1 . 2]" 1
368 1 56 ILE MD 1 60 VAL HB 3.690 . 5.580 5.376 5.022 5.688 0.108 14 0 "[ . 1 . 2]" 1
369 1 30 LEU H 1 66 ILE MD 3.940 . 6.080 5.752 5.546 6.038 . 0 0 "[ . 1 . 2]" 1
370 1 56 ILE H 1 66 ILE MD 4.230 . 6.660 4.606 4.220 4.886 . 0 0 "[ . 1 . 2]" 1
371 1 65 VAL HA 1 66 ILE MD 3.400 . 5.000 4.757 4.616 4.962 . 0 0 "[ . 1 . 2]" 1
372 1 66 ILE MD 1 84 VAL HA 3.510 . 5.220 5.261 5.047 5.369 0.149 12 0 "[ . 1 . 2]" 1
373 1 34 LEU H 1 37 ALA MB 3.550 . 5.300 4.502 4.348 4.643 . 0 0 "[ . 1 . 2]" 1
374 1 37 ALA MB 1 40 GLY H 3.460 . 5.120 4.821 4.668 5.073 . 0 0 "[ . 1 . 2]" 1
375 1 36 GLU HB3 1 37 ALA MB 3.570 . 5.340 4.923 4.651 5.272 . 0 0 "[ . 1 . 2]" 1
376 1 37 ALA MB 1 60 VAL HB 3.410 . 5.020 4.700 4.354 5.021 0.001 17 0 "[ . 1 . 2]" 1
377 1 6 PHE HE1 1 48 ALA MB 3.330 . 4.860 3.141 2.719 3.551 . 0 0 "[ . 1 . 2]" 1
378 1 66 ILE MG 1 68 VAL H 3.420 . 5.040 4.022 3.739 4.261 . 0 0 "[ . 1 . 2]" 1
379 1 55 ARG H 1 66 ILE MG 3.580 . 5.360 5.071 4.180 5.413 0.053 16 0 "[ . 1 . 2]" 1
380 1 66 ILE MG 1 68 VAL HA 3.450 . 5.100 4.520 4.145 4.826 . 0 0 "[ . 1 . 2]" 1
381 1 66 ILE MG 1 68 VAL HB 3.460 . 5.120 4.661 4.332 4.993 . 0 0 "[ . 1 . 2]" 1
382 1 55 ARG HA 1 56 ILE MG 3.420 . 5.040 3.721 3.530 3.872 . 0 0 "[ . 1 . 2]" 1
383 1 60 VAL MG1 1 61 ARG HA 3.510 . 5.220 4.184 3.958 4.449 . 0 0 "[ . 1 . 2]" 1
384 1 57 PRO HG2 1 60 VAL MG1 3.420 . 5.040 3.872 3.249 4.724 . 0 0 "[ . 1 . 2]" 1
385 1 36 GLU HB2 1 60 VAL MG1 3.990 . 6.180 5.677 5.202 6.045 . 0 0 "[ . 1 . 2]" 1
386 1 32 LEU HB3 1 60 VAL MG1 3.380 . 4.960 4.215 4.062 4.398 . 0 0 "[ . 1 . 2]" 1
387 1 55 ARG H 1 68 VAL MG2 3.490 . 5.180 4.728 4.199 5.166 . 0 0 "[ . 1 . 2]" 1
388 1 68 VAL MG2 1 81 LEU H 3.480 . 5.160 4.886 4.762 5.083 . 0 0 "[ . 1 . 2]" 1
389 1 85 VAL MG1 1 87 LEU HA 3.380 . 4.950 3.647 3.532 3.872 . 0 0 "[ . 1 . 2]" 1
390 1 63 GLY HA2 1 85 VAL MG1 4.270 . 6.740 5.840 5.500 6.070 . 0 0 "[ . 1 . 2]" 1
391 1 64 SER HA 1 85 VAL MG1 4.510 . 7.220 6.042 5.908 6.154 . 0 0 "[ . 1 . 2]" 1
392 1 7 THR MG 1 26 LEU HA 3.310 . 4.820 3.131 2.901 3.473 . 0 0 "[ . 1 . 2]" 1
393 1 9 VAL HB 1 10 THR MG 3.790 . 5.780 4.264 3.655 5.033 . 0 0 "[ . 1 . 2]" 1
394 1 28 ALA MB 1 84 VAL H 3.610 . 5.420 4.647 4.349 4.874 . 0 0 "[ . 1 . 2]" 1
395 1 4 LEU H 1 28 ALA MB 3.940 . 6.080 4.272 3.408 4.965 . 0 0 "[ . 1 . 2]" 1
396 1 5 LEU H 1 28 ALA MB 3.650 . 5.500 2.547 2.070 4.488 . 0 0 "[ . 1 . 2]" 1
397 1 6 PHE HD2 1 28 ALA MB 4.100 . 6.400 6.059 5.621 6.421 0.021 14 0 "[ . 1 . 2]" 1
398 1 27 ARG HA 1 28 ALA MB 3.330 . 4.860 4.082 3.992 4.136 . 0 0 "[ . 1 . 2]" 1
399 1 4 LEU HA 1 28 ALA MB 3.800 . 5.800 2.545 2.189 3.374 . 0 0 "[ . 1 . 2]" 1
400 1 5 LEU HA 1 28 ALA MB 3.910 . 6.020 2.756 2.266 3.292 . 0 0 "[ . 1 . 2]" 1
401 1 31 PRO HA 1 88 LEU MD2 3.350 . 4.900 2.744 2.343 3.129 . 0 0 "[ . 1 . 2]" 1
402 1 66 ILE H 1 85 VAL MG2 3.510 . 5.220 3.768 3.395 4.132 . 0 0 "[ . 1 . 2]" 1
403 1 68 VAL MG1 1 81 LEU H 3.490 . 5.180 4.800 4.558 5.102 . 0 0 "[ . 1 . 2]" 1
404 1 26 LEU H 1 81 LEU MD1 3.450 . 5.100 3.826 3.446 4.147 . 0 0 "[ . 1 . 2]" 1
405 1 81 LEU H 1 81 LEU MD1 3.360 . 4.920 4.348 4.131 4.402 . 0 0 "[ . 1 . 2]" 1
406 1 32 LEU MD1 1 36 GLU H 3.760 . 5.720 4.652 4.349 5.016 . 0 0 "[ . 1 . 2]" 1
407 1 27 ARG HA 1 81 LEU MD1 3.550 . 5.300 4.078 3.558 5.221 . 0 0 "[ . 1 . 2]" 1
408 1 32 LEU MD1 1 37 ALA HA 3.390 . 4.980 4.055 3.634 4.655 . 0 0 "[ . 1 . 2]" 1
409 1 86 ARG H 1 87 LEU MD2 3.800 . 5.800 4.595 4.043 5.186 . 0 0 "[ . 1 . 2]" 1
410 1 5 LEU MD2 1 6 PHE H 3.680 . 5.560 4.362 3.011 5.453 . 0 0 "[ . 1 . 2]" 1
411 1 2 LEU H 1 2 LEU MD2 3.470 . 5.140 2.814 1.768 4.567 0.032 2 0 "[ . 1 . 2]" 1
412 1 5 LEU H 1 5 LEU MD1 3.340 . 4.880 3.867 3.522 4.854 . 0 0 "[ . 1 . 2]" 1
413 1 82 LEU MD1 1 83 LEU H 3.790 . 5.780 5.500 5.171 5.662 . 0 0 "[ . 1 . 2]" 1
414 1 25 ASP HA 1 82 LEU MD1 3.730 . 5.660 5.085 4.145 5.744 0.084 20 0 "[ . 1 . 2]" 1
415 1 29 GLU H 1 83 LEU MD2 3.530 . 5.260 4.833 4.371 5.195 . 0 0 "[ . 1 . 2]" 1
416 1 27 ARG HA 1 83 LEU MD2 3.900 . 6.000 4.451 4.169 4.870 . 0 0 "[ . 1 . 2]" 1
417 1 26 LEU H 1 26 LEU MD1 3.490 . 5.180 4.041 3.888 4.127 . 0 0 "[ . 1 . 2]" 1
418 1 6 PHE HE1 1 26 LEU MD1 3.560 . 5.320 3.832 3.359 4.269 . 0 0 "[ . 1 . 2]" 1
419 1 6 PHE HD1 1 26 LEU MD1 3.520 . 5.240 2.595 1.947 2.967 . 0 0 "[ . 1 . 2]" 1
420 1 31 PRO HA 1 88 LEU MD1 3.410 . 5.020 3.532 2.897 3.985 . 0 0 "[ . 1 . 2]" 1
421 1 87 LEU MD1 1 88 LEU H 3.690 . 5.580 5.198 4.949 5.430 . 0 0 "[ . 1 . 2]" 1
422 1 32 LEU MD2 1 56 ILE H 3.940 . 6.080 5.424 5.142 5.788 . 0 0 "[ . 1 . 2]" 1
423 1 32 LEU MD2 1 86 ARG H 3.940 . 6.080 4.884 4.387 5.336 . 0 0 "[ . 1 . 2]" 1
424 1 32 LEU MD2 1 36 GLU H 3.900 . 6.000 5.388 5.114 5.559 . 0 0 "[ . 1 . 2]" 1
425 1 68 VAL HB 1 83 LEU MD1 3.630 . 5.460 5.027 4.490 5.543 0.083 14 0 "[ . 1 . 2]" 1
426 1 81 LEU H 1 81 LEU MD2 3.570 . 5.340 4.430 4.319 4.530 . 0 0 "[ . 1 . 2]" 1
427 1 86 ARG HG2 1 87 LEU H 3.560 . 5.320 5.267 5.095 5.386 0.066 14 0 "[ . 1 . 2]" 1
428 1 30 LEU H 1 86 ARG HG2 3.330 . 4.860 3.253 2.778 3.591 . 0 0 "[ . 1 . 2]" 1
429 1 31 PRO HA 1 86 ARG HG2 3.610 . 5.420 4.626 3.978 5.020 . 0 0 "[ . 1 . 2]" 1
430 1 29 GLU HG3 1 86 ARG HG2 3.530 . 5.260 4.029 2.749 5.023 . 0 0 "[ . 1 . 2]" 1
431 1 86 ARG H 1 86 ARG HG3 3.520 . 5.240 4.096 3.836 4.326 . 0 0 "[ . 1 . 2]" 1
432 1 43 ARG H 1 43 ARG HG2 3.610 . 5.420 4.871 4.721 5.043 . 0 0 "[ . 1 . 2]" 1
433 1 43 ARG HG2 1 44 VAL H 3.560 . 5.320 4.841 4.702 4.926 . 0 0 "[ . 1 . 2]" 1
434 1 33 THR HB 1 88 LEU HG 4.210 . 6.620 5.791 5.437 6.226 . 0 0 "[ . 1 . 2]" 1
435 1 42 GLU HA 1 55 ARG HG3 3.840 . 5.880 3.788 3.295 4.154 . 0 0 "[ . 1 . 2]" 1
436 1 88 LEU HB2 1 89 PRO HG2 3.870 . 5.940 5.814 5.163 6.233 0.293 13 0 "[ . 1 . 2]" 1
437 1 31 PRO HG2 1 32 LEU HA 3.770 . 5.740 5.226 5.122 5.344 . 0 0 "[ . 1 . 2]" 1
438 1 31 PRO HG2 1 86 ARG HB2 4.170 . 6.540 6.031 5.611 6.434 . 0 0 "[ . 1 . 2]" 1
439 1 31 PRO HG2 1 88 LEU MD1 3.490 . 5.180 3.973 3.673 4.226 . 0 0 "[ . 1 . 2]" 1
440 1 62 GLU HB3 1 87 LEU MD1 3.420 . 5.040 3.178 2.856 3.409 . 0 0 "[ . 1 . 2]" 1
441 1 55 ARG HB2 1 56 ILE H 3.320 . 4.840 4.309 4.086 4.446 . 0 0 "[ . 1 . 2]" 1
442 1 42 GLU HA 1 55 ARG HB2 3.530 . 5.260 3.871 3.379 4.341 . 0 0 "[ . 1 . 2]" 1
443 1 54 VAL HA 1 55 ARG HB2 3.690 . 5.580 4.561 4.427 4.697 . 0 0 "[ . 1 . 2]" 1
444 1 54 VAL HA 1 55 ARG HB3 3.860 . 5.920 4.676 4.583 4.784 . 0 0 "[ . 1 . 2]" 1
445 1 42 GLU HB3 1 55 ARG HB2 4.030 . 6.260 5.129 4.724 5.452 . 0 0 "[ . 1 . 2]" 1
446 1 54 VAL HB 1 55 ARG HB3 4.450 . 7.100 6.638 6.519 6.740 . 0 0 "[ . 1 . 2]" 1
447 1 35 GLU HB3 1 36 GLU H 3.530 . 5.260 3.610 3.351 3.750 . 0 0 "[ . 1 . 2]" 1
448 1 35 GLU HB2 1 36 GLU H 3.530 . 5.260 2.459 2.237 2.859 . 0 0 "[ . 1 . 2]" 1
449 1 32 LEU HA 1 36 GLU HB2 3.440 . 5.080 3.868 3.525 4.303 . 0 0 "[ . 1 . 2]" 1
450 1 36 GLU HB2 1 37 ALA HA 3.500 . 5.200 4.550 4.289 4.813 . 0 0 "[ . 1 . 2]" 1
451 1 36 GLU HB3 1 37 ALA H 3.290 . 4.780 3.774 3.542 4.042 . 0 0 "[ . 1 . 2]" 1
452 1 33 THR MG 1 36 GLU HB3 3.640 . 5.480 5.296 4.990 5.640 0.160 1 0 "[ . 1 . 2]" 1
453 1 63 GLY H 1 85 VAL HB 3.500 . 5.200 3.909 3.619 4.091 . 0 0 "[ . 1 . 2]" 1
454 1 44 VAL HB 1 45 VAL H 3.550 . 5.300 4.353 4.209 4.451 . 0 0 "[ . 1 . 2]" 1
455 1 83 LEU HA 1 84 VAL HB 3.690 . 5.580 4.770 4.647 4.876 . 0 0 "[ . 1 . 2]" 1
456 1 30 LEU H 1 86 ARG HB2 3.830 . 5.860 4.396 4.081 4.772 . 0 0 "[ . 1 . 2]" 1
457 1 32 LEU H 1 86 ARG HB2 4.020 . 6.240 3.681 3.169 4.045 . 0 0 "[ . 1 . 2]" 1
458 1 27 ARG HB2 1 82 LEU HA 3.930 . 6.050 5.530 5.254 5.786 . 0 0 "[ . 1 . 2]" 1
459 1 65 VAL HB 1 66 ILE H 3.560 . 5.320 4.172 4.072 4.283 . 0 0 "[ . 1 . 2]" 1
460 1 64 SER HA 1 65 VAL HB 3.590 . 5.380 4.709 4.570 4.858 . 0 0 "[ . 1 . 2]" 1
461 1 62 GLU HG3 1 63 GLY H 3.490 . 5.180 3.398 3.126 3.702 . 0 0 "[ . 1 . 2]" 1
462 1 62 GLU H 1 62 GLU HG3 3.480 . 5.160 4.356 4.311 4.420 . 0 0 "[ . 1 . 2]" 1
463 1 62 GLU HG3 1 87 LEU MD1 3.460 . 5.120 5.007 4.748 5.206 0.086 20 0 "[ . 1 . 2]" 1
464 1 43 ARG H 1 54 VAL HB 3.700 . 5.600 5.190 3.490 5.709 0.109 11 0 "[ . 1 . 2]" 1
465 1 43 ARG HG3 1 54 VAL HB 4.160 . 6.520 5.849 3.396 6.314 . 0 0 "[ . 1 . 2]" 1
466 1 4 LEU HG 1 45 VAL HB 3.960 . 6.120 1.926 1.771 2.139 0.029 13 0 "[ . 1 . 2]" 1
467 1 62 GLU H 1 62 GLU HG2 3.480 . 5.160 4.552 4.517 4.576 . 0 0 "[ . 1 . 2]" 1
468 1 42 GLU HG2 1 55 ARG HA 3.360 . 4.920 4.725 3.920 4.999 0.079 7 0 "[ . 1 . 2]" 1
469 1 42 GLU H 1 42 GLU HG3 3.480 . 5.160 4.014 3.724 4.198 . 0 0 "[ . 1 . 2]" 1
470 1 42 GLU HG3 1 55 ARG H 3.760 . 5.720 4.076 3.494 5.196 . 0 0 "[ . 1 . 2]" 1
471 1 42 GLU HG3 1 55 ARG HA 3.390 . 4.980 3.034 2.169 3.342 . 0 0 "[ . 1 . 2]" 1
472 1 42 GLU HG3 1 55 ARG HG3 3.530 . 5.260 3.921 3.257 4.371 . 0 0 "[ . 1 . 2]" 1
473 1 46 GLU HG3 1 47 VAL H 3.720 . 5.640 3.718 2.879 5.041 . 0 0 "[ . 1 . 2]" 1
474 1 29 GLU HG2 1 86 ARG HG2 3.530 . 5.260 4.365 3.325 5.365 0.105 1 0 "[ . 1 . 2]" 1
475 1 65 VAL HA 1 66 ILE HB 3.560 . 5.320 4.598 4.424 4.706 . 0 0 "[ . 1 . 2]" 1
476 1 5 LEU HB3 1 6 PHE H 3.470 . 5.140 2.995 1.831 4.429 . 0 0 "[ . 1 . 2]" 1
477 1 87 LEU HA 1 88 LEU HB2 3.570 . 5.340 4.600 4.439 4.687 . 0 0 "[ . 1 . 2]" 1
478 1 30 LEU HB2 1 83 LEU HB2 3.800 . 5.800 4.045 3.702 4.476 . 0 0 "[ . 1 . 2]" 1
479 1 26 LEU HB3 1 27 ARG H 3.480 . 5.160 3.725 3.630 3.830 . 0 0 "[ . 1 . 2]" 1
480 1 32 LEU HB3 1 36 GLU HB3 3.890 . 5.980 5.700 4.777 6.079 0.099 2 0 "[ . 1 . 2]" 1
481 1 32 LEU HB2 1 36 GLU HB3 3.770 . 5.740 5.573 4.965 5.888 0.148 19 0 "[ . 1 . 2]" 1
482 1 62 GLU HA 1 63 GLY HA2 3.390 . 4.980 4.419 4.380 4.446 . 0 0 "[ . 1 . 2]" 1
483 1 41 GLY HA3 1 42 GLU HB2 3.400 . 5.000 4.695 4.571 4.806 . 0 0 "[ . 1 . 2]" 1
484 1 78 PRO HA 1 79 GLY HA2 3.560 . 5.320 4.478 4.446 4.533 . 0 0 "[ . 1 . 2]" 1
485 1 41 GLY HA2 1 56 ILE H 3.570 . 5.340 4.735 4.212 5.018 . 0 0 "[ . 1 . 2]" 1
486 1 41 GLY HA2 1 42 GLU HG3 3.790 . 5.780 5.455 5.158 5.726 . 0 0 "[ . 1 . 2]" 1
487 1 69 PRO HA 1 70 GLY HA3 3.670 . 5.540 4.467 4.397 4.525 . 0 0 "[ . 1 . 2]" 1
488 1 69 PRO HB2 1 70 GLY HA3 3.470 . 5.140 4.275 4.133 4.484 . 0 0 "[ . 1 . 2]" 1
489 1 69 PRO HA 1 70 GLY HA2 3.670 . 5.540 4.403 4.355 4.452 . 0 0 "[ . 1 . 2]" 1
490 1 73 GLY HA2 1 74 GLN HB2 3.440 . 5.080 4.695 4.598 4.835 . 0 0 "[ . 1 . 2]" 1
491 1 43 ARG HD3 1 44 VAL HB 4.060 . 6.320 5.538 3.871 6.429 0.109 7 0 "[ . 1 . 2]" 1
492 1 78 PRO HA 1 79 GLY HA3 3.560 . 5.320 4.408 4.344 4.472 . 0 0 "[ . 1 . 2]" 1
493 1 80 ASP HB2 1 81 LEU H 3.290 . 4.780 3.961 2.469 4.254 . 0 0 "[ . 1 . 2]" 1
494 1 80 ASP HB2 1 82 LEU MD2 3.720 . 5.640 4.898 3.781 5.514 . 0 0 "[ . 1 . 2]" 1
495 1 80 ASP HB3 1 82 LEU MD2 3.720 . 5.640 4.174 2.853 5.545 . 0 0 "[ . 1 . 2]" 1
496 1 6 PHE HE1 1 48 ALA HA 3.640 . 5.480 5.269 4.233 5.551 0.071 10 0 "[ . 1 . 2]" 1
497 1 88 LEU H 1 89 PRO HD2 3.560 . 5.320 5.029 4.781 5.377 0.057 7 0 "[ . 1 . 2]" 1
498 1 61 ARG HA 1 62 GLU HA 3.540 . 5.280 4.327 4.220 4.428 . 0 0 "[ . 1 . 2]" 1
499 1 61 ARG HA 1 62 GLU HB2 3.690 . 5.580 4.642 4.565 4.700 . 0 0 "[ . 1 . 2]" 1
500 1 37 ALA MB 1 61 ARG HA 3.450 . 5.100 3.842 3.426 4.470 . 0 0 "[ . 1 . 2]" 1
501 1 88 LEU HA 1 89 PRO HG2 3.450 . 5.100 4.532 4.289 4.664 . 0 0 "[ . 1 . 2]" 1
502 1 28 ALA HA 1 83 LEU HA 3.900 . 6.000 5.203 5.068 5.422 . 0 0 "[ . 1 . 2]" 1
503 1 27 ARG HA 1 83 LEU HA 3.540 . 5.280 4.491 4.340 4.781 . 0 0 "[ . 1 . 2]" 1
504 1 66 ILE HB 1 83 LEU HA 4.010 . 6.220 4.755 4.577 5.009 . 0 0 "[ . 1 . 2]" 1
505 1 82 LEU HB2 1 83 LEU HA 4.300 . 6.800 4.975 4.798 5.137 . 0 0 "[ . 1 . 2]" 1
506 1 30 LEU HB2 1 83 LEU HA 3.530 . 5.260 3.678 3.334 4.046 . 0 0 "[ . 1 . 2]" 1
507 1 87 LEU HA 1 88 LEU HA 3.410 . 5.020 4.430 4.393 4.485 . 0 0 "[ . 1 . 2]" 1
508 1 71 MET HA 1 71 MET ME 3.300 . 4.800 3.544 1.825 4.786 . 0 0 "[ . 1 . 2]" 1
509 1 42 GLU HA 1 56 ILE HG12 3.350 . 4.900 3.842 2.959 4.506 . 0 0 "[ . 1 . 2]" 1
510 1 26 LEU HA 1 27 ARG HA 3.360 . 4.920 4.471 4.451 4.488 . 0 0 "[ . 1 . 2]" 1
511 1 47 VAL H 1 51 ARG HA 3.320 . 4.840 3.789 3.205 4.326 . 0 0 "[ . 1 . 2]" 1
512 1 47 VAL H 1 50 ARG HA 3.860 . 5.920 4.809 4.486 5.043 . 0 0 "[ . 1 . 2]" 1
513 1 49 GLY H 1 50 ARG HA 4.160 . 6.520 5.063 4.944 5.168 . 0 0 "[ . 1 . 2]" 1
514 1 36 GLU HA 1 40 GLY H 3.520 . 5.240 3.777 3.455 4.064 . 0 0 "[ . 1 . 2]" 1
515 1 34 LEU HA 1 37 ALA H 3.570 . 5.340 3.598 3.299 3.779 . 0 0 "[ . 1 . 2]" 1
516 1 52 VAL HA 1 53 SER HA 3.520 . 5.240 4.456 4.420 4.492 . 0 0 "[ . 1 . 2]" 1
517 1 53 SER HA 1 54 VAL HA 3.720 . 5.640 4.482 4.450 4.522 . 0 0 "[ . 1 . 2]" 1
518 1 31 PRO HA 1 32 LEU HA 3.510 . 5.220 4.486 4.459 4.521 . 0 0 "[ . 1 . 2]" 1
519 1 31 PRO HA 1 85 VAL MG1 3.420 . 5.040 5.041 4.799 5.143 0.103 20 0 "[ . 1 . 2]" 1
520 1 64 SER HA 1 65 VAL HA 3.410 . 5.020 4.457 4.439 4.496 . 0 0 "[ . 1 . 2]" 1
521 1 38 PHE HA 1 58 PRO HA 3.490 . 5.180 4.548 3.611 5.290 0.110 6 0 "[ . 1 . 2]" 1
522 1 47 VAL HA 1 48 ALA MB 3.380 . 4.960 3.976 3.845 4.172 . 0 0 "[ . 1 . 2]" 1
523 1 47 VAL HA 1 48 ALA HA 3.450 . 5.100 4.399 4.362 4.425 . 0 0 "[ . 1 . 2]" 1
524 1 65 VAL HA 1 66 ILE HA 3.500 . 5.200 4.451 4.422 4.481 . 0 0 "[ . 1 . 2]" 1
525 1 35 GLU HA 1 38 PHE H 3.440 . 5.080 3.604 3.344 3.939 . 0 0 "[ . 1 . 2]" 1
526 1 69 PRO HA 1 81 LEU H 3.500 . 5.200 3.255 2.866 3.678 . 0 0 "[ . 1 . 2]" 1
527 1 64 SER HA 1 85 VAL HB 3.470 . 5.140 4.936 4.807 5.037 . 0 0 "[ . 1 . 2]" 1
528 1 7 THR MG 1 9 VAL HA 3.750 . 5.700 4.164 3.559 4.594 . 0 0 "[ . 1 . 2]" 1
529 1 9 VAL HA 1 10 THR MG 3.970 . 6.140 3.756 3.408 4.147 . 0 0 "[ . 1 . 2]" 1
530 1 60 VAL HA 1 61 ARG HA 3.560 . 5.320 4.434 4.338 4.527 . 0 0 "[ . 1 . 2]" 1
531 1 60 VAL HA 1 85 VAL MG1 3.570 . 5.340 4.962 4.783 5.124 . 0 0 "[ . 1 . 2]" 1
532 1 88 LEU HB2 1 89 PRO HA 3.860 . 5.920 5.352 5.047 5.535 . 0 0 "[ . 1 . 2]" 1
533 1 39 HIS HA 1 58 PRO HA 3.530 . 5.260 4.758 4.260 5.358 0.098 13 0 "[ . 1 . 2]" 1
534 1 31 PRO HA 1 85 VAL HA 3.570 . 5.340 5.174 5.030 5.350 0.010 15 0 "[ . 1 . 2]" 1
535 1 84 VAL HA 1 85 VAL HA 3.440 . 5.080 4.503 4.433 4.552 . 0 0 "[ . 1 . 2]" 1
536 1 85 VAL HA 1 86 ARG HB2 3.340 . 4.880 4.505 4.358 4.617 . 0 0 "[ . 1 . 2]" 1
537 1 25 ASP HA 1 26 LEU HA 3.380 . 4.950 4.451 4.414 4.488 . 0 0 "[ . 1 . 2]" 1
538 1 25 ASP HA 1 79 GLY HA3 3.440 . 5.080 3.676 3.041 4.154 . 0 0 "[ . 1 . 2]" 1
539 1 25 ASP HA 1 26 LEU HG 3.360 . 4.920 4.176 3.903 4.439 . 0 0 "[ . 1 . 2]" 1
540 1 25 ASP HA 1 26 LEU MD2 3.420 . 5.040 3.873 3.738 4.100 . 0 0 "[ . 1 . 2]" 1
541 1 45 VAL MG1 1 46 GLU H 3.130 . 4.460 3.867 3.702 3.984 . 0 0 "[ . 1 . 2]" 1
542 1 35 GLU HA 1 38 PHE HB3 3.200 . 4.600 2.839 2.434 3.175 . 0 0 "[ . 1 . 2]" 1
543 1 36 GLU HA 1 36 GLU HG2 3.150 . 4.510 3.066 2.849 3.239 . 0 0 "[ . 1 . 2]" 1
544 1 36 GLU H 1 36 GLU HG2 3.070 . 4.340 2.336 2.063 2.545 . 0 0 "[ . 1 . 2]" 1
545 1 33 THR H 1 36 GLU HG2 3.420 . 5.040 3.849 3.296 4.441 . 0 0 "[ . 1 . 2]" 1
546 1 6 PHE HA 1 28 ALA MB 3.500 . 5.200 4.555 4.175 4.936 . 0 0 "[ . 1 . 2]" 1
547 1 48 ALA MB 1 49 GLY H 3.070 . 4.340 3.668 3.622 3.707 . 0 0 "[ . 1 . 2]" 1
548 1 48 ALA HA 1 49 GLY H 2.700 . 3.600 2.983 2.889 3.110 . 0 0 "[ . 1 . 2]" 1
549 1 48 ALA H 1 49 GLY H 2.930 . 4.060 2.750 2.650 2.831 . 0 0 "[ . 1 . 2]" 1
550 1 47 VAL HA 1 49 GLY H 3.330 . 4.860 4.002 3.574 4.233 . 0 0 "[ . 1 . 2]" 1
551 1 41 GLY H 1 56 ILE H 3.570 . 5.340 4.422 3.603 4.818 . 0 0 "[ . 1 . 2]" 1
552 1 41 GLY H 1 56 ILE HG12 3.490 . 5.180 3.301 2.663 4.390 . 0 0 "[ . 1 . 2]" 1
553 1 79 GLY H 1 80 ASP H 3.430 . 5.060 4.520 4.428 4.601 . 0 0 "[ . 1 . 2]" 1
554 1 73 GLY H 1 79 GLY H 2.950 . 4.100 3.089 2.710 3.996 . 0 0 "[ . 1 . 2]" 1
555 1 78 PRO HA 1 79 GLY H 2.510 . 3.220 2.168 2.128 2.231 . 0 0 "[ . 1 . 2]" 1
556 1 70 GLY H 1 72 GLY H 3.350 . 4.900 3.572 3.016 4.017 . 0 0 "[ . 1 . 2]" 1
557 1 72 GLY H 1 73 GLY H 3.180 . 4.560 3.499 3.211 4.067 . 0 0 "[ . 1 . 2]" 1
558 1 71 MET H 1 72 GLY H 2.800 . 3.800 2.314 1.878 2.529 . 0 0 "[ . 1 . 2]" 1
559 1 40 GLY H 1 41 GLY H 3.390 . 4.980 3.636 2.671 4.630 . 0 0 "[ . 1 . 2]" 1
560 1 37 ALA HA 1 40 GLY H 3.060 . 4.320 3.803 3.547 4.035 . 0 0 "[ . 1 . 2]" 1
561 1 74 GLN HA 1 75 GLY H 2.360 . 2.920 2.272 2.103 2.508 . 0 0 "[ . 1 . 2]" 1
562 1 74 GLN HB3 1 75 GLY H 2.730 . 3.660 2.898 2.315 3.745 0.085 9 0 "[ . 1 . 2]" 1
563 1 59 GLY H 1 60 VAL H 2.800 . 3.800 2.490 2.338 2.675 . 0 0 "[ . 1 . 2]" 1
564 1 58 PRO HA 1 59 GLY H 2.690 . 3.580 2.161 2.134 2.244 . 0 0 "[ . 1 . 2]" 1
565 1 26 LEU H 1 73 GLY H 3.170 . 4.540 3.623 3.074 4.123 . 0 0 "[ . 1 . 2]" 1
566 1 25 ASP HA 1 73 GLY H 3.430 . 5.060 3.696 3.369 4.100 . 0 0 "[ . 1 . 2]" 1
567 1 26 LEU HG 1 73 GLY H 2.890 . 3.980 2.925 2.042 3.476 . 0 0 "[ . 1 . 2]" 1
568 1 26 LEU MD2 1 73 GLY H 3.420 . 5.040 3.666 2.935 4.226 . 0 0 "[ . 1 . 2]" 1
569 1 26 LEU MD1 1 73 GLY H 3.080 . 4.360 4.005 3.378 4.398 0.038 20 0 "[ . 1 . 2]" 1
570 1 23 GLY H 1 79 GLY H 3.700 . 5.600 4.414 3.492 5.682 0.082 1 0 "[ . 1 . 2]" 1
571 1 23 GLY H 1 24 ARG H 3.330 . 4.860 3.919 2.642 4.522 . 0 0 "[ . 1 . 2]" 1
572 1 22 SER HA 1 23 GLY H 2.580 . 3.360 2.391 2.151 3.056 . 0 0 "[ . 1 . 2]" 1
573 1 33 THR H 1 36 GLU H 3.160 . 4.520 4.008 3.778 4.415 . 0 0 "[ . 1 . 2]" 1
574 1 32 LEU HA 1 33 THR H 2.650 . 3.500 2.222 2.162 2.289 . 0 0 "[ . 1 . 2]" 1
575 1 33 THR H 1 36 GLU HB3 2.910 . 4.020 4.034 3.699 4.163 0.143 8 0 "[ . 1 . 2]" 1
576 1 33 THR H 1 36 GLU HG3 3.420 . 5.040 3.460 2.301 4.087 . 0 0 "[ . 1 . 2]" 1
577 1 33 THR H 1 36 GLU HB2 2.970 . 4.140 2.638 2.467 2.818 . 0 0 "[ . 1 . 2]" 1
578 1 32 LEU HB3 1 33 THR H 3.070 . 4.340 4.116 3.972 4.224 . 0 0 "[ . 1 . 2]" 1
579 1 32 LEU HB2 1 33 THR H 3.320 . 4.840 4.417 4.267 4.538 . 0 0 "[ . 1 . 2]" 1
580 1 33 THR H 1 33 THR MG 2.560 . 3.320 2.465 2.179 3.702 0.382 11 0 "[ . 1 . 2]" 1
581 1 33 THR H 1 88 LEU MD1 3.400 . 5.000 3.564 2.969 4.019 . 0 0 "[ . 1 . 2]" 1
582 1 32 LEU MD1 1 33 THR H 2.870 . 3.940 2.879 2.528 3.269 . 0 0 "[ . 1 . 2]" 1
583 1 70 GLY H 1 81 LEU H 3.300 . 4.800 3.841 3.426 4.336 . 0 0 "[ . 1 . 2]" 1
584 1 70 GLY H 1 71 MET H 3.000 . 4.200 2.722 2.567 3.028 . 0 0 "[ . 1 . 2]" 1
585 1 70 GLY H 1 80 ASP HA 2.850 . 3.900 2.275 1.911 2.772 . 0 0 "[ . 1 . 2]" 1
586 1 69 PRO HA 1 70 GLY H 2.540 . 3.280 2.170 2.108 2.207 . 0 0 "[ . 1 . 2]" 1
587 1 69 PRO HB2 1 70 GLY H 2.870 . 3.940 3.631 3.294 3.849 . 0 0 "[ . 1 . 2]" 1
588 1 69 PRO HG2 1 70 GLY H 3.600 . 5.400 5.078 4.766 5.620 0.220 2 0 "[ . 1 . 2]" 1
589 1 39 HIS H 1 39 HIS HD2 3.440 . 5.080 4.350 4.107 4.659 . 0 0 "[ . 1 . 2]" 1
590 1 35 GLU HA 1 39 HIS H 3.450 . 5.100 4.207 3.936 4.457 . 0 0 "[ . 1 . 2]" 1
591 1 38 PHE HB3 1 39 HIS H 2.620 . 3.440 2.617 2.290 2.856 . 0 0 "[ . 1 . 2]" 1
592 1 38 PHE HB2 1 39 HIS H 2.940 . 4.080 3.893 3.678 4.001 . 0 0 "[ . 1 . 2]" 1
593 1 37 ALA H 1 38 PHE H 2.890 . 3.980 2.609 2.494 2.735 . 0 0 "[ . 1 . 2]" 1
594 1 38 PHE H 1 38 PHE HB3 2.680 . 3.560 2.506 2.416 2.594 . 0 0 "[ . 1 . 2]" 1
595 1 38 PHE H 1 38 PHE HB2 2.720 . 3.640 2.502 2.421 2.609 . 0 0 "[ . 1 . 2]" 1
596 1 37 ALA MB 1 38 PHE H 2.750 . 3.700 2.412 2.242 2.605 . 0 0 "[ . 1 . 2]" 1
597 1 38 PHE H 1 60 VAL MG1 3.630 . 5.460 4.754 4.625 4.890 . 0 0 "[ . 1 . 2]" 1
598 1 69 PRO HA 1 71 MET H 3.220 . 4.640 3.702 3.509 3.855 . 0 0 "[ . 1 . 2]" 1
599 1 71 MET H 1 81 LEU HB3 3.360 . 4.920 4.059 3.721 4.585 . 0 0 "[ . 1 . 2]" 1
600 1 71 MET H 1 81 LEU HB2 3.500 . 5.200 3.744 3.396 4.422 . 0 0 "[ . 1 . 2]" 1
601 1 68 VAL MG1 1 71 MET H 2.960 . 4.120 3.546 3.060 4.132 0.012 2 0 "[ . 1 . 2]" 1
602 1 58 PRO HA 1 60 VAL H 3.140 . 4.480 3.636 3.298 3.897 . 0 0 "[ . 1 . 2]" 1
603 1 60 VAL H 1 60 VAL HB 2.770 . 3.740 2.630 2.571 2.683 . 0 0 "[ . 1 . 2]" 1
604 1 37 ALA MB 1 60 VAL H 3.060 . 4.320 3.414 2.992 3.796 . 0 0 "[ . 1 . 2]" 1
605 1 60 VAL H 1 60 VAL MG1 2.430 . 3.060 2.083 1.991 2.163 . 0 0 "[ . 1 . 2]" 1
606 1 32 LEU MD2 1 60 VAL H 3.220 . 4.640 4.664 4.509 4.790 0.150 1 0 "[ . 1 . 2]" 1
607 1 68 VAL H 1 81 LEU H 3.020 . 4.240 3.293 2.941 3.590 . 0 0 "[ . 1 . 2]" 1
608 1 81 LEU H 1 82 LEU H 3.590 . 5.380 4.404 4.310 4.468 . 0 0 "[ . 1 . 2]" 1
609 1 72 GLY H 1 81 LEU H 3.450 . 5.100 3.771 3.276 4.286 . 0 0 "[ . 1 . 2]" 1
610 1 71 MET H 1 81 LEU H 3.140 . 4.480 3.775 3.270 4.221 . 0 0 "[ . 1 . 2]" 1
611 1 80 ASP HA 1 81 LEU H 2.750 . 3.700 2.283 2.128 2.429 . 0 0 "[ . 1 . 2]" 1
612 1 81 LEU H 1 81 LEU HB2 2.930 . 4.060 2.949 2.584 3.108 . 0 0 "[ . 1 . 2]" 1
613 1 36 GLU H 1 36 GLU HG3 3.070 . 4.340 3.684 3.304 3.872 . 0 0 "[ . 1 . 2]" 1
614 1 33 THR MG 1 36 GLU H 3.250 . 4.700 4.245 3.459 4.764 0.064 15 0 "[ . 1 . 2]" 1
615 1 49 GLY H 1 50 ARG H 2.610 . 3.420 2.424 2.146 2.656 . 0 0 "[ . 1 . 2]" 1
616 1 46 GLU HA 1 50 ARG H 3.520 . 5.240 4.456 3.767 5.134 . 0 0 "[ . 1 . 2]" 1
617 1 48 ALA HA 1 50 ARG H 3.440 . 5.080 4.575 4.433 4.807 . 0 0 "[ . 1 . 2]" 1
618 1 48 ALA MB 1 50 ARG H 3.300 . 4.800 3.745 3.354 4.330 . 0 0 "[ . 1 . 2]" 1
619 1 76 ASN H 1 76 ASN HB3 3.140 . 4.480 3.187 2.473 3.682 . 0 0 "[ . 1 . 2]" 1
620 1 76 ASN H 1 76 ASN HB2 3.140 . 4.480 2.809 2.425 4.151 . 0 0 "[ . 1 . 2]" 1
621 1 60 VAL H 1 61 ARG H 3.460 . 5.120 4.655 4.615 4.688 . 0 0 "[ . 1 . 2]" 1
622 1 60 VAL HA 1 61 ARG H 2.590 . 3.380 2.326 2.246 2.403 . 0 0 "[ . 1 . 2]" 1
623 1 61 ARG H 1 61 ARG HB3 3.090 . 4.380 3.692 3.572 3.812 . 0 0 "[ . 1 . 2]" 1
624 1 61 ARG H 1 85 VAL MG1 3.290 . 4.780 4.089 3.734 4.558 . 0 0 "[ . 1 . 2]" 1
625 1 63 GLY H 1 64 SER H 2.890 . 3.980 2.675 2.462 2.836 . 0 0 "[ . 1 . 2]" 1
626 1 62 GLU HA 1 64 SER H 3.060 . 4.320 3.534 3.450 3.666 . 0 0 "[ . 1 . 2]" 1
627 1 64 SER H 1 85 VAL HB 2.860 . 3.920 3.121 2.781 3.407 . 0 0 "[ . 1 . 2]" 1
628 1 64 SER H 1 85 VAL MG1 3.170 . 4.540 4.204 3.899 4.431 . 0 0 "[ . 1 . 2]" 1
629 1 24 ARG H 1 73 GLY H 3.480 . 5.160 3.957 3.470 4.831 . 0 0 "[ . 1 . 2]" 1
630 1 24 ARG H 1 79 GLY H 3.230 . 4.660 3.968 3.294 4.764 0.104 12 0 "[ . 1 . 2]" 1
631 1 23 GLY HA2 1 24 ARG H 2.710 . 3.620 2.842 2.212 3.460 . 0 0 "[ . 1 . 2]" 1
632 1 23 GLY HA3 1 24 ARG H 2.710 . 3.620 2.534 2.165 3.575 . 0 0 "[ . 1 . 2]" 1
633 1 24 ARG H 1 24 ARG HB2 3.060 . 4.320 2.922 2.504 3.718 . 0 0 "[ . 1 . 2]" 1
634 1 5 LEU H 1 6 PHE H 3.530 . 5.260 3.492 2.842 3.987 . 0 0 "[ . 1 . 2]" 1
635 1 6 PHE H 1 6 PHE HD1 4.030 . 6.270 4.849 4.524 5.288 . 0 0 "[ . 1 . 2]" 1
636 1 6 PHE H 1 6 PHE HD2 4.220 . 6.640 4.891 4.740 5.375 . 0 0 "[ . 1 . 2]" 1
637 1 5 LEU HB2 1 6 PHE H 3.470 . 5.140 3.929 3.278 4.671 . 0 0 "[ . 1 . 2]" 1
638 1 62 GLU H 1 63 GLY H 3.440 . 5.080 4.540 4.461 4.588 . 0 0 "[ . 1 . 2]" 1
639 1 62 GLU H 1 64 SER H 3.570 . 5.340 4.600 4.416 4.775 . 0 0 "[ . 1 . 2]" 1
640 1 37 ALA H 1 40 GLY H 3.420 . 5.040 4.672 4.419 4.893 . 0 0 "[ . 1 . 2]" 1
641 1 36 GLU H 1 37 ALA H 2.800 . 3.800 2.600 2.459 2.713 . 0 0 "[ . 1 . 2]" 1
642 1 61 ARG HA 1 62 GLU H 2.610 . 3.420 2.425 2.318 2.472 . 0 0 "[ . 1 . 2]" 1
643 1 35 GLU HA 1 37 ALA H 3.480 . 5.160 4.386 4.219 4.546 . 0 0 "[ . 1 . 2]" 1
644 1 62 GLU H 1 62 GLU HB2 2.630 . 3.460 2.588 2.499 2.698 . 0 0 "[ . 1 . 2]" 1
645 1 61 ARG HB3 1 62 GLU H 2.650 . 3.500 2.123 1.995 2.328 . 0 0 "[ . 1 . 2]" 1
646 1 62 GLU H 1 62 GLU HB3 2.750 . 3.700 2.322 2.272 2.417 . 0 0 "[ . 1 . 2]" 1
647 1 61 ARG HG2 1 62 GLU H 2.760 . 3.720 3.408 3.330 3.539 . 0 0 "[ . 1 . 2]" 1
648 1 37 ALA H 1 37 ALA MB 2.530 . 3.260 2.225 2.199 2.255 . 0 0 "[ . 1 . 2]" 1
649 1 62 GLU H 1 87 LEU MD1 2.710 . 3.620 2.242 2.046 2.518 . 0 0 "[ . 1 . 2]" 1
650 1 32 LEU MD2 1 37 ALA H 2.870 . 3.940 3.745 3.471 3.937 . 0 0 "[ . 1 . 2]" 1
651 1 73 GLY H 1 74 GLN H 3.400 . 5.000 4.305 4.082 4.508 . 0 0 "[ . 1 . 2]" 1
652 1 74 GLN H 1 75 GLY H 3.420 . 5.040 4.558 4.364 4.664 . 0 0 "[ . 1 . 2]" 1
653 1 74 GLN H 1 74 GLN HB2 2.540 . 3.280 2.537 2.413 2.635 . 0 0 "[ . 1 . 2]" 1
654 1 26 LEU MD1 1 74 GLN H 3.440 . 5.080 3.826 2.997 4.629 . 0 0 "[ . 1 . 2]" 1
655 1 29 GLU H 1 30 LEU H 3.420 . 5.040 4.518 4.465 4.594 . 0 0 "[ . 1 . 2]" 1
656 1 28 ALA HA 1 29 GLU H 2.610 . 3.420 2.227 2.126 2.520 . 0 0 "[ . 1 . 2]" 1
657 1 29 GLU H 1 29 GLU HB2 2.920 . 4.040 2.805 2.269 3.706 . 0 0 "[ . 1 . 2]" 1
658 1 29 GLU H 1 29 GLU HB3 2.920 . 4.040 3.376 2.686 3.669 . 0 0 "[ . 1 . 2]" 1
659 1 28 ALA MB 1 29 GLU H 2.630 . 3.460 2.805 2.351 3.152 . 0 0 "[ . 1 . 2]" 1
660 1 25 ASP HA 1 26 LEU H 2.630 . 3.460 2.223 2.181 2.270 . 0 0 "[ . 1 . 2]" 1
661 1 26 LEU H 1 26 LEU HB3 3.090 . 4.380 3.724 3.687 3.756 . 0 0 "[ . 1 . 2]" 1
662 1 26 LEU H 1 26 LEU HB2 3.090 . 4.380 2.704 2.645 2.764 . 0 0 "[ . 1 . 2]" 1
663 1 52 VAL HA 1 53 SER H 2.360 . 2.920 2.238 2.146 2.350 . 0 0 "[ . 1 . 2]" 1
664 1 53 SER H 1 53 SER HB3 2.730 . 3.660 3.095 2.433 3.709 0.049 10 0 "[ . 1 . 2]" 1
665 1 41 GLY HA3 1 42 GLU H 2.580 . 3.360 2.275 2.174 2.454 . 0 0 "[ . 1 . 2]" 1
666 1 41 GLY HA2 1 42 GLU H 2.730 . 3.660 2.996 2.711 3.237 . 0 0 "[ . 1 . 2]" 1
667 1 42 GLU H 1 42 GLU HG2 3.460 . 5.120 4.237 4.035 4.519 . 0 0 "[ . 1 . 2]" 1
668 1 35 GLU H 1 36 GLU H 2.850 . 3.900 2.594 2.494 2.717 . 0 0 "[ . 1 . 2]" 1
669 1 33 THR HB 1 35 GLU H 3.070 . 4.340 2.957 2.699 3.563 . 0 0 "[ . 1 . 2]" 1
670 1 34 LEU HB3 1 35 GLU H 3.000 . 4.200 3.785 3.462 3.965 . 0 0 "[ . 1 . 2]" 1
671 1 34 LEU HB2 1 35 GLU H 3.000 . 4.200 2.788 2.489 3.033 . 0 0 "[ . 1 . 2]" 1
672 1 33 THR MG 1 35 GLU H 3.760 . 5.720 4.216 2.330 5.042 . 0 0 "[ . 1 . 2]" 1
673 1 35 GLU H 1 37 ALA MB 3.950 . 6.100 4.498 4.288 4.724 . 0 0 "[ . 1 . 2]" 1
674 1 34 LEU MD1 1 35 GLU H 3.300 . 4.800 4.700 4.471 4.874 0.074 20 0 "[ . 1 . 2]" 1
675 1 25 ASP H 1 80 ASP H 3.710 . 5.620 4.826 4.502 5.279 . 0 0 "[ . 1 . 2]" 1
676 1 25 ASP HA 1 80 ASP H 2.840 . 3.880 2.740 2.430 2.970 . 0 0 "[ . 1 . 2]" 1
677 1 79 GLY HA2 1 80 ASP H 2.790 . 3.780 2.414 2.249 2.650 . 0 0 "[ . 1 . 2]" 1
678 1 79 GLY HA3 1 80 ASP H 2.790 . 3.780 2.725 2.450 2.945 . 0 0 "[ . 1 . 2]" 1
679 1 80 ASP H 1 80 ASP HB2 3.120 . 4.440 2.587 2.275 3.726 . 0 0 "[ . 1 . 2]" 1
680 1 80 ASP H 1 80 ASP HB3 3.120 . 4.440 3.084 2.435 3.704 . 0 0 "[ . 1 . 2]" 1
681 1 62 GLU HA 1 63 GLY H 2.510 . 3.220 2.173 2.152 2.205 . 0 0 "[ . 1 . 2]" 1
682 1 62 GLU HG2 1 63 GLY H 3.490 . 5.180 4.620 4.433 4.908 . 0 0 "[ . 1 . 2]" 1
683 1 62 GLU HB2 1 63 GLY H 3.250 . 4.700 4.196 4.076 4.337 . 0 0 "[ . 1 . 2]" 1
684 1 62 GLU HB3 1 63 GLY H 3.330 . 4.860 4.316 4.220 4.433 . 0 0 "[ . 1 . 2]" 1
685 1 63 GLY H 1 87 LEU HG 3.720 . 5.640 4.609 4.173 4.927 . 0 0 "[ . 1 . 2]" 1
686 1 63 GLY H 1 85 VAL MG1 3.010 . 4.220 4.098 3.845 4.289 0.069 8 0 "[ . 1 . 2]" 1
687 1 34 LEU H 1 35 GLU H 2.950 . 4.100 2.646 2.482 2.944 . 0 0 "[ . 1 . 2]" 1
688 1 33 THR HB 1 34 LEU H 2.790 . 3.780 2.486 2.249 3.573 . 0 0 "[ . 1 . 2]" 1
689 1 33 THR HA 1 34 LEU H 2.730 . 3.660 2.459 2.352 2.519 . 0 0 "[ . 1 . 2]" 1
690 1 34 LEU H 1 34 LEU HG 2.610 . 3.420 2.276 2.133 2.451 . 0 0 "[ . 1 . 2]" 1
691 1 34 LEU H 1 34 LEU HB2 3.150 . 4.500 2.516 2.469 2.594 . 0 0 "[ . 1 . 2]" 1
692 1 33 THR MG 1 34 LEU H 3.060 . 4.320 3.559 1.934 3.880 . 0 0 "[ . 1 . 2]" 1
693 1 34 LEU H 1 34 LEU MD2 3.060 . 4.320 3.255 3.073 3.443 . 0 0 "[ . 1 . 2]" 1
694 1 34 LEU H 1 34 LEU MD1 3.330 . 4.860 3.662 3.553 3.799 . 0 0 "[ . 1 . 2]" 1
695 1 43 ARG H 1 54 VAL H 2.860 . 3.920 3.016 2.406 3.654 . 0 0 "[ . 1 . 2]" 1
696 1 42 GLU H 1 43 ARG H 3.390 . 4.980 4.515 4.421 4.588 . 0 0 "[ . 1 . 2]" 1
697 1 42 GLU HA 1 43 ARG H 2.500 . 3.200 2.229 2.086 2.348 . 0 0 "[ . 1 . 2]" 1
698 1 43 ARG H 1 55 ARG HA 3.090 . 4.380 3.445 2.842 3.723 . 0 0 "[ . 1 . 2]" 1
699 1 43 ARG H 1 43 ARG HD3 3.630 . 5.460 5.078 4.803 5.289 . 0 0 "[ . 1 . 2]" 1
700 1 42 GLU HG2 1 43 ARG H 3.560 . 5.320 4.899 4.552 5.258 . 0 0 "[ . 1 . 2]" 1
701 1 42 GLU HB3 1 43 ARG H 2.870 . 3.940 2.841 2.421 3.348 . 0 0 "[ . 1 . 2]" 1
702 1 43 ARG H 1 43 ARG HB3 2.980 . 4.160 2.583 2.400 2.752 . 0 0 "[ . 1 . 2]" 1
703 1 43 ARG H 1 43 ARG HB2 2.980 . 4.160 3.189 3.002 3.567 . 0 0 "[ . 1 . 2]" 1
704 1 43 ARG H 1 43 ARG HG3 3.360 . 4.920 4.374 4.025 4.488 . 0 0 "[ . 1 . 2]" 1
705 1 43 ARG H 1 56 ILE MD 3.630 . 5.460 4.180 3.770 4.584 . 0 0 "[ . 1 . 2]" 1
706 1 45 VAL H 1 46 GLU H 3.770 . 5.740 4.477 4.395 4.527 . 0 0 "[ . 1 . 2]" 1
707 1 45 VAL H 1 45 VAL HB 3.060 . 4.320 3.823 3.756 3.911 . 0 0 "[ . 1 . 2]" 1
708 1 44 VAL MG2 1 45 VAL H 3.190 . 4.580 3.763 2.680 4.319 . 0 0 "[ . 1 . 2]" 1
709 1 82 LEU HA 1 83 LEU H 2.610 . 3.410 2.224 2.174 2.283 . 0 0 "[ . 1 . 2]" 1
710 1 83 LEU H 1 83 LEU HB2 2.800 . 3.800 2.498 2.399 2.662 . 0 0 "[ . 1 . 2]" 1
711 1 66 ILE HB 1 83 LEU H 2.900 . 4.000 3.057 2.862 3.393 . 0 0 "[ . 1 . 2]" 1
712 1 82 LEU HB3 1 83 LEU H 2.830 . 3.860 3.770 3.364 3.939 0.079 9 0 "[ . 1 . 2]" 1
713 1 30 LEU HB2 1 83 LEU H 4.480 . 7.160 5.778 5.500 6.101 . 0 0 "[ . 1 . 2]" 1
714 1 47 VAL H 1 50 ARG H 2.950 . 4.100 3.103 2.526 3.683 . 0 0 "[ . 1 . 2]" 1
715 1 46 GLU HA 1 47 VAL H 2.450 . 3.100 2.176 2.119 2.269 . 0 0 "[ . 1 . 2]" 1
716 1 47 VAL H 1 47 VAL HB 2.900 . 4.000 3.214 2.992 3.627 . 0 0 "[ . 1 . 2]" 1
717 1 28 ALA H 1 84 VAL H 3.170 . 4.540 3.879 3.531 4.112 . 0 0 "[ . 1 . 2]" 1
718 1 83 LEU HA 1 84 VAL H 2.570 . 3.340 2.145 2.109 2.186 . 0 0 "[ . 1 . 2]" 1
719 1 84 VAL H 1 84 VAL HB 2.740 . 3.680 2.638 2.553 2.744 . 0 0 "[ . 1 . 2]" 1
720 1 83 LEU HB3 1 84 VAL H 3.060 . 4.320 3.785 3.723 3.844 . 0 0 "[ . 1 . 2]" 1
721 1 84 VAL H 1 84 VAL MG2 3.080 . 4.360 2.151 2.057 2.218 . 0 0 "[ . 1 . 2]" 1
722 1 26 LEU HA 1 27 ARG H 2.810 . 3.820 2.170 2.123 2.240 . 0 0 "[ . 1 . 2]" 1
723 1 27 ARG H 1 27 ARG HB2 2.920 . 4.040 3.029 2.866 3.175 . 0 0 "[ . 1 . 2]" 1
724 1 27 ARG H 1 27 ARG HB3 2.820 . 3.840 2.566 2.472 2.673 . 0 0 "[ . 1 . 2]" 1
725 1 26 LEU HB2 1 27 ARG H 3.480 . 5.160 4.307 4.251 4.374 . 0 0 "[ . 1 . 2]" 1
726 1 24 ARG H 1 25 ASP H 3.460 . 5.120 4.547 4.429 4.677 . 0 0 "[ . 1 . 2]" 1
727 1 24 ARG HA 1 25 ASP H 2.450 . 3.100 2.235 2.165 2.381 . 0 0 "[ . 1 . 2]" 1
728 1 25 ASP H 1 25 ASP HB3 3.090 . 4.380 3.691 3.398 3.787 . 0 0 "[ . 1 . 2]" 1
729 1 24 ARG HB2 1 25 ASP H 3.220 . 4.640 3.812 2.883 4.211 . 0 0 "[ . 1 . 2]" 1
730 1 24 ARG HB3 1 25 ASP H 3.220 . 4.640 3.482 2.852 4.224 . 0 0 "[ . 1 . 2]" 1
731 1 25 ASP H 1 26 LEU MD2 3.340 . 4.880 3.738 3.387 4.121 . 0 0 "[ . 1 . 2]" 1
732 1 46 GLU H 1 47 VAL H 3.350 . 4.900 4.359 4.168 4.539 . 0 0 "[ . 1 . 2]" 1
733 1 43 ARG HA 1 44 VAL H 2.620 . 3.440 2.158 2.111 2.223 . 0 0 "[ . 1 . 2]" 1
734 1 45 VAL HA 1 46 GLU H 2.800 . 3.800 2.439 2.271 2.541 . 0 0 "[ . 1 . 2]" 1
735 1 43 ARG HD3 1 44 VAL H 3.220 . 4.640 3.372 2.103 4.036 . 0 0 "[ . 1 . 2]" 1
736 1 43 ARG HD2 1 44 VAL H 3.160 . 4.520 3.049 2.284 4.289 . 0 0 "[ . 1 . 2]" 1
737 1 45 VAL HB 1 46 GLU H 3.050 . 4.300 2.611 2.430 2.963 . 0 0 "[ . 1 . 2]" 1
738 1 44 VAL H 1 44 VAL HB 2.670 . 3.540 2.588 2.429 3.004 . 0 0 "[ . 1 . 2]" 1
739 1 46 GLU H 1 46 GLU HB3 2.800 . 3.800 2.629 2.309 3.179 . 0 0 "[ . 1 . 2]" 1
740 1 46 GLU H 1 46 GLU HB2 2.800 . 3.800 2.985 2.581 3.810 0.010 10 0 "[ . 1 . 2]" 1
741 1 43 ARG HG3 1 44 VAL H 3.000 . 4.200 3.639 3.504 3.883 . 0 0 "[ . 1 . 2]" 1
742 1 45 VAL MG2 1 46 GLU H 3.130 . 4.460 3.459 3.225 3.815 . 0 0 "[ . 1 . 2]" 1
743 1 4 LEU HB3 1 5 LEU H 2.650 . 3.500 3.679 2.604 4.035 0.535 18 2 "[ . 1 -. + 2]" 1
744 1 5 LEU H 1 5 LEU HB2 2.860 . 3.920 3.056 2.859 3.183 . 0 0 "[ . 1 . 2]" 1
745 1 54 VAL H 1 55 ARG H 3.510 . 5.220 4.448 4.098 4.544 . 0 0 "[ . 1 . 2]" 1
746 1 55 ARG H 1 56 ILE H 3.450 . 5.100 4.384 4.184 4.536 . 0 0 "[ . 1 . 2]" 1
747 1 54 VAL HA 1 55 ARG H 2.430 . 3.060 2.204 2.150 2.403 . 0 0 "[ . 1 . 2]" 1
748 1 55 ARG H 1 55 ARG HB3 2.560 . 3.320 2.507 2.454 2.588 . 0 0 "[ . 1 . 2]" 1
749 1 55 ARG H 1 55 ARG HG3 3.440 . 5.080 4.563 4.495 4.696 . 0 0 "[ . 1 . 2]" 1
750 1 87 LEU HA 1 88 LEU H 2.490 . 3.180 2.129 2.072 2.154 . 0 0 "[ . 1 . 2]" 1
751 1 33 THR HA 1 88 LEU H 3.140 . 4.480 2.743 2.095 3.322 . 0 0 "[ . 1 . 2]" 1
752 1 87 LEU HB2 1 88 LEU H 3.320 . 4.840 4.361 4.204 4.485 . 0 0 "[ . 1 . 2]" 1
753 1 88 LEU H 1 88 LEU HB2 2.460 . 3.120 2.519 2.414 2.597 . 0 0 "[ . 1 . 2]" 1
754 1 87 LEU HB3 1 88 LEU H 2.870 . 3.940 3.555 3.204 3.905 . 0 0 "[ . 1 . 2]" 1
755 1 88 LEU H 1 88 LEU MD2 2.860 . 3.920 3.269 3.008 3.589 . 0 0 "[ . 1 . 2]" 1
756 1 87 LEU MD2 1 88 LEU H 2.870 . 3.940 3.634 3.355 3.852 . 0 0 "[ . 1 . 2]" 1
757 1 1 MET HA 1 2 LEU H 2.550 . 3.300 2.565 2.228 3.565 0.265 11 0 "[ . 1 . 2]" 1
758 1 2 LEU H 1 8 PRO HD3 3.800 . 5.800 4.204 2.716 5.177 . 0 0 "[ . 1 . 2]" 1
759 1 2 LEU H 1 2 LEU MD1 3.470 . 5.140 4.402 3.740 4.860 . 0 0 "[ . 1 . 2]" 1
760 1 30 LEU H 1 86 ARG H 3.390 . 4.980 3.509 3.028 4.011 . 0 0 "[ . 1 . 2]" 1
761 1 32 LEU H 1 86 ARG H 3.460 . 5.120 3.628 3.218 4.078 . 0 0 "[ . 1 . 2]" 1
762 1 31 PRO HA 1 86 ARG H 3.090 . 4.380 3.545 3.314 3.835 . 0 0 "[ . 1 . 2]" 1
763 1 85 VAL HA 1 86 ARG H 2.520 . 3.240 2.113 2.060 2.160 . 0 0 "[ . 1 . 2]" 1
764 1 86 ARG H 1 86 ARG HG2 2.850 . 3.900 2.843 2.592 3.105 . 0 0 "[ . 1 . 2]" 1
765 1 86 ARG H 1 86 ARG HB2 2.960 . 4.120 2.527 2.369 2.725 . 0 0 "[ . 1 . 2]" 1
766 1 85 VAL MG1 1 86 ARG H 2.670 . 3.540 2.883 2.499 3.305 . 0 0 "[ . 1 . 2]" 1
767 1 42 GLU HA 1 56 ILE H 2.990 . 4.180 3.082 2.437 3.485 . 0 0 "[ . 1 . 2]" 1
768 1 55 ARG HA 1 56 ILE H 2.530 . 3.260 2.114 2.061 2.147 . 0 0 "[ . 1 . 2]" 1
769 1 56 ILE H 1 56 ILE HB 3.060 . 4.320 3.684 3.618 3.757 . 0 0 "[ . 1 . 2]" 1
770 1 55 ARG HB3 1 56 ILE H 3.680 . 5.560 4.298 4.101 4.455 . 0 0 "[ . 1 . 2]" 1
771 1 56 ILE H 1 56 ILE HG12 2.870 . 3.940 1.983 1.858 2.111 . 0 0 "[ . 1 . 2]" 1
772 1 56 ILE H 1 56 ILE HG13 3.000 . 4.200 3.323 3.195 3.474 . 0 0 "[ . 1 . 2]" 1
773 1 56 ILE H 1 56 ILE MG 3.010 . 4.220 2.503 2.231 2.767 . 0 0 "[ . 1 . 2]" 1
774 1 66 ILE HA 1 67 ARG H 2.470 . 3.140 2.221 2.167 2.295 . 0 0 "[ . 1 . 2]" 1
775 1 66 ILE MG 1 67 ARG H 2.650 . 3.500 3.364 3.035 3.488 . 0 0 "[ . 1 . 2]" 1
776 1 27 ARG H 1 28 ALA H 3.440 . 5.080 4.139 4.061 4.228 . 0 0 "[ . 1 . 2]" 1
777 1 27 ARG HA 1 28 ALA H 2.600 . 3.400 2.155 2.122 2.207 . 0 0 "[ . 1 . 2]" 1
778 1 28 ALA H 1 83 LEU HA 3.080 . 4.360 3.169 3.018 3.349 . 0 0 "[ . 1 . 2]" 1
779 1 27 ARG HB2 1 28 ALA H 3.510 . 5.220 4.441 4.358 4.506 . 0 0 "[ . 1 . 2]" 1
780 1 28 ALA H 1 82 LEU HB2 3.640 . 5.480 3.851 3.600 4.153 . 0 0 "[ . 1 . 2]" 1
781 1 28 ALA H 1 28 ALA MB 2.810 . 3.820 2.552 2.466 2.693 . 0 0 "[ . 1 . 2]" 1
782 1 28 ALA H 1 83 LEU MD2 2.890 . 3.980 2.980 2.678 3.310 . 0 0 "[ . 1 . 2]" 1
783 1 45 VAL H 1 52 VAL H 2.740 . 3.680 3.449 2.681 3.691 0.011 14 0 "[ . 1 . 2]" 1
784 1 53 SER H 1 54 VAL H 3.720 . 5.640 4.312 4.183 4.561 . 0 0 "[ . 1 . 2]" 1
785 1 42 GLU HA 1 54 VAL H 3.500 . 5.200 4.694 4.119 5.182 . 0 0 "[ . 1 . 2]" 1
786 1 54 VAL H 1 55 ARG HA 3.790 . 5.780 5.082 4.671 5.201 . 0 0 "[ . 1 . 2]" 1
787 1 46 GLU HA 1 52 VAL H 3.090 . 4.380 3.338 2.791 4.038 . 0 0 "[ . 1 . 2]" 1
788 1 62 GLU HA 1 87 LEU H 3.250 . 4.700 2.852 2.517 3.203 . 0 0 "[ . 1 . 2]" 1
789 1 62 GLU HB2 1 87 LEU H 3.410 . 5.020 3.060 2.581 3.665 . 0 0 "[ . 1 . 2]" 1
790 1 87 LEU H 1 87 LEU HB2 2.700 . 3.600 2.476 2.423 2.571 . 0 0 "[ . 1 . 2]" 1
791 1 86 ARG HB3 1 87 LEU H 2.840 . 3.880 3.809 3.643 3.941 0.061 13 0 "[ . 1 . 2]" 1
792 1 87 LEU H 1 87 LEU HG 3.020 . 4.240 2.536 2.361 2.774 . 0 0 "[ . 1 . 2]" 1
793 1 87 LEU H 1 87 LEU HB3 2.990 . 4.180 3.626 3.589 3.652 . 0 0 "[ . 1 . 2]" 1
794 1 87 LEU H 1 87 LEU MD1 3.180 . 4.560 3.874 3.778 3.986 . 0 0 "[ . 1 . 2]" 1
795 1 85 VAL MG1 1 87 LEU H 3.460 . 5.120 3.492 3.280 3.724 . 0 0 "[ . 1 . 2]" 1
796 1 47 VAL HA 1 48 ALA H 2.650 . 3.500 2.191 2.145 2.275 . 0 0 "[ . 1 . 2]" 1
797 1 48 ALA H 1 48 ALA MB 2.930 . 4.070 2.891 2.840 2.926 . 0 0 "[ . 1 . 2]" 1
798 1 84 VAL H 1 85 VAL H 3.450 . 5.100 4.182 4.099 4.307 . 0 0 "[ . 1 . 2]" 1
799 1 64 SER H 1 85 VAL H 3.640 . 5.480 4.168 3.881 4.622 . 0 0 "[ . 1 . 2]" 1
800 1 85 VAL H 1 86 ARG H 3.870 . 5.940 4.445 4.241 4.574 . 0 0 "[ . 1 . 2]" 1
801 1 65 VAL HA 1 85 VAL H 3.150 . 4.510 3.040 2.835 3.189 . 0 0 "[ . 1 . 2]" 1
802 1 84 VAL HA 1 85 VAL H 2.510 . 3.220 2.193 2.141 2.239 . 0 0 "[ . 1 . 2]" 1
803 1 64 SER HB2 1 85 VAL H 3.330 . 4.860 4.068 3.862 4.211 . 0 0 "[ . 1 . 2]" 1
804 1 85 VAL H 1 85 VAL HB 2.610 . 3.410 2.574 2.512 2.628 . 0 0 "[ . 1 . 2]" 1
805 1 65 VAL HB 1 85 VAL H 3.650 . 5.500 4.944 4.667 5.829 0.329 12 0 "[ . 1 . 2]" 1
806 1 84 VAL HB 1 85 VAL H 3.740 . 5.680 4.415 4.322 4.466 . 0 0 "[ . 1 . 2]" 1
807 1 85 VAL H 1 85 VAL MG2 2.540 . 3.280 2.074 2.000 2.249 . 0 0 "[ . 1 . 2]" 1
808 1 85 VAL H 1 85 VAL MG1 3.050 . 4.300 3.824 3.807 3.866 . 0 0 "[ . 1 . 2]" 1
809 1 28 ALA H 1 82 LEU H 3.390 . 4.980 3.955 3.693 4.185 . 0 0 "[ . 1 . 2]" 1
810 1 26 LEU H 1 82 LEU H 3.280 . 4.760 4.177 3.844 4.469 . 0 0 "[ . 1 . 2]" 1
811 1 27 ARG HA 1 82 LEU H 2.970 . 4.140 2.886 2.655 3.325 . 0 0 "[ . 1 . 2]" 1
812 1 81 LEU HA 1 82 LEU H 2.690 . 3.580 2.185 2.151 2.237 . 0 0 "[ . 1 . 2]" 1
813 1 82 LEU H 1 82 LEU HB2 2.760 . 3.720 2.652 2.613 2.684 . 0 0 "[ . 1 . 2]" 1
814 1 82 LEU H 1 82 LEU HG 2.820 . 3.840 3.184 3.051 3.312 . 0 0 "[ . 1 . 2]" 1
815 1 82 LEU H 1 82 LEU HB3 2.910 . 4.020 3.788 3.762 3.806 . 0 0 "[ . 1 . 2]" 1
816 1 81 LEU MD1 1 82 LEU H 2.760 . 3.720 2.371 1.984 2.930 . 0 0 "[ . 1 . 2]" 1
817 1 66 ILE H 1 85 VAL H 3.470 . 5.140 4.024 3.663 4.288 . 0 0 "[ . 1 . 2]" 1
818 1 66 ILE H 1 83 LEU H 2.980 . 4.160 2.685 2.290 3.155 . 0 0 "[ . 1 . 2]" 1
819 1 65 VAL HA 1 66 ILE H 2.530 . 3.260 2.144 2.102 2.239 . 0 0 "[ . 1 . 2]" 1
820 1 66 ILE H 1 84 VAL HA 3.190 . 4.580 3.615 3.364 3.835 . 0 0 "[ . 1 . 2]" 1
821 1 66 ILE H 1 83 LEU HB2 3.030 . 4.260 3.161 2.804 3.534 . 0 0 "[ . 1 . 2]" 1
822 1 66 ILE H 1 66 ILE HB 2.740 . 3.680 2.544 2.405 2.618 . 0 0 "[ . 1 . 2]" 1
823 1 66 ILE H 1 83 LEU HB3 3.280 . 4.760 4.188 3.891 4.459 . 0 0 "[ . 1 . 2]" 1
824 1 65 VAL MG2 1 66 ILE H 3.130 . 4.460 2.823 2.392 4.266 . 0 0 "[ . 1 . 2]" 1
825 1 65 VAL MG1 1 66 ILE H 3.130 . 4.460 3.967 2.825 4.273 . 0 0 "[ . 1 . 2]" 1
826 1 66 ILE H 1 66 ILE MD 2.750 . 3.700 3.638 3.427 3.762 0.062 8 0 "[ . 1 . 2]" 1
827 1 67 ARG H 1 68 VAL H 3.400 . 5.000 4.310 4.206 4.418 . 0 0 "[ . 1 . 2]" 1
828 1 67 ARG HA 1 68 VAL H 2.630 . 3.460 2.155 2.133 2.188 . 0 0 "[ . 1 . 2]" 1
829 1 68 VAL H 1 68 VAL HB 2.760 . 3.720 2.759 2.647 2.835 . 0 0 "[ . 1 . 2]" 1
830 1 68 VAL H 1 81 LEU HB3 2.950 . 4.100 2.575 2.363 2.805 . 0 0 "[ . 1 . 2]" 1
831 1 67 ARG HG2 1 68 VAL H 3.050 . 4.300 3.573 3.272 4.066 . 0 0 "[ . 1 . 2]" 1
832 1 67 ARG HG3 1 68 VAL H 3.050 . 4.300 3.583 3.336 4.206 . 0 0 "[ . 1 . 2]" 1
833 1 68 VAL H 1 68 VAL MG2 2.570 . 3.340 2.443 2.205 2.646 . 0 0 "[ . 1 . 2]" 1
834 1 31 PRO HA 1 32 LEU H 2.570 . 3.340 2.167 2.133 2.202 . 0 0 "[ . 1 . 2]" 1
835 1 32 LEU H 1 87 LEU HA 3.090 . 4.380 3.530 3.085 3.972 . 0 0 "[ . 1 . 2]" 1
836 1 30 LEU H 1 85 VAL HA 3.110 . 4.420 3.154 2.924 3.485 . 0 0 "[ . 1 . 2]" 1
837 1 30 LEU H 1 30 LEU HB3 2.820 . 3.840 2.695 2.355 2.845 . 0 0 "[ . 1 . 2]" 1
838 1 32 LEU H 1 88 LEU HG 2.960 . 4.120 2.399 2.119 2.776 . 0 0 "[ . 1 . 2]" 1
839 1 30 LEU H 1 30 LEU HB2 2.930 . 4.070 2.649 2.506 2.989 . 0 0 "[ . 1 . 2]" 1
840 1 4 LEU MD2 1 30 LEU H 3.640 . 5.480 5.695 5.585 5.933 0.453 7 0 "[ . 1 . 2]" 1
841 1 30 LEU H 1 85 VAL MG2 3.820 . 5.840 4.493 4.338 4.807 . 0 0 "[ . 1 . 2]" 1
842 1 30 LEU H 1 83 LEU MD2 3.150 . 4.500 4.208 3.832 4.484 . 0 0 "[ . 1 . 2]" 1
843 1 32 LEU H 1 32 LEU MD1 3.150 . 4.500 4.334 4.221 4.430 . 0 0 "[ . 1 . 2]" 1
844 1 32 LEU H 1 85 VAL MG1 2.870 . 3.940 3.990 3.931 4.053 0.113 15 0 "[ . 1 . 2]" 1
845 1 68 VAL H 1 82 LEU MD2 3.260 . 4.720 4.002 3.545 4.255 . 0 0 "[ . 1 . 2]" 1
846 1 63 GLY H 1 85 VAL H 3.510 . 5.220 4.657 4.300 4.873 . 0 0 "[ . 1 . 2]" 1
847 1 85 VAL HB 1 86 ARG H 3.460 . 5.120 4.285 4.107 4.414 . 0 0 "[ . 1 . 2]" 1
848 1 32 LEU HB2 1 86 ARG H 3.440 . 5.080 4.054 3.385 4.643 . 0 0 "[ . 1 . 2]" 1
849 1 67 ARG H 1 83 LEU HB2 4.170 . 6.540 5.912 5.688 6.166 . 0 0 "[ . 1 . 2]" 1
850 1 66 ILE H 1 67 ARG H 3.510 . 5.220 4.175 4.082 4.353 . 0 0 "[ . 1 . 2]" 1
851 1 28 ALA H 1 29 GLU H 3.600 . 5.400 4.361 4.298 4.413 . 0 0 "[ . 1 . 2]" 1
852 1 88 LEU H 1 89 PRO HD3 3.720 . 5.640 4.969 4.721 5.293 . 0 0 "[ . 1 . 2]" 1
853 1 32 LEU H 1 88 LEU H 3.350 . 4.900 3.301 3.023 3.640 . 0 0 "[ . 1 . 2]" 1
854 1 55 ARG H 1 55 ARG HG2 3.330 . 4.860 4.480 4.441 4.548 . 0 0 "[ . 1 . 2]" 1
855 1 42 GLU HA 1 55 ARG H 3.720 . 5.640 4.356 3.955 5.024 . 0 0 "[ . 1 . 2]" 1
856 1 2 LEU H 1 8 PRO HD2 3.800 . 5.800 3.595 2.311 4.685 . 0 0 "[ . 1 . 2]" 1
857 1 87 LEU H 1 88 LEU H 3.470 . 5.140 4.410 4.180 4.563 . 0 0 "[ . 1 . 2]" 1
858 1 86 ARG H 1 87 LEU H 3.710 . 5.620 4.134 3.960 4.342 . 0 0 "[ . 1 . 2]" 1
859 1 47 VAL H 1 52 VAL H 3.610 . 5.420 4.109 3.579 4.667 . 0 0 "[ . 1 . 2]" 1
860 1 9 VAL HB 1 25 ASP H 3.240 . 4.680 4.422 3.992 4.688 0.008 10 0 "[ . 1 . 2]" 1
861 1 25 ASP H 1 26 LEU HG 3.740 . 5.680 5.411 4.971 5.757 0.077 19 0 "[ . 1 . 2]" 1
862 1 44 VAL MG1 1 45 VAL H 3.190 . 4.580 3.429 2.719 4.221 . 0 0 "[ . 1 . 2]" 1
863 1 26 LEU MD2 1 27 ARG H 3.350 . 4.900 4.117 4.020 4.205 . 0 0 "[ . 1 . 2]" 1
864 1 27 ARG HA 1 84 VAL H 3.750 . 5.700 5.109 4.790 5.527 . 0 0 "[ . 1 . 2]" 1
865 1 44 VAL H 1 45 VAL H 3.390 . 4.980 4.342 4.216 4.510 . 0 0 "[ . 1 . 2]" 1
866 1 4 LEU MD2 1 5 LEU H 3.530 . 5.260 4.296 4.106 4.694 . 0 0 "[ . 1 . 2]" 1
867 1 5 LEU H 1 5 LEU HB3 2.860 . 3.920 3.665 2.885 3.883 . 0 0 "[ . 1 . 2]" 1
868 1 64 SER H 1 65 VAL H 3.480 . 5.160 4.486 4.439 4.524 . 0 0 "[ . 1 . 2]" 1
869 1 65 VAL H 1 66 ILE H 3.450 . 5.100 4.445 4.329 4.539 . 0 0 "[ . 1 . 2]" 1
870 1 64 SER HA 1 65 VAL H 2.400 . 3.000 2.179 2.140 2.222 . 0 0 "[ . 1 . 2]" 1
871 1 64 SER HB3 1 65 VAL H 2.850 . 3.900 3.527 3.454 3.587 . 0 0 "[ . 1 . 2]" 1
872 1 65 VAL H 1 65 VAL HB 2.730 . 3.660 2.927 2.590 3.070 . 0 0 "[ . 1 . 2]" 1
873 1 65 VAL H 1 65 VAL MG2 3.050 . 4.290 3.734 2.349 3.899 . 0 0 "[ . 1 . 2]" 1
874 1 65 VAL H 1 65 VAL MG1 3.050 . 4.290 2.178 1.959 3.886 . 0 0 "[ . 1 . 2]" 1
875 1 9 VAL H 1 26 LEU MD2 3.220 . 4.640 3.206 2.914 3.441 . 0 0 "[ . 1 . 2]" 1
876 1 7 THR MG 1 9 VAL H 3.670 . 5.540 3.555 2.970 4.091 . 0 0 "[ . 1 . 2]" 1
877 1 9 VAL H 1 10 THR MG 4.840 . 7.880 5.658 4.695 6.206 . 0 0 "[ . 1 . 2]" 1
878 1 8 PRO HB2 1 9 VAL H 3.340 . 4.880 4.269 4.052 4.401 . 0 0 "[ . 1 . 2]" 1
879 1 9 VAL H 1 9 VAL HB 2.710 . 3.620 3.700 3.629 3.788 0.168 3 0 "[ . 1 . 2]" 1
880 1 8 PRO HB3 1 9 VAL H 3.340 . 4.880 4.527 4.357 4.653 . 0 0 "[ . 1 . 2]" 1
881 1 9 VAL H 1 26 LEU HA 3.760 . 5.720 4.538 4.071 5.057 . 0 0 "[ . 1 . 2]" 1
882 1 8 PRO HA 1 9 VAL H 2.690 . 3.580 2.330 2.174 2.491 . 0 0 "[ . 1 . 2]" 1
883 1 9 VAL H 1 27 ARG H 4.330 . 6.860 5.754 5.137 6.308 . 0 0 "[ . 1 . 2]" 1
884 1 35 GLU H 1 37 ALA H 3.630 . 5.460 3.871 3.646 4.087 . 0 0 "[ . 1 . 2]" 1
885 1 62 GLU H 1 87 LEU HG 2.960 . 4.120 2.798 2.276 3.622 . 0 0 "[ . 1 . 2]" 1
886 1 5 LEU MD1 1 6 PHE H 3.680 . 5.560 4.666 3.730 5.368 . 0 0 "[ . 1 . 2]" 1
887 1 61 ARG HA 1 64 SER H 3.890 . 5.980 5.305 5.078 5.503 . 0 0 "[ . 1 . 2]" 1
888 1 61 ARG HB3 1 64 SER H 3.530 . 5.260 4.849 4.529 5.283 0.023 10 0 "[ . 1 . 2]" 1
889 1 80 ASP H 1 81 LEU H 3.630 . 5.460 4.590 4.510 4.678 . 0 0 "[ . 1 . 2]" 1
890 1 70 GLY H 1 80 ASP H 3.830 . 5.860 4.420 4.063 4.792 . 0 0 "[ . 1 . 2]" 1
891 1 63 GLY H 1 84 VAL HA 3.950 . 6.100 5.487 5.097 5.797 . 0 0 "[ . 1 . 2]" 1
892 1 61 ARG H 1 62 GLU H 3.550 . 5.300 4.429 4.370 4.476 . 0 0 "[ . 1 . 2]" 1
893 1 38 PHE HD1 1 39 HIS H 4.100 . 6.400 5.690 5.476 5.852 . 0 0 "[ . 1 . 2]" 1
894 1 33 THR H 1 36 GLU HA 3.850 . 5.900 5.591 5.293 5.849 . 0 0 "[ . 1 . 2]" 1
895 1 38 PHE H 1 38 PHE HD1 3.510 . 5.220 4.732 4.646 4.884 . 0 0 "[ . 1 . 2]" 1
896 1 26 LEU MD1 1 27 ARG H 3.910 . 6.020 5.363 5.279 5.487 . 0 0 "[ . 1 . 2]" 1
897 1 60 VAL MG2 1 61 ARG H 2.990 . 4.180 2.235 2.101 2.399 . 0 0 "[ . 1 . 2]" 1
898 1 60 VAL MG1 1 61 ARG H 2.900 . 4.000 3.712 3.576 3.878 . 0 0 "[ . 1 . 2]" 1
899 1 1 MET HA 1 1 MET QG 2.940 . 4.080 2.920 2.404 3.551 . 0 0 "[ . 1 . 2]" 1
900 1 1 MET QB 1 2 LEU H 3.110 . 4.420 2.436 1.910 3.497 . 0 0 "[ . 1 . 2]" 1
901 1 1 MET QB 1 2 LEU QB 3.170 . 4.540 4.042 3.115 4.857 0.317 5 0 "[ . 1 . 2]" 1
902 1 1 MET QB 1 2 LEU QD 2.980 . 4.160 2.951 2.025 4.357 0.197 14 0 "[ . 1 . 2]" 1
903 1 1 MET QG 1 2 LEU H 3.230 . 4.660 3.371 1.724 4.190 0.076 5 0 "[ . 1 . 2]" 1
904 1 2 LEU H 1 2 LEU QB 2.610 . 3.420 2.797 2.385 2.981 . 0 0 "[ . 1 . 2]" 1
905 1 2 LEU H 1 2 LEU QD 2.960 . 4.120 2.729 1.765 4.162 0.042 14 0 "[ . 1 . 2]" 1
906 1 2 LEU H 1 8 PRO QG 3.120 . 4.440 4.176 2.875 4.725 0.285 7 0 "[ . 1 . 2]" 1
907 1 2 LEU H 1 8 PRO QD 3.330 . 4.860 3.356 2.206 4.001 . 0 0 "[ . 1 . 2]" 1
908 1 2 LEU HA 1 2 LEU QD 2.960 . 4.120 3.391 2.664 3.560 . 0 0 "[ . 1 . 2]" 1
909 1 2 LEU HA 1 8 PRO QG 3.580 . 5.360 4.366 3.469 5.119 . 0 0 "[ . 1 . 2]" 1
910 1 2 LEU HA 1 8 PRO QD 2.590 . 3.380 2.908 2.261 3.403 0.023 13 0 "[ . 1 . 2]" 1
911 1 2 LEU QB 1 2 LEU QD 2.440 . 3.080 1.957 1.930 1.987 . 0 0 "[ . 1 . 2]" 1
912 1 2 LEU QB 1 7 THR HA 3.170 . 4.540 2.315 1.803 3.857 . 0 0 "[ . 1 . 2]" 1
913 1 2 LEU QB 1 8 PRO QG 3.480 . 5.160 4.257 3.468 4.971 . 0 0 "[ . 1 . 2]" 1
914 1 2 LEU QB 1 8 PRO QD 2.740 . 3.680 2.643 2.001 3.205 . 0 0 "[ . 1 . 2]" 1
915 1 2 LEU QD 1 7 THR HA 3.180 . 4.560 3.372 2.657 4.026 . 0 0 "[ . 1 . 2]" 1
916 1 2 LEU QD 1 7 THR HB 3.750 . 5.700 4.029 3.693 4.563 . 0 0 "[ . 1 . 2]" 1
917 1 2 LEU QD 1 7 THR MG 3.240 . 4.680 2.111 1.797 2.648 0.003 1 0 "[ . 1 . 2]" 1
918 1 2 LEU QD 1 8 PRO QD 2.910 . 4.020 3.427 2.660 4.062 0.042 6 0 "[ . 1 . 2]" 1
919 1 2 LEU QD 1 28 ALA HA 3.260 . 4.730 2.322 1.930 2.897 . 0 0 "[ . 1 . 2]" 1
920 1 2 LEU QD 1 28 ALA MB 2.380 . 2.970 2.765 2.350 3.104 0.134 9 0 "[ . 1 . 2]" 1
921 1 3 PRO QB 1 4 LEU H 3.030 . 4.260 2.373 1.825 3.078 . 0 0 "[ . 1 . 2]" 1
922 1 4 LEU HB3 1 45 VAL QG 2.870 . 3.940 3.964 3.682 4.130 0.190 17 0 "[ . 1 . 2]" 1
923 1 4 LEU MD1 1 30 LEU QD 3.150 . 4.500 2.487 1.770 2.963 0.030 9 0 "[ . 1 . 2]" 1
924 1 4 LEU MD1 1 31 PRO QD 3.390 . 4.980 2.144 1.709 2.598 0.091 7 0 "[ . 1 . 2]" 1
925 1 4 LEU MD1 1 45 VAL QG 2.870 . 3.940 2.638 2.264 2.951 . 0 0 "[ . 1 . 2]" 1
926 1 4 LEU MD1 1 54 VAL QG 3.280 . 4.760 4.316 3.943 4.699 . 0 0 "[ . 1 . 2]" 1
927 1 4 LEU MD2 1 31 PRO QD 2.710 . 3.620 2.127 1.903 2.394 . 0 0 "[ . 1 . 2]" 1
928 1 4 LEU MD2 1 45 VAL QG 3.390 . 4.980 1.949 1.790 2.128 0.010 7 0 "[ . 1 . 2]" 1
929 1 5 LEU H 1 5 LEU QB 2.570 . 3.340 2.902 2.558 3.029 . 0 0 "[ . 1 . 2]" 1
930 1 5 LEU H 1 5 LEU QD 3.040 . 4.280 3.680 3.458 4.158 . 0 0 "[ . 1 . 2]" 1
931 1 5 LEU HA 1 5 LEU QD 2.580 . 3.360 2.174 1.952 2.882 . 0 0 "[ . 1 . 2]" 1
932 1 5 LEU QB 1 6 PHE H 3.060 . 4.320 2.859 1.822 4.044 . 0 0 "[ . 1 . 2]" 1
933 1 5 LEU QB 1 47 VAL QG 3.190 . 4.580 2.950 2.575 3.415 . 0 0 "[ . 1 . 2]" 1
934 1 5 LEU HG 1 45 VAL QG 3.660 . 5.520 3.816 3.544 3.948 . 0 0 "[ . 1 . 2]" 1
935 1 5 LEU QD 1 6 PHE H 3.240 . 4.680 3.893 2.949 4.617 . 0 0 "[ . 1 . 2]" 1
936 1 5 LEU QD 1 45 VAL QG 3.230 . 4.660 1.720 1.608 1.860 0.192 16 0 "[ . 1 . 2]" 1
937 1 5 LEU QD 1 47 VAL QG 3.150 . 4.500 2.009 1.750 2.259 0.050 13 0 "[ . 1 . 2]" 1
938 1 5 LEU QD 1 54 VAL HB 3.190 . 4.580 3.188 2.246 4.527 . 0 0 "[ . 1 . 2]" 1
939 1 5 LEU QD 1 54 VAL QG 3.130 . 4.460 2.608 1.948 3.293 . 0 0 "[ . 1 . 2]" 1
940 1 5 LEU QD 1 81 LEU MD1 2.570 . 3.340 1.943 1.772 2.275 0.028 20 0 "[ . 1 . 2]" 1
941 1 5 LEU QD 1 81 LEU MD2 3.010 . 4.220 1.830 1.706 2.192 0.094 4 0 "[ . 1 . 2]" 1
942 1 5 LEU QD 1 83 LEU MD1 2.990 . 4.180 2.012 1.748 2.984 0.052 14 0 "[ . 1 . 2]" 1
943 1 5 LEU QD 1 83 LEU MD2 2.360 . 2.920 1.987 1.747 3.128 0.208 13 0 "[ . 1 . 2]" 1
944 1 6 PHE H 1 6 PHE QB 2.810 . 3.820 2.482 2.170 3.142 . 0 0 "[ . 1 . 2]" 1
945 1 6 PHE QB 1 6 PHE HD1 2.670 . 3.540 2.565 2.401 2.756 . 0 0 "[ . 1 . 2]" 1
946 1 6 PHE QB 1 26 LEU MD2 3.640 . 5.480 4.919 4.169 5.494 0.014 8 0 "[ . 1 . 2]" 1
947 1 6 PHE QB 1 47 VAL QG 3.370 . 4.940 2.010 1.727 2.668 0.073 5 0 "[ . 1 . 2]" 1
948 1 6 PHE HD1 1 26 LEU QB 3.760 . 5.720 4.772 4.075 5.141 . 0 0 "[ . 1 . 2]" 1
949 1 6 PHE HD1 1 47 VAL QG 3.750 . 5.700 2.354 1.932 2.819 . 0 0 "[ . 1 . 2]" 1
950 1 7 THR HA 1 8 PRO QG 3.170 . 4.540 3.994 3.910 4.057 . 0 0 "[ . 1 . 2]" 1
951 1 7 THR HA 1 8 PRO QD 2.470 . 3.140 2.063 1.987 2.119 . 0 0 "[ . 1 . 2]" 1
952 1 7 THR MG 1 8 PRO QB 3.720 . 5.640 5.000 4.875 5.167 . 0 0 "[ . 1 . 2]" 1
953 1 7 THR MG 1 8 PRO QG 3.400 . 5.000 4.401 4.180 4.696 . 0 0 "[ . 1 . 2]" 1
954 1 7 THR MG 1 9 VAL QG 2.220 . 2.640 1.829 1.722 2.109 0.078 19 0 "[ . 1 . 2]" 1
955 1 8 PRO HA 1 9 VAL QG 3.260 . 4.720 3.633 3.450 3.796 . 0 0 "[ . 1 . 2]" 1
956 1 8 PRO QB 1 9 VAL H 2.990 . 4.180 3.906 3.728 4.015 . 0 0 "[ . 1 . 2]" 1
957 1 8 PRO QB 1 9 VAL QG 3.630 . 5.460 4.536 4.378 4.669 . 0 0 "[ . 1 . 2]" 1
958 1 9 VAL H 1 9 VAL QG 2.590 . 3.380 1.994 1.820 2.131 . 0 0 "[ . 1 . 2]" 1
959 1 9 VAL HA 1 9 VAL QG 2.550 . 3.300 2.375 2.234 2.467 . 0 0 "[ . 1 . 2]" 1
960 1 9 VAL HB 1 25 ASP QB 3.530 . 5.260 4.827 4.258 5.516 0.256 19 0 "[ . 1 . 2]" 1
961 1 9 VAL QG 1 10 THR H 3.350 . 4.900 3.008 2.298 3.409 . 0 0 "[ . 1 . 2]" 1
962 1 9 VAL QG 1 25 ASP H 3.280 . 4.760 1.978 1.785 2.410 0.015 13 0 "[ . 1 . 2]" 1
963 1 9 VAL QG 1 25 ASP QB 3.210 . 4.620 2.740 2.085 3.500 . 0 0 "[ . 1 . 2]" 1
964 1 9 VAL QG 1 26 LEU HA 3.070 . 4.340 3.100 2.715 3.470 . 0 0 "[ . 1 . 2]" 1
965 1 9 VAL QG 1 26 LEU MD2 3.930 . 6.050 2.712 2.180 3.200 . 0 0 "[ . 1 . 2]" 1
966 1 9 VAL QG 1 27 ARG H 3.180 . 4.560 3.372 2.936 3.718 . 0 0 "[ . 1 . 2]" 1
967 1 9 VAL QG 1 27 ARG HA 3.900 . 6.000 5.481 5.077 5.740 . 0 0 "[ . 1 . 2]" 1
968 1 9 VAL QG 1 27 ARG HB2 3.300 . 4.800 4.548 4.100 4.820 0.020 10 0 "[ . 1 . 2]" 1
969 1 9 VAL QG 1 27 ARG HB3 3.010 . 4.220 4.030 3.621 4.243 0.023 6 0 "[ . 1 . 2]" 1
970 1 9 VAL QG 1 27 ARG QD 3.500 . 5.200 4.956 4.428 5.289 0.089 16 0 "[ . 1 . 2]" 1
971 1 9 VAL QG 1 82 LEU MD1 3.680 . 5.560 5.020 4.471 5.491 . 0 0 "[ . 1 . 2]" 1
972 1 11 LYS H 1 11 LYS QG 3.460 . 5.120 3.584 1.879 4.602 . 0 0 "[ . 1 . 2]" 1
973 1 11 LYS HA 1 11 LYS QD 3.410 . 5.020 3.433 2.082 4.574 . 0 0 "[ . 1 . 2]" 1
974 1 11 LYS QD 1 11 LYS QG 2.180 . 2.560 2.047 2.003 2.123 . 0 0 "[ . 1 . 2]" 1
975 1 22 SER H 1 22 SER QB 2.890 . 3.980 2.778 2.294 3.411 . 0 0 "[ . 1 . 2]" 1
976 1 22 SER QB 1 23 GLY H 2.730 . 3.660 3.204 1.973 4.023 0.363 7 0 "[ . 1 . 2]" 1
977 1 23 GLY QA 1 24 ARG H 2.430 . 3.060 2.222 2.138 2.499 . 0 0 "[ . 1 . 2]" 1
978 1 23 GLY QA 1 24 ARG HA 3.410 . 5.020 4.010 3.915 4.203 . 0 0 "[ . 1 . 2]" 1
979 1 23 GLY QA 1 24 ARG QG 3.060 . 4.320 3.701 3.323 4.549 0.229 12 0 "[ . 1 . 2]" 1
980 1 23 GLY QA 1 78 PRO HA 3.430 . 5.060 4.151 3.567 5.189 0.129 19 0 "[ . 1 . 2]" 1
981 1 23 GLY QA 1 79 GLY H 3.240 . 4.680 3.499 2.842 4.213 . 0 0 "[ . 1 . 2]" 1
982 1 24 ARG H 1 24 ARG QB 2.750 . 3.700 2.645 2.463 2.922 . 0 0 "[ . 1 . 2]" 1
983 1 24 ARG H 1 24 ARG QG 2.480 . 3.160 2.276 1.841 3.170 0.010 12 0 "[ . 1 . 2]" 1
984 1 24 ARG H 1 24 ARG QD 3.270 . 4.740 3.577 1.720 4.347 0.080 6 0 "[ . 1 . 2]" 1
985 1 24 ARG HA 1 24 ARG QG 2.760 . 3.720 3.036 2.530 3.563 . 0 0 "[ . 1 . 2]" 1
986 1 24 ARG HA 1 24 ARG QD 3.160 . 4.520 3.515 2.141 4.354 . 0 0 "[ . 1 . 2]" 1
987 1 24 ARG HA 1 25 ASP QB 3.550 . 5.300 4.543 4.396 4.678 . 0 0 "[ . 1 . 2]" 1
988 1 24 ARG HA 1 79 GLY QA 3.780 . 5.760 4.174 3.931 4.378 . 0 0 "[ . 1 . 2]" 1
989 1 24 ARG QB 1 24 ARG QG 2.190 . 2.580 2.058 1.999 2.111 . 0 0 "[ . 1 . 2]" 1
990 1 24 ARG QB 1 24 ARG QD 2.640 . 3.480 2.430 2.154 2.867 . 0 0 "[ . 1 . 2]" 1
991 1 24 ARG QB 1 25 ASP H 2.790 . 3.780 3.107 2.770 3.409 . 0 0 "[ . 1 . 2]" 1
992 1 24 ARG QB 1 73 GLY HA2 3.400 . 5.000 3.178 1.994 5.074 0.074 12 0 "[ . 1 . 2]" 1
993 1 24 ARG QG 1 73 GLY H 3.430 . 5.060 4.565 3.163 5.169 0.109 18 0 "[ . 1 . 2]" 1
994 1 24 ARG QG 1 73 GLY HA3 3.420 . 5.040 2.977 1.776 3.684 0.024 19 0 "[ . 1 . 2]" 1
995 1 24 ARG QG 1 79 GLY H 3.620 . 5.440 5.233 4.056 5.552 0.112 6 0 "[ . 1 . 2]" 1
996 1 24 ARG QG 1 80 ASP H 4.210 . 6.620 6.456 4.936 6.814 0.194 11 0 "[ . 1 . 2]" 1
997 1 24 ARG QD 1 25 ASP H 3.470 . 5.140 4.879 3.818 5.354 0.214 5 0 "[ . 1 . 2]" 1
998 1 25 ASP H 1 25 ASP QB 2.620 . 3.440 2.605 2.440 3.081 . 0 0 "[ . 1 . 2]" 1
999 1 25 ASP H 1 79 GLY QA 3.700 . 5.600 4.499 4.182 4.828 . 0 0 "[ . 1 . 2]" 1
1000 1 25 ASP HA 1 79 GLY QA 3.070 . 4.340 3.500 2.911 3.971 . 0 0 "[ . 1 . 2]" 1
1001 1 25 ASP QB 1 26 LEU H 3.010 . 4.220 3.553 3.191 3.640 . 0 0 "[ . 1 . 2]" 1
1002 1 25 ASP QB 1 82 LEU HG 3.580 . 5.360 4.059 3.020 4.675 . 0 0 "[ . 1 . 2]" 1
1003 1 25 ASP QB 1 82 LEU MD1 2.810 . 3.820 3.281 2.466 3.925 0.105 7 0 "[ . 1 . 2]" 1
1004 1 26 LEU H 1 26 LEU QB 2.690 . 3.580 2.643 2.589 2.697 . 0 0 "[ . 1 . 2]" 1
1005 1 26 LEU H 1 72 GLY QA 3.230 . 4.660 2.873 2.518 3.327 . 0 0 "[ . 1 . 2]" 1
1006 1 26 LEU QB 1 26 LEU MD1 2.600 . 3.400 2.141 2.120 2.169 . 0 0 "[ . 1 . 2]" 1
1007 1 26 LEU QB 1 27 ARG H 3.050 . 4.300 3.514 3.438 3.597 . 0 0 "[ . 1 . 2]" 1
1008 1 26 LEU QB 1 72 GLY QA 3.290 . 4.780 2.901 2.541 3.415 . 0 0 "[ . 1 . 2]" 1
1009 1 26 LEU QB 1 81 LEU HA 3.450 . 5.100 3.125 2.830 3.393 . 0 0 "[ . 1 . 2]" 1
1010 1 26 LEU QB 1 81 LEU MD1 2.520 . 3.240 2.291 2.023 2.514 . 0 0 "[ . 1 . 2]" 1
1011 1 26 LEU HG 1 72 GLY QA 3.430 . 5.060 2.478 1.981 2.841 . 0 0 "[ . 1 . 2]" 1
1012 1 26 LEU MD1 1 47 VAL QG 3.340 . 4.880 2.599 2.094 3.113 . 0 0 "[ . 1 . 2]" 1
1013 1 26 LEU MD1 1 72 GLY QA 2.990 . 4.180 2.751 2.208 3.080 . 0 0 "[ . 1 . 2]" 1
1014 1 27 ARG H 1 27 ARG QD 3.510 . 5.220 4.701 4.559 5.025 . 0 0 "[ . 1 . 2]" 1
1015 1 27 ARG HA 1 27 ARG QD 3.500 . 5.200 4.148 4.023 4.331 . 0 0 "[ . 1 . 2]" 1
1016 1 27 ARG HA 1 84 VAL QG 3.650 . 5.500 4.228 3.606 4.692 . 0 0 "[ . 1 . 2]" 1
1017 1 27 ARG HB2 1 27 ARG QD 2.910 . 4.020 2.595 2.353 3.091 . 0 0 "[ . 1 . 2]" 1
1018 1 27 ARG HB3 1 27 ARG QD 2.920 . 4.040 2.440 2.294 2.820 . 0 0 "[ . 1 . 2]" 1
1019 1 27 ARG QG 1 65 VAL QG 3.340 . 4.880 3.528 3.206 4.055 . 0 0 "[ . 1 . 2]" 1
1020 1 27 ARG QG 1 82 LEU HB3 3.090 . 4.380 2.580 2.357 2.814 . 0 0 "[ . 1 . 2]" 1
1021 1 27 ARG QG 1 83 LEU HA 3.510 . 5.220 4.767 4.317 5.279 0.059 2 0 "[ . 1 . 2]" 1
1022 1 27 ARG QG 1 84 VAL QG 2.650 . 3.500 2.614 2.094 3.207 . 0 0 "[ . 1 . 2]" 1
1023 1 27 ARG QD 1 28 ALA H 3.750 . 5.700 5.294 5.063 5.404 . 0 0 "[ . 1 . 2]" 1
1024 1 28 ALA H 1 84 VAL QG 3.200 . 4.600 3.920 3.526 4.110 . 0 0 "[ . 1 . 2]" 1
1025 1 28 ALA MB 1 29 GLU QB 3.460 . 5.120 4.489 4.096 4.875 . 0 0 "[ . 1 . 2]" 1
1026 1 28 ALA MB 1 45 VAL QG 3.710 . 5.620 4.909 4.595 5.345 . 0 0 "[ . 1 . 2]" 1
1027 1 28 ALA MB 1 84 VAL QG 3.360 . 4.920 4.885 4.638 5.019 0.099 9 0 "[ . 1 . 2]" 1
1028 1 29 GLU H 1 29 GLU QB 2.520 . 3.240 2.507 2.244 2.882 . 0 0 "[ . 1 . 2]" 1
1029 1 29 GLU H 1 29 GLU QG 2.780 . 3.760 2.697 1.880 3.506 . 0 0 "[ . 1 . 2]" 1
1030 1 29 GLU QB 1 30 LEU H 2.810 . 3.820 3.152 2.731 3.368 . 0 0 "[ . 1 . 2]" 1
1031 1 29 GLU QB 1 86 ARG HG2 3.470 . 5.140 2.388 2.051 2.969 . 0 0 "[ . 1 . 2]" 1
1032 1 29 GLU QB 1 86 ARG HG3 3.160 . 4.520 2.296 1.807 2.683 . 0 0 "[ . 1 . 2]" 1
1033 1 29 GLU QB 1 86 ARG QD 3.650 . 5.500 3.700 3.074 4.194 . 0 0 "[ . 1 . 2]" 1
1034 1 29 GLU QG 1 30 LEU H 3.380 . 4.950 4.245 3.942 4.857 . 0 0 "[ . 1 . 2]" 1
1035 1 29 GLU QG 1 84 VAL HB 3.280 . 4.760 3.430 1.959 4.705 . 0 0 "[ . 1 . 2]" 1
1036 1 29 GLU QG 1 84 VAL QG 3.190 . 4.580 3.689 2.446 4.726 0.146 2 0 "[ . 1 . 2]" 1
1037 1 29 GLU QG 1 86 ARG HG2 3.160 . 4.520 3.590 2.625 4.544 0.024 13 0 "[ . 1 . 2]" 1
1038 1 29 GLU QG 1 86 ARG HG3 3.360 . 4.920 3.241 2.325 4.081 . 0 0 "[ . 1 . 2]" 1
1039 1 29 GLU QG 1 86 ARG QD 3.440 . 5.080 4.044 2.278 5.026 . 0 0 "[ . 1 . 2]" 1
1040 1 30 LEU H 1 30 LEU QD 3.130 . 4.460 3.900 3.859 3.919 . 0 0 "[ . 1 . 2]" 1
1041 1 30 LEU H 1 31 PRO QD 3.600 . 5.400 4.014 3.906 4.126 . 0 0 "[ . 1 . 2]" 1
1042 1 30 LEU QD 1 31 PRO QD 2.730 . 3.660 2.587 2.190 2.844 . 0 0 "[ . 1 . 2]" 1
1043 1 30 LEU QD 1 32 LEU MD2 3.300 . 4.800 2.911 2.484 3.352 . 0 0 "[ . 1 . 2]" 1
1044 1 30 LEU QD 1 43 ARG HA 4.370 . 6.940 4.782 4.549 5.284 . 0 0 "[ . 1 . 2]" 1
1045 1 30 LEU QD 1 43 ARG QB 2.710 . 3.620 2.856 2.598 3.238 . 0 0 "[ . 1 . 2]" 1
1046 1 30 LEU QD 1 43 ARG HG2 2.450 . 3.100 1.883 1.738 2.456 0.062 4 0 "[ . 1 . 2]" 1
1047 1 30 LEU QD 1 45 VAL QG 3.020 . 4.240 2.330 1.977 2.889 . 0 0 "[ . 1 . 2]" 1
1048 1 30 LEU QD 1 54 VAL HB 3.380 . 4.960 4.595 3.591 5.060 0.100 16 0 "[ . 1 . 2]" 1
1049 1 30 LEU QD 1 54 VAL QG 3.030 . 4.260 2.429 2.098 2.966 . 0 0 "[ . 1 . 2]" 1
1050 1 30 LEU QD 1 56 ILE HA 3.700 . 5.600 4.556 4.148 5.019 . 0 0 "[ . 1 . 2]" 1
1051 1 30 LEU QD 1 56 ILE MG 3.430 . 5.060 2.239 1.816 2.598 . 0 0 "[ . 1 . 2]" 1
1052 1 30 LEU QD 1 56 ILE HG13 3.900 . 6.000 5.342 4.593 5.831 . 0 0 "[ . 1 . 2]" 1
1053 1 30 LEU QD 1 56 ILE MD 2.910 . 4.020 3.516 2.729 3.943 . 0 0 "[ . 1 . 2]" 1
1054 1 30 LEU QD 1 66 ILE MD 3.290 . 4.780 2.499 2.052 3.088 . 0 0 "[ . 1 . 2]" 1
1055 1 30 LEU QD 1 83 LEU HA 3.690 . 5.580 4.375 4.051 4.709 . 0 0 "[ . 1 . 2]" 1
1056 1 30 LEU QD 1 83 LEU HB2 3.690 . 5.580 3.290 2.958 3.723 . 0 0 "[ . 1 . 2]" 1
1057 1 30 LEU QD 1 83 LEU HB3 3.610 . 5.420 2.361 2.047 2.810 . 0 0 "[ . 1 . 2]" 1
1058 1 30 LEU QD 1 83 LEU MD2 2.750 . 3.700 2.838 2.070 3.655 . 0 0 "[ . 1 . 2]" 1
1059 1 30 LEU QD 1 85 VAL HA 3.420 . 5.040 3.581 3.209 3.926 . 0 0 "[ . 1 . 2]" 1
1060 1 30 LEU QD 1 85 VAL MG2 3.090 . 4.380 2.642 1.794 3.285 0.006 9 0 "[ . 1 . 2]" 1
1061 1 31 PRO QB 1 32 LEU H 3.070 . 4.340 3.532 3.409 3.597 . 0 0 "[ . 1 . 2]" 1
1062 1 31 PRO QB 1 86 ARG HB2 3.390 . 4.980 3.856 3.429 4.249 . 0 0 "[ . 1 . 2]" 1
1063 1 31 PRO QB 1 88 LEU HB2 3.990 . 6.180 5.191 4.761 5.528 . 0 0 "[ . 1 . 2]" 1
1064 1 31 PRO QB 1 88 LEU MD1 2.650 . 3.500 2.027 1.755 2.388 0.045 8 0 "[ . 1 . 2]" 1
1065 1 31 PRO QB 1 88 LEU MD2 2.570 . 3.340 2.243 2.041 3.145 . 0 0 "[ . 1 . 2]" 1
1066 1 32 LEU MD2 1 36 GLU QG 3.750 . 5.700 5.054 4.543 5.342 . 0 0 "[ . 1 . 2]" 1
1067 1 33 THR H 1 36 GLU QG 3.040 . 4.280 3.195 2.276 3.761 . 0 0 "[ . 1 . 2]" 1
1068 1 34 LEU H 1 34 LEU QB 2.760 . 3.720 2.470 2.428 2.539 . 0 0 "[ . 1 . 2]" 1
1069 1 34 LEU QB 1 34 LEU MD1 2.730 . 3.660 2.140 2.120 2.159 . 0 0 "[ . 1 . 2]" 1
1070 1 34 LEU QB 1 35 GLU H 2.710 . 3.620 2.720 2.436 2.942 . 0 0 "[ . 1 . 2]" 1
1071 1 35 GLU H 1 35 GLU QB 2.620 . 3.440 2.573 2.359 2.816 . 0 0 "[ . 1 . 2]" 1
1072 1 35 GLU H 1 35 GLU QG 2.950 . 4.100 3.012 2.651 3.464 . 0 0 "[ . 1 . 2]" 1
1073 1 35 GLU HA 1 35 GLU QG 2.910 . 4.020 2.582 2.399 2.756 . 0 0 "[ . 1 . 2]" 1
1074 1 36 GLU H 1 36 GLU QG 2.730 . 3.660 2.311 2.047 2.513 . 0 0 "[ . 1 . 2]" 1
1075 1 36 GLU HA 1 36 GLU QG 2.870 . 3.940 2.936 2.769 3.060 . 0 0 "[ . 1 . 2]" 1
1076 1 39 HIS HA 1 58 PRO QB 3.630 . 5.460 4.268 3.499 5.356 . 0 0 "[ . 1 . 2]" 1
1077 1 40 GLY QA 1 56 ILE H 3.740 . 5.680 4.471 4.215 4.795 . 0 0 "[ . 1 . 2]" 1
1078 1 40 GLY QA 1 56 ILE HB 3.270 . 4.740 3.937 3.704 4.245 . 0 0 "[ . 1 . 2]" 1
1079 1 40 GLY QA 1 56 ILE MD 3.120 . 4.440 2.846 2.612 3.148 . 0 0 "[ . 1 . 2]" 1
1080 1 41 GLY HA2 1 55 ARG QD 3.910 . 6.020 4.863 3.868 5.830 . 0 0 "[ . 1 . 2]" 1
1081 1 42 GLU HA 1 54 VAL QG 3.390 . 4.980 4.437 4.197 4.733 . 0 0 "[ . 1 . 2]" 1
1082 1 42 GLU HB3 1 53 SER QB 3.630 . 5.460 2.243 1.699 3.888 0.101 5 0 "[ . 1 . 2]" 1
1083 1 42 GLU HG2 1 55 ARG QD 3.510 . 5.220 5.197 4.879 5.377 0.157 13 0 "[ . 1 . 2]" 1
1084 1 42 GLU HG3 1 53 SER QB 3.660 . 5.520 3.601 2.826 4.882 . 0 0 "[ . 1 . 2]" 1
1085 1 43 ARG H 1 53 SER QB 3.750 . 5.700 3.780 3.192 5.357 . 0 0 "[ . 1 . 2]" 1
1086 1 43 ARG H 1 54 VAL QG 3.320 . 4.840 3.323 3.027 3.897 . 0 0 "[ . 1 . 2]" 1
1087 1 43 ARG HA 1 44 VAL QG 3.550 . 5.300 3.621 3.254 3.935 . 0 0 "[ . 1 . 2]" 1
1088 1 43 ARG HA 1 54 VAL QG 4.520 . 7.240 4.628 4.367 5.232 . 0 0 "[ . 1 . 2]" 1
1089 1 43 ARG QB 1 44 VAL H 3.020 . 4.240 3.867 3.765 3.919 . 0 0 "[ . 1 . 2]" 1
1090 1 43 ARG QB 1 45 VAL H 4.320 . 6.840 5.359 4.952 5.985 . 0 0 "[ . 1 . 2]" 1
1091 1 43 ARG QB 1 54 VAL QG 3.020 . 4.240 2.479 1.968 3.077 . 0 0 "[ . 1 . 2]" 1
1092 1 43 ARG HG2 1 54 VAL QG 2.790 . 3.780 3.776 3.343 4.050 0.270 9 0 "[ . 1 . 2]" 1
1093 1 43 ARG HG3 1 45 VAL QG 3.190 . 4.580 2.024 1.820 2.416 . 0 0 "[ . 1 . 2]" 1
1094 1 43 ARG HG3 1 54 VAL QG 3.410 . 5.020 3.325 2.946 4.015 . 0 0 "[ . 1 . 2]" 1
1095 1 43 ARG HD2 1 44 VAL QG 3.460 . 5.120 4.369 3.295 5.249 0.129 16 0 "[ . 1 . 2]" 1
1096 1 43 ARG HD2 1 45 VAL QG 3.010 . 4.220 3.454 2.312 4.028 . 0 0 "[ . 1 . 2]" 1
1097 1 44 VAL H 1 44 VAL QG 2.520 . 3.240 2.208 1.986 2.374 . 0 0 "[ . 1 . 2]" 1
1098 1 44 VAL QG 1 45 VAL H 2.620 . 3.440 2.974 2.634 3.198 . 0 0 "[ . 1 . 2]" 1
1099 1 44 VAL QG 1 45 VAL QG 3.920 . 6.040 3.735 3.552 3.877 . 0 0 "[ . 1 . 2]" 1
1100 1 44 VAL QG 1 51 ARG HA 3.070 . 4.340 3.837 3.381 4.279 . 0 0 "[ . 1 . 2]" 1
1101 1 44 VAL QG 1 51 ARG QB 2.650 . 3.500 3.592 1.997 3.777 0.277 9 0 "[ . 1 . 2]" 1
1102 1 44 VAL QG 1 51 ARG QG 2.700 . 3.600 1.987 1.766 2.277 0.034 18 0 "[ . 1 . 2]" 1
1103 1 44 VAL QG 1 51 ARG QD 2.980 . 4.160 2.525 1.966 3.954 . 0 0 "[ . 1 . 2]" 1
1104 1 44 VAL QG 1 53 SER QB 2.960 . 4.120 2.876 2.026 3.972 . 0 0 "[ . 1 . 2]" 1
1105 1 45 VAL H 1 45 VAL QG 2.780 . 3.760 2.119 2.015 2.278 . 0 0 "[ . 1 . 2]" 1
1106 1 45 VAL H 1 51 ARG QB 3.900 . 6.000 5.834 4.018 6.142 0.142 6 0 "[ . 1 . 2]" 1
1107 1 45 VAL HA 1 45 VAL QG 2.590 . 3.380 2.375 2.316 2.428 . 0 0 "[ . 1 . 2]" 1
1108 1 45 VAL HB 1 47 VAL QG 3.800 . 5.800 5.245 4.587 5.865 0.065 6 0 "[ . 1 . 2]" 1
1109 1 45 VAL QG 1 46 GLU H 2.820 . 3.850 3.222 3.078 3.432 . 0 0 "[ . 1 . 2]" 1
1110 1 45 VAL QG 1 46 GLU HA 3.270 . 4.740 3.943 3.658 4.245 . 0 0 "[ . 1 . 2]" 1
1111 1 45 VAL QG 1 47 VAL H 3.200 . 4.600 4.367 3.904 4.786 0.186 11 0 "[ . 1 . 2]" 1
1112 1 45 VAL QG 1 47 VAL HA 3.470 . 5.140 5.034 4.763 5.256 0.116 20 0 "[ . 1 . 2]" 1
1113 1 45 VAL QG 1 47 VAL HB 2.840 . 3.880 3.870 3.459 4.299 0.419 6 0 "[ . 1 . 2]" 1
1114 1 45 VAL QG 1 47 VAL QG 3.190 . 4.580 3.574 2.742 4.185 . 0 0 "[ . 1 . 2]" 1
1115 1 45 VAL QG 1 54 VAL QG 2.910 . 4.020 2.065 1.895 2.447 . 0 0 "[ . 1 . 2]" 1
1116 1 45 VAL QG 1 81 LEU MD2 3.840 . 5.880 4.163 3.811 4.615 . 0 0 "[ . 1 . 2]" 1
1117 1 45 VAL QG 1 83 LEU MD1 3.330 . 4.860 2.878 2.547 3.417 . 0 0 "[ . 1 . 2]" 1
1118 1 45 VAL QG 1 83 LEU MD2 3.300 . 4.800 3.261 3.053 3.617 . 0 0 "[ . 1 . 2]" 1
1119 1 46 GLU H 1 46 GLU QB 2.550 . 3.300 2.460 2.222 3.029 . 0 0 "[ . 1 . 2]" 1
1120 1 46 GLU HA 1 46 GLU QG 2.950 . 4.100 2.592 2.388 3.407 . 0 0 "[ . 1 . 2]" 1
1121 1 46 GLU HA 1 47 VAL QG 3.410 . 5.020 3.533 3.315 3.844 . 0 0 "[ . 1 . 2]" 1
1122 1 46 GLU QG 1 47 VAL H 3.280 . 4.760 3.091 2.510 4.410 . 0 0 "[ . 1 . 2]" 1
1123 1 46 GLU QG 1 49 GLY H 3.000 . 4.200 2.801 1.974 4.277 0.077 11 0 "[ . 1 . 2]" 1
1124 1 46 GLU QG 1 51 ARG HA 3.720 . 5.640 3.816 2.632 5.786 0.146 13 0 "[ . 1 . 2]" 1
1125 1 47 VAL H 1 47 VAL QG 3.110 . 4.420 2.141 1.878 2.468 . 0 0 "[ . 1 . 2]" 1
1126 1 47 VAL QG 1 48 ALA H 3.400 . 5.000 3.191 2.918 3.340 . 0 0 "[ . 1 . 2]" 1
1127 1 47 VAL QG 1 48 ALA HA 3.780 . 5.760 4.230 4.014 4.401 . 0 0 "[ . 1 . 2]" 1
1128 1 47 VAL QG 1 48 ALA MB 2.780 . 3.760 2.630 2.365 3.000 . 0 0 "[ . 1 . 2]" 1
1129 1 47 VAL QG 1 50 ARG H 3.260 . 4.720 3.300 3.138 3.548 . 0 0 "[ . 1 . 2]" 1
1130 1 47 VAL QG 1 51 ARG HA 3.330 . 4.860 4.162 3.313 4.729 . 0 0 "[ . 1 . 2]" 1
1131 1 47 VAL QG 1 81 LEU MD1 3.140 . 4.480 4.114 3.070 4.411 . 0 0 "[ . 1 . 2]" 1
1132 1 47 VAL QG 1 81 LEU MD2 3.390 . 4.980 4.598 3.750 5.036 0.056 1 0 "[ . 1 . 2]" 1
1133 1 48 ALA MB 1 50 ARG QB 3.290 . 4.780 4.011 3.594 4.465 . 0 0 "[ . 1 . 2]" 1
1134 1 50 ARG H 1 50 ARG QB 2.600 . 3.400 2.502 2.275 2.740 . 0 0 "[ . 1 . 2]" 1
1135 1 50 ARG H 1 50 ARG QD 3.230 . 4.660 3.817 2.204 4.725 0.065 6 0 "[ . 1 . 2]" 1
1136 1 50 ARG HA 1 50 ARG QD 3.210 . 4.620 3.047 2.066 4.387 . 0 0 "[ . 1 . 2]" 1
1137 1 50 ARG HA 1 51 ARG QB 3.450 . 5.100 4.092 3.958 4.371 . 0 0 "[ . 1 . 2]" 1
1138 1 50 ARG QB 1 50 ARG QD 2.700 . 3.600 2.497 2.133 2.883 . 0 0 "[ . 1 . 2]" 1
1139 1 51 ARG H 1 51 ARG QG 3.300 . 4.800 4.031 3.474 4.141 . 0 0 "[ . 1 . 2]" 1
1140 1 51 ARG HA 1 51 ARG QG 2.920 . 4.040 2.595 2.386 3.518 . 0 0 "[ . 1 . 2]" 1
1141 1 51 ARG HA 1 52 VAL QG 3.220 . 4.640 3.659 3.338 3.941 . 0 0 "[ . 1 . 2]" 1
1142 1 51 ARG QB 1 51 ARG QG 2.180 . 2.560 2.078 2.006 2.111 . 0 0 "[ . 1 . 2]" 1
1143 1 51 ARG QB 1 51 ARG QD 2.640 . 3.480 2.452 2.163 2.842 . 0 0 "[ . 1 . 2]" 1
1144 1 51 ARG QB 1 52 VAL H 3.000 . 4.200 3.887 3.016 4.015 . 0 0 "[ . 1 . 2]" 1
1145 1 51 ARG QG 1 52 VAL H 3.090 . 4.380 3.355 2.806 3.649 . 0 0 "[ . 1 . 2]" 1
1146 1 51 ARG QD 1 52 VAL H 3.750 . 5.700 4.800 3.073 5.476 . 0 0 "[ . 1 . 2]" 1
1147 1 52 VAL H 1 52 VAL QG 2.710 . 3.620 2.472 1.981 3.062 . 0 0 "[ . 1 . 2]" 1
1148 1 52 VAL HA 1 53 SER QB 3.150 . 4.510 4.428 4.075 4.547 0.037 16 0 "[ . 1 . 2]" 1
1149 1 52 VAL QG 1 53 SER HA 3.130 . 4.460 3.843 3.635 4.108 . 0 0 "[ . 1 . 2]" 1
1150 1 53 SER H 1 53 SER QB 2.460 . 3.120 2.707 2.282 2.922 . 0 0 "[ . 1 . 2]" 1
1151 1 53 SER QB 1 54 VAL H 2.930 . 4.070 3.497 2.974 4.009 . 0 0 "[ . 1 . 2]" 1
1152 1 53 SER QB 1 54 VAL HA 3.380 . 4.960 4.635 4.369 4.809 . 0 0 "[ . 1 . 2]" 1
1153 1 54 VAL HA 1 54 VAL QG 2.390 . 2.980 2.343 2.200 2.394 . 0 0 "[ . 1 . 2]" 1
1154 1 54 VAL QG 1 55 ARG H 2.780 . 3.760 2.673 2.025 3.076 . 0 0 "[ . 1 . 2]" 1
1155 1 54 VAL QG 1 55 ARG HA 3.280 . 4.760 3.873 3.551 4.069 . 0 0 "[ . 1 . 2]" 1
1156 1 54 VAL QG 1 56 ILE MG 3.550 . 5.300 2.566 2.073 2.962 . 0 0 "[ . 1 . 2]" 1
1157 1 54 VAL QG 1 56 ILE HG12 3.560 . 5.320 4.889 4.558 5.224 . 0 0 "[ . 1 . 2]" 1
1158 1 54 VAL QG 1 56 ILE MD 3.130 . 4.460 4.363 3.898 4.605 0.145 4 0 "[ . 1 . 2]" 1
1159 1 54 VAL QG 1 66 ILE MG 3.030 . 4.260 2.889 2.404 3.439 . 0 0 "[ . 1 . 2]" 1
1160 1 54 VAL QG 1 66 ILE MD 3.010 . 4.220 3.242 2.789 3.771 . 0 0 "[ . 1 . 2]" 1
1161 1 54 VAL QG 1 81 LEU HG 3.800 . 5.800 4.328 4.006 4.621 . 0 0 "[ . 1 . 2]" 1
1162 1 54 VAL QG 1 81 LEU MD1 3.560 . 5.320 4.322 3.887 4.671 . 0 0 "[ . 1 . 2]" 1
1163 1 54 VAL QG 1 81 LEU MD2 2.750 . 3.700 2.816 2.368 3.324 . 0 0 "[ . 1 . 2]" 1
1164 1 54 VAL QG 1 83 LEU MD2 2.860 . 3.920 3.497 3.189 3.745 . 0 0 "[ . 1 . 2]" 1
1165 1 55 ARG H 1 55 ARG QD 3.840 . 5.880 4.660 4.457 4.909 . 0 0 "[ . 1 . 2]" 1
1166 1 55 ARG HA 1 55 ARG QD 3.180 . 4.560 4.018 3.896 4.144 . 0 0 "[ . 1 . 2]" 1
1167 1 55 ARG HB2 1 55 ARG QD 2.860 . 3.920 2.435 2.352 2.552 . 0 0 "[ . 1 . 2]" 1
1168 1 55 ARG QD 1 55 ARG HG3 2.350 . 2.900 2.301 2.188 2.392 . 0 0 "[ . 1 . 2]" 1
1169 1 55 ARG QD 1 56 ILE H 3.580 . 5.360 5.039 4.487 5.354 . 0 0 "[ . 1 . 2]" 1
1170 1 57 PRO QB 1 58 PRO QD 2.910 . 4.020 2.956 2.563 3.232 . 0 0 "[ . 1 . 2]" 1
1171 1 57 PRO QD 1 66 ILE MD 3.270 . 4.740 2.253 2.099 2.450 . 0 0 "[ . 1 . 2]" 1
1172 1 58 PRO QB 1 59 GLY H 3.160 . 4.520 3.378 3.066 3.600 . 0 0 "[ . 1 . 2]" 1
1173 1 58 PRO QB 1 60 VAL H 3.730 . 5.660 5.045 4.799 5.238 . 0 0 "[ . 1 . 2]" 1
1174 1 60 VAL HA 1 61 ARG QD 3.670 . 5.540 4.955 4.655 5.225 . 0 0 "[ . 1 . 2]" 1
1175 1 60 VAL MG2 1 66 ILE QG 3.330 . 4.860 3.130 2.846 3.614 . 0 0 "[ . 1 . 2]" 1
1176 1 61 ARG H 1 61 ARG QD 3.470 . 5.140 4.253 3.935 4.568 . 0 0 "[ . 1 . 2]" 1
1177 1 61 ARG HA 1 61 ARG QD 3.280 . 4.760 4.144 4.072 4.200 . 0 0 "[ . 1 . 2]" 1
1178 1 61 ARG HB3 1 61 ARG QD 2.710 . 3.620 2.892 2.504 3.152 . 0 0 "[ . 1 . 2]" 1
1179 1 61 ARG QD 1 62 GLU H 3.720 . 5.640 4.628 4.199 4.984 . 0 0 "[ . 1 . 2]" 1
1180 1 62 GLU H 1 62 GLU QG 3.150 . 4.500 3.961 3.933 4.000 . 0 0 "[ . 1 . 2]" 1
1181 1 62 GLU HA 1 84 VAL QG 4.070 . 6.340 5.241 4.783 5.603 . 0 0 "[ . 1 . 2]" 1
1182 1 62 GLU QG 1 63 GLY H 3.110 . 4.420 3.315 3.066 3.594 . 0 0 "[ . 1 . 2]" 1
1183 1 62 GLU QG 1 87 LEU H 3.340 . 4.880 4.055 3.887 4.211 . 0 0 "[ . 1 . 2]" 1
1184 1 62 GLU QG 1 87 LEU MD1 3.150 . 4.510 4.155 3.880 4.376 . 0 0 "[ . 1 . 2]" 1
1185 1 63 GLY H 1 84 VAL QG 2.970 . 4.140 3.578 3.111 3.951 . 0 0 "[ . 1 . 2]" 1
1186 1 63 GLY H 1 86 ARG QD 3.610 . 5.420 3.477 2.799 5.425 0.005 5 0 "[ . 1 . 2]" 1
1187 1 63 GLY HA2 1 84 VAL QG 2.730 . 3.660 2.664 2.275 3.653 . 0 0 "[ . 1 . 2]" 1
1188 1 64 SER H 1 84 VAL QG 3.640 . 5.480 4.217 3.867 4.784 . 0 0 "[ . 1 . 2]" 1
1189 1 64 SER HA 1 65 VAL QG 2.990 . 4.180 3.641 3.441 3.766 . 0 0 "[ . 1 . 2]" 1
1190 1 64 SER HB2 1 84 VAL QG 4.330 . 6.860 5.323 5.056 5.743 . 0 0 "[ . 1 . 2]" 1
1191 1 65 VAL H 1 65 VAL QG 2.530 . 3.260 2.024 1.954 2.477 . 0 0 "[ . 1 . 2]" 1
1192 1 65 VAL HA 1 65 VAL QG 2.420 . 3.040 2.344 2.183 2.386 . 0 0 "[ . 1 . 2]" 1
1193 1 65 VAL QG 1 66 ILE H 2.550 . 3.300 2.658 2.370 2.956 . 0 0 "[ . 1 . 2]" 1
1194 1 65 VAL QG 1 82 LEU HA 3.000 . 4.200 2.713 2.548 2.944 . 0 0 "[ . 1 . 2]" 1
1195 1 65 VAL QG 1 82 LEU HB3 2.850 . 3.900 2.214 1.997 2.531 . 0 0 "[ . 1 . 2]" 1
1196 1 65 VAL QG 1 82 LEU MD1 2.890 . 3.980 3.171 2.736 3.515 . 0 0 "[ . 1 . 2]" 1
1197 1 65 VAL QG 1 82 LEU MD2 2.690 . 3.580 2.139 2.012 2.362 . 0 0 "[ . 1 . 2]" 1
1198 1 65 VAL QG 1 83 LEU H 2.810 . 3.820 2.805 2.429 3.109 . 0 0 "[ . 1 . 2]" 1
1199 1 65 VAL QG 1 84 VAL HA 2.790 . 3.780 2.990 2.204 3.230 . 0 0 "[ . 1 . 2]" 1
1200 1 65 VAL QG 1 84 VAL QG 2.520 . 3.240 2.186 1.702 2.414 0.098 12 0 "[ . 1 . 2]" 1
1201 1 65 VAL QG 1 85 VAL H 3.550 . 5.300 4.379 3.546 4.596 . 0 0 "[ . 1 . 2]" 1
1202 1 66 ILE H 1 66 ILE QG 3.290 . 4.780 2.359 2.229 2.608 . 0 0 "[ . 1 . 2]" 1
1203 1 66 ILE H 1 84 VAL QG 3.860 . 5.920 4.242 3.976 4.433 . 0 0 "[ . 1 . 2]" 1
1204 1 66 ILE HA 1 66 ILE QG 2.820 . 3.850 2.559 2.469 2.629 . 0 0 "[ . 1 . 2]" 1
1205 1 66 ILE HA 1 67 ARG QB 3.640 . 5.480 4.260 4.108 4.421 . 0 0 "[ . 1 . 2]" 1
1206 1 66 ILE QG 1 66 ILE MG 2.490 . 3.180 2.359 2.335 2.378 . 0 0 "[ . 1 . 2]" 1
1207 1 66 ILE QG 1 67 ARG H 3.610 . 5.420 4.477 4.375 4.598 . 0 0 "[ . 1 . 2]" 1
1208 1 66 ILE QG 1 83 LEU H 4.500 . 7.200 4.416 4.147 4.800 . 0 0 "[ . 1 . 2]" 1
1209 1 66 ILE QG 1 83 LEU HB2 3.980 . 6.160 3.558 3.242 4.037 . 0 0 "[ . 1 . 2]" 1
1210 1 67 ARG H 1 67 ARG QB 2.570 . 3.340 2.377 2.293 2.444 . 0 0 "[ . 1 . 2]" 1
1211 1 67 ARG H 1 67 ARG QG 3.340 . 4.880 4.050 3.985 4.098 . 0 0 "[ . 1 . 2]" 1
1212 1 67 ARG H 1 67 ARG QD 3.720 . 5.640 4.828 4.591 5.037 . 0 0 "[ . 1 . 2]" 1
1213 1 67 ARG QB 1 67 ARG QD 2.610 . 3.420 2.337 2.182 2.454 . 0 0 "[ . 1 . 2]" 1
1214 1 67 ARG QB 1 82 LEU MD2 3.120 . 4.440 2.334 2.069 2.535 . 0 0 "[ . 1 . 2]" 1
1215 1 67 ARG QG 1 80 ASP QB 3.000 . 4.200 3.520 2.411 4.395 0.195 11 0 "[ . 1 . 2]" 1
1216 1 67 ARG QG 1 82 LEU MD2 2.960 . 4.120 2.277 1.926 2.855 . 0 0 "[ . 1 . 2]" 1
1217 1 67 ARG QD 1 82 LEU MD1 3.190 . 4.580 4.520 3.897 4.863 0.283 10 0 "[ . 1 . 2]" 1
1218 1 67 ARG QD 1 82 LEU MD2 2.790 . 3.780 2.842 2.277 3.404 . 0 0 "[ . 1 . 2]" 1
1219 1 68 VAL MG1 1 71 MET QB 2.610 . 3.420 2.180 1.874 2.515 . 0 0 "[ . 1 . 2]" 1
1220 1 68 VAL MG2 1 71 MET QB 3.410 . 5.020 3.800 3.497 4.029 . 0 0 "[ . 1 . 2]" 1
1221 1 69 PRO HA 1 70 GLY QA 3.200 . 4.600 3.950 3.901 3.998 . 0 0 "[ . 1 . 2]" 1
1222 1 69 PRO HA 1 80 ASP QB 3.500 . 5.200 3.576 2.176 4.328 . 0 0 "[ . 1 . 2]" 1
1223 1 69 PRO HB2 1 70 GLY QA 3.080 . 4.360 4.025 3.898 4.147 . 0 0 "[ . 1 . 2]" 1
1224 1 70 GLY H 1 78 PRO QB 3.590 . 5.380 4.328 3.753 5.280 . 0 0 "[ . 1 . 2]" 1
1225 1 70 GLY QA 1 71 MET HA 3.500 . 5.200 4.088 4.058 4.116 . 0 0 "[ . 1 . 2]" 1
1226 1 70 GLY QA 1 72 GLY H 3.400 . 5.000 3.648 3.446 4.015 . 0 0 "[ . 1 . 2]" 1
1227 1 70 GLY QA 1 78 PRO HA 3.810 . 5.820 3.952 3.274 4.474 . 0 0 "[ . 1 . 2]" 1
1228 1 71 MET H 1 71 MET QB 2.880 . 3.960 2.428 2.268 2.599 . 0 0 "[ . 1 . 2]" 1
1229 1 71 MET QB 1 71 MET ME 3.310 . 4.820 3.107 2.013 3.753 . 0 0 "[ . 1 . 2]" 1
1230 1 71 MET QB 1 81 LEU MD2 3.480 . 5.160 2.645 2.178 3.209 . 0 0 "[ . 1 . 2]" 1
1231 1 72 GLY QA 1 80 ASP HA 3.750 . 5.700 3.857 3.450 4.274 . 0 0 "[ . 1 . 2]" 1
1232 1 72 GLY QA 1 81 LEU MD1 3.110 . 4.420 2.535 1.755 3.128 0.045 14 0 "[ . 1 . 2]" 1
1233 1 72 GLY QA 1 81 LEU MD2 3.450 . 5.100 3.658 3.158 4.254 . 0 0 "[ . 1 . 2]" 1
1234 1 73 GLY H 1 79 GLY QA 2.740 . 3.680 2.265 1.797 3.265 0.003 20 0 "[ . 1 . 2]" 1
1235 1 74 GLN H 1 74 GLN QG 2.730 . 3.660 2.350 2.101 2.547 . 0 0 "[ . 1 . 2]" 1
1236 1 74 GLN HA 1 74 GLN QG 2.790 . 3.780 3.070 2.896 3.173 . 0 0 "[ . 1 . 2]" 1
1237 1 74 GLN HB2 1 74 GLN QG 2.340 . 2.880 2.180 2.167 2.187 . 0 0 "[ . 1 . 2]" 1
1238 1 74 GLN HB3 1 75 GLY QA 3.360 . 4.920 4.072 3.762 4.373 . 0 0 "[ . 1 . 2]" 1
1239 1 74 GLN QG 1 75 GLY H 3.470 . 5.140 4.555 4.246 4.910 . 0 0 "[ . 1 . 2]" 1
1240 1 78 PRO QB 1 79 GLY H 2.860 . 3.920 3.403 3.078 3.506 . 0 0 "[ . 1 . 2]" 1
1241 1 79 GLY QA 1 80 ASP H 2.540 . 3.280 2.241 2.182 2.290 . 0 0 "[ . 1 . 2]" 1
1242 1 79 GLY QA 1 80 ASP HA 3.880 . 5.960 3.995 3.952 4.035 . 0 0 "[ . 1 . 2]" 1
1243 1 80 ASP H 1 80 ASP QB 2.710 . 3.620 2.358 2.180 2.689 . 0 0 "[ . 1 . 2]" 1
1244 1 80 ASP QB 1 82 LEU MD2 3.340 . 4.880 3.923 2.774 4.535 . 0 0 "[ . 1 . 2]" 1
1245 1 82 LEU MD1 1 84 VAL QG 3.820 . 5.840 4.246 4.018 4.537 . 0 0 "[ . 1 . 2]" 1
1246 1 82 LEU MD2 1 84 VAL QG 3.800 . 5.800 4.346 4.076 4.587 . 0 0 "[ . 1 . 2]" 1
1247 1 83 LEU HA 1 84 VAL QG 3.030 . 4.260 3.543 3.436 3.662 . 0 0 "[ . 1 . 2]" 1
1248 1 83 LEU MD2 1 84 VAL QG 3.940 . 6.080 4.603 4.479 4.787 . 0 0 "[ . 1 . 2]" 1
1249 1 84 VAL H 1 84 VAL QG 2.530 . 3.260 2.140 2.049 2.204 . 0 0 "[ . 1 . 2]" 1
1250 1 84 VAL HA 1 84 VAL QG 2.550 . 3.300 2.194 2.176 2.208 . 0 0 "[ . 1 . 2]" 1
1251 1 84 VAL QG 1 85 VAL H 2.770 . 3.740 3.296 3.150 3.372 . 0 0 "[ . 1 . 2]" 1
1252 1 84 VAL QG 1 85 VAL MG2 3.620 . 5.440 4.440 4.364 4.506 . 0 0 "[ . 1 . 2]" 1
1253 1 84 VAL QG 1 86 ARG H 3.990 . 6.180 4.810 4.394 5.240 . 0 0 "[ . 1 . 2]" 1
1254 1 84 VAL QG 1 86 ARG HG3 3.640 . 5.480 4.583 4.296 4.919 . 0 0 "[ . 1 . 2]" 1
1255 1 86 ARG H 1 86 ARG QD 3.580 . 5.360 3.838 3.573 4.418 . 0 0 "[ . 1 . 2]" 1
1256 1 86 ARG QD 1 87 LEU H 3.120 . 4.440 4.001 3.754 4.560 0.120 5 0 "[ . 1 . 2]" 1
1257 1 6 PHE QD 1 28 ALA MB 3.650 . 5.500 5.624 5.319 5.771 0.271 20 0 "[ . 1 . 2]" 1
1258 1 6 PHE QB 1 28 ALA MB 3.650 . 5.500 4.616 4.323 4.902 . 0 0 "[ . 1 . 2]" 1
1259 1 6 PHE QD 1 26 LEU QB 3.650 . 5.500 4.632 4.009 5.033 . 0 0 "[ . 1 . 2]" 1
1260 1 6 PHE QB 1 47 VAL MG1 3.660 . 5.520 4.351 4.120 4.996 . 0 0 "[ . 1 . 2]" 1
1261 1 6 PHE HD1 1 47 VAL MG1 3.660 . 5.520 4.984 4.364 5.532 0.012 9 0 "[ . 1 . 2]" 1
1262 1 5 LEU QB 1 45 VAL H 3.650 . 5.500 5.265 4.969 5.606 0.106 13 0 "[ . 1 . 2]" 1
1263 1 5 LEU QB 1 45 VAL HB 3.650 . 5.500 2.742 2.324 3.216 . 0 0 "[ . 1 . 2]" 1
1264 1 5 LEU QB 1 45 VAL MG1 3.650 . 5.500 3.632 3.403 4.005 . 0 0 "[ . 1 . 2]" 1
1265 1 5 LEU QB 1 45 VAL MG2 3.650 . 5.500 2.198 1.878 2.488 . 0 0 "[ . 1 . 2]" 1
1266 1 5 LEU HG 1 45 VAL MG2 3.650 . 5.500 3.878 3.622 4.055 . 0 0 "[ . 1 . 2]" 1
1267 1 5 LEU MD1 1 45 VAL MG2 3.650 . 5.500 1.979 1.719 2.524 0.081 15 0 "[ . 1 . 2]" 1
1268 1 5 LEU MD1 1 30 LEU MD1 3.650 . 5.500 4.250 3.541 5.477 . 0 0 "[ . 1 . 2]" 1
1269 1 5 LEU MD1 1 30 LEU MD2 3.650 . 5.500 5.354 4.492 5.641 0.141 13 0 "[ . 1 . 2]" 1
1270 1 5 LEU MD1 1 54 VAL MG2 3.650 . 5.500 3.211 2.299 4.101 . 0 0 "[ . 1 . 2]" 1
1271 1 7 THR MG 1 25 ASP H 3.650 . 5.500 5.769 5.701 5.916 0.416 19 0 "[ . 1 . 2]" 1
1272 1 8 PRO HA 1 26 LEU HA 3.650 . 5.500 5.532 4.944 5.772 0.272 15 0 "[ . 1 . 2]" 1
1273 1 8 PRO QB 1 26 LEU MD1 3.650 . 5.500 5.600 5.456 5.718 0.218 12 0 "[ . 1 . 2]" 1
1274 1 9 VAL MG1 1 25 ASP QB 3.650 . 5.500 3.651 2.932 4.761 . 0 0 "[ . 1 . 2]" 1
1275 1 9 VAL MG1 1 26 LEU MD1 3.650 . 5.500 5.597 5.373 5.874 0.374 3 0 "[ . 1 . 2]" 1
1276 1 9 VAL MG1 1 27 ARG QD 3.650 . 5.500 5.141 4.560 5.547 0.047 8 0 "[ . 1 . 2]" 1
1277 1 4 LEU CD1 1 45 VAL CB 3.100 . 4.400 4.603 4.436 4.737 0.337 3 0 "[ . 1 . 2]" 1
1278 1 4 LEU CD1 1 45 VAL CG1 3.100 . 4.400 4.267 3.821 4.471 0.071 3 0 "[ . 1 . 2]" 1
1279 1 4 LEU CD1 1 30 LEU CD2 3.650 . 5.500 4.732 3.956 5.614 0.114 1 0 "[ . 1 . 2]" 1
1280 1 4 LEU CD1 1 83 LEU CD2 3.650 . 5.500 4.362 3.750 4.744 . 0 0 "[ . 1 . 2]" 1
1281 1 4 LEU CD2 1 31 PRO QD 3.100 . 4.400 2.904 2.736 3.181 . 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 50
_Distance_constraint_stats_list.Viol_count 193
_Distance_constraint_stats_list.Viol_total 149.704
_Distance_constraint_stats_list.Viol_max 0.152
_Distance_constraint_stats_list.Viol_rms 0.0205
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0075
_Distance_constraint_stats_list.Viol_average_violations_only 0.0388
_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 11 LYS 0.028 0.012 12 0 "[ . 1 . 2]"
1 24 ARG 0.934 0.110 5 0 "[ . 1 . 2]"
1 25 ASP 0.028 0.012 12 0 "[ . 1 . 2]"
1 26 LEU 0.634 0.089 16 0 "[ . 1 . 2]"
1 28 ALA 1.289 0.091 1 0 "[ . 1 . 2]"
1 30 LEU 0.058 0.016 14 0 "[ . 1 . 2]"
1 32 LEU 0.065 0.027 9 0 "[ . 1 . 2]"
1 33 THR 0.023 0.012 16 0 "[ . 1 . 2]"
1 34 LEU 0.519 0.065 9 0 "[ . 1 . 2]"
1 35 GLU 0.015 0.007 18 0 "[ . 1 . 2]"
1 36 GLU 0.376 0.054 20 0 "[ . 1 . 2]"
1 37 ALA 0.067 0.016 6 0 "[ . 1 . 2]"
1 38 PHE 0.519 0.065 9 0 "[ . 1 . 2]"
1 39 HIS 0.015 0.007 18 0 "[ . 1 . 2]"
1 40 GLY 0.376 0.054 20 0 "[ . 1 . 2]"
1 43 ARG 0.011 0.011 15 0 "[ . 1 . 2]"
1 45 VAL 0.522 0.100 2 0 "[ . 1 . 2]"
1 52 VAL 0.522 0.100 2 0 "[ . 1 . 2]"
1 54 VAL 0.011 0.011 15 0 "[ . 1 . 2]"
1 59 GLY 0.044 0.016 6 0 "[ . 1 . 2]"
1 63 GLY 0.372 0.133 20 0 "[ . 1 . 2]"
1 64 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 66 ILE 0.276 0.064 4 0 "[ . 1 . 2]"
1 68 VAL 1.861 0.152 11 0 "[ . 1 . 2]"
1 73 GLY 1.390 0.110 5 0 "[ . 1 . 2]"
1 79 GLY 0.455 0.076 2 0 "[ . 1 . 2]"
1 80 ASP 0.634 0.089 16 0 "[ . 1 . 2]"
1 81 LEU 1.861 0.152 11 0 "[ . 1 . 2]"
1 82 LEU 0.260 0.050 19 0 "[ . 1 . 2]"
1 83 LEU 0.276 0.064 4 0 "[ . 1 . 2]"
1 84 VAL 1.086 0.091 1 0 "[ . 1 . 2]"
1 85 VAL 0.372 0.133 20 0 "[ . 1 . 2]"
1 86 ARG 0.065 0.027 9 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 26 LEU H 1 80 ASP O 1.900 . 2.090 2.117 2.029 2.179 0.089 16 0 "[ . 1 . 2]" 2
2 1 28 ALA H 1 82 LEU O 1.900 . 2.090 2.088 1.991 2.140 0.050 19 0 "[ . 1 . 2]" 2
3 1 30 LEU H 1 84 VAL O 1.900 . 2.090 2.070 2.009 2.106 0.016 14 0 "[ . 1 . 2]" 2
4 1 32 LEU H 1 86 ARG O 1.900 . 2.090 2.032 1.952 2.117 0.027 9 0 "[ . 1 . 2]" 2
5 1 33 THR O 1 37 ALA H 1.900 . 2.090 2.031 1.944 2.102 0.012 16 0 "[ . 1 . 2]" 2
6 1 34 LEU O 1 38 PHE H 1.900 . 2.090 2.112 2.064 2.155 0.065 9 0 "[ . 1 . 2]" 2
7 1 35 GLU O 1 39 HIS H 1.900 . 2.090 2.042 1.975 2.097 0.007 18 0 "[ . 1 . 2]" 2
8 1 36 GLU O 1 40 GLY H 1.900 . 2.090 2.102 2.040 2.144 0.054 20 0 "[ . 1 . 2]" 2
9 1 43 ARG H 1 54 VAL O 1.900 . 2.090 2.000 1.916 2.101 0.011 15 0 "[ . 1 . 2]" 2
10 1 45 VAL H 1 52 VAL O 1.900 . 2.090 2.010 1.910 2.095 0.005 20 0 "[ . 1 . 2]" 2
11 1 45 VAL O 1 52 VAL H 1.900 . 2.090 2.079 1.969 2.190 0.100 2 0 "[ . 1 . 2]" 2
12 1 43 ARG O 1 54 VAL H 1.900 . 2.090 2.010 1.935 2.082 . 0 0 "[ . 1 . 2]" 2
13 1 37 ALA O 1 59 GLY H 1.900 . 2.090 2.051 1.964 2.106 0.016 6 0 "[ . 1 . 2]" 2
14 1 63 GLY H 1 85 VAL O 1.900 . 2.090 2.074 1.973 2.223 0.133 20 0 "[ . 1 . 2]" 2
15 1 66 ILE H 1 83 LEU O 1.900 . 2.090 1.967 1.905 2.037 . 0 0 "[ . 1 . 2]" 2
16 1 68 VAL H 1 81 LEU O 1.900 . 2.090 2.067 1.952 2.135 0.045 19 0 "[ . 1 . 2]" 2
17 1 24 ARG O 1 73 GLY H 1.900 . 2.090 2.133 2.020 2.200 0.110 5 0 "[ . 1 . 2]" 2
18 1 73 GLY O 1 79 GLY H 1.900 . 2.090 2.088 1.961 2.166 0.076 2 0 "[ . 1 . 2]" 2
19 1 68 VAL O 1 81 LEU H 1.900 . 2.090 2.171 2.131 2.242 0.152 11 0 "[ . 1 . 2]" 2
20 1 26 LEU O 1 82 LEU H 1.900 . 2.090 1.966 1.908 2.039 . 0 0 "[ . 1 . 2]" 2
21 1 66 ILE O 1 83 LEU H 1.900 . 2.090 2.085 2.007 2.154 0.064 4 0 "[ . 1 . 2]" 2
22 1 28 ALA O 1 84 VAL H 1.900 . 2.090 2.141 2.088 2.181 0.091 1 0 "[ . 1 . 2]" 2
23 1 64 SER O 1 85 VAL H 1.900 . 2.090 1.962 1.933 1.994 . 0 0 "[ . 1 . 2]" 2
24 1 30 LEU O 1 86 ARG H 1.900 . 2.090 1.952 1.900 2.042 . 0 0 "[ . 1 . 2]" 2
25 1 26 LEU N 1 80 ASP O 2.900 2.700 3.190 2.974 2.901 3.052 . 0 0 "[ . 1 . 2]" 2
26 1 28 ALA N 1 82 LEU O 2.900 2.700 3.190 2.984 2.895 3.063 . 0 0 "[ . 1 . 2]" 2
27 1 30 LEU N 1 84 VAL O 2.900 2.700 3.190 2.979 2.903 3.042 . 0 0 "[ . 1 . 2]" 2
28 1 32 LEU N 1 86 ARG O 2.900 2.700 3.190 2.982 2.885 3.062 . 0 0 "[ . 1 . 2]" 2
29 1 33 THR O 1 37 ALA N 2.900 2.700 3.190 2.903 2.768 3.009 . 0 0 "[ . 1 . 2]" 2
30 1 34 LEU O 1 38 PHE N 2.900 2.700 3.190 3.014 2.903 3.074 . 0 0 "[ . 1 . 2]" 2
31 1 35 GLU O 1 39 HIS N 2.900 2.700 3.190 2.944 2.816 3.057 . 0 0 "[ . 1 . 2]" 2
32 1 36 GLU O 1 40 GLY N 2.900 2.700 3.190 2.973 2.898 3.091 . 0 0 "[ . 1 . 2]" 2
33 1 43 ARG N 1 54 VAL O 2.900 2.700 3.190 2.861 2.788 2.913 . 0 0 "[ . 1 . 2]" 2
34 1 45 VAL N 1 52 VAL O 2.900 2.700 3.190 2.963 2.865 3.051 . 0 0 "[ . 1 . 2]" 2
35 1 45 VAL O 1 52 VAL N 2.900 2.700 3.190 2.998 2.822 3.162 . 0 0 "[ . 1 . 2]" 2
36 1 43 ARG O 1 54 VAL N 2.900 2.700 3.190 2.915 2.804 3.014 . 0 0 "[ . 1 . 2]" 2
37 1 37 ALA O 1 59 GLY N 2.900 2.700 3.190 2.835 2.750 2.897 . 0 0 "[ . 1 . 2]" 2
38 1 63 GLY N 1 85 VAL O 2.900 2.700 3.190 2.977 2.808 3.208 0.018 20 0 "[ . 1 . 2]" 2
39 1 66 ILE N 1 83 LEU O 2.900 2.700 3.190 2.889 2.855 2.927 . 0 0 "[ . 1 . 2]" 2
40 1 68 VAL N 1 81 LEU O 2.900 2.700 3.190 2.926 2.883 2.982 . 0 0 "[ . 1 . 2]" 2
41 1 24 ARG O 1 73 GLY N 2.900 2.700 3.190 2.849 2.735 3.005 . 0 0 "[ . 1 . 2]" 2
42 1 73 GLY O 1 79 GLY N 2.900 2.700 3.190 2.949 2.850 3.105 . 0 0 "[ . 1 . 2]" 2
43 1 68 VAL O 1 81 LEU N 2.900 2.700 3.190 2.998 2.908 3.084 . 0 0 "[ . 1 . 2]" 2
44 1 26 LEU O 1 82 LEU N 2.900 2.700 3.190 2.915 2.810 3.010 . 0 0 "[ . 1 . 2]" 2
45 1 66 ILE O 1 83 LEU N 2.900 2.700 3.190 3.016 2.910 3.074 . 0 0 "[ . 1 . 2]" 2
46 1 28 ALA O 1 84 VAL N 2.900 2.700 3.190 3.058 2.984 3.107 . 0 0 "[ . 1 . 2]" 2
47 1 64 SER O 1 85 VAL N 2.900 2.700 3.190 2.870 2.800 2.948 . 0 0 "[ . 1 . 2]" 2
48 1 30 LEU O 1 86 ARG N 2.900 2.700 3.190 2.887 2.797 3.017 . 0 0 "[ . 1 . 2]" 2
49 1 11 LYS NZ 1 25 ASP OD1 2.900 2.700 3.190 2.937 2.688 3.153 0.012 12 0 "[ . 1 . 2]" 2
50 1 11 LYS QZ 1 25 ASP OD1 1.900 . 2.090 2.020 1.884 2.100 0.010 19 0 "[ . 1 . 2]" 2
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