NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
412962 |
2bzb   |
7350 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2bzb
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 3102
_Distance_constraint_stats_list.Viol_count 5535
_Distance_constraint_stats_list.Viol_total 7667.693
_Distance_constraint_stats_list.Viol_max 0.339
_Distance_constraint_stats_list.Viol_rms 0.0145
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0024
_Distance_constraint_stats_list.Viol_average_violations_only 0.0433
_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 1 MET 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 2 GLU 0.509 0.102 18 0 "[ . 1 . 2 . 3 ]"
1 3 MET 1.530 0.151 11 0 "[ . 1 . 2 . 3 ]"
1 4 GLY 0.329 0.102 18 0 "[ . 1 . 2 . 3 ]"
1 5 GLN 1.777 0.151 11 0 "[ . 1 . 2 . 3 ]"
1 6 LEU 3.556 0.162 7 0 "[ . 1 . 2 . 3 ]"
1 7 LYS 4.607 0.177 31 0 "[ . 1 . 2 . 3 ]"
1 8 ASN 2.121 0.124 29 0 "[ . 1 . 2 . 3 ]"
1 9 LYS 0.832 0.135 9 0 "[ . 1 . 2 . 3 ]"
1 10 ILE 3.106 0.225 31 0 "[ . 1 . 2 . 3 ]"
1 11 GLU 1.174 0.106 30 0 "[ . 1 . 2 . 3 ]"
1 12 ASN 1.963 0.159 8 0 "[ . 1 . 2 . 3 ]"
1 13 LYS 2.426 0.090 19 0 "[ . 1 . 2 . 3 ]"
1 14 LYS 9.438 0.234 22 0 "[ . 1 . 2 . 3 ]"
1 15 LYS 3.558 0.152 13 0 "[ . 1 . 2 . 3 ]"
1 16 GLU 1.891 0.097 19 0 "[ . 1 . 2 . 3 ]"
1 17 LEU 21.225 0.278 30 0 "[ . 1 . 2 . 3 ]"
1 18 ILE 8.796 0.140 23 0 "[ . 1 . 2 . 3 ]"
1 19 GLN 2.403 0.068 13 0 "[ . 1 . 2 . 3 ]"
1 20 LEU 0.757 0.122 18 0 "[ . 1 . 2 . 3 ]"
1 21 VAL 22.979 0.278 30 0 "[ . 1 . 2 . 3 ]"
1 22 ALA 5.871 0.174 8 0 "[ . 1 . 2 . 3 ]"
1 23 ARG 1.137 0.056 19 0 "[ . 1 . 2 . 3 ]"
1 24 HIS 5.078 0.122 23 0 "[ . 1 . 2 . 3 ]"
1 25 GLY 0.728 0.051 31 0 "[ . 1 . 2 . 3 ]"
1 26 LEU 14.510 0.221 20 0 "[ . 1 . 2 . 3 ]"
1 27 ASP 3.111 0.144 3 0 "[ . 1 . 2 . 3 ]"
1 28 HIS 0.770 0.128 20 0 "[ . 1 . 2 . 3 ]"
1 29 ASP 3.610 0.132 2 0 "[ . 1 . 2 . 3 ]"
1 30 LYS 5.352 0.157 17 0 "[ . 1 . 2 . 3 ]"
1 31 VAL 6.762 0.137 23 0 "[ . 1 . 2 . 3 ]"
1 32 LEU 4.982 0.127 28 0 "[ . 1 . 2 . 3 ]"
1 33 LEU 2.618 0.105 2 0 "[ . 1 . 2 . 3 ]"
1 34 PHE 3.550 0.159 17 0 "[ . 1 . 2 . 3 ]"
1 35 SER 0.448 0.140 23 0 "[ . 1 . 2 . 3 ]"
1 36 ARG 4.118 0.113 32 0 "[ . 1 . 2 . 3 ]"
1 37 ASP 3.339 0.155 10 0 "[ . 1 . 2 . 3 ]"
1 38 LEU 4.400 0.189 10 0 "[ . 1 . 2 . 3 ]"
1 39 ASP 0.316 0.052 12 0 "[ . 1 . 2 . 3 ]"
1 40 LYS 3.867 0.196 31 0 "[ . 1 . 2 . 3 ]"
1 41 LEU 3.958 0.174 14 0 "[ . 1 . 2 . 3 ]"
1 42 ILE 2.834 0.138 6 0 "[ . 1 . 2 . 3 ]"
1 43 ASN 2.648 0.113 9 0 "[ . 1 . 2 . 3 ]"
1 44 LYS 3.014 0.113 28 0 "[ . 1 . 2 . 3 ]"
1 45 PHE 3.682 0.150 2 0 "[ . 1 . 2 . 3 ]"
1 46 MET 7.680 0.161 11 0 "[ . 1 . 2 . 3 ]"
1 47 ASN 2.432 0.268 1 0 "[ . 1 . 2 . 3 ]"
1 48 VAL 5.346 0.268 1 0 "[ . 1 . 2 . 3 ]"
1 49 LYS 4.233 0.170 3 0 "[ . 1 . 2 . 3 ]"
1 50 ASP 1.510 0.167 9 0 "[ . 1 . 2 . 3 ]"
1 51 LYS 2.833 0.339 12 0 "[ . 1 . 2 . 3 ]"
1 52 VAL 3.140 0.339 12 0 "[ . 1 . 2 . 3 ]"
1 53 HIS 0.710 0.099 31 0 "[ . 1 . 2 . 3 ]"
1 54 LYS 1.010 0.099 31 0 "[ . 1 . 2 . 3 ]"
1 55 LEU 1.826 0.161 29 0 "[ . 1 . 2 . 3 ]"
1 56 GLU 0.703 0.161 29 0 "[ . 1 . 2 . 3 ]"
1 57 HIS 0.847 0.100 25 0 "[ . 1 . 2 . 3 ]"
1 58 HIS 0.847 0.100 25 0 "[ . 1 . 2 . 3 ]"
2 1 MET 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
2 2 GLU 1.104 0.157 19 0 "[ . 1 . 2 . 3 ]"
2 3 MET 1.744 0.157 19 0 "[ . 1 . 2 . 3 ]"
2 4 GLY 0.190 0.067 6 0 "[ . 1 . 2 . 3 ]"
2 5 GLN 1.664 0.146 31 0 "[ . 1 . 2 . 3 ]"
2 6 LEU 3.268 0.122 23 0 "[ . 1 . 2 . 3 ]"
2 7 LYS 3.172 0.122 23 0 "[ . 1 . 2 . 3 ]"
2 8 ASN 1.180 0.122 23 0 "[ . 1 . 2 . 3 ]"
2 9 LYS 0.831 0.089 4 0 "[ . 1 . 2 . 3 ]"
2 10 ILE 2.150 0.128 4 0 "[ . 1 . 2 . 3 ]"
2 11 GLU 2.040 0.075 2 0 "[ . 1 . 2 . 3 ]"
2 12 ASN 1.116 0.089 4 0 "[ . 1 . 2 . 3 ]"
2 13 LYS 2.648 0.098 10 0 "[ . 1 . 2 . 3 ]"
2 14 LYS 9.398 0.237 25 0 "[ . 1 . 2 . 3 ]"
2 15 LYS 3.605 0.128 10 0 "[ . 1 . 2 . 3 ]"
2 16 GLU 2.163 0.067 18 0 "[ . 1 . 2 . 3 ]"
2 17 LEU 21.204 0.278 31 0 "[ . 1 . 2 . 3 ]"
2 18 ILE 7.740 0.109 23 0 "[ . 1 . 2 . 3 ]"
2 19 GLN 2.253 0.075 8 0 "[ . 1 . 2 . 3 ]"
2 20 LEU 1.602 0.225 31 0 "[ . 1 . 2 . 3 ]"
2 21 VAL 21.873 0.278 31 0 "[ . 1 . 2 . 3 ]"
2 22 ALA 5.179 0.155 30 0 "[ . 1 . 2 . 3 ]"
2 23 ARG 1.390 0.061 5 0 "[ . 1 . 2 . 3 ]"
2 24 HIS 5.963 0.162 7 0 "[ . 1 . 2 . 3 ]"
2 25 GLY 0.360 0.051 2 0 "[ . 1 . 2 . 3 ]"
2 26 LEU 15.790 0.225 18 0 "[ . 1 . 2 . 3 ]"
2 27 ASP 3.391 0.161 21 0 "[ . 1 . 2 . 3 ]"
2 28 HIS 0.717 0.125 18 0 "[ . 1 . 2 . 3 ]"
2 29 ASP 4.244 0.161 21 0 "[ . 1 . 2 . 3 ]"
2 30 LYS 7.915 0.193 5 0 "[ . 1 . 2 . 3 ]"
2 31 VAL 7.747 0.147 15 0 "[ . 1 . 2 . 3 ]"
2 32 LEU 4.719 0.184 32 0 "[ . 1 . 2 . 3 ]"
2 33 LEU 3.077 0.094 27 0 "[ . 1 . 2 . 3 ]"
2 34 PHE 2.860 0.161 29 0 "[ . 1 . 2 . 3 ]"
2 35 SER 0.287 0.040 18 0 "[ . 1 . 2 . 3 ]"
2 36 ARG 3.985 0.184 32 0 "[ . 1 . 2 . 3 ]"
2 37 ASP 3.299 0.118 21 0 "[ . 1 . 2 . 3 ]"
2 38 LEU 4.327 0.174 14 0 "[ . 1 . 2 . 3 ]"
2 39 ASP 0.558 0.074 24 0 "[ . 1 . 2 . 3 ]"
2 40 LYS 4.047 0.203 13 0 "[ . 1 . 2 . 3 ]"
2 41 LEU 5.358 0.189 10 0 "[ . 1 . 2 . 3 ]"
2 42 ILE 2.896 0.121 20 0 "[ . 1 . 2 . 3 ]"
2 43 ASN 2.306 0.100 1 0 "[ . 1 . 2 . 3 ]"
2 44 LYS 2.790 0.097 21 0 "[ . 1 . 2 . 3 ]"
2 45 PHE 4.238 0.130 5 0 "[ . 1 . 2 . 3 ]"
2 46 MET 8.318 0.169 4 0 "[ . 1 . 2 . 3 ]"
2 47 ASN 2.899 0.291 17 0 "[ . 1 . 2 . 3 ]"
2 48 VAL 6.763 0.291 17 0 "[ . 1 . 2 . 3 ]"
2 49 LYS 5.685 0.222 2 0 "[ . 1 . 2 . 3 ]"
2 50 ASP 1.383 0.145 29 0 "[ . 1 . 2 . 3 ]"
2 51 LYS 2.623 0.252 8 0 "[ . 1 . 2 . 3 ]"
2 52 VAL 1.940 0.252 8 0 "[ . 1 . 2 . 3 ]"
2 53 HIS 0.763 0.132 30 0 "[ . 1 . 2 . 3 ]"
2 54 LYS 1.181 0.141 9 0 "[ . 1 . 2 . 3 ]"
2 55 LEU 2.171 0.224 9 0 "[ . 1 . 2 . 3 ]"
2 56 GLU 0.946 0.148 15 0 "[ . 1 . 2 . 3 ]"
2 57 HIS 0.775 0.122 4 0 "[ . 1 . 2 . 3 ]"
2 58 HIS 0.775 0.122 4 0 "[ . 1 . 2 . 3 ]"
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 31 VAL HA 1 34 PHE QD 4.540 . 4.540 3.715 3.401 3.927 . 0 0 "[ . 1 . 2 . 3 ]" 1
2 1 31 VAL HA 1 34 PHE HB3 3.930 . 3.930 2.632 2.406 2.814 . 0 0 "[ . 1 . 2 . 3 ]" 1
3 1 31 VAL HA 1 34 PHE HB2 4.270 . 4.270 3.788 3.453 4.056 . 0 0 "[ . 1 . 2 . 3 ]" 1
4 1 22 ALA MB 1 31 VAL HA 4.440 . 4.440 3.926 3.627 4.249 . 0 0 "[ . 1 . 2 . 3 ]" 1
5 1 31 VAL HA 1 31 VAL MG1 3.180 . 3.180 2.416 2.361 2.459 . 0 0 "[ . 1 . 2 . 3 ]" 1
6 1 31 VAL HA 1 31 VAL MG2 3.180 . 3.180 2.417 2.348 2.511 . 0 0 "[ . 1 . 2 . 3 ]" 1
7 1 21 VAL HA 1 24 HIS HB2 4.450 . 4.450 2.967 2.533 3.223 . 0 0 "[ . 1 . 2 . 3 ]" 1
8 1 18 ILE HA 1 34 PHE HZ 4.480 . 4.480 4.420 4.130 4.541 0.061 23 0 "[ . 1 . 2 . 3 ]" 1
9 1 17 LEU HA 1 18 ILE HA 5.320 . 5.320 4.749 4.698 4.823 . 0 0 "[ . 1 . 2 . 3 ]" 1
10 1 20 LEU HA 1 21 VAL HA 5.500 . 5.500 4.713 4.573 4.841 . 0 0 "[ . 1 . 2 . 3 ]" 1
11 1 20 LEU HB2 1 21 VAL HA 4.810 . 4.810 4.460 4.355 4.830 0.020 18 0 "[ . 1 . 2 . 3 ]" 1
12 1 18 ILE HA 1 22 ALA MB 5.340 . 5.340 4.300 4.051 4.473 . 0 0 "[ . 1 . 2 . 3 ]" 1
13 1 21 VAL HA 1 22 ALA MB 5.500 . 5.500 4.971 4.914 5.016 . 0 0 "[ . 1 . 2 . 3 ]" 1
14 1 10 ILE MD 2 21 VAL HA 3.300 . 3.300 2.224 1.967 2.615 . 0 0 "[ . 1 . 2 . 3 ]" 1
15 1 18 ILE HA 1 34 PHE QE 3.620 . 3.620 2.279 1.920 2.536 . 0 0 "[ . 1 . 2 . 3 ]" 1
16 1 18 ILE HA 1 34 PHE QD 4.110 . 4.110 3.270 2.957 3.621 . 0 0 "[ . 1 . 2 . 3 ]" 1
17 1 15 LYS HA 1 18 ILE HA 5.500 . 5.500 5.002 4.779 5.141 . 0 0 "[ . 1 . 2 . 3 ]" 1
18 1 17 LEU HG 1 18 ILE HA 5.190 . 5.190 4.725 3.306 5.299 0.109 28 0 "[ . 1 . 2 . 3 ]" 1
19 1 17 LEU MD1 1 18 ILE HA 4.580 . 4.580 2.975 2.275 4.675 0.095 25 0 "[ . 1 . 2 . 3 ]" 1
20 1 18 ILE HA 1 18 ILE MG 3.270 . 3.270 2.443 2.296 2.599 . 0 0 "[ . 1 . 2 . 3 ]" 1
21 1 18 ILE HA 1 18 ILE HG12 3.220 . 3.220 2.627 2.577 2.705 . 0 0 "[ . 1 . 2 . 3 ]" 1
22 1 9 LYS HA 1 10 ILE HA 4.890 . 4.890 4.818 4.698 4.891 0.001 22 0 "[ . 1 . 2 . 3 ]" 1
23 1 17 LEU HB2 2 10 ILE HA 4.970 . 4.970 4.860 4.483 5.013 0.043 13 0 "[ . 1 . 2 . 3 ]" 1
24 1 17 LEU HA 2 10 ILE HA 4.630 . 4.630 4.084 3.825 4.350 . 0 0 "[ . 1 . 2 . 3 ]" 1
25 1 7 LYS HA 1 10 ILE HA 5.500 . 5.500 5.069 4.739 5.388 . 0 0 "[ . 1 . 2 . 3 ]" 1
26 1 10 ILE HA 1 14 LYS HB2 5.150 . 5.150 4.512 4.266 4.698 . 0 0 "[ . 1 . 2 . 3 ]" 1
27 1 10 ILE HA 1 10 ILE HG12 3.640 . 3.640 2.439 2.372 2.516 . 0 0 "[ . 1 . 2 . 3 ]" 1
28 1 10 ILE HA 1 10 ILE MD 4.110 . 4.110 3.790 3.740 3.843 . 0 0 "[ . 1 . 2 . 3 ]" 1
29 1 42 ILE HA 1 44 LYS H 4.610 . 4.610 4.174 3.861 4.368 . 0 0 "[ . 1 . 2 . 3 ]" 1
30 1 34 PHE QE 2 42 ILE HA 3.730 . 3.730 2.233 2.018 2.768 . 0 0 "[ . 1 . 2 . 3 ]" 1
31 1 21 VAL MG2 2 42 ILE HA 4.950 . 4.950 4.110 3.305 4.799 . 0 0 "[ . 1 . 2 . 3 ]" 1
32 1 21 VAL MG1 2 42 ILE HA 4.950 . 4.950 3.611 2.784 4.536 . 0 0 "[ . 1 . 2 . 3 ]" 1
33 1 34 PHE HZ 2 42 ILE HA 4.640 . 4.640 3.772 3.467 4.290 . 0 0 "[ . 1 . 2 . 3 ]" 1
34 1 34 PHE QD 2 42 ILE HA 4.340 . 4.340 3.691 3.494 3.945 . 0 0 "[ . 1 . 2 . 3 ]" 1
35 1 42 ILE HA 1 45 PHE HB3 4.820 . 4.820 4.811 4.564 4.868 0.048 2 0 "[ . 1 . 2 . 3 ]" 1
36 1 41 LEU HB3 1 42 ILE HA 4.670 . 4.670 4.306 3.931 4.485 . 0 0 "[ . 1 . 2 . 3 ]" 1
37 1 42 ILE HA 1 44 LYS HB3 5.000 . 5.000 4.640 4.219 4.823 . 0 0 "[ . 1 . 2 . 3 ]" 1
38 1 42 ILE HA 1 42 ILE HG13 4.030 . 4.030 2.975 2.816 3.062 . 0 0 "[ . 1 . 2 . 3 ]" 1
39 1 42 ILE HA 1 42 ILE HG12 3.660 . 3.660 2.451 2.389 2.543 . 0 0 "[ . 1 . 2 . 3 ]" 1
40 1 42 ILE HA 1 42 ILE MG 3.270 . 3.270 2.461 2.399 2.544 . 0 0 "[ . 1 . 2 . 3 ]" 1
41 1 48 VAL HA 1 49 LYS HB3 5.500 . 5.500 5.487 4.573 5.631 0.131 3 0 "[ . 1 . 2 . 3 ]" 1
42 1 48 VAL HA 1 49 LYS HB2 5.500 . 5.500 4.490 4.276 5.477 . 0 0 "[ . 1 . 2 . 3 ]" 1
43 1 48 VAL HA 1 48 VAL MG1 3.270 . 3.270 2.352 2.202 2.484 . 0 0 "[ . 1 . 2 . 3 ]" 1
44 1 18 ILE HG13 1 35 SER HB2 5.500 . 5.500 5.286 4.952 5.640 0.140 23 0 "[ . 1 . 2 . 3 ]" 1
45 1 18 ILE HG13 1 35 SER HB3 5.500 . 5.500 4.635 4.265 4.955 . 0 0 "[ . 1 . 2 . 3 ]" 1
46 1 52 VAL HA 1 53 HIS HA 4.590 . 4.590 4.420 4.221 4.649 0.059 9 0 "[ . 1 . 2 . 3 ]" 1
47 1 34 PHE QD 1 35 SER HA 4.650 . 4.650 3.441 3.215 3.781 . 0 0 "[ . 1 . 2 . 3 ]" 1
48 1 18 ILE MD 1 35 SER HA 3.580 . 3.580 2.660 2.340 3.232 . 0 0 "[ . 1 . 2 . 3 ]" 1
49 1 44 LYS HB3 1 45 PHE HA 4.640 . 4.640 4.246 4.134 4.352 . 0 0 "[ . 1 . 2 . 3 ]" 1
50 1 26 LEU MD1 2 45 PHE HA 4.370 . 4.370 4.203 3.966 4.434 0.064 13 0 "[ . 1 . 2 . 3 ]" 1
51 1 44 LYS HG2 1 45 PHE HA 4.440 . 4.440 3.623 3.346 3.861 . 0 0 "[ . 1 . 2 . 3 ]" 1
52 1 45 PHE HZ 2 34 PHE HA 4.220 . 4.220 3.476 3.113 3.886 . 0 0 "[ . 1 . 2 . 3 ]" 1
53 1 45 PHE QE 2 34 PHE HA 4.240 . 4.240 3.315 3.043 3.663 . 0 0 "[ . 1 . 2 . 3 ]" 1
54 1 34 PHE HA 1 37 ASP HB3 4.470 . 4.470 3.220 2.951 3.511 . 0 0 "[ . 1 . 2 . 3 ]" 1
55 1 33 LEU HB2 1 34 PHE HA 4.920 . 4.920 4.212 4.005 4.362 . 0 0 "[ . 1 . 2 . 3 ]" 1
56 1 41 LEU MD1 2 34 PHE HA 4.630 . 4.630 3.449 2.789 4.547 . 0 0 "[ . 1 . 2 . 3 ]" 1
57 1 14 LYS HA 1 17 LEU HB3 3.940 . 3.940 2.755 2.445 2.967 . 0 0 "[ . 1 . 2 . 3 ]" 1
58 1 14 LYS HA 1 14 LYS HG3 3.970 . 3.970 2.730 2.637 2.898 . 0 0 "[ . 1 . 2 . 3 ]" 1
59 1 17 LEU HB2 2 14 LYS HA 4.360 . 4.360 3.584 3.178 3.978 . 0 0 "[ . 1 . 2 . 3 ]" 1
60 1 14 LYS HA 1 14 LYS HG2 4.130 . 4.130 3.151 3.047 3.236 . 0 0 "[ . 1 . 2 . 3 ]" 1
61 1 17 LEU MD2 2 14 LYS HA 4.350 . 4.350 3.309 2.329 3.947 . 0 0 "[ . 1 . 2 . 3 ]" 1
62 1 14 LYS HA 1 17 LEU HG 5.500 . 5.500 4.606 3.975 5.477 . 0 0 "[ . 1 . 2 . 3 ]" 1
63 1 17 LEU HG 2 14 LYS HA 5.180 . 5.180 3.487 2.743 5.038 . 0 0 "[ . 1 . 2 . 3 ]" 1
64 1 14 LYS HA 1 18 ILE MD 4.720 . 4.720 4.433 4.213 4.639 . 0 0 "[ . 1 . 2 . 3 ]" 1
65 1 15 LYS HA 1 18 ILE HB 3.440 . 3.440 2.529 2.279 2.728 . 0 0 "[ . 1 . 2 . 3 ]" 1
66 1 15 LYS HA 1 15 LYS HG2 3.730 . 3.730 2.592 2.480 2.702 . 0 0 "[ . 1 . 2 . 3 ]" 1
67 1 15 LYS HA 1 15 LYS HG3 3.730 . 3.730 2.818 2.578 3.082 . 0 0 "[ . 1 . 2 . 3 ]" 1
68 1 15 LYS HA 1 18 ILE MG 4.530 . 4.530 3.974 3.737 4.147 . 0 0 "[ . 1 . 2 . 3 ]" 1
69 1 15 LYS HA 1 18 ILE MD 3.380 . 3.380 1.951 1.861 2.039 . 0 0 "[ . 1 . 2 . 3 ]" 1
70 1 22 ALA MB 1 28 HIS HA 5.500 . 5.500 5.082 4.513 5.555 0.055 31 0 "[ . 1 . 2 . 3 ]" 1
71 1 28 HIS HA 1 32 LEU HG 5.500 . 5.500 4.219 3.680 5.462 . 0 0 "[ . 1 . 2 . 3 ]" 1
72 1 28 HIS HA 1 31 VAL MG1 4.710 . 4.710 4.208 3.677 4.728 0.018 31 0 "[ . 1 . 2 . 3 ]" 1
73 1 7 LYS HA 1 46 MET ME 4.800 . 4.800 3.396 2.874 4.839 0.039 27 0 "[ . 1 . 2 . 3 ]" 1
74 1 7 LYS HA 1 10 ILE MG 4.420 . 4.420 3.706 3.432 3.910 . 0 0 "[ . 1 . 2 . 3 ]" 1
75 1 6 LEU HB3 1 7 LYS HA 4.500 . 4.500 4.411 4.326 4.505 0.005 19 0 "[ . 1 . 2 . 3 ]" 1
76 1 7 LYS HA 1 7 LYS HG2 3.940 . 3.940 2.371 2.217 2.495 . 0 0 "[ . 1 . 2 . 3 ]" 1
77 1 7 LYS HA 1 7 LYS HG3 3.920 . 3.920 3.574 3.522 3.645 . 0 0 "[ . 1 . 2 . 3 ]" 1
78 1 7 LYS HA 1 10 ILE MD 3.650 . 3.650 2.319 1.985 2.683 . 0 0 "[ . 1 . 2 . 3 ]" 1
79 1 9 LYS HA 1 13 LYS H 4.730 . 4.730 3.880 3.699 4.021 . 0 0 "[ . 1 . 2 . 3 ]" 1
80 1 9 LYS HA 1 9 LYS HG2 3.950 . 3.950 2.917 2.447 3.285 . 0 0 "[ . 1 . 2 . 3 ]" 1
81 1 9 LYS HA 1 9 LYS HG3 3.950 . 3.950 3.553 2.904 3.829 . 0 0 "[ . 1 . 2 . 3 ]" 1
82 1 9 LYS HA 1 9 LYS HD2 5.100 . 5.100 3.389 2.045 4.700 . 0 0 "[ . 1 . 2 . 3 ]" 1
83 1 9 LYS HA 1 9 LYS HD3 5.100 . 5.100 3.162 1.962 4.468 . 0 0 "[ . 1 . 2 . 3 ]" 1
84 1 11 GLU HA 1 12 ASN HA 4.830 . 4.830 4.784 4.649 4.871 0.041 9 0 "[ . 1 . 2 . 3 ]" 1
85 1 11 GLU HA 1 11 GLU HG3 4.010 . 4.010 3.699 2.991 3.819 . 0 0 "[ . 1 . 2 . 3 ]" 1
86 1 11 GLU HA 1 14 LYS HB2 3.970 . 3.970 3.595 3.188 4.028 0.058 6 0 "[ . 1 . 2 . 3 ]" 1
87 1 11 GLU HA 1 14 LYS HB3 3.500 . 3.500 2.690 2.528 2.828 . 0 0 "[ . 1 . 2 . 3 ]" 1
88 1 16 GLU HA 1 16 GLU HG3 3.900 . 3.900 3.251 2.947 3.796 . 0 0 "[ . 1 . 2 . 3 ]" 1
89 1 13 LYS HG2 2 16 GLU HA 4.590 . 4.590 4.529 4.233 4.656 0.066 25 0 "[ . 1 . 2 . 3 ]" 1
90 1 10 ILE MG 1 11 GLU HA 3.940 . 3.940 3.256 3.098 3.423 . 0 0 "[ . 1 . 2 . 3 ]" 1
91 1 41 LEU HA 1 44 LYS HA 5.500 . 5.500 5.313 5.036 5.544 0.044 14 0 "[ . 1 . 2 . 3 ]" 1
92 1 43 ASN HA 1 44 LYS HA 4.920 . 4.920 4.880 4.802 4.931 0.011 2 0 "[ . 1 . 2 . 3 ]" 1
93 1 43 ASN HB3 1 44 LYS HA 5.130 . 5.130 4.469 4.305 4.662 . 0 0 "[ . 1 . 2 . 3 ]" 1
94 1 44 LYS HA 1 44 LYS HG3 3.630 . 3.630 2.712 2.601 2.835 . 0 0 "[ . 1 . 2 . 3 ]" 1
95 1 44 LYS HA 1 44 LYS HG2 3.960 . 3.960 3.060 2.912 3.223 . 0 0 "[ . 1 . 2 . 3 ]" 1
96 1 18 ILE MG 1 19 GLN HA 4.070 . 4.070 3.530 3.414 3.659 . 0 0 "[ . 1 . 2 . 3 ]" 1
97 1 36 ARG HA 1 36 ARG HD2 5.100 . 5.100 4.753 4.612 4.864 . 0 0 "[ . 1 . 2 . 3 ]" 1
98 1 36 ARG HA 1 36 ARG HD3 5.500 . 5.500 5.215 4.599 5.541 0.041 22 0 "[ . 1 . 2 . 3 ]" 1
99 1 36 ARG HA 1 36 ARG HG3 4.220 . 4.220 3.531 2.826 3.892 . 0 0 "[ . 1 . 2 . 3 ]" 1
100 1 30 LYS HA 1 33 LEU HB2 3.820 . 3.820 2.775 2.459 3.006 . 0 0 "[ . 1 . 2 . 3 ]" 1
101 1 30 LYS HA 1 30 LYS HD2 3.990 . 3.990 3.040 2.775 3.966 . 0 0 "[ . 1 . 2 . 3 ]" 1
102 1 30 LYS HA 1 30 LYS HD3 3.990 . 3.990 2.121 1.876 2.931 . 0 0 "[ . 1 . 2 . 3 ]" 1
103 1 30 LYS HA 1 30 LYS HG3 3.720 . 3.720 3.739 3.698 3.790 0.070 23 0 "[ . 1 . 2 . 3 ]" 1
104 1 41 LEU HA 1 45 PHE QD 4.590 . 4.590 3.858 3.630 4.206 . 0 0 "[ . 1 . 2 . 3 ]" 1
105 1 41 LEU HA 1 44 LYS HB3 4.130 . 4.130 2.812 2.616 3.038 . 0 0 "[ . 1 . 2 . 3 ]" 1
106 1 41 LEU HA 1 44 LYS HB2 3.820 . 3.820 3.107 2.751 3.445 . 0 0 "[ . 1 . 2 . 3 ]" 1
107 1 41 LEU HA 1 41 LEU HG 3.900 . 3.900 3.198 2.608 3.414 . 0 0 "[ . 1 . 2 . 3 ]" 1
108 1 29 ASP HA 1 32 LEU HA 5.500 . 5.500 5.399 5.041 5.557 0.057 14 0 "[ . 1 . 2 . 3 ]" 1
109 1 6 LEU HA 1 10 ILE H 4.810 . 4.810 4.249 4.060 4.547 . 0 0 "[ . 1 . 2 . 3 ]" 1
110 1 20 LEU HA 1 24 HIS H 4.630 . 4.630 4.484 4.155 4.643 0.013 32 0 "[ . 1 . 2 . 3 ]" 1
111 1 23 ARG HA 1 23 ARG HG3 3.790 . 3.790 3.777 3.710 3.831 0.041 19 0 "[ . 1 . 2 . 3 ]" 1
112 1 23 ARG HA 1 23 ARG HG2 3.890 . 3.890 3.736 3.638 3.821 . 0 0 "[ . 1 . 2 . 3 ]" 1
113 1 39 ASP HA 1 42 ILE HB 3.920 . 3.920 2.933 2.489 3.332 . 0 0 "[ . 1 . 2 . 3 ]" 1
114 1 39 ASP HA 1 42 ILE HG13 4.470 . 4.470 3.639 3.195 4.013 . 0 0 "[ . 1 . 2 . 3 ]" 1
115 1 14 LYS HD3 1 39 ASP HA 4.610 . 4.610 3.549 3.264 3.918 . 0 0 "[ . 1 . 2 . 3 ]" 1
116 1 39 ASP HA 1 42 ILE MD 4.000 . 4.000 2.909 2.467 3.357 . 0 0 "[ . 1 . 2 . 3 ]" 1
117 1 38 LEU HG 1 39 ASP HA 5.500 . 5.500 3.628 3.232 5.438 . 0 0 "[ . 1 . 2 . 3 ]" 1
118 1 38 LEU HA 1 42 ILE HG13 5.000 . 5.000 4.064 3.885 4.309 . 0 0 "[ . 1 . 2 . 3 ]" 1
119 1 38 LEU HA 1 41 LEU HB2 4.140 . 4.140 3.360 2.759 3.738 . 0 0 "[ . 1 . 2 . 3 ]" 1
120 1 38 LEU HA 1 42 ILE H 4.580 . 4.580 4.143 3.877 4.460 . 0 0 "[ . 1 . 2 . 3 ]" 1
121 1 38 LEU HA 1 41 LEU HB3 4.030 . 4.030 2.636 2.272 2.983 . 0 0 "[ . 1 . 2 . 3 ]" 1
122 1 5 GLN HA 1 5 GLN HG3 3.880 . 3.880 3.373 2.952 3.844 . 0 0 "[ . 1 . 2 . 3 ]" 1
123 1 37 ASP HA 1 40 LYS HD2 4.830 . 4.830 3.964 2.774 4.876 0.046 5 0 "[ . 1 . 2 . 3 ]" 1
124 1 37 ASP HA 1 40 LYS HD3 4.830 . 4.830 3.471 1.850 4.852 0.022 13 0 "[ . 1 . 2 . 3 ]" 1
125 1 6 LEU HG 2 24 HIS HA 4.430 . 4.430 3.193 2.674 3.710 . 0 0 "[ . 1 . 2 . 3 ]" 1
126 1 6 LEU MD1 2 24 HIS HA 4.150 . 4.150 2.723 2.297 3.184 . 0 0 "[ . 1 . 2 . 3 ]" 1
127 1 13 LYS HA 1 15 LYS H 4.620 . 4.620 4.383 4.285 4.515 . 0 0 "[ . 1 . 2 . 3 ]" 1
128 1 13 LYS HA 1 13 LYS HE2 4.490 . 4.490 3.070 2.438 3.824 . 0 0 "[ . 1 . 2 . 3 ]" 1
129 1 13 LYS HA 1 16 GLU HB3 4.220 . 4.220 4.110 3.659 4.259 0.039 2 0 "[ . 1 . 2 . 3 ]" 1
130 1 13 LYS HA 1 13 LYS HD3 4.370 . 4.370 2.005 1.901 2.072 . 0 0 "[ . 1 . 2 . 3 ]" 1
131 1 3 MET HA 1 4 GLY HA3 5.080 . 5.080 4.766 4.727 4.833 . 0 0 "[ . 1 . 2 . 3 ]" 1
132 1 3 MET HA 1 6 LEU HB2 3.740 . 3.740 2.901 2.382 3.261 . 0 0 "[ . 1 . 2 . 3 ]" 1
133 1 3 MET HA 1 6 LEU HB3 3.970 . 3.970 2.155 1.930 2.647 . 0 0 "[ . 1 . 2 . 3 ]" 1
134 1 3 MET HA 1 6 LEU HA 5.150 . 5.150 4.860 4.617 5.155 0.005 9 0 "[ . 1 . 2 . 3 ]" 1
135 1 43 ASN HA 1 47 ASN H 5.360 . 5.360 3.970 3.538 4.778 . 0 0 "[ . 1 . 2 . 3 ]" 1
136 1 43 ASN HA 1 46 MET HG3 4.640 . 4.640 2.836 2.248 3.793 . 0 0 "[ . 1 . 2 . 3 ]" 1
137 1 48 VAL HB 1 49 LYS HA 4.650 . 4.650 4.620 4.337 4.728 0.078 13 0 "[ . 1 . 2 . 3 ]" 1
138 1 43 ASN HA 1 46 MET HB2 3.700 . 3.700 2.409 2.099 2.603 . 0 0 "[ . 1 . 2 . 3 ]" 1
139 1 8 ASN HA 1 11 GLU HG3 4.680 . 4.680 3.372 2.806 4.087 . 0 0 "[ . 1 . 2 . 3 ]" 1
140 1 7 LYS HB3 1 8 ASN HA 4.260 . 4.260 3.936 3.700 4.150 . 0 0 "[ . 1 . 2 . 3 ]" 1
141 1 12 ASN HA 1 15 LYS HD3 3.860 . 3.860 3.118 2.410 3.847 . 0 0 "[ . 1 . 2 . 3 ]" 1
142 1 24 HIS HD2 2 46 MET HA 5.480 . 5.480 5.152 2.427 5.577 0.097 18 0 "[ . 1 . 2 . 3 ]" 1
143 1 46 MET HA 1 46 MET HG3 4.110 . 4.110 3.464 3.116 3.946 . 0 0 "[ . 1 . 2 . 3 ]" 1
144 1 45 PHE HB2 1 46 MET HA 4.970 . 4.970 4.752 4.581 4.958 . 0 0 "[ . 1 . 2 . 3 ]" 1
145 1 26 LEU HA 1 26 LEU HG 3.860 . 3.860 2.596 2.269 3.152 . 0 0 "[ . 1 . 2 . 3 ]" 1
146 1 26 LEU HA 1 26 LEU MD1 3.880 . 3.880 2.971 2.428 3.811 . 0 0 "[ . 1 . 2 . 3 ]" 1
147 1 4 GLY HA3 1 7 LYS HB3 4.670 . 4.670 3.831 3.415 4.678 0.008 27 0 "[ . 1 . 2 . 3 ]" 1
148 1 26 LEU HB3 1 30 LYS HB2 4.420 . 4.420 2.054 1.810 2.311 . 0 0 "[ . 1 . 2 . 3 ]" 1
149 1 45 PHE QD 2 26 LEU HB3 4.690 . 4.690 4.675 4.337 4.755 0.065 16 0 "[ . 1 . 2 . 3 ]" 1
150 1 22 ALA HA 1 26 LEU HB2 4.140 . 4.140 1.962 1.827 2.163 . 0 0 "[ . 1 . 2 . 3 ]" 1
151 1 26 LEU HB2 1 30 LYS HB3 4.610 . 4.610 4.210 3.874 4.499 . 0 0 "[ . 1 . 2 . 3 ]" 1
152 1 23 ARG H 1 23 ARG HD2 5.500 . 5.500 4.304 3.576 4.827 . 0 0 "[ . 1 . 2 . 3 ]" 1
153 1 23 ARG H 1 23 ARG HD3 5.500 . 5.500 4.628 4.353 4.844 . 0 0 "[ . 1 . 2 . 3 ]" 1
154 1 33 LEU HA 1 36 ARG HD3 3.710 . 3.710 2.515 1.989 3.306 . 0 0 "[ . 1 . 2 . 3 ]" 1
155 1 32 LEU HA 1 36 ARG HD2 4.590 . 4.590 4.596 4.098 4.703 0.113 32 0 "[ . 1 . 2 . 3 ]" 1
156 1 33 LEU MD1 1 36 ARG HD3 5.500 . 5.500 5.294 4.935 5.605 0.105 2 0 "[ . 1 . 2 . 3 ]" 1
157 1 17 LEU HA 1 20 LEU HB2 4.350 . 4.350 2.645 2.276 3.042 . 0 0 "[ . 1 . 2 . 3 ]" 1
158 1 10 ILE HG13 2 20 LEU HB3 3.770 . 3.770 2.573 2.248 2.858 . 0 0 "[ . 1 . 2 . 3 ]" 1
159 1 30 LYS HB2 1 30 LYS HE2 5.500 . 5.500 4.940 4.700 5.514 0.014 24 0 "[ . 1 . 2 . 3 ]" 1
160 1 30 LYS HB2 1 30 LYS HE3 5.500 . 5.500 5.166 4.127 5.503 0.003 9 0 "[ . 1 . 2 . 3 ]" 1
161 1 30 LYS HB3 1 30 LYS HE2 5.500 . 5.500 4.471 4.102 4.879 . 0 0 "[ . 1 . 2 . 3 ]" 1
162 1 30 LYS HB3 1 30 LYS HE3 5.500 . 5.500 4.677 3.510 5.067 . 0 0 "[ . 1 . 2 . 3 ]" 1
163 1 30 LYS HE2 1 30 LYS HG3 4.120 . 4.120 2.909 2.440 4.179 0.059 23 0 "[ . 1 . 2 . 3 ]" 1
164 1 30 LYS HE3 1 30 LYS HG3 4.120 . 4.120 3.393 2.422 3.884 . 0 0 "[ . 1 . 2 . 3 ]" 1
165 1 44 LYS HE2 1 44 LYS HG3 3.630 . 3.630 2.798 2.454 3.655 0.025 28 0 "[ . 1 . 2 . 3 ]" 1
166 1 44 LYS HE3 1 44 LYS HG3 3.630 . 3.630 3.405 3.087 3.704 0.074 5 0 "[ . 1 . 2 . 3 ]" 1
167 1 14 LYS HA 2 17 LEU HB3 4.850 . 4.850 4.474 3.986 4.722 . 0 0 "[ . 1 . 2 . 3 ]" 1
168 1 27 ASP HB3 1 28 HIS H 4.530 . 4.530 2.592 2.001 3.738 . 0 0 "[ . 1 . 2 . 3 ]" 1
169 1 27 ASP HB3 1 29 ASP H 4.250 . 4.250 3.042 2.539 4.382 0.132 2 0 "[ . 1 . 2 . 3 ]" 1
170 1 45 PHE HZ 2 33 LEU HB2 4.110 . 4.110 2.961 2.657 3.396 . 0 0 "[ . 1 . 2 . 3 ]" 1
171 1 45 PHE QE 2 33 LEU HB2 4.590 . 4.590 2.105 1.927 2.377 . 0 0 "[ . 1 . 2 . 3 ]" 1
172 1 33 LEU HB3 1 34 PHE H 4.160 . 4.160 3.559 3.435 3.697 . 0 0 "[ . 1 . 2 . 3 ]" 1
173 1 45 PHE HZ 2 33 LEU HB3 4.250 . 4.250 2.450 2.094 2.893 . 0 0 "[ . 1 . 2 . 3 ]" 1
174 1 45 PHE QE 2 33 LEU HB3 4.330 . 4.330 3.065 2.466 3.457 . 0 0 "[ . 1 . 2 . 3 ]" 1
175 1 30 LYS HA 1 33 LEU HB3 4.860 . 4.860 4.421 4.119 4.697 . 0 0 "[ . 1 . 2 . 3 ]" 1
176 1 6 LEU HB3 1 10 ILE MD 4.630 . 4.630 4.511 4.280 4.649 0.019 24 0 "[ . 1 . 2 . 3 ]" 1
177 1 6 LEU HB3 1 10 ILE HG13 5.500 . 5.500 5.224 4.987 5.506 0.006 31 0 "[ . 1 . 2 . 3 ]" 1
178 1 14 LYS HB3 1 14 LYS HE2 4.240 . 4.240 1.995 1.939 2.071 . 0 0 "[ . 1 . 2 . 3 ]" 1
179 1 11 GLU HA 1 14 LYS HE2 4.230 . 4.230 2.215 1.960 2.512 . 0 0 "[ . 1 . 2 . 3 ]" 1
180 1 14 LYS HB2 1 14 LYS HE2 4.020 . 4.020 3.182 2.890 3.467 . 0 0 "[ . 1 . 2 . 3 ]" 1
181 1 13 LYS HA 1 13 LYS HE3 4.490 . 4.490 3.542 2.741 4.274 . 0 0 "[ . 1 . 2 . 3 ]" 1
182 1 14 LYS HB3 1 14 LYS HE3 3.930 . 3.930 3.176 2.921 3.347 . 0 0 "[ . 1 . 2 . 3 ]" 1
183 1 14 LYS HE3 1 15 LYS HG3 4.740 . 4.740 3.272 2.684 3.595 . 0 0 "[ . 1 . 2 . 3 ]" 1
184 1 14 LYS HE3 1 18 ILE MD 3.960 . 3.960 2.776 2.400 3.269 . 0 0 "[ . 1 . 2 . 3 ]" 1
185 1 11 GLU HA 1 14 LYS HE3 4.300 . 4.300 3.908 3.501 4.244 . 0 0 "[ . 1 . 2 . 3 ]" 1
186 1 14 LYS HE3 1 15 LYS HA 4.680 . 4.680 4.505 3.977 4.735 0.055 7 0 "[ . 1 . 2 . 3 ]" 1
187 1 14 LYS HE3 1 15 LYS HG2 4.740 . 4.740 3.920 3.431 4.528 . 0 0 "[ . 1 . 2 . 3 ]" 1
188 1 14 LYS HE3 1 14 LYS HG2 4.040 . 4.040 2.491 2.416 2.541 . 0 0 "[ . 1 . 2 . 3 ]" 1
189 1 14 LYS HE3 1 38 LEU MD2 5.500 . 5.500 4.201 3.843 4.782 . 0 0 "[ . 1 . 2 . 3 ]" 1
190 1 36 ARG HA 1 39 ASP HB2 3.910 . 3.910 3.386 2.924 3.945 0.035 2 0 "[ . 1 . 2 . 3 ]" 1
191 1 36 ARG HA 1 39 ASP HB3 3.910 . 3.910 2.842 2.400 3.350 . 0 0 "[ . 1 . 2 . 3 ]" 1
192 1 29 ASP H 1 29 ASP HB3 3.610 . 3.610 2.845 2.143 3.635 0.025 7 0 "[ . 1 . 2 . 3 ]" 1
193 1 29 ASP HB3 1 30 LYS H 3.990 . 3.990 3.369 2.427 4.008 0.018 13 0 "[ . 1 . 2 . 3 ]" 1
194 1 26 LEU MD1 2 45 PHE HB3 4.530 . 4.530 2.525 2.069 3.118 . 0 0 "[ . 1 . 2 . 3 ]" 1
195 1 47 ASN HB2 1 47 ASN HD22 4.000 . 4.000 3.702 3.427 4.029 0.029 28 0 "[ . 1 . 2 . 3 ]" 1
196 1 12 ASN H 1 12 ASN HB3 3.280 . 3.280 2.671 2.413 3.439 0.159 8 0 "[ . 1 . 2 . 3 ]" 1
197 1 43 ASN H 1 43 ASN HB3 3.680 . 3.680 3.640 3.585 3.687 0.007 3 0 "[ . 1 . 2 . 3 ]" 1
198 1 40 LYS HA 1 43 ASN HB3 4.810 . 4.810 4.267 3.928 4.819 0.009 3 0 "[ . 1 . 2 . 3 ]" 1
199 1 43 ASN HB3 1 44 LYS HB2 5.500 . 5.500 5.413 5.251 5.536 0.036 25 0 "[ . 1 . 2 . 3 ]" 1
200 1 43 ASN HB3 1 46 MET HB2 4.500 . 4.500 4.405 3.812 4.556 0.056 14 0 "[ . 1 . 2 . 3 ]" 1
201 1 45 PHE QD 2 34 PHE HB2 4.800 . 4.800 3.069 2.805 3.231 . 0 0 "[ . 1 . 2 . 3 ]" 1
202 1 45 PHE HZ 2 34 PHE HB2 5.400 . 5.400 4.252 3.978 4.736 . 0 0 "[ . 1 . 2 . 3 ]" 1
203 1 7 LYS HA 1 10 ILE HB 3.990 . 3.990 2.361 2.080 2.666 . 0 0 "[ . 1 . 2 . 3 ]" 1
204 1 18 ILE HG12 1 34 PHE HB3 5.330 . 5.330 4.823 4.527 5.110 . 0 0 "[ . 1 . 2 . 3 ]" 1
205 1 16 GLU H 1 16 GLU HG2 3.980 . 3.980 3.348 2.238 3.724 . 0 0 "[ . 1 . 2 . 3 ]" 1
206 1 16 GLU HA 1 16 GLU HG2 3.900 . 3.900 2.611 2.449 3.019 . 0 0 "[ . 1 . 2 . 3 ]" 1
207 1 11 GLU H 1 11 GLU HG2 3.790 . 3.790 2.302 2.121 3.481 . 0 0 "[ . 1 . 2 . 3 ]" 1
208 1 8 ASN HA 1 11 GLU HG2 4.680 . 4.680 3.235 2.544 4.725 0.045 28 0 "[ . 1 . 2 . 3 ]" 1
209 1 11 GLU HA 1 11 GLU HG2 4.010 . 4.010 3.038 2.522 3.246 . 0 0 "[ . 1 . 2 . 3 ]" 1
210 1 11 GLU HG2 1 12 ASN H 5.070 . 5.070 4.262 4.087 4.895 . 0 0 "[ . 1 . 2 . 3 ]" 1
211 1 11 GLU HG3 1 12 ASN H 5.070 . 5.070 4.737 4.277 4.884 . 0 0 "[ . 1 . 2 . 3 ]" 1
212 1 19 GLN H 1 19 GLN HG2 3.910 . 3.910 3.469 3.275 3.703 . 0 0 "[ . 1 . 2 . 3 ]" 1
213 1 19 GLN HA 1 19 GLN HG2 3.720 . 3.720 2.569 2.454 2.661 . 0 0 "[ . 1 . 2 . 3 ]" 1
214 1 19 GLN HG2 1 22 ALA MB 4.510 . 4.510 4.327 4.034 4.578 0.068 13 0 "[ . 1 . 2 . 3 ]" 1
215 1 18 ILE MG 1 19 GLN HG2 4.920 . 4.920 4.539 4.249 4.885 . 0 0 "[ . 1 . 2 . 3 ]" 1
216 1 18 ILE HB 1 19 GLN HG2 5.270 . 5.270 4.703 4.344 5.027 . 0 0 "[ . 1 . 2 . 3 ]" 1
217 1 19 GLN HA 1 19 GLN HG3 3.870 . 3.870 2.991 2.810 3.141 . 0 0 "[ . 1 . 2 . 3 ]" 1
218 1 18 ILE MG 1 19 GLN HG3 4.380 . 4.380 4.125 3.928 4.391 0.011 20 0 "[ . 1 . 2 . 3 ]" 1
219 1 5 GLN H 1 5 GLN HG3 4.390 . 4.390 2.892 2.149 4.036 . 0 0 "[ . 1 . 2 . 3 ]" 1
220 1 5 GLN HA 1 5 GLN HG2 3.880 . 3.880 2.928 2.368 3.886 0.006 12 0 "[ . 1 . 2 . 3 ]" 1
221 1 45 PHE QD 2 30 LYS HB2 4.990 . 4.990 4.132 3.839 4.451 . 0 0 "[ . 1 . 2 . 3 ]" 1
222 1 49 LYS H 1 49 LYS HB3 4.010 . 4.010 3.700 3.464 3.950 . 0 0 "[ . 1 . 2 . 3 ]" 1
223 1 51 LYS HB3 1 52 VAL H 4.760 . 4.760 4.420 4.049 4.704 . 0 0 "[ . 1 . 2 . 3 ]" 1
224 1 46 MET HA 1 46 MET HG2 4.110 . 4.110 2.708 2.512 3.075 . 0 0 "[ . 1 . 2 . 3 ]" 1
225 1 10 ILE MD 1 46 MET HG2 5.300 . 5.300 3.822 3.255 4.573 . 0 0 "[ . 1 . 2 . 3 ]" 1
226 1 21 VAL MG2 2 46 MET HG2 5.500 . 5.500 4.143 2.072 4.733 . 0 0 "[ . 1 . 2 . 3 ]" 1
227 1 43 ASN HA 1 46 MET HG2 4.640 . 4.640 4.063 3.238 4.447 . 0 0 "[ . 1 . 2 . 3 ]" 1
228 1 10 ILE MD 1 46 MET HG3 5.300 . 5.300 4.376 3.287 4.997 . 0 0 "[ . 1 . 2 . 3 ]" 1
229 1 21 VAL MG2 2 46 MET HG3 5.500 . 5.500 4.856 3.166 5.546 0.046 16 0 "[ . 1 . 2 . 3 ]" 1
230 1 3 MET HA 1 3 MET HG2 4.050 . 4.050 3.276 2.441 4.192 0.142 13 0 "[ . 1 . 2 . 3 ]" 1
231 1 3 MET ME 1 3 MET HG2 3.700 . 3.700 2.843 2.448 3.422 . 0 0 "[ . 1 . 2 . 3 ]" 1
232 1 3 MET ME 1 3 MET HG3 3.700 . 3.700 2.702 2.432 3.429 . 0 0 "[ . 1 . 2 . 3 ]" 1
233 1 44 LYS HB3 1 45 PHE HB2 4.670 . 4.670 4.145 3.979 4.301 . 0 0 "[ . 1 . 2 . 3 ]" 1
234 1 15 LYS H 1 15 LYS HB2 3.590 . 3.590 2.409 2.258 2.533 . 0 0 "[ . 1 . 2 . 3 ]" 1
235 1 14 LYS HB2 1 14 LYS HE3 4.430 . 4.430 4.212 3.986 4.411 . 0 0 "[ . 1 . 2 . 3 ]" 1
236 1 43 ASN HB2 1 44 LYS HB2 4.700 . 4.700 4.517 4.222 4.727 0.027 18 0 "[ . 1 . 2 . 3 ]" 1
237 1 7 LYS HB3 1 10 ILE H 5.500 . 5.500 5.246 4.938 5.456 . 0 0 "[ . 1 . 2 . 3 ]" 1
238 1 7 LYS HB3 1 8 ASN HB2 5.500 . 5.500 4.696 4.263 5.104 . 0 0 "[ . 1 . 2 . 3 ]" 1
239 1 7 LYS HB3 1 8 ASN HB3 5.500 . 5.500 5.434 5.059 5.624 0.124 29 0 "[ . 1 . 2 . 3 ]" 1
240 1 20 LEU HB2 2 10 ILE HG13 4.600 . 4.600 3.771 3.404 4.089 . 0 0 "[ . 1 . 2 . 3 ]" 1
241 1 9 LYS HB2 1 10 ILE HG13 4.310 . 4.310 3.539 3.060 3.975 . 0 0 "[ . 1 . 2 . 3 ]" 1
242 1 28 HIS HA 1 31 VAL HB 3.740 . 3.740 2.945 2.313 3.586 . 0 0 "[ . 1 . 2 . 3 ]" 1
243 1 10 ILE HA 1 13 LYS HB3 4.390 . 4.390 3.082 2.721 3.410 . 0 0 "[ . 1 . 2 . 3 ]" 1
244 1 34 PHE QE 2 42 ILE HG12 4.710 . 4.710 2.337 2.024 2.841 . 0 0 "[ . 1 . 2 . 3 ]" 1
245 1 34 PHE HZ 2 42 ILE HG12 4.410 . 4.410 2.006 1.894 2.237 . 0 0 "[ . 1 . 2 . 3 ]" 1
246 1 44 LYS HD3 1 45 PHE QD 4.920 . 4.920 4.581 4.230 4.932 0.012 9 0 "[ . 1 . 2 . 3 ]" 1
247 1 11 GLU HA 1 14 LYS HD3 4.380 . 4.380 3.613 3.235 4.113 . 0 0 "[ . 1 . 2 . 3 ]" 1
248 1 15 LYS HD3 1 16 GLU H 5.500 . 5.500 5.199 4.700 5.558 0.058 3 0 "[ . 1 . 2 . 3 ]" 1
249 1 14 LYS HE3 1 15 LYS HD2 4.700 . 4.700 4.648 4.005 4.768 0.068 1 0 "[ . 1 . 2 . 3 ]" 1
250 1 12 ASN H 1 15 LYS HD2 5.500 . 5.500 4.948 3.987 5.528 0.028 19 0 "[ . 1 . 2 . 3 ]" 1
251 1 12 ASN H 1 15 LYS HD3 5.500 . 5.500 4.934 4.188 5.586 0.086 11 0 "[ . 1 . 2 . 3 ]" 1
252 1 15 LYS H 1 15 LYS HD2 4.550 . 4.550 4.166 3.424 4.569 0.019 9 0 "[ . 1 . 2 . 3 ]" 1
253 1 15 LYS H 1 15 LYS HD3 4.810 . 4.810 4.112 3.629 4.605 . 0 0 "[ . 1 . 2 . 3 ]" 1
254 1 11 GLU HA 1 15 LYS HD2 4.550 . 4.550 4.309 3.554 4.656 0.106 30 0 "[ . 1 . 2 . 3 ]" 1
255 1 15 LYS HA 1 15 LYS HD2 4.990 . 4.990 4.698 4.446 4.902 . 0 0 "[ . 1 . 2 . 3 ]" 1
256 1 15 LYS HA 1 15 LYS HD3 5.290 . 5.290 4.575 4.475 4.643 . 0 0 "[ . 1 . 2 . 3 ]" 1
257 1 14 LYS HE2 1 15 LYS HD2 4.420 . 4.420 4.194 3.856 4.447 0.027 12 0 "[ . 1 . 2 . 3 ]" 1
258 1 7 LYS HD2 1 10 ILE MD 5.080 . 5.080 3.266 2.706 4.749 . 0 0 "[ . 1 . 2 . 3 ]" 1
259 1 7 LYS HD3 1 10 ILE MD 5.080 . 5.080 3.703 2.885 4.882 . 0 0 "[ . 1 . 2 . 3 ]" 1
260 1 49 LYS HA 1 49 LYS HD2 5.500 . 5.500 4.550 2.401 4.975 . 0 0 "[ . 1 . 2 . 3 ]" 1
261 1 49 LYS HA 1 49 LYS HD3 5.500 . 5.500 4.403 2.143 4.944 . 0 0 "[ . 1 . 2 . 3 ]" 1
262 1 51 LYS HA 1 51 LYS HD2 5.500 . 5.500 4.962 4.679 5.539 0.039 10 0 "[ . 1 . 2 . 3 ]" 1
263 1 51 LYS HA 1 51 LYS HD3 5.500 . 5.500 4.952 4.437 5.550 0.050 19 0 "[ . 1 . 2 . 3 ]" 1
264 1 5 GLN HB2 1 6 LEU H 4.470 . 4.470 3.030 2.358 4.069 . 0 0 "[ . 1 . 2 . 3 ]" 1
265 1 5 GLN H 1 5 GLN HB2 3.890 . 3.890 2.757 2.386 3.646 . 0 0 "[ . 1 . 2 . 3 ]" 1
266 1 19 GLN HB3 1 20 LEU HA 5.440 . 5.440 4.404 4.211 4.592 . 0 0 "[ . 1 . 2 . 3 ]" 1
267 1 16 GLU HA 1 19 GLN HB2 3.670 . 3.670 3.104 2.782 3.293 . 0 0 "[ . 1 . 2 . 3 ]" 1
268 1 19 GLN HB2 1 20 LEU MD1 5.500 . 5.500 4.686 2.917 5.236 . 0 0 "[ . 1 . 2 . 3 ]" 1
269 1 20 LEU HA 1 23 ARG HG3 4.480 . 4.480 3.307 2.912 3.719 . 0 0 "[ . 1 . 2 . 3 ]" 1
270 1 10 ILE MD 2 23 ARG HG3 4.840 . 4.840 4.766 4.423 4.889 0.049 2 0 "[ . 1 . 2 . 3 ]" 1
271 1 23 ARG H 1 23 ARG HG3 3.990 . 3.990 3.360 3.111 3.593 . 0 0 "[ . 1 . 2 . 3 ]" 1
272 1 20 LEU HA 1 23 ARG HG2 4.500 . 4.500 2.080 1.926 2.287 . 0 0 "[ . 1 . 2 . 3 ]" 1
273 1 41 LEU HG 1 45 PHE QD 5.120 . 5.120 3.531 3.076 4.546 . 0 0 "[ . 1 . 2 . 3 ]" 1
274 1 38 LEU MD1 2 41 LEU HG 5.500 . 5.500 4.538 3.488 5.204 . 0 0 "[ . 1 . 2 . 3 ]" 1
275 1 38 LEU MD2 2 41 LEU HG 5.500 . 5.500 5.191 4.446 5.689 0.189 10 0 "[ . 1 . 2 . 3 ]" 1
276 1 17 LEU HG 1 34 PHE HZ 4.550 . 4.550 4.066 3.443 4.386 . 0 0 "[ . 1 . 2 . 3 ]" 1
277 1 17 LEU HG 1 34 PHE QE 4.540 . 4.540 4.263 3.254 4.614 0.074 5 0 "[ . 1 . 2 . 3 ]" 1
278 1 36 ARG HA 1 36 ARG HG2 4.220 . 4.220 3.331 2.515 3.759 . 0 0 "[ . 1 . 2 . 3 ]" 1
279 1 24 HIS HB2 2 6 LEU HG 4.680 . 4.680 4.156 3.642 4.665 . 0 0 "[ . 1 . 2 . 3 ]" 1
280 1 23 ARG HB2 2 6 LEU HG 5.500 . 5.500 5.199 4.459 5.523 0.023 21 0 "[ . 1 . 2 . 3 ]" 1
281 1 38 LEU H 1 38 LEU MD2 4.310 . 4.310 4.125 4.006 4.191 . 0 0 "[ . 1 . 2 . 3 ]" 1
282 1 34 PHE QE 1 38 LEU MD2 4.510 . 4.510 2.568 2.319 4.348 . 0 0 "[ . 1 . 2 . 3 ]" 1
283 1 34 PHE HZ 1 38 LEU MD2 4.300 . 4.300 2.828 2.384 4.459 0.159 17 0 "[ . 1 . 2 . 3 ]" 1
284 1 38 LEU HA 1 38 LEU MD2 4.270 . 4.270 3.824 3.170 3.971 . 0 0 "[ . 1 . 2 . 3 ]" 1
285 1 14 LYS HG3 1 38 LEU MD2 3.620 . 3.620 2.138 1.941 2.488 . 0 0 "[ . 1 . 2 . 3 ]" 1
286 1 33 LEU HG 1 34 PHE H 5.250 . 5.250 4.264 3.988 4.444 . 0 0 "[ . 1 . 2 . 3 ]" 1
287 1 30 LYS HA 1 33 LEU HG 5.450 . 5.450 3.578 3.133 4.048 . 0 0 "[ . 1 . 2 . 3 ]" 1
288 1 33 LEU H 1 33 LEU HG 4.120 . 4.120 2.234 2.058 2.422 . 0 0 "[ . 1 . 2 . 3 ]" 1
289 1 45 PHE QE 2 33 LEU HG 5.460 . 5.460 4.211 3.632 4.579 . 0 0 "[ . 1 . 2 . 3 ]" 1
290 1 17 LEU MD1 1 18 ILE H 4.580 . 4.580 3.213 2.569 4.474 . 0 0 "[ . 1 . 2 . 3 ]" 1
291 1 17 LEU H 1 17 LEU MD1 5.260 . 5.260 3.966 3.750 4.272 . 0 0 "[ . 1 . 2 . 3 ]" 1
292 1 17 LEU MD1 1 34 PHE HZ 4.410 . 4.410 2.562 1.885 4.104 . 0 0 "[ . 1 . 2 . 3 ]" 1
293 1 17 LEU MD1 1 34 PHE QE 4.810 . 4.810 2.736 2.003 4.550 . 0 0 "[ . 1 . 2 . 3 ]" 1
294 1 14 LYS HA 2 17 LEU MD1 4.350 . 4.350 3.821 2.544 4.402 0.052 17 0 "[ . 1 . 2 . 3 ]" 1
295 1 17 LEU HB3 1 17 LEU MD1 3.510 . 3.510 2.500 2.202 3.167 . 0 0 "[ . 1 . 2 . 3 ]" 1
296 1 19 GLN HB2 1 20 LEU MD2 5.500 . 5.500 3.947 3.011 5.150 . 0 0 "[ . 1 . 2 . 3 ]" 1
297 1 20 LEU HB3 1 20 LEU MD2 3.570 . 3.570 2.477 2.314 3.181 . 0 0 "[ . 1 . 2 . 3 ]" 1
298 1 13 LYS HA 1 13 LYS HD2 4.370 . 4.370 3.599 3.490 3.678 . 0 0 "[ . 1 . 2 . 3 ]" 1
299 1 30 LYS HG2 1 31 VAL H 4.960 . 4.960 4.360 4.080 4.631 . 0 0 "[ . 1 . 2 . 3 ]" 1
300 1 30 LYS HA 1 30 LYS HG2 4.060 . 4.060 3.018 2.807 3.171 . 0 0 "[ . 1 . 2 . 3 ]" 1
301 1 37 ASP HA 2 41 LEU MD1 5.180 . 5.180 4.804 4.008 5.196 0.016 28 0 "[ . 1 . 2 . 3 ]" 1
302 1 34 PHE QE 2 41 LEU MD1 4.280 . 4.280 3.564 1.874 4.055 . 0 0 "[ . 1 . 2 . 3 ]" 1
303 1 34 PHE QD 2 41 LEU MD1 4.190 . 4.190 3.103 2.052 4.303 0.113 5 0 "[ . 1 . 2 . 3 ]" 1
304 1 41 LEU HA 1 41 LEU MD1 3.980 . 3.980 2.383 2.112 3.891 . 0 0 "[ . 1 . 2 . 3 ]" 1
305 1 37 ASP HB3 2 41 LEU MD1 4.030 . 4.030 2.544 2.210 2.891 . 0 0 "[ . 1 . 2 . 3 ]" 1
306 1 37 ASP HB2 2 41 LEU MD1 4.030 . 4.030 3.714 3.178 4.095 0.065 10 0 "[ . 1 . 2 . 3 ]" 1
307 1 41 LEU HB2 1 41 LEU MD1 3.320 . 3.320 2.402 2.252 2.485 . 0 0 "[ . 1 . 2 . 3 ]" 1
308 1 7 LYS HG2 1 10 ILE MG 4.980 . 4.980 4.482 3.614 4.983 0.003 17 0 "[ . 1 . 2 . 3 ]" 1
309 1 40 LYS H 1 40 LYS HG3 4.320 . 4.320 2.964 2.262 4.346 0.026 6 0 "[ . 1 . 2 . 3 ]" 1
310 1 7 LYS HG3 1 10 ILE MD 4.960 . 4.960 4.489 3.965 4.938 . 0 0 "[ . 1 . 2 . 3 ]" 1
311 1 38 LEU H 2 41 LEU MD2 4.390 . 4.390 3.019 2.429 4.278 . 0 0 "[ . 1 . 2 . 3 ]" 1
312 1 37 ASP H 2 41 LEU MD2 4.980 . 4.980 4.412 3.974 5.005 0.025 20 0 "[ . 1 . 2 . 3 ]" 1
313 1 41 LEU MD2 1 42 ILE H 4.440 . 4.440 4.214 3.395 4.445 0.005 29 0 "[ . 1 . 2 . 3 ]" 1
314 1 34 PHE QE 2 41 LEU MD2 4.280 . 4.280 3.147 2.024 4.400 0.120 20 0 "[ . 1 . 2 . 3 ]" 1
315 1 34 PHE QD 2 41 LEU MD2 4.190 . 4.190 3.272 1.780 4.078 . 0 0 "[ . 1 . 2 . 3 ]" 1
316 1 37 ASP HA 2 41 LEU MD2 5.180 . 5.180 4.523 4.243 5.211 0.031 19 0 "[ . 1 . 2 . 3 ]" 1
317 1 41 LEU HA 1 41 LEU MD2 3.980 . 3.980 3.756 2.534 3.960 . 0 0 "[ . 1 . 2 . 3 ]" 1
318 1 34 PHE HA 2 41 LEU MD2 4.630 . 4.630 3.593 2.491 4.516 . 0 0 "[ . 1 . 2 . 3 ]" 1
319 1 37 ASP HB3 2 41 LEU MD2 4.030 . 4.030 2.485 2.232 2.657 . 0 0 "[ . 1 . 2 . 3 ]" 1
320 1 37 ASP HB2 2 41 LEU MD2 4.030 . 4.030 3.957 3.485 4.086 0.056 15 0 "[ . 1 . 2 . 3 ]" 1
321 1 41 LEU HB2 1 41 LEU MD2 3.320 . 3.320 2.463 2.196 3.210 . 0 0 "[ . 1 . 2 . 3 ]" 1
322 1 33 LEU H 1 33 LEU MD1 4.230 . 4.230 3.554 3.465 3.694 . 0 0 "[ . 1 . 2 . 3 ]" 1
323 1 45 PHE QE 2 33 LEU MD1 4.820 . 4.820 2.980 2.371 4.593 . 0 0 "[ . 1 . 2 . 3 ]" 1
324 1 33 LEU HA 1 33 LEU MD1 3.900 . 3.900 3.873 3.798 3.904 0.004 11 0 "[ . 1 . 2 . 3 ]" 1
325 1 6 LEU MD1 1 7 LYS H 4.840 . 4.840 3.066 2.819 3.232 . 0 0 "[ . 1 . 2 . 3 ]" 1
326 1 6 LEU H 1 6 LEU MD1 4.420 . 4.420 4.125 3.980 4.216 . 0 0 "[ . 1 . 2 . 3 ]" 1
327 1 45 PHE QD 2 26 LEU MD1 3.820 . 3.820 3.230 2.519 3.866 0.046 2 0 "[ . 1 . 2 . 3 ]" 1
328 1 26 LEU H 1 26 LEU MD1 4.290 . 4.290 2.737 1.992 4.117 . 0 0 "[ . 1 . 2 . 3 ]" 1
329 1 55 LEU HA 1 55 LEU MD1 4.280 . 4.280 3.623 2.058 4.129 . 0 0 "[ . 1 . 2 . 3 ]" 1
330 1 24 HIS HB3 1 26 LEU MD1 4.620 . 4.620 3.258 2.531 4.650 0.030 24 0 "[ . 1 . 2 . 3 ]" 1
331 1 45 PHE HB2 2 26 LEU MD1 4.510 . 4.510 3.477 3.095 4.214 . 0 0 "[ . 1 . 2 . 3 ]" 1
332 1 26 LEU MD1 1 30 LYS HB2 4.520 . 4.520 3.961 2.748 4.527 0.007 6 0 "[ . 1 . 2 . 3 ]" 1
333 1 14 LYS HG3 1 18 ILE MD 3.420 . 3.420 3.403 3.228 3.455 0.035 23 0 "[ . 1 . 2 . 3 ]" 1
334 1 13 LYS HG2 1 14 LYS H 5.150 . 5.150 4.846 4.624 5.034 . 0 0 "[ . 1 . 2 . 3 ]" 1
335 1 14 LYS H 1 14 LYS HG3 5.430 . 5.430 4.398 4.294 4.518 . 0 0 "[ . 1 . 2 . 3 ]" 1
336 1 13 LYS HA 2 13 LYS HG2 5.070 . 5.070 4.940 4.618 5.096 0.026 24 0 "[ . 1 . 2 . 3 ]" 1
337 1 17 LEU HA 2 13 LYS HG2 4.500 . 4.500 2.466 2.143 2.986 . 0 0 "[ . 1 . 2 . 3 ]" 1
338 1 14 LYS HG3 1 42 ILE MD 3.300 . 3.300 2.551 2.288 2.899 . 0 0 "[ . 1 . 2 . 3 ]" 1
339 1 22 ALA H 1 31 VAL MG1 5.060 . 5.060 4.466 3.980 4.782 . 0 0 "[ . 1 . 2 . 3 ]" 1
340 1 31 VAL MG1 1 32 LEU H 4.060 . 4.060 3.514 3.366 3.625 . 0 0 "[ . 1 . 2 . 3 ]" 1
341 1 17 LEU HB3 1 17 LEU MD2 3.510 . 3.510 2.905 2.089 3.227 . 0 0 "[ . 1 . 2 . 3 ]" 1
342 1 14 LYS H 2 17 LEU MD2 5.500 . 5.500 3.378 2.876 4.404 . 0 0 "[ . 1 . 2 . 3 ]" 1
343 1 17 LEU MD2 1 18 ILE H 4.580 . 4.580 3.912 3.357 4.130 . 0 0 "[ . 1 . 2 . 3 ]" 1
344 1 17 LEU MD2 1 34 PHE HZ 4.410 . 4.410 3.289 2.192 3.776 . 0 0 "[ . 1 . 2 . 3 ]" 1
345 1 24 HIS HA 2 6 LEU MD2 4.150 . 4.150 3.935 3.449 4.189 0.039 8 0 "[ . 1 . 2 . 3 ]" 1
346 1 17 LEU MD2 1 18 ILE HA 4.580 . 4.580 3.880 3.579 4.066 . 0 0 "[ . 1 . 2 . 3 ]" 1
347 1 22 ALA MB 1 31 VAL MG1 3.180 . 3.180 2.493 2.283 2.777 . 0 0 "[ . 1 . 2 . 3 ]" 1
348 1 17 LEU MD2 1 21 VAL MG1 4.350 . 4.350 3.292 2.027 4.408 0.058 13 0 "[ . 1 . 2 . 3 ]" 1
349 1 29 ASP HA 1 32 LEU MD2 4.640 . 4.640 4.387 1.916 4.676 0.036 7 0 "[ . 1 . 2 . 3 ]" 1
350 1 32 LEU HA 1 32 LEU MD2 3.790 . 3.790 2.135 2.034 3.917 0.127 28 0 "[ . 1 . 2 . 3 ]" 1
351 1 21 VAL MG2 1 22 ALA H 3.900 . 3.900 3.148 2.276 3.761 . 0 0 "[ . 1 . 2 . 3 ]" 1
352 1 21 VAL H 1 21 VAL MG2 3.890 . 3.890 2.282 1.791 3.808 . 0 0 "[ . 1 . 2 . 3 ]" 1
353 1 21 VAL MG2 1 34 PHE QE 4.220 . 4.220 2.774 2.383 3.788 . 0 0 "[ . 1 . 2 . 3 ]" 1
354 1 21 VAL MG2 1 34 PHE HZ 4.670 . 4.670 3.009 2.197 4.004 . 0 0 "[ . 1 . 2 . 3 ]" 1
355 1 21 VAL MG2 1 34 PHE QD 4.220 . 4.220 3.522 2.740 4.242 0.022 26 0 "[ . 1 . 2 . 3 ]" 1
356 1 46 MET ME 2 21 VAL MG2 4.560 . 4.560 4.326 2.315 4.701 0.141 28 0 "[ . 1 . 2 . 3 ]" 1
357 1 19 GLN HB3 1 22 ALA MB 4.550 . 4.550 4.190 3.943 4.549 . 0 0 "[ . 1 . 2 . 3 ]" 1
358 1 22 ALA MB 1 23 ARG HA 3.950 . 3.950 3.783 3.705 3.858 . 0 0 "[ . 1 . 2 . 3 ]" 1
359 1 19 GLN HA 1 22 ALA MB 3.120 . 3.120 2.386 2.188 2.639 . 0 0 "[ . 1 . 2 . 3 ]" 1
360 1 19 GLN HG3 1 22 ALA MB 5.250 . 5.250 4.838 4.558 5.129 . 0 0 "[ . 1 . 2 . 3 ]" 1
361 1 22 ALA MB 1 31 VAL HB 4.120 . 4.120 4.162 4.077 4.215 0.095 4 0 "[ . 1 . 2 . 3 ]" 1
362 1 22 ALA MB 1 23 ARG HB2 5.200 . 5.200 5.111 4.995 5.226 0.026 4 0 "[ . 1 . 2 . 3 ]" 1
363 1 22 ALA MB 1 23 ARG HB3 4.130 . 4.130 3.907 3.757 4.081 . 0 0 "[ . 1 . 2 . 3 ]" 1
364 1 22 ALA MB 1 31 VAL MG2 3.180 . 3.180 2.020 1.919 2.171 . 0 0 "[ . 1 . 2 . 3 ]" 1
365 1 21 VAL MG2 1 22 ALA MB 4.740 . 4.740 4.073 3.012 4.840 0.100 16 0 "[ . 1 . 2 . 3 ]" 1
366 1 21 VAL MG1 1 22 ALA MB 4.740 . 4.740 4.480 3.471 4.914 0.174 8 0 "[ . 1 . 2 . 3 ]" 1
367 1 42 ILE MG 1 43 ASN HB3 5.480 . 5.480 5.337 5.152 5.497 0.017 6 0 "[ . 1 . 2 . 3 ]" 1
368 1 42 ILE MG 1 43 ASN H 3.560 . 3.560 3.171 3.040 3.362 . 0 0 "[ . 1 . 2 . 3 ]" 1
369 1 42 ILE MG 1 44 LYS H 4.860 . 4.860 4.783 4.705 4.863 0.003 27 0 "[ . 1 . 2 . 3 ]" 1
370 1 34 PHE HZ 2 42 ILE MG 4.420 . 4.420 3.671 3.269 3.994 . 0 0 "[ . 1 . 2 . 3 ]" 1
371 1 42 ILE MG 1 46 MET HA 5.120 . 5.120 4.837 4.583 5.012 . 0 0 "[ . 1 . 2 . 3 ]" 1
372 1 42 ILE MG 1 43 ASN HA 4.020 . 4.020 3.362 3.197 3.540 . 0 0 "[ . 1 . 2 . 3 ]" 1
373 1 39 ASP HA 1 42 ILE MG 4.680 . 4.680 4.270 3.935 4.622 . 0 0 "[ . 1 . 2 . 3 ]" 1
374 1 42 ILE MG 1 45 PHE HB2 4.460 . 4.460 4.283 3.948 4.481 0.021 14 0 "[ . 1 . 2 . 3 ]" 1
375 1 42 ILE MG 1 46 MET HG2 3.730 . 3.730 2.704 2.108 2.981 . 0 0 "[ . 1 . 2 . 3 ]" 1
376 1 42 ILE MG 1 46 MET HG3 3.730 . 3.730 2.211 1.971 2.458 . 0 0 "[ . 1 . 2 . 3 ]" 1
377 1 42 ILE MG 1 46 MET ME 3.790 . 3.790 3.381 2.753 3.725 . 0 0 "[ . 1 . 2 . 3 ]" 1
378 1 14 LYS HD3 1 42 ILE MG 4.300 . 4.300 3.712 3.291 4.206 . 0 0 "[ . 1 . 2 . 3 ]" 1
379 1 18 ILE MG 1 34 PHE QE 4.190 . 4.190 3.243 2.899 3.785 . 0 0 "[ . 1 . 2 . 3 ]" 1
380 1 18 ILE MG 1 34 PHE QD 3.860 . 3.860 2.161 1.947 3.017 . 0 0 "[ . 1 . 2 . 3 ]" 1
381 1 18 ILE MG 1 31 VAL HA 4.460 . 4.460 3.426 3.305 3.712 . 0 0 "[ . 1 . 2 . 3 ]" 1
382 1 18 ILE MG 1 31 VAL HB 4.460 . 4.460 4.474 4.352 4.529 0.069 24 0 "[ . 1 . 2 . 3 ]" 1
383 1 18 ILE MG 1 22 ALA MB 3.490 . 3.490 2.847 2.471 3.003 . 0 0 "[ . 1 . 2 . 3 ]" 1
384 1 18 ILE MG 1 31 VAL H 5.500 . 5.500 5.541 5.456 5.637 0.137 23 0 "[ . 1 . 2 . 3 ]" 1
385 1 21 VAL HA 2 10 ILE MG 4.600 . 4.600 3.903 3.348 4.335 . 0 0 "[ . 1 . 2 . 3 ]" 1
386 1 10 ILE MG 1 14 LYS HE2 4.940 . 4.940 4.196 3.579 4.785 . 0 0 "[ . 1 . 2 . 3 ]" 1
387 1 10 ILE MG 1 11 GLU HB3 5.290 . 5.290 5.209 5.094 5.303 0.013 19 0 "[ . 1 . 2 . 3 ]" 1
388 1 10 ILE MG 1 11 GLU HB2 5.290 . 5.290 4.946 4.798 5.111 . 0 0 "[ . 1 . 2 . 3 ]" 1
389 1 10 ILE MG 1 14 LYS HB2 3.690 . 3.690 3.203 2.920 3.421 . 0 0 "[ . 1 . 2 . 3 ]" 1
390 1 10 ILE HG12 1 10 ILE MG 3.730 . 3.730 2.409 2.263 2.459 . 0 0 "[ . 1 . 2 . 3 ]" 1
391 1 7 LYS HD2 1 10 ILE MG 5.500 . 5.500 3.264 2.768 4.771 . 0 0 "[ . 1 . 2 . 3 ]" 1
392 1 7 LYS HD3 1 10 ILE MG 5.500 . 5.500 3.835 3.270 4.764 . 0 0 "[ . 1 . 2 . 3 ]" 1
393 1 17 LEU HG 2 10 ILE MG 5.500 . 5.500 3.938 3.396 4.385 . 0 0 "[ . 1 . 2 . 3 ]" 1
394 1 10 ILE MG 1 14 LYS HD3 4.210 . 4.210 3.364 3.058 3.627 . 0 0 "[ . 1 . 2 . 3 ]" 1
395 1 10 ILE H 1 10 ILE MG 3.830 . 3.830 3.771 3.713 3.805 . 0 0 "[ . 1 . 2 . 3 ]" 1
396 1 10 ILE HA 1 10 ILE MG 3.490 . 3.490 2.551 2.481 2.611 . 0 0 "[ . 1 . 2 . 3 ]" 1
397 1 10 ILE MG 1 46 MET ME 3.730 . 3.730 3.326 2.595 3.779 0.049 18 0 "[ . 1 . 2 . 3 ]" 1
398 1 46 MET ME 1 47 ASN H 5.500 . 5.500 5.311 4.711 5.581 0.081 21 0 "[ . 1 . 2 . 3 ]" 1
399 1 24 HIS HD2 2 46 MET ME 4.210 . 4.210 2.805 2.443 3.620 . 0 0 "[ . 1 . 2 . 3 ]" 1
400 1 24 HIS HA 2 46 MET ME 5.000 . 5.000 4.713 4.202 5.019 0.019 10 0 "[ . 1 . 2 . 3 ]" 1
401 1 21 VAL HA 2 46 MET ME 4.200 . 4.200 3.368 2.242 4.252 0.052 9 0 "[ . 1 . 2 . 3 ]" 1
402 1 24 HIS HB3 2 46 MET ME 4.150 . 4.150 3.420 2.140 4.150 . 0 0 "[ . 1 . 2 . 3 ]" 1
403 1 24 HIS HB2 2 46 MET ME 3.640 . 3.640 2.992 2.227 3.466 . 0 0 "[ . 1 . 2 . 3 ]" 1
404 1 10 ILE MD 1 46 MET ME 2.990 . 2.990 2.135 1.879 2.538 . 0 0 "[ . 1 . 2 . 3 ]" 1
405 1 21 VAL MG1 2 46 MET ME 4.560 . 4.560 3.466 1.820 4.729 0.169 4 0 "[ . 1 . 2 . 3 ]" 1
406 1 17 LEU H 1 18 ILE MD 4.950 . 4.950 4.993 4.969 5.012 0.062 20 0 "[ . 1 . 2 . 3 ]" 1
407 1 18 ILE MD 1 39 ASP H 5.100 . 5.100 4.829 4.510 5.128 0.028 20 0 "[ . 1 . 2 . 3 ]" 1
408 1 18 ILE MD 1 34 PHE QE 4.540 . 4.540 3.982 3.722 4.309 . 0 0 "[ . 1 . 2 . 3 ]" 1
409 1 18 ILE MD 1 34 PHE QD 4.340 . 4.340 3.812 3.555 4.250 . 0 0 "[ . 1 . 2 . 3 ]" 1
410 1 14 LYS HE2 1 18 ILE MD 4.750 . 4.750 3.814 3.452 4.317 . 0 0 "[ . 1 . 2 . 3 ]" 1
411 1 18 ILE HB 1 18 ILE MD 3.380 . 3.380 2.357 2.323 2.388 . 0 0 "[ . 1 . 2 . 3 ]" 1
412 1 39 ASP H 1 42 ILE MD 5.380 . 5.380 4.645 4.429 4.946 . 0 0 "[ . 1 . 2 . 3 ]" 1
413 1 34 PHE HZ 2 42 ILE MD 4.090 . 4.090 2.861 2.509 3.121 . 0 0 "[ . 1 . 2 . 3 ]" 1
414 1 14 LYS HA 1 42 ILE MD 4.570 . 4.570 4.023 3.691 4.413 . 0 0 "[ . 1 . 2 . 3 ]" 1
415 1 14 LYS HE3 1 42 ILE MD 4.670 . 4.670 4.309 4.161 4.445 . 0 0 "[ . 1 . 2 . 3 ]" 1
416 1 41 LEU HB3 1 42 ILE MD 4.960 . 4.960 4.657 4.232 4.960 . 0 0 "[ . 1 . 2 . 3 ]" 1
417 1 42 ILE H 1 42 ILE MD 3.910 . 3.910 3.673 3.571 3.764 . 0 0 "[ . 1 . 2 . 3 ]" 1
418 1 42 ILE HA 1 42 ILE MD 3.960 . 3.960 3.793 3.750 3.848 . 0 0 "[ . 1 . 2 . 3 ]" 1
419 1 14 LYS HE2 1 42 ILE MD 4.570 . 4.570 4.055 3.776 4.296 . 0 0 "[ . 1 . 2 . 3 ]" 1
420 1 42 ILE HB 1 42 ILE MD 3.460 . 3.460 2.444 2.379 2.485 . 0 0 "[ . 1 . 2 . 3 ]" 1
421 1 14 LYS HD2 1 42 ILE MD 3.920 . 3.920 2.485 2.248 2.886 . 0 0 "[ . 1 . 2 . 3 ]" 1
422 1 17 LEU HG 2 42 ILE MD 4.450 . 4.450 3.136 2.649 3.639 . 0 0 "[ . 1 . 2 . 3 ]" 1
423 1 14 LYS HD3 1 42 ILE MD 3.480 . 3.480 1.937 1.802 2.209 . 0 0 "[ . 1 . 2 . 3 ]" 1
424 1 38 LEU HG 1 42 ILE MD 3.950 . 3.950 2.783 2.459 3.986 0.036 17 0 "[ . 1 . 2 . 3 ]" 1
425 1 7 LYS H 1 10 ILE MD 4.570 . 4.570 4.245 4.011 4.466 . 0 0 "[ . 1 . 2 . 3 ]" 1
426 1 21 VAL H 2 10 ILE MD 4.540 . 4.540 3.597 3.218 3.913 . 0 0 "[ . 1 . 2 . 3 ]" 1
427 1 24 HIS HB3 2 10 ILE MD 4.540 . 4.540 3.648 3.164 4.131 . 0 0 "[ . 1 . 2 . 3 ]" 1
428 1 24 HIS HB2 2 10 ILE MD 4.710 . 4.710 2.577 1.970 3.176 . 0 0 "[ . 1 . 2 . 3 ]" 1
429 1 20 LEU HB2 2 10 ILE MD 4.740 . 4.740 3.848 3.461 4.382 . 0 0 "[ . 1 . 2 . 3 ]" 1
430 1 10 ILE HB 1 10 ILE MD 3.400 . 3.400 2.454 2.405 2.484 . 0 0 "[ . 1 . 2 . 3 ]" 1
431 1 20 LEU HB3 2 10 ILE MD 4.070 . 4.070 3.131 2.701 3.482 . 0 0 "[ . 1 . 2 . 3 ]" 1
432 1 20 LEU HA 2 10 ILE MD 4.710 . 4.710 4.294 3.961 4.526 . 0 0 "[ . 1 . 2 . 3 ]" 1
433 1 40 LYS HA 1 40 LYS HG3 3.920 . 3.920 3.007 2.383 3.758 . 0 0 "[ . 1 . 2 . 3 ]" 1
434 1 40 LYS HA 1 43 ASN HB2 3.640 . 3.640 2.632 2.303 3.131 . 0 0 "[ . 1 . 2 . 3 ]" 1
435 1 40 LYS HA 1 40 LYS HG2 3.920 . 3.920 2.964 2.377 3.945 0.025 17 0 "[ . 1 . 2 . 3 ]" 1
436 1 52 VAL H 1 52 VAL MG1 3.570 . 3.570 2.605 2.167 3.250 . 0 0 "[ . 1 . 2 . 3 ]" 1
437 1 48 VAL HA 1 48 VAL MG2 3.270 . 3.270 2.943 2.443 3.245 . 0 0 "[ . 1 . 2 . 3 ]" 1
438 1 52 VAL HA 1 52 VAL MG1 3.610 . 3.610 2.373 2.211 3.237 . 0 0 "[ . 1 . 2 . 3 ]" 1
439 1 21 VAL MG1 1 22 ALA H 3.900 . 3.900 3.595 2.463 3.844 . 0 0 "[ . 1 . 2 . 3 ]" 1
440 1 21 VAL H 1 21 VAL MG1 3.890 . 3.890 2.809 1.800 3.796 . 0 0 "[ . 1 . 2 . 3 ]" 1
441 1 21 VAL MG1 1 34 PHE QE 4.220 . 4.220 3.123 2.284 3.588 . 0 0 "[ . 1 . 2 . 3 ]" 1
442 1 21 VAL MG1 1 34 PHE QD 4.220 . 4.220 3.759 3.091 4.272 0.052 10 0 "[ . 1 . 2 . 3 ]" 1
443 1 46 MET HG3 2 21 VAL MG1 5.500 . 5.500 3.820 2.863 5.506 0.006 19 0 "[ . 1 . 2 . 3 ]" 1
444 1 42 ILE MG 2 21 VAL MG1 3.940 . 3.940 2.344 1.974 3.202 . 0 0 "[ . 1 . 2 . 3 ]" 1
445 1 45 PHE QE 2 33 LEU MD2 4.820 . 4.820 4.428 2.829 4.831 0.011 21 0 "[ . 1 . 2 . 3 ]" 1
446 1 38 LEU H 1 38 LEU MD1 4.310 . 4.310 4.189 4.129 4.246 . 0 0 "[ . 1 . 2 . 3 ]" 1
447 1 34 PHE QE 1 38 LEU MD1 4.510 . 4.510 3.843 2.502 4.340 . 0 0 "[ . 1 . 2 . 3 ]" 1
448 1 34 PHE HZ 1 38 LEU MD1 4.300 . 4.300 3.611 2.015 4.298 . 0 0 "[ . 1 . 2 . 3 ]" 1
449 1 33 LEU MD2 1 36 ARG HD3 5.500 . 5.500 2.657 2.148 3.012 . 0 0 "[ . 1 . 2 . 3 ]" 1
450 1 38 LEU HA 1 38 LEU MD1 4.270 . 4.270 2.387 2.172 3.747 . 0 0 "[ . 1 . 2 . 3 ]" 1
451 1 6 LEU HA 1 6 LEU MD2 4.190 . 4.190 2.195 2.099 2.311 . 0 0 "[ . 1 . 2 . 3 ]" 1
452 1 33 LEU HA 1 33 LEU MD2 3.900 . 3.900 2.099 2.044 2.180 . 0 0 "[ . 1 . 2 . 3 ]" 1
453 1 55 LEU HA 1 55 LEU MD2 4.280 . 4.280 2.850 1.976 4.102 . 0 0 "[ . 1 . 2 . 3 ]" 1
454 1 30 LYS HB3 2 45 PHE QD 4.280 . 4.280 2.293 2.037 2.676 . 0 0 "[ . 1 . 2 . 3 ]" 1
455 1 18 ILE HG12 1 34 PHE QD 3.980 . 3.980 2.676 2.436 2.966 . 0 0 "[ . 1 . 2 . 3 ]" 1
456 1 45 PHE QD 2 34 PHE QD 4.170 . 4.170 2.611 2.270 3.075 . 0 0 "[ . 1 . 2 . 3 ]" 1
457 1 41 LEU HG 2 34 PHE QE 4.730 . 4.730 2.567 2.051 4.769 0.039 14 0 "[ . 1 . 2 . 3 ]" 1
458 1 18 ILE HG12 1 34 PHE QE 4.050 . 4.050 2.387 2.061 2.899 . 0 0 "[ . 1 . 2 . 3 ]" 1
459 1 24 HIS HA 1 24 HIS HD2 4.480 . 4.480 3.459 3.015 4.531 0.051 12 0 "[ . 1 . 2 . 3 ]" 1
460 1 3 MET HA 1 3 MET HG3 4.050 . 4.050 3.489 2.557 4.180 0.130 7 0 "[ . 1 . 2 . 3 ]" 1
461 1 27 ASP HA 1 28 HIS HA 4.380 . 4.380 4.312 4.152 4.380 . 15 0 "[ . 1 . 2 . 3 ]" 1
462 1 29 ASP HA 1 31 VAL H 4.580 . 4.580 4.419 4.062 4.590 0.010 7 0 "[ . 1 . 2 . 3 ]" 1
463 1 45 PHE QD 2 30 LYS HA 4.480 . 4.480 3.175 2.633 3.605 . 0 0 "[ . 1 . 2 . 3 ]" 1
464 1 45 PHE QD 2 31 VAL HA 5.500 . 5.500 5.149 4.988 5.399 . 0 0 "[ . 1 . 2 . 3 ]" 1
465 1 32 LEU HA 1 36 ARG H 4.470 . 4.470 4.079 3.838 4.251 . 0 0 "[ . 1 . 2 . 3 ]" 1
466 1 34 PHE HA 1 34 PHE QD 3.600 . 3.600 2.648 2.458 2.758 . 0 0 "[ . 1 . 2 . 3 ]" 1
467 1 34 PHE HA 1 38 LEU H 4.560 . 4.560 3.822 3.601 3.986 . 0 0 "[ . 1 . 2 . 3 ]" 1
468 1 41 LEU HG 2 34 PHE QD 4.500 . 4.500 2.909 2.291 4.591 0.091 14 0 "[ . 1 . 2 . 3 ]" 1
469 1 43 ASN HA 1 46 MET H 3.930 . 3.930 3.314 2.988 3.613 . 0 0 "[ . 1 . 2 . 3 ]" 1
470 1 46 MET HA 1 46 MET ME 4.000 . 4.000 3.435 1.919 3.841 . 0 0 "[ . 1 . 2 . 3 ]" 1
471 1 46 MET ME 1 46 MET HG3 3.690 . 3.690 3.138 2.351 3.403 . 0 0 "[ . 1 . 2 . 3 ]" 1
472 1 46 MET ME 1 46 MET HG2 3.690 . 3.690 2.602 2.205 3.383 . 0 0 "[ . 1 . 2 . 3 ]" 1
473 1 20 LEU HA 1 23 ARG H 3.930 . 3.930 3.530 3.353 3.742 . 0 0 "[ . 1 . 2 . 3 ]" 1
474 1 23 ARG HA 1 26 LEU H 5.210 . 5.210 4.799 4.264 5.229 0.019 5 0 "[ . 1 . 2 . 3 ]" 1
475 1 20 LEU HB2 1 20 LEU MD2 3.460 . 3.460 3.026 2.145 3.215 . 0 0 "[ . 1 . 2 . 3 ]" 1
476 1 18 ILE HA 1 18 ILE HG13 4.060 . 4.060 2.860 2.715 2.965 . 0 0 "[ . 1 . 2 . 3 ]" 1
477 1 52 VAL HA 1 52 VAL MG2 3.610 . 3.610 3.195 2.226 3.256 . 0 0 "[ . 1 . 2 . 3 ]" 1
478 1 21 VAL MG1 1 34 PHE HZ 4.670 . 4.670 3.236 2.593 4.010 . 0 0 "[ . 1 . 2 . 3 ]" 1
479 1 32 LEU HA 1 32 LEU MD1 3.790 . 3.790 3.819 3.671 3.841 0.051 19 0 "[ . 1 . 2 . 3 ]" 1
480 1 26 LEU HA 1 26 LEU MD2 3.880 . 3.880 3.158 1.926 3.757 . 0 0 "[ . 1 . 2 . 3 ]" 1
481 1 17 LEU MD1 1 21 VAL MG1 4.350 . 4.350 3.324 2.184 4.457 0.107 25 0 "[ . 1 . 2 . 3 ]" 1
482 1 17 LEU MD1 1 21 VAL MG2 4.350 . 4.350 2.908 2.106 4.405 0.055 14 0 "[ . 1 . 2 . 3 ]" 1
483 1 17 LEU HB2 1 20 LEU HB2 5.060 . 5.060 4.729 4.492 4.996 . 0 0 "[ . 1 . 2 . 3 ]" 1
484 1 14 LYS HB3 1 14 LYS HD3 4.100 . 4.100 2.850 2.657 3.023 . 0 0 "[ . 1 . 2 . 3 ]" 1
485 1 44 LYS HG2 1 45 PHE QD 5.100 . 5.100 3.662 3.238 4.006 . 0 0 "[ . 1 . 2 . 3 ]" 1
486 1 44 LYS HB2 1 44 LYS HD3 4.090 . 4.090 3.724 2.374 3.856 . 0 0 "[ . 1 . 2 . 3 ]" 1
487 1 17 LEU MD1 2 42 ILE MD 3.580 . 3.580 2.465 2.204 2.846 . 0 0 "[ . 1 . 2 . 3 ]" 1
488 1 17 LEU MD2 2 42 ILE MD 3.580 . 3.580 2.136 1.883 2.432 . 0 0 "[ . 1 . 2 . 3 ]" 1
489 1 20 LEU HA 1 23 ARG HB2 5.160 . 5.160 4.919 4.758 5.171 0.011 20 0 "[ . 1 . 2 . 3 ]" 1
490 1 26 LEU MD2 1 30 LYS HB2 4.520 . 4.520 2.854 2.659 3.103 . 0 0 "[ . 1 . 2 . 3 ]" 1
491 1 44 LYS HE2 1 45 PHE QD 5.500 . 5.500 5.118 2.828 5.555 0.055 27 0 "[ . 1 . 2 . 3 ]" 1
492 1 44 LYS HE3 1 45 PHE QD 5.500 . 5.500 4.731 2.537 5.551 0.051 15 0 "[ . 1 . 2 . 3 ]" 1
493 1 45 PHE HB3 2 34 PHE QD 4.880 . 4.880 3.996 3.723 4.493 . 0 0 "[ . 1 . 2 . 3 ]" 1
494 1 29 ASP HA 1 32 LEU MD1 4.640 . 4.640 2.408 2.095 2.952 . 0 0 "[ . 1 . 2 . 3 ]" 1
495 1 26 LEU HG 1 30 LYS HB2 4.420 . 4.420 3.527 2.892 4.523 0.103 7 0 "[ . 1 . 2 . 3 ]" 1
496 1 20 LEU HB3 2 10 ILE HG12 4.310 . 4.310 2.108 1.838 2.532 . 0 0 "[ . 1 . 2 . 3 ]" 1
497 1 30 LYS HB3 1 30 LYS HD2 3.970 . 3.970 2.586 2.389 3.576 . 0 0 "[ . 1 . 2 . 3 ]" 1
498 1 7 LYS HB3 1 7 LYS HE2 3.620 . 3.620 2.888 2.017 3.715 0.095 17 0 "[ . 1 . 2 . 3 ]" 1
499 1 7 LYS HB3 1 7 LYS HE3 3.620 . 3.620 2.650 2.046 3.797 0.177 31 0 "[ . 1 . 2 . 3 ]" 1
500 1 42 ILE HG12 1 42 ILE MG 3.260 . 3.260 2.385 2.341 2.433 . 0 0 "[ . 1 . 2 . 3 ]" 1
501 1 26 LEU HA 1 30 LYS HB3 4.920 . 4.920 3.786 3.471 4.251 . 0 0 "[ . 1 . 2 . 3 ]" 1
502 1 10 ILE HA 1 13 LYS HB2 4.390 . 4.390 3.693 3.235 4.039 . 0 0 "[ . 1 . 2 . 3 ]" 1
503 1 45 PHE HB2 2 26 LEU MD2 4.510 . 4.510 3.539 2.734 4.175 . 0 0 "[ . 1 . 2 . 3 ]" 1
504 1 15 LYS HB3 1 15 LYS HD3 3.310 . 3.310 2.929 2.591 3.210 . 0 0 "[ . 1 . 2 . 3 ]" 1
505 1 30 LYS H 1 30 LYS HG3 4.050 . 4.050 3.726 3.499 3.909 . 0 0 "[ . 1 . 2 . 3 ]" 1
506 1 18 ILE HG13 1 34 PHE QE 4.720 . 4.720 3.212 2.929 3.608 . 0 0 "[ . 1 . 2 . 3 ]" 1
507 1 45 PHE QD 2 26 LEU MD2 3.820 . 3.820 2.883 2.375 3.521 . 0 0 "[ . 1 . 2 . 3 ]" 1
508 1 20 LEU HB3 1 20 LEU MD1 3.570 . 3.570 2.443 2.331 3.188 . 0 0 "[ . 1 . 2 . 3 ]" 1
509 1 17 LEU HG 2 14 LYS HB2 4.000 . 4.000 3.618 2.808 4.237 0.237 25 0 "[ . 1 . 2 . 3 ]" 1
510 1 30 LYS HA 1 30 LYS HE2 5.500 . 5.500 4.639 3.442 4.885 . 0 0 "[ . 1 . 2 . 3 ]" 1
511 1 30 LYS HA 1 30 LYS HE3 5.500 . 5.500 4.372 1.811 4.853 . 0 0 "[ . 1 . 2 . 3 ]" 1
512 1 24 HIS HB3 1 26 LEU MD2 4.620 . 4.620 4.560 4.302 4.715 0.095 14 0 "[ . 1 . 2 . 3 ]" 1
513 1 14 LYS HG3 1 38 LEU MD1 3.620 . 3.620 2.923 2.689 3.376 . 0 0 "[ . 1 . 2 . 3 ]" 1
514 1 10 ILE MD 1 10 ILE MG 2.730 . 2.730 1.940 1.898 1.988 . 0 0 "[ . 1 . 2 . 3 ]" 1
515 1 23 ARG H 1 23 ARG HB2 3.630 . 3.630 3.642 3.622 3.658 0.028 25 0 "[ . 1 . 2 . 3 ]" 1
516 1 42 ILE MG 2 21 VAL MG2 3.940 . 3.940 2.873 2.009 3.962 0.022 5 0 "[ . 1 . 2 . 3 ]" 1
517 1 22 ALA MB 1 23 ARG HG2 4.520 . 4.520 4.068 3.885 4.413 . 0 0 "[ . 1 . 2 . 3 ]" 1
518 1 30 LYS HB2 1 30 LYS HD3 4.080 . 4.080 3.720 3.608 3.812 . 0 0 "[ . 1 . 2 . 3 ]" 1
519 1 14 LYS HE3 1 38 LEU MD1 5.500 . 5.500 5.571 5.516 5.622 0.122 20 0 "[ . 1 . 2 . 3 ]" 1
520 1 30 LYS HA 2 45 PHE QE 4.810 . 4.810 2.409 2.147 2.876 . 0 0 "[ . 1 . 2 . 3 ]" 1
521 1 44 LYS HB3 1 44 LYS HD2 3.820 . 3.820 2.489 2.353 3.715 . 0 0 "[ . 1 . 2 . 3 ]" 1
522 1 30 LYS HB2 1 30 LYS HD2 4.080 . 4.080 3.711 3.604 4.145 0.065 23 0 "[ . 1 . 2 . 3 ]" 1
523 1 34 PHE QE 2 42 ILE HG13 4.620 . 4.620 2.919 2.616 3.260 . 0 0 "[ . 1 . 2 . 3 ]" 1
524 1 22 ALA HA 1 26 LEU HB3 4.150 . 4.150 3.361 3.000 3.827 . 0 0 "[ . 1 . 2 . 3 ]" 1
525 1 21 VAL HB 1 26 LEU MD2 5.500 . 5.500 3.981 2.783 5.515 0.015 21 0 "[ . 1 . 2 . 3 ]" 1
526 1 28 HIS HA 1 31 VAL MG2 4.710 . 4.710 2.722 2.224 3.047 . 0 0 "[ . 1 . 2 . 3 ]" 1
527 1 44 LYS HB2 1 44 LYS HD2 4.090 . 4.090 3.198 3.054 3.650 . 0 0 "[ . 1 . 2 . 3 ]" 1
528 1 26 LEU HG 1 30 LYS HB3 3.940 . 3.940 2.941 2.248 4.097 0.157 17 0 "[ . 1 . 2 . 3 ]" 1
529 1 6 LEU HA 1 6 LEU MD1 4.190 . 4.190 3.329 3.189 3.469 . 0 0 "[ . 1 . 2 . 3 ]" 1
530 1 9 LYS HB3 1 9 LYS HD2 4.120 . 4.120 2.826 2.377 3.594 . 0 0 "[ . 1 . 2 . 3 ]" 1
531 1 9 LYS HB3 1 9 LYS HD3 4.120 . 4.120 2.994 2.358 3.806 . 0 0 "[ . 1 . 2 . 3 ]" 1
532 1 38 LEU HG 1 42 ILE HG12 5.500 . 5.500 4.816 4.444 5.119 . 0 0 "[ . 1 . 2 . 3 ]" 1
533 1 44 LYS HB3 1 44 LYS HD3 3.820 . 3.820 3.637 2.953 3.711 . 0 0 "[ . 1 . 2 . 3 ]" 1
534 1 15 LYS HB2 1 15 LYS HD3 3.310 . 3.310 2.505 2.335 2.816 . 0 0 "[ . 1 . 2 . 3 ]" 1
535 1 20 LEU HB2 1 20 LEU MD1 3.460 . 3.460 2.451 2.288 3.215 . 0 0 "[ . 1 . 2 . 3 ]" 1
536 1 17 LEU MD2 1 34 PHE QE 4.810 . 4.810 3.652 2.608 4.050 . 0 0 "[ . 1 . 2 . 3 ]" 1
537 1 10 ILE MD 2 24 HIS HD2 5.060 . 5.060 4.073 2.981 5.081 0.021 5 0 "[ . 1 . 2 . 3 ]" 1
538 1 36 ARG H 1 36 ARG HD2 4.510 . 4.510 4.036 3.607 4.540 0.030 9 0 "[ . 1 . 2 . 3 ]" 1
539 1 36 ARG H 1 36 ARG HD3 5.020 . 5.020 4.291 3.633 4.710 . 0 0 "[ . 1 . 2 . 3 ]" 1
540 1 6 LEU HG 1 10 ILE MD 4.340 . 4.340 4.332 4.194 4.383 0.043 6 0 "[ . 1 . 2 . 3 ]" 1
541 1 10 ILE H 2 20 LEU MD1 4.940 . 4.940 3.782 3.197 5.165 0.225 31 0 "[ . 1 . 2 . 3 ]" 1
542 1 42 ILE MD 2 21 VAL HB 5.500 . 5.500 5.196 3.775 5.520 0.020 29 0 "[ . 1 . 2 . 3 ]" 1
543 1 18 ILE MG 1 21 VAL HB 5.500 . 5.500 4.711 3.624 5.601 0.101 26 0 "[ . 1 . 2 . 3 ]" 1
544 1 21 VAL HB 1 26 LEU MD1 5.500 . 5.500 3.602 2.784 4.542 . 0 0 "[ . 1 . 2 . 3 ]" 1
545 1 18 ILE HG13 1 38 LEU MD2 4.980 . 4.980 2.717 2.413 4.267 . 0 0 "[ . 1 . 2 . 3 ]" 1
546 1 44 LYS HD2 1 45 PHE QD 4.920 . 4.920 3.117 2.774 4.698 . 0 0 "[ . 1 . 2 . 3 ]" 1
547 1 27 ASP H 1 27 ASP HB2 3.730 . 3.730 2.660 2.349 3.740 0.010 2 0 "[ . 1 . 2 . 3 ]" 1
548 1 13 LYS HA 1 16 GLU HB2 4.090 . 4.090 2.561 2.108 2.792 . 0 0 "[ . 1 . 2 . 3 ]" 1
549 1 51 LYS HB2 1 51 LYS HD2 3.990 . 3.990 2.935 2.382 3.759 . 0 0 "[ . 1 . 2 . 3 ]" 1
550 1 51 LYS HB2 1 51 LYS HD3 3.990 . 3.990 3.133 2.408 3.771 . 0 0 "[ . 1 . 2 . 3 ]" 1
551 1 34 PHE HA 1 37 ASP HB2 4.470 . 4.470 3.895 3.384 4.171 . 0 0 "[ . 1 . 2 . 3 ]" 1
552 1 45 PHE HB3 2 26 LEU MD2 4.530 . 4.530 2.264 1.871 2.897 . 0 0 "[ . 1 . 2 . 3 ]" 1
553 1 10 ILE HG12 2 20 LEU HB2 4.360 . 4.360 2.597 2.324 3.089 . 0 0 "[ . 1 . 2 . 3 ]" 1
554 1 46 MET HB3 1 46 MET ME 3.310 . 3.310 2.102 1.906 3.286 . 0 0 "[ . 1 . 2 . 3 ]" 1
555 1 14 LYS HD2 1 39 ASP HA 4.410 . 4.410 2.775 2.381 3.141 . 0 0 "[ . 1 . 2 . 3 ]" 1
556 1 46 MET HG2 2 21 VAL MG1 5.500 . 5.500 3.138 2.180 4.818 . 0 0 "[ . 1 . 2 . 3 ]" 1
557 1 45 PHE HA 2 26 LEU MD2 4.370 . 4.370 3.835 3.277 4.349 . 0 0 "[ . 1 . 2 . 3 ]" 1
558 1 14 LYS HA 1 17 LEU HB2 5.320 . 5.320 3.912 3.499 4.238 . 0 0 "[ . 1 . 2 . 3 ]" 1
559 1 13 LYS HG2 2 16 GLU HB2 4.270 . 4.270 3.020 2.678 3.506 . 0 0 "[ . 1 . 2 . 3 ]" 1
560 1 16 GLU HB2 2 13 LYS HG3 4.540 . 4.540 3.178 2.798 3.482 . 0 0 "[ . 1 . 2 . 3 ]" 1
561 1 14 LYS HG3 1 38 LEU HG 5.080 . 5.080 2.636 2.230 4.714 . 0 0 "[ . 1 . 2 . 3 ]" 1
562 1 17 LEU MD2 1 21 VAL MG2 4.350 . 4.350 3.057 1.993 4.167 . 0 0 "[ . 1 . 2 . 3 ]" 1
563 1 41 LEU HB2 1 42 ILE HG13 5.440 . 5.440 4.967 4.559 5.287 . 0 0 "[ . 1 . 2 . 3 ]" 1
564 1 6 LEU MD1 1 10 ILE MD 3.430 . 3.430 1.977 1.938 2.036 . 0 0 "[ . 1 . 2 . 3 ]" 1
565 1 17 LEU MD1 2 42 ILE HG12 5.150 . 5.150 3.329 2.810 4.384 . 0 0 "[ . 1 . 2 . 3 ]" 1
566 1 17 LEU MD2 2 42 ILE HG12 5.150 . 5.150 3.512 2.939 4.028 . 0 0 "[ . 1 . 2 . 3 ]" 1
567 1 30 LYS HB3 1 30 LYS HD3 3.970 . 3.970 3.103 2.397 3.313 . 0 0 "[ . 1 . 2 . 3 ]" 1
568 1 21 VAL HB 1 22 ALA H 4.150 . 4.150 3.359 2.533 4.222 0.072 4 0 "[ . 1 . 2 . 3 ]" 1
569 1 29 ASP HA 1 32 LEU HG 4.530 . 4.530 2.972 1.985 3.312 . 0 0 "[ . 1 . 2 . 3 ]" 1
570 1 6 LEU MD2 1 10 ILE MD 3.430 . 3.430 3.255 2.754 3.463 0.033 8 0 "[ . 1 . 2 . 3 ]" 1
571 1 17 LEU HA 2 13 LYS HG3 4.470 . 4.470 3.345 2.973 4.055 . 0 0 "[ . 1 . 2 . 3 ]" 1
572 1 18 ILE HG13 1 38 LEU MD1 4.980 . 4.980 4.887 3.595 5.063 0.083 10 0 "[ . 1 . 2 . 3 ]" 1
573 1 45 PHE H 1 45 PHE HB3 3.590 . 3.590 3.554 3.475 3.594 0.004 8 0 "[ . 1 . 2 . 3 ]" 1
574 1 44 LYS HB2 1 45 PHE H 4.020 . 4.020 3.725 3.643 3.850 . 0 0 "[ . 1 . 2 . 3 ]" 1
575 1 26 LEU H 1 26 LEU MD2 4.290 . 4.290 3.727 3.438 3.904 . 0 0 "[ . 1 . 2 . 3 ]" 1
576 1 22 ALA HA 1 26 LEU H 3.720 . 3.720 3.256 2.970 3.452 . 0 0 "[ . 1 . 2 . 3 ]" 1
577 1 26 LEU H 1 26 LEU HB3 3.730 . 3.730 3.487 3.361 3.685 . 0 0 "[ . 1 . 2 . 3 ]" 1
578 1 26 LEU H 1 27 ASP H 4.570 . 4.570 4.451 4.373 4.522 . 0 0 "[ . 1 . 2 . 3 ]" 1
579 1 19 GLN H 1 19 GLN HB3 3.560 . 3.560 3.583 3.556 3.604 0.044 2 0 "[ . 1 . 2 . 3 ]" 1
580 1 48 VAL HB 1 49 LYS H 4.150 . 4.150 3.523 2.188 4.229 0.079 8 0 "[ . 1 . 2 . 3 ]" 1
581 1 49 LYS H 1 49 LYS HG3 4.310 . 4.310 2.883 2.088 4.379 0.069 3 0 "[ . 1 . 2 . 3 ]" 1
582 1 54 LYS HB2 1 55 LEU H 4.980 . 4.980 4.104 2.619 4.648 . 0 0 "[ . 1 . 2 . 3 ]" 1
583 1 37 ASP H 1 37 ASP HB2 3.810 . 3.810 2.406 2.205 2.562 . 0 0 "[ . 1 . 2 . 3 ]" 1
584 1 36 ARG HG2 1 37 ASP H 5.500 . 5.500 3.422 2.331 4.957 . 0 0 "[ . 1 . 2 . 3 ]" 1
585 1 41 LEU H 1 41 LEU MD2 4.520 . 4.520 4.242 4.148 4.315 . 0 0 "[ . 1 . 2 . 3 ]" 1
586 1 41 LEU H 1 41 LEU HG 4.470 . 4.470 4.436 4.257 4.484 0.014 29 0 "[ . 1 . 2 . 3 ]" 1
587 1 41 LEU H 1 41 LEU HB2 3.410 . 3.410 2.549 2.201 2.648 . 0 0 "[ . 1 . 2 . 3 ]" 1
588 1 10 ILE H 1 10 ILE HG12 3.820 . 3.820 3.489 3.381 3.576 . 0 0 "[ . 1 . 2 . 3 ]" 1
589 1 20 LEU MD2 2 10 ILE H 4.940 . 4.940 4.488 2.708 4.941 0.001 10 0 "[ . 1 . 2 . 3 ]" 1
590 1 9 LYS HB3 1 10 ILE H 4.100 . 4.100 3.579 3.199 3.892 . 0 0 "[ . 1 . 2 . 3 ]" 1
591 1 51 LYS H 1 51 LYS HB2 3.870 . 3.870 3.694 3.486 3.846 . 0 0 "[ . 1 . 2 . 3 ]" 1
592 1 30 LYS HB2 1 31 VAL H 3.520 . 3.520 2.577 2.424 2.764 . 0 0 "[ . 1 . 2 . 3 ]" 1
593 1 30 LYS HB3 1 31 VAL H 4.340 . 4.340 3.534 3.346 3.670 . 0 0 "[ . 1 . 2 . 3 ]" 1
594 1 26 LEU HG 1 31 VAL H 5.500 . 5.500 5.254 4.937 5.591 0.091 1 0 "[ . 1 . 2 . 3 ]" 1
595 1 32 LEU HB2 1 33 LEU H 4.140 . 4.140 2.415 2.227 3.930 . 0 0 "[ . 1 . 2 . 3 ]" 1
596 1 32 LEU MD1 1 33 LEU H 5.310 . 5.310 4.270 2.651 4.469 . 0 0 "[ . 1 . 2 . 3 ]" 1
597 1 32 LEU MD2 1 33 LEU H 5.310 . 5.310 4.527 4.025 4.614 . 0 0 "[ . 1 . 2 . 3 ]" 1
598 1 32 LEU HB3 1 33 LEU H 4.140 . 4.140 3.495 3.361 3.995 . 0 0 "[ . 1 . 2 . 3 ]" 1
599 1 22 ALA H 1 31 VAL MG2 5.060 . 5.060 4.128 3.788 4.356 . 0 0 "[ . 1 . 2 . 3 ]" 1
600 1 51 LYS HG3 1 52 VAL H 4.560 . 4.560 3.833 2.588 4.468 . 0 0 "[ . 1 . 2 . 3 ]" 1
601 1 52 VAL H 1 52 VAL HB 3.730 . 3.730 3.678 2.249 3.838 0.108 12 0 "[ . 1 . 2 . 3 ]" 1
602 1 51 LYS HB2 1 52 VAL H 4.520 . 4.520 4.320 3.593 4.538 0.018 9 0 "[ . 1 . 2 . 3 ]" 1
603 1 51 LYS HG2 1 52 VAL H 4.560 . 4.560 3.845 2.755 4.554 . 0 0 "[ . 1 . 2 . 3 ]" 1
604 1 9 LYS H 1 9 LYS HB3 3.680 . 3.680 3.621 3.586 3.648 . 0 0 "[ . 1 . 2 . 3 ]" 1
605 1 32 LEU H 1 32 LEU MD2 4.270 . 4.270 3.085 2.942 3.352 . 0 0 "[ . 1 . 2 . 3 ]" 1
606 1 13 LYS H 1 13 LYS HB2 3.660 . 3.660 2.344 2.172 2.456 . 0 0 "[ . 1 . 2 . 3 ]" 1
607 1 16 GLU HB3 1 17 LEU H 4.180 . 4.180 3.481 3.236 3.648 . 0 0 "[ . 1 . 2 . 3 ]" 1
608 1 17 LEU H 1 17 LEU MD2 5.260 . 5.260 4.210 4.066 4.282 . 0 0 "[ . 1 . 2 . 3 ]" 1
609 1 17 LEU H 1 17 LEU HB2 3.510 . 3.510 2.739 2.596 2.884 . 0 0 "[ . 1 . 2 . 3 ]" 1
610 1 34 PHE H 1 34 PHE HB2 3.550 . 3.550 2.594 2.523 2.662 . 0 0 "[ . 1 . 2 . 3 ]" 1
611 1 30 LYS H 1 30 LYS HB3 3.880 . 3.880 3.604 3.557 3.646 . 0 0 "[ . 1 . 2 . 3 ]" 1
612 1 11 GLU H 1 11 GLU HB3 3.770 . 3.770 3.605 3.557 3.630 . 0 0 "[ . 1 . 2 . 3 ]" 1
613 1 43 ASN HB3 1 48 VAL H 5.250 . 5.250 4.066 3.110 5.264 0.014 17 0 "[ . 1 . 2 . 3 ]" 1
614 1 43 ASN HB3 1 44 LYS H 4.070 . 4.070 3.687 3.543 3.816 . 0 0 "[ . 1 . 2 . 3 ]" 1
615 1 44 LYS H 1 44 LYS HB2 3.300 . 3.300 2.448 2.344 2.549 . 0 0 "[ . 1 . 2 . 3 ]" 1
616 1 44 LYS H 1 44 LYS HG2 4.700 . 4.700 4.450 4.385 4.505 . 0 0 "[ . 1 . 2 . 3 ]" 1
617 1 13 LYS HB3 1 14 LYS H 4.180 . 4.180 2.541 2.334 2.745 . 0 0 "[ . 1 . 2 . 3 ]" 1
618 1 17 LEU HB2 2 14 LYS H 4.160 . 4.160 3.927 3.460 4.171 0.011 28 0 "[ . 1 . 2 . 3 ]" 1
619 1 14 LYS H 1 14 LYS HB3 3.530 . 3.530 2.379 2.240 2.516 . 0 0 "[ . 1 . 2 . 3 ]" 1
620 1 17 LEU MD1 2 14 LYS H 5.500 . 5.500 4.409 2.145 5.449 . 0 0 "[ . 1 . 2 . 3 ]" 1
621 1 38 LEU HB2 1 39 ASP H 4.050 . 4.050 3.890 3.794 4.037 . 0 0 "[ . 1 . 2 . 3 ]" 1
622 1 38 LEU MD1 1 39 ASP H 5.430 . 5.430 4.220 4.071 4.843 . 0 0 "[ . 1 . 2 . 3 ]" 1
623 1 38 LEU HB3 1 39 ASP H 4.050 . 4.050 2.548 2.401 2.871 . 0 0 "[ . 1 . 2 . 3 ]" 1
624 1 17 LEU HB2 1 18 ILE H 4.300 . 4.300 3.970 3.779 4.089 . 0 0 "[ . 1 . 2 . 3 ]" 1
625 1 18 ILE H 1 18 ILE HG12 4.040 . 4.040 3.465 3.338 3.712 . 0 0 "[ . 1 . 2 . 3 ]" 1
626 1 16 GLU H 1 16 GLU HG3 3.980 . 3.980 2.657 2.332 3.719 . 0 0 "[ . 1 . 2 . 3 ]" 1
627 1 16 GLU H 1 16 GLU HB3 3.820 . 3.820 3.624 3.527 3.673 . 0 0 "[ . 1 . 2 . 3 ]" 1
628 1 23 ARG HB2 1 24 HIS H 4.360 . 4.360 4.103 4.032 4.178 . 0 0 "[ . 1 . 2 . 3 ]" 1
629 1 23 ARG HG2 1 24 HIS H 4.580 . 4.580 3.105 2.746 3.511 . 0 0 "[ . 1 . 2 . 3 ]" 1
630 1 15 LYS HB2 1 16 GLU H 3.910 . 3.910 2.767 2.520 2.907 . 0 0 "[ . 1 . 2 . 3 ]" 1
631 1 19 GLN HB3 1 20 LEU H 3.940 . 3.940 3.678 3.457 3.881 . 0 0 "[ . 1 . 2 . 3 ]" 1
632 1 20 LEU H 1 20 LEU MD2 3.900 . 3.900 3.297 2.219 3.710 . 0 0 "[ . 1 . 2 . 3 ]" 1
633 1 20 LEU H 1 20 LEU HB3 3.990 . 3.990 3.607 3.454 3.710 . 0 0 "[ . 1 . 2 . 3 ]" 1
634 1 20 LEU HB3 1 21 VAL H 4.400 . 4.400 3.459 2.960 3.610 . 0 0 "[ . 1 . 2 . 3 ]" 1
635 1 17 LEU MD1 1 21 VAL H 4.560 . 4.560 3.683 3.573 3.868 . 0 0 "[ . 1 . 2 . 3 ]" 1
636 1 10 ILE MG 2 21 VAL H 4.700 . 4.700 4.103 3.728 4.519 . 0 0 "[ . 1 . 2 . 3 ]" 1
637 1 21 VAL H 1 22 ALA MB 4.310 . 4.310 4.325 4.264 4.370 0.060 30 0 "[ . 1 . 2 . 3 ]" 1
638 1 7 LYS H 1 7 LYS HB3 3.380 . 3.380 3.244 2.800 3.446 0.066 17 0 "[ . 1 . 2 . 3 ]" 1
639 1 6 LEU HB2 1 7 LYS H 3.970 . 3.970 3.821 3.733 3.912 . 0 0 "[ . 1 . 2 . 3 ]" 1
640 1 7 LYS H 1 7 LYS HG2 3.980 . 3.980 3.535 3.005 4.034 0.054 24 0 "[ . 1 . 2 . 3 ]" 1
641 1 40 LYS H 1 40 LYS HG2 4.320 . 4.320 3.526 2.459 4.237 . 0 0 "[ . 1 . 2 . 3 ]" 1
642 1 23 ARG H 1 24 HIS H 3.470 . 3.470 2.614 2.487 2.671 . 0 0 "[ . 1 . 2 . 3 ]" 1
643 1 47 ASN H 1 47 ASN HB3 4.030 . 4.030 3.724 3.034 4.083 0.053 10 0 "[ . 1 . 2 . 3 ]" 1
644 1 7 LYS HB3 1 8 ASN H 3.820 . 3.820 2.992 2.542 3.379 . 0 0 "[ . 1 . 2 . 3 ]" 1
645 1 15 LYS H 1 18 ILE MD 4.390 . 4.390 3.796 3.659 3.950 . 0 0 "[ . 1 . 2 . 3 ]" 1
646 1 41 LEU HB2 1 42 ILE H 4.120 . 4.120 3.835 3.405 3.973 . 0 0 "[ . 1 . 2 . 3 ]" 1
647 1 42 ILE H 1 42 ILE HG12 4.100 . 4.100 3.483 3.365 3.688 . 0 0 "[ . 1 . 2 . 3 ]" 1
648 1 41 LEU MD1 1 42 ILE H 4.440 . 4.440 4.376 4.203 4.526 0.086 24 0 "[ . 1 . 2 . 3 ]" 1
649 1 28 HIS HB3 1 29 ASP H 3.850 . 3.850 3.338 2.560 3.884 0.034 6 0 "[ . 1 . 2 . 3 ]" 1
650 1 43 ASN H 1 44 LYS HB3 5.260 . 5.260 4.854 4.702 5.022 . 0 0 "[ . 1 . 2 . 3 ]" 1
651 1 11 GLU HB3 1 12 ASN H 3.980 . 3.980 3.361 3.198 3.606 . 0 0 "[ . 1 . 2 . 3 ]" 1
652 1 45 PHE HB3 1 46 MET H 4.270 . 4.270 3.660 3.428 3.934 . 0 0 "[ . 1 . 2 . 3 ]" 1
653 1 46 MET H 1 46 MET HG3 4.000 . 4.000 2.620 2.059 3.810 . 0 0 "[ . 1 . 2 . 3 ]" 1
654 1 46 MET H 1 46 MET HG2 4.000 . 4.000 2.934 2.223 3.395 . 0 0 "[ . 1 . 2 . 3 ]" 1
655 1 18 ILE HG12 1 35 SER H 5.110 . 5.110 4.688 4.393 4.949 . 0 0 "[ . 1 . 2 . 3 ]" 1
656 1 34 PHE HB2 1 35 SER H 4.670 . 4.670 3.873 3.807 3.956 . 0 0 "[ . 1 . 2 . 3 ]" 1
657 1 18 ILE MG 1 35 SER H 4.840 . 4.840 3.705 3.484 4.230 . 0 0 "[ . 1 . 2 . 3 ]" 1
658 1 26 LEU HB2 1 27 ASP H 4.410 . 4.410 3.949 3.739 4.100 . 0 0 "[ . 1 . 2 . 3 ]" 1
659 1 27 ASP H 1 30 LYS HG2 4.320 . 4.320 2.785 2.427 3.314 . 0 0 "[ . 1 . 2 . 3 ]" 1
660 1 48 VAL HA 1 50 ASP H 5.130 . 5.130 4.119 2.438 5.297 0.167 9 0 "[ . 1 . 2 . 3 ]" 1
661 1 3 MET HB2 1 4 GLY H 5.330 . 5.330 3.605 2.762 4.247 . 0 0 "[ . 1 . 2 . 3 ]" 1
662 1 3 MET HB3 1 4 GLY H 5.330 . 5.330 4.096 3.698 4.408 . 0 0 "[ . 1 . 2 . 3 ]" 1
663 1 4 GLY H 1 5 GLN H 4.540 . 4.540 2.642 2.450 2.846 . 0 0 "[ . 1 . 2 . 3 ]" 1
664 1 5 GLN H 1 6 LEU H 4.140 . 4.140 2.504 2.238 2.711 . 0 0 "[ . 1 . 2 . 3 ]" 1
665 1 17 LEU H 1 18 ILE H 3.750 . 3.750 2.603 2.541 2.649 . 0 0 "[ . 1 . 2 . 3 ]" 1
666 1 18 ILE H 1 19 GLN H 3.680 . 3.680 2.728 2.657 2.792 . 0 0 "[ . 1 . 2 . 3 ]" 1
667 1 19 GLN H 1 20 LEU H 3.660 . 3.660 2.692 2.566 2.887 . 0 0 "[ . 1 . 2 . 3 ]" 1
668 1 20 LEU H 1 21 VAL H 3.580 . 3.580 2.792 2.653 2.986 . 0 0 "[ . 1 . 2 . 3 ]" 1
669 1 21 VAL H 1 22 ALA H 3.560 . 3.560 2.707 2.649 2.802 . 0 0 "[ . 1 . 2 . 3 ]" 1
670 1 22 ALA H 1 23 ARG H 3.500 . 3.500 2.772 2.630 2.883 . 0 0 "[ . 1 . 2 . 3 ]" 1
671 1 29 ASP H 1 30 LYS H 3.430 . 3.430 2.588 2.422 2.729 . 0 0 "[ . 1 . 2 . 3 ]" 1
672 1 29 ASP H 1 31 VAL H 4.490 . 4.490 4.163 3.864 4.370 . 0 0 "[ . 1 . 2 . 3 ]" 1
673 1 30 LYS H 1 31 VAL H 3.330 . 3.330 2.628 2.410 2.786 . 0 0 "[ . 1 . 2 . 3 ]" 1
674 1 28 HIS HA 1 32 LEU H 4.840 . 4.840 4.241 3.801 4.709 . 0 0 "[ . 1 . 2 . 3 ]" 1
675 1 30 LYS H 1 32 LEU H 4.410 . 4.410 4.041 3.768 4.168 . 0 0 "[ . 1 . 2 . 3 ]" 1
676 1 31 VAL H 1 32 LEU H 3.420 . 3.420 2.637 2.555 2.753 . 0 0 "[ . 1 . 2 . 3 ]" 1
677 1 33 LEU H 1 34 PHE H 3.580 . 3.580 2.689 2.536 2.786 . 0 0 "[ . 1 . 2 . 3 ]" 1
678 1 35 SER H 1 37 ASP H 4.370 . 4.370 4.274 4.123 4.385 0.015 3 0 "[ . 1 . 2 . 3 ]" 1
679 1 35 SER HB2 1 36 ARG H 4.480 . 4.480 3.689 2.900 3.825 . 0 0 "[ . 1 . 2 . 3 ]" 1
680 1 35 SER HB3 1 36 ARG H 4.480 . 4.480 4.073 3.955 4.147 . 0 0 "[ . 1 . 2 . 3 ]" 1
681 1 35 SER H 1 36 ARG H 3.680 . 3.680 2.731 2.582 2.817 . 0 0 "[ . 1 . 2 . 3 ]" 1
682 1 36 ARG H 1 37 ASP H 3.580 . 3.580 2.617 2.539 2.754 . 0 0 "[ . 1 . 2 . 3 ]" 1
683 1 33 LEU HA 1 37 ASP H 4.780 . 4.780 4.107 3.838 4.251 . 0 0 "[ . 1 . 2 . 3 ]" 1
684 1 37 ASP H 1 38 LEU H 3.620 . 3.620 2.467 2.348 2.624 . 0 0 "[ . 1 . 2 . 3 ]" 1
685 1 36 ARG H 1 38 LEU H 4.730 . 4.730 4.040 3.849 4.237 . 0 0 "[ . 1 . 2 . 3 ]" 1
686 1 38 LEU H 1 40 LYS H 5.100 . 5.100 4.170 4.029 4.375 . 0 0 "[ . 1 . 2 . 3 ]" 1
687 1 38 LEU H 1 39 ASP H 3.490 . 3.490 2.708 2.569 2.859 . 0 0 "[ . 1 . 2 . 3 ]" 1
688 1 39 ASP H 1 40 LYS H 3.400 . 3.400 2.699 2.540 2.812 . 0 0 "[ . 1 . 2 . 3 ]" 1
689 1 41 LEU H 1 42 ILE H 3.610 . 3.610 2.597 2.359 2.797 . 0 0 "[ . 1 . 2 . 3 ]" 1
690 1 43 ASN H 1 44 LYS H 3.590 . 3.590 2.739 2.638 2.836 . 0 0 "[ . 1 . 2 . 3 ]" 1
691 1 44 LYS H 1 45 PHE H 3.570 . 3.570 2.730 2.627 2.819 . 0 0 "[ . 1 . 2 . 3 ]" 1
692 1 44 LYS H 1 46 MET H 4.530 . 4.530 3.923 3.741 4.030 . 0 0 "[ . 1 . 2 . 3 ]" 1
693 1 45 PHE H 1 46 MET H 3.370 . 3.370 2.417 2.312 2.586 . 0 0 "[ . 1 . 2 . 3 ]" 1
694 1 45 PHE H 1 47 ASN H 4.420 . 4.420 3.883 3.683 4.401 . 0 0 "[ . 1 . 2 . 3 ]" 1
695 1 46 MET H 1 47 ASN H 3.320 . 3.320 2.456 2.309 2.740 . 0 0 "[ . 1 . 2 . 3 ]" 1
696 1 46 MET H 1 48 VAL H 5.000 . 5.000 4.323 3.550 5.045 0.045 13 0 "[ . 1 . 2 . 3 ]" 1
697 1 48 VAL H 1 49 LYS H 4.730 . 4.730 4.160 3.436 4.446 . 0 0 "[ . 1 . 2 . 3 ]" 1
698 1 49 LYS HA 1 50 ASP H 3.060 . 3.060 2.582 1.971 3.172 0.112 19 0 "[ . 1 . 2 . 3 ]" 1
699 1 51 LYS HA 1 52 VAL H 2.980 . 2.980 3.000 2.674 3.319 0.339 12 0 "[ . 1 . 2 . 3 ]" 1
700 1 53 HIS H 1 54 LYS H 4.680 . 4.680 3.555 1.749 4.578 . 0 0 "[ . 1 . 2 . 3 ]" 1
701 1 6 LEU H 1 7 LYS H 3.970 . 3.970 2.644 2.416 2.861 . 0 0 "[ . 1 . 2 . 3 ]" 1
702 1 7 LYS H 1 8 ASN H 3.700 . 3.700 2.609 2.445 2.713 . 0 0 "[ . 1 . 2 . 3 ]" 1
703 1 8 ASN H 1 9 LYS H 3.510 . 3.510 2.688 2.604 2.786 . 0 0 "[ . 1 . 2 . 3 ]" 1
704 1 9 LYS H 1 10 ILE H 3.650 . 3.650 2.612 2.377 2.769 . 0 0 "[ . 1 . 2 . 3 ]" 1
705 1 7 LYS HA 1 11 GLU H 4.400 . 4.400 3.939 3.720 4.105 . 0 0 "[ . 1 . 2 . 3 ]" 1
706 1 10 ILE H 1 11 GLU H 3.620 . 3.620 2.802 2.535 2.982 . 0 0 "[ . 1 . 2 . 3 ]" 1
707 1 11 GLU H 1 12 ASN H 3.590 . 3.590 2.798 2.643 2.884 . 0 0 "[ . 1 . 2 . 3 ]" 1
708 1 12 ASN H 1 13 LYS H 3.900 . 3.900 2.792 2.692 2.941 . 0 0 "[ . 1 . 2 . 3 ]" 1
709 1 13 LYS H 1 14 LYS H 3.560 . 3.560 2.598 2.514 2.692 . 0 0 "[ . 1 . 2 . 3 ]" 1
710 1 14 LYS H 1 15 LYS H 3.670 . 3.670 2.711 2.632 2.784 . 0 0 "[ . 1 . 2 . 3 ]" 1
711 1 15 LYS H 1 16 GLU H 3.490 . 3.490 2.691 2.594 2.783 . 0 0 "[ . 1 . 2 . 3 ]" 1
712 1 16 GLU H 1 17 LEU H 3.670 . 3.670 2.686 2.572 2.784 . 0 0 "[ . 1 . 2 . 3 ]" 1
713 1 14 LYS HA 1 18 ILE H 5.190 . 5.190 4.212 4.109 4.321 . 0 0 "[ . 1 . 2 . 3 ]" 1
714 1 16 GLU HA 1 19 GLN H 3.850 . 3.850 3.775 3.564 3.883 0.033 12 0 "[ . 1 . 2 . 3 ]" 1
715 1 25 GLY H 1 26 LEU H 3.280 . 3.280 1.867 1.671 2.049 . 0 0 "[ . 1 . 2 . 3 ]" 1
716 1 27 ASP H 1 30 LYS HB3 4.570 . 4.570 3.509 3.180 3.871 . 0 0 "[ . 1 . 2 . 3 ]" 1
717 1 6 LEU MD2 1 7 LYS H 4.840 . 4.840 4.289 4.157 4.406 . 0 0 "[ . 1 . 2 . 3 ]" 1
718 1 55 LEU MD2 1 56 GLU H 5.150 . 5.150 4.117 3.239 5.208 0.058 31 0 "[ . 1 . 2 . 3 ]" 1
719 1 7 LYS H 1 7 LYS HG3 4.540 . 4.540 4.174 3.927 4.391 . 0 0 "[ . 1 . 2 . 3 ]" 1
720 1 10 ILE HB 1 12 ASN H 5.370 . 5.370 5.079 4.886 5.224 . 0 0 "[ . 1 . 2 . 3 ]" 1
721 1 28 HIS H 1 29 ASP H 4.500 . 4.500 2.659 2.481 2.872 . 0 0 "[ . 1 . 2 . 3 ]" 1
722 1 17 LEU HG 2 14 LYS H 5.500 . 5.500 4.401 3.920 5.281 . 0 0 "[ . 1 . 2 . 3 ]" 1
723 1 36 ARG HA 1 40 LYS H 4.720 . 4.720 4.133 3.851 4.694 . 0 0 "[ . 1 . 2 . 3 ]" 1
724 1 45 PHE QE 2 34 PHE H 5.050 . 5.050 3.285 2.996 3.609 . 0 0 "[ . 1 . 2 . 3 ]" 1
725 1 26 LEU MD2 2 46 MET H 5.180 . 5.180 4.676 3.900 5.144 . 0 0 "[ . 1 . 2 . 3 ]" 1
726 1 33 LEU H 1 33 LEU HB3 3.680 . 3.680 3.585 3.562 3.615 . 0 0 "[ . 1 . 2 . 3 ]" 1
727 1 32 LEU H 1 33 LEU H 3.540 . 3.540 2.729 2.633 2.817 . 0 0 "[ . 1 . 2 . 3 ]" 1
728 1 47 ASN HB3 1 48 VAL H 4.530 . 4.530 4.079 1.809 4.521 . 0 0 "[ . 1 . 2 . 3 ]" 1
729 1 22 ALA H 1 26 LEU H 5.500 . 5.500 5.499 5.351 5.573 0.073 25 0 "[ . 1 . 2 . 3 ]" 1
730 1 34 PHE QE 2 42 ILE H 5.060 . 5.060 3.561 3.221 3.971 . 0 0 "[ . 1 . 2 . 3 ]" 1
731 1 24 HIS H 1 25 GLY H 3.890 . 3.890 2.739 2.603 2.910 . 0 0 "[ . 1 . 2 . 3 ]" 1
732 1 57 HIS HB2 1 58 HIS H 5.010 . 5.010 3.704 2.332 4.567 . 0 0 "[ . 1 . 2 . 3 ]" 1
733 1 17 LEU HG 1 18 ILE H 5.070 . 5.070 4.347 3.380 4.754 . 0 0 "[ . 1 . 2 . 3 ]" 1
734 1 3 MET H 1 4 GLY H 4.630 . 4.630 2.555 2.187 2.864 . 0 0 "[ . 1 . 2 . 3 ]" 1
735 1 26 LEU MD2 1 27 ASP H 5.080 . 5.080 3.882 2.902 4.371 . 0 0 "[ . 1 . 2 . 3 ]" 1
736 1 55 LEU HG 1 56 GLU H 5.340 . 5.340 4.732 3.197 5.242 . 0 0 "[ . 1 . 2 . 3 ]" 1
737 1 10 ILE MD 1 11 GLU H 4.580 . 4.580 4.559 4.425 4.618 0.038 25 0 "[ . 1 . 2 . 3 ]" 1
738 1 10 ILE MD 2 20 LEU H 5.500 . 5.500 5.316 5.028 5.531 0.031 21 0 "[ . 1 . 2 . 3 ]" 1
739 1 10 ILE H 1 10 ILE MD 3.850 . 3.850 3.651 3.504 3.758 . 0 0 "[ . 1 . 2 . 3 ]" 1
740 1 10 ILE MD 2 24 HIS H 4.560 . 4.560 4.142 3.778 4.432 . 0 0 "[ . 1 . 2 . 3 ]" 1
741 1 18 ILE MD 1 35 SER H 4.920 . 4.920 4.227 4.039 4.630 . 0 0 "[ . 1 . 2 . 3 ]" 1
742 1 18 ILE MD 1 19 GLN H 4.430 . 4.430 4.457 4.416 4.492 0.062 10 0 "[ . 1 . 2 . 3 ]" 1
743 1 18 ILE H 1 18 ILE MD 3.770 . 3.770 3.419 3.355 3.455 . 0 0 "[ . 1 . 2 . 3 ]" 1
744 1 10 ILE MG 1 11 GLU H 3.870 . 3.870 3.091 2.991 3.234 . 0 0 "[ . 1 . 2 . 3 ]" 1
745 1 10 ILE MG 1 14 LYS H 4.400 . 4.400 4.000 3.813 4.245 . 0 0 "[ . 1 . 2 . 3 ]" 1
746 1 18 ILE MG 1 19 GLN H 3.760 . 3.760 3.438 3.267 3.555 . 0 0 "[ . 1 . 2 . 3 ]" 1
747 1 18 ILE H 1 18 ILE MG 3.930 . 3.930 3.806 3.770 3.850 . 0 0 "[ . 1 . 2 . 3 ]" 1
748 1 18 ILE MG 1 22 ALA H 4.410 . 4.410 3.878 3.580 4.009 . 0 0 "[ . 1 . 2 . 3 ]" 1
749 1 42 ILE MG 1 46 MET H 4.430 . 4.430 3.896 3.694 4.103 . 0 0 "[ . 1 . 2 . 3 ]" 1
750 1 42 ILE H 1 42 ILE MG 3.880 . 3.880 3.788 3.753 3.838 . 0 0 "[ . 1 . 2 . 3 ]" 1
751 1 22 ALA MB 1 24 HIS H 4.590 . 4.590 4.204 4.127 4.298 . 0 0 "[ . 1 . 2 . 3 ]" 1
752 1 22 ALA H 1 22 ALA MB 2.800 . 2.800 2.192 2.149 2.263 . 0 0 "[ . 1 . 2 . 3 ]" 1
753 1 22 ALA MB 1 23 ARG H 3.230 . 3.230 2.354 2.246 2.605 . 0 0 "[ . 1 . 2 . 3 ]" 1
754 1 22 ALA MB 1 26 LEU H 4.750 . 4.750 4.453 4.021 4.754 0.004 5 0 "[ . 1 . 2 . 3 ]" 1
755 1 19 GLN H 1 22 ALA MB 4.840 . 4.840 4.320 4.241 4.400 . 0 0 "[ . 1 . 2 . 3 ]" 1
756 1 48 VAL H 1 48 VAL MG2 3.950 . 3.950 2.243 1.924 2.701 . 0 0 "[ . 1 . 2 . 3 ]" 1
757 1 48 VAL MG2 1 49 LYS H 4.090 . 4.090 3.962 3.299 4.141 0.051 20 0 "[ . 1 . 2 . 3 ]" 1
758 1 51 LYS H 1 52 VAL MG1 4.660 . 4.660 3.457 2.716 4.576 . 0 0 "[ . 1 . 2 . 3 ]" 1
759 1 52 VAL H 1 52 VAL MG2 3.570 . 3.570 2.134 1.871 3.589 0.019 8 0 "[ . 1 . 2 . 3 ]" 1
760 1 52 VAL MG1 1 53 HIS H 5.190 . 5.190 3.956 3.407 4.367 . 0 0 "[ . 1 . 2 . 3 ]" 1
761 1 52 VAL MG2 1 53 HIS H 5.190 . 5.190 3.333 2.262 4.286 . 0 0 "[ . 1 . 2 . 3 ]" 1
762 1 48 VAL H 1 48 VAL MG1 3.950 . 3.950 3.182 2.471 3.968 0.018 8 0 "[ . 1 . 2 . 3 ]" 1
763 1 51 LYS H 1 52 VAL MG2 4.660 . 4.660 3.657 2.575 4.812 0.152 8 0 "[ . 1 . 2 . 3 ]" 1
764 1 48 VAL MG1 1 49 LYS H 4.090 . 4.090 3.496 2.613 4.023 . 0 0 "[ . 1 . 2 . 3 ]" 1
765 1 31 VAL MG2 1 32 LEU H 4.060 . 4.060 3.740 3.641 3.843 . 0 0 "[ . 1 . 2 . 3 ]" 1
766 1 31 VAL H 1 31 VAL MG2 3.790 . 3.790 1.973 1.866 2.126 . 0 0 "[ . 1 . 2 . 3 ]" 1
767 1 33 LEU H 1 33 LEU MD2 4.230 . 4.230 3.316 3.048 3.537 . 0 0 "[ . 1 . 2 . 3 ]" 1
768 1 20 LEU H 1 20 LEU MD1 3.900 . 3.900 3.588 2.532 3.806 . 0 0 "[ . 1 . 2 . 3 ]" 1
769 1 6 LEU MD2 2 23 ARG H 5.500 . 5.500 4.650 4.197 4.999 . 0 0 "[ . 1 . 2 . 3 ]" 1
770 1 6 LEU H 1 6 LEU MD2 4.420 . 4.420 4.145 4.046 4.240 . 0 0 "[ . 1 . 2 . 3 ]" 1
771 1 17 LEU MD2 1 21 VAL H 4.560 . 4.560 3.444 2.748 4.837 0.277 27 0 "[ . 1 . 2 . 3 ]" 1
772 1 13 LYS HG3 2 17 LEU H 3.970 . 3.970 3.249 2.976 3.499 . 0 0 "[ . 1 . 2 . 3 ]" 1
773 1 13 LYS HG2 2 17 LEU H 4.210 . 4.210 3.257 2.863 3.566 . 0 0 "[ . 1 . 2 . 3 ]" 1
774 1 31 VAL H 1 31 VAL MG1 3.790 . 3.790 3.751 3.698 3.774 . 0 0 "[ . 1 . 2 . 3 ]" 1
775 1 13 LYS HG3 1 14 LYS H 5.100 . 5.100 4.105 3.857 4.407 . 0 0 "[ . 1 . 2 . 3 ]" 1
776 1 14 LYS H 1 14 LYS HG2 5.500 . 5.500 4.382 4.302 4.474 . 0 0 "[ . 1 . 2 . 3 ]" 1
777 1 13 LYS HG3 2 16 GLU H 5.330 . 5.330 5.034 4.760 5.307 . 0 0 "[ . 1 . 2 . 3 ]" 1
778 1 13 LYS HG2 2 16 GLU H 5.500 . 5.500 5.008 4.787 5.241 . 0 0 "[ . 1 . 2 . 3 ]" 1
779 1 44 LYS H 1 44 LYS HG3 5.300 . 5.300 4.441 4.384 4.507 . 0 0 "[ . 1 . 2 . 3 ]" 1
780 1 44 LYS HG2 1 45 PHE H 4.110 . 4.110 3.640 3.330 3.887 . 0 0 "[ . 1 . 2 . 3 ]" 1
781 1 49 LYS H 1 49 LYS HG2 4.310 . 4.310 3.733 2.482 4.348 0.038 25 0 "[ . 1 . 2 . 3 ]" 1
782 1 14 LYS HG2 1 15 LYS H 4.410 . 4.410 3.559 3.414 3.737 . 0 0 "[ . 1 . 2 . 3 ]" 1
783 1 26 LEU MD1 1 27 ASP H 5.080 . 5.080 4.327 4.127 4.496 . 0 0 "[ . 1 . 2 . 3 ]" 1
784 1 26 LEU MD1 2 46 MET H 5.180 . 5.180 4.295 3.408 5.124 . 0 0 "[ . 1 . 2 . 3 ]" 1
785 1 32 LEU H 1 32 LEU MD1 4.270 . 4.270 3.643 3.532 3.775 . 0 0 "[ . 1 . 2 . 3 ]" 1
786 1 6 LEU MD1 2 23 ARG H 5.500 . 5.500 5.027 4.587 5.536 0.036 17 0 "[ . 1 . 2 . 3 ]" 1
787 1 9 LYS H 1 9 LYS HG2 3.980 . 3.980 2.719 2.168 3.670 . 0 0 "[ . 1 . 2 . 3 ]" 1
788 1 9 LYS H 1 9 LYS HG3 3.980 . 3.980 3.293 2.217 3.830 . 0 0 "[ . 1 . 2 . 3 ]" 1
789 1 41 LEU H 1 41 LEU MD1 4.520 . 4.520 4.164 4.087 4.232 . 0 0 "[ . 1 . 2 . 3 ]" 1
790 1 41 LEU MD1 2 38 LEU H 4.390 . 4.390 4.041 2.893 4.403 0.013 15 0 "[ . 1 . 2 . 3 ]" 1
791 1 41 LEU MD1 2 37 ASP H 4.980 . 4.980 4.711 4.356 5.002 0.022 15 0 "[ . 1 . 2 . 3 ]" 1
792 1 27 ASP H 1 30 LYS HG3 4.260 . 4.260 2.314 1.821 2.998 . 0 0 "[ . 1 . 2 . 3 ]" 1
793 1 30 LYS H 1 30 LYS HG2 3.350 . 3.350 2.389 2.089 2.597 . 0 0 "[ . 1 . 2 . 3 ]" 1
794 1 30 LYS HG3 1 31 VAL H 5.500 . 5.500 4.905 4.723 5.087 . 0 0 "[ . 1 . 2 . 3 ]" 1
795 1 32 LEU H 1 32 LEU HG 3.310 . 3.310 2.211 2.108 2.351 . 0 0 "[ . 1 . 2 . 3 ]" 1
796 1 38 LEU H 1 38 LEU HG 4.690 . 4.690 4.378 4.271 4.563 . 0 0 "[ . 1 . 2 . 3 ]" 1
797 1 38 LEU HG 1 39 ASP H 4.920 . 4.920 3.510 3.088 4.864 . 0 0 "[ . 1 . 2 . 3 ]" 1
798 1 38 LEU MD2 1 39 ASP H 5.430 . 5.430 4.124 3.383 4.438 . 0 0 "[ . 1 . 2 . 3 ]" 1
799 1 20 LEU H 1 20 LEU HG 4.450 . 4.450 2.801 2.329 4.335 . 0 0 "[ . 1 . 2 . 3 ]" 1
800 1 55 LEU H 1 55 LEU HG 3.910 . 3.910 3.028 2.085 4.065 0.155 22 0 "[ . 1 . 2 . 3 ]" 1
801 1 36 ARG HG3 1 37 ASP H 5.500 . 5.500 3.211 2.402 4.297 . 0 0 "[ . 1 . 2 . 3 ]" 1
802 1 17 LEU HG 1 21 VAL H 5.500 . 5.500 5.119 3.491 5.778 0.278 30 0 "[ . 1 . 2 . 3 ]" 1
803 1 6 LEU HG 1 7 LYS H 4.780 . 4.780 4.772 4.675 4.818 0.038 28 0 "[ . 1 . 2 . 3 ]" 1
804 1 6 LEU H 1 6 LEU HG 4.600 . 4.600 4.566 4.496 4.606 0.006 6 0 "[ . 1 . 2 . 3 ]" 1
805 1 17 LEU H 1 17 LEU HG 4.600 . 4.600 4.521 4.309 4.621 0.021 26 0 "[ . 1 . 2 . 3 ]" 1
806 1 23 ARG H 1 23 ARG HG2 3.360 . 3.360 2.161 2.030 2.380 . 0 0 "[ . 1 . 2 . 3 ]" 1
807 1 22 ALA H 1 23 ARG HG2 4.660 . 4.660 4.178 4.009 4.384 . 0 0 "[ . 1 . 2 . 3 ]" 1
808 1 21 VAL H 1 23 ARG HG2 4.740 . 4.740 4.685 4.549 4.776 0.036 18 0 "[ . 1 . 2 . 3 ]" 1
809 1 23 ARG HG3 1 24 HIS H 4.690 . 4.690 3.050 2.767 3.270 . 0 0 "[ . 1 . 2 . 3 ]" 1
810 1 26 LEU HG 1 27 ASP H 4.680 . 4.680 3.909 3.320 4.808 0.128 2 0 "[ . 1 . 2 . 3 ]" 1
811 1 26 LEU H 1 26 LEU HG 3.490 . 3.490 3.415 2.772 3.711 0.221 20 0 "[ . 1 . 2 . 3 ]" 1
812 1 19 GLN H 1 19 GLN HB2 2.960 . 2.960 2.464 2.363 2.539 . 0 0 "[ . 1 . 2 . 3 ]" 1
813 1 19 GLN HB2 1 20 LEU H 3.580 . 3.580 2.695 2.418 2.903 . 0 0 "[ . 1 . 2 . 3 ]" 1
814 1 5 GLN H 1 5 GLN HB3 3.890 . 3.890 3.379 2.398 3.670 . 0 0 "[ . 1 . 2 . 3 ]" 1
815 1 5 GLN HB3 1 6 LEU H 4.470 . 4.470 3.771 3.452 4.078 . 0 0 "[ . 1 . 2 . 3 ]" 1
816 1 11 GLU HB2 1 12 ASN H 3.980 . 3.980 2.381 2.250 2.502 . 0 0 "[ . 1 . 2 . 3 ]" 1
817 1 11 GLU H 1 11 GLU HB2 3.770 . 3.770 2.500 2.392 2.622 . 0 0 "[ . 1 . 2 . 3 ]" 1
818 1 51 LYS H 1 51 LYS HD2 5.500 . 5.500 4.564 4.026 4.972 . 0 0 "[ . 1 . 2 . 3 ]" 1
819 1 51 LYS H 1 51 LYS HD3 5.500 . 5.500 4.364 3.535 4.925 . 0 0 "[ . 1 . 2 . 3 ]" 1
820 1 27 ASP H 1 30 LYS HD2 5.500 . 5.500 4.643 4.122 5.276 . 0 0 "[ . 1 . 2 . 3 ]" 1
821 1 27 ASP H 1 30 LYS HD3 5.500 . 5.500 4.884 4.605 5.460 . 0 0 "[ . 1 . 2 . 3 ]" 1
822 1 9 LYS H 1 9 LYS HD2 5.500 . 5.500 4.259 3.298 5.005 . 0 0 "[ . 1 . 2 . 3 ]" 1
823 1 9 LYS H 1 9 LYS HD3 5.500 . 5.500 4.179 3.203 5.014 . 0 0 "[ . 1 . 2 . 3 ]" 1
824 1 14 LYS H 1 14 LYS HD3 4.900 . 4.900 4.647 4.526 4.791 . 0 0 "[ . 1 . 2 . 3 ]" 1
825 1 28 HIS HB2 1 29 ASP H 3.850 . 3.850 3.185 2.405 3.903 0.053 9 0 "[ . 1 . 2 . 3 ]" 1
826 1 14 LYS HD2 1 39 ASP H 4.350 . 4.350 3.888 3.562 4.359 0.009 22 0 "[ . 1 . 2 . 3 ]" 1
827 1 40 LYS H 1 40 LYS HD2 5.500 . 5.500 4.445 2.184 5.559 0.059 15 0 "[ . 1 . 2 . 3 ]" 1
828 1 40 LYS H 1 40 LYS HD3 5.500 . 5.500 4.292 2.679 4.909 . 0 0 "[ . 1 . 2 . 3 ]" 1
829 1 24 HIS HB3 1 25 GLY H 3.800 . 3.800 2.820 2.375 3.118 . 0 0 "[ . 1 . 2 . 3 ]" 1
830 1 24 HIS H 1 24 HIS HB2 3.280 . 3.280 2.615 2.488 2.750 . 0 0 "[ . 1 . 2 . 3 ]" 1
831 1 24 HIS H 1 24 HIS HB3 3.520 . 3.520 2.452 2.283 2.599 . 0 0 "[ . 1 . 2 . 3 ]" 1
832 1 57 HIS HB3 1 58 HIS H 5.010 . 5.010 3.460 1.914 4.291 . 0 0 "[ . 1 . 2 . 3 ]" 1
833 1 23 ARG H 1 23 ARG HB3 2.900 . 2.900 2.646 2.515 2.760 . 0 0 "[ . 1 . 2 . 3 ]" 1
834 1 24 HIS HB3 1 26 LEU H 4.430 . 4.430 3.672 3.191 4.159 . 0 0 "[ . 1 . 2 . 3 ]" 1
835 1 22 ALA H 1 23 ARG HB3 5.500 . 5.500 5.309 5.074 5.510 0.010 6 0 "[ . 1 . 2 . 3 ]" 1
836 1 22 ALA H 1 24 HIS HB2 5.500 . 5.500 5.428 5.200 5.518 0.018 30 0 "[ . 1 . 2 . 3 ]" 1
837 1 22 ALA H 1 24 HIS HB3 5.500 . 5.500 4.910 4.577 5.132 . 0 0 "[ . 1 . 2 . 3 ]" 1
838 1 53 HIS HB2 1 54 LYS H 4.910 . 4.910 3.896 1.869 4.561 . 0 0 "[ . 1 . 2 . 3 ]" 1
839 1 53 HIS HB3 1 54 LYS H 4.910 . 4.910 3.744 1.992 4.493 . 0 0 "[ . 1 . 2 . 3 ]" 1
840 1 18 ILE H 1 18 ILE HG13 3.410 . 3.410 2.081 1.975 2.369 . 0 0 "[ . 1 . 2 . 3 ]" 1
841 1 18 ILE HG13 1 19 GLN H 4.570 . 4.570 4.220 4.098 4.474 . 0 0 "[ . 1 . 2 . 3 ]" 1
842 1 13 LYS HB2 1 14 LYS H 4.180 . 4.180 3.682 3.492 3.824 . 0 0 "[ . 1 . 2 . 3 ]" 1
843 1 21 VAL H 1 24 HIS HB2 5.500 . 5.500 5.374 5.052 5.544 0.044 19 0 "[ . 1 . 2 . 3 ]" 1
844 1 21 VAL H 1 24 HIS HB3 5.500 . 5.500 5.533 5.207 5.602 0.102 6 0 "[ . 1 . 2 . 3 ]" 1
845 1 36 ARG HB2 1 37 ASP H 4.330 . 4.330 3.396 2.289 3.990 . 0 0 "[ . 1 . 2 . 3 ]" 1
846 1 36 ARG HB3 1 37 ASP H 4.330 . 4.330 3.878 3.200 4.177 . 0 0 "[ . 1 . 2 . 3 ]" 1
847 1 13 LYS H 1 13 LYS HB3 3.660 . 3.660 2.676 2.527 2.842 . 0 0 "[ . 1 . 2 . 3 ]" 1
848 1 16 GLU H 1 16 GLU HB2 3.190 . 3.190 2.474 2.302 2.539 . 0 0 "[ . 1 . 2 . 3 ]" 1
849 1 2 GLU HB2 1 3 MET H 5.240 . 5.240 4.153 2.547 4.535 . 0 0 "[ . 1 . 2 . 3 ]" 1
850 1 2 GLU HB3 1 3 MET H 5.240 . 5.240 3.681 1.994 4.407 . 0 0 "[ . 1 . 2 . 3 ]" 1
851 1 42 ILE H 1 42 ILE HG13 3.370 . 3.370 2.269 2.111 2.422 . 0 0 "[ . 1 . 2 . 3 ]" 1
852 1 31 VAL HB 1 32 LEU H 3.470 . 3.470 2.603 2.482 2.727 . 0 0 "[ . 1 . 2 . 3 ]" 1
853 1 31 VAL H 1 31 VAL HB 3.170 . 3.170 2.572 2.441 2.705 . 0 0 "[ . 1 . 2 . 3 ]" 1
854 1 30 LYS H 1 31 VAL HB 5.420 . 5.420 4.851 4.577 5.119 . 0 0 "[ . 1 . 2 . 3 ]" 1
855 1 21 VAL H 1 21 VAL HB 3.360 . 3.360 3.017 2.515 3.552 0.192 8 0 "[ . 1 . 2 . 3 ]" 1
856 1 10 ILE H 1 10 ILE HG13 3.440 . 3.440 2.259 2.121 2.356 . 0 0 "[ . 1 . 2 . 3 ]" 1
857 1 14 LYS H 1 14 LYS HB2 3.470 . 3.470 2.410 2.273 2.598 . 0 0 "[ . 1 . 2 . 3 ]" 1
858 1 7 LYS H 1 7 LYS HB2 2.930 . 2.930 2.078 1.991 2.202 . 0 0 "[ . 1 . 2 . 3 ]" 1
859 1 10 ILE HG13 1 11 GLU H 4.550 . 4.550 4.334 4.192 4.448 . 0 0 "[ . 1 . 2 . 3 ]" 1
860 1 13 LYS H 1 14 LYS HB3 4.760 . 4.760 4.484 4.312 4.629 . 0 0 "[ . 1 . 2 . 3 ]" 1
861 1 12 ASN H 1 14 LYS HB3 5.470 . 5.470 4.887 4.760 5.046 . 0 0 "[ . 1 . 2 . 3 ]" 1
862 1 14 LYS HB3 1 15 LYS H 3.110 . 3.110 2.335 2.167 2.581 . 0 0 "[ . 1 . 2 . 3 ]" 1
863 1 15 LYS H 1 15 LYS HB3 3.590 . 3.590 3.583 3.530 3.625 0.035 13 0 "[ . 1 . 2 . 3 ]" 1
864 1 15 LYS HB3 1 16 GLU H 3.910 . 3.910 3.637 3.451 3.806 . 0 0 "[ . 1 . 2 . 3 ]" 1
865 1 44 LYS HB3 1 45 PHE H 3.380 . 3.380 2.370 2.268 2.582 . 0 0 "[ . 1 . 2 . 3 ]" 1
866 1 44 LYS H 1 44 LYS HB3 3.080 . 3.080 2.479 2.361 2.567 . 0 0 "[ . 1 . 2 . 3 ]" 1
867 1 3 MET H 1 3 MET HG2 3.970 . 3.970 2.857 2.065 3.828 . 0 0 "[ . 1 . 2 . 3 ]" 1
868 1 3 MET H 1 3 MET HG3 3.970 . 3.970 3.069 2.180 3.926 . 0 0 "[ . 1 . 2 . 3 ]" 1
869 1 43 ASN H 1 46 MET HG2 5.500 . 5.500 5.347 4.494 5.613 0.113 9 0 "[ . 1 . 2 . 3 ]" 1
870 1 43 ASN H 1 46 MET HG3 5.500 . 5.500 4.164 3.871 5.023 . 0 0 "[ . 1 . 2 . 3 ]" 1
871 1 48 VAL H 1 48 VAL HB 3.740 . 3.740 3.346 2.529 3.805 0.065 4 0 "[ . 1 . 2 . 3 ]" 1
872 1 9 LYS H 1 9 LYS HB2 2.940 . 2.940 2.502 2.388 2.648 . 0 0 "[ . 1 . 2 . 3 ]" 1
873 1 40 LYS HB2 1 42 ILE H 5.500 . 5.500 5.251 5.000 5.638 0.138 6 0 "[ . 1 . 2 . 3 ]" 1
874 1 40 LYS HB3 1 42 ILE H 5.500 . 5.500 5.442 4.767 5.567 0.067 25 0 "[ . 1 . 2 . 3 ]" 1
875 1 46 MET H 1 46 MET HB2 3.230 . 3.230 2.574 2.315 2.712 . 0 0 "[ . 1 . 2 . 3 ]" 1
876 1 46 MET HB2 1 47 ASN H 3.820 . 3.820 2.844 2.372 3.586 . 0 0 "[ . 1 . 2 . 3 ]" 1
877 1 9 LYS HB3 1 13 LYS H 4.840 . 4.840 4.760 4.468 4.880 0.040 15 0 "[ . 1 . 2 . 3 ]" 1
878 1 9 LYS HB2 1 10 ILE H 3.730 . 3.730 2.578 2.265 2.854 . 0 0 "[ . 1 . 2 . 3 ]" 1
879 1 45 PHE H 1 46 MET HB2 4.940 . 4.940 4.734 4.338 4.962 0.022 28 0 "[ . 1 . 2 . 3 ]" 1
880 1 51 LYS H 1 51 LYS HB3 3.150 . 3.150 2.954 2.587 3.187 0.037 31 0 "[ . 1 . 2 . 3 ]" 1
881 1 49 LYS H 1 49 LYS HB2 4.010 . 4.010 2.642 2.469 3.756 . 0 0 "[ . 1 . 2 . 3 ]" 1
882 1 27 ASP H 1 30 LYS HB2 3.640 . 3.640 2.288 1.931 2.618 . 0 0 "[ . 1 . 2 . 3 ]" 1
883 1 30 LYS H 1 30 LYS HB2 3.180 . 3.180 2.410 2.287 2.542 . 0 0 "[ . 1 . 2 . 3 ]" 1
884 1 54 LYS HB3 1 55 LEU H 4.980 . 4.980 3.733 1.828 4.566 . 0 0 "[ . 1 . 2 . 3 ]" 1
885 1 29 ASP H 1 30 LYS HB2 4.800 . 4.800 4.698 4.559 4.818 0.018 10 0 "[ . 1 . 2 . 3 ]" 1
886 1 5 GLN HG2 1 6 LEU H 5.500 . 5.500 4.348 2.507 5.124 . 0 0 "[ . 1 . 2 . 3 ]" 1
887 1 5 GLN HG3 1 6 LEU H 5.500 . 5.500 4.105 2.431 5.289 . 0 0 "[ . 1 . 2 . 3 ]" 1
888 1 5 GLN H 1 5 GLN HG2 4.390 . 4.390 3.002 2.120 3.702 . 0 0 "[ . 1 . 2 . 3 ]" 1
889 1 19 GLN HG3 1 20 LEU H 4.730 . 4.730 4.348 4.135 4.572 . 0 0 "[ . 1 . 2 . 3 ]" 1
890 1 19 GLN H 1 19 GLN HG3 3.250 . 3.250 2.212 2.054 2.384 . 0 0 "[ . 1 . 2 . 3 ]" 1
891 1 11 GLU H 1 11 GLU HG3 3.790 . 3.790 3.647 2.258 3.816 0.026 15 0 "[ . 1 . 2 . 3 ]" 1
892 1 56 GLU H 1 56 GLU HG2 5.350 . 5.350 3.724 1.790 5.343 . 0 0 "[ . 1 . 2 . 3 ]" 1
893 1 56 GLU H 1 56 GLU HG3 5.350 . 5.350 3.691 2.037 4.904 . 0 0 "[ . 1 . 2 . 3 ]" 1
894 1 2 GLU HG2 1 3 MET H 5.500 . 5.500 4.450 3.206 5.595 0.095 20 0 "[ . 1 . 2 . 3 ]" 1
895 1 2 GLU HG3 1 3 MET H 5.500 . 5.500 4.599 3.435 5.480 . 0 0 "[ . 1 . 2 . 3 ]" 1
896 1 16 GLU HG2 1 17 LEU H 5.500 . 5.500 4.869 4.218 5.079 . 0 0 "[ . 1 . 2 . 3 ]" 1
897 1 16 GLU HG3 1 17 LEU H 5.500 . 5.500 4.449 4.271 4.934 . 0 0 "[ . 1 . 2 . 3 ]" 1
898 1 42 ILE H 1 42 ILE HB 3.300 . 3.300 2.507 2.425 2.602 . 0 0 "[ . 1 . 2 . 3 ]" 1
899 1 42 ILE HB 1 43 ASN H 2.990 . 2.990 2.456 2.202 2.704 . 0 0 "[ . 1 . 2 . 3 ]" 1
900 1 43 ASN H 1 43 ASN HB2 3.250 . 3.250 2.540 2.363 2.783 . 0 0 "[ . 1 . 2 . 3 ]" 1
901 1 43 ASN HB2 1 44 LYS H 3.430 . 3.430 2.803 2.554 2.940 . 0 0 "[ . 1 . 2 . 3 ]" 1
902 1 10 ILE H 1 10 ILE HB 3.390 . 3.390 2.445 2.334 2.545 . 0 0 "[ . 1 . 2 . 3 ]" 1
903 1 43 ASN HB2 1 43 ASN HD22 3.980 . 3.980 3.498 3.436 3.998 0.018 12 0 "[ . 1 . 2 . 3 ]" 1
904 1 34 PHE H 1 34 PHE HB3 3.280 . 3.280 2.447 2.346 2.537 . 0 0 "[ . 1 . 2 . 3 ]" 1
905 1 10 ILE HB 1 11 GLU H 3.560 . 3.560 2.496 2.328 2.590 . 0 0 "[ . 1 . 2 . 3 ]" 1
906 1 34 PHE HB3 1 35 SER H 3.570 . 3.570 2.500 2.415 2.630 . 0 0 "[ . 1 . 2 . 3 ]" 1
907 1 12 ASN H 1 12 ASN HB2 3.280 . 3.280 2.441 2.097 2.761 . 0 0 "[ . 1 . 2 . 3 ]" 1
908 1 8 ASN HB2 1 9 LYS H 3.930 . 3.930 3.637 2.753 3.969 0.039 21 0 "[ . 1 . 2 . 3 ]" 1
909 1 8 ASN HB3 1 9 LYS H 3.930 . 3.930 2.790 2.343 3.795 . 0 0 "[ . 1 . 2 . 3 ]" 1
910 1 18 ILE H 1 18 ILE HB 3.470 . 3.470 2.610 2.500 2.704 . 0 0 "[ . 1 . 2 . 3 ]" 1
911 1 18 ILE HB 1 19 GLN H 3.600 . 3.600 2.606 2.540 2.688 . 0 0 "[ . 1 . 2 . 3 ]" 1
912 1 46 MET H 1 47 ASN HB2 5.450 . 5.450 5.237 4.992 5.460 0.010 2 0 "[ . 1 . 2 . 3 ]" 1
913 1 47 ASN H 1 47 ASN HB2 3.260 . 3.260 3.254 3.143 3.407 0.147 2 0 "[ . 1 . 2 . 3 ]" 1
914 1 47 ASN HB2 1 48 VAL H 4.900 . 4.900 4.375 3.242 4.616 . 0 0 "[ . 1 . 2 . 3 ]" 1
915 1 45 PHE HB2 1 46 MET H 4.000 . 4.000 3.055 2.861 3.282 . 0 0 "[ . 1 . 2 . 3 ]" 1
916 1 45 PHE H 1 45 PHE HB2 3.270 . 3.270 2.281 2.190 2.342 . 0 0 "[ . 1 . 2 . 3 ]" 1
917 1 29 ASP HB2 1 30 LYS H 3.990 . 3.990 3.492 2.523 3.996 0.006 2 0 "[ . 1 . 2 . 3 ]" 1
918 1 29 ASP H 1 29 ASP HB2 3.610 . 3.610 2.891 2.300 3.662 0.052 9 0 "[ . 1 . 2 . 3 ]" 1
919 1 37 ASP HB2 1 38 LEU H 4.130 . 4.130 3.654 3.439 3.806 . 0 0 "[ . 1 . 2 . 3 ]" 1
920 1 37 ASP HB3 1 38 LEU H 4.130 . 4.130 2.544 2.359 2.865 . 0 0 "[ . 1 . 2 . 3 ]" 1
921 1 37 ASP H 1 37 ASP HB3 3.810 . 3.810 2.682 2.460 2.800 . 0 0 "[ . 1 . 2 . 3 ]" 1
922 1 39 ASP H 1 39 ASP HB2 3.200 . 3.200 2.458 2.336 2.558 . 0 0 "[ . 1 . 2 . 3 ]" 1
923 1 39 ASP H 1 39 ASP HB3 3.200 . 3.200 2.585 2.420 2.686 . 0 0 "[ . 1 . 2 . 3 ]" 1
924 1 38 LEU H 1 38 LEU HB2 3.510 . 3.510 2.595 2.400 2.661 . 0 0 "[ . 1 . 2 . 3 ]" 1
925 1 38 LEU H 1 38 LEU HB3 3.510 . 3.510 2.297 2.149 2.560 . 0 0 "[ . 1 . 2 . 3 ]" 1
926 1 14 LYS H 1 14 LYS HE2 4.730 . 4.730 4.227 4.028 4.489 . 0 0 "[ . 1 . 2 . 3 ]" 1
927 1 14 LYS HE2 1 15 LYS H 4.790 . 4.790 3.594 3.379 3.829 . 0 0 "[ . 1 . 2 . 3 ]" 1
928 1 14 LYS HE3 1 15 LYS H 5.140 . 5.140 4.389 4.065 4.626 . 0 0 "[ . 1 . 2 . 3 ]" 1
929 1 6 LEU H 1 6 LEU HB3 3.400 . 3.400 2.418 2.306 2.541 . 0 0 "[ . 1 . 2 . 3 ]" 1
930 1 6 LEU H 1 6 LEU HB2 3.650 . 3.650 2.506 2.385 2.682 . 0 0 "[ . 1 . 2 . 3 ]" 1
931 1 6 LEU HB3 1 7 LYS H 3.390 . 3.390 2.493 2.398 2.579 . 0 0 "[ . 1 . 2 . 3 ]" 1
932 1 27 ASP HB2 1 30 LYS H 4.510 . 4.510 2.754 2.002 4.491 . 0 0 "[ . 1 . 2 . 3 ]" 1
933 1 27 ASP HB3 1 30 LYS H 4.510 . 4.510 3.514 2.495 4.418 . 0 0 "[ . 1 . 2 . 3 ]" 1
934 1 33 LEU H 1 33 LEU HB2 3.020 . 3.020 2.504 2.419 2.599 . 0 0 "[ . 1 . 2 . 3 ]" 1
935 1 27 ASP H 1 27 ASP HB3 3.730 . 3.730 3.437 2.361 3.726 . 0 0 "[ . 1 . 2 . 3 ]" 1
936 1 27 ASP HB2 1 29 ASP H 4.250 . 4.250 3.303 2.829 4.357 0.107 3 0 "[ . 1 . 2 . 3 ]" 1
937 1 27 ASP HB2 1 28 HIS H 4.530 . 4.530 3.408 2.213 3.953 . 0 0 "[ . 1 . 2 . 3 ]" 1
938 1 33 LEU HB3 1 37 ASP H 5.130 . 5.130 5.098 4.757 5.197 0.067 4 0 "[ . 1 . 2 . 3 ]" 1
939 1 33 LEU HB2 1 34 PHE H 3.500 . 3.500 2.502 2.315 2.637 . 0 0 "[ . 1 . 2 . 3 ]" 1
940 1 17 LEU HB3 1 18 ILE H 3.710 . 3.710 2.655 2.387 2.840 . 0 0 "[ . 1 . 2 . 3 ]" 1
941 1 17 LEU H 1 17 LEU HB3 3.140 . 3.140 2.275 2.188 2.392 . 0 0 "[ . 1 . 2 . 3 ]" 1
942 1 16 GLU H 1 17 LEU HB3 4.900 . 4.900 4.659 4.526 4.807 . 0 0 "[ . 1 . 2 . 3 ]" 1
943 1 40 LYS H 1 41 LEU HB3 5.500 . 5.500 4.788 4.467 5.355 . 0 0 "[ . 1 . 2 . 3 ]" 1
944 1 40 LYS H 1 41 LEU HB2 5.500 . 5.500 5.033 4.354 5.264 . 0 0 "[ . 1 . 2 . 3 ]" 1
945 1 41 LEU HB3 1 42 ILE H 3.510 . 3.510 2.574 2.346 2.732 . 0 0 "[ . 1 . 2 . 3 ]" 1
946 1 41 LEU H 1 41 LEU HB3 3.310 . 3.310 2.459 2.354 2.831 . 0 0 "[ . 1 . 2 . 3 ]" 1
947 1 20 LEU HB2 1 21 VAL H 3.740 . 3.740 2.565 2.422 2.787 . 0 0 "[ . 1 . 2 . 3 ]" 1
948 1 20 LEU H 1 20 LEU HB2 3.280 . 3.280 2.466 2.173 2.595 . 0 0 "[ . 1 . 2 . 3 ]" 1
949 1 26 LEU HB3 1 30 LYS H 4.630 . 4.630 4.213 3.811 4.474 . 0 0 "[ . 1 . 2 . 3 ]" 1
950 1 26 LEU HB3 1 31 VAL H 4.100 . 4.100 3.215 2.893 3.625 . 0 0 "[ . 1 . 2 . 3 ]" 1
951 1 26 LEU HB3 1 27 ASP H 3.340 . 3.340 2.766 2.427 2.966 . 0 0 "[ . 1 . 2 . 3 ]" 1
952 1 26 LEU H 1 26 LEU HB2 2.840 . 2.840 2.218 2.053 2.507 . 0 0 "[ . 1 . 2 . 3 ]" 1
953 1 25 GLY H 1 26 LEU HB2 4.280 . 4.280 3.674 3.412 4.055 . 0 0 "[ . 1 . 2 . 3 ]" 1
954 1 4 GLY HA3 1 7 LYS H 4.480 . 4.480 3.545 3.316 4.257 . 0 0 "[ . 1 . 2 . 3 ]" 1
955 1 46 MET H 1 47 ASN HA 5.000 . 5.000 4.647 4.442 5.054 0.054 1 0 "[ . 1 . 2 . 3 ]" 1
956 1 47 ASN HA 1 48 VAL H 3.020 . 3.020 2.692 2.135 3.288 0.268 1 0 "[ . 1 . 2 . 3 ]" 1
957 1 27 ASP HA 1 29 ASP H 4.760 . 4.760 4.412 4.138 4.756 . 0 0 "[ . 1 . 2 . 3 ]" 1
958 1 50 ASP HA 1 52 VAL H 4.280 . 4.280 3.646 2.643 4.308 0.028 31 0 "[ . 1 . 2 . 3 ]" 1
959 1 50 ASP HA 1 51 LYS H 2.600 . 2.600 2.268 2.015 2.687 0.087 8 0 "[ . 1 . 2 . 3 ]" 1
960 1 55 LEU HA 1 56 GLU H 2.760 . 2.760 2.220 1.999 2.779 0.019 23 0 "[ . 1 . 2 . 3 ]" 1
961 1 26 LEU HA 1 27 ASP H 2.590 . 2.590 2.111 2.031 2.310 . 0 0 "[ . 1 . 2 . 3 ]" 1
962 1 53 HIS HA 1 54 LYS H 3.280 . 3.280 2.553 2.078 3.379 0.099 31 0 "[ . 1 . 2 . 3 ]" 1
963 1 8 ASN HA 1 8 ASN HD22 4.980 . 4.980 4.551 3.977 4.845 . 0 0 "[ . 1 . 2 . 3 ]" 1
964 1 43 ASN HA 1 45 PHE H 4.600 . 4.600 4.398 4.185 4.602 0.002 28 0 "[ . 1 . 2 . 3 ]" 1
965 1 43 ASN HA 1 48 VAL H 5.000 . 5.000 3.832 3.088 4.476 . 0 0 "[ . 1 . 2 . 3 ]" 1
966 1 48 VAL H 1 49 LYS HA 5.500 . 5.500 4.967 4.406 5.586 0.086 3 0 "[ . 1 . 2 . 3 ]" 1
967 1 42 ILE H 1 43 ASN HA 5.430 . 5.430 5.306 5.165 5.429 . 0 0 "[ . 1 . 2 . 3 ]" 1
968 1 54 LYS HA 1 55 LEU H 2.680 . 2.680 2.257 2.009 2.739 0.059 6 0 "[ . 1 . 2 . 3 ]" 1
969 1 2 GLU HA 1 3 MET H 3.180 . 3.180 2.166 2.032 2.559 . 0 0 "[ . 1 . 2 . 3 ]" 1
970 1 2 GLU HA 1 4 GLY H 4.060 . 4.060 3.791 3.094 4.162 0.102 18 0 "[ . 1 . 2 . 3 ]" 1
971 1 3 MET HA 1 6 LEU H 4.370 . 4.370 3.130 2.711 3.460 . 0 0 "[ . 1 . 2 . 3 ]" 1
972 1 3 MET HA 1 7 LYS H 4.450 . 4.450 3.757 3.258 4.120 . 0 0 "[ . 1 . 2 . 3 ]" 1
973 1 13 LYS HA 1 16 GLU H 3.820 . 3.820 3.284 3.164 3.414 . 0 0 "[ . 1 . 2 . 3 ]" 1
974 1 37 ASP HA 1 40 LYS H 3.810 . 3.810 3.506 3.190 3.798 . 0 0 "[ . 1 . 2 . 3 ]" 1
975 1 29 ASP HA 1 32 LEU H 3.840 . 3.840 3.449 3.051 3.605 . 0 0 "[ . 1 . 2 . 3 ]" 1
976 1 5 GLN HA 1 7 LYS H 4.770 . 4.770 4.423 4.086 4.694 . 0 0 "[ . 1 . 2 . 3 ]" 1
977 1 29 ASP HA 1 33 LEU H 4.660 . 4.660 4.002 3.685 4.262 . 0 0 "[ . 1 . 2 . 3 ]" 1
978 1 5 GLN HA 1 8 ASN H 3.910 . 3.910 3.212 2.805 3.592 . 0 0 "[ . 1 . 2 . 3 ]" 1
979 1 39 ASP HA 1 42 ILE H 3.850 . 3.850 3.574 3.267 3.811 . 0 0 "[ . 1 . 2 . 3 ]" 1
980 1 39 ASP HA 1 43 ASN H 4.310 . 4.310 4.048 3.820 4.316 0.006 24 0 "[ . 1 . 2 . 3 ]" 1
981 1 20 LEU HA 1 22 ALA H 4.500 . 4.500 4.280 4.163 4.428 . 0 0 "[ . 1 . 2 . 3 ]" 1
982 1 33 LEU HA 1 36 ARG H 3.820 . 3.820 3.769 3.483 3.892 0.072 24 0 "[ . 1 . 2 . 3 ]" 1
983 1 32 LEU HA 1 35 SER H 3.770 . 3.770 3.718 3.508 3.800 0.030 15 0 "[ . 1 . 2 . 3 ]" 1
984 1 41 LEU HA 1 44 LYS H 3.750 . 3.750 3.621 3.365 3.766 0.016 28 0 "[ . 1 . 2 . 3 ]" 1
985 1 16 GLU H 1 17 LEU HA 5.500 . 5.500 5.297 5.190 5.363 . 0 0 "[ . 1 . 2 . 3 ]" 1
986 1 17 LEU HA 1 21 VAL H 4.920 . 4.920 4.037 3.819 4.169 . 0 0 "[ . 1 . 2 . 3 ]" 1
987 1 19 GLN HA 1 21 VAL H 5.370 . 5.370 4.874 4.750 5.012 . 0 0 "[ . 1 . 2 . 3 ]" 1
988 1 19 GLN HA 1 23 ARG H 4.370 . 4.370 3.929 3.768 4.127 . 0 0 "[ . 1 . 2 . 3 ]" 1
989 1 29 ASP H 1 30 LYS HA 5.270 . 5.270 5.224 5.078 5.315 0.045 22 0 "[ . 1 . 2 . 3 ]" 1
990 1 30 LYS HA 1 33 LEU H 3.670 . 3.670 3.473 3.286 3.663 . 0 0 "[ . 1 . 2 . 3 ]" 1
991 1 30 LYS HA 1 34 PHE H 4.280 . 4.280 3.761 3.601 3.890 . 0 0 "[ . 1 . 2 . 3 ]" 1
992 1 30 LYS HA 1 32 LEU H 4.530 . 4.530 4.381 4.237 4.499 . 0 0 "[ . 1 . 2 . 3 ]" 1
993 1 44 LYS HA 1 47 ASN H 4.630 . 4.630 3.956 3.678 4.479 . 0 0 "[ . 1 . 2 . 3 ]" 1
994 1 44 LYS HA 1 46 MET H 4.530 . 4.530 4.527 4.176 4.612 0.082 6 0 "[ . 1 . 2 . 3 ]" 1
995 1 36 ARG HA 1 39 ASP H 3.850 . 3.850 3.469 3.161 3.888 0.038 2 0 "[ . 1 . 2 . 3 ]" 1
996 1 40 LYS HA 1 43 ASN H 3.910 . 3.910 3.496 3.148 3.943 0.033 9 0 "[ . 1 . 2 . 3 ]" 1
997 1 40 LYS HA 1 43 ASN HD21 4.750 . 4.750 2.867 2.161 4.657 . 0 0 "[ . 1 . 2 . 3 ]" 1
998 1 40 LYS HA 1 43 ASN HD22 4.750 . 4.750 4.118 3.270 4.795 0.045 4 0 "[ . 1 . 2 . 3 ]" 1
999 1 28 HIS HA 1 31 VAL H 3.790 . 3.790 3.385 2.923 3.676 . 0 0 "[ . 1 . 2 . 3 ]" 1
1000 1 28 HIS HA 1 30 LYS H 4.430 . 4.430 4.214 3.871 4.450 0.020 3 0 "[ . 1 . 2 . 3 ]" 1
1001 1 34 PHE HA 1 37 ASP H 4.000 . 4.000 3.682 3.532 3.785 . 0 0 "[ . 1 . 2 . 3 ]" 1
1002 1 45 PHE HA 1 47 ASN H 4.230 . 4.230 3.846 3.119 4.380 0.150 2 0 "[ . 1 . 2 . 3 ]" 1
1003 1 35 SER HA 1 39 ASP H 4.300 . 4.300 3.843 3.603 3.999 . 0 0 "[ . 1 . 2 . 3 ]" 1
1004 1 35 SER HA 1 38 LEU H 4.120 . 4.120 3.672 3.378 3.895 . 0 0 "[ . 1 . 2 . 3 ]" 1
1005 1 52 VAL HA 1 53 HIS H 3.430 . 3.430 2.719 2.061 3.474 0.044 32 0 "[ . 1 . 2 . 3 ]" 1
1006 1 48 VAL HA 1 49 LYS H 2.570 . 2.570 2.049 1.819 2.572 0.002 19 0 "[ . 1 . 2 . 3 ]" 1
1007 1 51 LYS H 1 52 VAL HA 5.500 . 5.500 4.654 3.952 5.478 . 0 0 "[ . 1 . 2 . 3 ]" 1
1008 1 35 SER H 1 35 SER HB2 3.620 . 3.620 3.557 2.625 3.622 0.002 2 0 "[ . 1 . 2 . 3 ]" 1
1009 1 35 SER H 1 35 SER HB3 3.620 . 3.620 2.681 2.559 3.579 . 0 0 "[ . 1 . 2 . 3 ]" 1
1010 1 42 ILE HA 1 46 MET H 4.650 . 4.650 4.099 3.785 4.381 . 0 0 "[ . 1 . 2 . 3 ]" 1
1011 1 42 ILE HA 1 45 PHE H 4.180 . 4.180 3.473 3.176 3.667 . 0 0 "[ . 1 . 2 . 3 ]" 1
1012 1 18 ILE HA 1 20 LEU H 4.440 . 4.440 4.210 4.038 4.351 . 0 0 "[ . 1 . 2 . 3 ]" 1
1013 1 21 VAL HA 1 24 HIS H 4.380 . 4.380 3.536 3.214 3.800 . 0 0 "[ . 1 . 2 . 3 ]" 1
1014 1 31 VAL HA 1 35 SER H 4.080 . 4.080 3.784 3.654 4.021 . 0 0 "[ . 1 . 2 . 3 ]" 1
1015 1 30 LYS H 1 31 VAL HA 5.380 . 5.380 5.230 5.045 5.358 . 0 0 "[ . 1 . 2 . 3 ]" 1
1016 1 31 VAL HA 1 33 LEU H 4.910 . 4.910 4.666 4.439 4.883 . 0 0 "[ . 1 . 2 . 3 ]" 1
1017 1 31 VAL HA 1 34 PHE H 3.890 . 3.890 3.641 3.397 3.894 0.004 7 0 "[ . 1 . 2 . 3 ]" 1
1018 1 22 ALA HA 1 24 HIS H 4.500 . 4.500 4.026 3.927 4.129 . 0 0 "[ . 1 . 2 . 3 ]" 1
1019 1 22 ALA HA 1 25 GLY H 4.870 . 4.870 3.901 3.730 4.132 . 0 0 "[ . 1 . 2 . 3 ]" 1
1020 1 25 GLY H 1 26 LEU HA 5.250 . 5.250 4.423 4.199 4.538 . 0 0 "[ . 1 . 2 . 3 ]" 1
1021 1 8 ASN HA 1 11 GLU H 3.960 . 3.960 3.424 3.039 3.819 . 0 0 "[ . 1 . 2 . 3 ]" 1
1022 1 3 MET HA 1 5 GLN H 4.640 . 4.640 4.282 3.743 4.668 0.028 17 0 "[ . 1 . 2 . 3 ]" 1
1023 1 5 GLN HA 1 9 LYS H 4.960 . 4.960 4.140 3.787 4.396 . 0 0 "[ . 1 . 2 . 3 ]" 1
1024 1 6 LEU HA 1 9 LYS H 3.880 . 3.880 3.396 3.166 3.618 . 0 0 "[ . 1 . 2 . 3 ]" 1
1025 1 17 LEU HA 1 20 LEU H 3.850 . 3.850 3.210 3.072 3.395 . 0 0 "[ . 1 . 2 . 3 ]" 1
1026 1 19 GLN HA 1 22 ALA H 3.950 . 3.950 3.555 3.395 3.771 . 0 0 "[ . 1 . 2 . 3 ]" 1
1027 1 11 GLU HA 1 14 LYS H 3.960 . 3.960 3.818 3.698 3.943 . 0 0 "[ . 1 . 2 . 3 ]" 1
1028 1 11 GLU HA 1 15 LYS H 4.090 . 4.090 4.007 3.838 4.107 0.017 4 0 "[ . 1 . 2 . 3 ]" 1
1029 1 9 LYS HA 1 12 ASN H 3.830 . 3.830 3.445 3.155 3.834 0.004 11 0 "[ . 1 . 2 . 3 ]" 1
1030 1 7 LYS HA 1 10 ILE H 3.890 . 3.890 3.266 3.051 3.541 . 0 0 "[ . 1 . 2 . 3 ]" 1
1031 1 15 LYS HA 1 19 GLN H 4.670 . 4.670 3.952 3.655 4.148 . 0 0 "[ . 1 . 2 . 3 ]" 1
1032 1 15 LYS HA 1 18 ILE H 3.830 . 3.830 3.098 2.908 3.224 . 0 0 "[ . 1 . 2 . 3 ]" 1
1033 1 14 LYS HA 1 17 LEU H 3.770 . 3.770 3.614 3.442 3.734 . 0 0 "[ . 1 . 2 . 3 ]" 1
1034 1 10 ILE HA 1 13 LYS H 3.980 . 3.980 3.581 3.395 3.784 . 0 0 "[ . 1 . 2 . 3 ]" 1
1035 1 10 ILE HA 1 14 LYS H 4.440 . 4.440 3.799 3.627 3.980 . 0 0 "[ . 1 . 2 . 3 ]" 1
1036 1 18 ILE HA 1 22 ALA H 4.450 . 4.450 3.896 3.589 4.053 . 0 0 "[ . 1 . 2 . 3 ]" 1
1037 1 21 VAL HA 1 23 ARG H 4.980 . 4.980 4.603 4.291 4.767 . 0 0 "[ . 1 . 2 . 3 ]" 1
1038 1 38 LEU HA 1 41 LEU H 3.600 . 3.600 3.402 3.110 3.605 0.005 27 0 "[ . 1 . 2 . 3 ]" 1
1039 1 55 LEU MD1 1 56 GLU H 5.150 . 5.150 4.485 2.046 5.285 0.135 30 0 "[ . 1 . 2 . 3 ]" 1
1040 1 34 PHE QD 1 35 SER H 4.400 . 4.400 3.308 3.052 3.548 . 0 0 "[ . 1 . 2 . 3 ]" 1
1041 1 34 PHE H 1 34 PHE QD 4.440 . 4.440 4.172 4.109 4.202 . 0 0 "[ . 1 . 2 . 3 ]" 1
1042 1 41 LEU HG 1 42 ILE H 4.960 . 4.960 3.840 3.411 4.948 . 0 0 "[ . 1 . 2 . 3 ]" 1
1043 1 52 VAL HB 1 53 HIS H 4.830 . 4.830 3.614 2.196 4.464 . 0 0 "[ . 1 . 2 . 3 ]" 1
1044 2 31 VAL HA 2 34 PHE QD 4.540 . 4.540 3.757 3.332 4.104 . 0 0 "[ . 1 . 2 . 3 ]" 1
1045 2 31 VAL HA 2 34 PHE HB3 3.930 . 3.930 2.690 2.515 2.884 . 0 0 "[ . 1 . 2 . 3 ]" 1
1046 2 31 VAL HA 2 34 PHE HB2 4.270 . 4.270 3.873 3.513 4.152 . 0 0 "[ . 1 . 2 . 3 ]" 1
1047 2 22 ALA MB 2 31 VAL HA 4.440 . 4.440 3.788 3.569 4.033 . 0 0 "[ . 1 . 2 . 3 ]" 1
1048 2 31 VAL HA 2 31 VAL MG2 3.160 . 3.160 2.468 2.393 2.550 . 0 0 "[ . 1 . 2 . 3 ]" 1
1049 2 31 VAL HA 2 31 VAL MG1 3.180 . 3.180 2.383 2.339 2.431 . 0 0 "[ . 1 . 2 . 3 ]" 1
1050 2 21 VAL HA 2 24 HIS HB2 4.450 . 4.450 2.993 2.591 3.347 . 0 0 "[ . 1 . 2 . 3 ]" 1
1051 2 18 ILE HA 2 34 PHE HZ 4.480 . 4.480 4.422 4.044 4.527 0.047 19 0 "[ . 1 . 2 . 3 ]" 1
1052 2 17 LEU HA 2 18 ILE HA 5.320 . 5.320 4.760 4.667 4.840 . 0 0 "[ . 1 . 2 . 3 ]" 1
1053 2 20 LEU HA 2 21 VAL HA 5.500 . 5.500 4.734 4.570 4.856 . 0 0 "[ . 1 . 2 . 3 ]" 1
1054 2 20 LEU HB2 2 21 VAL HA 4.810 . 4.810 4.507 4.311 4.823 0.013 17 0 "[ . 1 . 2 . 3 ]" 1
1055 2 18 ILE HA 2 22 ALA MB 5.340 . 5.340 4.316 4.115 4.490 . 0 0 "[ . 1 . 2 . 3 ]" 1
1056 2 21 VAL HA 2 22 ALA MB 5.500 . 5.500 4.979 4.925 5.020 . 0 0 "[ . 1 . 2 . 3 ]" 1
1057 1 21 VAL HA 2 10 ILE MD 3.300 . 3.300 2.227 1.939 2.545 . 0 0 "[ . 1 . 2 . 3 ]" 1
1058 2 18 ILE HA 2 34 PHE QE 3.620 . 3.620 2.265 1.849 2.523 . 0 0 "[ . 1 . 2 . 3 ]" 1
1059 2 18 ILE HA 2 34 PHE QD 4.110 . 4.110 3.216 2.960 3.492 . 0 0 "[ . 1 . 2 . 3 ]" 1
1060 2 15 LYS HA 2 18 ILE HA 5.500 . 5.500 5.019 4.773 5.242 . 0 0 "[ . 1 . 2 . 3 ]" 1
1061 2 17 LEU HG 2 18 ILE HA 5.190 . 5.190 4.729 3.322 5.290 0.100 7 0 "[ . 1 . 2 . 3 ]" 1
1062 2 17 LEU MD1 2 18 ILE HA 4.580 . 4.580 2.979 2.282 4.652 0.072 6 0 "[ . 1 . 2 . 3 ]" 1
1063 2 18 ILE HA 2 18 ILE MG 3.270 . 3.270 2.449 2.299 2.541 . 0 0 "[ . 1 . 2 . 3 ]" 1
1064 2 18 ILE HA 2 18 ILE HG12 3.220 . 3.220 2.612 2.546 2.670 . 0 0 "[ . 1 . 2 . 3 ]" 1
1065 2 9 LYS HA 2 10 ILE HA 4.890 . 4.890 4.817 4.736 4.891 0.001 18 0 "[ . 1 . 2 . 3 ]" 1
1066 1 10 ILE HA 2 17 LEU HB2 4.970 . 4.970 4.873 4.524 5.014 0.044 24 0 "[ . 1 . 2 . 3 ]" 1
1067 1 10 ILE HA 2 17 LEU HA 4.630 . 4.630 4.102 3.866 4.326 . 0 0 "[ . 1 . 2 . 3 ]" 1
1068 2 7 LYS HA 2 10 ILE HA 5.500 . 5.500 5.022 4.706 5.286 . 0 0 "[ . 1 . 2 . 3 ]" 1
1069 2 10 ILE HA 2 14 LYS HB2 5.150 . 5.150 4.548 4.275 4.789 . 0 0 "[ . 1 . 2 . 3 ]" 1
1070 2 10 ILE HA 2 10 ILE HG12 3.640 . 3.640 2.432 2.334 2.496 . 0 0 "[ . 1 . 2 . 3 ]" 1
1071 2 10 ILE HA 2 10 ILE MD 4.110 . 4.110 3.786 3.708 3.835 . 0 0 "[ . 1 . 2 . 3 ]" 1
1072 2 42 ILE HA 2 44 LYS H 4.610 . 4.610 4.196 4.026 4.385 . 0 0 "[ . 1 . 2 . 3 ]" 1
1073 1 42 ILE HA 2 34 PHE QE 3.730 . 3.730 2.201 1.980 2.469 . 0 0 "[ . 1 . 2 . 3 ]" 1
1074 1 42 ILE HA 2 21 VAL MG2 4.950 . 4.950 4.089 3.140 4.792 . 0 0 "[ . 1 . 2 . 3 ]" 1
1075 1 42 ILE HA 2 21 VAL MG1 4.950 . 4.950 3.550 2.877 4.431 . 0 0 "[ . 1 . 2 . 3 ]" 1
1076 1 42 ILE HA 2 34 PHE HZ 4.640 . 4.640 3.754 3.485 4.069 . 0 0 "[ . 1 . 2 . 3 ]" 1
1077 1 42 ILE HA 2 34 PHE QD 4.340 . 4.340 3.620 3.413 3.996 . 0 0 "[ . 1 . 2 . 3 ]" 1
1078 2 42 ILE HA 2 45 PHE HB3 4.820 . 4.820 4.768 4.486 4.884 0.064 18 0 "[ . 1 . 2 . 3 ]" 1
1079 2 41 LEU HB3 2 42 ILE HA 4.670 . 4.670 4.226 3.733 4.452 . 0 0 "[ . 1 . 2 . 3 ]" 1
1080 2 42 ILE HA 2 44 LYS HB3 5.000 . 5.000 4.613 4.393 4.889 . 0 0 "[ . 1 . 2 . 3 ]" 1
1081 2 42 ILE HA 2 42 ILE HG13 4.030 . 4.030 2.964 2.867 3.148 . 0 0 "[ . 1 . 2 . 3 ]" 1
1082 2 42 ILE HA 2 42 ILE HG12 3.660 . 3.660 2.428 2.359 2.533 . 0 0 "[ . 1 . 2 . 3 ]" 1
1083 2 42 ILE HA 2 42 ILE MG 3.270 . 3.270 2.466 2.362 2.548 . 0 0 "[ . 1 . 2 . 3 ]" 1
1084 2 48 VAL HA 2 49 LYS HB3 5.500 . 5.500 5.327 4.597 5.594 0.094 16 0 "[ . 1 . 2 . 3 ]" 1
1085 2 48 VAL HA 2 49 LYS HB2 5.500 . 5.500 4.662 4.254 5.647 0.147 29 0 "[ . 1 . 2 . 3 ]" 1
1086 2 48 VAL HA 2 48 VAL MG1 3.270 . 3.270 2.347 2.197 2.465 . 0 0 "[ . 1 . 2 . 3 ]" 1
1087 2 18 ILE HG13 2 35 SER HB2 5.500 . 5.500 5.268 4.953 5.524 0.024 6 0 "[ . 1 . 2 . 3 ]" 1
1088 2 18 ILE HG13 2 35 SER HB3 5.500 . 5.500 4.673 4.420 4.909 . 0 0 "[ . 1 . 2 . 3 ]" 1
1089 2 52 VAL HA 2 53 HIS HA 4.590 . 4.590 4.389 4.215 4.636 0.046 13 0 "[ . 1 . 2 . 3 ]" 1
1090 2 34 PHE QD 2 35 SER HA 4.650 . 4.650 3.396 3.211 3.767 . 0 0 "[ . 1 . 2 . 3 ]" 1
1091 2 18 ILE MD 2 35 SER HA 3.580 . 3.580 2.521 2.189 2.830 . 0 0 "[ . 1 . 2 . 3 ]" 1
1092 2 44 LYS HB3 2 45 PHE HA 4.640 . 4.640 4.237 4.103 4.523 . 0 0 "[ . 1 . 2 . 3 ]" 1
1093 1 45 PHE HA 2 30 LYS HD3 5.280 . 5.280 4.796 3.872 5.354 0.074 15 0 "[ . 1 . 2 . 3 ]" 1
1094 1 45 PHE HA 2 26 LEU MD1 4.370 . 4.370 4.200 3.832 4.422 0.052 5 0 "[ . 1 . 2 . 3 ]" 1
1095 2 44 LYS HG2 2 45 PHE HA 4.440 . 4.440 3.646 3.328 4.120 . 0 0 "[ . 1 . 2 . 3 ]" 1
1096 1 34 PHE HA 2 45 PHE HZ 4.220 . 4.220 3.504 3.089 3.815 . 0 0 "[ . 1 . 2 . 3 ]" 1
1097 1 34 PHE HA 2 45 PHE QE 4.240 . 4.240 3.285 2.797 3.636 . 0 0 "[ . 1 . 2 . 3 ]" 1
1098 2 34 PHE HA 2 37 ASP HB3 4.470 . 4.470 3.316 2.926 4.521 0.051 32 0 "[ . 1 . 2 . 3 ]" 1
1099 2 33 LEU HB2 2 34 PHE HA 4.920 . 4.920 4.292 4.152 4.567 . 0 0 "[ . 1 . 2 . 3 ]" 1
1100 1 34 PHE HA 2 41 LEU MD1 4.630 . 4.630 3.391 2.743 4.571 . 0 0 "[ . 1 . 2 . 3 ]" 1
1101 2 14 LYS HA 2 17 LEU HB3 3.940 . 3.940 2.758 2.432 2.991 . 0 0 "[ . 1 . 2 . 3 ]" 1
1102 2 14 LYS HA 2 14 LYS HG3 3.970 . 3.970 2.735 2.642 2.895 . 0 0 "[ . 1 . 2 . 3 ]" 1
1103 1 14 LYS HA 2 17 LEU HB2 4.360 . 4.360 3.546 3.113 3.873 . 0 0 "[ . 1 . 2 . 3 ]" 1
1104 2 14 LYS HA 2 14 LYS HG2 4.130 . 4.130 3.142 3.002 3.256 . 0 0 "[ . 1 . 2 . 3 ]" 1
1105 1 14 LYS HA 2 17 LEU MD2 4.350 . 4.350 3.310 2.481 3.765 . 0 0 "[ . 1 . 2 . 3 ]" 1
1106 2 14 LYS HA 2 17 LEU HG 5.500 . 5.500 4.609 4.010 5.470 . 0 0 "[ . 1 . 2 . 3 ]" 1
1107 1 14 LYS HA 2 17 LEU HG 5.180 . 5.180 3.475 2.610 4.994 . 0 0 "[ . 1 . 2 . 3 ]" 1
1108 2 14 LYS HA 2 18 ILE MD 4.720 . 4.720 4.414 4.249 4.594 . 0 0 "[ . 1 . 2 . 3 ]" 1
1109 2 15 LYS HA 2 18 ILE HB 3.440 . 3.440 2.535 2.203 2.849 . 0 0 "[ . 1 . 2 . 3 ]" 1
1110 2 15 LYS HA 2 15 LYS HG3 3.630 . 3.630 2.835 2.611 3.089 . 0 0 "[ . 1 . 2 . 3 ]" 1
1111 2 15 LYS HA 2 15 LYS HG2 3.730 . 3.730 2.593 2.508 2.723 . 0 0 "[ . 1 . 2 . 3 ]" 1
1112 2 15 LYS HA 2 18 ILE MG 4.530 . 4.530 3.959 3.725 4.210 . 0 0 "[ . 1 . 2 . 3 ]" 1
1113 2 15 LYS HA 2 18 ILE MD 3.380 . 3.380 1.952 1.878 2.110 . 0 0 "[ . 1 . 2 . 3 ]" 1
1114 2 22 ALA MB 2 28 HIS HA 5.500 . 5.500 5.049 4.351 5.519 0.019 22 0 "[ . 1 . 2 . 3 ]" 1
1115 2 28 HIS HA 2 32 LEU HG 5.500 . 5.500 4.194 3.904 4.546 . 0 0 "[ . 1 . 2 . 3 ]" 1
1116 2 28 HIS HA 2 31 VAL MG2 3.570 . 3.570 2.534 2.041 3.037 . 0 0 "[ . 1 . 2 . 3 ]" 1
1117 2 7 LYS HA 2 46 MET ME 4.800 . 4.800 3.447 2.773 4.814 0.014 24 0 "[ . 1 . 2 . 3 ]" 1
1118 2 7 LYS HA 2 10 ILE MG 4.420 . 4.420 3.691 3.474 3.966 . 0 0 "[ . 1 . 2 . 3 ]" 1
1119 2 6 LEU HB3 2 7 LYS HA 4.500 . 4.500 4.416 4.291 4.511 0.011 27 0 "[ . 1 . 2 . 3 ]" 1
1120 2 7 LYS HA 2 7 LYS HG2 3.940 . 3.940 2.352 2.203 2.467 . 0 0 "[ . 1 . 2 . 3 ]" 1
1121 2 7 LYS HA 2 7 LYS HG3 3.920 . 3.920 3.578 3.543 3.646 . 0 0 "[ . 1 . 2 . 3 ]" 1
1122 2 7 LYS HA 2 10 ILE MD 3.650 . 3.650 2.259 1.922 2.636 . 0 0 "[ . 1 . 2 . 3 ]" 1
1123 2 9 LYS HA 2 13 LYS H 4.730 . 4.730 3.846 3.533 4.103 . 0 0 "[ . 1 . 2 . 3 ]" 1
1124 2 9 LYS HA 2 9 LYS HG2 3.950 . 3.950 2.779 2.376 3.356 . 0 0 "[ . 1 . 2 . 3 ]" 1
1125 2 9 LYS HA 2 9 LYS HG3 3.950 . 3.950 3.353 2.964 3.877 . 0 0 "[ . 1 . 2 . 3 ]" 1
1126 2 9 LYS HA 2 9 LYS HD2 5.100 . 5.100 3.931 2.097 4.877 . 0 0 "[ . 1 . 2 . 3 ]" 1
1127 2 9 LYS HA 2 9 LYS HD3 5.100 . 5.100 3.774 1.927 4.705 . 0 0 "[ . 1 . 2 . 3 ]" 1
1128 2 11 GLU HA 2 12 ASN HA 4.830 . 4.830 4.795 4.657 4.878 0.048 4 0 "[ . 1 . 2 . 3 ]" 1
1129 2 11 GLU HA 2 11 GLU HG3 4.010 . 4.010 3.729 3.230 3.804 . 0 0 "[ . 1 . 2 . 3 ]" 1
1130 2 11 GLU HA 2 14 LYS HB2 3.970 . 3.970 3.588 3.192 4.013 0.043 9 0 "[ . 1 . 2 . 3 ]" 1
1131 2 11 GLU HA 2 14 LYS HB3 3.500 . 3.500 2.688 2.557 2.822 . 0 0 "[ . 1 . 2 . 3 ]" 1
1132 2 16 GLU HA 2 16 GLU HG3 3.900 . 3.900 3.221 3.077 3.673 . 0 0 "[ . 1 . 2 . 3 ]" 1
1133 1 16 GLU HA 2 13 LYS HG2 4.590 . 4.590 4.514 4.059 4.687 0.097 19 0 "[ . 1 . 2 . 3 ]" 1
1134 2 10 ILE MG 2 11 GLU HA 3.940 . 3.940 3.274 3.136 3.422 . 0 0 "[ . 1 . 2 . 3 ]" 1
1135 2 41 LEU HA 2 44 LYS HA 5.500 . 5.500 5.331 4.844 5.535 0.035 13 0 "[ . 1 . 2 . 3 ]" 1
1136 2 43 ASN HA 2 44 LYS HA 4.920 . 4.920 4.881 4.786 4.930 0.010 14 0 "[ . 1 . 2 . 3 ]" 1
1137 2 43 ASN HB3 2 44 LYS HA 5.130 . 5.130 4.445 4.255 4.624 . 0 0 "[ . 1 . 2 . 3 ]" 1
1138 2 44 LYS HA 2 44 LYS HG3 3.630 . 3.630 2.699 2.600 2.840 . 0 0 "[ . 1 . 2 . 3 ]" 1
1139 2 44 LYS HA 2 44 LYS HG2 3.960 . 3.960 3.061 2.934 3.233 . 0 0 "[ . 1 . 2 . 3 ]" 1
1140 2 18 ILE MG 2 19 GLN HA 4.070 . 4.070 3.501 3.259 3.679 . 0 0 "[ . 1 . 2 . 3 ]" 1
1141 2 19 GLN HA 2 31 VAL MG1 4.610 . 4.610 4.174 3.731 4.608 . 0 0 "[ . 1 . 2 . 3 ]" 1
1142 2 36 ARG HA 2 36 ARG HD2 5.500 . 5.500 4.714 4.603 4.866 . 0 0 "[ . 1 . 2 . 3 ]" 1
1143 2 36 ARG HA 2 36 ARG HD3 5.500 . 5.500 5.316 4.411 5.531 0.031 3 0 "[ . 1 . 2 . 3 ]" 1
1144 2 36 ARG HA 2 36 ARG HG3 4.220 . 4.220 3.642 2.874 3.859 . 0 0 "[ . 1 . 2 . 3 ]" 1
1145 2 30 LYS HA 2 33 LEU HB2 3.820 . 3.820 2.868 2.536 3.036 . 0 0 "[ . 1 . 2 . 3 ]" 1
1146 2 30 LYS HA 2 30 LYS HD3 3.420 . 3.420 2.230 1.901 3.082 . 0 0 "[ . 1 . 2 . 3 ]" 1
1147 2 30 LYS HA 2 30 LYS HD2 3.990 . 3.990 3.330 2.884 4.001 0.011 23 0 "[ . 1 . 2 . 3 ]" 1
1148 2 30 LYS HA 2 30 LYS HG3 3.720 . 3.720 3.737 3.685 3.789 0.069 9 0 "[ . 1 . 2 . 3 ]" 1
1149 2 41 LEU HA 2 45 PHE QD 4.590 . 4.590 3.839 3.614 4.198 . 0 0 "[ . 1 . 2 . 3 ]" 1
1150 2 41 LEU HA 2 44 LYS HB3 4.130 . 4.130 2.824 2.438 3.145 . 0 0 "[ . 1 . 2 . 3 ]" 1
1151 2 41 LEU HA 2 44 LYS HB2 3.820 . 3.820 3.117 2.556 3.469 . 0 0 "[ . 1 . 2 . 3 ]" 1
1152 2 41 LEU HA 2 41 LEU HG 3.900 . 3.900 3.200 2.604 3.819 . 0 0 "[ . 1 . 2 . 3 ]" 1
1153 2 29 ASP HA 2 32 LEU HA 5.500 . 5.500 5.323 4.886 5.535 0.035 27 0 "[ . 1 . 2 . 3 ]" 1
1154 2 31 VAL MG2 2 32 LEU HA 5.500 . 5.500 5.385 5.287 5.454 . 0 0 "[ . 1 . 2 . 3 ]" 1
1155 2 6 LEU HA 2 10 ILE H 4.810 . 4.810 4.266 4.073 4.448 . 0 0 "[ . 1 . 2 . 3 ]" 1
1156 2 20 LEU HA 2 24 HIS H 4.630 . 4.630 4.601 4.460 4.682 0.052 26 0 "[ . 1 . 2 . 3 ]" 1
1157 2 23 ARG HA 2 23 ARG HG3 3.790 . 3.790 3.772 3.688 3.822 0.032 32 0 "[ . 1 . 2 . 3 ]" 1
1158 2 23 ARG HA 2 23 ARG HG2 3.890 . 3.890 3.738 3.677 3.813 . 0 0 "[ . 1 . 2 . 3 ]" 1
1159 2 39 ASP HA 2 42 ILE HB 3.920 . 3.920 2.925 2.701 3.397 . 0 0 "[ . 1 . 2 . 3 ]" 1
1160 2 39 ASP HA 2 42 ILE HG13 4.470 . 4.470 3.751 3.404 4.216 . 0 0 "[ . 1 . 2 . 3 ]" 1
1161 2 14 LYS HD3 2 39 ASP HA 4.610 . 4.610 3.512 3.260 3.774 . 0 0 "[ . 1 . 2 . 3 ]" 1
1162 2 39 ASP HA 2 42 ILE MD 4.000 . 4.000 3.051 2.507 3.611 . 0 0 "[ . 1 . 2 . 3 ]" 1
1163 2 38 LEU HG 2 39 ASP HA 5.500 . 5.500 3.750 3.344 5.547 0.047 4 0 "[ . 1 . 2 . 3 ]" 1
1164 2 38 LEU HA 2 42 ILE HG13 5.000 . 5.000 4.081 3.822 4.454 . 0 0 "[ . 1 . 2 . 3 ]" 1
1165 2 38 LEU HA 2 41 LEU HB2 4.140 . 4.140 3.275 2.598 3.749 . 0 0 "[ . 1 . 2 . 3 ]" 1
1166 2 38 LEU HA 2 42 ILE H 4.580 . 4.580 4.118 3.884 4.394 . 0 0 "[ . 1 . 2 . 3 ]" 1
1167 2 38 LEU HA 2 41 LEU HB3 4.030 . 4.030 2.702 2.311 3.263 . 0 0 "[ . 1 . 2 . 3 ]" 1
1168 2 5 GLN HA 2 5 GLN HG3 3.880 . 3.880 3.464 2.443 3.857 . 0 0 "[ . 1 . 2 . 3 ]" 1
1169 2 37 ASP HA 2 40 LYS HD2 4.830 . 4.830 3.679 1.962 4.852 0.022 28 0 "[ . 1 . 2 . 3 ]" 1
1170 2 37 ASP HA 2 40 LYS HD3 4.830 . 4.830 3.208 1.824 4.862 0.032 24 0 "[ . 1 . 2 . 3 ]" 1
1171 1 24 HIS HA 2 6 LEU HG 4.430 . 4.430 3.284 2.833 3.684 . 0 0 "[ . 1 . 2 . 3 ]" 1
1172 1 24 HIS HA 2 6 LEU MD1 4.150 . 4.150 2.683 2.065 3.150 . 0 0 "[ . 1 . 2 . 3 ]" 1
1173 2 13 LYS HA 2 15 LYS H 4.620 . 4.620 4.390 4.284 4.508 . 0 0 "[ . 1 . 2 . 3 ]" 1
1174 2 13 LYS HA 2 13 LYS HE2 4.490 . 4.490 2.823 2.039 3.735 . 0 0 "[ . 1 . 2 . 3 ]" 1
1175 2 13 LYS HA 2 16 GLU HB3 4.220 . 4.220 4.127 3.802 4.269 0.049 30 0 "[ . 1 . 2 . 3 ]" 1
1176 2 13 LYS HA 2 13 LYS HD3 4.370 . 4.370 2.117 1.917 3.829 . 0 0 "[ . 1 . 2 . 3 ]" 1
1177 2 3 MET HA 2 4 GLY HA3 5.080 . 5.080 4.737 4.638 4.821 . 0 0 "[ . 1 . 2 . 3 ]" 1
1178 2 3 MET HA 2 6 LEU HB2 3.740 . 3.740 2.870 2.298 3.399 . 0 0 "[ . 1 . 2 . 3 ]" 1
1179 2 3 MET HA 2 6 LEU HB3 3.970 . 3.970 2.200 1.944 2.685 . 0 0 "[ . 1 . 2 . 3 ]" 1
1180 2 3 MET HA 2 6 LEU HA 5.150 . 5.150 4.831 4.282 5.171 0.021 17 0 "[ . 1 . 2 . 3 ]" 1
1181 2 43 ASN HA 2 47 ASN H 5.360 . 5.360 4.120 2.950 4.800 . 0 0 "[ . 1 . 2 . 3 ]" 1
1182 2 43 ASN HA 2 46 MET HG3 4.640 . 4.640 2.756 2.365 3.921 . 0 0 "[ . 1 . 2 . 3 ]" 1
1183 2 48 VAL HB 2 49 LYS HA 4.650 . 4.650 4.650 4.405 4.752 0.102 17 0 "[ . 1 . 2 . 3 ]" 1
1184 2 43 ASN HA 2 46 MET HB2 3.700 . 3.700 2.379 1.985 2.673 . 0 0 "[ . 1 . 2 . 3 ]" 1
1185 2 12 ASN HA 2 15 LYS HB2 3.890 . 3.890 2.763 2.415 3.115 . 0 0 "[ . 1 . 2 . 3 ]" 1
1186 2 8 ASN HA 2 11 GLU HG3 4.680 . 4.680 3.308 2.558 4.123 . 0 0 "[ . 1 . 2 . 3 ]" 1
1187 2 11 GLU HB3 2 12 ASN HA 4.680 . 4.680 4.238 3.993 4.534 . 0 0 "[ . 1 . 2 . 3 ]" 1
1188 2 8 ASN HA 2 11 GLU HB2 3.690 . 3.690 2.722 2.287 3.177 . 0 0 "[ . 1 . 2 . 3 ]" 1
1189 2 7 LYS HB3 2 8 ASN HA 4.260 . 4.260 3.998 3.785 4.190 . 0 0 "[ . 1 . 2 . 3 ]" 1
1190 2 12 ASN HA 2 15 LYS HD3 3.860 . 3.860 3.032 2.311 3.896 0.036 4 0 "[ . 1 . 2 . 3 ]" 1
1191 1 46 MET HA 2 24 HIS HD2 5.480 . 5.480 4.816 2.466 5.610 0.130 4 0 "[ . 1 . 2 . 3 ]" 1
1192 2 46 MET HA 2 46 MET HG3 4.110 . 4.110 3.491 3.218 3.914 . 0 0 "[ . 1 . 2 . 3 ]" 1
1193 2 45 PHE HB2 2 46 MET HA 4.970 . 4.970 4.800 4.625 4.953 . 0 0 "[ . 1 . 2 . 3 ]" 1
1194 2 26 LEU HA 2 26 LEU HG 3.860 . 3.860 2.799 2.292 3.206 . 0 0 "[ . 1 . 2 . 3 ]" 1
1195 2 26 LEU HA 2 26 LEU MD1 3.880 . 3.880 3.233 2.339 3.805 . 0 0 "[ . 1 . 2 . 3 ]" 1
1196 2 4 GLY HA3 2 7 LYS HB3 4.670 . 4.670 3.662 2.993 4.591 . 0 0 "[ . 1 . 2 . 3 ]" 1
1197 2 26 LEU HB3 2 30 LYS HB2 4.420 . 4.420 1.989 1.775 2.389 . 0 0 "[ . 1 . 2 . 3 ]" 1
1198 2 26 LEU HB3 2 31 VAL MG2 3.670 . 3.670 2.567 2.406 2.789 . 0 0 "[ . 1 . 2 . 3 ]" 1
1199 1 26 LEU HB3 2 45 PHE QD 4.690 . 4.690 4.576 4.253 4.727 0.037 24 0 "[ . 1 . 2 . 3 ]" 1
1200 2 22 ALA HA 2 26 LEU HB2 4.140 . 4.140 1.960 1.803 2.210 . 0 0 "[ . 1 . 2 . 3 ]" 1
1201 2 26 LEU HB2 2 30 LYS HB3 4.610 . 4.610 4.005 3.819 4.229 . 0 0 "[ . 1 . 2 . 3 ]" 1
1202 2 23 ARG H 2 23 ARG HD2 5.500 . 5.500 4.296 3.805 4.728 . 0 0 "[ . 1 . 2 . 3 ]" 1
1203 2 23 ARG H 2 23 ARG HD3 5.500 . 5.500 4.636 4.330 4.875 . 0 0 "[ . 1 . 2 . 3 ]" 1
1204 2 33 LEU MD1 2 36 ARG HD2 6.100 . 6.100 5.655 3.391 6.141 0.041 30 0 "[ . 1 . 2 . 3 ]" 1
1205 2 33 LEU MD1 2 36 ARG HD3 6.100 . 6.100 5.086 2.199 6.164 0.064 27 0 "[ . 1 . 2 . 3 ]" 1
1206 2 17 LEU HA 2 20 LEU HB2 4.350 . 4.350 2.635 2.239 3.075 . 0 0 "[ . 1 . 2 . 3 ]" 1
1207 1 20 LEU HB3 2 10 ILE HG13 3.770 . 3.770 2.551 2.177 2.843 . 0 0 "[ . 1 . 2 . 3 ]" 1
1208 2 30 LYS HB2 2 30 LYS HE2 5.500 . 5.500 4.981 4.702 5.507 0.007 32 0 "[ . 1 . 2 . 3 ]" 1
1209 2 30 LYS HB2 2 30 LYS HE3 5.500 . 5.500 5.096 4.173 5.506 0.006 21 0 "[ . 1 . 2 . 3 ]" 1
1210 2 30 LYS HB3 2 30 LYS HE2 5.500 . 5.500 4.511 4.192 4.946 . 0 0 "[ . 1 . 2 . 3 ]" 1
1211 2 30 LYS HB3 2 30 LYS HE3 5.500 . 5.500 4.606 3.405 4.962 . 0 0 "[ . 1 . 2 . 3 ]" 1
1212 2 30 LYS HE2 2 30 LYS HG3 4.120 . 4.120 3.049 2.465 4.179 0.059 23 0 "[ . 1 . 2 . 3 ]" 1
1213 2 30 LYS HE3 2 30 LYS HG3 4.120 . 4.120 3.340 2.427 3.897 . 0 0 "[ . 1 . 2 . 3 ]" 1
1214 2 44 LYS HE2 2 44 LYS HG3 3.630 . 3.630 2.815 2.471 3.671 0.041 21 0 "[ . 1 . 2 . 3 ]" 1
1215 2 44 LYS HE3 2 44 LYS HG3 3.630 . 3.630 3.418 3.096 3.709 0.079 19 0 "[ . 1 . 2 . 3 ]" 1
1216 1 17 LEU HB3 2 14 LYS HA 4.850 . 4.850 4.496 4.132 4.855 0.005 28 0 "[ . 1 . 2 . 3 ]" 1
1217 2 27 ASP HB3 2 28 HIS H 4.530 . 4.530 2.703 2.088 4.217 . 0 0 "[ . 1 . 2 . 3 ]" 1
1218 2 27 ASP HB3 2 29 ASP H 4.250 . 4.250 3.016 2.593 3.920 . 0 0 "[ . 1 . 2 . 3 ]" 1
1219 1 33 LEU HB2 2 45 PHE HZ 4.110 . 4.110 2.796 2.390 3.301 . 0 0 "[ . 1 . 2 . 3 ]" 1
1220 1 33 LEU HB2 2 45 PHE QE 4.590 . 4.590 2.227 1.917 2.621 . 0 0 "[ . 1 . 2 . 3 ]" 1
1221 2 33 LEU HB3 2 34 PHE H 4.160 . 4.160 3.592 3.344 3.811 . 0 0 "[ . 1 . 2 . 3 ]" 1
1222 1 33 LEU HB3 2 45 PHE HZ 4.250 . 4.250 2.440 2.087 2.930 . 0 0 "[ . 1 . 2 . 3 ]" 1
1223 1 33 LEU HB3 2 45 PHE QE 4.330 . 4.330 3.248 2.726 3.591 . 0 0 "[ . 1 . 2 . 3 ]" 1
1224 2 30 LYS HA 2 33 LEU HB3 4.860 . 4.860 4.527 4.132 4.741 . 0 0 "[ . 1 . 2 . 3 ]" 1
1225 2 6 LEU HB3 2 10 ILE MD 4.630 . 4.630 4.521 4.353 4.643 0.013 3 0 "[ . 1 . 2 . 3 ]" 1
1226 2 6 LEU HB3 2 10 ILE HG13 5.500 . 5.500 5.225 4.938 5.506 0.006 10 0 "[ . 1 . 2 . 3 ]" 1
1227 2 14 LYS HB3 2 14 LYS HE2 4.240 . 4.240 2.001 1.902 2.090 . 0 0 "[ . 1 . 2 . 3 ]" 1
1228 2 11 GLU HA 2 14 LYS HE2 4.230 . 4.230 2.225 1.965 2.601 . 0 0 "[ . 1 . 2 . 3 ]" 1
1229 2 14 LYS HB2 2 14 LYS HE2 4.020 . 4.020 3.201 2.952 3.487 . 0 0 "[ . 1 . 2 . 3 ]" 1
1230 2 14 LYS HE2 2 15 LYS HG3 4.630 . 4.630 2.875 2.411 3.490 . 0 0 "[ . 1 . 2 . 3 ]" 1
1231 2 13 LYS HA 2 13 LYS HE3 4.490 . 4.490 3.668 2.106 4.119 . 0 0 "[ . 1 . 2 . 3 ]" 1
1232 2 14 LYS HB3 2 14 LYS HE3 3.930 . 3.930 3.174 2.899 3.316 . 0 0 "[ . 1 . 2 . 3 ]" 1
1233 2 14 LYS HE3 2 15 LYS HG2 4.740 . 4.740 3.843 3.391 4.225 . 0 0 "[ . 1 . 2 . 3 ]" 1
1234 2 14 LYS HE3 2 18 ILE MD 3.960 . 3.960 2.762 2.198 3.289 . 0 0 "[ . 1 . 2 . 3 ]" 1
1235 2 11 GLU HA 2 14 LYS HE3 4.300 . 4.300 3.923 3.437 4.329 0.029 18 0 "[ . 1 . 2 . 3 ]" 1
1236 2 14 LYS HE3 2 15 LYS HA 4.680 . 4.680 4.464 3.842 4.724 0.044 28 0 "[ . 1 . 2 . 3 ]" 1
1237 2 14 LYS HE3 2 15 LYS HG3 4.340 . 4.340 3.225 2.617 3.557 . 0 0 "[ . 1 . 2 . 3 ]" 1
1238 2 14 LYS HE3 2 14 LYS HG2 4.040 . 4.040 2.476 2.340 2.551 . 0 0 "[ . 1 . 2 . 3 ]" 1
1239 2 14 LYS HE3 2 38 LEU MD2 5.500 . 5.500 4.206 3.830 4.765 . 0 0 "[ . 1 . 2 . 3 ]" 1
1240 2 39 ASP HB2 2 40 LYS H 4.110 . 4.110 3.777 3.556 3.965 . 0 0 "[ . 1 . 2 . 3 ]" 1
1241 2 36 ARG HA 2 39 ASP HB2 3.900 . 3.900 3.203 2.537 3.774 . 0 0 "[ . 1 . 2 . 3 ]" 1
1242 2 36 ARG HA 2 39 ASP HB3 3.910 . 3.910 2.674 2.325 3.036 . 0 0 "[ . 1 . 2 . 3 ]" 1
1243 2 29 ASP H 2 29 ASP HB3 3.610 . 3.610 2.996 2.276 3.679 0.069 18 0 "[ . 1 . 2 . 3 ]" 1
1244 2 29 ASP HB3 2 30 LYS H 3.990 . 3.990 3.337 2.389 3.978 . 0 0 "[ . 1 . 2 . 3 ]" 1
1245 1 45 PHE HB3 2 26 LEU MD1 4.530 . 4.530 2.355 2.105 2.932 . 0 0 "[ . 1 . 2 . 3 ]" 1
1246 2 47 ASN HB2 2 47 ASN HD22 4.000 . 4.000 3.735 3.430 4.029 0.029 24 0 "[ . 1 . 2 . 3 ]" 1
1247 2 12 ASN H 2 12 ASN HB3 3.280 . 3.280 2.469 2.309 2.682 . 0 0 "[ . 1 . 2 . 3 ]" 1
1248 2 11 GLU HB2 2 12 ASN HB2 5.500 . 5.500 4.206 3.890 4.458 . 0 0 "[ . 1 . 2 . 3 ]" 1
1249 2 11 GLU HB2 2 12 ASN HB3 5.500 . 5.500 4.682 4.328 4.960 . 0 0 "[ . 1 . 2 . 3 ]" 1
1250 2 43 ASN H 2 43 ASN HB3 3.680 . 3.680 3.640 3.609 3.669 . 0 0 "[ . 1 . 2 . 3 ]" 1
1251 2 40 LYS HA 2 43 ASN HB3 4.810 . 4.810 4.316 3.846 4.773 . 0 0 "[ . 1 . 2 . 3 ]" 1
1252 2 43 ASN HB3 2 44 LYS HB2 5.500 . 5.500 5.391 5.185 5.530 0.030 23 0 "[ . 1 . 2 . 3 ]" 1
1253 2 43 ASN HB3 2 46 MET HB2 4.500 . 4.500 4.385 3.975 4.544 0.044 19 0 "[ . 1 . 2 . 3 ]" 1
1254 1 34 PHE HB2 2 45 PHE QD 4.800 . 4.800 3.137 2.917 3.336 . 0 0 "[ . 1 . 2 . 3 ]" 1
1255 1 34 PHE HB2 2 45 PHE HZ 5.400 . 5.400 4.168 3.940 4.500 . 0 0 "[ . 1 . 2 . 3 ]" 1
1256 2 7 LYS HA 2 10 ILE HB 3.990 . 3.990 2.346 2.105 2.619 . 0 0 "[ . 1 . 2 . 3 ]" 1
1257 2 18 ILE HG12 2 34 PHE HB3 5.330 . 5.330 4.805 4.276 5.268 . 0 0 "[ . 1 . 2 . 3 ]" 1
1258 2 16 GLU H 2 16 GLU HG2 3.980 . 3.980 3.452 2.582 3.634 . 0 0 "[ . 1 . 2 . 3 ]" 1
1259 2 16 GLU HA 2 16 GLU HG2 3.900 . 3.900 2.534 2.324 2.919 . 0 0 "[ . 1 . 2 . 3 ]" 1
1260 2 11 GLU H 2 11 GLU HG2 3.790 . 3.790 2.264 2.107 3.212 . 0 0 "[ . 1 . 2 . 3 ]" 1
1261 2 8 ASN HA 2 11 GLU HG2 4.680 . 4.680 3.277 2.302 4.690 0.010 2 0 "[ . 1 . 2 . 3 ]" 1
1262 2 11 GLU HA 2 11 GLU HG2 4.010 . 4.010 3.010 2.537 3.141 . 0 0 "[ . 1 . 2 . 3 ]" 1
1263 2 7 LYS HD2 2 11 GLU HG2 4.440 . 4.440 2.973 2.292 3.517 . 0 0 "[ . 1 . 2 . 3 ]" 1
1264 2 11 GLU HG2 2 12 ASN H 5.070 . 5.070 4.231 3.992 4.860 . 0 0 "[ . 1 . 2 . 3 ]" 1
1265 2 11 GLU HG3 2 12 ASN H 5.070 . 5.070 4.690 4.166 4.869 . 0 0 "[ . 1 . 2 . 3 ]" 1
1266 2 19 GLN H 2 19 GLN HG2 3.910 . 3.910 3.477 3.267 3.739 . 0 0 "[ . 1 . 2 . 3 ]" 1
1267 2 19 GLN HA 2 19 GLN HG2 3.720 . 3.720 2.556 2.466 2.731 . 0 0 "[ . 1 . 2 . 3 ]" 1
1268 2 19 GLN HG2 2 22 ALA MB 4.510 . 4.510 4.291 3.653 4.539 0.029 9 0 "[ . 1 . 2 . 3 ]" 1
1269 2 18 ILE MG 2 19 GLN HG2 4.920 . 4.920 4.468 3.774 4.922 0.002 13 0 "[ . 1 . 2 . 3 ]" 1
1270 2 19 GLN HG2 2 31 VAL MG1 5.460 . 5.460 4.999 4.030 5.506 0.046 9 0 "[ . 1 . 2 . 3 ]" 1
1271 2 18 ILE HB 2 19 GLN HG2 5.270 . 5.270 4.673 4.331 5.154 . 0 0 "[ . 1 . 2 . 3 ]" 1
1272 2 19 GLN HA 2 19 GLN HG3 3.870 . 3.870 2.982 2.674 3.136 . 0 0 "[ . 1 . 2 . 3 ]" 1
1273 2 18 ILE MG 2 19 GLN HG3 4.380 . 4.380 4.055 3.415 4.395 0.015 17 0 "[ . 1 . 2 . 3 ]" 1
1274 2 5 GLN H 2 5 GLN HG3 4.390 . 4.390 3.125 2.067 4.034 . 0 0 "[ . 1 . 2 . 3 ]" 1
1275 2 5 GLN HA 2 5 GLN HG2 3.880 . 3.880 3.088 2.520 3.863 . 0 0 "[ . 1 . 2 . 3 ]" 1
1276 1 30 LYS HB2 2 45 PHE QD 4.990 . 4.990 4.014 3.777 4.378 . 0 0 "[ . 1 . 2 . 3 ]" 1
1277 2 49 LYS H 2 49 LYS HB3 4.010 . 4.010 3.583 3.061 3.806 . 0 0 "[ . 1 . 2 . 3 ]" 1
1278 2 51 LYS HB3 2 52 VAL H 4.760 . 4.760 4.443 4.172 4.617 . 0 0 "[ . 1 . 2 . 3 ]" 1
1279 2 46 MET HA 2 46 MET HG2 4.110 . 4.110 2.708 2.453 3.131 . 0 0 "[ . 1 . 2 . 3 ]" 1
1280 2 10 ILE MD 2 46 MET HG2 5.300 . 5.300 3.837 3.381 4.539 . 0 0 "[ . 1 . 2 . 3 ]" 1
1281 1 46 MET HG2 2 21 VAL MG2 5.500 . 5.500 4.094 2.108 4.752 . 0 0 "[ . 1 . 2 . 3 ]" 1
1282 2 43 ASN HA 2 46 MET HG2 4.640 . 4.640 3.956 2.753 4.465 . 0 0 "[ . 1 . 2 . 3 ]" 1
1283 2 10 ILE MD 2 46 MET HG3 5.300 . 5.300 4.435 3.303 5.028 . 0 0 "[ . 1 . 2 . 3 ]" 1
1284 1 46 MET HG3 2 21 VAL MG2 5.500 . 5.500 4.741 3.077 5.567 0.067 8 0 "[ . 1 . 2 . 3 ]" 1
1285 2 3 MET HA 2 3 MET HG2 4.050 . 4.050 3.274 2.401 4.178 0.128 21 0 "[ . 1 . 2 . 3 ]" 1
1286 2 3 MET ME 2 3 MET HG2 3.700 . 3.700 2.775 2.447 3.423 . 0 0 "[ . 1 . 2 . 3 ]" 1
1287 2 3 MET ME 2 3 MET HG3 3.700 . 3.700 2.768 2.440 3.424 . 0 0 "[ . 1 . 2 . 3 ]" 1
1288 2 44 LYS HB3 2 45 PHE HB2 4.670 . 4.670 4.107 3.808 4.280 . 0 0 "[ . 1 . 2 . 3 ]" 1
1289 2 15 LYS H 2 15 LYS HB3 3.590 . 3.590 3.588 3.544 3.619 0.029 25 0 "[ . 1 . 2 . 3 ]" 1
1290 2 12 ASN HA 2 15 LYS HB3 4.940 . 4.940 4.373 3.991 4.726 . 0 0 "[ . 1 . 2 . 3 ]" 1
1291 2 14 LYS HB2 2 14 LYS HE3 4.430 . 4.430 4.215 4.003 4.390 . 0 0 "[ . 1 . 2 . 3 ]" 1
1292 2 14 LYS H 2 15 LYS HB2 5.140 . 5.140 4.831 4.685 5.077 . 0 0 "[ . 1 . 2 . 3 ]" 1
1293 2 43 ASN HB2 2 44 LYS HB2 4.700 . 4.700 4.559 4.226 4.753 0.053 32 0 "[ . 1 . 2 . 3 ]" 1
1294 2 7 LYS HB3 2 10 ILE H 5.500 . 5.500 5.254 5.107 5.426 . 0 0 "[ . 1 . 2 . 3 ]" 1
1295 2 7 LYS HB3 2 8 ASN HB2 5.500 . 5.500 4.601 4.218 4.948 . 0 0 "[ . 1 . 2 . 3 ]" 1
1296 2 7 LYS HB3 2 8 ASN HB3 5.500 . 5.500 5.361 5.020 5.622 0.122 23 0 "[ . 1 . 2 . 3 ]" 1
1297 1 10 ILE HG13 2 20 LEU HB2 4.600 . 4.600 3.821 3.497 4.161 . 0 0 "[ . 1 . 2 . 3 ]" 1
1298 2 9 LYS HB2 2 10 ILE HG13 4.310 . 4.310 3.564 3.081 4.146 . 0 0 "[ . 1 . 2 . 3 ]" 1
1299 2 28 HIS HA 2 31 VAL HB 3.740 . 3.740 3.051 2.329 3.603 . 0 0 "[ . 1 . 2 . 3 ]" 1
1300 2 10 ILE HA 2 13 LYS HB3 4.390 . 4.390 3.086 2.779 3.516 . 0 0 "[ . 1 . 2 . 3 ]" 1
1301 2 36 ARG HB2 2 39 ASP HB3 5.500 . 5.500 4.570 3.910 5.574 0.074 24 0 "[ . 1 . 2 . 3 ]" 1
1302 2 36 ARG HB3 2 39 ASP HB3 5.500 . 5.500 4.902 4.609 5.228 . 0 0 "[ . 1 . 2 . 3 ]" 1
1303 1 42 ILE HG12 2 34 PHE QE 4.710 . 4.710 2.333 1.996 2.654 . 0 0 "[ . 1 . 2 . 3 ]" 1
1304 1 42 ILE HG12 2 34 PHE HZ 4.410 . 4.410 1.990 1.897 2.117 . 0 0 "[ . 1 . 2 . 3 ]" 1
1305 2 44 LYS HD3 2 45 PHE QD 4.920 . 4.920 4.552 3.959 4.958 0.038 24 0 "[ . 1 . 2 . 3 ]" 1
1306 2 11 GLU HA 2 14 LYS HD3 4.380 . 4.380 3.580 3.148 4.186 . 0 0 "[ . 1 . 2 . 3 ]" 1
1307 2 15 LYS HD3 2 16 GLU H 5.500 . 5.500 5.174 4.884 5.534 0.034 22 0 "[ . 1 . 2 . 3 ]" 1
1308 2 14 LYS HE3 2 15 LYS HD2 4.700 . 4.700 4.597 3.746 4.773 0.073 17 0 "[ . 1 . 2 . 3 ]" 1
1309 2 14 LYS HD2 2 39 ASP HB3 5.140 . 5.140 4.853 4.534 5.174 0.034 2 0 "[ . 1 . 2 . 3 ]" 1
1310 2 12 ASN H 2 15 LYS HD2 5.500 . 5.500 5.034 3.792 5.524 0.024 1 0 "[ . 1 . 2 . 3 ]" 1
1311 2 12 ASN H 2 15 LYS HD3 5.500 . 5.500 4.776 4.083 5.563 0.063 22 0 "[ . 1 . 2 . 3 ]" 1
1312 2 15 LYS H 2 15 LYS HD2 4.550 . 4.550 4.245 3.440 4.564 0.014 27 0 "[ . 1 . 2 . 3 ]" 1
1313 2 15 LYS H 2 15 LYS HD3 4.810 . 4.810 4.029 3.610 4.678 . 0 0 "[ . 1 . 2 . 3 ]" 1
1314 2 11 GLU HA 2 15 LYS HD2 4.550 . 4.550 4.363 3.566 4.606 0.056 21 0 "[ . 1 . 2 . 3 ]" 1
1315 2 15 LYS HA 2 15 LYS HD2 4.990 . 4.990 4.729 4.455 4.886 . 0 0 "[ . 1 . 2 . 3 ]" 1
1316 2 15 LYS HA 2 15 LYS HD3 5.290 . 5.290 4.582 4.494 4.632 . 0 0 "[ . 1 . 2 . 3 ]" 1
1317 2 14 LYS HE2 2 15 LYS HD2 4.420 . 4.420 4.171 3.642 4.442 0.022 4 0 "[ . 1 . 2 . 3 ]" 1
1318 2 7 LYS HD2 2 10 ILE MD 4.720 . 4.720 3.329 2.952 4.153 . 0 0 "[ . 1 . 2 . 3 ]" 1
1319 2 7 LYS HD3 2 10 ILE MD 5.080 . 5.080 3.723 3.176 4.573 . 0 0 "[ . 1 . 2 . 3 ]" 1
1320 2 26 LEU MD1 2 30 LYS HD3 4.850 . 4.850 4.780 3.686 5.019 0.169 30 0 "[ . 1 . 2 . 3 ]" 1
1321 2 26 LEU MD2 2 30 LYS HD3 4.850 . 4.850 4.105 2.568 4.501 . 0 0 "[ . 1 . 2 . 3 ]" 1
1322 2 30 LYS H 2 30 LYS HD2 5.300 . 5.300 4.815 4.539 5.015 . 0 0 "[ . 1 . 2 . 3 ]" 1
1323 2 7 LYS HD2 2 8 ASN H 5.260 . 5.260 4.746 4.255 4.965 . 0 0 "[ . 1 . 2 . 3 ]" 1
1324 2 7 LYS HD2 2 8 ASN HA 5.200 . 5.200 4.876 3.920 5.304 0.104 32 0 "[ . 1 . 2 . 3 ]" 1
1325 2 7 LYS HD2 2 11 GLU HG3 4.440 . 4.440 4.296 2.426 4.490 0.050 7 0 "[ . 1 . 2 . 3 ]" 1
1326 2 49 LYS HA 2 49 LYS HD2 5.500 . 5.500 4.420 1.947 5.539 0.039 11 0 "[ . 1 . 2 . 3 ]" 1
1327 2 49 LYS HA 2 49 LYS HD3 5.500 . 5.500 4.333 2.041 4.947 . 0 0 "[ . 1 . 2 . 3 ]" 1
1328 2 51 LYS HA 2 51 LYS HD2 5.500 . 5.500 4.924 4.637 5.543 0.043 10 0 "[ . 1 . 2 . 3 ]" 1
1329 2 51 LYS HA 2 51 LYS HD3 5.500 . 5.500 4.975 4.579 5.549 0.049 4 0 "[ . 1 . 2 . 3 ]" 1
1330 2 5 GLN HB2 2 6 LEU H 4.470 . 4.470 2.963 2.398 3.996 . 0 0 "[ . 1 . 2 . 3 ]" 1
1331 2 5 GLN H 2 5 GLN HB2 3.890 . 3.890 2.723 2.325 3.676 . 0 0 "[ . 1 . 2 . 3 ]" 1
1332 2 19 GLN HB3 2 20 LEU HA 5.440 . 5.440 4.440 4.237 4.625 . 0 0 "[ . 1 . 2 . 3 ]" 1
1333 2 16 GLU HA 2 19 GLN HB2 3.670 . 3.670 3.084 2.658 3.356 . 0 0 "[ . 1 . 2 . 3 ]" 1
1334 2 19 GLN HB2 2 20 LEU MD1 5.500 . 5.500 4.551 2.786 5.372 . 0 0 "[ . 1 . 2 . 3 ]" 1
1335 2 20 LEU HA 2 23 ARG HG3 4.480 . 4.480 3.291 2.935 3.564 . 0 0 "[ . 1 . 2 . 3 ]" 1
1336 1 23 ARG HG3 2 10 ILE MD 4.840 . 4.840 4.670 4.209 4.896 0.056 19 0 "[ . 1 . 2 . 3 ]" 1
1337 2 23 ARG H 2 23 ARG HG3 3.990 . 3.990 3.345 3.124 3.552 . 0 0 "[ . 1 . 2 . 3 ]" 1
1338 2 20 LEU HA 2 23 ARG HG2 4.500 . 4.500 2.028 1.871 2.190 . 0 0 "[ . 1 . 2 . 3 ]" 1
1339 2 41 LEU HG 2 45 PHE QD 5.120 . 5.120 3.732 3.150 5.215 0.095 20 0 "[ . 1 . 2 . 3 ]" 1
1340 1 41 LEU HG 2 38 LEU MD1 5.500 . 5.500 4.529 3.145 5.327 . 0 0 "[ . 1 . 2 . 3 ]" 1
1341 1 41 LEU HG 2 38 LEU MD2 5.500 . 5.500 5.172 4.597 5.674 0.174 14 0 "[ . 1 . 2 . 3 ]" 1
1342 2 17 LEU HG 2 34 PHE HZ 4.550 . 4.550 4.096 3.358 4.431 . 0 0 "[ . 1 . 2 . 3 ]" 1
1343 2 17 LEU HG 2 34 PHE QE 4.540 . 4.540 4.262 3.229 4.624 0.084 2 0 "[ . 1 . 2 . 3 ]" 1
1344 2 36 ARG HA 2 36 ARG HG2 4.220 . 4.220 3.515 2.554 3.760 . 0 0 "[ . 1 . 2 . 3 ]" 1
1345 1 6 LEU HG 2 24 HIS HB2 4.680 . 4.680 4.051 3.434 4.558 . 0 0 "[ . 1 . 2 . 3 ]" 1
1346 1 6 LEU HG 2 23 ARG HB2 5.500 . 5.500 5.319 4.654 5.532 0.032 9 0 "[ . 1 . 2 . 3 ]" 1
1347 2 38 LEU H 2 38 LEU MD2 4.310 . 4.310 4.143 3.998 4.215 . 0 0 "[ . 1 . 2 . 3 ]" 1
1348 2 34 PHE QE 2 38 LEU MD2 4.510 . 4.510 2.598 2.270 4.381 . 0 0 "[ . 1 . 2 . 3 ]" 1
1349 2 34 PHE HZ 2 38 LEU MD2 4.300 . 4.300 2.850 2.479 4.461 0.161 29 0 "[ . 1 . 2 . 3 ]" 1
1350 2 38 LEU HA 2 38 LEU MD2 4.270 . 4.270 3.810 3.187 3.925 . 0 0 "[ . 1 . 2 . 3 ]" 1
1351 2 14 LYS HG3 2 38 LEU MD2 3.620 . 3.620 2.120 1.904 2.532 . 0 0 "[ . 1 . 2 . 3 ]" 1
1352 2 33 LEU HG 2 34 PHE H 5.250 . 5.250 4.393 4.166 5.200 . 0 0 "[ . 1 . 2 . 3 ]" 1
1353 2 30 LYS HA 2 33 LEU HG 5.450 . 5.450 3.901 3.385 5.429 . 0 0 "[ . 1 . 2 . 3 ]" 1
1354 2 33 LEU H 2 33 LEU HG 4.120 . 4.120 2.429 2.119 4.132 0.012 4 0 "[ . 1 . 2 . 3 ]" 1
1355 1 33 LEU HG 2 45 PHE QE 5.460 . 5.460 4.276 3.958 4.831 . 0 0 "[ . 1 . 2 . 3 ]" 1
1356 2 31 VAL MG2 2 32 LEU HG 5.270 . 5.270 4.614 4.351 4.744 . 0 0 "[ . 1 . 2 . 3 ]" 1
1357 2 17 LEU MD1 2 18 ILE H 4.580 . 4.580 3.215 2.644 4.461 . 0 0 "[ . 1 . 2 . 3 ]" 1
1358 2 17 LEU H 2 17 LEU MD1 5.260 . 5.260 3.967 3.808 4.268 . 0 0 "[ . 1 . 2 . 3 ]" 1
1359 2 17 LEU MD1 2 34 PHE HZ 4.410 . 4.410 2.587 1.944 4.208 . 0 0 "[ . 1 . 2 . 3 ]" 1
1360 2 17 LEU MD1 2 34 PHE QE 4.810 . 4.810 2.735 2.025 4.590 . 0 0 "[ . 1 . 2 . 3 ]" 1
1361 1 17 LEU MD1 2 14 LYS HA 4.350 . 4.350 3.829 2.505 4.385 0.035 28 0 "[ . 1 . 2 . 3 ]" 1
1362 2 17 LEU HB3 2 17 LEU MD1 3.510 . 3.510 2.499 2.213 3.164 . 0 0 "[ . 1 . 2 . 3 ]" 1
1363 2 19 GLN HB2 2 20 LEU MD2 5.500 . 5.500 4.180 3.191 5.361 . 0 0 "[ . 1 . 2 . 3 ]" 1
1364 2 20 LEU HB3 2 20 LEU MD2 3.570 . 3.570 2.429 2.299 3.148 . 0 0 "[ . 1 . 2 . 3 ]" 1
1365 2 13 LYS HA 2 13 LYS HD2 4.370 . 4.370 3.614 3.515 3.911 . 0 0 "[ . 1 . 2 . 3 ]" 1
1366 2 30 LYS HG2 2 31 VAL H 4.960 . 4.960 4.417 4.169 4.667 . 0 0 "[ . 1 . 2 . 3 ]" 1
1367 2 30 LYS HA 2 30 LYS HG2 4.060 . 4.060 2.844 2.508 3.040 . 0 0 "[ . 1 . 2 . 3 ]" 1
1368 2 15 LYS HG3 2 18 ILE MD 4.690 . 4.690 3.252 2.736 3.582 . 0 0 "[ . 1 . 2 . 3 ]" 1
1369 1 41 LEU MD1 2 37 ASP HA 5.180 . 5.180 4.799 4.091 5.189 0.009 32 0 "[ . 1 . 2 . 3 ]" 1
1370 1 41 LEU MD1 2 34 PHE QE 4.280 . 4.280 3.773 3.450 4.074 . 0 0 "[ . 1 . 2 . 3 ]" 1
1371 1 41 LEU MD1 2 34 PHE QD 4.190 . 4.190 3.190 2.708 4.293 0.103 6 0 "[ . 1 . 2 . 3 ]" 1
1372 2 41 LEU HA 2 41 LEU MD1 3.980 . 3.980 2.532 2.072 3.933 . 0 0 "[ . 1 . 2 . 3 ]" 1
1373 1 41 LEU MD1 2 37 ASP HB3 4.030 . 4.030 2.508 2.157 3.040 . 0 0 "[ . 1 . 2 . 3 ]" 1
1374 1 41 LEU MD1 2 37 ASP HB2 4.030 . 4.030 3.630 3.279 4.121 0.091 24 0 "[ . 1 . 2 . 3 ]" 1
1375 2 41 LEU HB2 2 41 LEU MD1 3.320 . 3.320 2.458 2.283 3.199 . 0 0 "[ . 1 . 2 . 3 ]" 1
1376 2 7 LYS HG2 2 10 ILE MG 4.980 . 4.980 4.288 3.561 4.940 . 0 0 "[ . 1 . 2 . 3 ]" 1
1377 2 40 LYS H 2 40 LYS HG3 4.320 . 4.320 2.965 2.177 4.314 . 0 0 "[ . 1 . 2 . 3 ]" 1
1378 2 7 LYS HG3 2 10 ILE MD 4.960 . 4.960 4.385 3.829 4.885 . 0 0 "[ . 1 . 2 . 3 ]" 1
1379 1 41 LEU MD2 2 38 LEU H 4.390 . 4.390 2.918 2.598 3.596 . 0 0 "[ . 1 . 2 . 3 ]" 1
1380 1 41 LEU MD2 2 37 ASP H 4.980 . 4.980 4.387 4.179 4.770 . 0 0 "[ . 1 . 2 . 3 ]" 1
1381 2 41 LEU MD2 2 42 ILE H 4.440 . 4.440 4.208 3.466 4.486 0.046 20 0 "[ . 1 . 2 . 3 ]" 1
1382 1 41 LEU MD2 2 34 PHE QE 4.280 . 4.280 3.126 2.036 3.701 . 0 0 "[ . 1 . 2 . 3 ]" 1
1383 1 41 LEU MD2 2 34 PHE QD 4.190 . 4.190 3.404 1.913 4.065 . 0 0 "[ . 1 . 2 . 3 ]" 1
1384 1 41 LEU MD2 2 37 ASP HA 5.180 . 5.180 4.451 4.137 5.190 0.010 30 0 "[ . 1 . 2 . 3 ]" 1
1385 2 41 LEU HA 2 41 LEU MD2 3.980 . 3.980 3.519 2.048 3.916 . 0 0 "[ . 1 . 2 . 3 ]" 1
1386 1 41 LEU MD2 2 34 PHE HA 4.630 . 4.630 3.723 2.654 4.386 . 0 0 "[ . 1 . 2 . 3 ]" 1
1387 1 41 LEU MD2 2 37 ASP HB3 4.030 . 4.030 2.523 2.188 3.237 . 0 0 "[ . 1 . 2 . 3 ]" 1
1388 1 41 LEU MD2 2 37 ASP HB2 4.030 . 4.030 3.990 3.633 4.088 0.058 29 0 "[ . 1 . 2 . 3 ]" 1
1389 2 41 LEU HB2 2 41 LEU MD2 3.320 . 3.320 2.517 2.247 3.225 . 0 0 "[ . 1 . 2 . 3 ]" 1
1390 2 33 LEU H 2 33 LEU MD1 4.230 . 4.230 3.519 2.310 3.673 . 0 0 "[ . 1 . 2 . 3 ]" 1
1391 1 33 LEU MD1 2 45 PHE QE 4.820 . 4.820 2.785 2.378 3.255 . 0 0 "[ . 1 . 2 . 3 ]" 1
1392 2 33 LEU HA 2 33 LEU MD1 3.900 . 3.900 3.703 2.010 3.898 . 0 0 "[ . 1 . 2 . 3 ]" 1
1393 2 6 LEU MD1 2 7 LYS H 4.840 . 4.840 3.045 2.845 3.186 . 0 0 "[ . 1 . 2 . 3 ]" 1
1394 2 6 LEU H 2 6 LEU MD1 4.420 . 4.420 4.119 3.997 4.225 . 0 0 "[ . 1 . 2 . 3 ]" 1
1395 1 26 LEU MD1 2 45 PHE QD 3.820 . 3.820 3.526 2.537 3.950 0.130 5 0 "[ . 1 . 2 . 3 ]" 1
1396 2 26 LEU H 2 26 LEU MD1 4.290 . 4.290 3.277 2.027 4.165 . 0 0 "[ . 1 . 2 . 3 ]" 1
1397 2 55 LEU HA 2 55 LEU MD1 4.280 . 4.280 3.477 1.982 4.140 . 0 0 "[ . 1 . 2 . 3 ]" 1
1398 2 24 HIS HB3 2 26 LEU MD1 4.620 . 4.620 3.831 2.538 4.727 0.107 5 0 "[ . 1 . 2 . 3 ]" 1
1399 1 26 LEU MD1 2 45 PHE HB2 4.510 . 4.510 3.660 3.062 4.408 . 0 0 "[ . 1 . 2 . 3 ]" 1
1400 2 26 LEU MD1 2 30 LYS HB2 4.520 . 4.520 3.517 2.791 4.466 . 0 0 "[ . 1 . 2 . 3 ]" 1
1401 2 14 LYS HG3 2 18 ILE MD 3.420 . 3.420 3.388 3.157 3.452 0.032 20 0 "[ . 1 . 2 . 3 ]" 1
1402 2 13 LYS HG2 2 14 LYS H 5.150 . 5.150 4.781 4.574 4.977 . 0 0 "[ . 1 . 2 . 3 ]" 1
1403 2 14 LYS H 2 14 LYS HG3 5.430 . 5.430 4.394 4.305 4.501 . 0 0 "[ . 1 . 2 . 3 ]" 1
1404 1 13 LYS HG2 2 13 LYS HA 5.070 . 5.070 4.964 4.558 5.103 0.033 8 0 "[ . 1 . 2 . 3 ]" 1
1405 1 13 LYS HG2 2 17 LEU HA 4.500 . 4.500 2.545 2.097 2.988 . 0 0 "[ . 1 . 2 . 3 ]" 1
1406 2 14 LYS HG3 2 42 ILE MD 3.300 . 3.300 2.500 2.216 3.057 . 0 0 "[ . 1 . 2 . 3 ]" 1
1407 2 22 ALA H 2 31 VAL MG2 5.060 . 5.060 4.266 3.994 4.576 . 0 0 "[ . 1 . 2 . 3 ]" 1
1408 2 29 ASP H 2 31 VAL MG2 5.500 . 5.500 4.608 4.361 4.905 . 0 0 "[ . 1 . 2 . 3 ]" 1
1409 2 30 LYS H 2 31 VAL MG2 4.120 . 4.120 3.835 3.674 3.970 . 0 0 "[ . 1 . 2 . 3 ]" 1
1410 2 31 VAL MG2 2 32 LEU H 4.060 . 4.060 3.634 3.455 3.742 . 0 0 "[ . 1 . 2 . 3 ]" 1
1411 2 29 ASP HA 2 31 VAL MG2 5.300 . 5.300 5.325 5.194 5.384 0.084 32 0 "[ . 1 . 2 . 3 ]" 1
1412 2 22 ALA HA 2 31 VAL MG2 3.350 . 3.350 2.585 2.308 2.867 . 0 0 "[ . 1 . 2 . 3 ]" 1
1413 2 17 LEU HB3 2 17 LEU MD2 3.510 . 3.510 2.910 2.116 3.228 . 0 0 "[ . 1 . 2 . 3 ]" 1
1414 2 26 LEU HB2 2 31 VAL MG2 3.550 . 3.550 2.652 2.070 3.308 . 0 0 "[ . 1 . 2 . 3 ]" 1
1415 1 17 LEU MD2 2 14 LYS H 5.500 . 5.500 3.348 2.808 4.510 . 0 0 "[ . 1 . 2 . 3 ]" 1
1416 2 17 LEU MD2 2 18 ILE H 4.580 . 4.580 3.910 3.314 4.139 . 0 0 "[ . 1 . 2 . 3 ]" 1
1417 2 17 LEU MD2 2 34 PHE HZ 4.410 . 4.410 3.338 2.240 3.920 . 0 0 "[ . 1 . 2 . 3 ]" 1
1418 1 6 LEU MD2 2 24 HIS HA 4.150 . 4.150 3.861 3.066 4.183 0.033 5 0 "[ . 1 . 2 . 3 ]" 1
1419 2 30 LYS HA 2 31 VAL MG2 4.900 . 4.900 4.866 4.781 4.907 0.007 26 0 "[ . 1 . 2 . 3 ]" 1
1420 2 17 LEU MD2 2 18 ILE HA 4.580 . 4.580 3.886 3.591 4.088 . 0 0 "[ . 1 . 2 . 3 ]" 1
1421 2 31 VAL MG2 2 34 PHE HB3 4.950 . 4.950 4.658 4.414 4.921 . 0 0 "[ . 1 . 2 . 3 ]" 1
1422 2 30 LYS HB3 2 31 VAL MG2 4.020 . 4.020 4.022 3.842 4.074 0.054 16 0 "[ . 1 . 2 . 3 ]" 1
1423 2 22 ALA MB 2 31 VAL MG2 2.860 . 2.860 2.044 1.961 2.151 . 0 0 "[ . 1 . 2 . 3 ]" 1
1424 2 17 LEU MD2 2 21 VAL MG1 4.350 . 4.350 3.339 2.051 4.425 0.075 24 0 "[ . 1 . 2 . 3 ]" 1
1425 2 29 ASP HA 2 32 LEU MD2 4.640 . 4.640 4.409 4.130 4.661 0.021 22 0 "[ . 1 . 2 . 3 ]" 1
1426 2 32 LEU HA 2 32 LEU MD2 3.790 . 3.790 2.085 2.036 2.125 . 0 0 "[ . 1 . 2 . 3 ]" 1
1427 2 21 VAL MG2 2 22 ALA H 3.900 . 3.900 3.151 2.230 3.795 . 0 0 "[ . 1 . 2 . 3 ]" 1
1428 2 21 VAL H 2 21 VAL MG2 3.890 . 3.890 2.221 1.784 3.804 . 0 0 "[ . 1 . 2 . 3 ]" 1
1429 2 21 VAL MG2 2 34 PHE QE 4.220 . 4.220 2.758 2.510 3.770 . 0 0 "[ . 1 . 2 . 3 ]" 1
1430 2 21 VAL MG2 2 34 PHE HZ 4.670 . 4.670 3.019 2.198 4.124 . 0 0 "[ . 1 . 2 . 3 ]" 1
1431 2 21 VAL MG2 2 34 PHE QD 4.220 . 4.220 3.501 2.741 4.189 . 0 0 "[ . 1 . 2 . 3 ]" 1
1432 1 21 VAL MG2 2 46 MET ME 4.560 . 4.560 4.210 2.503 4.703 0.143 10 0 "[ . 1 . 2 . 3 ]" 1
1433 2 19 GLN HB3 2 22 ALA MB 4.550 . 4.550 4.175 3.581 4.559 0.009 21 0 "[ . 1 . 2 . 3 ]" 1
1434 2 22 ALA MB 2 23 ARG HA 3.950 . 3.950 3.812 3.717 3.916 . 0 0 "[ . 1 . 2 . 3 ]" 1
1435 2 19 GLN HA 2 22 ALA MB 3.120 . 3.120 2.374 2.007 2.633 . 0 0 "[ . 1 . 2 . 3 ]" 1
1436 2 19 GLN HG3 2 22 ALA MB 5.250 . 5.250 4.816 4.355 5.054 . 0 0 "[ . 1 . 2 . 3 ]" 1
1437 2 22 ALA MB 2 31 VAL HB 4.120 . 4.120 4.164 4.110 4.221 0.101 11 0 "[ . 1 . 2 . 3 ]" 1
1438 2 22 ALA MB 2 23 ARG HB2 5.200 . 5.200 5.106 4.926 5.255 0.055 17 0 "[ . 1 . 2 . 3 ]" 1
1439 2 22 ALA MB 2 23 ARG HB3 4.130 . 4.130 3.882 3.669 4.084 . 0 0 "[ . 1 . 2 . 3 ]" 1
1440 2 22 ALA MB 2 31 VAL MG1 3.180 . 3.180 2.378 2.212 2.663 . 0 0 "[ . 1 . 2 . 3 ]" 1
1441 2 21 VAL MG2 2 22 ALA MB 4.740 . 4.740 4.065 2.924 4.812 0.072 24 0 "[ . 1 . 2 . 3 ]" 1
1442 2 21 VAL MG1 2 22 ALA MB 4.740 . 4.740 4.514 3.465 4.895 0.155 30 0 "[ . 1 . 2 . 3 ]" 1
1443 2 42 ILE MG 2 43 ASN HB3 5.480 . 5.480 5.342 5.004 5.505 0.025 20 0 "[ . 1 . 2 . 3 ]" 1
1444 2 42 ILE MG 2 43 ASN H 3.560 . 3.560 3.163 2.959 3.341 . 0 0 "[ . 1 . 2 . 3 ]" 1
1445 2 42 ILE MG 2 44 LYS H 4.860 . 4.860 4.796 4.664 4.878 0.018 25 0 "[ . 1 . 2 . 3 ]" 1
1446 1 42 ILE MG 2 34 PHE HZ 4.420 . 4.420 3.630 3.209 3.869 . 0 0 "[ . 1 . 2 . 3 ]" 1
1447 2 42 ILE MG 2 46 MET HA 5.120 . 5.120 4.796 4.490 4.979 . 0 0 "[ . 1 . 2 . 3 ]" 1
1448 2 42 ILE MG 2 43 ASN HA 4.020 . 4.020 3.355 3.070 3.549 . 0 0 "[ . 1 . 2 . 3 ]" 1
1449 2 39 ASP HA 2 42 ILE MG 4.680 . 4.680 4.271 4.063 4.685 0.005 4 0 "[ . 1 . 2 . 3 ]" 1
1450 2 42 ILE MG 2 45 PHE HB2 4.460 . 4.460 4.269 3.913 4.490 0.030 19 0 "[ . 1 . 2 . 3 ]" 1
1451 2 42 ILE MG 2 46 MET HG2 3.730 . 3.730 2.658 2.103 2.994 . 0 0 "[ . 1 . 2 . 3 ]" 1
1452 2 42 ILE MG 2 46 MET HG3 3.730 . 3.730 2.211 1.920 2.489 . 0 0 "[ . 1 . 2 . 3 ]" 1
1453 2 42 ILE MG 2 46 MET ME 3.790 . 3.790 3.341 2.549 3.815 0.025 28 0 "[ . 1 . 2 . 3 ]" 1
1454 2 14 LYS HD3 2 42 ILE MG 4.300 . 4.300 3.632 3.080 4.212 . 0 0 "[ . 1 . 2 . 3 ]" 1
1455 2 18 ILE MG 2 34 PHE QE 4.190 . 4.190 3.257 2.953 3.497 . 0 0 "[ . 1 . 2 . 3 ]" 1
1456 2 18 ILE MG 2 34 PHE QD 3.860 . 3.860 2.127 1.966 2.334 . 0 0 "[ . 1 . 2 . 3 ]" 1
1457 2 18 ILE MG 2 31 VAL HA 4.460 . 4.460 3.381 3.263 3.480 . 0 0 "[ . 1 . 2 . 3 ]" 1
1458 2 18 ILE MG 2 31 VAL HB 4.460 . 4.460 4.471 4.431 4.501 0.041 12 0 "[ . 1 . 2 . 3 ]" 1
1459 2 18 ILE MG 2 22 ALA MB 3.490 . 3.490 2.869 2.571 3.020 . 0 0 "[ . 1 . 2 . 3 ]" 1
1460 2 18 ILE MG 2 31 VAL H 5.500 . 5.500 5.533 5.469 5.584 0.084 21 0 "[ . 1 . 2 . 3 ]" 1
1461 1 10 ILE MG 2 21 VAL HA 4.600 . 4.600 3.943 3.495 4.409 . 0 0 "[ . 1 . 2 . 3 ]" 1
1462 2 10 ILE MG 2 14 LYS HE2 4.940 . 4.940 4.273 3.735 4.771 . 0 0 "[ . 1 . 2 . 3 ]" 1
1463 2 10 ILE MG 2 11 GLU HB3 5.240 . 5.240 5.205 4.967 5.289 0.049 23 0 "[ . 1 . 2 . 3 ]" 1
1464 2 10 ILE MG 2 11 GLU HB2 5.290 . 5.290 4.938 4.764 5.078 . 0 0 "[ . 1 . 2 . 3 ]" 1
1465 2 10 ILE MG 2 14 LYS HB2 3.690 . 3.690 3.256 2.998 3.509 . 0 0 "[ . 1 . 2 . 3 ]" 1
1466 2 10 ILE HG12 2 10 ILE MG 3.730 . 3.730 2.413 2.306 2.461 . 0 0 "[ . 1 . 2 . 3 ]" 1
1467 2 7 LYS HD2 2 10 ILE MG 5.170 . 5.170 3.221 2.844 4.192 . 0 0 "[ . 1 . 2 . 3 ]" 1
1468 2 7 LYS HD3 2 10 ILE MG 5.500 . 5.500 3.724 3.127 4.580 . 0 0 "[ . 1 . 2 . 3 ]" 1
1469 1 10 ILE MG 2 17 LEU HG 5.500 . 5.500 3.903 3.304 4.207 . 0 0 "[ . 1 . 2 . 3 ]" 1
1470 2 10 ILE MG 2 14 LYS HD3 4.210 . 4.210 3.434 3.084 3.833 . 0 0 "[ . 1 . 2 . 3 ]" 1
1471 2 10 ILE H 2 10 ILE MG 3.830 . 3.830 3.766 3.711 3.819 . 0 0 "[ . 1 . 2 . 3 ]" 1
1472 2 10 ILE HA 2 10 ILE MG 3.490 . 3.490 2.548 2.507 2.601 . 0 0 "[ . 1 . 2 . 3 ]" 1
1473 2 10 ILE MG 2 46 MET ME 3.730 . 3.730 3.243 2.296 3.746 0.016 25 0 "[ . 1 . 2 . 3 ]" 1
1474 2 46 MET ME 2 47 ASN H 5.500 . 5.500 5.316 4.625 5.564 0.064 12 0 "[ . 1 . 2 . 3 ]" 1
1475 1 46 MET ME 2 24 HIS HD2 4.210 . 4.210 2.864 2.428 3.759 . 0 0 "[ . 1 . 2 . 3 ]" 1
1476 1 46 MET ME 2 24 HIS HA 5.000 . 5.000 4.681 4.134 5.039 0.039 12 0 "[ . 1 . 2 . 3 ]" 1
1477 1 46 MET ME 2 21 VAL HA 4.200 . 4.200 3.457 2.225 4.254 0.054 2 0 "[ . 1 . 2 . 3 ]" 1
1478 1 46 MET ME 2 24 HIS HB3 4.150 . 4.150 3.414 2.339 4.057 . 0 0 "[ . 1 . 2 . 3 ]" 1
1479 1 46 MET ME 2 24 HIS HB2 3.640 . 3.640 2.954 2.138 3.463 . 0 0 "[ . 1 . 2 . 3 ]" 1
1480 2 10 ILE MD 2 46 MET ME 2.990 . 2.990 2.102 1.831 2.515 . 0 0 "[ . 1 . 2 . 3 ]" 1
1481 1 46 MET ME 2 21 VAL MG1 4.560 . 4.560 3.579 1.843 4.721 0.161 11 0 "[ . 1 . 2 . 3 ]" 1
1482 2 17 LEU H 2 18 ILE MD 4.950 . 4.950 4.990 4.955 5.020 0.070 11 0 "[ . 1 . 2 . 3 ]" 1
1483 2 18 ILE MD 2 39 ASP H 5.100 . 5.100 4.751 4.510 5.072 . 0 0 "[ . 1 . 2 . 3 ]" 1
1484 2 18 ILE MD 2 34 PHE QE 4.540 . 4.540 3.970 3.738 4.300 . 0 0 "[ . 1 . 2 . 3 ]" 1
1485 2 18 ILE MD 2 34 PHE QD 4.340 . 4.340 3.784 3.504 4.121 . 0 0 "[ . 1 . 2 . 3 ]" 1
1486 2 14 LYS HE2 2 18 ILE MD 4.750 . 4.750 3.810 3.464 4.327 . 0 0 "[ . 1 . 2 . 3 ]" 1
1487 2 15 LYS HB3 2 18 ILE MD 4.360 . 4.360 3.879 3.609 4.165 . 0 0 "[ . 1 . 2 . 3 ]" 1
1488 2 18 ILE HB 2 18 ILE MD 3.380 . 3.380 2.363 2.332 2.387 . 0 0 "[ . 1 . 2 . 3 ]" 1
1489 2 39 ASP H 2 42 ILE MD 5.380 . 5.380 4.715 4.398 5.079 . 0 0 "[ . 1 . 2 . 3 ]" 1
1490 1 42 ILE MD 2 34 PHE HZ 4.090 . 4.090 2.892 2.639 3.193 . 0 0 "[ . 1 . 2 . 3 ]" 1
1491 2 14 LYS HA 2 42 ILE MD 4.570 . 4.570 3.939 3.507 4.448 . 0 0 "[ . 1 . 2 . 3 ]" 1
1492 2 14 LYS HE3 2 42 ILE MD 4.670 . 4.670 4.313 4.172 4.471 . 0 0 "[ . 1 . 2 . 3 ]" 1
1493 2 41 LEU HB3 2 42 ILE MD 4.960 . 4.960 4.631 4.213 4.872 . 0 0 "[ . 1 . 2 . 3 ]" 1
1494 2 42 ILE H 2 42 ILE MD 3.910 . 3.910 3.701 3.592 3.842 . 0 0 "[ . 1 . 2 . 3 ]" 1
1495 2 42 ILE HA 2 42 ILE MD 3.960 . 3.960 3.781 3.742 3.836 . 0 0 "[ . 1 . 2 . 3 ]" 1
1496 2 14 LYS HE2 2 42 ILE MD 4.570 . 4.570 4.036 3.493 4.280 . 0 0 "[ . 1 . 2 . 3 ]" 1
1497 2 42 ILE HB 2 42 ILE MD 3.460 . 3.460 2.452 2.379 2.512 . 0 0 "[ . 1 . 2 . 3 ]" 1
1498 2 14 LYS HD2 2 42 ILE MD 3.920 . 3.920 2.512 2.312 3.050 . 0 0 "[ . 1 . 2 . 3 ]" 1
1499 1 42 ILE MD 2 17 LEU HG 4.450 . 4.450 3.219 2.797 3.742 . 0 0 "[ . 1 . 2 . 3 ]" 1
1500 2 14 LYS HD3 2 42 ILE MD 3.480 . 3.480 1.933 1.810 2.197 . 0 0 "[ . 1 . 2 . 3 ]" 1
1501 2 38 LEU HG 2 42 ILE MD 3.950 . 3.950 2.812 2.535 3.997 0.047 29 0 "[ . 1 . 2 . 3 ]" 1
1502 2 7 LYS H 2 10 ILE MD 4.570 . 4.570 4.222 4.012 4.477 . 0 0 "[ . 1 . 2 . 3 ]" 1
1503 1 10 ILE MD 2 21 VAL H 4.540 . 4.540 3.578 3.341 3.948 . 0 0 "[ . 1 . 2 . 3 ]" 1
1504 1 10 ILE MD 2 24 HIS HB3 4.540 . 4.540 3.670 3.177 4.018 . 0 0 "[ . 1 . 2 . 3 ]" 1
1505 1 10 ILE MD 2 24 HIS HB2 4.710 . 4.710 2.619 2.071 3.076 . 0 0 "[ . 1 . 2 . 3 ]" 1
1506 1 10 ILE MD 2 20 LEU HB2 4.740 . 4.740 3.889 3.531 4.339 . 0 0 "[ . 1 . 2 . 3 ]" 1
1507 2 10 ILE HB 2 10 ILE MD 3.400 . 3.400 2.459 2.424 2.491 . 0 0 "[ . 1 . 2 . 3 ]" 1
1508 1 10 ILE MD 2 20 LEU HB3 4.070 . 4.070 3.128 2.578 3.516 . 0 0 "[ . 1 . 2 . 3 ]" 1
1509 1 10 ILE MD 2 20 LEU HA 4.710 . 4.710 4.338 4.075 4.552 . 0 0 "[ . 1 . 2 . 3 ]" 1
1510 2 40 LYS HA 2 40 LYS HG3 3.920 . 3.920 3.063 2.436 3.787 . 0 0 "[ . 1 . 2 . 3 ]" 1
1511 2 40 LYS HA 2 43 ASN HB2 3.640 . 3.640 2.679 2.155 3.131 . 0 0 "[ . 1 . 2 . 3 ]" 1
1512 2 40 LYS HA 2 40 LYS HG2 3.920 . 3.920 2.944 2.419 4.123 0.203 13 0 "[ . 1 . 2 . 3 ]" 1
1513 2 52 VAL H 2 52 VAL MG1 3.570 . 3.570 2.614 2.106 3.627 0.057 8 0 "[ . 1 . 2 . 3 ]" 1
1514 2 48 VAL HA 2 48 VAL MG2 3.270 . 3.270 2.849 2.404 3.257 . 0 0 "[ . 1 . 2 . 3 ]" 1
1515 2 52 VAL HA 2 52 VAL MG1 3.610 . 3.610 2.341 2.269 2.444 . 0 0 "[ . 1 . 2 . 3 ]" 1
1516 2 21 VAL MG1 2 22 ALA H 3.900 . 3.900 3.638 2.474 3.833 . 0 0 "[ . 1 . 2 . 3 ]" 1
1517 2 21 VAL H 2 21 VAL MG1 3.890 . 3.890 2.854 1.745 3.788 . 0 0 "[ . 1 . 2 . 3 ]" 1
1518 2 21 VAL MG1 2 34 PHE QE 4.220 . 4.220 3.164 2.457 3.490 . 0 0 "[ . 1 . 2 . 3 ]" 1
1519 2 21 VAL MG1 2 34 PHE QD 4.220 . 4.220 3.770 3.226 4.252 0.032 26 0 "[ . 1 . 2 . 3 ]" 1
1520 1 21 VAL MG1 2 46 MET HG3 5.500 . 5.500 4.065 3.078 5.459 . 0 0 "[ . 1 . 2 . 3 ]" 1
1521 1 21 VAL MG1 2 42 ILE MG 3.940 . 3.940 2.428 2.021 3.278 . 0 0 "[ . 1 . 2 . 3 ]" 1
1522 1 33 LEU MD2 2 45 PHE QE 4.820 . 4.820 4.589 4.287 4.849 0.029 23 0 "[ . 1 . 2 . 3 ]" 1
1523 2 38 LEU H 2 38 LEU MD1 4.310 . 4.310 4.191 4.124 4.260 . 0 0 "[ . 1 . 2 . 3 ]" 1
1524 2 34 PHE QE 2 38 LEU MD1 4.510 . 4.510 3.785 2.526 4.357 . 0 0 "[ . 1 . 2 . 3 ]" 1
1525 2 34 PHE HZ 2 38 LEU MD1 4.300 . 4.300 3.525 1.988 4.308 0.008 30 0 "[ . 1 . 2 . 3 ]" 1
1526 2 33 LEU MD2 2 36 ARG HD3 6.100 . 6.100 2.853 2.046 4.964 . 0 0 "[ . 1 . 2 . 3 ]" 1
1527 2 38 LEU HA 2 38 LEU MD1 4.270 . 4.270 2.420 2.209 3.746 . 0 0 "[ . 1 . 2 . 3 ]" 1
1528 2 6 LEU HA 2 6 LEU MD2 4.190 . 4.190 2.204 2.123 2.316 . 0 0 "[ . 1 . 2 . 3 ]" 1
1529 2 33 LEU HA 2 33 LEU MD2 3.900 . 3.900 2.195 2.022 3.835 . 0 0 "[ . 1 . 2 . 3 ]" 1
1530 2 55 LEU HA 2 55 LEU MD2 4.280 . 4.280 3.032 1.988 4.119 . 0 0 "[ . 1 . 2 . 3 ]" 1
1531 1 45 PHE QD 2 30 LYS HB3 4.280 . 4.280 2.455 2.134 2.735 . 0 0 "[ . 1 . 2 . 3 ]" 1
1532 1 45 PHE QD 2 30 LYS HD3 4.340 . 4.340 2.871 2.069 3.554 . 0 0 "[ . 1 . 2 . 3 ]" 1
1533 2 18 ILE HG12 2 34 PHE QD 3.980 . 3.980 2.649 2.265 3.101 . 0 0 "[ . 1 . 2 . 3 ]" 1
1534 1 34 PHE QD 2 45 PHE QD 4.170 . 4.170 2.609 2.125 2.996 . 0 0 "[ . 1 . 2 . 3 ]" 1
1535 1 34 PHE QE 2 41 LEU HG 4.730 . 4.730 2.826 2.078 4.777 0.047 16 0 "[ . 1 . 2 . 3 ]" 1
1536 2 18 ILE HG12 2 34 PHE QE 4.050 . 4.050 2.370 2.104 2.750 . 0 0 "[ . 1 . 2 . 3 ]" 1
1537 2 24 HIS HA 2 24 HIS HD2 4.480 . 4.480 3.622 3.029 4.543 0.063 9 0 "[ . 1 . 2 . 3 ]" 1
1538 2 3 MET HA 2 3 MET HG3 4.050 . 4.050 3.475 2.571 4.184 0.134 2 0 "[ . 1 . 2 . 3 ]" 1
1539 2 27 ASP HA 2 28 HIS HA 4.380 . 4.380 4.308 4.183 4.476 0.096 14 0 "[ . 1 . 2 . 3 ]" 1
1540 2 29 ASP HA 2 31 VAL H 4.580 . 4.580 4.386 4.159 4.576 . 0 0 "[ . 1 . 2 . 3 ]" 1
1541 1 30 LYS HA 2 45 PHE QD 4.480 . 4.480 3.438 2.955 3.845 . 0 0 "[ . 1 . 2 . 3 ]" 1
1542 1 31 VAL HA 2 45 PHE QD 5.500 . 5.500 5.143 4.890 5.364 . 0 0 "[ . 1 . 2 . 3 ]" 1
1543 2 32 LEU HA 2 36 ARG H 4.470 . 4.470 4.127 3.887 4.323 . 0 0 "[ . 1 . 2 . 3 ]" 1
1544 2 34 PHE HA 2 34 PHE QD 3.600 . 3.600 2.668 2.501 2.781 . 0 0 "[ . 1 . 2 . 3 ]" 1
1545 2 34 PHE HA 2 38 LEU H 4.560 . 4.560 3.815 3.605 4.005 . 0 0 "[ . 1 . 2 . 3 ]" 1
1546 1 34 PHE QD 2 41 LEU HG 4.500 . 4.500 3.115 2.166 4.617 0.117 20 0 "[ . 1 . 2 . 3 ]" 1
1547 2 43 ASN HA 2 46 MET H 3.930 . 3.930 3.260 2.897 3.475 . 0 0 "[ . 1 . 2 . 3 ]" 1
1548 2 46 MET HA 2 46 MET ME 4.000 . 4.000 3.254 1.839 3.785 . 0 0 "[ . 1 . 2 . 3 ]" 1
1549 2 46 MET ME 2 46 MET HG3 3.690 . 3.690 3.197 2.326 3.438 . 0 0 "[ . 1 . 2 . 3 ]" 1
1550 2 46 MET ME 2 46 MET HG2 3.690 . 3.690 2.531 2.243 3.369 . 0 0 "[ . 1 . 2 . 3 ]" 1
1551 2 20 LEU HA 2 23 ARG H 3.930 . 3.930 3.420 3.193 3.620 . 0 0 "[ . 1 . 2 . 3 ]" 1
1552 2 23 ARG HA 2 26 LEU H 5.210 . 5.210 4.566 4.054 5.219 0.009 13 0 "[ . 1 . 2 . 3 ]" 1
1553 2 20 LEU HB2 2 20 LEU MD2 3.460 . 3.460 2.961 2.192 3.210 . 0 0 "[ . 1 . 2 . 3 ]" 1
1554 2 18 ILE HA 2 18 ILE HG13 4.060 . 4.060 2.863 2.803 2.979 . 0 0 "[ . 1 . 2 . 3 ]" 1
1555 2 52 VAL HA 2 52 VAL MG2 3.610 . 3.610 3.203 2.407 3.254 . 0 0 "[ . 1 . 2 . 3 ]" 1
1556 2 21 VAL MG1 2 34 PHE HZ 4.670 . 4.670 3.285 2.701 3.853 . 0 0 "[ . 1 . 2 . 3 ]" 1
1557 2 32 LEU HA 2 32 LEU MD1 3.790 . 3.790 3.827 3.799 3.852 0.062 6 0 "[ . 1 . 2 . 3 ]" 1
1558 2 26 LEU HA 2 26 LEU MD2 3.880 . 3.880 2.683 1.942 3.741 . 0 0 "[ . 1 . 2 . 3 ]" 1
1559 2 17 LEU MD1 2 21 VAL MG1 4.350 . 4.350 3.384 2.222 4.462 0.112 1 0 "[ . 1 . 2 . 3 ]" 1
1560 2 17 LEU MD1 2 21 VAL MG2 4.350 . 4.350 2.850 2.085 4.436 0.086 22 0 "[ . 1 . 2 . 3 ]" 1
1561 1 45 PHE QE 2 30 LYS HD3 4.660 . 4.660 2.827 2.425 3.449 . 0 0 "[ . 1 . 2 . 3 ]" 1
1562 2 17 LEU HB2 2 20 LEU HB2 5.060 . 5.060 4.730 4.435 5.063 0.003 21 0 "[ . 1 . 2 . 3 ]" 1
1563 2 14 LYS HB3 2 14 LYS HD3 4.100 . 4.100 2.843 2.598 3.017 . 0 0 "[ . 1 . 2 . 3 ]" 1
1564 2 44 LYS HG2 2 45 PHE QD 5.100 . 5.100 3.651 2.982 4.045 . 0 0 "[ . 1 . 2 . 3 ]" 1
1565 2 44 LYS HB2 2 44 LYS HD3 4.090 . 4.090 3.716 2.306 3.860 . 0 0 "[ . 1 . 2 . 3 ]" 1
1566 1 42 ILE MD 2 17 LEU MD1 3.580 . 3.580 2.508 2.148 2.776 . 0 0 "[ . 1 . 2 . 3 ]" 1
1567 1 42 ILE MD 2 17 LEU MD2 3.580 . 3.580 2.181 1.886 2.526 . 0 0 "[ . 1 . 2 . 3 ]" 1
1568 2 20 LEU HA 2 23 ARG HB2 5.160 . 5.160 4.893 4.730 5.005 . 0 0 "[ . 1 . 2 . 3 ]" 1
1569 2 7 LYS HB3 2 7 LYS HD2 3.540 . 3.540 2.840 2.442 3.091 . 0 0 "[ . 1 . 2 . 3 ]" 1
1570 2 26 LEU MD2 2 30 LYS HB2 4.520 . 4.520 2.935 2.695 3.292 . 0 0 "[ . 1 . 2 . 3 ]" 1
1571 2 44 LYS HE2 2 45 PHE QD 5.500 . 5.500 5.092 2.661 5.548 0.048 14 0 "[ . 1 . 2 . 3 ]" 1
1572 2 44 LYS HE3 2 45 PHE QD 5.500 . 5.500 4.774 2.814 5.525 0.025 8 0 "[ . 1 . 2 . 3 ]" 1
1573 1 34 PHE QD 2 45 PHE HB3 4.880 . 4.880 4.029 3.651 4.282 . 0 0 "[ . 1 . 2 . 3 ]" 1
1574 2 29 ASP HA 2 32 LEU MD1 4.640 . 4.640 2.343 1.975 2.765 . 0 0 "[ . 1 . 2 . 3 ]" 1
1575 2 26 LEU HG 2 30 LYS HB2 4.420 . 4.420 3.880 2.778 4.554 0.134 5 0 "[ . 1 . 2 . 3 ]" 1
1576 1 10 ILE HG12 2 20 LEU HB3 4.310 . 4.310 2.092 1.833 2.364 . 0 0 "[ . 1 . 2 . 3 ]" 1
1577 2 30 LYS HB3 2 30 LYS HD3 3.780 . 3.780 2.922 2.263 3.293 . 0 0 "[ . 1 . 2 . 3 ]" 1
1578 2 7 LYS HB3 2 7 LYS HE2 3.620 . 3.620 2.782 2.022 3.352 . 0 0 "[ . 1 . 2 . 3 ]" 1
1579 2 7 LYS HB3 2 7 LYS HE3 3.620 . 3.620 2.595 2.087 3.658 0.038 22 0 "[ . 1 . 2 . 3 ]" 1
1580 2 42 ILE HG12 2 42 ILE MG 3.260 . 3.260 2.389 2.344 2.438 . 0 0 "[ . 1 . 2 . 3 ]" 1
1581 2 26 LEU HA 2 30 LYS HB3 4.920 . 4.920 3.647 3.186 3.981 . 0 0 "[ . 1 . 2 . 3 ]" 1
1582 2 10 ILE HA 2 13 LYS HB2 4.390 . 4.390 3.684 3.242 4.125 . 0 0 "[ . 1 . 2 . 3 ]" 1
1583 1 26 LEU MD2 2 45 PHE HB2 4.510 . 4.510 3.326 2.854 4.337 . 0 0 "[ . 1 . 2 . 3 ]" 1
1584 2 15 LYS HB2 2 15 LYS HD3 3.310 . 3.310 2.486 2.356 2.861 . 0 0 "[ . 1 . 2 . 3 ]" 1
1585 2 30 LYS H 2 30 LYS HG3 4.050 . 4.050 3.602 3.308 3.858 . 0 0 "[ . 1 . 2 . 3 ]" 1
1586 2 18 ILE HG13 2 34 PHE QE 4.720 . 4.720 3.208 2.809 3.610 . 0 0 "[ . 1 . 2 . 3 ]" 1
1587 1 26 LEU MD2 2 45 PHE QD 3.820 . 3.820 2.637 2.197 3.258 . 0 0 "[ . 1 . 2 . 3 ]" 1
1588 2 20 LEU HB3 2 20 LEU MD1 3.570 . 3.570 2.533 2.335 3.193 . 0 0 "[ . 1 . 2 . 3 ]" 1
1589 1 14 LYS HB2 2 17 LEU HG 4.000 . 4.000 3.610 2.939 4.234 0.234 22 0 "[ . 1 . 2 . 3 ]" 1
1590 2 30 LYS HA 2 30 LYS HE2 5.500 . 5.500 4.630 3.540 5.063 . 0 0 "[ . 1 . 2 . 3 ]" 1
1591 2 30 LYS HA 2 30 LYS HE3 5.500 . 5.500 4.389 1.861 4.944 . 0 0 "[ . 1 . 2 . 3 ]" 1
1592 2 24 HIS HB3 2 26 LEU MD2 4.620 . 4.620 4.389 3.981 4.662 0.042 13 0 "[ . 1 . 2 . 3 ]" 1
1593 2 14 LYS HG3 2 38 LEU MD1 3.620 . 3.620 2.923 2.716 3.322 . 0 0 "[ . 1 . 2 . 3 ]" 1
1594 2 10 ILE MD 2 10 ILE MG 2.730 . 2.730 1.948 1.900 2.034 . 0 0 "[ . 1 . 2 . 3 ]" 1
1595 2 23 ARG H 2 23 ARG HB2 3.630 . 3.630 3.644 3.623 3.663 0.033 24 0 "[ . 1 . 2 . 3 ]" 1
1596 1 21 VAL MG2 2 42 ILE MG 3.940 . 3.940 2.938 2.093 3.973 0.033 18 0 "[ . 1 . 2 . 3 ]" 1
1597 2 22 ALA MB 2 23 ARG HG2 4.520 . 4.520 4.102 3.748 4.451 . 0 0 "[ . 1 . 2 . 3 ]" 1
1598 2 30 LYS HB2 2 30 LYS HD2 4.080 . 4.080 3.661 3.417 4.124 0.044 23 0 "[ . 1 . 2 . 3 ]" 1
1599 2 14 LYS HE3 2 38 LEU MD1 5.500 . 5.500 5.575 5.541 5.614 0.114 5 0 "[ . 1 . 2 . 3 ]" 1
1600 1 45 PHE QE 2 30 LYS HA 4.810 . 4.810 2.521 2.144 2.854 . 0 0 "[ . 1 . 2 . 3 ]" 1
1601 2 44 LYS HB3 2 44 LYS HD2 3.820 . 3.820 2.488 2.355 3.767 . 0 0 "[ . 1 . 2 . 3 ]" 1
1602 2 30 LYS HB2 2 30 LYS HD3 3.970 . 3.970 3.716 3.475 3.828 . 0 0 "[ . 1 . 2 . 3 ]" 1
1603 1 42 ILE HG13 2 34 PHE QE 4.620 . 4.620 2.915 2.660 3.320 . 0 0 "[ . 1 . 2 . 3 ]" 1
1604 2 22 ALA HA 2 26 LEU HB3 4.150 . 4.150 3.371 2.739 3.839 . 0 0 "[ . 1 . 2 . 3 ]" 1
1605 2 21 VAL HB 2 26 LEU MD2 5.500 . 5.500 4.247 2.870 5.513 0.013 9 0 "[ . 1 . 2 . 3 ]" 1
1606 2 28 HIS HA 2 31 VAL MG1 4.710 . 4.710 4.241 3.644 4.716 0.006 4 0 "[ . 1 . 2 . 3 ]" 1
1607 2 44 LYS HB2 2 44 LYS HD2 4.090 . 4.090 3.179 2.981 3.609 . 0 0 "[ . 1 . 2 . 3 ]" 1
1608 2 26 LEU HG 2 30 LYS HB3 3.940 . 3.940 3.241 1.898 4.133 0.193 5 0 "[ . 1 . 2 . 3 ]" 1
1609 2 6 LEU HA 2 6 LEU MD1 4.190 . 4.190 3.352 3.244 3.464 . 0 0 "[ . 1 . 2 . 3 ]" 1
1610 2 9 LYS HB3 2 9 LYS HD2 4.120 . 4.120 2.931 2.313 3.764 . 0 0 "[ . 1 . 2 . 3 ]" 1
1611 2 9 LYS HB3 2 9 LYS HD3 4.120 . 4.120 3.012 2.403 3.812 . 0 0 "[ . 1 . 2 . 3 ]" 1
1612 2 38 LEU HG 2 42 ILE HG12 5.500 . 5.500 4.825 4.546 5.120 . 0 0 "[ . 1 . 2 . 3 ]" 1
1613 2 44 LYS HB3 2 44 LYS HD3 3.820 . 3.820 3.635 2.913 3.703 . 0 0 "[ . 1 . 2 . 3 ]" 1
1614 2 15 LYS HB3 2 15 LYS HD3 3.210 . 3.210 2.985 2.622 3.224 0.014 20 0 "[ . 1 . 2 . 3 ]" 1
1615 2 20 LEU HB2 2 20 LEU MD1 3.460 . 3.460 2.414 2.284 3.201 . 0 0 "[ . 1 . 2 . 3 ]" 1
1616 2 17 LEU MD2 2 34 PHE QE 4.810 . 4.810 3.660 2.668 4.088 . 0 0 "[ . 1 . 2 . 3 ]" 1
1617 1 24 HIS HD2 2 10 ILE MD 5.060 . 5.060 3.865 2.724 5.111 0.051 23 0 "[ . 1 . 2 . 3 ]" 1
1618 2 36 ARG H 2 36 ARG HD2 5.020 . 5.020 3.859 3.664 4.253 . 0 0 "[ . 1 . 2 . 3 ]" 1
1619 2 36 ARG H 2 36 ARG HD3 5.020 . 5.020 4.501 4.138 4.727 . 0 0 "[ . 1 . 2 . 3 ]" 1
1620 2 6 LEU HG 2 10 ILE MD 4.340 . 4.340 4.331 4.185 4.385 0.045 9 0 "[ . 1 . 2 . 3 ]" 1
1621 1 20 LEU MD1 2 10 ILE H 4.940 . 4.940 3.600 3.175 5.062 0.122 18 0 "[ . 1 . 2 . 3 ]" 1
1622 1 21 VAL HB 2 42 ILE MD 5.500 . 5.500 5.172 3.916 5.523 0.023 23 0 "[ . 1 . 2 . 3 ]" 1
1623 2 18 ILE MG 2 21 VAL HB 5.500 . 5.500 4.674 3.678 5.609 0.109 23 0 "[ . 1 . 2 . 3 ]" 1
1624 2 21 VAL HB 2 26 LEU MD1 5.500 . 5.500 3.616 2.586 4.773 . 0 0 "[ . 1 . 2 . 3 ]" 1
1625 2 18 ILE HG13 2 38 LEU MD2 4.980 . 4.980 2.719 2.341 4.268 . 0 0 "[ . 1 . 2 . 3 ]" 1
1626 2 11 GLU HB3 2 15 LYS HD2 4.050 . 4.050 3.098 2.382 3.441 . 0 0 "[ . 1 . 2 . 3 ]" 1
1627 2 44 LYS HD2 2 45 PHE QD 4.920 . 4.920 3.108 2.412 4.858 . 0 0 "[ . 1 . 2 . 3 ]" 1
1628 2 27 ASP H 2 27 ASP HB2 3.730 . 3.730 2.546 2.267 2.696 . 0 0 "[ . 1 . 2 . 3 ]" 1
1629 2 13 LYS HA 2 16 GLU HB2 4.090 . 4.090 2.550 2.270 2.723 . 0 0 "[ . 1 . 2 . 3 ]" 1
1630 2 51 LYS HB2 2 51 LYS HD2 3.990 . 3.990 2.886 2.319 3.739 . 0 0 "[ . 1 . 2 . 3 ]" 1
1631 2 51 LYS HB2 2 51 LYS HD3 3.990 . 3.990 3.158 2.457 3.835 . 0 0 "[ . 1 . 2 . 3 ]" 1
1632 2 34 PHE HA 2 37 ASP HB2 4.470 . 4.470 3.798 3.248 4.230 . 0 0 "[ . 1 . 2 . 3 ]" 1
1633 1 26 LEU MD2 2 45 PHE HB3 4.530 . 4.530 2.059 1.840 2.936 . 0 0 "[ . 1 . 2 . 3 ]" 1
1634 1 20 LEU HB2 2 10 ILE HG12 4.360 . 4.360 2.538 2.331 3.104 . 0 0 "[ . 1 . 2 . 3 ]" 1
1635 2 46 MET HB3 2 46 MET ME 3.310 . 3.310 2.176 1.960 3.319 0.009 6 0 "[ . 1 . 2 . 3 ]" 1
1636 2 14 LYS HD2 2 39 ASP HA 4.410 . 4.410 2.720 2.284 3.358 . 0 0 "[ . 1 . 2 . 3 ]" 1
1637 1 21 VAL MG1 2 46 MET HG2 5.500 . 5.500 3.334 2.415 4.791 . 0 0 "[ . 1 . 2 . 3 ]" 1
1638 1 26 LEU MD2 2 45 PHE HA 4.370 . 4.370 3.926 3.302 4.272 . 0 0 "[ . 1 . 2 . 3 ]" 1
1639 2 14 LYS HA 2 17 LEU HB2 5.320 . 5.320 3.923 3.552 4.264 . 0 0 "[ . 1 . 2 . 3 ]" 1
1640 1 16 GLU HB2 2 13 LYS HG2 4.270 . 4.270 2.967 2.658 3.272 . 0 0 "[ . 1 . 2 . 3 ]" 1
1641 1 13 LYS HG3 2 16 GLU HB2 4.540 . 4.540 3.167 2.765 3.607 . 0 0 "[ . 1 . 2 . 3 ]" 1
1642 2 14 LYS HG3 2 38 LEU HG 5.080 . 5.080 2.604 2.149 4.701 . 0 0 "[ . 1 . 2 . 3 ]" 1
1643 2 17 LEU MD2 2 21 VAL MG2 4.350 . 4.350 3.043 2.007 4.109 . 0 0 "[ . 1 . 2 . 3 ]" 1
1644 2 41 LEU HB2 2 42 ILE HG13 5.440 . 5.440 4.903 4.263 5.184 . 0 0 "[ . 1 . 2 . 3 ]" 1
1645 2 6 LEU MD1 2 10 ILE MD 3.430 . 3.430 1.975 1.894 2.020 . 0 0 "[ . 1 . 2 . 3 ]" 1
1646 2 7 LYS HD2 2 7 LYS HG2 2.950 . 2.950 2.524 2.432 2.628 . 0 0 "[ . 1 . 2 . 3 ]" 1
1647 1 42 ILE HG12 2 17 LEU MD1 5.150 . 5.150 3.340 2.820 4.469 . 0 0 "[ . 1 . 2 . 3 ]" 1
1648 1 42 ILE HG12 2 17 LEU MD2 5.150 . 5.150 3.526 2.801 3.997 . 0 0 "[ . 1 . 2 . 3 ]" 1
1649 2 30 LYS HB3 2 30 LYS HD2 3.970 . 3.970 2.562 2.314 3.551 . 0 0 "[ . 1 . 2 . 3 ]" 1
1650 2 21 VAL HB 2 22 ALA H 4.150 . 4.150 3.324 2.545 4.198 0.048 11 0 "[ . 1 . 2 . 3 ]" 1
1651 2 29 ASP HA 2 32 LEU HG 4.530 . 4.530 2.934 2.595 3.392 . 0 0 "[ . 1 . 2 . 3 ]" 1
1652 2 6 LEU MD2 2 10 ILE MD 3.430 . 3.430 3.225 2.824 3.484 0.054 16 0 "[ . 1 . 2 . 3 ]" 1
1653 1 13 LYS HG3 2 17 LEU HA 4.470 . 4.470 3.318 3.021 3.649 . 0 0 "[ . 1 . 2 . 3 ]" 1
1654 2 18 ILE HG13 2 38 LEU MD1 4.980 . 4.980 4.847 3.639 5.052 0.072 14 0 "[ . 1 . 2 . 3 ]" 1
1655 2 45 PHE H 2 45 PHE HB3 3.590 . 3.590 3.550 3.473 3.591 0.001 24 0 "[ . 1 . 2 . 3 ]" 1
1656 2 44 LYS HB2 2 45 PHE H 4.020 . 4.020 3.702 3.514 3.920 . 0 0 "[ . 1 . 2 . 3 ]" 1
1657 2 26 LEU H 2 31 VAL MG2 4.840 . 4.840 4.350 3.888 4.838 . 0 0 "[ . 1 . 2 . 3 ]" 1
1658 2 26 LEU H 2 26 LEU MD2 4.290 . 4.290 3.599 3.351 3.888 . 0 0 "[ . 1 . 2 . 3 ]" 1
1659 2 22 ALA HA 2 26 LEU H 3.720 . 3.720 3.167 2.770 3.480 . 0 0 "[ . 1 . 2 . 3 ]" 1
1660 2 26 LEU H 2 26 LEU HB3 3.730 . 3.730 3.532 3.337 3.718 . 0 0 "[ . 1 . 2 . 3 ]" 1
1661 2 26 LEU H 2 27 ASP H 4.570 . 4.570 4.408 4.186 4.506 . 0 0 "[ . 1 . 2 . 3 ]" 1
1662 2 19 GLN H 2 19 GLN HB3 3.560 . 3.560 3.580 3.565 3.600 0.040 6 0 "[ . 1 . 2 . 3 ]" 1
1663 2 48 VAL HB 2 49 LYS H 4.150 . 4.150 3.705 2.709 4.224 0.074 7 0 "[ . 1 . 2 . 3 ]" 1
1664 2 49 LYS H 2 49 LYS HG3 4.310 . 4.310 2.933 2.181 4.281 . 0 0 "[ . 1 . 2 . 3 ]" 1
1665 2 54 LYS HB2 2 55 LEU H 4.980 . 4.980 4.063 2.585 4.608 . 0 0 "[ . 1 . 2 . 3 ]" 1
1666 2 37 ASP H 2 37 ASP HB2 3.810 . 3.810 2.393 2.145 2.561 . 0 0 "[ . 1 . 2 . 3 ]" 1
1667 2 36 ARG HG2 2 37 ASP H 5.500 . 5.500 3.126 2.489 4.950 . 0 0 "[ . 1 . 2 . 3 ]" 1
1668 2 41 LEU H 2 41 LEU MD2 4.520 . 4.520 4.215 3.849 4.311 . 0 0 "[ . 1 . 2 . 3 ]" 1
1669 2 41 LEU H 2 41 LEU HG 4.470 . 4.470 4.428 4.033 4.521 0.051 24 0 "[ . 1 . 2 . 3 ]" 1
1670 2 41 LEU H 2 41 LEU HB2 3.410 . 3.410 2.481 2.106 2.660 . 0 0 "[ . 1 . 2 . 3 ]" 1
1671 2 10 ILE H 2 10 ILE HG12 3.820 . 3.820 3.495 3.400 3.574 . 0 0 "[ . 1 . 2 . 3 ]" 1
1672 1 10 ILE H 2 20 LEU MD2 4.940 . 4.940 4.245 2.541 4.961 0.021 26 0 "[ . 1 . 2 . 3 ]" 1
1673 2 9 LYS HB3 2 10 ILE H 4.100 . 4.100 3.631 3.284 3.830 . 0 0 "[ . 1 . 2 . 3 ]" 1
1674 2 51 LYS H 2 51 LYS HB2 3.870 . 3.870 3.694 3.552 3.895 0.025 29 0 "[ . 1 . 2 . 3 ]" 1
1675 2 30 LYS HB2 2 31 VAL H 3.520 . 3.520 2.549 2.316 2.764 . 0 0 "[ . 1 . 2 . 3 ]" 1
1676 2 30 LYS HB3 2 31 VAL H 4.340 . 4.340 3.452 3.328 3.604 . 0 0 "[ . 1 . 2 . 3 ]" 1
1677 2 30 LYS HD3 2 31 VAL H 5.500 . 5.500 5.309 5.096 5.502 0.002 2 0 "[ . 1 . 2 . 3 ]" 1
1678 2 26 LEU HG 2 31 VAL H 5.500 . 5.500 5.295 4.798 5.619 0.119 16 0 "[ . 1 . 2 . 3 ]" 1
1679 2 32 LEU HB2 2 33 LEU H 4.140 . 4.140 2.370 2.211 2.535 . 0 0 "[ . 1 . 2 . 3 ]" 1
1680 2 32 LEU MD1 2 33 LEU H 5.310 . 5.310 4.320 4.125 4.482 . 0 0 "[ . 1 . 2 . 3 ]" 1
1681 2 32 LEU MD2 2 33 LEU H 5.310 . 5.310 4.546 4.480 4.627 . 0 0 "[ . 1 . 2 . 3 ]" 1
1682 2 32 LEU HB3 2 33 LEU H 4.140 . 4.140 3.480 3.299 3.627 . 0 0 "[ . 1 . 2 . 3 ]" 1
1683 2 22 ALA H 2 31 VAL MG1 4.910 . 4.910 4.407 4.174 4.709 . 0 0 "[ . 1 . 2 . 3 ]" 1
1684 2 51 LYS HG3 2 52 VAL H 4.560 . 4.560 3.904 3.301 4.455 . 0 0 "[ . 1 . 2 . 3 ]" 1
1685 2 52 VAL H 2 52 VAL HB 3.730 . 3.730 3.660 2.417 3.798 0.068 15 0 "[ . 1 . 2 . 3 ]" 1
1686 2 51 LYS HB2 2 52 VAL H 4.520 . 4.520 4.362 4.108 4.488 . 0 0 "[ . 1 . 2 . 3 ]" 1
1687 2 51 LYS HG2 2 52 VAL H 4.560 . 4.560 3.901 3.160 4.497 . 0 0 "[ . 1 . 2 . 3 ]" 1
1688 2 9 LYS H 2 9 LYS HB3 3.680 . 3.680 3.624 3.594 3.666 . 0 0 "[ . 1 . 2 . 3 ]" 1
1689 2 32 LEU H 2 32 LEU MD2 4.270 . 4.270 3.086 2.935 3.279 . 0 0 "[ . 1 . 2 . 3 ]" 1
1690 2 13 LYS H 2 13 LYS HB2 3.660 . 3.660 2.343 2.230 2.465 . 0 0 "[ . 1 . 2 . 3 ]" 1
1691 2 16 GLU HB3 2 17 LEU H 4.180 . 4.180 3.505 3.227 3.703 . 0 0 "[ . 1 . 2 . 3 ]" 1
1692 2 17 LEU H 2 17 LEU MD2 5.260 . 5.260 4.211 4.080 4.291 . 0 0 "[ . 1 . 2 . 3 ]" 1
1693 2 17 LEU H 2 17 LEU HB2 3.510 . 3.510 2.738 2.618 2.834 . 0 0 "[ . 1 . 2 . 3 ]" 1
1694 2 34 PHE H 2 34 PHE HB2 3.550 . 3.550 2.616 2.523 2.740 . 0 0 "[ . 1 . 2 . 3 ]" 1
1695 2 30 LYS H 2 30 LYS HB3 3.880 . 3.880 3.572 3.499 3.650 . 0 0 "[ . 1 . 2 . 3 ]" 1
1696 2 11 GLU H 2 11 GLU HB3 3.770 . 3.770 3.597 3.555 3.637 . 0 0 "[ . 1 . 2 . 3 ]" 1
1697 2 43 ASN HB3 2 48 VAL H 5.250 . 5.250 4.195 3.425 5.079 . 0 0 "[ . 1 . 2 . 3 ]" 1
1698 2 43 ASN HB3 2 44 LYS H 4.070 . 4.070 3.644 3.456 3.836 . 0 0 "[ . 1 . 2 . 3 ]" 1
1699 2 44 LYS H 2 44 LYS HB2 3.300 . 3.300 2.431 2.317 2.535 . 0 0 "[ . 1 . 2 . 3 ]" 1
1700 2 44 LYS H 2 44 LYS HG2 4.700 . 4.700 4.461 4.417 4.494 . 0 0 "[ . 1 . 2 . 3 ]" 1
1701 2 13 LYS HB3 2 14 LYS H 4.180 . 4.180 2.502 2.337 2.652 . 0 0 "[ . 1 . 2 . 3 ]" 1
1702 1 14 LYS H 2 17 LEU HB2 4.160 . 4.160 3.960 3.569 4.167 0.007 25 0 "[ . 1 . 2 . 3 ]" 1
1703 2 14 LYS H 2 14 LYS HB3 3.530 . 3.530 2.388 2.238 2.505 . 0 0 "[ . 1 . 2 . 3 ]" 1
1704 1 14 LYS H 2 17 LEU MD1 5.500 . 5.500 4.442 2.153 5.437 . 0 0 "[ . 1 . 2 . 3 ]" 1
1705 2 38 LEU HB2 2 39 ASP H 4.050 . 4.050 3.895 3.752 4.042 . 0 0 "[ . 1 . 2 . 3 ]" 1
1706 2 38 LEU MD1 2 39 ASP H 5.430 . 5.430 4.255 4.060 4.943 . 0 0 "[ . 1 . 2 . 3 ]" 1
1707 2 38 LEU HB3 2 39 ASP H 4.050 . 4.050 2.572 2.338 2.940 . 0 0 "[ . 1 . 2 . 3 ]" 1
1708 2 17 LEU HB2 2 18 ILE H 4.300 . 4.300 3.969 3.763 4.093 . 0 0 "[ . 1 . 2 . 3 ]" 1
1709 2 18 ILE H 2 18 ILE HG12 4.040 . 4.040 3.447 3.321 3.620 . 0 0 "[ . 1 . 2 . 3 ]" 1
1710 2 16 GLU H 2 16 GLU HG3 3.980 . 3.980 2.596 2.372 3.875 . 0 0 "[ . 1 . 2 . 3 ]" 1
1711 2 16 GLU H 2 16 GLU HB3 3.820 . 3.820 3.633 3.504 3.675 . 0 0 "[ . 1 . 2 . 3 ]" 1
1712 2 23 ARG HB2 2 24 HIS H 4.360 . 4.360 4.222 4.086 4.329 . 0 0 "[ . 1 . 2 . 3 ]" 1
1713 2 23 ARG HG2 2 24 HIS H 4.580 . 4.580 3.282 3.043 3.602 . 0 0 "[ . 1 . 2 . 3 ]" 1
1714 2 15 LYS HB3 2 16 GLU H 3.910 . 3.910 3.658 3.489 3.865 . 0 0 "[ . 1 . 2 . 3 ]" 1
1715 2 19 GLN HB3 2 20 LEU H 3.940 . 3.940 3.743 3.546 3.964 0.024 15 0 "[ . 1 . 2 . 3 ]" 1
1716 2 20 LEU H 2 20 LEU MD2 3.900 . 3.900 3.453 2.276 3.870 . 0 0 "[ . 1 . 2 . 3 ]" 1
1717 2 20 LEU H 2 20 LEU HB3 3.990 . 3.990 3.595 3.449 3.706 . 0 0 "[ . 1 . 2 . 3 ]" 1
1718 2 20 LEU HB3 2 21 VAL H 4.400 . 4.400 3.392 2.907 3.615 . 0 0 "[ . 1 . 2 . 3 ]" 1
1719 2 17 LEU MD1 2 21 VAL H 4.560 . 4.560 3.680 3.550 3.887 . 0 0 "[ . 1 . 2 . 3 ]" 1
1720 1 21 VAL H 2 10 ILE MG 4.700 . 4.700 4.089 3.678 4.436 . 0 0 "[ . 1 . 2 . 3 ]" 1
1721 2 21 VAL H 2 22 ALA MB 4.310 . 4.310 4.325 4.262 4.366 0.056 11 0 "[ . 1 . 2 . 3 ]" 1
1722 2 7 LYS H 2 7 LYS HB3 3.380 . 3.380 3.157 2.762 3.407 0.027 21 0 "[ . 1 . 2 . 3 ]" 1
1723 2 6 LEU HB2 2 7 LYS H 3.970 . 3.970 3.830 3.737 3.903 . 0 0 "[ . 1 . 2 . 3 ]" 1
1724 2 7 LYS H 2 7 LYS HG2 3.980 . 3.980 3.697 3.155 4.036 0.056 2 0 "[ . 1 . 2 . 3 ]" 1
1725 2 40 LYS H 2 40 LYS HG2 4.320 . 4.320 3.517 2.476 4.294 . 0 0 "[ . 1 . 2 . 3 ]" 1
1726 2 23 ARG H 2 24 HIS H 3.470 . 3.470 2.568 2.467 2.659 . 0 0 "[ . 1 . 2 . 3 ]" 1
1727 2 47 ASN H 2 47 ASN HB3 4.030 . 4.030 3.664 2.748 4.090 0.060 4 0 "[ . 1 . 2 . 3 ]" 1
1728 2 7 LYS HB3 2 8 ASN H 3.820 . 3.820 2.973 2.705 3.210 . 0 0 "[ . 1 . 2 . 3 ]" 1
1729 2 15 LYS H 2 15 LYS HG2 4.280 . 4.280 3.662 3.465 3.956 . 0 0 "[ . 1 . 2 . 3 ]" 1
1730 2 15 LYS H 2 18 ILE MD 4.390 . 4.390 3.791 3.592 3.989 . 0 0 "[ . 1 . 2 . 3 ]" 1
1731 2 41 LEU HB2 2 42 ILE H 4.120 . 4.120 3.772 3.252 3.917 . 0 0 "[ . 1 . 2 . 3 ]" 1
1732 2 42 ILE H 2 42 ILE HG12 4.100 . 4.100 3.500 3.280 3.655 . 0 0 "[ . 1 . 2 . 3 ]" 1
1733 2 41 LEU MD1 2 42 ILE H 4.440 . 4.440 4.314 3.367 4.458 0.018 10 0 "[ . 1 . 2 . 3 ]" 1
1734 2 28 HIS HB3 2 29 ASP H 3.850 . 3.850 3.309 2.306 3.951 0.101 18 0 "[ . 1 . 2 . 3 ]" 1
1735 2 43 ASN H 2 44 LYS HB3 5.260 . 5.260 4.865 4.605 4.971 . 0 0 "[ . 1 . 2 . 3 ]" 1
1736 2 11 GLU HB3 2 12 ASN H 3.980 . 3.980 3.347 3.058 3.633 . 0 0 "[ . 1 . 2 . 3 ]" 1
1737 2 45 PHE HB3 2 46 MET H 4.270 . 4.270 3.714 3.463 3.927 . 0 0 "[ . 1 . 2 . 3 ]" 1
1738 2 46 MET H 2 46 MET HG3 4.000 . 4.000 2.681 2.088 3.766 . 0 0 "[ . 1 . 2 . 3 ]" 1
1739 2 46 MET H 2 46 MET HG2 4.000 . 4.000 2.919 2.247 3.298 . 0 0 "[ . 1 . 2 . 3 ]" 1
1740 2 18 ILE HG12 2 35 SER H 5.110 . 5.110 4.654 4.445 4.962 . 0 0 "[ . 1 . 2 . 3 ]" 1
1741 2 34 PHE HB2 2 35 SER H 4.670 . 4.670 3.885 3.813 3.955 . 0 0 "[ . 1 . 2 . 3 ]" 1
1742 2 18 ILE MG 2 35 SER H 4.840 . 4.840 3.613 3.455 3.842 . 0 0 "[ . 1 . 2 . 3 ]" 1
1743 2 31 VAL MG1 2 35 SER H 5.400 . 5.400 3.991 3.848 4.114 . 0 0 "[ . 1 . 2 . 3 ]" 1
1744 2 26 LEU HB2 2 27 ASP H 4.410 . 4.410 3.971 3.637 4.264 . 0 0 "[ . 1 . 2 . 3 ]" 1
1745 2 27 ASP H 2 30 LYS HG2 4.320 . 4.320 3.042 2.641 3.380 . 0 0 "[ . 1 . 2 . 3 ]" 1
1746 2 48 VAL HA 2 50 ASP H 5.130 . 5.130 3.978 2.749 5.208 0.078 28 0 "[ . 1 . 2 . 3 ]" 1
1747 2 3 MET HB2 2 4 GLY H 5.330 . 5.330 3.758 2.618 4.372 . 0 0 "[ . 1 . 2 . 3 ]" 1
1748 2 3 MET HB3 2 4 GLY H 5.330 . 5.330 4.174 3.636 4.456 . 0 0 "[ . 1 . 2 . 3 ]" 1
1749 2 4 GLY H 2 5 GLN H 4.540 . 4.540 2.554 2.257 2.786 . 0 0 "[ . 1 . 2 . 3 ]" 1
1750 2 5 GLN H 2 6 LEU H 4.140 . 4.140 2.444 2.100 2.729 . 0 0 "[ . 1 . 2 . 3 ]" 1
1751 2 17 LEU H 2 18 ILE H 3.750 . 3.750 2.598 2.552 2.649 . 0 0 "[ . 1 . 2 . 3 ]" 1
1752 2 18 ILE H 2 19 GLN H 3.680 . 3.680 2.733 2.666 2.847 . 0 0 "[ . 1 . 2 . 3 ]" 1
1753 2 19 GLN H 2 20 LEU H 3.660 . 3.660 2.679 2.508 2.890 . 0 0 "[ . 1 . 2 . 3 ]" 1
1754 2 20 LEU H 2 21 VAL H 3.580 . 3.580 2.748 2.533 2.998 . 0 0 "[ . 1 . 2 . 3 ]" 1
1755 2 21 VAL H 2 22 ALA H 3.560 . 3.560 2.694 2.615 2.778 . 0 0 "[ . 1 . 2 . 3 ]" 1
1756 2 22 ALA H 2 23 ARG H 3.500 . 3.500 2.725 2.571 2.876 . 0 0 "[ . 1 . 2 . 3 ]" 1
1757 2 29 ASP H 2 30 LYS H 3.430 . 3.430 2.562 2.306 2.748 . 0 0 "[ . 1 . 2 . 3 ]" 1
1758 2 29 ASP H 2 31 VAL H 4.490 . 4.490 4.146 3.818 4.351 . 0 0 "[ . 1 . 2 . 3 ]" 1
1759 2 30 LYS H 2 31 VAL H 3.330 . 3.330 2.659 2.558 2.767 . 0 0 "[ . 1 . 2 . 3 ]" 1
1760 2 28 HIS HA 2 32 LEU H 4.840 . 4.840 4.264 3.934 4.804 . 0 0 "[ . 1 . 2 . 3 ]" 1
1761 2 30 LYS H 2 32 LEU H 4.410 . 4.410 4.064 3.945 4.176 . 0 0 "[ . 1 . 2 . 3 ]" 1
1762 2 31 VAL H 2 32 LEU H 3.420 . 3.420 2.649 2.489 2.789 . 0 0 "[ . 1 . 2 . 3 ]" 1
1763 2 33 LEU H 2 34 PHE H 3.580 . 3.580 2.668 2.569 2.763 . 0 0 "[ . 1 . 2 . 3 ]" 1
1764 2 35 SER H 2 37 ASP H 4.370 . 4.370 4.265 4.010 4.385 0.015 24 0 "[ . 1 . 2 . 3 ]" 1
1765 2 35 SER HB2 2 36 ARG H 4.480 . 4.480 3.677 3.479 3.837 . 0 0 "[ . 1 . 2 . 3 ]" 1
1766 2 35 SER HB3 2 36 ARG H 4.480 . 4.480 4.053 3.963 4.157 . 0 0 "[ . 1 . 2 . 3 ]" 1
1767 2 35 SER H 2 36 ARG H 3.680 . 3.680 2.755 2.641 2.844 . 0 0 "[ . 1 . 2 . 3 ]" 1
1768 2 36 ARG H 2 37 ASP H 3.580 . 3.580 2.613 2.487 2.734 . 0 0 "[ . 1 . 2 . 3 ]" 1
1769 2 33 LEU HA 2 37 ASP H 4.780 . 4.780 4.122 3.913 4.273 . 0 0 "[ . 1 . 2 . 3 ]" 1
1770 2 37 ASP H 2 38 LEU H 3.620 . 3.620 2.440 2.287 2.616 . 0 0 "[ . 1 . 2 . 3 ]" 1
1771 2 36 ARG H 2 38 LEU H 4.730 . 4.730 4.030 3.868 4.260 . 0 0 "[ . 1 . 2 . 3 ]" 1
1772 2 38 LEU H 2 40 LYS H 5.100 . 5.100 4.123 3.948 4.287 . 0 0 "[ . 1 . 2 . 3 ]" 1
1773 2 38 LEU H 2 39 ASP H 3.490 . 3.490 2.645 2.430 2.819 . 0 0 "[ . 1 . 2 . 3 ]" 1
1774 2 39 ASP H 2 40 LYS H 3.400 . 3.400 2.702 2.554 2.799 . 0 0 "[ . 1 . 2 . 3 ]" 1
1775 2 41 LEU H 2 42 ILE H 3.610 . 3.610 2.603 2.391 2.756 . 0 0 "[ . 1 . 2 . 3 ]" 1
1776 2 43 ASN H 2 44 LYS H 3.590 . 3.590 2.750 2.636 2.859 . 0 0 "[ . 1 . 2 . 3 ]" 1
1777 2 44 LYS H 2 45 PHE H 3.570 . 3.570 2.764 2.613 2.872 . 0 0 "[ . 1 . 2 . 3 ]" 1
1778 2 44 LYS H 2 46 MET H 4.530 . 4.530 3.922 3.740 4.008 . 0 0 "[ . 1 . 2 . 3 ]" 1
1779 2 45 PHE H 2 46 MET H 3.370 . 3.370 2.444 2.047 2.581 . 0 0 "[ . 1 . 2 . 3 ]" 1
1780 2 45 PHE H 2 47 ASN H 4.420 . 4.420 3.883 3.670 4.396 . 0 0 "[ . 1 . 2 . 3 ]" 1
1781 2 46 MET H 2 47 ASN H 3.320 . 3.320 2.433 2.253 2.627 . 0 0 "[ . 1 . 2 . 3 ]" 1
1782 2 46 MET H 2 48 VAL H 5.000 . 5.000 4.160 3.508 5.007 0.007 16 0 "[ . 1 . 2 . 3 ]" 1
1783 2 48 VAL H 2 49 LYS H 4.730 . 4.730 4.103 3.564 4.544 . 0 0 "[ . 1 . 2 . 3 ]" 1
1784 2 49 LYS HA 2 50 ASP H 3.060 . 3.060 2.583 1.968 3.205 0.145 29 0 "[ . 1 . 2 . 3 ]" 1
1785 2 51 LYS HA 2 52 VAL H 2.980 . 2.980 2.979 2.589 3.142 0.162 14 0 "[ . 1 . 2 . 3 ]" 1
1786 2 53 HIS H 2 54 LYS H 4.680 . 4.680 3.446 1.696 4.584 . 0 0 "[ . 1 . 2 . 3 ]" 1
1787 2 6 LEU H 2 7 LYS H 3.970 . 3.970 2.644 2.461 2.919 . 0 0 "[ . 1 . 2 . 3 ]" 1
1788 2 7 LYS H 2 8 ASN H 3.700 . 3.700 2.602 2.481 2.720 . 0 0 "[ . 1 . 2 . 3 ]" 1
1789 2 8 ASN H 2 9 LYS H 3.510 . 3.510 2.670 2.440 2.858 . 0 0 "[ . 1 . 2 . 3 ]" 1
1790 2 9 LYS H 2 10 ILE H 3.650 . 3.650 2.576 2.368 2.774 . 0 0 "[ . 1 . 2 . 3 ]" 1
1791 2 7 LYS HA 2 11 GLU H 4.400 . 4.400 3.954 3.711 4.237 . 0 0 "[ . 1 . 2 . 3 ]" 1
1792 2 10 ILE H 2 11 GLU H 3.620 . 3.620 2.787 2.652 3.093 . 0 0 "[ . 1 . 2 . 3 ]" 1
1793 2 11 GLU H 2 12 ASN H 3.590 . 3.590 2.788 2.646 2.966 . 0 0 "[ . 1 . 2 . 3 ]" 1
1794 2 12 ASN H 2 13 LYS H 3.900 . 3.900 2.832 2.701 2.946 . 0 0 "[ . 1 . 2 . 3 ]" 1
1795 2 13 LYS H 2 14 LYS H 3.560 . 3.560 2.599 2.525 2.683 . 0 0 "[ . 1 . 2 . 3 ]" 1
1796 2 14 LYS H 2 15 LYS H 3.670 . 3.670 2.728 2.641 2.814 . 0 0 "[ . 1 . 2 . 3 ]" 1
1797 2 15 LYS H 2 16 GLU H 3.490 . 3.490 2.700 2.565 2.794 . 0 0 "[ . 1 . 2 . 3 ]" 1
1798 2 16 GLU H 2 17 LEU H 3.670 . 3.670 2.672 2.560 2.789 . 0 0 "[ . 1 . 2 . 3 ]" 1
1799 2 14 LYS HA 2 18 ILE H 5.190 . 5.190 4.202 4.041 4.376 . 0 0 "[ . 1 . 2 . 3 ]" 1
1800 2 16 GLU HA 2 19 GLN H 3.850 . 3.850 3.751 3.450 3.884 0.034 15 0 "[ . 1 . 2 . 3 ]" 1
1801 2 25 GLY H 2 26 LEU H 3.280 . 3.280 1.917 1.748 2.105 . 0 0 "[ . 1 . 2 . 3 ]" 1
1802 2 27 ASP H 2 30 LYS HB3 4.570 . 4.570 3.542 3.188 3.972 . 0 0 "[ . 1 . 2 . 3 ]" 1
1803 2 6 LEU MD2 2 7 LYS H 4.840 . 4.840 4.265 4.131 4.369 . 0 0 "[ . 1 . 2 . 3 ]" 1
1804 2 55 LEU MD2 2 56 GLU H 5.150 . 5.150 4.303 3.416 5.213 0.063 29 0 "[ . 1 . 2 . 3 ]" 1
1805 2 39 ASP HB3 2 43 ASN HD21 4.990 . 4.990 4.495 4.027 4.898 . 0 0 "[ . 1 . 2 . 3 ]" 1
1806 2 7 LYS H 2 7 LYS HG3 4.540 . 4.540 4.254 3.937 4.450 . 0 0 "[ . 1 . 2 . 3 ]" 1
1807 2 10 ILE HB 2 12 ASN H 5.370 . 5.370 5.049 4.888 5.255 . 0 0 "[ . 1 . 2 . 3 ]" 1
1808 2 28 HIS H 2 29 ASP H 4.500 . 4.500 2.758 2.553 3.727 . 0 0 "[ . 1 . 2 . 3 ]" 1
1809 1 14 LYS H 2 17 LEU HG 5.500 . 5.500 4.439 3.962 5.340 . 0 0 "[ . 1 . 2 . 3 ]" 1
1810 2 36 ARG HA 2 40 LYS H 4.720 . 4.720 4.087 3.851 4.376 . 0 0 "[ . 1 . 2 . 3 ]" 1
1811 1 34 PHE H 2 45 PHE QE 5.050 . 5.050 3.341 3.117 3.559 . 0 0 "[ . 1 . 2 . 3 ]" 1
1812 1 46 MET H 2 26 LEU MD2 5.180 . 5.180 4.418 3.780 5.047 . 0 0 "[ . 1 . 2 . 3 ]" 1
1813 2 33 LEU H 2 33 LEU HB3 3.680 . 3.680 3.579 3.530 3.635 . 0 0 "[ . 1 . 2 . 3 ]" 1
1814 2 32 LEU H 2 33 LEU H 3.540 . 3.540 2.742 2.668 2.847 . 0 0 "[ . 1 . 2 . 3 ]" 1
1815 2 47 ASN HB3 2 48 VAL H 4.530 . 4.530 4.002 1.878 4.508 . 0 0 "[ . 1 . 2 . 3 ]" 1
1816 2 22 ALA H 2 26 LEU H 5.500 . 5.500 5.465 5.264 5.578 0.078 11 0 "[ . 1 . 2 . 3 ]" 1
1817 1 42 ILE H 2 34 PHE QE 5.060 . 5.060 3.531 3.243 4.109 . 0 0 "[ . 1 . 2 . 3 ]" 1
1818 2 24 HIS H 2 25 GLY H 3.890 . 3.890 2.560 2.356 2.736 . 0 0 "[ . 1 . 2 . 3 ]" 1
1819 2 57 HIS HB2 2 58 HIS H 5.010 . 5.010 3.469 1.852 4.452 . 0 0 "[ . 1 . 2 . 3 ]" 1
1820 2 17 LEU HG 2 18 ILE H 5.070 . 5.070 4.345 3.366 4.783 . 0 0 "[ . 1 . 2 . 3 ]" 1
1821 2 3 MET H 2 4 GLY H 4.630 . 4.630 2.370 1.691 2.908 . 0 0 "[ . 1 . 2 . 3 ]" 1
1822 2 26 LEU MD2 2 27 ASP H 5.080 . 5.080 3.656 2.974 4.662 . 0 0 "[ . 1 . 2 . 3 ]" 1
1823 2 55 LEU HG 2 56 GLU H 5.340 . 5.340 4.684 3.852 5.181 . 0 0 "[ . 1 . 2 . 3 ]" 1
1824 2 10 ILE MD 2 11 GLU H 4.580 . 4.580 4.548 4.399 4.603 0.023 28 0 "[ . 1 . 2 . 3 ]" 1
1825 1 20 LEU H 2 10 ILE MD 5.500 . 5.500 5.329 5.026 5.539 0.039 30 0 "[ . 1 . 2 . 3 ]" 1
1826 2 10 ILE H 2 10 ILE MD 3.850 . 3.850 3.655 3.535 3.770 . 0 0 "[ . 1 . 2 . 3 ]" 1
1827 1 24 HIS H 2 10 ILE MD 4.560 . 4.560 4.039 3.479 4.367 . 0 0 "[ . 1 . 2 . 3 ]" 1
1828 2 18 ILE MD 2 35 SER H 4.920 . 4.920 4.156 3.962 4.390 . 0 0 "[ . 1 . 2 . 3 ]" 1
1829 2 18 ILE MD 2 19 GLN H 4.430 . 4.430 4.453 4.410 4.489 0.059 6 0 "[ . 1 . 2 . 3 ]" 1
1830 2 18 ILE H 2 18 ILE MD 3.770 . 3.770 3.426 3.361 3.480 . 0 0 "[ . 1 . 2 . 3 ]" 1
1831 2 10 ILE MG 2 11 GLU H 3.870 . 3.870 3.070 2.919 3.173 . 0 0 "[ . 1 . 2 . 3 ]" 1
1832 2 10 ILE MG 2 14 LYS H 4.400 . 4.400 4.017 3.789 4.258 . 0 0 "[ . 1 . 2 . 3 ]" 1
1833 2 18 ILE MG 2 19 GLN H 3.760 . 3.760 3.414 3.279 3.569 . 0 0 "[ . 1 . 2 . 3 ]" 1
1834 2 18 ILE H 2 18 ILE MG 3.930 . 3.930 3.800 3.761 3.823 . 0 0 "[ . 1 . 2 . 3 ]" 1
1835 2 18 ILE MG 2 22 ALA H 4.410 . 4.410 3.921 3.678 4.063 . 0 0 "[ . 1 . 2 . 3 ]" 1
1836 2 42 ILE MG 2 46 MET H 4.430 . 4.430 3.894 3.668 4.120 . 0 0 "[ . 1 . 2 . 3 ]" 1
1837 2 42 ILE H 2 42 ILE MG 3.880 . 3.880 3.787 3.759 3.819 . 0 0 "[ . 1 . 2 . 3 ]" 1
1838 2 22 ALA MB 2 24 HIS H 4.590 . 4.590 4.161 4.070 4.243 . 0 0 "[ . 1 . 2 . 3 ]" 1
1839 2 22 ALA H 2 22 ALA MB 2.800 . 2.800 2.206 2.147 2.259 . 0 0 "[ . 1 . 2 . 3 ]" 1
1840 2 22 ALA MB 2 23 ARG H 3.230 . 3.230 2.437 2.195 2.628 . 0 0 "[ . 1 . 2 . 3 ]" 1
1841 2 22 ALA MB 2 26 LEU H 4.750 . 4.750 4.299 3.806 4.761 0.011 19 0 "[ . 1 . 2 . 3 ]" 1
1842 2 19 GLN H 2 22 ALA MB 4.840 . 4.840 4.322 4.193 4.407 . 0 0 "[ . 1 . 2 . 3 ]" 1
1843 2 48 VAL H 2 48 VAL MG2 3.950 . 3.950 2.217 1.948 2.707 . 0 0 "[ . 1 . 2 . 3 ]" 1
1844 2 48 VAL MG2 2 49 LYS H 4.090 . 4.090 4.043 3.623 4.181 0.091 17 0 "[ . 1 . 2 . 3 ]" 1
1845 2 51 LYS H 2 52 VAL MG1 4.660 . 4.660 3.439 2.565 4.912 0.252 8 0 "[ . 1 . 2 . 3 ]" 1
1846 2 52 VAL H 2 52 VAL MG2 3.570 . 3.570 2.032 1.869 2.297 . 0 0 "[ . 1 . 2 . 3 ]" 1
1847 2 52 VAL MG1 2 53 HIS H 5.190 . 5.190 3.844 3.522 4.263 . 0 0 "[ . 1 . 2 . 3 ]" 1
1848 2 52 VAL MG2 2 53 HIS H 5.190 . 5.190 3.553 2.353 4.308 . 0 0 "[ . 1 . 2 . 3 ]" 1
1849 2 48 VAL H 2 48 VAL MG1 3.950 . 3.950 3.279 2.437 3.974 0.024 7 0 "[ . 1 . 2 . 3 ]" 1
1850 2 51 LYS H 2 52 VAL MG2 4.660 . 4.660 3.595 2.394 4.446 . 0 0 "[ . 1 . 2 . 3 ]" 1
1851 2 48 VAL MG1 2 49 LYS H 4.090 . 4.090 3.470 2.358 3.928 . 0 0 "[ . 1 . 2 . 3 ]" 1
1852 2 31 VAL MG1 2 32 LEU H 3.990 . 3.990 3.560 3.425 3.740 . 0 0 "[ . 1 . 2 . 3 ]" 1
1853 2 31 VAL H 2 31 VAL MG1 3.790 . 3.790 3.755 3.729 3.781 . 0 0 "[ . 1 . 2 . 3 ]" 1
1854 2 33 LEU H 2 33 LEU MD2 4.230 . 4.230 3.273 2.162 3.746 . 0 0 "[ . 1 . 2 . 3 ]" 1
1855 2 20 LEU H 2 20 LEU MD1 3.900 . 3.900 3.487 2.484 3.821 . 0 0 "[ . 1 . 2 . 3 ]" 1
1856 1 23 ARG H 2 6 LEU MD2 5.500 . 5.500 4.724 4.200 4.980 . 0 0 "[ . 1 . 2 . 3 ]" 1
1857 2 6 LEU H 2 6 LEU MD2 4.420 . 4.420 4.153 4.096 4.209 . 0 0 "[ . 1 . 2 . 3 ]" 1
1858 2 17 LEU MD2 2 21 VAL H 4.560 . 4.560 3.449 2.774 4.820 0.260 27 0 "[ . 1 . 2 . 3 ]" 1
1859 1 17 LEU H 2 13 LYS HG3 3.970 . 3.970 3.247 3.002 3.762 . 0 0 "[ . 1 . 2 . 3 ]" 1
1860 1 17 LEU H 2 13 LYS HG2 4.210 . 4.210 3.137 2.815 3.553 . 0 0 "[ . 1 . 2 . 3 ]" 1
1861 2 31 VAL H 2 31 VAL MG2 2.990 . 2.990 1.882 1.780 2.016 . 0 0 "[ . 1 . 2 . 3 ]" 1
1862 2 13 LYS HG3 2 14 LYS H 5.100 . 5.100 4.060 3.743 4.297 . 0 0 "[ . 1 . 2 . 3 ]" 1
1863 2 14 LYS H 2 14 LYS HG2 5.500 . 5.500 4.384 4.293 4.455 . 0 0 "[ . 1 . 2 . 3 ]" 1
1864 1 16 GLU H 2 13 LYS HG3 5.330 . 5.330 5.064 4.802 5.347 0.017 19 0 "[ . 1 . 2 . 3 ]" 1
1865 1 16 GLU H 2 13 LYS HG2 5.500 . 5.500 4.951 4.706 5.241 . 0 0 "[ . 1 . 2 . 3 ]" 1
1866 2 44 LYS H 2 44 LYS HG3 5.300 . 5.300 4.427 4.346 4.482 . 0 0 "[ . 1 . 2 . 3 ]" 1
1867 2 44 LYS HG2 2 45 PHE H 4.110 . 4.110 3.632 3.372 4.112 0.002 18 0 "[ . 1 . 2 . 3 ]" 1
1868 2 49 LYS H 2 49 LYS HG2 4.310 . 4.310 3.311 1.885 4.133 . 0 0 "[ . 1 . 2 . 3 ]" 1
1869 2 14 LYS HG2 2 15 LYS H 4.410 . 4.410 3.541 3.383 3.667 . 0 0 "[ . 1 . 2 . 3 ]" 1
1870 2 26 LEU MD1 2 27 ASP H 5.080 . 5.080 4.308 4.046 4.848 . 0 0 "[ . 1 . 2 . 3 ]" 1
1871 1 46 MET H 2 26 LEU MD1 5.180 . 5.180 4.403 3.520 5.197 0.017 8 0 "[ . 1 . 2 . 3 ]" 1
1872 2 32 LEU H 2 32 LEU MD1 4.270 . 4.270 3.635 3.527 3.753 . 0 0 "[ . 1 . 2 . 3 ]" 1
1873 1 23 ARG H 2 6 LEU MD1 5.500 . 5.500 5.089 4.626 5.538 0.038 12 0 "[ . 1 . 2 . 3 ]" 1
1874 2 9 LYS H 2 9 LYS HG2 3.980 . 3.980 3.063 2.131 3.799 . 0 0 "[ . 1 . 2 . 3 ]" 1
1875 2 9 LYS H 2 9 LYS HG3 3.980 . 3.980 2.889 2.080 3.895 . 0 0 "[ . 1 . 2 . 3 ]" 1
1876 2 14 LYS H 2 15 LYS HG3 5.470 . 5.470 4.651 4.451 5.056 . 0 0 "[ . 1 . 2 . 3 ]" 1
1877 2 15 LYS H 2 15 LYS HG3 3.380 . 3.380 2.347 2.194 2.650 . 0 0 "[ . 1 . 2 . 3 ]" 1
1878 2 41 LEU H 2 41 LEU MD1 4.520 . 4.520 4.165 4.092 4.313 . 0 0 "[ . 1 . 2 . 3 ]" 1
1879 1 38 LEU H 2 41 LEU MD1 4.390 . 4.390 3.845 2.625 4.403 0.013 32 0 "[ . 1 . 2 . 3 ]" 1
1880 2 15 LYS HG3 2 16 GLU H 4.710 . 4.710 4.482 4.355 4.679 . 0 0 "[ . 1 . 2 . 3 ]" 1
1881 1 37 ASP H 2 41 LEU MD1 4.980 . 4.980 4.656 4.240 4.982 0.002 26 0 "[ . 1 . 2 . 3 ]" 1
1882 2 27 ASP H 2 30 LYS HG3 4.260 . 4.260 2.206 1.633 2.955 . 0 0 "[ . 1 . 2 . 3 ]" 1
1883 2 30 LYS H 2 30 LYS HG2 3.350 . 3.350 2.422 2.153 2.728 . 0 0 "[ . 1 . 2 . 3 ]" 1
1884 2 30 LYS HG3 2 31 VAL H 5.500 . 5.500 4.831 4.601 5.057 . 0 0 "[ . 1 . 2 . 3 ]" 1
1885 2 32 LEU H 2 32 LEU HG 3.310 . 3.310 2.201 2.103 2.318 . 0 0 "[ . 1 . 2 . 3 ]" 1
1886 2 38 LEU H 2 38 LEU HG 4.690 . 4.690 4.380 4.306 4.565 . 0 0 "[ . 1 . 2 . 3 ]" 1
1887 2 38 LEU HG 2 39 ASP H 4.920 . 4.920 3.595 3.153 4.894 . 0 0 "[ . 1 . 2 . 3 ]" 1
1888 2 38 LEU MD2 2 39 ASP H 5.430 . 5.430 4.140 3.479 4.549 . 0 0 "[ . 1 . 2 . 3 ]" 1
1889 2 20 LEU H 2 20 LEU HG 4.450 . 4.450 2.962 2.385 4.280 . 0 0 "[ . 1 . 2 . 3 ]" 1
1890 2 55 LEU H 2 55 LEU HG 3.910 . 3.910 3.080 1.964 4.134 0.224 9 0 "[ . 1 . 2 . 3 ]" 1
1891 2 36 ARG HG3 2 37 ASP H 5.500 . 5.500 2.974 1.915 4.180 . 0 0 "[ . 1 . 2 . 3 ]" 1
1892 2 17 LEU HG 2 21 VAL H 5.500 . 5.500 5.120 3.461 5.778 0.278 31 0 "[ . 1 . 2 . 3 ]" 1
1893 2 6 LEU HG 2 7 LYS H 4.780 . 4.780 4.767 4.649 4.811 0.031 21 0 "[ . 1 . 2 . 3 ]" 1
1894 2 6 LEU H 2 6 LEU HG 4.600 . 4.600 4.572 4.497 4.617 0.017 16 0 "[ . 1 . 2 . 3 ]" 1
1895 2 17 LEU H 2 17 LEU HG 4.600 . 4.600 4.517 4.295 4.628 0.028 11 0 "[ . 1 . 2 . 3 ]" 1
1896 2 23 ARG H 2 23 ARG HG2 3.360 . 3.360 2.137 1.970 2.295 . 0 0 "[ . 1 . 2 . 3 ]" 1
1897 2 22 ALA H 2 23 ARG HG2 4.660 . 4.660 4.176 3.989 4.358 . 0 0 "[ . 1 . 2 . 3 ]" 1
1898 2 21 VAL H 2 23 ARG HG2 4.740 . 4.740 4.700 4.579 4.801 0.061 5 0 "[ . 1 . 2 . 3 ]" 1
1899 2 23 ARG HG3 2 24 HIS H 4.690 . 4.690 3.308 2.856 3.676 . 0 0 "[ . 1 . 2 . 3 ]" 1
1900 2 26 LEU HG 2 27 ASP H 4.680 . 4.680 4.260 3.411 4.824 0.144 21 0 "[ . 1 . 2 . 3 ]" 1
1901 2 26 LEU H 2 26 LEU HG 3.490 . 3.490 3.171 2.652 3.715 0.225 18 0 "[ . 1 . 2 . 3 ]" 1
1902 2 19 GLN H 2 19 GLN HB2 2.960 . 2.960 2.456 2.359 2.579 . 0 0 "[ . 1 . 2 . 3 ]" 1
1903 2 19 GLN HB2 2 20 LEU H 3.580 . 3.580 2.794 2.497 3.083 . 0 0 "[ . 1 . 2 . 3 ]" 1
1904 2 5 GLN H 2 5 GLN HB3 3.890 . 3.890 3.428 2.492 3.683 . 0 0 "[ . 1 . 2 . 3 ]" 1
1905 2 11 GLU HB3 2 15 LYS H 5.500 . 5.500 5.003 4.809 5.179 . 0 0 "[ . 1 . 2 . 3 ]" 1
1906 2 5 GLN HB3 2 6 LEU H 4.470 . 4.470 3.802 3.551 4.137 . 0 0 "[ . 1 . 2 . 3 ]" 1
1907 2 11 GLU HB2 2 12 ASN H 3.300 . 3.300 2.351 2.195 2.548 . 0 0 "[ . 1 . 2 . 3 ]" 1
1908 2 11 GLU H 2 11 GLU HB2 3.030 . 3.030 2.501 2.370 2.589 . 0 0 "[ . 1 . 2 . 3 ]" 1
1909 2 11 GLU HB2 2 13 LYS H 5.500 . 5.500 5.001 4.829 5.211 . 0 0 "[ . 1 . 2 . 3 ]" 1
1910 2 51 LYS H 2 51 LYS HD2 5.500 . 5.500 4.588 3.962 5.511 0.011 29 0 "[ . 1 . 2 . 3 ]" 1
1911 2 51 LYS H 2 51 LYS HD3 5.500 . 5.500 4.372 3.804 5.454 . 0 0 "[ . 1 . 2 . 3 ]" 1
1912 2 9 LYS H 2 11 GLU HB2 5.500 . 5.500 5.086 4.792 5.428 . 0 0 "[ . 1 . 2 . 3 ]" 1
1913 2 7 LYS HD2 2 10 ILE H 5.500 . 5.500 4.630 4.359 4.952 . 0 0 "[ . 1 . 2 . 3 ]" 1
1914 2 10 ILE H 2 11 GLU HB2 5.500 . 5.500 4.814 4.600 5.211 . 0 0 "[ . 1 . 2 . 3 ]" 1
1915 2 30 LYS H 2 30 LYS HD3 4.580 . 4.580 4.031 3.519 4.636 0.056 23 0 "[ . 1 . 2 . 3 ]" 1
1916 2 7 LYS H 2 7 LYS HD2 5.250 . 5.250 4.760 4.467 4.939 . 0 0 "[ . 1 . 2 . 3 ]" 1
1917 2 27 ASP H 2 30 LYS HD3 5.500 . 5.500 4.945 4.544 5.429 . 0 0 "[ . 1 . 2 . 3 ]" 1
1918 2 27 ASP H 2 30 LYS HD2 5.500 . 5.500 4.466 3.546 5.265 . 0 0 "[ . 1 . 2 . 3 ]" 1
1919 2 9 LYS H 2 9 LYS HD2 5.500 . 5.500 4.342 3.088 5.040 . 0 0 "[ . 1 . 2 . 3 ]" 1
1920 2 9 LYS H 2 9 LYS HD3 5.500 . 5.500 4.313 3.192 5.176 . 0 0 "[ . 1 . 2 . 3 ]" 1
1921 2 14 LYS H 2 14 LYS HD3 4.900 . 4.900 4.653 4.544 4.852 . 0 0 "[ . 1 . 2 . 3 ]" 1
1922 2 28 HIS HB2 2 29 ASP H 3.850 . 3.850 3.266 2.526 3.889 0.039 12 0 "[ . 1 . 2 . 3 ]" 1
1923 2 14 LYS HD2 2 39 ASP H 4.350 . 4.350 3.836 3.546 4.282 . 0 0 "[ . 1 . 2 . 3 ]" 1
1924 2 40 LYS H 2 40 LYS HD2 5.500 . 5.500 4.485 2.275 4.945 . 0 0 "[ . 1 . 2 . 3 ]" 1
1925 2 40 LYS H 2 40 LYS HD3 5.500 . 5.500 4.373 2.725 5.574 0.074 7 0 "[ . 1 . 2 . 3 ]" 1
1926 2 24 HIS HB3 2 25 GLY H 3.800 . 3.800 2.851 2.239 3.191 . 0 0 "[ . 1 . 2 . 3 ]" 1
1927 2 24 HIS H 2 24 HIS HB2 3.280 . 3.280 2.673 2.525 2.759 . 0 0 "[ . 1 . 2 . 3 ]" 1
1928 2 24 HIS H 2 24 HIS HB3 3.520 . 3.520 2.417 2.281 2.599 . 0 0 "[ . 1 . 2 . 3 ]" 1
1929 2 57 HIS HB3 2 58 HIS H 5.010 . 5.010 3.174 1.762 4.435 . 0 0 "[ . 1 . 2 . 3 ]" 1
1930 2 23 ARG H 2 23 ARG HB3 2.900 . 2.900 2.658 2.564 2.816 . 0 0 "[ . 1 . 2 . 3 ]" 1
1931 2 24 HIS HB3 2 26 LEU H 4.430 . 4.430 3.870 3.341 4.451 0.021 16 0 "[ . 1 . 2 . 3 ]" 1
1932 2 22 ALA H 2 23 ARG HB3 5.500 . 5.500 5.254 5.044 5.477 . 0 0 "[ . 1 . 2 . 3 ]" 1
1933 2 22 ALA H 2 24 HIS HB2 5.500 . 5.500 5.428 5.128 5.529 0.029 25 0 "[ . 1 . 2 . 3 ]" 1
1934 2 22 ALA H 2 24 HIS HB3 5.500 . 5.500 4.934 4.707 5.142 . 0 0 "[ . 1 . 2 . 3 ]" 1
1935 2 53 HIS HB2 2 54 LYS H 4.910 . 4.910 3.723 2.491 4.543 . 0 0 "[ . 1 . 2 . 3 ]" 1
1936 2 53 HIS HB3 2 54 LYS H 4.910 . 4.910 3.716 2.028 4.436 . 0 0 "[ . 1 . 2 . 3 ]" 1
1937 2 18 ILE H 2 18 ILE HG13 3.410 . 3.410 2.066 1.976 2.272 . 0 0 "[ . 1 . 2 . 3 ]" 1
1938 2 18 ILE HG13 2 19 GLN H 4.570 . 4.570 4.204 4.107 4.411 . 0 0 "[ . 1 . 2 . 3 ]" 1
1939 2 13 LYS HB2 2 14 LYS H 4.180 . 4.180 3.667 3.543 3.872 . 0 0 "[ . 1 . 2 . 3 ]" 1
1940 2 21 VAL H 2 24 HIS HB2 5.500 . 5.500 5.393 5.029 5.552 0.052 29 0 "[ . 1 . 2 . 3 ]" 1
1941 2 21 VAL H 2 24 HIS HB3 5.500 . 5.500 5.557 5.506 5.621 0.121 25 0 "[ . 1 . 2 . 3 ]" 1
1942 2 36 ARG HB2 2 37 ASP H 4.330 . 4.330 3.601 2.225 4.088 . 0 0 "[ . 1 . 2 . 3 ]" 1
1943 2 36 ARG HB3 2 37 ASP H 4.330 . 4.330 3.967 3.252 4.246 . 0 0 "[ . 1 . 2 . 3 ]" 1
1944 2 13 LYS H 2 13 LYS HB3 3.660 . 3.660 2.658 2.500 2.809 . 0 0 "[ . 1 . 2 . 3 ]" 1
1945 2 16 GLU H 2 16 GLU HB2 3.190 . 3.190 2.477 2.218 2.561 . 0 0 "[ . 1 . 2 . 3 ]" 1
1946 2 2 GLU HB2 2 3 MET H 5.240 . 5.240 3.867 2.188 4.605 . 0 0 "[ . 1 . 2 . 3 ]" 1
1947 2 2 GLU HB3 2 3 MET H 5.240 . 5.240 3.608 1.714 4.437 . 0 0 "[ . 1 . 2 . 3 ]" 1
1948 2 42 ILE H 2 42 ILE HG13 3.370 . 3.370 2.303 2.137 2.515 . 0 0 "[ . 1 . 2 . 3 ]" 1
1949 2 31 VAL HB 2 32 LEU H 3.470 . 3.470 2.534 2.398 2.828 . 0 0 "[ . 1 . 2 . 3 ]" 1
1950 2 31 VAL H 2 31 VAL HB 3.170 . 3.170 2.636 2.548 2.750 . 0 0 "[ . 1 . 2 . 3 ]" 1
1951 2 30 LYS H 2 31 VAL HB 5.420 . 5.420 4.936 4.787 5.114 . 0 0 "[ . 1 . 2 . 3 ]" 1
1952 2 21 VAL H 2 21 VAL HB 3.360 . 3.360 3.017 2.565 3.546 0.186 31 0 "[ . 1 . 2 . 3 ]" 1
1953 2 10 ILE H 2 10 ILE HG13 3.440 . 3.440 2.266 2.152 2.352 . 0 0 "[ . 1 . 2 . 3 ]" 1
1954 2 14 LYS H 2 14 LYS HB2 3.470 . 3.470 2.403 2.274 2.552 . 0 0 "[ . 1 . 2 . 3 ]" 1
1955 2 7 LYS H 2 7 LYS HB2 2.930 . 2.930 2.085 2.025 2.149 . 0 0 "[ . 1 . 2 . 3 ]" 1
1956 2 10 ILE HG13 2 11 GLU H 4.550 . 4.550 4.322 4.139 4.426 . 0 0 "[ . 1 . 2 . 3 ]" 1
1957 2 13 LYS H 2 14 LYS HB3 4.760 . 4.760 4.476 4.299 4.626 . 0 0 "[ . 1 . 2 . 3 ]" 1
1958 2 12 ASN H 2 14 LYS HB3 5.470 . 5.470 4.888 4.771 5.077 . 0 0 "[ . 1 . 2 . 3 ]" 1
1959 2 12 ASN H 2 15 LYS HB2 5.500 . 5.500 5.018 4.720 5.304 . 0 0 "[ . 1 . 2 . 3 ]" 1
1960 2 14 LYS HB3 2 15 LYS H 3.110 . 3.110 2.319 2.166 2.610 . 0 0 "[ . 1 . 2 . 3 ]" 1
1961 2 15 LYS H 2 15 LYS HB2 3.230 . 3.230 2.421 2.291 2.509 . 0 0 "[ . 1 . 2 . 3 ]" 1
1962 2 15 LYS HB2 2 16 GLU H 3.610 . 3.610 2.768 2.625 2.953 . 0 0 "[ . 1 . 2 . 3 ]" 1
1963 2 44 LYS HB3 2 45 PHE H 3.380 . 3.380 2.341 2.117 2.817 . 0 0 "[ . 1 . 2 . 3 ]" 1
1964 2 44 LYS H 2 44 LYS HB3 3.080 . 3.080 2.503 2.400 2.574 . 0 0 "[ . 1 . 2 . 3 ]" 1
1965 2 3 MET H 2 3 MET HG2 3.970 . 3.970 3.050 2.057 3.991 0.021 12 0 "[ . 1 . 2 . 3 ]" 1
1966 2 3 MET H 2 3 MET HG3 3.970 . 3.970 3.076 2.243 3.847 . 0 0 "[ . 1 . 2 . 3 ]" 1
1967 2 43 ASN H 2 46 MET HG2 5.500 . 5.500 5.258 4.220 5.600 0.100 1 0 "[ . 1 . 2 . 3 ]" 1
1968 2 43 ASN H 2 46 MET HG3 5.500 . 5.500 4.120 3.848 5.016 . 0 0 "[ . 1 . 2 . 3 ]" 1
1969 2 48 VAL H 2 48 VAL HB 3.740 . 3.740 3.188 2.532 3.798 0.058 26 0 "[ . 1 . 2 . 3 ]" 1
1970 2 9 LYS H 2 9 LYS HB2 2.940 . 2.940 2.520 2.384 2.712 . 0 0 "[ . 1 . 2 . 3 ]" 1
1971 2 40 LYS HB2 2 42 ILE H 5.500 . 5.500 5.230 4.821 5.621 0.121 20 0 "[ . 1 . 2 . 3 ]" 1
1972 2 40 LYS HB3 2 42 ILE H 5.500 . 5.500 5.369 4.575 5.585 0.085 13 0 "[ . 1 . 2 . 3 ]" 1
1973 2 46 MET H 2 46 MET HB2 3.230 . 3.230 2.584 2.388 2.706 . 0 0 "[ . 1 . 2 . 3 ]" 1
1974 2 46 MET HB2 2 47 ASN H 3.820 . 3.820 2.980 2.481 3.603 . 0 0 "[ . 1 . 2 . 3 ]" 1
1975 2 9 LYS HB3 2 13 LYS H 4.840 . 4.840 4.705 4.414 4.879 0.039 9 0 "[ . 1 . 2 . 3 ]" 1
1976 2 9 LYS HB2 2 10 ILE H 3.730 . 3.730 2.621 2.282 3.050 . 0 0 "[ . 1 . 2 . 3 ]" 1
1977 2 45 PHE H 2 46 MET HB2 4.940 . 4.940 4.786 4.155 4.950 0.010 21 0 "[ . 1 . 2 . 3 ]" 1
1978 2 51 LYS H 2 51 LYS HB3 3.150 . 3.150 2.910 2.488 3.202 0.052 27 0 "[ . 1 . 2 . 3 ]" 1
1979 2 49 LYS H 2 49 LYS HB2 4.010 . 4.010 2.798 2.376 3.913 . 0 0 "[ . 1 . 2 . 3 ]" 1
1980 2 27 ASP H 2 30 LYS HB2 3.640 . 3.640 2.375 2.024 2.789 . 0 0 "[ . 1 . 2 . 3 ]" 1
1981 2 30 LYS H 2 30 LYS HB2 3.180 . 3.180 2.345 2.240 2.439 . 0 0 "[ . 1 . 2 . 3 ]" 1
1982 2 54 LYS HB3 2 55 LEU H 4.980 . 4.980 3.567 1.983 4.463 . 0 0 "[ . 1 . 2 . 3 ]" 1
1983 2 29 ASP H 2 30 LYS HB2 4.800 . 4.800 4.569 4.251 4.753 . 0 0 "[ . 1 . 2 . 3 ]" 1
1984 2 5 GLN HG2 2 6 LEU H 5.500 . 5.500 4.301 2.442 5.320 . 0 0 "[ . 1 . 2 . 3 ]" 1
1985 2 5 GLN HG3 2 6 LEU H 5.500 . 5.500 4.254 2.082 5.263 . 0 0 "[ . 1 . 2 . 3 ]" 1
1986 2 5 GLN H 2 5 GLN HG2 4.390 . 4.390 2.810 2.055 4.071 . 0 0 "[ . 1 . 2 . 3 ]" 1
1987 2 19 GLN HG3 2 20 LEU H 4.730 . 4.730 4.391 4.147 4.623 . 0 0 "[ . 1 . 2 . 3 ]" 1
1988 2 19 GLN H 2 19 GLN HG3 3.250 . 3.250 2.226 2.058 2.395 . 0 0 "[ . 1 . 2 . 3 ]" 1
1989 2 11 GLU H 2 11 GLU HG3 3.790 . 3.790 3.605 2.179 3.790 . 0 0 "[ . 1 . 2 . 3 ]" 1
1990 2 56 GLU H 2 56 GLU HG2 5.350 . 5.350 3.800 2.039 5.326 . 0 0 "[ . 1 . 2 . 3 ]" 1
1991 2 56 GLU H 2 56 GLU HG3 5.350 . 5.350 3.918 2.088 4.906 . 0 0 "[ . 1 . 2 . 3 ]" 1
1992 2 2 GLU HG2 2 3 MET H 5.500 . 5.500 4.840 3.324 5.657 0.157 19 0 "[ . 1 . 2 . 3 ]" 1
1993 2 2 GLU HG3 2 3 MET H 5.500 . 5.500 4.497 2.785 5.562 0.062 1 0 "[ . 1 . 2 . 3 ]" 1
1994 2 16 GLU HG2 2 17 LEU H 5.500 . 5.500 4.936 4.605 5.056 . 0 0 "[ . 1 . 2 . 3 ]" 1
1995 2 16 GLU HG3 2 17 LEU H 5.500 . 5.500 4.445 4.307 5.183 . 0 0 "[ . 1 . 2 . 3 ]" 1
1996 2 42 ILE H 2 42 ILE HB 3.300 . 3.300 2.502 2.436 2.648 . 0 0 "[ . 1 . 2 . 3 ]" 1
1997 2 42 ILE HB 2 43 ASN H 2.990 . 2.990 2.495 2.259 2.760 . 0 0 "[ . 1 . 2 . 3 ]" 1
1998 2 43 ASN H 2 43 ASN HB2 3.250 . 3.250 2.508 2.377 2.667 . 0 0 "[ . 1 . 2 . 3 ]" 1
1999 2 43 ASN HB2 2 44 LYS H 3.430 . 3.430 2.798 2.549 3.043 . 0 0 "[ . 1 . 2 . 3 ]" 1
2000 2 10 ILE H 2 10 ILE HB 3.390 . 3.390 2.438 2.321 2.574 . 0 0 "[ . 1 . 2 . 3 ]" 1
2001 2 43 ASN HB2 2 43 ASN HD22 3.980 . 3.980 3.471 3.436 3.527 . 0 0 "[ . 1 . 2 . 3 ]" 1
2002 2 34 PHE H 2 34 PHE HB3 3.280 . 3.280 2.450 2.369 2.503 . 0 0 "[ . 1 . 2 . 3 ]" 1
2003 2 10 ILE HB 2 11 GLU H 3.560 . 3.560 2.478 2.303 2.565 . 0 0 "[ . 1 . 2 . 3 ]" 1
2004 2 34 PHE HB3 2 35 SER H 3.570 . 3.570 2.519 2.423 2.639 . 0 0 "[ . 1 . 2 . 3 ]" 1
2005 2 12 ASN H 2 12 ASN HB2 3.280 . 3.280 2.578 2.305 2.776 . 0 0 "[ . 1 . 2 . 3 ]" 1
2006 2 8 ASN HB2 2 9 LYS H 3.930 . 3.930 3.793 2.951 3.957 0.027 29 0 "[ . 1 . 2 . 3 ]" 1
2007 2 8 ASN HB3 2 9 LYS H 3.930 . 3.930 2.697 2.300 3.881 . 0 0 "[ . 1 . 2 . 3 ]" 1
2008 2 18 ILE H 2 18 ILE HB 3.470 . 3.470 2.600 2.517 2.692 . 0 0 "[ . 1 . 2 . 3 ]" 1
2009 2 18 ILE HB 2 19 GLN H 3.600 . 3.600 2.585 2.525 2.665 . 0 0 "[ . 1 . 2 . 3 ]" 1
2010 2 46 MET H 2 47 ASN HB2 5.450 . 5.450 5.224 4.835 5.493 0.043 14 0 "[ . 1 . 2 . 3 ]" 1
2011 2 47 ASN H 2 47 ASN HB2 3.260 . 3.260 3.228 3.081 3.375 0.115 4 0 "[ . 1 . 2 . 3 ]" 1
2012 2 47 ASN HB2 2 48 VAL H 4.900 . 4.900 4.329 3.342 4.600 . 0 0 "[ . 1 . 2 . 3 ]" 1
2013 2 45 PHE HB2 2 46 MET H 4.000 . 4.000 3.137 2.936 3.497 . 0 0 "[ . 1 . 2 . 3 ]" 1
2014 2 45 PHE H 2 45 PHE HB2 3.270 . 3.270 2.286 2.190 2.354 . 0 0 "[ . 1 . 2 . 3 ]" 1
2015 2 29 ASP HB2 2 30 LYS H 3.990 . 3.990 3.328 2.351 3.994 0.004 12 0 "[ . 1 . 2 . 3 ]" 1
2016 2 29 ASP H 2 29 ASP HB2 3.610 . 3.610 2.762 2.384 3.642 0.032 7 0 "[ . 1 . 2 . 3 ]" 1
2017 2 37 ASP HB2 2 38 LEU H 4.130 . 4.130 3.634 3.179 3.877 . 0 0 "[ . 1 . 2 . 3 ]" 1
2018 2 37 ASP HB3 2 38 LEU H 4.130 . 4.130 2.678 2.325 3.649 . 0 0 "[ . 1 . 2 . 3 ]" 1
2019 2 37 ASP H 2 37 ASP HB3 3.810 . 3.810 2.778 2.627 3.510 . 0 0 "[ . 1 . 2 . 3 ]" 1
2020 2 39 ASP HB3 2 40 LYS H 3.180 . 3.180 2.487 2.236 2.706 . 0 0 "[ . 1 . 2 . 3 ]" 1
2021 2 39 ASP H 2 39 ASP HB2 2.920 . 2.920 2.462 2.339 2.608 . 0 0 "[ . 1 . 2 . 3 ]" 1
2022 2 39 ASP H 2 39 ASP HB3 3.200 . 3.200 2.560 2.436 2.693 . 0 0 "[ . 1 . 2 . 3 ]" 1
2023 2 39 ASP HB3 2 43 ASN HD22 4.990 . 4.990 4.552 3.566 4.996 0.006 4 0 "[ . 1 . 2 . 3 ]" 1
2024 2 38 LEU H 2 38 LEU HB2 3.510 . 3.510 2.607 2.383 2.683 . 0 0 "[ . 1 . 2 . 3 ]" 1
2025 2 38 LEU H 2 38 LEU HB3 3.510 . 3.510 2.308 2.147 2.525 . 0 0 "[ . 1 . 2 . 3 ]" 1
2026 2 14 LYS H 2 14 LYS HE2 4.730 . 4.730 4.248 3.982 4.483 . 0 0 "[ . 1 . 2 . 3 ]" 1
2027 2 14 LYS HE2 2 15 LYS H 4.790 . 4.790 3.565 3.188 3.817 . 0 0 "[ . 1 . 2 . 3 ]" 1
2028 2 14 LYS HE3 2 15 LYS H 5.140 . 5.140 4.349 3.882 4.611 . 0 0 "[ . 1 . 2 . 3 ]" 1
2029 2 6 LEU H 2 6 LEU HB3 3.400 . 3.400 2.409 2.301 2.539 . 0 0 "[ . 1 . 2 . 3 ]" 1
2030 2 6 LEU H 2 6 LEU HB2 3.650 . 3.650 2.523 2.435 2.677 . 0 0 "[ . 1 . 2 . 3 ]" 1
2031 2 6 LEU HB3 2 7 LYS H 3.390 . 3.390 2.500 2.381 2.576 . 0 0 "[ . 1 . 2 . 3 ]" 1
2032 2 27 ASP HB2 2 30 LYS H 4.510 . 4.510 2.852 1.964 4.373 . 0 0 "[ . 1 . 2 . 3 ]" 1
2033 2 27 ASP HB3 2 30 LYS H 4.510 . 4.510 3.545 2.532 4.595 0.085 14 0 "[ . 1 . 2 . 3 ]" 1
2034 2 33 LEU H 2 33 LEU HB2 3.020 . 3.020 2.464 2.257 2.582 . 0 0 "[ . 1 . 2 . 3 ]" 1
2035 2 27 ASP H 2 27 ASP HB3 3.730 . 3.730 3.461 2.448 3.699 . 0 0 "[ . 1 . 2 . 3 ]" 1
2036 2 27 ASP HB2 2 29 ASP H 4.250 . 4.250 3.419 2.858 4.336 0.086 12 0 "[ . 1 . 2 . 3 ]" 1
2037 2 27 ASP HB2 2 28 HIS H 4.530 . 4.530 3.596 3.112 4.350 . 0 0 "[ . 1 . 2 . 3 ]" 1
2038 2 33 LEU HB3 2 37 ASP H 5.130 . 5.130 5.106 4.788 5.188 0.058 25 0 "[ . 1 . 2 . 3 ]" 1
2039 2 33 LEU HB2 2 34 PHE H 3.500 . 3.500 2.598 2.337 2.813 . 0 0 "[ . 1 . 2 . 3 ]" 1
2040 2 17 LEU HB3 2 18 ILE H 3.710 . 3.710 2.653 2.340 2.835 . 0 0 "[ . 1 . 2 . 3 ]" 1
2041 2 17 LEU H 2 17 LEU HB3 3.140 . 3.140 2.273 2.218 2.389 . 0 0 "[ . 1 . 2 . 3 ]" 1
2042 2 16 GLU H 2 17 LEU HB3 4.900 . 4.900 4.644 4.503 4.809 . 0 0 "[ . 1 . 2 . 3 ]" 1
2043 2 40 LYS H 2 41 LEU HB3 5.500 . 5.500 4.867 4.589 5.360 . 0 0 "[ . 1 . 2 . 3 ]" 1
2044 2 40 LYS H 2 41 LEU HB2 5.500 . 5.500 4.990 4.425 5.256 . 0 0 "[ . 1 . 2 . 3 ]" 1
2045 2 41 LEU HB3 2 42 ILE H 3.510 . 3.510 2.544 2.321 2.659 . 0 0 "[ . 1 . 2 . 3 ]" 1
2046 2 41 LEU H 2 41 LEU HB3 3.310 . 3.310 2.511 2.361 2.976 . 0 0 "[ . 1 . 2 . 3 ]" 1
2047 2 20 LEU HB2 2 21 VAL H 3.740 . 3.740 2.575 2.429 2.806 . 0 0 "[ . 1 . 2 . 3 ]" 1
2048 2 20 LEU H 2 20 LEU HB2 3.280 . 3.280 2.422 2.187 2.569 . 0 0 "[ . 1 . 2 . 3 ]" 1
2049 2 26 LEU HB3 2 30 LYS H 4.630 . 4.630 4.123 3.806 4.596 . 0 0 "[ . 1 . 2 . 3 ]" 1
2050 2 26 LEU HB3 2 31 VAL H 4.100 . 4.100 3.115 2.793 3.463 . 0 0 "[ . 1 . 2 . 3 ]" 1
2051 2 26 LEU HB3 2 27 ASP H 3.340 . 3.340 2.856 2.446 3.346 0.006 19 0 "[ . 1 . 2 . 3 ]" 1
2052 2 26 LEU H 2 26 LEU HB2 2.840 . 2.840 2.277 1.986 2.582 . 0 0 "[ . 1 . 2 . 3 ]" 1
2053 2 25 GLY H 2 26 LEU HB2 4.280 . 4.280 3.785 3.253 4.236 . 0 0 "[ . 1 . 2 . 3 ]" 1
2054 2 4 GLY HA3 2 7 LYS H 4.480 . 4.480 3.479 3.161 3.811 . 0 0 "[ . 1 . 2 . 3 ]" 1
2055 2 46 MET H 2 47 ASN HA 5.000 . 5.000 4.661 4.378 5.052 0.052 17 0 "[ . 1 . 2 . 3 ]" 1
2056 2 47 ASN HA 2 48 VAL H 3.020 . 3.020 2.761 2.163 3.311 0.291 17 0 "[ . 1 . 2 . 3 ]" 1
2057 2 27 ASP HA 2 29 ASP H 4.760 . 4.760 4.395 4.114 4.675 . 0 0 "[ . 1 . 2 . 3 ]" 1
2058 2 50 ASP HA 2 52 VAL H 4.280 . 4.280 3.524 2.730 4.285 0.005 3 0 "[ . 1 . 2 . 3 ]" 1
2059 2 50 ASP HA 2 51 LYS H 2.600 . 2.600 2.251 1.956 2.709 0.109 8 0 "[ . 1 . 2 . 3 ]" 1
2060 2 55 LEU HA 2 56 GLU H 2.760 . 2.760 2.202 1.959 2.770 0.010 9 0 "[ . 1 . 2 . 3 ]" 1
2061 2 26 LEU HA 2 27 ASP H 2.590 . 2.590 2.056 1.870 2.185 . 0 0 "[ . 1 . 2 . 3 ]" 1
2062 2 53 HIS HA 2 54 LYS H 3.280 . 3.280 2.625 2.024 3.412 0.132 30 0 "[ . 1 . 2 . 3 ]" 1
2063 2 8 ASN HA 2 8 ASN HD22 4.980 . 4.980 4.566 4.021 4.851 . 0 0 "[ . 1 . 2 . 3 ]" 1
2064 2 43 ASN HA 2 45 PHE H 4.600 . 4.600 4.402 3.777 4.619 0.019 21 0 "[ . 1 . 2 . 3 ]" 1
2065 2 43 ASN HA 2 48 VAL H 5.000 . 5.000 3.989 3.233 5.037 0.037 16 0 "[ . 1 . 2 . 3 ]" 1
2066 2 48 VAL H 2 49 LYS HA 5.500 . 5.500 4.982 4.435 5.528 0.028 18 0 "[ . 1 . 2 . 3 ]" 1
2067 2 42 ILE H 2 43 ASN HA 5.430 . 5.430 5.308 5.194 5.454 0.024 19 0 "[ . 1 . 2 . 3 ]" 1
2068 2 54 LYS HA 2 55 LEU H 2.680 . 2.680 2.258 2.001 2.821 0.141 9 0 "[ . 1 . 2 . 3 ]" 1
2069 2 2 GLU HA 2 3 MET H 3.180 . 3.180 2.246 2.022 3.252 0.072 6 0 "[ . 1 . 2 . 3 ]" 1
2070 2 2 GLU HA 2 4 GLY H 4.060 . 4.060 3.638 2.981 4.120 0.060 8 0 "[ . 1 . 2 . 3 ]" 1
2071 2 3 MET HA 2 6 LEU H 4.370 . 4.370 3.051 2.310 3.428 . 0 0 "[ . 1 . 2 . 3 ]" 1
2072 2 3 MET HA 2 7 LYS H 4.450 . 4.450 3.825 3.590 4.206 . 0 0 "[ . 1 . 2 . 3 ]" 1
2073 2 13 LYS HA 2 16 GLU H 3.820 . 3.820 3.271 3.169 3.446 . 0 0 "[ . 1 . 2 . 3 ]" 1
2074 2 37 ASP HA 2 40 LYS H 3.810 . 3.810 3.384 2.970 3.828 0.018 6 0 "[ . 1 . 2 . 3 ]" 1
2075 2 29 ASP HA 2 32 LEU H 3.840 . 3.840 3.386 3.047 3.677 . 0 0 "[ . 1 . 2 . 3 ]" 1
2076 2 5 GLN HA 2 7 LYS H 4.770 . 4.770 4.423 4.227 4.752 . 0 0 "[ . 1 . 2 . 3 ]" 1
2077 2 29 ASP HA 2 33 LEU H 4.660 . 4.660 3.966 3.687 4.157 . 0 0 "[ . 1 . 2 . 3 ]" 1
2078 2 5 GLN HA 2 8 ASN H 3.910 . 3.910 3.211 2.799 3.596 . 0 0 "[ . 1 . 2 . 3 ]" 1
2079 2 39 ASP HA 2 42 ILE H 3.850 . 3.850 3.591 3.370 3.788 . 0 0 "[ . 1 . 2 . 3 ]" 1
2080 2 39 ASP HA 2 43 ASN H 4.310 . 4.310 3.994 3.818 4.217 . 0 0 "[ . 1 . 2 . 3 ]" 1
2081 2 20 LEU HA 2 22 ALA H 4.500 . 4.500 4.214 4.013 4.372 . 0 0 "[ . 1 . 2 . 3 ]" 1
2082 2 33 LEU HA 2 36 ARG H 3.820 . 3.820 3.770 3.507 3.850 0.030 28 0 "[ . 1 . 2 . 3 ]" 1
2083 2 32 LEU HA 2 35 SER H 3.770 . 3.770 3.738 3.636 3.787 0.017 14 0 "[ . 1 . 2 . 3 ]" 1
2084 2 41 LEU HA 2 44 LYS H 3.750 . 3.750 3.652 3.294 3.809 0.059 13 0 "[ . 1 . 2 . 3 ]" 1
2085 2 16 GLU H 2 17 LEU HA 5.500 . 5.500 5.284 5.190 5.374 . 0 0 "[ . 1 . 2 . 3 ]" 1
2086 2 17 LEU HA 2 21 VAL H 4.920 . 4.920 4.074 3.931 4.248 . 0 0 "[ . 1 . 2 . 3 ]" 1
2087 2 19 GLN HA 2 21 VAL H 5.370 . 5.370 4.888 4.653 5.049 . 0 0 "[ . 1 . 2 . 3 ]" 1
2088 2 19 GLN HA 2 23 ARG H 4.370 . 4.370 3.996 3.749 4.195 . 0 0 "[ . 1 . 2 . 3 ]" 1
2089 2 29 ASP H 2 30 LYS HA 5.270 . 5.270 5.204 5.008 5.315 0.045 32 0 "[ . 1 . 2 . 3 ]" 1
2090 2 30 LYS HA 2 33 LEU H 3.670 . 3.670 3.555 3.401 3.687 0.017 9 0 "[ . 1 . 2 . 3 ]" 1
2091 2 30 LYS HA 2 34 PHE H 4.280 . 4.280 3.803 3.657 3.974 . 0 0 "[ . 1 . 2 . 3 ]" 1
2092 2 30 LYS HA 2 32 LEU H 4.530 . 4.530 4.423 4.162 4.541 0.011 13 0 "[ . 1 . 2 . 3 ]" 1
2093 2 44 LYS HA 2 47 ASN H 4.630 . 4.630 4.006 3.705 4.637 0.007 14 0 "[ . 1 . 2 . 3 ]" 1
2094 2 44 LYS HA 2 46 MET H 4.530 . 4.530 4.489 4.310 4.616 0.086 10 0 "[ . 1 . 2 . 3 ]" 1
2095 2 36 ARG HA 2 39 ASP H 3.850 . 3.850 3.386 3.107 3.787 . 0 0 "[ . 1 . 2 . 3 ]" 1
2096 2 40 LYS HA 2 43 ASN H 3.910 . 3.910 3.585 2.948 3.928 0.018 26 0 "[ . 1 . 2 . 3 ]" 1
2097 2 40 LYS HA 2 43 ASN HD21 4.750 . 4.750 2.903 2.098 3.377 . 0 0 "[ . 1 . 2 . 3 ]" 1
2098 2 40 LYS HA 2 43 ASN HD22 4.750 . 4.750 4.277 3.323 4.796 0.046 19 0 "[ . 1 . 2 . 3 ]" 1
2099 2 28 HIS HA 2 31 VAL H 3.790 . 3.790 3.390 2.849 3.792 0.002 4 0 "[ . 1 . 2 . 3 ]" 1
2100 2 28 HIS HA 2 30 LYS H 4.430 . 4.430 4.238 3.962 4.448 0.018 23 0 "[ . 1 . 2 . 3 ]" 1
2101 2 34 PHE HA 2 37 ASP H 4.000 . 4.000 3.630 3.433 3.759 . 0 0 "[ . 1 . 2 . 3 ]" 1
2102 2 45 PHE HA 2 47 ASN H 4.230 . 4.230 3.687 3.230 4.306 0.076 20 0 "[ . 1 . 2 . 3 ]" 1
2103 2 35 SER HA 2 39 ASP H 4.300 . 4.300 3.913 3.713 4.147 . 0 0 "[ . 1 . 2 . 3 ]" 1
2104 2 35 SER HA 2 38 LEU H 4.120 . 4.120 3.721 3.591 3.847 . 0 0 "[ . 1 . 2 . 3 ]" 1
2105 2 52 VAL HA 2 53 HIS H 3.430 . 3.430 2.510 2.039 3.444 0.014 10 0 "[ . 1 . 2 . 3 ]" 1
2106 2 48 VAL HA 2 49 LYS H 2.570 . 2.570 2.005 1.862 2.242 . 0 0 "[ . 1 . 2 . 3 ]" 1
2107 2 51 LYS H 2 52 VAL HA 5.500 . 5.500 4.694 3.976 5.476 . 0 0 "[ . 1 . 2 . 3 ]" 1
2108 2 35 SER H 2 35 SER HB2 3.620 . 3.620 3.584 3.550 3.613 . 0 0 "[ . 1 . 2 . 3 ]" 1
2109 2 35 SER H 2 35 SER HB3 3.620 . 3.620 2.643 2.597 2.698 . 0 0 "[ . 1 . 2 . 3 ]" 1
2110 2 42 ILE HA 2 46 MET H 4.650 . 4.650 4.112 3.888 4.472 . 0 0 "[ . 1 . 2 . 3 ]" 1
2111 2 42 ILE HA 2 45 PHE H 4.180 . 4.180 3.453 3.209 3.666 . 0 0 "[ . 1 . 2 . 3 ]" 1
2112 2 18 ILE HA 2 20 LEU H 4.440 . 4.440 4.135 3.877 4.415 . 0 0 "[ . 1 . 2 . 3 ]" 1
2113 2 21 VAL HA 2 24 HIS H 4.380 . 4.380 3.560 3.257 3.835 . 0 0 "[ . 1 . 2 . 3 ]" 1
2114 2 31 VAL HA 2 35 SER H 4.080 . 4.080 3.797 3.673 3.947 . 0 0 "[ . 1 . 2 . 3 ]" 1
2115 2 30 LYS H 2 31 VAL HA 5.380 . 5.380 5.268 5.182 5.362 . 0 0 "[ . 1 . 2 . 3 ]" 1
2116 2 31 VAL HA 2 33 LEU H 4.910 . 4.910 4.708 4.452 4.870 . 0 0 "[ . 1 . 2 . 3 ]" 1
2117 2 31 VAL HA 2 34 PHE H 3.890 . 3.890 3.685 3.519 3.853 . 0 0 "[ . 1 . 2 . 3 ]" 1
2118 2 22 ALA HA 2 24 HIS H 4.500 . 4.500 3.866 3.736 4.003 . 0 0 "[ . 1 . 2 . 3 ]" 1
2119 2 22 ALA HA 2 25 GLY H 4.870 . 4.870 3.871 3.462 4.155 . 0 0 "[ . 1 . 2 . 3 ]" 1
2120 2 25 GLY H 2 26 LEU HA 5.250 . 5.250 4.399 4.221 4.592 . 0 0 "[ . 1 . 2 . 3 ]" 1
2121 2 8 ASN HA 2 11 GLU H 3.960 . 3.960 3.429 2.902 3.864 . 0 0 "[ . 1 . 2 . 3 ]" 1
2122 2 3 MET HA 2 5 GLN H 4.640 . 4.640 4.112 3.526 4.672 0.032 5 0 "[ . 1 . 2 . 3 ]" 1
2123 2 5 GLN HA 2 9 LYS H 4.960 . 4.960 4.143 3.889 4.510 . 0 0 "[ . 1 . 2 . 3 ]" 1
2124 2 6 LEU HA 2 9 LYS H 3.880 . 3.880 3.398 3.280 3.587 . 0 0 "[ . 1 . 2 . 3 ]" 1
2125 2 17 LEU HA 2 20 LEU H 3.850 . 3.850 3.226 3.126 3.435 . 0 0 "[ . 1 . 2 . 3 ]" 1
2126 2 19 GLN HA 2 22 ALA H 3.950 . 3.950 3.556 3.142 3.750 . 0 0 "[ . 1 . 2 . 3 ]" 1
2127 2 11 GLU HA 2 14 LYS H 3.960 . 3.960 3.831 3.705 3.974 0.014 20 0 "[ . 1 . 2 . 3 ]" 1
2128 2 11 GLU HA 2 15 LYS H 4.090 . 4.090 4.003 3.740 4.114 0.024 20 0 "[ . 1 . 2 . 3 ]" 1
2129 2 9 LYS HA 2 12 ASN H 3.830 . 3.830 3.388 3.093 3.767 . 0 0 "[ . 1 . 2 . 3 ]" 1
2130 2 7 LYS HA 2 10 ILE H 3.890 . 3.890 3.222 3.021 3.421 . 0 0 "[ . 1 . 2 . 3 ]" 1
2131 2 15 LYS HA 2 19 GLN H 4.670 . 4.670 3.971 3.701 4.196 . 0 0 "[ . 1 . 2 . 3 ]" 1
2132 2 15 LYS HA 2 18 ILE H 3.830 . 3.830 3.128 2.906 3.292 . 0 0 "[ . 1 . 2 . 3 ]" 1
2133 2 14 LYS HA 2 17 LEU H 3.770 . 3.770 3.621 3.397 3.761 . 0 0 "[ . 1 . 2 . 3 ]" 1
2134 2 10 ILE HA 2 13 LYS H 3.980 . 3.980 3.564 3.380 3.897 . 0 0 "[ . 1 . 2 . 3 ]" 1
2135 2 10 ILE HA 2 14 LYS H 4.440 . 4.440 3.804 3.635 3.995 . 0 0 "[ . 1 . 2 . 3 ]" 1
2136 2 18 ILE HA 2 22 ALA H 4.450 . 4.450 3.936 3.701 4.127 . 0 0 "[ . 1 . 2 . 3 ]" 1
2137 2 21 VAL HA 2 23 ARG H 4.980 . 4.980 4.530 4.258 4.740 . 0 0 "[ . 1 . 2 . 3 ]" 1
2138 2 38 LEU HA 2 41 LEU H 3.600 . 3.600 3.367 3.153 3.601 0.001 8 0 "[ . 1 . 2 . 3 ]" 1
2139 2 55 LEU MD1 2 56 GLU H 5.150 . 5.150 4.529 3.103 5.298 0.148 15 0 "[ . 1 . 2 . 3 ]" 1
2140 2 34 PHE QD 2 35 SER H 4.400 . 4.400 3.303 3.145 3.539 . 0 0 "[ . 1 . 2 . 3 ]" 1
2141 2 34 PHE H 2 34 PHE QD 4.440 . 4.440 4.176 4.147 4.198 . 0 0 "[ . 1 . 2 . 3 ]" 1
2142 2 41 LEU HG 2 42 ILE H 4.960 . 4.960 4.019 3.535 4.994 0.034 13 0 "[ . 1 . 2 . 3 ]" 1
2143 2 52 VAL HB 2 53 HIS H 4.830 . 4.830 3.174 2.106 4.380 . 0 0 "[ . 1 . 2 . 3 ]" 1
2144 1 1 MET HA 1 1 MET QG 3.630 . 3.630 2.716 2.422 3.384 . 0 0 "[ . 1 . 2 . 3 ]" 1
2145 1 1 MET ME 1 1 MET QG 3.530 . 3.530 2.329 2.208 2.474 . 0 0 "[ . 1 . 2 . 3 ]" 1
2146 1 2 GLU HA 1 2 GLU QG 3.710 . 3.710 2.651 2.350 3.354 . 0 0 "[ . 1 . 2 . 3 ]" 1
2147 1 2 GLU QB 1 4 GLY H 4.590 . 4.590 3.366 2.471 4.305 . 0 0 "[ . 1 . 2 . 3 ]" 1
2148 1 2 GLU QB 1 5 GLN H 4.940 . 4.940 3.081 2.180 3.932 . 0 0 "[ . 1 . 2 . 3 ]" 1
2149 1 2 GLU QB 1 5 GLN QG 4.230 . 4.230 2.922 2.051 4.267 0.037 28 0 "[ . 1 . 2 . 3 ]" 1
2150 1 3 MET H 1 3 MET QB 3.560 . 3.560 2.544 2.409 2.815 . 0 0 "[ . 1 . 2 . 3 ]" 1
2151 1 3 MET HA 1 3 MET QG 3.540 . 3.540 2.967 2.347 3.514 . 0 0 "[ . 1 . 2 . 3 ]" 1
2152 1 3 MET HA 1 5 GLN QB 5.340 . 5.340 5.219 4.616 5.491 0.151 11 0 "[ . 1 . 2 . 3 ]" 1
2153 1 3 MET HA 1 6 LEU QD 4.500 . 4.500 3.434 2.781 4.044 . 0 0 "[ . 1 . 2 . 3 ]" 1
2154 1 3 MET QB 1 6 LEU HG 5.340 . 5.340 4.662 4.038 5.346 0.006 25 0 "[ . 1 . 2 . 3 ]" 1
2155 1 3 MET QB 1 6 LEU QD 4.040 . 4.040 3.595 2.807 4.088 0.048 27 0 "[ . 1 . 2 . 3 ]" 1
2156 1 3 MET ME 1 3 MET QG 3.090 . 3.090 2.357 2.178 2.491 . 0 0 "[ . 1 . 2 . 3 ]" 1
2157 1 3 MET QG 1 4 GLY H 4.530 . 4.530 3.495 2.301 4.524 . 0 0 "[ . 1 . 2 . 3 ]" 1
2158 1 5 GLN H 1 5 GLN QB 3.230 . 3.230 2.466 2.355 2.710 . 0 0 "[ . 1 . 2 . 3 ]" 1
2159 1 5 GLN H 1 5 GLN QG 3.650 . 3.650 2.322 2.085 2.753 . 0 0 "[ . 1 . 2 . 3 ]" 1
2160 1 5 GLN HA 1 5 GLN QG 3.350 . 3.350 2.735 2.304 3.366 0.016 11 0 "[ . 1 . 2 . 3 ]" 1
2161 1 5 GLN HA 1 5 GLN QE 5.340 . 5.340 4.403 2.791 5.432 0.092 13 0 "[ . 1 . 2 . 3 ]" 1
2162 1 5 GLN HA 1 8 ASN QB 3.550 . 3.550 2.321 1.882 2.730 . 0 0 "[ . 1 . 2 . 3 ]" 1
2163 1 5 GLN HA 1 8 ASN QD 4.110 . 4.110 3.274 2.182 3.945 . 0 0 "[ . 1 . 2 . 3 ]" 1
2164 1 5 GLN QB 1 6 LEU H 3.750 . 3.750 2.871 2.321 3.566 . 0 0 "[ . 1 . 2 . 3 ]" 1
2165 1 5 GLN QB 1 6 LEU HA 5.030 . 5.030 4.067 3.704 4.689 . 0 0 "[ . 1 . 2 . 3 ]" 1
2166 1 5 GLN QB 1 8 ASN H 5.340 . 5.340 4.679 4.396 4.851 . 0 0 "[ . 1 . 2 . 3 ]" 1
2167 1 5 GLN QB 1 8 ASN QB 4.180 . 4.180 3.703 3.028 4.204 0.024 24 0 "[ . 1 . 2 . 3 ]" 1
2168 1 5 GLN QB 1 8 ASN QD 4.700 . 4.700 4.332 3.202 4.803 0.103 26 0 "[ . 1 . 2 . 3 ]" 1
2169 1 5 GLN QB 1 9 LYS H 5.340 . 5.340 4.697 4.369 5.074 . 0 0 "[ . 1 . 2 . 3 ]" 1
2170 1 5 GLN QG 1 6 LEU H 4.640 . 4.640 3.700 2.223 4.300 . 0 0 "[ . 1 . 2 . 3 ]" 1
2171 1 6 LEU H 1 6 LEU QD 3.840 . 3.840 3.682 3.649 3.713 . 0 0 "[ . 1 . 2 . 3 ]" 1
2172 1 6 LEU HA 1 6 LEU QD 2.960 . 2.960 2.166 2.072 2.278 . 0 0 "[ . 1 . 2 . 3 ]" 1
2173 1 6 LEU HA 1 9 LYS QG 3.760 . 3.760 3.047 2.285 3.769 0.009 18 0 "[ . 1 . 2 . 3 ]" 1
2174 1 6 LEU HB3 1 6 LEU QD 2.900 . 2.900 2.251 2.216 2.297 . 0 0 "[ . 1 . 2 . 3 ]" 1
2175 1 6 LEU QD 1 7 LYS H 4.070 . 4.070 3.003 2.776 3.151 . 0 0 "[ . 1 . 2 . 3 ]" 1
2176 1 6 LEU QD 1 7 LYS HA 4.470 . 4.470 2.815 2.545 2.993 . 0 0 "[ . 1 . 2 . 3 ]" 1
2177 1 6 LEU QD 1 7 LYS HG2 3.780 . 3.780 3.407 2.614 3.773 . 0 0 "[ . 1 . 2 . 3 ]" 1
2178 1 6 LEU QD 1 7 LYS HG3 4.650 . 4.650 4.662 4.035 4.776 0.126 5 0 "[ . 1 . 2 . 3 ]" 1
2179 1 6 LEU QD 1 8 ASN H 5.340 . 5.340 4.455 4.255 4.585 . 0 0 "[ . 1 . 2 . 3 ]" 1
2180 1 6 LEU QD 1 9 LYS H 4.830 . 4.830 4.082 3.785 4.271 . 0 0 "[ . 1 . 2 . 3 ]" 1
2181 1 6 LEU QD 1 9 LYS HB2 3.660 . 3.660 3.003 2.661 3.299 . 0 0 "[ . 1 . 2 . 3 ]" 1
2182 1 6 LEU QD 1 9 LYS HB3 4.590 . 4.590 4.143 3.734 4.573 . 0 0 "[ . 1 . 2 . 3 ]" 1
2183 1 6 LEU QD 1 10 ILE H 4.500 . 4.500 3.512 3.305 3.751 . 0 0 "[ . 1 . 2 . 3 ]" 1
2184 1 6 LEU QD 1 10 ILE HG13 4.770 . 4.770 2.437 2.266 2.656 . 0 0 "[ . 1 . 2 . 3 ]" 1
2185 1 6 LEU QD 1 10 ILE MD 2.980 . 2.980 1.960 1.928 2.007 . 0 0 "[ . 1 . 2 . 3 ]" 1
2186 1 6 LEU QD 1 46 MET ME 3.410 . 3.410 2.987 2.140 3.521 0.111 8 0 "[ . 1 . 2 . 3 ]" 1
2187 1 6 LEU QD 2 20 LEU HB3 3.530 . 3.530 3.038 2.788 3.344 . 0 0 "[ . 1 . 2 . 3 ]" 1
2188 1 6 LEU QD 2 21 VAL HA 4.530 . 4.530 3.600 3.297 3.970 . 0 0 "[ . 1 . 2 . 3 ]" 1
2189 1 6 LEU QD 2 23 ARG H 4.600 . 4.600 4.272 4.073 4.550 . 0 0 "[ . 1 . 2 . 3 ]" 1
2190 1 6 LEU QD 2 23 ARG HB2 4.820 . 4.820 4.023 3.765 4.313 . 0 0 "[ . 1 . 2 . 3 ]" 1
2191 1 6 LEU QD 2 23 ARG HG2 4.530 . 4.530 2.990 2.774 3.306 . 0 0 "[ . 1 . 2 . 3 ]" 1
2192 1 6 LEU QD 2 23 ARG QD 3.380 . 3.380 2.529 2.163 2.974 . 0 0 "[ . 1 . 2 . 3 ]" 1
2193 1 6 LEU QD 2 24 HIS H 3.970 . 3.970 3.352 3.088 3.735 . 0 0 "[ . 1 . 2 . 3 ]" 1
2194 1 6 LEU QD 2 24 HIS HA 3.410 . 3.410 2.662 2.236 3.087 . 0 0 "[ . 1 . 2 . 3 ]" 1
2195 1 6 LEU QD 2 24 HIS HB2 3.730 . 3.730 2.083 1.817 2.408 . 0 0 "[ . 1 . 2 . 3 ]" 1
2196 1 6 LEU QD 2 24 HIS HB3 4.370 . 4.370 3.511 3.250 3.869 . 0 0 "[ . 1 . 2 . 3 ]" 1
2197 1 6 LEU QD 2 24 HIS HD2 4.430 . 4.430 3.007 1.989 4.592 0.162 7 0 "[ . 1 . 2 . 3 ]" 1
2198 1 6 LEU QD 2 25 GLY H 5.440 . 5.440 4.892 4.585 5.264 . 0 0 "[ . 1 . 2 . 3 ]" 1
2199 1 7 LYS H 1 7 LYS QD 5.110 . 5.110 4.477 4.129 4.784 . 0 0 "[ . 1 . 2 . 3 ]" 1
2200 1 7 LYS H 1 8 ASN QB 4.720 . 4.720 4.382 3.987 4.728 0.008 7 0 "[ . 1 . 2 . 3 ]" 1
2201 1 7 LYS HB3 1 7 LYS QD 3.370 . 3.370 2.707 2.067 2.880 . 0 0 "[ . 1 . 2 . 3 ]" 1
2202 1 7 LYS HB3 1 7 LYS QE 3.050 . 3.050 2.202 2.008 3.156 0.106 28 0 "[ . 1 . 2 . 3 ]" 1
2203 1 7 LYS HB3 1 11 GLU QG 4.840 . 4.840 3.629 3.110 4.163 . 0 0 "[ . 1 . 2 . 3 ]" 1
2204 1 7 LYS QE 1 7 LYS HG2 3.450 . 3.450 3.284 2.090 3.497 0.047 11 0 "[ . 1 . 2 . 3 ]" 1
2205 1 7 LYS QE 1 7 LYS HG3 3.190 . 3.190 2.521 2.270 3.238 0.048 26 0 "[ . 1 . 2 . 3 ]" 1
2206 1 7 LYS QD 1 8 ASN H 5.120 . 5.120 4.670 4.112 4.815 . 0 0 "[ . 1 . 2 . 3 ]" 1
2207 1 7 LYS QD 1 8 ASN HA 5.060 . 5.060 4.927 3.716 5.172 0.112 25 0 "[ . 1 . 2 . 3 ]" 1
2208 1 7 LYS QD 1 10 ILE H 5.340 . 5.340 4.620 4.245 5.502 0.162 26 0 "[ . 1 . 2 . 3 ]" 1
2209 1 7 LYS QD 1 10 ILE MG 4.740 . 4.740 3.085 2.642 4.248 . 0 0 "[ . 1 . 2 . 3 ]" 1
2210 1 7 LYS QD 1 10 ILE MD 4.340 . 4.340 3.056 2.482 4.287 . 0 0 "[ . 1 . 2 . 3 ]" 1
2211 1 7 LYS QD 1 11 GLU QG 3.680 . 3.680 3.046 2.101 3.649 . 0 0 "[ . 1 . 2 . 3 ]" 1
2212 1 7 LYS QE 1 11 GLU QG 3.580 . 3.580 2.631 2.007 3.589 0.009 17 0 "[ . 1 . 2 . 3 ]" 1
2213 1 8 ASN H 1 8 ASN QB 2.890 . 2.890 2.267 2.114 2.509 . 0 0 "[ . 1 . 2 . 3 ]" 1
2214 1 8 ASN HA 1 8 ASN QD 4.160 . 4.160 3.838 2.891 4.161 0.001 17 0 "[ . 1 . 2 . 3 ]" 1
2215 1 8 ASN HA 1 11 GLU QB 3.630 . 3.630 2.678 2.286 3.104 . 0 0 "[ . 1 . 2 . 3 ]" 1
2216 1 8 ASN QB 1 9 LYS H 3.250 . 3.250 2.573 2.319 2.869 . 0 0 "[ . 1 . 2 . 3 ]" 1
2217 1 8 ASN QB 1 9 LYS QG 4.350 . 4.350 3.441 3.015 3.835 . 0 0 "[ . 1 . 2 . 3 ]" 1
2218 1 9 LYS H 1 9 LYS QG 3.270 . 3.270 2.323 2.153 2.505 . 0 0 "[ . 1 . 2 . 3 ]" 1
2219 1 9 LYS H 1 9 LYS QD 4.770 . 4.770 3.618 3.129 4.463 . 0 0 "[ . 1 . 2 . 3 ]" 1
2220 1 9 LYS H 1 11 GLU QB 5.340 . 5.340 4.964 4.699 5.207 . 0 0 "[ . 1 . 2 . 3 ]" 1
2221 1 9 LYS H 2 20 LEU QD 5.050 . 5.050 4.463 4.154 4.859 . 0 0 "[ . 1 . 2 . 3 ]" 1
2222 1 9 LYS HA 1 9 LYS QG 3.360 . 3.360 2.787 2.336 3.106 . 0 0 "[ . 1 . 2 . 3 ]" 1
2223 1 9 LYS HA 1 9 LYS QD 4.380 . 4.380 2.723 1.937 4.075 . 0 0 "[ . 1 . 2 . 3 ]" 1
2224 1 9 LYS HA 1 12 ASN QB 3.370 . 3.370 2.512 2.119 3.015 . 0 0 "[ . 1 . 2 . 3 ]" 1
2225 1 9 LYS HA 1 12 ASN QD 4.150 . 4.150 3.827 2.811 4.285 0.135 9 0 "[ . 1 . 2 . 3 ]" 1
2226 1 9 LYS HA 2 20 LEU QD 4.320 . 4.320 3.801 3.440 4.095 . 0 0 "[ . 1 . 2 . 3 ]" 1
2227 1 9 LYS HB2 2 20 LEU QD 3.750 . 3.750 2.751 2.508 3.129 . 0 0 "[ . 1 . 2 . 3 ]" 1
2228 1 9 LYS HB3 1 9 LYS QD 3.480 . 3.480 2.492 2.308 3.059 . 0 0 "[ . 1 . 2 . 3 ]" 1
2229 1 9 LYS HB3 1 12 ASN QB 4.960 . 4.960 4.304 3.759 4.853 . 0 0 "[ . 1 . 2 . 3 ]" 1
2230 1 9 LYS HB3 2 20 LEU QD 3.520 . 3.520 2.333 1.998 2.737 . 0 0 "[ . 1 . 2 . 3 ]" 1
2231 1 9 LYS QG 2 20 LEU QD 4.160 . 4.160 3.523 3.030 4.151 . 0 0 "[ . 1 . 2 . 3 ]" 1
2232 1 9 LYS QD 1 10 ILE H 5.340 . 5.340 4.763 4.239 5.272 . 0 0 "[ . 1 . 2 . 3 ]" 1
2233 1 10 ILE H 1 11 GLU QB 5.340 . 5.340 4.699 4.507 4.944 . 0 0 "[ . 1 . 2 . 3 ]" 1
2234 1 10 ILE H 2 20 LEU QD 4.160 . 4.160 3.241 2.535 4.058 . 0 0 "[ . 1 . 2 . 3 ]" 1
2235 1 10 ILE HA 1 13 LYS QB 3.840 . 3.840 2.931 2.623 3.239 . 0 0 "[ . 1 . 2 . 3 ]" 1
2236 1 10 ILE HA 2 17 LEU QD 3.780 . 3.780 2.563 2.320 2.819 . 0 0 "[ . 1 . 2 . 3 ]" 1
2237 1 10 ILE HA 2 20 LEU QD 3.700 . 3.700 2.406 2.019 3.081 . 0 0 "[ . 1 . 2 . 3 ]" 1
2238 1 10 ILE HA 2 21 VAL QG 4.650 . 4.650 4.255 3.774 4.720 0.070 19 0 "[ . 1 . 2 . 3 ]" 1
2239 1 10 ILE HB 1 11 GLU QG 4.940 . 4.940 3.572 3.393 3.755 . 0 0 "[ . 1 . 2 . 3 ]" 1
2240 1 10 ILE MG 2 17 LEU QD 3.050 . 3.050 1.934 1.836 2.134 . 0 0 "[ . 1 . 2 . 3 ]" 1
2241 1 10 ILE MG 2 21 VAL QG 3.630 . 3.630 2.384 2.054 3.065 . 0 0 "[ . 1 . 2 . 3 ]" 1
2242 1 10 ILE HG12 2 20 LEU QD 4.950 . 4.950 3.098 2.686 3.745 . 0 0 "[ . 1 . 2 . 3 ]" 1
2243 1 10 ILE MD 1 46 MET QG 4.500 . 4.500 3.524 3.090 4.001 . 0 0 "[ . 1 . 2 . 3 ]" 1
2244 1 10 ILE MD 2 21 VAL QG 4.080 . 4.080 2.320 2.024 2.900 . 0 0 "[ . 1 . 2 . 3 ]" 1
2245 1 11 GLU H 1 11 GLU QB 2.910 . 2.910 2.456 2.357 2.564 . 0 0 "[ . 1 . 2 . 3 ]" 1
2246 1 11 GLU H 1 11 GLU QG 3.190 . 3.190 2.244 2.107 2.425 . 0 0 "[ . 1 . 2 . 3 ]" 1
2247 1 11 GLU H 1 12 ASN QB 4.660 . 4.660 4.478 4.230 4.666 0.006 25 0 "[ . 1 . 2 . 3 ]" 1
2248 1 11 GLU HA 1 11 GLU QG 3.500 . 3.500 2.905 2.396 3.067 . 0 0 "[ . 1 . 2 . 3 ]" 1
2249 1 11 GLU QB 1 12 ASN H 3.150 . 3.150 2.334 2.216 2.459 . 0 0 "[ . 1 . 2 . 3 ]" 1
2250 1 11 GLU QB 1 12 ASN HA 4.570 . 4.570 3.758 3.639 3.856 . 0 0 "[ . 1 . 2 . 3 ]" 1
2251 1 11 GLU QB 1 12 ASN QB 4.760 . 4.760 3.762 3.574 4.067 . 0 0 "[ . 1 . 2 . 3 ]" 1
2252 1 11 GLU QB 1 13 LYS H 5.340 . 5.340 4.664 4.546 4.839 . 0 0 "[ . 1 . 2 . 3 ]" 1
2253 1 11 GLU QB 1 15 LYS H 5.340 . 5.340 4.702 4.590 4.800 . 0 0 "[ . 1 . 2 . 3 ]" 1
2254 1 11 GLU QB 1 15 LYS HD2 3.980 . 3.980 2.999 2.463 3.384 . 0 0 "[ . 1 . 2 . 3 ]" 1
2255 1 11 GLU QG 1 12 ASN H 4.220 . 4.220 3.963 3.827 4.063 . 0 0 "[ . 1 . 2 . 3 ]" 1
2256 1 12 ASN H 1 12 ASN QB 2.840 . 2.840 2.211 2.079 2.295 . 0 0 "[ . 1 . 2 . 3 ]" 1
2257 1 12 ASN H 1 13 LYS QB 4.730 . 4.730 4.524 4.407 4.707 . 0 0 "[ . 1 . 2 . 3 ]" 1
2258 1 12 ASN H 1 15 LYS QB 5.340 . 5.340 4.874 4.537 5.256 . 0 0 "[ . 1 . 2 . 3 ]" 1
2259 1 12 ASN HA 1 12 ASN QD 4.640 . 4.640 3.637 2.841 4.103 . 0 0 "[ . 1 . 2 . 3 ]" 1
2260 1 12 ASN HA 1 15 LYS QB 3.750 . 3.750 2.715 2.225 3.308 . 0 0 "[ . 1 . 2 . 3 ]" 1
2261 1 12 ASN QB 1 13 LYS H 3.440 . 3.440 2.490 2.176 2.668 . 0 0 "[ . 1 . 2 . 3 ]" 1
2262 1 13 LYS H 1 13 LYS QB 3.050 . 3.050 2.199 2.107 2.269 . 0 0 "[ . 1 . 2 . 3 ]" 1
2263 1 13 LYS H 1 13 LYS QE 4.100 . 4.100 3.617 3.009 3.910 . 0 0 "[ . 1 . 2 . 3 ]" 1
2264 1 13 LYS H 2 17 LEU QD 4.990 . 4.990 4.160 3.781 4.483 . 0 0 "[ . 1 . 2 . 3 ]" 1
2265 1 13 LYS H 2 20 LEU QD 3.800 . 3.800 3.624 3.413 3.875 0.075 21 0 "[ . 1 . 2 . 3 ]" 1
2266 1 13 LYS HA 1 13 LYS QD 3.730 . 3.730 1.996 1.893 2.061 . 0 0 "[ . 1 . 2 . 3 ]" 1
2267 1 13 LYS HA 1 13 LYS QE 3.880 . 3.880 2.696 2.413 2.975 . 0 0 "[ . 1 . 2 . 3 ]" 1
2268 1 13 LYS HA 1 16 GLU QG 4.260 . 4.260 2.763 2.268 3.092 . 0 0 "[ . 1 . 2 . 3 ]" 1
2269 1 13 LYS HA 2 13 LYS QD 4.220 . 4.220 3.243 2.867 3.609 . 0 0 "[ . 1 . 2 . 3 ]" 1
2270 1 13 LYS HA 2 20 LEU QD 4.590 . 4.590 4.340 4.122 4.525 . 0 0 "[ . 1 . 2 . 3 ]" 1
2271 1 13 LYS QB 1 13 LYS QE 3.600 . 3.600 1.999 1.934 2.054 . 0 0 "[ . 1 . 2 . 3 ]" 1
2272 1 13 LYS QB 1 14 LYS H 3.410 . 3.410 2.498 2.307 2.682 . 0 0 "[ . 1 . 2 . 3 ]" 1
2273 1 13 LYS QB 1 16 GLU H 5.320 . 5.320 4.885 4.792 4.991 . 0 0 "[ . 1 . 2 . 3 ]" 1
2274 1 13 LYS QB 2 17 LEU QD 4.180 . 4.180 2.508 2.283 2.822 . 0 0 "[ . 1 . 2 . 3 ]" 1
2275 1 13 LYS QB 2 20 LEU QD 3.480 . 3.480 2.130 1.972 2.342 . 0 0 "[ . 1 . 2 . 3 ]" 1
2276 1 13 LYS HG2 2 13 LYS QD 4.360 . 4.360 3.960 3.699 4.450 0.090 19 0 "[ . 1 . 2 . 3 ]" 1
2277 1 13 LYS HG2 2 20 LEU QD 3.880 . 3.880 2.426 2.137 2.682 . 0 0 "[ . 1 . 2 . 3 ]" 1
2278 1 13 LYS QD 1 16 GLU HB3 5.290 . 5.290 3.816 3.414 4.127 . 0 0 "[ . 1 . 2 . 3 ]" 1
2279 1 13 LYS QD 2 13 LYS HA 4.220 . 4.220 3.301 3.032 3.733 . 0 0 "[ . 1 . 2 . 3 ]" 1
2280 1 13 LYS QD 2 13 LYS HG2 4.360 . 4.360 3.955 3.587 4.334 . 0 0 "[ . 1 . 2 . 3 ]" 1
2281 1 13 LYS QD 2 16 GLU HB3 4.400 . 4.400 2.433 2.094 2.998 . 0 0 "[ . 1 . 2 . 3 ]" 1
2282 1 13 LYS QE 1 16 GLU HB2 4.440 . 4.440 4.468 4.203 4.524 0.084 6 0 "[ . 1 . 2 . 3 ]" 1
2283 1 13 LYS QE 2 16 GLU HB2 5.340 . 5.340 4.022 3.298 4.490 . 0 0 "[ . 1 . 2 . 3 ]" 1
2284 1 13 LYS QE 2 16 GLU HB3 4.720 . 4.720 3.186 2.346 3.974 . 0 0 "[ . 1 . 2 . 3 ]" 1
2285 1 13 LYS QE 2 20 LEU QD 3.690 . 3.690 2.699 2.098 3.147 . 0 0 "[ . 1 . 2 . 3 ]" 1
2286 1 14 LYS H 1 15 LYS QB 5.010 . 5.010 4.658 4.448 4.809 . 0 0 "[ . 1 . 2 . 3 ]" 1
2287 1 14 LYS H 1 15 LYS QG 5.320 . 5.320 4.544 4.303 4.883 . 0 0 "[ . 1 . 2 . 3 ]" 1
2288 1 14 LYS H 1 17 LEU QD 5.440 . 5.440 5.562 5.450 5.639 0.199 18 0 "[ . 1 . 2 . 3 ]" 1
2289 1 14 LYS H 2 17 LEU QD 3.960 . 3.960 2.820 2.146 3.209 . 0 0 "[ . 1 . 2 . 3 ]" 1
2290 1 14 LYS H 2 20 LEU QD 5.040 . 5.040 4.393 4.178 4.597 . 0 0 "[ . 1 . 2 . 3 ]" 1
2291 1 14 LYS HA 1 17 LEU QD 4.120 . 4.120 3.395 3.294 3.462 . 0 0 "[ . 1 . 2 . 3 ]" 1
2292 1 14 LYS HA 1 38 LEU QD 3.860 . 3.860 3.323 2.942 3.731 . 0 0 "[ . 1 . 2 . 3 ]" 1
2293 1 14 LYS HA 2 17 LEU QD 3.660 . 3.660 3.100 2.268 3.556 . 0 0 "[ . 1 . 2 . 3 ]" 1
2294 1 14 LYS HB2 1 38 LEU QD 4.270 . 4.270 3.806 3.524 4.121 . 0 0 "[ . 1 . 2 . 3 ]" 1
2295 1 14 LYS HB2 2 17 LEU QD 4.410 . 4.410 2.523 1.821 2.975 . 0 0 "[ . 1 . 2 . 3 ]" 1
2296 1 14 LYS HB3 1 38 LEU QD 5.310 . 5.310 4.292 4.145 4.544 . 0 0 "[ . 1 . 2 . 3 ]" 1
2297 1 14 LYS HB3 2 17 LEU QD 4.220 . 4.220 3.764 2.929 4.244 0.024 31 0 "[ . 1 . 2 . 3 ]" 1
2298 1 14 LYS HG2 1 38 LEU QD 4.050 . 4.050 2.630 2.388 3.039 . 0 0 "[ . 1 . 2 . 3 ]" 1
2299 1 14 LYS HG3 1 17 LEU QD 4.750 . 4.750 3.828 3.451 4.078 . 0 0 "[ . 1 . 2 . 3 ]" 1
2300 1 14 LYS HG3 2 17 LEU QD 4.910 . 4.910 3.539 2.746 3.999 . 0 0 "[ . 1 . 2 . 3 ]" 1
2301 1 14 LYS HD2 1 39 ASP QB 5.010 . 5.010 3.318 2.799 3.708 . 0 0 "[ . 1 . 2 . 3 ]" 1
2302 1 14 LYS HE2 1 15 LYS QG 4.530 . 4.530 2.895 2.524 3.455 . 0 0 "[ . 1 . 2 . 3 ]" 1
2303 1 14 LYS HE2 2 17 LEU QD 5.440 . 5.440 4.857 3.943 5.436 . 0 0 "[ . 1 . 2 . 3 ]" 1
2304 1 14 LYS HE3 1 15 LYS QG 4.020 . 4.020 3.091 2.593 3.333 . 0 0 "[ . 1 . 2 . 3 ]" 1
2305 1 14 LYS HE3 1 38 LEU QD 4.850 . 4.850 4.080 3.777 4.527 . 0 0 "[ . 1 . 2 . 3 ]" 1
2306 1 15 LYS H 1 15 LYS QB 3.010 . 3.010 2.374 2.234 2.487 . 0 0 "[ . 1 . 2 . 3 ]" 1
2307 1 15 LYS H 1 15 LYS QG 3.260 . 3.260 2.354 2.152 2.680 . 0 0 "[ . 1 . 2 . 3 ]" 1
2308 1 15 LYS H 1 17 LEU QD 5.440 . 5.440 5.472 5.303 5.592 0.152 13 0 "[ . 1 . 2 . 3 ]" 1
2309 1 15 LYS H 1 38 LEU QD 5.440 . 5.440 5.127 4.875 5.473 0.033 2 0 "[ . 1 . 2 . 3 ]" 1
2310 1 15 LYS H 2 17 LEU QD 5.440 . 5.440 4.906 4.176 5.347 . 0 0 "[ . 1 . 2 . 3 ]" 1
2311 1 15 LYS HA 1 17 LEU QD 5.440 . 5.440 4.977 4.630 5.411 . 0 0 "[ . 1 . 2 . 3 ]" 1
2312 1 15 LYS QB 1 16 GLU H 3.330 . 3.330 2.685 2.469 2.820 . 0 0 "[ . 1 . 2 . 3 ]" 1
2313 1 15 LYS QB 1 18 ILE MD 4.270 . 4.270 3.643 3.470 3.802 . 0 0 "[ . 1 . 2 . 3 ]" 1
2314 1 15 LYS QE 1 15 LYS QG 3.170 . 3.170 2.413 2.101 2.804 . 0 0 "[ . 1 . 2 . 3 ]" 1
2315 1 15 LYS QG 1 16 GLU H 4.600 . 4.600 4.222 4.013 4.398 . 0 0 "[ . 1 . 2 . 3 ]" 1
2316 1 15 LYS QG 1 18 ILE MD 4.580 . 4.580 2.625 2.463 2.793 . 0 0 "[ . 1 . 2 . 3 ]" 1
2317 1 16 GLU H 1 16 GLU QG 3.400 . 3.400 2.413 2.217 2.600 . 0 0 "[ . 1 . 2 . 3 ]" 1
2318 1 16 GLU HB2 2 13 LYS QE 5.340 . 5.340 3.856 3.171 4.587 . 0 0 "[ . 1 . 2 . 3 ]" 1
2319 1 16 GLU HB3 2 13 LYS QD 4.400 . 4.400 2.371 2.020 2.644 . 0 0 "[ . 1 . 2 . 3 ]" 1
2320 1 16 GLU HB3 2 13 LYS QE 4.720 . 4.720 2.970 2.302 4.536 . 0 0 "[ . 1 . 2 . 3 ]" 1
2321 1 17 LEU H 1 17 LEU QD 3.780 . 3.780 3.621 3.524 3.745 . 0 0 "[ . 1 . 2 . 3 ]" 1
2322 1 17 LEU H 1 20 LEU QD 5.200 . 5.200 4.312 3.874 4.565 . 0 0 "[ . 1 . 2 . 3 ]" 1
2323 1 17 LEU HA 1 17 LEU QD 3.320 . 3.320 2.326 2.239 2.455 . 0 0 "[ . 1 . 2 . 3 ]" 1
2324 1 17 LEU HA 1 20 LEU QD 3.550 . 3.550 2.359 2.144 2.573 . 0 0 "[ . 1 . 2 . 3 ]" 1
2325 1 17 LEU HA 1 21 VAL QG 4.460 . 4.460 3.922 3.688 4.185 . 0 0 "[ . 1 . 2 . 3 ]" 1
2326 1 17 LEU HB2 1 21 VAL QG 5.340 . 5.340 4.669 4.411 4.923 . 0 0 "[ . 1 . 2 . 3 ]" 1
2327 1 17 LEU HB3 1 17 LEU QD 2.980 . 2.980 2.170 2.062 2.229 . 0 0 "[ . 1 . 2 . 3 ]" 1
2328 1 17 LEU HB3 1 20 LEU QD 5.230 . 5.230 4.798 4.536 5.035 . 0 0 "[ . 1 . 2 . 3 ]" 1
2329 1 17 LEU HB3 1 21 VAL QG 5.440 . 5.440 4.475 4.129 4.698 . 0 0 "[ . 1 . 2 . 3 ]" 1
2330 1 17 LEU HB3 1 38 LEU QD 4.630 . 4.630 3.682 3.289 3.966 . 0 0 "[ . 1 . 2 . 3 ]" 1
2331 1 17 LEU HG 1 20 LEU QD 5.440 . 5.440 4.878 4.338 5.340 . 0 0 "[ . 1 . 2 . 3 ]" 1
2332 1 17 LEU HG 1 21 VAL QG 4.070 . 4.070 3.457 2.030 4.185 0.115 26 0 "[ . 1 . 2 . 3 ]" 1
2333 1 17 LEU HG 1 38 LEU QD 4.040 . 4.040 3.800 3.404 4.067 0.027 27 0 "[ . 1 . 2 . 3 ]" 1
2334 1 17 LEU QD 1 18 ILE HG13 3.380 . 3.380 2.902 2.574 3.387 0.007 24 0 "[ . 1 . 2 . 3 ]" 1
2335 1 17 LEU QD 1 20 LEU H 4.590 . 4.590 3.877 3.565 4.425 . 0 0 "[ . 1 . 2 . 3 ]" 1
2336 1 17 LEU QD 1 20 LEU HB2 4.330 . 4.330 2.696 2.476 3.070 . 0 0 "[ . 1 . 2 . 3 ]" 1
2337 1 17 LEU QD 1 20 LEU QD 3.840 . 3.840 2.981 2.771 3.321 . 0 0 "[ . 1 . 2 . 3 ]" 1
2338 1 17 LEU QD 1 21 VAL HB 4.520 . 4.520 3.854 2.568 4.603 0.083 14 0 "[ . 1 . 2 . 3 ]" 1
2339 1 17 LEU QD 1 21 VAL QG 2.800 . 2.800 2.039 1.816 2.417 . 0 0 "[ . 1 . 2 . 3 ]" 1
2340 1 17 LEU QD 1 34 PHE QE 3.930 . 3.930 2.292 1.997 3.113 . 0 0 "[ . 1 . 2 . 3 ]" 1
2341 1 17 LEU QD 1 34 PHE HZ 3.700 . 3.700 2.090 1.879 2.439 . 0 0 "[ . 1 . 2 . 3 ]" 1
2342 1 17 LEU QD 1 38 LEU QD 3.180 . 3.180 2.158 2.021 2.400 . 0 0 "[ . 1 . 2 . 3 ]" 1
2343 1 17 LEU QD 2 10 ILE HA 3.780 . 3.780 2.565 2.388 2.884 . 0 0 "[ . 1 . 2 . 3 ]" 1
2344 1 17 LEU QD 2 10 ILE MG 3.050 . 3.050 1.956 1.847 2.162 . 0 0 "[ . 1 . 2 . 3 ]" 1
2345 1 17 LEU QD 2 13 LYS H 4.990 . 4.990 4.132 3.723 4.510 . 0 0 "[ . 1 . 2 . 3 ]" 1
2346 1 17 LEU QD 2 13 LYS QB 4.180 . 4.180 2.477 2.149 2.885 . 0 0 "[ . 1 . 2 . 3 ]" 1
2347 1 17 LEU QD 2 14 LYS H 3.960 . 3.960 2.794 2.137 3.236 . 0 0 "[ . 1 . 2 . 3 ]" 1
2348 1 17 LEU QD 2 14 LYS HA 3.660 . 3.660 3.104 2.173 3.660 0.000 4 0 "[ . 1 . 2 . 3 ]" 1
2349 1 17 LEU QD 2 14 LYS HB2 4.410 . 4.410 2.548 1.816 2.978 . 0 0 "[ . 1 . 2 . 3 ]" 1
2350 1 17 LEU QD 2 14 LYS HB3 4.220 . 4.220 3.776 2.938 4.251 0.031 7 0 "[ . 1 . 2 . 3 ]" 1
2351 1 17 LEU QD 2 14 LYS HG3 4.910 . 4.910 3.574 2.783 4.104 . 0 0 "[ . 1 . 2 . 3 ]" 1
2352 1 17 LEU QD 2 14 LYS HE2 5.440 . 5.440 4.889 4.130 5.435 . 0 0 "[ . 1 . 2 . 3 ]" 1
2353 1 17 LEU QD 2 15 LYS H 5.440 . 5.440 4.900 4.150 5.349 . 0 0 "[ . 1 . 2 . 3 ]" 1
2354 1 17 LEU QD 2 38 LEU QD 3.940 . 3.940 2.939 2.268 3.350 . 0 0 "[ . 1 . 2 . 3 ]" 1
2355 1 17 LEU QD 2 42 ILE MG 3.460 . 3.460 3.110 2.774 3.437 . 0 0 "[ . 1 . 2 . 3 ]" 1
2356 1 17 LEU QD 2 42 ILE HG12 4.370 . 4.370 2.934 2.703 3.239 . 0 0 "[ . 1 . 2 . 3 ]" 1
2357 1 17 LEU QD 2 42 ILE HG13 5.140 . 5.140 3.782 3.537 4.081 . 0 0 "[ . 1 . 2 . 3 ]" 1
2358 1 17 LEU QD 2 42 ILE MD 2.940 . 2.940 2.008 1.826 2.217 . 0 0 "[ . 1 . 2 . 3 ]" 1
2359 1 18 ILE H 1 38 LEU QD 4.530 . 4.530 4.016 3.804 4.552 0.022 2 0 "[ . 1 . 2 . 3 ]" 1
2360 1 18 ILE HA 1 21 VAL QG 3.090 . 3.090 2.521 2.018 2.990 . 0 0 "[ . 1 . 2 . 3 ]" 1
2361 1 18 ILE HB 1 35 SER QB 5.340 . 5.340 4.228 3.926 4.914 . 0 0 "[ . 1 . 2 . 3 ]" 1
2362 1 18 ILE HB 1 38 LEU QD 5.440 . 5.440 4.574 4.403 5.286 . 0 0 "[ . 1 . 2 . 3 ]" 1
2363 1 18 ILE MG 1 35 SER QB 3.630 . 3.630 2.237 1.923 3.311 . 0 0 "[ . 1 . 2 . 3 ]" 1
2364 1 18 ILE HG12 1 38 LEU QD 4.320 . 4.320 2.363 2.150 3.209 . 0 0 "[ . 1 . 2 . 3 ]" 1
2365 1 18 ILE HG13 1 38 LEU QD 3.900 . 3.900 2.666 2.406 3.468 . 0 0 "[ . 1 . 2 . 3 ]" 1
2366 1 18 ILE MD 1 35 SER QB 3.450 . 3.450 1.944 1.811 2.142 . 0 0 "[ . 1 . 2 . 3 ]" 1
2367 1 18 ILE MD 1 38 LEU QB 4.550 . 4.550 3.645 3.257 4.011 . 0 0 "[ . 1 . 2 . 3 ]" 1
2368 1 18 ILE MD 1 38 LEU QD 3.400 . 3.400 2.372 2.107 3.220 . 0 0 "[ . 1 . 2 . 3 ]" 1
2369 1 19 GLN H 1 21 VAL QG 4.790 . 4.790 4.581 4.203 4.844 0.054 29 0 "[ . 1 . 2 . 3 ]" 1
2370 1 19 GLN HA 1 31 VAL QG 4.580 . 4.580 4.051 3.817 4.468 . 0 0 "[ . 1 . 2 . 3 ]" 1
2371 1 19 GLN HB2 1 20 LEU QD 4.420 . 4.420 3.677 2.888 4.393 . 0 0 "[ . 1 . 2 . 3 ]" 1
2372 1 19 GLN HB3 1 20 LEU QD 4.770 . 4.770 4.075 3.559 4.614 . 0 0 "[ . 1 . 2 . 3 ]" 1
2373 1 19 GLN HG2 1 31 VAL QG 5.400 . 5.400 4.951 4.503 5.440 0.040 23 0 "[ . 1 . 2 . 3 ]" 1
2374 1 20 LEU H 1 21 VAL QG 4.320 . 4.320 3.843 3.674 3.978 . 0 0 "[ . 1 . 2 . 3 ]" 1
2375 1 20 LEU HA 1 20 LEU QD 2.960 . 2.960 2.046 2.011 2.125 . 0 0 "[ . 1 . 2 . 3 ]" 1
2376 1 20 LEU HA 1 21 VAL QG 5.350 . 5.350 4.667 4.517 4.875 . 0 0 "[ . 1 . 2 . 3 ]" 1
2377 1 20 LEU HA 1 23 ARG QD 3.860 . 3.860 2.517 1.991 3.062 . 0 0 "[ . 1 . 2 . 3 ]" 1
2378 1 20 LEU HB2 1 21 VAL QG 4.940 . 4.940 3.301 3.088 3.855 . 0 0 "[ . 1 . 2 . 3 ]" 1
2379 1 20 LEU HB3 1 20 LEU QD 3.100 . 3.100 2.174 2.092 2.527 . 0 0 "[ . 1 . 2 . 3 ]" 1
2380 1 20 LEU HB3 1 23 ARG QD 4.570 . 4.570 4.070 3.559 4.581 0.011 18 0 "[ . 1 . 2 . 3 ]" 1
2381 1 20 LEU HB3 2 6 LEU QD 3.530 . 3.530 2.967 2.571 3.276 . 0 0 "[ . 1 . 2 . 3 ]" 1
2382 1 20 LEU QD 1 21 VAL H 5.060 . 5.060 4.045 3.795 4.165 . 0 0 "[ . 1 . 2 . 3 ]" 1
2383 1 20 LEU QD 1 23 ARG HG3 5.440 . 5.440 3.952 3.690 4.407 . 0 0 "[ . 1 . 2 . 3 ]" 1
2384 1 20 LEU QD 1 23 ARG QD 3.450 . 3.450 2.255 1.929 2.715 . 0 0 "[ . 1 . 2 . 3 ]" 1
2385 1 20 LEU QD 2 9 LYS H 5.050 . 5.050 4.469 4.280 5.016 . 0 0 "[ . 1 . 2 . 3 ]" 1
2386 1 20 LEU QD 2 9 LYS HA 4.320 . 4.320 3.866 3.499 4.381 0.061 31 0 "[ . 1 . 2 . 3 ]" 1
2387 1 20 LEU QD 2 9 LYS HB2 3.750 . 3.750 2.715 2.389 3.233 . 0 0 "[ . 1 . 2 . 3 ]" 1
2388 1 20 LEU QD 2 9 LYS HB3 3.520 . 3.520 2.388 1.950 3.024 . 0 0 "[ . 1 . 2 . 3 ]" 1
2389 1 20 LEU QD 2 9 LYS QG 4.160 . 4.160 3.631 3.054 4.046 . 0 0 "[ . 1 . 2 . 3 ]" 1
2390 1 20 LEU QD 2 10 ILE H 4.160 . 4.160 3.352 2.697 4.107 . 0 0 "[ . 1 . 2 . 3 ]" 1
2391 1 20 LEU QD 2 10 ILE HA 3.700 . 3.700 2.522 2.164 3.273 . 0 0 "[ . 1 . 2 . 3 ]" 1
2392 1 20 LEU QD 2 10 ILE HG12 4.950 . 4.950 3.168 2.655 3.743 . 0 0 "[ . 1 . 2 . 3 ]" 1
2393 1 20 LEU QD 2 13 LYS H 3.800 . 3.800 3.650 3.434 3.898 0.098 10 0 "[ . 1 . 2 . 3 ]" 1
2394 1 20 LEU QD 2 13 LYS HA 4.590 . 4.590 4.325 4.155 4.507 . 0 0 "[ . 1 . 2 . 3 ]" 1
2395 1 20 LEU QD 2 13 LYS QB 3.480 . 3.480 2.128 1.982 2.356 . 0 0 "[ . 1 . 2 . 3 ]" 1
2396 1 20 LEU QD 2 13 LYS HG2 3.880 . 3.880 2.412 2.077 2.743 . 0 0 "[ . 1 . 2 . 3 ]" 1
2397 1 20 LEU QD 2 13 LYS QE 3.690 . 3.690 2.607 2.221 3.597 . 0 0 "[ . 1 . 2 . 3 ]" 1
2398 1 20 LEU QD 2 14 LYS H 5.040 . 5.040 4.429 4.222 4.696 . 0 0 "[ . 1 . 2 . 3 ]" 1
2399 1 21 VAL H 1 21 VAL QG 2.970 . 2.970 1.828 1.771 1.999 . 0 0 "[ . 1 . 2 . 3 ]" 1
2400 1 21 VAL HA 2 6 LEU QD 4.530 . 4.530 3.624 3.078 3.950 . 0 0 "[ . 1 . 2 . 3 ]" 1
2401 1 21 VAL HB 1 26 LEU QD 4.030 . 4.030 3.178 2.581 4.114 0.084 4 0 "[ . 1 . 2 . 3 ]" 1
2402 1 21 VAL QG 1 22 ALA H 3.400 . 3.400 2.813 2.258 3.308 . 0 0 "[ . 1 . 2 . 3 ]" 1
2403 1 21 VAL QG 1 22 ALA HA 4.200 . 4.200 3.398 3.013 3.772 . 0 0 "[ . 1 . 2 . 3 ]" 1
2404 1 21 VAL QG 1 24 HIS HB3 4.330 . 4.330 3.729 3.076 4.314 . 0 0 "[ . 1 . 2 . 3 ]" 1
2405 1 21 VAL QG 1 26 LEU H 4.970 . 4.970 4.745 4.263 5.063 0.093 22 0 "[ . 1 . 2 . 3 ]" 1
2406 1 21 VAL QG 1 26 LEU QD 3.050 . 3.050 1.950 1.761 2.174 . 0 0 "[ . 1 . 2 . 3 ]" 1
2407 1 21 VAL QG 1 31 VAL HA 5.440 . 5.440 4.380 3.567 5.108 . 0 0 "[ . 1 . 2 . 3 ]" 1
2408 1 21 VAL QG 1 31 VAL QG 5.380 . 5.380 3.759 3.150 4.415 . 0 0 "[ . 1 . 2 . 3 ]" 1
2409 1 21 VAL QG 1 34 PHE QE 3.460 . 3.460 2.523 2.264 2.700 . 0 0 "[ . 1 . 2 . 3 ]" 1
2410 1 21 VAL QG 1 34 PHE HZ 3.520 . 3.520 2.585 2.172 2.941 . 0 0 "[ . 1 . 2 . 3 ]" 1
2411 1 21 VAL QG 2 10 ILE HA 4.650 . 4.650 4.250 3.909 4.778 0.128 4 0 "[ . 1 . 2 . 3 ]" 1
2412 1 21 VAL QG 2 10 ILE MG 3.630 . 3.630 2.382 1.997 3.210 . 0 0 "[ . 1 . 2 . 3 ]" 1
2413 1 21 VAL QG 2 10 ILE MD 4.080 . 4.080 2.353 1.964 2.808 . 0 0 "[ . 1 . 2 . 3 ]" 1
2414 1 21 VAL QG 2 42 ILE HA 4.250 . 4.250 3.342 2.717 3.801 . 0 0 "[ . 1 . 2 . 3 ]" 1
2415 1 21 VAL QG 2 42 ILE MG 3.340 . 3.340 2.163 1.942 2.593 . 0 0 "[ . 1 . 2 . 3 ]" 1
2416 1 21 VAL QG 2 42 ILE HG12 4.370 . 4.370 2.854 2.402 3.422 . 0 0 "[ . 1 . 2 . 3 ]" 1
2417 1 21 VAL QG 2 42 ILE MD 4.980 . 4.980 2.945 2.611 3.428 . 0 0 "[ . 1 . 2 . 3 ]" 1
2418 1 21 VAL QG 2 45 PHE HB2 4.180 . 4.180 3.452 2.805 4.063 . 0 0 "[ . 1 . 2 . 3 ]" 1
2419 1 21 VAL QG 2 45 PHE HB3 4.320 . 4.320 3.477 2.804 4.011 . 0 0 "[ . 1 . 2 . 3 ]" 1
2420 1 21 VAL QG 2 46 MET HA 4.580 . 4.580 4.206 3.442 4.747 0.167 7 0 "[ . 1 . 2 . 3 ]" 1
2421 1 21 VAL QG 2 46 MET QG 3.770 . 3.770 2.870 2.042 3.650 . 0 0 "[ . 1 . 2 . 3 ]" 1
2422 1 21 VAL QG 2 46 MET ME 3.670 . 3.670 3.162 1.802 3.721 0.051 30 0 "[ . 1 . 2 . 3 ]" 1
2423 1 22 ALA H 1 26 LEU QD 4.850 . 4.850 3.715 3.434 3.996 . 0 0 "[ . 1 . 2 . 3 ]" 1
2424 1 22 ALA H 1 31 VAL QG 4.440 . 4.440 3.802 3.453 3.930 . 0 0 "[ . 1 . 2 . 3 ]" 1
2425 1 22 ALA HA 1 26 LEU QD 4.170 . 4.170 2.555 2.130 3.052 . 0 0 "[ . 1 . 2 . 3 ]" 1
2426 1 22 ALA HA 1 31 VAL QG 3.340 . 3.340 2.493 2.163 2.751 . 0 0 "[ . 1 . 2 . 3 ]" 1
2427 1 22 ALA MB 1 31 VAL QG 2.660 . 2.660 1.931 1.861 2.014 . 0 0 "[ . 1 . 2 . 3 ]" 1
2428 1 23 ARG H 1 23 ARG QD 4.740 . 4.740 3.954 3.426 4.304 . 0 0 "[ . 1 . 2 . 3 ]" 1
2429 1 23 ARG H 2 6 LEU QD 4.600 . 4.600 4.338 3.937 4.567 . 0 0 "[ . 1 . 2 . 3 ]" 1
2430 1 23 ARG HA 1 23 ARG QD 4.790 . 4.790 4.493 4.422 4.548 . 0 0 "[ . 1 . 2 . 3 ]" 1
2431 1 23 ARG HB2 1 23 ARG QD 3.360 . 3.360 2.693 2.357 3.119 . 0 0 "[ . 1 . 2 . 3 ]" 1
2432 1 23 ARG HB2 2 6 LEU QD 4.820 . 4.820 4.005 3.744 4.314 . 0 0 "[ . 1 . 2 . 3 ]" 1
2433 1 23 ARG HG2 2 6 LEU QD 4.530 . 4.530 2.970 2.469 3.297 . 0 0 "[ . 1 . 2 . 3 ]" 1
2434 1 23 ARG QD 2 6 LEU QD 3.380 . 3.380 2.393 2.059 2.867 . 0 0 "[ . 1 . 2 . 3 ]" 1
2435 1 24 HIS H 1 25 GLY QA 5.240 . 5.240 4.632 4.539 4.702 . 0 0 "[ . 1 . 2 . 3 ]" 1
2436 1 24 HIS H 2 6 LEU QD 3.970 . 3.970 3.246 2.991 3.507 . 0 0 "[ . 1 . 2 . 3 ]" 1
2437 1 24 HIS HA 2 6 LEU QD 3.410 . 3.410 2.633 2.053 3.062 . 0 0 "[ . 1 . 2 . 3 ]" 1
2438 1 24 HIS HB2 2 6 LEU QD 3.730 . 3.730 2.115 1.859 2.384 . 0 0 "[ . 1 . 2 . 3 ]" 1
2439 1 24 HIS HB3 1 26 LEU QD 3.950 . 3.950 3.057 2.520 4.006 0.056 2 0 "[ . 1 . 2 . 3 ]" 1
2440 1 24 HIS HB3 2 6 LEU QD 4.370 . 4.370 3.540 3.260 3.790 . 0 0 "[ . 1 . 2 . 3 ]" 1
2441 1 24 HIS HD2 2 6 LEU QD 4.430 . 4.430 2.745 1.846 4.552 0.122 23 0 "[ . 1 . 2 . 3 ]" 1
2442 1 25 GLY H 1 26 LEU QD 4.990 . 4.990 3.383 2.684 4.170 . 0 0 "[ . 1 . 2 . 3 ]" 1
2443 1 25 GLY H 2 6 LEU QD 5.440 . 5.440 4.924 4.632 5.176 . 0 0 "[ . 1 . 2 . 3 ]" 1
2444 1 25 GLY QA 1 26 LEU H 2.910 . 2.910 2.881 2.694 2.961 0.051 31 0 "[ . 1 . 2 . 3 ]" 1
2445 1 25 GLY QA 1 26 LEU HA 4.500 . 4.500 4.075 3.974 4.173 . 0 0 "[ . 1 . 2 . 3 ]" 1
2446 1 25 GLY QA 1 26 LEU QD 4.690 . 4.690 3.790 3.480 4.305 . 0 0 "[ . 1 . 2 . 3 ]" 1
2447 1 26 LEU H 1 26 LEU QD 3.710 . 3.710 2.496 1.985 3.390 . 0 0 "[ . 1 . 2 . 3 ]" 1
2448 1 26 LEU H 1 31 VAL QG 4.800 . 4.800 4.358 3.888 4.756 . 0 0 "[ . 1 . 2 . 3 ]" 1
2449 1 26 LEU HA 1 26 LEU QD 3.330 . 3.330 2.369 1.920 2.652 . 0 0 "[ . 1 . 2 . 3 ]" 1
2450 1 26 LEU HA 1 27 ASP QB 4.590 . 4.590 4.397 3.956 4.598 0.008 30 0 "[ . 1 . 2 . 3 ]" 1
2451 1 26 LEU HB2 1 26 LEU QD 3.080 . 3.080 2.204 2.102 2.410 . 0 0 "[ . 1 . 2 . 3 ]" 1
2452 1 26 LEU HB2 1 31 VAL QG 3.540 . 3.540 2.737 2.265 3.178 . 0 0 "[ . 1 . 2 . 3 ]" 1
2453 1 26 LEU HB3 1 31 VAL QG 3.650 . 3.650 2.513 2.243 2.712 . 0 0 "[ . 1 . 2 . 3 ]" 1
2454 1 26 LEU QD 1 27 ASP H 3.730 . 3.730 3.568 2.855 3.874 0.144 3 0 "[ . 1 . 2 . 3 ]" 1
2455 1 26 LEU QD 1 27 ASP HA 5.440 . 5.440 5.306 4.960 5.468 0.028 5 0 "[ . 1 . 2 . 3 ]" 1
2456 1 26 LEU QD 1 30 LYS HB2 3.970 . 3.970 2.753 2.424 3.052 . 0 0 "[ . 1 . 2 . 3 ]" 1
2457 1 26 LEU QD 1 30 LYS HB3 3.650 . 3.650 2.027 1.758 2.350 . 0 0 "[ . 1 . 2 . 3 ]" 1
2458 1 26 LEU QD 1 30 LYS HG2 4.950 . 4.950 4.196 3.523 4.639 . 0 0 "[ . 1 . 2 . 3 ]" 1
2459 1 26 LEU QD 1 30 LYS HG3 4.650 . 4.650 3.249 2.193 3.861 . 0 0 "[ . 1 . 2 . 3 ]" 1
2460 1 26 LEU QD 1 30 LYS QD 3.740 . 3.740 3.443 2.576 3.809 0.069 20 0 "[ . 1 . 2 . 3 ]" 1
2461 1 26 LEU QD 1 30 LYS QE 4.850 . 4.850 4.449 3.362 4.941 0.091 25 0 "[ . 1 . 2 . 3 ]" 1
2462 1 26 LEU QD 1 31 VAL HA 4.750 . 4.750 2.796 2.601 3.018 . 0 0 "[ . 1 . 2 . 3 ]" 1
2463 1 26 LEU QD 1 34 PHE HB2 4.390 . 4.390 2.962 2.630 3.289 . 0 0 "[ . 1 . 2 . 3 ]" 1
2464 1 26 LEU QD 1 34 PHE HB3 4.360 . 4.360 3.266 3.005 3.534 . 0 0 "[ . 1 . 2 . 3 ]" 1
2465 1 26 LEU QD 2 45 PHE HA 3.810 . 3.810 3.573 3.212 3.765 . 0 0 "[ . 1 . 2 . 3 ]" 1
2466 1 26 LEU QD 2 45 PHE HB2 3.790 . 3.790 3.015 2.721 3.319 . 0 0 "[ . 1 . 2 . 3 ]" 1
2467 1 26 LEU QD 2 45 PHE HB3 3.830 . 3.830 1.911 1.824 2.176 . 0 0 "[ . 1 . 2 . 3 ]" 1
2468 1 26 LEU QD 2 45 PHE QD 3.340 . 3.340 2.496 2.185 2.738 . 0 0 "[ . 1 . 2 . 3 ]" 1
2469 1 26 LEU QD 2 46 MET H 4.520 . 4.520 3.897 3.308 4.283 . 0 0 "[ . 1 . 2 . 3 ]" 1
2470 1 26 LEU QD 2 46 MET HA 4.280 . 4.280 2.876 2.068 3.637 . 0 0 "[ . 1 . 2 . 3 ]" 1
2471 1 26 LEU QD 2 46 MET QG 4.470 . 4.470 3.657 2.854 4.477 0.007 28 0 "[ . 1 . 2 . 3 ]" 1
2472 1 26 LEU QD 2 47 ASN H 5.440 . 5.440 4.673 4.135 5.283 . 0 0 "[ . 1 . 2 . 3 ]" 1
2473 1 27 ASP H 1 27 ASP QB 2.900 . 2.900 2.519 2.258 2.655 . 0 0 "[ . 1 . 2 . 3 ]" 1
2474 1 27 ASP QB 1 29 ASP H 3.460 . 3.460 2.750 2.442 3.276 . 0 0 "[ . 1 . 2 . 3 ]" 1
2475 1 27 ASP QB 1 30 LYS H 3.790 . 3.790 2.452 1.984 3.909 0.119 2 0 "[ . 1 . 2 . 3 ]" 1
2476 1 27 ASP QB 1 30 LYS HG2 4.510 . 4.510 2.281 1.902 3.757 . 0 0 "[ . 1 . 2 . 3 ]" 1
2477 1 27 ASP QB 1 30 LYS HG3 4.490 . 4.490 3.307 2.617 4.492 0.002 2 0 "[ . 1 . 2 . 3 ]" 1
2478 1 28 HIS HA 1 31 VAL QG 3.470 . 3.470 2.688 2.207 3.011 . 0 0 "[ . 1 . 2 . 3 ]" 1
2479 1 28 HIS HA 1 32 LEU QD 5.390 . 5.390 4.323 3.969 4.746 . 0 0 "[ . 1 . 2 . 3 ]" 1
2480 1 28 HIS QB 1 29 ASP H 3.160 . 3.160 2.689 2.370 3.288 0.128 20 0 "[ . 1 . 2 . 3 ]" 1
2481 1 28 HIS QB 1 31 VAL QG 4.820 . 4.820 4.168 3.728 4.437 . 0 0 "[ . 1 . 2 . 3 ]" 1
2482 1 29 ASP H 1 29 ASP QB 2.870 . 2.870 2.364 2.073 2.626 . 0 0 "[ . 1 . 2 . 3 ]" 1
2483 1 29 ASP H 1 31 VAL QG 5.440 . 5.440 4.664 4.344 4.895 . 0 0 "[ . 1 . 2 . 3 ]" 1
2484 1 29 ASP H 1 32 LEU QD 5.440 . 5.440 4.260 3.681 4.526 . 0 0 "[ . 1 . 2 . 3 ]" 1
2485 1 29 ASP H 1 33 LEU QD 5.440 . 5.440 5.470 5.375 5.518 0.078 23 0 "[ . 1 . 2 . 3 ]" 1
2486 1 29 ASP HA 1 31 VAL QG 5.250 . 5.250 5.161 4.950 5.270 0.020 22 0 "[ . 1 . 2 . 3 ]" 1
2487 1 29 ASP HA 1 32 LEU QB 3.670 . 3.670 2.790 2.530 3.706 0.036 28 0 "[ . 1 . 2 . 3 ]" 1
2488 1 29 ASP HA 1 32 LEU QD 3.970 . 3.970 2.366 1.893 2.767 . 0 0 "[ . 1 . 2 . 3 ]" 1
2489 1 29 ASP QB 1 30 LYS H 3.370 . 3.370 2.885 2.398 3.438 0.068 20 0 "[ . 1 . 2 . 3 ]" 1
2490 1 29 ASP QB 1 30 LYS HG2 5.340 . 5.340 3.822 3.160 4.594 . 0 0 "[ . 1 . 2 . 3 ]" 1
2491 1 29 ASP QB 1 32 LEU QD 4.510 . 4.510 3.779 3.133 4.281 . 0 0 "[ . 1 . 2 . 3 ]" 1
2492 1 29 ASP QB 1 33 LEU HG 5.340 . 5.340 3.827 3.181 4.700 . 0 0 "[ . 1 . 2 . 3 ]" 1
2493 1 29 ASP QB 1 33 LEU QD 4.390 . 4.390 3.348 2.870 3.986 . 0 0 "[ . 1 . 2 . 3 ]" 1
2494 1 30 LYS H 1 30 LYS QD 4.320 . 4.320 3.588 3.256 4.190 . 0 0 "[ . 1 . 2 . 3 ]" 1
2495 1 30 LYS H 1 31 VAL QG 4.100 . 4.100 3.852 3.559 4.043 . 0 0 "[ . 1 . 2 . 3 ]" 1
2496 1 30 LYS H 1 32 LEU QB 5.340 . 5.340 4.993 4.872 5.445 0.105 28 0 "[ . 1 . 2 . 3 ]" 1
2497 1 30 LYS H 1 33 LEU QD 4.640 . 4.640 4.294 4.135 4.592 . 0 0 "[ . 1 . 2 . 3 ]" 1
2498 1 30 LYS HA 1 30 LYS QD 3.230 . 3.230 2.080 1.860 2.858 . 0 0 "[ . 1 . 2 . 3 ]" 1
2499 1 30 LYS HA 1 30 LYS QE 4.730 . 4.730 3.973 1.804 4.208 . 0 0 "[ . 1 . 2 . 3 ]" 1
2500 1 30 LYS HA 1 31 VAL QG 4.860 . 4.860 4.721 4.647 4.769 . 0 0 "[ . 1 . 2 . 3 ]" 1
2501 1 30 LYS HA 1 33 LEU QD 3.520 . 3.520 2.624 2.157 3.124 . 0 0 "[ . 1 . 2 . 3 ]" 1
2502 1 30 LYS HB2 1 30 LYS QD 3.580 . 3.580 3.306 3.281 3.399 . 0 0 "[ . 1 . 2 . 3 ]" 1
2503 1 30 LYS HB3 1 30 LYS QD 3.440 . 3.440 2.441 2.292 2.710 . 0 0 "[ . 1 . 2 . 3 ]" 1
2504 1 30 LYS HB3 1 30 LYS QE 4.810 . 4.810 4.036 3.381 4.268 . 0 0 "[ . 1 . 2 . 3 ]" 1
2505 1 30 LYS HB3 1 31 VAL QG 4.000 . 4.000 4.017 3.910 4.076 0.076 14 0 "[ . 1 . 2 . 3 ]" 1
2506 1 30 LYS QE 1 30 LYS HG2 3.250 . 3.250 2.759 2.410 3.077 . 0 0 "[ . 1 . 2 . 3 ]" 1
2507 1 30 LYS HG2 1 33 LEU QD 4.460 . 4.460 4.305 3.934 4.507 0.047 4 0 "[ . 1 . 2 . 3 ]" 1
2508 1 30 LYS QE 1 30 LYS HG3 3.600 . 3.600 2.610 2.322 3.575 . 0 0 "[ . 1 . 2 . 3 ]" 1
2509 1 30 LYS QD 1 31 VAL H 5.340 . 5.340 4.832 4.688 5.289 . 0 0 "[ . 1 . 2 . 3 ]" 1
2510 1 30 LYS QD 1 33 LEU QD 5.280 . 5.280 2.655 2.023 3.848 . 0 0 "[ . 1 . 2 . 3 ]" 1
2511 1 30 LYS QD 2 45 PHE HA 5.140 . 5.140 3.994 3.085 4.732 . 0 0 "[ . 1 . 2 . 3 ]" 1
2512 1 30 LYS QD 2 45 PHE QD 4.250 . 4.250 2.456 2.006 2.932 . 0 0 "[ . 1 . 2 . 3 ]" 1
2513 1 30 LYS QD 2 45 PHE QE 4.560 . 4.560 2.574 2.274 3.044 . 0 0 "[ . 1 . 2 . 3 ]" 1
2514 1 30 LYS QE 1 33 LEU QD 4.700 . 4.700 3.733 1.995 4.367 . 0 0 "[ . 1 . 2 . 3 ]" 1
2515 1 30 LYS QE 2 45 PHE QD 4.610 . 4.610 4.275 3.736 4.654 0.044 21 0 "[ . 1 . 2 . 3 ]" 1
2516 1 31 VAL H 1 31 VAL QG 2.880 . 2.880 1.966 1.861 2.115 . 0 0 "[ . 1 . 2 . 3 ]" 1
2517 1 31 VAL H 1 32 LEU QB 4.960 . 4.960 4.677 4.528 4.870 . 0 0 "[ . 1 . 2 . 3 ]" 1
2518 1 31 VAL H 1 32 LEU QD 4.550 . 4.550 4.597 4.513 4.652 0.102 1 0 "[ . 1 . 2 . 3 ]" 1
2519 1 31 VAL HB 1 32 LEU QD 4.110 . 4.110 3.517 3.201 4.179 0.069 28 0 "[ . 1 . 2 . 3 ]" 1
2520 1 31 VAL QG 1 32 LEU HA 5.440 . 5.440 3.593 3.421 3.708 . 0 0 "[ . 1 . 2 . 3 ]" 1
2521 1 31 VAL QG 1 32 LEU HG 5.220 . 5.220 4.041 3.803 4.820 . 0 0 "[ . 1 . 2 . 3 ]" 1
2522 1 31 VAL QG 1 34 PHE HB3 4.910 . 4.910 3.755 3.543 3.943 . 0 0 "[ . 1 . 2 . 3 ]" 1
2523 1 31 VAL QG 1 35 SER H 5.340 . 5.340 3.887 3.725 4.110 . 0 0 "[ . 1 . 2 . 3 ]" 1
2524 1 32 LEU H 1 32 LEU QB 2.960 . 2.960 2.486 2.391 2.533 . 0 0 "[ . 1 . 2 . 3 ]" 1
2525 1 32 LEU H 1 32 LEU QD 3.440 . 3.440 2.924 2.837 3.066 . 0 0 "[ . 1 . 2 . 3 ]" 1
2526 1 32 LEU HA 1 36 ARG QB 5.270 . 5.270 4.895 4.457 5.315 0.045 17 0 "[ . 1 . 2 . 3 ]" 1
2527 1 32 LEU HA 1 36 ARG QG 5.250 . 5.250 4.242 3.502 4.987 . 0 0 "[ . 1 . 2 . 3 ]" 1
2528 1 32 LEU QB 1 32 LEU QD 2.820 . 2.820 1.943 1.804 1.980 . 0 0 "[ . 1 . 2 . 3 ]" 1
2529 1 32 LEU QB 1 33 LEU H 3.560 . 3.560 2.367 2.199 3.529 . 0 0 "[ . 1 . 2 . 3 ]" 1
2530 1 32 LEU QB 1 33 LEU QD 4.190 . 4.190 3.471 3.154 4.246 0.056 28 0 "[ . 1 . 2 . 3 ]" 1
2531 1 32 LEU QB 1 36 ARG H 5.340 . 5.340 4.881 4.697 5.102 . 0 0 "[ . 1 . 2 . 3 ]" 1
2532 1 32 LEU QB 1 36 ARG HD2 4.060 . 4.060 3.488 2.757 3.827 . 0 0 "[ . 1 . 2 . 3 ]" 1
2533 1 32 LEU QD 1 33 LEU H 4.600 . 4.600 3.899 2.617 4.015 . 0 0 "[ . 1 . 2 . 3 ]" 1
2534 1 33 LEU H 1 33 LEU QD 3.480 . 3.480 3.043 2.879 3.145 . 0 0 "[ . 1 . 2 . 3 ]" 1
2535 1 33 LEU HA 1 33 LEU QD 2.990 . 2.990 2.090 2.037 2.169 . 0 0 "[ . 1 . 2 . 3 ]" 1
2536 1 33 LEU HA 1 36 ARG QG 3.470 . 3.470 2.673 2.056 3.517 0.047 8 0 "[ . 1 . 2 . 3 ]" 1
2537 1 33 LEU HB2 1 33 LEU QD 3.040 . 3.040 2.247 2.189 2.282 . 0 0 "[ . 1 . 2 . 3 ]" 1
2538 1 33 LEU HB3 1 33 LEU QD 2.920 . 2.920 2.113 2.080 2.141 . 0 0 "[ . 1 . 2 . 3 ]" 1
2539 1 33 LEU HB3 1 37 ASP QB 5.340 . 5.340 4.303 3.909 4.607 . 0 0 "[ . 1 . 2 . 3 ]" 1
2540 1 33 LEU QD 1 34 PHE H 4.330 . 4.330 4.003 3.865 4.107 . 0 0 "[ . 1 . 2 . 3 ]" 1
2541 1 33 LEU QD 1 36 ARG HD2 5.440 . 5.440 3.617 2.168 4.006 . 0 0 "[ . 1 . 2 . 3 ]" 1
2542 1 33 LEU QD 1 36 ARG HD3 4.190 . 4.190 2.650 2.145 3.000 . 0 0 "[ . 1 . 2 . 3 ]" 1
2543 1 33 LEU QD 2 45 PHE QE 4.100 . 4.100 2.761 2.367 3.208 . 0 0 "[ . 1 . 2 . 3 ]" 1
2544 1 33 LEU QD 2 45 PHE HZ 4.860 . 4.860 3.247 2.977 3.625 . 0 0 "[ . 1 . 2 . 3 ]" 1
2545 1 34 PHE HA 1 37 ASP QB 3.760 . 3.760 3.072 2.828 3.335 . 0 0 "[ . 1 . 2 . 3 ]" 1
2546 1 34 PHE HA 2 41 LEU QD 3.800 . 3.800 2.987 2.457 3.357 . 0 0 "[ . 1 . 2 . 3 ]" 1
2547 1 34 PHE HB2 1 37 ASP QB 5.340 . 5.340 5.206 4.904 5.384 0.044 2 0 "[ . 1 . 2 . 3 ]" 1
2548 1 34 PHE HB3 2 41 LEU QD 5.440 . 5.440 4.923 4.395 5.272 . 0 0 "[ . 1 . 2 . 3 ]" 1
2549 1 34 PHE QD 1 38 LEU QD 4.600 . 4.600 3.402 3.275 3.633 . 0 0 "[ . 1 . 2 . 3 ]" 1
2550 1 34 PHE QD 2 41 LEU QD 3.550 . 3.550 2.645 1.773 3.080 . 0 0 "[ . 1 . 2 . 3 ]" 1
2551 1 34 PHE QE 1 38 LEU QD 3.790 . 3.790 2.435 2.301 2.694 . 0 0 "[ . 1 . 2 . 3 ]" 1
2552 1 34 PHE QE 2 38 LEU QD 4.740 . 4.740 3.755 3.337 4.145 . 0 0 "[ . 1 . 2 . 3 ]" 1
2553 1 34 PHE QE 2 41 LEU QD 3.550 . 3.550 2.823 1.872 3.340 . 0 0 "[ . 1 . 2 . 3 ]" 1
2554 1 34 PHE HZ 1 38 LEU QD 3.770 . 3.770 2.616 2.012 2.963 . 0 0 "[ . 1 . 2 . 3 ]" 1
2555 1 34 PHE HZ 2 38 LEU QD 4.470 . 4.470 3.465 3.248 3.981 . 0 0 "[ . 1 . 2 . 3 ]" 1
2556 1 34 PHE HZ 2 41 LEU QD 4.560 . 4.560 4.020 3.415 4.591 0.031 2 0 "[ . 1 . 2 . 3 ]" 1
2557 1 35 SER H 1 35 SER QB 3.140 . 3.140 2.585 2.508 2.648 . 0 0 "[ . 1 . 2 . 3 ]" 1
2558 1 35 SER H 1 36 ARG QB 5.340 . 5.340 4.916 4.527 5.114 . 0 0 "[ . 1 . 2 . 3 ]" 1
2559 1 35 SER H 1 36 ARG QG 5.030 . 5.030 4.171 3.921 4.398 . 0 0 "[ . 1 . 2 . 3 ]" 1
2560 1 35 SER HA 1 38 LEU QB 4.020 . 4.020 2.430 2.016 2.861 . 0 0 "[ . 1 . 2 . 3 ]" 1
2561 1 35 SER HA 1 38 LEU QD 4.170 . 4.170 2.826 2.315 3.496 . 0 0 "[ . 1 . 2 . 3 ]" 1
2562 1 35 SER HA 2 41 LEU QD 5.440 . 5.440 4.914 4.340 5.321 . 0 0 "[ . 1 . 2 . 3 ]" 1
2563 1 35 SER QB 1 36 ARG H 3.920 . 3.920 3.425 2.831 3.519 . 0 0 "[ . 1 . 2 . 3 ]" 1
2564 1 35 SER QB 1 36 ARG QG 5.180 . 5.180 4.713 3.287 5.218 0.038 22 0 "[ . 1 . 2 . 3 ]" 1
2565 1 36 ARG H 1 36 ARG QB 2.950 . 2.950 2.544 2.356 2.665 . 0 0 "[ . 1 . 2 . 3 ]" 1
2566 1 36 ARG H 1 36 ARG QG 3.380 . 3.380 2.125 1.913 2.387 . 0 0 "[ . 1 . 2 . 3 ]" 1
2567 1 36 ARG H 1 37 ASP QB 4.840 . 4.840 4.396 4.251 4.555 . 0 0 "[ . 1 . 2 . 3 ]" 1
2568 1 36 ARG H 1 38 LEU QB 5.340 . 5.340 4.550 4.365 4.964 . 0 0 "[ . 1 . 2 . 3 ]" 1
2569 1 36 ARG HA 1 36 ARG QG 3.700 . 3.700 3.040 2.385 3.379 . 0 0 "[ . 1 . 2 . 3 ]" 1
2570 1 36 ARG QB 1 36 ARG HD2 3.380 . 3.380 2.644 2.253 3.314 . 0 0 "[ . 1 . 2 . 3 ]" 1
2571 1 36 ARG QB 1 36 ARG HD3 3.450 . 3.450 2.957 2.290 3.293 . 0 0 "[ . 1 . 2 . 3 ]" 1
2572 1 36 ARG QB 1 37 ASP H 3.700 . 3.700 3.151 2.242 3.608 . 0 0 "[ . 1 . 2 . 3 ]" 1
2573 1 36 ARG QB 1 37 ASP QB 4.760 . 4.760 4.346 3.320 4.815 0.055 25 0 "[ . 1 . 2 . 3 ]" 1
2574 1 36 ARG QB 1 39 ASP QB 4.760 . 4.760 4.135 3.697 4.698 . 0 0 "[ . 1 . 2 . 3 ]" 1
2575 1 36 ARG QG 1 37 ASP H 4.740 . 4.740 2.912 2.240 4.034 . 0 0 "[ . 1 . 2 . 3 ]" 1
2576 1 36 ARG QG 1 37 ASP QB 5.180 . 5.180 3.909 3.036 5.288 0.108 23 0 "[ . 1 . 2 . 3 ]" 1
2577 1 37 ASP H 1 37 ASP QB 3.030 . 3.030 2.238 2.128 2.344 . 0 0 "[ . 1 . 2 . 3 ]" 1
2578 1 37 ASP H 2 41 LEU QD 4.350 . 4.350 4.014 3.691 4.225 . 0 0 "[ . 1 . 2 . 3 ]" 1
2579 1 37 ASP HA 1 40 LYS QB 3.380 . 3.380 2.836 2.131 3.535 0.155 10 0 "[ . 1 . 2 . 3 ]" 1
2580 1 37 ASP HA 1 40 LYS QG 4.270 . 4.270 3.458 1.923 4.301 0.031 5 0 "[ . 1 . 2 . 3 ]" 1
2581 1 37 ASP HA 1 40 LYS QD 4.180 . 4.180 2.961 1.844 4.088 . 0 0 "[ . 1 . 2 . 3 ]" 1
2582 1 37 ASP HA 2 41 LEU QD 4.550 . 4.550 4.096 3.846 4.253 . 0 0 "[ . 1 . 2 . 3 ]" 1
2583 1 37 ASP QB 1 38 LEU H 3.560 . 3.560 2.497 2.320 2.782 . 0 0 "[ . 1 . 2 . 3 ]" 1
2584 1 37 ASP QB 2 41 LEU HG 5.340 . 5.340 4.065 3.299 4.412 . 0 0 "[ . 1 . 2 . 3 ]" 1
2585 1 37 ASP QB 2 41 LEU QD 2.860 . 2.860 2.203 1.983 2.362 . 0 0 "[ . 1 . 2 . 3 ]" 1
2586 1 38 LEU H 1 38 LEU QB 3.060 . 3.060 2.147 2.058 2.255 . 0 0 "[ . 1 . 2 . 3 ]" 1
2587 1 38 LEU H 2 41 LEU QD 3.580 . 3.580 2.749 2.408 3.079 . 0 0 "[ . 1 . 2 . 3 ]" 1
2588 1 38 LEU HA 1 38 LEU QD 3.040 . 3.040 2.329 2.159 3.069 0.029 2 0 "[ . 1 . 2 . 3 ]" 1
2589 1 38 LEU HA 2 41 LEU QD 3.160 . 3.160 2.299 1.884 3.073 . 0 0 "[ . 1 . 2 . 3 ]" 1
2590 1 38 LEU QB 1 39 ASP H 3.540 . 3.540 2.515 2.376 2.813 . 0 0 "[ . 1 . 2 . 3 ]" 1
2591 1 38 LEU QB 2 41 LEU QD 3.870 . 3.870 2.359 2.028 2.633 . 0 0 "[ . 1 . 2 . 3 ]" 1
2592 1 38 LEU HG 1 41 LEU QD 5.310 . 5.310 5.045 3.319 5.343 0.033 10 0 "[ . 1 . 2 . 3 ]" 1
2593 1 38 LEU HG 2 41 LEU QD 5.440 . 5.440 4.366 2.801 4.981 . 0 0 "[ . 1 . 2 . 3 ]" 1
2594 1 38 LEU QD 1 39 ASP H 4.150 . 4.150 3.695 3.322 3.854 . 0 0 "[ . 1 . 2 . 3 ]" 1
2595 1 38 LEU QD 1 41 LEU H 4.710 . 4.710 4.381 4.157 4.647 . 0 0 "[ . 1 . 2 . 3 ]" 1
2596 1 38 LEU QD 1 41 LEU HB2 5.350 . 5.350 4.330 3.793 5.025 . 0 0 "[ . 1 . 2 . 3 ]" 1
2597 1 38 LEU QD 1 41 LEU HB3 3.900 . 3.900 3.088 2.620 3.834 . 0 0 "[ . 1 . 2 . 3 ]" 1
2598 1 38 LEU QD 1 41 LEU HG 5.440 . 5.440 4.330 3.721 5.295 . 0 0 "[ . 1 . 2 . 3 ]" 1
2599 1 38 LEU QD 1 42 ILE H 4.130 . 4.130 3.736 3.370 4.035 . 0 0 "[ . 1 . 2 . 3 ]" 1
2600 1 38 LEU QD 1 42 ILE HA 5.240 . 5.240 4.748 4.529 4.948 . 0 0 "[ . 1 . 2 . 3 ]" 1
2601 1 38 LEU QD 1 42 ILE HG12 3.700 . 3.700 3.330 3.140 3.546 . 0 0 "[ . 1 . 2 . 3 ]" 1
2602 1 38 LEU QD 1 42 ILE HG13 3.640 . 3.640 2.440 2.226 2.660 . 0 0 "[ . 1 . 2 . 3 ]" 1
2603 1 38 LEU QD 1 42 ILE MD 3.050 . 3.050 2.218 1.964 2.496 . 0 0 "[ . 1 . 2 . 3 ]" 1
2604 1 38 LEU QD 2 17 LEU QD 3.940 . 3.940 2.949 2.261 3.310 . 0 0 "[ . 1 . 2 . 3 ]" 1
2605 1 38 LEU QD 2 34 PHE QE 4.740 . 4.740 3.748 3.416 4.180 . 0 0 "[ . 1 . 2 . 3 ]" 1
2606 1 38 LEU QD 2 34 PHE HZ 4.470 . 4.470 3.451 3.125 3.964 . 0 0 "[ . 1 . 2 . 3 ]" 1
2607 1 38 LEU QD 2 41 LEU HB2 5.440 . 5.440 4.990 4.172 5.436 . 0 0 "[ . 1 . 2 . 3 ]" 1
2608 1 39 ASP H 1 39 ASP QB 2.710 . 2.710 2.239 2.165 2.281 . 0 0 "[ . 1 . 2 . 3 ]" 1
2609 1 39 ASP H 1 40 LYS QB 4.830 . 4.830 4.572 3.887 4.833 0.003 17 0 "[ . 1 . 2 . 3 ]" 1
2610 1 39 ASP QB 1 40 LYS H 3.080 . 3.080 2.473 2.156 2.778 . 0 0 "[ . 1 . 2 . 3 ]" 1
2611 1 39 ASP QB 1 40 LYS QB 4.500 . 4.500 4.158 3.501 4.504 0.004 20 0 "[ . 1 . 2 . 3 ]" 1
2612 1 39 ASP QB 1 43 ASN QD 4.140 . 4.140 3.783 3.502 4.192 0.052 12 0 "[ . 1 . 2 . 3 ]" 1
2613 1 40 LYS H 1 40 LYS QB 2.910 . 2.910 2.319 1.870 2.471 . 0 0 "[ . 1 . 2 . 3 ]" 1
2614 1 40 LYS H 1 40 LYS QG 3.510 . 3.510 2.647 2.239 3.706 0.196 31 0 "[ . 1 . 2 . 3 ]" 1
2615 1 40 LYS H 1 40 LYS QD 4.760 . 4.760 3.805 2.124 4.412 . 0 0 "[ . 1 . 2 . 3 ]" 1
2616 1 40 LYS H 2 41 LEU QD 5.440 . 5.440 5.226 4.783 5.485 0.045 24 0 "[ . 1 . 2 . 3 ]" 1
2617 1 40 LYS HA 1 40 LYS QD 4.880 . 4.880 3.987 2.415 4.317 . 0 0 "[ . 1 . 2 . 3 ]" 1
2618 1 40 LYS HA 1 43 ASN QD 3.970 . 3.970 2.799 2.134 3.956 . 0 0 "[ . 1 . 2 . 3 ]" 1
2619 1 40 LYS QB 1 41 LEU H 3.460 . 3.460 2.779 2.373 3.497 0.037 10 0 "[ . 1 . 2 . 3 ]" 1
2620 1 40 LYS QB 1 41 LEU HB2 5.190 . 5.190 4.429 3.875 5.235 0.045 10 0 "[ . 1 . 2 . 3 ]" 1
2621 1 40 LYS QG 1 41 LEU H 5.190 . 5.190 3.766 2.280 4.701 . 0 0 "[ . 1 . 2 . 3 ]" 1
2622 1 41 LEU H 1 41 LEU QD 3.900 . 3.900 3.743 3.667 3.796 . 0 0 "[ . 1 . 2 . 3 ]" 1
2623 1 41 LEU H 2 41 LEU QD 4.920 . 4.920 4.321 3.665 4.940 0.020 24 0 "[ . 1 . 2 . 3 ]" 1
2624 1 41 LEU HA 1 41 LEU QD 2.980 . 2.980 2.237 2.102 2.946 . 0 0 "[ . 1 . 2 . 3 ]" 1
2625 1 41 LEU HA 1 44 LYS QD 4.240 . 4.240 3.454 2.960 3.738 . 0 0 "[ . 1 . 2 . 3 ]" 1
2626 1 41 LEU HA 1 44 LYS QE 4.230 . 4.230 2.449 1.904 3.160 . 0 0 "[ . 1 . 2 . 3 ]" 1
2627 1 41 LEU HB2 2 38 LEU QD 5.440 . 5.440 5.067 4.271 5.454 0.014 25 0 "[ . 1 . 2 . 3 ]" 1
2628 1 41 LEU HG 2 37 ASP QB 5.340 . 5.340 4.117 3.143 4.757 . 0 0 "[ . 1 . 2 . 3 ]" 1
2629 1 41 LEU QD 1 42 ILE H 3.890 . 3.890 3.805 3.298 3.922 0.032 17 0 "[ . 1 . 2 . 3 ]" 1
2630 1 41 LEU QD 1 42 ILE HA 5.370 . 5.370 4.018 2.847 4.288 . 0 0 "[ . 1 . 2 . 3 ]" 1
2631 1 41 LEU QD 1 44 LYS H 4.960 . 4.960 4.571 4.235 4.794 . 0 0 "[ . 1 . 2 . 3 ]" 1
2632 1 41 LEU QD 1 44 LYS HB3 3.760 . 3.760 3.098 2.658 3.528 . 0 0 "[ . 1 . 2 . 3 ]" 1
2633 1 41 LEU QD 1 44 LYS QD 3.530 . 3.530 2.676 2.148 3.643 0.113 28 0 "[ . 1 . 2 . 3 ]" 1
2634 1 41 LEU QD 1 44 LYS QE 3.810 . 3.810 2.964 1.957 3.821 0.011 30 0 "[ . 1 . 2 . 3 ]" 1
2635 1 41 LEU QD 1 45 PHE HA 5.440 . 5.440 5.438 5.264 5.525 0.085 21 0 "[ . 1 . 2 . 3 ]" 1
2636 1 41 LEU QD 1 45 PHE HB2 4.790 . 4.790 4.309 3.654 4.620 . 0 0 "[ . 1 . 2 . 3 ]" 1
2637 1 41 LEU QD 1 45 PHE QD 3.040 . 3.040 2.496 2.163 2.721 . 0 0 "[ . 1 . 2 . 3 ]" 1
2638 1 41 LEU QD 1 45 PHE QE 4.190 . 4.190 2.164 1.981 2.806 . 0 0 "[ . 1 . 2 . 3 ]" 1
2639 1 41 LEU QD 2 34 PHE HA 3.800 . 3.800 3.082 2.627 3.507 . 0 0 "[ . 1 . 2 . 3 ]" 1
2640 1 41 LEU QD 2 34 PHE HB3 5.440 . 5.440 5.032 4.469 5.466 0.026 29 0 "[ . 1 . 2 . 3 ]" 1
2641 1 41 LEU QD 2 34 PHE QD 3.550 . 3.550 2.782 1.909 3.108 . 0 0 "[ . 1 . 2 . 3 ]" 1
2642 1 41 LEU QD 2 34 PHE QE 3.550 . 3.550 2.944 2.031 3.318 . 0 0 "[ . 1 . 2 . 3 ]" 1
2643 1 41 LEU QD 2 34 PHE HZ 4.560 . 4.560 4.109 3.551 4.565 0.005 26 0 "[ . 1 . 2 . 3 ]" 1
2644 1 41 LEU QD 2 35 SER HA 5.440 . 5.440 5.066 4.743 5.450 0.010 32 0 "[ . 1 . 2 . 3 ]" 1
2645 1 41 LEU QD 2 37 ASP H 4.350 . 4.350 4.031 3.817 4.343 . 0 0 "[ . 1 . 2 . 3 ]" 1
2646 1 41 LEU QD 2 37 ASP HA 4.550 . 4.550 4.064 3.873 4.341 . 0 0 "[ . 1 . 2 . 3 ]" 1
2647 1 41 LEU QD 2 37 ASP QB 2.860 . 2.860 2.198 2.016 2.618 . 0 0 "[ . 1 . 2 . 3 ]" 1
2648 1 41 LEU QD 2 38 LEU H 3.580 . 3.580 2.802 2.568 3.119 . 0 0 "[ . 1 . 2 . 3 ]" 1
2649 1 41 LEU QD 2 38 LEU HA 3.160 . 3.160 2.254 1.909 2.506 . 0 0 "[ . 1 . 2 . 3 ]" 1
2650 1 41 LEU QD 2 38 LEU QB 3.870 . 3.870 2.434 2.069 2.888 . 0 0 "[ . 1 . 2 . 3 ]" 1
2651 1 41 LEU QD 2 38 LEU HG 5.440 . 5.440 4.330 2.761 4.762 . 0 0 "[ . 1 . 2 . 3 ]" 1
2652 1 41 LEU QD 2 40 LYS H 5.440 . 5.440 5.140 4.855 5.438 . 0 0 "[ . 1 . 2 . 3 ]" 1
2653 1 41 LEU QD 2 41 LEU H 4.920 . 4.920 4.196 3.776 4.592 . 0 0 "[ . 1 . 2 . 3 ]" 1
2654 1 42 ILE HA 1 46 MET QG 4.570 . 4.570 3.539 3.204 3.782 . 0 0 "[ . 1 . 2 . 3 ]" 1
2655 1 42 ILE HA 2 21 VAL QG 4.250 . 4.250 3.313 2.760 3.772 . 0 0 "[ . 1 . 2 . 3 ]" 1
2656 1 42 ILE MG 1 46 MET QG 3.240 . 3.240 2.103 1.872 2.319 . 0 0 "[ . 1 . 2 . 3 ]" 1
2657 1 42 ILE MG 2 17 LEU QD 3.460 . 3.460 3.109 2.726 3.386 . 0 0 "[ . 1 . 2 . 3 ]" 1
2658 1 42 ILE MG 2 21 VAL QG 3.340 . 3.340 2.112 1.896 2.426 . 0 0 "[ . 1 . 2 . 3 ]" 1
2659 1 42 ILE HG12 2 17 LEU QD 4.370 . 4.370 2.927 2.707 3.326 . 0 0 "[ . 1 . 2 . 3 ]" 1
2660 1 42 ILE HG12 2 21 VAL QG 4.370 . 4.370 2.847 2.463 3.266 . 0 0 "[ . 1 . 2 . 3 ]" 1
2661 1 42 ILE HG13 2 17 LEU QD 5.140 . 5.140 3.813 3.466 4.061 . 0 0 "[ . 1 . 2 . 3 ]" 1
2662 1 42 ILE MD 2 17 LEU QD 2.940 . 2.940 2.049 1.812 2.294 . 0 0 "[ . 1 . 2 . 3 ]" 1
2663 1 42 ILE MD 2 21 VAL QG 4.980 . 4.980 2.930 2.640 3.325 . 0 0 "[ . 1 . 2 . 3 ]" 1
2664 1 43 ASN H 1 46 MET QG 4.660 . 4.660 3.963 3.802 4.490 . 0 0 "[ . 1 . 2 . 3 ]" 1
2665 1 43 ASN HA 1 43 ASN QD 4.550 . 4.550 3.790 2.186 4.139 . 0 0 "[ . 1 . 2 . 3 ]" 1
2666 1 43 ASN HA 1 46 MET QG 4.030 . 4.030 2.749 2.232 3.502 . 0 0 "[ . 1 . 2 . 3 ]" 1
2667 1 43 ASN HA 1 48 VAL QG 4.320 . 4.320 2.882 2.028 4.362 0.042 24 0 "[ . 1 . 2 . 3 ]" 1
2668 1 43 ASN HB2 1 43 ASN QD 3.400 . 3.400 2.264 2.145 3.304 . 0 0 "[ . 1 . 2 . 3 ]" 1
2669 1 44 LYS H 1 44 LYS QD 4.730 . 4.730 4.650 4.512 4.740 0.010 2 0 "[ . 1 . 2 . 3 ]" 1
2670 1 44 LYS H 1 44 LYS QE 4.800 . 4.800 4.084 3.739 4.275 . 0 0 "[ . 1 . 2 . 3 ]" 1
2671 1 44 LYS HA 1 44 LYS QD 4.910 . 4.910 4.276 4.030 4.339 . 0 0 "[ . 1 . 2 . 3 ]" 1
2672 1 44 LYS HA 1 44 LYS QE 5.340 . 5.340 4.186 3.922 4.410 . 0 0 "[ . 1 . 2 . 3 ]" 1
2673 1 44 LYS HB2 1 44 LYS QD 3.480 . 3.480 3.001 2.345 3.128 . 0 0 "[ . 1 . 2 . 3 ]" 1
2674 1 44 LYS HB2 1 44 LYS QE 4.090 . 4.090 2.130 1.934 2.802 . 0 0 "[ . 1 . 2 . 3 ]" 1
2675 1 44 LYS HB3 1 44 LYS QE 4.100 . 4.100 2.664 1.949 2.865 . 0 0 "[ . 1 . 2 . 3 ]" 1
2676 1 44 LYS QE 1 44 LYS HG3 3.140 . 3.140 2.671 2.371 3.237 0.097 28 0 "[ . 1 . 2 . 3 ]" 1
2677 1 44 LYS QD 1 45 PHE H 4.590 . 4.590 4.206 3.930 4.681 0.091 28 0 "[ . 1 . 2 . 3 ]" 1
2678 1 44 LYS QD 1 45 PHE QD 4.170 . 4.170 3.059 2.742 4.235 0.065 28 0 "[ . 1 . 2 . 3 ]" 1
2679 1 44 LYS QE 1 45 PHE H 5.340 . 5.340 4.825 3.494 5.150 . 0 0 "[ . 1 . 2 . 3 ]" 1
2680 1 44 LYS QE 1 45 PHE QD 4.840 . 4.840 4.264 2.366 4.670 . 0 0 "[ . 1 . 2 . 3 ]" 1
2681 1 45 PHE HA 2 26 LEU QD 3.810 . 3.810 3.498 3.190 3.699 . 0 0 "[ . 1 . 2 . 3 ]" 1
2682 1 45 PHE HB2 2 21 VAL QG 4.180 . 4.180 3.442 2.849 4.183 0.003 26 0 "[ . 1 . 2 . 3 ]" 1
2683 1 45 PHE HB2 2 26 LEU QD 3.790 . 3.790 3.056 2.606 3.377 . 0 0 "[ . 1 . 2 . 3 ]" 1
2684 1 45 PHE HB3 2 21 VAL QG 4.320 . 4.320 3.503 2.941 4.186 . 0 0 "[ . 1 . 2 . 3 ]" 1
2685 1 45 PHE HB3 2 26 LEU QD 3.830 . 3.830 1.997 1.830 2.266 . 0 0 "[ . 1 . 2 . 3 ]" 1
2686 1 45 PHE QD 2 26 LEU QD 3.340 . 3.340 2.605 2.306 2.920 . 0 0 "[ . 1 . 2 . 3 ]" 1
2687 1 45 PHE QD 2 30 LYS QE 4.610 . 4.610 4.089 3.165 4.464 . 0 0 "[ . 1 . 2 . 3 ]" 1
2688 1 45 PHE QE 2 33 LEU QD 4.100 . 4.100 2.854 2.358 3.719 . 0 0 "[ . 1 . 2 . 3 ]" 1
2689 1 45 PHE HZ 2 33 LEU QD 4.860 . 4.860 3.388 2.893 3.872 . 0 0 "[ . 1 . 2 . 3 ]" 1
2690 1 46 MET H 2 26 LEU QD 4.520 . 4.520 3.832 3.414 4.219 . 0 0 "[ . 1 . 2 . 3 ]" 1
2691 1 46 MET HA 1 46 MET QG 3.450 . 3.450 2.616 2.412 2.973 . 0 0 "[ . 1 . 2 . 3 ]" 1
2692 1 46 MET HA 2 21 VAL QG 4.580 . 4.580 4.159 3.422 4.715 0.135 31 0 "[ . 1 . 2 . 3 ]" 1
2693 1 46 MET HA 2 26 LEU QD 4.280 . 4.280 2.843 2.165 3.600 . 0 0 "[ . 1 . 2 . 3 ]" 1
2694 1 46 MET QG 2 21 VAL QG 3.770 . 3.770 2.754 2.070 3.499 . 0 0 "[ . 1 . 2 . 3 ]" 1
2695 1 46 MET QG 2 26 LEU QD 4.470 . 4.470 3.665 2.856 4.548 0.078 8 0 "[ . 1 . 2 . 3 ]" 1
2696 1 46 MET ME 2 21 VAL QG 3.670 . 3.670 3.305 1.830 3.705 0.035 21 0 "[ . 1 . 2 . 3 ]" 1
2697 1 47 ASN H 1 48 VAL QG 4.470 . 4.470 3.564 3.075 4.059 . 0 0 "[ . 1 . 2 . 3 ]" 1
2698 1 47 ASN H 2 26 LEU QD 5.440 . 5.440 4.659 4.217 5.126 . 0 0 "[ . 1 . 2 . 3 ]" 1
2699 1 47 ASN HA 1 47 ASN QD 4.410 . 4.410 3.522 1.839 4.149 . 0 0 "[ . 1 . 2 . 3 ]" 1
2700 1 48 VAL H 1 48 VAL QG 2.990 . 2.990 2.189 1.884 2.651 . 0 0 "[ . 1 . 2 . 3 ]" 1
2701 1 48 VAL H 1 49 LYS QG 4.340 . 4.340 4.206 3.728 4.443 0.103 4 0 "[ . 1 . 2 . 3 ]" 1
2702 1 48 VAL HA 1 48 VAL QG 2.830 . 2.830 2.238 2.134 2.409 . 0 0 "[ . 1 . 2 . 3 ]" 1
2703 1 48 VAL HA 1 49 LYS QB 4.700 . 4.700 4.280 4.132 4.444 . 0 0 "[ . 1 . 2 . 3 ]" 1
2704 1 48 VAL HA 1 49 LYS QG 4.570 . 4.570 3.633 3.016 4.265 . 0 0 "[ . 1 . 2 . 3 ]" 1
2705 1 48 VAL HB 1 49 LYS QG 5.340 . 5.340 4.983 3.006 5.374 0.034 25 0 "[ . 1 . 2 . 3 ]" 1
2706 1 48 VAL QG 1 49 LYS H 3.490 . 3.490 3.225 2.583 3.563 0.073 15 0 "[ . 1 . 2 . 3 ]" 1
2707 1 48 VAL QG 1 49 LYS HA 4.450 . 4.450 3.872 3.390 4.484 0.034 3 0 "[ . 1 . 2 . 3 ]" 1
2708 1 48 VAL QG 1 50 ASP H 4.160 . 4.160 3.231 1.775 4.221 0.061 27 0 "[ . 1 . 2 . 3 ]" 1
2709 1 49 LYS H 1 49 LYS QB 3.130 . 3.130 2.574 2.433 3.300 0.170 3 0 "[ . 1 . 2 . 3 ]" 1
2710 1 49 LYS H 1 49 LYS QG 3.750 . 3.750 2.697 2.070 3.456 . 0 0 "[ . 1 . 2 . 3 ]" 1
2711 1 49 LYS HA 1 49 LYS QG 3.620 . 3.620 2.533 2.239 3.292 . 0 0 "[ . 1 . 2 . 3 ]" 1
2712 1 49 LYS HA 1 49 LYS QD 4.730 . 4.730 3.946 2.090 4.302 . 0 0 "[ . 1 . 2 . 3 ]" 1
2713 1 49 LYS QB 1 49 LYS QD 3.280 . 3.280 2.277 2.101 2.684 . 0 0 "[ . 1 . 2 . 3 ]" 1
2714 1 50 ASP H 1 50 ASP QB 2.910 . 2.910 2.595 2.242 2.987 0.077 32 0 "[ . 1 . 2 . 3 ]" 1
2715 1 50 ASP QB 1 51 LYS H 4.210 . 4.210 3.271 2.221 3.939 . 0 0 "[ . 1 . 2 . 3 ]" 1
2716 1 50 ASP QB 1 52 VAL H 4.420 . 4.420 3.163 2.134 4.305 . 0 0 "[ . 1 . 2 . 3 ]" 1
2717 1 50 ASP QB 1 52 VAL QG 3.820 . 3.820 2.858 1.866 3.861 0.041 1 0 "[ . 1 . 2 . 3 ]" 1
2718 1 51 LYS H 1 51 LYS QG 3.260 . 3.260 2.032 1.647 2.292 . 0 0 "[ . 1 . 2 . 3 ]" 1
2719 1 51 LYS H 1 51 LYS QD 4.770 . 4.770 3.941 3.400 4.275 . 0 0 "[ . 1 . 2 . 3 ]" 1
2720 1 51 LYS H 1 52 VAL QG 3.930 . 3.930 3.098 2.351 3.945 0.015 12 0 "[ . 1 . 2 . 3 ]" 1
2721 1 51 LYS HA 1 52 VAL QG 4.680 . 4.680 4.134 3.551 4.371 . 0 0 "[ . 1 . 2 . 3 ]" 1
2722 1 51 LYS HB2 1 51 LYS QD 3.370 . 3.370 2.574 2.300 3.043 . 0 0 "[ . 1 . 2 . 3 ]" 1
2723 1 51 LYS QG 1 52 VAL H 4.000 . 4.000 3.405 2.372 4.018 0.018 31 0 "[ . 1 . 2 . 3 ]" 1
2724 1 52 VAL H 1 52 VAL QG 3.110 . 3.110 2.001 1.779 2.295 . 0 0 "[ . 1 . 2 . 3 ]" 1
2725 1 52 VAL QG 1 53 HIS H 4.520 . 4.520 3.088 2.249 3.751 . 0 0 "[ . 1 . 2 . 3 ]" 1
2726 1 53 HIS QB 1 54 LYS H 4.250 . 4.250 3.277 1.861 4.032 . 0 0 "[ . 1 . 2 . 3 ]" 1
2727 1 54 LYS H 1 54 LYS QB 3.650 . 3.650 2.626 2.236 3.414 . 0 0 "[ . 1 . 2 . 3 ]" 1
2728 1 54 LYS H 1 54 LYS QG 4.990 . 4.990 3.408 2.159 4.324 . 0 0 "[ . 1 . 2 . 3 ]" 1
2729 1 54 LYS HA 1 54 LYS QE 4.570 . 4.570 4.040 1.858 4.625 0.055 3 0 "[ . 1 . 2 . 3 ]" 1
2730 1 54 LYS QB 1 55 LEU H 4.190 . 4.190 3.394 1.808 4.031 . 0 0 "[ . 1 . 2 . 3 ]" 1
2731 1 54 LYS QG 1 55 LEU H 4.560 . 4.560 3.824 2.329 4.647 0.087 5 0 "[ . 1 . 2 . 3 ]" 1
2732 1 55 LEU H 1 55 LEU QB 2.980 . 2.980 2.555 2.037 3.119 0.139 13 0 "[ . 1 . 2 . 3 ]" 1
2733 1 55 LEU HA 1 55 LEU QD 3.410 . 3.410 2.518 1.968 3.429 0.019 19 0 "[ . 1 . 2 . 3 ]" 1
2734 1 55 LEU QB 1 56 GLU H 3.640 . 3.640 2.988 1.861 3.801 0.161 29 0 "[ . 1 . 2 . 3 ]" 1
2735 1 55 LEU QD 1 56 GLU H 4.430 . 4.430 3.628 2.043 4.462 0.032 25 0 "[ . 1 . 2 . 3 ]" 1
2736 1 56 GLU H 1 56 GLU QB 3.410 . 3.410 2.617 2.171 3.429 0.019 14 0 "[ . 1 . 2 . 3 ]" 1
2737 1 56 GLU H 1 56 GLU QG 4.650 . 4.650 3.142 1.775 4.536 . 0 0 "[ . 1 . 2 . 3 ]" 1
2738 1 57 HIS QB 1 58 HIS H 4.380 . 4.380 3.033 1.895 3.932 . 0 0 "[ . 1 . 2 . 3 ]" 1
2739 1 57 HIS QB 1 58 HIS HA 4.240 . 4.240 4.207 3.856 4.340 0.100 25 0 "[ . 1 . 2 . 3 ]" 1
2740 2 1 MET HA 2 1 MET QG 3.630 . 3.630 2.706 2.398 3.538 . 0 0 "[ . 1 . 2 . 3 ]" 1
2741 2 1 MET ME 2 1 MET QG 3.530 . 3.530 2.373 2.208 2.482 . 0 0 "[ . 1 . 2 . 3 ]" 1
2742 2 2 GLU HA 2 2 GLU QG 3.710 . 3.710 2.830 2.453 3.591 . 0 0 "[ . 1 . 2 . 3 ]" 1
2743 2 2 GLU QB 2 4 GLY H 4.590 . 4.590 3.504 2.233 4.657 0.067 6 0 "[ . 1 . 2 . 3 ]" 1
2744 2 2 GLU QB 2 5 GLN H 4.940 . 4.940 3.404 2.300 4.990 0.050 32 0 "[ . 1 . 2 . 3 ]" 1
2745 2 2 GLU QB 2 5 GLN QG 4.230 . 4.230 3.225 2.030 4.376 0.146 31 0 "[ . 1 . 2 . 3 ]" 1
2746 2 3 MET H 2 3 MET QB 3.560 . 3.560 2.738 2.317 3.422 . 0 0 "[ . 1 . 2 . 3 ]" 1
2747 2 3 MET HA 2 3 MET QG 3.540 . 3.540 2.955 2.314 3.502 . 0 0 "[ . 1 . 2 . 3 ]" 1
2748 2 3 MET HA 2 5 GLN QB 5.340 . 5.340 5.067 3.914 5.486 0.146 4 0 "[ . 1 . 2 . 3 ]" 1
2749 2 3 MET HA 2 6 LEU QD 4.500 . 4.500 3.514 3.160 4.092 . 0 0 "[ . 1 . 2 . 3 ]" 1
2750 2 3 MET QB 2 6 LEU HG 5.340 . 5.340 4.444 3.469 5.358 0.018 12 0 "[ . 1 . 2 . 3 ]" 1
2751 2 3 MET QB 2 6 LEU QD 4.040 . 4.040 3.421 2.641 4.062 0.022 6 0 "[ . 1 . 2 . 3 ]" 1
2752 2 3 MET ME 2 3 MET QG 3.090 . 3.090 2.353 2.210 2.476 . 0 0 "[ . 1 . 2 . 3 ]" 1
2753 2 3 MET QG 2 4 GLY H 4.530 . 4.530 3.566 2.433 4.530 . 0 0 "[ . 1 . 2 . 3 ]" 1
2754 2 5 GLN H 2 5 GLN QB 3.230 . 3.230 2.485 2.297 2.763 . 0 0 "[ . 1 . 2 . 3 ]" 1
2755 2 5 GLN H 2 5 GLN QG 3.650 . 3.650 2.330 2.022 3.563 . 0 0 "[ . 1 . 2 . 3 ]" 1
2756 2 5 GLN HA 2 5 GLN QG 3.350 . 3.350 2.837 2.398 3.362 0.012 3 0 "[ . 1 . 2 . 3 ]" 1
2757 2 5 GLN HA 2 5 GLN QE 5.340 . 5.340 4.136 2.521 5.426 0.086 32 0 "[ . 1 . 2 . 3 ]" 1
2758 2 5 GLN HA 2 8 ASN QB 3.550 . 3.550 2.308 1.857 2.713 . 0 0 "[ . 1 . 2 . 3 ]" 1
2759 2 5 GLN HA 2 8 ASN QD 4.110 . 4.110 3.503 2.574 4.114 0.004 22 0 "[ . 1 . 2 . 3 ]" 1
2760 2 5 GLN QB 2 6 LEU H 3.750 . 3.750 2.838 2.364 3.619 . 0 0 "[ . 1 . 2 . 3 ]" 1
2761 2 5 GLN QB 2 6 LEU HA 5.030 . 5.030 4.023 3.780 4.484 . 0 0 "[ . 1 . 2 . 3 ]" 1
2762 2 5 GLN QB 2 8 ASN H 5.340 . 5.340 4.676 4.366 5.028 . 0 0 "[ . 1 . 2 . 3 ]" 1
2763 2 5 GLN QB 2 8 ASN QB 4.180 . 4.180 3.703 3.081 4.135 . 0 0 "[ . 1 . 2 . 3 ]" 1
2764 2 5 GLN QB 2 8 ASN QD 4.700 . 4.700 4.391 3.557 4.822 0.122 7 0 "[ . 1 . 2 . 3 ]" 1
2765 2 5 GLN QB 2 9 LYS H 5.340 . 5.340 4.697 4.301 5.275 . 0 0 "[ . 1 . 2 . 3 ]" 1
2766 2 5 GLN QG 2 6 LEU H 4.640 . 4.640 3.732 2.044 4.667 0.027 16 0 "[ . 1 . 2 . 3 ]" 1
2767 2 6 LEU H 2 6 LEU QD 3.840 . 3.840 3.684 3.647 3.720 . 0 0 "[ . 1 . 2 . 3 ]" 1
2768 2 6 LEU HA 2 6 LEU QD 2.960 . 2.960 2.175 2.098 2.281 . 0 0 "[ . 1 . 2 . 3 ]" 1
2769 2 6 LEU HA 2 9 LYS QG 3.760 . 3.760 3.096 2.292 3.734 . 0 0 "[ . 1 . 2 . 3 ]" 1
2770 2 6 LEU HB3 2 6 LEU QD 2.900 . 2.900 2.251 2.214 2.288 . 0 0 "[ . 1 . 2 . 3 ]" 1
2771 2 6 LEU QD 2 7 LYS H 4.070 . 4.070 2.982 2.797 3.112 . 0 0 "[ . 1 . 2 . 3 ]" 1
2772 2 6 LEU QD 2 7 LYS HA 4.470 . 4.470 2.768 2.617 3.021 . 0 0 "[ . 1 . 2 . 3 ]" 1
2773 2 6 LEU QD 2 7 LYS HG2 3.780 . 3.780 3.460 2.886 3.827 0.047 2 0 "[ . 1 . 2 . 3 ]" 1
2774 2 6 LEU QD 2 7 LYS HG3 4.650 . 4.650 4.649 4.235 4.740 0.090 5 0 "[ . 1 . 2 . 3 ]" 1
2775 2 6 LEU QD 2 8 ASN H 5.340 . 5.340 4.439 4.323 4.577 . 0 0 "[ . 1 . 2 . 3 ]" 1
2776 2 6 LEU QD 2 9 LYS H 4.830 . 4.830 4.071 3.895 4.254 . 0 0 "[ . 1 . 2 . 3 ]" 1
2777 2 6 LEU QD 2 9 LYS HB2 3.660 . 3.660 3.023 2.704 3.353 . 0 0 "[ . 1 . 2 . 3 ]" 1
2778 2 6 LEU QD 2 9 LYS HB3 4.590 . 4.590 4.179 3.799 4.544 . 0 0 "[ . 1 . 2 . 3 ]" 1
2779 2 6 LEU QD 2 10 ILE H 4.500 . 4.500 3.527 3.329 3.691 . 0 0 "[ . 1 . 2 . 3 ]" 1
2780 2 6 LEU QD 2 10 ILE HG13 4.770 . 4.770 2.443 2.214 2.589 . 0 0 "[ . 1 . 2 . 3 ]" 1
2781 2 6 LEU QD 2 10 ILE MD 2.980 . 2.980 1.957 1.876 1.997 . 0 0 "[ . 1 . 2 . 3 ]" 1
2782 2 6 LEU QD 2 46 MET ME 3.410 . 3.410 3.084 2.154 3.530 0.120 6 0 "[ . 1 . 2 . 3 ]" 1
2783 2 7 LYS H 2 8 ASN QB 4.720 . 4.720 4.360 4.197 4.622 . 0 0 "[ . 1 . 2 . 3 ]" 1
2784 2 7 LYS HB3 2 7 LYS QE 3.050 . 3.050 2.112 2.012 2.254 . 0 0 "[ . 1 . 2 . 3 ]" 1
2785 2 7 LYS HB3 2 11 GLU QG 4.840 . 4.840 3.787 3.213 4.543 . 0 0 "[ . 1 . 2 . 3 ]" 1
2786 2 7 LYS QE 2 7 LYS HG2 3.450 . 3.450 3.352 3.265 3.491 0.041 12 0 "[ . 1 . 2 . 3 ]" 1
2787 2 7 LYS QE 2 7 LYS HG3 3.190 . 3.190 2.464 2.227 2.981 . 0 0 "[ . 1 . 2 . 3 ]" 1
2788 2 7 LYS HD2 2 11 GLU QG 3.750 . 3.750 2.893 2.267 3.136 . 0 0 "[ . 1 . 2 . 3 ]" 1
2789 2 7 LYS QE 2 11 GLU QG 3.580 . 3.580 2.629 2.021 3.655 0.075 2 0 "[ . 1 . 2 . 3 ]" 1
2790 2 8 ASN H 2 8 ASN QB 2.890 . 2.890 2.261 2.178 2.444 . 0 0 "[ . 1 . 2 . 3 ]" 1
2791 2 8 ASN HA 2 8 ASN QD 4.160 . 4.160 3.858 2.998 4.170 0.010 27 0 "[ . 1 . 2 . 3 ]" 1
2792 2 8 ASN QB 2 9 LYS H 3.250 . 3.250 2.585 2.279 3.076 . 0 0 "[ . 1 . 2 . 3 ]" 1
2793 2 8 ASN QB 2 9 LYS QG 4.350 . 4.350 3.422 3.084 3.845 . 0 0 "[ . 1 . 2 . 3 ]" 1
2794 2 9 LYS H 2 9 LYS QG 3.270 . 3.270 2.318 2.064 2.706 . 0 0 "[ . 1 . 2 . 3 ]" 1
2795 2 9 LYS H 2 9 LYS QD 4.770 . 4.770 3.739 2.990 4.527 . 0 0 "[ . 1 . 2 . 3 ]" 1
2796 2 9 LYS HA 2 9 LYS QG 3.360 . 3.360 2.649 2.313 3.161 . 0 0 "[ . 1 . 2 . 3 ]" 1
2797 2 9 LYS HA 2 9 LYS QD 4.380 . 4.380 3.325 1.900 4.256 . 0 0 "[ . 1 . 2 . 3 ]" 1
2798 2 9 LYS HA 2 12 ASN QB 3.370 . 3.370 2.383 2.018 2.880 . 0 0 "[ . 1 . 2 . 3 ]" 1
2799 2 9 LYS HA 2 12 ASN QD 4.150 . 4.150 3.799 3.026 4.239 0.089 4 0 "[ . 1 . 2 . 3 ]" 1
2800 2 9 LYS HB3 2 9 LYS QD 3.480 . 3.480 2.529 2.285 3.077 . 0 0 "[ . 1 . 2 . 3 ]" 1
2801 2 9 LYS HB3 2 12 ASN QB 4.960 . 4.960 4.168 3.666 4.783 . 0 0 "[ . 1 . 2 . 3 ]" 1
2802 2 9 LYS QD 2 10 ILE H 5.340 . 5.340 4.791 4.313 5.394 0.054 29 0 "[ . 1 . 2 . 3 ]" 1
2803 2 10 ILE HA 2 13 LYS QB 3.840 . 3.840 2.934 2.666 3.331 . 0 0 "[ . 1 . 2 . 3 ]" 1
2804 2 10 ILE HB 2 11 GLU QG 4.940 . 4.940 3.533 3.299 3.786 . 0 0 "[ . 1 . 2 . 3 ]" 1
2805 2 10 ILE MD 2 46 MET QG 4.500 . 4.500 3.563 3.097 3.990 . 0 0 "[ . 1 . 2 . 3 ]" 1
2806 2 11 GLU H 2 11 GLU QG 3.190 . 3.190 2.212 2.093 2.449 . 0 0 "[ . 1 . 2 . 3 ]" 1
2807 2 11 GLU H 2 12 ASN QB 4.660 . 4.660 4.461 4.174 4.647 . 0 0 "[ . 1 . 2 . 3 ]" 1
2808 2 11 GLU HA 2 11 GLU QG 3.500 . 3.500 2.889 2.450 2.999 . 0 0 "[ . 1 . 2 . 3 ]" 1
2809 2 11 GLU QG 2 12 ASN H 4.220 . 4.220 3.930 3.746 4.097 . 0 0 "[ . 1 . 2 . 3 ]" 1
2810 2 12 ASN H 2 12 ASN QB 2.840 . 2.840 2.234 2.159 2.301 . 0 0 "[ . 1 . 2 . 3 ]" 1
2811 2 12 ASN H 2 13 LYS QB 4.730 . 4.730 4.553 4.377 4.676 . 0 0 "[ . 1 . 2 . 3 ]" 1
2812 2 12 ASN HA 2 12 ASN QD 4.640 . 4.640 3.674 2.837 4.180 . 0 0 "[ . 1 . 2 . 3 ]" 1
2813 2 12 ASN QB 2 13 LYS H 3.440 . 3.440 2.516 2.178 2.754 . 0 0 "[ . 1 . 2 . 3 ]" 1
2814 2 13 LYS H 2 13 LYS QB 3.050 . 3.050 2.195 2.128 2.250 . 0 0 "[ . 1 . 2 . 3 ]" 1
2815 2 13 LYS H 2 13 LYS QE 4.100 . 4.100 3.600 3.320 3.994 . 0 0 "[ . 1 . 2 . 3 ]" 1
2816 2 13 LYS HA 2 13 LYS QD 3.730 . 3.730 2.084 1.909 3.446 . 0 0 "[ . 1 . 2 . 3 ]" 1
2817 2 13 LYS HA 2 13 LYS QE 3.880 . 3.880 2.615 1.845 2.989 . 0 0 "[ . 1 . 2 . 3 ]" 1
2818 2 13 LYS HA 2 16 GLU QG 4.260 . 4.260 2.811 2.487 3.230 . 0 0 "[ . 1 . 2 . 3 ]" 1
2819 2 13 LYS QB 2 13 LYS QE 3.600 . 3.600 2.010 1.938 2.260 . 0 0 "[ . 1 . 2 . 3 ]" 1
2820 2 13 LYS QB 2 14 LYS H 3.410 . 3.410 2.461 2.308 2.609 . 0 0 "[ . 1 . 2 . 3 ]" 1
2821 2 13 LYS QB 2 16 GLU H 5.320 . 5.320 4.863 4.772 4.965 . 0 0 "[ . 1 . 2 . 3 ]" 1
2822 2 13 LYS QD 2 16 GLU HB3 5.290 . 5.290 3.920 3.566 5.313 0.023 19 0 "[ . 1 . 2 . 3 ]" 1
2823 2 13 LYS QE 2 16 GLU HB2 4.440 . 4.440 4.361 2.626 4.507 0.067 18 0 "[ . 1 . 2 . 3 ]" 1
2824 2 14 LYS H 2 17 LEU QD 5.440 . 5.440 5.557 5.440 5.639 0.199 13 0 "[ . 1 . 2 . 3 ]" 1
2825 2 14 LYS HA 2 17 LEU QD 4.120 . 4.120 3.396 3.305 3.457 . 0 0 "[ . 1 . 2 . 3 ]" 1
2826 2 14 LYS HA 2 38 LEU QD 3.860 . 3.860 3.241 2.900 3.783 . 0 0 "[ . 1 . 2 . 3 ]" 1
2827 2 14 LYS HB2 2 38 LEU QD 4.270 . 4.270 3.750 3.399 3.984 . 0 0 "[ . 1 . 2 . 3 ]" 1
2828 2 14 LYS HB3 2 38 LEU QD 5.310 . 5.310 4.248 4.131 4.585 . 0 0 "[ . 1 . 2 . 3 ]" 1
2829 2 14 LYS HG2 2 38 LEU QD 4.050 . 4.050 2.614 2.370 3.042 . 0 0 "[ . 1 . 2 . 3 ]" 1
2830 2 14 LYS HG3 2 17 LEU QD 4.750 . 4.750 3.869 3.448 4.110 . 0 0 "[ . 1 . 2 . 3 ]" 1
2831 2 14 LYS HE3 2 38 LEU QD 4.850 . 4.850 4.085 3.769 4.515 . 0 0 "[ . 1 . 2 . 3 ]" 1
2832 2 15 LYS H 2 17 LEU QD 5.440 . 5.440 5.484 5.394 5.568 0.128 10 0 "[ . 1 . 2 . 3 ]" 1
2833 2 15 LYS H 2 38 LEU QD 5.440 . 5.440 5.072 4.825 5.458 0.018 2 0 "[ . 1 . 2 . 3 ]" 1
2834 2 15 LYS HA 2 17 LEU QD 5.440 . 5.440 5.007 4.770 5.391 . 0 0 "[ . 1 . 2 . 3 ]" 1
2835 2 15 LYS QE 2 15 LYS HG2 3.410 . 3.410 2.545 2.304 2.925 . 0 0 "[ . 1 . 2 . 3 ]" 1
2836 2 16 GLU H 2 16 GLU QG 3.400 . 3.400 2.470 2.325 2.786 . 0 0 "[ . 1 . 2 . 3 ]" 1
2837 2 17 LEU H 2 17 LEU QD 3.780 . 3.780 3.622 3.557 3.747 . 0 0 "[ . 1 . 2 . 3 ]" 1
2838 2 17 LEU H 2 20 LEU QD 5.200 . 5.200 4.340 3.934 4.570 . 0 0 "[ . 1 . 2 . 3 ]" 1
2839 2 17 LEU HA 2 17 LEU QD 3.320 . 3.320 2.327 2.287 2.420 . 0 0 "[ . 1 . 2 . 3 ]" 1
2840 2 17 LEU HA 2 20 LEU QD 3.550 . 3.550 2.392 2.184 2.635 . 0 0 "[ . 1 . 2 . 3 ]" 1
2841 2 17 LEU HA 2 21 VAL QG 4.460 . 4.460 3.928 3.706 4.242 . 0 0 "[ . 1 . 2 . 3 ]" 1
2842 2 17 LEU HB2 2 21 VAL QG 5.340 . 5.340 4.667 4.418 4.957 . 0 0 "[ . 1 . 2 . 3 ]" 1
2843 2 17 LEU HB3 2 17 LEU QD 2.980 . 2.980 2.174 2.086 2.225 . 0 0 "[ . 1 . 2 . 3 ]" 1
2844 2 17 LEU HB3 2 20 LEU QD 5.230 . 5.230 4.812 4.572 5.010 . 0 0 "[ . 1 . 2 . 3 ]" 1
2845 2 17 LEU HB3 2 21 VAL QG 5.440 . 5.440 4.466 4.129 4.711 . 0 0 "[ . 1 . 2 . 3 ]" 1
2846 2 17 LEU HB3 2 38 LEU QD 4.630 . 4.630 3.631 3.342 4.094 . 0 0 "[ . 1 . 2 . 3 ]" 1
2847 2 17 LEU HG 2 20 LEU QD 5.440 . 5.440 4.855 4.336 5.208 . 0 0 "[ . 1 . 2 . 3 ]" 1
2848 2 17 LEU HG 2 21 VAL QG 4.070 . 4.070 3.442 2.045 4.200 0.130 19 0 "[ . 1 . 2 . 3 ]" 1
2849 2 17 LEU HG 2 38 LEU QD 4.040 . 4.040 3.755 3.308 4.085 0.045 26 0 "[ . 1 . 2 . 3 ]" 1
2850 2 17 LEU QD 2 18 ILE HG13 3.380 . 3.380 2.921 2.558 3.378 . 0 0 "[ . 1 . 2 . 3 ]" 1
2851 2 17 LEU QD 2 20 LEU H 4.590 . 4.590 3.844 3.550 4.440 . 0 0 "[ . 1 . 2 . 3 ]" 1
2852 2 17 LEU QD 2 20 LEU HB2 4.330 . 4.330 2.697 2.487 3.171 . 0 0 "[ . 1 . 2 . 3 ]" 1
2853 2 17 LEU QD 2 20 LEU QD 3.840 . 3.840 2.951 2.749 3.151 . 0 0 "[ . 1 . 2 . 3 ]" 1
2854 2 17 LEU QD 2 21 VAL HB 4.520 . 4.520 3.901 2.662 4.598 0.078 22 0 "[ . 1 . 2 . 3 ]" 1
2855 2 17 LEU QD 2 21 VAL QG 2.800 . 2.800 2.039 1.861 2.420 . 0 0 "[ . 1 . 2 . 3 ]" 1
2856 2 17 LEU QD 2 34 PHE QE 3.930 . 3.930 2.284 2.018 3.020 . 0 0 "[ . 1 . 2 . 3 ]" 1
2857 2 17 LEU QD 2 34 PHE HZ 3.700 . 3.700 2.113 1.938 2.569 . 0 0 "[ . 1 . 2 . 3 ]" 1
2858 2 17 LEU QD 2 38 LEU QD 3.180 . 3.180 2.136 1.966 2.357 . 0 0 "[ . 1 . 2 . 3 ]" 1
2859 2 18 ILE H 2 38 LEU QD 4.530 . 4.530 3.979 3.675 4.565 0.035 4 0 "[ . 1 . 2 . 3 ]" 1
2860 2 18 ILE HA 2 21 VAL QG 3.090 . 3.090 2.553 2.016 2.990 . 0 0 "[ . 1 . 2 . 3 ]" 1
2861 2 18 ILE HB 2 35 SER QB 5.340 . 5.340 4.158 3.984 4.434 . 0 0 "[ . 1 . 2 . 3 ]" 1
2862 2 18 ILE HB 2 38 LEU QD 5.440 . 5.440 4.563 4.287 5.352 . 0 0 "[ . 1 . 2 . 3 ]" 1
2863 2 18 ILE MG 2 35 SER QB 3.630 . 3.630 2.132 1.929 2.480 . 0 0 "[ . 1 . 2 . 3 ]" 1
2864 2 18 ILE HG12 2 38 LEU QD 4.320 . 4.320 2.367 2.088 3.269 . 0 0 "[ . 1 . 2 . 3 ]" 1
2865 2 18 ILE HG13 2 38 LEU QD 3.900 . 3.900 2.650 2.336 3.501 . 0 0 "[ . 1 . 2 . 3 ]" 1
2866 2 18 ILE MD 2 35 SER QB 3.450 . 3.450 1.923 1.856 2.028 . 0 0 "[ . 1 . 2 . 3 ]" 1
2867 2 18 ILE MD 2 38 LEU QB 4.550 . 4.550 3.558 3.216 4.006 . 0 0 "[ . 1 . 2 . 3 ]" 1
2868 2 18 ILE MD 2 38 LEU QD 3.400 . 3.400 2.374 2.076 3.338 . 0 0 "[ . 1 . 2 . 3 ]" 1
2869 2 19 GLN H 2 21 VAL QG 4.790 . 4.790 4.596 4.260 4.865 0.075 8 0 "[ . 1 . 2 . 3 ]" 1
2870 2 19 GLN HB2 2 20 LEU QD 4.420 . 4.420 3.666 2.766 4.166 . 0 0 "[ . 1 . 2 . 3 ]" 1
2871 2 19 GLN HB3 2 20 LEU QD 4.770 . 4.770 4.063 3.477 4.615 . 0 0 "[ . 1 . 2 . 3 ]" 1
2872 2 20 LEU H 2 21 VAL QG 4.320 . 4.320 3.782 3.509 4.118 . 0 0 "[ . 1 . 2 . 3 ]" 1
2873 2 20 LEU HA 2 20 LEU QD 2.960 . 2.960 2.070 2.005 2.303 . 0 0 "[ . 1 . 2 . 3 ]" 1
2874 2 20 LEU HA 2 21 VAL QG 5.350 . 5.350 4.658 4.492 4.850 . 0 0 "[ . 1 . 2 . 3 ]" 1
2875 2 20 LEU HA 2 23 ARG QD 3.860 . 3.860 2.562 2.297 2.964 . 0 0 "[ . 1 . 2 . 3 ]" 1
2876 2 20 LEU HB2 2 21 VAL QG 4.940 . 4.940 3.306 3.118 3.865 . 0 0 "[ . 1 . 2 . 3 ]" 1
2877 2 20 LEU HB3 2 20 LEU QD 3.100 . 3.100 2.179 2.083 2.503 . 0 0 "[ . 1 . 2 . 3 ]" 1
2878 2 20 LEU HB3 2 23 ARG QD 4.570 . 4.570 4.149 3.674 4.574 0.004 8 0 "[ . 1 . 2 . 3 ]" 1
2879 2 20 LEU QD 2 21 VAL H 5.060 . 5.060 4.031 3.794 4.140 . 0 0 "[ . 1 . 2 . 3 ]" 1
2880 2 20 LEU QD 2 23 ARG HG3 5.440 . 5.440 3.967 3.557 4.638 . 0 0 "[ . 1 . 2 . 3 ]" 1
2881 2 20 LEU QD 2 23 ARG QD 3.450 . 3.450 2.305 1.973 3.085 . 0 0 "[ . 1 . 2 . 3 ]" 1
2882 2 21 VAL H 2 21 VAL QG 2.970 . 2.970 1.807 1.711 1.956 . 0 0 "[ . 1 . 2 . 3 ]" 1
2883 2 21 VAL HB 2 26 LEU QD 4.030 . 4.030 3.184 2.557 4.077 0.047 11 0 "[ . 1 . 2 . 3 ]" 1
2884 2 21 VAL QG 2 22 ALA H 3.400 . 3.400 2.853 2.216 3.321 . 0 0 "[ . 1 . 2 . 3 ]" 1
2885 2 21 VAL QG 2 22 ALA HA 4.200 . 4.200 3.424 2.957 3.815 . 0 0 "[ . 1 . 2 . 3 ]" 1
2886 2 21 VAL QG 2 24 HIS HB3 4.330 . 4.330 3.743 3.148 4.301 . 0 0 "[ . 1 . 2 . 3 ]" 1
2887 2 21 VAL QG 2 26 LEU H 4.970 . 4.970 4.825 4.117 5.090 0.120 22 0 "[ . 1 . 2 . 3 ]" 1
2888 2 21 VAL QG 2 26 LEU QD 3.050 . 3.050 1.948 1.839 2.115 . 0 0 "[ . 1 . 2 . 3 ]" 1
2889 2 21 VAL QG 2 31 VAL HA 5.440 . 5.440 4.396 3.677 5.088 . 0 0 "[ . 1 . 2 . 3 ]" 1
2890 2 21 VAL QG 2 31 VAL MG1 5.440 . 5.440 4.404 3.606 5.087 . 0 0 "[ . 1 . 2 . 3 ]" 1
2891 2 21 VAL QG 2 34 PHE QE 3.460 . 3.460 2.544 2.402 2.685 . 0 0 "[ . 1 . 2 . 3 ]" 1
2892 2 21 VAL QG 2 34 PHE HZ 3.520 . 3.520 2.603 2.166 2.986 . 0 0 "[ . 1 . 2 . 3 ]" 1
2893 2 22 ALA H 2 26 LEU QD 4.850 . 4.850 3.704 3.415 3.941 . 0 0 "[ . 1 . 2 . 3 ]" 1
2894 2 22 ALA HA 2 26 LEU QD 4.170 . 4.170 2.504 2.208 2.809 . 0 0 "[ . 1 . 2 . 3 ]" 1
2895 2 23 ARG H 2 23 ARG QD 4.740 . 4.740 3.953 3.607 4.274 . 0 0 "[ . 1 . 2 . 3 ]" 1
2896 2 23 ARG HA 2 23 ARG QD 4.790 . 4.790 4.506 4.443 4.554 . 0 0 "[ . 1 . 2 . 3 ]" 1
2897 2 23 ARG HB2 2 23 ARG QD 3.360 . 3.360 2.699 2.398 3.052 . 0 0 "[ . 1 . 2 . 3 ]" 1
2898 2 24 HIS H 2 25 GLY QA 5.240 . 5.240 4.501 4.321 4.636 . 0 0 "[ . 1 . 2 . 3 ]" 1
2899 2 24 HIS HB3 2 26 LEU QD 3.950 . 3.950 3.434 2.521 4.018 0.068 5 0 "[ . 1 . 2 . 3 ]" 1
2900 2 25 GLY H 2 26 LEU QD 4.990 . 4.990 3.661 3.059 4.258 . 0 0 "[ . 1 . 2 . 3 ]" 1
2901 2 25 GLY QA 2 26 LEU H 2.910 . 2.910 2.828 2.656 2.961 0.051 2 0 "[ . 1 . 2 . 3 ]" 1
2902 2 25 GLY QA 2 26 LEU HA 4.500 . 4.500 4.039 3.926 4.151 . 0 0 "[ . 1 . 2 . 3 ]" 1
2903 2 25 GLY QA 2 26 LEU QD 4.690 . 4.690 3.907 3.545 4.356 . 0 0 "[ . 1 . 2 . 3 ]" 1
2904 2 26 LEU H 2 26 LEU QD 3.710 . 3.710 2.822 2.019 3.373 . 0 0 "[ . 1 . 2 . 3 ]" 1
2905 2 26 LEU HA 2 26 LEU QD 3.330 . 3.330 2.144 1.936 2.526 . 0 0 "[ . 1 . 2 . 3 ]" 1
2906 2 26 LEU HA 2 27 ASP QB 4.590 . 4.590 4.316 3.895 4.604 0.014 28 0 "[ . 1 . 2 . 3 ]" 1
2907 2 26 LEU HB2 2 26 LEU QD 3.080 . 3.080 2.270 2.119 2.391 . 0 0 "[ . 1 . 2 . 3 ]" 1
2908 2 26 LEU QD 2 27 ASP H 3.730 . 3.730 3.366 2.927 3.886 0.156 11 0 "[ . 1 . 2 . 3 ]" 1
2909 2 26 LEU QD 2 27 ASP HA 5.440 . 5.440 5.228 5.022 5.464 0.024 13 0 "[ . 1 . 2 . 3 ]" 1
2910 2 26 LEU QD 2 30 LYS HB2 3.970 . 3.970 2.758 2.481 3.201 . 0 0 "[ . 1 . 2 . 3 ]" 1
2911 2 26 LEU QD 2 30 LYS HB3 3.650 . 3.650 1.953 1.755 2.406 . 0 0 "[ . 1 . 2 . 3 ]" 1
2912 2 26 LEU QD 2 30 LYS HG2 4.950 . 4.950 3.969 3.506 4.597 . 0 0 "[ . 1 . 2 . 3 ]" 1
2913 2 26 LEU QD 2 30 LYS HG3 4.650 . 4.650 2.903 2.174 4.049 . 0 0 "[ . 1 . 2 . 3 ]" 1
2914 2 26 LEU QD 2 30 LYS HD2 4.260 . 4.260 3.055 2.456 3.484 . 0 0 "[ . 1 . 2 . 3 ]" 1
2915 2 26 LEU QD 2 30 LYS HD3 4.170 . 4.170 3.874 2.522 4.187 0.017 13 0 "[ . 1 . 2 . 3 ]" 1
2916 2 26 LEU QD 2 30 LYS QE 4.850 . 4.850 4.006 3.163 4.710 . 0 0 "[ . 1 . 2 . 3 ]" 1
2917 2 26 LEU QD 2 31 VAL HA 4.750 . 4.750 2.735 2.444 3.002 . 0 0 "[ . 1 . 2 . 3 ]" 1
2918 2 26 LEU QD 2 34 PHE HB2 4.390 . 4.390 2.999 2.588 3.351 . 0 0 "[ . 1 . 2 . 3 ]" 1
2919 2 26 LEU QD 2 34 PHE HB3 4.360 . 4.360 3.233 2.939 3.479 . 0 0 "[ . 1 . 2 . 3 ]" 1
2920 2 27 ASP H 2 27 ASP QB 2.900 . 2.900 2.461 2.240 2.632 . 0 0 "[ . 1 . 2 . 3 ]" 1
2921 2 27 ASP QB 2 29 ASP H 3.460 . 3.460 2.784 2.459 3.621 0.161 21 0 "[ . 1 . 2 . 3 ]" 1
2922 2 27 ASP QB 2 30 LYS H 3.790 . 3.790 2.544 1.946 3.750 . 0 0 "[ . 1 . 2 . 3 ]" 1
2923 2 27 ASP QB 2 30 LYS HG2 4.510 . 4.510 2.470 1.946 3.293 . 0 0 "[ . 1 . 2 . 3 ]" 1
2924 2 27 ASP QB 2 30 LYS HG3 4.490 . 4.490 3.096 2.299 3.905 . 0 0 "[ . 1 . 2 . 3 ]" 1
2925 2 28 HIS HA 2 32 LEU QD 5.390 . 5.390 4.330 4.073 4.617 . 0 0 "[ . 1 . 2 . 3 ]" 1
2926 2 28 HIS QB 2 29 ASP H 3.160 . 3.160 2.729 2.283 3.285 0.125 18 0 "[ . 1 . 2 . 3 ]" 1
2927 2 28 HIS QB 2 31 VAL MG2 4.870 . 4.870 4.225 3.765 4.674 . 0 0 "[ . 1 . 2 . 3 ]" 1
2928 2 29 ASP H 2 29 ASP QB 2.870 . 2.870 2.369 2.157 2.639 . 0 0 "[ . 1 . 2 . 3 ]" 1
2929 2 29 ASP H 2 32 LEU QD 5.440 . 5.440 4.255 3.912 4.621 . 0 0 "[ . 1 . 2 . 3 ]" 1
2930 2 29 ASP H 2 33 LEU QD 5.440 . 5.440 5.427 4.894 5.534 0.094 27 0 "[ . 1 . 2 . 3 ]" 1
2931 2 29 ASP HA 2 32 LEU QB 3.670 . 3.670 2.705 2.296 2.933 . 0 0 "[ . 1 . 2 . 3 ]" 1
2932 2 29 ASP HA 2 32 LEU QD 3.970 . 3.970 2.333 1.971 2.744 . 0 0 "[ . 1 . 2 . 3 ]" 1
2933 2 29 ASP QB 2 30 LYS H 3.370 . 3.370 2.778 2.319 3.440 0.070 24 0 "[ . 1 . 2 . 3 ]" 1
2934 2 29 ASP QB 2 30 LYS HG2 5.340 . 5.340 3.705 2.981 4.524 . 0 0 "[ . 1 . 2 . 3 ]" 1
2935 2 29 ASP QB 2 32 LEU QD 4.510 . 4.510 3.795 3.378 4.199 . 0 0 "[ . 1 . 2 . 3 ]" 1
2936 2 29 ASP QB 2 33 LEU HG 5.340 . 5.340 3.908 2.889 5.360 0.020 7 0 "[ . 1 . 2 . 3 ]" 1
2937 2 29 ASP QB 2 33 LEU QD 4.390 . 4.390 3.228 2.503 3.916 . 0 0 "[ . 1 . 2 . 3 ]" 1
2938 2 30 LYS H 2 32 LEU QB 5.340 . 5.340 4.981 4.804 5.128 . 0 0 "[ . 1 . 2 . 3 ]" 1
2939 2 30 LYS H 2 33 LEU QD 4.640 . 4.640 4.332 4.055 4.597 . 0 0 "[ . 1 . 2 . 3 ]" 1
2940 2 30 LYS HA 2 30 LYS QE 4.730 . 4.730 3.962 1.855 4.366 . 0 0 "[ . 1 . 2 . 3 ]" 1
2941 2 30 LYS HA 2 33 LEU QD 3.520 . 3.520 2.850 2.278 3.257 . 0 0 "[ . 1 . 2 . 3 ]" 1
2942 2 30 LYS HB3 2 30 LYS QE 4.810 . 4.810 4.035 3.285 4.316 . 0 0 "[ . 1 . 2 . 3 ]" 1
2943 2 30 LYS QE 2 30 LYS HG2 3.250 . 3.250 2.686 2.328 3.080 . 0 0 "[ . 1 . 2 . 3 ]" 1
2944 2 30 LYS HG2 2 33 LEU QD 4.460 . 4.460 4.303 3.363 4.504 0.044 7 0 "[ . 1 . 2 . 3 ]" 1
2945 2 30 LYS QE 2 30 LYS HG3 3.600 . 3.600 2.667 2.349 3.582 . 0 0 "[ . 1 . 2 . 3 ]" 1
2946 2 30 LYS HD3 2 33 LEU QD 5.440 . 5.440 3.303 2.472 4.707 . 0 0 "[ . 1 . 2 . 3 ]" 1
2947 2 30 LYS QE 2 33 LEU QD 4.700 . 4.700 4.068 2.099 4.777 0.077 11 0 "[ . 1 . 2 . 3 ]" 1
2948 2 31 VAL H 2 32 LEU QB 4.960 . 4.960 4.688 4.503 4.884 . 0 0 "[ . 1 . 2 . 3 ]" 1
2949 2 31 VAL H 2 32 LEU QD 4.550 . 4.550 4.605 4.567 4.697 0.147 15 0 "[ . 1 . 2 . 3 ]" 1
2950 2 31 VAL HB 2 32 LEU QD 4.110 . 4.110 3.395 3.156 3.683 . 0 0 "[ . 1 . 2 . 3 ]" 1
2951 2 32 LEU H 2 32 LEU QB 2.960 . 2.960 2.493 2.448 2.535 . 0 0 "[ . 1 . 2 . 3 ]" 1
2952 2 32 LEU H 2 32 LEU QD 3.440 . 3.440 2.923 2.826 3.059 . 0 0 "[ . 1 . 2 . 3 ]" 1
2953 2 32 LEU HA 2 36 ARG QB 5.270 . 5.270 4.876 4.545 5.314 0.044 24 0 "[ . 1 . 2 . 3 ]" 1
2954 2 32 LEU HA 2 36 ARG QG 5.250 . 5.250 4.401 3.573 4.965 . 0 0 "[ . 1 . 2 . 3 ]" 1
2955 2 32 LEU HA 2 36 ARG QD 4.490 . 4.490 4.521 4.298 4.674 0.184 32 0 "[ . 1 . 2 . 3 ]" 1
2956 2 32 LEU QB 2 32 LEU QD 2.820 . 2.820 1.945 1.922 1.961 . 0 0 "[ . 1 . 2 . 3 ]" 1
2957 2 32 LEU QB 2 33 LEU H 3.560 . 3.560 2.333 2.179 2.489 . 0 0 "[ . 1 . 2 . 3 ]" 1
2958 2 32 LEU QB 2 33 LEU QD 4.190 . 4.190 3.321 2.521 3.730 . 0 0 "[ . 1 . 2 . 3 ]" 1
2959 2 32 LEU QB 2 36 ARG H 5.340 . 5.340 4.928 4.714 5.135 . 0 0 "[ . 1 . 2 . 3 ]" 1
2960 2 32 LEU QB 2 36 ARG QD 3.980 . 3.980 3.523 3.299 3.682 . 0 0 "[ . 1 . 2 . 3 ]" 1
2961 2 32 LEU QD 2 33 LEU H 4.600 . 4.600 3.939 3.829 4.028 . 0 0 "[ . 1 . 2 . 3 ]" 1
2962 2 33 LEU H 2 33 LEU QD 3.480 . 3.480 2.971 2.144 3.148 . 0 0 "[ . 1 . 2 . 3 ]" 1
2963 2 33 LEU HA 2 33 LEU QD 2.990 . 2.990 2.083 1.974 2.427 . 0 0 "[ . 1 . 2 . 3 ]" 1
2964 2 33 LEU HA 2 36 ARG QG 3.470 . 3.470 2.471 2.124 3.486 0.016 2 0 "[ . 1 . 2 . 3 ]" 1
2965 2 33 LEU HA 2 36 ARG QD 3.650 . 3.650 2.338 1.930 2.725 . 0 0 "[ . 1 . 2 . 3 ]" 1
2966 2 33 LEU HB2 2 33 LEU QD 3.040 . 3.040 2.252 2.094 2.302 . 0 0 "[ . 1 . 2 . 3 ]" 1
2967 2 33 LEU HB3 2 33 LEU QD 2.920 . 2.920 2.140 2.083 2.417 . 0 0 "[ . 1 . 2 . 3 ]" 1
2968 2 33 LEU HB3 2 37 ASP QB 5.340 . 5.340 4.288 3.993 4.573 . 0 0 "[ . 1 . 2 . 3 ]" 1
2969 2 33 LEU QD 2 34 PHE H 4.330 . 4.330 4.038 3.890 4.169 . 0 0 "[ . 1 . 2 . 3 ]" 1
2970 2 33 LEU QD 2 36 ARG QD 4.010 . 4.010 2.422 2.027 2.959 . 0 0 "[ . 1 . 2 . 3 ]" 1
2971 2 33 LEU MD2 2 36 ARG HD2 6.100 . 6.100 3.454 2.352 6.111 0.011 7 0 "[ . 1 . 2 . 3 ]" 1
2972 2 34 PHE HA 2 37 ASP QB 3.760 . 3.760 3.078 2.787 3.328 . 0 0 "[ . 1 . 2 . 3 ]" 1
2973 2 34 PHE HB2 2 37 ASP QB 5.340 . 5.340 5.199 4.908 5.379 0.039 9 0 "[ . 1 . 2 . 3 ]" 1
2974 2 34 PHE QD 2 38 LEU QD 4.600 . 4.600 3.437 3.309 3.702 . 0 0 "[ . 1 . 2 . 3 ]" 1
2975 2 34 PHE QE 2 38 LEU QD 3.790 . 3.790 2.410 2.255 2.708 . 0 0 "[ . 1 . 2 . 3 ]" 1
2976 2 34 PHE HZ 2 38 LEU QD 3.770 . 3.770 2.568 1.986 2.860 . 0 0 "[ . 1 . 2 . 3 ]" 1
2977 2 35 SER H 2 35 SER QB 3.140 . 3.140 2.578 2.536 2.627 . 0 0 "[ . 1 . 2 . 3 ]" 1
2978 2 35 SER H 2 36 ARG QB 5.340 . 5.340 4.972 4.574 5.242 . 0 0 "[ . 1 . 2 . 3 ]" 1
2979 2 35 SER H 2 36 ARG QG 5.030 . 5.030 4.156 3.814 4.376 . 0 0 "[ . 1 . 2 . 3 ]" 1
2980 2 35 SER HA 2 38 LEU QB 4.020 . 4.020 2.534 2.283 2.985 . 0 0 "[ . 1 . 2 . 3 ]" 1
2981 2 35 SER HA 2 38 LEU QD 4.170 . 4.170 2.948 2.504 3.599 . 0 0 "[ . 1 . 2 . 3 ]" 1
2982 2 35 SER QB 2 36 ARG H 3.920 . 3.920 3.415 3.272 3.538 . 0 0 "[ . 1 . 2 . 3 ]" 1
2983 2 35 SER QB 2 36 ARG QG 5.180 . 5.180 4.820 4.048 5.220 0.040 18 0 "[ . 1 . 2 . 3 ]" 1
2984 2 36 ARG H 2 36 ARG QB 2.950 . 2.950 2.569 2.253 2.769 . 0 0 "[ . 1 . 2 . 3 ]" 1
2985 2 36 ARG H 2 36 ARG QG 3.380 . 3.380 2.109 1.879 2.362 . 0 0 "[ . 1 . 2 . 3 ]" 1
2986 2 36 ARG H 2 36 ARG QD 4.200 . 4.200 3.643 3.519 3.737 . 0 0 "[ . 1 . 2 . 3 ]" 1
2987 2 36 ARG H 2 37 ASP QB 4.840 . 4.840 4.414 4.179 4.597 . 0 0 "[ . 1 . 2 . 3 ]" 1
2988 2 36 ARG H 2 38 LEU QB 5.340 . 5.340 4.593 4.345 4.981 . 0 0 "[ . 1 . 2 . 3 ]" 1
2989 2 36 ARG HA 2 36 ARG QG 3.700 . 3.700 3.182 2.389 3.378 . 0 0 "[ . 1 . 2 . 3 ]" 1
2990 2 36 ARG HA 2 36 ARG QD 4.700 . 4.700 4.395 4.024 4.562 . 0 0 "[ . 1 . 2 . 3 ]" 1
2991 2 36 ARG QB 2 36 ARG QD 3.040 . 3.040 2.269 2.083 2.400 . 0 0 "[ . 1 . 2 . 3 ]" 1
2992 2 36 ARG QB 2 37 ASP H 3.700 . 3.700 3.314 2.189 3.708 0.008 29 0 "[ . 1 . 2 . 3 ]" 1
2993 2 36 ARG QB 2 37 ASP QB 4.760 . 4.760 4.515 3.398 4.853 0.093 12 0 "[ . 1 . 2 . 3 ]" 1
2994 2 36 ARG QG 2 37 ASP H 4.740 . 4.740 2.682 1.898 3.970 . 0 0 "[ . 1 . 2 . 3 ]" 1
2995 2 36 ARG QG 2 37 ASP QB 5.180 . 5.180 3.588 2.979 5.281 0.101 21 0 "[ . 1 . 2 . 3 ]" 1
2996 2 37 ASP H 2 37 ASP QB 3.030 . 3.030 2.247 2.125 2.353 . 0 0 "[ . 1 . 2 . 3 ]" 1
2997 2 37 ASP HA 2 40 LYS QB 3.380 . 3.380 2.789 2.065 3.498 0.118 21 0 "[ . 1 . 2 . 3 ]" 1
2998 2 37 ASP HA 2 40 LYS QG 4.270 . 4.270 3.216 1.921 4.339 0.069 26 0 "[ . 1 . 2 . 3 ]" 1
2999 2 37 ASP HA 2 40 LYS QD 4.180 . 4.180 2.707 1.817 4.164 . 0 0 "[ . 1 . 2 . 3 ]" 1
3000 2 37 ASP QB 2 38 LEU H 3.560 . 3.560 2.588 2.290 2.992 . 0 0 "[ . 1 . 2 . 3 ]" 1
3001 2 38 LEU H 2 38 LEU QB 3.060 . 3.060 2.157 2.051 2.269 . 0 0 "[ . 1 . 2 . 3 ]" 1
3002 2 38 LEU HA 2 38 LEU QD 3.040 . 3.040 2.342 2.194 3.070 0.030 2 0 "[ . 1 . 2 . 3 ]" 1
3003 2 38 LEU QB 2 39 ASP H 3.540 . 3.540 2.537 2.316 2.872 . 0 0 "[ . 1 . 2 . 3 ]" 1
3004 2 38 LEU HG 2 41 LEU QD 5.310 . 5.310 4.991 2.828 5.361 0.051 20 0 "[ . 1 . 2 . 3 ]" 1
3005 2 38 LEU QD 2 39 ASP H 4.150 . 4.150 3.710 3.391 3.896 . 0 0 "[ . 1 . 2 . 3 ]" 1
3006 2 38 LEU QD 2 41 LEU H 4.710 . 4.710 4.356 4.087 4.631 . 0 0 "[ . 1 . 2 . 3 ]" 1
3007 2 38 LEU QD 2 41 LEU HB2 5.350 . 5.350 4.239 3.648 4.884 . 0 0 "[ . 1 . 2 . 3 ]" 1
3008 2 38 LEU QD 2 41 LEU HB3 3.900 . 3.900 3.056 2.564 3.689 . 0 0 "[ . 1 . 2 . 3 ]" 1
3009 2 38 LEU QD 2 41 LEU HG 5.440 . 5.440 4.353 3.653 5.467 0.027 29 0 "[ . 1 . 2 . 3 ]" 1
3010 2 38 LEU QD 2 42 ILE H 4.130 . 4.130 3.691 3.340 4.043 . 0 0 "[ . 1 . 2 . 3 ]" 1
3011 2 38 LEU QD 2 42 ILE HA 5.240 . 5.240 4.718 4.479 4.977 . 0 0 "[ . 1 . 2 . 3 ]" 1
3012 2 38 LEU QD 2 42 ILE HG12 3.700 . 3.700 3.340 3.125 3.540 . 0 0 "[ . 1 . 2 . 3 ]" 1
3013 2 38 LEU QD 2 42 ILE HG13 3.640 . 3.640 2.400 2.178 2.675 . 0 0 "[ . 1 . 2 . 3 ]" 1
3014 2 38 LEU QD 2 42 ILE MD 3.050 . 3.050 2.207 1.944 2.502 . 0 0 "[ . 1 . 2 . 3 ]" 1
3015 2 39 ASP H 2 40 LYS QB 4.830 . 4.830 4.547 3.983 4.835 0.005 13 0 "[ . 1 . 2 . 3 ]" 1
3016 2 39 ASP HB2 2 43 ASN QD 5.140 . 5.140 4.578 4.191 4.970 . 0 0 "[ . 1 . 2 . 3 ]" 1
3017 2 39 ASP HB3 2 40 LYS QB 4.610 . 4.610 4.274 3.481 4.648 0.038 29 0 "[ . 1 . 2 . 3 ]" 1
3018 2 39 ASP HB3 2 43 ASN QD 4.380 . 4.380 3.993 3.369 4.396 0.016 31 0 "[ . 1 . 2 . 3 ]" 1
3019 2 40 LYS H 2 40 LYS QB 2.910 . 2.910 2.322 1.882 2.549 . 0 0 "[ . 1 . 2 . 3 ]" 1
3020 2 40 LYS H 2 40 LYS QG 3.510 . 3.510 2.654 2.157 3.688 0.178 17 0 "[ . 1 . 2 . 3 ]" 1
3021 2 40 LYS H 2 40 LYS QD 4.760 . 4.760 3.862 2.167 4.387 . 0 0 "[ . 1 . 2 . 3 ]" 1
3022 2 40 LYS HA 2 40 LYS QD 4.880 . 4.880 4.079 2.416 4.325 . 0 0 "[ . 1 . 2 . 3 ]" 1
3023 2 40 LYS HA 2 43 ASN QD 3.970 . 3.970 2.857 2.080 3.311 . 0 0 "[ . 1 . 2 . 3 ]" 1
3024 2 40 LYS QB 2 41 LEU H 3.460 . 3.460 2.663 2.196 3.504 0.044 13 0 "[ . 1 . 2 . 3 ]" 1
3025 2 40 LYS QB 2 41 LEU HB2 5.190 . 5.190 4.278 3.629 5.237 0.047 21 0 "[ . 1 . 2 . 3 ]" 1
3026 2 40 LYS QG 2 41 LEU H 5.190 . 5.190 3.639 2.164 4.686 . 0 0 "[ . 1 . 2 . 3 ]" 1
3027 2 41 LEU H 2 41 LEU QD 3.900 . 3.900 3.730 3.575 3.808 . 0 0 "[ . 1 . 2 . 3 ]" 1
3028 2 41 LEU HA 2 41 LEU QD 2.980 . 2.980 2.206 2.011 2.863 . 0 0 "[ . 1 . 2 . 3 ]" 1
3029 2 41 LEU HA 2 44 LYS QD 4.240 . 4.240 3.434 2.762 4.035 . 0 0 "[ . 1 . 2 . 3 ]" 1
3030 2 41 LEU HA 2 44 LYS QE 4.230 . 4.230 2.496 1.929 3.391 . 0 0 "[ . 1 . 2 . 3 ]" 1
3031 2 41 LEU QD 2 42 ILE H 3.890 . 3.890 3.766 3.272 3.933 0.043 11 0 "[ . 1 . 2 . 3 ]" 1
3032 2 41 LEU QD 2 42 ILE HA 5.370 . 5.370 3.924 3.002 4.262 . 0 0 "[ . 1 . 2 . 3 ]" 1
3033 2 41 LEU QD 2 44 LYS H 4.960 . 4.960 4.585 4.194 4.819 . 0 0 "[ . 1 . 2 . 3 ]" 1
3034 2 41 LEU QD 2 44 LYS HB3 3.760 . 3.760 3.121 2.488 3.413 . 0 0 "[ . 1 . 2 . 3 ]" 1
3035 2 41 LEU QD 2 44 LYS QD 3.530 . 3.530 2.679 2.069 3.599 0.069 21 0 "[ . 1 . 2 . 3 ]" 1
3036 2 41 LEU QD 2 44 LYS QE 3.810 . 3.810 2.969 1.932 3.821 0.011 13 0 "[ . 1 . 2 . 3 ]" 1
3037 2 41 LEU QD 2 45 PHE HA 5.440 . 5.440 5.418 5.079 5.518 0.078 28 0 "[ . 1 . 2 . 3 ]" 1
3038 2 41 LEU QD 2 45 PHE HB2 4.790 . 4.790 4.212 3.540 4.545 . 0 0 "[ . 1 . 2 . 3 ]" 1
3039 2 41 LEU QD 2 45 PHE QD 3.040 . 3.040 2.469 2.141 2.654 . 0 0 "[ . 1 . 2 . 3 ]" 1
3040 2 41 LEU QD 2 45 PHE QE 4.190 . 4.190 2.230 1.966 3.211 . 0 0 "[ . 1 . 2 . 3 ]" 1
3041 2 42 ILE HA 2 46 MET QG 4.570 . 4.570 3.542 3.229 3.750 . 0 0 "[ . 1 . 2 . 3 ]" 1
3042 2 42 ILE MG 2 46 MET QG 3.240 . 3.240 2.077 1.844 2.307 . 0 0 "[ . 1 . 2 . 3 ]" 1
3043 2 43 ASN H 2 46 MET QG 4.660 . 4.660 3.900 3.780 4.418 . 0 0 "[ . 1 . 2 . 3 ]" 1
3044 2 43 ASN HA 2 43 ASN QD 4.550 . 4.550 3.855 3.421 4.102 . 0 0 "[ . 1 . 2 . 3 ]" 1
3045 2 43 ASN HA 2 46 MET QG 4.030 . 4.030 2.668 2.291 3.477 . 0 0 "[ . 1 . 2 . 3 ]" 1
3046 2 43 ASN HA 2 48 VAL QG 4.320 . 4.320 3.080 2.257 4.323 0.003 1 0 "[ . 1 . 2 . 3 ]" 1
3047 2 43 ASN HB2 2 43 ASN QD 3.400 . 3.400 2.211 2.160 2.271 . 0 0 "[ . 1 . 2 . 3 ]" 1
3048 2 44 LYS H 2 44 LYS QD 4.730 . 4.730 4.653 4.491 4.730 0.000 6 0 "[ . 1 . 2 . 3 ]" 1
3049 2 44 LYS H 2 44 LYS QE 4.800 . 4.800 4.089 3.855 4.392 . 0 0 "[ . 1 . 2 . 3 ]" 1
3050 2 44 LYS HA 2 44 LYS QD 4.910 . 4.910 4.270 3.985 4.338 . 0 0 "[ . 1 . 2 . 3 ]" 1
3051 2 44 LYS HA 2 44 LYS QE 5.340 . 5.340 4.190 3.884 4.475 . 0 0 "[ . 1 . 2 . 3 ]" 1
3052 2 44 LYS HB2 2 44 LYS QD 3.480 . 3.480 2.985 2.281 3.140 . 0 0 "[ . 1 . 2 . 3 ]" 1
3053 2 44 LYS HB2 2 44 LYS QE 4.090 . 4.090 2.126 1.930 2.907 . 0 0 "[ . 1 . 2 . 3 ]" 1
3054 2 44 LYS HB3 2 44 LYS QE 4.100 . 4.100 2.688 2.059 2.976 . 0 0 "[ . 1 . 2 . 3 ]" 1
3055 2 44 LYS QE 2 44 LYS HG3 3.140 . 3.140 2.686 2.378 3.237 0.097 21 0 "[ . 1 . 2 . 3 ]" 1
3056 2 44 LYS QD 2 45 PHE H 4.590 . 4.590 4.194 3.776 4.664 0.074 21 0 "[ . 1 . 2 . 3 ]" 1
3057 2 44 LYS QD 2 45 PHE QD 4.170 . 4.170 3.045 2.392 4.261 0.091 21 0 "[ . 1 . 2 . 3 ]" 1
3058 2 44 LYS QE 2 45 PHE H 5.340 . 5.340 4.822 3.562 5.243 . 0 0 "[ . 1 . 2 . 3 ]" 1
3059 2 44 LYS QE 2 45 PHE QD 4.840 . 4.840 4.276 2.432 4.767 . 0 0 "[ . 1 . 2 . 3 ]" 1
3060 2 46 MET HA 2 46 MET QG 3.450 . 3.450 2.619 2.399 3.012 . 0 0 "[ . 1 . 2 . 3 ]" 1
3061 2 47 ASN H 2 48 VAL QG 4.470 . 4.470 3.609 2.980 4.066 . 0 0 "[ . 1 . 2 . 3 ]" 1
3062 2 47 ASN HA 2 47 ASN QD 4.410 . 4.410 3.576 1.896 4.109 . 0 0 "[ . 1 . 2 . 3 ]" 1
3063 2 48 VAL H 2 48 VAL QG 2.990 . 2.990 2.173 1.901 2.656 . 0 0 "[ . 1 . 2 . 3 ]" 1
3064 2 48 VAL H 2 49 LYS QG 4.340 . 4.340 4.247 3.549 4.562 0.222 2 0 "[ . 1 . 2 . 3 ]" 1
3065 2 48 VAL HA 2 48 VAL QG 2.830 . 2.830 2.215 2.136 2.396 . 0 0 "[ . 1 . 2 . 3 ]" 1
3066 2 48 VAL HA 2 49 LYS QB 4.700 . 4.700 4.288 4.102 4.509 . 0 0 "[ . 1 . 2 . 3 ]" 1
3067 2 48 VAL HA 2 49 LYS QG 4.570 . 4.570 3.596 3.048 4.039 . 0 0 "[ . 1 . 2 . 3 ]" 1
3068 2 48 VAL HB 2 49 LYS QG 5.340 . 5.340 5.182 4.578 5.406 0.066 20 0 "[ . 1 . 2 . 3 ]" 1
3069 2 48 VAL QG 2 49 LYS H 3.490 . 3.490 3.245 2.344 3.542 0.052 10 0 "[ . 1 . 2 . 3 ]" 1
3070 2 48 VAL QG 2 49 LYS HA 4.450 . 4.450 3.890 2.955 4.329 . 0 0 "[ . 1 . 2 . 3 ]" 1
3071 2 48 VAL QG 2 50 ASP H 4.160 . 4.160 3.159 1.893 4.169 0.009 28 0 "[ . 1 . 2 . 3 ]" 1
3072 2 49 LYS H 2 49 LYS QB 3.130 . 3.130 2.617 2.343 3.267 0.137 18 0 "[ . 1 . 2 . 3 ]" 1
3073 2 49 LYS H 2 49 LYS QG 3.750 . 3.750 2.539 1.862 3.125 . 0 0 "[ . 1 . 2 . 3 ]" 1
3074 2 49 LYS HA 2 49 LYS QG 3.620 . 3.620 2.709 2.338 3.380 . 0 0 "[ . 1 . 2 . 3 ]" 1
3075 2 49 LYS HA 2 49 LYS QD 4.730 . 4.730 3.838 1.937 4.564 . 0 0 "[ . 1 . 2 . 3 ]" 1
3076 2 49 LYS QB 2 49 LYS QD 3.280 . 3.280 2.270 2.083 2.746 . 0 0 "[ . 1 . 2 . 3 ]" 1
3077 2 50 ASP H 2 50 ASP QB 2.910 . 2.910 2.558 2.163 2.999 0.089 1 0 "[ . 1 . 2 . 3 ]" 1
3078 2 50 ASP QB 2 51 LYS H 4.210 . 4.210 3.414 2.420 4.029 . 0 0 "[ . 1 . 2 . 3 ]" 1
3079 2 50 ASP QB 2 52 VAL H 4.420 . 4.420 3.272 2.154 4.438 0.018 4 0 "[ . 1 . 2 . 3 ]" 1
3080 2 50 ASP QB 2 52 VAL QG 3.820 . 3.820 2.692 1.804 3.844 0.024 20 0 "[ . 1 . 2 . 3 ]" 1
3081 2 51 LYS H 2 51 LYS QG 3.260 . 3.260 2.066 1.767 3.166 . 0 0 "[ . 1 . 2 . 3 ]" 1
3082 2 51 LYS H 2 51 LYS QD 4.770 . 4.770 3.956 3.626 4.884 0.114 29 0 "[ . 1 . 2 . 3 ]" 1
3083 2 51 LYS H 2 52 VAL QG 3.930 . 3.930 3.063 2.386 3.852 . 0 0 "[ . 1 . 2 . 3 ]" 1
3084 2 51 LYS HA 2 52 VAL QG 4.680 . 4.680 4.110 3.587 4.293 . 0 0 "[ . 1 . 2 . 3 ]" 1
3085 2 51 LYS HB2 2 51 LYS QD 3.370 . 3.370 2.564 2.246 3.098 . 0 0 "[ . 1 . 2 . 3 ]" 1
3086 2 51 LYS QG 2 52 VAL H 4.000 . 4.000 3.471 2.873 3.961 . 0 0 "[ . 1 . 2 . 3 ]" 1
3087 2 52 VAL H 2 52 VAL QG 3.110 . 3.110 1.956 1.818 2.183 . 0 0 "[ . 1 . 2 . 3 ]" 1
3088 2 52 VAL QG 2 53 HIS H 4.520 . 4.520 3.217 2.337 3.784 . 0 0 "[ . 1 . 2 . 3 ]" 1
3089 2 53 HIS QB 2 54 LYS H 4.250 . 4.250 3.178 2.012 3.998 . 0 0 "[ . 1 . 2 . 3 ]" 1
3090 2 54 LYS H 2 54 LYS QB 3.650 . 3.650 2.666 2.233 3.438 . 0 0 "[ . 1 . 2 . 3 ]" 1
3091 2 54 LYS H 2 54 LYS QG 4.990 . 4.990 3.186 2.062 4.305 . 0 0 "[ . 1 . 2 . 3 ]" 1
3092 2 54 LYS HA 2 54 LYS QE 4.570 . 4.570 4.243 1.744 4.637 0.067 13 0 "[ . 1 . 2 . 3 ]" 1
3093 2 54 LYS QB 2 55 LEU H 4.190 . 4.190 3.279 1.962 4.026 . 0 0 "[ . 1 . 2 . 3 ]" 1
3094 2 54 LYS QG 2 55 LEU H 4.560 . 4.560 3.733 2.262 4.657 0.097 32 0 "[ . 1 . 2 . 3 ]" 1
3095 2 55 LEU H 2 55 LEU QB 2.980 . 2.980 2.560 2.106 3.124 0.144 27 0 "[ . 1 . 2 . 3 ]" 1
3096 2 55 LEU HA 2 55 LEU QD 3.410 . 3.410 2.588 1.959 3.439 0.029 29 0 "[ . 1 . 2 . 3 ]" 1
3097 2 55 LEU QB 2 56 GLU H 3.640 . 3.640 3.025 1.820 3.779 0.139 8 0 "[ . 1 . 2 . 3 ]" 1
3098 2 55 LEU QD 2 56 GLU H 4.430 . 4.430 3.738 3.076 4.439 0.009 24 0 "[ . 1 . 2 . 3 ]" 1
3099 2 56 GLU H 2 56 GLU QB 3.410 . 3.410 2.578 2.067 3.421 0.011 6 0 "[ . 1 . 2 . 3 ]" 1
3100 2 56 GLU H 2 56 GLU QG 4.650 . 4.650 3.305 2.008 4.531 . 0 0 "[ . 1 . 2 . 3 ]" 1
3101 2 57 HIS QB 2 58 HIS H 4.380 . 4.380 2.733 1.756 3.816 . 0 0 "[ . 1 . 2 . 3 ]" 1
3102 2 57 HIS QB 2 58 HIS HA 4.240 . 4.240 4.190 3.879 4.362 0.122 4 0 "[ . 1 . 2 . 3 ]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 112
_Distance_constraint_stats_list.Viol_count 168
_Distance_constraint_stats_list.Viol_total 446.525
_Distance_constraint_stats_list.Viol_max 0.316
_Distance_constraint_stats_list.Viol_rms 0.0250
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0039
_Distance_constraint_stats_list.Viol_average_violations_only 0.0831
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 5 GLN 0.686 0.296 19 0 "[ . 1 . 2 . 3 ]"
1 6 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 7 LYS 0.010 0.010 25 0 "[ . 1 . 2 . 3 ]"
1 8 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 9 LYS 0.686 0.296 19 0 "[ . 1 . 2 . 3 ]"
1 10 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 11 GLU 0.010 0.010 25 0 "[ . 1 . 2 . 3 ]"
1 12 ASN 0.019 0.010 5 0 "[ . 1 . 2 . 3 ]"
1 13 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 14 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 15 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 16 GLU 3.162 0.257 17 0 "[ . 1 . 2 . 3 ]"
1 17 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 18 ILE 0.011 0.007 20 0 "[ . 1 . 2 . 3 ]"
1 19 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 20 LEU 3.143 0.257 17 0 "[ . 1 . 2 . 3 ]"
1 21 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 22 ALA 0.011 0.007 20 0 "[ . 1 . 2 . 3 ]"
1 23 ARG 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 28 HIS 0.379 0.133 31 0 "[ . 1 . 2 . 3 ]"
1 29 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 30 LYS 0.004 0.004 20 0 "[ . 1 . 2 . 3 ]"
1 31 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 32 LEU 0.566 0.133 31 0 "[ . 1 . 2 . 3 ]"
1 33 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 34 PHE 0.004 0.004 20 0 "[ . 1 . 2 . 3 ]"
1 35 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 36 ARG 1.185 0.222 17 0 "[ . 1 . 2 . 3 ]"
1 37 ASP 0.297 0.261 16 0 "[ . 1 . 2 . 3 ]"
1 38 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 39 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 40 LYS 1.071 0.222 17 0 "[ . 1 . 2 . 3 ]"
1 41 LEU 0.297 0.261 16 0 "[ . 1 . 2 . 3 ]"
1 42 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 43 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 44 LYS 0.072 0.072 3 0 "[ . 1 . 2 . 3 ]"
2 5 GLN 0.395 0.142 13 0 "[ . 1 . 2 . 3 ]"
2 6 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
2 7 LYS 0.006 0.006 9 0 "[ . 1 . 2 . 3 ]"
2 8 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
2 9 LYS 0.404 0.142 13 0 "[ . 1 . 2 . 3 ]"
2 10 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
2 11 GLU 0.006 0.006 9 0 "[ . 1 . 2 . 3 ]"
2 12 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
2 13 LYS 0.009 0.009 18 0 "[ . 1 . 2 . 3 ]"
2 14 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
2 15 LYS 0.040 0.040 15 0 "[ . 1 . 2 . 3 ]"
2 16 GLU 5.664 0.316 26 0 "[ . 1 . 2 . 3 ]"
2 17 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
2 18 ILE 0.008 0.007 1 0 "[ . 1 . 2 . 3 ]"
2 19 GLN 0.385 0.164 30 0 "[ . 1 . 2 . 3 ]"
2 20 LEU 5.664 0.316 26 0 "[ . 1 . 2 . 3 ]"
2 21 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
2 22 ALA 0.008 0.007 1 0 "[ . 1 . 2 . 3 ]"
2 23 ARG 0.344 0.164 30 0 "[ . 1 . 2 . 3 ]"
2 28 HIS 0.408 0.127 4 0 "[ . 1 . 2 . 3 ]"
2 29 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
2 30 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
2 31 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
2 32 LEU 0.699 0.127 4 0 "[ . 1 . 2 . 3 ]"
2 33 LEU 0.026 0.022 28 0 "[ . 1 . 2 . 3 ]"
2 34 PHE 0.001 0.001 32 0 "[ . 1 . 2 . 3 ]"
2 35 SER 0.048 0.048 32 0 "[ . 1 . 2 . 3 ]"
2 36 ARG 0.749 0.106 29 0 "[ . 1 . 2 . 3 ]"
2 37 ASP 0.463 0.144 11 0 "[ . 1 . 2 . 3 ]"
2 38 LEU 0.001 0.001 32 0 "[ . 1 . 2 . 3 ]"
2 39 ASP 0.048 0.048 32 0 "[ . 1 . 2 . 3 ]"
2 40 LYS 0.467 0.106 29 0 "[ . 1 . 2 . 3 ]"
2 41 LEU 0.437 0.144 11 0 "[ . 1 . 2 . 3 ]"
2 42 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
2 43 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
2 44 LYS 0.010 0.010 18 0 "[ . 1 . 2 . 3 ]"
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 5 GLN O 1 9 LYS N 3.000 2.700 3.300 2.981 2.770 3.320 0.020 19 0 "[ . 1 . 2 . 3 ]" 2
2 1 5 GLN O 1 9 LYS H 2.000 . 2.300 2.089 1.886 2.596 0.296 19 0 "[ . 1 . 2 . 3 ]" 2
3 1 6 LEU O 1 10 ILE N 3.000 2.700 3.300 2.948 2.795 3.095 . 0 0 "[ . 1 . 2 . 3 ]" 2
4 1 6 LEU O 1 10 ILE H 2.000 . 2.300 2.006 1.861 2.218 . 0 0 "[ . 1 . 2 . 3 ]" 2
5 1 7 LYS O 1 11 GLU N 3.000 2.700 3.300 2.809 2.690 2.924 0.010 25 0 "[ . 1 . 2 . 3 ]" 2
6 1 7 LYS O 1 11 GLU H 2.000 . 2.300 1.846 1.714 1.956 . 0 0 "[ . 1 . 2 . 3 ]" 2
7 1 8 ASN O 1 12 ASN N 3.000 2.700 3.300 2.924 2.734 3.161 . 0 0 "[ . 1 . 2 . 3 ]" 2
8 1 8 ASN O 1 12 ASN H 2.000 . 2.300 1.970 1.768 2.206 . 0 0 "[ . 1 . 2 . 3 ]" 2
9 1 9 LYS O 1 13 LYS N 3.000 2.700 3.300 2.811 2.706 2.913 . 0 0 "[ . 1 . 2 . 3 ]" 2
10 1 9 LYS O 1 13 LYS H 2.000 . 2.300 1.868 1.759 1.962 . 0 0 "[ . 1 . 2 . 3 ]" 2
11 1 10 ILE O 1 14 LYS N 3.000 2.700 3.300 2.833 2.718 2.950 . 0 0 "[ . 1 . 2 . 3 ]" 2
12 1 10 ILE O 1 14 LYS H 2.000 . 2.300 1.880 1.765 1.995 . 0 0 "[ . 1 . 2 . 3 ]" 2
13 1 11 GLU O 1 15 LYS N 3.000 2.700 3.300 2.847 2.740 2.938 . 0 0 "[ . 1 . 2 . 3 ]" 2
14 1 11 GLU O 1 15 LYS H 2.000 . 2.300 1.914 1.816 2.010 . 0 0 "[ . 1 . 2 . 3 ]" 2
15 1 12 ASN O 1 16 GLU N 3.000 2.700 3.300 2.829 2.690 3.122 0.010 5 0 "[ . 1 . 2 . 3 ]" 2
16 1 12 ASN O 1 16 GLU H 2.000 . 2.300 1.901 1.740 2.229 . 0 0 "[ . 1 . 2 . 3 ]" 2
17 1 13 LYS O 1 17 LEU N 3.000 2.700 3.300 2.986 2.859 3.115 . 0 0 "[ . 1 . 2 . 3 ]" 2
18 1 13 LYS O 1 17 LEU H 2.000 . 2.300 2.093 1.940 2.239 . 0 0 "[ . 1 . 2 . 3 ]" 2
19 1 14 LYS O 1 18 ILE N 3.000 2.700 3.300 2.816 2.738 2.917 . 0 0 "[ . 1 . 2 . 3 ]" 2
20 1 14 LYS O 1 18 ILE H 2.000 . 2.300 1.883 1.793 1.990 . 0 0 "[ . 1 . 2 . 3 ]" 2
21 1 15 LYS O 1 19 GLN N 3.000 2.700 3.300 3.017 2.824 3.199 . 0 0 "[ . 1 . 2 . 3 ]" 2
22 1 15 LYS O 1 19 GLN H 2.000 . 2.300 2.068 1.852 2.266 . 0 0 "[ . 1 . 2 . 3 ]" 2
23 1 16 GLU O 1 20 LEU N 3.000 2.700 3.300 3.216 3.058 3.342 0.042 30 0 "[ . 1 . 2 . 3 ]" 2
24 1 16 GLU O 1 20 LEU H 2.000 . 2.300 2.383 2.177 2.557 0.257 17 0 "[ . 1 . 2 . 3 ]" 2
25 1 17 LEU O 1 21 VAL N 3.000 2.700 3.300 2.845 2.745 2.933 . 0 0 "[ . 1 . 2 . 3 ]" 2
26 1 17 LEU O 1 21 VAL H 2.000 . 2.300 1.887 1.764 1.990 . 0 0 "[ . 1 . 2 . 3 ]" 2
27 1 18 ILE O 1 22 ALA N 3.000 2.700 3.300 2.763 2.693 2.887 0.007 20 0 "[ . 1 . 2 . 3 ]" 2
28 1 18 ILE O 1 22 ALA H 2.000 . 2.300 1.864 1.779 2.003 . 0 0 "[ . 1 . 2 . 3 ]" 2
29 1 19 GLN O 1 23 ARG N 3.000 2.700 3.300 2.942 2.807 3.230 . 0 0 "[ . 1 . 2 . 3 ]" 2
30 1 19 GLN O 1 23 ARG H 2.000 . 2.300 1.997 1.854 2.296 . 0 0 "[ . 1 . 2 . 3 ]" 2
31 1 28 HIS O 1 32 LEU N 3.000 2.700 3.300 3.026 2.784 3.356 0.056 31 0 "[ . 1 . 2 . 3 ]" 2
32 1 28 HIS O 1 32 LEU H 2.000 . 2.300 2.092 1.827 2.433 0.133 31 0 "[ . 1 . 2 . 3 ]" 2
33 1 29 ASP O 1 33 LEU N 3.000 2.700 3.300 2.886 2.767 3.088 . 0 0 "[ . 1 . 2 . 3 ]" 2
34 1 29 ASP O 1 33 LEU H 2.000 . 2.300 1.920 1.790 2.147 . 0 0 "[ . 1 . 2 . 3 ]" 2
35 1 30 LYS O 1 34 PHE N 3.000 2.700 3.300 2.772 2.696 2.879 0.004 20 0 "[ . 1 . 2 . 3 ]" 2
36 1 30 LYS O 1 34 PHE H 2.000 . 2.300 1.822 1.747 1.940 . 0 0 "[ . 1 . 2 . 3 ]" 2
37 1 31 VAL O 1 35 SER N 3.000 2.700 3.300 2.851 2.762 2.967 . 0 0 "[ . 1 . 2 . 3 ]" 2
38 1 31 VAL O 1 35 SER H 2.000 . 2.300 1.897 1.802 2.017 . 0 0 "[ . 1 . 2 . 3 ]" 2
39 1 32 LEU O 1 36 ARG N 3.000 2.700 3.300 3.060 2.820 3.311 0.011 24 0 "[ . 1 . 2 . 3 ]" 2
40 1 32 LEU O 1 36 ARG H 2.000 . 2.300 2.124 1.900 2.363 0.063 10 0 "[ . 1 . 2 . 3 ]" 2
41 1 33 LEU O 1 37 ASP N 3.000 2.700 3.300 3.028 2.843 3.204 . 0 0 "[ . 1 . 2 . 3 ]" 2
42 1 33 LEU O 1 37 ASP H 2.000 . 2.300 2.103 1.875 2.286 . 0 0 "[ . 1 . 2 . 3 ]" 2
43 1 34 PHE O 1 38 LEU N 3.000 2.700 3.300 2.796 2.707 2.902 . 0 0 "[ . 1 . 2 . 3 ]" 2
44 1 34 PHE O 1 38 LEU H 2.000 . 2.300 1.849 1.748 1.990 . 0 0 "[ . 1 . 2 . 3 ]" 2
45 1 35 SER O 1 39 ASP N 3.000 2.700 3.300 2.887 2.733 3.116 . 0 0 "[ . 1 . 2 . 3 ]" 2
46 1 35 SER O 1 39 ASP H 2.000 . 2.300 1.986 1.792 2.269 . 0 0 "[ . 1 . 2 . 3 ]" 2
47 1 36 ARG O 1 40 LYS N 3.000 2.700 3.300 3.090 2.875 3.349 0.049 26 0 "[ . 1 . 2 . 3 ]" 2
48 1 36 ARG O 1 40 LYS H 2.000 . 2.300 2.165 1.918 2.522 0.222 17 0 "[ . 1 . 2 . 3 ]" 2
49 1 37 ASP O 1 41 LEU N 3.000 2.700 3.300 2.898 2.744 3.336 0.036 16 0 "[ . 1 . 2 . 3 ]" 2
50 1 37 ASP O 1 41 LEU H 2.000 . 2.300 2.009 1.839 2.561 0.261 16 0 "[ . 1 . 2 . 3 ]" 2
51 1 38 LEU O 1 42 ILE N 3.000 2.700 3.300 2.951 2.855 3.087 . 0 0 "[ . 1 . 2 . 3 ]" 2
52 1 38 LEU O 1 42 ILE H 2.000 . 2.300 2.034 1.898 2.240 . 0 0 "[ . 1 . 2 . 3 ]" 2
53 1 39 ASP O 1 43 ASN N 3.000 2.700 3.300 2.913 2.716 3.225 . 0 0 "[ . 1 . 2 . 3 ]" 2
54 1 39 ASP O 1 43 ASN H 2.000 . 2.300 1.939 1.750 2.246 . 0 0 "[ . 1 . 2 . 3 ]" 2
55 1 40 LYS O 1 44 LYS N 3.000 2.700 3.300 2.881 2.711 3.224 . 0 0 "[ . 1 . 2 . 3 ]" 2
56 1 40 LYS O 1 44 LYS H 2.000 . 2.300 2.024 1.866 2.372 0.072 3 0 "[ . 1 . 2 . 3 ]" 2
57 2 5 GLN O 2 9 LYS N 3.000 2.700 3.300 2.984 2.763 3.313 0.013 13 0 "[ . 1 . 2 . 3 ]" 2
58 2 5 GLN O 2 9 LYS H 2.000 . 2.300 2.100 1.846 2.442 0.142 13 0 "[ . 1 . 2 . 3 ]" 2
59 2 6 LEU O 2 10 ILE N 3.000 2.700 3.300 2.947 2.821 3.128 . 0 0 "[ . 1 . 2 . 3 ]" 2
60 2 6 LEU O 2 10 ILE H 2.000 . 2.300 2.015 1.854 2.203 . 0 0 "[ . 1 . 2 . 3 ]" 2
61 2 7 LYS O 2 11 GLU N 3.000 2.700 3.300 2.831 2.694 3.062 0.006 9 0 "[ . 1 . 2 . 3 ]" 2
62 2 7 LYS O 2 11 GLU H 2.000 . 2.300 1.866 1.730 2.080 . 0 0 "[ . 1 . 2 . 3 ]" 2
63 2 8 ASN O 2 12 ASN N 3.000 2.700 3.300 2.898 2.746 3.234 . 0 0 "[ . 1 . 2 . 3 ]" 2
64 2 8 ASN O 2 12 ASN H 2.000 . 2.300 1.946 1.790 2.264 . 0 0 "[ . 1 . 2 . 3 ]" 2
65 2 9 LYS O 2 13 LYS N 3.000 2.700 3.300 2.789 2.691 2.868 0.009 18 0 "[ . 1 . 2 . 3 ]" 2
66 2 9 LYS O 2 13 LYS H 2.000 . 2.300 1.850 1.769 1.945 . 0 0 "[ . 1 . 2 . 3 ]" 2
67 2 10 ILE O 2 14 LYS N 3.000 2.700 3.300 2.844 2.711 2.976 . 0 0 "[ . 1 . 2 . 3 ]" 2
68 2 10 ILE O 2 14 LYS H 2.000 . 2.300 1.888 1.746 2.043 . 0 0 "[ . 1 . 2 . 3 ]" 2
69 2 11 GLU O 2 15 LYS N 3.000 2.700 3.300 2.850 2.721 3.047 . 0 0 "[ . 1 . 2 . 3 ]" 2
70 2 11 GLU O 2 15 LYS H 2.000 . 2.300 1.912 1.766 2.105 . 0 0 "[ . 1 . 2 . 3 ]" 2
71 2 12 ASN O 2 16 GLU N 3.000 2.700 3.300 2.831 2.721 3.012 . 0 0 "[ . 1 . 2 . 3 ]" 2
72 2 12 ASN O 2 16 GLU H 2.000 . 2.300 1.911 1.774 2.104 . 0 0 "[ . 1 . 2 . 3 ]" 2
73 2 13 LYS O 2 17 LEU N 3.000 2.700 3.300 2.949 2.847 3.099 . 0 0 "[ . 1 . 2 . 3 ]" 2
74 2 13 LYS O 2 17 LEU H 2.000 . 2.300 2.054 1.946 2.224 . 0 0 "[ . 1 . 2 . 3 ]" 2
75 2 14 LYS O 2 18 ILE N 3.000 2.700 3.300 2.816 2.707 2.978 . 0 0 "[ . 1 . 2 . 3 ]" 2
76 2 14 LYS O 2 18 ILE H 2.000 . 2.300 1.881 1.757 2.045 . 0 0 "[ . 1 . 2 . 3 ]" 2
77 2 15 LYS O 2 19 GLN N 3.000 2.700 3.300 3.042 2.828 3.268 . 0 0 "[ . 1 . 2 . 3 ]" 2
78 2 15 LYS O 2 19 GLN H 2.000 . 2.300 2.093 1.863 2.340 0.040 15 0 "[ . 1 . 2 . 3 ]" 2
79 2 16 GLU O 2 20 LEU N 3.000 2.700 3.300 3.255 3.079 3.372 0.072 25 0 "[ . 1 . 2 . 3 ]" 2
80 2 16 GLU O 2 20 LEU H 2.000 . 2.300 2.462 2.196 2.616 0.316 26 0 "[ . 1 . 2 . 3 ]" 2
81 2 17 LEU O 2 21 VAL N 3.000 2.700 3.300 2.868 2.747 2.988 . 0 0 "[ . 1 . 2 . 3 ]" 2
82 2 17 LEU O 2 21 VAL H 2.000 . 2.300 1.913 1.772 2.065 . 0 0 "[ . 1 . 2 . 3 ]" 2
83 2 18 ILE O 2 22 ALA N 3.000 2.700 3.300 2.780 2.693 2.903 0.007 1 0 "[ . 1 . 2 . 3 ]" 2
84 2 18 ILE O 2 22 ALA H 2.000 . 2.300 1.890 1.774 2.053 . 0 0 "[ . 1 . 2 . 3 ]" 2
85 2 19 GLN O 2 23 ARG N 3.000 2.700 3.300 2.985 2.764 3.320 0.020 30 0 "[ . 1 . 2 . 3 ]" 2
86 2 19 GLN O 2 23 ARG H 2.000 . 2.300 2.075 1.871 2.464 0.164 30 0 "[ . 1 . 2 . 3 ]" 2
87 2 28 HIS O 2 32 LEU N 3.000 2.700 3.300 3.047 2.851 3.322 0.022 4 0 "[ . 1 . 2 . 3 ]" 2
88 2 28 HIS O 2 32 LEU H 2.000 . 2.300 2.117 1.914 2.427 0.127 4 0 "[ . 1 . 2 . 3 ]" 2
89 2 29 ASP O 2 33 LEU N 3.000 2.700 3.300 2.851 2.714 2.958 . 0 0 "[ . 1 . 2 . 3 ]" 2
90 2 29 ASP O 2 33 LEU H 2.000 . 2.300 1.882 1.745 2.013 . 0 0 "[ . 1 . 2 . 3 ]" 2
91 2 30 LYS O 2 34 PHE N 3.000 2.700 3.300 2.803 2.723 2.928 . 0 0 "[ . 1 . 2 . 3 ]" 2
92 2 30 LYS O 2 34 PHE H 2.000 . 2.300 1.866 1.784 2.026 . 0 0 "[ . 1 . 2 . 3 ]" 2
93 2 31 VAL O 2 35 SER N 3.000 2.700 3.300 2.837 2.720 2.969 . 0 0 "[ . 1 . 2 . 3 ]" 2
94 2 31 VAL O 2 35 SER H 2.000 . 2.300 1.881 1.756 2.025 . 0 0 "[ . 1 . 2 . 3 ]" 2
95 2 32 LEU O 2 36 ARG N 3.000 2.700 3.300 3.121 2.924 3.308 0.008 11 0 "[ . 1 . 2 . 3 ]" 2
96 2 32 LEU O 2 36 ARG H 2.000 . 2.300 2.185 1.962 2.397 0.097 11 0 "[ . 1 . 2 . 3 ]" 2
97 2 33 LEU O 2 37 ASP N 3.000 2.700 3.300 3.054 2.825 3.216 . 0 0 "[ . 1 . 2 . 3 ]" 2
98 2 33 LEU O 2 37 ASP H 2.000 . 2.300 2.145 1.861 2.322 0.022 28 0 "[ . 1 . 2 . 3 ]" 2
99 2 34 PHE O 2 38 LEU N 3.000 2.700 3.300 2.793 2.699 2.957 0.001 32 0 "[ . 1 . 2 . 3 ]" 2
100 2 34 PHE O 2 38 LEU H 2.000 . 2.300 1.846 1.755 1.996 . 0 0 "[ . 1 . 2 . 3 ]" 2
101 2 35 SER O 2 39 ASP N 3.000 2.700 3.300 2.895 2.780 3.235 . 0 0 "[ . 1 . 2 . 3 ]" 2
102 2 35 SER O 2 39 ASP H 2.000 . 2.300 2.008 1.858 2.348 0.048 32 0 "[ . 1 . 2 . 3 ]" 2
103 2 36 ARG O 2 40 LYS N 3.000 2.700 3.300 3.041 2.882 3.312 0.012 29 0 "[ . 1 . 2 . 3 ]" 2
104 2 36 ARG O 2 40 LYS H 2.000 . 2.300 2.116 1.959 2.406 0.106 29 0 "[ . 1 . 2 . 3 ]" 2
105 2 37 ASP O 2 41 LEU N 3.000 2.700 3.300 2.943 2.704 3.313 0.013 29 0 "[ . 1 . 2 . 3 ]" 2
106 2 37 ASP O 2 41 LEU H 2.000 . 2.300 2.047 1.794 2.444 0.144 11 0 "[ . 1 . 2 . 3 ]" 2
107 2 38 LEU O 2 42 ILE N 3.000 2.700 3.300 2.940 2.801 3.144 . 0 0 "[ . 1 . 2 . 3 ]" 2
108 2 38 LEU O 2 42 ILE H 2.000 . 2.300 2.018 1.843 2.258 . 0 0 "[ . 1 . 2 . 3 ]" 2
109 2 39 ASP O 2 43 ASN N 3.000 2.700 3.300 2.879 2.747 3.104 . 0 0 "[ . 1 . 2 . 3 ]" 2
110 2 39 ASP O 2 43 ASN H 2.000 . 2.300 1.905 1.769 2.131 . 0 0 "[ . 1 . 2 . 3 ]" 2
111 2 40 LYS O 2 44 LYS N 3.000 2.700 3.300 2.853 2.690 3.063 0.010 18 0 "[ . 1 . 2 . 3 ]" 2
112 2 40 LYS O 2 44 LYS H 2.000 . 2.300 1.977 1.810 2.236 . 0 0 "[ . 1 . 2 . 3 ]" 2
stop_
save_
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