NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
454318 |
2yuo   |
10194 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2yuo
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 1435
_Distance_constraint_stats_list.Viol_count 142
_Distance_constraint_stats_list.Viol_total 11.677
_Distance_constraint_stats_list.Viol_max 0.030
_Distance_constraint_stats_list.Viol_rms 0.0005
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0000
_Distance_constraint_stats_list.Viol_average_violations_only 0.0041
_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 7 GLY 0.001 0.001 20 0 "[ . 1 . 2]"
1 8 ARG 0.003 0.002 20 0 "[ . 1 . 2]"
1 9 ARG 0.008 0.006 14 0 "[ . 1 . 2]"
1 10 ALA 0.012 0.006 14 0 "[ . 1 . 2]"
1 11 LYS 0.000 0.000 17 0 "[ . 1 . 2]"
1 12 ALA 0.002 0.001 13 0 "[ . 1 . 2]"
1 13 LEU 0.002 0.001 19 0 "[ . 1 . 2]"
1 14 LEU 0.006 0.006 15 0 "[ . 1 . 2]"
1 15 ASP 0.009 0.006 15 0 "[ . 1 . 2]"
1 16 PHE 0.002 0.001 13 0 "[ . 1 . 2]"
1 17 GLU 0.062 0.028 18 0 "[ . 1 . 2]"
1 18 ARG 0.034 0.027 14 0 "[ . 1 . 2]"
1 19 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 20 ASP 0.000 0.000 16 0 "[ . 1 . 2]"
1 21 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 22 ASP 0.000 0.000 13 0 "[ . 1 . 2]"
1 23 GLU 0.004 0.002 12 0 "[ . 1 . 2]"
1 24 LEU 0.013 0.003 13 0 "[ . 1 . 2]"
1 25 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 26 PHE 0.013 0.005 20 0 "[ . 1 . 2]"
1 27 ARG 0.039 0.022 16 0 "[ . 1 . 2]"
1 28 LYS 0.006 0.005 16 0 "[ . 1 . 2]"
1 29 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 30 ASP 0.001 0.001 17 0 "[ . 1 . 2]"
1 31 ILE 0.002 0.001 17 0 "[ . 1 . 2]"
1 32 ILE 0.008 0.003 13 0 "[ . 1 . 2]"
1 33 THR 0.004 0.002 17 0 "[ . 1 . 2]"
1 34 ILE 0.005 0.003 17 0 "[ . 1 . 2]"
1 35 ILE 0.017 0.007 17 0 "[ . 1 . 2]"
1 36 SER 0.011 0.007 17 0 "[ . 1 . 2]"
1 37 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 38 LYS 0.004 0.003 17 0 "[ . 1 . 2]"
1 39 ASP 0.001 0.001 18 0 "[ . 1 . 2]"
1 40 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 41 HIS 0.001 0.001 17 0 "[ . 1 . 2]"
1 42 CYS 0.025 0.018 13 0 "[ . 1 . 2]"
1 43 TRP 0.020 0.007 13 0 "[ . 1 . 2]"
1 44 VAL 0.015 0.007 13 0 "[ . 1 . 2]"
1 45 GLY 0.005 0.004 17 0 "[ . 1 . 2]"
1 46 GLU 0.032 0.026 16 0 "[ . 1 . 2]"
1 47 LEU 0.006 0.002 15 0 "[ . 1 . 2]"
1 48 ASN 0.001 0.001 16 0 "[ . 1 . 2]"
1 49 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 50 LEU 0.005 0.003 16 0 "[ . 1 . 2]"
1 51 ARG 0.038 0.026 16 0 "[ . 1 . 2]"
1 52 GLY 0.005 0.002 16 0 "[ . 1 . 2]"
1 53 TRP 0.027 0.018 13 0 "[ . 1 . 2]"
1 54 PHE 0.008 0.002 19 0 "[ . 1 . 2]"
1 55 PRO 0.000 0.000 20 0 "[ . 1 . 2]"
1 56 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 57 LYS 0.010 0.006 15 0 "[ . 1 . 2]"
1 58 PHE 0.003 0.001 19 0 "[ . 1 . 2]"
1 59 VAL 0.004 0.002 19 0 "[ . 1 . 2]"
1 60 GLU 0.000 0.000 16 0 "[ . 1 . 2]"
1 61 VAL 0.236 0.025 11 0 "[ . 1 . 2]"
1 62 LEU 0.246 0.025 11 0 "[ . 1 . 2]"
1 63 ASP 0.002 0.002 16 0 "[ . 1 . 2]"
1 64 GLU 0.002 0.001 7 0 "[ . 1 . 2]"
1 65 ARG 0.044 0.030 12 0 "[ . 1 . 2]"
1 66 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 67 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 68 GLU 0.015 0.013 15 0 "[ . 1 . 2]"
1 69 TYR 0.016 0.013 15 0 "[ . 1 . 2]"
1 70 SER 0.010 0.004 19 0 "[ . 1 . 2]"
1 71 ILE 0.010 0.004 19 0 "[ . 1 . 2]"
1 74 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 75 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 7 GLY QA 1 8 ARG H . . 3.110 2.161 2.109 2.269 . 0 0 "[ . 1 . 2]" 1
2 1 7 GLY QA 1 33 THR MG . . 4.020 3.758 3.262 4.021 0.001 20 0 "[ . 1 . 2]" 1
3 1 7 GLY HA2 1 33 THR MG . . 4.760 4.348 3.469 4.760 . 0 0 "[ . 1 . 2]" 1
4 1 7 GLY HA3 1 33 THR MG . . 4.760 4.261 3.322 4.742 . 0 0 "[ . 1 . 2]" 1
5 1 8 ARG H 1 8 ARG HB2 . . 4.080 2.550 2.356 2.915 . 0 0 "[ . 1 . 2]" 1
6 1 8 ARG H 1 8 ARG QB . . 3.210 2.468 2.326 2.640 . 0 0 "[ . 1 . 2]" 1
7 1 8 ARG H 1 8 ARG HB3 . . 4.080 3.494 2.865 3.704 . 0 0 "[ . 1 . 2]" 1
8 1 8 ARG H 1 8 ARG HD2 . . 5.500 4.962 4.690 5.416 . 0 0 "[ . 1 . 2]" 1
9 1 8 ARG H 1 8 ARG HD3 . . 5.500 5.416 5.111 5.500 0.000 17 0 "[ . 1 . 2]" 1
10 1 8 ARG H 1 8 ARG QG . . 4.320 3.536 3.197 4.178 . 0 0 "[ . 1 . 2]" 1
11 1 8 ARG H 1 9 ARG H . . 4.530 4.461 4.386 4.528 . 0 0 "[ . 1 . 2]" 1
12 1 8 ARG H 1 9 ARG QG . . 4.310 4.279 4.166 4.312 0.002 20 0 "[ . 1 . 2]" 1
13 1 8 ARG H 1 33 THR MG . . 4.640 3.675 3.140 4.179 . 0 0 "[ . 1 . 2]" 1
14 1 8 ARG H 1 34 ILE H . . 4.760 3.496 2.926 3.961 . 0 0 "[ . 1 . 2]" 1
15 1 8 ARG H 1 34 ILE HB . . 4.230 2.963 2.655 3.422 . 0 0 "[ . 1 . 2]" 1
16 1 8 ARG HA 1 8 ARG HD2 . . 5.480 4.455 3.907 4.673 . 0 0 "[ . 1 . 2]" 1
17 1 8 ARG HA 1 8 ARG QD . . 4.740 3.903 3.689 4.075 . 0 0 "[ . 1 . 2]" 1
18 1 8 ARG HA 1 8 ARG HD3 . . 5.480 4.379 3.925 4.688 . 0 0 "[ . 1 . 2]" 1
19 1 8 ARG HA 1 8 ARG QG . . 3.840 2.245 2.142 2.329 . 0 0 "[ . 1 . 2]" 1
20 1 8 ARG HA 1 9 ARG H . . 2.860 2.477 2.210 2.626 . 0 0 "[ . 1 . 2]" 1
21 1 8 ARG HA 1 9 ARG QG . . 3.900 3.444 3.225 3.681 . 0 0 "[ . 1 . 2]" 1
22 1 8 ARG HA 1 34 ILE MD . . 4.990 4.617 4.116 4.984 . 0 0 "[ . 1 . 2]" 1
23 1 8 ARG QB 1 9 ARG H . . 3.490 2.425 1.974 3.490 . 0 0 "[ . 1 . 2]" 1
24 1 8 ARG QB 1 34 ILE MD . . 3.610 2.329 1.934 2.691 . 0 0 "[ . 1 . 2]" 1
25 1 8 ARG QB 1 34 ILE QG . . 5.180 3.212 2.603 3.593 . 0 0 "[ . 1 . 2]" 1
26 1 8 ARG QB 1 61 VAL QG . . 3.980 3.584 3.342 3.980 0.000 20 0 "[ . 1 . 2]" 1
27 1 8 ARG HB2 1 34 ILE MG . . 4.930 3.359 2.919 4.226 . 0 0 "[ . 1 . 2]" 1
28 1 8 ARG HB3 1 34 ILE MG . . 4.930 3.882 2.832 4.519 . 0 0 "[ . 1 . 2]" 1
29 1 8 ARG QD 1 34 ILE MD . . 4.800 2.982 2.250 3.406 . 0 0 "[ . 1 . 2]" 1
30 1 8 ARG QD 1 61 VAL QG . . 3.950 2.825 2.336 3.548 . 0 0 "[ . 1 . 2]" 1
31 1 8 ARG HD2 1 9 ARG H . . 5.500 5.012 4.508 5.439 . 0 0 "[ . 1 . 2]" 1
32 1 8 ARG HD2 1 34 ILE MD . . 5.500 3.582 2.862 4.303 . 0 0 "[ . 1 . 2]" 1
33 1 8 ARG HD2 1 34 ILE MG . . 5.500 4.297 3.474 5.419 . 0 0 "[ . 1 . 2]" 1
34 1 8 ARG HD2 1 61 VAL MG1 . . 5.500 3.916 3.378 4.743 . 0 0 "[ . 1 . 2]" 1
35 1 8 ARG HD2 1 61 VAL MG2 . . 5.500 5.050 4.448 5.499 . 0 0 "[ . 1 . 2]" 1
36 1 8 ARG HD3 1 9 ARG H . . 5.500 4.462 3.482 5.491 . 0 0 "[ . 1 . 2]" 1
37 1 8 ARG HD3 1 34 ILE MD . . 5.500 3.473 2.290 4.498 . 0 0 "[ . 1 . 2]" 1
38 1 8 ARG HD3 1 34 ILE MG . . 5.500 4.733 3.630 5.370 . 0 0 "[ . 1 . 2]" 1
39 1 8 ARG HD3 1 61 VAL MG1 . . 5.500 3.072 2.411 4.251 . 0 0 "[ . 1 . 2]" 1
40 1 8 ARG HD3 1 61 VAL MG2 . . 5.500 4.398 3.452 5.499 . 0 0 "[ . 1 . 2]" 1
41 1 8 ARG QG 1 9 ARG H . . 3.480 3.098 1.830 3.468 . 0 0 "[ . 1 . 2]" 1
42 1 8 ARG QG 1 34 ILE MD . . 5.500 3.776 2.341 4.394 . 0 0 "[ . 1 . 2]" 1
43 1 9 ARG H 1 9 ARG QB . . 3.490 2.792 2.682 2.849 . 0 0 "[ . 1 . 2]" 1
44 1 9 ARG H 1 9 ARG QG . . 3.580 3.138 2.933 3.304 . 0 0 "[ . 1 . 2]" 1
45 1 9 ARG H 1 10 ALA H . . 4.690 4.255 4.158 4.356 . 0 0 "[ . 1 . 2]" 1
46 1 9 ARG H 1 10 ALA MB . . 4.820 4.746 4.596 4.812 . 0 0 "[ . 1 . 2]" 1
47 1 9 ARG H 1 34 ILE MD . . 4.490 3.557 3.343 3.928 . 0 0 "[ . 1 . 2]" 1
48 1 9 ARG H 1 61 VAL QG . . 4.510 4.028 3.786 4.438 . 0 0 "[ . 1 . 2]" 1
49 1 9 ARG HA 1 9 ARG HD2 . . 4.560 4.246 3.855 4.557 . 0 0 "[ . 1 . 2]" 1
50 1 9 ARG HA 1 9 ARG QD . . 3.980 3.775 3.638 3.980 . 0 0 "[ . 1 . 2]" 1
51 1 9 ARG HA 1 9 ARG HD3 . . 4.560 4.308 3.885 4.550 . 0 0 "[ . 1 . 2]" 1
52 1 9 ARG HA 1 9 ARG HG2 . . 3.990 2.464 2.375 2.612 . 0 0 "[ . 1 . 2]" 1
53 1 9 ARG HA 1 9 ARG QG . . 3.360 2.402 2.332 2.509 . 0 0 "[ . 1 . 2]" 1
54 1 9 ARG HA 1 9 ARG HG3 . . 3.990 3.351 3.152 3.493 . 0 0 "[ . 1 . 2]" 1
55 1 9 ARG HA 1 10 ALA H . . 2.940 2.181 2.152 2.258 . 0 0 "[ . 1 . 2]" 1
56 1 9 ARG HA 1 10 ALA MB . . 3.940 3.894 3.805 3.946 0.006 14 0 "[ . 1 . 2]" 1
57 1 9 ARG HA 1 31 ILE MG . . 4.180 3.954 3.619 4.132 . 0 0 "[ . 1 . 2]" 1
58 1 9 ARG HA 1 33 THR HA . . 3.430 2.649 2.225 2.950 . 0 0 "[ . 1 . 2]" 1
59 1 9 ARG HA 1 33 THR MG . . 4.480 4.210 3.843 4.480 0.000 19 0 "[ . 1 . 2]" 1
60 1 9 ARG HA 1 34 ILE H . . 3.720 2.793 2.370 3.124 . 0 0 "[ . 1 . 2]" 1
61 1 9 ARG HA 1 34 ILE MD . . 4.570 3.565 3.229 3.981 . 0 0 "[ . 1 . 2]" 1
62 1 9 ARG HA 1 34 ILE HG12 . . 4.780 4.178 3.741 4.498 . 0 0 "[ . 1 . 2]" 1
63 1 9 ARG HA 1 34 ILE HG13 . . 4.780 2.566 2.196 2.790 . 0 0 "[ . 1 . 2]" 1
64 1 9 ARG QB 1 9 ARG QD . . 3.010 2.095 2.043 2.131 . 0 0 "[ . 1 . 2]" 1
65 1 9 ARG QB 1 10 ALA H . . 3.360 3.035 2.752 3.168 . 0 0 "[ . 1 . 2]" 1
66 1 9 ARG QB 1 31 ILE MG . . 2.900 2.268 2.037 2.400 . 0 0 "[ . 1 . 2]" 1
67 1 9 ARG HB2 1 10 ALA H . . 4.170 4.085 3.852 4.170 0.000 4 0 "[ . 1 . 2]" 1
68 1 9 ARG HB2 1 31 ILE MG . . 3.650 3.455 3.208 3.649 . 0 0 "[ . 1 . 2]" 1
69 1 9 ARG HB3 1 10 ALA H . . 4.170 3.131 2.817 3.284 . 0 0 "[ . 1 . 2]" 1
70 1 9 ARG HB3 1 31 ILE MG . . 3.650 2.300 2.059 2.443 . 0 0 "[ . 1 . 2]" 1
71 1 9 ARG QD 1 31 ILE MG . . 3.140 2.212 1.870 2.603 . 0 0 "[ . 1 . 2]" 1
72 1 9 ARG QD 1 33 THR HA . . 4.860 3.547 2.924 4.119 . 0 0 "[ . 1 . 2]" 1
73 1 9 ARG QD 1 33 THR MG . . 4.580 4.076 3.381 4.576 . 0 0 "[ . 1 . 2]" 1
74 1 9 ARG HD2 1 31 ILE MG . . 3.660 2.489 1.886 3.135 . 0 0 "[ . 1 . 2]" 1
75 1 9 ARG HD3 1 31 ILE MG . . 3.660 2.902 2.259 3.601 . 0 0 "[ . 1 . 2]" 1
76 1 9 ARG QG 1 31 ILE MG . . 4.320 3.556 3.246 3.806 . 0 0 "[ . 1 . 2]" 1
77 1 9 ARG QG 1 33 THR HA . . 3.890 2.328 1.993 2.727 . 0 0 "[ . 1 . 2]" 1
78 1 9 ARG QG 1 33 THR MG . . 4.870 3.230 2.749 3.410 . 0 0 "[ . 1 . 2]" 1
79 1 9 ARG HG2 1 10 ALA H . . 5.500 4.368 4.165 4.498 . 0 0 "[ . 1 . 2]" 1
80 1 9 ARG HG2 1 31 ILE MG . . 5.000 3.790 3.375 4.127 . 0 0 "[ . 1 . 2]" 1
81 1 9 ARG HG2 1 33 THR HA . . 4.760 2.343 2.001 2.751 . 0 0 "[ . 1 . 2]" 1
82 1 9 ARG HG3 1 10 ALA H . . 5.500 5.247 5.118 5.356 . 0 0 "[ . 1 . 2]" 1
83 1 9 ARG HG3 1 31 ILE MG . . 5.000 4.327 4.106 4.519 . 0 0 "[ . 1 . 2]" 1
84 1 9 ARG HG3 1 33 THR HA . . 4.760 4.019 3.619 4.461 . 0 0 "[ . 1 . 2]" 1
85 1 10 ALA H 1 10 ALA MB . . 3.330 2.407 2.288 2.538 . 0 0 "[ . 1 . 2]" 1
86 1 10 ALA H 1 31 ILE MG . . 4.190 3.709 3.474 4.074 . 0 0 "[ . 1 . 2]" 1
87 1 10 ALA H 1 32 ILE HB . . 4.110 3.644 3.437 3.932 . 0 0 "[ . 1 . 2]" 1
88 1 10 ALA H 1 32 ILE MG . . 5.010 4.424 4.226 4.683 . 0 0 "[ . 1 . 2]" 1
89 1 10 ALA H 1 34 ILE MD . . 4.460 3.472 3.173 3.866 . 0 0 "[ . 1 . 2]" 1
90 1 10 ALA H 1 34 ILE QG . . 4.490 2.910 2.652 3.376 . 0 0 "[ . 1 . 2]" 1
91 1 10 ALA H 1 62 LEU MD1 . . 4.490 3.596 3.246 3.975 . 0 0 "[ . 1 . 2]" 1
92 1 10 ALA H 1 62 LEU HG . . 5.500 4.718 4.396 4.941 . 0 0 "[ . 1 . 2]" 1
93 1 10 ALA HA 1 11 LYS H . . 2.920 2.237 2.152 2.413 . 0 0 "[ . 1 . 2]" 1
94 1 10 ALA HA 1 34 ILE MD . . 4.910 3.842 3.467 4.289 . 0 0 "[ . 1 . 2]" 1
95 1 10 ALA HA 1 59 VAL MG2 . . 4.900 4.088 3.696 4.316 . 0 0 "[ . 1 . 2]" 1
96 1 10 ALA HA 1 60 GLU H . . 4.930 4.256 4.024 4.741 . 0 0 "[ . 1 . 2]" 1
97 1 10 ALA HA 1 61 VAL HA . . 3.060 2.706 2.558 2.915 . 0 0 "[ . 1 . 2]" 1
98 1 10 ALA HA 1 61 VAL MG1 . . 4.610 4.185 4.023 4.333 . 0 0 "[ . 1 . 2]" 1
99 1 10 ALA HA 1 61 VAL QG . . 4.020 3.827 3.700 3.947 . 0 0 "[ . 1 . 2]" 1
100 1 10 ALA HA 1 61 VAL MG2 . . 4.610 4.436 4.317 4.574 . 0 0 "[ . 1 . 2]" 1
101 1 10 ALA HA 1 62 LEU H . . 3.420 3.366 3.122 3.423 0.003 12 0 "[ . 1 . 2]" 1
102 1 10 ALA HA 1 62 LEU HB2 . . 4.560 4.347 4.159 4.553 . 0 0 "[ . 1 . 2]" 1
103 1 10 ALA HA 1 62 LEU HB3 . . 5.350 5.148 4.943 5.325 . 0 0 "[ . 1 . 2]" 1
104 1 10 ALA HA 1 62 LEU MD1 . . 4.110 2.594 2.316 2.889 . 0 0 "[ . 1 . 2]" 1
105 1 10 ALA HA 1 62 LEU MD2 . . 4.100 3.493 3.281 3.642 . 0 0 "[ . 1 . 2]" 1
106 1 10 ALA HA 1 62 LEU HG . . 3.550 2.231 2.004 2.415 . 0 0 "[ . 1 . 2]" 1
107 1 10 ALA MB 1 11 LYS H . . 3.340 2.842 2.440 3.149 . 0 0 "[ . 1 . 2]" 1
108 1 10 ALA MB 1 32 ILE H . . 4.350 4.017 3.728 4.271 . 0 0 "[ . 1 . 2]" 1
109 1 10 ALA MB 1 32 ILE MD . . 4.190 3.907 3.648 4.146 . 0 0 "[ . 1 . 2]" 1
110 1 10 ALA MB 1 32 ILE MG . . 4.730 4.330 4.063 4.720 . 0 0 "[ . 1 . 2]" 1
111 1 10 ALA MB 1 34 ILE MD . . 2.900 2.333 1.933 2.669 . 0 0 "[ . 1 . 2]" 1
112 1 10 ALA MB 1 43 TRP HE3 . . 4.420 3.559 3.253 3.802 . 0 0 "[ . 1 . 2]" 1
113 1 10 ALA MB 1 43 TRP HZ3 . . 4.170 3.274 2.989 3.526 . 0 0 "[ . 1 . 2]" 1
114 1 10 ALA MB 1 54 PHE QD . . 5.500 5.289 4.946 5.501 0.001 19 0 "[ . 1 . 2]" 1
115 1 10 ALA MB 1 54 PHE QE . . 4.300 3.626 3.338 3.845 . 0 0 "[ . 1 . 2]" 1
116 1 10 ALA MB 1 59 VAL H . . 5.500 4.911 4.646 5.093 . 0 0 "[ . 1 . 2]" 1
117 1 10 ALA MB 1 59 VAL HA . . 4.570 4.404 4.165 4.567 . 0 0 "[ . 1 . 2]" 1
118 1 10 ALA MB 1 59 VAL HB . . 2.930 2.445 2.170 2.769 . 0 0 "[ . 1 . 2]" 1
119 1 10 ALA MB 1 59 VAL MG1 . . 3.390 3.180 2.942 3.389 . 0 0 "[ . 1 . 2]" 1
120 1 10 ALA MB 1 60 GLU H . . 3.660 3.084 2.765 3.302 . 0 0 "[ . 1 . 2]" 1
121 1 10 ALA MB 1 61 VAL HA . . 3.140 2.668 2.357 3.106 . 0 0 "[ . 1 . 2]" 1
122 1 10 ALA MB 1 62 LEU H . . 4.520 4.125 3.979 4.327 . 0 0 "[ . 1 . 2]" 1
123 1 10 ALA MB 1 62 LEU HG . . 4.700 3.815 3.631 4.027 . 0 0 "[ . 1 . 2]" 1
124 1 11 LYS H 1 11 LYS HB2 . . 3.520 2.800 2.576 3.014 . 0 0 "[ . 1 . 2]" 1
125 1 11 LYS H 1 11 LYS QB . . 3.000 2.351 2.242 2.476 . 0 0 "[ . 1 . 2]" 1
126 1 11 LYS H 1 11 LYS HB3 . . 3.520 2.544 2.340 2.703 . 0 0 "[ . 1 . 2]" 1
127 1 11 LYS H 1 11 LYS QG . . 4.180 4.042 3.915 4.148 . 0 0 "[ . 1 . 2]" 1
128 1 11 LYS H 1 31 ILE MD . . 4.620 4.261 3.728 4.610 . 0 0 "[ . 1 . 2]" 1
129 1 11 LYS H 1 31 ILE MG . . 5.500 5.217 4.915 5.495 . 0 0 "[ . 1 . 2]" 1
130 1 11 LYS H 1 59 VAL HA . . 5.340 5.020 4.643 5.337 . 0 0 "[ . 1 . 2]" 1
131 1 11 LYS H 1 59 VAL HB . . 4.440 3.615 3.181 3.981 . 0 0 "[ . 1 . 2]" 1
132 1 11 LYS H 1 59 VAL MG2 . . 4.620 4.116 3.523 4.565 . 0 0 "[ . 1 . 2]" 1
133 1 11 LYS H 1 60 GLU H . . 3.530 2.793 2.483 3.174 . 0 0 "[ . 1 . 2]" 1
134 1 11 LYS H 1 60 GLU QB . . 4.180 3.433 3.209 3.866 . 0 0 "[ . 1 . 2]" 1
135 1 11 LYS H 1 61 VAL HA . . 4.110 4.017 3.868 4.107 . 0 0 "[ . 1 . 2]" 1
136 1 11 LYS H 1 62 LEU MD1 . . 4.110 2.759 2.254 3.574 . 0 0 "[ . 1 . 2]" 1
137 1 11 LYS H 1 62 LEU MD2 . . 3.780 2.698 2.297 3.055 . 0 0 "[ . 1 . 2]" 1
138 1 11 LYS H 1 62 LEU HG . . 3.610 2.847 2.441 3.333 . 0 0 "[ . 1 . 2]" 1
139 1 11 LYS HA 1 11 LYS QG . . 3.550 2.451 2.323 2.560 . 0 0 "[ . 1 . 2]" 1
140 1 11 LYS HA 1 12 ALA H . . 2.830 2.158 2.146 2.178 . 0 0 "[ . 1 . 2]" 1
141 1 11 LYS HA 1 12 ALA HA . . 4.940 4.362 4.349 4.370 . 0 0 "[ . 1 . 2]" 1
142 1 11 LYS HA 1 12 ALA MB . . 4.180 3.978 3.927 4.000 . 0 0 "[ . 1 . 2]" 1
143 1 11 LYS HA 1 31 ILE MD . . 3.290 2.626 2.267 2.836 . 0 0 "[ . 1 . 2]" 1
144 1 11 LYS HA 1 31 ILE HG12 . . 4.920 4.727 4.439 4.908 . 0 0 "[ . 1 . 2]" 1
145 1 11 LYS HA 1 31 ILE MG . . 4.490 4.082 3.820 4.325 . 0 0 "[ . 1 . 2]" 1
146 1 11 LYS HA 1 32 ILE H . . 4.220 3.704 3.502 4.040 . 0 0 "[ . 1 . 2]" 1
147 1 11 LYS HA 1 32 ILE MD . . 5.030 4.639 4.355 4.901 . 0 0 "[ . 1 . 2]" 1
148 1 11 LYS QB 1 11 LYS QE . . 3.900 2.219 1.985 3.111 . 0 0 "[ . 1 . 2]" 1
149 1 11 LYS QB 1 62 LEU MD1 . . 3.110 2.201 1.934 2.474 . 0 0 "[ . 1 . 2]" 1
150 1 11 LYS QB 1 62 LEU MD2 . . 2.950 1.921 1.830 2.112 . 0 0 "[ . 1 . 2]" 1
151 1 11 LYS HB2 1 62 LEU MD2 . . 3.390 2.047 1.978 2.340 . 0 0 "[ . 1 . 2]" 1
152 1 11 LYS HB3 1 62 LEU MD2 . . 3.390 2.394 1.957 2.909 . 0 0 "[ . 1 . 2]" 1
153 1 11 LYS QD 1 13 LEU MD2 . . 5.330 3.859 2.470 4.844 . 0 0 "[ . 1 . 2]" 1
154 1 11 LYS QD 1 29 ASN H . . 5.340 4.548 2.995 5.212 . 0 0 "[ . 1 . 2]" 1
155 1 11 LYS QD 1 29 ASN HA . . 3.810 2.970 2.002 3.509 . 0 0 "[ . 1 . 2]" 1
156 1 11 LYS QD 1 29 ASN QB . . 4.540 4.107 3.393 4.491 . 0 0 "[ . 1 . 2]" 1
157 1 11 LYS QD 1 62 LEU MD2 . . 4.630 3.327 2.764 4.397 . 0 0 "[ . 1 . 2]" 1
158 1 11 LYS HD2 1 31 ILE MD . . 4.470 4.093 3.675 4.464 . 0 0 "[ . 1 . 2]" 1
159 1 11 LYS HD2 1 62 LEU MD2 . . 5.500 4.498 4.290 4.674 . 0 0 "[ . 1 . 2]" 1
160 1 11 LYS HD3 1 31 ILE MD . . 4.470 3.911 2.921 4.435 . 0 0 "[ . 1 . 2]" 1
161 1 11 LYS HD3 1 62 LEU MD2 . . 5.500 3.610 2.798 5.355 . 0 0 "[ . 1 . 2]" 1
162 1 11 LYS QE 1 11 LYS QG . . 3.320 2.363 2.075 2.592 . 0 0 "[ . 1 . 2]" 1
163 1 11 LYS QE 1 13 LEU MD2 . . 3.660 2.432 1.968 3.244 . 0 0 "[ . 1 . 2]" 1
164 1 11 LYS QE 1 29 ASN HA . . 4.580 4.070 3.390 4.390 . 0 0 "[ . 1 . 2]" 1
165 1 11 LYS QE 1 60 GLU QB . . 4.250 3.307 2.640 3.840 . 0 0 "[ . 1 . 2]" 1
166 1 11 LYS QE 1 62 LEU MD2 . . 4.090 3.506 2.733 4.049 . 0 0 "[ . 1 . 2]" 1
167 1 11 LYS HE2 1 11 LYS QG . . 3.790 2.970 2.162 3.442 . 0 0 "[ . 1 . 2]" 1
168 1 11 LYS HE2 1 13 LEU MD2 . . 4.380 3.196 2.357 4.318 . 0 0 "[ . 1 . 2]" 1
169 1 11 LYS HE2 1 60 GLU QB . . 4.840 4.063 2.680 4.818 . 0 0 "[ . 1 . 2]" 1
170 1 11 LYS HE3 1 11 LYS QG . . 3.790 2.694 2.121 3.459 . 0 0 "[ . 1 . 2]" 1
171 1 11 LYS HE3 1 13 LEU MD2 . . 4.380 2.595 1.988 3.467 . 0 0 "[ . 1 . 2]" 1
172 1 11 LYS HE3 1 60 GLU QB . . 4.840 3.756 2.949 4.697 . 0 0 "[ . 1 . 2]" 1
173 1 11 LYS QG 1 12 ALA H . . 3.580 2.668 2.471 2.845 . 0 0 "[ . 1 . 2]" 1
174 1 11 LYS QG 1 13 LEU MD2 . . 4.360 4.041 3.292 4.352 . 0 0 "[ . 1 . 2]" 1
175 1 11 LYS QG 1 29 ASN H . . 4.550 3.986 3.723 4.432 . 0 0 "[ . 1 . 2]" 1
176 1 11 LYS QG 1 29 ASN HA . . 3.310 2.749 2.346 3.014 . 0 0 "[ . 1 . 2]" 1
177 1 11 LYS QG 1 31 ILE MD . . 3.780 2.383 1.966 2.859 . 0 0 "[ . 1 . 2]" 1
178 1 11 LYS QG 1 62 LEU MD1 . . 4.030 3.765 3.259 4.029 . 0 0 "[ . 1 . 2]" 1
179 1 11 LYS QG 1 62 LEU MD2 . . 3.790 3.637 3.245 3.790 0.000 17 0 "[ . 1 . 2]" 1
180 1 12 ALA H 1 12 ALA MB . . 2.910 2.182 2.054 2.251 . 0 0 "[ . 1 . 2]" 1
181 1 12 ALA H 1 13 LEU H . . 4.940 4.454 4.298 4.584 . 0 0 "[ . 1 . 2]" 1
182 1 12 ALA H 1 29 ASN H . . 4.400 4.278 4.118 4.397 . 0 0 "[ . 1 . 2]" 1
183 1 12 ALA H 1 29 ASN HA . . 4.570 4.103 3.813 4.317 . 0 0 "[ . 1 . 2]" 1
184 1 12 ALA H 1 30 ASP H . . 4.480 2.673 2.502 2.856 . 0 0 "[ . 1 . 2]" 1
185 1 12 ALA H 1 30 ASP HB2 . . 4.890 3.854 3.710 4.007 . 0 0 "[ . 1 . 2]" 1
186 1 12 ALA H 1 31 ILE MD . . 4.210 3.918 3.482 4.211 0.001 13 0 "[ . 1 . 2]" 1
187 1 12 ALA H 1 31 ILE MG . . 5.500 5.412 5.196 5.500 0.000 16 0 "[ . 1 . 2]" 1
188 1 12 ALA H 1 32 ILE MD . . 4.090 3.813 3.492 4.091 0.001 19 0 "[ . 1 . 2]" 1
189 1 12 ALA H 1 59 VAL HA . . 5.500 4.797 4.508 5.005 . 0 0 "[ . 1 . 2]" 1
190 1 12 ALA H 1 59 VAL HB . . 4.870 4.157 3.925 4.375 . 0 0 "[ . 1 . 2]" 1
191 1 12 ALA H 1 59 VAL MG1 . . 4.240 3.833 3.589 4.031 . 0 0 "[ . 1 . 2]" 1
192 1 12 ALA H 1 60 GLU H . . 5.380 4.769 4.507 4.935 . 0 0 "[ . 1 . 2]" 1
193 1 12 ALA HA 1 13 LEU H . . 2.950 2.158 2.142 2.181 . 0 0 "[ . 1 . 2]" 1
194 1 12 ALA HA 1 13 LEU MD1 . . 5.220 4.898 4.694 5.109 . 0 0 "[ . 1 . 2]" 1
195 1 12 ALA HA 1 13 LEU MD2 . . 5.490 4.652 4.491 4.909 . 0 0 "[ . 1 . 2]" 1
196 1 12 ALA HA 1 13 LEU HG . . 3.870 3.752 3.509 3.867 . 0 0 "[ . 1 . 2]" 1
197 1 12 ALA HA 1 14 LEU H . . 4.060 3.561 3.375 3.806 . 0 0 "[ . 1 . 2]" 1
198 1 12 ALA HA 1 14 LEU QD . . 5.440 4.664 4.364 5.415 . 0 0 "[ . 1 . 2]" 1
199 1 12 ALA HA 1 26 PHE QD . . 5.090 4.104 3.803 4.439 . 0 0 "[ . 1 . 2]" 1
200 1 12 ALA HA 1 26 PHE QE . . 4.590 3.653 3.292 4.081 . 0 0 "[ . 1 . 2]" 1
201 1 12 ALA HA 1 32 ILE MD . . 4.330 4.026 3.855 4.191 . 0 0 "[ . 1 . 2]" 1
202 1 12 ALA HA 1 59 VAL HA . . 3.260 2.398 2.021 2.654 . 0 0 "[ . 1 . 2]" 1
203 1 12 ALA HA 1 59 VAL HB . . 4.180 2.906 2.688 3.236 . 0 0 "[ . 1 . 2]" 1
204 1 12 ALA HA 1 59 VAL MG1 . . 2.990 2.011 1.975 2.112 . 0 0 "[ . 1 . 2]" 1
205 1 12 ALA HA 1 59 VAL MG2 . . 4.720 4.270 4.162 4.385 . 0 0 "[ . 1 . 2]" 1
206 1 12 ALA HA 1 60 GLU H . . 4.190 3.787 3.483 4.021 . 0 0 "[ . 1 . 2]" 1
207 1 12 ALA MB 1 13 LEU H . . 3.700 3.237 2.958 3.451 . 0 0 "[ . 1 . 2]" 1
208 1 12 ALA MB 1 14 LEU H . . 3.500 2.930 2.674 3.232 . 0 0 "[ . 1 . 2]" 1
209 1 12 ALA MB 1 26 PHE HB2 . . 4.380 2.998 2.772 3.220 . 0 0 "[ . 1 . 2]" 1
210 1 12 ALA MB 1 26 PHE HB3 . . 4.680 4.119 3.947 4.351 . 0 0 "[ . 1 . 2]" 1
211 1 12 ALA MB 1 26 PHE QD . . 2.960 2.036 1.818 2.278 . 0 0 "[ . 1 . 2]" 1
212 1 12 ALA MB 1 26 PHE QE . . 3.300 2.746 2.166 3.050 . 0 0 "[ . 1 . 2]" 1
213 1 12 ALA MB 1 26 PHE HZ . . 4.700 4.475 4.086 4.651 . 0 0 "[ . 1 . 2]" 1
214 1 12 ALA MB 1 27 ARG H . . 4.700 3.936 3.645 4.350 . 0 0 "[ . 1 . 2]" 1
215 1 12 ALA MB 1 28 LYS HA . . 3.170 2.804 2.522 3.015 . 0 0 "[ . 1 . 2]" 1
216 1 12 ALA MB 1 29 ASN H . . 3.250 2.961 2.638 3.189 . 0 0 "[ . 1 . 2]" 1
217 1 12 ALA MB 1 29 ASN HA . . 4.120 3.951 3.660 4.113 . 0 0 "[ . 1 . 2]" 1
218 1 12 ALA MB 1 30 ASP H . . 3.190 1.947 1.856 2.064 . 0 0 "[ . 1 . 2]" 1
219 1 12 ALA MB 1 30 ASP HA . . 4.510 4.186 3.929 4.355 . 0 0 "[ . 1 . 2]" 1
220 1 12 ALA MB 1 30 ASP HB2 . . 3.600 2.381 2.163 2.636 . 0 0 "[ . 1 . 2]" 1
221 1 12 ALA MB 1 30 ASP HB3 . . 4.170 3.721 3.510 3.972 . 0 0 "[ . 1 . 2]" 1
222 1 12 ALA MB 1 32 ILE MD . . 3.250 2.575 2.196 2.804 . 0 0 "[ . 1 . 2]" 1
223 1 12 ALA MB 1 59 VAL HA . . 4.340 4.005 3.653 4.235 . 0 0 "[ . 1 . 2]" 1
224 1 12 ALA MB 1 59 VAL MG1 . . 3.560 2.530 2.422 2.665 . 0 0 "[ . 1 . 2]" 1
225 1 13 LEU H 1 13 LEU QB . . 3.270 2.521 2.434 2.613 . 0 0 "[ . 1 . 2]" 1
226 1 13 LEU H 1 13 LEU MD1 . . 4.110 3.433 3.194 3.672 . 0 0 "[ . 1 . 2]" 1
227 1 13 LEU H 1 13 LEU MD2 . . 3.970 3.434 3.149 3.680 . 0 0 "[ . 1 . 2]" 1
228 1 13 LEU H 1 13 LEU HG . . 3.450 2.184 1.902 2.447 . 0 0 "[ . 1 . 2]" 1
229 1 13 LEU H 1 14 LEU H . . 3.040 2.442 2.229 2.648 . 0 0 "[ . 1 . 2]" 1
230 1 13 LEU H 1 14 LEU QD . . 4.810 3.364 2.931 4.636 . 0 0 "[ . 1 . 2]" 1
231 1 13 LEU H 1 26 PHE QE . . 4.990 4.379 3.768 4.837 . 0 0 "[ . 1 . 2]" 1
232 1 13 LEU H 1 29 ASN H . . 5.000 4.788 4.379 4.999 . 0 0 "[ . 1 . 2]" 1
233 1 13 LEU H 1 59 VAL HA . . 3.350 2.252 2.043 2.465 . 0 0 "[ . 1 . 2]" 1
234 1 13 LEU H 1 59 VAL HB . . 4.640 4.139 3.890 4.506 . 0 0 "[ . 1 . 2]" 1
235 1 13 LEU H 1 59 VAL MG1 . . 3.810 3.439 3.279 3.590 . 0 0 "[ . 1 . 2]" 1
236 1 13 LEU H 1 60 GLU H . . 4.500 4.087 3.610 4.453 . 0 0 "[ . 1 . 2]" 1
237 1 13 LEU HA 1 13 LEU MD1 . . 4.140 3.944 3.906 3.990 . 0 0 "[ . 1 . 2]" 1
238 1 13 LEU HA 1 13 LEU MD2 . . 2.770 2.293 2.068 2.519 . 0 0 "[ . 1 . 2]" 1
239 1 13 LEU HA 1 13 LEU HG . . 4.220 3.094 2.988 3.179 . 0 0 "[ . 1 . 2]" 1
240 1 13 LEU HA 1 14 LEU QD . . 5.440 4.158 3.696 5.141 . 0 0 "[ . 1 . 2]" 1
241 1 13 LEU HA 1 28 LYS QE . . 5.460 4.598 4.065 5.450 . 0 0 "[ . 1 . 2]" 1
242 1 13 LEU HA 1 28 LYS HG2 . . 5.060 4.742 3.857 5.048 . 0 0 "[ . 1 . 2]" 1
243 1 13 LEU HA 1 28 LYS HG3 . . 4.150 3.931 3.463 4.148 . 0 0 "[ . 1 . 2]" 1
244 1 13 LEU HA 1 29 ASN H . . 4.830 3.775 3.450 3.923 . 0 0 "[ . 1 . 2]" 1
245 1 13 LEU QB 1 13 LEU MD1 . . 2.770 2.078 2.035 2.101 . 0 0 "[ . 1 . 2]" 1
246 1 13 LEU QB 1 13 LEU MD2 . . 2.840 2.190 2.097 2.287 . 0 0 "[ . 1 . 2]" 1
247 1 13 LEU QB 1 14 LEU H . . 3.430 2.958 2.706 3.228 . 0 0 "[ . 1 . 2]" 1
248 1 13 LEU QB 1 14 LEU MD1 . . 4.870 4.463 4.271 4.849 . 0 0 "[ . 1 . 2]" 1
249 1 13 LEU QB 1 14 LEU QD . . 3.540 2.201 1.863 3.364 . 0 0 "[ . 1 . 2]" 1
250 1 13 LEU QB 1 14 LEU MD2 . . 4.870 2.216 1.866 3.503 . 0 0 "[ . 1 . 2]" 1
251 1 13 LEU QB 1 29 ASN H . . 5.500 5.389 5.031 5.500 . 0 0 "[ . 1 . 2]" 1
252 1 13 LEU QB 1 59 VAL HA . . 4.260 3.812 3.625 3.967 . 0 0 "[ . 1 . 2]" 1
253 1 13 LEU QB 1 60 GLU H . . 5.500 5.294 5.015 5.472 . 0 0 "[ . 1 . 2]" 1
254 1 13 LEU MD1 1 14 LEU H . . 5.010 4.649 4.248 4.828 . 0 0 "[ . 1 . 2]" 1
255 1 13 LEU MD1 1 58 PHE HA . . 4.110 3.702 3.296 4.097 . 0 0 "[ . 1 . 2]" 1
256 1 13 LEU MD1 1 59 VAL H . . 4.290 4.068 3.787 4.291 0.001 19 0 "[ . 1 . 2]" 1
257 1 13 LEU MD1 1 59 VAL HA . . 4.030 3.288 2.992 3.694 . 0 0 "[ . 1 . 2]" 1
258 1 13 LEU MD1 1 60 GLU H . . 4.370 4.052 3.714 4.370 0.000 16 0 "[ . 1 . 2]" 1
259 1 13 LEU MD1 1 60 GLU QB . . 3.190 2.471 2.132 2.895 . 0 0 "[ . 1 . 2]" 1
260 1 13 LEU MD1 1 60 GLU QG . . 4.230 3.942 3.655 4.228 . 0 0 "[ . 1 . 2]" 1
261 1 13 LEU MD2 1 14 LEU H . . 5.020 4.797 4.699 4.893 . 0 0 "[ . 1 . 2]" 1
262 1 13 LEU MD2 1 59 VAL HA . . 4.270 3.998 3.738 4.227 . 0 0 "[ . 1 . 2]" 1
263 1 13 LEU MD2 1 60 GLU H . . 4.100 3.781 3.232 4.076 . 0 0 "[ . 1 . 2]" 1
264 1 13 LEU MD2 1 60 GLU QB . . 3.060 2.018 1.872 2.187 . 0 0 "[ . 1 . 2]" 1
265 1 13 LEU MD2 1 60 GLU HG2 . . 4.520 3.499 2.945 4.335 . 0 0 "[ . 1 . 2]" 1
266 1 13 LEU MD2 1 60 GLU QG . . 3.880 3.289 2.888 3.831 . 0 0 "[ . 1 . 2]" 1
267 1 13 LEU MD2 1 60 GLU HG3 . . 4.520 4.228 3.968 4.453 . 0 0 "[ . 1 . 2]" 1
268 1 13 LEU HG 1 14 LEU H . . 4.770 4.299 4.161 4.481 . 0 0 "[ . 1 . 2]" 1
269 1 13 LEU HG 1 59 VAL H . . 4.900 4.802 4.538 4.901 0.001 11 0 "[ . 1 . 2]" 1
270 1 13 LEU HG 1 59 VAL HA . . 3.290 2.483 2.239 2.771 . 0 0 "[ . 1 . 2]" 1
271 1 13 LEU HG 1 60 GLU H . . 3.790 3.326 2.948 3.519 . 0 0 "[ . 1 . 2]" 1
272 1 13 LEU HG 1 60 GLU QB . . 3.900 2.892 2.550 3.180 . 0 0 "[ . 1 . 2]" 1
273 1 14 LEU H 1 14 LEU HB2 . . 4.020 3.923 3.862 3.987 . 0 0 "[ . 1 . 2]" 1
274 1 14 LEU H 1 14 LEU HB3 . . 4.020 3.399 3.200 3.542 . 0 0 "[ . 1 . 2]" 1
275 1 14 LEU H 1 14 LEU MD1 . . 4.670 4.140 3.056 4.375 . 0 0 "[ . 1 . 2]" 1
276 1 14 LEU H 1 14 LEU QD . . 3.830 2.452 2.037 3.328 . 0 0 "[ . 1 . 2]" 1
277 1 14 LEU H 1 14 LEU MD2 . . 4.670 2.565 2.041 3.926 . 0 0 "[ . 1 . 2]" 1
278 1 14 LEU H 1 14 LEU HG . . 3.770 2.840 2.331 3.098 . 0 0 "[ . 1 . 2]" 1
279 1 14 LEU H 1 15 ASP H . . 4.570 4.375 4.356 4.406 . 0 0 "[ . 1 . 2]" 1
280 1 14 LEU H 1 26 PHE QD . . 4.920 4.574 4.362 4.736 . 0 0 "[ . 1 . 2]" 1
281 1 14 LEU H 1 26 PHE QE . . 4.090 3.897 3.638 4.041 . 0 0 "[ . 1 . 2]" 1
282 1 14 LEU H 1 28 LYS HA . . 4.000 3.523 3.235 3.881 . 0 0 "[ . 1 . 2]" 1
283 1 14 LEU H 1 28 LYS HG3 . . 4.600 3.915 3.230 4.250 . 0 0 "[ . 1 . 2]" 1
284 1 14 LEU H 1 29 ASN H . . 4.730 4.262 3.934 4.645 . 0 0 "[ . 1 . 2]" 1
285 1 14 LEU H 1 58 PHE HB3 . . 4.660 4.532 4.298 4.660 . 13 0 "[ . 1 . 2]" 1
286 1 14 LEU H 1 59 VAL HA . . 4.640 4.397 4.198 4.638 . 0 0 "[ . 1 . 2]" 1
287 1 14 LEU HA 1 14 LEU MD1 . . 4.760 4.007 3.602 4.107 . 0 0 "[ . 1 . 2]" 1
288 1 14 LEU HA 1 14 LEU QD . . 3.620 3.352 3.246 3.415 . 0 0 "[ . 1 . 2]" 1
289 1 14 LEU HA 1 14 LEU MD2 . . 4.760 3.633 3.402 4.077 . 0 0 "[ . 1 . 2]" 1
290 1 14 LEU HA 1 15 ASP H . . 3.120 2.579 2.468 2.646 . 0 0 "[ . 1 . 2]" 1
291 1 14 LEU HA 1 28 LYS H . . 4.770 4.534 3.914 4.745 . 0 0 "[ . 1 . 2]" 1
292 1 14 LEU HA 1 28 LYS HA . . 4.350 3.019 2.833 3.307 . 0 0 "[ . 1 . 2]" 1
293 1 14 LEU HA 1 28 LYS QB . . 4.180 2.592 2.175 2.818 . 0 0 "[ . 1 . 2]" 1
294 1 14 LEU HA 1 28 LYS QD . . 3.860 3.190 2.218 3.762 . 0 0 "[ . 1 . 2]" 1
295 1 14 LEU HA 1 28 LYS QE . . 4.310 3.240 2.004 4.220 . 0 0 "[ . 1 . 2]" 1
296 1 14 LEU HA 1 28 LYS HG2 . . 4.470 3.847 3.589 4.267 . 0 0 "[ . 1 . 2]" 1
297 1 14 LEU HA 1 28 LYS HG3 . . 3.980 2.177 2.000 2.623 . 0 0 "[ . 1 . 2]" 1
298 1 14 LEU QB 1 15 ASP H . . 3.190 2.071 1.921 2.265 . 0 0 "[ . 1 . 2]" 1
299 1 14 LEU QB 1 15 ASP QB . . 4.740 3.945 3.832 4.055 . 0 0 "[ . 1 . 2]" 1
300 1 14 LEU QB 1 58 PHE QD . . 4.760 4.526 4.161 4.756 . 0 0 "[ . 1 . 2]" 1
301 1 14 LEU HB2 1 15 ASP H . . 3.720 2.085 1.931 2.285 . 0 0 "[ . 1 . 2]" 1
302 1 14 LEU HB2 1 15 ASP QB . . 5.500 4.047 3.921 4.177 . 0 0 "[ . 1 . 2]" 1
303 1 14 LEU HB2 1 58 PHE QD . . 5.500 4.916 4.496 5.268 . 0 0 "[ . 1 . 2]" 1
304 1 14 LEU HB3 1 15 ASP H . . 3.720 3.565 3.427 3.717 . 0 0 "[ . 1 . 2]" 1
305 1 14 LEU HB3 1 15 ASP QB . . 5.500 5.468 5.375 5.506 0.006 15 0 "[ . 1 . 2]" 1
306 1 14 LEU HB3 1 58 PHE QD . . 5.500 5.303 4.906 5.499 . 0 0 "[ . 1 . 2]" 1
307 1 14 LEU QD 1 16 PHE HB2 . . 4.910 3.875 2.644 4.328 . 0 0 "[ . 1 . 2]" 1
308 1 14 LEU QD 1 58 PHE HB2 . . 4.800 4.243 3.944 4.671 . 0 0 "[ . 1 . 2]" 1
309 1 14 LEU QD 1 58 PHE QD . . 3.650 2.393 1.881 2.679 . 0 0 "[ . 1 . 2]" 1
310 1 14 LEU QD 1 58 PHE QE . . 3.720 2.328 1.994 2.773 . 0 0 "[ . 1 . 2]" 1
311 1 14 LEU QD 1 58 PHE HZ . . 4.730 3.846 3.456 4.032 . 0 0 "[ . 1 . 2]" 1
312 1 14 LEU MD1 1 15 ASP H . . 4.770 3.246 2.384 3.613 . 0 0 "[ . 1 . 2]" 1
313 1 14 LEU MD1 1 58 PHE HB3 . . 4.580 4.239 3.463 4.530 . 0 0 "[ . 1 . 2]" 1
314 1 14 LEU MD1 1 58 PHE QD . . 4.230 2.579 1.894 2.981 . 0 0 "[ . 1 . 2]" 1
315 1 14 LEU MD1 1 58 PHE QE . . 4.380 2.348 2.023 2.813 . 0 0 "[ . 1 . 2]" 1
316 1 14 LEU MD2 1 15 ASP H . . 4.770 4.438 4.117 4.608 . 0 0 "[ . 1 . 2]" 1
317 1 14 LEU MD2 1 58 PHE HB3 . . 4.580 3.410 2.892 4.575 . 0 0 "[ . 1 . 2]" 1
318 1 14 LEU MD2 1 58 PHE QD . . 4.230 2.980 2.501 3.325 . 0 0 "[ . 1 . 2]" 1
319 1 14 LEU MD2 1 58 PHE QE . . 4.380 3.930 3.020 4.315 . 0 0 "[ . 1 . 2]" 1
320 1 14 LEU HG 1 15 ASP H . . 4.850 3.618 3.133 4.304 . 0 0 "[ . 1 . 2]" 1
321 1 14 LEU HG 1 58 PHE HB3 . . 4.690 3.808 3.539 4.092 . 0 0 "[ . 1 . 2]" 1
322 1 14 LEU HG 1 58 PHE QD . . 4.530 2.561 2.079 3.132 . 0 0 "[ . 1 . 2]" 1
323 1 14 LEU HG 1 58 PHE QE . . 4.900 3.884 3.471 4.487 . 0 0 "[ . 1 . 2]" 1
324 1 15 ASP H 1 15 ASP QB . . 3.210 2.254 2.140 2.400 . 0 0 "[ . 1 . 2]" 1
325 1 15 ASP H 1 16 PHE H . . 5.140 4.513 4.265 4.608 . 0 0 "[ . 1 . 2]" 1
326 1 15 ASP H 1 27 ARG HA . . 5.270 4.877 4.599 5.147 . 0 0 "[ . 1 . 2]" 1
327 1 15 ASP H 1 28 LYS H . . 4.500 4.168 3.611 4.498 . 0 0 "[ . 1 . 2]" 1
328 1 15 ASP H 1 28 LYS QB . . 4.860 3.062 2.786 3.312 . 0 0 "[ . 1 . 2]" 1
329 1 15 ASP H 1 28 LYS QD . . 4.990 4.348 3.644 4.930 . 0 0 "[ . 1 . 2]" 1
330 1 15 ASP HA 1 16 PHE H . . 2.970 2.187 2.138 2.278 . 0 0 "[ . 1 . 2]" 1
331 1 15 ASP HA 1 26 PHE QD . . 4.380 3.773 3.367 4.197 . 0 0 "[ . 1 . 2]" 1
332 1 15 ASP HA 1 27 ARG QD . . 4.530 3.841 3.277 4.531 0.001 16 0 "[ . 1 . 2]" 1
333 1 15 ASP HA 1 28 LYS H . . 3.430 3.048 2.550 3.314 . 0 0 "[ . 1 . 2]" 1
334 1 15 ASP QB 1 16 PHE H . . 3.660 3.464 2.858 3.661 0.001 13 0 "[ . 1 . 2]" 1
335 1 15 ASP QB 1 27 ARG HA . . 4.250 2.777 2.438 3.106 . 0 0 "[ . 1 . 2]" 1
336 1 15 ASP QB 1 27 ARG HB2 . . 5.500 5.198 4.824 5.477 . 0 0 "[ . 1 . 2]" 1
337 1 15 ASP QB 1 27 ARG QD . . 4.670 2.902 1.982 4.058 . 0 0 "[ . 1 . 2]" 1
338 1 15 ASP QB 1 27 ARG HG2 . . 5.500 4.708 3.839 5.354 . 0 0 "[ . 1 . 2]" 1
339 1 15 ASP QB 1 27 ARG HG3 . . 5.500 4.704 3.204 5.460 . 0 0 "[ . 1 . 2]" 1
340 1 15 ASP QB 1 28 LYS H . . 4.320 2.882 2.251 3.852 . 0 0 "[ . 1 . 2]" 1
341 1 15 ASP QB 1 28 LYS HB2 . . 5.500 3.331 3.000 4.264 . 0 0 "[ . 1 . 2]" 1
342 1 15 ASP QB 1 28 LYS HB3 . . 5.500 4.360 3.961 5.277 . 0 0 "[ . 1 . 2]" 1
343 1 16 PHE H 1 16 PHE HB2 . . 3.930 3.103 2.687 3.359 . 0 0 "[ . 1 . 2]" 1
344 1 16 PHE H 1 16 PHE HB3 . . 3.700 2.669 2.453 2.902 . 0 0 "[ . 1 . 2]" 1
345 1 16 PHE H 1 16 PHE QD . . 4.620 4.323 4.210 4.433 . 0 0 "[ . 1 . 2]" 1
346 1 16 PHE H 1 17 GLU H . . 4.780 4.215 4.084 4.477 . 0 0 "[ . 1 . 2]" 1
347 1 16 PHE H 1 26 PHE QD . . 4.040 3.436 2.622 4.018 . 0 0 "[ . 1 . 2]" 1
348 1 16 PHE H 1 26 PHE QE . . 4.890 4.159 3.304 4.859 . 0 0 "[ . 1 . 2]" 1
349 1 16 PHE H 1 27 ARG HA . . 3.920 3.260 2.903 3.556 . 0 0 "[ . 1 . 2]" 1
350 1 16 PHE H 1 28 LYS H . . 5.190 4.960 4.542 5.191 0.001 16 0 "[ . 1 . 2]" 1
351 1 16 PHE HA 1 16 PHE QD . . 3.370 2.437 2.161 2.673 . 0 0 "[ . 1 . 2]" 1
352 1 16 PHE HA 1 16 PHE QE . . 5.310 4.500 4.360 4.575 . 0 0 "[ . 1 . 2]" 1
353 1 16 PHE HA 1 17 GLU H . . 2.930 2.154 2.139 2.189 . 0 0 "[ . 1 . 2]" 1
354 1 16 PHE HA 1 17 GLU QB . . 4.510 4.255 4.117 4.503 . 0 0 "[ . 1 . 2]" 1
355 1 16 PHE HA 1 26 PHE H . . 5.020 4.661 4.541 4.940 . 0 0 "[ . 1 . 2]" 1
356 1 16 PHE HA 1 58 PHE QD . . 4.970 3.941 3.319 4.442 . 0 0 "[ . 1 . 2]" 1
357 1 16 PHE HA 1 58 PHE QE . . 4.950 3.647 3.177 4.103 . 0 0 "[ . 1 . 2]" 1
358 1 16 PHE HB2 1 17 GLU H . . 4.470 4.321 4.077 4.468 . 0 0 "[ . 1 . 2]" 1
359 1 16 PHE HB2 1 26 PHE H . . 4.590 4.335 3.999 4.585 . 0 0 "[ . 1 . 2]" 1
360 1 16 PHE HB2 1 26 PHE QD . . 4.680 3.941 3.407 4.360 . 0 0 "[ . 1 . 2]" 1
361 1 16 PHE HB2 1 26 PHE QE . . 4.140 2.800 2.139 3.411 . 0 0 "[ . 1 . 2]" 1
362 1 16 PHE HB2 1 26 PHE HZ . . 4.580 3.284 2.803 3.985 . 0 0 "[ . 1 . 2]" 1
363 1 16 PHE HB2 1 58 PHE QD . . 3.880 2.594 2.196 2.974 . 0 0 "[ . 1 . 2]" 1
364 1 16 PHE HB3 1 17 GLU H . . 4.890 4.292 4.108 4.450 . 0 0 "[ . 1 . 2]" 1
365 1 16 PHE HB3 1 26 PHE H . . 3.880 2.673 2.301 2.977 . 0 0 "[ . 1 . 2]" 1
366 1 16 PHE HB3 1 26 PHE QD . . 4.430 3.301 2.980 3.551 . 0 0 "[ . 1 . 2]" 1
367 1 16 PHE HB3 1 26 PHE QE . . 4.330 3.056 2.739 3.348 . 0 0 "[ . 1 . 2]" 1
368 1 16 PHE HB3 1 26 PHE HZ . . 4.640 3.401 2.948 3.764 . 0 0 "[ . 1 . 2]" 1
369 1 16 PHE QD 1 17 GLU H . . 4.080 3.383 2.700 3.912 . 0 0 "[ . 1 . 2]" 1
370 1 16 PHE QD 1 18 ARG HA . . 5.300 4.118 3.621 4.511 . 0 0 "[ . 1 . 2]" 1
371 1 16 PHE QD 1 23 GLU HB3 . . 5.260 4.853 4.463 5.183 . 0 0 "[ . 1 . 2]" 1
372 1 16 PHE QD 1 25 GLY HA2 . . 4.380 2.192 2.001 2.627 . 0 0 "[ . 1 . 2]" 1
373 1 16 PHE QD 1 25 GLY QA . . 3.530 2.181 1.991 2.607 . 0 0 "[ . 1 . 2]" 1
374 1 16 PHE QD 1 25 GLY HA3 . . 4.380 3.879 3.560 4.348 . 0 0 "[ . 1 . 2]" 1
375 1 16 PHE QD 1 26 PHE H . . 4.190 3.320 2.919 3.912 . 0 0 "[ . 1 . 2]" 1
376 1 16 PHE QD 1 26 PHE QD . . 4.280 3.475 2.962 4.123 . 0 0 "[ . 1 . 2]" 1
377 1 16 PHE QD 1 54 PHE HB2 . . 4.720 3.826 3.492 4.127 . 0 0 "[ . 1 . 2]" 1
378 1 16 PHE QD 1 54 PHE HB3 . . 4.650 4.275 3.860 4.649 . 0 0 "[ . 1 . 2]" 1
379 1 16 PHE QD 1 55 PRO HD2 . . 4.340 3.951 3.624 4.225 . 0 0 "[ . 1 . 2]" 1
380 1 16 PHE QD 1 58 PHE QE . . 2.900 2.594 2.288 2.861 . 0 0 "[ . 1 . 2]" 1
381 1 16 PHE QD 1 58 PHE HZ . . 4.180 3.746 3.441 4.019 . 0 0 "[ . 1 . 2]" 1
382 1 16 PHE QE 1 18 ARG HA . . 4.580 3.114 2.410 3.581 . 0 0 "[ . 1 . 2]" 1
383 1 16 PHE QE 1 23 GLU HA . . 5.500 4.466 4.115 5.245 . 0 0 "[ . 1 . 2]" 1
384 1 16 PHE QE 1 23 GLU HB2 . . 4.770 4.582 4.152 4.769 . 0 0 "[ . 1 . 2]" 1
385 1 16 PHE QE 1 23 GLU HB3 . . 3.770 2.922 2.466 3.238 . 0 0 "[ . 1 . 2]" 1
386 1 16 PHE QE 1 23 GLU QG . . 5.040 4.093 3.569 4.609 . 0 0 "[ . 1 . 2]" 1
387 1 16 PHE QE 1 24 LEU H . . 4.580 3.552 2.894 4.113 . 0 0 "[ . 1 . 2]" 1
388 1 16 PHE QE 1 54 PHE HB2 . . 4.800 3.536 3.049 4.023 . 0 0 "[ . 1 . 2]" 1
389 1 16 PHE QE 1 54 PHE HB3 . . 4.310 3.618 3.028 4.053 . 0 0 "[ . 1 . 2]" 1
390 1 16 PHE QE 1 55 PRO HD2 . . 4.100 3.230 2.911 3.731 . 0 0 "[ . 1 . 2]" 1
391 1 16 PHE QE 1 55 PRO HD3 . . 4.040 3.631 3.218 3.998 . 0 0 "[ . 1 . 2]" 1
392 1 16 PHE QE 1 55 PRO HG2 . . 4.610 4.082 3.332 4.505 . 0 0 "[ . 1 . 2]" 1
393 1 16 PHE QE 1 55 PRO QG . . 4.050 3.186 2.360 3.702 . 0 0 "[ . 1 . 2]" 1
394 1 16 PHE QE 1 55 PRO HG3 . . 4.610 3.334 2.412 3.936 . 0 0 "[ . 1 . 2]" 1
395 1 16 PHE HZ 1 18 ARG HA . . 5.500 3.702 2.900 4.364 . 0 0 "[ . 1 . 2]" 1
396 1 16 PHE HZ 1 23 GLU HB3 . . 4.620 3.862 3.191 4.481 . 0 0 "[ . 1 . 2]" 1
397 1 16 PHE HZ 1 23 GLU QG . . 5.340 4.033 3.279 4.781 . 0 0 "[ . 1 . 2]" 1
398 1 16 PHE HZ 1 55 PRO HD3 . . 3.950 3.223 2.434 3.834 . 0 0 "[ . 1 . 2]" 1
399 1 17 GLU H 1 17 GLU QB . . 3.140 2.401 2.192 2.937 . 0 0 "[ . 1 . 2]" 1
400 1 17 GLU H 1 17 GLU HG2 . . 4.710 3.420 1.929 4.548 . 0 0 "[ . 1 . 2]" 1
401 1 17 GLU H 1 17 GLU QG . . 3.890 3.008 1.918 3.918 0.028 18 0 "[ . 1 . 2]" 1
402 1 17 GLU H 1 17 GLU HG3 . . 4.710 3.609 2.666 4.465 . 0 0 "[ . 1 . 2]" 1
403 1 17 GLU HA 1 17 GLU HG2 . . 3.990 2.996 2.401 3.889 . 0 0 "[ . 1 . 2]" 1
404 1 17 GLU HA 1 17 GLU HG3 . . 3.990 3.272 2.201 3.890 . 0 0 "[ . 1 . 2]" 1
405 1 17 GLU HA 1 18 ARG H . . 2.740 2.197 2.142 2.269 . 0 0 "[ . 1 . 2]" 1
406 1 17 GLU HA 1 18 ARG HB3 . . 4.530 4.456 4.389 4.504 . 0 0 "[ . 1 . 2]" 1
407 1 17 GLU HA 1 25 GLY QA . . 4.530 3.342 2.943 3.968 . 0 0 "[ . 1 . 2]" 1
408 1 17 GLU HA 1 26 PHE H . . 4.770 4.119 3.746 4.770 . 0 0 "[ . 1 . 2]" 1
409 1 17 GLU QB 1 18 ARG H . . 3.970 3.722 3.567 3.956 . 0 0 "[ . 1 . 2]" 1
410 1 17 GLU QG 1 18 ARG H . . 4.390 4.173 3.017 4.417 0.027 14 0 "[ . 1 . 2]" 1
411 1 18 ARG H 1 18 ARG HB2 . . 3.960 3.554 3.524 3.581 . 0 0 "[ . 1 . 2]" 1
412 1 18 ARG H 1 18 ARG HB3 . . 3.310 2.300 2.231 2.375 . 0 0 "[ . 1 . 2]" 1
413 1 18 ARG H 1 18 ARG HG2 . . 4.190 2.862 2.493 3.464 . 0 0 "[ . 1 . 2]" 1
414 1 18 ARG H 1 18 ARG QG . . 3.480 2.792 2.464 3.260 . 0 0 "[ . 1 . 2]" 1
415 1 18 ARG H 1 18 ARG HG3 . . 4.190 4.017 3.856 4.175 . 0 0 "[ . 1 . 2]" 1
416 1 18 ARG H 1 19 HIS H . . 5.060 4.534 4.383 4.648 . 0 0 "[ . 1 . 2]" 1
417 1 18 ARG H 1 23 GLU HB3 . . 5.500 4.856 4.573 5.244 . 0 0 "[ . 1 . 2]" 1
418 1 18 ARG H 1 25 GLY HA2 . . 4.060 2.845 2.340 3.491 . 0 0 "[ . 1 . 2]" 1
419 1 18 ARG H 1 25 GLY QA . . 3.510 2.260 1.947 2.823 . 0 0 "[ . 1 . 2]" 1
420 1 18 ARG H 1 25 GLY HA3 . . 4.060 2.387 2.019 2.981 . 0 0 "[ . 1 . 2]" 1
421 1 18 ARG H 1 26 PHE H . . 5.130 4.113 3.803 4.452 . 0 0 "[ . 1 . 2]" 1
422 1 18 ARG HA 1 18 ARG QD . . 5.040 4.201 3.752 4.394 . 0 0 "[ . 1 . 2]" 1
423 1 18 ARG HA 1 19 HIS H . . 3.170 2.183 2.139 2.370 . 0 0 "[ . 1 . 2]" 1
424 1 18 ARG HA 1 19 HIS HA . . 4.810 4.381 4.351 4.424 . 0 0 "[ . 1 . 2]" 1
425 1 18 ARG HA 1 19 HIS QB . . 5.340 4.195 3.990 4.582 . 0 0 "[ . 1 . 2]" 1
426 1 18 ARG HA 1 20 ASP H . . 4.510 4.064 3.563 4.506 . 0 0 "[ . 1 . 2]" 1
427 1 18 ARG HA 1 23 GLU HB2 . . 4.000 3.394 3.099 3.783 . 0 0 "[ . 1 . 2]" 1
428 1 18 ARG HA 1 23 GLU HB3 . . 4.190 2.653 2.305 3.242 . 0 0 "[ . 1 . 2]" 1
429 1 18 ARG HB2 1 18 ARG HD2 . . 4.230 3.089 2.607 4.138 . 0 0 "[ . 1 . 2]" 1
430 1 18 ARG HB2 1 18 ARG QD . . 3.410 2.765 2.491 3.327 . 0 0 "[ . 1 . 2]" 1
431 1 18 ARG HB2 1 18 ARG HD3 . . 4.230 3.295 2.716 3.659 . 0 0 "[ . 1 . 2]" 1
432 1 18 ARG HB2 1 19 HIS H . . 3.850 3.277 2.583 3.709 . 0 0 "[ . 1 . 2]" 1
433 1 18 ARG HB2 1 20 ASP H . . 4.820 3.685 2.895 4.248 . 0 0 "[ . 1 . 2]" 1
434 1 18 ARG HB2 1 23 GLU H . . 4.890 4.003 3.748 4.225 . 0 0 "[ . 1 . 2]" 1
435 1 18 ARG HB2 1 23 GLU HB2 . . 4.040 2.237 2.047 2.491 . 0 0 "[ . 1 . 2]" 1
436 1 18 ARG HB2 1 23 GLU QG . . 4.680 3.957 3.680 4.089 . 0 0 "[ . 1 . 2]" 1
437 1 18 ARG HB2 1 25 GLY H . . 5.180 3.719 3.370 3.974 . 0 0 "[ . 1 . 2]" 1
438 1 18 ARG HB2 1 25 GLY HA2 . . 4.580 4.399 4.127 4.554 . 0 0 "[ . 1 . 2]" 1
439 1 18 ARG HB2 1 25 GLY QA . . 3.980 3.867 3.617 3.979 . 0 0 "[ . 1 . 2]" 1
440 1 18 ARG HB2 1 25 GLY HA3 . . 4.580 4.288 3.999 4.414 . 0 0 "[ . 1 . 2]" 1
441 1 18 ARG HB3 1 18 ARG HD2 . . 3.730 2.933 2.340 3.552 . 0 0 "[ . 1 . 2]" 1
442 1 18 ARG HB3 1 18 ARG QD . . 3.250 2.183 2.078 2.294 . 0 0 "[ . 1 . 2]" 1
443 1 18 ARG HB3 1 18 ARG HD3 . . 3.730 2.307 2.119 2.725 . 0 0 "[ . 1 . 2]" 1
444 1 18 ARG HB3 1 23 GLU HB2 . . 4.790 3.937 3.764 4.184 . 0 0 "[ . 1 . 2]" 1
445 1 18 ARG HB3 1 23 GLU HB3 . . 4.730 3.273 3.039 3.387 . 0 0 "[ . 1 . 2]" 1
446 1 18 ARG HB3 1 25 GLY H . . 4.270 2.481 2.192 2.887 . 0 0 "[ . 1 . 2]" 1
447 1 18 ARG HB3 1 25 GLY HA2 . . 4.400 2.811 2.575 3.030 . 0 0 "[ . 1 . 2]" 1
448 1 18 ARG HB3 1 25 GLY QA . . 3.870 2.365 2.120 2.484 . 0 0 "[ . 1 . 2]" 1
449 1 18 ARG HB3 1 25 GLY HA3 . . 4.400 2.548 2.254 2.690 . 0 0 "[ . 1 . 2]" 1
450 1 18 ARG QD 1 24 LEU HA . . 3.900 3.101 2.544 3.842 . 0 0 "[ . 1 . 2]" 1
451 1 18 ARG QD 1 24 LEU MD1 . . 4.300 3.889 3.613 4.248 . 0 0 "[ . 1 . 2]" 1
452 1 18 ARG HD2 1 24 LEU HA . . 4.550 3.543 2.592 4.550 0.000 20 0 "[ . 1 . 2]" 1
453 1 18 ARG HD2 1 24 LEU MD1 . . 4.920 4.434 3.870 4.901 . 0 0 "[ . 1 . 2]" 1
454 1 18 ARG HD2 1 25 GLY H . . 4.200 2.903 2.033 3.678 . 0 0 "[ . 1 . 2]" 1
455 1 18 ARG HD3 1 24 LEU HA . . 4.550 3.689 2.787 4.535 . 0 0 "[ . 1 . 2]" 1
456 1 18 ARG HD3 1 24 LEU MD1 . . 4.920 4.397 3.722 4.920 . 0 0 "[ . 1 . 2]" 1
457 1 18 ARG HD3 1 25 GLY H . . 4.200 2.189 1.911 2.888 . 0 0 "[ . 1 . 2]" 1
458 1 18 ARG QG 1 23 GLU H . . 4.790 4.664 4.257 4.790 . 0 0 "[ . 1 . 2]" 1
459 1 18 ARG QG 1 23 GLU HB2 . . 4.030 3.490 3.238 3.696 . 0 0 "[ . 1 . 2]" 1
460 1 18 ARG QG 1 23 GLU HB3 . . 4.270 4.027 3.928 4.078 . 0 0 "[ . 1 . 2]" 1
461 1 18 ARG QG 1 25 GLY H . . 5.020 3.749 3.045 4.099 . 0 0 "[ . 1 . 2]" 1
462 1 18 ARG QG 1 25 GLY QA . . 4.750 3.528 3.227 3.831 . 0 0 "[ . 1 . 2]" 1
463 1 18 ARG HG2 1 23 GLU HB3 . . 5.010 4.929 4.716 5.008 . 0 0 "[ . 1 . 2]" 1
464 1 18 ARG HG3 1 23 GLU HB3 . . 5.010 4.275 4.130 4.441 . 0 0 "[ . 1 . 2]" 1
465 1 19 HIS H 1 19 HIS QB . . 3.670 2.361 2.142 2.795 . 0 0 "[ . 1 . 2]" 1
466 1 19 HIS H 1 20 ASP H . . 3.740 2.495 2.203 2.889 . 0 0 "[ . 1 . 2]" 1
467 1 19 HIS HA 1 19 HIS HD2 . . 4.600 3.446 2.417 4.597 . 0 0 "[ . 1 . 2]" 1
468 1 19 HIS QB 1 20 ASP H . . 3.860 2.726 2.152 3.770 . 0 0 "[ . 1 . 2]" 1
469 1 19 HIS HB2 1 20 ASP H . . 4.450 3.400 2.227 4.436 . 0 0 "[ . 1 . 2]" 1
470 1 19 HIS HB3 1 20 ASP H . . 4.450 3.192 2.174 4.373 . 0 0 "[ . 1 . 2]" 1
471 1 20 ASP H 1 20 ASP QB . . 3.670 2.449 2.254 2.912 . 0 0 "[ . 1 . 2]" 1
472 1 20 ASP H 1 21 ASP H . . 5.170 4.484 4.148 4.599 . 0 0 "[ . 1 . 2]" 1
473 1 20 ASP H 1 22 ASP H . . 5.500 4.976 4.545 5.499 . 0 0 "[ . 1 . 2]" 1
474 1 20 ASP H 1 23 GLU H . . 4.930 3.671 3.064 3.952 . 0 0 "[ . 1 . 2]" 1
475 1 20 ASP H 1 23 GLU HB2 . . 4.490 2.365 2.056 2.799 . 0 0 "[ . 1 . 2]" 1
476 1 20 ASP H 1 23 GLU HB3 . . 5.040 3.721 3.502 4.201 . 0 0 "[ . 1 . 2]" 1
477 1 20 ASP QB 1 23 GLU H . . 4.120 2.531 1.982 3.090 . 0 0 "[ . 1 . 2]" 1
478 1 20 ASP QB 1 23 GLU HB2 . . 4.050 3.132 2.407 3.868 . 0 0 "[ . 1 . 2]" 1
479 1 20 ASP QB 1 23 GLU QG . . 3.830 2.641 1.968 3.552 . 0 0 "[ . 1 . 2]" 1
480 1 20 ASP HB2 1 21 ASP H . . 4.370 4.082 3.754 4.319 . 0 0 "[ . 1 . 2]" 1
481 1 20 ASP HB2 1 22 ASP H . . 4.740 4.192 3.591 4.657 . 0 0 "[ . 1 . 2]" 1
482 1 20 ASP HB2 1 23 GLU H . . 5.000 3.675 2.558 4.333 . 0 0 "[ . 1 . 2]" 1
483 1 20 ASP HB2 1 23 GLU HB2 . . 4.910 3.791 2.508 4.648 . 0 0 "[ . 1 . 2]" 1
484 1 20 ASP HB2 1 23 GLU HG2 . . 5.390 4.443 2.371 5.390 0.000 16 0 "[ . 1 . 2]" 1
485 1 20 ASP HB2 1 23 GLU HG3 . . 5.390 3.290 2.127 4.695 . 0 0 "[ . 1 . 2]" 1
486 1 20 ASP HB3 1 21 ASP H . . 4.370 3.276 2.438 4.047 . 0 0 "[ . 1 . 2]" 1
487 1 20 ASP HB3 1 22 ASP H . . 4.740 2.801 2.470 3.219 . 0 0 "[ . 1 . 2]" 1
488 1 20 ASP HB3 1 23 GLU H . . 5.000 2.722 1.990 3.559 . 0 0 "[ . 1 . 2]" 1
489 1 20 ASP HB3 1 23 GLU HB2 . . 4.910 3.614 2.456 4.672 . 0 0 "[ . 1 . 2]" 1
490 1 20 ASP HB3 1 23 GLU HG2 . . 5.390 4.417 2.703 5.388 . 0 0 "[ . 1 . 2]" 1
491 1 20 ASP HB3 1 23 GLU HG3 . . 5.390 3.446 2.057 5.092 . 0 0 "[ . 1 . 2]" 1
492 1 21 ASP H 1 21 ASP HB2 . . 4.010 2.707 2.231 3.595 . 0 0 "[ . 1 . 2]" 1
493 1 21 ASP H 1 21 ASP QB . . 3.310 2.415 2.159 2.718 . 0 0 "[ . 1 . 2]" 1
494 1 21 ASP H 1 21 ASP HB3 . . 4.010 3.152 2.331 3.602 . 0 0 "[ . 1 . 2]" 1
495 1 21 ASP HA 1 23 GLU H . . 4.700 4.511 3.966 4.700 . 0 0 "[ . 1 . 2]" 1
496 1 21 ASP QB 1 22 ASP H . . 3.780 2.792 2.431 3.557 . 0 0 "[ . 1 . 2]" 1
497 1 21 ASP HB2 1 22 ASP H . . 4.440 3.213 2.462 4.170 . 0 0 "[ . 1 . 2]" 1
498 1 21 ASP HB3 1 22 ASP H . . 4.440 3.506 2.586 4.023 . 0 0 "[ . 1 . 2]" 1
499 1 22 ASP H 1 22 ASP QB . . 3.430 2.465 2.149 2.793 . 0 0 "[ . 1 . 2]" 1
500 1 22 ASP H 1 23 GLU H . . 3.260 2.647 2.367 3.103 . 0 0 "[ . 1 . 2]" 1
501 1 22 ASP H 1 23 GLU HB2 . . 5.040 4.581 4.208 4.990 . 0 0 "[ . 1 . 2]" 1
502 1 22 ASP QB 1 23 GLU H . . 4.290 2.689 2.292 3.344 . 0 0 "[ . 1 . 2]" 1
503 1 22 ASP QB 1 23 GLU QG . . 5.180 3.720 3.347 4.357 . 0 0 "[ . 1 . 2]" 1
504 1 22 ASP QB 1 53 TRP HD1 . . 3.460 2.580 2.034 3.376 . 0 0 "[ . 1 . 2]" 1
505 1 22 ASP HB2 1 23 GLU H . . 4.880 2.919 2.326 3.809 . 0 0 "[ . 1 . 2]" 1
506 1 22 ASP HB2 1 53 TRP HD1 . . 3.960 3.301 2.045 3.960 0.000 13 0 "[ . 1 . 2]" 1
507 1 22 ASP HB2 1 53 TRP HE1 . . 4.530 3.345 2.375 4.188 . 0 0 "[ . 1 . 2]" 1
508 1 22 ASP HB3 1 23 GLU H . . 4.880 3.526 2.497 4.124 . 0 0 "[ . 1 . 2]" 1
509 1 22 ASP HB3 1 53 TRP HD1 . . 3.960 3.095 2.417 3.917 . 0 0 "[ . 1 . 2]" 1
510 1 22 ASP HB3 1 53 TRP HE1 . . 4.530 3.779 2.307 4.529 . 0 0 "[ . 1 . 2]" 1
511 1 23 GLU H 1 23 GLU HB2 . . 3.250 2.312 2.202 2.439 . 0 0 "[ . 1 . 2]" 1
512 1 23 GLU H 1 23 GLU HB3 . . 4.130 3.553 3.503 3.590 . 0 0 "[ . 1 . 2]" 1
513 1 23 GLU H 1 23 GLU QG . . 3.640 2.584 2.363 2.794 . 0 0 "[ . 1 . 2]" 1
514 1 23 GLU H 1 24 LEU H . . 5.140 4.599 4.479 4.647 . 0 0 "[ . 1 . 2]" 1
515 1 23 GLU H 1 53 TRP HE1 . . 4.100 3.354 2.777 4.026 . 0 0 "[ . 1 . 2]" 1
516 1 23 GLU HA 1 23 GLU HG2 . . 4.140 2.408 2.168 2.599 . 0 0 "[ . 1 . 2]" 1
517 1 23 GLU HA 1 23 GLU QG . . 3.600 2.333 2.130 2.550 . 0 0 "[ . 1 . 2]" 1
518 1 23 GLU HA 1 23 GLU HG3 . . 4.140 3.239 2.646 3.704 . 0 0 "[ . 1 . 2]" 1
519 1 23 GLU HA 1 24 LEU H . . 3.070 2.212 2.139 2.343 . 0 0 "[ . 1 . 2]" 1
520 1 23 GLU HA 1 53 TRP H . . 3.340 3.081 2.541 3.342 0.002 12 0 "[ . 1 . 2]" 1
521 1 23 GLU HA 1 53 TRP HD1 . . 4.540 3.065 2.725 3.294 . 0 0 "[ . 1 . 2]" 1
522 1 23 GLU HB2 1 24 LEU H . . 4.610 4.189 3.901 4.439 . 0 0 "[ . 1 . 2]" 1
523 1 23 GLU HB2 1 53 TRP HD1 . . 5.500 5.429 5.104 5.500 . 18 0 "[ . 1 . 2]" 1
524 1 23 GLU HB3 1 24 LEU H . . 4.170 3.055 2.596 3.530 . 0 0 "[ . 1 . 2]" 1
525 1 23 GLU QG 1 24 LEU H . . 5.070 3.889 3.423 4.335 . 0 0 "[ . 1 . 2]" 1
526 1 23 GLU QG 1 53 TRP H . . 5.340 4.611 3.878 5.052 . 0 0 "[ . 1 . 2]" 1
527 1 23 GLU QG 1 53 TRP HD1 . . 4.350 3.646 3.280 3.948 . 0 0 "[ . 1 . 2]" 1
528 1 23 GLU QG 1 53 TRP HE1 . . 3.850 2.057 1.877 2.317 . 0 0 "[ . 1 . 2]" 1
529 1 23 GLU QG 1 53 TRP HZ2 . . 4.310 2.687 2.263 3.188 . 0 0 "[ . 1 . 2]" 1
530 1 23 GLU HG2 1 53 TRP HE1 . . 4.400 2.371 1.900 3.436 . 0 0 "[ . 1 . 2]" 1
531 1 23 GLU HG2 1 53 TRP HZ2 . . 4.900 2.927 2.349 3.493 . 0 0 "[ . 1 . 2]" 1
532 1 23 GLU HG3 1 53 TRP HE1 . . 4.400 2.788 1.903 3.995 . 0 0 "[ . 1 . 2]" 1
533 1 23 GLU HG3 1 53 TRP HZ2 . . 4.900 3.214 2.621 3.844 . 0 0 "[ . 1 . 2]" 1
534 1 24 LEU H 1 24 LEU HB2 . . 3.510 2.796 2.662 2.998 . 0 0 "[ . 1 . 2]" 1
535 1 24 LEU H 1 24 LEU HB3 . . 3.230 2.523 2.402 2.621 . 0 0 "[ . 1 . 2]" 1
536 1 24 LEU H 1 24 LEU MD1 . . 5.060 4.237 4.109 4.338 . 0 0 "[ . 1 . 2]" 1
537 1 24 LEU H 1 24 LEU MD2 . . 4.580 4.311 4.196 4.439 . 0 0 "[ . 1 . 2]" 1
538 1 24 LEU H 1 24 LEU HG . . 4.630 4.468 4.344 4.533 . 0 0 "[ . 1 . 2]" 1
539 1 24 LEU H 1 25 GLY H . . 4.910 4.326 4.189 4.428 . 0 0 "[ . 1 . 2]" 1
540 1 24 LEU H 1 25 GLY QA . . 5.340 4.739 4.553 4.894 . 0 0 "[ . 1 . 2]" 1
541 1 24 LEU H 1 52 GLY HA2 . . 5.500 5.300 4.868 5.499 . 0 0 "[ . 1 . 2]" 1
542 1 24 LEU H 1 52 GLY HA3 . . 4.350 3.814 3.466 4.056 . 0 0 "[ . 1 . 2]" 1
543 1 24 LEU H 1 54 PHE HB3 . . 4.510 2.918 2.698 3.208 . 0 0 "[ . 1 . 2]" 1
544 1 24 LEU H 1 54 PHE QD . . 4.070 4.015 3.906 4.068 . 0 0 "[ . 1 . 2]" 1
545 1 24 LEU HA 1 24 LEU MD1 . . 2.920 2.185 1.991 2.415 . 0 0 "[ . 1 . 2]" 1
546 1 24 LEU HA 1 24 LEU MD2 . . 4.310 3.900 3.860 3.952 . 0 0 "[ . 1 . 2]" 1
547 1 24 LEU HA 1 24 LEU HG . . 4.250 3.058 2.996 3.146 . 0 0 "[ . 1 . 2]" 1
548 1 24 LEU HA 1 25 GLY H . . 2.910 2.150 2.143 2.165 . 0 0 "[ . 1 . 2]" 1
549 1 24 LEU HB2 1 24 LEU MD2 . . 3.590 2.438 2.317 2.535 . 0 0 "[ . 1 . 2]" 1
550 1 24 LEU HB2 1 52 GLY H . . 3.680 2.803 2.453 3.024 . 0 0 "[ . 1 . 2]" 1
551 1 24 LEU HB2 1 52 GLY HA2 . . 4.590 4.175 3.579 4.480 . 0 0 "[ . 1 . 2]" 1
552 1 24 LEU HB2 1 52 GLY HA3 . . 3.800 2.730 2.168 3.062 . 0 0 "[ . 1 . 2]" 1
553 1 24 LEU HB2 1 53 TRP H . . 4.820 4.005 3.549 4.285 . 0 0 "[ . 1 . 2]" 1
554 1 24 LEU HB2 1 54 PHE HB3 . . 4.790 3.996 3.609 4.339 . 0 0 "[ . 1 . 2]" 1
555 1 24 LEU HB2 1 54 PHE QD . . 3.950 3.409 3.145 3.643 . 0 0 "[ . 1 . 2]" 1
556 1 24 LEU HB2 1 54 PHE QE . . 5.220 5.092 4.865 5.221 0.001 17 0 "[ . 1 . 2]" 1
557 1 24 LEU HB3 1 24 LEU MD2 . . 3.250 2.223 2.120 2.357 . 0 0 "[ . 1 . 2]" 1
558 1 24 LEU HB3 1 25 GLY H . . 4.440 4.311 4.224 4.395 . 0 0 "[ . 1 . 2]" 1
559 1 24 LEU HB3 1 26 PHE QD . . 4.530 3.873 3.421 4.222 . 0 0 "[ . 1 . 2]" 1
560 1 24 LEU HB3 1 26 PHE QE . . 4.830 3.715 3.404 4.021 . 0 0 "[ . 1 . 2]" 1
561 1 24 LEU HB3 1 52 GLY H . . 4.440 4.161 3.796 4.440 . 0 0 "[ . 1 . 2]" 1
562 1 24 LEU HB3 1 52 GLY HA3 . . 4.490 4.221 3.756 4.490 . 0 0 "[ . 1 . 2]" 1
563 1 24 LEU HB3 1 53 TRP H . . 5.500 4.720 4.292 4.930 . 0 0 "[ . 1 . 2]" 1
564 1 24 LEU HB3 1 54 PHE HB2 . . 4.730 4.046 3.687 4.351 . 0 0 "[ . 1 . 2]" 1
565 1 24 LEU HB3 1 54 PHE HB3 . . 4.200 2.501 2.181 2.805 . 0 0 "[ . 1 . 2]" 1
566 1 24 LEU HB3 1 54 PHE QD . . 3.660 2.267 2.075 2.448 . 0 0 "[ . 1 . 2]" 1
567 1 24 LEU HB3 1 54 PHE QE . . 5.020 4.301 4.173 4.434 . 0 0 "[ . 1 . 2]" 1
568 1 24 LEU MD1 1 25 GLY H . . 3.440 2.916 2.458 3.144 . 0 0 "[ . 1 . 2]" 1
569 1 24 LEU MD1 1 25 GLY QA . . 4.450 4.310 4.061 4.437 . 0 0 "[ . 1 . 2]" 1
570 1 24 LEU MD1 1 26 PHE QD . . 4.480 4.283 4.008 4.416 . 0 0 "[ . 1 . 2]" 1
571 1 24 LEU MD1 1 26 PHE QE . . 5.500 5.439 5.323 5.502 0.002 2 0 "[ . 1 . 2]" 1
572 1 24 LEU MD1 1 46 GLU HA . . 3.640 3.481 3.187 3.641 0.001 13 0 "[ . 1 . 2]" 1
573 1 24 LEU MD1 1 46 GLU QG . . 4.810 4.502 4.285 4.725 . 0 0 "[ . 1 . 2]" 1
574 1 24 LEU MD1 1 47 LEU H . . 3.400 2.687 2.340 3.148 . 0 0 "[ . 1 . 2]" 1
575 1 24 LEU MD1 1 47 LEU HB3 . . 2.920 2.583 2.289 2.847 . 0 0 "[ . 1 . 2]" 1
576 1 24 LEU MD1 1 50 LEU H . . 4.170 3.776 3.471 4.171 0.001 16 0 "[ . 1 . 2]" 1
577 1 24 LEU MD1 1 51 ARG H . . 3.940 3.843 3.473 3.941 0.001 19 0 "[ . 1 . 2]" 1
578 1 24 LEU MD1 1 51 ARG HA . . 3.490 3.255 2.381 3.441 . 0 0 "[ . 1 . 2]" 1
579 1 24 LEU MD1 1 52 GLY H . . 3.840 2.947 2.252 3.287 . 0 0 "[ . 1 . 2]" 1
580 1 24 LEU MD1 1 52 GLY HA2 . . 5.500 4.806 4.184 5.118 . 0 0 "[ . 1 . 2]" 1
581 1 24 LEU MD1 1 52 GLY HA3 . . 4.460 3.674 3.115 4.044 . 0 0 "[ . 1 . 2]" 1
582 1 24 LEU MD1 1 54 PHE QE . . 5.500 5.248 5.033 5.387 . 0 0 "[ . 1 . 2]" 1
583 1 24 LEU MD2 1 25 GLY H . . 5.090 4.796 4.593 4.959 . 0 0 "[ . 1 . 2]" 1
584 1 24 LEU MD2 1 26 PHE HB3 . . 5.000 4.391 3.875 4.700 . 0 0 "[ . 1 . 2]" 1
585 1 24 LEU MD2 1 26 PHE QD . . 3.690 3.460 3.117 3.679 . 0 0 "[ . 1 . 2]" 1
586 1 24 LEU MD2 1 26 PHE QE . . 4.540 4.074 3.821 4.289 . 0 0 "[ . 1 . 2]" 1
587 1 24 LEU MD2 1 32 ILE HA . . 4.870 4.728 4.515 4.873 0.003 13 0 "[ . 1 . 2]" 1
588 1 24 LEU MD2 1 32 ILE HB . . 4.450 4.235 3.994 4.436 . 0 0 "[ . 1 . 2]" 1
589 1 24 LEU MD2 1 32 ILE MD . . 3.410 3.123 2.723 3.347 . 0 0 "[ . 1 . 2]" 1
590 1 24 LEU MD2 1 32 ILE MG . . 3.350 2.058 1.916 2.205 . 0 0 "[ . 1 . 2]" 1
591 1 24 LEU MD2 1 45 GLY H . . 4.300 2.786 2.485 2.903 . 0 0 "[ . 1 . 2]" 1
592 1 24 LEU MD2 1 45 GLY HA2 . . 4.680 4.160 4.006 4.373 . 0 0 "[ . 1 . 2]" 1
593 1 24 LEU MD2 1 45 GLY HA3 . . 3.960 3.087 2.885 3.364 . 0 0 "[ . 1 . 2]" 1
594 1 24 LEU MD2 1 46 GLU H . . 4.330 3.459 3.228 3.672 . 0 0 "[ . 1 . 2]" 1
595 1 24 LEU MD2 1 46 GLU HA . . 4.180 2.928 2.537 3.265 . 0 0 "[ . 1 . 2]" 1
596 1 24 LEU MD2 1 47 LEU H . . 4.170 3.094 2.419 3.865 . 0 0 "[ . 1 . 2]" 1
597 1 24 LEU MD2 1 47 LEU HB2 . . 3.720 2.987 2.653 3.438 . 0 0 "[ . 1 . 2]" 1
598 1 24 LEU MD2 1 47 LEU HB3 . . 4.140 2.971 2.591 3.346 . 0 0 "[ . 1 . 2]" 1
599 1 24 LEU MD2 1 51 ARG HA . . 4.250 3.378 2.450 3.643 . 0 0 "[ . 1 . 2]" 1
600 1 24 LEU MD2 1 52 GLY H . . 4.130 2.745 2.324 3.077 . 0 0 "[ . 1 . 2]" 1
601 1 24 LEU MD2 1 54 PHE HB3 . . 4.880 3.785 3.501 4.197 . 0 0 "[ . 1 . 2]" 1
602 1 24 LEU MD2 1 54 PHE QD . . 3.640 2.244 1.994 2.653 . 0 0 "[ . 1 . 2]" 1
603 1 24 LEU MD2 1 54 PHE QE . . 3.790 2.695 2.435 2.904 . 0 0 "[ . 1 . 2]" 1
604 1 24 LEU HG 1 25 GLY H . . 3.720 3.419 3.138 3.645 . 0 0 "[ . 1 . 2]" 1
605 1 24 LEU HG 1 26 PHE QD . . 3.610 2.788 2.448 2.943 . 0 0 "[ . 1 . 2]" 1
606 1 24 LEU HG 1 32 ILE MD . . 4.470 3.860 3.601 4.108 . 0 0 "[ . 1 . 2]" 1
607 1 24 LEU HG 1 32 ILE MG . . 4.680 3.843 3.580 4.067 . 0 0 "[ . 1 . 2]" 1
608 1 24 LEU HG 1 47 LEU HB3 . . 4.840 3.486 3.153 4.213 . 0 0 "[ . 1 . 2]" 1
609 1 24 LEU HG 1 54 PHE QD . . 4.910 4.050 3.746 4.313 . 0 0 "[ . 1 . 2]" 1
610 1 25 GLY H 1 26 PHE H . . 4.820 4.569 4.435 4.612 . 0 0 "[ . 1 . 2]" 1
611 1 25 GLY QA 1 26 PHE H . . 2.900 2.215 2.110 2.283 . 0 0 "[ . 1 . 2]" 1
612 1 25 GLY QA 1 26 PHE QD . . 5.160 3.267 3.042 3.735 . 0 0 "[ . 1 . 2]" 1
613 1 25 GLY QA 1 26 PHE QE . . 5.290 3.917 3.585 4.422 . 0 0 "[ . 1 . 2]" 1
614 1 25 GLY HA2 1 26 PHE H . . 3.400 2.328 2.138 2.529 . 0 0 "[ . 1 . 2]" 1
615 1 25 GLY HA3 1 26 PHE H . . 3.400 2.850 2.599 3.249 . 0 0 "[ . 1 . 2]" 1
616 1 26 PHE H 1 26 PHE QD . . 4.220 3.248 2.802 3.458 . 0 0 "[ . 1 . 2]" 1
617 1 26 PHE H 1 27 ARG H . . 5.020 4.370 4.287 4.471 . 0 0 "[ . 1 . 2]" 1
618 1 26 PHE H 1 47 LEU MD2 . . 4.950 4.697 4.336 4.950 0.000 16 0 "[ . 1 . 2]" 1
619 1 26 PHE HB2 1 27 ARG H . . 3.160 2.241 1.968 2.680 . 0 0 "[ . 1 . 2]" 1
620 1 26 PHE HB2 1 30 ASP HB2 . . 3.810 2.758 2.540 2.984 . 0 0 "[ . 1 . 2]" 1
621 1 26 PHE HB2 1 30 ASP HB3 . . 4.150 3.463 3.100 3.787 . 0 0 "[ . 1 . 2]" 1
622 1 26 PHE HB2 1 32 ILE MD . . 3.810 2.566 2.328 3.086 . 0 0 "[ . 1 . 2]" 1
623 1 26 PHE HB2 1 47 LEU MD2 . . 3.580 3.008 2.700 3.247 . 0 0 "[ . 1 . 2]" 1
624 1 26 PHE HB3 1 27 ARG H . . 3.660 3.436 3.261 3.664 0.004 16 0 "[ . 1 . 2]" 1
625 1 26 PHE HB3 1 30 ASP HB2 . . 4.370 4.196 3.998 4.368 . 0 0 "[ . 1 . 2]" 1
626 1 26 PHE HB3 1 30 ASP HB3 . . 4.640 4.314 3.960 4.608 . 0 0 "[ . 1 . 2]" 1
627 1 26 PHE HB3 1 32 ILE MD . . 3.750 2.111 1.925 2.472 . 0 0 "[ . 1 . 2]" 1
628 1 26 PHE HB3 1 47 LEU MD1 . . 4.680 4.061 3.858 4.390 . 0 0 "[ . 1 . 2]" 1
629 1 26 PHE HB3 1 47 LEU MD2 . . 3.330 2.150 1.911 2.536 . 0 0 "[ . 1 . 2]" 1
630 1 26 PHE QD 1 27 ARG H . . 4.060 3.647 3.265 4.065 0.005 20 0 "[ . 1 . 2]" 1
631 1 26 PHE QD 1 27 ARG HA . . 4.940 4.160 3.790 4.456 . 0 0 "[ . 1 . 2]" 1
632 1 26 PHE QD 1 30 ASP HB2 . . 4.660 3.789 3.423 4.043 . 0 0 "[ . 1 . 2]" 1
633 1 26 PHE QD 1 32 ILE MD . . 3.430 2.402 1.958 2.671 . 0 0 "[ . 1 . 2]" 1
634 1 26 PHE QD 1 32 ILE MG . . 4.450 4.164 3.945 4.398 . 0 0 "[ . 1 . 2]" 1
635 1 26 PHE QD 1 47 LEU MD2 . . 4.220 3.553 3.229 4.059 . 0 0 "[ . 1 . 2]" 1
636 1 26 PHE QD 1 54 PHE HB3 . . 4.750 4.462 4.217 4.750 0.000 17 0 "[ . 1 . 2]" 1
637 1 26 PHE QE 1 32 ILE MD . . 3.750 3.311 3.161 3.479 . 0 0 "[ . 1 . 2]" 1
638 1 26 PHE QE 1 54 PHE HB2 . . 3.560 2.288 2.082 2.502 . 0 0 "[ . 1 . 2]" 1
639 1 26 PHE QE 1 54 PHE HB3 . . 3.570 2.808 2.463 3.134 . 0 0 "[ . 1 . 2]" 1
640 1 26 PHE QE 1 55 PRO HD2 . . 4.570 3.722 3.421 3.939 . 0 0 "[ . 1 . 2]" 1
641 1 26 PHE QE 1 58 PHE HB3 . . 3.840 2.660 2.406 2.990 . 0 0 "[ . 1 . 2]" 1
642 1 26 PHE QE 1 59 VAL H . . 5.240 4.927 4.729 5.108 . 0 0 "[ . 1 . 2]" 1
643 1 26 PHE QE 1 59 VAL HA . . 5.000 4.588 4.295 4.886 . 0 0 "[ . 1 . 2]" 1
644 1 26 PHE QE 1 59 VAL MG1 . . 3.150 2.659 2.420 2.849 . 0 0 "[ . 1 . 2]" 1
645 1 26 PHE QE 1 59 VAL MG2 . . 4.960 4.709 4.510 4.902 . 0 0 "[ . 1 . 2]" 1
646 1 26 PHE HZ 1 54 PHE HB2 . . 4.430 3.184 2.837 3.467 . 0 0 "[ . 1 . 2]" 1
647 1 26 PHE HZ 1 54 PHE HB3 . . 5.250 4.631 4.267 4.917 . 0 0 "[ . 1 . 2]" 1
648 1 26 PHE HZ 1 54 PHE QD . . 3.930 3.654 3.282 3.875 . 0 0 "[ . 1 . 2]" 1
649 1 26 PHE HZ 1 55 PRO HD2 . . 4.800 3.575 3.238 3.874 . 0 0 "[ . 1 . 2]" 1
650 1 26 PHE HZ 1 58 PHE H . . 5.060 4.953 4.666 5.061 0.001 16 0 "[ . 1 . 2]" 1
651 1 26 PHE HZ 1 58 PHE HB2 . . 3.620 2.917 2.659 3.057 . 0 0 "[ . 1 . 2]" 1
652 1 26 PHE HZ 1 58 PHE HB3 . . 3.720 2.786 2.492 3.106 . 0 0 "[ . 1 . 2]" 1
653 1 26 PHE HZ 1 58 PHE QD . . 4.240 3.966 3.706 4.180 . 0 0 "[ . 1 . 2]" 1
654 1 26 PHE HZ 1 59 VAL MG1 . . 3.510 2.669 2.440 2.904 . 0 0 "[ . 1 . 2]" 1
655 1 27 ARG H 1 27 ARG HB2 . . 3.390 2.447 2.219 2.678 . 0 0 "[ . 1 . 2]" 1
656 1 27 ARG H 1 27 ARG HB3 . . 3.870 3.645 3.502 3.799 . 0 0 "[ . 1 . 2]" 1
657 1 27 ARG H 1 27 ARG QD . . 4.680 3.753 2.123 4.627 . 0 0 "[ . 1 . 2]" 1
658 1 27 ARG H 1 27 ARG HG2 . . 4.320 3.441 2.747 4.193 . 0 0 "[ . 1 . 2]" 1
659 1 27 ARG H 1 27 ARG QG . . 3.670 3.247 2.685 3.692 0.022 16 0 "[ . 1 . 2]" 1
660 1 27 ARG H 1 27 ARG HG3 . . 4.320 4.117 3.786 4.290 . 0 0 "[ . 1 . 2]" 1
661 1 27 ARG H 1 28 LYS H . . 4.910 4.496 4.459 4.575 . 0 0 "[ . 1 . 2]" 1
662 1 27 ARG H 1 30 ASP H . . 5.110 5.014 4.750 5.108 . 0 0 "[ . 1 . 2]" 1
663 1 27 ARG H 1 30 ASP HB2 . . 3.800 2.878 2.547 3.095 . 0 0 "[ . 1 . 2]" 1
664 1 27 ARG H 1 30 ASP HB3 . . 4.270 3.468 3.284 3.560 . 0 0 "[ . 1 . 2]" 1
665 1 27 ARG H 1 32 ILE MD . . 4.790 4.449 4.110 4.781 . 0 0 "[ . 1 . 2]" 1
666 1 27 ARG H 1 47 LEU MD2 . . 4.160 3.517 3.341 3.660 . 0 0 "[ . 1 . 2]" 1
667 1 27 ARG HA 1 27 ARG QD . . 3.500 2.296 2.002 2.553 . 0 0 "[ . 1 . 2]" 1
668 1 27 ARG HA 1 27 ARG HG2 . . 3.960 2.983 2.433 3.709 . 0 0 "[ . 1 . 2]" 1
669 1 27 ARG HA 1 27 ARG QG . . 3.420 2.590 2.349 2.838 . 0 0 "[ . 1 . 2]" 1
670 1 27 ARG HA 1 27 ARG HG3 . . 3.960 3.367 2.380 3.827 . 0 0 "[ . 1 . 2]" 1
671 1 27 ARG HA 1 28 LYS H . . 2.980 2.461 2.311 2.625 . 0 0 "[ . 1 . 2]" 1
672 1 27 ARG HA 1 28 LYS HB2 . . 5.220 4.588 4.475 4.699 . 0 0 "[ . 1 . 2]" 1
673 1 27 ARG HA 1 28 LYS QB . . 4.510 4.256 4.211 4.334 . 0 0 "[ . 1 . 2]" 1
674 1 27 ARG HA 1 28 LYS HB3 . . 5.220 5.046 4.874 5.217 . 0 0 "[ . 1 . 2]" 1
675 1 27 ARG HB2 1 28 LYS H . . 3.960 3.653 3.356 3.923 . 0 0 "[ . 1 . 2]" 1
676 1 27 ARG HB3 1 27 ARG QD . . 3.450 2.636 2.155 3.401 . 0 0 "[ . 1 . 2]" 1
677 1 27 ARG HB3 1 28 LYS H . . 3.470 2.321 1.968 2.660 . 0 0 "[ . 1 . 2]" 1
678 1 27 ARG HB3 1 28 LYS QB . . 4.540 3.904 3.711 4.024 . 0 0 "[ . 1 . 2]" 1
679 1 27 ARG QD 1 28 LYS H . . 4.460 3.458 2.475 4.465 0.005 16 0 "[ . 1 . 2]" 1
680 1 27 ARG QG 1 28 LYS H . . 4.410 3.886 3.211 4.392 . 0 0 "[ . 1 . 2]" 1
681 1 28 LYS H 1 28 LYS HB2 . . 3.210 2.463 2.278 2.590 . 0 0 "[ . 1 . 2]" 1
682 1 28 LYS H 1 28 LYS HB3 . . 3.210 2.595 2.481 2.795 . 0 0 "[ . 1 . 2]" 1
683 1 28 LYS H 1 28 LYS QD . . 4.590 4.421 4.290 4.590 . 0 0 "[ . 1 . 2]" 1
684 1 28 LYS H 1 28 LYS HG2 . . 4.850 4.487 4.434 4.563 . 0 0 "[ . 1 . 2]" 1
685 1 28 LYS H 1 28 LYS HG3 . . 4.500 4.413 4.262 4.481 . 0 0 "[ . 1 . 2]" 1
686 1 28 LYS HA 1 28 LYS QD . . 4.410 4.033 3.794 4.216 . 0 0 "[ . 1 . 2]" 1
687 1 28 LYS HA 1 28 LYS HG2 . . 3.830 3.060 2.640 3.333 . 0 0 "[ . 1 . 2]" 1
688 1 28 LYS HA 1 28 LYS HG3 . . 3.320 2.544 2.371 2.755 . 0 0 "[ . 1 . 2]" 1
689 1 28 LYS HA 1 29 ASN H . . 2.750 2.208 2.160 2.241 . 0 0 "[ . 1 . 2]" 1
690 1 28 LYS HA 1 29 ASN HA . . 4.500 4.405 4.385 4.424 . 0 0 "[ . 1 . 2]" 1
691 1 28 LYS HA 1 30 ASP H . . 4.130 3.716 3.496 3.988 . 0 0 "[ . 1 . 2]" 1
692 1 28 LYS QB 1 29 ASN H . . 3.950 3.599 3.504 3.730 . 0 0 "[ . 1 . 2]" 1
693 1 28 LYS HB2 1 29 ASN H . . 4.690 4.134 4.030 4.220 . 0 0 "[ . 1 . 2]" 1
694 1 28 LYS HB3 1 29 ASN H . . 4.690 3.962 3.754 4.156 . 0 0 "[ . 1 . 2]" 1
695 1 28 LYS QD 1 29 ASN H . . 5.500 4.479 4.156 4.700 . 0 0 "[ . 1 . 2]" 1
696 1 28 LYS QD 1 29 ASN QB . . 5.340 4.563 3.733 5.297 . 0 0 "[ . 1 . 2]" 1
697 1 28 LYS QD 1 29 ASN HD21 . . 4.890 3.940 2.799 4.749 . 0 0 "[ . 1 . 2]" 1
698 1 28 LYS QD 1 29 ASN HD22 . . 4.890 3.618 2.517 4.887 . 0 0 "[ . 1 . 2]" 1
699 1 28 LYS QE 1 28 LYS HG2 . . 3.730 2.739 2.150 3.286 . 0 0 "[ . 1 . 2]" 1
700 1 28 LYS QE 1 28 LYS HG3 . . 3.860 2.400 2.094 3.303 . 0 0 "[ . 1 . 2]" 1
701 1 28 LYS QE 1 29 ASN QD . . 5.230 3.467 1.983 4.634 . 0 0 "[ . 1 . 2]" 1
702 1 28 LYS HG2 1 29 ASN H . . 4.110 2.693 2.277 3.112 . 0 0 "[ . 1 . 2]" 1
703 1 28 LYS HG2 1 29 ASN HA . . 4.990 4.016 3.766 4.350 . 0 0 "[ . 1 . 2]" 1
704 1 28 LYS HG2 1 29 ASN QB . . 4.760 3.325 2.850 3.711 . 0 0 "[ . 1 . 2]" 1
705 1 28 LYS HG2 1 29 ASN HD21 . . 4.880 3.087 1.942 4.412 . 0 0 "[ . 1 . 2]" 1
706 1 28 LYS HG2 1 29 ASN QD . . 4.280 2.671 1.918 3.674 . 0 0 "[ . 1 . 2]" 1
707 1 28 LYS HG2 1 29 ASN HD22 . . 4.880 3.073 2.227 4.060 . 0 0 "[ . 1 . 2]" 1
708 1 28 LYS HG3 1 29 ASN H . . 3.650 2.927 2.554 3.457 . 0 0 "[ . 1 . 2]" 1
709 1 29 ASN H 1 29 ASN HA . . 2.860 2.275 2.273 2.283 . 0 0 "[ . 1 . 2]" 1
710 1 29 ASN H 1 30 ASP H . . 3.720 2.703 2.494 2.789 . 0 0 "[ . 1 . 2]" 1
711 1 29 ASN HA 1 30 ASP HB2 . . 5.500 5.199 5.095 5.279 . 0 0 "[ . 1 . 2]" 1
712 1 29 ASN QB 1 29 ASN QD . . 3.030 2.165 2.062 2.660 . 0 0 "[ . 1 . 2]" 1
713 1 30 ASP H 1 30 ASP HB2 . . 3.270 2.487 2.372 2.601 . 0 0 "[ . 1 . 2]" 1
714 1 30 ASP H 1 30 ASP HB3 . . 3.750 3.683 3.601 3.750 . 0 0 "[ . 1 . 2]" 1
715 1 30 ASP HA 1 31 ILE H . . 2.770 2.196 2.143 2.253 . 0 0 "[ . 1 . 2]" 1
716 1 30 ASP HA 1 31 ILE HB . . 4.920 4.703 4.652 4.782 . 0 0 "[ . 1 . 2]" 1
717 1 30 ASP HA 1 31 ILE MD . . 4.640 4.188 3.844 4.458 . 0 0 "[ . 1 . 2]" 1
718 1 30 ASP HA 1 31 ILE HG12 . . 4.770 3.608 3.393 3.850 . 0 0 "[ . 1 . 2]" 1
719 1 30 ASP HB2 1 31 ILE H . . 4.480 4.175 4.037 4.373 . 0 0 "[ . 1 . 2]" 1
720 1 30 ASP HB2 1 32 ILE MD . . 4.010 3.666 3.440 3.986 . 0 0 "[ . 1 . 2]" 1
721 1 30 ASP HB2 1 47 LEU MD1 . . 4.580 4.416 4.175 4.581 0.001 17 0 "[ . 1 . 2]" 1
722 1 30 ASP HB2 1 47 LEU MD2 . . 4.140 3.917 3.596 4.132 . 0 0 "[ . 1 . 2]" 1
723 1 30 ASP HB3 1 31 ILE H . . 3.480 3.083 2.845 3.416 . 0 0 "[ . 1 . 2]" 1
724 1 30 ASP HB3 1 32 ILE MD . . 4.090 3.936 3.554 4.080 . 0 0 "[ . 1 . 2]" 1
725 1 30 ASP HB3 1 47 LEU MD1 . . 3.400 3.074 2.739 3.318 . 0 0 "[ . 1 . 2]" 1
726 1 30 ASP HB3 1 47 LEU MD2 . . 3.610 3.083 2.508 3.333 . 0 0 "[ . 1 . 2]" 1
727 1 31 ILE H 1 31 ILE HB . . 3.080 2.561 2.519 2.640 . 0 0 "[ . 1 . 2]" 1
728 1 31 ILE H 1 31 ILE MD . . 4.020 3.389 2.989 3.678 . 0 0 "[ . 1 . 2]" 1
729 1 31 ILE H 1 31 ILE HG12 . . 3.520 2.350 2.096 2.470 . 0 0 "[ . 1 . 2]" 1
730 1 31 ILE H 1 31 ILE HG13 . . 3.850 3.765 3.583 3.851 0.001 17 0 "[ . 1 . 2]" 1
731 1 31 ILE H 1 31 ILE MG . . 3.990 3.801 3.780 3.825 . 0 0 "[ . 1 . 2]" 1
732 1 31 ILE H 1 32 ILE H . . 4.740 4.486 4.418 4.567 . 0 0 "[ . 1 . 2]" 1
733 1 31 ILE H 1 47 LEU MD1 . . 3.930 3.822 3.356 3.923 . 0 0 "[ . 1 . 2]" 1
734 1 31 ILE HB 1 31 ILE MD . . 3.680 3.220 3.209 3.230 . 0 0 "[ . 1 . 2]" 1
735 1 31 ILE HB 1 32 ILE H . . 4.630 4.134 3.958 4.235 . 0 0 "[ . 1 . 2]" 1
736 1 31 ILE HB 1 32 ILE HA . . 5.270 4.699 4.559 4.778 . 0 0 "[ . 1 . 2]" 1
737 1 31 ILE HB 1 32 ILE HG13 . . 5.300 5.166 5.003 5.284 . 0 0 "[ . 1 . 2]" 1
738 1 31 ILE MD 1 32 ILE H . . 4.050 3.625 3.445 3.783 . 0 0 "[ . 1 . 2]" 1
739 1 31 ILE HG12 1 31 ILE MG . . 3.260 3.187 3.177 3.201 . 0 0 "[ . 1 . 2]" 1
740 1 31 ILE HG13 1 31 ILE MG . . 3.310 2.339 2.218 2.453 . 0 0 "[ . 1 . 2]" 1
741 1 31 ILE MG 1 32 ILE H . . 3.260 2.429 2.174 2.723 . 0 0 "[ . 1 . 2]" 1
742 1 31 ILE MG 1 32 ILE HA . . 4.250 3.694 3.476 3.822 . 0 0 "[ . 1 . 2]" 1
743 1 31 ILE MG 1 33 THR H . . 4.470 4.261 4.046 4.465 . 0 0 "[ . 1 . 2]" 1
744 1 31 ILE MG 1 33 THR HA . . 4.790 4.217 4.073 4.315 . 0 0 "[ . 1 . 2]" 1
745 1 32 ILE H 1 32 ILE HB . . 3.230 2.715 2.629 2.836 . 0 0 "[ . 1 . 2]" 1
746 1 32 ILE H 1 32 ILE MD . . 3.800 3.684 3.588 3.791 . 0 0 "[ . 1 . 2]" 1
747 1 32 ILE H 1 32 ILE HG12 . . 4.260 4.199 4.057 4.261 0.001 20 0 "[ . 1 . 2]" 1
748 1 32 ILE H 1 32 ILE HG13 . . 3.750 2.844 2.642 2.932 . 0 0 "[ . 1 . 2]" 1
749 1 32 ILE H 1 32 ILE MG . . 4.030 3.878 3.846 3.929 . 0 0 "[ . 1 . 2]" 1
750 1 32 ILE HA 1 32 ILE MD . . 4.050 3.900 3.884 3.954 . 0 0 "[ . 1 . 2]" 1
751 1 32 ILE HA 1 32 ILE HG12 . . 3.760 2.817 2.755 2.900 . 0 0 "[ . 1 . 2]" 1
752 1 32 ILE HA 1 32 ILE HG13 . . 3.720 2.763 2.713 2.898 . 0 0 "[ . 1 . 2]" 1
753 1 32 ILE HA 1 32 ILE MG . . 3.180 2.399 2.311 2.440 . 0 0 "[ . 1 . 2]" 1
754 1 32 ILE HA 1 33 THR H . . 2.850 2.158 2.145 2.224 . 0 0 "[ . 1 . 2]" 1
755 1 32 ILE HA 1 47 LEU HB2 . . 4.000 3.181 2.579 3.292 . 0 0 "[ . 1 . 2]" 1
756 1 32 ILE HA 1 47 LEU HB3 . . 4.990 4.892 4.309 4.990 0.000 19 0 "[ . 1 . 2]" 1
757 1 32 ILE HA 1 47 LEU MD1 . . 3.590 2.257 1.988 3.180 . 0 0 "[ . 1 . 2]" 1
758 1 32 ILE HA 1 47 LEU MD2 . . 4.850 4.185 3.845 4.617 . 0 0 "[ . 1 . 2]" 1
759 1 32 ILE HB 1 32 ILE MD . . 3.220 2.212 2.099 2.304 . 0 0 "[ . 1 . 2]" 1
760 1 32 ILE HB 1 33 THR H . . 4.210 4.127 3.875 4.202 . 0 0 "[ . 1 . 2]" 1
761 1 32 ILE HB 1 59 VAL MG1 . . 4.620 4.070 3.880 4.396 . 0 0 "[ . 1 . 2]" 1
762 1 32 ILE MD 1 32 ILE MG . . 3.230 2.351 2.186 2.481 . 0 0 "[ . 1 . 2]" 1
763 1 32 ILE MD 1 33 THR H . . 5.500 5.225 5.039 5.292 . 0 0 "[ . 1 . 2]" 1
764 1 32 ILE MD 1 47 LEU HB2 . . 4.820 3.848 3.521 4.063 . 0 0 "[ . 1 . 2]" 1
765 1 32 ILE MD 1 47 LEU HB3 . . 4.520 4.281 3.891 4.521 0.001 16 0 "[ . 1 . 2]" 1
766 1 32 ILE MD 1 47 LEU MD1 . . 4.210 3.596 3.355 3.931 . 0 0 "[ . 1 . 2]" 1
767 1 32 ILE MD 1 47 LEU MD2 . . 3.900 2.809 2.564 3.175 . 0 0 "[ . 1 . 2]" 1
768 1 32 ILE MD 1 54 PHE QD . . 5.220 4.178 3.803 4.477 . 0 0 "[ . 1 . 2]" 1
769 1 32 ILE MD 1 54 PHE QE . . 4.160 3.831 3.322 4.115 . 0 0 "[ . 1 . 2]" 1
770 1 32 ILE MD 1 54 PHE HZ . . 5.160 4.189 3.799 4.438 . 0 0 "[ . 1 . 2]" 1
771 1 32 ILE MD 1 59 VAL HB . . 4.780 4.103 3.846 4.491 . 0 0 "[ . 1 . 2]" 1
772 1 32 ILE MD 1 59 VAL MG1 . . 3.130 2.616 2.421 2.865 . 0 0 "[ . 1 . 2]" 1
773 1 32 ILE HG12 1 32 ILE MG . . 3.040 2.160 2.060 2.251 . 0 0 "[ . 1 . 2]" 1
774 1 32 ILE HG12 1 47 LEU HB2 . . 4.610 2.390 2.046 2.611 . 0 0 "[ . 1 . 2]" 1
775 1 32 ILE HG12 1 47 LEU HB3 . . 5.000 3.400 2.818 3.569 . 0 0 "[ . 1 . 2]" 1
776 1 32 ILE HG12 1 59 VAL MG1 . . 5.500 5.208 4.963 5.483 . 0 0 "[ . 1 . 2]" 1
777 1 32 ILE HG13 1 47 LEU HB2 . . 4.210 3.897 3.413 4.153 . 0 0 "[ . 1 . 2]" 1
778 1 32 ILE HG13 1 47 LEU HB3 . . 5.220 5.052 4.481 5.218 . 0 0 "[ . 1 . 2]" 1
779 1 32 ILE HG13 1 47 LEU MD2 . . 4.480 3.135 2.809 3.665 . 0 0 "[ . 1 . 2]" 1
780 1 32 ILE HG13 1 59 VAL MG1 . . 4.970 4.727 4.562 4.891 . 0 0 "[ . 1 . 2]" 1
781 1 32 ILE MG 1 33 THR H . . 3.360 2.523 2.035 2.684 . 0 0 "[ . 1 . 2]" 1
782 1 32 ILE MG 1 33 THR HB . . 4.830 3.961 3.691 4.064 . 0 0 "[ . 1 . 2]" 1
783 1 32 ILE MG 1 45 GLY HA2 . . 3.820 3.564 3.286 3.779 . 0 0 "[ . 1 . 2]" 1
784 1 32 ILE MG 1 45 GLY HA3 . . 3.390 2.348 2.144 2.505 . 0 0 "[ . 1 . 2]" 1
785 1 32 ILE MG 1 46 GLU H . . 3.510 2.244 1.923 2.519 . 0 0 "[ . 1 . 2]" 1
786 1 32 ILE MG 1 47 LEU HB2 . . 4.060 2.055 1.977 2.181 . 0 0 "[ . 1 . 2]" 1
787 1 32 ILE MG 1 47 LEU HB3 . . 4.260 3.284 2.765 3.454 . 0 0 "[ . 1 . 2]" 1
788 1 32 ILE MG 1 47 LEU MD2 . . 4.250 3.479 3.205 3.701 . 0 0 "[ . 1 . 2]" 1
789 1 32 ILE MG 1 47 LEU HG . . 4.750 4.687 4.611 4.751 0.001 13 0 "[ . 1 . 2]" 1
790 1 32 ILE MG 1 54 PHE QD . . 4.460 3.856 3.491 4.108 . 0 0 "[ . 1 . 2]" 1
791 1 32 ILE MG 1 54 PHE QE . . 3.440 2.675 2.319 2.993 . 0 0 "[ . 1 . 2]" 1
792 1 32 ILE MG 1 54 PHE HZ . . 4.260 3.548 3.232 3.926 . 0 0 "[ . 1 . 2]" 1
793 1 33 THR H 1 33 THR HB . . 3.250 2.456 2.383 2.510 . 0 0 "[ . 1 . 2]" 1
794 1 33 THR H 1 33 THR MG . . 4.050 3.760 3.737 3.770 . 0 0 "[ . 1 . 2]" 1
795 1 33 THR H 1 46 GLU H . . 3.580 3.017 2.694 3.165 . 0 0 "[ . 1 . 2]" 1
796 1 33 THR H 1 46 GLU HB3 . . 4.430 3.897 3.571 4.158 . 0 0 "[ . 1 . 2]" 1
797 1 33 THR H 1 47 LEU HB2 . . 4.880 4.033 3.683 4.323 . 0 0 "[ . 1 . 2]" 1
798 1 33 THR H 1 47 LEU MD1 . . 5.340 3.572 3.192 4.605 . 0 0 "[ . 1 . 2]" 1
799 1 33 THR HA 1 33 THR MG . . 3.180 2.403 2.329 2.453 . 0 0 "[ . 1 . 2]" 1
800 1 33 THR HA 1 34 ILE H . . 2.920 2.172 2.142 2.199 . 0 0 "[ . 1 . 2]" 1
801 1 33 THR HA 1 34 ILE HG12 . . 5.040 4.865 4.632 4.979 . 0 0 "[ . 1 . 2]" 1
802 1 33 THR HA 1 34 ILE QG . . 4.380 3.608 3.462 3.746 . 0 0 "[ . 1 . 2]" 1
803 1 33 THR HA 1 34 ILE HG13 . . 5.040 3.720 3.574 3.879 . 0 0 "[ . 1 . 2]" 1
804 1 33 THR HB 1 35 ILE MD . . 4.540 3.465 3.242 3.631 . 0 0 "[ . 1 . 2]" 1
805 1 33 THR HB 1 46 GLU H . . 3.730 3.045 2.673 3.379 . 0 0 "[ . 1 . 2]" 1
806 1 33 THR HB 1 46 GLU HB2 . . 3.730 3.555 3.233 3.730 0.000 16 0 "[ . 1 . 2]" 1
807 1 33 THR HB 1 46 GLU HB3 . . 3.320 2.483 2.243 2.631 . 0 0 "[ . 1 . 2]" 1
808 1 33 THR HB 1 46 GLU QG . . 4.530 4.491 4.387 4.532 0.002 17 0 "[ . 1 . 2]" 1
809 1 33 THR MG 1 34 ILE H . . 3.330 2.296 2.030 2.920 . 0 0 "[ . 1 . 2]" 1
810 1 33 THR MG 1 35 ILE MD . . 3.420 2.095 1.983 2.390 . 0 0 "[ . 1 . 2]" 1
811 1 33 THR MG 1 46 GLU H . . 4.570 3.907 3.677 4.144 . 0 0 "[ . 1 . 2]" 1
812 1 33 THR MG 1 46 GLU HB2 . . 4.000 3.742 3.495 3.990 . 0 0 "[ . 1 . 2]" 1
813 1 33 THR MG 1 46 GLU HB3 . . 3.940 3.434 3.170 3.764 . 0 0 "[ . 1 . 2]" 1
814 1 33 THR MG 1 46 GLU QG . . 4.910 4.857 4.758 4.910 0.000 9 0 "[ . 1 . 2]" 1
815 1 34 ILE H 1 34 ILE HB . . 3.190 2.550 2.491 2.636 . 0 0 "[ . 1 . 2]" 1
816 1 34 ILE H 1 34 ILE MD . . 4.060 3.826 3.660 4.030 . 0 0 "[ . 1 . 2]" 1
817 1 34 ILE H 1 34 ILE HG12 . . 3.910 3.491 3.097 3.747 . 0 0 "[ . 1 . 2]" 1
818 1 34 ILE H 1 34 ILE QG . . 3.330 2.349 2.024 2.565 . 0 0 "[ . 1 . 2]" 1
819 1 34 ILE H 1 34 ILE HG13 . . 3.910 2.388 2.050 2.628 . 0 0 "[ . 1 . 2]" 1
820 1 34 ILE H 1 34 ILE MG . . 4.070 3.794 3.767 3.823 . 0 0 "[ . 1 . 2]" 1
821 1 34 ILE H 1 35 ILE H . . 4.940 4.369 4.281 4.491 . 0 0 "[ . 1 . 2]" 1
822 1 34 ILE HA 1 34 ILE MD . . 3.880 3.798 3.735 3.842 . 0 0 "[ . 1 . 2]" 1
823 1 34 ILE HA 1 34 ILE HG12 . . 4.000 2.501 2.423 2.574 . 0 0 "[ . 1 . 2]" 1
824 1 34 ILE HA 1 34 ILE QG . . 3.510 2.406 2.351 2.477 . 0 0 "[ . 1 . 2]" 1
825 1 34 ILE HA 1 34 ILE HG13 . . 4.000 3.135 3.011 3.274 . 0 0 "[ . 1 . 2]" 1
826 1 34 ILE HA 1 34 ILE MG . . 3.190 2.332 2.224 2.454 . 0 0 "[ . 1 . 2]" 1
827 1 34 ILE HA 1 35 ILE H . . 3.070 2.144 2.139 2.151 . 0 0 "[ . 1 . 2]" 1
828 1 34 ILE HA 1 35 ILE HB . . 4.840 4.715 4.664 4.768 . 0 0 "[ . 1 . 2]" 1
829 1 34 ILE HA 1 36 SER H . . 4.420 4.341 4.166 4.418 . 0 0 "[ . 1 . 2]" 1
830 1 34 ILE HA 1 45 GLY HA2 . . 3.610 2.126 2.001 2.362 . 0 0 "[ . 1 . 2]" 1
831 1 34 ILE HA 1 45 GLY HA3 . . 4.020 2.892 2.704 2.994 . 0 0 "[ . 1 . 2]" 1
832 1 34 ILE HA 1 54 PHE QE . . 4.740 4.202 4.053 4.360 . 0 0 "[ . 1 . 2]" 1
833 1 34 ILE HB 1 35 ILE H . . 5.110 4.302 4.203 4.358 . 0 0 "[ . 1 . 2]" 1
834 1 34 ILE MD 1 34 ILE MG . . 2.980 1.991 1.903 2.110 . 0 0 "[ . 1 . 2]" 1
835 1 34 ILE MD 1 35 ILE H . . 5.380 5.239 5.082 5.321 . 0 0 "[ . 1 . 2]" 1
836 1 34 ILE MD 1 37 GLN HE21 . . 4.680 3.295 2.261 3.965 . 0 0 "[ . 1 . 2]" 1
837 1 34 ILE MD 1 37 GLN QE . . 4.080 2.921 2.212 3.559 . 0 0 "[ . 1 . 2]" 1
838 1 34 ILE MD 1 37 GLN HE22 . . 4.680 3.597 2.570 4.320 . 0 0 "[ . 1 . 2]" 1
839 1 34 ILE MD 1 43 TRP HB2 . . 4.530 4.341 4.073 4.533 0.003 17 0 "[ . 1 . 2]" 1
840 1 34 ILE MD 1 43 TRP HB3 . . 4.320 3.794 3.355 4.119 . 0 0 "[ . 1 . 2]" 1
841 1 34 ILE MD 1 43 TRP HE3 . . 3.480 2.592 2.284 2.845 . 0 0 "[ . 1 . 2]" 1
842 1 34 ILE MD 1 43 TRP HZ3 . . 3.650 3.185 2.769 3.403 . 0 0 "[ . 1 . 2]" 1
843 1 34 ILE MD 1 45 GLY HA3 . . 5.500 5.356 5.202 5.476 . 0 0 "[ . 1 . 2]" 1
844 1 34 ILE MD 1 54 PHE HZ . . 3.680 3.645 3.441 3.680 . 0 0 "[ . 1 . 2]" 1
845 1 34 ILE MD 1 56 ALA MB . . 4.750 4.583 4.287 4.743 . 0 0 "[ . 1 . 2]" 1
846 1 34 ILE MD 1 61 VAL HA . . 4.430 3.664 3.359 4.097 . 0 0 "[ . 1 . 2]" 1
847 1 34 ILE MD 1 61 VAL QG . . 3.450 2.932 2.699 3.206 . 0 0 "[ . 1 . 2]" 1
848 1 34 ILE QG 1 34 ILE MG . . 3.030 2.344 2.245 2.404 . 0 0 "[ . 1 . 2]" 1
849 1 34 ILE QG 1 43 TRP HE3 . . 4.610 3.842 3.649 4.014 . 0 0 "[ . 1 . 2]" 1
850 1 34 ILE QG 1 54 PHE HZ . . 3.980 2.871 2.702 3.078 . 0 0 "[ . 1 . 2]" 1
851 1 34 ILE HG12 1 34 ILE MG . . 3.610 2.413 2.293 2.486 . 0 0 "[ . 1 . 2]" 1
852 1 34 ILE HG12 1 54 PHE HZ . . 4.860 2.910 2.742 3.122 . 0 0 "[ . 1 . 2]" 1
853 1 34 ILE HG13 1 34 ILE MG . . 3.610 3.187 3.178 3.199 . 0 0 "[ . 1 . 2]" 1
854 1 34 ILE HG13 1 54 PHE HZ . . 4.860 4.395 4.078 4.716 . 0 0 "[ . 1 . 2]" 1
855 1 34 ILE MG 1 35 ILE H . . 3.520 2.760 2.531 2.951 . 0 0 "[ . 1 . 2]" 1
856 1 34 ILE MG 1 36 SER H . . 3.540 3.308 3.065 3.513 . 0 0 "[ . 1 . 2]" 1
857 1 34 ILE MG 1 36 SER HA . . 4.390 3.911 3.742 4.090 . 0 0 "[ . 1 . 2]" 1
858 1 34 ILE MG 1 37 GLN HA . . 4.450 4.013 3.304 4.378 . 0 0 "[ . 1 . 2]" 1
859 1 34 ILE MG 1 37 GLN QB . . 4.530 4.214 3.574 4.530 . 0 0 "[ . 1 . 2]" 1
860 1 34 ILE MG 1 37 GLN QE . . 4.240 2.833 2.200 3.632 . 0 0 "[ . 1 . 2]" 1
861 1 34 ILE MG 1 37 GLN HG2 . . 4.100 2.926 2.277 3.353 . 0 0 "[ . 1 . 2]" 1
862 1 34 ILE MG 1 37 GLN QG . . 3.470 2.564 1.813 3.175 . 0 0 "[ . 1 . 2]" 1
863 1 34 ILE MG 1 37 GLN HG3 . . 4.100 2.951 1.889 3.927 . 0 0 "[ . 1 . 2]" 1
864 1 34 ILE MG 1 43 TRP HA . . 4.790 4.590 4.234 4.784 . 0 0 "[ . 1 . 2]" 1
865 1 34 ILE MG 1 43 TRP HB2 . . 4.260 4.185 3.930 4.258 . 0 0 "[ . 1 . 2]" 1
866 1 34 ILE MG 1 43 TRP HB3 . . 3.760 2.907 2.782 3.026 . 0 0 "[ . 1 . 2]" 1
867 1 34 ILE MG 1 43 TRP HE3 . . 3.930 3.825 3.357 3.932 0.002 17 0 "[ . 1 . 2]" 1
868 1 34 ILE MG 1 43 TRP HZ3 . . 5.250 5.085 4.680 5.235 . 0 0 "[ . 1 . 2]" 1
869 1 34 ILE MG 1 44 VAL H . . 4.290 3.441 3.119 3.867 . 0 0 "[ . 1 . 2]" 1
870 1 34 ILE MG 1 45 GLY HA2 . . 5.040 3.654 3.468 3.971 . 0 0 "[ . 1 . 2]" 1
871 1 34 ILE MG 1 45 GLY HA3 . . 4.560 4.372 4.102 4.540 . 0 0 "[ . 1 . 2]" 1
872 1 34 ILE MG 1 54 PHE HZ . . 4.340 4.076 3.672 4.340 . 0 0 "[ . 1 . 2]" 1
873 1 35 ILE H 1 35 ILE HB . . 3.500 2.585 2.539 2.647 . 0 0 "[ . 1 . 2]" 1
874 1 35 ILE H 1 35 ILE MD . . 4.360 3.500 3.356 3.655 . 0 0 "[ . 1 . 2]" 1
875 1 35 ILE H 1 35 ILE HG12 . . 3.850 2.223 2.079 2.414 . 0 0 "[ . 1 . 2]" 1
876 1 35 ILE H 1 35 ILE HG13 . . 4.170 3.605 3.354 3.806 . 0 0 "[ . 1 . 2]" 1
877 1 35 ILE H 1 35 ILE MG . . 4.150 3.800 3.785 3.823 . 0 0 "[ . 1 . 2]" 1
878 1 35 ILE H 1 36 SER H . . 3.110 2.600 2.439 2.692 . 0 0 "[ . 1 . 2]" 1
879 1 35 ILE H 1 44 VAL HB . . 5.500 4.267 3.871 4.517 . 0 0 "[ . 1 . 2]" 1
880 1 35 ILE H 1 44 VAL MG1 . . 4.470 3.713 3.371 3.993 . 0 0 "[ . 1 . 2]" 1
881 1 35 ILE H 1 45 GLY HA2 . . 3.620 1.925 1.898 2.015 . 0 0 "[ . 1 . 2]" 1
882 1 35 ILE H 1 45 GLY HA3 . . 4.080 3.600 3.520 3.742 . 0 0 "[ . 1 . 2]" 1
883 1 35 ILE H 1 46 GLU H . . 4.720 4.245 3.993 4.507 . 0 0 "[ . 1 . 2]" 1
884 1 35 ILE H 1 46 GLU HB2 . . 5.500 4.714 4.393 4.975 . 0 0 "[ . 1 . 2]" 1
885 1 35 ILE HA 1 35 ILE MD . . 3.090 2.210 1.993 2.381 . 0 0 "[ . 1 . 2]" 1
886 1 35 ILE HA 1 35 ILE HG12 . . 3.830 3.015 2.905 3.120 . 0 0 "[ . 1 . 2]" 1
887 1 35 ILE HA 1 35 ILE HG13 . . 4.140 3.792 3.748 3.843 . 0 0 "[ . 1 . 2]" 1
888 1 35 ILE HA 1 35 ILE MG . . 3.170 2.259 2.185 2.403 . 0 0 "[ . 1 . 2]" 1
889 1 35 ILE HB 1 35 ILE MD . . 3.510 3.209 3.189 3.217 . 0 0 "[ . 1 . 2]" 1
890 1 35 ILE HB 1 36 SER H . . 3.360 2.111 2.031 2.234 . 0 0 "[ . 1 . 2]" 1
891 1 35 ILE HB 1 44 VAL H . . 5.490 5.273 5.092 5.416 . 0 0 "[ . 1 . 2]" 1
892 1 35 ILE HB 1 44 VAL HB . . 3.880 3.549 3.066 3.781 . 0 0 "[ . 1 . 2]" 1
893 1 35 ILE HB 1 44 VAL MG1 . . 3.130 2.615 2.047 2.985 . 0 0 "[ . 1 . 2]" 1
894 1 35 ILE HB 1 45 GLY HA2 . . 4.600 3.718 3.528 3.920 . 0 0 "[ . 1 . 2]" 1
895 1 35 ILE MD 1 36 SER HB2 . . 5.500 5.492 5.425 5.507 0.007 17 0 "[ . 1 . 2]" 1
896 1 35 ILE MD 1 45 GLY HA2 . . 4.450 4.067 3.795 4.304 . 0 0 "[ . 1 . 2]" 1
897 1 35 ILE MD 1 45 GLY HA3 . . 5.500 5.267 5.040 5.504 0.004 17 0 "[ . 1 . 2]" 1
898 1 35 ILE MD 1 46 GLU H . . 4.450 4.161 3.586 4.438 . 0 0 "[ . 1 . 2]" 1
899 1 35 ILE MD 1 46 GLU HA . . 4.940 4.710 4.348 4.939 . 0 0 "[ . 1 . 2]" 1
900 1 35 ILE MD 1 46 GLU HB2 . . 3.400 2.558 2.150 2.829 . 0 0 "[ . 1 . 2]" 1
901 1 35 ILE MD 1 46 GLU HB3 . . 3.850 3.274 2.803 3.617 . 0 0 "[ . 1 . 2]" 1
902 1 35 ILE MD 1 46 GLU QG . . 3.950 3.695 3.278 3.883 . 0 0 "[ . 1 . 2]" 1
903 1 35 ILE MD 1 51 ARG QB . . 5.320 4.916 3.410 5.318 . 0 0 "[ . 1 . 2]" 1
904 1 35 ILE MD 1 51 ARG HD2 . . 4.890 3.962 2.983 4.791 . 0 0 "[ . 1 . 2]" 1
905 1 35 ILE MD 1 51 ARG QD . . 4.020 3.198 2.329 3.787 . 0 0 "[ . 1 . 2]" 1
906 1 35 ILE MD 1 51 ARG HD3 . . 4.890 3.679 2.354 4.832 . 0 0 "[ . 1 . 2]" 1
907 1 35 ILE MD 1 51 ARG HG2 . . 5.500 4.233 3.714 4.765 . 0 0 "[ . 1 . 2]" 1
908 1 35 ILE MD 1 51 ARG QG . . 4.690 3.587 3.088 4.145 . 0 0 "[ . 1 . 2]" 1
909 1 35 ILE MD 1 51 ARG HG3 . . 5.500 4.109 3.166 5.263 . 0 0 "[ . 1 . 2]" 1
910 1 35 ILE HG12 1 35 ILE MG . . 3.510 3.186 3.162 3.202 . 0 0 "[ . 1 . 2]" 1
911 1 35 ILE HG12 1 36 SER H . . 4.650 3.975 3.906 4.050 . 0 0 "[ . 1 . 2]" 1
912 1 35 ILE HG12 1 44 VAL MG1 . . 4.110 3.882 3.356 4.104 . 0 0 "[ . 1 . 2]" 1
913 1 35 ILE HG12 1 45 GLY HA2 . . 4.130 2.570 2.383 2.811 . 0 0 "[ . 1 . 2]" 1
914 1 35 ILE HG12 1 45 GLY HA3 . . 4.510 4.121 3.977 4.314 . 0 0 "[ . 1 . 2]" 1
915 1 35 ILE HG12 1 46 GLU H . . 4.490 3.527 3.217 3.810 . 0 0 "[ . 1 . 2]" 1
916 1 35 ILE HG12 1 46 GLU QG . . 4.770 4.572 4.264 4.733 . 0 0 "[ . 1 . 2]" 1
917 1 35 ILE HG13 1 35 ILE MG . . 3.340 2.411 2.329 2.536 . 0 0 "[ . 1 . 2]" 1
918 1 35 ILE HG13 1 36 SER H . . 4.620 4.421 4.215 4.604 . 0 0 "[ . 1 . 2]" 1
919 1 35 ILE HG13 1 44 VAL MG1 . . 3.970 3.582 3.192 3.857 . 0 0 "[ . 1 . 2]" 1
920 1 35 ILE HG13 1 45 GLY HA2 . . 4.300 3.911 3.587 4.118 . 0 0 "[ . 1 . 2]" 1
921 1 35 ILE HG13 1 45 GLY HA3 . . 5.500 5.327 5.003 5.495 . 0 0 "[ . 1 . 2]" 1
922 1 35 ILE HG13 1 46 GLU H . . 4.980 4.623 4.388 4.956 . 0 0 "[ . 1 . 2]" 1
923 1 35 ILE HG13 1 46 GLU HB2 . . 4.220 2.672 2.426 3.067 . 0 0 "[ . 1 . 2]" 1
924 1 35 ILE HG13 1 46 GLU QG . . 4.780 3.984 3.645 4.158 . 0 0 "[ . 1 . 2]" 1
925 1 35 ILE HG13 1 51 ARG HD2 . . 4.700 3.047 2.149 4.440 . 0 0 "[ . 1 . 2]" 1
926 1 35 ILE HG13 1 51 ARG HD3 . . 4.700 3.061 1.999 4.269 . 0 0 "[ . 1 . 2]" 1
927 1 35 ILE MG 1 36 SER H . . 4.070 3.163 2.997 3.374 . 0 0 "[ . 1 . 2]" 1
928 1 35 ILE MG 1 36 SER HA . . 4.900 4.018 3.782 4.235 . 0 0 "[ . 1 . 2]" 1
929 1 35 ILE MG 1 36 SER HB2 . . 3.800 2.750 2.637 2.864 . 0 0 "[ . 1 . 2]" 1
930 1 35 ILE MG 1 36 SER HB3 . . 4.500 4.064 3.920 4.158 . 0 0 "[ . 1 . 2]" 1
931 1 35 ILE MG 1 44 VAL HB . . 5.120 4.506 4.197 4.645 . 0 0 "[ . 1 . 2]" 1
932 1 35 ILE MG 1 46 GLU HB2 . . 5.400 4.528 4.329 4.868 . 0 0 "[ . 1 . 2]" 1
933 1 35 ILE MG 1 46 GLU QG . . 5.350 5.297 4.997 5.351 0.001 12 0 "[ . 1 . 2]" 1
934 1 35 ILE MG 1 51 ARG HD2 . . 4.820 3.178 2.189 4.644 . 0 0 "[ . 1 . 2]" 1
935 1 35 ILE MG 1 51 ARG QD . . 3.950 2.732 2.159 3.359 . 0 0 "[ . 1 . 2]" 1
936 1 35 ILE MG 1 51 ARG HD3 . . 4.820 3.411 2.224 4.212 . 0 0 "[ . 1 . 2]" 1
937 1 36 SER H 1 36 SER HB2 . . 4.130 2.913 2.786 3.098 . 0 0 "[ . 1 . 2]" 1
938 1 36 SER H 1 36 SER HB3 . . 3.990 3.026 2.965 3.102 . 0 0 "[ . 1 . 2]" 1
939 1 36 SER H 1 44 VAL H . . 3.740 3.611 3.390 3.732 . 0 0 "[ . 1 . 2]" 1
940 1 36 SER H 1 44 VAL HB . . 3.260 2.443 2.027 2.675 . 0 0 "[ . 1 . 2]" 1
941 1 36 SER H 1 44 VAL MG1 . . 4.180 3.004 2.398 3.380 . 0 0 "[ . 1 . 2]" 1
942 1 36 SER H 1 44 VAL MG2 . . 4.610 4.075 3.722 4.297 . 0 0 "[ . 1 . 2]" 1
943 1 36 SER H 1 45 GLY HA2 . . 4.730 4.034 3.944 4.163 . 0 0 "[ . 1 . 2]" 1
944 1 36 SER HB2 1 44 VAL HB . . 4.030 3.720 3.281 3.939 . 0 0 "[ . 1 . 2]" 1
945 1 36 SER HB2 1 44 VAL MG1 . . 4.710 3.921 3.222 4.274 . 0 0 "[ . 1 . 2]" 1
946 1 36 SER HB2 1 44 VAL MG2 . . 4.690 4.462 3.921 4.667 . 0 0 "[ . 1 . 2]" 1
947 1 36 SER HB3 1 44 VAL H . . 4.660 4.416 4.034 4.636 . 0 0 "[ . 1 . 2]" 1
948 1 36 SER HB3 1 44 VAL HB . . 3.550 2.702 2.298 2.913 . 0 0 "[ . 1 . 2]" 1
949 1 36 SER HB3 1 44 VAL MG1 . . 3.720 3.574 3.090 3.719 . 0 0 "[ . 1 . 2]" 1
950 1 36 SER HB3 1 44 VAL MG2 . . 3.760 3.164 2.630 3.407 . 0 0 "[ . 1 . 2]" 1
951 1 37 GLN H 1 37 GLN QG . . 4.320 2.837 2.414 3.332 . 0 0 "[ . 1 . 2]" 1
952 1 37 GLN HA 1 37 GLN HG2 . . 3.930 2.692 2.405 3.226 . 0 0 "[ . 1 . 2]" 1
953 1 37 GLN HA 1 37 GLN QG . . 3.430 2.550 2.325 3.061 . 0 0 "[ . 1 . 2]" 1
954 1 37 GLN HA 1 37 GLN HG3 . . 3.930 3.205 2.745 3.874 . 0 0 "[ . 1 . 2]" 1
955 1 37 GLN HA 1 38 LYS H . . 3.350 2.280 2.144 2.382 . 0 0 "[ . 1 . 2]" 1
956 1 37 GLN HA 1 39 ASP H . . 4.640 3.918 3.464 4.571 . 0 0 "[ . 1 . 2]" 1
957 1 37 GLN HA 1 43 TRP HA . . 3.560 2.373 2.162 2.587 . 0 0 "[ . 1 . 2]" 1
958 1 37 GLN HA 1 43 TRP HD1 . . 3.700 2.903 2.638 3.166 . 0 0 "[ . 1 . 2]" 1
959 1 37 GLN HA 1 43 TRP HE1 . . 5.150 4.805 4.446 5.147 . 0 0 "[ . 1 . 2]" 1
960 1 37 GLN HA 1 44 VAL H . . 4.340 2.688 2.412 2.842 . 0 0 "[ . 1 . 2]" 1
961 1 37 GLN QB 1 37 GLN HE22 . . 4.710 3.941 3.494 4.129 . 0 0 "[ . 1 . 2]" 1
962 1 37 GLN QB 1 38 LYS H . . 4.500 3.713 3.069 3.877 . 0 0 "[ . 1 . 2]" 1
963 1 37 GLN QB 1 39 ASP H . . 4.830 4.002 3.542 4.511 . 0 0 "[ . 1 . 2]" 1
964 1 37 GLN QB 1 43 TRP HD1 . . 4.240 2.780 2.447 3.093 . 0 0 "[ . 1 . 2]" 1
965 1 37 GLN QB 1 43 TRP HE1 . . 4.040 3.177 2.671 3.503 . 0 0 "[ . 1 . 2]" 1
966 1 37 GLN QB 1 43 TRP HZ2 . . 5.500 5.155 4.589 5.492 . 0 0 "[ . 1 . 2]" 1
967 1 37 GLN QE 1 61 VAL QG . . 4.300 3.710 3.102 4.174 . 0 0 "[ . 1 . 2]" 1
968 1 37 GLN HE21 1 43 TRP HZ2 . . 5.080 4.028 3.388 4.748 . 0 0 "[ . 1 . 2]" 1
969 1 37 GLN HE22 1 43 TRP HZ2 . . 5.080 4.001 3.408 4.680 . 0 0 "[ . 1 . 2]" 1
970 1 37 GLN QG 1 43 TRP HB3 . . 5.340 3.356 2.374 4.651 . 0 0 "[ . 1 . 2]" 1
971 1 37 GLN QG 1 43 TRP HD1 . . 4.500 3.546 2.795 4.353 . 0 0 "[ . 1 . 2]" 1
972 1 37 GLN QG 1 43 TRP HE1 . . 4.430 4.023 2.959 4.429 . 0 0 "[ . 1 . 2]" 1
973 1 38 LYS H 1 38 LYS QB . . 3.250 2.268 2.125 2.597 . 0 0 "[ . 1 . 2]" 1
974 1 38 LYS H 1 38 LYS HD2 . . 5.500 4.203 2.355 5.070 . 0 0 "[ . 1 . 2]" 1
975 1 38 LYS H 1 38 LYS QD . . 4.720 3.731 2.084 4.458 . 0 0 "[ . 1 . 2]" 1
976 1 38 LYS H 1 38 LYS HD3 . . 5.500 4.335 2.094 5.281 . 0 0 "[ . 1 . 2]" 1
977 1 38 LYS H 1 38 LYS QG . . 4.760 3.147 2.199 4.047 . 0 0 "[ . 1 . 2]" 1
978 1 38 LYS H 1 39 ASP H . . 3.490 2.891 2.515 3.171 . 0 0 "[ . 1 . 2]" 1
979 1 38 LYS H 1 43 TRP HA . . 3.950 2.840 2.387 3.181 . 0 0 "[ . 1 . 2]" 1
980 1 38 LYS H 1 43 TRP HD1 . . 4.510 3.715 2.824 4.266 . 0 0 "[ . 1 . 2]" 1
981 1 38 LYS HA 1 38 LYS HD2 . . 4.860 3.514 2.032 4.789 . 0 0 "[ . 1 . 2]" 1
982 1 38 LYS HA 1 38 LYS QD . . 4.120 3.160 2.014 4.120 . 0 0 "[ . 1 . 2]" 1
983 1 38 LYS HA 1 38 LYS HD3 . . 4.860 3.904 3.066 4.638 . 0 0 "[ . 1 . 2]" 1
984 1 38 LYS HA 1 38 LYS HG2 . . 3.970 2.907 2.205 3.831 . 0 0 "[ . 1 . 2]" 1
985 1 38 LYS HA 1 38 LYS HG3 . . 3.970 2.946 2.193 3.691 . 0 0 "[ . 1 . 2]" 1
986 1 38 LYS HA 1 39 ASP HA . . 5.130 4.576 4.544 4.678 . 0 0 "[ . 1 . 2]" 1
987 1 38 LYS HA 1 44 VAL MG2 . . 4.920 4.370 3.940 4.921 0.001 18 0 "[ . 1 . 2]" 1
988 1 38 LYS QB 1 38 LYS QD . . 3.480 2.246 2.056 2.544 . 0 0 "[ . 1 . 2]" 1
989 1 38 LYS QB 1 38 LYS QE . . 3.920 2.996 2.006 3.874 . 0 0 "[ . 1 . 2]" 1
990 1 38 LYS QB 1 39 ASP H . . 3.600 2.373 1.972 2.690 . 0 0 "[ . 1 . 2]" 1
991 1 38 LYS QB 1 42 CYS HB2 . . 4.120 3.403 2.536 4.115 . 0 0 "[ . 1 . 2]" 1
992 1 38 LYS QB 1 42 CYS QB . . 3.560 3.082 2.508 3.506 . 0 0 "[ . 1 . 2]" 1
993 1 38 LYS QB 1 42 CYS HB3 . . 4.120 3.743 2.821 4.123 0.003 17 0 "[ . 1 . 2]" 1
994 1 38 LYS QB 1 44 VAL MG2 . . 4.070 2.963 2.107 3.841 . 0 0 "[ . 1 . 2]" 1
995 1 38 LYS QD 1 44 VAL MG2 . . 4.460 2.937 1.928 4.072 . 0 0 "[ . 1 . 2]" 1
996 1 38 LYS QE 1 38 LYS HG2 . . 3.830 2.718 2.227 3.519 . 0 0 "[ . 1 . 2]" 1
997 1 38 LYS QE 1 38 LYS HG3 . . 3.830 2.652 2.225 3.472 . 0 0 "[ . 1 . 2]" 1
998 1 38 LYS QG 1 39 ASP H . . 4.860 4.050 3.446 4.421 . 0 0 "[ . 1 . 2]" 1
999 1 38 LYS QG 1 44 VAL MG2 . . 5.190 2.866 1.843 4.183 . 0 0 "[ . 1 . 2]" 1
1000 1 39 ASP H 1 39 ASP HB2 . . 3.990 3.056 2.716 3.991 0.001 18 0 "[ . 1 . 2]" 1
1001 1 39 ASP H 1 39 ASP HB3 . . 3.990 3.515 2.722 3.981 . 0 0 "[ . 1 . 2]" 1
1002 1 39 ASP H 1 43 TRP HD1 . . 4.320 2.996 2.007 3.411 . 0 0 "[ . 1 . 2]" 1
1003 1 39 ASP HA 1 40 GLU H . . 3.450 2.421 2.200 2.645 . 0 0 "[ . 1 . 2]" 1
1004 1 39 ASP HA 1 40 GLU HA . . 5.410 4.303 4.292 4.325 . 0 0 "[ . 1 . 2]" 1
1005 1 39 ASP HA 1 41 HIS H . . 4.990 4.149 3.850 4.693 . 0 0 "[ . 1 . 2]" 1
1006 1 39 ASP HA 1 42 CYS H . . 4.720 4.536 4.188 4.720 . 0 0 "[ . 1 . 2]" 1
1007 1 39 ASP QB 1 40 GLU H . . 3.250 2.684 1.967 3.158 . 0 0 "[ . 1 . 2]" 1
1008 1 39 ASP QB 1 42 CYS H . . 4.120 2.322 1.889 3.758 . 0 0 "[ . 1 . 2]" 1
1009 1 39 ASP QB 1 42 CYS QB . . 4.990 2.779 1.975 4.974 . 0 0 "[ . 1 . 2]" 1
1010 1 39 ASP HB2 1 40 GLU H . . 3.960 3.516 2.090 3.905 . 0 0 "[ . 1 . 2]" 1
1011 1 39 ASP HB3 1 40 GLU H . . 3.960 2.938 1.986 3.911 . 0 0 "[ . 1 . 2]" 1
1012 1 40 GLU H 1 40 GLU HB2 . . 3.900 2.380 2.207 2.667 . 0 0 "[ . 1 . 2]" 1
1013 1 40 GLU H 1 40 GLU QB . . 3.360 2.292 2.143 2.601 . 0 0 "[ . 1 . 2]" 1
1014 1 40 GLU H 1 40 GLU HB3 . . 3.900 3.214 2.483 3.609 . 0 0 "[ . 1 . 2]" 1
1015 1 40 GLU H 1 40 GLU HG2 . . 4.630 3.997 2.591 4.603 . 0 0 "[ . 1 . 2]" 1
1016 1 40 GLU H 1 40 GLU HG3 . . 4.630 3.577 1.977 4.565 . 0 0 "[ . 1 . 2]" 1
1017 1 40 GLU H 1 41 HIS H . . 3.900 2.722 2.438 2.936 . 0 0 "[ . 1 . 2]" 1
1018 1 40 GLU HA 1 40 GLU QG . . 3.660 2.424 2.210 2.962 . 0 0 "[ . 1 . 2]" 1
1019 1 40 GLU HA 1 43 TRP HE1 . . 3.740 2.373 1.902 3.211 . 0 0 "[ . 1 . 2]" 1
1020 1 40 GLU HB2 1 41 HIS H . . 4.520 3.373 2.515 4.259 . 0 0 "[ . 1 . 2]" 1
1021 1 40 GLU HB2 1 41 HIS HD2 . . 4.920 3.756 2.413 4.661 . 0 0 "[ . 1 . 2]" 1
1022 1 40 GLU HB3 1 41 HIS H . . 4.520 3.429 2.672 4.096 . 0 0 "[ . 1 . 2]" 1
1023 1 40 GLU HB3 1 41 HIS HD2 . . 4.920 3.301 2.151 4.789 . 0 0 "[ . 1 . 2]" 1
1024 1 41 HIS H 1 41 HIS HB2 . . 3.960 2.447 2.224 2.730 . 0 0 "[ . 1 . 2]" 1
1025 1 41 HIS H 1 41 HIS QB . . 3.450 2.409 2.201 2.674 . 0 0 "[ . 1 . 2]" 1
1026 1 41 HIS H 1 41 HIS HB3 . . 3.960 3.626 3.510 3.825 . 0 0 "[ . 1 . 2]" 1
1027 1 41 HIS H 1 41 HIS HD2 . . 4.670 3.177 2.248 4.158 . 0 0 "[ . 1 . 2]" 1
1028 1 41 HIS HA 1 41 HIS HD2 . . 4.980 3.360 2.353 4.504 . 0 0 "[ . 1 . 2]" 1
1029 1 41 HIS HA 1 57 LYS H . . 4.900 4.468 3.735 4.901 0.001 17 0 "[ . 1 . 2]" 1
1030 1 41 HIS QB 1 42 CYS H . . 3.760 2.670 2.246 3.757 . 0 0 "[ . 1 . 2]" 1
1031 1 41 HIS HB2 1 42 CYS H . . 4.530 2.775 2.282 4.129 . 0 0 "[ . 1 . 2]" 1
1032 1 41 HIS HB3 1 42 CYS H . . 4.530 3.596 3.007 4.321 . 0 0 "[ . 1 . 2]" 1
1033 1 42 CYS H 1 42 CYS HB2 . . 4.050 2.765 2.398 3.601 . 0 0 "[ . 1 . 2]" 1
1034 1 42 CYS H 1 42 CYS QB . . 3.280 2.562 2.173 3.097 . 0 0 "[ . 1 . 2]" 1
1035 1 42 CYS H 1 42 CYS HB3 . . 4.050 3.492 2.236 3.927 . 0 0 "[ . 1 . 2]" 1
1036 1 42 CYS H 1 43 TRP HD1 . . 4.430 4.095 3.438 4.389 . 0 0 "[ . 1 . 2]" 1
1037 1 42 CYS H 1 43 TRP HE1 . . 5.120 4.855 3.974 5.123 0.003 17 0 "[ . 1 . 2]" 1
1038 1 42 CYS QB 1 43 TRP H . . 4.030 3.415 3.071 3.959 . 0 0 "[ . 1 . 2]" 1
1039 1 42 CYS QB 1 53 TRP HB3 . . 5.340 4.417 4.113 5.160 . 0 0 "[ . 1 . 2]" 1
1040 1 42 CYS QB 1 53 TRP HZ3 . . 4.890 3.477 2.472 3.900 . 0 0 "[ . 1 . 2]" 1
1041 1 42 CYS QB 1 54 PHE H . . 4.430 3.716 3.189 4.431 0.001 13 0 "[ . 1 . 2]" 1
1042 1 42 CYS HB2 1 53 TRP HB2 . . 4.790 4.237 2.889 4.790 . 0 0 "[ . 1 . 2]" 1
1043 1 42 CYS HB2 1 53 TRP HE3 . . 4.200 3.526 2.305 4.007 . 0 0 "[ . 1 . 2]" 1
1044 1 42 CYS HB3 1 53 TRP HB2 . . 4.790 3.311 2.745 4.808 0.018 13 0 "[ . 1 . 2]" 1
1045 1 42 CYS HB3 1 53 TRP HE3 . . 4.200 2.435 2.001 4.106 . 0 0 "[ . 1 . 2]" 1
1046 1 43 TRP H 1 43 TRP HB2 . . 3.450 2.527 2.438 2.576 . 0 0 "[ . 1 . 2]" 1
1047 1 43 TRP H 1 43 TRP HB3 . . 3.850 3.710 3.644 3.740 . 0 0 "[ . 1 . 2]" 1
1048 1 43 TRP H 1 43 TRP HD1 . . 3.870 3.728 3.563 3.874 0.004 18 0 "[ . 1 . 2]" 1
1049 1 43 TRP H 1 53 TRP HE3 . . 4.480 4.086 3.375 4.474 . 0 0 "[ . 1 . 2]" 1
1050 1 43 TRP H 1 54 PHE H . . 3.670 2.867 2.675 3.117 . 0 0 "[ . 1 . 2]" 1
1051 1 43 TRP H 1 54 PHE QE . . 4.840 4.459 4.214 4.653 . 0 0 "[ . 1 . 2]" 1
1052 1 43 TRP H 1 55 PRO HA . . 4.380 3.958 3.595 4.186 . 0 0 "[ . 1 . 2]" 1
1053 1 43 TRP H 1 56 ALA H . . 4.370 3.548 3.203 3.943 . 0 0 "[ . 1 . 2]" 1
1054 1 43 TRP H 1 56 ALA MB . . 4.440 3.771 3.508 4.301 . 0 0 "[ . 1 . 2]" 1
1055 1 43 TRP HA 1 43 TRP HD1 . . 3.300 2.139 2.073 2.193 . 0 0 "[ . 1 . 2]" 1
1056 1 43 TRP HA 1 43 TRP HE1 . . 4.690 4.642 4.546 4.690 0.000 16 0 "[ . 1 . 2]" 1
1057 1 43 TRP HA 1 43 TRP HE3 . . 5.400 5.212 5.135 5.230 . 0 0 "[ . 1 . 2]" 1
1058 1 43 TRP HA 1 44 VAL H . . 3.190 2.378 2.295 2.558 . 0 0 "[ . 1 . 2]" 1
1059 1 43 TRP HA 1 44 VAL MG2 . . 4.560 3.510 3.322 3.807 . 0 0 "[ . 1 . 2]" 1
1060 1 43 TRP HB2 1 43 TRP HE3 . . 3.820 2.730 2.645 2.957 . 0 0 "[ . 1 . 2]" 1
1061 1 43 TRP HB2 1 44 VAL H . . 3.890 3.740 3.358 3.897 0.007 13 0 "[ . 1 . 2]" 1
1062 1 43 TRP HB2 1 54 PHE H . . 4.860 4.440 4.197 4.583 . 0 0 "[ . 1 . 2]" 1
1063 1 43 TRP HB2 1 54 PHE QE . . 4.340 3.082 2.770 3.386 . 0 0 "[ . 1 . 2]" 1
1064 1 43 TRP HB2 1 54 PHE HZ . . 4.430 3.475 3.175 3.886 . 0 0 "[ . 1 . 2]" 1
1065 1 43 TRP HB3 1 43 TRP HE3 . . 3.990 3.182 2.935 3.286 . 0 0 "[ . 1 . 2]" 1
1066 1 43 TRP HB3 1 44 VAL H . . 3.410 2.506 2.122 2.709 . 0 0 "[ . 1 . 2]" 1
1067 1 43 TRP HB3 1 54 PHE QE . . 4.590 4.042 3.436 4.381 . 0 0 "[ . 1 . 2]" 1
1068 1 43 TRP HB3 1 54 PHE HZ . . 4.440 3.807 3.476 4.196 . 0 0 "[ . 1 . 2]" 1
1069 1 43 TRP HD1 1 44 VAL H . . 4.770 4.242 4.102 4.369 . 0 0 "[ . 1 . 2]" 1
1070 1 43 TRP HD1 1 56 ALA MB . . 4.310 4.260 4.031 4.310 . 0 0 "[ . 1 . 2]" 1
1071 1 43 TRP HE1 1 56 ALA MB . . 4.130 3.992 3.790 4.100 . 0 0 "[ . 1 . 2]" 1
1072 1 43 TRP HE3 1 54 PHE HZ . . 3.670 3.487 3.189 3.659 . 0 0 "[ . 1 . 2]" 1
1073 1 43 TRP HE3 1 56 ALA HA . . 4.410 3.540 3.255 3.787 . 0 0 "[ . 1 . 2]" 1
1074 1 43 TRP HE3 1 56 ALA MB . . 4.780 2.777 2.574 2.986 . 0 0 "[ . 1 . 2]" 1
1075 1 43 TRP HE3 1 59 VAL MG2 . . 3.720 3.266 2.871 3.499 . 0 0 "[ . 1 . 2]" 1
1076 1 43 TRP HE3 1 61 VAL QG . . 5.040 3.897 3.661 4.168 . 0 0 "[ . 1 . 2]" 1
1077 1 43 TRP HH2 1 56 ALA MB . . 4.560 3.327 3.039 3.610 . 0 0 "[ . 1 . 2]" 1
1078 1 43 TRP HH2 1 61 VAL MG1 . . 4.420 4.105 3.670 4.420 . 0 0 "[ . 1 . 2]" 1
1079 1 43 TRP HH2 1 61 VAL QG . . 3.190 2.073 1.844 2.425 . 0 0 "[ . 1 . 2]" 1
1080 1 43 TRP HH2 1 61 VAL MG2 . . 4.420 2.079 1.849 2.437 . 0 0 "[ . 1 . 2]" 1
1081 1 43 TRP HZ2 1 56 ALA MB . . 3.920 3.629 3.377 3.759 . 0 0 "[ . 1 . 2]" 1
1082 1 43 TRP HZ2 1 61 VAL QG . . 4.380 3.888 3.517 4.270 . 0 0 "[ . 1 . 2]" 1
1083 1 43 TRP HZ3 1 54 PHE QE . . 4.940 4.671 4.334 4.912 . 0 0 "[ . 1 . 2]" 1
1084 1 43 TRP HZ3 1 59 VAL MG2 . . 3.420 3.259 2.882 3.420 0.000 16 0 "[ . 1 . 2]" 1
1085 1 43 TRP HZ3 1 61 VAL MG1 . . 4.660 4.083 3.699 4.510 . 0 0 "[ . 1 . 2]" 1
1086 1 43 TRP HZ3 1 61 VAL QG . . 3.130 2.000 1.793 2.214 . 0 0 "[ . 1 . 2]" 1
1087 1 43 TRP HZ3 1 61 VAL MG2 . . 4.660 2.005 1.796 2.219 . 0 0 "[ . 1 . 2]" 1
1088 1 44 VAL H 1 44 VAL HB . . 3.490 2.617 2.526 2.738 . 0 0 "[ . 1 . 2]" 1
1089 1 44 VAL H 1 44 VAL MG1 . . 4.280 3.830 3.739 3.892 . 0 0 "[ . 1 . 2]" 1
1090 1 44 VAL H 1 44 VAL MG2 . . 3.640 2.846 2.647 3.156 . 0 0 "[ . 1 . 2]" 1
1091 1 44 VAL H 1 45 GLY HA3 . . 5.470 5.395 5.310 5.471 0.001 15 0 "[ . 1 . 2]" 1
1092 1 44 VAL MG1 1 45 GLY H . . 3.440 2.764 2.334 3.094 . 0 0 "[ . 1 . 2]" 1
1093 1 44 VAL MG1 1 45 GLY HA2 . . 4.630 3.609 3.426 3.806 . 0 0 "[ . 1 . 2]" 1
1094 1 44 VAL MG1 1 45 GLY HA3 . . 5.250 4.317 4.088 4.564 . 0 0 "[ . 1 . 2]" 1
1095 1 44 VAL MG1 1 51 ARG HA . . 4.940 3.899 3.690 4.410 . 0 0 "[ . 1 . 2]" 1
1096 1 44 VAL MG1 1 51 ARG QB . . 4.190 3.604 2.866 4.153 . 0 0 "[ . 1 . 2]" 1
1097 1 44 VAL MG1 1 51 ARG HD2 . . 5.150 3.706 2.871 5.127 . 0 0 "[ . 1 . 2]" 1
1098 1 44 VAL MG1 1 51 ARG QD . . 4.350 3.406 2.811 4.161 . 0 0 "[ . 1 . 2]" 1
1099 1 44 VAL MG1 1 51 ARG HD3 . . 5.150 4.296 2.964 4.938 . 0 0 "[ . 1 . 2]" 1
1100 1 44 VAL MG1 1 52 GLY H . . 3.840 3.177 2.845 3.463 . 0 0 "[ . 1 . 2]" 1
1101 1 44 VAL MG1 1 52 GLY HA2 . . 4.140 3.248 2.888 3.853 . 0 0 "[ . 1 . 2]" 1
1102 1 44 VAL MG1 1 52 GLY HA3 . . 4.990 4.255 4.024 4.741 . 0 0 "[ . 1 . 2]" 1
1103 1 44 VAL MG1 1 53 TRP HA . . 4.370 3.543 3.309 3.836 . 0 0 "[ . 1 . 2]" 1
1104 1 44 VAL MG2 1 45 GLY H . . 4.460 4.072 3.904 4.226 . 0 0 "[ . 1 . 2]" 1
1105 1 44 VAL MG2 1 53 TRP HA . . 4.160 2.461 2.177 2.679 . 0 0 "[ . 1 . 2]" 1
1106 1 44 VAL MG2 1 53 TRP HB2 . . 4.240 3.139 2.878 3.264 . 0 0 "[ . 1 . 2]" 1
1107 1 44 VAL MG2 1 53 TRP HB3 . . 3.800 2.804 2.402 2.999 . 0 0 "[ . 1 . 2]" 1
1108 1 44 VAL MG2 1 53 TRP HD1 . . 5.160 4.915 4.457 5.128 . 0 0 "[ . 1 . 2]" 1
1109 1 44 VAL MG2 1 53 TRP HE3 . . 5.200 5.083 4.684 5.204 0.004 13 0 "[ . 1 . 2]" 1
1110 1 44 VAL MG2 1 54 PHE H . . 4.960 3.989 3.745 4.165 . 0 0 "[ . 1 . 2]" 1
1111 1 45 GLY H 1 52 GLY H . . 3.710 3.543 2.722 3.707 . 0 0 "[ . 1 . 2]" 1
1112 1 45 GLY H 1 53 TRP HA . . 4.120 3.805 3.362 4.052 . 0 0 "[ . 1 . 2]" 1
1113 1 45 GLY H 1 54 PHE QD . . 4.180 2.993 2.751 3.369 . 0 0 "[ . 1 . 2]" 1
1114 1 45 GLY H 1 54 PHE QE . . 3.910 2.282 1.977 2.888 . 0 0 "[ . 1 . 2]" 1
1115 1 45 GLY HA2 1 46 GLU H . . 3.300 2.705 2.515 2.824 . 0 0 "[ . 1 . 2]" 1
1116 1 45 GLY HA2 1 54 PHE QE . . 4.070 3.531 3.355 3.789 . 0 0 "[ . 1 . 2]" 1
1117 1 45 GLY HA3 1 46 GLU H . . 3.390 2.432 2.333 2.612 . 0 0 "[ . 1 . 2]" 1
1118 1 45 GLY HA3 1 54 PHE QD . . 4.500 4.182 3.999 4.446 . 0 0 "[ . 1 . 2]" 1
1119 1 45 GLY HA3 1 54 PHE QE . . 3.620 2.111 1.999 2.413 . 0 0 "[ . 1 . 2]" 1
1120 1 45 GLY HA3 1 54 PHE HZ . . 4.820 3.619 3.380 3.897 . 0 0 "[ . 1 . 2]" 1
1121 1 46 GLU H 1 46 GLU HB2 . . 3.820 3.005 2.873 3.141 . 0 0 "[ . 1 . 2]" 1
1122 1 46 GLU H 1 46 GLU HB3 . . 3.710 2.964 2.779 3.127 . 0 0 "[ . 1 . 2]" 1
1123 1 46 GLU H 1 46 GLU QG . . 4.360 4.201 4.140 4.326 . 0 0 "[ . 1 . 2]" 1
1124 1 46 GLU H 1 54 PHE QE . . 4.790 4.324 4.047 4.664 . 0 0 "[ . 1 . 2]" 1
1125 1 46 GLU HA 1 46 GLU QG . . 3.520 2.282 2.141 2.433 . 0 0 "[ . 1 . 2]" 1
1126 1 46 GLU HA 1 47 LEU H . . 2.840 2.161 2.142 2.294 . 0 0 "[ . 1 . 2]" 1
1127 1 46 GLU HA 1 50 LEU H . . 4.610 4.238 4.075 4.596 . 0 0 "[ . 1 . 2]" 1
1128 1 46 GLU HA 1 51 ARG HA . . 3.140 2.657 1.998 2.864 . 0 0 "[ . 1 . 2]" 1
1129 1 46 GLU HA 1 51 ARG QB . . 4.480 4.128 1.965 4.477 . 0 0 "[ . 1 . 2]" 1
1130 1 46 GLU HA 1 51 ARG HG2 . . 4.610 3.499 2.640 4.398 . 0 0 "[ . 1 . 2]" 1
1131 1 46 GLU HA 1 51 ARG QG . . 3.920 3.052 2.562 3.836 . 0 0 "[ . 1 . 2]" 1
1132 1 46 GLU HA 1 51 ARG HG3 . . 4.610 3.612 3.232 4.636 0.026 16 0 "[ . 1 . 2]" 1
1133 1 46 GLU HA 1 52 GLY H . . 4.280 4.001 3.730 4.228 . 0 0 "[ . 1 . 2]" 1
1134 1 46 GLU HB2 1 47 LEU H . . 4.500 4.356 4.017 4.450 . 0 0 "[ . 1 . 2]" 1
1135 1 46 GLU HB3 1 47 LEU H . . 4.680 3.988 3.707 4.101 . 0 0 "[ . 1 . 2]" 1
1136 1 46 GLU QG 1 47 LEU H . . 3.530 2.840 1.887 3.094 . 0 0 "[ . 1 . 2]" 1
1137 1 46 GLU QG 1 49 GLY H . . 4.580 3.972 3.344 4.535 . 0 0 "[ . 1 . 2]" 1
1138 1 46 GLU QG 1 49 GLY QA . . 4.550 3.658 3.472 3.972 . 0 0 "[ . 1 . 2]" 1
1139 1 46 GLU QG 1 50 LEU H . . 4.190 3.375 2.975 3.674 . 0 0 "[ . 1 . 2]" 1
1140 1 46 GLU QG 1 51 ARG HA . . 4.070 3.294 2.853 3.654 . 0 0 "[ . 1 . 2]" 1
1141 1 46 GLU QG 1 51 ARG QB . . 4.130 3.271 1.970 3.980 . 0 0 "[ . 1 . 2]" 1
1142 1 46 GLU QG 1 51 ARG HD2 . . 5.500 4.503 3.417 5.079 . 0 0 "[ . 1 . 2]" 1
1143 1 46 GLU QG 1 51 ARG HD3 . . 5.500 3.986 2.958 4.954 . 0 0 "[ . 1 . 2]" 1
1144 1 46 GLU QG 1 51 ARG HG2 . . 4.220 3.182 2.152 4.219 . 0 0 "[ . 1 . 2]" 1
1145 1 46 GLU QG 1 51 ARG QG . . 3.480 2.304 1.834 2.793 . 0 0 "[ . 1 . 2]" 1
1146 1 46 GLU QG 1 51 ARG HG3 . . 4.220 2.455 1.988 3.924 . 0 0 "[ . 1 . 2]" 1
1147 1 47 LEU H 1 47 LEU HB2 . . 3.800 3.282 3.190 3.500 . 0 0 "[ . 1 . 2]" 1
1148 1 47 LEU H 1 47 LEU HB3 . . 3.510 3.024 2.915 3.146 . 0 0 "[ . 1 . 2]" 1
1149 1 47 LEU H 1 47 LEU MD2 . . 4.940 4.667 4.587 4.773 . 0 0 "[ . 1 . 2]" 1
1150 1 47 LEU H 1 47 LEU HG . . 5.230 4.627 4.446 4.679 . 0 0 "[ . 1 . 2]" 1
1151 1 47 LEU H 1 50 LEU H . . 3.370 2.683 2.406 2.817 . 0 0 "[ . 1 . 2]" 1
1152 1 47 LEU H 1 50 LEU HB2 . . 4.020 3.502 3.273 3.973 . 0 0 "[ . 1 . 2]" 1
1153 1 47 LEU H 1 51 ARG HA . . 3.960 3.878 3.353 3.962 0.002 15 0 "[ . 1 . 2]" 1
1154 1 47 LEU HB2 1 47 LEU MD1 . . 2.890 2.059 1.996 2.199 . 0 0 "[ . 1 . 2]" 1
1155 1 47 LEU HB2 1 47 LEU MD2 . . 3.390 2.630 2.501 2.709 . 0 0 "[ . 1 . 2]" 1
1156 1 47 LEU HB3 1 47 LEU MD2 . . 3.280 2.078 1.973 2.213 . 0 0 "[ . 1 . 2]" 1
1157 1 47 LEU MD1 1 48 ASN H . . 4.480 3.037 2.623 3.253 . 0 0 "[ . 1 . 2]" 1
1158 1 47 LEU MD1 1 48 ASN HD21 . . 4.360 3.771 2.291 4.334 . 0 0 "[ . 1 . 2]" 1
1159 1 47 LEU MD1 1 48 ASN QD . . 3.730 3.423 2.232 3.691 . 0 0 "[ . 1 . 2]" 1
1160 1 47 LEU MD1 1 48 ASN HD22 . . 4.360 3.992 3.083 4.336 . 0 0 "[ . 1 . 2]" 1
1161 1 47 LEU MD1 1 49 GLY H . . 5.500 5.113 4.823 5.292 . 0 0 "[ . 1 . 2]" 1
1162 1 47 LEU MD2 1 48 ASN QD . . 4.670 2.188 1.778 3.852 . 0 0 "[ . 1 . 2]" 1
1163 1 47 LEU HG 1 48 ASN QB . . 3.670 3.409 2.578 3.656 . 0 0 "[ . 1 . 2]" 1
1164 1 47 LEU HG 1 48 ASN HD21 . . 4.320 2.409 1.930 3.885 . 0 0 "[ . 1 . 2]" 1
1165 1 47 LEU HG 1 48 ASN QD . . 3.760 2.291 1.915 3.263 . 0 0 "[ . 1 . 2]" 1
1166 1 47 LEU HG 1 48 ASN HD22 . . 4.320 3.110 2.641 3.507 . 0 0 "[ . 1 . 2]" 1
1167 1 47 LEU HG 1 49 GLY H . . 5.500 4.778 4.593 5.036 . 0 0 "[ . 1 . 2]" 1
1168 1 48 ASN H 1 49 GLY H . . 4.490 2.761 2.636 2.902 . 0 0 "[ . 1 . 2]" 1
1169 1 48 ASN HA 1 49 GLY H . . 3.400 2.901 2.807 2.983 . 0 0 "[ . 1 . 2]" 1
1170 1 48 ASN HA 1 50 LEU H . . 4.740 4.549 4.285 4.693 . 0 0 "[ . 1 . 2]" 1
1171 1 48 ASN QB 1 48 ASN QD . . 2.960 2.220 2.063 2.625 . 0 0 "[ . 1 . 2]" 1
1172 1 48 ASN QB 1 49 GLY H . . 4.210 3.801 3.748 3.855 . 0 0 "[ . 1 . 2]" 1
1173 1 48 ASN QB 1 50 LEU MD2 . . 4.000 3.871 3.594 4.001 0.001 16 0 "[ . 1 . 2]" 1
1174 1 48 ASN HB2 1 49 GLY H . . 4.790 4.164 4.031 4.276 . 0 0 "[ . 1 . 2]" 1
1175 1 48 ASN HB2 1 50 LEU MD1 . . 4.320 2.690 1.993 3.016 . 0 0 "[ . 1 . 2]" 1
1176 1 48 ASN HB2 1 50 LEU MD2 . . 4.580 4.480 4.130 4.575 . 0 0 "[ . 1 . 2]" 1
1177 1 48 ASN HB3 1 49 GLY H . . 4.790 4.392 4.317 4.455 . 0 0 "[ . 1 . 2]" 1
1178 1 48 ASN HB3 1 50 LEU MD1 . . 4.320 3.135 2.761 3.539 . 0 0 "[ . 1 . 2]" 1
1179 1 48 ASN HB3 1 50 LEU MD2 . . 4.580 4.246 3.816 4.495 . 0 0 "[ . 1 . 2]" 1
1180 1 48 ASN QD 1 50 LEU MD1 . . 4.810 4.185 3.724 4.787 . 0 0 "[ . 1 . 2]" 1
1181 1 49 GLY H 1 50 LEU H . . 3.470 2.585 2.527 2.650 . 0 0 "[ . 1 . 2]" 1
1182 1 49 GLY H 1 50 LEU MD1 . . 5.500 5.279 4.949 5.496 . 0 0 "[ . 1 . 2]" 1
1183 1 49 GLY QA 1 50 LEU MD2 . . 4.860 3.704 3.265 4.023 . 0 0 "[ . 1 . 2]" 1
1184 1 49 GLY QA 1 50 LEU HG . . 4.930 3.763 3.603 3.841 . 0 0 "[ . 1 . 2]" 1
1185 1 50 LEU H 1 50 LEU HB2 . . 3.100 2.795 2.731 2.933 . 0 0 "[ . 1 . 2]" 1
1186 1 50 LEU H 1 50 LEU HB3 . . 3.950 3.821 3.795 3.857 . 0 0 "[ . 1 . 2]" 1
1187 1 50 LEU H 1 50 LEU MD1 . . 4.570 3.952 3.597 4.079 . 0 0 "[ . 1 . 2]" 1
1188 1 50 LEU H 1 50 LEU MD2 . . 4.120 3.635 3.367 3.835 . 0 0 "[ . 1 . 2]" 1
1189 1 50 LEU H 1 50 LEU HG . . 3.310 2.719 2.467 2.891 . 0 0 "[ . 1 . 2]" 1
1190 1 50 LEU H 1 51 ARG H . . 4.580 4.426 4.257 4.490 . 0 0 "[ . 1 . 2]" 1
1191 1 50 LEU HB2 1 50 LEU MD1 . . 3.320 2.266 2.175 2.354 . 0 0 "[ . 1 . 2]" 1
1192 1 50 LEU HB2 1 51 ARG H . . 4.320 3.662 3.404 4.095 . 0 0 "[ . 1 . 2]" 1
1193 1 50 LEU HB3 1 50 LEU MD2 . . 3.500 2.369 2.236 2.412 . 0 0 "[ . 1 . 2]" 1
1194 1 50 LEU HB3 1 51 ARG H . . 3.320 2.785 2.433 3.323 0.003 16 0 "[ . 1 . 2]" 1
1195 1 50 LEU MD2 1 51 ARG H . . 4.410 3.752 3.565 4.058 . 0 0 "[ . 1 . 2]" 1
1196 1 51 ARG H 1 51 ARG QB . . 3.210 2.600 2.373 3.097 . 0 0 "[ . 1 . 2]" 1
1197 1 51 ARG H 1 51 ARG QG . . 4.570 3.749 2.213 4.192 . 0 0 "[ . 1 . 2]" 1
1198 1 51 ARG HA 1 51 ARG HG2 . . 4.040 2.452 2.176 3.863 . 0 0 "[ . 1 . 2]" 1
1199 1 51 ARG HA 1 51 ARG QG . . 3.400 2.301 2.136 3.330 . 0 0 "[ . 1 . 2]" 1
1200 1 51 ARG HA 1 51 ARG HG3 . . 4.040 2.897 2.491 3.637 . 0 0 "[ . 1 . 2]" 1
1201 1 51 ARG HA 1 52 GLY H . . 3.010 2.166 2.143 2.363 . 0 0 "[ . 1 . 2]" 1
1202 1 51 ARG QB 1 51 ARG QD . . 3.380 2.220 2.083 2.411 . 0 0 "[ . 1 . 2]" 1
1203 1 51 ARG QB 1 52 GLY H . . 3.880 3.624 2.496 3.882 0.002 15 0 "[ . 1 . 2]" 1
1204 1 51 ARG QB 1 52 GLY HA2 . . 5.000 4.164 3.957 4.326 . 0 0 "[ . 1 . 2]" 1
1205 1 51 ARG QG 1 52 GLY H . . 3.980 3.574 2.966 3.982 0.002 16 0 "[ . 1 . 2]" 1
1206 1 52 GLY HA2 1 53 TRP H . . 3.460 2.676 2.445 2.883 . 0 0 "[ . 1 . 2]" 1
1207 1 52 GLY HA2 1 53 TRP HD1 . . 5.030 4.213 3.474 4.765 . 0 0 "[ . 1 . 2]" 1
1208 1 52 GLY HA3 1 53 TRP H . . 3.460 2.458 2.290 2.685 . 0 0 "[ . 1 . 2]" 1
1209 1 53 TRP H 1 53 TRP HB2 . . 3.950 3.683 3.598 3.767 . 0 0 "[ . 1 . 2]" 1
1210 1 53 TRP H 1 53 TRP HB3 . . 3.980 2.661 2.374 3.044 . 0 0 "[ . 1 . 2]" 1
1211 1 53 TRP H 1 53 TRP HD1 . . 3.740 2.165 1.900 2.550 . 0 0 "[ . 1 . 2]" 1
1212 1 53 TRP HA 1 53 TRP HD1 . . 4.950 4.365 4.131 4.564 . 0 0 "[ . 1 . 2]" 1
1213 1 53 TRP HA 1 53 TRP HE3 . . 4.790 4.318 3.997 4.658 . 0 0 "[ . 1 . 2]" 1
1214 1 53 TRP HA 1 54 PHE H . . 3.070 2.414 2.326 2.465 . 0 0 "[ . 1 . 2]" 1
1215 1 53 TRP HA 1 54 PHE QD . . 4.300 3.699 3.405 3.944 . 0 0 "[ . 1 . 2]" 1
1216 1 53 TRP HB2 1 54 PHE H . . 3.540 2.510 2.309 2.733 . 0 0 "[ . 1 . 2]" 1
1217 1 53 TRP HB3 1 53 TRP HD1 . . 3.770 2.791 2.668 2.900 . 0 0 "[ . 1 . 2]" 1
1218 1 53 TRP HB3 1 54 PHE H . . 4.050 3.889 3.700 4.043 . 0 0 "[ . 1 . 2]" 1
1219 1 53 TRP HE3 1 54 PHE H . . 3.890 2.844 2.226 3.291 . 0 0 "[ . 1 . 2]" 1
1220 1 54 PHE H 1 54 PHE QD . . 3.740 3.533 3.377 3.614 . 0 0 "[ . 1 . 2]" 1
1221 1 54 PHE H 1 54 PHE QE . . 4.880 4.780 4.654 4.866 . 0 0 "[ . 1 . 2]" 1
1222 1 54 PHE H 1 55 PRO HD3 . . 4.750 4.691 4.667 4.739 . 0 0 "[ . 1 . 2]" 1
1223 1 54 PHE HB2 1 55 PRO HD2 . . 3.520 2.019 1.999 2.085 . 0 0 "[ . 1 . 2]" 1
1224 1 54 PHE HB2 1 55 PRO HD3 . . 3.760 3.458 3.438 3.518 . 0 0 "[ . 1 . 2]" 1
1225 1 54 PHE HB3 1 55 PRO HD2 . . 4.000 3.405 3.337 3.457 . 0 0 "[ . 1 . 2]" 1
1226 1 54 PHE HB3 1 55 PRO HD3 . . 4.420 4.372 4.313 4.416 . 0 0 "[ . 1 . 2]" 1
1227 1 54 PHE QD 1 55 PRO HD2 . . 4.230 3.416 3.313 3.530 . 0 0 "[ . 1 . 2]" 1
1228 1 54 PHE QD 1 56 ALA HA . . 3.940 3.158 2.961 3.502 . 0 0 "[ . 1 . 2]" 1
1229 1 54 PHE QD 1 56 ALA MB . . 5.500 4.285 4.103 4.588 . 0 0 "[ . 1 . 2]" 1
1230 1 54 PHE QD 1 58 PHE H . . 4.840 4.701 4.539 4.838 . 0 0 "[ . 1 . 2]" 1
1231 1 54 PHE QD 1 59 VAL MG1 . . 3.670 3.348 3.171 3.529 . 0 0 "[ . 1 . 2]" 1
1232 1 54 PHE QD 1 59 VAL MG2 . . 3.780 3.429 2.986 3.782 0.002 19 0 "[ . 1 . 2]" 1
1233 1 54 PHE QE 1 56 ALA H . . 5.340 4.514 4.071 5.062 . 0 0 "[ . 1 . 2]" 1
1234 1 54 PHE QE 1 56 ALA HA . . 3.660 2.553 2.134 2.944 . 0 0 "[ . 1 . 2]" 1
1235 1 54 PHE QE 1 56 ALA MB . . 4.680 3.592 3.311 3.956 . 0 0 "[ . 1 . 2]" 1
1236 1 54 PHE QE 1 59 VAL H . . 5.500 4.476 4.207 4.874 . 0 0 "[ . 1 . 2]" 1
1237 1 54 PHE QE 1 59 VAL HB . . 5.500 4.569 4.262 4.855 . 0 0 "[ . 1 . 2]" 1
1238 1 54 PHE QE 1 59 VAL MG1 . . 3.470 3.029 2.715 3.249 . 0 0 "[ . 1 . 2]" 1
1239 1 54 PHE QE 1 59 VAL MG2 . . 3.000 2.126 1.972 2.447 . 0 0 "[ . 1 . 2]" 1
1240 1 54 PHE HZ 1 59 VAL MG1 . . 4.560 4.063 3.793 4.382 . 0 0 "[ . 1 . 2]" 1
1241 1 54 PHE HZ 1 59 VAL MG2 . . 4.100 3.358 2.981 3.785 . 0 0 "[ . 1 . 2]" 1
1242 1 55 PRO HA 1 56 ALA H . . 2.870 2.170 2.151 2.211 . 0 0 "[ . 1 . 2]" 1
1243 1 55 PRO HA 1 56 ALA HA . . 4.640 4.435 4.370 4.491 . 0 0 "[ . 1 . 2]" 1
1244 1 55 PRO HA 1 57 LYS H . . 5.100 3.704 3.497 3.957 . 0 0 "[ . 1 . 2]" 1
1245 1 55 PRO HB2 1 56 ALA H . . 4.220 3.787 3.369 3.990 . 0 0 "[ . 1 . 2]" 1
1246 1 55 PRO HB2 1 57 LYS H . . 4.390 3.261 3.019 3.534 . 0 0 "[ . 1 . 2]" 1
1247 1 55 PRO HB2 1 57 LYS QB . . 4.860 4.083 3.702 4.210 . 0 0 "[ . 1 . 2]" 1
1248 1 55 PRO HB2 1 57 LYS QG . . 4.440 1.987 1.929 2.195 . 0 0 "[ . 1 . 2]" 1
1249 1 55 PRO HB2 1 58 PHE H . . 4.750 2.797 2.565 3.108 . 0 0 "[ . 1 . 2]" 1
1250 1 55 PRO HB2 1 58 PHE QD . . 4.670 2.019 1.997 2.115 . 0 0 "[ . 1 . 2]" 1
1251 1 55 PRO HB2 1 58 PHE QE . . 5.000 3.559 3.282 3.700 . 0 0 "[ . 1 . 2]" 1
1252 1 55 PRO HB3 1 56 ALA H . . 4.650 4.181 3.892 4.330 . 0 0 "[ . 1 . 2]" 1
1253 1 55 PRO HB3 1 57 LYS H . . 4.680 4.462 4.283 4.677 . 0 0 "[ . 1 . 2]" 1
1254 1 55 PRO HB3 1 58 PHE H . . 4.840 4.535 4.322 4.822 . 0 0 "[ . 1 . 2]" 1
1255 1 55 PRO HB3 1 58 PHE HB2 . . 5.150 4.759 4.495 4.995 . 0 0 "[ . 1 . 2]" 1
1256 1 55 PRO HB3 1 58 PHE QD . . 4.190 3.437 3.315 3.566 . 0 0 "[ . 1 . 2]" 1
1257 1 55 PRO HB3 1 58 PHE QE . . 4.810 4.030 3.836 4.156 . 0 0 "[ . 1 . 2]" 1
1258 1 55 PRO HD2 1 58 PHE QD . . 4.800 4.483 4.216 4.680 . 0 0 "[ . 1 . 2]" 1
1259 1 55 PRO HD2 1 58 PHE QE . . 5.500 5.411 5.088 5.500 0.000 20 0 "[ . 1 . 2]" 1
1260 1 55 PRO QG 1 58 PHE QD . . 3.970 2.293 1.944 2.609 . 0 0 "[ . 1 . 2]" 1
1261 1 55 PRO QG 1 58 PHE QE . . 3.820 3.029 2.647 3.192 . 0 0 "[ . 1 . 2]" 1
1262 1 55 PRO QG 1 58 PHE HZ . . 4.610 4.241 4.007 4.460 . 0 0 "[ . 1 . 2]" 1
1263 1 55 PRO HG2 1 58 PHE QD . . 4.610 2.378 1.997 2.714 . 0 0 "[ . 1 . 2]" 1
1264 1 55 PRO HG3 1 58 PHE QD . . 4.610 3.018 2.672 3.383 . 0 0 "[ . 1 . 2]" 1
1265 1 56 ALA H 1 56 ALA MB . . 3.050 2.155 2.025 2.244 . 0 0 "[ . 1 . 2]" 1
1266 1 56 ALA H 1 57 LYS H . . 3.700 2.712 2.400 2.871 . 0 0 "[ . 1 . 2]" 1
1267 1 56 ALA H 1 57 LYS QG . . 5.060 3.968 3.632 4.627 . 0 0 "[ . 1 . 2]" 1
1268 1 56 ALA HA 1 58 PHE H . . 4.340 3.839 3.395 4.117 . 0 0 "[ . 1 . 2]" 1
1269 1 56 ALA HA 1 59 VAL H . . 4.160 3.207 3.123 3.313 . 0 0 "[ . 1 . 2]" 1
1270 1 56 ALA HA 1 59 VAL MG1 . . 4.720 3.782 3.633 3.926 . 0 0 "[ . 1 . 2]" 1
1271 1 56 ALA HA 1 59 VAL MG2 . . 3.550 2.122 1.945 2.457 . 0 0 "[ . 1 . 2]" 1
1272 1 56 ALA MB 1 57 LYS H . . 3.440 2.698 2.538 2.834 . 0 0 "[ . 1 . 2]" 1
1273 1 56 ALA MB 1 57 LYS HA . . 4.570 3.780 3.675 3.860 . 0 0 "[ . 1 . 2]" 1
1274 1 56 ALA MB 1 58 PHE H . . 4.910 4.369 4.149 4.491 . 0 0 "[ . 1 . 2]" 1
1275 1 56 ALA MB 1 59 VAL MG2 . . 4.200 3.096 2.914 3.237 . 0 0 "[ . 1 . 2]" 1
1276 1 57 LYS H 1 57 LYS HB2 . . 3.620 3.584 3.519 3.599 . 0 0 "[ . 1 . 2]" 1
1277 1 57 LYS H 1 57 LYS QB . . 3.090 2.455 2.206 2.587 . 0 0 "[ . 1 . 2]" 1
1278 1 57 LYS H 1 57 LYS HB3 . . 3.620 2.501 2.230 2.653 . 0 0 "[ . 1 . 2]" 1
1279 1 57 LYS H 1 57 LYS QD . . 4.430 3.670 3.214 4.248 . 0 0 "[ . 1 . 2]" 1
1280 1 57 LYS H 1 57 LYS HG2 . . 3.910 2.310 1.903 3.611 . 0 0 "[ . 1 . 2]" 1
1281 1 57 LYS H 1 57 LYS QG . . 3.060 2.182 1.892 2.738 . 0 0 "[ . 1 . 2]" 1
1282 1 57 LYS H 1 57 LYS HG3 . . 3.910 3.339 2.040 3.804 . 0 0 "[ . 1 . 2]" 1
1283 1 57 LYS H 1 58 PHE H . . 3.610 2.768 2.653 2.904 . 0 0 "[ . 1 . 2]" 1
1284 1 57 LYS H 1 58 PHE QD . . 4.770 4.201 3.663 4.407 . 0 0 "[ . 1 . 2]" 1
1285 1 57 LYS HA 1 57 LYS QD . . 4.350 4.223 3.413 4.356 0.006 15 0 "[ . 1 . 2]" 1
1286 1 57 LYS HA 1 57 LYS QG . . 3.740 3.347 3.326 3.443 . 0 0 "[ . 1 . 2]" 1
1287 1 57 LYS HA 1 58 PHE QD . . 5.360 5.185 4.678 5.361 0.001 19 0 "[ . 1 . 2]" 1
1288 1 57 LYS HA 1 59 VAL H . . 4.350 4.100 3.879 4.252 . 0 0 "[ . 1 . 2]" 1
1289 1 57 LYS QB 1 58 PHE QD . . 4.770 4.046 3.755 4.401 . 0 0 "[ . 1 . 2]" 1
1290 1 57 LYS HB2 1 58 PHE H . . 4.750 3.887 3.592 4.181 . 0 0 "[ . 1 . 2]" 1
1291 1 57 LYS HB2 1 58 PHE QD . . 5.430 4.402 4.025 4.916 . 0 0 "[ . 1 . 2]" 1
1292 1 57 LYS HB3 1 58 PHE H . . 4.750 4.027 3.823 4.306 . 0 0 "[ . 1 . 2]" 1
1293 1 57 LYS HB3 1 58 PHE QD . . 5.430 4.745 4.417 5.134 . 0 0 "[ . 1 . 2]" 1
1294 1 57 LYS QD 1 58 PHE QD . . 4.810 3.388 2.048 3.916 . 0 0 "[ . 1 . 2]" 1
1295 1 57 LYS QD 1 58 PHE QE . . 4.720 3.546 2.870 4.109 . 0 0 "[ . 1 . 2]" 1
1296 1 57 LYS QE 1 57 LYS QG . . 3.310 2.197 2.069 2.492 . 0 0 "[ . 1 . 2]" 1
1297 1 57 LYS QE 1 58 PHE QE . . 4.570 2.565 1.903 3.702 . 0 0 "[ . 1 . 2]" 1
1298 1 57 LYS QE 1 58 PHE HZ . . 4.840 4.402 3.327 4.831 . 0 0 "[ . 1 . 2]" 1
1299 1 57 LYS QG 1 58 PHE H . . 3.570 2.283 2.081 2.787 . 0 0 "[ . 1 . 2]" 1
1300 1 57 LYS QG 1 58 PHE HB2 . . 4.720 3.668 3.520 4.032 . 0 0 "[ . 1 . 2]" 1
1301 1 57 LYS QG 1 58 PHE QD . . 3.420 2.002 1.856 2.618 . 0 0 "[ . 1 . 2]" 1
1302 1 57 LYS QG 1 58 PHE QE . . 4.520 3.264 2.667 3.849 . 0 0 "[ . 1 . 2]" 1
1303 1 57 LYS QG 1 59 VAL H . . 5.340 4.420 4.251 4.867 . 0 0 "[ . 1 . 2]" 1
1304 1 57 LYS HG2 1 58 PHE H . . 4.350 2.776 2.254 4.350 . 0 0 "[ . 1 . 2]" 1
1305 1 57 LYS HG2 1 58 PHE QD . . 4.030 2.723 2.029 3.901 . 0 0 "[ . 1 . 2]" 1
1306 1 57 LYS HG3 1 58 PHE H . . 4.350 2.584 2.146 3.559 . 0 0 "[ . 1 . 2]" 1
1307 1 57 LYS HG3 1 58 PHE QD . . 4.030 2.104 2.000 2.729 . 0 0 "[ . 1 . 2]" 1
1308 1 58 PHE H 1 58 PHE HB2 . . 3.150 2.195 2.180 2.269 . 0 0 "[ . 1 . 2]" 1
1309 1 58 PHE H 1 58 PHE HB3 . . 3.660 3.497 3.471 3.541 . 0 0 "[ . 1 . 2]" 1
1310 1 58 PHE H 1 58 PHE QD . . 3.810 2.449 2.229 2.787 . 0 0 "[ . 1 . 2]" 1
1311 1 58 PHE H 1 59 VAL H . . 3.260 2.514 2.201 2.678 . 0 0 "[ . 1 . 2]" 1
1312 1 58 PHE H 1 59 VAL MG1 . . 4.410 4.001 3.767 4.202 . 0 0 "[ . 1 . 2]" 1
1313 1 58 PHE H 1 59 VAL MG2 . . 4.500 4.023 3.780 4.153 . 0 0 "[ . 1 . 2]" 1
1314 1 58 PHE HB2 1 59 VAL H . . 4.330 3.038 2.892 3.276 . 0 0 "[ . 1 . 2]" 1
1315 1 58 PHE HB2 1 59 VAL MG1 . . 3.960 3.059 2.961 3.216 . 0 0 "[ . 1 . 2]" 1
1316 1 58 PHE HB3 1 59 VAL H . . 4.730 3.542 3.408 3.766 . 0 0 "[ . 1 . 2]" 1
1317 1 58 PHE HB3 1 59 VAL MG1 . . 4.030 2.905 2.774 3.014 . 0 0 "[ . 1 . 2]" 1
1318 1 58 PHE HB3 1 59 VAL MG2 . . 5.000 4.751 4.628 4.901 . 0 0 "[ . 1 . 2]" 1
1319 1 58 PHE QD 1 59 VAL H . . 5.500 4.521 4.426 4.646 . 0 0 "[ . 1 . 2]" 1
1320 1 59 VAL H 1 59 VAL MG1 . . 3.690 2.457 2.276 2.745 . 0 0 "[ . 1 . 2]" 1
1321 1 59 VAL H 1 59 VAL MG2 . . 3.160 2.219 2.058 2.342 . 0 0 "[ . 1 . 2]" 1
1322 1 59 VAL H 1 60 GLU H . . 4.780 4.469 4.432 4.503 . 0 0 "[ . 1 . 2]" 1
1323 1 59 VAL HA 1 59 VAL MG1 . . 3.160 2.500 2.420 2.575 . 0 0 "[ . 1 . 2]" 1
1324 1 59 VAL HA 1 60 GLU H . . 2.950 2.543 2.466 2.604 . 0 0 "[ . 1 . 2]" 1
1325 1 59 VAL HA 1 60 GLU QB . . 4.410 3.934 3.895 3.968 . 0 0 "[ . 1 . 2]" 1
1326 1 59 VAL HB 1 60 GLU H . . 3.110 2.187 2.082 2.325 . 0 0 "[ . 1 . 2]" 1
1327 1 59 VAL MG1 1 60 GLU H . . 3.820 3.725 3.624 3.804 . 0 0 "[ . 1 . 2]" 1
1328 1 59 VAL MG2 1 60 GLU H . . 3.920 2.855 2.543 3.132 . 0 0 "[ . 1 . 2]" 1
1329 1 59 VAL MG2 1 61 VAL H . . 4.590 4.163 3.921 4.442 . 0 0 "[ . 1 . 2]" 1
1330 1 59 VAL MG2 1 61 VAL HA . . 4.800 4.263 3.975 4.576 . 0 0 "[ . 1 . 2]" 1
1331 1 60 GLU H 1 60 GLU QB . . 3.210 2.569 2.506 2.660 . 0 0 "[ . 1 . 2]" 1
1332 1 60 GLU H 1 60 GLU HG2 . . 5.120 4.797 4.377 4.976 . 0 0 "[ . 1 . 2]" 1
1333 1 60 GLU H 1 60 GLU QG . . 4.290 4.155 4.027 4.283 . 0 0 "[ . 1 . 2]" 1
1334 1 60 GLU H 1 60 GLU HG3 . . 5.120 4.578 4.356 4.788 . 0 0 "[ . 1 . 2]" 1
1335 1 60 GLU H 1 61 VAL H . . 4.730 4.346 4.287 4.418 . 0 0 "[ . 1 . 2]" 1
1336 1 60 GLU QB 1 61 VAL H . . 4.220 3.659 3.487 3.750 . 0 0 "[ . 1 . 2]" 1
1337 1 60 GLU QG 1 61 VAL H . . 4.090 2.713 2.317 3.248 . 0 0 "[ . 1 . 2]" 1
1338 1 60 GLU QG 1 62 LEU MD2 . . 3.640 3.049 2.534 3.640 . 0 0 "[ . 1 . 2]" 1
1339 1 60 GLU HG2 1 61 VAL H . . 4.660 3.980 2.990 4.472 . 0 0 "[ . 1 . 2]" 1
1340 1 60 GLU HG2 1 62 LEU MD2 . . 4.440 3.657 2.561 4.307 . 0 0 "[ . 1 . 2]" 1
1341 1 60 GLU HG3 1 61 VAL H . . 4.660 2.792 2.332 3.335 . 0 0 "[ . 1 . 2]" 1
1342 1 60 GLU HG3 1 62 LEU MD2 . . 4.440 3.617 2.647 4.439 . 0 0 "[ . 1 . 2]" 1
1343 1 61 VAL H 1 61 VAL HB . . 2.990 2.576 2.495 2.663 . 0 0 "[ . 1 . 2]" 1
1344 1 61 VAL H 1 61 VAL MG1 . . 3.860 3.768 3.759 3.777 . 0 0 "[ . 1 . 2]" 1
1345 1 61 VAL H 1 61 VAL QG . . 2.970 2.111 1.911 2.354 . 0 0 "[ . 1 . 2]" 1
1346 1 61 VAL H 1 61 VAL MG2 . . 3.860 2.123 1.916 2.378 . 0 0 "[ . 1 . 2]" 1
1347 1 61 VAL HA 1 61 VAL MG1 . . 3.160 2.305 2.216 2.421 . 0 0 "[ . 1 . 2]" 1
1348 1 61 VAL HA 1 61 VAL MG2 . . 3.160 2.404 2.282 2.485 . 0 0 "[ . 1 . 2]" 1
1349 1 61 VAL HA 1 62 LEU H . . 2.820 2.295 2.230 2.354 . 0 0 "[ . 1 . 2]" 1
1350 1 61 VAL HA 1 62 LEU HA . . 4.680 4.446 4.418 4.480 . 0 0 "[ . 1 . 2]" 1
1351 1 61 VAL HA 1 62 LEU HB2 . . 5.120 4.922 4.872 4.960 . 0 0 "[ . 1 . 2]" 1
1352 1 61 VAL HA 1 62 LEU HB3 . . 5.500 5.512 5.499 5.525 0.025 11 0 "[ . 1 . 2]" 1
1353 1 61 VAL HA 1 62 LEU MD1 . . 4.640 4.391 4.261 4.454 . 0 0 "[ . 1 . 2]" 1
1354 1 61 VAL HA 1 62 LEU MD2 . . 4.280 3.950 3.837 4.058 . 0 0 "[ . 1 . 2]" 1
1355 1 61 VAL HA 1 62 LEU HG . . 3.810 3.076 3.021 3.132 . 0 0 "[ . 1 . 2]" 1
1356 1 61 VAL HB 1 62 LEU H . . 4.390 3.751 3.619 3.846 . 0 0 "[ . 1 . 2]" 1
1357 1 61 VAL QG 1 62 LEU H . . 3.180 1.970 1.830 2.210 . 0 0 "[ . 1 . 2]" 1
1358 1 61 VAL QG 1 62 LEU HA . . 4.280 3.482 3.209 3.675 . 0 0 "[ . 1 . 2]" 1
1359 1 61 VAL MG1 1 62 LEU H . . 4.120 1.976 1.833 2.220 . 0 0 "[ . 1 . 2]" 1
1360 1 61 VAL MG2 1 62 LEU H . . 4.120 3.873 3.686 4.030 . 0 0 "[ . 1 . 2]" 1
1361 1 62 LEU H 1 62 LEU HB2 . . 3.480 3.035 2.963 3.097 . 0 0 "[ . 1 . 2]" 1
1362 1 62 LEU H 1 62 LEU HB3 . . 3.930 3.880 3.815 3.932 0.002 15 0 "[ . 1 . 2]" 1
1363 1 62 LEU H 1 62 LEU MD1 . . 3.940 3.708 3.569 3.880 . 0 0 "[ . 1 . 2]" 1
1364 1 62 LEU H 1 62 LEU MD2 . . 3.960 3.716 3.617 3.794 . 0 0 "[ . 1 . 2]" 1
1365 1 62 LEU H 1 62 LEU HG . . 3.040 2.505 2.346 2.660 . 0 0 "[ . 1 . 2]" 1
1366 1 62 LEU HA 1 62 LEU MD1 . . 4.180 4.045 4.032 4.051 . 0 0 "[ . 1 . 2]" 1
1367 1 62 LEU HA 1 62 LEU MD2 . . 2.930 2.721 2.605 2.784 . 0 0 "[ . 1 . 2]" 1
1368 1 62 LEU HA 1 62 LEU HG . . 4.090 3.242 3.208 3.282 . 0 0 "[ . 1 . 2]" 1
1369 1 62 LEU HA 1 63 ASP H . . 3.190 2.180 2.138 2.481 . 0 0 "[ . 1 . 2]" 1
1370 1 62 LEU HB2 1 62 LEU MD1 . . 3.320 2.089 1.995 2.249 . 0 0 "[ . 1 . 2]" 1
1371 1 62 LEU HB2 1 63 ASP H . . 4.370 3.849 3.017 4.099 . 0 0 "[ . 1 . 2]" 1
1372 1 62 LEU HB2 1 64 GLU QG . . 4.850 3.827 3.247 4.172 . 0 0 "[ . 1 . 2]" 1
1373 1 62 LEU HB3 1 62 LEU MD1 . . 3.280 2.609 2.511 2.670 . 0 0 "[ . 1 . 2]" 1
1374 1 62 LEU HB3 1 62 LEU MD2 . . 3.420 2.059 2.025 2.132 . 0 0 "[ . 1 . 2]" 1
1375 1 62 LEU HB3 1 63 ASP H . . 4.250 3.329 2.489 3.650 . 0 0 "[ . 1 . 2]" 1
1376 1 62 LEU HB3 1 64 GLU QG . . 4.730 4.379 3.365 4.731 0.001 7 0 "[ . 1 . 2]" 1
1377 1 62 LEU MD1 1 64 GLU QG . . 4.690 4.360 3.746 4.622 . 0 0 "[ . 1 . 2]" 1
1378 1 62 LEU MD2 1 63 ASP H . . 4.420 4.304 3.978 4.422 0.002 16 0 "[ . 1 . 2]" 1
1379 1 63 ASP H 1 63 ASP HB2 . . 3.850 2.990 2.401 3.714 . 0 0 "[ . 1 . 2]" 1
1380 1 63 ASP H 1 63 ASP HB3 . . 3.850 3.060 2.465 3.732 . 0 0 "[ . 1 . 2]" 1
1381 1 63 ASP HA 1 64 GLU H . . 3.290 2.379 2.141 2.907 . 0 0 "[ . 1 . 2]" 1
1382 1 63 ASP QB 1 64 GLU H . . 4.240 3.698 2.845 4.056 . 0 0 "[ . 1 . 2]" 1
1383 1 64 GLU H 1 64 GLU QB . . 3.560 2.639 2.214 3.232 . 0 0 "[ . 1 . 2]" 1
1384 1 64 GLU H 1 64 GLU QG . . 4.070 2.722 1.994 3.440 . 0 0 "[ . 1 . 2]" 1
1385 1 64 GLU H 1 65 ARG H . . 4.660 3.496 1.936 4.639 . 0 0 "[ . 1 . 2]" 1
1386 1 64 GLU HA 1 64 GLU QG . . 3.610 2.519 2.200 3.505 . 0 0 "[ . 1 . 2]" 1
1387 1 64 GLU QG 1 65 ARG H . . 4.770 4.212 3.413 4.670 . 0 0 "[ . 1 . 2]" 1
1388 1 65 ARG H 1 65 ARG QB . . 3.500 2.616 2.121 3.338 . 0 0 "[ . 1 . 2]" 1
1389 1 65 ARG H 1 65 ARG QG . . 3.920 2.954 1.883 3.921 0.001 2 0 "[ . 1 . 2]" 1
1390 1 65 ARG H 1 66 SER QB . . 4.900 4.586 4.258 4.892 . 0 0 "[ . 1 . 2]" 1
1391 1 65 ARG HA 1 65 ARG HD2 . . 5.140 3.975 2.088 5.019 . 0 0 "[ . 1 . 2]" 1
1392 1 65 ARG HA 1 65 ARG QD . . 4.530 3.404 2.067 4.263 . 0 0 "[ . 1 . 2]" 1
1393 1 65 ARG HA 1 65 ARG HD3 . . 5.140 3.897 2.256 4.925 . 0 0 "[ . 1 . 2]" 1
1394 1 65 ARG HA 1 65 ARG QG . . 3.370 2.840 2.170 3.400 0.030 12 0 "[ . 1 . 2]" 1
1395 1 65 ARG QB 1 65 ARG QD . . 3.220 2.194 2.070 2.479 . 0 0 "[ . 1 . 2]" 1
1396 1 67 LYS HA 1 67 LYS QD . . 4.490 3.523 2.071 4.456 . 0 0 "[ . 1 . 2]" 1
1397 1 67 LYS HA 1 67 LYS QE . . 5.500 4.291 1.988 5.468 . 0 0 "[ . 1 . 2]" 1
1398 1 67 LYS HA 1 67 LYS QG . . 3.800 2.748 2.238 3.445 . 0 0 "[ . 1 . 2]" 1
1399 1 67 LYS QB 1 68 GLU H . . 4.280 3.278 2.097 4.028 . 0 0 "[ . 1 . 2]" 1
1400 1 67 LYS HB2 1 68 GLU H . . 4.960 3.768 2.176 4.653 . 0 0 "[ . 1 . 2]" 1
1401 1 67 LYS HB3 1 68 GLU H . . 4.960 3.904 2.111 4.653 . 0 0 "[ . 1 . 2]" 1
1402 1 67 LYS QD 1 69 TYR QD . . 4.470 3.793 2.760 4.465 . 0 0 "[ . 1 . 2]" 1
1403 1 67 LYS QD 1 69 TYR QE . . 4.480 2.876 1.999 4.230 . 0 0 "[ . 1 . 2]" 1
1404 1 67 LYS QG 1 69 TYR QD . . 4.960 3.682 1.999 4.884 . 0 0 "[ . 1 . 2]" 1
1405 1 68 GLU H 1 68 GLU QB . . 3.640 2.584 2.129 3.102 . 0 0 "[ . 1 . 2]" 1
1406 1 68 GLU H 1 68 GLU QG . . 4.960 3.525 1.863 4.415 . 0 0 "[ . 1 . 2]" 1
1407 1 68 GLU H 1 69 TYR H . . 4.490 4.275 3.345 4.503 0.013 15 0 "[ . 1 . 2]" 1
1408 1 68 GLU HA 1 68 GLU QG . . 3.910 2.686 2.145 3.439 . 0 0 "[ . 1 . 2]" 1
1409 1 68 GLU HA 1 69 TYR H . . 3.430 2.288 2.138 2.717 . 0 0 "[ . 1 . 2]" 1
1410 1 68 GLU HA 1 69 TYR QD . . 4.700 3.401 2.720 4.359 . 0 0 "[ . 1 . 2]" 1
1411 1 68 GLU HA 1 69 TYR QE . . 5.260 4.858 4.321 5.254 . 0 0 "[ . 1 . 2]" 1
1412 1 68 GLU QB 1 69 TYR H . . 4.270 3.389 2.152 4.038 . 0 0 "[ . 1 . 2]" 1
1413 1 68 GLU QB 1 69 TYR QD . . 5.060 4.624 3.108 5.063 0.003 15 0 "[ . 1 . 2]" 1
1414 1 68 GLU QG 1 69 TYR QD . . 4.950 4.506 2.439 4.929 . 0 0 "[ . 1 . 2]" 1
1415 1 69 TYR H 1 69 TYR HB2 . . 3.850 2.518 2.242 2.884 . 0 0 "[ . 1 . 2]" 1
1416 1 69 TYR H 1 69 TYR QB . . 3.330 2.474 2.218 2.807 . 0 0 "[ . 1 . 2]" 1
1417 1 69 TYR H 1 69 TYR HB3 . . 3.850 3.677 3.531 3.851 0.001 3 0 "[ . 1 . 2]" 1
1418 1 69 TYR H 1 69 TYR QD . . 4.450 2.631 1.974 3.436 . 0 0 "[ . 1 . 2]" 1
1419 1 69 TYR HA 1 69 TYR QD . . 3.650 2.886 2.371 3.164 . 0 0 "[ . 1 . 2]" 1
1420 1 69 TYR HA 1 69 TYR QE . . 4.790 4.606 4.473 4.716 . 0 0 "[ . 1 . 2]" 1
1421 1 69 TYR QB 1 70 SER H . . 4.160 3.103 2.231 3.868 . 0 0 "[ . 1 . 2]" 1
1422 1 70 SER HA 1 71 ILE H . . 3.500 2.546 2.145 3.504 0.004 19 0 "[ . 1 . 2]" 1
1423 1 70 SER QB 1 71 ILE H . . 4.520 3.078 2.153 3.997 . 0 0 "[ . 1 . 2]" 1
1424 1 70 SER QB 1 71 ILE QG . . 4.650 4.240 3.216 4.644 . 0 0 "[ . 1 . 2]" 1
1425 1 71 ILE H 1 71 ILE HB . . 3.940 3.183 2.538 3.874 . 0 0 "[ . 1 . 2]" 1
1426 1 71 ILE H 1 71 ILE MD . . 5.450 3.448 1.891 4.100 . 0 0 "[ . 1 . 2]" 1
1427 1 71 ILE H 1 71 ILE HG12 . . 4.530 2.999 1.974 4.520 . 0 0 "[ . 1 . 2]" 1
1428 1 71 ILE H 1 71 ILE QG . . 3.960 2.444 1.848 3.515 . 0 0 "[ . 1 . 2]" 1
1429 1 71 ILE H 1 71 ILE HG13 . . 4.530 2.976 2.006 4.226 . 0 0 "[ . 1 . 2]" 1
1430 1 71 ILE H 1 71 ILE MG . . 4.730 3.256 1.895 3.932 . 0 0 "[ . 1 . 2]" 1
1431 1 71 ILE HA 1 71 ILE MD . . 4.360 3.640 1.957 4.181 . 0 0 "[ . 1 . 2]" 1
1432 1 71 ILE HA 1 71 ILE QG . . 3.660 2.953 2.309 3.483 . 0 0 "[ . 1 . 2]" 1
1433 1 71 ILE HA 1 71 ILE MG . . 3.630 2.325 2.071 2.479 . 0 0 "[ . 1 . 2]" 1
1434 1 74 GLY HA2 1 75 PRO QD . . 3.640 2.768 1.958 3.437 . 0 0 "[ . 1 . 2]" 1
1435 1 74 GLY HA3 1 75 PRO QD . . 3.640 2.366 1.960 3.438 . 0 0 "[ . 1 . 2]" 1
stop_
save_
Contact the webmaster for help, if required. Saturday, May 18, 2024 2:56:58 AM GMT (wattos1)