NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
352203 |
2k86   |
15939 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2k86
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 1924
_Distance_constraint_stats_list.Viol_count 3830
_Distance_constraint_stats_list.Viol_total 3606.338
_Distance_constraint_stats_list.Viol_max 0.388
_Distance_constraint_stats_list.Viol_rms 0.0200
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0047
_Distance_constraint_stats_list.Viol_average_violations_only 0.0471
_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 4 SER 0.320 0.100 17 0 "[ . 1 . 2]"
1 5 ARG 1.196 0.106 11 0 "[ . 1 . 2]"
1 6 ARG 2.867 0.156 11 0 "[ . 1 . 2]"
1 7 ASN 2.877 0.254 10 0 "[ . 1 . 2]"
1 8 ALA 4.137 0.254 10 0 "[ . 1 . 2]"
1 9 TRP 2.311 0.104 4 0 "[ . 1 . 2]"
1 10 GLY 2.111 0.149 15 0 "[ . 1 . 2]"
1 11 ASN 2.792 0.100 10 0 "[ . 1 . 2]"
1 12 LEU 3.283 0.115 10 0 "[ . 1 . 2]"
1 13 SER 2.050 0.095 18 0 "[ . 1 . 2]"
1 14 TYR 1.589 0.106 6 0 "[ . 1 . 2]"
1 15 ALA 2.129 0.099 20 0 "[ . 1 . 2]"
1 16 ASP 0.533 0.115 10 0 "[ . 1 . 2]"
1 17 LEU 6.775 0.171 5 0 "[ . 1 . 2]"
1 18 ILE 9.001 0.167 19 0 "[ . 1 . 2]"
1 19 THR 13.570 0.195 2 0 "[ . 1 . 2]"
1 20 ARG 6.469 0.191 11 0 "[ . 1 . 2]"
1 21 ALA 2.523 0.106 2 0 "[ . 1 . 2]"
1 22 ILE 5.957 0.107 7 0 "[ . 1 . 2]"
1 23 GLU 3.719 0.117 9 0 "[ . 1 . 2]"
1 24 SER 0.943 0.071 18 0 "[ . 1 . 2]"
1 25 SER 4.726 0.147 16 0 "[ . 1 . 2]"
1 26 PRO 3.853 0.158 13 0 "[ . 1 . 2]"
1 27 ASP 2.846 0.114 10 0 "[ . 1 . 2]"
1 28 LYS 7.687 0.147 16 0 "[ . 1 . 2]"
1 29 ARG 4.778 0.127 11 0 "[ . 1 . 2]"
1 30 LEU 11.852 0.176 4 0 "[ . 1 . 2]"
1 31 THR 3.667 0.111 13 0 "[ . 1 . 2]"
1 32 LEU 5.613 0.250 8 0 "[ . 1 . 2]"
1 33 SER 1.533 0.097 17 0 "[ . 1 . 2]"
1 34 GLN 4.769 0.098 4 0 "[ . 1 . 2]"
1 35 ILE 3.400 0.130 16 0 "[ . 1 . 2]"
1 36 TYR 1.724 0.088 15 0 "[ . 1 . 2]"
1 37 GLU 1.308 0.067 14 0 "[ . 1 . 2]"
1 38 TRP 1.547 0.053 10 0 "[ . 1 . 2]"
1 39 MET 7.632 0.167 19 0 "[ . 1 . 2]"
1 40 VAL 5.340 0.104 19 0 "[ . 1 . 2]"
1 41 ARG 4.090 0.106 2 0 "[ . 1 . 2]"
1 42 CYS 0.973 0.061 1 0 "[ . 1 . 2]"
1 43 VAL 4.533 0.118 17 0 "[ . 1 . 2]"
1 44 PRO 6.691 0.171 5 0 "[ . 1 . 2]"
1 45 TYR 1.318 0.096 1 0 "[ . 1 . 2]"
1 46 PHE 1.479 0.089 4 0 "[ . 1 . 2]"
1 47 LYS 5.364 0.124 4 0 "[ . 1 . 2]"
1 48 ASP 0.337 0.096 11 0 "[ . 1 . 2]"
1 49 LYS 2.205 0.114 11 0 "[ . 1 . 2]"
1 50 GLY 1.068 0.099 5 0 "[ . 1 . 2]"
1 51 ASP 0.422 0.112 14 0 "[ . 1 . 2]"
1 52 SER 1.021 0.112 14 0 "[ . 1 . 2]"
1 53 ASN 1.455 0.096 15 0 "[ . 1 . 2]"
1 54 SER 4.551 0.184 19 0 "[ . 1 . 2]"
1 55 SER 0.083 0.027 12 0 "[ . 1 . 2]"
1 56 ALA 0.476 0.088 17 0 "[ . 1 . 2]"
1 57 GLY 7.321 0.185 1 0 "[ . 1 . 2]"
1 58 TRP 1.071 0.098 8 0 "[ . 1 . 2]"
1 59 LYS 6.306 0.250 8 0 "[ . 1 . 2]"
1 60 ASN 10.224 0.214 1 0 "[ . 1 . 2]"
1 61 SER 2.783 0.247 10 0 "[ . 1 . 2]"
1 62 ILE 6.237 0.133 14 0 "[ . 1 . 2]"
1 63 ARG 5.221 0.169 18 0 "[ . 1 . 2]"
1 64 HIS 0.813 0.086 20 0 "[ . 1 . 2]"
1 65 ASN 3.247 0.134 7 0 "[ . 1 . 2]"
1 66 LEU 7.605 0.138 19 0 "[ . 1 . 2]"
1 67 SER 0.077 0.035 3 0 "[ . 1 . 2]"
1 68 LEU 1.353 0.104 9 0 "[ . 1 . 2]"
1 69 HIS 0.392 0.101 10 0 "[ . 1 . 2]"
1 70 SER 0.053 0.042 16 0 "[ . 1 . 2]"
1 71 ARG 1.883 0.135 11 0 "[ . 1 . 2]"
1 72 PHE 6.235 0.179 4 0 "[ . 1 . 2]"
1 73 MET 5.347 0.131 7 0 "[ . 1 . 2]"
1 74 ARG 10.317 0.388 3 0 "[ . 1 . 2]"
1 75 VAL 11.932 0.388 3 0 "[ . 1 . 2]"
1 76 GLN 3.860 0.142 20 0 "[ . 1 . 2]"
1 77 ASN 1.999 0.157 2 0 "[ . 1 . 2]"
1 78 GLU 0.813 0.113 12 0 "[ . 1 . 2]"
1 79 GLY 1.203 0.080 8 0 "[ . 1 . 2]"
1 80 THR 0.253 0.172 8 0 "[ . 1 . 2]"
1 81 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 82 LYS 0.080 0.068 20 0 "[ . 1 . 2]"
1 83 SER 0.263 0.096 13 0 "[ . 1 . 2]"
1 84 SER 1.147 0.067 8 0 "[ . 1 . 2]"
1 85 TRP 4.776 0.157 2 0 "[ . 1 . 2]"
1 86 TRP 3.498 0.176 4 0 "[ . 1 . 2]"
1 87 ILE 13.308 0.242 15 0 "[ . 1 . 2]"
1 88 ILE 17.490 0.195 2 0 "[ . 1 . 2]"
1 89 ASN 4.168 0.135 11 0 "[ . 1 . 2]"
1 90 PRO 3.235 0.157 7 0 "[ . 1 . 2]"
1 91 ASP 1.134 0.157 7 0 "[ . 1 . 2]"
1 92 GLY 0.013 0.013 4 0 "[ . 1 . 2]"
1 93 GLY 0.246 0.064 5 0 "[ . 1 . 2]"
1 94 LYS 2.655 0.143 12 0 "[ . 1 . 2]"
1 96 GLY 0.425 0.104 19 0 "[ . 1 . 2]"
1 97 LYS 0.326 0.145 18 0 "[ . 1 . 2]"
1 98 ALA 0.554 0.105 16 0 "[ . 1 . 2]"
1 99 PRO 0.172 0.050 7 0 "[ . 1 . 2]"
1 100 ARG 0.206 0.079 1 0 "[ . 1 . 2]"
1 101 ARG 0.387 0.147 7 0 "[ . 1 . 2]"
1 102 ARG 0.596 0.147 7 0 "[ . 1 . 2]"
1 103 ALA 0.226 0.065 17 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 71 ARG H 1 72 PHE H 2.630 . 2.630 2.488 2.234 2.638 0.008 8 0 "[ . 1 . 2]" 1
2 1 57 GLY H 1 60 ASN QB 4.560 . 4.560 4.156 3.880 4.566 0.006 15 0 "[ . 1 . 2]" 1
3 1 56 ALA MB 1 57 GLY H 3.960 . 3.960 3.586 3.547 3.623 . 0 0 "[ . 1 . 2]" 1
4 1 49 LYS H 1 50 GLY H 3.300 . 3.300 2.507 2.412 2.577 . 0 0 "[ . 1 . 2]" 1
5 1 49 LYS HA 1 50 GLY H 3.410 . 3.410 3.358 3.251 3.440 0.030 19 0 "[ . 1 . 2]" 1
6 1 50 GLY H 1 50 GLY HA3 2.850 . 2.850 2.261 2.223 2.320 . 0 0 "[ . 1 . 2]" 1
7 1 49 LYS HD3 1 50 GLY H 4.960 . 4.960 4.669 4.583 4.815 . 0 0 "[ . 1 . 2]" 1
8 1 49 LYS HG2 1 50 GLY H 4.790 . 4.790 4.297 4.103 4.455 . 0 0 "[ . 1 . 2]" 1
9 1 40 VAL MG1 1 50 GLY H 4.480 . 4.480 4.055 3.597 4.327 . 0 0 "[ . 1 . 2]" 1
10 1 78 GLU H 1 79 GLY H 4.110 . 4.110 2.625 2.202 3.340 . 0 0 "[ . 1 . 2]" 1
11 1 77 ASN HD21 1 79 GLY H 5.500 . 5.500 5.233 4.334 5.572 0.072 1 0 "[ . 1 . 2]" 1
12 1 77 ASN HA 1 79 GLY H 4.420 . 4.420 4.012 3.307 4.461 0.041 2 0 "[ . 1 . 2]" 1
13 1 79 GLY H 1 79 GLY QA 2.670 . 2.670 2.369 2.255 2.497 . 0 0 "[ . 1 . 2]" 1
14 1 78 GLU QG 1 79 GLY H 4.530 . 4.530 4.100 2.379 4.592 0.062 9 0 "[ . 1 . 2]" 1
15 1 78 GLU HB2 1 79 GLY H 4.380 . 4.380 3.425 2.140 4.391 0.011 17 0 "[ . 1 . 2]" 1
16 1 78 GLU HB3 1 79 GLY H 4.380 . 4.380 3.626 2.399 4.413 0.033 4 0 "[ . 1 . 2]" 1
17 1 92 GLY H 1 93 GLY H 3.670 . 3.670 2.661 1.789 3.463 . 0 0 "[ . 1 . 2]" 1
18 1 92 GLY QA 1 93 GLY H 3.070 . 3.070 2.448 2.175 2.786 . 0 0 "[ . 1 . 2]" 1
19 1 90 PRO HA 1 92 GLY H 5.370 . 5.370 5.014 4.343 5.383 0.013 4 0 "[ . 1 . 2]" 1
20 1 92 GLY H 1 92 GLY QA 2.740 . 2.740 2.432 2.211 2.492 . 0 0 "[ . 1 . 2]" 1
21 1 90 PRO QB 1 92 GLY H 4.680 . 4.680 3.797 3.207 4.177 . 0 0 "[ . 1 . 2]" 1
22 1 31 THR H 1 34 GLN HE22 4.860 . 4.860 4.179 4.094 4.301 . 0 0 "[ . 1 . 2]" 1
23 1 30 LEU HA 1 31 THR H 3.250 . 3.250 2.260 2.221 2.304 . 0 0 "[ . 1 . 2]" 1
24 1 31 THR H 1 85 TRP HA 5.240 . 5.240 3.768 3.536 3.970 . 0 0 "[ . 1 . 2]" 1
25 1 31 THR H 1 34 GLN QG 3.440 . 3.440 1.905 1.726 2.056 . 0 0 "[ . 1 . 2]" 1
26 1 30 LEU HB2 1 31 THR H 4.090 . 4.090 3.751 3.613 3.880 . 0 0 "[ . 1 . 2]" 1
27 1 31 THR H 1 35 ILE MD 5.400 . 5.400 4.849 4.708 4.984 . 0 0 "[ . 1 . 2]" 1
28 1 31 THR H 1 31 THR MG 3.290 . 3.290 1.922 1.841 2.022 . 0 0 "[ . 1 . 2]" 1
29 1 74 ARG HA 1 87 ILE H . . 3.000 3.083 3.020 3.133 0.133 20 0 "[ . 1 . 2]" 1
30 1 31 THR H 1 34 GLN QB . . 4.000 3.742 3.450 3.961 . 0 0 "[ . 1 . 2]" 1
31 1 30 LEU HB3 1 31 THR H 3.830 . 3.830 2.774 2.603 2.939 . 0 0 "[ . 1 . 2]" 1
32 1 73 MET QG 1 87 ILE H 4.950 . 4.950 3.927 3.745 4.110 . 0 0 "[ . 1 . 2]" 1
33 1 87 ILE H 1 87 ILE MG 3.600 . 3.600 2.437 2.328 2.505 . 0 0 "[ . 1 . 2]" 1
34 1 80 THR HB 1 81 GLY H 4.590 . 4.590 3.778 2.531 4.572 . 0 0 "[ . 1 . 2]" 1
35 1 22 ILE H 1 24 SER H 4.340 . 4.340 4.009 3.918 4.065 . 0 0 "[ . 1 . 2]" 1
36 1 24 SER H 1 24 SER QB 2.780 . 2.780 2.367 2.295 2.647 . 0 0 "[ . 1 . 2]" 1
37 1 22 ILE HA 1 24 SER H 4.330 . 4.330 3.995 3.879 4.179 . 0 0 "[ . 1 . 2]" 1
38 1 21 ALA HA 1 24 SER H 3.540 . 3.540 3.550 3.477 3.575 0.035 8 0 "[ . 1 . 2]" 1
39 1 22 ILE HB 1 24 SER H 5.120 . 5.120 4.803 4.680 4.920 . 0 0 "[ . 1 . 2]" 1
40 1 22 ILE MG 1 24 SER H 5.210 . 5.210 4.673 4.564 4.803 . 0 0 "[ . 1 . 2]" 1
41 1 21 ALA MB 1 24 SER H 4.610 . 4.610 4.446 4.364 4.527 . 0 0 "[ . 1 . 2]" 1
42 1 45 TYR H 1 46 PHE H 3.520 . 3.520 2.765 2.607 2.986 . 0 0 "[ . 1 . 2]" 1
43 1 45 TYR HB2 1 46 PHE H 3.750 . 3.750 3.726 3.587 3.806 0.056 17 0 "[ . 1 . 2]" 1
44 1 46 PHE H 1 46 PHE HB2 3.020 . 3.020 2.234 2.137 2.301 . 0 0 "[ . 1 . 2]" 1
45 1 45 TYR HB3 1 46 PHE H 3.600 . 3.600 2.410 2.204 2.602 . 0 0 "[ . 1 . 2]" 1
46 1 46 PHE H 1 49 LYS HG2 4.560 . 4.560 4.389 4.179 4.578 0.018 11 0 "[ . 1 . 2]" 1
47 1 43 VAL MG2 1 46 PHE H 3.370 . 3.370 2.020 1.881 2.125 . 0 0 "[ . 1 . 2]" 1
48 1 39 MET H 1 40 VAL H 3.250 . 3.250 2.772 2.724 2.824 . 0 0 "[ . 1 . 2]" 1
49 1 37 GLU HA 1 40 VAL H 3.930 . 3.930 3.326 3.101 3.480 . 0 0 "[ . 1 . 2]" 1
50 1 39 MET QB 1 40 VAL H 3.560 . 3.560 2.753 2.287 3.402 . 0 0 "[ . 1 . 2]" 1
51 1 40 VAL H 1 40 VAL HB 2.910 . 2.910 2.667 2.610 2.721 . 0 0 "[ . 1 . 2]" 1
52 1 40 VAL H 1 41 ARG QB 5.110 . 5.110 4.922 4.801 5.035 . 0 0 "[ . 1 . 2]" 1
53 1 40 VAL H 1 41 ARG QG 4.690 . 4.690 4.209 4.094 4.284 . 0 0 "[ . 1 . 2]" 1
54 1 40 VAL H 1 40 VAL MG2 2.830 . 2.830 1.965 1.879 2.031 . 0 0 "[ . 1 . 2]" 1
55 1 35 ILE MG 1 40 VAL H 5.500 . 5.500 5.465 5.318 5.518 0.018 4 0 "[ . 1 . 2]" 1
56 1 28 LYS HA 1 29 ARG H 3.270 . 3.270 3.146 3.063 3.217 . 0 0 "[ . 1 . 2]" 1
57 1 29 ARG H 1 29 ARG HB3 3.870 . 3.870 3.340 3.228 3.447 . 0 0 "[ . 1 . 2]" 1
58 1 29 ARG H 1 30 LEU MD1 4.510 . 4.510 3.324 3.189 3.459 . 0 0 "[ . 1 . 2]" 1
59 1 66 LEU H 1 67 SER H 3.850 . 3.850 2.612 2.437 2.803 . 0 0 "[ . 1 . 2]" 1
60 1 67 SER H 1 67 SER QB 3.380 . 3.380 2.525 2.260 3.131 . 0 0 "[ . 1 . 2]" 1
61 1 66 LEU QB 1 67 SER H 4.190 . 4.190 3.076 2.555 3.440 . 0 0 "[ . 1 . 2]" 1
62 1 66 LEU HG 1 67 SER H 5.500 . 5.500 5.201 5.002 5.377 . 0 0 "[ . 1 . 2]" 1
63 1 40 VAL H 1 42 CYS H 4.840 . 4.840 4.500 4.333 4.654 . 0 0 "[ . 1 . 2]" 1
64 1 42 CYS H 1 42 CYS HB2 3.370 . 3.370 3.052 2.953 3.158 . 0 0 "[ . 1 . 2]" 1
65 1 41 ARG QB 1 42 CYS H 3.180 . 3.180 2.596 2.363 2.812 . 0 0 "[ . 1 . 2]" 1
66 1 41 ARG QG 1 42 CYS H 4.060 . 4.060 4.011 3.888 4.085 0.025 2 0 "[ . 1 . 2]" 1
67 1 42 CYS H 1 42 CYS HB3 3.370 . 3.370 2.666 2.509 2.756 . 0 0 "[ . 1 . 2]" 1
68 1 42 CYS H 1 43 VAL MG1 3.840 . 3.840 3.444 3.298 3.610 . 0 0 "[ . 1 . 2]" 1
69 1 79 GLY H 1 80 THR H 4.050 . 4.050 2.935 1.954 4.051 0.001 20 0 "[ . 1 . 2]" 1
70 1 80 THR H 1 80 THR HB 3.780 . 3.780 3.252 2.506 3.753 . 0 0 "[ . 1 . 2]" 1
71 1 79 GLY QA 1 80 THR H 3.230 . 3.230 2.404 2.082 2.826 . 0 0 "[ . 1 . 2]" 1
72 1 80 THR H 1 80 THR MG 3.840 . 3.840 2.582 1.933 3.487 . 0 0 "[ . 1 . 2]" 1
73 1 43 VAL HA 1 45 TYR H 5.360 . 5.360 4.142 3.801 4.608 . 0 0 "[ . 1 . 2]" 1
74 1 45 TYR H 1 45 TYR HB2 3.660 . 3.660 2.352 2.194 2.465 . 0 0 "[ . 1 . 2]" 1
75 1 45 TYR H 1 45 TYR HB3 3.750 . 3.750 2.514 2.379 2.630 . 0 0 "[ . 1 . 2]" 1
76 1 44 PRO HB3 1 45 TYR H 3.930 . 3.930 3.872 3.661 3.970 0.040 5 0 "[ . 1 . 2]" 1
77 1 43 VAL MG2 1 45 TYR H 3.840 . 3.840 2.206 1.989 2.566 . 0 0 "[ . 1 . 2]" 1
78 1 64 HIS H 1 65 ASN H 3.390 . 3.390 2.405 2.313 2.474 . 0 0 "[ . 1 . 2]" 1
79 1 65 ASN H 1 67 SER H 4.490 . 4.490 3.947 3.767 4.181 . 0 0 "[ . 1 . 2]" 1
80 1 65 ASN H 1 65 ASN HD22 4.440 . 4.440 3.491 3.395 3.568 . 0 0 "[ . 1 . 2]" 1
81 1 63 ARG HA 1 65 ASN H 4.420 . 4.420 4.107 3.875 4.287 . 0 0 "[ . 1 . 2]" 1
82 1 62 ILE HA 1 65 ASN H 3.740 . 3.740 3.272 3.114 3.450 . 0 0 "[ . 1 . 2]" 1
83 1 14 TYR HB2 1 65 ASN H 5.500 . 5.500 5.394 5.185 5.528 0.028 17 0 "[ . 1 . 2]" 1
84 1 65 ASN H 1 65 ASN HB2 3.730 . 3.730 2.512 2.423 2.598 . 0 0 "[ . 1 . 2]" 1
85 1 65 ASN H 1 65 ASN HB3 3.730 . 3.730 3.659 3.614 3.728 . 0 0 "[ . 1 . 2]" 1
86 1 65 ASN H 1 66 LEU QB 4.700 . 4.700 4.509 4.335 4.705 0.005 13 0 "[ . 1 . 2]" 1
87 1 62 ILE MG 1 65 ASN H 4.780 . 4.780 4.352 4.203 4.484 . 0 0 "[ . 1 . 2]" 1
88 1 18 ILE MD 1 65 ASN H 4.340 . 4.340 4.159 4.020 4.295 . 0 0 "[ . 1 . 2]" 1
89 1 73 MET H 1 87 ILE H 3.830 . 3.830 3.258 3.145 3.382 . 0 0 "[ . 1 . 2]" 1
90 1 73 MET H 1 89 ASN H 4.560 . 4.560 3.428 3.068 3.694 . 0 0 "[ . 1 . 2]" 1
91 1 73 MET H 1 74 ARG H 4.700 . 4.700 4.228 4.125 4.282 . 0 0 "[ . 1 . 2]" 1
92 1 72 PHE HA 1 73 MET H 3.120 . 3.120 2.319 2.227 2.401 . 0 0 "[ . 1 . 2]" 1
93 1 73 MET H 1 86 TRP HA 5.450 . 5.450 5.160 5.030 5.344 . 0 0 "[ . 1 . 2]" 1
94 1 73 MET H 1 88 ILE HA 4.250 . 4.250 3.335 3.125 3.525 . 0 0 "[ . 1 . 2]" 1
95 1 72 PHE HB2 1 73 MET H 4.080 . 4.080 3.874 3.712 4.084 0.004 12 0 "[ . 1 . 2]" 1
96 1 73 MET H 1 73 MET QG 3.790 . 3.790 2.480 2.330 2.623 . 0 0 "[ . 1 . 2]" 1
97 1 73 MET H 1 89 ASN HB3 5.500 . 5.500 4.648 4.319 5.025 . 0 0 "[ . 1 . 2]" 1
98 1 73 MET H 1 73 MET QB 3.440 . 3.440 3.215 3.121 3.289 . 0 0 "[ . 1 . 2]" 1
99 1 73 MET H 1 87 ILE MG . . 4.300 4.370 4.309 4.411 0.111 9 0 "[ . 1 . 2]" 1
100 1 73 MET H 1 87 ILE MD 4.160 . 4.160 3.943 3.774 4.166 0.006 16 0 "[ . 1 . 2]" 1
101 1 31 THR H 1 86 TRP H 4.850 . 4.850 4.361 4.169 4.490 . 0 0 "[ . 1 . 2]" 1
102 1 86 TRP H 1 87 ILE H 5.300 . 5.300 4.417 4.373 4.479 . 0 0 "[ . 1 . 2]" 1
103 1 85 TRP H 1 86 TRP H 4.710 . 4.710 4.379 4.277 4.501 . 0 0 "[ . 1 . 2]" 1
104 1 31 THR HA 1 86 TRP H 4.000 . 4.000 3.403 3.233 3.564 . 0 0 "[ . 1 . 2]" 1
105 1 85 TRP HA 1 86 TRP H 3.320 . 3.320 2.322 2.246 2.402 . 0 0 "[ . 1 . 2]" 1
106 1 30 LEU HB3 1 86 TRP H 5.500 . 5.500 5.023 4.964 5.162 . 0 0 "[ . 1 . 2]" 1
107 1 75 VAL HB 1 86 TRP H 5.500 . 5.500 4.883 4.507 5.284 . 0 0 "[ . 1 . 2]" 1
108 1 29 ARG HB3 1 86 TRP H . . 5.000 4.937 4.663 5.033 0.033 8 0 "[ . 1 . 2]" 1
109 1 29 ARG HB2 1 86 TRP H 4.730 . 4.730 3.865 3.682 4.062 . 0 0 "[ . 1 . 2]" 1
110 1 86 TRP H 1 87 ILE MG 4.430 . 4.430 3.950 3.778 4.076 . 0 0 "[ . 1 . 2]" 1
111 1 31 THR MG 1 86 TRP H 4.470 . 4.470 4.463 4.216 4.525 0.055 12 0 "[ . 1 . 2]" 1
112 1 35 ILE MD 1 86 TRP H 4.360 . 4.360 3.480 3.255 3.671 . 0 0 "[ . 1 . 2]" 1
113 1 14 TYR H 1 15 ALA H 3.500 . 3.500 2.732 2.646 2.905 . 0 0 "[ . 1 . 2]" 1
114 1 15 ALA H 1 16 ASP H 3.250 . 3.250 2.748 2.638 2.872 . 0 0 "[ . 1 . 2]" 1
115 1 15 ALA H 1 65 ASN HD22 5.360 . 5.360 4.923 4.511 5.211 . 0 0 "[ . 1 . 2]" 1
116 1 14 TYR HB2 1 15 ALA H 3.390 . 3.390 2.445 2.230 2.724 . 0 0 "[ . 1 . 2]" 1
117 1 14 TYR HB3 1 15 ALA H 3.980 . 3.980 3.569 3.295 3.704 . 0 0 "[ . 1 . 2]" 1
118 1 15 ALA H 1 65 ASN HB2 . . 4.500 4.400 4.105 4.523 0.023 19 0 "[ . 1 . 2]" 1
119 1 15 ALA H 1 17 LEU HG 5.500 . 5.500 5.241 5.015 5.485 . 0 0 "[ . 1 . 2]" 1
120 1 15 ALA H 1 15 ALA MB 2.780 . 2.780 2.193 2.158 2.217 . 0 0 "[ . 1 . 2]" 1
121 1 15 ALA H 1 18 ILE MD 4.440 . 4.440 3.865 3.708 4.000 . 0 0 "[ . 1 . 2]" 1
122 1 15 ALA H 1 17 LEU HB2 5.500 . 5.500 5.334 5.220 5.433 . 0 0 "[ . 1 . 2]" 1
123 1 15 ALA H 1 65 ASN HB3 4.820 . 4.820 3.590 3.456 3.736 . 0 0 "[ . 1 . 2]" 1
124 1 29 ARG HA 1 88 ILE H 5.500 . 5.500 5.344 5.216 5.461 . 0 0 "[ . 1 . 2]" 1
125 1 87 ILE HB 1 88 ILE H 3.390 . 3.390 2.724 2.531 3.043 . 0 0 "[ . 1 . 2]" 1
126 1 88 ILE H 1 88 ILE HB 3.380 . 3.380 2.670 2.497 2.813 . 0 0 "[ . 1 . 2]" 1
127 1 88 ILE H 1 88 ILE HG12 4.270 . 4.270 3.875 3.817 3.949 . 0 0 "[ . 1 . 2]" 1
128 1 88 ILE H 1 88 ILE MD 3.650 . 3.650 2.119 2.004 2.247 . 0 0 "[ . 1 . 2]" 1
129 1 87 ILE MD 1 88 ILE H 3.520 . 3.520 3.279 2.788 3.457 . 0 0 "[ . 1 . 2]" 1
130 1 12 LEU H 1 13 SER H 4.730 . 4.730 4.522 4.403 4.597 . 0 0 "[ . 1 . 2]" 1
131 1 13 SER H 1 13 SER HB3 3.610 . 3.610 3.528 3.490 3.558 . 0 0 "[ . 1 . 2]" 1
132 1 13 SER H 1 16 ASP HB2 3.480 . 3.480 2.252 2.052 2.407 . 0 0 "[ . 1 . 2]" 1
133 1 13 SER H 1 17 LEU HG . . 5.000 4.326 3.993 4.572 . 0 0 "[ . 1 . 2]" 1
134 1 12 LEU HB3 1 13 SER H 3.710 . 3.710 3.021 2.721 3.343 . 0 0 "[ . 1 . 2]" 1
135 1 12 LEU HB2 1 13 SER H 4.390 . 4.390 4.006 3.845 4.179 . 0 0 "[ . 1 . 2]" 1
136 1 67 SER H 1 68 LEU H 3.220 . 3.220 2.334 1.951 2.689 . 0 0 "[ . 1 . 2]" 1
137 1 67 SER QB 1 68 LEU H 4.110 . 4.110 3.572 3.257 4.025 . 0 0 "[ . 1 . 2]" 1
138 1 66 LEU HA 1 68 LEU H 4.620 . 4.620 3.768 3.478 4.039 . 0 0 "[ . 1 . 2]" 1
139 1 68 LEU H 1 68 LEU MD1 4.560 . 4.560 3.852 3.108 4.063 . 0 0 "[ . 1 . 2]" 1
140 1 68 LEU H 1 68 LEU MD2 4.560 . 4.560 3.669 3.402 3.849 . 0 0 "[ . 1 . 2]" 1
141 1 11 ASN H 1 12 LEU H 4.160 . 4.160 2.506 1.756 3.543 . 0 0 "[ . 1 . 2]" 1
142 1 11 ASN HD21 1 12 LEU H 5.010 . 5.010 4.549 4.150 5.077 0.067 4 0 "[ . 1 . 2]" 1
143 1 11 ASN HA 1 12 LEU H 3.520 . 3.520 2.898 2.361 3.098 . 0 0 "[ . 1 . 2]" 1
144 1 10 GLY HA2 1 12 LEU H 4.130 . 4.130 3.596 3.201 4.089 . 0 0 "[ . 1 . 2]" 1
145 1 10 GLY HA3 1 12 LEU H 5.030 . 5.030 4.464 4.182 4.807 . 0 0 "[ . 1 . 2]" 1
146 1 11 ASN HB2 1 12 LEU H 4.590 . 4.590 4.200 3.662 4.576 . 0 0 "[ . 1 . 2]" 1
147 1 12 LEU H 1 12 LEU HB2 3.230 . 3.230 2.396 2.319 2.516 . 0 0 "[ . 1 . 2]" 1
148 1 12 LEU H 1 12 LEU MD2 3.540 . 3.540 3.428 1.961 3.640 0.100 8 0 "[ . 1 . 2]" 1
149 1 45 TYR H 1 47 LYS H 4.660 . 4.660 4.078 3.606 4.333 . 0 0 "[ . 1 . 2]" 1
150 1 47 LYS H 1 48 ASP H 3.270 . 3.270 2.620 2.428 2.988 . 0 0 "[ . 1 . 2]" 1
151 1 46 PHE HA 1 47 LYS H 3.550 . 3.550 3.218 3.135 3.316 . 0 0 "[ . 1 . 2]" 1
152 1 40 VAL HA 1 47 LYS H . . 4.500 4.519 4.408 4.589 0.089 11 0 "[ . 1 . 2]" 1
153 1 47 LYS H 1 47 LYS QE 4.610 . 4.610 4.627 4.100 4.719 0.109 15 0 "[ . 1 . 2]" 1
154 1 46 PHE HB3 1 47 LYS H 4.050 . 4.050 4.033 3.714 4.139 0.089 4 0 "[ . 1 . 2]" 1
155 1 46 PHE HB2 1 47 LYS H 4.300 . 4.300 3.934 3.724 4.213 . 0 0 "[ . 1 . 2]" 1
156 1 47 LYS H 1 47 LYS QB 2.810 . 2.810 2.109 1.967 2.481 . 0 0 "[ . 1 . 2]" 1
157 1 47 LYS H 1 47 LYS QG 4.030 . 4.030 3.491 2.389 3.989 . 0 0 "[ . 1 . 2]" 1
158 1 40 VAL MG1 1 47 LYS H 5.340 . 5.340 4.545 4.424 4.790 . 0 0 "[ . 1 . 2]" 1
159 1 19 THR H 1 20 ARG H 3.130 . 3.130 2.821 2.755 2.877 . 0 0 "[ . 1 . 2]" 1
160 1 20 ARG H 1 23 GLU H 4.790 . 4.790 4.744 4.634 4.815 0.025 7 0 "[ . 1 . 2]" 1
161 1 20 ARG H 1 21 ALA H 3.020 . 3.020 2.737 2.689 2.794 . 0 0 "[ . 1 . 2]" 1
162 1 17 LEU HA 1 20 ARG H 3.450 . 3.450 3.137 2.963 3.322 . 0 0 "[ . 1 . 2]" 1
163 1 19 THR HB 1 20 ARG H 3.530 . 3.530 2.526 2.406 2.926 . 0 0 "[ . 1 . 2]" 1
164 1 18 ILE HA 1 20 ARG H 4.510 . 4.510 4.487 4.374 4.528 0.018 6 0 "[ . 1 . 2]" 1
165 1 19 THR MG 1 20 ARG H 3.120 . 3.120 2.778 2.542 2.873 . 0 0 "[ . 1 . 2]" 1
166 1 20 ARG H 1 88 ILE MD 5.500 . 5.500 4.642 4.461 4.835 . 0 0 "[ . 1 . 2]" 1
167 1 34 GLN H 1 36 TYR H 5.500 . 5.500 4.141 4.043 4.254 . 0 0 "[ . 1 . 2]" 1
168 1 33 SER H 1 34 GLN H 3.240 . 3.240 2.686 2.615 2.807 . 0 0 "[ . 1 . 2]" 1
169 1 31 THR H 1 34 GLN H 4.010 . 4.010 3.596 3.375 3.719 . 0 0 "[ . 1 . 2]" 1
170 1 31 THR HA 1 34 GLN H . . 4.620 4.638 4.560 4.684 0.064 16 0 "[ . 1 . 2]" 1
171 1 34 GLN H 1 34 GLN QG 2.830 . 2.830 1.915 1.862 2.013 . 0 0 "[ . 1 . 2]" 1
172 1 34 GLN H 1 34 GLN QB 3.310 . 3.310 2.933 2.796 3.059 . 0 0 "[ . 1 . 2]" 1
173 1 19 THR HA 1 21 ALA H 4.510 . 4.510 4.493 4.387 4.532 0.022 19 0 "[ . 1 . 2]" 1
174 1 17 LEU HA 1 21 ALA H . . 5.000 4.220 4.141 4.274 . 0 0 "[ . 1 . 2]" 1
175 1 21 ALA H 1 39 MET HA 5.400 . 5.400 4.163 3.964 4.434 . 0 0 "[ . 1 . 2]" 1
176 1 18 ILE HA 1 21 ALA H . . 3.930 3.755 3.635 3.832 . 0 0 "[ . 1 . 2]" 1
177 1 20 ARG QB 1 21 ALA H 2.700 . 2.700 2.387 2.224 2.525 . 0 0 "[ . 1 . 2]" 1
178 1 19 THR MG 1 21 ALA H 4.780 . 4.780 4.655 4.559 4.708 . 0 0 "[ . 1 . 2]" 1
179 1 21 ALA H 1 88 ILE MD 5.470 . 5.470 5.199 5.029 5.301 . 0 0 "[ . 1 . 2]" 1
180 1 21 ALA H 1 35 ILE MG 4.540 . 4.540 4.112 3.888 4.438 . 0 0 "[ . 1 . 2]" 1
181 1 21 ALA H 1 22 ILE MD 5.090 . 5.090 5.069 5.004 5.103 0.013 11 0 "[ . 1 . 2]" 1
182 1 21 ALA H 1 21 ALA MB 2.630 . 2.630 2.210 2.186 2.227 . 0 0 "[ . 1 . 2]" 1
183 1 18 ILE MG 1 21 ALA H 5.100 . 5.100 4.911 4.854 4.975 . 0 0 "[ . 1 . 2]" 1
184 1 55 SER H 1 56 ALA H 4.230 . 4.230 2.939 2.759 3.145 . 0 0 "[ . 1 . 2]" 1
185 1 56 ALA H 1 57 GLY H 3.960 . 3.960 3.133 2.951 3.545 . 0 0 "[ . 1 . 2]" 1
186 1 53 ASN HA 1 56 ALA H 3.960 . 3.960 3.781 3.521 3.968 0.008 15 0 "[ . 1 . 2]" 1
187 1 56 ALA H 1 56 ALA MB 2.850 . 2.850 2.234 2.191 2.304 . 0 0 "[ . 1 . 2]" 1
188 1 42 CYS H 1 43 VAL H 3.080 . 3.080 1.981 1.926 2.166 . 0 0 "[ . 1 . 2]" 1
189 1 40 VAL H 1 43 VAL H 4.950 . 4.950 4.765 4.677 4.848 . 0 0 "[ . 1 . 2]" 1
190 1 43 VAL H 1 44 PRO HD3 4.760 . 4.760 4.793 4.714 4.842 0.082 18 0 "[ . 1 . 2]" 1
191 1 43 VAL H 1 44 PRO HD2 4.850 . 4.850 4.921 4.883 4.968 0.118 17 0 "[ . 1 . 2]" 1
192 1 40 VAL HA 1 43 VAL H 4.660 . 4.660 3.803 3.666 3.905 . 0 0 "[ . 1 . 2]" 1
193 1 43 VAL H 1 43 VAL HB 3.180 . 3.180 2.167 2.076 2.230 . 0 0 "[ . 1 . 2]" 1
194 1 42 CYS HB2 1 43 VAL H 4.150 . 4.150 4.139 3.968 4.190 0.040 16 0 "[ . 1 . 2]" 1
195 1 20 ARG QB 1 43 VAL H 4.960 . 4.960 4.974 4.826 5.027 0.067 8 0 "[ . 1 . 2]" 1
196 1 42 CYS HB3 1 43 VAL H 4.150 . 4.150 3.087 2.737 3.281 . 0 0 "[ . 1 . 2]" 1
197 1 43 VAL H 1 43 VAL MG1 3.130 . 3.130 2.243 2.149 2.329 . 0 0 "[ . 1 . 2]" 1
198 1 52 SER QB 1 54 SER H 4.550 . 4.550 2.651 2.349 3.317 . 0 0 "[ . 1 . 2]" 1
199 1 53 ASN HA 1 54 SER H 3.510 . 3.510 3.360 3.264 3.512 0.002 9 0 "[ . 1 . 2]" 1
200 1 49 LYS HA 1 54 SER H 4.400 . 4.400 4.164 3.771 4.484 0.084 12 0 "[ . 1 . 2]" 1
201 1 53 ASN HA 1 55 SER H 4.150 . 4.150 3.407 3.014 3.712 . 0 0 "[ . 1 . 2]" 1
202 1 54 SER QB 1 55 SER H 4.490 . 4.490 3.013 2.722 3.309 . 0 0 "[ . 1 . 2]" 1
203 1 61 SER H 1 62 ILE H 3.250 . 3.250 2.481 2.376 2.588 . 0 0 "[ . 1 . 2]" 1
204 1 61 SER H 1 64 HIS H 5.380 . 5.380 5.196 4.987 5.382 0.002 18 0 "[ . 1 . 2]" 1
205 1 60 ASN H 1 61 SER H 2.990 . 2.990 2.410 2.309 2.603 . 0 0 "[ . 1 . 2]" 1
206 1 59 LYS H 1 61 SER H 4.380 . 4.380 4.052 3.865 4.357 . 0 0 "[ . 1 . 2]" 1
207 1 58 TRP HA 1 61 SER H . . 3.720 3.094 2.849 3.402 . 0 0 "[ . 1 . 2]" 1
208 1 61 SER H 1 61 SER HB3 2.950 . 2.950 2.574 2.362 3.197 0.247 10 0 "[ . 1 . 2]" 1
209 1 61 SER H 1 62 ILE HA 5.170 . 5.170 5.086 4.972 5.175 0.005 12 0 "[ . 1 . 2]" 1
210 1 61 SER H 1 61 SER HB2 3.140 . 3.140 2.341 1.830 2.579 . 0 0 "[ . 1 . 2]" 1
211 1 60 ASN QB 1 61 SER H 3.620 . 3.620 3.342 2.131 3.547 . 0 0 "[ . 1 . 2]" 1
212 1 61 SER H 1 62 ILE HB 4.500 . 4.500 4.249 4.099 4.416 . 0 0 "[ . 1 . 2]" 1
213 1 59 LYS HB3 1 61 SER H 5.500 . 5.500 5.204 5.010 5.441 . 0 0 "[ . 1 . 2]" 1
214 1 61 SER H 1 62 ILE MG 5.500 . 5.500 5.321 5.176 5.457 . 0 0 "[ . 1 . 2]" 1
215 1 37 GLU H 1 37 GLU HB2 3.680 . 3.680 3.667 3.640 3.687 0.007 15 0 "[ . 1 . 2]" 1
216 1 37 GLU H 1 37 GLU HB3 3.680 . 3.680 2.848 2.683 2.918 . 0 0 "[ . 1 . 2]" 1
217 1 37 GLU H 1 37 GLU QG 2.620 . 2.620 1.939 1.812 2.038 . 0 0 "[ . 1 . 2]" 1
218 1 39 MET H 1 41 ARG QG 4.640 . 4.640 4.266 4.135 4.405 . 0 0 "[ . 1 . 2]" 1
219 1 41 ARG H 1 42 CYS H 3.020 . 3.020 2.814 2.635 2.951 . 0 0 "[ . 1 . 2]" 1
220 1 39 MET H 1 41 ARG H 4.300 . 4.300 3.941 3.883 4.024 . 0 0 "[ . 1 . 2]" 1
221 1 40 VAL H 1 41 ARG H 3.190 . 3.190 2.762 2.674 2.809 . 0 0 "[ . 1 . 2]" 1
222 1 41 ARG H 1 41 ARG HD3 4.160 . 4.160 3.956 3.767 4.162 0.002 2 0 "[ . 1 . 2]" 1
223 1 39 MET QB 1 41 ARG H 4.660 . 4.660 4.478 4.274 4.730 0.070 6 0 "[ . 1 . 2]" 1
224 1 40 VAL HB 1 41 ARG H 3.330 . 3.330 2.995 2.828 3.091 . 0 0 "[ . 1 . 2]" 1
225 1 41 ARG H 1 41 ARG QB 2.710 . 2.710 2.579 2.496 2.673 . 0 0 "[ . 1 . 2]" 1
226 1 41 ARG H 1 41 ARG QG 3.260 . 3.260 2.190 2.070 2.261 . 0 0 "[ . 1 . 2]" 1
227 1 40 VAL MG1 1 41 ARG H 3.780 . 3.780 3.762 3.639 3.828 0.048 7 0 "[ . 1 . 2]" 1
228 1 57 GLY H 1 60 ASN H . . 4.250 3.125 2.980 3.412 . 0 0 "[ . 1 . 2]" 1
229 1 59 LYS H 1 60 ASN H 3.550 . 3.550 2.594 2.483 2.798 . 0 0 "[ . 1 . 2]" 1
230 1 57 GLY HA2 1 60 ASN H 4.200 . 4.200 3.952 3.778 4.221 0.021 4 0 "[ . 1 . 2]" 1
231 1 60 ASN H 1 61 SER HB2 5.030 . 5.030 4.479 3.875 4.938 . 0 0 "[ . 1 . 2]" 1
232 1 60 ASN H 1 60 ASN QB 2.730 . 2.730 2.367 2.238 2.514 . 0 0 "[ . 1 . 2]" 1
233 1 59 LYS HB3 1 60 ASN H 3.630 . 3.630 3.203 2.772 3.600 . 0 0 "[ . 1 . 2]" 1
234 1 63 ARG H 1 65 ASN HD22 5.500 . 5.500 5.582 5.546 5.634 0.134 7 0 "[ . 1 . 2]" 1
235 1 60 ASN HA 1 63 ARG H . . 4.050 3.634 3.393 3.947 . 0 0 "[ . 1 . 2]" 1
236 1 62 ILE HB 1 63 ARG H 3.660 . 3.660 3.023 2.757 3.226 . 0 0 "[ . 1 . 2]" 1
237 1 63 ARG H 1 63 ARG HG3 2.830 . 2.830 2.249 2.063 2.523 . 0 0 "[ . 1 . 2]" 1
238 1 63 ARG H 1 63 ARG HG2 3.750 . 3.750 3.384 3.206 3.591 . 0 0 "[ . 1 . 2]" 1
239 1 62 ILE MD 1 63 ARG H 5.270 . 5.270 4.878 4.745 5.025 . 0 0 "[ . 1 . 2]" 1
240 1 63 ARG H 1 66 LEU QB 5.500 . 5.500 5.477 4.990 5.588 0.088 9 0 "[ . 1 . 2]" 1
241 1 62 ILE MG 1 63 ARG H 3.650 . 3.650 2.720 2.600 2.836 . 0 0 "[ . 1 . 2]" 1
242 1 21 ALA H 1 22 ILE H 3.130 . 3.130 2.652 2.591 2.691 . 0 0 "[ . 1 . 2]" 1
243 1 70 SER HA 1 72 PHE H 4.480 . 4.480 3.150 2.929 3.445 . 0 0 "[ . 1 . 2]" 1
244 1 18 ILE HA 1 22 ILE H 4.210 . 4.210 4.169 4.044 4.240 0.030 17 0 "[ . 1 . 2]" 1
245 1 22 ILE H 1 22 ILE HB 2.660 . 2.660 2.388 2.318 2.468 . 0 0 "[ . 1 . 2]" 1
246 1 71 ARG HB2 1 72 PHE H 4.370 . 4.370 3.901 2.941 4.381 0.011 7 0 "[ . 1 . 2]" 1
247 1 22 ILE H 1 22 ILE MG 4.100 . 4.100 3.715 3.691 3.733 . 0 0 "[ . 1 . 2]" 1
248 1 22 ILE H 1 35 ILE MG 4.360 . 4.360 3.541 3.242 3.785 . 0 0 "[ . 1 . 2]" 1
249 1 22 ILE H 1 22 ILE MD 3.630 . 3.630 3.471 3.409 3.501 . 0 0 "[ . 1 . 2]" 1
250 1 22 ILE H 1 22 ILE QG 2.890 . 2.890 2.118 2.068 2.175 . 0 0 "[ . 1 . 2]" 1
251 1 18 ILE MG 1 22 ILE H 4.450 . 4.450 4.150 4.073 4.276 . 0 0 "[ . 1 . 2]" 1
252 1 91 ASP H 1 93 GLY H . . 4.000 3.523 2.154 4.041 0.041 8 0 "[ . 1 . 2]" 1
253 1 90 PRO HD3 1 91 ASP H 4.340 . 4.340 3.534 3.414 3.700 . 0 0 "[ . 1 . 2]" 1
254 1 90 PRO HD2 1 91 ASP H 3.700 . 3.700 2.185 1.945 2.474 . 0 0 "[ . 1 . 2]" 1
255 1 91 ASP H 1 91 ASP HB2 3.920 . 3.920 3.689 2.484 4.043 0.123 15 0 "[ . 1 . 2]" 1
256 1 91 ASP H 1 91 ASP HB3 3.920 . 3.920 3.472 3.207 4.024 0.104 8 0 "[ . 1 . 2]" 1
257 1 90 PRO QB 1 91 ASP H 4.040 . 4.040 3.340 2.240 3.797 . 0 0 "[ . 1 . 2]" 1
258 1 90 PRO QG 1 91 ASP H 3.290 . 3.290 2.636 1.962 3.319 0.029 5 0 "[ . 1 . 2]" 1
259 1 5 ARG HA 1 6 ARG H 3.230 . 3.230 2.381 2.054 3.261 0.031 11 0 "[ . 1 . 2]" 1
260 1 6 ARG H 1 6 ARG QB 3.370 . 3.370 2.889 2.261 3.294 . 0 0 "[ . 1 . 2]" 1
261 1 6 ARG H 1 6 ARG QG 3.780 . 3.780 2.606 2.038 3.768 . 0 0 "[ . 1 . 2]" 1
262 1 6 ARG H 1 6 ARG QD 5.190 . 5.190 4.491 3.917 5.346 0.156 11 0 "[ . 1 . 2]" 1
263 1 6 ARG QB 1 7 ASN H 4.670 . 4.670 2.530 2.073 3.013 . 0 0 "[ . 1 . 2]" 1
264 1 5 ARG H 1 6 ARG QB 5.040 . 5.040 4.712 3.733 5.136 0.096 17 0 "[ . 1 . 2]" 1
265 1 8 ALA H 1 9 TRP HA 5.270 . 5.270 5.169 4.757 5.310 0.040 2 0 "[ . 1 . 2]" 1
266 1 12 LEU H 1 12 LEU MD1 3.540 . 3.540 3.531 3.256 3.648 0.108 8 0 "[ . 1 . 2]" 1
267 1 13 SER H 1 16 ASP H 3.890 . 3.890 3.460 3.264 3.669 . 0 0 "[ . 1 . 2]" 1
268 1 16 ASP H 1 16 ASP HB2 2.970 . 2.970 2.472 2.400 2.524 . 0 0 "[ . 1 . 2]" 1
269 1 16 ASP H 1 16 ASP HB3 3.690 . 3.690 3.621 3.588 3.649 . 0 0 "[ . 1 . 2]" 1
270 1 15 ALA MB 1 16 ASP H 3.050 . 3.050 2.494 2.380 2.568 . 0 0 "[ . 1 . 2]" 1
271 1 18 ILE H 1 19 THR H 3.320 . 3.320 2.678 2.629 2.738 . 0 0 "[ . 1 . 2]" 1
272 1 18 ILE H 1 19 THR HA 5.410 . 5.410 5.196 5.121 5.257 . 0 0 "[ . 1 . 2]" 1
273 1 15 ALA HA 1 18 ILE H 3.850 . 3.850 3.680 3.545 3.814 . 0 0 "[ . 1 . 2]" 1
274 1 14 TYR HB3 1 18 ILE H 5.500 . 5.500 5.028 4.810 5.182 . 0 0 "[ . 1 . 2]" 1
275 1 17 LEU HB2 1 18 ILE H 3.390 . 3.390 2.476 2.266 2.599 . 0 0 "[ . 1 . 2]" 1
276 1 17 LEU HB3 1 18 ILE H 3.680 . 3.680 3.607 3.478 3.687 0.007 2 0 "[ . 1 . 2]" 1
277 1 18 ILE H 1 18 ILE HB 3.840 . 3.840 3.111 3.050 3.184 . 0 0 "[ . 1 . 2]" 1
278 1 15 ALA MB 1 18 ILE H 5.020 . 5.020 4.760 4.660 4.874 . 0 0 "[ . 1 . 2]" 1
279 1 18 ILE H 1 62 ILE MD 4.560 . 4.560 3.618 3.376 3.812 . 0 0 "[ . 1 . 2]" 1
280 1 18 ILE H 1 18 ILE MD 3.560 . 3.560 3.468 3.399 3.536 . 0 0 "[ . 1 . 2]" 1
281 1 18 ILE H 1 18 ILE MG 3.640 . 3.640 3.670 3.652 3.686 0.046 8 0 "[ . 1 . 2]" 1
282 1 13 SER H 1 13 SER HB2 3.610 . 3.610 2.527 2.340 2.714 . 0 0 "[ . 1 . 2]" 1
283 1 13 SER H 1 16 ASP HB3 . . 3.660 3.569 3.420 3.685 0.025 15 0 "[ . 1 . 2]" 1
284 1 12 LEU HA 1 13 SER H 2.790 . 2.790 2.196 2.095 2.285 . 0 0 "[ . 1 . 2]" 1
285 1 18 ILE H 1 18 ILE QG 3.870 . 3.870 1.713 1.649 1.771 . 0 0 "[ . 1 . 2]" 1
286 1 33 SER QB 1 34 GLN H 2.940 . 2.940 2.348 2.216 2.533 . 0 0 "[ . 1 . 2]" 1
287 1 20 ARG H 1 20 ARG QB 2.700 . 2.700 2.573 2.481 2.629 . 0 0 "[ . 1 . 2]" 1
288 1 20 ARG H 1 20 ARG HG2 2.920 . 2.920 2.164 2.056 2.248 . 0 0 "[ . 1 . 2]" 1
289 1 21 ALA MB 1 22 ILE H 2.790 . 2.790 2.282 2.197 2.391 . 0 0 "[ . 1 . 2]" 1
290 1 27 ASP H 1 28 LYS H 2.870 . 2.870 2.414 1.991 2.692 . 0 0 "[ . 1 . 2]" 1
291 1 28 LYS H 1 29 ARG H 3.120 . 3.120 2.737 2.618 2.843 . 0 0 "[ . 1 . 2]" 1
292 1 27 ASP HA 1 28 LYS H 3.430 . 3.430 3.198 3.071 3.326 . 0 0 "[ . 1 . 2]" 1
293 1 28 LYS H 1 28 LYS HA 2.560 . 2.560 2.219 2.186 2.251 . 0 0 "[ . 1 . 2]" 1
294 1 28 LYS H 1 28 LYS HE3 4.120 . 4.120 3.867 3.542 4.123 0.003 16 0 "[ . 1 . 2]" 1
295 1 27 ASP HB2 1 28 LYS H 5.100 . 5.100 4.155 3.499 4.512 . 0 0 "[ . 1 . 2]" 1
296 1 26 PRO HB2 1 28 LYS H 4.910 . 4.910 4.682 4.428 4.957 0.047 6 0 "[ . 1 . 2]" 1
297 1 27 ASP HB3 1 28 LYS H 5.100 . 5.100 3.956 3.642 4.392 . 0 0 "[ . 1 . 2]" 1
298 1 28 LYS H 1 28 LYS HB2 3.890 . 3.890 3.739 3.695 3.799 . 0 0 "[ . 1 . 2]" 1
299 1 28 LYS H 1 28 LYS QD 3.430 . 3.430 2.561 2.361 2.770 . 0 0 "[ . 1 . 2]" 1
300 1 28 LYS H 1 28 LYS HG2 3.240 . 3.240 2.980 2.837 3.088 . 0 0 "[ . 1 . 2]" 1
301 1 22 ILE MG 1 28 LYS H 4.900 . 4.900 4.282 4.102 4.436 . 0 0 "[ . 1 . 2]" 1
302 1 28 LYS H 1 29 ARG HG3 5.170 . 5.170 5.141 4.928 5.233 0.063 3 0 "[ . 1 . 2]" 1
303 1 28 LYS HB2 1 29 ARG H 4.350 . 4.350 3.823 3.723 3.910 . 0 0 "[ . 1 . 2]" 1
304 1 29 ARG H 1 29 ARG QD 4.750 . 4.750 4.216 4.142 4.305 . 0 0 "[ . 1 . 2]" 1
305 1 29 ARG H 1 29 ARG HB2 3.830 . 3.830 3.728 3.640 3.764 . 0 0 "[ . 1 . 2]" 1
306 1 29 ARG H 1 29 ARG HG2 3.780 . 3.780 2.357 2.226 2.496 . 0 0 "[ . 1 . 2]" 1
307 1 29 ARG H 1 29 ARG HG3 3.810 . 3.810 2.689 2.503 2.874 . 0 0 "[ . 1 . 2]" 1
308 1 29 ARG H 1 30 LEU MD2 4.510 . 4.510 2.948 2.783 3.139 . 0 0 "[ . 1 . 2]" 1
309 1 30 LEU H 1 31 THR H 4.690 . 4.690 4.364 4.296 4.419 . 0 0 "[ . 1 . 2]" 1
310 1 30 LEU H 1 86 TRP H 3.810 . 3.810 2.332 2.257 2.396 . 0 0 "[ . 1 . 2]" 1
311 1 29 ARG HA 1 30 LEU H 3.060 . 3.060 2.097 2.060 2.143 . 0 0 "[ . 1 . 2]" 1
312 1 30 LEU H 1 87 ILE HA 4.470 . 4.470 4.175 4.127 4.246 . 0 0 "[ . 1 . 2]" 1
313 1 30 LEU H 1 85 TRP HA 5.000 . 5.000 3.912 3.688 4.081 . 0 0 "[ . 1 . 2]" 1
314 1 28 LYS HA 1 30 LEU H 5.500 . 5.500 5.437 5.305 5.519 0.019 11 0 "[ . 1 . 2]" 1
315 1 22 ILE HA 1 30 LEU H 5.110 . 5.110 5.179 5.134 5.217 0.107 7 0 "[ . 1 . 2]" 1
316 1 30 LEU H 1 85 TRP QB 3.930 . 3.930 2.957 2.880 3.054 . 0 0 "[ . 1 . 2]" 1
317 1 30 LEU H 1 34 GLN QG 5.250 . 5.250 5.107 4.921 5.332 0.082 10 0 "[ . 1 . 2]" 1
318 1 30 LEU H 1 30 LEU HB3 4.010 . 4.010 3.866 3.834 3.900 . 0 0 "[ . 1 . 2]" 1
319 1 29 ARG HB3 1 30 LEU H 4.290 . 4.290 4.127 4.020 4.212 . 0 0 "[ . 1 . 2]" 1
320 1 30 LEU H 1 30 LEU HB2 3.620 . 3.620 2.797 2.738 2.903 . 0 0 "[ . 1 . 2]" 1
321 1 29 ARG HB2 1 30 LEU H 3.820 . 3.820 3.406 3.339 3.475 . 0 0 "[ . 1 . 2]" 1
322 1 30 LEU H 1 87 ILE MG 3.840 . 3.840 3.510 3.438 3.610 . 0 0 "[ . 1 . 2]" 1
323 1 22 ILE MG 1 30 LEU H 4.060 . 4.060 3.904 3.739 4.012 . 0 0 "[ . 1 . 2]" 1
324 1 30 LEU H 1 30 LEU MD1 4.560 . 4.560 3.491 3.391 3.541 . 0 0 "[ . 1 . 2]" 1
325 1 30 LEU H 1 30 LEU MD2 4.560 . 4.560 2.426 2.344 2.491 . 0 0 "[ . 1 . 2]" 1
326 1 30 LEU H 1 35 ILE MD 4.730 . 4.730 3.474 3.202 3.670 . 0 0 "[ . 1 . 2]" 1
327 1 87 ILE H 1 87 ILE QG 3.630 . 3.630 2.774 2.697 2.925 . 0 0 "[ . 1 . 2]" 1
328 1 31 THR H 1 35 ILE H 4.570 . 4.570 4.212 4.106 4.337 . 0 0 "[ . 1 . 2]" 1
329 1 34 GLN H 1 35 ILE H 3.180 . 3.180 2.579 2.542 2.632 . 0 0 "[ . 1 . 2]" 1
330 1 33 SER HA 1 35 ILE H 4.380 . 4.380 4.418 4.399 4.451 0.071 4 0 "[ . 1 . 2]" 1
331 1 32 LEU HA 1 35 ILE H 3.710 . 3.710 3.312 3.112 3.497 . 0 0 "[ . 1 . 2]" 1
332 1 34 GLN QG 1 35 ILE H 3.450 . 3.450 2.795 2.511 3.190 . 0 0 "[ . 1 . 2]" 1
333 1 34 GLN QB 1 35 ILE H 3.930 . 3.930 3.373 2.946 3.645 . 0 0 "[ . 1 . 2]" 1
334 1 35 ILE H 1 37 GLU QG 4.380 . 4.380 4.333 4.248 4.396 0.016 13 0 "[ . 1 . 2]" 1
335 1 35 ILE H 1 35 ILE HB 2.780 . 2.780 2.562 2.496 2.637 . 0 0 "[ . 1 . 2]" 1
336 1 30 LEU HB2 1 35 ILE H 4.160 . 4.160 3.688 3.435 3.988 . 0 0 "[ . 1 . 2]" 1
337 1 35 ILE H 1 35 ILE QG 3.410 . 3.410 2.272 2.171 2.381 . 0 0 "[ . 1 . 2]" 1
338 1 31 THR MG 1 34 GLN H 4.150 . 4.150 3.890 3.800 3.971 . 0 0 "[ . 1 . 2]" 1
339 1 17 LEU HB3 1 20 ARG H 5.500 . 5.500 5.069 4.963 5.173 . 0 0 "[ . 1 . 2]" 1
340 1 18 ILE HB 1 20 ARG H 5.500 . 5.500 4.935 4.801 5.086 . 0 0 "[ . 1 . 2]" 1
341 1 38 TRP HB2 1 39 MET H 3.490 . 3.490 2.942 2.788 3.039 . 0 0 "[ . 1 . 2]" 1
342 1 34 GLN HA 1 38 TRP H 4.710 . 4.710 3.707 3.616 3.789 . 0 0 "[ . 1 . 2]" 1
343 1 38 TRP H 1 38 TRP HB2 3.020 . 3.020 2.281 2.246 2.310 . 0 0 "[ . 1 . 2]" 1
344 1 38 TRP H 1 38 TRP HB3 3.520 . 3.520 3.549 3.533 3.564 0.044 4 0 "[ . 1 . 2]" 1
345 1 37 GLU HB2 1 38 TRP H 4.530 . 4.530 3.604 3.512 3.718 . 0 0 "[ . 1 . 2]" 1
346 1 37 GLU HB3 1 38 TRP H 4.530 . 4.530 4.103 3.946 4.218 . 0 0 "[ . 1 . 2]" 1
347 1 37 GLU QG 1 38 TRP H 3.250 . 3.250 2.098 1.940 2.274 . 0 0 "[ . 1 . 2]" 1
348 1 38 TRP H 1 41 ARG QG 4.730 . 4.730 3.879 3.801 3.999 . 0 0 "[ . 1 . 2]" 1
349 1 38 TRP H 1 40 VAL MG2 5.240 . 5.240 5.150 5.041 5.246 0.006 15 0 "[ . 1 . 2]" 1
350 1 35 ILE QG 1 38 TRP H 5.500 . 5.500 5.425 5.311 5.468 . 0 0 "[ . 1 . 2]" 1
351 1 21 ALA MB 1 38 TRP H 4.500 . 4.500 4.022 3.859 4.215 . 0 0 "[ . 1 . 2]" 1
352 1 35 ILE H 1 35 ILE MG 3.910 . 3.910 3.824 3.777 3.866 . 0 0 "[ . 1 . 2]" 1
353 1 35 ILE H 1 37 GLU H 4.340 . 4.340 4.254 4.181 4.329 . 0 0 "[ . 1 . 2]" 1
354 1 34 GLN H 1 37 GLU H 5.330 . 5.330 4.866 4.803 4.929 . 0 0 "[ . 1 . 2]" 1
355 1 38 TRP HB3 1 39 MET H 4.050 . 4.050 3.492 3.362 3.629 . 0 0 "[ . 1 . 2]" 1
356 1 34 GLN HA 1 37 GLU H 3.910 . 3.910 3.160 2.987 3.368 . 0 0 "[ . 1 . 2]" 1
357 1 39 MET H 1 41 ARG QB 5.450 . 5.450 4.982 4.828 5.230 . 0 0 "[ . 1 . 2]" 1
358 1 21 ALA MB 1 39 MET H 4.020 . 4.020 2.634 2.439 2.792 . 0 0 "[ . 1 . 2]" 1
359 1 39 MET H 1 39 MET QB 2.780 . 2.780 2.360 1.950 2.841 0.061 10 0 "[ . 1 . 2]" 1
360 1 40 VAL H 1 40 VAL MG1 3.760 . 3.760 3.791 3.776 3.802 0.042 6 0 "[ . 1 . 2]" 1
361 1 43 VAL H 1 43 VAL MG2 3.840 . 3.840 3.613 3.549 3.650 . 0 0 "[ . 1 . 2]" 1
362 1 47 LYS H 1 47 LYS HD3 3.680 . 3.680 3.133 2.877 3.783 0.103 5 0 "[ . 1 . 2]" 1
363 1 48 ASP H 1 49 LYS H 3.210 . 3.210 2.448 2.316 2.586 . 0 0 "[ . 1 . 2]" 1
364 1 47 LYS H 1 49 LYS H 4.220 . 4.220 3.706 3.478 3.926 . 0 0 "[ . 1 . 2]" 1
365 1 47 LYS HA 1 49 LYS H 4.710 . 4.710 4.421 4.247 4.611 . 0 0 "[ . 1 . 2]" 1
366 1 46 PHE HA 1 49 LYS H 3.720 . 3.720 2.688 2.442 3.225 . 0 0 "[ . 1 . 2]" 1
367 1 48 ASP HB2 1 49 LYS H 4.010 . 4.010 3.345 2.357 4.023 0.013 17 0 "[ . 1 . 2]" 1
368 1 48 ASP HB3 1 49 LYS H 4.010 . 4.010 3.062 2.249 4.039 0.029 17 0 "[ . 1 . 2]" 1
369 1 49 LYS H 1 49 LYS HD3 3.270 . 3.270 2.827 2.656 3.014 . 0 0 "[ . 1 . 2]" 1
370 1 49 LYS H 1 49 LYS HG2 3.650 . 3.650 2.072 1.970 2.177 . 0 0 "[ . 1 . 2]" 1
371 1 49 LYS H 1 49 LYS HG3 3.680 . 3.680 3.615 3.528 3.690 0.010 18 0 "[ . 1 . 2]" 1
372 1 50 GLY H 1 51 ASP H 3.240 . 3.240 2.316 2.138 2.519 . 0 0 "[ . 1 . 2]" 1
373 1 50 GLY HA3 1 51 ASP H 3.400 . 3.400 3.120 2.889 3.320 . 0 0 "[ . 1 . 2]" 1
374 1 46 PHE H 1 48 ASP H 5.230 . 5.230 4.884 4.636 5.206 . 0 0 "[ . 1 . 2]" 1
375 1 49 LYS HD3 1 51 ASP H 5.390 . 5.390 5.166 4.776 5.423 0.033 19 0 "[ . 1 . 2]" 1
376 1 40 VAL MG1 1 51 ASP H 5.500 . 5.500 5.227 4.630 5.553 0.053 6 0 "[ . 1 . 2]" 1
377 1 53 ASN QB 1 54 SER H 4.450 . 4.450 3.066 2.638 3.395 . 0 0 "[ . 1 . 2]" 1
378 1 58 TRP H 1 59 LYS H 3.410 . 3.410 2.460 2.170 2.816 . 0 0 "[ . 1 . 2]" 1
379 1 58 TRP H 1 60 ASN HD22 5.480 . 5.480 5.445 5.147 5.578 0.098 8 0 "[ . 1 . 2]" 1
380 1 58 TRP H 1 58 TRP HB3 3.670 . 3.670 3.570 3.446 3.668 . 0 0 "[ . 1 . 2]" 1
381 1 58 TRP H 1 58 TRP HB2 3.570 . 3.570 2.334 2.159 2.522 . 0 0 "[ . 1 . 2]" 1
382 1 62 ILE H 1 63 ARG H 3.310 . 3.310 2.732 2.653 2.806 . 0 0 "[ . 1 . 2]" 1
383 1 58 TRP HA 1 62 ILE H 5.440 . 5.440 4.015 3.703 4.715 . 0 0 "[ . 1 . 2]" 1
384 1 61 SER HB3 1 62 ILE H 3.570 . 3.570 2.778 2.529 3.589 0.019 10 0 "[ . 1 . 2]" 1
385 1 59 LYS HA 1 62 ILE H 3.780 . 3.780 3.014 2.838 3.306 . 0 0 "[ . 1 . 2]" 1
386 1 61 SER HB2 1 62 ILE H 3.990 . 3.990 3.636 2.385 3.923 . 0 0 "[ . 1 . 2]" 1
387 1 60 ASN QB 1 62 ILE H 5.260 . 5.260 5.052 4.388 5.205 . 0 0 "[ . 1 . 2]" 1
388 1 62 ILE H 1 62 ILE HB 3.110 . 3.110 2.126 2.090 2.159 . 0 0 "[ . 1 . 2]" 1
389 1 62 ILE H 1 62 ILE HG12 4.490 . 4.490 4.040 3.871 4.191 . 0 0 "[ . 1 . 2]" 1
390 1 62 ILE H 1 62 ILE HG13 4.490 . 4.490 2.991 2.768 3.291 . 0 0 "[ . 1 . 2]" 1
391 1 62 ILE H 1 62 ILE MD 4.440 . 4.440 3.901 3.749 4.090 . 0 0 "[ . 1 . 2]" 1
392 1 62 ILE H 1 62 ILE MG 3.570 . 3.570 3.534 3.413 3.606 0.036 15 0 "[ . 1 . 2]" 1
393 1 18 ILE MD 1 62 ILE H 5.410 . 5.410 5.155 4.899 5.403 . 0 0 "[ . 1 . 2]" 1
394 1 56 ALA HA 1 57 GLY H 3.290 . 3.290 2.596 2.212 2.787 . 0 0 "[ . 1 . 2]" 1
395 1 63 ARG H 1 63 ARG QB 3.030 . 3.030 2.474 2.359 2.549 . 0 0 "[ . 1 . 2]" 1
396 1 66 LEU H 1 68 LEU H 4.640 . 4.640 4.081 3.915 4.273 . 0 0 "[ . 1 . 2]" 1
397 1 65 ASN HB2 1 66 LEU H 4.560 . 4.560 2.907 2.806 3.046 . 0 0 "[ . 1 . 2]" 1
398 1 65 ASN HB3 1 66 LEU H 4.560 . 4.560 3.782 3.679 3.898 . 0 0 "[ . 1 . 2]" 1
399 1 66 LEU H 1 66 LEU QB 3.690 . 3.690 2.333 2.240 2.437 . 0 0 "[ . 1 . 2]" 1
400 1 66 LEU H 1 66 LEU HG 4.240 . 4.240 3.753 3.530 4.126 . 0 0 "[ . 1 . 2]" 1
401 1 18 ILE MD 1 66 LEU H 4.620 . 4.620 3.582 3.360 3.795 . 0 0 "[ . 1 . 2]" 1
402 1 15 ALA MB 1 66 LEU H 5.500 . 5.500 5.467 5.280 5.534 0.034 17 0 "[ . 1 . 2]" 1
403 1 66 LEU H 1 66 LEU MD1 4.490 . 4.490 2.178 2.030 2.485 . 0 0 "[ . 1 . 2]" 1
404 1 62 ILE MG 1 66 LEU H 4.920 . 4.920 4.100 3.967 4.227 . 0 0 "[ . 1 . 2]" 1
405 1 19 THR HA 1 22 ILE H 4.500 . 4.500 3.571 3.439 3.664 . 0 0 "[ . 1 . 2]" 1
406 1 22 ILE H 1 23 GLU HB2 4.990 . 4.990 4.945 4.695 5.039 0.049 4 0 "[ . 1 . 2]" 1
407 1 71 ARG HB3 1 72 PHE H 4.370 . 4.370 3.719 3.103 4.374 0.004 2 0 "[ . 1 . 2]" 1
408 1 22 ILE H 1 88 ILE MD 4.780 . 4.780 3.752 3.593 3.827 . 0 0 "[ . 1 . 2]" 1
409 1 75 VAL H 1 86 TRP HA 4.250 . 4.250 2.934 2.732 3.136 . 0 0 "[ . 1 . 2]" 1
410 1 74 ARG HA 1 75 VAL H 3.190 . 3.190 1.888 1.755 1.974 . 0 0 "[ . 1 . 2]" 1
411 1 75 VAL H 1 84 SER QB 5.110 . 5.110 4.089 3.819 4.402 . 0 0 "[ . 1 . 2]" 1
412 1 75 VAL H 1 85 TRP QB 4.410 . 4.410 3.708 3.469 4.007 . 0 0 "[ . 1 . 2]" 1
413 1 73 MET QG 1 75 VAL H 5.170 . 5.170 5.141 4.865 5.262 0.092 10 0 "[ . 1 . 2]" 1
414 1 75 VAL H 1 75 VAL HB 3.850 . 3.850 2.454 2.322 2.672 . 0 0 "[ . 1 . 2]" 1
415 1 75 VAL H 1 87 ILE MG 4.330 . 4.330 3.642 3.247 3.912 . 0 0 "[ . 1 . 2]" 1
416 1 75 VAL H 1 75 VAL MG2 3.760 . 3.760 2.540 2.288 2.749 . 0 0 "[ . 1 . 2]" 1
417 1 74 ARG HG2 1 75 VAL H 4.590 . 4.590 4.154 3.915 4.460 . 0 0 "[ . 1 . 2]" 1
418 1 75 VAL H 1 76 GLN H 4.750 . 4.750 4.314 4.194 4.450 . 0 0 "[ . 1 . 2]" 1
419 1 75 VAL HA 1 76 GLN H 2.890 . 2.890 2.217 2.046 2.448 . 0 0 "[ . 1 . 2]" 1
420 1 76 GLN H 1 76 GLN QB 3.650 . 3.650 2.494 2.303 3.059 . 0 0 "[ . 1 . 2]" 1
421 1 66 LEU H 1 66 LEU MD2 4.490 . 4.490 4.064 3.925 4.179 . 0 0 "[ . 1 . 2]" 1
422 1 64 HIS HA 1 67 SER H 4.620 . 4.620 3.594 3.313 3.920 . 0 0 "[ . 1 . 2]" 1
423 1 67 SER H 1 68 LEU HA 5.260 . 5.260 4.692 4.327 5.071 . 0 0 "[ . 1 . 2]" 1
424 1 74 ARG H 1 87 ILE H 5.190 . 5.190 4.975 4.859 5.043 . 0 0 "[ . 1 . 2]" 1
425 1 73 MET HA 1 74 ARG H 3.020 . 3.020 2.231 2.045 2.394 . 0 0 "[ . 1 . 2]" 1
426 1 73 MET QG 1 74 ARG H 4.300 . 4.300 3.821 3.601 4.025 . 0 0 "[ . 1 . 2]" 1
427 1 73 MET QB 1 74 ARG H 3.700 . 3.700 2.600 2.425 2.898 . 0 0 "[ . 1 . 2]" 1
428 1 74 ARG H 1 74 ARG QB 3.560 . 3.560 2.488 2.300 2.627 . 0 0 "[ . 1 . 2]" 1
429 1 74 ARG H 1 74 ARG HG2 3.910 . 3.910 3.861 3.671 3.953 0.043 12 0 "[ . 1 . 2]" 1
430 1 74 ARG H 1 74 ARG HG3 4.120 . 4.120 2.697 2.400 2.837 . 0 0 "[ . 1 . 2]" 1
431 1 68 LEU H 1 68 LEU HG 3.320 . 3.320 2.759 2.197 3.075 . 0 0 "[ . 1 . 2]" 1
432 1 72 PHE HB3 1 73 MET H 4.080 . 4.080 2.741 2.574 2.994 . 0 0 "[ . 1 . 2]" 1
433 1 75 VAL H 1 75 VAL MG1 3.760 . 3.760 3.632 3.536 3.711 . 0 0 "[ . 1 . 2]" 1
434 1 77 ASN H 1 77 ASN HD21 4.290 . 4.290 3.407 2.154 4.355 0.065 9 0 "[ . 1 . 2]" 1
435 1 77 ASN H 1 77 ASN HD22 4.830 . 4.830 4.306 3.734 4.809 . 0 0 "[ . 1 . 2]" 1
436 1 76 GLN HA 1 77 ASN H 2.720 . 2.720 2.510 2.214 2.739 0.019 7 0 "[ . 1 . 2]" 1
437 1 77 ASN H 1 77 ASN HB2 3.710 . 3.710 2.385 2.252 2.568 . 0 0 "[ . 1 . 2]" 1
438 1 77 ASN H 1 77 ASN HB3 3.710 . 3.710 3.602 3.531 3.719 0.009 7 0 "[ . 1 . 2]" 1
439 1 76 GLN QG 1 77 ASN H 3.760 . 3.760 3.533 2.893 3.806 0.046 19 0 "[ . 1 . 2]" 1
440 1 77 ASN H 1 78 GLU H 4.640 . 4.640 4.478 4.372 4.600 . 0 0 "[ . 1 . 2]" 1
441 1 77 ASN HA 1 78 GLU H 3.010 . 3.010 2.306 2.037 2.714 . 0 0 "[ . 1 . 2]" 1
442 1 78 GLU H 1 79 GLY QA 4.620 . 4.620 4.503 4.123 4.695 0.075 2 0 "[ . 1 . 2]" 1
443 1 78 GLU H 1 78 GLU QG 4.220 . 4.220 2.962 1.914 4.110 . 0 0 "[ . 1 . 2]" 1
444 1 78 GLU H 1 78 GLU HB2 3.660 . 3.660 2.591 2.326 3.571 . 0 0 "[ . 1 . 2]" 1
445 1 78 GLU H 1 78 GLU HB3 3.660 . 3.660 3.142 2.376 3.643 . 0 0 "[ . 1 . 2]" 1
446 1 75 VAL H 1 85 TRP H 4.540 . 4.540 3.462 3.128 3.889 . 0 0 "[ . 1 . 2]" 1
447 1 84 SER HA 1 85 TRP H 3.090 . 3.090 2.432 2.197 2.813 . 0 0 "[ . 1 . 2]" 1
448 1 84 SER QB 1 85 TRP H 3.590 . 3.590 2.509 2.085 3.022 . 0 0 "[ . 1 . 2]" 1
449 1 85 TRP H 1 85 TRP QB 3.530 . 3.530 2.766 2.593 2.936 . 0 0 "[ . 1 . 2]" 1
450 1 75 VAL HB 1 85 TRP H 4.910 . 4.910 3.406 3.148 3.773 . 0 0 "[ . 1 . 2]" 1
451 1 76 GLN QB 1 77 ASN H 3.300 . 3.300 2.178 1.918 2.653 . 0 0 "[ . 1 . 2]" 1
452 1 86 TRP H 1 86 TRP HB2 3.880 . 3.880 2.781 2.716 2.879 . 0 0 "[ . 1 . 2]" 1
453 1 86 TRP H 1 86 TRP HB3 3.880 . 3.880 3.769 3.734 3.837 . 0 0 "[ . 1 . 2]" 1
454 1 85 TRP QB 1 86 TRP H 3.120 . 3.120 2.671 2.545 2.833 . 0 0 "[ . 1 . 2]" 1
455 1 86 TRP HA 1 87 ILE H 3.400 . 3.400 2.271 2.217 2.315 . 0 0 "[ . 1 . 2]" 1
456 1 88 ILE H 1 88 ILE HG13 3.820 . 3.820 2.562 2.452 2.682 . 0 0 "[ . 1 . 2]" 1
457 1 87 ILE MD 1 89 ASN H 4.800 . 4.800 4.244 3.973 4.512 . 0 0 "[ . 1 . 2]" 1
458 1 97 LYS H 1 98 ALA H 4.650 . 4.650 3.019 2.051 4.273 . 0 0 "[ . 1 . 2]" 1
459 1 96 GLY QA 1 97 LYS H 3.150 . 3.150 2.320 2.052 2.882 . 0 0 "[ . 1 . 2]" 1
460 1 96 GLY QA 1 98 ALA H 5.060 . 5.060 3.704 2.859 4.745 . 0 0 "[ . 1 . 2]" 1
461 1 98 ALA H 1 99 PRO HD3 5.130 . 5.130 3.985 2.697 4.817 . 0 0 "[ . 1 . 2]" 1
462 1 98 ALA H 1 98 ALA MB 3.470 . 3.470 2.497 2.169 2.971 . 0 0 "[ . 1 . 2]" 1
463 1 100 ARG H 1 100 ARG QG 4.190 . 4.190 2.719 1.941 4.045 . 0 0 "[ . 1 . 2]" 1
464 1 100 ARG HA 1 101 ARG H 3.350 . 3.350 2.571 2.057 3.429 0.079 1 0 "[ . 1 . 2]" 1
465 1 100 ARG QG 1 101 ARG H 4.770 . 4.770 4.045 2.740 4.778 0.008 14 0 "[ . 1 . 2]" 1
466 1 101 ARG H 1 101 ARG QG 4.970 . 4.970 3.233 1.903 4.243 . 0 0 "[ . 1 . 2]" 1
467 1 102 ARG HA 1 103 ALA H 3.180 . 3.180 2.166 1.992 2.810 . 0 0 "[ . 1 . 2]" 1
468 1 102 ARG QB 1 103 ALA H 4.280 . 4.280 3.501 2.508 3.998 . 0 0 "[ . 1 . 2]" 1
469 1 102 ARG QG 1 103 ALA H 4.470 . 4.470 3.872 2.650 4.535 0.065 17 0 "[ . 1 . 2]" 1
470 1 73 MET QG 1 94 LYS H 5.500 . 5.500 4.561 3.551 5.563 0.063 7 0 "[ . 1 . 2]" 1
471 1 90 PRO QG 1 94 LYS H 5.090 . 5.090 4.463 3.205 5.112 0.022 2 0 "[ . 1 . 2]" 1
472 1 102 ARG H 1 102 ARG QB 2.970 . 2.970 2.547 2.232 3.093 0.123 15 0 "[ . 1 . 2]" 1
473 1 101 ARG HA 1 102 ARG H 3.250 . 3.250 2.488 2.074 3.397 0.147 7 0 "[ . 1 . 2]" 1
474 1 102 ARG H 1 102 ARG QG 4.550 . 4.550 3.547 2.394 4.551 0.001 10 0 "[ . 1 . 2]" 1
475 1 83 SER H 1 83 SER HB2 3.800 . 3.800 2.828 2.355 3.491 . 0 0 "[ . 1 . 2]" 1
476 1 83 SER H 1 83 SER HB3 3.800 . 3.800 3.336 2.415 3.896 0.096 13 0 "[ . 1 . 2]" 1
477 1 34 GLN H 1 34 GLN HE21 4.860 . 4.860 4.813 4.730 4.869 0.009 1 0 "[ . 1 . 2]" 1
478 1 57 GLY HA2 1 60 ASN HD21 3.710 . 3.710 2.371 2.016 3.282 . 0 0 "[ . 1 . 2]" 1
479 1 60 ASN HD21 1 61 SER HB2 4.280 . 4.280 4.258 3.864 4.436 0.156 4 0 "[ . 1 . 2]" 1
480 1 59 LYS HB3 1 60 ASN HD21 5.430 . 5.430 5.539 5.440 5.644 0.214 1 0 "[ . 1 . 2]" 1
481 1 19 THR H 1 19 THR HA 2.880 . 2.880 2.672 2.619 2.739 . 0 0 "[ . 1 . 2]" 1
482 1 15 ALA HA 1 19 THR H 4.600 . 4.600 4.201 4.142 4.271 . 0 0 "[ . 1 . 2]" 1
483 1 19 THR H 1 19 THR HB 3.310 . 3.310 2.048 1.947 2.105 . 0 0 "[ . 1 . 2]" 1
484 1 16 ASP HB3 1 19 THR H 5.350 . 5.350 5.349 5.274 5.390 0.040 13 0 "[ . 1 . 2]" 1
485 1 17 LEU HB2 1 19 THR H 4.980 . 4.980 4.933 4.843 5.005 0.025 1 0 "[ . 1 . 2]" 1
486 1 18 ILE HB 1 19 THR H 3.260 . 3.260 2.368 2.233 2.523 . 0 0 "[ . 1 . 2]" 1
487 1 19 THR H 1 19 THR MG 3.410 . 3.410 3.521 3.459 3.547 0.137 16 0 "[ . 1 . 2]" 1
488 1 19 THR H 1 88 ILE MD 4.200 . 4.200 4.057 3.824 4.127 . 0 0 "[ . 1 . 2]" 1
489 1 19 THR H 1 35 ILE MG 5.500 . 5.500 5.155 4.920 5.372 . 0 0 "[ . 1 . 2]" 1
490 1 19 THR H 1 88 ILE MG 5.500 . 5.500 4.923 4.540 5.151 . 0 0 "[ . 1 . 2]" 1
491 1 18 ILE MD 1 19 THR H 4.730 . 4.730 4.028 3.900 4.185 . 0 0 "[ . 1 . 2]" 1
492 1 18 ILE MG 1 19 THR H 4.070 . 4.070 3.769 3.674 3.887 . 0 0 "[ . 1 . 2]" 1
493 1 19 THR H 1 22 ILE MD 4.570 . 4.570 3.811 3.750 3.881 . 0 0 "[ . 1 . 2]" 1
494 1 63 ARG H 1 64 HIS H 3.320 . 3.320 2.587 2.453 2.695 . 0 0 "[ . 1 . 2]" 1
495 1 64 HIS H 1 65 ASN HD22 4.760 . 4.760 4.722 4.591 4.797 0.037 15 0 "[ . 1 . 2]" 1
496 1 61 SER HA 1 64 HIS H 3.750 . 3.750 3.586 3.367 3.749 . 0 0 "[ . 1 . 2]" 1
497 1 63 ARG HG2 1 64 HIS H 5.150 . 5.150 5.011 4.800 5.164 0.014 5 0 "[ . 1 . 2]" 1
498 1 62 ILE MG 1 64 HIS H 4.770 . 4.770 4.447 4.329 4.549 . 0 0 "[ . 1 . 2]" 1
499 1 18 ILE MD 1 64 HIS H 5.450 . 5.450 5.481 5.439 5.536 0.086 20 0 "[ . 1 . 2]" 1
500 1 7 ASN HD21 1 11 ASN HB2 5.290 . 5.290 4.454 2.356 5.264 . 0 0 "[ . 1 . 2]" 1
501 1 7 ASN HD21 1 8 ALA MB 5.500 . 5.500 5.521 5.110 5.754 0.254 10 0 "[ . 1 . 2]" 1
502 1 7 ASN HD22 1 11 ASN HB2 5.500 . 5.500 4.437 2.419 5.551 0.051 8 0 "[ . 1 . 2]" 1
503 1 9 TRP H 1 9 TRP HB2 3.870 . 3.870 3.830 3.700 3.935 0.065 4 0 "[ . 1 . 2]" 1
504 1 9 TRP H 1 9 TRP HB3 3.870 . 3.870 3.237 2.724 3.586 . 0 0 "[ . 1 . 2]" 1
505 1 9 TRP H 1 11 ASN HB2 4.860 . 4.860 4.683 4.091 4.943 0.083 8 0 "[ . 1 . 2]" 1
506 1 8 ALA MB 1 9 TRP H 3.750 . 3.750 3.463 3.244 3.566 . 0 0 "[ . 1 . 2]" 1
507 1 9 TRP HE1 1 10 GLY H 5.170 . 5.170 4.705 3.892 5.252 0.082 7 0 "[ . 1 . 2]" 1
508 1 9 TRP H 1 10 GLY H 3.490 . 3.490 2.009 1.722 2.418 . 0 0 "[ . 1 . 2]" 1
509 1 9 TRP HA 1 10 GLY H 3.570 . 3.570 3.414 3.208 3.540 . 0 0 "[ . 1 . 2]" 1
510 1 9 TRP HB2 1 10 GLY H 4.500 . 4.500 3.898 3.161 4.360 . 0 0 "[ . 1 . 2]" 1
511 1 9 TRP HB3 1 10 GLY H 4.500 . 4.500 4.131 3.722 4.497 . 0 0 "[ . 1 . 2]" 1
512 1 10 GLY H 1 11 ASN HB2 4.300 . 4.300 3.991 3.564 4.313 0.013 4 0 "[ . 1 . 2]" 1
513 1 8 ALA MB 1 10 GLY H 5.010 . 5.010 4.912 4.526 5.159 0.149 15 0 "[ . 1 . 2]" 1
514 1 11 ASN HA 1 11 ASN HD21 3.730 . 3.730 2.342 1.759 3.677 . 0 0 "[ . 1 . 2]" 1
515 1 11 ASN HB3 1 11 ASN HD21 3.550 . 3.550 3.025 2.345 3.527 . 0 0 "[ . 1 . 2]" 1
516 1 6 ARG QB 1 11 ASN HD22 4.270 . 4.270 3.770 2.776 4.338 0.068 3 0 "[ . 1 . 2]" 1
517 1 14 TYR H 1 16 ASP H 5.300 . 5.300 4.083 3.953 4.303 . 0 0 "[ . 1 . 2]" 1
518 1 14 TYR H 1 17 LEU H 5.500 . 5.500 4.760 4.661 4.852 . 0 0 "[ . 1 . 2]" 1
519 1 13 SER HA 1 14 TYR H 3.290 . 3.290 2.608 2.540 2.659 . 0 0 "[ . 1 . 2]" 1
520 1 13 SER HB2 1 14 TYR H 3.950 . 3.950 3.211 2.981 3.437 . 0 0 "[ . 1 . 2]" 1
521 1 13 SER HB3 1 14 TYR H 3.950 . 3.950 2.392 2.213 2.711 . 0 0 "[ . 1 . 2]" 1
522 1 14 TYR H 1 14 TYR HB2 3.450 . 3.450 2.630 2.488 2.766 . 0 0 "[ . 1 . 2]" 1
523 1 14 TYR H 1 14 TYR HB3 3.670 . 3.670 3.612 3.586 3.658 . 0 0 "[ . 1 . 2]" 1
524 1 17 LEU H 1 18 ILE H 3.230 . 3.230 2.723 2.623 2.797 . 0 0 "[ . 1 . 2]" 1
525 1 15 ALA H 1 17 LEU H 4.590 . 4.590 4.216 4.110 4.317 . 0 0 "[ . 1 . 2]" 1
526 1 13 SER H 1 17 LEU H 4.720 . 4.720 4.286 4.113 4.454 . 0 0 "[ . 1 . 2]" 1
527 1 17 LEU H 1 20 ARG H 4.870 . 4.870 4.501 4.412 4.577 . 0 0 "[ . 1 . 2]" 1
528 1 14 TYR HA 1 17 LEU H 4.110 . 4.110 3.433 3.222 3.668 . 0 0 "[ . 1 . 2]" 1
529 1 12 LEU HA 1 17 LEU H 5.460 . 5.460 5.333 4.998 5.485 0.025 1 0 "[ . 1 . 2]" 1
530 1 16 ASP HB2 1 17 LEU H 3.160 . 3.160 2.572 2.398 2.689 . 0 0 "[ . 1 . 2]" 1
531 1 16 ASP HB3 1 17 LEU H 3.690 . 3.690 3.562 3.399 3.713 0.023 14 0 "[ . 1 . 2]" 1
532 1 17 LEU H 1 17 LEU HB2 2.960 . 2.960 2.582 2.504 2.687 . 0 0 "[ . 1 . 2]" 1
533 1 17 LEU H 1 17 LEU HG 2.940 . 2.940 2.150 2.085 2.230 . 0 0 "[ . 1 . 2]" 1
534 1 17 LEU H 1 17 LEU HB3 3.640 . 3.640 3.595 3.562 3.628 . 0 0 "[ . 1 . 2]" 1
535 1 17 LEU H 1 18 ILE MD 5.430 . 5.430 5.017 4.901 5.153 . 0 0 "[ . 1 . 2]" 1
536 1 22 ILE H 1 23 GLU H 3.130 . 3.130 2.813 2.742 2.914 . 0 0 "[ . 1 . 2]" 1
537 1 23 GLU H 1 24 SER H 2.960 . 2.960 2.578 2.475 2.687 . 0 0 "[ . 1 . 2]" 1
538 1 19 THR HA 1 23 GLU H 4.330 . 4.330 3.843 3.465 4.016 . 0 0 "[ . 1 . 2]" 1
539 1 23 GLU H 1 23 GLU HG2 3.250 . 3.250 2.894 2.271 3.304 0.054 19 0 "[ . 1 . 2]" 1
540 1 23 GLU H 1 23 GLU HG3 3.220 . 3.220 2.818 2.314 3.337 0.117 9 0 "[ . 1 . 2]" 1
541 1 23 GLU H 1 23 GLU HB2 2.820 . 2.820 2.359 2.157 2.473 . 0 0 "[ . 1 . 2]" 1
542 1 22 ILE HB 1 23 GLU H 3.040 . 3.040 2.638 2.511 2.798 . 0 0 "[ . 1 . 2]" 1
543 1 19 THR MG 1 23 GLU H 4.060 . 4.060 3.846 3.739 3.972 . 0 0 "[ . 1 . 2]" 1
544 1 22 ILE MG 1 23 GLU H 3.430 . 3.430 3.294 3.160 3.441 0.011 19 0 "[ . 1 . 2]" 1
545 1 22 ILE QG 1 23 GLU H 4.560 . 4.560 4.146 4.116 4.208 . 0 0 "[ . 1 . 2]" 1
546 1 22 ILE MD 1 23 GLU H 5.060 . 5.060 4.611 4.557 4.708 . 0 0 "[ . 1 . 2]" 1
547 1 21 ALA MB 1 23 GLU H 4.750 . 4.750 4.453 4.342 4.531 . 0 0 "[ . 1 . 2]" 1
548 1 23 GLU H 1 24 SER QB 4.530 . 4.530 4.461 4.173 4.601 0.071 18 0 "[ . 1 . 2]" 1
549 1 25 SER H 1 28 LYS H 4.470 . 4.470 4.527 4.357 4.617 0.147 16 0 "[ . 1 . 2]" 1
550 1 22 ILE HA 1 25 SER H 4.000 . 4.000 3.846 3.691 3.986 . 0 0 "[ . 1 . 2]" 1
551 1 25 SER H 1 28 LYS QD 3.690 . 3.690 3.265 3.054 3.465 . 0 0 "[ . 1 . 2]" 1
552 1 22 ILE MG 1 25 SER H 4.390 . 4.390 4.424 4.370 4.475 0.085 19 0 "[ . 1 . 2]" 1
553 1 27 ASP H 1 29 ARG H 3.990 . 3.990 3.406 3.214 3.569 . 0 0 "[ . 1 . 2]" 1
554 1 26 PRO QD 1 27 ASP H 3.200 . 3.200 2.258 1.971 2.510 . 0 0 "[ . 1 . 2]" 1
555 1 27 ASP H 1 27 ASP HB2 3.910 . 3.910 2.645 2.387 2.923 . 0 0 "[ . 1 . 2]" 1
556 1 26 PRO HB2 1 27 ASP H 3.460 . 3.460 2.587 2.209 3.129 . 0 0 "[ . 1 . 2]" 1
557 1 27 ASP H 1 27 ASP HB3 3.910 . 3.910 3.044 2.573 3.762 . 0 0 "[ . 1 . 2]" 1
558 1 26 PRO QG 1 27 ASP H 3.300 . 3.300 2.554 2.079 2.906 . 0 0 "[ . 1 . 2]" 1
559 1 26 PRO HB3 1 27 ASP H 4.190 . 4.190 3.837 3.621 4.173 . 0 0 "[ . 1 . 2]" 1
560 1 27 ASP H 1 28 LYS HG2 5.180 . 5.180 4.841 4.569 5.019 . 0 0 "[ . 1 . 2]" 1
561 1 27 ASP H 1 29 ARG HG2 4.870 . 4.870 4.666 4.434 4.903 0.033 2 0 "[ . 1 . 2]" 1
562 1 27 ASP H 1 30 LEU MD1 5.420 . 5.420 3.552 3.122 3.771 . 0 0 "[ . 1 . 2]" 1
563 1 27 ASP H 1 30 LEU MD2 5.420 . 5.420 4.361 3.926 4.540 . 0 0 "[ . 1 . 2]" 1
564 1 29 ARG HE 1 85 TRP QB 5.050 . 5.050 5.044 4.490 5.144 0.094 4 0 "[ . 1 . 2]" 1
565 1 27 ASP HB2 1 29 ARG HE 4.800 . 4.800 3.535 2.054 4.159 . 0 0 "[ . 1 . 2]" 1
566 1 27 ASP HB3 1 29 ARG HE 4.800 . 4.800 2.730 1.754 3.225 . 0 0 "[ . 1 . 2]" 1
567 1 29 ARG HE 1 29 ARG HG2 3.730 . 3.730 2.350 2.117 2.757 . 0 0 "[ . 1 . 2]" 1
568 1 31 THR HB 1 32 LEU H 3.700 . 3.700 2.500 2.419 2.602 . 0 0 "[ . 1 . 2]" 1
569 1 32 LEU H 1 32 LEU HB2 3.910 . 3.910 2.149 2.070 2.306 . 0 0 "[ . 1 . 2]" 1
570 1 32 LEU H 1 32 LEU HB3 3.910 . 3.910 3.188 2.637 3.486 . 0 0 "[ . 1 . 2]" 1
571 1 32 LEU H 1 32 LEU MD1 4.940 . 4.940 4.100 3.822 4.246 . 0 0 "[ . 1 . 2]" 1
572 1 32 LEU H 1 32 LEU MD2 4.940 . 4.940 3.378 2.961 4.144 . 0 0 "[ . 1 . 2]" 1
573 1 32 LEU H 1 35 ILE MD 5.150 . 5.150 4.050 3.940 4.205 . 0 0 "[ . 1 . 2]" 1
574 1 31 THR H 1 33 SER H 4.990 . 4.990 4.869 4.660 5.017 0.027 12 0 "[ . 1 . 2]" 1
575 1 32 LEU H 1 33 SER H 3.530 . 3.530 2.535 2.327 2.609 . 0 0 "[ . 1 . 2]" 1
576 1 31 THR HA 1 33 SER H 4.250 . 4.250 4.173 4.075 4.277 0.027 12 0 "[ . 1 . 2]" 1
577 1 31 THR HB 1 33 SER H 3.540 . 3.540 2.938 2.847 3.029 . 0 0 "[ . 1 . 2]" 1
578 1 33 SER H 1 34 GLN HA 5.380 . 5.380 5.172 5.117 5.261 . 0 0 "[ . 1 . 2]" 1
579 1 33 SER H 1 33 SER QB 2.860 . 2.860 2.437 2.241 2.561 . 0 0 "[ . 1 . 2]" 1
580 1 33 SER H 1 34 GLN QG 4.650 . 4.650 3.907 3.801 4.024 . 0 0 "[ . 1 . 2]" 1
581 1 32 LEU HB2 1 33 SER H 3.670 . 3.670 3.436 3.307 3.728 0.058 9 0 "[ . 1 . 2]" 1
582 1 32 LEU HB3 1 33 SER H 3.670 . 3.670 3.149 2.836 3.516 . 0 0 "[ . 1 . 2]" 1
583 1 31 THR MG 1 33 SER H 4.380 . 4.380 4.241 4.077 4.363 . 0 0 "[ . 1 . 2]" 1
584 1 34 GLN HE22 1 34 GLN QG 3.660 . 3.660 3.472 3.454 3.491 . 0 0 "[ . 1 . 2]" 1
585 1 34 GLN QB 1 34 GLN HE22 4.400 . 4.400 3.181 3.129 3.231 . 0 0 "[ . 1 . 2]" 1
586 1 30 LEU HG 1 34 GLN HE22 4.520 . 4.520 4.563 4.518 4.601 0.081 6 0 "[ . 1 . 2]" 1
587 1 31 THR MG 1 34 GLN HE22 4.840 . 4.840 4.534 4.450 4.676 . 0 0 "[ . 1 . 2]" 1
588 1 31 THR H 1 34 GLN HE21 5.230 . 5.230 4.343 4.237 4.515 . 0 0 "[ . 1 . 2]" 1
589 1 34 GLN HA 1 34 GLN HE21 4.820 . 4.820 4.178 3.973 4.355 . 0 0 "[ . 1 . 2]" 1
590 1 30 LEU HG 1 34 GLN HE21 4.420 . 4.420 4.041 3.804 4.440 0.020 18 0 "[ . 1 . 2]" 1
591 1 31 THR MG 1 34 GLN HE21 5.060 . 5.060 4.930 4.803 5.073 0.013 4 0 "[ . 1 . 2]" 1
592 1 35 ILE H 1 36 TYR H 3.120 . 3.120 2.641 2.560 2.766 . 0 0 "[ . 1 . 2]" 1
593 1 34 GLN HA 1 36 TYR H 4.940 . 4.940 4.174 4.000 4.347 . 0 0 "[ . 1 . 2]" 1
594 1 33 SER HA 1 36 TYR H 3.940 . 3.940 3.527 3.432 3.768 . 0 0 "[ . 1 . 2]" 1
595 1 32 LEU HA 1 36 TYR H 4.190 . 4.190 3.735 3.466 3.891 . 0 0 "[ . 1 . 2]" 1
596 1 36 TYR H 1 36 TYR HB3 3.600 . 3.600 2.446 2.242 3.659 0.059 15 0 "[ . 1 . 2]" 1
597 1 36 TYR H 1 36 TYR HB2 3.600 . 3.600 2.635 2.323 2.899 . 0 0 "[ . 1 . 2]" 1
598 1 36 TYR H 1 37 GLU QG 4.000 . 4.000 4.040 4.015 4.067 0.067 14 0 "[ . 1 . 2]" 1
599 1 35 ILE HB 1 36 TYR H 3.040 . 3.040 2.591 2.468 2.861 . 0 0 "[ . 1 . 2]" 1
600 1 35 ILE QG 1 36 TYR H 4.210 . 4.210 4.041 3.948 4.218 0.008 15 0 "[ . 1 . 2]" 1
601 1 38 TRP H 1 38 TRP HE1 5.500 . 5.500 5.220 5.034 5.448 . 0 0 "[ . 1 . 2]" 1
602 1 25 SER HA 1 38 TRP HE1 5.280 . 5.280 4.450 3.571 5.027 . 0 0 "[ . 1 . 2]" 1
603 1 38 TRP HB2 1 38 TRP HE1 4.880 . 4.880 4.742 4.725 4.763 . 0 0 "[ . 1 . 2]" 1
604 1 38 TRP HB3 1 38 TRP HE1 5.140 . 5.140 5.171 5.141 5.193 0.053 10 0 "[ . 1 . 2]" 1
605 1 53 ASN H 1 53 ASN HD22 5.160 . 5.160 3.790 3.591 4.022 . 0 0 "[ . 1 . 2]" 1
606 1 53 ASN HA 1 53 ASN HD22 3.900 . 3.900 3.694 3.449 3.926 0.026 4 0 "[ . 1 . 2]" 1
607 1 52 SER QB 1 53 ASN HD22 5.500 . 5.500 5.278 4.573 5.593 0.093 19 0 "[ . 1 . 2]" 1
608 1 53 ASN QB 1 53 ASN HD22 3.620 . 3.620 3.434 3.285 3.501 . 0 0 "[ . 1 . 2]" 1
609 1 53 ASN HA 1 53 ASN HD21 3.280 . 3.280 2.580 1.818 3.376 0.096 15 0 "[ . 1 . 2]" 1
610 1 52 SER HA 1 53 ASN HD21 5.230 . 5.230 3.669 3.141 4.446 . 0 0 "[ . 1 . 2]" 1
611 1 60 ASN HA 1 60 ASN HD22 5.130 . 5.130 5.122 4.723 5.195 0.065 15 0 "[ . 1 . 2]" 1
612 1 57 GLY HA3 1 60 ASN HD22 5.280 . 5.280 4.569 3.986 5.406 0.126 15 0 "[ . 1 . 2]" 1
613 1 64 HIS H 1 65 ASN HD21 4.880 . 4.880 3.506 3.336 3.730 . 0 0 "[ . 1 . 2]" 1
614 1 65 ASN H 1 65 ASN HD21 4.480 . 4.480 2.095 1.849 2.254 . 0 0 "[ . 1 . 2]" 1
615 1 63 ARG H 1 65 ASN HD21 4.730 . 4.730 4.327 4.148 4.713 . 0 0 "[ . 1 . 2]" 1
616 1 65 ASN HD21 1 66 LEU H 4.930 . 4.930 4.182 4.059 4.316 . 0 0 "[ . 1 . 2]" 1
617 1 65 ASN HA 1 65 ASN HD21 4.160 . 4.160 3.530 2.655 3.850 . 0 0 "[ . 1 . 2]" 1
618 1 15 ALA MB 1 65 ASN HD21 5.370 . 5.370 5.196 4.982 5.403 0.033 9 0 "[ . 1 . 2]" 1
619 1 52 SER QB 1 53 ASN HD21 4.330 . 4.330 4.069 3.453 4.411 0.081 2 0 "[ . 1 . 2]" 1
620 1 15 ALA MB 1 65 ASN HD22 5.500 . 5.500 5.252 4.872 5.527 0.027 12 0 "[ . 1 . 2]" 1
621 1 77 ASN HA 1 77 ASN HD21 4.620 . 4.620 2.253 1.794 3.745 . 0 0 "[ . 1 . 2]" 1
622 1 77 ASN HD21 1 85 TRP QB 5.500 . 5.500 5.219 4.559 5.657 0.157 2 0 "[ . 1 . 2]" 1
623 1 77 ASN HD21 1 84 SER HA 5.040 . 5.040 3.516 2.381 4.194 . 0 0 "[ . 1 . 2]" 1
624 1 77 ASN HA 1 77 ASN HD22 4.760 . 4.760 3.594 3.303 4.229 . 0 0 "[ . 1 . 2]" 1
625 1 77 ASN HD22 1 84 SER HA 5.150 . 5.150 3.316 2.489 4.815 . 0 0 "[ . 1 . 2]" 1
626 1 77 ASN HD21 1 85 TRP HE1 3.800 . 3.800 2.550 1.952 3.487 . 0 0 "[ . 1 . 2]" 1
627 1 77 ASN HD22 1 85 TRP HE1 5.020 . 5.020 3.365 2.078 4.249 . 0 0 "[ . 1 . 2]" 1
628 1 77 ASN HA 1 85 TRP HE1 3.740 . 3.740 2.540 1.798 3.806 0.066 5 0 "[ . 1 . 2]" 1
629 1 85 TRP QB 1 85 TRP HE1 4.620 . 4.620 4.380 4.324 4.420 . 0 0 "[ . 1 . 2]" 1
630 1 29 ARG QD 1 85 TRP HE1 4.910 . 4.910 3.718 3.515 4.240 . 0 0 "[ . 1 . 2]" 1
631 1 29 ARG HB2 1 85 TRP HE1 5.500 . 5.500 5.552 5.448 5.622 0.122 2 0 "[ . 1 . 2]" 1
632 1 32 LEU H 1 86 TRP HE1 4.670 . 4.670 1.994 1.828 2.353 . 0 0 "[ . 1 . 2]" 1
633 1 32 LEU HB2 1 86 TRP HE1 4.480 . 4.480 2.357 1.659 2.863 . 0 0 "[ . 1 . 2]" 1
634 1 32 LEU HB3 1 86 TRP HE1 4.480 . 4.480 4.006 3.059 4.505 0.025 16 0 "[ . 1 . 2]" 1
635 1 32 LEU MD1 1 86 TRP HE1 4.850 . 4.850 4.374 2.654 4.954 0.104 4 0 "[ . 1 . 2]" 1
636 1 32 LEU MD2 1 86 TRP HE1 4.850 . 4.850 2.750 2.309 3.954 . 0 0 "[ . 1 . 2]" 1
637 1 35 ILE MD 1 86 TRP HE1 5.150 . 5.150 4.323 4.066 4.663 . 0 0 "[ . 1 . 2]" 1
638 1 28 LYS H 1 28 LYS HE2 4.480 . 4.480 4.533 4.512 4.550 0.070 16 0 "[ . 1 . 2]" 1
639 1 26 PRO HA 1 28 LYS H 4.510 . 4.510 4.303 4.121 4.523 0.013 12 0 "[ . 1 . 2]" 1
640 1 41 ARG H 1 41 ARG HD2 4.200 . 4.200 2.833 2.709 2.972 . 0 0 "[ . 1 . 2]" 1
641 1 46 PHE H 1 46 PHE HB3 3.640 . 3.640 3.433 3.040 3.582 . 0 0 "[ . 1 . 2]" 1
642 1 75 VAL HB 1 76 GLN H 3.840 . 3.840 3.910 3.858 3.982 0.142 20 0 "[ . 1 . 2]" 1
643 1 76 GLN H 1 76 GLN QG 3.990 . 3.990 2.885 2.078 3.995 0.005 1 0 "[ . 1 . 2]" 1
644 1 4 SER QB 1 5 ARG QB 4.580 . 4.580 4.130 3.539 4.680 0.100 17 0 "[ . 1 . 2]" 1
645 1 96 GLY QA 1 97 LYS HA 4.800 . 4.800 4.037 3.830 4.540 . 0 0 "[ . 1 . 2]" 1
646 1 4 SER QB 1 5 ARG HA 4.450 . 4.450 4.315 3.991 4.511 0.061 18 0 "[ . 1 . 2]" 1
647 1 100 ARG HA 1 100 ARG QG 3.850 . 3.850 2.842 2.240 3.376 . 0 0 "[ . 1 . 2]" 1
648 1 76 GLN HA 1 76 GLN QG 3.280 . 3.280 2.559 2.246 3.332 0.052 16 0 "[ . 1 . 2]" 1
649 1 5 ARG HA 1 5 ARG QD 4.240 . 4.240 3.828 2.042 4.346 0.106 11 0 "[ . 1 . 2]" 1
650 1 40 VAL HB 1 41 ARG HD2 3.920 . 3.920 3.521 3.457 3.598 . 0 0 "[ . 1 . 2]" 1
651 1 5 ARG QB 1 5 ARG QD 2.810 . 2.810 2.337 2.067 2.817 0.007 19 0 "[ . 1 . 2]" 1
652 1 40 VAL MG2 1 41 ARG HD2 4.900 . 4.900 4.966 4.928 5.004 0.104 19 0 "[ . 1 . 2]" 1
653 1 12 LEU MD1 1 20 ARG HD3 5.040 . 5.040 2.250 2.071 2.683 . 0 0 "[ . 1 . 2]" 1
654 1 6 ARG HA 1 6 ARG QD 4.620 . 4.620 4.389 4.179 4.582 . 0 0 "[ . 1 . 2]" 1
655 1 6 ARG HA 1 6 ARG QG 3.350 . 3.350 3.328 3.304 3.342 . 0 0 "[ . 1 . 2]" 1
656 1 6 ARG QG 1 8 ALA HA 4.580 . 4.580 3.375 2.689 4.582 0.002 10 0 "[ . 1 . 2]" 1
657 1 5 ARG HA 1 6 ARG QB 4.210 . 4.210 4.157 3.784 4.263 0.053 11 0 "[ . 1 . 2]" 1
658 1 5 ARG HA 1 6 ARG QG 4.220 . 4.220 3.908 3.378 4.235 0.015 3 0 "[ . 1 . 2]" 1
659 1 6 ARG QD 1 11 ASN HB3 3.980 . 3.980 2.509 1.858 2.999 . 0 0 "[ . 1 . 2]" 1
660 1 37 GLU QG 1 41 ARG HD3 4.890 . 4.890 4.740 4.463 4.911 0.021 14 0 "[ . 1 . 2]" 1
661 1 41 ARG HD3 1 41 ARG QG 2.670 . 2.670 2.161 2.145 2.191 . 0 0 "[ . 1 . 2]" 1
662 1 6 ARG QB 1 6 ARG QD 3.410 . 3.410 2.258 2.079 2.438 . 0 0 "[ . 1 . 2]" 1
663 1 6 ARG HA 1 7 ASN HA 4.520 . 4.520 4.336 4.221 4.390 . 0 0 "[ . 1 . 2]" 1
664 1 6 ARG QD 1 7 ASN HA 5.500 . 5.500 5.465 4.770 5.609 0.109 8 0 "[ . 1 . 2]" 1
665 1 7 ASN HA 1 8 ALA MB 4.420 . 4.420 3.833 3.640 4.018 . 0 0 "[ . 1 . 2]" 1
666 1 6 ARG QG 1 7 ASN HA 4.510 . 4.510 3.797 3.214 4.092 . 0 0 "[ . 1 . 2]" 1
667 1 18 ILE HB 1 22 ILE HB 5.040 . 5.040 5.017 4.924 5.068 0.028 16 0 "[ . 1 . 2]" 1
668 1 22 ILE HB 1 88 ILE HG12 4.570 . 4.570 4.065 3.802 4.287 . 0 0 "[ . 1 . 2]" 1
669 1 22 ILE HB 1 23 GLU HG3 4.630 . 4.630 3.988 3.336 4.666 0.036 7 0 "[ . 1 . 2]" 1
670 1 7 ASN HA 1 8 ALA HA 4.830 . 4.830 4.264 4.119 4.389 . 0 0 "[ . 1 . 2]" 1
671 1 6 ARG QD 1 8 ALA HA 5.260 . 5.260 3.971 3.143 5.037 . 0 0 "[ . 1 . 2]" 1
672 1 8 ALA MB 1 12 LEU MD2 4.120 . 4.120 2.595 2.116 3.762 . 0 0 "[ . 1 . 2]" 1
673 1 9 TRP HA 1 10 GLY HA2 4.540 . 4.540 4.440 4.345 4.531 . 0 0 "[ . 1 . 2]" 1
674 1 8 ALA HA 1 9 TRP HA 4.610 . 4.610 4.325 4.203 4.449 . 0 0 "[ . 1 . 2]" 1
675 1 9 TRP HA 1 10 GLY HA3 5.500 . 5.500 5.088 4.927 5.270 . 0 0 "[ . 1 . 2]" 1
676 1 9 TRP HA 1 9 TRP HB2 2.990 . 2.990 2.491 2.274 2.602 . 0 0 "[ . 1 . 2]" 1
677 1 9 TRP HA 1 9 TRP HB3 2.990 . 2.990 2.429 2.331 2.744 . 0 0 "[ . 1 . 2]" 1
678 1 9 TRP HA 1 12 LEU HG 4.760 . 4.760 3.475 2.364 4.782 0.022 10 0 "[ . 1 . 2]" 1
679 1 8 ALA MB 1 9 TRP HA 4.470 . 4.470 4.130 3.941 4.277 . 0 0 "[ . 1 . 2]" 1
680 1 9 TRP HA 1 12 LEU MD1 4.260 . 4.260 2.590 2.007 3.934 . 0 0 "[ . 1 . 2]" 1
681 1 10 GLY HA2 1 11 ASN HB2 5.500 . 5.500 5.334 4.864 5.585 0.085 7 0 "[ . 1 . 2]" 1
682 1 10 GLY HA2 1 45 TYR HB2 5.500 . 5.500 4.714 3.710 5.529 0.029 3 0 "[ . 1 . 2]" 1
683 1 11 ASN HA 1 12 LEU HA 4.930 . 4.930 4.664 4.381 4.802 . 0 0 "[ . 1 . 2]" 1
684 1 6 ARG QD 1 11 ASN HA 4.740 . 4.740 4.368 4.044 4.666 . 0 0 "[ . 1 . 2]" 1
685 1 10 GLY HA3 1 11 ASN HA 4.730 . 4.730 4.465 4.313 4.687 . 0 0 "[ . 1 . 2]" 1
686 1 11 ASN HA 1 11 ASN HB2 2.860 . 2.860 2.738 2.593 2.949 0.089 11 0 "[ . 1 . 2]" 1
687 1 11 ASN HA 1 11 ASN HB3 3.010 . 3.010 2.843 2.496 3.029 0.019 18 0 "[ . 1 . 2]" 1
688 1 6 ARG QB 1 11 ASN HA 4.940 . 4.940 4.470 4.160 4.768 . 0 0 "[ . 1 . 2]" 1
689 1 6 ARG QG 1 11 ASN HA 5.500 . 5.500 5.531 5.336 5.600 0.100 10 0 "[ . 1 . 2]" 1
690 1 11 ASN HA 1 12 LEU HB2 5.490 . 5.490 5.175 4.866 5.305 . 0 0 "[ . 1 . 2]" 1
691 1 8 ALA HA 1 11 ASN HB2 5.500 . 5.500 5.037 3.881 5.575 0.075 5 0 "[ . 1 . 2]" 1
692 1 60 ASN QB 1 63 ARG QB 5.320 . 5.320 4.569 4.145 4.927 . 0 0 "[ . 1 . 2]" 1
693 1 6 ARG QB 1 11 ASN HB2 4.490 . 4.490 2.887 1.937 3.724 . 0 0 "[ . 1 . 2]" 1
694 1 8 ALA HA 1 12 LEU HA 4.640 . 4.640 4.457 3.940 4.683 0.043 17 0 "[ . 1 . 2]" 1
695 1 6 ARG QD 1 12 LEU HA 4.800 . 4.800 3.269 2.461 4.138 . 0 0 "[ . 1 . 2]" 1
696 1 12 LEU HA 1 16 ASP HB2 4.180 . 4.180 3.124 2.722 3.402 . 0 0 "[ . 1 . 2]" 1
697 1 12 LEU HA 1 16 ASP HB3 4.520 . 4.520 3.641 3.231 4.012 . 0 0 "[ . 1 . 2]" 1
698 1 12 LEU HA 1 12 LEU MD2 4.000 . 4.000 2.157 2.047 3.289 . 0 0 "[ . 1 . 2]" 1
699 1 8 ALA MB 1 12 LEU HA 5.500 . 5.500 5.410 4.849 5.585 0.085 4 0 "[ . 1 . 2]" 1
700 1 12 LEU HB3 1 17 LEU HG 4.490 . 4.490 3.134 2.533 3.520 . 0 0 "[ . 1 . 2]" 1
701 1 12 LEU HB2 1 17 LEU HG 4.370 . 4.370 3.230 2.703 3.898 . 0 0 "[ . 1 . 2]" 1
702 1 12 LEU HB2 1 16 ASP HB3 4.600 . 4.600 4.173 3.934 4.422 . 0 0 "[ . 1 . 2]" 1
703 1 12 LEU HA 1 12 LEU HG 4.140 . 4.140 3.116 2.996 3.755 . 0 0 "[ . 1 . 2]" 1
704 1 12 LEU HB2 1 12 LEU MD1 3.360 . 3.360 2.301 2.204 3.199 . 0 0 "[ . 1 . 2]" 1
705 1 32 LEU MD1 1 63 ARG QD 4.660 . 4.660 4.258 2.533 4.736 0.076 18 0 "[ . 1 . 2]" 1
706 1 12 LEU MD1 1 16 ASP HB3 4.200 . 4.200 3.107 1.945 3.606 . 0 0 "[ . 1 . 2]" 1
707 1 12 LEU MD2 1 16 ASP HB3 4.200 . 4.200 2.180 1.943 4.315 0.115 10 0 "[ . 1 . 2]" 1
708 1 12 LEU MD2 1 16 ASP HB2 4.550 . 4.550 3.116 2.934 4.572 0.022 10 0 "[ . 1 . 2]" 1
709 1 9 TRP HA 1 12 LEU MD2 4.260 . 4.260 3.732 2.334 4.149 . 0 0 "[ . 1 . 2]" 1
710 1 12 LEU HB2 1 12 LEU MD2 3.360 . 3.360 3.137 2.196 3.200 . 0 0 "[ . 1 . 2]" 1
711 1 13 SER HA 1 13 SER HB3 3.020 . 3.020 2.379 2.317 2.469 . 0 0 "[ . 1 . 2]" 1
712 1 13 SER HA 1 16 ASP HB2 4.420 . 4.420 4.376 4.211 4.468 0.048 2 0 "[ . 1 . 2]" 1
713 1 12 LEU HB3 1 13 SER HA 5.290 . 5.290 4.818 4.713 5.002 . 0 0 "[ . 1 . 2]" 1
714 1 13 SER HA 1 17 LEU MD2 5.290 . 5.290 4.967 4.547 5.327 0.037 5 0 "[ . 1 . 2]" 1
715 1 13 SER HA 1 17 LEU MD1 5.290 . 5.290 4.237 3.739 4.490 . 0 0 "[ . 1 . 2]" 1
716 1 13 SER HA 1 13 SER HB2 3.020 . 3.020 3.018 2.992 3.030 0.010 3 0 "[ . 1 . 2]" 1
717 1 13 SER HB2 1 16 ASP HB2 5.250 . 5.250 3.602 3.452 3.800 . 0 0 "[ . 1 . 2]" 1
718 1 12 LEU HA 1 13 SER HB3 5.500 . 5.500 5.546 5.473 5.595 0.095 18 0 "[ . 1 . 2]" 1
719 1 12 LEU HA 1 13 SER HB2 5.500 . 5.500 4.699 4.493 4.952 . 0 0 "[ . 1 . 2]" 1
720 1 14 TYR HA 1 16 ASP HB2 5.500 . 5.500 5.122 4.863 5.375 . 0 0 "[ . 1 . 2]" 1
721 1 14 TYR HA 1 17 LEU HB2 3.480 . 3.480 2.924 2.749 3.058 . 0 0 "[ . 1 . 2]" 1
722 1 14 TYR HA 1 17 LEU HG 3.810 . 3.810 3.065 2.455 3.658 . 0 0 "[ . 1 . 2]" 1
723 1 14 TYR HA 1 15 ALA MB 5.110 . 5.110 4.972 4.934 5.016 . 0 0 "[ . 1 . 2]" 1
724 1 14 TYR HA 1 62 ILE MD 5.200 . 5.200 3.968 3.589 4.306 . 0 0 "[ . 1 . 2]" 1
725 1 14 TYR HA 1 18 ILE MD 4.710 . 4.710 4.631 4.463 4.738 0.028 11 0 "[ . 1 . 2]" 1
726 1 14 TYR HA 1 18 ILE QG 4.710 . 4.710 4.041 3.952 4.140 . 0 0 "[ . 1 . 2]" 1
727 1 11 ASN HB3 1 12 LEU HA 4.610 . 4.610 4.495 4.312 4.649 0.039 7 0 "[ . 1 . 2]" 1
728 1 14 TYR HB3 1 62 ILE MD 4.590 . 4.590 3.660 3.324 4.128 . 0 0 "[ . 1 . 2]" 1
729 1 14 TYR HB3 1 18 ILE MD 3.940 . 3.940 3.572 3.083 3.864 . 0 0 "[ . 1 . 2]" 1
730 1 73 MET QB 1 89 ASN HB3 4.600 . 4.600 4.016 3.704 4.421 . 0 0 "[ . 1 . 2]" 1
731 1 14 TYR HB2 1 18 ILE MD 4.810 . 4.810 3.951 3.765 4.191 . 0 0 "[ . 1 . 2]" 1
732 1 14 TYR HB2 1 62 ILE MD 5.500 . 5.500 5.036 4.691 5.454 . 0 0 "[ . 1 . 2]" 1
733 1 15 ALA HA 1 19 THR HB 5.500 . 5.500 5.337 5.057 5.438 . 0 0 "[ . 1 . 2]" 1
734 1 15 ALA HA 1 66 LEU HA 5.500 . 5.500 5.528 5.407 5.599 0.099 20 0 "[ . 1 . 2]" 1
735 1 14 TYR HB2 1 15 ALA HA 4.630 . 4.630 4.208 3.956 4.478 . 0 0 "[ . 1 . 2]" 1
736 1 15 ALA HA 1 65 ASN HB2 4.430 . 4.430 3.596 3.318 3.840 . 0 0 "[ . 1 . 2]" 1
737 1 15 ALA HA 1 65 ASN HB3 4.430 . 4.430 3.044 2.711 3.507 . 0 0 "[ . 1 . 2]" 1
738 1 15 ALA HA 1 62 ILE MD 5.370 . 5.370 5.142 4.799 5.399 0.029 6 0 "[ . 1 . 2]" 1
739 1 15 ALA HA 1 18 ILE MD 3.210 . 3.210 2.051 1.918 2.188 . 0 0 "[ . 1 . 2]" 1
740 1 15 ALA HA 1 18 ILE QG 4.490 . 4.490 2.247 2.098 2.435 . 0 0 "[ . 1 . 2]" 1
741 1 15 ALA MB 1 18 ILE MD 4.040 . 4.040 3.237 3.125 3.384 . 0 0 "[ . 1 . 2]" 1
742 1 15 ALA MB 1 18 ILE QG 4.750 . 4.750 3.771 3.655 3.911 . 0 0 "[ . 1 . 2]" 1
743 1 15 ALA MB 1 16 ASP HA 5.230 . 5.230 3.806 3.732 3.879 . 0 0 "[ . 1 . 2]" 1
744 1 15 ALA MB 1 71 ARG HD3 4.730 . 4.730 3.873 2.637 4.756 0.026 12 0 "[ . 1 . 2]" 1
745 1 16 ASP HA 1 17 LEU HA 4.940 . 4.940 4.789 4.746 4.855 . 0 0 "[ . 1 . 2]" 1
746 1 16 ASP HA 1 19 THR HB 4.490 . 4.490 2.374 2.268 2.589 . 0 0 "[ . 1 . 2]" 1
747 1 16 ASP HA 1 20 ARG HG2 4.700 . 4.700 4.222 4.036 4.351 . 0 0 "[ . 1 . 2]" 1
748 1 16 ASP HA 1 19 THR MG 3.710 . 3.710 3.239 2.912 3.421 . 0 0 "[ . 1 . 2]" 1
749 1 13 SER HB3 1 16 ASP HB2 5.250 . 5.250 4.956 4.804 5.124 . 0 0 "[ . 1 . 2]" 1
750 1 12 LEU HB3 1 16 ASP HB2 4.180 . 4.180 2.040 1.899 2.330 . 0 0 "[ . 1 . 2]" 1
751 1 12 LEU HB2 1 16 ASP HB2 4.050 . 4.050 3.630 3.501 3.891 . 0 0 "[ . 1 . 2]" 1
752 1 16 ASP HB3 1 17 LEU HG 5.500 . 5.500 4.576 4.282 4.865 . 0 0 "[ . 1 . 2]" 1
753 1 16 ASP HB3 1 20 ARG HG3 5.500 . 5.500 4.563 4.295 4.919 . 0 0 "[ . 1 . 2]" 1
754 1 12 LEU HB3 1 16 ASP HB3 4.140 . 4.140 2.468 2.207 2.695 . 0 0 "[ . 1 . 2]" 1
755 1 17 LEU HA 1 20 ARG HD2 4.500 . 4.500 4.563 4.504 4.629 0.129 1 0 "[ . 1 . 2]" 1
756 1 17 LEU HA 1 20 ARG HD3 4.500 . 4.500 4.359 4.107 4.525 0.025 3 0 "[ . 1 . 2]" 1
757 1 16 ASP HB2 1 17 LEU HA 4.330 . 4.330 4.262 4.103 4.334 0.004 13 0 "[ . 1 . 2]" 1
758 1 17 LEU HA 1 20 ARG HG3 3.140 . 3.140 2.787 2.461 3.175 0.035 3 0 "[ . 1 . 2]" 1
759 1 17 LEU HA 1 17 LEU MD2 3.900 . 3.900 2.161 2.093 2.220 . 0 0 "[ . 1 . 2]" 1
760 1 17 LEU HA 1 17 LEU MD1 3.900 . 3.900 3.901 3.872 3.918 0.018 1 0 "[ . 1 . 2]" 1
761 1 17 LEU HB2 1 43 VAL MG2 3.950 . 3.950 3.929 3.734 4.020 0.070 10 0 "[ . 1 . 2]" 1
762 1 17 LEU HB2 1 62 ILE MD 4.020 . 4.020 3.226 2.882 3.394 . 0 0 "[ . 1 . 2]" 1
763 1 14 TYR HA 1 17 LEU HB3 4.960 . 4.960 4.423 4.263 4.612 . 0 0 "[ . 1 . 2]" 1
764 1 17 LEU HB3 1 43 VAL MG2 4.190 . 4.190 2.533 2.386 2.625 . 0 0 "[ . 1 . 2]" 1
765 1 17 LEU HA 1 17 LEU HG 3.680 . 3.680 3.140 3.009 3.267 . 0 0 "[ . 1 . 2]" 1
766 1 17 LEU HG 1 44 PRO HD2 5.500 . 5.500 5.560 5.298 5.671 0.171 5 0 "[ . 1 . 2]" 1
767 1 17 LEU HB3 1 17 LEU MD1 3.490 . 3.490 2.413 2.344 2.479 . 0 0 "[ . 1 . 2]" 1
768 1 17 LEU MD2 1 45 TYR HB3 4.950 . 4.950 2.783 2.288 3.415 . 0 0 "[ . 1 . 2]" 1
769 1 17 LEU HB3 1 17 LEU MD2 3.490 . 3.490 2.343 2.256 2.409 . 0 0 "[ . 1 . 2]" 1
770 1 18 ILE HA 1 39 MET ME 3.450 . 3.450 2.524 2.059 3.503 0.053 14 0 "[ . 1 . 2]" 1
771 1 18 ILE HA 1 35 ILE MG 3.520 . 3.520 2.541 2.338 2.696 . 0 0 "[ . 1 . 2]" 1
772 1 18 ILE HA 1 22 ILE QG 4.350 . 4.350 3.762 3.693 3.824 . 0 0 "[ . 1 . 2]" 1
773 1 18 ILE HA 1 18 ILE QG 3.540 . 3.540 2.725 2.647 2.775 . 0 0 "[ . 1 . 2]" 1
774 1 18 ILE HA 1 18 ILE MG 3.040 . 3.040 2.208 2.184 2.232 . 0 0 "[ . 1 . 2]" 1
775 1 15 ALA HA 1 18 ILE HB 3.830 . 3.830 3.635 3.534 3.770 . 0 0 "[ . 1 . 2]" 1
776 1 15 ALA MB 1 18 ILE HB 4.910 . 4.910 4.674 4.574 4.863 . 0 0 "[ . 1 . 2]" 1
777 1 18 ILE HB 1 22 ILE MG 5.500 . 5.500 5.536 5.457 5.574 0.074 19 0 "[ . 1 . 2]" 1
778 1 18 ILE HB 1 18 ILE MD 3.370 . 3.370 2.469 2.375 2.530 . 0 0 "[ . 1 . 2]" 1
779 1 18 ILE HB 1 35 ILE MD 5.020 . 5.020 4.373 4.260 4.559 . 0 0 "[ . 1 . 2]" 1
780 1 18 ILE HB 1 66 LEU MD2 5.040 . 5.040 5.043 4.838 5.144 0.104 16 0 "[ . 1 . 2]" 1
781 1 18 ILE MG 1 32 LEU HA 5.240 . 5.240 4.712 4.458 4.893 . 0 0 "[ . 1 . 2]" 1
782 1 18 ILE MG 1 66 LEU HA 5.500 . 5.500 5.081 4.812 5.269 . 0 0 "[ . 1 . 2]" 1
783 1 15 ALA HA 1 18 ILE MG 4.590 . 4.590 4.373 4.274 4.478 . 0 0 "[ . 1 . 2]" 1
784 1 18 ILE MG 1 88 ILE HG13 4.790 . 4.790 4.229 4.064 4.407 . 0 0 "[ . 1 . 2]" 1
785 1 18 ILE MG 1 22 ILE HB 4.570 . 4.570 4.367 4.282 4.461 . 0 0 "[ . 1 . 2]" 1
786 1 18 ILE MG 1 66 LEU QB 4.810 . 4.810 4.770 4.553 4.861 0.051 16 0 "[ . 1 . 2]" 1
787 1 18 ILE MG 1 66 LEU HG 4.820 . 4.820 3.395 2.995 3.872 . 0 0 "[ . 1 . 2]" 1
788 1 18 ILE MG 1 35 ILE MG 3.450 . 3.450 1.963 1.842 2.114 . 0 0 "[ . 1 . 2]" 1
789 1 18 ILE MD 1 18 ILE MG 2.930 . 2.930 1.941 1.897 2.006 . 0 0 "[ . 1 . 2]" 1
790 1 18 ILE MG 1 35 ILE MD 3.170 . 3.170 2.063 1.950 2.251 . 0 0 "[ . 1 . 2]" 1
791 1 18 ILE MG 1 66 LEU MD2 3.790 . 3.790 3.037 2.833 3.196 . 0 0 "[ . 1 . 2]" 1
792 1 18 ILE MG 1 66 LEU MD1 3.790 . 3.790 2.119 1.927 2.316 . 0 0 "[ . 1 . 2]" 1
793 1 18 ILE QG 1 62 ILE MG 3.960 . 3.960 2.802 2.448 3.230 . 0 0 "[ . 1 . 2]" 1
794 1 18 ILE HA 1 18 ILE MD 4.020 . 4.020 3.951 3.861 3.992 . 0 0 "[ . 1 . 2]" 1
795 1 18 ILE MD 1 62 ILE HG12 4.310 . 4.310 2.353 1.995 2.797 . 0 0 "[ . 1 . 2]" 1
796 1 18 ILE MD 1 39 MET ME 4.290 . 4.290 4.322 4.116 4.457 0.167 19 0 "[ . 1 . 2]" 1
797 1 18 ILE MD 1 66 LEU QB 4.490 . 4.490 4.134 3.994 4.222 . 0 0 "[ . 1 . 2]" 1
798 1 18 ILE MD 1 66 LEU HG 4.150 . 4.150 3.218 2.741 3.766 . 0 0 "[ . 1 . 2]" 1
799 1 18 ILE MD 1 62 ILE MG 3.220 . 3.220 1.980 1.816 2.131 . 0 0 "[ . 1 . 2]" 1
800 1 18 ILE MD 1 66 LEU MD1 3.820 . 3.820 1.797 1.732 1.867 . 0 0 "[ . 1 . 2]" 1
801 1 19 THR HA 1 19 THR MG 3.080 . 3.080 2.647 2.566 2.861 . 0 0 "[ . 1 . 2]" 1
802 1 19 THR HB 1 20 ARG HA 5.350 . 5.350 4.480 4.294 4.929 . 0 0 "[ . 1 . 2]" 1
803 1 19 THR HB 1 88 ILE HG12 4.410 . 4.410 3.715 3.642 3.780 . 0 0 "[ . 1 . 2]" 1
804 1 19 THR HB 1 88 ILE MD 3.730 . 3.730 3.892 3.818 3.925 0.195 2 0 "[ . 1 . 2]" 1
805 1 19 THR HB 1 88 ILE MG 4.540 . 4.540 4.495 4.253 4.628 0.088 15 0 "[ . 1 . 2]" 1
806 1 18 ILE MG 1 19 THR HB 5.480 . 5.480 5.390 5.256 5.493 0.013 1 0 "[ . 1 . 2]" 1
807 1 19 THR MG 1 20 ARG HG2 4.140 . 4.140 3.699 3.191 3.922 . 0 0 "[ . 1 . 2]" 1
808 1 19 THR MG 1 20 ARG QB 4.120 . 4.120 4.251 4.113 4.311 0.191 11 0 "[ . 1 . 2]" 1
809 1 19 THR MG 1 23 GLU HB2 4.690 . 4.690 3.608 3.456 3.760 . 0 0 "[ . 1 . 2]" 1
810 1 19 THR MG 1 23 GLU HG2 3.690 . 3.690 3.353 2.938 3.705 0.015 14 0 "[ . 1 . 2]" 1
811 1 16 ASP HB3 1 19 THR MG 4.470 . 4.470 4.322 3.788 4.493 0.023 2 0 "[ . 1 . 2]" 1
812 1 19 THR MG 1 88 ILE MD 3.570 . 3.570 2.228 1.987 3.114 . 0 0 "[ . 1 . 2]" 1
813 1 19 THR MG 1 22 ILE MD 5.110 . 5.110 4.487 4.349 4.971 . 0 0 "[ . 1 . 2]" 1
814 1 20 ARG HA 1 20 ARG HD2 3.980 . 3.980 2.278 2.085 2.482 . 0 0 "[ . 1 . 2]" 1
815 1 20 ARG HA 1 20 ARG QB 2.710 . 2.710 2.341 2.296 2.388 . 0 0 "[ . 1 . 2]" 1
816 1 20 ARG HA 1 20 ARG HG2 3.240 . 3.240 3.237 3.084 3.319 0.079 3 0 "[ . 1 . 2]" 1
817 1 19 THR MG 1 20 ARG HA 3.530 . 3.530 2.955 2.873 3.024 . 0 0 "[ . 1 . 2]" 1
818 1 20 ARG QB 1 20 ARG HD2 3.720 . 3.720 3.015 2.802 3.163 . 0 0 "[ . 1 . 2]" 1
819 1 17 LEU HA 1 20 ARG QB 3.760 . 3.760 2.782 2.581 3.002 . 0 0 "[ . 1 . 2]" 1
820 1 20 ARG QB 1 43 VAL HA 4.380 . 4.380 4.161 3.862 4.435 0.055 5 0 "[ . 1 . 2]" 1
821 1 20 ARG QB 1 20 ARG HD3 3.720 . 3.720 3.504 3.468 3.529 . 0 0 "[ . 1 . 2]" 1
822 1 20 ARG QB 1 20 ARG HG2 2.510 . 2.510 2.293 2.217 2.349 . 0 0 "[ . 1 . 2]" 1
823 1 20 ARG HA 1 20 ARG HG3 3.910 . 3.910 3.810 3.756 3.867 . 0 0 "[ . 1 . 2]" 1
824 1 20 ARG HG2 1 43 VAL MG2 4.950 . 4.950 4.666 4.255 4.960 0.010 1 0 "[ . 1 . 2]" 1
825 1 12 LEU MD1 1 20 ARG HG2 4.480 . 4.480 2.771 2.442 3.975 . 0 0 "[ . 1 . 2]" 1
826 1 12 LEU MD2 1 20 ARG HG2 4.480 . 4.480 3.973 3.411 4.395 . 0 0 "[ . 1 . 2]" 1
827 1 12 LEU MD1 1 20 ARG HD2 5.040 . 5.040 3.581 3.357 4.066 . 0 0 "[ . 1 . 2]" 1
828 1 12 LEU MD2 1 20 ARG HD2 5.040 . 5.040 4.105 3.402 4.856 . 0 0 "[ . 1 . 2]" 1
829 1 21 ALA HA 1 39 MET QB 5.500 . 5.500 4.479 3.766 5.052 . 0 0 "[ . 1 . 2]" 1
830 1 21 ALA HA 1 38 TRP HB2 5.190 . 5.190 4.197 3.835 4.551 . 0 0 "[ . 1 . 2]" 1
831 1 21 ALA HA 1 24 SER QB 3.850 . 3.850 2.879 2.577 3.815 . 0 0 "[ . 1 . 2]" 1
832 1 21 ALA MB 1 22 ILE MG 5.500 . 5.500 4.827 4.740 4.879 . 0 0 "[ . 1 . 2]" 1
833 1 21 ALA MB 1 43 VAL MG1 5.500 . 5.500 4.994 4.762 5.279 . 0 0 "[ . 1 . 2]" 1
834 1 19 THR MG 1 21 ALA MB 5.500 . 5.500 5.561 5.539 5.590 0.090 15 0 "[ . 1 . 2]" 1
835 1 21 ALA MB 1 30 LEU HG 5.500 . 5.500 4.562 4.392 4.890 . 0 0 "[ . 1 . 2]" 1
836 1 21 ALA MB 1 30 LEU HB2 5.500 . 5.500 4.995 4.851 5.300 . 0 0 "[ . 1 . 2]" 1
837 1 17 LEU HB3 1 21 ALA MB 5.500 . 5.500 5.030 4.819 5.288 . 0 0 "[ . 1 . 2]" 1
838 1 21 ALA MB 1 39 MET ME 4.100 . 4.100 3.146 2.587 3.943 . 0 0 "[ . 1 . 2]" 1
839 1 20 ARG HG2 1 21 ALA MB 5.500 . 5.500 5.464 5.350 5.545 0.045 4 0 "[ . 1 . 2]" 1
840 1 21 ALA MB 1 41 ARG QB 5.500 . 5.500 5.175 5.027 5.431 . 0 0 "[ . 1 . 2]" 1
841 1 21 ALA MB 1 35 ILE QG 3.720 . 3.720 3.482 3.366 3.724 0.004 7 0 "[ . 1 . 2]" 1
842 1 18 ILE MG 1 21 ALA MB 4.470 . 4.470 3.779 3.670 3.887 . 0 0 "[ . 1 . 2]" 1
843 1 18 ILE HA 1 21 ALA MB 3.830 . 3.830 3.106 2.979 3.194 . 0 0 "[ . 1 . 2]" 1
844 1 21 ALA MB 1 22 ILE HA 4.320 . 4.320 3.707 3.636 3.760 . 0 0 "[ . 1 . 2]" 1
845 1 21 ALA MB 1 38 TRP HB3 3.970 . 3.970 2.411 2.217 2.580 . 0 0 "[ . 1 . 2]" 1
846 1 21 ALA MB 1 38 TRP HB2 4.000 . 4.000 2.457 2.236 2.658 . 0 0 "[ . 1 . 2]" 1
847 1 21 ALA MB 1 39 MET HA 4.360 . 4.360 2.214 2.045 2.440 . 0 0 "[ . 1 . 2]" 1
848 1 21 ALA HA 1 22 ILE HA 5.460 . 5.460 4.817 4.727 4.899 . 0 0 "[ . 1 . 2]" 1
849 1 22 ILE HA 1 28 LYS QD 5.500 . 5.500 4.493 4.251 4.671 . 0 0 "[ . 1 . 2]" 1
850 1 22 ILE HA 1 28 LYS HA 4.620 . 4.620 3.852 3.730 4.008 . 0 0 "[ . 1 . 2]" 1
851 1 22 ILE HA 1 25 SER HB2 4.480 . 4.480 3.223 2.703 4.083 . 0 0 "[ . 1 . 2]" 1
852 1 22 ILE HA 1 30 LEU HB2 4.770 . 4.770 4.132 3.899 4.307 . 0 0 "[ . 1 . 2]" 1
853 1 22 ILE HA 1 30 LEU HG 3.760 . 3.760 3.612 3.380 3.830 0.070 17 0 "[ . 1 . 2]" 1
854 1 22 ILE HA 1 88 ILE MD 4.340 . 4.340 4.346 4.203 4.392 0.052 2 0 "[ . 1 . 2]" 1
855 1 22 ILE HA 1 22 ILE MG 2.990 . 2.990 2.460 2.410 2.502 . 0 0 "[ . 1 . 2]" 1
856 1 22 ILE HA 1 35 ILE MG 4.620 . 4.620 4.476 4.239 4.663 0.043 15 0 "[ . 1 . 2]" 1
857 1 22 ILE HA 1 22 ILE QG 3.060 . 3.060 2.386 2.356 2.419 . 0 0 "[ . 1 . 2]" 1
858 1 19 THR HB 1 22 ILE HB 5.230 . 5.230 5.245 5.192 5.271 0.041 17 0 "[ . 1 . 2]" 1
859 1 21 ALA MB 1 22 ILE HB 5.220 . 5.220 4.310 4.189 4.418 . 0 0 "[ . 1 . 2]" 1
860 1 19 THR MG 1 22 ILE HB 4.810 . 4.810 4.063 3.908 4.491 . 0 0 "[ . 1 . 2]" 1
861 1 22 ILE MG 1 87 ILE MG 4.030 . 4.030 3.663 3.511 3.760 . 0 0 "[ . 1 . 2]" 1
862 1 22 ILE MG 1 30 LEU HG 5.160 . 5.160 4.738 4.524 4.849 . 0 0 "[ . 1 . 2]" 1
863 1 22 ILE MG 1 87 ILE QG 5.500 . 5.500 4.427 4.197 4.525 . 0 0 "[ . 1 . 2]" 1
864 1 22 ILE MG 1 28 LYS HG3 4.790 . 4.790 4.423 4.139 4.673 . 0 0 "[ . 1 . 2]" 1
865 1 22 ILE MG 1 28 LYS QD 4.120 . 4.120 2.949 2.617 3.229 . 0 0 "[ . 1 . 2]" 1
866 1 22 ILE MG 1 87 ILE HB 3.940 . 3.940 3.229 3.099 3.392 . 0 0 "[ . 1 . 2]" 1
867 1 22 ILE MG 1 88 ILE HA 5.070 . 5.070 4.648 4.375 4.785 . 0 0 "[ . 1 . 2]" 1
868 1 22 ILE MG 1 29 ARG HA 3.620 . 3.620 3.342 3.110 3.496 . 0 0 "[ . 1 . 2]" 1
869 1 22 ILE QG 1 22 ILE MG 3.090 . 3.090 2.289 2.244 2.320 . 0 0 "[ . 1 . 2]" 1
870 1 22 ILE MG 1 30 LEU MD2 4.520 . 4.520 2.322 2.155 2.389 . 0 0 "[ . 1 . 2]" 1
871 1 22 ILE MG 1 30 LEU MD1 4.520 . 4.520 4.427 4.314 4.491 . 0 0 "[ . 1 . 2]" 1
872 1 22 ILE QG 1 35 ILE QG 4.750 . 4.750 2.415 2.276 2.702 . 0 0 "[ . 1 . 2]" 1
873 1 18 ILE MG 1 22 ILE QG 4.650 . 4.650 2.656 2.538 2.761 . 0 0 "[ . 1 . 2]" 1
874 1 18 ILE HB 1 22 ILE QG 4.560 . 4.560 4.155 4.012 4.262 . 0 0 "[ . 1 . 2]" 1
875 1 21 ALA HA 1 22 ILE QG 5.500 . 5.500 5.070 4.994 5.144 . 0 0 "[ . 1 . 2]" 1
876 1 22 ILE QG 1 30 LEU HB3 5.500 . 5.500 4.746 4.521 4.945 . 0 0 "[ . 1 . 2]" 1
877 1 22 ILE MD 1 22 ILE MG 2.850 . 2.850 1.928 1.906 1.964 . 0 0 "[ . 1 . 2]" 1
878 1 22 ILE MD 1 66 LEU HG 5.070 . 5.070 4.354 4.059 4.581 . 0 0 "[ . 1 . 2]" 1
879 1 22 ILE MD 1 88 ILE MG 5.360 . 5.360 4.176 4.028 4.308 . 0 0 "[ . 1 . 2]" 1
880 1 22 ILE MD 1 87 ILE MG 4.800 . 4.800 4.222 4.060 4.339 . 0 0 "[ . 1 . 2]" 1
881 1 22 ILE MD 1 87 ILE QG 5.500 . 5.500 4.504 4.422 4.708 . 0 0 "[ . 1 . 2]" 1
882 1 22 ILE MD 1 88 ILE HG12 3.820 . 3.820 3.164 3.057 3.290 . 0 0 "[ . 1 . 2]" 1
883 1 18 ILE HB 1 22 ILE MD 3.810 . 3.810 2.901 2.799 2.946 . 0 0 "[ . 1 . 2]" 1
884 1 22 ILE MD 1 88 ILE HG13 2.880 . 2.880 2.113 2.016 2.260 . 0 0 "[ . 1 . 2]" 1
885 1 22 ILE MD 1 88 ILE HB 4.820 . 4.820 4.277 4.167 4.394 . 0 0 "[ . 1 . 2]" 1
886 1 22 ILE MD 1 87 ILE HB 4.760 . 4.760 4.155 3.972 4.383 . 0 0 "[ . 1 . 2]" 1
887 1 22 ILE MD 1 86 TRP HB3 4.360 . 4.360 4.059 3.842 4.236 . 0 0 "[ . 1 . 2]" 1
888 1 18 ILE HA 1 22 ILE MD 4.030 . 4.030 3.953 3.898 4.032 0.002 5 0 "[ . 1 . 2]" 1
889 1 22 ILE HA 1 22 ILE MD 4.020 . 4.020 3.832 3.820 3.850 . 0 0 "[ . 1 . 2]" 1
890 1 22 ILE MD 1 35 ILE MD 3.150 . 3.150 2.244 2.153 2.484 . 0 0 "[ . 1 . 2]" 1
891 1 18 ILE MG 1 22 ILE MD 3.070 . 3.070 2.026 1.939 2.123 . 0 0 "[ . 1 . 2]" 1
892 1 19 THR HB 1 22 ILE MD 4.820 . 4.820 4.883 4.864 4.901 0.081 10 0 "[ . 1 . 2]" 1
893 1 22 ILE MD 1 28 LYS HA 5.500 . 5.500 5.245 5.049 5.412 . 0 0 "[ . 1 . 2]" 1
894 1 22 ILE MD 1 29 ARG HA 5.340 . 5.340 4.464 4.305 4.581 . 0 0 "[ . 1 . 2]" 1
895 1 22 ILE MD 1 86 TRP HA 5.080 . 5.080 4.979 4.826 5.090 0.010 10 0 "[ . 1 . 2]" 1
896 1 22 ILE HB 1 22 ILE MD 3.310 . 3.310 2.412 2.375 2.452 . 0 0 "[ . 1 . 2]" 1
897 1 23 GLU HA 1 28 LYS HE2 3.970 . 3.970 2.884 2.469 3.251 . 0 0 "[ . 1 . 2]" 1
898 1 23 GLU HA 1 23 GLU HG2 3.640 . 3.640 2.420 2.316 2.558 . 0 0 "[ . 1 . 2]" 1
899 1 23 GLU HA 1 23 GLU HG3 3.580 . 3.580 3.411 3.195 3.635 0.055 16 0 "[ . 1 . 2]" 1
900 1 23 GLU HA 1 28 LYS QD 3.220 . 3.220 2.071 1.987 2.178 . 0 0 "[ . 1 . 2]" 1
901 1 23 GLU HA 1 28 LYS HG3 4.520 . 4.520 4.461 4.249 4.553 0.033 13 0 "[ . 1 . 2]" 1
902 1 23 GLU HA 1 28 LYS HG2 4.990 . 4.990 4.982 4.876 5.019 0.029 4 0 "[ . 1 . 2]" 1
903 1 23 GLU HA 1 88 ILE MD 4.250 . 4.250 4.125 3.774 4.299 0.049 5 0 "[ . 1 . 2]" 1
904 1 22 ILE MG 1 23 GLU HA 3.770 . 3.770 3.292 3.192 3.372 . 0 0 "[ . 1 . 2]" 1
905 1 22 ILE HB 1 23 GLU HA 4.610 . 4.610 4.426 4.380 4.469 . 0 0 "[ . 1 . 2]" 1
906 1 23 GLU HA 1 24 SER QB 5.330 . 5.330 5.222 5.014 5.365 0.035 16 0 "[ . 1 . 2]" 1
907 1 22 ILE HB 1 23 GLU HB2 4.860 . 4.860 4.738 4.494 4.885 0.025 12 0 "[ . 1 . 2]" 1
908 1 23 GLU HB2 1 88 ILE MD 4.820 . 4.820 4.266 3.848 4.536 . 0 0 "[ . 1 . 2]" 1
909 1 22 ILE MG 1 23 GLU HB2 5.180 . 5.180 4.857 4.721 5.005 . 0 0 "[ . 1 . 2]" 1
910 1 19 THR MG 1 23 GLU HB3 4.540 . 4.540 4.506 4.363 4.572 0.032 3 0 "[ . 1 . 2]" 1
911 1 23 GLU HB3 1 88 ILE MD 5.490 . 5.490 4.779 4.366 5.059 . 0 0 "[ . 1 . 2]" 1
912 1 23 GLU HG2 1 28 LYS HG3 5.500 . 5.500 5.250 4.753 5.524 0.024 9 0 "[ . 1 . 2]" 1
913 1 23 GLU HG2 1 88 ILE HG12 5.500 . 5.500 5.181 4.735 5.525 0.025 3 0 "[ . 1 . 2]" 1
914 1 23 GLU HG2 1 88 ILE MD 3.590 . 3.590 2.660 2.357 2.979 . 0 0 "[ . 1 . 2]" 1
915 1 22 ILE MG 1 23 GLU HG2 4.610 . 4.610 3.310 3.030 3.630 . 0 0 "[ . 1 . 2]" 1
916 1 23 GLU HG3 1 28 LYS QD 5.000 . 5.000 4.720 4.372 4.952 . 0 0 "[ . 1 . 2]" 1
917 1 23 GLU HG3 1 88 ILE HG12 5.380 . 5.380 4.883 4.238 5.438 0.058 1 0 "[ . 1 . 2]" 1
918 1 19 THR MG 1 23 GLU HG3 3.910 . 3.910 2.346 2.209 2.511 . 0 0 "[ . 1 . 2]" 1
919 1 23 GLU HG3 1 88 ILE MD 3.700 . 3.700 2.731 2.108 3.273 . 0 0 "[ . 1 . 2]" 1
920 1 22 ILE MG 1 23 GLU HG3 4.730 . 4.730 4.167 3.587 4.656 . 0 0 "[ . 1 . 2]" 1
921 1 20 ARG HA 1 23 GLU HG3 4.180 . 4.180 4.071 3.699 4.252 0.072 1 0 "[ . 1 . 2]" 1
922 1 24 SER HA 1 24 SER QB 2.580 . 2.580 2.366 2.184 2.456 . 0 0 "[ . 1 . 2]" 1
923 1 25 SER HA 1 26 PRO QD 2.530 . 2.530 2.413 2.362 2.517 . 0 0 "[ . 1 . 2]" 1
924 1 25 SER HA 1 26 PRO QG 4.360 . 4.360 4.162 4.056 4.376 0.016 9 0 "[ . 1 . 2]" 1
925 1 25 SER HA 1 26 PRO HB3 5.140 . 5.140 5.132 4.916 5.189 0.049 20 0 "[ . 1 . 2]" 1
926 1 25 SER HA 1 30 LEU HG 4.580 . 4.580 4.650 4.550 4.711 0.131 7 0 "[ . 1 . 2]" 1
927 1 25 SER HB3 1 30 LEU HG 3.680 . 3.680 2.978 2.738 3.348 . 0 0 "[ . 1 . 2]" 1
928 1 22 ILE MG 1 25 SER HB3 5.060 . 5.060 4.490 3.919 4.866 . 0 0 "[ . 1 . 2]" 1
929 1 25 SER HB2 1 30 LEU HG 3.680 . 3.680 3.366 2.804 3.725 0.045 11 0 "[ . 1 . 2]" 1
930 1 22 ILE MG 1 25 SER HB2 5.060 . 5.060 4.026 3.560 4.842 . 0 0 "[ . 1 . 2]" 1
931 1 73 MET QG 1 88 ILE HA 4.900 . 4.900 4.519 4.312 4.696 . 0 0 "[ . 1 . 2]" 1
932 1 73 MET QG 1 90 PRO HD3 4.860 . 4.860 4.047 3.447 4.527 . 0 0 "[ . 1 . 2]" 1
933 1 26 PRO QD 1 30 LEU HG 4.240 . 4.240 3.823 3.734 3.944 . 0 0 "[ . 1 . 2]" 1
934 1 26 PRO HA 1 27 ASP HA 4.650 . 4.650 4.556 4.480 4.657 0.007 18 0 "[ . 1 . 2]" 1
935 1 51 ASP HA 1 52 SER QB 5.500 . 5.500 5.084 4.501 5.486 . 0 0 "[ . 1 . 2]" 1
936 1 27 ASP HA 1 94 LYS QE 5.500 . 5.500 4.869 4.226 5.384 . 0 0 "[ . 1 . 2]" 1
937 1 26 PRO QG 1 27 ASP HA 5.050 . 5.050 5.018 4.602 5.082 0.032 7 0 "[ . 1 . 2]" 1
938 1 47 LYS QB 1 48 ASP HA 4.550 . 4.550 3.675 3.561 3.881 . 0 0 "[ . 1 . 2]" 1
939 1 27 ASP HA 1 94 LYS QD 4.660 . 4.660 4.548 4.358 4.728 0.068 6 0 "[ . 1 . 2]" 1
940 1 27 ASP HA 1 28 LYS HG3 5.050 . 5.050 5.090 5.031 5.127 0.077 2 0 "[ . 1 . 2]" 1
941 1 27 ASP HA 1 28 LYS HG2 4.460 . 4.460 3.407 3.350 3.500 . 0 0 "[ . 1 . 2]" 1
942 1 27 ASP HB2 1 29 ARG HG2 4.180 . 4.180 3.660 2.244 4.264 0.084 11 0 "[ . 1 . 2]" 1
943 1 27 ASP HB3 1 29 ARG HG2 4.180 . 4.180 2.519 2.185 2.921 . 0 0 "[ . 1 . 2]" 1
944 1 28 LYS HA 1 28 LYS HE2 4.610 . 4.610 4.394 4.243 4.486 . 0 0 "[ . 1 . 2]" 1
945 1 28 LYS HA 1 87 ILE HB 5.350 . 5.350 4.963 4.720 5.163 . 0 0 "[ . 1 . 2]" 1
946 1 23 GLU HG2 1 28 LYS HA 5.500 . 5.500 5.394 4.999 5.556 0.056 12 0 "[ . 1 . 2]" 1
947 1 28 LYS HA 1 28 LYS QD 3.320 . 3.320 2.026 1.931 2.077 . 0 0 "[ . 1 . 2]" 1
948 1 22 ILE MG 1 28 LYS HA 3.460 . 3.460 2.474 2.273 2.624 . 0 0 "[ . 1 . 2]" 1
949 1 28 LYS HB2 1 94 LYS QD 3.050 . 3.050 2.138 1.953 2.423 . 0 0 "[ . 1 . 2]" 1
950 1 28 LYS HA 1 28 LYS HG3 3.920 . 3.920 3.807 3.754 3.851 . 0 0 "[ . 1 . 2]" 1
951 1 28 LYS HA 1 28 LYS HG2 3.700 . 3.700 3.245 3.191 3.283 . 0 0 "[ . 1 . 2]" 1
952 1 23 GLU HB3 1 28 LYS QD 4.880 . 4.880 4.044 3.771 4.331 . 0 0 "[ . 1 . 2]" 1
953 1 28 LYS HE3 1 28 LYS HG3 3.960 . 3.960 3.049 2.840 3.282 . 0 0 "[ . 1 . 2]" 1
954 1 28 LYS HE3 1 28 LYS HG2 3.640 . 3.640 2.415 2.332 2.549 . 0 0 "[ . 1 . 2]" 1
955 1 23 GLU HA 1 28 LYS HE3 4.490 . 4.490 4.261 3.992 4.508 0.018 12 0 "[ . 1 . 2]" 1
956 1 28 LYS HA 1 28 LYS HE3 4.490 . 4.490 4.316 4.127 4.457 . 0 0 "[ . 1 . 2]" 1
957 1 28 LYS HE2 1 28 LYS HG2 3.890 . 3.890 3.646 3.585 3.744 . 0 0 "[ . 1 . 2]" 1
958 1 28 LYS HE2 1 28 LYS HG3 4.200 . 4.200 3.771 3.704 3.830 . 0 0 "[ . 1 . 2]" 1
959 1 29 ARG HA 1 87 ILE HA 3.760 . 3.760 3.308 3.173 3.415 . 0 0 "[ . 1 . 2]" 1
960 1 29 ARG HA 1 30 LEU HA 4.490 . 4.490 4.441 4.392 4.481 . 0 0 "[ . 1 . 2]" 1
961 1 28 LYS HA 1 29 ARG HA 4.750 . 4.750 4.288 4.211 4.378 . 0 0 "[ . 1 . 2]" 1
962 1 22 ILE HA 1 29 ARG HA 5.500 . 5.500 5.430 5.256 5.515 0.015 9 0 "[ . 1 . 2]" 1
963 1 29 ARG HA 1 85 TRP QB 4.460 . 4.460 3.312 3.220 3.388 . 0 0 "[ . 1 . 2]" 1
964 1 29 ARG HA 1 87 ILE HB 4.390 . 4.390 3.692 3.374 3.850 . 0 0 "[ . 1 . 2]" 1
965 1 29 ARG HA 1 29 ARG QD 4.360 . 4.360 4.276 4.197 4.383 0.023 17 0 "[ . 1 . 2]" 1
966 1 28 LYS HB2 1 29 ARG HA 5.170 . 5.170 4.788 4.663 4.857 . 0 0 "[ . 1 . 2]" 1
967 1 29 ARG HA 1 94 LYS QD 4.740 . 4.740 4.464 4.038 4.769 0.029 12 0 "[ . 1 . 2]" 1
968 1 29 ARG HA 1 29 ARG HG2 4.060 . 4.060 3.726 3.656 3.779 . 0 0 "[ . 1 . 2]" 1
969 1 29 ARG HA 1 87 ILE MG 3.090 . 3.090 1.920 1.833 2.063 . 0 0 "[ . 1 . 2]" 1
970 1 29 ARG HA 1 29 ARG HG3 3.820 . 3.820 3.769 3.686 3.834 0.014 7 0 "[ . 1 . 2]" 1
971 1 29 ARG HB3 1 75 VAL HB 4.260 . 4.260 3.714 3.427 3.899 . 0 0 "[ . 1 . 2]" 1
972 1 29 ARG HB3 1 87 ILE HB 4.210 . 4.210 3.945 3.410 4.186 . 0 0 "[ . 1 . 2]" 1
973 1 29 ARG HB3 1 85 TRP QB 4.650 . 4.650 3.089 2.971 3.199 . 0 0 "[ . 1 . 2]" 1
974 1 29 ARG HB3 1 94 LYS QG 4.450 . 4.450 2.364 1.939 3.123 . 0 0 "[ . 1 . 2]" 1
975 1 29 ARG HB2 1 85 TRP QB 4.180 . 4.180 1.745 1.685 1.813 . 0 0 "[ . 1 . 2]" 1
976 1 29 ARG HB2 1 87 ILE MG 3.670 . 3.670 2.786 2.517 3.052 . 0 0 "[ . 1 . 2]" 1
977 1 29 ARG HG2 1 87 ILE MG 3.680 . 3.680 3.658 3.468 3.747 0.067 12 0 "[ . 1 . 2]" 1
978 1 29 ARG HG2 1 30 LEU MD1 5.500 . 5.500 4.829 4.673 5.083 . 0 0 "[ . 1 . 2]" 1
979 1 29 ARG HG2 1 30 LEU MD2 5.500 . 5.500 4.784 4.610 4.927 . 0 0 "[ . 1 . 2]" 1
980 1 29 ARG HG2 1 94 LYS QG 3.530 . 3.530 2.858 2.300 3.649 0.119 2 0 "[ . 1 . 2]" 1
981 1 27 ASP HB2 1 29 ARG HG3 4.690 . 4.690 3.807 2.349 4.608 . 0 0 "[ . 1 . 2]" 1
982 1 29 ARG QD 1 85 TRP QB 4.740 . 4.740 2.678 2.476 2.884 . 0 0 "[ . 1 . 2]" 1
983 1 29 ARG QD 1 75 VAL HB 5.100 . 5.100 3.363 3.065 3.618 . 0 0 "[ . 1 . 2]" 1
984 1 17 LEU HB2 1 20 ARG HG2 5.180 . 5.180 5.109 4.994 5.181 0.001 1 0 "[ . 1 . 2]" 1
985 1 17 LEU HB2 1 39 MET ME 3.520 . 3.520 3.321 2.830 3.555 0.035 14 0 "[ . 1 . 2]" 1
986 1 29 ARG HB3 1 29 ARG QD 3.780 . 3.780 2.388 2.248 2.549 . 0 0 "[ . 1 . 2]" 1
987 1 29 ARG HB2 1 29 ARG QD 3.860 . 3.860 2.314 2.223 2.443 . 0 0 "[ . 1 . 2]" 1
988 1 30 LEU HA 1 34 GLN QG 4.210 . 4.210 3.137 2.998 3.333 . 0 0 "[ . 1 . 2]" 1
989 1 30 LEU HA 1 34 GLN QB 5.010 . 5.010 4.182 3.548 4.766 . 0 0 "[ . 1 . 2]" 1
990 1 30 LEU HA 1 31 THR MG 4.320 . 4.320 3.489 3.434 3.591 . 0 0 "[ . 1 . 2]" 1
991 1 29 ARG HG3 1 30 LEU HA 5.390 . 5.390 4.559 4.333 5.010 . 0 0 "[ . 1 . 2]" 1
992 1 30 LEU HA 1 30 LEU MD1 4.350 . 4.350 2.112 2.036 2.203 . 0 0 "[ . 1 . 2]" 1
993 1 30 LEU HA 1 30 LEU MD2 4.350 . 4.350 3.326 3.281 3.371 . 0 0 "[ . 1 . 2]" 1
994 1 30 LEU HB3 1 34 GLN QB 4.500 . 4.500 2.654 1.836 3.334 . 0 0 "[ . 1 . 2]" 1
995 1 22 ILE QG 1 30 LEU HB2 4.570 . 4.570 3.233 3.006 3.414 . 0 0 "[ . 1 . 2]" 1
996 1 30 LEU HB2 1 35 ILE QG 3.980 . 3.980 1.914 1.790 2.012 . 0 0 "[ . 1 . 2]" 1
997 1 30 LEU HB2 1 34 GLN QG 4.600 . 4.600 3.472 3.083 3.887 . 0 0 "[ . 1 . 2]" 1
998 1 26 PRO QG 1 30 LEU HG 5.400 . 5.400 5.446 5.416 5.488 0.088 19 0 "[ . 1 . 2]" 1
999 1 22 ILE QG 1 30 LEU HG 4.450 . 4.450 4.244 4.123 4.402 . 0 0 "[ . 1 . 2]" 1
1000 1 18 ILE MG 1 32 LEU MD2 4.670 . 4.670 3.848 3.204 4.718 0.048 18 0 "[ . 1 . 2]" 1
1001 1 32 LEU MD2 1 66 LEU MD1 3.940 . 3.940 2.934 2.338 3.585 . 0 0 "[ . 1 . 2]" 1
1002 1 32 LEU MD2 1 63 ARG QD 4.660 . 4.660 3.590 2.586 4.662 0.002 8 0 "[ . 1 . 2]" 1
1003 1 32 LEU MD2 1 63 ARG HG2 3.850 . 3.850 2.382 1.815 3.903 0.053 8 0 "[ . 1 . 2]" 1
1004 1 31 THR HA 1 32 LEU HA 4.650 . 4.650 4.361 4.290 4.429 . 0 0 "[ . 1 . 2]" 1
1005 1 31 THR HA 1 85 TRP QB 4.580 . 4.580 4.474 4.272 4.594 0.014 16 0 "[ . 1 . 2]" 1
1006 1 30 LEU HB3 1 31 THR HA 5.500 . 5.500 4.775 4.647 4.915 . 0 0 "[ . 1 . 2]" 1
1007 1 31 THR HA 1 35 ILE QG 5.500 . 5.500 4.271 4.164 4.427 . 0 0 "[ . 1 . 2]" 1
1008 1 31 THR HA 1 35 ILE MD 5.500 . 5.500 4.128 4.053 4.254 . 0 0 "[ . 1 . 2]" 1
1009 1 31 THR HA 1 31 THR HB 2.880 . 2.880 2.405 2.373 2.445 . 0 0 "[ . 1 . 2]" 1
1010 1 31 THR HB 1 84 SER QB 5.500 . 5.500 5.512 5.324 5.567 0.067 8 0 "[ . 1 . 2]" 1
1011 1 31 THR MG 1 34 GLN QB 4.320 . 4.320 4.349 4.297 4.396 0.076 6 0 "[ . 1 . 2]" 1
1012 1 31 THR MG 1 34 GLN QG 4.550 . 4.550 2.728 2.631 2.836 . 0 0 "[ . 1 . 2]" 1
1013 1 31 THR MG 1 85 TRP QB 3.950 . 3.950 4.015 3.969 4.061 0.111 13 0 "[ . 1 . 2]" 1
1014 1 31 THR MG 1 83 SER HA 5.050 . 5.050 4.425 2.788 5.089 0.039 13 0 "[ . 1 . 2]" 1
1015 1 31 THR HA 1 31 THR MG 3.000 . 3.000 2.456 2.375 2.502 . 0 0 "[ . 1 . 2]" 1
1016 1 32 LEU HA 1 35 ILE HB 3.500 . 3.500 2.289 2.074 2.599 . 0 0 "[ . 1 . 2]" 1
1017 1 32 LEU HA 1 32 LEU HG 3.980 . 3.980 3.543 2.504 3.714 . 0 0 "[ . 1 . 2]" 1
1018 1 32 LEU HA 1 32 LEU MD1 3.780 . 3.780 2.052 1.860 3.722 . 0 0 "[ . 1 . 2]" 1
1019 1 32 LEU HA 1 35 ILE MG 4.150 . 4.150 3.712 3.529 4.026 . 0 0 "[ . 1 . 2]" 1
1020 1 32 LEU HA 1 32 LEU MD2 3.780 . 3.780 2.601 2.041 3.677 . 0 0 "[ . 1 . 2]" 1
1021 1 32 LEU HG 1 63 ARG HG2 4.610 . 4.610 2.925 2.238 4.294 . 0 0 "[ . 1 . 2]" 1
1022 1 32 LEU MD1 1 62 ILE MG 3.210 . 3.210 1.898 1.778 2.580 . 0 0 "[ . 1 . 2]" 1
1023 1 18 ILE MG 1 32 LEU MD1 4.670 . 4.670 3.391 2.894 4.723 0.053 8 0 "[ . 1 . 2]" 1
1024 1 32 LEU MD1 1 66 LEU MD1 3.940 . 3.940 3.539 2.844 3.955 0.015 1 0 "[ . 1 . 2]" 1
1025 1 32 LEU MD1 1 66 LEU MD2 3.940 . 3.940 3.939 3.115 4.078 0.138 19 0 "[ . 1 . 2]" 1
1026 1 8 ALA MB 1 12 LEU MD1 4.120 . 4.120 3.719 2.762 4.128 0.008 3 0 "[ . 1 . 2]" 1
1027 1 32 LEU MD1 1 63 ARG HG2 3.850 . 3.850 3.439 2.004 3.786 . 0 0 "[ . 1 . 2]" 1
1028 1 12 LEU HA 1 12 LEU MD1 4.000 . 4.000 3.779 2.162 3.898 . 0 0 "[ . 1 . 2]" 1
1029 1 12 LEU MD1 1 16 ASP HB2 4.550 . 4.550 3.725 3.022 4.128 . 0 0 "[ . 1 . 2]" 1
1030 1 32 LEU MD2 1 66 LEU MD2 3.940 . 3.940 2.825 2.390 4.023 0.083 8 0 "[ . 1 . 2]" 1
1031 1 33 SER HA 1 33 SER QB 2.550 . 2.550 2.332 2.290 2.416 . 0 0 "[ . 1 . 2]" 1
1032 1 70 SER HA 1 70 SER QB 2.670 . 2.670 2.317 2.177 2.417 . 0 0 "[ . 1 . 2]" 1
1033 1 33 SER QB 1 34 GLN QB 4.330 . 4.330 4.192 3.820 4.427 0.097 17 0 "[ . 1 . 2]" 1
1034 1 31 THR MG 1 33 SER QB 4.400 . 4.400 4.051 3.848 4.356 . 0 0 "[ . 1 . 2]" 1
1035 1 34 GLN HA 1 37 GLU QG 2.930 . 2.930 1.871 1.788 2.036 . 0 0 "[ . 1 . 2]" 1
1036 1 34 GLN HA 1 34 GLN QG 3.370 . 3.370 3.134 2.959 3.255 . 0 0 "[ . 1 . 2]" 1
1037 1 34 GLN QB 1 37 GLU QG 3.720 . 3.720 3.204 3.065 3.378 . 0 0 "[ . 1 . 2]" 1
1038 1 30 LEU HB2 1 34 GLN QB 4.690 . 4.690 4.155 3.350 4.737 0.047 14 0 "[ . 1 . 2]" 1
1039 1 34 GLN QG 1 85 TRP QB 5.500 . 5.500 5.543 5.456 5.582 0.082 9 0 "[ . 1 . 2]" 1
1040 1 30 LEU HB3 1 34 GLN QG 4.320 . 4.320 2.017 1.724 2.477 . 0 0 "[ . 1 . 2]" 1
1041 1 30 LEU HG 1 34 GLN QG 4.410 . 4.410 3.995 3.669 4.476 0.066 7 0 "[ . 1 . 2]" 1
1042 1 35 ILE HA 1 38 TRP HB3 3.960 . 3.960 3.958 3.808 4.000 0.040 5 0 "[ . 1 . 2]" 1
1043 1 35 ILE HA 1 37 GLU QG 4.730 . 4.730 4.599 4.428 4.744 0.014 4 0 "[ . 1 . 2]" 1
1044 1 30 LEU HB3 1 35 ILE HA 4.530 . 4.530 3.816 3.590 4.104 . 0 0 "[ . 1 . 2]" 1
1045 1 30 LEU HB2 1 35 ILE HA 4.480 . 4.480 3.676 3.527 3.875 . 0 0 "[ . 1 . 2]" 1
1046 1 30 LEU HG 1 35 ILE HA 5.380 . 5.380 3.730 3.406 3.989 . 0 0 "[ . 1 . 2]" 1
1047 1 35 ILE HA 1 35 ILE MG 3.090 . 3.090 2.487 2.436 2.557 . 0 0 "[ . 1 . 2]" 1
1048 1 22 ILE QG 1 35 ILE HA 4.550 . 4.550 4.153 3.961 4.507 . 0 0 "[ . 1 . 2]" 1
1049 1 21 ALA MB 1 35 ILE HA 3.290 . 3.290 2.746 2.486 3.148 . 0 0 "[ . 1 . 2]" 1
1050 1 35 ILE HA 1 35 ILE QG 2.990 . 2.990 2.405 2.367 2.436 . 0 0 "[ . 1 . 2]" 1
1051 1 34 GLN HA 1 35 ILE HA 4.780 . 4.780 4.748 4.664 4.790 0.010 17 0 "[ . 1 . 2]" 1
1052 1 30 LEU HB2 1 35 ILE HB 4.680 . 4.680 4.458 4.351 4.643 . 0 0 "[ . 1 . 2]" 1
1053 1 21 ALA MB 1 35 ILE MG 3.120 . 3.120 2.082 1.912 2.381 . 0 0 "[ . 1 . 2]" 1
1054 1 35 ILE MD 1 35 ILE MG 2.800 . 2.800 1.970 1.923 2.017 . 0 0 "[ . 1 . 2]" 1
1055 1 18 ILE QG 1 35 ILE MG 4.350 . 4.350 3.826 3.686 3.971 . 0 0 "[ . 1 . 2]" 1
1056 1 35 ILE MG 1 62 ILE MD 3.880 . 3.880 3.249 3.018 3.427 . 0 0 "[ . 1 . 2]" 1
1057 1 18 ILE HB 1 35 ILE MG 4.630 . 4.630 4.200 3.995 4.366 . 0 0 "[ . 1 . 2]" 1
1058 1 35 ILE MG 1 39 MET ME 3.200 . 3.200 2.174 1.852 2.989 . 0 0 "[ . 1 . 2]" 1
1059 1 35 ILE MG 1 38 TRP HB3 5.390 . 5.390 4.835 4.560 5.048 . 0 0 "[ . 1 . 2]" 1
1060 1 35 ILE MG 1 39 MET HA 5.500 . 5.500 4.737 4.450 5.019 . 0 0 "[ . 1 . 2]" 1
1061 1 35 ILE MG 1 66 LEU MD1 5.120 . 5.120 4.345 4.111 4.510 . 0 0 "[ . 1 . 2]" 1
1062 1 35 ILE MG 1 66 LEU MD2 5.120 . 5.120 4.725 4.459 5.021 . 0 0 "[ . 1 . 2]" 1
1063 1 32 LEU MD2 1 35 ILE MD 4.680 . 4.680 2.739 2.322 4.242 . 0 0 "[ . 1 . 2]" 1
1064 1 35 ILE MD 1 66 LEU MD2 3.960 . 3.960 3.159 2.933 3.448 . 0 0 "[ . 1 . 2]" 1
1065 1 35 ILE MD 1 66 LEU MD1 3.960 . 3.960 3.657 3.422 3.852 . 0 0 "[ . 1 . 2]" 1
1066 1 22 ILE QG 1 35 ILE MD 3.440 . 3.440 2.547 2.439 2.689 . 0 0 "[ . 1 . 2]" 1
1067 1 22 ILE MG 1 35 ILE MD 4.550 . 4.550 4.121 4.004 4.349 . 0 0 "[ . 1 . 2]" 1
1068 1 32 LEU MD1 1 35 ILE MD 4.680 . 4.680 2.732 2.228 4.187 . 0 0 "[ . 1 . 2]" 1
1069 1 30 LEU HB2 1 35 ILE MD 3.900 . 3.900 2.894 2.795 3.036 . 0 0 "[ . 1 . 2]" 1
1070 1 32 LEU HB3 1 35 ILE MD 5.500 . 5.500 4.830 4.701 4.954 . 0 0 "[ . 1 . 2]" 1
1071 1 35 ILE HB 1 35 ILE MD 3.060 . 3.060 2.436 2.412 2.460 . 0 0 "[ . 1 . 2]" 1
1072 1 32 LEU HB2 1 35 ILE MD 5.500 . 5.500 4.355 3.695 4.625 . 0 0 "[ . 1 . 2]" 1
1073 1 35 ILE MD 1 86 TRP HB3 4.140 . 4.140 3.438 3.274 3.566 . 0 0 "[ . 1 . 2]" 1
1074 1 35 ILE MD 1 86 TRP HB2 4.140 . 4.140 2.075 1.916 2.229 . 0 0 "[ . 1 . 2]" 1
1075 1 22 ILE HA 1 35 ILE MD 4.710 . 4.710 4.646 4.515 4.719 0.009 11 0 "[ . 1 . 2]" 1
1076 1 35 ILE HA 1 35 ILE MD 3.850 . 3.850 3.850 3.821 3.867 0.017 13 0 "[ . 1 . 2]" 1
1077 1 32 LEU HA 1 35 ILE MD 3.450 . 3.450 2.371 2.219 2.565 . 0 0 "[ . 1 . 2]" 1
1078 1 37 GLU HA 1 40 VAL HA 5.500 . 5.500 5.339 5.099 5.516 0.016 3 0 "[ . 1 . 2]" 1
1079 1 37 GLU HA 1 41 ARG HD2 4.820 . 4.820 4.547 4.359 4.736 . 0 0 "[ . 1 . 2]" 1
1080 1 37 GLU HA 1 40 VAL HB 3.500 . 3.500 2.800 2.655 2.988 . 0 0 "[ . 1 . 2]" 1
1081 1 37 GLU HA 1 40 VAL MG2 3.450 . 3.450 2.895 2.609 3.098 . 0 0 "[ . 1 . 2]" 1
1082 1 39 MET ME 1 62 ILE HB 5.080 . 5.080 4.644 4.291 5.069 . 0 0 "[ . 1 . 2]" 1
1083 1 37 GLU QG 1 40 VAL MG2 5.270 . 5.270 5.195 5.002 5.307 0.037 11 0 "[ . 1 . 2]" 1
1084 1 37 GLU HA 1 37 GLU QG 3.470 . 3.470 3.289 3.256 3.315 . 0 0 "[ . 1 . 2]" 1
1085 1 39 MET ME 1 39 MET HG2 3.730 . 3.730 2.916 2.471 3.389 . 0 0 "[ . 1 . 2]" 1
1086 1 39 MET HG2 1 43 VAL MG1 5.130 . 5.130 3.906 3.229 4.706 . 0 0 "[ . 1 . 2]" 1
1087 1 35 ILE MG 1 39 MET HG2 4.290 . 4.290 3.781 2.838 4.420 0.130 16 0 "[ . 1 . 2]" 1
1088 1 39 MET ME 1 39 MET HG3 3.730 . 3.730 2.950 2.386 3.418 . 0 0 "[ . 1 . 2]" 1
1089 1 39 MET HG3 1 43 VAL MG1 5.130 . 5.130 4.038 3.021 4.736 . 0 0 "[ . 1 . 2]" 1
1090 1 35 ILE MG 1 39 MET HG3 4.290 . 4.290 3.606 2.912 4.376 0.086 2 0 "[ . 1 . 2]" 1
1091 1 39 MET QB 1 62 ILE MD 5.310 . 5.310 4.426 4.286 4.573 . 0 0 "[ . 1 . 2]" 1
1092 1 39 MET QB 1 43 VAL MG1 3.190 . 3.190 2.680 2.323 3.196 0.006 14 0 "[ . 1 . 2]" 1
1093 1 39 MET HA 1 39 MET HG2 4.000 . 4.000 2.925 2.139 3.805 . 0 0 "[ . 1 . 2]" 1
1094 1 39 MET HA 1 39 MET HG3 4.000 . 4.000 3.062 2.046 3.831 . 0 0 "[ . 1 . 2]" 1
1095 1 16 ASP HB3 1 17 LEU HA 4.530 . 4.530 4.297 4.101 4.484 . 0 0 "[ . 1 . 2]" 1
1096 1 38 TRP HB2 1 39 MET HA 5.370 . 5.370 4.700 4.599 4.763 . 0 0 "[ . 1 . 2]" 1
1097 1 17 LEU HA 1 44 PRO HD2 5.500 . 5.500 5.089 4.456 5.489 . 0 0 "[ . 1 . 2]" 1
1098 1 35 ILE HB 1 39 MET ME 4.630 . 4.630 4.208 3.931 4.647 0.017 19 0 "[ . 1 . 2]" 1
1099 1 35 ILE HA 1 39 MET ME 5.450 . 5.450 4.715 4.293 5.409 . 0 0 "[ . 1 . 2]" 1
1100 1 17 LEU HB3 1 39 MET ME 3.540 . 3.540 3.174 2.632 3.531 . 0 0 "[ . 1 . 2]" 1
1101 1 39 MET ME 1 59 LYS HB2 5.390 . 5.390 4.777 3.963 5.423 0.033 11 0 "[ . 1 . 2]" 1
1102 1 39 MET ME 1 62 ILE MD 3.440 . 3.440 1.835 1.761 1.955 . 0 0 "[ . 1 . 2]" 1
1103 1 39 MET ME 1 43 VAL MG2 4.530 . 4.530 3.703 3.368 4.018 . 0 0 "[ . 1 . 2]" 1
1104 1 18 ILE QG 1 39 MET ME 4.170 . 4.170 3.140 2.803 3.496 . 0 0 "[ . 1 . 2]" 1
1105 1 18 ILE MG 1 39 MET ME 3.960 . 3.960 3.157 2.850 3.742 . 0 0 "[ . 1 . 2]" 1
1106 1 17 LEU HA 1 39 MET ME 5.500 . 5.500 4.562 3.806 5.296 . 0 0 "[ . 1 . 2]" 1
1107 1 39 MET HA 1 39 MET ME 5.500 . 5.500 4.188 3.949 4.352 . 0 0 "[ . 1 . 2]" 1
1108 1 39 MET HA 1 40 VAL HA 5.450 . 5.450 4.793 4.678 4.861 . 0 0 "[ . 1 . 2]" 1
1109 1 40 VAL HA 1 41 ARG HD2 5.350 . 5.350 5.326 5.221 5.382 0.032 12 0 "[ . 1 . 2]" 1
1110 1 40 VAL HA 1 46 PHE HB3 3.600 . 3.600 3.416 2.910 3.669 0.069 5 0 "[ . 1 . 2]" 1
1111 1 39 MET QB 1 40 VAL HA 4.700 . 4.700 3.820 3.520 4.177 . 0 0 "[ . 1 . 2]" 1
1112 1 40 VAL HA 1 40 VAL MG2 3.190 . 3.190 2.412 2.376 2.447 . 0 0 "[ . 1 . 2]" 1
1113 1 40 VAL HB 1 43 VAL MG1 4.490 . 4.490 4.467 4.398 4.542 0.052 18 0 "[ . 1 . 2]" 1
1114 1 39 MET QB 1 40 VAL MG2 4.860 . 4.860 3.491 2.972 4.160 . 0 0 "[ . 1 . 2]" 1
1115 1 40 VAL MG2 1 46 PHE HB3 4.150 . 4.150 2.508 2.344 2.701 . 0 0 "[ . 1 . 2]" 1
1116 1 40 VAL MG2 1 50 GLY HA2 3.690 . 3.690 3.055 2.651 3.358 . 0 0 "[ . 1 . 2]" 1
1117 1 40 VAL MG2 1 43 VAL MG1 3.920 . 3.920 3.164 3.084 3.253 . 0 0 "[ . 1 . 2]" 1
1118 1 40 VAL MG2 1 43 VAL MG2 4.870 . 4.870 4.843 4.748 4.910 0.040 11 0 "[ . 1 . 2]" 1
1119 1 40 VAL MG1 1 47 LYS HD2 4.440 . 4.440 2.837 2.576 3.546 . 0 0 "[ . 1 . 2]" 1
1120 1 40 VAL MG1 1 46 PHE HB3 4.710 . 4.710 4.119 3.901 4.467 . 0 0 "[ . 1 . 2]" 1
1121 1 40 VAL HA 1 40 VAL MG1 3.080 . 3.080 2.408 2.371 2.444 . 0 0 "[ . 1 . 2]" 1
1122 1 40 VAL MG1 1 50 GLY HA3 3.640 . 3.640 2.823 2.489 3.053 . 0 0 "[ . 1 . 2]" 1
1123 1 37 GLU HA 1 40 VAL MG1 4.370 . 4.370 4.224 4.094 4.385 0.015 3 0 "[ . 1 . 2]" 1
1124 1 40 VAL MG1 1 50 GLY HA2 3.880 . 3.880 3.906 3.702 3.979 0.099 5 0 "[ . 1 . 2]" 1
1125 1 41 ARG HA 1 41 ARG HD2 4.130 . 4.130 2.297 2.143 2.428 . 0 0 "[ . 1 . 2]" 1
1126 1 41 ARG HA 1 41 ARG HD3 4.140 . 4.140 3.774 3.720 3.861 . 0 0 "[ . 1 . 2]" 1
1127 1 41 ARG HA 1 41 ARG QG 3.270 . 3.270 3.144 3.107 3.186 . 0 0 "[ . 1 . 2]" 1
1128 1 40 VAL MG1 1 41 ARG HA 3.870 . 3.870 3.830 3.669 3.902 0.032 7 0 "[ . 1 . 2]" 1
1129 1 41 ARG QB 1 41 ARG HD2 3.800 . 3.800 3.102 3.024 3.167 . 0 0 "[ . 1 . 2]" 1
1130 1 39 MET HA 1 41 ARG QB 4.370 . 4.370 4.422 4.319 4.468 0.098 3 0 "[ . 1 . 2]" 1
1131 1 40 VAL MG1 1 41 ARG QB 5.200 . 5.200 5.122 5.023 5.194 . 0 0 "[ . 1 . 2]" 1
1132 1 41 ARG QB 1 43 VAL MG1 5.310 . 5.310 5.159 5.046 5.281 . 0 0 "[ . 1 . 2]" 1
1133 1 37 GLU HA 1 41 ARG QG 5.050 . 5.050 4.191 4.049 4.334 . 0 0 "[ . 1 . 2]" 1
1134 1 39 MET HA 1 41 ARG QG 5.400 . 5.400 4.878 4.611 5.038 . 0 0 "[ . 1 . 2]" 1
1135 1 40 VAL MG1 1 41 ARG QG 5.030 . 5.030 4.821 4.692 4.970 . 0 0 "[ . 1 . 2]" 1
1136 1 21 ALA MB 1 41 ARG QG 5.120 . 5.120 5.155 5.097 5.226 0.106 2 0 "[ . 1 . 2]" 1
1137 1 41 ARG QB 1 41 ARG HD3 3.610 . 3.610 3.549 3.505 3.581 . 0 0 "[ . 1 . 2]" 1
1138 1 42 CYS HA 1 43 VAL MG1 4.790 . 4.790 4.821 4.782 4.851 0.061 1 0 "[ . 1 . 2]" 1
1139 1 22 ILE MG 1 28 LYS HB2 4.220 . 4.220 3.856 3.664 4.014 . 0 0 "[ . 1 . 2]" 1
1140 1 43 VAL HA 1 44 PRO HD3 3.000 . 3.000 2.244 2.197 2.291 . 0 0 "[ . 1 . 2]" 1
1141 1 43 VAL HA 1 44 PRO HD2 3.100 . 3.100 2.343 2.264 2.437 . 0 0 "[ . 1 . 2]" 1
1142 1 43 VAL HA 1 44 PRO QG 4.150 . 4.150 3.979 3.938 4.042 . 0 0 "[ . 1 . 2]" 1
1143 1 43 VAL HA 1 43 VAL MG2 3.220 . 3.220 2.277 2.241 2.302 . 0 0 "[ . 1 . 2]" 1
1144 1 40 VAL MG1 1 43 VAL MG1 3.980 . 3.980 3.495 3.381 3.586 . 0 0 "[ . 1 . 2]" 1
1145 1 39 MET ME 1 43 VAL MG1 4.590 . 4.590 4.307 3.769 4.597 0.007 2 0 "[ . 1 . 2]" 1
1146 1 20 ARG QB 1 43 VAL MG1 5.500 . 5.500 5.350 5.176 5.514 0.014 14 0 "[ . 1 . 2]" 1
1147 1 43 VAL MG1 1 46 PHE HB3 3.640 . 3.640 2.414 1.877 2.714 . 0 0 "[ . 1 . 2]" 1
1148 1 43 VAL MG1 1 44 PRO HD2 4.430 . 4.430 3.792 3.659 3.921 . 0 0 "[ . 1 . 2]" 1
1149 1 43 VAL MG1 1 44 PRO HD3 4.840 . 4.840 4.418 4.317 4.517 . 0 0 "[ . 1 . 2]" 1
1150 1 39 MET HA 1 43 VAL MG1 4.050 . 4.050 3.820 3.664 4.050 0.000 14 0 "[ . 1 . 2]" 1
1151 1 43 VAL MG1 1 44 PRO HA 4.360 . 4.360 3.870 3.718 4.084 . 0 0 "[ . 1 . 2]" 1
1152 1 43 VAL HA 1 43 VAL MG1 3.320 . 3.320 3.196 3.173 3.210 . 0 0 "[ . 1 . 2]" 1
1153 1 21 ALA MB 1 43 VAL MG2 4.920 . 4.920 4.727 4.436 4.946 0.026 14 0 "[ . 1 . 2]" 1
1154 1 20 ARG QB 1 43 VAL MG2 5.500 . 5.500 3.738 3.437 4.051 . 0 0 "[ . 1 . 2]" 1
1155 1 20 ARG HG3 1 43 VAL MG2 5.500 . 5.500 3.897 3.466 4.239 . 0 0 "[ . 1 . 2]" 1
1156 1 17 LEU HG 1 43 VAL MG2 4.390 . 4.390 4.152 4.074 4.218 . 0 0 "[ . 1 . 2]" 1
1157 1 43 VAL MG2 1 45 TYR HB3 4.710 . 4.710 2.640 2.379 2.870 . 0 0 "[ . 1 . 2]" 1
1158 1 43 VAL MG2 1 44 PRO HB2 5.350 . 5.350 4.671 4.385 4.868 . 0 0 "[ . 1 . 2]" 1
1159 1 43 VAL MG2 1 45 TYR HB2 4.280 . 4.280 3.540 3.205 3.899 . 0 0 "[ . 1 . 2]" 1
1160 1 43 VAL MG2 1 44 PRO HD2 3.780 . 3.780 2.001 1.907 2.116 . 0 0 "[ . 1 . 2]" 1
1161 1 39 MET HA 1 43 VAL MG2 4.870 . 4.870 4.234 4.078 4.356 . 0 0 "[ . 1 . 2]" 1
1162 1 43 VAL MG2 1 46 PHE HA 5.160 . 5.160 4.213 4.111 4.342 . 0 0 "[ . 1 . 2]" 1
1163 1 17 LEU HA 1 43 VAL MG2 4.130 . 4.130 3.368 2.959 3.561 . 0 0 "[ . 1 . 2]" 1
1164 1 44 PRO HA 1 47 LYS QB 3.740 . 3.740 3.613 2.656 3.814 0.074 11 0 "[ . 1 . 2]" 1
1165 1 44 PRO HA 1 47 LYS HD3 4.780 . 4.780 3.661 2.954 4.844 0.064 5 0 "[ . 1 . 2]" 1
1166 1 43 VAL MG2 1 44 PRO HA 4.740 . 4.740 4.296 4.224 4.379 . 0 0 "[ . 1 . 2]" 1
1167 1 90 PRO QB 1 93 GLY QA 4.910 . 4.910 4.415 3.536 4.974 0.064 5 0 "[ . 1 . 2]" 1
1168 1 10 GLY HA2 1 44 PRO HB3 4.420 . 4.420 4.219 3.456 4.486 0.066 4 0 "[ . 1 . 2]" 1
1169 1 9 TRP HA 1 44 PRO QG 3.980 . 3.980 3.767 2.765 4.072 0.092 17 0 "[ . 1 . 2]" 1
1170 1 43 VAL MG1 1 44 PRO QG 4.980 . 4.980 4.696 4.544 4.830 . 0 0 "[ . 1 . 2]" 1
1171 1 43 VAL MG2 1 44 PRO QG 4.580 . 4.580 3.345 3.237 3.479 . 0 0 "[ . 1 . 2]" 1
1172 1 43 VAL MG2 1 44 PRO HD3 3.980 . 3.980 3.226 3.129 3.330 . 0 0 "[ . 1 . 2]" 1
1173 1 9 TRP HA 1 44 PRO HD2 5.500 . 5.500 5.318 4.663 5.540 0.040 8 0 "[ . 1 . 2]" 1
1174 1 44 PRO HD2 1 45 TYR HB2 4.710 . 4.710 3.979 3.539 4.538 . 0 0 "[ . 1 . 2]" 1
1175 1 43 VAL MG2 1 45 TYR HA 5.500 . 5.500 4.273 4.132 4.414 . 0 0 "[ . 1 . 2]" 1
1176 1 44 PRO QG 1 45 TYR HB2 4.270 . 4.270 2.979 2.763 3.444 . 0 0 "[ . 1 . 2]" 1
1177 1 44 PRO HB3 1 45 TYR HB2 5.500 . 5.500 5.536 5.419 5.596 0.096 1 0 "[ . 1 . 2]" 1
1178 1 45 TYR HB3 1 46 PHE HA 4.720 . 4.720 4.218 4.155 4.279 . 0 0 "[ . 1 . 2]" 1
1179 1 44 PRO HB2 1 45 TYR HB3 5.500 . 5.500 5.196 4.741 5.513 0.013 5 0 "[ . 1 . 2]" 1
1180 1 17 LEU MD1 1 45 TYR HB3 4.950 . 4.950 2.377 2.114 2.548 . 0 0 "[ . 1 . 2]" 1
1181 1 46 PHE HA 1 49 LYS HB2 3.940 . 3.940 2.133 1.954 2.612 . 0 0 "[ . 1 . 2]" 1
1182 1 46 PHE HA 1 49 LYS HB3 4.090 . 4.090 3.697 3.577 3.917 . 0 0 "[ . 1 . 2]" 1
1183 1 46 PHE HA 1 49 LYS HG2 3.860 . 3.860 2.178 1.967 2.444 . 0 0 "[ . 1 . 2]" 1
1184 1 46 PHE HA 1 49 LYS HG3 3.520 . 3.520 2.979 2.540 3.269 . 0 0 "[ . 1 . 2]" 1
1185 1 43 VAL MG1 1 46 PHE HA 3.970 . 3.970 3.680 3.600 3.757 . 0 0 "[ . 1 . 2]" 1
1186 1 46 PHE HB3 1 49 LYS HB2 4.290 . 4.290 3.575 3.146 4.151 . 0 0 "[ . 1 . 2]" 1
1187 1 45 TYR HB3 1 46 PHE HB3 5.500 . 5.500 5.417 5.168 5.532 0.032 10 0 "[ . 1 . 2]" 1
1188 1 40 VAL HA 1 46 PHE HB2 4.310 . 4.310 3.991 3.626 4.369 0.059 11 0 "[ . 1 . 2]" 1
1189 1 45 TYR HB3 1 46 PHE HB2 4.530 . 4.530 3.993 3.754 4.207 . 0 0 "[ . 1 . 2]" 1
1190 1 46 PHE HB2 1 49 LYS HG2 5.050 . 5.050 4.970 4.749 5.077 0.027 3 0 "[ . 1 . 2]" 1
1191 1 40 VAL MG2 1 46 PHE HB2 4.530 . 4.530 3.803 3.567 4.111 . 0 0 "[ . 1 . 2]" 1
1192 1 40 VAL MG1 1 46 PHE HB2 5.500 . 5.500 5.146 4.866 5.457 . 0 0 "[ . 1 . 2]" 1
1193 1 40 VAL HA 1 47 LYS HA 3.910 . 3.910 3.620 3.306 3.844 . 0 0 "[ . 1 . 2]" 1
1194 1 47 LYS HA 1 47 LYS QE 4.460 . 4.460 4.067 3.541 4.195 . 0 0 "[ . 1 . 2]" 1
1195 1 47 LYS HA 1 47 LYS HD2 3.170 . 3.170 2.281 1.962 3.198 0.028 5 0 "[ . 1 . 2]" 1
1196 1 47 LYS HA 1 47 LYS HD3 3.620 . 3.620 2.841 1.842 3.191 . 0 0 "[ . 1 . 2]" 1
1197 1 47 LYS HA 1 47 LYS QG 3.130 . 3.130 2.712 2.592 2.991 . 0 0 "[ . 1 . 2]" 1
1198 1 40 VAL MG2 1 47 LYS HA 4.300 . 4.300 3.754 3.564 3.950 . 0 0 "[ . 1 . 2]" 1
1199 1 40 VAL MG1 1 47 LYS HA 3.270 . 3.270 2.420 2.260 2.690 . 0 0 "[ . 1 . 2]" 1
1200 1 44 PRO HB2 1 47 LYS QB 5.280 . 5.280 5.188 4.594 5.317 0.037 11 0 "[ . 1 . 2]" 1
1201 1 47 LYS QB 1 47 LYS HD3 3.480 . 3.480 2.607 2.381 3.047 . 0 0 "[ . 1 . 2]" 1
1202 1 44 PRO HA 1 47 LYS QG 3.730 . 3.730 3.532 2.446 3.854 0.124 4 0 "[ . 1 . 2]" 1
1203 1 87 ILE MG 1 94 LYS QG 3.890 . 3.890 2.251 1.771 2.970 . 0 0 "[ . 1 . 2]" 1
1204 1 87 ILE MD 1 94 LYS QG 4.290 . 4.290 3.000 1.884 3.742 . 0 0 "[ . 1 . 2]" 1
1205 1 40 VAL HA 1 47 LYS HD2 4.740 . 4.740 3.409 2.864 4.770 0.030 13 0 "[ . 1 . 2]" 1
1206 1 47 LYS QE 1 47 LYS QG 3.150 . 3.150 2.266 2.118 2.564 . 0 0 "[ . 1 . 2]" 1
1207 1 43 VAL HB 1 47 LYS QE 5.130 . 5.130 5.100 4.791 5.179 0.049 15 0 "[ . 1 . 2]" 1
1208 1 44 PRO HA 1 47 LYS QE 4.400 . 4.400 3.716 3.131 4.008 . 0 0 "[ . 1 . 2]" 1
1209 1 27 ASP HA 1 28 LYS HE3 4.590 . 4.590 4.540 4.188 4.704 0.114 10 0 "[ . 1 . 2]" 1
1210 1 48 ASP HA 1 49 LYS HD3 5.500 . 5.500 4.767 4.501 5.019 . 0 0 "[ . 1 . 2]" 1
1211 1 47 LYS QG 1 48 ASP HA 5.500 . 5.500 5.265 4.243 5.596 0.096 11 0 "[ . 1 . 2]" 1
1212 1 48 ASP HA 1 49 LYS HG2 5.500 . 5.500 5.261 5.140 5.379 . 0 0 "[ . 1 . 2]" 1
1213 1 49 LYS HA 1 54 SER HA 4.900 . 4.900 4.818 4.291 5.014 0.114 11 0 "[ . 1 . 2]" 1
1214 1 49 LYS HA 1 50 GLY HA2 4.720 . 4.720 4.678 4.562 4.750 0.030 1 0 "[ . 1 . 2]" 1
1215 1 49 LYS HA 1 49 LYS HE2 5.180 . 5.180 4.549 4.318 4.740 . 0 0 "[ . 1 . 2]" 1
1216 1 49 LYS HA 1 49 LYS HE3 5.180 . 5.180 4.976 4.570 5.093 . 0 0 "[ . 1 . 2]" 1
1217 1 49 LYS HA 1 49 LYS HG2 3.640 . 3.640 3.462 3.380 3.519 . 0 0 "[ . 1 . 2]" 1
1218 1 49 LYS HA 1 49 LYS HD2 3.490 . 3.490 3.069 2.930 3.202 . 0 0 "[ . 1 . 2]" 1
1219 1 49 LYS HA 1 49 LYS HD3 3.860 . 3.860 2.254 2.093 2.442 . 0 0 "[ . 1 . 2]" 1
1220 1 49 LYS HA 1 54 SER QB 3.260 . 3.260 1.983 1.813 2.232 . 0 0 "[ . 1 . 2]" 1
1221 1 49 LYS HB3 1 49 LYS HD2 4.010 . 4.010 2.728 2.643 2.795 . 0 0 "[ . 1 . 2]" 1
1222 1 49 LYS HB3 1 54 SER QB 3.890 . 3.890 2.257 1.964 2.547 . 0 0 "[ . 1 . 2]" 1
1223 1 49 LYS HE2 1 49 LYS HG3 3.870 . 3.870 3.101 2.912 3.859 . 0 0 "[ . 1 . 2]" 1
1224 1 49 LYS HA 1 49 LYS HG3 3.880 . 3.880 3.852 3.786 3.899 0.019 16 0 "[ . 1 . 2]" 1
1225 1 47 LYS HD3 1 47 LYS QG 2.700 . 2.700 2.329 2.261 2.421 . 0 0 "[ . 1 . 2]" 1
1226 1 49 LYS HD3 1 49 LYS HG2 2.950 . 2.950 2.505 2.431 2.574 . 0 0 "[ . 1 . 2]" 1
1227 1 49 LYS HD3 1 54 SER QB 3.870 . 3.870 2.831 2.602 3.085 . 0 0 "[ . 1 . 2]" 1
1228 1 40 VAL MG1 1 47 LYS HD3 4.090 . 4.090 3.742 2.546 4.121 0.031 4 0 "[ . 1 . 2]" 1
1229 1 43 VAL MG1 1 47 LYS HD3 4.530 . 4.530 2.628 2.186 3.322 . 0 0 "[ . 1 . 2]" 1
1230 1 49 LYS HB2 1 49 LYS HD2 4.060 . 4.060 3.832 3.765 3.881 . 0 0 "[ . 1 . 2]" 1
1231 1 49 LYS HD2 1 54 SER QB 4.110 . 4.110 2.165 1.947 2.406 . 0 0 "[ . 1 . 2]" 1
1232 1 49 LYS HE2 1 49 LYS HG2 3.940 . 3.940 2.393 2.223 3.626 . 0 0 "[ . 1 . 2]" 1
1233 1 49 LYS HE3 1 49 LYS HG2 3.940 . 3.940 2.983 2.346 3.152 . 0 0 "[ . 1 . 2]" 1
1234 1 49 LYS HE3 1 49 LYS HG3 3.870 . 3.870 2.662 2.491 3.030 . 0 0 "[ . 1 . 2]" 1
1235 1 40 VAL HA 1 50 GLY HA3 5.330 . 5.330 5.127 4.400 5.361 0.031 2 0 "[ . 1 . 2]" 1
1236 1 50 GLY HA2 1 51 ASP HA 4.720 . 4.720 4.567 4.403 4.689 . 0 0 "[ . 1 . 2]" 1
1237 1 51 ASP HA 1 52 SER HA 5.030 . 5.030 4.540 4.368 4.737 . 0 0 "[ . 1 . 2]" 1
1238 1 50 GLY HA3 1 51 ASP HA 4.730 . 4.730 4.432 4.280 4.549 . 0 0 "[ . 1 . 2]" 1
1239 1 27 ASP HA 1 28 LYS HB2 4.580 . 4.580 4.575 4.501 4.632 0.052 12 0 "[ . 1 . 2]" 1
1240 1 52 SER HA 1 52 SER QB 2.550 . 2.550 2.334 2.162 2.437 . 0 0 "[ . 1 . 2]" 1
1241 1 52 SER HA 1 53 ASN QB 4.850 . 4.850 4.767 4.571 4.925 0.075 9 0 "[ . 1 . 2]" 1
1242 1 54 SER QB 1 58 TRP HB2 3.770 . 3.770 3.768 3.499 3.854 0.084 15 0 "[ . 1 . 2]" 1
1243 1 49 LYS HB2 1 54 SER QB 3.830 . 3.830 3.685 3.422 3.869 0.039 17 0 "[ . 1 . 2]" 1
1244 1 49 LYS HG2 1 54 SER QB 4.240 . 4.240 4.131 3.987 4.254 0.014 3 0 "[ . 1 . 2]" 1
1245 1 52 SER QB 1 53 ASN HA 4.660 . 4.660 4.369 4.154 4.619 . 0 0 "[ . 1 . 2]" 1
1246 1 91 ASP HA 1 92 GLY QA 4.930 . 4.930 4.248 4.064 4.447 . 0 0 "[ . 1 . 2]" 1
1247 1 52 SER HA 1 53 ASN HA 4.400 . 4.400 4.327 4.218 4.413 0.013 17 0 "[ . 1 . 2]" 1
1248 1 53 ASN HA 1 53 ASN QB 2.610 . 2.610 2.430 2.348 2.473 . 0 0 "[ . 1 . 2]" 1
1249 1 90 PRO QG 1 91 ASP HA 4.710 . 4.710 4.692 4.547 4.737 0.027 8 0 "[ . 1 . 2]" 1
1250 1 53 ASN HA 1 56 ALA MB 4.540 . 4.540 4.149 3.567 4.566 0.026 17 0 "[ . 1 . 2]" 1
1251 1 53 ASN HA 1 54 SER HA 5.490 . 5.490 4.888 4.756 5.033 . 0 0 "[ . 1 . 2]" 1
1252 1 90 PRO HA 1 91 ASP HA 5.500 . 5.500 4.869 4.618 5.087 . 0 0 "[ . 1 . 2]" 1
1253 1 54 SER HA 1 54 SER QB 2.540 . 2.540 2.284 2.228 2.340 . 0 0 "[ . 1 . 2]" 1
1254 1 54 SER HA 1 58 TRP HB2 4.830 . 4.830 4.611 4.181 4.856 0.026 7 0 "[ . 1 . 2]" 1
1255 1 52 SER QB 1 53 ASN QB 3.920 . 3.920 3.796 3.490 4.010 0.090 19 0 "[ . 1 . 2]" 1
1256 1 56 ALA HA 1 60 ASN QB 5.020 . 5.020 3.841 3.106 5.080 0.060 14 0 "[ . 1 . 2]" 1
1257 1 53 ASN QB 1 56 ALA MB 4.590 . 4.590 4.313 3.758 4.625 0.035 9 0 "[ . 1 . 2]" 1
1258 1 56 ALA MB 1 57 GLY HA2 4.420 . 4.420 4.271 4.134 4.400 . 0 0 "[ . 1 . 2]" 1
1259 1 57 GLY HA3 1 60 ASN QB 5.060 . 5.060 5.013 4.857 5.156 0.096 3 0 "[ . 1 . 2]" 1
1260 1 57 GLY HA2 1 60 ASN QB 3.800 . 3.800 3.801 3.572 3.877 0.077 11 0 "[ . 1 . 2]" 1
1261 1 58 TRP HA 1 61 SER HB2 4.340 . 4.340 2.970 2.173 3.889 . 0 0 "[ . 1 . 2]" 1
1262 1 57 GLY HA3 1 58 TRP HB2 4.830 . 4.830 4.548 4.352 4.813 . 0 0 "[ . 1 . 2]" 1
1263 1 59 LYS HA 1 62 ILE HB 3.720 . 3.720 2.018 1.867 2.181 . 0 0 "[ . 1 . 2]" 1
1264 1 59 LYS HA 1 62 ILE HG12 5.190 . 5.190 4.514 4.136 4.912 . 0 0 "[ . 1 . 2]" 1
1265 1 59 LYS HA 1 62 ILE HG13 5.190 . 5.190 3.442 2.881 3.979 . 0 0 "[ . 1 . 2]" 1
1266 1 59 LYS HA 1 59 LYS HD2 4.960 . 4.960 4.404 3.708 5.058 0.098 10 0 "[ . 1 . 2]" 1
1267 1 59 LYS HA 1 62 ILE MG 4.140 . 4.140 3.229 2.926 3.476 . 0 0 "[ . 1 . 2]" 1
1268 1 59 LYS HA 1 59 LYS HD3 4.960 . 4.960 4.347 3.594 4.974 0.014 5 0 "[ . 1 . 2]" 1
1269 1 56 ALA MB 1 59 LYS HB3 5.500 . 5.500 4.532 4.033 5.078 . 0 0 "[ . 1 . 2]" 1
1270 1 59 LYS HB2 1 62 ILE MD 4.200 . 4.200 3.536 3.037 4.232 0.032 1 0 "[ . 1 . 2]" 1
1271 1 59 LYS HB2 1 63 ARG HG3 5.500 . 5.500 5.504 5.094 5.669 0.169 18 0 "[ . 1 . 2]" 1
1272 1 59 LYS HB3 1 59 LYS HE2 4.750 . 4.750 3.628 1.904 4.857 0.107 3 0 "[ . 1 . 2]" 1
1273 1 59 LYS HB2 1 62 ILE HB 4.190 . 4.190 4.032 3.889 4.229 0.039 14 0 "[ . 1 . 2]" 1
1274 1 56 ALA HA 1 59 LYS HB3 4.500 . 4.500 3.018 2.333 3.732 . 0 0 "[ . 1 . 2]" 1
1275 1 32 LEU HG 1 59 LYS HB2 5.360 . 5.360 4.988 3.851 5.610 0.250 8 0 "[ . 1 . 2]" 1
1276 1 59 LYS HB2 1 62 ILE MG 4.210 . 4.210 4.229 4.076 4.284 0.074 6 0 "[ . 1 . 2]" 1
1277 1 56 ALA MB 1 60 ASN QB 5.410 . 5.410 4.020 3.162 5.371 . 0 0 "[ . 1 . 2]" 1
1278 1 60 ASN QB 1 63 ARG HG3 5.290 . 5.290 4.603 4.171 5.206 . 0 0 "[ . 1 . 2]" 1
1279 1 60 ASN QB 1 61 SER HA 4.690 . 4.690 4.607 3.575 4.750 0.060 16 0 "[ . 1 . 2]" 1
1280 1 58 TRP HA 1 61 SER HB3 4.230 . 4.230 2.792 2.281 3.828 . 0 0 "[ . 1 . 2]" 1
1281 1 60 ASN QB 1 61 SER HB2 5.020 . 5.020 4.872 3.232 5.103 0.083 8 0 "[ . 1 . 2]" 1
1282 1 14 TYR HB3 1 62 ILE HA 3.610 . 3.610 3.025 2.531 3.451 . 0 0 "[ . 1 . 2]" 1
1283 1 18 ILE MD 1 62 ILE HA 3.480 . 3.480 3.035 2.673 3.270 . 0 0 "[ . 1 . 2]" 1
1284 1 62 ILE HA 1 62 ILE MG 3.160 . 3.160 2.899 2.833 2.995 . 0 0 "[ . 1 . 2]" 1
1285 1 62 ILE HA 1 62 ILE HG13 3.770 . 3.770 2.600 2.503 2.761 . 0 0 "[ . 1 . 2]" 1
1286 1 62 ILE HA 1 62 ILE HG12 3.770 . 3.770 2.387 2.299 2.449 . 0 0 "[ . 1 . 2]" 1
1287 1 18 ILE MG 1 62 ILE HA 5.420 . 5.420 5.180 4.930 5.395 . 0 0 "[ . 1 . 2]" 1
1288 1 32 LEU HG 1 62 ILE MG 4.110 . 4.110 3.505 3.269 3.658 . 0 0 "[ . 1 . 2]" 1
1289 1 62 ILE MG 1 66 LEU QB 4.380 . 4.380 4.323 4.122 4.402 0.022 7 0 "[ . 1 . 2]" 1
1290 1 32 LEU MD2 1 62 ILE MG 3.210 . 3.210 2.530 1.858 2.961 . 0 0 "[ . 1 . 2]" 1
1291 1 18 ILE MG 1 62 ILE MG 4.010 . 4.010 2.577 2.325 2.796 . 0 0 "[ . 1 . 2]" 1
1292 1 62 ILE MG 1 66 LEU MD2 4.300 . 4.300 3.628 3.352 3.894 . 0 0 "[ . 1 . 2]" 1
1293 1 62 ILE MG 1 66 LEU MD1 4.300 . 4.300 2.148 2.042 2.248 . 0 0 "[ . 1 . 2]" 1
1294 1 39 MET ME 1 62 ILE MG 4.160 . 4.160 3.505 3.356 3.783 . 0 0 "[ . 1 . 2]" 1
1295 1 62 ILE MG 1 63 ARG HG3 4.190 . 4.190 3.077 2.820 3.417 . 0 0 "[ . 1 . 2]" 1
1296 1 62 ILE MG 1 63 ARG QB 3.990 . 3.990 4.009 3.891 4.094 0.104 8 0 "[ . 1 . 2]" 1
1297 1 18 ILE MD 1 62 ILE HG13 4.310 . 4.310 3.846 3.506 4.226 . 0 0 "[ . 1 . 2]" 1
1298 1 18 ILE HA 1 62 ILE MD 4.270 . 4.270 3.419 3.266 3.632 . 0 0 "[ . 1 . 2]" 1
1299 1 59 LYS HA 1 62 ILE MD 3.890 . 3.890 2.557 2.188 3.111 . 0 0 "[ . 1 . 2]" 1
1300 1 62 ILE HA 1 62 ILE MD 3.730 . 3.730 3.715 3.677 3.738 0.008 8 0 "[ . 1 . 2]" 1
1301 1 17 LEU HA 1 62 ILE MD 5.500 . 5.500 5.547 5.349 5.618 0.118 1 0 "[ . 1 . 2]" 1
1302 1 32 LEU HA 1 62 ILE MD 5.500 . 5.500 5.590 5.528 5.633 0.133 14 0 "[ . 1 . 2]" 1
1303 1 62 ILE MD 1 62 ILE MG 2.950 . 2.950 1.803 1.681 1.907 . 0 0 "[ . 1 . 2]" 1
1304 1 18 ILE MD 1 62 ILE MD 3.450 . 3.450 3.148 2.762 3.477 0.027 17 0 "[ . 1 . 2]" 1
1305 1 18 ILE QG 1 62 ILE MD 4.150 . 4.150 2.263 2.075 2.500 . 0 0 "[ . 1 . 2]" 1
1306 1 18 ILE MG 1 62 ILE MD 4.620 . 4.620 2.762 2.596 2.926 . 0 0 "[ . 1 . 2]" 1
1307 1 62 ILE MD 1 66 LEU MD2 5.500 . 5.500 5.468 5.191 5.579 0.079 6 0 "[ . 1 . 2]" 1
1308 1 62 ILE MD 1 66 LEU MD1 5.500 . 5.500 4.043 3.896 4.206 . 0 0 "[ . 1 . 2]" 1
1309 1 63 ARG HA 1 64 HIS HA 4.830 . 4.830 4.761 4.703 4.841 0.011 18 0 "[ . 1 . 2]" 1
1310 1 63 ARG HA 1 63 ARG QD 4.310 . 4.310 4.103 3.897 4.247 . 0 0 "[ . 1 . 2]" 1
1311 1 63 ARG HA 1 63 ARG HG3 3.600 . 3.600 3.126 2.968 3.235 . 0 0 "[ . 1 . 2]" 1
1312 1 63 ARG HA 1 63 ARG HG2 3.570 . 3.570 2.550 2.425 2.635 . 0 0 "[ . 1 . 2]" 1
1313 1 63 ARG HA 1 66 LEU QB 3.730 . 3.730 3.077 2.369 3.381 . 0 0 "[ . 1 . 2]" 1
1314 1 32 LEU HG 1 63 ARG HA 5.500 . 5.500 4.841 4.341 5.636 0.136 9 0 "[ . 1 . 2]" 1
1315 1 63 ARG HA 1 66 LEU HG 5.500 . 5.500 5.052 4.759 5.303 . 0 0 "[ . 1 . 2]" 1
1316 1 32 LEU MD1 1 63 ARG HA 4.670 . 4.670 4.198 3.428 4.673 0.003 1 0 "[ . 1 . 2]" 1
1317 1 62 ILE MG 1 63 ARG HA 3.880 . 3.880 2.858 2.768 2.996 . 0 0 "[ . 1 . 2]" 1
1318 1 32 LEU MD2 1 63 ARG HA 4.670 . 4.670 3.129 2.677 4.466 . 0 0 "[ . 1 . 2]" 1
1319 1 18 ILE MG 1 63 ARG HA 5.500 . 5.500 5.358 5.095 5.509 0.009 19 0 "[ . 1 . 2]" 1
1320 1 63 ARG HA 1 66 LEU MD1 4.620 . 4.620 2.257 1.943 2.585 . 0 0 "[ . 1 . 2]" 1
1321 1 63 ARG HA 1 66 LEU MD2 4.620 . 4.620 3.468 2.856 3.953 . 0 0 "[ . 1 . 2]" 1
1322 1 63 ARG QB 1 63 ARG HG3 2.540 . 2.540 2.354 2.252 2.416 . 0 0 "[ . 1 . 2]" 1
1323 1 63 ARG HG2 1 66 LEU MD2 5.500 . 5.500 4.402 3.220 5.203 . 0 0 "[ . 1 . 2]" 1
1324 1 60 ASN HA 1 63 ARG HG2 5.380 . 5.380 4.411 3.997 5.114 . 0 0 "[ . 1 . 2]" 1
1325 1 60 ASN HA 1 63 ARG HG3 4.200 . 4.200 2.832 2.446 3.452 . 0 0 "[ . 1 . 2]" 1
1326 1 12 LEU MD2 1 20 ARG HD3 5.040 . 5.040 2.807 2.089 3.466 . 0 0 "[ . 1 . 2]" 1
1327 1 20 ARG HA 1 20 ARG HD3 3.980 . 3.980 3.808 3.698 3.906 . 0 0 "[ . 1 . 2]" 1
1328 1 18 ILE MD 1 65 ASN HB2 3.810 . 3.810 2.273 2.107 2.495 . 0 0 "[ . 1 . 2]" 1
1329 1 18 ILE MD 1 65 ASN HA 5.040 . 5.040 4.686 4.549 4.925 . 0 0 "[ . 1 . 2]" 1
1330 1 18 ILE MD 1 65 ASN HB3 3.810 . 3.810 2.934 2.731 3.278 . 0 0 "[ . 1 . 2]" 1
1331 1 66 LEU HA 1 72 PHE HB2 4.000 . 4.000 2.522 2.156 2.826 . 0 0 "[ . 1 . 2]" 1
1332 1 66 LEU HA 1 72 PHE HB3 4.000 . 4.000 3.271 2.898 3.608 . 0 0 "[ . 1 . 2]" 1
1333 1 66 LEU HA 1 66 LEU HG 3.800 . 3.800 2.454 2.379 2.515 . 0 0 "[ . 1 . 2]" 1
1334 1 62 ILE MG 1 66 LEU HA 5.500 . 5.500 5.433 5.265 5.566 0.066 14 0 "[ . 1 . 2]" 1
1335 1 18 ILE MD 1 66 LEU HA 4.010 . 4.010 3.805 3.556 3.967 . 0 0 "[ . 1 . 2]" 1
1336 1 66 LEU HA 1 66 LEU MD1 3.690 . 3.690 2.847 2.430 3.093 . 0 0 "[ . 1 . 2]" 1
1337 1 66 LEU HG 1 74 ARG HG2 5.500 . 5.500 5.116 4.618 5.518 0.018 12 0 "[ . 1 . 2]" 1
1338 1 66 LEU HG 1 74 ARG HG3 5.500 . 5.500 5.484 4.984 5.573 0.073 16 0 "[ . 1 . 2]" 1
1339 1 18 ILE HB 1 66 LEU MD1 5.040 . 5.040 3.908 3.489 4.227 . 0 0 "[ . 1 . 2]" 1
1340 1 63 ARG HG2 1 66 LEU MD1 5.500 . 5.500 3.999 3.324 4.418 . 0 0 "[ . 1 . 2]" 1
1341 1 18 ILE MD 1 66 LEU MD2 3.820 . 3.820 3.594 3.446 3.698 . 0 0 "[ . 1 . 2]" 1
1342 1 66 LEU HA 1 66 LEU MD2 3.690 . 3.690 3.712 3.622 3.775 0.085 1 0 "[ . 1 . 2]" 1
1343 1 67 SER HA 1 67 SER QB 2.690 . 2.690 2.317 2.170 2.374 . 0 0 "[ . 1 . 2]" 1
1344 1 66 LEU HA 1 67 SER HA 4.720 . 4.720 4.580 4.392 4.712 . 0 0 "[ . 1 . 2]" 1
1345 1 22 ILE HA 1 25 SER HB3 4.480 . 4.480 3.492 2.512 4.031 . 0 0 "[ . 1 . 2]" 1
1346 1 65 ASN HA 1 68 LEU HG 4.250 . 4.250 2.266 1.906 2.534 . 0 0 "[ . 1 . 2]" 1
1347 1 69 HIS QB 1 71 ARG HB2 4.490 . 4.490 2.696 2.132 4.380 . 0 0 "[ . 1 . 2]" 1
1348 1 69 HIS QB 1 71 ARG HB3 4.490 . 4.490 3.352 1.998 4.502 0.012 3 0 "[ . 1 . 2]" 1
1349 1 70 SER HA 1 89 ASN HB2 5.500 . 5.500 5.201 4.813 5.542 0.042 16 0 "[ . 1 . 2]" 1
1350 1 71 ARG HA 1 89 ASN HB3 3.550 . 3.550 2.809 2.586 3.123 . 0 0 "[ . 1 . 2]" 1
1351 1 71 ARG HA 1 88 ILE MG 4.300 . 4.300 3.998 3.866 4.278 . 0 0 "[ . 1 . 2]" 1
1352 1 71 ARG HB2 1 88 ILE MG 4.760 . 4.760 4.356 3.367 4.846 0.086 5 0 "[ . 1 . 2]" 1
1353 1 71 ARG HB3 1 88 ILE MG 4.760 . 4.760 3.642 2.907 4.796 0.036 2 0 "[ . 1 . 2]" 1
1354 1 71 ARG HB2 1 71 ARG HD3 3.980 . 3.980 3.182 2.898 3.843 . 0 0 "[ . 1 . 2]" 1
1355 1 74 ARG QB 1 74 ARG HD2 3.400 . 3.400 2.357 2.151 2.478 . 0 0 "[ . 1 . 2]" 1
1356 1 71 ARG HB3 1 71 ARG HD3 3.980 . 3.980 2.647 2.315 3.671 . 0 0 "[ . 1 . 2]" 1
1357 1 71 ARG HA 1 71 ARG HD3 5.090 . 5.090 4.578 4.274 4.897 . 0 0 "[ . 1 . 2]" 1
1358 1 71 ARG HA 1 71 ARG HD2 5.090 . 5.090 4.588 4.358 4.865 . 0 0 "[ . 1 . 2]" 1
1359 1 71 ARG HB2 1 71 ARG HD2 3.980 . 3.980 2.583 2.269 3.277 . 0 0 "[ . 1 . 2]" 1
1360 1 15 ALA MB 1 71 ARG HD2 4.730 . 4.730 3.948 3.015 4.739 0.009 6 0 "[ . 1 . 2]" 1
1361 1 71 ARG HB3 1 71 ARG HD2 3.980 . 3.980 2.882 2.366 3.105 . 0 0 "[ . 1 . 2]" 1
1362 1 72 PHE HA 1 88 ILE HA . . 3.000 1.981 1.911 2.022 . 0 0 "[ . 1 . 2]" 1
1363 1 66 LEU HA 1 72 PHE HA 5.380 . 5.380 5.157 4.878 5.419 0.039 12 0 "[ . 1 . 2]" 1
1364 1 72 PHE HA 1 89 ASN HB3 4.650 . 4.650 3.540 3.331 3.897 . 0 0 "[ . 1 . 2]" 1
1365 1 72 PHE HA 1 89 ASN HB2 4.560 . 4.560 3.085 2.705 3.347 . 0 0 "[ . 1 . 2]" 1
1366 1 72 PHE HA 1 88 ILE HB . . 4.500 4.644 4.595 4.679 0.179 4 0 "[ . 1 . 2]" 1
1367 1 72 PHE HA 1 88 ILE MD 5.340 . 5.340 5.351 5.300 5.391 0.051 8 0 "[ . 1 . 2]" 1
1368 1 72 PHE HA 1 88 ILE MG 4.200 . 4.200 3.245 3.034 3.444 . 0 0 "[ . 1 . 2]" 1
1369 1 72 PHE HB2 1 73 MET HA 4.930 . 4.930 4.438 4.293 4.629 . 0 0 "[ . 1 . 2]" 1
1370 1 72 PHE HB3 1 73 MET HA 4.930 . 4.930 4.137 3.956 4.353 . 0 0 "[ . 1 . 2]" 1
1371 1 73 MET HA 1 73 MET QG 3.420 . 3.420 3.346 3.297 3.399 . 0 0 "[ . 1 . 2]" 1
1372 1 73 MET HA 1 73 MET ME 4.600 . 4.600 4.255 4.131 4.466 . 0 0 "[ . 1 . 2]" 1
1373 1 73 MET QB 1 87 ILE QG 3.670 . 3.670 3.644 3.582 3.677 0.007 10 0 "[ . 1 . 2]" 1
1374 1 73 MET QB 1 87 ILE MD 4.250 . 4.250 3.978 3.826 4.176 . 0 0 "[ . 1 . 2]" 1
1375 1 73 MET QB 1 73 MET ME 3.200 . 3.200 2.042 1.927 2.242 . 0 0 "[ . 1 . 2]" 1
1376 1 73 MET ME 1 98 ALA MB 5.500 . 5.500 4.076 2.044 5.605 0.105 16 0 "[ . 1 . 2]" 1
1377 1 73 MET ME 1 87 ILE QG 4.280 . 4.280 3.651 3.133 3.991 . 0 0 "[ . 1 . 2]" 1
1378 1 73 MET ME 1 74 ARG QB 5.500 . 5.500 5.373 5.129 5.550 0.050 6 0 "[ . 1 . 2]" 1
1379 1 73 MET ME 1 87 ILE MG 4.600 . 4.600 4.304 3.628 4.636 0.036 12 0 "[ . 1 . 2]" 1
1380 1 73 MET ME 1 96 GLY QA 4.050 . 4.050 2.849 2.026 4.071 0.021 19 0 "[ . 1 . 2]" 1
1381 1 73 MET ME 1 75 VAL HA 4.260 . 4.260 4.277 4.078 4.362 0.102 19 0 "[ . 1 . 2]" 1
1382 1 74 ARG HA 1 86 TRP HA 3.220 . 3.220 2.496 2.349 2.615 . 0 0 "[ . 1 . 2]" 1
1383 1 74 ARG HA 1 74 ARG HD2 4.750 . 4.750 4.531 4.319 4.758 0.008 1 0 "[ . 1 . 2]" 1
1384 1 73 MET QB 1 74 ARG HA 5.330 . 5.330 4.538 4.391 4.636 . 0 0 "[ . 1 . 2]" 1
1385 1 74 ARG HA 1 75 VAL HB 5.500 . 5.500 4.025 3.799 4.292 . 0 0 "[ . 1 . 2]" 1
1386 1 74 ARG HA 1 87 ILE QG 5.070 . 5.070 4.182 3.948 4.451 . 0 0 "[ . 1 . 2]" 1
1387 1 74 ARG HA 1 75 VAL MG1 4.590 . 4.590 4.938 4.887 4.978 0.388 3 0 "[ . 1 . 2]" 1
1388 1 74 ARG HA 1 74 ARG HG2 3.640 . 3.640 2.677 2.529 2.955 . 0 0 "[ . 1 . 2]" 1
1389 1 74 ARG HA 1 74 ARG HG3 3.580 . 3.580 3.107 2.860 3.366 . 0 0 "[ . 1 . 2]" 1
1390 1 74 ARG HA 1 75 VAL HA 4.670 . 4.670 4.072 4.014 4.137 . 0 0 "[ . 1 . 2]" 1
1391 1 74 ARG HA 1 74 ARG HD3 4.750 . 4.750 4.670 4.436 4.822 0.072 7 0 "[ . 1 . 2]" 1
1392 1 74 ARG HG2 1 84 SER QB 5.500 . 5.500 5.399 4.742 5.551 0.051 14 0 "[ . 1 . 2]" 1
1393 1 74 ARG QB 1 74 ARG HD3 3.400 . 3.400 2.978 2.418 3.340 . 0 0 "[ . 1 . 2]" 1
1394 1 75 VAL HA 1 76 GLN HA 4.450 . 4.450 4.343 4.257 4.399 . 0 0 "[ . 1 . 2]" 1
1395 1 75 VAL HA 1 96 GLY QA 4.140 . 4.140 2.602 1.856 3.900 . 0 0 "[ . 1 . 2]" 1
1396 1 74 ARG QB 1 75 VAL HA 4.830 . 4.830 4.305 4.067 4.438 . 0 0 "[ . 1 . 2]" 1
1397 1 75 VAL HB 1 85 TRP QB 4.620 . 4.620 2.236 2.027 2.794 . 0 0 "[ . 1 . 2]" 1
1398 1 29 ARG HG2 1 75 VAL HB 5.500 . 5.500 5.523 5.366 5.627 0.127 11 0 "[ . 1 . 2]" 1
1399 1 74 ARG QB 1 75 VAL HB 5.500 . 5.500 5.099 4.919 5.342 . 0 0 "[ . 1 . 2]" 1
1400 1 75 VAL HB 1 87 ILE MG 4.670 . 4.670 3.119 2.765 3.326 . 0 0 "[ . 1 . 2]" 1
1401 1 75 VAL MG1 1 76 GLN QB 5.500 . 5.500 3.995 3.700 4.390 . 0 0 "[ . 1 . 2]" 1
1402 1 75 VAL MG1 1 85 TRP QB 4.470 . 4.470 3.087 2.747 3.691 . 0 0 "[ . 1 . 2]" 1
1403 1 75 VAL HA 1 75 VAL MG1 3.290 . 3.290 2.311 2.176 2.426 . 0 0 "[ . 1 . 2]" 1
1404 1 75 VAL MG1 1 76 GLN HA 5.500 . 5.500 3.754 3.545 3.945 . 0 0 "[ . 1 . 2]" 1
1405 1 75 VAL MG2 1 76 GLN QB 5.500 . 5.500 5.554 5.467 5.633 0.133 18 0 "[ . 1 . 2]" 1
1406 1 75 VAL MG2 1 85 TRP QB 4.470 . 4.470 3.529 3.287 4.126 . 0 0 "[ . 1 . 2]" 1
1407 1 75 VAL HA 1 75 VAL MG2 3.290 . 3.290 2.345 2.258 2.435 . 0 0 "[ . 1 . 2]" 1
1408 1 74 ARG HA 1 75 VAL MG2 4.590 . 4.590 2.991 2.815 3.227 . 0 0 "[ . 1 . 2]" 1
1409 1 75 VAL MG2 1 76 GLN HA 5.500 . 5.500 5.503 5.387 5.570 0.070 9 0 "[ . 1 . 2]" 1
1410 1 76 GLN QB 1 84 SER HA 5.230 . 5.230 4.385 3.629 5.102 . 0 0 "[ . 1 . 2]" 1
1411 1 63 ARG QB 1 63 ARG QD 3.380 . 3.380 2.299 2.079 2.394 . 0 0 "[ . 1 . 2]" 1
1412 1 60 ASN HA 1 63 ARG QB 4.360 . 4.360 3.582 3.170 3.971 . 0 0 "[ . 1 . 2]" 1
1413 1 63 ARG QB 1 64 HIS HA 4.620 . 4.620 3.962 3.810 4.112 . 0 0 "[ . 1 . 2]" 1
1414 1 78 GLU HA 1 79 GLY QA 4.240 . 4.240 4.191 3.756 4.295 0.055 7 0 "[ . 1 . 2]" 1
1415 1 78 GLU HA 1 78 GLU QG 3.160 . 3.160 2.678 2.271 3.273 0.113 12 0 "[ . 1 . 2]" 1
1416 1 15 ALA MB 1 65 ASN HA 4.980 . 4.980 4.270 3.958 4.670 . 0 0 "[ . 1 . 2]" 1
1417 1 78 GLU HB2 1 78 GLU QG 2.680 . 2.680 2.323 2.155 2.458 . 0 0 "[ . 1 . 2]" 1
1418 1 78 GLU HB3 1 78 GLU QG 2.680 . 2.680 2.271 2.125 2.393 . 0 0 "[ . 1 . 2]" 1
1419 1 80 THR HA 1 80 THR HB 2.660 . 2.660 2.550 2.432 2.832 0.172 8 0 "[ . 1 . 2]" 1
1420 1 79 GLY QA 1 80 THR MG 4.390 . 4.390 3.773 3.150 4.470 0.080 8 0 "[ . 1 . 2]" 1
1421 1 80 THR HA 1 80 THR MG 3.330 . 3.330 2.633 2.058 3.256 . 0 0 "[ . 1 . 2]" 1
1422 1 79 GLY QA 1 80 THR HA 4.240 . 4.240 3.955 3.874 4.085 . 0 0 "[ . 1 . 2]" 1
1423 1 31 THR MG 1 83 SER HB3 4.730 . 4.730 2.973 2.071 4.361 . 0 0 "[ . 1 . 2]" 1
1424 1 31 THR MG 1 83 SER HB2 4.730 . 4.730 3.231 2.037 4.620 . 0 0 "[ . 1 . 2]" 1
1425 1 76 GLN QG 1 84 SER HA 5.450 . 5.450 4.494 2.910 5.493 0.043 7 0 "[ . 1 . 2]" 1
1426 1 84 SER QB 1 85 TRP QB 4.960 . 4.960 4.689 4.478 4.963 0.003 7 0 "[ . 1 . 2]" 1
1427 1 31 THR MG 1 84 SER QB 4.520 . 4.520 4.459 4.122 4.561 0.041 12 0 "[ . 1 . 2]" 1
1428 1 31 THR HA 1 85 TRP HA 3.210 . 3.210 2.799 2.605 3.012 . 0 0 "[ . 1 . 2]" 1
1429 1 31 THR MG 1 85 TRP HA 3.720 . 3.720 2.923 2.669 3.015 . 0 0 "[ . 1 . 2]" 1
1430 1 85 TRP QB 1 87 ILE MG 4.320 . 4.320 3.307 3.083 3.509 . 0 0 "[ . 1 . 2]" 1
1431 1 86 TRP HA 1 87 ILE MG 4.380 . 4.380 3.279 3.115 3.402 . 0 0 "[ . 1 . 2]" 1
1432 1 35 ILE MD 1 86 TRP HA 4.720 . 4.720 4.575 4.429 4.741 0.021 15 0 "[ . 1 . 2]" 1
1433 1 22 ILE MD 1 86 TRP HB2 4.360 . 4.360 3.424 3.178 3.598 . 0 0 "[ . 1 . 2]" 1
1434 1 28 LYS HA 1 87 ILE HA 5.500 . 5.500 5.180 5.037 5.387 . 0 0 "[ . 1 . 2]" 1
1435 1 28 LYS HB2 1 87 ILE HA 5.330 . 5.330 5.376 5.245 5.433 0.103 18 0 "[ . 1 . 2]" 1
1436 1 87 ILE HA 1 88 ILE HG13 4.000 . 4.000 3.909 3.781 4.012 0.012 4 0 "[ . 1 . 2]" 1
1437 1 22 ILE HB 1 87 ILE HA 5.500 . 5.500 4.647 4.378 4.803 . 0 0 "[ . 1 . 2]" 1
1438 1 29 ARG HB3 1 87 ILE HA 5.500 . 5.500 4.720 4.490 4.904 . 0 0 "[ . 1 . 2]" 1
1439 1 87 ILE HA 1 94 LYS QD 5.500 . 5.500 5.245 4.729 5.643 0.143 12 0 "[ . 1 . 2]" 1
1440 1 87 ILE HA 1 88 ILE MD 3.640 . 3.640 3.656 3.534 3.706 0.066 7 0 "[ . 1 . 2]" 1
1441 1 87 ILE HA 1 87 ILE MG 2.890 . 2.890 2.671 2.593 2.747 . 0 0 "[ . 1 . 2]" 1
1442 1 87 ILE HA 1 88 ILE MG 5.500 . 5.500 5.531 5.485 5.568 0.068 11 0 "[ . 1 . 2]" 1
1443 1 22 ILE MG 1 87 ILE HA 2.970 . 2.970 2.303 2.025 2.457 . 0 0 "[ . 1 . 2]" 1
1444 1 22 ILE MD 1 87 ILE HA 3.330 . 3.330 2.238 2.121 2.367 . 0 0 "[ . 1 . 2]" 1
1445 1 87 ILE HA 1 87 ILE MD 3.640 . 3.640 3.824 3.639 3.882 0.242 15 0 "[ . 1 . 2]" 1
1446 1 87 ILE HB 1 87 ILE MD 3.310 . 3.310 2.097 2.055 2.207 . 0 0 "[ . 1 . 2]" 1
1447 1 87 ILE HB 1 94 LYS QG 4.730 . 4.730 3.936 2.682 4.738 0.008 14 0 "[ . 1 . 2]" 1
1448 1 87 ILE HB 1 88 ILE HB 5.360 . 5.360 4.958 4.578 5.385 0.025 6 0 "[ . 1 . 2]" 1
1449 1 87 ILE HB 1 88 ILE HA 5.390 . 5.390 4.987 4.796 5.281 . 0 0 "[ . 1 . 2]" 1
1450 1 29 ARG HG3 1 87 ILE MG 4.230 . 4.230 4.256 4.217 4.280 0.050 8 0 "[ . 1 . 2]" 1
1451 1 30 LEU MD1 1 87 ILE MG 5.500 . 5.500 5.311 5.233 5.397 . 0 0 "[ . 1 . 2]" 1
1452 1 30 LEU MD2 1 87 ILE MG 5.500 . 5.500 4.107 3.954 4.296 . 0 0 "[ . 1 . 2]" 1
1453 1 35 ILE MD 1 87 ILE MG 5.500 . 5.500 5.107 4.888 5.207 . 0 0 "[ . 1 . 2]" 1
1454 1 87 ILE MG 1 94 LYS QD 4.050 . 4.050 2.787 2.219 3.438 . 0 0 "[ . 1 . 2]" 1
1455 1 29 ARG HB3 1 87 ILE MG 3.410 . 3.410 1.856 1.778 1.942 . 0 0 "[ . 1 . 2]" 1
1456 1 28 LYS HB2 1 87 ILE MG 4.630 . 4.630 4.023 3.839 4.298 . 0 0 "[ . 1 . 2]" 1
1457 1 29 ARG QD 1 87 ILE MG 5.070 . 5.070 3.391 3.065 3.676 . 0 0 "[ . 1 . 2]" 1
1458 1 28 LYS HA 1 87 ILE MG 5.370 . 5.370 4.836 4.625 5.062 . 0 0 "[ . 1 . 2]" 1
1459 1 87 ILE QG 1 90 PRO QG 5.440 . 5.440 5.134 4.749 5.446 0.006 9 0 "[ . 1 . 2]" 1
1460 1 87 ILE QG 1 89 ASN HB2 5.070 . 5.070 3.981 3.718 4.357 . 0 0 "[ . 1 . 2]" 1
1461 1 73 MET QG 1 87 ILE QG 4.300 . 4.300 1.839 1.772 1.917 . 0 0 "[ . 1 . 2]" 1
1462 1 87 ILE MD 1 87 ILE MG 3.110 . 3.110 2.186 1.939 2.783 . 0 0 "[ . 1 . 2]" 1
1463 1 87 ILE MD 1 94 LYS HB2 4.570 . 4.570 2.290 1.810 3.690 . 0 0 "[ . 1 . 2]" 1
1464 1 87 ILE MD 1 90 PRO QG 4.070 . 4.070 3.411 2.929 3.810 . 0 0 "[ . 1 . 2]" 1
1465 1 28 LYS HB2 1 87 ILE MD 4.540 . 4.540 4.047 3.780 4.430 . 0 0 "[ . 1 . 2]" 1
1466 1 73 MET ME 1 87 ILE MD 4.880 . 4.880 3.453 2.819 3.772 . 0 0 "[ . 1 . 2]" 1
1467 1 73 MET QG 1 87 ILE MD 3.890 . 3.890 2.186 2.065 2.431 . 0 0 "[ . 1 . 2]" 1
1468 1 87 ILE MD 1 89 ASN HA 4.130 . 4.130 2.514 2.251 2.782 . 0 0 "[ . 1 . 2]" 1
1469 1 72 PHE HA 1 87 ILE MD 4.620 . 4.620 4.721 4.670 4.772 0.152 18 0 "[ . 1 . 2]" 1
1470 1 88 ILE HA 1 88 ILE HG13 3.990 . 3.990 2.736 2.664 2.821 . 0 0 "[ . 1 . 2]" 1
1471 1 88 ILE HA 1 88 ILE HG12 3.910 . 3.910 3.525 3.375 3.675 . 0 0 "[ . 1 . 2]" 1
1472 1 88 ILE HA 1 88 ILE MG 3.110 . 3.110 2.365 2.296 2.456 . 0 0 "[ . 1 . 2]" 1
1473 1 87 ILE MD 1 88 ILE HA 4.540 . 4.540 4.405 4.023 4.554 0.014 14 0 "[ . 1 . 2]" 1
1474 1 22 ILE MD 1 88 ILE HA 4.550 . 4.550 3.864 3.711 4.010 . 0 0 "[ . 1 . 2]" 1
1475 1 22 ILE HB 1 88 ILE HB 5.390 . 5.390 5.075 4.638 5.255 . 0 0 "[ . 1 . 2]" 1
1476 1 22 ILE MG 1 88 ILE HB 4.750 . 4.750 3.964 3.673 4.126 . 0 0 "[ . 1 . 2]" 1
1477 1 87 ILE MD 1 88 ILE HB 4.980 . 4.980 4.291 3.794 4.506 . 0 0 "[ . 1 . 2]" 1
1478 1 88 ILE HG12 1 88 ILE MG 3.440 . 3.440 2.137 2.064 2.183 . 0 0 "[ . 1 . 2]" 1
1479 1 88 ILE MG 1 89 ASN HB3 4.440 . 4.440 4.127 3.990 4.284 . 0 0 "[ . 1 . 2]" 1
1480 1 88 ILE MG 1 90 PRO HA 4.260 . 4.260 4.277 4.114 4.358 0.098 15 0 "[ . 1 . 2]" 1
1481 1 88 ILE HG13 1 88 ILE MG 3.320 . 3.320 2.911 2.841 3.017 . 0 0 "[ . 1 . 2]" 1
1482 1 22 ILE MG 1 88 ILE HG13 3.890 . 3.890 3.096 2.867 3.381 . 0 0 "[ . 1 . 2]" 1
1483 1 19 THR HB 1 88 ILE HG13 4.970 . 4.970 5.055 5.036 5.098 0.128 7 0 "[ . 1 . 2]" 1
1484 1 18 ILE HB 1 88 ILE HG13 4.430 . 4.430 4.056 3.889 4.161 . 0 0 "[ . 1 . 2]" 1
1485 1 22 ILE MG 1 88 ILE HG12 4.430 . 4.430 4.173 4.087 4.313 . 0 0 "[ . 1 . 2]" 1
1486 1 18 ILE QG 1 88 ILE HG12 5.500 . 5.500 5.613 5.559 5.646 0.146 17 0 "[ . 1 . 2]" 1
1487 1 88 ILE MD 1 88 ILE MG 3.120 . 3.120 2.804 2.570 2.959 . 0 0 "[ . 1 . 2]" 1
1488 1 22 ILE MG 1 88 ILE MD 3.110 . 3.110 2.004 1.936 2.066 . 0 0 "[ . 1 . 2]" 1
1489 1 22 ILE MD 1 88 ILE MD 3.260 . 3.260 2.377 2.101 2.646 . 0 0 "[ . 1 . 2]" 1
1490 1 18 ILE MG 1 88 ILE MD 4.430 . 4.430 4.447 4.161 4.533 0.103 8 0 "[ . 1 . 2]" 1
1491 1 22 ILE HB 1 88 ILE MD 3.310 . 3.310 1.820 1.793 1.852 . 0 0 "[ . 1 . 2]" 1
1492 1 88 ILE HB 1 88 ILE MD 3.310 . 3.310 2.076 2.012 2.137 . 0 0 "[ . 1 . 2]" 1
1493 1 28 LYS HB2 1 88 ILE MD 5.500 . 5.500 5.329 5.100 5.548 0.048 12 0 "[ . 1 . 2]" 1
1494 1 88 ILE HA 1 88 ILE MD 3.630 . 3.630 3.720 3.683 3.749 0.119 19 0 "[ . 1 . 2]" 1
1495 1 19 THR HA 1 88 ILE MD 4.100 . 4.100 1.747 1.710 1.778 . 0 0 "[ . 1 . 2]" 1
1496 1 89 ASN HA 1 90 PRO HD3 3.060 . 3.060 2.195 2.049 2.410 . 0 0 "[ . 1 . 2]" 1
1497 1 89 ASN HA 1 90 PRO HA 4.600 . 4.600 4.498 4.450 4.542 . 0 0 "[ . 1 . 2]" 1
1498 1 89 ASN HA 1 90 PRO HD2 3.000 . 3.000 2.191 2.065 2.285 . 0 0 "[ . 1 . 2]" 1
1499 1 73 MET ME 1 89 ASN HA 4.680 . 4.680 4.754 4.694 4.811 0.131 7 0 "[ . 1 . 2]" 1
1500 1 73 MET QB 1 89 ASN HA 4.290 . 4.290 4.001 3.660 4.271 . 0 0 "[ . 1 . 2]" 1
1501 1 88 ILE MG 1 89 ASN HA 4.810 . 4.810 4.358 4.108 4.491 . 0 0 "[ . 1 . 2]" 1
1502 1 14 TYR HB2 1 65 ASN HA 5.500 . 5.500 5.424 5.286 5.565 0.065 7 0 "[ . 1 . 2]" 1
1503 1 73 MET QB 1 89 ASN HB2 4.140 . 4.140 2.479 2.219 2.842 . 0 0 "[ . 1 . 2]" 1
1504 1 71 ARG HA 1 89 ASN HB2 4.240 . 4.240 4.274 4.141 4.375 0.135 11 0 "[ . 1 . 2]" 1
1505 1 10 GLY HA3 1 44 PRO HB2 5.250 . 5.250 4.663 3.692 5.268 0.018 4 0 "[ . 1 . 2]" 1
1506 1 89 ASN HA 1 90 PRO QG 3.800 . 3.800 3.851 3.823 3.874 0.074 14 0 "[ . 1 . 2]" 1
1507 1 88 ILE MG 1 90 PRO HD3 4.860 . 4.860 4.509 4.062 4.892 0.032 13 0 "[ . 1 . 2]" 1
1508 1 87 ILE MD 1 90 PRO HD3 4.150 . 4.150 2.408 1.976 2.839 . 0 0 "[ . 1 . 2]" 1
1509 1 89 ASN HB3 1 90 PRO HD2 4.580 . 4.580 4.622 4.584 4.681 0.101 17 0 "[ . 1 . 2]" 1
1510 1 73 MET ME 1 90 PRO HD2 5.030 . 5.030 4.964 4.680 5.087 0.057 10 0 "[ . 1 . 2]" 1
1511 1 87 ILE MD 1 90 PRO HD2 4.110 . 4.110 2.876 2.592 3.061 . 0 0 "[ . 1 . 2]" 1
1512 1 40 VAL MG2 1 50 GLY HA3 3.820 . 3.820 2.831 2.195 3.213 . 0 0 "[ . 1 . 2]" 1
1513 1 93 GLY QA 1 94 LYS QE 5.130 . 5.130 3.424 2.343 5.191 0.061 5 0 "[ . 1 . 2]" 1
1514 1 93 GLY QA 1 94 LYS HA 4.100 . 4.100 3.934 3.882 3.972 . 0 0 "[ . 1 . 2]" 1
1515 1 60 ASN HA 1 63 ARG QD 4.960 . 4.960 2.872 2.222 4.408 . 0 0 "[ . 1 . 2]" 1
1516 1 73 MET QB 1 96 GLY QA 5.500 . 5.500 4.755 3.717 5.604 0.104 19 0 "[ . 1 . 2]" 1
1517 1 75 VAL HB 1 96 GLY QA 5.500 . 5.500 4.461 3.857 5.505 0.005 6 0 "[ . 1 . 2]" 1
1518 1 98 ALA HA 1 99 PRO HD3 2.980 . 2.980 2.186 1.903 2.497 . 0 0 "[ . 1 . 2]" 1
1519 1 98 ALA HA 1 99 PRO HD2 3.120 . 3.120 2.396 2.087 3.018 . 0 0 "[ . 1 . 2]" 1
1520 1 96 GLY QA 1 98 ALA MB 4.810 . 4.810 4.175 2.980 4.894 0.084 19 0 "[ . 1 . 2]" 1
1521 1 10 GLY HA2 1 44 PRO HB2 4.400 . 4.400 3.758 3.171 4.130 . 0 0 "[ . 1 . 2]" 1
1522 1 98 ALA MB 1 99 PRO QG 4.910 . 4.910 4.573 3.984 4.940 0.030 17 0 "[ . 1 . 2]" 1
1523 1 98 ALA MB 1 99 PRO HD3 4.210 . 4.210 3.735 3.077 4.028 . 0 0 "[ . 1 . 2]" 1
1524 1 99 PRO HD2 1 100 ARG HA 5.500 . 5.500 5.076 4.495 5.509 0.009 1 0 "[ . 1 . 2]" 1
1525 1 98 ALA MB 1 99 PRO HD2 3.780 . 3.780 3.330 2.683 3.830 0.050 7 0 "[ . 1 . 2]" 1
1526 1 99 PRO HD2 1 100 ARG QG 5.240 . 5.240 3.865 2.130 5.244 0.004 10 0 "[ . 1 . 2]" 1
1527 1 5 ARG HA 1 5 ARG QG 3.420 . 3.420 2.734 2.344 3.467 0.047 12 0 "[ . 1 . 2]" 1
1528 1 87 ILE HB 1 94 LYS QE 5.190 . 5.190 5.137 4.261 5.309 0.119 7 0 "[ . 1 . 2]" 1
1529 1 29 ARG HG2 1 94 LYS QE 5.500 . 5.500 4.352 2.186 5.270 . 0 0 "[ . 1 . 2]" 1
1530 1 68 LEU HA 1 68 LEU HG 3.830 . 3.830 3.206 3.021 3.831 0.001 5 0 "[ . 1 . 2]" 1
1531 1 97 LYS HA 1 97 LYS QG 3.470 . 3.470 2.755 2.375 3.371 . 0 0 "[ . 1 . 2]" 1
1532 1 97 LYS HA 1 97 LYS QE 4.540 . 4.540 4.100 2.720 4.579 0.039 10 0 "[ . 1 . 2]" 1
1533 1 87 ILE MD 1 94 LYS HB3 4.570 . 4.570 3.606 2.126 4.590 0.020 6 0 "[ . 1 . 2]" 1
1534 1 94 LYS HA 1 94 LYS QG 3.590 . 3.590 2.688 2.279 3.224 . 0 0 "[ . 1 . 2]" 1
1535 1 94 LYS HA 1 94 LYS QD 4.140 . 4.140 3.329 2.426 3.753 . 0 0 "[ . 1 . 2]" 1
1536 1 28 LYS HA 1 94 LYS QD 5.130 . 5.130 4.526 4.225 4.867 . 0 0 "[ . 1 . 2]" 1
1537 1 94 LYS QD 1 94 LYS QG 2.400 . 2.400 2.008 1.921 2.036 . 0 0 "[ . 1 . 2]" 1
1538 1 28 LYS HG2 1 94 LYS QD 3.860 . 3.860 3.873 3.630 3.978 0.118 7 0 "[ . 1 . 2]" 1
1539 1 59 LYS HA 1 59 LYS HE2 5.500 . 5.500 5.091 4.118 5.529 0.029 14 0 "[ . 1 . 2]" 1
1540 1 59 LYS HA 1 59 LYS HE3 5.500 . 5.500 5.087 3.906 5.614 0.114 8 0 "[ . 1 . 2]" 1
1541 1 59 LYS HB3 1 59 LYS HE3 4.750 . 4.750 3.099 1.936 4.286 . 0 0 "[ . 1 . 2]" 1
1542 1 27 ASP HB3 1 29 ARG HG3 4.690 . 4.690 2.986 2.403 4.009 . 0 0 "[ . 1 . 2]" 1
1543 1 29 ARG HG2 1 94 LYS QD 4.060 . 4.060 3.090 2.285 3.533 . 0 0 "[ . 1 . 2]" 1
1544 1 38 TRP HB3 1 39 MET HA 4.230 . 4.230 4.144 3.960 4.240 0.010 10 0 "[ . 1 . 2]" 1
1545 1 36 TYR HB2 1 37 GLU HA 5.500 . 5.500 5.429 3.974 5.526 0.026 2 0 "[ . 1 . 2]" 1
1546 1 36 TYR HB3 1 37 GLU HA 5.500 . 5.500 4.411 3.774 4.697 . 0 0 "[ . 1 . 2]" 1
1547 1 6 ARG QG 1 7 ASN QB 4.870 . 4.870 4.673 4.272 4.948 0.078 7 0 "[ . 1 . 2]" 1
1548 1 7 ASN QB 1 9 TRP H 4.190 . 4.190 2.903 2.421 3.218 . 0 0 "[ . 1 . 2]" 1
1549 1 7 ASN QB 1 9 TRP QB 4.440 . 4.440 4.433 4.175 4.544 0.104 4 0 "[ . 1 . 2]" 1
1550 1 7 ASN QB 1 10 GLY H 4.920 . 4.920 3.354 2.406 4.188 . 0 0 "[ . 1 . 2]" 1
1551 1 8 ALA HA 1 9 TRP QB 5.340 . 5.340 5.067 4.901 5.314 . 0 0 "[ . 1 . 2]" 1
1552 1 8 ALA HA 1 12 LEU QD 4.080 . 4.080 2.143 1.963 2.358 . 0 0 "[ . 1 . 2]" 1
1553 1 8 ALA MB 1 12 LEU QD 3.480 . 3.480 2.505 2.100 2.703 . 0 0 "[ . 1 . 2]" 1
1554 1 8 ALA MB 1 20 ARG QD 4.390 . 4.390 4.352 3.963 4.528 0.138 15 0 "[ . 1 . 2]" 1
1555 1 9 TRP H 1 12 LEU QD 5.140 . 5.140 3.572 3.139 3.974 . 0 0 "[ . 1 . 2]" 1
1556 1 9 TRP HA 1 12 LEU QD 3.560 . 3.560 2.474 1.996 2.823 . 0 0 "[ . 1 . 2]" 1
1557 1 9 TRP HA 1 20 ARG QD 5.340 . 5.340 5.015 4.500 5.400 0.060 12 0 "[ . 1 . 2]" 1
1558 1 9 TRP QB 1 10 GLY H 3.960 . 3.960 3.551 3.031 3.913 . 0 0 "[ . 1 . 2]" 1
1559 1 9 TRP QB 1 10 GLY HA2 4.930 . 4.930 4.511 4.085 4.895 . 0 0 "[ . 1 . 2]" 1
1560 1 9 TRP QB 1 10 GLY HA3 5.170 . 5.170 4.633 4.220 4.892 . 0 0 "[ . 1 . 2]" 1
1561 1 9 TRP QB 1 12 LEU QD 4.090 . 4.090 3.846 3.272 4.135 0.045 20 0 "[ . 1 . 2]" 1
1562 1 9 TRP QB 1 44 PRO HD3 5.340 . 5.340 4.531 3.495 5.231 . 0 0 "[ . 1 . 2]" 1
1563 1 10 GLY H 1 12 LEU QD 4.520 . 4.520 3.887 3.042 4.419 . 0 0 "[ . 1 . 2]" 1
1564 1 11 ASN HB2 1 12 LEU QD 5.440 . 5.440 4.897 4.229 5.387 . 0 0 "[ . 1 . 2]" 1
1565 1 11 ASN HB3 1 12 LEU QD 5.200 . 5.200 4.455 3.922 5.222 0.022 7 0 "[ . 1 . 2]" 1
1566 1 12 LEU HA 1 12 LEU QD 2.750 . 2.750 2.091 2.039 2.171 . 0 0 "[ . 1 . 2]" 1
1567 1 12 LEU HA 1 17 LEU QD 5.440 . 5.440 4.273 4.126 4.439 . 0 0 "[ . 1 . 2]" 1
1568 1 12 LEU HB2 1 12 LEU QD 2.940 . 2.940 2.208 2.160 2.237 . 0 0 "[ . 1 . 2]" 1
1569 1 12 LEU HB2 1 20 ARG QD 4.970 . 4.970 4.938 4.711 5.009 0.039 15 0 "[ . 1 . 2]" 1
1570 1 12 LEU HB3 1 12 LEU QD 3.060 . 3.060 2.111 2.081 2.481 . 0 0 "[ . 1 . 2]" 1
1571 1 12 LEU HB3 1 17 LEU QD 4.340 . 4.340 2.679 2.357 2.996 . 0 0 "[ . 1 . 2]" 1
1572 1 12 LEU HG 1 17 LEU QD 5.090 . 5.090 3.784 2.807 4.058 . 0 0 "[ . 1 . 2]" 1
1573 1 12 LEU QD 1 13 SER H 4.090 . 4.090 3.487 3.263 3.654 . 0 0 "[ . 1 . 2]" 1
1574 1 12 LEU QD 1 16 ASP HA 4.610 . 4.610 4.035 3.895 4.256 . 0 0 "[ . 1 . 2]" 1
1575 1 12 LEU QD 1 16 ASP HB2 3.730 . 3.730 2.918 2.789 3.041 . 0 0 "[ . 1 . 2]" 1
1576 1 12 LEU QD 1 16 ASP HB3 3.380 . 3.380 2.034 1.914 2.238 . 0 0 "[ . 1 . 2]" 1
1577 1 12 LEU QD 1 17 LEU HA 4.410 . 4.410 3.259 3.056 4.158 . 0 0 "[ . 1 . 2]" 1
1578 1 12 LEU QD 1 17 LEU QD 2.770 . 2.770 2.296 2.116 2.582 . 0 0 "[ . 1 . 2]" 1
1579 1 12 LEU QD 1 19 THR MG 4.510 . 4.510 4.424 4.001 4.560 0.050 6 0 "[ . 1 . 2]" 1
1580 1 12 LEU QD 1 20 ARG HG2 3.750 . 3.750 2.709 2.421 3.696 . 0 0 "[ . 1 . 2]" 1
1581 1 12 LEU QD 1 20 ARG HG3 4.170 . 4.170 2.160 1.843 3.275 . 0 0 "[ . 1 . 2]" 1
1582 1 12 LEU QD 1 20 ARG QD 3.360 . 3.360 2.106 1.988 2.560 . 0 0 "[ . 1 . 2]" 1
1583 1 12 LEU QD 1 43 VAL HA 4.680 . 4.680 4.301 3.770 4.717 0.037 10 0 "[ . 1 . 2]" 1
1584 1 12 LEU QD 1 44 PRO HD2 4.430 . 4.430 3.374 2.644 3.937 . 0 0 "[ . 1 . 2]" 1
1585 1 12 LEU QD 1 44 PRO HD3 4.400 . 4.400 3.550 2.663 4.293 . 0 0 "[ . 1 . 2]" 1
1586 1 13 SER HA 1 17 LEU QD 4.010 . 4.010 4.002 3.631 4.100 0.090 1 0 "[ . 1 . 2]" 1
1587 1 13 SER QB 1 14 TYR H 3.300 . 3.300 2.323 2.184 2.560 . 0 0 "[ . 1 . 2]" 1
1588 1 13 SER QB 1 14 TYR HA 4.630 . 4.630 4.457 4.368 4.537 . 0 0 "[ . 1 . 2]" 1
1589 1 13 SER QB 1 14 TYR HB3 5.340 . 5.340 5.334 5.243 5.369 0.029 7 0 "[ . 1 . 2]" 1
1590 1 13 SER QB 1 15 ALA H 3.510 . 3.510 2.999 2.758 3.187 . 0 0 "[ . 1 . 2]" 1
1591 1 13 SER QB 1 15 ALA MB 4.510 . 4.510 3.060 2.783 3.426 . 0 0 "[ . 1 . 2]" 1
1592 1 13 SER QB 1 16 ASP H 3.310 . 3.310 2.729 2.465 3.129 . 0 0 "[ . 1 . 2]" 1
1593 1 13 SER QB 1 16 ASP HB2 4.420 . 4.420 3.520 3.385 3.704 . 0 0 "[ . 1 . 2]" 1
1594 1 13 SER QB 1 16 ASP HB3 5.340 . 5.340 4.869 4.758 5.019 . 0 0 "[ . 1 . 2]" 1
1595 1 14 TYR HA 1 17 LEU QD 3.120 . 3.120 2.104 2.000 2.247 . 0 0 "[ . 1 . 2]" 1
1596 1 14 TYR HA 1 65 ASN QB 5.340 . 5.340 5.391 5.286 5.446 0.106 6 0 "[ . 1 . 2]" 1
1597 1 14 TYR HB2 1 17 LEU QD 5.440 . 5.440 4.675 4.501 4.794 . 0 0 "[ . 1 . 2]" 1
1598 1 14 TYR HB2 1 62 ILE QG 5.020 . 5.020 3.710 3.236 4.125 . 0 0 "[ . 1 . 2]" 1
1599 1 14 TYR HB2 1 68 LEU QD 5.440 . 5.440 5.027 4.479 5.371 . 0 0 "[ . 1 . 2]" 1
1600 1 14 TYR HB3 1 17 LEU QD 5.440 . 5.440 3.906 3.604 4.252 . 0 0 "[ . 1 . 2]" 1
1601 1 14 TYR HB3 1 62 ILE QG 4.660 . 4.660 2.361 2.000 2.801 . 0 0 "[ . 1 . 2]" 1
1602 1 14 TYR HB3 1 65 ASN QB 4.820 . 4.820 3.851 3.412 4.181 . 0 0 "[ . 1 . 2]" 1
1603 1 15 ALA H 1 62 ILE QG 5.340 . 5.340 4.797 4.471 5.170 . 0 0 "[ . 1 . 2]" 1
1604 1 15 ALA H 1 65 ASN QB 3.990 . 3.990 3.437 3.285 3.565 . 0 0 "[ . 1 . 2]" 1
1605 1 15 ALA H 1 68 LEU QD 5.440 . 5.440 5.178 4.085 5.535 0.095 12 0 "[ . 1 . 2]" 1
1606 1 15 ALA MB 1 17 LEU QD 5.440 . 5.440 5.451 5.406 5.479 0.039 17 0 "[ . 1 . 2]" 1
1607 1 15 ALA MB 1 65 ASN QB 4.390 . 4.390 2.380 2.156 2.619 . 0 0 "[ . 1 . 2]" 1
1608 1 15 ALA MB 1 68 LEU QD 4.510 . 4.510 3.928 2.386 4.538 0.028 16 0 "[ . 1 . 2]" 1
1609 1 16 ASP H 1 17 LEU QD 4.880 . 4.880 4.535 4.438 4.611 . 0 0 "[ . 1 . 2]" 1
1610 1 16 ASP HA 1 20 ARG QD 5.340 . 5.340 4.357 3.763 4.801 . 0 0 "[ . 1 . 2]" 1
1611 1 16 ASP HB2 1 17 LEU QD 4.520 . 4.520 3.677 3.418 3.931 . 0 0 "[ . 1 . 2]" 1
1612 1 16 ASP HB2 1 20 ARG QD 5.190 . 5.190 4.696 4.402 4.941 . 0 0 "[ . 1 . 2]" 1
1613 1 16 ASP HB3 1 20 ARG QD 4.550 . 4.550 3.388 2.983 3.731 . 0 0 "[ . 1 . 2]" 1
1614 1 17 LEU H 1 17 LEU QD 3.320 . 3.320 3.000 2.896 3.065 . 0 0 "[ . 1 . 2]" 1
1615 1 17 LEU HA 1 17 LEU QD 3.050 . 3.050 2.151 2.084 2.208 . 0 0 "[ . 1 . 2]" 1
1616 1 17 LEU HB2 1 17 LEU QD 3.100 . 3.100 2.225 2.170 2.293 . 0 0 "[ . 1 . 2]" 1
1617 1 17 LEU QD 1 18 ILE H 4.320 . 4.320 3.968 3.833 4.041 . 0 0 "[ . 1 . 2]" 1
1618 1 17 LEU QD 1 20 ARG H 5.440 . 5.440 4.682 4.452 4.821 . 0 0 "[ . 1 . 2]" 1
1619 1 17 LEU QD 1 20 ARG QB 4.590 . 4.590 3.768 3.567 4.073 . 0 0 "[ . 1 . 2]" 1
1620 1 17 LEU QD 1 20 ARG HG2 4.830 . 4.830 3.394 3.111 3.556 . 0 0 "[ . 1 . 2]" 1
1621 1 17 LEU QD 1 20 ARG HG3 4.200 . 4.200 3.041 2.547 3.625 . 0 0 "[ . 1 . 2]" 1
1622 1 17 LEU QD 1 39 MET QB 4.720 . 4.720 4.400 3.881 4.766 0.046 14 0 "[ . 1 . 2]" 1
1623 1 17 LEU QD 1 39 MET ME 3.600 . 3.600 3.638 3.450 3.716 0.116 5 0 "[ . 1 . 2]" 1
1624 1 17 LEU QD 1 43 VAL MG1 3.880 . 3.880 3.761 3.655 3.874 . 0 0 "[ . 1 . 2]" 1
1625 1 17 LEU QD 1 43 VAL MG2 3.210 . 3.210 1.783 1.715 1.850 . 0 0 "[ . 1 . 2]" 1
1626 1 17 LEU QD 1 44 PRO QG 4.610 . 4.610 3.238 2.826 3.556 . 0 0 "[ . 1 . 2]" 1
1627 1 17 LEU QD 1 44 PRO HD3 4.790 . 4.790 3.842 3.596 3.989 . 0 0 "[ . 1 . 2]" 1
1628 1 17 LEU QD 1 45 TYR HA 5.440 . 5.440 4.347 4.078 4.561 . 0 0 "[ . 1 . 2]" 1
1629 1 17 LEU QD 1 45 TYR HB2 4.550 . 4.550 2.798 2.471 3.040 . 0 0 "[ . 1 . 2]" 1
1630 1 17 LEU QD 1 45 TYR HB3 4.020 . 4.020 2.238 2.031 2.400 . 0 0 "[ . 1 . 2]" 1
1631 1 18 ILE H 1 66 LEU QD 5.440 . 5.440 5.336 5.215 5.441 0.001 5 0 "[ . 1 . 2]" 1
1632 1 18 ILE HB 1 66 LEU QD 4.330 . 4.330 3.773 3.434 4.019 . 0 0 "[ . 1 . 2]" 1
1633 1 18 ILE MG 1 30 LEU QD 5.110 . 5.110 4.857 4.637 4.958 . 0 0 "[ . 1 . 2]" 1
1634 1 18 ILE MG 1 32 LEU QD 4.020 . 4.020 3.117 2.866 3.308 . 0 0 "[ . 1 . 2]" 1
1635 1 18 ILE MG 1 39 MET QG 5.340 . 5.340 4.839 4.421 5.345 0.005 6 0 "[ . 1 . 2]" 1
1636 1 18 ILE MG 1 62 ILE QG 3.680 . 3.680 3.733 3.697 3.765 0.085 9 0 "[ . 1 . 2]" 1
1637 1 18 ILE MG 1 66 LEU QD 3.020 . 3.020 2.076 1.912 2.233 . 0 0 "[ . 1 . 2]" 1
1638 1 18 ILE QG 1 62 ILE QG 3.690 . 3.690 2.258 2.161 2.436 . 0 0 "[ . 1 . 2]" 1
1639 1 18 ILE MD 1 32 LEU QD 4.190 . 4.190 3.816 3.581 4.039 . 0 0 "[ . 1 . 2]" 1
1640 1 18 ILE MD 1 62 ILE QG 3.460 . 3.460 2.332 1.984 2.760 . 0 0 "[ . 1 . 2]" 1
1641 1 18 ILE MD 1 65 ASN QB 3.300 . 3.300 2.199 2.057 2.422 . 0 0 "[ . 1 . 2]" 1
1642 1 18 ILE MD 1 66 LEU QD 3.330 . 3.330 1.792 1.728 1.861 . 0 0 "[ . 1 . 2]" 1
1643 1 20 ARG H 1 20 ARG QD 3.590 . 3.590 3.034 2.706 3.310 . 0 0 "[ . 1 . 2]" 1
1644 1 20 ARG QD 1 20 ARG HG3 2.640 . 2.640 2.321 2.269 2.374 . 0 0 "[ . 1 . 2]" 1
1645 1 20 ARG QD 1 21 ALA H 5.190 . 5.190 4.813 4.702 4.963 . 0 0 "[ . 1 . 2]" 1
1646 1 22 ILE HA 1 25 SER QB 3.710 . 3.710 2.692 2.483 2.830 . 0 0 "[ . 1 . 2]" 1
1647 1 22 ILE HA 1 30 LEU QD 3.040 . 3.040 1.877 1.835 1.936 . 0 0 "[ . 1 . 2]" 1
1648 1 22 ILE HB 1 30 LEU QD 4.190 . 4.190 3.956 3.883 4.041 . 0 0 "[ . 1 . 2]" 1
1649 1 22 ILE MG 1 25 SER QB 4.230 . 4.230 3.616 3.455 3.845 . 0 0 "[ . 1 . 2]" 1
1650 1 22 ILE MG 1 30 LEU QD 3.530 . 3.530 2.314 2.149 2.380 . 0 0 "[ . 1 . 2]" 1
1651 1 22 ILE QG 1 25 SER QB 5.340 . 5.340 4.418 4.286 4.531 . 0 0 "[ . 1 . 2]" 1
1652 1 22 ILE QG 1 30 LEU QD 3.510 . 3.510 2.132 2.057 2.238 . 0 0 "[ . 1 . 2]" 1
1653 1 22 ILE MD 1 30 LEU QD 3.640 . 3.640 3.538 3.479 3.633 . 0 0 "[ . 1 . 2]" 1
1654 1 22 ILE MD 1 66 LEU QD 3.800 . 3.800 3.374 3.169 3.501 . 0 0 "[ . 1 . 2]" 1
1655 1 22 ILE MD 1 86 TRP QB 3.610 . 3.610 3.252 3.034 3.404 . 0 0 "[ . 1 . 2]" 1
1656 1 23 GLU HA 1 30 LEU QD 5.440 . 5.440 4.967 4.780 5.075 . 0 0 "[ . 1 . 2]" 1
1657 1 25 SER H 1 25 SER QB 3.090 . 3.090 2.220 2.099 2.365 . 0 0 "[ . 1 . 2]" 1
1658 1 25 SER HA 1 30 LEU QD 4.950 . 4.950 3.541 3.370 3.683 . 0 0 "[ . 1 . 2]" 1
1659 1 25 SER QB 1 26 PRO HA 5.130 . 5.130 4.568 4.448 4.788 . 0 0 "[ . 1 . 2]" 1
1660 1 25 SER QB 1 26 PRO QG 4.270 . 4.270 3.703 3.656 3.799 . 0 0 "[ . 1 . 2]" 1
1661 1 25 SER QB 1 26 PRO QD 2.870 . 2.870 1.883 1.847 1.966 . 0 0 "[ . 1 . 2]" 1
1662 1 25 SER QB 1 28 LYS H 3.750 . 3.750 3.208 3.094 3.389 . 0 0 "[ . 1 . 2]" 1
1663 1 25 SER QB 1 28 LYS QD 4.120 . 4.120 3.433 3.075 3.862 . 0 0 "[ . 1 . 2]" 1
1664 1 25 SER QB 1 28 LYS HE2 5.340 . 5.340 4.825 4.509 5.140 . 0 0 "[ . 1 . 2]" 1
1665 1 25 SER QB 1 28 LYS HE3 5.340 . 5.340 5.254 4.996 5.403 0.063 1 0 "[ . 1 . 2]" 1
1666 1 25 SER QB 1 30 LEU HB3 5.340 . 5.340 4.691 4.517 4.804 . 0 0 "[ . 1 . 2]" 1
1667 1 25 SER QB 1 30 LEU HG 2.940 . 2.940 2.743 2.625 2.847 . 0 0 "[ . 1 . 2]" 1
1668 1 25 SER QB 1 30 LEU QD 3.440 . 3.440 1.619 1.595 1.656 . 0 0 "[ . 1 . 2]" 1
1669 1 25 SER QB 1 38 TRP HE1 4.690 . 4.690 4.187 3.320 4.710 0.020 3 0 "[ . 1 . 2]" 1
1670 1 26 PRO QD 1 30 LEU QD 5.440 . 5.440 1.897 1.834 2.004 . 0 0 "[ . 1 . 2]" 1
1671 1 27 ASP H 1 27 ASP QB 3.170 . 3.170 2.430 2.336 2.598 . 0 0 "[ . 1 . 2]" 1
1672 1 27 ASP H 1 30 LEU QD 4.780 . 4.780 3.402 3.042 3.587 . 0 0 "[ . 1 . 2]" 1
1673 1 27 ASP QB 1 28 LYS H 4.290 . 4.290 3.546 3.337 3.689 . 0 0 "[ . 1 . 2]" 1
1674 1 27 ASP QB 1 28 LYS HA 5.340 . 5.340 5.025 4.712 5.210 . 0 0 "[ . 1 . 2]" 1
1675 1 27 ASP QB 1 28 LYS HB2 5.250 . 5.250 4.868 4.439 5.130 . 0 0 "[ . 1 . 2]" 1
1676 1 27 ASP QB 1 29 ARG H 3.890 . 3.890 2.781 2.365 2.993 . 0 0 "[ . 1 . 2]" 1
1677 1 27 ASP QB 1 29 ARG HG3 4.110 . 4.110 2.687 2.297 2.912 . 0 0 "[ . 1 . 2]" 1
1678 1 27 ASP QB 1 29 ARG QD 4.520 . 4.520 3.846 3.268 4.177 . 0 0 "[ . 1 . 2]" 1
1679 1 28 LYS QD 1 30 LEU QD 5.400 . 5.400 3.810 3.611 3.995 . 0 0 "[ . 1 . 2]" 1
1680 1 29 ARG H 1 30 LEU QD 3.710 . 3.710 2.756 2.639 2.888 . 0 0 "[ . 1 . 2]" 1
1681 1 29 ARG HA 1 75 VAL QG 4.790 . 4.790 4.376 4.112 4.674 . 0 0 "[ . 1 . 2]" 1
1682 1 29 ARG HB2 1 75 VAL QG 4.430 . 4.430 3.306 3.056 3.663 . 0 0 "[ . 1 . 2]" 1
1683 1 29 ARG HG2 1 75 VAL QG 5.190 . 5.190 4.158 3.887 4.506 . 0 0 "[ . 1 . 2]" 1
1684 1 29 ARG HG3 1 30 LEU QD 4.630 . 4.630 3.693 3.485 3.891 . 0 0 "[ . 1 . 2]" 1
1685 1 29 ARG QD 1 75 VAL QG 3.600 . 3.600 2.263 1.822 2.873 . 0 0 "[ . 1 . 2]" 1
1686 1 30 LEU H 1 30 LEU QD 3.580 . 3.580 2.383 2.303 2.443 . 0 0 "[ . 1 . 2]" 1
1687 1 30 LEU HA 1 30 LEU QD 3.530 . 3.530 2.089 2.018 2.175 . 0 0 "[ . 1 . 2]" 1
1688 1 30 LEU QD 1 31 THR H 4.910 . 4.910 3.587 3.540 3.669 . 0 0 "[ . 1 . 2]" 1
1689 1 30 LEU QD 1 34 GLN QB 5.280 . 5.280 2.934 2.318 3.568 . 0 0 "[ . 1 . 2]" 1
1690 1 30 LEU QD 1 34 GLN QG 4.460 . 4.460 3.243 3.022 3.490 . 0 0 "[ . 1 . 2]" 1
1691 1 30 LEU QD 1 35 ILE MG 5.000 . 5.000 4.121 3.740 4.329 . 0 0 "[ . 1 . 2]" 1
1692 1 30 LEU QD 1 86 TRP H 4.540 . 4.540 4.182 4.132 4.219 . 0 0 "[ . 1 . 2]" 1
1693 1 30 LEU QD 1 87 ILE HA 4.740 . 4.740 4.138 3.976 4.213 . 0 0 "[ . 1 . 2]" 1
1694 1 30 LEU QD 1 87 ILE HB 4.970 . 4.970 4.963 4.808 5.031 0.061 18 0 "[ . 1 . 2]" 1
1695 1 30 LEU QD 1 87 ILE MG 4.170 . 4.170 3.976 3.843 4.132 . 0 0 "[ . 1 . 2]" 1
1696 1 30 LEU QD 1 88 ILE MD 4.570 . 4.570 4.582 4.514 4.638 0.068 18 0 "[ . 1 . 2]" 1
1697 1 31 THR HA 1 86 TRP QB 5.340 . 5.340 4.357 4.143 4.489 . 0 0 "[ . 1 . 2]" 1
1698 1 31 THR MG 1 83 SER QB 3.910 . 3.910 2.601 2.023 3.854 . 0 0 "[ . 1 . 2]" 1
1699 1 32 LEU H 1 32 LEU QD 3.890 . 3.890 3.196 2.887 3.565 . 0 0 "[ . 1 . 2]" 1
1700 1 32 LEU HA 1 32 LEU QD 2.780 . 2.780 1.905 1.834 2.032 . 0 0 "[ . 1 . 2]" 1
1701 1 32 LEU HA 1 66 LEU QD 5.080 . 5.080 4.631 4.249 5.116 0.036 8 0 "[ . 1 . 2]" 1
1702 1 32 LEU HA 1 86 TRP QB 5.190 . 5.190 4.619 4.296 4.981 . 0 0 "[ . 1 . 2]" 1
1703 1 32 LEU QB 1 32 LEU QD 2.790 . 2.790 2.049 1.924 2.085 . 0 0 "[ . 1 . 2]" 1
1704 1 32 LEU QB 1 33 SER H 3.210 . 3.210 2.898 2.743 3.043 . 0 0 "[ . 1 . 2]" 1
1705 1 32 LEU QB 1 33 SER QB 4.930 . 4.930 4.542 3.966 4.769 . 0 0 "[ . 1 . 2]" 1
1706 1 32 LEU QB 1 35 ILE HB 4.880 . 4.880 4.336 4.091 4.603 . 0 0 "[ . 1 . 2]" 1
1707 1 32 LEU QB 1 35 ILE MD 4.730 . 4.730 4.047 3.567 4.219 . 0 0 "[ . 1 . 2]" 1
1708 1 32 LEU QB 1 86 TRP HE1 3.900 . 3.900 2.340 1.652 2.832 . 0 0 "[ . 1 . 2]" 1
1709 1 32 LEU QD 1 33 SER H 4.390 . 4.390 4.103 3.972 4.312 . 0 0 "[ . 1 . 2]" 1
1710 1 32 LEU QD 1 35 ILE HB 3.760 . 3.760 2.496 2.182 2.798 . 0 0 "[ . 1 . 2]" 1
1711 1 32 LEU QD 1 35 ILE MD 3.640 . 3.640 2.330 2.144 2.642 . 0 0 "[ . 1 . 2]" 1
1712 1 32 LEU QD 1 36 TYR H 3.610 . 3.610 3.623 3.494 3.698 0.088 15 0 "[ . 1 . 2]" 1
1713 1 32 LEU QD 1 39 MET ME 3.960 . 3.960 3.832 3.542 4.000 0.040 4 0 "[ . 1 . 2]" 1
1714 1 32 LEU QD 1 59 LYS HB2 4.580 . 4.580 3.365 2.564 4.106 . 0 0 "[ . 1 . 2]" 1
1715 1 32 LEU QD 1 62 ILE HB 4.570 . 4.570 3.302 2.882 3.594 . 0 0 "[ . 1 . 2]" 1
1716 1 32 LEU QD 1 62 ILE MG 2.790 . 2.790 1.816 1.737 1.915 . 0 0 "[ . 1 . 2]" 1
1717 1 32 LEU QD 1 62 ILE MD 3.760 . 3.760 3.054 2.979 3.223 . 0 0 "[ . 1 . 2]" 1
1718 1 32 LEU QD 1 63 ARG H 4.540 . 4.540 3.809 3.312 4.138 . 0 0 "[ . 1 . 2]" 1
1719 1 32 LEU QD 1 63 ARG HA 3.890 . 3.890 3.004 2.639 3.472 . 0 0 "[ . 1 . 2]" 1
1720 1 32 LEU QD 1 63 ARG QB 3.790 . 3.790 3.652 3.349 3.841 0.051 1 0 "[ . 1 . 2]" 1
1721 1 32 LEU QD 1 63 ARG HG2 3.090 . 3.090 2.255 1.811 2.538 . 0 0 "[ . 1 . 2]" 1
1722 1 32 LEU QD 1 63 ARG HG3 4.110 . 4.110 3.003 2.301 3.386 . 0 0 "[ . 1 . 2]" 1
1723 1 32 LEU QD 1 63 ARG QD 4.080 . 4.080 3.317 2.523 3.840 . 0 0 "[ . 1 . 2]" 1
1724 1 32 LEU QD 1 66 LEU QD 2.990 . 2.990 2.404 2.100 3.012 0.022 8 0 "[ . 1 . 2]" 1
1725 1 32 LEU QD 1 86 TRP QB 4.980 . 4.980 3.388 3.078 4.146 . 0 0 "[ . 1 . 2]" 1
1726 1 32 LEU QD 1 86 TRP HE1 4.060 . 4.060 2.651 2.300 3.193 . 0 0 "[ . 1 . 2]" 1
1727 1 34 GLN HA 1 37 GLU QB 4.260 . 4.260 3.927 3.741 4.132 . 0 0 "[ . 1 . 2]" 1
1728 1 35 ILE H 1 36 TYR QB 5.030 . 5.030 4.328 4.160 4.727 . 0 0 "[ . 1 . 2]" 1
1729 1 35 ILE HB 1 66 LEU QD 5.440 . 5.440 5.111 4.878 5.434 . 0 0 "[ . 1 . 2]" 1
1730 1 35 ILE HB 1 86 TRP QB 5.340 . 5.340 5.220 5.054 5.350 0.010 15 0 "[ . 1 . 2]" 1
1731 1 35 ILE MG 1 36 TYR QB 4.830 . 4.830 4.215 3.962 4.896 0.066 15 0 "[ . 1 . 2]" 1
1732 1 35 ILE MG 1 39 MET QG 3.670 . 3.670 2.954 2.801 3.488 . 0 0 "[ . 1 . 2]" 1
1733 1 35 ILE MG 1 66 LEU QD 4.140 . 4.140 4.015 3.825 4.203 0.063 16 0 "[ . 1 . 2]" 1
1734 1 35 ILE MG 1 86 TRP QB 4.930 . 4.930 4.703 4.533 4.875 . 0 0 "[ . 1 . 2]" 1
1735 1 35 ILE MD 1 86 TRP QB 3.500 . 3.500 2.058 1.904 2.207 . 0 0 "[ . 1 . 2]" 1
1736 1 36 TYR H 1 36 TYR QB 2.970 . 2.970 2.218 2.133 2.500 . 0 0 "[ . 1 . 2]" 1
1737 1 36 TYR QB 1 37 GLU H 3.700 . 3.700 2.495 2.147 2.688 . 0 0 "[ . 1 . 2]" 1
1738 1 36 TYR QB 1 37 GLU HA 4.750 . 4.750 4.224 3.443 4.436 . 0 0 "[ . 1 . 2]" 1
1739 1 36 TYR QB 1 40 VAL MG2 4.360 . 4.360 4.232 3.211 4.378 0.018 11 0 "[ . 1 . 2]" 1
1740 1 37 GLU H 1 37 GLU QB 2.900 . 2.900 2.755 2.619 2.810 . 0 0 "[ . 1 . 2]" 1
1741 1 37 GLU QB 1 38 TRP H 3.950 . 3.950 3.383 3.316 3.487 . 0 0 "[ . 1 . 2]" 1
1742 1 37 GLU QB 1 41 ARG H 5.340 . 5.340 4.877 4.769 4.948 . 0 0 "[ . 1 . 2]" 1
1743 1 37 GLU QB 1 41 ARG QG 5.250 . 5.250 3.740 3.558 3.871 . 0 0 "[ . 1 . 2]" 1
1744 1 37 GLU QB 1 41 ARG HD3 5.340 . 5.340 3.397 3.126 3.727 . 0 0 "[ . 1 . 2]" 1
1745 1 39 MET H 1 39 MET QG 3.370 . 3.370 2.957 2.163 3.535 0.165 14 0 "[ . 1 . 2]" 1
1746 1 39 MET HA 1 42 CYS QB 4.850 . 4.850 3.898 3.318 4.340 . 0 0 "[ . 1 . 2]" 1
1747 1 39 MET ME 1 39 MET QG 3.250 . 3.250 2.421 2.340 2.518 . 0 0 "[ . 1 . 2]" 1
1748 1 39 MET QG 1 40 VAL H 4.130 . 4.130 3.365 2.109 4.187 0.057 1 0 "[ . 1 . 2]" 1
1749 1 39 MET QG 1 43 VAL MG1 4.330 . 4.330 3.284 2.970 3.581 . 0 0 "[ . 1 . 2]" 1
1750 1 39 MET QG 1 62 ILE MD 5.190 . 5.190 4.203 4.004 4.370 . 0 0 "[ . 1 . 2]" 1
1751 1 39 MET ME 1 62 ILE QG 4.230 . 4.230 3.510 3.351 3.659 . 0 0 "[ . 1 . 2]" 1
1752 1 41 ARG HA 1 42 CYS QB 5.330 . 5.330 4.833 4.774 4.966 . 0 0 "[ . 1 . 2]" 1
1753 1 41 ARG QB 1 42 CYS QB 5.290 . 5.290 3.101 3.008 3.170 . 0 0 "[ . 1 . 2]" 1
1754 1 42 CYS H 1 42 CYS QB 2.860 . 2.860 2.507 2.387 2.570 . 0 0 "[ . 1 . 2]" 1
1755 1 42 CYS QB 1 43 VAL H 3.450 . 3.450 3.005 2.691 3.168 . 0 0 "[ . 1 . 2]" 1
1756 1 42 CYS QB 1 43 VAL MG1 4.970 . 4.970 4.683 4.482 4.786 . 0 0 "[ . 1 . 2]" 1
1757 1 47 LYS H 1 49 LYS QE 5.340 . 5.340 5.313 5.040 5.416 0.076 13 0 "[ . 1 . 2]" 1
1758 1 48 ASP H 1 48 ASP QB 3.420 . 3.420 2.331 2.137 2.646 . 0 0 "[ . 1 . 2]" 1
1759 1 48 ASP HA 1 48 ASP QB 2.580 . 2.580 2.353 2.189 2.422 . 0 0 "[ . 1 . 2]" 1
1760 1 48 ASP QB 1 50 GLY H 5.220 . 5.220 4.352 4.191 4.651 . 0 0 "[ . 1 . 2]" 1
1761 1 49 LYS H 1 49 LYS QE 3.930 . 3.930 3.432 3.220 3.647 . 0 0 "[ . 1 . 2]" 1
1762 1 49 LYS HA 1 49 LYS QE 4.430 . 4.430 4.212 4.042 4.357 . 0 0 "[ . 1 . 2]" 1
1763 1 49 LYS HB2 1 49 LYS QE 4.640 . 4.640 4.233 4.177 4.392 . 0 0 "[ . 1 . 2]" 1
1764 1 49 LYS QE 1 49 LYS HG2 3.360 . 3.360 2.257 2.168 2.319 . 0 0 "[ . 1 . 2]" 1
1765 1 49 LYS QE 1 49 LYS HG3 3.280 . 3.280 2.514 2.390 2.925 . 0 0 "[ . 1 . 2]" 1
1766 1 49 LYS QE 1 54 SER QB 4.450 . 4.450 3.974 3.743 4.218 . 0 0 "[ . 1 . 2]" 1
1767 1 50 GLY H 1 51 ASP QB 4.890 . 4.890 4.066 3.760 4.569 . 0 0 "[ . 1 . 2]" 1
1768 1 50 GLY HA2 1 55 SER QB 4.660 . 4.660 3.358 2.374 3.917 . 0 0 "[ . 1 . 2]" 1
1769 1 50 GLY HA3 1 55 SER QB 5.340 . 5.340 4.898 3.982 5.355 0.015 13 0 "[ . 1 . 2]" 1
1770 1 51 ASP H 1 51 ASP QB 3.020 . 3.020 2.417 2.220 2.546 . 0 0 "[ . 1 . 2]" 1
1771 1 51 ASP QB 1 52 SER QB 4.150 . 4.150 4.015 3.411 4.262 0.112 14 0 "[ . 1 . 2]" 1
1772 1 55 SER QB 1 56 ALA H 3.250 . 3.250 2.264 1.876 2.890 . 0 0 "[ . 1 . 2]" 1
1773 1 55 SER QB 1 56 ALA MB 4.650 . 4.650 3.598 3.354 3.946 . 0 0 "[ . 1 . 2]" 1
1774 1 55 SER QB 1 59 LYS HB3 5.140 . 5.140 4.889 4.376 5.167 0.027 12 0 "[ . 1 . 2]" 1
1775 1 56 ALA HA 1 59 LYS QD 4.620 . 4.620 3.229 2.209 4.094 . 0 0 "[ . 1 . 2]" 1
1776 1 56 ALA HA 1 59 LYS QE 4.830 . 4.830 3.248 1.928 4.482 . 0 0 "[ . 1 . 2]" 1
1777 1 56 ALA MB 1 59 LYS QE 4.530 . 4.530 3.959 3.074 4.618 0.088 17 0 "[ . 1 . 2]" 1
1778 1 59 LYS HA 1 59 LYS QD 4.190 . 4.190 3.745 3.518 4.064 . 0 0 "[ . 1 . 2]" 1
1779 1 59 LYS HB3 1 59 LYS QD 3.680 . 3.680 2.723 2.105 3.507 . 0 0 "[ . 1 . 2]" 1
1780 1 59 LYS HB3 1 59 LYS QE 4.140 . 4.140 2.816 1.896 3.930 . 0 0 "[ . 1 . 2]" 1
1781 1 59 LYS QD 1 60 ASN H 4.430 . 4.430 3.266 2.823 3.778 . 0 0 "[ . 1 . 2]" 1
1782 1 59 LYS QD 1 60 ASN HA 4.290 . 4.290 2.732 2.340 3.356 . 0 0 "[ . 1 . 2]" 1
1783 1 59 LYS QD 1 60 ASN HD21 5.340 . 5.340 5.212 4.739 5.423 0.083 7 0 "[ . 1 . 2]" 1
1784 1 59 LYS QD 1 61 SER H 5.340 . 5.340 4.948 4.628 5.372 0.032 10 0 "[ . 1 . 2]" 1
1785 1 59 LYS QE 1 60 ASN QB 5.340 . 5.340 4.742 3.195 5.349 0.009 10 0 "[ . 1 . 2]" 1
1786 1 61 SER HA 1 64 HIS QB 3.830 . 3.830 3.394 2.885 3.850 0.020 3 0 "[ . 1 . 2]" 1
1787 1 62 ILE H 1 62 ILE QG 3.900 . 3.900 2.915 2.713 3.178 . 0 0 "[ . 1 . 2]" 1
1788 1 62 ILE HA 1 65 ASN QB 3.820 . 3.820 2.743 2.432 3.120 . 0 0 "[ . 1 . 2]" 1
1789 1 62 ILE HA 1 66 LEU QD 4.730 . 4.730 3.876 3.784 3.949 . 0 0 "[ . 1 . 2]" 1
1790 1 62 ILE MG 1 66 LEU QD 3.260 . 3.260 2.132 2.031 2.220 . 0 0 "[ . 1 . 2]" 1
1791 1 62 ILE MD 1 66 LEU QD 4.390 . 4.390 3.942 3.797 4.075 . 0 0 "[ . 1 . 2]" 1
1792 1 63 ARG H 1 66 LEU QD 4.010 . 4.010 3.947 3.790 4.079 0.069 20 0 "[ . 1 . 2]" 1
1793 1 63 ARG HA 1 66 LEU QD 3.220 . 3.220 2.213 1.936 2.488 . 0 0 "[ . 1 . 2]" 1
1794 1 63 ARG QB 1 66 LEU QD 4.270 . 4.270 3.825 3.624 4.011 . 0 0 "[ . 1 . 2]" 1
1795 1 63 ARG HG2 1 66 LEU QD 4.790 . 4.790 3.664 3.063 3.988 . 0 0 "[ . 1 . 2]" 1
1796 1 63 ARG HG3 1 66 LEU QD 4.610 . 4.610 4.359 4.106 4.616 0.006 9 0 "[ . 1 . 2]" 1
1797 1 64 HIS H 1 64 HIS QB 2.680 . 2.680 2.368 2.160 2.561 . 0 0 "[ . 1 . 2]" 1
1798 1 64 HIS QB 1 65 ASN H 2.960 . 2.960 2.695 2.490 2.864 . 0 0 "[ . 1 . 2]" 1
1799 1 64 HIS QB 1 65 ASN HA 4.520 . 4.520 3.997 3.744 4.257 . 0 0 "[ . 1 . 2]" 1
1800 1 65 ASN H 1 65 ASN QB 3.050 . 3.050 2.470 2.389 2.551 . 0 0 "[ . 1 . 2]" 1
1801 1 65 ASN H 1 66 LEU QD 4.650 . 4.650 3.661 3.466 3.843 . 0 0 "[ . 1 . 2]" 1
1802 1 65 ASN HA 1 68 LEU QB 5.050 . 5.050 2.747 2.290 3.752 . 0 0 "[ . 1 . 2]" 1
1803 1 65 ASN HA 1 68 LEU QD 3.500 . 3.500 2.069 1.882 2.495 . 0 0 "[ . 1 . 2]" 1
1804 1 65 ASN QB 1 66 LEU H 3.960 . 3.960 2.817 2.725 2.944 . 0 0 "[ . 1 . 2]" 1
1805 1 65 ASN QB 1 66 LEU QB 4.900 . 4.900 4.557 4.458 4.712 . 0 0 "[ . 1 . 2]" 1
1806 1 65 ASN QB 1 66 LEU QD 4.470 . 4.470 2.887 2.709 3.033 . 0 0 "[ . 1 . 2]" 1
1807 1 65 ASN QB 1 68 LEU QD 4.530 . 4.530 3.261 2.688 3.551 . 0 0 "[ . 1 . 2]" 1
1808 1 66 LEU H 1 66 LEU QD 3.740 . 3.740 2.168 2.025 2.462 . 0 0 "[ . 1 . 2]" 1
1809 1 66 LEU HA 1 66 LEU QD 3.160 . 3.160 2.750 2.402 2.945 . 0 0 "[ . 1 . 2]" 1
1810 1 66 LEU QD 1 67 SER H 4.820 . 4.820 4.015 3.723 4.202 . 0 0 "[ . 1 . 2]" 1
1811 1 66 LEU QD 1 72 PHE HA 5.120 . 5.120 5.050 4.907 5.136 0.016 13 0 "[ . 1 . 2]" 1
1812 1 66 LEU QD 1 72 PHE QB 3.680 . 3.680 3.070 2.753 3.204 . 0 0 "[ . 1 . 2]" 1
1813 1 66 LEU QD 1 73 MET HA 5.440 . 5.440 5.351 5.045 5.516 0.076 20 0 "[ . 1 . 2]" 1
1814 1 66 LEU QD 1 74 ARG HA 4.660 . 4.660 4.518 4.302 4.675 0.015 4 0 "[ . 1 . 2]" 1
1815 1 66 LEU QD 1 74 ARG HG3 4.670 . 4.670 3.675 3.125 4.200 . 0 0 "[ . 1 . 2]" 1
1816 1 66 LEU QD 1 86 TRP QB 3.600 . 3.600 1.936 1.862 2.038 . 0 0 "[ . 1 . 2]" 1
1817 1 66 LEU QD 1 86 TRP HE1 5.440 . 5.440 4.528 3.927 5.015 . 0 0 "[ . 1 . 2]" 1
1818 1 66 LEU QD 1 88 ILE HA 5.020 . 5.020 5.046 4.943 5.111 0.091 7 0 "[ . 1 . 2]" 1
1819 1 67 SER QB 1 68 LEU QB 5.340 . 5.340 4.980 4.341 5.375 0.035 3 0 "[ . 1 . 2]" 1
1820 1 68 LEU H 1 68 LEU QB 2.950 . 2.950 2.498 2.398 2.939 . 0 0 "[ . 1 . 2]" 1
1821 1 68 LEU H 1 68 LEU QD 3.900 . 3.900 3.327 2.960 3.516 . 0 0 "[ . 1 . 2]" 1
1822 1 68 LEU H 1 72 PHE QB 4.720 . 4.720 4.733 4.541 4.824 0.104 9 0 "[ . 1 . 2]" 1
1823 1 69 HIS QB 1 71 ARG QB 3.930 . 3.930 2.466 1.956 3.470 . 0 0 "[ . 1 . 2]" 1
1824 1 69 HIS QB 1 71 ARG QG 4.250 . 4.250 3.257 1.852 4.351 0.101 10 0 "[ . 1 . 2]" 1
1825 1 70 SER HA 1 89 ASN QD 4.750 . 4.750 4.335 3.993 4.761 0.011 7 0 "[ . 1 . 2]" 1
1826 1 71 ARG H 1 71 ARG QB 3.700 . 3.700 2.356 2.197 2.816 . 0 0 "[ . 1 . 2]" 1
1827 1 71 ARG H 1 72 PHE QB 4.720 . 4.720 4.396 4.072 4.638 . 0 0 "[ . 1 . 2]" 1
1828 1 71 ARG HA 1 71 ARG QG 3.350 . 3.350 2.525 2.319 3.326 . 0 0 "[ . 1 . 2]" 1
1829 1 71 ARG HA 1 71 ARG QD 4.250 . 4.250 4.070 3.949 4.250 0.000 20 0 "[ . 1 . 2]" 1
1830 1 71 ARG QB 1 71 ARG QG 2.360 . 2.360 2.079 2.064 2.094 . 0 0 "[ . 1 . 2]" 1
1831 1 71 ARG QB 1 71 ARG QD 2.940 . 2.940 2.130 2.032 2.338 . 0 0 "[ . 1 . 2]" 1
1832 1 71 ARG QB 1 72 PHE H 3.710 . 3.710 3.279 2.841 3.779 0.069 2 0 "[ . 1 . 2]" 1
1833 1 71 ARG QB 1 88 ILE MG 4.170 . 4.170 3.420 2.829 4.019 . 0 0 "[ . 1 . 2]" 1
1834 1 71 ARG QB 1 89 ASN HB3 5.340 . 5.340 4.539 4.091 4.917 . 0 0 "[ . 1 . 2]" 1
1835 1 71 ARG QG 1 89 ASN HB3 5.340 . 5.340 4.597 4.045 5.210 . 0 0 "[ . 1 . 2]" 1
1836 1 71 ARG QD 1 88 ILE MG 4.240 . 4.240 3.788 2.903 4.302 0.062 11 0 "[ . 1 . 2]" 1
1837 1 72 PHE QB 1 73 MET H 3.390 . 3.390 2.687 2.531 2.919 . 0 0 "[ . 1 . 2]" 1
1838 1 72 PHE QB 1 74 ARG HG2 5.340 . 5.340 4.517 3.990 4.879 . 0 0 "[ . 1 . 2]" 1
1839 1 72 PHE QB 1 74 ARG HG3 5.340 . 5.340 4.081 3.543 4.587 . 0 0 "[ . 1 . 2]" 1
1840 1 72 PHE QB 1 88 ILE HA 4.630 . 4.630 3.281 3.063 3.482 . 0 0 "[ . 1 . 2]" 1
1841 1 73 MET QG 1 75 VAL QG 3.940 . 3.940 3.037 2.496 3.706 . 0 0 "[ . 1 . 2]" 1
1842 1 73 MET QG 1 94 LYS QB 4.540 . 4.540 4.001 3.541 4.389 . 0 0 "[ . 1 . 2]" 1
1843 1 73 MET ME 1 75 VAL QG 3.860 . 3.860 2.734 2.257 3.170 . 0 0 "[ . 1 . 2]" 1
1844 1 74 ARG HA 1 74 ARG QD 4.150 . 4.150 4.080 4.019 4.155 0.005 1 0 "[ . 1 . 2]" 1
1845 1 74 ARG HA 1 75 VAL QG 3.930 . 3.930 2.967 2.799 3.189 . 0 0 "[ . 1 . 2]" 1
1846 1 74 ARG HA 1 86 TRP QB 4.390 . 4.390 4.023 3.714 4.224 . 0 0 "[ . 1 . 2]" 1
1847 1 74 ARG QB 1 74 ARG QD 2.950 . 2.950 2.251 2.036 2.409 . 0 0 "[ . 1 . 2]" 1
1848 1 74 ARG QD 1 84 SER QB 4.960 . 4.960 4.784 4.366 4.996 0.036 2 0 "[ . 1 . 2]" 1
1849 1 74 ARG QD 1 86 TRP QB 5.000 . 5.000 4.444 3.761 5.039 0.039 4 0 "[ . 1 . 2]" 1
1850 1 75 VAL H 1 75 VAL QG 3.140 . 3.140 2.491 2.263 2.669 . 0 0 "[ . 1 . 2]" 1
1851 1 75 VAL HA 1 75 VAL QG 2.860 . 2.860 2.070 2.029 2.106 . 0 0 "[ . 1 . 2]" 1
1852 1 75 VAL HB 1 94 LYS QB 5.340 . 5.340 4.322 3.762 5.421 0.081 13 0 "[ . 1 . 2]" 1
1853 1 75 VAL QG 1 76 GLN H 3.550 . 3.550 2.260 2.108 2.483 . 0 0 "[ . 1 . 2]" 1
1854 1 75 VAL QG 1 76 GLN HA 4.470 . 4.470 3.694 3.503 3.863 . 0 0 "[ . 1 . 2]" 1
1855 1 75 VAL QG 1 76 GLN QB 4.780 . 4.780 3.907 3.646 4.234 . 0 0 "[ . 1 . 2]" 1
1856 1 75 VAL QG 1 77 ASN H 5.130 . 5.130 4.772 4.543 5.013 . 0 0 "[ . 1 . 2]" 1
1857 1 75 VAL QG 1 77 ASN HA 4.790 . 4.790 4.284 4.059 4.767 . 0 0 "[ . 1 . 2]" 1
1858 1 75 VAL QG 1 84 SER HA 5.280 . 5.280 4.817 4.328 5.185 . 0 0 "[ . 1 . 2]" 1
1859 1 75 VAL QG 1 85 TRP H 4.120 . 4.120 3.633 3.108 3.931 . 0 0 "[ . 1 . 2]" 1
1860 1 75 VAL QG 1 85 TRP QB 3.640 . 3.640 2.890 2.631 3.289 . 0 0 "[ . 1 . 2]" 1
1861 1 75 VAL QG 1 86 TRP H 5.040 . 5.040 4.887 4.559 5.066 0.026 17 0 "[ . 1 . 2]" 1
1862 1 75 VAL QG 1 86 TRP HA 5.100 . 5.100 3.791 3.357 4.086 . 0 0 "[ . 1 . 2]" 1
1863 1 75 VAL QG 1 87 ILE HA 5.440 . 5.440 4.911 4.647 5.090 . 0 0 "[ . 1 . 2]" 1
1864 1 75 VAL QG 1 87 ILE HB 5.440 . 5.440 4.184 4.013 4.388 . 0 0 "[ . 1 . 2]" 1
1865 1 75 VAL QG 1 87 ILE MG 3.030 . 3.030 1.962 1.824 2.062 . 0 0 "[ . 1 . 2]" 1
1866 1 75 VAL QG 1 94 LYS HA 5.440 . 5.440 4.253 3.670 4.845 . 0 0 "[ . 1 . 2]" 1
1867 1 75 VAL QG 1 94 LYS QB 4.480 . 4.480 2.150 1.812 2.960 . 0 0 "[ . 1 . 2]" 1
1868 1 75 VAL QG 1 94 LYS QG 4.300 . 4.300 2.701 2.295 3.284 . 0 0 "[ . 1 . 2]" 1
1869 1 75 VAL QG 1 96 GLY QA 4.460 . 4.460 2.081 1.676 2.639 . 0 0 "[ . 1 . 2]" 1
1870 1 76 GLN HA 1 76 GLN QE 4.520 . 4.520 4.114 2.530 4.588 0.068 6 0 "[ . 1 . 2]" 1
1871 1 76 GLN QB 1 76 GLN QE 3.860 . 3.860 2.462 1.770 3.674 . 0 0 "[ . 1 . 2]" 1
1872 1 76 GLN QB 1 77 ASN QB 4.520 . 4.520 3.984 3.725 4.321 . 0 0 "[ . 1 . 2]" 1
1873 1 76 GLN QG 1 77 ASN QB 5.340 . 5.340 5.193 4.549 5.417 0.077 19 0 "[ . 1 . 2]" 1
1874 1 77 ASN H 1 77 ASN QB 3.070 . 3.070 2.352 2.228 2.516 . 0 0 "[ . 1 . 2]" 1
1875 1 77 ASN HA 1 78 GLU QB 4.790 . 4.790 4.373 3.542 4.792 0.002 4 0 "[ . 1 . 2]" 1
1876 1 77 ASN QB 1 78 GLU H 3.880 . 3.880 2.573 1.714 3.376 . 0 0 "[ . 1 . 2]" 1
1877 1 77 ASN QB 1 78 GLU HA 5.030 . 5.030 4.386 4.165 4.676 . 0 0 "[ . 1 . 2]" 1
1878 1 77 ASN QB 1 78 GLU QB 4.760 . 4.760 4.179 3.078 4.779 0.019 11 0 "[ . 1 . 2]" 1
1879 1 77 ASN QB 1 79 GLY H 4.790 . 4.790 2.673 2.036 3.439 . 0 0 "[ . 1 . 2]" 1
1880 1 77 ASN QB 1 84 SER HA 5.340 . 5.340 4.449 3.774 5.280 . 0 0 "[ . 1 . 2]" 1
1881 1 77 ASN QB 1 85 TRP HE1 4.340 . 4.340 4.028 3.224 4.407 0.067 8 0 "[ . 1 . 2]" 1
1882 1 78 GLU H 1 78 GLU QB 3.070 . 3.070 2.410 2.115 2.772 . 0 0 "[ . 1 . 2]" 1
1883 1 78 GLU QB 1 79 GLY H 3.750 . 3.750 2.948 2.123 3.799 0.049 2 0 "[ . 1 . 2]" 1
1884 1 78 GLU QB 1 79 GLY QA 4.230 . 4.230 3.804 3.387 4.246 0.016 17 0 "[ . 1 . 2]" 1
1885 1 82 LYS H 1 83 SER QB 5.340 . 5.340 4.398 3.465 5.408 0.068 20 0 "[ . 1 . 2]" 1
1886 1 83 SER H 1 83 SER QB 3.270 . 3.270 2.574 2.266 3.051 . 0 0 "[ . 1 . 2]" 1
1887 1 86 TRP H 1 86 TRP QB 3.140 . 3.140 2.712 2.656 2.801 . 0 0 "[ . 1 . 2]" 1
1888 1 86 TRP QB 1 87 ILE H 4.160 . 4.160 3.048 2.911 3.142 . 0 0 "[ . 1 . 2]" 1
1889 1 87 ILE MG 1 94 LYS QB 4.280 . 4.280 2.475 1.945 3.087 . 0 0 "[ . 1 . 2]" 1
1890 1 87 ILE QG 1 94 LYS QB 4.770 . 4.770 3.430 3.055 4.043 . 0 0 "[ . 1 . 2]" 1
1891 1 87 ILE MD 1 94 LYS QB 3.850 . 3.850 2.247 1.783 3.546 . 0 0 "[ . 1 . 2]" 1
1892 1 90 PRO HA 1 91 ASP QB 4.700 . 4.700 4.489 4.234 4.857 0.157 7 0 "[ . 1 . 2]" 1
1893 1 90 PRO QB 1 91 ASP QB 4.610 . 4.610 3.615 3.085 4.561 . 0 0 "[ . 1 . 2]" 1
1894 1 91 ASP QB 1 93 GLY H 5.340 . 5.340 4.802 3.544 5.369 0.029 10 0 "[ . 1 . 2]" 1
1895 1 97 LYS H 1 97 LYS QD 4.240 . 4.240 3.696 2.122 4.385 0.145 18 0 "[ . 1 . 2]" 1
1896 1 100 ARG H 1 100 ARG QB 3.510 . 3.510 2.795 2.285 3.387 . 0 0 "[ . 1 . 2]" 1
1897 1 40 VAL MG2 1 50 GLY H 5.000 . 5.000 3.978 3.607 4.271 . 0 0 "[ . 1 . 2]" 1
1898 1 90 PRO HG2 1 92 GLY H 5.000 . 5.000 2.516 2.213 3.512 . 0 0 "[ . 1 . 2]" 1
1899 1 73 MET QB 1 87 ILE H 5.500 . 5.500 5.173 5.076 5.249 . 0 0 "[ . 1 . 2]" 1
1900 1 57 GLY HA3 1 60 ASN HD21 5.000 . 5.000 3.762 3.510 4.204 . 0 0 "[ . 1 . 2]" 1
1901 1 27 ASP HB3 1 29 ARG H 4.500 . 4.500 3.083 2.573 3.704 . 0 0 "[ . 1 . 2]" 1
1902 1 22 ILE MD 1 86 TRP H 5.000 . 5.000 4.946 4.756 5.024 0.024 2 0 "[ . 1 . 2]" 1
1903 1 30 LEU MD2 1 86 TRP H 4.500 . 4.500 4.433 4.360 4.470 . 0 0 "[ . 1 . 2]" 1
1904 1 13 SER HB2 1 15 ALA H 4.000 . 4.000 3.255 2.866 3.518 . 0 0 "[ . 1 . 2]" 1
1905 1 22 ILE MG 1 88 ILE H 4.000 . 4.000 2.324 2.053 2.467 . 0 0 "[ . 1 . 2]" 1
1906 1 40 VAL MG2 1 47 LYS H 6.000 . 6.000 4.826 4.699 5.014 . 0 0 "[ . 1 . 2]" 1
1907 1 30 LEU HA 1 34 GLN H 5.500 . 5.500 5.414 5.150 5.598 0.098 4 0 "[ . 1 . 2]" 1
1908 1 57 GLY HA3 1 60 ASN H 4.500 . 4.500 4.522 4.375 4.610 0.110 4 0 "[ . 1 . 2]" 1
1909 1 32 LEU MD2 1 63 ARG H 6.500 . 6.500 4.298 3.434 4.764 . 0 0 "[ . 1 . 2]" 1
1910 1 63 ARG H 1 66 LEU MD1 5.000 . 5.000 4.035 3.842 4.198 . 0 0 "[ . 1 . 2]" 1
1911 1 25 SER HB3 1 28 LYS H 4.000 . 4.000 3.886 3.651 4.105 0.105 18 0 "[ . 1 . 2]" 1
1912 1 26 PRO QD 1 30 LEU H 6.000 . 6.000 6.119 6.088 6.158 0.158 13 0 "[ . 1 . 2]" 1
1913 1 30 LEU HB3 1 35 ILE H 3.910 . 3.910 3.174 2.954 3.451 . 0 0 "[ . 1 . 2]" 1
1914 1 57 GLY H 1 60 ASN HA 5.500 . 5.500 5.641 5.582 5.685 0.185 1 0 "[ . 1 . 2]" 1
1915 1 30 LEU MD1 1 31 THR H 5.270 . 5.270 3.696 3.638 3.796 . 0 0 "[ . 1 . 2]" 1
1916 1 73 MET H 1 86 TRP HB3 6.000 . 6.000 5.415 5.218 5.665 . 0 0 "[ . 1 . 2]" 1
1917 1 30 LEU HB2 1 86 TRP H 5.500 . 5.500 4.170 4.099 4.328 . 0 0 "[ . 1 . 2]" 1
1918 1 30 LEU MD1 1 86 TRP H 5.000 . 5.000 5.128 5.105 5.176 0.176 4 0 "[ . 1 . 2]" 1
1919 1 56 ALA HA 1 60 ASN H 4.660 . 4.660 3.657 3.053 4.642 . 0 0 "[ . 1 . 2]" 1
1920 1 54 SER H 1 57 GLY HA2 6.000 . 6.000 6.134 6.043 6.184 0.184 19 0 "[ . 1 . 2]" 1
1921 1 57 GLY O 1 60 ASN H 3.500 . 3.500 2.694 1.797 3.442 . 0 0 "[ . 1 . 2]" 1
1922 1 57 GLY HA3 1 60 ASN QD 4.830 . 4.830 3.586 3.330 4.050 . 0 0 "[ . 1 . 2]" 1
1923 1 40 VAL HB 1 43 VAL QG 5.000 . 5.000 4.408 4.345 4.478 . 0 0 "[ . 1 . 2]" 1
1924 1 40 VAL QG 1 43 VAL QG 3.870 . 3.870 2.907 2.848 2.971 . 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 46
_Distance_constraint_stats_list.Viol_count 426
_Distance_constraint_stats_list.Viol_total 448.735
_Distance_constraint_stats_list.Viol_max 0.153
_Distance_constraint_stats_list.Viol_rms 0.0355
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0244
_Distance_constraint_stats_list.Viol_average_violations_only 0.0527
_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 14 TYR 1.097 0.088 3 0 "[ . 1 . 2]"
1 15 ALA 1.201 0.071 14 0 "[ . 1 . 2]"
1 16 ASP 0.012 0.012 13 0 "[ . 1 . 2]"
1 17 LEU 2.908 0.129 4 0 "[ . 1 . 2]"
1 18 ILE 1.097 0.088 3 0 "[ . 1 . 2]"
1 19 THR 1.201 0.071 14 0 "[ . 1 . 2]"
1 20 ARG 0.012 0.012 13 0 "[ . 1 . 2]"
1 21 ALA 2.908 0.129 4 0 "[ . 1 . 2]"
1 22 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 30 LEU 1.292 0.074 4 0 "[ . 1 . 2]"
1 31 THR 3.687 0.110 17 0 "[ . 1 . 2]"
1 32 LEU 0.027 0.027 10 0 "[ . 1 . 2]"
1 33 SER 2.706 0.147 15 0 "[ . 1 . 2]"
1 34 GLN 3.687 0.110 17 0 "[ . 1 . 2]"
1 35 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 36 TYR 0.672 0.062 11 0 "[ . 1 . 2]"
1 37 GLU 4.558 0.147 8 0 "[ . 1 . 2]"
1 38 TRP 0.000 0.000 . 0 "[ . 1 . 2]"
1 39 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 40 VAL 0.646 0.062 11 0 "[ . 1 . 2]"
1 41 ARG 1.852 0.147 8 0 "[ . 1 . 2]"
1 47 LYS 2.448 0.153 19 0 "[ . 1 . 2]"
1 48 ASP 1.610 0.104 13 0 "[ . 1 . 2]"
1 50 GLY 2.448 0.153 19 0 "[ . 1 . 2]"
1 51 ASP 1.610 0.104 13 0 "[ . 1 . 2]"
1 55 SER 1.869 0.148 6 0 "[ . 1 . 2]"
1 59 LYS 1.869 0.148 6 0 "[ . 1 . 2]"
1 73 MET 0.996 0.070 13 0 "[ . 1 . 2]"
1 75 VAL 0.087 0.034 10 0 "[ . 1 . 2]"
1 85 TRP 0.087 0.034 10 0 "[ . 1 . 2]"
1 86 TRP 1.292 0.074 4 0 "[ . 1 . 2]"
1 87 ILE 0.996 0.070 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 19 THR O 1 23 GLU H 2.000 . 2.000 1.794 1.726 1.830 . 0 0 "[ . 1 . 2]" 2
2 1 19 THR O 1 23 GLU N 3.000 . 3.000 2.751 2.685 2.813 . 0 0 "[ . 1 . 2]" 2
3 1 36 TYR O 1 40 VAL H 2.000 . 2.000 2.016 1.958 2.062 0.062 11 0 "[ . 1 . 2]" 2
4 1 36 TYR O 1 40 VAL N 3.000 . 3.000 2.997 2.936 3.044 0.044 11 0 "[ . 1 . 2]" 2
5 1 35 ILE O 1 39 MET H 2.000 . 2.000 1.795 1.748 1.864 . 0 0 "[ . 1 . 2]" 2
6 1 35 ILE O 1 39 MET N 3.000 . 3.000 2.717 2.675 2.763 . 0 0 "[ . 1 . 2]" 2
7 1 18 ILE O 1 22 ILE H 2.000 . 2.000 1.912 1.844 1.971 . 0 0 "[ . 1 . 2]" 2
8 1 18 ILE O 1 22 ILE N 3.000 . 3.000 2.886 2.821 2.951 . 0 0 "[ . 1 . 2]" 2
9 1 14 TYR O 1 18 ILE H 2.000 . 2.000 2.041 2.000 2.088 0.088 3 0 "[ . 1 . 2]" 2
10 1 14 TYR O 1 18 ILE N 3.000 . 3.000 3.007 2.955 3.069 0.069 3 0 "[ . 1 . 2]" 2
11 1 33 SER O 1 37 GLU H 2.000 . 2.000 2.088 2.047 2.147 0.147 15 0 "[ . 1 . 2]" 2
12 1 33 SER O 1 37 GLU N 3.000 . 3.000 3.048 3.005 3.104 0.104 15 0 "[ . 1 . 2]" 2
13 1 32 LEU O 1 36 TYR H 2.000 . 2.000 1.931 1.859 2.027 0.027 10 0 "[ . 1 . 2]" 2
14 1 32 LEU O 1 36 TYR N 3.000 . 3.000 2.827 2.761 2.910 . 0 0 "[ . 1 . 2]" 2
15 1 17 LEU O 1 21 ALA H 2.000 . 2.000 2.096 2.070 2.129 0.129 4 0 "[ . 1 . 2]" 2
16 1 17 LEU O 1 21 ALA N 3.000 . 3.000 3.050 3.021 3.082 0.082 8 0 "[ . 1 . 2]" 2
17 1 15 ALA O 1 19 THR H 2.000 . 2.000 2.052 2.036 2.071 0.071 14 0 "[ . 1 . 2]" 2
18 1 15 ALA O 1 19 THR N 3.000 . 3.000 3.006 2.982 3.020 0.020 14 0 "[ . 1 . 2]" 2
19 1 16 ASP O 1 20 ARG H 2.000 . 2.000 1.883 1.790 2.012 0.012 13 0 "[ . 1 . 2]" 2
20 1 16 ASP O 1 20 ARG N 3.000 . 3.000 2.765 2.698 2.897 . 0 0 "[ . 1 . 2]" 2
21 1 31 THR OG1 1 34 GLN H 2.000 . 2.000 2.086 2.062 2.110 0.110 17 0 "[ . 1 . 2]" 2
22 1 31 THR OG1 1 34 GLN N 3.000 . 3.000 3.061 3.037 3.091 0.091 16 0 "[ . 1 . 2]" 2
23 1 31 THR H 1 34 GLN OE1 2.000 . 2.000 2.033 2.004 2.061 0.061 12 0 "[ . 1 . 2]" 2
24 1 31 THR N 1 34 GLN OE1 3.000 . 3.000 2.988 2.928 3.022 0.022 1 0 "[ . 1 . 2]" 2
25 1 34 GLN O 1 38 TRP H 2.000 . 2.000 1.829 1.751 1.913 . 0 0 "[ . 1 . 2]" 2
26 1 34 GLN O 1 38 TRP N 3.000 . 3.000 2.799 2.724 2.879 . 0 0 "[ . 1 . 2]" 2
27 1 31 THR O 1 35 ILE H 2.000 . 2.000 1.798 1.735 1.884 . 0 0 "[ . 1 . 2]" 2
28 1 31 THR O 1 35 ILE N 3.000 . 3.000 2.742 2.674 2.833 . 0 0 "[ . 1 . 2]" 2
29 1 30 LEU H 1 86 TRP O 2.000 . 2.000 2.049 2.010 2.074 0.074 4 0 "[ . 1 . 2]" 2
30 1 30 LEU N 1 86 TRP O 3.000 . 3.000 3.014 2.976 3.042 0.042 4 0 "[ . 1 . 2]" 2
31 1 30 LEU O 1 86 TRP H 2.000 . 2.000 1.715 1.670 1.845 . 0 0 "[ . 1 . 2]" 2
32 1 30 LEU O 1 86 TRP N 3.000 . 3.000 2.647 2.618 2.729 . 0 0 "[ . 1 . 2]" 2
33 1 75 VAL O 1 85 TRP H 2.000 . 2.000 1.876 1.706 2.034 0.034 10 0 "[ . 1 . 2]" 2
34 1 75 VAL O 1 85 TRP N 3.000 . 3.000 2.805 2.688 2.979 . 0 0 "[ . 1 . 2]" 2
35 1 73 MET O 1 87 ILE H 2.000 . 2.000 2.041 2.016 2.070 0.070 13 0 "[ . 1 . 2]" 2
36 1 73 MET O 1 87 ILE N 3.000 . 3.000 2.979 2.953 3.000 . 0 0 "[ . 1 . 2]" 2
37 1 73 MET H 1 87 ILE O 2.000 . 2.000 1.987 1.869 2.045 0.045 12 0 "[ . 1 . 2]" 2
38 1 73 MET N 1 87 ILE O 3.000 . 3.000 2.923 2.822 2.991 . 0 0 "[ . 1 . 2]" 2
39 1 37 GLU O 1 41 ARG H 2.000 . 2.000 2.092 2.053 2.147 0.147 8 0 "[ . 1 . 2]" 2
40 1 37 GLU O 1 41 ARG N 3.000 . 3.000 2.952 2.901 3.005 0.005 13 0 "[ . 1 . 2]" 2
41 1 47 LYS O 1 50 GLY H 2.000 . 2.000 2.117 2.087 2.153 0.153 19 0 "[ . 1 . 2]" 2
42 1 47 LYS O 1 50 GLY N 3.000 . 3.000 2.984 2.931 3.028 0.028 4 0 "[ . 1 . 2]" 2
43 1 48 ASP O 1 51 ASP H 2.000 . 2.000 2.073 2.041 2.104 0.104 13 0 "[ . 1 . 2]" 2
44 1 48 ASP O 1 51 ASP N 3.000 . 3.000 2.992 2.917 3.023 0.023 6 0 "[ . 1 . 2]" 2
45 1 55 SER O 1 59 LYS H 2.000 . 2.000 2.086 2.044 2.148 0.148 6 0 "[ . 1 . 2]" 2
46 1 55 SER O 1 59 LYS N 3.000 . 3.000 2.981 2.919 3.034 0.034 4 0 "[ . 1 . 2]" 2
stop_
save_
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