NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
475973 |
2l08   |
17033 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2l08
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 1615
_Distance_constraint_stats_list.Viol_count 604
_Distance_constraint_stats_list.Viol_total 435.942
_Distance_constraint_stats_list.Viol_max 0.253
_Distance_constraint_stats_list.Viol_rms 0.0063
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0007
_Distance_constraint_stats_list.Viol_average_violations_only 0.0361
_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 9 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 VAL 0.334 0.047 10 0 "[ . 1 . 2]"
1 13 VAL 0.397 0.067 19 0 "[ . 1 . 2]"
1 14 ILE 1.698 0.100 7 0 "[ . 1 . 2]"
1 15 ARG 0.025 0.025 4 0 "[ . 1 . 2]"
1 16 ARG 0.176 0.091 20 0 "[ . 1 . 2]"
1 17 LEU 0.203 0.051 4 0 "[ . 1 . 2]"
1 19 PRO 0.173 0.072 1 0 "[ . 1 . 2]"
1 20 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 21 LEU 2.673 0.140 9 0 "[ . 1 . 2]"
1 22 THR 1.668 0.131 10 0 "[ . 1 . 2]"
1 23 LYS 0.790 0.092 2 0 "[ . 1 . 2]"
1 24 GLU 0.104 0.041 19 0 "[ . 1 . 2]"
1 25 GLN 1.722 0.098 5 0 "[ . 1 . 2]"
1 26 LEU 3.862 0.131 10 0 "[ . 1 . 2]"
1 27 GLU 0.519 0.121 7 0 "[ . 1 . 2]"
1 28 GLU 1.884 0.148 14 0 "[ . 1 . 2]"
1 29 GLN 0.798 0.089 14 0 "[ . 1 . 2]"
1 30 LEU 1.048 0.100 7 0 "[ . 1 . 2]"
1 31 ARG 1.370 0.148 14 0 "[ . 1 . 2]"
1 32 PRO 0.283 0.115 16 0 "[ . 1 . 2]"
1 33 LEU 0.316 0.046 10 0 "[ . 1 . 2]"
1 34 PRO 0.050 0.024 10 0 "[ . 1 . 2]"
1 35 ALA 0.026 0.021 3 0 "[ . 1 . 2]"
1 36 HIS 0.270 0.063 20 0 "[ . 1 . 2]"
1 37 ASP 0.577 0.207 10 0 "[ . 1 . 2]"
1 38 TYR 0.427 0.253 7 0 "[ . 1 . 2]"
1 39 PHE 0.449 0.080 16 0 "[ . 1 . 2]"
1 40 GLU 0.306 0.059 7 0 "[ . 1 . 2]"
1 41 PHE 0.407 0.253 7 0 "[ . 1 . 2]"
1 42 PHE 0.066 0.044 14 0 "[ . 1 . 2]"
1 43 ALA 0.016 0.016 12 0 "[ . 1 . 2]"
1 44 ALA 0.003 0.003 20 0 "[ . 1 . 2]"
1 46 LEU 0.750 0.140 9 0 "[ . 1 . 2]"
1 53 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 54 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 ARG 0.238 0.044 14 0 "[ . 1 . 2]"
1 56 ALA 0.117 0.051 4 0 "[ . 1 . 2]"
1 57 TYR 0.327 0.103 10 0 "[ . 1 . 2]"
1 58 ILE 0.340 0.103 10 0 "[ . 1 . 2]"
1 59 ASN 0.225 0.047 2 0 "[ . 1 . 2]"
1 60 PHE 0.083 0.037 20 0 "[ . 1 . 2]"
1 61 ARG 0.526 0.207 10 0 "[ . 1 . 2]"
1 62 ASN 0.488 0.065 20 0 "[ . 1 . 2]"
1 63 PRO 0.287 0.061 5 0 "[ . 1 . 2]"
1 64 ASP 0.349 0.045 4 0 "[ . 1 . 2]"
1 65 ASP 0.561 0.065 20 0 "[ . 1 . 2]"
1 66 ILE 0.148 0.035 9 0 "[ . 1 . 2]"
1 67 LEU 0.156 0.089 17 0 "[ . 1 . 2]"
1 68 LEU 1.647 0.109 19 0 "[ . 1 . 2]"
1 69 PHE 1.490 0.109 19 0 "[ . 1 . 2]"
1 70 ARG 0.211 0.102 8 0 "[ . 1 . 2]"
1 71 ASP 0.375 0.102 8 0 "[ . 1 . 2]"
1 72 ARG 0.145 0.029 4 0 "[ . 1 . 2]"
1 73 PHE 0.105 0.023 12 0 "[ . 1 . 2]"
1 74 ASP 0.055 0.055 19 0 "[ . 1 . 2]"
1 75 GLY 0.297 0.060 9 0 "[ . 1 . 2]"
1 76 TYR 0.616 0.081 9 0 "[ . 1 . 2]"
1 77 ILE 0.544 0.055 16 0 "[ . 1 . 2]"
1 78 PHE 0.222 0.040 10 0 "[ . 1 . 2]"
1 79 LEU 1.651 0.081 3 0 "[ . 1 . 2]"
1 80 ASP 0.608 0.041 9 0 "[ . 1 . 2]"
1 81 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 82 LYS 0.101 0.033 2 0 "[ . 1 . 2]"
1 83 GLY 0.244 0.049 5 0 "[ . 1 . 2]"
1 84 LEU 0.012 0.012 17 0 "[ . 1 . 2]"
1 85 GLU 1.005 0.081 3 0 "[ . 1 . 2]"
1 86 TYR 0.457 0.036 7 0 "[ . 1 . 2]"
1 87 PRO 0.610 0.064 19 0 "[ . 1 . 2]"
1 88 ALA 1.145 0.078 20 0 "[ . 1 . 2]"
1 89 VAL 0.282 0.091 20 0 "[ . 1 . 2]"
1 90 VAL 0.119 0.057 20 0 "[ . 1 . 2]"
1 91 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 PHE 0.535 0.068 10 0 "[ . 1 . 2]"
1 93 ALA 0.545 0.068 10 0 "[ . 1 . 2]"
1 94 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 95 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 96 GLN 0.890 0.177 19 0 "[ . 1 . 2]"
1 97 LYS 0.836 0.177 19 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 9 SER HA 1 66 ILE MD 5.160 . 6.190 3.793 2.846 5.205 . 0 0 "[ . 1 . 2]" 1
2 1 10 HIS H 1 66 ILE MD 4.320 . 5.180 2.729 1.856 4.527 . 0 0 "[ . 1 . 2]" 1
3 1 10 HIS HA 1 66 ILE MD 4.800 . 5.760 4.221 2.047 5.080 . 0 0 "[ . 1 . 2]" 1
4 1 10 HIS QB 1 66 ILE MD 3.980 . 4.780 2.827 1.856 4.702 . 0 0 "[ . 1 . 2]" 1
5 1 10 HIS HB2 1 66 ILE MD 4.770 . 5.720 3.092 1.865 5.442 . 0 0 "[ . 1 . 2]" 1
6 1 10 HIS HB3 1 66 ILE MD 4.770 . 5.720 3.862 2.225 5.172 . 0 0 "[ . 1 . 2]" 1
7 1 12 VAL HA 1 12 VAL MG1 3.470 . 4.160 2.429 2.331 2.535 . 0 0 "[ . 1 . 2]" 1
8 1 12 VAL HA 1 12 VAL MG2 3.470 . 4.160 2.406 2.322 2.509 . 0 0 "[ . 1 . 2]" 1
9 1 12 VAL HA 1 13 VAL H 3.310 . 3.970 2.227 2.159 2.377 . 0 0 "[ . 1 . 2]" 1
10 1 12 VAL HA 1 13 VAL QG 4.570 . 4.860 3.242 3.157 3.328 . 0 0 "[ . 1 . 2]" 1
11 1 12 VAL HA 1 92 PHE HA 4.130 . 4.960 2.147 1.753 3.049 0.047 10 0 "[ . 1 . 2]" 1
12 1 12 VAL HA 1 93 ALA H 2.910 . 3.490 2.721 1.790 3.222 0.010 3 0 "[ . 1 . 2]" 1
13 1 12 VAL HB 1 13 VAL H 4.330 . 5.200 4.109 3.750 4.332 . 0 0 "[ . 1 . 2]" 1
14 1 12 VAL HB 1 13 VAL HA 5.430 . 6.520 4.900 4.594 5.041 . 0 0 "[ . 1 . 2]" 1
15 1 12 VAL HB 1 58 ILE HB 5.540 . 6.650 3.896 2.328 5.453 . 0 0 "[ . 1 . 2]" 1
16 1 12 VAL HB 1 60 PHE H 5.010 . 6.010 4.585 3.053 6.015 0.005 10 0 "[ . 1 . 2]" 1
17 1 12 VAL HB 1 60 PHE QD 4.390 . 5.270 2.511 1.763 3.142 0.037 20 0 "[ . 1 . 2]" 1
18 1 12 VAL HB 1 60 PHE QE 4.410 . 5.290 2.556 1.923 3.677 . 0 0 "[ . 1 . 2]" 1
19 1 12 VAL HB 1 66 ILE MD 5.970 . 7.160 4.755 3.513 5.850 . 0 0 "[ . 1 . 2]" 1
20 1 12 VAL HB 1 66 ILE HG12 5.710 . 6.850 4.385 3.286 5.678 . 0 0 "[ . 1 . 2]" 1
21 1 12 VAL HB 1 90 VAL QG 4.440 . 5.330 3.822 3.138 4.211 . 0 0 "[ . 1 . 2]" 1
22 1 12 VAL HB 1 92 PHE HA 5.600 . 6.720 4.571 4.056 4.986 . 0 0 "[ . 1 . 2]" 1
23 1 12 VAL QG 1 13 VAL H 3.320 . 3.980 2.524 1.991 3.115 . 0 0 "[ . 1 . 2]" 1
24 1 12 VAL QG 1 13 VAL HA 3.890 . 4.670 3.740 3.327 4.237 . 0 0 "[ . 1 . 2]" 1
25 1 12 VAL QG 1 13 VAL QG 4.730 . 5.680 3.462 3.200 3.727 . 0 0 "[ . 1 . 2]" 1
26 1 12 VAL QG 1 58 ILE HB 4.240 . 5.090 3.800 2.640 4.686 . 0 0 "[ . 1 . 2]" 1
27 1 12 VAL QG 1 60 PHE H 4.780 . 5.740 4.271 2.971 5.112 . 0 0 "[ . 1 . 2]" 1
28 1 12 VAL QG 1 60 PHE HB2 4.160 . 4.990 3.368 2.227 4.260 . 0 0 "[ . 1 . 2]" 1
29 1 12 VAL QG 1 60 PHE QD 3.110 . 3.730 2.938 2.245 3.518 . 0 0 "[ . 1 . 2]" 1
30 1 12 VAL QG 1 60 PHE QE 3.430 . 4.120 2.776 2.211 3.236 . 0 0 "[ . 1 . 2]" 1
31 1 12 VAL QG 1 63 PRO HA 5.630 . 6.760 5.637 5.075 6.553 . 0 0 "[ . 1 . 2]" 1
32 1 12 VAL QG 1 66 ILE HA 4.190 . 5.030 3.649 3.159 3.970 . 0 0 "[ . 1 . 2]" 1
33 1 12 VAL QG 1 66 ILE MD 2.920 . 3.500 2.694 2.127 3.494 . 0 0 "[ . 1 . 2]" 1
34 1 12 VAL QG 1 66 ILE HG12 3.450 . 4.140 2.874 2.441 3.493 . 0 0 "[ . 1 . 2]" 1
35 1 12 VAL QG 1 66 ILE HG13 5.530 . 6.640 4.214 3.770 4.886 . 0 0 "[ . 1 . 2]" 1
36 1 12 VAL QG 1 66 ILE MG 3.000 . 3.600 2.060 1.765 2.611 0.035 9 0 "[ . 1 . 2]" 1
37 1 12 VAL QG 1 70 ARG QB 4.050 . 4.860 3.585 2.631 4.263 . 0 0 "[ . 1 . 2]" 1
38 1 12 VAL QG 1 90 VAL HA 4.040 . 4.850 3.823 3.353 4.216 . 0 0 "[ . 1 . 2]" 1
39 1 12 VAL QG 1 90 VAL HB 4.310 . 5.170 4.192 3.928 4.444 . 0 0 "[ . 1 . 2]" 1
40 1 12 VAL QG 1 91 GLU H 3.990 . 4.790 3.067 2.468 3.485 . 0 0 "[ . 1 . 2]" 1
41 1 12 VAL QG 1 92 PHE HA 3.700 . 4.440 2.294 1.781 2.801 0.019 3 0 "[ . 1 . 2]" 1
42 1 12 VAL QG 1 92 PHE QB 3.880 . 4.660 2.690 1.938 3.822 . 0 0 "[ . 1 . 2]" 1
43 1 12 VAL QG 1 93 ALA H 3.600 . 4.320 3.507 2.592 3.956 . 0 0 "[ . 1 . 2]" 1
44 1 12 VAL QG 1 93 ALA MB 4.720 . 5.660 4.280 3.600 4.854 . 0 0 "[ . 1 . 2]" 1
45 1 12 VAL MG1 1 60 PHE QD 3.780 . 4.540 3.863 2.996 4.444 . 0 0 "[ . 1 . 2]" 1
46 1 12 VAL MG1 1 60 PHE QE 4.460 . 5.350 2.944 2.270 3.453 . 0 0 "[ . 1 . 2]" 1
47 1 12 VAL MG1 1 66 ILE HG13 6.500 . 7.800 6.154 5.548 7.203 . 0 0 "[ . 1 . 2]" 1
48 1 12 VAL MG1 1 66 ILE MG 3.540 . 4.250 3.299 2.472 4.280 0.030 12 0 "[ . 1 . 2]" 1
49 1 12 VAL MG1 1 92 PHE HA 4.650 . 5.580 2.628 1.948 3.403 . 0 0 "[ . 1 . 2]" 1
50 1 12 VAL MG1 1 93 ALA H 4.640 . 5.570 4.318 3.332 4.963 . 0 0 "[ . 1 . 2]" 1
51 1 12 VAL MG2 1 60 PHE QD 3.780 . 4.540 3.108 2.298 4.096 . 0 0 "[ . 1 . 2]" 1
52 1 12 VAL MG2 1 60 PHE QE 4.460 . 5.350 3.576 2.462 4.837 . 0 0 "[ . 1 . 2]" 1
53 1 12 VAL MG2 1 66 ILE HG13 6.500 . 7.800 4.294 3.836 4.970 . 0 0 "[ . 1 . 2]" 1
54 1 12 VAL MG2 1 66 ILE MG 3.540 . 4.250 2.084 1.771 2.649 0.029 9 0 "[ . 1 . 2]" 1
55 1 12 VAL MG2 1 92 PHE HA 4.650 . 5.580 2.604 2.060 3.439 . 0 0 "[ . 1 . 2]" 1
56 1 12 VAL MG2 1 93 ALA H 4.640 . 5.570 3.720 2.702 4.232 . 0 0 "[ . 1 . 2]" 1
57 1 13 VAL H 1 13 VAL HB 4.020 . 4.820 3.780 3.682 3.858 . 0 0 "[ . 1 . 2]" 1
58 1 13 VAL H 1 13 VAL QG 3.540 . 3.640 2.044 1.930 2.189 . 0 0 "[ . 1 . 2]" 1
59 1 13 VAL H 1 14 ILE HA 5.660 . 6.790 5.070 4.801 5.310 . 0 0 "[ . 1 . 2]" 1
60 1 13 VAL H 1 90 VAL HA 6.140 . 7.370 5.178 4.806 5.447 . 0 0 "[ . 1 . 2]" 1
61 1 13 VAL H 1 91 GLU HA 5.860 . 7.030 5.022 4.864 5.379 . 0 0 "[ . 1 . 2]" 1
62 1 13 VAL H 1 91 GLU HG2 4.850 . 5.820 4.679 4.004 5.170 . 0 0 "[ . 1 . 2]" 1
63 1 13 VAL H 1 91 GLU HG3 4.850 . 5.820 3.865 3.338 4.295 . 0 0 "[ . 1 . 2]" 1
64 1 13 VAL H 1 92 PHE HA 4.090 . 4.910 3.106 2.430 3.760 . 0 0 "[ . 1 . 2]" 1
65 1 13 VAL H 1 93 ALA H 4.040 . 4.850 3.812 3.275 4.383 . 0 0 "[ . 1 . 2]" 1
66 1 13 VAL H 1 93 ALA HA 6.120 . 7.340 4.931 4.051 6.072 . 0 0 "[ . 1 . 2]" 1
67 1 13 VAL H 1 93 ALA MB 4.360 . 5.230 3.761 3.124 5.049 . 0 0 "[ . 1 . 2]" 1
68 1 13 VAL HA 1 14 ILE H 3.400 . 4.080 2.438 2.156 2.665 . 0 0 "[ . 1 . 2]" 1
69 1 13 VAL HA 1 14 ILE MG 4.140 . 4.970 3.935 3.686 4.229 . 0 0 "[ . 1 . 2]" 1
70 1 13 VAL HA 1 57 TYR HA 4.270 . 5.120 3.197 2.290 4.311 . 0 0 "[ . 1 . 2]" 1
71 1 13 VAL HA 1 57 TYR QD 4.840 . 5.810 4.093 3.112 5.096 . 0 0 "[ . 1 . 2]" 1
72 1 13 VAL HA 1 58 ILE H 4.150 . 4.980 2.563 2.023 3.130 . 0 0 "[ . 1 . 2]" 1
73 1 13 VAL HA 1 58 ILE QG 4.280 . 5.140 3.615 2.831 4.342 . 0 0 "[ . 1 . 2]" 1
74 1 13 VAL HB 1 14 ILE H 3.970 . 4.760 2.370 1.911 3.331 . 0 0 "[ . 1 . 2]" 1
75 1 13 VAL HB 1 14 ILE MG 4.040 . 4.850 3.980 3.355 4.405 . 0 0 "[ . 1 . 2]" 1
76 1 13 VAL HB 1 57 TYR HA 5.010 . 6.010 3.350 2.227 4.235 . 0 0 "[ . 1 . 2]" 1
77 1 13 VAL HB 1 57 TYR QD 4.310 . 5.170 3.217 1.998 4.425 . 0 0 "[ . 1 . 2]" 1
78 1 13 VAL HB 1 57 TYR QE 4.190 . 5.030 4.159 2.757 4.887 . 0 0 "[ . 1 . 2]" 1
79 1 13 VAL HB 1 91 GLU QG 5.110 . 6.130 4.667 4.219 5.408 . 0 0 "[ . 1 . 2]" 1
80 1 13 VAL HB 1 93 ALA MB 5.310 . 6.370 4.749 3.960 5.883 . 0 0 "[ . 1 . 2]" 1
81 1 13 VAL QG 1 14 ILE H 3.610 . 4.330 3.065 2.757 3.557 . 0 0 "[ . 1 . 2]" 1
82 1 13 VAL QG 1 14 ILE MG 5.190 . 6.230 4.135 3.762 4.426 . 0 0 "[ . 1 . 2]" 1
83 1 13 VAL QG 1 15 ARG H 4.630 . 5.560 4.501 3.706 5.141 . 0 0 "[ . 1 . 2]" 1
84 1 13 VAL QG 1 57 TYR HA 4.800 . 5.410 3.157 2.199 4.090 . 0 0 "[ . 1 . 2]" 1
85 1 13 VAL QG 1 57 TYR HB3 5.370 . 6.440 3.001 2.163 3.695 . 0 0 "[ . 1 . 2]" 1
86 1 13 VAL QG 1 57 TYR QD 4.370 . 4.620 1.970 1.756 2.352 0.044 13 0 "[ . 1 . 2]" 1
87 1 13 VAL QG 1 57 TYR QE 3.850 . 4.620 2.914 2.465 3.440 . 0 0 "[ . 1 . 2]" 1
88 1 13 VAL QG 1 58 ILE H 4.850 . 4.980 3.018 1.761 3.998 0.039 16 0 "[ . 1 . 2]" 1
89 1 13 VAL QG 1 91 GLU HB2 5.230 . 6.280 4.334 3.810 4.946 . 0 0 "[ . 1 . 2]" 1
90 1 13 VAL QG 1 91 GLU HB3 5.730 . 6.880 4.635 4.218 5.232 . 0 0 "[ . 1 . 2]" 1
91 1 13 VAL QG 1 91 GLU QG 4.180 . 5.020 2.300 1.917 2.931 . 0 0 "[ . 1 . 2]" 1
92 1 13 VAL QG 1 93 ALA H 4.730 . 5.680 3.513 3.058 3.989 . 0 0 "[ . 1 . 2]" 1
93 1 13 VAL QG 1 93 ALA MB 4.030 . 4.640 2.207 1.733 3.172 0.067 19 0 "[ . 1 . 2]" 1
94 1 14 ILE H 1 14 ILE HB 3.910 . 4.690 2.905 2.411 3.218 . 0 0 "[ . 1 . 2]" 1
95 1 14 ILE H 1 14 ILE MD 4.720 . 5.660 4.385 3.938 4.803 . 0 0 "[ . 1 . 2]" 1
96 1 14 ILE H 1 14 ILE HG12 4.880 . 5.860 4.778 4.511 4.950 . 0 0 "[ . 1 . 2]" 1
97 1 14 ILE H 1 14 ILE MG 3.490 . 4.190 2.145 1.947 2.363 . 0 0 "[ . 1 . 2]" 1
98 1 14 ILE H 1 15 ARG H 4.910 . 5.890 4.470 4.226 4.661 . 0 0 "[ . 1 . 2]" 1
99 1 14 ILE H 1 56 ALA MB 5.290 . 6.350 4.692 3.829 5.987 . 0 0 "[ . 1 . 2]" 1
100 1 14 ILE H 1 57 TYR HA 4.310 . 5.170 3.074 2.599 3.630 . 0 0 "[ . 1 . 2]" 1
101 1 14 ILE H 1 57 TYR QD 5.970 . 7.160 4.537 3.071 5.467 . 0 0 "[ . 1 . 2]" 1
102 1 14 ILE H 1 58 ILE H 4.030 . 4.840 3.754 2.470 4.656 . 0 0 "[ . 1 . 2]" 1
103 1 14 ILE H 1 58 ILE HB 4.760 . 5.710 4.705 3.719 5.690 . 0 0 "[ . 1 . 2]" 1
104 1 14 ILE H 1 58 ILE QG 6.500 . 7.800 3.559 2.969 4.270 . 0 0 "[ . 1 . 2]" 1
105 1 14 ILE HA 1 14 ILE MD 3.920 . 4.700 2.455 1.954 3.807 . 0 0 "[ . 1 . 2]" 1
106 1 14 ILE HA 1 14 ILE MG 3.500 . 4.200 3.227 3.212 3.235 . 0 0 "[ . 1 . 2]" 1
107 1 14 ILE HA 1 15 ARG H 3.310 . 3.970 2.255 2.124 2.381 . 0 0 "[ . 1 . 2]" 1
108 1 14 ILE HA 1 88 ALA MB 5.870 . 7.040 5.107 4.730 5.692 . 0 0 "[ . 1 . 2]" 1
109 1 14 ILE HA 1 90 VAL H 5.390 . 6.470 4.844 4.468 5.337 . 0 0 "[ . 1 . 2]" 1
110 1 14 ILE HA 1 91 GLU H 6.500 . 7.800 3.333 2.800 3.696 . 0 0 "[ . 1 . 2]" 1
111 1 14 ILE HB 1 14 ILE MD 3.110 . 3.730 2.354 2.297 2.441 . 0 0 "[ . 1 . 2]" 1
112 1 14 ILE HB 1 30 LEU HA 4.720 . 5.660 5.291 4.525 5.746 0.086 17 0 "[ . 1 . 2]" 1
113 1 14 ILE HB 1 30 LEU HB3 5.150 . 6.180 4.551 3.900 5.496 . 0 0 "[ . 1 . 2]" 1
114 1 14 ILE HB 1 30 LEU QD 4.230 . 5.080 3.150 2.448 4.025 . 0 0 "[ . 1 . 2]" 1
115 1 14 ILE HB 1 58 ILE MD 4.200 . 5.040 2.409 1.973 3.086 . 0 0 "[ . 1 . 2]" 1
116 1 14 ILE HB 1 58 ILE QG 5.250 . 6.300 3.060 2.112 3.596 . 0 0 "[ . 1 . 2]" 1
117 1 14 ILE MD 1 14 ILE MG 3.060 . 3.670 2.979 1.935 3.257 . 0 0 "[ . 1 . 2]" 1
118 1 14 ILE MD 1 15 ARG H 4.020 . 4.820 3.063 2.180 4.628 . 0 0 "[ . 1 . 2]" 1
119 1 14 ILE MD 1 17 LEU QD 3.660 . 4.390 2.962 2.066 3.403 . 0 0 "[ . 1 . 2]" 1
120 1 14 ILE MD 1 30 LEU H 5.320 . 6.380 6.232 5.287 6.480 0.100 7 0 "[ . 1 . 2]" 1
121 1 14 ILE MD 1 30 LEU HA 3.680 . 4.420 4.124 3.324 4.463 0.043 12 0 "[ . 1 . 2]" 1
122 1 14 ILE MD 1 30 LEU HB2 5.340 . 6.410 5.658 4.601 6.279 . 0 0 "[ . 1 . 2]" 1
123 1 14 ILE MD 1 30 LEU HB3 4.320 . 5.180 4.447 3.335 5.204 0.024 14 0 "[ . 1 . 2]" 1
124 1 14 ILE MD 1 30 LEU QD 3.150 . 3.780 2.394 1.742 2.986 0.058 19 0 "[ . 1 . 2]" 1
125 1 14 ILE MD 1 58 ILE MD 3.360 . 4.030 2.863 2.231 3.306 . 0 0 "[ . 1 . 2]" 1
126 1 14 ILE MD 1 73 PHE QD 4.430 . 5.320 4.320 2.733 4.752 . 0 0 "[ . 1 . 2]" 1
127 1 14 ILE MD 1 73 PHE QE 4.930 . 5.920 5.480 3.380 5.808 . 0 0 "[ . 1 . 2]" 1
128 1 14 ILE MD 1 76 TYR H 5.530 . 6.640 5.045 4.506 5.970 . 0 0 "[ . 1 . 2]" 1
129 1 14 ILE MD 1 76 TYR QD 5.310 . 6.370 4.378 3.845 5.235 . 0 0 "[ . 1 . 2]" 1
130 1 14 ILE MD 1 76 TYR QE 4.420 . 5.300 4.411 2.450 5.375 0.075 5 0 "[ . 1 . 2]" 1
131 1 14 ILE MD 1 88 ALA HA 3.860 . 4.630 2.903 2.120 3.822 . 0 0 "[ . 1 . 2]" 1
132 1 14 ILE MD 1 88 ALA MB 3.200 . 3.840 1.799 1.739 2.106 0.061 19 0 "[ . 1 . 2]" 1
133 1 14 ILE MD 1 89 VAL HB 5.910 . 7.090 4.787 4.088 6.251 . 0 0 "[ . 1 . 2]" 1
134 1 14 ILE MD 1 90 VAL HA 4.540 . 5.450 2.812 2.288 4.099 . 0 0 "[ . 1 . 2]" 1
135 1 14 ILE HG12 1 14 ILE MG 3.540 . 4.250 2.286 2.211 2.434 . 0 0 "[ . 1 . 2]" 1
136 1 14 ILE HG12 1 15 ARG H 3.720 . 4.460 3.858 2.548 4.485 0.025 4 0 "[ . 1 . 2]" 1
137 1 14 ILE HG12 1 17 LEU QD 3.970 . 4.760 2.206 1.880 2.448 . 0 0 "[ . 1 . 2]" 1
138 1 14 ILE HG12 1 88 ALA MB 3.640 . 4.370 3.072 2.469 3.934 . 0 0 "[ . 1 . 2]" 1
139 1 14 ILE HG13 1 15 ARG H 4.910 . 5.890 2.525 1.907 3.280 . 0 0 "[ . 1 . 2]" 1
140 1 14 ILE HG13 1 17 LEU QD 4.340 . 5.210 2.304 1.830 3.381 . 0 0 "[ . 1 . 2]" 1
141 1 14 ILE HG13 1 88 ALA MB 4.030 . 4.840 3.328 2.738 4.032 . 0 0 "[ . 1 . 2]" 1
142 1 14 ILE HG13 1 90 VAL HA 4.450 . 5.340 4.197 2.560 5.027 . 0 0 "[ . 1 . 2]" 1
143 1 14 ILE MG 1 15 ARG H 3.780 . 4.540 3.764 3.336 4.093 . 0 0 "[ . 1 . 2]" 1
144 1 14 ILE MG 1 17 LEU QD 3.160 . 3.790 2.210 1.840 2.905 . 0 0 "[ . 1 . 2]" 1
145 1 14 ILE MG 1 17 LEU HG 3.630 . 4.360 3.005 2.443 3.419 . 0 0 "[ . 1 . 2]" 1
146 1 14 ILE MG 1 30 LEU HB2 4.850 . 5.820 4.816 4.303 5.630 . 0 0 "[ . 1 . 2]" 1
147 1 14 ILE MG 1 30 LEU QD 3.840 . 4.610 2.146 1.728 2.536 0.072 14 0 "[ . 1 . 2]" 1
148 1 14 ILE MG 1 41 PHE QD 5.270 . 6.320 4.324 3.811 5.001 . 0 0 "[ . 1 . 2]" 1
149 1 14 ILE MG 1 41 PHE QE 4.470 . 5.360 4.112 3.260 5.146 . 0 0 "[ . 1 . 2]" 1
150 1 14 ILE MG 1 56 ALA H 3.850 . 4.620 3.053 1.843 4.252 . 0 0 "[ . 1 . 2]" 1
151 1 14 ILE MG 1 56 ALA MB 3.240 . 3.890 2.356 1.882 3.491 . 0 0 "[ . 1 . 2]" 1
152 1 14 ILE MG 1 57 TYR H 4.440 . 5.330 4.071 3.649 4.560 . 0 0 "[ . 1 . 2]" 1
153 1 14 ILE MG 1 57 TYR HA 4.540 . 5.450 3.154 1.989 4.358 . 0 0 "[ . 1 . 2]" 1
154 1 14 ILE MG 1 57 TYR QD 4.750 . 5.700 4.800 3.938 5.357 . 0 0 "[ . 1 . 2]" 1
155 1 14 ILE MG 1 58 ILE H 4.590 . 5.510 4.161 3.034 5.362 . 0 0 "[ . 1 . 2]" 1
156 1 14 ILE MG 1 58 ILE QG 4.110 . 4.930 2.872 2.302 4.056 . 0 0 "[ . 1 . 2]" 1
157 1 15 ARG H 1 88 ALA MB 5.090 . 6.110 4.835 4.305 5.527 . 0 0 "[ . 1 . 2]" 1
158 1 15 ARG H 1 89 VAL H 4.050 . 4.860 3.183 2.669 3.559 . 0 0 "[ . 1 . 2]" 1
159 1 15 ARG H 1 89 VAL HA 5.170 . 6.200 4.687 4.434 4.872 . 0 0 "[ . 1 . 2]" 1
160 1 15 ARG H 1 89 VAL HB 4.630 . 5.560 3.501 3.040 5.235 . 0 0 "[ . 1 . 2]" 1
161 1 15 ARG H 1 89 VAL MG1 4.590 . 5.510 4.059 2.752 4.617 . 0 0 "[ . 1 . 2]" 1
162 1 15 ARG H 1 89 VAL MG2 4.590 . 5.510 4.608 4.326 4.921 . 0 0 "[ . 1 . 2]" 1
163 1 15 ARG H 1 91 GLU H 5.310 . 6.370 4.431 3.754 4.904 . 0 0 "[ . 1 . 2]" 1
164 1 15 ARG H 1 91 GLU QG 4.490 . 5.390 4.105 3.293 4.740 . 0 0 "[ . 1 . 2]" 1
165 1 16 ARG HA 1 16 ARG HD2 5.480 . 6.580 3.602 1.986 4.745 . 0 0 "[ . 1 . 2]" 1
166 1 16 ARG HA 1 16 ARG QD 4.750 . 5.700 3.085 1.977 4.177 . 0 0 "[ . 1 . 2]" 1
167 1 16 ARG HA 1 16 ARG HD3 5.480 . 6.580 3.675 2.008 4.791 . 0 0 "[ . 1 . 2]" 1
168 1 16 ARG HA 1 17 LEU HA 4.590 . 5.510 4.641 4.430 4.827 . 0 0 "[ . 1 . 2]" 1
169 1 16 ARG HA 1 17 LEU HB2 4.800 . 5.760 5.217 4.795 5.513 . 0 0 "[ . 1 . 2]" 1
170 1 16 ARG HA 1 89 VAL HB 6.030 . 7.240 5.732 5.216 7.331 0.091 20 0 "[ . 1 . 2]" 1
171 1 16 ARG QB 1 75 GLY HA2 6.270 . 7.520 5.660 4.667 6.443 . 0 0 "[ . 1 . 2]" 1
172 1 16 ARG QB 1 87 PRO QD 5.080 . 6.100 3.418 2.063 4.759 . 0 0 "[ . 1 . 2]" 1
173 1 16 ARG QB 1 89 VAL H 4.410 . 5.290 2.912 2.347 3.476 . 0 0 "[ . 1 . 2]" 1
174 1 16 ARG QB 1 89 VAL HB 4.810 . 5.770 3.412 2.626 4.273 . 0 0 "[ . 1 . 2]" 1
175 1 16 ARG QB 1 89 VAL QG 4.550 . 5.460 2.671 2.040 3.186 . 0 0 "[ . 1 . 2]" 1
176 1 16 ARG HB2 1 88 ALA HA 6.500 . 7.800 3.981 2.197 5.981 . 0 0 "[ . 1 . 2]" 1
177 1 16 ARG HB3 1 88 ALA HA 6.500 . 7.800 4.719 2.819 5.893 . 0 0 "[ . 1 . 2]" 1
178 1 16 ARG QD 1 89 VAL QG 3.370 . 4.040 2.987 1.816 4.082 0.042 14 0 "[ . 1 . 2]" 1
179 1 16 ARG QG 1 89 VAL HB 5.610 . 6.730 3.480 2.246 5.858 . 0 0 "[ . 1 . 2]" 1
180 1 17 LEU H 1 17 LEU HB2 3.930 . 4.720 2.340 2.252 2.508 . 0 0 "[ . 1 . 2]" 1
181 1 17 LEU H 1 17 LEU QD 4.090 . 4.910 2.383 1.951 3.591 . 0 0 "[ . 1 . 2]" 1
182 1 17 LEU H 1 55 ARG HA 4.800 . 5.760 4.719 4.038 5.454 . 0 0 "[ . 1 . 2]" 1
183 1 17 LEU HA 1 17 LEU QD 3.450 . 4.140 1.919 1.875 1.963 . 0 0 "[ . 1 . 2]" 1
184 1 17 LEU HB2 1 55 ARG HA 4.830 . 5.800 3.064 2.111 4.015 . 0 0 "[ . 1 . 2]" 1
185 1 17 LEU HB2 1 56 ALA H 4.210 . 5.050 3.664 2.381 4.652 . 0 0 "[ . 1 . 2]" 1
186 1 17 LEU HB2 1 56 ALA MB 5.320 . 6.380 4.426 3.635 4.999 . 0 0 "[ . 1 . 2]" 1
187 1 17 LEU HB3 1 55 ARG HA 5.200 . 6.240 3.754 2.653 5.175 . 0 0 "[ . 1 . 2]" 1
188 1 17 LEU HB3 1 56 ALA H 4.750 . 5.700 4.495 3.103 5.682 . 0 0 "[ . 1 . 2]" 1
189 1 17 LEU HB3 1 56 ALA MB 5.320 . 6.380 4.505 3.651 5.411 . 0 0 "[ . 1 . 2]" 1
190 1 17 LEU QD 1 26 LEU QD 3.110 . 3.730 2.183 1.833 2.510 . 0 0 "[ . 1 . 2]" 1
191 1 17 LEU QD 1 29 GLN QG 5.320 . 6.380 4.447 3.358 4.847 . 0 0 "[ . 1 . 2]" 1
192 1 17 LEU QD 1 42 PHE QD 4.410 . 5.290 4.578 3.937 4.774 . 0 0 "[ . 1 . 2]" 1
193 1 17 LEU QD 1 55 ARG HA 5.400 . 6.480 4.093 3.053 4.652 . 0 0 "[ . 1 . 2]" 1
194 1 17 LEU QD 1 56 ALA H 5.020 . 6.020 3.624 2.549 4.481 . 0 0 "[ . 1 . 2]" 1
195 1 17 LEU QD 1 56 ALA MB 4.000 . 4.800 3.445 2.937 4.080 . 0 0 "[ . 1 . 2]" 1
196 1 17 LEU QD 1 86 TYR HB3 4.930 . 5.920 3.073 2.246 3.810 . 0 0 "[ . 1 . 2]" 1
197 1 17 LEU QD 1 88 ALA MB 3.490 . 4.190 2.882 1.984 3.628 . 0 0 "[ . 1 . 2]" 1
198 1 17 LEU QD 1 89 VAL H 4.580 . 5.500 3.589 3.062 4.321 . 0 0 "[ . 1 . 2]" 1
199 1 17 LEU HG 1 42 PHE QD 3.990 . 4.790 4.514 3.819 4.772 . 0 0 "[ . 1 . 2]" 1
200 1 17 LEU HG 1 55 ARG HA 3.880 . 4.660 4.256 3.039 4.703 0.043 8 0 "[ . 1 . 2]" 1
201 1 17 LEU HG 1 56 ALA H 3.650 . 4.380 3.610 2.666 4.431 0.051 4 0 "[ . 1 . 2]" 1
202 1 17 LEU HG 1 56 ALA MB 3.500 . 4.200 3.137 2.583 3.950 . 0 0 "[ . 1 . 2]" 1
203 1 19 PRO HA 1 20 GLY HA2 4.810 . 5.770 4.434 4.351 4.548 . 0 0 "[ . 1 . 2]" 1
204 1 19 PRO HA 1 20 GLY HA3 4.530 . 5.440 4.458 4.352 4.617 . 0 0 "[ . 1 . 2]" 1
205 1 19 PRO HB2 1 20 GLY HA3 4.720 . 5.660 5.210 4.860 5.466 . 0 0 "[ . 1 . 2]" 1
206 1 19 PRO HB2 1 46 LEU HA 4.710 . 5.650 4.761 3.311 5.722 0.072 1 0 "[ . 1 . 2]" 1
207 1 20 GLY H 1 21 LEU H 4.340 . 5.210 3.005 1.902 4.254 . 0 0 "[ . 1 . 2]" 1
208 1 20 GLY HA2 1 84 LEU QD 6.400 . 7.680 3.471 2.747 4.338 . 0 0 "[ . 1 . 2]" 1
209 1 20 GLY HA2 1 86 TYR QE 5.150 . 6.180 3.981 2.741 5.058 . 0 0 "[ . 1 . 2]" 1
210 1 20 GLY HA3 1 21 LEU HB2 5.820 . 6.980 5.731 5.652 5.837 . 0 0 "[ . 1 . 2]" 1
211 1 20 GLY HA3 1 21 LEU HB3 4.880 . 5.860 4.428 4.206 4.762 . 0 0 "[ . 1 . 2]" 1
212 1 20 GLY HA3 1 84 LEU QD 6.400 . 7.680 3.305 2.313 4.431 . 0 0 "[ . 1 . 2]" 1
213 1 20 GLY HA3 1 86 TYR QE 4.040 . 4.850 2.541 1.826 3.617 . 0 0 "[ . 1 . 2]" 1
214 1 21 LEU H 1 21 LEU HB2 3.580 . 4.300 3.732 3.591 4.090 . 0 0 "[ . 1 . 2]" 1
215 1 21 LEU H 1 21 LEU HB3 3.250 . 3.900 2.755 2.418 3.487 . 0 0 "[ . 1 . 2]" 1
216 1 21 LEU H 1 21 LEU QD 3.630 . 4.360 1.802 1.706 2.111 0.094 7 0 "[ . 1 . 2]" 1
217 1 21 LEU H 1 21 LEU HG 3.870 . 4.640 3.546 3.402 3.725 . 0 0 "[ . 1 . 2]" 1
218 1 21 LEU H 1 22 THR H 4.710 . 5.650 4.562 4.312 4.666 . 0 0 "[ . 1 . 2]" 1
219 1 21 LEU H 1 46 LEU HB3 3.900 . 4.680 4.187 3.444 4.820 0.140 9 0 "[ . 1 . 2]" 1
220 1 21 LEU HA 1 21 LEU QD 3.740 . 4.490 3.348 3.323 3.376 . 0 0 "[ . 1 . 2]" 1
221 1 21 LEU HA 1 21 LEU HG 3.850 . 4.620 3.784 3.767 3.812 . 0 0 "[ . 1 . 2]" 1
222 1 21 LEU HA 1 22 THR H 3.210 . 3.850 2.376 2.238 2.503 . 0 0 "[ . 1 . 2]" 1
223 1 21 LEU HA 1 22 THR HA 4.600 . 5.520 4.334 4.288 4.411 . 0 0 "[ . 1 . 2]" 1
224 1 21 LEU HA 1 46 LEU QD 3.840 . 4.610 3.222 2.460 4.267 . 0 0 "[ . 1 . 2]" 1
225 1 21 LEU HB2 1 22 THR H 4.140 . 4.970 2.493 2.214 2.948 . 0 0 "[ . 1 . 2]" 1
226 1 21 LEU HB2 1 22 THR HA 4.820 . 5.780 4.900 4.752 5.139 . 0 0 "[ . 1 . 2]" 1
227 1 21 LEU HB2 1 22 THR HB 5.620 . 6.740 4.725 4.461 5.037 . 0 0 "[ . 1 . 2]" 1
228 1 21 LEU HB2 1 25 GLN H 4.490 . 5.390 4.546 4.316 4.909 . 0 0 "[ . 1 . 2]" 1
229 1 21 LEU HB2 1 25 GLN HB2 4.500 . 5.400 2.939 2.273 4.050 . 0 0 "[ . 1 . 2]" 1
230 1 21 LEU HB2 1 25 GLN HB3 5.090 . 6.110 4.249 3.391 4.868 . 0 0 "[ . 1 . 2]" 1
231 1 21 LEU HB2 1 25 GLN HE21 5.720 . 6.860 3.333 1.966 3.924 . 0 0 "[ . 1 . 2]" 1
232 1 21 LEU HB2 1 25 GLN HE22 6.260 . 7.510 3.987 3.116 4.542 . 0 0 "[ . 1 . 2]" 1
233 1 21 LEU HB2 1 26 LEU HA 4.920 . 5.900 4.978 4.645 5.347 . 0 0 "[ . 1 . 2]" 1
234 1 21 LEU HB2 1 26 LEU HB2 4.840 . 5.810 4.157 3.920 4.363 . 0 0 "[ . 1 . 2]" 1
235 1 21 LEU HB2 1 26 LEU HB3 4.340 . 5.210 5.258 5.144 5.328 0.118 16 0 "[ . 1 . 2]" 1
236 1 21 LEU HB2 1 29 GLN HE22 5.380 . 6.460 5.614 5.237 6.488 0.028 7 0 "[ . 1 . 2]" 1
237 1 21 LEU HB3 1 21 LEU QD 2.850 . 3.420 2.138 2.121 2.146 . 0 0 "[ . 1 . 2]" 1
238 1 21 LEU HB3 1 22 THR H 4.270 . 5.120 3.848 3.684 4.125 . 0 0 "[ . 1 . 2]" 1
239 1 21 LEU HB3 1 25 GLN HB2 4.490 . 5.390 4.379 3.850 5.180 . 0 0 "[ . 1 . 2]" 1
240 1 21 LEU HB3 1 25 GLN HE21 5.870 . 7.040 4.743 2.621 5.514 . 0 0 "[ . 1 . 2]" 1
241 1 21 LEU HB3 1 25 GLN HE22 6.500 . 7.800 4.948 3.562 5.557 . 0 0 "[ . 1 . 2]" 1
242 1 21 LEU HB3 1 25 GLN HG3 6.500 . 7.800 6.129 3.659 6.693 . 0 0 "[ . 1 . 2]" 1
243 1 21 LEU HB3 1 26 LEU HB2 4.960 . 5.950 4.802 4.729 4.921 . 0 0 "[ . 1 . 2]" 1
244 1 21 LEU HB3 1 26 LEU HB3 5.450 . 6.540 6.252 6.043 6.377 . 0 0 "[ . 1 . 2]" 1
245 1 21 LEU QD 1 22 THR H 4.460 . 5.340 3.784 3.547 4.074 . 0 0 "[ . 1 . 2]" 1
246 1 21 LEU QD 1 22 THR HA 4.320 . 5.180 4.641 4.403 4.857 . 0 0 "[ . 1 . 2]" 1
247 1 21 LEU QD 1 25 GLN H 4.160 . 4.990 4.023 3.641 4.466 . 0 0 "[ . 1 . 2]" 1
248 1 21 LEU QD 1 25 GLN HB2 3.600 . 4.320 2.307 1.873 3.192 . 0 0 "[ . 1 . 2]" 1
249 1 21 LEU QD 1 25 GLN HB3 3.760 . 4.510 2.857 2.323 4.442 . 0 0 "[ . 1 . 2]" 1
250 1 21 LEU QD 1 25 GLN HE21 3.710 . 4.450 4.043 2.609 4.422 . 0 0 "[ . 1 . 2]" 1
251 1 21 LEU QD 1 25 GLN HE22 4.990 . 5.990 4.537 3.941 4.943 . 0 0 "[ . 1 . 2]" 1
252 1 21 LEU QD 1 25 GLN HG3 4.200 . 5.040 4.294 2.389 4.926 . 0 0 "[ . 1 . 2]" 1
253 1 21 LEU QD 1 26 LEU H 3.530 . 4.240 3.301 2.911 3.645 . 0 0 "[ . 1 . 2]" 1
254 1 21 LEU QD 1 26 LEU HA 3.420 . 4.100 2.165 1.902 2.428 . 0 0 "[ . 1 . 2]" 1
255 1 21 LEU QD 1 26 LEU HB2 3.750 . 4.500 2.415 2.227 2.602 . 0 0 "[ . 1 . 2]" 1
256 1 21 LEU QD 1 28 GLU QG 4.310 . 5.170 4.258 3.450 4.587 . 0 0 "[ . 1 . 2]" 1
257 1 21 LEU QD 1 29 GLN HE21 3.120 . 3.740 2.901 2.443 3.503 . 0 0 "[ . 1 . 2]" 1
258 1 21 LEU QD 1 29 GLN HE22 3.640 . 4.370 2.220 1.762 2.920 0.038 14 0 "[ . 1 . 2]" 1
259 1 21 LEU QD 1 78 PHE HD2 3.610 . 4.330 3.045 2.583 3.484 . 0 0 "[ . 1 . 2]" 1
260 1 21 LEU QD 1 86 TYR QD 4.350 . 5.220 3.182 2.761 3.692 . 0 0 "[ . 1 . 2]" 1
261 1 21 LEU HG 1 22 THR H 4.030 . 4.840 3.564 3.239 3.972 . 0 0 "[ . 1 . 2]" 1
262 1 21 LEU HG 1 22 THR HA 4.410 . 5.290 4.496 4.218 4.824 . 0 0 "[ . 1 . 2]" 1
263 1 21 LEU HG 1 25 GLN H 4.270 . 5.120 4.536 4.221 5.024 . 0 0 "[ . 1 . 2]" 1
264 1 21 LEU HG 1 25 GLN HB2 4.330 . 5.200 3.704 3.135 5.165 . 0 0 "[ . 1 . 2]" 1
265 1 21 LEU HG 1 25 GLN HB3 5.160 . 6.190 4.947 4.201 6.097 . 0 0 "[ . 1 . 2]" 1
266 1 21 LEU HG 1 25 GLN HE21 4.600 . 5.520 5.215 4.068 5.539 0.019 9 0 "[ . 1 . 2]" 1
267 1 21 LEU HG 1 25 GLN HE22 5.590 . 6.710 6.207 5.501 6.717 0.007 9 0 "[ . 1 . 2]" 1
268 1 21 LEU HG 1 25 GLN HG3 4.980 . 5.980 5.605 3.165 5.990 0.010 9 0 "[ . 1 . 2]" 1
269 1 21 LEU HG 1 26 LEU H 3.390 . 4.070 3.473 2.640 4.090 0.020 6 0 "[ . 1 . 2]" 1
270 1 21 LEU HG 1 26 LEU HA 3.330 . 4.000 3.173 2.525 3.609 . 0 0 "[ . 1 . 2]" 1
271 1 21 LEU HG 1 26 LEU HB2 4.640 . 5.570 1.852 1.763 2.006 0.037 4 0 "[ . 1 . 2]" 1
272 1 21 LEU HG 1 26 LEU HB3 3.590 . 4.310 3.289 3.075 3.457 . 0 0 "[ . 1 . 2]" 1
273 1 21 LEU HG 1 29 GLN HE22 4.280 . 5.140 4.429 3.659 5.170 0.030 9 0 "[ . 1 . 2]" 1
274 1 22 THR H 1 23 LYS H 4.620 . 5.540 4.607 4.560 4.661 . 0 0 "[ . 1 . 2]" 1
275 1 22 THR H 1 24 GLU H 4.970 . 5.960 4.937 4.616 5.225 . 0 0 "[ . 1 . 2]" 1
276 1 22 THR H 1 24 GLU HB2 4.730 . 5.680 5.099 4.563 5.715 0.035 10 0 "[ . 1 . 2]" 1
277 1 22 THR H 1 25 GLN HB2 4.140 . 4.970 3.931 2.826 5.008 0.038 19 0 "[ . 1 . 2]" 1
278 1 22 THR H 1 25 GLN HE21 4.000 . 4.800 3.382 2.134 4.270 . 0 0 "[ . 1 . 2]" 1
279 1 22 THR H 1 25 GLN HG3 4.080 . 4.900 4.475 2.653 4.939 0.039 17 0 "[ . 1 . 2]" 1
280 1 22 THR H 1 26 LEU H 4.510 . 5.410 4.767 4.208 5.266 . 0 0 "[ . 1 . 2]" 1
281 1 22 THR H 1 26 LEU HB3 4.240 . 5.090 5.162 5.112 5.221 0.131 10 0 "[ . 1 . 2]" 1
282 1 22 THR HA 1 23 LYS H 3.070 . 3.680 2.304 2.245 2.399 . 0 0 "[ . 1 . 2]" 1
283 1 22 THR HA 1 24 GLU H 4.670 . 5.600 4.248 4.054 4.414 . 0 0 "[ . 1 . 2]" 1
284 1 22 THR HA 1 26 LEU HB3 3.980 . 4.780 4.557 4.204 4.768 . 0 0 "[ . 1 . 2]" 1
285 1 22 THR HA 1 26 LEU QD 4.320 . 5.180 4.118 3.770 4.535 . 0 0 "[ . 1 . 2]" 1
286 1 22 THR HA 1 43 ALA MB 4.250 . 5.100 3.685 2.036 4.540 . 0 0 "[ . 1 . 2]" 1
287 1 22 THR HA 1 44 ALA H 3.720 . 4.460 2.914 1.958 4.463 0.003 20 0 "[ . 1 . 2]" 1
288 1 22 THR HB 1 23 LYS H 3.660 . 4.390 3.807 3.617 3.950 . 0 0 "[ . 1 . 2]" 1
289 1 22 THR HB 1 23 LYS QG 5.120 . 6.140 4.413 4.214 4.563 . 0 0 "[ . 1 . 2]" 1
290 1 22 THR HB 1 24 GLU H 3.290 . 3.950 3.204 2.789 3.556 . 0 0 "[ . 1 . 2]" 1
291 1 22 THR HB 1 24 GLU HG2 5.240 . 6.290 5.251 4.623 5.893 . 0 0 "[ . 1 . 2]" 1
292 1 22 THR HB 1 24 GLU HG3 4.440 . 5.330 3.671 2.970 4.327 . 0 0 "[ . 1 . 2]" 1
293 1 22 THR HB 1 25 GLN H 3.820 . 4.580 3.557 2.774 3.975 . 0 0 "[ . 1 . 2]" 1
294 1 22 THR HB 1 25 GLN HE21 4.620 . 5.540 3.909 2.136 5.550 0.010 19 0 "[ . 1 . 2]" 1
295 1 22 THR HB 1 25 GLN HE22 5.980 . 7.180 5.372 3.704 6.493 . 0 0 "[ . 1 . 2]" 1
296 1 22 THR HB 1 43 ALA MB 5.920 . 7.100 4.974 4.053 6.096 . 0 0 "[ . 1 . 2]" 1
297 1 23 LYS H 1 23 LYS HB3 4.050 . 4.860 2.495 2.408 2.605 . 0 0 "[ . 1 . 2]" 1
298 1 23 LYS H 1 23 LYS QD 4.540 . 5.450 3.864 3.389 4.314 . 0 0 "[ . 1 . 2]" 1
299 1 23 LYS H 1 23 LYS HE2 5.540 . 6.650 5.287 3.993 5.608 . 0 0 "[ . 1 . 2]" 1
300 1 23 LYS H 1 23 LYS QE 4.880 . 5.860 4.544 3.405 4.778 . 0 0 "[ . 1 . 2]" 1
301 1 23 LYS H 1 23 LYS HE3 5.540 . 6.650 4.992 3.692 6.031 . 0 0 "[ . 1 . 2]" 1
302 1 23 LYS H 1 23 LYS QG 4.070 . 4.880 2.254 2.112 2.428 . 0 0 "[ . 1 . 2]" 1
303 1 23 LYS H 1 24 GLU H 3.520 . 4.220 2.994 2.890 3.085 . 0 0 "[ . 1 . 2]" 1
304 1 23 LYS H 1 24 GLU HB2 5.950 . 7.140 5.299 5.161 5.428 . 0 0 "[ . 1 . 2]" 1
305 1 23 LYS H 1 24 GLU HG2 6.040 . 7.250 5.850 5.557 6.179 . 0 0 "[ . 1 . 2]" 1
306 1 23 LYS H 1 24 GLU HG3 4.790 . 5.750 4.375 4.106 4.632 . 0 0 "[ . 1 . 2]" 1
307 1 23 LYS H 1 26 LEU HB3 3.850 . 4.620 3.801 3.546 3.950 . 0 0 "[ . 1 . 2]" 1
308 1 23 LYS H 1 26 LEU HG 4.890 . 5.870 5.782 5.413 5.952 0.082 16 0 "[ . 1 . 2]" 1
309 1 23 LYS H 1 43 ALA HA 5.050 . 6.060 2.552 2.034 3.261 . 0 0 "[ . 1 . 2]" 1
310 1 23 LYS H 1 43 ALA MB 6.500 . 7.800 3.114 1.784 3.851 0.016 12 0 "[ . 1 . 2]" 1
311 1 23 LYS HA 1 23 LYS QE 5.530 . 6.640 4.186 4.089 4.362 . 0 0 "[ . 1 . 2]" 1
312 1 23 LYS HA 1 23 LYS HG2 4.080 . 4.900 3.789 3.656 4.222 . 0 0 "[ . 1 . 2]" 1
313 1 23 LYS HA 1 23 LYS QG 3.570 . 4.280 3.361 3.345 3.446 . 0 0 "[ . 1 . 2]" 1
314 1 23 LYS HA 1 23 LYS HG3 4.080 . 4.900 3.768 3.653 3.896 . 0 0 "[ . 1 . 2]" 1
315 1 23 LYS HA 1 25 GLN H 4.680 . 5.620 4.363 3.868 4.804 . 0 0 "[ . 1 . 2]" 1
316 1 23 LYS HA 1 26 LEU H 4.240 . 5.090 3.227 2.863 3.486 . 0 0 "[ . 1 . 2]" 1
317 1 23 LYS HA 1 26 LEU HB2 4.840 . 5.810 3.427 3.223 3.707 . 0 0 "[ . 1 . 2]" 1
318 1 23 LYS HA 1 26 LEU HB3 5.410 . 6.490 1.801 1.708 2.046 0.092 2 0 "[ . 1 . 2]" 1
319 1 23 LYS HA 1 26 LEU QD 4.560 . 5.470 2.315 2.133 2.615 . 0 0 "[ . 1 . 2]" 1
320 1 23 LYS HA 1 26 LEU HG 4.300 . 5.160 3.405 3.167 3.559 . 0 0 "[ . 1 . 2]" 1
321 1 23 LYS HA 1 27 GLU H 4.280 . 5.140 3.253 2.783 3.677 . 0 0 "[ . 1 . 2]" 1
322 1 23 LYS HA 1 27 GLU HB3 4.100 . 4.920 3.885 3.279 4.436 . 0 0 "[ . 1 . 2]" 1
323 1 23 LYS HB2 1 23 LYS QE 3.840 . 4.610 2.066 1.854 2.787 . 0 0 "[ . 1 . 2]" 1
324 1 23 LYS HB2 1 24 GLU H 3.510 . 4.210 3.849 3.747 3.991 . 0 0 "[ . 1 . 2]" 1
325 1 23 LYS HB2 1 24 GLU HA 4.360 . 5.230 4.569 4.364 4.770 . 0 0 "[ . 1 . 2]" 1
326 1 23 LYS HB2 1 24 GLU HG2 5.060 . 6.070 5.649 4.941 6.072 0.002 17 0 "[ . 1 . 2]" 1
327 1 23 LYS HB2 1 26 LEU HG 4.570 . 5.480 5.072 4.651 5.381 . 0 0 "[ . 1 . 2]" 1
328 1 23 LYS HB2 1 27 GLU H 4.550 . 5.460 4.248 3.698 4.794 . 0 0 "[ . 1 . 2]" 1
329 1 23 LYS HB2 1 27 GLU HB3 5.510 . 6.610 3.386 2.775 4.119 . 0 0 "[ . 1 . 2]" 1
330 1 23 LYS HB2 1 41 PHE H 4.620 . 5.540 4.458 3.713 4.972 . 0 0 "[ . 1 . 2]" 1
331 1 23 LYS HB2 1 41 PHE HB2 4.440 . 5.330 2.235 1.938 2.651 . 0 0 "[ . 1 . 2]" 1
332 1 23 LYS HB2 1 41 PHE HB3 4.780 . 5.740 3.133 2.653 3.612 . 0 0 "[ . 1 . 2]" 1
333 1 23 LYS HB2 1 41 PHE QD 5.310 . 6.370 3.645 2.813 4.010 . 0 0 "[ . 1 . 2]" 1
334 1 23 LYS HB3 1 23 LYS HE2 5.000 . 6.000 3.604 1.958 4.202 . 0 0 "[ . 1 . 2]" 1
335 1 23 LYS HB3 1 23 LYS QE 4.240 . 5.090 2.734 1.922 3.250 . 0 0 "[ . 1 . 2]" 1
336 1 23 LYS HB3 1 23 LYS HE3 5.000 . 6.000 3.012 2.484 4.046 . 0 0 "[ . 1 . 2]" 1
337 1 23 LYS HB3 1 24 GLU H 4.780 . 5.740 4.090 3.968 4.253 . 0 0 "[ . 1 . 2]" 1
338 1 23 LYS HB3 1 26 LEU QD 3.200 . 3.840 3.287 3.050 3.566 . 0 0 "[ . 1 . 2]" 1
339 1 23 LYS HB3 1 26 LEU HG 4.830 . 5.800 5.191 4.726 5.446 . 0 0 "[ . 1 . 2]" 1
340 1 23 LYS HB3 1 41 PHE H 4.980 . 5.980 4.709 4.005 5.247 . 0 0 "[ . 1 . 2]" 1
341 1 23 LYS HB3 1 41 PHE HB2 4.660 . 5.590 2.812 1.920 3.339 . 0 0 "[ . 1 . 2]" 1
342 1 23 LYS HB3 1 41 PHE HB3 4.930 . 5.920 3.228 2.891 3.570 . 0 0 "[ . 1 . 2]" 1
343 1 23 LYS QD 1 24 GLU H 4.420 . 5.300 4.165 2.529 4.499 . 0 0 "[ . 1 . 2]" 1
344 1 23 LYS QD 1 24 GLU HG3 5.060 . 6.070 4.173 2.133 4.709 . 0 0 "[ . 1 . 2]" 1
345 1 23 LYS QD 1 41 PHE H 4.930 . 5.920 4.600 3.691 5.915 . 0 0 "[ . 1 . 2]" 1
346 1 23 LYS QD 1 41 PHE HB2 4.020 . 4.820 3.861 3.260 4.397 . 0 0 "[ . 1 . 2]" 1
347 1 23 LYS QD 1 41 PHE HB3 5.630 . 6.760 4.964 4.461 5.328 . 0 0 "[ . 1 . 2]" 1
348 1 23 LYS QD 1 41 PHE QD 5.210 . 6.250 4.845 3.452 5.631 . 0 0 "[ . 1 . 2]" 1
349 1 23 LYS QE 1 23 LYS QG 3.030 . 3.640 2.395 2.312 2.821 . 0 0 "[ . 1 . 2]" 1
350 1 23 LYS QE 1 24 GLU H 4.900 . 5.880 4.561 3.984 5.229 . 0 0 "[ . 1 . 2]" 1
351 1 23 LYS QE 1 26 LEU QD 6.270 . 7.520 4.866 4.242 5.294 . 0 0 "[ . 1 . 2]" 1
352 1 23 LYS QE 1 40 GLU HA 4.710 . 5.650 4.748 3.935 5.285 . 0 0 "[ . 1 . 2]" 1
353 1 23 LYS QE 1 41 PHE H 3.990 . 4.790 3.267 2.480 3.934 . 0 0 "[ . 1 . 2]" 1
354 1 23 LYS QE 1 41 PHE HB2 3.900 . 4.680 2.353 1.803 2.836 . 0 0 "[ . 1 . 2]" 1
355 1 23 LYS QE 1 41 PHE HB3 6.040 . 7.250 3.854 3.297 4.332 . 0 0 "[ . 1 . 2]" 1
356 1 23 LYS HE2 1 23 LYS HG2 4.110 . 4.930 3.598 3.035 3.749 . 0 0 "[ . 1 . 2]" 1
357 1 23 LYS HE2 1 23 LYS HG3 4.110 . 4.930 2.791 2.448 3.758 . 0 0 "[ . 1 . 2]" 1
358 1 23 LYS HE2 1 41 PHE HB2 4.520 . 5.420 3.540 2.081 4.358 . 0 0 "[ . 1 . 2]" 1
359 1 23 LYS HE2 1 41 PHE QD 4.280 . 5.140 3.976 3.020 4.613 . 0 0 "[ . 1 . 2]" 1
360 1 23 LYS HE2 1 43 ALA MB 6.500 . 7.800 5.063 4.056 5.923 . 0 0 "[ . 1 . 2]" 1
361 1 23 LYS HE3 1 23 LYS HG2 4.110 . 4.930 3.537 2.519 4.258 . 0 0 "[ . 1 . 2]" 1
362 1 23 LYS HE3 1 23 LYS HG3 4.110 . 4.930 3.264 3.018 3.805 . 0 0 "[ . 1 . 2]" 1
363 1 23 LYS HE3 1 41 PHE HB2 4.520 . 5.420 2.740 1.809 4.004 . 0 0 "[ . 1 . 2]" 1
364 1 23 LYS HE3 1 41 PHE QD 4.280 . 5.140 3.588 2.792 5.104 . 0 0 "[ . 1 . 2]" 1
365 1 23 LYS HE3 1 43 ALA MB 6.500 . 7.800 4.576 2.861 5.488 . 0 0 "[ . 1 . 2]" 1
366 1 23 LYS QG 1 24 GLU H 3.880 . 4.660 2.292 2.041 2.702 . 0 0 "[ . 1 . 2]" 1
367 1 23 LYS QG 1 24 GLU HA 4.640 . 5.570 3.412 3.182 4.469 . 0 0 "[ . 1 . 2]" 1
368 1 23 LYS QG 1 24 GLU HG2 4.720 . 5.660 3.424 2.883 4.315 . 0 0 "[ . 1 . 2]" 1
369 1 23 LYS QG 1 24 GLU HG3 4.620 . 5.540 2.760 2.305 3.096 . 0 0 "[ . 1 . 2]" 1
370 1 23 LYS QG 1 41 PHE QD 4.600 . 5.520 5.127 4.509 5.376 . 0 0 "[ . 1 . 2]" 1
371 1 23 LYS QG 1 43 ALA HA 3.970 . 4.760 3.660 2.762 4.601 . 0 0 "[ . 1 . 2]" 1
372 1 23 LYS QG 1 43 ALA MB 6.270 . 7.520 2.796 1.984 3.424 . 0 0 "[ . 1 . 2]" 1
373 1 23 LYS HG2 1 24 GLU H 4.740 . 5.690 2.919 2.511 4.288 . 0 0 "[ . 1 . 2]" 1
374 1 23 LYS HG2 1 24 GLU HG3 5.370 . 6.440 3.476 3.032 4.352 . 0 0 "[ . 1 . 2]" 1
375 1 23 LYS HG2 1 27 GLU HB3 6.500 . 7.800 6.141 5.655 6.547 . 0 0 "[ . 1 . 2]" 1
376 1 23 LYS HG2 1 41 PHE HB2 4.900 . 5.880 4.770 3.834 5.339 . 0 0 "[ . 1 . 2]" 1
377 1 23 LYS HG3 1 24 GLU H 4.740 . 5.690 2.444 2.078 2.963 . 0 0 "[ . 1 . 2]" 1
378 1 23 LYS HG3 1 24 GLU HG3 5.370 . 6.440 2.935 2.390 3.633 . 0 0 "[ . 1 . 2]" 1
379 1 23 LYS HG3 1 27 GLU HB3 6.500 . 7.800 5.160 4.617 5.992 . 0 0 "[ . 1 . 2]" 1
380 1 23 LYS HG3 1 41 PHE HB2 4.900 . 5.880 4.559 4.267 4.924 . 0 0 "[ . 1 . 2]" 1
381 1 24 GLU H 1 24 GLU HB2 2.920 . 3.500 2.609 2.458 2.707 . 0 0 "[ . 1 . 2]" 1
382 1 24 GLU H 1 24 GLU HB3 3.720 . 4.460 3.592 3.571 3.614 . 0 0 "[ . 1 . 2]" 1
383 1 24 GLU H 1 24 GLU HG2 3.250 . 3.900 3.198 2.996 3.497 . 0 0 "[ . 1 . 2]" 1
384 1 24 GLU H 1 24 GLU HG3 3.270 . 3.920 2.003 1.826 2.229 . 0 0 "[ . 1 . 2]" 1
385 1 24 GLU H 1 25 GLN H 3.390 . 4.070 2.903 2.705 3.098 . 0 0 "[ . 1 . 2]" 1
386 1 24 GLU H 1 25 GLN HG3 4.890 . 5.870 4.820 4.502 5.254 . 0 0 "[ . 1 . 2]" 1
387 1 24 GLU H 1 26 LEU H 4.410 . 5.290 3.854 3.559 4.204 . 0 0 "[ . 1 . 2]" 1
388 1 24 GLU H 1 27 GLU H 4.820 . 5.780 4.775 4.484 4.873 . 0 0 "[ . 1 . 2]" 1
389 1 24 GLU HA 1 24 GLU HG2 3.100 . 3.720 2.597 2.509 2.674 . 0 0 "[ . 1 . 2]" 1
390 1 24 GLU HA 1 24 GLU HG3 3.580 . 4.300 3.120 2.990 3.244 . 0 0 "[ . 1 . 2]" 1
391 1 24 GLU HA 1 27 GLU H 4.680 . 5.620 4.337 3.683 4.778 . 0 0 "[ . 1 . 2]" 1
392 1 24 GLU HA 1 27 GLU HG2 3.980 . 4.780 3.320 2.475 3.958 . 0 0 "[ . 1 . 2]" 1
393 1 24 GLU HB2 1 24 GLU HG3 2.870 . 3.440 2.458 2.407 2.511 . 0 0 "[ . 1 . 2]" 1
394 1 24 GLU HB2 1 25 GLN H 3.060 . 3.670 2.544 2.036 3.316 . 0 0 "[ . 1 . 2]" 1
395 1 24 GLU HB2 1 25 GLN HE21 6.150 . 7.380 4.475 3.558 6.477 . 0 0 "[ . 1 . 2]" 1
396 1 24 GLU HB2 1 25 GLN HG3 3.780 . 4.540 3.062 2.480 4.581 0.041 19 0 "[ . 1 . 2]" 1
397 1 24 GLU HB2 1 26 LEU H 4.900 . 5.880 4.591 4.213 5.210 . 0 0 "[ . 1 . 2]" 1
398 1 24 GLU HB3 1 25 GLN H 3.910 . 4.690 3.635 3.233 4.181 . 0 0 "[ . 1 . 2]" 1
399 1 24 GLU HB3 1 25 GLN HE21 6.500 . 7.800 5.802 4.943 7.817 0.017 19 0 "[ . 1 . 2]" 1
400 1 24 GLU HG2 1 25 GLN H 4.860 . 5.830 4.944 4.711 5.115 . 0 0 "[ . 1 . 2]" 1
401 1 24 GLU HG3 1 25 GLN H 4.150 . 4.980 4.209 3.974 4.509 . 0 0 "[ . 1 . 2]" 1
402 1 25 GLN H 1 25 GLN HB2 3.300 . 3.960 2.629 2.489 3.584 . 0 0 "[ . 1 . 2]" 1
403 1 25 GLN H 1 25 GLN HE21 4.910 . 5.890 3.885 3.297 4.890 . 0 0 "[ . 1 . 2]" 1
404 1 25 GLN H 1 25 GLN HG3 3.030 . 3.640 2.519 2.134 3.049 . 0 0 "[ . 1 . 2]" 1
405 1 25 GLN H 1 26 LEU H 3.300 . 3.960 2.246 1.929 2.533 . 0 0 "[ . 1 . 2]" 1
406 1 25 GLN H 1 26 LEU HB3 4.050 . 4.860 4.037 3.596 4.366 . 0 0 "[ . 1 . 2]" 1
407 1 25 GLN H 1 27 GLU H 4.290 . 5.150 4.125 3.435 4.697 . 0 0 "[ . 1 . 2]" 1
408 1 25 GLN HA 1 25 GLN HE21 5.310 . 6.370 5.038 4.535 5.248 . 0 0 "[ . 1 . 2]" 1
409 1 25 GLN HA 1 25 GLN HG2 3.060 . 3.670 2.697 2.514 3.679 0.009 19 0 "[ . 1 . 2]" 1
410 1 25 GLN HA 1 25 GLN HG3 3.940 . 4.730 3.212 3.045 3.806 . 0 0 "[ . 1 . 2]" 1
411 1 25 GLN HA 1 27 GLU H 4.600 . 5.520 4.315 3.785 4.805 . 0 0 "[ . 1 . 2]" 1
412 1 25 GLN HA 1 27 GLU HG2 4.450 . 5.340 4.557 3.449 5.317 . 0 0 "[ . 1 . 2]" 1
413 1 25 GLN HA 1 28 GLU H 3.460 . 4.150 3.843 3.522 4.078 . 0 0 "[ . 1 . 2]" 1
414 1 25 GLN HA 1 28 GLU HB2 4.210 . 5.050 5.087 4.956 5.148 0.098 5 0 "[ . 1 . 2]" 1
415 1 25 GLN HA 1 28 GLU HB3 3.340 . 4.010 3.782 3.412 4.069 0.059 8 0 "[ . 1 . 2]" 1
416 1 25 GLN HA 1 28 GLU QG 4.570 . 5.480 2.989 2.350 3.834 . 0 0 "[ . 1 . 2]" 1
417 1 25 GLN HB2 1 26 LEU H 3.610 . 4.330 3.167 2.334 4.235 . 0 0 "[ . 1 . 2]" 1
418 1 25 GLN HB2 1 26 LEU HA 4.410 . 5.290 4.319 3.984 4.611 . 0 0 "[ . 1 . 2]" 1
419 1 25 GLN HB2 1 26 LEU QD 6.500 . 7.800 5.243 4.987 5.710 . 0 0 "[ . 1 . 2]" 1
420 1 25 GLN HB3 1 25 GLN HE21 4.010 . 4.810 3.808 2.477 3.978 . 0 0 "[ . 1 . 2]" 1
421 1 25 GLN HB3 1 25 GLN HE22 4.500 . 5.400 4.329 3.664 4.496 . 0 0 "[ . 1 . 2]" 1
422 1 25 GLN HB3 1 26 LEU H 5.120 . 6.140 4.063 3.463 4.485 . 0 0 "[ . 1 . 2]" 1
423 1 25 GLN HB3 1 28 GLU QG 4.580 . 5.500 4.076 3.826 4.838 . 0 0 "[ . 1 . 2]" 1
424 1 25 GLN HE21 1 25 GLN HG3 3.180 . 3.820 2.296 2.237 2.989 . 0 0 "[ . 1 . 2]" 1
425 1 25 GLN HE21 1 26 LEU H 4.740 . 5.690 5.313 4.736 5.706 0.016 17 0 "[ . 1 . 2]" 1
426 1 25 GLN HE22 1 25 GLN HG3 3.520 . 4.220 3.511 3.484 3.820 . 0 0 "[ . 1 . 2]" 1
427 1 25 GLN HE22 1 26 LEU H 5.940 . 7.130 6.714 5.970 7.151 0.021 17 0 "[ . 1 . 2]" 1
428 1 25 GLN HG3 1 26 LEU H 3.760 . 4.510 4.301 3.449 4.527 0.017 8 0 "[ . 1 . 2]" 1
429 1 25 GLN HG3 1 26 LEU HB3 5.280 . 6.340 6.224 4.632 6.389 0.049 9 0 "[ . 1 . 2]" 1
430 1 26 LEU H 1 26 LEU HB3 3.470 . 4.160 2.268 2.202 2.398 . 0 0 "[ . 1 . 2]" 1
431 1 26 LEU H 1 26 LEU QD 3.800 . 4.560 3.776 3.712 3.846 . 0 0 "[ . 1 . 2]" 1
432 1 26 LEU H 1 26 LEU HG 3.800 . 4.560 4.261 4.156 4.425 . 0 0 "[ . 1 . 2]" 1
433 1 26 LEU H 1 27 GLU H 3.320 . 3.980 2.521 2.122 3.070 . 0 0 "[ . 1 . 2]" 1
434 1 26 LEU H 1 27 GLU HG2 5.030 . 6.040 4.025 3.299 4.872 . 0 0 "[ . 1 . 2]" 1
435 1 26 LEU H 1 28 GLU H 4.320 . 5.180 4.059 3.676 4.486 . 0 0 "[ . 1 . 2]" 1
436 1 26 LEU HA 1 26 LEU QD 3.070 . 3.680 2.346 2.253 2.423 . 0 0 "[ . 1 . 2]" 1
437 1 26 LEU HA 1 26 LEU HG 3.630 . 4.360 3.316 3.184 3.418 . 0 0 "[ . 1 . 2]" 1
438 1 26 LEU HA 1 27 GLU HA 4.770 . 5.720 4.735 4.644 4.827 . 0 0 "[ . 1 . 2]" 1
439 1 26 LEU HA 1 28 GLU QG 4.880 . 5.860 4.016 3.676 4.365 . 0 0 "[ . 1 . 2]" 1
440 1 26 LEU HA 1 29 GLN H 4.220 . 5.060 4.361 4.084 4.586 . 0 0 "[ . 1 . 2]" 1
441 1 26 LEU HA 1 29 GLN HE21 4.440 . 5.330 2.550 1.886 3.306 . 0 0 "[ . 1 . 2]" 1
442 1 26 LEU HA 1 29 GLN HE22 3.480 . 4.180 2.208 1.790 3.355 0.010 3 0 "[ . 1 . 2]" 1
443 1 26 LEU HA 1 29 GLN QG 4.240 . 5.040 3.907 3.021 4.267 . 0 0 "[ . 1 . 2]" 1
444 1 26 LEU HB2 1 27 GLU H 4.370 . 5.240 4.148 3.935 4.268 . 0 0 "[ . 1 . 2]" 1
445 1 26 LEU HB3 1 27 GLU H 3.660 . 4.390 2.911 2.557 3.116 . 0 0 "[ . 1 . 2]" 1
446 1 26 LEU QD 1 27 GLU H 4.250 . 5.100 3.855 3.608 4.019 . 0 0 "[ . 1 . 2]" 1
447 1 26 LEU QD 1 27 GLU HA 4.310 . 5.170 3.970 3.822 4.208 . 0 0 "[ . 1 . 2]" 1
448 1 26 LEU QD 1 29 GLN H 4.690 . 5.630 4.782 4.606 5.034 . 0 0 "[ . 1 . 2]" 1
449 1 26 LEU QD 1 29 GLN QB 6.500 . 7.800 5.141 4.847 5.464 . 0 0 "[ . 1 . 2]" 1
450 1 26 LEU QD 1 29 GLN HE21 3.450 . 4.140 2.711 2.147 3.916 . 0 0 "[ . 1 . 2]" 1
451 1 26 LEU QD 1 29 GLN QG 4.550 . 5.400 3.449 3.161 3.790 . 0 0 "[ . 1 . 2]" 1
452 1 26 LEU QD 1 30 LEU H 4.530 . 5.440 4.742 4.406 5.066 . 0 0 "[ . 1 . 2]" 1
453 1 26 LEU QD 1 30 LEU HB2 4.490 . 5.390 4.387 4.200 4.647 . 0 0 "[ . 1 . 2]" 1
454 1 26 LEU QD 1 30 LEU HB3 4.860 . 5.830 4.842 4.677 5.160 . 0 0 "[ . 1 . 2]" 1
455 1 26 LEU QD 1 30 LEU QD 3.400 . 4.080 2.043 1.900 2.328 . 0 0 "[ . 1 . 2]" 1
456 1 26 LEU QD 1 30 LEU HG 2.850 . 3.420 3.000 2.734 3.400 . 0 0 "[ . 1 . 2]" 1
457 1 26 LEU QD 1 41 PHE HB2 6.500 . 7.800 3.788 3.203 4.504 . 0 0 "[ . 1 . 2]" 1
458 1 26 LEU QD 1 41 PHE HB3 4.940 . 5.930 2.575 2.005 3.311 . 0 0 "[ . 1 . 2]" 1
459 1 26 LEU QD 1 41 PHE QD 3.750 . 4.500 3.387 2.763 3.862 . 0 0 "[ . 1 . 2]" 1
460 1 26 LEU QD 1 41 PHE QE 5.030 . 6.040 4.719 4.141 5.136 . 0 0 "[ . 1 . 2]" 1
461 1 26 LEU QD 1 42 PHE H 5.130 . 6.160 3.086 2.318 3.932 . 0 0 "[ . 1 . 2]" 1
462 1 26 LEU QD 1 42 PHE QD 3.410 . 4.090 3.007 2.740 3.383 . 0 0 "[ . 1 . 2]" 1
463 1 26 LEU QD 1 43 ALA H 6.050 . 7.260 5.115 4.702 5.585 . 0 0 "[ . 1 . 2]" 1
464 1 26 LEU QD 1 43 ALA HA 3.730 . 4.480 4.169 3.646 4.461 . 0 0 "[ . 1 . 2]" 1
465 1 26 LEU HG 1 27 GLU H 3.900 . 4.680 3.546 3.252 3.812 . 0 0 "[ . 1 . 2]" 1
466 1 26 LEU HG 1 27 GLU HA 4.470 . 5.360 3.373 3.139 3.652 . 0 0 "[ . 1 . 2]" 1
467 1 26 LEU HG 1 27 GLU HB3 4.440 . 5.330 4.294 3.883 4.835 . 0 0 "[ . 1 . 2]" 1
468 1 26 LEU HG 1 30 LEU HB2 5.760 . 6.910 4.404 3.966 4.732 . 0 0 "[ . 1 . 2]" 1
469 1 26 LEU HG 1 30 LEU HG 3.820 . 4.580 3.619 2.910 4.057 . 0 0 "[ . 1 . 2]" 1
470 1 26 LEU HG 1 41 PHE HB3 4.880 . 5.860 3.379 2.921 3.676 . 0 0 "[ . 1 . 2]" 1
471 1 26 LEU HG 1 42 PHE H 5.560 . 6.670 5.174 4.552 5.789 . 0 0 "[ . 1 . 2]" 1
472 1 27 GLU H 1 27 GLU HB3 2.710 . 3.250 2.573 2.488 2.666 . 0 0 "[ . 1 . 2]" 1
473 1 27 GLU H 1 27 GLU HG2 3.260 . 3.910 2.178 1.960 2.390 . 0 0 "[ . 1 . 2]" 1
474 1 27 GLU H 1 27 GLU HG3 4.000 . 4.800 3.396 3.224 3.683 . 0 0 "[ . 1 . 2]" 1
475 1 27 GLU H 1 28 GLU H 3.260 . 3.910 2.569 2.369 2.668 . 0 0 "[ . 1 . 2]" 1
476 1 27 GLU H 1 28 GLU HB3 4.570 . 5.480 4.811 4.598 4.967 . 0 0 "[ . 1 . 2]" 1
477 1 27 GLU H 1 29 GLN H 4.400 . 5.280 4.605 4.235 4.883 . 0 0 "[ . 1 . 2]" 1
478 1 27 GLU H 1 30 LEU HG 4.980 . 5.980 5.133 4.322 5.417 . 0 0 "[ . 1 . 2]" 1
479 1 27 GLU HA 1 27 GLU HB2 3.000 . 3.600 2.414 2.352 2.474 . 0 0 "[ . 1 . 2]" 1
480 1 27 GLU HA 1 27 GLU HG2 3.630 . 4.360 3.769 3.709 3.814 . 0 0 "[ . 1 . 2]" 1
481 1 27 GLU HA 1 27 GLU HG3 3.980 . 4.780 3.757 3.711 3.827 . 0 0 "[ . 1 . 2]" 1
482 1 27 GLU HA 1 29 GLN H 4.560 . 5.470 4.156 3.713 4.564 . 0 0 "[ . 1 . 2]" 1
483 1 27 GLU HA 1 30 LEU H 3.620 . 4.340 3.177 2.842 3.548 . 0 0 "[ . 1 . 2]" 1
484 1 27 GLU HA 1 30 LEU HB2 3.820 . 4.580 2.346 1.930 2.832 . 0 0 "[ . 1 . 2]" 1
485 1 27 GLU HA 1 30 LEU HB3 4.120 . 4.940 4.018 3.584 4.521 . 0 0 "[ . 1 . 2]" 1
486 1 27 GLU HA 1 30 LEU QD 4.570 . 5.480 2.843 2.429 3.396 . 0 0 "[ . 1 . 2]" 1
487 1 27 GLU HA 1 30 LEU HG 3.570 . 4.280 3.326 2.417 4.017 . 0 0 "[ . 1 . 2]" 1
488 1 27 GLU HA 1 31 ARG H 4.600 . 5.520 4.083 3.609 4.447 . 0 0 "[ . 1 . 2]" 1
489 1 27 GLU HA 1 31 ARG HB3 5.720 . 6.860 5.066 4.472 5.540 . 0 0 "[ . 1 . 2]" 1
490 1 27 GLU HA 1 41 PHE QD 4.320 . 5.180 3.592 3.258 4.166 . 0 0 "[ . 1 . 2]" 1
491 1 27 GLU HB2 1 30 LEU HG 5.280 . 6.340 5.628 4.791 6.377 0.037 8 0 "[ . 1 . 2]" 1
492 1 27 GLU HB2 1 31 ARG H 5.140 . 6.170 4.510 4.032 4.967 . 0 0 "[ . 1 . 2]" 1
493 1 27 GLU HB2 1 41 PHE QD 4.280 . 5.140 3.571 2.965 4.414 . 0 0 "[ . 1 . 2]" 1
494 1 27 GLU HB2 1 41 PHE QE 4.650 . 5.580 3.129 2.623 3.436 . 0 0 "[ . 1 . 2]" 1
495 1 27 GLU HB2 1 56 ALA MB 6.170 . 7.400 5.995 5.149 6.882 . 0 0 "[ . 1 . 2]" 1
496 1 27 GLU HB3 1 27 GLU HG2 3.000 . 3.600 2.470 2.412 2.532 . 0 0 "[ . 1 . 2]" 1
497 1 27 GLU HB3 1 30 LEU HG 5.730 . 6.880 5.695 4.675 6.340 . 0 0 "[ . 1 . 2]" 1
498 1 27 GLU HB3 1 41 PHE HB2 5.790 . 6.950 3.460 2.681 4.400 . 0 0 "[ . 1 . 2]" 1
499 1 27 GLU HB3 1 41 PHE HB3 5.430 . 6.520 3.686 2.952 4.739 . 0 0 "[ . 1 . 2]" 1
500 1 27 GLU HB3 1 41 PHE QD 4.530 . 5.440 3.157 2.563 3.576 . 0 0 "[ . 1 . 2]" 1
501 1 27 GLU HB3 1 56 ALA MB 6.500 . 7.800 5.567 4.928 6.514 . 0 0 "[ . 1 . 2]" 1
502 1 27 GLU HG2 1 28 GLU H 3.220 . 3.860 2.766 2.461 3.042 . 0 0 "[ . 1 . 2]" 1
503 1 27 GLU HG2 1 28 GLU HA 3.730 . 4.480 4.368 4.000 4.512 0.032 1 0 "[ . 1 . 2]" 1
504 1 27 GLU HG2 1 31 ARG H 5.530 . 6.640 6.283 6.035 6.603 . 0 0 "[ . 1 . 2]" 1
505 1 27 GLU HG2 1 31 ARG HG2 4.590 . 5.510 5.047 4.356 5.522 0.012 8 0 "[ . 1 . 2]" 1
506 1 27 GLU HG2 1 31 ARG HG3 4.700 . 5.640 5.378 4.790 5.761 0.121 7 0 "[ . 1 . 2]" 1
507 1 27 GLU HG3 1 28 GLU H 3.950 . 4.740 2.783 2.291 3.265 . 0 0 "[ . 1 . 2]" 1
508 1 27 GLU HG3 1 28 GLU HA 3.740 . 4.490 3.125 2.809 3.437 . 0 0 "[ . 1 . 2]" 1
509 1 28 GLU H 1 28 GLU HB2 3.520 . 4.220 3.606 3.574 3.626 . 0 0 "[ . 1 . 2]" 1
510 1 28 GLU H 1 28 GLU HB3 2.990 . 3.590 2.528 2.405 2.631 . 0 0 "[ . 1 . 2]" 1
511 1 28 GLU H 1 28 GLU QG 3.110 . 3.730 2.219 1.954 2.479 . 0 0 "[ . 1 . 2]" 1
512 1 28 GLU HA 1 28 GLU QG 3.730 . 4.480 3.355 3.346 3.367 . 0 0 "[ . 1 . 2]" 1
513 1 28 GLU HA 1 31 ARG H 4.050 . 4.860 3.859 3.503 4.199 . 0 0 "[ . 1 . 2]" 1
514 1 28 GLU HA 1 31 ARG QD 4.150 . 4.980 4.121 2.896 5.128 0.148 14 0 "[ . 1 . 2]" 1
515 1 28 GLU HA 1 31 ARG HG2 4.890 . 5.870 4.270 2.465 5.524 . 0 0 "[ . 1 . 2]" 1
516 1 28 GLU HA 1 31 ARG HG3 3.770 . 4.520 3.470 2.727 4.123 . 0 0 "[ . 1 . 2]" 1
517 1 28 GLU HB2 1 28 GLU QG 2.520 . 3.020 2.371 2.337 2.437 . 0 0 "[ . 1 . 2]" 1
518 1 28 GLU HB3 1 28 GLU QG 2.600 . 3.120 2.322 2.258 2.357 . 0 0 "[ . 1 . 2]" 1
519 1 28 GLU QG 1 29 GLN H 3.440 . 4.130 2.280 1.908 2.625 . 0 0 "[ . 1 . 2]" 1
520 1 28 GLU QG 1 29 GLN HA 4.040 . 4.850 3.683 3.298 3.946 . 0 0 "[ . 1 . 2]" 1
521 1 28 GLU QG 1 29 GLN HE21 3.980 . 4.780 4.167 3.333 4.869 0.089 14 0 "[ . 1 . 2]" 1
522 1 28 GLU QG 1 29 GLN HE22 3.890 . 4.670 3.578 2.719 4.753 0.083 6 0 "[ . 1 . 2]" 1
523 1 28 GLU QG 1 29 GLN QG 4.280 . 5.140 3.771 2.754 4.138 . 0 0 "[ . 1 . 2]" 1
524 1 28 GLU HG2 1 29 GLN HA 4.670 . 5.600 5.146 4.576 5.438 . 0 0 "[ . 1 . 2]" 1
525 1 28 GLU HG3 1 29 GLN HA 4.670 . 5.600 3.774 3.378 4.057 . 0 0 "[ . 1 . 2]" 1
526 1 29 GLN H 1 29 GLN QB 3.180 . 3.820 2.814 2.634 2.945 . 0 0 "[ . 1 . 2]" 1
527 1 29 GLN H 1 29 GLN HE21 4.220 . 5.060 3.784 3.077 4.530 . 0 0 "[ . 1 . 2]" 1
528 1 29 GLN H 1 29 GLN QG 3.570 . 3.960 2.478 1.755 2.880 0.045 12 0 "[ . 1 . 2]" 1
529 1 29 GLN H 1 30 LEU HB2 4.470 . 5.360 4.551 4.287 4.725 . 0 0 "[ . 1 . 2]" 1
530 1 29 GLN H 1 30 LEU HG 4.220 . 5.060 3.872 3.652 4.173 . 0 0 "[ . 1 . 2]" 1
531 1 29 GLN H 1 31 ARG H 4.590 . 5.510 4.010 3.800 4.161 . 0 0 "[ . 1 . 2]" 1
532 1 29 GLN HA 1 29 GLN QG 3.590 . 4.310 3.453 3.336 3.490 . 0 0 "[ . 1 . 2]" 1
533 1 29 GLN HA 1 32 PRO HB2 4.680 . 5.620 4.869 4.408 5.303 . 0 0 "[ . 1 . 2]" 1
534 1 29 GLN HA 1 32 PRO HB3 4.140 . 4.970 3.452 2.832 3.915 . 0 0 "[ . 1 . 2]" 1
535 1 29 GLN HA 1 32 PRO HD3 4.890 . 5.870 3.218 2.932 3.656 . 0 0 "[ . 1 . 2]" 1
536 1 29 GLN HA 1 32 PRO HG2 5.440 . 6.530 4.747 4.047 5.375 . 0 0 "[ . 1 . 2]" 1
537 1 29 GLN HA 1 32 PRO HG3 4.720 . 5.660 3.055 2.350 3.822 . 0 0 "[ . 1 . 2]" 1
538 1 29 GLN QB 1 29 GLN HE22 4.480 . 5.380 4.145 3.572 4.260 . 0 0 "[ . 1 . 2]" 1
539 1 29 GLN QB 1 30 LEU HA 4.550 . 5.460 4.445 4.367 4.622 . 0 0 "[ . 1 . 2]" 1
540 1 29 GLN QB 1 30 LEU HG 5.660 . 6.790 4.468 4.199 4.904 . 0 0 "[ . 1 . 2]" 1
541 1 29 GLN QB 1 73 PHE QE 5.150 . 6.040 2.832 1.906 3.478 . 0 0 "[ . 1 . 2]" 1
542 1 29 GLN QB 1 76 TYR QE 4.050 . 4.860 3.032 1.858 4.007 . 0 0 "[ . 1 . 2]" 1
543 1 29 GLN QG 1 30 LEU H 3.420 . 4.100 2.741 2.298 3.243 . 0 0 "[ . 1 . 2]" 1
544 1 29 GLN QG 1 32 PRO HB3 6.500 . 7.800 6.391 5.979 6.829 . 0 0 "[ . 1 . 2]" 1
545 1 29 GLN QG 1 32 PRO HD3 5.410 . 6.490 5.041 4.777 5.227 . 0 0 "[ . 1 . 2]" 1
546 1 29 GLN QG 1 32 PRO HG3 6.500 . 7.800 5.590 5.348 5.934 . 0 0 "[ . 1 . 2]" 1
547 1 29 GLN QG 1 76 TYR QE 4.510 . 5.410 3.123 1.719 4.112 0.081 9 0 "[ . 1 . 2]" 1
548 1 30 LEU H 1 30 LEU HB2 3.360 . 4.030 2.506 2.448 2.573 . 0 0 "[ . 1 . 2]" 1
549 1 30 LEU H 1 30 LEU HB3 3.720 . 4.460 3.664 3.620 3.722 . 0 0 "[ . 1 . 2]" 1
550 1 30 LEU H 1 30 LEU QD 3.460 . 4.150 3.190 2.878 3.343 . 0 0 "[ . 1 . 2]" 1
551 1 30 LEU H 1 30 LEU HG 3.480 . 4.180 2.627 2.489 2.917 . 0 0 "[ . 1 . 2]" 1
552 1 30 LEU H 1 31 ARG H 2.990 . 3.590 2.327 2.123 2.540 . 0 0 "[ . 1 . 2]" 1
553 1 30 LEU H 1 31 ARG HA 5.030 . 6.040 5.015 4.843 5.186 . 0 0 "[ . 1 . 2]" 1
554 1 30 LEU H 1 31 ARG HB3 5.440 . 6.530 5.130 4.645 5.425 . 0 0 "[ . 1 . 2]" 1
555 1 30 LEU H 1 31 ARG HG2 4.840 . 5.810 4.583 3.774 5.360 . 0 0 "[ . 1 . 2]" 1
556 1 30 LEU H 1 31 ARG HG3 4.430 . 5.320 4.290 3.466 5.164 . 0 0 "[ . 1 . 2]" 1
557 1 30 LEU HA 1 30 LEU QD 3.070 . 3.680 1.995 1.948 2.050 . 0 0 "[ . 1 . 2]" 1
558 1 30 LEU HA 1 30 LEU HG 3.850 . 4.620 3.212 3.131 3.386 . 0 0 "[ . 1 . 2]" 1
559 1 30 LEU HA 1 41 PHE QE 5.240 . 6.290 4.699 4.354 5.254 . 0 0 "[ . 1 . 2]" 1
560 1 30 LEU HB2 1 31 ARG H 3.560 . 4.270 3.205 2.980 3.539 . 0 0 "[ . 1 . 2]" 1
561 1 30 LEU HB2 1 41 PHE QD 4.010 . 4.810 3.740 3.228 4.440 . 0 0 "[ . 1 . 2]" 1
562 1 30 LEU HB2 1 41 PHE QE 3.890 . 4.670 2.501 1.999 3.309 . 0 0 "[ . 1 . 2]" 1
563 1 30 LEU HB3 1 31 ARG H 4.000 . 4.800 4.083 3.892 4.293 . 0 0 "[ . 1 . 2]" 1
564 1 30 LEU HB3 1 31 ARG HA 4.880 . 5.860 4.839 4.696 4.954 . 0 0 "[ . 1 . 2]" 1
565 1 30 LEU HB3 1 31 ARG HG2 5.570 . 6.680 5.291 4.656 5.959 . 0 0 "[ . 1 . 2]" 1
566 1 30 LEU HB3 1 41 PHE QE 6.500 . 7.800 2.394 2.036 2.943 . 0 0 "[ . 1 . 2]" 1
567 1 30 LEU QD 1 31 ARG H 4.720 . 5.660 4.298 4.185 4.382 . 0 0 "[ . 1 . 2]" 1
568 1 30 LEU QD 1 41 PHE QD 4.420 . 5.300 2.236 1.948 2.674 . 0 0 "[ . 1 . 2]" 1
569 1 30 LEU QD 1 42 PHE H 4.800 . 5.760 4.903 4.534 5.476 . 0 0 "[ . 1 . 2]" 1
570 1 30 LEU QD 1 42 PHE QD 4.500 . 5.400 4.675 4.179 5.168 . 0 0 "[ . 1 . 2]" 1
571 1 30 LEU QD 1 73 PHE QD 5.510 . 6.610 4.460 3.988 5.055 . 0 0 "[ . 1 . 2]" 1
572 1 30 LEU QD 1 76 TYR QE 4.430 . 5.320 3.769 2.856 4.779 . 0 0 "[ . 1 . 2]" 1
573 1 30 LEU HG 1 41 PHE QE 4.420 . 5.300 4.350 4.074 4.665 . 0 0 "[ . 1 . 2]" 1
574 1 31 ARG H 1 31 ARG HB3 3.420 . 4.100 3.310 3.098 3.429 . 0 0 "[ . 1 . 2]" 1
575 1 31 ARG H 1 31 ARG HD2 5.640 . 6.770 4.328 3.037 5.130 . 0 0 "[ . 1 . 2]" 1
576 1 31 ARG H 1 31 ARG QD 4.880 . 5.860 3.907 2.976 4.452 . 0 0 "[ . 1 . 2]" 1
577 1 31 ARG H 1 31 ARG HD3 5.640 . 6.770 4.679 4.271 4.999 . 0 0 "[ . 1 . 2]" 1
578 1 31 ARG H 1 31 ARG HG2 3.160 . 3.790 3.136 2.404 3.855 0.065 2 0 "[ . 1 . 2]" 1
579 1 31 ARG H 1 31 ARG HG3 3.590 . 4.310 2.579 2.076 3.253 . 0 0 "[ . 1 . 2]" 1
580 1 31 ARG H 1 32 PRO HA 4.460 . 5.350 4.617 4.467 4.783 . 0 0 "[ . 1 . 2]" 1
581 1 31 ARG H 1 32 PRO HB3 4.870 . 5.840 4.562 4.315 4.853 . 0 0 "[ . 1 . 2]" 1
582 1 31 ARG H 1 32 PRO HD2 4.200 . 5.040 3.512 3.104 4.041 . 0 0 "[ . 1 . 2]" 1
583 1 31 ARG H 1 32 PRO HD3 5.420 . 6.500 2.336 2.008 2.859 . 0 0 "[ . 1 . 2]" 1
584 1 31 ARG H 1 33 LEU H 4.930 . 5.920 4.958 4.761 5.106 . 0 0 "[ . 1 . 2]" 1
585 1 31 ARG HA 1 31 ARG HG3 3.680 . 4.420 3.695 3.593 3.770 . 0 0 "[ . 1 . 2]" 1
586 1 31 ARG HA 1 33 LEU H 3.380 . 4.060 3.161 2.908 3.533 . 0 0 "[ . 1 . 2]" 1
587 1 31 ARG HA 1 33 LEU HB2 5.050 . 6.060 4.215 3.933 4.547 . 0 0 "[ . 1 . 2]" 1
588 1 31 ARG HA 1 33 LEU QD 3.610 . 4.330 2.230 1.936 2.610 . 0 0 "[ . 1 . 2]" 1
589 1 31 ARG HA 1 33 LEU HG 4.380 . 5.260 5.152 4.959 5.306 0.046 10 0 "[ . 1 . 2]" 1
590 1 31 ARG HB2 1 31 ARG QD 3.270 . 3.920 2.310 2.212 2.700 . 0 0 "[ . 1 . 2]" 1
591 1 31 ARG HB2 1 33 LEU H 4.410 . 5.290 3.915 3.613 4.242 . 0 0 "[ . 1 . 2]" 1
592 1 31 ARG HB2 1 38 TYR QD 4.600 . 5.520 3.862 3.111 4.534 . 0 0 "[ . 1 . 2]" 1
593 1 31 ARG HB3 1 32 PRO HD2 5.950 . 7.140 4.983 4.823 5.128 . 0 0 "[ . 1 . 2]" 1
594 1 31 ARG HB3 1 32 PRO HD3 5.000 . 6.000 4.893 4.774 4.984 . 0 0 "[ . 1 . 2]" 1
595 1 31 ARG HB3 1 38 TYR HA 3.880 . 4.660 4.378 3.594 4.692 0.032 5 0 "[ . 1 . 2]" 1
596 1 31 ARG HB3 1 38 TYR HB3 3.520 . 4.220 2.854 2.416 3.192 . 0 0 "[ . 1 . 2]" 1
597 1 31 ARG HB3 1 38 TYR QD 4.780 . 5.740 4.344 3.547 4.860 . 0 0 "[ . 1 . 2]" 1
598 1 31 ARG QD 1 38 TYR HB2 5.100 . 6.120 3.693 2.246 5.402 . 0 0 "[ . 1 . 2]" 1
599 1 31 ARG HG2 1 32 PRO HD3 5.970 . 7.160 5.266 4.112 5.909 . 0 0 "[ . 1 . 2]" 1
600 1 31 ARG HG3 1 32 PRO HA 4.460 . 5.350 4.736 3.892 5.465 0.115 16 0 "[ . 1 . 2]" 1
601 1 31 ARG HG3 1 32 PRO HB3 5.650 . 6.780 5.633 4.923 6.035 . 0 0 "[ . 1 . 2]" 1
602 1 32 PRO HA 1 33 LEU QD 4.910 . 5.890 4.048 3.837 4.230 . 0 0 "[ . 1 . 2]" 1
603 1 32 PRO HB2 1 33 LEU HA 4.580 . 5.500 4.614 4.458 4.665 . 0 0 "[ . 1 . 2]" 1
604 1 32 PRO HB2 1 33 LEU QD 5.610 . 6.730 4.229 4.132 4.376 . 0 0 "[ . 1 . 2]" 1
605 1 32 PRO HB2 1 69 PHE QD 4.630 . 5.560 4.996 4.239 5.471 . 0 0 "[ . 1 . 2]" 1
606 1 32 PRO HB2 1 69 PHE QE 4.420 . 5.300 3.123 2.623 3.967 . 0 0 "[ . 1 . 2]" 1
607 1 32 PRO HB3 1 33 LEU H 4.440 . 5.330 4.608 4.528 4.683 . 0 0 "[ . 1 . 2]" 1
608 1 32 PRO HB3 1 33 LEU HA 5.880 . 7.060 5.854 5.763 5.890 . 0 0 "[ . 1 . 2]" 1
609 1 32 PRO HB3 1 33 LEU QD 5.560 . 6.670 4.607 4.483 4.722 . 0 0 "[ . 1 . 2]" 1
610 1 32 PRO HD2 1 33 LEU H 4.830 . 5.800 3.181 2.746 3.704 . 0 0 "[ . 1 . 2]" 1
611 1 32 PRO HD2 1 33 LEU QD 4.760 . 5.710 2.010 1.794 2.288 0.006 8 0 "[ . 1 . 2]" 1
612 1 32 PRO HD2 1 33 LEU HG 4.210 . 5.050 4.332 3.864 4.721 . 0 0 "[ . 1 . 2]" 1
613 1 32 PRO HD3 1 33 LEU QD 5.040 . 6.050 3.409 3.215 3.627 . 0 0 "[ . 1 . 2]" 1
614 1 32 PRO HD3 1 33 LEU HG 6.500 . 7.800 6.049 5.593 6.419 . 0 0 "[ . 1 . 2]" 1
615 1 32 PRO HG2 1 33 LEU HG 4.000 . 4.800 4.530 3.563 4.830 0.030 12 0 "[ . 1 . 2]" 1
616 1 32 PRO HG3 1 33 LEU H 5.080 . 6.100 4.955 4.665 5.286 . 0 0 "[ . 1 . 2]" 1
617 1 32 PRO HG3 1 33 LEU QD 6.120 . 7.340 4.014 3.816 4.216 . 0 0 "[ . 1 . 2]" 1
618 1 32 PRO HG3 1 69 PHE QD 4.160 . 4.990 4.284 3.722 4.962 . 0 0 "[ . 1 . 2]" 1
619 1 33 LEU H 1 33 LEU HB2 3.740 . 4.490 2.415 2.347 2.527 . 0 0 "[ . 1 . 2]" 1
620 1 33 LEU H 1 33 LEU QD 3.880 . 4.660 1.929 1.782 2.118 0.018 10 0 "[ . 1 . 2]" 1
621 1 33 LEU H 1 33 LEU HG 3.530 . 4.240 3.614 3.252 3.764 . 0 0 "[ . 1 . 2]" 1
622 1 33 LEU H 1 38 TYR HB3 6.500 . 7.800 6.284 5.630 6.822 . 0 0 "[ . 1 . 2]" 1
623 1 33 LEU H 1 38 TYR QD 6.500 . 7.800 6.716 5.856 7.441 . 0 0 "[ . 1 . 2]" 1
624 1 33 LEU HA 1 33 LEU HG 3.760 . 4.510 2.541 2.469 2.653 . 0 0 "[ . 1 . 2]" 1
625 1 33 LEU HA 1 34 PRO HB2 5.680 . 6.820 5.579 5.273 5.716 . 0 0 "[ . 1 . 2]" 1
626 1 33 LEU HA 1 34 PRO HB3 5.110 . 6.130 5.090 4.592 5.543 . 0 0 "[ . 1 . 2]" 1
627 1 33 LEU HA 1 34 PRO QD 3.500 . 4.200 2.076 1.838 2.238 . 0 0 "[ . 1 . 2]" 1
628 1 33 LEU HA 1 34 PRO HG2 5.020 . 6.020 4.485 4.255 4.665 . 0 0 "[ . 1 . 2]" 1
629 1 33 LEU HA 1 34 PRO HG3 5.380 . 6.460 4.460 3.899 4.693 . 0 0 "[ . 1 . 2]" 1
630 1 33 LEU HB2 1 34 PRO QD 4.420 . 5.300 3.658 3.379 4.041 . 0 0 "[ . 1 . 2]" 1
631 1 33 LEU HB2 1 34 PRO HG2 5.320 . 6.380 5.460 5.004 6.404 0.024 10 0 "[ . 1 . 2]" 1
632 1 33 LEU HB2 1 36 HIS QB 4.510 . 5.410 3.273 2.167 4.428 . 0 0 "[ . 1 . 2]" 1
633 1 33 LEU HB2 1 60 PHE QE 6.450 . 7.740 5.700 5.157 6.189 . 0 0 "[ . 1 . 2]" 1
634 1 33 LEU HB2 1 69 PHE QE 6.500 . 7.800 5.055 4.781 5.475 . 0 0 "[ . 1 . 2]" 1
635 1 33 LEU HB3 1 34 PRO HD2 3.820 . 4.580 2.285 1.870 2.991 . 0 0 "[ . 1 . 2]" 1
636 1 33 LEU HB3 1 34 PRO HD3 3.820 . 4.580 3.607 2.963 4.258 . 0 0 "[ . 1 . 2]" 1
637 1 33 LEU HB3 1 36 HIS QB 5.190 . 6.230 3.199 1.976 4.445 . 0 0 "[ . 1 . 2]" 1
638 1 33 LEU HB3 1 60 PHE QE 6.010 . 7.210 5.155 4.408 5.538 . 0 0 "[ . 1 . 2]" 1
639 1 33 LEU HB3 1 69 PHE QE 6.400 . 7.680 4.009 3.726 4.668 . 0 0 "[ . 1 . 2]" 1
640 1 33 LEU QD 1 34 PRO QD 3.870 . 4.640 3.359 3.151 3.672 . 0 0 "[ . 1 . 2]" 1
641 1 33 LEU QD 1 34 PRO HG2 6.490 . 7.790 4.852 4.484 5.724 . 0 0 "[ . 1 . 2]" 1
642 1 33 LEU QD 1 38 TYR QD 6.500 . 7.800 5.517 4.907 6.099 . 0 0 "[ . 1 . 2]" 1
643 1 33 LEU QD 1 58 ILE HB 5.920 . 7.100 4.852 4.145 5.512 . 0 0 "[ . 1 . 2]" 1
644 1 33 LEU QD 1 58 ILE MD 3.700 . 4.440 3.461 2.794 3.866 . 0 0 "[ . 1 . 2]" 1
645 1 33 LEU QD 1 58 ILE QG 5.640 . 6.770 4.526 3.902 4.949 . 0 0 "[ . 1 . 2]" 1
646 1 33 LEU QD 1 58 ILE MG 4.250 . 5.100 2.781 2.163 3.359 . 0 0 "[ . 1 . 2]" 1
647 1 33 LEU QD 1 60 PHE HA 3.680 . 4.420 3.449 2.537 4.432 0.012 5 0 "[ . 1 . 2]" 1
648 1 33 LEU QD 1 60 PHE QD 3.970 . 4.760 3.029 2.735 3.488 . 0 0 "[ . 1 . 2]" 1
649 1 33 LEU QD 1 60 PHE QE 4.300 . 4.610 2.451 1.960 2.925 . 0 0 "[ . 1 . 2]" 1
650 1 33 LEU QD 1 65 ASP QB 4.400 . 5.280 3.271 2.002 4.235 . 0 0 "[ . 1 . 2]" 1
651 1 33 LEU HG 1 34 PRO QD 4.620 . 5.540 3.253 3.058 3.748 . 0 0 "[ . 1 . 2]" 1
652 1 33 LEU HG 1 36 HIS QB 5.190 . 6.230 4.884 3.950 6.266 0.036 10 0 "[ . 1 . 2]" 1
653 1 33 LEU HG 1 69 PHE QD . . 4.600 3.146 2.867 3.528 . 0 0 "[ . 1 . 2]" 1
654 1 34 PRO HA 1 35 ALA HA 4.710 . 5.650 4.618 4.416 4.703 . 0 0 "[ . 1 . 2]" 1
655 1 34 PRO HA 1 35 ALA MB 4.490 . 5.390 4.462 3.911 4.947 . 0 0 "[ . 1 . 2]" 1
656 1 34 PRO HB2 1 35 ALA MB 4.350 . 5.220 3.356 3.112 4.239 . 0 0 "[ . 1 . 2]" 1
657 1 34 PRO HB3 1 35 ALA H 4.610 . 5.530 3.916 3.293 4.662 . 0 0 "[ . 1 . 2]" 1
658 1 34 PRO HB3 1 35 ALA MB 5.100 . 6.120 4.680 4.221 5.236 . 0 0 "[ . 1 . 2]" 1
659 1 34 PRO HB3 1 69 PHE QE 4.670 . 5.600 5.239 4.557 5.509 . 0 0 "[ . 1 . 2]" 1
660 1 34 PRO QD 1 69 PHE QD 4.110 . 4.930 3.886 2.988 4.208 . 0 0 "[ . 1 . 2]" 1
661 1 34 PRO HD2 1 69 PHE QD 4.740 . 5.690 4.220 3.284 4.522 . 0 0 "[ . 1 . 2]" 1
662 1 34 PRO HD2 1 69 PHE QE 4.500 . 5.400 2.643 2.207 3.203 . 0 0 "[ . 1 . 2]" 1
663 1 34 PRO HD3 1 69 PHE QD 4.740 . 5.690 4.607 3.437 5.116 . 0 0 "[ . 1 . 2]" 1
664 1 34 PRO HD3 1 69 PHE QE 4.500 . 5.400 2.506 1.927 3.123 . 0 0 "[ . 1 . 2]" 1
665 1 34 PRO HG2 1 35 ALA H 4.970 . 5.960 2.671 1.779 5.107 0.021 3 0 "[ . 1 . 2]" 1
666 1 34 PRO HG2 1 65 ASP QB 6.100 . 7.320 4.817 3.531 6.031 . 0 0 "[ . 1 . 2]" 1
667 1 34 PRO HG3 1 65 ASP QB 6.270 . 7.520 5.525 4.401 7.322 . 0 0 "[ . 1 . 2]" 1
668 1 34 PRO HG3 1 68 LEU MD1 6.460 . 7.750 6.308 4.641 7.001 . 0 0 "[ . 1 . 2]" 1
669 1 34 PRO HG3 1 69 PHE QD 4.890 . 5.870 5.624 4.507 5.839 . 0 0 "[ . 1 . 2]" 1
670 1 34 PRO HG3 1 69 PHE QE 4.940 . 5.930 3.630 3.269 3.860 . 0 0 "[ . 1 . 2]" 1
671 1 35 ALA H 1 35 ALA MB 3.020 . 3.620 2.684 2.285 2.882 . 0 0 "[ . 1 . 2]" 1
672 1 35 ALA MB 1 36 HIS H 3.720 . 4.460 3.377 1.801 3.731 . 0 0 "[ . 1 . 2]" 1
673 1 36 HIS HA 1 37 ASP H 3.480 . 4.180 2.497 2.228 2.846 . 0 0 "[ . 1 . 2]" 1
674 1 36 HIS HA 1 37 ASP HA 4.600 . 5.520 4.408 4.251 4.591 . 0 0 "[ . 1 . 2]" 1
675 1 36 HIS HA 1 61 ARG H 4.820 . 5.780 4.174 2.238 5.792 0.012 11 0 "[ . 1 . 2]" 1
676 1 36 HIS HA 1 61 ARG HB2 6.210 . 7.450 3.217 2.087 4.431 . 0 0 "[ . 1 . 2]" 1
677 1 36 HIS HA 1 61 ARG HB3 5.270 . 6.320 4.402 2.556 5.719 . 0 0 "[ . 1 . 2]" 1
678 1 36 HIS HA 1 61 ARG HD2 4.930 . 5.920 4.698 1.755 5.910 0.045 10 0 "[ . 1 . 2]" 1
679 1 36 HIS HA 1 61 ARG QD 4.180 . 5.020 4.146 1.749 5.083 0.063 20 0 "[ . 1 . 2]" 1
680 1 36 HIS HA 1 61 ARG HD3 4.930 . 5.920 4.856 3.361 5.884 . 0 0 "[ . 1 . 2]" 1
681 1 36 HIS HA 1 61 ARG QG 4.070 . 4.880 2.667 1.853 4.046 . 0 0 "[ . 1 . 2]" 1
682 1 36 HIS QB 1 37 ASP H 3.380 . 4.060 2.321 1.848 2.913 . 0 0 "[ . 1 . 2]" 1
683 1 36 HIS QB 1 37 ASP HA 4.920 . 5.900 4.505 4.249 5.053 . 0 0 "[ . 1 . 2]" 1
684 1 36 HIS QB 1 58 ILE MG 4.820 . 5.780 4.605 3.616 5.427 . 0 0 "[ . 1 . 2]" 1
685 1 36 HIS QB 1 60 PHE HA 4.250 . 5.100 2.992 2.169 3.778 . 0 0 "[ . 1 . 2]" 1
686 1 36 HIS QB 1 60 PHE QD 5.340 . 6.410 4.415 3.644 5.017 . 0 0 "[ . 1 . 2]" 1
687 1 36 HIS QB 1 61 ARG HB2 6.270 . 7.520 3.321 2.231 4.869 . 0 0 "[ . 1 . 2]" 1
688 1 36 HIS HB2 1 37 ASP H 3.900 . 4.680 2.674 1.942 3.789 . 0 0 "[ . 1 . 2]" 1
689 1 36 HIS HB2 1 58 ILE MG 5.680 . 6.820 4.948 3.749 5.853 . 0 0 "[ . 1 . 2]" 1
690 1 36 HIS HB2 1 60 PHE HA 4.880 . 5.860 3.341 2.199 5.119 . 0 0 "[ . 1 . 2]" 1
691 1 36 HIS HB3 1 37 ASP H 3.900 . 4.680 3.337 1.877 4.155 . 0 0 "[ . 1 . 2]" 1
692 1 36 HIS HB3 1 58 ILE MG 5.680 . 6.820 5.541 4.746 6.422 . 0 0 "[ . 1 . 2]" 1
693 1 36 HIS HB3 1 60 PHE HA 4.880 . 5.860 3.742 2.906 4.710 . 0 0 "[ . 1 . 2]" 1
694 1 37 ASP H 1 37 ASP HB2 4.140 . 4.970 2.653 2.380 3.168 . 0 0 "[ . 1 . 2]" 1
695 1 37 ASP H 1 37 ASP QB 3.640 . 4.370 2.372 2.231 2.585 . 0 0 "[ . 1 . 2]" 1
696 1 37 ASP H 1 37 ASP HB3 4.140 . 4.970 2.895 2.398 3.773 . 0 0 "[ . 1 . 2]" 1
697 1 37 ASP H 1 38 TYR H 4.750 . 5.700 4.546 4.291 4.650 . 0 0 "[ . 1 . 2]" 1
698 1 37 ASP H 1 38 TYR QD 5.630 . 6.760 5.430 4.831 6.055 . 0 0 "[ . 1 . 2]" 1
699 1 37 ASP H 1 58 ILE MG 5.400 . 6.480 5.594 4.264 6.509 0.029 5 0 "[ . 1 . 2]" 1
700 1 37 ASP H 1 59 ASN QD 4.190 . 5.030 4.140 2.780 5.046 0.016 4 0 "[ . 1 . 2]" 1
701 1 37 ASP H 1 60 PHE HA 4.590 . 5.510 4.322 2.675 5.430 . 0 0 "[ . 1 . 2]" 1
702 1 37 ASP H 1 61 ARG H 4.620 . 5.540 4.437 3.296 5.346 . 0 0 "[ . 1 . 2]" 1
703 1 37 ASP H 1 61 ARG HA 5.140 . 6.170 5.407 5.009 5.979 . 0 0 "[ . 1 . 2]" 1
704 1 37 ASP H 1 61 ARG QD 4.240 . 5.090 3.641 2.645 4.945 . 0 0 "[ . 1 . 2]" 1
705 1 37 ASP H 1 61 ARG HG2 4.990 . 5.990 2.940 2.065 4.655 . 0 0 "[ . 1 . 2]" 1
706 1 37 ASP H 1 61 ARG QG 4.210 . 5.050 2.563 1.889 4.402 . 0 0 "[ . 1 . 2]" 1
707 1 37 ASP H 1 61 ARG HG3 4.990 . 5.990 3.233 2.032 5.428 . 0 0 "[ . 1 . 2]" 1
708 1 37 ASP QB 1 59 ASN H 4.560 . 5.470 4.657 3.758 5.517 0.047 2 0 "[ . 1 . 2]" 1
709 1 37 ASP QB 1 59 ASN QB 4.360 . 5.230 2.730 1.771 4.432 0.029 3 0 "[ . 1 . 2]" 1
710 1 37 ASP QB 1 59 ASN QD 3.160 . 3.790 2.180 1.762 3.305 0.038 15 0 "[ . 1 . 2]" 1
711 1 37 ASP QB 1 61 ARG QD 3.470 . 4.160 3.226 2.194 4.367 0.207 10 0 "[ . 1 . 2]" 1
712 1 37 ASP QB 1 61 ARG QG 3.960 . 4.750 3.209 2.272 4.612 . 0 0 "[ . 1 . 2]" 1
713 1 37 ASP HB2 1 61 ARG HG2 5.270 . 6.320 4.005 2.922 5.382 . 0 0 "[ . 1 . 2]" 1
714 1 37 ASP HB2 1 61 ARG HG3 5.270 . 6.320 4.109 2.451 6.334 0.014 12 0 "[ . 1 . 2]" 1
715 1 37 ASP HB3 1 61 ARG HG2 5.270 . 6.320 4.275 2.592 6.200 . 0 0 "[ . 1 . 2]" 1
716 1 37 ASP HB3 1 61 ARG HG3 5.270 . 6.320 4.669 2.887 6.333 0.013 15 0 "[ . 1 . 2]" 1
717 1 38 TYR H 1 38 TYR QD 5.390 . 6.470 2.843 2.177 3.177 . 0 0 "[ . 1 . 2]" 1
718 1 38 TYR H 1 39 PHE H 4.680 . 5.620 4.417 4.280 4.553 . 0 0 "[ . 1 . 2]" 1
719 1 38 TYR HA 1 38 TYR QD 4.080 . 4.900 3.743 3.696 3.776 . 0 0 "[ . 1 . 2]" 1
720 1 38 TYR HA 1 39 PHE H 3.430 . 4.120 2.312 2.145 2.778 . 0 0 "[ . 1 . 2]" 1
721 1 38 TYR HA 1 58 ILE QG 6.500 . 7.130 4.829 3.935 5.720 . 0 0 "[ . 1 . 2]" 1
722 1 38 TYR HB2 1 39 PHE H 4.600 . 5.520 2.762 1.888 3.396 . 0 0 "[ . 1 . 2]" 1
723 1 38 TYR HB2 1 41 PHE QE 4.990 . 5.990 2.493 1.547 3.504 0.253 7 0 "[ . 1 . 2]" 1
724 1 38 TYR HB3 1 39 PHE H 4.790 . 5.750 3.864 3.457 4.166 . 0 0 "[ . 1 . 2]" 1
725 1 39 PHE H 1 39 PHE HB2 3.990 . 4.790 2.390 2.163 2.835 . 0 0 "[ . 1 . 2]" 1
726 1 39 PHE H 1 40 GLU H 4.640 . 5.570 4.337 3.160 4.607 . 0 0 "[ . 1 . 2]" 1
727 1 39 PHE H 1 41 PHE QE 4.470 . 5.360 3.869 2.979 4.699 . 0 0 "[ . 1 . 2]" 1
728 1 39 PHE H 1 58 ILE HA 3.670 . 4.400 2.932 2.171 3.701 . 0 0 "[ . 1 . 2]" 1
729 1 39 PHE H 1 58 ILE MG 4.860 . 5.830 4.211 3.546 4.916 . 0 0 "[ . 1 . 2]" 1
730 1 39 PHE HA 1 40 GLU H 3.180 . 3.820 2.764 2.373 3.563 . 0 0 "[ . 1 . 2]" 1
731 1 39 PHE HA 1 40 GLU HA 4.710 . 5.650 4.364 4.287 4.748 . 0 0 "[ . 1 . 2]" 1
732 1 39 PHE HA 1 40 GLU QG 4.690 . 5.630 4.410 4.005 4.838 . 0 0 "[ . 1 . 2]" 1
733 1 39 PHE HB2 1 58 ILE HA 5.050 . 6.060 3.234 2.669 3.722 . 0 0 "[ . 1 . 2]" 1
734 1 39 PHE HB2 1 58 ILE QG 5.640 . 6.770 4.875 4.609 5.436 . 0 0 "[ . 1 . 2]" 1
735 1 39 PHE HB2 1 58 ILE MG 4.490 . 5.390 4.919 4.176 5.470 0.080 16 0 "[ . 1 . 2]" 1
736 1 39 PHE HB3 1 40 GLU H 3.830 . 4.600 2.281 1.780 3.510 0.020 19 0 "[ . 1 . 2]" 1
737 1 39 PHE HB3 1 40 GLU QB 5.280 . 6.340 4.576 4.119 5.507 . 0 0 "[ . 1 . 2]" 1
738 1 39 PHE HB3 1 56 ALA MB 5.590 . 6.710 5.046 4.042 5.793 . 0 0 "[ . 1 . 2]" 1
739 1 39 PHE HB3 1 57 TYR H 3.910 . 4.690 3.367 2.819 3.807 . 0 0 "[ . 1 . 2]" 1
740 1 39 PHE HB3 1 57 TYR HB2 6.200 . 7.440 2.372 1.776 4.611 0.024 18 0 "[ . 1 . 2]" 1
741 1 39 PHE QD 1 40 GLU H 3.980 . 4.780 2.210 1.754 2.918 0.046 13 0 "[ . 1 . 2]" 1
742 1 39 PHE QD 1 40 GLU QB 4.170 . 5.000 3.755 2.700 4.340 . 0 0 "[ . 1 . 2]" 1
743 1 39 PHE QD 1 40 GLU QG 3.850 . 4.620 2.280 1.741 2.850 0.059 7 0 "[ . 1 . 2]" 1
744 1 39 PHE QD 1 58 ILE MG 5.150 . 6.180 5.548 4.685 6.043 . 0 0 "[ . 1 . 2]" 1
745 1 39 PHE QD 1 59 ASN H 5.080 . 6.100 4.182 3.333 5.075 . 0 0 "[ . 1 . 2]" 1
746 1 39 PHE QD 1 59 ASN HB2 5.010 . 6.010 2.750 1.836 4.588 . 0 0 "[ . 1 . 2]" 1
747 1 39 PHE QD 1 59 ASN HB3 5.010 . 6.010 3.627 2.691 4.399 . 0 0 "[ . 1 . 2]" 1
748 1 39 PHE QE 1 40 GLU H 4.070 . 4.880 4.168 3.658 4.828 . 0 0 "[ . 1 . 2]" 1
749 1 39 PHE QE 1 40 GLU QB 5.410 . 6.490 4.845 3.776 6.069 . 0 0 "[ . 1 . 2]" 1
750 1 39 PHE QE 1 40 GLU QG 5.270 . 5.560 3.508 2.504 4.640 . 0 0 "[ . 1 . 2]" 1
751 1 39 PHE QE 1 57 TYR HB2 5.340 . 6.410 4.332 3.195 5.179 . 0 0 "[ . 1 . 2]" 1
752 1 39 PHE QE 1 57 TYR HB3 5.180 . 6.220 4.719 4.160 5.526 . 0 0 "[ . 1 . 2]" 1
753 1 39 PHE QE 1 59 ASN QB 4.500 . 5.400 3.649 2.196 4.893 . 0 0 "[ . 1 . 2]" 1
754 1 40 GLU H 1 40 GLU QG 3.710 . 4.450 2.001 1.800 2.723 0.000 1 0 "[ . 1 . 2]" 1
755 1 40 GLU HA 1 41 PHE H 3.160 . 3.790 2.204 2.132 2.466 . 0 0 "[ . 1 . 2]" 1
756 1 40 GLU HA 1 41 PHE HA 4.460 . 5.350 4.446 4.408 4.473 . 0 0 "[ . 1 . 2]" 1
757 1 40 GLU HA 1 41 PHE HB2 4.940 . 5.930 4.642 4.553 4.743 . 0 0 "[ . 1 . 2]" 1
758 1 40 GLU HA 1 41 PHE QE 4.660 . 5.590 4.944 3.686 5.448 . 0 0 "[ . 1 . 2]" 1
759 1 40 GLU HA 1 56 ALA HA 6.500 . 7.800 6.127 5.626 6.910 . 0 0 "[ . 1 . 2]" 1
760 1 40 GLU HA 1 56 ALA MB 5.510 . 6.610 5.652 5.268 6.246 . 0 0 "[ . 1 . 2]" 1
761 1 40 GLU QB 1 41 PHE H 4.460 . 4.510 3.076 2.332 3.636 . 0 0 "[ . 1 . 2]" 1
762 1 40 GLU QB 1 41 PHE HA 4.960 . 5.950 4.473 4.277 4.860 . 0 0 "[ . 1 . 2]" 1
763 1 40 GLU QB 1 41 PHE QD 5.610 . 6.730 5.149 4.395 5.516 . 0 0 "[ . 1 . 2]" 1
764 1 40 GLU QG 1 41 PHE H 4.200 . 5.040 4.130 3.413 4.468 . 0 0 "[ . 1 . 2]" 1
765 1 40 GLU QG 1 41 PHE HA 5.340 . 5.360 4.234 3.795 4.656 . 0 0 "[ . 1 . 2]" 1
766 1 40 GLU QG 1 41 PHE HB2 6.370 . 7.640 6.119 5.711 6.395 . 0 0 "[ . 1 . 2]" 1
767 1 40 GLU QG 1 41 PHE HB3 6.500 . 7.800 6.345 5.904 6.707 . 0 0 "[ . 1 . 2]" 1
768 1 40 GLU QG 1 56 ALA HA 5.100 . 6.120 3.970 3.094 5.052 . 0 0 "[ . 1 . 2]" 1
769 1 40 GLU QG 1 56 ALA MB 5.630 . 6.760 4.744 4.055 5.343 . 0 0 "[ . 1 . 2]" 1
770 1 40 GLU QG 1 57 TYR H 4.960 . 5.950 3.873 2.939 4.869 . 0 0 "[ . 1 . 2]" 1
771 1 41 PHE H 1 41 PHE HB2 3.700 . 4.440 2.641 2.478 2.882 . 0 0 "[ . 1 . 2]" 1
772 1 41 PHE H 1 41 PHE HB3 3.890 . 4.670 3.751 3.606 3.897 . 0 0 "[ . 1 . 2]" 1
773 1 41 PHE H 1 41 PHE QD 3.910 . 4.690 2.829 2.160 3.217 . 0 0 "[ . 1 . 2]" 1
774 1 41 PHE H 1 56 ALA HA 6.070 . 7.280 5.424 4.868 6.363 . 0 0 "[ . 1 . 2]" 1
775 1 41 PHE HA 1 41 PHE QD 4.070 . 4.880 2.802 2.566 2.986 . 0 0 "[ . 1 . 2]" 1
776 1 41 PHE HA 1 41 PHE QE 5.660 . 6.790 4.657 4.516 4.754 . 0 0 "[ . 1 . 2]" 1
777 1 41 PHE HA 1 42 PHE H 3.260 . 3.910 2.259 2.142 2.437 . 0 0 "[ . 1 . 2]" 1
778 1 41 PHE HA 1 42 PHE QD 4.040 . 4.850 3.718 3.417 4.027 . 0 0 "[ . 1 . 2]" 1
779 1 41 PHE HA 1 56 ALA H 5.600 . 6.720 5.289 4.820 6.110 . 0 0 "[ . 1 . 2]" 1
780 1 41 PHE HA 1 56 ALA HA 3.900 . 4.680 3.027 2.384 3.886 . 0 0 "[ . 1 . 2]" 1
781 1 41 PHE HA 1 56 ALA MB 3.520 . 4.220 2.410 1.888 2.965 . 0 0 "[ . 1 . 2]" 1
782 1 41 PHE HA 1 57 TYR H 4.370 . 5.240 3.860 2.971 5.225 . 0 0 "[ . 1 . 2]" 1
783 1 41 PHE HB2 1 41 PHE QE 4.770 . 5.720 4.400 4.388 4.419 . 0 0 "[ . 1 . 2]" 1
784 1 41 PHE HB2 1 42 PHE H 4.620 . 5.540 3.998 3.430 4.301 . 0 0 "[ . 1 . 2]" 1
785 1 41 PHE HB2 1 56 ALA MB 4.260 . 5.110 4.385 3.875 4.946 . 0 0 "[ . 1 . 2]" 1
786 1 41 PHE HB3 1 42 PHE H 4.360 . 5.230 3.061 2.496 3.498 . 0 0 "[ . 1 . 2]" 1
787 1 41 PHE HB3 1 56 ALA HA 5.310 . 6.370 5.112 4.391 5.744 . 0 0 "[ . 1 . 2]" 1
788 1 41 PHE HB3 1 56 ALA MB 4.490 . 5.390 3.264 2.623 3.880 . 0 0 "[ . 1 . 2]" 1
789 1 41 PHE QD 1 42 PHE H 4.940 . 5.930 4.113 3.733 4.330 . 0 0 "[ . 1 . 2]" 1
790 1 41 PHE QD 1 56 ALA H 5.530 . 6.640 5.441 4.967 6.053 . 0 0 "[ . 1 . 2]" 1
791 1 41 PHE QD 1 56 ALA HA 4.470 . 5.360 4.209 3.679 4.607 . 0 0 "[ . 1 . 2]" 1
792 1 41 PHE QD 1 56 ALA MB 3.070 . 3.680 1.996 1.776 2.379 0.024 8 0 "[ . 1 . 2]" 1
793 1 41 PHE QD 1 57 TYR H 4.460 . 5.350 4.209 3.422 5.315 . 0 0 "[ . 1 . 2]" 1
794 1 41 PHE QD 1 58 ILE QG 5.540 . 6.650 4.821 4.349 5.257 . 0 0 "[ . 1 . 2]" 1
795 1 41 PHE QE 1 56 ALA MB 3.700 . 4.440 3.137 2.715 3.616 . 0 0 "[ . 1 . 2]" 1
796 1 41 PHE QE 1 58 ILE HA 5.930 . 7.120 4.525 3.823 5.284 . 0 0 "[ . 1 . 2]" 1
797 1 41 PHE QE 1 58 ILE MD 4.180 . 5.020 3.928 3.252 4.766 . 0 0 "[ . 1 . 2]" 1
798 1 41 PHE QE 1 58 ILE QG 4.940 . 5.540 3.094 2.620 3.590 . 0 0 "[ . 1 . 2]" 1
799 1 41 PHE QE 1 58 ILE MG 4.570 . 5.480 4.595 4.314 5.093 . 0 0 "[ . 1 . 2]" 1
800 1 42 PHE H 1 42 PHE HB3 4.030 . 4.840 2.610 2.484 2.850 . 0 0 "[ . 1 . 2]" 1
801 1 42 PHE H 1 42 PHE QD 4.210 . 5.050 2.140 1.820 2.372 . 0 0 "[ . 1 . 2]" 1
802 1 42 PHE H 1 43 ALA H 4.660 . 5.590 4.615 4.553 4.664 . 0 0 "[ . 1 . 2]" 1
803 1 42 PHE H 1 55 ARG H 5.080 . 6.100 5.449 4.460 6.144 0.044 14 0 "[ . 1 . 2]" 1
804 1 42 PHE H 1 56 ALA MB 3.620 . 4.340 2.784 1.984 3.418 . 0 0 "[ . 1 . 2]" 1
805 1 42 PHE HA 1 43 ALA H 3.120 . 3.740 2.300 2.150 2.506 . 0 0 "[ . 1 . 2]" 1
806 1 42 PHE HA 1 43 ALA MB 4.010 . 4.810 3.937 3.815 4.022 . 0 0 "[ . 1 . 2]" 1
807 1 42 PHE HA 1 56 ALA MB 5.390 . 6.470 5.229 4.473 5.725 . 0 0 "[ . 1 . 2]" 1
808 1 42 PHE HB2 1 43 ALA H 4.860 . 5.830 2.722 2.243 3.308 . 0 0 "[ . 1 . 2]" 1
809 1 42 PHE HB2 1 54 SER HA 5.750 . 6.900 4.928 4.009 5.928 . 0 0 "[ . 1 . 2]" 1
810 1 42 PHE HB3 1 54 SER HA 6.080 . 7.300 4.570 3.651 5.552 . 0 0 "[ . 1 . 2]" 1
811 1 42 PHE HB3 1 55 ARG H 5.810 . 6.970 3.638 2.859 4.506 . 0 0 "[ . 1 . 2]" 1
812 1 42 PHE HB3 1 55 ARG HA 5.240 . 6.290 4.583 3.351 5.859 . 0 0 "[ . 1 . 2]" 1
813 1 42 PHE HB3 1 56 ALA H 5.830 . 7.000 5.392 4.268 6.343 . 0 0 "[ . 1 . 2]" 1
814 1 42 PHE HB3 1 56 ALA MB 4.670 . 5.600 4.344 3.580 4.892 . 0 0 "[ . 1 . 2]" 1
815 1 42 PHE QD 1 43 ALA H 4.180 . 5.020 3.585 2.818 4.274 . 0 0 "[ . 1 . 2]" 1
816 1 42 PHE QD 1 43 ALA HA 4.330 . 5.200 3.922 3.060 4.721 . 0 0 "[ . 1 . 2]" 1
817 1 42 PHE QD 1 44 ALA H 4.700 . 5.640 3.290 2.261 4.372 . 0 0 "[ . 1 . 2]" 1
818 1 42 PHE QD 1 55 ARG H 4.310 . 5.170 4.005 3.157 4.703 . 0 0 "[ . 1 . 2]" 1
819 1 42 PHE QD 1 55 ARG HA 4.670 . 5.600 3.290 2.628 4.370 . 0 0 "[ . 1 . 2]" 1
820 1 42 PHE QD 1 55 ARG HB2 6.500 . 7.800 5.242 4.448 5.993 . 0 0 "[ . 1 . 2]" 1
821 1 42 PHE QD 1 55 ARG HB3 6.500 . 7.800 5.301 4.690 5.769 . 0 0 "[ . 1 . 2]" 1
822 1 42 PHE QD 1 56 ALA H 4.730 . 5.680 3.533 2.411 4.608 . 0 0 "[ . 1 . 2]" 1
823 1 42 PHE QD 1 56 ALA HA 4.380 . 5.260 3.510 3.052 4.504 . 0 0 "[ . 1 . 2]" 1
824 1 42 PHE QD 1 56 ALA MB 3.570 . 4.280 2.492 2.006 3.203 . 0 0 "[ . 1 . 2]" 1
825 1 43 ALA H 1 43 ALA MB 2.980 . 3.580 2.464 2.270 2.734 . 0 0 "[ . 1 . 2]" 1
826 1 43 ALA H 1 44 ALA H 4.590 . 5.510 4.049 2.883 4.484 . 0 0 "[ . 1 . 2]" 1
827 1 43 ALA HA 1 44 ALA H 3.320 . 3.980 2.243 2.152 2.850 . 0 0 "[ . 1 . 2]" 1
828 1 43 ALA MB 1 44 ALA H 3.310 . 3.970 3.403 2.680 3.692 . 0 0 "[ . 1 . 2]" 1
829 1 46 LEU HA 1 46 LEU HG 4.050 . 4.860 3.734 3.566 3.834 . 0 0 "[ . 1 . 2]" 1
830 1 46 LEU HB2 1 82 LYS HB2 4.810 . 5.770 4.642 2.819 5.607 . 0 0 "[ . 1 . 2]" 1
831 1 46 LEU HB2 1 84 LEU QD 3.260 . 3.910 2.580 2.127 3.922 0.012 17 0 "[ . 1 . 2]" 1
832 1 46 LEU QD 1 82 LYS HB2 3.260 . 3.910 3.058 2.297 3.910 . 0 0 "[ . 1 . 2]" 1
833 1 46 LEU QD 1 82 LYS QE 3.860 . 4.630 2.910 2.065 4.386 . 0 0 "[ . 1 . 2]" 1
834 1 46 LEU QD 1 82 LYS HG2 4.270 . 5.120 2.562 1.975 3.122 . 0 0 "[ . 1 . 2]" 1
835 1 46 LEU QD 1 82 LYS HG3 3.190 . 3.830 2.209 1.773 3.350 0.027 2 0 "[ . 1 . 2]" 1
836 1 53 TYR HA 1 54 SER H 3.560 . 4.270 2.227 2.142 2.473 . 0 0 "[ . 1 . 2]" 1
837 1 53 TYR QB 1 54 SER H 3.480 . 4.180 3.373 2.354 4.002 . 0 0 "[ . 1 . 2]" 1
838 1 53 TYR QB 1 54 SER HA 4.350 . 5.220 4.330 3.913 4.863 . 0 0 "[ . 1 . 2]" 1
839 1 53 TYR HB2 1 54 SER H 4.100 . 4.920 3.936 2.379 4.595 . 0 0 "[ . 1 . 2]" 1
840 1 53 TYR HB3 1 54 SER H 4.100 . 4.920 3.903 2.861 4.516 . 0 0 "[ . 1 . 2]" 1
841 1 55 ARG H 1 55 ARG HD2 6.500 . 7.800 4.154 1.799 5.983 0.001 4 0 "[ . 1 . 2]" 1
842 1 55 ARG H 1 55 ARG QD 5.710 . 6.850 3.443 1.779 4.912 0.021 7 0 "[ . 1 . 2]" 1
843 1 55 ARG H 1 55 ARG HD3 6.500 . 7.800 4.066 1.786 6.180 0.014 7 0 "[ . 1 . 2]" 1
844 1 55 ARG H 1 56 ALA H 6.500 . 7.800 4.450 4.314 4.533 . 0 0 "[ . 1 . 2]" 1
845 1 55 ARG H 1 56 ALA MB 4.850 . 5.820 5.186 4.746 5.605 . 0 0 "[ . 1 . 2]" 1
846 1 55 ARG HA 1 56 ALA H 3.500 . 4.200 2.425 2.204 2.666 . 0 0 "[ . 1 . 2]" 1
847 1 55 ARG HA 1 56 ALA MB 3.940 . 4.730 3.932 3.857 4.060 . 0 0 "[ . 1 . 2]" 1
848 1 55 ARG QB 1 56 ALA H 4.260 . 5.110 2.535 2.013 3.679 . 0 0 "[ . 1 . 2]" 1
849 1 55 ARG QB 1 57 TYR QD 4.880 . 5.860 4.986 3.842 5.442 . 0 0 "[ . 1 . 2]" 1
850 1 55 ARG QD 1 56 ALA H 4.610 . 5.530 4.335 2.325 5.346 . 0 0 "[ . 1 . 2]" 1
851 1 55 ARG HD2 1 56 ALA H 5.370 . 6.440 4.926 3.493 5.897 . 0 0 "[ . 1 . 2]" 1
852 1 55 ARG HD3 1 56 ALA H 5.370 . 6.440 4.984 2.361 6.139 . 0 0 "[ . 1 . 2]" 1
853 1 56 ALA H 1 57 TYR H 4.620 . 5.540 4.504 4.415 4.594 . 0 0 "[ . 1 . 2]" 1
854 1 56 ALA H 1 57 TYR QD 4.540 . 5.450 5.027 4.657 5.269 . 0 0 "[ . 1 . 2]" 1
855 1 56 ALA H 1 57 TYR QE 5.440 . 6.530 5.315 4.832 5.647 . 0 0 "[ . 1 . 2]" 1
856 1 56 ALA HA 1 57 TYR H 3.330 . 4.000 2.370 2.172 2.553 . 0 0 "[ . 1 . 2]" 1
857 1 56 ALA HA 1 57 TYR HB2 4.540 . 5.450 4.538 4.402 4.654 . 0 0 "[ . 1 . 2]" 1
858 1 56 ALA HA 1 57 TYR QD 4.190 . 5.030 3.242 2.662 3.789 . 0 0 "[ . 1 . 2]" 1
859 1 56 ALA MB 1 57 TYR H 3.330 . 4.000 2.540 2.229 3.273 . 0 0 "[ . 1 . 2]" 1
860 1 56 ALA MB 1 57 TYR HA 4.700 . 5.640 4.079 3.926 4.352 . 0 0 "[ . 1 . 2]" 1
861 1 56 ALA MB 1 57 TYR QD 4.680 . 5.620 4.413 3.974 4.743 . 0 0 "[ . 1 . 2]" 1
862 1 56 ALA MB 1 58 ILE MD 4.710 . 5.650 4.587 3.850 5.332 . 0 0 "[ . 1 . 2]" 1
863 1 57 TYR H 1 57 TYR QD 3.620 . 4.340 2.845 2.256 3.518 . 0 0 "[ . 1 . 2]" 1
864 1 57 TYR HA 1 57 TYR QE 5.530 . 6.640 4.688 4.515 4.821 . 0 0 "[ . 1 . 2]" 1
865 1 57 TYR HB2 1 58 ILE H 4.530 . 5.440 3.865 3.244 4.447 . 0 0 "[ . 1 . 2]" 1
866 1 57 TYR HB3 1 57 TYR QE 4.670 . 5.600 4.421 4.392 4.453 . 0 0 "[ . 1 . 2]" 1
867 1 57 TYR HB3 1 58 ILE H 4.120 . 4.940 2.770 2.045 3.819 . 0 0 "[ . 1 . 2]" 1
868 1 57 TYR HB3 1 58 ILE HA 4.200 . 5.040 4.553 4.376 5.143 0.103 10 0 "[ . 1 . 2]" 1
869 1 57 TYR HB3 1 58 ILE QG 6.160 . 7.390 4.855 4.513 5.472 . 0 0 "[ . 1 . 2]" 1
870 1 57 TYR QD 1 58 ILE H 4.630 . 5.560 3.942 3.310 4.744 . 0 0 "[ . 1 . 2]" 1
871 1 57 TYR QD 1 93 ALA MB 5.160 . 6.190 4.590 3.269 5.272 . 0 0 "[ . 1 . 2]" 1
872 1 57 TYR QE 1 93 ALA MB 4.700 . 5.640 4.965 3.624 5.614 . 0 0 "[ . 1 . 2]" 1
873 1 58 ILE H 1 58 ILE QG 4.880 . 5.860 2.715 2.182 2.947 . 0 0 "[ . 1 . 2]" 1
874 1 58 ILE H 1 58 ILE MG 4.170 . 5.000 3.906 3.805 3.953 . 0 0 "[ . 1 . 2]" 1
875 1 58 ILE H 1 59 ASN H 4.500 . 5.400 4.408 4.182 4.516 . 0 0 "[ . 1 . 2]" 1
876 1 58 ILE H 1 59 ASN HA 4.820 . 5.780 4.881 4.677 5.444 . 0 0 "[ . 1 . 2]" 1
877 1 58 ILE HA 1 58 ILE MD 3.980 . 4.780 3.881 3.846 3.920 . 0 0 "[ . 1 . 2]" 1
878 1 58 ILE HA 1 58 ILE MG 3.370 . 4.040 2.377 2.336 2.416 . 0 0 "[ . 1 . 2]" 1
879 1 58 ILE HA 1 59 ASN HA 4.880 . 5.860 4.448 4.402 4.500 . 0 0 "[ . 1 . 2]" 1
880 1 58 ILE HB 1 59 ASN H 4.590 . 5.510 3.990 3.701 4.320 . 0 0 "[ . 1 . 2]" 1
881 1 58 ILE HB 1 60 PHE QE 5.010 . 6.010 3.055 2.409 3.862 . 0 0 "[ . 1 . 2]" 1
882 1 58 ILE MD 1 59 ASN H 4.950 . 5.940 5.006 4.735 5.353 . 0 0 "[ . 1 . 2]" 1
883 1 58 ILE MD 1 60 PHE QE 4.300 . 5.160 3.327 2.742 3.994 . 0 0 "[ . 1 . 2]" 1
884 1 58 ILE QG 1 59 ASN H 5.200 . 6.240 4.194 4.061 4.351 . 0 0 "[ . 1 . 2]" 1
885 1 58 ILE MG 1 59 ASN H 3.590 . 4.310 2.425 2.006 3.008 . 0 0 "[ . 1 . 2]" 1
886 1 58 ILE MG 1 59 ASN HA 3.940 . 4.730 3.712 3.345 4.151 . 0 0 "[ . 1 . 2]" 1
887 1 58 ILE MG 1 60 PHE H 4.470 . 5.360 3.850 3.139 4.551 . 0 0 "[ . 1 . 2]" 1
888 1 58 ILE MG 1 60 PHE QD 3.860 . 4.630 2.983 2.575 3.288 . 0 0 "[ . 1 . 2]" 1
889 1 58 ILE MG 1 60 PHE QE 4.050 . 4.860 2.626 2.364 3.117 . 0 0 "[ . 1 . 2]" 1
890 1 59 ASN H 1 60 PHE H 4.750 . 5.700 4.197 3.756 4.549 . 0 0 "[ . 1 . 2]" 1
891 1 59 ASN HA 1 59 ASN HD22 5.280 . 6.340 4.666 4.217 5.148 . 0 0 "[ . 1 . 2]" 1
892 1 59 ASN HA 1 60 PHE HA 5.240 . 6.290 4.454 4.366 4.534 . 0 0 "[ . 1 . 2]" 1
893 1 59 ASN HA 1 60 PHE HB2 5.110 . 6.130 4.393 4.221 4.527 . 0 0 "[ . 1 . 2]" 1
894 1 59 ASN HA 1 60 PHE QD 4.780 . 5.740 3.723 2.908 4.433 . 0 0 "[ . 1 . 2]" 1
895 1 59 ASN QB 1 60 PHE H 4.330 . 5.200 3.802 3.221 4.044 . 0 0 "[ . 1 . 2]" 1
896 1 59 ASN HB2 1 60 PHE H 5.210 . 6.250 4.279 3.326 4.598 . 0 0 "[ . 1 . 2]" 1
897 1 59 ASN HB3 1 60 PHE H 5.210 . 6.250 4.286 3.848 4.507 . 0 0 "[ . 1 . 2]" 1
898 1 60 PHE H 1 60 PHE HB2 4.020 . 4.820 2.351 2.237 2.500 . 0 0 "[ . 1 . 2]" 1
899 1 60 PHE H 1 60 PHE QD 4.360 . 5.230 2.574 1.941 3.307 . 0 0 "[ . 1 . 2]" 1
900 1 60 PHE HA 1 60 PHE QD 4.000 . 4.800 3.039 2.796 3.134 . 0 0 "[ . 1 . 2]" 1
901 1 60 PHE HA 1 61 ARG HB2 4.880 . 5.860 4.534 4.030 4.759 . 0 0 "[ . 1 . 2]" 1
902 1 60 PHE HB2 1 66 ILE HG12 6.500 . 7.800 3.006 2.215 3.889 . 0 0 "[ . 1 . 2]" 1
903 1 60 PHE HB3 1 61 ARG H 4.660 . 5.590 2.889 2.226 3.899 . 0 0 "[ . 1 . 2]" 1
904 1 60 PHE HB3 1 62 ASN H 3.860 . 4.630 2.943 2.376 4.007 . 0 0 "[ . 1 . 2]" 1
905 1 60 PHE HB3 1 66 ILE H 5.880 . 7.060 4.402 3.636 5.162 . 0 0 "[ . 1 . 2]" 1
906 1 60 PHE HB3 1 66 ILE HG12 6.500 . 7.800 2.870 2.225 3.917 . 0 0 "[ . 1 . 2]" 1
907 1 60 PHE HB3 1 66 ILE HG13 5.090 . 6.110 3.048 2.649 3.741 . 0 0 "[ . 1 . 2]" 1
908 1 60 PHE QD 1 61 ARG H 4.790 . 5.750 3.682 2.926 4.657 . 0 0 "[ . 1 . 2]" 1
909 1 60 PHE QD 1 62 ASN H 4.570 . 5.480 3.742 3.338 4.132 . 0 0 "[ . 1 . 2]" 1
910 1 60 PHE QD 1 65 ASP HB2 5.060 . 6.070 3.469 1.947 4.406 . 0 0 "[ . 1 . 2]" 1
911 1 60 PHE QD 1 65 ASP QB 4.180 . 5.020 2.548 1.770 3.744 0.030 20 0 "[ . 1 . 2]" 1
912 1 60 PHE QD 1 65 ASP HB3 5.060 . 6.070 2.967 1.847 4.923 . 0 0 "[ . 1 . 2]" 1
913 1 60 PHE QD 1 66 ILE MD 4.130 . 4.960 3.940 3.715 4.371 . 0 0 "[ . 1 . 2]" 1
914 1 60 PHE QD 1 66 ILE HG12 5.190 . 6.230 2.975 2.526 3.382 . 0 0 "[ . 1 . 2]" 1
915 1 60 PHE QD 1 66 ILE HG13 3.990 . 4.790 3.143 2.721 3.758 . 0 0 "[ . 1 . 2]" 1
916 1 60 PHE QD 1 66 ILE MG 4.440 . 5.330 4.138 3.670 4.618 . 0 0 "[ . 1 . 2]" 1
917 1 60 PHE QE 1 62 ASN HB2 6.500 . 7.800 7.669 7.609 7.734 . 0 0 "[ . 1 . 2]" 1
918 1 60 PHE QE 1 62 ASN HB3 5.700 . 6.840 6.254 6.061 6.513 . 0 0 "[ . 1 . 2]" 1
919 1 60 PHE QE 1 62 ASN HD21 6.370 . 7.640 7.171 6.310 7.611 . 0 0 "[ . 1 . 2]" 1
920 1 60 PHE QE 1 65 ASP QB 4.710 . 5.650 3.352 2.149 4.201 . 0 0 "[ . 1 . 2]" 1
921 1 60 PHE QE 1 66 ILE HA 4.830 . 5.800 2.725 2.124 3.958 . 0 0 "[ . 1 . 2]" 1
922 1 60 PHE QE 1 66 ILE HG12 4.760 . 5.710 3.975 3.332 4.800 . 0 0 "[ . 1 . 2]" 1
923 1 60 PHE QE 1 69 PHE H 5.060 . 6.070 3.808 3.364 4.522 . 0 0 "[ . 1 . 2]" 1
924 1 60 PHE QE 1 69 PHE HB2 4.680 . 5.620 2.686 1.973 3.716 . 0 0 "[ . 1 . 2]" 1
925 1 60 PHE QE 1 69 PHE HB3 5.170 . 6.200 3.969 3.169 4.961 . 0 0 "[ . 1 . 2]" 1
926 1 60 PHE QE 1 90 VAL QG 4.080 . 4.900 3.405 2.454 4.299 . 0 0 "[ . 1 . 2]" 1
927 1 61 ARG H 1 61 ARG HB2 3.920 . 4.700 2.606 2.385 2.906 . 0 0 "[ . 1 . 2]" 1
928 1 61 ARG H 1 61 ARG HB3 4.100 . 4.920 3.701 3.070 3.905 . 0 0 "[ . 1 . 2]" 1
929 1 61 ARG H 1 61 ARG QG 4.220 . 5.060 2.879 2.164 4.296 . 0 0 "[ . 1 . 2]" 1
930 1 61 ARG H 1 62 ASN H 3.990 . 4.790 2.235 1.905 2.767 . 0 0 "[ . 1 . 2]" 1
931 1 61 ARG H 1 62 ASN HA 5.130 . 6.160 4.868 4.675 5.384 . 0 0 "[ . 1 . 2]" 1
932 1 61 ARG H 1 62 ASN HB2 5.090 . 6.110 4.574 4.036 5.049 . 0 0 "[ . 1 . 2]" 1
933 1 61 ARG HA 1 61 ARG HD2 4.060 . 4.870 3.218 2.059 4.676 . 0 0 "[ . 1 . 2]" 1
934 1 61 ARG HA 1 61 ARG QD 3.410 . 4.090 2.660 2.027 4.016 . 0 0 "[ . 1 . 2]" 1
935 1 61 ARG HA 1 61 ARG HD3 4.060 . 4.870 3.281 2.060 4.786 . 0 0 "[ . 1 . 2]" 1
936 1 61 ARG HA 1 61 ARG QG 3.650 . 4.380 2.822 2.389 3.116 . 0 0 "[ . 1 . 2]" 1
937 1 61 ARG HA 1 62 ASN HA 4.580 . 5.500 4.535 4.392 4.626 . 0 0 "[ . 1 . 2]" 1
938 1 61 ARG HB2 1 61 ARG QD 3.650 . 4.380 3.266 2.401 3.532 . 0 0 "[ . 1 . 2]" 1
939 1 61 ARG HB2 1 62 ASN H 3.860 . 4.630 3.328 2.337 4.444 . 0 0 "[ . 1 . 2]" 1
940 1 61 ARG HB2 1 62 ASN HB3 5.600 . 6.720 4.672 3.950 5.993 . 0 0 "[ . 1 . 2]" 1
941 1 61 ARG HB3 1 62 ASN H 4.200 . 5.040 4.043 3.311 4.449 . 0 0 "[ . 1 . 2]" 1
942 1 61 ARG HB3 1 62 ASN HB2 4.580 . 5.500 4.348 3.581 4.829 . 0 0 "[ . 1 . 2]" 1
943 1 61 ARG HB3 1 62 ASN HB3 6.010 . 7.210 5.471 4.800 5.870 . 0 0 "[ . 1 . 2]" 1
944 1 61 ARG QG 1 62 ASN H 4.990 . 5.990 4.354 3.953 4.626 . 0 0 "[ . 1 . 2]" 1
945 1 62 ASN H 1 62 ASN HB2 3.730 . 4.480 3.110 2.673 3.465 . 0 0 "[ . 1 . 2]" 1
946 1 62 ASN H 1 62 ASN HB3 3.610 . 4.330 2.821 2.519 3.141 . 0 0 "[ . 1 . 2]" 1
947 1 62 ASN H 1 62 ASN HD21 5.190 . 6.230 4.910 4.530 5.358 . 0 0 "[ . 1 . 2]" 1
948 1 62 ASN H 1 63 PRO HA 5.480 . 6.580 5.002 4.575 5.527 . 0 0 "[ . 1 . 2]" 1
949 1 62 ASN H 1 63 PRO HD2 5.060 . 6.070 4.772 4.468 5.163 . 0 0 "[ . 1 . 2]" 1
950 1 62 ASN H 1 63 PRO HD3 5.770 . 6.920 4.679 4.255 5.093 . 0 0 "[ . 1 . 2]" 1
951 1 62 ASN H 1 65 ASP QB 4.610 . 5.530 3.415 2.481 5.175 . 0 0 "[ . 1 . 2]" 1
952 1 62 ASN H 1 66 ILE HG13 5.420 . 6.500 4.184 3.341 5.573 . 0 0 "[ . 1 . 2]" 1
953 1 62 ASN HA 1 62 ASN HD21 4.530 . 5.440 4.319 3.935 4.538 . 0 0 "[ . 1 . 2]" 1
954 1 62 ASN HA 1 62 ASN HD22 4.900 . 5.880 4.589 4.337 4.840 . 0 0 "[ . 1 . 2]" 1
955 1 62 ASN HA 1 63 PRO HD2 3.470 . 4.160 2.106 1.931 2.526 . 0 0 "[ . 1 . 2]" 1
956 1 62 ASN HA 1 63 PRO HD3 3.370 . 4.040 2.478 1.982 2.656 . 0 0 "[ . 1 . 2]" 1
957 1 62 ASN HA 1 63 PRO HG3 4.430 . 5.320 4.436 4.188 4.543 . 0 0 "[ . 1 . 2]" 1
958 1 62 ASN HA 1 64 ASP H 4.340 . 5.210 4.091 3.637 4.508 . 0 0 "[ . 1 . 2]" 1
959 1 62 ASN HA 1 66 ILE HG13 5.720 . 6.860 5.265 4.761 6.092 . 0 0 "[ . 1 . 2]" 1
960 1 62 ASN HB2 1 62 ASN HD22 4.080 . 4.900 3.849 3.726 4.029 . 0 0 "[ . 1 . 2]" 1
961 1 62 ASN HB2 1 63 PRO HD2 4.090 . 4.910 3.973 3.800 4.322 . 0 0 "[ . 1 . 2]" 1
962 1 62 ASN HB2 1 63 PRO HD3 5.060 . 6.070 4.915 4.414 5.112 . 0 0 "[ . 1 . 2]" 1
963 1 62 ASN HB2 1 64 ASP H 5.280 . 6.340 4.863 4.282 5.256 . 0 0 "[ . 1 . 2]" 1
964 1 62 ASN HB2 1 65 ASP H 4.490 . 5.390 4.337 3.952 5.229 . 0 0 "[ . 1 . 2]" 1
965 1 62 ASN HB2 1 65 ASP QB 4.300 . 5.160 3.866 3.101 5.202 0.042 7 0 "[ . 1 . 2]" 1
966 1 62 ASN HB3 1 62 ASN HD21 3.380 . 4.060 2.211 2.176 2.265 . 0 0 "[ . 1 . 2]" 1
967 1 62 ASN HB3 1 62 ASN HD22 3.510 . 4.210 3.472 3.458 3.501 . 0 0 "[ . 1 . 2]" 1
968 1 62 ASN HB3 1 63 PRO HA 5.660 . 6.790 5.378 5.099 5.522 . 0 0 "[ . 1 . 2]" 1
969 1 62 ASN HB3 1 63 PRO HD2 4.500 . 5.400 4.192 3.889 4.431 . 0 0 "[ . 1 . 2]" 1
970 1 62 ASN HB3 1 63 PRO HD3 5.960 . 7.150 5.086 4.685 5.260 . 0 0 "[ . 1 . 2]" 1
971 1 62 ASN HB3 1 63 PRO HG2 6.500 . 7.800 5.729 5.236 6.500 . 0 0 "[ . 1 . 2]" 1
972 1 62 ASN HB3 1 64 ASP H 4.460 . 5.350 3.989 3.098 4.520 . 0 0 "[ . 1 . 2]" 1
973 1 62 ASN HB3 1 65 ASP H 4.170 . 5.000 2.752 2.277 3.636 . 0 0 "[ . 1 . 2]" 1
974 1 62 ASN HB3 1 65 ASP QB 4.380 . 5.260 2.415 1.756 3.623 0.044 19 0 "[ . 1 . 2]" 1
975 1 62 ASN HD21 1 64 ASP H 4.160 . 4.990 3.450 2.297 4.481 . 0 0 "[ . 1 . 2]" 1
976 1 62 ASN HD21 1 64 ASP QB 3.750 . 4.500 2.536 2.041 3.589 . 0 0 "[ . 1 . 2]" 1
977 1 62 ASN HD21 1 65 ASP HA 4.470 . 5.360 4.173 3.738 4.607 . 0 0 "[ . 1 . 2]" 1
978 1 62 ASN HD21 1 65 ASP HB2 4.070 . 4.880 3.205 1.918 4.915 0.035 8 0 "[ . 1 . 2]" 1
979 1 62 ASN HD21 1 65 ASP HB3 4.070 . 4.880 4.068 2.740 4.945 0.065 20 0 "[ . 1 . 2]" 1
980 1 62 ASN HD22 1 64 ASP H 4.060 . 4.870 3.085 2.402 3.744 . 0 0 "[ . 1 . 2]" 1
981 1 62 ASN HD22 1 64 ASP HA 4.690 . 5.630 4.735 4.282 5.344 . 0 0 "[ . 1 . 2]" 1
982 1 62 ASN HD22 1 64 ASP HB2 4.340 . 5.210 2.222 1.861 3.457 . 0 0 "[ . 1 . 2]" 1
983 1 62 ASN HD22 1 64 ASP QB 3.500 . 4.200 2.000 1.755 2.545 0.045 4 0 "[ . 1 . 2]" 1
984 1 62 ASN HD22 1 64 ASP HB3 4.340 . 5.210 3.362 1.760 4.252 0.040 4 0 "[ . 1 . 2]" 1
985 1 62 ASN HD22 1 65 ASP H 4.220 . 5.060 3.404 3.054 3.718 . 0 0 "[ . 1 . 2]" 1
986 1 62 ASN HD22 1 65 ASP QB 5.020 . 6.020 4.402 3.294 5.210 . 0 0 "[ . 1 . 2]" 1
987 1 63 PRO HA 1 65 ASP H 4.180 . 5.020 4.425 3.893 4.807 . 0 0 "[ . 1 . 2]" 1
988 1 63 PRO HA 1 66 ILE H 4.270 . 5.120 3.555 3.230 4.177 . 0 0 "[ . 1 . 2]" 1
989 1 63 PRO HA 1 66 ILE HB 4.590 . 5.510 3.224 2.525 3.838 . 0 0 "[ . 1 . 2]" 1
990 1 63 PRO HA 1 66 ILE MD 3.700 . 4.440 2.072 1.868 2.403 . 0 0 "[ . 1 . 2]" 1
991 1 63 PRO HA 1 66 ILE HG12 5.560 . 6.670 4.154 3.643 4.664 . 0 0 "[ . 1 . 2]" 1
992 1 63 PRO HA 1 66 ILE HG13 4.370 . 5.240 2.716 2.215 3.332 . 0 0 "[ . 1 . 2]" 1
993 1 63 PRO QB 1 65 ASP H 5.540 . 6.650 4.990 4.440 5.528 . 0 0 "[ . 1 . 2]" 1
994 1 63 PRO HD2 1 64 ASP H 4.080 . 4.900 3.046 2.734 3.228 . 0 0 "[ . 1 . 2]" 1
995 1 63 PRO HD2 1 64 ASP QB 4.050 . 4.860 4.694 4.099 4.898 0.038 13 0 "[ . 1 . 2]" 1
996 1 63 PRO HD2 1 65 ASP H 4.730 . 5.680 4.745 4.443 5.079 . 0 0 "[ . 1 . 2]" 1
997 1 63 PRO HD2 1 66 ILE MD 5.510 . 6.610 5.330 4.884 5.834 . 0 0 "[ . 1 . 2]" 1
998 1 63 PRO HD3 1 64 ASP H 4.230 . 5.080 4.100 3.922 4.286 . 0 0 "[ . 1 . 2]" 1
999 1 63 PRO HD3 1 65 ASP H 5.450 . 6.540 5.635 5.143 5.997 . 0 0 "[ . 1 . 2]" 1
1000 1 63 PRO HG2 1 64 ASP H 3.270 . 3.920 2.658 2.225 3.942 0.022 11 0 "[ . 1 . 2]" 1
1001 1 63 PRO HG2 1 65 ASP H 5.040 . 6.050 5.170 4.650 6.111 0.061 5 0 "[ . 1 . 2]" 1
1002 1 63 PRO HG2 1 66 ILE MD 5.200 . 6.240 5.355 5.027 5.559 . 0 0 "[ . 1 . 2]" 1
1003 1 63 PRO HG3 1 64 ASP H 4.200 . 5.040 4.095 3.824 4.546 . 0 0 "[ . 1 . 2]" 1
1004 1 63 PRO HG3 1 64 ASP QB 5.610 . 6.730 5.913 5.199 6.679 . 0 0 "[ . 1 . 2]" 1
1005 1 64 ASP H 1 64 ASP HB2 3.510 . 4.210 2.572 2.448 2.702 . 0 0 "[ . 1 . 2]" 1
1006 1 64 ASP H 1 64 ASP QB 3.000 . 3.600 2.471 2.234 2.613 . 0 0 "[ . 1 . 2]" 1
1007 1 64 ASP H 1 64 ASP HB3 3.510 . 4.210 3.429 2.381 3.668 . 0 0 "[ . 1 . 2]" 1
1008 1 64 ASP H 1 65 ASP H 3.320 . 3.980 2.663 2.281 2.941 . 0 0 "[ . 1 . 2]" 1
1009 1 64 ASP H 1 66 ILE H 4.190 . 5.030 4.085 3.683 4.318 . 0 0 "[ . 1 . 2]" 1
1010 1 64 ASP H 1 66 ILE MD 5.060 . 6.070 5.046 4.590 5.240 . 0 0 "[ . 1 . 2]" 1
1011 1 64 ASP H 1 67 LEU MD2 5.890 . 7.070 4.866 4.303 5.884 . 0 0 "[ . 1 . 2]" 1
1012 1 64 ASP HA 1 66 ILE H 4.200 . 5.040 4.194 3.895 4.432 . 0 0 "[ . 1 . 2]" 1
1013 1 64 ASP HA 1 67 LEU H 4.430 . 5.320 3.797 3.538 4.257 . 0 0 "[ . 1 . 2]" 1
1014 1 64 ASP HA 1 67 LEU HB3 6.140 . 7.370 4.980 4.469 5.757 . 0 0 "[ . 1 . 2]" 1
1015 1 64 ASP HA 1 67 LEU MD1 3.580 . 4.300 2.965 2.383 3.794 . 0 0 "[ . 1 . 2]" 1
1016 1 64 ASP HA 1 67 LEU HG 3.770 . 4.520 2.576 2.133 3.410 . 0 0 "[ . 1 . 2]" 1
1017 1 64 ASP HA 1 68 LEU H 5.080 . 6.100 4.378 3.800 5.512 . 0 0 "[ . 1 . 2]" 1
1018 1 64 ASP QB 1 66 ILE H 6.180 . 7.420 4.665 4.470 4.912 . 0 0 "[ . 1 . 2]" 1
1019 1 64 ASP QB 1 67 LEU MD1 4.530 . 5.440 3.605 3.158 4.721 . 0 0 "[ . 1 . 2]" 1
1020 1 64 ASP QB 1 67 LEU MD2 5.350 . 6.420 4.157 3.628 4.957 . 0 0 "[ . 1 . 2]" 1
1021 1 64 ASP HB2 1 65 ASP H 3.760 . 4.510 2.869 2.264 4.097 . 0 0 "[ . 1 . 2]" 1
1022 1 64 ASP HB3 1 65 ASP H 3.760 . 4.510 3.603 2.777 4.129 . 0 0 "[ . 1 . 2]" 1
1023 1 65 ASP H 1 65 ASP HB2 3.650 . 4.380 2.552 2.179 3.671 . 0 0 "[ . 1 . 2]" 1
1024 1 65 ASP H 1 65 ASP QB 3.200 . 3.840 2.327 2.117 2.673 . 0 0 "[ . 1 . 2]" 1
1025 1 65 ASP H 1 65 ASP HB3 3.650 . 4.380 2.955 2.388 3.625 . 0 0 "[ . 1 . 2]" 1
1026 1 65 ASP H 1 66 ILE H 3.410 . 4.090 2.633 2.354 2.825 . 0 0 "[ . 1 . 2]" 1
1027 1 65 ASP H 1 66 ILE HA 5.010 . 6.010 5.238 5.010 5.414 . 0 0 "[ . 1 . 2]" 1
1028 1 65 ASP H 1 66 ILE HB 5.150 . 6.180 4.874 4.500 5.103 . 0 0 "[ . 1 . 2]" 1
1029 1 65 ASP H 1 66 ILE MD 5.260 . 6.310 5.179 4.901 5.456 . 0 0 "[ . 1 . 2]" 1
1030 1 65 ASP H 1 66 ILE HG13 4.390 . 5.270 4.108 3.776 4.570 . 0 0 "[ . 1 . 2]" 1
1031 1 65 ASP H 1 67 LEU H 5.050 . 6.060 4.720 4.235 5.148 . 0 0 "[ . 1 . 2]" 1
1032 1 65 ASP H 1 67 LEU MD1 5.200 . 6.240 5.109 4.885 5.234 . 0 0 "[ . 1 . 2]" 1
1033 1 65 ASP H 1 68 LEU H 5.000 . 6.000 4.851 4.592 5.197 . 0 0 "[ . 1 . 2]" 1
1034 1 65 ASP H 1 68 LEU HB3 4.850 . 5.820 4.787 4.296 5.183 . 0 0 "[ . 1 . 2]" 1
1035 1 65 ASP H 1 68 LEU MD2 5.640 . 6.770 4.942 4.482 5.453 . 0 0 "[ . 1 . 2]" 1
1036 1 65 ASP HA 1 67 LEU H 5.130 . 6.160 4.851 4.104 5.358 . 0 0 "[ . 1 . 2]" 1
1037 1 65 ASP HA 1 67 LEU MD1 4.370 . 5.240 4.614 3.998 5.061 . 0 0 "[ . 1 . 2]" 1
1038 1 65 ASP HA 1 68 LEU H 3.710 . 4.450 3.545 2.981 4.091 . 0 0 "[ . 1 . 2]" 1
1039 1 65 ASP HA 1 68 LEU HB2 3.700 . 4.440 3.305 2.800 3.841 . 0 0 "[ . 1 . 2]" 1
1040 1 65 ASP HA 1 68 LEU HB3 3.410 . 4.090 2.333 1.765 2.840 0.035 20 0 "[ . 1 . 2]" 1
1041 1 65 ASP HA 1 68 LEU MD1 4.930 . 5.920 4.760 4.364 5.172 . 0 0 "[ . 1 . 2]" 1
1042 1 65 ASP HA 1 68 LEU MD2 5.440 . 6.530 2.749 2.481 3.015 . 0 0 "[ . 1 . 2]" 1
1043 1 65 ASP HA 1 68 LEU HG 3.920 . 4.700 4.336 3.874 4.744 0.044 6 0 "[ . 1 . 2]" 1
1044 1 65 ASP HA 1 69 PHE H 4.170 . 5.000 3.826 2.853 4.445 . 0 0 "[ . 1 . 2]" 1
1045 1 65 ASP HA 1 69 PHE QD 5.280 . 6.340 3.402 2.591 4.192 . 0 0 "[ . 1 . 2]" 1
1046 1 65 ASP QB 1 66 ILE H 3.900 . 4.680 2.823 2.561 3.600 . 0 0 "[ . 1 . 2]" 1
1047 1 65 ASP QB 1 68 LEU MD2 4.430 . 5.320 3.910 3.125 4.533 . 0 0 "[ . 1 . 2]" 1
1048 1 65 ASP QB 1 69 PHE H 6.110 . 7.330 4.773 3.605 5.753 . 0 0 "[ . 1 . 2]" 1
1049 1 65 ASP QB 1 69 PHE QD 5.840 . 7.010 3.775 2.423 5.669 . 0 0 "[ . 1 . 2]" 1
1050 1 65 ASP HB2 1 66 ILE H 4.450 . 5.340 3.541 2.617 3.943 . 0 0 "[ . 1 . 2]" 1
1051 1 65 ASP HB3 1 66 ILE H 4.450 . 5.340 3.267 2.610 4.168 . 0 0 "[ . 1 . 2]" 1
1052 1 66 ILE H 1 66 ILE HB 3.370 . 4.040 2.569 2.470 2.620 . 0 0 "[ . 1 . 2]" 1
1053 1 66 ILE H 1 66 ILE MD 4.290 . 5.150 3.598 3.551 3.672 . 0 0 "[ . 1 . 2]" 1
1054 1 66 ILE H 1 66 ILE HG12 4.010 . 4.810 3.307 3.235 3.466 . 0 0 "[ . 1 . 2]" 1
1055 1 66 ILE H 1 66 ILE HG13 3.510 . 4.210 2.083 2.022 2.224 . 0 0 "[ . 1 . 2]" 1
1056 1 66 ILE H 1 66 ILE MG 3.860 . 4.630 3.785 3.772 3.792 . 0 0 "[ . 1 . 2]" 1
1057 1 66 ILE H 1 67 LEU H 3.540 . 4.250 2.986 2.789 3.151 . 0 0 "[ . 1 . 2]" 1
1058 1 66 ILE H 1 68 LEU H 4.100 . 4.920 3.957 3.811 4.110 . 0 0 "[ . 1 . 2]" 1
1059 1 66 ILE HA 1 66 ILE HG12 3.980 . 4.780 2.527 2.469 2.569 . 0 0 "[ . 1 . 2]" 1
1060 1 66 ILE HB 1 66 ILE MD 3.290 . 3.950 2.452 2.419 2.486 . 0 0 "[ . 1 . 2]" 1
1061 1 66 ILE HB 1 67 LEU H 3.140 . 3.770 2.240 2.003 2.810 . 0 0 "[ . 1 . 2]" 1
1062 1 66 ILE MD 1 66 ILE MG 3.670 . 4.400 1.934 1.914 1.962 . 0 0 "[ . 1 . 2]" 1
1063 1 66 ILE HG12 1 66 ILE MG 3.510 . 4.210 2.424 2.396 2.460 . 0 0 "[ . 1 . 2]" 1
1064 1 66 ILE MG 1 67 LEU H 3.900 . 4.680 3.025 2.733 3.573 . 0 0 "[ . 1 . 2]" 1
1065 1 66 ILE MG 1 67 LEU HA 4.400 . 5.280 3.183 2.924 3.633 . 0 0 "[ . 1 . 2]" 1
1066 1 66 ILE MG 1 68 LEU H 4.740 . 5.690 4.703 4.512 4.948 . 0 0 "[ . 1 . 2]" 1
1067 1 66 ILE MG 1 70 ARG H 4.930 . 5.920 4.289 3.912 4.994 . 0 0 "[ . 1 . 2]" 1
1068 1 66 ILE MG 1 70 ARG QD 4.910 . 5.890 4.372 3.258 5.183 . 0 0 "[ . 1 . 2]" 1
1069 1 66 ILE MG 1 92 PHE QB 4.420 . 5.300 4.226 3.056 5.033 . 0 0 "[ . 1 . 2]" 1
1070 1 67 LEU H 1 67 LEU HB2 3.850 . 4.620 3.617 3.594 3.699 . 0 0 "[ . 1 . 2]" 1
1071 1 67 LEU H 1 67 LEU HB3 3.760 . 4.510 2.732 2.650 3.003 . 0 0 "[ . 1 . 2]" 1
1072 1 67 LEU H 1 67 LEU MD1 3.570 . 4.280 3.310 3.084 3.457 . 0 0 "[ . 1 . 2]" 1
1073 1 67 LEU H 1 67 LEU MD2 3.490 . 4.190 3.320 3.216 3.522 . 0 0 "[ . 1 . 2]" 1
1074 1 67 LEU H 1 67 LEU HG 3.020 . 3.620 1.969 1.847 2.040 . 0 0 "[ . 1 . 2]" 1
1075 1 67 LEU H 1 68 LEU H 3.240 . 3.890 2.628 2.188 2.724 . 0 0 "[ . 1 . 2]" 1
1076 1 67 LEU HA 1 67 LEU HB2 2.960 . 3.550 2.499 2.483 2.529 . 0 0 "[ . 1 . 2]" 1
1077 1 67 LEU HA 1 70 ARG H 4.280 . 5.140 3.823 3.481 4.482 . 0 0 "[ . 1 . 2]" 1
1078 1 67 LEU HA 1 70 ARG HB2 4.690 . 5.630 3.900 2.988 4.859 . 0 0 "[ . 1 . 2]" 1
1079 1 67 LEU HA 1 70 ARG QB 3.820 . 4.580 2.832 2.057 4.008 . 0 0 "[ . 1 . 2]" 1
1080 1 67 LEU HA 1 70 ARG HB3 4.690 . 5.630 2.924 2.075 4.294 . 0 0 "[ . 1 . 2]" 1
1081 1 67 LEU HA 1 71 ASP H 4.180 . 5.020 3.956 3.626 4.424 . 0 0 "[ . 1 . 2]" 1
1082 1 67 LEU HB2 1 67 LEU MD1 2.720 . 3.260 2.292 2.266 2.331 . 0 0 "[ . 1 . 2]" 1
1083 1 67 LEU HB2 1 68 LEU H 4.170 . 5.000 3.929 3.798 4.143 . 0 0 "[ . 1 . 2]" 1
1084 1 67 LEU HB2 1 71 ASP HB2 4.170 . 5.000 4.662 4.093 5.089 0.089 17 0 "[ . 1 . 2]" 1
1085 1 67 LEU HB2 1 71 ASP HB3 6.170 . 7.400 5.721 5.120 6.208 . 0 0 "[ . 1 . 2]" 1
1086 1 67 LEU HB3 1 67 LEU MD1 3.280 . 3.940 3.199 3.184 3.220 . 0 0 "[ . 1 . 2]" 1
1087 1 67 LEU HB3 1 67 LEU MD2 2.830 . 3.400 2.224 2.202 2.253 . 0 0 "[ . 1 . 2]" 1
1088 1 67 LEU HB3 1 68 LEU H 4.330 . 5.200 4.219 4.120 4.387 . 0 0 "[ . 1 . 2]" 1
1089 1 67 LEU MD1 1 68 LEU H 3.000 . 3.600 2.255 2.059 2.613 . 0 0 "[ . 1 . 2]" 1
1090 1 67 LEU MD1 1 68 LEU HA 3.050 . 3.660 2.701 2.555 2.940 . 0 0 "[ . 1 . 2]" 1
1091 1 67 LEU MD1 1 68 LEU HB2 2.940 . 3.530 2.825 2.660 2.990 . 0 0 "[ . 1 . 2]" 1
1092 1 67 LEU MD1 1 68 LEU HB3 3.440 . 4.130 3.671 3.390 3.869 . 0 0 "[ . 1 . 2]" 1
1093 1 67 LEU MD1 1 71 ASP H 5.450 . 6.540 5.210 4.751 5.611 . 0 0 "[ . 1 . 2]" 1
1094 1 67 LEU MD1 1 71 ASP HB3 5.290 . 6.350 5.193 4.623 5.703 . 0 0 "[ . 1 . 2]" 1
1095 1 67 LEU HG 1 68 LEU H 3.220 . 3.860 2.874 2.584 3.330 . 0 0 "[ . 1 . 2]" 1
1096 1 68 LEU H 1 68 LEU HB2 3.430 . 4.120 2.678 2.520 2.823 . 0 0 "[ . 1 . 2]" 1
1097 1 68 LEU H 1 68 LEU HB3 2.950 . 3.540 2.348 2.257 2.429 . 0 0 "[ . 1 . 2]" 1
1098 1 68 LEU H 1 69 PHE H 3.350 . 4.020 2.883 2.667 3.040 . 0 0 "[ . 1 . 2]" 1
1099 1 68 LEU H 1 69 PHE HA 5.390 . 6.470 5.403 5.226 5.509 . 0 0 "[ . 1 . 2]" 1
1100 1 68 LEU H 1 69 PHE HB2 4.820 . 5.780 4.898 4.621 5.086 . 0 0 "[ . 1 . 2]" 1
1101 1 68 LEU H 1 70 ARG H 4.470 . 5.360 4.033 3.836 4.268 . 0 0 "[ . 1 . 2]" 1
1102 1 68 LEU H 1 71 ASP H 4.610 . 5.530 4.883 4.611 5.090 . 0 0 "[ . 1 . 2]" 1
1103 1 68 LEU HA 1 68 LEU MD1 2.710 . 3.250 2.224 2.113 2.303 . 0 0 "[ . 1 . 2]" 1
1104 1 68 LEU HA 1 68 LEU HG 3.740 . 4.490 3.314 3.247 3.378 . 0 0 "[ . 1 . 2]" 1
1105 1 68 LEU HA 1 71 ASP H 4.300 . 5.160 4.240 3.800 4.783 . 0 0 "[ . 1 . 2]" 1
1106 1 68 LEU HA 1 71 ASP HB2 4.450 . 5.340 4.398 3.417 5.151 . 0 0 "[ . 1 . 2]" 1
1107 1 68 LEU HA 1 71 ASP HB3 4.010 . 4.810 3.897 3.132 4.896 0.086 8 0 "[ . 1 . 2]" 1
1108 1 68 LEU HB2 1 68 LEU MD2 2.970 . 3.560 2.399 2.378 2.423 . 0 0 "[ . 1 . 2]" 1
1109 1 68 LEU HB2 1 69 PHE H 4.340 . 5.210 3.743 3.644 3.905 . 0 0 "[ . 1 . 2]" 1
1110 1 68 LEU HB3 1 68 LEU MD1 3.300 . 3.960 3.216 3.211 3.221 . 0 0 "[ . 1 . 2]" 1
1111 1 68 LEU HB3 1 68 LEU MD2 2.990 . 3.590 2.336 2.318 2.349 . 0 0 "[ . 1 . 2]" 1
1112 1 68 LEU HB3 1 68 LEU HG 2.800 . 3.360 2.468 2.455 2.483 . 0 0 "[ . 1 . 2]" 1
1113 1 68 LEU HB3 1 69 PHE H 3.640 . 4.370 2.281 2.138 2.521 . 0 0 "[ . 1 . 2]" 1
1114 1 68 LEU HB3 1 69 PHE HB2 4.850 . 5.820 4.112 3.876 4.287 . 0 0 "[ . 1 . 2]" 1
1115 1 68 LEU MD1 1 69 PHE H 4.470 . 5.360 4.060 3.951 4.282 . 0 0 "[ . 1 . 2]" 1
1116 1 68 LEU MD1 1 69 PHE HA 4.290 . 5.150 4.065 3.840 4.312 . 0 0 "[ . 1 . 2]" 1
1117 1 68 LEU MD1 1 69 PHE QE 4.950 . 5.940 4.525 3.886 4.845 . 0 0 "[ . 1 . 2]" 1
1118 1 68 LEU MD1 1 71 ASP HB3 5.560 . 6.670 4.348 3.385 5.145 . 0 0 "[ . 1 . 2]" 1
1119 1 68 LEU MD1 1 72 ARG HB3 4.470 . 5.360 4.579 3.341 5.360 0.000 10 0 "[ . 1 . 2]" 1
1120 1 68 LEU MD1 1 72 ARG QD . . 4.450 3.258 2.235 3.936 . 0 0 "[ . 1 . 2]" 1
1121 1 68 LEU MD2 1 69 PHE QD 4.600 . 5.520 2.675 2.362 3.036 . 0 0 "[ . 1 . 2]" 1
1122 1 68 LEU MD2 1 69 PHE QE 5.180 . 6.220 2.511 2.214 2.860 . 0 0 "[ . 1 . 2]" 1
1123 1 68 LEU HG 1 69 PHE H 3.360 . 4.030 2.972 2.770 3.411 . 0 0 "[ . 1 . 2]" 1
1124 1 68 LEU HG 1 69 PHE HA 4.160 . 4.990 3.197 2.971 3.543 . 0 0 "[ . 1 . 2]" 1
1125 1 68 LEU HG 1 69 PHE HB2 3.510 . 4.210 4.282 4.225 4.319 0.109 19 0 "[ . 1 . 2]" 1
1126 1 68 LEU HG 1 69 PHE HB3 4.790 . 5.750 5.031 4.822 5.197 . 0 0 "[ . 1 . 2]" 1
1127 1 68 LEU HG 1 69 PHE QE 4.820 . 5.780 3.658 2.993 3.994 . 0 0 "[ . 1 . 2]" 1
1128 1 68 LEU HG 1 72 ARG H 5.700 . 6.840 5.552 4.675 6.193 . 0 0 "[ . 1 . 2]" 1
1129 1 68 LEU HG 1 72 ARG HB3 5.240 . 6.290 5.722 4.840 6.310 0.020 10 0 "[ . 1 . 2]" 1
1130 1 68 LEU HG 1 72 ARG QD 5.100 . 5.140 3.349 2.587 3.922 . 0 0 "[ . 1 . 2]" 1
1131 1 68 LEU HG 1 72 ARG QG 5.490 . 6.590 4.042 3.142 4.633 . 0 0 "[ . 1 . 2]" 1
1132 1 69 PHE H 1 69 PHE HB2 3.260 . 3.910 2.234 2.189 2.288 . 0 0 "[ . 1 . 2]" 1
1133 1 69 PHE H 1 69 PHE HB3 3.310 . 3.970 3.531 3.473 3.565 . 0 0 "[ . 1 . 2]" 1
1134 1 69 PHE H 1 69 PHE QD 3.750 . 4.500 2.593 2.390 2.892 . 0 0 "[ . 1 . 2]" 1
1135 1 69 PHE H 1 70 ARG H 3.520 . 4.220 2.618 2.423 2.756 . 0 0 "[ . 1 . 2]" 1
1136 1 69 PHE H 1 71 ASP H 4.350 . 5.220 4.279 4.009 4.602 . 0 0 "[ . 1 . 2]" 1
1137 1 69 PHE H 1 71 ASP HB2 6.500 . 7.800 6.079 5.191 6.430 . 0 0 "[ . 1 . 2]" 1
1138 1 69 PHE H 1 72 ARG H 4.860 . 5.830 5.157 4.903 5.496 . 0 0 "[ . 1 . 2]" 1
1139 1 69 PHE HA 1 69 PHE QD 4.010 . 4.810 2.937 2.689 3.054 . 0 0 "[ . 1 . 2]" 1
1140 1 69 PHE HA 1 69 PHE QE 5.420 . 6.500 4.456 4.378 4.530 . 0 0 "[ . 1 . 2]" 1
1141 1 69 PHE HA 1 70 ARG HA 4.950 . 5.940 4.829 4.737 4.873 . 0 0 "[ . 1 . 2]" 1
1142 1 69 PHE HA 1 72 ARG H 3.870 . 4.640 3.370 3.123 3.716 . 0 0 "[ . 1 . 2]" 1
1143 1 69 PHE HA 1 72 ARG HA 5.410 . 6.490 5.650 5.409 5.989 . 0 0 "[ . 1 . 2]" 1
1144 1 69 PHE HA 1 72 ARG HB2 4.540 . 5.450 4.820 4.654 4.978 . 0 0 "[ . 1 . 2]" 1
1145 1 69 PHE HA 1 72 ARG HB3 4.220 . 5.060 4.421 3.808 4.716 . 0 0 "[ . 1 . 2]" 1
1146 1 69 PHE HA 1 72 ARG QD 4.460 . 5.350 2.479 2.095 2.699 . 0 0 "[ . 1 . 2]" 1
1147 1 69 PHE HA 1 72 ARG QG 4.600 . 5.520 2.005 1.786 2.278 0.014 6 0 "[ . 1 . 2]" 1
1148 1 69 PHE HA 1 73 PHE H 4.300 . 5.160 4.329 3.890 5.166 0.006 8 0 "[ . 1 . 2]" 1
1149 1 69 PHE HA 1 73 PHE QD 4.550 . 5.460 2.997 2.698 3.470 . 0 0 "[ . 1 . 2]" 1
1150 1 69 PHE HB2 1 70 ARG H 3.630 . 4.360 3.073 2.855 3.347 . 0 0 "[ . 1 . 2]" 1
1151 1 69 PHE HB2 1 70 ARG QB 6.270 . 7.520 4.707 4.448 5.077 . 0 0 "[ . 1 . 2]" 1
1152 1 69 PHE HB2 1 72 ARG QD 4.450 . 5.340 4.813 4.389 5.156 . 0 0 "[ . 1 . 2]" 1
1153 1 69 PHE HB3 1 70 ARG H 5.850 . 7.020 3.595 3.310 3.739 . 0 0 "[ . 1 . 2]" 1
1154 1 69 PHE HB3 1 70 ARG QB 5.270 . 6.320 5.006 4.765 5.155 . 0 0 "[ . 1 . 2]" 1
1155 1 69 PHE QD 1 70 ARG HA 5.260 . 6.310 5.830 5.619 5.924 . 0 0 "[ . 1 . 2]" 1
1156 1 69 PHE QD 1 73 PHE QB 6.400 . 7.680 4.346 3.918 4.745 . 0 0 "[ . 1 . 2]" 1
1157 1 69 PHE QD 1 73 PHE QD 4.920 . 5.900 2.560 2.366 2.949 . 0 0 "[ . 1 . 2]" 1
1158 1 69 PHE QD 1 73 PHE QE 4.070 . 4.880 1.989 1.787 2.415 0.013 18 0 "[ . 1 . 2]" 1
1159 1 69 PHE QE 1 72 ARG QD 4.620 . 5.540 3.562 3.083 4.012 . 0 0 "[ . 1 . 2]" 1
1160 1 69 PHE QE 1 73 PHE QD 3.840 . 4.610 4.527 4.302 4.571 . 0 0 "[ . 1 . 2]" 1
1161 1 70 ARG H 1 70 ARG HB2 3.550 . 4.260 2.732 2.197 3.653 . 0 0 "[ . 1 . 2]" 1
1162 1 70 ARG H 1 70 ARG HB3 3.550 . 4.260 2.586 2.374 2.970 . 0 0 "[ . 1 . 2]" 1
1163 1 70 ARG H 1 71 ASP H 3.540 . 4.250 2.764 2.566 2.959 . 0 0 "[ . 1 . 2]" 1
1164 1 70 ARG H 1 71 ASP HB2 5.260 . 6.310 5.076 4.641 5.276 . 0 0 "[ . 1 . 2]" 1
1165 1 70 ARG H 1 72 ARG H 4.520 . 5.420 4.368 4.120 4.618 . 0 0 "[ . 1 . 2]" 1
1166 1 70 ARG HA 1 70 ARG HD2 5.100 . 6.120 4.414 3.489 5.540 . 0 0 "[ . 1 . 2]" 1
1167 1 70 ARG HA 1 70 ARG QD 4.450 . 5.340 3.663 2.676 4.466 . 0 0 "[ . 1 . 2]" 1
1168 1 70 ARG HA 1 70 ARG HD3 5.100 . 6.120 4.078 2.722 4.976 . 0 0 "[ . 1 . 2]" 1
1169 1 70 ARG HA 1 73 PHE QB 4.610 . 5.220 3.181 2.899 3.613 . 0 0 "[ . 1 . 2]" 1
1170 1 70 ARG HA 1 74 ASP H 4.310 . 5.170 3.898 2.769 4.949 . 0 0 "[ . 1 . 2]" 1
1171 1 70 ARG HA 1 90 VAL HB 4.450 . 5.340 3.939 2.662 5.236 . 0 0 "[ . 1 . 2]" 1
1172 1 70 ARG HA 1 90 VAL MG1 4.430 . 5.320 2.384 1.806 3.397 . 0 0 "[ . 1 . 2]" 1
1173 1 70 ARG HA 1 90 VAL QG 3.860 . 4.630 2.203 1.800 2.703 . 0 0 "[ . 1 . 2]" 1
1174 1 70 ARG HA 1 90 VAL MG2 4.430 . 5.320 3.111 1.839 4.012 . 0 0 "[ . 1 . 2]" 1
1175 1 70 ARG QB 1 90 VAL QG 4.730 . 5.680 2.881 2.259 3.435 . 0 0 "[ . 1 . 2]" 1
1176 1 70 ARG HB2 1 71 ASP H 4.420 . 5.300 3.887 3.665 4.069 . 0 0 "[ . 1 . 2]" 1
1177 1 70 ARG HB3 1 71 ASP H 4.420 . 5.300 2.894 2.459 4.062 . 0 0 "[ . 1 . 2]" 1
1178 1 70 ARG QD 1 71 ASP HA 4.290 . 5.150 3.295 2.395 4.919 . 0 0 "[ . 1 . 2]" 1
1179 1 70 ARG QD 1 74 ASP H 5.040 . 6.050 4.937 3.952 6.105 0.055 19 0 "[ . 1 . 2]" 1
1180 1 70 ARG QD 1 74 ASP QB 4.620 . 5.540 3.562 2.403 5.420 . 0 0 "[ . 1 . 2]" 1
1181 1 70 ARG HD2 1 71 ASP H 5.110 . 6.130 4.150 2.747 5.343 . 0 0 "[ . 1 . 2]" 1
1182 1 70 ARG HD2 1 71 ASP HA 4.910 . 5.890 4.151 2.456 5.922 0.032 3 0 "[ . 1 . 2]" 1
1183 1 70 ARG HD3 1 71 ASP H 5.110 . 6.130 4.094 2.798 5.736 . 0 0 "[ . 1 . 2]" 1
1184 1 70 ARG HD3 1 71 ASP HA 4.910 . 5.890 3.854 2.415 5.992 0.102 8 0 "[ . 1 . 2]" 1
1185 1 70 ARG QG 1 71 ASP H 4.300 . 5.160 3.690 2.056 4.618 . 0 0 "[ . 1 . 2]" 1
1186 1 70 ARG QG 1 90 VAL QG 5.700 . 6.840 2.654 1.777 4.360 0.023 20 0 "[ . 1 . 2]" 1
1187 1 71 ASP H 1 71 ASP HB2 3.150 . 3.780 2.497 2.235 2.625 . 0 0 "[ . 1 . 2]" 1
1188 1 71 ASP H 1 71 ASP HB3 3.300 . 3.960 2.573 2.381 3.526 . 0 0 "[ . 1 . 2]" 1
1189 1 71 ASP H 1 72 ARG H 3.400 . 4.080 2.748 2.536 2.944 . 0 0 "[ . 1 . 2]" 1
1190 1 71 ASP H 1 72 ARG HA 5.240 . 6.290 5.351 5.186 5.508 . 0 0 "[ . 1 . 2]" 1
1191 1 71 ASP H 1 73 PHE H 4.430 . 5.320 4.071 3.836 4.466 . 0 0 "[ . 1 . 2]" 1
1192 1 71 ASP HA 1 74 ASP H 4.430 . 5.320 4.253 3.611 5.178 . 0 0 "[ . 1 . 2]" 1
1193 1 71 ASP HA 1 74 ASP QB 3.640 . 4.370 3.399 2.616 4.037 . 0 0 "[ . 1 . 2]" 1
1194 1 71 ASP HB2 1 72 ARG H 3.940 . 4.730 3.944 3.724 4.263 . 0 0 "[ . 1 . 2]" 1
1195 1 71 ASP HB3 1 72 ARG H 3.600 . 4.320 2.783 2.392 4.310 . 0 0 "[ . 1 . 2]" 1
1196 1 71 ASP HB3 1 72 ARG HA 4.430 . 5.320 4.444 4.128 4.816 . 0 0 "[ . 1 . 2]" 1
1197 1 72 ARG H 1 72 ARG HB2 3.600 . 4.320 3.667 3.577 3.928 . 0 0 "[ . 1 . 2]" 1
1198 1 72 ARG H 1 72 ARG HB3 3.190 . 3.830 2.890 2.576 3.297 . 0 0 "[ . 1 . 2]" 1
1199 1 72 ARG H 1 72 ARG QD 4.620 . 5.520 3.834 3.630 4.137 . 0 0 "[ . 1 . 2]" 1
1200 1 72 ARG H 1 72 ARG QG 3.590 . 4.310 2.006 1.771 2.368 0.029 4 0 "[ . 1 . 2]" 1
1201 1 72 ARG H 1 73 PHE H 3.230 . 3.880 2.449 2.015 2.801 . 0 0 "[ . 1 . 2]" 1
1202 1 72 ARG H 1 73 PHE QB 4.640 . 5.570 4.249 3.488 4.587 . 0 0 "[ . 1 . 2]" 1
1203 1 72 ARG H 1 73 PHE QD 5.060 . 6.070 4.054 3.688 4.318 . 0 0 "[ . 1 . 2]" 1
1204 1 72 ARG H 1 74 ASP H 4.990 . 5.990 4.217 3.518 5.359 . 0 0 "[ . 1 . 2]" 1
1205 1 72 ARG HA 1 72 ARG QD 4.730 . 5.680 4.502 4.432 4.565 . 0 0 "[ . 1 . 2]" 1
1206 1 72 ARG HA 1 73 PHE H 3.460 . 4.150 3.363 3.027 3.515 . 0 0 "[ . 1 . 2]" 1
1207 1 72 ARG HB2 1 72 ARG QD 3.640 . 4.370 2.883 2.717 3.086 . 0 0 "[ . 1 . 2]" 1
1208 1 72 ARG HB2 1 73 PHE H 4.440 . 5.330 4.138 3.840 4.484 . 0 0 "[ . 1 . 2]" 1
1209 1 72 ARG HB2 1 73 PHE QD 4.740 . 5.690 4.197 3.932 4.531 . 0 0 "[ . 1 . 2]" 1
1210 1 72 ARG HB3 1 72 ARG QD 3.710 . 4.450 2.470 2.361 2.662 . 0 0 "[ . 1 . 2]" 1
1211 1 72 ARG HB3 1 73 PHE H 3.870 . 4.640 4.362 4.116 4.588 . 0 0 "[ . 1 . 2]" 1
1212 1 72 ARG HB3 1 73 PHE QD 4.630 . 5.560 4.875 4.615 5.194 . 0 0 "[ . 1 . 2]" 1
1213 1 72 ARG QD 1 73 PHE H 5.610 . 6.730 4.885 4.451 5.446 . 0 0 "[ . 1 . 2]" 1
1214 1 72 ARG QD 1 73 PHE QD 4.520 . 5.420 3.398 2.995 3.724 . 0 0 "[ . 1 . 2]" 1
1215 1 72 ARG QD 1 73 PHE QE 4.650 . 5.580 3.151 2.785 3.537 . 0 0 "[ . 1 . 2]" 1
1216 1 72 ARG QG 1 73 PHE H 4.160 . 4.990 2.876 2.416 3.560 . 0 0 "[ . 1 . 2]" 1
1217 1 72 ARG QG 1 73 PHE QD 4.770 . 5.620 1.960 1.777 2.280 0.023 12 0 "[ . 1 . 2]" 1
1218 1 72 ARG QG 1 73 PHE QE 4.480 . 5.380 3.052 2.734 3.401 . 0 0 "[ . 1 . 2]" 1
1219 1 73 PHE H 1 73 PHE QB 3.560 . 4.000 2.442 2.257 2.755 . 0 0 "[ . 1 . 2]" 1
1220 1 73 PHE H 1 73 PHE QD 3.680 . 4.420 3.221 2.536 3.846 . 0 0 "[ . 1 . 2]" 1
1221 1 73 PHE H 1 74 ASP H 3.290 . 3.950 2.347 1.862 2.991 . 0 0 "[ . 1 . 2]" 1
1222 1 73 PHE H 1 90 VAL QG 4.480 . 5.380 3.946 3.201 4.602 . 0 0 "[ . 1 . 2]" 1
1223 1 73 PHE HA 1 73 PHE QD 3.990 . 4.790 2.844 2.513 3.075 . 0 0 "[ . 1 . 2]" 1
1224 1 73 PHE HA 1 73 PHE QE 5.240 . 6.290 4.484 4.396 4.554 . 0 0 "[ . 1 . 2]" 1
1225 1 73 PHE HA 1 76 TYR HA 5.170 . 6.200 5.147 4.211 5.852 . 0 0 "[ . 1 . 2]" 1
1226 1 73 PHE HA 1 76 TYR HB3 3.590 . 4.310 3.121 2.418 4.207 . 0 0 "[ . 1 . 2]" 1
1227 1 73 PHE HA 1 76 TYR QD 5.950 . 7.140 3.544 2.870 4.734 . 0 0 "[ . 1 . 2]" 1
1228 1 73 PHE QB 1 74 ASP H 3.320 . 3.980 3.120 2.011 3.765 . 0 0 "[ . 1 . 2]" 1
1229 1 73 PHE QB 1 75 GLY H 5.590 . 5.900 4.255 2.961 5.024 . 0 0 "[ . 1 . 2]" 1
1230 1 73 PHE QB 1 76 TYR H 4.570 . 5.480 4.432 3.457 5.292 . 0 0 "[ . 1 . 2]" 1
1231 1 73 PHE QB 1 76 TYR QD 4.470 . 5.360 3.711 2.813 4.487 . 0 0 "[ . 1 . 2]" 1
1232 1 73 PHE QB 1 88 ALA MB 5.500 . 6.600 4.047 3.440 4.848 . 0 0 "[ . 1 . 2]" 1
1233 1 73 PHE QB 1 90 VAL QG 3.320 . 3.980 2.361 1.882 3.163 . 0 0 "[ . 1 . 2]" 1
1234 1 73 PHE QD 1 76 TYR H 4.230 . 5.080 4.565 4.018 5.055 . 0 0 "[ . 1 . 2]" 1
1235 1 73 PHE QD 1 76 TYR HB3 3.910 . 4.690 3.651 2.302 4.658 . 0 0 "[ . 1 . 2]" 1
1236 1 73 PHE QD 1 76 TYR QD 3.840 . 4.610 2.597 2.202 2.915 . 0 0 "[ . 1 . 2]" 1
1237 1 73 PHE QD 1 76 TYR QE 4.530 . 5.440 2.975 2.009 4.342 . 0 0 "[ . 1 . 2]" 1
1238 1 73 PHE QD 1 88 ALA MB 5.480 . 6.580 3.518 2.193 4.390 . 0 0 "[ . 1 . 2]" 1
1239 1 73 PHE QD 1 90 VAL QG 4.140 . 4.970 3.899 3.337 4.583 . 0 0 "[ . 1 . 2]" 1
1240 1 74 ASP H 1 74 ASP QB 3.370 . 4.040 2.463 2.219 2.881 . 0 0 "[ . 1 . 2]" 1
1241 1 74 ASP H 1 75 GLY H 4.450 . 5.340 3.731 2.713 4.401 . 0 0 "[ . 1 . 2]" 1
1242 1 74 ASP H 1 76 TYR HB3 5.800 . 6.960 5.147 4.657 5.807 . 0 0 "[ . 1 . 2]" 1
1243 1 74 ASP H 1 90 VAL QG 3.590 . 4.310 3.411 2.490 4.279 . 0 0 "[ . 1 . 2]" 1
1244 1 74 ASP HA 1 75 GLY H 3.280 . 3.940 2.671 2.153 3.594 . 0 0 "[ . 1 . 2]" 1
1245 1 74 ASP HA 1 76 TYR H 5.190 . 6.230 4.822 3.750 6.018 . 0 0 "[ . 1 . 2]" 1
1246 1 74 ASP HA 1 89 VAL HA 5.000 . 6.000 3.767 2.838 4.944 . 0 0 "[ . 1 . 2]" 1
1247 1 74 ASP HA 1 90 VAL H 4.230 . 5.080 2.949 2.065 3.853 . 0 0 "[ . 1 . 2]" 1
1248 1 74 ASP HA 1 90 VAL QG 3.660 . 4.390 2.648 1.917 3.809 . 0 0 "[ . 1 . 2]" 1
1249 1 75 GLY H 1 76 TYR H 3.490 . 4.190 2.638 2.149 3.044 . 0 0 "[ . 1 . 2]" 1
1250 1 75 GLY H 1 76 TYR HB3 4.970 . 5.960 4.177 3.601 4.758 . 0 0 "[ . 1 . 2]" 1
1251 1 75 GLY H 1 88 ALA H 5.270 . 6.320 5.556 4.940 6.367 0.047 7 0 "[ . 1 . 2]" 1
1252 1 75 GLY H 1 88 ALA MB 4.830 . 5.800 4.580 3.773 5.802 0.002 7 0 "[ . 1 . 2]" 1
1253 1 75 GLY H 1 89 VAL HA 3.640 . 4.370 2.872 1.845 4.430 0.060 9 0 "[ . 1 . 2]" 1
1254 1 75 GLY H 1 90 VAL HB 6.250 . 7.500 5.190 3.979 6.642 . 0 0 "[ . 1 . 2]" 1
1255 1 75 GLY H 1 90 VAL QG 3.710 . 4.450 3.635 2.798 4.507 0.057 20 0 "[ . 1 . 2]" 1
1256 1 75 GLY HA2 1 87 PRO HB2 4.570 . 5.480 4.776 3.744 5.482 0.002 20 0 "[ . 1 . 2]" 1
1257 1 75 GLY HA2 1 87 PRO HB3 5.380 . 6.460 5.507 4.473 6.278 . 0 0 "[ . 1 . 2]" 1
1258 1 75 GLY HA2 1 88 ALA H 4.340 . 5.210 4.308 3.165 4.789 . 0 0 "[ . 1 . 2]" 1
1259 1 75 GLY HA2 1 89 VAL HA 3.780 . 4.540 2.670 1.890 3.554 . 0 0 "[ . 1 . 2]" 1
1260 1 75 GLY HA2 1 89 VAL MG1 6.190 . 7.430 3.879 3.496 4.641 . 0 0 "[ . 1 . 2]" 1
1261 1 75 GLY HA2 1 89 VAL QG 4.670 . 5.600 2.485 1.919 3.527 . 0 0 "[ . 1 . 2]" 1
1262 1 75 GLY HA2 1 89 VAL MG2 6.190 . 7.430 2.527 1.927 3.678 . 0 0 "[ . 1 . 2]" 1
1263 1 75 GLY HA2 1 90 VAL QG 6.400 . 7.680 4.970 3.796 5.672 . 0 0 "[ . 1 . 2]" 1
1264 1 75 GLY HA3 1 87 PRO HB2 5.440 . 6.530 5.720 4.844 6.499 . 0 0 "[ . 1 . 2]" 1
1265 1 75 GLY HA3 1 88 ALA H 5.270 . 6.320 5.735 4.617 6.255 . 0 0 "[ . 1 . 2]" 1
1266 1 75 GLY HA3 1 89 VAL MG1 5.740 . 6.890 4.119 3.190 5.303 . 0 0 "[ . 1 . 2]" 1
1267 1 75 GLY HA3 1 89 VAL QG 4.780 . 5.740 2.986 2.125 4.181 . 0 0 "[ . 1 . 2]" 1
1268 1 75 GLY HA3 1 89 VAL MG2 5.740 . 6.890 3.077 2.145 4.376 . 0 0 "[ . 1 . 2]" 1
1269 1 75 GLY HA3 1 90 VAL QG 6.400 . 7.680 5.565 4.726 6.172 . 0 0 "[ . 1 . 2]" 1
1270 1 76 TYR H 1 76 TYR HB3 3.070 . 3.680 2.420 2.102 2.931 . 0 0 "[ . 1 . 2]" 1
1271 1 76 TYR H 1 76 TYR QD 3.580 . 4.300 2.834 1.809 3.938 . 0 0 "[ . 1 . 2]" 1
1272 1 76 TYR H 1 76 TYR QE 5.240 . 6.290 4.941 3.906 5.995 . 0 0 "[ . 1 . 2]" 1
1273 1 76 TYR H 1 77 ILE H 4.720 . 5.660 4.519 4.355 4.650 . 0 0 "[ . 1 . 2]" 1
1274 1 76 TYR H 1 77 ILE HG12 5.550 . 6.660 5.544 5.221 5.989 . 0 0 "[ . 1 . 2]" 1
1275 1 76 TYR H 1 88 ALA H 3.930 . 4.720 3.659 3.005 4.128 . 0 0 "[ . 1 . 2]" 1
1276 1 76 TYR H 1 88 ALA MB 3.460 . 4.150 3.185 2.639 3.807 . 0 0 "[ . 1 . 2]" 1
1277 1 76 TYR H 1 89 VAL HA 5.390 . 6.470 4.124 3.614 4.923 . 0 0 "[ . 1 . 2]" 1
1278 1 76 TYR H 1 89 VAL QG 5.690 . 6.830 4.362 3.829 5.158 . 0 0 "[ . 1 . 2]" 1
1279 1 76 TYR H 1 90 VAL QG 5.920 . 7.100 4.826 4.147 5.676 . 0 0 "[ . 1 . 2]" 1
1280 1 76 TYR HA 1 76 TYR QD 3.860 . 4.630 3.397 2.845 3.758 . 0 0 "[ . 1 . 2]" 1
1281 1 76 TYR HA 1 77 ILE H 3.170 . 3.800 2.272 2.136 2.447 . 0 0 "[ . 1 . 2]" 1
1282 1 76 TYR HA 1 77 ILE HG12 4.050 . 4.860 3.722 3.462 4.010 . 0 0 "[ . 1 . 2]" 1
1283 1 76 TYR HA 1 88 ALA MB 5.240 . 6.290 4.989 4.183 5.733 . 0 0 "[ . 1 . 2]" 1
1284 1 76 TYR HB2 1 77 ILE H 4.000 . 4.800 3.292 2.485 4.200 . 0 0 "[ . 1 . 2]" 1
1285 1 76 TYR HB3 1 88 ALA H 4.690 . 5.630 5.006 3.905 5.687 0.057 18 0 "[ . 1 . 2]" 1
1286 1 76 TYR HB3 1 88 ALA MB 4.180 . 5.020 3.828 2.140 5.098 0.078 20 0 "[ . 1 . 2]" 1
1287 1 76 TYR QD 1 77 ILE H 3.730 . 4.480 3.318 3.049 3.566 . 0 0 "[ . 1 . 2]" 1
1288 1 76 TYR QD 1 78 PHE HA 5.800 . 6.960 4.273 3.509 5.059 . 0 0 "[ . 1 . 2]" 1
1289 1 76 TYR QD 1 78 PHE QB . . 4.900 3.782 2.418 4.150 . 0 0 "[ . 1 . 2]" 1
1290 1 76 TYR QD 1 88 ALA MB 4.130 . 4.960 2.376 1.767 3.315 0.033 5 0 "[ . 1 . 2]" 1
1291 1 76 TYR QE 1 78 PHE HA 4.190 . 5.030 3.474 2.909 4.363 . 0 0 "[ . 1 . 2]" 1
1292 1 76 TYR QE 1 78 PHE QB 4.500 . 5.400 2.544 1.784 3.076 0.016 13 0 "[ . 1 . 2]" 1
1293 1 76 TYR QE 1 78 PHE HD1 3.930 . 4.720 3.058 2.148 3.974 . 0 0 "[ . 1 . 2]" 1
1294 1 76 TYR QE 1 88 ALA MB 5.050 . 6.060 2.696 1.964 3.487 . 0 0 "[ . 1 . 2]" 1
1295 1 77 ILE H 1 77 ILE HB 3.140 . 3.770 2.511 2.451 2.579 . 0 0 "[ . 1 . 2]" 1
1296 1 77 ILE H 1 77 ILE MD 4.060 . 4.870 3.578 3.347 3.773 . 0 0 "[ . 1 . 2]" 1
1297 1 77 ILE H 1 77 ILE HG12 3.470 . 4.160 2.521 2.214 2.788 . 0 0 "[ . 1 . 2]" 1
1298 1 77 ILE H 1 77 ILE HG13 3.780 . 4.540 3.862 3.647 4.077 . 0 0 "[ . 1 . 2]" 1
1299 1 77 ILE H 1 77 ILE MG 3.780 . 4.540 3.805 3.773 3.840 . 0 0 "[ . 1 . 2]" 1
1300 1 77 ILE H 1 78 PHE H 4.800 . 5.760 4.317 4.187 4.503 . 0 0 "[ . 1 . 2]" 1
1301 1 77 ILE H 1 87 PRO HA 4.430 . 5.320 4.681 4.321 4.919 . 0 0 "[ . 1 . 2]" 1
1302 1 77 ILE HA 1 77 ILE MD 3.240 . 3.890 2.041 1.989 2.100 . 0 0 "[ . 1 . 2]" 1
1303 1 77 ILE HA 1 77 ILE HG12 4.000 . 4.800 3.023 2.947 3.068 . 0 0 "[ . 1 . 2]" 1
1304 1 77 ILE HA 1 77 ILE HG13 4.010 . 4.810 3.745 3.719 3.764 . 0 0 "[ . 1 . 2]" 1
1305 1 77 ILE HA 1 77 ILE MG 3.310 . 3.970 2.435 2.401 2.465 . 0 0 "[ . 1 . 2]" 1
1306 1 77 ILE HA 1 78 PHE H 3.310 . 3.970 2.180 2.132 2.221 . 0 0 "[ . 1 . 2]" 1
1307 1 77 ILE HA 1 86 TYR H 4.280 . 5.140 4.093 3.627 4.591 . 0 0 "[ . 1 . 2]" 1
1308 1 77 ILE HA 1 87 PRO HA 3.850 . 4.620 2.614 2.477 2.788 . 0 0 "[ . 1 . 2]" 1
1309 1 77 ILE HA 1 87 PRO HB2 4.840 . 5.810 5.237 4.936 5.526 . 0 0 "[ . 1 . 2]" 1
1310 1 77 ILE HA 1 87 PRO HB3 3.920 . 4.700 4.219 3.828 4.496 . 0 0 "[ . 1 . 2]" 1
1311 1 77 ILE HA 1 88 ALA H 3.880 . 4.660 3.567 3.082 4.404 . 0 0 "[ . 1 . 2]" 1
1312 1 77 ILE HA 1 88 ALA MB 5.980 . 7.180 4.786 4.305 5.455 . 0 0 "[ . 1 . 2]" 1
1313 1 77 ILE HB 1 78 PHE H 4.500 . 5.400 4.393 4.250 4.465 . 0 0 "[ . 1 . 2]" 1
1314 1 77 ILE HB 1 85 GLU QG 6.130 . 7.360 5.180 4.736 5.981 . 0 0 "[ . 1 . 2]" 1
1315 1 77 ILE HB 1 87 PRO HB3 6.500 . 7.800 6.178 5.905 6.370 . 0 0 "[ . 1 . 2]" 1
1316 1 77 ILE MD 1 78 PHE H 3.610 . 4.330 3.782 3.575 3.934 . 0 0 "[ . 1 . 2]" 1
1317 1 77 ILE MD 1 85 GLU HA 3.980 . 4.780 4.223 3.825 4.727 . 0 0 "[ . 1 . 2]" 1
1318 1 77 ILE MD 1 85 GLU HB2 4.340 . 5.210 4.077 3.549 4.994 . 0 0 "[ . 1 . 2]" 1
1319 1 77 ILE MD 1 85 GLU HB3 3.380 . 4.060 2.671 2.213 3.520 . 0 0 "[ . 1 . 2]" 1
1320 1 77 ILE MD 1 85 GLU QG 3.990 . 4.790 4.002 3.694 4.557 . 0 0 "[ . 1 . 2]" 1
1321 1 77 ILE MD 1 86 TYR H 3.680 . 4.420 4.286 3.958 4.451 0.031 20 0 "[ . 1 . 2]" 1
1322 1 77 ILE MD 1 87 PRO HA 3.370 . 4.040 1.962 1.766 2.334 0.034 16 0 "[ . 1 . 2]" 1
1323 1 77 ILE MD 1 87 PRO HB2 3.920 . 4.700 3.423 3.223 3.716 . 0 0 "[ . 1 . 2]" 1
1324 1 77 ILE MD 1 87 PRO HB3 3.170 . 3.800 2.194 1.990 2.351 . 0 0 "[ . 1 . 2]" 1
1325 1 77 ILE MD 1 87 PRO HD2 3.990 . 4.790 4.591 4.300 4.749 . 0 0 "[ . 1 . 2]" 1
1326 1 77 ILE MD 1 87 PRO HD3 3.990 . 4.790 3.673 3.136 4.210 . 0 0 "[ . 1 . 2]" 1
1327 1 77 ILE MD 1 87 PRO HG2 4.090 . 4.910 4.378 3.847 4.568 . 0 0 "[ . 1 . 2]" 1
1328 1 77 ILE MD 1 87 PRO HG3 3.540 . 4.250 3.561 2.598 3.977 . 0 0 "[ . 1 . 2]" 1
1329 1 77 ILE MD 1 88 ALA H 4.710 . 5.650 3.813 3.424 4.247 . 0 0 "[ . 1 . 2]" 1
1330 1 77 ILE HG12 1 87 PRO HA 4.210 . 5.050 4.072 3.794 4.495 . 0 0 "[ . 1 . 2]" 1
1331 1 77 ILE HG12 1 87 PRO HB2 5.410 . 6.490 5.740 5.331 6.217 . 0 0 "[ . 1 . 2]" 1
1332 1 77 ILE HG12 1 87 PRO HB3 3.810 . 4.570 4.512 4.125 4.625 0.055 16 0 "[ . 1 . 2]" 1
1333 1 77 ILE HG12 1 87 PRO QD 6.260 . 7.510 6.265 5.714 6.651 . 0 0 "[ . 1 . 2]" 1
1334 1 77 ILE HG12 1 88 ALA H 4.920 . 5.900 5.465 4.873 5.933 0.033 19 0 "[ . 1 . 2]" 1
1335 1 77 ILE HG13 1 77 ILE MG 3.190 . 3.830 2.392 2.365 2.430 . 0 0 "[ . 1 . 2]" 1
1336 1 77 ILE HG13 1 87 PRO HA 6.500 . 7.800 4.961 4.755 5.347 . 0 0 "[ . 1 . 2]" 1
1337 1 77 ILE HG13 1 87 PRO HB3 4.250 . 5.100 4.897 4.652 5.093 . 0 0 "[ . 1 . 2]" 1
1338 1 77 ILE MG 1 78 PHE H 3.300 . 3.960 3.106 2.700 3.331 . 0 0 "[ . 1 . 2]" 1
1339 1 77 ILE MG 1 78 PHE HA 4.190 . 5.030 3.800 3.533 3.934 . 0 0 "[ . 1 . 2]" 1
1340 1 77 ILE MG 1 78 PHE HB2 4.790 . 5.750 5.156 4.943 5.335 . 0 0 "[ . 1 . 2]" 1
1341 1 77 ILE MG 1 78 PHE HB3 4.790 . 5.750 4.846 4.646 5.054 . 0 0 "[ . 1 . 2]" 1
1342 1 77 ILE MG 1 79 LEU HA 4.410 . 5.290 4.174 3.773 4.535 . 0 0 "[ . 1 . 2]" 1
1343 1 77 ILE MG 1 79 LEU MD1 3.210 . 3.850 3.409 2.986 3.758 . 0 0 "[ . 1 . 2]" 1
1344 1 77 ILE MG 1 79 LEU HG 3.540 . 4.250 2.597 2.360 2.925 . 0 0 "[ . 1 . 2]" 1
1345 1 77 ILE MG 1 85 GLU H 4.550 . 5.460 4.780 4.436 5.506 0.046 3 0 "[ . 1 . 2]" 1
1346 1 77 ILE MG 1 85 GLU HA 3.400 . 4.080 2.710 2.398 3.292 . 0 0 "[ . 1 . 2]" 1
1347 1 77 ILE MG 1 85 GLU HB2 4.110 . 4.930 3.821 3.487 4.590 . 0 0 "[ . 1 . 2]" 1
1348 1 77 ILE MG 1 85 GLU HB3 3.230 . 3.880 2.347 1.944 3.131 . 0 0 "[ . 1 . 2]" 1
1349 1 77 ILE MG 1 85 GLU QG 3.330 . 4.000 2.611 2.265 3.214 . 0 0 "[ . 1 . 2]" 1
1350 1 77 ILE MG 1 86 TYR H 3.300 . 3.960 3.135 2.848 3.398 . 0 0 "[ . 1 . 2]" 1
1351 1 77 ILE MG 1 87 PRO HA 4.070 . 4.880 3.998 3.789 4.269 . 0 0 "[ . 1 . 2]" 1
1352 1 77 ILE MG 1 87 PRO QD 4.500 . 5.400 4.311 3.776 4.825 . 0 0 "[ . 1 . 2]" 1
1353 1 78 PHE H 1 78 PHE QB 3.550 . 4.260 2.350 2.261 2.416 . 0 0 "[ . 1 . 2]" 1
1354 1 78 PHE H 1 78 PHE HD1 5.300 . 6.360 4.935 4.828 5.084 . 0 0 "[ . 1 . 2]" 1
1355 1 78 PHE H 1 79 LEU H 4.330 . 5.200 4.514 4.426 4.589 . 0 0 "[ . 1 . 2]" 1
1356 1 78 PHE H 1 79 LEU HG 4.930 . 5.920 5.006 4.553 5.318 . 0 0 "[ . 1 . 2]" 1
1357 1 78 PHE H 1 85 GLU HA 4.380 . 5.260 4.549 4.197 5.010 . 0 0 "[ . 1 . 2]" 1
1358 1 78 PHE H 1 86 TYR H 3.760 . 4.510 3.073 2.647 3.318 . 0 0 "[ . 1 . 2]" 1
1359 1 78 PHE H 1 86 TYR HB2 5.040 . 6.050 2.970 2.752 3.177 . 0 0 "[ . 1 . 2]" 1
1360 1 78 PHE H 1 87 PRO HA 4.150 . 4.980 3.818 3.527 4.169 . 0 0 "[ . 1 . 2]" 1
1361 1 78 PHE HA 1 78 PHE HD1 3.730 . 4.480 2.662 2.380 2.901 . 0 0 "[ . 1 . 2]" 1
1362 1 78 PHE HA 1 79 LEU H 2.790 . 3.350 2.200 2.157 2.274 . 0 0 "[ . 1 . 2]" 1
1363 1 78 PHE HA 1 79 LEU HA 4.700 . 5.640 4.420 4.393 4.451 . 0 0 "[ . 1 . 2]" 1
1364 1 78 PHE HA 1 79 LEU HB2 4.560 . 5.470 4.490 4.409 4.600 . 0 0 "[ . 1 . 2]" 1
1365 1 78 PHE HA 1 79 LEU HB3 5.910 . 7.090 5.684 5.646 5.717 . 0 0 "[ . 1 . 2]" 1
1366 1 78 PHE HA 1 79 LEU MD1 4.200 . 5.040 5.006 4.757 5.080 0.040 10 0 "[ . 1 . 2]" 1
1367 1 78 PHE HA 1 79 LEU HG 4.440 . 5.330 3.959 3.734 4.161 . 0 0 "[ . 1 . 2]" 1
1368 1 78 PHE QB 1 78 PHE HD1 3.270 . 3.920 2.546 2.430 2.736 . 0 0 "[ . 1 . 2]" 1
1369 1 78 PHE QB 1 78 PHE HD2 3.270 . 3.920 2.309 2.269 2.372 . 0 0 "[ . 1 . 2]" 1
1370 1 78 PHE QB 1 79 LEU H 3.940 . 4.730 3.721 3.589 3.838 . 0 0 "[ . 1 . 2]" 1
1371 1 78 PHE QB 1 86 TYR H 4.390 . 5.270 3.608 3.270 3.901 . 0 0 "[ . 1 . 2]" 1
1372 1 78 PHE QB 1 86 TYR HB2 4.260 . 5.110 2.047 1.788 2.299 0.012 12 0 "[ . 1 . 2]" 1
1373 1 78 PHE QB 1 86 TYR QD 4.470 . 5.360 2.904 2.332 3.375 . 0 0 "[ . 1 . 2]" 1
1374 1 78 PHE HB2 1 79 LEU H 4.580 . 5.500 4.188 4.001 4.346 . 0 0 "[ . 1 . 2]" 1
1375 1 78 PHE HB2 1 86 TYR QD 5.320 . 6.380 4.517 3.979 5.017 . 0 0 "[ . 1 . 2]" 1
1376 1 78 PHE HB3 1 79 LEU H 4.580 . 5.500 4.169 3.987 4.370 . 0 0 "[ . 1 . 2]" 1
1377 1 78 PHE HB3 1 86 TYR QD 5.320 . 6.380 2.942 2.348 3.435 . 0 0 "[ . 1 . 2]" 1
1378 1 78 PHE HD1 1 79 LEU H 3.790 . 4.550 3.457 2.824 4.081 . 0 0 "[ . 1 . 2]" 1
1379 1 79 LEU H 1 79 LEU HB2 3.180 . 3.820 2.489 2.350 2.659 . 0 0 "[ . 1 . 2]" 1
1380 1 79 LEU H 1 79 LEU HB3 3.990 . 4.790 3.688 3.595 3.793 . 0 0 "[ . 1 . 2]" 1
1381 1 79 LEU H 1 79 LEU MD1 3.250 . 3.900 3.882 3.615 3.961 0.061 11 0 "[ . 1 . 2]" 1
1382 1 79 LEU H 1 79 LEU HG 3.200 . 3.840 2.984 2.784 3.234 . 0 0 "[ . 1 . 2]" 1
1383 1 79 LEU H 1 85 GLU HA 4.970 . 5.960 5.260 4.847 5.816 . 0 0 "[ . 1 . 2]" 1
1384 1 79 LEU H 1 86 TYR H 4.710 . 5.650 4.897 4.739 5.052 . 0 0 "[ . 1 . 2]" 1
1385 1 79 LEU HA 1 79 LEU MD1 3.870 . 4.640 3.877 3.849 3.912 . 0 0 "[ . 1 . 2]" 1
1386 1 79 LEU HA 1 79 LEU MD2 2.880 . 3.460 2.047 1.974 2.148 . 0 0 "[ . 1 . 2]" 1
1387 1 79 LEU HA 1 79 LEU HG 3.790 . 4.550 2.954 2.831 3.132 . 0 0 "[ . 1 . 2]" 1
1388 1 79 LEU HA 1 80 ASP H 3.210 . 3.850 2.159 2.109 2.252 . 0 0 "[ . 1 . 2]" 1
1389 1 79 LEU HA 1 83 GLY H 4.690 . 5.630 5.049 4.607 5.433 . 0 0 "[ . 1 . 2]" 1
1390 1 79 LEU HA 1 83 GLY HA3 5.760 . 6.910 5.700 5.089 6.220 . 0 0 "[ . 1 . 2]" 1
1391 1 79 LEU HA 1 84 LEU H 4.370 . 5.240 4.086 3.695 4.557 . 0 0 "[ . 1 . 2]" 1
1392 1 79 LEU HA 1 84 LEU HA 6.040 . 7.250 5.188 4.933 5.474 . 0 0 "[ . 1 . 2]" 1
1393 1 79 LEU HA 1 85 GLU HA 4.200 . 5.040 3.320 2.812 4.064 . 0 0 "[ . 1 . 2]" 1
1394 1 79 LEU HA 1 86 TYR H 4.220 . 5.060 3.593 3.404 3.834 . 0 0 "[ . 1 . 2]" 1
1395 1 79 LEU HA 1 86 TYR QD 4.760 . 5.710 3.530 2.802 4.613 . 0 0 "[ . 1 . 2]" 1
1396 1 79 LEU HB2 1 79 LEU MD1 2.500 . 3.000 2.295 2.255 2.327 . 0 0 "[ . 1 . 2]" 1
1397 1 79 LEU HB2 1 80 ASP H 4.190 . 5.030 4.276 3.947 4.439 . 0 0 "[ . 1 . 2]" 1
1398 1 79 LEU HB2 1 83 GLY H 5.610 . 6.730 5.897 5.516 6.157 . 0 0 "[ . 1 . 2]" 1
1399 1 79 LEU HB2 1 83 GLY HA2 4.490 . 5.390 4.549 3.759 5.047 . 0 0 "[ . 1 . 2]" 1
1400 1 79 LEU HB3 1 79 LEU MD1 3.360 . 4.030 2.457 2.405 2.506 . 0 0 "[ . 1 . 2]" 1
1401 1 79 LEU HB3 1 79 LEU MD2 3.200 . 3.840 2.332 2.289 2.372 . 0 0 "[ . 1 . 2]" 1
1402 1 79 LEU HB3 1 80 ASP H 3.460 . 4.150 3.353 2.828 3.720 . 0 0 "[ . 1 . 2]" 1
1403 1 79 LEU HB3 1 83 GLY H 4.210 . 5.050 4.331 4.015 4.598 . 0 0 "[ . 1 . 2]" 1
1404 1 79 LEU HB3 1 83 GLY HA2 4.380 . 5.260 2.820 2.044 3.314 . 0 0 "[ . 1 . 2]" 1
1405 1 79 LEU HB3 1 83 GLY HA3 4.170 . 5.000 4.478 3.502 5.049 0.049 5 0 "[ . 1 . 2]" 1
1406 1 79 LEU MD1 1 83 GLY HA2 4.120 . 4.940 3.805 3.284 4.282 . 0 0 "[ . 1 . 2]" 1
1407 1 79 LEU MD1 1 85 GLU HA 4.310 . 5.170 4.627 4.408 4.871 . 0 0 "[ . 1 . 2]" 1
1408 1 79 LEU MD1 1 85 GLU HB3 5.110 . 6.130 5.642 5.399 5.895 . 0 0 "[ . 1 . 2]" 1
1409 1 79 LEU MD1 1 85 GLU QG 3.990 . 4.790 3.728 3.475 3.947 . 0 0 "[ . 1 . 2]" 1
1410 1 79 LEU MD2 1 80 ASP H 3.780 . 4.540 3.493 3.248 3.843 . 0 0 "[ . 1 . 2]" 1
1411 1 79 LEU MD2 1 83 GLY H 4.190 . 5.030 4.557 4.319 4.928 . 0 0 "[ . 1 . 2]" 1
1412 1 79 LEU MD2 1 83 GLY HA2 3.450 . 4.140 2.809 2.478 3.364 . 0 0 "[ . 1 . 2]" 1
1413 1 79 LEU MD2 1 83 GLY HA3 3.770 . 4.520 3.736 3.226 4.403 . 0 0 "[ . 1 . 2]" 1
1414 1 79 LEU MD2 1 84 LEU HA 3.640 . 4.370 3.883 3.602 4.197 . 0 0 "[ . 1 . 2]" 1
1415 1 79 LEU MD2 1 85 GLU H 3.720 . 4.460 3.345 3.152 3.505 . 0 0 "[ . 1 . 2]" 1
1416 1 79 LEU MD2 1 85 GLU HA 2.990 . 3.590 2.076 1.915 2.287 . 0 0 "[ . 1 . 2]" 1
1417 1 79 LEU MD2 1 85 GLU HG2 3.140 . 3.770 2.028 1.769 2.522 0.031 5 0 "[ . 1 . 2]" 1
1418 1 79 LEU MD2 1 85 GLU HG3 3.140 . 3.770 2.814 2.616 3.232 . 0 0 "[ . 1 . 2]" 1
1419 1 79 LEU HG 1 80 ASP H 5.590 . 6.710 4.999 4.840 5.166 . 0 0 "[ . 1 . 2]" 1
1420 1 79 LEU HG 1 85 GLU H 4.970 . 5.960 6.002 5.865 6.041 0.081 3 0 "[ . 1 . 2]" 1
1421 1 79 LEU HG 1 85 GLU HA 3.940 . 4.730 3.784 3.621 3.939 . 0 0 "[ . 1 . 2]" 1
1422 1 79 LEU HG 1 85 GLU QG 3.750 . 4.500 3.914 3.561 4.456 . 0 0 "[ . 1 . 2]" 1
1423 1 79 LEU HG 1 86 TYR H 4.040 . 4.850 4.638 4.189 4.874 0.024 13 0 "[ . 1 . 2]" 1
1424 1 80 ASP H 1 80 ASP HB2 3.950 . 4.740 2.858 2.368 3.718 . 0 0 "[ . 1 . 2]" 1
1425 1 80 ASP H 1 80 ASP HB3 3.950 . 4.740 2.588 2.293 3.602 . 0 0 "[ . 1 . 2]" 1
1426 1 80 ASP H 1 81 SER HA 5.520 . 6.620 5.699 5.317 5.877 . 0 0 "[ . 1 . 2]" 1
1427 1 80 ASP H 1 82 LYS H 4.210 . 5.050 4.752 4.304 5.083 0.033 2 0 "[ . 1 . 2]" 1
1428 1 80 ASP H 1 82 LYS HB2 4.790 . 5.750 5.340 4.762 5.778 0.028 4 0 "[ . 1 . 2]" 1
1429 1 80 ASP H 1 83 GLY H 3.840 . 4.610 3.694 2.975 4.191 . 0 0 "[ . 1 . 2]" 1
1430 1 80 ASP H 1 83 GLY HA3 4.590 . 5.510 5.300 4.513 5.551 0.041 9 0 "[ . 1 . 2]" 1
1431 1 80 ASP H 1 84 LEU H 3.610 . 4.330 2.893 2.257 3.734 . 0 0 "[ . 1 . 2]" 1
1432 1 80 ASP H 1 84 LEU HB2 4.350 . 5.220 3.561 2.881 4.487 . 0 0 "[ . 1 . 2]" 1
1433 1 80 ASP H 1 84 LEU HG 5.640 . 6.770 4.890 4.378 5.828 . 0 0 "[ . 1 . 2]" 1
1434 1 80 ASP H 1 86 TYR QD 5.120 . 6.140 3.577 2.961 4.523 . 0 0 "[ . 1 . 2]" 1
1435 1 80 ASP H 1 86 TYR QE 4.400 . 5.280 2.870 2.117 3.639 . 0 0 "[ . 1 . 2]" 1
1436 1 80 ASP QB 1 82 LYS H 3.960 . 4.750 3.071 2.533 3.717 . 0 0 "[ . 1 . 2]" 1
1437 1 80 ASP QB 1 84 LEU HB2 5.170 . 6.200 3.049 1.869 4.353 . 0 0 "[ . 1 . 2]" 1
1438 1 80 ASP QB 1 84 LEU HG 5.470 . 6.560 3.806 2.591 5.190 . 0 0 "[ . 1 . 2]" 1
1439 1 80 ASP QB 1 86 TYR QE 3.390 . 4.070 1.888 1.764 2.755 0.036 7 0 "[ . 1 . 2]" 1
1440 1 80 ASP HB2 1 86 TYR QE 4.110 . 4.930 2.350 1.769 3.753 0.031 7 0 "[ . 1 . 2]" 1
1441 1 80 ASP HB3 1 86 TYR QE 4.110 . 4.930 2.741 1.785 4.403 0.015 16 0 "[ . 1 . 2]" 1
1442 1 81 SER HA 1 82 LYS HA 4.910 . 5.890 4.740 4.661 4.819 . 0 0 "[ . 1 . 2]" 1
1443 1 81 SER QB 1 82 LYS H 3.940 . 4.730 2.732 2.402 3.054 . 0 0 "[ . 1 . 2]" 1
1444 1 81 SER QB 1 82 LYS HA 4.300 . 5.160 4.030 3.854 4.148 . 0 0 "[ . 1 . 2]" 1
1445 1 81 SER QB 1 82 LYS HG2 4.550 . 5.460 3.416 3.185 3.818 . 0 0 "[ . 1 . 2]" 1
1446 1 81 SER HB2 1 82 LYS HA 5.100 . 6.120 4.464 4.195 4.592 . 0 0 "[ . 1 . 2]" 1
1447 1 81 SER HB3 1 82 LYS HA 5.100 . 6.120 4.592 4.363 4.728 . 0 0 "[ . 1 . 2]" 1
1448 1 82 LYS H 1 82 LYS HB2 2.760 . 3.310 2.410 2.225 2.553 . 0 0 "[ . 1 . 2]" 1
1449 1 82 LYS H 1 82 LYS HD2 5.260 . 6.310 4.765 4.483 5.067 . 0 0 "[ . 1 . 2]" 1
1450 1 82 LYS H 1 82 LYS QD 4.600 . 5.520 3.699 3.337 4.146 . 0 0 "[ . 1 . 2]" 1
1451 1 82 LYS H 1 82 LYS HD3 5.260 . 6.310 3.860 3.442 4.400 . 0 0 "[ . 1 . 2]" 1
1452 1 82 LYS H 1 82 LYS HG2 2.990 . 3.590 2.520 2.183 3.112 . 0 0 "[ . 1 . 2]" 1
1453 1 82 LYS H 1 83 GLY H 2.760 . 3.310 2.606 2.386 2.823 . 0 0 "[ . 1 . 2]" 1
1454 1 82 LYS H 1 83 GLY HA2 4.740 . 5.690 4.869 4.631 5.013 . 0 0 "[ . 1 . 2]" 1
1455 1 82 LYS HA 1 82 LYS HD2 3.590 . 4.310 3.006 2.757 3.264 . 0 0 "[ . 1 . 2]" 1
1456 1 82 LYS HA 1 82 LYS QD 3.130 . 3.760 2.055 1.894 2.196 . 0 0 "[ . 1 . 2]" 1
1457 1 82 LYS HA 1 82 LYS HD3 3.590 . 4.310 2.095 1.916 2.250 . 0 0 "[ . 1 . 2]" 1
1458 1 82 LYS HA 1 82 LYS HG2 3.120 . 3.740 2.986 2.704 3.190 . 0 0 "[ . 1 . 2]" 1
1459 1 82 LYS HA 1 83 GLY HA2 5.280 . 6.340 5.117 5.011 5.209 . 0 0 "[ . 1 . 2]" 1
1460 1 82 LYS HB2 1 83 GLY H 3.300 . 3.960 3.260 2.313 3.945 . 0 0 "[ . 1 . 2]" 1
1461 1 82 LYS HB2 1 83 GLY HA3 5.530 . 6.640 5.071 4.574 5.585 . 0 0 "[ . 1 . 2]" 1
1462 1 82 LYS HB2 1 84 LEU H 3.510 . 4.210 3.403 2.867 4.164 . 0 0 "[ . 1 . 2]" 1
1463 1 82 LYS HB2 1 84 LEU QD 4.080 . 4.900 2.974 2.613 3.478 . 0 0 "[ . 1 . 2]" 1
1464 1 82 LYS HB2 1 84 LEU HG 3.040 . 3.650 2.440 1.833 2.989 . 0 0 "[ . 1 . 2]" 1
1465 1 82 LYS HB3 1 82 LYS QD 2.610 . 3.130 2.377 2.276 2.449 . 0 0 "[ . 1 . 2]" 1
1466 1 82 LYS HB3 1 82 LYS HE2 5.490 . 6.590 4.510 4.215 4.796 . 0 0 "[ . 1 . 2]" 1
1467 1 82 LYS HB3 1 82 LYS QE 4.740 . 5.690 3.977 3.922 4.200 . 0 0 "[ . 1 . 2]" 1
1468 1 82 LYS HB3 1 82 LYS HE3 5.490 . 6.590 4.486 4.229 4.793 . 0 0 "[ . 1 . 2]" 1
1469 1 82 LYS HB3 1 83 GLY HA3 5.940 . 7.130 4.927 4.428 5.298 . 0 0 "[ . 1 . 2]" 1
1470 1 82 LYS HB3 1 84 LEU QD 4.570 . 5.480 3.189 2.740 3.978 . 0 0 "[ . 1 . 2]" 1
1471 1 82 LYS QE 1 82 LYS HG3 3.080 . 3.700 2.437 2.338 2.833 . 0 0 "[ . 1 . 2]" 1
1472 1 82 LYS HE2 1 82 LYS HG3 3.520 . 4.220 2.874 2.453 3.709 . 0 0 "[ . 1 . 2]" 1
1473 1 82 LYS HE3 1 82 LYS HG3 3.520 . 4.220 2.998 2.420 3.721 . 0 0 "[ . 1 . 2]" 1
1474 1 82 LYS HG2 1 83 GLY H 4.480 . 5.380 4.646 4.198 5.086 . 0 0 "[ . 1 . 2]" 1
1475 1 83 GLY H 1 84 LEU H 3.030 . 3.640 2.419 1.943 2.795 . 0 0 "[ . 1 . 2]" 1
1476 1 83 GLY H 1 84 LEU QD 4.350 . 5.220 4.374 3.870 4.739 . 0 0 "[ . 1 . 2]" 1
1477 1 83 GLY H 1 84 LEU HG 4.560 . 5.470 3.915 3.201 4.428 . 0 0 "[ . 1 . 2]" 1
1478 1 83 GLY HA2 1 84 LEU HA 4.800 . 5.760 4.650 4.487 4.778 . 0 0 "[ . 1 . 2]" 1
1479 1 83 GLY HA3 1 84 LEU QD 4.690 . 5.630 4.449 4.240 4.633 . 0 0 "[ . 1 . 2]" 1
1480 1 84 LEU H 1 84 LEU HB2 3.340 . 4.010 2.516 2.477 2.589 . 0 0 "[ . 1 . 2]" 1
1481 1 84 LEU H 1 84 LEU QD 3.510 . 4.210 3.136 2.999 3.420 . 0 0 "[ . 1 . 2]" 1
1482 1 84 LEU H 1 84 LEU HG 3.430 . 4.120 2.445 2.259 2.969 . 0 0 "[ . 1 . 2]" 1
1483 1 84 LEU H 1 85 GLU H 4.540 . 5.450 4.474 4.347 4.561 . 0 0 "[ . 1 . 2]" 1
1484 1 84 LEU H 1 86 TYR QE 4.950 . 5.940 4.280 3.363 4.951 . 0 0 "[ . 1 . 2]" 1
1485 1 84 LEU HA 1 84 LEU QD 2.790 . 3.350 2.043 1.967 2.108 . 0 0 "[ . 1 . 2]" 1
1486 1 84 LEU HA 1 85 GLU H 2.840 . 3.410 2.171 2.144 2.224 . 0 0 "[ . 1 . 2]" 1
1487 1 84 LEU HA 1 85 GLU QG 4.800 . 5.760 3.798 3.588 3.987 . 0 0 "[ . 1 . 2]" 1
1488 1 84 LEU HB2 1 86 TYR QD 5.370 . 6.440 4.242 3.760 4.696 . 0 0 "[ . 1 . 2]" 1
1489 1 84 LEU HB2 1 86 TYR QE 4.120 . 4.940 2.928 2.268 3.478 . 0 0 "[ . 1 . 2]" 1
1490 1 84 LEU HB3 1 85 GLU H 3.880 . 4.660 3.405 3.150 3.738 . 0 0 "[ . 1 . 2]" 1
1491 1 84 LEU HB3 1 86 TYR QD 6.030 . 7.240 4.539 4.132 4.905 . 0 0 "[ . 1 . 2]" 1
1492 1 84 LEU HB3 1 86 TYR QE 4.600 . 5.520 3.633 3.077 4.151 . 0 0 "[ . 1 . 2]" 1
1493 1 84 LEU QD 1 85 GLU H 4.200 . 5.040 3.630 3.433 3.808 . 0 0 "[ . 1 . 2]" 1
1494 1 84 LEU QD 1 86 TYR QE 3.970 . 4.760 3.299 2.914 3.682 . 0 0 "[ . 1 . 2]" 1
1495 1 85 GLU H 1 85 GLU HB2 3.510 . 4.210 2.497 2.405 2.582 . 0 0 "[ . 1 . 2]" 1
1496 1 85 GLU H 1 85 GLU HB3 4.050 . 4.860 3.610 3.579 3.640 . 0 0 "[ . 1 . 2]" 1
1497 1 85 GLU H 1 85 GLU HG2 3.680 . 4.420 3.481 3.297 3.669 . 0 0 "[ . 1 . 2]" 1
1498 1 85 GLU H 1 85 GLU QG 3.170 . 3.800 2.260 2.080 2.421 . 0 0 "[ . 1 . 2]" 1
1499 1 85 GLU H 1 85 GLU HG3 3.680 . 4.420 2.290 2.102 2.457 . 0 0 "[ . 1 . 2]" 1
1500 1 85 GLU H 1 86 TYR H 4.570 . 5.480 4.392 4.181 4.517 . 0 0 "[ . 1 . 2]" 1
1501 1 85 GLU HA 1 85 GLU QG 3.610 . 4.330 2.461 2.403 2.542 . 0 0 "[ . 1 . 2]" 1
1502 1 85 GLU HA 1 86 TYR H 3.230 . 3.880 2.179 2.135 2.229 . 0 0 "[ . 1 . 2]" 1
1503 1 85 GLU HA 1 86 TYR HB2 4.670 . 5.600 4.734 4.597 4.883 . 0 0 "[ . 1 . 2]" 1
1504 1 85 GLU HB2 1 86 TYR H 4.390 . 5.270 4.373 4.224 4.507 . 0 0 "[ . 1 . 2]" 1
1505 1 85 GLU HB2 1 87 PRO HD2 6.070 . 7.280 5.638 5.026 6.488 . 0 0 "[ . 1 . 2]" 1
1506 1 85 GLU HB2 1 87 PRO QD 5.270 . 6.320 3.934 3.403 4.624 . 0 0 "[ . 1 . 2]" 1
1507 1 85 GLU HB2 1 87 PRO HD3 6.070 . 7.280 4.016 3.461 4.734 . 0 0 "[ . 1 . 2]" 1
1508 1 85 GLU HB3 1 86 TYR H 4.210 . 5.050 3.660 3.369 3.944 . 0 0 "[ . 1 . 2]" 1
1509 1 85 GLU HB3 1 87 PRO QD 5.490 . 6.590 3.730 3.117 4.652 . 0 0 "[ . 1 . 2]" 1
1510 1 85 GLU HB3 1 87 PRO HG3 4.950 . 5.940 4.753 3.539 5.918 . 0 0 "[ . 1 . 2]" 1
1511 1 85 GLU QG 1 86 TYR H 4.570 . 5.480 4.316 4.146 4.446 . 0 0 "[ . 1 . 2]" 1
1512 1 86 TYR H 1 86 TYR QD 4.650 . 5.580 2.979 2.554 3.328 . 0 0 "[ . 1 . 2]" 1
1513 1 86 TYR H 1 87 PRO HD2 4.700 . 5.640 4.917 4.577 5.332 . 0 0 "[ . 1 . 2]" 1
1514 1 86 TYR H 1 87 PRO QD 4.120 . 4.940 3.875 3.598 4.131 . 0 0 "[ . 1 . 2]" 1
1515 1 86 TYR H 1 87 PRO HD3 4.700 . 5.640 4.067 3.694 4.359 . 0 0 "[ . 1 . 2]" 1
1516 1 86 TYR H 1 87 PRO HG3 6.210 . 7.450 5.995 5.103 6.563 . 0 0 "[ . 1 . 2]" 1
1517 1 86 TYR HA 1 86 TYR QD 4.240 . 5.090 2.635 2.274 3.004 . 0 0 "[ . 1 . 2]" 1
1518 1 86 TYR HA 1 87 PRO HD2 3.510 . 4.210 2.334 2.054 2.766 . 0 0 "[ . 1 . 2]" 1
1519 1 86 TYR HA 1 87 PRO HD3 3.510 . 4.210 2.310 1.897 2.626 . 0 0 "[ . 1 . 2]" 1
1520 1 86 TYR HA 1 87 PRO HG3 4.630 . 5.560 4.393 4.073 4.564 . 0 0 "[ . 1 . 2]" 1
1521 1 86 TYR QD 1 87 PRO HD2 5.420 . 6.500 4.141 3.592 4.638 . 0 0 "[ . 1 . 2]" 1
1522 1 86 TYR QD 1 87 PRO QD 4.560 . 5.470 3.811 3.434 4.155 . 0 0 "[ . 1 . 2]" 1
1523 1 86 TYR QD 1 87 PRO HD3 5.420 . 6.500 4.559 4.031 5.128 . 0 0 "[ . 1 . 2]" 1
1524 1 87 PRO HA 1 88 ALA H 3.030 . 3.640 2.314 2.184 2.561 . 0 0 "[ . 1 . 2]" 1
1525 1 87 PRO HA 1 88 ALA HA 4.490 . 5.390 4.526 4.439 4.685 . 0 0 "[ . 1 . 2]" 1
1526 1 87 PRO HA 1 88 ALA MB 4.000 . 4.800 4.150 3.915 4.317 . 0 0 "[ . 1 . 2]" 1
1527 1 87 PRO HB2 1 88 ALA H 3.830 . 4.600 4.062 2.982 4.359 . 0 0 "[ . 1 . 2]" 1
1528 1 87 PRO HB3 1 88 ALA H 4.170 . 5.000 4.370 3.740 4.642 . 0 0 "[ . 1 . 2]" 1
1529 1 87 PRO HG2 1 88 ALA H 5.040 . 6.050 5.166 4.609 5.682 . 0 0 "[ . 1 . 2]" 1
1530 1 87 PRO HG2 1 88 ALA HA 5.070 . 6.080 5.350 4.684 6.144 0.064 19 0 "[ . 1 . 2]" 1
1531 1 88 ALA H 1 88 ALA MB 3.030 . 3.640 2.307 2.219 2.669 . 0 0 "[ . 1 . 2]" 1
1532 1 88 ALA H 1 89 VAL H 4.660 . 5.590 4.200 3.858 4.488 . 0 0 "[ . 1 . 2]" 1
1533 1 88 ALA HA 1 89 VAL H 3.330 . 4.000 2.217 2.132 2.313 . 0 0 "[ . 1 . 2]" 1
1534 1 88 ALA HA 1 89 VAL HA 4.620 . 5.540 4.460 4.421 4.513 . 0 0 "[ . 1 . 2]" 1
1535 1 88 ALA HA 1 89 VAL HB 4.810 . 5.770 4.753 4.631 4.893 . 0 0 "[ . 1 . 2]" 1
1536 1 88 ALA HA 1 89 VAL QG 4.210 . 5.050 3.826 3.626 3.950 . 0 0 "[ . 1 . 2]" 1
1537 1 88 ALA MB 1 89 VAL H 3.410 . 4.090 3.492 3.214 3.646 . 0 0 "[ . 1 . 2]" 1
1538 1 88 ALA MB 1 89 VAL HA 4.460 . 5.350 4.299 4.170 4.402 . 0 0 "[ . 1 . 2]" 1
1539 1 88 ALA MB 1 89 VAL HB 5.570 . 6.680 5.499 5.213 5.643 . 0 0 "[ . 1 . 2]" 1
1540 1 88 ALA MB 1 90 VAL HA 6.360 . 7.630 5.362 4.969 5.621 . 0 0 "[ . 1 . 2]" 1
1541 1 89 VAL H 1 89 VAL HB 3.640 . 4.370 2.589 2.501 3.100 . 0 0 "[ . 1 . 2]" 1
1542 1 89 VAL H 1 89 VAL MG1 3.960 . 4.750 3.742 2.089 3.862 . 0 0 "[ . 1 . 2]" 1
1543 1 89 VAL H 1 89 VAL QG 3.190 . 3.830 2.394 2.081 2.615 . 0 0 "[ . 1 . 2]" 1
1544 1 89 VAL H 1 89 VAL MG2 3.960 . 4.750 2.511 2.244 3.885 . 0 0 "[ . 1 . 2]" 1
1545 1 89 VAL H 1 90 VAL H 4.620 . 5.540 4.370 4.124 4.600 . 0 0 "[ . 1 . 2]" 1
1546 1 89 VAL HA 1 89 VAL MG1 3.230 . 3.880 2.449 2.358 3.223 . 0 0 "[ . 1 . 2]" 1
1547 1 89 VAL HA 1 89 VAL QG 2.770 . 3.320 2.156 2.128 2.334 . 0 0 "[ . 1 . 2]" 1
1548 1 89 VAL HA 1 89 VAL MG2 3.230 . 3.880 2.410 2.374 2.453 . 0 0 "[ . 1 . 2]" 1
1549 1 89 VAL HA 1 90 VAL H 3.000 . 3.600 2.195 2.141 2.327 . 0 0 "[ . 1 . 2]" 1
1550 1 89 VAL HA 1 90 VAL HA 4.490 . 5.390 4.426 4.362 4.499 . 0 0 "[ . 1 . 2]" 1
1551 1 89 VAL HB 1 90 VAL H 4.500 . 5.400 4.267 3.829 4.481 . 0 0 "[ . 1 . 2]" 1
1552 1 89 VAL QG 1 90 VAL H 3.140 . 3.770 2.826 2.129 3.336 . 0 0 "[ . 1 . 2]" 1
1553 1 89 VAL QG 1 90 VAL HA 4.380 . 5.260 3.906 3.607 4.111 . 0 0 "[ . 1 . 2]" 1
1554 1 89 VAL QG 1 91 GLU HB3 3.710 . 4.450 3.259 2.695 3.959 . 0 0 "[ . 1 . 2]" 1
1555 1 90 VAL H 1 90 VAL HB 3.560 . 4.270 2.683 2.504 2.940 . 0 0 "[ . 1 . 2]" 1
1556 1 90 VAL H 1 90 VAL QG 3.190 . 3.830 2.134 1.849 2.460 . 0 0 "[ . 1 . 2]" 1
1557 1 90 VAL H 1 91 GLU H 4.430 . 5.320 4.474 4.234 4.613 . 0 0 "[ . 1 . 2]" 1
1558 1 90 VAL HA 1 91 GLU H 3.200 . 3.840 2.192 2.147 2.240 . 0 0 "[ . 1 . 2]" 1
1559 1 90 VAL QG 1 91 GLU H 3.490 . 4.190 2.727 2.352 3.172 . 0 0 "[ . 1 . 2]" 1
1560 1 90 VAL QG 1 92 PHE HA 4.970 . 5.960 4.793 4.351 5.075 . 0 0 "[ . 1 . 2]" 1
1561 1 91 GLU H 1 91 GLU HB3 3.970 . 4.760 3.312 3.038 3.513 . 0 0 "[ . 1 . 2]" 1
1562 1 91 GLU H 1 91 GLU QG 3.830 . 4.600 2.461 2.192 2.605 . 0 0 "[ . 1 . 2]" 1
1563 1 91 GLU H 1 92 PHE H 4.660 . 5.590 4.437 4.364 4.529 . 0 0 "[ . 1 . 2]" 1
1564 1 91 GLU HA 1 91 GLU HG2 3.940 . 4.730 3.797 3.716 3.914 . 0 0 "[ . 1 . 2]" 1
1565 1 91 GLU HA 1 91 GLU QG 3.450 . 4.140 3.354 3.338 3.361 . 0 0 "[ . 1 . 2]" 1
1566 1 91 GLU HA 1 91 GLU HG3 3.940 . 4.730 3.739 3.648 3.829 . 0 0 "[ . 1 . 2]" 1
1567 1 91 GLU HA 1 92 PHE QB 4.570 . 5.480 4.322 4.046 4.700 . 0 0 "[ . 1 . 2]" 1
1568 1 91 GLU HB2 1 92 PHE H 4.470 . 5.360 2.511 2.125 2.938 . 0 0 "[ . 1 . 2]" 1
1569 1 91 GLU HB2 1 92 PHE HA 5.170 . 6.200 4.822 4.666 5.019 . 0 0 "[ . 1 . 2]" 1
1570 1 91 GLU QG 1 92 PHE H 3.900 . 4.680 3.601 3.139 3.976 . 0 0 "[ . 1 . 2]" 1
1571 1 92 PHE H 1 92 PHE HD1 5.350 . 6.420 2.870 1.820 4.861 . 0 0 "[ . 1 . 2]" 1
1572 1 92 PHE H 1 92 PHE HD2 5.580 . 6.700 4.351 2.237 4.930 . 0 0 "[ . 1 . 2]" 1
1573 1 92 PHE H 1 93 ALA H 4.660 . 5.590 4.600 4.472 4.659 . 0 0 "[ . 1 . 2]" 1
1574 1 92 PHE HA 1 92 PHE HD1 4.660 . 5.590 3.674 2.416 4.191 . 0 0 "[ . 1 . 2]" 1
1575 1 92 PHE QB 1 93 ALA H 3.880 . 4.660 2.863 2.364 3.722 . 0 0 "[ . 1 . 2]" 1
1576 1 92 PHE HB2 1 93 ALA H 4.430 . 5.320 3.072 2.388 4.174 . 0 0 "[ . 1 . 2]" 1
1577 1 92 PHE HB3 1 93 ALA H 4.430 . 5.320 3.855 2.891 4.191 . 0 0 "[ . 1 . 2]" 1
1578 1 92 PHE HD1 1 93 ALA H 4.630 . 5.560 4.862 2.636 5.628 0.068 10 0 "[ . 1 . 2]" 1
1579 1 92 PHE HD2 1 93 ALA H 5.110 . 6.130 4.145 3.123 5.921 . 0 0 "[ . 1 . 2]" 1
1580 1 93 ALA HA 1 94 PRO HD2 3.800 . 4.560 2.485 1.926 2.939 . 0 0 "[ . 1 . 2]" 1
1581 1 93 ALA HA 1 94 PRO QD 3.290 . 3.950 2.004 1.809 2.274 . 0 0 "[ . 1 . 2]" 1
1582 1 93 ALA HA 1 94 PRO HD3 3.800 . 4.560 2.231 1.826 2.610 . 0 0 "[ . 1 . 2]" 1
1583 1 93 ALA MB 1 94 PRO QD 4.040 . 4.850 2.431 1.804 3.053 . 0 0 "[ . 1 . 2]" 1
1584 1 94 PRO QB 1 95 PHE H 4.000 . 4.800 3.399 2.439 3.815 . 0 0 "[ . 1 . 2]" 1
1585 1 95 PHE H 1 96 GLN H 4.910 . 5.890 3.848 2.439 4.664 . 0 0 "[ . 1 . 2]" 1
1586 1 95 PHE HA 1 95 PHE HD1 4.650 . 5.580 3.244 2.451 4.235 . 0 0 "[ . 1 . 2]" 1
1587 1 96 GLN H 1 97 LYS H 4.650 . 5.580 4.186 2.696 4.613 . 0 0 "[ . 1 . 2]" 1
1588 1 96 GLN HA 1 96 GLN HE21 4.110 . 4.930 2.599 1.742 4.736 0.058 7 0 "[ . 1 . 2]" 1
1589 1 96 GLN HA 1 96 GLN HE22 4.110 . 4.930 3.356 3.018 4.966 0.036 17 0 "[ . 1 . 2]" 1
1590 1 96 GLN HA 1 96 GLN QG 3.400 . 4.080 2.886 2.424 3.125 . 0 0 "[ . 1 . 2]" 1
1591 1 96 GLN HA 1 97 LYS H 3.000 . 3.600 2.468 2.136 3.572 . 0 0 "[ . 1 . 2]" 1
1592 1 96 GLN HA 1 97 LYS HA 4.420 . 5.300 4.485 4.277 5.340 0.040 20 0 "[ . 1 . 2]" 1
1593 1 96 GLN HA 1 97 LYS QB 4.560 . 5.470 4.232 4.036 4.603 . 0 0 "[ . 1 . 2]" 1
1594 1 96 GLN QB 1 96 GLN QE 3.170 . 3.800 3.183 1.835 3.440 . 0 0 "[ . 1 . 2]" 1
1595 1 96 GLN QB 1 96 GLN QG 2.360 . 2.830 2.001 1.987 2.020 . 0 0 "[ . 1 . 2]" 1
1596 1 96 GLN QB 1 97 LYS H 3.600 . 4.320 2.983 1.836 3.918 . 0 0 "[ . 1 . 2]" 1
1597 1 96 GLN QB 1 97 LYS QB 4.750 . 5.700 4.487 3.466 5.378 . 0 0 "[ . 1 . 2]" 1
1598 1 96 GLN HB2 1 97 LYS H 4.340 . 5.210 3.958 3.302 4.472 . 0 0 "[ . 1 . 2]" 1
1599 1 96 GLN HB3 1 97 LYS H 4.340 . 5.210 3.201 1.845 4.421 . 0 0 "[ . 1 . 2]" 1
1600 1 96 GLN QE 1 97 LYS H 4.460 . 5.350 2.854 1.845 4.102 . 0 0 "[ . 1 . 2]" 1
1601 1 96 GLN QE 1 97 LYS HA 4.770 . 5.720 4.669 3.554 5.844 0.124 10 0 "[ . 1 . 2]" 1
1602 1 96 GLN QE 1 97 LYS QB 4.170 . 5.000 3.699 2.355 5.177 0.177 19 0 "[ . 1 . 2]" 1
1603 1 96 GLN QG 1 97 LYS H 3.990 . 4.790 3.571 1.779 4.466 0.021 2 0 "[ . 1 . 2]" 1
1604 1 97 LYS H 1 97 LYS HB2 3.620 . 4.340 2.646 2.155 3.506 . 0 0 "[ . 1 . 2]" 1
1605 1 97 LYS H 1 97 LYS HB3 3.620 . 4.340 3.007 2.341 3.688 . 0 0 "[ . 1 . 2]" 1
1606 1 97 LYS H 1 97 LYS HG2 5.190 . 6.230 4.235 2.252 5.373 . 0 0 "[ . 1 . 2]" 1
1607 1 97 LYS H 1 97 LYS QG 4.470 . 5.360 3.761 2.231 4.556 . 0 0 "[ . 1 . 2]" 1
1608 1 97 LYS H 1 97 LYS HG3 5.190 . 6.230 4.387 3.611 5.319 . 0 0 "[ . 1 . 2]" 1
1609 1 97 LYS HA 1 97 LYS QD 3.290 . 3.950 2.396 1.970 3.598 . 0 0 "[ . 1 . 2]" 1
1610 1 97 LYS HA 1 97 LYS QE 5.230 . 6.280 3.625 1.760 4.803 0.040 3 0 "[ . 1 . 2]" 1
1611 1 97 LYS HA 1 97 LYS HG2 3.840 . 4.610 3.415 2.422 3.884 . 0 0 "[ . 1 . 2]" 1
1612 1 97 LYS HA 1 97 LYS QG 3.330 . 4.000 2.812 2.276 3.135 . 0 0 "[ . 1 . 2]" 1
1613 1 97 LYS HA 1 97 LYS HG3 3.840 . 4.610 3.246 2.302 3.738 . 0 0 "[ . 1 . 2]" 1
1614 1 97 LYS QB 1 97 LYS QE 4.350 . 5.220 3.025 1.900 3.888 . 0 0 "[ . 1 . 2]" 1
1615 1 97 LYS QE 1 97 LYS QG 3.330 . 4.000 2.371 2.137 2.803 . 0 0 "[ . 1 . 2]" 1
stop_
save_
Contact the webmaster for help, if required. Thursday, May 23, 2024 4:41:14 AM GMT (wattos1)