NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
420425 |
2eki   |
10273 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2eki
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 2008
_Distance_constraint_stats_list.Viol_count 455
_Distance_constraint_stats_list.Viol_total 89.474
_Distance_constraint_stats_list.Viol_max 0.159
_Distance_constraint_stats_list.Viol_rms 0.0021
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0001
_Distance_constraint_stats_list.Viol_average_violations_only 0.0098
_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 8 TYR 0.002 0.001 17 0 "[ . 1 . 2]"
1 9 LEU 0.042 0.029 3 0 "[ . 1 . 2]"
1 10 LYS 0.042 0.009 19 0 "[ . 1 . 2]"
1 11 LEU 0.013 0.006 9 0 "[ . 1 . 2]"
1 12 VAL 0.018 0.008 9 0 "[ . 1 . 2]"
1 13 ARG 0.234 0.045 5 0 "[ . 1 . 2]"
1 14 ILE 0.041 0.013 11 0 "[ . 1 . 2]"
1 15 TYR 0.034 0.018 11 0 "[ . 1 . 2]"
1 16 THR 0.067 0.018 11 0 "[ . 1 . 2]"
1 17 LYS 0.255 0.029 12 0 "[ . 1 . 2]"
1 18 PRO 0.195 0.043 10 0 "[ . 1 . 2]"
1 19 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 21 GLN 0.255 0.079 7 0 "[ . 1 . 2]"
1 22 LEU 0.518 0.079 7 0 "[ . 1 . 2]"
1 23 PRO 0.109 0.027 12 0 "[ . 1 . 2]"
1 24 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 25 TYR 0.121 0.038 11 0 "[ . 1 . 2]"
1 26 THR 0.025 0.014 6 0 "[ . 1 . 2]"
1 27 SER 0.016 0.013 11 0 "[ . 1 . 2]"
1 28 PRO 0.054 0.020 9 0 "[ . 1 . 2]"
1 29 VAL 0.642 0.121 9 0 "[ . 1 . 2]"
1 30 VAL 0.831 0.121 9 0 "[ . 1 . 2]"
1 31 LEU 0.039 0.011 5 0 "[ . 1 . 2]"
1 32 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 33 TYR 0.033 0.008 9 0 "[ . 1 . 2]"
1 34 SER 0.006 0.005 9 0 "[ . 1 . 2]"
1 35 ARG 0.108 0.041 5 0 "[ . 1 . 2]"
1 36 THR 0.021 0.013 5 0 "[ . 1 . 2]"
1 37 THR 0.024 0.008 1 0 "[ . 1 . 2]"
1 38 VAL 0.001 0.001 1 0 "[ . 1 . 2]"
1 39 GLU 0.039 0.011 1 0 "[ . 1 . 2]"
1 40 ASP 0.021 0.008 1 0 "[ . 1 . 2]"
1 41 PHE 0.066 0.012 11 0 "[ . 1 . 2]"
1 42 CYS 0.042 0.017 1 0 "[ . 1 . 2]"
1 43 MET 0.031 0.007 1 0 "[ . 1 . 2]"
1 44 LYS 0.010 0.006 6 0 "[ . 1 . 2]"
1 45 ILE 0.039 0.010 6 0 "[ . 1 . 2]"
1 46 HIS 0.052 0.013 15 0 "[ . 1 . 2]"
1 47 LYS 0.004 0.002 6 0 "[ . 1 . 2]"
1 48 ASN 0.029 0.013 10 0 "[ . 1 . 2]"
1 49 LEU 0.061 0.013 15 0 "[ . 1 . 2]"
1 50 ILE 0.052 0.017 1 0 "[ . 1 . 2]"
1 51 LYS 0.324 0.111 10 0 "[ . 1 . 2]"
1 52 GLU 0.015 0.007 10 0 "[ . 1 . 2]"
1 53 PHE 0.016 0.005 14 0 "[ . 1 . 2]"
1 54 LYS 0.008 0.003 2 0 "[ . 1 . 2]"
1 55 TYR 0.117 0.027 2 0 "[ . 1 . 2]"
1 56 ALA 0.059 0.021 15 0 "[ . 1 . 2]"
1 57 LEU 0.110 0.022 9 0 "[ . 1 . 2]"
1 58 VAL 0.017 0.004 13 0 "[ . 1 . 2]"
1 59 TRP 0.464 0.159 20 0 "[ . 1 . 2]"
1 60 GLY 0.522 0.159 20 0 "[ . 1 . 2]"
1 61 LEU 0.110 0.033 16 0 "[ . 1 . 2]"
1 62 SER 0.017 0.009 8 0 "[ . 1 . 2]"
1 63 VAL 0.134 0.026 17 0 "[ . 1 . 2]"
1 64 LYS 0.078 0.068 19 0 "[ . 1 . 2]"
1 65 HIS 0.195 0.021 1 0 "[ . 1 . 2]"
1 66 ASN 0.016 0.016 18 0 "[ . 1 . 2]"
1 67 PRO 0.010 0.004 19 0 "[ . 1 . 2]"
1 68 GLN 0.189 0.021 1 0 "[ . 1 . 2]"
1 69 LYS 0.060 0.020 3 0 "[ . 1 . 2]"
1 70 VAL 0.020 0.004 13 0 "[ . 1 . 2]"
1 71 GLY 0.009 0.005 14 0 "[ . 1 . 2]"
1 72 LYS 0.216 0.054 12 0 "[ . 1 . 2]"
1 73 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 74 HIS 0.016 0.005 15 0 "[ . 1 . 2]"
1 75 THR 0.001 0.001 10 0 "[ . 1 . 2]"
1 76 LEU 0.005 0.002 8 0 "[ . 1 . 2]"
1 77 GLU 0.018 0.009 8 0 "[ . 1 . 2]"
1 78 ASP 0.005 0.003 15 0 "[ . 1 . 2]"
1 79 GLU 0.003 0.002 15 0 "[ . 1 . 2]"
1 80 ASP 0.009 0.005 4 0 "[ . 1 . 2]"
1 81 VAL 0.017 0.005 4 0 "[ . 1 . 2]"
1 82 ILE 0.023 0.008 11 0 "[ . 1 . 2]"
1 83 GLN 0.001 0.001 3 0 "[ . 1 . 2]"
1 84 ILE 0.071 0.031 7 0 "[ . 1 . 2]"
1 85 VAL 0.133 0.031 7 0 "[ . 1 . 2]"
1 86 LYS 0.009 0.001 17 0 "[ . 1 . 2]"
1 87 LYS 0.041 0.035 16 0 "[ . 1 . 2]"
1 89 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 90 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 8 TYR H 1 8 TYR QB . . 3.620 2.674 2.254 3.156 . 0 0 "[ . 1 . 2]" 1
2 1 8 TYR H 1 8 TYR QD . . 4.670 3.209 1.911 4.465 . 0 0 "[ . 1 . 2]" 1
3 1 8 TYR HA 1 8 TYR QD . . 3.900 3.404 2.843 3.729 . 0 0 "[ . 1 . 2]" 1
4 1 8 TYR HA 1 9 LEU H . . 3.230 3.069 2.268 3.231 0.001 17 0 "[ . 1 . 2]" 1
5 1 8 TYR HA 1 10 LYS H . . 5.500 4.675 3.744 5.363 . 0 0 "[ . 1 . 2]" 1
6 1 8 TYR HB2 1 9 LEU H . . 5.410 4.373 4.089 4.582 . 0 0 "[ . 1 . 2]" 1
7 1 8 TYR HB3 1 9 LEU H . . 5.410 4.247 3.648 4.657 . 0 0 "[ . 1 . 2]" 1
8 1 8 TYR QD 1 9 LEU H . . 4.550 3.605 2.368 4.432 . 0 0 "[ . 1 . 2]" 1
9 1 8 TYR QD 1 9 LEU HA . . 4.200 3.442 2.899 4.056 . 0 0 "[ . 1 . 2]" 1
10 1 8 TYR QD 1 9 LEU QD . . 3.820 3.469 2.535 3.816 . 0 0 "[ . 1 . 2]" 1
11 1 8 TYR QD 1 10 LYS H . . 5.330 4.535 3.730 5.184 . 0 0 "[ . 1 . 2]" 1
12 1 8 TYR QE 1 9 LEU HA . . 5.020 4.673 4.175 5.011 . 0 0 "[ . 1 . 2]" 1
13 1 8 TYR QE 1 9 LEU QD . . 4.500 3.785 3.050 4.491 . 0 0 "[ . 1 . 2]" 1
14 1 8 TYR QE 1 34 SER QB . . 5.000 4.601 3.748 4.994 . 0 0 "[ . 1 . 2]" 1
15 1 9 LEU H 1 9 LEU QB . . 3.320 2.246 2.104 2.950 . 0 0 "[ . 1 . 2]" 1
16 1 9 LEU H 1 9 LEU QD . . 4.570 3.264 1.991 3.774 . 0 0 "[ . 1 . 2]" 1
17 1 9 LEU H 1 9 LEU HG . . 5.020 4.234 2.898 4.919 . 0 0 "[ . 1 . 2]" 1
18 1 9 LEU HA 1 9 LEU MD1 . . 3.810 2.641 1.931 3.820 0.010 8 0 "[ . 1 . 2]" 1
19 1 9 LEU HA 1 9 LEU QD . . 3.070 2.186 1.899 2.931 . 0 0 "[ . 1 . 2]" 1
20 1 9 LEU HA 1 9 LEU MD2 . . 3.810 2.801 1.957 3.839 0.029 3 0 "[ . 1 . 2]" 1
21 1 9 LEU HA 1 9 LEU HG . . 4.210 3.118 2.275 3.723 . 0 0 "[ . 1 . 2]" 1
22 1 9 LEU HA 1 10 LYS H . . 2.750 2.289 2.144 2.721 . 0 0 "[ . 1 . 2]" 1
23 1 9 LEU HA 1 33 TYR H . . 5.240 4.736 4.291 5.138 . 0 0 "[ . 1 . 2]" 1
24 1 9 LEU HA 1 33 TYR HB2 . . 4.800 4.412 4.070 4.713 . 0 0 "[ . 1 . 2]" 1
25 1 9 LEU HA 1 33 TYR HB3 . . 4.640 3.645 2.957 4.154 . 0 0 "[ . 1 . 2]" 1
26 1 9 LEU QB 1 10 LYS H . . 4.070 3.883 3.479 3.993 . 0 0 "[ . 1 . 2]" 1
27 1 9 LEU QD 1 10 LYS H . . 4.340 3.520 2.796 4.339 . 0 0 "[ . 1 . 2]" 1
28 1 9 LEU QD 1 33 TYR HA . . 5.440 5.069 4.377 5.438 . 0 0 "[ . 1 . 2]" 1
29 1 9 LEU QD 1 33 TYR HB3 . . 4.720 3.562 2.866 4.221 . 0 0 "[ . 1 . 2]" 1
30 1 10 LYS H 1 10 LYS HB2 . . 3.560 2.381 2.169 2.685 . 0 0 "[ . 1 . 2]" 1
31 1 10 LYS H 1 10 LYS QB . . 3.080 2.221 2.122 2.293 . 0 0 "[ . 1 . 2]" 1
32 1 10 LYS H 1 10 LYS HB3 . . 3.560 2.744 2.391 3.001 . 0 0 "[ . 1 . 2]" 1
33 1 10 LYS H 1 10 LYS HG2 . . 4.590 4.502 4.094 4.599 0.009 19 0 "[ . 1 . 2]" 1
34 1 10 LYS H 1 10 LYS HG3 . . 4.590 4.334 4.092 4.512 . 0 0 "[ . 1 . 2]" 1
35 1 10 LYS H 1 33 TYR HB2 . . 4.580 3.034 2.526 3.547 . 0 0 "[ . 1 . 2]" 1
36 1 10 LYS H 1 33 TYR HB3 . . 4.800 2.925 2.397 3.452 . 0 0 "[ . 1 . 2]" 1
37 1 10 LYS H 1 33 TYR QD . . 5.500 4.099 3.620 4.393 . 0 0 "[ . 1 . 2]" 1
38 1 10 LYS HA 1 10 LYS HD2 . . 4.940 4.304 3.684 4.612 . 0 0 "[ . 1 . 2]" 1
39 1 10 LYS HA 1 10 LYS QD . . 4.320 3.623 2.081 4.170 . 0 0 "[ . 1 . 2]" 1
40 1 10 LYS HA 1 10 LYS HD3 . . 4.940 4.050 2.093 4.802 . 0 0 "[ . 1 . 2]" 1
41 1 10 LYS HA 1 10 LYS QE . . 4.820 4.122 3.011 4.719 . 0 0 "[ . 1 . 2]" 1
42 1 10 LYS HA 1 10 LYS HG2 . . 3.860 2.918 2.184 3.866 0.006 12 0 "[ . 1 . 2]" 1
43 1 10 LYS HA 1 10 LYS HG3 . . 3.860 2.712 2.323 3.486 . 0 0 "[ . 1 . 2]" 1
44 1 10 LYS HA 1 11 LEU H . . 2.660 2.353 2.212 2.453 . 0 0 "[ . 1 . 2]" 1
45 1 10 LYS HA 1 11 LEU HB2 . . 4.850 4.439 4.241 4.685 . 0 0 "[ . 1 . 2]" 1
46 1 10 LYS HA 1 11 LEU QD . . 4.450 3.220 2.636 4.059 . 0 0 "[ . 1 . 2]" 1
47 1 10 LYS QB 1 10 LYS QD . . 3.060 2.238 2.058 2.677 . 0 0 "[ . 1 . 2]" 1
48 1 10 LYS QB 1 10 LYS QE . . 4.240 2.889 1.970 3.769 . 0 0 "[ . 1 . 2]" 1
49 1 10 LYS QB 1 11 LEU H . . 4.020 3.255 3.023 3.598 . 0 0 "[ . 1 . 2]" 1
50 1 10 LYS QB 1 12 VAL QG . . 4.800 3.475 3.075 3.801 . 0 0 "[ . 1 . 2]" 1
51 1 10 LYS QB 1 33 TYR HB3 . . 3.870 3.086 2.606 3.316 . 0 0 "[ . 1 . 2]" 1
52 1 10 LYS HB2 1 33 TYR HB2 . . 4.260 3.521 3.255 3.800 . 0 0 "[ . 1 . 2]" 1
53 1 10 LYS HB2 1 33 TYR HB3 . . 4.520 4.087 3.556 4.357 . 0 0 "[ . 1 . 2]" 1
54 1 10 LYS HB2 1 33 TYR QD . . 4.300 3.582 3.319 3.742 . 0 0 "[ . 1 . 2]" 1
55 1 10 LYS HB3 1 33 TYR HB2 . . 4.260 2.121 2.012 2.305 . 0 0 "[ . 1 . 2]" 1
56 1 10 LYS HB3 1 33 TYR HB3 . . 4.520 3.213 2.630 3.521 . 0 0 "[ . 1 . 2]" 1
57 1 10 LYS HB3 1 33 TYR QD . . 4.300 2.156 1.996 2.466 . 0 0 "[ . 1 . 2]" 1
58 1 10 LYS QD 1 12 VAL QG . . 3.860 3.281 2.207 3.851 . 0 0 "[ . 1 . 2]" 1
59 1 10 LYS QD 1 33 TYR HB2 . . 5.340 4.076 3.265 4.689 . 0 0 "[ . 1 . 2]" 1
60 1 10 LYS QD 1 33 TYR QD . . 4.100 2.698 1.993 3.911 . 0 0 "[ . 1 . 2]" 1
61 1 10 LYS QD 1 33 TYR QE . . 4.600 2.956 2.122 4.597 . 0 0 "[ . 1 . 2]" 1
62 1 10 LYS QE 1 10 LYS HG2 . . 3.650 2.715 2.232 3.417 . 0 0 "[ . 1 . 2]" 1
63 1 10 LYS QE 1 10 LYS HG3 . . 3.650 2.633 2.164 3.302 . 0 0 "[ . 1 . 2]" 1
64 1 10 LYS QE 1 33 TYR QD . . 4.390 4.130 3.752 4.382 . 0 0 "[ . 1 . 2]" 1
65 1 10 LYS QE 1 33 TYR QE . . 4.640 3.980 3.336 4.473 . 0 0 "[ . 1 . 2]" 1
66 1 10 LYS QG 1 12 VAL QG . . 4.190 3.463 2.345 4.168 . 0 0 "[ . 1 . 2]" 1
67 1 10 LYS QG 1 33 TYR HB2 . . 4.460 3.826 2.746 4.354 . 0 0 "[ . 1 . 2]" 1
68 1 10 LYS QG 1 33 TYR HB3 . . 5.340 5.023 4.053 5.343 0.003 10 0 "[ . 1 . 2]" 1
69 1 10 LYS QG 1 33 TYR QD . . 4.250 3.176 1.881 3.841 . 0 0 "[ . 1 . 2]" 1
70 1 10 LYS HG2 1 11 LEU H . . 4.590 2.383 1.899 4.119 . 0 0 "[ . 1 . 2]" 1
71 1 10 LYS HG2 1 33 TYR HB2 . . 5.200 4.164 3.491 4.983 . 0 0 "[ . 1 . 2]" 1
72 1 10 LYS HG3 1 11 LEU H . . 4.590 2.997 2.230 4.105 . 0 0 "[ . 1 . 2]" 1
73 1 10 LYS HG3 1 33 TYR HB2 . . 5.200 4.638 2.873 5.202 0.002 11 0 "[ . 1 . 2]" 1
74 1 11 LEU H 1 11 LEU HB2 . . 2.940 2.479 2.295 2.761 . 0 0 "[ . 1 . 2]" 1
75 1 11 LEU H 1 11 LEU HB3 . . 3.830 3.667 3.544 3.833 0.003 13 0 "[ . 1 . 2]" 1
76 1 11 LEU H 1 11 LEU MD1 . . 4.230 3.877 2.806 4.156 . 0 0 "[ . 1 . 2]" 1
77 1 11 LEU H 1 11 LEU QD . . 3.600 2.747 2.215 3.502 . 0 0 "[ . 1 . 2]" 1
78 1 11 LEU H 1 11 LEU MD2 . . 4.230 2.913 2.244 3.906 . 0 0 "[ . 1 . 2]" 1
79 1 11 LEU H 1 11 LEU HG . . 4.620 3.940 2.784 4.621 0.001 10 0 "[ . 1 . 2]" 1
80 1 11 LEU H 1 12 VAL H . . 4.630 4.374 4.172 4.545 . 0 0 "[ . 1 . 2]" 1
81 1 11 LEU H 1 12 VAL QG . . 4.800 4.087 3.859 4.303 . 0 0 "[ . 1 . 2]" 1
82 1 11 LEU H 1 33 TYR QD . . 4.830 4.554 4.000 4.830 0.000 7 0 "[ . 1 . 2]" 1
83 1 11 LEU HB2 1 11 LEU QD . . 3.040 2.191 1.960 2.352 . 0 0 "[ . 1 . 2]" 1
84 1 11 LEU HB2 1 12 VAL H . . 4.470 4.255 3.988 4.443 . 0 0 "[ . 1 . 2]" 1
85 1 11 LEU HB2 1 12 VAL HA . . 5.500 4.952 4.634 5.199 . 0 0 "[ . 1 . 2]" 1
86 1 11 LEU HB3 1 11 LEU QD . . 3.040 2.264 2.100 2.518 . 0 0 "[ . 1 . 2]" 1
87 1 11 LEU HB3 1 12 VAL H . . 3.660 3.281 2.920 3.570 . 0 0 "[ . 1 . 2]" 1
88 1 11 LEU QD 1 12 VAL H . . 3.740 3.247 2.728 3.707 . 0 0 "[ . 1 . 2]" 1
89 1 11 LEU QD 1 32 PRO HA . . 3.430 2.964 1.966 3.429 . 0 0 "[ . 1 . 2]" 1
90 1 11 LEU QD 1 32 PRO HB3 . . 4.790 4.109 3.117 4.643 . 0 0 "[ . 1 . 2]" 1
91 1 11 LEU QD 1 33 TYR H . . 4.230 3.523 2.814 4.089 . 0 0 "[ . 1 . 2]" 1
92 1 11 LEU QD 1 33 TYR QD . . 5.440 5.243 4.861 5.446 0.006 9 0 "[ . 1 . 2]" 1
93 1 11 LEU HG 1 12 VAL H . . 5.430 5.137 4.183 5.404 . 0 0 "[ . 1 . 2]" 1
94 1 12 VAL H 1 12 VAL HB . . 3.830 3.197 2.474 3.831 0.001 13 0 "[ . 1 . 2]" 1
95 1 12 VAL H 1 12 VAL MG1 . . 3.990 3.245 2.395 3.886 . 0 0 "[ . 1 . 2]" 1
96 1 12 VAL H 1 12 VAL QG . . 3.110 2.455 1.946 3.031 . 0 0 "[ . 1 . 2]" 1
97 1 12 VAL H 1 12 VAL MG2 . . 3.990 2.555 1.996 3.182 . 0 0 "[ . 1 . 2]" 1
98 1 12 VAL H 1 33 TYR H . . 4.570 4.015 3.560 4.557 . 0 0 "[ . 1 . 2]" 1
99 1 12 VAL H 1 78 ASP HA . . 5.500 5.402 5.249 5.500 . 0 0 "[ . 1 . 2]" 1
100 1 12 VAL HA 1 12 VAL MG1 . . 3.300 2.396 2.247 2.512 . 0 0 "[ . 1 . 2]" 1
101 1 12 VAL HA 1 12 VAL MG2 . . 3.300 2.745 2.150 3.202 . 0 0 "[ . 1 . 2]" 1
102 1 12 VAL HA 1 13 ARG H . . 2.960 2.189 2.143 2.297 . 0 0 "[ . 1 . 2]" 1
103 1 12 VAL HA 1 13 ARG QG . . 5.500 4.475 3.535 5.367 . 0 0 "[ . 1 . 2]" 1
104 1 12 VAL HA 1 78 ASP H . . 4.930 4.437 3.940 4.788 . 0 0 "[ . 1 . 2]" 1
105 1 12 VAL HA 1 78 ASP HA . . 3.990 2.915 2.458 3.406 . 0 0 "[ . 1 . 2]" 1
106 1 12 VAL HA 1 78 ASP QB . . 3.900 2.265 1.991 2.722 . 0 0 "[ . 1 . 2]" 1
107 1 12 VAL HA 1 79 GLU H . . 4.700 4.216 3.852 4.590 . 0 0 "[ . 1 . 2]" 1
108 1 12 VAL HB 1 13 ARG H . . 4.600 3.738 2.655 4.485 . 0 0 "[ . 1 . 2]" 1
109 1 12 VAL HB 1 78 ASP HA . . 4.560 3.274 2.003 4.563 0.003 15 0 "[ . 1 . 2]" 1
110 1 12 VAL QG 1 13 ARG H . . 3.440 3.181 2.517 3.443 0.003 10 0 "[ . 1 . 2]" 1
111 1 12 VAL QG 1 31 LEU HB2 . . 4.530 3.011 2.459 3.598 . 0 0 "[ . 1 . 2]" 1
112 1 12 VAL QG 1 31 LEU MD1 . . 3.830 3.531 3.145 3.743 . 0 0 "[ . 1 . 2]" 1
113 1 12 VAL QG 1 33 TYR H . . 4.600 3.678 3.238 4.076 . 0 0 "[ . 1 . 2]" 1
114 1 12 VAL QG 1 33 TYR HA . . 3.450 2.593 1.991 3.177 . 0 0 "[ . 1 . 2]" 1
115 1 12 VAL QG 1 33 TYR HB2 . . 3.820 3.214 2.773 3.688 . 0 0 "[ . 1 . 2]" 1
116 1 12 VAL QG 1 33 TYR QD . . 3.320 2.231 1.903 2.900 . 0 0 "[ . 1 . 2]" 1
117 1 12 VAL QG 1 33 TYR QE . . 4.040 3.225 2.912 3.908 . 0 0 "[ . 1 . 2]" 1
118 1 12 VAL QG 1 36 THR HB . . 3.940 3.294 2.877 3.752 . 0 0 "[ . 1 . 2]" 1
119 1 12 VAL QG 1 36 THR MG . . 2.950 1.945 1.792 2.240 . 0 0 "[ . 1 . 2]" 1
120 1 12 VAL QG 1 77 GLU HA . . 4.260 2.943 2.310 3.539 . 0 0 "[ . 1 . 2]" 1
121 1 12 VAL QG 1 78 ASP H . . 3.650 2.725 2.361 3.114 . 0 0 "[ . 1 . 2]" 1
122 1 12 VAL QG 1 78 ASP HA . . 3.440 2.519 1.910 3.147 . 0 0 "[ . 1 . 2]" 1
123 1 12 VAL QG 1 78 ASP QB . . 3.290 2.261 1.965 2.671 . 0 0 "[ . 1 . 2]" 1
124 1 12 VAL QG 1 79 GLU H . . 4.790 4.064 3.427 4.651 . 0 0 "[ . 1 . 2]" 1
125 1 12 VAL MG1 1 13 ARG H . . 4.260 3.509 2.551 4.202 . 0 0 "[ . 1 . 2]" 1
126 1 12 VAL MG1 1 33 TYR HA . . 4.570 3.739 2.813 4.578 0.008 9 0 "[ . 1 . 2]" 1
127 1 12 VAL MG1 1 78 ASP H . . 4.160 2.880 2.379 3.338 . 0 0 "[ . 1 . 2]" 1
128 1 12 VAL MG1 1 78 ASP HA . . 4.370 2.738 1.921 3.669 . 0 0 "[ . 1 . 2]" 1
129 1 12 VAL MG1 1 78 ASP QB . . 3.900 2.571 1.972 3.247 . 0 0 "[ . 1 . 2]" 1
130 1 12 VAL MG2 1 13 ARG H . . 4.260 3.912 3.512 4.254 . 0 0 "[ . 1 . 2]" 1
131 1 12 VAL MG2 1 33 TYR HA . . 4.570 2.890 1.995 3.982 . 0 0 "[ . 1 . 2]" 1
132 1 12 VAL MG2 1 78 ASP H . . 4.160 3.619 2.851 4.107 . 0 0 "[ . 1 . 2]" 1
133 1 12 VAL MG2 1 78 ASP HA . . 4.370 3.436 3.099 3.839 . 0 0 "[ . 1 . 2]" 1
134 1 12 VAL MG2 1 78 ASP QB . . 3.900 3.127 2.012 3.900 0.000 19 0 "[ . 1 . 2]" 1
135 1 13 ARG H 1 13 ARG HB2 . . 3.890 2.456 2.189 3.682 . 0 0 "[ . 1 . 2]" 1
136 1 13 ARG H 1 13 ARG QB . . 3.180 2.381 2.167 2.806 . 0 0 "[ . 1 . 2]" 1
137 1 13 ARG H 1 13 ARG HB3 . . 3.890 3.575 2.910 3.734 . 0 0 "[ . 1 . 2]" 1
138 1 13 ARG H 1 13 ARG HD2 . . 4.860 4.010 2.921 4.824 . 0 0 "[ . 1 . 2]" 1
139 1 13 ARG H 1 13 ARG QD . . 4.270 2.921 1.868 4.259 . 0 0 "[ . 1 . 2]" 1
140 1 13 ARG H 1 13 ARG HD3 . . 4.860 3.296 1.891 4.865 0.005 1 0 "[ . 1 . 2]" 1
141 1 13 ARG H 1 13 ARG HE . . 4.130 3.647 2.772 4.152 0.022 5 0 "[ . 1 . 2]" 1
142 1 13 ARG H 1 13 ARG QG . . 3.730 3.110 1.881 3.658 . 0 0 "[ . 1 . 2]" 1
143 1 13 ARG H 1 14 ILE MD . . 4.930 4.374 4.037 4.930 . 19 0 "[ . 1 . 2]" 1
144 1 13 ARG H 1 78 ASP HA . . 3.480 2.591 2.182 3.056 . 0 0 "[ . 1 . 2]" 1
145 1 13 ARG H 1 78 ASP QB . . 4.220 2.938 2.508 3.724 . 0 0 "[ . 1 . 2]" 1
146 1 13 ARG H 1 79 GLU H . . 3.880 2.708 2.394 2.930 . 0 0 "[ . 1 . 2]" 1
147 1 13 ARG H 1 79 GLU HA . . 4.800 4.698 4.503 4.800 0.000 15 0 "[ . 1 . 2]" 1
148 1 13 ARG HA 1 13 ARG QD . . 4.900 3.537 2.694 4.476 . 0 0 "[ . 1 . 2]" 1
149 1 13 ARG HA 1 13 ARG QG . . 4.010 2.398 2.195 3.343 . 0 0 "[ . 1 . 2]" 1
150 1 13 ARG HA 1 14 ILE H . . 2.880 2.192 2.142 2.310 . 0 0 "[ . 1 . 2]" 1
151 1 13 ARG HA 1 14 ILE HB . . 4.960 4.585 4.443 4.687 . 0 0 "[ . 1 . 2]" 1
152 1 13 ARG HA 1 28 PRO HB2 . . 4.720 3.847 3.295 4.577 . 0 0 "[ . 1 . 2]" 1
153 1 13 ARG HA 1 29 VAL H . . 4.640 4.393 3.917 4.640 0.000 10 0 "[ . 1 . 2]" 1
154 1 13 ARG HA 1 30 VAL MG1 . . 4.150 3.965 3.407 4.156 0.006 9 0 "[ . 1 . 2]" 1
155 1 13 ARG HA 1 30 VAL QG . . 3.640 3.384 3.173 3.585 . 0 0 "[ . 1 . 2]" 1
156 1 13 ARG HA 1 30 VAL MG2 . . 4.150 3.696 3.437 3.957 . 0 0 "[ . 1 . 2]" 1
157 1 13 ARG HA 1 31 LEU H . . 4.190 3.397 2.468 4.038 . 0 0 "[ . 1 . 2]" 1
158 1 13 ARG HA 1 79 GLU H . . 5.010 4.549 4.232 4.905 . 0 0 "[ . 1 . 2]" 1
159 1 13 ARG QB 1 13 ARG QD . . 3.300 2.355 1.987 2.666 . 0 0 "[ . 1 . 2]" 1
160 1 13 ARG QB 1 13 ARG HE . . 3.750 2.654 1.908 3.795 0.045 5 0 "[ . 1 . 2]" 1
161 1 13 ARG QB 1 14 ILE H . . 3.990 3.033 2.669 3.446 . 0 0 "[ . 1 . 2]" 1
162 1 13 ARG QB 1 28 PRO HB2 . . 4.220 2.609 2.081 3.451 . 0 0 "[ . 1 . 2]" 1
163 1 13 ARG QB 1 30 VAL QG . . 4.630 3.765 1.838 4.154 . 0 0 "[ . 1 . 2]" 1
164 1 13 ARG QB 1 79 GLU H . . 4.640 2.823 2.390 4.403 . 0 0 "[ . 1 . 2]" 1
165 1 13 ARG QB 1 79 GLU HA . . 5.140 3.509 3.089 5.035 . 0 0 "[ . 1 . 2]" 1
166 1 13 ARG HB2 1 13 ARG HD2 . . 4.230 3.173 2.070 3.764 . 0 0 "[ . 1 . 2]" 1
167 1 13 ARG HB2 1 13 ARG HD3 . . 4.230 2.859 2.346 3.664 . 0 0 "[ . 1 . 2]" 1
168 1 13 ARG HB3 1 13 ARG HD2 . . 4.230 3.699 2.557 4.220 . 0 0 "[ . 1 . 2]" 1
169 1 13 ARG HB3 1 13 ARG HD3 . . 4.230 3.517 2.604 3.874 . 0 0 "[ . 1 . 2]" 1
170 1 13 ARG QD 1 30 VAL QG . . 3.980 2.947 2.282 3.543 . 0 0 "[ . 1 . 2]" 1
171 1 13 ARG HD2 1 30 VAL MG1 . . 5.250 4.059 2.609 5.251 0.001 8 0 "[ . 1 . 2]" 1
172 1 13 ARG HD2 1 30 VAL MG2 . . 5.250 3.785 2.519 5.137 . 0 0 "[ . 1 . 2]" 1
173 1 13 ARG HD3 1 30 VAL MG1 . . 5.250 4.108 3.087 4.855 . 0 0 "[ . 1 . 2]" 1
174 1 13 ARG HD3 1 30 VAL MG2 . . 5.250 3.804 2.464 5.060 . 0 0 "[ . 1 . 2]" 1
175 1 13 ARG QG 1 14 ILE H . . 4.970 3.914 3.517 4.139 . 0 0 "[ . 1 . 2]" 1
176 1 13 ARG QG 1 28 PRO QG . . 4.170 3.081 2.198 3.783 . 0 0 "[ . 1 . 2]" 1
177 1 13 ARG QG 1 29 VAL H . . 5.170 4.933 4.480 5.171 0.001 19 0 "[ . 1 . 2]" 1
178 1 13 ARG QG 1 30 VAL QG . . 3.300 2.398 1.948 3.325 0.025 11 0 "[ . 1 . 2]" 1
179 1 13 ARG QG 1 79 GLU H . . 4.920 4.591 2.596 4.908 . 0 0 "[ . 1 . 2]" 1
180 1 14 ILE H 1 14 ILE HB . . 3.290 2.684 2.476 2.897 . 0 0 "[ . 1 . 2]" 1
181 1 14 ILE H 1 14 ILE MD . . 4.040 3.738 3.354 4.001 . 0 0 "[ . 1 . 2]" 1
182 1 14 ILE H 1 14 ILE HG12 . . 4.350 2.870 2.591 3.063 . 0 0 "[ . 1 . 2]" 1
183 1 14 ILE H 1 14 ILE QG . . 3.730 2.822 2.557 2.993 . 0 0 "[ . 1 . 2]" 1
184 1 14 ILE H 1 14 ILE HG13 . . 4.350 4.178 3.937 4.352 0.002 7 0 "[ . 1 . 2]" 1
185 1 14 ILE H 1 14 ILE MG . . 4.120 3.861 3.734 3.952 . 0 0 "[ . 1 . 2]" 1
186 1 14 ILE H 1 28 PRO HB2 . . 3.550 3.268 2.868 3.543 . 0 0 "[ . 1 . 2]" 1
187 1 14 ILE H 1 28 PRO HB3 . . 5.500 4.458 4.034 4.981 . 0 0 "[ . 1 . 2]" 1
188 1 14 ILE H 1 29 VAL H . . 3.560 2.882 2.498 3.186 . 0 0 "[ . 1 . 2]" 1
189 1 14 ILE H 1 29 VAL HB . . 5.420 4.938 4.652 5.342 . 0 0 "[ . 1 . 2]" 1
190 1 14 ILE H 1 29 VAL MG1 . . 4.550 2.390 1.883 2.748 . 0 0 "[ . 1 . 2]" 1
191 1 14 ILE H 1 30 VAL H . . 5.170 4.939 4.414 5.171 0.001 15 0 "[ . 1 . 2]" 1
192 1 14 ILE H 1 30 VAL HA . . 4.250 3.820 3.133 4.147 . 0 0 "[ . 1 . 2]" 1
193 1 14 ILE H 1 30 VAL QG . . 4.920 4.509 4.335 4.679 . 0 0 "[ . 1 . 2]" 1
194 1 14 ILE H 1 41 PHE QE . . 5.390 5.310 4.851 5.396 0.006 9 0 "[ . 1 . 2]" 1
195 1 14 ILE HA 1 14 ILE MD . . 3.710 2.026 1.953 2.151 . 0 0 "[ . 1 . 2]" 1
196 1 14 ILE HA 1 15 TYR H . . 3.100 2.157 2.139 2.216 . 0 0 "[ . 1 . 2]" 1
197 1 14 ILE HA 1 15 TYR QD . . 4.980 4.226 3.944 4.613 . 0 0 "[ . 1 . 2]" 1
198 1 14 ILE HA 1 79 GLU H . . 5.040 4.273 3.920 4.641 . 0 0 "[ . 1 . 2]" 1
199 1 14 ILE HA 1 80 ASP H . . 5.050 2.784 2.542 3.032 . 0 0 "[ . 1 . 2]" 1
200 1 14 ILE HB 1 14 ILE MD . . 3.510 3.224 3.216 3.230 . 0 0 "[ . 1 . 2]" 1
201 1 14 ILE HB 1 15 TYR H . . 4.660 4.249 4.045 4.431 . 0 0 "[ . 1 . 2]" 1
202 1 14 ILE HB 1 29 VAL H . . 4.480 3.832 3.598 4.346 . 0 0 "[ . 1 . 2]" 1
203 1 14 ILE HB 1 29 VAL MG1 . . 4.170 1.940 1.840 2.342 . 0 0 "[ . 1 . 2]" 1
204 1 14 ILE HB 1 41 PHE QD . . 4.180 2.781 2.361 3.088 . 0 0 "[ . 1 . 2]" 1
205 1 14 ILE HB 1 41 PHE QE . . 3.820 3.384 2.966 3.562 . 0 0 "[ . 1 . 2]" 1
206 1 14 ILE HB 1 76 LEU MD1 . . 4.540 3.846 3.472 4.117 . 0 0 "[ . 1 . 2]" 1
207 1 14 ILE HB 1 82 ILE MG . . 4.660 3.955 3.687 4.340 . 0 0 "[ . 1 . 2]" 1
208 1 14 ILE MD 1 14 ILE MG . . 2.800 2.015 1.892 2.199 . 0 0 "[ . 1 . 2]" 1
209 1 14 ILE MD 1 15 TYR H . . 3.810 3.647 3.232 3.802 . 0 0 "[ . 1 . 2]" 1
210 1 14 ILE MD 1 41 PHE HB2 . . 5.490 5.148 4.703 5.493 0.003 10 0 "[ . 1 . 2]" 1
211 1 14 ILE MD 1 41 PHE QD . . 4.830 4.713 4.361 4.836 0.006 11 0 "[ . 1 . 2]" 1
212 1 14 ILE MD 1 76 LEU HB3 . . 3.200 1.956 1.804 2.163 . 0 0 "[ . 1 . 2]" 1
213 1 14 ILE MD 1 76 LEU MD2 . . 3.040 2.118 1.855 2.503 . 0 0 "[ . 1 . 2]" 1
214 1 14 ILE MD 1 76 LEU HG . . 4.370 4.191 3.980 4.370 . 0 0 "[ . 1 . 2]" 1
215 1 14 ILE MD 1 77 GLU H . . 4.120 2.825 2.438 3.463 . 0 0 "[ . 1 . 2]" 1
216 1 14 ILE MD 1 78 ASP HA . . 3.840 3.235 2.798 3.622 . 0 0 "[ . 1 . 2]" 1
217 1 14 ILE MD 1 78 ASP QB . . 5.500 4.673 4.284 5.047 . 0 0 "[ . 1 . 2]" 1
218 1 14 ILE MD 1 79 GLU H . . 5.030 3.817 3.277 4.301 . 0 0 "[ . 1 . 2]" 1
219 1 14 ILE MD 1 79 GLU HA . . 5.070 4.718 4.363 4.996 . 0 0 "[ . 1 . 2]" 1
220 1 14 ILE MD 1 80 ASP H . . 3.770 2.701 2.302 3.065 . 0 0 "[ . 1 . 2]" 1
221 1 14 ILE MD 1 80 ASP HB2 . . 3.940 2.994 2.002 3.858 . 0 0 "[ . 1 . 2]" 1
222 1 14 ILE MD 1 80 ASP QB . . 3.340 2.353 1.970 2.689 . 0 0 "[ . 1 . 2]" 1
223 1 14 ILE MD 1 80 ASP HB3 . . 3.940 2.870 2.121 3.919 . 0 0 "[ . 1 . 2]" 1
224 1 14 ILE MD 1 82 ILE MD . . 4.730 4.545 4.249 4.722 . 0 0 "[ . 1 . 2]" 1
225 1 14 ILE MD 1 82 ILE MG . . 4.280 3.784 3.334 4.223 . 0 0 "[ . 1 . 2]" 1
226 1 14 ILE QG 1 31 LEU MD1 . . 3.450 2.476 1.965 2.915 . 0 0 "[ . 1 . 2]" 1
227 1 14 ILE QG 1 41 PHE HB2 . . 5.340 3.863 3.339 4.260 . 0 0 "[ . 1 . 2]" 1
228 1 14 ILE QG 1 41 PHE QD . . 4.230 3.432 2.968 3.654 . 0 0 "[ . 1 . 2]" 1
229 1 14 ILE HG12 1 14 ILE MG . . 3.580 3.191 3.173 3.199 . 0 0 "[ . 1 . 2]" 1
230 1 14 ILE HG12 1 31 LEU MD1 . . 3.930 3.159 2.733 3.628 . 0 0 "[ . 1 . 2]" 1
231 1 14 ILE HG12 1 41 PHE QD . . 4.970 4.519 4.045 4.972 0.002 2 0 "[ . 1 . 2]" 1
232 1 14 ILE HG13 1 14 ILE MG . . 3.580 2.350 2.170 2.471 . 0 0 "[ . 1 . 2]" 1
233 1 14 ILE HG13 1 31 LEU MD1 . . 3.930 2.631 2.007 3.650 . 0 0 "[ . 1 . 2]" 1
234 1 14 ILE HG13 1 41 PHE QD . . 4.970 3.562 3.045 3.760 . 0 0 "[ . 1 . 2]" 1
235 1 14 ILE MG 1 15 TYR H . . 3.330 2.718 1.939 3.164 . 0 0 "[ . 1 . 2]" 1
236 1 14 ILE MG 1 15 TYR HB2 . . 5.470 4.421 3.833 4.649 . 0 0 "[ . 1 . 2]" 1
237 1 14 ILE MG 1 15 TYR QD . . 5.240 4.783 4.355 5.079 . 0 0 "[ . 1 . 2]" 1
238 1 14 ILE MG 1 16 THR H . . 5.150 3.780 3.389 4.426 . 0 0 "[ . 1 . 2]" 1
239 1 14 ILE MG 1 29 VAL H . . 4.740 4.568 3.966 4.740 . 0 0 "[ . 1 . 2]" 1
240 1 14 ILE MG 1 29 VAL HB . . 5.480 5.252 4.840 5.493 0.013 11 0 "[ . 1 . 2]" 1
241 1 14 ILE MG 1 41 PHE HB2 . . 4.710 3.899 3.382 4.266 . 0 0 "[ . 1 . 2]" 1
242 1 14 ILE MG 1 41 PHE QD . . 3.550 2.824 2.441 3.220 . 0 0 "[ . 1 . 2]" 1
243 1 14 ILE MG 1 41 PHE QE . . 3.570 2.928 2.261 3.508 . 0 0 "[ . 1 . 2]" 1
244 1 14 ILE MG 1 41 PHE HZ . . 4.880 4.511 4.027 4.878 . 0 0 "[ . 1 . 2]" 1
245 1 14 ILE MG 1 76 LEU MD2 . . 3.690 2.324 1.974 2.705 . 0 0 "[ . 1 . 2]" 1
246 1 14 ILE MG 1 76 LEU HG . . 4.870 4.646 4.304 4.872 0.002 11 0 "[ . 1 . 2]" 1
247 1 14 ILE MG 1 80 ASP QB . . 3.980 3.535 3.176 3.977 . 0 0 "[ . 1 . 2]" 1
248 1 14 ILE MG 1 81 VAL HA . . 4.500 3.365 2.792 3.928 . 0 0 "[ . 1 . 2]" 1
249 1 14 ILE MG 1 82 ILE H . . 4.110 3.148 2.820 3.562 . 0 0 "[ . 1 . 2]" 1
250 1 14 ILE MG 1 82 ILE HB . . 3.820 3.055 2.449 3.354 . 0 0 "[ . 1 . 2]" 1
251 1 14 ILE MG 1 82 ILE MD . . 3.550 3.393 3.144 3.539 . 0 0 "[ . 1 . 2]" 1
252 1 14 ILE MG 1 82 ILE MG . . 2.860 1.875 1.737 2.157 . 0 0 "[ . 1 . 2]" 1
253 1 15 TYR H 1 15 TYR HB2 . . 3.430 2.535 2.470 2.631 . 0 0 "[ . 1 . 2]" 1
254 1 15 TYR H 1 15 TYR QD . . 3.580 2.824 2.530 3.014 . 0 0 "[ . 1 . 2]" 1
255 1 15 TYR H 1 15 TYR QE . . 4.850 4.472 4.158 4.738 . 0 0 "[ . 1 . 2]" 1
256 1 15 TYR H 1 16 THR H . . 4.850 4.240 4.144 4.517 . 0 0 "[ . 1 . 2]" 1
257 1 15 TYR H 1 28 PRO HB3 . . 5.500 4.692 4.227 5.131 . 0 0 "[ . 1 . 2]" 1
258 1 15 TYR H 1 79 GLU HA . . 4.940 4.672 4.281 4.940 . 0 0 "[ . 1 . 2]" 1
259 1 15 TYR H 1 80 ASP H . . 4.950 3.443 3.221 3.775 . 0 0 "[ . 1 . 2]" 1
260 1 15 TYR H 1 81 VAL HA . . 3.870 2.852 2.480 3.348 . 0 0 "[ . 1 . 2]" 1
261 1 15 TYR H 1 81 VAL MG2 . . 3.930 3.520 3.321 3.745 . 0 0 "[ . 1 . 2]" 1
262 1 15 TYR H 1 82 ILE H . . 5.130 4.168 3.816 4.613 . 0 0 "[ . 1 . 2]" 1
263 1 15 TYR H 1 82 ILE MG . . 4.670 4.392 4.091 4.670 . 0 0 "[ . 1 . 2]" 1
264 1 15 TYR HA 1 15 TYR QD . . 3.610 2.582 2.313 2.783 . 0 0 "[ . 1 . 2]" 1
265 1 15 TYR HA 1 16 THR H . . 2.860 2.177 2.144 2.197 . 0 0 "[ . 1 . 2]" 1
266 1 15 TYR HA 1 28 PRO HA . . 4.770 3.157 2.829 3.571 . 0 0 "[ . 1 . 2]" 1
267 1 15 TYR HA 1 29 VAL H . . 4.210 3.826 3.524 4.147 . 0 0 "[ . 1 . 2]" 1
268 1 15 TYR HB2 1 23 PRO HB2 . . 5.500 3.722 3.508 4.007 . 0 0 "[ . 1 . 2]" 1
269 1 15 TYR HB2 1 23 PRO HB3 . . 4.970 4.753 4.493 4.973 0.003 2 0 "[ . 1 . 2]" 1
270 1 15 TYR HB2 1 25 TYR HA . . 5.500 5.019 4.595 5.349 . 0 0 "[ . 1 . 2]" 1
271 1 15 TYR HB2 1 25 TYR QE . . 5.130 3.497 2.764 4.157 . 0 0 "[ . 1 . 2]" 1
272 1 15 TYR HB2 1 81 VAL HA . . 4.480 2.502 2.046 2.702 . 0 0 "[ . 1 . 2]" 1
273 1 15 TYR HB2 1 81 VAL MG1 . . 4.360 3.065 2.893 3.281 . 0 0 "[ . 1 . 2]" 1
274 1 15 TYR HB2 1 81 VAL MG2 . . 3.190 1.947 1.807 2.105 . 0 0 "[ . 1 . 2]" 1
275 1 15 TYR HB2 1 82 ILE H . . 4.780 4.181 3.801 4.426 . 0 0 "[ . 1 . 2]" 1
276 1 15 TYR HB3 1 16 THR H . . 3.870 3.805 3.337 3.888 0.018 11 0 "[ . 1 . 2]" 1
277 1 15 TYR HB3 1 23 PRO HB2 . . 4.560 2.862 2.626 3.080 . 0 0 "[ . 1 . 2]" 1
278 1 15 TYR HB3 1 23 PRO HB3 . . 4.550 4.244 4.000 4.520 . 0 0 "[ . 1 . 2]" 1
279 1 15 TYR HB3 1 25 TYR QD . . 4.560 3.332 2.222 4.143 . 0 0 "[ . 1 . 2]" 1
280 1 15 TYR HB3 1 25 TYR QE . . 5.350 3.486 2.938 4.298 . 0 0 "[ . 1 . 2]" 1
281 1 15 TYR HB3 1 81 VAL MG1 . . 5.030 3.596 3.130 3.975 . 0 0 "[ . 1 . 2]" 1
282 1 15 TYR HB3 1 81 VAL MG2 . . 3.720 2.875 2.660 3.120 . 0 0 "[ . 1 . 2]" 1
283 1 15 TYR QD 1 16 THR H . . 4.580 4.398 4.000 4.581 0.001 18 0 "[ . 1 . 2]" 1
284 1 15 TYR QD 1 23 PRO HB2 . . 5.500 4.754 4.528 4.966 . 0 0 "[ . 1 . 2]" 1
285 1 15 TYR QD 1 25 TYR HA . . 3.490 2.183 2.008 2.602 . 0 0 "[ . 1 . 2]" 1
286 1 15 TYR QD 1 25 TYR HB3 . . 4.800 4.248 3.580 4.713 . 0 0 "[ . 1 . 2]" 1
287 1 15 TYR QD 1 25 TYR QD . . 4.320 3.078 2.632 3.747 . 0 0 "[ . 1 . 2]" 1
288 1 15 TYR QD 1 25 TYR QE . . 4.740 3.527 2.774 4.464 . 0 0 "[ . 1 . 2]" 1
289 1 15 TYR QD 1 28 PRO HA . . 5.190 3.430 3.037 3.802 . 0 0 "[ . 1 . 2]" 1
290 1 15 TYR QD 1 28 PRO HB2 . . 4.820 3.860 3.683 4.147 . 0 0 "[ . 1 . 2]" 1
291 1 15 TYR QD 1 28 PRO HB3 . . 4.240 2.196 2.000 2.517 . 0 0 "[ . 1 . 2]" 1
292 1 15 TYR QD 1 28 PRO HD3 . . 4.620 3.687 3.349 4.000 . 0 0 "[ . 1 . 2]" 1
293 1 15 TYR QD 1 28 PRO QG . . 4.410 3.626 3.243 3.968 . 0 0 "[ . 1 . 2]" 1
294 1 15 TYR QD 1 79 GLU HA . . 4.020 3.497 3.176 3.664 . 0 0 "[ . 1 . 2]" 1
295 1 15 TYR QD 1 79 GLU HB3 . . 4.980 4.765 4.296 4.980 0.000 2 0 "[ . 1 . 2]" 1
296 1 15 TYR QD 1 81 VAL MG1 . . 4.610 4.470 4.275 4.614 0.004 8 0 "[ . 1 . 2]" 1
297 1 15 TYR QD 1 81 VAL MG2 . . 3.350 2.278 1.994 2.466 . 0 0 "[ . 1 . 2]" 1
298 1 15 TYR QE 1 25 TYR HA . . 3.800 2.734 2.299 3.513 . 0 0 "[ . 1 . 2]" 1
299 1 15 TYR QE 1 25 TYR QD . . 4.230 3.448 2.912 3.919 . 0 0 "[ . 1 . 2]" 1
300 1 15 TYR QE 1 27 SER H . . 5.500 5.212 4.771 5.498 . 0 0 "[ . 1 . 2]" 1
301 1 15 TYR QE 1 28 PRO HB2 . . 4.300 3.821 3.446 4.117 . 0 0 "[ . 1 . 2]" 1
302 1 15 TYR QE 1 28 PRO HB3 . . 3.850 2.576 2.139 3.046 . 0 0 "[ . 1 . 2]" 1
303 1 15 TYR QE 1 28 PRO HD2 . . 4.850 4.434 3.994 4.677 . 0 0 "[ . 1 . 2]" 1
304 1 15 TYR QE 1 28 PRO HD3 . . 3.910 3.132 2.768 3.433 . 0 0 "[ . 1 . 2]" 1
305 1 15 TYR QE 1 28 PRO QG . . 3.520 2.279 1.987 2.618 . 0 0 "[ . 1 . 2]" 1
306 1 15 TYR QE 1 79 GLU H . . 4.530 4.368 4.105 4.510 . 0 0 "[ . 1 . 2]" 1
307 1 15 TYR QE 1 79 GLU HA . . 3.420 2.226 2.033 2.403 . 0 0 "[ . 1 . 2]" 1
308 1 15 TYR QE 1 79 GLU HB2 . . 4.870 4.482 4.129 4.743 . 0 0 "[ . 1 . 2]" 1
309 1 15 TYR QE 1 79 GLU HB3 . . 3.540 3.135 2.743 3.430 . 0 0 "[ . 1 . 2]" 1
310 1 15 TYR QE 1 79 GLU QG . . 3.930 3.313 2.613 3.913 . 0 0 "[ . 1 . 2]" 1
311 1 15 TYR QE 1 81 VAL MG2 . . 4.450 4.146 3.921 4.358 . 0 0 "[ . 1 . 2]" 1
312 1 16 THR H 1 16 THR HB . . 3.380 2.556 2.337 2.851 . 0 0 "[ . 1 . 2]" 1
313 1 16 THR H 1 16 THR MG . . 3.660 2.186 1.912 2.549 . 0 0 "[ . 1 . 2]" 1
314 1 16 THR H 1 17 LYS H . . 4.670 4.605 4.515 4.638 . 0 0 "[ . 1 . 2]" 1
315 1 16 THR H 1 28 PRO HA . . 4.510 3.798 3.197 4.060 . 0 0 "[ . 1 . 2]" 1
316 1 16 THR H 1 41 PHE QE . . 5.240 3.683 3.315 4.150 . 0 0 "[ . 1 . 2]" 1
317 1 16 THR H 1 82 ILE MG . . 5.010 4.234 3.979 4.531 . 0 0 "[ . 1 . 2]" 1
318 1 16 THR HA 1 82 ILE H . . 4.070 2.977 2.762 3.165 . 0 0 "[ . 1 . 2]" 1
319 1 16 THR HB 1 17 LYS H . . 4.260 4.078 3.913 4.236 . 0 0 "[ . 1 . 2]" 1
320 1 16 THR HB 1 82 ILE MG . . 4.630 3.703 3.366 4.133 . 0 0 "[ . 1 . 2]" 1
321 1 16 THR MG 1 17 LYS H . . 4.180 3.728 3.501 4.098 . 0 0 "[ . 1 . 2]" 1
322 1 16 THR MG 1 17 LYS HA . . 4.650 3.879 3.675 4.300 . 0 0 "[ . 1 . 2]" 1
323 1 16 THR MG 1 18 PRO HD2 . . 4.970 4.369 3.636 4.894 . 0 0 "[ . 1 . 2]" 1
324 1 16 THR MG 1 18 PRO HD3 . . 4.390 3.041 2.253 3.629 . 0 0 "[ . 1 . 2]" 1
325 1 16 THR MG 1 18 PRO QG . . 4.880 4.356 3.595 4.890 0.010 18 0 "[ . 1 . 2]" 1
326 1 16 THR MG 1 23 PRO HA . . 4.490 3.874 3.457 4.216 . 0 0 "[ . 1 . 2]" 1
327 1 16 THR MG 1 24 ASP H . . 4.910 3.370 2.800 3.777 . 0 0 "[ . 1 . 2]" 1
328 1 16 THR MG 1 29 VAL MG1 . . 4.580 4.105 3.013 4.580 0.000 5 0 "[ . 1 . 2]" 1
329 1 16 THR MG 1 41 PHE HZ . . 3.470 3.204 2.525 3.482 0.012 11 0 "[ . 1 . 2]" 1
330 1 16 THR MG 1 82 ILE H . . 5.500 5.460 5.370 5.505 0.005 11 0 "[ . 1 . 2]" 1
331 1 17 LYS H 1 17 LYS HB2 . . 3.420 2.835 2.597 3.082 . 0 0 "[ . 1 . 2]" 1
332 1 17 LYS H 1 17 LYS HB3 . . 3.510 2.748 2.545 2.976 . 0 0 "[ . 1 . 2]" 1
333 1 17 LYS H 1 18 PRO HD2 . . 5.030 4.619 4.384 4.807 . 0 0 "[ . 1 . 2]" 1
334 1 17 LYS H 1 18 PRO HD3 . . 4.990 4.247 3.799 4.666 . 0 0 "[ . 1 . 2]" 1
335 1 17 LYS H 1 81 VAL HA . . 5.500 5.367 5.069 5.500 . 0 0 "[ . 1 . 2]" 1
336 1 17 LYS H 1 81 VAL MG1 . . 3.800 3.628 3.248 3.799 . 0 0 "[ . 1 . 2]" 1
337 1 17 LYS H 1 82 ILE H . . 4.040 3.728 3.434 4.012 . 0 0 "[ . 1 . 2]" 1
338 1 17 LYS H 1 82 ILE MG . . 4.150 3.423 3.183 3.698 . 0 0 "[ . 1 . 2]" 1
339 1 17 LYS H 1 83 GLN QB . . 4.670 4.166 3.869 4.636 . 0 0 "[ . 1 . 2]" 1
340 1 17 LYS HA 1 17 LYS QD . . 4.890 4.014 3.674 4.219 . 0 0 "[ . 1 . 2]" 1
341 1 17 LYS HA 1 18 PRO HD2 . . 3.430 1.950 1.913 2.041 . 0 0 "[ . 1 . 2]" 1
342 1 17 LYS HA 1 18 PRO HD3 . . 3.400 2.445 2.282 2.615 . 0 0 "[ . 1 . 2]" 1
343 1 17 LYS HA 1 18 PRO QG . . 4.300 3.783 3.766 3.806 . 0 0 "[ . 1 . 2]" 1
344 1 17 LYS HA 1 23 PRO HA . . 3.710 2.250 1.999 2.529 . 0 0 "[ . 1 . 2]" 1
345 1 17 LYS HA 1 23 PRO HG3 . . 4.830 4.267 4.005 4.649 . 0 0 "[ . 1 . 2]" 1
346 1 17 LYS HA 1 24 ASP H . . 4.470 4.072 3.751 4.420 . 0 0 "[ . 1 . 2]" 1
347 1 17 LYS HB2 1 17 LYS HD2 . . 3.980 2.555 2.298 2.906 . 0 0 "[ . 1 . 2]" 1
348 1 17 LYS HB2 1 17 LYS HD3 . . 3.980 3.277 2.548 3.803 . 0 0 "[ . 1 . 2]" 1
349 1 17 LYS HB2 1 17 LYS QE . . 4.510 3.604 2.310 4.205 . 0 0 "[ . 1 . 2]" 1
350 1 17 LYS HB2 1 23 PRO HG3 . . 4.550 3.646 3.026 4.059 . 0 0 "[ . 1 . 2]" 1
351 1 17 LYS HB2 1 59 TRP HH2 . . 5.500 5.055 4.512 5.491 . 0 0 "[ . 1 . 2]" 1
352 1 17 LYS HB2 1 81 VAL MG2 . . 4.660 4.393 4.200 4.654 . 0 0 "[ . 1 . 2]" 1
353 1 17 LYS HB2 1 82 ILE H . . 4.500 4.019 3.638 4.436 . 0 0 "[ . 1 . 2]" 1
354 1 17 LYS HB2 1 83 GLN QB . . 4.220 3.483 3.183 4.221 0.001 3 0 "[ . 1 . 2]" 1
355 1 17 LYS HB3 1 17 LYS QD . . 3.520 2.368 2.132 2.638 . 0 0 "[ . 1 . 2]" 1
356 1 17 LYS HB3 1 17 LYS QE . . 4.890 3.954 3.258 4.276 . 0 0 "[ . 1 . 2]" 1
357 1 17 LYS HB3 1 23 PRO HA . . 5.340 5.113 4.854 5.345 0.005 10 0 "[ . 1 . 2]" 1
358 1 17 LYS HB3 1 81 VAL MG1 . . 4.130 3.373 3.104 3.581 . 0 0 "[ . 1 . 2]" 1
359 1 17 LYS HB3 1 83 GLN H . . 5.160 4.331 3.949 4.864 . 0 0 "[ . 1 . 2]" 1
360 1 17 LYS HB3 1 83 GLN QB . . 4.530 2.235 1.990 2.935 . 0 0 "[ . 1 . 2]" 1
361 1 17 LYS HB3 1 83 GLN QE . . 5.340 4.413 3.107 5.295 . 0 0 "[ . 1 . 2]" 1
362 1 17 LYS HB3 1 83 GLN QG . . 4.880 3.255 1.985 4.246 . 0 0 "[ . 1 . 2]" 1
363 1 17 LYS QD 1 18 PRO HD2 . . 5.340 4.860 4.238 5.309 . 0 0 "[ . 1 . 2]" 1
364 1 17 LYS QD 1 23 PRO HD2 . . 5.340 4.937 3.403 5.346 0.006 17 0 "[ . 1 . 2]" 1
365 1 17 LYS QD 1 23 PRO HD3 . . 4.890 3.533 1.993 4.006 . 0 0 "[ . 1 . 2]" 1
366 1 17 LYS QD 1 23 PRO HG3 . . 4.490 3.453 2.105 4.336 . 0 0 "[ . 1 . 2]" 1
367 1 17 LYS QD 1 59 TRP HH2 . . 4.350 2.727 2.301 3.124 . 0 0 "[ . 1 . 2]" 1
368 1 17 LYS QD 1 59 TRP HZ3 . . 4.780 2.442 1.994 2.964 . 0 0 "[ . 1 . 2]" 1
369 1 17 LYS QD 1 83 GLN QB . . 4.570 2.527 2.128 3.170 . 0 0 "[ . 1 . 2]" 1
370 1 17 LYS QE 1 17 LYS QG . . 3.220 2.221 2.073 2.346 . 0 0 "[ . 1 . 2]" 1
371 1 17 LYS QE 1 22 LEU HA . . 4.660 3.903 2.801 4.668 0.008 12 0 "[ . 1 . 2]" 1
372 1 17 LYS QE 1 22 LEU QD . . 4.860 4.311 2.903 4.889 0.029 12 0 "[ . 1 . 2]" 1
373 1 17 LYS QE 1 23 PRO HB3 . . 4.950 3.789 2.718 4.399 . 0 0 "[ . 1 . 2]" 1
374 1 17 LYS QE 1 23 PRO HD2 . . 4.630 3.563 3.133 4.044 . 0 0 "[ . 1 . 2]" 1
375 1 17 LYS QE 1 23 PRO HD3 . . 4.190 2.346 1.992 2.700 . 0 0 "[ . 1 . 2]" 1
376 1 17 LYS QE 1 23 PRO HG2 . . 5.200 4.164 3.593 4.944 . 0 0 "[ . 1 . 2]" 1
377 1 17 LYS QE 1 23 PRO HG3 . . 4.440 2.757 1.972 3.673 . 0 0 "[ . 1 . 2]" 1
378 1 17 LYS QE 1 59 TRP HH2 . . 4.410 3.958 3.374 4.367 . 0 0 "[ . 1 . 2]" 1
379 1 17 LYS QE 1 59 TRP HZ2 . . 4.770 4.536 3.911 4.770 0.000 11 0 "[ . 1 . 2]" 1
380 1 17 LYS QE 1 81 VAL MG1 . . 4.490 3.432 2.246 4.401 . 0 0 "[ . 1 . 2]" 1
381 1 17 LYS QG 1 18 PRO HD3 . . 4.390 4.059 3.645 4.416 0.026 1 0 "[ . 1 . 2]" 1
382 1 17 LYS QG 1 23 PRO HA . . 4.010 3.369 3.004 3.667 . 0 0 "[ . 1 . 2]" 1
383 1 17 LYS QG 1 23 PRO HB2 . . 4.670 3.864 3.426 4.349 . 0 0 "[ . 1 . 2]" 1
384 1 17 LYS QG 1 23 PRO HB3 . . 4.000 2.325 1.984 2.831 . 0 0 "[ . 1 . 2]" 1
385 1 17 LYS QG 1 23 PRO HD3 . . 4.320 2.014 1.929 2.221 . 0 0 "[ . 1 . 2]" 1
386 1 17 LYS QG 1 23 PRO HG3 . . 3.970 2.765 2.033 3.388 . 0 0 "[ . 1 . 2]" 1
387 1 17 LYS HG2 1 18 PRO HD2 . . 4.650 3.285 2.598 3.774 . 0 0 "[ . 1 . 2]" 1
388 1 17 LYS HG2 1 18 PRO HD3 . . 5.060 4.620 4.055 5.006 . 0 0 "[ . 1 . 2]" 1
389 1 17 LYS HG2 1 23 PRO HA . . 4.770 4.506 4.083 4.780 0.010 15 0 "[ . 1 . 2]" 1
390 1 17 LYS HG2 1 23 PRO HD2 . . 5.500 5.037 4.324 5.458 . 0 0 "[ . 1 . 2]" 1
391 1 17 LYS HG2 1 23 PRO HG3 . . 4.840 4.453 3.698 4.867 0.027 12 0 "[ . 1 . 2]" 1
392 1 17 LYS HG3 1 18 PRO HD2 . . 4.650 3.126 2.290 3.833 . 0 0 "[ . 1 . 2]" 1
393 1 17 LYS HG3 1 18 PRO HD3 . . 5.060 4.545 3.848 5.078 0.018 14 0 "[ . 1 . 2]" 1
394 1 17 LYS HG3 1 23 PRO HA . . 4.770 3.486 3.092 3.809 . 0 0 "[ . 1 . 2]" 1
395 1 17 LYS HG3 1 23 PRO HD2 . . 5.500 3.698 3.516 3.897 . 0 0 "[ . 1 . 2]" 1
396 1 17 LYS HG3 1 23 PRO HG3 . . 4.840 2.795 2.042 3.467 . 0 0 "[ . 1 . 2]" 1
397 1 18 PRO HA 1 19 LYS H . . 3.090 2.306 2.150 2.686 . 0 0 "[ . 1 . 2]" 1
398 1 18 PRO QB 1 19 LYS H . . 3.770 2.880 1.953 3.531 . 0 0 "[ . 1 . 2]" 1
399 1 18 PRO QB 1 19 LYS QG . . 4.540 3.880 3.510 4.487 . 0 0 "[ . 1 . 2]" 1
400 1 18 PRO QB 1 21 GLN H . . 4.110 3.147 2.607 3.445 . 0 0 "[ . 1 . 2]" 1
401 1 18 PRO HB2 1 19 LYS H . . 4.320 3.026 1.972 3.802 . 0 0 "[ . 1 . 2]" 1
402 1 18 PRO HB3 1 19 LYS H . . 4.320 3.711 3.170 4.189 . 0 0 "[ . 1 . 2]" 1
403 1 18 PRO HD2 1 21 GLN H . . 5.380 5.212 4.884 5.382 0.002 15 0 "[ . 1 . 2]" 1
404 1 18 PRO HD2 1 21 GLN QB . . 4.320 4.042 3.865 4.278 . 0 0 "[ . 1 . 2]" 1
405 1 18 PRO HD2 1 22 LEU H . . 5.360 4.862 4.548 5.151 . 0 0 "[ . 1 . 2]" 1
406 1 18 PRO HD2 1 23 PRO HA . . 4.250 2.237 1.997 2.859 . 0 0 "[ . 1 . 2]" 1
407 1 18 PRO HD2 1 23 PRO HB3 . . 4.560 3.455 3.136 3.764 . 0 0 "[ . 1 . 2]" 1
408 1 18 PRO HD2 1 24 ASP H . . 4.660 3.862 3.490 4.546 . 0 0 "[ . 1 . 2]" 1
409 1 18 PRO HD3 1 21 GLN QB . . 4.720 4.506 4.080 4.763 0.043 10 0 "[ . 1 . 2]" 1
410 1 18 PRO HD3 1 23 PRO HA . . 4.160 2.654 1.998 3.256 . 0 0 "[ . 1 . 2]" 1
411 1 18 PRO HD3 1 23 PRO HB3 . . 4.700 4.227 3.762 4.602 . 0 0 "[ . 1 . 2]" 1
412 1 18 PRO HD3 1 24 ASP H . . 4.500 3.424 2.873 4.227 . 0 0 "[ . 1 . 2]" 1
413 1 18 PRO QG 1 21 GLN QB . . 3.740 2.022 1.847 2.240 . 0 0 "[ . 1 . 2]" 1
414 1 19 LYS H 1 19 LYS QB . . 3.110 2.532 2.313 2.995 . 0 0 "[ . 1 . 2]" 1
415 1 19 LYS H 1 19 LYS HG2 . . 4.880 2.542 1.891 3.979 . 0 0 "[ . 1 . 2]" 1
416 1 19 LYS H 1 19 LYS QG . . 4.250 2.198 1.878 2.726 . 0 0 "[ . 1 . 2]" 1
417 1 19 LYS H 1 19 LYS HG3 . . 4.880 3.166 1.920 3.778 . 0 0 "[ . 1 . 2]" 1
418 1 19 LYS HA 1 19 LYS QG . . 3.570 3.243 2.439 3.451 . 0 0 "[ . 1 . 2]" 1
419 1 19 LYS HA 1 83 GLN HE21 . . 4.570 3.315 2.179 4.437 . 0 0 "[ . 1 . 2]" 1
420 1 19 LYS HA 1 83 GLN QE . . 3.990 2.771 1.970 3.969 . 0 0 "[ . 1 . 2]" 1
421 1 19 LYS HA 1 83 GLN HE22 . . 4.570 3.249 2.012 4.551 . 0 0 "[ . 1 . 2]" 1
422 1 19 LYS QB 1 19 LYS QE . . 4.450 3.016 2.004 3.707 . 0 0 "[ . 1 . 2]" 1
423 1 19 LYS QB 1 83 GLN QE . . 3.990 3.319 2.575 3.964 . 0 0 "[ . 1 . 2]" 1
424 1 19 LYS QD 1 19 LYS QG . . 2.370 2.056 2.022 2.092 . 0 0 "[ . 1 . 2]" 1
425 1 19 LYS QE 1 19 LYS QG . . 3.120 2.197 2.029 2.494 . 0 0 "[ . 1 . 2]" 1
426 1 21 GLN H 1 21 GLN QB . . 3.210 2.302 2.190 2.494 . 0 0 "[ . 1 . 2]" 1
427 1 21 GLN H 1 21 GLN QG . . 4.800 3.097 2.205 4.156 . 0 0 "[ . 1 . 2]" 1
428 1 21 GLN H 1 22 LEU H . . 4.780 4.548 4.447 4.614 . 0 0 "[ . 1 . 2]" 1
429 1 21 GLN HA 1 21 GLN QG . . 3.910 2.471 2.167 3.014 . 0 0 "[ . 1 . 2]" 1
430 1 21 GLN HA 1 22 LEU H . . 3.110 2.517 2.398 2.646 . 0 0 "[ . 1 . 2]" 1
431 1 21 GLN QB 1 22 LEU H . . 3.040 2.341 1.943 2.981 . 0 0 "[ . 1 . 2]" 1
432 1 21 GLN HB2 1 22 LEU H . . 3.720 3.618 3.215 3.799 0.079 7 0 "[ . 1 . 2]" 1
433 1 21 GLN HB3 1 22 LEU H . . 3.720 2.383 1.953 3.129 . 0 0 "[ . 1 . 2]" 1
434 1 21 GLN QG 1 22 LEU H . . 4.000 3.331 1.785 4.003 0.003 15 0 "[ . 1 . 2]" 1
435 1 22 LEU H 1 22 LEU HB2 . . 3.910 3.021 2.219 3.625 . 0 0 "[ . 1 . 2]" 1
436 1 22 LEU H 1 22 LEU QB . . 3.180 2.317 2.197 2.390 . 0 0 "[ . 1 . 2]" 1
437 1 22 LEU H 1 22 LEU HB3 . . 3.910 2.913 2.305 3.606 . 0 0 "[ . 1 . 2]" 1
438 1 22 LEU H 1 22 LEU MD1 . . 4.180 3.841 3.510 4.009 . 0 0 "[ . 1 . 2]" 1
439 1 22 LEU H 1 22 LEU QD . . 3.600 3.304 3.252 3.443 . 0 0 "[ . 1 . 2]" 1
440 1 22 LEU H 1 22 LEU MD2 . . 4.180 3.666 3.439 4.119 . 0 0 "[ . 1 . 2]" 1
441 1 22 LEU H 1 22 LEU HG . . 3.190 2.792 2.644 3.110 . 0 0 "[ . 1 . 2]" 1
442 1 22 LEU H 1 23 PRO HD2 . . 5.500 4.797 4.768 4.817 . 0 0 "[ . 1 . 2]" 1
443 1 22 LEU H 1 23 PRO HD3 . . 5.200 5.048 5.011 5.080 . 0 0 "[ . 1 . 2]" 1
444 1 22 LEU HA 1 22 LEU MD1 . . 4.330 3.514 3.222 3.899 . 0 0 "[ . 1 . 2]" 1
445 1 22 LEU HA 1 22 LEU QD . . 3.100 2.673 1.966 3.128 0.028 11 0 "[ . 1 . 2]" 1
446 1 22 LEU HA 1 22 LEU MD2 . . 4.330 3.224 1.972 4.117 . 0 0 "[ . 1 . 2]" 1
447 1 22 LEU HA 1 22 LEU HG . . 3.940 3.326 2.664 3.720 . 0 0 "[ . 1 . 2]" 1
448 1 22 LEU HA 1 23 PRO HD2 . . 3.400 2.382 2.310 2.456 . 0 0 "[ . 1 . 2]" 1
449 1 22 LEU HA 1 23 PRO HD3 . . 3.190 2.294 2.271 2.323 . 0 0 "[ . 1 . 2]" 1
450 1 22 LEU HA 1 23 PRO HG2 . . 4.660 4.498 4.439 4.559 . 0 0 "[ . 1 . 2]" 1
451 1 22 LEU HA 1 23 PRO HG3 . . 4.660 4.462 4.421 4.507 . 0 0 "[ . 1 . 2]" 1
452 1 22 LEU QB 1 23 PRO HD2 . . 3.260 2.080 1.988 2.220 . 0 0 "[ . 1 . 2]" 1
453 1 22 LEU QB 1 23 PRO HD3 . . 3.970 3.389 3.268 3.540 . 0 0 "[ . 1 . 2]" 1
454 1 22 LEU HB2 1 23 PRO HD2 . . 3.930 2.805 1.997 3.789 . 0 0 "[ . 1 . 2]" 1
455 1 22 LEU HB2 1 23 PRO HD3 . . 4.780 4.019 3.347 4.800 0.020 2 0 "[ . 1 . 2]" 1
456 1 22 LEU HB3 1 23 PRO HD2 . . 3.930 2.968 1.999 3.707 . 0 0 "[ . 1 . 2]" 1
457 1 22 LEU HB3 1 23 PRO HD3 . . 4.780 4.128 3.444 4.634 . 0 0 "[ . 1 . 2]" 1
458 1 22 LEU QD 1 23 PRO HD2 . . 3.430 2.111 1.887 2.343 . 0 0 "[ . 1 . 2]" 1
459 1 22 LEU QD 1 23 PRO HD3 . . 3.560 3.145 2.576 3.451 . 0 0 "[ . 1 . 2]" 1
460 1 22 LEU QD 1 23 PRO HG3 . . 4.900 3.958 3.716 4.296 . 0 0 "[ . 1 . 2]" 1
461 1 22 LEU MD1 1 23 PRO HD2 . . 4.350 2.902 1.975 4.191 . 0 0 "[ . 1 . 2]" 1
462 1 22 LEU MD1 1 25 TYR QE . . 4.680 3.570 2.351 4.640 . 0 0 "[ . 1 . 2]" 1
463 1 22 LEU MD2 1 23 PRO HD2 . . 4.350 3.229 1.891 4.200 . 0 0 "[ . 1 . 2]" 1
464 1 22 LEU MD2 1 25 TYR QE . . 4.680 4.327 3.568 4.683 0.003 9 0 "[ . 1 . 2]" 1
465 1 22 LEU HG 1 23 PRO HD2 . . 4.720 4.174 3.836 4.361 . 0 0 "[ . 1 . 2]" 1
466 1 23 PRO HA 1 24 ASP H . . 2.910 2.160 2.150 2.232 . 0 0 "[ . 1 . 2]" 1
467 1 23 PRO HA 1 81 VAL MG2 . . 5.500 5.355 4.996 5.502 0.002 2 0 "[ . 1 . 2]" 1
468 1 23 PRO HB2 1 24 ASP H . . 4.290 3.652 3.105 3.816 . 0 0 "[ . 1 . 2]" 1
469 1 23 PRO HB2 1 25 TYR QD . . 4.530 4.274 3.540 4.529 . 0 0 "[ . 1 . 2]" 1
470 1 23 PRO HB2 1 25 TYR QE . . 4.210 3.372 2.098 3.981 . 0 0 "[ . 1 . 2]" 1
471 1 23 PRO HB2 1 81 VAL MG2 . . 3.820 3.040 2.596 3.266 . 0 0 "[ . 1 . 2]" 1
472 1 23 PRO HB3 1 24 ASP H . . 4.200 4.085 3.727 4.199 . 0 0 "[ . 1 . 2]" 1
473 1 23 PRO HB3 1 25 TYR QE . . 4.940 4.580 3.716 4.919 . 0 0 "[ . 1 . 2]" 1
474 1 23 PRO HB3 1 81 VAL MG1 . . 3.890 2.503 2.114 2.900 . 0 0 "[ . 1 . 2]" 1
475 1 23 PRO HB3 1 81 VAL MG2 . . 4.190 3.761 3.426 3.942 . 0 0 "[ . 1 . 2]" 1
476 1 23 PRO HD2 1 25 TYR QE . . 4.290 3.607 2.974 4.296 0.006 8 0 "[ . 1 . 2]" 1
477 1 23 PRO HD3 1 25 TYR QE . . 5.320 4.804 4.415 5.292 . 0 0 "[ . 1 . 2]" 1
478 1 23 PRO HG2 1 25 TYR QE . . 4.330 2.307 2.000 2.799 . 0 0 "[ . 1 . 2]" 1
479 1 23 PRO HG2 1 81 VAL MG1 . . 4.080 3.683 2.970 3.992 . 0 0 "[ . 1 . 2]" 1
480 1 23 PRO HG2 1 81 VAL MG2 . . 4.140 3.722 3.107 4.106 . 0 0 "[ . 1 . 2]" 1
481 1 23 PRO HG3 1 25 TYR QE . . 4.770 3.662 3.367 3.864 . 0 0 "[ . 1 . 2]" 1
482 1 23 PRO HG3 1 81 VAL MG1 . . 3.640 2.654 1.978 2.950 . 0 0 "[ . 1 . 2]" 1
483 1 23 PRO HG3 1 81 VAL MG2 . . 4.180 3.480 2.977 3.862 . 0 0 "[ . 1 . 2]" 1
484 1 24 ASP H 1 24 ASP HB2 . . 3.720 2.890 2.213 3.592 . 0 0 "[ . 1 . 2]" 1
485 1 24 ASP H 1 24 ASP QB . . 3.250 2.589 2.191 2.791 . 0 0 "[ . 1 . 2]" 1
486 1 24 ASP H 1 24 ASP HB3 . . 3.720 3.275 2.542 3.644 . 0 0 "[ . 1 . 2]" 1
487 1 24 ASP QB 1 26 THR H . . 4.680 2.999 2.557 3.586 . 0 0 "[ . 1 . 2]" 1
488 1 24 ASP QB 1 26 THR MG . . 5.340 3.639 2.698 4.960 . 0 0 "[ . 1 . 2]" 1
489 1 24 ASP QB 1 27 SER H . . 4.230 2.787 2.308 3.534 . 0 0 "[ . 1 . 2]" 1
490 1 24 ASP QB 1 27 SER QB . . 4.910 3.092 2.238 4.804 . 0 0 "[ . 1 . 2]" 1
491 1 24 ASP HB2 1 25 TYR H . . 4.210 3.805 2.794 4.203 . 0 0 "[ . 1 . 2]" 1
492 1 24 ASP HB2 1 27 SER H . . 4.990 3.432 2.322 4.773 . 0 0 "[ . 1 . 2]" 1
493 1 24 ASP HB3 1 25 TYR H . . 4.210 3.505 2.725 4.195 . 0 0 "[ . 1 . 2]" 1
494 1 24 ASP HB3 1 27 SER H . . 4.990 3.337 2.604 4.684 . 0 0 "[ . 1 . 2]" 1
495 1 25 TYR H 1 25 TYR HB2 . . 3.150 2.586 2.353 2.886 . 0 0 "[ . 1 . 2]" 1
496 1 25 TYR H 1 25 TYR HB3 . . 4.010 3.732 3.603 3.852 . 0 0 "[ . 1 . 2]" 1
497 1 25 TYR H 1 25 TYR QD . . 3.620 3.193 2.638 3.533 . 0 0 "[ . 1 . 2]" 1
498 1 25 TYR H 1 25 TYR QE . . 5.140 4.958 4.599 5.124 . 0 0 "[ . 1 . 2]" 1
499 1 25 TYR H 1 26 THR H . . 3.240 2.165 1.798 2.431 . 0 0 "[ . 1 . 2]" 1
500 1 25 TYR H 1 26 THR MG . . 4.270 3.178 2.624 3.464 . 0 0 "[ . 1 . 2]" 1
501 1 25 TYR H 1 27 SER H . . 4.560 3.858 3.189 4.560 . 0 0 "[ . 1 . 2]" 1
502 1 25 TYR HA 1 25 TYR QD . . 3.430 2.562 2.100 3.002 . 0 0 "[ . 1 . 2]" 1
503 1 25 TYR HA 1 25 TYR QE . . 4.610 4.524 4.267 4.648 0.038 11 0 "[ . 1 . 2]" 1
504 1 25 TYR HA 1 27 SER H . . 4.410 4.238 3.824 4.423 0.013 11 0 "[ . 1 . 2]" 1
505 1 25 TYR HA 1 81 VAL MG2 . . 5.500 5.369 5.169 5.502 0.002 9 0 "[ . 1 . 2]" 1
506 1 25 TYR HB2 1 26 THR H . . 4.070 3.647 2.845 4.034 . 0 0 "[ . 1 . 2]" 1
507 1 25 TYR HB2 1 26 THR MG . . 4.640 4.113 3.113 4.638 . 0 0 "[ . 1 . 2]" 1
508 1 25 TYR HB3 1 26 THR H . . 5.110 4.287 4.003 4.544 . 0 0 "[ . 1 . 2]" 1
509 1 25 TYR HB3 1 26 THR MG . . 5.500 5.004 3.849 5.501 0.001 10 0 "[ . 1 . 2]" 1
510 1 25 TYR QD 1 26 THR H . . 4.820 4.715 4.127 4.834 0.014 6 0 "[ . 1 . 2]" 1
511 1 25 TYR QD 1 81 VAL MG2 . . 4.650 3.861 3.578 4.173 . 0 0 "[ . 1 . 2]" 1
512 1 25 TYR QE 1 81 VAL MG1 . . 4.630 3.935 2.970 4.389 . 0 0 "[ . 1 . 2]" 1
513 1 25 TYR QE 1 81 VAL MG2 . . 3.640 2.393 1.880 2.929 . 0 0 "[ . 1 . 2]" 1
514 1 26 THR H 1 26 THR MG . . 3.170 2.278 1.883 2.812 . 0 0 "[ . 1 . 2]" 1
515 1 26 THR H 1 27 SER H . . 3.000 2.026 1.805 2.389 . 0 0 "[ . 1 . 2]" 1
516 1 26 THR H 1 27 SER QB . . 4.770 4.089 3.816 4.711 . 0 0 "[ . 1 . 2]" 1
517 1 26 THR HA 1 26 THR MG . . 3.470 2.854 2.166 3.207 . 0 0 "[ . 1 . 2]" 1
518 1 26 THR MG 1 27 SER H . . 4.160 2.999 2.154 4.064 . 0 0 "[ . 1 . 2]" 1
519 1 27 SER H 1 27 SER HB2 . . 3.750 2.807 2.464 3.228 . 0 0 "[ . 1 . 2]" 1
520 1 27 SER H 1 27 SER QB . . 3.170 2.504 2.424 2.620 . 0 0 "[ . 1 . 2]" 1
521 1 27 SER H 1 27 SER HB3 . . 3.750 3.076 2.505 3.753 0.003 11 0 "[ . 1 . 2]" 1
522 1 27 SER H 1 28 PRO HD2 . . 4.830 3.561 3.228 3.989 . 0 0 "[ . 1 . 2]" 1
523 1 27 SER H 1 28 PRO HD3 . . 4.000 2.694 2.291 3.220 . 0 0 "[ . 1 . 2]" 1
524 1 27 SER HA 1 28 PRO HD2 . . 3.310 2.307 2.069 2.445 . 0 0 "[ . 1 . 2]" 1
525 1 27 SER HA 1 28 PRO HD3 . . 3.830 3.189 2.902 3.335 . 0 0 "[ . 1 . 2]" 1
526 1 28 PRO HA 1 29 VAL H . . 3.050 2.433 2.251 2.682 . 0 0 "[ . 1 . 2]" 1
527 1 28 PRO HB2 1 29 VAL H . . 3.620 2.548 1.983 3.044 . 0 0 "[ . 1 . 2]" 1
528 1 28 PRO HB2 1 30 VAL QG . . 4.460 4.110 3.835 4.480 0.020 9 0 "[ . 1 . 2]" 1
529 1 28 PRO HB3 1 29 VAL H . . 3.740 3.428 3.175 3.690 . 0 0 "[ . 1 . 2]" 1
530 1 28 PRO HD2 1 30 VAL QG . . 5.270 4.945 4.221 5.286 0.016 9 0 "[ . 1 . 2]" 1
531 1 28 PRO QG 1 30 VAL QG . . 3.990 3.538 3.005 3.914 . 0 0 "[ . 1 . 2]" 1
532 1 29 VAL H 1 29 VAL HB . . 3.170 2.957 2.735 3.110 . 0 0 "[ . 1 . 2]" 1
533 1 29 VAL H 1 29 VAL MG1 . . 3.300 1.975 1.870 2.163 . 0 0 "[ . 1 . 2]" 1
534 1 29 VAL H 1 29 VAL MG2 . . 3.940 3.815 3.754 3.931 . 0 0 "[ . 1 . 2]" 1
535 1 29 VAL H 1 30 VAL H . . 4.390 4.305 4.153 4.408 0.018 16 0 "[ . 1 . 2]" 1
536 1 29 VAL H 1 30 VAL QG . . 4.910 4.599 4.301 4.930 0.020 10 0 "[ . 1 . 2]" 1
537 1 29 VAL H 1 41 PHE QE . . 4.480 4.362 4.212 4.481 0.001 4 0 "[ . 1 . 2]" 1
538 1 29 VAL HA 1 29 VAL MG1 . . 3.300 3.190 3.178 3.200 . 0 0 "[ . 1 . 2]" 1
539 1 29 VAL HA 1 29 VAL MG2 . . 3.160 2.367 2.208 2.448 . 0 0 "[ . 1 . 2]" 1
540 1 29 VAL HA 1 30 VAL H . . 2.640 2.153 2.140 2.182 . 0 0 "[ . 1 . 2]" 1
541 1 29 VAL HA 1 30 VAL HB . . 5.240 4.821 4.646 5.023 . 0 0 "[ . 1 . 2]" 1
542 1 29 VAL HA 1 30 VAL QG . . 3.720 3.468 3.318 3.637 . 0 0 "[ . 1 . 2]" 1
543 1 29 VAL HA 1 31 LEU H . . 5.500 5.436 5.289 5.510 0.010 11 0 "[ . 1 . 2]" 1
544 1 29 VAL HA 1 44 LYS QE . . 4.830 4.273 3.725 4.829 . 0 0 "[ . 1 . 2]" 1
545 1 29 VAL HB 1 30 VAL H . . 4.330 4.325 4.218 4.451 0.121 9 0 "[ . 1 . 2]" 1
546 1 29 VAL HB 1 41 PHE QD . . 4.640 4.364 3.992 4.627 . 0 0 "[ . 1 . 2]" 1
547 1 29 VAL HB 1 41 PHE QE . . 3.810 3.558 2.899 3.818 0.008 9 0 "[ . 1 . 2]" 1
548 1 29 VAL HB 1 41 PHE HZ . . 5.350 5.123 4.511 5.353 0.003 9 0 "[ . 1 . 2]" 1
549 1 29 VAL MG1 1 30 VAL H . . 4.200 4.092 3.806 4.242 0.042 19 0 "[ . 1 . 2]" 1
550 1 29 VAL MG1 1 41 PHE QD . . 3.730 2.044 1.951 2.298 . 0 0 "[ . 1 . 2]" 1
551 1 29 VAL MG1 1 41 PHE QE . . 3.370 1.941 1.779 2.022 . 0 0 "[ . 1 . 2]" 1
552 1 29 VAL MG1 1 41 PHE HZ . . 4.210 3.935 3.520 4.206 . 0 0 "[ . 1 . 2]" 1
553 1 29 VAL MG1 1 44 LYS QG . . 4.820 4.029 3.833 4.258 . 0 0 "[ . 1 . 2]" 1
554 1 29 VAL MG2 1 30 VAL H . . 3.240 2.787 2.293 3.101 . 0 0 "[ . 1 . 2]" 1
555 1 29 VAL MG2 1 30 VAL HA . . 4.790 4.014 3.870 4.178 . 0 0 "[ . 1 . 2]" 1
556 1 29 VAL MG2 1 31 LEU MD1 . . 4.150 2.980 2.541 3.465 . 0 0 "[ . 1 . 2]" 1
557 1 29 VAL MG2 1 41 PHE HA . . 4.040 3.793 3.480 4.019 . 0 0 "[ . 1 . 2]" 1
558 1 29 VAL MG2 1 41 PHE QD . . 3.750 3.342 2.878 3.697 . 0 0 "[ . 1 . 2]" 1
559 1 29 VAL MG2 1 41 PHE QE . . 4.210 3.888 3.422 4.199 . 0 0 "[ . 1 . 2]" 1
560 1 29 VAL MG2 1 44 LYS H . . 5.190 4.950 4.725 5.088 . 0 0 "[ . 1 . 2]" 1
561 1 29 VAL MG2 1 44 LYS HA . . 4.980 4.822 4.655 4.978 . 0 0 "[ . 1 . 2]" 1
562 1 29 VAL MG2 1 44 LYS HB2 . . 3.730 3.186 2.883 3.334 . 0 0 "[ . 1 . 2]" 1
563 1 29 VAL MG2 1 44 LYS HB3 . . 3.920 2.892 2.691 3.155 . 0 0 "[ . 1 . 2]" 1
564 1 29 VAL MG2 1 44 LYS HD2 . . 4.220 3.334 2.616 4.158 . 0 0 "[ . 1 . 2]" 1
565 1 29 VAL MG2 1 44 LYS QD . . 3.690 3.090 2.576 3.658 . 0 0 "[ . 1 . 2]" 1
566 1 29 VAL MG2 1 44 LYS HD3 . . 4.220 3.960 3.635 4.220 0.000 3 0 "[ . 1 . 2]" 1
567 1 29 VAL MG2 1 44 LYS QE . . 3.900 2.162 1.713 2.880 . 0 0 "[ . 1 . 2]" 1
568 1 29 VAL MG2 1 44 LYS HG2 . . 3.840 3.720 3.502 3.837 . 0 0 "[ . 1 . 2]" 1
569 1 29 VAL MG2 1 44 LYS QG . . 3.320 2.244 2.029 2.402 . 0 0 "[ . 1 . 2]" 1
570 1 29 VAL MG2 1 44 LYS HG3 . . 3.840 2.263 2.042 2.427 . 0 0 "[ . 1 . 2]" 1
571 1 30 VAL H 1 30 VAL HB . . 3.040 2.729 2.519 3.092 0.052 9 0 "[ . 1 . 2]" 1
572 1 30 VAL H 1 30 VAL MG1 . . 4.030 3.416 1.845 3.833 . 0 0 "[ . 1 . 2]" 1
573 1 30 VAL H 1 30 VAL QG . . 2.960 2.074 1.840 2.354 . 0 0 "[ . 1 . 2]" 1
574 1 30 VAL H 1 30 VAL MG2 . . 4.030 2.448 1.962 3.693 . 0 0 "[ . 1 . 2]" 1
575 1 30 VAL H 1 31 LEU H . . 4.460 4.245 4.142 4.308 . 0 0 "[ . 1 . 2]" 1
576 1 30 VAL H 1 31 LEU HG . . 4.860 4.717 4.462 4.837 . 0 0 "[ . 1 . 2]" 1
577 1 30 VAL H 1 44 LYS QE . . 4.490 4.181 3.657 4.486 . 0 0 "[ . 1 . 2]" 1
578 1 30 VAL HA 1 30 VAL MG1 . . 3.350 2.443 2.093 3.169 . 0 0 "[ . 1 . 2]" 1
579 1 30 VAL HA 1 30 VAL MG2 . . 3.350 2.500 2.405 2.565 . 0 0 "[ . 1 . 2]" 1
580 1 30 VAL HA 1 31 LEU H . . 2.780 2.179 2.158 2.215 . 0 0 "[ . 1 . 2]" 1
581 1 30 VAL HB 1 31 LEU H . . 4.440 4.332 4.200 4.392 . 0 0 "[ . 1 . 2]" 1
582 1 30 VAL QG 1 31 LEU H . . 3.140 3.063 2.917 3.130 . 0 0 "[ . 1 . 2]" 1
583 1 30 VAL MG1 1 31 LEU H . . 4.350 3.379 3.059 4.316 . 0 0 "[ . 1 . 2]" 1
584 1 30 VAL MG2 1 31 LEU H . . 4.350 4.052 2.968 4.361 0.011 5 0 "[ . 1 . 2]" 1
585 1 31 LEU H 1 31 LEU HB3 . . 3.880 3.654 3.607 3.710 . 0 0 "[ . 1 . 2]" 1
586 1 31 LEU H 1 31 LEU MD1 . . 4.200 3.696 3.278 4.004 . 0 0 "[ . 1 . 2]" 1
587 1 31 LEU H 1 31 LEU MD2 . . 4.220 3.769 3.343 4.110 . 0 0 "[ . 1 . 2]" 1
588 1 31 LEU H 1 31 LEU HG . . 3.480 2.695 2.046 3.106 . 0 0 "[ . 1 . 2]" 1
589 1 31 LEU H 1 32 PRO QD . . 4.470 4.368 4.348 4.378 . 0 0 "[ . 1 . 2]" 1
590 1 31 LEU HA 1 31 LEU MD2 . . 3.420 2.276 2.073 2.645 . 0 0 "[ . 1 . 2]" 1
591 1 31 LEU HA 1 32 PRO QD . . 3.370 2.045 1.998 2.083 . 0 0 "[ . 1 . 2]" 1
592 1 31 LEU HB2 1 31 LEU MD1 . . 3.270 2.230 2.097 2.387 . 0 0 "[ . 1 . 2]" 1
593 1 31 LEU HB2 1 32 PRO QD . . 3.840 3.567 3.237 3.753 . 0 0 "[ . 1 . 2]" 1
594 1 31 LEU HB2 1 36 THR MG . . 3.470 2.726 1.976 3.442 . 0 0 "[ . 1 . 2]" 1
595 1 31 LEU HB3 1 31 LEU MD1 . . 3.340 2.466 2.312 2.669 . 0 0 "[ . 1 . 2]" 1
596 1 31 LEU HB3 1 31 LEU MD2 . . 3.450 2.218 2.011 2.325 . 0 0 "[ . 1 . 2]" 1
597 1 31 LEU HB3 1 32 PRO QD . . 3.920 2.167 1.981 2.369 . 0 0 "[ . 1 . 2]" 1
598 1 31 LEU HB3 1 32 PRO HG3 . . 5.020 4.830 4.674 4.998 . 0 0 "[ . 1 . 2]" 1
599 1 31 LEU HB3 1 36 THR MG . . 3.770 3.004 2.538 3.349 . 0 0 "[ . 1 . 2]" 1
600 1 31 LEU MD1 1 40 ASP H . . 5.500 4.897 4.328 5.270 . 0 0 "[ . 1 . 2]" 1
601 1 31 LEU MD1 1 40 ASP HB2 . . 4.370 3.951 3.453 4.371 0.001 1 0 "[ . 1 . 2]" 1
602 1 31 LEU MD1 1 40 ASP QB . . 3.820 2.967 2.450 3.336 . 0 0 "[ . 1 . 2]" 1
603 1 31 LEU MD1 1 40 ASP HB3 . . 4.370 3.135 2.478 3.665 . 0 0 "[ . 1 . 2]" 1
604 1 31 LEU MD1 1 41 PHE H . . 3.720 3.435 3.032 3.719 . 0 0 "[ . 1 . 2]" 1
605 1 31 LEU MD1 1 41 PHE HA . . 3.340 2.448 2.204 2.631 . 0 0 "[ . 1 . 2]" 1
606 1 31 LEU MD1 1 41 PHE HB2 . . 3.710 2.178 1.957 2.311 . 0 0 "[ . 1 . 2]" 1
607 1 31 LEU MD1 1 41 PHE HB3 . . 4.000 3.600 3.383 3.728 . 0 0 "[ . 1 . 2]" 1
608 1 31 LEU MD1 1 41 PHE QD . . 3.790 2.666 2.337 3.308 . 0 0 "[ . 1 . 2]" 1
609 1 31 LEU MD1 1 42 CYS H . . 5.330 5.010 4.692 5.216 . 0 0 "[ . 1 . 2]" 1
610 1 31 LEU MD2 1 32 PRO QD . . 3.370 2.423 2.025 3.061 . 0 0 "[ . 1 . 2]" 1
611 1 31 LEU MD2 1 40 ASP QB . . 4.800 3.561 2.955 4.205 . 0 0 "[ . 1 . 2]" 1
612 1 31 LEU MD2 1 41 PHE H . . 4.540 4.433 4.084 4.540 . 0 0 "[ . 1 . 2]" 1
613 1 31 LEU MD2 1 41 PHE HA . . 3.250 2.631 2.405 2.863 . 0 0 "[ . 1 . 2]" 1
614 1 31 LEU MD2 1 41 PHE HB2 . . 4.250 3.814 3.418 4.014 . 0 0 "[ . 1 . 2]" 1
615 1 31 LEU MD2 1 41 PHE QD . . 4.340 4.090 3.584 4.344 0.004 11 0 "[ . 1 . 2]" 1
616 1 31 LEU MD2 1 44 LYS H . . 4.500 4.174 3.965 4.393 . 0 0 "[ . 1 . 2]" 1
617 1 31 LEU MD2 1 44 LYS HA . . 4.960 4.763 4.522 4.903 . 0 0 "[ . 1 . 2]" 1
618 1 31 LEU MD2 1 44 LYS HB2 . . 3.870 3.522 3.331 3.799 . 0 0 "[ . 1 . 2]" 1
619 1 31 LEU MD2 1 44 LYS HB3 . . 4.270 4.081 3.858 4.264 . 0 0 "[ . 1 . 2]" 1
620 1 31 LEU MD2 1 44 LYS HD2 . . 4.130 3.943 3.663 4.130 . 0 0 "[ . 1 . 2]" 1
621 1 31 LEU MD2 1 44 LYS HD3 . . 4.130 3.561 2.656 4.080 . 0 0 "[ . 1 . 2]" 1
622 1 31 LEU MD2 1 44 LYS QE . . 3.560 2.272 1.888 2.771 . 0 0 "[ . 1 . 2]" 1
623 1 31 LEU MD2 1 44 LYS HG2 . . 3.570 2.686 2.386 2.920 . 0 0 "[ . 1 . 2]" 1
624 1 31 LEU MD2 1 44 LYS HG3 . . 3.570 1.961 1.816 2.117 . 0 0 "[ . 1 . 2]" 1
625 1 31 LEU HG 1 32 PRO QD . . 4.570 4.220 3.899 4.427 . 0 0 "[ . 1 . 2]" 1
626 1 31 LEU HG 1 41 PHE HA . . 4.990 4.479 3.925 4.799 . 0 0 "[ . 1 . 2]" 1
627 1 32 PRO HA 1 33 TYR H . . 2.970 2.161 2.150 2.257 . 0 0 "[ . 1 . 2]" 1
628 1 32 PRO HA 1 34 SER H . . 4.980 4.436 4.303 4.861 . 0 0 "[ . 1 . 2]" 1
629 1 32 PRO HB2 1 33 TYR H . . 3.960 3.554 3.019 3.722 . 0 0 "[ . 1 . 2]" 1
630 1 32 PRO HB2 1 34 SER H . . 4.440 3.603 3.450 3.822 . 0 0 "[ . 1 . 2]" 1
631 1 32 PRO HB2 1 35 ARG H . . 4.480 2.852 2.619 3.016 . 0 0 "[ . 1 . 2]" 1
632 1 32 PRO HB3 1 33 TYR H . . 4.310 4.017 3.677 4.131 . 0 0 "[ . 1 . 2]" 1
633 1 32 PRO HB3 1 34 SER H . . 5.260 4.999 4.874 5.222 . 0 0 "[ . 1 . 2]" 1
634 1 32 PRO HB3 1 35 ARG H . . 4.880 4.544 4.357 4.662 . 0 0 "[ . 1 . 2]" 1
635 1 32 PRO QD 1 35 ARG HB2 . . 4.240 3.795 3.404 4.050 . 0 0 "[ . 1 . 2]" 1
636 1 32 PRO QD 1 35 ARG HB3 . . 4.980 4.746 4.515 4.963 . 0 0 "[ . 1 . 2]" 1
637 1 32 PRO QD 1 36 THR MG . . 4.510 4.028 3.645 4.434 . 0 0 "[ . 1 . 2]" 1
638 1 32 PRO HG2 1 35 ARG H . . 4.020 3.081 2.926 3.223 . 0 0 "[ . 1 . 2]" 1
639 1 32 PRO HG2 1 35 ARG HB2 . . 4.490 2.086 2.000 2.231 . 0 0 "[ . 1 . 2]" 1
640 1 32 PRO HG2 1 35 ARG HB3 . . 4.050 3.597 3.251 3.957 . 0 0 "[ . 1 . 2]" 1
641 1 32 PRO HG2 1 35 ARG QD . . 5.320 4.844 2.103 5.308 . 0 0 "[ . 1 . 2]" 1
642 1 32 PRO HG2 1 35 ARG QG . . 4.570 3.692 3.417 4.162 . 0 0 "[ . 1 . 2]" 1
643 1 32 PRO HG3 1 35 ARG H . . 4.890 4.552 4.419 4.666 . 0 0 "[ . 1 . 2]" 1
644 1 33 TYR H 1 33 TYR HB2 . . 3.090 2.282 2.223 2.360 . 0 0 "[ . 1 . 2]" 1
645 1 33 TYR H 1 33 TYR HB3 . . 3.110 2.852 2.731 3.020 . 0 0 "[ . 1 . 2]" 1
646 1 33 TYR H 1 33 TYR QD . . 4.180 4.055 3.895 4.158 . 0 0 "[ . 1 . 2]" 1
647 1 33 TYR H 1 36 THR MG . . 4.940 3.762 3.381 4.130 . 0 0 "[ . 1 . 2]" 1
648 1 33 TYR HA 1 33 TYR QD . . 3.520 2.987 2.695 3.138 . 0 0 "[ . 1 . 2]" 1
649 1 33 TYR HA 1 33 TYR QE . . 4.830 4.582 4.473 4.672 . 0 0 "[ . 1 . 2]" 1
650 1 33 TYR HA 1 36 THR MG . . 3.310 2.056 1.922 2.217 . 0 0 "[ . 1 . 2]" 1
651 1 33 TYR HB2 1 34 SER H . . 4.380 3.466 3.360 3.564 . 0 0 "[ . 1 . 2]" 1
652 1 33 TYR HB2 1 35 ARG H . . 5.500 5.432 5.304 5.503 0.003 5 0 "[ . 1 . 2]" 1
653 1 33 TYR HB3 1 34 SER H . . 4.300 2.100 1.928 2.213 . 0 0 "[ . 1 . 2]" 1
654 1 33 TYR QD 1 34 SER H . . 4.160 3.284 2.940 3.521 . 0 0 "[ . 1 . 2]" 1
655 1 33 TYR QD 1 34 SER HA . . 3.900 3.096 2.730 3.450 . 0 0 "[ . 1 . 2]" 1
656 1 33 TYR QD 1 34 SER QB . . 4.470 4.393 4.168 4.475 0.005 9 0 "[ . 1 . 2]" 1
657 1 34 SER H 1 34 SER HA . . 2.810 2.677 2.662 2.707 . 0 0 "[ . 1 . 2]" 1
658 1 34 SER H 1 34 SER QB . . 3.570 2.324 2.196 2.670 . 0 0 "[ . 1 . 2]" 1
659 1 34 SER H 1 36 THR MG . . 4.610 4.507 4.298 4.602 . 0 0 "[ . 1 . 2]" 1
660 1 34 SER HA 1 36 THR H . . 5.500 5.222 5.065 5.377 . 0 0 "[ . 1 . 2]" 1
661 1 34 SER QB 1 35 ARG H . . 4.060 2.886 2.541 3.463 . 0 0 "[ . 1 . 2]" 1
662 1 34 SER QB 1 35 ARG HB2 . . 4.990 4.313 3.967 4.989 . 0 0 "[ . 1 . 2]" 1
663 1 34 SER QB 1 35 ARG QG . . 4.510 3.062 2.591 3.515 . 0 0 "[ . 1 . 2]" 1
664 1 34 SER HB2 1 35 ARG H . . 4.770 3.703 2.799 4.125 . 0 0 "[ . 1 . 2]" 1
665 1 34 SER HB3 1 35 ARG H . . 4.770 3.185 2.576 4.022 . 0 0 "[ . 1 . 2]" 1
666 1 35 ARG H 1 35 ARG HB2 . . 3.630 2.618 2.517 2.728 . 0 0 "[ . 1 . 2]" 1
667 1 35 ARG H 1 35 ARG QD . . 4.980 4.187 2.319 4.814 . 0 0 "[ . 1 . 2]" 1
668 1 35 ARG H 1 35 ARG HG2 . . 4.270 3.206 2.869 4.273 0.003 5 0 "[ . 1 . 2]" 1
669 1 35 ARG H 1 35 ARG HG3 . . 4.270 4.030 3.363 4.235 . 0 0 "[ . 1 . 2]" 1
670 1 35 ARG H 1 36 THR MG . . 3.770 3.533 3.314 3.769 . 0 0 "[ . 1 . 2]" 1
671 1 35 ARG HA 1 35 ARG QD . . 3.890 2.542 2.018 3.565 . 0 0 "[ . 1 . 2]" 1
672 1 35 ARG HA 1 35 ARG HG2 . . 4.250 2.870 2.570 3.606 . 0 0 "[ . 1 . 2]" 1
673 1 35 ARG HA 1 35 ARG HG3 . . 4.250 3.629 2.385 3.831 . 0 0 "[ . 1 . 2]" 1
674 1 35 ARG HA 1 36 THR H . . 3.000 2.230 2.193 2.300 . 0 0 "[ . 1 . 2]" 1
675 1 35 ARG HB2 1 35 ARG QD . . 3.520 3.184 2.074 3.506 . 0 0 "[ . 1 . 2]" 1
676 1 35 ARG HB2 1 36 THR H . . 4.530 4.485 4.425 4.535 0.005 2 0 "[ . 1 . 2]" 1
677 1 35 ARG HB2 1 40 ASP QB . . 4.940 4.795 4.478 4.942 0.002 9 0 "[ . 1 . 2]" 1
678 1 35 ARG HB3 1 35 ARG QD . . 3.180 2.386 2.113 3.221 0.041 5 0 "[ . 1 . 2]" 1
679 1 35 ARG HB3 1 36 THR H . . 4.170 3.964 3.864 4.099 . 0 0 "[ . 1 . 2]" 1
680 1 35 ARG HB3 1 37 THR H . . 5.500 5.390 5.093 5.502 0.002 9 0 "[ . 1 . 2]" 1
681 1 35 ARG HB3 1 40 ASP QB . . 4.560 3.798 3.545 4.051 . 0 0 "[ . 1 . 2]" 1
682 1 35 ARG QD 1 36 THR H . . 5.130 4.339 3.817 5.143 0.013 5 0 "[ . 1 . 2]" 1
683 1 36 THR H 1 36 THR MG . . 3.600 3.324 3.193 3.437 . 0 0 "[ . 1 . 2]" 1
684 1 36 THR H 1 37 THR HA . . 5.280 5.149 5.104 5.240 . 0 0 "[ . 1 . 2]" 1
685 1 36 THR H 1 37 THR HG1 . . 4.060 3.499 3.348 3.752 . 0 0 "[ . 1 . 2]" 1
686 1 36 THR H 1 37 THR MG . . 4.110 3.689 3.562 3.831 . 0 0 "[ . 1 . 2]" 1
687 1 36 THR H 1 40 ASP HB2 . . 5.500 4.973 4.694 5.204 . 0 0 "[ . 1 . 2]" 1
688 1 36 THR H 1 40 ASP QB . . 4.710 4.586 4.283 4.693 . 0 0 "[ . 1 . 2]" 1
689 1 36 THR H 1 40 ASP HB3 . . 5.500 5.385 4.944 5.500 0.000 16 0 "[ . 1 . 2]" 1
690 1 36 THR HB 1 37 THR H . . 4.770 3.614 3.514 3.748 . 0 0 "[ . 1 . 2]" 1
691 1 36 THR HB 1 37 THR HG1 . . 5.060 4.990 4.927 5.062 0.002 9 0 "[ . 1 . 2]" 1
692 1 36 THR HB 1 76 LEU H . . 4.060 2.942 2.523 3.352 . 0 0 "[ . 1 . 2]" 1
693 1 36 THR HB 1 76 LEU HB2 . . 4.110 2.773 2.490 3.141 . 0 0 "[ . 1 . 2]" 1
694 1 36 THR HB 1 76 LEU HB3 . . 4.580 4.083 3.685 4.543 . 0 0 "[ . 1 . 2]" 1
695 1 36 THR HB 1 76 LEU MD1 . . 4.640 4.085 3.709 4.490 . 0 0 "[ . 1 . 2]" 1
696 1 36 THR MG 1 37 THR H . . 3.910 3.836 3.744 3.910 . 0 0 "[ . 1 . 2]" 1
697 1 36 THR MG 1 37 THR HG1 . . 5.170 5.059 5.018 5.093 . 0 0 "[ . 1 . 2]" 1
698 1 36 THR MG 1 76 LEU HB2 . . 4.340 3.668 3.479 3.959 . 0 0 "[ . 1 . 2]" 1
699 1 37 THR H 1 37 THR HB . . 4.120 3.862 3.838 3.898 . 0 0 "[ . 1 . 2]" 1
700 1 37 THR H 1 37 THR HG1 . . 3.300 2.424 2.345 2.529 . 0 0 "[ . 1 . 2]" 1
701 1 37 THR H 1 37 THR MG . . 3.840 3.672 3.635 3.691 . 0 0 "[ . 1 . 2]" 1
702 1 37 THR H 1 38 VAL H . . 5.030 4.279 4.195 4.356 . 0 0 "[ . 1 . 2]" 1
703 1 37 THR H 1 39 GLU QG . . 5.110 4.607 4.175 5.112 0.002 1 0 "[ . 1 . 2]" 1
704 1 37 THR H 1 40 ASP H . . 3.880 3.529 3.320 3.717 . 0 0 "[ . 1 . 2]" 1
705 1 37 THR H 1 40 ASP HA . . 5.180 4.978 4.785 5.180 . 0 0 "[ . 1 . 2]" 1
706 1 37 THR H 1 40 ASP HB2 . . 3.600 2.496 1.910 3.337 . 0 0 "[ . 1 . 2]" 1
707 1 37 THR H 1 40 ASP QB . . 3.040 2.039 1.897 2.338 . 0 0 "[ . 1 . 2]" 1
708 1 37 THR H 1 40 ASP HB3 . . 3.600 2.733 1.982 3.537 . 0 0 "[ . 1 . 2]" 1
709 1 37 THR H 1 41 PHE H . . 4.460 3.956 3.651 4.270 . 0 0 "[ . 1 . 2]" 1
710 1 37 THR H 1 75 THR HA . . 5.020 4.828 4.406 5.016 . 0 0 "[ . 1 . 2]" 1
711 1 37 THR H 1 76 LEU H . . 5.310 3.940 3.632 4.231 . 0 0 "[ . 1 . 2]" 1
712 1 37 THR H 1 76 LEU MD1 . . 4.990 2.985 2.604 3.505 . 0 0 "[ . 1 . 2]" 1
713 1 37 THR H 1 76 LEU HG . . 4.790 4.397 4.122 4.758 . 0 0 "[ . 1 . 2]" 1
714 1 37 THR HA 1 37 THR MG . . 3.230 2.022 1.993 2.058 . 0 0 "[ . 1 . 2]" 1
715 1 37 THR HA 1 38 VAL H . . 3.110 2.281 2.212 2.386 . 0 0 "[ . 1 . 2]" 1
716 1 37 THR HA 1 38 VAL HB . . 5.110 4.783 4.686 4.932 . 0 0 "[ . 1 . 2]" 1
717 1 37 THR HA 1 38 VAL MG2 . . 4.230 3.833 3.589 4.090 . 0 0 "[ . 1 . 2]" 1
718 1 37 THR HA 1 39 GLU H . . 4.660 4.206 4.005 4.419 . 0 0 "[ . 1 . 2]" 1
719 1 37 THR HA 1 75 THR H . . 5.200 4.856 4.513 5.027 . 0 0 "[ . 1 . 2]" 1
720 1 37 THR HA 1 75 THR HA . . 3.270 2.335 2.127 2.432 . 0 0 "[ . 1 . 2]" 1
721 1 37 THR HA 1 75 THR HB . . 5.390 5.321 5.143 5.389 . 0 0 "[ . 1 . 2]" 1
722 1 37 THR HA 1 75 THR MG . . 4.070 3.667 3.483 3.914 . 0 0 "[ . 1 . 2]" 1
723 1 37 THR HA 1 76 LEU H . . 3.550 2.474 2.338 2.573 . 0 0 "[ . 1 . 2]" 1
724 1 37 THR HA 1 76 LEU MD1 . . 4.660 3.531 3.256 3.788 . 0 0 "[ . 1 . 2]" 1
725 1 37 THR HA 1 76 LEU HG . . 4.780 3.288 3.083 3.578 . 0 0 "[ . 1 . 2]" 1
726 1 37 THR HB 1 38 VAL H . . 3.220 2.805 2.503 3.025 . 0 0 "[ . 1 . 2]" 1
727 1 37 THR HB 1 38 VAL MG2 . . 4.700 4.511 4.312 4.701 0.001 1 0 "[ . 1 . 2]" 1
728 1 37 THR HB 1 39 GLU H . . 3.450 2.518 2.409 2.697 . 0 0 "[ . 1 . 2]" 1
729 1 37 THR HB 1 40 ASP H . . 4.600 3.104 2.964 3.304 . 0 0 "[ . 1 . 2]" 1
730 1 37 THR HB 1 75 THR HA . . 4.560 4.290 4.167 4.418 . 0 0 "[ . 1 . 2]" 1
731 1 37 THR HB 1 76 LEU H . . 5.220 5.112 4.975 5.215 . 0 0 "[ . 1 . 2]" 1
732 1 37 THR HG1 1 38 VAL H . . 4.860 4.768 4.634 4.850 . 0 0 "[ . 1 . 2]" 1
733 1 37 THR HG1 1 39 GLU H . . 5.140 4.650 4.356 4.949 . 0 0 "[ . 1 . 2]" 1
734 1 37 THR HG1 1 40 ASP H . . 3.790 3.330 3.106 3.620 . 0 0 "[ . 1 . 2]" 1
735 1 37 THR MG 1 38 VAL H . . 3.790 3.299 3.220 3.383 . 0 0 "[ . 1 . 2]" 1
736 1 37 THR MG 1 39 GLU H . . 4.160 4.105 4.044 4.164 0.004 1 0 "[ . 1 . 2]" 1
737 1 37 THR MG 1 39 GLU HB3 . . 5.500 5.212 4.890 5.408 . 0 0 "[ . 1 . 2]" 1
738 1 37 THR MG 1 39 GLU QG . . 4.500 3.494 3.282 3.795 . 0 0 "[ . 1 . 2]" 1
739 1 37 THR MG 1 40 ASP H . . 4.520 4.412 4.326 4.528 0.008 1 0 "[ . 1 . 2]" 1
740 1 37 THR MG 1 40 ASP QB . . 4.690 4.206 4.052 4.388 . 0 0 "[ . 1 . 2]" 1
741 1 37 THR MG 1 73 ASP HA . . 3.990 3.305 2.969 3.743 . 0 0 "[ . 1 . 2]" 1
742 1 37 THR MG 1 74 HIS H . . 5.310 4.583 4.248 4.819 . 0 0 "[ . 1 . 2]" 1
743 1 37 THR MG 1 75 THR H . . 4.650 3.940 3.626 4.217 . 0 0 "[ . 1 . 2]" 1
744 1 37 THR MG 1 75 THR HA . . 3.580 2.038 1.979 2.153 . 0 0 "[ . 1 . 2]" 1
745 1 37 THR MG 1 75 THR HB . . 4.890 4.393 4.273 4.463 . 0 0 "[ . 1 . 2]" 1
746 1 37 THR MG 1 75 THR MG . . 3.440 3.118 2.939 3.336 . 0 0 "[ . 1 . 2]" 1
747 1 37 THR MG 1 76 LEU H . . 4.230 3.411 3.162 3.608 . 0 0 "[ . 1 . 2]" 1
748 1 37 THR MG 1 76 LEU HB2 . . 5.500 4.937 4.707 5.271 . 0 0 "[ . 1 . 2]" 1
749 1 38 VAL H 1 38 VAL HB . . 3.230 2.555 2.384 2.702 . 0 0 "[ . 1 . 2]" 1
750 1 38 VAL H 1 38 VAL MG1 . . 4.160 3.764 3.730 3.790 . 0 0 "[ . 1 . 2]" 1
751 1 38 VAL H 1 38 VAL MG2 . . 3.140 2.139 1.892 2.498 . 0 0 "[ . 1 . 2]" 1
752 1 38 VAL H 1 39 GLU H . . 3.700 2.893 2.739 3.003 . 0 0 "[ . 1 . 2]" 1
753 1 38 VAL H 1 72 LYS HA . . 4.590 4.388 4.151 4.575 . 0 0 "[ . 1 . 2]" 1
754 1 38 VAL H 1 74 HIS H . . 4.640 4.254 3.822 4.635 . 0 0 "[ . 1 . 2]" 1
755 1 38 VAL H 1 74 HIS HB3 . . 4.530 3.975 3.563 4.274 . 0 0 "[ . 1 . 2]" 1
756 1 38 VAL H 1 74 HIS HD2 . . 4.980 4.078 3.727 4.522 . 0 0 "[ . 1 . 2]" 1
757 1 38 VAL H 1 76 LEU MD1 . . 3.660 3.435 3.239 3.635 . 0 0 "[ . 1 . 2]" 1
758 1 38 VAL H 1 76 LEU MD2 . . 4.500 4.316 4.143 4.497 . 0 0 "[ . 1 . 2]" 1
759 1 38 VAL H 1 76 LEU HG . . 4.050 3.065 2.885 3.344 . 0 0 "[ . 1 . 2]" 1
760 1 38 VAL HA 1 38 VAL MG1 . . 3.220 2.437 2.331 2.532 . 0 0 "[ . 1 . 2]" 1
761 1 38 VAL HA 1 38 VAL MG2 . . 3.090 2.315 2.116 2.443 . 0 0 "[ . 1 . 2]" 1
762 1 38 VAL HA 1 41 PHE H . . 4.000 3.598 3.368 3.833 . 0 0 "[ . 1 . 2]" 1
763 1 38 VAL HA 1 41 PHE HB2 . . 4.540 4.080 3.797 4.302 . 0 0 "[ . 1 . 2]" 1
764 1 38 VAL HA 1 41 PHE QD . . 5.060 4.745 4.437 5.056 . 0 0 "[ . 1 . 2]" 1
765 1 38 VAL HA 1 42 CYS H . . 4.760 4.402 4.219 4.538 . 0 0 "[ . 1 . 2]" 1
766 1 38 VAL HA 1 70 VAL MG2 . . 5.500 5.123 4.890 5.348 . 0 0 "[ . 1 . 2]" 1
767 1 38 VAL HA 1 76 LEU MD1 . . 3.260 2.212 1.983 2.371 . 0 0 "[ . 1 . 2]" 1
768 1 38 VAL HA 1 76 LEU MD2 . . 4.510 3.427 3.070 3.710 . 0 0 "[ . 1 . 2]" 1
769 1 38 VAL HA 1 76 LEU HG . . 4.460 3.077 2.915 3.469 . 0 0 "[ . 1 . 2]" 1
770 1 38 VAL HA 1 82 ILE MD . . 4.090 3.045 2.807 3.221 . 0 0 "[ . 1 . 2]" 1
771 1 38 VAL HB 1 39 GLU H . . 3.560 2.691 2.551 2.852 . 0 0 "[ . 1 . 2]" 1
772 1 38 VAL HB 1 53 PHE HZ . . 5.070 4.197 3.837 4.442 . 0 0 "[ . 1 . 2]" 1
773 1 38 VAL HB 1 56 ALA MB . . 5.290 4.371 4.161 4.675 . 0 0 "[ . 1 . 2]" 1
774 1 38 VAL HB 1 70 VAL MG2 . . 4.740 4.254 3.890 4.585 . 0 0 "[ . 1 . 2]" 1
775 1 38 VAL HB 1 72 LYS H . . 4.790 4.664 4.512 4.787 . 0 0 "[ . 1 . 2]" 1
776 1 38 VAL HB 1 72 LYS HA . . 3.100 2.037 1.997 2.185 . 0 0 "[ . 1 . 2]" 1
777 1 38 VAL HB 1 72 LYS HB2 . . 4.710 3.961 3.816 4.174 . 0 0 "[ . 1 . 2]" 1
778 1 38 VAL HB 1 74 HIS H . . 4.110 3.654 3.247 4.012 . 0 0 "[ . 1 . 2]" 1
779 1 38 VAL HB 1 76 LEU MD1 . . 4.850 4.709 4.469 4.848 . 0 0 "[ . 1 . 2]" 1
780 1 38 VAL HB 1 76 LEU MD2 . . 5.500 5.217 5.000 5.406 . 0 0 "[ . 1 . 2]" 1
781 1 38 VAL HB 1 82 ILE MD . . 4.930 4.313 4.124 4.548 . 0 0 "[ . 1 . 2]" 1
782 1 38 VAL MG1 1 39 GLU H . . 3.800 3.357 2.960 3.596 . 0 0 "[ . 1 . 2]" 1
783 1 38 VAL MG1 1 42 CYS H . . 4.510 4.016 3.742 4.228 . 0 0 "[ . 1 . 2]" 1
784 1 38 VAL MG1 1 42 CYS HA . . 5.500 5.240 4.991 5.409 . 0 0 "[ . 1 . 2]" 1
785 1 38 VAL MG1 1 42 CYS QB . . 4.590 4.062 3.419 4.417 . 0 0 "[ . 1 . 2]" 1
786 1 38 VAL MG1 1 53 PHE QE . . 3.230 2.499 2.074 2.744 . 0 0 "[ . 1 . 2]" 1
787 1 38 VAL MG1 1 53 PHE HZ . . 3.210 2.363 2.113 2.728 . 0 0 "[ . 1 . 2]" 1
788 1 38 VAL MG1 1 55 TYR HA . . 4.750 4.651 4.492 4.749 . 0 0 "[ . 1 . 2]" 1
789 1 38 VAL MG1 1 72 LYS H . . 5.220 4.476 4.161 4.831 . 0 0 "[ . 1 . 2]" 1
790 1 38 VAL MG1 1 72 LYS HA . . 3.280 2.347 2.095 2.739 . 0 0 "[ . 1 . 2]" 1
791 1 38 VAL MG1 1 82 ILE MD . . 2.930 2.376 1.946 2.819 . 0 0 "[ . 1 . 2]" 1
792 1 38 VAL MG1 1 82 ILE MG . . 5.050 4.506 4.249 4.850 . 0 0 "[ . 1 . 2]" 1
793 1 38 VAL MG2 1 39 GLU H . . 4.150 3.933 3.786 4.055 . 0 0 "[ . 1 . 2]" 1
794 1 38 VAL MG2 1 41 PHE H . . 5.490 5.305 5.101 5.454 . 0 0 "[ . 1 . 2]" 1
795 1 38 VAL MG2 1 53 PHE QE . . 4.630 3.929 3.592 4.269 . 0 0 "[ . 1 . 2]" 1
796 1 38 VAL MG2 1 53 PHE HZ . . 4.560 3.577 3.270 4.046 . 0 0 "[ . 1 . 2]" 1
797 1 38 VAL MG2 1 56 ALA MB . . 3.540 2.529 2.113 2.776 . 0 0 "[ . 1 . 2]" 1
798 1 38 VAL MG2 1 70 VAL HB . . 4.420 3.514 3.310 3.701 . 0 0 "[ . 1 . 2]" 1
799 1 38 VAL MG2 1 70 VAL MG1 . . 4.540 4.072 3.916 4.281 . 0 0 "[ . 1 . 2]" 1
800 1 38 VAL MG2 1 70 VAL MG2 . . 2.970 2.118 1.925 2.399 . 0 0 "[ . 1 . 2]" 1
801 1 38 VAL MG2 1 71 GLY H . . 4.760 4.246 4.001 4.572 . 0 0 "[ . 1 . 2]" 1
802 1 38 VAL MG2 1 72 LYS HA . . 3.950 3.345 3.181 3.594 . 0 0 "[ . 1 . 2]" 1
803 1 38 VAL MG2 1 74 HIS H . . 3.790 3.268 2.796 3.597 . 0 0 "[ . 1 . 2]" 1
804 1 38 VAL MG2 1 74 HIS HB2 . . 3.860 3.514 3.293 3.747 . 0 0 "[ . 1 . 2]" 1
805 1 38 VAL MG2 1 74 HIS HB3 . . 3.370 2.024 1.871 2.242 . 0 0 "[ . 1 . 2]" 1
806 1 38 VAL MG2 1 74 HIS HD2 . . 3.500 2.445 2.031 2.884 . 0 0 "[ . 1 . 2]" 1
807 1 38 VAL MG2 1 76 LEU H . . 4.840 4.506 4.157 4.828 . 0 0 "[ . 1 . 2]" 1
808 1 38 VAL MG2 1 76 LEU MD1 . . 3.450 3.254 2.845 3.382 . 0 0 "[ . 1 . 2]" 1
809 1 38 VAL MG2 1 76 LEU MD2 . . 3.090 2.780 2.528 3.028 . 0 0 "[ . 1 . 2]" 1
810 1 38 VAL MG2 1 76 LEU HG . . 3.550 2.697 2.522 2.945 . 0 0 "[ . 1 . 2]" 1
811 1 38 VAL MG2 1 82 ILE MD . . 3.050 2.093 1.907 2.263 . 0 0 "[ . 1 . 2]" 1
812 1 39 GLU H 1 39 GLU HB2 . . 3.750 3.589 3.516 3.606 . 0 0 "[ . 1 . 2]" 1
813 1 39 GLU H 1 39 GLU HB3 . . 3.810 2.521 2.221 2.703 . 0 0 "[ . 1 . 2]" 1
814 1 39 GLU H 1 39 GLU QG . . 2.940 2.192 1.892 2.729 . 0 0 "[ . 1 . 2]" 1
815 1 39 GLU H 1 40 ASP H . . 3.450 2.583 2.448 2.715 . 0 0 "[ . 1 . 2]" 1
816 1 39 GLU H 1 40 ASP QB . . 4.770 4.363 4.223 4.522 . 0 0 "[ . 1 . 2]" 1
817 1 39 GLU H 1 42 CYS QB . . 5.340 5.230 5.093 5.351 0.011 1 0 "[ . 1 . 2]" 1
818 1 39 GLU H 1 50 ILE MD . . 4.090 3.977 3.759 4.088 . 0 0 "[ . 1 . 2]" 1
819 1 39 GLU H 1 72 LYS HB2 . . 3.910 3.693 3.168 3.912 0.002 9 0 "[ . 1 . 2]" 1
820 1 39 GLU H 1 72 LYS QD . . 5.340 4.868 4.172 5.344 0.004 1 0 "[ . 1 . 2]" 1
821 1 39 GLU HA 1 39 GLU HG2 . . 3.970 3.750 3.624 3.890 . 0 0 "[ . 1 . 2]" 1
822 1 39 GLU HA 1 39 GLU QG . . 3.460 3.328 3.270 3.340 . 0 0 "[ . 1 . 2]" 1
823 1 39 GLU HA 1 39 GLU HG3 . . 3.970 3.734 3.543 3.905 . 0 0 "[ . 1 . 2]" 1
824 1 39 GLU HA 1 40 ASP HA . . 5.500 4.798 4.700 4.868 . 0 0 "[ . 1 . 2]" 1
825 1 39 GLU HA 1 42 CYS QB . . 3.760 2.845 2.598 3.298 . 0 0 "[ . 1 . 2]" 1
826 1 39 GLU HA 1 43 MET H . . 4.730 4.517 4.199 4.716 . 0 0 "[ . 1 . 2]" 1
827 1 39 GLU HA 1 43 MET ME . . 4.640 4.257 3.819 4.639 . 0 0 "[ . 1 . 2]" 1
828 1 39 GLU HA 1 43 MET QG . . 5.000 4.411 4.150 4.798 . 0 0 "[ . 1 . 2]" 1
829 1 39 GLU HA 1 50 ILE HA . . 5.500 4.752 4.548 5.042 . 0 0 "[ . 1 . 2]" 1
830 1 39 GLU HA 1 50 ILE MD . . 3.100 2.071 1.956 2.281 . 0 0 "[ . 1 . 2]" 1
831 1 39 GLU HA 1 50 ILE QG . . 4.590 4.146 4.003 4.317 . 0 0 "[ . 1 . 2]" 1
832 1 39 GLU HA 1 50 ILE MG . . 5.390 5.163 4.995 5.362 . 0 0 "[ . 1 . 2]" 1
833 1 39 GLU HA 1 72 LYS HB2 . . 4.860 3.616 2.941 3.938 . 0 0 "[ . 1 . 2]" 1
834 1 39 GLU HB2 1 40 ASP H . . 4.390 3.831 3.444 4.282 . 0 0 "[ . 1 . 2]" 1
835 1 39 GLU HB2 1 50 ILE MD . . 4.400 2.459 2.068 2.936 . 0 0 "[ . 1 . 2]" 1
836 1 39 GLU HB2 1 50 ILE QG . . 4.020 3.548 3.302 3.809 . 0 0 "[ . 1 . 2]" 1
837 1 39 GLU HB2 1 50 ILE MG . . 4.820 4.665 4.312 4.821 0.001 19 0 "[ . 1 . 2]" 1
838 1 39 GLU HB2 1 72 LYS HB2 . . 4.490 3.628 2.743 4.023 . 0 0 "[ . 1 . 2]" 1
839 1 39 GLU HB3 1 40 ASP H . . 4.500 3.896 3.638 4.056 . 0 0 "[ . 1 . 2]" 1
840 1 39 GLU HB3 1 50 ILE MD . . 3.230 2.525 2.136 3.065 . 0 0 "[ . 1 . 2]" 1
841 1 39 GLU HB3 1 72 LYS HA . . 4.580 3.773 3.288 4.166 . 0 0 "[ . 1 . 2]" 1
842 1 39 GLU HB3 1 72 LYS HB2 . . 3.870 2.238 1.999 2.615 . 0 0 "[ . 1 . 2]" 1
843 1 39 GLU QG 1 40 ASP H . . 3.370 2.102 1.830 2.638 . 0 0 "[ . 1 . 2]" 1
844 1 39 GLU QG 1 40 ASP HA . . 4.750 3.206 2.862 3.453 . 0 0 "[ . 1 . 2]" 1
845 1 39 GLU QG 1 43 MET QG . . 5.340 4.260 3.673 4.762 . 0 0 "[ . 1 . 2]" 1
846 1 39 GLU QG 1 50 ILE MD . . 4.250 3.959 3.663 4.210 . 0 0 "[ . 1 . 2]" 1
847 1 39 GLU QG 1 72 LYS HB2 . . 5.340 4.123 3.846 4.698 . 0 0 "[ . 1 . 2]" 1
848 1 39 GLU HG2 1 50 ILE MD . . 4.870 4.466 4.091 4.879 0.009 1 0 "[ . 1 . 2]" 1
849 1 39 GLU HG3 1 50 ILE MD . . 4.870 4.432 4.107 4.763 . 0 0 "[ . 1 . 2]" 1
850 1 40 ASP H 1 40 ASP HB2 . . 3.690 2.389 2.203 2.631 . 0 0 "[ . 1 . 2]" 1
851 1 40 ASP H 1 40 ASP QB . . 3.120 2.249 2.181 2.355 . 0 0 "[ . 1 . 2]" 1
852 1 40 ASP H 1 40 ASP HB3 . . 3.690 3.063 2.438 3.577 . 0 0 "[ . 1 . 2]" 1
853 1 40 ASP H 1 41 PHE H . . 3.350 2.628 2.383 2.840 . 0 0 "[ . 1 . 2]" 1
854 1 40 ASP H 1 42 CYS H . . 4.910 4.266 3.992 4.444 . 0 0 "[ . 1 . 2]" 1
855 1 40 ASP H 1 43 MET QG . . 5.030 4.779 4.544 5.035 0.005 1 0 "[ . 1 . 2]" 1
856 1 40 ASP H 1 76 LEU MD1 . . 4.910 4.319 3.894 4.708 . 0 0 "[ . 1 . 2]" 1
857 1 40 ASP HA 1 42 CYS H . . 5.290 4.645 4.375 5.010 . 0 0 "[ . 1 . 2]" 1
858 1 40 ASP HA 1 43 MET H . . 4.060 3.803 3.668 4.051 . 0 0 "[ . 1 . 2]" 1
859 1 40 ASP HA 1 43 MET HB2 . . 3.600 3.447 3.226 3.601 0.001 1 0 "[ . 1 . 2]" 1
860 1 40 ASP HA 1 43 MET QG . . 3.790 2.971 2.602 3.331 . 0 0 "[ . 1 . 2]" 1
861 1 40 ASP HA 1 44 LYS H . . 5.180 4.979 4.694 5.179 . 0 0 "[ . 1 . 2]" 1
862 1 40 ASP QB 1 41 PHE H . . 3.270 2.763 2.641 2.909 . 0 0 "[ . 1 . 2]" 1
863 1 40 ASP QB 1 43 MET QG . . 5.320 4.704 4.415 5.000 . 0 0 "[ . 1 . 2]" 1
864 1 40 ASP HB2 1 41 PHE H . . 4.090 3.430 2.731 4.086 . 0 0 "[ . 1 . 2]" 1
865 1 40 ASP HB3 1 41 PHE H . . 4.090 3.180 2.688 3.750 . 0 0 "[ . 1 . 2]" 1
866 1 41 PHE H 1 41 PHE HB2 . . 3.230 2.827 2.742 2.909 . 0 0 "[ . 1 . 2]" 1
867 1 41 PHE H 1 41 PHE HB3 . . 3.050 2.312 2.240 2.394 . 0 0 "[ . 1 . 2]" 1
868 1 41 PHE H 1 41 PHE QD . . 4.210 4.036 3.933 4.116 . 0 0 "[ . 1 . 2]" 1
869 1 41 PHE H 1 42 CYS QB . . 5.080 4.461 4.372 4.579 . 0 0 "[ . 1 . 2]" 1
870 1 41 PHE H 1 43 MET H . . 4.940 4.024 3.880 4.227 . 0 0 "[ . 1 . 2]" 1
871 1 41 PHE H 1 76 LEU MD1 . . 3.890 3.212 3.027 3.461 . 0 0 "[ . 1 . 2]" 1
872 1 41 PHE HA 1 41 PHE QD . . 3.710 3.254 3.171 3.322 . 0 0 "[ . 1 . 2]" 1
873 1 41 PHE HA 1 44 LYS H . . 3.680 3.342 3.120 3.488 . 0 0 "[ . 1 . 2]" 1
874 1 41 PHE HA 1 44 LYS HB2 . . 3.980 2.996 2.803 3.233 . 0 0 "[ . 1 . 2]" 1
875 1 41 PHE HA 1 44 LYS HB3 . . 5.170 4.601 4.417 4.803 . 0 0 "[ . 1 . 2]" 1
876 1 41 PHE HA 1 44 LYS QG . . 4.460 3.109 2.849 3.405 . 0 0 "[ . 1 . 2]" 1
877 1 41 PHE HA 1 76 LEU MD1 . . 4.250 4.126 3.940 4.252 0.002 8 0 "[ . 1 . 2]" 1
878 1 41 PHE HB2 1 42 CYS H . . 4.360 3.963 3.780 4.104 . 0 0 "[ . 1 . 2]" 1
879 1 41 PHE HB2 1 44 LYS HB2 . . 5.500 4.958 4.717 5.188 . 0 0 "[ . 1 . 2]" 1
880 1 41 PHE HB2 1 76 LEU MD1 . . 3.640 2.363 2.137 2.549 . 0 0 "[ . 1 . 2]" 1
881 1 41 PHE HB3 1 42 CYS H . . 3.290 2.614 2.341 2.832 . 0 0 "[ . 1 . 2]" 1
882 1 41 PHE HB3 1 76 LEU MD1 . . 3.910 2.669 2.342 2.946 . 0 0 "[ . 1 . 2]" 1
883 1 41 PHE QD 1 42 CYS H . . 3.690 2.626 2.461 2.838 . 0 0 "[ . 1 . 2]" 1
884 1 41 PHE QD 1 42 CYS HA . . 3.880 2.350 2.269 2.486 . 0 0 "[ . 1 . 2]" 1
885 1 41 PHE QD 1 42 CYS QB . . 4.560 3.735 3.184 4.022 . 0 0 "[ . 1 . 2]" 1
886 1 41 PHE QD 1 44 LYS H . . 5.080 4.896 4.550 5.059 . 0 0 "[ . 1 . 2]" 1
887 1 41 PHE QD 1 45 ILE MD . . 4.870 4.420 4.173 4.654 . 0 0 "[ . 1 . 2]" 1
888 1 41 PHE QD 1 49 LEU MD2 . . 4.880 3.491 3.192 3.861 . 0 0 "[ . 1 . 2]" 1
889 1 41 PHE QD 1 76 LEU MD1 . . 4.070 3.223 2.785 3.639 . 0 0 "[ . 1 . 2]" 1
890 1 41 PHE QD 1 82 ILE MD . . 4.410 4.100 3.459 4.399 . 0 0 "[ . 1 . 2]" 1
891 1 41 PHE QD 1 82 ILE MG . . 4.560 3.534 3.217 3.709 . 0 0 "[ . 1 . 2]" 1
892 1 41 PHE QD 1 84 ILE QG . . 4.510 3.060 2.665 3.378 . 0 0 "[ . 1 . 2]" 1
893 1 41 PHE QE 1 42 CYS HA . . 4.890 3.474 3.282 3.621 . 0 0 "[ . 1 . 2]" 1
894 1 41 PHE QE 1 45 ILE MD . . 3.880 3.481 3.031 3.855 . 0 0 "[ . 1 . 2]" 1
895 1 41 PHE QE 1 45 ILE HG13 . . 4.120 2.842 2.113 3.550 . 0 0 "[ . 1 . 2]" 1
896 1 41 PHE QE 1 82 ILE MG . . 3.730 3.372 3.024 3.723 . 0 0 "[ . 1 . 2]" 1
897 1 41 PHE QE 1 84 ILE HB . . 5.030 3.959 3.495 4.673 . 0 0 "[ . 1 . 2]" 1
898 1 41 PHE QE 1 84 ILE QG . . 3.650 2.185 1.970 2.799 . 0 0 "[ . 1 . 2]" 1
899 1 41 PHE HZ 1 45 ILE MD . . 3.800 3.282 2.697 3.800 . 19 0 "[ . 1 . 2]" 1
900 1 41 PHE HZ 1 45 ILE HG12 . . 4.740 3.919 3.325 4.388 . 0 0 "[ . 1 . 2]" 1
901 1 41 PHE HZ 1 45 ILE HG13 . . 4.530 3.511 2.872 4.152 . 0 0 "[ . 1 . 2]" 1
902 1 41 PHE HZ 1 82 ILE MG . . 4.440 3.804 3.255 4.319 . 0 0 "[ . 1 . 2]" 1
903 1 41 PHE HZ 1 84 ILE QG . . 4.930 3.718 3.480 4.167 . 0 0 "[ . 1 . 2]" 1
904 1 42 CYS H 1 42 CYS HB2 . . 3.690 2.787 2.355 3.578 . 0 0 "[ . 1 . 2]" 1
905 1 42 CYS H 1 42 CYS QB . . 2.860 2.370 2.182 2.505 . 0 0 "[ . 1 . 2]" 1
906 1 42 CYS H 1 42 CYS HB3 . . 3.690 3.192 2.204 3.612 . 0 0 "[ . 1 . 2]" 1
907 1 42 CYS H 1 43 MET H . . 3.380 2.784 2.676 2.920 . 0 0 "[ . 1 . 2]" 1
908 1 42 CYS H 1 43 MET QG . . 4.840 4.344 4.035 4.648 . 0 0 "[ . 1 . 2]" 1
909 1 42 CYS H 1 44 LYS H . . 4.720 4.416 4.231 4.524 . 0 0 "[ . 1 . 2]" 1
910 1 42 CYS H 1 49 LEU MD2 . . 4.560 4.274 4.019 4.476 . 0 0 "[ . 1 . 2]" 1
911 1 42 CYS H 1 76 LEU MD1 . . 5.060 4.645 4.513 4.805 . 0 0 "[ . 1 . 2]" 1
912 1 42 CYS H 1 84 ILE MD . . 4.690 4.100 3.740 4.445 . 0 0 "[ . 1 . 2]" 1
913 1 42 CYS HA 1 43 MET QG . . 5.410 5.235 4.980 5.412 0.002 10 0 "[ . 1 . 2]" 1
914 1 42 CYS HA 1 44 LYS H . . 4.720 4.464 4.237 4.619 . 0 0 "[ . 1 . 2]" 1
915 1 42 CYS HA 1 45 ILE H . . 4.120 3.646 3.428 3.802 . 0 0 "[ . 1 . 2]" 1
916 1 42 CYS HA 1 45 ILE HB . . 3.980 3.492 3.064 3.945 . 0 0 "[ . 1 . 2]" 1
917 1 42 CYS HA 1 45 ILE MD . . 5.220 4.853 4.636 5.021 . 0 0 "[ . 1 . 2]" 1
918 1 42 CYS HA 1 45 ILE HG12 . . 3.780 3.393 3.134 3.593 . 0 0 "[ . 1 . 2]" 1
919 1 42 CYS HA 1 46 HIS H . . 4.950 3.962 3.730 4.295 . 0 0 "[ . 1 . 2]" 1
920 1 42 CYS HA 1 49 LEU HB3 . . 4.330 3.796 3.510 4.225 . 0 0 "[ . 1 . 2]" 1
921 1 42 CYS HA 1 49 LEU MD1 . . 4.790 4.677 4.395 4.790 . 0 0 "[ . 1 . 2]" 1
922 1 42 CYS HA 1 49 LEU MD2 . . 3.070 2.026 1.904 2.284 . 0 0 "[ . 1 . 2]" 1
923 1 42 CYS HA 1 49 LEU HG . . 4.290 3.782 3.409 4.105 . 0 0 "[ . 1 . 2]" 1
924 1 42 CYS HA 1 50 ILE MD . . 5.500 5.301 5.041 5.487 . 0 0 "[ . 1 . 2]" 1
925 1 42 CYS HA 1 84 ILE MD . . 4.540 3.902 3.521 4.263 . 0 0 "[ . 1 . 2]" 1
926 1 42 CYS QB 1 43 MET ME . . 4.900 3.313 2.473 4.126 . 0 0 "[ . 1 . 2]" 1
927 1 42 CYS QB 1 49 LEU H . . 5.340 4.265 3.810 4.809 . 0 0 "[ . 1 . 2]" 1
928 1 42 CYS QB 1 49 LEU HB2 . . 5.340 3.951 3.527 4.242 . 0 0 "[ . 1 . 2]" 1
929 1 42 CYS QB 1 49 LEU HB3 . . 3.880 2.456 2.022 2.719 . 0 0 "[ . 1 . 2]" 1
930 1 42 CYS QB 1 49 LEU MD1 . . 5.340 3.970 3.657 4.194 . 0 0 "[ . 1 . 2]" 1
931 1 42 CYS QB 1 49 LEU MD2 . . 3.590 2.468 2.018 2.789 . 0 0 "[ . 1 . 2]" 1
932 1 42 CYS QB 1 50 ILE HA . . 4.170 3.226 2.951 3.438 . 0 0 "[ . 1 . 2]" 1
933 1 42 CYS QB 1 50 ILE MD . . 3.440 2.890 2.625 3.157 . 0 0 "[ . 1 . 2]" 1
934 1 42 CYS QB 1 50 ILE QG . . 5.320 4.378 4.039 4.699 . 0 0 "[ . 1 . 2]" 1
935 1 42 CYS QB 1 50 ILE MG . . 4.730 4.141 3.764 4.509 . 0 0 "[ . 1 . 2]" 1
936 1 42 CYS HB2 1 43 MET H . . 4.010 3.176 2.707 3.957 . 0 0 "[ . 1 . 2]" 1
937 1 42 CYS HB2 1 43 MET QG . . 5.030 3.911 3.399 4.838 . 0 0 "[ . 1 . 2]" 1
938 1 42 CYS HB2 1 49 LEU HB3 . . 4.490 3.616 2.030 4.373 . 0 0 "[ . 1 . 2]" 1
939 1 42 CYS HB2 1 49 LEU MD2 . . 4.240 3.389 2.056 4.107 . 0 0 "[ . 1 . 2]" 1
940 1 42 CYS HB2 1 49 LEU HG . . 4.320 3.625 2.099 4.319 . 0 0 "[ . 1 . 2]" 1
941 1 42 CYS HB2 1 50 ILE H . . 4.500 3.664 2.881 4.204 . 0 0 "[ . 1 . 2]" 1
942 1 42 CYS HB2 1 50 ILE HA . . 4.800 3.779 3.319 4.120 . 0 0 "[ . 1 . 2]" 1
943 1 42 CYS HB2 1 50 ILE HB . . 4.130 3.252 2.804 3.723 . 0 0 "[ . 1 . 2]" 1
944 1 42 CYS HB2 1 50 ILE MD . . 4.040 3.178 2.732 3.920 . 0 0 "[ . 1 . 2]" 1
945 1 42 CYS HB2 1 50 ILE MG . . 5.390 4.620 4.257 4.839 . 0 0 "[ . 1 . 2]" 1
946 1 42 CYS HB2 1 84 ILE MD . . 4.930 4.562 4.003 4.896 . 0 0 "[ . 1 . 2]" 1
947 1 42 CYS HB2 1 84 ILE MG . . 5.500 4.982 4.059 5.492 . 0 0 "[ . 1 . 2]" 1
948 1 42 CYS HB3 1 43 MET H . . 4.010 3.735 3.588 3.991 . 0 0 "[ . 1 . 2]" 1
949 1 42 CYS HB3 1 43 MET QG . . 5.030 4.596 4.239 4.948 . 0 0 "[ . 1 . 2]" 1
950 1 42 CYS HB3 1 49 LEU HB3 . . 4.490 2.999 2.070 4.484 . 0 0 "[ . 1 . 2]" 1
951 1 42 CYS HB3 1 49 LEU MD2 . . 4.240 2.760 2.316 3.244 . 0 0 "[ . 1 . 2]" 1
952 1 42 CYS HB3 1 49 LEU HG . . 4.320 2.884 2.047 4.064 . 0 0 "[ . 1 . 2]" 1
953 1 42 CYS HB3 1 50 ILE H . . 4.500 3.365 2.588 4.467 . 0 0 "[ . 1 . 2]" 1
954 1 42 CYS HB3 1 50 ILE HA . . 4.800 3.573 3.091 4.060 . 0 0 "[ . 1 . 2]" 1
955 1 42 CYS HB3 1 50 ILE HB . . 4.130 3.513 3.054 4.071 . 0 0 "[ . 1 . 2]" 1
956 1 42 CYS HB3 1 50 ILE MD . . 4.040 3.530 3.062 3.819 . 0 0 "[ . 1 . 2]" 1
957 1 42 CYS HB3 1 50 ILE MG . . 5.390 4.723 4.194 5.407 0.017 1 0 "[ . 1 . 2]" 1
958 1 42 CYS HB3 1 84 ILE MD . . 4.930 4.274 3.327 4.785 . 0 0 "[ . 1 . 2]" 1
959 1 42 CYS HB3 1 84 ILE MG . . 5.500 4.442 4.068 4.889 . 0 0 "[ . 1 . 2]" 1
960 1 43 MET H 1 43 MET HB2 . . 3.100 2.459 2.354 2.584 . 0 0 "[ . 1 . 2]" 1
961 1 43 MET H 1 43 MET HB3 . . 3.780 3.586 3.568 3.604 . 0 0 "[ . 1 . 2]" 1
962 1 43 MET H 1 43 MET ME . . 4.410 3.514 3.017 3.703 . 0 0 "[ . 1 . 2]" 1
963 1 43 MET H 1 43 MET QG . . 3.030 2.241 2.006 2.436 . 0 0 "[ . 1 . 2]" 1
964 1 43 MET H 1 44 LYS H . . 3.240 2.676 2.456 2.767 . 0 0 "[ . 1 . 2]" 1
965 1 43 MET H 1 45 ILE H . . 4.360 4.161 3.993 4.358 . 0 0 "[ . 1 . 2]" 1
966 1 43 MET H 1 45 ILE HG12 . . 5.500 5.444 5.261 5.504 0.004 6 0 "[ . 1 . 2]" 1
967 1 43 MET H 1 50 ILE MD . . 5.200 5.040 4.610 5.188 . 0 0 "[ . 1 . 2]" 1
968 1 43 MET HA 1 43 MET ME . . 3.780 3.030 2.746 3.297 . 0 0 "[ . 1 . 2]" 1
969 1 43 MET HA 1 43 MET QG . . 3.540 2.806 2.674 2.935 . 0 0 "[ . 1 . 2]" 1
970 1 43 MET HA 1 45 ILE H . . 4.480 4.070 3.742 4.428 . 0 0 "[ . 1 . 2]" 1
971 1 43 MET HA 1 46 HIS H . . 4.120 3.781 3.415 4.108 . 0 0 "[ . 1 . 2]" 1
972 1 43 MET HA 1 47 LYS HA . . 3.750 2.612 2.212 2.886 . 0 0 "[ . 1 . 2]" 1
973 1 43 MET HB2 1 44 LYS H . . 3.710 2.556 2.462 2.771 . 0 0 "[ . 1 . 2]" 1
974 1 43 MET HB2 1 45 ILE H . . 5.210 4.961 4.796 5.152 . 0 0 "[ . 1 . 2]" 1
975 1 43 MET HB3 1 44 LYS H . . 3.720 3.557 3.348 3.709 . 0 0 "[ . 1 . 2]" 1
976 1 43 MET HB3 1 47 LYS HA . . 4.250 4.087 3.762 4.252 0.002 6 0 "[ . 1 . 2]" 1
977 1 43 MET ME 1 44 LYS H . . 5.500 5.418 4.988 5.506 0.006 6 0 "[ . 1 . 2]" 1
978 1 43 MET ME 1 47 LYS HA . . 3.460 2.758 2.059 3.215 . 0 0 "[ . 1 . 2]" 1
979 1 43 MET ME 1 50 ILE MD . . 4.150 3.492 2.708 4.082 . 0 0 "[ . 1 . 2]" 1
980 1 43 MET ME 1 50 ILE QG . . 4.140 3.546 3.021 4.094 . 0 0 "[ . 1 . 2]" 1
981 1 43 MET ME 1 50 ILE MG . . 3.260 2.278 1.944 2.723 . 0 0 "[ . 1 . 2]" 1
982 1 43 MET ME 1 51 LYS H . . 5.500 4.679 4.299 5.137 . 0 0 "[ . 1 . 2]" 1
983 1 43 MET QG 1 44 LYS H . . 4.170 4.031 3.889 4.159 . 0 0 "[ . 1 . 2]" 1
984 1 43 MET QG 1 47 LYS HA . . 4.670 4.142 3.537 4.587 . 0 0 "[ . 1 . 2]" 1
985 1 43 MET QG 1 47 LYS QB . . 5.340 5.112 4.565 5.341 0.001 11 0 "[ . 1 . 2]" 1
986 1 43 MET QG 1 50 ILE HB . . 4.930 4.305 4.161 4.462 . 0 0 "[ . 1 . 2]" 1
987 1 43 MET QG 1 50 ILE MD . . 4.780 4.496 4.055 4.773 . 0 0 "[ . 1 . 2]" 1
988 1 43 MET QG 1 50 ILE QG . . 5.500 5.355 5.134 5.507 0.007 1 0 "[ . 1 . 2]" 1
989 1 43 MET QG 1 50 ILE MG . . 4.940 4.588 4.238 4.905 . 0 0 "[ . 1 . 2]" 1
990 1 44 LYS H 1 44 LYS HB2 . . 3.310 2.291 2.208 2.391 . 0 0 "[ . 1 . 2]" 1
991 1 44 LYS H 1 44 LYS HB3 . . 3.650 3.547 3.509 3.581 . 0 0 "[ . 1 . 2]" 1
992 1 44 LYS H 1 44 LYS QD . . 4.520 4.021 3.751 4.227 . 0 0 "[ . 1 . 2]" 1
993 1 44 LYS H 1 44 LYS HG2 . . 4.250 2.656 2.383 2.839 . 0 0 "[ . 1 . 2]" 1
994 1 44 LYS H 1 44 LYS QG . . 3.520 2.595 2.352 2.761 . 0 0 "[ . 1 . 2]" 1
995 1 44 LYS H 1 44 LYS HG3 . . 4.250 3.674 3.547 3.828 . 0 0 "[ . 1 . 2]" 1
996 1 44 LYS H 1 45 ILE MD . . 4.870 4.573 4.095 4.841 . 0 0 "[ . 1 . 2]" 1
997 1 44 LYS H 1 46 HIS H . . 4.930 4.820 4.479 4.933 0.003 15 0 "[ . 1 . 2]" 1
998 1 44 LYS HA 1 44 LYS HD2 . . 3.490 2.702 2.014 3.452 . 0 0 "[ . 1 . 2]" 1
999 1 44 LYS HA 1 44 LYS QD . . 3.040 2.238 1.999 2.487 . 0 0 "[ . 1 . 2]" 1
1000 1 44 LYS HA 1 44 LYS HD3 . . 3.490 2.826 2.199 3.477 . 0 0 "[ . 1 . 2]" 1
1001 1 44 LYS HA 1 44 LYS QE . . 4.660 4.028 3.628 4.318 . 0 0 "[ . 1 . 2]" 1
1002 1 44 LYS HA 1 44 LYS HG2 . . 3.960 2.595 2.401 2.823 . 0 0 "[ . 1 . 2]" 1
1003 1 44 LYS HA 1 44 LYS QG . . 3.430 2.542 2.368 2.742 . 0 0 "[ . 1 . 2]" 1
1004 1 44 LYS HA 1 44 LYS HG3 . . 3.960 3.658 3.615 3.722 . 0 0 "[ . 1 . 2]" 1
1005 1 44 LYS HA 1 45 ILE MD . . 4.650 4.308 3.784 4.640 . 0 0 "[ . 1 . 2]" 1
1006 1 44 LYS HB2 1 44 LYS QE . . 5.000 3.890 3.351 4.322 . 0 0 "[ . 1 . 2]" 1
1007 1 44 LYS HB2 1 45 ILE H . . 3.580 2.868 2.670 3.030 . 0 0 "[ . 1 . 2]" 1
1008 1 44 LYS HB2 1 45 ILE MD . . 4.780 3.165 2.634 3.578 . 0 0 "[ . 1 . 2]" 1
1009 1 44 LYS HB3 1 44 LYS QE . . 4.540 3.139 2.053 3.951 . 0 0 "[ . 1 . 2]" 1
1010 1 44 LYS HB3 1 45 ILE H . . 4.000 3.456 3.108 3.792 . 0 0 "[ . 1 . 2]" 1
1011 1 44 LYS HB3 1 45 ILE HA . . 4.550 4.198 4.014 4.398 . 0 0 "[ . 1 . 2]" 1
1012 1 44 LYS HB3 1 45 ILE MD . . 4.050 2.701 2.162 3.149 . 0 0 "[ . 1 . 2]" 1
1013 1 44 LYS QE 1 44 LYS HG2 . . 3.900 2.914 2.490 3.287 . 0 0 "[ . 1 . 2]" 1
1014 1 44 LYS QE 1 44 LYS QG . . 3.230 2.158 2.033 2.280 . 0 0 "[ . 1 . 2]" 1
1015 1 44 LYS QE 1 44 LYS HG3 . . 3.900 2.240 2.103 2.330 . 0 0 "[ . 1 . 2]" 1
1016 1 44 LYS QG 1 45 ILE H . . 4.830 4.352 4.232 4.420 . 0 0 "[ . 1 . 2]" 1
1017 1 44 LYS QG 1 45 ILE MD . . 5.180 4.343 3.902 4.691 . 0 0 "[ . 1 . 2]" 1
1018 1 44 LYS HG2 1 45 ILE H . . 5.500 4.720 4.529 4.793 . 0 0 "[ . 1 . 2]" 1
1019 1 44 LYS HG3 1 45 ILE H . . 5.500 5.105 4.938 5.212 . 0 0 "[ . 1 . 2]" 1
1020 1 45 ILE H 1 45 ILE HB . . 3.000 2.600 2.484 2.713 . 0 0 "[ . 1 . 2]" 1
1021 1 45 ILE H 1 45 ILE MD . . 3.820 2.815 2.385 3.196 . 0 0 "[ . 1 . 2]" 1
1022 1 45 ILE H 1 45 ILE HG12 . . 3.080 2.335 2.147 2.519 . 0 0 "[ . 1 . 2]" 1
1023 1 45 ILE H 1 45 ILE HG13 . . 4.230 3.809 3.670 3.950 . 0 0 "[ . 1 . 2]" 1
1024 1 45 ILE H 1 45 ILE MG . . 3.830 3.795 3.769 3.837 0.007 12 0 "[ . 1 . 2]" 1
1025 1 45 ILE H 1 46 HIS H . . 2.990 2.696 2.552 2.884 . 0 0 "[ . 1 . 2]" 1
1026 1 45 ILE H 1 46 HIS HA . . 5.110 4.924 4.747 5.095 . 0 0 "[ . 1 . 2]" 1
1027 1 45 ILE H 1 49 LEU MD2 . . 4.600 3.946 3.624 4.222 . 0 0 "[ . 1 . 2]" 1
1028 1 45 ILE HA 1 45 ILE MD . . 2.910 2.064 1.933 2.193 . 0 0 "[ . 1 . 2]" 1
1029 1 45 ILE HA 1 45 ILE HG12 . . 3.780 3.351 3.220 3.513 . 0 0 "[ . 1 . 2]" 1
1030 1 45 ILE HA 1 45 ILE MG . . 2.920 2.314 2.226 2.428 . 0 0 "[ . 1 . 2]" 1
1031 1 45 ILE HB 1 45 ILE MD . . 3.520 3.206 3.181 3.227 . 0 0 "[ . 1 . 2]" 1
1032 1 45 ILE HB 1 46 HIS H . . 2.930 2.027 1.901 2.300 . 0 0 "[ . 1 . 2]" 1
1033 1 45 ILE HB 1 46 HIS HB2 . . 4.430 3.695 3.563 3.882 . 0 0 "[ . 1 . 2]" 1
1034 1 45 ILE HB 1 49 LEU MD2 . . 3.190 2.286 1.954 2.674 . 0 0 "[ . 1 . 2]" 1
1035 1 45 ILE MD 1 46 HIS H . . 4.680 4.330 4.192 4.437 . 0 0 "[ . 1 . 2]" 1
1036 1 45 ILE HG13 1 45 ILE MG . . 3.200 2.214 2.144 2.287 . 0 0 "[ . 1 . 2]" 1
1037 1 45 ILE MG 1 46 HIS H . . 3.420 3.076 2.818 3.392 . 0 0 "[ . 1 . 2]" 1
1038 1 45 ILE MG 1 46 HIS HA . . 4.690 4.062 3.832 4.321 . 0 0 "[ . 1 . 2]" 1
1039 1 45 ILE MG 1 46 HIS HB2 . . 3.600 2.610 2.383 2.809 . 0 0 "[ . 1 . 2]" 1
1040 1 45 ILE MG 1 46 HIS HB3 . . 4.270 3.853 3.585 4.078 . 0 0 "[ . 1 . 2]" 1
1041 1 45 ILE MG 1 46 HIS HD2 . . 4.340 4.309 4.168 4.350 0.010 6 0 "[ . 1 . 2]" 1
1042 1 46 HIS H 1 46 HIS HB2 . . 3.770 3.005 2.903 3.103 . 0 0 "[ . 1 . 2]" 1
1043 1 46 HIS H 1 46 HIS HB3 . . 3.600 3.113 3.030 3.192 . 0 0 "[ . 1 . 2]" 1
1044 1 46 HIS H 1 49 LEU HB2 . . 3.930 3.401 3.081 3.856 . 0 0 "[ . 1 . 2]" 1
1045 1 46 HIS H 1 49 LEU MD2 . . 3.790 2.838 2.589 3.240 . 0 0 "[ . 1 . 2]" 1
1046 1 46 HIS HA 1 46 HIS HD2 . . 4.530 3.348 2.760 4.367 . 0 0 "[ . 1 . 2]" 1
1047 1 46 HIS HB2 1 46 HIS HD2 . . 3.670 2.838 2.690 3.024 . 0 0 "[ . 1 . 2]" 1
1048 1 46 HIS HB2 1 49 LEU H . . 4.880 4.586 4.138 4.893 0.013 15 0 "[ . 1 . 2]" 1
1049 1 46 HIS HB2 1 49 LEU HB2 . . 4.070 3.198 2.811 3.562 . 0 0 "[ . 1 . 2]" 1
1050 1 46 HIS HB2 1 49 LEU HB3 . . 5.000 4.425 3.929 4.993 . 0 0 "[ . 1 . 2]" 1
1051 1 46 HIS HB2 1 49 LEU MD1 . . 5.260 4.490 4.142 4.944 . 0 0 "[ . 1 . 2]" 1
1052 1 46 HIS HB2 1 49 LEU MD2 . . 4.760 3.741 3.495 4.186 . 0 0 "[ . 1 . 2]" 1
1053 1 46 HIS HB3 1 49 LEU H . . 3.400 2.877 2.408 3.231 . 0 0 "[ . 1 . 2]" 1
1054 1 46 HIS HB3 1 49 LEU HB2 . . 3.840 2.060 1.993 2.507 . 0 0 "[ . 1 . 2]" 1
1055 1 46 HIS HB3 1 49 LEU HB3 . . 4.230 3.160 2.751 3.598 . 0 0 "[ . 1 . 2]" 1
1056 1 46 HIS HB3 1 49 LEU MD1 . . 5.150 3.861 3.456 4.442 . 0 0 "[ . 1 . 2]" 1
1057 1 46 HIS HB3 1 49 LEU MD2 . . 4.220 3.515 3.159 3.863 . 0 0 "[ . 1 . 2]" 1
1058 1 46 HIS HB3 1 49 LEU HG . . 5.320 4.995 4.841 5.256 . 0 0 "[ . 1 . 2]" 1
1059 1 46 HIS HB3 1 50 ILE H . . 5.170 4.987 4.767 5.166 . 0 0 "[ . 1 . 2]" 1
1060 1 46 HIS HE1 1 48 ASN QB . . 3.500 2.567 2.246 3.317 . 0 0 "[ . 1 . 2]" 1
1061 1 48 ASN H 1 49 LEU H . . 4.720 2.640 1.814 2.884 . 0 0 "[ . 1 . 2]" 1
1062 1 48 ASN HA 1 50 ILE H . . 4.990 4.187 3.671 4.490 . 0 0 "[ . 1 . 2]" 1
1063 1 48 ASN HA 1 50 ILE MG . . 4.820 3.453 3.156 3.689 . 0 0 "[ . 1 . 2]" 1
1064 1 48 ASN HA 1 51 LYS H . . 4.140 3.641 3.273 3.893 . 0 0 "[ . 1 . 2]" 1
1065 1 48 ASN HA 1 51 LYS QD . . 4.680 3.367 1.978 4.114 . 0 0 "[ . 1 . 2]" 1
1066 1 48 ASN HA 1 51 LYS QG . . 4.650 2.818 1.998 4.048 . 0 0 "[ . 1 . 2]" 1
1067 1 48 ASN QB 1 51 LYS H . . 5.340 4.798 4.268 5.321 . 0 0 "[ . 1 . 2]" 1
1068 1 48 ASN QB 1 51 LYS HB2 . . 5.200 4.116 3.398 4.921 . 0 0 "[ . 1 . 2]" 1
1069 1 48 ASN QB 1 51 LYS QD . . 4.220 3.738 2.824 4.232 0.012 1 0 "[ . 1 . 2]" 1
1070 1 48 ASN QB 1 51 LYS QG . . 4.750 3.960 2.652 4.763 0.013 10 0 "[ . 1 . 2]" 1
1071 1 48 ASN HB2 1 49 LEU H . . 4.870 4.103 3.094 4.641 . 0 0 "[ . 1 . 2]" 1
1072 1 48 ASN HB3 1 49 LEU H . . 4.870 4.030 2.923 4.552 . 0 0 "[ . 1 . 2]" 1
1073 1 48 ASN HD21 1 49 LEU H . . 5.100 4.605 2.587 5.104 0.004 6 0 "[ . 1 . 2]" 1
1074 1 49 LEU H 1 49 LEU HB2 . . 3.060 2.784 2.367 3.052 . 0 0 "[ . 1 . 2]" 1
1075 1 49 LEU H 1 49 LEU HB3 . . 3.120 2.413 2.261 2.692 . 0 0 "[ . 1 . 2]" 1
1076 1 49 LEU H 1 49 LEU MD1 . . 4.410 4.145 3.837 4.311 . 0 0 "[ . 1 . 2]" 1
1077 1 49 LEU H 1 49 LEU MD2 . . 4.440 4.246 4.167 4.333 . 0 0 "[ . 1 . 2]" 1
1078 1 49 LEU H 1 49 LEU HG . . 4.580 4.348 4.156 4.589 0.009 6 0 "[ . 1 . 2]" 1
1079 1 49 LEU H 1 50 ILE H . . 3.510 2.553 2.117 3.136 . 0 0 "[ . 1 . 2]" 1
1080 1 49 LEU H 1 50 ILE MG . . 4.260 3.761 3.346 4.255 . 0 0 "[ . 1 . 2]" 1
1081 1 49 LEU H 1 51 LYS H . . 4.640 3.933 3.711 4.400 . 0 0 "[ . 1 . 2]" 1
1082 1 49 LEU HA 1 49 LEU MD1 . . 2.910 2.110 1.966 2.365 . 0 0 "[ . 1 . 2]" 1
1083 1 49 LEU HA 1 49 LEU MD2 . . 3.920 3.861 3.736 3.926 0.006 2 0 "[ . 1 . 2]" 1
1084 1 49 LEU HA 1 49 LEU HG . . 4.130 3.358 3.119 3.495 . 0 0 "[ . 1 . 2]" 1
1085 1 49 LEU HA 1 52 GLU H . . 3.790 3.276 3.148 3.397 . 0 0 "[ . 1 . 2]" 1
1086 1 49 LEU HA 1 52 GLU HB2 . . 4.270 3.439 3.084 3.754 . 0 0 "[ . 1 . 2]" 1
1087 1 49 LEU HA 1 52 GLU HB3 . . 5.400 5.085 4.778 5.404 0.004 1 0 "[ . 1 . 2]" 1
1088 1 49 LEU HA 1 52 GLU HG2 . . 4.040 3.563 3.152 3.820 . 0 0 "[ . 1 . 2]" 1
1089 1 49 LEU HA 1 52 GLU HG3 . . 4.530 3.839 3.458 4.105 . 0 0 "[ . 1 . 2]" 1
1090 1 49 LEU HB2 1 49 LEU MD2 . . 3.250 2.252 2.126 2.377 . 0 0 "[ . 1 . 2]" 1
1091 1 49 LEU HB2 1 50 ILE H . . 4.330 3.879 3.645 4.159 . 0 0 "[ . 1 . 2]" 1
1092 1 49 LEU HB3 1 49 LEU MD2 . . 3.280 2.396 2.278 2.554 . 0 0 "[ . 1 . 2]" 1
1093 1 49 LEU HB3 1 50 ILE H . . 3.660 2.515 2.190 2.964 . 0 0 "[ . 1 . 2]" 1
1094 1 49 LEU HB3 1 50 ILE MG . . 5.290 4.521 4.308 4.767 . 0 0 "[ . 1 . 2]" 1
1095 1 49 LEU HB3 1 84 ILE MG . . 5.470 4.774 4.492 5.101 . 0 0 "[ . 1 . 2]" 1
1096 1 49 LEU MD1 1 50 ILE H . . 5.120 4.168 3.907 4.388 . 0 0 "[ . 1 . 2]" 1
1097 1 49 LEU MD1 1 50 ILE HA . . 5.450 4.297 3.880 4.831 . 0 0 "[ . 1 . 2]" 1
1098 1 49 LEU MD1 1 51 LYS H . . 5.220 4.783 4.389 5.215 . 0 0 "[ . 1 . 2]" 1
1099 1 49 LEU MD1 1 52 GLU H . . 4.310 3.670 3.319 4.085 . 0 0 "[ . 1 . 2]" 1
1100 1 49 LEU MD1 1 52 GLU HB2 . . 4.160 2.776 2.567 3.058 . 0 0 "[ . 1 . 2]" 1
1101 1 49 LEU MD1 1 52 GLU HG2 . . 4.640 4.197 3.908 4.510 . 0 0 "[ . 1 . 2]" 1
1102 1 49 LEU MD1 1 52 GLU HG3 . . 4.670 4.023 3.626 4.280 . 0 0 "[ . 1 . 2]" 1
1103 1 49 LEU MD1 1 53 PHE H . . 4.420 3.371 2.703 4.036 . 0 0 "[ . 1 . 2]" 1
1104 1 49 LEU MD1 1 53 PHE HA . . 4.120 3.403 2.817 3.944 . 0 0 "[ . 1 . 2]" 1
1105 1 49 LEU MD1 1 53 PHE QD . . 4.690 4.170 3.728 4.644 . 0 0 "[ . 1 . 2]" 1
1106 1 49 LEU MD1 1 84 ILE HB . . 5.490 4.195 3.664 4.983 . 0 0 "[ . 1 . 2]" 1
1107 1 49 LEU MD1 1 86 LYS HE2 . . 3.550 2.333 1.850 3.250 . 0 0 "[ . 1 . 2]" 1
1108 1 49 LEU MD1 1 86 LYS QE . . 3.040 2.148 1.798 2.787 . 0 0 "[ . 1 . 2]" 1
1109 1 49 LEU MD1 1 86 LYS HE3 . . 3.550 2.950 1.881 3.550 0.000 15 0 "[ . 1 . 2]" 1
1110 1 49 LEU MD2 1 50 ILE H . . 4.750 4.231 3.938 4.577 . 0 0 "[ . 1 . 2]" 1
1111 1 49 LEU MD2 1 50 ILE HA . . 5.120 4.722 4.494 5.017 . 0 0 "[ . 1 . 2]" 1
1112 1 49 LEU MD2 1 50 ILE MD . . 5.240 5.049 4.685 5.241 0.001 2 0 "[ . 1 . 2]" 1
1113 1 49 LEU MD2 1 53 PHE QD . . 5.090 4.529 4.014 4.860 . 0 0 "[ . 1 . 2]" 1
1114 1 49 LEU MD2 1 84 ILE HB . . 4.340 3.663 3.291 4.062 . 0 0 "[ . 1 . 2]" 1
1115 1 49 LEU MD2 1 84 ILE QG . . 4.130 2.942 2.600 3.628 . 0 0 "[ . 1 . 2]" 1
1116 1 49 LEU MD2 1 84 ILE MG . . 3.390 2.121 1.947 2.323 . 0 0 "[ . 1 . 2]" 1
1117 1 49 LEU HG 1 50 ILE H . . 4.540 3.400 2.958 3.762 . 0 0 "[ . 1 . 2]" 1
1118 1 49 LEU HG 1 50 ILE HA . . 4.560 3.455 3.126 3.818 . 0 0 "[ . 1 . 2]" 1
1119 1 49 LEU HG 1 52 GLU H . . 5.500 4.909 4.661 5.201 . 0 0 "[ . 1 . 2]" 1
1120 1 49 LEU HG 1 53 PHE H . . 4.630 4.125 3.649 4.436 . 0 0 "[ . 1 . 2]" 1
1121 1 49 LEU HG 1 53 PHE HB3 . . 4.950 4.083 3.709 4.387 . 0 0 "[ . 1 . 2]" 1
1122 1 49 LEU HG 1 53 PHE QD . . 4.890 4.362 3.873 4.660 . 0 0 "[ . 1 . 2]" 1
1123 1 49 LEU HG 1 84 ILE MG . . 3.450 2.991 2.555 3.430 . 0 0 "[ . 1 . 2]" 1
1124 1 49 LEU HG 1 86 LYS QE . . 5.340 4.730 4.155 5.341 0.001 5 0 "[ . 1 . 2]" 1
1125 1 50 ILE H 1 50 ILE HB . . 3.090 2.398 2.311 2.572 . 0 0 "[ . 1 . 2]" 1
1126 1 50 ILE H 1 50 ILE MD . . 4.200 3.929 3.802 4.153 . 0 0 "[ . 1 . 2]" 1
1127 1 50 ILE H 1 50 ILE QG . . 4.170 4.077 4.040 4.099 . 0 0 "[ . 1 . 2]" 1
1128 1 50 ILE H 1 50 ILE MG . . 3.150 2.379 2.007 2.548 . 0 0 "[ . 1 . 2]" 1
1129 1 50 ILE H 1 51 LYS H . . 3.470 2.816 2.552 2.971 . 0 0 "[ . 1 . 2]" 1
1130 1 50 ILE H 1 52 GLU H . . 4.650 4.381 4.160 4.569 . 0 0 "[ . 1 . 2]" 1
1131 1 50 ILE HA 1 50 ILE MD . . 2.910 2.168 2.001 2.318 . 0 0 "[ . 1 . 2]" 1
1132 1 50 ILE HA 1 50 ILE QG . . 3.540 2.664 2.537 2.805 . 0 0 "[ . 1 . 2]" 1
1133 1 50 ILE HA 1 50 ILE MG . . 3.490 3.193 3.183 3.201 . 0 0 "[ . 1 . 2]" 1
1134 1 50 ILE HA 1 52 GLU H . . 4.780 4.294 4.015 4.515 . 0 0 "[ . 1 . 2]" 1
1135 1 50 ILE HA 1 53 PHE H . . 3.590 3.200 3.048 3.326 . 0 0 "[ . 1 . 2]" 1
1136 1 50 ILE HA 1 53 PHE HA . . 4.950 4.685 4.472 4.917 . 0 0 "[ . 1 . 2]" 1
1137 1 50 ILE HA 1 53 PHE HB2 . . 3.840 2.761 2.515 3.043 . 0 0 "[ . 1 . 2]" 1
1138 1 50 ILE HA 1 53 PHE HB3 . . 3.290 2.107 1.999 2.337 . 0 0 "[ . 1 . 2]" 1
1139 1 50 ILE HA 1 53 PHE QD . . 4.560 3.700 3.353 4.002 . 0 0 "[ . 1 . 2]" 1
1140 1 50 ILE HB 1 50 ILE MD . . 3.220 2.291 2.183 2.368 . 0 0 "[ . 1 . 2]" 1
1141 1 50 ILE HB 1 51 LYS H . . 4.600 3.941 3.755 4.041 . 0 0 "[ . 1 . 2]" 1
1142 1 50 ILE MD 1 51 LYS H . . 4.860 4.794 4.636 4.870 0.010 1 0 "[ . 1 . 2]" 1
1143 1 50 ILE MD 1 53 PHE H . . 4.960 4.616 4.319 4.815 . 0 0 "[ . 1 . 2]" 1
1144 1 50 ILE MD 1 53 PHE HB2 . . 4.060 3.602 3.210 3.891 . 0 0 "[ . 1 . 2]" 1
1145 1 50 ILE MD 1 53 PHE HB3 . . 3.190 2.855 2.463 3.045 . 0 0 "[ . 1 . 2]" 1
1146 1 50 ILE MD 1 53 PHE QD . . 3.700 2.880 2.112 3.359 . 0 0 "[ . 1 . 2]" 1
1147 1 50 ILE MD 1 72 LYS H . . 5.500 4.790 4.392 5.094 . 0 0 "[ . 1 . 2]" 1
1148 1 50 ILE MD 1 72 LYS HB2 . . 3.810 2.084 1.952 2.301 . 0 0 "[ . 1 . 2]" 1
1149 1 50 ILE MD 1 72 LYS HB3 . . 3.830 2.419 2.042 2.771 . 0 0 "[ . 1 . 2]" 1
1150 1 50 ILE MD 1 72 LYS QD . . 3.890 2.912 2.177 3.891 0.001 1 0 "[ . 1 . 2]" 1
1151 1 50 ILE MD 1 72 LYS QE . . 4.670 3.961 2.276 4.599 . 0 0 "[ . 1 . 2]" 1
1152 1 50 ILE MD 1 72 LYS QG . . 4.420 3.304 2.446 3.735 . 0 0 "[ . 1 . 2]" 1
1153 1 50 ILE QG 1 50 ILE MG . . 3.080 2.095 2.032 2.122 . 0 0 "[ . 1 . 2]" 1
1154 1 50 ILE QG 1 51 LYS H . . 4.990 3.961 3.708 4.164 . 0 0 "[ . 1 . 2]" 1
1155 1 50 ILE QG 1 52 GLU H . . 5.500 5.367 5.087 5.495 . 0 0 "[ . 1 . 2]" 1
1156 1 50 ILE QG 1 53 PHE H . . 4.880 4.643 4.346 4.841 . 0 0 "[ . 1 . 2]" 1
1157 1 50 ILE QG 1 53 PHE HB2 . . 5.500 4.803 4.518 5.150 . 0 0 "[ . 1 . 2]" 1
1158 1 50 ILE QG 1 53 PHE HB3 . . 4.600 3.487 3.235 3.725 . 0 0 "[ . 1 . 2]" 1
1159 1 50 ILE QG 1 72 LYS QE . . 4.950 4.225 2.973 4.942 . 0 0 "[ . 1 . 2]" 1
1160 1 50 ILE MG 1 51 LYS H . . 3.190 2.126 1.868 2.466 . 0 0 "[ . 1 . 2]" 1
1161 1 50 ILE MG 1 51 LYS HA . . 3.910 3.110 2.988 3.331 . 0 0 "[ . 1 . 2]" 1
1162 1 50 ILE MG 1 51 LYS HB2 . . 4.560 3.929 3.713 4.262 . 0 0 "[ . 1 . 2]" 1
1163 1 50 ILE MG 1 51 LYS HB3 . . 4.660 4.419 4.211 4.546 . 0 0 "[ . 1 . 2]" 1
1164 1 50 ILE MG 1 51 LYS QD . . 4.410 3.788 1.750 4.301 . 0 0 "[ . 1 . 2]" 1
1165 1 50 ILE MG 1 51 LYS QE . . 4.050 3.689 2.713 4.046 . 0 0 "[ . 1 . 2]" 1
1166 1 50 ILE MG 1 51 LYS QG . . 3.670 2.462 2.218 3.088 . 0 0 "[ . 1 . 2]" 1
1167 1 50 ILE MG 1 52 GLU H . . 4.430 4.307 4.133 4.429 . 0 0 "[ . 1 . 2]" 1
1168 1 50 ILE MG 1 53 PHE H . . 5.270 4.683 4.507 4.962 . 0 0 "[ . 1 . 2]" 1
1169 1 50 ILE MG 1 53 PHE HB3 . . 5.090 4.570 4.426 4.740 . 0 0 "[ . 1 . 2]" 1
1170 1 51 LYS H 1 51 LYS HB2 . . 3.000 2.500 2.329 2.626 . 0 0 "[ . 1 . 2]" 1
1171 1 51 LYS H 1 51 LYS HB3 . . 3.770 3.590 3.568 3.611 . 0 0 "[ . 1 . 2]" 1
1172 1 51 LYS H 1 51 LYS QD . . 4.140 3.807 1.832 4.140 0.000 11 0 "[ . 1 . 2]" 1
1173 1 51 LYS H 1 51 LYS QE . . 5.500 4.432 3.146 4.942 . 0 0 "[ . 1 . 2]" 1
1174 1 51 LYS H 1 51 LYS HG2 . . 3.790 3.127 2.162 3.901 0.111 10 0 "[ . 1 . 2]" 1
1175 1 51 LYS H 1 51 LYS QG . . 3.140 2.372 2.093 3.166 0.026 10 0 "[ . 1 . 2]" 1
1176 1 51 LYS H 1 51 LYS HG3 . . 3.790 2.532 2.145 3.671 . 0 0 "[ . 1 . 2]" 1
1177 1 51 LYS H 1 52 GLU H . . 3.030 2.609 2.463 2.763 . 0 0 "[ . 1 . 2]" 1
1178 1 51 LYS H 1 52 GLU HA . . 5.400 5.247 5.132 5.360 . 0 0 "[ . 1 . 2]" 1
1179 1 51 LYS H 1 52 GLU HG2 . . 4.210 4.060 3.695 4.212 0.002 10 0 "[ . 1 . 2]" 1
1180 1 51 LYS H 1 53 PHE H . . 3.970 3.697 3.580 3.948 . 0 0 "[ . 1 . 2]" 1
1181 1 51 LYS H 1 53 PHE HB3 . . 4.790 4.602 4.465 4.766 . 0 0 "[ . 1 . 2]" 1
1182 1 51 LYS HA 1 51 LYS QD . . 4.190 3.731 2.153 4.102 . 0 0 "[ . 1 . 2]" 1
1183 1 51 LYS HA 1 51 LYS QE . . 4.550 4.070 2.023 4.569 0.019 8 0 "[ . 1 . 2]" 1
1184 1 51 LYS HA 1 51 LYS HG2 . . 3.690 2.609 2.338 3.591 . 0 0 "[ . 1 . 2]" 1
1185 1 51 LYS HA 1 51 LYS QG . . 3.120 2.419 2.279 3.111 . 0 0 "[ . 1 . 2]" 1
1186 1 51 LYS HA 1 51 LYS HG3 . . 3.690 3.267 2.327 3.729 0.039 1 0 "[ . 1 . 2]" 1
1187 1 51 LYS HA 1 53 PHE H . . 4.810 4.195 3.975 4.657 . 0 0 "[ . 1 . 2]" 1
1188 1 51 LYS HB2 1 51 LYS QD . . 3.570 2.652 2.152 3.466 . 0 0 "[ . 1 . 2]" 1
1189 1 51 LYS HB2 1 51 LYS QE . . 4.260 3.879 2.109 4.263 0.003 11 0 "[ . 1 . 2]" 1
1190 1 51 LYS HB2 1 52 GLU H . . 3.400 2.671 2.495 2.922 . 0 0 "[ . 1 . 2]" 1
1191 1 51 LYS HB2 1 52 GLU HG2 . . 3.530 2.793 2.601 2.959 . 0 0 "[ . 1 . 2]" 1
1192 1 51 LYS HB3 1 51 LYS QD . . 3.560 2.346 2.055 3.269 . 0 0 "[ . 1 . 2]" 1
1193 1 51 LYS HB3 1 51 LYS QE . . 4.650 3.496 2.187 4.598 . 0 0 "[ . 1 . 2]" 1
1194 1 51 LYS HB3 1 52 GLU H . . 4.380 3.710 3.464 3.937 . 0 0 "[ . 1 . 2]" 1
1195 1 51 LYS QD 1 52 GLU H . . 5.500 4.868 3.753 5.205 . 0 0 "[ . 1 . 2]" 1
1196 1 51 LYS QG 1 52 GLU H . . 4.440 4.051 3.834 4.447 0.007 10 0 "[ . 1 . 2]" 1
1197 1 52 GLU H 1 52 GLU HB2 . . 3.660 2.680 2.579 2.837 . 0 0 "[ . 1 . 2]" 1
1198 1 52 GLU H 1 52 GLU HB3 . . 4.070 3.660 3.630 3.728 . 0 0 "[ . 1 . 2]" 1
1199 1 52 GLU H 1 52 GLU HG2 . . 3.220 2.116 1.910 2.360 . 0 0 "[ . 1 . 2]" 1
1200 1 52 GLU H 1 52 GLU HG3 . . 3.690 3.525 3.377 3.653 . 0 0 "[ . 1 . 2]" 1
1201 1 52 GLU H 1 53 PHE H . . 3.050 2.260 2.087 2.370 . 0 0 "[ . 1 . 2]" 1
1202 1 52 GLU H 1 53 PHE HA . . 4.900 4.784 4.578 4.883 . 0 0 "[ . 1 . 2]" 1
1203 1 52 GLU H 1 53 PHE HB2 . . 5.040 4.745 4.422 4.890 . 0 0 "[ . 1 . 2]" 1
1204 1 52 GLU H 1 53 PHE HB3 . . 4.410 4.297 4.153 4.406 . 0 0 "[ . 1 . 2]" 1
1205 1 52 GLU HA 1 52 GLU HG2 . . 3.750 3.120 3.032 3.224 . 0 0 "[ . 1 . 2]" 1
1206 1 52 GLU HA 1 52 GLU HG3 . . 4.080 3.889 3.836 3.972 . 0 0 "[ . 1 . 2]" 1
1207 1 52 GLU HA 1 87 LYS H . . 4.300 3.785 3.413 4.164 . 0 0 "[ . 1 . 2]" 1
1208 1 52 GLU HA 1 87 LYS QD . . 4.070 3.277 2.398 3.936 . 0 0 "[ . 1 . 2]" 1
1209 1 52 GLU HB2 1 53 PHE H . . 3.930 3.210 2.710 3.454 . 0 0 "[ . 1 . 2]" 1
1210 1 52 GLU HB2 1 86 LYS QD . . 4.040 3.166 1.879 3.632 . 0 0 "[ . 1 . 2]" 1
1211 1 52 GLU HB2 1 86 LYS QG . . 4.310 2.888 2.062 4.049 . 0 0 "[ . 1 . 2]" 1
1212 1 52 GLU HB3 1 53 PHE H . . 4.720 4.222 3.854 4.409 . 0 0 "[ . 1 . 2]" 1
1213 1 52 GLU HB3 1 86 LYS HB2 . . 5.150 4.380 3.864 4.855 . 0 0 "[ . 1 . 2]" 1
1214 1 52 GLU HB3 1 86 LYS QD . . 3.740 3.384 1.997 3.741 0.001 7 0 "[ . 1 . 2]" 1
1215 1 52 GLU HB3 1 86 LYS QG . . 4.090 3.494 2.839 4.088 . 0 0 "[ . 1 . 2]" 1
1216 1 52 GLU HB3 1 87 LYS H . . 4.260 3.570 2.939 3.883 . 0 0 "[ . 1 . 2]" 1
1217 1 52 GLU HG2 1 53 PHE H . . 5.000 4.129 3.981 4.223 . 0 0 "[ . 1 . 2]" 1
1218 1 52 GLU HG2 1 86 LYS QD . . 5.280 4.894 3.831 5.280 . 0 0 "[ . 1 . 2]" 1
1219 1 52 GLU HG3 1 53 PHE H . . 5.250 5.087 4.835 5.229 . 0 0 "[ . 1 . 2]" 1
1220 1 52 GLU HG3 1 86 LYS QD . . 4.350 3.628 2.899 3.928 . 0 0 "[ . 1 . 2]" 1
1221 1 52 GLU HG3 1 86 LYS QG . . 4.970 4.466 3.753 4.967 . 0 0 "[ . 1 . 2]" 1
1222 1 53 PHE H 1 53 PHE HB2 . . 3.430 2.799 2.674 2.937 . 0 0 "[ . 1 . 2]" 1
1223 1 53 PHE H 1 53 PHE HB3 . . 2.880 2.301 2.205 2.424 . 0 0 "[ . 1 . 2]" 1
1224 1 53 PHE H 1 53 PHE QD . . 4.260 4.071 3.950 4.169 . 0 0 "[ . 1 . 2]" 1
1225 1 53 PHE H 1 54 LYS H . . 4.700 4.496 4.408 4.585 . 0 0 "[ . 1 . 2]" 1
1226 1 53 PHE H 1 84 ILE MG . . 5.500 4.859 4.473 5.131 . 0 0 "[ . 1 . 2]" 1
1227 1 53 PHE HA 1 53 PHE QD . . 3.620 2.957 2.757 3.139 . 0 0 "[ . 1 . 2]" 1
1228 1 53 PHE HA 1 54 LYS H . . 2.920 2.146 2.138 2.187 . 0 0 "[ . 1 . 2]" 1
1229 1 53 PHE HA 1 54 LYS HA . . 4.660 4.391 4.384 4.407 . 0 0 "[ . 1 . 2]" 1
1230 1 53 PHE HA 1 54 LYS HB3 . . 4.870 4.785 4.706 4.862 . 0 0 "[ . 1 . 2]" 1
1231 1 53 PHE HA 1 55 TYR H . . 4.470 4.116 3.835 4.474 0.004 2 0 "[ . 1 . 2]" 1
1232 1 53 PHE HA 1 84 ILE MG . . 3.930 3.281 3.004 3.584 . 0 0 "[ . 1 . 2]" 1
1233 1 53 PHE HA 1 86 LYS QG . . 4.880 3.662 2.941 4.706 . 0 0 "[ . 1 . 2]" 1
1234 1 53 PHE HA 1 87 LYS H . . 4.460 4.125 3.674 4.461 0.001 1 0 "[ . 1 . 2]" 1
1235 1 53 PHE HB2 1 54 LYS H . . 4.220 4.111 3.920 4.221 0.001 1 0 "[ . 1 . 2]" 1
1236 1 53 PHE HB2 1 84 ILE MG . . 4.260 3.096 2.586 3.403 . 0 0 "[ . 1 . 2]" 1
1237 1 53 PHE HB3 1 54 LYS H . . 5.500 4.400 4.233 4.517 . 0 0 "[ . 1 . 2]" 1
1238 1 53 PHE HB3 1 84 ILE MD . . 5.450 5.012 4.314 5.451 0.001 7 0 "[ . 1 . 2]" 1
1239 1 53 PHE HB3 1 84 ILE MG . . 5.360 4.547 4.045 4.867 . 0 0 "[ . 1 . 2]" 1
1240 1 53 PHE QD 1 54 LYS H . . 4.070 3.555 3.047 3.907 . 0 0 "[ . 1 . 2]" 1
1241 1 53 PHE QD 1 54 LYS HA . . 4.850 4.281 3.897 4.635 . 0 0 "[ . 1 . 2]" 1
1242 1 53 PHE QD 1 56 ALA HA . . 5.260 4.993 4.529 5.241 . 0 0 "[ . 1 . 2]" 1
1243 1 53 PHE QD 1 84 ILE HA . . 4.790 3.298 2.913 3.718 . 0 0 "[ . 1 . 2]" 1
1244 1 53 PHE QD 1 84 ILE HB . . 5.500 4.955 4.634 5.285 . 0 0 "[ . 1 . 2]" 1
1245 1 53 PHE QD 1 84 ILE MD . . 2.940 2.308 1.975 2.884 . 0 0 "[ . 1 . 2]" 1
1246 1 53 PHE QD 1 84 ILE MG . . 3.030 2.199 2.009 2.734 . 0 0 "[ . 1 . 2]" 1
1247 1 53 PHE QD 1 85 VAL H . . 4.850 3.579 3.206 3.958 . 0 0 "[ . 1 . 2]" 1
1248 1 53 PHE QE 1 55 TYR HA . . 3.680 3.208 3.069 3.373 . 0 0 "[ . 1 . 2]" 1
1249 1 53 PHE QE 1 55 TYR HB2 . . 5.500 4.940 4.678 5.181 . 0 0 "[ . 1 . 2]" 1
1250 1 53 PHE QE 1 56 ALA H . . 4.080 3.608 3.160 3.866 . 0 0 "[ . 1 . 2]" 1
1251 1 53 PHE QE 1 56 ALA HA . . 4.690 3.329 2.898 3.734 . 0 0 "[ . 1 . 2]" 1
1252 1 53 PHE QE 1 56 ALA MB . . 3.140 2.167 1.967 2.537 . 0 0 "[ . 1 . 2]" 1
1253 1 53 PHE QE 1 71 GLY HA2 . . 4.210 2.983 2.277 3.378 . 0 0 "[ . 1 . 2]" 1
1254 1 53 PHE QE 1 71 GLY HA3 . . 4.320 3.895 3.248 4.264 . 0 0 "[ . 1 . 2]" 1
1255 1 53 PHE QE 1 72 LYS H . . 3.550 2.878 2.333 3.421 . 0 0 "[ . 1 . 2]" 1
1256 1 53 PHE QE 1 72 LYS HA . . 4.580 3.182 2.664 3.551 . 0 0 "[ . 1 . 2]" 1
1257 1 53 PHE QE 1 72 LYS HB2 . . 4.690 3.968 3.534 4.384 . 0 0 "[ . 1 . 2]" 1
1258 1 53 PHE QE 1 84 ILE HA . . 4.540 3.448 2.855 3.930 . 0 0 "[ . 1 . 2]" 1
1259 1 53 PHE QE 1 84 ILE MD . . 3.740 2.570 2.155 2.896 . 0 0 "[ . 1 . 2]" 1
1260 1 53 PHE QE 1 85 VAL H . . 4.580 3.951 3.344 4.402 . 0 0 "[ . 1 . 2]" 1
1261 1 53 PHE HZ 1 55 TYR HA . . 3.420 2.742 2.561 2.914 . 0 0 "[ . 1 . 2]" 1
1262 1 53 PHE HZ 1 55 TYR HB2 . . 5.000 4.743 4.434 4.923 . 0 0 "[ . 1 . 2]" 1
1263 1 53 PHE HZ 1 55 TYR HB3 . . 5.330 5.144 4.963 5.301 . 0 0 "[ . 1 . 2]" 1
1264 1 53 PHE HZ 1 56 ALA H . . 3.750 3.330 2.942 3.627 . 0 0 "[ . 1 . 2]" 1
1265 1 53 PHE HZ 1 56 ALA HA . . 5.500 4.771 4.245 5.099 . 0 0 "[ . 1 . 2]" 1
1266 1 53 PHE HZ 1 56 ALA MB . . 3.800 2.698 2.241 3.056 . 0 0 "[ . 1 . 2]" 1
1267 1 53 PHE HZ 1 70 VAL MG2 . . 4.570 3.438 3.175 3.770 . 0 0 "[ . 1 . 2]" 1
1268 1 53 PHE HZ 1 71 GLY HA2 . . 4.180 2.870 2.484 3.372 . 0 0 "[ . 1 . 2]" 1
1269 1 53 PHE HZ 1 71 GLY HA3 . . 4.700 4.240 3.866 4.705 0.005 14 0 "[ . 1 . 2]" 1
1270 1 53 PHE HZ 1 72 LYS H . . 4.730 4.101 3.279 4.595 . 0 0 "[ . 1 . 2]" 1
1271 1 53 PHE HZ 1 72 LYS HA . . 4.210 3.471 3.112 4.109 . 0 0 "[ . 1 . 2]" 1
1272 1 53 PHE HZ 1 72 LYS HB3 . . 4.800 4.201 3.794 4.743 . 0 0 "[ . 1 . 2]" 1
1273 1 53 PHE HZ 1 84 ILE MD . . 4.800 4.459 3.963 4.746 . 0 0 "[ . 1 . 2]" 1
1274 1 54 LYS H 1 54 LYS HB2 . . 3.570 2.652 2.486 2.882 . 0 0 "[ . 1 . 2]" 1
1275 1 54 LYS H 1 54 LYS HB3 . . 3.350 2.682 2.596 2.747 . 0 0 "[ . 1 . 2]" 1
1276 1 54 LYS H 1 54 LYS HD3 . . 5.060 4.837 4.753 4.932 . 0 0 "[ . 1 . 2]" 1
1277 1 54 LYS H 1 54 LYS HG2 . . 4.750 4.530 4.479 4.584 . 0 0 "[ . 1 . 2]" 1
1278 1 54 LYS H 1 55 TYR H . . 3.010 2.331 2.102 2.625 . 0 0 "[ . 1 . 2]" 1
1279 1 54 LYS H 1 55 TYR HA . . 4.920 4.704 4.488 4.872 . 0 0 "[ . 1 . 2]" 1
1280 1 54 LYS H 1 84 ILE MG . . 4.560 4.196 4.031 4.407 . 0 0 "[ . 1 . 2]" 1
1281 1 54 LYS H 1 85 VAL H . . 4.460 3.983 3.812 4.267 . 0 0 "[ . 1 . 2]" 1
1282 1 54 LYS H 1 85 VAL HA . . 5.500 5.094 4.945 5.327 . 0 0 "[ . 1 . 2]" 1
1283 1 54 LYS H 1 85 VAL QG . . 3.700 3.172 2.493 3.698 . 0 0 "[ . 1 . 2]" 1
1284 1 54 LYS H 1 87 LYS HA . . 5.500 5.172 4.822 5.457 . 0 0 "[ . 1 . 2]" 1
1285 1 54 LYS HA 1 54 LYS HD2 . . 4.680 4.471 4.359 4.595 . 0 0 "[ . 1 . 2]" 1
1286 1 54 LYS HA 1 54 LYS HD3 . . 4.740 4.525 4.498 4.564 . 0 0 "[ . 1 . 2]" 1
1287 1 54 LYS HA 1 54 LYS HG2 . . 3.620 2.873 2.736 2.951 . 0 0 "[ . 1 . 2]" 1
1288 1 54 LYS HA 1 54 LYS HG3 . . 3.440 2.539 2.428 2.661 . 0 0 "[ . 1 . 2]" 1
1289 1 54 LYS HA 1 55 TYR QD . . 4.930 4.329 4.007 4.573 . 0 0 "[ . 1 . 2]" 1
1290 1 54 LYS HA 1 87 LYS HA . . 5.500 5.210 4.369 5.469 . 0 0 "[ . 1 . 2]" 1
1291 1 54 LYS HA 1 87 LYS HE2 . . 5.470 3.958 2.282 5.469 . 0 0 "[ . 1 . 2]" 1
1292 1 54 LYS HA 1 87 LYS QE . . 4.700 3.244 2.247 4.702 0.002 16 0 "[ . 1 . 2]" 1
1293 1 54 LYS HA 1 87 LYS HE3 . . 5.470 3.726 2.569 5.405 . 0 0 "[ . 1 . 2]" 1
1294 1 54 LYS HA 1 87 LYS QG . . 4.280 3.460 2.414 4.278 . 0 0 "[ . 1 . 2]" 1
1295 1 54 LYS HB2 1 54 LYS HD2 . . 3.820 2.810 2.737 2.935 . 0 0 "[ . 1 . 2]" 1
1296 1 54 LYS HB2 1 54 LYS HD3 . . 4.010 2.822 2.682 2.950 . 0 0 "[ . 1 . 2]" 1
1297 1 54 LYS HB2 1 55 TYR H . . 3.780 3.615 3.409 3.771 . 0 0 "[ . 1 . 2]" 1
1298 1 54 LYS HB2 1 55 TYR QD . . 4.690 3.968 3.593 4.303 . 0 0 "[ . 1 . 2]" 1
1299 1 54 LYS HB2 1 85 VAL QG . . 4.190 3.175 2.766 3.527 . 0 0 "[ . 1 . 2]" 1
1300 1 54 LYS HB2 1 87 LYS H . . 4.020 2.741 2.188 3.304 . 0 0 "[ . 1 . 2]" 1
1301 1 54 LYS HB2 1 87 LYS HA . . 3.640 2.917 2.579 3.123 . 0 0 "[ . 1 . 2]" 1
1302 1 54 LYS HB2 1 87 LYS HB2 . . 4.930 4.099 3.535 4.680 . 0 0 "[ . 1 . 2]" 1
1303 1 54 LYS HB2 1 87 LYS QB . . 4.300 3.208 1.988 4.245 . 0 0 "[ . 1 . 2]" 1
1304 1 54 LYS HB2 1 87 LYS HB3 . . 4.930 3.581 1.999 4.863 . 0 0 "[ . 1 . 2]" 1
1305 1 54 LYS HB2 1 87 LYS QD . . 5.340 4.011 2.068 5.189 . 0 0 "[ . 1 . 2]" 1
1306 1 54 LYS HB2 1 87 LYS QE . . 5.250 3.816 3.143 4.803 . 0 0 "[ . 1 . 2]" 1
1307 1 54 LYS HB2 1 87 LYS QG . . 3.780 2.584 1.956 3.536 . 0 0 "[ . 1 . 2]" 1
1308 1 54 LYS HB3 1 54 LYS HD3 . . 4.200 2.285 2.170 2.377 . 0 0 "[ . 1 . 2]" 1
1309 1 54 LYS HB3 1 54 LYS HE2 . . 5.460 4.205 3.798 4.546 . 0 0 "[ . 1 . 2]" 1
1310 1 54 LYS HB3 1 54 LYS QE . . 4.720 3.659 3.603 3.743 . 0 0 "[ . 1 . 2]" 1
1311 1 54 LYS HB3 1 54 LYS HE3 . . 5.460 4.135 3.822 4.602 . 0 0 "[ . 1 . 2]" 1
1312 1 54 LYS HB3 1 55 TYR H . . 3.080 2.354 2.007 2.661 . 0 0 "[ . 1 . 2]" 1
1313 1 54 LYS HB3 1 55 TYR QD . . 3.660 2.487 1.996 2.927 . 0 0 "[ . 1 . 2]" 1
1314 1 54 LYS HB3 1 55 TYR QE . . 3.890 3.432 3.039 3.825 . 0 0 "[ . 1 . 2]" 1
1315 1 54 LYS HB3 1 85 VAL QG . . 3.970 2.314 1.915 2.685 . 0 0 "[ . 1 . 2]" 1
1316 1 54 LYS HB3 1 87 LYS HA . . 4.330 4.082 3.820 4.321 . 0 0 "[ . 1 . 2]" 1
1317 1 54 LYS HD2 1 55 TYR QE . . 4.150 3.945 3.644 4.140 . 0 0 "[ . 1 . 2]" 1
1318 1 54 LYS HD2 1 87 LYS HA . . 4.290 2.540 2.196 2.879 . 0 0 "[ . 1 . 2]" 1
1319 1 54 LYS HD3 1 55 TYR H . . 4.730 4.473 4.100 4.731 0.001 8 0 "[ . 1 . 2]" 1
1320 1 54 LYS HD3 1 55 TYR QD . . 4.490 2.662 2.334 2.998 . 0 0 "[ . 1 . 2]" 1
1321 1 54 LYS HD3 1 85 VAL QG . . 3.940 2.876 2.272 3.204 . 0 0 "[ . 1 . 2]" 1
1322 1 54 LYS HD3 1 87 LYS HA . . 3.560 3.420 3.027 3.563 0.003 2 0 "[ . 1 . 2]" 1
1323 1 54 LYS QE 1 54 LYS HG2 . . 3.500 2.222 2.091 2.306 . 0 0 "[ . 1 . 2]" 1
1324 1 54 LYS QE 1 55 TYR QD . . 3.570 2.522 2.070 2.997 . 0 0 "[ . 1 . 2]" 1
1325 1 54 LYS QE 1 85 VAL QG . . 4.600 4.038 3.579 4.294 . 0 0 "[ . 1 . 2]" 1
1326 1 54 LYS QE 1 87 LYS HA . . 5.340 4.548 4.201 4.939 . 0 0 "[ . 1 . 2]" 1
1327 1 54 LYS HE2 1 55 TYR QE . . 4.060 2.899 2.194 3.717 . 0 0 "[ . 1 . 2]" 1
1328 1 54 LYS HE3 1 55 TYR QE . . 4.060 3.694 2.962 4.042 . 0 0 "[ . 1 . 2]" 1
1329 1 54 LYS HG2 1 55 TYR H . . 4.470 3.912 3.598 4.221 . 0 0 "[ . 1 . 2]" 1
1330 1 54 LYS HG2 1 55 TYR HB3 . . 4.730 3.419 3.230 3.619 . 0 0 "[ . 1 . 2]" 1
1331 1 54 LYS HG2 1 55 TYR QD . . 3.690 2.210 2.013 2.545 . 0 0 "[ . 1 . 2]" 1
1332 1 54 LYS HG2 1 55 TYR QE . . 4.330 3.935 3.688 4.313 . 0 0 "[ . 1 . 2]" 1
1333 1 54 LYS HG2 1 85 VAL QG . . 5.440 4.116 3.584 4.645 . 0 0 "[ . 1 . 2]" 1
1334 1 54 LYS HG3 1 85 VAL QG . . 5.410 4.608 4.164 4.995 . 0 0 "[ . 1 . 2]" 1
1335 1 54 LYS HG3 1 87 LYS HA . . 5.200 3.909 3.072 4.256 . 0 0 "[ . 1 . 2]" 1
1336 1 55 TYR H 1 55 TYR QD . . 4.060 3.198 2.703 3.453 . 0 0 "[ . 1 . 2]" 1
1337 1 55 TYR H 1 56 ALA H . . 4.590 4.373 4.352 4.398 . 0 0 "[ . 1 . 2]" 1
1338 1 55 TYR H 1 84 ILE MG . . 5.190 4.774 4.477 5.012 . 0 0 "[ . 1 . 2]" 1
1339 1 55 TYR H 1 85 VAL H . . 3.880 3.366 3.173 3.509 . 0 0 "[ . 1 . 2]" 1
1340 1 55 TYR H 1 85 VAL HA . . 5.500 5.235 4.998 5.471 . 0 0 "[ . 1 . 2]" 1
1341 1 55 TYR H 1 85 VAL HB . . 4.680 3.768 2.583 4.707 0.027 2 0 "[ . 1 . 2]" 1
1342 1 55 TYR H 1 85 VAL QG . . 4.090 2.660 1.835 3.646 . 0 0 "[ . 1 . 2]" 1
1343 1 55 TYR HA 1 55 TYR QD . . 4.020 3.735 3.720 3.742 . 0 0 "[ . 1 . 2]" 1
1344 1 55 TYR HA 1 56 ALA H . . 3.170 2.480 2.422 2.540 . 0 0 "[ . 1 . 2]" 1
1345 1 55 TYR HA 1 70 VAL H . . 4.910 4.620 4.302 4.887 . 0 0 "[ . 1 . 2]" 1
1346 1 55 TYR HA 1 70 VAL MG2 . . 4.310 4.125 3.971 4.300 . 0 0 "[ . 1 . 2]" 1
1347 1 55 TYR HA 1 71 GLY HA2 . . 4.650 3.188 2.752 3.519 . 0 0 "[ . 1 . 2]" 1
1348 1 55 TYR HA 1 71 GLY HA3 . . 5.400 4.932 4.437 5.276 . 0 0 "[ . 1 . 2]" 1
1349 1 55 TYR HB2 1 56 ALA H . . 3.200 2.281 2.169 2.401 . 0 0 "[ . 1 . 2]" 1
1350 1 55 TYR HB2 1 56 ALA MB . . 4.550 4.430 4.349 4.533 . 0 0 "[ . 1 . 2]" 1
1351 1 55 TYR HB2 1 69 LYS QD . . 4.720 3.609 2.228 4.409 . 0 0 "[ . 1 . 2]" 1
1352 1 55 TYR HB2 1 69 LYS HE2 . . 5.500 3.641 2.554 5.128 . 0 0 "[ . 1 . 2]" 1
1353 1 55 TYR HB2 1 69 LYS QE . . 4.720 3.360 2.526 4.378 . 0 0 "[ . 1 . 2]" 1
1354 1 55 TYR HB2 1 69 LYS HE3 . . 5.500 4.414 3.214 5.075 . 0 0 "[ . 1 . 2]" 1
1355 1 55 TYR HB2 1 69 LYS QG . . 3.770 2.184 1.945 2.489 . 0 0 "[ . 1 . 2]" 1
1356 1 55 TYR HB2 1 70 VAL H . . 4.590 3.333 3.072 3.558 . 0 0 "[ . 1 . 2]" 1
1357 1 55 TYR HB3 1 56 ALA H . . 3.810 3.691 3.628 3.768 . 0 0 "[ . 1 . 2]" 1
1358 1 55 TYR HB3 1 56 ALA MB . . 5.500 5.456 5.413 5.521 0.021 15 0 "[ . 1 . 2]" 1
1359 1 55 TYR HB3 1 69 LYS QD . . 4.800 3.708 3.002 4.576 . 0 0 "[ . 1 . 2]" 1
1360 1 55 TYR HB3 1 69 LYS QE . . 4.810 3.192 1.990 4.563 . 0 0 "[ . 1 . 2]" 1
1361 1 55 TYR HB3 1 69 LYS HG2 . . 4.970 3.352 2.853 4.206 . 0 0 "[ . 1 . 2]" 1
1362 1 55 TYR HB3 1 69 LYS QG . . 4.220 2.950 2.676 3.422 . 0 0 "[ . 1 . 2]" 1
1363 1 55 TYR HB3 1 69 LYS HG3 . . 4.970 3.372 3.042 3.861 . 0 0 "[ . 1 . 2]" 1
1364 1 55 TYR HB3 1 70 VAL H . . 5.200 4.966 4.692 5.190 . 0 0 "[ . 1 . 2]" 1
1365 1 55 TYR HB3 1 70 VAL MG2 . . 5.500 5.382 5.175 5.503 0.003 18 0 "[ . 1 . 2]" 1
1366 1 55 TYR QD 1 56 ALA H . . 3.590 3.064 2.817 3.307 . 0 0 "[ . 1 . 2]" 1
1367 1 55 TYR QD 1 56 ALA HA . . 4.470 3.400 3.067 3.831 . 0 0 "[ . 1 . 2]" 1
1368 1 55 TYR QD 1 57 LEU HG . . 3.840 2.730 2.518 2.971 . 0 0 "[ . 1 . 2]" 1
1369 1 55 TYR QD 1 69 LYS HA . . 4.660 3.524 3.076 3.876 . 0 0 "[ . 1 . 2]" 1
1370 1 55 TYR QD 1 69 LYS QD . . 4.410 3.545 1.960 4.251 . 0 0 "[ . 1 . 2]" 1
1371 1 55 TYR QD 1 69 LYS HE2 . . 4.460 3.181 2.282 4.461 0.001 15 0 "[ . 1 . 2]" 1
1372 1 55 TYR QD 1 69 LYS HE3 . . 4.460 3.692 2.634 4.412 . 0 0 "[ . 1 . 2]" 1
1373 1 55 TYR QD 1 69 LYS HG2 . . 4.360 3.987 3.321 4.374 0.014 15 0 "[ . 1 . 2]" 1
1374 1 55 TYR QD 1 69 LYS QG . . 3.550 2.822 2.350 3.435 . 0 0 "[ . 1 . 2]" 1
1375 1 55 TYR QD 1 69 LYS HG3 . . 4.360 2.895 2.396 3.594 . 0 0 "[ . 1 . 2]" 1
1376 1 55 TYR QD 1 70 VAL H . . 4.330 3.985 3.771 4.213 . 0 0 "[ . 1 . 2]" 1
1377 1 55 TYR QD 1 85 VAL HB . . 5.180 4.205 3.335 5.180 . 0 0 "[ . 1 . 2]" 1
1378 1 55 TYR QD 1 85 VAL MG1 . . 4.130 3.350 2.507 3.693 . 0 0 "[ . 1 . 2]" 1
1379 1 55 TYR QD 1 85 VAL QG . . 3.530 2.834 2.474 3.170 . 0 0 "[ . 1 . 2]" 1
1380 1 55 TYR QD 1 85 VAL MG2 . . 4.130 3.229 2.561 3.806 . 0 0 "[ . 1 . 2]" 1
1381 1 55 TYR QE 1 56 ALA H . . 5.500 5.309 5.116 5.484 . 0 0 "[ . 1 . 2]" 1
1382 1 55 TYR QE 1 57 LEU H . . 4.940 4.703 4.348 4.931 . 0 0 "[ . 1 . 2]" 1
1383 1 55 TYR QE 1 57 LEU MD1 . . 3.450 2.399 2.088 2.594 . 0 0 "[ . 1 . 2]" 1
1384 1 55 TYR QE 1 57 LEU MD2 . . 3.260 2.483 2.024 2.958 . 0 0 "[ . 1 . 2]" 1
1385 1 55 TYR QE 1 57 LEU HG . . 3.290 2.515 2.189 2.785 . 0 0 "[ . 1 . 2]" 1
1386 1 55 TYR QE 1 69 LYS HE2 . . 5.220 3.825 2.744 5.033 . 0 0 "[ . 1 . 2]" 1
1387 1 55 TYR QE 1 69 LYS QE . . 4.480 3.345 2.665 4.324 . 0 0 "[ . 1 . 2]" 1
1388 1 55 TYR QE 1 69 LYS HE3 . . 5.220 3.900 3.286 4.710 . 0 0 "[ . 1 . 2]" 1
1389 1 55 TYR QE 1 85 VAL MG1 . . 3.550 2.353 1.998 2.892 . 0 0 "[ . 1 . 2]" 1
1390 1 55 TYR QE 1 85 VAL QG . . 2.980 2.160 1.940 2.438 . 0 0 "[ . 1 . 2]" 1
1391 1 55 TYR QE 1 85 VAL MG2 . . 3.550 2.586 2.230 2.988 . 0 0 "[ . 1 . 2]" 1
1392 1 56 ALA H 1 56 ALA MB . . 3.210 2.506 2.451 2.573 . 0 0 "[ . 1 . 2]" 1
1393 1 56 ALA H 1 57 LEU HG . . 5.150 4.818 4.649 4.983 . 0 0 "[ . 1 . 2]" 1
1394 1 56 ALA H 1 69 LYS HA . . 4.410 3.923 3.684 4.232 . 0 0 "[ . 1 . 2]" 1
1395 1 56 ALA H 1 69 LYS QG . . 5.120 3.679 3.386 3.950 . 0 0 "[ . 1 . 2]" 1
1396 1 56 ALA H 1 70 VAL H . . 3.680 2.605 2.375 2.897 . 0 0 "[ . 1 . 2]" 1
1397 1 56 ALA H 1 70 VAL MG1 . . 4.810 4.558 4.389 4.805 . 0 0 "[ . 1 . 2]" 1
1398 1 56 ALA H 1 70 VAL MG2 . . 3.720 2.331 2.082 2.462 . 0 0 "[ . 1 . 2]" 1
1399 1 56 ALA H 1 84 ILE MD . . 5.500 5.263 4.981 5.503 0.003 2 0 "[ . 1 . 2]" 1
1400 1 56 ALA HA 1 57 LEU H . . 2.950 2.187 2.162 2.211 . 0 0 "[ . 1 . 2]" 1
1401 1 56 ALA HA 1 57 LEU HB2 . . 4.870 4.680 4.591 4.793 . 0 0 "[ . 1 . 2]" 1
1402 1 56 ALA HA 1 57 LEU HG . . 4.890 3.595 3.442 3.755 . 0 0 "[ . 1 . 2]" 1
1403 1 56 ALA HA 1 70 VAL MG2 . . 4.690 3.751 3.461 3.906 . 0 0 "[ . 1 . 2]" 1
1404 1 56 ALA HA 1 82 ILE MD . . 4.610 3.912 3.699 4.087 . 0 0 "[ . 1 . 2]" 1
1405 1 56 ALA HA 1 82 ILE HG13 . . 5.370 3.694 3.456 4.112 . 0 0 "[ . 1 . 2]" 1
1406 1 56 ALA HA 1 84 ILE HA . . 3.540 3.399 3.081 3.546 0.006 7 0 "[ . 1 . 2]" 1
1407 1 56 ALA HA 1 84 ILE MD . . 4.000 3.714 3.465 3.945 . 0 0 "[ . 1 . 2]" 1
1408 1 56 ALA HA 1 84 ILE MG . . 5.390 5.095 4.760 5.248 . 0 0 "[ . 1 . 2]" 1
1409 1 56 ALA HA 1 85 VAL H . . 3.770 3.621 3.340 3.778 0.008 7 0 "[ . 1 . 2]" 1
1410 1 56 ALA HA 1 85 VAL QG . . 4.120 3.643 3.282 4.100 . 0 0 "[ . 1 . 2]" 1
1411 1 56 ALA MB 1 57 LEU H . . 3.340 3.005 2.932 3.109 . 0 0 "[ . 1 . 2]" 1
1412 1 56 ALA MB 1 69 LYS HA . . 5.500 5.084 4.749 5.304 . 0 0 "[ . 1 . 2]" 1
1413 1 56 ALA MB 1 70 VAL H . . 4.570 3.735 3.431 3.957 . 0 0 "[ . 1 . 2]" 1
1414 1 56 ALA MB 1 70 VAL HB . . 4.890 4.217 3.850 4.439 . 0 0 "[ . 1 . 2]" 1
1415 1 56 ALA MB 1 70 VAL MG1 . . 4.350 3.893 3.618 4.212 . 0 0 "[ . 1 . 2]" 1
1416 1 56 ALA MB 1 70 VAL MG2 . . 2.770 1.951 1.711 2.144 . 0 0 "[ . 1 . 2]" 1
1417 1 56 ALA MB 1 74 HIS HB2 . . 5.500 5.371 4.993 5.502 0.002 13 0 "[ . 1 . 2]" 1
1418 1 56 ALA MB 1 82 ILE HA . . 4.640 4.074 3.868 4.252 . 0 0 "[ . 1 . 2]" 1
1419 1 56 ALA MB 1 82 ILE HB . . 4.500 4.018 3.811 4.212 . 0 0 "[ . 1 . 2]" 1
1420 1 56 ALA MB 1 82 ILE MD . . 3.010 1.873 1.748 1.991 . 0 0 "[ . 1 . 2]" 1
1421 1 56 ALA MB 1 82 ILE HG12 . . 3.850 2.528 2.086 2.746 . 0 0 "[ . 1 . 2]" 1
1422 1 56 ALA MB 1 82 ILE MG . . 4.080 3.918 3.703 4.082 0.002 8 0 "[ . 1 . 2]" 1
1423 1 56 ALA MB 1 83 GLN H . . 4.250 3.542 3.263 3.925 . 0 0 "[ . 1 . 2]" 1
1424 1 56 ALA MB 1 83 GLN QB . . 4.970 4.695 4.416 4.951 . 0 0 "[ . 1 . 2]" 1
1425 1 56 ALA MB 1 84 ILE MD . . 3.040 2.468 2.129 2.747 . 0 0 "[ . 1 . 2]" 1
1426 1 56 ALA MB 1 84 ILE QG . . 4.380 4.039 3.770 4.335 . 0 0 "[ . 1 . 2]" 1
1427 1 56 ALA MB 1 85 VAL H . . 4.450 4.290 3.739 4.454 0.004 2 0 "[ . 1 . 2]" 1
1428 1 57 LEU H 1 57 LEU HB2 . . 3.510 2.595 2.503 2.694 . 0 0 "[ . 1 . 2]" 1
1429 1 57 LEU H 1 57 LEU HB3 . . 3.700 3.698 3.660 3.722 0.022 9 0 "[ . 1 . 2]" 1
1430 1 57 LEU H 1 57 LEU MD1 . . 4.050 3.621 3.435 3.790 . 0 0 "[ . 1 . 2]" 1
1431 1 57 LEU H 1 57 LEU MD2 . . 4.060 3.730 3.488 3.920 . 0 0 "[ . 1 . 2]" 1
1432 1 57 LEU H 1 57 LEU HG . . 3.620 2.544 2.330 2.713 . 0 0 "[ . 1 . 2]" 1
1433 1 57 LEU H 1 58 VAL H . . 4.910 4.096 3.902 4.338 . 0 0 "[ . 1 . 2]" 1
1434 1 57 LEU H 1 82 ILE HA . . 4.650 3.953 3.720 4.267 . 0 0 "[ . 1 . 2]" 1
1435 1 57 LEU H 1 82 ILE MD . . 4.700 4.439 4.244 4.693 . 0 0 "[ . 1 . 2]" 1
1436 1 57 LEU H 1 82 ILE HG12 . . 4.430 3.876 3.534 4.186 . 0 0 "[ . 1 . 2]" 1
1437 1 57 LEU H 1 82 ILE HG13 . . 4.970 3.303 3.080 3.611 . 0 0 "[ . 1 . 2]" 1
1438 1 57 LEU H 1 83 GLN H . . 3.680 2.325 2.167 2.544 . 0 0 "[ . 1 . 2]" 1
1439 1 57 LEU H 1 83 GLN QB . . 3.950 2.701 2.327 2.989 . 0 0 "[ . 1 . 2]" 1
1440 1 57 LEU H 1 84 ILE HA . . 5.030 4.769 4.437 4.931 . 0 0 "[ . 1 . 2]" 1
1441 1 57 LEU H 1 84 ILE MD . . 5.160 4.941 4.618 5.155 . 0 0 "[ . 1 . 2]" 1
1442 1 57 LEU H 1 85 VAL H . . 5.500 5.145 4.946 5.353 . 0 0 "[ . 1 . 2]" 1
1443 1 57 LEU H 1 85 VAL QG . . 4.450 4.131 3.893 4.413 . 0 0 "[ . 1 . 2]" 1
1444 1 57 LEU HA 1 57 LEU MD1 . . 4.590 3.948 3.913 3.986 . 0 0 "[ . 1 . 2]" 1
1445 1 57 LEU HA 1 57 LEU MD2 . . 3.220 2.287 2.063 2.589 . 0 0 "[ . 1 . 2]" 1
1446 1 57 LEU HA 1 58 VAL H . . 3.040 2.204 2.143 2.279 . 0 0 "[ . 1 . 2]" 1
1447 1 57 LEU HA 1 58 VAL HB . . 5.270 4.690 4.589 4.824 . 0 0 "[ . 1 . 2]" 1
1448 1 57 LEU HA 1 68 GLN H . . 4.250 3.469 3.113 4.144 . 0 0 "[ . 1 . 2]" 1
1449 1 57 LEU HB2 1 57 LEU MD1 . . 3.560 2.143 2.023 2.312 . 0 0 "[ . 1 . 2]" 1
1450 1 57 LEU HB2 1 59 TRP HH2 . . 4.530 2.479 2.197 2.975 . 0 0 "[ . 1 . 2]" 1
1451 1 57 LEU HB2 1 59 TRP HZ3 . . 4.480 3.104 2.736 3.583 . 0 0 "[ . 1 . 2]" 1
1452 1 57 LEU HB2 1 67 PRO QB . . 4.580 3.709 3.374 4.153 . 0 0 "[ . 1 . 2]" 1
1453 1 57 LEU HB2 1 83 GLN H . . 4.250 3.294 2.969 3.683 . 0 0 "[ . 1 . 2]" 1
1454 1 57 LEU HB2 1 83 GLN QB . . 3.540 2.318 1.995 2.580 . 0 0 "[ . 1 . 2]" 1
1455 1 57 LEU HB3 1 57 LEU MD1 . . 3.130 2.521 2.397 2.662 . 0 0 "[ . 1 . 2]" 1
1456 1 57 LEU HB3 1 57 LEU MD2 . . 3.590 2.230 2.079 2.341 . 0 0 "[ . 1 . 2]" 1
1457 1 57 LEU HB3 1 58 VAL H . . 4.130 3.862 3.579 4.075 . 0 0 "[ . 1 . 2]" 1
1458 1 57 LEU HB3 1 59 TRP HH2 . . 4.600 3.474 3.157 3.880 . 0 0 "[ . 1 . 2]" 1
1459 1 57 LEU HB3 1 59 TRP HZ3 . . 4.810 4.389 4.085 4.797 . 0 0 "[ . 1 . 2]" 1
1460 1 57 LEU HB3 1 67 PRO HB2 . . 4.420 2.510 2.190 3.005 . 0 0 "[ . 1 . 2]" 1
1461 1 57 LEU HB3 1 67 PRO QB . . 3.780 2.344 2.069 2.791 . 0 0 "[ . 1 . 2]" 1
1462 1 57 LEU HB3 1 67 PRO HB3 . . 4.420 2.820 2.494 3.451 . 0 0 "[ . 1 . 2]" 1
1463 1 57 LEU HB3 1 68 GLN H . . 4.820 3.713 3.397 4.100 . 0 0 "[ . 1 . 2]" 1
1464 1 57 LEU HB3 1 83 GLN QB . . 4.250 3.918 3.574 4.210 . 0 0 "[ . 1 . 2]" 1
1465 1 57 LEU MD1 1 59 TRP HH2 . . 3.750 2.210 1.981 2.598 . 0 0 "[ . 1 . 2]" 1
1466 1 57 LEU MD1 1 59 TRP HZ2 . . 4.300 2.731 2.508 3.272 . 0 0 "[ . 1 . 2]" 1
1467 1 57 LEU MD1 1 59 TRP HZ3 . . 4.690 4.005 3.645 4.397 . 0 0 "[ . 1 . 2]" 1
1468 1 57 LEU MD1 1 67 PRO QB . . 4.620 3.054 2.623 3.390 . 0 0 "[ . 1 . 2]" 1
1469 1 57 LEU MD1 1 83 GLN H . . 4.920 4.495 4.141 4.905 . 0 0 "[ . 1 . 2]" 1
1470 1 57 LEU MD1 1 83 GLN QB . . 3.870 2.577 2.206 3.023 . 0 0 "[ . 1 . 2]" 1
1471 1 57 LEU MD1 1 83 GLN QE . . 4.390 3.641 2.805 4.340 . 0 0 "[ . 1 . 2]" 1
1472 1 57 LEU MD1 1 83 GLN QG . . 4.360 2.944 1.979 3.862 . 0 0 "[ . 1 . 2]" 1
1473 1 57 LEU MD1 1 85 VAL HB . . 5.500 5.152 4.213 5.484 . 0 0 "[ . 1 . 2]" 1
1474 1 57 LEU MD2 1 68 GLN H . . 4.430 3.663 3.313 4.039 . 0 0 "[ . 1 . 2]" 1
1475 1 57 LEU MD2 1 68 GLN HA . . 5.170 4.129 3.631 4.443 . 0 0 "[ . 1 . 2]" 1
1476 1 57 LEU MD2 1 69 LYS H . . 4.210 3.889 3.402 4.211 0.001 13 0 "[ . 1 . 2]" 1
1477 1 57 LEU MD2 1 69 LYS HA . . 3.660 2.618 2.445 2.881 . 0 0 "[ . 1 . 2]" 1
1478 1 57 LEU MD2 1 69 LYS HE2 . . 5.500 4.357 3.045 5.085 . 0 0 "[ . 1 . 2]" 1
1479 1 57 LEU MD2 1 69 LYS QE . . 4.790 3.668 2.376 4.645 . 0 0 "[ . 1 . 2]" 1
1480 1 57 LEU MD2 1 69 LYS HE3 . . 5.500 4.058 2.480 5.455 . 0 0 "[ . 1 . 2]" 1
1481 1 57 LEU MD2 1 70 VAL H . . 4.450 3.971 3.540 4.312 . 0 0 "[ . 1 . 2]" 1
1482 1 57 LEU HG 1 59 TRP HH2 . . 5.500 4.389 4.048 4.996 . 0 0 "[ . 1 . 2]" 1
1483 1 57 LEU HG 1 83 GLN QB . . 4.580 3.243 2.673 3.775 . 0 0 "[ . 1 . 2]" 1
1484 1 57 LEU HG 1 85 VAL QG . . 3.580 3.398 3.138 3.579 . 0 0 "[ . 1 . 2]" 1
1485 1 58 VAL H 1 58 VAL HB . . 3.310 2.534 2.434 2.665 . 0 0 "[ . 1 . 2]" 1
1486 1 58 VAL H 1 58 VAL MG2 . . 3.190 2.307 1.967 2.678 . 0 0 "[ . 1 . 2]" 1
1487 1 58 VAL H 1 59 TRP H . . 4.830 4.579 4.530 4.612 . 0 0 "[ . 1 . 2]" 1
1488 1 58 VAL H 1 67 PRO HA . . 5.070 4.796 4.347 5.074 0.004 19 0 "[ . 1 . 2]" 1
1489 1 58 VAL H 1 68 GLN H . . 3.440 3.298 3.053 3.444 0.004 13 0 "[ . 1 . 2]" 1
1490 1 58 VAL H 1 68 GLN HA . . 5.500 5.381 5.133 5.502 0.002 7 0 "[ . 1 . 2]" 1
1491 1 58 VAL H 1 70 VAL H . . 4.820 4.391 3.949 4.718 . 0 0 "[ . 1 . 2]" 1
1492 1 58 VAL H 1 70 VAL MG1 . . 4.620 3.149 2.855 3.509 . 0 0 "[ . 1 . 2]" 1
1493 1 58 VAL HA 1 58 VAL MG1 . . 3.500 2.329 2.188 2.457 . 0 0 "[ . 1 . 2]" 1
1494 1 58 VAL HA 1 58 VAL MG2 . . 3.440 2.362 2.258 2.535 . 0 0 "[ . 1 . 2]" 1
1495 1 58 VAL HA 1 59 TRP H . . 3.060 2.208 2.169 2.266 . 0 0 "[ . 1 . 2]" 1
1496 1 58 VAL HA 1 59 TRP HE3 . . 3.990 3.687 3.384 3.812 . 0 0 "[ . 1 . 2]" 1
1497 1 58 VAL HA 1 81 VAL H . . 4.720 4.579 4.387 4.712 . 0 0 "[ . 1 . 2]" 1
1498 1 58 VAL HA 1 82 ILE HA . . 3.740 2.760 2.367 3.093 . 0 0 "[ . 1 . 2]" 1
1499 1 58 VAL HA 1 82 ILE HB . . 4.750 3.801 3.415 4.208 . 0 0 "[ . 1 . 2]" 1
1500 1 58 VAL HA 1 82 ILE HG13 . . 4.850 3.834 3.422 4.208 . 0 0 "[ . 1 . 2]" 1
1501 1 58 VAL HA 1 83 GLN H . . 4.640 4.310 3.909 4.595 . 0 0 "[ . 1 . 2]" 1
1502 1 58 VAL HB 1 59 TRP H . . 4.390 3.974 3.802 4.122 . 0 0 "[ . 1 . 2]" 1
1503 1 58 VAL HB 1 59 TRP HA . . 5.500 4.685 4.511 4.818 . 0 0 "[ . 1 . 2]" 1
1504 1 58 VAL HB 1 63 VAL HB . . 5.050 4.656 4.082 5.039 . 0 0 "[ . 1 . 2]" 1
1505 1 58 VAL HB 1 63 VAL MG1 . . 3.410 2.220 1.844 2.506 . 0 0 "[ . 1 . 2]" 1
1506 1 58 VAL HB 1 63 VAL MG2 . . 4.060 2.905 2.246 3.394 . 0 0 "[ . 1 . 2]" 1
1507 1 58 VAL HB 1 68 GLN H . . 4.420 4.229 3.903 4.421 0.001 13 0 "[ . 1 . 2]" 1
1508 1 58 VAL HB 1 68 GLN HB2 . . 5.500 4.994 4.345 5.346 . 0 0 "[ . 1 . 2]" 1
1509 1 58 VAL HB 1 70 VAL MG1 . . 3.920 3.206 2.893 3.540 . 0 0 "[ . 1 . 2]" 1
1510 1 58 VAL HB 1 70 VAL MG2 . . 4.320 4.014 3.695 4.298 . 0 0 "[ . 1 . 2]" 1
1511 1 58 VAL MG1 1 59 TRP H . . 3.530 2.072 1.895 2.239 . 0 0 "[ . 1 . 2]" 1
1512 1 58 VAL MG1 1 59 TRP HA . . 4.830 3.624 3.374 3.864 . 0 0 "[ . 1 . 2]" 1
1513 1 58 VAL MG1 1 59 TRP HE3 . . 4.890 4.797 4.619 4.888 . 0 0 "[ . 1 . 2]" 1
1514 1 58 VAL MG1 1 70 VAL MG1 . . 4.340 4.079 3.848 4.337 . 0 0 "[ . 1 . 2]" 1
1515 1 58 VAL MG1 1 74 HIS HD2 . . 4.870 4.484 4.059 4.795 . 0 0 "[ . 1 . 2]" 1
1516 1 58 VAL MG1 1 80 ASP HA . . 5.450 4.237 3.906 4.443 . 0 0 "[ . 1 . 2]" 1
1517 1 58 VAL MG1 1 80 ASP HB2 . . 4.100 3.879 3.404 4.097 . 0 0 "[ . 1 . 2]" 1
1518 1 58 VAL MG1 1 80 ASP QB . . 3.490 2.984 2.394 3.466 . 0 0 "[ . 1 . 2]" 1
1519 1 58 VAL MG1 1 80 ASP HB3 . . 4.100 3.210 2.424 4.104 0.004 1 0 "[ . 1 . 2]" 1
1520 1 58 VAL MG1 1 81 VAL H . . 4.600 3.700 3.406 3.874 . 0 0 "[ . 1 . 2]" 1
1521 1 58 VAL MG1 1 82 ILE HA . . 4.780 4.328 3.885 4.717 . 0 0 "[ . 1 . 2]" 1
1522 1 58 VAL MG2 1 59 TRP H . . 4.120 3.940 3.821 4.075 . 0 0 "[ . 1 . 2]" 1
1523 1 58 VAL MG2 1 70 VAL MG1 . . 3.090 2.196 1.912 2.674 . 0 0 "[ . 1 . 2]" 1
1524 1 58 VAL MG2 1 74 HIS HD2 . . 3.510 2.965 2.457 3.231 . 0 0 "[ . 1 . 2]" 1
1525 1 58 VAL MG2 1 82 ILE HA . . 3.820 3.524 2.949 3.820 0.000 18 0 "[ . 1 . 2]" 1
1526 1 58 VAL MG2 1 82 ILE HB . . 3.670 3.235 2.690 3.644 . 0 0 "[ . 1 . 2]" 1
1527 1 58 VAL MG2 1 82 ILE MD . . 3.680 3.028 2.578 3.350 . 0 0 "[ . 1 . 2]" 1
1528 1 58 VAL MG2 1 82 ILE MG . . 5.360 4.427 3.951 4.741 . 0 0 "[ . 1 . 2]" 1
1529 1 58 VAL MG2 1 83 GLN H . . 5.000 4.530 3.980 4.821 . 0 0 "[ . 1 . 2]" 1
1530 1 59 TRP H 1 59 TRP HB2 . . 4.130 2.574 2.489 2.659 . 0 0 "[ . 1 . 2]" 1
1531 1 59 TRP H 1 59 TRP QB . . 3.550 2.530 2.451 2.609 . 0 0 "[ . 1 . 2]" 1
1532 1 59 TRP H 1 59 TRP HB3 . . 4.130 3.726 3.670 3.784 . 0 0 "[ . 1 . 2]" 1
1533 1 59 TRP H 1 59 TRP HE3 . . 3.370 3.218 3.075 3.375 0.005 17 0 "[ . 1 . 2]" 1
1534 1 59 TRP H 1 59 TRP HZ3 . . 5.500 5.338 5.186 5.509 0.009 17 0 "[ . 1 . 2]" 1
1535 1 59 TRP H 1 60 GLY H . . 4.840 3.471 2.448 3.966 . 0 0 "[ . 1 . 2]" 1
1536 1 59 TRP H 1 81 VAL H . . 3.980 3.018 2.823 3.199 . 0 0 "[ . 1 . 2]" 1
1537 1 59 TRP H 1 81 VAL HB . . 4.010 3.458 3.292 3.594 . 0 0 "[ . 1 . 2]" 1
1538 1 59 TRP H 1 81 VAL MG2 . . 4.680 4.642 4.451 4.682 0.002 17 0 "[ . 1 . 2]" 1
1539 1 59 TRP H 1 82 ILE HA . . 4.440 4.111 3.781 4.411 . 0 0 "[ . 1 . 2]" 1
1540 1 59 TRP HA 1 60 GLY H . . 2.980 2.418 2.185 2.932 . 0 0 "[ . 1 . 2]" 1
1541 1 59 TRP HA 1 63 VAL MG2 . . 4.230 3.269 2.873 3.613 . 0 0 "[ . 1 . 2]" 1
1542 1 59 TRP QB 1 59 TRP HD1 . . 3.320 2.710 2.668 2.737 . 0 0 "[ . 1 . 2]" 1
1543 1 59 TRP QB 1 59 TRP HE1 . . 4.600 4.466 4.453 4.473 . 0 0 "[ . 1 . 2]" 1
1544 1 59 TRP QB 1 60 GLY H . . 3.760 3.772 3.646 3.919 0.159 20 0 "[ . 1 . 2]" 1
1545 1 59 TRP QB 1 81 VAL H . . 4.130 3.293 2.993 3.734 . 0 0 "[ . 1 . 2]" 1
1546 1 59 TRP QB 1 81 VAL HB . . 3.260 2.204 1.987 2.366 . 0 0 "[ . 1 . 2]" 1
1547 1 59 TRP QB 1 81 VAL MG1 . . 3.990 3.362 3.053 3.610 . 0 0 "[ . 1 . 2]" 1
1548 1 59 TRP QB 1 81 VAL MG2 . . 3.660 3.372 3.210 3.631 . 0 0 "[ . 1 . 2]" 1
1549 1 59 TRP HB2 1 60 GLY H . . 4.620 4.452 4.122 4.569 . 0 0 "[ . 1 . 2]" 1
1550 1 59 TRP HB2 1 81 VAL HB . . 3.870 2.220 1.999 2.388 . 0 0 "[ . 1 . 2]" 1
1551 1 59 TRP HB3 1 60 GLY H . . 4.620 4.107 3.844 4.401 . 0 0 "[ . 1 . 2]" 1
1552 1 59 TRP HB3 1 81 VAL HB . . 3.870 3.726 3.380 3.869 . 0 0 "[ . 1 . 2]" 1
1553 1 59 TRP HD1 1 66 ASN HB2 . . 4.040 2.449 2.074 2.911 . 0 0 "[ . 1 . 2]" 1
1554 1 59 TRP HD1 1 66 ASN QB . . 3.290 2.310 2.061 2.619 . 0 0 "[ . 1 . 2]" 1
1555 1 59 TRP HD1 1 66 ASN HB3 . . 4.040 3.427 2.149 4.014 . 0 0 "[ . 1 . 2]" 1
1556 1 59 TRP HD1 1 67 PRO HD3 . . 4.930 4.085 3.673 4.395 . 0 0 "[ . 1 . 2]" 1
1557 1 59 TRP HE1 1 66 ASN QB . . 4.240 3.429 3.043 3.960 . 0 0 "[ . 1 . 2]" 1
1558 1 59 TRP HE1 1 67 PRO HB2 . . 4.560 3.776 3.635 4.065 . 0 0 "[ . 1 . 2]" 1
1559 1 59 TRP HE1 1 67 PRO QB . . 3.970 2.049 1.894 2.374 . 0 0 "[ . 1 . 2]" 1
1560 1 59 TRP HE1 1 67 PRO HB3 . . 4.560 2.058 1.901 2.391 . 0 0 "[ . 1 . 2]" 1
1561 1 59 TRP HE1 1 67 PRO HD2 . . 4.280 4.096 3.659 4.283 0.003 20 0 "[ . 1 . 2]" 1
1562 1 59 TRP HE1 1 67 PRO HD3 . . 3.530 2.491 2.034 2.743 . 0 0 "[ . 1 . 2]" 1
1563 1 59 TRP HE1 1 67 PRO HG2 . . 4.570 4.281 3.960 4.443 . 0 0 "[ . 1 . 2]" 1
1564 1 59 TRP HE1 1 67 PRO QG . . 3.900 3.057 2.772 3.225 . 0 0 "[ . 1 . 2]" 1
1565 1 59 TRP HE1 1 67 PRO HG3 . . 4.570 3.131 2.830 3.321 . 0 0 "[ . 1 . 2]" 1
1566 1 59 TRP HE3 1 81 VAL HB . . 4.210 2.509 2.100 3.090 . 0 0 "[ . 1 . 2]" 1
1567 1 59 TRP HE3 1 81 VAL MG1 . . 4.010 2.242 1.939 2.622 . 0 0 "[ . 1 . 2]" 1
1568 1 59 TRP HE3 1 82 ILE HA . . 4.790 3.487 3.153 3.884 . 0 0 "[ . 1 . 2]" 1
1569 1 59 TRP HE3 1 83 GLN H . . 4.910 4.425 4.020 4.753 . 0 0 "[ . 1 . 2]" 1
1570 1 59 TRP HH2 1 83 GLN H . . 4.960 4.453 3.868 4.875 . 0 0 "[ . 1 . 2]" 1
1571 1 59 TRP HH2 1 83 GLN QB . . 3.940 2.354 1.914 2.758 . 0 0 "[ . 1 . 2]" 1
1572 1 59 TRP HZ2 1 67 PRO QB . . 4.400 2.392 2.106 2.771 . 0 0 "[ . 1 . 2]" 1
1573 1 59 TRP HZ2 1 67 PRO HD3 . . 4.770 4.427 3.855 4.770 . 0 0 "[ . 1 . 2]" 1
1574 1 59 TRP HZ2 1 67 PRO QG . . 4.040 3.222 2.732 3.597 . 0 0 "[ . 1 . 2]" 1
1575 1 59 TRP HZ3 1 81 VAL MG1 . . 4.740 2.847 2.477 3.253 . 0 0 "[ . 1 . 2]" 1
1576 1 59 TRP HZ3 1 83 GLN H . . 4.000 3.095 2.520 3.502 . 0 0 "[ . 1 . 2]" 1
1577 1 59 TRP HZ3 1 83 GLN QB . . 3.880 2.088 1.924 2.371 . 0 0 "[ . 1 . 2]" 1
1578 1 60 GLY H 1 61 LEU H . . 4.470 4.340 4.113 4.462 . 0 0 "[ . 1 . 2]" 1
1579 1 60 GLY H 1 63 VAL H . . 4.820 3.799 3.379 4.277 . 0 0 "[ . 1 . 2]" 1
1580 1 60 GLY H 1 63 VAL HB . . 5.500 5.430 5.047 5.526 0.026 17 0 "[ . 1 . 2]" 1
1581 1 60 GLY H 1 63 VAL MG1 . . 4.860 4.269 3.866 4.757 . 0 0 "[ . 1 . 2]" 1
1582 1 60 GLY H 1 63 VAL MG2 . . 3.280 2.496 2.198 2.621 . 0 0 "[ . 1 . 2]" 1
1583 1 60 GLY H 1 66 ASN QB . . 4.800 3.610 2.995 4.308 . 0 0 "[ . 1 . 2]" 1
1584 1 60 GLY H 1 66 ASN QD . . 3.850 2.615 1.743 3.566 . 0 0 "[ . 1 . 2]" 1
1585 1 60 GLY QA 1 61 LEU H . . 3.090 2.244 2.137 2.283 . 0 0 "[ . 1 . 2]" 1
1586 1 60 GLY QA 1 62 SER H . . 4.380 3.276 2.896 3.765 . 0 0 "[ . 1 . 2]" 1
1587 1 60 GLY QA 1 66 ASN QD . . 4.720 3.705 3.130 4.574 . 0 0 "[ . 1 . 2]" 1
1588 1 61 LEU H 1 61 LEU QB . . 3.040 2.507 2.251 2.788 . 0 0 "[ . 1 . 2]" 1
1589 1 61 LEU H 1 61 LEU MD1 . . 4.200 2.427 1.772 3.306 . 0 0 "[ . 1 . 2]" 1
1590 1 61 LEU H 1 61 LEU QD . . 3.650 2.283 1.657 3.084 . 0 0 "[ . 1 . 2]" 1
1591 1 61 LEU H 1 61 LEU MD2 . . 4.200 3.353 1.822 4.048 . 0 0 "[ . 1 . 2]" 1
1592 1 61 LEU H 1 61 LEU HG . . 3.550 2.957 1.904 3.583 0.033 16 0 "[ . 1 . 2]" 1
1593 1 61 LEU HA 1 61 LEU MD1 . . 4.280 3.190 2.023 4.006 . 0 0 "[ . 1 . 2]" 1
1594 1 61 LEU HA 1 61 LEU QD . . 2.860 2.540 2.012 2.889 0.029 7 0 "[ . 1 . 2]" 1
1595 1 61 LEU HA 1 61 LEU MD2 . . 4.280 3.198 2.396 3.813 . 0 0 "[ . 1 . 2]" 1
1596 1 61 LEU HA 1 61 LEU HG . . 3.790 2.935 2.343 3.725 . 0 0 "[ . 1 . 2]" 1
1597 1 61 LEU HA 1 63 VAL H . . 4.310 3.641 3.204 4.189 . 0 0 "[ . 1 . 2]" 1
1598 1 61 LEU QB 1 61 LEU QD . . 2.670 1.877 1.808 1.961 . 0 0 "[ . 1 . 2]" 1
1599 1 61 LEU QB 1 62 SER H . . 3.510 2.756 2.406 3.161 . 0 0 "[ . 1 . 2]" 1
1600 1 61 LEU HB2 1 62 SER H . . 4.320 2.826 2.437 3.263 . 0 0 "[ . 1 . 2]" 1
1601 1 61 LEU HB3 1 62 SER H . . 4.320 3.860 3.409 4.265 . 0 0 "[ . 1 . 2]" 1
1602 1 61 LEU QD 1 79 GLU HB2 . . 5.080 4.875 4.369 5.079 . 0 0 "[ . 1 . 2]" 1
1603 1 62 SER H 1 62 SER QB . . 3.460 2.301 2.160 2.537 . 0 0 "[ . 1 . 2]" 1
1604 1 62 SER H 1 63 VAL H . . 3.190 2.884 2.653 3.111 . 0 0 "[ . 1 . 2]" 1
1605 1 62 SER H 1 63 VAL MG1 . . 5.150 4.707 4.450 4.971 . 0 0 "[ . 1 . 2]" 1
1606 1 62 SER H 1 63 VAL MG2 . . 4.620 4.147 3.647 4.604 . 0 0 "[ . 1 . 2]" 1
1607 1 62 SER H 1 77 GLU QB . . 5.110 3.774 3.141 5.064 . 0 0 "[ . 1 . 2]" 1
1608 1 62 SER H 1 77 GLU QG . . 5.300 3.738 2.658 4.416 . 0 0 "[ . 1 . 2]" 1
1609 1 62 SER HA 1 63 VAL MG1 . . 4.900 4.454 4.054 4.756 . 0 0 "[ . 1 . 2]" 1
1610 1 62 SER HA 1 63 VAL MG2 . . 5.500 4.987 4.722 5.307 . 0 0 "[ . 1 . 2]" 1
1611 1 62 SER HA 1 77 GLU QB . . 4.580 4.177 3.584 4.495 . 0 0 "[ . 1 . 2]" 1
1612 1 62 SER HA 1 77 GLU QG . . 3.920 3.240 2.342 3.929 0.009 8 0 "[ . 1 . 2]" 1
1613 1 62 SER QB 1 63 VAL H . . 4.100 3.166 2.490 3.805 . 0 0 "[ . 1 . 2]" 1
1614 1 62 SER QB 1 63 VAL MG1 . . 4.810 3.173 2.537 3.835 . 0 0 "[ . 1 . 2]" 1
1615 1 62 SER QB 1 63 VAL MG2 . . 5.000 3.903 3.052 4.663 . 0 0 "[ . 1 . 2]" 1
1616 1 62 SER QB 1 74 HIS HE1 . . 4.390 3.654 2.702 4.302 . 0 0 "[ . 1 . 2]" 1
1617 1 62 SER QB 1 77 GLU H . . 4.130 3.884 3.427 4.130 0.000 14 0 "[ . 1 . 2]" 1
1618 1 62 SER QB 1 77 GLU QB . . 3.860 2.475 1.903 3.666 . 0 0 "[ . 1 . 2]" 1
1619 1 62 SER QB 1 77 GLU QG . . 3.550 2.210 1.903 2.947 . 0 0 "[ . 1 . 2]" 1
1620 1 62 SER HB2 1 63 VAL H . . 4.790 3.893 2.985 4.280 . 0 0 "[ . 1 . 2]" 1
1621 1 62 SER HB2 1 77 GLU HG2 . . 5.000 3.244 2.001 4.436 . 0 0 "[ . 1 . 2]" 1
1622 1 62 SER HB2 1 77 GLU HG3 . . 5.000 3.079 2.065 4.990 . 0 0 "[ . 1 . 2]" 1
1623 1 62 SER HB3 1 63 VAL H . . 4.790 3.459 2.534 4.319 . 0 0 "[ . 1 . 2]" 1
1624 1 62 SER HB3 1 77 GLU HG2 . . 5.000 3.663 2.517 5.000 . 7 0 "[ . 1 . 2]" 1
1625 1 62 SER HB3 1 77 GLU HG3 . . 5.000 3.448 1.998 5.008 0.008 8 0 "[ . 1 . 2]" 1
1626 1 63 VAL H 1 63 VAL HB . . 3.970 3.758 3.682 3.874 . 0 0 "[ . 1 . 2]" 1
1627 1 63 VAL H 1 63 VAL MG1 . . 3.540 2.866 2.506 3.239 . 0 0 "[ . 1 . 2]" 1
1628 1 63 VAL H 1 63 VAL MG2 . . 2.880 2.018 1.876 2.296 . 0 0 "[ . 1 . 2]" 1
1629 1 63 VAL H 1 64 LYS H . . 4.740 4.462 4.375 4.544 . 0 0 "[ . 1 . 2]" 1
1630 1 63 VAL HA 1 63 VAL MG1 . . 3.540 2.313 2.165 2.442 . 0 0 "[ . 1 . 2]" 1
1631 1 63 VAL HA 1 64 LYS H . . 3.200 2.303 2.158 2.635 . 0 0 "[ . 1 . 2]" 1
1632 1 63 VAL HA 1 64 LYS QB . . 5.260 4.347 4.189 4.607 . 0 0 "[ . 1 . 2]" 1
1633 1 63 VAL HA 1 74 HIS HE1 . . 4.870 4.473 3.823 4.854 . 0 0 "[ . 1 . 2]" 1
1634 1 63 VAL HB 1 64 LYS H . . 3.220 2.696 1.897 3.207 . 0 0 "[ . 1 . 2]" 1
1635 1 63 VAL HB 1 65 HIS H . . 3.300 3.154 2.801 3.306 0.006 17 0 "[ . 1 . 2]" 1
1636 1 63 VAL HB 1 68 GLN QE . . 4.250 3.195 2.251 4.165 . 0 0 "[ . 1 . 2]" 1
1637 1 63 VAL HB 1 74 HIS HE1 . . 5.500 5.320 4.913 5.503 0.003 15 0 "[ . 1 . 2]" 1
1638 1 63 VAL MG1 1 65 HIS H . . 4.770 4.630 4.362 4.778 0.008 15 0 "[ . 1 . 2]" 1
1639 1 63 VAL MG1 1 66 ASN HA . . 5.390 4.763 4.488 5.077 . 0 0 "[ . 1 . 2]" 1
1640 1 63 VAL MG1 1 68 GLN HB2 . . 3.900 3.132 2.825 3.558 . 0 0 "[ . 1 . 2]" 1
1641 1 63 VAL MG1 1 68 GLN HB3 . . 3.550 2.195 2.038 2.531 . 0 0 "[ . 1 . 2]" 1
1642 1 63 VAL MG1 1 68 GLN HE21 . . 4.750 2.715 1.969 3.885 . 0 0 "[ . 1 . 2]" 1
1643 1 63 VAL MG1 1 68 GLN QE . . 4.180 2.392 1.852 3.326 . 0 0 "[ . 1 . 2]" 1
1644 1 63 VAL MG1 1 68 GLN HE22 . . 4.750 2.729 2.131 3.616 . 0 0 "[ . 1 . 2]" 1
1645 1 63 VAL MG1 1 70 VAL MG1 . . 3.260 2.826 2.409 3.041 . 0 0 "[ . 1 . 2]" 1
1646 1 63 VAL MG1 1 74 HIS HE1 . . 3.420 2.588 2.353 2.927 . 0 0 "[ . 1 . 2]" 1
1647 1 63 VAL MG2 1 64 LYS H . . 4.430 3.665 3.143 4.068 . 0 0 "[ . 1 . 2]" 1
1648 1 63 VAL MG2 1 65 HIS H . . 4.030 3.691 3.062 4.040 0.010 17 0 "[ . 1 . 2]" 1
1649 1 63 VAL MG2 1 66 ASN H . . 4.490 3.809 3.221 4.506 0.016 18 0 "[ . 1 . 2]" 1
1650 1 63 VAL MG2 1 66 ASN HA . . 4.150 3.279 2.893 3.802 . 0 0 "[ . 1 . 2]" 1
1651 1 63 VAL MG2 1 66 ASN HD21 . . 4.840 2.467 1.824 4.264 . 0 0 "[ . 1 . 2]" 1
1652 1 63 VAL MG2 1 66 ASN HD22 . . 4.840 3.017 1.759 4.446 . 0 0 "[ . 1 . 2]" 1
1653 1 63 VAL MG2 1 68 GLN H . . 3.860 3.580 3.123 3.811 . 0 0 "[ . 1 . 2]" 1
1654 1 63 VAL MG2 1 68 GLN HA . . 5.500 4.939 4.500 5.484 . 0 0 "[ . 1 . 2]" 1
1655 1 63 VAL MG2 1 68 GLN HB2 . . 4.290 3.096 2.569 3.853 . 0 0 "[ . 1 . 2]" 1
1656 1 63 VAL MG2 1 68 GLN HB3 . . 3.790 2.980 2.149 3.654 . 0 0 "[ . 1 . 2]" 1
1657 1 63 VAL MG2 1 68 GLN QE . . 5.340 4.309 3.622 5.208 . 0 0 "[ . 1 . 2]" 1
1658 1 63 VAL MG2 1 68 GLN QG . . 5.340 4.331 3.456 4.882 . 0 0 "[ . 1 . 2]" 1
1659 1 63 VAL MG2 1 70 VAL MG1 . . 4.970 4.487 4.085 4.813 . 0 0 "[ . 1 . 2]" 1
1660 1 64 LYS H 1 64 LYS QB . . 3.160 2.286 2.156 2.509 . 0 0 "[ . 1 . 2]" 1
1661 1 64 LYS H 1 64 LYS HG2 . . 4.270 3.432 2.218 4.275 0.005 10 0 "[ . 1 . 2]" 1
1662 1 64 LYS H 1 64 LYS HG3 . . 4.270 3.614 2.459 4.015 . 0 0 "[ . 1 . 2]" 1
1663 1 64 LYS H 1 65 HIS H . . 3.170 2.542 2.147 2.903 . 0 0 "[ . 1 . 2]" 1
1664 1 64 LYS H 1 68 GLN QE . . 4.870 3.654 2.588 4.422 . 0 0 "[ . 1 . 2]" 1
1665 1 64 LYS HA 1 64 LYS QD . . 3.850 2.873 2.016 3.918 0.068 19 0 "[ . 1 . 2]" 1
1666 1 64 LYS HA 1 64 LYS QE . . 4.910 3.699 1.982 4.733 . 0 0 "[ . 1 . 2]" 1
1667 1 64 LYS HA 1 64 LYS HG2 . . 4.170 3.005 2.206 3.610 . 0 0 "[ . 1 . 2]" 1
1668 1 64 LYS HA 1 64 LYS HG3 . . 4.170 3.037 2.205 3.844 . 0 0 "[ . 1 . 2]" 1
1669 1 64 LYS QB 1 65 HIS H . . 3.350 2.481 2.253 2.737 . 0 0 "[ . 1 . 2]" 1
1670 1 64 LYS QB 1 65 HIS HA . . 5.500 4.131 4.027 4.247 . 0 0 "[ . 1 . 2]" 1
1671 1 64 LYS QB 1 65 HIS HB2 . . 4.670 4.096 3.920 4.334 . 0 0 "[ . 1 . 2]" 1
1672 1 64 LYS QB 1 65 HIS HB3 . . 5.130 4.916 4.817 5.019 . 0 0 "[ . 1 . 2]" 1
1673 1 64 LYS QB 1 65 HIS HD2 . . 4.100 3.138 1.924 3.915 . 0 0 "[ . 1 . 2]" 1
1674 1 64 LYS QB 1 65 HIS HE1 . . 4.860 4.193 3.258 4.785 . 0 0 "[ . 1 . 2]" 1
1675 1 64 LYS QB 1 68 GLN QE . . 5.080 4.637 3.581 5.085 0.005 13 0 "[ . 1 . 2]" 1
1676 1 65 HIS H 1 65 HIS HB2 . . 3.480 2.724 2.623 2.868 . 0 0 "[ . 1 . 2]" 1
1677 1 65 HIS H 1 65 HIS HB3 . . 3.960 3.797 3.738 3.884 . 0 0 "[ . 1 . 2]" 1
1678 1 65 HIS H 1 65 HIS HD2 . . 4.950 3.687 2.457 4.560 . 0 0 "[ . 1 . 2]" 1
1679 1 65 HIS H 1 68 GLN QG . . 5.300 4.867 3.351 5.281 . 0 0 "[ . 1 . 2]" 1
1680 1 65 HIS HA 1 66 ASN H . . 3.410 2.172 2.140 2.302 . 0 0 "[ . 1 . 2]" 1
1681 1 65 HIS HB2 1 68 GLN HA . . 5.500 5.302 4.716 5.521 0.021 1 0 "[ . 1 . 2]" 1
1682 1 65 HIS HB2 1 68 GLN QG . . 5.110 4.943 4.129 5.119 0.009 18 0 "[ . 1 . 2]" 1
1683 1 65 HIS HB3 1 66 ASN H . . 4.260 3.451 2.720 3.769 . 0 0 "[ . 1 . 2]" 1
1684 1 65 HIS HB3 1 68 GLN HB2 . . 5.500 5.430 5.005 5.510 0.010 13 0 "[ . 1 . 2]" 1
1685 1 66 ASN H 1 66 ASN QB . . 3.590 2.979 2.617 3.259 . 0 0 "[ . 1 . 2]" 1
1686 1 66 ASN H 1 66 ASN QD . . 4.580 3.356 1.792 4.496 . 0 0 "[ . 1 . 2]" 1
1687 1 66 ASN HA 1 67 PRO HA . . 3.700 2.386 2.228 2.478 . 0 0 "[ . 1 . 2]" 1
1688 1 66 ASN HA 1 67 PRO QB . . 4.720 3.960 3.866 4.017 . 0 0 "[ . 1 . 2]" 1
1689 1 66 ASN HA 1 68 GLN H . . 3.720 2.722 2.291 3.180 . 0 0 "[ . 1 . 2]" 1
1690 1 66 ASN QB 1 66 ASN QD . . 3.040 2.129 2.064 2.449 . 0 0 "[ . 1 . 2]" 1
1691 1 66 ASN QB 1 67 PRO HA . . 4.380 2.012 1.943 2.221 . 0 0 "[ . 1 . 2]" 1
1692 1 67 PRO HA 1 68 GLN H . . 3.140 2.208 2.152 2.347 . 0 0 "[ . 1 . 2]" 1
1693 1 67 PRO QB 1 68 GLN H . . 3.540 3.071 2.663 3.362 . 0 0 "[ . 1 . 2]" 1
1694 1 67 PRO HB2 1 68 GLN H . . 4.080 3.241 2.755 3.595 . 0 0 "[ . 1 . 2]" 1
1695 1 67 PRO HB3 1 68 GLN H . . 4.080 3.815 3.528 4.043 . 0 0 "[ . 1 . 2]" 1
1696 1 68 GLN H 1 68 GLN HB2 . . 3.520 2.998 2.664 3.322 . 0 0 "[ . 1 . 2]" 1
1697 1 68 GLN H 1 68 GLN HB3 . . 3.600 2.626 2.507 2.801 . 0 0 "[ . 1 . 2]" 1
1698 1 68 GLN H 1 68 GLN QG . . 4.560 4.038 3.893 4.124 . 0 0 "[ . 1 . 2]" 1
1699 1 68 GLN HA 1 68 GLN HG2 . . 3.960 3.240 2.288 3.545 . 0 0 "[ . 1 . 2]" 1
1700 1 68 GLN HA 1 68 GLN QG . . 3.440 2.396 2.260 2.610 . 0 0 "[ . 1 . 2]" 1
1701 1 68 GLN HA 1 68 GLN HG3 . . 3.960 2.533 2.325 3.502 . 0 0 "[ . 1 . 2]" 1
1702 1 68 GLN HA 1 69 LYS H . . 2.810 2.180 2.141 2.372 . 0 0 "[ . 1 . 2]" 1
1703 1 68 GLN HA 1 69 LYS HB2 . . 5.020 4.281 4.144 4.398 . 0 0 "[ . 1 . 2]" 1
1704 1 68 GLN HA 1 69 LYS QB . . 4.370 4.026 3.944 4.059 . 0 0 "[ . 1 . 2]" 1
1705 1 68 GLN HA 1 69 LYS HB3 . . 5.020 4.913 4.735 5.024 0.004 9 0 "[ . 1 . 2]" 1
1706 1 68 GLN HB2 1 70 VAL MG1 . . 4.800 4.493 4.255 4.723 . 0 0 "[ . 1 . 2]" 1
1707 1 68 GLN HB3 1 68 GLN QE . . 4.490 3.400 2.838 3.882 . 0 0 "[ . 1 . 2]" 1
1708 1 68 GLN HB3 1 69 LYS H . . 4.360 4.081 3.494 4.266 . 0 0 "[ . 1 . 2]" 1
1709 1 68 GLN HB3 1 70 VAL MG1 . . 3.860 3.203 2.843 3.453 . 0 0 "[ . 1 . 2]" 1
1710 1 68 GLN QE 1 70 VAL MG1 . . 3.890 2.882 2.063 3.891 0.001 8 0 "[ . 1 . 2]" 1
1711 1 68 GLN HE21 1 70 VAL MG1 . . 4.590 3.062 2.343 4.576 . 0 0 "[ . 1 . 2]" 1
1712 1 68 GLN HE22 1 70 VAL MG1 . . 4.590 4.071 2.080 4.513 . 0 0 "[ . 1 . 2]" 1
1713 1 68 GLN QG 1 69 LYS H . . 3.170 2.571 2.139 2.851 . 0 0 "[ . 1 . 2]" 1
1714 1 68 GLN QG 1 69 LYS QB . . 5.180 3.957 3.769 4.143 . 0 0 "[ . 1 . 2]" 1
1715 1 68 GLN QG 1 70 VAL MG1 . . 3.700 2.573 2.054 3.704 0.004 13 0 "[ . 1 . 2]" 1
1716 1 68 GLN HG2 1 69 LYS H . . 3.640 3.165 2.154 3.543 . 0 0 "[ . 1 . 2]" 1
1717 1 68 GLN HG2 1 70 VAL MG1 . . 4.350 2.631 2.073 4.317 . 0 0 "[ . 1 . 2]" 1
1718 1 68 GLN HG3 1 69 LYS H . . 3.640 2.838 2.322 3.646 0.006 13 0 "[ . 1 . 2]" 1
1719 1 68 GLN HG3 1 70 VAL MG1 . . 4.350 3.963 3.358 4.332 . 0 0 "[ . 1 . 2]" 1
1720 1 69 LYS H 1 69 LYS HB2 . . 3.550 2.407 2.284 2.705 . 0 0 "[ . 1 . 2]" 1
1721 1 69 LYS H 1 69 LYS QB . . 3.100 2.257 2.197 2.455 . 0 0 "[ . 1 . 2]" 1
1722 1 69 LYS H 1 69 LYS HB3 . . 3.550 2.752 2.580 2.857 . 0 0 "[ . 1 . 2]" 1
1723 1 69 LYS H 1 69 LYS QD . . 4.740 4.361 3.831 4.625 . 0 0 "[ . 1 . 2]" 1
1724 1 69 LYS H 1 69 LYS QG . . 4.800 3.992 3.916 4.082 . 0 0 "[ . 1 . 2]" 1
1725 1 69 LYS H 1 70 VAL H . . 4.540 4.399 4.258 4.543 0.003 15 0 "[ . 1 . 2]" 1
1726 1 69 LYS H 1 70 VAL MG1 . . 4.530 4.214 4.047 4.380 . 0 0 "[ . 1 . 2]" 1
1727 1 69 LYS HA 1 69 LYS QD . . 4.530 3.682 2.226 4.176 . 0 0 "[ . 1 . 2]" 1
1728 1 69 LYS HA 1 70 VAL H . . 2.840 2.151 2.141 2.171 . 0 0 "[ . 1 . 2]" 1
1729 1 69 LYS HA 1 70 VAL MG1 . . 4.450 3.754 3.596 3.949 . 0 0 "[ . 1 . 2]" 1
1730 1 69 LYS HA 1 70 VAL MG2 . . 4.340 3.951 3.821 4.049 . 0 0 "[ . 1 . 2]" 1
1731 1 69 LYS QB 1 69 LYS QD . . 3.270 2.181 2.032 2.494 . 0 0 "[ . 1 . 2]" 1
1732 1 69 LYS QB 1 69 LYS QE . . 4.080 2.960 1.997 3.703 . 0 0 "[ . 1 . 2]" 1
1733 1 69 LYS HB2 1 69 LYS QD . . 3.760 2.400 2.054 2.722 . 0 0 "[ . 1 . 2]" 1
1734 1 69 LYS HB2 1 69 LYS HE2 . . 5.310 3.920 2.030 4.554 . 0 0 "[ . 1 . 2]" 1
1735 1 69 LYS HB2 1 69 LYS HE3 . . 5.310 3.539 2.044 4.645 . 0 0 "[ . 1 . 2]" 1
1736 1 69 LYS HB3 1 69 LYS QD . . 3.760 2.643 2.307 3.456 . 0 0 "[ . 1 . 2]" 1
1737 1 69 LYS HB3 1 69 LYS HE2 . . 5.310 4.416 3.437 4.771 . 0 0 "[ . 1 . 2]" 1
1738 1 69 LYS HB3 1 69 LYS HE3 . . 5.310 4.386 3.552 5.330 0.020 3 0 "[ . 1 . 2]" 1
1739 1 69 LYS QE 1 69 LYS QG . . 3.080 2.196 2.106 2.392 . 0 0 "[ . 1 . 2]" 1
1740 1 69 LYS QG 1 70 VAL H . . 3.740 3.120 2.634 3.398 . 0 0 "[ . 1 . 2]" 1
1741 1 69 LYS QG 1 70 VAL MG1 . . 5.340 4.781 4.439 4.950 . 0 0 "[ . 1 . 2]" 1
1742 1 69 LYS HG2 1 70 VAL H . . 4.620 3.787 3.050 4.617 . 0 0 "[ . 1 . 2]" 1
1743 1 69 LYS HG3 1 70 VAL H . . 4.620 3.457 2.656 4.092 . 0 0 "[ . 1 . 2]" 1
1744 1 70 VAL H 1 70 VAL MG1 . . 3.620 2.734 2.546 2.883 . 0 0 "[ . 1 . 2]" 1
1745 1 70 VAL H 1 70 VAL MG2 . . 3.020 2.199 2.039 2.374 . 0 0 "[ . 1 . 2]" 1
1746 1 70 VAL H 1 71 GLY H . . 4.770 4.495 4.440 4.530 . 0 0 "[ . 1 . 2]" 1
1747 1 70 VAL HB 1 71 GLY H . . 3.110 2.359 2.255 2.609 . 0 0 "[ . 1 . 2]" 1
1748 1 70 VAL HB 1 74 HIS H . . 4.230 4.152 4.009 4.234 0.004 15 0 "[ . 1 . 2]" 1
1749 1 70 VAL HB 1 74 HIS HA . . 5.320 4.381 4.291 4.505 . 0 0 "[ . 1 . 2]" 1
1750 1 70 VAL HB 1 74 HIS HB2 . . 3.470 2.037 1.998 2.166 . 0 0 "[ . 1 . 2]" 1
1751 1 70 VAL HB 1 74 HIS HB3 . . 3.800 2.544 2.288 2.833 . 0 0 "[ . 1 . 2]" 1
1752 1 70 VAL HB 1 74 HIS HE1 . . 5.500 4.813 4.342 5.105 . 0 0 "[ . 1 . 2]" 1
1753 1 70 VAL MG1 1 71 GLY H . . 3.790 3.737 3.652 3.793 0.003 14 0 "[ . 1 . 2]" 1
1754 1 70 VAL MG1 1 74 HIS HA . . 5.020 4.831 4.726 4.944 . 0 0 "[ . 1 . 2]" 1
1755 1 70 VAL MG1 1 74 HIS HB2 . . 4.030 3.213 3.032 3.411 . 0 0 "[ . 1 . 2]" 1
1756 1 70 VAL MG1 1 74 HIS HB3 . . 4.710 3.739 3.517 3.911 . 0 0 "[ . 1 . 2]" 1
1757 1 70 VAL MG1 1 74 HIS HD2 . . 4.510 3.829 3.394 4.295 . 0 0 "[ . 1 . 2]" 1
1758 1 70 VAL MG1 1 74 HIS HE1 . . 4.060 3.034 2.694 3.352 . 0 0 "[ . 1 . 2]" 1
1759 1 70 VAL MG1 1 76 LEU MD2 . . 5.500 5.163 4.854 5.454 . 0 0 "[ . 1 . 2]" 1
1760 1 70 VAL MG2 1 71 GLY H . . 3.790 3.298 3.057 3.553 . 0 0 "[ . 1 . 2]" 1
1761 1 70 VAL MG2 1 72 LYS HA . . 5.500 4.830 4.641 5.004 . 0 0 "[ . 1 . 2]" 1
1762 1 70 VAL MG2 1 74 HIS H . . 4.630 4.373 4.023 4.573 . 0 0 "[ . 1 . 2]" 1
1763 1 70 VAL MG2 1 74 HIS HA . . 5.500 5.067 4.900 5.230 . 0 0 "[ . 1 . 2]" 1
1764 1 70 VAL MG2 1 74 HIS HB2 . . 3.930 3.294 3.095 3.515 . 0 0 "[ . 1 . 2]" 1
1765 1 70 VAL MG2 1 74 HIS HB3 . . 3.620 2.577 2.338 2.817 . 0 0 "[ . 1 . 2]" 1
1766 1 70 VAL MG2 1 74 HIS HD2 . . 3.790 3.229 2.802 3.642 . 0 0 "[ . 1 . 2]" 1
1767 1 71 GLY H 1 74 HIS H . . 4.550 3.588 3.254 3.867 . 0 0 "[ . 1 . 2]" 1
1768 1 71 GLY H 1 74 HIS HB2 . . 3.840 2.709 2.182 2.933 . 0 0 "[ . 1 . 2]" 1
1769 1 71 GLY H 1 74 HIS HB3 . . 4.720 3.464 3.145 4.065 . 0 0 "[ . 1 . 2]" 1
1770 1 71 GLY HA2 1 72 LYS H . . 3.300 2.921 2.595 3.085 . 0 0 "[ . 1 . 2]" 1
1771 1 71 GLY HA2 1 73 ASP H . . 4.860 4.449 4.201 4.740 . 0 0 "[ . 1 . 2]" 1
1772 1 71 GLY HA3 1 72 LYS H . . 3.180 2.269 2.174 2.529 . 0 0 "[ . 1 . 2]" 1
1773 1 71 GLY HA3 1 73 ASP H . . 4.320 3.206 3.026 3.477 . 0 0 "[ . 1 . 2]" 1
1774 1 71 GLY HA3 1 74 HIS H . . 4.840 4.051 3.583 4.384 . 0 0 "[ . 1 . 2]" 1
1775 1 72 LYS H 1 72 LYS HB2 . . 3.880 3.656 3.593 3.705 . 0 0 "[ . 1 . 2]" 1
1776 1 72 LYS H 1 72 LYS HB3 . . 3.930 2.796 2.582 2.975 . 0 0 "[ . 1 . 2]" 1
1777 1 72 LYS H 1 72 LYS HD2 . . 4.790 4.103 1.902 4.777 . 0 0 "[ . 1 . 2]" 1
1778 1 72 LYS H 1 72 LYS HD3 . . 4.790 4.170 1.998 4.668 . 0 0 "[ . 1 . 2]" 1
1779 1 72 LYS H 1 72 LYS QE . . 4.660 4.335 3.628 4.714 0.054 12 0 "[ . 1 . 2]" 1
1780 1 72 LYS H 1 72 LYS HG2 . . 3.820 2.819 2.111 3.678 . 0 0 "[ . 1 . 2]" 1
1781 1 72 LYS H 1 72 LYS QG . . 3.300 2.171 1.875 3.301 0.001 20 0 "[ . 1 . 2]" 1
1782 1 72 LYS H 1 72 LYS HG3 . . 3.820 2.491 1.886 3.822 0.002 1 0 "[ . 1 . 2]" 1
1783 1 72 LYS H 1 74 HIS H . . 4.560 3.910 3.716 4.181 . 0 0 "[ . 1 . 2]" 1
1784 1 72 LYS HA 1 72 LYS HD2 . . 5.060 4.537 4.016 5.114 0.054 12 0 "[ . 1 . 2]" 1
1785 1 72 LYS HA 1 72 LYS QD . . 4.330 3.950 3.443 4.266 . 0 0 "[ . 1 . 2]" 1
1786 1 72 LYS HA 1 72 LYS HD3 . . 5.060 4.435 3.689 5.022 . 0 0 "[ . 1 . 2]" 1
1787 1 72 LYS HA 1 74 HIS H . . 4.240 3.728 3.516 4.107 . 0 0 "[ . 1 . 2]" 1
1788 1 72 LYS HB2 1 72 LYS QD . . 3.650 2.327 2.077 3.304 . 0 0 "[ . 1 . 2]" 1
1789 1 72 LYS HB2 1 72 LYS QE . . 4.850 3.692 2.068 4.262 . 0 0 "[ . 1 . 2]" 1
1790 1 72 LYS HB2 1 73 ASP H . . 4.460 4.154 3.864 4.456 . 0 0 "[ . 1 . 2]" 1
1791 1 72 LYS HB2 1 74 HIS H . . 5.500 5.367 5.204 5.505 0.005 15 0 "[ . 1 . 2]" 1
1792 1 72 LYS HB3 1 72 LYS QE . . 4.940 3.976 3.162 4.413 . 0 0 "[ . 1 . 2]" 1
1793 1 72 LYS QD 1 73 ASP H . . 4.820 3.702 2.128 4.819 . 0 0 "[ . 1 . 2]" 1
1794 1 72 LYS QE 1 72 LYS QG . . 3.340 2.173 2.063 2.412 . 0 0 "[ . 1 . 2]" 1
1795 1 72 LYS QG 1 73 ASP H . . 3.810 2.716 2.243 3.701 . 0 0 "[ . 1 . 2]" 1
1796 1 72 LYS QG 1 73 ASP QB . . 4.290 3.402 2.972 3.923 . 0 0 "[ . 1 . 2]" 1
1797 1 72 LYS QG 1 74 HIS H . . 5.340 4.641 4.419 5.137 . 0 0 "[ . 1 . 2]" 1
1798 1 73 ASP H 1 73 ASP QB . . 3.280 2.361 2.162 2.771 . 0 0 "[ . 1 . 2]" 1
1799 1 73 ASP H 1 74 HIS H . . 3.050 2.321 2.183 2.475 . 0 0 "[ . 1 . 2]" 1
1800 1 73 ASP H 1 74 HIS HA . . 5.050 4.792 4.643 5.013 . 0 0 "[ . 1 . 2]" 1
1801 1 73 ASP H 1 74 HIS HB2 . . 4.910 4.559 4.331 4.784 . 0 0 "[ . 1 . 2]" 1
1802 1 73 ASP H 1 74 HIS HB3 . . 4.870 4.502 4.295 4.754 . 0 0 "[ . 1 . 2]" 1
1803 1 73 ASP QB 1 74 HIS H . . 4.080 3.330 2.927 3.937 . 0 0 "[ . 1 . 2]" 1
1804 1 74 HIS H 1 74 HIS HB2 . . 3.650 2.679 2.454 2.836 . 0 0 "[ . 1 . 2]" 1
1805 1 74 HIS H 1 74 HIS HB3 . . 2.950 2.426 2.285 2.614 . 0 0 "[ . 1 . 2]" 1
1806 1 74 HIS H 1 75 THR H . . 4.820 4.561 4.447 4.640 . 0 0 "[ . 1 . 2]" 1
1807 1 74 HIS HA 1 75 THR H . . 2.630 2.183 2.139 2.273 . 0 0 "[ . 1 . 2]" 1
1808 1 74 HIS HA 1 75 THR HB . . 4.750 4.691 4.600 4.751 0.001 10 0 "[ . 1 . 2]" 1
1809 1 74 HIS HB2 1 75 THR H . . 4.380 4.081 3.890 4.278 . 0 0 "[ . 1 . 2]" 1
1810 1 74 HIS HB3 1 74 HIS HD2 . . 3.830 2.809 2.745 2.909 . 0 0 "[ . 1 . 2]" 1
1811 1 74 HIS HD2 1 75 THR H . . 4.810 4.091 3.504 4.539 . 0 0 "[ . 1 . 2]" 1
1812 1 74 HIS HD2 1 76 LEU H . . 4.820 4.478 3.904 4.776 . 0 0 "[ . 1 . 2]" 1
1813 1 74 HIS HD2 1 76 LEU HA . . 4.240 3.378 3.086 3.638 . 0 0 "[ . 1 . 2]" 1
1814 1 74 HIS HD2 1 76 LEU MD1 . . 4.930 4.744 4.585 4.913 . 0 0 "[ . 1 . 2]" 1
1815 1 74 HIS HD2 1 76 LEU MD2 . . 3.220 3.006 2.631 3.217 . 0 0 "[ . 1 . 2]" 1
1816 1 74 HIS HD2 1 76 LEU HG . . 3.860 3.354 3.094 3.591 . 0 0 "[ . 1 . 2]" 1
1817 1 75 THR H 1 75 THR HB . . 2.890 2.548 2.459 2.652 . 0 0 "[ . 1 . 2]" 1
1818 1 75 THR H 1 75 THR MG . . 3.970 3.788 3.761 3.819 . 0 0 "[ . 1 . 2]" 1
1819 1 75 THR H 1 76 LEU H . . 4.790 4.552 4.492 4.612 . 0 0 "[ . 1 . 2]" 1
1820 1 75 THR HA 1 75 THR MG . . 3.350 2.347 2.252 2.468 . 0 0 "[ . 1 . 2]" 1
1821 1 75 THR HA 1 76 LEU H . . 2.980 2.183 2.149 2.226 . 0 0 "[ . 1 . 2]" 1
1822 1 75 THR HA 1 76 LEU HB2 . . 4.770 4.404 4.319 4.536 . 0 0 "[ . 1 . 2]" 1
1823 1 75 THR HA 1 76 LEU HG . . 4.450 4.192 3.876 4.434 . 0 0 "[ . 1 . 2]" 1
1824 1 75 THR HB 1 76 LEU H . . 4.310 4.056 3.979 4.141 . 0 0 "[ . 1 . 2]" 1
1825 1 75 THR MG 1 76 LEU H . . 3.340 2.268 1.914 2.439 . 0 0 "[ . 1 . 2]" 1
1826 1 76 LEU H 1 76 LEU HB2 . . 3.460 2.298 2.215 2.433 . 0 0 "[ . 1 . 2]" 1
1827 1 76 LEU H 1 76 LEU HB3 . . 3.780 3.564 3.516 3.638 . 0 0 "[ . 1 . 2]" 1
1828 1 76 LEU H 1 76 LEU MD1 . . 3.820 3.632 3.350 3.809 . 0 0 "[ . 1 . 2]" 1
1829 1 76 LEU H 1 76 LEU MD2 . . 5.200 4.018 3.930 4.152 . 0 0 "[ . 1 . 2]" 1
1830 1 76 LEU H 1 76 LEU HG . . 3.310 2.932 2.714 3.165 . 0 0 "[ . 1 . 2]" 1
1831 1 76 LEU H 1 77 GLU H . . 4.740 4.576 4.512 4.619 . 0 0 "[ . 1 . 2]" 1
1832 1 76 LEU HA 1 76 LEU MD1 . . 4.570 3.862 3.834 3.911 . 0 0 "[ . 1 . 2]" 1
1833 1 76 LEU HA 1 76 LEU MD2 . . 3.290 2.292 2.043 2.556 . 0 0 "[ . 1 . 2]" 1
1834 1 76 LEU HA 1 76 LEU HG . . 4.170 2.774 2.672 2.886 . 0 0 "[ . 1 . 2]" 1
1835 1 76 LEU HA 1 77 GLU H . . 2.990 2.280 2.172 2.427 . 0 0 "[ . 1 . 2]" 1
1836 1 76 LEU HB2 1 76 LEU MD1 . . 3.340 2.142 2.004 2.293 . 0 0 "[ . 1 . 2]" 1
1837 1 76 LEU HB2 1 76 LEU MD2 . . 3.650 3.163 3.123 3.183 . 0 0 "[ . 1 . 2]" 1
1838 1 76 LEU HB2 1 77 GLU H . . 4.680 4.003 3.661 4.260 . 0 0 "[ . 1 . 2]" 1
1839 1 76 LEU HB3 1 76 LEU MD1 . . 3.430 2.524 2.412 2.634 . 0 0 "[ . 1 . 2]" 1
1840 1 76 LEU HB3 1 77 GLU H . . 3.670 2.785 2.365 3.173 . 0 0 "[ . 1 . 2]" 1
1841 1 76 LEU MD1 1 77 GLU H . . 5.240 4.741 4.419 5.006 . 0 0 "[ . 1 . 2]" 1
1842 1 76 LEU MD1 1 82 ILE MD . . 3.280 2.947 2.251 3.218 . 0 0 "[ . 1 . 2]" 1
1843 1 76 LEU MD1 1 82 ILE MG . . 4.030 3.309 3.041 3.658 . 0 0 "[ . 1 . 2]" 1
1844 1 76 LEU MD2 1 77 GLU H . . 3.670 3.001 2.676 3.439 . 0 0 "[ . 1 . 2]" 1
1845 1 76 LEU MD2 1 80 ASP H . . 5.500 5.371 5.058 5.500 . 0 0 "[ . 1 . 2]" 1
1846 1 76 LEU MD2 1 80 ASP QB . . 4.640 3.386 3.221 3.590 . 0 0 "[ . 1 . 2]" 1
1847 1 76 LEU MD2 1 82 ILE HB . . 4.080 2.678 2.482 2.879 . 0 0 "[ . 1 . 2]" 1
1848 1 76 LEU MD2 1 82 ILE MD . . 3.150 2.064 1.831 2.337 . 0 0 "[ . 1 . 2]" 1
1849 1 76 LEU MD2 1 82 ILE MG . . 4.170 2.722 2.260 3.237 . 0 0 "[ . 1 . 2]" 1
1850 1 76 LEU HG 1 82 ILE MD . . 4.200 3.673 3.363 4.022 . 0 0 "[ . 1 . 2]" 1
1851 1 77 GLU H 1 77 GLU QB . . 3.260 2.526 2.268 2.990 . 0 0 "[ . 1 . 2]" 1
1852 1 77 GLU H 1 77 GLU QG . . 4.250 3.149 2.029 4.177 . 0 0 "[ . 1 . 2]" 1
1853 1 77 GLU H 1 80 ASP HB2 . . 4.600 3.282 2.921 3.878 . 0 0 "[ . 1 . 2]" 1
1854 1 77 GLU H 1 80 ASP QB . . 3.990 2.921 2.595 3.103 . 0 0 "[ . 1 . 2]" 1
1855 1 77 GLU H 1 80 ASP HB3 . . 4.600 3.467 2.719 3.952 . 0 0 "[ . 1 . 2]" 1
1856 1 77 GLU HA 1 77 GLU QG . . 3.500 2.691 2.156 3.339 . 0 0 "[ . 1 . 2]" 1
1857 1 77 GLU HA 1 78 ASP H . . 3.100 2.374 2.212 2.649 . 0 0 "[ . 1 . 2]" 1
1858 1 77 GLU HA 1 78 ASP QB . . 4.770 4.310 4.165 4.578 . 0 0 "[ . 1 . 2]" 1
1859 1 77 GLU QB 1 78 ASP H . . 3.250 2.538 1.962 3.164 . 0 0 "[ . 1 . 2]" 1
1860 1 77 GLU HB2 1 78 ASP H . . 4.030 3.649 1.972 4.031 0.001 3 0 "[ . 1 . 2]" 1
1861 1 77 GLU HB3 1 78 ASP H . . 4.030 2.782 2.205 3.830 . 0 0 "[ . 1 . 2]" 1
1862 1 78 ASP H 1 78 ASP QB . . 3.030 2.351 2.136 2.689 . 0 0 "[ . 1 . 2]" 1
1863 1 78 ASP H 1 79 GLU H . . 4.680 4.621 4.586 4.642 . 0 0 "[ . 1 . 2]" 1
1864 1 78 ASP HA 1 79 GLU H . . 2.970 2.259 2.194 2.430 . 0 0 "[ . 1 . 2]" 1
1865 1 78 ASP HA 1 79 GLU HA . . 4.490 4.417 4.396 4.468 . 0 0 "[ . 1 . 2]" 1
1866 1 78 ASP HA 1 80 ASP H . . 4.120 3.831 3.499 3.984 . 0 0 "[ . 1 . 2]" 1
1867 1 78 ASP HA 1 80 ASP QB . . 5.340 4.362 4.191 4.557 . 0 0 "[ . 1 . 2]" 1
1868 1 78 ASP QB 1 79 GLU H . . 4.010 3.105 2.503 3.637 . 0 0 "[ . 1 . 2]" 1
1869 1 79 GLU H 1 79 GLU HG2 . . 4.280 3.390 2.582 4.282 0.002 15 0 "[ . 1 . 2]" 1
1870 1 79 GLU H 1 79 GLU QG . . 3.600 2.781 2.507 3.567 . 0 0 "[ . 1 . 2]" 1
1871 1 79 GLU H 1 79 GLU HG3 . . 4.280 3.235 2.583 4.207 . 0 0 "[ . 1 . 2]" 1
1872 1 79 GLU H 1 80 ASP H . . 3.520 2.865 2.733 3.054 . 0 0 "[ . 1 . 2]" 1
1873 1 79 GLU HA 1 79 GLU HG2 . . 3.960 2.672 2.204 3.699 . 0 0 "[ . 1 . 2]" 1
1874 1 79 GLU HA 1 79 GLU QG . . 3.390 2.451 2.166 2.644 . 0 0 "[ . 1 . 2]" 1
1875 1 79 GLU HA 1 79 GLU HG3 . . 3.960 3.152 2.445 3.765 . 0 0 "[ . 1 . 2]" 1
1876 1 79 GLU HB2 1 80 ASP H . . 4.680 4.341 4.201 4.435 . 0 0 "[ . 1 . 2]" 1
1877 1 80 ASP H 1 80 ASP HB2 . . 3.810 2.823 2.493 3.440 . 0 0 "[ . 1 . 2]" 1
1878 1 80 ASP H 1 80 ASP QB . . 3.090 2.544 2.453 2.666 . 0 0 "[ . 1 . 2]" 1
1879 1 80 ASP H 1 80 ASP HB3 . . 3.810 3.217 2.567 3.778 . 0 0 "[ . 1 . 2]" 1
1880 1 80 ASP H 1 81 VAL H . . 4.470 4.407 4.359 4.475 0.005 4 0 "[ . 1 . 2]" 1
1881 1 80 ASP HA 1 81 VAL H . . 3.110 2.217 2.166 2.273 . 0 0 "[ . 1 . 2]" 1
1882 1 80 ASP HA 1 81 VAL MG2 . . 4.820 3.563 3.382 3.686 . 0 0 "[ . 1 . 2]" 1
1883 1 80 ASP QB 1 81 VAL H . . 3.810 3.263 2.858 3.612 . 0 0 "[ . 1 . 2]" 1
1884 1 80 ASP HB2 1 81 VAL H . . 4.370 4.138 3.838 4.364 . 0 0 "[ . 1 . 2]" 1
1885 1 80 ASP HB3 1 81 VAL H . . 4.370 3.482 2.922 4.207 . 0 0 "[ . 1 . 2]" 1
1886 1 81 VAL H 1 81 VAL HB . . 3.430 2.520 2.473 2.590 . 0 0 "[ . 1 . 2]" 1
1887 1 81 VAL H 1 81 VAL MG1 . . 3.970 3.797 3.769 3.823 . 0 0 "[ . 1 . 2]" 1
1888 1 81 VAL H 1 81 VAL MG2 . . 3.650 2.603 2.422 2.742 . 0 0 "[ . 1 . 2]" 1
1889 1 81 VAL H 1 82 ILE H . . 5.000 4.487 4.442 4.534 . 0 0 "[ . 1 . 2]" 1
1890 1 81 VAL HA 1 81 VAL MG1 . . 3.540 2.417 2.298 2.492 . 0 0 "[ . 1 . 2]" 1
1891 1 81 VAL HA 1 81 VAL MG2 . . 3.300 2.381 2.323 2.469 . 0 0 "[ . 1 . 2]" 1
1892 1 81 VAL HA 1 82 ILE H . . 2.940 2.173 2.148 2.216 . 0 0 "[ . 1 . 2]" 1
1893 1 81 VAL HA 1 82 ILE MG . . 4.210 3.703 3.546 3.935 . 0 0 "[ . 1 . 2]" 1
1894 1 81 VAL HB 1 82 ILE H . . 4.750 4.116 3.958 4.240 . 0 0 "[ . 1 . 2]" 1
1895 1 81 VAL HB 1 82 ILE HA . . 5.420 4.743 4.606 4.835 . 0 0 "[ . 1 . 2]" 1
1896 1 81 VAL MG1 1 82 ILE H . . 3.420 2.345 2.008 2.646 . 0 0 "[ . 1 . 2]" 1
1897 1 81 VAL MG1 1 82 ILE MG . . 4.510 3.852 3.716 4.039 . 0 0 "[ . 1 . 2]" 1
1898 1 81 VAL MG2 1 82 ILE H . . 4.330 3.979 3.840 4.044 . 0 0 "[ . 1 . 2]" 1
1899 1 82 ILE H 1 82 ILE HB . . 3.720 3.165 2.938 3.337 . 0 0 "[ . 1 . 2]" 1
1900 1 82 ILE H 1 82 ILE MD . . 4.730 4.693 4.639 4.738 0.008 11 0 "[ . 1 . 2]" 1
1901 1 82 ILE H 1 82 ILE MG . . 3.160 2.112 1.915 2.347 . 0 0 "[ . 1 . 2]" 1
1902 1 82 ILE H 1 83 GLN H . . 4.840 4.390 4.281 4.484 . 0 0 "[ . 1 . 2]" 1
1903 1 82 ILE HA 1 82 ILE MD . . 4.090 3.747 3.622 3.850 . 0 0 "[ . 1 . 2]" 1
1904 1 82 ILE HA 1 82 ILE HG12 . . 4.000 3.129 2.995 3.245 . 0 0 "[ . 1 . 2]" 1
1905 1 82 ILE HA 1 82 ILE HG13 . . 3.580 2.422 2.258 2.569 . 0 0 "[ . 1 . 2]" 1
1906 1 82 ILE HA 1 83 GLN H . . 3.000 2.218 2.147 2.344 . 0 0 "[ . 1 . 2]" 1
1907 1 82 ILE HA 1 83 GLN QB . . 5.500 4.000 3.947 4.061 . 0 0 "[ . 1 . 2]" 1
1908 1 82 ILE HB 1 82 ILE MD . . 3.330 2.370 2.239 2.520 . 0 0 "[ . 1 . 2]" 1
1909 1 82 ILE HB 1 83 GLN H . . 4.310 4.059 3.886 4.198 . 0 0 "[ . 1 . 2]" 1
1910 1 82 ILE MD 1 82 ILE MG . . 2.970 2.086 1.919 2.289 . 0 0 "[ . 1 . 2]" 1
1911 1 82 ILE MD 1 83 GLN H . . 4.450 4.013 3.610 4.386 . 0 0 "[ . 1 . 2]" 1
1912 1 82 ILE MD 1 84 ILE H . . 5.040 4.731 4.475 4.994 . 0 0 "[ . 1 . 2]" 1
1913 1 82 ILE MD 1 84 ILE HA . . 4.840 4.153 3.848 4.509 . 0 0 "[ . 1 . 2]" 1
1914 1 82 ILE MD 1 84 ILE MD . . 3.520 2.129 1.930 2.555 . 0 0 "[ . 1 . 2]" 1
1915 1 82 ILE MD 1 84 ILE QG . . 4.510 3.353 2.924 3.569 . 0 0 "[ . 1 . 2]" 1
1916 1 82 ILE HG12 1 83 GLN H . . 3.500 2.671 2.011 3.052 . 0 0 "[ . 1 . 2]" 1
1917 1 82 ILE HG12 1 84 ILE H . . 4.420 3.657 3.485 4.111 . 0 0 "[ . 1 . 2]" 1
1918 1 82 ILE HG12 1 84 ILE MD . . 3.970 2.699 1.991 3.108 . 0 0 "[ . 1 . 2]" 1
1919 1 82 ILE HG12 1 84 ILE QG . . 4.400 3.128 2.757 3.487 . 0 0 "[ . 1 . 2]" 1
1920 1 82 ILE HG13 1 82 ILE MG . . 3.700 3.189 3.167 3.201 . 0 0 "[ . 1 . 2]" 1
1921 1 82 ILE HG13 1 83 GLN H . . 3.520 2.589 2.226 3.054 . 0 0 "[ . 1 . 2]" 1
1922 1 82 ILE HG13 1 84 ILE MD . . 4.250 3.857 3.283 4.175 . 0 0 "[ . 1 . 2]" 1
1923 1 82 ILE MG 1 83 GLN H . . 4.430 3.800 3.461 4.069 . 0 0 "[ . 1 . 2]" 1
1924 1 82 ILE MG 1 84 ILE MD . . 3.700 3.171 2.771 3.435 . 0 0 "[ . 1 . 2]" 1
1925 1 82 ILE MG 1 84 ILE QG . . 4.130 2.925 2.415 3.304 . 0 0 "[ . 1 . 2]" 1
1926 1 82 ILE MG 1 84 ILE MG . . 5.500 5.187 4.817 5.452 . 0 0 "[ . 1 . 2]" 1
1927 1 83 GLN H 1 83 GLN QB . . 3.500 2.410 2.318 2.514 . 0 0 "[ . 1 . 2]" 1
1928 1 83 GLN H 1 83 GLN HG2 . . 5.180 4.485 4.288 4.845 . 0 0 "[ . 1 . 2]" 1
1929 1 83 GLN H 1 83 GLN QG . . 4.500 3.978 3.801 4.125 . 0 0 "[ . 1 . 2]" 1
1930 1 83 GLN H 1 83 GLN HG3 . . 5.180 4.502 4.028 4.796 . 0 0 "[ . 1 . 2]" 1
1931 1 83 GLN H 1 84 ILE MD . . 5.500 4.627 4.170 5.245 . 0 0 "[ . 1 . 2]" 1
1932 1 83 GLN HA 1 84 ILE H . . 3.110 2.186 2.139 2.223 . 0 0 "[ . 1 . 2]" 1
1933 1 83 GLN QB 1 83 GLN HE22 . . 4.870 4.048 3.786 4.318 . 0 0 "[ . 1 . 2]" 1
1934 1 83 GLN QB 1 84 ILE H . . 4.060 3.957 3.836 4.005 . 0 0 "[ . 1 . 2]" 1
1935 1 83 GLN QB 1 85 VAL QG . . 4.790 3.596 3.193 4.360 . 0 0 "[ . 1 . 2]" 1
1936 1 83 GLN QE 1 85 VAL QG . . 4.040 3.100 1.961 4.026 . 0 0 "[ . 1 . 2]" 1
1937 1 83 GLN QG 1 84 ILE H . . 3.880 3.492 2.882 3.861 . 0 0 "[ . 1 . 2]" 1
1938 1 83 GLN QG 1 85 VAL QG . . 3.840 2.469 2.045 3.723 . 0 0 "[ . 1 . 2]" 1
1939 1 84 ILE H 1 84 ILE HB . . 3.080 2.452 2.357 2.535 . 0 0 "[ . 1 . 2]" 1
1940 1 84 ILE H 1 84 ILE MD . . 3.990 3.432 3.035 3.673 . 0 0 "[ . 1 . 2]" 1
1941 1 84 ILE H 1 84 ILE QG . . 3.210 2.325 2.172 2.528 . 0 0 "[ . 1 . 2]" 1
1942 1 84 ILE H 1 84 ILE MG . . 4.140 3.755 3.719 3.792 . 0 0 "[ . 1 . 2]" 1
1943 1 84 ILE H 1 85 VAL H . . 4.710 4.395 4.319 4.506 . 0 0 "[ . 1 . 2]" 1
1944 1 84 ILE H 1 85 VAL QG . . 5.000 4.542 4.284 5.031 0.031 7 0 "[ . 1 . 2]" 1
1945 1 84 ILE HA 1 84 ILE MD . . 3.070 2.002 1.928 2.152 . 0 0 "[ . 1 . 2]" 1
1946 1 84 ILE HA 1 84 ILE QG . . 3.610 2.857 2.717 2.999 . 0 0 "[ . 1 . 2]" 1
1947 1 84 ILE HA 1 84 ILE MG . . 3.190 2.386 2.272 2.462 . 0 0 "[ . 1 . 2]" 1
1948 1 84 ILE HA 1 85 VAL H . . 2.860 2.150 2.141 2.170 . 0 0 "[ . 1 . 2]" 1
1949 1 84 ILE HA 1 85 VAL QG . . 4.040 3.685 3.326 4.018 . 0 0 "[ . 1 . 2]" 1
1950 1 84 ILE HB 1 84 ILE MD . . 3.630 3.222 3.211 3.231 . 0 0 "[ . 1 . 2]" 1
1951 1 84 ILE HB 1 85 VAL H . . 4.640 4.379 4.236 4.462 . 0 0 "[ . 1 . 2]" 1
1952 1 84 ILE HB 1 85 VAL QG . . 5.280 5.037 4.834 5.283 0.003 7 0 "[ . 1 . 2]" 1
1953 1 84 ILE MD 1 84 ILE MG . . 2.860 2.049 1.906 2.236 . 0 0 "[ . 1 . 2]" 1
1954 1 84 ILE MD 1 85 VAL H . . 3.790 3.602 3.428 3.743 . 0 0 "[ . 1 . 2]" 1
1955 1 84 ILE QG 1 84 ILE MG . . 2.990 2.262 2.113 2.384 . 0 0 "[ . 1 . 2]" 1
1956 1 84 ILE QG 1 85 VAL H . . 4.760 4.697 4.632 4.762 0.002 16 0 "[ . 1 . 2]" 1
1957 1 84 ILE MG 1 85 VAL H . . 3.370 2.917 2.425 3.105 . 0 0 "[ . 1 . 2]" 1
1958 1 84 ILE MG 1 85 VAL HA . . 4.260 3.804 3.677 3.981 . 0 0 "[ . 1 . 2]" 1
1959 1 84 ILE MG 1 85 VAL HB . . 5.500 5.068 4.487 5.500 0.000 9 0 "[ . 1 . 2]" 1
1960 1 84 ILE MG 1 86 LYS H . . 4.630 4.395 3.642 4.630 0.000 17 0 "[ . 1 . 2]" 1
1961 1 84 ILE MG 1 86 LYS HB3 . . 5.500 5.404 5.049 5.500 0.000 19 0 "[ . 1 . 2]" 1
1962 1 84 ILE MG 1 86 LYS HE2 . . 4.450 3.925 2.945 4.447 . 0 0 "[ . 1 . 2]" 1
1963 1 84 ILE MG 1 86 LYS QE . . 3.780 3.309 2.890 3.599 . 0 0 "[ . 1 . 2]" 1
1964 1 84 ILE MG 1 86 LYS HE3 . . 4.450 3.723 2.932 4.451 0.001 17 0 "[ . 1 . 2]" 1
1965 1 84 ILE MG 1 86 LYS QG . . 3.560 3.034 2.540 3.340 . 0 0 "[ . 1 . 2]" 1
1966 1 85 VAL H 1 85 VAL HB . . 3.920 3.026 2.365 3.761 . 0 0 "[ . 1 . 2]" 1
1967 1 85 VAL H 1 85 VAL MG1 . . 3.930 3.029 1.853 3.781 . 0 0 "[ . 1 . 2]" 1
1968 1 85 VAL H 1 85 VAL QG . . 3.030 2.387 1.849 2.871 . 0 0 "[ . 1 . 2]" 1
1969 1 85 VAL H 1 85 VAL MG2 . . 3.930 2.683 2.114 3.767 . 0 0 "[ . 1 . 2]" 1
1970 1 85 VAL H 1 86 LYS H . . 4.690 4.478 4.213 4.560 . 0 0 "[ . 1 . 2]" 1
1971 1 85 VAL HA 1 85 VAL MG1 . . 3.300 2.526 2.320 3.173 . 0 0 "[ . 1 . 2]" 1
1972 1 85 VAL HA 1 85 VAL QG . . 2.780 2.216 2.026 2.418 . 0 0 "[ . 1 . 2]" 1
1973 1 85 VAL HA 1 85 VAL MG2 . . 3.300 2.640 2.154 3.197 . 0 0 "[ . 1 . 2]" 1
1974 1 85 VAL HA 1 86 LYS H . . 2.770 2.200 2.139 2.249 . 0 0 "[ . 1 . 2]" 1
1975 1 85 VAL HA 1 86 LYS HB2 . . 5.500 4.604 4.382 4.723 . 0 0 "[ . 1 . 2]" 1
1976 1 85 VAL HA 1 86 LYS QG . . 4.770 3.635 3.395 4.195 . 0 0 "[ . 1 . 2]" 1
1977 1 85 VAL HB 1 86 LYS H . . 4.800 3.654 2.795 4.472 . 0 0 "[ . 1 . 2]" 1
1978 1 85 VAL QG 1 86 LYS H . . 3.390 2.797 2.156 3.391 0.001 5 0 "[ . 1 . 2]" 1
1979 1 85 VAL QG 1 87 LYS HA . . 4.630 4.034 3.579 4.630 . 0 0 "[ . 1 . 2]" 1
1980 1 86 LYS H 1 86 LYS HB2 . . 3.220 2.532 2.290 2.647 . 0 0 "[ . 1 . 2]" 1
1981 1 86 LYS H 1 86 LYS HB3 . . 3.770 3.684 3.562 3.740 . 0 0 "[ . 1 . 2]" 1
1982 1 86 LYS H 1 86 LYS QD . . 4.220 4.058 3.646 4.221 0.001 15 0 "[ . 1 . 2]" 1
1983 1 86 LYS H 1 86 LYS HG2 . . 4.150 3.669 2.556 4.151 0.001 15 0 "[ . 1 . 2]" 1
1984 1 86 LYS H 1 86 LYS QG . . 3.380 2.599 2.233 2.881 . 0 0 "[ . 1 . 2]" 1
1985 1 86 LYS H 1 86 LYS HG3 . . 4.150 2.756 2.261 3.707 . 0 0 "[ . 1 . 2]" 1
1986 1 86 LYS HB2 1 87 LYS HA . . 5.500 5.351 4.990 5.498 . 0 0 "[ . 1 . 2]" 1
1987 1 86 LYS HB3 1 86 LYS QD . . 3.470 2.389 2.102 2.677 . 0 0 "[ . 1 . 2]" 1
1988 1 86 LYS HB3 1 87 LYS H . . 3.630 3.181 2.752 3.409 . 0 0 "[ . 1 . 2]" 1
1989 1 86 LYS QE 1 86 LYS QG . . 3.200 2.167 2.077 2.420 . 0 0 "[ . 1 . 2]" 1
1990 1 87 LYS H 1 87 LYS HB2 . . 3.730 2.903 2.314 3.607 . 0 0 "[ . 1 . 2]" 1
1991 1 87 LYS H 1 87 LYS HB3 . . 3.730 3.253 2.576 3.617 . 0 0 "[ . 1 . 2]" 1
1992 1 87 LYS H 1 87 LYS QD . . 4.180 3.603 2.066 4.174 . 0 0 "[ . 1 . 2]" 1
1993 1 87 LYS H 1 87 LYS HE2 . . 5.500 4.863 3.883 5.489 . 0 0 "[ . 1 . 2]" 1
1994 1 87 LYS H 1 87 LYS HE3 . . 5.500 4.708 3.714 5.535 0.035 16 0 "[ . 1 . 2]" 1
1995 1 87 LYS H 1 87 LYS HG2 . . 4.070 2.990 1.907 4.014 . 0 0 "[ . 1 . 2]" 1
1996 1 87 LYS H 1 87 LYS QG . . 3.190 2.199 1.837 3.158 . 0 0 "[ . 1 . 2]" 1
1997 1 87 LYS H 1 87 LYS HG3 . . 4.070 2.630 2.000 3.474 . 0 0 "[ . 1 . 2]" 1
1998 1 87 LYS HA 1 87 LYS QD . . 4.490 4.110 3.131 4.421 . 0 0 "[ . 1 . 2]" 1
1999 1 87 LYS HA 1 87 LYS HG2 . . 4.050 3.080 2.398 3.824 . 0 0 "[ . 1 . 2]" 1
2000 1 87 LYS HA 1 87 LYS QG . . 3.510 2.747 2.191 3.344 . 0 0 "[ . 1 . 2]" 1
2001 1 87 LYS HA 1 87 LYS HG3 . . 4.050 3.176 2.214 3.945 . 0 0 "[ . 1 . 2]" 1
2002 1 87 LYS QB 1 87 LYS QD . . 3.290 2.113 2.031 2.263 . 0 0 "[ . 1 . 2]" 1
2003 1 87 LYS QB 1 87 LYS QE . . 3.930 3.062 2.094 3.736 . 0 0 "[ . 1 . 2]" 1
2004 1 87 LYS QE 1 87 LYS QG . . 3.340 2.216 2.060 2.528 . 0 0 "[ . 1 . 2]" 1
2005 1 89 GLY QA 1 90 PRO HD2 . . 3.160 2.130 1.929 2.477 . 0 0 "[ . 1 . 2]" 1
2006 1 89 GLY QA 1 90 PRO QD . . 2.630 1.973 1.866 2.134 . 0 0 "[ . 1 . 2]" 1
2007 1 89 GLY QA 1 90 PRO HD3 . . 3.160 2.396 2.234 2.863 . 0 0 "[ . 1 . 2]" 1
2008 1 89 GLY QA 1 90 PRO QG . . 4.260 3.699 3.647 3.936 . 0 0 "[ . 1 . 2]" 1
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