NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
613831 |
2nbn   |
25984 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2nbn
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 1748
_Distance_constraint_stats_list.Viol_count 4573
_Distance_constraint_stats_list.Viol_total 6869.768
_Distance_constraint_stats_list.Viol_max 0.467
_Distance_constraint_stats_list.Viol_rms 0.0356
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0098
_Distance_constraint_stats_list.Viol_average_violations_only 0.0751
_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 2 SER 2.412 0.178 12 0 "[ . 1 . 2]"
1 3 VAL 8.897 0.341 12 0 "[ . 1 . 2]"
1 4 GLU 1.809 0.211 19 0 "[ . 1 . 2]"
1 5 THR 3.110 0.431 16 0 "[ . 1 . 2]"
1 6 ILE 14.062 0.303 3 0 "[ . 1 . 2]"
1 7 ILE 6.497 0.341 12 0 "[ . 1 . 2]"
1 8 GLU 5.204 0.431 16 0 "[ . 1 . 2]"
1 9 ARG 2.988 0.181 7 0 "[ . 1 . 2]"
1 10 ILE 2.577 0.181 7 0 "[ . 1 . 2]"
1 11 LYS 7.338 0.432 9 0 "[ . 1 . 2]"
1 12 ALA 7.949 0.331 12 0 "[ . 1 . 2]"
1 13 ARG 4.936 0.331 12 0 "[ . 1 . 2]"
1 14 VAL 8.674 0.432 9 0 "[ . 1 . 2]"
1 15 GLY 1.424 0.160 12 0 "[ . 1 . 2]"
1 16 ALA 4.723 0.197 9 0 "[ . 1 . 2]"
1 17 VAL 9.469 0.202 8 0 "[ . 1 . 2]"
1 18 ASP 10.155 0.225 11 0 "[ . 1 . 2]"
1 19 PRO 6.565 0.211 11 0 "[ . 1 . 2]"
1 20 ASN 4.664 0.140 11 0 "[ . 1 . 2]"
1 21 GLY 16.324 0.225 11 0 "[ . 1 . 2]"
1 22 PRO 2.506 0.133 8 0 "[ . 1 . 2]"
1 23 ARG 6.391 0.382 2 0 "[ . 1 . 2]"
1 24 LYS 4.757 0.177 15 0 "[ . 1 . 2]"
1 25 VAL 10.393 0.329 20 0 "[ . 1 . 2]"
1 26 LEU 1.629 0.338 11 0 "[ . 1 . 2]"
1 27 GLY 4.834 0.338 11 0 "[ . 1 . 2]"
1 28 VAL 10.729 0.265 16 0 "[ . 1 . 2]"
1 29 PHE 11.456 0.179 7 0 "[ . 1 . 2]"
1 30 GLN 2.239 0.148 13 0 "[ . 1 . 2]"
1 31 LEU 3.306 0.301 20 0 "[ . 1 . 2]"
1 32 ASN 5.960 0.365 11 0 "[ . 1 . 2]"
1 33 ILE 8.958 0.365 11 0 "[ . 1 . 2]"
1 34 LYS 17.481 0.363 7 0 "[ . 1 . 2]"
1 35 THR 9.361 0.290 9 0 "[ . 1 . 2]"
1 36 ALA 0.846 0.290 9 0 "[ . 1 . 2]"
1 37 SER 0.166 0.064 11 0 "[ . 1 . 2]"
1 38 GLY 6.617 0.218 11 0 "[ . 1 . 2]"
1 39 VAL 17.561 0.230 10 0 "[ . 1 . 2]"
1 40 GLU 3.997 0.164 18 0 "[ . 1 . 2]"
1 41 GLN 12.259 0.232 15 0 "[ . 1 . 2]"
1 42 TRP 8.428 0.186 15 0 "[ . 1 . 2]"
1 43 ILE 9.802 0.192 2 0 "[ . 1 . 2]"
1 44 VAL 12.019 0.455 19 0 "[ . 1 . 2]"
1 45 ASP 10.552 0.455 19 0 "[ . 1 . 2]"
1 46 LEU 16.626 0.213 10 0 "[ . 1 . 2]"
1 47 LYS 6.395 0.224 8 0 "[ . 1 . 2]"
1 48 GLN 9.184 0.156 1 0 "[ . 1 . 2]"
1 49 LEU 7.588 0.217 5 0 "[ . 1 . 2]"
1 50 LYS 12.332 0.296 2 0 "[ . 1 . 2]"
1 51 VAL 18.159 0.467 17 0 "[ . 1 . 2]"
1 52 ASP 7.150 0.467 17 0 "[ . 1 . 2]"
1 53 GLN 5.735 0.274 7 0 "[ . 1 . 2]"
1 54 GLY 4.248 0.274 7 0 "[ . 1 . 2]"
1 55 VAL 4.601 0.192 2 0 "[ . 1 . 2]"
1 56 PHE 3.134 0.192 2 0 "[ . 1 . 2]"
1 57 ALA 0.021 0.021 11 0 "[ . 1 . 2]"
1 58 SER 2.383 0.192 2 0 "[ . 1 . 2]"
1 59 PRO 1.945 0.160 20 0 "[ . 1 . 2]"
1 60 ASP 0.174 0.029 8 0 "[ . 1 . 2]"
1 61 VAL 6.859 0.160 20 0 "[ . 1 . 2]"
1 62 THR 3.667 0.140 19 0 "[ . 1 . 2]"
1 63 VAL 7.360 0.307 5 0 "[ . 1 . 2]"
1 64 THR 7.464 0.307 5 0 "[ . 1 . 2]"
1 65 VAL 13.157 0.459 6 0 "[ . 1 . 2]"
1 66 GLY 8.515 0.363 7 0 "[ . 1 . 2]"
1 67 LEU 7.752 0.259 15 0 "[ . 1 . 2]"
1 68 GLU 1.911 0.159 15 0 "[ . 1 . 2]"
1 69 ASP 1.916 0.181 3 0 "[ . 1 . 2]"
1 70 MET 3.672 0.177 2 0 "[ . 1 . 2]"
1 71 LEU 5.013 0.303 3 0 "[ . 1 . 2]"
1 72 ALA 4.920 0.152 16 0 "[ . 1 . 2]"
1 73 ILE 6.989 0.178 6 0 "[ . 1 . 2]"
1 74 SER 3.638 0.168 17 0 "[ . 1 . 2]"
1 75 GLY 2.694 0.268 16 0 "[ . 1 . 2]"
1 76 LYS 2.602 0.276 15 0 "[ . 1 . 2]"
1 77 THR 3.886 0.344 13 0 "[ . 1 . 2]"
1 78 LEU 8.076 0.256 10 0 "[ . 1 . 2]"
1 79 THR 2.602 0.074 15 0 "[ . 1 . 2]"
1 80 VAL 1.635 0.066 4 0 "[ . 1 . 2]"
1 81 GLY 1.706 0.066 4 0 "[ . 1 . 2]"
1 82 ASP 2.462 0.152 19 0 "[ . 1 . 2]"
1 83 ALA 0.647 0.127 6 0 "[ . 1 . 2]"
1 84 LEU 4.686 0.196 7 0 "[ . 1 . 2]"
1 85 LYS 4.068 0.196 7 0 "[ . 1 . 2]"
1 86 GLN 1.786 0.123 15 0 "[ . 1 . 2]"
1 87 GLY 0.917 0.123 15 0 "[ . 1 . 2]"
1 88 LYS 0.589 0.127 6 0 "[ . 1 . 2]"
1 89 ILE 9.155 0.459 6 0 "[ . 1 . 2]"
1 90 GLU 4.268 0.157 6 0 "[ . 1 . 2]"
1 91 LEU 6.982 0.198 6 0 "[ . 1 . 2]"
1 92 SER 1.393 0.060 12 0 "[ . 1 . 2]"
1 93 GLY 2.884 0.097 17 0 "[ . 1 . 2]"
1 94 ASP 7.185 0.159 12 0 "[ . 1 . 2]"
1 95 ALA 2.724 0.159 12 0 "[ . 1 . 2]"
1 96 ASP 0.028 0.028 20 0 "[ . 1 . 2]"
1 97 LEU 9.472 0.275 3 0 "[ . 1 . 2]"
1 98 ALA 6.321 0.215 20 0 "[ . 1 . 2]"
1 99 ALA 1.370 0.064 1 0 "[ . 1 . 2]"
1 100 LYS 1.192 0.102 19 0 "[ . 1 . 2]"
1 101 LEU 12.675 0.266 5 0 "[ . 1 . 2]"
1 102 ALA 5.615 0.266 5 0 "[ . 1 . 2]"
1 103 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 104 VAL 1.242 0.142 19 0 "[ . 1 . 2]"
1 105 ILE 1.383 0.179 12 0 "[ . 1 . 2]"
1 106 HIS 0.043 0.007 18 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 SER H 1 3 VAL H . . 4.570 4.408 4.326 4.590 0.020 12 0 "[ . 1 . 2]" 1
2 1 2 SER HA 1 4 GLU H . . 4.850 4.395 4.179 4.775 . 0 0 "[ . 1 . 2]" 1
3 1 2 SER HA 1 6 ILE MD . . 4.140 4.174 3.708 4.318 0.178 12 0 "[ . 1 . 2]" 1
4 1 2 SER QB 1 3 VAL H . . 3.430 2.398 1.924 2.855 . 0 0 "[ . 1 . 2]" 1
5 1 2 SER QB 1 4 GLU H . . 3.860 2.539 2.354 2.760 . 0 0 "[ . 1 . 2]" 1
6 1 2 SER QB 1 5 THR H . . 3.660 3.662 3.372 3.761 0.101 12 0 "[ . 1 . 2]" 1
7 1 2 SER HB2 1 3 VAL H . . 4.070 3.422 2.808 3.860 . 0 0 "[ . 1 . 2]" 1
8 1 2 SER HB2 1 4 GLU H . . 4.440 3.649 2.486 4.410 . 0 0 "[ . 1 . 2]" 1
9 1 2 SER HB3 1 3 VAL H . . 4.070 2.453 1.953 2.941 . 0 0 "[ . 1 . 2]" 1
10 1 2 SER HB3 1 4 GLU H . . 4.440 2.846 2.369 3.669 . 0 0 "[ . 1 . 2]" 1
11 1 3 VAL H 1 3 VAL HB . . 3.560 2.548 2.236 3.602 0.042 19 0 "[ . 1 . 2]" 1
12 1 3 VAL H 1 3 VAL MG1 . . 3.430 3.061 1.903 3.769 0.339 5 0 "[ . 1 . 2]" 1
13 1 3 VAL H 1 3 VAL MG2 . . 3.430 2.882 1.959 3.701 0.271 4 0 "[ . 1 . 2]" 1
14 1 3 VAL H 1 4 GLU H . . 4.440 2.808 2.612 2.916 . 0 0 "[ . 1 . 2]" 1
15 1 3 VAL HA 1 3 VAL MG1 . . 3.660 2.734 2.233 3.186 . 0 0 "[ . 1 . 2]" 1
16 1 3 VAL HA 1 3 VAL MG2 . . 3.660 2.301 2.071 3.190 . 0 0 "[ . 1 . 2]" 1
17 1 3 VAL HA 1 6 ILE H . . 5.190 3.144 2.911 3.408 . 0 0 "[ . 1 . 2]" 1
18 1 3 VAL HA 1 6 ILE HB . . 4.640 2.633 2.206 3.031 . 0 0 "[ . 1 . 2]" 1
19 1 3 VAL HA 1 6 ILE MD . . 3.790 3.539 2.388 3.886 0.096 15 0 "[ . 1 . 2]" 1
20 1 3 VAL HB 1 4 GLU H . . 3.840 3.349 2.426 4.051 0.211 19 0 "[ . 1 . 2]" 1
21 1 3 VAL QG 1 4 GLU H . . 3.640 2.597 1.975 3.387 . 0 0 "[ . 1 . 2]" 1
22 1 3 VAL QG 1 4 GLU HA . . 3.720 3.192 2.883 3.625 . 0 0 "[ . 1 . 2]" 1
23 1 3 VAL QG 1 6 ILE H . . 4.230 3.969 3.764 4.277 0.047 19 0 "[ . 1 . 2]" 1
24 1 3 VAL QG 1 7 ILE H . . 3.610 3.282 2.806 3.951 0.341 12 0 "[ . 1 . 2]" 1
25 1 3 VAL QG 1 7 ILE MD . . 4.450 3.183 2.776 4.124 . 0 0 "[ . 1 . 2]" 1
26 1 3 VAL QG 1 33 ILE MD . . 3.220 2.342 1.841 2.834 . 0 0 "[ . 1 . 2]" 1
27 1 3 VAL QG 1 33 ILE MG . . 3.000 2.405 1.971 2.869 . 0 0 "[ . 1 . 2]" 1
28 1 3 VAL QG 1 40 GLU QB . . 4.000 3.145 2.656 3.775 . 0 0 "[ . 1 . 2]" 1
29 1 3 VAL QG 1 40 GLU QG . . 3.750 3.085 2.336 3.758 0.008 9 0 "[ . 1 . 2]" 1
30 1 3 VAL QG 1 42 TRP HD1 . . 4.460 4.076 3.471 4.484 0.024 5 0 "[ . 1 . 2]" 1
31 1 3 VAL QG 1 42 TRP HE1 . . 3.370 2.590 2.219 2.958 . 0 0 "[ . 1 . 2]" 1
32 1 3 VAL QG 1 42 TRP HH2 . . 4.610 3.842 3.583 4.067 . 0 0 "[ . 1 . 2]" 1
33 1 3 VAL QG 1 42 TRP HZ2 . . 4.340 2.472 2.071 2.807 . 0 0 "[ . 1 . 2]" 1
34 1 3 VAL QG 1 42 TRP HZ3 . . 5.090 5.168 5.109 5.242 0.152 7 0 "[ . 1 . 2]" 1
35 1 3 VAL QG 1 67 LEU QB . . 5.160 4.773 4.135 5.237 0.077 7 0 "[ . 1 . 2]" 1
36 1 3 VAL QG 1 67 LEU QD . . 3.670 2.409 1.780 3.045 . 0 0 "[ . 1 . 2]" 1
37 1 3 VAL MG1 1 4 GLU H . . 4.220 2.862 1.981 3.775 . 0 0 "[ . 1 . 2]" 1
38 1 3 VAL MG1 1 40 GLU HG2 . . 5.500 4.799 4.074 5.506 0.006 9 0 "[ . 1 . 2]" 1
39 1 3 VAL MG1 1 40 GLU HG3 . . 5.500 3.787 2.678 5.107 . 0 0 "[ . 1 . 2]" 1
40 1 3 VAL MG1 1 42 TRP HE1 . . 4.460 3.087 2.248 3.980 . 0 0 "[ . 1 . 2]" 1
41 1 3 VAL MG2 1 4 GLU H . . 4.220 3.780 2.117 4.092 . 0 0 "[ . 1 . 2]" 1
42 1 3 VAL MG2 1 40 GLU HG2 . . 5.500 4.582 3.484 5.484 . 0 0 "[ . 1 . 2]" 1
43 1 3 VAL MG2 1 40 GLU HG3 . . 5.500 3.664 2.684 4.569 . 0 0 "[ . 1 . 2]" 1
44 1 3 VAL MG2 1 42 TRP HE1 . . 4.460 3.178 2.309 4.143 . 0 0 "[ . 1 . 2]" 1
45 1 4 GLU H 1 4 GLU HB2 . . 4.110 2.896 2.477 3.595 . 0 0 "[ . 1 . 2]" 1
46 1 4 GLU H 1 4 GLU QB . . 3.400 2.303 2.232 2.515 . 0 0 "[ . 1 . 2]" 1
47 1 4 GLU H 1 4 GLU HB3 . . 4.110 2.465 2.397 2.569 . 0 0 "[ . 1 . 2]" 1
48 1 4 GLU H 1 4 GLU QG . . 4.110 3.431 2.036 3.991 . 0 0 "[ . 1 . 2]" 1
49 1 4 GLU H 1 5 THR H . . 4.070 2.774 2.648 2.952 . 0 0 "[ . 1 . 2]" 1
50 1 4 GLU HA 1 4 GLU HG2 . . 4.010 3.498 3.237 3.842 . 0 0 "[ . 1 . 2]" 1
51 1 4 GLU HA 1 4 GLU HG3 . . 4.010 2.994 2.414 3.868 . 0 0 "[ . 1 . 2]" 1
52 1 4 GLU HA 1 7 ILE H . . 4.830 3.909 3.519 4.277 . 0 0 "[ . 1 . 2]" 1
53 1 4 GLU HA 1 7 ILE HB . . 3.440 3.373 3.237 3.481 0.041 12 0 "[ . 1 . 2]" 1
54 1 4 GLU HA 1 7 ILE MG . . 4.560 4.613 4.572 4.694 0.134 18 0 "[ . 1 . 2]" 1
55 1 4 GLU HB2 1 5 THR H . . 4.360 3.903 3.684 4.085 . 0 0 "[ . 1 . 2]" 1
56 1 4 GLU HB3 1 5 THR H . . 4.360 3.024 2.258 3.990 . 0 0 "[ . 1 . 2]" 1
57 1 4 GLU QG 1 6 ILE H . . 5.090 4.796 4.198 5.132 0.042 9 0 "[ . 1 . 2]" 1
58 1 4 GLU HG2 1 5 THR H . . 4.890 3.280 2.124 4.429 . 0 0 "[ . 1 . 2]" 1
59 1 4 GLU HG3 1 5 THR H . . 4.890 3.829 2.314 4.657 . 0 0 "[ . 1 . 2]" 1
60 1 5 THR H 1 5 THR HB . . 3.850 2.759 2.432 3.649 . 0 0 "[ . 1 . 2]" 1
61 1 5 THR H 1 5 THR MG . . 4.020 3.594 2.202 3.788 . 0 0 "[ . 1 . 2]" 1
62 1 5 THR H 1 6 ILE H . . 4.220 2.468 2.364 2.747 . 0 0 "[ . 1 . 2]" 1
63 1 5 THR HA 1 5 THR MG . . 3.320 2.304 2.028 3.178 . 0 0 "[ . 1 . 2]" 1
64 1 5 THR HA 1 6 ILE MD . . 4.680 4.514 4.360 4.724 0.044 17 0 "[ . 1 . 2]" 1
65 1 5 THR HA 1 8 GLU H . . 3.620 3.604 3.391 3.694 0.074 15 0 "[ . 1 . 2]" 1
66 1 5 THR HA 1 8 GLU HB2 . . 3.700 2.701 2.255 4.131 0.431 16 0 "[ . 1 . 2]" 1
67 1 5 THR HA 1 8 GLU QB . . 3.210 2.416 2.233 2.970 . 0 0 "[ . 1 . 2]" 1
68 1 5 THR HA 1 8 GLU HB3 . . 3.700 3.532 2.532 3.842 0.142 14 0 "[ . 1 . 2]" 1
69 1 5 THR HA 1 8 GLU HG2 . . 4.280 3.899 1.995 4.320 0.040 19 0 "[ . 1 . 2]" 1
70 1 5 THR HA 1 8 GLU HG3 . . 4.280 3.276 2.838 4.254 . 0 0 "[ . 1 . 2]" 1
71 1 5 THR HB 1 6 ILE H . . 4.070 2.974 2.331 4.104 0.034 13 0 "[ . 1 . 2]" 1
72 1 5 THR MG 1 6 ILE H . . 4.630 3.775 2.211 4.233 . 0 0 "[ . 1 . 2]" 1
73 1 6 ILE H 1 6 ILE HB . . 3.490 2.655 2.270 2.768 . 0 0 "[ . 1 . 2]" 1
74 1 6 ILE H 1 6 ILE MD . . 3.800 2.467 1.885 2.899 . 0 0 "[ . 1 . 2]" 1
75 1 6 ILE H 1 6 ILE HG12 . . 4.620 2.366 1.906 4.170 . 0 0 "[ . 1 . 2]" 1
76 1 6 ILE H 1 6 ILE QG . . 4.060 2.233 1.898 3.561 . 0 0 "[ . 1 . 2]" 1
77 1 6 ILE H 1 6 ILE HG13 . . 4.620 3.547 3.487 3.864 . 0 0 "[ . 1 . 2]" 1
78 1 6 ILE H 1 6 ILE MG . . 3.870 3.747 3.638 3.785 . 0 0 "[ . 1 . 2]" 1
79 1 6 ILE H 1 7 ILE H . . 3.830 2.671 2.461 2.972 . 0 0 "[ . 1 . 2]" 1
80 1 6 ILE HA 1 6 ILE MD . . 3.150 2.245 1.976 2.786 . 0 0 "[ . 1 . 2]" 1
81 1 6 ILE HA 1 6 ILE MG . . 3.250 2.229 2.099 2.567 . 0 0 "[ . 1 . 2]" 1
82 1 6 ILE HA 1 9 ARG H . . 4.630 3.885 3.526 4.182 . 0 0 "[ . 1 . 2]" 1
83 1 6 ILE HA 1 9 ARG QB . . 5.200 3.674 2.926 4.862 . 0 0 "[ . 1 . 2]" 1
84 1 6 ILE HA 1 9 ARG QD . . 4.430 3.952 2.322 4.460 0.030 17 0 "[ . 1 . 2]" 1
85 1 6 ILE HA 1 10 ILE H . . 5.240 4.993 4.388 5.296 0.056 3 0 "[ . 1 . 2]" 1
86 1 6 ILE HB 1 6 ILE MD . . 2.960 3.045 2.330 3.226 0.266 6 0 "[ . 1 . 2]" 1
87 1 6 ILE HB 1 7 ILE H . . 3.590 2.379 2.207 2.645 . 0 0 "[ . 1 . 2]" 1
88 1 6 ILE MD 1 7 ILE H . . 4.130 4.264 3.996 4.422 0.292 17 0 "[ . 1 . 2]" 1
89 1 6 ILE MD 1 9 ARG QD . . 4.750 4.620 3.592 4.857 0.107 17 0 "[ . 1 . 2]" 1
90 1 6 ILE MD 1 71 LEU H . . 4.040 3.974 3.589 4.164 0.124 17 0 "[ . 1 . 2]" 1
91 1 6 ILE MD 1 71 LEU HA . . 3.950 2.174 1.933 2.377 . 0 0 "[ . 1 . 2]" 1
92 1 6 ILE MD 1 71 LEU QB . . 3.830 3.395 1.831 3.744 . 0 0 "[ . 1 . 2]" 1
93 1 6 ILE MD 1 71 LEU QD . . 2.570 2.006 1.828 2.873 0.303 3 0 "[ . 1 . 2]" 1
94 1 6 ILE MD 1 74 SER QB . . 3.330 2.181 1.930 3.139 . 0 0 "[ . 1 . 2]" 1
95 1 6 ILE MD 1 75 GLY H . . 3.990 4.119 4.043 4.258 0.268 16 0 "[ . 1 . 2]" 1
96 1 6 ILE HG12 1 6 ILE MG . . 3.540 2.974 2.145 3.186 . 0 0 "[ . 1 . 2]" 1
97 1 6 ILE HG12 1 7 ILE H . . 5.500 3.969 3.617 5.061 . 0 0 "[ . 1 . 2]" 1
98 1 6 ILE HG13 1 6 ILE MG . . 3.540 2.264 2.132 2.566 . 0 0 "[ . 1 . 2]" 1
99 1 6 ILE HG13 1 7 ILE H . . 5.500 4.696 4.520 4.940 . 0 0 "[ . 1 . 2]" 1
100 1 6 ILE MG 1 7 ILE H . . 3.620 3.422 2.650 3.698 0.078 7 0 "[ . 1 . 2]" 1
101 1 6 ILE MG 1 10 ILE MD . . 3.090 2.754 1.781 3.127 0.037 3 0 "[ . 1 . 2]" 1
102 1 6 ILE MG 1 70 MET ME . . 3.260 2.874 2.034 3.290 0.030 17 0 "[ . 1 . 2]" 1
103 1 7 ILE H 1 7 ILE HB . . 3.740 2.460 2.402 2.545 . 0 0 "[ . 1 . 2]" 1
104 1 7 ILE H 1 7 ILE MD . . 4.130 3.395 3.076 3.607 . 0 0 "[ . 1 . 2]" 1
105 1 7 ILE H 1 7 ILE QG . . 4.600 2.262 2.099 2.387 . 0 0 "[ . 1 . 2]" 1
106 1 7 ILE H 1 7 ILE MG . . 4.230 3.753 3.738 3.765 . 0 0 "[ . 1 . 2]" 1
107 1 7 ILE H 1 8 GLU H . . 4.150 2.584 2.437 2.780 . 0 0 "[ . 1 . 2]" 1
108 1 7 ILE HA 1 7 ILE MD . . 3.230 2.016 1.945 2.091 . 0 0 "[ . 1 . 2]" 1
109 1 7 ILE HA 1 7 ILE MG . . 3.550 2.396 2.337 2.452 . 0 0 "[ . 1 . 2]" 1
110 1 7 ILE HA 1 9 ARG H . . 5.190 4.034 3.810 4.289 . 0 0 "[ . 1 . 2]" 1
111 1 7 ILE HA 1 10 ILE H . . 3.320 3.105 2.966 3.380 0.060 19 0 "[ . 1 . 2]" 1
112 1 7 ILE HA 1 10 ILE HB . . 3.350 2.611 2.111 2.987 . 0 0 "[ . 1 . 2]" 1
113 1 7 ILE HA 1 10 ILE MD . . 3.350 2.013 1.907 2.475 . 0 0 "[ . 1 . 2]" 1
114 1 7 ILE HA 1 10 ILE MG . . 4.350 3.987 3.532 4.238 . 0 0 "[ . 1 . 2]" 1
115 1 7 ILE HA 1 11 LYS H . . 4.190 3.911 3.604 4.268 0.078 18 0 "[ . 1 . 2]" 1
116 1 7 ILE HB 1 8 GLU H . . 3.630 2.833 2.421 2.992 . 0 0 "[ . 1 . 2]" 1
117 1 7 ILE MD 1 7 ILE MG . . 3.250 2.030 1.913 2.140 . 0 0 "[ . 1 . 2]" 1
118 1 7 ILE MD 1 8 GLU H . . 5.180 4.685 4.600 4.776 . 0 0 "[ . 1 . 2]" 1
119 1 7 ILE MD 1 10 ILE H . . 4.820 4.484 4.249 4.762 . 0 0 "[ . 1 . 2]" 1
120 1 7 ILE MD 1 10 ILE HB . . 3.760 3.138 2.697 3.769 0.009 19 0 "[ . 1 . 2]" 1
121 1 7 ILE MD 1 10 ILE MD . . 3.500 1.953 1.755 2.539 . 0 0 "[ . 1 . 2]" 1
122 1 7 ILE MD 1 10 ILE MG . . 4.100 3.483 2.877 4.111 0.011 19 0 "[ . 1 . 2]" 1
123 1 7 ILE MD 1 31 LEU MD1 . . 3.980 3.329 1.854 4.035 0.055 8 0 "[ . 1 . 2]" 1
124 1 7 ILE MD 1 31 LEU QD . . 3.460 1.917 1.733 2.335 . 0 0 "[ . 1 . 2]" 1
125 1 7 ILE MD 1 31 LEU MD2 . . 3.980 2.422 1.736 4.068 0.088 19 0 "[ . 1 . 2]" 1
126 1 7 ILE MD 1 33 ILE MD . . 4.630 2.795 2.379 3.261 . 0 0 "[ . 1 . 2]" 1
127 1 7 ILE MD 1 42 TRP HB2 . . 5.480 3.614 3.296 4.051 . 0 0 "[ . 1 . 2]" 1
128 1 7 ILE MD 1 42 TRP QB . . 4.700 3.107 2.838 3.521 . 0 0 "[ . 1 . 2]" 1
129 1 7 ILE MD 1 42 TRP HB3 . . 5.480 3.395 3.063 3.892 . 0 0 "[ . 1 . 2]" 1
130 1 7 ILE MD 1 42 TRP HD1 . . 5.500 4.064 3.808 4.307 . 0 0 "[ . 1 . 2]" 1
131 1 7 ILE MD 1 42 TRP HE1 . . 4.420 4.382 4.110 4.496 0.076 18 0 "[ . 1 . 2]" 1
132 1 7 ILE MD 1 42 TRP HE3 . . 4.980 3.934 3.310 4.529 . 0 0 "[ . 1 . 2]" 1
133 1 7 ILE MD 1 51 VAL QG . . 4.760 3.178 2.743 3.700 . 0 0 "[ . 1 . 2]" 1
134 1 7 ILE MD 1 70 MET ME . . 4.380 3.192 2.253 3.816 . 0 0 "[ . 1 . 2]" 1
135 1 7 ILE MG 1 8 GLU H . . 4.400 3.519 3.132 3.673 . 0 0 "[ . 1 . 2]" 1
136 1 7 ILE MG 1 8 GLU HA . . 5.310 3.503 3.261 3.677 . 0 0 "[ . 1 . 2]" 1
137 1 7 ILE MG 1 10 ILE H . . 4.690 4.019 3.771 4.371 . 0 0 "[ . 1 . 2]" 1
138 1 7 ILE MG 1 10 ILE HB . . 4.010 2.848 2.390 3.395 . 0 0 "[ . 1 . 2]" 1
139 1 7 ILE MG 1 11 LYS H . . 4.780 3.074 2.677 3.500 . 0 0 "[ . 1 . 2]" 1
140 1 7 ILE MG 1 11 LYS QE . . 4.830 3.682 1.868 4.843 0.013 1 0 "[ . 1 . 2]" 1
141 1 7 ILE MG 1 11 LYS QG . . 4.730 2.758 2.185 3.646 . 0 0 "[ . 1 . 2]" 1
142 1 7 ILE MG 1 42 TRP HE3 . . 5.500 3.365 3.010 3.601 . 0 0 "[ . 1 . 2]" 1
143 1 7 ILE MG 1 42 TRP HH2 . . 4.030 4.008 3.406 4.107 0.077 7 0 "[ . 1 . 2]" 1
144 1 7 ILE MG 1 42 TRP HZ3 . . 4.610 3.219 2.840 3.485 . 0 0 "[ . 1 . 2]" 1
145 1 8 GLU H 1 8 GLU HB2 . . 3.740 2.429 2.101 3.546 . 0 0 "[ . 1 . 2]" 1
146 1 8 GLU H 1 8 GLU QB . . 3.050 2.151 2.082 2.265 . 0 0 "[ . 1 . 2]" 1
147 1 8 GLU H 1 8 GLU HB3 . . 3.740 3.215 2.224 3.550 . 0 0 "[ . 1 . 2]" 1
148 1 8 GLU H 1 8 GLU HG2 . . 3.890 3.132 2.621 3.648 . 0 0 "[ . 1 . 2]" 1
149 1 8 GLU H 1 8 GLU QG . . 3.360 2.916 2.572 3.154 . 0 0 "[ . 1 . 2]" 1
150 1 8 GLU H 1 8 GLU HG3 . . 3.890 3.679 2.842 4.066 0.176 13 0 "[ . 1 . 2]" 1
151 1 8 GLU H 1 9 ARG H . . 4.170 2.762 2.587 2.897 . 0 0 "[ . 1 . 2]" 1
152 1 8 GLU HA 1 8 GLU QG . . 3.650 2.517 2.082 3.447 . 0 0 "[ . 1 . 2]" 1
153 1 8 GLU HA 1 11 LYS H . . 4.050 3.945 3.782 4.174 0.124 7 0 "[ . 1 . 2]" 1
154 1 8 GLU HA 1 11 LYS HB2 . . 5.500 4.874 4.611 5.390 . 0 0 "[ . 1 . 2]" 1
155 1 8 GLU HA 1 11 LYS QG . . 4.700 2.232 1.944 2.665 . 0 0 "[ . 1 . 2]" 1
156 1 8 GLU HA 1 12 ALA H . . 4.260 4.337 4.272 4.434 0.174 18 0 "[ . 1 . 2]" 1
157 1 8 GLU QB 1 9 ARG H . . 3.720 2.892 2.573 3.492 . 0 0 "[ . 1 . 2]" 1
158 1 8 GLU HB2 1 9 ARG H . . 4.240 3.196 2.844 4.108 . 0 0 "[ . 1 . 2]" 1
159 1 8 GLU HB3 1 9 ARG H . . 4.240 3.346 2.855 3.797 . 0 0 "[ . 1 . 2]" 1
160 1 8 GLU QG 1 9 ARG H . . 4.390 3.971 1.943 4.499 0.109 9 0 "[ . 1 . 2]" 1
161 1 8 GLU HG2 1 9 ARG H . . 5.260 4.497 1.967 4.918 . 0 0 "[ . 1 . 2]" 1
162 1 8 GLU HG3 1 9 ARG H . . 5.260 4.596 2.000 5.215 . 0 0 "[ . 1 . 2]" 1
163 1 9 ARG H 1 9 ARG QB . . 3.640 2.258 2.061 2.662 . 0 0 "[ . 1 . 2]" 1
164 1 9 ARG H 1 9 ARG QD . . 5.010 3.399 2.584 4.356 . 0 0 "[ . 1 . 2]" 1
165 1 9 ARG H 1 9 ARG QG . . 4.490 3.215 1.937 3.989 . 0 0 "[ . 1 . 2]" 1
166 1 9 ARG H 1 10 ILE H . . 3.350 2.477 2.438 2.556 . 0 0 "[ . 1 . 2]" 1
167 1 9 ARG H 1 10 ILE MD . . 5.090 4.704 4.515 5.046 . 0 0 "[ . 1 . 2]" 1
168 1 9 ARG H 1 10 ILE QG . . 4.630 4.078 3.692 4.366 . 0 0 "[ . 1 . 2]" 1
169 1 9 ARG HA 1 9 ARG QD . . 4.650 3.357 2.297 4.150 . 0 0 "[ . 1 . 2]" 1
170 1 9 ARG HA 1 9 ARG QG . . 3.720 2.354 2.004 3.343 . 0 0 "[ . 1 . 2]" 1
171 1 9 ARG HA 1 12 ALA H . . 4.300 3.699 3.395 3.822 . 0 0 "[ . 1 . 2]" 1
172 1 9 ARG HA 1 12 ALA MB . . 4.370 2.739 2.101 3.030 . 0 0 "[ . 1 . 2]" 1
173 1 9 ARG HA 1 13 ARG H . . 4.580 4.332 4.112 4.559 . 0 0 "[ . 1 . 2]" 1
174 1 9 ARG QB 1 10 ILE H . . 3.280 2.817 2.609 3.461 0.181 7 0 "[ . 1 . 2]" 1
175 1 9 ARG HB2 1 10 ILE H . . 3.830 3.196 2.649 3.911 0.081 17 0 "[ . 1 . 2]" 1
176 1 9 ARG HB3 1 10 ILE H . . 3.830 3.362 2.793 4.007 0.177 18 0 "[ . 1 . 2]" 1
177 1 9 ARG QD 1 10 ILE H . . 4.960 4.802 3.778 5.042 0.082 10 0 "[ . 1 . 2]" 1
178 1 9 ARG QG 1 10 ILE H . . 4.450 4.146 1.890 4.558 0.108 1 0 "[ . 1 . 2]" 1
179 1 10 ILE H 1 10 ILE HB . . 3.090 2.480 2.355 2.674 . 0 0 "[ . 1 . 2]" 1
180 1 10 ILE H 1 10 ILE MD . . 3.730 3.349 3.176 3.588 . 0 0 "[ . 1 . 2]" 1
181 1 10 ILE H 1 10 ILE QG . . 4.150 2.234 1.902 2.508 . 0 0 "[ . 1 . 2]" 1
182 1 10 ILE H 1 10 ILE MG . . 3.940 3.752 3.716 3.772 . 0 0 "[ . 1 . 2]" 1
183 1 10 ILE H 1 11 LYS H . . 3.770 2.780 2.687 2.926 . 0 0 "[ . 1 . 2]" 1
184 1 10 ILE H 1 12 ALA H . . 5.500 3.963 3.859 4.196 . 0 0 "[ . 1 . 2]" 1
185 1 10 ILE H 1 13 ARG H . . 5.090 4.726 4.561 4.957 . 0 0 "[ . 1 . 2]" 1
186 1 10 ILE HA 1 10 ILE MD . . 4.150 3.852 3.807 3.891 . 0 0 "[ . 1 . 2]" 1
187 1 10 ILE HA 1 10 ILE QG . . 3.600 2.412 2.336 2.482 . 0 0 "[ . 1 . 2]" 1
188 1 10 ILE HA 1 10 ILE MG . . 3.180 2.409 2.312 2.502 . 0 0 "[ . 1 . 2]" 1
189 1 10 ILE HA 1 12 ALA H . . 4.690 4.257 4.060 4.604 . 0 0 "[ . 1 . 2]" 1
190 1 10 ILE HA 1 13 ARG H . . 4.080 3.418 3.203 3.799 . 0 0 "[ . 1 . 2]" 1
191 1 10 ILE HA 1 13 ARG QB . . 4.760 2.842 2.534 3.471 . 0 0 "[ . 1 . 2]" 1
192 1 10 ILE HB 1 10 ILE MD . . 3.630 2.315 2.189 2.417 . 0 0 "[ . 1 . 2]" 1
193 1 10 ILE HB 1 11 LYS H . . 3.460 2.279 2.209 2.348 . 0 0 "[ . 1 . 2]" 1
194 1 10 ILE MD 1 10 ILE MG . . 2.710 2.164 1.993 2.390 . 0 0 "[ . 1 . 2]" 1
195 1 10 ILE MD 1 11 LYS H . . 4.450 4.196 4.077 4.352 . 0 0 "[ . 1 . 2]" 1
196 1 10 ILE MD 1 70 MET ME . . 3.680 2.514 1.858 3.098 . 0 0 "[ . 1 . 2]" 1
197 1 10 ILE QG 1 10 ILE MG . . 3.010 2.211 2.080 2.311 . 0 0 "[ . 1 . 2]" 1
198 1 10 ILE QG 1 11 LYS H . . 5.240 3.994 3.731 4.116 . 0 0 "[ . 1 . 2]" 1
199 1 10 ILE HG12 1 10 ILE MG . . 3.640 2.257 2.111 2.372 . 0 0 "[ . 1 . 2]" 1
200 1 10 ILE HG13 1 10 ILE MG . . 3.640 3.173 3.150 3.199 . 0 0 "[ . 1 . 2]" 1
201 1 10 ILE MG 1 11 LYS H . . 3.610 3.027 2.706 3.355 . 0 0 "[ . 1 . 2]" 1
202 1 10 ILE MG 1 51 VAL MG1 . . 3.580 3.508 3.075 3.723 0.143 11 0 "[ . 1 . 2]" 1
203 1 10 ILE MG 1 51 VAL MG2 . . 3.580 3.231 2.409 3.611 0.031 12 0 "[ . 1 . 2]" 1
204 1 11 LYS H 1 11 LYS HB2 . . 3.940 3.580 3.566 3.597 . 0 0 "[ . 1 . 2]" 1
205 1 11 LYS H 1 11 LYS QE . . 4.210 3.935 3.034 4.320 0.110 6 0 "[ . 1 . 2]" 1
206 1 11 LYS H 1 11 LYS HG2 . . 3.920 2.300 1.955 2.504 . 0 0 "[ . 1 . 2]" 1
207 1 11 LYS H 1 11 LYS HG3 . . 3.920 2.605 2.171 3.449 . 0 0 "[ . 1 . 2]" 1
208 1 11 LYS H 1 12 ALA H . . 3.660 2.794 2.636 2.880 . 0 0 "[ . 1 . 2]" 1
209 1 11 LYS H 1 13 ARG H . . 5.420 4.309 4.118 4.611 . 0 0 "[ . 1 . 2]" 1
210 1 11 LYS HA 1 11 LYS QD . . 4.620 4.349 4.201 4.519 . 0 0 "[ . 1 . 2]" 1
211 1 11 LYS HA 1 11 LYS HG2 . . 4.000 3.838 3.619 3.936 . 0 0 "[ . 1 . 2]" 1
212 1 11 LYS HA 1 11 LYS QG . . 3.380 3.321 3.305 3.342 . 0 0 "[ . 1 . 2]" 1
213 1 11 LYS HA 1 11 LYS HG3 . . 4.000 3.653 3.570 3.909 . 0 0 "[ . 1 . 2]" 1
214 1 11 LYS HA 1 14 VAL H . . 4.430 3.597 3.245 3.988 . 0 0 "[ . 1 . 2]" 1
215 1 11 LYS HA 1 14 VAL HB . . 4.070 3.477 2.448 4.502 0.432 9 0 "[ . 1 . 2]" 1
216 1 11 LYS HA 1 14 VAL MG1 . . 4.700 3.787 3.607 4.076 . 0 0 "[ . 1 . 2]" 1
217 1 11 LYS HA 1 14 VAL QG . . 3.490 1.930 1.840 2.043 . 0 0 "[ . 1 . 2]" 1
218 1 11 LYS HA 1 14 VAL MG2 . . 4.700 1.936 1.845 2.051 . 0 0 "[ . 1 . 2]" 1
219 1 11 LYS HA 1 15 GLY H . . 4.200 4.105 3.884 4.253 0.053 15 0 "[ . 1 . 2]" 1
220 1 11 LYS HA 1 51 VAL QG . . 3.350 2.111 1.917 2.361 . 0 0 "[ . 1 . 2]" 1
221 1 11 LYS HB2 1 11 LYS HD2 . . 4.030 2.796 1.984 3.714 . 0 0 "[ . 1 . 2]" 1
222 1 11 LYS HB2 1 11 LYS QD . . 3.350 2.202 1.946 3.179 . 0 0 "[ . 1 . 2]" 1
223 1 11 LYS HB2 1 11 LYS HD3 . . 4.030 2.903 1.961 3.778 . 0 0 "[ . 1 . 2]" 1
224 1 11 LYS HB2 1 12 ALA H . . 3.490 3.607 3.478 3.761 0.271 12 0 "[ . 1 . 2]" 1
225 1 11 LYS HB2 1 51 VAL QG . . 4.110 2.819 2.380 3.509 . 0 0 "[ . 1 . 2]" 1
226 1 11 LYS HB3 1 14 VAL QG . . 3.830 3.780 3.638 3.948 0.118 13 0 "[ . 1 . 2]" 1
227 1 11 LYS QD 1 12 ALA H . . 5.060 3.869 3.334 4.231 . 0 0 "[ . 1 . 2]" 1
228 1 11 LYS HE2 1 12 ALA H . . 5.500 4.523 3.021 5.503 0.003 16 0 "[ . 1 . 2]" 1
229 1 11 LYS HE3 1 12 ALA H . . 5.500 4.087 2.367 5.523 0.023 19 0 "[ . 1 . 2]" 1
230 1 11 LYS QG 1 12 ALA H . . 3.360 2.000 1.904 2.158 . 0 0 "[ . 1 . 2]" 1
231 1 12 ALA H 1 12 ALA MB . . 2.910 2.140 2.030 2.234 . 0 0 "[ . 1 . 2]" 1
232 1 12 ALA H 1 13 ARG H . . 3.430 2.632 2.439 2.859 . 0 0 "[ . 1 . 2]" 1
233 1 12 ALA H 1 14 VAL QG . . 4.660 4.050 3.563 4.520 . 0 0 "[ . 1 . 2]" 1
234 1 12 ALA H 1 51 VAL QG . . 4.560 4.707 4.586 4.778 0.218 4 0 "[ . 1 . 2]" 1
235 1 12 ALA HA 1 15 GLY H . . 4.980 3.947 3.739 4.109 . 0 0 "[ . 1 . 2]" 1
236 1 12 ALA MB 1 13 ARG H . . 3.140 2.608 2.279 2.877 . 0 0 "[ . 1 . 2]" 1
237 1 12 ALA MB 1 13 ARG QD . . 5.340 4.911 3.870 5.671 0.331 12 0 "[ . 1 . 2]" 1
238 1 13 ARG H 1 13 ARG HB2 . . 3.760 2.591 2.505 2.694 . 0 0 "[ . 1 . 2]" 1
239 1 13 ARG H 1 13 ARG QB . . 3.290 2.281 2.228 2.474 . 0 0 "[ . 1 . 2]" 1
240 1 13 ARG H 1 13 ARG HB3 . . 3.760 2.600 2.382 3.606 . 0 0 "[ . 1 . 2]" 1
241 1 13 ARG H 1 13 ARG QD . . 4.560 4.184 3.666 4.537 . 0 0 "[ . 1 . 2]" 1
242 1 13 ARG H 1 13 ARG QG . . 4.150 3.838 2.170 4.043 . 0 0 "[ . 1 . 2]" 1
243 1 13 ARG H 1 14 VAL H . . 3.460 2.584 2.436 2.861 . 0 0 "[ . 1 . 2]" 1
244 1 13 ARG H 1 14 VAL QG . . 3.810 3.592 3.255 3.925 0.115 20 0 "[ . 1 . 2]" 1
245 1 13 ARG H 1 15 GLY H . . 4.790 4.245 3.937 4.437 . 0 0 "[ . 1 . 2]" 1
246 1 13 ARG HA 1 13 ARG HD2 . . 4.750 3.243 2.047 4.478 . 0 0 "[ . 1 . 2]" 1
247 1 13 ARG HA 1 13 ARG QD . . 3.920 2.421 1.965 3.937 0.017 4 0 "[ . 1 . 2]" 1
248 1 13 ARG HA 1 13 ARG HD3 . . 4.750 2.832 1.975 4.366 . 0 0 "[ . 1 . 2]" 1
249 1 13 ARG HA 1 13 ARG HG2 . . 3.880 3.453 2.433 3.812 . 0 0 "[ . 1 . 2]" 1
250 1 13 ARG HA 1 13 ARG QG . . 3.340 2.811 2.393 3.059 . 0 0 "[ . 1 . 2]" 1
251 1 13 ARG HA 1 13 ARG HG3 . . 3.880 3.176 2.839 3.792 . 0 0 "[ . 1 . 2]" 1
252 1 13 ARG HA 1 16 ALA H . . 3.320 3.415 3.324 3.472 0.152 18 0 "[ . 1 . 2]" 1
253 1 13 ARG HA 1 16 ALA MB . . 3.480 2.195 1.982 2.407 . 0 0 "[ . 1 . 2]" 1
254 1 13 ARG HA 1 17 VAL H . . 4.720 4.630 4.448 4.727 0.007 18 0 "[ . 1 . 2]" 1
255 1 13 ARG HA 1 17 VAL QG . . 4.490 4.496 4.296 4.598 0.108 11 0 "[ . 1 . 2]" 1
256 1 13 ARG QB 1 13 ARG QD . . 3.330 2.321 1.951 2.851 . 0 0 "[ . 1 . 2]" 1
257 1 13 ARG QB 1 14 VAL H . . 3.630 2.479 2.298 2.688 . 0 0 "[ . 1 . 2]" 1
258 1 13 ARG HB2 1 14 VAL H . . 4.210 3.708 2.620 4.005 . 0 0 "[ . 1 . 2]" 1
259 1 13 ARG HB3 1 14 VAL H . . 4.210 2.622 2.320 3.744 . 0 0 "[ . 1 . 2]" 1
260 1 13 ARG QD 1 16 ALA H . . 4.880 4.553 3.970 5.004 0.124 6 0 "[ . 1 . 2]" 1
261 1 13 ARG QD 1 16 ALA MB . . 4.980 3.301 2.405 4.910 . 0 0 "[ . 1 . 2]" 1
262 1 13 ARG QD 1 17 VAL QG . . 4.690 3.684 2.402 4.782 0.092 6 0 "[ . 1 . 2]" 1
263 1 13 ARG QG 1 14 VAL H . . 3.850 3.657 3.218 3.986 0.136 7 0 "[ . 1 . 2]" 1
264 1 14 VAL H 1 14 VAL HB . . 3.440 3.077 2.575 3.608 0.168 12 0 "[ . 1 . 2]" 1
265 1 14 VAL H 1 14 VAL MG1 . . 3.820 3.192 2.370 3.768 . 0 0 "[ . 1 . 2]" 1
266 1 14 VAL H 1 14 VAL QG . . 2.990 1.959 1.823 2.135 . 0 0 "[ . 1 . 2]" 1
267 1 14 VAL H 1 14 VAL MG2 . . 3.820 1.991 1.892 2.147 . 0 0 "[ . 1 . 2]" 1
268 1 14 VAL H 1 15 GLY H . . 3.320 2.884 2.820 2.964 . 0 0 "[ . 1 . 2]" 1
269 1 14 VAL H 1 16 ALA H . . 4.440 3.933 3.872 3.972 . 0 0 "[ . 1 . 2]" 1
270 1 14 VAL HA 1 14 VAL MG1 . . 3.420 2.263 2.072 2.433 . 0 0 "[ . 1 . 2]" 1
271 1 14 VAL HA 1 14 VAL QG . . 2.980 2.114 2.046 2.197 . 0 0 "[ . 1 . 2]" 1
272 1 14 VAL HA 1 14 VAL MG2 . . 3.420 2.740 2.350 3.173 . 0 0 "[ . 1 . 2]" 1
273 1 14 VAL HA 1 16 ALA H . . 4.310 3.746 3.701 3.806 . 0 0 "[ . 1 . 2]" 1
274 1 14 VAL HA 1 17 VAL H . . 4.390 3.849 3.481 4.089 . 0 0 "[ . 1 . 2]" 1
275 1 14 VAL HA 1 17 VAL HB . . 5.010 4.396 3.718 4.809 . 0 0 "[ . 1 . 2]" 1
276 1 14 VAL HA 1 17 VAL QG . . 3.720 2.349 1.992 2.742 . 0 0 "[ . 1 . 2]" 1
277 1 14 VAL HB 1 15 GLY H . . 3.280 2.857 2.332 3.440 0.160 12 0 "[ . 1 . 2]" 1
278 1 14 VAL HB 1 15 GLY QA . . 4.620 3.863 3.739 3.987 . 0 0 "[ . 1 . 2]" 1
279 1 14 VAL QG 1 15 GLY H . . 3.490 2.563 1.841 3.206 . 0 0 "[ . 1 . 2]" 1
280 1 14 VAL QG 1 15 GLY QA . . 4.100 3.266 3.137 3.444 . 0 0 "[ . 1 . 2]" 1
281 1 14 VAL QG 1 17 VAL QG . . 3.210 3.263 3.212 3.340 0.130 5 0 "[ . 1 . 2]" 1
282 1 14 VAL QG 1 49 LEU HA . . 3.700 2.666 2.136 3.266 . 0 0 "[ . 1 . 2]" 1
283 1 14 VAL QG 1 49 LEU QB . . 3.600 2.367 1.858 3.271 . 0 0 "[ . 1 . 2]" 1
284 1 14 VAL QG 1 49 LEU QD . . 2.780 2.151 1.796 2.799 0.019 10 0 "[ . 1 . 2]" 1
285 1 14 VAL QG 1 49 LEU HG . . 4.990 3.801 3.435 4.316 . 0 0 "[ . 1 . 2]" 1
286 1 14 VAL QG 1 50 LYS H . . 3.980 3.108 2.593 3.991 0.011 9 0 "[ . 1 . 2]" 1
287 1 14 VAL QG 1 50 LYS HA . . 4.490 2.768 2.252 3.345 . 0 0 "[ . 1 . 2]" 1
288 1 14 VAL MG1 1 15 GLY H . . 3.990 3.668 3.219 4.084 0.094 16 0 "[ . 1 . 2]" 1
289 1 14 VAL MG2 1 15 GLY H . . 3.990 2.892 1.844 3.832 . 0 0 "[ . 1 . 2]" 1
290 1 15 GLY H 1 16 ALA H . . 3.330 2.633 2.590 2.677 . 0 0 "[ . 1 . 2]" 1
291 1 15 GLY H 1 16 ALA MB . . 4.160 4.052 3.880 4.159 . 0 0 "[ . 1 . 2]" 1
292 1 15 GLY H 1 17 VAL H . . 5.500 4.259 4.151 4.368 . 0 0 "[ . 1 . 2]" 1
293 1 15 GLY H 1 17 VAL QG . . 4.830 4.515 4.332 4.743 . 0 0 "[ . 1 . 2]" 1
294 1 15 GLY QA 1 16 ALA H . . 3.120 2.909 2.895 2.920 . 0 0 "[ . 1 . 2]" 1
295 1 15 GLY QA 1 16 ALA MB . . 4.200 4.060 3.998 4.127 . 0 0 "[ . 1 . 2]" 1
296 1 15 GLY HA2 1 16 ALA MB . . 5.030 4.793 4.715 4.888 . 0 0 "[ . 1 . 2]" 1
297 1 15 GLY HA3 1 16 ALA MB . . 5.030 4.386 4.315 4.473 . 0 0 "[ . 1 . 2]" 1
298 1 16 ALA H 1 16 ALA MB . . 2.650 2.398 2.201 2.508 . 0 0 "[ . 1 . 2]" 1
299 1 16 ALA H 1 17 VAL H . . 3.470 2.041 2.001 2.137 . 0 0 "[ . 1 . 2]" 1
300 1 16 ALA H 1 17 VAL HB . . 4.200 4.327 4.285 4.397 0.197 9 0 "[ . 1 . 2]" 1
301 1 16 ALA H 1 17 VAL MG1 . . 5.500 5.375 5.329 5.473 . 0 0 "[ . 1 . 2]" 1
302 1 16 ALA H 1 17 VAL QG . . 4.390 3.394 3.287 3.543 . 0 0 "[ . 1 . 2]" 1
303 1 16 ALA H 1 17 VAL MG2 . . 5.500 3.432 3.317 3.589 . 0 0 "[ . 1 . 2]" 1
304 1 16 ALA MB 1 17 VAL H . . 3.420 3.290 3.094 3.387 . 0 0 "[ . 1 . 2]" 1
305 1 17 VAL H 1 17 VAL HB . . 2.850 2.436 2.426 2.469 . 0 0 "[ . 1 . 2]" 1
306 1 17 VAL H 1 17 VAL MG1 . . 3.620 3.748 3.745 3.755 0.135 13 0 "[ . 1 . 2]" 1
307 1 17 VAL H 1 17 VAL QG . . 2.650 2.333 2.230 2.436 . 0 0 "[ . 1 . 2]" 1
308 1 17 VAL H 1 17 VAL MG2 . . 3.620 2.357 2.247 2.468 . 0 0 "[ . 1 . 2]" 1
309 1 17 VAL H 1 18 ASP H . . 5.010 4.589 4.499 4.613 . 0 0 "[ . 1 . 2]" 1
310 1 17 VAL HA 1 17 VAL MG1 . . 3.180 2.467 2.441 2.493 . 0 0 "[ . 1 . 2]" 1
311 1 17 VAL HA 1 17 VAL MG2 . . 3.180 2.207 2.140 2.314 . 0 0 "[ . 1 . 2]" 1
312 1 17 VAL HA 1 18 ASP H . . 2.720 2.184 2.141 2.207 . 0 0 "[ . 1 . 2]" 1
313 1 17 VAL HB 1 18 ASP H . . 4.400 4.184 4.119 4.360 . 0 0 "[ . 1 . 2]" 1
314 1 17 VAL QG 1 18 ASP H . . 3.020 2.257 2.158 2.532 . 0 0 "[ . 1 . 2]" 1
315 1 17 VAL QG 1 20 ASN H . . 5.440 5.067 4.949 5.398 . 0 0 "[ . 1 . 2]" 1
316 1 17 VAL QG 1 49 LEU QD . . 2.190 2.138 1.894 2.272 0.082 18 0 "[ . 1 . 2]" 1
317 1 17 VAL MG1 1 18 ASP H . . 3.650 2.276 2.171 2.568 . 0 0 "[ . 1 . 2]" 1
318 1 17 VAL MG1 1 49 LEU MD1 . . 3.890 3.295 2.961 3.548 . 0 0 "[ . 1 . 2]" 1
319 1 17 VAL MG1 1 49 LEU MD2 . . 3.890 3.519 2.536 3.912 0.022 6 0 "[ . 1 . 2]" 1
320 1 17 VAL MG2 1 18 ASP H . . 3.650 3.750 3.697 3.852 0.202 8 0 "[ . 1 . 2]" 1
321 1 17 VAL MG2 1 49 LEU MD1 . . 3.890 2.214 1.934 2.456 . 0 0 "[ . 1 . 2]" 1
322 1 17 VAL MG2 1 49 LEU MD2 . . 3.890 3.709 3.280 3.911 0.021 13 0 "[ . 1 . 2]" 1
323 1 18 ASP H 1 18 ASP HB2 . . 3.560 2.352 2.339 2.373 . 0 0 "[ . 1 . 2]" 1
324 1 18 ASP H 1 18 ASP QB . . 3.080 2.322 2.311 2.342 . 0 0 "[ . 1 . 2]" 1
325 1 18 ASP H 1 18 ASP HB3 . . 3.560 3.594 3.582 3.611 0.051 8 0 "[ . 1 . 2]" 1
326 1 18 ASP H 1 22 PRO HD2 . . 5.500 3.370 3.008 3.472 . 0 0 "[ . 1 . 2]" 1
327 1 18 ASP H 1 22 PRO QG . . 5.140 3.609 2.510 3.885 . 0 0 "[ . 1 . 2]" 1
328 1 18 ASP HA 1 19 PRO HD2 . . 3.360 2.260 2.234 2.287 . 0 0 "[ . 1 . 2]" 1
329 1 18 ASP HA 1 19 PRO HD3 . . 3.370 2.258 2.255 2.264 . 0 0 "[ . 1 . 2]" 1
330 1 18 ASP QB 1 21 GLY H . . 2.850 3.040 3.021 3.075 0.225 11 0 "[ . 1 . 2]" 1
331 1 18 ASP HB2 1 21 GLY H . . 3.320 3.419 3.394 3.462 0.142 11 0 "[ . 1 . 2]" 1
332 1 18 ASP HB3 1 21 GLY H . . 3.320 3.404 3.387 3.442 0.122 11 0 "[ . 1 . 2]" 1
333 1 19 PRO HA 1 21 GLY H . . 3.980 4.173 4.156 4.191 0.211 11 0 "[ . 1 . 2]" 1
334 1 19 PRO HA 1 23 ARG HD2 . . 4.700 4.605 4.253 4.725 0.025 12 0 "[ . 1 . 2]" 1
335 1 19 PRO HA 1 23 ARG QD . . 3.980 4.028 3.985 4.081 0.101 18 0 "[ . 1 . 2]" 1
336 1 19 PRO HA 1 23 ARG HD3 . . 4.700 4.492 4.332 4.831 0.131 11 0 "[ . 1 . 2]" 1
337 1 19 PRO QB 1 20 ASN H . . 3.750 3.537 3.439 3.571 . 0 0 "[ . 1 . 2]" 1
338 1 19 PRO HB2 1 20 ASN H . . 4.360 3.736 3.616 3.777 . 0 0 "[ . 1 . 2]" 1
339 1 19 PRO HB3 1 20 ASN H . . 4.360 4.375 4.306 4.399 0.039 14 0 "[ . 1 . 2]" 1
340 1 19 PRO HD2 1 20 ASN H . . 3.480 2.793 2.716 2.824 . 0 0 "[ . 1 . 2]" 1
341 1 19 PRO HD2 1 20 ASN HD21 . . 5.260 3.984 3.955 4.006 . 0 0 "[ . 1 . 2]" 1
342 1 19 PRO QG 1 20 ASN HD21 . . 4.050 2.775 2.750 2.780 . 0 0 "[ . 1 . 2]" 1
343 1 19 PRO QG 1 20 ASN HD22 . . 4.160 4.171 4.165 4.178 0.018 12 0 "[ . 1 . 2]" 1
344 1 19 PRO HG2 1 20 ASN H . . 4.310 2.943 2.754 3.010 . 0 0 "[ . 1 . 2]" 1
345 1 19 PRO HG3 1 20 ASN H . . 4.310 4.311 4.169 4.361 0.051 14 0 "[ . 1 . 2]" 1
346 1 20 ASN H 1 20 ASN HB2 . . 2.970 2.105 2.092 2.114 . 0 0 "[ . 1 . 2]" 1
347 1 20 ASN H 1 20 ASN HB3 . . 3.310 3.361 3.353 3.375 0.065 20 0 "[ . 1 . 2]" 1
348 1 20 ASN H 1 20 ASN HD21 . . 4.680 2.848 2.748 2.908 . 0 0 "[ . 1 . 2]" 1
349 1 20 ASN H 1 20 ASN HD22 . . 5.210 4.495 4.403 4.550 . 0 0 "[ . 1 . 2]" 1
350 1 20 ASN H 1 21 GLY H . . 2.920 2.491 2.428 2.590 . 0 0 "[ . 1 . 2]" 1
351 1 20 ASN HA 1 21 GLY H . . 3.390 3.517 3.508 3.530 0.140 11 0 "[ . 1 . 2]" 1
352 1 20 ASN HB2 1 20 ASN HD21 . . 3.240 2.521 2.506 2.544 . 0 0 "[ . 1 . 2]" 1
353 1 20 ASN HB2 1 20 ASN HD22 . . 3.720 3.598 3.592 3.608 . 0 0 "[ . 1 . 2]" 1
354 1 20 ASN HB2 1 21 GLY H . . 3.150 3.115 3.058 3.151 0.001 14 0 "[ . 1 . 2]" 1
355 1 20 ASN HB3 1 21 GLY H . . 3.860 3.216 3.154 3.260 . 0 0 "[ . 1 . 2]" 1
356 1 21 GLY H 1 22 PRO HD2 . . 3.830 2.463 2.268 2.505 . 0 0 "[ . 1 . 2]" 1
357 1 21 GLY QA 1 22 PRO HD2 . . 3.120 2.298 2.288 2.355 . 0 0 "[ . 1 . 2]" 1
358 1 21 GLY HA2 1 22 PRO HD2 . . 3.660 3.783 3.780 3.793 0.133 8 0 "[ . 1 . 2]" 1
359 1 21 GLY HA3 1 22 PRO HD2 . . 3.660 2.318 2.307 2.378 . 0 0 "[ . 1 . 2]" 1
360 1 22 PRO HA 1 23 ARG H . . 2.890 2.581 2.153 2.699 . 0 0 "[ . 1 . 2]" 1
361 1 22 PRO QB 1 23 ARG H . . 3.410 2.197 1.932 3.455 0.045 8 0 "[ . 1 . 2]" 1
362 1 22 PRO HB2 1 23 ARG H . . 4.120 2.245 1.949 3.709 . 0 0 "[ . 1 . 2]" 1
363 1 22 PRO HB3 1 23 ARG H . . 4.120 3.304 3.163 4.122 0.002 8 0 "[ . 1 . 2]" 1
364 1 23 ARG H 1 23 ARG QB . . 3.550 2.612 2.059 2.752 . 0 0 "[ . 1 . 2]" 1
365 1 23 ARG H 1 23 ARG QD . . 4.610 3.821 2.770 4.214 . 0 0 "[ . 1 . 2]" 1
366 1 23 ARG H 1 23 ARG QG . . 3.760 3.521 3.257 4.142 0.382 2 0 "[ . 1 . 2]" 1
367 1 23 ARG H 1 24 LYS H . . 5.500 4.437 4.399 4.610 . 0 0 "[ . 1 . 2]" 1
368 1 23 ARG HA 1 23 ARG HD2 . . 4.090 2.160 1.985 2.731 . 0 0 "[ . 1 . 2]" 1
369 1 23 ARG HA 1 23 ARG HD3 . . 4.090 2.630 2.286 2.791 . 0 0 "[ . 1 . 2]" 1
370 1 23 ARG HA 1 23 ARG QG . . 3.650 2.791 2.485 2.913 . 0 0 "[ . 1 . 2]" 1
371 1 23 ARG HA 1 24 LYS H . . 3.250 2.431 2.392 2.454 . 0 0 "[ . 1 . 2]" 1
372 1 23 ARG HA 1 25 VAL H . . 5.280 5.426 5.361 5.609 0.329 20 0 "[ . 1 . 2]" 1
373 1 23 ARG QB 1 23 ARG QD . . 3.260 2.364 2.315 2.439 . 0 0 "[ . 1 . 2]" 1
374 1 23 ARG QB 1 24 LYS H . . 3.870 2.391 2.286 2.635 . 0 0 "[ . 1 . 2]" 1
375 1 23 ARG QB 1 25 VAL QG . . 3.630 3.359 3.075 3.606 . 0 0 "[ . 1 . 2]" 1
376 1 23 ARG HB2 1 25 VAL MG1 . . 5.940 3.684 3.254 4.193 . 0 0 "[ . 1 . 2]" 1
377 1 23 ARG HB2 1 25 VAL MG2 . . 5.940 5.574 5.150 5.989 0.049 11 0 "[ . 1 . 2]" 1
378 1 23 ARG HB3 1 25 VAL MG1 . . 5.940 4.148 3.348 4.511 . 0 0 "[ . 1 . 2]" 1
379 1 23 ARG HB3 1 25 VAL MG2 . . 5.940 5.838 5.254 6.011 0.071 12 0 "[ . 1 . 2]" 1
380 1 23 ARG HD2 1 24 LYS H . . 5.500 3.297 2.795 4.441 . 0 0 "[ . 1 . 2]" 1
381 1 23 ARG HD3 1 24 LYS H . . 5.500 4.526 4.366 4.598 . 0 0 "[ . 1 . 2]" 1
382 1 23 ARG QG 1 24 LYS H . . 4.610 3.825 2.653 4.217 . 0 0 "[ . 1 . 2]" 1
383 1 24 LYS H 1 24 LYS QB . . 3.650 2.227 2.133 2.354 . 0 0 "[ . 1 . 2]" 1
384 1 24 LYS H 1 24 LYS HG2 . . 4.420 3.849 2.533 4.458 0.038 8 0 "[ . 1 . 2]" 1
385 1 24 LYS H 1 24 LYS QG . . 3.870 2.820 2.504 3.329 . 0 0 "[ . 1 . 2]" 1
386 1 24 LYS H 1 24 LYS HG3 . . 4.420 3.150 2.783 3.943 . 0 0 "[ . 1 . 2]" 1
387 1 24 LYS H 1 25 VAL H . . 5.500 4.321 4.123 4.435 . 0 0 "[ . 1 . 2]" 1
388 1 24 LYS H 1 25 VAL QG . . 4.270 4.308 4.216 4.373 0.103 20 0 "[ . 1 . 2]" 1
389 1 24 LYS HA 1 24 LYS HG2 . . 3.980 2.953 2.733 3.619 . 0 0 "[ . 1 . 2]" 1
390 1 24 LYS HA 1 24 LYS HG3 . . 3.980 2.692 2.373 3.926 . 0 0 "[ . 1 . 2]" 1
391 1 24 LYS QB 1 24 LYS QD . . 3.290 2.060 1.949 2.261 . 0 0 "[ . 1 . 2]" 1
392 1 24 LYS QB 1 24 LYS QE . . 4.520 2.813 2.077 3.574 . 0 0 "[ . 1 . 2]" 1
393 1 24 LYS QB 1 25 VAL H . . 3.680 3.635 3.443 3.770 0.090 8 0 "[ . 1 . 2]" 1
394 1 24 LYS HB2 1 25 VAL H . . 4.470 4.389 3.594 4.617 0.147 8 0 "[ . 1 . 2]" 1
395 1 24 LYS HB3 1 25 VAL H . . 4.470 3.982 3.812 4.436 . 0 0 "[ . 1 . 2]" 1
396 1 24 LYS QE 1 24 LYS QG . . 3.220 2.153 2.039 2.323 . 0 0 "[ . 1 . 2]" 1
397 1 24 LYS HG2 1 25 VAL H . . 4.530 4.577 4.540 4.706 0.176 15 0 "[ . 1 . 2]" 1
398 1 24 LYS HG3 1 25 VAL H . . 4.530 4.578 4.540 4.707 0.177 15 0 "[ . 1 . 2]" 1
399 1 25 VAL H 1 25 VAL MG1 . . 3.810 2.888 2.480 3.093 . 0 0 "[ . 1 . 2]" 1
400 1 25 VAL H 1 25 VAL MG2 . . 3.810 2.083 1.900 2.175 . 0 0 "[ . 1 . 2]" 1
401 1 25 VAL HA 1 25 VAL MG1 . . 3.280 2.257 2.172 2.365 . 0 0 "[ . 1 . 2]" 1
402 1 25 VAL HA 1 25 VAL QG . . 2.830 2.213 2.138 2.306 . 0 0 "[ . 1 . 2]" 1
403 1 25 VAL HA 1 25 VAL MG2 . . 3.280 3.197 3.194 3.200 . 0 0 "[ . 1 . 2]" 1
404 1 25 VAL HA 1 26 LEU H . . 3.140 2.514 2.488 2.542 . 0 0 "[ . 1 . 2]" 1
405 1 25 VAL HA 1 46 LEU QD . . 4.190 4.089 3.785 4.347 0.157 8 0 "[ . 1 . 2]" 1
406 1 25 VAL HB 1 26 LEU H . . 5.310 2.139 2.085 2.187 . 0 0 "[ . 1 . 2]" 1
407 1 25 VAL QG 1 26 LEU HA . . 3.650 3.687 3.496 3.792 0.142 8 0 "[ . 1 . 2]" 1
408 1 25 VAL QG 1 47 LYS HA . . 3.540 3.515 2.939 3.764 0.224 8 0 "[ . 1 . 2]" 1
409 1 25 VAL MG1 1 26 LEU H . . 3.830 3.509 3.454 3.636 . 0 0 "[ . 1 . 2]" 1
410 1 25 VAL MG2 1 26 LEU H . . 3.830 3.325 3.174 3.401 . 0 0 "[ . 1 . 2]" 1
411 1 26 LEU H 1 26 LEU QB . . 3.070 2.933 2.535 3.194 0.124 11 0 "[ . 1 . 2]" 1
412 1 26 LEU H 1 26 LEU QD . . 3.720 2.617 1.743 3.286 . 0 0 "[ . 1 . 2]" 1
413 1 26 LEU H 1 26 LEU HG . . 3.950 3.062 2.499 3.952 0.002 9 0 "[ . 1 . 2]" 1
414 1 26 LEU H 1 27 GLY H . . 4.660 4.347 4.233 4.436 . 0 0 "[ . 1 . 2]" 1
415 1 26 LEU HA 1 26 LEU QD . . 3.960 3.270 2.995 3.455 . 0 0 "[ . 1 . 2]" 1
416 1 26 LEU HA 1 26 LEU HG . . 4.150 3.333 2.419 4.268 0.118 11 0 "[ . 1 . 2]" 1
417 1 26 LEU HA 1 27 GLY H . . 2.840 2.212 2.158 2.385 . 0 0 "[ . 1 . 2]" 1
418 1 26 LEU HA 1 46 LEU QB . . 5.340 4.658 3.944 4.977 . 0 0 "[ . 1 . 2]" 1
419 1 26 LEU HA 1 46 LEU QD . . 4.870 3.204 2.941 3.455 . 0 0 "[ . 1 . 2]" 1
420 1 26 LEU HB2 1 27 GLY H . . 4.160 3.311 2.475 4.198 0.038 9 0 "[ . 1 . 2]" 1
421 1 26 LEU HB3 1 27 GLY H . . 4.160 3.784 2.982 4.167 0.007 6 0 "[ . 1 . 2]" 1
422 1 26 LEU HG 1 27 GLY H . . 4.390 4.353 3.914 4.728 0.338 11 0 "[ . 1 . 2]" 1
423 1 27 GLY H 1 28 VAL H . . 4.580 4.433 4.396 4.495 . 0 0 "[ . 1 . 2]" 1
424 1 27 GLY H 1 28 VAL QG . . 4.470 3.679 3.570 3.792 . 0 0 "[ . 1 . 2]" 1
425 1 27 GLY H 1 46 LEU H . . 4.370 4.092 3.641 4.431 0.061 11 0 "[ . 1 . 2]" 1
426 1 27 GLY H 1 46 LEU MD1 . . 3.740 3.414 3.226 3.741 0.001 11 0 "[ . 1 . 2]" 1
427 1 27 GLY H 1 46 LEU QD . . 3.230 3.205 3.067 3.405 0.175 11 0 "[ . 1 . 2]" 1
428 1 27 GLY H 1 46 LEU MD2 . . 3.740 3.894 3.837 3.953 0.213 10 0 "[ . 1 . 2]" 1
429 1 27 GLY H 1 47 LYS H . . 4.540 3.771 3.373 3.998 . 0 0 "[ . 1 . 2]" 1
430 1 27 GLY H 1 47 LYS QE . . 5.340 2.620 1.929 3.402 . 0 0 "[ . 1 . 2]" 1
431 1 27 GLY H 1 47 LYS QG . . 3.470 1.900 1.851 2.004 . 0 0 "[ . 1 . 2]" 1
432 1 27 GLY QA 1 28 VAL H . . 2.840 2.277 2.264 2.284 . 0 0 "[ . 1 . 2]" 1
433 1 27 GLY QA 1 28 VAL QG . . 5.050 2.886 2.836 2.943 . 0 0 "[ . 1 . 2]" 1
434 1 27 GLY QA 1 47 LYS QG . . 4.620 3.718 3.634 3.830 . 0 0 "[ . 1 . 2]" 1
435 1 27 GLY QA 1 60 ASP H . . 4.970 4.186 3.952 4.461 . 0 0 "[ . 1 . 2]" 1
436 1 27 GLY QA 1 97 LEU QD . . 3.490 2.941 2.667 3.140 . 0 0 "[ . 1 . 2]" 1
437 1 27 GLY HA2 1 28 VAL H . . 3.260 2.629 2.547 2.709 . 0 0 "[ . 1 . 2]" 1
438 1 27 GLY HA2 1 97 LEU MD1 . . 5.040 4.453 3.869 5.113 0.073 3 0 "[ . 1 . 2]" 1
439 1 27 GLY HA2 1 97 LEU MD2 . . 5.040 5.028 4.003 5.142 0.102 16 0 "[ . 1 . 2]" 1
440 1 27 GLY HA3 1 28 VAL H . . 3.260 2.500 2.427 2.578 . 0 0 "[ . 1 . 2]" 1
441 1 27 GLY HA3 1 97 LEU MD1 . . 5.040 3.283 2.841 4.009 . 0 0 "[ . 1 . 2]" 1
442 1 27 GLY HA3 1 97 LEU MD2 . . 5.040 3.664 2.765 4.148 . 0 0 "[ . 1 . 2]" 1
443 1 28 VAL H 1 28 VAL HB . . 3.220 3.075 3.029 3.118 . 0 0 "[ . 1 . 2]" 1
444 1 28 VAL H 1 28 VAL MG1 . . 4.030 4.006 3.997 4.015 . 0 0 "[ . 1 . 2]" 1
445 1 28 VAL H 1 28 VAL QG . . 3.130 2.643 2.607 2.724 . 0 0 "[ . 1 . 2]" 1
446 1 28 VAL H 1 28 VAL MG2 . . 4.030 2.681 2.641 2.771 . 0 0 "[ . 1 . 2]" 1
447 1 28 VAL H 1 29 PHE H . . 4.920 4.382 4.351 4.405 . 0 0 "[ . 1 . 2]" 1
448 1 28 VAL H 1 45 ASP HA . . 5.500 5.015 4.914 5.096 . 0 0 "[ . 1 . 2]" 1
449 1 28 VAL H 1 46 LEU MD1 . . 4.150 4.047 3.644 4.224 0.074 6 0 "[ . 1 . 2]" 1
450 1 28 VAL H 1 46 LEU MD2 . . 4.150 2.947 2.670 3.094 . 0 0 "[ . 1 . 2]" 1
451 1 28 VAL H 1 60 ASP H . . 3.800 2.685 2.388 3.012 . 0 0 "[ . 1 . 2]" 1
452 1 28 VAL H 1 60 ASP HB2 . . 3.890 2.203 1.953 2.601 . 0 0 "[ . 1 . 2]" 1
453 1 28 VAL H 1 60 ASP QB . . 3.280 2.135 1.864 2.443 . 0 0 "[ . 1 . 2]" 1
454 1 28 VAL H 1 60 ASP HB3 . . 3.890 2.960 2.279 3.467 . 0 0 "[ . 1 . 2]" 1
455 1 28 VAL H 1 61 VAL H . . 5.090 4.167 3.924 4.469 . 0 0 "[ . 1 . 2]" 1
456 1 28 VAL HA 1 28 VAL MG1 . . 3.470 2.138 2.091 2.209 . 0 0 "[ . 1 . 2]" 1
457 1 28 VAL HA 1 28 VAL MG2 . . 3.470 2.567 2.519 2.605 . 0 0 "[ . 1 . 2]" 1
458 1 28 VAL HA 1 29 PHE H . . 3.150 2.293 2.232 2.319 . 0 0 "[ . 1 . 2]" 1
459 1 28 VAL HA 1 29 PHE QD . . 5.080 4.466 4.383 4.571 . 0 0 "[ . 1 . 2]" 1
460 1 28 VAL HA 1 45 ASP HA . . 3.500 2.170 2.112 2.253 . 0 0 "[ . 1 . 2]" 1
461 1 28 VAL HA 1 45 ASP HB2 . . 4.790 3.779 3.609 3.915 . 0 0 "[ . 1 . 2]" 1
462 1 28 VAL HA 1 45 ASP QB . . 4.120 3.668 3.518 3.785 . 0 0 "[ . 1 . 2]" 1
463 1 28 VAL HA 1 45 ASP HB3 . . 4.790 4.961 4.862 5.055 0.265 16 0 "[ . 1 . 2]" 1
464 1 28 VAL HA 1 46 LEU H . . 3.410 3.049 2.759 3.251 . 0 0 "[ . 1 . 2]" 1
465 1 28 VAL HB 1 29 PHE H . . 3.880 3.510 3.436 3.704 . 0 0 "[ . 1 . 2]" 1
466 1 28 VAL HB 1 44 VAL H . . 5.500 5.659 5.602 5.702 0.202 13 0 "[ . 1 . 2]" 1
467 1 28 VAL HB 1 56 PHE QE . . 5.230 4.202 3.928 4.566 . 0 0 "[ . 1 . 2]" 1
468 1 28 VAL HB 1 59 PRO HA . . 3.740 2.109 1.981 2.254 . 0 0 "[ . 1 . 2]" 1
469 1 28 VAL HB 1 60 ASP H . . 3.450 2.588 2.325 2.707 . 0 0 "[ . 1 . 2]" 1
470 1 28 VAL HB 1 60 ASP HB2 . . 5.500 4.108 3.755 4.332 . 0 0 "[ . 1 . 2]" 1
471 1 28 VAL HB 1 60 ASP QB . . 4.770 3.940 3.673 4.117 . 0 0 "[ . 1 . 2]" 1
472 1 28 VAL HB 1 60 ASP HB3 . . 5.500 5.114 4.528 5.511 0.011 8 0 "[ . 1 . 2]" 1
473 1 28 VAL QG 1 29 PHE H . . 3.270 2.171 2.033 2.327 . 0 0 "[ . 1 . 2]" 1
474 1 28 VAL QG 1 30 GLN H . . 5.440 4.789 4.616 4.913 . 0 0 "[ . 1 . 2]" 1
475 1 28 VAL QG 1 30 GLN QB . . 4.890 4.385 4.259 4.685 . 0 0 "[ . 1 . 2]" 1
476 1 28 VAL QG 1 43 ILE MG . . 3.060 2.132 1.837 2.312 . 0 0 "[ . 1 . 2]" 1
477 1 28 VAL QG 1 44 VAL H . . 4.150 3.249 3.083 3.361 . 0 0 "[ . 1 . 2]" 1
478 1 28 VAL QG 1 45 ASP HA . . 3.140 2.093 1.982 2.345 . 0 0 "[ . 1 . 2]" 1
479 1 28 VAL QG 1 45 ASP QB . . 4.040 2.395 2.199 2.613 . 0 0 "[ . 1 . 2]" 1
480 1 28 VAL QG 1 46 LEU H . . 3.390 3.475 3.361 3.532 0.142 10 0 "[ . 1 . 2]" 1
481 1 28 VAL QG 1 47 LYS QE . . 4.340 3.131 1.909 3.851 . 0 0 "[ . 1 . 2]" 1
482 1 28 VAL QG 1 56 PHE QB . . 4.350 2.860 2.725 3.015 . 0 0 "[ . 1 . 2]" 1
483 1 28 VAL QG 1 56 PHE QD . . 3.840 2.811 2.735 2.878 . 0 0 "[ . 1 . 2]" 1
484 1 28 VAL QG 1 56 PHE QE . . 3.510 2.563 2.388 2.823 . 0 0 "[ . 1 . 2]" 1
485 1 28 VAL QG 1 59 PRO HA . . 3.930 2.886 2.780 3.040 . 0 0 "[ . 1 . 2]" 1
486 1 28 VAL QG 1 59 PRO QB . . 3.890 2.906 2.764 3.136 . 0 0 "[ . 1 . 2]" 1
487 1 28 VAL QG 1 60 ASP H . . 3.700 3.075 2.776 3.379 . 0 0 "[ . 1 . 2]" 1
488 1 28 VAL QG 1 61 VAL H . . 4.820 4.566 4.432 4.677 . 0 0 "[ . 1 . 2]" 1
489 1 28 VAL MG1 1 29 PHE H . . 4.000 2.179 2.038 2.340 . 0 0 "[ . 1 . 2]" 1
490 1 28 VAL MG1 1 45 ASP HA . . 3.660 2.119 1.992 2.426 . 0 0 "[ . 1 . 2]" 1
491 1 28 VAL MG1 1 46 LEU H . . 4.210 3.948 3.725 4.269 0.059 14 0 "[ . 1 . 2]" 1
492 1 28 VAL MG1 1 56 PHE QD . . 4.830 3.169 3.084 3.306 . 0 0 "[ . 1 . 2]" 1
493 1 28 VAL MG1 1 56 PHE QE . . 4.070 3.715 3.542 3.984 . 0 0 "[ . 1 . 2]" 1
494 1 28 VAL MG1 1 59 PRO HA . . 4.510 3.412 3.229 3.521 . 0 0 "[ . 1 . 2]" 1
495 1 28 VAL MG1 1 60 ASP H . . 4.220 4.181 3.940 4.249 0.029 8 0 "[ . 1 . 2]" 1
496 1 28 VAL MG2 1 29 PHE H . . 4.000 4.083 4.042 4.139 0.139 2 0 "[ . 1 . 2]" 1
497 1 28 VAL MG2 1 45 ASP HA . . 3.660 3.392 2.968 3.576 . 0 0 "[ . 1 . 2]" 1
498 1 28 VAL MG2 1 46 LEU H . . 4.210 3.878 3.662 4.000 . 0 0 "[ . 1 . 2]" 1
499 1 28 VAL MG2 1 56 PHE QD . . 4.830 3.147 3.016 3.281 . 0 0 "[ . 1 . 2]" 1
500 1 28 VAL MG2 1 56 PHE QE . . 4.070 2.614 2.419 2.887 . 0 0 "[ . 1 . 2]" 1
501 1 28 VAL MG2 1 59 PRO HA . . 4.510 3.125 2.928 3.377 . 0 0 "[ . 1 . 2]" 1
502 1 28 VAL MG2 1 60 ASP H . . 4.220 3.170 2.826 3.556 . 0 0 "[ . 1 . 2]" 1
503 1 29 PHE H 1 29 PHE HB2 . . 3.760 2.610 2.517 2.684 . 0 0 "[ . 1 . 2]" 1
504 1 29 PHE H 1 29 PHE QB . . 3.240 2.564 2.478 2.631 . 0 0 "[ . 1 . 2]" 1
505 1 29 PHE H 1 29 PHE HB3 . . 3.760 3.759 3.704 3.797 0.037 16 0 "[ . 1 . 2]" 1
506 1 29 PHE H 1 29 PHE QD . . 3.510 3.634 3.519 3.689 0.179 7 0 "[ . 1 . 2]" 1
507 1 29 PHE H 1 30 GLN H . . 5.140 4.447 4.390 4.497 . 0 0 "[ . 1 . 2]" 1
508 1 29 PHE H 1 43 ILE MG . . 4.240 3.827 3.493 4.068 . 0 0 "[ . 1 . 2]" 1
509 1 29 PHE H 1 45 ASP HA . . 3.600 3.005 2.838 3.324 . 0 0 "[ . 1 . 2]" 1
510 1 29 PHE H 1 46 LEU QD . . 3.170 3.167 2.929 3.247 0.077 16 0 "[ . 1 . 2]" 1
511 1 29 PHE HA 1 30 GLN H . . 2.900 2.223 2.175 2.258 . 0 0 "[ . 1 . 2]" 1
512 1 29 PHE HA 1 59 PRO QB . . 4.550 3.379 3.210 3.511 . 0 0 "[ . 1 . 2]" 1
513 1 29 PHE HA 1 61 VAL H . . 3.450 3.358 3.151 3.471 0.021 1 0 "[ . 1 . 2]" 1
514 1 29 PHE HA 1 61 VAL HB . . 4.710 3.056 2.898 3.311 . 0 0 "[ . 1 . 2]" 1
515 1 29 PHE HA 1 61 VAL MG1 . . 4.790 3.993 3.742 4.199 . 0 0 "[ . 1 . 2]" 1
516 1 29 PHE HA 1 61 VAL QG . . 4.180 3.708 3.544 3.830 . 0 0 "[ . 1 . 2]" 1
517 1 29 PHE HA 1 61 VAL MG2 . . 4.790 4.416 4.254 4.673 . 0 0 "[ . 1 . 2]" 1
518 1 29 PHE QB 1 30 GLN H . . 3.710 2.872 2.762 3.047 . 0 0 "[ . 1 . 2]" 1
519 1 29 PHE QB 1 31 LEU H . . 4.190 4.152 4.091 4.291 0.101 6 0 "[ . 1 . 2]" 1
520 1 29 PHE QB 1 44 VAL H . . 3.650 3.216 3.065 3.314 . 0 0 "[ . 1 . 2]" 1
521 1 29 PHE QB 1 44 VAL HB . . 4.000 2.610 1.941 3.169 . 0 0 "[ . 1 . 2]" 1
522 1 29 PHE QB 1 44 VAL QG . . 3.570 2.042 1.782 2.656 . 0 0 "[ . 1 . 2]" 1
523 1 29 PHE QB 1 46 LEU QD . . 3.760 3.622 3.478 3.781 0.021 19 0 "[ . 1 . 2]" 1
524 1 29 PHE HB2 1 44 VAL H . . 4.340 3.307 3.130 3.426 . 0 0 "[ . 1 . 2]" 1
525 1 29 PHE HB3 1 44 VAL H . . 4.340 4.398 4.317 4.500 0.160 10 0 "[ . 1 . 2]" 1
526 1 29 PHE QD 1 30 GLN H . . 5.100 3.708 3.596 3.857 . 0 0 "[ . 1 . 2]" 1
527 1 29 PHE QD 1 46 LEU QD . . 3.590 2.787 2.579 3.085 . 0 0 "[ . 1 . 2]" 1
528 1 29 PHE QD 1 61 VAL HB . . 4.080 1.984 1.933 2.082 . 0 0 "[ . 1 . 2]" 1
529 1 29 PHE QD 1 61 VAL MG1 . . 4.040 3.228 3.027 3.386 . 0 0 "[ . 1 . 2]" 1
530 1 29 PHE QD 1 61 VAL QG . . 3.380 2.889 2.784 2.982 . 0 0 "[ . 1 . 2]" 1
531 1 29 PHE QD 1 61 VAL MG2 . . 4.040 3.271 3.104 3.461 . 0 0 "[ . 1 . 2]" 1
532 1 29 PHE QD 1 101 LEU QD . . 4.730 2.602 2.136 3.623 . 0 0 "[ . 1 . 2]" 1
533 1 29 PHE QE 1 46 LEU HB2 . . 4.370 4.259 4.008 4.503 0.133 1 0 "[ . 1 . 2]" 1
534 1 29 PHE QE 1 46 LEU HB3 . . 4.370 2.825 2.616 2.967 . 0 0 "[ . 1 . 2]" 1
535 1 29 PHE QE 1 46 LEU QD . . 3.610 2.458 2.306 2.639 . 0 0 "[ . 1 . 2]" 1
536 1 29 PHE QE 1 61 VAL H . . 5.500 5.161 4.681 5.500 0.000 6 0 "[ . 1 . 2]" 1
537 1 29 PHE QE 1 61 VAL HB . . 5.080 3.103 2.704 3.322 . 0 0 "[ . 1 . 2]" 1
538 1 29 PHE QE 1 61 VAL MG1 . . 3.680 3.735 3.693 3.769 0.089 16 0 "[ . 1 . 2]" 1
539 1 29 PHE QE 1 61 VAL MG2 . . 3.680 2.825 2.639 2.966 . 0 0 "[ . 1 . 2]" 1
540 1 29 PHE QE 1 97 LEU HB2 . . 4.990 3.796 3.624 4.160 . 0 0 "[ . 1 . 2]" 1
541 1 29 PHE QE 1 97 LEU QB . . 4.380 2.084 1.940 2.432 . 0 0 "[ . 1 . 2]" 1
542 1 29 PHE QE 1 97 LEU HB3 . . 4.990 2.094 1.948 2.448 . 0 0 "[ . 1 . 2]" 1
543 1 29 PHE QE 1 97 LEU QD . . 4.580 2.272 1.920 2.535 . 0 0 "[ . 1 . 2]" 1
544 1 29 PHE QE 1 97 LEU HG . . 4.690 4.103 2.945 4.698 0.008 18 0 "[ . 1 . 2]" 1
545 1 29 PHE QE 1 98 ALA HA . . 3.600 3.595 3.423 3.651 0.051 20 0 "[ . 1 . 2]" 1
546 1 29 PHE QE 1 101 LEU HB2 . . 5.160 4.318 4.133 4.590 . 0 0 "[ . 1 . 2]" 1
547 1 29 PHE QE 1 101 LEU QB . . 4.540 4.094 3.942 4.294 . 0 0 "[ . 1 . 2]" 1
548 1 29 PHE QE 1 101 LEU HB3 . . 5.160 5.088 4.802 5.220 0.060 11 0 "[ . 1 . 2]" 1
549 1 29 PHE QE 1 101 LEU MD1 . . 4.860 2.638 1.871 3.518 . 0 0 "[ . 1 . 2]" 1
550 1 29 PHE QE 1 101 LEU QD . . 4.070 2.291 1.818 2.572 . 0 0 "[ . 1 . 2]" 1
551 1 29 PHE QE 1 101 LEU MD2 . . 4.860 2.767 1.885 3.326 . 0 0 "[ . 1 . 2]" 1
552 1 29 PHE HZ 1 46 LEU HB2 . . 4.900 5.024 4.961 5.062 0.162 4 0 "[ . 1 . 2]" 1
553 1 29 PHE HZ 1 46 LEU QB . . 4.030 3.955 3.861 4.045 0.015 15 0 "[ . 1 . 2]" 1
554 1 29 PHE HZ 1 46 LEU HB3 . . 4.900 4.138 4.026 4.254 . 0 0 "[ . 1 . 2]" 1
555 1 29 PHE HZ 1 101 LEU H . . 4.650 4.669 4.561 4.720 0.070 19 0 "[ . 1 . 2]" 1
556 1 30 GLN H 1 30 GLN HB2 . . 3.960 2.904 2.413 3.136 . 0 0 "[ . 1 . 2]" 1
557 1 30 GLN H 1 30 GLN QB . . 3.410 2.487 2.326 2.544 . 0 0 "[ . 1 . 2]" 1
558 1 30 GLN H 1 30 GLN HB3 . . 3.960 2.736 2.639 3.052 . 0 0 "[ . 1 . 2]" 1
559 1 30 GLN H 1 30 GLN HG2 . . 5.500 4.820 4.248 4.926 . 0 0 "[ . 1 . 2]" 1
560 1 30 GLN H 1 30 GLN QG . . 4.800 4.156 3.930 4.221 . 0 0 "[ . 1 . 2]" 1
561 1 30 GLN H 1 30 GLN HG3 . . 5.500 4.555 4.396 4.767 . 0 0 "[ . 1 . 2]" 1
562 1 30 GLN H 1 31 LEU H . . 4.890 3.951 3.883 4.073 . 0 0 "[ . 1 . 2]" 1
563 1 30 GLN H 1 59 PRO HB2 . . 4.230 3.566 3.289 3.649 . 0 0 "[ . 1 . 2]" 1
564 1 30 GLN H 1 59 PRO QB . . 3.700 3.392 3.140 3.449 . 0 0 "[ . 1 . 2]" 1
565 1 30 GLN H 1 59 PRO HB3 . . 4.230 4.246 3.974 4.329 0.099 20 0 "[ . 1 . 2]" 1
566 1 30 GLN H 1 61 VAL H . . 5.160 4.203 4.028 4.326 . 0 0 "[ . 1 . 2]" 1
567 1 30 GLN H 1 61 VAL HB . . 5.010 4.048 3.783 4.378 . 0 0 "[ . 1 . 2]" 1
568 1 30 GLN H 1 61 VAL QG . . 4.010 3.781 3.617 3.926 . 0 0 "[ . 1 . 2]" 1
569 1 30 GLN H 1 62 THR HA . . 3.690 2.850 2.363 3.038 . 0 0 "[ . 1 . 2]" 1
570 1 30 GLN H 1 62 THR MG . . 4.040 4.031 3.640 4.112 0.072 11 0 "[ . 1 . 2]" 1
571 1 30 GLN H 1 63 VAL H . . 4.680 2.953 2.712 3.248 . 0 0 "[ . 1 . 2]" 1
572 1 30 GLN HA 1 30 GLN HE21 . . 4.750 3.697 2.925 3.989 . 0 0 "[ . 1 . 2]" 1
573 1 30 GLN HA 1 30 GLN QE . . 3.950 3.316 2.861 3.572 . 0 0 "[ . 1 . 2]" 1
574 1 30 GLN HA 1 30 GLN HE22 . . 4.750 3.809 3.576 4.163 . 0 0 "[ . 1 . 2]" 1
575 1 30 GLN HA 1 31 LEU H . . 3.070 2.213 2.182 2.229 . 0 0 "[ . 1 . 2]" 1
576 1 30 GLN HA 1 43 ILE HA . . 3.950 2.834 2.723 3.029 . 0 0 "[ . 1 . 2]" 1
577 1 30 GLN HA 1 44 VAL H . . 4.100 3.487 3.304 3.718 . 0 0 "[ . 1 . 2]" 1
578 1 30 GLN QB 1 31 LEU H . . 4.120 3.980 3.894 4.004 . 0 0 "[ . 1 . 2]" 1
579 1 30 GLN QB 1 56 PHE H . . 4.280 4.053 3.780 4.353 0.073 18 0 "[ . 1 . 2]" 1
580 1 30 GLN QB 1 59 PRO QG . . 4.150 1.944 1.901 2.024 . 0 0 "[ . 1 . 2]" 1
581 1 30 GLN QB 1 62 THR HA . . 3.500 1.992 1.930 2.261 . 0 0 "[ . 1 . 2]" 1
582 1 30 GLN QB 1 62 THR HB . . 5.180 4.106 3.724 4.434 . 0 0 "[ . 1 . 2]" 1
583 1 30 GLN QB 1 62 THR MG . . 3.830 1.942 1.809 2.200 . 0 0 "[ . 1 . 2]" 1
584 1 30 GLN QB 1 63 VAL H . . 3.990 3.035 2.856 3.410 . 0 0 "[ . 1 . 2]" 1
585 1 30 GLN HB2 1 62 THR HA . . 4.100 3.340 2.676 3.674 . 0 0 "[ . 1 . 2]" 1
586 1 30 GLN HB3 1 62 THR HA . . 4.100 2.017 1.943 2.438 . 0 0 "[ . 1 . 2]" 1
587 1 30 GLN QE 1 30 GLN QG . . 2.810 2.092 2.069 2.123 . 0 0 "[ . 1 . 2]" 1
588 1 30 GLN QE 1 31 LEU H . . 4.040 3.763 3.501 4.050 0.010 9 0 "[ . 1 . 2]" 1
589 1 30 GLN QE 1 41 GLN QB . . 3.260 2.061 1.926 2.522 . 0 0 "[ . 1 . 2]" 1
590 1 30 GLN QE 1 41 GLN QE . . 4.460 3.822 3.315 4.028 . 0 0 "[ . 1 . 2]" 1
591 1 30 GLN QE 1 42 TRP H . . 3.950 1.923 1.755 2.188 . 0 0 "[ . 1 . 2]" 1
592 1 30 GLN QE 1 55 VAL H . . 5.340 4.208 4.043 4.651 . 0 0 "[ . 1 . 2]" 1
593 1 30 GLN QE 1 55 VAL HA . . 3.260 2.070 1.924 2.439 . 0 0 "[ . 1 . 2]" 1
594 1 30 GLN QE 1 55 VAL HB . . 3.250 3.109 2.859 3.271 0.021 13 0 "[ . 1 . 2]" 1
595 1 30 GLN QE 1 55 VAL QG . . 3.030 2.927 2.735 3.040 0.010 19 0 "[ . 1 . 2]" 1
596 1 30 GLN QE 1 56 PHE H . . 3.820 3.558 3.074 3.823 0.003 15 0 "[ . 1 . 2]" 1
597 1 30 GLN HE21 1 31 LEU H . . 4.760 4.135 3.705 4.499 . 0 0 "[ . 1 . 2]" 1
598 1 30 GLN HE21 1 41 GLN HA . . 4.450 3.070 2.808 4.460 0.010 18 0 "[ . 1 . 2]" 1
599 1 30 GLN HE21 1 42 TRP H . . 4.620 2.226 1.894 3.049 . 0 0 "[ . 1 . 2]" 1
600 1 30 GLN HE21 1 55 VAL HA . . 4.050 3.091 2.103 3.369 . 0 0 "[ . 1 . 2]" 1
601 1 30 GLN HE22 1 30 GLN HG2 . . 3.830 3.809 3.438 3.915 0.085 19 0 "[ . 1 . 2]" 1
602 1 30 GLN HE22 1 30 GLN HG3 . . 3.830 3.507 3.439 3.978 0.148 13 0 "[ . 1 . 2]" 1
603 1 30 GLN HE22 1 31 LEU H . . 4.760 4.349 4.101 4.692 . 0 0 "[ . 1 . 2]" 1
604 1 30 GLN HE22 1 41 GLN HA . . 4.450 3.539 2.423 3.978 . 0 0 "[ . 1 . 2]" 1
605 1 30 GLN HE22 1 42 TRP H . . 4.620 2.131 1.884 2.570 . 0 0 "[ . 1 . 2]" 1
606 1 30 GLN HE22 1 55 VAL HA . . 4.050 2.178 1.940 3.359 . 0 0 "[ . 1 . 2]" 1
607 1 30 GLN QG 1 31 LEU H . . 4.190 3.903 3.614 4.035 . 0 0 "[ . 1 . 2]" 1
608 1 30 GLN QG 1 32 ASN QD . . 3.900 2.316 1.892 3.672 . 0 0 "[ . 1 . 2]" 1
609 1 30 GLN QG 1 55 VAL QG . . 5.110 2.128 1.951 2.479 . 0 0 "[ . 1 . 2]" 1
610 1 30 GLN QG 1 62 THR HA . . 4.340 3.715 3.342 4.194 . 0 0 "[ . 1 . 2]" 1
611 1 30 GLN QG 1 62 THR MG . . 3.240 2.456 2.036 2.771 . 0 0 "[ . 1 . 2]" 1
612 1 30 GLN QG 1 63 VAL H . . 5.050 4.279 3.902 5.074 0.024 13 0 "[ . 1 . 2]" 1
613 1 30 GLN HG2 1 62 THR HA . . 4.960 4.296 3.827 5.021 0.061 18 0 "[ . 1 . 2]" 1
614 1 30 GLN HG2 1 62 THR MG . . 3.840 2.774 2.161 3.900 0.060 18 0 "[ . 1 . 2]" 1
615 1 30 GLN HG3 1 62 THR HA . . 4.960 4.070 3.684 4.494 . 0 0 "[ . 1 . 2]" 1
616 1 30 GLN HG3 1 62 THR MG . . 3.840 2.823 2.486 3.037 . 0 0 "[ . 1 . 2]" 1
617 1 31 LEU H 1 31 LEU QB . . 3.320 2.163 2.102 2.221 . 0 0 "[ . 1 . 2]" 1
618 1 31 LEU H 1 31 LEU MD1 . . 5.500 4.268 4.230 4.308 . 0 0 "[ . 1 . 2]" 1
619 1 31 LEU H 1 31 LEU QD . . 4.360 3.760 3.728 3.793 . 0 0 "[ . 1 . 2]" 1
620 1 31 LEU H 1 31 LEU MD2 . . 5.500 4.177 4.102 4.228 . 0 0 "[ . 1 . 2]" 1
621 1 31 LEU H 1 31 LEU HG . . 4.170 4.152 3.952 4.314 0.144 18 0 "[ . 1 . 2]" 1
622 1 31 LEU H 1 32 ASN H . . 5.090 4.522 4.494 4.540 . 0 0 "[ . 1 . 2]" 1
623 1 31 LEU H 1 42 TRP H . . 4.250 3.653 3.370 3.823 . 0 0 "[ . 1 . 2]" 1
624 1 31 LEU H 1 42 TRP QB . . 5.340 3.141 2.987 3.418 . 0 0 "[ . 1 . 2]" 1
625 1 31 LEU H 1 43 ILE HA . . 4.220 3.629 3.072 3.875 . 0 0 "[ . 1 . 2]" 1
626 1 31 LEU H 1 44 VAL H . . 4.250 3.874 3.735 4.029 . 0 0 "[ . 1 . 2]" 1
627 1 31 LEU HA 1 31 LEU MD1 . . 4.440 2.764 2.156 3.823 . 0 0 "[ . 1 . 2]" 1
628 1 31 LEU HA 1 31 LEU QD . . 3.190 2.296 2.147 2.432 . 0 0 "[ . 1 . 2]" 1
629 1 31 LEU HA 1 31 LEU MD2 . . 4.440 3.469 2.165 3.990 . 0 0 "[ . 1 . 2]" 1
630 1 31 LEU HA 1 32 ASN H . . 2.700 2.156 2.146 2.167 . 0 0 "[ . 1 . 2]" 1
631 1 31 LEU HA 1 63 VAL H . . 3.410 3.466 3.360 3.536 0.126 19 0 "[ . 1 . 2]" 1
632 1 31 LEU HA 1 63 VAL HB . . 3.950 2.308 2.051 4.251 0.301 20 0 "[ . 1 . 2]" 1
633 1 31 LEU HA 1 63 VAL QG . . 5.040 3.047 1.778 3.313 . 0 0 "[ . 1 . 2]" 1
634 1 31 LEU QB 1 31 LEU QD . . 2.730 1.927 1.891 1.959 . 0 0 "[ . 1 . 2]" 1
635 1 31 LEU QB 1 32 ASN H . . 4.350 3.661 3.612 3.706 . 0 0 "[ . 1 . 2]" 1
636 1 31 LEU QB 1 42 TRP H . . 4.720 4.056 3.494 4.422 . 0 0 "[ . 1 . 2]" 1
637 1 31 LEU QB 1 42 TRP QB . . 3.920 2.157 1.899 2.424 . 0 0 "[ . 1 . 2]" 1
638 1 31 LEU QB 1 63 VAL QG . . 4.260 3.550 2.650 4.178 . 0 0 "[ . 1 . 2]" 1
639 1 31 LEU HB2 1 42 TRP HB2 . . 5.230 3.721 2.953 4.157 . 0 0 "[ . 1 . 2]" 1
640 1 31 LEU HB2 1 42 TRP HB3 . . 5.230 4.784 3.865 5.280 0.050 7 0 "[ . 1 . 2]" 1
641 1 31 LEU HB3 1 42 TRP HB2 . . 5.230 2.205 1.934 2.505 . 0 0 "[ . 1 . 2]" 1
642 1 31 LEU HB3 1 42 TRP HB3 . . 5.230 3.395 2.966 3.569 . 0 0 "[ . 1 . 2]" 1
643 1 31 LEU QD 1 32 ASN H . . 3.680 2.104 1.951 2.254 . 0 0 "[ . 1 . 2]" 1
644 1 31 LEU QD 1 42 TRP QB . . 4.030 2.770 2.423 3.072 . 0 0 "[ . 1 . 2]" 1
645 1 31 LEU QD 1 42 TRP HD1 . . 5.070 3.360 3.057 3.626 . 0 0 "[ . 1 . 2]" 1
646 1 31 LEU QD 1 44 VAL QG . . 3.280 3.150 2.841 3.404 0.124 5 0 "[ . 1 . 2]" 1
647 1 31 LEU QD 1 70 MET ME . . 3.020 1.721 1.640 2.155 . 0 0 "[ . 1 . 2]" 1
648 1 31 LEU MD1 1 70 MET ME . . 3.860 1.924 1.762 2.434 . 0 0 "[ . 1 . 2]" 1
649 1 31 LEU MD2 1 70 MET ME . . 3.860 1.981 1.779 2.405 . 0 0 "[ . 1 . 2]" 1
650 1 31 LEU HG 1 32 ASN H . . 4.000 3.604 3.191 4.019 0.019 6 0 "[ . 1 . 2]" 1
651 1 32 ASN H 1 32 ASN HB2 . . 3.830 2.748 2.663 2.817 . 0 0 "[ . 1 . 2]" 1
652 1 32 ASN H 1 32 ASN QB . . 3.210 2.689 2.613 2.749 . 0 0 "[ . 1 . 2]" 1
653 1 32 ASN H 1 32 ASN HB3 . . 3.830 3.817 3.794 3.830 . 0 0 "[ . 1 . 2]" 1
654 1 32 ASN H 1 32 ASN HD21 . . 4.500 2.822 2.384 4.271 . 0 0 "[ . 1 . 2]" 1
655 1 32 ASN H 1 32 ASN QD . . 3.920 2.733 2.361 3.932 0.012 3 0 "[ . 1 . 2]" 1
656 1 32 ASN H 1 32 ASN HD22 . . 4.500 4.016 3.722 4.599 0.099 3 0 "[ . 1 . 2]" 1
657 1 32 ASN H 1 33 ILE H . . 4.890 4.156 4.065 4.422 . 0 0 "[ . 1 . 2]" 1
658 1 32 ASN H 1 64 THR HA . . 3.640 3.067 2.467 3.266 . 0 0 "[ . 1 . 2]" 1
659 1 32 ASN H 1 64 THR MG . . 4.230 4.152 3.710 4.327 0.097 4 0 "[ . 1 . 2]" 1
660 1 32 ASN H 1 65 VAL H . . 3.790 3.345 3.153 3.725 . 0 0 "[ . 1 . 2]" 1
661 1 32 ASN HA 1 32 ASN QD . . 4.400 3.698 3.486 4.168 . 0 0 "[ . 1 . 2]" 1
662 1 32 ASN HA 1 33 ILE H . . 2.870 2.157 2.142 2.215 . 0 0 "[ . 1 . 2]" 1
663 1 32 ASN HA 1 39 VAL MG1 . . 4.390 4.468 4.145 4.566 0.176 15 0 "[ . 1 . 2]" 1
664 1 32 ASN HA 1 39 VAL QG . . 3.490 3.216 2.947 3.381 . 0 0 "[ . 1 . 2]" 1
665 1 32 ASN HA 1 39 VAL MG2 . . 4.390 3.298 3.015 3.484 . 0 0 "[ . 1 . 2]" 1
666 1 32 ASN HA 1 40 GLU H . . 5.240 4.630 4.463 4.789 . 0 0 "[ . 1 . 2]" 1
667 1 32 ASN HA 1 41 GLN HA . . 3.920 2.736 2.586 3.084 . 0 0 "[ . 1 . 2]" 1
668 1 32 ASN HA 1 41 GLN QB . . 4.990 4.698 4.463 5.037 0.047 10 0 "[ . 1 . 2]" 1
669 1 32 ASN HA 1 41 GLN QG . . 4.420 4.346 4.123 4.473 0.053 2 0 "[ . 1 . 2]" 1
670 1 32 ASN HA 1 42 TRP H . . 4.550 3.814 3.510 4.193 . 0 0 "[ . 1 . 2]" 1
671 1 32 ASN QB 1 32 ASN QD . . 2.950 2.230 2.153 2.283 . 0 0 "[ . 1 . 2]" 1
672 1 32 ASN QB 1 33 ILE H . . 3.930 3.406 2.912 3.532 . 0 0 "[ . 1 . 2]" 1
673 1 32 ASN QB 1 39 VAL QG . . 3.190 2.232 2.072 2.455 . 0 0 "[ . 1 . 2]" 1
674 1 32 ASN QB 1 41 GLN QE . . 4.610 3.564 2.935 4.032 . 0 0 "[ . 1 . 2]" 1
675 1 32 ASN QB 1 64 THR HA . . 3.510 2.388 1.972 2.521 . 0 0 "[ . 1 . 2]" 1
676 1 32 ASN QB 1 65 VAL H . . 5.140 3.446 2.999 3.880 . 0 0 "[ . 1 . 2]" 1
677 1 32 ASN HB2 1 33 ILE H . . 4.770 4.261 3.844 4.414 . 0 0 "[ . 1 . 2]" 1
678 1 32 ASN HB2 1 39 VAL MG1 . . 4.920 4.837 4.613 5.008 0.088 10 0 "[ . 1 . 2]" 1
679 1 32 ASN HB2 1 39 VAL MG2 . . 4.920 3.445 3.237 3.643 . 0 0 "[ . 1 . 2]" 1
680 1 32 ASN HB2 1 64 THR HA . . 4.130 2.404 1.979 2.541 . 0 0 "[ . 1 . 2]" 1
681 1 32 ASN HB2 1 64 THR MG . . 3.800 2.218 1.920 2.499 . 0 0 "[ . 1 . 2]" 1
682 1 32 ASN HB3 1 33 ILE H . . 4.770 3.583 3.015 3.731 . 0 0 "[ . 1 . 2]" 1
683 1 32 ASN HB3 1 39 VAL MG1 . . 4.920 3.383 3.214 3.540 . 0 0 "[ . 1 . 2]" 1
684 1 32 ASN HB3 1 39 VAL MG2 . . 4.920 2.302 2.125 2.559 . 0 0 "[ . 1 . 2]" 1
685 1 32 ASN HB3 1 64 THR HA . . 4.130 4.096 3.662 4.229 0.099 5 0 "[ . 1 . 2]" 1
686 1 32 ASN HB3 1 64 THR MG . . 3.800 3.272 2.842 3.585 . 0 0 "[ . 1 . 2]" 1
687 1 32 ASN QD 1 33 ILE H . . 5.230 5.340 5.241 5.595 0.365 11 0 "[ . 1 . 2]" 1
688 1 32 ASN QD 1 41 GLN QE . . 4.690 3.831 2.934 4.181 . 0 0 "[ . 1 . 2]" 1
689 1 32 ASN QD 1 62 THR HA . . 4.290 3.684 2.931 4.314 0.024 4 0 "[ . 1 . 2]" 1
690 1 32 ASN QD 1 62 THR MG . . 3.010 2.189 1.805 2.611 . 0 0 "[ . 1 . 2]" 1
691 1 32 ASN QD 1 64 THR MG . . 3.670 3.003 1.894 3.677 0.007 19 0 "[ . 1 . 2]" 1
692 1 32 ASN HD21 1 62 THR MG . . 3.560 3.267 2.414 3.568 0.008 17 0 "[ . 1 . 2]" 1
693 1 32 ASN HD22 1 62 THR MG . . 3.560 2.229 1.864 2.685 . 0 0 "[ . 1 . 2]" 1
694 1 33 ILE H 1 33 ILE HB . . 3.070 2.619 2.523 2.742 . 0 0 "[ . 1 . 2]" 1
695 1 33 ILE H 1 33 ILE MD . . 4.150 2.145 1.943 2.530 . 0 0 "[ . 1 . 2]" 1
696 1 33 ILE H 1 33 ILE HG12 . . 4.830 4.149 4.016 4.520 . 0 0 "[ . 1 . 2]" 1
697 1 33 ILE H 1 33 ILE QG . . 4.170 3.101 2.955 3.468 . 0 0 "[ . 1 . 2]" 1
698 1 33 ILE H 1 33 ILE HG13 . . 4.830 3.204 3.028 3.602 . 0 0 "[ . 1 . 2]" 1
699 1 33 ILE H 1 33 ILE MG . . 4.620 3.835 3.795 3.894 . 0 0 "[ . 1 . 2]" 1
700 1 33 ILE H 1 34 LYS H . . 4.680 4.451 4.222 4.513 . 0 0 "[ . 1 . 2]" 1
701 1 33 ILE H 1 40 GLU H . . 3.980 3.206 2.819 3.404 . 0 0 "[ . 1 . 2]" 1
702 1 33 ILE H 1 41 GLN HA . . 4.660 3.987 3.852 4.172 . 0 0 "[ . 1 . 2]" 1
703 1 33 ILE HA 1 33 ILE MD . . 4.350 3.457 3.330 3.597 . 0 0 "[ . 1 . 2]" 1
704 1 33 ILE HA 1 33 ILE MG . . 3.510 2.339 2.240 2.399 . 0 0 "[ . 1 . 2]" 1
705 1 33 ILE HA 1 34 LYS H . . 3.190 2.166 2.140 2.192 . 0 0 "[ . 1 . 2]" 1
706 1 33 ILE HA 1 65 VAL H . . 3.780 3.572 3.184 3.817 0.037 17 0 "[ . 1 . 2]" 1
707 1 33 ILE HB 1 33 ILE MD . . 3.440 2.199 2.117 2.266 . 0 0 "[ . 1 . 2]" 1
708 1 33 ILE HB 1 34 LYS H . . 4.400 4.074 3.953 4.266 . 0 0 "[ . 1 . 2]" 1
709 1 33 ILE MD 1 34 LYS H . . 5.500 5.044 4.989 5.156 . 0 0 "[ . 1 . 2]" 1
710 1 33 ILE MD 1 41 GLN HA . . 4.230 4.315 4.243 4.413 0.183 2 0 "[ . 1 . 2]" 1
711 1 33 ILE MD 1 42 TRP H . . 5.230 4.601 4.261 4.748 . 0 0 "[ . 1 . 2]" 1
712 1 33 ILE MD 1 42 TRP QB . . 4.840 3.353 3.037 3.572 . 0 0 "[ . 1 . 2]" 1
713 1 33 ILE MD 1 42 TRP HD1 . . 3.980 2.044 1.909 2.281 . 0 0 "[ . 1 . 2]" 1
714 1 33 ILE MD 1 42 TRP HE1 . . 3.990 2.408 2.140 2.867 . 0 0 "[ . 1 . 2]" 1
715 1 33 ILE QG 1 34 LYS H . . 4.000 4.157 4.094 4.220 0.220 10 0 "[ . 1 . 2]" 1
716 1 33 ILE MG 1 34 LYS H . . 3.390 2.462 2.226 2.763 . 0 0 "[ . 1 . 2]" 1
717 1 33 ILE MG 1 66 GLY HA2 . . 4.440 3.463 2.992 3.612 . 0 0 "[ . 1 . 2]" 1
718 1 33 ILE MG 1 66 GLY QA . . 3.820 3.355 2.911 3.483 . 0 0 "[ . 1 . 2]" 1
719 1 33 ILE MG 1 66 GLY HA3 . . 4.440 4.498 3.989 4.621 0.181 13 0 "[ . 1 . 2]" 1
720 1 34 LYS H 1 34 LYS HB2 . . 4.070 2.761 2.216 3.596 . 0 0 "[ . 1 . 2]" 1
721 1 34 LYS H 1 34 LYS HB3 . . 4.070 2.996 2.205 3.520 . 0 0 "[ . 1 . 2]" 1
722 1 34 LYS H 1 34 LYS HG2 . . 4.240 3.685 2.676 4.474 0.234 7 0 "[ . 1 . 2]" 1
723 1 34 LYS H 1 34 LYS QG . . 3.720 3.002 2.639 3.912 0.192 7 0 "[ . 1 . 2]" 1
724 1 34 LYS H 1 34 LYS HG3 . . 4.240 3.606 3.153 4.318 0.078 7 0 "[ . 1 . 2]" 1
725 1 34 LYS H 1 35 THR H . . 4.850 4.622 4.597 4.634 . 0 0 "[ . 1 . 2]" 1
726 1 34 LYS H 1 66 GLY HA2 . . 4.240 2.224 1.869 2.518 . 0 0 "[ . 1 . 2]" 1
727 1 34 LYS H 1 66 GLY QA . . 3.560 2.212 1.863 2.500 . 0 0 "[ . 1 . 2]" 1
728 1 34 LYS H 1 66 GLY HA3 . . 4.240 3.941 3.620 4.246 0.006 6 0 "[ . 1 . 2]" 1
729 1 34 LYS H 1 67 LEU H . . 5.250 3.111 2.798 3.558 . 0 0 "[ . 1 . 2]" 1
730 1 34 LYS HA 1 34 LYS QD . . 4.070 3.960 3.689 4.302 0.232 10 0 "[ . 1 . 2]" 1
731 1 34 LYS HA 1 34 LYS HG2 . . 3.900 3.287 2.541 3.613 . 0 0 "[ . 1 . 2]" 1
732 1 34 LYS HA 1 34 LYS HG3 . . 3.900 2.872 2.201 3.887 . 0 0 "[ . 1 . 2]" 1
733 1 34 LYS HA 1 35 THR H . . 2.940 2.284 2.237 2.312 . 0 0 "[ . 1 . 2]" 1
734 1 34 LYS HA 1 38 GLY H . . 5.420 5.579 5.549 5.614 0.194 2 0 "[ . 1 . 2]" 1
735 1 34 LYS HA 1 39 VAL HA . . 3.550 2.584 2.445 2.746 . 0 0 "[ . 1 . 2]" 1
736 1 34 LYS HA 1 39 VAL MG1 . . 4.360 4.503 4.432 4.572 0.212 2 0 "[ . 1 . 2]" 1
737 1 34 LYS HA 1 39 VAL MG2 . . 4.360 2.048 1.966 2.165 . 0 0 "[ . 1 . 2]" 1
738 1 34 LYS HA 1 40 GLU H . . 5.140 3.827 3.697 3.995 . 0 0 "[ . 1 . 2]" 1
739 1 34 LYS QB 1 35 THR H . . 3.510 2.809 2.673 3.397 . 0 0 "[ . 1 . 2]" 1
740 1 34 LYS QB 1 66 GLY QA . . 3.880 2.278 1.788 2.855 . 0 0 "[ . 1 . 2]" 1
741 1 34 LYS HB2 1 35 THR H . . 4.070 3.594 2.782 4.145 0.075 7 0 "[ . 1 . 2]" 1
742 1 34 LYS HB2 1 66 GLY HA2 . . 5.320 2.938 1.918 4.454 . 0 0 "[ . 1 . 2]" 1
743 1 34 LYS HB2 1 66 GLY HA3 . . 5.320 4.031 2.953 5.519 0.199 5 0 "[ . 1 . 2]" 1
744 1 34 LYS HB3 1 35 THR H . . 4.070 3.361 2.715 4.212 0.142 9 0 "[ . 1 . 2]" 1
745 1 34 LYS HB3 1 66 GLY HA2 . . 5.320 3.301 2.113 4.149 . 0 0 "[ . 1 . 2]" 1
746 1 34 LYS HB3 1 66 GLY HA3 . . 5.320 4.338 2.802 4.950 . 0 0 "[ . 1 . 2]" 1
747 1 34 LYS QG 1 66 GLY QA . . 3.680 3.073 2.451 3.668 . 0 0 "[ . 1 . 2]" 1
748 1 34 LYS HG2 1 35 THR H . . 3.930 3.884 2.095 4.071 0.141 19 0 "[ . 1 . 2]" 1
749 1 34 LYS HG2 1 66 GLY HA2 . . 4.870 3.631 2.549 4.491 . 0 0 "[ . 1 . 2]" 1
750 1 34 LYS HG2 1 66 GLY HA3 . . 4.870 4.467 3.455 5.233 0.363 7 0 "[ . 1 . 2]" 1
751 1 34 LYS HG3 1 35 THR H . . 3.930 3.799 3.347 4.035 0.105 17 0 "[ . 1 . 2]" 1
752 1 34 LYS HG3 1 66 GLY HA2 . . 4.870 3.852 3.616 4.252 . 0 0 "[ . 1 . 2]" 1
753 1 34 LYS HG3 1 66 GLY HA3 . . 4.870 4.868 4.577 4.985 0.115 12 0 "[ . 1 . 2]" 1
754 1 35 THR H 1 35 THR MG . . 3.310 2.698 2.277 2.850 . 0 0 "[ . 1 . 2]" 1
755 1 35 THR H 1 36 ALA H . . 5.500 4.406 4.394 4.414 . 0 0 "[ . 1 . 2]" 1
756 1 35 THR H 1 38 GLY H . . 4.120 3.562 3.521 3.611 . 0 0 "[ . 1 . 2]" 1
757 1 35 THR H 1 40 GLU H . . 4.970 4.675 4.517 4.835 . 0 0 "[ . 1 . 2]" 1
758 1 35 THR H 1 67 LEU MD1 . . 5.500 4.854 4.652 4.948 . 0 0 "[ . 1 . 2]" 1
759 1 35 THR H 1 67 LEU QD . . 4.370 4.561 4.425 4.629 0.259 15 0 "[ . 1 . 2]" 1
760 1 35 THR H 1 67 LEU MD2 . . 5.500 5.545 5.513 5.601 0.101 19 0 "[ . 1 . 2]" 1
761 1 35 THR HA 1 35 THR MG . . 3.500 2.595 2.456 3.088 . 0 0 "[ . 1 . 2]" 1
762 1 35 THR HA 1 37 SER H . . 4.130 4.092 3.945 4.194 0.064 11 0 "[ . 1 . 2]" 1
763 1 35 THR HA 1 67 LEU MD1 . . 4.910 3.326 2.951 3.447 . 0 0 "[ . 1 . 2]" 1
764 1 35 THR HA 1 67 LEU QD . . 4.230 2.885 2.743 3.020 . 0 0 "[ . 1 . 2]" 1
765 1 35 THR HA 1 67 LEU MD2 . . 4.910 3.173 3.056 3.454 . 0 0 "[ . 1 . 2]" 1
766 1 35 THR HB 1 36 ALA H . . 4.270 2.447 2.220 3.294 . 0 0 "[ . 1 . 2]" 1
767 1 35 THR HB 1 36 ALA MB . . 4.520 4.145 3.969 4.810 0.290 9 0 "[ . 1 . 2]" 1
768 1 35 THR HB 1 37 SER H . . 5.350 3.082 2.836 3.838 . 0 0 "[ . 1 . 2]" 1
769 1 35 THR HB 1 67 LEU MD1 . . 4.980 3.879 2.625 4.551 . 0 0 "[ . 1 . 2]" 1
770 1 35 THR HB 1 67 LEU MD2 . . 4.980 4.166 3.240 5.013 0.033 11 0 "[ . 1 . 2]" 1
771 1 35 THR MG 1 36 ALA H . . 4.800 3.853 3.794 3.961 . 0 0 "[ . 1 . 2]" 1
772 1 35 THR MG 1 37 SER H . . 4.450 3.895 3.036 4.075 . 0 0 "[ . 1 . 2]" 1
773 1 35 THR MG 1 38 GLY H . . 4.320 3.972 3.086 4.303 . 0 0 "[ . 1 . 2]" 1
774 1 35 THR MG 1 39 VAL HA . . 3.320 2.125 2.049 2.252 . 0 0 "[ . 1 . 2]" 1
775 1 35 THR MG 1 39 VAL HB . . 4.360 4.378 4.187 4.453 0.093 18 0 "[ . 1 . 2]" 1
776 1 35 THR MG 1 40 GLU H . . 3.880 2.477 2.265 2.717 . 0 0 "[ . 1 . 2]" 1
777 1 35 THR MG 1 40 GLU HA . . 4.060 3.997 3.721 4.171 0.111 7 0 "[ . 1 . 2]" 1
778 1 35 THR MG 1 40 GLU QB . . 3.940 3.192 2.450 3.694 . 0 0 "[ . 1 . 2]" 1
779 1 36 ALA MB 1 37 SER H . . 3.650 3.093 3.042 3.164 . 0 0 "[ . 1 . 2]" 1
780 1 36 ALA MB 1 38 GLY H . . 4.490 4.473 4.447 4.498 0.008 19 0 "[ . 1 . 2]" 1
781 1 37 SER H 1 37 SER HB2 . . 4.050 2.535 2.360 3.422 . 0 0 "[ . 1 . 2]" 1
782 1 37 SER H 1 37 SER QB . . 3.430 2.438 2.312 3.100 . 0 0 "[ . 1 . 2]" 1
783 1 37 SER H 1 37 SER HB3 . . 4.050 3.382 2.619 3.746 . 0 0 "[ . 1 . 2]" 1
784 1 37 SER H 1 38 GLY H . . 3.540 2.267 2.133 2.511 . 0 0 "[ . 1 . 2]" 1
785 1 37 SER HA 1 38 GLY H . . 3.560 3.126 3.004 3.206 . 0 0 "[ . 1 . 2]" 1
786 1 37 SER QB 1 38 GLY H . . 3.850 3.612 3.500 3.780 . 0 0 "[ . 1 . 2]" 1
787 1 38 GLY H 1 39 VAL H . . 4.990 4.288 4.232 4.392 . 0 0 "[ . 1 . 2]" 1
788 1 38 GLY QA 1 39 VAL HB . . 4.720 3.899 3.885 3.917 . 0 0 "[ . 1 . 2]" 1
789 1 38 GLY QA 1 39 VAL QG . . 4.330 3.681 3.649 3.701 . 0 0 "[ . 1 . 2]" 1
790 1 38 GLY HA2 1 39 VAL H . . 3.000 3.172 3.113 3.218 0.218 11 0 "[ . 1 . 2]" 1
791 1 38 GLY HA2 1 39 VAL HB . . 5.500 4.255 4.215 4.312 . 0 0 "[ . 1 . 2]" 1
792 1 38 GLY HA3 1 39 VAL H . . 3.000 2.147 2.138 2.164 . 0 0 "[ . 1 . 2]" 1
793 1 38 GLY HA3 1 39 VAL HB . . 5.500 4.527 4.481 4.603 . 0 0 "[ . 1 . 2]" 1
794 1 39 VAL H 1 39 VAL HB . . 2.950 3.144 3.102 3.180 0.230 10 0 "[ . 1 . 2]" 1
795 1 39 VAL H 1 39 VAL MG1 . . 4.040 2.368 2.327 2.394 . 0 0 "[ . 1 . 2]" 1
796 1 39 VAL H 1 39 VAL QG . . 3.340 2.351 2.312 2.376 . 0 0 "[ . 1 . 2]" 1
797 1 39 VAL H 1 39 VAL MG2 . . 4.040 3.995 3.986 4.002 . 0 0 "[ . 1 . 2]" 1
798 1 39 VAL H 1 40 GLU H . . 4.700 4.324 4.297 4.365 . 0 0 "[ . 1 . 2]" 1
799 1 39 VAL HA 1 40 GLU H . . 2.710 2.207 2.188 2.228 . 0 0 "[ . 1 . 2]" 1
800 1 39 VAL HB 1 40 GLU H . . 4.050 4.183 4.141 4.214 0.164 18 0 "[ . 1 . 2]" 1
801 1 39 VAL QG 1 40 GLU H . . 3.100 2.223 2.062 2.324 . 0 0 "[ . 1 . 2]" 1
802 1 39 VAL QG 1 40 GLU HA . . 3.880 3.557 3.505 3.664 . 0 0 "[ . 1 . 2]" 1
803 1 39 VAL QG 1 41 GLN QB . . 4.270 4.335 4.196 4.425 0.155 2 0 "[ . 1 . 2]" 1
804 1 39 VAL QG 1 41 GLN QE . . 2.790 2.568 2.331 2.694 . 0 0 "[ . 1 . 2]" 1
805 1 39 VAL QG 1 41 GLN QG . . 3.220 2.678 2.496 2.800 . 0 0 "[ . 1 . 2]" 1
806 1 39 VAL QG 1 64 THR HA . . 5.360 4.836 4.479 5.120 . 0 0 "[ . 1 . 2]" 1
807 1 39 VAL MG1 1 40 GLU H . . 3.700 3.604 3.538 3.704 0.004 10 0 "[ . 1 . 2]" 1
808 1 39 VAL MG1 1 41 GLN HE21 . . 4.910 2.656 2.389 2.800 . 0 0 "[ . 1 . 2]" 1
809 1 39 VAL MG1 1 41 GLN HE22 . . 4.910 3.848 3.584 4.025 . 0 0 "[ . 1 . 2]" 1
810 1 39 VAL MG2 1 40 GLU H . . 3.700 2.245 2.076 2.352 . 0 0 "[ . 1 . 2]" 1
811 1 39 VAL MG2 1 41 GLN HE21 . . 4.910 4.033 3.661 4.267 . 0 0 "[ . 1 . 2]" 1
812 1 39 VAL MG2 1 41 GLN HE22 . . 4.910 4.854 4.581 4.975 0.065 2 0 "[ . 1 . 2]" 1
813 1 40 GLU H 1 40 GLU HB2 . . 3.960 2.850 2.411 3.655 . 0 0 "[ . 1 . 2]" 1
814 1 40 GLU H 1 40 GLU QB . . 3.180 2.630 2.378 2.957 . 0 0 "[ . 1 . 2]" 1
815 1 40 GLU H 1 40 GLU HB3 . . 3.960 3.518 2.943 3.711 . 0 0 "[ . 1 . 2]" 1
816 1 40 GLU H 1 40 GLU HG2 . . 4.060 2.614 1.902 3.281 . 0 0 "[ . 1 . 2]" 1
817 1 40 GLU H 1 40 GLU QG . . 3.380 2.359 1.861 2.772 . 0 0 "[ . 1 . 2]" 1
818 1 40 GLU H 1 40 GLU HG3 . . 4.060 2.967 2.258 3.866 . 0 0 "[ . 1 . 2]" 1
819 1 40 GLU HA 1 40 GLU HG2 . . 4.140 2.890 2.499 3.713 . 0 0 "[ . 1 . 2]" 1
820 1 40 GLU HA 1 40 GLU QG . . 3.610 2.758 2.462 3.349 . 0 0 "[ . 1 . 2]" 1
821 1 40 GLU HA 1 40 GLU HG3 . . 4.140 3.709 3.357 4.073 . 0 0 "[ . 1 . 2]" 1
822 1 40 GLU HA 1 41 GLN H . . 3.040 2.145 2.140 2.169 . 0 0 "[ . 1 . 2]" 1
823 1 40 GLU HA 1 42 TRP HE1 . . 5.030 4.483 4.264 4.768 . 0 0 "[ . 1 . 2]" 1
824 1 40 GLU QB 1 41 GLN H . . 3.410 3.244 3.070 3.379 . 0 0 "[ . 1 . 2]" 1
825 1 40 GLU QB 1 42 TRP HD1 . . 4.100 3.370 2.941 3.917 . 0 0 "[ . 1 . 2]" 1
826 1 40 GLU QB 1 42 TRP HE1 . . 3.090 2.092 1.947 2.389 . 0 0 "[ . 1 . 2]" 1
827 1 40 GLU HB2 1 41 GLN H . . 4.130 3.977 3.304 4.254 0.124 15 0 "[ . 1 . 2]" 1
828 1 40 GLU HB3 1 41 GLN H . . 4.130 3.574 3.191 4.189 0.059 6 0 "[ . 1 . 2]" 1
829 1 41 GLN H 1 41 GLN HB2 . . 4.170 2.494 2.406 2.695 . 0 0 "[ . 1 . 2]" 1
830 1 41 GLN H 1 41 GLN QB . . 3.320 2.452 2.372 2.629 . 0 0 "[ . 1 . 2]" 1
831 1 41 GLN H 1 41 GLN HB3 . . 4.170 3.638 3.612 3.691 . 0 0 "[ . 1 . 2]" 1
832 1 41 GLN H 1 41 GLN HG2 . . 4.040 2.649 2.473 3.045 . 0 0 "[ . 1 . 2]" 1
833 1 41 GLN H 1 41 GLN QG . . 3.320 2.543 2.302 2.918 . 0 0 "[ . 1 . 2]" 1
834 1 41 GLN H 1 41 GLN HG3 . . 4.040 3.315 2.737 3.737 . 0 0 "[ . 1 . 2]" 1
835 1 41 GLN H 1 42 TRP H . . 5.470 4.579 4.507 4.597 . 0 0 "[ . 1 . 2]" 1
836 1 41 GLN HA 1 41 GLN HE21 . . 4.680 4.141 3.222 4.381 . 0 0 "[ . 1 . 2]" 1
837 1 41 GLN HA 1 41 GLN QE . . 3.960 3.863 3.161 4.039 0.079 17 0 "[ . 1 . 2]" 1
838 1 41 GLN HA 1 41 GLN HE22 . . 4.680 4.704 4.575 4.766 0.086 16 0 "[ . 1 . 2]" 1
839 1 41 GLN HA 1 41 GLN HG2 . . 3.750 2.629 2.556 2.672 . 0 0 "[ . 1 . 2]" 1
840 1 41 GLN HA 1 41 GLN QG . . 3.290 2.581 2.514 2.621 . 0 0 "[ . 1 . 2]" 1
841 1 41 GLN HA 1 41 GLN HG3 . . 3.750 3.762 3.718 3.787 0.037 13 0 "[ . 1 . 2]" 1
842 1 41 GLN HA 1 42 TRP H . . 3.320 2.283 2.202 2.329 . 0 0 "[ . 1 . 2]" 1
843 1 41 GLN QB 1 41 GLN QE . . 3.520 3.530 3.041 3.646 0.126 20 0 "[ . 1 . 2]" 1
844 1 41 GLN QB 1 54 GLY H . . 4.230 3.092 2.860 3.264 . 0 0 "[ . 1 . 2]" 1
845 1 41 GLN QB 1 54 GLY QA . . 4.020 2.078 1.959 2.481 . 0 0 "[ . 1 . 2]" 1
846 1 41 GLN HB2 1 42 TRP H . . 4.220 3.832 3.604 4.084 . 0 0 "[ . 1 . 2]" 1
847 1 41 GLN HB3 1 42 TRP H . . 4.220 2.752 2.609 3.011 . 0 0 "[ . 1 . 2]" 1
848 1 41 GLN QE 1 41 GLN QG . . 2.920 2.173 2.097 2.201 . 0 0 "[ . 1 . 2]" 1
849 1 41 GLN QE 1 55 VAL HB . . 3.730 3.753 3.465 3.879 0.149 13 0 "[ . 1 . 2]" 1
850 1 41 GLN HE22 1 41 GLN HG2 . . 3.800 3.513 3.448 3.542 . 0 0 "[ . 1 . 2]" 1
851 1 41 GLN HE22 1 41 GLN HG3 . . 3.800 3.771 3.689 4.032 0.232 15 0 "[ . 1 . 2]" 1
852 1 41 GLN QG 1 42 TRP H . . 4.190 4.316 4.254 4.376 0.186 15 0 "[ . 1 . 2]" 1
853 1 42 TRP H 1 42 TRP HB2 . . 3.980 2.877 2.802 2.913 . 0 0 "[ . 1 . 2]" 1
854 1 42 TRP H 1 42 TRP QB . . 3.460 2.807 2.740 2.840 . 0 0 "[ . 1 . 2]" 1
855 1 42 TRP H 1 42 TRP HB3 . . 3.980 3.911 3.870 3.934 . 0 0 "[ . 1 . 2]" 1
856 1 42 TRP H 1 42 TRP HD1 . . 4.730 3.502 3.348 3.666 . 0 0 "[ . 1 . 2]" 1
857 1 42 TRP H 1 43 ILE H . . 4.720 4.307 4.264 4.390 . 0 0 "[ . 1 . 2]" 1
858 1 42 TRP HA 1 42 TRP HE3 . . 5.300 3.174 3.099 3.286 . 0 0 "[ . 1 . 2]" 1
859 1 42 TRP HA 1 43 ILE H . . 3.080 2.234 2.190 2.309 . 0 0 "[ . 1 . 2]" 1
860 1 42 TRP HA 1 51 VAL QG . . 4.490 4.526 4.399 4.610 0.120 9 0 "[ . 1 . 2]" 1
861 1 42 TRP HA 1 52 ASP H . . 4.800 4.679 4.549 4.832 0.032 18 0 "[ . 1 . 2]" 1
862 1 42 TRP HA 1 53 GLN HA . . 3.630 2.493 2.367 2.579 . 0 0 "[ . 1 . 2]" 1
863 1 42 TRP HA 1 54 GLY H . . 3.080 2.978 2.816 3.112 0.032 17 0 "[ . 1 . 2]" 1
864 1 42 TRP QB 1 42 TRP HE3 . . 3.550 2.544 2.507 2.572 . 0 0 "[ . 1 . 2]" 1
865 1 42 TRP QB 1 43 ILE H . . 3.340 2.842 2.622 2.991 . 0 0 "[ . 1 . 2]" 1
866 1 42 TRP QB 1 44 VAL QG . . 4.200 3.186 3.028 3.425 . 0 0 "[ . 1 . 2]" 1
867 1 42 TRP QB 1 52 ASP H . . 4.760 4.183 4.014 4.383 . 0 0 "[ . 1 . 2]" 1
868 1 42 TRP HB2 1 42 TRP HE3 . . 4.190 4.112 4.086 4.130 . 0 0 "[ . 1 . 2]" 1
869 1 42 TRP HB2 1 43 ILE H . . 4.060 3.999 3.846 4.095 0.035 4 0 "[ . 1 . 2]" 1
870 1 42 TRP HB3 1 42 TRP HE3 . . 4.190 2.569 2.530 2.598 . 0 0 "[ . 1 . 2]" 1
871 1 42 TRP HB3 1 43 ILE H . . 4.060 2.909 2.668 3.074 . 0 0 "[ . 1 . 2]" 1
872 1 42 TRP HD1 1 54 GLY H . . 5.500 5.434 5.224 5.544 0.044 9 0 "[ . 1 . 2]" 1
873 1 42 TRP HE3 1 43 ILE H . . 4.090 3.544 3.307 3.809 . 0 0 "[ . 1 . 2]" 1
874 1 42 TRP HE3 1 51 VAL HA . . 5.440 5.425 5.271 5.505 0.065 19 0 "[ . 1 . 2]" 1
875 1 42 TRP HE3 1 51 VAL QG . . 3.570 2.760 2.590 2.899 . 0 0 "[ . 1 . 2]" 1
876 1 42 TRP HE3 1 52 ASP H . . 4.390 3.822 3.635 3.982 . 0 0 "[ . 1 . 2]" 1
877 1 42 TRP HE3 1 52 ASP HA . . 4.250 4.247 4.168 4.308 0.058 15 0 "[ . 1 . 2]" 1
878 1 42 TRP HE3 1 53 GLN H . . 4.440 4.372 4.250 4.451 0.011 12 0 "[ . 1 . 2]" 1
879 1 42 TRP HE3 1 53 GLN HA . . 5.500 2.773 2.665 2.914 . 0 0 "[ . 1 . 2]" 1
880 1 42 TRP HE3 1 54 GLY H . . 4.770 4.812 4.687 4.885 0.115 7 0 "[ . 1 . 2]" 1
881 1 42 TRP HZ3 1 51 VAL QG . . 4.210 3.490 3.189 4.019 . 0 0 "[ . 1 . 2]" 1
882 1 42 TRP HZ3 1 52 ASP HA . . 4.580 4.449 4.204 4.566 . 0 0 "[ . 1 . 2]" 1
883 1 42 TRP HZ3 1 53 GLN H . . 4.500 4.494 4.351 4.555 0.055 7 0 "[ . 1 . 2]" 1
884 1 43 ILE H 1 43 ILE HB . . 3.160 2.654 2.596 2.778 . 0 0 "[ . 1 . 2]" 1
885 1 43 ILE H 1 43 ILE MD . . 3.590 2.785 2.330 3.046 . 0 0 "[ . 1 . 2]" 1
886 1 43 ILE H 1 43 ILE QG . . 3.580 2.983 2.810 3.195 . 0 0 "[ . 1 . 2]" 1
887 1 43 ILE H 1 43 ILE MG . . 3.810 3.857 3.830 3.912 0.102 18 0 "[ . 1 . 2]" 1
888 1 43 ILE H 1 44 VAL H . . 4.970 4.299 4.203 4.398 . 0 0 "[ . 1 . 2]" 1
889 1 43 ILE H 1 44 VAL QG . . 4.590 3.937 3.705 4.061 . 0 0 "[ . 1 . 2]" 1
890 1 43 ILE H 1 51 VAL HA . . 4.610 4.693 4.619 4.766 0.156 4 0 "[ . 1 . 2]" 1
891 1 43 ILE H 1 51 VAL QG . . 5.350 3.585 3.335 3.772 . 0 0 "[ . 1 . 2]" 1
892 1 43 ILE H 1 52 ASP H . . 3.660 2.851 2.757 2.931 . 0 0 "[ . 1 . 2]" 1
893 1 43 ILE H 1 52 ASP QB . . 4.850 3.469 3.288 3.691 . 0 0 "[ . 1 . 2]" 1
894 1 43 ILE H 1 53 GLN H . . 5.000 4.547 4.475 4.672 . 0 0 "[ . 1 . 2]" 1
895 1 43 ILE H 1 53 GLN HA . . 3.720 3.467 3.401 3.534 . 0 0 "[ . 1 . 2]" 1
896 1 43 ILE H 1 54 GLY H . . 4.910 4.617 4.394 4.806 . 0 0 "[ . 1 . 2]" 1
897 1 43 ILE HA 1 43 ILE MD . . 3.870 3.706 3.483 3.816 . 0 0 "[ . 1 . 2]" 1
898 1 43 ILE HA 1 43 ILE MG . . 3.390 2.369 2.240 2.402 . 0 0 "[ . 1 . 2]" 1
899 1 43 ILE HA 1 44 VAL H . . 3.380 2.142 2.138 2.150 . 0 0 "[ . 1 . 2]" 1
900 1 43 ILE HB 1 43 ILE MD . . 3.380 2.058 2.010 2.212 . 0 0 "[ . 1 . 2]" 1
901 1 43 ILE HB 1 44 VAL H . . 5.500 4.238 4.136 4.324 . 0 0 "[ . 1 . 2]" 1
902 1 43 ILE HB 1 51 VAL HA . . 4.570 4.628 4.580 4.673 0.103 19 0 "[ . 1 . 2]" 1
903 1 43 ILE HB 1 52 ASP H . . 3.520 3.228 3.137 3.358 . 0 0 "[ . 1 . 2]" 1
904 1 43 ILE HB 1 52 ASP HB2 . . 4.630 2.306 2.106 2.471 . 0 0 "[ . 1 . 2]" 1
905 1 43 ILE HB 1 52 ASP QB . . 3.850 2.293 2.097 2.454 . 0 0 "[ . 1 . 2]" 1
906 1 43 ILE HB 1 52 ASP HB3 . . 4.630 4.040 3.838 4.205 . 0 0 "[ . 1 . 2]" 1
907 1 43 ILE MD 1 44 VAL H . . 5.460 5.259 5.121 5.324 . 0 0 "[ . 1 . 2]" 1
908 1 43 ILE MD 1 52 ASP HA . . 4.520 4.583 4.542 4.664 0.144 2 0 "[ . 1 . 2]" 1
909 1 43 ILE MD 1 52 ASP HB2 . . 4.180 2.231 2.083 2.480 . 0 0 "[ . 1 . 2]" 1
910 1 43 ILE MD 1 52 ASP QB . . 3.660 2.203 2.067 2.446 . 0 0 "[ . 1 . 2]" 1
911 1 43 ILE MD 1 52 ASP HB3 . . 4.180 3.455 3.218 3.736 . 0 0 "[ . 1 . 2]" 1
912 1 43 ILE MD 1 54 GLY H . . 3.600 3.609 3.510 3.648 0.048 5 0 "[ . 1 . 2]" 1
913 1 43 ILE MD 1 54 GLY HA2 . . 3.840 3.848 3.817 3.868 0.028 16 0 "[ . 1 . 2]" 1
914 1 43 ILE MD 1 54 GLY QA . . 3.360 2.888 2.773 2.958 . 0 0 "[ . 1 . 2]" 1
915 1 43 ILE MD 1 54 GLY HA3 . . 3.840 2.986 2.845 3.076 . 0 0 "[ . 1 . 2]" 1
916 1 43 ILE MD 1 55 VAL H . . 3.020 3.056 3.027 3.090 0.070 13 0 "[ . 1 . 2]" 1
917 1 43 ILE MD 1 55 VAL HA . . 4.850 2.921 2.748 3.091 . 0 0 "[ . 1 . 2]" 1
918 1 43 ILE MD 1 56 PHE HA . . 4.310 3.077 2.967 3.223 . 0 0 "[ . 1 . 2]" 1
919 1 43 ILE MD 1 56 PHE HB2 . . 4.710 3.654 3.578 3.736 . 0 0 "[ . 1 . 2]" 1
920 1 43 ILE MD 1 56 PHE QB . . 4.060 3.548 3.479 3.624 . 0 0 "[ . 1 . 2]" 1
921 1 43 ILE MD 1 56 PHE HB3 . . 4.710 4.806 4.744 4.902 0.192 2 0 "[ . 1 . 2]" 1
922 1 43 ILE MD 1 56 PHE QD . . 3.730 3.732 3.633 3.757 0.027 13 0 "[ . 1 . 2]" 1
923 1 43 ILE QG 1 44 VAL H . . 4.750 4.246 4.183 4.312 . 0 0 "[ . 1 . 2]" 1
924 1 43 ILE QG 1 56 PHE H . . 4.030 2.311 2.158 2.385 . 0 0 "[ . 1 . 2]" 1
925 1 43 ILE MG 1 44 VAL H . . 3.600 2.826 2.649 3.039 . 0 0 "[ . 1 . 2]" 1
926 1 43 ILE MG 1 45 ASP HA . . 4.680 4.167 4.052 4.262 . 0 0 "[ . 1 . 2]" 1
927 1 43 ILE MG 1 45 ASP HB2 . . 4.380 3.876 3.642 4.053 . 0 0 "[ . 1 . 2]" 1
928 1 43 ILE MG 1 45 ASP QB . . 3.580 3.541 3.465 3.635 0.055 17 0 "[ . 1 . 2]" 1
929 1 43 ILE MG 1 45 ASP HB3 . . 4.380 4.133 3.921 4.405 0.025 20 0 "[ . 1 . 2]" 1
930 1 43 ILE MG 1 50 LYS QE . . 4.290 4.210 3.889 4.316 0.026 13 0 "[ . 1 . 2]" 1
931 1 43 ILE MG 1 51 VAL HA . . 4.720 4.465 4.267 4.531 . 0 0 "[ . 1 . 2]" 1
932 1 43 ILE MG 1 52 ASP QB . . 3.720 3.608 3.394 3.743 0.023 11 0 "[ . 1 . 2]" 1
933 1 43 ILE MG 1 56 PHE H . . 3.560 3.602 3.569 3.649 0.089 6 0 "[ . 1 . 2]" 1
934 1 43 ILE MG 1 56 PHE HA . . 5.000 3.487 3.277 3.617 . 0 0 "[ . 1 . 2]" 1
935 1 43 ILE MG 1 56 PHE QB . . 3.810 1.936 1.886 2.060 . 0 0 "[ . 1 . 2]" 1
936 1 43 ILE MG 1 56 PHE QD . . 3.860 2.715 2.381 2.948 . 0 0 "[ . 1 . 2]" 1
937 1 44 VAL H 1 44 VAL HB . . 3.780 3.384 2.901 3.607 . 0 0 "[ . 1 . 2]" 1
938 1 44 VAL H 1 44 VAL MG1 . . 3.620 3.609 3.418 3.926 0.306 14 0 "[ . 1 . 2]" 1
939 1 44 VAL H 1 44 VAL QG . . 3.130 1.993 1.842 2.364 . 0 0 "[ . 1 . 2]" 1
940 1 44 VAL H 1 44 VAL MG2 . . 3.620 2.003 1.850 2.384 . 0 0 "[ . 1 . 2]" 1
941 1 44 VAL H 1 45 ASP H . . 4.370 4.042 3.973 4.140 . 0 0 "[ . 1 . 2]" 1
942 1 44 VAL H 1 51 VAL HA . . 5.280 4.822 4.632 4.938 . 0 0 "[ . 1 . 2]" 1
943 1 44 VAL HA 1 45 ASP H . . 3.430 2.174 2.165 2.180 . 0 0 "[ . 1 . 2]" 1
944 1 44 VAL HA 1 50 LYS H . . 4.680 4.515 4.308 4.718 0.038 1 0 "[ . 1 . 2]" 1
945 1 44 VAL HA 1 51 VAL HA . . 4.030 2.400 2.202 2.552 . 0 0 "[ . 1 . 2]" 1
946 1 44 VAL HA 1 52 ASP H . . 4.020 3.716 3.563 3.864 . 0 0 "[ . 1 . 2]" 1
947 1 44 VAL HB 1 45 ASP H . . 3.750 3.955 3.831 4.205 0.455 19 0 "[ . 1 . 2]" 1
948 1 44 VAL QG 1 45 ASP H . . 3.770 3.459 3.151 3.600 . 0 0 "[ . 1 . 2]" 1
949 1 44 VAL QG 1 52 ASP H . . 3.640 3.536 3.263 3.773 0.133 16 0 "[ . 1 . 2]" 1
950 1 44 VAL MG1 1 45 ASP H . . 4.330 3.637 3.231 3.828 . 0 0 "[ . 1 . 2]" 1
951 1 44 VAL MG2 1 45 ASP H . . 4.330 4.383 4.371 4.399 0.069 5 0 "[ . 1 . 2]" 1
952 1 45 ASP H 1 45 ASP HB2 . . 3.800 3.141 2.895 3.240 . 0 0 "[ . 1 . 2]" 1
953 1 45 ASP H 1 45 ASP QB . . 3.300 2.144 2.100 2.231 . 0 0 "[ . 1 . 2]" 1
954 1 45 ASP H 1 45 ASP HB3 . . 3.800 2.188 2.129 2.319 . 0 0 "[ . 1 . 2]" 1
955 1 45 ASP H 1 46 LEU H . . 5.310 4.602 4.592 4.612 . 0 0 "[ . 1 . 2]" 1
956 1 45 ASP H 1 50 LYS H . . 3.780 3.223 3.119 3.328 . 0 0 "[ . 1 . 2]" 1
957 1 45 ASP H 1 51 VAL HA . . 3.810 3.520 3.273 3.730 . 0 0 "[ . 1 . 2]" 1
958 1 45 ASP HA 1 46 LEU H . . 3.520 2.294 2.239 2.330 . 0 0 "[ . 1 . 2]" 1
959 1 45 ASP HA 1 47 LYS H . . 3.830 3.828 3.741 3.871 0.041 10 0 "[ . 1 . 2]" 1
960 1 45 ASP QB 1 46 LEU H . . 3.480 3.333 3.232 3.534 0.054 7 0 "[ . 1 . 2]" 1
961 1 45 ASP QB 1 49 LEU H . . 4.860 4.207 3.848 4.390 . 0 0 "[ . 1 . 2]" 1
962 1 45 ASP QB 1 50 LYS H . . 3.670 3.146 2.821 3.372 . 0 0 "[ . 1 . 2]" 1
963 1 45 ASP QB 1 50 LYS QB . . 4.020 4.094 4.040 4.157 0.137 10 0 "[ . 1 . 2]" 1
964 1 45 ASP QB 1 50 LYS QG . . 4.340 2.030 1.946 2.172 . 0 0 "[ . 1 . 2]" 1
965 1 46 LEU H 1 46 LEU MD1 . . 3.610 3.732 3.675 3.800 0.190 11 0 "[ . 1 . 2]" 1
966 1 46 LEU H 1 46 LEU QD . . 3.030 2.117 1.903 2.262 . 0 0 "[ . 1 . 2]" 1
967 1 46 LEU H 1 46 LEU MD2 . . 3.610 2.129 1.908 2.281 . 0 0 "[ . 1 . 2]" 1
968 1 46 LEU H 1 46 LEU HG . . 3.760 2.109 2.014 2.263 . 0 0 "[ . 1 . 2]" 1
969 1 46 LEU H 1 47 LYS H . . 3.700 1.988 1.929 2.124 . 0 0 "[ . 1 . 2]" 1
970 1 46 LEU H 1 47 LYS QE . . 5.340 4.851 3.405 5.343 0.003 16 0 "[ . 1 . 2]" 1
971 1 46 LEU H 1 47 LYS HG2 . . 5.500 4.182 3.414 5.340 . 0 0 "[ . 1 . 2]" 1
972 1 46 LEU H 1 47 LYS HG3 . . 5.500 3.449 2.980 3.982 . 0 0 "[ . 1 . 2]" 1
973 1 46 LEU H 1 49 LEU HA . . 5.180 5.039 5.003 5.091 . 0 0 "[ . 1 . 2]" 1
974 1 46 LEU HA 1 46 LEU MD1 . . 4.070 4.122 4.071 4.141 0.071 14 0 "[ . 1 . 2]" 1
975 1 46 LEU HA 1 46 LEU QD . . 3.520 3.242 3.129 3.390 . 0 0 "[ . 1 . 2]" 1
976 1 46 LEU HA 1 46 LEU MD2 . . 4.070 3.395 3.238 3.628 . 0 0 "[ . 1 . 2]" 1
977 1 46 LEU HA 1 47 LYS H . . 3.330 3.374 3.357 3.406 0.076 9 0 "[ . 1 . 2]" 1
978 1 46 LEU HA 1 49 LEU H . . 3.520 3.168 3.110 3.215 . 0 0 "[ . 1 . 2]" 1
979 1 46 LEU HA 1 49 LEU HA . . 4.540 2.958 2.891 3.026 . 0 0 "[ . 1 . 2]" 1
980 1 46 LEU QB 1 46 LEU QD . . 2.860 1.818 1.793 1.837 . 0 0 "[ . 1 . 2]" 1
981 1 46 LEU QB 1 47 LYS H . . 3.530 3.647 3.589 3.701 0.171 7 0 "[ . 1 . 2]" 1
982 1 46 LEU QD 1 47 LYS H . . 3.820 3.471 3.308 3.563 . 0 0 "[ . 1 . 2]" 1
983 1 46 LEU MD1 1 47 LYS H . . 4.430 4.191 3.944 4.305 . 0 0 "[ . 1 . 2]" 1
984 1 46 LEU MD2 1 47 LYS H . . 4.430 3.708 3.464 3.830 . 0 0 "[ . 1 . 2]" 1
985 1 46 LEU HG 1 47 LYS H . . 4.440 2.784 2.640 2.925 . 0 0 "[ . 1 . 2]" 1
986 1 47 LYS H 1 47 LYS HB2 . . 3.660 2.611 2.332 2.713 . 0 0 "[ . 1 . 2]" 1
987 1 47 LYS H 1 47 LYS HB3 . . 3.660 3.587 3.563 3.595 . 0 0 "[ . 1 . 2]" 1
988 1 47 LYS H 1 47 LYS QD . . 5.090 3.859 2.838 4.318 . 0 0 "[ . 1 . 2]" 1
989 1 47 LYS H 1 47 LYS QE . . 4.950 4.148 3.192 4.572 . 0 0 "[ . 1 . 2]" 1
990 1 47 LYS H 1 47 LYS HG2 . . 3.940 2.894 2.275 3.734 . 0 0 "[ . 1 . 2]" 1
991 1 47 LYS H 1 47 LYS QG . . 3.460 2.139 1.924 2.535 . 0 0 "[ . 1 . 2]" 1
992 1 47 LYS H 1 47 LYS HG3 . . 3.940 2.343 1.943 2.795 . 0 0 "[ . 1 . 2]" 1
993 1 47 LYS H 1 48 GLN H . . 3.390 2.690 2.626 2.728 . 0 0 "[ . 1 . 2]" 1
994 1 47 LYS H 1 49 LEU H . . 3.830 3.419 3.379 3.460 . 0 0 "[ . 1 . 2]" 1
995 1 47 LYS H 1 49 LEU HA . . 5.260 4.975 4.933 5.029 . 0 0 "[ . 1 . 2]" 1
996 1 47 LYS HA 1 47 LYS QD . . 4.840 3.716 3.183 4.146 . 0 0 "[ . 1 . 2]" 1
997 1 47 LYS HA 1 47 LYS HG2 . . 4.100 2.662 2.305 3.114 . 0 0 "[ . 1 . 2]" 1
998 1 47 LYS HA 1 47 LYS QG . . 3.550 2.528 2.254 2.595 . 0 0 "[ . 1 . 2]" 1
999 1 47 LYS HA 1 47 LYS HG3 . . 4.100 3.368 2.719 3.755 . 0 0 "[ . 1 . 2]" 1
1000 1 47 LYS QB 1 47 LYS QE . . 4.380 2.981 2.494 3.505 . 0 0 "[ . 1 . 2]" 1
1001 1 47 LYS QB 1 48 GLN H . . 3.080 2.355 2.322 2.464 . 0 0 "[ . 1 . 2]" 1
1002 1 47 LYS QB 1 49 LEU H . . 4.560 4.143 4.114 4.155 . 0 0 "[ . 1 . 2]" 1
1003 1 47 LYS HB2 1 48 GLN H . . 3.550 2.389 2.349 2.536 . 0 0 "[ . 1 . 2]" 1
1004 1 47 LYS HB3 1 48 GLN H . . 3.550 3.590 3.319 3.667 0.117 11 0 "[ . 1 . 2]" 1
1005 1 47 LYS QG 1 48 GLN H . . 4.110 3.818 3.649 4.158 0.048 12 0 "[ . 1 . 2]" 1
1006 1 47 LYS HG2 1 48 GLN H . . 4.850 4.633 4.303 4.978 0.128 12 0 "[ . 1 . 2]" 1
1007 1 47 LYS HG3 1 48 GLN H . . 4.850 4.077 3.847 4.481 . 0 0 "[ . 1 . 2]" 1
1008 1 48 GLN H 1 48 GLN HB2 . . 3.570 2.562 2.548 2.574 . 0 0 "[ . 1 . 2]" 1
1009 1 48 GLN H 1 48 GLN QB . . 3.110 2.519 2.506 2.530 . 0 0 "[ . 1 . 2]" 1
1010 1 48 GLN H 1 48 GLN HB3 . . 3.570 3.719 3.711 3.726 0.156 1 0 "[ . 1 . 2]" 1
1011 1 48 GLN H 1 48 GLN QE . . 4.270 3.982 3.943 4.037 . 0 0 "[ . 1 . 2]" 1
1012 1 48 GLN H 1 48 GLN HG2 . . 4.250 3.798 3.770 3.812 . 0 0 "[ . 1 . 2]" 1
1013 1 48 GLN H 1 48 GLN HG3 . . 3.570 2.789 2.751 2.816 . 0 0 "[ . 1 . 2]" 1
1014 1 48 GLN H 1 49 LEU H . . 3.170 2.099 2.062 2.145 . 0 0 "[ . 1 . 2]" 1
1015 1 48 GLN H 1 50 LYS H . . 4.420 4.294 3.972 4.464 0.044 11 0 "[ . 1 . 2]" 1
1016 1 48 GLN H 1 50 LYS HG2 . . 5.040 4.229 3.612 4.698 . 0 0 "[ . 1 . 2]" 1
1017 1 48 GLN H 1 50 LYS QG . . 4.350 3.840 3.543 4.158 . 0 0 "[ . 1 . 2]" 1
1018 1 48 GLN H 1 50 LYS HG3 . . 5.040 4.710 4.136 5.159 0.119 2 0 "[ . 1 . 2]" 1
1019 1 48 GLN HA 1 48 GLN QE . . 4.830 4.646 4.479 4.803 . 0 0 "[ . 1 . 2]" 1
1020 1 48 GLN HA 1 48 GLN HG2 . . 3.240 2.513 2.498 2.527 . 0 0 "[ . 1 . 2]" 1
1021 1 48 GLN HA 1 48 GLN HG3 . . 3.790 3.169 3.162 3.175 . 0 0 "[ . 1 . 2]" 1
1022 1 48 GLN HA 1 49 LEU QD . . 4.280 3.109 2.610 3.539 . 0 0 "[ . 1 . 2]" 1
1023 1 48 GLN QB 1 48 GLN QE . . 3.500 2.264 1.918 2.667 . 0 0 "[ . 1 . 2]" 1
1024 1 48 GLN QB 1 49 LEU H . . 3.430 3.368 3.317 3.421 . 0 0 "[ . 1 . 2]" 1
1025 1 48 GLN QB 1 50 LYS QG . . 3.800 2.870 2.522 3.181 . 0 0 "[ . 1 . 2]" 1
1026 1 48 GLN HB2 1 49 LEU H . . 4.200 3.525 3.464 3.588 . 0 0 "[ . 1 . 2]" 1
1027 1 48 GLN HB3 1 49 LEU H . . 4.200 4.276 4.238 4.314 0.114 13 0 "[ . 1 . 2]" 1
1028 1 48 GLN QE 1 48 GLN HG2 . . 3.350 3.334 3.290 3.350 . 0 0 "[ . 1 . 2]" 1
1029 1 48 GLN QE 1 48 GLN HG3 . . 3.300 2.449 2.231 2.675 . 0 0 "[ . 1 . 2]" 1
1030 1 48 GLN QE 1 50 LYS QE . . 4.300 4.095 3.823 4.308 0.008 3 0 "[ . 1 . 2]" 1
1031 1 48 GLN HG2 1 49 LEU H . . 5.110 5.140 5.131 5.149 0.039 19 0 "[ . 1 . 2]" 1
1032 1 48 GLN HG3 1 49 LEU H . . 4.570 4.624 4.611 4.637 0.067 13 0 "[ . 1 . 2]" 1
1033 1 49 LEU H 1 49 LEU HB2 . . 4.080 3.409 3.266 3.586 . 0 0 "[ . 1 . 2]" 1
1034 1 49 LEU H 1 49 LEU QB . . 3.520 3.243 3.141 3.354 . 0 0 "[ . 1 . 2]" 1
1035 1 49 LEU H 1 49 LEU HB3 . . 4.080 4.071 4.034 4.084 0.004 14 0 "[ . 1 . 2]" 1
1036 1 49 LEU H 1 49 LEU MD1 . . 3.660 3.164 2.371 3.665 0.005 14 0 "[ . 1 . 2]" 1
1037 1 49 LEU H 1 49 LEU QD . . 3.200 2.226 2.154 2.455 . 0 0 "[ . 1 . 2]" 1
1038 1 49 LEU H 1 49 LEU MD2 . . 3.660 2.294 2.192 2.500 . 0 0 "[ . 1 . 2]" 1
1039 1 49 LEU H 1 49 LEU HG . . 5.220 4.577 4.481 4.706 . 0 0 "[ . 1 . 2]" 1
1040 1 49 LEU H 1 50 LYS H . . 3.380 3.122 2.918 3.232 . 0 0 "[ . 1 . 2]" 1
1041 1 49 LEU HA 1 49 LEU MD1 . . 3.480 1.984 1.924 2.139 . 0 0 "[ . 1 . 2]" 1
1042 1 49 LEU HA 1 49 LEU MD2 . . 3.480 2.848 2.526 3.289 . 0 0 "[ . 1 . 2]" 1
1043 1 49 LEU QB 1 50 LYS H . . 3.840 3.852 3.807 3.896 0.056 7 0 "[ . 1 . 2]" 1
1044 1 49 LEU HB2 1 50 LYS H . . 4.370 4.506 4.409 4.587 0.217 5 0 "[ . 1 . 2]" 1
1045 1 49 LEU HB3 1 50 LYS H . . 4.370 4.186 4.103 4.326 . 0 0 "[ . 1 . 2]" 1
1046 1 49 LEU QD 1 50 LYS H . . 3.780 3.710 3.570 3.840 0.060 9 0 "[ . 1 . 2]" 1
1047 1 49 LEU MD1 1 50 LYS H . . 4.570 3.931 3.752 4.114 . 0 0 "[ . 1 . 2]" 1
1048 1 49 LEU MD2 1 50 LYS H . . 4.570 4.563 4.365 4.718 0.148 10 0 "[ . 1 . 2]" 1
1049 1 50 LYS H 1 50 LYS HB2 . . 3.880 3.840 3.691 3.924 0.044 11 0 "[ . 1 . 2]" 1
1050 1 50 LYS H 1 50 LYS QB . . 3.110 3.133 3.011 3.230 0.120 2 0 "[ . 1 . 2]" 1
1051 1 50 LYS H 1 50 LYS HB3 . . 3.880 3.325 3.155 3.481 . 0 0 "[ . 1 . 2]" 1
1052 1 50 LYS H 1 50 LYS HD2 . . 5.310 4.328 3.941 4.789 . 0 0 "[ . 1 . 2]" 1
1053 1 50 LYS H 1 50 LYS QD . . 4.450 3.878 3.643 4.146 . 0 0 "[ . 1 . 2]" 1
1054 1 50 LYS H 1 50 LYS HD3 . . 5.310 4.403 4.258 4.565 . 0 0 "[ . 1 . 2]" 1
1055 1 50 LYS H 1 50 LYS QE . . 5.340 5.047 4.603 5.351 0.011 11 0 "[ . 1 . 2]" 1
1056 1 50 LYS H 1 50 LYS HG2 . . 4.290 3.057 1.995 3.730 . 0 0 "[ . 1 . 2]" 1
1057 1 50 LYS H 1 50 LYS QG . . 3.490 2.173 1.958 2.323 . 0 0 "[ . 1 . 2]" 1
1058 1 50 LYS H 1 50 LYS HG3 . . 4.290 2.512 2.097 3.064 . 0 0 "[ . 1 . 2]" 1
1059 1 50 LYS HA 1 50 LYS HD2 . . 5.500 4.703 4.486 4.894 . 0 0 "[ . 1 . 2]" 1
1060 1 50 LYS HA 1 50 LYS HD3 . . 5.500 4.499 3.898 5.373 . 0 0 "[ . 1 . 2]" 1
1061 1 50 LYS HA 1 51 VAL H . . 2.700 2.582 2.521 2.625 . 0 0 "[ . 1 . 2]" 1
1062 1 50 LYS HA 1 51 VAL QG . . 4.930 3.335 2.923 3.525 . 0 0 "[ . 1 . 2]" 1
1063 1 50 LYS QB 1 50 LYS QE . . 3.470 2.721 2.430 2.880 . 0 0 "[ . 1 . 2]" 1
1064 1 50 LYS HB2 1 50 LYS HE2 . . 5.080 3.911 3.634 4.087 . 0 0 "[ . 1 . 2]" 1
1065 1 50 LYS HB2 1 50 LYS HE3 . . 5.080 2.899 2.528 3.087 . 0 0 "[ . 1 . 2]" 1
1066 1 50 LYS HB2 1 51 VAL H . . 3.480 2.082 2.009 2.201 . 0 0 "[ . 1 . 2]" 1
1067 1 50 LYS HB3 1 50 LYS HE2 . . 5.080 4.767 4.369 5.067 . 0 0 "[ . 1 . 2]" 1
1068 1 50 LYS HB3 1 50 LYS HE3 . . 5.080 3.703 3.487 4.038 . 0 0 "[ . 1 . 2]" 1
1069 1 50 LYS HB3 1 51 VAL H . . 3.480 3.532 3.406 3.677 0.197 11 0 "[ . 1 . 2]" 1
1070 1 50 LYS QE 1 51 VAL H . . 4.080 4.069 3.854 4.119 0.039 1 0 "[ . 1 . 2]" 1
1071 1 50 LYS QG 1 51 VAL H . . 3.720 3.638 3.435 3.766 0.046 14 0 "[ . 1 . 2]" 1
1072 1 50 LYS HG2 1 51 VAL H . . 4.330 4.495 4.422 4.626 0.296 2 0 "[ . 1 . 2]" 1
1073 1 50 LYS HG3 1 51 VAL H . . 4.330 3.854 3.558 4.065 . 0 0 "[ . 1 . 2]" 1
1074 1 51 VAL H 1 51 VAL HB . . 3.510 3.267 2.869 3.491 . 0 0 "[ . 1 . 2]" 1
1075 1 51 VAL H 1 51 VAL MG1 . . 3.830 2.859 2.109 4.008 0.178 16 0 "[ . 1 . 2]" 1
1076 1 51 VAL H 1 51 VAL QG . . 3.290 2.390 2.100 2.981 . 0 0 "[ . 1 . 2]" 1
1077 1 51 VAL H 1 51 VAL MG2 . . 3.830 3.487 2.587 3.909 0.079 1 0 "[ . 1 . 2]" 1
1078 1 51 VAL H 1 52 ASP H . . 4.570 4.326 4.298 4.364 . 0 0 "[ . 1 . 2]" 1
1079 1 51 VAL HA 1 51 VAL MG1 . . 3.300 2.802 2.172 3.180 . 0 0 "[ . 1 . 2]" 1
1080 1 51 VAL HA 1 51 VAL MG2 . . 3.300 2.421 2.292 2.620 . 0 0 "[ . 1 . 2]" 1
1081 1 51 VAL HA 1 52 ASP H . . 3.110 2.228 2.205 2.260 . 0 0 "[ . 1 . 2]" 1
1082 1 51 VAL HB 1 52 ASP H . . 3.940 3.870 3.553 3.946 0.006 8 0 "[ . 1 . 2]" 1
1083 1 51 VAL QG 1 52 ASP H . . 3.210 2.098 1.913 2.288 . 0 0 "[ . 1 . 2]" 1
1084 1 51 VAL QG 1 52 ASP HA . . 4.270 3.312 3.107 3.834 . 0 0 "[ . 1 . 2]" 1
1085 1 51 VAL MG1 1 52 ASP H . . 4.630 3.160 1.917 4.008 . 0 0 "[ . 1 . 2]" 1
1086 1 51 VAL MG1 1 52 ASP HA . . 4.970 3.918 3.376 4.166 . 0 0 "[ . 1 . 2]" 1
1087 1 51 VAL MG2 1 52 ASP H . . 4.630 2.922 2.039 4.150 . 0 0 "[ . 1 . 2]" 1
1088 1 51 VAL MG2 1 52 ASP HA . . 4.970 4.129 3.207 5.437 0.467 17 0 "[ . 1 . 2]" 1
1089 1 52 ASP H 1 52 ASP HB2 . . 3.900 3.092 2.938 3.282 . 0 0 "[ . 1 . 2]" 1
1090 1 52 ASP H 1 52 ASP QB . . 3.160 2.987 2.859 3.137 . 0 0 "[ . 1 . 2]" 1
1091 1 52 ASP H 1 52 ASP HB3 . . 3.900 3.954 3.920 3.984 0.084 15 0 "[ . 1 . 2]" 1
1092 1 52 ASP H 1 53 GLN HA . . 5.060 4.760 4.706 4.815 . 0 0 "[ . 1 . 2]" 1
1093 1 52 ASP HA 1 53 GLN H . . 3.010 2.451 2.431 2.462 . 0 0 "[ . 1 . 2]" 1
1094 1 52 ASP HA 1 53 GLN QB . . 5.020 4.089 4.019 4.175 . 0 0 "[ . 1 . 2]" 1
1095 1 52 ASP HB2 1 53 GLN H . . 3.300 3.181 3.004 3.352 0.052 9 0 "[ . 1 . 2]" 1
1096 1 52 ASP HB3 1 53 GLN H . . 3.300 2.516 2.386 2.671 . 0 0 "[ . 1 . 2]" 1
1097 1 53 GLN H 1 53 GLN HB2 . . 3.900 3.112 2.277 3.677 . 0 0 "[ . 1 . 2]" 1
1098 1 53 GLN H 1 53 GLN QB . . 3.270 2.378 2.218 2.545 . 0 0 "[ . 1 . 2]" 1
1099 1 53 GLN H 1 53 GLN HB3 . . 3.900 2.731 2.406 3.078 . 0 0 "[ . 1 . 2]" 1
1100 1 53 GLN H 1 53 GLN HG2 . . 4.260 3.821 3.411 4.311 0.051 20 0 "[ . 1 . 2]" 1
1101 1 53 GLN H 1 53 GLN HG3 . . 4.260 3.830 2.760 4.327 0.067 20 0 "[ . 1 . 2]" 1
1102 1 53 GLN H 1 54 GLY H . . 4.680 4.575 4.566 4.585 . 0 0 "[ . 1 . 2]" 1
1103 1 53 GLN HA 1 53 GLN HE21 . . 4.870 3.687 3.300 4.040 . 0 0 "[ . 1 . 2]" 1
1104 1 53 GLN HA 1 53 GLN QE . . 4.260 3.584 3.250 3.864 . 0 0 "[ . 1 . 2]" 1
1105 1 53 GLN HA 1 53 GLN HE22 . . 4.870 4.958 4.880 5.058 0.188 13 0 "[ . 1 . 2]" 1
1106 1 53 GLN HA 1 53 GLN HG2 . . 4.190 3.109 2.046 4.228 0.038 7 0 "[ . 1 . 2]" 1
1107 1 53 GLN HA 1 53 GLN HG3 . . 4.190 3.685 3.173 4.220 0.030 18 0 "[ . 1 . 2]" 1
1108 1 53 GLN HA 1 54 GLY H . . 2.900 2.359 2.277 2.398 . 0 0 "[ . 1 . 2]" 1
1109 1 53 GLN QB 1 54 GLY H . . 3.470 2.812 2.548 3.217 . 0 0 "[ . 1 . 2]" 1
1110 1 53 GLN HB2 1 54 GLY H . . 4.300 3.251 2.581 4.217 . 0 0 "[ . 1 . 2]" 1
1111 1 53 GLN HB3 1 54 GLY H . . 4.300 3.677 3.137 4.032 . 0 0 "[ . 1 . 2]" 1
1112 1 53 GLN QE 1 54 GLY QA . . 4.530 3.182 2.578 3.601 . 0 0 "[ . 1 . 2]" 1
1113 1 53 GLN QG 1 54 GLY H . . 3.590 3.006 2.593 3.548 . 0 0 "[ . 1 . 2]" 1
1114 1 53 GLN HG2 1 54 GLY H . . 4.140 3.225 2.618 4.414 0.274 7 0 "[ . 1 . 2]" 1
1115 1 53 GLN HG3 1 54 GLY H . . 4.140 4.130 3.713 4.271 0.131 9 0 "[ . 1 . 2]" 1
1116 1 54 GLY H 1 55 VAL H . . 5.500 4.600 4.566 4.612 . 0 0 "[ . 1 . 2]" 1
1117 1 54 GLY HA2 1 55 VAL H . . 3.020 2.844 2.704 2.894 . 0 0 "[ . 1 . 2]" 1
1118 1 54 GLY HA3 1 55 VAL H . . 3.020 2.318 2.281 2.431 . 0 0 "[ . 1 . 2]" 1
1119 1 55 VAL H 1 55 VAL HB . . 3.070 3.093 3.021 3.122 0.052 16 0 "[ . 1 . 2]" 1
1120 1 55 VAL H 1 56 PHE H . . 5.240 4.467 4.422 4.498 . 0 0 "[ . 1 . 2]" 1
1121 1 55 VAL HA 1 56 PHE H . . 2.830 2.241 2.182 2.255 . 0 0 "[ . 1 . 2]" 1
1122 1 55 VAL HB 1 56 PHE H . . 4.080 3.986 3.954 4.101 0.021 6 0 "[ . 1 . 2]" 1
1123 1 55 VAL QG 1 56 PHE H . . 3.130 2.190 2.148 2.400 . 0 0 "[ . 1 . 2]" 1
1124 1 55 VAL QG 1 57 ALA H . . 5.090 4.472 4.384 4.563 . 0 0 "[ . 1 . 2]" 1
1125 1 55 VAL QG 1 57 ALA HA . . 4.140 4.097 4.024 4.161 0.021 11 0 "[ . 1 . 2]" 1
1126 1 55 VAL QG 1 58 SER H . . 4.490 4.609 4.549 4.682 0.192 2 0 "[ . 1 . 2]" 1
1127 1 56 PHE H 1 56 PHE HB2 . . 3.590 2.513 2.410 2.572 . 0 0 "[ . 1 . 2]" 1
1128 1 56 PHE H 1 56 PHE QB . . 3.060 2.281 2.241 2.294 . 0 0 "[ . 1 . 2]" 1
1129 1 56 PHE H 1 56 PHE HB3 . . 3.590 2.616 2.572 2.675 . 0 0 "[ . 1 . 2]" 1
1130 1 56 PHE H 1 56 PHE QD . . 4.270 4.176 4.128 4.195 . 0 0 "[ . 1 . 2]" 1
1131 1 56 PHE H 1 59 PRO QB . . 4.360 4.066 3.955 4.242 . 0 0 "[ . 1 . 2]" 1
1132 1 56 PHE HA 1 57 ALA H . . 2.970 2.362 2.285 2.402 . 0 0 "[ . 1 . 2]" 1
1133 1 56 PHE HA 1 57 ALA MB . . 4.680 4.128 4.044 4.173 . 0 0 "[ . 1 . 2]" 1
1134 1 56 PHE HA 1 58 SER H . . 4.970 4.165 4.023 4.243 . 0 0 "[ . 1 . 2]" 1
1135 1 56 PHE QB 1 57 ALA H . . 4.450 3.304 3.231 3.433 . 0 0 "[ . 1 . 2]" 1
1136 1 56 PHE HB2 1 57 ALA H . . 5.270 3.931 3.890 4.041 . 0 0 "[ . 1 . 2]" 1
1137 1 56 PHE HB3 1 57 ALA H . . 5.270 3.553 3.453 3.714 . 0 0 "[ . 1 . 2]" 1
1138 1 56 PHE QD 1 57 ALA H . . 4.650 2.737 2.607 2.867 . 0 0 "[ . 1 . 2]" 1
1139 1 56 PHE QD 1 58 SER H . . 4.160 2.339 2.262 2.471 . 0 0 "[ . 1 . 2]" 1
1140 1 56 PHE QD 1 59 PRO HA . . 3.860 2.422 2.184 2.585 . 0 0 "[ . 1 . 2]" 1
1141 1 56 PHE QD 1 59 PRO QB . . 4.400 3.255 2.979 3.423 . 0 0 "[ . 1 . 2]" 1
1142 1 56 PHE QD 1 59 PRO HD2 . . 5.060 4.304 4.088 4.409 . 0 0 "[ . 1 . 2]" 1
1143 1 56 PHE QD 1 59 PRO HD3 . . 5.060 3.155 2.956 3.295 . 0 0 "[ . 1 . 2]" 1
1144 1 56 PHE QD 1 60 ASP H . . 4.710 4.485 4.218 4.707 . 0 0 "[ . 1 . 2]" 1
1145 1 56 PHE QE 1 58 SER H . . 4.100 3.551 3.503 3.590 . 0 0 "[ . 1 . 2]" 1
1146 1 56 PHE QE 1 59 PRO HA . . 4.120 3.952 3.543 4.126 0.006 16 0 "[ . 1 . 2]" 1
1147 1 57 ALA H 1 57 ALA MB . . 2.870 2.152 2.026 2.235 . 0 0 "[ . 1 . 2]" 1
1148 1 57 ALA H 1 58 SER H . . 4.220 2.735 2.658 2.800 . 0 0 "[ . 1 . 2]" 1
1149 1 57 ALA MB 1 58 SER H . . 3.310 2.783 2.687 2.911 . 0 0 "[ . 1 . 2]" 1
1150 1 58 SER H 1 58 SER QB . . 3.160 2.966 2.953 2.988 . 0 0 "[ . 1 . 2]" 1
1151 1 58 SER H 1 59 PRO HA . . 4.520 4.180 4.162 4.192 . 0 0 "[ . 1 . 2]" 1
1152 1 58 SER H 1 59 PRO QD . . 4.010 2.770 2.688 2.824 . 0 0 "[ . 1 . 2]" 1
1153 1 58 SER HA 1 59 PRO HD2 . . 3.340 1.978 1.966 1.998 . 0 0 "[ . 1 . 2]" 1
1154 1 58 SER HA 1 59 PRO QD . . 2.920 1.935 1.923 1.956 . 0 0 "[ . 1 . 2]" 1
1155 1 58 SER HA 1 59 PRO HD3 . . 3.340 2.744 2.719 2.785 . 0 0 "[ . 1 . 2]" 1
1156 1 59 PRO HA 1 60 ASP H . . 3.060 2.223 2.180 2.324 . 0 0 "[ . 1 . 2]" 1
1157 1 59 PRO HA 1 61 VAL H . . 3.950 3.786 3.672 3.962 0.012 10 0 "[ . 1 . 2]" 1
1158 1 59 PRO QB 1 60 ASP H . . 3.250 2.998 2.717 3.148 . 0 0 "[ . 1 . 2]" 1
1159 1 59 PRO QB 1 61 VAL H . . 3.050 2.367 2.323 2.472 . 0 0 "[ . 1 . 2]" 1
1160 1 59 PRO QG 1 61 VAL H . . 3.770 3.836 3.788 3.930 0.160 20 0 "[ . 1 . 2]" 1
1161 1 60 ASP H 1 60 ASP HB2 . . 3.740 2.181 2.067 2.321 . 0 0 "[ . 1 . 2]" 1
1162 1 60 ASP H 1 60 ASP QB . . 3.220 2.128 2.047 2.207 . 0 0 "[ . 1 . 2]" 1
1163 1 60 ASP H 1 60 ASP HB3 . . 3.740 3.028 2.763 3.305 . 0 0 "[ . 1 . 2]" 1
1164 1 60 ASP H 1 61 VAL H . . 3.120 2.540 2.348 2.644 . 0 0 "[ . 1 . 2]" 1
1165 1 60 ASP H 1 61 VAL QG . . 4.520 4.339 4.175 4.489 . 0 0 "[ . 1 . 2]" 1
1166 1 60 ASP QB 1 61 VAL H . . 3.510 3.063 2.901 3.171 . 0 0 "[ . 1 . 2]" 1
1167 1 60 ASP QB 1 97 LEU QD . . 3.520 2.461 1.912 3.513 . 0 0 "[ . 1 . 2]" 1
1168 1 60 ASP HB2 1 97 LEU MD1 . . 5.130 3.750 3.091 5.064 . 0 0 "[ . 1 . 2]" 1
1169 1 60 ASP HB2 1 97 LEU MD2 . . 5.130 4.865 3.135 5.137 0.007 8 0 "[ . 1 . 2]" 1
1170 1 60 ASP HB3 1 97 LEU MD1 . . 5.130 2.705 1.937 4.285 . 0 0 "[ . 1 . 2]" 1
1171 1 60 ASP HB3 1 97 LEU MD2 . . 5.130 3.950 2.240 4.563 . 0 0 "[ . 1 . 2]" 1
1172 1 61 VAL H 1 61 VAL HB . . 3.890 2.889 2.869 2.915 . 0 0 "[ . 1 . 2]" 1
1173 1 61 VAL H 1 61 VAL MG1 . . 4.050 3.918 3.893 3.941 . 0 0 "[ . 1 . 2]" 1
1174 1 61 VAL H 1 61 VAL MG2 . . 4.050 3.154 3.092 3.225 . 0 0 "[ . 1 . 2]" 1
1175 1 61 VAL H 1 62 THR H . . 4.420 4.336 4.299 4.366 . 0 0 "[ . 1 . 2]" 1
1176 1 61 VAL HA 1 61 VAL MG1 . . 3.530 2.406 2.362 2.446 . 0 0 "[ . 1 . 2]" 1
1177 1 61 VAL HA 1 61 VAL MG2 . . 3.530 2.271 2.222 2.312 . 0 0 "[ . 1 . 2]" 1
1178 1 61 VAL HA 1 62 THR H . . 3.290 2.253 2.220 2.278 . 0 0 "[ . 1 . 2]" 1
1179 1 61 VAL HA 1 93 GLY QA . . 4.260 2.947 2.744 3.387 . 0 0 "[ . 1 . 2]" 1
1180 1 61 VAL HA 1 94 ASP H . . 4.160 2.973 2.471 3.612 . 0 0 "[ . 1 . 2]" 1
1181 1 61 VAL HB 1 62 THR H . . 4.600 3.914 3.825 4.030 . 0 0 "[ . 1 . 2]" 1
1182 1 61 VAL QG 1 62 THR H . . 3.150 2.138 2.029 2.235 . 0 0 "[ . 1 . 2]" 1
1183 1 61 VAL QG 1 93 GLY QA . . 3.720 3.242 3.024 3.440 . 0 0 "[ . 1 . 2]" 1
1184 1 61 VAL QG 1 94 ASP H . . 3.030 2.172 2.020 2.406 . 0 0 "[ . 1 . 2]" 1
1185 1 61 VAL QG 1 94 ASP HA . . 4.330 3.873 3.666 4.274 . 0 0 "[ . 1 . 2]" 1
1186 1 61 VAL QG 1 94 ASP HB2 . . 3.680 2.421 2.025 2.943 . 0 0 "[ . 1 . 2]" 1
1187 1 61 VAL QG 1 94 ASP HB3 . . 3.610 2.503 1.949 3.084 . 0 0 "[ . 1 . 2]" 1
1188 1 61 VAL QG 1 98 ALA HA . . 3.300 3.271 3.116 3.371 0.071 12 0 "[ . 1 . 2]" 1
1189 1 61 VAL QG 1 98 ALA MB . . 3.510 1.937 1.851 2.056 . 0 0 "[ . 1 . 2]" 1
1190 1 61 VAL MG1 1 62 THR H . . 3.690 2.150 2.037 2.252 . 0 0 "[ . 1 . 2]" 1
1191 1 61 VAL MG1 1 93 GLY HA2 . . 5.240 5.301 5.264 5.337 0.097 17 0 "[ . 1 . 2]" 1
1192 1 61 VAL MG1 1 93 GLY HA3 . . 5.240 3.905 3.849 4.011 . 0 0 "[ . 1 . 2]" 1
1193 1 61 VAL MG1 1 94 ASP H . . 4.190 2.761 2.429 3.033 . 0 0 "[ . 1 . 2]" 1
1194 1 61 VAL MG1 1 94 ASP HA . . 5.390 4.940 4.576 5.256 . 0 0 "[ . 1 . 2]" 1
1195 1 61 VAL MG1 1 98 ALA HA . . 4.120 3.430 3.233 3.588 . 0 0 "[ . 1 . 2]" 1
1196 1 61 VAL MG2 1 62 THR H . . 3.690 3.800 3.761 3.830 0.140 19 0 "[ . 1 . 2]" 1
1197 1 61 VAL MG2 1 93 GLY HA2 . . 5.240 4.958 4.674 5.216 . 0 0 "[ . 1 . 2]" 1
1198 1 61 VAL MG2 1 93 GLY HA3 . . 5.240 3.607 3.209 3.934 . 0 0 "[ . 1 . 2]" 1
1199 1 61 VAL MG2 1 94 ASP H . . 4.190 2.305 2.059 2.731 . 0 0 "[ . 1 . 2]" 1
1200 1 61 VAL MG2 1 94 ASP HA . . 5.390 4.051 3.797 4.550 . 0 0 "[ . 1 . 2]" 1
1201 1 61 VAL MG2 1 98 ALA HA . . 4.120 4.137 3.927 4.249 0.129 20 0 "[ . 1 . 2]" 1
1202 1 62 THR H 1 62 THR HB . . 3.350 3.220 2.688 3.345 . 0 0 "[ . 1 . 2]" 1
1203 1 62 THR H 1 62 THR MG . . 3.970 3.786 3.651 3.905 . 0 0 "[ . 1 . 2]" 1
1204 1 62 THR H 1 63 VAL H . . 5.500 4.150 4.032 4.291 . 0 0 "[ . 1 . 2]" 1
1205 1 62 THR H 1 91 LEU HA . . 4.980 4.774 3.895 5.075 0.095 12 0 "[ . 1 . 2]" 1
1206 1 62 THR HA 1 62 THR MG . . 3.300 2.079 1.950 2.352 . 0 0 "[ . 1 . 2]" 1
1207 1 62 THR HA 1 63 VAL H . . 3.340 2.155 2.142 2.171 . 0 0 "[ . 1 . 2]" 1
1208 1 62 THR HB 1 63 VAL H . . 5.500 3.962 3.785 4.402 . 0 0 "[ . 1 . 2]" 1
1209 1 62 THR HB 1 92 SER HB2 . . 4.320 2.690 2.057 3.426 . 0 0 "[ . 1 . 2]" 1
1210 1 62 THR HB 1 92 SER QB . . 3.780 2.517 1.986 3.280 . 0 0 "[ . 1 . 2]" 1
1211 1 62 THR HB 1 92 SER HB3 . . 4.320 3.624 2.002 4.262 . 0 0 "[ . 1 . 2]" 1
1212 1 62 THR MG 1 63 VAL H . . 3.490 3.313 2.899 3.501 0.011 7 0 "[ . 1 . 2]" 1
1213 1 63 VAL H 1 63 VAL HB . . 3.310 2.556 2.448 2.621 . 0 0 "[ . 1 . 2]" 1
1214 1 63 VAL H 1 63 VAL MG1 . . 3.820 3.725 2.246 3.828 0.008 16 0 "[ . 1 . 2]" 1
1215 1 63 VAL H 1 63 VAL MG2 . . 3.820 2.449 2.216 3.792 . 0 0 "[ . 1 . 2]" 1
1216 1 63 VAL H 1 64 THR H . . 4.540 4.489 4.443 4.571 0.031 20 0 "[ . 1 . 2]" 1
1217 1 63 VAL HA 1 63 VAL MG1 . . 3.530 2.433 2.349 3.186 . 0 0 "[ . 1 . 2]" 1
1218 1 63 VAL HA 1 63 VAL MG2 . . 3.530 2.371 2.257 2.405 . 0 0 "[ . 1 . 2]" 1
1219 1 63 VAL HA 1 64 THR H . . 2.880 2.158 2.145 2.206 . 0 0 "[ . 1 . 2]" 1
1220 1 63 VAL HA 1 91 LEU HA . . 3.990 3.526 2.633 3.994 0.004 16 0 "[ . 1 . 2]" 1
1221 1 63 VAL HB 1 64 THR H . . 3.940 4.130 4.044 4.247 0.307 5 0 "[ . 1 . 2]" 1
1222 1 63 VAL QG 1 64 THR H . . 3.270 2.503 2.150 2.671 . 0 0 "[ . 1 . 2]" 1
1223 1 63 VAL QG 1 64 THR HA . . 4.390 3.556 3.289 3.655 . 0 0 "[ . 1 . 2]" 1
1224 1 63 VAL QG 1 65 VAL H . . 3.720 3.620 3.440 3.773 0.053 5 0 "[ . 1 . 2]" 1
1225 1 63 VAL QG 1 98 ALA MB . . 2.910 2.502 2.201 3.125 0.215 20 0 "[ . 1 . 2]" 1
1226 1 63 VAL MG1 1 64 THR H . . 3.950 2.598 2.297 3.530 . 0 0 "[ . 1 . 2]" 1
1227 1 63 VAL MG2 1 64 THR H . . 3.950 3.941 2.169 4.101 0.151 16 0 "[ . 1 . 2]" 1
1228 1 64 THR H 1 64 THR HB . . 3.380 3.239 2.655 3.322 . 0 0 "[ . 1 . 2]" 1
1229 1 64 THR H 1 64 THR MG . . 3.980 3.789 3.748 3.857 . 0 0 "[ . 1 . 2]" 1
1230 1 64 THR H 1 90 GLU H . . 3.680 2.789 2.591 3.029 . 0 0 "[ . 1 . 2]" 1
1231 1 64 THR H 1 90 GLU HB2 . . 4.580 3.368 2.749 3.763 . 0 0 "[ . 1 . 2]" 1
1232 1 64 THR H 1 90 GLU HB3 . . 4.430 3.505 2.981 3.970 . 0 0 "[ . 1 . 2]" 1
1233 1 64 THR H 1 91 LEU HA . . 4.600 4.241 3.568 4.622 0.022 1 0 "[ . 1 . 2]" 1
1234 1 64 THR HA 1 64 THR MG . . 3.230 2.027 1.937 2.373 . 0 0 "[ . 1 . 2]" 1
1235 1 64 THR HA 1 65 VAL H . . 2.760 2.157 2.142 2.161 . 0 0 "[ . 1 . 2]" 1
1236 1 64 THR HA 1 65 VAL QG . . 4.370 3.694 3.346 3.916 . 0 0 "[ . 1 . 2]" 1
1237 1 64 THR HB 1 65 VAL H . . 4.680 3.965 3.739 4.302 . 0 0 "[ . 1 . 2]" 1
1238 1 64 THR HB 1 90 GLU H . . 4.000 3.180 2.801 3.626 . 0 0 "[ . 1 . 2]" 1
1239 1 64 THR HB 1 90 GLU HB2 . . 3.650 1.965 1.913 1.999 . 0 0 "[ . 1 . 2]" 1
1240 1 64 THR HB 1 90 GLU HB3 . . 3.660 2.982 2.485 3.278 . 0 0 "[ . 1 . 2]" 1
1241 1 64 THR HB 1 90 GLU HG2 . . 4.630 4.643 4.419 4.756 0.126 14 0 "[ . 1 . 2]" 1
1242 1 64 THR HB 1 90 GLU HG3 . . 3.930 3.547 3.082 3.982 0.052 19 0 "[ . 1 . 2]" 1
1243 1 64 THR MG 1 65 VAL H . . 3.400 3.322 2.858 3.446 0.046 15 0 "[ . 1 . 2]" 1
1244 1 65 VAL H 1 65 VAL HB . . 3.510 3.201 2.662 3.774 0.264 2 0 "[ . 1 . 2]" 1
1245 1 65 VAL H 1 65 VAL MG1 . . 3.980 2.819 2.066 3.944 . 0 0 "[ . 1 . 2]" 1
1246 1 65 VAL H 1 65 VAL QG . . 3.300 2.328 1.956 2.966 . 0 0 "[ . 1 . 2]" 1
1247 1 65 VAL H 1 65 VAL MG2 . . 3.980 3.307 1.979 3.958 . 0 0 "[ . 1 . 2]" 1
1248 1 65 VAL H 1 66 GLY H . . 5.500 4.373 4.154 4.469 . 0 0 "[ . 1 . 2]" 1
1249 1 65 VAL HA 1 65 VAL QG . . 3.120 2.173 2.041 2.274 . 0 0 "[ . 1 . 2]" 1
1250 1 65 VAL HA 1 66 GLY H . . 2.920 2.278 2.148 2.476 . 0 0 "[ . 1 . 2]" 1
1251 1 65 VAL HA 1 89 ILE HA . . 3.970 2.968 2.809 3.170 . 0 0 "[ . 1 . 2]" 1
1252 1 65 VAL HA 1 90 GLU H . . 4.230 3.746 3.448 4.042 . 0 0 "[ . 1 . 2]" 1
1253 1 65 VAL HB 1 66 GLY H . . 4.050 3.686 2.225 4.246 0.196 5 0 "[ . 1 . 2]" 1
1254 1 65 VAL HB 1 89 ILE HA . . 4.070 3.719 3.111 4.529 0.459 6 0 "[ . 1 . 2]" 1
1255 1 65 VAL HB 1 89 ILE MG . . 4.280 3.364 2.565 4.448 0.168 3 0 "[ . 1 . 2]" 1
1256 1 65 VAL QG 1 66 GLY H . . 2.980 2.329 1.868 3.089 0.109 2 0 "[ . 1 . 2]" 1
1257 1 65 VAL QG 1 66 GLY QA . . 4.510 3.431 3.185 3.922 . 0 0 "[ . 1 . 2]" 1
1258 1 65 VAL QG 1 69 ASP QB . . 3.150 2.117 1.782 3.331 0.181 3 0 "[ . 1 . 2]" 1
1259 1 65 VAL QG 1 70 MET H . . 3.990 2.922 2.376 4.028 0.038 10 0 "[ . 1 . 2]" 1
1260 1 65 VAL QG 1 70 MET ME . . 2.830 2.339 1.945 2.979 0.149 18 0 "[ . 1 . 2]" 1
1261 1 65 VAL QG 1 89 ILE HA . . 3.860 2.745 1.839 3.571 . 0 0 "[ . 1 . 2]" 1
1262 1 65 VAL QG 1 89 ILE MD . . 3.140 3.218 3.048 3.294 0.154 17 0 "[ . 1 . 2]" 1
1263 1 65 VAL QG 1 89 ILE QG . . 4.580 2.143 1.837 2.521 . 0 0 "[ . 1 . 2]" 1
1264 1 65 VAL QG 1 89 ILE MG . . 3.250 2.642 1.865 3.313 0.063 15 0 "[ . 1 . 2]" 1
1265 1 65 VAL MG1 1 66 GLY H . . 3.760 3.261 1.872 4.069 0.309 19 0 "[ . 1 . 2]" 1
1266 1 65 VAL MG1 1 70 MET ME . . 3.490 2.718 1.954 3.667 0.177 2 0 "[ . 1 . 2]" 1
1267 1 65 VAL MG1 1 89 ILE HA . . 4.560 3.822 1.899 4.718 0.158 7 0 "[ . 1 . 2]" 1
1268 1 65 VAL MG1 1 89 ILE MG . . 3.710 3.366 1.878 3.820 0.110 4 0 "[ . 1 . 2]" 1
1269 1 65 VAL MG2 1 66 GLY H . . 3.760 2.879 1.879 3.914 0.154 8 0 "[ . 1 . 2]" 1
1270 1 65 VAL MG2 1 70 MET ME . . 3.490 3.232 2.324 3.618 0.128 1 0 "[ . 1 . 2]" 1
1271 1 65 VAL MG2 1 89 ILE HA . . 4.560 3.296 1.845 4.583 0.023 9 0 "[ . 1 . 2]" 1
1272 1 65 VAL MG2 1 89 ILE MG . . 3.710 3.180 1.869 3.799 0.089 2 0 "[ . 1 . 2]" 1
1273 1 66 GLY H 1 67 LEU H . . 5.040 4.590 4.529 4.632 . 0 0 "[ . 1 . 2]" 1
1274 1 66 GLY H 1 69 ASP HB2 . . 4.700 2.627 2.133 4.079 . 0 0 "[ . 1 . 2]" 1
1275 1 66 GLY H 1 69 ASP QB . . 3.920 2.499 2.113 3.015 . 0 0 "[ . 1 . 2]" 1
1276 1 66 GLY H 1 69 ASP HB3 . . 4.700 3.545 2.975 4.112 . 0 0 "[ . 1 . 2]" 1
1277 1 66 GLY H 1 89 ILE HA . . 5.220 4.754 4.598 4.896 . 0 0 "[ . 1 . 2]" 1
1278 1 66 GLY QA 1 69 ASP H . . 4.160 3.365 3.195 3.618 . 0 0 "[ . 1 . 2]" 1
1279 1 66 GLY HA2 1 67 LEU H . . 3.480 2.401 2.342 2.518 . 0 0 "[ . 1 . 2]" 1
1280 1 66 GLY HA3 1 67 LEU H . . 3.480 2.740 2.608 2.812 . 0 0 "[ . 1 . 2]" 1
1281 1 67 LEU H 1 67 LEU HB2 . . 3.340 2.163 2.056 2.225 . 0 0 "[ . 1 . 2]" 1
1282 1 67 LEU H 1 67 LEU HB3 . . 3.340 2.923 2.828 3.141 . 0 0 "[ . 1 . 2]" 1
1283 1 67 LEU H 1 67 LEU MD1 . . 4.640 3.500 3.034 3.659 . 0 0 "[ . 1 . 2]" 1
1284 1 67 LEU H 1 67 LEU QD . . 3.240 3.346 2.965 3.467 0.227 18 0 "[ . 1 . 2]" 1
1285 1 67 LEU H 1 67 LEU MD2 . . 4.640 4.272 4.179 4.315 . 0 0 "[ . 1 . 2]" 1
1286 1 67 LEU H 1 67 LEU HG . . 4.680 4.501 4.448 4.521 . 0 0 "[ . 1 . 2]" 1
1287 1 67 LEU H 1 68 GLU H . . 4.080 2.937 2.730 3.029 . 0 0 "[ . 1 . 2]" 1
1288 1 67 LEU H 1 69 ASP H . . 4.910 4.075 3.869 4.464 . 0 0 "[ . 1 . 2]" 1
1289 1 67 LEU HA 1 67 LEU MD1 . . 4.180 2.359 2.212 2.510 . 0 0 "[ . 1 . 2]" 1
1290 1 67 LEU HA 1 67 LEU QD . . 3.180 2.337 2.197 2.478 . 0 0 "[ . 1 . 2]" 1
1291 1 67 LEU HA 1 67 LEU MD2 . . 4.180 3.824 3.787 3.843 . 0 0 "[ . 1 . 2]" 1
1292 1 67 LEU HA 1 67 LEU HG . . 3.970 2.641 2.576 2.702 . 0 0 "[ . 1 . 2]" 1
1293 1 67 LEU QB 1 68 GLU H . . 3.350 2.100 2.051 2.324 . 0 0 "[ . 1 . 2]" 1
1294 1 67 LEU HB2 1 68 GLU H . . 3.950 3.301 3.064 3.477 . 0 0 "[ . 1 . 2]" 1
1295 1 67 LEU HB3 1 68 GLU H . . 3.950 2.126 2.070 2.361 . 0 0 "[ . 1 . 2]" 1
1296 1 67 LEU MD1 1 68 GLU H . . 4.720 4.585 4.509 4.725 0.005 18 0 "[ . 1 . 2]" 1
1297 1 67 LEU MD2 1 68 GLU H . . 4.720 3.903 3.752 4.091 . 0 0 "[ . 1 . 2]" 1
1298 1 67 LEU HG 1 68 GLU H . . 4.320 4.111 3.974 4.372 0.052 2 0 "[ . 1 . 2]" 1
1299 1 68 GLU H 1 68 GLU HB2 . . 3.580 2.644 2.395 2.768 . 0 0 "[ . 1 . 2]" 1
1300 1 68 GLU H 1 68 GLU HB3 . . 3.580 3.586 3.572 3.593 0.013 11 0 "[ . 1 . 2]" 1
1301 1 68 GLU H 1 68 GLU HG2 . . 4.050 2.604 2.001 3.571 . 0 0 "[ . 1 . 2]" 1
1302 1 68 GLU H 1 68 GLU QG . . 3.480 2.200 1.990 2.546 . 0 0 "[ . 1 . 2]" 1
1303 1 68 GLU H 1 68 GLU HG3 . . 4.050 2.463 2.175 3.541 . 0 0 "[ . 1 . 2]" 1
1304 1 68 GLU H 1 69 ASP H . . 3.540 2.818 2.665 2.992 . 0 0 "[ . 1 . 2]" 1
1305 1 68 GLU HA 1 68 GLU HG2 . . 3.580 2.557 2.297 3.547 . 0 0 "[ . 1 . 2]" 1
1306 1 68 GLU HA 1 68 GLU HG3 . . 3.580 3.514 2.557 3.739 0.159 15 0 "[ . 1 . 2]" 1
1307 1 68 GLU HA 1 70 MET H . . 4.530 4.573 4.426 4.658 0.128 6 0 "[ . 1 . 2]" 1
1308 1 68 GLU HA 1 71 LEU H . . 3.740 3.647 3.368 3.846 0.106 3 0 "[ . 1 . 2]" 1
1309 1 68 GLU HA 1 72 ALA H . . 4.340 4.011 3.794 4.316 . 0 0 "[ . 1 . 2]" 1
1310 1 68 GLU QB 1 69 ASP H . . 3.370 2.565 2.261 2.739 . 0 0 "[ . 1 . 2]" 1
1311 1 68 GLU HB2 1 69 ASP H . . 3.850 2.615 2.287 2.804 . 0 0 "[ . 1 . 2]" 1
1312 1 68 GLU HB3 1 69 ASP H . . 3.850 3.732 3.118 3.856 0.006 5 0 "[ . 1 . 2]" 1
1313 1 68 GLU QG 1 69 ASP H . . 4.060 3.934 3.781 4.109 0.049 17 0 "[ . 1 . 2]" 1
1314 1 68 GLU HG2 1 69 ASP H . . 4.670 4.611 3.973 4.827 0.157 17 0 "[ . 1 . 2]" 1
1315 1 68 GLU HG3 1 69 ASP H . . 4.670 4.296 4.021 4.808 0.138 15 0 "[ . 1 . 2]" 1
1316 1 69 ASP H 1 69 ASP HB2 . . 3.820 2.519 2.070 2.772 . 0 0 "[ . 1 . 2]" 1
1317 1 69 ASP H 1 69 ASP QB . . 3.010 2.443 2.047 2.681 . 0 0 "[ . 1 . 2]" 1
1318 1 69 ASP H 1 69 ASP HB3 . . 3.820 3.463 2.440 3.599 . 0 0 "[ . 1 . 2]" 1
1319 1 69 ASP H 1 70 MET H . . 3.220 2.791 2.588 2.925 . 0 0 "[ . 1 . 2]" 1
1320 1 69 ASP HA 1 72 ALA H . . 3.730 3.755 3.428 3.881 0.151 10 0 "[ . 1 . 2]" 1
1321 1 69 ASP QB 1 70 MET H . . 3.260 2.410 2.258 2.533 . 0 0 "[ . 1 . 2]" 1
1322 1 69 ASP QB 1 73 ILE MD . . 4.120 3.975 3.536 4.298 0.178 6 0 "[ . 1 . 2]" 1
1323 1 69 ASP HB2 1 70 MET H . . 3.900 2.623 2.289 3.886 . 0 0 "[ . 1 . 2]" 1
1324 1 69 ASP HB3 1 70 MET H . . 3.900 3.374 2.321 3.787 . 0 0 "[ . 1 . 2]" 1
1325 1 70 MET H 1 71 LEU H . . 4.010 2.742 2.511 2.936 . 0 0 "[ . 1 . 2]" 1
1326 1 70 MET H 1 73 ILE MD . . 4.950 4.907 4.399 5.114 0.164 3 0 "[ . 1 . 2]" 1
1327 1 70 MET HA 1 73 ILE HB . . 3.900 3.480 3.090 3.966 0.066 3 0 "[ . 1 . 2]" 1
1328 1 70 MET HA 1 73 ILE MD . . 3.560 3.046 2.186 3.659 0.099 18 0 "[ . 1 . 2]" 1
1329 1 70 MET QB 1 71 LEU H . . 3.810 2.463 2.233 2.787 . 0 0 "[ . 1 . 2]" 1
1330 1 70 MET QG 1 71 LEU H . . 5.340 4.152 3.222 4.397 . 0 0 "[ . 1 . 2]" 1
1331 1 71 LEU H 1 71 LEU HB2 . . 4.100 2.670 2.480 3.581 . 0 0 "[ . 1 . 2]" 1
1332 1 71 LEU H 1 71 LEU HB3 . . 4.100 3.534 2.632 3.587 . 0 0 "[ . 1 . 2]" 1
1333 1 71 LEU H 1 71 LEU QD . . 4.010 2.960 2.885 3.108 . 0 0 "[ . 1 . 2]" 1
1334 1 71 LEU H 1 71 LEU HG . . 3.530 2.010 1.921 2.276 . 0 0 "[ . 1 . 2]" 1
1335 1 71 LEU H 1 72 ALA H . . 3.630 2.772 2.669 2.839 . 0 0 "[ . 1 . 2]" 1
1336 1 71 LEU HA 1 71 LEU MD1 . . 4.090 3.935 3.696 3.975 . 0 0 "[ . 1 . 2]" 1
1337 1 71 LEU HA 1 71 LEU QD . . 3.190 2.422 2.041 3.397 0.207 3 0 "[ . 1 . 2]" 1
1338 1 71 LEU HA 1 71 LEU MD2 . . 4.090 2.469 2.048 3.964 . 0 0 "[ . 1 . 2]" 1
1339 1 71 LEU QB 1 72 ALA H . . 3.400 2.672 2.489 3.463 0.063 3 0 "[ . 1 . 2]" 1
1340 1 71 LEU QD 1 72 ALA H . . 3.880 3.903 2.581 4.032 0.152 16 0 "[ . 1 . 2]" 1
1341 1 71 LEU MD1 1 72 ALA H . . 4.730 4.151 2.611 4.333 . 0 0 "[ . 1 . 2]" 1
1342 1 71 LEU MD2 1 72 ALA H . . 4.730 4.780 4.034 4.872 0.142 2 0 "[ . 1 . 2]" 1
1343 1 71 LEU HG 1 72 ALA H . . 4.350 4.175 2.394 4.428 0.078 10 0 "[ . 1 . 2]" 1
1344 1 72 ALA H 1 72 ALA MB . . 3.240 2.134 2.041 2.228 . 0 0 "[ . 1 . 2]" 1
1345 1 72 ALA H 1 73 ILE H . . 3.710 2.727 2.600 2.807 . 0 0 "[ . 1 . 2]" 1
1346 1 72 ALA HA 1 78 LEU H . . 4.210 3.962 3.631 4.274 0.064 3 0 "[ . 1 . 2]" 1
1347 1 72 ALA HA 1 78 LEU QD . . 5.300 4.418 3.667 4.697 . 0 0 "[ . 1 . 2]" 1
1348 1 72 ALA MB 1 73 ILE H . . 3.180 2.604 2.327 2.839 . 0 0 "[ . 1 . 2]" 1
1349 1 72 ALA MB 1 78 LEU QD . . 3.260 2.601 1.817 3.148 . 0 0 "[ . 1 . 2]" 1
1350 1 73 ILE H 1 73 ILE HB . . 3.390 2.695 2.663 2.724 . 0 0 "[ . 1 . 2]" 1
1351 1 73 ILE H 1 73 ILE MD . . 3.710 3.620 3.560 3.712 0.002 3 0 "[ . 1 . 2]" 1
1352 1 73 ILE H 1 73 ILE HG12 . . 3.850 3.010 2.845 3.193 . 0 0 "[ . 1 . 2]" 1
1353 1 73 ILE H 1 73 ILE QG . . 3.090 1.940 1.881 2.088 . 0 0 "[ . 1 . 2]" 1
1354 1 73 ILE H 1 73 ILE HG13 . . 3.850 1.964 1.900 2.116 . 0 0 "[ . 1 . 2]" 1
1355 1 73 ILE H 1 73 ILE MG . . 3.920 3.772 3.760 3.801 . 0 0 "[ . 1 . 2]" 1
1356 1 73 ILE H 1 74 SER H . . 3.580 2.747 2.580 2.848 . 0 0 "[ . 1 . 2]" 1
1357 1 73 ILE H 1 78 LEU H . . 5.090 4.608 4.352 4.909 . 0 0 "[ . 1 . 2]" 1
1358 1 73 ILE HA 1 73 ILE MD . . 3.740 3.832 3.801 3.860 0.120 15 0 "[ . 1 . 2]" 1
1359 1 73 ILE HA 1 73 ILE HG12 . . 4.070 2.613 2.595 2.639 . 0 0 "[ . 1 . 2]" 1
1360 1 73 ILE HA 1 73 ILE HG13 . . 4.070 3.291 3.243 3.369 . 0 0 "[ . 1 . 2]" 1
1361 1 73 ILE HA 1 73 ILE MG . . 3.470 2.312 2.149 2.344 . 0 0 "[ . 1 . 2]" 1
1362 1 73 ILE HA 1 75 GLY H . . 5.170 4.009 3.887 4.186 . 0 0 "[ . 1 . 2]" 1
1363 1 73 ILE HA 1 76 LYS H . . 5.150 3.948 3.761 4.293 . 0 0 "[ . 1 . 2]" 1
1364 1 73 ILE HA 1 78 LEU H . . 3.570 2.973 2.688 3.464 . 0 0 "[ . 1 . 2]" 1
1365 1 73 ILE HA 1 78 LEU HB2 . . 4.490 4.221 3.437 4.545 0.055 14 0 "[ . 1 . 2]" 1
1366 1 73 ILE HA 1 78 LEU HB3 . . 4.560 3.198 2.166 3.916 . 0 0 "[ . 1 . 2]" 1
1367 1 73 ILE HB 1 73 ILE MD . . 3.550 2.456 2.411 2.499 . 0 0 "[ . 1 . 2]" 1
1368 1 73 ILE HB 1 74 SER H . . 3.570 2.093 2.030 2.142 . 0 0 "[ . 1 . 2]" 1
1369 1 73 ILE HB 1 74 SER QB . . 4.180 3.722 3.535 3.787 . 0 0 "[ . 1 . 2]" 1
1370 1 73 ILE MD 1 73 ILE MG . . 3.130 1.936 1.895 2.039 . 0 0 "[ . 1 . 2]" 1
1371 1 73 ILE MD 1 74 SER H . . 4.180 4.186 4.143 4.216 0.036 3 0 "[ . 1 . 2]" 1
1372 1 73 ILE MD 1 80 VAL HA . . 3.990 2.324 1.947 2.865 . 0 0 "[ . 1 . 2]" 1
1373 1 73 ILE MD 1 80 VAL QG . . 3.570 2.034 1.827 2.683 . 0 0 "[ . 1 . 2]" 1
1374 1 73 ILE MD 1 83 ALA MB . . 2.990 2.820 2.326 3.075 0.085 14 0 "[ . 1 . 2]" 1
1375 1 73 ILE QG 1 73 ILE MG . . 3.130 2.343 2.293 2.375 . 0 0 "[ . 1 . 2]" 1
1376 1 73 ILE QG 1 74 SER H . . 3.460 3.589 3.532 3.628 0.168 17 0 "[ . 1 . 2]" 1
1377 1 73 ILE QG 1 78 LEU HB2 . . 4.740 4.407 3.881 4.708 . 0 0 "[ . 1 . 2]" 1
1378 1 73 ILE QG 1 78 LEU HB3 . . 4.850 3.055 2.373 3.783 . 0 0 "[ . 1 . 2]" 1
1379 1 73 ILE HG12 1 73 ILE MG . . 3.700 2.410 2.350 2.449 . 0 0 "[ . 1 . 2]" 1
1380 1 73 ILE HG13 1 73 ILE MG . . 3.700 3.198 3.187 3.200 . 0 0 "[ . 1 . 2]" 1
1381 1 73 ILE MG 1 74 SER H . . 3.290 3.323 3.270 3.377 0.087 15 0 "[ . 1 . 2]" 1
1382 1 73 ILE MG 1 80 VAL QG . . 2.980 2.135 1.715 2.521 . 0 0 "[ . 1 . 2]" 1
1383 1 74 SER H 1 74 SER QB . . 3.020 2.133 2.049 2.333 . 0 0 "[ . 1 . 2]" 1
1384 1 74 SER H 1 75 GLY H . . 3.320 2.704 2.555 2.732 . 0 0 "[ . 1 . 2]" 1
1385 1 74 SER QB 1 75 GLY H . . 3.580 3.162 2.964 3.689 0.109 19 0 "[ . 1 . 2]" 1
1386 1 75 GLY H 1 76 LYS H . . 3.430 2.655 2.603 2.770 . 0 0 "[ . 1 . 2]" 1
1387 1 76 LYS H 1 76 LYS QB . . 3.660 3.106 2.880 3.468 . 0 0 "[ . 1 . 2]" 1
1388 1 76 LYS H 1 76 LYS QG . . 4.000 3.469 2.620 4.017 0.017 3 0 "[ . 1 . 2]" 1
1389 1 76 LYS H 1 77 THR H . . 3.280 2.663 2.582 2.838 . 0 0 "[ . 1 . 2]" 1
1390 1 76 LYS H 1 78 LEU H . . 4.220 3.985 3.648 4.327 0.107 4 0 "[ . 1 . 2]" 1
1391 1 76 LYS HA 1 76 LYS HG2 . . 4.060 3.422 2.701 3.914 . 0 0 "[ . 1 . 2]" 1
1392 1 76 LYS HA 1 76 LYS HG3 . . 4.060 3.601 3.519 3.722 . 0 0 "[ . 1 . 2]" 1
1393 1 76 LYS HA 1 78 LEU H . . 4.080 4.058 3.781 4.134 0.054 3 0 "[ . 1 . 2]" 1
1394 1 76 LYS QB 1 77 THR H . . 4.350 3.821 3.580 4.044 . 0 0 "[ . 1 . 2]" 1
1395 1 76 LYS HB2 1 77 THR H . . 4.970 4.338 3.756 4.594 . 0 0 "[ . 1 . 2]" 1
1396 1 76 LYS HB3 1 77 THR H . . 4.970 4.346 4.082 4.572 . 0 0 "[ . 1 . 2]" 1
1397 1 76 LYS QG 1 77 THR H . . 3.860 3.637 3.278 4.136 0.276 15 0 "[ . 1 . 2]" 1
1398 1 76 LYS HG2 1 77 THR H . . 4.660 4.046 3.374 4.675 0.015 18 0 "[ . 1 . 2]" 1
1399 1 76 LYS HG3 1 77 THR H . . 4.660 4.371 3.866 4.662 0.002 7 0 "[ . 1 . 2]" 1
1400 1 77 THR H 1 77 THR HB . . 3.930 3.245 2.338 3.742 . 0 0 "[ . 1 . 2]" 1
1401 1 77 THR H 1 77 THR MG . . 3.370 2.545 1.927 3.714 0.344 13 0 "[ . 1 . 2]" 1
1402 1 77 THR H 1 78 LEU H . . 2.780 2.243 2.067 2.422 . 0 0 "[ . 1 . 2]" 1
1403 1 77 THR HA 1 77 THR MG . . 3.100 2.587 2.323 3.207 0.107 12 0 "[ . 1 . 2]" 1
1404 1 77 THR HB 1 78 LEU H . . 3.940 3.707 2.767 4.039 0.099 9 0 "[ . 1 . 2]" 1
1405 1 77 THR MG 1 78 LEU H . . 3.770 3.350 2.145 3.842 0.072 8 0 "[ . 1 . 2]" 1
1406 1 78 LEU H 1 78 LEU HB2 . . 3.400 2.757 2.535 2.896 . 0 0 "[ . 1 . 2]" 1
1407 1 78 LEU H 1 78 LEU HB3 . . 3.530 3.033 2.818 3.460 . 0 0 "[ . 1 . 2]" 1
1408 1 78 LEU H 1 78 LEU MD1 . . 4.380 4.377 4.283 4.427 0.047 10 0 "[ . 1 . 2]" 1
1409 1 78 LEU H 1 78 LEU QD . . 3.690 3.808 3.413 3.946 0.256 10 0 "[ . 1 . 2]" 1
1410 1 78 LEU H 1 78 LEU MD2 . . 4.380 4.220 3.571 4.433 0.053 10 0 "[ . 1 . 2]" 1
1411 1 78 LEU H 1 78 LEU HG . . 5.190 4.633 4.181 4.997 . 0 0 "[ . 1 . 2]" 1
1412 1 78 LEU H 1 79 THR H . . 4.410 4.455 4.409 4.479 0.069 15 0 "[ . 1 . 2]" 1
1413 1 78 LEU HA 1 78 LEU MD1 . . 4.360 3.080 1.957 3.775 . 0 0 "[ . 1 . 2]" 1
1414 1 78 LEU HA 1 78 LEU QD . . 3.360 2.723 1.866 3.012 . 0 0 "[ . 1 . 2]" 1
1415 1 78 LEU HA 1 78 LEU MD2 . . 4.360 3.127 2.067 3.564 . 0 0 "[ . 1 . 2]" 1
1416 1 78 LEU HA 1 78 LEU HG . . 3.890 2.547 2.217 3.630 . 0 0 "[ . 1 . 2]" 1
1417 1 78 LEU HA 1 79 THR H . . 3.190 2.461 2.418 2.473 . 0 0 "[ . 1 . 2]" 1
1418 1 78 LEU HB2 1 79 THR H . . 5.500 3.902 3.866 3.966 . 0 0 "[ . 1 . 2]" 1
1419 1 78 LEU HB3 1 79 THR H . . 3.430 3.004 2.573 3.213 . 0 0 "[ . 1 . 2]" 1
1420 1 78 LEU QD 1 79 THR H . . 3.240 2.074 1.844 2.411 . 0 0 "[ . 1 . 2]" 1
1421 1 78 LEU QD 1 82 ASP H . . 4.010 3.422 3.159 3.796 . 0 0 "[ . 1 . 2]" 1
1422 1 78 LEU QD 1 82 ASP HA . . 3.950 4.027 3.950 4.102 0.152 19 0 "[ . 1 . 2]" 1
1423 1 78 LEU QD 1 82 ASP QB . . 3.440 1.837 1.700 1.918 . 0 0 "[ . 1 . 2]" 1
1424 1 78 LEU QD 1 83 ALA H . . 3.470 2.511 1.928 3.474 0.004 9 0 "[ . 1 . 2]" 1
1425 1 78 LEU QD 1 86 GLN QE . . 3.600 2.883 2.434 3.619 0.019 19 0 "[ . 1 . 2]" 1
1426 1 78 LEU MD1 1 79 THR H . . 3.990 3.412 1.847 3.949 . 0 0 "[ . 1 . 2]" 1
1427 1 78 LEU MD2 1 79 THR H . . 3.990 2.494 1.857 3.925 . 0 0 "[ . 1 . 2]" 1
1428 1 78 LEU HG 1 79 THR H . . 3.900 2.629 1.947 3.945 0.045 19 0 "[ . 1 . 2]" 1
1429 1 79 THR H 1 79 THR HB . . 3.790 3.733 3.371 3.863 0.073 14 0 "[ . 1 . 2]" 1
1430 1 79 THR H 1 79 THR MG . . 3.470 3.019 2.586 3.495 0.025 6 0 "[ . 1 . 2]" 1
1431 1 79 THR H 1 80 VAL H . . 5.000 4.479 4.449 4.553 . 0 0 "[ . 1 . 2]" 1
1432 1 79 THR H 1 82 ASP H . . 4.710 3.796 3.648 4.223 . 0 0 "[ . 1 . 2]" 1
1433 1 79 THR H 1 82 ASP QB . . 4.080 2.582 2.165 3.024 . 0 0 "[ . 1 . 2]" 1
1434 1 79 THR HA 1 79 THR MG . . 3.480 2.285 2.147 2.416 . 0 0 "[ . 1 . 2]" 1
1435 1 79 THR HA 1 80 VAL H . . 3.310 2.291 2.264 2.358 . 0 0 "[ . 1 . 2]" 1
1436 1 79 THR HB 1 80 VAL H . . 3.490 2.738 2.573 2.935 . 0 0 "[ . 1 . 2]" 1
1437 1 79 THR HB 1 81 GLY H . . 3.370 2.869 2.678 3.081 . 0 0 "[ . 1 . 2]" 1
1438 1 79 THR HB 1 82 ASP H . . 5.400 3.618 2.775 4.328 . 0 0 "[ . 1 . 2]" 1
1439 1 79 THR MG 1 80 VAL H . . 3.950 3.638 2.720 3.976 0.026 4 0 "[ . 1 . 2]" 1
1440 1 79 THR MG 1 81 GLY H . . 4.380 4.304 3.644 4.433 0.053 14 0 "[ . 1 . 2]" 1
1441 1 79 THR MG 1 82 ASP H . . 4.370 4.401 4.374 4.444 0.074 15 0 "[ . 1 . 2]" 1
1442 1 80 VAL H 1 80 VAL HB . . 3.220 2.588 2.500 2.667 . 0 0 "[ . 1 . 2]" 1
1443 1 80 VAL H 1 80 VAL MG1 . . 3.740 3.765 3.761 3.767 0.027 12 0 "[ . 1 . 2]" 1
1444 1 80 VAL H 1 80 VAL QG . . 3.040 2.106 1.909 2.337 . 0 0 "[ . 1 . 2]" 1
1445 1 80 VAL H 1 80 VAL MG2 . . 3.740 2.118 1.914 2.360 . 0 0 "[ . 1 . 2]" 1
1446 1 80 VAL H 1 81 GLY H . . 3.760 2.810 2.638 2.926 . 0 0 "[ . 1 . 2]" 1
1447 1 80 VAL H 1 82 ASP H . . 5.500 4.404 4.101 4.708 . 0 0 "[ . 1 . 2]" 1
1448 1 80 VAL HA 1 80 VAL MG1 . . 3.640 2.366 2.294 2.456 . 0 0 "[ . 1 . 2]" 1
1449 1 80 VAL HA 1 80 VAL MG2 . . 3.640 2.332 2.218 2.439 . 0 0 "[ . 1 . 2]" 1
1450 1 80 VAL HA 1 82 ASP H . . 4.690 4.380 4.153 4.675 . 0 0 "[ . 1 . 2]" 1
1451 1 80 VAL HA 1 83 ALA H . . 3.750 3.557 3.390 3.722 . 0 0 "[ . 1 . 2]" 1
1452 1 80 VAL HA 1 83 ALA MB . . 3.190 2.730 2.485 3.203 0.013 15 0 "[ . 1 . 2]" 1
1453 1 80 VAL HA 1 89 ILE MD . . 5.020 3.203 2.818 3.507 . 0 0 "[ . 1 . 2]" 1
1454 1 80 VAL HB 1 81 GLY H . . 3.380 2.607 2.317 2.727 . 0 0 "[ . 1 . 2]" 1
1455 1 80 VAL QG 1 81 GLY H . . 3.230 3.209 2.939 3.296 0.066 4 0 "[ . 1 . 2]" 1
1456 1 80 VAL MG1 1 81 GLY H . . 3.800 3.450 3.048 3.612 . 0 0 "[ . 1 . 2]" 1
1457 1 80 VAL MG2 1 81 GLY H . . 3.800 3.830 3.660 3.860 0.060 20 0 "[ . 1 . 2]" 1
1458 1 81 GLY H 1 82 ASP H . . 3.470 2.818 2.719 2.967 . 0 0 "[ . 1 . 2]" 1
1459 1 81 GLY QA 1 84 LEU QB . . 3.970 2.586 2.283 2.912 . 0 0 "[ . 1 . 2]" 1
1460 1 81 GLY QA 1 84 LEU QD . . 4.190 3.881 3.614 4.237 0.047 6 0 "[ . 1 . 2]" 1
1461 1 81 GLY HA2 1 84 LEU HB2 . . 5.350 2.716 2.346 3.464 . 0 0 "[ . 1 . 2]" 1
1462 1 81 GLY HA2 1 84 LEU HB3 . . 5.350 3.607 3.120 3.884 . 0 0 "[ . 1 . 2]" 1
1463 1 81 GLY HA3 1 84 LEU HB2 . . 5.350 4.326 3.999 5.075 . 0 0 "[ . 1 . 2]" 1
1464 1 81 GLY HA3 1 84 LEU HB3 . . 5.350 5.141 4.767 5.380 0.030 14 0 "[ . 1 . 2]" 1
1465 1 82 ASP H 1 82 ASP HB2 . . 3.380 2.095 2.065 2.133 . 0 0 "[ . 1 . 2]" 1
1466 1 82 ASP H 1 82 ASP QB . . 2.860 2.075 2.044 2.113 . 0 0 "[ . 1 . 2]" 1
1467 1 82 ASP H 1 82 ASP HB3 . . 3.380 3.357 3.153 3.447 0.067 15 0 "[ . 1 . 2]" 1
1468 1 82 ASP H 1 83 ALA H . . 3.110 2.709 2.510 2.899 . 0 0 "[ . 1 . 2]" 1
1469 1 82 ASP H 1 83 ALA MB . . 5.500 4.261 4.106 4.399 . 0 0 "[ . 1 . 2]" 1
1470 1 82 ASP HA 1 85 LYS QB . . 3.560 3.221 2.917 3.494 . 0 0 "[ . 1 . 2]" 1
1471 1 82 ASP HA 1 86 GLN H . . 5.500 4.634 4.241 5.111 . 0 0 "[ . 1 . 2]" 1
1472 1 82 ASP QB 1 83 ALA H . . 3.130 2.555 2.364 2.780 . 0 0 "[ . 1 . 2]" 1
1473 1 82 ASP QB 1 86 GLN QE . . 3.500 3.481 3.271 3.531 0.031 15 0 "[ . 1 . 2]" 1
1474 1 82 ASP HB2 1 83 ALA H . . 3.610 2.916 2.759 3.182 . 0 0 "[ . 1 . 2]" 1
1475 1 82 ASP HB3 1 83 ALA H . . 3.610 2.857 2.468 3.218 . 0 0 "[ . 1 . 2]" 1
1476 1 83 ALA H 1 83 ALA MB . . 2.870 2.065 2.026 2.159 . 0 0 "[ . 1 . 2]" 1
1477 1 83 ALA HA 1 86 GLN H . . 4.460 3.500 3.382 3.648 . 0 0 "[ . 1 . 2]" 1
1478 1 83 ALA HA 1 86 GLN QB . . 3.630 2.834 2.415 3.092 . 0 0 "[ . 1 . 2]" 1
1479 1 83 ALA HA 1 86 GLN QE . . 4.680 2.608 2.479 2.796 . 0 0 "[ . 1 . 2]" 1
1480 1 83 ALA HA 1 87 GLY H . . 4.390 4.285 3.883 4.398 0.008 19 0 "[ . 1 . 2]" 1
1481 1 83 ALA HA 1 88 LYS H . . 4.200 3.925 3.640 4.327 0.127 6 0 "[ . 1 . 2]" 1
1482 1 83 ALA HA 1 89 ILE MD . . 5.440 4.948 3.800 5.420 . 0 0 "[ . 1 . 2]" 1
1483 1 83 ALA MB 1 84 LEU H . . 3.340 2.749 2.524 2.809 . 0 0 "[ . 1 . 2]" 1
1484 1 83 ALA MB 1 84 LEU HA . . 4.740 3.748 3.691 3.798 . 0 0 "[ . 1 . 2]" 1
1485 1 83 ALA MB 1 86 GLN HE21 . . 4.970 3.843 3.699 4.073 . 0 0 "[ . 1 . 2]" 1
1486 1 83 ALA MB 1 86 GLN QE . . 4.250 3.721 3.604 3.898 . 0 0 "[ . 1 . 2]" 1
1487 1 83 ALA MB 1 86 GLN HE22 . . 4.970 4.974 4.931 4.998 0.028 6 0 "[ . 1 . 2]" 1
1488 1 83 ALA MB 1 89 ILE MD . . 2.920 2.591 1.845 2.932 0.012 4 0 "[ . 1 . 2]" 1
1489 1 84 LEU H 1 84 LEU QB . . 3.690 2.035 2.019 2.154 . 0 0 "[ . 1 . 2]" 1
1490 1 84 LEU H 1 85 LYS H . . 3.310 2.855 2.758 2.899 . 0 0 "[ . 1 . 2]" 1
1491 1 84 LEU H 1 86 GLN H . . 5.500 4.237 4.037 4.329 . 0 0 "[ . 1 . 2]" 1
1492 1 84 LEU HA 1 84 LEU MD1 . . 3.580 2.470 2.360 2.881 . 0 0 "[ . 1 . 2]" 1
1493 1 84 LEU HA 1 84 LEU QD . . 2.900 1.963 1.876 1.995 . 0 0 "[ . 1 . 2]" 1
1494 1 84 LEU HA 1 84 LEU MD2 . . 3.580 2.071 1.903 2.113 . 0 0 "[ . 1 . 2]" 1
1495 1 84 LEU HA 1 84 LEU HG . . 3.660 3.632 3.623 3.680 0.020 11 0 "[ . 1 . 2]" 1
1496 1 84 LEU HA 1 87 GLY H . . 4.660 3.406 2.993 3.725 . 0 0 "[ . 1 . 2]" 1
1497 1 84 LEU HA 1 88 LYS H . . 4.600 3.581 3.199 4.071 . 0 0 "[ . 1 . 2]" 1
1498 1 84 LEU HA 1 89 ILE H . . 3.440 3.439 3.096 3.499 0.059 18 0 "[ . 1 . 2]" 1
1499 1 84 LEU HA 1 89 ILE HB . . 4.280 3.811 3.207 4.225 . 0 0 "[ . 1 . 2]" 1
1500 1 84 LEU QB 1 85 LYS H . . 3.040 2.429 2.280 2.486 . 0 0 "[ . 1 . 2]" 1
1501 1 84 LEU HB2 1 85 LYS H . . 3.480 3.125 3.057 3.553 0.073 6 0 "[ . 1 . 2]" 1
1502 1 84 LEU HB3 1 85 LYS H . . 3.480 2.541 2.308 2.615 . 0 0 "[ . 1 . 2]" 1
1503 1 84 LEU QD 1 85 LYS H . . 3.690 3.705 3.227 3.790 0.100 4 0 "[ . 1 . 2]" 1
1504 1 84 LEU QD 1 87 GLY H . . 4.610 4.122 3.830 4.509 . 0 0 "[ . 1 . 2]" 1
1505 1 84 LEU QD 1 88 LYS H . . 4.980 4.273 3.808 4.713 . 0 0 "[ . 1 . 2]" 1
1506 1 84 LEU QD 1 89 ILE H . . 4.220 3.460 2.973 3.744 . 0 0 "[ . 1 . 2]" 1
1507 1 84 LEU MD1 1 85 LYS H . . 4.360 3.955 3.309 4.088 . 0 0 "[ . 1 . 2]" 1
1508 1 84 LEU MD2 1 85 LYS H . . 4.360 4.496 4.466 4.556 0.196 7 0 "[ . 1 . 2]" 1
1509 1 84 LEU HG 1 85 LYS H . . 4.940 4.901 4.725 4.967 0.027 15 0 "[ . 1 . 2]" 1
1510 1 85 LYS H 1 85 LYS HB2 . . 3.320 2.069 2.061 2.111 . 0 0 "[ . 1 . 2]" 1
1511 1 85 LYS H 1 85 LYS QB . . 2.780 2.046 2.038 2.076 . 0 0 "[ . 1 . 2]" 1
1512 1 85 LYS H 1 85 LYS HB3 . . 3.320 3.236 3.065 3.323 0.003 8 0 "[ . 1 . 2]" 1
1513 1 85 LYS H 1 85 LYS QG . . 4.470 3.531 3.324 3.924 . 0 0 "[ . 1 . 2]" 1
1514 1 85 LYS H 1 86 GLN H . . 3.550 2.794 2.687 2.856 . 0 0 "[ . 1 . 2]" 1
1515 1 85 LYS HA 1 85 LYS QE . . 4.410 3.875 2.288 4.338 . 0 0 "[ . 1 . 2]" 1
1516 1 85 LYS HA 1 85 LYS QG . . 3.590 2.205 2.045 2.475 . 0 0 "[ . 1 . 2]" 1
1517 1 85 LYS HA 1 87 GLY H . . 4.380 4.114 3.807 4.412 0.032 6 0 "[ . 1 . 2]" 1
1518 1 85 LYS QB 1 85 LYS QD . . 2.980 2.173 1.959 2.479 . 0 0 "[ . 1 . 2]" 1
1519 1 85 LYS QB 1 85 LYS QE . . 4.180 2.933 1.948 3.742 . 0 0 "[ . 1 . 2]" 1
1520 1 85 LYS QB 1 86 GLN H . . 3.330 2.609 2.476 2.919 . 0 0 "[ . 1 . 2]" 1
1521 1 85 LYS QB 1 87 GLY H . . 4.730 4.461 4.303 4.675 . 0 0 "[ . 1 . 2]" 1
1522 1 85 LYS HB2 1 86 GLN H . . 3.830 3.187 2.994 3.507 . 0 0 "[ . 1 . 2]" 1
1523 1 85 LYS HB3 1 86 GLN H . . 3.830 2.782 2.547 3.193 . 0 0 "[ . 1 . 2]" 1
1524 1 85 LYS QD 1 86 GLN H . . 4.910 4.606 3.870 4.864 . 0 0 "[ . 1 . 2]" 1
1525 1 85 LYS QG 1 86 GLN H . . 5.120 4.390 4.254 4.581 . 0 0 "[ . 1 . 2]" 1
1526 1 86 GLN H 1 86 GLN HB2 . . 3.980 2.599 2.509 2.682 . 0 0 "[ . 1 . 2]" 1
1527 1 86 GLN H 1 86 GLN QB . . 3.190 2.541 2.464 2.611 . 0 0 "[ . 1 . 2]" 1
1528 1 86 GLN H 1 86 GLN HB3 . . 3.980 3.598 3.587 3.658 . 0 0 "[ . 1 . 2]" 1
1529 1 86 GLN H 1 86 GLN QE . . 4.670 4.125 3.948 4.321 . 0 0 "[ . 1 . 2]" 1
1530 1 86 GLN H 1 86 GLN HG2 . . 3.610 2.890 2.721 3.291 . 0 0 "[ . 1 . 2]" 1
1531 1 86 GLN H 1 86 GLN QG . . 3.030 2.193 2.047 2.354 . 0 0 "[ . 1 . 2]" 1
1532 1 86 GLN H 1 86 GLN HG3 . . 3.610 2.277 2.103 2.455 . 0 0 "[ . 1 . 2]" 1
1533 1 86 GLN H 1 87 GLY H . . 3.410 2.569 2.227 2.746 . 0 0 "[ . 1 . 2]" 1
1534 1 86 GLN HA 1 86 GLN QE . . 4.890 4.903 4.764 4.974 0.084 9 0 "[ . 1 . 2]" 1
1535 1 86 GLN HA 1 86 GLN HG2 . . 3.720 2.497 2.367 2.622 . 0 0 "[ . 1 . 2]" 1
1536 1 86 GLN HA 1 86 GLN QG . . 3.160 2.440 2.327 2.546 . 0 0 "[ . 1 . 2]" 1
1537 1 86 GLN HA 1 86 GLN HG3 . . 3.720 3.447 3.340 3.509 . 0 0 "[ . 1 . 2]" 1
1538 1 86 GLN QB 1 87 GLY H . . 4.160 2.866 2.582 3.071 . 0 0 "[ . 1 . 2]" 1
1539 1 86 GLN QB 1 88 LYS H . . 5.280 3.212 2.877 3.428 . 0 0 "[ . 1 . 2]" 1
1540 1 86 GLN QB 1 88 LYS QE . . 3.870 2.386 1.876 3.179 . 0 0 "[ . 1 . 2]" 1
1541 1 86 GLN HB2 1 87 GLY H . . 4.920 2.938 2.636 3.156 . 0 0 "[ . 1 . 2]" 1
1542 1 86 GLN HB3 1 87 GLY H . . 4.920 3.989 3.683 4.204 . 0 0 "[ . 1 . 2]" 1
1543 1 86 GLN QE 1 86 GLN QG . . 3.020 2.148 2.085 2.261 . 0 0 "[ . 1 . 2]" 1
1544 1 86 GLN QE 1 88 LYS QE . . 4.790 3.606 2.094 4.793 0.003 19 0 "[ . 1 . 2]" 1
1545 1 86 GLN QG 1 87 GLY H . . 4.140 4.002 3.933 4.112 . 0 0 "[ . 1 . 2]" 1
1546 1 86 GLN HG2 1 87 GLY H . . 4.750 4.792 4.754 4.873 0.123 15 0 "[ . 1 . 2]" 1
1547 1 86 GLN HG3 1 87 GLY H . . 4.750 4.291 4.177 4.473 . 0 0 "[ . 1 . 2]" 1
1548 1 87 GLY H 1 88 LYS H . . 3.200 2.329 2.075 2.523 . 0 0 "[ . 1 . 2]" 1
1549 1 87 GLY H 1 89 ILE H . . 4.380 4.177 3.845 4.396 0.016 17 0 "[ . 1 . 2]" 1
1550 1 88 LYS H 1 88 LYS HB2 . . 3.770 2.590 2.453 3.621 . 0 0 "[ . 1 . 2]" 1
1551 1 88 LYS H 1 88 LYS QB . . 3.160 2.509 2.415 2.910 . 0 0 "[ . 1 . 2]" 1
1552 1 88 LYS H 1 88 LYS HB3 . . 3.770 3.587 3.066 3.640 . 0 0 "[ . 1 . 2]" 1
1553 1 88 LYS H 1 88 LYS HE2 . . 4.360 4.010 3.510 4.374 0.014 19 0 "[ . 1 . 2]" 1
1554 1 88 LYS H 1 88 LYS HE3 . . 4.360 4.282 3.408 4.366 0.006 15 0 "[ . 1 . 2]" 1
1555 1 88 LYS H 1 88 LYS HG2 . . 3.360 2.220 1.854 2.456 . 0 0 "[ . 1 . 2]" 1
1556 1 88 LYS H 1 88 LYS HG3 . . 3.360 3.344 2.754 3.431 0.071 8 0 "[ . 1 . 2]" 1
1557 1 88 LYS H 1 89 ILE H . . 3.180 2.405 2.115 2.449 . 0 0 "[ . 1 . 2]" 1
1558 1 88 LYS HA 1 88 LYS QE . . 4.910 2.681 1.968 4.371 . 0 0 "[ . 1 . 2]" 1
1559 1 88 LYS HA 1 88 LYS QG . . 3.540 2.805 2.613 3.321 . 0 0 "[ . 1 . 2]" 1
1560 1 88 LYS QB 1 89 ILE H . . 3.690 2.776 2.712 3.635 . 0 0 "[ . 1 . 2]" 1
1561 1 88 LYS HB2 1 89 ILE H . . 4.260 2.848 2.768 3.928 . 0 0 "[ . 1 . 2]" 1
1562 1 88 LYS HB3 1 89 ILE H . . 4.260 3.895 3.801 4.285 0.025 6 0 "[ . 1 . 2]" 1
1563 1 88 LYS QE 1 89 ILE H . . 5.340 5.273 4.897 5.349 0.009 16 0 "[ . 1 . 2]" 1
1564 1 88 LYS QG 1 89 ILE H . . 4.140 3.917 2.656 4.089 . 0 0 "[ . 1 . 2]" 1
1565 1 89 ILE H 1 89 ILE HB . . 3.820 2.670 2.565 2.785 . 0 0 "[ . 1 . 2]" 1
1566 1 89 ILE H 1 89 ILE MD . . 3.560 3.286 2.649 3.677 0.117 14 0 "[ . 1 . 2]" 1
1567 1 89 ILE H 1 89 ILE QG . . 4.860 2.339 2.044 2.701 . 0 0 "[ . 1 . 2]" 1
1568 1 89 ILE H 1 89 ILE MG . . 4.020 3.835 3.804 3.863 . 0 0 "[ . 1 . 2]" 1
1569 1 89 ILE HA 1 89 ILE MD . . 3.880 3.893 3.802 3.958 0.078 8 0 "[ . 1 . 2]" 1
1570 1 89 ILE HA 1 89 ILE MG . . 3.560 2.323 2.192 2.378 . 0 0 "[ . 1 . 2]" 1
1571 1 89 ILE HA 1 90 GLU H . . 2.940 2.153 2.139 2.181 . 0 0 "[ . 1 . 2]" 1
1572 1 89 ILE HB 1 89 ILE MD . . 3.350 2.254 2.101 2.398 . 0 0 "[ . 1 . 2]" 1
1573 1 89 ILE HB 1 90 GLU H . . 4.070 4.082 3.967 4.227 0.157 6 0 "[ . 1 . 2]" 1
1574 1 89 ILE HG12 1 90 GLU H . . 5.160 4.749 4.569 4.910 . 0 0 "[ . 1 . 2]" 1
1575 1 89 ILE HG13 1 90 GLU H . . 5.160 4.922 4.624 5.198 0.038 14 0 "[ . 1 . 2]" 1
1576 1 89 ILE MG 1 90 GLU H . . 3.660 2.447 2.216 2.810 . 0 0 "[ . 1 . 2]" 1
1577 1 90 GLU H 1 90 GLU HB2 . . 3.750 2.208 2.184 2.278 . 0 0 "[ . 1 . 2]" 1
1578 1 90 GLU H 1 90 GLU HB3 . . 3.480 3.314 3.284 3.368 . 0 0 "[ . 1 . 2]" 1
1579 1 90 GLU H 1 90 GLU HG2 . . 4.030 4.031 3.944 4.097 0.067 9 0 "[ . 1 . 2]" 1
1580 1 90 GLU H 1 90 GLU HG3 . . 3.910 3.945 3.918 3.986 0.076 19 0 "[ . 1 . 2]" 1
1581 1 90 GLU HA 1 90 GLU HG2 . . 3.920 2.028 2.023 2.037 . 0 0 "[ . 1 . 2]" 1
1582 1 90 GLU HA 1 90 GLU HG3 . . 4.060 3.249 3.194 3.319 . 0 0 "[ . 1 . 2]" 1
1583 1 90 GLU HA 1 91 LEU H . . 2.830 2.263 2.238 2.272 . 0 0 "[ . 1 . 2]" 1
1584 1 90 GLU HA 1 91 LEU QD . . 5.150 3.954 3.546 4.123 . 0 0 "[ . 1 . 2]" 1
1585 1 90 GLU HB2 1 91 LEU H . . 4.200 4.221 4.198 4.270 0.070 6 0 "[ . 1 . 2]" 1
1586 1 90 GLU HB3 1 91 LEU H . . 3.700 3.078 3.017 3.181 . 0 0 "[ . 1 . 2]" 1
1587 1 90 GLU HG2 1 91 LEU H . . 3.820 3.270 3.189 3.369 . 0 0 "[ . 1 . 2]" 1
1588 1 90 GLU HG3 1 91 LEU H . . 4.600 4.654 4.619 4.685 0.085 17 0 "[ . 1 . 2]" 1
1589 1 91 LEU H 1 91 LEU HB2 . . 3.910 2.940 2.583 3.797 . 0 0 "[ . 1 . 2]" 1
1590 1 91 LEU H 1 91 LEU QB . . 3.120 2.742 2.538 3.167 0.047 9 0 "[ . 1 . 2]" 1
1591 1 91 LEU H 1 91 LEU HB3 . . 3.910 3.653 3.326 3.871 . 0 0 "[ . 1 . 2]" 1
1592 1 91 LEU H 1 91 LEU MD1 . . 3.900 3.728 3.213 3.986 0.086 18 0 "[ . 1 . 2]" 1
1593 1 91 LEU H 1 91 LEU QD . . 3.340 3.241 2.952 3.381 0.041 6 0 "[ . 1 . 2]" 1
1594 1 91 LEU H 1 91 LEU MD2 . . 3.900 3.605 3.148 3.931 0.031 11 0 "[ . 1 . 2]" 1
1595 1 91 LEU H 1 91 LEU HG . . 3.700 2.522 1.935 2.744 . 0 0 "[ . 1 . 2]" 1
1596 1 91 LEU HA 1 91 LEU MD1 . . 3.770 3.888 3.791 3.968 0.198 6 0 "[ . 1 . 2]" 1
1597 1 91 LEU HA 1 91 LEU MD2 . . 3.770 2.550 1.974 3.956 0.186 19 0 "[ . 1 . 2]" 1
1598 1 91 LEU HA 1 92 SER H . . 2.850 2.154 2.141 2.206 . 0 0 "[ . 1 . 2]" 1
1599 1 91 LEU QB 1 92 SER H . . 3.660 3.173 2.906 3.249 . 0 0 "[ . 1 . 2]" 1
1600 1 91 LEU HB2 1 92 SER H . . 4.170 3.885 2.994 4.200 0.030 16 0 "[ . 1 . 2]" 1
1601 1 91 LEU HB3 1 92 SER H . . 4.170 3.528 3.345 4.011 . 0 0 "[ . 1 . 2]" 1
1602 1 91 LEU QD 1 92 SER H . . 3.800 3.724 3.536 3.859 0.059 14 0 "[ . 1 . 2]" 1
1603 1 91 LEU QD 1 99 ALA H . . 3.770 3.771 3.491 3.833 0.063 20 0 "[ . 1 . 2]" 1
1604 1 91 LEU QD 1 99 ALA MB . . 4.150 3.529 3.250 3.759 . 0 0 "[ . 1 . 2]" 1
1605 1 92 SER H 1 92 SER HB2 . . 4.030 3.341 3.254 3.399 . 0 0 "[ . 1 . 2]" 1
1606 1 92 SER H 1 92 SER QB . . 3.370 3.077 2.580 3.179 . 0 0 "[ . 1 . 2]" 1
1607 1 92 SER H 1 92 SER HB3 . . 4.030 3.669 2.678 3.824 . 0 0 "[ . 1 . 2]" 1
1608 1 92 SER H 1 98 ALA MB . . 5.020 4.623 4.256 5.000 . 0 0 "[ . 1 . 2]" 1
1609 1 92 SER HA 1 93 GLY H . . 3.150 2.164 2.147 2.313 . 0 0 "[ . 1 . 2]" 1
1610 1 92 SER HB2 1 93 GLY H . . 3.890 3.916 3.789 3.950 0.060 12 0 "[ . 1 . 2]" 1
1611 1 92 SER HB3 1 93 GLY H . . 3.890 3.909 3.885 3.922 0.032 17 0 "[ . 1 . 2]" 1
1612 1 93 GLY H 1 94 ASP H . . 5.500 3.800 3.594 4.028 . 0 0 "[ . 1 . 2]" 1
1613 1 93 GLY QA 1 94 ASP H . . 2.780 2.287 2.208 2.414 . 0 0 "[ . 1 . 2]" 1
1614 1 93 GLY HA2 1 94 ASP H . . 3.480 3.512 3.463 3.558 0.078 11 0 "[ . 1 . 2]" 1
1615 1 93 GLY HA3 1 94 ASP H . . 3.480 2.318 2.234 2.456 . 0 0 "[ . 1 . 2]" 1
1616 1 94 ASP H 1 94 ASP HB2 . . 3.270 2.672 2.524 2.891 . 0 0 "[ . 1 . 2]" 1
1617 1 94 ASP H 1 94 ASP HB3 . . 3.170 3.287 3.230 3.327 0.157 15 0 "[ . 1 . 2]" 1
1618 1 94 ASP H 1 95 ALA H . . 4.050 3.870 3.806 4.009 . 0 0 "[ . 1 . 2]" 1
1619 1 94 ASP HA 1 95 ALA H . . 2.780 2.200 2.160 2.228 . 0 0 "[ . 1 . 2]" 1
1620 1 94 ASP HA 1 95 ALA MB . . 3.910 4.027 3.993 4.069 0.159 12 0 "[ . 1 . 2]" 1
1621 1 94 ASP HA 1 96 ASP H . . 3.720 3.431 3.358 3.525 . 0 0 "[ . 1 . 2]" 1
1622 1 94 ASP HB2 1 95 ALA H . . 4.800 4.651 4.607 4.666 . 0 0 "[ . 1 . 2]" 1
1623 1 94 ASP HB2 1 97 LEU HB2 . . 4.610 3.356 3.226 3.483 . 0 0 "[ . 1 . 2]" 1
1624 1 94 ASP HB2 1 97 LEU HB3 . . 4.610 4.683 4.650 4.702 0.092 15 0 "[ . 1 . 2]" 1
1625 1 94 ASP HB2 1 97 LEU QD . . 4.710 3.363 2.876 4.216 . 0 0 "[ . 1 . 2]" 1
1626 1 94 ASP HB3 1 95 ALA H . . 4.100 4.113 4.005 4.140 0.040 19 0 "[ . 1 . 2]" 1
1627 1 94 ASP HB3 1 97 LEU HB2 . . 4.390 2.032 1.963 2.191 . 0 0 "[ . 1 . 2]" 1
1628 1 94 ASP HB3 1 97 LEU QB . . 3.680 2.021 1.948 2.179 . 0 0 "[ . 1 . 2]" 1
1629 1 94 ASP HB3 1 97 LEU HB3 . . 4.390 3.605 3.267 3.837 . 0 0 "[ . 1 . 2]" 1
1630 1 94 ASP HB3 1 97 LEU QD . . 4.340 2.983 2.707 3.329 . 0 0 "[ . 1 . 2]" 1
1631 1 95 ALA H 1 95 ALA MB . . 2.800 2.167 2.090 2.243 . 0 0 "[ . 1 . 2]" 1
1632 1 95 ALA H 1 96 ASP H . . 3.420 2.663 2.483 2.774 . 0 0 "[ . 1 . 2]" 1
1633 1 95 ALA H 1 96 ASP QB . . 5.080 4.365 4.214 4.474 . 0 0 "[ . 1 . 2]" 1
1634 1 95 ALA H 1 97 LEU H . . 5.250 4.564 4.380 4.698 . 0 0 "[ . 1 . 2]" 1
1635 1 95 ALA HA 1 98 ALA MB . . 3.080 2.868 2.741 3.052 . 0 0 "[ . 1 . 2]" 1
1636 1 95 ALA MB 1 96 ASP H . . 3.070 2.837 2.738 2.961 . 0 0 "[ . 1 . 2]" 1
1637 1 96 ASP H 1 96 ASP HB2 . . 3.300 2.206 2.067 2.353 . 0 0 "[ . 1 . 2]" 1
1638 1 96 ASP H 1 96 ASP QB . . 2.750 2.139 2.046 2.222 . 0 0 "[ . 1 . 2]" 1
1639 1 96 ASP H 1 96 ASP HB3 . . 3.300 2.953 2.729 3.275 . 0 0 "[ . 1 . 2]" 1
1640 1 96 ASP H 1 97 LEU H . . 3.140 2.726 2.638 2.811 . 0 0 "[ . 1 . 2]" 1
1641 1 96 ASP H 1 98 ALA H . . 4.430 4.203 4.008 4.335 . 0 0 "[ . 1 . 2]" 1
1642 1 96 ASP HA 1 98 ALA H . . 4.940 4.564 4.323 4.764 . 0 0 "[ . 1 . 2]" 1
1643 1 96 ASP HA 1 99 ALA H . . 3.840 3.552 3.368 3.868 0.028 20 0 "[ . 1 . 2]" 1
1644 1 96 ASP HA 1 99 ALA MB . . 3.400 2.370 2.127 2.584 . 0 0 "[ . 1 . 2]" 1
1645 1 96 ASP HA 1 100 LYS H . . 4.940 4.006 3.624 4.450 . 0 0 "[ . 1 . 2]" 1
1646 1 96 ASP QB 1 97 LEU H . . 3.000 2.421 2.259 2.742 . 0 0 "[ . 1 . 2]" 1
1647 1 96 ASP HB2 1 97 LEU H . . 3.630 3.409 3.079 3.618 . 0 0 "[ . 1 . 2]" 1
1648 1 96 ASP HB3 1 97 LEU H . . 3.630 2.491 2.284 2.949 . 0 0 "[ . 1 . 2]" 1
1649 1 97 LEU H 1 97 LEU HB2 . . 3.740 2.049 2.041 2.067 . 0 0 "[ . 1 . 2]" 1
1650 1 97 LEU H 1 97 LEU QB . . 3.110 2.031 2.020 2.049 . 0 0 "[ . 1 . 2]" 1
1651 1 97 LEU H 1 97 LEU HB3 . . 3.740 3.303 3.243 3.370 . 0 0 "[ . 1 . 2]" 1
1652 1 97 LEU H 1 97 LEU MD1 . . 4.040 3.918 2.927 4.159 0.119 9 0 "[ . 1 . 2]" 1
1653 1 97 LEU H 1 97 LEU QD . . 3.490 3.332 2.751 3.626 0.136 8 0 "[ . 1 . 2]" 1
1654 1 97 LEU H 1 97 LEU MD2 . . 4.040 3.802 2.793 4.315 0.275 3 0 "[ . 1 . 2]" 1
1655 1 97 LEU H 1 97 LEU HG . . 4.100 3.697 3.323 4.372 0.272 16 0 "[ . 1 . 2]" 1
1656 1 97 LEU H 1 98 ALA H . . 3.390 2.789 2.678 2.863 . 0 0 "[ . 1 . 2]" 1
1657 1 97 LEU HA 1 97 LEU MD1 . . 4.130 3.335 2.196 3.781 . 0 0 "[ . 1 . 2]" 1
1658 1 97 LEU HA 1 97 LEU QD . . 3.240 2.172 1.995 2.671 . 0 0 "[ . 1 . 2]" 1
1659 1 97 LEU HA 1 97 LEU MD2 . . 4.130 2.310 2.106 3.677 . 0 0 "[ . 1 . 2]" 1
1660 1 97 LEU HA 1 97 LEU HG . . 4.220 2.832 2.277 3.635 . 0 0 "[ . 1 . 2]" 1
1661 1 97 LEU HA 1 98 ALA H . . 3.480 3.550 3.525 3.561 0.081 3 0 "[ . 1 . 2]" 1
1662 1 97 LEU QB 1 97 LEU QD . . 2.810 1.925 1.748 2.011 . 0 0 "[ . 1 . 2]" 1
1663 1 97 LEU QB 1 98 ALA H . . 3.640 2.584 2.466 2.718 . 0 0 "[ . 1 . 2]" 1
1664 1 97 LEU QD 1 98 ALA H . . 3.870 3.895 3.861 3.925 0.055 15 0 "[ . 1 . 2]" 1
1665 1 97 LEU MD1 1 98 ALA H . . 4.490 4.442 4.155 4.576 0.086 3 0 "[ . 1 . 2]" 1
1666 1 97 LEU MD2 1 98 ALA H . . 4.490 4.338 4.186 4.600 0.110 16 0 "[ . 1 . 2]" 1
1667 1 98 ALA H 1 98 ALA MB . . 3.460 2.096 2.033 2.215 . 0 0 "[ . 1 . 2]" 1
1668 1 98 ALA H 1 99 ALA H . . 3.180 2.617 2.507 2.746 . 0 0 "[ . 1 . 2]" 1
1669 1 98 ALA HA 1 99 ALA H . . 3.500 3.538 3.482 3.564 0.064 1 0 "[ . 1 . 2]" 1
1670 1 98 ALA HA 1 101 LEU H . . 4.660 3.501 3.280 3.603 . 0 0 "[ . 1 . 2]" 1
1671 1 98 ALA HA 1 101 LEU HB2 . . 4.320 2.880 2.744 3.034 . 0 0 "[ . 1 . 2]" 1
1672 1 98 ALA HA 1 101 LEU QB . . 3.630 2.843 2.716 2.983 . 0 0 "[ . 1 . 2]" 1
1673 1 98 ALA HA 1 101 LEU HB3 . . 4.320 4.378 4.328 4.470 0.150 20 0 "[ . 1 . 2]" 1
1674 1 98 ALA HA 1 101 LEU QD . . 4.590 3.341 3.056 4.161 . 0 0 "[ . 1 . 2]" 1
1675 1 98 ALA HA 1 102 ALA H . . 5.490 4.817 4.533 5.015 . 0 0 "[ . 1 . 2]" 1
1676 1 98 ALA MB 1 99 ALA H . . 3.380 2.599 2.413 2.906 . 0 0 "[ . 1 . 2]" 1
1677 1 99 ALA H 1 99 ALA MB . . 2.860 2.171 2.065 2.220 . 0 0 "[ . 1 . 2]" 1
1678 1 99 ALA H 1 100 LYS H . . 3.210 2.768 2.665 2.865 . 0 0 "[ . 1 . 2]" 1
1679 1 99 ALA HA 1 102 ALA H . . 4.330 3.549 3.330 3.731 . 0 0 "[ . 1 . 2]" 1
1680 1 99 ALA HA 1 102 ALA MB . . 3.170 3.014 2.574 3.225 0.055 6 0 "[ . 1 . 2]" 1
1681 1 99 ALA MB 1 100 LYS H . . 2.990 2.613 2.515 2.829 . 0 0 "[ . 1 . 2]" 1
1682 1 100 LYS H 1 100 LYS HB2 . . 3.660 2.352 2.061 2.634 . 0 0 "[ . 1 . 2]" 1
1683 1 100 LYS H 1 100 LYS QB . . 2.960 2.193 2.040 2.251 . 0 0 "[ . 1 . 2]" 1
1684 1 100 LYS H 1 100 LYS HB3 . . 3.660 2.802 2.432 3.532 . 0 0 "[ . 1 . 2]" 1
1685 1 100 LYS H 1 101 LEU H . . 3.820 2.743 2.538 2.889 . 0 0 "[ . 1 . 2]" 1
1686 1 100 LYS HA 1 100 LYS QE . . 4.780 4.331 2.950 4.779 . 0 0 "[ . 1 . 2]" 1
1687 1 100 LYS HA 1 100 LYS QG . . 3.510 2.392 2.014 3.012 . 0 0 "[ . 1 . 2]" 1
1688 1 100 LYS HA 1 101 LEU H . . 3.460 3.520 3.474 3.562 0.102 19 0 "[ . 1 . 2]" 1
1689 1 100 LYS QB 1 100 LYS QE . . 4.060 3.332 2.412 3.773 . 0 0 "[ . 1 . 2]" 1
1690 1 100 LYS QB 1 101 LEU H . . 3.370 2.666 2.383 2.937 . 0 0 "[ . 1 . 2]" 1
1691 1 100 LYS HB2 1 101 LEU H . . 4.090 3.694 2.751 4.013 . 0 0 "[ . 1 . 2]" 1
1692 1 100 LYS HB3 1 101 LEU H . . 4.090 2.789 2.408 3.367 . 0 0 "[ . 1 . 2]" 1
1693 1 101 LEU H 1 101 LEU HB2 . . 3.710 2.055 2.042 2.082 . 0 0 "[ . 1 . 2]" 1
1694 1 101 LEU H 1 101 LEU QB . . 3.240 2.036 2.023 2.064 . 0 0 "[ . 1 . 2]" 1
1695 1 101 LEU H 1 101 LEU HB3 . . 3.710 3.316 3.246 3.396 . 0 0 "[ . 1 . 2]" 1
1696 1 101 LEU H 1 101 LEU MD1 . . 4.010 3.907 2.893 4.223 0.213 19 0 "[ . 1 . 2]" 1
1697 1 101 LEU H 1 101 LEU QD . . 3.450 3.355 2.582 3.678 0.228 14 0 "[ . 1 . 2]" 1
1698 1 101 LEU H 1 101 LEU MD2 . . 4.010 3.830 2.606 4.108 0.098 4 0 "[ . 1 . 2]" 1
1699 1 101 LEU H 1 101 LEU HG . . 4.270 3.699 3.239 4.415 0.145 20 0 "[ . 1 . 2]" 1
1700 1 101 LEU H 1 102 ALA H . . 3.240 2.817 2.624 2.912 . 0 0 "[ . 1 . 2]" 1
1701 1 101 LEU HA 1 101 LEU MD1 . . 4.410 3.280 1.902 3.777 . 0 0 "[ . 1 . 2]" 1
1702 1 101 LEU HA 1 101 LEU QD . . 3.150 1.992 1.850 2.111 . 0 0 "[ . 1 . 2]" 1
1703 1 101 LEU HA 1 101 LEU MD2 . . 4.410 2.294 1.939 3.778 . 0 0 "[ . 1 . 2]" 1
1704 1 101 LEU HA 1 101 LEU HG . . 4.020 2.819 2.607 3.639 . 0 0 "[ . 1 . 2]" 1
1705 1 101 LEU HA 1 104 VAL H . . 4.080 3.510 3.249 3.673 . 0 0 "[ . 1 . 2]" 1
1706 1 101 LEU HA 1 104 VAL HB . . 4.780 3.748 2.813 4.713 . 0 0 "[ . 1 . 2]" 1
1707 1 101 LEU HA 1 104 VAL QG . . 4.080 2.631 1.892 3.255 . 0 0 "[ . 1 . 2]" 1
1708 1 101 LEU QB 1 102 ALA H . . 3.330 2.474 2.406 2.681 . 0 0 "[ . 1 . 2]" 1
1709 1 101 LEU QB 1 104 VAL QG . . 3.970 3.887 3.491 4.070 0.100 6 0 "[ . 1 . 2]" 1
1710 1 101 LEU HB2 1 102 ALA H . . 4.020 2.912 2.770 3.100 . 0 0 "[ . 1 . 2]" 1
1711 1 101 LEU HB3 1 102 ALA H . . 4.020 2.681 2.567 2.935 . 0 0 "[ . 1 . 2]" 1
1712 1 101 LEU QD 1 104 VAL HB . . 4.000 3.670 2.870 4.123 0.123 20 0 "[ . 1 . 2]" 1
1713 1 101 LEU QD 1 104 VAL QG . . 3.280 2.535 2.064 3.030 . 0 0 "[ . 1 . 2]" 1
1714 1 101 LEU QD 1 105 ILE H . . 5.440 4.526 3.821 5.452 0.012 11 0 "[ . 1 . 2]" 1
1715 1 101 LEU MD1 1 102 ALA H . . 4.250 4.392 4.329 4.516 0.266 5 0 "[ . 1 . 2]" 1
1716 1 101 LEU MD2 1 102 ALA H . . 4.250 4.279 4.120 4.461 0.211 12 0 "[ . 1 . 2]" 1
1717 1 101 LEU HG 1 102 ALA H . . 5.500 4.910 4.722 5.146 . 0 0 "[ . 1 . 2]" 1
1718 1 102 ALA H 1 102 ALA MB . . 2.860 2.103 2.038 2.221 . 0 0 "[ . 1 . 2]" 1
1719 1 102 ALA H 1 103 GLU H . . 3.780 2.818 2.736 2.954 . 0 0 "[ . 1 . 2]" 1
1720 1 102 ALA HA 1 105 ILE HB . . 3.980 2.674 2.269 2.900 . 0 0 "[ . 1 . 2]" 1
1721 1 102 ALA HA 1 105 ILE MD . . 3.930 2.047 1.917 2.797 . 0 0 "[ . 1 . 2]" 1
1722 1 102 ALA HA 1 105 ILE QG . . 4.330 2.895 2.163 4.432 0.102 4 0 "[ . 1 . 2]" 1
1723 1 102 ALA HA 1 105 ILE MG . . 3.890 3.898 3.553 4.069 0.179 12 0 "[ . 1 . 2]" 1
1724 1 102 ALA MB 1 103 GLU H . . 3.520 2.727 2.293 2.903 . 0 0 "[ . 1 . 2]" 1
1725 1 103 GLU H 1 103 GLU QB . . 3.070 2.187 2.042 2.626 . 0 0 "[ . 1 . 2]" 1
1726 1 103 GLU H 1 103 GLU HG2 . . 4.810 4.009 2.088 4.664 . 0 0 "[ . 1 . 2]" 1
1727 1 103 GLU H 1 103 GLU QG . . 4.060 3.425 1.924 4.002 . 0 0 "[ . 1 . 2]" 1
1728 1 103 GLU H 1 103 GLU HG3 . . 4.810 3.863 1.953 4.479 . 0 0 "[ . 1 . 2]" 1
1729 1 103 GLU HA 1 103 GLU QG . . 3.710 2.652 2.090 3.452 . 0 0 "[ . 1 . 2]" 1
1730 1 103 GLU QB 1 104 VAL H . . 3.580 2.753 2.111 3.449 . 0 0 "[ . 1 . 2]" 1
1731 1 103 GLU QG 1 104 VAL H . . 5.130 3.523 2.050 4.469 . 0 0 "[ . 1 . 2]" 1
1732 1 104 VAL H 1 104 VAL HB . . 3.460 2.592 2.272 3.602 0.142 19 0 "[ . 1 . 2]" 1
1733 1 104 VAL H 1 104 VAL MG1 . . 3.810 2.900 2.377 3.785 . 0 0 "[ . 1 . 2]" 1
1734 1 104 VAL H 1 104 VAL QG . . 3.110 2.309 1.826 2.594 . 0 0 "[ . 1 . 2]" 1
1735 1 104 VAL H 1 104 VAL MG2 . . 3.810 3.051 1.888 3.762 . 0 0 "[ . 1 . 2]" 1
1736 1 104 VAL H 1 105 ILE H . . 4.000 2.512 2.388 2.743 . 0 0 "[ . 1 . 2]" 1
1737 1 104 VAL HB 1 105 ILE H . . 4.670 3.595 2.617 4.045 . 0 0 "[ . 1 . 2]" 1
1738 1 104 VAL QG 1 105 ILE H . . 4.200 2.575 2.204 3.402 . 0 0 "[ . 1 . 2]" 1
1739 1 104 VAL MG1 1 105 ILE H . . 5.210 2.930 2.213 4.160 . 0 0 "[ . 1 . 2]" 1
1740 1 104 VAL MG2 1 105 ILE H . . 5.210 3.813 2.313 4.189 . 0 0 "[ . 1 . 2]" 1
1741 1 105 ILE H 1 105 ILE HB . . 3.930 2.477 2.190 2.664 . 0 0 "[ . 1 . 2]" 1
1742 1 105 ILE H 1 105 ILE MG . . 4.070 3.712 2.804 3.795 . 0 0 "[ . 1 . 2]" 1
1743 1 105 ILE HA 1 105 ILE QG . . 3.640 2.385 2.071 2.528 . 0 0 "[ . 1 . 2]" 1
1744 1 105 ILE HA 1 105 ILE MG . . 3.680 2.421 2.251 3.137 . 0 0 "[ . 1 . 2]" 1
1745 1 105 ILE HB 1 105 ILE MD . . 3.450 2.308 2.028 2.452 . 0 0 "[ . 1 . 2]" 1
1746 1 105 ILE MD 1 105 ILE MG . . 3.260 2.111 1.918 2.940 . 0 0 "[ . 1 . 2]" 1
1747 1 105 ILE QG 1 106 HIS H . . 4.940 4.092 3.707 4.355 . 0 0 "[ . 1 . 2]" 1
1748 1 105 ILE MG 1 106 HIS H . . 3.580 3.456 2.249 3.587 0.007 18 0 "[ . 1 . 2]" 1
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